NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
457898 | 2w9u | 16150 | cing | 4-filtered-FRED | STAR | entry | full | 531 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2w9u # This FRED archive file contains, for PDB entry <2w9u>: # # - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. 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_2w9u _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2w9u _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4873.51 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 $SHORT_DISINTEGRIN_JERDOSTATIN A . 1 1 stop_ save_ save_SHORT_DISINTEGRIN_JERDOSTATIN _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "SHORT DISINTEGRIN JERDOSTATIN" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code AMDCTTGPCCRQCKLKPAGTTCWKTSVSSHYCTGRSCECPSYPGNG _Entity.Number_of_monomers 46 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 ALA . 1 1 2 MET . 1 1 3 ASP . 1 1 4 CYS . 1 1 5 THR . 1 1 6 THR . 1 1 7 GLY . 1 1 8 PRO . 1 1 9 CYS . 1 1 10 CYS . 1 1 11 ARG . 1 1 12 GLN . 1 1 13 CYS . 1 1 14 LYS . 1 1 15 LEU . 1 1 16 LYS . 1 1 17 PRO . 1 1 18 ALA . 1 1 19 GLY . 1 1 20 THR . 1 1 21 THR . 1 1 22 CYS . 1 1 23 TRP . 1 1 24 LYS . 1 1 25 THR . 1 1 26 SER . 1 1 27 VAL . 1 1 28 SER . 1 1 29 SER . 1 1 30 HIS . 1 1 31 TYR . 1 1 32 CYS . 1 1 33 THR . 1 1 34 GLY . 1 1 35 ARG . 1 1 36 SER . 1 1 37 CYS . 1 1 38 GLU . 1 1 39 CYS . 1 1 40 PRO . 1 1 41 SER . 1 1 42 TYR . 1 1 43 PRO . 1 1 44 GLY . 1 1 45 ASN . 1 1 46 GLY . 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 ALA 1 1 1 1 MET 2 2 1 1 ASP 3 3 1 1 CYS 4 4 1 1 THR 5 5 1 1 THR 6 6 1 1 GLY 7 7 1 1 PRO 8 8 1 1 CYS 9 9 1 1 CYS 10 10 1 1 ARG 11 11 1 1 GLN 12 12 1 1 CYS 13 13 1 1 LYS 14 14 1 1 LEU 15 15 1 1 LYS 16 16 1 1 PRO 17 17 1 1 ALA 18 18 1 1 GLY 19 19 1 1 THR 20 20 1 1 THR 21 21 1 1 CYS 22 22 1 1 TRP 23 23 1 1 LYS 24 24 1 1 THR 25 25 1 1 SER 26 26 1 1 VAL 27 27 1 1 SER 28 28 1 1 SER 29 29 1 1 HIS 30 30 1 1 TYR 31 31 1 1 CYS 32 32 1 1 THR 33 33 1 1 GLY 34 34 1 1 ARG 35 35 1 1 SER 36 36 1 1 CYS 37 37 1 1 GLU 38 38 1 1 CYS 39 39 1 1 PRO 40 40 1 1 SER 41 41 1 1 TYR 42 42 1 1 PRO 43 43 1 1 GLY 44 44 1 1 ASN 45 45 1 1 GLY 46 46 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_2 _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 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 ALA HA . 1 . HA 1 1 1 1 2 1 1 2 MET H . 2 . HN 1 1 2 1 1 1 1 1 ALA MB . 1 . HB# 1 1 2 1 2 1 1 2 MET H . 2 . HN 1 1 3 1 1 1 1 2 MET HA . 2 . HA 1 1 3 1 2 1 1 3 ASP H . 3 . HN 1 1 4 1 1 1 1 2 MET QB . 2 . HB# 1 1 4 1 2 1 1 3 ASP H . 3 . HN 1 1 5 1 1 1 1 3 ASP H . 3 . HN 1 1 5 1 2 1 1 4 CYS H . 4 . HN 1 1 6 1 1 1 1 3 ASP HA . 3 . HA 1 1 6 1 2 1 1 4 CYS H . 4 . HN 1 1 7 1 1 1 1 3 ASP QB . 3 . HB# 1 1 7 1 2 1 1 4 CYS H . 4 . HN 1 1 8 1 1 1 1 3 ASP HA . 3 . HA 1 1 8 1 2 1 1 4 CYS QB . 4 . HB# 1 1 9 1 1 1 1 4 CYS HA . 4 . HA 1 1 9 1 2 1 1 5 THR H . 5 . HN 1 1 10 1 1 1 1 4 CYS QB . 4 . HB# 1 1 10 1 2 1 1 5 THR H . 5 . HN 1 1 11 1 1 1 1 4 CYS QB . 4 . HB# 1 1 11 1 2 1 1 5 THR HA . 5 . HA 1 1 12 1 1 1 1 4 CYS QB . 4 . HB# 1 1 12 1 2 1 1 5 THR HB . 5 . HB 1 1 13 1 1 1 1 4 CYS QB . 4 . HB# 1 1 13 1 2 1 1 6 THR MG . 6 . HG2# 1 1 14 1 1 1 1 4 CYS HA . 4 . HA 1 1 14 1 2 1 1 13 CYS H . 13 . HN 1 1 15 1 1 1 1 4 CYS HA . 4 . HA 1 1 15 1 2 1 1 13 CYS HA . 13 . HA 1 1 16 1 1 1 1 4 CYS QB . 4 . HB# 1 1 16 1 2 1 1 13 CYS H . 13 . HN 1 1 17 1 1 1 1 5 THR HA . 5 . HA 1 1 17 1 2 1 1 6 THR H . 6 . HN 1 1 18 1 1 1 1 5 THR HB . 5 . HB 1 1 18 1 2 1 1 6 THR H . 6 . HN 1 1 19 1 1 1 1 5 THR MG . 5 . HG2# 1 1 19 1 2 1 1 6 THR H . 6 . HN 1 1 20 1 1 1 1 5 THR H . 5 . HN 1 1 20 1 2 1 1 13 CYS HA . 13 . HA 1 1 21 1 1 1 1 5 THR HA . 5 . HA 1 1 21 1 2 1 1 37 CYS H . 37 . HN 1 1 22 1 1 1 1 5 THR MG . 5 . HG2# 1 1 22 1 2 1 1 37 CYS H . 37 . HN 1 1 23 1 1 1 1 5 THR MG . 5 . HG2# 1 1 23 1 2 1 1 37 CYS QB . 37 . HB# 1 1 24 1 1 1 1 6 THR HA . 6 . HA 1 1 24 1 2 1 1 7 GLY H . 7 . HN 1 1 25 1 1 1 1 6 THR HB . 6 . HB 1 1 25 1 2 1 1 7 GLY H . 7 . HN 1 1 26 1 1 1 1 6 THR MG . 6 . HG2# 1 1 26 1 2 1 1 7 GLY H . 7 . HN 1 1 27 1 1 1 1 6 THR MG . 6 . HG2# 1 1 27 1 2 1 1 7 GLY QA . 7 . HA# 1 1 28 1 1 1 1 6 THR HA . 6 . HA 1 1 28 1 2 1 1 10 CYS QB . 10 . HB# 1 1 29 1 1 1 1 6 THR MG . 6 . HG2# 1 1 29 1 2 1 1 12 GLN HA . 12 . HA 1 1 30 1 1 1 1 6 THR MG . 6 . HG2# 1 1 30 1 2 1 1 13 CYS H . 13 . HN 1 1 31 1 1 1 1 7 GLY H . 7 . HN 1 1 31 1 2 1 1 8 PRO QD . 8 . HD# 1 1 32 1 1 1 1 7 GLY QA . 7 . HA# 1 1 32 1 2 1 1 8 PRO QG . 8 . HG# 1 1 33 1 1 1 1 7 GLY QA . 7 . HA# 1 1 33 1 2 1 1 8 PRO QD . 8 . HD# 1 1 34 1 1 1 1 7 GLY H . 7 . HN 1 1 34 1 2 1 1 10 CYS QB . 10 . HB# 1 1 35 1 1 1 1 7 GLY QA . 7 . HA# 1 1 35 1 2 1 1 10 CYS QB . 10 . HB# 1 1 36 1 1 1 1 7 GLY H . 7 . HN 1 1 36 1 2 1 1 37 CYS QB . 37 . HB# 1 1 37 1 1 1 1 7 GLY QA . 7 . HA# 1 1 37 1 2 1 1 37 CYS QB . 37 . HB# 1 1 38 1 1 1 1 8 PRO HA . 8 . HA 1 1 38 1 2 1 1 9 CYS H . 9 . HN 1 1 39 1 1 1 1 8 PRO QB . 8 . HB# 1 1 39 1 2 1 1 9 CYS H . 9 . HN 1 1 40 1 1 1 1 8 PRO QG . 8 . HG# 1 1 40 1 2 1 1 9 CYS H . 9 . HN 1 1 41 1 1 1 1 8 PRO QD . 8 . HD# 1 1 41 1 2 1 1 9 CYS H . 9 . HN 1 1 42 1 1 1 1 8 PRO QB . 8 . HB# 1 1 42 1 2 1 1 10 CYS H . 10 . HN 1 1 43 1 1 1 1 8 PRO HA . 8 . HA 1 1 43 1 2 1 1 22 CYS QB . 22 . HB# 1 1 44 1 1 1 1 8 PRO QB . 8 . HB# 1 1 44 1 2 1 1 22 CYS HA . 22 . HA 1 1 45 1 1 1 1 8 PRO QB . 8 . HB# 1 1 45 1 2 1 1 22 CYS QB . 22 . HB# 1 1 46 1 1 1 1 8 PRO QG . 8 . HG# 1 1 46 1 2 1 1 22 CYS QB . 22 . HB# 1 1 47 1 1 1 1 8 PRO QG . 8 . HG# 1 1 47 1 2 1 1 23 TRP HE1 . 23 . HE1 1 1 48 1 1 1 1 8 PRO QG . 8 . HG# 1 1 48 1 2 1 1 23 TRP HZ2 . 23 . HZ2 1 1 49 1 1 1 1 8 PRO QD . 8 . HD# 1 1 49 1 2 1 1 37 CYS QB . 37 . HB# 1 1 50 1 1 1 1 8 PRO QD . 8 . HD# 1 1 50 1 2 1 1 38 GLU HA . 38 . HA 1 1 51 1 1 1 1 8 PRO QG . 8 . HG# 1 1 51 1 2 1 1 39 CYS H . 39 . HN 1 1 52 1 1 1 1 8 PRO QD . 8 . HD# 1 1 52 1 2 1 1 39 CYS H . 39 . HN 1 1 53 1 1 1 1 8 PRO QG . 8 . HG# 1 1 53 1 2 1 1 39 CYS HA . 39 . HA 1 1 54 1 1 1 1 8 PRO QB . 8 . HB# 1 1 54 1 2 1 1 39 CYS QB . 39 . HB# 1 1 55 1 1 1 1 8 PRO QG . 8 . HG# 1 1 55 1 2 1 1 39 CYS QB . 39 . HB# 1 1 56 1 1 1 1 9 CYS H . 9 . HN 1 1 56 1 2 1 1 10 CYS H . 10 . HN 1 1 57 1 1 1 1 9 CYS HA . 9 . HA 1 1 57 1 2 1 1 10 CYS H . 10 . HN 1 1 58 1 1 1 1 9 CYS QB . 9 . HB# 1 1 58 1 2 1 1 10 CYS H . 10 . HN 1 1 59 1 1 1 1 9 CYS QB . 9 . HB# 1 1 59 1 2 1 1 15 LEU QD . 15 . HD# 1 1 60 1 1 1 1 9 CYS QB . 9 . HB# 1 1 60 1 2 1 1 16 LYS H . 16 . HN 1 1 61 1 1 1 1 9 CYS HA . 9 . HA 1 1 61 1 2 1 1 16 LYS QG . 16 . HG# 1 1 62 1 1 1 1 9 CYS HA . 9 . HA 1 1 62 1 2 1 1 16 LYS QD . 16 . HD# 1 1 63 1 1 1 1 9 CYS HA . 9 . HA 1 1 63 1 2 1 1 16 LYS QE . 16 . HE# 1 1 64 1 1 1 1 9 CYS QB . 9 . HB# 1 1 64 1 2 1 1 32 CYS HA . 32 . HA 1 1 65 1 1 1 1 9 CYS H . 9 . HN 1 1 65 1 2 1 1 37 CYS HA . 37 . HA 1 1 66 1 1 1 1 9 CYS H . 9 . HN 1 1 66 1 2 1 1 37 CYS QB . 37 . HB# 1 1 67 1 1 1 1 9 CYS QB . 9 . HB# 1 1 67 1 2 1 1 37 CYS H . 37 . HN 1 1 68 1 1 1 1 9 CYS QB . 9 . HB# 1 1 68 1 2 1 1 37 CYS HA . 37 . HA 1 1 69 1 1 1 1 9 CYS H . 9 . HN 1 1 69 1 2 1 1 38 GLU HA . 38 . HA 1 1 70 1 1 1 1 9 CYS QB . 9 . HB# 1 1 70 1 2 1 1 38 GLU H . 38 . HN 1 1 71 1 1 1 1 9 CYS QB . 9 . HB# 1 1 71 1 2 1 1 38 GLU HA . 38 . HA 1 1 72 1 1 1 1 9 CYS H . 9 . HN 1 1 72 1 2 1 1 39 CYS H . 39 . HN 1 1 73 1 1 1 1 9 CYS QB . 9 . HB# 1 1 73 1 2 1 1 39 CYS HA . 39 . HA 1 1 74 1 1 1 1 10 CYS H . 10 . HN 1 1 74 1 2 1 1 11 ARG H . 11 . HN 1 1 75 1 1 1 1 10 CYS HA . 10 . HA 1 1 75 1 2 1 1 11 ARG H . 11 . HN 1 1 76 1 1 1 1 10 CYS QB . 10 . HB# 1 1 76 1 2 1 1 11 ARG H . 11 . HN 1 1 77 1 1 1 1 10 CYS QB . 10 . HB# 1 1 77 1 2 1 1 13 CYS H . 13 . HN 1 1 78 1 1 1 1 10 CYS HA . 10 . HA 1 1 78 1 2 1 1 14 LYS H . 14 . HN 1 1 79 1 1 1 1 10 CYS QB . 10 . HB# 1 1 79 1 2 1 1 14 LYS H . 14 . HN 1 1 80 1 1 1 1 10 CYS H . 10 . HN 1 1 80 1 2 1 1 15 LEU QD . 15 . HD# 1 1 81 1 1 1 1 10 CYS HA . 10 . HA 1 1 81 1 2 1 1 15 LEU H . 15 . HN 1 1 82 1 1 1 1 10 CYS HA . 10 . HA 1 1 82 1 2 1 1 15 LEU HA . 15 . HA 1 1 83 1 1 1 1 10 CYS HA . 10 . HA 1 1 83 1 2 1 1 15 LEU QB . 15 . HB# 1 1 84 1 1 1 1 10 CYS HA . 10 . HA 1 1 84 1 2 1 1 15 LEU QD . 15 . HD# 1 1 85 1 1 1 1 10 CYS QB . 10 . HB# 1 1 85 1 2 1 1 15 LEU HA . 15 . HA 1 1 86 1 1 1 1 10 CYS QB . 10 . HB# 1 1 86 1 2 1 1 15 LEU QB . 15 . HB# 1 1 87 1 1 1 1 10 CYS QB . 10 . HB# 1 1 87 1 2 1 1 15 LEU QD . 15 . HD# 1 1 88 1 1 1 1 10 CYS H . 10 . HN 1 1 88 1 2 1 1 16 LYS QG . 16 . HG# 1 1 89 1 1 1 1 10 CYS H . 10 . HN 1 1 89 1 2 1 1 16 LYS QD . 16 . HD# 1 1 90 1 1 1 1 10 CYS H . 10 . HN 1 1 90 1 2 1 1 16 LYS QE . 16 . HE# 1 1 91 1 1 1 1 10 CYS HA . 10 . HA 1 1 91 1 2 1 1 16 LYS H . 16 . HN 1 1 92 1 1 1 1 10 CYS HA . 10 . HA 1 1 92 1 2 1 1 16 LYS HA . 16 . HA 1 1 93 1 1 1 1 10 CYS HA . 10 . HA 1 1 93 1 2 1 1 16 LYS QG . 16 . HG# 1 1 94 1 1 1 1 10 CYS HA . 10 . HA 1 1 94 1 2 1 1 16 LYS QD . 16 . HD# 1 1 95 1 1 1 1 10 CYS HA . 10 . HA 1 1 95 1 2 1 1 16 LYS QE . 16 . HE# 1 1 96 1 1 1 1 10 CYS QB . 10 . HB# 1 1 96 1 2 1 1 16 LYS H . 16 . HN 1 1 97 1 1 1 1 10 CYS QB . 10 . HB# 1 1 97 1 2 1 1 16 LYS QG . 16 . HG# 1 1 98 1 1 1 1 10 CYS H . 10 . HN 1 1 98 1 2 1 1 37 CYS HA . 37 . HA 1 1 99 1 1 1 1 10 CYS H . 10 . HN 1 1 99 1 2 1 1 37 CYS QB . 37 . HB# 1 1 100 1 1 1 1 10 CYS QB . 10 . HB# 1 1 100 1 2 1 1 37 CYS H . 37 . HN 1 1 101 1 1 1 1 10 CYS QB . 10 . HB# 1 1 101 1 2 1 1 37 CYS HA . 37 . HA 1 1 102 1 1 1 1 10 CYS QB . 10 . HB# 1 1 102 1 2 1 1 37 CYS QB . 37 . HB# 1 1 103 1 1 1 1 11 ARG H . 11 . HN 1 1 103 1 2 1 1 11 ARG QG . 11 . HG# 1 1 104 1 1 1 1 11 ARG H . 11 . HN 1 1 104 1 2 1 1 11 ARG QD . 11 . HD# 1 1 105 1 1 1 1 11 ARG H . 11 . HN 1 1 105 1 2 1 1 12 GLN H . 12 . HN 1 1 106 1 1 1 1 11 ARG HA . 11 . HA 1 1 106 1 2 1 1 12 GLN H . 12 . HN 1 1 107 1 1 1 1 11 ARG QB . 11 . HB# 1 1 107 1 2 1 1 12 GLN H . 12 . HN 1 1 108 1 1 1 1 11 ARG QG . 11 . HG# 1 1 108 1 2 1 1 12 GLN H . 12 . HN 1 1 109 1 1 1 1 11 ARG QG . 11 . HG# 1 1 109 1 2 1 1 12 GLN QG . 12 . HG# 1 1 110 1 1 1 1 11 ARG HA . 11 . HA 1 1 110 1 2 1 1 13 CYS H . 13 . HN 1 1 111 1 1 1 1 11 ARG H . 11 . HN 1 1 111 1 2 1 1 14 LYS H . 14 . HN 1 1 112 1 1 1 1 11 ARG H . 11 . HN 1 1 112 1 2 1 1 15 LEU HA . 15 . HA 1 1 113 1 1 1 1 11 ARG H . 11 . HN 1 1 113 1 2 1 1 15 LEU QD . 15 . HD# 1 1 114 1 1 1 1 11 ARG H . 11 . HN 1 1 114 1 2 1 1 16 LYS H . 16 . HN 1 1 115 1 1 1 1 11 ARG H . 11 . HN 1 1 115 1 2 1 1 16 LYS QG . 16 . HG# 1 1 116 1 1 1 1 11 ARG H . 11 . HN 1 1 116 1 2 1 1 16 LYS QE . 16 . HE# 1 1 117 1 1 1 1 11 ARG QB . 11 . HB# 1 1 117 1 2 1 1 16 LYS QE . 16 . HE# 1 1 118 1 1 1 1 11 ARG QD . 11 . HD# 1 1 118 1 2 1 1 16 LYS QG . 16 . HG# 1 1 119 1 1 1 1 12 GLN H . 12 . HN 1 1 119 1 2 1 1 12 GLN QG . 12 . HG# 1 1 120 1 1 1 1 12 GLN H . 12 . HN 1 1 120 1 2 1 1 13 CYS H . 13 . HN 1 1 121 1 1 1 1 12 GLN HA . 12 . HA 1 1 121 1 2 1 1 13 CYS H . 13 . HN 1 1 122 1 1 1 1 12 GLN QB . 12 . HB# 1 1 122 1 2 1 1 13 CYS H . 13 . HN 1 1 123 1 1 1 1 12 GLN QG . 12 . HG# 1 1 123 1 2 1 1 13 CYS H . 13 . HN 1 1 124 1 1 1 1 12 GLN HA . 12 . HA 1 1 124 1 2 1 1 14 LYS H . 14 . HN 1 1 125 1 1 1 1 12 GLN QB . 12 . HB# 1 1 125 1 2 1 1 14 LYS H . 14 . HN 1 1 126 1 1 1 1 13 CYS H . 13 . HN 1 1 126 1 2 1 1 14 LYS H . 14 . HN 1 1 127 1 1 1 1 13 CYS HA . 13 . HA 1 1 127 1 2 1 1 14 LYS H . 14 . HN 1 1 128 1 1 1 1 13 CYS QB . 13 . HB# 1 1 128 1 2 1 1 14 LYS H . 14 . HN 1 1 129 1 1 1 1 14 LYS H . 14 . HN 1 1 129 1 2 1 1 14 LYS QG . 14 . HG# 1 1 130 1 1 1 1 14 LYS H . 14 . HN 1 1 130 1 2 1 1 14 LYS QD . 14 . HD# 1 1 131 1 1 1 1 14 LYS H . 14 . HN 1 1 131 1 2 1 1 15 LEU HA . 15 . HA 1 1 132 1 1 1 1 14 LYS H . 14 . HN 1 1 132 1 2 1 1 15 LEU H . 15 . HN 1 1 133 1 1 1 1 14 LYS HA . 14 . HA 1 1 133 1 2 1 1 15 LEU H . 15 . HN 1 1 134 1 1 1 1 14 LYS QB . 14 . HB# 1 1 134 1 2 1 1 15 LEU H . 15 . HN 1 1 135 1 1 1 1 14 LYS QG . 14 . HG# 1 1 135 1 2 1 1 15 LEU H . 15 . HN 1 1 136 1 1 1 1 14 LYS H . 14 . HN 1 1 136 1 2 1 1 16 LYS HA . 16 . HA 1 1 137 1 1 1 1 15 LEU H . 15 . HN 1 1 137 1 2 1 1 15 LEU HG . 15 . HG 1 1 138 1 1 1 1 15 LEU H . 15 . HN 1 1 138 1 2 1 1 15 LEU QD . 15 . HD# 1 1 139 1 1 1 1 15 LEU HA . 15 . HA 1 1 139 1 2 1 1 16 LYS H . 16 . HN 1 1 140 1 1 1 1 15 LEU HA . 15 . HA 1 1 140 1 2 1 1 16 LYS QG . 16 . HG# 1 1 141 1 1 1 1 15 LEU QB . 15 . HB# 1 1 141 1 2 1 1 16 LYS H . 16 . HN 1 1 142 1 1 1 1 15 LEU QD . 15 . HD# 1 1 142 1 2 1 1 16 LYS H . 16 . HN 1 1 143 1 1 1 1 15 LEU QD . 15 . HD# 1 1 143 1 2 1 1 18 ALA H . 18 . HN 1 1 144 1 1 1 1 15 LEU QD . 15 . HD# 1 1 144 1 2 1 1 33 THR H . 33 . HN 1 1 145 1 1 1 1 15 LEU QD . 15 . HD# 1 1 145 1 2 1 1 34 GLY H . 34 . HN 1 1 146 1 1 1 1 15 LEU QB . 15 . HB# 1 1 146 1 2 1 1 34 GLY H . 34 . HN 1 1 147 1 1 1 1 15 LEU QB . 15 . HB# 1 1 147 1 2 1 1 34 GLY QA . 34 . HA# 1 1 148 1 1 1 1 15 LEU QD . 15 . HD# 1 1 148 1 2 1 1 34 GLY QA . 34 . HA# 1 1 149 1 1 1 1 15 LEU QB . 15 . HB# 1 1 149 1 2 1 1 35 ARG H . 35 . HN 1 1 150 1 1 1 1 15 LEU QD . 15 . HD# 1 1 150 1 2 1 1 35 ARG H . 35 . HN 1 1 151 1 1 1 1 15 LEU QD . 15 . HD# 1 1 151 1 2 1 1 35 ARG HA . 35 . HA 1 1 152 1 1 1 1 15 LEU QB . 15 . HB# 1 1 152 1 2 1 1 36 SER H . 36 . HN 1 1 153 1 1 1 1 15 LEU QD . 15 . HD# 1 1 153 1 2 1 1 36 SER H . 36 . HN 1 1 154 1 1 1 1 15 LEU QD . 15 . HD# 1 1 154 1 2 1 1 36 SER HA . 36 . HA 1 1 155 1 1 1 1 15 LEU QD . 15 . HD# 1 1 155 1 2 1 1 36 SER QB . 36 . HB# 1 1 156 1 1 1 1 15 LEU QB . 15 . HB# 1 1 156 1 2 1 1 37 CYS H . 37 . HN 1 1 157 1 1 1 1 15 LEU QD . 15 . HD# 1 1 157 1 2 1 1 37 CYS H . 37 . HN 1 1 158 1 1 1 1 15 LEU QD . 15 . HD# 1 1 158 1 2 1 1 37 CYS HA . 37 . HA 1 1 159 1 1 1 1 15 LEU QD . 15 . HD# 1 1 159 1 2 1 1 38 GLU H . 38 . HN 1 1 160 1 1 1 1 16 LYS H . 16 . HN 1 1 160 1 2 1 1 16 LYS QG . 16 . HG# 1 1 161 1 1 1 1 16 LYS H . 16 . HN 1 1 161 1 2 1 1 16 LYS QD . 16 . HD# 1 1 162 1 1 1 1 16 LYS H . 16 . HN 1 1 162 1 2 1 1 17 PRO QD . 17 . HD# 1 1 163 1 1 1 1 16 LYS HA . 16 . HA 1 1 163 1 2 1 1 17 PRO QD . 17 . HD# 1 1 164 1 1 1 1 16 LYS QG . 16 . HG# 1 1 164 1 2 1 1 17 PRO QD . 17 . HD# 1 1 165 1 1 1 1 16 LYS HA . 16 . HA 1 1 165 1 2 1 1 20 THR MG . 20 . HG2# 1 1 166 1 1 1 1 16 LYS QB . 16 . HB# 1 1 166 1 2 1 1 20 THR HB . 20 . HB 1 1 167 1 1 1 1 16 LYS QB . 16 . HB# 1 1 167 1 2 1 1 20 THR MG . 20 . HG2# 1 1 168 1 1 1 1 16 LYS QD . 16 . HD# 1 1 168 1 2 1 1 20 THR MG . 20 . HG2# 1 1 169 1 1 1 1 16 LYS QE . 16 . HE# 1 1 169 1 2 1 1 20 THR MG . 20 . HG2# 1 1 170 1 1 1 1 16 LYS QB . 16 . HB# 1 1 170 1 2 1 1 32 CYS QB . 32 . HB# 1 1 171 1 1 1 1 17 PRO HA . 17 . HA 1 1 171 1 2 1 1 18 ALA H . 18 . HN 1 1 172 1 1 1 1 17 PRO QB . 17 . HB# 1 1 172 1 2 1 1 18 ALA H . 18 . HN 1 1 173 1 1 1 1 17 PRO QG . 17 . HG# 1 1 173 1 2 1 1 18 ALA H . 18 . HN 1 1 174 1 1 1 1 17 PRO QD . 17 . HD# 1 1 174 1 2 1 1 18 ALA H . 18 . HN 1 1 175 1 1 1 1 17 PRO HA . 17 . HA 1 1 175 1 2 1 1 18 ALA MB . 18 . HB# 1 1 176 1 1 1 1 17 PRO QB . 17 . HB# 1 1 176 1 2 1 1 18 ALA MB . 18 . HB# 1 1 177 1 1 1 1 17 PRO QB . 17 . HB# 1 1 177 1 2 1 1 19 GLY H . 19 . HN 1 1 178 1 1 1 1 17 PRO QB . 17 . HB# 1 1 178 1 2 1 1 20 THR H . 20 . HN 1 1 179 1 1 1 1 17 PRO QG . 17 . HG# 1 1 179 1 2 1 1 20 THR H . 20 . HN 1 1 180 1 1 1 1 17 PRO QB . 17 . HB# 1 1 180 1 2 1 1 20 THR HA . 20 . HA 1 1 181 1 1 1 1 17 PRO QD . 17 . HD# 1 1 181 1 2 1 1 20 THR MG . 20 . HG2# 1 1 182 1 1 1 1 18 ALA H . 18 . HN 1 1 182 1 2 1 1 19 GLY H . 19 . HN 1 1 183 1 1 1 1 18 ALA HA . 18 . HA 1 1 183 1 2 1 1 19 GLY H . 19 . HN 1 1 184 1 1 1 1 18 ALA MB . 18 . HB# 1 1 184 1 2 1 1 19 GLY H . 19 . HN 1 1 185 1 1 1 1 18 ALA HA . 18 . HA 1 1 185 1 2 1 1 19 GLY QA . 19 . HA# 1 1 186 1 1 1 1 18 ALA MB . 18 . HB# 1 1 186 1 2 1 1 19 GLY QA . 19 . HA# 1 1 187 1 1 1 1 18 ALA H . 18 . HN 1 1 187 1 2 1 1 20 THR H . 20 . HN 1 1 188 1 1 1 1 18 ALA MB . 18 . HB# 1 1 188 1 2 1 1 20 THR H . 20 . HN 1 1 189 1 1 1 1 18 ALA HA . 18 . HA 1 1 189 1 2 1 1 20 THR H . 20 . HN 1 1 190 1 1 1 1 18 ALA HA . 18 . HA 1 1 190 1 2 1 1 31 TYR QB . 31 . HB# 1 1 191 1 1 1 1 18 ALA H . 18 . HN 1 1 191 1 2 1 1 32 CYS QB . 32 . HB# 1 1 192 1 1 1 1 18 ALA HA . 18 . HA 1 1 192 1 2 1 1 32 CYS H . 32 . HN 1 1 193 1 1 1 1 18 ALA H . 18 . HN 1 1 193 1 2 1 1 33 THR H . 33 . HN 1 1 194 1 1 1 1 18 ALA HA . 18 . HA 1 1 194 1 2 1 1 33 THR H . 33 . HN 1 1 195 1 1 1 1 18 ALA HA . 18 . HA 1 1 195 1 2 1 1 33 THR HA . 33 . HA 1 1 196 1 1 1 1 18 ALA HA . 18 . HA 1 1 196 1 2 1 1 33 THR MG . 33 . HG2# 1 1 197 1 1 1 1 18 ALA MB . 18 . HB# 1 1 197 1 2 1 1 33 THR H . 33 . HN 1 1 198 1 1 1 1 18 ALA MB . 18 . HB# 1 1 198 1 2 1 1 33 THR HA . 33 . HA 1 1 199 1 1 1 1 18 ALA H . 18 . HN 1 1 199 1 2 1 1 34 GLY H . 34 . HN 1 1 200 1 1 1 1 18 ALA H . 18 . HN 1 1 200 1 2 1 1 34 GLY QA . 34 . HA# 1 1 201 1 1 1 1 18 ALA HA . 18 . HA 1 1 201 1 2 1 1 34 GLY QA . 34 . HA# 1 1 202 1 1 1 1 18 ALA MB . 18 . HB# 1 1 202 1 2 1 1 34 GLY H . 34 . HN 1 1 203 1 1 1 1 18 ALA MB . 18 . HB# 1 1 203 1 2 1 1 34 GLY QA . 34 . HA# 1 1 204 1 1 1 1 18 ALA H . 18 . HN 1 1 204 1 2 1 1 35 ARG H . 35 . HN 1 1 205 1 1 1 1 18 ALA MB . 18 . HB# 1 1 205 1 2 1 1 35 ARG H . 35 . HN 1 1 206 1 1 1 1 19 GLY H . 19 . HN 1 1 206 1 2 1 1 20 THR H . 20 . HN 1 1 207 1 1 1 1 19 GLY QA . 19 . HA# 1 1 207 1 2 1 1 20 THR H . 20 . HN 1 1 208 1 1 1 1 19 GLY H . 19 . HN 1 1 208 1 2 1 1 31 TYR HA . 31 . HA 1 1 209 1 1 1 1 19 GLY H . 19 . HN 1 1 209 1 2 1 1 31 TYR QB . 31 . HB# 1 1 210 1 1 1 1 19 GLY H . 19 . HN 1 1 210 1 2 1 1 31 TYR QD . 31 . HD# 1 1 211 1 1 1 1 19 GLY H . 19 . HN 1 1 211 1 2 1 1 31 TYR QE . 31 . HE# 1 1 212 1 1 1 1 19 GLY QA . 19 . HA# 1 1 212 1 2 1 1 31 TYR HA . 31 . HA 1 1 213 1 1 1 1 19 GLY QA . 19 . HA# 1 1 213 1 2 1 1 31 TYR QB . 31 . HB# 1 1 214 1 1 1 1 19 GLY QA . 19 . HA# 1 1 214 1 2 1 1 31 TYR QD . 31 . HD# 1 1 215 1 1 1 1 19 GLY QA . 19 . HA# 1 1 215 1 2 1 1 31 TYR QE . 31 . HE# 1 1 216 1 1 1 1 19 GLY H . 19 . HN 1 1 216 1 2 1 1 32 CYS H . 32 . HN 1 1 217 1 1 1 1 19 GLY H . 19 . HN 1 1 217 1 2 1 1 32 CYS HA . 32 . HA 1 1 218 1 1 1 1 19 GLY H . 19 . HN 1 1 218 1 2 1 1 32 CYS QB . 32 . HB# 1 1 219 1 1 1 1 19 GLY QA . 19 . HA# 1 1 219 1 2 1 1 32 CYS H . 32 . HN 1 1 220 1 1 1 1 19 GLY H . 19 . HN 1 1 220 1 2 1 1 33 THR HA . 33 . HA 1 1 221 1 1 1 1 20 THR H . 20 . HN 1 1 221 1 2 1 1 21 THR H . 21 . HN 1 1 222 1 1 1 1 20 THR H . 20 . HN 1 1 222 1 2 1 1 21 THR MG . 21 . HG2# 1 1 223 1 1 1 1 20 THR HA . 20 . HA 1 1 223 1 2 1 1 21 THR H . 21 . HN 1 1 224 1 1 1 1 20 THR HB . 20 . HB 1 1 224 1 2 1 1 21 THR H . 21 . HN 1 1 225 1 1 1 1 20 THR MG . 20 . HG2# 1 1 225 1 2 1 1 21 THR H . 21 . HN 1 1 226 1 1 1 1 20 THR MG . 20 . HG2# 1 1 226 1 2 1 1 21 THR HA . 21 . HA 1 1 227 1 1 1 1 20 THR MG . 20 . HG2# 1 1 227 1 2 1 1 21 THR HB . 21 . HB 1 1 228 1 1 1 1 20 THR MG . 20 . HG2# 1 1 228 1 2 1 1 22 CYS HA . 22 . HA 1 1 229 1 1 1 1 20 THR MG . 20 . HG2# 1 1 229 1 2 1 1 22 CYS QB . 22 . HB# 1 1 230 1 1 1 1 20 THR H . 20 . HN 1 1 230 1 2 1 1 31 TYR HA . 31 . HA 1 1 231 1 1 1 1 20 THR H . 20 . HN 1 1 231 1 2 1 1 31 TYR QB . 31 . HB# 1 1 232 1 1 1 1 20 THR HA . 20 . HA 1 1 232 1 2 1 1 31 TYR QD . 31 . HD# 1 1 233 1 1 1 1 20 THR HA . 20 . HA 1 1 233 1 2 1 1 31 TYR QE . 31 . HE# 1 1 234 1 1 1 1 20 THR HB . 20 . HB 1 1 234 1 2 1 1 31 TYR HA . 31 . HA 1 1 235 1 1 1 1 20 THR MG . 20 . HG2# 1 1 235 1 2 1 1 31 TYR HA . 31 . HA 1 1 236 1 1 1 1 20 THR MG . 20 . HG2# 1 1 236 1 2 1 1 31 TYR QD . 31 . HD# 1 1 237 1 1 1 1 20 THR H . 20 . HN 1 1 237 1 2 1 1 32 CYS H . 32 . HN 1 1 238 1 1 1 1 20 THR H . 20 . HN 1 1 238 1 2 1 1 32 CYS HA . 32 . HA 1 1 239 1 1 1 1 20 THR H . 20 . HN 1 1 239 1 2 1 1 32 CYS QB . 32 . HB# 1 1 240 1 1 1 1 20 THR HA . 20 . HA 1 1 240 1 2 1 1 32 CYS H . 32 . HN 1 1 241 1 1 1 1 20 THR HB . 20 . HB 1 1 241 1 2 1 1 32 CYS H . 32 . HN 1 1 242 1 1 1 1 20 THR HB . 20 . HB 1 1 242 1 2 1 1 32 CYS QB . 32 . HB# 1 1 243 1 1 1 1 20 THR MG . 20 . HG2# 1 1 243 1 2 1 1 32 CYS H . 32 . HN 1 1 244 1 1 1 1 20 THR MG . 20 . HG2# 1 1 244 1 2 1 1 32 CYS QB . 32 . HB# 1 1 245 1 1 1 1 21 THR HA . 21 . HA 1 1 245 1 2 1 1 22 CYS H . 22 . HN 1 1 246 1 1 1 1 21 THR HA . 21 . HA 1 1 246 1 2 1 1 22 CYS QB . 22 . HB# 1 1 247 1 1 1 1 21 THR HB . 21 . HB 1 1 247 1 2 1 1 22 CYS H . 22 . HN 1 1 248 1 1 1 1 21 THR MG . 21 . HG2# 1 1 248 1 2 1 1 22 CYS H . 22 . HN 1 1 249 1 1 1 1 21 THR MG . 21 . HG2# 1 1 249 1 2 1 1 22 CYS HA . 22 . HA 1 1 250 1 1 1 1 21 THR MG . 21 . HG2# 1 1 250 1 2 1 1 23 TRP H . 23 . HN 1 1 251 1 1 1 1 21 THR HA . 21 . HA 1 1 251 1 2 1 1 24 LYS H . 24 . HN 1 1 252 1 1 1 1 21 THR MG . 21 . HG2# 1 1 252 1 2 1 1 24 LYS QE . 24 . HE# 1 1 253 1 1 1 1 21 THR MG . 21 . HG2# 1 1 253 1 2 1 1 29 SER QB . 29 . HB# 1 1 254 1 1 1 1 21 THR HA . 21 . HA 1 1 254 1 2 1 1 30 HIS H . 30 . HN 1 1 255 1 1 1 1 21 THR MG . 21 . HG2# 1 1 255 1 2 1 1 30 HIS H . 30 . HN 1 1 256 1 1 1 1 21 THR H . 21 . HN 1 1 256 1 2 1 1 31 TYR HA . 31 . HA 1 1 257 1 1 1 1 21 THR H . 21 . HN 1 1 257 1 2 1 1 31 TYR QD . 31 . HD# 1 1 258 1 1 1 1 21 THR H . 21 . HN 1 1 258 1 2 1 1 31 TYR QE . 31 . HE# 1 1 259 1 1 1 1 21 THR HA . 21 . HA 1 1 259 1 2 1 1 31 TYR HA . 31 . HA 1 1 260 1 1 1 1 21 THR HA . 21 . HA 1 1 260 1 2 1 1 31 TYR QD . 31 . HD# 1 1 261 1 1 1 1 21 THR HA . 21 . HA 1 1 261 1 2 1 1 31 TYR QE . 31 . HE# 1 1 262 1 1 1 1 21 THR HB . 21 . HB 1 1 262 1 2 1 1 31 TYR HA . 31 . HA 1 1 263 1 1 1 1 21 THR HB . 21 . HB 1 1 263 1 2 1 1 31 TYR QD . 31 . HD# 1 1 264 1 1 1 1 21 THR HB . 21 . HB 1 1 264 1 2 1 1 31 TYR QE . 31 . HE# 1 1 265 1 1 1 1 21 THR MG . 21 . HG2# 1 1 265 1 2 1 1 31 TYR HA . 31 . HA 1 1 266 1 1 1 1 21 THR MG . 21 . HG2# 1 1 266 1 2 1 1 31 TYR QD . 31 . HD# 1 1 267 1 1 1 1 21 THR MG . 21 . HG2# 1 1 267 1 2 1 1 31 TYR QE . 31 . HE# 1 1 268 1 1 1 1 21 THR HA . 21 . HA 1 1 268 1 2 1 1 32 CYS H . 32 . HN 1 1 269 1 1 1 1 21 THR MG . 21 . HG2# 1 1 269 1 2 1 1 32 CYS H . 32 . HN 1 1 270 1 1 1 1 22 CYS H . 22 . HN 1 1 270 1 2 1 1 23 TRP H . 23 . HN 1 1 271 1 1 1 1 22 CYS HA . 22 . HA 1 1 271 1 2 1 1 23 TRP H . 23 . HN 1 1 272 1 1 1 1 22 CYS QB . 22 . HB# 1 1 272 1 2 1 1 23 TRP H . 23 . HN 1 1 273 1 1 1 1 22 CYS H . 22 . HN 1 1 273 1 2 1 1 30 HIS H . 30 . HN 1 1 274 1 1 1 1 22 CYS H . 22 . HN 1 1 274 1 2 1 1 31 TYR HA . 31 . HA 1 1 275 1 1 1 1 22 CYS H . 22 . HN 1 1 275 1 2 1 1 31 TYR QD . 31 . HD# 1 1 276 1 1 1 1 22 CYS H . 22 . HN 1 1 276 1 2 1 1 31 TYR QE . 31 . HE# 1 1 277 1 1 1 1 22 CYS H . 22 . HN 1 1 277 1 2 1 1 32 CYS H . 32 . HN 1 1 278 1 1 1 1 22 CYS QB . 22 . HB# 1 1 278 1 2 1 1 32 CYS H . 32 . HN 1 1 279 1 1 1 1 22 CYS HA . 22 . HA 1 1 279 1 2 1 1 39 CYS QB . 39 . HB# 1 1 280 1 1 1 1 22 CYS QB . 22 . HB# 1 1 280 1 2 1 1 39 CYS H . 39 . HN 1 1 281 1 1 1 1 22 CYS QB . 22 . HB# 1 1 281 1 2 1 1 39 CYS HA . 39 . HA 1 1 282 1 1 1 1 22 CYS QB . 22 . HB# 1 1 282 1 2 1 1 39 CYS QB . 39 . HB# 1 1 283 1 1 1 1 23 TRP H . 23 . HN 1 1 283 1 2 1 1 23 TRP HD1 . 23 . HD1 1 1 284 1 1 1 1 23 TRP HA . 23 . HA 1 1 284 1 2 1 1 24 LYS H . 24 . HN 1 1 285 1 1 1 1 23 TRP QB . 23 . HB# 1 1 285 1 2 1 1 24 LYS H . 24 . HN 1 1 286 1 1 1 1 23 TRP HD1 . 23 . HD1 1 1 286 1 2 1 1 24 LYS H . 24 . HN 1 1 287 1 1 1 1 23 TRP HD1 . 23 . HD1 1 1 287 1 2 1 1 25 THR H . 25 . HN 1 1 288 1 1 1 1 23 TRP HD1 . 23 . HD1 1 1 288 1 2 1 1 25 THR MG . 25 . HG2# 1 1 289 1 1 1 1 23 TRP HE1 . 23 . HE1 1 1 289 1 2 1 1 25 THR MG . 25 . HG2# 1 1 290 1 1 1 1 23 TRP HZ2 . 23 . HZ2 1 1 290 1 2 1 1 25 THR MG . 25 . HG2# 1 1 291 1 1 1 1 23 TRP HH2 . 23 . HH2 1 1 291 1 2 1 1 25 THR MG . 25 . HG2# 1 1 292 1 1 1 1 23 TRP HZ3 . 23 . HZ3 1 1 292 1 2 1 1 25 THR MG . 25 . HG2# 1 1 293 1 1 1 1 23 TRP HE1 . 23 . HE1 1 1 293 1 2 1 1 28 SER QB . 28 . HB# 1 1 294 1 1 1 1 23 TRP HZ3 . 23 . HZ3 1 1 294 1 2 1 1 28 SER QB . 28 . HB# 1 1 295 1 1 1 1 23 TRP HH2 . 23 . HH2 1 1 295 1 2 1 1 28 SER QB . 28 . HB# 1 1 296 1 1 1 1 23 TRP HD1 . 23 . HD1 1 1 296 1 2 1 1 29 SER HA . 29 . HA 1 1 297 1 1 1 1 23 TRP HE3 . 23 . HE3 1 1 297 1 2 1 1 29 SER HA . 29 . HA 1 1 298 1 1 1 1 23 TRP H . 23 . HN 1 1 298 1 2 1 1 30 HIS H . 30 . HN 1 1 299 1 1 1 1 23 TRP H . 23 . HN 1 1 299 1 2 1 1 30 HIS QB . 30 . HB# 1 1 300 1 1 1 1 23 TRP HA . 23 . HA 1 1 300 1 2 1 1 30 HIS H . 30 . HN 1 1 301 1 1 1 1 23 TRP HA . 23 . HA 1 1 301 1 2 1 1 30 HIS QB . 30 . HB# 1 1 302 1 1 1 1 23 TRP QB . 23 . HB# 1 1 302 1 2 1 1 30 HIS H . 30 . HN 1 1 303 1 1 1 1 23 TRP QB . 23 . HB# 1 1 303 1 2 1 1 30 HIS QB . 30 . HB# 1 1 304 1 1 1 1 23 TRP HD1 . 23 . HD1 1 1 304 1 2 1 1 30 HIS H . 30 . HN 1 1 305 1 1 1 1 23 TRP HE3 . 23 . HE3 1 1 305 1 2 1 1 30 HIS H . 30 . HN 1 1 306 1 1 1 1 23 TRP HD1 . 23 . HD1 1 1 306 1 2 1 1 30 HIS QB . 30 . HB# 1 1 307 1 1 1 1 23 TRP QB . 23 . HB# 1 1 307 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 308 1 1 1 1 23 TRP HZ3 . 23 . HZ3 1 1 308 1 2 1 1 30 HIS HE1 . 30 . HE1 1 1 309 1 1 1 1 23 TRP H . 23 . HN 1 1 309 1 2 1 1 31 TYR HA . 31 . HA 1 1 310 1 1 1 1 23 TRP HZ2 . 23 . HZ2 1 1 310 1 2 1 1 39 CYS QB . 39 . HB# 1 1 311 1 1 1 1 23 TRP HZ3 . 23 . HZ3 1 1 311 1 2 1 1 41 SER QB . 41 . HB# 1 1 312 1 1 1 1 24 LYS H . 24 . HN 1 1 312 1 2 1 1 24 LYS QG . 24 . HG# 1 1 313 1 1 1 1 24 LYS HA . 24 . HA 1 1 313 1 2 1 1 25 THR H . 25 . HN 1 1 314 1 1 1 1 24 LYS QB . 24 . HB# 1 1 314 1 2 1 1 25 THR H . 25 . HN 1 1 315 1 1 1 1 24 LYS QG . 24 . HG# 1 1 315 1 2 1 1 25 THR H . 25 . HN 1 1 316 1 1 1 1 24 LYS H . 24 . HN 1 1 316 1 2 1 1 25 THR MG . 25 . HG2# 1 1 317 1 1 1 1 24 LYS HA . 24 . HA 1 1 317 1 2 1 1 28 SER H . 28 . HN 1 1 318 1 1 1 1 24 LYS H . 24 . HN 1 1 318 1 2 1 1 29 SER HA . 29 . HA 1 1 319 1 1 1 1 24 LYS HA . 24 . HA 1 1 319 1 2 1 1 30 HIS H . 30 . HN 1 1 320 1 1 1 1 24 LYS HA . 24 . HA 1 1 320 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 321 1 1 1 1 24 LYS QB . 24 . HB# 1 1 321 1 2 1 1 30 HIS H . 30 . HN 1 1 322 1 1 1 1 24 LYS QB . 24 . HB# 1 1 322 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 323 1 1 1 1 25 THR H . 25 . HN 1 1 323 1 2 1 1 26 SER H . 26 . HN 1 1 324 1 1 1 1 25 THR HA . 25 . HA 1 1 324 1 2 1 1 26 SER H . 26 . HN 1 1 325 1 1 1 1 25 THR MG . 25 . HG2# 1 1 325 1 2 1 1 26 SER H . 26 . HN 1 1 326 1 1 1 1 25 THR H . 25 . HN 1 1 326 1 2 1 1 27 VAL H . 27 . HN 1 1 327 1 1 1 1 25 THR H . 25 . HN 1 1 327 1 2 1 1 28 SER H . 28 . HN 1 1 328 1 1 1 1 25 THR H . 25 . HN 1 1 328 1 2 1 1 29 SER HA . 29 . HA 1 1 329 1 1 1 1 26 SER H . 26 . HN 1 1 329 1 2 1 1 27 VAL H . 27 . HN 1 1 330 1 1 1 1 26 SER H . 26 . HN 1 1 330 1 2 1 1 27 VAL HB . 27 . HB 1 1 331 1 1 1 1 26 SER HA . 26 . HA 1 1 331 1 2 1 1 27 VAL H . 27 . HN 1 1 332 1 1 1 1 26 SER QB . 26 . HB# 1 1 332 1 2 1 1 27 VAL H . 27 . HN 1 1 333 1 1 1 1 26 SER QB . 26 . HB# 1 1 333 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 334 1 1 1 1 26 SER QB . 26 . HB# 1 1 334 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 335 1 1 1 1 26 SER H . 26 . HN 1 1 335 1 2 1 1 28 SER H . 28 . HN 1 1 336 1 1 1 1 26 SER QB . 26 . HB# 1 1 336 1 2 1 1 28 SER H . 28 . HN 1 1 337 1 1 1 1 27 VAL H . 27 . HN 1 1 337 1 2 1 1 28 SER H . 28 . HN 1 1 338 1 1 1 1 27 VAL H . 27 . HN 1 1 338 1 2 1 1 28 SER HA . 28 . HA 1 1 339 1 1 1 1 27 VAL HA . 27 . HA 1 1 339 1 2 1 1 28 SER H . 28 . HN 1 1 340 1 1 1 1 27 VAL HB . 27 . HB 1 1 340 1 2 1 1 28 SER H . 28 . HN 1 1 341 1 1 1 1 27 VAL HB . 27 . HB 1 1 341 1 2 1 1 28 SER QB . 28 . HB# 1 1 342 1 1 1 1 27 VAL QG . 27 . HG# 1 1 342 1 2 1 1 28 SER H . 28 . HN 1 1 343 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 343 1 2 1 1 28 SER QB . 28 . HB# 1 1 344 1 1 1 1 27 VAL MG2 . 27 . HG2# 1 1 344 1 2 1 1 28 SER QB . 28 . HB# 1 1 345 1 1 1 1 28 SER H . 28 . HN 1 1 345 1 2 1 1 29 SER H . 29 . HN 1 1 346 1 1 1 1 28 SER HA . 28 . HA 1 1 346 1 2 1 1 29 SER H . 29 . HN 1 1 347 1 1 1 1 28 SER QB . 28 . HB# 1 1 347 1 2 1 1 29 SER H . 29 . HN 1 1 348 1 1 1 1 28 SER QB . 28 . HB# 1 1 348 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 349 1 1 1 1 28 SER QB . 28 . HB# 1 1 349 1 2 1 1 30 HIS HE1 . 30 . HE1 1 1 350 1 1 1 1 29 SER H . 29 . HN 1 1 350 1 2 1 1 30 HIS H . 30 . HN 1 1 351 1 1 1 1 29 SER HA . 29 . HA 1 1 351 1 2 1 1 30 HIS H . 30 . HN 1 1 352 1 1 1 1 29 SER H . 29 . HN 1 1 352 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 353 1 1 1 1 29 SER HA . 29 . HA 1 1 353 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 354 1 1 1 1 29 SER QB . 29 . HB# 1 1 354 1 2 1 1 30 HIS H . 30 . HN 1 1 355 1 1 1 1 29 SER QB . 29 . HB# 1 1 355 1 2 1 1 31 TYR QD . 31 . HD# 1 1 356 1 1 1 1 29 SER QB . 29 . HB# 1 1 356 1 2 1 1 31 TYR QE . 31 . HE# 1 1 357 1 1 1 1 30 HIS H . 30 . HN 1 1 357 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 358 1 1 1 1 30 HIS H . 30 . HN 1 1 358 1 2 1 1 31 TYR HA . 31 . HA 1 1 359 1 1 1 1 30 HIS H . 30 . HN 1 1 359 1 2 1 1 31 TYR QE . 31 . HE# 1 1 360 1 1 1 1 30 HIS HA . 30 . HA 1 1 360 1 2 1 1 31 TYR H . 31 . HN 1 1 361 1 1 1 1 30 HIS HA . 30 . HA 1 1 361 1 2 1 1 31 TYR QD . 31 . HD# 1 1 362 1 1 1 1 30 HIS HA . 30 . HA 1 1 362 1 2 1 1 31 TYR QE . 31 . HE# 1 1 363 1 1 1 1 30 HIS QB . 30 . HB# 1 1 363 1 2 1 1 31 TYR H . 31 . HN 1 1 364 1 1 1 1 30 HIS QB . 30 . HB# 1 1 364 1 2 1 1 40 PRO QD . 40 . HD# 1 1 365 1 1 1 1 30 HIS QB . 30 . HB# 1 1 365 1 2 1 1 40 PRO QG . 40 . HG# 1 1 366 1 1 1 1 30 HIS HD2 . 30 . HD2 1 1 366 1 2 1 1 41 SER HA . 41 . HA 1 1 367 1 1 1 1 30 HIS HE1 . 30 . HE1 1 1 367 1 2 1 1 41 SER HA . 41 . HA 1 1 368 1 1 1 1 30 HIS HE1 . 30 . HE1 1 1 368 1 2 1 1 41 SER QB . 41 . HB# 1 1 369 1 1 1 1 30 HIS HE1 . 30 . HE1 1 1 369 1 2 1 1 42 TYR H . 42 . HN 1 1 370 1 1 1 1 30 HIS HE1 . 30 . HE1 1 1 370 1 2 1 1 42 TYR QB . 42 . HB# 1 1 371 1 1 1 1 30 HIS HD2 . 30 . HD2 1 1 371 1 2 1 1 43 PRO QB . 43 . HB# 1 1 372 1 1 1 1 30 HIS HE1 . 30 . HE1 1 1 372 1 2 1 1 43 PRO QB . 43 . HB# 1 1 373 1 1 1 1 30 HIS HA . 30 . HA 1 1 373 1 2 1 1 44 GLY H . 44 . HN 1 1 374 1 1 1 1 31 TYR H . 31 . HN 1 1 374 1 2 1 1 31 TYR QD . 31 . HD# 1 1 375 1 1 1 1 31 TYR H . 31 . HN 1 1 375 1 2 1 1 32 CYS H . 32 . HN 1 1 376 1 1 1 1 31 TYR HA . 31 . HA 1 1 376 1 2 1 1 32 CYS H . 32 . HN 1 1 377 1 1 1 1 31 TYR QB . 31 . HB# 1 1 377 1 2 1 1 32 CYS H . 32 . HN 1 1 378 1 1 1 1 31 TYR QD . 31 . HD# 1 1 378 1 2 1 1 32 CYS H . 32 . HN 1 1 379 1 1 1 1 31 TYR QE . 31 . HE# 1 1 379 1 2 1 1 32 CYS H . 32 . HN 1 1 380 1 1 1 1 31 TYR QE . 31 . HE# 1 1 380 1 2 1 1 44 GLY H . 44 . HN 1 1 381 1 1 1 1 31 TYR QE . 31 . HE# 1 1 381 1 2 1 1 44 GLY QA . 44 . HA# 1 1 382 1 1 1 1 32 CYS H . 32 . HN 1 1 382 1 2 1 1 33 THR H . 33 . HN 1 1 383 1 1 1 1 32 CYS H . 32 . HN 1 1 383 1 2 1 1 33 THR HA . 33 . HA 1 1 384 1 1 1 1 32 CYS H . 32 . HN 1 1 384 1 2 1 1 33 THR MG . 33 . HG2# 1 1 385 1 1 1 1 32 CYS HA . 32 . HA 1 1 385 1 2 1 1 33 THR H . 33 . HN 1 1 386 1 1 1 1 32 CYS HA . 32 . HA 1 1 386 1 2 1 1 33 THR MG . 33 . HG2# 1 1 387 1 1 1 1 32 CYS QB . 32 . HB# 1 1 387 1 2 1 1 33 THR H . 33 . HN 1 1 388 1 1 1 1 32 CYS H . 32 . HN 1 1 388 1 2 1 1 34 GLY H . 34 . HN 1 1 389 1 1 1 1 32 CYS HA . 32 . HA 1 1 389 1 2 1 1 34 GLY H . 34 . HN 1 1 390 1 1 1 1 32 CYS QB . 32 . HB# 1 1 390 1 2 1 1 34 GLY H . 34 . HN 1 1 391 1 1 1 1 32 CYS HA . 32 . HA 1 1 391 1 2 1 1 35 ARG H . 35 . HN 1 1 392 1 1 1 1 32 CYS QB . 32 . HB# 1 1 392 1 2 1 1 35 ARG H . 35 . HN 1 1 393 1 1 1 1 32 CYS HA . 32 . HA 1 1 393 1 2 1 1 36 SER H . 36 . HN 1 1 394 1 1 1 1 32 CYS QB . 32 . HB# 1 1 394 1 2 1 1 36 SER H . 36 . HN 1 1 395 1 1 1 1 32 CYS HA . 32 . HA 1 1 395 1 2 1 1 39 CYS HA . 39 . HA 1 1 396 1 1 1 1 32 CYS H . 32 . HN 1 1 396 1 2 1 1 40 PRO QD . 40 . HD# 1 1 397 1 1 1 1 32 CYS HA . 32 . HA 1 1 397 1 2 1 1 40 PRO QD . 40 . HD# 1 1 398 1 1 1 1 33 THR H . 33 . HN 1 1 398 1 2 1 1 34 GLY H . 34 . HN 1 1 399 1 1 1 1 33 THR H . 33 . HN 1 1 399 1 2 1 1 34 GLY QA . 34 . HA# 1 1 400 1 1 1 1 33 THR HA . 33 . HA 1 1 400 1 2 1 1 34 GLY H . 34 . HN 1 1 401 1 1 1 1 33 THR HB . 33 . HB 1 1 401 1 2 1 1 34 GLY H . 34 . HN 1 1 402 1 1 1 1 33 THR MG . 33 . HG2# 1 1 402 1 2 1 1 34 GLY H . 34 . HN 1 1 403 1 1 1 1 33 THR H . 33 . HN 1 1 403 1 2 1 1 35 ARG H . 35 . HN 1 1 404 1 1 1 1 33 THR HB . 33 . HB 1 1 404 1 2 1 1 35 ARG H . 35 . HN 1 1 405 1 1 1 1 33 THR HG1 . 33 . HG1 1 1 405 1 2 1 1 35 ARG H . 35 . HN 1 1 406 1 1 1 1 33 THR HG1 . 33 . HG1 1 1 406 1 2 1 1 35 ARG QB . 35 . HB# 1 1 407 1 1 1 1 33 THR MG . 33 . HG2# 1 1 407 1 2 1 1 35 ARG H . 35 . HN 1 1 408 1 1 1 1 33 THR H . 33 . HN 1 1 408 1 2 1 1 36 SER H . 36 . HN 1 1 409 1 1 1 1 33 THR HG1 . 33 . HG1 1 1 409 1 2 1 1 36 SER H . 36 . HN 1 1 410 1 1 1 1 33 THR MG . 33 . HG2# 1 1 410 1 2 1 1 36 SER H . 36 . HN 1 1 411 1 1 1 1 33 THR MG . 33 . HG2# 1 1 411 1 2 1 1 36 SER QB . 36 . HB# 1 1 412 1 1 1 1 33 THR H . 33 . HN 1 1 412 1 2 1 1 39 CYS HA . 39 . HA 1 1 413 1 1 1 1 33 THR MG . 33 . HG2# 1 1 413 1 2 1 1 39 CYS HA . 39 . HA 1 1 414 1 1 1 1 33 THR H . 33 . HN 1 1 414 1 2 1 1 40 PRO QG . 40 . HG# 1 1 415 1 1 1 1 33 THR H . 33 . HN 1 1 415 1 2 1 1 40 PRO QD . 40 . HD# 1 1 416 1 1 1 1 33 THR MG . 33 . HG2# 1 1 416 1 2 1 1 40 PRO HA . 40 . HA 1 1 417 1 1 1 1 33 THR MG . 33 . HG2# 1 1 417 1 2 1 1 40 PRO QG . 40 . HG# 1 1 418 1 1 1 1 33 THR MG . 33 . HG2# 1 1 418 1 2 1 1 40 PRO QD . 40 . HD# 1 1 419 1 1 1 1 33 THR MG . 33 . HG2# 1 1 419 1 2 1 1 42 TYR QE . 42 . HE# 1 1 420 1 1 1 1 34 GLY H . 34 . HN 1 1 420 1 2 1 1 35 ARG H . 35 . HN 1 1 421 1 1 1 1 34 GLY H . 34 . HN 1 1 421 1 2 1 1 35 ARG QB . 35 . HB# 1 1 422 1 1 1 1 34 GLY QA . 34 . HA# 1 1 422 1 2 1 1 35 ARG H . 35 . HN 1 1 423 1 1 1 1 34 GLY H . 34 . HN 1 1 423 1 2 1 1 36 SER H . 36 . HN 1 1 424 1 1 1 1 34 GLY QA . 34 . HA# 1 1 424 1 2 1 1 36 SER H . 36 . HN 1 1 425 1 1 1 1 35 ARG H . 35 . HN 1 1 425 1 2 1 1 35 ARG QG . 35 . HG# 1 1 426 1 1 1 1 35 ARG H . 35 . HN 1 1 426 1 2 1 1 35 ARG QD . 35 . HD# 1 1 427 1 1 1 1 35 ARG H . 35 . HN 1 1 427 1 2 1 1 36 SER H . 36 . HN 1 1 428 1 1 1 1 35 ARG H . 35 . HN 1 1 428 1 2 1 1 36 SER QB . 36 . HB# 1 1 429 1 1 1 1 35 ARG HA . 35 . HA 1 1 429 1 2 1 1 36 SER H . 36 . HN 1 1 430 1 1 1 1 35 ARG QB . 35 . HB# 1 1 430 1 2 1 1 36 SER H . 36 . HN 1 1 431 1 1 1 1 35 ARG QG . 35 . HG# 1 1 431 1 2 1 1 36 SER H . 36 . HN 1 1 432 1 1 1 1 35 ARG QD . 35 . HD# 1 1 432 1 2 1 1 36 SER H . 36 . HN 1 1 433 1 1 1 1 36 SER H . 36 . HN 1 1 433 1 2 1 1 37 CYS H . 37 . HN 1 1 434 1 1 1 1 36 SER HA . 36 . HA 1 1 434 1 2 1 1 37 CYS H . 37 . HN 1 1 435 1 1 1 1 36 SER QB . 36 . HB# 1 1 435 1 2 1 1 37 CYS H . 37 . HN 1 1 436 1 1 1 1 36 SER H . 36 . HN 1 1 436 1 2 1 1 38 GLU H . 38 . HN 1 1 437 1 1 1 1 36 SER HA . 36 . HA 1 1 437 1 2 1 1 38 GLU H . 38 . HN 1 1 438 1 1 1 1 36 SER QB . 36 . HB# 1 1 438 1 2 1 1 38 GLU H . 38 . HN 1 1 439 1 1 1 1 36 SER QB . 36 . HB# 1 1 439 1 2 1 1 38 GLU QB . 38 . HB# 1 1 440 1 1 1 1 37 CYS H . 37 . HN 1 1 440 1 2 1 1 38 GLU H . 38 . HN 1 1 441 1 1 1 1 37 CYS HA . 37 . HA 1 1 441 1 2 1 1 38 GLU H . 38 . HN 1 1 442 1 1 1 1 37 CYS QB . 37 . HB# 1 1 442 1 2 1 1 38 GLU H . 38 . HN 1 1 443 1 1 1 1 38 GLU H . 38 . HN 1 1 443 1 2 1 1 38 GLU QG . 38 . HG# 1 1 444 1 1 1 1 38 GLU H . 38 . HN 1 1 444 1 2 1 1 39 CYS H . 39 . HN 1 1 445 1 1 1 1 38 GLU HA . 38 . HA 1 1 445 1 2 1 1 39 CYS H . 39 . HN 1 1 446 1 1 1 1 38 GLU QB . 38 . HB# 1 1 446 1 2 1 1 39 CYS H . 39 . HN 1 1 447 1 1 1 1 38 GLU QG . 38 . HG# 1 1 447 1 2 1 1 39 CYS H . 39 . HN 1 1 448 1 1 1 1 38 GLU QB . 38 . HB# 1 1 448 1 2 1 1 39 CYS HA . 39 . HA 1 1 449 1 1 1 1 39 CYS H . 39 . HN 1 1 449 1 2 1 1 40 PRO QD . 40 . HD# 1 1 450 1 1 1 1 39 CYS HA . 39 . HA 1 1 450 1 2 1 1 40 PRO QB . 40 . HB# 1 1 451 1 1 1 1 39 CYS HA . 39 . HA 1 1 451 1 2 1 1 40 PRO QG . 40 . HG# 1 1 452 1 1 1 1 39 CYS HA . 39 . HA 1 1 452 1 2 1 1 40 PRO QD . 40 . HD# 1 1 453 1 1 1 1 39 CYS QB . 39 . HB# 1 1 453 1 2 1 1 40 PRO QD . 40 . HD# 1 1 454 1 1 1 1 40 PRO HA . 40 . HA 1 1 454 1 2 1 1 41 SER H . 41 . HN 1 1 455 1 1 1 1 40 PRO HA . 40 . HA 1 1 455 1 2 1 1 41 SER QB . 41 . HB# 1 1 456 1 1 1 1 40 PRO QB . 40 . HB# 1 1 456 1 2 1 1 41 SER H . 41 . HN 1 1 457 1 1 1 1 40 PRO QG . 40 . HG# 1 1 457 1 2 1 1 41 SER H . 41 . HN 1 1 458 1 1 1 1 40 PRO HA . 40 . HA 1 1 458 1 2 1 1 42 TYR H . 42 . HN 1 1 459 1 1 1 1 40 PRO HA . 40 . HA 1 1 459 1 2 1 1 42 TYR QE . 42 . HE# 1 1 460 1 1 1 1 40 PRO QB . 40 . HB# 1 1 460 1 2 1 1 42 TYR H . 42 . HN 1 1 461 1 1 1 1 40 PRO QB . 40 . HB# 1 1 461 1 2 1 1 42 TYR QD . 42 . HD# 1 1 462 1 1 1 1 40 PRO QB . 40 . HB# 1 1 462 1 2 1 1 42 TYR QE . 42 . HE# 1 1 463 1 1 1 1 40 PRO QG . 40 . HG# 1 1 463 1 2 1 1 42 TYR H . 42 . HN 1 1 464 1 1 1 1 40 PRO QG . 40 . HG# 1 1 464 1 2 1 1 42 TYR QD . 42 . HD# 1 1 465 1 1 1 1 40 PRO QG . 40 . HG# 1 1 465 1 2 1 1 42 TYR QE . 42 . HE# 1 1 466 1 1 1 1 41 SER H . 41 . HN 1 1 466 1 2 1 1 42 TYR H . 42 . HN 1 1 467 1 1 1 1 41 SER H . 41 . HN 1 1 467 1 2 1 1 42 TYR QD . 42 . HD# 1 1 468 1 1 1 1 41 SER H . 41 . HN 1 1 468 1 2 1 1 42 TYR QE . 42 . HE# 1 1 469 1 1 1 1 41 SER HA . 41 . HA 1 1 469 1 2 1 1 42 TYR H . 42 . HN 1 1 470 1 1 1 1 41 SER QB . 41 . HB# 1 1 470 1 2 1 1 42 TYR H . 42 . HN 1 1 471 1 1 1 1 41 SER QB . 41 . HB# 1 1 471 1 2 1 1 42 TYR QD . 42 . HD# 1 1 472 1 1 1 1 41 SER QB . 41 . HB# 1 1 472 1 2 1 1 42 TYR QE . 42 . HE# 1 1 473 1 1 1 1 42 TYR H . 42 . HN 1 1 473 1 2 1 1 42 TYR QD . 42 . HD# 1 1 474 1 1 1 1 42 TYR H . 42 . HN 1 1 474 1 2 1 1 43 PRO QD . 43 . HD# 1 1 475 1 1 1 1 42 TYR HA . 42 . HA 1 1 475 1 2 1 1 43 PRO QG . 43 . HG# 1 1 476 1 1 1 1 42 TYR HA . 42 . HA 1 1 476 1 2 1 1 43 PRO QD . 43 . HD# 1 1 477 1 1 1 1 42 TYR QB . 42 . HB# 1 1 477 1 2 1 1 43 PRO QD . 43 . HD# 1 1 478 1 1 1 1 42 TYR QD . 42 . HD# 1 1 478 1 2 1 1 43 PRO QG . 43 . HG# 1 1 479 1 1 1 1 42 TYR QE . 42 . HE# 1 1 479 1 2 1 1 43 PRO QG . 43 . HG# 1 1 480 1 1 1 1 42 TYR QD . 42 . HD# 1 1 480 1 2 1 1 43 PRO QD . 43 . HD# 1 1 481 1 1 1 1 42 TYR QE . 42 . HE# 1 1 481 1 2 1 1 43 PRO QD . 43 . HD# 1 1 482 1 1 1 1 42 TYR QE . 42 . HE# 1 1 482 1 2 1 1 44 GLY QA . 44 . HA# 1 1 483 1 1 1 1 42 TYR QD . 42 . HD# 1 1 483 1 2 1 1 46 GLY H . 46 . HN 1 1 484 1 1 1 1 42 TYR QE . 42 . HE# 1 1 484 1 2 1 1 46 GLY H . 46 . HN 1 1 485 1 1 1 1 43 PRO HA . 43 . HA 1 1 485 1 2 1 1 44 GLY H . 44 . HN 1 1 486 1 1 1 1 43 PRO QB . 43 . HB# 1 1 486 1 2 1 1 44 GLY H . 44 . HN 1 1 487 1 1 1 1 43 PRO QG . 43 . HG# 1 1 487 1 2 1 1 44 GLY H . 44 . HN 1 1 488 1 1 1 1 43 PRO QD . 43 . HD# 1 1 488 1 2 1 1 44 GLY H . 44 . HN 1 1 489 1 1 1 1 44 GLY H . 44 . HN 1 1 489 1 2 1 1 45 ASN H . 45 . HN 1 1 490 1 1 1 1 44 GLY QA . 44 . HA# 1 1 490 1 2 1 1 45 ASN H . 45 . HN 1 1 491 1 1 1 1 45 ASN H . 45 . HN 1 1 491 1 2 1 1 45 ASN QD . 45 . HD2# 1 1 492 1 1 1 1 45 ASN HA . 45 . HA 1 1 492 1 2 1 1 46 GLY H . 46 . HN 1 1 493 1 1 1 1 45 ASN QB . 45 . HB# 1 1 493 1 2 1 1 46 GLY H . 46 . HN 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 . . . . . 5.0 0.0 5.0 1 1 2 1 . . . . . 6.0 0.0 6.0 1 1 3 1 . . . . . 5.0 0.0 5.0 1 1 4 1 . . . . . 5.0 0.0 5.0 1 1 5 1 . . . . . 5.0 0.0 5.0 1 1 6 1 . . . . . 5.0 0.0 5.0 1 1 7 1 . . . . . 5.0 0.0 5.0 1 1 8 1 . . . . . 5.0 0.0 5.0 1 1 9 1 . . . . . 3.5 0.0 3.5 1 1 10 1 . . . . . 3.5 0.0 3.5 1 1 11 1 . . . . . 6.0 0.0 6.0 1 1 12 1 . . . . . 5.0 0.0 5.0 1 1 13 1 . . . . . 5.0 0.0 5.0 1 1 14 1 . . . . . 6.0 0.0 6.0 1 1 15 1 . . . . . 5.0 0.0 5.0 1 1 16 1 . . . . . 5.0 0.0 5.0 1 1 17 1 . . . . . 2.5 0.0 2.5 1 1 18 1 . . . . . 5.0 0.0 5.0 1 1 19 1 . . . . . 5.0 0.0 5.0 1 1 20 1 . . . . . 6.0 0.0 6.0 1 1 21 1 . . . . . 6.0 0.0 6.0 1 1 22 1 . . . . . 6.0 0.0 6.0 1 1 23 1 . . . . . 5.0 0.0 5.0 1 1 24 1 . . . . . 2.5 0.0 2.5 1 1 25 1 . . . . . 5.0 0.0 5.0 1 1 26 1 . . . . . 5.0 0.0 5.0 1 1 27 1 . . . . . 5.0 0.0 5.0 1 1 28 1 . . . . . 5.0 0.0 5.0 1 1 29 1 . . . . . 6.0 0.0 6.0 1 1 30 1 . . . . . 6.0 0.0 6.0 1 1 31 1 . . . . . 5.0 0.0 5.0 1 1 32 1 . . . . . 5.0 0.0 5.0 1 1 33 1 . . . . . 3.5 0.0 3.5 1 1 34 1 . . . . . 5.0 0.0 5.0 1 1 35 1 . . . . . 6.0 0.0 6.0 1 1 36 1 . . . . . 5.0 0.0 5.0 1 1 37 1 . . . . . 5.0 0.0 5.0 1 1 38 1 . . . . . 5.0 0.0 5.0 1 1 39 1 . . . . . 5.0 0.0 5.0 1 1 40 1 . . . . . 5.0 0.0 5.0 1 1 41 1 . . . . . 5.0 0.0 5.0 1 1 42 1 . . . . . 6.0 0.0 6.0 1 1 43 1 . . . . . 5.0 0.0 5.0 1 1 44 1 . . . . . 6.0 0.0 6.0 1 1 45 1 . . . . . 5.0 0.0 5.0 1 1 46 1 . . . . . 6.0 0.0 6.0 1 1 47 1 . . . . . 6.0 0.0 6.0 1 1 48 1 . . . . . 6.0 0.0 6.0 1 1 49 1 . . . . . 5.0 0.0 5.0 1 1 50 1 . . . . . 5.0 0.0 5.0 1 1 51 1 . . . . . 5.0 0.0 5.0 1 1 52 1 . . . . . 5.0 0.0 5.0 1 1 53 1 . . . . . 5.0 0.0 5.0 1 1 54 1 . . . . . 5.0 0.0 5.0 1 1 55 1 . . . . . 5.0 0.0 5.0 1 1 56 1 . . . . . 3.5 0.0 3.5 1 1 57 1 . . . . . 5.0 0.0 5.0 1 1 58 1 . . . . . 6.0 0.0 6.0 1 1 59 1 . . . . . 6.0 0.0 6.0 1 1 60 1 . . . . . 6.0 0.0 6.0 1 1 61 1 . . . . . 5.0 0.0 5.0 1 1 62 1 . . . . . 5.0 0.0 5.0 1 1 63 1 . . . . . 5.0 0.0 5.0 1 1 64 1 . . . . . 6.0 0.0 6.0 1 1 65 1 . . . . . 5.0 0.0 5.0 1 1 66 1 . . . . . 5.0 0.0 5.0 1 1 67 1 . . . . . 6.0 0.0 6.0 1 1 68 1 . . . . . 5.0 0.0 5.0 1 1 69 1 . . . . . 6.0 0.0 6.0 1 1 70 1 . . . . . 6.0 0.0 6.0 1 1 71 1 . . . . . 6.0 0.0 6.0 1 1 72 1 . . . . . 6.0 0.0 6.0 1 1 73 1 . . . . . 6.0 0.0 6.0 1 1 74 1 . . . . . 5.0 0.0 5.0 1 1 75 1 . . . . . 3.5 0.0 3.5 1 1 76 1 . . . . . 5.0 0.0 5.0 1 1 77 1 . . . . . 5.0 0.0 5.0 1 1 78 1 . . . . . 5.0 0.0 5.0 1 1 79 1 . . . . . 6.0 0.0 6.0 1 1 80 1 . . . . . 6.0 0.0 6.0 1 1 81 1 . . . . . 5.0 0.0 5.0 1 1 82 1 . . . . . 5.0 0.0 5.0 1 1 83 1 . . . . . 6.0 0.0 6.0 1 1 84 1 . . . . . 5.0 0.0 5.0 1 1 85 1 . . . . . 5.0 0.0 5.0 1 1 86 1 . . . . . 6.0 0.0 6.0 1 1 87 1 . . . . . 6.0 0.0 6.0 1 1 88 1 . . . . . 6.0 0.0 6.0 1 1 89 1 . . . . . 6.0 0.0 6.0 1 1 90 1 . . . . . 5.0 0.0 5.0 1 1 91 1 . . . . . 3.5 0.0 3.5 1 1 92 1 . . . . . 6.0 0.0 6.0 1 1 93 1 . . . . . 5.0 0.0 5.0 1 1 94 1 . . . . . 6.0 0.0 6.0 1 1 95 1 . . . . . 6.0 0.0 6.0 1 1 96 1 . . . . . 5.0 0.0 5.0 1 1 97 1 . . . . . 6.0 0.0 6.0 1 1 98 1 . . . . . 5.0 0.0 5.0 1 1 99 1 . . . . . 5.0 0.0 5.0 1 1 100 1 . . . . . 6.0 0.0 6.0 1 1 101 1 . . . . . 6.0 0.0 6.0 1 1 102 1 . . . . . 6.0 0.0 6.0 1 1 103 1 . . . . . 5.0 0.0 5.0 1 1 104 1 . . . . . 5.0 0.0 5.0 1 1 105 1 . . . . . 6.0 0.0 6.0 1 1 106 1 . . . . . 5.0 0.0 5.0 1 1 107 1 . . . . . 6.0 0.0 6.0 1 1 108 1 . . . . . 6.0 0.0 6.0 1 1 109 1 . . . . . 5.0 0.0 5.0 1 1 110 1 . . . . . 5.0 0.0 5.0 1 1 111 1 . . . . . 5.0 0.0 5.0 1 1 112 1 . . . . . 5.0 0.0 5.0 1 1 113 1 . . . . . 6.0 0.0 6.0 1 1 114 1 . . . . . 5.0 0.0 5.0 1 1 115 1 . . . . . 5.0 0.0 5.0 1 1 116 1 . . . . . 5.0 0.0 5.0 1 1 117 1 . . . . . 5.0 0.0 5.0 1 1 118 1 . . . . . 6.0 0.0 6.0 1 1 119 1 . . . . . 5.0 0.0 5.0 1 1 120 1 . . . . . 5.0 0.0 5.0 1 1 121 1 . . . . . 3.5 0.0 3.5 1 1 122 1 . . . . . 3.5 0.0 3.5 1 1 123 1 . . . . . 5.0 0.0 5.0 1 1 124 1 . . . . . 6.0 0.0 6.0 1 1 125 1 . . . . . 6.0 0.0 6.0 1 1 126 1 . . . . . 3.5 0.0 3.5 1 1 127 1 . . . . . 5.0 0.0 5.0 1 1 128 1 . . . . . 5.0 0.0 5.0 1 1 129 1 . . . . . 5.0 0.0 5.0 1 1 130 1 . . . . . 6.0 0.0 6.0 1 1 131 1 . . . . . 6.0 0.0 6.0 1 1 132 1 . . . . . 5.0 0.0 5.0 1 1 133 1 . . . . . 2.5 0.0 2.5 1 1 134 1 . . . . . 5.0 0.0 5.0 1 1 135 1 . . . . . 6.0 0.0 6.0 1 1 136 1 . . . . . 6.0 0.0 6.0 1 1 137 1 . . . . . 5.0 0.0 5.0 1 1 138 1 . . . . . 5.0 0.0 5.0 1 1 139 1 . . . . . 2.5 0.0 2.5 1 1 140 1 . . . . . 6.0 0.0 6.0 1 1 141 1 . . . . . 5.0 0.0 5.0 1 1 142 1 . . . . . 5.0 0.0 5.0 1 1 143 1 . . . . . 6.0 0.0 6.0 1 1 144 1 . . . . . 6.0 0.0 6.0 1 1 145 1 . . . . . 5.0 0.0 5.0 1 1 146 1 . . . . . 6.0 0.0 6.0 1 1 147 1 . . . . . 6.0 0.0 6.0 1 1 148 1 . . . . . 6.0 0.0 6.0 1 1 149 1 . . . . . 6.0 0.0 6.0 1 1 150 1 . . . . . 5.0 0.0 5.0 1 1 151 1 . . . . . 5.0 0.0 5.0 1 1 152 1 . . . . . 5.0 0.0 5.0 1 1 153 1 . . . . . 5.0 0.0 5.0 1 1 154 1 . . . . . 5.0 0.0 5.0 1 1 155 1 . . . . . 5.0 0.0 5.0 1 1 156 1 . . . . . 6.0 0.0 6.0 1 1 157 1 . . . . . 5.0 0.0 5.0 1 1 158 1 . . . . . 5.0 0.0 5.0 1 1 159 1 . . . . . 6.0 0.0 6.0 1 1 160 1 . . . . . 5.0 0.0 5.0 1 1 161 1 . . . . . 5.0 0.0 5.0 1 1 162 1 . . . . . 5.0 0.0 5.0 1 1 163 1 . . . . . 2.5 0.0 2.5 1 1 164 1 . . . . . 6.0 0.0 6.0 1 1 165 1 . . . . . 5.0 0.0 5.0 1 1 166 1 . . . . . 5.0 0.0 5.0 1 1 167 1 . . . . . 5.0 0.0 5.0 1 1 168 1 . . . . . 5.0 0.0 5.0 1 1 169 1 . . . . . 5.0 0.0 5.0 1 1 170 1 . . . . . 6.0 0.0 6.0 1 1 171 1 . . . . . 2.2 0.0 2.2 1 1 172 1 . . . . . 3.5 0.0 3.5 1 1 173 1 . . . . . 5.0 0.0 5.0 1 1 174 1 . . . . . 6.0 0.0 6.0 1 1 175 1 . . . . . 5.0 0.0 5.0 1 1 176 1 . . . . . 5.0 0.0 5.0 1 1 177 1 . . . . . 6.0 0.0 6.0 1 1 178 1 . . . . . 5.0 0.0 5.0 1 1 179 1 . . . . . 6.0 0.0 6.0 1 1 180 1 . . . . . 6.0 0.0 6.0 1 1 181 1 . . . . . 5.0 0.0 5.0 1 1 182 1 . . . . . 5.0 0.0 5.0 1 1 183 1 . . . . . 2.5 0.0 2.5 1 1 184 1 . . . . . 5.0 0.0 5.0 1 1 185 1 . . . . . 5.0 0.0 5.0 1 1 186 1 . . . . . 5.0 0.0 5.0 1 1 187 1 . . . . . 6.0 0.0 6.0 1 1 188 1 . . . . . 5.0 0.0 5.0 1 1 189 1 . . . . . 5.0 0.0 5.0 1 1 190 1 . . . . . 6.0 0.0 6.0 1 1 191 1 . . . . . 6.0 0.0 6.0 1 1 192 1 . . . . . 6.0 0.0 6.0 1 1 193 1 . . . . . 6.0 0.0 6.0 1 1 194 1 . . . . . 5.0 0.0 5.0 1 1 195 1 . . . . . 5.0 0.0 5.0 1 1 196 1 . . . . . 5.0 0.0 5.0 1 1 197 1 . . . . . 6.0 0.0 6.0 1 1 198 1 . . . . . 5.0 0.0 5.0 1 1 199 1 . . . . . 5.0 0.0 5.0 1 1 200 1 . . . . . 5.0 0.0 5.0 1 1 201 1 . . . . . 5.0 0.0 5.0 1 1 202 1 . . . . . 5.0 0.0 5.0 1 1 203 1 . . . . . 5.0 0.0 5.0 1 1 204 1 . . . . . 6.0 0.0 6.0 1 1 205 1 . . . . . 6.0 0.0 6.0 1 1 206 1 . . . . . 3.5 0.0 3.5 1 1 207 1 . . . . . 3.5 0.0 3.5 1 1 208 1 . . . . . 6.0 0.0 6.0 1 1 209 1 . . . . . 5.0 0.0 5.0 1 1 210 1 . . . . . 5.0 0.0 5.0 1 1 211 1 . . . . . 6.0 0.0 6.0 1 1 212 1 . . . . . 6.0 0.0 6.0 1 1 213 1 . . . . . 5.0 0.0 5.0 1 1 214 1 . . . . . 5.0 0.0 5.0 1 1 215 1 . . . . . 6.0 0.0 6.0 1 1 216 1 . . . . . 5.0 0.0 5.0 1 1 217 1 . . . . . 6.0 0.0 6.0 1 1 218 1 . . . . . 5.0 0.0 5.0 1 1 219 1 . . . . . 5.0 0.0 5.0 1 1 220 1 . . . . . 5.0 0.0 5.0 1 1 221 1 . . . . . 5.0 0.0 5.0 1 1 222 1 . . . . . 6.0 0.0 6.0 1 1 223 1 . . . . . 2.5 0.0 2.5 1 1 224 1 . . . . . 5.0 0.0 5.0 1 1 225 1 . . . . . 5.0 0.0 5.0 1 1 226 1 . . . . . 5.0 0.0 5.0 1 1 227 1 . . . . . 5.0 0.0 5.0 1 1 228 1 . . . . . 6.0 0.0 6.0 1 1 229 1 . . . . . 6.0 0.0 6.0 1 1 230 1 . . . . . 6.0 0.0 6.0 1 1 231 1 . . . . . 6.0 0.0 6.0 1 1 232 1 . . . . . 6.0 0.0 6.0 1 1 233 1 . . . . . 6.0 0.0 6.0 1 1 234 1 . . . . . 6.0 0.0 6.0 1 1 235 1 . . . . . 6.0 0.0 6.0 1 1 236 1 . . . . . 6.0 0.0 6.0 1 1 237 1 . . . . . 5.0 0.0 5.0 1 1 238 1 . . . . . 5.0 0.0 5.0 1 1 239 1 . . . . . 5.0 0.0 5.0 1 1 240 1 . . . . . 5.0 0.0 5.0 1 1 241 1 . . . . . 5.0 0.0 5.0 1 1 242 1 . . . . . 5.0 0.0 5.0 1 1 243 1 . . . . . 5.0 0.0 5.0 1 1 244 1 . . . . . 5.0 0.0 5.0 1 1 245 1 . . . . . 2.5 0.0 2.5 1 1 246 1 . . . . . 6.0 0.0 6.0 1 1 247 1 . . . . . 5.0 0.0 5.0 1 1 248 1 . . . . . 5.0 0.0 5.0 1 1 249 1 . . . . . 5.0 0.0 5.0 1 1 250 1 . . . . . 5.0 0.0 5.0 1 1 251 1 . . . . . 5.0 0.0 5.0 1 1 252 1 . . . . . 6.0 0.0 6.0 1 1 253 1 . . . . . 5.0 0.0 5.0 1 1 254 1 . . . . . 5.0 0.0 5.0 1 1 255 1 . . . . . 5.0 0.0 5.0 1 1 256 1 . . . . . 6.0 0.0 6.0 1 1 257 1 . . . . . 5.0 0.0 5.0 1 1 258 1 . . . . . 6.0 0.0 6.0 1 1 259 1 . . . . . 5.0 0.0 5.0 1 1 260 1 . . . . . 3.5 0.0 3.5 1 1 261 1 . . . . . 5.0 0.0 5.0 1 1 262 1 . . . . . 6.0 0.0 6.0 1 1 263 1 . . . . . 6.0 0.0 6.0 1 1 264 1 . . . . . 6.0 0.0 6.0 1 1 265 1 . . . . . 5.0 0.0 5.0 1 1 266 1 . . . . . 5.0 0.0 5.0 1 1 267 1 . . . . . 3.5 0.0 3.5 1 1 268 1 . . . . . 5.0 0.0 5.0 1 1 269 1 . . . . . 5.0 0.0 5.0 1 1 270 1 . . . . . 3.5 0.0 3.5 1 1 271 1 . . . . . 5.0 0.0 5.0 1 1 272 1 . . . . . 5.0 0.0 5.0 1 1 273 1 . . . . . 6.0 0.0 6.0 1 1 274 1 . . . . . 5.0 0.0 5.0 1 1 275 1 . . . . . 5.0 0.0 5.0 1 1 276 1 . . . . . 6.0 0.0 6.0 1 1 277 1 . . . . . 5.0 0.0 5.0 1 1 278 1 . . . . . 6.0 0.0 6.0 1 1 279 1 . . . . . 6.0 0.0 6.0 1 1 280 1 . . . . . 6.0 0.0 6.0 1 1 281 1 . . . . . 5.0 0.0 5.0 1 1 282 1 . . . . . 6.0 0.0 6.0 1 1 283 1 . . . . . 5.0 0.0 5.0 1 1 284 1 . . . . . 3.5 0.0 3.5 1 1 285 1 . . . . . 5.0 0.0 5.0 1 1 286 1 . . . . . 5.0 0.0 5.0 1 1 287 1 . . . . . 6.0 0.0 6.0 1 1 288 1 . . . . . 6.0 0.0 6.0 1 1 289 1 . . . . . 5.0 0.0 5.0 1 1 290 1 . . . . . 5.0 0.0 5.0 1 1 291 1 . . . . . 6.0 0.0 6.0 1 1 292 1 . . . . . 6.0 0.0 6.0 1 1 293 1 . . . . . 6.0 0.0 6.0 1 1 294 1 . . . . . 5.0 0.0 5.0 1 1 295 1 . . . . . 6.0 0.0 6.0 1 1 296 1 . . . . . 6.0 0.0 6.0 1 1 297 1 . . . . . 5.0 0.0 5.0 1 1 298 1 . . . . . 5.0 0.0 5.0 1 1 299 1 . . . . . 6.0 0.0 6.0 1 1 300 1 . . . . . 6.0 0.0 6.0 1 1 301 1 . . . . . 6.0 0.0 6.0 1 1 302 1 . . . . . 5.0 0.0 5.0 1 1 303 1 . . . . . 5.0 0.0 5.0 1 1 304 1 . . . . . 6.0 0.0 6.0 1 1 305 1 . . . . . 5.0 0.0 5.0 1 1 306 1 . . . . . 6.0 0.0 6.0 1 1 307 1 . . . . . 6.0 0.0 6.0 1 1 308 1 . . . . . 6.0 0.0 6.0 1 1 309 1 . . . . . 6.0 0.0 6.0 1 1 310 1 . . . . . 6.0 0.0 6.0 1 1 311 1 . . . . . 6.0 0.0 6.0 1 1 312 1 . . . . . 5.0 0.0 5.0 1 1 313 1 . . . . . 3.5 0.0 3.5 1 1 314 1 . . . . . 5.0 0.0 5.0 1 1 315 1 . . . . . 5.0 0.0 5.0 1 1 316 1 . . . . . 6.0 0.0 6.0 1 1 317 1 . . . . . 6.0 0.0 6.0 1 1 318 1 . . . . . 6.0 0.0 6.0 1 1 319 1 . . . . . 6.0 0.0 6.0 1 1 320 1 . . . . . 6.0 0.0 6.0 1 1 321 1 . . . . . 6.0 0.0 6.0 1 1 322 1 . . . . . 6.0 0.0 6.0 1 1 323 1 . . . . . 5.0 0.0 5.0 1 1 324 1 . . . . . 2.5 0.0 2.5 1 1 325 1 . . . . . 5.0 0.0 5.0 1 1 326 1 . . . . . 6.0 0.0 6.0 1 1 327 1 . . . . . 5.0 0.0 5.0 1 1 328 1 . . . . . 5.0 0.0 5.0 1 1 329 1 . . . . . 3.5 0.0 3.5 1 1 330 1 . . . . . 6.0 0.0 6.0 1 1 331 1 . . . . . 3.5 0.0 3.5 1 1 332 1 . . . . . 5.0 0.0 5.0 1 1 333 1 . . . . . 6.0 0.0 6.0 1 1 334 1 . . . . . 6.0 0.0 6.0 1 1 335 1 . . . . . 5.0 0.0 5.0 1 1 336 1 . . . . . 6.0 0.0 6.0 1 1 337 1 . . . . . 2.5 0.0 2.5 1 1 338 1 . . . . . 6.0 0.0 6.0 1 1 339 1 . . . . . 3.5 0.0 3.5 1 1 340 1 . . . . . 5.0 0.0 5.0 1 1 341 1 . . . . . 6.0 0.0 6.0 1 1 342 1 . . . . . 5.0 0.0 5.0 1 1 343 1 . . . . . 5.0 0.0 5.0 1 1 344 1 . . . . . 5.0 0.0 5.0 1 1 345 1 . . . . . 5.0 0.0 5.0 1 1 346 1 . . . . . 3.5 0.0 3.5 1 1 347 1 . . . . . 5.0 0.0 5.0 1 1 348 1 . . . . . 5.0 0.0 5.0 1 1 349 1 . . . . . 6.0 0.0 6.0 1 1 350 1 . . . . . 5.0 0.0 5.0 1 1 351 1 . . . . . 3.5 0.0 3.5 1 1 352 1 . . . . . 5.0 0.0 5.0 1 1 353 1 . . . . . 5.0 0.0 5.0 1 1 354 1 . . . . . 5.0 0.0 5.0 1 1 355 1 . . . . . 6.0 0.0 6.0 1 1 356 1 . . . . . 5.0 0.0 5.0 1 1 357 1 . . . . . 5.0 0.0 5.0 1 1 358 1 . . . . . 6.0 0.0 6.0 1 1 359 1 . . . . . 6.0 0.0 6.0 1 1 360 1 . . . . . 3.5 0.0 3.5 1 1 361 1 . . . . . 5.0 0.0 5.0 1 1 362 1 . . . . . 6.0 0.0 6.0 1 1 363 1 . . . . . 5.0 0.0 5.0 1 1 364 1 . . . . . 6.0 0.0 6.0 1 1 365 1 . . . . . 6.0 0.0 6.0 1 1 366 1 . . . . . 6.0 0.0 6.0 1 1 367 1 . . . . . 5.0 0.0 5.0 1 1 368 1 . . . . . 5.0 0.0 5.0 1 1 369 1 . . . . . 6.0 0.0 6.0 1 1 370 1 . . . . . 6.0 0.0 6.0 1 1 371 1 . . . . . 5.0 0.0 5.0 1 1 372 1 . . . . . 6.0 0.0 6.0 1 1 373 1 . . . . . 6.0 0.0 6.0 1 1 374 1 . . . . . 5.0 0.0 5.0 1 1 375 1 . . . . . 5.0 0.0 5.0 1 1 376 1 . . . . . 2.5 0.0 2.5 1 1 377 1 . . . . . 5.0 0.0 5.0 1 1 378 1 . . . . . 5.0 0.0 5.0 1 1 379 1 . . . . . 6.0 0.0 6.0 1 1 380 1 . . . . . 6.0 0.0 6.0 1 1 381 1 . . . . . 5.0 0.0 5.0 1 1 382 1 . . . . . 5.0 0.0 5.0 1 1 383 1 . . . . . 6.0 0.0 6.0 1 1 384 1 . . . . . 6.0 0.0 6.0 1 1 385 1 . . . . . 2.5 0.0 2.5 1 1 386 1 . . . . . 5.0 0.0 5.0 1 1 387 1 . . . . . 5.0 0.0 5.0 1 1 388 1 . . . . . 5.0 0.0 5.0 1 1 389 1 . . . . . 5.0 0.0 5.0 1 1 390 1 . . . . . 5.0 0.0 5.0 1 1 391 1 . . . . . 6.0 0.0 6.0 1 1 392 1 . . . . . 6.0 0.0 6.0 1 1 393 1 . . . . . 6.0 0.0 6.0 1 1 394 1 . . . . . 6.0 0.0 6.0 1 1 395 1 . . . . . 5.0 0.0 5.0 1 1 396 1 . . . . . 6.0 0.0 6.0 1 1 397 1 . . . . . 5.0 0.0 5.0 1 1 398 1 . . . . . 3.5 0.0 3.5 1 1 399 1 . . . . . 6.0 0.0 6.0 1 1 400 1 . . . . . 5.0 0.0 5.0 1 1 401 1 . . . . . 6.0 0.0 6.0 1 1 402 1 . . . . . 5.0 0.0 5.0 1 1 403 1 . . . . . 5.0 0.0 5.0 1 1 404 1 . . . . . 5.0 0.0 5.0 1 1 405 1 . . . . . 5.0 0.0 5.0 1 1 406 1 . . . . . 5.0 0.0 5.0 1 1 407 1 . . . . . 5.0 0.0 5.0 1 1 408 1 . . . . . 5.0 0.0 5.0 1 1 409 1 . . . . . 5.0 0.0 5.0 1 1 410 1 . . . . . 6.0 0.0 6.0 1 1 411 1 . . . . . 6.0 0.0 6.0 1 1 412 1 . . . . . 6.0 0.0 6.0 1 1 413 1 . . . . . 5.0 0.0 5.0 1 1 414 1 . . . . . 5.0 0.0 5.0 1 1 415 1 . . . . . 5.0 0.0 5.0 1 1 416 1 . . . . . 6.0 0.0 6.0 1 1 417 1 . . . . . 5.0 0.0 5.0 1 1 418 1 . . . . . 5.0 0.0 5.0 1 1 419 1 . . . . . 6.0 0.0 6.0 1 1 420 1 . . . . . 3.5 0.0 3.5 1 1 421 1 . . . . . 6.0 0.0 6.0 1 1 422 1 . . . . . 5.0 0.0 5.0 1 1 423 1 . . . . . 5.0 0.0 5.0 1 1 424 1 . . . . . 5.0 0.0 5.0 1 1 425 1 . . . . . 5.0 0.0 5.0 1 1 426 1 . . . . . 6.0 0.0 6.0 1 1 427 1 . . . . . 2.5 0.0 2.5 1 1 428 1 . . . . . 6.0 0.0 6.0 1 1 429 1 . . . . . 3.5 0.0 3.5 1 1 430 1 . . . . . 5.0 0.0 5.0 1 1 431 1 . . . . . 5.0 0.0 5.0 1 1 432 1 . . . . . 6.0 0.0 6.0 1 1 433 1 . . . . . 5.0 0.0 5.0 1 1 434 1 . . . . . 2.5 0.0 2.5 1 1 435 1 . . . . . 3.5 0.0 3.5 1 1 436 1 . . . . . 5.0 0.0 5.0 1 1 437 1 . . . . . 5.0 0.0 5.0 1 1 438 1 . . . . . 5.0 0.0 5.0 1 1 439 1 . . . . . 6.0 0.0 6.0 1 1 440 1 . . . . . 2.5 0.0 2.5 1 1 441 1 . . . . . 5.0 0.0 5.0 1 1 442 1 . . . . . 5.0 0.0 5.0 1 1 443 1 . . . . . 5.0 0.0 5.0 1 1 444 1 . . . . . 5.0 0.0 5.0 1 1 445 1 . . . . . 2.5 0.0 2.5 1 1 446 1 . . . . . 5.0 0.0 5.0 1 1 447 1 . . . . . 5.0 0.0 5.0 1 1 448 1 . . . . . 6.0 0.0 6.0 1 1 449 1 . . . . . 5.0 0.0 5.0 1 1 450 1 . . . . . 6.0 0.0 6.0 1 1 451 1 . . . . . 5.0 0.0 5.0 1 1 452 1 . . . . . 3.5 0.0 3.5 1 1 453 1 . . . . . 5.0 0.0 5.0 1 1 454 1 . . . . . 2.5 0.0 2.5 1 1 455 1 . . . . . 6.0 0.0 6.0 1 1 456 1 . . . . . 5.0 0.0 5.0 1 1 457 1 . . . . . 6.0 0.0 6.0 1 1 458 1 . . . . . 5.0 0.0 5.0 1 1 459 1 . . . . . 6.0 0.0 6.0 1 1 460 1 . . . . . 5.0 0.0 5.0 1 1 461 1 . . . . . 6.0 0.0 6.0 1 1 462 1 . . . . . 5.0 0.0 5.0 1 1 463 1 . . . . . 6.0 0.0 6.0 1 1 464 1 . . . . . 6.0 0.0 6.0 1 1 465 1 . . . . . 6.0 0.0 6.0 1 1 466 1 . . . . . 3.5 0.0 3.5 1 1 467 1 . . . . . 6.0 0.0 6.0 1 1 468 1 . . . . . 6.0 0.0 6.0 1 1 469 1 . . . . . 3.5 0.0 3.5 1 1 470 1 . . . . . 5.0 0.0 5.0 1 1 471 1 . . . . . 6.0 0.0 6.0 1 1 472 1 . . . . . 6.0 0.0 6.0 1 1 473 1 . . . . . 5.0 0.0 5.0 1 1 474 1 . . . . . 6.0 0.0 6.0 1 1 475 1 . . . . . 6.0 0.0 6.0 1 1 476 1 . . . . . 3.5 0.0 3.5 1 1 477 1 . . . . . 5.0 0.0 5.0 1 1 478 1 . . . . . 6.0 0.0 6.0 1 1 479 1 . . . . . 6.0 0.0 6.0 1 1 480 1 . . . . . 6.0 0.0 6.0 1 1 481 1 . . . . . 6.0 0.0 6.0 1 1 482 1 . . . . . 6.0 0.0 6.0 1 1 483 1 . . . . . 6.0 0.0 6.0 1 1 484 1 . . . . . 6.0 0.0 6.0 1 1 485 1 . . . . . 3.5 0.0 3.5 1 1 486 1 . . . . . 5.0 0.0 5.0 1 1 487 1 . . . . . 5.0 0.0 5.0 1 1 488 1 . . . . . 5.0 0.0 5.0 1 1 489 1 . . . . . 5.0 0.0 5.0 1 1 490 1 . . . . . 5.0 0.0 5.0 1 1 491 1 . . . . . 5.0 0.0 5.0 1 1 492 1 . . . . . 5.0 0.0 5.0 1 1 493 1 . . . . . 6.0 0.0 6.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _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 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 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 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 9 CYS HA . 9 . HA 1 2 1 1 2 1 1 16 LYS QB . 16 . HB# 1 2 1 1 2 1 1 17 PRO QB . 17 . HB# 1 2 2 1 1 1 1 9 CYS QB . 9 . HB# 1 2 2 1 2 1 1 16 LYS QB . 16 . HB# 1 2 2 1 2 1 1 16 LYS QD . 16 . HD# 1 2 3 1 1 1 1 11 ARG H . 11 . HN 1 2 3 1 2 1 1 14 LYS QB . 14 . HB# 1 2 3 1 2 1 1 16 LYS QD . 16 . HD# 1 2 4 1 1 1 1 13 CYS H . 13 . HN 1 2 4 1 2 1 1 14 LYS QB . 14 . HB# 1 2 4 1 2 1 1 16 LYS QD . 16 . HD# 1 2 5 1 1 1 1 11 ARG QG . 11 . HG# 1 2 5 1 1 1 1 14 LYS QG . 14 . HG# 1 2 5 1 1 1 1 16 LYS QG . 16 . HG# 1 2 5 1 2 1 1 13 CYS H . 13 . HN 1 2 6 1 1 1 1 23 TRP HH2 . 23 . HH2 1 2 6 1 2 1 1 25 THR HA . 25 . HA 1 2 6 1 2 1 1 25 THR HB . 25 . HB 1 2 7 1 1 1 1 23 TRP HD1 . 23 . HD1 1 2 7 1 2 1 1 25 THR HA . 25 . HA 1 2 7 1 2 1 1 25 THR HB . 25 . HB 1 2 8 1 1 1 1 23 TRP HZ2 . 23 . HZ2 1 2 8 1 2 1 1 25 THR HA . 25 . HA 1 2 8 1 2 1 1 25 THR HB . 25 . HB 1 2 9 1 1 1 1 23 TRP HE1 . 23 . HE1 1 2 9 1 2 1 1 25 THR HA . 25 . HA 1 2 9 1 2 1 1 25 THR HB . 25 . HB 1 2 10 1 1 1 1 22 CYS QB . 22 . HB# 1 2 10 1 1 1 1 39 CYS QB . 39 . HB# 1 2 10 1 2 1 1 23 TRP HE1 . 23 . HE1 1 2 11 1 1 1 1 8 PRO QB . 8 . HB# 1 2 11 1 1 1 1 17 PRO QG . 17 . HG# 1 2 11 1 1 1 1 38 GLU QB . 38 . HB# 1 2 11 1 1 1 1 43 PRO QB . 43 . HB# 1 2 11 1 1 1 1 43 PRO QG . 43 . HG# 1 2 11 1 2 1 1 23 TRP HZ2 . 23 . HZ2 1 2 12 1 1 1 1 8 PRO QG . 8 . HG# 1 2 12 1 1 1 1 27 VAL HB . 27 . HB 1 2 12 1 1 1 1 38 GLU QG . 38 . HG# 1 2 12 1 1 1 1 43 PRO QB . 43 . HB# 1 2 12 1 2 1 1 23 TRP HH2 . 23 . HH2 1 2 13 1 1 1 1 22 CYS HA . 22 . HA 1 2 13 1 1 1 1 29 SER HA . 29 . HA 1 2 13 1 2 1 1 24 LYS QB . 24 . HB# 1 2 14 1 1 1 1 25 THR MG . 25 . HG2# 1 2 14 1 1 1 1 27 VAL QG . 27 . HG# 1 2 14 1 2 1 1 26 SER HA . 26 . HA 1 2 15 1 1 1 1 25 THR HA . 25 . HA 1 2 15 1 1 1 1 25 THR HB . 25 . HB 1 2 15 1 2 1 1 26 SER QB . 26 . HB# 1 2 16 1 1 1 1 25 THR HA . 25 . HA 1 2 16 1 1 1 1 25 THR HB . 25 . HB 1 2 16 1 2 1 1 27 VAL H . 27 . HN 1 2 17 1 1 1 1 25 THR HA . 25 . HA 1 2 17 1 1 1 1 25 THR HB . 25 . HB 1 2 17 1 2 1 1 28 SER H . 28 . HN 1 2 18 1 1 1 1 22 CYS HA . 22 . HA 1 2 18 1 1 1 1 29 SER HA . 29 . HA 1 2 18 1 2 1 1 30 HIS HD2 . 30 . HD2 1 2 19 1 1 1 1 29 SER QB . 29 . HB# 1 2 19 1 1 1 1 43 PRO QD . 43 . HD# 1 2 19 1 2 1 1 30 HIS HD2 . 30 . HD2 1 2 20 1 1 1 1 30 HIS QB . 30 . HB# 1 2 20 1 2 1 1 40 PRO QD . 40 . HD# 1 2 20 1 2 1 1 44 GLY QA . 44 . HA# 1 2 21 1 1 1 1 23 TRP HE3 . 23 . HE3 1 2 21 1 1 1 1 23 TRP HH2 . 23 . HH2 1 2 21 1 2 1 1 30 HIS HE1 . 30 . HE1 1 2 22 1 1 1 1 25 THR MG . 25 . HG2# 1 2 22 1 1 1 1 27 VAL QG . 27 . HG# 1 2 22 1 2 1 1 30 HIS HE1 . 30 . HE1 1 2 23 1 1 1 1 25 THR MG . 25 . HG2# 1 2 23 1 1 1 1 27 VAL QG . 27 . HG# 1 2 23 1 2 1 1 30 HIS HD2 . 30 . HD2 1 2 24 1 1 1 1 29 SER H . 29 . HN 1 2 24 1 1 1 1 34 GLY H . 34 . HN 1 2 24 1 1 1 1 45 ASN H . 45 . HN 1 2 24 1 2 1 1 31 TYR QE . 31 . HE# 1 2 25 1 1 1 1 16 LYS QB . 16 . HB# 1 2 25 1 1 1 1 40 PRO QB . 40 . HB# 1 2 25 1 2 1 1 32 CYS H . 32 . HN 1 2 26 1 1 1 1 31 TYR QD . 31 . HD# 1 2 26 1 1 1 1 42 TYR QD . 42 . HD# 1 2 26 1 2 1 1 33 THR MG . 33 . HG2# 1 2 27 1 1 1 1 38 GLU HA . 38 . HA 1 2 27 1 1 1 1 40 PRO HA . 40 . HA 1 2 27 1 2 1 1 39 CYS HA . 39 . HA 1 2 28 1 1 1 1 38 GLU HA . 38 . HA 1 2 28 1 1 1 1 40 PRO HA . 40 . HA 1 2 28 1 2 1 1 39 CYS QB . 39 . HB# 1 2 29 1 1 1 1 30 HIS HA . 30 . HA 1 2 29 1 1 1 1 32 CYS HA . 32 . HA 1 2 29 1 2 1 1 40 PRO QB . 40 . HB# 1 2 30 1 1 1 1 30 HIS HA . 30 . HA 1 2 30 1 1 1 1 32 CYS HA . 32 . HA 1 2 30 1 2 1 1 40 PRO QG . 40 . HG# 1 2 31 1 1 1 1 31 TYR QD . 31 . HD# 1 2 31 1 1 1 1 42 TYR QD . 42 . HD# 1 2 31 1 2 1 1 44 GLY H . 44 . HN 1 2 32 1 1 1 1 31 TYR QD . 31 . HD# 1 2 32 1 1 1 1 42 TYR QD . 42 . HD# 1 2 32 1 2 1 1 44 GLY QA . 44 . HA# 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 . . . . . 5.0 0.0 5.0 1 2 2 1 . . . . . 6.0 0.0 6.0 1 2 3 1 . . . . . 5.0 0.0 5.0 1 2 4 1 . . . . . 5.0 0.0 5.0 1 2 5 1 . . . . . 6.0 0.0 6.0 1 2 6 1 . . . . . 6.0 0.0 6.0 1 2 7 1 . . . . . 6.0 0.0 6.0 1 2 8 1 . . . . . 6.0 0.0 6.0 1 2 9 1 . . . . . 6.0 0.0 6.0 1 2 10 1 . . . . . 6.0 0.0 6.0 1 2 11 1 . . . . . 5.0 0.0 5.0 1 2 12 1 . . . . . 6.0 0.0 6.0 1 2 13 1 . . . . . 6.0 0.0 6.0 1 2 14 1 . . . . . 6.0 0.0 6.0 1 2 15 1 . . . . . 6.0 0.0 6.0 1 2 16 1 . . . . . 5.0 0.0 5.0 1 2 17 1 . . . . . 5.0 0.0 5.0 1 2 18 1 . . . . . 6.0 0.0 6.0 1 2 19 1 . . . . . 6.0 0.0 6.0 1 2 20 1 . . . . . 6.0 0.0 6.0 1 2 21 1 . . . . . 6.0 0.0 6.0 1 2 22 1 . . . . . 6.0 0.0 6.0 1 2 23 1 . . . . . 6.0 0.0 6.0 1 2 24 1 . . . . . 6.0 0.0 6.0 1 2 25 1 . . . . . 6.0 0.0 6.0 1 2 26 1 . . . . . 6.0 0.0 6.0 1 2 27 1 . . . . . 6.0 0.0 6.0 1 2 28 1 . . . . . 5.0 0.0 5.0 1 2 29 1 . . . . . 6.0 0.0 6.0 1 2 30 1 . . . . . 5.0 0.0 5.0 1 2 31 1 . . . . . 5.0 0.0 5.0 1 2 32 1 . . . . . 5.0 0.0 5.0 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_4_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 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 9 CYS O . 9 . O 1 3 1 1 2 1 1 16 LYS H . 16 . HN 1 3 2 1 1 1 1 9 CYS O . 9 . O 1 3 2 1 2 1 1 16 LYS N . 16 . N 1 3 3 1 1 1 1 19 GLY H . 19 . HN 1 3 3 1 2 1 1 32 CYS O . 32 . O 1 3 4 1 1 1 1 19 GLY N . 19 . N 1 3 4 1 2 1 1 32 CYS O . 32 . O 1 3 5 1 1 1 1 20 THR O . 20 . O 1 3 5 1 2 1 1 32 CYS H . 32 . HN 1 3 6 1 1 1 1 20 THR O . 20 . O 1 3 6 1 2 1 1 32 CYS N . 32 . N 1 3 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 . . . . . 2.0 0.0 2.3 1 3 2 1 . . . . . 3.0 2.5 3.3 1 3 3 1 . . . . . 2.0 0.0 2.3 1 3 4 1 . . . . . 3.0 2.5 3.3 1 3 5 1 . . . . . 2.0 0.0 2.3 1 3 6 1 . . . . . 3.0 2.5 3.3 1 3 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 ALA C C -19.272 -5.083 2.129 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C -20.657 -4.585 2.528 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C -21.158 -5.344 3.747 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA H1 H -21.509 -5.678 1.009 1.00 . A A . 1 ALA H1 1 1 1 5 1 1 1 ALA H2 H -22.575 -4.584 1.786 1.00 . A A . 1 ALA H2 1 1 1 6 1 1 1 ALA H3 H -21.386 -3.995 0.698 1.00 . A A . 1 ALA H3 1 1 1 7 1 1 1 ALA HA H -20.588 -3.539 2.790 1.00 . A A . 1 ALA HA 1 1 1 8 1 1 1 ALA HB1 H -22.111 -4.940 4.056 1.00 . A A . 1 ALA HB1 1 1 1 9 1 1 1 ALA HB2 H -21.274 -6.389 3.498 1.00 . A A . 1 ALA HB2 1 1 1 10 1 1 1 ALA HB3 H -20.446 -5.243 4.553 1.00 . A A . 1 ALA HB3 1 1 1 11 1 1 1 ALA N N -21.618 -4.723 1.404 1.00 . A A . 1 ALA N 1 1 1 12 1 1 1 ALA O O -19.088 -6.263 1.832 1.00 . A A . 1 ALA O 1 1 1 13 1 1 2 MET C C -15.932 -3.797 2.653 1.00 . A A . 2 MET C 1 1 1 14 1 1 2 MET CA C -16.932 -4.522 1.759 1.00 . A A . 2 MET CA 1 1 1 15 1 1 2 MET CB C -16.668 -4.176 0.293 1.00 . A A . 2 MET CB 1 1 1 16 1 1 2 MET CE C -19.128 -3.902 -1.944 1.00 . A A . 2 MET CE 1 1 1 17 1 1 2 MET CG C -17.080 -5.273 -0.675 1.00 . A A . 2 MET CG 1 1 1 18 1 1 2 MET H H -18.510 -3.250 2.369 1.00 . A A . 2 MET H 1 1 1 19 1 1 2 MET HA H -16.814 -5.587 1.895 1.00 . A A . 2 MET HA 1 1 1 20 1 1 2 MET HB2 H -17.217 -3.280 0.042 1.00 . A A . 2 MET HB2 1 1 1 21 1 1 2 MET HB3 H -15.612 -3.989 0.163 1.00 . A A . 2 MET HB3 1 1 1 22 1 1 2 MET HE1 H -19.273 -3.857 -0.875 1.00 . A A . 2 MET HE1 1 1 1 23 1 1 2 MET HE2 H -19.166 -2.904 -2.355 1.00 . A A . 2 MET HE2 1 1 1 24 1 1 2 MET HE3 H -19.906 -4.505 -2.388 1.00 . A A . 2 MET HE3 1 1 1 25 1 1 2 MET HG2 H -16.255 -5.960 -0.792 1.00 . A A . 2 MET HG2 1 1 1 26 1 1 2 MET HG3 H -17.929 -5.799 -0.262 1.00 . A A . 2 MET HG3 1 1 1 27 1 1 2 MET N N -18.301 -4.175 2.123 1.00 . A A . 2 MET N 1 1 1 28 1 1 2 MET O O -15.559 -2.655 2.386 1.00 . A A . 2 MET O 1 1 1 29 1 1 2 MET SD S -17.531 -4.633 -2.299 1.00 . A A . 2 MET SD 1 1 1 30 1 1 3 ASP C C -13.134 -4.407 4.377 1.00 . A A . 3 ASP C 1 1 1 31 1 1 3 ASP CA C -14.542 -3.889 4.650 1.00 . A A . 3 ASP CA 1 1 1 32 1 1 3 ASP CB C -14.946 -4.208 6.090 1.00 . A A . 3 ASP CB 1 1 1 33 1 1 3 ASP CG C -14.450 -3.166 7.074 1.00 . A A . 3 ASP CG 1 1 1 34 1 1 3 ASP H H -15.834 -5.376 3.876 1.00 . A A . 3 ASP H 1 1 1 35 1 1 3 ASP HA H -14.552 -2.818 4.511 1.00 . A A . 3 ASP HA 1 1 1 36 1 1 3 ASP HB2 H -16.023 -4.252 6.155 1.00 . A A . 3 ASP HB2 1 1 1 37 1 1 3 ASP HB3 H -14.532 -5.166 6.370 1.00 . A A . 3 ASP HB3 1 1 1 38 1 1 3 ASP N N -15.500 -4.469 3.716 1.00 . A A . 3 ASP N 1 1 1 39 1 1 3 ASP O O -12.327 -4.554 5.295 1.00 . A A . 3 ASP O 1 1 1 40 1 1 3 ASP OD1 O -14.714 -1.965 6.850 1.00 . A A . 3 ASP OD1 1 1 1 41 1 1 3 ASP OD2 O -13.798 -3.550 8.067 1.00 . A A . 3 ASP OD2 1 1 1 42 1 1 4 CYS C C -10.591 -4.037 2.366 1.00 . A A . 4 CYS C 1 1 1 43 1 1 4 CYS CA C -11.534 -5.185 2.715 1.00 . A A . 4 CYS CA 1 1 1 44 1 1 4 CYS CB C -11.665 -6.133 1.521 1.00 . A A . 4 CYS CB 1 1 1 45 1 1 4 CYS H H -13.531 -4.545 2.422 1.00 . A A . 4 CYS H 1 1 1 46 1 1 4 CYS HA H -11.124 -5.730 3.552 1.00 . A A . 4 CYS HA 1 1 1 47 1 1 4 CYS HB2 H -12.456 -5.781 0.877 1.00 . A A . 4 CYS HB2 1 1 1 48 1 1 4 CYS HB3 H -10.735 -6.136 0.971 1.00 . A A . 4 CYS HB3 1 1 1 49 1 1 4 CYS N N -12.846 -4.683 3.109 1.00 . A A . 4 CYS N 1 1 1 50 1 1 4 CYS O O -9.373 -4.164 2.490 1.00 . A A . 4 CYS O 1 1 1 51 1 1 4 CYS SG S -12.047 -7.856 1.975 1.00 . A A . 4 CYS SG 1 1 1 52 1 1 5 THR C C -9.453 -2.067 0.381 1.00 . A A . 5 THR C 1 1 1 53 1 1 5 THR CA C -10.366 -1.750 1.561 1.00 . A A . 5 THR CA 1 1 1 54 1 1 5 THR CB C -9.536 -1.275 2.756 1.00 . A A . 5 THR CB 1 1 1 55 1 1 5 THR CG2 C -9.378 0.229 2.815 1.00 . A A . 5 THR CG2 1 1 1 56 1 1 5 THR H H -12.136 -2.875 1.850 1.00 . A A . 5 THR H 1 1 1 57 1 1 5 THR HA H -11.046 -0.963 1.273 1.00 . A A . 5 THR HA 1 1 1 58 1 1 5 THR HB H -8.548 -1.709 2.691 1.00 . A A . 5 THR HB 1 1 1 59 1 1 5 THR HG1 H -9.710 -2.507 4.269 1.00 . A A . 5 THR HG1 1 1 1 60 1 1 5 THR HG21 H -9.078 0.598 1.846 1.00 . A A . 5 THR HG21 1 1 1 61 1 1 5 THR HG22 H -10.319 0.678 3.096 1.00 . A A . 5 THR HG22 1 1 1 62 1 1 5 THR HG23 H -8.625 0.483 3.547 1.00 . A A . 5 THR HG23 1 1 1 63 1 1 5 THR N N -11.160 -2.917 1.929 1.00 . A A . 5 THR N 1 1 1 64 1 1 5 THR O O -8.230 -2.092 0.516 1.00 . A A . 5 THR O 1 1 1 65 1 1 5 THR OG1 O -10.125 -1.694 3.974 1.00 . A A . 5 THR OG1 1 1 1 66 1 1 6 THR C C -8.317 -1.512 -2.326 1.00 . A A . 6 THR C 1 1 1 67 1 1 6 THR CA C -9.296 -2.632 -1.982 1.00 . A A . 6 THR CA 1 1 1 68 1 1 6 THR CB C -10.243 -2.879 -3.157 1.00 . A A . 6 THR CB 1 1 1 69 1 1 6 THR CG2 C -10.587 -4.341 -3.348 1.00 . A A . 6 THR CG2 1 1 1 70 1 1 6 THR H H -11.034 -2.280 -0.825 1.00 . A A . 6 THR H 1 1 1 71 1 1 6 THR HA H -8.735 -3.534 -1.788 1.00 . A A . 6 THR HA 1 1 1 72 1 1 6 THR HB H -9.774 -2.529 -4.065 1.00 . A A . 6 THR HB 1 1 1 73 1 1 6 THR HG1 H -12.019 -2.303 -3.747 1.00 . A A . 6 THR HG1 1 1 1 74 1 1 6 THR HG21 H -9.985 -4.943 -2.683 1.00 . A A . 6 THR HG21 1 1 1 75 1 1 6 THR HG22 H -11.633 -4.496 -3.127 1.00 . A A . 6 THR HG22 1 1 1 76 1 1 6 THR HG23 H -10.388 -4.627 -4.371 1.00 . A A . 6 THR HG23 1 1 1 77 1 1 6 THR N N -10.055 -2.313 -0.778 1.00 . A A . 6 THR N 1 1 1 78 1 1 6 THR O O -8.606 -0.334 -2.114 1.00 . A A . 6 THR O 1 1 1 79 1 1 6 THR OG1 O -11.457 -2.171 -2.981 1.00 . A A . 6 THR OG1 1 1 1 80 1 1 7 GLY C C -4.772 -1.528 -3.359 1.00 . A A . 7 GLY C 1 1 1 81 1 1 7 GLY CA C -6.152 -0.912 -3.222 1.00 . A A . 7 GLY CA 1 1 1 82 1 1 7 GLY H H -6.986 -2.845 -3.000 1.00 . A A . 7 GLY H 1 1 1 83 1 1 7 GLY HA2 H -6.118 -0.145 -2.462 1.00 . A A . 7 GLY HA2 1 1 1 84 1 1 7 GLY HA3 H -6.429 -0.461 -4.163 1.00 . A A . 7 GLY HA3 1 1 1 85 1 1 7 GLY N N -7.159 -1.891 -2.856 1.00 . A A . 7 GLY N 1 1 1 86 1 1 7 GLY O O -4.598 -2.721 -3.109 1.00 . A A . 7 GLY O 1 1 1 87 1 1 8 PRO C C -1.728 -1.542 -2.579 1.00 . A A . 8 PRO C 1 1 1 88 1 1 8 PRO CA C -2.392 -1.232 -3.919 1.00 . A A . 8 PRO CA 1 1 1 89 1 1 8 PRO CB C -1.680 -0.081 -4.632 1.00 . A A . 8 PRO CB 1 1 1 90 1 1 8 PRO CD C -3.874 0.699 -4.075 1.00 . A A . 8 PRO CD 1 1 1 91 1 1 8 PRO CG C -2.443 1.137 -4.244 1.00 . A A . 8 PRO CG 1 1 1 92 1 1 8 PRO HA H -2.367 -2.115 -4.541 1.00 . A A . 8 PRO HA 1 1 1 93 1 1 8 PRO HB2 H -0.653 -0.029 -4.301 1.00 . A A . 8 PRO HB2 1 1 1 94 1 1 8 PRO HB3 H -1.711 -0.241 -5.699 1.00 . A A . 8 PRO HB3 1 1 1 95 1 1 8 PRO HD2 H -4.340 1.239 -3.264 1.00 . A A . 8 PRO HD2 1 1 1 96 1 1 8 PRO HD3 H -4.424 0.847 -4.993 1.00 . A A . 8 PRO HD3 1 1 1 97 1 1 8 PRO HG2 H -2.060 1.529 -3.315 1.00 . A A . 8 PRO HG2 1 1 1 98 1 1 8 PRO HG3 H -2.369 1.880 -5.024 1.00 . A A . 8 PRO HG3 1 1 1 99 1 1 8 PRO N N -3.761 -0.736 -3.756 1.00 . A A . 8 PRO N 1 1 1 100 1 1 8 PRO O O -0.865 -2.416 -2.492 1.00 . A A . 8 PRO O 1 1 1 101 1 1 9 CYS C C -2.239 -2.271 0.461 1.00 . A A . 9 CYS C 1 1 1 102 1 1 9 CYS CA C -1.598 -1.047 -0.194 1.00 . A A . 9 CYS CA 1 1 1 103 1 1 9 CYS CB C -1.819 0.191 0.680 1.00 . A A . 9 CYS CB 1 1 1 104 1 1 9 CYS H H -2.843 -0.157 -1.661 1.00 . A A . 9 CYS H 1 1 1 105 1 1 9 CYS HA H -0.538 -1.222 -0.294 1.00 . A A . 9 CYS HA 1 1 1 106 1 1 9 CYS HB2 H -2.380 0.923 0.119 1.00 . A A . 9 CYS HB2 1 1 1 107 1 1 9 CYS HB3 H -2.384 -0.091 1.557 1.00 . A A . 9 CYS HB3 1 1 1 108 1 1 9 CYS N N -2.145 -0.832 -1.533 1.00 . A A . 9 CYS N 1 1 1 109 1 1 9 CYS O O -1.731 -2.796 1.452 1.00 . A A . 9 CYS O 1 1 1 110 1 1 9 CYS SG S -0.282 0.992 1.247 1.00 . A A . 9 CYS SG 1 1 1 111 1 1 10 CYS C C -3.696 -5.135 -0.363 1.00 . A A . 10 CYS C 1 1 1 112 1 1 10 CYS CA C -4.073 -3.878 0.417 1.00 . A A . 10 CYS CA 1 1 1 113 1 1 10 CYS CB C -5.583 -3.643 0.330 1.00 . A A . 10 CYS CB 1 1 1 114 1 1 10 CYS H H -3.715 -2.258 -0.890 1.00 . A A . 10 CYS H 1 1 1 115 1 1 10 CYS HA H -3.793 -4.009 1.452 1.00 . A A . 10 CYS HA 1 1 1 116 1 1 10 CYS HB2 H -5.762 -2.612 0.073 1.00 . A A . 10 CYS HB2 1 1 1 117 1 1 10 CYS HB3 H -5.994 -4.275 -0.444 1.00 . A A . 10 CYS HB3 1 1 1 118 1 1 10 CYS N N -3.359 -2.719 -0.103 1.00 . A A . 10 CYS N 1 1 1 119 1 1 10 CYS O O -3.987 -5.246 -1.554 1.00 . A A . 10 CYS O 1 1 1 120 1 1 10 CYS SG S -6.493 -3.994 1.870 1.00 . A A . 10 CYS SG 1 1 1 121 1 1 11 ARG C C -3.817 -8.032 -0.980 1.00 . A A . 11 ARG C 1 1 1 122 1 1 11 ARG CA C -2.633 -7.327 -0.323 1.00 . A A . 11 ARG CA 1 1 1 123 1 1 11 ARG CB C -1.979 -8.254 0.703 1.00 . A A . 11 ARG CB 1 1 1 124 1 1 11 ARG CD C 0.023 -9.696 1.180 1.00 . A A . 11 ARG CD 1 1 1 125 1 1 11 ARG CG C -0.918 -9.167 0.110 1.00 . A A . 11 ARG CG 1 1 1 126 1 1 11 ARG CZ C 1.357 -11.414 0.022 1.00 . A A . 11 ARG CZ 1 1 1 127 1 1 11 ARG H H -2.843 -5.934 1.260 1.00 . A A . 11 ARG H 1 1 1 128 1 1 11 ARG HA H -1.912 -7.085 -1.085 1.00 . A A . 11 ARG HA 1 1 1 129 1 1 11 ARG HB2 H -1.516 -7.652 1.471 1.00 . A A . 11 ARG HB2 1 1 1 130 1 1 11 ARG HB3 H -2.743 -8.870 1.153 1.00 . A A . 11 ARG HB3 1 1 1 131 1 1 11 ARG HD2 H 0.901 -9.070 1.211 1.00 . A A . 11 ARG HD2 1 1 1 132 1 1 11 ARG HD3 H -0.481 -9.657 2.135 1.00 . A A . 11 ARG HD3 1 1 1 133 1 1 11 ARG HE H -0.005 -11.783 1.432 1.00 . A A . 11 ARG HE 1 1 1 134 1 1 11 ARG HG2 H -1.404 -10.001 -0.372 1.00 . A A . 11 ARG HG2 1 1 1 135 1 1 11 ARG HG3 H -0.345 -8.611 -0.618 1.00 . A A . 11 ARG HG3 1 1 1 136 1 1 11 ARG HH11 H 1.740 -9.517 -0.567 1.00 . A A . 11 ARG HH11 1 1 1 137 1 1 11 ARG HH12 H 2.666 -10.743 -1.366 1.00 . A A . 11 ARG HH12 1 1 1 138 1 1 11 ARG HH21 H 1.211 -13.397 0.383 1.00 . A A . 11 ARG HH21 1 1 1 139 1 1 11 ARG HH22 H 2.366 -12.946 -0.827 1.00 . A A . 11 ARG HH22 1 1 1 140 1 1 11 ARG N N -3.047 -6.079 0.312 1.00 . A A . 11 ARG N 1 1 1 141 1 1 11 ARG NE N 0.432 -11.074 0.916 1.00 . A A . 11 ARG NE 1 1 1 142 1 1 11 ARG NH1 N 1.971 -10.481 -0.696 1.00 . A A . 11 ARG NH1 1 1 1 143 1 1 11 ARG NH2 N 1.671 -12.690 -0.155 1.00 . A A . 11 ARG NH2 1 1 1 144 1 1 11 ARG O O -3.647 -8.827 -1.904 1.00 . A A . 11 ARG O 1 1 1 145 1 1 12 GLN C C -7.401 -8.028 -0.068 1.00 . A A . 12 GLN C 1 1 1 146 1 1 12 GLN CA C -6.242 -8.325 -1.012 1.00 . A A . 12 GLN CA 1 1 1 147 1 1 12 GLN CB C -6.084 -9.840 -1.186 1.00 . A A . 12 GLN CB 1 1 1 148 1 1 12 GLN CD C -4.982 -11.493 -2.746 1.00 . A A . 12 GLN CD 1 1 1 149 1 1 12 GLN CG C -5.865 -10.266 -2.628 1.00 . A A . 12 GLN CG 1 1 1 150 1 1 12 GLN H H -5.078 -7.091 0.247 1.00 . A A . 12 GLN H 1 1 1 151 1 1 12 GLN HA H -6.449 -7.876 -1.972 1.00 . A A . 12 GLN HA 1 1 1 152 1 1 12 GLN HB2 H -5.237 -10.171 -0.603 1.00 . A A . 12 GLN HB2 1 1 1 153 1 1 12 GLN HB3 H -6.975 -10.329 -0.820 1.00 . A A . 12 GLN HB3 1 1 1 154 1 1 12 GLN HE21 H -3.539 -10.582 -1.724 1.00 . A A . 12 GLN HE21 1 1 1 155 1 1 12 GLN HE22 H -3.191 -12.194 -2.241 1.00 . A A . 12 GLN HE22 1 1 1 156 1 1 12 GLN HG2 H -6.824 -10.488 -3.074 1.00 . A A . 12 GLN HG2 1 1 1 157 1 1 12 GLN HG3 H -5.400 -9.452 -3.164 1.00 . A A . 12 GLN HG3 1 1 1 158 1 1 12 GLN N N -5.015 -7.732 -0.490 1.00 . A A . 12 GLN N 1 1 1 159 1 1 12 GLN NE2 N -3.783 -11.415 -2.180 1.00 . A A . 12 GLN NE2 1 1 1 160 1 1 12 GLN O O -8.547 -7.885 -0.494 1.00 . A A . 12 GLN O 1 1 1 161 1 1 12 GLN OE1 O -5.372 -12.499 -3.338 1.00 . A A . 12 GLN OE1 1 1 1 162 1 1 13 CYS C C -7.429 -7.536 3.616 1.00 . A A . 13 CYS C 1 1 1 163 1 1 13 CYS CA C -8.081 -7.647 2.241 1.00 . A A . 13 CYS CA 1 1 1 164 1 1 13 CYS CB C -9.155 -8.736 2.258 1.00 . A A . 13 CYS CB 1 1 1 165 1 1 13 CYS H H -6.147 -8.056 1.486 1.00 . A A . 13 CYS H 1 1 1 166 1 1 13 CYS HA H -8.543 -6.702 1.997 1.00 . A A . 13 CYS HA 1 1 1 167 1 1 13 CYS HB2 H -9.516 -8.892 1.252 1.00 . A A . 13 CYS HB2 1 1 1 168 1 1 13 CYS HB3 H -8.721 -9.654 2.626 1.00 . A A . 13 CYS HB3 1 1 1 169 1 1 13 CYS N N -7.082 -7.933 1.218 1.00 . A A . 13 CYS N 1 1 1 170 1 1 13 CYS O O -8.019 -7.920 4.626 1.00 . A A . 13 CYS O 1 1 1 171 1 1 13 CYS SG S -10.594 -8.343 3.306 1.00 . A A . 13 CYS SG 1 1 1 172 1 1 14 LYS C C -4.429 -5.749 4.765 1.00 . A A . 14 LYS C 1 1 1 173 1 1 14 LYS CA C -5.478 -6.846 4.896 1.00 . A A . 14 LYS CA 1 1 1 174 1 1 14 LYS CB C -4.810 -8.163 5.297 1.00 . A A . 14 LYS CB 1 1 1 175 1 1 14 LYS CD C -3.728 -7.374 7.423 1.00 . A A . 14 LYS CD 1 1 1 176 1 1 14 LYS CE C -3.661 -7.534 8.933 1.00 . A A . 14 LYS CE 1 1 1 177 1 1 14 LYS CG C -4.704 -8.358 6.801 1.00 . A A . 14 LYS CG 1 1 1 178 1 1 14 LYS H H -5.788 -6.719 2.810 1.00 . A A . 14 LYS H 1 1 1 179 1 1 14 LYS HA H -6.185 -6.563 5.661 1.00 . A A . 14 LYS HA 1 1 1 180 1 1 14 LYS HB2 H -5.383 -8.983 4.889 1.00 . A A . 14 LYS HB2 1 1 1 181 1 1 14 LYS HB3 H -3.814 -8.189 4.881 1.00 . A A . 14 LYS HB3 1 1 1 182 1 1 14 LYS HD2 H -2.745 -7.545 7.009 1.00 . A A . 14 LYS HD2 1 1 1 183 1 1 14 LYS HD3 H -4.048 -6.369 7.190 1.00 . A A . 14 LYS HD3 1 1 1 184 1 1 14 LYS HE2 H -4.656 -7.724 9.306 1.00 . A A . 14 LYS HE2 1 1 1 185 1 1 14 LYS HE3 H -3.024 -8.375 9.164 1.00 . A A . 14 LYS HE3 1 1 1 186 1 1 14 LYS HG2 H -5.678 -8.212 7.243 1.00 . A A . 14 LYS HG2 1 1 1 187 1 1 14 LYS HG3 H -4.364 -9.364 7.000 1.00 . A A . 14 LYS HG3 1 1 1 188 1 1 14 LYS HZ1 H -3.583 -5.467 9.221 1.00 . A A . 14 LYS HZ1 1 1 1 189 1 1 14 LYS HZ2 H -3.286 -6.365 10.623 1.00 . A A . 14 LYS HZ2 1 1 1 190 1 1 14 LYS HZ3 H -2.094 -6.244 9.429 1.00 . A A . 14 LYS HZ3 1 1 1 191 1 1 14 LYS N N -6.208 -7.008 3.647 1.00 . A A . 14 LYS N 1 1 1 192 1 1 14 LYS NZ N -3.118 -6.318 9.598 1.00 . A A . 14 LYS NZ 1 1 1 193 1 1 14 LYS O O -3.494 -5.861 3.972 1.00 . A A . 14 LYS O 1 1 1 194 1 1 15 LEU C C -2.214 -4.041 5.556 1.00 . A A . 15 LEU C 1 1 1 195 1 1 15 LEU CA C -3.661 -3.561 5.523 1.00 . A A . 15 LEU CA 1 1 1 196 1 1 15 LEU CB C -3.932 -2.633 6.707 1.00 . A A . 15 LEU CB 1 1 1 197 1 1 15 LEU CD1 C -3.899 -0.336 7.712 1.00 . A A . 15 LEU CD1 1 1 1 198 1 1 15 LEU CD2 C -2.133 -1.010 6.069 1.00 . A A . 15 LEU CD2 1 1 1 199 1 1 15 LEU CG C -3.593 -1.161 6.470 1.00 . A A . 15 LEU CG 1 1 1 200 1 1 15 LEU H H -5.358 -4.657 6.157 1.00 . A A . 15 LEU H 1 1 1 201 1 1 15 LEU HA H -3.824 -3.016 4.607 1.00 . A A . 15 LEU HA 1 1 1 202 1 1 15 LEU HB2 H -4.981 -2.703 6.957 1.00 . A A . 15 LEU HB2 1 1 1 203 1 1 15 LEU HB3 H -3.354 -2.981 7.550 1.00 . A A . 15 LEU HB3 1 1 1 204 1 1 15 LEU HD11 H -4.211 -0.991 8.513 1.00 . A A . 15 LEU HD11 1 1 1 205 1 1 15 LEU HD12 H -3.015 0.205 8.014 1.00 . A A . 15 LEU HD12 1 1 1 206 1 1 15 LEU HD13 H -4.692 0.364 7.492 1.00 . A A . 15 LEU HD13 1 1 1 207 1 1 15 LEU HD21 H -1.542 -1.760 6.575 1.00 . A A . 15 LEU HD21 1 1 1 208 1 1 15 LEU HD22 H -2.038 -1.137 5.001 1.00 . A A . 15 LEU HD22 1 1 1 209 1 1 15 LEU HD23 H -1.783 -0.027 6.348 1.00 . A A . 15 LEU HD23 1 1 1 210 1 1 15 LEU HG H -4.203 -0.785 5.662 1.00 . A A . 15 LEU HG 1 1 1 211 1 1 15 LEU N N -4.591 -4.686 5.548 1.00 . A A . 15 LEU N 1 1 1 212 1 1 15 LEU O O -1.730 -4.517 6.582 1.00 . A A . 15 LEU O 1 1 1 213 1 1 16 LYS C C 0.703 -3.728 5.439 1.00 . A A . 16 LYS C 1 1 1 214 1 1 16 LYS CA C -0.138 -4.339 4.319 1.00 . A A . 16 LYS CA 1 1 1 215 1 1 16 LYS CB C 0.439 -3.942 2.959 1.00 . A A . 16 LYS CB 1 1 1 216 1 1 16 LYS CD C 0.537 -4.374 0.485 1.00 . A A . 16 LYS CD 1 1 1 217 1 1 16 LYS CE C 0.756 -5.524 -0.485 1.00 . A A . 16 LYS CE 1 1 1 218 1 1 16 LYS CG C 0.024 -4.869 1.828 1.00 . A A . 16 LYS CG 1 1 1 219 1 1 16 LYS H H -1.972 -3.529 3.636 1.00 . A A . 16 LYS H 1 1 1 220 1 1 16 LYS HA H -0.116 -5.415 4.409 1.00 . A A . 16 LYS HA 1 1 1 221 1 1 16 LYS HB2 H 0.107 -2.943 2.717 1.00 . A A . 16 LYS HB2 1 1 1 222 1 1 16 LYS HB3 H 1.517 -3.948 3.023 1.00 . A A . 16 LYS HB3 1 1 1 223 1 1 16 LYS HD2 H -0.186 -3.693 0.063 1.00 . A A . 16 LYS HD2 1 1 1 224 1 1 16 LYS HD3 H 1.474 -3.859 0.637 1.00 . A A . 16 LYS HD3 1 1 1 225 1 1 16 LYS HE2 H 0.125 -6.350 -0.193 1.00 . A A . 16 LYS HE2 1 1 1 226 1 1 16 LYS HE3 H 0.484 -5.196 -1.478 1.00 . A A . 16 LYS HE3 1 1 1 227 1 1 16 LYS HG2 H 0.427 -5.853 2.015 1.00 . A A . 16 LYS HG2 1 1 1 228 1 1 16 LYS HG3 H -1.055 -4.920 1.795 1.00 . A A . 16 LYS HG3 1 1 1 229 1 1 16 LYS HZ1 H 2.504 -6.141 0.477 1.00 . A A . 16 LYS HZ1 1 1 1 230 1 1 16 LYS HZ2 H 2.260 -6.865 -1.033 1.00 . A A . 16 LYS HZ2 1 1 1 231 1 1 16 LYS HZ3 H 2.778 -5.258 -0.939 1.00 . A A . 16 LYS HZ3 1 1 1 232 1 1 16 LYS N N -1.530 -3.915 4.422 1.00 . A A . 16 LYS N 1 1 1 233 1 1 16 LYS NZ N 2.174 -5.979 -0.496 1.00 . A A . 16 LYS NZ 1 1 1 234 1 1 16 LYS O O 0.419 -2.627 5.909 1.00 . A A . 16 LYS O 1 1 1 235 1 1 17 PRO C C 3.401 -2.704 6.558 1.00 . A A . 17 PRO C 1 1 1 236 1 1 17 PRO CA C 2.634 -3.961 6.954 1.00 . A A . 17 PRO CA 1 1 1 237 1 1 17 PRO CB C 3.603 -5.127 7.177 1.00 . A A . 17 PRO CB 1 1 1 238 1 1 17 PRO CD C 2.163 -5.761 5.380 1.00 . A A . 17 PRO CD 1 1 1 239 1 1 17 PRO CG C 3.560 -5.910 5.910 1.00 . A A . 17 PRO CG 1 1 1 240 1 1 17 PRO HA H 2.082 -3.770 7.863 1.00 . A A . 17 PRO HA 1 1 1 241 1 1 17 PRO HB2 H 4.593 -4.741 7.369 1.00 . A A . 17 PRO HB2 1 1 1 242 1 1 17 PRO HB3 H 3.271 -5.718 8.017 1.00 . A A . 17 PRO HB3 1 1 1 243 1 1 17 PRO HD2 H 2.165 -5.780 4.300 1.00 . A A . 17 PRO HD2 1 1 1 244 1 1 17 PRO HD3 H 1.524 -6.539 5.772 1.00 . A A . 17 PRO HD3 1 1 1 245 1 1 17 PRO HG2 H 4.274 -5.509 5.206 1.00 . A A . 17 PRO HG2 1 1 1 246 1 1 17 PRO HG3 H 3.775 -6.949 6.113 1.00 . A A . 17 PRO HG3 1 1 1 247 1 1 17 PRO N N 1.753 -4.439 5.883 1.00 . A A . 17 PRO N 1 1 1 248 1 1 17 PRO O O 3.996 -2.643 5.483 1.00 . A A . 17 PRO O 1 1 1 249 1 1 18 ALA C C 5.535 -0.698 6.783 1.00 . A A . 18 ALA C 1 1 1 250 1 1 18 ALA CA C 4.082 -0.448 7.177 1.00 . A A . 18 ALA CA 1 1 1 251 1 1 18 ALA CB C 4.013 0.454 8.400 1.00 . A A . 18 ALA CB 1 1 1 252 1 1 18 ALA H H 2.893 -1.812 8.274 1.00 . A A . 18 ALA H 1 1 1 253 1 1 18 ALA HA H 3.579 0.051 6.362 1.00 . A A . 18 ALA HA 1 1 1 254 1 1 18 ALA HB1 H 4.851 0.247 9.048 1.00 . A A . 18 ALA HB1 1 1 1 255 1 1 18 ALA HB2 H 4.046 1.487 8.087 1.00 . A A . 18 ALA HB2 1 1 1 256 1 1 18 ALA HB3 H 3.092 0.268 8.932 1.00 . A A . 18 ALA HB3 1 1 1 257 1 1 18 ALA N N 3.385 -1.703 7.434 1.00 . A A . 18 ALA N 1 1 1 258 1 1 18 ALA O O 6.117 -1.722 7.139 1.00 . A A . 18 ALA O 1 1 1 259 1 1 19 GLY C C 7.672 -1.044 4.629 1.00 . A A . 19 GLY C 1 1 1 260 1 1 19 GLY CA C 7.490 0.099 5.610 1.00 . A A . 19 GLY CA 1 1 1 261 1 1 19 GLY H H 5.600 1.035 5.784 1.00 . A A . 19 GLY H 1 1 1 262 1 1 19 GLY HA2 H 8.111 -0.082 6.475 1.00 . A A . 19 GLY HA2 1 1 1 263 1 1 19 GLY HA3 H 7.805 1.018 5.138 1.00 . A A . 19 GLY HA3 1 1 1 264 1 1 19 GLY N N 6.113 0.241 6.042 1.00 . A A . 19 GLY N 1 1 1 265 1 1 19 GLY O O 8.766 -1.594 4.503 1.00 . A A . 19 GLY O 1 1 1 266 1 1 20 THR C C 6.168 -2.000 1.590 1.00 . A A . 20 THR C 1 1 1 267 1 1 20 THR CA C 6.641 -2.483 2.957 1.00 . A A . 20 THR CA 1 1 1 268 1 1 20 THR CB C 5.773 -3.653 3.425 1.00 . A A . 20 THR CB 1 1 1 269 1 1 20 THR CG2 C 5.803 -4.837 2.483 1.00 . A A . 20 THR CG2 1 1 1 270 1 1 20 THR H H 5.753 -0.922 4.076 1.00 . A A . 20 THR H 1 1 1 271 1 1 20 THR HA H 7.665 -2.816 2.875 1.00 . A A . 20 THR HA 1 1 1 272 1 1 20 THR HB H 4.749 -3.318 3.502 1.00 . A A . 20 THR HB 1 1 1 273 1 1 20 THR HG1 H 7.119 -4.348 4.667 1.00 . A A . 20 THR HG1 1 1 1 274 1 1 20 THR HG21 H 6.029 -4.496 1.483 1.00 . A A . 20 THR HG21 1 1 1 275 1 1 20 THR HG22 H 6.560 -5.535 2.806 1.00 . A A . 20 THR HG22 1 1 1 276 1 1 20 THR HG23 H 4.839 -5.324 2.487 1.00 . A A . 20 THR HG23 1 1 1 277 1 1 20 THR N N 6.597 -1.400 3.932 1.00 . A A . 20 THR N 1 1 1 278 1 1 20 THR O O 5.076 -1.447 1.461 1.00 . A A . 20 THR O 1 1 1 279 1 1 20 THR OG1 O 6.190 -4.108 4.700 1.00 . A A . 20 THR OG1 1 1 1 280 1 1 21 THR C C 5.346 -2.427 -1.234 1.00 . A A . 21 THR C 1 1 1 281 1 1 21 THR CA C 6.660 -1.797 -0.785 1.00 . A A . 21 THR CA 1 1 1 282 1 1 21 THR CB C 7.783 -2.174 -1.754 1.00 . A A . 21 THR CB 1 1 1 283 1 1 21 THR CG2 C 8.290 -0.997 -2.557 1.00 . A A . 21 THR CG2 1 1 1 284 1 1 21 THR H H 7.853 -2.658 0.738 1.00 . A A . 21 THR H 1 1 1 285 1 1 21 THR HA H 6.545 -0.723 -0.782 1.00 . A A . 21 THR HA 1 1 1 286 1 1 21 THR HB H 7.414 -2.914 -2.449 1.00 . A A . 21 THR HB 1 1 1 287 1 1 21 THR HG1 H 9.283 -3.422 -1.588 1.00 . A A . 21 THR HG1 1 1 1 288 1 1 21 THR HG21 H 7.919 -0.080 -2.123 1.00 . A A . 21 THR HG21 1 1 1 289 1 1 21 THR HG22 H 9.369 -0.990 -2.544 1.00 . A A . 21 THR HG22 1 1 1 290 1 1 21 THR HG23 H 7.942 -1.080 -3.576 1.00 . A A . 21 THR HG23 1 1 1 291 1 1 21 THR N N 6.996 -2.212 0.573 1.00 . A A . 21 THR N 1 1 1 292 1 1 21 THR O O 5.257 -3.641 -1.418 1.00 . A A . 21 THR O 1 1 1 293 1 1 21 THR OG1 O 8.886 -2.727 -1.058 1.00 . A A . 21 THR OG1 1 1 1 294 1 1 22 CYS C C 2.808 -1.849 -3.321 1.00 . A A . 22 CYS C 1 1 1 295 1 1 22 CYS CA C 3.014 -2.066 -1.827 1.00 . A A . 22 CYS CA 1 1 1 296 1 1 22 CYS CB C 1.916 -1.344 -1.046 1.00 . A A . 22 CYS CB 1 1 1 297 1 1 22 CYS H H 4.459 -0.636 -1.238 1.00 . A A . 22 CYS H 1 1 1 298 1 1 22 CYS HA H 2.959 -3.123 -1.617 1.00 . A A . 22 CYS HA 1 1 1 299 1 1 22 CYS HB2 H 0.954 -1.657 -1.424 1.00 . A A . 22 CYS HB2 1 1 1 300 1 1 22 CYS HB3 H 1.991 -1.611 -0.002 1.00 . A A . 22 CYS HB3 1 1 1 301 1 1 22 CYS N N 4.326 -1.593 -1.404 1.00 . A A . 22 CYS N 1 1 1 302 1 1 22 CYS O O 2.272 -2.712 -4.016 1.00 . A A . 22 CYS O 1 1 1 303 1 1 22 CYS SG S 1.991 0.474 -1.163 1.00 . A A . 22 CYS SG 1 1 1 304 1 1 23 TRP C C 4.310 -0.777 -6.016 1.00 . A A . 23 TRP C 1 1 1 305 1 1 23 TRP CA C 3.085 -0.353 -5.217 1.00 . A A . 23 TRP CA 1 1 1 306 1 1 23 TRP CB C 2.850 1.150 -5.378 1.00 . A A . 23 TRP CB 1 1 1 307 1 1 23 TRP CD1 C 1.368 0.635 -7.405 1.00 . A A . 23 TRP CD1 1 1 1 308 1 1 23 TRP CD2 C 1.377 2.787 -6.791 1.00 . A A . 23 TRP CD2 1 1 1 309 1 1 23 TRP CE2 C 0.533 2.643 -7.907 1.00 . A A . 23 TRP CE2 1 1 1 310 1 1 23 TRP CE3 C 1.540 4.054 -6.227 1.00 . A A . 23 TRP CE3 1 1 1 311 1 1 23 TRP CG C 1.902 1.492 -6.485 1.00 . A A . 23 TRP CG 1 1 1 312 1 1 23 TRP CH2 C 0.031 4.949 -7.898 1.00 . A A . 23 TRP CH2 1 1 1 313 1 1 23 TRP CZ2 C -0.146 3.719 -8.469 1.00 . A A . 23 TRP CZ2 1 1 1 314 1 1 23 TRP CZ3 C 0.865 5.123 -6.787 1.00 . A A . 23 TRP CZ3 1 1 1 315 1 1 23 TRP H H 3.645 -0.039 -3.202 1.00 . A A . 23 TRP H 1 1 1 316 1 1 23 TRP HA H 2.227 -0.881 -5.595 1.00 . A A . 23 TRP HA 1 1 1 317 1 1 23 TRP HB2 H 2.443 1.544 -4.459 1.00 . A A . 23 TRP HB2 1 1 1 318 1 1 23 TRP HB3 H 3.793 1.635 -5.584 1.00 . A A . 23 TRP HB3 1 1 1 319 1 1 23 TRP HD1 H 1.574 -0.424 -7.440 1.00 . A A . 23 TRP HD1 1 1 1 320 1 1 23 TRP HE1 H 0.047 0.928 -9.010 1.00 . A A . 23 TRP HE1 1 1 1 321 1 1 23 TRP HE3 H 2.178 4.206 -5.370 1.00 . A A . 23 TRP HE3 1 1 1 322 1 1 23 TRP HH2 H -0.474 5.812 -8.305 1.00 . A A . 23 TRP HH2 1 1 1 323 1 1 23 TRP HZ2 H -0.794 3.601 -9.324 1.00 . A A . 23 TRP HZ2 1 1 1 324 1 1 23 TRP HZ3 H 0.979 6.111 -6.366 1.00 . A A . 23 TRP HZ3 1 1 1 325 1 1 23 TRP N N 3.231 -0.688 -3.807 1.00 . A A . 23 TRP N 1 1 1 326 1 1 23 TRP NE1 N 0.545 1.321 -8.264 1.00 . A A . 23 TRP NE1 1 1 1 327 1 1 23 TRP O O 4.250 -1.709 -6.819 1.00 . A A . 23 TRP O 1 1 1 328 1 1 24 LYS C C 6.474 -0.273 -8.005 1.00 . A A . 24 LYS C 1 1 1 329 1 1 24 LYS CA C 6.661 -0.381 -6.494 1.00 . A A . 24 LYS CA 1 1 1 330 1 1 24 LYS CB C 7.153 -1.782 -6.128 1.00 . A A . 24 LYS CB 1 1 1 331 1 1 24 LYS CD C 9.108 -3.336 -5.855 1.00 . A A . 24 LYS CD 1 1 1 332 1 1 24 LYS CE C 10.183 -3.942 -6.743 1.00 . A A . 24 LYS CE 1 1 1 333 1 1 24 LYS CG C 8.635 -1.994 -6.389 1.00 . A A . 24 LYS CG 1 1 1 334 1 1 24 LYS H H 5.397 0.646 -5.144 1.00 . A A . 24 LYS H 1 1 1 335 1 1 24 LYS HA H 7.399 0.343 -6.181 1.00 . A A . 24 LYS HA 1 1 1 336 1 1 24 LYS HB2 H 6.966 -1.953 -5.078 1.00 . A A . 24 LYS HB2 1 1 1 337 1 1 24 LYS HB3 H 6.600 -2.507 -6.706 1.00 . A A . 24 LYS HB3 1 1 1 338 1 1 24 LYS HD2 H 9.511 -3.197 -4.863 1.00 . A A . 24 LYS HD2 1 1 1 339 1 1 24 LYS HD3 H 8.266 -4.012 -5.812 1.00 . A A . 24 LYS HD3 1 1 1 340 1 1 24 LYS HE2 H 9.708 -4.430 -7.580 1.00 . A A . 24 LYS HE2 1 1 1 341 1 1 24 LYS HE3 H 10.822 -3.149 -7.104 1.00 . A A . 24 LYS HE3 1 1 1 342 1 1 24 LYS HG2 H 8.812 -1.959 -7.453 1.00 . A A . 24 LYS HG2 1 1 1 343 1 1 24 LYS HG3 H 9.193 -1.207 -5.903 1.00 . A A . 24 LYS HG3 1 1 1 344 1 1 24 LYS HZ1 H 10.481 -5.322 -5.203 1.00 . A A . 24 LYS HZ1 1 1 1 345 1 1 24 LYS HZ2 H 11.276 -5.719 -6.643 1.00 . A A . 24 LYS HZ2 1 1 1 346 1 1 24 LYS HZ3 H 11.881 -4.487 -5.655 1.00 . A A . 24 LYS HZ3 1 1 1 347 1 1 24 LYS N N 5.417 -0.084 -5.794 1.00 . A A . 24 LYS N 1 1 1 348 1 1 24 LYS NZ N 11.014 -4.937 -6.010 1.00 . A A . 24 LYS NZ 1 1 1 349 1 1 24 LYS O O 7.156 -0.950 -8.774 1.00 . A A . 24 LYS O 1 1 1 350 1 1 25 THR C C 6.516 1.256 -10.577 1.00 . A A . 25 THR C 1 1 1 351 1 1 25 THR CA C 5.268 0.779 -9.840 1.00 . A A . 25 THR CA 1 1 1 352 1 1 25 THR CB C 4.132 1.788 -10.024 1.00 . A A . 25 THR CB 1 1 1 353 1 1 25 THR CG2 C 3.225 1.462 -11.191 1.00 . A A . 25 THR CG2 1 1 1 354 1 1 25 THR H H 5.034 1.094 -7.760 1.00 . A A . 25 THR H 1 1 1 355 1 1 25 THR HA H 4.963 -0.171 -10.252 1.00 . A A . 25 THR HA 1 1 1 356 1 1 25 THR HB H 4.555 2.767 -10.198 1.00 . A A . 25 THR HB 1 1 1 357 1 1 25 THR HG1 H 3.005 2.750 -8.744 1.00 . A A . 25 THR HG1 1 1 1 358 1 1 25 THR HG21 H 3.805 1.440 -12.102 1.00 . A A . 25 THR HG21 1 1 1 359 1 1 25 THR HG22 H 2.767 0.497 -11.032 1.00 . A A . 25 THR HG22 1 1 1 360 1 1 25 THR HG23 H 2.457 2.217 -11.272 1.00 . A A . 25 THR HG23 1 1 1 361 1 1 25 THR N N 5.545 0.582 -8.422 1.00 . A A . 25 THR N 1 1 1 362 1 1 25 THR O O 7.230 2.139 -10.102 1.00 . A A . 25 THR O 1 1 1 363 1 1 25 THR OG1 O 3.327 1.853 -8.861 1.00 . A A . 25 THR OG1 1 1 1 364 1 1 26 SER C C 7.990 2.528 -12.790 1.00 . A A . 26 SER C 1 1 1 365 1 1 26 SER CA C 7.940 1.023 -12.543 1.00 . A A . 26 SER CA 1 1 1 366 1 1 26 SER CB C 7.914 0.277 -13.878 1.00 . A A . 26 SER CB 1 1 1 367 1 1 26 SER H H 6.169 -0.036 -12.064 1.00 . A A . 26 SER H 1 1 1 368 1 1 26 SER HA H 8.822 0.732 -11.995 1.00 . A A . 26 SER HA 1 1 1 369 1 1 26 SER HB2 H 8.707 0.648 -14.511 1.00 . A A . 26 SER HB2 1 1 1 370 1 1 26 SER HB3 H 8.060 -0.779 -13.701 1.00 . A A . 26 SER HB3 1 1 1 371 1 1 26 SER HG H 6.620 -0.141 -15.288 1.00 . A A . 26 SER HG 1 1 1 372 1 1 26 SER N N 6.775 0.662 -11.739 1.00 . A A . 26 SER N 1 1 1 373 1 1 26 SER O O 9.067 3.123 -12.844 1.00 . A A . 26 SER O 1 1 1 374 1 1 26 SER OG O 6.677 0.462 -14.543 1.00 . A A . 26 SER OG 1 1 1 375 1 1 27 VAL C C 6.710 5.350 -11.860 1.00 . A A . 27 VAL C 1 1 1 376 1 1 27 VAL CA C 6.727 4.571 -13.174 1.00 . A A . 27 VAL CA 1 1 1 377 1 1 27 VAL CB C 5.466 4.925 -13.987 1.00 . A A . 27 VAL CB 1 1 1 378 1 1 27 VAL CG1 C 4.207 4.536 -13.225 1.00 . A A . 27 VAL CG1 1 1 1 379 1 1 27 VAL CG2 C 5.451 6.407 -14.335 1.00 . A A . 27 VAL CG2 1 1 1 380 1 1 27 VAL H H 5.996 2.607 -12.880 1.00 . A A . 27 VAL H 1 1 1 381 1 1 27 VAL HA H 7.593 4.870 -13.746 1.00 . A A . 27 VAL HA 1 1 1 382 1 1 27 VAL HB H 5.488 4.362 -14.909 1.00 . A A . 27 VAL HB 1 1 1 383 1 1 27 VAL HG11 H 4.456 3.808 -12.468 1.00 . A A . 27 VAL HG11 1 1 1 384 1 1 27 VAL HG12 H 3.785 5.413 -12.757 1.00 . A A . 27 VAL HG12 1 1 1 385 1 1 27 VAL HG13 H 3.488 4.112 -13.910 1.00 . A A . 27 VAL HG13 1 1 1 386 1 1 27 VAL HG21 H 6.427 6.703 -14.690 1.00 . A A . 27 VAL HG21 1 1 1 387 1 1 27 VAL HG22 H 4.717 6.588 -15.107 1.00 . A A . 27 VAL HG22 1 1 1 388 1 1 27 VAL HG23 H 5.197 6.980 -13.456 1.00 . A A . 27 VAL HG23 1 1 1 389 1 1 27 VAL N N 6.819 3.136 -12.936 1.00 . A A . 27 VAL N 1 1 1 390 1 1 27 VAL O O 6.998 6.546 -11.834 1.00 . A A . 27 VAL O 1 1 1 391 1 1 28 SER C C 6.294 4.250 -8.350 1.00 . A A . 28 SER C 1 1 1 392 1 1 28 SER CA C 6.312 5.297 -9.459 1.00 . A A . 28 SER CA 1 1 1 393 1 1 28 SER CB C 5.073 6.186 -9.356 1.00 . A A . 28 SER CB 1 1 1 394 1 1 28 SER H H 6.147 3.715 -10.853 1.00 . A A . 28 SER H 1 1 1 395 1 1 28 SER HA H 7.194 5.909 -9.347 1.00 . A A . 28 SER HA 1 1 1 396 1 1 28 SER HB2 H 4.207 5.572 -9.152 1.00 . A A . 28 SER HB2 1 1 1 397 1 1 28 SER HB3 H 5.207 6.896 -8.553 1.00 . A A . 28 SER HB3 1 1 1 398 1 1 28 SER HG H 3.944 6.770 -10.847 1.00 . A A . 28 SER HG 1 1 1 399 1 1 28 SER N N 6.369 4.665 -10.772 1.00 . A A . 28 SER N 1 1 1 400 1 1 28 SER O O 5.346 3.474 -8.230 1.00 . A A . 28 SER O 1 1 1 401 1 1 28 SER OG O 4.852 6.897 -10.562 1.00 . A A . 28 SER OG 1 1 1 402 1 1 29 SER C C 7.125 3.951 -5.107 1.00 . A A . 29 SER C 1 1 1 403 1 1 29 SER CA C 7.449 3.281 -6.438 1.00 . A A . 29 SER CA 1 1 1 404 1 1 29 SER CB C 8.851 2.671 -6.390 1.00 . A A . 29 SER CB 1 1 1 405 1 1 29 SER H H 8.072 4.877 -7.682 1.00 . A A . 29 SER H 1 1 1 406 1 1 29 SER HA H 6.729 2.495 -6.614 1.00 . A A . 29 SER HA 1 1 1 407 1 1 29 SER HB2 H 9.034 2.272 -5.403 1.00 . A A . 29 SER HB2 1 1 1 408 1 1 29 SER HB3 H 8.921 1.876 -7.118 1.00 . A A . 29 SER HB3 1 1 1 409 1 1 29 SER HG H 10.612 3.213 -7.056 1.00 . A A . 29 SER HG 1 1 1 410 1 1 29 SER N N 7.347 4.233 -7.538 1.00 . A A . 29 SER N 1 1 1 411 1 1 29 SER O O 7.627 5.034 -4.806 1.00 . A A . 29 SER O 1 1 1 412 1 1 29 SER OG O 9.841 3.643 -6.678 1.00 . A A . 29 SER OG 1 1 1 413 1 1 30 HIS C C 5.988 2.760 -1.936 1.00 . A A . 30 HIS C 1 1 1 414 1 1 30 HIS CA C 5.880 3.830 -3.019 1.00 . A A . 30 HIS CA 1 1 1 415 1 1 30 HIS CB C 4.446 4.360 -3.086 1.00 . A A . 30 HIS CB 1 1 1 416 1 1 30 HIS CD2 C 4.419 5.078 -5.579 1.00 . A A . 30 HIS CD2 1 1 1 417 1 1 30 HIS CE1 C 3.534 7.067 -5.328 1.00 . A A . 30 HIS CE1 1 1 1 418 1 1 30 HIS CG C 4.194 5.259 -4.256 1.00 . A A . 30 HIS CG 1 1 1 419 1 1 30 HIS H H 5.911 2.442 -4.614 1.00 . A A . 30 HIS H 1 1 1 420 1 1 30 HIS HA H 6.545 4.644 -2.774 1.00 . A A . 30 HIS HA 1 1 1 421 1 1 30 HIS HB2 H 3.764 3.525 -3.157 1.00 . A A . 30 HIS HB2 1 1 1 422 1 1 30 HIS HB3 H 4.233 4.916 -2.185 1.00 . A A . 30 HIS HB3 1 1 1 423 1 1 30 HIS HD1 H 3.364 6.939 -3.294 1.00 . A A . 30 HIS HD1 1 1 1 424 1 1 30 HIS HD2 H 4.846 4.198 -6.041 1.00 . A A . 30 HIS HD2 1 1 1 425 1 1 30 HIS HE1 H 3.134 8.048 -5.539 1.00 . A A . 30 HIS HE1 1 1 1 426 1 1 30 HIS HE2 H 3.895 6.309 -7.193 1.00 . A A . 30 HIS HE2 1 1 1 427 1 1 30 HIS N N 6.279 3.299 -4.316 1.00 . A A . 30 HIS N 1 1 1 428 1 1 30 HIS ND1 N 3.640 6.515 -4.133 1.00 . A A . 30 HIS ND1 1 1 1 429 1 1 30 HIS NE2 N 4.000 6.216 -6.224 1.00 . A A . 30 HIS NE2 1 1 1 430 1 1 30 HIS O O 6.563 1.695 -2.158 1.00 . A A . 30 HIS O 1 1 1 431 1 1 31 TYR C C 4.230 2.287 1.235 1.00 . A A . 31 TYR C 1 1 1 432 1 1 31 TYR CA C 5.463 2.118 0.353 1.00 . A A . 31 TYR CA 1 1 1 433 1 1 31 TYR CB C 6.731 2.328 1.183 1.00 . A A . 31 TYR CB 1 1 1 434 1 1 31 TYR CD1 C 8.180 0.286 1.504 1.00 . A A . 31 TYR CD1 1 1 1 435 1 1 31 TYR CD2 C 8.662 1.730 -0.330 1.00 . A A . 31 TYR CD2 1 1 1 436 1 1 31 TYR CE1 C 9.229 -0.536 1.138 1.00 . A A . 31 TYR CE1 1 1 1 437 1 1 31 TYR CE2 C 9.712 0.913 -0.703 1.00 . A A . 31 TYR CE2 1 1 1 438 1 1 31 TYR CG C 7.879 1.431 0.778 1.00 . A A . 31 TYR CG 1 1 1 439 1 1 31 TYR CZ C 9.992 -0.218 0.034 1.00 . A A . 31 TYR CZ 1 1 1 440 1 1 31 TYR H H 4.987 3.918 -0.651 1.00 . A A . 31 TYR H 1 1 1 441 1 1 31 TYR HA H 5.468 1.116 -0.051 1.00 . A A . 31 TYR HA 1 1 1 442 1 1 31 TYR HB2 H 7.057 3.351 1.076 1.00 . A A . 31 TYR HB2 1 1 1 443 1 1 31 TYR HB3 H 6.508 2.133 2.222 1.00 . A A . 31 TYR HB3 1 1 1 444 1 1 31 TYR HD1 H 7.581 0.040 2.368 1.00 . A A . 31 TYR HD1 1 1 1 445 1 1 31 TYR HD2 H 8.441 2.617 -0.905 1.00 . A A . 31 TYR HD2 1 1 1 446 1 1 31 TYR HE1 H 9.447 -1.422 1.716 1.00 . A A . 31 TYR HE1 1 1 1 447 1 1 31 TYR HE2 H 10.309 1.163 -1.568 1.00 . A A . 31 TYR HE2 1 1 1 448 1 1 31 TYR HH H 10.692 -1.849 -0.706 1.00 . A A . 31 TYR HH 1 1 1 449 1 1 31 TYR N N 5.431 3.053 -0.766 1.00 . A A . 31 TYR N 1 1 1 450 1 1 31 TYR O O 3.621 3.356 1.266 1.00 . A A . 31 TYR O 1 1 1 451 1 1 31 TYR OH O 11.037 -1.034 -0.334 1.00 . A A . 31 TYR OH 1 1 1 452 1 1 32 CYS C C 3.132 1.688 4.244 1.00 . A A . 32 CYS C 1 1 1 453 1 1 32 CYS CA C 2.715 1.268 2.840 1.00 . A A . 32 CYS CA 1 1 1 454 1 1 32 CYS CB C 2.031 -0.101 2.882 1.00 . A A . 32 CYS CB 1 1 1 455 1 1 32 CYS H H 4.397 0.406 1.894 1.00 . A A . 32 CYS H 1 1 1 456 1 1 32 CYS HA H 2.022 1.996 2.449 1.00 . A A . 32 CYS HA 1 1 1 457 1 1 32 CYS HB2 H 2.311 -0.662 2.003 1.00 . A A . 32 CYS HB2 1 1 1 458 1 1 32 CYS HB3 H 2.364 -0.634 3.761 1.00 . A A . 32 CYS HB3 1 1 1 459 1 1 32 CYS N N 3.871 1.230 1.955 1.00 . A A . 32 CYS N 1 1 1 460 1 1 32 CYS O O 4.229 1.363 4.698 1.00 . A A . 32 CYS O 1 1 1 461 1 1 32 CYS SG S 0.211 -0.026 2.933 1.00 . A A . 32 CYS SG 1 1 1 462 1 1 33 THR C C 1.716 2.085 7.299 1.00 . A A . 33 THR C 1 1 1 463 1 1 33 THR CA C 2.534 2.871 6.280 1.00 . A A . 33 THR CA 1 1 1 464 1 1 33 THR CB C 2.231 4.364 6.407 1.00 . A A . 33 THR CB 1 1 1 465 1 1 33 THR CG2 C 2.815 5.191 5.282 1.00 . A A . 33 THR CG2 1 1 1 466 1 1 33 THR H H 1.395 2.637 4.513 1.00 . A A . 33 THR H 1 1 1 467 1 1 33 THR HA H 3.583 2.707 6.476 1.00 . A A . 33 THR HA 1 1 1 468 1 1 33 THR HB H 2.647 4.728 7.335 1.00 . A A . 33 THR HB 1 1 1 469 1 1 33 THR HG1 H 0.662 5.530 6.540 1.00 . A A . 33 THR HG1 1 1 1 470 1 1 33 THR HG21 H 2.493 4.787 4.333 1.00 . A A . 33 THR HG21 1 1 1 471 1 1 33 THR HG22 H 2.475 6.212 5.372 1.00 . A A . 33 THR HG22 1 1 1 472 1 1 33 THR HG23 H 3.893 5.164 5.337 1.00 . A A . 33 THR HG23 1 1 1 473 1 1 33 THR N N 2.253 2.410 4.927 1.00 . A A . 33 THR N 1 1 1 474 1 1 33 THR O O 1.491 2.548 8.418 1.00 . A A . 33 THR O 1 1 1 475 1 1 33 THR OG1 O 0.833 4.592 6.426 1.00 . A A . 33 THR OG1 1 1 1 476 1 1 34 GLY C C -0.648 0.829 8.468 1.00 . A A . 34 GLY C 1 1 1 477 1 1 34 GLY CA C 0.479 0.063 7.797 1.00 . A A . 34 GLY CA 1 1 1 478 1 1 34 GLY H H 1.481 0.576 6.000 1.00 . A A . 34 GLY H 1 1 1 479 1 1 34 GLY HA2 H 1.127 -0.343 8.560 1.00 . A A . 34 GLY HA2 1 1 1 480 1 1 34 GLY HA3 H 0.056 -0.753 7.230 1.00 . A A . 34 GLY HA3 1 1 1 481 1 1 34 GLY N N 1.270 0.894 6.905 1.00 . A A . 34 GLY N 1 1 1 482 1 1 34 GLY O O -1.076 0.478 9.568 1.00 . A A . 34 GLY O 1 1 1 483 1 1 35 ARG C C -3.460 2.603 7.485 1.00 . A A . 35 ARG C 1 1 1 484 1 1 35 ARG CA C -2.204 2.700 8.349 1.00 . A A . 35 ARG CA 1 1 1 485 1 1 35 ARG CB C -1.758 4.159 8.455 1.00 . A A . 35 ARG CB 1 1 1 486 1 1 35 ARG CD C -1.140 5.977 10.075 1.00 . A A . 35 ARG CD 1 1 1 487 1 1 35 ARG CG C -1.068 4.490 9.768 1.00 . A A . 35 ARG CG 1 1 1 488 1 1 35 ARG CZ C 0.649 6.359 11.726 1.00 . A A . 35 ARG CZ 1 1 1 489 1 1 35 ARG H H -0.739 2.111 6.937 1.00 . A A . 35 ARG H 1 1 1 490 1 1 35 ARG HA H -2.434 2.332 9.338 1.00 . A A . 35 ARG HA 1 1 1 491 1 1 35 ARG HB2 H -1.072 4.373 7.648 1.00 . A A . 35 ARG HB2 1 1 1 492 1 1 35 ARG HB3 H -2.624 4.796 8.357 1.00 . A A . 35 ARG HB3 1 1 1 493 1 1 35 ARG HD2 H -0.545 6.511 9.350 1.00 . A A . 35 ARG HD2 1 1 1 494 1 1 35 ARG HD3 H -2.169 6.297 10.001 1.00 . A A . 35 ARG HD3 1 1 1 495 1 1 35 ARG HE H -1.306 6.443 12.118 1.00 . A A . 35 ARG HE 1 1 1 496 1 1 35 ARG HG2 H -1.551 3.945 10.565 1.00 . A A . 35 ARG HG2 1 1 1 497 1 1 35 ARG HG3 H -0.031 4.195 9.703 1.00 . A A . 35 ARG HG3 1 1 1 498 1 1 35 ARG HH11 H 1.307 5.935 9.861 1.00 . A A . 35 ARG HH11 1 1 1 499 1 1 35 ARG HH12 H 2.545 6.208 11.040 1.00 . A A . 35 ARG HH12 1 1 1 500 1 1 35 ARG HH21 H 0.321 6.803 13.670 1.00 . A A . 35 ARG HH21 1 1 1 501 1 1 35 ARG HH22 H 1.986 6.700 13.203 1.00 . A A . 35 ARG HH22 1 1 1 502 1 1 35 ARG N N -1.124 1.880 7.807 1.00 . A A . 35 ARG N 1 1 1 503 1 1 35 ARG NE N -0.643 6.284 11.414 1.00 . A A . 35 ARG NE 1 1 1 504 1 1 35 ARG NH1 N 1.576 6.150 10.799 1.00 . A A . 35 ARG NH1 1 1 1 505 1 1 35 ARG NH2 N 1.015 6.644 12.968 1.00 . A A . 35 ARG NH2 1 1 1 506 1 1 35 ARG O O -4.576 2.765 7.978 1.00 . A A . 35 ARG O 1 1 1 507 1 1 36 SER C C -4.089 1.202 4.177 1.00 . A A . 36 SER C 1 1 1 508 1 1 36 SER CA C -4.392 2.221 5.269 1.00 . A A . 36 SER CA 1 1 1 509 1 1 36 SER CB C -4.705 3.581 4.641 1.00 . A A . 36 SER CB 1 1 1 510 1 1 36 SER H H -2.360 2.218 5.860 1.00 . A A . 36 SER H 1 1 1 511 1 1 36 SER HA H -5.253 1.886 5.827 1.00 . A A . 36 SER HA 1 1 1 512 1 1 36 SER HB2 H -4.873 4.306 5.423 1.00 . A A . 36 SER HB2 1 1 1 513 1 1 36 SER HB3 H -3.870 3.895 4.033 1.00 . A A . 36 SER HB3 1 1 1 514 1 1 36 SER HG H -5.653 3.827 2.945 1.00 . A A . 36 SER HG 1 1 1 515 1 1 36 SER N N -3.272 2.338 6.196 1.00 . A A . 36 SER N 1 1 1 516 1 1 36 SER O O -2.975 0.688 4.085 1.00 . A A . 36 SER O 1 1 1 517 1 1 36 SER OG O -5.863 3.513 3.827 1.00 . A A . 36 SER OG 1 1 1 518 1 1 37 CYS C C -4.745 0.679 0.925 1.00 . A A . 37 CYS C 1 1 1 519 1 1 37 CYS CA C -4.926 -0.039 2.260 1.00 . A A . 37 CYS CA 1 1 1 520 1 1 37 CYS CB C -6.131 -0.979 2.193 1.00 . A A . 37 CYS CB 1 1 1 521 1 1 37 CYS H H -5.952 1.362 3.469 1.00 . A A . 37 CYS H 1 1 1 522 1 1 37 CYS HA H -4.040 -0.622 2.463 1.00 . A A . 37 CYS HA 1 1 1 523 1 1 37 CYS HB2 H -6.997 -0.468 2.585 1.00 . A A . 37 CYS HB2 1 1 1 524 1 1 37 CYS HB3 H -6.312 -1.246 1.165 1.00 . A A . 37 CYS HB3 1 1 1 525 1 1 37 CYS N N -5.088 0.917 3.348 1.00 . A A . 37 CYS N 1 1 1 526 1 1 37 CYS O O -4.910 0.083 -0.139 1.00 . A A . 37 CYS O 1 1 1 527 1 1 37 CYS SG S -5.918 -2.520 3.144 1.00 . A A . 37 CYS SG 1 1 1 528 1 1 38 GLU C C -2.831 3.450 -0.177 1.00 . A A . 38 GLU C 1 1 1 529 1 1 38 GLU CA C -4.193 2.762 -0.212 1.00 . A A . 38 GLU CA 1 1 1 530 1 1 38 GLU CB C -5.302 3.807 -0.354 1.00 . A A . 38 GLU CB 1 1 1 531 1 1 38 GLU CD C -6.865 3.450 -2.305 1.00 . A A . 38 GLU CD 1 1 1 532 1 1 38 GLU CG C -6.626 3.228 -0.825 1.00 . A A . 38 GLU CG 1 1 1 533 1 1 38 GLU H H -4.282 2.382 1.868 1.00 . A A . 38 GLU H 1 1 1 534 1 1 38 GLU HA H -4.225 2.097 -1.062 1.00 . A A . 38 GLU HA 1 1 1 535 1 1 38 GLU HB2 H -5.460 4.279 0.605 1.00 . A A . 38 GLU HB2 1 1 1 536 1 1 38 GLU HB3 H -4.986 4.555 -1.066 1.00 . A A . 38 GLU HB3 1 1 1 537 1 1 38 GLU HG2 H -6.629 2.166 -0.631 1.00 . A A . 38 GLU HG2 1 1 1 538 1 1 38 GLU HG3 H -7.426 3.697 -0.271 1.00 . A A . 38 GLU HG3 1 1 1 539 1 1 38 GLU N N -4.401 1.963 0.990 1.00 . A A . 38 GLU N 1 1 1 540 1 1 38 GLU O O -2.637 4.429 0.545 1.00 . A A . 38 GLU O 1 1 1 541 1 1 38 GLU OE1 O -6.682 4.594 -2.771 1.00 . A A . 38 GLU OE1 1 1 1 542 1 1 38 GLU OE2 O -7.235 2.480 -2.999 1.00 . A A . 38 GLU OE2 1 1 1 543 1 1 39 CYS C C -0.585 4.997 -1.279 1.00 . A A . 39 CYS C 1 1 1 544 1 1 39 CYS CA C -0.542 3.491 -1.020 1.00 . A A . 39 CYS CA 1 1 1 545 1 1 39 CYS CB C 0.276 2.798 -2.114 1.00 . A A . 39 CYS CB 1 1 1 546 1 1 39 CYS H H -2.106 2.149 -1.509 1.00 . A A . 39 CYS H 1 1 1 547 1 1 39 CYS HA H -0.069 3.315 -0.065 1.00 . A A . 39 CYS HA 1 1 1 548 1 1 39 CYS HB2 H -0.104 3.096 -3.080 1.00 . A A . 39 CYS HB2 1 1 1 549 1 1 39 CYS HB3 H 1.308 3.105 -2.030 1.00 . A A . 39 CYS HB3 1 1 1 550 1 1 39 CYS N N -1.889 2.930 -0.960 1.00 . A A . 39 CYS N 1 1 1 551 1 1 39 CYS O O -1.463 5.487 -1.989 1.00 . A A . 39 CYS O 1 1 1 552 1 1 39 CYS SG S 0.231 0.977 -2.042 1.00 . A A . 39 CYS SG 1 1 1 553 1 1 40 PRO C C 0.823 7.606 -2.294 1.00 . A A . 40 PRO C 1 1 1 554 1 1 40 PRO CA C 0.430 7.208 -0.875 1.00 . A A . 40 PRO CA 1 1 1 555 1 1 40 PRO CB C 1.510 7.639 0.120 1.00 . A A . 40 PRO CB 1 1 1 556 1 1 40 PRO CD C 1.452 5.250 0.161 1.00 . A A . 40 PRO CD 1 1 1 557 1 1 40 PRO CG C 2.368 6.434 0.294 1.00 . A A . 40 PRO CG 1 1 1 558 1 1 40 PRO HA H -0.508 7.677 -0.619 1.00 . A A . 40 PRO HA 1 1 1 559 1 1 40 PRO HB2 H 2.069 8.468 -0.289 1.00 . A A . 40 PRO HB2 1 1 1 560 1 1 40 PRO HB3 H 1.049 7.932 1.051 1.00 . A A . 40 PRO HB3 1 1 1 561 1 1 40 PRO HD2 H 1.967 4.425 -0.309 1.00 . A A . 40 PRO HD2 1 1 1 562 1 1 40 PRO HD3 H 1.070 4.957 1.128 1.00 . A A . 40 PRO HD3 1 1 1 563 1 1 40 PRO HG2 H 3.127 6.410 -0.475 1.00 . A A . 40 PRO HG2 1 1 1 564 1 1 40 PRO HG3 H 2.825 6.446 1.272 1.00 . A A . 40 PRO HG3 1 1 1 565 1 1 40 PRO N N 0.366 5.753 -0.703 1.00 . A A . 40 PRO N 1 1 1 566 1 1 40 PRO O O 1.156 6.754 -3.118 1.00 . A A . 40 PRO O 1 1 1 567 1 1 41 SER C C 2.576 9.917 -3.918 1.00 . A A . 41 SER C 1 1 1 568 1 1 41 SER CA C 1.135 9.415 -3.891 1.00 . A A . 41 SER CA 1 1 1 569 1 1 41 SER CB C 0.183 10.543 -4.295 1.00 . A A . 41 SER CB 1 1 1 570 1 1 41 SER H H 0.509 9.535 -1.872 1.00 . A A . 41 SER H 1 1 1 571 1 1 41 SER HA H 1.036 8.604 -4.597 1.00 . A A . 41 SER HA 1 1 1 572 1 1 41 SER HB2 H 0.203 10.661 -5.368 1.00 . A A . 41 SER HB2 1 1 1 573 1 1 41 SER HB3 H -0.820 10.295 -3.979 1.00 . A A . 41 SER HB3 1 1 1 574 1 1 41 SER HG H 0.526 12.471 -4.349 1.00 . A A . 41 SER HG 1 1 1 575 1 1 41 SER N N 0.782 8.905 -2.571 1.00 . A A . 41 SER N 1 1 1 576 1 1 41 SER O O 2.928 10.778 -4.724 1.00 . A A . 41 SER O 1 1 1 577 1 1 41 SER OG O 0.561 11.769 -3.694 1.00 . A A . 41 SER OG 1 1 1 578 1 1 42 TYR C C 5.692 8.565 -2.626 1.00 . A A . 42 TYR C 1 1 1 579 1 1 42 TYR CA C 4.808 9.765 -2.961 1.00 . A A . 42 TYR CA 1 1 1 580 1 1 42 TYR CB C 4.998 10.864 -1.913 1.00 . A A . 42 TYR CB 1 1 1 581 1 1 42 TYR CD1 C 5.675 9.768 0.259 1.00 . A A . 42 TYR CD1 1 1 1 582 1 1 42 TYR CD2 C 3.459 10.629 0.076 1.00 . A A . 42 TYR CD2 1 1 1 583 1 1 42 TYR CE1 C 5.411 9.354 1.551 1.00 . A A . 42 TYR CE1 1 1 1 584 1 1 42 TYR CE2 C 3.188 10.218 1.367 1.00 . A A . 42 TYR CE2 1 1 1 585 1 1 42 TYR CG C 4.705 10.412 -0.499 1.00 . A A . 42 TYR CG 1 1 1 586 1 1 42 TYR CZ C 4.167 9.581 2.100 1.00 . A A . 42 TYR CZ 1 1 1 587 1 1 42 TYR H H 3.069 8.689 -2.418 1.00 . A A . 42 TYR H 1 1 1 588 1 1 42 TYR HA H 5.095 10.149 -3.928 1.00 . A A . 42 TYR HA 1 1 1 589 1 1 42 TYR HB2 H 6.021 11.209 -1.944 1.00 . A A . 42 TYR HB2 1 1 1 590 1 1 42 TYR HB3 H 4.338 11.687 -2.142 1.00 . A A . 42 TYR HB3 1 1 1 591 1 1 42 TYR HD1 H 6.648 9.592 -0.174 1.00 . A A . 42 TYR HD1 1 1 1 592 1 1 42 TYR HD2 H 2.695 11.128 -0.501 1.00 . A A . 42 TYR HD2 1 1 1 593 1 1 42 TYR HE1 H 6.179 8.855 2.124 1.00 . A A . 42 TYR HE1 1 1 1 594 1 1 42 TYR HE2 H 2.214 10.396 1.797 1.00 . A A . 42 TYR HE2 1 1 1 595 1 1 42 TYR HH H 3.423 8.338 3.364 1.00 . A A . 42 TYR HH 1 1 1 596 1 1 42 TYR N N 3.406 9.372 -3.034 1.00 . A A . 42 TYR N 1 1 1 597 1 1 42 TYR O O 5.269 7.651 -1.918 1.00 . A A . 42 TYR O 1 1 1 598 1 1 42 TYR OH O 3.901 9.170 3.386 1.00 . A A . 42 TYR OH 1 1 1 599 1 1 43 PRO C C 8.388 7.447 -1.445 1.00 . A A . 43 PRO C 1 1 1 600 1 1 43 PRO CA C 7.879 7.457 -2.883 1.00 . A A . 43 PRO CA 1 1 1 601 1 1 43 PRO CB C 9.025 7.748 -3.853 1.00 . A A . 43 PRO CB 1 1 1 602 1 1 43 PRO CD C 7.524 9.603 -3.987 1.00 . A A . 43 PRO CD 1 1 1 603 1 1 43 PRO CG C 8.976 9.221 -4.063 1.00 . A A . 43 PRO CG 1 1 1 604 1 1 43 PRO HA H 7.441 6.498 -3.115 1.00 . A A . 43 PRO HA 1 1 1 605 1 1 43 PRO HB2 H 9.962 7.441 -3.411 1.00 . A A . 43 PRO HB2 1 1 1 606 1 1 43 PRO HB3 H 8.864 7.213 -4.777 1.00 . A A . 43 PRO HB3 1 1 1 607 1 1 43 PRO HD2 H 7.413 10.576 -3.532 1.00 . A A . 43 PRO HD2 1 1 1 608 1 1 43 PRO HD3 H 7.078 9.592 -4.971 1.00 . A A . 43 PRO HD3 1 1 1 609 1 1 43 PRO HG2 H 9.537 9.722 -3.287 1.00 . A A . 43 PRO HG2 1 1 1 610 1 1 43 PRO HG3 H 9.378 9.467 -5.035 1.00 . A A . 43 PRO HG3 1 1 1 611 1 1 43 PRO N N 6.937 8.553 -3.132 1.00 . A A . 43 PRO N 1 1 1 612 1 1 43 PRO O O 8.719 8.493 -0.886 1.00 . A A . 43 PRO O 1 1 1 613 1 1 44 GLY C C 10.358 5.675 0.595 1.00 . A A . 44 GLY C 1 1 1 614 1 1 44 GLY CA C 8.916 6.136 0.516 1.00 . A A . 44 GLY CA 1 1 1 615 1 1 44 GLY H H 8.170 5.460 -1.347 1.00 . A A . 44 GLY H 1 1 1 616 1 1 44 GLY HA2 H 8.293 5.423 1.035 1.00 . A A . 44 GLY HA2 1 1 1 617 1 1 44 GLY HA3 H 8.829 7.096 1.002 1.00 . A A . 44 GLY HA3 1 1 1 618 1 1 44 GLY N N 8.447 6.259 -0.852 1.00 . A A . 44 GLY N 1 1 1 619 1 1 44 GLY O O 10.631 4.518 0.915 1.00 . A A . 44 GLY O 1 1 1 620 1 1 45 ASN C C 13.500 7.394 0.988 1.00 . A A . 45 ASN C 1 1 1 621 1 1 45 ASN CA C 12.707 6.263 0.342 1.00 . A A . 45 ASN CA 1 1 1 622 1 1 45 ASN CB C 13.231 6.000 -1.071 1.00 . A A . 45 ASN CB 1 1 1 623 1 1 45 ASN CG C 13.123 4.540 -1.465 1.00 . A A . 45 ASN CG 1 1 1 624 1 1 45 ASN H H 11.004 7.488 0.054 1.00 . A A . 45 ASN H 1 1 1 625 1 1 45 ASN HA H 12.829 5.369 0.934 1.00 . A A . 45 ASN HA 1 1 1 626 1 1 45 ASN HB2 H 12.660 6.586 -1.776 1.00 . A A . 45 ASN HB2 1 1 1 627 1 1 45 ASN HB3 H 14.269 6.293 -1.123 1.00 . A A . 45 ASN HB3 1 1 1 628 1 1 45 ASN HD21 H 13.289 5.021 -3.387 1.00 . A A . 45 ASN HD21 1 1 1 629 1 1 45 ASN HD22 H 13.114 3.336 -3.047 1.00 . A A . 45 ASN HD22 1 1 1 630 1 1 45 ASN N N 11.284 6.583 0.302 1.00 . A A . 45 ASN N 1 1 1 631 1 1 45 ASN ND2 N 13.181 4.272 -2.764 1.00 . A A . 45 ASN ND2 1 1 1 632 1 1 45 ASN O O 14.658 7.629 0.644 1.00 . A A . 45 ASN O 1 1 1 633 1 1 45 ASN OD1 O 12.989 3.663 -0.612 1.00 . A A . 45 ASN OD1 1 1 1 634 1 1 46 GLY C C 13.216 9.228 4.089 1.00 . A A . 46 GLY C 1 1 1 635 1 1 46 GLY CA C 13.532 9.188 2.607 1.00 . A A . 46 GLY CA 1 1 1 636 1 1 46 GLY H H 11.946 7.858 2.161 1.00 . A A . 46 GLY H 1 1 1 637 1 1 46 GLY HA2 H 13.217 10.119 2.158 1.00 . A A . 46 GLY HA2 1 1 1 638 1 1 46 GLY HA3 H 14.599 9.083 2.481 1.00 . A A . 46 GLY HA3 1 1 1 639 1 1 46 GLY N N 12.869 8.091 1.928 1.00 . A A . 46 GLY N 1 1 1 640 1 1 46 GLY O O 14.102 9.623 4.875 1.00 . A A . 46 GLY O 1 1 1 641 1 1 46 GLY OXT O 12.081 8.865 4.464 1.00 . A A . 46 GLY OXT 1 1 2 642 1 1 1 ALA C C -18.046 -4.580 7.933 1.00 . A A . 1 ALA C 1 1 2 643 1 1 1 ALA CA C -18.610 -3.199 8.247 1.00 . A A . 1 ALA CA 1 1 2 644 1 1 1 ALA CB C -17.580 -2.125 7.934 1.00 . A A . 1 ALA CB 1 1 2 645 1 1 1 ALA H1 H -19.514 -3.998 9.913 1.00 . A A . 1 ALA H1 1 1 2 646 1 1 1 ALA H2 H -18.181 -2.969 10.245 1.00 . A A . 1 ALA H2 1 1 2 647 1 1 1 ALA H3 H -19.680 -2.297 9.755 1.00 . A A . 1 ALA H3 1 1 2 648 1 1 1 ALA HA H -19.475 -3.025 7.623 1.00 . A A . 1 ALA HA 1 1 2 649 1 1 1 ALA HB1 H -16.798 -2.148 8.679 1.00 . A A . 1 ALA HB1 1 1 2 650 1 1 1 ALA HB2 H -18.056 -1.156 7.942 1.00 . A A . 1 ALA HB2 1 1 2 651 1 1 1 ALA HB3 H -17.153 -2.309 6.959 1.00 . A A . 1 ALA HB3 1 1 2 652 1 1 1 ALA N N -19.034 -3.107 9.668 1.00 . A A . 1 ALA N 1 1 2 653 1 1 1 ALA O O -17.458 -5.233 8.795 1.00 . A A . 1 ALA O 1 1 2 654 1 1 2 MET C C -16.988 -6.216 4.940 1.00 . A A . 2 MET C 1 1 2 655 1 1 2 MET CA C -17.739 -6.325 6.263 1.00 . A A . 2 MET CA 1 1 2 656 1 1 2 MET CB C -18.901 -7.310 6.124 1.00 . A A . 2 MET CB 1 1 2 657 1 1 2 MET CE C -20.828 -8.804 8.105 1.00 . A A . 2 MET CE 1 1 2 658 1 1 2 MET CG C -18.547 -8.730 6.532 1.00 . A A . 2 MET CG 1 1 2 659 1 1 2 MET H H -18.707 -4.454 6.050 1.00 . A A . 2 MET H 1 1 2 660 1 1 2 MET HA H -17.060 -6.688 7.020 1.00 . A A . 2 MET HA 1 1 2 661 1 1 2 MET HB2 H -19.720 -6.973 6.743 1.00 . A A . 2 MET HB2 1 1 2 662 1 1 2 MET HB3 H -19.224 -7.324 5.093 1.00 . A A . 2 MET HB3 1 1 2 663 1 1 2 MET HE1 H -21.215 -9.231 7.191 1.00 . A A . 2 MET HE1 1 1 2 664 1 1 2 MET HE2 H -21.328 -9.251 8.951 1.00 . A A . 2 MET HE2 1 1 2 665 1 1 2 MET HE3 H -21.003 -7.738 8.105 1.00 . A A . 2 MET HE3 1 1 2 666 1 1 2 MET HG2 H -19.031 -9.417 5.853 1.00 . A A . 2 MET HG2 1 1 2 667 1 1 2 MET HG3 H -17.476 -8.854 6.465 1.00 . A A . 2 MET HG3 1 1 2 668 1 1 2 MET N N -18.230 -5.020 6.692 1.00 . A A . 2 MET N 1 1 2 669 1 1 2 MET O O -17.055 -7.114 4.101 1.00 . A A . 2 MET O 1 1 2 670 1 1 2 MET SD S -19.069 -9.120 8.214 1.00 . A A . 2 MET SD 1 1 2 671 1 1 3 ASP C C -14.128 -5.520 3.636 1.00 . A A . 3 ASP C 1 1 2 672 1 1 3 ASP CA C -15.510 -4.883 3.539 1.00 . A A . 3 ASP CA 1 1 2 673 1 1 3 ASP CB C -15.375 -3.384 3.268 1.00 . A A . 3 ASP CB 1 1 2 674 1 1 3 ASP CG C -14.677 -2.652 4.397 1.00 . A A . 3 ASP CG 1 1 2 675 1 1 3 ASP H H -16.260 -4.430 5.466 1.00 . A A . 3 ASP H 1 1 2 676 1 1 3 ASP HA H -16.048 -5.341 2.722 1.00 . A A . 3 ASP HA 1 1 2 677 1 1 3 ASP HB2 H -14.805 -3.238 2.363 1.00 . A A . 3 ASP HB2 1 1 2 678 1 1 3 ASP HB3 H -16.360 -2.957 3.141 1.00 . A A . 3 ASP HB3 1 1 2 679 1 1 3 ASP N N -16.274 -5.110 4.761 1.00 . A A . 3 ASP N 1 1 2 680 1 1 3 ASP O O -13.610 -5.741 4.731 1.00 . A A . 3 ASP O 1 1 2 681 1 1 3 ASP OD1 O -15.267 -1.694 4.939 1.00 . A A . 3 ASP OD1 1 1 2 682 1 1 3 ASP OD2 O -13.540 -3.038 4.741 1.00 . A A . 3 ASP OD2 1 1 2 683 1 1 4 CYS C C -11.143 -5.409 2.039 1.00 . A A . 4 CYS C 1 1 2 684 1 1 4 CYS CA C -12.212 -6.426 2.438 1.00 . A A . 4 CYS CA 1 1 2 685 1 1 4 CYS CB C -12.204 -7.601 1.456 1.00 . A A . 4 CYS CB 1 1 2 686 1 1 4 CYS H H -13.998 -5.614 1.643 1.00 . A A . 4 CYS H 1 1 2 687 1 1 4 CYS HA H -11.986 -6.794 3.426 1.00 . A A . 4 CYS HA 1 1 2 688 1 1 4 CYS HB2 H -13.133 -7.606 0.907 1.00 . A A . 4 CYS HB2 1 1 2 689 1 1 4 CYS HB3 H -11.384 -7.476 0.762 1.00 . A A . 4 CYS HB3 1 1 2 690 1 1 4 CYS N N -13.535 -5.814 2.483 1.00 . A A . 4 CYS N 1 1 2 691 1 1 4 CYS O O -9.950 -5.670 2.183 1.00 . A A . 4 CYS O 1 1 2 692 1 1 4 CYS SG S -12.019 -9.235 2.243 1.00 . A A . 4 CYS SG 1 1 2 693 1 1 5 THR C C -9.733 -3.698 0.001 1.00 . A A . 5 THR C 1 1 2 694 1 1 5 THR CA C -10.660 -3.201 1.111 1.00 . A A . 5 THR CA 1 1 2 695 1 1 5 THR CB C -9.866 -2.664 2.317 1.00 . A A . 5 THR CB 1 1 2 696 1 1 5 THR CG2 C -8.547 -3.368 2.586 1.00 . A A . 5 THR CG2 1 1 2 697 1 1 5 THR H H -12.542 -4.108 1.441 1.00 . A A . 5 THR H 1 1 2 698 1 1 5 THR HA H -11.259 -2.395 0.711 1.00 . A A . 5 THR HA 1 1 2 699 1 1 5 THR HB H -10.479 -2.771 3.202 1.00 . A A . 5 THR HB 1 1 2 700 1 1 5 THR HG1 H -9.282 -0.918 2.984 1.00 . A A . 5 THR HG1 1 1 2 701 1 1 5 THR HG21 H -8.085 -3.649 1.653 1.00 . A A . 5 THR HG21 1 1 2 702 1 1 5 THR HG22 H -7.889 -2.701 3.123 1.00 . A A . 5 THR HG22 1 1 2 703 1 1 5 THR HG23 H -8.723 -4.250 3.181 1.00 . A A . 5 THR HG23 1 1 2 704 1 1 5 THR N N -11.578 -4.254 1.535 1.00 . A A . 5 THR N 1 1 2 705 1 1 5 THR O O -9.126 -4.763 0.112 1.00 . A A . 5 THR O 1 1 2 706 1 1 5 THR OG1 O -9.582 -1.287 2.150 1.00 . A A . 5 THR OG1 1 1 2 707 1 1 6 THR C C -8.072 -2.072 -2.773 1.00 . A A . 6 THR C 1 1 2 708 1 1 6 THR CA C -8.793 -3.292 -2.206 1.00 . A A . 6 THR CA 1 1 2 709 1 1 6 THR CB C -9.630 -3.958 -3.300 1.00 . A A . 6 THR CB 1 1 2 710 1 1 6 THR CG2 C -8.928 -5.123 -3.964 1.00 . A A . 6 THR CG2 1 1 2 711 1 1 6 THR H H -10.151 -2.090 -1.112 1.00 . A A . 6 THR H 1 1 2 712 1 1 6 THR HA H -8.056 -3.997 -1.852 1.00 . A A . 6 THR HA 1 1 2 713 1 1 6 THR HB H -9.853 -3.227 -4.064 1.00 . A A . 6 THR HB 1 1 2 714 1 1 6 THR HG1 H -11.410 -4.753 -3.490 1.00 . A A . 6 THR HG1 1 1 2 715 1 1 6 THR HG21 H -8.546 -5.792 -3.207 1.00 . A A . 6 THR HG21 1 1 2 716 1 1 6 THR HG22 H -9.628 -5.654 -4.593 1.00 . A A . 6 THR HG22 1 1 2 717 1 1 6 THR HG23 H -8.111 -4.755 -4.566 1.00 . A A . 6 THR HG23 1 1 2 718 1 1 6 THR N N -9.638 -2.924 -1.075 1.00 . A A . 6 THR N 1 1 2 719 1 1 6 THR O O -8.472 -0.934 -2.530 1.00 . A A . 6 THR O 1 1 2 720 1 1 6 THR OG1 O -10.854 -4.438 -2.773 1.00 . A A . 6 THR OG1 1 1 2 721 1 1 7 GLY C C -4.778 -1.582 -4.284 1.00 . A A . 7 GLY C 1 1 2 722 1 1 7 GLY CA C -6.247 -1.236 -4.120 1.00 . A A . 7 GLY CA 1 1 2 723 1 1 7 GLY H H -6.737 -3.249 -3.687 1.00 . A A . 7 GLY H 1 1 2 724 1 1 7 GLY HA2 H -6.331 -0.365 -3.489 1.00 . A A . 7 GLY HA2 1 1 2 725 1 1 7 GLY HA3 H -6.662 -1.007 -5.090 1.00 . A A . 7 GLY HA3 1 1 2 726 1 1 7 GLY N N -7.008 -2.321 -3.529 1.00 . A A . 7 GLY N 1 1 2 727 1 1 7 GLY O O -4.416 -2.758 -4.310 1.00 . A A . 7 GLY O 1 1 2 728 1 1 8 PRO C C -1.795 -1.259 -3.270 1.00 . A A . 8 PRO C 1 1 2 729 1 1 8 PRO CA C -2.461 -0.790 -4.561 1.00 . A A . 8 PRO CA 1 1 2 730 1 1 8 PRO CB C -1.940 0.590 -4.965 1.00 . A A . 8 PRO CB 1 1 2 731 1 1 8 PRO CD C -4.243 0.865 -4.380 1.00 . A A . 8 PRO CD 1 1 2 732 1 1 8 PRO CG C -2.901 1.547 -4.351 1.00 . A A . 8 PRO CG 1 1 2 733 1 1 8 PRO HA H -2.255 -1.500 -5.349 1.00 . A A . 8 PRO HA 1 1 2 734 1 1 8 PRO HB2 H -0.941 0.728 -4.580 1.00 . A A . 8 PRO HB2 1 1 2 735 1 1 8 PRO HB3 H -1.933 0.676 -6.042 1.00 . A A . 8 PRO HB3 1 1 2 736 1 1 8 PRO HD2 H -4.811 1.113 -3.495 1.00 . A A . 8 PRO HD2 1 1 2 737 1 1 8 PRO HD3 H -4.788 1.142 -5.270 1.00 . A A . 8 PRO HD3 1 1 2 738 1 1 8 PRO HG2 H -2.609 1.757 -3.332 1.00 . A A . 8 PRO HG2 1 1 2 739 1 1 8 PRO HG3 H -2.932 2.458 -4.929 1.00 . A A . 8 PRO HG3 1 1 2 740 1 1 8 PRO N N -3.901 -0.571 -4.399 1.00 . A A . 8 PRO N 1 1 2 741 1 1 8 PRO O O -0.743 -1.897 -3.300 1.00 . A A . 8 PRO O 1 1 2 742 1 1 9 CYS C C -2.557 -2.606 -0.335 1.00 . A A . 9 CYS C 1 1 2 743 1 1 9 CYS CA C -1.884 -1.332 -0.836 1.00 . A A . 9 CYS CA 1 1 2 744 1 1 9 CYS CB C -2.078 -0.203 0.180 1.00 . A A . 9 CYS CB 1 1 2 745 1 1 9 CYS H H -3.253 -0.432 -2.177 1.00 . A A . 9 CYS H 1 1 2 746 1 1 9 CYS HA H -0.828 -1.522 -0.953 1.00 . A A . 9 CYS HA 1 1 2 747 1 1 9 CYS HB2 H -2.780 0.512 -0.220 1.00 . A A . 9 CYS HB2 1 1 2 748 1 1 9 CYS HB3 H -2.475 -0.615 1.096 1.00 . A A . 9 CYS HB3 1 1 2 749 1 1 9 CYS N N -2.416 -0.941 -2.137 1.00 . A A . 9 CYS N 1 1 2 750 1 1 9 CYS O O -1.933 -3.429 0.334 1.00 . A A . 9 CYS O 1 1 2 751 1 1 9 CYS SG S -0.551 0.699 0.593 1.00 . A A . 9 CYS SG 1 1 2 752 1 1 10 CYS C C -4.691 -4.947 -1.386 1.00 . A A . 10 CYS C 1 1 2 753 1 1 10 CYS CA C -4.595 -3.934 -0.249 1.00 . A A . 10 CYS CA 1 1 2 754 1 1 10 CYS CB C -5.999 -3.529 0.205 1.00 . A A . 10 CYS CB 1 1 2 755 1 1 10 CYS H H -4.278 -2.070 -1.200 1.00 . A A . 10 CYS H 1 1 2 756 1 1 10 CYS HA H -4.075 -4.389 0.582 1.00 . A A . 10 CYS HA 1 1 2 757 1 1 10 CYS HB2 H -6.624 -3.395 -0.664 1.00 . A A . 10 CYS HB2 1 1 2 758 1 1 10 CYS HB3 H -6.410 -4.316 0.820 1.00 . A A . 10 CYS HB3 1 1 2 759 1 1 10 CYS N N -3.835 -2.761 -0.664 1.00 . A A . 10 CYS N 1 1 2 760 1 1 10 CYS O O -4.523 -4.599 -2.555 1.00 . A A . 10 CYS O 1 1 2 761 1 1 10 CYS SG S -6.058 -1.983 1.169 1.00 . A A . 10 CYS SG 1 1 2 762 1 1 11 ARG C C -5.529 -8.566 -1.378 1.00 . A A . 11 ARG C 1 1 2 763 1 1 11 ARG CA C -5.084 -7.261 -2.030 1.00 . A A . 11 ARG CA 1 1 2 764 1 1 11 ARG CB C -3.751 -7.464 -2.754 1.00 . A A . 11 ARG CB 1 1 2 765 1 1 11 ARG CD C -2.365 -6.267 -4.477 1.00 . A A . 11 ARG CD 1 1 2 766 1 1 11 ARG CG C -3.723 -6.870 -4.154 1.00 . A A . 11 ARG CG 1 1 2 767 1 1 11 ARG CZ C -0.226 -7.051 -5.416 1.00 . A A . 11 ARG CZ 1 1 2 768 1 1 11 ARG H H -5.088 -6.415 -0.089 1.00 . A A . 11 ARG H 1 1 2 769 1 1 11 ARG HA H -5.831 -6.959 -2.749 1.00 . A A . 11 ARG HA 1 1 2 770 1 1 11 ARG HB2 H -2.966 -7.001 -2.174 1.00 . A A . 11 ARG HB2 1 1 2 771 1 1 11 ARG HB3 H -3.551 -8.523 -2.832 1.00 . A A . 11 ARG HB3 1 1 2 772 1 1 11 ARG HD2 H -2.468 -5.618 -5.334 1.00 . A A . 11 ARG HD2 1 1 2 773 1 1 11 ARG HD3 H -2.030 -5.690 -3.627 1.00 . A A . 11 ARG HD3 1 1 2 774 1 1 11 ARG HE H -1.559 -8.208 -4.485 1.00 . A A . 11 ARG HE 1 1 2 775 1 1 11 ARG HG2 H -3.938 -7.649 -4.869 1.00 . A A . 11 ARG HG2 1 1 2 776 1 1 11 ARG HG3 H -4.475 -6.098 -4.222 1.00 . A A . 11 ARG HG3 1 1 2 777 1 1 11 ARG HH11 H -0.571 -5.072 -5.654 1.00 . A A . 11 ARG HH11 1 1 2 778 1 1 11 ARG HH12 H 0.926 -5.648 -6.306 1.00 . A A . 11 ARG HH12 1 1 2 779 1 1 11 ARG HH21 H 0.410 -8.968 -5.341 1.00 . A A . 11 ARG HH21 1 1 2 780 1 1 11 ARG HH22 H 1.483 -7.860 -6.129 1.00 . A A . 11 ARG HH22 1 1 2 781 1 1 11 ARG N N -4.964 -6.199 -1.037 1.00 . A A . 11 ARG N 1 1 2 782 1 1 11 ARG NE N -1.368 -7.292 -4.776 1.00 . A A . 11 ARG NE 1 1 2 783 1 1 11 ARG NH1 N 0.067 -5.823 -5.826 1.00 . A A . 11 ARG NH1 1 1 2 784 1 1 11 ARG NH2 N 0.626 -8.041 -5.648 1.00 . A A . 11 ARG NH2 1 1 2 785 1 1 11 ARG O O -6.384 -9.278 -1.905 1.00 . A A . 11 ARG O 1 1 2 786 1 1 12 GLN C C -6.347 -9.825 1.560 1.00 . A A . 12 GLN C 1 1 2 787 1 1 12 GLN CA C -5.275 -10.090 0.506 1.00 . A A . 12 GLN CA 1 1 2 788 1 1 12 GLN CB C -4.026 -10.648 1.180 1.00 . A A . 12 GLN CB 1 1 2 789 1 1 12 GLN CD C -2.370 -12.544 0.968 1.00 . A A . 12 GLN CD 1 1 2 790 1 1 12 GLN CG C -3.135 -11.450 0.247 1.00 . A A . 12 GLN CG 1 1 2 791 1 1 12 GLN H H -4.269 -8.263 0.143 1.00 . A A . 12 GLN H 1 1 2 792 1 1 12 GLN HA H -5.648 -10.814 -0.201 1.00 . A A . 12 GLN HA 1 1 2 793 1 1 12 GLN HB2 H -3.452 -9.823 1.574 1.00 . A A . 12 GLN HB2 1 1 2 794 1 1 12 GLN HB3 H -4.329 -11.287 1.995 1.00 . A A . 12 GLN HB3 1 1 2 795 1 1 12 GLN HE21 H -0.671 -11.535 0.749 1.00 . A A . 12 GLN HE21 1 1 2 796 1 1 12 GLN HE22 H -0.545 -13.047 1.574 1.00 . A A . 12 GLN HE22 1 1 2 797 1 1 12 GLN HG2 H -3.749 -11.906 -0.515 1.00 . A A . 12 GLN HG2 1 1 2 798 1 1 12 GLN HG3 H -2.425 -10.781 -0.217 1.00 . A A . 12 GLN HG3 1 1 2 799 1 1 12 GLN N N -4.942 -8.872 -0.226 1.00 . A A . 12 GLN N 1 1 2 800 1 1 12 GLN NE2 N -1.064 -12.356 1.111 1.00 . A A . 12 GLN NE2 1 1 2 801 1 1 12 GLN O O -6.560 -10.640 2.457 1.00 . A A . 12 GLN O 1 1 2 802 1 1 12 GLN OE1 O -2.948 -13.545 1.392 1.00 . A A . 12 GLN OE1 1 1 2 803 1 1 13 CYS C C -7.449 -7.789 3.698 1.00 . A A . 13 CYS C 1 1 2 804 1 1 13 CYS CA C -8.056 -8.284 2.389 1.00 . A A . 13 CYS CA 1 1 2 805 1 1 13 CYS CB C -9.016 -9.447 2.663 1.00 . A A . 13 CYS CB 1 1 2 806 1 1 13 CYS H H -6.780 -8.072 0.716 1.00 . A A . 13 CYS H 1 1 2 807 1 1 13 CYS HA H -8.610 -7.473 1.940 1.00 . A A . 13 CYS HA 1 1 2 808 1 1 13 CYS HB2 H -9.331 -9.875 1.722 1.00 . A A . 13 CYS HB2 1 1 2 809 1 1 13 CYS HB3 H -8.504 -10.201 3.242 1.00 . A A . 13 CYS HB3 1 1 2 810 1 1 13 CYS N N -7.008 -8.677 1.448 1.00 . A A . 13 CYS N 1 1 2 811 1 1 13 CYS O O -8.075 -7.872 4.755 1.00 . A A . 13 CYS O 1 1 2 812 1 1 13 CYS SG S -10.515 -8.969 3.582 1.00 . A A . 13 CYS SG 1 1 2 813 1 1 14 LYS C C -4.466 -5.756 4.379 1.00 . A A . 14 LYS C 1 1 2 814 1 1 14 LYS CA C -5.538 -6.755 4.792 1.00 . A A . 14 LYS CA 1 1 2 815 1 1 14 LYS CB C -4.909 -7.903 5.587 1.00 . A A . 14 LYS CB 1 1 2 816 1 1 14 LYS CD C -5.302 -7.747 8.064 1.00 . A A . 14 LYS CD 1 1 2 817 1 1 14 LYS CE C -6.476 -7.463 8.987 1.00 . A A . 14 LYS CE 1 1 2 818 1 1 14 LYS CG C -5.760 -8.371 6.756 1.00 . A A . 14 LYS CG 1 1 2 819 1 1 14 LYS H H -5.778 -7.226 2.748 1.00 . A A . 14 LYS H 1 1 2 820 1 1 14 LYS HA H -6.265 -6.253 5.413 1.00 . A A . 14 LYS HA 1 1 2 821 1 1 14 LYS HB2 H -4.754 -8.741 4.924 1.00 . A A . 14 LYS HB2 1 1 2 822 1 1 14 LYS HB3 H -3.954 -7.578 5.972 1.00 . A A . 14 LYS HB3 1 1 2 823 1 1 14 LYS HD2 H -4.625 -8.426 8.559 1.00 . A A . 14 LYS HD2 1 1 2 824 1 1 14 LYS HD3 H -4.792 -6.819 7.850 1.00 . A A . 14 LYS HD3 1 1 2 825 1 1 14 LYS HE2 H -6.264 -6.569 9.555 1.00 . A A . 14 LYS HE2 1 1 2 826 1 1 14 LYS HE3 H -7.360 -7.305 8.387 1.00 . A A . 14 LYS HE3 1 1 2 827 1 1 14 LYS HG2 H -6.788 -8.091 6.576 1.00 . A A . 14 LYS HG2 1 1 2 828 1 1 14 LYS HG3 H -5.686 -9.446 6.835 1.00 . A A . 14 LYS HG3 1 1 2 829 1 1 14 LYS HZ1 H -6.384 -9.480 9.521 1.00 . A A . 14 LYS HZ1 1 1 2 830 1 1 14 LYS HZ2 H -6.228 -8.418 10.829 1.00 . A A . 14 LYS HZ2 1 1 2 831 1 1 14 LYS HZ3 H -7.744 -8.675 10.122 1.00 . A A . 14 LYS HZ3 1 1 2 832 1 1 14 LYS N N -6.228 -7.269 3.619 1.00 . A A . 14 LYS N 1 1 2 833 1 1 14 LYS NZ N -6.725 -8.588 9.931 1.00 . A A . 14 LYS NZ 1 1 2 834 1 1 14 LYS O O -3.416 -6.140 3.864 1.00 . A A . 14 LYS O 1 1 2 835 1 1 15 LEU C C -2.367 -3.815 4.552 1.00 . A A . 15 LEU C 1 1 2 836 1 1 15 LEU CA C -3.804 -3.404 4.248 1.00 . A A . 15 LEU CA 1 1 2 837 1 1 15 LEU CB C -4.148 -2.112 4.997 1.00 . A A . 15 LEU CB 1 1 2 838 1 1 15 LEU CD1 C -4.358 -1.285 7.356 1.00 . A A . 15 LEU CD1 1 1 2 839 1 1 15 LEU CD2 C -6.363 -2.190 6.166 1.00 . A A . 15 LEU CD2 1 1 2 840 1 1 15 LEU CG C -4.856 -2.301 6.341 1.00 . A A . 15 LEU CG 1 1 2 841 1 1 15 LEU H H -5.601 -4.234 5.009 1.00 . A A . 15 LEU H 1 1 2 842 1 1 15 LEU HA H -3.895 -3.227 3.186 1.00 . A A . 15 LEU HA 1 1 2 843 1 1 15 LEU HB2 H -3.230 -1.568 5.170 1.00 . A A . 15 LEU HB2 1 1 2 844 1 1 15 LEU HB3 H -4.785 -1.514 4.362 1.00 . A A . 15 LEU HB3 1 1 2 845 1 1 15 LEU HD11 H -4.238 -0.325 6.875 1.00 . A A . 15 LEU HD11 1 1 2 846 1 1 15 LEU HD12 H -5.074 -1.198 8.160 1.00 . A A . 15 LEU HD12 1 1 2 847 1 1 15 LEU HD13 H -3.408 -1.609 7.754 1.00 . A A . 15 LEU HD13 1 1 2 848 1 1 15 LEU HD21 H -6.633 -2.507 5.169 1.00 . A A . 15 LEU HD21 1 1 2 849 1 1 15 LEU HD22 H -6.857 -2.819 6.891 1.00 . A A . 15 LEU HD22 1 1 2 850 1 1 15 LEU HD23 H -6.667 -1.164 6.313 1.00 . A A . 15 LEU HD23 1 1 2 851 1 1 15 LEU HG H -4.634 -3.288 6.721 1.00 . A A . 15 LEU HG 1 1 2 852 1 1 15 LEU N N -4.743 -4.471 4.601 1.00 . A A . 15 LEU N 1 1 2 853 1 1 15 LEU O O -2.017 -4.077 5.703 1.00 . A A . 15 LEU O 1 1 2 854 1 1 16 LYS C C 0.498 -3.617 4.873 1.00 . A A . 16 LYS C 1 1 2 855 1 1 16 LYS CA C -0.146 -4.274 3.649 1.00 . A A . 16 LYS CA 1 1 2 856 1 1 16 LYS CB C 0.637 -3.907 2.387 1.00 . A A . 16 LYS CB 1 1 2 857 1 1 16 LYS CD C 1.324 -4.564 0.059 1.00 . A A . 16 LYS CD 1 1 2 858 1 1 16 LYS CE C 0.257 -4.391 -1.010 1.00 . A A . 16 LYS CE 1 1 2 859 1 1 16 LYS CG C 0.724 -5.037 1.375 1.00 . A A . 16 LYS CG 1 1 2 860 1 1 16 LYS H H -1.892 -3.670 2.615 1.00 . A A . 16 LYS H 1 1 2 861 1 1 16 LYS HA H -0.123 -5.347 3.775 1.00 . A A . 16 LYS HA 1 1 2 862 1 1 16 LYS HB2 H 0.157 -3.063 1.913 1.00 . A A . 16 LYS HB2 1 1 2 863 1 1 16 LYS HB3 H 1.642 -3.627 2.669 1.00 . A A . 16 LYS HB3 1 1 2 864 1 1 16 LYS HD2 H 1.815 -3.616 0.219 1.00 . A A . 16 LYS HD2 1 1 2 865 1 1 16 LYS HD3 H 2.045 -5.293 -0.279 1.00 . A A . 16 LYS HD3 1 1 2 866 1 1 16 LYS HE2 H -0.603 -4.987 -0.742 1.00 . A A . 16 LYS HE2 1 1 2 867 1 1 16 LYS HE3 H -0.027 -3.350 -1.053 1.00 . A A . 16 LYS HE3 1 1 2 868 1 1 16 LYS HG2 H 1.345 -5.822 1.779 1.00 . A A . 16 LYS HG2 1 1 2 869 1 1 16 LYS HG3 H -0.269 -5.420 1.191 1.00 . A A . 16 LYS HG3 1 1 2 870 1 1 16 LYS HZ1 H 1.299 -5.692 -2.270 1.00 . A A . 16 LYS HZ1 1 1 2 871 1 1 16 LYS HZ2 H -0.065 -4.992 -2.985 1.00 . A A . 16 LYS HZ2 1 1 2 872 1 1 16 LYS HZ3 H 1.339 -4.075 -2.768 1.00 . A A . 16 LYS HZ3 1 1 2 873 1 1 16 LYS N N -1.545 -3.882 3.508 1.00 . A A . 16 LYS N 1 1 2 874 1 1 16 LYS NZ N 0.741 -4.817 -2.352 1.00 . A A . 16 LYS NZ 1 1 2 875 1 1 16 LYS O O 0.161 -2.488 5.229 1.00 . A A . 16 LYS O 1 1 2 876 1 1 17 PRO C C 2.812 -2.470 6.464 1.00 . A A . 17 PRO C 1 1 2 877 1 1 17 PRO CA C 2.117 -3.802 6.725 1.00 . A A . 17 PRO CA 1 1 2 878 1 1 17 PRO CB C 3.153 -4.882 7.050 1.00 . A A . 17 PRO CB 1 1 2 879 1 1 17 PRO CD C 1.892 -5.676 5.181 1.00 . A A . 17 PRO CD 1 1 2 880 1 1 17 PRO CG C 2.636 -6.122 6.408 1.00 . A A . 17 PRO CG 1 1 2 881 1 1 17 PRO HA H 1.436 -3.692 7.556 1.00 . A A . 17 PRO HA 1 1 2 882 1 1 17 PRO HB2 H 4.112 -4.597 6.642 1.00 . A A . 17 PRO HB2 1 1 2 883 1 1 17 PRO HB3 H 3.232 -4.997 8.121 1.00 . A A . 17 PRO HB3 1 1 2 884 1 1 17 PRO HD2 H 2.553 -5.649 4.327 1.00 . A A . 17 PRO HD2 1 1 2 885 1 1 17 PRO HD3 H 1.053 -6.330 4.991 1.00 . A A . 17 PRO HD3 1 1 2 886 1 1 17 PRO HG2 H 3.460 -6.763 6.133 1.00 . A A . 17 PRO HG2 1 1 2 887 1 1 17 PRO HG3 H 1.969 -6.635 7.085 1.00 . A A . 17 PRO HG3 1 1 2 888 1 1 17 PRO N N 1.433 -4.321 5.535 1.00 . A A . 17 PRO N 1 1 2 889 1 1 17 PRO O O 3.473 -2.293 5.440 1.00 . A A . 17 PRO O 1 1 2 890 1 1 18 ALA C C 4.797 -0.349 7.139 1.00 . A A . 18 ALA C 1 1 2 891 1 1 18 ALA CA C 3.283 -0.224 7.274 1.00 . A A . 18 ALA CA 1 1 2 892 1 1 18 ALA CB C 2.927 0.645 8.471 1.00 . A A . 18 ALA CB 1 1 2 893 1 1 18 ALA H H 2.128 -1.738 8.195 1.00 . A A . 18 ALA H 1 1 2 894 1 1 18 ALA HA H 2.889 0.247 6.386 1.00 . A A . 18 ALA HA 1 1 2 895 1 1 18 ALA HB1 H 3.534 0.358 9.317 1.00 . A A . 18 ALA HB1 1 1 2 896 1 1 18 ALA HB2 H 3.112 1.681 8.231 1.00 . A A . 18 ALA HB2 1 1 2 897 1 1 18 ALA HB3 H 1.883 0.512 8.715 1.00 . A A . 18 ALA HB3 1 1 2 898 1 1 18 ALA N N 2.664 -1.537 7.400 1.00 . A A . 18 ALA N 1 1 2 899 1 1 18 ALA O O 5.479 -0.783 8.066 1.00 . A A . 18 ALA O 1 1 2 900 1 1 19 GLY C C 7.092 -1.037 4.635 1.00 . A A . 19 GLY C 1 1 2 901 1 1 19 GLY CA C 6.744 -0.052 5.736 1.00 . A A . 19 GLY CA 1 1 2 902 1 1 19 GLY H H 4.721 0.365 5.272 1.00 . A A . 19 GLY H 1 1 2 903 1 1 19 GLY HA2 H 7.234 -0.361 6.648 1.00 . A A . 19 GLY HA2 1 1 2 904 1 1 19 GLY HA3 H 7.108 0.926 5.458 1.00 . A A . 19 GLY HA3 1 1 2 905 1 1 19 GLY N N 5.315 0.030 5.975 1.00 . A A . 19 GLY N 1 1 2 906 1 1 19 GLY O O 8.235 -1.484 4.532 1.00 . A A . 19 GLY O 1 1 2 907 1 1 20 THR C C 5.807 -1.705 1.402 1.00 . A A . 20 THR C 1 1 2 908 1 1 20 THR CA C 6.309 -2.307 2.710 1.00 . A A . 20 THR CA 1 1 2 909 1 1 20 THR CB C 5.585 -3.625 2.993 1.00 . A A . 20 THR CB 1 1 2 910 1 1 20 THR CG2 C 5.732 -4.644 1.883 1.00 . A A . 20 THR CG2 1 1 2 911 1 1 20 THR H H 5.218 -0.983 3.941 1.00 . A A . 20 THR H 1 1 2 912 1 1 20 THR HA H 7.368 -2.496 2.625 1.00 . A A . 20 THR HA 1 1 2 913 1 1 20 THR HB H 4.531 -3.424 3.120 1.00 . A A . 20 THR HB 1 1 2 914 1 1 20 THR HG1 H 7.023 -4.327 4.123 1.00 . A A . 20 THR HG1 1 1 2 915 1 1 20 THR HG21 H 6.076 -4.152 0.986 1.00 . A A . 20 THR HG21 1 1 2 916 1 1 20 THR HG22 H 6.447 -5.397 2.178 1.00 . A A . 20 THR HG22 1 1 2 917 1 1 20 THR HG23 H 4.776 -5.109 1.694 1.00 . A A . 20 THR HG23 1 1 2 918 1 1 20 THR N N 6.105 -1.374 3.810 1.00 . A A . 20 THR N 1 1 2 919 1 1 20 THR O O 4.727 -1.116 1.353 1.00 . A A . 20 THR O 1 1 2 920 1 1 20 THR OG1 O 6.071 -4.217 4.185 1.00 . A A . 20 THR OG1 1 1 2 921 1 1 21 THR C C 4.839 -1.782 -1.376 1.00 . A A . 21 THR C 1 1 2 922 1 1 21 THR CA C 6.231 -1.317 -0.963 1.00 . A A . 21 THR CA 1 1 2 923 1 1 21 THR CB C 7.258 -1.728 -2.019 1.00 . A A . 21 THR CB 1 1 2 924 1 1 21 THR CG2 C 7.987 -0.547 -2.618 1.00 . A A . 21 THR CG2 1 1 2 925 1 1 21 THR H H 7.448 -2.328 0.444 1.00 . A A . 21 THR H 1 1 2 926 1 1 21 THR HA H 6.223 -0.239 -0.887 1.00 . A A . 21 THR HA 1 1 2 927 1 1 21 THR HB H 6.753 -2.247 -2.821 1.00 . A A . 21 THR HB 1 1 2 928 1 1 21 THR HG1 H 8.317 -3.376 -2.024 1.00 . A A . 21 THR HG1 1 1 2 929 1 1 21 THR HG21 H 7.903 0.300 -1.952 1.00 . A A . 21 THR HG21 1 1 2 930 1 1 21 THR HG22 H 9.028 -0.798 -2.754 1.00 . A A . 21 THR HG22 1 1 2 931 1 1 21 THR HG23 H 7.546 -0.300 -3.572 1.00 . A A . 21 THR HG23 1 1 2 932 1 1 21 THR N N 6.598 -1.852 0.344 1.00 . A A . 21 THR N 1 1 2 933 1 1 21 THR O O 4.523 -2.970 -1.307 1.00 . A A . 21 THR O 1 1 2 934 1 1 21 THR OG1 O 8.230 -2.599 -1.467 1.00 . A A . 21 THR OG1 1 1 2 935 1 1 22 CYS C C 2.481 -0.971 -3.723 1.00 . A A . 22 CYS C 1 1 2 936 1 1 22 CYS CA C 2.649 -1.144 -2.218 1.00 . A A . 22 CYS CA 1 1 2 937 1 1 22 CYS CB C 1.652 -0.252 -1.478 1.00 . A A . 22 CYS CB 1 1 2 938 1 1 22 CYS H H 4.319 0.094 -1.828 1.00 . A A . 22 CYS H 1 1 2 939 1 1 22 CYS HA H 2.452 -2.173 -1.963 1.00 . A A . 22 CYS HA 1 1 2 940 1 1 22 CYS HB2 H 0.650 -0.562 -1.729 1.00 . A A . 22 CYS HB2 1 1 2 941 1 1 22 CYS HB3 H 1.802 -0.363 -0.414 1.00 . A A . 22 CYS HB3 1 1 2 942 1 1 22 CYS N N 4.010 -0.835 -1.799 1.00 . A A . 22 CYS N 1 1 2 943 1 1 22 CYS O O 1.641 -1.625 -4.341 1.00 . A A . 22 CYS O 1 1 2 944 1 1 22 CYS SG S 1.797 1.520 -1.878 1.00 . A A . 22 CYS SG 1 1 2 945 1 1 23 TRP C C 4.418 -0.393 -6.469 1.00 . A A . 23 TRP C 1 1 2 946 1 1 23 TRP CA C 3.205 0.171 -5.742 1.00 . A A . 23 TRP CA 1 1 2 947 1 1 23 TRP CB C 3.084 1.673 -6.010 1.00 . A A . 23 TRP CB 1 1 2 948 1 1 23 TRP CD1 C 1.484 1.131 -7.936 1.00 . A A . 23 TRP CD1 1 1 2 949 1 1 23 TRP CD2 C 1.612 3.308 -7.432 1.00 . A A . 23 TRP CD2 1 1 2 950 1 1 23 TRP CE2 C 0.705 3.145 -8.496 1.00 . A A . 23 TRP CE2 1 1 2 951 1 1 23 TRP CE3 C 1.855 4.595 -6.944 1.00 . A A . 23 TRP CE3 1 1 2 952 1 1 23 TRP CG C 2.097 2.006 -7.087 1.00 . A A . 23 TRP CG 1 1 2 953 1 1 23 TRP CH2 C 0.298 5.468 -8.582 1.00 . A A . 23 TRP CH2 1 1 2 954 1 1 23 TRP CZ2 C 0.041 4.220 -9.079 1.00 . A A . 23 TRP CZ2 1 1 2 955 1 1 23 TRP CZ3 C 1.195 5.662 -7.525 1.00 . A A . 23 TRP CZ3 1 1 2 956 1 1 23 TRP H H 3.927 0.411 -3.766 1.00 . A A . 23 TRP H 1 1 2 957 1 1 23 TRP HA H 2.323 -0.320 -6.116 1.00 . A A . 23 TRP HA 1 1 2 958 1 1 23 TRP HB2 H 2.769 2.169 -5.104 1.00 . A A . 23 TRP HB2 1 1 2 959 1 1 23 TRP HB3 H 4.048 2.058 -6.309 1.00 . A A . 23 TRP HB3 1 1 2 960 1 1 23 TRP HD1 H 1.645 0.064 -7.928 1.00 . A A . 23 TRP HD1 1 1 2 961 1 1 23 TRP HE1 H 0.090 1.400 -9.484 1.00 . A A . 23 TRP HE1 1 1 2 962 1 1 23 TRP HE3 H 2.544 4.763 -6.130 1.00 . A A . 23 TRP HE3 1 1 2 963 1 1 23 TRP HH2 H -0.193 6.330 -9.007 1.00 . A A . 23 TRP HH2 1 1 2 964 1 1 23 TRP HZ2 H -0.655 4.087 -9.893 1.00 . A A . 23 TRP HZ2 1 1 2 965 1 1 23 TRP HZ3 H 1.371 6.664 -7.162 1.00 . A A . 23 TRP HZ3 1 1 2 966 1 1 23 TRP N N 3.279 -0.085 -4.309 1.00 . A A . 23 TRP N 1 1 2 967 1 1 23 TRP NE1 N 0.643 1.808 -8.785 1.00 . A A . 23 TRP NE1 1 1 2 968 1 1 23 TRP O O 4.318 -1.385 -7.191 1.00 . A A . 23 TRP O 1 1 2 969 1 1 24 LYS C C 6.626 -0.259 -8.435 1.00 . A A . 24 LYS C 1 1 2 970 1 1 24 LYS CA C 6.798 -0.180 -6.920 1.00 . A A . 24 LYS CA 1 1 2 971 1 1 24 LYS CB C 7.234 -1.539 -6.372 1.00 . A A . 24 LYS CB 1 1 2 972 1 1 24 LYS CD C 9.269 -2.937 -5.904 1.00 . A A . 24 LYS CD 1 1 2 973 1 1 24 LYS CE C 8.706 -4.345 -5.999 1.00 . A A . 24 LYS CE 1 1 2 974 1 1 24 LYS CG C 8.589 -1.997 -6.886 1.00 . A A . 24 LYS CG 1 1 2 975 1 1 24 LYS H H 5.573 1.034 -5.694 1.00 . A A . 24 LYS H 1 1 2 976 1 1 24 LYS HA H 7.561 0.551 -6.695 1.00 . A A . 24 LYS HA 1 1 2 977 1 1 24 LYS HB2 H 7.283 -1.480 -5.295 1.00 . A A . 24 LYS HB2 1 1 2 978 1 1 24 LYS HB3 H 6.499 -2.279 -6.650 1.00 . A A . 24 LYS HB3 1 1 2 979 1 1 24 LYS HD2 H 10.326 -2.967 -6.122 1.00 . A A . 24 LYS HD2 1 1 2 980 1 1 24 LYS HD3 H 9.118 -2.564 -4.901 1.00 . A A . 24 LYS HD3 1 1 2 981 1 1 24 LYS HE2 H 8.922 -4.869 -5.080 1.00 . A A . 24 LYS HE2 1 1 2 982 1 1 24 LYS HE3 H 7.636 -4.283 -6.133 1.00 . A A . 24 LYS HE3 1 1 2 983 1 1 24 LYS HG2 H 8.452 -2.512 -7.825 1.00 . A A . 24 LYS HG2 1 1 2 984 1 1 24 LYS HG3 H 9.218 -1.131 -7.037 1.00 . A A . 24 LYS HG3 1 1 2 985 1 1 24 LYS HZ1 H 9.281 -4.521 -7.999 1.00 . A A . 24 LYS HZ1 1 1 2 986 1 1 24 LYS HZ2 H 10.278 -5.365 -6.923 1.00 . A A . 24 LYS HZ2 1 1 2 987 1 1 24 LYS HZ3 H 8.747 -5.970 -7.311 1.00 . A A . 24 LYS HZ3 1 1 2 988 1 1 24 LYS N N 5.562 0.250 -6.279 1.00 . A A . 24 LYS N 1 1 2 989 1 1 24 LYS NZ N 9.294 -5.103 -7.138 1.00 . A A . 24 LYS NZ 1 1 2 990 1 1 24 LYS O O 7.232 -1.102 -9.096 1.00 . A A . 24 LYS O 1 1 2 991 1 1 25 THR C C 6.840 0.791 -11.200 1.00 . A A . 25 THR C 1 1 2 992 1 1 25 THR CA C 5.538 0.655 -10.416 1.00 . A A . 25 THR CA 1 1 2 993 1 1 25 THR CB C 4.585 1.800 -10.770 1.00 . A A . 25 THR CB 1 1 2 994 1 1 25 THR CG2 C 5.179 3.167 -10.524 1.00 . A A . 25 THR CG2 1 1 2 995 1 1 25 THR H H 5.337 1.272 -8.400 1.00 . A A . 25 THR H 1 1 2 996 1 1 25 THR HA H 5.073 -0.280 -10.689 1.00 . A A . 25 THR HA 1 1 2 997 1 1 25 THR HB H 3.693 1.714 -10.166 1.00 . A A . 25 THR HB 1 1 2 998 1 1 25 THR HG1 H 3.252 1.667 -12.199 1.00 . A A . 25 THR HG1 1 1 2 999 1 1 25 THR HG21 H 6.110 3.058 -9.992 1.00 . A A . 25 THR HG21 1 1 2 1000 1 1 25 THR HG22 H 5.357 3.659 -11.468 1.00 . A A . 25 THR HG22 1 1 2 1001 1 1 25 THR HG23 H 4.493 3.757 -9.933 1.00 . A A . 25 THR HG23 1 1 2 1002 1 1 25 THR N N 5.792 0.626 -8.979 1.00 . A A . 25 THR N 1 1 2 1003 1 1 25 THR O O 7.921 0.895 -10.621 1.00 . A A . 25 THR O 1 1 2 1004 1 1 25 THR OG1 O 4.208 1.736 -12.134 1.00 . A A . 25 THR OG1 1 1 2 1005 1 1 26 SER C C 8.624 2.203 -13.228 1.00 . A A . 26 SER C 1 1 2 1006 1 1 26 SER CA C 7.883 0.876 -13.401 1.00 . A A . 26 SER CA 1 1 2 1007 1 1 26 SER CB C 7.451 0.714 -14.859 1.00 . A A . 26 SER CB 1 1 2 1008 1 1 26 SER H H 5.832 0.675 -12.915 1.00 . A A . 26 SER H 1 1 2 1009 1 1 26 SER HA H 8.556 0.071 -13.150 1.00 . A A . 26 SER HA 1 1 2 1010 1 1 26 SER HB2 H 7.159 -0.311 -15.035 1.00 . A A . 26 SER HB2 1 1 2 1011 1 1 26 SER HB3 H 6.612 1.366 -15.058 1.00 . A A . 26 SER HB3 1 1 2 1012 1 1 26 SER HG H 8.443 0.505 -16.535 1.00 . A A . 26 SER HG 1 1 2 1013 1 1 26 SER N N 6.723 0.773 -12.520 1.00 . A A . 26 SER N 1 1 2 1014 1 1 26 SER O O 9.801 2.307 -13.574 1.00 . A A . 26 SER O 1 1 2 1015 1 1 26 SER OG O 8.507 1.046 -15.744 1.00 . A A . 26 SER OG 1 1 2 1016 1 1 27 VAL C C 7.889 5.304 -11.380 1.00 . A A . 27 VAL C 1 1 2 1017 1 1 27 VAL CA C 8.561 4.525 -12.507 1.00 . A A . 27 VAL CA 1 1 2 1018 1 1 27 VAL CB C 8.512 5.369 -13.798 1.00 . A A . 27 VAL CB 1 1 2 1019 1 1 27 VAL CG1 C 9.318 6.648 -13.632 1.00 . A A . 27 VAL CG1 1 1 2 1020 1 1 27 VAL CG2 C 9.017 4.564 -14.986 1.00 . A A . 27 VAL CG2 1 1 2 1021 1 1 27 VAL H H 7.004 3.086 -12.446 1.00 . A A . 27 VAL H 1 1 2 1022 1 1 27 VAL HA H 9.598 4.364 -12.250 1.00 . A A . 27 VAL HA 1 1 2 1023 1 1 27 VAL HB H 7.483 5.641 -13.986 1.00 . A A . 27 VAL HB 1 1 2 1024 1 1 27 VAL HG11 H 10.135 6.472 -12.948 1.00 . A A . 27 VAL HG11 1 1 2 1025 1 1 27 VAL HG12 H 9.710 6.953 -14.591 1.00 . A A . 27 VAL HG12 1 1 2 1026 1 1 27 VAL HG13 H 8.681 7.426 -13.239 1.00 . A A . 27 VAL HG13 1 1 2 1027 1 1 27 VAL HG21 H 10.006 4.186 -14.771 1.00 . A A . 27 VAL HG21 1 1 2 1028 1 1 27 VAL HG22 H 8.348 3.738 -15.172 1.00 . A A . 27 VAL HG22 1 1 2 1029 1 1 27 VAL HG23 H 9.057 5.199 -15.859 1.00 . A A . 27 VAL HG23 1 1 2 1030 1 1 27 VAL N N 7.940 3.217 -12.702 1.00 . A A . 27 VAL N 1 1 2 1031 1 1 27 VAL O O 7.570 6.484 -11.530 1.00 . A A . 27 VAL O 1 1 2 1032 1 1 28 SER C C 6.800 4.260 -7.979 1.00 . A A . 28 SER C 1 1 2 1033 1 1 28 SER CA C 7.047 5.273 -9.094 1.00 . A A . 28 SER CA 1 1 2 1034 1 1 28 SER CB C 5.724 5.931 -9.501 1.00 . A A . 28 SER CB 1 1 2 1035 1 1 28 SER H H 7.956 3.701 -10.189 1.00 . A A . 28 SER H 1 1 2 1036 1 1 28 SER HA H 7.718 6.035 -8.727 1.00 . A A . 28 SER HA 1 1 2 1037 1 1 28 SER HB2 H 5.479 5.646 -10.513 1.00 . A A . 28 SER HB2 1 1 2 1038 1 1 28 SER HB3 H 4.939 5.605 -8.835 1.00 . A A . 28 SER HB3 1 1 2 1039 1 1 28 SER HG H 5.883 7.701 -10.327 1.00 . A A . 28 SER HG 1 1 2 1040 1 1 28 SER N N 7.679 4.639 -10.249 1.00 . A A . 28 SER N 1 1 2 1041 1 1 28 SER O O 5.722 3.674 -7.888 1.00 . A A . 28 SER O 1 1 2 1042 1 1 28 SER OG O 5.818 7.344 -9.438 1.00 . A A . 28 SER OG 1 1 2 1043 1 1 29 SER C C 7.256 3.831 -4.750 1.00 . A A . 29 SER C 1 1 2 1044 1 1 29 SER CA C 7.691 3.118 -6.026 1.00 . A A . 29 SER CA 1 1 2 1045 1 1 29 SER CB C 9.024 2.403 -5.797 1.00 . A A . 29 SER CB 1 1 2 1046 1 1 29 SER H H 8.640 4.556 -7.256 1.00 . A A . 29 SER H 1 1 2 1047 1 1 29 SER HA H 6.941 2.387 -6.289 1.00 . A A . 29 SER HA 1 1 2 1048 1 1 29 SER HB2 H 9.775 3.127 -5.515 1.00 . A A . 29 SER HB2 1 1 2 1049 1 1 29 SER HB3 H 8.910 1.677 -5.005 1.00 . A A . 29 SER HB3 1 1 2 1050 1 1 29 SER HG H 9.335 2.312 -7.729 1.00 . A A . 29 SER HG 1 1 2 1051 1 1 29 SER N N 7.805 4.059 -7.134 1.00 . A A . 29 SER N 1 1 2 1052 1 1 29 SER O O 7.795 4.881 -4.400 1.00 . A A . 29 SER O 1 1 2 1053 1 1 29 SER OG O 9.454 1.736 -6.970 1.00 . A A . 29 SER OG 1 1 2 1054 1 1 30 HIS C C 5.606 2.765 -1.751 1.00 . A A . 30 HIS C 1 1 2 1055 1 1 30 HIS CA C 5.767 3.834 -2.826 1.00 . A A . 30 HIS CA 1 1 2 1056 1 1 30 HIS CB C 4.426 4.525 -3.079 1.00 . A A . 30 HIS CB 1 1 2 1057 1 1 30 HIS CD2 C 4.882 5.531 -5.425 1.00 . A A . 30 HIS CD2 1 1 2 1058 1 1 30 HIS CE1 C 4.305 7.603 -5.004 1.00 . A A . 30 HIS CE1 1 1 2 1059 1 1 30 HIS CG C 4.493 5.589 -4.129 1.00 . A A . 30 HIS CG 1 1 2 1060 1 1 30 HIS H H 5.888 2.420 -4.393 1.00 . A A . 30 HIS H 1 1 2 1061 1 1 30 HIS HA H 6.481 4.568 -2.483 1.00 . A A . 30 HIS HA 1 1 2 1062 1 1 30 HIS HB2 H 3.704 3.788 -3.400 1.00 . A A . 30 HIS HB2 1 1 2 1063 1 1 30 HIS HB3 H 4.085 4.982 -2.162 1.00 . A A . 30 HIS HB3 1 1 2 1064 1 1 30 HIS HD1 H 3.810 7.263 -3.047 1.00 . A A . 30 HIS HD1 1 1 2 1065 1 1 30 HIS HD2 H 5.229 4.653 -5.951 1.00 . A A . 30 HIS HD2 1 1 2 1066 1 1 30 HIS HE1 H 4.108 8.659 -5.118 1.00 . A A . 30 HIS HE1 1 1 2 1067 1 1 30 HIS HE2 H 5.049 7.076 -6.837 1.00 . A A . 30 HIS HE2 1 1 2 1068 1 1 30 HIS N N 6.277 3.255 -4.062 1.00 . A A . 30 HIS N 1 1 2 1069 1 1 30 HIS ND1 N 4.138 6.901 -3.897 1.00 . A A . 30 HIS ND1 1 1 2 1070 1 1 30 HIS NE2 N 4.756 6.795 -5.945 1.00 . A A . 30 HIS NE2 1 1 2 1071 1 1 30 HIS O O 5.459 1.582 -2.056 1.00 . A A . 30 HIS O 1 1 2 1072 1 1 31 TYR C C 4.125 2.416 1.284 1.00 . A A . 31 TYR C 1 1 2 1073 1 1 31 TYR CA C 5.492 2.268 0.627 1.00 . A A . 31 TYR CA 1 1 2 1074 1 1 31 TYR CB C 6.596 2.510 1.657 1.00 . A A . 31 TYR CB 1 1 2 1075 1 1 31 TYR CD1 C 8.820 2.466 0.463 1.00 . A A . 31 TYR CD1 1 1 2 1076 1 1 31 TYR CD2 C 8.228 0.591 1.809 1.00 . A A . 31 TYR CD2 1 1 2 1077 1 1 31 TYR CE1 C 10.018 1.859 0.137 1.00 . A A . 31 TYR CE1 1 1 2 1078 1 1 31 TYR CE2 C 9.423 -0.023 1.488 1.00 . A A . 31 TYR CE2 1 1 2 1079 1 1 31 TYR CG C 7.906 1.843 1.304 1.00 . A A . 31 TYR CG 1 1 2 1080 1 1 31 TYR CZ C 10.315 0.615 0.652 1.00 . A A . 31 TYR CZ 1 1 2 1081 1 1 31 TYR H H 5.755 4.145 -0.313 1.00 . A A . 31 TYR H 1 1 2 1082 1 1 31 TYR HA H 5.586 1.263 0.243 1.00 . A A . 31 TYR HA 1 1 2 1083 1 1 31 TYR HB2 H 6.776 3.571 1.739 1.00 . A A . 31 TYR HB2 1 1 2 1084 1 1 31 TYR HB3 H 6.276 2.128 2.615 1.00 . A A . 31 TYR HB3 1 1 2 1085 1 1 31 TYR HD1 H 8.585 3.441 0.062 1.00 . A A . 31 TYR HD1 1 1 2 1086 1 1 31 TYR HD2 H 7.527 0.093 2.463 1.00 . A A . 31 TYR HD2 1 1 2 1087 1 1 31 TYR HE1 H 10.715 2.360 -0.519 1.00 . A A . 31 TYR HE1 1 1 2 1088 1 1 31 TYR HE2 H 9.655 -0.997 1.892 1.00 . A A . 31 TYR HE2 1 1 2 1089 1 1 31 TYR HH H 11.987 -0.203 1.134 1.00 . A A . 31 TYR HH 1 1 2 1090 1 1 31 TYR N N 5.635 3.190 -0.493 1.00 . A A . 31 TYR N 1 1 2 1091 1 1 31 TYR O O 3.491 3.467 1.189 1.00 . A A . 31 TYR O 1 1 2 1092 1 1 31 TYR OH O 11.506 0.007 0.329 1.00 . A A . 31 TYR OH 1 1 2 1093 1 1 32 CYS C C 2.547 1.730 4.092 1.00 . A A . 32 CYS C 1 1 2 1094 1 1 32 CYS CA C 2.386 1.371 2.621 1.00 . A A . 32 CYS CA 1 1 2 1095 1 1 32 CYS CB C 1.707 0.006 2.491 1.00 . A A . 32 CYS CB 1 1 2 1096 1 1 32 CYS H H 4.225 0.549 1.991 1.00 . A A . 32 CYS H 1 1 2 1097 1 1 32 CYS HA H 1.769 2.118 2.145 1.00 . A A . 32 CYS HA 1 1 2 1098 1 1 32 CYS HB2 H 2.024 -0.459 1.570 1.00 . A A . 32 CYS HB2 1 1 2 1099 1 1 32 CYS HB3 H 2.004 -0.615 3.323 1.00 . A A . 32 CYS HB3 1 1 2 1100 1 1 32 CYS N N 3.676 1.358 1.949 1.00 . A A . 32 CYS N 1 1 2 1101 1 1 32 CYS O O 3.595 1.485 4.690 1.00 . A A . 32 CYS O 1 1 2 1102 1 1 32 CYS SG S -0.113 0.079 2.475 1.00 . A A . 32 CYS SG 1 1 2 1103 1 1 33 THR C C 0.546 1.831 6.877 1.00 . A A . 33 THR C 1 1 2 1104 1 1 33 THR CA C 1.520 2.688 6.076 1.00 . A A . 33 THR CA 1 1 2 1105 1 1 33 THR CB C 1.161 4.168 6.229 1.00 . A A . 33 THR CB 1 1 2 1106 1 1 33 THR CG2 C 1.858 5.061 5.226 1.00 . A A . 33 THR CG2 1 1 2 1107 1 1 33 THR H H 0.692 2.466 4.143 1.00 . A A . 33 THR H 1 1 2 1108 1 1 33 THR HA H 2.519 2.527 6.452 1.00 . A A . 33 THR HA 1 1 2 1109 1 1 33 THR HB H 1.446 4.496 7.218 1.00 . A A . 33 THR HB 1 1 2 1110 1 1 33 THR HG1 H -0.498 4.125 5.188 1.00 . A A . 33 THR HG1 1 1 2 1111 1 1 33 THR HG21 H 2.655 4.511 4.747 1.00 . A A . 33 THR HG21 1 1 2 1112 1 1 33 THR HG22 H 1.148 5.389 4.481 1.00 . A A . 33 THR HG22 1 1 2 1113 1 1 33 THR HG23 H 2.269 5.921 5.734 1.00 . A A . 33 THR HG23 1 1 2 1114 1 1 33 THR N N 1.501 2.304 4.671 1.00 . A A . 33 THR N 1 1 2 1115 1 1 33 THR O O 0.139 2.201 7.978 1.00 . A A . 33 THR O 1 1 2 1116 1 1 33 THR OG1 O -0.234 4.363 6.080 1.00 . A A . 33 THR OG1 1 1 2 1117 1 1 34 GLY C C -1.962 0.510 7.553 1.00 . A A . 34 GLY C 1 1 2 1118 1 1 34 GLY CA C -0.754 -0.214 6.987 1.00 . A A . 34 GLY CA 1 1 2 1119 1 1 34 GLY H H 0.532 0.438 5.432 1.00 . A A . 34 GLY H 1 1 2 1120 1 1 34 GLY HA2 H -0.235 -0.710 7.794 1.00 . A A . 34 GLY HA2 1 1 2 1121 1 1 34 GLY HA3 H -1.093 -0.958 6.282 1.00 . A A . 34 GLY HA3 1 1 2 1122 1 1 34 GLY N N 0.173 0.681 6.314 1.00 . A A . 34 GLY N 1 1 2 1123 1 1 34 GLY O O -2.316 0.322 8.717 1.00 . A A . 34 GLY O 1 1 2 1124 1 1 35 ARG C C -4.905 1.975 6.160 1.00 . A A . 35 ARG C 1 1 2 1125 1 1 35 ARG CA C -3.764 2.099 7.163 1.00 . A A . 35 ARG CA 1 1 2 1126 1 1 35 ARG CB C -3.401 3.572 7.358 1.00 . A A . 35 ARG CB 1 1 2 1127 1 1 35 ARG CD C -4.028 4.514 9.603 1.00 . A A . 35 ARG CD 1 1 2 1128 1 1 35 ARG CG C -2.920 3.899 8.763 1.00 . A A . 35 ARG CG 1 1 2 1129 1 1 35 ARG CZ C -6.228 3.816 10.467 1.00 . A A . 35 ARG CZ 1 1 2 1130 1 1 35 ARG H H -2.263 1.454 5.815 1.00 . A A . 35 ARG H 1 1 2 1131 1 1 35 ARG HA H -4.089 1.692 8.105 1.00 . A A . 35 ARG HA 1 1 2 1132 1 1 35 ARG HB2 H -2.617 3.833 6.663 1.00 . A A . 35 ARG HB2 1 1 2 1133 1 1 35 ARG HB3 H -4.271 4.177 7.149 1.00 . A A . 35 ARG HB3 1 1 2 1134 1 1 35 ARG HD2 H -3.686 4.591 10.625 1.00 . A A . 35 ARG HD2 1 1 2 1135 1 1 35 ARG HD3 H -4.246 5.500 9.222 1.00 . A A . 35 ARG HD3 1 1 2 1136 1 1 35 ARG HE H -5.343 3.060 8.846 1.00 . A A . 35 ARG HE 1 1 2 1137 1 1 35 ARG HG2 H -2.584 2.990 9.239 1.00 . A A . 35 ARG HG2 1 1 2 1138 1 1 35 ARG HG3 H -2.099 4.598 8.698 1.00 . A A . 35 ARG HG3 1 1 2 1139 1 1 35 ARG HH11 H -5.326 5.269 11.547 1.00 . A A . 35 ARG HH11 1 1 2 1140 1 1 35 ARG HH12 H -6.874 4.761 12.134 1.00 . A A . 35 ARG HH12 1 1 2 1141 1 1 35 ARG HH21 H -7.380 2.391 9.615 1.00 . A A . 35 ARG HH21 1 1 2 1142 1 1 35 ARG HH22 H -8.040 3.127 11.037 1.00 . A A . 35 ARG HH22 1 1 2 1143 1 1 35 ARG N N -2.594 1.343 6.731 1.00 . A A . 35 ARG N 1 1 2 1144 1 1 35 ARG NE N -5.248 3.711 9.572 1.00 . A A . 35 ARG NE 1 1 2 1145 1 1 35 ARG NH1 N -6.134 4.687 11.465 1.00 . A A . 35 ARG NH1 1 1 2 1146 1 1 35 ARG NH2 N -7.304 3.048 10.365 1.00 . A A . 35 ARG NH2 1 1 2 1147 1 1 35 ARG O O -6.054 1.741 6.536 1.00 . A A . 35 ARG O 1 1 2 1148 1 1 36 SER C C -4.955 1.617 2.505 1.00 . A A . 36 SER C 1 1 2 1149 1 1 36 SER CA C -5.585 2.048 3.825 1.00 . A A . 36 SER CA 1 1 2 1150 1 1 36 SER CB C -6.290 3.394 3.650 1.00 . A A . 36 SER CB 1 1 2 1151 1 1 36 SER H H -3.652 2.325 4.648 1.00 . A A . 36 SER H 1 1 2 1152 1 1 36 SER HA H -6.313 1.307 4.120 1.00 . A A . 36 SER HA 1 1 2 1153 1 1 36 SER HB2 H -5.618 4.190 3.934 1.00 . A A . 36 SER HB2 1 1 2 1154 1 1 36 SER HB3 H -6.576 3.516 2.615 1.00 . A A . 36 SER HB3 1 1 2 1155 1 1 36 SER HG H -7.203 3.690 5.357 1.00 . A A . 36 SER HG 1 1 2 1156 1 1 36 SER N N -4.583 2.137 4.883 1.00 . A A . 36 SER N 1 1 2 1157 1 1 36 SER O O -3.735 1.501 2.395 1.00 . A A . 36 SER O 1 1 2 1158 1 1 36 SER OG O -7.452 3.470 4.457 1.00 . A A . 36 SER OG 1 1 2 1159 1 1 37 CYS C C -4.668 2.118 -0.555 1.00 . A A . 37 CYS C 1 1 2 1160 1 1 37 CYS CA C -5.332 0.962 0.189 1.00 . A A . 37 CYS CA 1 1 2 1161 1 1 37 CYS CB C -6.497 0.415 -0.636 1.00 . A A . 37 CYS CB 1 1 2 1162 1 1 37 CYS H H -6.762 1.491 1.658 1.00 . A A . 37 CYS H 1 1 2 1163 1 1 37 CYS HA H -4.606 0.176 0.332 1.00 . A A . 37 CYS HA 1 1 2 1164 1 1 37 CYS HB2 H -7.170 1.224 -0.876 1.00 . A A . 37 CYS HB2 1 1 2 1165 1 1 37 CYS HB3 H -6.112 -0.010 -1.551 1.00 . A A . 37 CYS HB3 1 1 2 1166 1 1 37 CYS N N -5.800 1.380 1.506 1.00 . A A . 37 CYS N 1 1 2 1167 1 1 37 CYS O O -3.908 1.904 -1.500 1.00 . A A . 37 CYS O 1 1 2 1168 1 1 37 CYS SG S -7.464 -0.875 0.212 1.00 . A A . 37 CYS SG 1 1 2 1169 1 1 38 GLU C C -2.886 4.608 -0.507 1.00 . A A . 38 GLU C 1 1 2 1170 1 1 38 GLU CA C -4.388 4.527 -0.759 1.00 . A A . 38 GLU CA 1 1 2 1171 1 1 38 GLU CB C -5.074 5.790 -0.235 1.00 . A A . 38 GLU CB 1 1 2 1172 1 1 38 GLU CD C -3.897 7.646 -1.481 1.00 . A A . 38 GLU CD 1 1 2 1173 1 1 38 GLU CG C -5.196 6.892 -1.276 1.00 . A A . 38 GLU CG 1 1 2 1174 1 1 38 GLU H H -5.574 3.453 0.628 1.00 . A A . 38 GLU H 1 1 2 1175 1 1 38 GLU HA H -4.559 4.450 -1.822 1.00 . A A . 38 GLU HA 1 1 2 1176 1 1 38 GLU HB2 H -6.066 5.533 0.104 1.00 . A A . 38 GLU HB2 1 1 2 1177 1 1 38 GLU HB3 H -4.506 6.175 0.599 1.00 . A A . 38 GLU HB3 1 1 2 1178 1 1 38 GLU HG2 H -5.491 6.450 -2.216 1.00 . A A . 38 GLU HG2 1 1 2 1179 1 1 38 GLU HG3 H -5.955 7.590 -0.954 1.00 . A A . 38 GLU HG3 1 1 2 1180 1 1 38 GLU N N -4.960 3.343 -0.127 1.00 . A A . 38 GLU N 1 1 2 1181 1 1 38 GLU O O -2.443 4.712 0.637 1.00 . A A . 38 GLU O 1 1 2 1182 1 1 38 GLU OE1 O -3.653 8.109 -2.616 1.00 . A A . 38 GLU OE1 1 1 2 1183 1 1 38 GLU OE2 O -3.125 7.775 -0.509 1.00 . A A . 38 GLU OE2 1 1 2 1184 1 1 39 CYS C C -0.174 6.081 -1.497 1.00 . A A . 39 CYS C 1 1 2 1185 1 1 39 CYS CA C -0.652 4.630 -1.477 1.00 . A A . 39 CYS CA 1 1 2 1186 1 1 39 CYS CB C 0.004 3.851 -2.619 1.00 . A A . 39 CYS CB 1 1 2 1187 1 1 39 CYS H H -2.517 4.478 -2.469 1.00 . A A . 39 CYS H 1 1 2 1188 1 1 39 CYS HA H -0.369 4.181 -0.537 1.00 . A A . 39 CYS HA 1 1 2 1189 1 1 39 CYS HB2 H -0.484 4.109 -3.547 1.00 . A A . 39 CYS HB2 1 1 2 1190 1 1 39 CYS HB3 H 1.047 4.125 -2.679 1.00 . A A . 39 CYS HB3 1 1 2 1191 1 1 39 CYS N N -2.106 4.561 -1.583 1.00 . A A . 39 CYS N 1 1 2 1192 1 1 39 CYS O O -0.716 6.909 -2.229 1.00 . A A . 39 CYS O 1 1 2 1193 1 1 39 CYS SG S -0.085 2.042 -2.433 1.00 . A A . 39 CYS SG 1 1 2 1194 1 1 40 PRO C C 1.790 8.300 -2.003 1.00 . A A . 40 PRO C 1 1 2 1195 1 1 40 PRO CA C 1.397 7.771 -0.628 1.00 . A A . 40 PRO CA 1 1 2 1196 1 1 40 PRO CB C 2.635 7.622 0.260 1.00 . A A . 40 PRO CB 1 1 2 1197 1 1 40 PRO CD C 1.561 5.488 0.215 1.00 . A A . 40 PRO CD 1 1 2 1198 1 1 40 PRO CG C 2.369 6.410 1.084 1.00 . A A . 40 PRO CG 1 1 2 1199 1 1 40 PRO HA H 0.699 8.455 -0.167 1.00 . A A . 40 PRO HA 1 1 2 1200 1 1 40 PRO HB2 H 3.511 7.495 -0.358 1.00 . A A . 40 PRO HB2 1 1 2 1201 1 1 40 PRO HB3 H 2.747 8.501 0.877 1.00 . A A . 40 PRO HB3 1 1 2 1202 1 1 40 PRO HD2 H 2.210 4.826 -0.338 1.00 . A A . 40 PRO HD2 1 1 2 1203 1 1 40 PRO HD3 H 0.862 4.923 0.813 1.00 . A A . 40 PRO HD3 1 1 2 1204 1 1 40 PRO HG2 H 3.303 5.942 1.361 1.00 . A A . 40 PRO HG2 1 1 2 1205 1 1 40 PRO HG3 H 1.808 6.681 1.966 1.00 . A A . 40 PRO HG3 1 1 2 1206 1 1 40 PRO N N 0.852 6.411 -0.691 1.00 . A A . 40 PRO N 1 1 2 1207 1 1 40 PRO O O 1.789 7.559 -2.986 1.00 . A A . 40 PRO O 1 1 2 1208 1 1 41 SER C C 4.032 10.438 -3.365 1.00 . A A . 41 SER C 1 1 2 1209 1 1 41 SER CA C 2.524 10.208 -3.321 1.00 . A A . 41 SER CA 1 1 2 1210 1 1 41 SER CB C 1.788 11.536 -3.509 1.00 . A A . 41 SER CB 1 1 2 1211 1 1 41 SER H H 2.110 10.123 -1.247 1.00 . A A . 41 SER H 1 1 2 1212 1 1 41 SER HA H 2.251 9.539 -4.124 1.00 . A A . 41 SER HA 1 1 2 1213 1 1 41 SER HB2 H 2.318 12.317 -2.984 1.00 . A A . 41 SER HB2 1 1 2 1214 1 1 41 SER HB3 H 1.745 11.776 -4.562 1.00 . A A . 41 SER HB3 1 1 2 1215 1 1 41 SER HG H 0.305 12.209 -2.420 1.00 . A A . 41 SER HG 1 1 2 1216 1 1 41 SER N N 2.127 9.584 -2.065 1.00 . A A . 41 SER N 1 1 2 1217 1 1 41 SER O O 4.512 11.335 -4.057 1.00 . A A . 41 SER O 1 1 2 1218 1 1 41 SER OG O 0.466 11.464 -3.003 1.00 . A A . 41 SER OG 1 1 2 1219 1 1 42 TYR C C 6.857 8.435 -2.084 1.00 . A A . 42 TYR C 1 1 2 1220 1 1 42 TYR CA C 6.226 9.734 -2.582 1.00 . A A . 42 TYR CA 1 1 2 1221 1 1 42 TYR CB C 6.642 10.898 -1.680 1.00 . A A . 42 TYR CB 1 1 2 1222 1 1 42 TYR CD1 C 5.118 11.145 0.319 1.00 . A A . 42 TYR CD1 1 1 2 1223 1 1 42 TYR CD2 C 7.199 10.022 0.622 1.00 . A A . 42 TYR CD2 1 1 2 1224 1 1 42 TYR CE1 C 4.815 10.951 1.653 1.00 . A A . 42 TYR CE1 1 1 2 1225 1 1 42 TYR CE2 C 6.903 9.824 1.957 1.00 . A A . 42 TYR CE2 1 1 2 1226 1 1 42 TYR CG C 6.313 10.685 -0.219 1.00 . A A . 42 TYR CG 1 1 2 1227 1 1 42 TYR CZ C 5.710 10.291 2.467 1.00 . A A . 42 TYR CZ 1 1 2 1228 1 1 42 TYR H H 4.334 8.923 -2.095 1.00 . A A . 42 TYR H 1 1 2 1229 1 1 42 TYR HA H 6.571 9.928 -3.586 1.00 . A A . 42 TYR HA 1 1 2 1230 1 1 42 TYR HB2 H 7.709 11.043 -1.760 1.00 . A A . 42 TYR HB2 1 1 2 1231 1 1 42 TYR HB3 H 6.137 11.796 -2.007 1.00 . A A . 42 TYR HB3 1 1 2 1232 1 1 42 TYR HD1 H 4.419 11.662 -0.322 1.00 . A A . 42 TYR HD1 1 1 2 1233 1 1 42 TYR HD2 H 8.133 9.659 0.219 1.00 . A A . 42 TYR HD2 1 1 2 1234 1 1 42 TYR HE1 H 3.880 11.316 2.052 1.00 . A A . 42 TYR HE1 1 1 2 1235 1 1 42 TYR HE2 H 7.604 9.307 2.594 1.00 . A A . 42 TYR HE2 1 1 2 1236 1 1 42 TYR HH H 4.989 10.883 4.149 1.00 . A A . 42 TYR HH 1 1 2 1237 1 1 42 TYR N N 4.773 9.621 -2.624 1.00 . A A . 42 TYR N 1 1 2 1238 1 1 42 TYR O O 6.322 7.781 -1.189 1.00 . A A . 42 TYR O 1 1 2 1239 1 1 42 TYR OH O 5.411 10.096 3.796 1.00 . A A . 42 TYR OH 1 1 2 1240 1 1 43 PRO C C 9.110 6.818 -0.798 1.00 . A A . 43 PRO C 1 1 2 1241 1 1 43 PRO CA C 8.702 6.811 -2.268 1.00 . A A . 43 PRO CA 1 1 2 1242 1 1 43 PRO CB C 9.940 6.781 -3.175 1.00 . A A . 43 PRO CB 1 1 2 1243 1 1 43 PRO CD C 8.713 8.755 -3.735 1.00 . A A . 43 PRO CD 1 1 2 1244 1 1 43 PRO CG C 10.097 8.176 -3.677 1.00 . A A . 43 PRO CG 1 1 2 1245 1 1 43 PRO HA H 8.096 5.941 -2.459 1.00 . A A . 43 PRO HA 1 1 2 1246 1 1 43 PRO HB2 H 10.801 6.470 -2.601 1.00 . A A . 43 PRO HB2 1 1 2 1247 1 1 43 PRO HB3 H 9.775 6.088 -3.987 1.00 . A A . 43 PRO HB3 1 1 2 1248 1 1 43 PRO HD2 H 8.739 9.818 -3.541 1.00 . A A . 43 PRO HD2 1 1 2 1249 1 1 43 PRO HD3 H 8.259 8.556 -4.695 1.00 . A A . 43 PRO HD3 1 1 2 1250 1 1 43 PRO HG2 H 10.713 8.746 -2.998 1.00 . A A . 43 PRO HG2 1 1 2 1251 1 1 43 PRO HG3 H 10.538 8.164 -4.663 1.00 . A A . 43 PRO HG3 1 1 2 1252 1 1 43 PRO N N 8.006 8.040 -2.660 1.00 . A A . 43 PRO N 1 1 2 1253 1 1 43 PRO O O 8.504 6.136 0.028 1.00 . A A . 43 PRO O 1 1 2 1254 1 1 44 GLY C C 11.997 7.085 1.064 1.00 . A A . 44 GLY C 1 1 2 1255 1 1 44 GLY CA C 10.611 7.675 0.891 1.00 . A A . 44 GLY CA 1 1 2 1256 1 1 44 GLY H H 10.582 8.112 -1.180 1.00 . A A . 44 GLY H 1 1 2 1257 1 1 44 GLY HA2 H 9.923 7.142 1.530 1.00 . A A . 44 GLY HA2 1 1 2 1258 1 1 44 GLY HA3 H 10.634 8.713 1.190 1.00 . A A . 44 GLY HA3 1 1 2 1259 1 1 44 GLY N N 10.139 7.593 -0.479 1.00 . A A . 44 GLY N 1 1 2 1260 1 1 44 GLY O O 12.160 6.042 1.698 1.00 . A A . 44 GLY O 1 1 2 1261 1 1 45 ASN C C 14.826 7.210 2.048 1.00 . A A . 45 ASN C 1 1 2 1262 1 1 45 ASN CA C 14.376 7.287 0.592 1.00 . A A . 45 ASN CA 1 1 2 1263 1 1 45 ASN CB C 15.304 8.217 -0.192 1.00 . A A . 45 ASN CB 1 1 2 1264 1 1 45 ASN CG C 15.136 9.670 0.204 1.00 . A A . 45 ASN CG 1 1 2 1265 1 1 45 ASN H H 12.803 8.577 0.005 1.00 . A A . 45 ASN H 1 1 2 1266 1 1 45 ASN HA H 14.423 6.299 0.160 1.00 . A A . 45 ASN HA 1 1 2 1267 1 1 45 ASN HB2 H 16.329 7.930 -0.009 1.00 . A A . 45 ASN HB2 1 1 2 1268 1 1 45 ASN HB3 H 15.091 8.122 -1.247 1.00 . A A . 45 ASN HB3 1 1 2 1269 1 1 45 ASN HD21 H 16.118 9.347 1.903 1.00 . A A . 45 ASN HD21 1 1 2 1270 1 1 45 ASN HD22 H 15.565 10.964 1.652 1.00 . A A . 45 ASN HD22 1 1 2 1271 1 1 45 ASN N N 12.997 7.752 0.498 1.00 . A A . 45 ASN N 1 1 2 1272 1 1 45 ASN ND2 N 15.659 10.030 1.371 1.00 . A A . 45 ASN ND2 1 1 2 1273 1 1 45 ASN O O 15.653 6.372 2.408 1.00 . A A . 45 ASN O 1 1 2 1274 1 1 45 ASN OD1 O 14.544 10.461 -0.529 1.00 . A A . 45 ASN OD1 1 1 2 1275 1 1 46 GLY C C 13.426 8.250 5.190 1.00 . A A . 46 GLY C 1 1 2 1276 1 1 46 GLY CA C 14.634 8.102 4.286 1.00 . A A . 46 GLY CA 1 1 2 1277 1 1 46 GLY H H 13.623 8.732 2.536 1.00 . A A . 46 GLY H 1 1 2 1278 1 1 46 GLY HA2 H 15.308 8.926 4.467 1.00 . A A . 46 GLY HA2 1 1 2 1279 1 1 46 GLY HA3 H 15.138 7.178 4.527 1.00 . A A . 46 GLY HA3 1 1 2 1280 1 1 46 GLY N N 14.276 8.088 2.880 1.00 . A A . 46 GLY N 1 1 2 1281 1 1 46 GLY O O 12.434 8.874 4.758 1.00 . A A . 46 GLY O 1 1 2 1282 1 1 46 GLY OXT O 13.472 7.742 6.330 1.00 . A A . 46 GLY OXT 1 1 3 1283 1 1 1 ALA C C -20.081 -2.790 1.822 1.00 . A A . 1 ALA C 1 1 3 1284 1 1 1 ALA CA C -21.386 -2.788 2.611 1.00 . A A . 1 ALA CA 1 1 3 1285 1 1 1 ALA CB C -22.331 -3.848 2.067 1.00 . A A . 1 ALA CB 1 1 3 1286 1 1 1 ALA H1 H -21.329 -0.749 2.873 1.00 . A A . 1 ALA H1 1 1 3 1287 1 1 1 ALA H2 H -22.337 -1.278 1.588 1.00 . A A . 1 ALA H2 1 1 3 1288 1 1 1 ALA H3 H -22.845 -1.471 3.216 1.00 . A A . 1 ALA H3 1 1 3 1289 1 1 1 ALA HA H -21.170 -3.028 3.642 1.00 . A A . 1 ALA HA 1 1 3 1290 1 1 1 ALA HB1 H -22.144 -3.992 1.014 1.00 . A A . 1 ALA HB1 1 1 3 1291 1 1 1 ALA HB2 H -22.169 -4.778 2.592 1.00 . A A . 1 ALA HB2 1 1 3 1292 1 1 1 ALA HB3 H -23.353 -3.528 2.211 1.00 . A A . 1 ALA HB3 1 1 3 1293 1 1 1 ALA N N -22.032 -1.451 2.568 1.00 . A A . 1 ALA N 1 1 3 1294 1 1 1 ALA O O -19.975 -2.150 0.776 1.00 . A A . 1 ALA O 1 1 3 1295 1 1 2 MET C C -16.959 -4.737 2.258 1.00 . A A . 2 MET C 1 1 3 1296 1 1 2 MET CA C -17.790 -3.600 1.674 1.00 . A A . 2 MET CA 1 1 3 1297 1 1 2 MET CB C -17.035 -2.276 1.816 1.00 . A A . 2 MET CB 1 1 3 1298 1 1 2 MET CE C -14.797 -0.329 -1.111 1.00 . A A . 2 MET CE 1 1 3 1299 1 1 2 MET CG C -16.037 -2.023 0.699 1.00 . A A . 2 MET CG 1 1 3 1300 1 1 2 MET H H -19.234 -4.002 3.169 1.00 . A A . 2 MET H 1 1 3 1301 1 1 2 MET HA H -17.961 -3.795 0.626 1.00 . A A . 2 MET HA 1 1 3 1302 1 1 2 MET HB2 H -17.750 -1.467 1.822 1.00 . A A . 2 MET HB2 1 1 3 1303 1 1 2 MET HB3 H -16.500 -2.279 2.754 1.00 . A A . 2 MET HB3 1 1 3 1304 1 1 2 MET HE1 H -14.658 -1.358 -1.406 1.00 . A A . 2 MET HE1 1 1 3 1305 1 1 2 MET HE2 H -15.315 0.204 -1.895 1.00 . A A . 2 MET HE2 1 1 3 1306 1 1 2 MET HE3 H -13.835 0.130 -0.938 1.00 . A A . 2 MET HE3 1 1 3 1307 1 1 2 MET HG2 H -15.094 -2.475 0.967 1.00 . A A . 2 MET HG2 1 1 3 1308 1 1 2 MET HG3 H -16.408 -2.479 -0.207 1.00 . A A . 2 MET HG3 1 1 3 1309 1 1 2 MET N N -19.089 -3.514 2.331 1.00 . A A . 2 MET N 1 1 3 1310 1 1 2 MET O O -16.652 -5.711 1.570 1.00 . A A . 2 MET O 1 1 3 1311 1 1 2 MET SD S -15.767 -0.266 0.394 1.00 . A A . 2 MET SD 1 1 3 1312 1 1 3 ASP C C -14.422 -5.752 3.571 1.00 . A A . 3 ASP C 1 1 3 1313 1 1 3 ASP CA C -15.801 -5.624 4.209 1.00 . A A . 3 ASP CA 1 1 3 1314 1 1 3 ASP CB C -16.520 -6.975 4.174 1.00 . A A . 3 ASP CB 1 1 3 1315 1 1 3 ASP CG C -16.072 -7.897 5.291 1.00 . A A . 3 ASP CG 1 1 3 1316 1 1 3 ASP H H -16.873 -3.808 4.026 1.00 . A A . 3 ASP H 1 1 3 1317 1 1 3 ASP HA H -15.681 -5.318 5.238 1.00 . A A . 3 ASP HA 1 1 3 1318 1 1 3 ASP HB2 H -17.583 -6.813 4.271 1.00 . A A . 3 ASP HB2 1 1 3 1319 1 1 3 ASP HB3 H -16.318 -7.458 3.229 1.00 . A A . 3 ASP HB3 1 1 3 1320 1 1 3 ASP N N -16.598 -4.607 3.531 1.00 . A A . 3 ASP N 1 1 3 1321 1 1 3 ASP O O -14.295 -5.797 2.348 1.00 . A A . 3 ASP O 1 1 3 1322 1 1 3 ASP OD1 O -16.809 -8.018 6.292 1.00 . A A . 3 ASP OD1 1 1 3 1323 1 1 3 ASP OD2 O -14.985 -8.499 5.164 1.00 . A A . 3 ASP OD2 1 1 3 1324 1 1 4 CYS C C -11.628 -4.733 3.073 1.00 . A A . 4 CYS C 1 1 3 1325 1 1 4 CYS CA C -12.019 -5.932 3.930 1.00 . A A . 4 CYS CA 1 1 3 1326 1 1 4 CYS CB C -11.846 -7.220 3.124 1.00 . A A . 4 CYS CB 1 1 3 1327 1 1 4 CYS H H -13.558 -5.768 5.374 1.00 . A A . 4 CYS H 1 1 3 1328 1 1 4 CYS HA H -11.369 -5.969 4.791 1.00 . A A . 4 CYS HA 1 1 3 1329 1 1 4 CYS HB2 H -12.682 -7.328 2.449 1.00 . A A . 4 CYS HB2 1 1 3 1330 1 1 4 CYS HB3 H -10.934 -7.154 2.551 1.00 . A A . 4 CYS HB3 1 1 3 1331 1 1 4 CYS N N -13.391 -5.809 4.409 1.00 . A A . 4 CYS N 1 1 3 1332 1 1 4 CYS O O -12.221 -4.487 2.023 1.00 . A A . 4 CYS O 1 1 3 1333 1 1 4 CYS SG S -11.758 -8.731 4.140 1.00 . A A . 4 CYS SG 1 1 3 1334 1 1 5 THR C C -9.714 -3.206 1.384 1.00 . A A . 5 THR C 1 1 3 1335 1 1 5 THR CA C -10.141 -2.824 2.798 1.00 . A A . 5 THR CA 1 1 3 1336 1 1 5 THR CB C -8.969 -2.190 3.546 1.00 . A A . 5 THR CB 1 1 3 1337 1 1 5 THR CG2 C -8.566 -0.840 2.995 1.00 . A A . 5 THR CG2 1 1 3 1338 1 1 5 THR H H -10.185 -4.245 4.366 1.00 . A A . 5 THR H 1 1 3 1339 1 1 5 THR HA H -10.949 -2.111 2.740 1.00 . A A . 5 THR HA 1 1 3 1340 1 1 5 THR HB H -8.115 -2.847 3.473 1.00 . A A . 5 THR HB 1 1 3 1341 1 1 5 THR HG1 H -10.090 -1.505 4.998 1.00 . A A . 5 THR HG1 1 1 3 1342 1 1 5 THR HG21 H -9.438 -0.208 2.915 1.00 . A A . 5 THR HG21 1 1 3 1343 1 1 5 THR HG22 H -7.848 -0.380 3.658 1.00 . A A . 5 THR HG22 1 1 3 1344 1 1 5 THR HG23 H -8.123 -0.967 2.018 1.00 . A A . 5 THR HG23 1 1 3 1345 1 1 5 THR N N -10.621 -3.994 3.525 1.00 . A A . 5 THR N 1 1 3 1346 1 1 5 THR O O -9.543 -4.386 1.076 1.00 . A A . 5 THR O 1 1 3 1347 1 1 5 THR OG1 O -9.283 -2.018 4.916 1.00 . A A . 5 THR OG1 1 1 3 1348 1 1 6 THR C C -8.216 -1.333 -1.354 1.00 . A A . 6 THR C 1 1 3 1349 1 1 6 THR CA C -9.130 -2.447 -0.852 1.00 . A A . 6 THR CA 1 1 3 1350 1 1 6 THR CB C -10.357 -2.567 -1.758 1.00 . A A . 6 THR CB 1 1 3 1351 1 1 6 THR CG2 C -10.782 -3.999 -2.001 1.00 . A A . 6 THR CG2 1 1 3 1352 1 1 6 THR H H -9.690 -1.285 0.828 1.00 . A A . 6 THR H 1 1 3 1353 1 1 6 THR HA H -8.586 -3.379 -0.875 1.00 . A A . 6 THR HA 1 1 3 1354 1 1 6 THR HB H -10.131 -2.122 -2.716 1.00 . A A . 6 THR HB 1 1 3 1355 1 1 6 THR HG1 H -11.201 -0.985 -0.969 1.00 . A A . 6 THR HG1 1 1 3 1356 1 1 6 THR HG21 H -9.995 -4.667 -1.683 1.00 . A A . 6 THR HG21 1 1 3 1357 1 1 6 THR HG22 H -11.681 -4.208 -1.439 1.00 . A A . 6 THR HG22 1 1 3 1358 1 1 6 THR HG23 H -10.974 -4.144 -3.054 1.00 . A A . 6 THR HG23 1 1 3 1359 1 1 6 THR N N -9.540 -2.205 0.527 1.00 . A A . 6 THR N 1 1 3 1360 1 1 6 THR O O -8.471 -0.152 -1.117 1.00 . A A . 6 THR O 1 1 3 1361 1 1 6 THR OG1 O -11.463 -1.879 -1.198 1.00 . A A . 6 THR OG1 1 1 3 1362 1 1 7 GLY C C -4.922 -1.380 -3.056 1.00 . A A . 7 GLY C 1 1 3 1363 1 1 7 GLY CA C -6.213 -0.743 -2.574 1.00 . A A . 7 GLY CA 1 1 3 1364 1 1 7 GLY H H -6.999 -2.674 -2.206 1.00 . A A . 7 GLY H 1 1 3 1365 1 1 7 GLY HA2 H -5.981 -0.029 -1.798 1.00 . A A . 7 GLY HA2 1 1 3 1366 1 1 7 GLY HA3 H -6.676 -0.224 -3.400 1.00 . A A . 7 GLY HA3 1 1 3 1367 1 1 7 GLY N N -7.150 -1.719 -2.049 1.00 . A A . 7 GLY N 1 1 3 1368 1 1 7 GLY O O -4.680 -2.561 -2.807 1.00 . A A . 7 GLY O 1 1 3 1369 1 1 8 PRO C C -1.909 -1.703 -3.165 1.00 . A A . 8 PRO C 1 1 3 1370 1 1 8 PRO CA C -2.788 -1.123 -4.270 1.00 . A A . 8 PRO CA 1 1 3 1371 1 1 8 PRO CB C -2.123 0.113 -4.897 1.00 . A A . 8 PRO CB 1 1 3 1372 1 1 8 PRO CD C -4.269 0.800 -4.098 1.00 . A A . 8 PRO CD 1 1 3 1373 1 1 8 PRO CG C -2.873 1.284 -4.358 1.00 . A A . 8 PRO CG 1 1 3 1374 1 1 8 PRO HA H -2.944 -1.874 -5.030 1.00 . A A . 8 PRO HA 1 1 3 1375 1 1 8 PRO HB2 H -1.082 0.147 -4.611 1.00 . A A . 8 PRO HB2 1 1 3 1376 1 1 8 PRO HB3 H -2.203 0.058 -5.973 1.00 . A A . 8 PRO HB3 1 1 3 1377 1 1 8 PRO HD2 H -4.710 1.339 -3.272 1.00 . A A . 8 PRO HD2 1 1 3 1378 1 1 8 PRO HD3 H -4.876 0.898 -4.985 1.00 . A A . 8 PRO HD3 1 1 3 1379 1 1 8 PRO HG2 H -2.417 1.621 -3.439 1.00 . A A . 8 PRO HG2 1 1 3 1380 1 1 8 PRO HG3 H -2.883 2.081 -5.086 1.00 . A A . 8 PRO HG3 1 1 3 1381 1 1 8 PRO N N -4.065 -0.615 -3.755 1.00 . A A . 8 PRO N 1 1 3 1382 1 1 8 PRO O O -1.089 -2.588 -3.412 1.00 . A A . 8 PRO O 1 1 3 1383 1 1 9 CYS C C -1.983 -2.894 -0.166 1.00 . A A . 9 CYS C 1 1 3 1384 1 1 9 CYS CA C -1.313 -1.679 -0.802 1.00 . A A . 9 CYS CA 1 1 3 1385 1 1 9 CYS CB C -1.154 -0.559 0.233 1.00 . A A . 9 CYS CB 1 1 3 1386 1 1 9 CYS H H -2.758 -0.503 -1.810 1.00 . A A . 9 CYS H 1 1 3 1387 1 1 9 CYS HA H -0.337 -1.968 -1.160 1.00 . A A . 9 CYS HA 1 1 3 1388 1 1 9 CYS HB2 H -0.485 0.190 -0.160 1.00 . A A . 9 CYS HB2 1 1 3 1389 1 1 9 CYS HB3 H -2.119 -0.110 0.415 1.00 . A A . 9 CYS HB3 1 1 3 1390 1 1 9 CYS N N -2.087 -1.204 -1.945 1.00 . A A . 9 CYS N 1 1 3 1391 1 1 9 CYS O O -1.316 -3.745 0.423 1.00 . A A . 9 CYS O 1 1 3 1392 1 1 9 CYS SG S -0.484 -1.102 1.842 1.00 . A A . 9 CYS SG 1 1 3 1393 1 1 10 CYS C C -3.566 -5.413 -0.256 1.00 . A A . 10 CYS C 1 1 3 1394 1 1 10 CYS CA C -4.066 -4.074 0.277 1.00 . A A . 10 CYS CA 1 1 3 1395 1 1 10 CYS CB C -5.553 -3.906 -0.042 1.00 . A A . 10 CYS CB 1 1 3 1396 1 1 10 CYS H H -3.779 -2.256 -0.766 1.00 . A A . 10 CYS H 1 1 3 1397 1 1 10 CYS HA H -3.934 -4.056 1.348 1.00 . A A . 10 CYS HA 1 1 3 1398 1 1 10 CYS HB2 H -5.683 -3.030 -0.659 1.00 . A A . 10 CYS HB2 1 1 3 1399 1 1 10 CYS HB3 H -5.899 -4.774 -0.583 1.00 . A A . 10 CYS HB3 1 1 3 1400 1 1 10 CYS N N -3.304 -2.966 -0.287 1.00 . A A . 10 CYS N 1 1 3 1401 1 1 10 CYS O O -3.193 -5.528 -1.424 1.00 . A A . 10 CYS O 1 1 3 1402 1 1 10 CYS SG S -6.610 -3.709 1.428 1.00 . A A . 10 CYS SG 1 1 3 1403 1 1 11 ARG C C -4.308 -8.644 -0.128 1.00 . A A . 11 ARG C 1 1 3 1404 1 1 11 ARG CA C -3.119 -7.756 0.224 1.00 . A A . 11 ARG CA 1 1 3 1405 1 1 11 ARG CB C -2.304 -8.388 1.357 1.00 . A A . 11 ARG CB 1 1 3 1406 1 1 11 ARG CD C -0.658 -10.022 0.389 1.00 . A A . 11 ARG CD 1 1 3 1407 1 1 11 ARG CG C -0.850 -8.640 0.992 1.00 . A A . 11 ARG CG 1 1 3 1408 1 1 11 ARG CZ C 1.094 -10.905 1.881 1.00 . A A . 11 ARG CZ 1 1 3 1409 1 1 11 ARG H H -3.880 -6.269 1.523 1.00 . A A . 11 ARG H 1 1 3 1410 1 1 11 ARG HA H -2.489 -7.656 -0.647 1.00 . A A . 11 ARG HA 1 1 3 1411 1 1 11 ARG HB2 H -2.329 -7.730 2.213 1.00 . A A . 11 ARG HB2 1 1 3 1412 1 1 11 ARG HB3 H -2.753 -9.333 1.627 1.00 . A A . 11 ARG HB3 1 1 3 1413 1 1 11 ARG HD2 H -1.399 -10.688 0.805 1.00 . A A . 11 ARG HD2 1 1 3 1414 1 1 11 ARG HD3 H -0.794 -9.956 -0.680 1.00 . A A . 11 ARG HD3 1 1 3 1415 1 1 11 ARG HE H 1.282 -10.671 -0.092 1.00 . A A . 11 ARG HE 1 1 3 1416 1 1 11 ARG HG2 H -0.536 -7.898 0.273 1.00 . A A . 11 ARG HG2 1 1 3 1417 1 1 11 ARG HG3 H -0.246 -8.558 1.884 1.00 . A A . 11 ARG HG3 1 1 3 1418 1 1 11 ARG HH11 H -0.630 -10.406 2.815 1.00 . A A . 11 ARG HH11 1 1 3 1419 1 1 11 ARG HH12 H 0.618 -11.029 3.842 1.00 . A A . 11 ARG HH12 1 1 3 1420 1 1 11 ARG HH21 H 2.924 -11.492 1.257 1.00 . A A . 11 ARG HH21 1 1 3 1421 1 1 11 ARG HH22 H 2.635 -11.645 2.958 1.00 . A A . 11 ARG HH22 1 1 3 1422 1 1 11 ARG N N -3.567 -6.423 0.607 1.00 . A A . 11 ARG N 1 1 3 1423 1 1 11 ARG NE N 0.672 -10.560 0.666 1.00 . A A . 11 ARG NE 1 1 3 1424 1 1 11 ARG NH1 N 0.295 -10.769 2.932 1.00 . A A . 11 ARG NH1 1 1 3 1425 1 1 11 ARG NH2 N 2.318 -11.387 2.045 1.00 . A A . 11 ARG NH2 1 1 3 1426 1 1 11 ARG O O -4.604 -8.864 -1.303 1.00 . A A . 11 ARG O 1 1 3 1427 1 1 12 GLN C C -7.344 -9.562 1.526 1.00 . A A . 12 GLN C 1 1 3 1428 1 1 12 GLN CA C -6.145 -10.016 0.691 1.00 . A A . 12 GLN CA 1 1 3 1429 1 1 12 GLN CB C -5.791 -11.464 1.036 1.00 . A A . 12 GLN CB 1 1 3 1430 1 1 12 GLN CD C -5.021 -13.687 0.118 1.00 . A A . 12 GLN CD 1 1 3 1431 1 1 12 GLN CG C -5.029 -12.182 -0.065 1.00 . A A . 12 GLN CG 1 1 3 1432 1 1 12 GLN H H -4.702 -8.942 1.809 1.00 . A A . 12 GLN H 1 1 3 1433 1 1 12 GLN HA H -6.414 -9.963 -0.354 1.00 . A A . 12 GLN HA 1 1 3 1434 1 1 12 GLN HB2 H -5.184 -11.471 1.928 1.00 . A A . 12 GLN HB2 1 1 3 1435 1 1 12 GLN HB3 H -6.703 -12.009 1.227 1.00 . A A . 12 GLN HB3 1 1 3 1436 1 1 12 GLN HE21 H -5.068 -13.953 -1.852 1.00 . A A . 12 GLN HE21 1 1 3 1437 1 1 12 GLN HE22 H -5.042 -15.395 -0.901 1.00 . A A . 12 GLN HE22 1 1 3 1438 1 1 12 GLN HG2 H -5.491 -11.954 -1.014 1.00 . A A . 12 GLN HG2 1 1 3 1439 1 1 12 GLN HG3 H -4.008 -11.829 -0.068 1.00 . A A . 12 GLN HG3 1 1 3 1440 1 1 12 GLN N N -4.987 -9.152 0.896 1.00 . A A . 12 GLN N 1 1 3 1441 1 1 12 GLN NE2 N -5.046 -14.419 -0.990 1.00 . A A . 12 GLN NE2 1 1 3 1442 1 1 12 GLN O O -8.411 -10.171 1.467 1.00 . A A . 12 GLN O 1 1 3 1443 1 1 12 GLN OE1 O -4.992 -14.187 1.243 1.00 . A A . 12 GLN OE1 1 1 3 1444 1 1 13 CYS C C -7.789 -6.740 3.916 1.00 . A A . 13 CYS C 1 1 3 1445 1 1 13 CYS CA C -8.244 -7.971 3.138 1.00 . A A . 13 CYS CA 1 1 3 1446 1 1 13 CYS CB C -8.737 -9.047 4.110 1.00 . A A . 13 CYS CB 1 1 3 1447 1 1 13 CYS H H -6.300 -8.041 2.310 1.00 . A A . 13 CYS H 1 1 3 1448 1 1 13 CYS HA H -9.058 -7.689 2.488 1.00 . A A . 13 CYS HA 1 1 3 1449 1 1 13 CYS HB2 H -9.118 -9.885 3.546 1.00 . A A . 13 CYS HB2 1 1 3 1450 1 1 13 CYS HB3 H -7.909 -9.377 4.719 1.00 . A A . 13 CYS HB3 1 1 3 1451 1 1 13 CYS N N -7.168 -8.492 2.302 1.00 . A A . 13 CYS N 1 1 3 1452 1 1 13 CYS O O -8.562 -5.803 4.118 1.00 . A A . 13 CYS O 1 1 3 1453 1 1 13 CYS SG S -10.062 -8.488 5.230 1.00 . A A . 13 CYS SG 1 1 3 1454 1 1 14 LYS C C -4.700 -5.121 4.475 1.00 . A A . 14 LYS C 1 1 3 1455 1 1 14 LYS CA C -5.988 -5.627 5.112 1.00 . A A . 14 LYS CA 1 1 3 1456 1 1 14 LYS CB C -5.726 -6.042 6.561 1.00 . A A . 14 LYS CB 1 1 3 1457 1 1 14 LYS CD C -4.269 -7.340 8.144 1.00 . A A . 14 LYS CD 1 1 3 1458 1 1 14 LYS CE C -5.026 -8.476 8.812 1.00 . A A . 14 LYS CE 1 1 3 1459 1 1 14 LYS CG C -4.701 -7.156 6.698 1.00 . A A . 14 LYS CG 1 1 3 1460 1 1 14 LYS H H -5.960 -7.519 4.166 1.00 . A A . 14 LYS H 1 1 3 1461 1 1 14 LYS HA H -6.718 -4.831 5.101 1.00 . A A . 14 LYS HA 1 1 3 1462 1 1 14 LYS HB2 H -5.369 -5.184 7.110 1.00 . A A . 14 LYS HB2 1 1 3 1463 1 1 14 LYS HB3 H -6.654 -6.380 6.999 1.00 . A A . 14 LYS HB3 1 1 3 1464 1 1 14 LYS HD2 H -3.212 -7.561 8.168 1.00 . A A . 14 LYS HD2 1 1 3 1465 1 1 14 LYS HD3 H -4.459 -6.424 8.685 1.00 . A A . 14 LYS HD3 1 1 3 1466 1 1 14 LYS HE2 H -5.115 -8.261 9.866 1.00 . A A . 14 LYS HE2 1 1 3 1467 1 1 14 LYS HE3 H -6.011 -8.541 8.374 1.00 . A A . 14 LYS HE3 1 1 3 1468 1 1 14 LYS HG2 H -5.136 -8.079 6.344 1.00 . A A . 14 LYS HG2 1 1 3 1469 1 1 14 LYS HG3 H -3.835 -6.911 6.101 1.00 . A A . 14 LYS HG3 1 1 3 1470 1 1 14 LYS HZ1 H -3.744 -9.765 7.783 1.00 . A A . 14 LYS HZ1 1 1 3 1471 1 1 14 LYS HZ2 H -3.722 -9.973 9.462 1.00 . A A . 14 LYS HZ2 1 1 3 1472 1 1 14 LYS HZ3 H -5.028 -10.549 8.555 1.00 . A A . 14 LYS HZ3 1 1 3 1473 1 1 14 LYS N N -6.533 -6.746 4.355 1.00 . A A . 14 LYS N 1 1 3 1474 1 1 14 LYS NZ N -4.332 -9.782 8.641 1.00 . A A . 14 LYS NZ 1 1 3 1475 1 1 14 LYS O O -3.965 -5.884 3.848 1.00 . A A . 14 LYS O 1 1 3 1476 1 1 15 LEU C C -1.996 -4.062 4.377 1.00 . A A . 15 LEU C 1 1 3 1477 1 1 15 LEU CA C -3.231 -3.221 4.075 1.00 . A A . 15 LEU CA 1 1 3 1478 1 1 15 LEU CB C -3.037 -1.787 4.596 1.00 . A A . 15 LEU CB 1 1 3 1479 1 1 15 LEU CD1 C -4.841 -1.255 6.273 1.00 . A A . 15 LEU CD1 1 1 3 1480 1 1 15 LEU CD2 C -2.917 -2.711 6.947 1.00 . A A . 15 LEU CD2 1 1 3 1481 1 1 15 LEU CG C -3.359 -1.539 6.080 1.00 . A A . 15 LEU CG 1 1 3 1482 1 1 15 LEU H H -5.059 -3.275 5.144 1.00 . A A . 15 LEU H 1 1 3 1483 1 1 15 LEU HA H -3.360 -3.183 3.004 1.00 . A A . 15 LEU HA 1 1 3 1484 1 1 15 LEU HB2 H -2.007 -1.509 4.429 1.00 . A A . 15 LEU HB2 1 1 3 1485 1 1 15 LEU HB3 H -3.662 -1.134 4.006 1.00 . A A . 15 LEU HB3 1 1 3 1486 1 1 15 LEU HD11 H -5.298 -1.057 5.315 1.00 . A A . 15 LEU HD11 1 1 3 1487 1 1 15 LEU HD12 H -5.316 -2.112 6.729 1.00 . A A . 15 LEU HD12 1 1 3 1488 1 1 15 LEU HD13 H -4.961 -0.395 6.914 1.00 . A A . 15 LEU HD13 1 1 3 1489 1 1 15 LEU HD21 H -1.862 -2.888 6.801 1.00 . A A . 15 LEU HD21 1 1 3 1490 1 1 15 LEU HD22 H -3.103 -2.479 7.985 1.00 . A A . 15 LEU HD22 1 1 3 1491 1 1 15 LEU HD23 H -3.472 -3.595 6.672 1.00 . A A . 15 LEU HD23 1 1 3 1492 1 1 15 LEU HG H -2.815 -0.664 6.408 1.00 . A A . 15 LEU HG 1 1 3 1493 1 1 15 LEU N N -4.433 -3.829 4.638 1.00 . A A . 15 LEU N 1 1 3 1494 1 1 15 LEU O O -1.873 -4.646 5.454 1.00 . A A . 15 LEU O 1 1 3 1495 1 1 16 LYS C C 0.952 -4.374 4.758 1.00 . A A . 16 LYS C 1 1 3 1496 1 1 16 LYS CA C 0.137 -4.902 3.579 1.00 . A A . 16 LYS CA 1 1 3 1497 1 1 16 LYS CB C 0.974 -4.854 2.299 1.00 . A A . 16 LYS CB 1 1 3 1498 1 1 16 LYS CD C 1.537 -5.899 0.084 1.00 . A A . 16 LYS CD 1 1 3 1499 1 1 16 LYS CE C 0.745 -6.295 -1.151 1.00 . A A . 16 LYS CE 1 1 3 1500 1 1 16 LYS CG C 0.693 -6.003 1.344 1.00 . A A . 16 LYS CG 1 1 3 1501 1 1 16 LYS H H -1.240 -3.648 2.574 1.00 . A A . 16 LYS H 1 1 3 1502 1 1 16 LYS HA H -0.146 -5.926 3.778 1.00 . A A . 16 LYS HA 1 1 3 1503 1 1 16 LYS HB2 H 0.769 -3.928 1.783 1.00 . A A . 16 LYS HB2 1 1 3 1504 1 1 16 LYS HB3 H 2.020 -4.883 2.565 1.00 . A A . 16 LYS HB3 1 1 3 1505 1 1 16 LYS HD2 H 1.874 -4.879 -0.029 1.00 . A A . 16 LYS HD2 1 1 3 1506 1 1 16 LYS HD3 H 2.391 -6.554 0.179 1.00 . A A . 16 LYS HD3 1 1 3 1507 1 1 16 LYS HE2 H 0.794 -7.368 -1.266 1.00 . A A . 16 LYS HE2 1 1 3 1508 1 1 16 LYS HE3 H -0.284 -5.995 -1.015 1.00 . A A . 16 LYS HE3 1 1 3 1509 1 1 16 LYS HG2 H 0.920 -6.934 1.841 1.00 . A A . 16 LYS HG2 1 1 3 1510 1 1 16 LYS HG3 H -0.351 -5.983 1.070 1.00 . A A . 16 LYS HG3 1 1 3 1511 1 1 16 LYS HZ1 H 1.330 -4.621 -2.256 1.00 . A A . 16 LYS HZ1 1 1 3 1512 1 1 16 LYS HZ2 H 2.232 -6.012 -2.590 1.00 . A A . 16 LYS HZ2 1 1 3 1513 1 1 16 LYS HZ3 H 0.659 -5.860 -3.193 1.00 . A A . 16 LYS HZ3 1 1 3 1514 1 1 16 LYS N N -1.085 -4.128 3.414 1.00 . A A . 16 LYS N 1 1 3 1515 1 1 16 LYS NZ N 1.279 -5.652 -2.384 1.00 . A A . 16 LYS NZ 1 1 3 1516 1 1 16 LYS O O 0.721 -3.262 5.232 1.00 . A A . 16 LYS O 1 1 3 1517 1 1 17 PRO C C 3.572 -3.508 6.079 1.00 . A A . 17 PRO C 1 1 3 1518 1 1 17 PRO CA C 2.767 -4.768 6.377 1.00 . A A . 17 PRO CA 1 1 3 1519 1 1 17 PRO CB C 3.705 -5.965 6.573 1.00 . A A . 17 PRO CB 1 1 3 1520 1 1 17 PRO CD C 2.265 -6.505 4.745 1.00 . A A . 17 PRO CD 1 1 3 1521 1 1 17 PRO CG C 3.647 -6.722 5.290 1.00 . A A . 17 PRO CG 1 1 3 1522 1 1 17 PRO HA H 2.183 -4.615 7.273 1.00 . A A . 17 PRO HA 1 1 3 1523 1 1 17 PRO HB2 H 4.705 -5.611 6.776 1.00 . A A . 17 PRO HB2 1 1 3 1524 1 1 17 PRO HB3 H 3.357 -6.566 7.400 1.00 . A A . 17 PRO HB3 1 1 3 1525 1 1 17 PRO HD2 H 2.277 -6.522 3.665 1.00 . A A . 17 PRO HD2 1 1 3 1526 1 1 17 PRO HD3 H 1.585 -7.250 5.131 1.00 . A A . 17 PRO HD3 1 1 3 1527 1 1 17 PRO HG2 H 4.386 -6.337 4.602 1.00 . A A . 17 PRO HG2 1 1 3 1528 1 1 17 PRO HG3 H 3.816 -7.772 5.475 1.00 . A A . 17 PRO HG3 1 1 3 1529 1 1 17 PRO N N 1.919 -5.166 5.248 1.00 . A A . 17 PRO N 1 1 3 1530 1 1 17 PRO O O 4.230 -3.411 5.043 1.00 . A A . 17 PRO O 1 1 3 1531 1 1 18 ALA C C 5.687 -1.538 6.399 1.00 . A A . 18 ALA C 1 1 3 1532 1 1 18 ALA CA C 4.246 -1.288 6.834 1.00 . A A . 18 ALA CA 1 1 3 1533 1 1 18 ALA CB C 4.216 -0.490 8.129 1.00 . A A . 18 ALA CB 1 1 3 1534 1 1 18 ALA H H 2.977 -2.679 7.801 1.00 . A A . 18 ALA H 1 1 3 1535 1 1 18 ALA HA H 3.745 -0.710 6.071 1.00 . A A . 18 ALA HA 1 1 3 1536 1 1 18 ALA HB1 H 5.044 -0.788 8.755 1.00 . A A . 18 ALA HB1 1 1 3 1537 1 1 18 ALA HB2 H 4.294 0.564 7.905 1.00 . A A . 18 ALA HB2 1 1 3 1538 1 1 18 ALA HB3 H 3.287 -0.680 8.647 1.00 . A A . 18 ALA HB3 1 1 3 1539 1 1 18 ALA N N 3.519 -2.543 6.996 1.00 . A A . 18 ALA N 1 1 3 1540 1 1 18 ALA O O 6.251 -2.598 6.670 1.00 . A A . 18 ALA O 1 1 3 1541 1 1 19 GLY C C 7.749 -1.677 4.087 1.00 . A A . 19 GLY C 1 1 3 1542 1 1 19 GLY CA C 7.639 -0.706 5.248 1.00 . A A . 19 GLY CA 1 1 3 1543 1 1 19 GLY H H 5.775 0.259 5.521 1.00 . A A . 19 GLY H 1 1 3 1544 1 1 19 GLY HA2 H 8.252 -1.064 6.062 1.00 . A A . 19 GLY HA2 1 1 3 1545 1 1 19 GLY HA3 H 8.004 0.260 4.932 1.00 . A A . 19 GLY HA3 1 1 3 1546 1 1 19 GLY N N 6.274 -0.562 5.715 1.00 . A A . 19 GLY N 1 1 3 1547 1 1 19 GLY O O 8.838 -2.158 3.772 1.00 . A A . 19 GLY O 1 1 3 1548 1 1 20 THR C C 6.041 -2.186 1.074 1.00 . A A . 20 THR C 1 1 3 1549 1 1 20 THR CA C 6.586 -2.883 2.317 1.00 . A A . 20 THR CA 1 1 3 1550 1 1 20 THR CB C 5.728 -4.105 2.652 1.00 . A A . 20 THR CB 1 1 3 1551 1 1 20 THR CG2 C 5.631 -5.104 1.519 1.00 . A A . 20 THR CG2 1 1 3 1552 1 1 20 THR H H 5.781 -1.549 3.747 1.00 . A A . 20 THR H 1 1 3 1553 1 1 20 THR HA H 7.598 -3.205 2.121 1.00 . A A . 20 THR HA 1 1 3 1554 1 1 20 THR HB H 4.727 -3.774 2.887 1.00 . A A . 20 THR HB 1 1 3 1555 1 1 20 THR HG1 H 7.192 -4.912 3.672 1.00 . A A . 20 THR HG1 1 1 3 1556 1 1 20 THR HG21 H 5.905 -4.625 0.591 1.00 . A A . 20 THR HG21 1 1 3 1557 1 1 20 THR HG22 H 6.301 -5.930 1.709 1.00 . A A . 20 THR HG22 1 1 3 1558 1 1 20 THR HG23 H 4.617 -5.471 1.450 1.00 . A A . 20 THR HG23 1 1 3 1559 1 1 20 THR N N 6.617 -1.965 3.449 1.00 . A A . 20 THR N 1 1 3 1560 1 1 20 THR O O 4.904 -1.713 1.065 1.00 . A A . 20 THR O 1 1 3 1561 1 1 20 THR OG1 O 6.247 -4.786 3.781 1.00 . A A . 20 THR OG1 1 1 3 1562 1 1 21 THR C C 5.189 -2.132 -1.777 1.00 . A A . 21 THR C 1 1 3 1563 1 1 21 THR CA C 6.453 -1.487 -1.222 1.00 . A A . 21 THR CA 1 1 3 1564 1 1 21 THR CB C 7.581 -1.563 -2.254 1.00 . A A . 21 THR CB 1 1 3 1565 1 1 21 THR CG2 C 8.079 -0.202 -2.687 1.00 . A A . 21 THR CG2 1 1 3 1566 1 1 21 THR H H 7.752 -2.521 0.093 1.00 . A A . 21 THR H 1 1 3 1567 1 1 21 THR HA H 6.245 -0.449 -1.008 1.00 . A A . 21 THR HA 1 1 3 1568 1 1 21 THR HB H 7.221 -2.078 -3.133 1.00 . A A . 21 THR HB 1 1 3 1569 1 1 21 THR HG1 H 8.774 -3.116 -2.207 1.00 . A A . 21 THR HG1 1 1 3 1570 1 1 21 THR HG21 H 7.721 0.547 -1.996 1.00 . A A . 21 THR HG21 1 1 3 1571 1 1 21 THR HG22 H 9.159 -0.199 -2.694 1.00 . A A . 21 THR HG22 1 1 3 1572 1 1 21 THR HG23 H 7.711 0.017 -3.678 1.00 . A A . 21 THR HG23 1 1 3 1573 1 1 21 THR N N 6.857 -2.126 0.026 1.00 . A A . 21 THR N 1 1 3 1574 1 1 21 THR O O 5.073 -3.357 -1.821 1.00 . A A . 21 THR O 1 1 3 1575 1 1 21 THR OG1 O 8.689 -2.282 -1.740 1.00 . A A . 21 THR OG1 1 1 3 1576 1 1 22 CYS C C 2.913 -1.578 -4.249 1.00 . A A . 22 CYS C 1 1 3 1577 1 1 22 CYS CA C 2.983 -1.792 -2.742 1.00 . A A . 22 CYS CA 1 1 3 1578 1 1 22 CYS CB C 1.802 -1.098 -2.065 1.00 . A A . 22 CYS CB 1 1 3 1579 1 1 22 CYS H H 4.390 -0.334 -2.132 1.00 . A A . 22 CYS H 1 1 3 1580 1 1 22 CYS HA H 2.927 -2.850 -2.540 1.00 . A A . 22 CYS HA 1 1 3 1581 1 1 22 CYS HB2 H 0.895 -1.352 -2.593 1.00 . A A . 22 CYS HB2 1 1 3 1582 1 1 22 CYS HB3 H 1.728 -1.444 -1.046 1.00 . A A . 22 CYS HB3 1 1 3 1583 1 1 22 CYS N N 4.241 -1.300 -2.196 1.00 . A A . 22 CYS N 1 1 3 1584 1 1 22 CYS O O 2.369 -2.408 -4.977 1.00 . A A . 22 CYS O 1 1 3 1585 1 1 22 CYS SG S 1.927 0.719 -2.029 1.00 . A A . 22 CYS SG 1 1 3 1586 1 1 23 TRP C C 4.717 -0.612 -6.819 1.00 . A A . 23 TRP C 1 1 3 1587 1 1 23 TRP CA C 3.442 -0.147 -6.137 1.00 . A A . 23 TRP CA 1 1 3 1588 1 1 23 TRP CB C 3.245 1.359 -6.359 1.00 . A A . 23 TRP CB 1 1 3 1589 1 1 23 TRP CD1 C 1.067 0.818 -7.577 1.00 . A A . 23 TRP CD1 1 1 3 1590 1 1 23 TRP CD2 C 1.722 2.941 -7.804 1.00 . A A . 23 TRP CD2 1 1 3 1591 1 1 23 TRP CE2 C 0.518 2.765 -8.510 1.00 . A A . 23 TRP CE2 1 1 3 1592 1 1 23 TRP CE3 C 2.322 4.202 -7.806 1.00 . A A . 23 TRP CE3 1 1 3 1593 1 1 23 TRP CG C 2.054 1.679 -7.211 1.00 . A A . 23 TRP CG 1 1 3 1594 1 1 23 TRP CH2 C 0.513 5.022 -9.193 1.00 . A A . 23 TRP CH2 1 1 3 1595 1 1 23 TRP CZ2 C -0.096 3.799 -9.209 1.00 . A A . 23 TRP CZ2 1 1 3 1596 1 1 23 TRP CZ3 C 1.712 5.229 -8.502 1.00 . A A . 23 TRP CZ3 1 1 3 1597 1 1 23 TRP H H 3.874 0.170 -4.088 1.00 . A A . 23 TRP H 1 1 3 1598 1 1 23 TRP HA H 2.615 -0.675 -6.572 1.00 . A A . 23 TRP HA 1 1 3 1599 1 1 23 TRP HB2 H 3.111 1.843 -5.403 1.00 . A A . 23 TRP HB2 1 1 3 1600 1 1 23 TRP HB3 H 4.122 1.765 -6.843 1.00 . A A . 23 TRP HB3 1 1 3 1601 1 1 23 TRP HD1 H 1.038 -0.218 -7.286 1.00 . A A . 23 TRP HD1 1 1 3 1602 1 1 23 TRP HE1 H -0.662 1.051 -8.741 1.00 . A A . 23 TRP HE1 1 1 3 1603 1 1 23 TRP HE3 H 3.247 4.380 -7.282 1.00 . A A . 23 TRP HE3 1 1 3 1604 1 1 23 TRP HH2 H 0.073 5.852 -9.724 1.00 . A A . 23 TRP HH2 1 1 3 1605 1 1 23 TRP HZ2 H -1.022 3.654 -9.744 1.00 . A A . 23 TRP HZ2 1 1 3 1606 1 1 23 TRP HZ3 H 2.162 6.211 -8.514 1.00 . A A . 23 TRP HZ3 1 1 3 1607 1 1 23 TRP N N 3.458 -0.459 -4.714 1.00 . A A . 23 TRP N 1 1 3 1608 1 1 23 TRP NE1 N 0.140 1.460 -8.358 1.00 . A A . 23 TRP NE1 1 1 3 1609 1 1 23 TRP O O 4.700 -1.542 -7.625 1.00 . A A . 23 TRP O 1 1 3 1610 1 1 24 LYS C C 7.020 -0.329 -8.608 1.00 . A A . 24 LYS C 1 1 3 1611 1 1 24 LYS CA C 7.107 -0.293 -7.083 1.00 . A A . 24 LYS CA 1 1 3 1612 1 1 24 LYS CB C 7.585 -1.643 -6.552 1.00 . A A . 24 LYS CB 1 1 3 1613 1 1 24 LYS CD C 8.962 -3.167 -8.004 1.00 . A A . 24 LYS CD 1 1 3 1614 1 1 24 LYS CE C 10.034 -3.003 -9.070 1.00 . A A . 24 LYS CE 1 1 3 1615 1 1 24 LYS CG C 8.986 -2.018 -7.009 1.00 . A A . 24 LYS CG 1 1 3 1616 1 1 24 LYS H H 5.758 0.776 -5.850 1.00 . A A . 24 LYS H 1 1 3 1617 1 1 24 LYS HA H 7.813 0.467 -6.794 1.00 . A A . 24 LYS HA 1 1 3 1618 1 1 24 LYS HB2 H 7.578 -1.611 -5.472 1.00 . A A . 24 LYS HB2 1 1 3 1619 1 1 24 LYS HB3 H 6.902 -2.410 -6.884 1.00 . A A . 24 LYS HB3 1 1 3 1620 1 1 24 LYS HD2 H 9.133 -4.092 -7.475 1.00 . A A . 24 LYS HD2 1 1 3 1621 1 1 24 LYS HD3 H 7.994 -3.196 -8.482 1.00 . A A . 24 LYS HD3 1 1 3 1622 1 1 24 LYS HE2 H 9.865 -3.733 -9.847 1.00 . A A . 24 LYS HE2 1 1 3 1623 1 1 24 LYS HE3 H 9.960 -2.010 -9.487 1.00 . A A . 24 LYS HE3 1 1 3 1624 1 1 24 LYS HG2 H 9.443 -1.159 -7.477 1.00 . A A . 24 LYS HG2 1 1 3 1625 1 1 24 LYS HG3 H 9.568 -2.312 -6.147 1.00 . A A . 24 LYS HG3 1 1 3 1626 1 1 24 LYS HZ1 H 11.426 -2.913 -7.514 1.00 . A A . 24 LYS HZ1 1 1 3 1627 1 1 24 LYS HZ2 H 11.681 -4.195 -8.588 1.00 . A A . 24 LYS HZ2 1 1 3 1628 1 1 24 LYS HZ3 H 12.087 -2.616 -9.043 1.00 . A A . 24 LYS HZ3 1 1 3 1629 1 1 24 LYS N N 5.817 0.045 -6.497 1.00 . A A . 24 LYS N 1 1 3 1630 1 1 24 LYS NZ N 11.403 -3.195 -8.515 1.00 . A A . 24 LYS NZ 1 1 3 1631 1 1 24 LYS O O 7.783 -1.035 -9.267 1.00 . A A . 24 LYS O 1 1 3 1632 1 1 25 THR C C 7.164 0.970 -11.303 1.00 . A A . 25 THR C 1 1 3 1633 1 1 25 THR CA C 5.896 0.490 -10.608 1.00 . A A . 25 THR CA 1 1 3 1634 1 1 25 THR CB C 4.717 1.398 -10.968 1.00 . A A . 25 THR CB 1 1 3 1635 1 1 25 THR CG2 C 4.931 2.843 -10.582 1.00 . A A . 25 THR CG2 1 1 3 1636 1 1 25 THR H H 5.503 0.978 -8.586 1.00 . A A . 25 THR H 1 1 3 1637 1 1 25 THR HA H 5.680 -0.510 -10.949 1.00 . A A . 25 THR HA 1 1 3 1638 1 1 25 THR HB H 3.834 1.046 -10.454 1.00 . A A . 25 THR HB 1 1 3 1639 1 1 25 THR HG1 H 3.732 0.765 -12.538 1.00 . A A . 25 THR HG1 1 1 3 1640 1 1 25 THR HG21 H 5.860 2.935 -10.042 1.00 . A A . 25 THR HG21 1 1 3 1641 1 1 25 THR HG22 H 4.969 3.452 -11.473 1.00 . A A . 25 THR HG22 1 1 3 1642 1 1 25 THR HG23 H 4.114 3.171 -9.954 1.00 . A A . 25 THR HG23 1 1 3 1643 1 1 25 THR N N 6.082 0.437 -9.162 1.00 . A A . 25 THR N 1 1 3 1644 1 1 25 THR O O 8.164 1.283 -10.655 1.00 . A A . 25 THR O 1 1 3 1645 1 1 25 THR OG1 O 4.464 1.360 -12.361 1.00 . A A . 25 THR OG1 1 1 3 1646 1 1 26 SER C C 8.635 2.886 -13.195 1.00 . A A . 26 SER C 1 1 3 1647 1 1 26 SER CA C 8.261 1.422 -13.430 1.00 . A A . 26 SER CA 1 1 3 1648 1 1 26 SER CB C 7.969 1.198 -14.915 1.00 . A A . 26 SER CB 1 1 3 1649 1 1 26 SER H H 6.293 0.726 -13.078 1.00 . A A . 26 SER H 1 1 3 1650 1 1 26 SER HA H 9.100 0.804 -13.148 1.00 . A A . 26 SER HA 1 1 3 1651 1 1 26 SER HB2 H 7.021 1.651 -15.165 1.00 . A A . 26 SER HB2 1 1 3 1652 1 1 26 SER HB3 H 8.752 1.650 -15.506 1.00 . A A . 26 SER HB3 1 1 3 1653 1 1 26 SER HG H 8.774 -0.579 -15.100 1.00 . A A . 26 SER HG 1 1 3 1654 1 1 26 SER N N 7.117 1.005 -12.627 1.00 . A A . 26 SER N 1 1 3 1655 1 1 26 SER O O 9.756 3.295 -13.498 1.00 . A A . 26 SER O 1 1 3 1656 1 1 26 SER OG O 7.907 -0.185 -15.219 1.00 . A A . 26 SER OG 1 1 3 1657 1 1 27 VAL C C 7.124 5.658 -11.291 1.00 . A A . 27 VAL C 1 1 3 1658 1 1 27 VAL CA C 7.978 5.094 -12.425 1.00 . A A . 27 VAL CA 1 1 3 1659 1 1 27 VAL CB C 7.736 5.938 -13.693 1.00 . A A . 27 VAL CB 1 1 3 1660 1 1 27 VAL CG1 C 8.242 7.359 -13.492 1.00 . A A . 27 VAL CG1 1 1 3 1661 1 1 27 VAL CG2 C 8.399 5.296 -14.902 1.00 . A A . 27 VAL CG2 1 1 3 1662 1 1 27 VAL H H 6.823 3.313 -12.449 1.00 . A A . 27 VAL H 1 1 3 1663 1 1 27 VAL HA H 9.019 5.187 -12.154 1.00 . A A . 27 VAL HA 1 1 3 1664 1 1 27 VAL HB H 6.672 5.982 -13.873 1.00 . A A . 27 VAL HB 1 1 3 1665 1 1 27 VAL HG11 H 9.081 7.350 -12.813 1.00 . A A . 27 VAL HG11 1 1 3 1666 1 1 27 VAL HG12 H 8.551 7.768 -14.443 1.00 . A A . 27 VAL HG12 1 1 3 1667 1 1 27 VAL HG13 H 7.451 7.967 -13.079 1.00 . A A . 27 VAL HG13 1 1 3 1668 1 1 27 VAL HG21 H 9.451 5.156 -14.704 1.00 . A A . 27 VAL HG21 1 1 3 1669 1 1 27 VAL HG22 H 7.938 4.339 -15.098 1.00 . A A . 27 VAL HG22 1 1 3 1670 1 1 27 VAL HG23 H 8.276 5.937 -15.762 1.00 . A A . 27 VAL HG23 1 1 3 1671 1 1 27 VAL N N 7.704 3.679 -12.669 1.00 . A A . 27 VAL N 1 1 3 1672 1 1 27 VAL O O 6.563 6.748 -11.410 1.00 . A A . 27 VAL O 1 1 3 1673 1 1 28 SER C C 6.141 4.275 -7.981 1.00 . A A . 28 SER C 1 1 3 1674 1 1 28 SER CA C 6.249 5.370 -9.038 1.00 . A A . 28 SER CA 1 1 3 1675 1 1 28 SER CB C 4.850 5.807 -9.479 1.00 . A A . 28 SER CB 1 1 3 1676 1 1 28 SER H H 7.504 4.064 -10.144 1.00 . A A . 28 SER H 1 1 3 1677 1 1 28 SER HA H 6.758 6.218 -8.605 1.00 . A A . 28 SER HA 1 1 3 1678 1 1 28 SER HB2 H 4.584 5.291 -10.390 1.00 . A A . 28 SER HB2 1 1 3 1679 1 1 28 SER HB3 H 4.139 5.561 -8.706 1.00 . A A . 28 SER HB3 1 1 3 1680 1 1 28 SER HG H 4.689 7.666 -8.883 1.00 . A A . 28 SER HG 1 1 3 1681 1 1 28 SER N N 7.032 4.922 -10.188 1.00 . A A . 28 SER N 1 1 3 1682 1 1 28 SER O O 5.191 3.491 -7.978 1.00 . A A . 28 SER O 1 1 3 1683 1 1 28 SER OG O 4.803 7.203 -9.716 1.00 . A A . 28 SER OG 1 1 3 1684 1 1 29 SER C C 6.760 3.856 -4.676 1.00 . A A . 29 SER C 1 1 3 1685 1 1 29 SER CA C 7.126 3.229 -6.018 1.00 . A A . 29 SER CA 1 1 3 1686 1 1 29 SER CB C 8.503 2.572 -5.923 1.00 . A A . 29 SER CB 1 1 3 1687 1 1 29 SER H H 7.845 4.881 -7.130 1.00 . A A . 29 SER H 1 1 3 1688 1 1 29 SER HA H 6.388 2.476 -6.265 1.00 . A A . 29 SER HA 1 1 3 1689 1 1 29 SER HB2 H 8.454 1.735 -5.243 1.00 . A A . 29 SER HB2 1 1 3 1690 1 1 29 SER HB3 H 8.802 2.225 -6.901 1.00 . A A . 29 SER HB3 1 1 3 1691 1 1 29 SER HG H 10.249 3.455 -6.012 1.00 . A A . 29 SER HG 1 1 3 1692 1 1 29 SER N N 7.116 4.228 -7.080 1.00 . A A . 29 SER N 1 1 3 1693 1 1 29 SER O O 7.247 4.931 -4.328 1.00 . A A . 29 SER O 1 1 3 1694 1 1 29 SER OG O 9.474 3.488 -5.447 1.00 . A A . 29 SER OG 1 1 3 1695 1 1 30 HIS C C 5.458 2.539 -1.597 1.00 . A A . 30 HIS C 1 1 3 1696 1 1 30 HIS CA C 5.463 3.664 -2.625 1.00 . A A . 30 HIS CA 1 1 3 1697 1 1 30 HIS CB C 4.066 4.278 -2.726 1.00 . A A . 30 HIS CB 1 1 3 1698 1 1 30 HIS CD2 C 4.143 5.060 -5.193 1.00 . A A . 30 HIS CD2 1 1 3 1699 1 1 30 HIS CE1 C 3.437 7.114 -4.904 1.00 . A A . 30 HIS CE1 1 1 3 1700 1 1 30 HIS CG C 3.912 5.227 -3.871 1.00 . A A . 30 HIS CG 1 1 3 1701 1 1 30 HIS H H 5.544 2.324 -4.261 1.00 . A A . 30 HIS H 1 1 3 1702 1 1 30 HIS HA H 6.159 4.425 -2.306 1.00 . A A . 30 HIS HA 1 1 3 1703 1 1 30 HIS HB2 H 3.341 3.487 -2.851 1.00 . A A . 30 HIS HB2 1 1 3 1704 1 1 30 HIS HB3 H 3.850 4.817 -1.815 1.00 . A A . 30 HIS HB3 1 1 3 1705 1 1 30 HIS HD1 H 3.222 6.950 -2.876 1.00 . A A . 30 HIS HD1 1 1 3 1706 1 1 30 HIS HD2 H 4.501 4.158 -5.673 1.00 . A A . 30 HIS HD2 1 1 3 1707 1 1 30 HIS HE1 H 3.132 8.132 -5.094 1.00 . A A . 30 HIS HE1 1 1 3 1708 1 1 30 HIS HE2 H 3.997 6.451 -6.759 1.00 . A A . 30 HIS HE2 1 1 3 1709 1 1 30 HIS N N 5.897 3.175 -3.928 1.00 . A A . 30 HIS N 1 1 3 1710 1 1 30 HIS ND1 N 3.472 6.525 -3.722 1.00 . A A . 30 HIS ND1 1 1 3 1711 1 1 30 HIS NE2 N 3.840 6.247 -5.813 1.00 . A A . 30 HIS NE2 1 1 3 1712 1 1 30 HIS O O 5.374 1.363 -1.949 1.00 . A A . 30 HIS O 1 1 3 1713 1 1 31 TYR C C 4.255 2.020 1.563 1.00 . A A . 31 TYR C 1 1 3 1714 1 1 31 TYR CA C 5.546 1.935 0.758 1.00 . A A . 31 TYR CA 1 1 3 1715 1 1 31 TYR CB C 6.750 2.161 1.672 1.00 . A A . 31 TYR CB 1 1 3 1716 1 1 31 TYR CD1 C 8.394 0.267 1.404 1.00 . A A . 31 TYR CD1 1 1 3 1717 1 1 31 TYR CD2 C 8.890 2.344 0.347 1.00 . A A . 31 TYR CD2 1 1 3 1718 1 1 31 TYR CE1 C 9.568 -0.270 0.912 1.00 . A A . 31 TYR CE1 1 1 3 1719 1 1 31 TYR CE2 C 10.066 1.815 -0.150 1.00 . A A . 31 TYR CE2 1 1 3 1720 1 1 31 TYR CG C 8.036 1.580 1.131 1.00 . A A . 31 TYR CG 1 1 3 1721 1 1 31 TYR CZ C 10.400 0.508 0.135 1.00 . A A . 31 TYR CZ 1 1 3 1722 1 1 31 TYR H H 5.605 3.864 -0.108 1.00 . A A . 31 TYR H 1 1 3 1723 1 1 31 TYR HA H 5.618 0.951 0.318 1.00 . A A . 31 TYR HA 1 1 3 1724 1 1 31 TYR HB2 H 6.896 3.222 1.808 1.00 . A A . 31 TYR HB2 1 1 3 1725 1 1 31 TYR HB3 H 6.555 1.704 2.632 1.00 . A A . 31 TYR HB3 1 1 3 1726 1 1 31 TYR HD1 H 7.739 -0.340 2.011 1.00 . A A . 31 TYR HD1 1 1 3 1727 1 1 31 TYR HD2 H 8.626 3.368 0.126 1.00 . A A . 31 TYR HD2 1 1 3 1728 1 1 31 TYR HE1 H 9.828 -1.294 1.136 1.00 . A A . 31 TYR HE1 1 1 3 1729 1 1 31 TYR HE2 H 10.717 2.425 -0.759 1.00 . A A . 31 TYR HE2 1 1 3 1730 1 1 31 TYR HH H 12.297 0.578 -0.174 1.00 . A A . 31 TYR HH 1 1 3 1731 1 1 31 TYR N N 5.544 2.910 -0.325 1.00 . A A . 31 TYR N 1 1 3 1732 1 1 31 TYR O O 3.545 3.025 1.510 1.00 . A A . 31 TYR O 1 1 3 1733 1 1 31 TYR OH O 11.570 -0.023 -0.358 1.00 . A A . 31 TYR OH 1 1 3 1734 1 1 32 CYS C C 3.033 1.412 4.535 1.00 . A A . 32 CYS C 1 1 3 1735 1 1 32 CYS CA C 2.748 0.924 3.121 1.00 . A A . 32 CYS CA 1 1 3 1736 1 1 32 CYS CB C 2.180 -0.495 3.163 1.00 . A A . 32 CYS CB 1 1 3 1737 1 1 32 CYS H H 4.556 0.190 2.312 1.00 . A A . 32 CYS H 1 1 3 1738 1 1 32 CYS HA H 2.021 1.579 2.666 1.00 . A A . 32 CYS HA 1 1 3 1739 1 1 32 CYS HB2 H 2.959 -1.178 3.469 1.00 . A A . 32 CYS HB2 1 1 3 1740 1 1 32 CYS HB3 H 1.374 -0.531 3.881 1.00 . A A . 32 CYS HB3 1 1 3 1741 1 1 32 CYS N N 3.954 0.962 2.308 1.00 . A A . 32 CYS N 1 1 3 1742 1 1 32 CYS O O 4.131 1.227 5.058 1.00 . A A . 32 CYS O 1 1 3 1743 1 1 32 CYS SG S 1.527 -1.081 1.566 1.00 . A A . 32 CYS SG 1 1 3 1744 1 1 33 THR C C 1.344 1.704 7.478 1.00 . A A . 33 THR C 1 1 3 1745 1 1 33 THR CA C 2.170 2.541 6.507 1.00 . A A . 33 THR CA 1 1 3 1746 1 1 33 THR CB C 1.729 4.005 6.572 1.00 . A A . 33 THR CB 1 1 3 1747 1 1 33 THR CG2 C 2.245 4.840 5.420 1.00 . A A . 33 THR CG2 1 1 3 1748 1 1 33 THR H H 1.181 2.143 4.680 1.00 . A A . 33 THR H 1 1 3 1749 1 1 33 THR HA H 3.211 2.474 6.785 1.00 . A A . 33 THR HA 1 1 3 1750 1 1 33 THR HB H 2.100 4.441 7.489 1.00 . A A . 33 THR HB 1 1 3 1751 1 1 33 THR HG1 H -0.027 3.809 5.726 1.00 . A A . 33 THR HG1 1 1 3 1752 1 1 33 THR HG21 H 3.317 4.725 5.345 1.00 . A A . 33 THR HG21 1 1 3 1753 1 1 33 THR HG22 H 1.782 4.512 4.501 1.00 . A A . 33 THR HG22 1 1 3 1754 1 1 33 THR HG23 H 2.006 5.879 5.593 1.00 . A A . 33 THR HG23 1 1 3 1755 1 1 33 THR N N 2.033 2.031 5.149 1.00 . A A . 33 THR N 1 1 3 1756 1 1 33 THR O O 1.011 2.156 8.574 1.00 . A A . 33 THR O 1 1 3 1757 1 1 33 THR OG1 O 0.315 4.103 6.574 1.00 . A A . 33 THR OG1 1 1 3 1758 1 1 34 GLY C C -0.984 0.282 8.513 1.00 . A A . 34 GLY C 1 1 3 1759 1 1 34 GLY CA C 0.229 -0.404 7.911 1.00 . A A . 34 GLY CA 1 1 3 1760 1 1 34 GLY H H 1.311 0.174 6.181 1.00 . A A . 34 GLY H 1 1 3 1761 1 1 34 GLY HA2 H 0.856 -0.769 8.712 1.00 . A A . 34 GLY HA2 1 1 3 1762 1 1 34 GLY HA3 H -0.104 -1.244 7.320 1.00 . A A . 34 GLY HA3 1 1 3 1763 1 1 34 GLY N N 1.016 0.480 7.067 1.00 . A A . 34 GLY N 1 1 3 1764 1 1 34 GLY O O -1.402 -0.046 9.624 1.00 . A A . 34 GLY O 1 1 3 1765 1 1 35 ARG C C -3.859 1.903 7.246 1.00 . A A . 35 ARG C 1 1 3 1766 1 1 35 ARG CA C -2.717 1.974 8.255 1.00 . A A . 35 ARG CA 1 1 3 1767 1 1 35 ARG CB C -2.351 3.434 8.525 1.00 . A A . 35 ARG CB 1 1 3 1768 1 1 35 ARG CD C -1.438 5.134 10.138 1.00 . A A . 35 ARG CD 1 1 3 1769 1 1 35 ARG CG C -1.711 3.659 9.886 1.00 . A A . 35 ARG CG 1 1 3 1770 1 1 35 ARG CZ C -3.231 6.455 9.074 1.00 . A A . 35 ARG CZ 1 1 3 1771 1 1 35 ARG H H -1.168 1.458 6.905 1.00 . A A . 35 ARG H 1 1 3 1772 1 1 35 ARG HA H -3.042 1.519 9.176 1.00 . A A . 35 ARG HA 1 1 3 1773 1 1 35 ARG HB2 H -1.658 3.766 7.766 1.00 . A A . 35 ARG HB2 1 1 3 1774 1 1 35 ARG HB3 H -3.247 4.034 8.469 1.00 . A A . 35 ARG HB3 1 1 3 1775 1 1 35 ARG HD2 H -0.943 5.235 11.093 1.00 . A A . 35 ARG HD2 1 1 3 1776 1 1 35 ARG HD3 H -0.792 5.507 9.358 1.00 . A A . 35 ARG HD3 1 1 3 1777 1 1 35 ARG HE H -3.097 6.068 11.028 1.00 . A A . 35 ARG HE 1 1 3 1778 1 1 35 ARG HG2 H -2.378 3.291 10.651 1.00 . A A . 35 ARG HG2 1 1 3 1779 1 1 35 ARG HG3 H -0.778 3.117 9.927 1.00 . A A . 35 ARG HG3 1 1 3 1780 1 1 35 ARG HH11 H -1.841 5.752 7.782 1.00 . A A . 35 ARG HH11 1 1 3 1781 1 1 35 ARG HH12 H -3.113 6.684 7.069 1.00 . A A . 35 ARG HH12 1 1 3 1782 1 1 35 ARG HH21 H -4.767 7.293 10.086 1.00 . A A . 35 ARG HH21 1 1 3 1783 1 1 35 ARG HH22 H -4.772 7.559 8.374 1.00 . A A . 35 ARG HH22 1 1 3 1784 1 1 35 ARG N N -1.548 1.239 7.781 1.00 . A A . 35 ARG N 1 1 3 1785 1 1 35 ARG NE N -2.668 5.924 10.159 1.00 . A A . 35 ARG NE 1 1 3 1786 1 1 35 ARG NH1 N -2.683 6.282 7.877 1.00 . A A . 35 ARG NH1 1 1 3 1787 1 1 35 ARG NH2 N -4.348 7.160 9.187 1.00 . A A . 35 ARG NH2 1 1 3 1788 1 1 35 ARG O O -5.018 1.718 7.618 1.00 . A A . 35 ARG O 1 1 3 1789 1 1 36 SER C C -3.975 1.285 3.681 1.00 . A A . 36 SER C 1 1 3 1790 1 1 36 SER CA C -4.522 2.009 4.907 1.00 . A A . 36 SER CA 1 1 3 1791 1 1 36 SER CB C -4.955 3.426 4.525 1.00 . A A . 36 SER CB 1 1 3 1792 1 1 36 SER H H -2.584 2.200 5.741 1.00 . A A . 36 SER H 1 1 3 1793 1 1 36 SER HA H -5.379 1.468 5.278 1.00 . A A . 36 SER HA 1 1 3 1794 1 1 36 SER HB2 H -4.944 4.053 5.405 1.00 . A A . 36 SER HB2 1 1 3 1795 1 1 36 SER HB3 H -4.270 3.824 3.791 1.00 . A A . 36 SER HB3 1 1 3 1796 1 1 36 SER HG H -6.215 3.591 3.034 1.00 . A A . 36 SER HG 1 1 3 1797 1 1 36 SER N N -3.524 2.054 5.971 1.00 . A A . 36 SER N 1 1 3 1798 1 1 36 SER O O -2.766 1.103 3.545 1.00 . A A . 36 SER O 1 1 3 1799 1 1 36 SER OG O -6.263 3.430 3.980 1.00 . A A . 36 SER OG 1 1 3 1800 1 1 37 CYS C C -4.263 1.138 0.417 1.00 . A A . 37 CYS C 1 1 3 1801 1 1 37 CYS CA C -4.474 0.168 1.578 1.00 . A A . 37 CYS CA 1 1 3 1802 1 1 37 CYS CB C -5.525 -0.878 1.202 1.00 . A A . 37 CYS CB 1 1 3 1803 1 1 37 CYS H H -5.824 1.046 2.952 1.00 . A A . 37 CYS H 1 1 3 1804 1 1 37 CYS HA H -3.541 -0.335 1.782 1.00 . A A . 37 CYS HA 1 1 3 1805 1 1 37 CYS HB2 H -6.478 -0.387 1.065 1.00 . A A . 37 CYS HB2 1 1 3 1806 1 1 37 CYS HB3 H -5.235 -1.353 0.277 1.00 . A A . 37 CYS HB3 1 1 3 1807 1 1 37 CYS N N -4.873 0.872 2.791 1.00 . A A . 37 CYS N 1 1 3 1808 1 1 37 CYS O O -4.069 0.719 -0.725 1.00 . A A . 37 CYS O 1 1 3 1809 1 1 37 CYS SG S -5.748 -2.183 2.453 1.00 . A A . 37 CYS SG 1 1 3 1810 1 1 38 GLU C C -2.664 3.957 -0.311 1.00 . A A . 38 GLU C 1 1 3 1811 1 1 38 GLU CA C -4.105 3.456 -0.310 1.00 . A A . 38 GLU CA 1 1 3 1812 1 1 38 GLU CB C -5.065 4.625 -0.080 1.00 . A A . 38 GLU CB 1 1 3 1813 1 1 38 GLU CD C -6.379 4.637 -2.237 1.00 . A A . 38 GLU CD 1 1 3 1814 1 1 38 GLU CG C -6.423 4.435 -0.735 1.00 . A A . 38 GLU CG 1 1 3 1815 1 1 38 GLU H H -4.454 2.711 1.640 1.00 . A A . 38 GLU H 1 1 3 1816 1 1 38 GLU HA H -4.319 3.009 -1.269 1.00 . A A . 38 GLU HA 1 1 3 1817 1 1 38 GLU HB2 H -5.215 4.749 0.982 1.00 . A A . 38 GLU HB2 1 1 3 1818 1 1 38 GLU HB3 H -4.620 5.525 -0.479 1.00 . A A . 38 GLU HB3 1 1 3 1819 1 1 38 GLU HG2 H -6.769 3.433 -0.532 1.00 . A A . 38 GLU HG2 1 1 3 1820 1 1 38 GLU HG3 H -7.116 5.147 -0.311 1.00 . A A . 38 GLU HG3 1 1 3 1821 1 1 38 GLU N N -4.298 2.434 0.713 1.00 . A A . 38 GLU N 1 1 3 1822 1 1 38 GLU O O -2.279 4.769 0.531 1.00 . A A . 38 GLU O 1 1 3 1823 1 1 38 GLU OE1 O -6.680 5.759 -2.695 1.00 . A A . 38 GLU OE1 1 1 3 1824 1 1 38 GLU OE2 O -6.044 3.672 -2.956 1.00 . A A . 38 GLU OE2 1 1 3 1825 1 1 39 CYS C C -0.346 5.379 -1.536 1.00 . A A . 39 CYS C 1 1 3 1826 1 1 39 CYS CA C -0.472 3.865 -1.369 1.00 . A A . 39 CYS CA 1 1 3 1827 1 1 39 CYS CB C 0.193 3.153 -2.550 1.00 . A A . 39 CYS CB 1 1 3 1828 1 1 39 CYS H H -2.237 2.823 -1.901 1.00 . A A . 39 CYS H 1 1 3 1829 1 1 39 CYS HA H 0.025 3.570 -0.457 1.00 . A A . 39 CYS HA 1 1 3 1830 1 1 39 CYS HB2 H -0.264 3.490 -3.469 1.00 . A A . 39 CYS HB2 1 1 3 1831 1 1 39 CYS HB3 H 1.244 3.400 -2.565 1.00 . A A . 39 CYS HB3 1 1 3 1832 1 1 39 CYS N N -1.872 3.467 -1.260 1.00 . A A . 39 CYS N 1 1 3 1833 1 1 39 CYS O O -1.074 5.985 -2.322 1.00 . A A . 39 CYS O 1 1 3 1834 1 1 39 CYS SG S 0.052 1.338 -2.499 1.00 . A A . 39 CYS SG 1 1 3 1835 1 1 40 PRO C C 1.007 7.938 -2.311 1.00 . A A . 40 PRO C 1 1 3 1836 1 1 40 PRO CA C 0.798 7.462 -0.879 1.00 . A A . 40 PRO CA 1 1 3 1837 1 1 40 PRO CB C 2.067 7.683 -0.052 1.00 . A A . 40 PRO CB 1 1 3 1838 1 1 40 PRO CD C 1.502 5.372 0.162 1.00 . A A . 40 PRO CD 1 1 3 1839 1 1 40 PRO CG C 2.106 6.536 0.896 1.00 . A A . 40 PRO CG 1 1 3 1840 1 1 40 PRO HA H -0.023 8.008 -0.437 1.00 . A A . 40 PRO HA 1 1 3 1841 1 1 40 PRO HB2 H 2.928 7.688 -0.704 1.00 . A A . 40 PRO HB2 1 1 3 1842 1 1 40 PRO HB3 H 1.999 8.625 0.472 1.00 . A A . 40 PRO HB3 1 1 3 1843 1 1 40 PRO HD2 H 2.269 4.810 -0.351 1.00 . A A . 40 PRO HD2 1 1 3 1844 1 1 40 PRO HD3 H 0.960 4.736 0.845 1.00 . A A . 40 PRO HD3 1 1 3 1845 1 1 40 PRO HG2 H 3.129 6.319 1.167 1.00 . A A . 40 PRO HG2 1 1 3 1846 1 1 40 PRO HG3 H 1.525 6.766 1.777 1.00 . A A . 40 PRO HG3 1 1 3 1847 1 1 40 PRO N N 0.585 6.013 -0.800 1.00 . A A . 40 PRO N 1 1 3 1848 1 1 40 PRO O O 1.007 7.139 -3.248 1.00 . A A . 40 PRO O 1 1 3 1849 1 1 41 SER C C 2.834 10.312 -3.953 1.00 . A A . 41 SER C 1 1 3 1850 1 1 41 SER CA C 1.396 9.827 -3.795 1.00 . A A . 41 SER CA 1 1 3 1851 1 1 41 SER CB C 0.425 10.986 -4.026 1.00 . A A . 41 SER CB 1 1 3 1852 1 1 41 SER H H 1.174 9.829 -1.689 1.00 . A A . 41 SER H 1 1 3 1853 1 1 41 SER HA H 1.207 9.058 -4.530 1.00 . A A . 41 SER HA 1 1 3 1854 1 1 41 SER HB2 H 0.764 11.574 -4.866 1.00 . A A . 41 SER HB2 1 1 3 1855 1 1 41 SER HB3 H -0.558 10.592 -4.236 1.00 . A A . 41 SER HB3 1 1 3 1856 1 1 41 SER HG H 1.203 12.231 -2.729 1.00 . A A . 41 SER HG 1 1 3 1857 1 1 41 SER N N 1.185 9.244 -2.475 1.00 . A A . 41 SER N 1 1 3 1858 1 1 41 SER O O 3.102 11.263 -4.688 1.00 . A A . 41 SER O 1 1 3 1859 1 1 41 SER OG O 0.348 11.822 -2.885 1.00 . A A . 41 SER OG 1 1 3 1860 1 1 42 TYR C C 6.041 8.867 -2.814 1.00 . A A . 42 TYR C 1 1 3 1861 1 1 42 TYR CA C 5.167 10.011 -3.326 1.00 . A A . 42 TYR CA 1 1 3 1862 1 1 42 TYR CB C 5.430 11.281 -2.512 1.00 . A A . 42 TYR CB 1 1 3 1863 1 1 42 TYR CD1 C 6.318 10.483 -0.287 1.00 . A A . 42 TYR CD1 1 1 3 1864 1 1 42 TYR CD2 C 4.165 11.505 -0.337 1.00 . A A . 42 TYR CD2 1 1 3 1865 1 1 42 TYR CE1 C 6.206 10.303 1.078 1.00 . A A . 42 TYR CE1 1 1 3 1866 1 1 42 TYR CE2 C 4.046 11.329 1.028 1.00 . A A . 42 TYR CE2 1 1 3 1867 1 1 42 TYR CG C 5.302 11.086 -1.017 1.00 . A A . 42 TYR CG 1 1 3 1868 1 1 42 TYR CZ C 5.068 10.727 1.731 1.00 . A A . 42 TYR CZ 1 1 3 1869 1 1 42 TYR H H 3.480 8.900 -2.694 1.00 . A A . 42 TYR H 1 1 3 1870 1 1 42 TYR HA H 5.411 10.200 -4.360 1.00 . A A . 42 TYR HA 1 1 3 1871 1 1 42 TYR HB2 H 6.432 11.628 -2.715 1.00 . A A . 42 TYR HB2 1 1 3 1872 1 1 42 TYR HB3 H 4.725 12.043 -2.810 1.00 . A A . 42 TYR HB3 1 1 3 1873 1 1 42 TYR HD1 H 7.208 10.152 -0.802 1.00 . A A . 42 TYR HD1 1 1 3 1874 1 1 42 TYR HD2 H 3.366 11.976 -0.891 1.00 . A A . 42 TYR HD2 1 1 3 1875 1 1 42 TYR HE1 H 7.008 9.832 1.627 1.00 . A A . 42 TYR HE1 1 1 3 1876 1 1 42 TYR HE2 H 3.154 11.661 1.539 1.00 . A A . 42 TYR HE2 1 1 3 1877 1 1 42 TYR HH H 4.645 11.364 3.495 1.00 . A A . 42 TYR HH 1 1 3 1878 1 1 42 TYR N N 3.756 9.651 -3.260 1.00 . A A . 42 TYR N 1 1 3 1879 1 1 42 TYR O O 5.665 8.160 -1.879 1.00 . A A . 42 TYR O 1 1 3 1880 1 1 42 TYR OH O 4.953 10.550 3.090 1.00 . A A . 42 TYR OH 1 1 3 1881 1 1 43 PRO C C 8.847 7.911 -1.699 1.00 . A A . 43 PRO C 1 1 3 1882 1 1 43 PRO CA C 8.148 7.605 -3.019 1.00 . A A . 43 PRO CA 1 1 3 1883 1 1 43 PRO CB C 9.159 7.568 -4.165 1.00 . A A . 43 PRO CB 1 1 3 1884 1 1 43 PRO CD C 7.754 9.466 -4.545 1.00 . A A . 43 PRO CD 1 1 3 1885 1 1 43 PRO CG C 9.161 8.956 -4.705 1.00 . A A . 43 PRO CG 1 1 3 1886 1 1 43 PRO HA H 7.646 6.651 -2.947 1.00 . A A . 43 PRO HA 1 1 3 1887 1 1 43 PRO HB2 H 10.131 7.289 -3.783 1.00 . A A . 43 PRO HB2 1 1 3 1888 1 1 43 PRO HB3 H 8.839 6.856 -4.910 1.00 . A A . 43 PRO HB3 1 1 3 1889 1 1 43 PRO HD2 H 7.760 10.518 -4.303 1.00 . A A . 43 PRO HD2 1 1 3 1890 1 1 43 PRO HD3 H 7.184 9.288 -5.445 1.00 . A A . 43 PRO HD3 1 1 3 1891 1 1 43 PRO HG2 H 9.848 9.569 -4.140 1.00 . A A . 43 PRO HG2 1 1 3 1892 1 1 43 PRO HG3 H 9.439 8.944 -5.748 1.00 . A A . 43 PRO HG3 1 1 3 1893 1 1 43 PRO N N 7.224 8.670 -3.421 1.00 . A A . 43 PRO N 1 1 3 1894 1 1 43 PRO O O 9.655 8.836 -1.613 1.00 . A A . 43 PRO O 1 1 3 1895 1 1 44 GLY C C 10.579 6.867 0.678 1.00 . A A . 44 GLY C 1 1 3 1896 1 1 44 GLY CA C 9.137 7.333 0.630 1.00 . A A . 44 GLY CA 1 1 3 1897 1 1 44 GLY H H 7.879 6.408 -0.800 1.00 . A A . 44 GLY H 1 1 3 1898 1 1 44 GLY HA2 H 8.569 6.787 1.369 1.00 . A A . 44 GLY HA2 1 1 3 1899 1 1 44 GLY HA3 H 9.102 8.385 0.870 1.00 . A A . 44 GLY HA3 1 1 3 1900 1 1 44 GLY N N 8.530 7.129 -0.672 1.00 . A A . 44 GLY N 1 1 3 1901 1 1 44 GLY O O 10.862 5.683 0.499 1.00 . A A . 44 GLY O 1 1 3 1902 1 1 45 ASN C C 13.557 8.130 2.211 1.00 . A A . 45 ASN C 1 1 3 1903 1 1 45 ASN CA C 12.913 7.481 0.990 1.00 . A A . 45 ASN CA 1 1 3 1904 1 1 45 ASN CB C 13.625 7.943 -0.282 1.00 . A A . 45 ASN CB 1 1 3 1905 1 1 45 ASN CG C 14.745 7.005 -0.691 1.00 . A A . 45 ASN CG 1 1 3 1906 1 1 45 ASN H H 11.204 8.729 1.053 1.00 . A A . 45 ASN H 1 1 3 1907 1 1 45 ASN HA H 13.007 6.409 1.076 1.00 . A A . 45 ASN HA 1 1 3 1908 1 1 45 ASN HB2 H 12.911 7.992 -1.090 1.00 . A A . 45 ASN HB2 1 1 3 1909 1 1 45 ASN HB3 H 14.044 8.925 -0.117 1.00 . A A . 45 ASN HB3 1 1 3 1910 1 1 45 ASN HD21 H 15.958 7.830 0.652 1.00 . A A . 45 ASN HD21 1 1 3 1911 1 1 45 ASN HD22 H 16.638 6.549 -0.287 1.00 . A A . 45 ASN HD22 1 1 3 1912 1 1 45 ASN N N 11.492 7.802 0.919 1.00 . A A . 45 ASN N 1 1 3 1913 1 1 45 ASN ND2 N 15.897 7.142 -0.043 1.00 . A A . 45 ASN ND2 1 1 3 1914 1 1 45 ASN O O 14.301 7.485 2.949 1.00 . A A . 45 ASN O 1 1 3 1915 1 1 45 ASN OD1 O 14.577 6.168 -1.577 1.00 . A A . 45 ASN OD1 1 1 3 1916 1 1 46 GLY C C 12.814 11.037 4.216 1.00 . A A . 46 GLY C 1 1 3 1917 1 1 46 GLY CA C 13.824 10.125 3.550 1.00 . A A . 46 GLY CA 1 1 3 1918 1 1 46 GLY H H 12.666 9.873 1.795 1.00 . A A . 46 GLY H 1 1 3 1919 1 1 46 GLY HA2 H 14.660 10.719 3.210 1.00 . A A . 46 GLY HA2 1 1 3 1920 1 1 46 GLY HA3 H 14.178 9.407 4.275 1.00 . A A . 46 GLY HA3 1 1 3 1921 1 1 46 GLY N N 13.266 9.410 2.417 1.00 . A A . 46 GLY N 1 1 3 1922 1 1 46 GLY O O 12.697 10.987 5.459 1.00 . A A . 46 GLY O 1 1 3 1923 1 1 46 GLY OXT O 12.139 11.802 3.496 1.00 . A A . 46 GLY OXT 1 1 4 1924 1 1 1 ALA C C -10.785 2.855 6.998 1.00 . A A . 1 ALA C 1 1 4 1925 1 1 1 ALA CA C -10.924 4.199 6.291 1.00 . A A . 1 ALA CA 1 1 4 1926 1 1 1 ALA CB C -9.758 5.107 6.652 1.00 . A A . 1 ALA CB 1 1 4 1927 1 1 1 ALA H1 H -12.327 4.802 7.669 1.00 . A A . 1 ALA H1 1 1 4 1928 1 1 1 ALA H2 H -12.163 5.841 6.314 1.00 . A A . 1 ALA H2 1 1 4 1929 1 1 1 ALA H3 H -12.972 4.336 6.151 1.00 . A A . 1 ALA H3 1 1 4 1930 1 1 1 ALA HA H -10.903 4.035 5.224 1.00 . A A . 1 ALA HA 1 1 4 1931 1 1 1 ALA HB1 H -9.999 5.665 7.545 1.00 . A A . 1 ALA HB1 1 1 4 1932 1 1 1 ALA HB2 H -8.877 4.509 6.829 1.00 . A A . 1 ALA HB2 1 1 4 1933 1 1 1 ALA HB3 H -9.571 5.793 5.839 1.00 . A A . 1 ALA HB3 1 1 4 1934 1 1 1 ALA N N -12.213 4.853 6.638 1.00 . A A . 1 ALA N 1 1 4 1935 1 1 1 ALA O O -10.092 2.743 8.009 1.00 . A A . 1 ALA O 1 1 4 1936 1 1 2 MET C C -11.894 -0.543 6.043 1.00 . A A . 2 MET C 1 1 4 1937 1 1 2 MET CA C -11.400 0.500 7.039 1.00 . A A . 2 MET CA 1 1 4 1938 1 1 2 MET CB C -12.242 0.443 8.315 1.00 . A A . 2 MET CB 1 1 4 1939 1 1 2 MET CE C -13.731 0.888 11.177 1.00 . A A . 2 MET CE 1 1 4 1940 1 1 2 MET CG C -11.475 0.834 9.568 1.00 . A A . 2 MET CG 1 1 4 1941 1 1 2 MET H H -11.985 1.990 5.653 1.00 . A A . 2 MET H 1 1 4 1942 1 1 2 MET HA H -10.372 0.285 7.287 1.00 . A A . 2 MET HA 1 1 4 1943 1 1 2 MET HB2 H -13.081 1.115 8.209 1.00 . A A . 2 MET HB2 1 1 4 1944 1 1 2 MET HB3 H -12.611 -0.563 8.444 1.00 . A A . 2 MET HB3 1 1 4 1945 1 1 2 MET HE1 H -13.600 1.950 11.033 1.00 . A A . 2 MET HE1 1 1 4 1946 1 1 2 MET HE2 H -14.394 0.501 10.417 1.00 . A A . 2 MET HE2 1 1 4 1947 1 1 2 MET HE3 H -14.157 0.706 12.152 1.00 . A A . 2 MET HE3 1 1 4 1948 1 1 2 MET HG2 H -10.446 0.527 9.454 1.00 . A A . 2 MET HG2 1 1 4 1949 1 1 2 MET HG3 H -11.519 1.907 9.681 1.00 . A A . 2 MET HG3 1 1 4 1950 1 1 2 MET N N -11.449 1.838 6.460 1.00 . A A . 2 MET N 1 1 4 1951 1 1 2 MET O O -12.227 -0.219 4.902 1.00 . A A . 2 MET O 1 1 4 1952 1 1 2 MET SD S -12.143 0.068 11.057 1.00 . A A . 2 MET SD 1 1 4 1953 1 1 3 ASP C C -11.509 -3.018 4.392 1.00 . A A . 3 ASP C 1 1 4 1954 1 1 3 ASP CA C -12.395 -2.888 5.627 1.00 . A A . 3 ASP CA 1 1 4 1955 1 1 3 ASP CB C -13.848 -2.663 5.205 1.00 . A A . 3 ASP CB 1 1 4 1956 1 1 3 ASP CG C -14.586 -3.964 4.956 1.00 . A A . 3 ASP CG 1 1 4 1957 1 1 3 ASP H H -11.662 -1.993 7.400 1.00 . A A . 3 ASP H 1 1 4 1958 1 1 3 ASP HA H -12.333 -3.803 6.197 1.00 . A A . 3 ASP HA 1 1 4 1959 1 1 3 ASP HB2 H -14.363 -2.123 5.985 1.00 . A A . 3 ASP HB2 1 1 4 1960 1 1 3 ASP HB3 H -13.866 -2.080 4.296 1.00 . A A . 3 ASP HB3 1 1 4 1961 1 1 3 ASP N N -11.940 -1.797 6.481 1.00 . A A . 3 ASP N 1 1 4 1962 1 1 3 ASP O O -10.683 -2.149 4.114 1.00 . A A . 3 ASP O 1 1 4 1963 1 1 3 ASP OD1 O -15.233 -4.085 3.895 1.00 . A A . 3 ASP OD1 1 1 4 1964 1 1 3 ASP OD2 O -14.516 -4.861 5.822 1.00 . A A . 3 ASP OD2 1 1 4 1965 1 1 4 CYS C C -11.159 -3.273 1.404 1.00 . A A . 4 CYS C 1 1 4 1966 1 1 4 CYS CA C -10.904 -4.353 2.449 1.00 . A A . 4 CYS CA 1 1 4 1967 1 1 4 CYS CB C -11.240 -5.724 1.862 1.00 . A A . 4 CYS CB 1 1 4 1968 1 1 4 CYS H H -12.361 -4.766 3.928 1.00 . A A . 4 CYS H 1 1 4 1969 1 1 4 CYS HA H -9.859 -4.335 2.721 1.00 . A A . 4 CYS HA 1 1 4 1970 1 1 4 CYS HB2 H -12.307 -5.879 1.919 1.00 . A A . 4 CYS HB2 1 1 4 1971 1 1 4 CYS HB3 H -10.933 -5.748 0.827 1.00 . A A . 4 CYS HB3 1 1 4 1972 1 1 4 CYS N N -11.687 -4.109 3.655 1.00 . A A . 4 CYS N 1 1 4 1973 1 1 4 CYS O O -12.145 -2.539 1.481 1.00 . A A . 4 CYS O 1 1 4 1974 1 1 4 CYS SG S -10.434 -7.120 2.712 1.00 . A A . 4 CYS SG 1 1 4 1975 1 1 5 THR C C -9.455 -2.557 -1.800 1.00 . A A . 5 THR C 1 1 4 1976 1 1 5 THR CA C -10.389 -2.206 -0.645 1.00 . A A . 5 THR CA 1 1 4 1977 1 1 5 THR CB C -10.081 -0.801 -0.119 1.00 . A A . 5 THR CB 1 1 4 1978 1 1 5 THR CG2 C -10.085 0.261 -1.198 1.00 . A A . 5 THR CG2 1 1 4 1979 1 1 5 THR H H -9.506 -3.806 0.419 1.00 . A A . 5 THR H 1 1 4 1980 1 1 5 THR HA H -11.406 -2.231 -1.001 1.00 . A A . 5 THR HA 1 1 4 1981 1 1 5 THR HB H -9.104 -0.805 0.337 1.00 . A A . 5 THR HB 1 1 4 1982 1 1 5 THR HG1 H -11.913 -0.614 0.549 1.00 . A A . 5 THR HG1 1 1 4 1983 1 1 5 THR HG21 H -10.278 -0.199 -2.156 1.00 . A A . 5 THR HG21 1 1 4 1984 1 1 5 THR HG22 H -10.856 0.987 -0.986 1.00 . A A . 5 THR HG22 1 1 4 1985 1 1 5 THR HG23 H -9.124 0.753 -1.223 1.00 . A A . 5 THR HG23 1 1 4 1986 1 1 5 THR N N -10.266 -3.188 0.425 1.00 . A A . 5 THR N 1 1 4 1987 1 1 5 THR O O -8.287 -2.175 -1.803 1.00 . A A . 5 THR O 1 1 4 1988 1 1 5 THR OG1 O -11.027 -0.416 0.863 1.00 . A A . 5 THR OG1 1 1 4 1989 1 1 6 THR C C -8.370 -2.543 -4.493 1.00 . A A . 6 THR C 1 1 4 1990 1 1 6 THR CA C -9.190 -3.706 -3.938 1.00 . A A . 6 THR CA 1 1 4 1991 1 1 6 THR CB C -10.106 -4.266 -5.028 1.00 . A A . 6 THR CB 1 1 4 1992 1 1 6 THR CG2 C -10.251 -5.772 -4.972 1.00 . A A . 6 THR CG2 1 1 4 1993 1 1 6 THR H H -10.915 -3.573 -2.715 1.00 . A A . 6 THR H 1 1 4 1994 1 1 6 THR HA H -8.514 -4.484 -3.618 1.00 . A A . 6 THR HA 1 1 4 1995 1 1 6 THR HB H -9.698 -4.009 -5.995 1.00 . A A . 6 THR HB 1 1 4 1996 1 1 6 THR HG1 H -11.356 -2.759 -5.083 1.00 . A A . 6 THR HG1 1 1 4 1997 1 1 6 THR HG21 H -9.443 -6.189 -4.389 1.00 . A A . 6 THR HG21 1 1 4 1998 1 1 6 THR HG22 H -11.195 -6.026 -4.513 1.00 . A A . 6 THR HG22 1 1 4 1999 1 1 6 THR HG23 H -10.217 -6.174 -5.973 1.00 . A A . 6 THR HG23 1 1 4 2000 1 1 6 THR N N -9.978 -3.294 -2.777 1.00 . A A . 6 THR N 1 1 4 2001 1 1 6 THR O O -8.870 -1.734 -5.275 1.00 . A A . 6 THR O 1 1 4 2002 1 1 6 THR OG1 O -11.403 -3.706 -4.930 1.00 . A A . 6 THR OG1 1 1 4 2003 1 1 7 GLY C C -4.794 -1.841 -4.672 1.00 . A A . 7 GLY C 1 1 4 2004 1 1 7 GLY CA C -6.241 -1.401 -4.540 1.00 . A A . 7 GLY CA 1 1 4 2005 1 1 7 GLY H H -6.767 -3.139 -3.453 1.00 . A A . 7 GLY H 1 1 4 2006 1 1 7 GLY HA2 H -6.293 -0.581 -3.839 1.00 . A A . 7 GLY HA2 1 1 4 2007 1 1 7 GLY HA3 H -6.590 -1.059 -5.503 1.00 . A A . 7 GLY HA3 1 1 4 2008 1 1 7 GLY N N -7.109 -2.467 -4.079 1.00 . A A . 7 GLY N 1 1 4 2009 1 1 7 GLY O O -4.505 -3.037 -4.685 1.00 . A A . 7 GLY O 1 1 4 2010 1 1 8 PRO C C -1.791 -1.696 -3.623 1.00 . A A . 8 PRO C 1 1 4 2011 1 1 8 PRO CA C -2.426 -1.187 -4.917 1.00 . A A . 8 PRO CA 1 1 4 2012 1 1 8 PRO CB C -1.821 0.161 -5.314 1.00 . A A . 8 PRO CB 1 1 4 2013 1 1 8 PRO CD C -4.118 0.568 -4.780 1.00 . A A . 8 PRO CD 1 1 4 2014 1 1 8 PRO CG C -2.743 1.176 -4.731 1.00 . A A . 8 PRO CG 1 1 4 2015 1 1 8 PRO HA H -2.252 -1.905 -5.705 1.00 . A A . 8 PRO HA 1 1 4 2016 1 1 8 PRO HB2 H -0.826 0.247 -4.903 1.00 . A A . 8 PRO HB2 1 1 4 2017 1 1 8 PRO HB3 H -1.781 0.239 -6.391 1.00 . A A . 8 PRO HB3 1 1 4 2018 1 1 8 PRO HD2 H -4.688 0.857 -3.910 1.00 . A A . 8 PRO HD2 1 1 4 2019 1 1 8 PRO HD3 H -4.629 0.865 -5.683 1.00 . A A . 8 PRO HD3 1 1 4 2020 1 1 8 PRO HG2 H -2.462 1.383 -3.710 1.00 . A A . 8 PRO HG2 1 1 4 2021 1 1 8 PRO HG3 H -2.713 2.080 -5.320 1.00 . A A . 8 PRO HG3 1 1 4 2022 1 1 8 PRO N N -3.855 -0.885 -4.778 1.00 . A A . 8 PRO N 1 1 4 2023 1 1 8 PRO O O -0.620 -2.078 -3.610 1.00 . A A . 8 PRO O 1 1 4 2024 1 1 9 CYS C C -2.667 -3.509 -0.866 1.00 . A A . 9 CYS C 1 1 4 2025 1 1 9 CYS CA C -2.051 -2.166 -1.247 1.00 . A A . 9 CYS CA 1 1 4 2026 1 1 9 CYS CB C -2.339 -1.134 -0.154 1.00 . A A . 9 CYS CB 1 1 4 2027 1 1 9 CYS H H -3.484 -1.385 -2.599 1.00 . A A . 9 CYS H 1 1 4 2028 1 1 9 CYS HA H -0.982 -2.289 -1.339 1.00 . A A . 9 CYS HA 1 1 4 2029 1 1 9 CYS HB2 H -3.014 -0.388 -0.544 1.00 . A A . 9 CYS HB2 1 1 4 2030 1 1 9 CYS HB3 H -2.805 -1.629 0.686 1.00 . A A . 9 CYS HB3 1 1 4 2031 1 1 9 CYS N N -2.559 -1.701 -2.535 1.00 . A A . 9 CYS N 1 1 4 2032 1 1 9 CYS O O -2.004 -4.360 -0.273 1.00 . A A . 9 CYS O 1 1 4 2033 1 1 9 CYS SG S -0.861 -0.268 0.466 1.00 . A A . 9 CYS SG 1 1 4 2034 1 1 10 CYS C C -4.706 -5.851 -2.103 1.00 . A A . 10 CYS C 1 1 4 2035 1 1 10 CYS CA C -4.641 -4.931 -0.889 1.00 . A A . 10 CYS CA 1 1 4 2036 1 1 10 CYS CB C -6.054 -4.633 -0.389 1.00 . A A . 10 CYS CB 1 1 4 2037 1 1 10 CYS H H -4.419 -2.976 -1.672 1.00 . A A . 10 CYS H 1 1 4 2038 1 1 10 CYS HA H -4.091 -5.431 -0.105 1.00 . A A . 10 CYS HA 1 1 4 2039 1 1 10 CYS HB2 H -6.483 -3.846 -0.990 1.00 . A A . 10 CYS HB2 1 1 4 2040 1 1 10 CYS HB3 H -6.658 -5.523 -0.488 1.00 . A A . 10 CYS HB3 1 1 4 2041 1 1 10 CYS N N -3.940 -3.692 -1.204 1.00 . A A . 10 CYS N 1 1 4 2042 1 1 10 CYS O O -5.351 -5.535 -3.102 1.00 . A A . 10 CYS O 1 1 4 2043 1 1 10 CYS SG S -6.129 -4.104 1.353 1.00 . A A . 10 CYS SG 1 1 4 2044 1 1 11 ARG C C -4.698 -9.273 -2.670 1.00 . A A . 11 ARG C 1 1 4 2045 1 1 11 ARG CA C -4.019 -7.969 -3.089 1.00 . A A . 11 ARG CA 1 1 4 2046 1 1 11 ARG CB C -2.580 -8.249 -3.526 1.00 . A A . 11 ARG CB 1 1 4 2047 1 1 11 ARG CD C -2.355 -7.899 -6.004 1.00 . A A . 11 ARG CD 1 1 4 2048 1 1 11 ARG CG C -2.477 -8.921 -4.885 1.00 . A A . 11 ARG CG 1 1 4 2049 1 1 11 ARG CZ C -0.569 -6.976 -7.430 1.00 . A A . 11 ARG CZ 1 1 4 2050 1 1 11 ARG H H -3.544 -7.189 -1.179 1.00 . A A . 11 ARG H 1 1 4 2051 1 1 11 ARG HA H -4.562 -7.547 -3.921 1.00 . A A . 11 ARG HA 1 1 4 2052 1 1 11 ARG HB2 H -2.041 -7.314 -3.568 1.00 . A A . 11 ARG HB2 1 1 4 2053 1 1 11 ARG HB3 H -2.112 -8.891 -2.794 1.00 . A A . 11 ARG HB3 1 1 4 2054 1 1 11 ARG HD2 H -2.835 -8.292 -6.887 1.00 . A A . 11 ARG HD2 1 1 4 2055 1 1 11 ARG HD3 H -2.852 -6.989 -5.699 1.00 . A A . 11 ARG HD3 1 1 4 2056 1 1 11 ARG HE H -0.280 -7.867 -5.667 1.00 . A A . 11 ARG HE 1 1 4 2057 1 1 11 ARG HG2 H -1.605 -9.557 -4.896 1.00 . A A . 11 ARG HG2 1 1 4 2058 1 1 11 ARG HG3 H -3.363 -9.517 -5.049 1.00 . A A . 11 ARG HG3 1 1 4 2059 1 1 11 ARG HH11 H -2.435 -6.768 -8.183 1.00 . A A . 11 ARG HH11 1 1 4 2060 1 1 11 ARG HH12 H -1.161 -6.128 -9.167 1.00 . A A . 11 ARG HH12 1 1 4 2061 1 1 11 ARG HH21 H 1.396 -7.025 -6.959 1.00 . A A . 11 ARG HH21 1 1 4 2062 1 1 11 ARG HH22 H 1.013 -6.273 -8.472 1.00 . A A . 11 ARG HH22 1 1 4 2063 1 1 11 ARG N N -4.037 -6.994 -2.004 1.00 . A A . 11 ARG N 1 1 4 2064 1 1 11 ARG NE N -0.960 -7.595 -6.318 1.00 . A A . 11 ARG NE 1 1 4 2065 1 1 11 ARG NH1 N -1.462 -6.593 -8.334 1.00 . A A . 11 ARG NH1 1 1 4 2066 1 1 11 ARG NH2 N 0.719 -6.739 -7.637 1.00 . A A . 11 ARG NH2 1 1 4 2067 1 1 11 ARG O O -4.984 -10.129 -3.507 1.00 . A A . 11 ARG O 1 1 4 2068 1 1 12 GLN C C -6.659 -10.278 0.189 1.00 . A A . 12 GLN C 1 1 4 2069 1 1 12 GLN CA C -5.592 -10.623 -0.848 1.00 . A A . 12 GLN CA 1 1 4 2070 1 1 12 GLN CB C -4.547 -11.537 -0.217 1.00 . A A . 12 GLN CB 1 1 4 2071 1 1 12 GLN CD C -2.359 -12.693 -0.728 1.00 . A A . 12 GLN CD 1 1 4 2072 1 1 12 GLN CG C -3.745 -12.339 -1.230 1.00 . A A . 12 GLN CG 1 1 4 2073 1 1 12 GLN H H -4.698 -8.709 -0.749 1.00 . A A . 12 GLN H 1 1 4 2074 1 1 12 GLN HA H -6.058 -11.138 -1.673 1.00 . A A . 12 GLN HA 1 1 4 2075 1 1 12 GLN HB2 H -3.861 -10.931 0.356 1.00 . A A . 12 GLN HB2 1 1 4 2076 1 1 12 GLN HB3 H -5.044 -12.228 0.446 1.00 . A A . 12 GLN HB3 1 1 4 2077 1 1 12 GLN HE21 H -3.100 -13.177 1.052 1.00 . A A . 12 GLN HE21 1 1 4 2078 1 1 12 GLN HE22 H -1.390 -13.352 0.878 1.00 . A A . 12 GLN HE22 1 1 4 2079 1 1 12 GLN HG2 H -4.276 -13.254 -1.447 1.00 . A A . 12 GLN HG2 1 1 4 2080 1 1 12 GLN HG3 H -3.648 -11.757 -2.134 1.00 . A A . 12 GLN HG3 1 1 4 2081 1 1 12 GLN N N -4.951 -9.421 -1.371 1.00 . A A . 12 GLN N 1 1 4 2082 1 1 12 GLN NE2 N -2.275 -13.117 0.527 1.00 . A A . 12 GLN NE2 1 1 4 2083 1 1 12 GLN O O -7.132 -11.153 0.915 1.00 . A A . 12 GLN O 1 1 4 2084 1 1 12 GLN OE1 O -1.375 -12.586 -1.460 1.00 . A A . 12 GLN OE1 1 1 4 2085 1 1 13 CYS C C -7.434 -8.342 2.591 1.00 . A A . 13 CYS C 1 1 4 2086 1 1 13 CYS CA C -8.039 -8.532 1.204 1.00 . A A . 13 CYS CA 1 1 4 2087 1 1 13 CYS CB C -9.219 -9.508 1.277 1.00 . A A . 13 CYS CB 1 1 4 2088 1 1 13 CYS H H -6.611 -8.356 -0.347 1.00 . A A . 13 CYS H 1 1 4 2089 1 1 13 CYS HA H -8.399 -7.576 0.853 1.00 . A A . 13 CYS HA 1 1 4 2090 1 1 13 CYS HB2 H -9.264 -10.074 0.359 1.00 . A A . 13 CYS HB2 1 1 4 2091 1 1 13 CYS HB3 H -9.063 -10.186 2.104 1.00 . A A . 13 CYS HB3 1 1 4 2092 1 1 13 CYS N N -7.030 -9.001 0.255 1.00 . A A . 13 CYS N 1 1 4 2093 1 1 13 CYS O O -8.080 -8.614 3.604 1.00 . A A . 13 CYS O 1 1 4 2094 1 1 13 CYS SG S -10.839 -8.708 1.514 1.00 . A A . 13 CYS SG 1 1 4 2095 1 1 14 LYS C C -4.360 -6.649 3.703 1.00 . A A . 14 LYS C 1 1 4 2096 1 1 14 LYS CA C -5.501 -7.642 3.891 1.00 . A A . 14 LYS CA 1 1 4 2097 1 1 14 LYS CB C -4.960 -8.960 4.450 1.00 . A A . 14 LYS CB 1 1 4 2098 1 1 14 LYS CD C -3.901 -10.006 6.474 1.00 . A A . 14 LYS CD 1 1 4 2099 1 1 14 LYS CE C -3.863 -10.046 7.993 1.00 . A A . 14 LYS CE 1 1 4 2100 1 1 14 LYS CG C -4.932 -9.010 5.969 1.00 . A A . 14 LYS CG 1 1 4 2101 1 1 14 LYS H H -5.728 -7.671 1.789 1.00 . A A . 14 LYS H 1 1 4 2102 1 1 14 LYS HA H -6.212 -7.228 4.590 1.00 . A A . 14 LYS HA 1 1 4 2103 1 1 14 LYS HB2 H -5.581 -9.769 4.096 1.00 . A A . 14 LYS HB2 1 1 4 2104 1 1 14 LYS HB3 H -3.953 -9.105 4.088 1.00 . A A . 14 LYS HB3 1 1 4 2105 1 1 14 LYS HD2 H -4.152 -10.989 6.104 1.00 . A A . 14 LYS HD2 1 1 4 2106 1 1 14 LYS HD3 H -2.927 -9.719 6.106 1.00 . A A . 14 LYS HD3 1 1 4 2107 1 1 14 LYS HE2 H -4.816 -10.402 8.355 1.00 . A A . 14 LYS HE2 1 1 4 2108 1 1 14 LYS HE3 H -3.085 -10.728 8.303 1.00 . A A . 14 LYS HE3 1 1 4 2109 1 1 14 LYS HG2 H -4.686 -8.030 6.348 1.00 . A A . 14 LYS HG2 1 1 4 2110 1 1 14 LYS HG3 H -5.908 -9.303 6.328 1.00 . A A . 14 LYS HG3 1 1 4 2111 1 1 14 LYS HZ1 H -2.702 -8.323 8.202 1.00 . A A . 14 LYS HZ1 1 1 4 2112 1 1 14 LYS HZ2 H -4.365 -8.049 8.341 1.00 . A A . 14 LYS HZ2 1 1 4 2113 1 1 14 LYS HZ3 H -3.519 -8.774 9.613 1.00 . A A . 14 LYS HZ3 1 1 4 2114 1 1 14 LYS N N -6.192 -7.872 2.630 1.00 . A A . 14 LYS N 1 1 4 2115 1 1 14 LYS NZ N -3.593 -8.704 8.578 1.00 . A A . 14 LYS NZ 1 1 4 2116 1 1 14 LYS O O -3.215 -7.047 3.493 1.00 . A A . 14 LYS O 1 1 4 2117 1 1 15 LEU C C -2.279 -4.754 3.785 1.00 . A A . 15 LEU C 1 1 4 2118 1 1 15 LEU CA C -3.716 -4.272 3.598 1.00 . A A . 15 LEU CA 1 1 4 2119 1 1 15 LEU CB C -4.008 -3.115 4.566 1.00 . A A . 15 LEU CB 1 1 4 2120 1 1 15 LEU CD1 C -6.079 -3.806 5.819 1.00 . A A . 15 LEU CD1 1 1 4 2121 1 1 15 LEU CD2 C -3.846 -4.677 6.540 1.00 . A A . 15 LEU CD2 1 1 4 2122 1 1 15 LEU CG C -4.594 -3.499 5.933 1.00 . A A . 15 LEU CG 1 1 4 2123 1 1 15 LEU H H -5.630 -5.123 3.926 1.00 . A A . 15 LEU H 1 1 4 2124 1 1 15 LEU HA H -3.817 -3.905 2.588 1.00 . A A . 15 LEU HA 1 1 4 2125 1 1 15 LEU HB2 H -3.084 -2.582 4.737 1.00 . A A . 15 LEU HB2 1 1 4 2126 1 1 15 LEU HB3 H -4.701 -2.442 4.082 1.00 . A A . 15 LEU HB3 1 1 4 2127 1 1 15 LEU HD11 H -6.464 -3.388 4.901 1.00 . A A . 15 LEU HD11 1 1 4 2128 1 1 15 LEU HD12 H -6.226 -4.876 5.816 1.00 . A A . 15 LEU HD12 1 1 4 2129 1 1 15 LEU HD13 H -6.602 -3.374 6.659 1.00 . A A . 15 LEU HD13 1 1 4 2130 1 1 15 LEU HD21 H -2.800 -4.429 6.635 1.00 . A A . 15 LEU HD21 1 1 4 2131 1 1 15 LEU HD22 H -4.253 -4.897 7.516 1.00 . A A . 15 LEU HD22 1 1 4 2132 1 1 15 LEU HD23 H -3.954 -5.542 5.903 1.00 . A A . 15 LEU HD23 1 1 4 2133 1 1 15 LEU HG H -4.486 -2.658 6.604 1.00 . A A . 15 LEU HG 1 1 4 2134 1 1 15 LEU N N -4.693 -5.356 3.768 1.00 . A A . 15 LEU N 1 1 4 2135 1 1 15 LEU O O -1.939 -5.354 4.804 1.00 . A A . 15 LEU O 1 1 4 2136 1 1 16 LYS C C 0.592 -4.535 4.176 1.00 . A A . 16 LYS C 1 1 4 2137 1 1 16 LYS CA C -0.042 -4.906 2.834 1.00 . A A . 16 LYS CA 1 1 4 2138 1 1 16 LYS CB C 0.742 -4.263 1.688 1.00 . A A . 16 LYS CB 1 1 4 2139 1 1 16 LYS CD C 1.613 -4.454 -0.661 1.00 . A A . 16 LYS CD 1 1 4 2140 1 1 16 LYS CE C 1.032 -4.831 -2.014 1.00 . A A . 16 LYS CE 1 1 4 2141 1 1 16 LYS CG C 0.891 -5.163 0.473 1.00 . A A . 16 LYS CG 1 1 4 2142 1 1 16 LYS H H -1.773 -4.019 1.995 1.00 . A A . 16 LYS H 1 1 4 2143 1 1 16 LYS HA H -0.014 -5.980 2.719 1.00 . A A . 16 LYS HA 1 1 4 2144 1 1 16 LYS HB2 H 0.232 -3.361 1.381 1.00 . A A . 16 LYS HB2 1 1 4 2145 1 1 16 LYS HB3 H 1.729 -4.005 2.041 1.00 . A A . 16 LYS HB3 1 1 4 2146 1 1 16 LYS HD2 H 1.518 -3.387 -0.524 1.00 . A A . 16 LYS HD2 1 1 4 2147 1 1 16 LYS HD3 H 2.658 -4.730 -0.637 1.00 . A A . 16 LYS HD3 1 1 4 2148 1 1 16 LYS HE2 H 0.487 -5.758 -1.913 1.00 . A A . 16 LYS HE2 1 1 4 2149 1 1 16 LYS HE3 H 0.357 -4.050 -2.332 1.00 . A A . 16 LYS HE3 1 1 4 2150 1 1 16 LYS HG2 H 1.456 -6.040 0.754 1.00 . A A . 16 LYS HG2 1 1 4 2151 1 1 16 LYS HG3 H -0.091 -5.459 0.134 1.00 . A A . 16 LYS HG3 1 1 4 2152 1 1 16 LYS HZ1 H 2.947 -4.478 -2.772 1.00 . A A . 16 LYS HZ1 1 1 4 2153 1 1 16 LYS HZ2 H 2.336 -6.011 -3.143 1.00 . A A . 16 LYS HZ2 1 1 4 2154 1 1 16 LYS HZ3 H 1.759 -4.649 -3.964 1.00 . A A . 16 LYS HZ3 1 1 4 2155 1 1 16 LYS N N -1.441 -4.494 2.786 1.00 . A A . 16 LYS N 1 1 4 2156 1 1 16 LYS NZ N 2.093 -5.004 -3.045 1.00 . A A . 16 LYS NZ 1 1 4 2157 1 1 16 LYS O O 0.273 -3.497 4.755 1.00 . A A . 16 LYS O 1 1 4 2158 1 1 17 PRO C C 2.737 -3.726 6.076 1.00 . A A . 17 PRO C 1 1 4 2159 1 1 17 PRO CA C 2.173 -5.139 5.970 1.00 . A A . 17 PRO CA 1 1 4 2160 1 1 17 PRO CB C 3.305 -6.166 5.973 1.00 . A A . 17 PRO CB 1 1 4 2161 1 1 17 PRO CD C 1.940 -6.647 4.066 1.00 . A A . 17 PRO CD 1 1 4 2162 1 1 17 PRO CG C 2.806 -7.281 5.121 1.00 . A A . 17 PRO CG 1 1 4 2163 1 1 17 PRO HA H 1.513 -5.325 6.804 1.00 . A A . 17 PRO HA 1 1 4 2164 1 1 17 PRO HB2 H 4.199 -5.722 5.561 1.00 . A A . 17 PRO HB2 1 1 4 2165 1 1 17 PRO HB3 H 3.493 -6.497 6.984 1.00 . A A . 17 PRO HB3 1 1 4 2166 1 1 17 PRO HD2 H 2.515 -6.455 3.172 1.00 . A A . 17 PRO HD2 1 1 4 2167 1 1 17 PRO HD3 H 1.094 -7.280 3.842 1.00 . A A . 17 PRO HD3 1 1 4 2168 1 1 17 PRO HG2 H 3.639 -7.793 4.663 1.00 . A A . 17 PRO HG2 1 1 4 2169 1 1 17 PRO HG3 H 2.225 -7.968 5.719 1.00 . A A . 17 PRO HG3 1 1 4 2170 1 1 17 PRO N N 1.500 -5.383 4.690 1.00 . A A . 17 PRO N 1 1 4 2171 1 1 17 PRO O O 3.504 -3.287 5.218 1.00 . A A . 17 PRO O 1 1 4 2172 1 1 18 ALA C C 4.348 -1.580 7.267 1.00 . A A . 18 ALA C 1 1 4 2173 1 1 18 ALA CA C 2.827 -1.656 7.360 1.00 . A A . 18 ALA CA 1 1 4 2174 1 1 18 ALA CB C 2.353 -1.149 8.713 1.00 . A A . 18 ALA CB 1 1 4 2175 1 1 18 ALA H H 1.745 -3.424 7.786 1.00 . A A . 18 ALA H 1 1 4 2176 1 1 18 ALA HA H 2.398 -1.026 6.595 1.00 . A A . 18 ALA HA 1 1 4 2177 1 1 18 ALA HB1 H 2.807 -1.737 9.497 1.00 . A A . 18 ALA HB1 1 1 4 2178 1 1 18 ALA HB2 H 2.637 -0.114 8.830 1.00 . A A . 18 ALA HB2 1 1 4 2179 1 1 18 ALA HB3 H 1.278 -1.236 8.774 1.00 . A A . 18 ALA HB3 1 1 4 2180 1 1 18 ALA N N 2.356 -3.019 7.137 1.00 . A A . 18 ALA N 1 1 4 2181 1 1 18 ALA O O 5.059 -2.294 7.974 1.00 . A A . 18 ALA O 1 1 4 2182 1 1 19 GLY C C 6.800 -1.429 5.076 1.00 . A A . 19 GLY C 1 1 4 2183 1 1 19 GLY CA C 6.271 -0.572 6.209 1.00 . A A . 19 GLY CA 1 1 4 2184 1 1 19 GLY H H 4.223 -0.180 5.844 1.00 . A A . 19 GLY H 1 1 4 2185 1 1 19 GLY HA2 H 6.766 -0.858 7.125 1.00 . A A . 19 GLY HA2 1 1 4 2186 1 1 19 GLY HA3 H 6.494 0.463 5.999 1.00 . A A . 19 GLY HA3 1 1 4 2187 1 1 19 GLY N N 4.839 -0.718 6.385 1.00 . A A . 19 GLY N 1 1 4 2188 1 1 19 GLY O O 7.987 -1.752 5.034 1.00 . A A . 19 GLY O 1 1 4 2189 1 1 20 THR C C 5.801 -1.991 1.714 1.00 . A A . 20 THR C 1 1 4 2190 1 1 20 THR CA C 6.294 -2.620 3.012 1.00 . A A . 20 THR CA 1 1 4 2191 1 1 20 THR CB C 5.722 -4.031 3.162 1.00 . A A . 20 THR CB 1 1 4 2192 1 1 20 THR CG2 C 6.064 -4.945 2.005 1.00 . A A . 20 THR CG2 1 1 4 2193 1 1 20 THR H H 4.983 -1.506 4.241 1.00 . A A . 20 THR H 1 1 4 2194 1 1 20 THR HA H 7.372 -2.677 2.985 1.00 . A A . 20 THR HA 1 1 4 2195 1 1 20 THR HB H 4.645 -3.966 3.225 1.00 . A A . 20 THR HB 1 1 4 2196 1 1 20 THR HG1 H 5.831 -5.525 4.424 1.00 . A A . 20 THR HG1 1 1 4 2197 1 1 20 THR HG21 H 6.551 -4.376 1.228 1.00 . A A . 20 THR HG21 1 1 4 2198 1 1 20 THR HG22 H 6.726 -5.727 2.348 1.00 . A A . 20 THR HG22 1 1 4 2199 1 1 20 THR HG23 H 5.158 -5.386 1.615 1.00 . A A . 20 THR HG23 1 1 4 2200 1 1 20 THR N N 5.915 -1.797 4.153 1.00 . A A . 20 THR N 1 1 4 2201 1 1 20 THR O O 4.713 -1.417 1.667 1.00 . A A . 20 THR O 1 1 4 2202 1 1 20 THR OG1 O 6.200 -4.642 4.348 1.00 . A A . 20 THR OG1 1 1 4 2203 1 1 21 THR C C 4.896 -2.060 -1.105 1.00 . A A . 21 THR C 1 1 4 2204 1 1 21 THR CA C 6.245 -1.533 -0.632 1.00 . A A . 21 THR CA 1 1 4 2205 1 1 21 THR CB C 7.326 -1.836 -1.670 1.00 . A A . 21 THR CB 1 1 4 2206 1 1 21 THR CG2 C 8.086 -0.602 -2.100 1.00 . A A . 21 THR CG2 1 1 4 2207 1 1 21 THR H H 7.462 -2.565 0.760 1.00 . A A . 21 THR H 1 1 4 2208 1 1 21 THR HA H 6.170 -0.463 -0.512 1.00 . A A . 21 THR HA 1 1 4 2209 1 1 21 THR HB H 6.862 -2.262 -2.549 1.00 . A A . 21 THR HB 1 1 4 2210 1 1 21 THR HG1 H 8.569 -3.335 -1.878 1.00 . A A . 21 THR HG1 1 1 4 2211 1 1 21 THR HG21 H 7.721 0.252 -1.547 1.00 . A A . 21 THR HG21 1 1 4 2212 1 1 21 THR HG22 H 9.138 -0.739 -1.900 1.00 . A A . 21 THR HG22 1 1 4 2213 1 1 21 THR HG23 H 7.937 -0.437 -3.156 1.00 . A A . 21 THR HG23 1 1 4 2214 1 1 21 THR N N 6.606 -2.098 0.663 1.00 . A A . 21 THR N 1 1 4 2215 1 1 21 THR O O 4.585 -3.240 -0.945 1.00 . A A . 21 THR O 1 1 4 2216 1 1 21 THR OG1 O 8.266 -2.768 -1.165 1.00 . A A . 21 THR OG1 1 1 4 2217 1 1 22 CYS C C 2.582 -1.098 -3.619 1.00 . A A . 22 CYS C 1 1 4 2218 1 1 22 CYS CA C 2.775 -1.535 -2.171 1.00 . A A . 22 CYS CA 1 1 4 2219 1 1 22 CYS CB C 1.695 -0.900 -1.292 1.00 . A A . 22 CYS CB 1 1 4 2220 1 1 22 CYS H H 4.400 -0.244 -1.772 1.00 . A A . 22 CYS H 1 1 4 2221 1 1 22 CYS HA H 2.685 -2.609 -2.115 1.00 . A A . 22 CYS HA 1 1 4 2222 1 1 22 CYS HB2 H 0.734 -1.309 -1.565 1.00 . A A . 22 CYS HB2 1 1 4 2223 1 1 22 CYS HB3 H 1.899 -1.136 -0.258 1.00 . A A . 22 CYS HB3 1 1 4 2224 1 1 22 CYS N N 4.096 -1.170 -1.680 1.00 . A A . 22 CYS N 1 1 4 2225 1 1 22 CYS O O 1.998 -1.825 -4.423 1.00 . A A . 22 CYS O 1 1 4 2226 1 1 22 CYS SG S 1.585 0.916 -1.436 1.00 . A A . 22 CYS SG 1 1 4 2227 1 1 23 TRP C C 4.269 0.741 -5.995 1.00 . A A . 23 TRP C 1 1 4 2228 1 1 23 TRP CA C 2.922 0.632 -5.290 1.00 . A A . 23 TRP CA 1 1 4 2229 1 1 23 TRP CB C 2.245 2.001 -5.250 1.00 . A A . 23 TRP CB 1 1 4 2230 1 1 23 TRP CD1 C 0.746 1.345 -7.210 1.00 . A A . 23 TRP CD1 1 1 4 2231 1 1 23 TRP CD2 C 1.138 3.542 -7.054 1.00 . A A . 23 TRP CD2 1 1 4 2232 1 1 23 TRP CE2 C 0.305 3.311 -8.165 1.00 . A A . 23 TRP CE2 1 1 4 2233 1 1 23 TRP CE3 C 1.519 4.853 -6.759 1.00 . A A . 23 TRP CE3 1 1 4 2234 1 1 23 TRP CG C 1.405 2.270 -6.456 1.00 . A A . 23 TRP CG 1 1 4 2235 1 1 23 TRP CH2 C 0.236 5.615 -8.667 1.00 . A A . 23 TRP CH2 1 1 4 2236 1 1 23 TRP CZ2 C -0.152 4.341 -8.978 1.00 . A A . 23 TRP CZ2 1 1 4 2237 1 1 23 TRP CZ3 C 1.065 5.876 -7.570 1.00 . A A . 23 TRP CZ3 1 1 4 2238 1 1 23 TRP H H 3.506 0.639 -3.257 1.00 . A A . 23 TRP H 1 1 4 2239 1 1 23 TRP HA H 2.296 -0.048 -5.848 1.00 . A A . 23 TRP HA 1 1 4 2240 1 1 23 TRP HB2 H 1.610 2.058 -4.379 1.00 . A A . 23 TRP HB2 1 1 4 2241 1 1 23 TRP HB3 H 3.002 2.770 -5.190 1.00 . A A . 23 TRP HB3 1 1 4 2242 1 1 23 TRP HD1 H 0.756 0.284 -7.013 1.00 . A A . 23 TRP HD1 1 1 4 2243 1 1 23 TRP HE1 H -0.467 1.512 -8.915 1.00 . A A . 23 TRP HE1 1 1 4 2244 1 1 23 TRP HE3 H 2.157 5.073 -5.917 1.00 . A A . 23 TRP HE3 1 1 4 2245 1 1 23 TRP HH2 H -0.093 6.443 -9.275 1.00 . A A . 23 TRP HH2 1 1 4 2246 1 1 23 TRP HZ2 H -0.793 4.156 -9.825 1.00 . A A . 23 TRP HZ2 1 1 4 2247 1 1 23 TRP HZ3 H 1.350 6.897 -7.358 1.00 . A A . 23 TRP HZ3 1 1 4 2248 1 1 23 TRP N N 3.061 0.099 -3.942 1.00 . A A . 23 TRP N 1 1 4 2249 1 1 23 TRP NE1 N 0.080 1.963 -8.239 1.00 . A A . 23 TRP NE1 1 1 4 2250 1 1 23 TRP O O 4.546 1.736 -6.664 1.00 . A A . 23 TRP O 1 1 4 2251 1 1 24 LYS C C 6.274 -0.388 -8.005 1.00 . A A . 24 LYS C 1 1 4 2252 1 1 24 LYS CA C 6.410 -0.300 -6.486 1.00 . A A . 24 LYS CA 1 1 4 2253 1 1 24 LYS CB C 7.240 -1.475 -5.964 1.00 . A A . 24 LYS CB 1 1 4 2254 1 1 24 LYS CD C 9.090 -2.987 -6.741 1.00 . A A . 24 LYS CD 1 1 4 2255 1 1 24 LYS CE C 10.036 -3.129 -7.922 1.00 . A A . 24 LYS CE 1 1 4 2256 1 1 24 LYS CG C 8.636 -1.548 -6.562 1.00 . A A . 24 LYS CG 1 1 4 2257 1 1 24 LYS H H 4.819 -1.055 -5.308 1.00 . A A . 24 LYS H 1 1 4 2258 1 1 24 LYS HA H 6.911 0.622 -6.235 1.00 . A A . 24 LYS HA 1 1 4 2259 1 1 24 LYS HB2 H 7.335 -1.384 -4.892 1.00 . A A . 24 LYS HB2 1 1 4 2260 1 1 24 LYS HB3 H 6.724 -2.395 -6.194 1.00 . A A . 24 LYS HB3 1 1 4 2261 1 1 24 LYS HD2 H 9.600 -3.308 -5.845 1.00 . A A . 24 LYS HD2 1 1 4 2262 1 1 24 LYS HD3 H 8.224 -3.610 -6.908 1.00 . A A . 24 LYS HD3 1 1 4 2263 1 1 24 LYS HE2 H 10.512 -2.177 -8.103 1.00 . A A . 24 LYS HE2 1 1 4 2264 1 1 24 LYS HE3 H 10.787 -3.866 -7.679 1.00 . A A . 24 LYS HE3 1 1 4 2265 1 1 24 LYS HG2 H 8.630 -1.060 -7.525 1.00 . A A . 24 LYS HG2 1 1 4 2266 1 1 24 LYS HG3 H 9.326 -1.041 -5.903 1.00 . A A . 24 LYS HG3 1 1 4 2267 1 1 24 LYS HZ1 H 8.445 -4.056 -8.909 1.00 . A A . 24 LYS HZ1 1 1 4 2268 1 1 24 LYS HZ2 H 9.081 -2.724 -9.735 1.00 . A A . 24 LYS HZ2 1 1 4 2269 1 1 24 LYS HZ3 H 9.925 -4.189 -9.719 1.00 . A A . 24 LYS HZ3 1 1 4 2270 1 1 24 LYS N N 5.098 -0.286 -5.850 1.00 . A A . 24 LYS N 1 1 4 2271 1 1 24 LYS NZ N 9.322 -3.554 -9.158 1.00 . A A . 24 LYS NZ 1 1 4 2272 1 1 24 LYS O O 6.654 -1.387 -8.617 1.00 . A A . 24 LYS O 1 1 4 2273 1 1 25 THR C C 6.852 1.014 -10.763 1.00 . A A . 25 THR C 1 1 4 2274 1 1 25 THR CA C 5.538 0.709 -10.053 1.00 . A A . 25 THR CA 1 1 4 2275 1 1 25 THR CB C 4.486 1.759 -10.422 1.00 . A A . 25 THR CB 1 1 4 2276 1 1 25 THR CG2 C 4.889 3.167 -10.046 1.00 . A A . 25 THR CG2 1 1 4 2277 1 1 25 THR H H 5.443 1.430 -8.066 1.00 . A A . 25 THR H 1 1 4 2278 1 1 25 THR HA H 5.189 -0.262 -10.371 1.00 . A A . 25 THR HA 1 1 4 2279 1 1 25 THR HB H 3.564 1.531 -9.904 1.00 . A A . 25 THR HB 1 1 4 2280 1 1 25 THR HG1 H 3.302 1.547 -11.967 1.00 . A A . 25 THR HG1 1 1 4 2281 1 1 25 THR HG21 H 5.738 3.131 -9.381 1.00 . A A . 25 THR HG21 1 1 4 2282 1 1 25 THR HG22 H 5.151 3.717 -10.937 1.00 . A A . 25 THR HG22 1 1 4 2283 1 1 25 THR HG23 H 4.064 3.657 -9.550 1.00 . A A . 25 THR HG23 1 1 4 2284 1 1 25 THR N N 5.727 0.665 -8.607 1.00 . A A . 25 THR N 1 1 4 2285 1 1 25 THR O O 7.867 1.287 -10.123 1.00 . A A . 25 THR O 1 1 4 2286 1 1 25 THR OG1 O 4.229 1.743 -11.815 1.00 . A A . 25 THR OG1 1 1 4 2287 1 1 26 SER C C 8.491 2.663 -12.732 1.00 . A A . 26 SER C 1 1 4 2288 1 1 26 SER CA C 8.014 1.221 -12.893 1.00 . A A . 26 SER CA 1 1 4 2289 1 1 26 SER CB C 7.729 0.931 -14.367 1.00 . A A . 26 SER CB 1 1 4 2290 1 1 26 SER H H 5.985 0.730 -12.539 1.00 . A A . 26 SER H 1 1 4 2291 1 1 26 SER HA H 8.795 0.558 -12.552 1.00 . A A . 26 SER HA 1 1 4 2292 1 1 26 SER HB2 H 8.369 1.545 -14.983 1.00 . A A . 26 SER HB2 1 1 4 2293 1 1 26 SER HB3 H 7.926 -0.112 -14.571 1.00 . A A . 26 SER HB3 1 1 4 2294 1 1 26 SER HG H 6.253 1.132 -15.640 1.00 . A A . 26 SER HG 1 1 4 2295 1 1 26 SER N N 6.825 0.958 -12.089 1.00 . A A . 26 SER N 1 1 4 2296 1 1 26 SER O O 9.652 2.972 -13.000 1.00 . A A . 26 SER O 1 1 4 2297 1 1 26 SER OG O 6.379 1.212 -14.691 1.00 . A A . 26 SER OG 1 1 4 2298 1 1 27 VAL C C 7.470 5.470 -10.758 1.00 . A A . 27 VAL C 1 1 4 2299 1 1 27 VAL CA C 7.940 4.951 -12.115 1.00 . A A . 27 VAL CA 1 1 4 2300 1 1 27 VAL CB C 7.335 5.826 -13.233 1.00 . A A . 27 VAL CB 1 1 4 2301 1 1 27 VAL CG1 C 5.815 5.810 -13.169 1.00 . A A . 27 VAL CG1 1 1 4 2302 1 1 27 VAL CG2 C 7.866 7.249 -13.146 1.00 . A A . 27 VAL CG2 1 1 4 2303 1 1 27 VAL H H 6.682 3.247 -12.104 1.00 . A A . 27 VAL H 1 1 4 2304 1 1 27 VAL HA H 9.016 5.036 -12.167 1.00 . A A . 27 VAL HA 1 1 4 2305 1 1 27 VAL HB H 7.635 5.412 -14.185 1.00 . A A . 27 VAL HB 1 1 4 2306 1 1 27 VAL HG11 H 5.494 6.068 -12.171 1.00 . A A . 27 VAL HG11 1 1 4 2307 1 1 27 VAL HG12 H 5.417 6.526 -13.872 1.00 . A A . 27 VAL HG12 1 1 4 2308 1 1 27 VAL HG13 H 5.454 4.823 -13.418 1.00 . A A . 27 VAL HG13 1 1 4 2309 1 1 27 VAL HG21 H 8.860 7.237 -12.725 1.00 . A A . 27 VAL HG21 1 1 4 2310 1 1 27 VAL HG22 H 7.899 7.682 -14.135 1.00 . A A . 27 VAL HG22 1 1 4 2311 1 1 27 VAL HG23 H 7.215 7.838 -12.516 1.00 . A A . 27 VAL HG23 1 1 4 2312 1 1 27 VAL N N 7.594 3.545 -12.299 1.00 . A A . 27 VAL N 1 1 4 2313 1 1 27 VAL O O 7.089 6.633 -10.625 1.00 . A A . 27 VAL O 1 1 4 2314 1 1 28 SER C C 7.159 3.789 -7.453 1.00 . A A . 28 SER C 1 1 4 2315 1 1 28 SER CA C 7.081 4.979 -8.404 1.00 . A A . 28 SER CA 1 1 4 2316 1 1 28 SER CB C 5.654 5.536 -8.423 1.00 . A A . 28 SER CB 1 1 4 2317 1 1 28 SER H H 7.816 3.689 -9.916 1.00 . A A . 28 SER H 1 1 4 2318 1 1 28 SER HA H 7.752 5.749 -8.052 1.00 . A A . 28 SER HA 1 1 4 2319 1 1 28 SER HB2 H 5.381 5.788 -9.437 1.00 . A A . 28 SER HB2 1 1 4 2320 1 1 28 SER HB3 H 4.972 4.790 -8.042 1.00 . A A . 28 SER HB3 1 1 4 2321 1 1 28 SER HG H 5.682 6.469 -6.700 1.00 . A A . 28 SER HG 1 1 4 2322 1 1 28 SER N N 7.501 4.603 -9.751 1.00 . A A . 28 SER N 1 1 4 2323 1 1 28 SER O O 7.421 2.661 -7.873 1.00 . A A . 28 SER O 1 1 4 2324 1 1 28 SER OG O 5.550 6.701 -7.622 1.00 . A A . 28 SER OG 1 1 4 2325 1 1 29 SER C C 6.643 3.571 -3.780 1.00 . A A . 29 SER C 1 1 4 2326 1 1 29 SER CA C 6.971 3.002 -5.155 1.00 . A A . 29 SER CA 1 1 4 2327 1 1 29 SER CB C 8.348 2.337 -5.131 1.00 . A A . 29 SER CB 1 1 4 2328 1 1 29 SER H H 6.724 4.968 -5.899 1.00 . A A . 29 SER H 1 1 4 2329 1 1 29 SER HA H 6.226 2.262 -5.411 1.00 . A A . 29 SER HA 1 1 4 2330 1 1 29 SER HB2 H 8.384 1.617 -4.327 1.00 . A A . 29 SER HB2 1 1 4 2331 1 1 29 SER HB3 H 8.520 1.834 -6.071 1.00 . A A . 29 SER HB3 1 1 4 2332 1 1 29 SER HG H 9.517 3.418 -3.989 1.00 . A A . 29 SER HG 1 1 4 2333 1 1 29 SER N N 6.929 4.048 -6.170 1.00 . A A . 29 SER N 1 1 4 2334 1 1 29 SER O O 7.362 4.425 -3.262 1.00 . A A . 29 SER O 1 1 4 2335 1 1 29 SER OG O 9.374 3.294 -4.930 1.00 . A A . 29 SER OG 1 1 4 2336 1 1 30 HIS C C 5.051 2.401 -0.893 1.00 . A A . 30 HIS C 1 1 4 2337 1 1 30 HIS CA C 5.120 3.558 -1.882 1.00 . A A . 30 HIS CA 1 1 4 2338 1 1 30 HIS CB C 3.756 4.241 -1.985 1.00 . A A . 30 HIS CB 1 1 4 2339 1 1 30 HIS CD2 C 4.084 5.226 -4.363 1.00 . A A . 30 HIS CD2 1 1 4 2340 1 1 30 HIS CE1 C 3.215 7.207 -4.013 1.00 . A A . 30 HIS CE1 1 1 4 2341 1 1 30 HIS CG C 3.683 5.270 -3.070 1.00 . A A . 30 HIS CG 1 1 4 2342 1 1 30 HIS H H 5.015 2.417 -3.661 1.00 . A A . 30 HIS H 1 1 4 2343 1 1 30 HIS HA H 5.846 4.275 -1.529 1.00 . A A . 30 HIS HA 1 1 4 2344 1 1 30 HIS HB2 H 3.001 3.495 -2.184 1.00 . A A . 30 HIS HB2 1 1 4 2345 1 1 30 HIS HB3 H 3.534 4.729 -1.047 1.00 . A A . 30 HIS HB3 1 1 4 2346 1 1 30 HIS HD1 H 2.764 6.865 -2.046 1.00 . A A . 30 HIS HD1 1 1 4 2347 1 1 30 HIS HD2 H 4.554 4.390 -4.860 1.00 . A A . 30 HIS HD2 1 1 4 2348 1 1 30 HIS HE1 H 2.868 8.217 -4.164 1.00 . A A . 30 HIS HE1 1 1 4 2349 1 1 30 HIS HE2 H 3.873 6.668 -5.875 1.00 . A A . 30 HIS HE2 1 1 4 2350 1 1 30 HIS N N 5.549 3.095 -3.196 1.00 . A A . 30 HIS N 1 1 4 2351 1 1 30 HIS ND1 N 3.143 6.525 -2.883 1.00 . A A . 30 HIS ND1 1 1 4 2352 1 1 30 HIS NE2 N 3.782 6.441 -4.925 1.00 . A A . 30 HIS NE2 1 1 4 2353 1 1 30 HIS O O 4.941 1.240 -1.287 1.00 . A A . 30 HIS O 1 1 4 2354 1 1 31 TYR C C 3.696 1.707 2.122 1.00 . A A . 31 TYR C 1 1 4 2355 1 1 31 TYR CA C 5.060 1.710 1.440 1.00 . A A . 31 TYR CA 1 1 4 2356 1 1 31 TYR CB C 6.159 1.956 2.476 1.00 . A A . 31 TYR CB 1 1 4 2357 1 1 31 TYR CD1 C 8.208 0.640 3.141 1.00 . A A . 31 TYR CD1 1 1 4 2358 1 1 31 TYR CD2 C 7.960 1.254 0.851 1.00 . A A . 31 TYR CD2 1 1 4 2359 1 1 31 TYR CE1 C 9.404 0.013 2.848 1.00 . A A . 31 TYR CE1 1 1 4 2360 1 1 31 TYR CE2 C 9.154 0.628 0.550 1.00 . A A . 31 TYR CE2 1 1 4 2361 1 1 31 TYR CG C 7.466 1.270 2.150 1.00 . A A . 31 TYR CG 1 1 4 2362 1 1 31 TYR CZ C 9.872 0.009 1.551 1.00 . A A . 31 TYR CZ 1 1 4 2363 1 1 31 TYR H H 5.203 3.667 0.647 1.00 . A A . 31 TYR H 1 1 4 2364 1 1 31 TYR HA H 5.222 0.747 0.979 1.00 . A A . 31 TYR HA 1 1 4 2365 1 1 31 TYR HB2 H 6.349 3.016 2.543 1.00 . A A . 31 TYR HB2 1 1 4 2366 1 1 31 TYR HB3 H 5.824 1.594 3.438 1.00 . A A . 31 TYR HB3 1 1 4 2367 1 1 31 TYR HD1 H 7.838 0.644 4.156 1.00 . A A . 31 TYR HD1 1 1 4 2368 1 1 31 TYR HD2 H 7.395 1.740 0.069 1.00 . A A . 31 TYR HD2 1 1 4 2369 1 1 31 TYR HE1 H 9.965 -0.472 3.632 1.00 . A A . 31 TYR HE1 1 1 4 2370 1 1 31 TYR HE2 H 9.521 0.626 -0.466 1.00 . A A . 31 TYR HE2 1 1 4 2371 1 1 31 TYR HH H 11.782 0.017 1.327 1.00 . A A . 31 TYR HH 1 1 4 2372 1 1 31 TYR N N 5.116 2.724 0.394 1.00 . A A . 31 TYR N 1 1 4 2373 1 1 31 TYR O O 3.203 2.751 2.549 1.00 . A A . 31 TYR O 1 1 4 2374 1 1 31 TYR OH O 11.063 -0.614 1.255 1.00 . A A . 31 TYR OH 1 1 4 2375 1 1 32 CYS C C 1.886 0.628 4.356 1.00 . A A . 32 CYS C 1 1 4 2376 1 1 32 CYS CA C 1.784 0.394 2.854 1.00 . A A . 32 CYS CA 1 1 4 2377 1 1 32 CYS CB C 1.195 -0.992 2.581 1.00 . A A . 32 CYS CB 1 1 4 2378 1 1 32 CYS H H 3.532 -0.270 1.864 1.00 . A A . 32 CYS H 1 1 4 2379 1 1 32 CYS HA H 1.133 1.142 2.429 1.00 . A A . 32 CYS HA 1 1 4 2380 1 1 32 CYS HB2 H 1.645 -1.396 1.687 1.00 . A A . 32 CYS HB2 1 1 4 2381 1 1 32 CYS HB3 H 1.420 -1.640 3.415 1.00 . A A . 32 CYS HB3 1 1 4 2382 1 1 32 CYS N N 3.090 0.528 2.221 1.00 . A A . 32 CYS N 1 1 4 2383 1 1 32 CYS O O 2.935 0.403 4.959 1.00 . A A . 32 CYS O 1 1 4 2384 1 1 32 CYS SG S -0.613 -1.002 2.343 1.00 . A A . 32 CYS SG 1 1 4 2385 1 1 33 THR C C -0.017 0.249 7.122 1.00 . A A . 33 THR C 1 1 4 2386 1 1 33 THR CA C 0.757 1.340 6.388 1.00 . A A . 33 THR CA 1 1 4 2387 1 1 33 THR CB C 0.124 2.704 6.665 1.00 . A A . 33 THR CB 1 1 4 2388 1 1 33 THR CG2 C 0.642 3.800 5.759 1.00 . A A . 33 THR CG2 1 1 4 2389 1 1 33 THR H H -0.016 1.237 4.422 1.00 . A A . 33 THR H 1 1 4 2390 1 1 33 THR HA H 1.775 1.345 6.748 1.00 . A A . 33 THR HA 1 1 4 2391 1 1 33 THR HB H 0.340 2.989 7.685 1.00 . A A . 33 THR HB 1 1 4 2392 1 1 33 THR HG1 H -1.662 3.506 6.701 1.00 . A A . 33 THR HG1 1 1 4 2393 1 1 33 THR HG21 H 1.719 3.846 5.828 1.00 . A A . 33 THR HG21 1 1 4 2394 1 1 33 THR HG22 H 0.356 3.589 4.739 1.00 . A A . 33 THR HG22 1 1 4 2395 1 1 33 THR HG23 H 0.222 4.747 6.062 1.00 . A A . 33 THR HG23 1 1 4 2396 1 1 33 THR N N 0.790 1.079 4.955 1.00 . A A . 33 THR N 1 1 4 2397 1 1 33 THR O O -0.455 0.442 8.256 1.00 . A A . 33 THR O 1 1 4 2398 1 1 33 THR OG1 O -1.282 2.646 6.508 1.00 . A A . 33 THR OG1 1 1 4 2399 1 1 34 GLY C C -2.218 -1.578 7.708 1.00 . A A . 34 GLY C 1 1 4 2400 1 1 34 GLY CA C -0.905 -2.007 7.076 1.00 . A A . 34 GLY CA 1 1 4 2401 1 1 34 GLY H H 0.191 -1.000 5.565 1.00 . A A . 34 GLY H 1 1 4 2402 1 1 34 GLY HA2 H -0.282 -2.453 7.837 1.00 . A A . 34 GLY HA2 1 1 4 2403 1 1 34 GLY HA3 H -1.111 -2.747 6.318 1.00 . A A . 34 GLY HA3 1 1 4 2404 1 1 34 GLY N N -0.183 -0.901 6.468 1.00 . A A . 34 GLY N 1 1 4 2405 1 1 34 GLY O O -2.585 -2.061 8.779 1.00 . A A . 34 GLY O 1 1 4 2406 1 1 35 ARG C C -5.238 -0.098 6.438 1.00 . A A . 35 ARG C 1 1 4 2407 1 1 35 ARG CA C -4.201 -0.176 7.552 1.00 . A A . 35 ARG CA 1 1 4 2408 1 1 35 ARG CB C -4.022 1.200 8.195 1.00 . A A . 35 ARG CB 1 1 4 2409 1 1 35 ARG CD C -3.943 1.048 10.701 1.00 . A A . 35 ARG CD 1 1 4 2410 1 1 35 ARG CG C -3.130 1.186 9.424 1.00 . A A . 35 ARG CG 1 1 4 2411 1 1 35 ARG CZ C -3.501 0.522 13.068 1.00 . A A . 35 ARG CZ 1 1 4 2412 1 1 35 ARG H H -2.580 -0.319 6.197 1.00 . A A . 35 ARG H 1 1 4 2413 1 1 35 ARG HA H -4.549 -0.868 8.298 1.00 . A A . 35 ARG HA 1 1 4 2414 1 1 35 ARG HB2 H -3.587 1.870 7.468 1.00 . A A . 35 ARG HB2 1 1 4 2415 1 1 35 ARG HB3 H -4.992 1.579 8.484 1.00 . A A . 35 ARG HB3 1 1 4 2416 1 1 35 ARG HD2 H -4.600 1.900 10.788 1.00 . A A . 35 ARG HD2 1 1 4 2417 1 1 35 ARG HD3 H -4.532 0.145 10.642 1.00 . A A . 35 ARG HD3 1 1 4 2418 1 1 35 ARG HE H -2.169 1.300 11.801 1.00 . A A . 35 ARG HE 1 1 4 2419 1 1 35 ARG HG2 H -2.448 0.352 9.353 1.00 . A A . 35 ARG HG2 1 1 4 2420 1 1 35 ARG HG3 H -2.570 2.109 9.462 1.00 . A A . 35 ARG HG3 1 1 4 2421 1 1 35 ARG HH11 H -5.381 0.100 12.453 1.00 . A A . 35 ARG HH11 1 1 4 2422 1 1 35 ARG HH12 H -5.044 -0.261 14.113 1.00 . A A . 35 ARG HH12 1 1 4 2423 1 1 35 ARG HH21 H -1.725 0.826 13.983 1.00 . A A . 35 ARG HH21 1 1 4 2424 1 1 35 ARG HH22 H -2.969 0.152 14.982 1.00 . A A . 35 ARG HH22 1 1 4 2425 1 1 35 ARG N N -2.925 -0.668 7.045 1.00 . A A . 35 ARG N 1 1 4 2426 1 1 35 ARG NE N -3.093 0.983 11.888 1.00 . A A . 35 ARG NE 1 1 4 2427 1 1 35 ARG NH1 N -4.744 0.085 13.224 1.00 . A A . 35 ARG NH1 1 1 4 2428 1 1 35 ARG NH2 N -2.663 0.498 14.095 1.00 . A A . 35 ARG NH2 1 1 4 2429 1 1 35 ARG O O -6.307 -0.702 6.525 1.00 . A A . 35 ARG O 1 1 4 2430 1 1 36 SER C C -5.194 0.215 2.994 1.00 . A A . 36 SER C 1 1 4 2431 1 1 36 SER CA C -5.809 0.812 4.255 1.00 . A A . 36 SER CA 1 1 4 2432 1 1 36 SER CB C -6.122 2.293 4.032 1.00 . A A . 36 SER CB 1 1 4 2433 1 1 36 SER H H -4.044 1.102 5.388 1.00 . A A . 36 SER H 1 1 4 2434 1 1 36 SER HA H -6.726 0.288 4.476 1.00 . A A . 36 SER HA 1 1 4 2435 1 1 36 SER HB2 H -6.177 2.794 4.987 1.00 . A A . 36 SER HB2 1 1 4 2436 1 1 36 SER HB3 H -5.339 2.738 3.436 1.00 . A A . 36 SER HB3 1 1 4 2437 1 1 36 SER HG H -7.981 2.904 3.938 1.00 . A A . 36 SER HG 1 1 4 2438 1 1 36 SER N N -4.912 0.649 5.393 1.00 . A A . 36 SER N 1 1 4 2439 1 1 36 SER O O -4.027 -0.177 2.989 1.00 . A A . 36 SER O 1 1 4 2440 1 1 36 SER OG O -7.358 2.458 3.359 1.00 . A A . 36 SER OG 1 1 4 2441 1 1 37 CYS C C -5.204 0.702 -0.342 1.00 . A A . 37 CYS C 1 1 4 2442 1 1 37 CYS CA C -5.504 -0.405 0.666 1.00 . A A . 37 CYS CA 1 1 4 2443 1 1 37 CYS CB C -6.533 -1.372 0.083 1.00 . A A . 37 CYS CB 1 1 4 2444 1 1 37 CYS H H -6.905 0.474 1.986 1.00 . A A . 37 CYS H 1 1 4 2445 1 1 37 CYS HA H -4.593 -0.945 0.869 1.00 . A A . 37 CYS HA 1 1 4 2446 1 1 37 CYS HB2 H -7.314 -0.803 -0.398 1.00 . A A . 37 CYS HB2 1 1 4 2447 1 1 37 CYS HB3 H -6.049 -1.999 -0.650 1.00 . A A . 37 CYS HB3 1 1 4 2448 1 1 37 CYS N N -5.982 0.147 1.926 1.00 . A A . 37 CYS N 1 1 4 2449 1 1 37 CYS O O -5.101 0.448 -1.542 1.00 . A A . 37 CYS O 1 1 4 2450 1 1 37 CYS SG S -7.321 -2.462 1.315 1.00 . A A . 37 CYS SG 1 1 4 2451 1 1 38 GLU C C -3.333 3.545 -0.520 1.00 . A A . 38 GLU C 1 1 4 2452 1 1 38 GLU CA C -4.770 3.068 -0.713 1.00 . A A . 38 GLU CA 1 1 4 2453 1 1 38 GLU CB C -5.743 4.213 -0.427 1.00 . A A . 38 GLU CB 1 1 4 2454 1 1 38 GLU CD C -6.547 5.521 -2.432 1.00 . A A . 38 GLU CD 1 1 4 2455 1 1 38 GLU CG C -5.529 5.430 -1.313 1.00 . A A . 38 GLU CG 1 1 4 2456 1 1 38 GLU H H -5.153 2.071 1.115 1.00 . A A . 38 GLU H 1 1 4 2457 1 1 38 GLU HA H -4.896 2.749 -1.737 1.00 . A A . 38 GLU HA 1 1 4 2458 1 1 38 GLU HB2 H -6.752 3.859 -0.576 1.00 . A A . 38 GLU HB2 1 1 4 2459 1 1 38 GLU HB3 H -5.627 4.520 0.603 1.00 . A A . 38 GLU HB3 1 1 4 2460 1 1 38 GLU HG2 H -5.603 6.319 -0.706 1.00 . A A . 38 GLU HG2 1 1 4 2461 1 1 38 GLU HG3 H -4.541 5.373 -1.747 1.00 . A A . 38 GLU HG3 1 1 4 2462 1 1 38 GLU N N -5.061 1.929 0.150 1.00 . A A . 38 GLU N 1 1 4 2463 1 1 38 GLU O O -3.013 4.189 0.478 1.00 . A A . 38 GLU O 1 1 4 2464 1 1 38 GLU OE1 O -7.754 5.369 -2.151 1.00 . A A . 38 GLU OE1 1 1 4 2465 1 1 38 GLU OE2 O -6.136 5.745 -3.591 1.00 . A A . 38 GLU OE2 1 1 4 2466 1 1 39 CYS C C -0.937 5.145 -1.427 1.00 . A A . 39 CYS C 1 1 4 2467 1 1 39 CYS CA C -1.070 3.622 -1.414 1.00 . A A . 39 CYS CA 1 1 4 2468 1 1 39 CYS CB C -0.287 3.020 -2.584 1.00 . A A . 39 CYS CB 1 1 4 2469 1 1 39 CYS H H -2.786 2.709 -2.254 1.00 . A A . 39 CYS H 1 1 4 2470 1 1 39 CYS HA H -0.665 3.242 -0.488 1.00 . A A . 39 CYS HA 1 1 4 2471 1 1 39 CYS HB2 H -0.792 3.263 -3.509 1.00 . A A . 39 CYS HB2 1 1 4 2472 1 1 39 CYS HB3 H 0.706 3.446 -2.601 1.00 . A A . 39 CYS HB3 1 1 4 2473 1 1 39 CYS N N -2.472 3.224 -1.481 1.00 . A A . 39 CYS N 1 1 4 2474 1 1 39 CYS O O -1.574 5.822 -2.234 1.00 . A A . 39 CYS O 1 1 4 2475 1 1 39 CYS SG S -0.114 1.207 -2.509 1.00 . A A . 39 CYS SG 1 1 4 2476 1 1 40 PRO C C 0.467 7.766 -1.798 1.00 . A A . 40 PRO C 1 1 4 2477 1 1 40 PRO CA C 0.099 7.159 -0.449 1.00 . A A . 40 PRO CA 1 1 4 2478 1 1 40 PRO CB C 1.261 7.301 0.535 1.00 . A A . 40 PRO CB 1 1 4 2479 1 1 40 PRO CD C 0.694 4.981 0.474 1.00 . A A . 40 PRO CD 1 1 4 2480 1 1 40 PRO CG C 1.199 6.073 1.375 1.00 . A A . 40 PRO CG 1 1 4 2481 1 1 40 PRO HA H -0.773 7.661 -0.057 1.00 . A A . 40 PRO HA 1 1 4 2482 1 1 40 PRO HB2 H 2.192 7.362 -0.009 1.00 . A A . 40 PRO HB2 1 1 4 2483 1 1 40 PRO HB3 H 1.126 8.192 1.130 1.00 . A A . 40 PRO HB3 1 1 4 2484 1 1 40 PRO HD2 H 1.520 4.464 0.007 1.00 . A A . 40 PRO HD2 1 1 4 2485 1 1 40 PRO HD3 H 0.079 4.288 1.029 1.00 . A A . 40 PRO HD3 1 1 4 2486 1 1 40 PRO HG2 H 2.185 5.830 1.743 1.00 . A A . 40 PRO HG2 1 1 4 2487 1 1 40 PRO HG3 H 0.517 6.225 2.198 1.00 . A A . 40 PRO HG3 1 1 4 2488 1 1 40 PRO N N -0.107 5.708 -0.529 1.00 . A A . 40 PRO N 1 1 4 2489 1 1 40 PRO O O 0.600 7.056 -2.795 1.00 . A A . 40 PRO O 1 1 4 2490 1 1 41 SER C C 2.410 10.332 -2.973 1.00 . A A . 41 SER C 1 1 4 2491 1 1 41 SER CA C 0.987 9.788 -3.049 1.00 . A A . 41 SER CA 1 1 4 2492 1 1 41 SER CB C 0.004 10.932 -3.309 1.00 . A A . 41 SER CB 1 1 4 2493 1 1 41 SER H H 0.513 9.596 -0.994 1.00 . A A . 41 SER H 1 1 4 2494 1 1 41 SER HA H 0.928 9.082 -3.864 1.00 . A A . 41 SER HA 1 1 4 2495 1 1 41 SER HB2 H 0.429 11.857 -2.949 1.00 . A A . 41 SER HB2 1 1 4 2496 1 1 41 SER HB3 H -0.181 11.010 -4.370 1.00 . A A . 41 SER HB3 1 1 4 2497 1 1 41 SER HG H -1.323 11.336 -1.926 1.00 . A A . 41 SER HG 1 1 4 2498 1 1 41 SER N N 0.632 9.085 -1.822 1.00 . A A . 41 SER N 1 1 4 2499 1 1 41 SER O O 2.725 11.362 -3.569 1.00 . A A . 41 SER O 1 1 4 2500 1 1 41 SER OG O -1.227 10.707 -2.645 1.00 . A A . 41 SER OG 1 1 4 2501 1 1 42 TYR C C 5.539 8.836 -1.744 1.00 . A A . 42 TYR C 1 1 4 2502 1 1 42 TYR CA C 4.658 10.036 -2.087 1.00 . A A . 42 TYR CA 1 1 4 2503 1 1 42 TYR CB C 4.784 11.109 -1.002 1.00 . A A . 42 TYR CB 1 1 4 2504 1 1 42 TYR CD1 C 3.281 10.798 1.004 1.00 . A A . 42 TYR CD1 1 1 4 2505 1 1 42 TYR CD2 C 5.493 9.914 1.106 1.00 . A A . 42 TYR CD2 1 1 4 2506 1 1 42 TYR CE1 C 3.032 10.332 2.281 1.00 . A A . 42 TYR CE1 1 1 4 2507 1 1 42 TYR CE2 C 5.251 9.444 2.383 1.00 . A A . 42 TYR CE2 1 1 4 2508 1 1 42 TYR CG C 4.514 10.597 0.396 1.00 . A A . 42 TYR CG 1 1 4 2509 1 1 42 TYR CZ C 4.019 9.656 2.966 1.00 . A A . 42 TYR CZ 1 1 4 2510 1 1 42 TYR H H 2.956 8.816 -1.790 1.00 . A A . 42 TYR H 1 1 4 2511 1 1 42 TYR HA H 4.985 10.450 -3.029 1.00 . A A . 42 TYR HA 1 1 4 2512 1 1 42 TYR HB2 H 5.786 11.511 -1.019 1.00 . A A . 42 TYR HB2 1 1 4 2513 1 1 42 TYR HB3 H 4.080 11.902 -1.208 1.00 . A A . 42 TYR HB3 1 1 4 2514 1 1 42 TYR HD1 H 2.510 11.328 0.465 1.00 . A A . 42 TYR HD1 1 1 4 2515 1 1 42 TYR HD2 H 6.456 9.750 0.647 1.00 . A A . 42 TYR HD2 1 1 4 2516 1 1 42 TYR HE1 H 2.067 10.498 2.737 1.00 . A A . 42 TYR HE1 1 1 4 2517 1 1 42 TYR HE2 H 6.025 8.915 2.918 1.00 . A A . 42 TYR HE2 1 1 4 2518 1 1 42 TYR HH H 3.455 8.286 4.191 1.00 . A A . 42 TYR HH 1 1 4 2519 1 1 42 TYR N N 3.267 9.629 -2.239 1.00 . A A . 42 TYR N 1 1 4 2520 1 1 42 TYR O O 5.113 7.929 -1.028 1.00 . A A . 42 TYR O 1 1 4 2521 1 1 42 TYR OH O 3.775 9.190 4.237 1.00 . A A . 42 TYR OH 1 1 4 2522 1 1 43 PRO C C 8.256 7.733 -0.566 1.00 . A A . 43 PRO C 1 1 4 2523 1 1 43 PRO CA C 7.719 7.713 -1.993 1.00 . A A . 43 PRO CA 1 1 4 2524 1 1 43 PRO CB C 8.846 7.969 -2.993 1.00 . A A . 43 PRO CB 1 1 4 2525 1 1 43 PRO CD C 7.375 9.850 -3.117 1.00 . A A . 43 PRO CD 1 1 4 2526 1 1 43 PRO CG C 8.820 9.441 -3.218 1.00 . A A . 43 PRO CG 1 1 4 2527 1 1 43 PRO HA H 7.266 6.753 -2.193 1.00 . A A . 43 PRO HA 1 1 4 2528 1 1 43 PRO HB2 H 9.787 7.648 -2.570 1.00 . A A . 43 PRO HB2 1 1 4 2529 1 1 43 PRO HB3 H 8.651 7.427 -3.907 1.00 . A A . 43 PRO HB3 1 1 4 2530 1 1 43 PRO HD2 H 7.291 10.826 -2.661 1.00 . A A . 43 PRO HD2 1 1 4 2531 1 1 43 PRO HD3 H 6.914 9.847 -4.093 1.00 . A A . 43 PRO HD3 1 1 4 2532 1 1 43 PRO HG2 H 9.404 9.938 -2.457 1.00 . A A . 43 PRO HG2 1 1 4 2533 1 1 43 PRO HG3 H 9.206 9.670 -4.199 1.00 . A A . 43 PRO HG3 1 1 4 2534 1 1 43 PRO N N 6.783 8.812 -2.252 1.00 . A A . 43 PRO N 1 1 4 2535 1 1 43 PRO O O 8.586 8.791 -0.031 1.00 . A A . 43 PRO O 1 1 4 2536 1 1 44 GLY C C 10.255 6.983 1.541 1.00 . A A . 44 GLY C 1 1 4 2537 1 1 44 GLY CA C 8.839 6.461 1.405 1.00 . A A . 44 GLY CA 1 1 4 2538 1 1 44 GLY H H 8.063 5.746 -0.431 1.00 . A A . 44 GLY H 1 1 4 2539 1 1 44 GLY HA2 H 8.817 5.426 1.713 1.00 . A A . 44 GLY HA2 1 1 4 2540 1 1 44 GLY HA3 H 8.192 7.032 2.054 1.00 . A A . 44 GLY HA3 1 1 4 2541 1 1 44 GLY N N 8.341 6.556 0.045 1.00 . A A . 44 GLY N 1 1 4 2542 1 1 44 GLY O O 10.887 7.351 0.551 1.00 . A A . 44 GLY O 1 1 4 2543 1 1 45 ASN C C 12.264 8.948 2.589 1.00 . A A . 45 ASN C 1 1 4 2544 1 1 45 ASN CA C 12.107 7.498 3.036 1.00 . A A . 45 ASN CA 1 1 4 2545 1 1 45 ASN CB C 13.133 6.617 2.321 1.00 . A A . 45 ASN CB 1 1 4 2546 1 1 45 ASN CG C 13.211 5.224 2.913 1.00 . A A . 45 ASN CG 1 1 4 2547 1 1 45 ASN H H 10.203 6.710 3.521 1.00 . A A . 45 ASN H 1 1 4 2548 1 1 45 ASN HA H 12.277 7.442 4.100 1.00 . A A . 45 ASN HA 1 1 4 2549 1 1 45 ASN HB2 H 12.861 6.530 1.280 1.00 . A A . 45 ASN HB2 1 1 4 2550 1 1 45 ASN HB3 H 14.107 7.077 2.397 1.00 . A A . 45 ASN HB3 1 1 4 2551 1 1 45 ASN HD21 H 12.936 4.418 1.116 1.00 . A A . 45 ASN HD21 1 1 4 2552 1 1 45 ASN HD22 H 13.122 3.300 2.420 1.00 . A A . 45 ASN HD22 1 1 4 2553 1 1 45 ASN N N 10.755 7.017 2.772 1.00 . A A . 45 ASN N 1 1 4 2554 1 1 45 ASN ND2 N 13.076 4.212 2.064 1.00 . A A . 45 ASN ND2 1 1 4 2555 1 1 45 ASN O O 12.824 9.224 1.528 1.00 . A A . 45 ASN O 1 1 4 2556 1 1 45 ASN OD1 O 13.390 5.059 4.120 1.00 . A A . 45 ASN OD1 1 1 4 2557 1 1 46 GLY C C 11.105 12.158 4.055 1.00 . A A . 46 GLY C 1 1 4 2558 1 1 46 GLY CA C 11.862 11.281 3.077 1.00 . A A . 46 GLY CA 1 1 4 2559 1 1 46 GLY H H 11.331 9.592 4.238 1.00 . A A . 46 GLY H 1 1 4 2560 1 1 46 GLY HA2 H 11.461 11.437 2.086 1.00 . A A . 46 GLY HA2 1 1 4 2561 1 1 46 GLY HA3 H 12.903 11.571 3.081 1.00 . A A . 46 GLY HA3 1 1 4 2562 1 1 46 GLY N N 11.767 9.871 3.405 1.00 . A A . 46 GLY N 1 1 4 2563 1 1 46 GLY O O 9.994 11.764 4.468 1.00 . A A . 46 GLY O 1 1 4 2564 1 1 46 GLY OXT O 11.623 13.238 4.408 1.00 . A A . 46 GLY OXT 1 1 5 2565 1 1 1 ALA C C -13.684 -5.326 8.875 1.00 . A A . 1 ALA C 1 1 5 2566 1 1 1 ALA CA C -13.913 -6.780 9.273 1.00 . A A . 1 ALA CA 1 1 5 2567 1 1 1 ALA CB C -15.186 -6.907 10.095 1.00 . A A . 1 ALA CB 1 1 5 2568 1 1 1 ALA H1 H -12.453 -6.583 10.709 1.00 . A A . 1 ALA H1 1 1 5 2569 1 1 1 ALA H2 H -13.068 -8.175 10.527 1.00 . A A . 1 ALA H2 1 1 5 2570 1 1 1 ALA H3 H -11.998 -7.526 9.352 1.00 . A A . 1 ALA H3 1 1 5 2571 1 1 1 ALA HA H -14.033 -7.372 8.377 1.00 . A A . 1 ALA HA 1 1 5 2572 1 1 1 ALA HB1 H -15.535 -7.929 10.064 1.00 . A A . 1 ALA HB1 1 1 5 2573 1 1 1 ALA HB2 H -14.984 -6.627 11.118 1.00 . A A . 1 ALA HB2 1 1 5 2574 1 1 1 ALA HB3 H -15.945 -6.256 9.687 1.00 . A A . 1 ALA HB3 1 1 5 2575 1 1 1 ALA N N -12.754 -7.314 10.034 1.00 . A A . 1 ALA N 1 1 5 2576 1 1 1 ALA O O -14.629 -4.545 8.768 1.00 . A A . 1 ALA O 1 1 5 2577 1 1 2 MET C C -12.662 -3.258 6.909 1.00 . A A . 2 MET C 1 1 5 2578 1 1 2 MET CA C -12.069 -3.608 8.271 1.00 . A A . 2 MET CA 1 1 5 2579 1 1 2 MET CB C -10.549 -3.444 8.235 1.00 . A A . 2 MET CB 1 1 5 2580 1 1 2 MET CE C -9.039 -1.881 10.975 1.00 . A A . 2 MET CE 1 1 5 2581 1 1 2 MET CG C -9.844 -4.044 9.441 1.00 . A A . 2 MET CG 1 1 5 2582 1 1 2 MET H H -11.712 -5.637 8.758 1.00 . A A . 2 MET H 1 1 5 2583 1 1 2 MET HA H -12.478 -2.937 9.011 1.00 . A A . 2 MET HA 1 1 5 2584 1 1 2 MET HB2 H -10.167 -3.925 7.347 1.00 . A A . 2 MET HB2 1 1 5 2585 1 1 2 MET HB3 H -10.313 -2.391 8.195 1.00 . A A . 2 MET HB3 1 1 5 2586 1 1 2 MET HE1 H -10.016 -1.593 10.617 1.00 . A A . 2 MET HE1 1 1 5 2587 1 1 2 MET HE2 H -9.124 -2.275 11.978 1.00 . A A . 2 MET HE2 1 1 5 2588 1 1 2 MET HE3 H -8.389 -1.019 10.982 1.00 . A A . 2 MET HE3 1 1 5 2589 1 1 2 MET HG2 H -10.524 -4.035 10.280 1.00 . A A . 2 MET HG2 1 1 5 2590 1 1 2 MET HG3 H -9.572 -5.064 9.212 1.00 . A A . 2 MET HG3 1 1 5 2591 1 1 2 MET N N -12.423 -4.969 8.657 1.00 . A A . 2 MET N 1 1 5 2592 1 1 2 MET O O -13.300 -4.091 6.266 1.00 . A A . 2 MET O 1 1 5 2593 1 1 2 MET SD S -8.354 -3.137 9.897 1.00 . A A . 2 MET SD 1 1 5 2594 1 1 3 ASP C C -11.844 -1.501 4.151 1.00 . A A . 3 ASP C 1 1 5 2595 1 1 3 ASP CA C -12.958 -1.560 5.191 1.00 . A A . 3 ASP CA 1 1 5 2596 1 1 3 ASP CB C -13.605 -0.182 5.341 1.00 . A A . 3 ASP CB 1 1 5 2597 1 1 3 ASP CG C -15.064 -0.270 5.744 1.00 . A A . 3 ASP CG 1 1 5 2598 1 1 3 ASP H H -11.929 -1.402 7.034 1.00 . A A . 3 ASP H 1 1 5 2599 1 1 3 ASP HA H -13.706 -2.265 4.861 1.00 . A A . 3 ASP HA 1 1 5 2600 1 1 3 ASP HB2 H -13.075 0.378 6.097 1.00 . A A . 3 ASP HB2 1 1 5 2601 1 1 3 ASP HB3 H -13.541 0.343 4.399 1.00 . A A . 3 ASP HB3 1 1 5 2602 1 1 3 ASP N N -12.445 -2.020 6.476 1.00 . A A . 3 ASP N 1 1 5 2603 1 1 3 ASP O O -11.320 -0.430 3.847 1.00 . A A . 3 ASP O 1 1 5 2604 1 1 3 ASP OD1 O -15.472 0.473 6.662 1.00 . A A . 3 ASP OD1 1 1 5 2605 1 1 3 ASP OD2 O -15.799 -1.080 5.141 1.00 . A A . 3 ASP OD2 1 1 5 2606 1 1 4 CYS C C -10.751 -1.866 1.397 1.00 . A A . 4 CYS C 1 1 5 2607 1 1 4 CYS CA C -10.434 -2.742 2.601 1.00 . A A . 4 CYS CA 1 1 5 2608 1 1 4 CYS CB C -10.236 -4.182 2.146 1.00 . A A . 4 CYS CB 1 1 5 2609 1 1 4 CYS H H -11.941 -3.481 3.892 1.00 . A A . 4 CYS H 1 1 5 2610 1 1 4 CYS HA H -9.514 -2.399 3.050 1.00 . A A . 4 CYS HA 1 1 5 2611 1 1 4 CYS HB2 H -9.635 -4.182 1.250 1.00 . A A . 4 CYS HB2 1 1 5 2612 1 1 4 CYS HB3 H -9.718 -4.720 2.921 1.00 . A A . 4 CYS HB3 1 1 5 2613 1 1 4 CYS N N -11.486 -2.661 3.608 1.00 . A A . 4 CYS N 1 1 5 2614 1 1 4 CYS O O -11.912 -1.690 1.029 1.00 . A A . 4 CYS O 1 1 5 2615 1 1 4 CYS SG S -11.776 -5.083 1.777 1.00 . A A . 4 CYS SG 1 1 5 2616 1 1 5 THR C C -9.189 -1.118 -1.601 1.00 . A A . 5 THR C 1 1 5 2617 1 1 5 THR CA C -9.858 -0.478 -0.389 1.00 . A A . 5 THR CA 1 1 5 2618 1 1 5 THR CB C -9.253 0.899 -0.125 1.00 . A A . 5 THR CB 1 1 5 2619 1 1 5 THR CG2 C -9.386 1.849 -1.297 1.00 . A A . 5 THR CG2 1 1 5 2620 1 1 5 THR H H -8.806 -1.514 1.121 1.00 . A A . 5 THR H 1 1 5 2621 1 1 5 THR HA H -10.912 -0.368 -0.587 1.00 . A A . 5 THR HA 1 1 5 2622 1 1 5 THR HB H -8.203 0.780 0.087 1.00 . A A . 5 THR HB 1 1 5 2623 1 1 5 THR HG1 H -9.209 1.665 1.677 1.00 . A A . 5 THR HG1 1 1 5 2624 1 1 5 THR HG21 H -10.377 1.764 -1.718 1.00 . A A . 5 THR HG21 1 1 5 2625 1 1 5 THR HG22 H -9.224 2.862 -0.959 1.00 . A A . 5 THR HG22 1 1 5 2626 1 1 5 THR HG23 H -8.653 1.598 -2.048 1.00 . A A . 5 THR HG23 1 1 5 2627 1 1 5 THR N N -9.706 -1.329 0.782 1.00 . A A . 5 THR N 1 1 5 2628 1 1 5 THR O O -7.973 -1.022 -1.771 1.00 . A A . 5 THR O 1 1 5 2629 1 1 5 THR OG1 O -9.867 1.510 0.996 1.00 . A A . 5 THR OG1 1 1 5 2630 1 1 6 THR C C -8.505 -1.542 -4.394 1.00 . A A . 6 THR C 1 1 5 2631 1 1 6 THR CA C -9.473 -2.443 -3.631 1.00 . A A . 6 THR CA 1 1 5 2632 1 1 6 THR CB C -10.628 -2.858 -4.544 1.00 . A A . 6 THR CB 1 1 5 2633 1 1 6 THR CG2 C -11.145 -4.251 -4.258 1.00 . A A . 6 THR CG2 1 1 5 2634 1 1 6 THR H H -10.947 -1.822 -2.242 1.00 . A A . 6 THR H 1 1 5 2635 1 1 6 THR HA H -8.944 -3.328 -3.313 1.00 . A A . 6 THR HA 1 1 5 2636 1 1 6 THR HB H -10.288 -2.836 -5.570 1.00 . A A . 6 THR HB 1 1 5 2637 1 1 6 THR HG1 H -12.407 -2.204 -5.036 1.00 . A A . 6 THR HG1 1 1 5 2638 1 1 6 THR HG21 H -10.533 -4.713 -3.497 1.00 . A A . 6 THR HG21 1 1 5 2639 1 1 6 THR HG22 H -12.166 -4.192 -3.911 1.00 . A A . 6 THR HG22 1 1 5 2640 1 1 6 THR HG23 H -11.105 -4.842 -5.161 1.00 . A A . 6 THR HG23 1 1 5 2641 1 1 6 THR N N -9.988 -1.777 -2.436 1.00 . A A . 6 THR N 1 1 5 2642 1 1 6 THR O O -8.921 -0.704 -5.194 1.00 . A A . 6 THR O 1 1 5 2643 1 1 6 THR OG1 O -11.716 -1.960 -4.416 1.00 . A A . 6 THR OG1 1 1 5 2644 1 1 7 GLY C C -4.823 -1.535 -4.735 1.00 . A A . 7 GLY C 1 1 5 2645 1 1 7 GLY CA C -6.208 -0.916 -4.803 1.00 . A A . 7 GLY CA 1 1 5 2646 1 1 7 GLY H H -6.942 -2.402 -3.487 1.00 . A A . 7 GLY H 1 1 5 2647 1 1 7 GLY HA2 H -6.177 0.059 -4.339 1.00 . A A . 7 GLY HA2 1 1 5 2648 1 1 7 GLY HA3 H -6.486 -0.800 -5.840 1.00 . A A . 7 GLY HA3 1 1 5 2649 1 1 7 GLY N N -7.213 -1.720 -4.136 1.00 . A A . 7 GLY N 1 1 5 2650 1 1 7 GLY O O -4.689 -2.743 -4.542 1.00 . A A . 7 GLY O 1 1 5 2651 1 1 8 PRO C C -1.952 -1.661 -3.462 1.00 . A A . 8 PRO C 1 1 5 2652 1 1 8 PRO CA C -2.381 -1.204 -4.857 1.00 . A A . 8 PRO CA 1 1 5 2653 1 1 8 PRO CB C -1.563 0.013 -5.303 1.00 . A A . 8 PRO CB 1 1 5 2654 1 1 8 PRO CD C -3.843 0.731 -5.138 1.00 . A A . 8 PRO CD 1 1 5 2655 1 1 8 PRO CG C -2.420 1.191 -4.989 1.00 . A A . 8 PRO CG 1 1 5 2656 1 1 8 PRO HA H -2.230 -2.013 -5.556 1.00 . A A . 8 PRO HA 1 1 5 2657 1 1 8 PRO HB2 H -0.633 0.045 -4.755 1.00 . A A . 8 PRO HB2 1 1 5 2658 1 1 8 PRO HB3 H -1.360 -0.054 -6.362 1.00 . A A . 8 PRO HB3 1 1 5 2659 1 1 8 PRO HD2 H -4.472 1.209 -4.401 1.00 . A A . 8 PRO HD2 1 1 5 2660 1 1 8 PRO HD3 H -4.203 0.936 -6.135 1.00 . A A . 8 PRO HD3 1 1 5 2661 1 1 8 PRO HG2 H -2.238 1.517 -3.979 1.00 . A A . 8 PRO HG2 1 1 5 2662 1 1 8 PRO HG3 H -2.212 1.990 -5.685 1.00 . A A . 8 PRO HG3 1 1 5 2663 1 1 8 PRO N N -3.766 -0.721 -4.896 1.00 . A A . 8 PRO N 1 1 5 2664 1 1 8 PRO O O -1.470 -2.781 -3.291 1.00 . A A . 8 PRO O 1 1 5 2665 1 1 9 CYS C C -2.539 -2.325 -0.584 1.00 . A A . 9 CYS C 1 1 5 2666 1 1 9 CYS CA C -1.749 -1.123 -1.093 1.00 . A A . 9 CYS CA 1 1 5 2667 1 1 9 CYS CB C -1.980 0.077 -0.169 1.00 . A A . 9 CYS CB 1 1 5 2668 1 1 9 CYS H H -2.513 0.085 -2.659 1.00 . A A . 9 CYS H 1 1 5 2669 1 1 9 CYS HA H -0.699 -1.372 -1.088 1.00 . A A . 9 CYS HA 1 1 5 2670 1 1 9 CYS HB2 H -2.479 0.857 -0.723 1.00 . A A . 9 CYS HB2 1 1 5 2671 1 1 9 CYS HB3 H -2.607 -0.227 0.656 1.00 . A A . 9 CYS HB3 1 1 5 2672 1 1 9 CYS N N -2.125 -0.794 -2.467 1.00 . A A . 9 CYS N 1 1 5 2673 1 1 9 CYS O O -2.056 -3.092 0.248 1.00 . A A . 9 CYS O 1 1 5 2674 1 1 9 CYS SG S -0.453 0.788 0.531 1.00 . A A . 9 CYS SG 1 1 5 2675 1 1 10 CYS C C -4.285 -4.855 -1.451 1.00 . A A . 10 CYS C 1 1 5 2676 1 1 10 CYS CA C -4.616 -3.586 -0.674 1.00 . A A . 10 CYS CA 1 1 5 2677 1 1 10 CYS CB C -6.085 -3.219 -0.881 1.00 . A A . 10 CYS CB 1 1 5 2678 1 1 10 CYS H H -4.093 -1.835 -1.741 1.00 . A A . 10 CYS H 1 1 5 2679 1 1 10 CYS HA H -4.445 -3.766 0.378 1.00 . A A . 10 CYS HA 1 1 5 2680 1 1 10 CYS HB2 H -6.154 -2.172 -1.130 1.00 . A A . 10 CYS HB2 1 1 5 2681 1 1 10 CYS HB3 H -6.486 -3.805 -1.695 1.00 . A A . 10 CYS HB3 1 1 5 2682 1 1 10 CYS N N -3.759 -2.480 -1.084 1.00 . A A . 10 CYS N 1 1 5 2683 1 1 10 CYS O O -4.094 -4.818 -2.667 1.00 . A A . 10 CYS O 1 1 5 2684 1 1 10 CYS SG S -7.133 -3.509 0.580 1.00 . A A . 10 CYS SG 1 1 5 2685 1 1 11 ARG C C -5.223 -7.989 -1.721 1.00 . A A . 11 ARG C 1 1 5 2686 1 1 11 ARG CA C -3.933 -7.259 -1.369 1.00 . A A . 11 ARG CA 1 1 5 2687 1 1 11 ARG CB C -3.077 -8.122 -0.439 1.00 . A A . 11 ARG CB 1 1 5 2688 1 1 11 ARG CD C -2.664 -10.553 0.044 1.00 . A A . 11 ARG CD 1 1 5 2689 1 1 11 ARG CG C -2.714 -9.476 -1.027 1.00 . A A . 11 ARG CG 1 1 5 2690 1 1 11 ARG CZ C -0.293 -10.651 0.707 1.00 . A A . 11 ARG CZ 1 1 5 2691 1 1 11 ARG H H -4.398 -5.943 0.221 1.00 . A A . 11 ARG H 1 1 5 2692 1 1 11 ARG HA H -3.384 -7.066 -2.276 1.00 . A A . 11 ARG HA 1 1 5 2693 1 1 11 ARG HB2 H -2.162 -7.593 -0.217 1.00 . A A . 11 ARG HB2 1 1 5 2694 1 1 11 ARG HB3 H -3.619 -8.287 0.481 1.00 . A A . 11 ARG HB3 1 1 5 2695 1 1 11 ARG HD2 H -3.594 -10.540 0.593 1.00 . A A . 11 ARG HD2 1 1 5 2696 1 1 11 ARG HD3 H -2.543 -11.514 -0.435 1.00 . A A . 11 ARG HD3 1 1 5 2697 1 1 11 ARG HE H -1.773 -9.960 1.853 1.00 . A A . 11 ARG HE 1 1 5 2698 1 1 11 ARG HG2 H -3.455 -9.749 -1.763 1.00 . A A . 11 ARG HG2 1 1 5 2699 1 1 11 ARG HG3 H -1.744 -9.404 -1.498 1.00 . A A . 11 ARG HG3 1 1 5 2700 1 1 11 ARG HH11 H -0.671 -11.344 -1.155 1.00 . A A . 11 ARG HH11 1 1 5 2701 1 1 11 ARG HH12 H 0.988 -11.402 -0.665 1.00 . A A . 11 ARG HH12 1 1 5 2702 1 1 11 ARG HH21 H 0.409 -10.035 2.500 1.00 . A A . 11 ARG HH21 1 1 5 2703 1 1 11 ARG HH22 H 1.602 -10.659 1.410 1.00 . A A . 11 ARG HH22 1 1 5 2704 1 1 11 ARG N N -4.229 -5.977 -0.743 1.00 . A A . 11 ARG N 1 1 5 2705 1 1 11 ARG NE N -1.560 -10.346 0.978 1.00 . A A . 11 ARG NE 1 1 5 2706 1 1 11 ARG NH1 N 0.035 -11.175 -0.467 1.00 . A A . 11 ARG NH1 1 1 5 2707 1 1 11 ARG NH2 N 0.650 -10.430 1.613 1.00 . A A . 11 ARG NH2 1 1 5 2708 1 1 11 ARG O O -5.581 -8.110 -2.892 1.00 . A A . 11 ARG O 1 1 5 2709 1 1 12 GLN C C -8.325 -8.459 -0.189 1.00 . A A . 12 GLN C 1 1 5 2710 1 1 12 GLN CA C -7.175 -9.179 -0.891 1.00 . A A . 12 GLN CA 1 1 5 2711 1 1 12 GLN CB C -7.060 -10.611 -0.365 1.00 . A A . 12 GLN CB 1 1 5 2712 1 1 12 GLN CD C -6.887 -12.929 -1.355 1.00 . A A . 12 GLN CD 1 1 5 2713 1 1 12 GLN CG C -6.288 -11.538 -1.290 1.00 . A A . 12 GLN CG 1 1 5 2714 1 1 12 GLN H H -5.580 -8.334 0.212 1.00 . A A . 12 GLN H 1 1 5 2715 1 1 12 GLN HA H -7.380 -9.210 -1.950 1.00 . A A . 12 GLN HA 1 1 5 2716 1 1 12 GLN HB2 H -6.558 -10.592 0.591 1.00 . A A . 12 GLN HB2 1 1 5 2717 1 1 12 GLN HB3 H -8.052 -11.015 -0.233 1.00 . A A . 12 GLN HB3 1 1 5 2718 1 1 12 GLN HE21 H -5.489 -13.615 -0.118 1.00 . A A . 12 GLN HE21 1 1 5 2719 1 1 12 GLN HE22 H -6.645 -14.777 -0.663 1.00 . A A . 12 GLN HE22 1 1 5 2720 1 1 12 GLN HG2 H -6.289 -11.116 -2.285 1.00 . A A . 12 GLN HG2 1 1 5 2721 1 1 12 GLN HG3 H -5.271 -11.616 -0.934 1.00 . A A . 12 GLN HG3 1 1 5 2722 1 1 12 GLN N N -5.919 -8.467 -0.697 1.00 . A A . 12 GLN N 1 1 5 2723 1 1 12 GLN NE2 N -6.279 -13.869 -0.640 1.00 . A A . 12 GLN NE2 1 1 5 2724 1 1 12 GLN O O -9.480 -8.587 -0.592 1.00 . A A . 12 GLN O 1 1 5 2725 1 1 12 GLN OE1 O -7.885 -13.157 -2.039 1.00 . A A . 12 GLN OE1 1 1 5 2726 1 1 13 CYS C C -8.372 -6.576 2.994 1.00 . A A . 13 CYS C 1 1 5 2727 1 1 13 CYS CA C -8.969 -6.942 1.636 1.00 . A A . 13 CYS CA 1 1 5 2728 1 1 13 CYS CB C -10.273 -7.732 1.835 1.00 . A A . 13 CYS CB 1 1 5 2729 1 1 13 CYS H H -7.051 -7.635 1.117 1.00 . A A . 13 CYS H 1 1 5 2730 1 1 13 CYS HA H -9.184 -6.036 1.094 1.00 . A A . 13 CYS HA 1 1 5 2731 1 1 13 CYS HB2 H -10.691 -7.973 0.871 1.00 . A A . 13 CYS HB2 1 1 5 2732 1 1 13 CYS HB3 H -10.053 -8.647 2.365 1.00 . A A . 13 CYS HB3 1 1 5 2733 1 1 13 CYS N N -7.992 -7.699 0.859 1.00 . A A . 13 CYS N 1 1 5 2734 1 1 13 CYS O O -8.999 -6.768 4.036 1.00 . A A . 13 CYS O 1 1 5 2735 1 1 13 CYS SG S -11.557 -6.839 2.776 1.00 . A A . 13 CYS SG 1 1 5 2736 1 1 14 LYS C C -5.247 -4.803 3.900 1.00 . A A . 14 LYS C 1 1 5 2737 1 1 14 LYS CA C -6.469 -5.663 4.202 1.00 . A A . 14 LYS CA 1 1 5 2738 1 1 14 LYS CB C -6.051 -6.905 4.992 1.00 . A A . 14 LYS CB 1 1 5 2739 1 1 14 LYS CD C -6.510 -8.019 7.197 1.00 . A A . 14 LYS CD 1 1 5 2740 1 1 14 LYS CE C -7.984 -8.341 7.012 1.00 . A A . 14 LYS CE 1 1 5 2741 1 1 14 LYS CG C -6.131 -6.723 6.499 1.00 . A A . 14 LYS CG 1 1 5 2742 1 1 14 LYS H H -6.697 -5.925 2.115 1.00 . A A . 14 LYS H 1 1 5 2743 1 1 14 LYS HA H -7.162 -5.087 4.797 1.00 . A A . 14 LYS HA 1 1 5 2744 1 1 14 LYS HB2 H -6.694 -7.727 4.715 1.00 . A A . 14 LYS HB2 1 1 5 2745 1 1 14 LYS HB3 H -5.032 -7.154 4.735 1.00 . A A . 14 LYS HB3 1 1 5 2746 1 1 14 LYS HD2 H -5.922 -8.825 6.783 1.00 . A A . 14 LYS HD2 1 1 5 2747 1 1 14 LYS HD3 H -6.300 -7.923 8.252 1.00 . A A . 14 LYS HD3 1 1 5 2748 1 1 14 LYS HE2 H -8.566 -7.658 7.614 1.00 . A A . 14 LYS HE2 1 1 5 2749 1 1 14 LYS HE3 H -8.241 -8.210 5.971 1.00 . A A . 14 LYS HE3 1 1 5 2750 1 1 14 LYS HG2 H -5.169 -6.397 6.865 1.00 . A A . 14 LYS HG2 1 1 5 2751 1 1 14 LYS HG3 H -6.877 -5.973 6.722 1.00 . A A . 14 LYS HG3 1 1 5 2752 1 1 14 LYS HZ1 H -7.940 -9.923 8.375 1.00 . A A . 14 LYS HZ1 1 1 5 2753 1 1 14 LYS HZ2 H -9.333 -9.883 7.418 1.00 . A A . 14 LYS HZ2 1 1 5 2754 1 1 14 LYS HZ3 H -7.867 -10.411 6.758 1.00 . A A . 14 LYS HZ3 1 1 5 2755 1 1 14 LYS N N -7.151 -6.052 2.974 1.00 . A A . 14 LYS N 1 1 5 2756 1 1 14 LYS NZ N -8.304 -9.737 7.419 1.00 . A A . 14 LYS NZ 1 1 5 2757 1 1 14 LYS O O -4.392 -5.178 3.098 1.00 . A A . 14 LYS O 1 1 5 2758 1 1 15 LEU C C -2.720 -3.462 4.439 1.00 . A A . 15 LEU C 1 1 5 2759 1 1 15 LEU CA C -4.052 -2.724 4.361 1.00 . A A . 15 LEU CA 1 1 5 2760 1 1 15 LEU CB C -4.070 -1.603 5.412 1.00 . A A . 15 LEU CB 1 1 5 2761 1 1 15 LEU CD1 C -5.329 -0.062 6.937 1.00 . A A . 15 LEU CD1 1 1 5 2762 1 1 15 LEU CD2 C -6.426 -0.936 4.866 1.00 . A A . 15 LEU CD2 1 1 5 2763 1 1 15 LEU CG C -5.444 -1.243 5.985 1.00 . A A . 15 LEU CG 1 1 5 2764 1 1 15 LEU H H -5.885 -3.409 5.176 1.00 . A A . 15 LEU H 1 1 5 2765 1 1 15 LEU HA H -4.147 -2.285 3.379 1.00 . A A . 15 LEU HA 1 1 5 2766 1 1 15 LEU HB2 H -3.433 -1.901 6.231 1.00 . A A . 15 LEU HB2 1 1 5 2767 1 1 15 LEU HB3 H -3.652 -0.715 4.962 1.00 . A A . 15 LEU HB3 1 1 5 2768 1 1 15 LEU HD11 H -4.300 0.054 7.245 1.00 . A A . 15 LEU HD11 1 1 5 2769 1 1 15 LEU HD12 H -5.659 0.837 6.437 1.00 . A A . 15 LEU HD12 1 1 5 2770 1 1 15 LEU HD13 H -5.947 -0.239 7.805 1.00 . A A . 15 LEU HD13 1 1 5 2771 1 1 15 LEU HD21 H -5.886 -0.578 4.002 1.00 . A A . 15 LEU HD21 1 1 5 2772 1 1 15 LEU HD22 H -6.967 -1.834 4.605 1.00 . A A . 15 LEU HD22 1 1 5 2773 1 1 15 LEU HD23 H -7.122 -0.179 5.195 1.00 . A A . 15 LEU HD23 1 1 5 2774 1 1 15 LEU HG H -5.825 -2.084 6.546 1.00 . A A . 15 LEU HG 1 1 5 2775 1 1 15 LEU N N -5.171 -3.646 4.552 1.00 . A A . 15 LEU N 1 1 5 2776 1 1 15 LEU O O -2.371 -4.019 5.480 1.00 . A A . 15 LEU O 1 1 5 2777 1 1 16 LYS C C 0.183 -3.707 4.487 1.00 . A A . 16 LYS C 1 1 5 2778 1 1 16 LYS CA C -0.679 -4.133 3.299 1.00 . A A . 16 LYS CA 1 1 5 2779 1 1 16 LYS CB C 0.048 -3.820 1.989 1.00 . A A . 16 LYS CB 1 1 5 2780 1 1 16 LYS CD C 0.378 -4.421 -0.429 1.00 . A A . 16 LYS CD 1 1 5 2781 1 1 16 LYS CE C -0.246 -5.216 -1.564 1.00 . A A . 16 LYS CE 1 1 5 2782 1 1 16 LYS CG C -0.128 -4.892 0.925 1.00 . A A . 16 LYS CG 1 1 5 2783 1 1 16 LYS H H -2.301 -3.000 2.536 1.00 . A A . 16 LYS H 1 1 5 2784 1 1 16 LYS HA H -0.857 -5.197 3.358 1.00 . A A . 16 LYS HA 1 1 5 2785 1 1 16 LYS HB2 H -0.326 -2.887 1.596 1.00 . A A . 16 LYS HB2 1 1 5 2786 1 1 16 LYS HB3 H 1.104 -3.717 2.192 1.00 . A A . 16 LYS HB3 1 1 5 2787 1 1 16 LYS HD2 H 0.128 -3.378 -0.553 1.00 . A A . 16 LYS HD2 1 1 5 2788 1 1 16 LYS HD3 H 1.451 -4.543 -0.463 1.00 . A A . 16 LYS HD3 1 1 5 2789 1 1 16 LYS HE2 H -1.321 -5.134 -1.495 1.00 . A A . 16 LYS HE2 1 1 5 2790 1 1 16 LYS HE3 H 0.086 -4.799 -2.503 1.00 . A A . 16 LYS HE3 1 1 5 2791 1 1 16 LYS HG2 H 0.426 -5.771 1.219 1.00 . A A . 16 LYS HG2 1 1 5 2792 1 1 16 LYS HG3 H -1.177 -5.135 0.843 1.00 . A A . 16 LYS HG3 1 1 5 2793 1 1 16 LYS HZ1 H -0.036 -7.034 -0.557 1.00 . A A . 16 LYS HZ1 1 1 5 2794 1 1 16 LYS HZ2 H -0.431 -7.199 -2.193 1.00 . A A . 16 LYS HZ2 1 1 5 2795 1 1 16 LYS HZ3 H 1.141 -6.767 -1.741 1.00 . A A . 16 LYS HZ3 1 1 5 2796 1 1 16 LYS N N -1.975 -3.462 3.337 1.00 . A A . 16 LYS N 1 1 5 2797 1 1 16 LYS NZ N 0.134 -6.654 -1.510 1.00 . A A . 16 LYS NZ 1 1 5 2798 1 1 16 LYS O O 0.138 -2.553 4.911 1.00 . A A . 16 LYS O 1 1 5 2799 1 1 17 PRO C C 2.754 -3.145 5.940 1.00 . A A . 17 PRO C 1 1 5 2800 1 1 17 PRO CA C 1.847 -4.345 6.189 1.00 . A A . 17 PRO CA 1 1 5 2801 1 1 17 PRO CB C 2.685 -5.623 6.352 1.00 . A A . 17 PRO CB 1 1 5 2802 1 1 17 PRO CD C 1.100 -6.032 4.609 1.00 . A A . 17 PRO CD 1 1 5 2803 1 1 17 PRO CG C 2.464 -6.412 5.104 1.00 . A A . 17 PRO CG 1 1 5 2804 1 1 17 PRO HA H 1.270 -4.175 7.086 1.00 . A A . 17 PRO HA 1 1 5 2805 1 1 17 PRO HB2 H 3.726 -5.359 6.470 1.00 . A A . 17 PRO HB2 1 1 5 2806 1 1 17 PRO HB3 H 2.348 -6.165 7.224 1.00 . A A . 17 PRO HB3 1 1 5 2807 1 1 17 PRO HD2 H 1.052 -6.109 3.532 1.00 . A A . 17 PRO HD2 1 1 5 2808 1 1 17 PRO HD3 H 0.343 -6.648 5.070 1.00 . A A . 17 PRO HD3 1 1 5 2809 1 1 17 PRO HG2 H 3.214 -6.155 4.370 1.00 . A A . 17 PRO HG2 1 1 5 2810 1 1 17 PRO HG3 H 2.502 -7.468 5.326 1.00 . A A . 17 PRO HG3 1 1 5 2811 1 1 17 PRO N N 0.979 -4.635 5.044 1.00 . A A . 17 PRO N 1 1 5 2812 1 1 17 PRO O O 3.508 -3.117 4.967 1.00 . A A . 17 PRO O 1 1 5 2813 1 1 18 ALA C C 4.939 -1.292 6.365 1.00 . A A . 18 ALA C 1 1 5 2814 1 1 18 ALA CA C 3.493 -0.948 6.710 1.00 . A A . 18 ALA CA 1 1 5 2815 1 1 18 ALA CB C 3.437 -0.146 8.001 1.00 . A A . 18 ALA CB 1 1 5 2816 1 1 18 ALA H H 2.055 -2.237 7.581 1.00 . A A . 18 ALA H 1 1 5 2817 1 1 18 ALA HA H 3.079 -0.341 5.918 1.00 . A A . 18 ALA HA 1 1 5 2818 1 1 18 ALA HB1 H 3.764 -0.764 8.824 1.00 . A A . 18 ALA HB1 1 1 5 2819 1 1 18 ALA HB2 H 4.084 0.715 7.919 1.00 . A A . 18 ALA HB2 1 1 5 2820 1 1 18 ALA HB3 H 2.424 0.182 8.178 1.00 . A A . 18 ALA HB3 1 1 5 2821 1 1 18 ALA N N 2.676 -2.154 6.828 1.00 . A A . 18 ALA N 1 1 5 2822 1 1 18 ALA O O 5.381 -2.424 6.564 1.00 . A A . 18 ALA O 1 1 5 2823 1 1 19 GLY C C 7.186 -1.591 4.381 1.00 . A A . 19 GLY C 1 1 5 2824 1 1 19 GLY CA C 7.051 -0.545 5.470 1.00 . A A . 19 GLY CA 1 1 5 2825 1 1 19 GLY H H 5.264 0.566 5.696 1.00 . A A . 19 GLY H 1 1 5 2826 1 1 19 GLY HA2 H 7.596 -0.876 6.342 1.00 . A A . 19 GLY HA2 1 1 5 2827 1 1 19 GLY HA3 H 7.479 0.383 5.120 1.00 . A A . 19 GLY HA3 1 1 5 2828 1 1 19 GLY N N 5.668 -0.315 5.839 1.00 . A A . 19 GLY N 1 1 5 2829 1 1 19 GLY O O 8.235 -2.219 4.238 1.00 . A A . 19 GLY O 1 1 5 2830 1 1 20 THR C C 5.747 -2.077 1.207 1.00 . A A . 20 THR C 1 1 5 2831 1 1 20 THR CA C 6.117 -2.748 2.523 1.00 . A A . 20 THR CA 1 1 5 2832 1 1 20 THR CB C 5.137 -3.883 2.825 1.00 . A A . 20 THR CB 1 1 5 2833 1 1 20 THR CG2 C 5.169 -4.992 1.797 1.00 . A A . 20 THR CG2 1 1 5 2834 1 1 20 THR H H 5.312 -1.242 3.768 1.00 . A A . 20 THR H 1 1 5 2835 1 1 20 THR HA H 7.114 -3.156 2.439 1.00 . A A . 20 THR HA 1 1 5 2836 1 1 20 THR HB H 4.134 -3.482 2.848 1.00 . A A . 20 THR HB 1 1 5 2837 1 1 20 THR HG1 H 4.589 -4.640 4.547 1.00 . A A . 20 THR HG1 1 1 5 2838 1 1 20 THR HG21 H 5.488 -4.592 0.846 1.00 . A A . 20 THR HG21 1 1 5 2839 1 1 20 THR HG22 H 5.860 -5.759 2.115 1.00 . A A . 20 THR HG22 1 1 5 2840 1 1 20 THR HG23 H 4.182 -5.418 1.695 1.00 . A A . 20 THR HG23 1 1 5 2841 1 1 20 THR N N 6.119 -1.776 3.608 1.00 . A A . 20 THR N 1 1 5 2842 1 1 20 THR O O 4.719 -1.407 1.109 1.00 . A A . 20 THR O 1 1 5 2843 1 1 20 THR OG1 O 5.413 -4.461 4.089 1.00 . A A . 20 THR OG1 1 1 5 2844 1 1 21 THR C C 4.958 -1.992 -1.627 1.00 . A A . 21 THR C 1 1 5 2845 1 1 21 THR CA C 6.354 -1.658 -1.112 1.00 . A A . 21 THR CA 1 1 5 2846 1 1 21 THR CB C 7.410 -2.130 -2.114 1.00 . A A . 21 THR CB 1 1 5 2847 1 1 21 THR CG2 C 8.164 -0.988 -2.755 1.00 . A A . 21 THR CG2 1 1 5 2848 1 1 21 THR H H 7.397 -2.795 0.338 1.00 . A A . 21 THR H 1 1 5 2849 1 1 21 THR HA H 6.434 -0.587 -1.003 1.00 . A A . 21 THR HA 1 1 5 2850 1 1 21 THR HB H 6.925 -2.689 -2.901 1.00 . A A . 21 THR HB 1 1 5 2851 1 1 21 THR HG1 H 8.788 -3.522 -2.150 1.00 . A A . 21 THR HG1 1 1 5 2852 1 1 21 THR HG21 H 8.309 -0.202 -2.028 1.00 . A A . 21 THR HG21 1 1 5 2853 1 1 21 THR HG22 H 9.123 -1.339 -3.104 1.00 . A A . 21 THR HG22 1 1 5 2854 1 1 21 THR HG23 H 7.594 -0.605 -3.589 1.00 . A A . 21 THR HG23 1 1 5 2855 1 1 21 THR N N 6.592 -2.254 0.198 1.00 . A A . 21 THR N 1 1 5 2856 1 1 21 THR O O 4.654 -3.147 -1.924 1.00 . A A . 21 THR O 1 1 5 2857 1 1 21 THR OG1 O 8.360 -2.974 -1.487 1.00 . A A . 21 THR OG1 1 1 5 2858 1 1 22 CYS C C 2.641 -0.813 -3.691 1.00 . A A . 22 CYS C 1 1 5 2859 1 1 22 CYS CA C 2.750 -1.156 -2.212 1.00 . A A . 22 CYS CA 1 1 5 2860 1 1 22 CYS CB C 1.775 -0.291 -1.412 1.00 . A A . 22 CYS CB 1 1 5 2861 1 1 22 CYS H H 4.415 -0.073 -1.480 1.00 . A A . 22 CYS H 1 1 5 2862 1 1 22 CYS HA H 2.491 -2.195 -2.076 1.00 . A A . 22 CYS HA 1 1 5 2863 1 1 22 CYS HB2 H 0.800 -0.343 -1.873 1.00 . A A . 22 CYS HB2 1 1 5 2864 1 1 22 CYS HB3 H 1.711 -0.674 -0.404 1.00 . A A . 22 CYS HB3 1 1 5 2865 1 1 22 CYS N N 4.113 -0.971 -1.731 1.00 . A A . 22 CYS N 1 1 5 2866 1 1 22 CYS O O 1.564 -0.470 -4.178 1.00 . A A . 22 CYS O 1 1 5 2867 1 1 22 CYS SG S 2.241 1.469 -1.309 1.00 . A A . 22 CYS SG 1 1 5 2868 1 1 23 TRP C C 5.041 -1.074 -6.504 1.00 . A A . 23 TRP C 1 1 5 2869 1 1 23 TRP CA C 3.762 -0.596 -5.828 1.00 . A A . 23 TRP CA 1 1 5 2870 1 1 23 TRP CB C 3.585 0.908 -6.043 1.00 . A A . 23 TRP CB 1 1 5 2871 1 1 23 TRP CD1 C 2.250 0.369 -8.154 1.00 . A A . 23 TRP CD1 1 1 5 2872 1 1 23 TRP CD2 C 2.166 2.518 -7.543 1.00 . A A . 23 TRP CD2 1 1 5 2873 1 1 23 TRP CE2 C 1.398 2.353 -8.710 1.00 . A A . 23 TRP CE2 1 1 5 2874 1 1 23 TRP CE3 C 2.260 3.789 -6.973 1.00 . A A . 23 TRP CE3 1 1 5 2875 1 1 23 TRP CG C 2.702 1.236 -7.205 1.00 . A A . 23 TRP CG 1 1 5 2876 1 1 23 TRP CH2 C 0.839 4.644 -8.737 1.00 . A A . 23 TRP CH2 1 1 5 2877 1 1 23 TRP CZ2 C 0.729 3.410 -9.316 1.00 . A A . 23 TRP CZ2 1 1 5 2878 1 1 23 TRP CZ3 C 1.596 4.839 -7.577 1.00 . A A . 23 TRP CZ3 1 1 5 2879 1 1 23 TRP H H 4.589 -1.182 -3.971 1.00 . A A . 23 TRP H 1 1 5 2880 1 1 23 TRP HA H 2.928 -1.108 -6.275 1.00 . A A . 23 TRP HA 1 1 5 2881 1 1 23 TRP HB2 H 3.146 1.343 -5.157 1.00 . A A . 23 TRP HB2 1 1 5 2882 1 1 23 TRP HB3 H 4.550 1.359 -6.219 1.00 . A A . 23 TRP HB3 1 1 5 2883 1 1 23 TRP HD1 H 2.488 -0.682 -8.175 1.00 . A A . 23 TRP HD1 1 1 5 2884 1 1 23 TRP HE1 H 1.027 0.628 -9.840 1.00 . A A . 23 TRP HE1 1 1 5 2885 1 1 23 TRP HE3 H 2.837 3.957 -6.077 1.00 . A A . 23 TRP HE3 1 1 5 2886 1 1 23 TRP HH2 H 0.341 5.493 -9.177 1.00 . A A . 23 TRP HH2 1 1 5 2887 1 1 23 TRP HZ2 H 0.139 3.274 -10.208 1.00 . A A . 23 TRP HZ2 1 1 5 2888 1 1 23 TRP HZ3 H 1.659 5.830 -7.152 1.00 . A A . 23 TRP HZ3 1 1 5 2889 1 1 23 TRP N N 3.757 -0.904 -4.407 1.00 . A A . 23 TRP N 1 1 5 2890 1 1 23 TRP NE1 N 1.466 1.033 -9.065 1.00 . A A . 23 TRP NE1 1 1 5 2891 1 1 23 TRP O O 5.031 -2.053 -7.250 1.00 . A A . 23 TRP O 1 1 5 2892 1 1 24 LYS C C 7.341 -0.651 -8.367 1.00 . A A . 24 LYS C 1 1 5 2893 1 1 24 LYS CA C 7.420 -0.723 -6.844 1.00 . A A . 24 LYS CA 1 1 5 2894 1 1 24 LYS CB C 7.845 -2.125 -6.407 1.00 . A A . 24 LYS CB 1 1 5 2895 1 1 24 LYS CD C 9.858 -3.564 -5.969 1.00 . A A . 24 LYS CD 1 1 5 2896 1 1 24 LYS CE C 11.348 -3.329 -5.779 1.00 . A A . 24 LYS CE 1 1 5 2897 1 1 24 LYS CG C 9.239 -2.512 -6.874 1.00 . A A . 24 LYS CG 1 1 5 2898 1 1 24 LYS H H 6.078 0.399 -5.651 1.00 . A A . 24 LYS H 1 1 5 2899 1 1 24 LYS HA H 8.152 -0.008 -6.498 1.00 . A A . 24 LYS HA 1 1 5 2900 1 1 24 LYS HB2 H 7.824 -2.176 -5.328 1.00 . A A . 24 LYS HB2 1 1 5 2901 1 1 24 LYS HB3 H 7.143 -2.843 -6.806 1.00 . A A . 24 LYS HB3 1 1 5 2902 1 1 24 LYS HD2 H 9.373 -3.527 -5.005 1.00 . A A . 24 LYS HD2 1 1 5 2903 1 1 24 LYS HD3 H 9.710 -4.538 -6.412 1.00 . A A . 24 LYS HD3 1 1 5 2904 1 1 24 LYS HE2 H 11.836 -3.403 -6.740 1.00 . A A . 24 LYS HE2 1 1 5 2905 1 1 24 LYS HE3 H 11.494 -2.337 -5.377 1.00 . A A . 24 LYS HE3 1 1 5 2906 1 1 24 LYS HG2 H 9.176 -2.906 -7.877 1.00 . A A . 24 LYS HG2 1 1 5 2907 1 1 24 LYS HG3 H 9.866 -1.632 -6.870 1.00 . A A . 24 LYS HG3 1 1 5 2908 1 1 24 LYS HZ1 H 11.225 -4.711 -4.218 1.00 . A A . 24 LYS HZ1 1 1 5 2909 1 1 24 LYS HZ2 H 12.380 -5.103 -5.391 1.00 . A A . 24 LYS HZ2 1 1 5 2910 1 1 24 LYS HZ3 H 12.692 -3.871 -4.275 1.00 . A A . 24 LYS HZ3 1 1 5 2911 1 1 24 LYS N N 6.136 -0.373 -6.248 1.00 . A A . 24 LYS N 1 1 5 2912 1 1 24 LYS NZ N 11.954 -4.323 -4.851 1.00 . A A . 24 LYS NZ 1 1 5 2913 1 1 24 LYS O O 8.059 -1.362 -9.070 1.00 . A A . 24 LYS O 1 1 5 2914 1 1 25 THR C C 7.611 0.686 -10.992 1.00 . A A . 25 THR C 1 1 5 2915 1 1 25 THR CA C 6.280 0.385 -10.307 1.00 . A A . 25 THR CA 1 1 5 2916 1 1 25 THR CB C 5.277 1.512 -10.579 1.00 . A A . 25 THR CB 1 1 5 2917 1 1 25 THR CG2 C 5.064 1.793 -12.050 1.00 . A A . 25 THR CG2 1 1 5 2918 1 1 25 THR H H 5.919 0.751 -8.254 1.00 . A A . 25 THR H 1 1 5 2919 1 1 25 THR HA H 5.886 -0.538 -10.703 1.00 . A A . 25 THR HA 1 1 5 2920 1 1 25 THR HB H 5.635 2.422 -10.117 1.00 . A A . 25 THR HB 1 1 5 2921 1 1 25 THR HG1 H 3.743 1.909 -9.430 1.00 . A A . 25 THR HG1 1 1 5 2922 1 1 25 THR HG21 H 6.017 1.960 -12.528 1.00 . A A . 25 THR HG21 1 1 5 2923 1 1 25 THR HG22 H 4.573 0.948 -12.511 1.00 . A A . 25 THR HG22 1 1 5 2924 1 1 25 THR HG23 H 4.446 2.673 -12.162 1.00 . A A . 25 THR HG23 1 1 5 2925 1 1 25 THR N N 6.461 0.214 -8.868 1.00 . A A . 25 THR N 1 1 5 2926 1 1 25 THR O O 8.544 1.185 -10.363 1.00 . A A . 25 THR O 1 1 5 2927 1 1 25 THR OG1 O 4.015 1.201 -10.019 1.00 . A A . 25 THR OG1 1 1 5 2928 1 1 26 SER C C 9.041 2.097 -13.421 1.00 . A A . 26 SER C 1 1 5 2929 1 1 26 SER CA C 8.911 0.620 -13.053 1.00 . A A . 26 SER CA 1 1 5 2930 1 1 26 SER CB C 8.916 -0.239 -14.319 1.00 . A A . 26 SER CB 1 1 5 2931 1 1 26 SER H H 6.916 -0.014 -12.732 1.00 . A A . 26 SER H 1 1 5 2932 1 1 26 SER HA H 9.752 0.341 -12.436 1.00 . A A . 26 SER HA 1 1 5 2933 1 1 26 SER HB2 H 8.712 -1.266 -14.056 1.00 . A A . 26 SER HB2 1 1 5 2934 1 1 26 SER HB3 H 8.154 0.118 -14.997 1.00 . A A . 26 SER HB3 1 1 5 2935 1 1 26 SER HG H 10.197 -0.825 -15.681 1.00 . A A . 26 SER HG 1 1 5 2936 1 1 26 SER N N 7.693 0.381 -12.284 1.00 . A A . 26 SER N 1 1 5 2937 1 1 26 SER O O 9.178 2.446 -14.594 1.00 . A A . 26 SER O 1 1 5 2938 1 1 26 SER OG O 10.173 -0.178 -14.972 1.00 . A A . 26 SER OG 1 1 5 2939 1 1 27 VAL C C 8.783 5.125 -11.293 1.00 . A A . 27 VAL C 1 1 5 2940 1 1 27 VAL CA C 9.108 4.398 -12.593 1.00 . A A . 27 VAL CA 1 1 5 2941 1 1 27 VAL CB C 8.163 4.912 -13.701 1.00 . A A . 27 VAL CB 1 1 5 2942 1 1 27 VAL CG1 C 6.714 4.594 -13.362 1.00 . A A . 27 VAL CG1 1 1 5 2943 1 1 27 VAL CG2 C 8.351 6.408 -13.913 1.00 . A A . 27 VAL CG2 1 1 5 2944 1 1 27 VAL H H 8.892 2.605 -11.498 1.00 . A A . 27 VAL H 1 1 5 2945 1 1 27 VAL HA H 10.126 4.623 -12.877 1.00 . A A . 27 VAL HA 1 1 5 2946 1 1 27 VAL HB H 8.411 4.409 -14.623 1.00 . A A . 27 VAL HB 1 1 5 2947 1 1 27 VAL HG11 H 6.682 3.804 -12.628 1.00 . A A . 27 VAL HG11 1 1 5 2948 1 1 27 VAL HG12 H 6.236 5.477 -12.962 1.00 . A A . 27 VAL HG12 1 1 5 2949 1 1 27 VAL HG13 H 6.197 4.278 -14.255 1.00 . A A . 27 VAL HG13 1 1 5 2950 1 1 27 VAL HG21 H 9.405 6.639 -13.935 1.00 . A A . 27 VAL HG21 1 1 5 2951 1 1 27 VAL HG22 H 7.899 6.698 -14.850 1.00 . A A . 27 VAL HG22 1 1 5 2952 1 1 27 VAL HG23 H 7.880 6.948 -13.104 1.00 . A A . 27 VAL HG23 1 1 5 2953 1 1 27 VAL N N 8.998 2.954 -12.405 1.00 . A A . 27 VAL N 1 1 5 2954 1 1 27 VAL O O 9.344 6.180 -10.999 1.00 . A A . 27 VAL O 1 1 5 2955 1 1 28 SER C C 7.280 4.057 -8.187 1.00 . A A . 28 SER C 1 1 5 2956 1 1 28 SER CA C 7.452 5.134 -9.254 1.00 . A A . 28 SER CA 1 1 5 2957 1 1 28 SER CB C 6.141 5.901 -9.434 1.00 . A A . 28 SER CB 1 1 5 2958 1 1 28 SER H H 7.453 3.710 -10.815 1.00 . A A . 28 SER H 1 1 5 2959 1 1 28 SER HA H 8.221 5.821 -8.937 1.00 . A A . 28 SER HA 1 1 5 2960 1 1 28 SER HB2 H 6.105 6.321 -10.427 1.00 . A A . 28 SER HB2 1 1 5 2961 1 1 28 SER HB3 H 5.309 5.224 -9.299 1.00 . A A . 28 SER HB3 1 1 5 2962 1 1 28 SER HG H 6.477 7.733 -8.827 1.00 . A A . 28 SER HG 1 1 5 2963 1 1 28 SER N N 7.865 4.549 -10.522 1.00 . A A . 28 SER N 1 1 5 2964 1 1 28 SER O O 6.283 3.334 -8.178 1.00 . A A . 28 SER O 1 1 5 2965 1 1 28 SER OG O 6.031 6.952 -8.490 1.00 . A A . 28 SER OG 1 1 5 2966 1 1 29 SER C C 7.709 3.616 -4.922 1.00 . A A . 29 SER C 1 1 5 2967 1 1 29 SER CA C 8.203 2.972 -6.213 1.00 . A A . 29 SER CA 1 1 5 2968 1 1 29 SER CB C 9.584 2.349 -5.994 1.00 . A A . 29 SER CB 1 1 5 2969 1 1 29 SER H H 9.021 4.564 -7.345 1.00 . A A . 29 SER H 1 1 5 2970 1 1 29 SER HA H 7.507 2.197 -6.505 1.00 . A A . 29 SER HA 1 1 5 2971 1 1 29 SER HB2 H 9.810 1.684 -6.814 1.00 . A A . 29 SER HB2 1 1 5 2972 1 1 29 SER HB3 H 10.326 3.132 -5.950 1.00 . A A . 29 SER HB3 1 1 5 2973 1 1 29 SER HG H 9.151 0.785 -4.897 1.00 . A A . 29 SER HG 1 1 5 2974 1 1 29 SER N N 8.253 3.957 -7.288 1.00 . A A . 29 SER N 1 1 5 2975 1 1 29 SER O O 8.204 4.665 -4.512 1.00 . A A . 29 SER O 1 1 5 2976 1 1 29 SER OG O 9.625 1.612 -4.785 1.00 . A A . 29 SER OG 1 1 5 2977 1 1 30 HIS C C 6.158 2.460 -1.954 1.00 . A A . 30 HIS C 1 1 5 2978 1 1 30 HIS CA C 6.146 3.512 -3.061 1.00 . A A . 30 HIS CA 1 1 5 2979 1 1 30 HIS CB C 4.718 3.989 -3.319 1.00 . A A . 30 HIS CB 1 1 5 2980 1 1 30 HIS CD2 C 5.072 4.771 -5.766 1.00 . A A . 30 HIS CD2 1 1 5 2981 1 1 30 HIS CE1 C 3.992 6.673 -5.659 1.00 . A A . 30 HIS CE1 1 1 5 2982 1 1 30 HIS CG C 4.600 4.898 -4.503 1.00 . A A . 30 HIS CG 1 1 5 2983 1 1 30 HIS H H 6.359 2.162 -4.678 1.00 . A A . 30 HIS H 1 1 5 2984 1 1 30 HIS HA H 6.745 4.353 -2.747 1.00 . A A . 30 HIS HA 1 1 5 2985 1 1 30 HIS HB2 H 4.089 3.130 -3.498 1.00 . A A . 30 HIS HB2 1 1 5 2986 1 1 30 HIS HB3 H 4.358 4.520 -2.450 1.00 . A A . 30 HIS HB3 1 1 5 2987 1 1 30 HIS HD1 H 3.471 6.480 -3.689 1.00 . A A . 30 HIS HD1 1 1 5 2988 1 1 30 HIS HD2 H 5.644 3.941 -6.154 1.00 . A A . 30 HIS HD2 1 1 5 2989 1 1 30 HIS HE1 H 3.554 7.622 -5.930 1.00 . A A . 30 HIS HE1 1 1 5 2990 1 1 30 HIS HE2 H 4.750 6.000 -7.432 1.00 . A A . 30 HIS HE2 1 1 5 2991 1 1 30 HIS N N 6.720 2.989 -4.295 1.00 . A A . 30 HIS N 1 1 5 2992 1 1 30 HIS ND1 N 3.928 6.101 -4.469 1.00 . A A . 30 HIS ND1 1 1 5 2993 1 1 30 HIS NE2 N 4.681 5.887 -6.463 1.00 . A A . 30 HIS NE2 1 1 5 2994 1 1 30 HIS O O 6.733 1.383 -2.114 1.00 . A A . 30 HIS O 1 1 5 2995 1 1 31 TYR C C 4.176 2.060 1.104 1.00 . A A . 31 TYR C 1 1 5 2996 1 1 31 TYR CA C 5.464 1.867 0.306 1.00 . A A . 31 TYR CA 1 1 5 2997 1 1 31 TYR CB C 6.674 2.082 1.218 1.00 . A A . 31 TYR CB 1 1 5 2998 1 1 31 TYR CD1 C 8.042 -0.020 1.492 1.00 . A A . 31 TYR CD1 1 1 5 2999 1 1 31 TYR CD2 C 8.795 1.615 -0.070 1.00 . A A . 31 TYR CD2 1 1 5 3000 1 1 31 TYR CE1 C 9.124 -0.821 1.183 1.00 . A A . 31 TYR CE1 1 1 5 3001 1 1 31 TYR CE2 C 9.880 0.820 -0.386 1.00 . A A . 31 TYR CE2 1 1 5 3002 1 1 31 TYR CG C 7.859 1.210 0.873 1.00 . A A . 31 TYR CG 1 1 5 3003 1 1 31 TYR CZ C 10.040 -0.397 0.243 1.00 . A A . 31 TYR CZ 1 1 5 3004 1 1 31 TYR H H 5.086 3.657 -0.762 1.00 . A A . 31 TYR H 1 1 5 3005 1 1 31 TYR HA H 5.489 0.859 -0.077 1.00 . A A . 31 TYR HA 1 1 5 3006 1 1 31 TYR HB2 H 6.990 3.112 1.147 1.00 . A A . 31 TYR HB2 1 1 5 3007 1 1 31 TYR HB3 H 6.389 1.868 2.238 1.00 . A A . 31 TYR HB3 1 1 5 3008 1 1 31 TYR HD1 H 7.323 -0.349 2.227 1.00 . A A . 31 TYR HD1 1 1 5 3009 1 1 31 TYR HD2 H 8.668 2.569 -0.560 1.00 . A A . 31 TYR HD2 1 1 5 3010 1 1 31 TYR HE1 H 9.248 -1.773 1.676 1.00 . A A . 31 TYR HE1 1 1 5 3011 1 1 31 TYR HE2 H 10.598 1.152 -1.121 1.00 . A A . 31 TYR HE2 1 1 5 3012 1 1 31 TYR HH H 11.903 -0.645 -0.165 1.00 . A A . 31 TYR HH 1 1 5 3013 1 1 31 TYR N N 5.523 2.782 -0.830 1.00 . A A . 31 TYR N 1 1 5 3014 1 1 31 TYR O O 3.710 3.185 1.286 1.00 . A A . 31 TYR O 1 1 5 3015 1 1 31 TYR OH O 11.119 -1.192 -0.068 1.00 . A A . 31 TYR OH 1 1 5 3016 1 1 32 CYS C C 2.671 1.437 3.796 1.00 . A A . 32 CYS C 1 1 5 3017 1 1 32 CYS CA C 2.378 1.003 2.364 1.00 . A A . 32 CYS CA 1 1 5 3018 1 1 32 CYS CB C 1.688 -0.364 2.359 1.00 . A A . 32 CYS CB 1 1 5 3019 1 1 32 CYS H H 4.029 0.088 1.407 1.00 . A A . 32 CYS H 1 1 5 3020 1 1 32 CYS HA H 1.723 1.729 1.908 1.00 . A A . 32 CYS HA 1 1 5 3021 1 1 32 CYS HB2 H 2.054 -0.940 1.523 1.00 . A A . 32 CYS HB2 1 1 5 3022 1 1 32 CYS HB3 H 1.927 -0.882 3.276 1.00 . A A . 32 CYS HB3 1 1 5 3023 1 1 32 CYS N N 3.608 0.955 1.581 1.00 . A A . 32 CYS N 1 1 5 3024 1 1 32 CYS O O 3.728 1.123 4.345 1.00 . A A . 32 CYS O 1 1 5 3025 1 1 32 CYS SG S -0.130 -0.288 2.223 1.00 . A A . 32 CYS SG 1 1 5 3026 1 1 33 THR C C 1.135 1.761 6.751 1.00 . A A . 33 THR C 1 1 5 3027 1 1 33 THR CA C 1.898 2.641 5.763 1.00 . A A . 33 THR CA 1 1 5 3028 1 1 33 THR CB C 1.419 4.089 5.879 1.00 . A A . 33 THR CB 1 1 5 3029 1 1 33 THR CG2 C 1.867 4.964 4.728 1.00 . A A . 33 THR CG2 1 1 5 3030 1 1 33 THR H H 0.914 2.382 3.906 1.00 . A A . 33 THR H 1 1 5 3031 1 1 33 THR HA H 2.950 2.600 6.003 1.00 . A A . 33 THR HA 1 1 5 3032 1 1 33 THR HB H 1.812 4.515 6.791 1.00 . A A . 33 THR HB 1 1 5 3033 1 1 33 THR HG1 H -0.272 4.362 6.829 1.00 . A A . 33 THR HG1 1 1 5 3034 1 1 33 THR HG21 H 1.483 4.564 3.801 1.00 . A A . 33 THR HG21 1 1 5 3035 1 1 33 THR HG22 H 1.492 5.967 4.870 1.00 . A A . 33 THR HG22 1 1 5 3036 1 1 33 THR HG23 H 2.946 4.985 4.690 1.00 . A A . 33 THR HG23 1 1 5 3037 1 1 33 THR N N 1.734 2.162 4.395 1.00 . A A . 33 THR N 1 1 5 3038 1 1 33 THR O O 0.892 2.162 7.889 1.00 . A A . 33 THR O 1 1 5 3039 1 1 33 THR OG1 O 0.005 4.146 5.936 1.00 . A A . 33 THR OG1 1 1 5 3040 1 1 34 GLY C C -1.133 0.313 7.889 1.00 . A A . 34 GLY C 1 1 5 3041 1 1 34 GLY CA C 0.029 -0.353 7.174 1.00 . A A . 34 GLY CA 1 1 5 3042 1 1 34 GLY H H 0.982 0.293 5.394 1.00 . A A . 34 GLY H 1 1 5 3043 1 1 34 GLY HA2 H 0.708 -0.753 7.912 1.00 . A A . 34 GLY HA2 1 1 5 3044 1 1 34 GLY HA3 H -0.353 -1.166 6.575 1.00 . A A . 34 GLY HA3 1 1 5 3045 1 1 34 GLY N N 0.760 0.561 6.311 1.00 . A A . 34 GLY N 1 1 5 3046 1 1 34 GLY O O -1.533 -0.117 8.971 1.00 . A A . 34 GLY O 1 1 5 3047 1 1 35 ARG C C -3.793 2.523 6.794 1.00 . A A . 35 ARG C 1 1 5 3048 1 1 35 ARG CA C -2.798 2.089 7.868 1.00 . A A . 35 ARG CA 1 1 5 3049 1 1 35 ARG CB C -2.296 3.312 8.637 1.00 . A A . 35 ARG CB 1 1 5 3050 1 1 35 ARG CD C -2.672 2.709 11.047 1.00 . A A . 35 ARG CD 1 1 5 3051 1 1 35 ARG CG C -3.094 3.609 9.896 1.00 . A A . 35 ARG CG 1 1 5 3052 1 1 35 ARG CZ C -1.732 4.242 12.732 1.00 . A A . 35 ARG CZ 1 1 5 3053 1 1 35 ARG H H -1.314 1.659 6.421 1.00 . A A . 35 ARG H 1 1 5 3054 1 1 35 ARG HA H -3.298 1.424 8.556 1.00 . A A . 35 ARG HA 1 1 5 3055 1 1 35 ARG HB2 H -1.266 3.148 8.919 1.00 . A A . 35 ARG HB2 1 1 5 3056 1 1 35 ARG HB3 H -2.349 4.176 7.991 1.00 . A A . 35 ARG HB3 1 1 5 3057 1 1 35 ARG HD2 H -3.350 1.871 11.099 1.00 . A A . 35 ARG HD2 1 1 5 3058 1 1 35 ARG HD3 H -1.671 2.351 10.859 1.00 . A A . 35 ARG HD3 1 1 5 3059 1 1 35 ARG HE H -3.459 3.260 12.917 1.00 . A A . 35 ARG HE 1 1 5 3060 1 1 35 ARG HG2 H -2.932 4.638 10.180 1.00 . A A . 35 ARG HG2 1 1 5 3061 1 1 35 ARG HG3 H -4.142 3.450 9.692 1.00 . A A . 35 ARG HG3 1 1 5 3062 1 1 35 ARG HH11 H -0.598 4.026 11.070 1.00 . A A . 35 ARG HH11 1 1 5 3063 1 1 35 ARG HH12 H 0.041 5.099 12.270 1.00 . A A . 35 ARG HH12 1 1 5 3064 1 1 35 ARG HH21 H -2.620 4.670 14.496 1.00 . A A . 35 ARG HH21 1 1 5 3065 1 1 35 ARG HH22 H -1.106 5.464 14.215 1.00 . A A . 35 ARG HH22 1 1 5 3066 1 1 35 ARG N N -1.676 1.364 7.282 1.00 . A A . 35 ARG N 1 1 5 3067 1 1 35 ARG NE N -2.691 3.413 12.327 1.00 . A A . 35 ARG NE 1 1 5 3068 1 1 35 ARG NH1 N -0.677 4.474 11.960 1.00 . A A . 35 ARG NH1 1 1 5 3069 1 1 35 ARG NH2 N -1.827 4.841 13.911 1.00 . A A . 35 ARG NH2 1 1 5 3070 1 1 35 ARG O O -4.608 3.419 7.016 1.00 . A A . 35 ARG O 1 1 5 3071 1 1 36 SER C C -4.360 1.281 3.339 1.00 . A A . 36 SER C 1 1 5 3072 1 1 36 SER CA C -4.617 2.204 4.525 1.00 . A A . 36 SER CA 1 1 5 3073 1 1 36 SER CB C -4.437 3.663 4.100 1.00 . A A . 36 SER CB 1 1 5 3074 1 1 36 SER H H -3.053 1.178 5.510 1.00 . A A . 36 SER H 1 1 5 3075 1 1 36 SER HA H -5.631 2.060 4.866 1.00 . A A . 36 SER HA 1 1 5 3076 1 1 36 SER HB2 H -4.062 4.235 4.935 1.00 . A A . 36 SER HB2 1 1 5 3077 1 1 36 SER HB3 H -3.731 3.713 3.284 1.00 . A A . 36 SER HB3 1 1 5 3078 1 1 36 SER HG H -6.216 4.407 4.441 1.00 . A A . 36 SER HG 1 1 5 3079 1 1 36 SER N N -3.722 1.883 5.630 1.00 . A A . 36 SER N 1 1 5 3080 1 1 36 SER O O -3.269 0.729 3.197 1.00 . A A . 36 SER O 1 1 5 3081 1 1 36 SER OG O -5.666 4.227 3.676 1.00 . A A . 36 SER OG 1 1 5 3082 1 1 37 CYS C C -5.018 1.097 0.057 1.00 . A A . 37 CYS C 1 1 5 3083 1 1 37 CYS CA C -5.242 0.263 1.317 1.00 . A A . 37 CYS CA 1 1 5 3084 1 1 37 CYS CB C -6.494 -0.601 1.159 1.00 . A A . 37 CYS CB 1 1 5 3085 1 1 37 CYS H H -6.214 1.586 2.650 1.00 . A A . 37 CYS H 1 1 5 3086 1 1 37 CYS HA H -4.388 -0.380 1.466 1.00 . A A . 37 CYS HA 1 1 5 3087 1 1 37 CYS HB2 H -7.336 -0.081 1.591 1.00 . A A . 37 CYS HB2 1 1 5 3088 1 1 37 CYS HB3 H -6.679 -0.764 0.108 1.00 . A A . 37 CYS HB3 1 1 5 3089 1 1 37 CYS N N -5.367 1.119 2.489 1.00 . A A . 37 CYS N 1 1 5 3090 1 1 37 CYS O O -5.197 0.611 -1.060 1.00 . A A . 37 CYS O 1 1 5 3091 1 1 37 CYS SG S -6.382 -2.231 1.965 1.00 . A A . 37 CYS SG 1 1 5 3092 1 1 38 GLU C C -2.907 3.651 -0.949 1.00 . A A . 38 GLU C 1 1 5 3093 1 1 38 GLU CA C -4.379 3.255 -0.876 1.00 . A A . 38 GLU CA 1 1 5 3094 1 1 38 GLU CB C -5.249 4.507 -0.751 1.00 . A A . 38 GLU CB 1 1 5 3095 1 1 38 GLU CD C -7.529 5.257 -1.541 1.00 . A A . 38 GLU CD 1 1 5 3096 1 1 38 GLU CG C -6.741 4.216 -0.769 1.00 . A A . 38 GLU CG 1 1 5 3097 1 1 38 GLU H H -4.502 2.686 1.159 1.00 . A A . 38 GLU H 1 1 5 3098 1 1 38 GLU HA H -4.644 2.734 -1.784 1.00 . A A . 38 GLU HA 1 1 5 3099 1 1 38 GLU HB2 H -5.012 5.005 0.177 1.00 . A A . 38 GLU HB2 1 1 5 3100 1 1 38 GLU HB3 H -5.024 5.171 -1.573 1.00 . A A . 38 GLU HB3 1 1 5 3101 1 1 38 GLU HG2 H -6.901 3.252 -1.229 1.00 . A A . 38 GLU HG2 1 1 5 3102 1 1 38 GLU HG3 H -7.102 4.193 0.248 1.00 . A A . 38 GLU HG3 1 1 5 3103 1 1 38 GLU N N -4.626 2.355 0.245 1.00 . A A . 38 GLU N 1 1 5 3104 1 1 38 GLU O O -2.477 4.607 -0.304 1.00 . A A . 38 GLU O 1 1 5 3105 1 1 38 GLU OE1 O -7.574 5.165 -2.785 1.00 . A A . 38 GLU OE1 1 1 5 3106 1 1 38 GLU OE2 O -8.100 6.164 -0.900 1.00 . A A . 38 GLU OE2 1 1 5 3107 1 1 39 CYS C C -0.470 4.648 -2.251 1.00 . A A . 39 CYS C 1 1 5 3108 1 1 39 CYS CA C -0.714 3.176 -1.913 1.00 . A A . 39 CYS CA 1 1 5 3109 1 1 39 CYS CB C -0.144 2.282 -3.019 1.00 . A A . 39 CYS CB 1 1 5 3110 1 1 39 CYS H H -2.546 2.163 -2.231 1.00 . A A . 39 CYS H 1 1 5 3111 1 1 39 CYS HA H -0.219 2.942 -0.984 1.00 . A A . 39 CYS HA 1 1 5 3112 1 1 39 CYS HB2 H -0.485 1.270 -2.863 1.00 . A A . 39 CYS HB2 1 1 5 3113 1 1 39 CYS HB3 H -0.507 2.633 -3.976 1.00 . A A . 39 CYS HB3 1 1 5 3114 1 1 39 CYS N N -2.141 2.909 -1.744 1.00 . A A . 39 CYS N 1 1 5 3115 1 1 39 CYS O O -0.755 5.091 -3.364 1.00 . A A . 39 CYS O 1 1 5 3116 1 1 39 CYS SG S 1.675 2.243 -3.099 1.00 . A A . 39 CYS SG 1 1 5 3117 1 1 40 PRO C C 1.039 7.137 -2.814 1.00 . A A . 40 PRO C 1 1 5 3118 1 1 40 PRO CA C 0.331 6.857 -1.493 1.00 . A A . 40 PRO CA 1 1 5 3119 1 1 40 PRO CB C 1.238 7.207 -0.315 1.00 . A A . 40 PRO CB 1 1 5 3120 1 1 40 PRO CD C 0.426 4.988 0.071 1.00 . A A . 40 PRO CD 1 1 5 3121 1 1 40 PRO CG C 0.832 6.263 0.762 1.00 . A A . 40 PRO CG 1 1 5 3122 1 1 40 PRO HA H -0.574 7.444 -1.440 1.00 . A A . 40 PRO HA 1 1 5 3123 1 1 40 PRO HB2 H 2.272 7.067 -0.598 1.00 . A A . 40 PRO HB2 1 1 5 3124 1 1 40 PRO HB3 H 1.074 8.233 -0.022 1.00 . A A . 40 PRO HB3 1 1 5 3125 1 1 40 PRO HD2 H 1.255 4.297 0.039 1.00 . A A . 40 PRO HD2 1 1 5 3126 1 1 40 PRO HD3 H -0.420 4.541 0.572 1.00 . A A . 40 PRO HD3 1 1 5 3127 1 1 40 PRO HG2 H 1.667 6.081 1.424 1.00 . A A . 40 PRO HG2 1 1 5 3128 1 1 40 PRO HG3 H -0.001 6.672 1.314 1.00 . A A . 40 PRO HG3 1 1 5 3129 1 1 40 PRO N N 0.058 5.430 -1.290 1.00 . A A . 40 PRO N 1 1 5 3130 1 1 40 PRO O O 1.538 6.223 -3.470 1.00 . A A . 40 PRO O 1 1 5 3131 1 1 41 SER C C 3.131 9.335 -4.183 1.00 . A A . 41 SER C 1 1 5 3132 1 1 41 SER CA C 1.721 8.813 -4.443 1.00 . A A . 41 SER CA 1 1 5 3133 1 1 41 SER CB C 0.889 9.888 -5.147 1.00 . A A . 41 SER CB 1 1 5 3134 1 1 41 SER H H 0.659 9.092 -2.634 1.00 . A A . 41 SER H 1 1 5 3135 1 1 41 SER HA H 1.783 7.945 -5.081 1.00 . A A . 41 SER HA 1 1 5 3136 1 1 41 SER HB2 H 0.789 10.745 -4.497 1.00 . A A . 41 SER HB2 1 1 5 3137 1 1 41 SER HB3 H 1.386 10.184 -6.059 1.00 . A A . 41 SER HB3 1 1 5 3138 1 1 41 SER HG H -1.062 9.897 -4.971 1.00 . A A . 41 SER HG 1 1 5 3139 1 1 41 SER N N 1.076 8.409 -3.199 1.00 . A A . 41 SER N 1 1 5 3140 1 1 41 SER O O 3.631 10.189 -4.914 1.00 . A A . 41 SER O 1 1 5 3141 1 1 41 SER OG O -0.404 9.405 -5.467 1.00 . A A . 41 SER OG 1 1 5 3142 1 1 42 TYR C C 5.977 8.018 -2.416 1.00 . A A . 42 TYR C 1 1 5 3143 1 1 42 TYR CA C 5.120 9.227 -2.785 1.00 . A A . 42 TYR CA 1 1 5 3144 1 1 42 TYR CB C 5.086 10.221 -1.622 1.00 . A A . 42 TYR CB 1 1 5 3145 1 1 42 TYR CD1 C 3.324 9.831 0.145 1.00 . A A . 42 TYR CD1 1 1 5 3146 1 1 42 TYR CD2 C 5.467 8.831 0.451 1.00 . A A . 42 TYR CD2 1 1 5 3147 1 1 42 TYR CE1 C 2.893 9.280 1.337 1.00 . A A . 42 TYR CE1 1 1 5 3148 1 1 42 TYR CE2 C 5.043 8.276 1.643 1.00 . A A . 42 TYR CE2 1 1 5 3149 1 1 42 TYR CG C 4.617 9.616 -0.317 1.00 . A A . 42 TYR CG 1 1 5 3150 1 1 42 TYR CZ C 3.755 8.504 2.082 1.00 . A A . 42 TYR CZ 1 1 5 3151 1 1 42 TYR H H 3.316 8.136 -2.593 1.00 . A A . 42 TYR H 1 1 5 3152 1 1 42 TYR HA H 5.553 9.710 -3.648 1.00 . A A . 42 TYR HA 1 1 5 3153 1 1 42 TYR HB2 H 6.079 10.614 -1.465 1.00 . A A . 42 TYR HB2 1 1 5 3154 1 1 42 TYR HB3 H 4.418 11.033 -1.871 1.00 . A A . 42 TYR HB3 1 1 5 3155 1 1 42 TYR HD1 H 2.651 10.439 -0.441 1.00 . A A . 42 TYR HD1 1 1 5 3156 1 1 42 TYR HD2 H 6.475 8.656 0.105 1.00 . A A . 42 TYR HD2 1 1 5 3157 1 1 42 TYR HE1 H 1.884 9.458 1.680 1.00 . A A . 42 TYR HE1 1 1 5 3158 1 1 42 TYR HE2 H 5.719 7.669 2.226 1.00 . A A . 42 TYR HE2 1 1 5 3159 1 1 42 TYR HH H 3.742 8.415 4.002 1.00 . A A . 42 TYR HH 1 1 5 3160 1 1 42 TYR N N 3.767 8.814 -3.138 1.00 . A A . 42 TYR N 1 1 5 3161 1 1 42 TYR O O 5.478 7.039 -1.861 1.00 . A A . 42 TYR O 1 1 5 3162 1 1 42 TYR OH O 3.329 7.953 3.269 1.00 . A A . 42 TYR OH 1 1 5 3163 1 1 43 PRO C C 8.526 6.876 -0.930 1.00 . A A . 43 PRO C 1 1 5 3164 1 1 43 PRO CA C 8.210 6.973 -2.418 1.00 . A A . 43 PRO CA 1 1 5 3165 1 1 43 PRO CB C 9.465 7.344 -3.209 1.00 . A A . 43 PRO CB 1 1 5 3166 1 1 43 PRO CD C 7.966 9.199 -3.384 1.00 . A A . 43 PRO CD 1 1 5 3167 1 1 43 PRO CG C 9.422 8.830 -3.303 1.00 . A A . 43 PRO CG 1 1 5 3168 1 1 43 PRO HA H 7.828 6.025 -2.767 1.00 . A A . 43 PRO HA 1 1 5 3169 1 1 43 PRO HB2 H 10.342 7.005 -2.677 1.00 . A A . 43 PRO HB2 1 1 5 3170 1 1 43 PRO HB3 H 9.428 6.886 -4.186 1.00 . A A . 43 PRO HB3 1 1 5 3171 1 1 43 PRO HD2 H 7.781 10.123 -2.857 1.00 . A A . 43 PRO HD2 1 1 5 3172 1 1 43 PRO HD3 H 7.655 9.283 -4.415 1.00 . A A . 43 PRO HD3 1 1 5 3173 1 1 43 PRO HG2 H 9.871 9.266 -2.422 1.00 . A A . 43 PRO HG2 1 1 5 3174 1 1 43 PRO HG3 H 9.942 9.156 -4.191 1.00 . A A . 43 PRO HG3 1 1 5 3175 1 1 43 PRO N N 7.286 8.070 -2.721 1.00 . A A . 43 PRO N 1 1 5 3176 1 1 43 PRO O O 8.557 7.884 -0.224 1.00 . A A . 43 PRO O 1 1 5 3177 1 1 44 GLY C C 7.865 5.653 1.841 1.00 . A A . 44 GLY C 1 1 5 3178 1 1 44 GLY CA C 9.070 5.448 0.943 1.00 . A A . 44 GLY CA 1 1 5 3179 1 1 44 GLY H H 8.720 4.889 -1.069 1.00 . A A . 44 GLY H 1 1 5 3180 1 1 44 GLY HA2 H 9.845 6.142 1.235 1.00 . A A . 44 GLY HA2 1 1 5 3181 1 1 44 GLY HA3 H 9.435 4.440 1.074 1.00 . A A . 44 GLY HA3 1 1 5 3182 1 1 44 GLY N N 8.759 5.655 -0.459 1.00 . A A . 44 GLY N 1 1 5 3183 1 1 44 GLY O O 6.724 5.578 1.386 1.00 . A A . 44 GLY O 1 1 5 3184 1 1 45 ASN C C 7.273 7.417 4.868 1.00 . A A . 45 ASN C 1 1 5 3185 1 1 45 ASN CA C 7.048 6.129 4.084 1.00 . A A . 45 ASN CA 1 1 5 3186 1 1 45 ASN CB C 6.952 4.943 5.045 1.00 . A A . 45 ASN CB 1 1 5 3187 1 1 45 ASN CG C 5.789 5.073 6.010 1.00 . A A . 45 ASN CG 1 1 5 3188 1 1 45 ASN H H 9.051 5.959 3.421 1.00 . A A . 45 ASN H 1 1 5 3189 1 1 45 ASN HA H 6.121 6.212 3.536 1.00 . A A . 45 ASN HA 1 1 5 3190 1 1 45 ASN HB2 H 6.822 4.035 4.476 1.00 . A A . 45 ASN HB2 1 1 5 3191 1 1 45 ASN HB3 H 7.866 4.876 5.617 1.00 . A A . 45 ASN HB3 1 1 5 3192 1 1 45 ASN HD21 H 6.728 3.926 7.335 1.00 . A A . 45 ASN HD21 1 1 5 3193 1 1 45 ASN HD22 H 5.172 4.504 7.812 1.00 . A A . 45 ASN HD22 1 1 5 3194 1 1 45 ASN N N 8.120 5.912 3.119 1.00 . A A . 45 ASN N 1 1 5 3195 1 1 45 ASN ND2 N 5.908 4.437 7.169 1.00 . A A . 45 ASN ND2 1 1 5 3196 1 1 45 ASN O O 8.387 7.938 4.918 1.00 . A A . 45 ASN O 1 1 5 3197 1 1 45 ASN OD1 O 4.796 5.739 5.717 1.00 . A A . 45 ASN OD1 1 1 5 3198 1 1 46 GLY C C 6.569 8.886 7.723 1.00 . A A . 46 GLY C 1 1 5 3199 1 1 46 GLY CA C 6.311 9.149 6.253 1.00 . A A . 46 GLY CA 1 1 5 3200 1 1 46 GLY H H 5.346 7.467 5.404 1.00 . A A . 46 GLY H 1 1 5 3201 1 1 46 GLY HA2 H 5.390 9.704 6.153 1.00 . A A . 46 GLY HA2 1 1 5 3202 1 1 46 GLY HA3 H 7.121 9.745 5.858 1.00 . A A . 46 GLY HA3 1 1 5 3203 1 1 46 GLY N N 6.208 7.926 5.479 1.00 . A A . 46 GLY N 1 1 5 3204 1 1 46 GLY O O 7.719 8.548 8.073 1.00 . A A . 46 GLY O 1 1 5 3205 1 1 46 GLY OXT O 5.620 9.018 8.525 1.00 . A A . 46 GLY OXT 1 1 6 3206 1 1 1 ALA C C -19.115 -4.484 7.705 1.00 . A A . 1 ALA C 1 1 6 3207 1 1 1 ALA CA C -20.258 -4.944 8.603 1.00 . A A . 1 ALA CA 1 1 6 3208 1 1 1 ALA CB C -19.756 -5.177 10.020 1.00 . A A . 1 ALA CB 1 1 6 3209 1 1 1 ALA H1 H -20.127 -6.827 7.783 1.00 . A A . 1 ALA H1 1 1 6 3210 1 1 1 ALA H2 H -21.466 -6.594 8.832 1.00 . A A . 1 ALA H2 1 1 6 3211 1 1 1 ALA H3 H -21.478 -5.911 7.258 1.00 . A A . 1 ALA H3 1 1 6 3212 1 1 1 ALA HA H -21.008 -4.168 8.637 1.00 . A A . 1 ALA HA 1 1 6 3213 1 1 1 ALA HB1 H -19.145 -4.341 10.327 1.00 . A A . 1 ALA HB1 1 1 6 3214 1 1 1 ALA HB2 H -20.598 -5.273 10.689 1.00 . A A . 1 ALA HB2 1 1 6 3215 1 1 1 ALA HB3 H -19.168 -6.082 10.049 1.00 . A A . 1 ALA HB3 1 1 6 3216 1 1 1 ALA N N -20.889 -6.180 8.071 1.00 . A A . 1 ALA N 1 1 6 3217 1 1 1 ALA O O -19.246 -3.508 6.967 1.00 . A A . 1 ALA O 1 1 6 3218 1 1 2 MET C C -16.925 -5.481 5.580 1.00 . A A . 2 MET C 1 1 6 3219 1 1 2 MET CA C -16.825 -4.857 6.968 1.00 . A A . 2 MET CA 1 1 6 3220 1 1 2 MET CB C -15.547 -5.331 7.662 1.00 . A A . 2 MET CB 1 1 6 3221 1 1 2 MET CE C -14.830 -2.316 7.424 1.00 . A A . 2 MET CE 1 1 6 3222 1 1 2 MET CG C -15.245 -4.589 8.954 1.00 . A A . 2 MET CG 1 1 6 3223 1 1 2 MET H H -17.949 -5.961 8.383 1.00 . A A . 2 MET H 1 1 6 3224 1 1 2 MET HA H -16.791 -3.783 6.865 1.00 . A A . 2 MET HA 1 1 6 3225 1 1 2 MET HB2 H -15.643 -6.382 7.890 1.00 . A A . 2 MET HB2 1 1 6 3226 1 1 2 MET HB3 H -14.713 -5.192 6.989 1.00 . A A . 2 MET HB3 1 1 6 3227 1 1 2 MET HE1 H -15.877 -2.185 7.653 1.00 . A A . 2 MET HE1 1 1 6 3228 1 1 2 MET HE2 H -14.355 -1.349 7.345 1.00 . A A . 2 MET HE2 1 1 6 3229 1 1 2 MET HE3 H -14.730 -2.844 6.487 1.00 . A A . 2 MET HE3 1 1 6 3230 1 1 2 MET HG2 H -16.163 -4.165 9.332 1.00 . A A . 2 MET HG2 1 1 6 3231 1 1 2 MET HG3 H -14.851 -5.292 9.673 1.00 . A A . 2 MET HG3 1 1 6 3232 1 1 2 MET N N -17.993 -5.193 7.775 1.00 . A A . 2 MET N 1 1 6 3233 1 1 2 MET O O -17.591 -6.500 5.393 1.00 . A A . 2 MET O 1 1 6 3234 1 1 2 MET SD S -14.047 -3.261 8.728 1.00 . A A . 2 MET SD 1 1 6 3235 1 1 3 ASP C C -14.863 -5.393 2.658 1.00 . A A . 3 ASP C 1 1 6 3236 1 1 3 ASP CA C -16.273 -5.358 3.238 1.00 . A A . 3 ASP CA 1 1 6 3237 1 1 3 ASP CB C -17.174 -4.481 2.367 1.00 . A A . 3 ASP CB 1 1 6 3238 1 1 3 ASP CG C -17.550 -5.156 1.062 1.00 . A A . 3 ASP CG 1 1 6 3239 1 1 3 ASP H H -15.747 -4.055 4.821 1.00 . A A . 3 ASP H 1 1 6 3240 1 1 3 ASP HA H -16.669 -6.363 3.252 1.00 . A A . 3 ASP HA 1 1 6 3241 1 1 3 ASP HB2 H -18.081 -4.257 2.908 1.00 . A A . 3 ASP HB2 1 1 6 3242 1 1 3 ASP HB3 H -16.658 -3.560 2.139 1.00 . A A . 3 ASP HB3 1 1 6 3243 1 1 3 ASP N N -16.260 -4.863 4.610 1.00 . A A . 3 ASP N 1 1 6 3244 1 1 3 ASP O O -14.667 -5.173 1.463 1.00 . A A . 3 ASP O 1 1 6 3245 1 1 3 ASP OD1 O -18.558 -4.744 0.450 1.00 . A A . 3 ASP OD1 1 1 6 3246 1 1 3 ASP OD2 O -16.837 -6.095 0.652 1.00 . A A . 3 ASP OD2 1 1 6 3247 1 1 4 CYS C C -12.033 -4.399 2.516 1.00 . A A . 4 CYS C 1 1 6 3248 1 1 4 CYS CA C -12.492 -5.737 3.085 1.00 . A A . 4 CYS CA 1 1 6 3249 1 1 4 CYS CB C -12.307 -6.834 2.036 1.00 . A A . 4 CYS CB 1 1 6 3250 1 1 4 CYS H H -14.104 -5.839 4.453 1.00 . A A . 4 CYS H 1 1 6 3251 1 1 4 CYS HA H -11.889 -5.972 3.949 1.00 . A A . 4 CYS HA 1 1 6 3252 1 1 4 CYS HB2 H -13.167 -6.847 1.384 1.00 . A A . 4 CYS HB2 1 1 6 3253 1 1 4 CYS HB3 H -11.424 -6.617 1.453 1.00 . A A . 4 CYS HB3 1 1 6 3254 1 1 4 CYS N N -13.884 -5.672 3.513 1.00 . A A . 4 CYS N 1 1 6 3255 1 1 4 CYS O O -12.819 -3.458 2.397 1.00 . A A . 4 CYS O 1 1 6 3256 1 1 4 CYS SG S -12.116 -8.509 2.731 1.00 . A A . 4 CYS SG 1 1 6 3257 1 1 5 THR C C -9.235 -3.444 0.453 1.00 . A A . 5 THR C 1 1 6 3258 1 1 5 THR CA C -10.179 -3.109 1.604 1.00 . A A . 5 THR CA 1 1 6 3259 1 1 5 THR CB C -9.431 -2.332 2.689 1.00 . A A . 5 THR CB 1 1 6 3260 1 1 5 THR CG2 C -9.602 -0.832 2.578 1.00 . A A . 5 THR CG2 1 1 6 3261 1 1 5 THR H H -10.183 -5.110 2.284 1.00 . A A . 5 THR H 1 1 6 3262 1 1 5 THR HA H -10.986 -2.499 1.228 1.00 . A A . 5 THR HA 1 1 6 3263 1 1 5 THR HB H -8.377 -2.553 2.612 1.00 . A A . 5 THR HB 1 1 6 3264 1 1 5 THR HG1 H -9.140 -3.103 4.466 1.00 . A A . 5 THR HG1 1 1 6 3265 1 1 5 THR HG21 H -9.651 -0.552 1.536 1.00 . A A . 5 THR HG21 1 1 6 3266 1 1 5 THR HG22 H -10.516 -0.537 3.073 1.00 . A A . 5 THR HG22 1 1 6 3267 1 1 5 THR HG23 H -8.763 -0.339 3.045 1.00 . A A . 5 THR HG23 1 1 6 3268 1 1 5 THR N N -10.755 -4.325 2.164 1.00 . A A . 5 THR N 1 1 6 3269 1 1 5 THR O O -8.127 -3.933 0.670 1.00 . A A . 5 THR O 1 1 6 3270 1 1 5 THR OG1 O -9.873 -2.719 3.978 1.00 . A A . 5 THR OG1 1 1 6 3271 1 1 6 THR C C -8.003 -2.275 -2.323 1.00 . A A . 6 THR C 1 1 6 3272 1 1 6 THR CA C -8.881 -3.467 -1.956 1.00 . A A . 6 THR CA 1 1 6 3273 1 1 6 THR CB C -9.785 -3.830 -3.135 1.00 . A A . 6 THR CB 1 1 6 3274 1 1 6 THR CG2 C -10.496 -5.154 -2.958 1.00 . A A . 6 THR CG2 1 1 6 3275 1 1 6 THR H H -10.579 -2.801 -0.880 1.00 . A A . 6 THR H 1 1 6 3276 1 1 6 THR HA H -8.245 -4.310 -1.731 1.00 . A A . 6 THR HA 1 1 6 3277 1 1 6 THR HB H -9.184 -3.895 -4.030 1.00 . A A . 6 THR HB 1 1 6 3278 1 1 6 THR HG1 H -10.365 -1.967 -3.301 1.00 . A A . 6 THR HG1 1 1 6 3279 1 1 6 THR HG21 H -11.049 -5.145 -2.030 1.00 . A A . 6 THR HG21 1 1 6 3280 1 1 6 THR HG22 H -11.177 -5.310 -3.782 1.00 . A A . 6 THR HG22 1 1 6 3281 1 1 6 THR HG23 H -9.769 -5.953 -2.935 1.00 . A A . 6 THR HG23 1 1 6 3282 1 1 6 THR N N -9.685 -3.185 -0.771 1.00 . A A . 6 THR N 1 1 6 3283 1 1 6 THR O O -8.264 -1.146 -1.907 1.00 . A A . 6 THR O 1 1 6 3284 1 1 6 THR OG1 O -10.773 -2.835 -3.333 1.00 . A A . 6 THR OG1 1 1 6 3285 1 1 7 GLY C C -4.618 -1.947 -3.613 1.00 . A A . 7 GLY C 1 1 6 3286 1 1 7 GLY CA C -6.059 -1.478 -3.524 1.00 . A A . 7 GLY CA 1 1 6 3287 1 1 7 GLY H H -6.806 -3.455 -3.409 1.00 . A A . 7 GLY H 1 1 6 3288 1 1 7 GLY HA2 H -6.120 -0.667 -2.815 1.00 . A A . 7 GLY HA2 1 1 6 3289 1 1 7 GLY HA3 H -6.369 -1.117 -4.493 1.00 . A A . 7 GLY HA3 1 1 6 3290 1 1 7 GLY N N -6.962 -2.536 -3.108 1.00 . A A . 7 GLY N 1 1 6 3291 1 1 7 GLY O O -4.334 -3.127 -3.409 1.00 . A A . 7 GLY O 1 1 6 3292 1 1 8 PRO C C -1.597 -1.656 -2.695 1.00 . A A . 8 PRO C 1 1 6 3293 1 1 8 PRO CA C -2.257 -1.379 -4.046 1.00 . A A . 8 PRO CA 1 1 6 3294 1 1 8 PRO CB C -1.650 -0.134 -4.698 1.00 . A A . 8 PRO CB 1 1 6 3295 1 1 8 PRO CD C -3.930 0.392 -4.194 1.00 . A A . 8 PRO CD 1 1 6 3296 1 1 8 PRO CG C -2.550 0.982 -4.297 1.00 . A A . 8 PRO CG 1 1 6 3297 1 1 8 PRO HA H -2.112 -2.231 -4.694 1.00 . A A . 8 PRO HA 1 1 6 3298 1 1 8 PRO HB2 H -0.646 0.015 -4.331 1.00 . A A . 8 PRO HB2 1 1 6 3299 1 1 8 PRO HB3 H -1.631 -0.257 -5.771 1.00 . A A . 8 PRO HB3 1 1 6 3300 1 1 8 PRO HD2 H -4.474 0.846 -3.379 1.00 . A A . 8 PRO HD2 1 1 6 3301 1 1 8 PRO HD3 H -4.465 0.520 -5.123 1.00 . A A . 8 PRO HD3 1 1 6 3302 1 1 8 PRO HG2 H -2.240 1.378 -3.342 1.00 . A A . 8 PRO HG2 1 1 6 3303 1 1 8 PRO HG3 H -2.530 1.757 -5.049 1.00 . A A . 8 PRO HG3 1 1 6 3304 1 1 8 PRO N N -3.678 -1.037 -3.926 1.00 . A A . 8 PRO N 1 1 6 3305 1 1 8 PRO O O -0.727 -2.520 -2.587 1.00 . A A . 8 PRO O 1 1 6 3306 1 1 9 CYS C C -2.359 -1.984 0.528 1.00 . A A . 9 CYS C 1 1 6 3307 1 1 9 CYS CA C -1.459 -1.094 -0.326 1.00 . A A . 9 CYS CA 1 1 6 3308 1 1 9 CYS CB C -1.276 0.267 0.353 1.00 . A A . 9 CYS CB 1 1 6 3309 1 1 9 CYS H H -2.711 -0.248 -1.813 1.00 . A A . 9 CYS H 1 1 6 3310 1 1 9 CYS HA H -0.495 -1.569 -0.426 1.00 . A A . 9 CYS HA 1 1 6 3311 1 1 9 CYS HB2 H -0.678 0.900 -0.283 1.00 . A A . 9 CYS HB2 1 1 6 3312 1 1 9 CYS HB3 H -2.244 0.722 0.494 1.00 . A A . 9 CYS HB3 1 1 6 3313 1 1 9 CYS N N -2.015 -0.922 -1.667 1.00 . A A . 9 CYS N 1 1 6 3314 1 1 9 CYS O O -2.587 -1.707 1.704 1.00 . A A . 9 CYS O 1 1 6 3315 1 1 9 CYS SG S -0.457 0.196 1.981 1.00 . A A . 9 CYS SG 1 1 6 3316 1 1 10 CYS C C -3.529 -5.411 0.150 1.00 . A A . 10 CYS C 1 1 6 3317 1 1 10 CYS CA C -3.745 -3.981 0.634 1.00 . A A . 10 CYS CA 1 1 6 3318 1 1 10 CYS CB C -5.209 -3.576 0.447 1.00 . A A . 10 CYS CB 1 1 6 3319 1 1 10 CYS H H -2.655 -3.222 -1.011 1.00 . A A . 10 CYS H 1 1 6 3320 1 1 10 CYS HA H -3.499 -3.932 1.682 1.00 . A A . 10 CYS HA 1 1 6 3321 1 1 10 CYS HB2 H -5.316 -3.066 -0.498 1.00 . A A . 10 CYS HB2 1 1 6 3322 1 1 10 CYS HB3 H -5.822 -4.465 0.442 1.00 . A A . 10 CYS HB3 1 1 6 3323 1 1 10 CYS N N -2.870 -3.053 -0.073 1.00 . A A . 10 CYS N 1 1 6 3324 1 1 10 CYS O O -3.240 -5.644 -1.023 1.00 . A A . 10 CYS O 1 1 6 3325 1 1 10 CYS SG S -5.843 -2.470 1.750 1.00 . A A . 10 CYS SG 1 1 6 3326 1 1 11 ARG C C -4.803 -8.403 0.285 1.00 . A A . 11 ARG C 1 1 6 3327 1 1 11 ARG CA C -3.489 -7.774 0.738 1.00 . A A . 11 ARG CA 1 1 6 3328 1 1 11 ARG CB C -2.934 -8.531 1.947 1.00 . A A . 11 ARG CB 1 1 6 3329 1 1 11 ARG CD C -1.071 -10.115 1.368 1.00 . A A . 11 ARG CD 1 1 6 3330 1 1 11 ARG CG C -2.560 -9.972 1.642 1.00 . A A . 11 ARG CG 1 1 6 3331 1 1 11 ARG CZ C -0.848 -12.568 1.438 1.00 . A A . 11 ARG CZ 1 1 6 3332 1 1 11 ARG H H -3.899 -6.114 1.984 1.00 . A A . 11 ARG H 1 1 6 3333 1 1 11 ARG HA H -2.777 -7.836 -0.071 1.00 . A A . 11 ARG HA 1 1 6 3334 1 1 11 ARG HB2 H -2.053 -8.020 2.304 1.00 . A A . 11 ARG HB2 1 1 6 3335 1 1 11 ARG HB3 H -3.680 -8.534 2.728 1.00 . A A . 11 ARG HB3 1 1 6 3336 1 1 11 ARG HD2 H -0.911 -10.096 0.300 1.00 . A A . 11 ARG HD2 1 1 6 3337 1 1 11 ARG HD3 H -0.553 -9.284 1.823 1.00 . A A . 11 ARG HD3 1 1 6 3338 1 1 11 ARG HE H 0.097 -11.298 2.653 1.00 . A A . 11 ARG HE 1 1 6 3339 1 1 11 ARG HG2 H -2.820 -10.589 2.488 1.00 . A A . 11 ARG HG2 1 1 6 3340 1 1 11 ARG HG3 H -3.110 -10.301 0.772 1.00 . A A . 11 ARG HG3 1 1 6 3341 1 1 11 ARG HH11 H -2.105 -11.882 0.009 1.00 . A A . 11 ARG HH11 1 1 6 3342 1 1 11 ARG HH12 H -1.930 -13.603 0.080 1.00 . A A . 11 ARG HH12 1 1 6 3343 1 1 11 ARG HH21 H 0.328 -13.562 2.747 1.00 . A A . 11 ARG HH21 1 1 6 3344 1 1 11 ARG HH22 H -0.550 -14.557 1.634 1.00 . A A . 11 ARG HH22 1 1 6 3345 1 1 11 ARG N N -3.669 -6.364 1.066 1.00 . A A . 11 ARG N 1 1 6 3346 1 1 11 ARG NE N -0.533 -11.362 1.905 1.00 . A A . 11 ARG NE 1 1 6 3347 1 1 11 ARG NH1 N -1.698 -12.694 0.426 1.00 . A A . 11 ARG NH1 1 1 6 3348 1 1 11 ARG NH2 N -0.313 -13.651 1.984 1.00 . A A . 11 ARG NH2 1 1 6 3349 1 1 11 ARG O O -5.194 -9.467 0.767 1.00 . A A . 11 ARG O 1 1 6 3350 1 1 12 GLN C C -7.885 -8.070 -0.169 1.00 . A A . 12 GLN C 1 1 6 3351 1 1 12 GLN CA C -6.748 -8.233 -1.179 1.00 . A A . 12 GLN CA 1 1 6 3352 1 1 12 GLN CB C -6.623 -9.703 -1.582 1.00 . A A . 12 GLN CB 1 1 6 3353 1 1 12 GLN CD C -8.885 -10.185 -2.599 1.00 . A A . 12 GLN CD 1 1 6 3354 1 1 12 GLN CG C -7.394 -10.056 -2.844 1.00 . A A . 12 GLN CG 1 1 6 3355 1 1 12 GLN H H -5.113 -6.901 -0.997 1.00 . A A . 12 GLN H 1 1 6 3356 1 1 12 GLN HA H -6.983 -7.651 -2.057 1.00 . A A . 12 GLN HA 1 1 6 3357 1 1 12 GLN HB2 H -5.581 -9.932 -1.747 1.00 . A A . 12 GLN HB2 1 1 6 3358 1 1 12 GLN HB3 H -6.994 -10.318 -0.775 1.00 . A A . 12 GLN HB3 1 1 6 3359 1 1 12 GLN HE21 H -9.201 -8.411 -3.441 1.00 . A A . 12 GLN HE21 1 1 6 3360 1 1 12 GLN HE22 H -10.609 -9.230 -2.864 1.00 . A A . 12 GLN HE22 1 1 6 3361 1 1 12 GLN HG2 H -7.231 -9.282 -3.578 1.00 . A A . 12 GLN HG2 1 1 6 3362 1 1 12 GLN HG3 H -7.024 -10.997 -3.225 1.00 . A A . 12 GLN HG3 1 1 6 3363 1 1 12 GLN N N -5.479 -7.740 -0.649 1.00 . A A . 12 GLN N 1 1 6 3364 1 1 12 GLN NE2 N -9.641 -9.173 -3.009 1.00 . A A . 12 GLN NE2 1 1 6 3365 1 1 12 GLN O O -9.000 -8.535 -0.408 1.00 . A A . 12 GLN O 1 1 6 3366 1 1 12 GLN OE1 O -9.352 -11.182 -2.048 1.00 . A A . 12 GLN OE1 1 1 6 3367 1 1 13 CYS C C -8.136 -6.291 3.094 1.00 . A A . 13 CYS C 1 1 6 3368 1 1 13 CYS CA C -8.632 -7.202 1.973 1.00 . A A . 13 CYS CA 1 1 6 3369 1 1 13 CYS CB C -9.083 -8.542 2.556 1.00 . A A . 13 CYS CB 1 1 6 3370 1 1 13 CYS H H -6.709 -7.056 1.098 1.00 . A A . 13 CYS H 1 1 6 3371 1 1 13 CYS HA H -9.476 -6.731 1.495 1.00 . A A . 13 CYS HA 1 1 6 3372 1 1 13 CYS HB2 H -9.457 -9.166 1.757 1.00 . A A . 13 CYS HB2 1 1 6 3373 1 1 13 CYS HB3 H -8.237 -9.028 3.019 1.00 . A A . 13 CYS HB3 1 1 6 3374 1 1 13 CYS N N -7.609 -7.410 0.954 1.00 . A A . 13 CYS N 1 1 6 3375 1 1 13 CYS O O -8.865 -5.413 3.555 1.00 . A A . 13 CYS O 1 1 6 3376 1 1 13 CYS SG S -10.399 -8.400 3.809 1.00 . A A . 13 CYS SG 1 1 6 3377 1 1 14 LYS C C -5.029 -5.043 4.181 1.00 . A A . 14 LYS C 1 1 6 3378 1 1 14 LYS CA C -6.333 -5.700 4.615 1.00 . A A . 14 LYS CA 1 1 6 3379 1 1 14 LYS CB C -6.093 -6.564 5.854 1.00 . A A . 14 LYS CB 1 1 6 3380 1 1 14 LYS CD C -7.307 -7.946 7.566 1.00 . A A . 14 LYS CD 1 1 6 3381 1 1 14 LYS CE C -8.725 -8.394 7.879 1.00 . A A . 14 LYS CE 1 1 6 3382 1 1 14 LYS CG C -7.294 -6.644 6.782 1.00 . A A . 14 LYS CG 1 1 6 3383 1 1 14 LYS H H -6.363 -7.223 3.142 1.00 . A A . 14 LYS H 1 1 6 3384 1 1 14 LYS HA H -7.046 -4.927 4.861 1.00 . A A . 14 LYS HA 1 1 6 3385 1 1 14 LYS HB2 H -5.843 -7.566 5.537 1.00 . A A . 14 LYS HB2 1 1 6 3386 1 1 14 LYS HB3 H -5.263 -6.154 6.409 1.00 . A A . 14 LYS HB3 1 1 6 3387 1 1 14 LYS HD2 H -6.820 -8.712 6.981 1.00 . A A . 14 LYS HD2 1 1 6 3388 1 1 14 LYS HD3 H -6.771 -7.802 8.493 1.00 . A A . 14 LYS HD3 1 1 6 3389 1 1 14 LYS HE2 H -9.196 -7.646 8.500 1.00 . A A . 14 LYS HE2 1 1 6 3390 1 1 14 LYS HE3 H -9.272 -8.488 6.953 1.00 . A A . 14 LYS HE3 1 1 6 3391 1 1 14 LYS HG2 H -7.256 -5.818 7.476 1.00 . A A . 14 LYS HG2 1 1 6 3392 1 1 14 LYS HG3 H -8.197 -6.580 6.192 1.00 . A A . 14 LYS HG3 1 1 6 3393 1 1 14 LYS HZ1 H -8.197 -9.639 9.471 1.00 . A A . 14 LYS HZ1 1 1 6 3394 1 1 14 LYS HZ2 H -9.730 -9.959 8.830 1.00 . A A . 14 LYS HZ2 1 1 6 3395 1 1 14 LYS HZ3 H -8.343 -10.444 7.991 1.00 . A A . 14 LYS HZ3 1 1 6 3396 1 1 14 LYS N N -6.901 -6.506 3.539 1.00 . A A . 14 LYS N 1 1 6 3397 1 1 14 LYS NZ N -8.751 -9.700 8.593 1.00 . A A . 14 LYS NZ 1 1 6 3398 1 1 14 LYS O O -4.205 -5.659 3.506 1.00 . A A . 14 LYS O 1 1 6 3399 1 1 15 LEU C C -2.387 -3.859 4.548 1.00 . A A . 15 LEU C 1 1 6 3400 1 1 15 LEU CA C -3.636 -3.044 4.233 1.00 . A A . 15 LEU CA 1 1 6 3401 1 1 15 LEU CB C -3.576 -1.688 4.957 1.00 . A A . 15 LEU CB 1 1 6 3402 1 1 15 LEU CD1 C -5.752 -1.404 6.190 1.00 . A A . 15 LEU CD1 1 1 6 3403 1 1 15 LEU CD2 C -3.947 -2.851 7.166 1.00 . A A . 15 LEU CD2 1 1 6 3404 1 1 15 LEU CG C -4.250 -1.611 6.334 1.00 . A A . 15 LEU CG 1 1 6 3405 1 1 15 LEU H H -5.537 -3.354 5.114 1.00 . A A . 15 LEU H 1 1 6 3406 1 1 15 LEU HA H -3.663 -2.863 3.171 1.00 . A A . 15 LEU HA 1 1 6 3407 1 1 15 LEU HB2 H -2.536 -1.424 5.082 1.00 . A A . 15 LEU HB2 1 1 6 3408 1 1 15 LEU HB3 H -4.037 -0.949 4.319 1.00 . A A . 15 LEU HB3 1 1 6 3409 1 1 15 LEU HD11 H -6.017 -1.415 5.142 1.00 . A A . 15 LEU HD11 1 1 6 3410 1 1 15 LEU HD12 H -6.277 -2.197 6.702 1.00 . A A . 15 LEU HD12 1 1 6 3411 1 1 15 LEU HD13 H -6.027 -0.453 6.620 1.00 . A A . 15 LEU HD13 1 1 6 3412 1 1 15 LEU HD21 H -2.878 -2.981 7.241 1.00 . A A . 15 LEU HD21 1 1 6 3413 1 1 15 LEU HD22 H -4.363 -2.730 8.155 1.00 . A A . 15 LEU HD22 1 1 6 3414 1 1 15 LEU HD23 H -4.384 -3.719 6.699 1.00 . A A . 15 LEU HD23 1 1 6 3415 1 1 15 LEU HG H -3.855 -0.755 6.864 1.00 . A A . 15 LEU HG 1 1 6 3416 1 1 15 LEU N N -4.846 -3.786 4.578 1.00 . A A . 15 LEU N 1 1 6 3417 1 1 15 LEU O O -2.212 -4.343 5.665 1.00 . A A . 15 LEU O 1 1 6 3418 1 1 16 LYS C C 0.549 -4.197 4.856 1.00 . A A . 16 LYS C 1 1 6 3419 1 1 16 LYS CA C -0.292 -4.773 3.718 1.00 . A A . 16 LYS CA 1 1 6 3420 1 1 16 LYS CB C 0.513 -4.772 2.417 1.00 . A A . 16 LYS CB 1 1 6 3421 1 1 16 LYS CD C 0.485 -5.057 -0.079 1.00 . A A . 16 LYS CD 1 1 6 3422 1 1 16 LYS CE C 1.276 -6.281 -0.509 1.00 . A A . 16 LYS CE 1 1 6 3423 1 1 16 LYS CG C -0.261 -5.303 1.222 1.00 . A A . 16 LYS CG 1 1 6 3424 1 1 16 LYS H H -1.720 -3.606 2.680 1.00 . A A . 16 LYS H 1 1 6 3425 1 1 16 LYS HA H -0.564 -5.789 3.963 1.00 . A A . 16 LYS HA 1 1 6 3426 1 1 16 LYS HB2 H 0.821 -3.761 2.198 1.00 . A A . 16 LYS HB2 1 1 6 3427 1 1 16 LYS HB3 H 1.392 -5.385 2.550 1.00 . A A . 16 LYS HB3 1 1 6 3428 1 1 16 LYS HD2 H -0.229 -4.813 -0.852 1.00 . A A . 16 LYS HD2 1 1 6 3429 1 1 16 LYS HD3 H 1.166 -4.229 0.059 1.00 . A A . 16 LYS HD3 1 1 6 3430 1 1 16 LYS HE2 H 2.049 -6.469 0.222 1.00 . A A . 16 LYS HE2 1 1 6 3431 1 1 16 LYS HE3 H 0.608 -7.129 -0.551 1.00 . A A . 16 LYS HE3 1 1 6 3432 1 1 16 LYS HG2 H -0.409 -6.366 1.344 1.00 . A A . 16 LYS HG2 1 1 6 3433 1 1 16 LYS HG3 H -1.220 -4.808 1.177 1.00 . A A . 16 LYS HG3 1 1 6 3434 1 1 16 LYS HZ1 H 1.337 -5.447 -2.423 1.00 . A A . 16 LYS HZ1 1 1 6 3435 1 1 16 LYS HZ2 H 2.862 -5.695 -1.735 1.00 . A A . 16 LYS HZ2 1 1 6 3436 1 1 16 LYS HZ3 H 1.981 -7.009 -2.336 1.00 . A A . 16 LYS HZ3 1 1 6 3437 1 1 16 LYS N N -1.523 -4.012 3.550 1.00 . A A . 16 LYS N 1 1 6 3438 1 1 16 LYS NZ N 1.908 -6.095 -1.844 1.00 . A A . 16 LYS NZ 1 1 6 3439 1 1 16 LYS O O 0.292 -3.089 5.327 1.00 . A A . 16 LYS O 1 1 6 3440 1 1 17 PRO C C 3.177 -3.206 6.069 1.00 . A A . 17 PRO C 1 1 6 3441 1 1 17 PRO CA C 2.441 -4.497 6.408 1.00 . A A . 17 PRO CA 1 1 6 3442 1 1 17 PRO CB C 3.440 -5.648 6.574 1.00 . A A . 17 PRO CB 1 1 6 3443 1 1 17 PRO CD C 1.945 -6.276 4.819 1.00 . A A . 17 PRO CD 1 1 6 3444 1 1 17 PRO CG C 2.794 -6.825 5.929 1.00 . A A . 17 PRO CG 1 1 6 3445 1 1 17 PRO HA H 1.887 -4.362 7.326 1.00 . A A . 17 PRO HA 1 1 6 3446 1 1 17 PRO HB2 H 4.370 -5.392 6.087 1.00 . A A . 17 PRO HB2 1 1 6 3447 1 1 17 PRO HB3 H 3.617 -5.823 7.625 1.00 . A A . 17 PRO HB3 1 1 6 3448 1 1 17 PRO HD2 H 2.519 -6.200 3.908 1.00 . A A . 17 PRO HD2 1 1 6 3449 1 1 17 PRO HD3 H 1.072 -6.894 4.669 1.00 . A A . 17 PRO HD3 1 1 6 3450 1 1 17 PRO HG2 H 3.550 -7.484 5.530 1.00 . A A . 17 PRO HG2 1 1 6 3451 1 1 17 PRO HG3 H 2.180 -7.347 6.647 1.00 . A A . 17 PRO HG3 1 1 6 3452 1 1 17 PRO N N 1.567 -4.943 5.318 1.00 . A A . 17 PRO N 1 1 6 3453 1 1 17 PRO O O 3.982 -3.166 5.138 1.00 . A A . 17 PRO O 1 1 6 3454 1 1 18 ALA C C 5.059 -0.998 6.602 1.00 . A A . 18 ALA C 1 1 6 3455 1 1 18 ALA CA C 3.540 -0.862 6.612 1.00 . A A . 18 ALA CA 1 1 6 3456 1 1 18 ALA CB C 3.106 0.133 7.678 1.00 . A A . 18 ALA CB 1 1 6 3457 1 1 18 ALA H H 2.250 -2.246 7.558 1.00 . A A . 18 ALA H 1 1 6 3458 1 1 18 ALA HA H 3.216 -0.489 5.651 1.00 . A A . 18 ALA HA 1 1 6 3459 1 1 18 ALA HB1 H 3.578 -0.117 8.616 1.00 . A A . 18 ALA HB1 1 1 6 3460 1 1 18 ALA HB2 H 3.398 1.129 7.381 1.00 . A A . 18 ALA HB2 1 1 6 3461 1 1 18 ALA HB3 H 2.033 0.092 7.792 1.00 . A A . 18 ALA HB3 1 1 6 3462 1 1 18 ALA N N 2.899 -2.153 6.831 1.00 . A A . 18 ALA N 1 1 6 3463 1 1 18 ALA O O 5.657 -1.452 7.578 1.00 . A A . 18 ALA O 1 1 6 3464 1 1 19 GLY C C 7.564 -1.357 4.084 1.00 . A A . 19 GLY C 1 1 6 3465 1 1 19 GLY CA C 7.119 -0.696 5.377 1.00 . A A . 19 GLY CA 1 1 6 3466 1 1 19 GLY H H 5.146 -0.254 4.748 1.00 . A A . 19 GLY H 1 1 6 3467 1 1 19 GLY HA2 H 7.501 -1.269 6.210 1.00 . A A . 19 GLY HA2 1 1 6 3468 1 1 19 GLY HA3 H 7.535 0.299 5.419 1.00 . A A . 19 GLY HA3 1 1 6 3469 1 1 19 GLY N N 5.676 -0.606 5.494 1.00 . A A . 19 GLY N 1 1 6 3470 1 1 19 GLY O O 8.759 -1.428 3.799 1.00 . A A . 19 GLY O 1 1 6 3471 1 1 20 THR C C 6.325 -1.697 0.869 1.00 . A A . 20 THR C 1 1 6 3472 1 1 20 THR CA C 6.911 -2.489 2.031 1.00 . A A . 20 THR CA 1 1 6 3473 1 1 20 THR CB C 6.372 -3.924 2.022 1.00 . A A . 20 THR CB 1 1 6 3474 1 1 20 THR CG2 C 4.884 -4.014 1.751 1.00 . A A . 20 THR CG2 1 1 6 3475 1 1 20 THR H H 5.668 -1.752 3.571 1.00 . A A . 20 THR H 1 1 6 3476 1 1 20 THR HA H 7.985 -2.517 1.925 1.00 . A A . 20 THR HA 1 1 6 3477 1 1 20 THR HB H 6.558 -4.371 2.988 1.00 . A A . 20 THR HB 1 1 6 3478 1 1 20 THR HG1 H 7.665 -5.285 1.466 1.00 . A A . 20 THR HG1 1 1 6 3479 1 1 20 THR HG21 H 4.348 -3.433 2.487 1.00 . A A . 20 THR HG21 1 1 6 3480 1 1 20 THR HG22 H 4.675 -3.626 0.764 1.00 . A A . 20 THR HG22 1 1 6 3481 1 1 20 THR HG23 H 4.569 -5.045 1.806 1.00 . A A . 20 THR HG23 1 1 6 3482 1 1 20 THR N N 6.604 -1.839 3.297 1.00 . A A . 20 THR N 1 1 6 3483 1 1 20 THR O O 5.313 -1.014 1.020 1.00 . A A . 20 THR O 1 1 6 3484 1 1 20 THR OG1 O 7.034 -4.701 1.040 1.00 . A A . 20 THR OG1 1 1 6 3485 1 1 21 THR C C 5.197 -1.663 -1.988 1.00 . A A . 21 THR C 1 1 6 3486 1 1 21 THR CA C 6.502 -1.076 -1.469 1.00 . A A . 21 THR CA 1 1 6 3487 1 1 21 THR CB C 7.566 -1.105 -2.563 1.00 . A A . 21 THR CB 1 1 6 3488 1 1 21 THR CG2 C 8.113 0.268 -2.872 1.00 . A A . 21 THR CG2 1 1 6 3489 1 1 21 THR H H 7.768 -2.349 -0.349 1.00 . A A . 21 THR H 1 1 6 3490 1 1 21 THR HA H 6.325 -0.050 -1.186 1.00 . A A . 21 THR HA 1 1 6 3491 1 1 21 THR HB H 7.131 -1.501 -3.469 1.00 . A A . 21 THR HB 1 1 6 3492 1 1 21 THR HG1 H 8.633 -2.742 -2.704 1.00 . A A . 21 THR HG1 1 1 6 3493 1 1 21 THR HG21 H 8.009 0.896 -1.998 1.00 . A A . 21 THR HG21 1 1 6 3494 1 1 21 THR HG22 H 9.155 0.190 -3.140 1.00 . A A . 21 THR HG22 1 1 6 3495 1 1 21 THR HG23 H 7.559 0.698 -3.693 1.00 . A A . 21 THR HG23 1 1 6 3496 1 1 21 THR N N 6.965 -1.790 -0.288 1.00 . A A . 21 THR N 1 1 6 3497 1 1 21 THR O O 5.091 -2.868 -2.219 1.00 . A A . 21 THR O 1 1 6 3498 1 1 21 THR OG1 O 8.655 -1.931 -2.191 1.00 . A A . 21 THR OG1 1 1 6 3499 1 1 22 CYS C C 2.659 -0.701 -4.070 1.00 . A A . 22 CYS C 1 1 6 3500 1 1 22 CYS CA C 2.904 -1.224 -2.662 1.00 . A A . 22 CYS CA 1 1 6 3501 1 1 22 CYS CB C 1.798 -0.732 -1.727 1.00 . A A . 22 CYS CB 1 1 6 3502 1 1 22 CYS H H 4.355 0.148 -1.967 1.00 . A A . 22 CYS H 1 1 6 3503 1 1 22 CYS HA H 2.895 -2.302 -2.683 1.00 . A A . 22 CYS HA 1 1 6 3504 1 1 22 CYS HB2 H 0.839 -0.984 -2.154 1.00 . A A . 22 CYS HB2 1 1 6 3505 1 1 22 CYS HB3 H 1.902 -1.223 -0.772 1.00 . A A . 22 CYS HB3 1 1 6 3506 1 1 22 CYS N N 4.206 -0.799 -2.170 1.00 . A A . 22 CYS N 1 1 6 3507 1 1 22 CYS O O 1.516 -0.474 -4.466 1.00 . A A . 22 CYS O 1 1 6 3508 1 1 22 CYS SG S 1.816 1.067 -1.433 1.00 . A A . 22 CYS SG 1 1 6 3509 1 1 23 TRP C C 4.824 -0.382 -7.029 1.00 . A A . 23 TRP C 1 1 6 3510 1 1 23 TRP CA C 3.615 -0.008 -6.187 1.00 . A A . 23 TRP CA 1 1 6 3511 1 1 23 TRP CB C 3.432 1.516 -6.182 1.00 . A A . 23 TRP CB 1 1 6 3512 1 1 23 TRP CD1 C 1.028 1.197 -6.953 1.00 . A A . 23 TRP CD1 1 1 6 3513 1 1 23 TRP CD2 C 1.853 3.225 -7.402 1.00 . A A . 23 TRP CD2 1 1 6 3514 1 1 23 TRP CE2 C 0.529 3.163 -7.875 1.00 . A A . 23 TRP CE2 1 1 6 3515 1 1 23 TRP CE3 C 2.573 4.411 -7.573 1.00 . A A . 23 TRP CE3 1 1 6 3516 1 1 23 TRP CG C 2.150 1.950 -6.817 1.00 . A A . 23 TRP CG 1 1 6 3517 1 1 23 TRP CH2 C 0.639 5.385 -8.660 1.00 . A A . 23 TRP CH2 1 1 6 3518 1 1 23 TRP CZ2 C -0.088 4.237 -8.506 1.00 . A A . 23 TRP CZ2 1 1 6 3519 1 1 23 TRP CZ3 C 1.958 5.479 -8.200 1.00 . A A . 23 TRP CZ3 1 1 6 3520 1 1 23 TRP H H 4.622 -0.703 -4.460 1.00 . A A . 23 TRP H 1 1 6 3521 1 1 23 TRP HA H 2.744 -0.461 -6.625 1.00 . A A . 23 TRP HA 1 1 6 3522 1 1 23 TRP HB2 H 3.437 1.869 -5.161 1.00 . A A . 23 TRP HB2 1 1 6 3523 1 1 23 TRP HB3 H 4.247 1.974 -6.721 1.00 . A A . 23 TRP HB3 1 1 6 3524 1 1 23 TRP HD1 H 0.945 0.181 -6.606 1.00 . A A . 23 TRP HD1 1 1 6 3525 1 1 23 TRP HE1 H -0.850 1.585 -7.805 1.00 . A A . 23 TRP HE1 1 1 6 3526 1 1 23 TRP HE3 H 3.590 4.501 -7.226 1.00 . A A . 23 TRP HE3 1 1 6 3527 1 1 23 TRP HH2 H 0.198 6.244 -9.144 1.00 . A A . 23 TRP HH2 1 1 6 3528 1 1 23 TRP HZ2 H -1.103 4.179 -8.867 1.00 . A A . 23 TRP HZ2 1 1 6 3529 1 1 23 TRP HZ3 H 2.498 6.404 -8.339 1.00 . A A . 23 TRP HZ3 1 1 6 3530 1 1 23 TRP N N 3.734 -0.508 -4.826 1.00 . A A . 23 TRP N 1 1 6 3531 1 1 23 TRP NE1 N 0.048 1.913 -7.591 1.00 . A A . 23 TRP NE1 1 1 6 3532 1 1 23 TRP O O 4.751 -1.260 -7.889 1.00 . A A . 23 TRP O 1 1 6 3533 1 1 24 LYS C C 6.882 0.018 -9.029 1.00 . A A . 24 LYS C 1 1 6 3534 1 1 24 LYS CA C 7.163 0.061 -7.528 1.00 . A A . 24 LYS CA 1 1 6 3535 1 1 24 LYS CB C 7.806 -1.249 -7.073 1.00 . A A . 24 LYS CB 1 1 6 3536 1 1 24 LYS CD C 10.023 -2.409 -6.842 1.00 . A A . 24 LYS CD 1 1 6 3537 1 1 24 LYS CE C 11.418 -2.573 -7.423 1.00 . A A . 24 LYS CE 1 1 6 3538 1 1 24 LYS CG C 9.155 -1.521 -7.719 1.00 . A A . 24 LYS CG 1 1 6 3539 1 1 24 LYS H H 5.911 0.990 -6.091 1.00 . A A . 24 LYS H 1 1 6 3540 1 1 24 LYS HA H 7.839 0.877 -7.322 1.00 . A A . 24 LYS HA 1 1 6 3541 1 1 24 LYS HB2 H 7.944 -1.214 -6.002 1.00 . A A . 24 LYS HB2 1 1 6 3542 1 1 24 LYS HB3 H 7.143 -2.065 -7.316 1.00 . A A . 24 LYS HB3 1 1 6 3543 1 1 24 LYS HD2 H 10.103 -1.964 -5.862 1.00 . A A . 24 LYS HD2 1 1 6 3544 1 1 24 LYS HD3 H 9.560 -3.382 -6.761 1.00 . A A . 24 LYS HD3 1 1 6 3545 1 1 24 LYS HE2 H 11.864 -1.596 -7.537 1.00 . A A . 24 LYS HE2 1 1 6 3546 1 1 24 LYS HE3 H 12.012 -3.161 -6.740 1.00 . A A . 24 LYS HE3 1 1 6 3547 1 1 24 LYS HG2 H 8.997 -2.013 -8.667 1.00 . A A . 24 LYS HG2 1 1 6 3548 1 1 24 LYS HG3 H 9.663 -0.581 -7.879 1.00 . A A . 24 LYS HG3 1 1 6 3549 1 1 24 LYS HZ1 H 10.705 -2.783 -9.376 1.00 . A A . 24 LYS HZ1 1 1 6 3550 1 1 24 LYS HZ2 H 12.332 -3.209 -9.191 1.00 . A A . 24 LYS HZ2 1 1 6 3551 1 1 24 LYS HZ3 H 11.118 -4.247 -8.636 1.00 . A A . 24 LYS HZ3 1 1 6 3552 1 1 24 LYS N N 5.929 0.302 -6.784 1.00 . A A . 24 LYS N 1 1 6 3553 1 1 24 LYS NZ N 11.392 -3.250 -8.749 1.00 . A A . 24 LYS NZ 1 1 6 3554 1 1 24 LYS O O 7.522 -0.726 -9.773 1.00 . A A . 24 LYS O 1 1 6 3555 1 1 25 THR C C 6.608 1.510 -11.723 1.00 . A A . 25 THR C 1 1 6 3556 1 1 25 THR CA C 5.516 0.877 -10.862 1.00 . A A . 25 THR CA 1 1 6 3557 1 1 25 THR CB C 4.211 1.666 -11.004 1.00 . A A . 25 THR CB 1 1 6 3558 1 1 25 THR CG2 C 3.319 1.159 -12.116 1.00 . A A . 25 THR CG2 1 1 6 3559 1 1 25 THR H H 5.434 1.376 -8.809 1.00 . A A . 25 THR H 1 1 6 3560 1 1 25 THR HA H 5.349 -0.134 -11.202 1.00 . A A . 25 THR HA 1 1 6 3561 1 1 25 THR HB H 4.446 2.699 -11.213 1.00 . A A . 25 THR HB 1 1 6 3562 1 1 25 THR HG1 H 3.141 0.724 -9.661 1.00 . A A . 25 THR HG1 1 1 6 3563 1 1 25 THR HG21 H 3.342 0.080 -12.133 1.00 . A A . 25 THR HG21 1 1 6 3564 1 1 25 THR HG22 H 2.306 1.496 -11.946 1.00 . A A . 25 THR HG22 1 1 6 3565 1 1 25 THR HG23 H 3.671 1.542 -13.063 1.00 . A A . 25 THR HG23 1 1 6 3566 1 1 25 THR N N 5.909 0.817 -9.458 1.00 . A A . 25 THR N 1 1 6 3567 1 1 25 THR O O 6.423 2.592 -12.282 1.00 . A A . 25 THR O 1 1 6 3568 1 1 25 THR OG1 O 3.464 1.617 -9.801 1.00 . A A . 25 THR OG1 1 1 6 3569 1 1 26 SER C C 9.632 2.403 -11.879 1.00 . A A . 26 SER C 1 1 6 3570 1 1 26 SER CA C 8.877 1.309 -12.619 1.00 . A A . 26 SER CA 1 1 6 3571 1 1 26 SER CB C 8.405 1.826 -13.981 1.00 . A A . 26 SER CB 1 1 6 3572 1 1 26 SER H H 7.831 -0.024 -11.358 1.00 . A A . 26 SER H 1 1 6 3573 1 1 26 SER HA H 9.544 0.478 -12.774 1.00 . A A . 26 SER HA 1 1 6 3574 1 1 26 SER HB2 H 8.152 2.873 -13.899 1.00 . A A . 26 SER HB2 1 1 6 3575 1 1 26 SER HB3 H 9.198 1.703 -14.705 1.00 . A A . 26 SER HB3 1 1 6 3576 1 1 26 SER HG H 7.518 0.505 -15.124 1.00 . A A . 26 SER HG 1 1 6 3577 1 1 26 SER N N 7.747 0.827 -11.827 1.00 . A A . 26 SER N 1 1 6 3578 1 1 26 SER O O 10.837 2.300 -11.653 1.00 . A A . 26 SER O 1 1 6 3579 1 1 26 SER OG O 7.263 1.116 -14.429 1.00 . A A . 26 SER OG 1 1 6 3580 1 1 27 VAL C C 8.645 4.979 -9.608 1.00 . A A . 27 VAL C 1 1 6 3581 1 1 27 VAL CA C 9.505 4.571 -10.796 1.00 . A A . 27 VAL CA 1 1 6 3582 1 1 27 VAL CB C 9.701 5.778 -11.732 1.00 . A A . 27 VAL CB 1 1 6 3583 1 1 27 VAL CG1 C 8.364 6.406 -12.102 1.00 . A A . 27 VAL CG1 1 1 6 3584 1 1 27 VAL CG2 C 10.625 6.804 -11.096 1.00 . A A . 27 VAL CG2 1 1 6 3585 1 1 27 VAL H H 7.960 3.469 -11.723 1.00 . A A . 27 VAL H 1 1 6 3586 1 1 27 VAL HA H 10.473 4.261 -10.435 1.00 . A A . 27 VAL HA 1 1 6 3587 1 1 27 VAL HB H 10.164 5.420 -12.639 1.00 . A A . 27 VAL HB 1 1 6 3588 1 1 27 VAL HG11 H 7.704 5.646 -12.494 1.00 . A A . 27 VAL HG11 1 1 6 3589 1 1 27 VAL HG12 H 7.919 6.850 -11.223 1.00 . A A . 27 VAL HG12 1 1 6 3590 1 1 27 VAL HG13 H 8.519 7.169 -12.851 1.00 . A A . 27 VAL HG13 1 1 6 3591 1 1 27 VAL HG21 H 11.520 6.314 -10.744 1.00 . A A . 27 VAL HG21 1 1 6 3592 1 1 27 VAL HG22 H 10.888 7.554 -11.827 1.00 . A A . 27 VAL HG22 1 1 6 3593 1 1 27 VAL HG23 H 10.121 7.274 -10.263 1.00 . A A . 27 VAL HG23 1 1 6 3594 1 1 27 VAL N N 8.913 3.450 -11.509 1.00 . A A . 27 VAL N 1 1 6 3595 1 1 27 VAL O O 9.151 5.221 -8.512 1.00 . A A . 27 VAL O 1 1 6 3596 1 1 28 SER C C 6.301 4.317 -7.744 1.00 . A A . 28 SER C 1 1 6 3597 1 1 28 SER CA C 6.401 5.420 -8.788 1.00 . A A . 28 SER CA 1 1 6 3598 1 1 28 SER CB C 5.022 5.701 -9.387 1.00 . A A . 28 SER CB 1 1 6 3599 1 1 28 SER H H 7.001 4.840 -10.729 1.00 . A A . 28 SER H 1 1 6 3600 1 1 28 SER HA H 6.770 6.318 -8.315 1.00 . A A . 28 SER HA 1 1 6 3601 1 1 28 SER HB2 H 4.454 4.783 -9.423 1.00 . A A . 28 SER HB2 1 1 6 3602 1 1 28 SER HB3 H 4.504 6.421 -8.771 1.00 . A A . 28 SER HB3 1 1 6 3603 1 1 28 SER HG H 4.612 7.024 -10.773 1.00 . A A . 28 SER HG 1 1 6 3604 1 1 28 SER N N 7.340 5.048 -9.835 1.00 . A A . 28 SER N 1 1 6 3605 1 1 28 SER O O 5.415 3.466 -7.810 1.00 . A A . 28 SER O 1 1 6 3606 1 1 28 SER OG O 5.132 6.220 -10.701 1.00 . A A . 28 SER OG 1 1 6 3607 1 1 29 SER C C 6.936 3.984 -4.373 1.00 . A A . 29 SER C 1 1 6 3608 1 1 29 SER CA C 7.225 3.335 -5.720 1.00 . A A . 29 SER CA 1 1 6 3609 1 1 29 SER CB C 8.572 2.612 -5.679 1.00 . A A . 29 SER CB 1 1 6 3610 1 1 29 SER H H 7.897 5.039 -6.781 1.00 . A A . 29 SER H 1 1 6 3611 1 1 29 SER HA H 6.444 2.620 -5.934 1.00 . A A . 29 SER HA 1 1 6 3612 1 1 29 SER HB2 H 8.453 1.659 -5.185 1.00 . A A . 29 SER HB2 1 1 6 3613 1 1 29 SER HB3 H 8.923 2.452 -6.688 1.00 . A A . 29 SER HB3 1 1 6 3614 1 1 29 SER HG H 10.392 2.935 -5.029 1.00 . A A . 29 SER HG 1 1 6 3615 1 1 29 SER N N 7.214 4.335 -6.780 1.00 . A A . 29 SER N 1 1 6 3616 1 1 29 SER O O 7.577 4.963 -3.994 1.00 . A A . 29 SER O 1 1 6 3617 1 1 29 SER OG O 9.539 3.372 -4.975 1.00 . A A . 29 SER OG 1 1 6 3618 1 1 30 HIS C C 5.341 2.868 -1.352 1.00 . A A . 30 HIS C 1 1 6 3619 1 1 30 HIS CA C 5.567 3.982 -2.367 1.00 . A A . 30 HIS CA 1 1 6 3620 1 1 30 HIS CB C 4.297 4.826 -2.512 1.00 . A A . 30 HIS CB 1 1 6 3621 1 1 30 HIS CD2 C 4.380 5.288 -5.063 1.00 . A A . 30 HIS CD2 1 1 6 3622 1 1 30 HIS CE1 C 4.141 7.465 -5.009 1.00 . A A . 30 HIS CE1 1 1 6 3623 1 1 30 HIS CG C 4.269 5.651 -3.763 1.00 . A A . 30 HIS CG 1 1 6 3624 1 1 30 HIS H H 5.470 2.670 -4.024 1.00 . A A . 30 HIS H 1 1 6 3625 1 1 30 HIS HA H 6.369 4.614 -2.017 1.00 . A A . 30 HIS HA 1 1 6 3626 1 1 30 HIS HB2 H 3.438 4.171 -2.528 1.00 . A A . 30 HIS HB2 1 1 6 3627 1 1 30 HIS HB3 H 4.219 5.496 -1.668 1.00 . A A . 30 HIS HB3 1 1 6 3628 1 1 30 HIS HD1 H 4.015 7.585 -2.969 1.00 . A A . 30 HIS HD1 1 1 6 3629 1 1 30 HIS HD2 H 4.518 4.283 -5.439 1.00 . A A . 30 HIS HD2 1 1 6 3630 1 1 30 HIS HE1 H 4.052 8.497 -5.315 1.00 . A A . 30 HIS HE1 1 1 6 3631 1 1 30 HIS HE2 H 4.254 6.470 -6.793 1.00 . A A . 30 HIS HE2 1 1 6 3632 1 1 30 HIS N N 5.954 3.442 -3.663 1.00 . A A . 30 HIS N 1 1 6 3633 1 1 30 HIS ND1 N 4.121 7.022 -3.763 1.00 . A A . 30 HIS ND1 1 1 6 3634 1 1 30 HIS NE2 N 4.297 6.433 -5.815 1.00 . A A . 30 HIS NE2 1 1 6 3635 1 1 30 HIS O O 4.609 1.913 -1.614 1.00 . A A . 30 HIS O 1 1 6 3636 1 1 31 TYR C C 4.442 2.044 1.472 1.00 . A A . 31 TYR C 1 1 6 3637 1 1 31 TYR CA C 5.840 2.004 0.867 1.00 . A A . 31 TYR CA 1 1 6 3638 1 1 31 TYR CB C 6.889 2.242 1.955 1.00 . A A . 31 TYR CB 1 1 6 3639 1 1 31 TYR CD1 C 9.005 1.041 2.630 1.00 . A A . 31 TYR CD1 1 1 6 3640 1 1 31 TYR CD2 C 8.749 1.669 0.344 1.00 . A A . 31 TYR CD2 1 1 6 3641 1 1 31 TYR CE1 C 10.240 0.489 2.344 1.00 . A A . 31 TYR CE1 1 1 6 3642 1 1 31 TYR CE2 C 9.982 1.119 0.051 1.00 . A A . 31 TYR CE2 1 1 6 3643 1 1 31 TYR CG C 8.240 1.639 1.637 1.00 . A A . 31 TYR CG 1 1 6 3644 1 1 31 TYR CZ C 10.723 0.530 1.053 1.00 . A A . 31 TYR CZ 1 1 6 3645 1 1 31 TYR H H 6.541 3.782 -0.040 1.00 . A A . 31 TYR H 1 1 6 3646 1 1 31 TYR HA H 6.002 1.030 0.430 1.00 . A A . 31 TYR HA 1 1 6 3647 1 1 31 TYR HB2 H 7.024 3.305 2.088 1.00 . A A . 31 TYR HB2 1 1 6 3648 1 1 31 TYR HB3 H 6.541 1.809 2.881 1.00 . A A . 31 TYR HB3 1 1 6 3649 1 1 31 TYR HD1 H 8.624 1.010 3.640 1.00 . A A . 31 TYR HD1 1 1 6 3650 1 1 31 TYR HD2 H 8.167 2.131 -0.439 1.00 . A A . 31 TYR HD2 1 1 6 3651 1 1 31 TYR HE1 H 10.820 0.028 3.129 1.00 . A A . 31 TYR HE1 1 1 6 3652 1 1 31 TYR HE2 H 10.360 1.151 -0.961 1.00 . A A . 31 TYR HE2 1 1 6 3653 1 1 31 TYR HH H 12.544 0.669 0.450 1.00 . A A . 31 TYR HH 1 1 6 3654 1 1 31 TYR N N 5.973 2.997 -0.190 1.00 . A A . 31 TYR N 1 1 6 3655 1 1 31 TYR O O 3.734 3.044 1.358 1.00 . A A . 31 TYR O 1 1 6 3656 1 1 31 TYR OH O 11.952 -0.019 0.764 1.00 . A A . 31 TYR OH 1 1 6 3657 1 1 32 CYS C C 2.740 1.554 4.096 1.00 . A A . 32 CYS C 1 1 6 3658 1 1 32 CYS CA C 2.738 0.864 2.739 1.00 . A A . 32 CYS CA 1 1 6 3659 1 1 32 CYS CB C 2.323 -0.601 2.897 1.00 . A A . 32 CYS CB 1 1 6 3660 1 1 32 CYS H H 4.655 0.186 2.178 1.00 . A A . 32 CYS H 1 1 6 3661 1 1 32 CYS HA H 2.030 1.363 2.095 1.00 . A A . 32 CYS HA 1 1 6 3662 1 1 32 CYS HB2 H 3.189 -1.229 2.753 1.00 . A A . 32 CYS HB2 1 1 6 3663 1 1 32 CYS HB3 H 1.936 -0.754 3.895 1.00 . A A . 32 CYS HB3 1 1 6 3664 1 1 32 CYS N N 4.049 0.951 2.117 1.00 . A A . 32 CYS N 1 1 6 3665 1 1 32 CYS O O 3.715 1.476 4.844 1.00 . A A . 32 CYS O 1 1 6 3666 1 1 32 CYS SG S 1.045 -1.143 1.718 1.00 . A A . 32 CYS SG 1 1 6 3667 1 1 33 THR C C 0.615 2.114 6.630 1.00 . A A . 33 THR C 1 1 6 3668 1 1 33 THR CA C 1.505 2.912 5.684 1.00 . A A . 33 THR CA 1 1 6 3669 1 1 33 THR CB C 0.924 4.311 5.472 1.00 . A A . 33 THR CB 1 1 6 3670 1 1 33 THR CG2 C 1.879 5.257 4.777 1.00 . A A . 33 THR CG2 1 1 6 3671 1 1 33 THR H H 0.894 2.239 3.777 1.00 . A A . 33 THR H 1 1 6 3672 1 1 33 THR HA H 2.489 3.001 6.120 1.00 . A A . 33 THR HA 1 1 6 3673 1 1 33 THR HB H 0.678 4.737 6.434 1.00 . A A . 33 THR HB 1 1 6 3674 1 1 33 THR HG1 H -0.927 4.823 5.084 1.00 . A A . 33 THR HG1 1 1 6 3675 1 1 33 THR HG21 H 2.792 4.734 4.536 1.00 . A A . 33 THR HG21 1 1 6 3676 1 1 33 THR HG22 H 1.424 5.625 3.869 1.00 . A A . 33 THR HG22 1 1 6 3677 1 1 33 THR HG23 H 2.101 6.088 5.430 1.00 . A A . 33 THR HG23 1 1 6 3678 1 1 33 THR N N 1.639 2.220 4.411 1.00 . A A . 33 THR N 1 1 6 3679 1 1 33 THR O O 0.140 2.635 7.639 1.00 . A A . 33 THR O 1 1 6 3680 1 1 33 THR OG1 O -0.261 4.250 4.698 1.00 . A A . 33 THR OG1 1 1 6 3681 1 1 34 GLY C C -1.704 0.671 7.605 1.00 . A A . 34 GLY C 1 1 6 3682 1 1 34 GLY CA C -0.443 -0.020 7.117 1.00 . A A . 34 GLY CA 1 1 6 3683 1 1 34 GLY H H 0.804 0.482 5.473 1.00 . A A . 34 GLY H 1 1 6 3684 1 1 34 GLY HA2 H 0.130 -0.344 7.973 1.00 . A A . 34 GLY HA2 1 1 6 3685 1 1 34 GLY HA3 H -0.724 -0.887 6.538 1.00 . A A . 34 GLY HA3 1 1 6 3686 1 1 34 GLY N N 0.393 0.841 6.292 1.00 . A A . 34 GLY N 1 1 6 3687 1 1 34 GLY O O -2.149 0.440 8.730 1.00 . A A . 34 GLY O 1 1 6 3688 1 1 35 ARG C C -4.577 2.079 6.068 1.00 . A A . 35 ARG C 1 1 6 3689 1 1 35 ARG CA C -3.491 2.253 7.124 1.00 . A A . 35 ARG CA 1 1 6 3690 1 1 35 ARG CB C -3.179 3.739 7.314 1.00 . A A . 35 ARG CB 1 1 6 3691 1 1 35 ARG CD C -1.727 3.667 9.364 1.00 . A A . 35 ARG CD 1 1 6 3692 1 1 35 ARG CG C -3.041 4.149 8.771 1.00 . A A . 35 ARG CG 1 1 6 3693 1 1 35 ARG CZ C -1.491 5.122 11.339 1.00 . A A . 35 ARG CZ 1 1 6 3694 1 1 35 ARG H H -1.876 1.672 5.881 1.00 . A A . 35 ARG H 1 1 6 3695 1 1 35 ARG HA H -3.850 1.850 8.055 1.00 . A A . 35 ARG HA 1 1 6 3696 1 1 35 ARG HB2 H -2.252 3.968 6.810 1.00 . A A . 35 ARG HB2 1 1 6 3697 1 1 35 ARG HB3 H -3.973 4.323 6.872 1.00 . A A . 35 ARG HB3 1 1 6 3698 1 1 35 ARG HD2 H -1.635 2.605 9.187 1.00 . A A . 35 ARG HD2 1 1 6 3699 1 1 35 ARG HD3 H -0.915 4.184 8.876 1.00 . A A . 35 ARG HD3 1 1 6 3700 1 1 35 ARG HE H -1.724 3.141 11.399 1.00 . A A . 35 ARG HE 1 1 6 3701 1 1 35 ARG HG2 H -3.080 5.226 8.838 1.00 . A A . 35 ARG HG2 1 1 6 3702 1 1 35 ARG HG3 H -3.858 3.722 9.334 1.00 . A A . 35 ARG HG3 1 1 6 3703 1 1 35 ARG HH11 H -1.433 6.097 9.568 1.00 . A A . 35 ARG HH11 1 1 6 3704 1 1 35 ARG HH12 H -1.269 7.098 10.971 1.00 . A A . 35 ARG HH12 1 1 6 3705 1 1 35 ARG HH21 H -1.509 4.455 13.247 1.00 . A A . 35 ARG HH21 1 1 6 3706 1 1 35 ARG HH22 H -1.312 6.166 13.060 1.00 . A A . 35 ARG HH22 1 1 6 3707 1 1 35 ARG N N -2.279 1.525 6.762 1.00 . A A . 35 ARG N 1 1 6 3708 1 1 35 ARG NE N -1.652 3.914 10.802 1.00 . A A . 35 ARG NE 1 1 6 3709 1 1 35 ARG NH1 N -1.390 6.193 10.562 1.00 . A A . 35 ARG NH1 1 1 6 3710 1 1 35 ARG NH2 N -1.433 5.259 12.657 1.00 . A A . 35 ARG NH2 1 1 6 3711 1 1 35 ARG O O -5.721 1.754 6.388 1.00 . A A . 35 ARG O 1 1 6 3712 1 1 36 SER C C -4.501 1.543 2.491 1.00 . A A . 36 SER C 1 1 6 3713 1 1 36 SER CA C -5.162 2.176 3.710 1.00 . A A . 36 SER CA 1 1 6 3714 1 1 36 SER CB C -5.732 3.547 3.340 1.00 . A A . 36 SER CB 1 1 6 3715 1 1 36 SER H H -3.289 2.563 4.624 1.00 . A A . 36 SER H 1 1 6 3716 1 1 36 SER HA H -5.968 1.539 4.039 1.00 . A A . 36 SER HA 1 1 6 3717 1 1 36 SER HB2 H -5.649 4.210 4.188 1.00 . A A . 36 SER HB2 1 1 6 3718 1 1 36 SER HB3 H -5.174 3.954 2.509 1.00 . A A . 36 SER HB3 1 1 6 3719 1 1 36 SER HG H -7.648 3.563 3.747 1.00 . A A . 36 SER HG 1 1 6 3720 1 1 36 SER N N -4.214 2.303 4.813 1.00 . A A . 36 SER N 1 1 6 3721 1 1 36 SER O O -3.276 1.435 2.422 1.00 . A A . 36 SER O 1 1 6 3722 1 1 36 SER OG O -7.096 3.449 2.970 1.00 . A A . 36 SER OG 1 1 6 3723 1 1 37 CYS C C -4.249 1.541 -0.646 1.00 . A A . 37 CYS C 1 1 6 3724 1 1 37 CYS CA C -4.811 0.498 0.316 1.00 . A A . 37 CYS CA 1 1 6 3725 1 1 37 CYS CB C -5.912 -0.306 -0.381 1.00 . A A . 37 CYS CB 1 1 6 3726 1 1 37 CYS H H -6.287 1.234 1.643 1.00 . A A . 37 CYS H 1 1 6 3727 1 1 37 CYS HA H -4.016 -0.174 0.600 1.00 . A A . 37 CYS HA 1 1 6 3728 1 1 37 CYS HB2 H -6.505 0.361 -0.987 1.00 . A A . 37 CYS HB2 1 1 6 3729 1 1 37 CYS HB3 H -5.453 -1.048 -1.018 1.00 . A A . 37 CYS HB3 1 1 6 3730 1 1 37 CYS N N -5.319 1.123 1.531 1.00 . A A . 37 CYS N 1 1 6 3731 1 1 37 CYS O O -3.382 1.238 -1.464 1.00 . A A . 37 CYS O 1 1 6 3732 1 1 37 CYS SG S -7.045 -1.174 0.752 1.00 . A A . 37 CYS SG 1 1 6 3733 1 1 38 GLU C C -2.890 4.315 -1.018 1.00 . A A . 38 GLU C 1 1 6 3734 1 1 38 GLU CA C -4.286 3.847 -1.416 1.00 . A A . 38 GLU CA 1 1 6 3735 1 1 38 GLU CB C -5.265 5.022 -1.364 1.00 . A A . 38 GLU CB 1 1 6 3736 1 1 38 GLU CD C -7.634 5.640 -1.985 1.00 . A A . 38 GLU CD 1 1 6 3737 1 1 38 GLU CG C -6.355 4.953 -2.421 1.00 . A A . 38 GLU CG 1 1 6 3738 1 1 38 GLU H H -5.437 2.954 0.122 1.00 . A A . 38 GLU H 1 1 6 3739 1 1 38 GLU HA H -4.250 3.466 -2.425 1.00 . A A . 38 GLU HA 1 1 6 3740 1 1 38 GLU HB2 H -5.736 5.042 -0.393 1.00 . A A . 38 GLU HB2 1 1 6 3741 1 1 38 GLU HB3 H -4.714 5.941 -1.506 1.00 . A A . 38 GLU HB3 1 1 6 3742 1 1 38 GLU HG2 H -5.997 5.430 -3.321 1.00 . A A . 38 GLU HG2 1 1 6 3743 1 1 38 GLU HG3 H -6.573 3.915 -2.627 1.00 . A A . 38 GLU HG3 1 1 6 3744 1 1 38 GLU N N -4.746 2.769 -0.547 1.00 . A A . 38 GLU N 1 1 6 3745 1 1 38 GLU O O -2.727 5.059 -0.050 1.00 . A A . 38 GLU O 1 1 6 3746 1 1 38 GLU OE1 O -7.606 6.873 -1.784 1.00 . A A . 38 GLU OE1 1 1 6 3747 1 1 38 GLU OE2 O -8.663 4.947 -1.846 1.00 . A A . 38 GLU OE2 1 1 6 3748 1 1 39 CYS C C -0.334 5.776 -1.592 1.00 . A A . 39 CYS C 1 1 6 3749 1 1 39 CYS CA C -0.503 4.262 -1.497 1.00 . A A . 39 CYS CA 1 1 6 3750 1 1 39 CYS CB C 0.452 3.574 -2.477 1.00 . A A . 39 CYS CB 1 1 6 3751 1 1 39 CYS H H -2.075 3.292 -2.532 1.00 . A A . 39 CYS H 1 1 6 3752 1 1 39 CYS HA H -0.265 3.946 -0.492 1.00 . A A . 39 CYS HA 1 1 6 3753 1 1 39 CYS HB2 H 0.277 3.963 -3.469 1.00 . A A . 39 CYS HB2 1 1 6 3754 1 1 39 CYS HB3 H 1.470 3.792 -2.186 1.00 . A A . 39 CYS HB3 1 1 6 3755 1 1 39 CYS N N -1.884 3.880 -1.772 1.00 . A A . 39 CYS N 1 1 6 3756 1 1 39 CYS O O -1.006 6.433 -2.387 1.00 . A A . 39 CYS O 1 1 6 3757 1 1 39 CYS SG S 0.273 1.762 -2.556 1.00 . A A . 39 CYS SG 1 1 6 3758 1 1 40 PRO C C 1.339 8.279 -2.143 1.00 . A A . 40 PRO C 1 1 6 3759 1 1 40 PRO CA C 0.825 7.797 -0.791 1.00 . A A . 40 PRO CA 1 1 6 3760 1 1 40 PRO CB C 1.895 7.987 0.292 1.00 . A A . 40 PRO CB 1 1 6 3761 1 1 40 PRO CD C 1.421 5.647 0.189 1.00 . A A . 40 PRO CD 1 1 6 3762 1 1 40 PRO CG C 2.509 6.641 0.476 1.00 . A A . 40 PRO CG 1 1 6 3763 1 1 40 PRO HA H -0.063 8.353 -0.527 1.00 . A A . 40 PRO HA 1 1 6 3764 1 1 40 PRO HB2 H 2.623 8.710 -0.044 1.00 . A A . 40 PRO HB2 1 1 6 3765 1 1 40 PRO HB3 H 1.430 8.335 1.202 1.00 . A A . 40 PRO HB3 1 1 6 3766 1 1 40 PRO HD2 H 1.836 4.746 -0.240 1.00 . A A . 40 PRO HD2 1 1 6 3767 1 1 40 PRO HD3 H 0.869 5.419 1.089 1.00 . A A . 40 PRO HD3 1 1 6 3768 1 1 40 PRO HG2 H 3.327 6.513 -0.217 1.00 . A A . 40 PRO HG2 1 1 6 3769 1 1 40 PRO HG3 H 2.857 6.532 1.492 1.00 . A A . 40 PRO HG3 1 1 6 3770 1 1 40 PRO N N 0.572 6.352 -0.784 1.00 . A A . 40 PRO N 1 1 6 3771 1 1 40 PRO O O 1.678 7.475 -3.011 1.00 . A A . 40 PRO O 1 1 6 3772 1 1 41 SER C C 3.356 10.500 -3.507 1.00 . A A . 41 SER C 1 1 6 3773 1 1 41 SER CA C 1.864 10.177 -3.571 1.00 . A A . 41 SER CA 1 1 6 3774 1 1 41 SER CB C 1.071 11.442 -3.903 1.00 . A A . 41 SER CB 1 1 6 3775 1 1 41 SER H H 1.108 10.189 -1.593 1.00 . A A . 41 SER H 1 1 6 3776 1 1 41 SER HA H 1.702 9.450 -4.353 1.00 . A A . 41 SER HA 1 1 6 3777 1 1 41 SER HB2 H 1.653 12.311 -3.635 1.00 . A A . 41 SER HB2 1 1 6 3778 1 1 41 SER HB3 H 0.860 11.464 -4.962 1.00 . A A . 41 SER HB3 1 1 6 3779 1 1 41 SER HG H -0.017 11.894 -2.338 1.00 . A A . 41 SER HG 1 1 6 3780 1 1 41 SER N N 1.393 9.596 -2.319 1.00 . A A . 41 SER N 1 1 6 3781 1 1 41 SER O O 3.861 11.295 -4.300 1.00 . A A . 41 SER O 1 1 6 3782 1 1 41 SER OG O -0.154 11.478 -3.192 1.00 . A A . 41 SER OG 1 1 6 3783 1 1 42 TYR C C 6.196 8.803 -2.006 1.00 . A A . 42 TYR C 1 1 6 3784 1 1 42 TYR CA C 5.490 10.098 -2.410 1.00 . A A . 42 TYR CA 1 1 6 3785 1 1 42 TYR CB C 5.751 11.189 -1.367 1.00 . A A . 42 TYR CB 1 1 6 3786 1 1 42 TYR CD1 C 6.411 9.975 0.746 1.00 . A A . 42 TYR CD1 1 1 6 3787 1 1 42 TYR CD2 C 4.316 11.113 0.711 1.00 . A A . 42 TYR CD2 1 1 6 3788 1 1 42 TYR CE1 C 6.175 9.572 2.046 1.00 . A A . 42 TYR CE1 1 1 6 3789 1 1 42 TYR CE2 C 4.073 10.713 2.011 1.00 . A A . 42 TYR CE2 1 1 6 3790 1 1 42 TYR CG C 5.487 10.751 0.057 1.00 . A A . 42 TYR CG 1 1 6 3791 1 1 42 TYR CZ C 5.005 9.943 2.674 1.00 . A A . 42 TYR CZ 1 1 6 3792 1 1 42 TYR H H 3.605 9.250 -1.965 1.00 . A A . 42 TYR H 1 1 6 3793 1 1 42 TYR HA H 5.878 10.424 -3.363 1.00 . A A . 42 TYR HA 1 1 6 3794 1 1 42 TYR HB2 H 6.783 11.498 -1.431 1.00 . A A . 42 TYR HB2 1 1 6 3795 1 1 42 TYR HB3 H 5.114 12.036 -1.577 1.00 . A A . 42 TYR HB3 1 1 6 3796 1 1 42 TYR HD1 H 7.326 9.686 0.251 1.00 . A A . 42 TYR HD1 1 1 6 3797 1 1 42 TYR HD2 H 3.587 11.715 0.189 1.00 . A A . 42 TYR HD2 1 1 6 3798 1 1 42 TYR HE1 H 6.906 8.969 2.564 1.00 . A A . 42 TYR HE1 1 1 6 3799 1 1 42 TYR HE2 H 3.156 11.005 2.503 1.00 . A A . 42 TYR HE2 1 1 6 3800 1 1 42 TYR HH H 5.402 9.961 4.555 1.00 . A A . 42 TYR HH 1 1 6 3801 1 1 42 TYR N N 4.058 9.876 -2.566 1.00 . A A . 42 TYR N 1 1 6 3802 1 1 42 TYR O O 5.670 8.025 -1.210 1.00 . A A . 42 TYR O 1 1 6 3803 1 1 42 TYR OH O 4.767 9.543 3.969 1.00 . A A . 42 TYR OH 1 1 6 3804 1 1 43 PRO C C 8.807 7.401 -0.861 1.00 . A A . 43 PRO C 1 1 6 3805 1 1 43 PRO CA C 8.167 7.343 -2.244 1.00 . A A . 43 PRO CA 1 1 6 3806 1 1 43 PRO CB C 9.239 7.327 -3.331 1.00 . A A . 43 PRO CB 1 1 6 3807 1 1 43 PRO CD C 8.103 9.423 -3.515 1.00 . A A . 43 PRO CD 1 1 6 3808 1 1 43 PRO CG C 9.447 8.762 -3.668 1.00 . A A . 43 PRO CG 1 1 6 3809 1 1 43 PRO HA H 7.557 6.455 -2.321 1.00 . A A . 43 PRO HA 1 1 6 3810 1 1 43 PRO HB2 H 10.141 6.874 -2.945 1.00 . A A . 43 PRO HB2 1 1 6 3811 1 1 43 PRO HB3 H 8.884 6.768 -4.184 1.00 . A A . 43 PRO HB3 1 1 6 3812 1 1 43 PRO HD2 H 8.216 10.421 -3.118 1.00 . A A . 43 PRO HD2 1 1 6 3813 1 1 43 PRO HD3 H 7.584 9.448 -4.462 1.00 . A A . 43 PRO HD3 1 1 6 3814 1 1 43 PRO HG2 H 10.160 9.200 -2.985 1.00 . A A . 43 PRO HG2 1 1 6 3815 1 1 43 PRO HG3 H 9.795 8.854 -4.686 1.00 . A A . 43 PRO HG3 1 1 6 3816 1 1 43 PRO N N 7.398 8.552 -2.553 1.00 . A A . 43 PRO N 1 1 6 3817 1 1 43 PRO O O 9.268 8.455 -0.423 1.00 . A A . 43 PRO O 1 1 6 3818 1 1 44 GLY C C 10.877 5.788 1.120 1.00 . A A . 44 GLY C 1 1 6 3819 1 1 44 GLY CA C 9.420 6.204 1.148 1.00 . A A . 44 GLY CA 1 1 6 3820 1 1 44 GLY H H 8.451 5.452 -0.578 1.00 . A A . 44 GLY H 1 1 6 3821 1 1 44 GLY HA2 H 8.866 5.495 1.744 1.00 . A A . 44 GLY HA2 1 1 6 3822 1 1 44 GLY HA3 H 9.344 7.180 1.605 1.00 . A A . 44 GLY HA3 1 1 6 3823 1 1 44 GLY N N 8.833 6.261 -0.178 1.00 . A A . 44 GLY N 1 1 6 3824 1 1 44 GLY O O 11.262 4.806 1.755 1.00 . A A . 44 GLY O 1 1 6 3825 1 1 45 ASN C C 13.930 7.141 1.193 1.00 . A A . 45 ASN C 1 1 6 3826 1 1 45 ASN CA C 13.114 6.239 0.273 1.00 . A A . 45 ASN CA 1 1 6 3827 1 1 45 ASN CB C 13.583 6.408 -1.173 1.00 . A A . 45 ASN CB 1 1 6 3828 1 1 45 ASN CG C 13.422 5.138 -1.986 1.00 . A A . 45 ASN CG 1 1 6 3829 1 1 45 ASN H H 11.324 7.305 -0.102 1.00 . A A . 45 ASN H 1 1 6 3830 1 1 45 ASN HA H 13.262 5.212 0.572 1.00 . A A . 45 ASN HA 1 1 6 3831 1 1 45 ASN HB2 H 13.005 7.190 -1.644 1.00 . A A . 45 ASN HB2 1 1 6 3832 1 1 45 ASN HB3 H 14.627 6.687 -1.177 1.00 . A A . 45 ASN HB3 1 1 6 3833 1 1 45 ASN HD21 H 13.909 6.112 -3.650 1.00 . A A . 45 ASN HD21 1 1 6 3834 1 1 45 ASN HD22 H 13.556 4.432 -3.839 1.00 . A A . 45 ASN HD22 1 1 6 3835 1 1 45 ASN N N 11.690 6.536 0.381 1.00 . A A . 45 ASN N 1 1 6 3836 1 1 45 ASN ND2 N 13.652 5.237 -3.290 1.00 . A A . 45 ASN ND2 1 1 6 3837 1 1 45 ASN O O 14.961 6.732 1.726 1.00 . A A . 45 ASN O 1 1 6 3838 1 1 45 ASN OD1 O 13.096 4.081 -1.448 1.00 . A A . 45 ASN OD1 1 1 6 3839 1 1 46 GLY C C 14.976 10.317 1.443 1.00 . A A . 46 GLY C 1 1 6 3840 1 1 46 GLY CA C 14.159 9.312 2.231 1.00 . A A . 46 GLY CA 1 1 6 3841 1 1 46 GLY H H 12.634 8.643 0.924 1.00 . A A . 46 GLY H 1 1 6 3842 1 1 46 GLY HA2 H 14.818 8.764 2.887 1.00 . A A . 46 GLY HA2 1 1 6 3843 1 1 46 GLY HA3 H 13.434 9.844 2.829 1.00 . A A . 46 GLY HA3 1 1 6 3844 1 1 46 GLY N N 13.461 8.371 1.375 1.00 . A A . 46 GLY N 1 1 6 3845 1 1 46 GLY O O 15.999 10.797 1.975 1.00 . A A . 46 GLY O 1 1 6 3846 1 1 46 GLY OXT O 14.594 10.623 0.294 1.00 . A A . 46 GLY OXT 1 1 7 3847 1 1 1 ALA C C -19.878 -5.910 2.903 1.00 . A A . 1 ALA C 1 1 7 3848 1 1 1 ALA CA C -20.804 -5.064 2.035 1.00 . A A . 1 ALA CA 1 1 7 3849 1 1 1 ALA CB C -21.941 -4.499 2.873 1.00 . A A . 1 ALA CB 1 1 7 3850 1 1 1 ALA H1 H -20.549 -6.357 0.455 1.00 . A A . 1 ALA H1 1 1 7 3851 1 1 1 ALA H2 H -22.040 -6.529 1.288 1.00 . A A . 1 ALA H2 1 1 7 3852 1 1 1 ALA H3 H -21.791 -5.196 0.235 1.00 . A A . 1 ALA H3 1 1 7 3853 1 1 1 ALA HA H -20.241 -4.235 1.631 1.00 . A A . 1 ALA HA 1 1 7 3854 1 1 1 ALA HB1 H -21.553 -3.753 3.550 1.00 . A A . 1 ALA HB1 1 1 7 3855 1 1 1 ALA HB2 H -22.676 -4.048 2.223 1.00 . A A . 1 ALA HB2 1 1 7 3856 1 1 1 ALA HB3 H -22.401 -5.296 3.439 1.00 . A A . 1 ALA HB3 1 1 7 3857 1 1 1 ALA N N -21.344 -5.858 0.901 1.00 . A A . 1 ALA N 1 1 7 3858 1 1 1 ALA O O -20.273 -6.388 3.967 1.00 . A A . 1 ALA O 1 1 7 3859 1 1 2 MET C C -16.693 -5.977 3.929 1.00 . A A . 2 MET C 1 1 7 3860 1 1 2 MET CA C -17.663 -6.881 3.176 1.00 . A A . 2 MET CA 1 1 7 3861 1 1 2 MET CB C -16.891 -7.792 2.219 1.00 . A A . 2 MET CB 1 1 7 3862 1 1 2 MET CE C -17.910 -11.219 0.107 1.00 . A A . 2 MET CE 1 1 7 3863 1 1 2 MET CG C -17.733 -8.916 1.639 1.00 . A A . 2 MET CG 1 1 7 3864 1 1 2 MET H H -18.390 -5.686 1.587 1.00 . A A . 2 MET H 1 1 7 3865 1 1 2 MET HA H -18.195 -7.492 3.890 1.00 . A A . 2 MET HA 1 1 7 3866 1 1 2 MET HB2 H -16.511 -7.197 1.402 1.00 . A A . 2 MET HB2 1 1 7 3867 1 1 2 MET HB3 H -16.060 -8.231 2.751 1.00 . A A . 2 MET HB3 1 1 7 3868 1 1 2 MET HE1 H -17.969 -11.687 1.078 1.00 . A A . 2 MET HE1 1 1 7 3869 1 1 2 MET HE2 H -18.905 -10.981 -0.240 1.00 . A A . 2 MET HE2 1 1 7 3870 1 1 2 MET HE3 H -17.438 -11.895 -0.591 1.00 . A A . 2 MET HE3 1 1 7 3871 1 1 2 MET HG2 H -17.898 -9.657 2.406 1.00 . A A . 2 MET HG2 1 1 7 3872 1 1 2 MET HG3 H -18.682 -8.510 1.322 1.00 . A A . 2 MET HG3 1 1 7 3873 1 1 2 MET N N -18.645 -6.092 2.441 1.00 . A A . 2 MET N 1 1 7 3874 1 1 2 MET O O -16.366 -4.882 3.472 1.00 . A A . 2 MET O 1 1 7 3875 1 1 2 MET SD S -16.945 -9.715 0.227 1.00 . A A . 2 MET SD 1 1 7 3876 1 1 3 ASP C C -13.862 -5.928 5.468 1.00 . A A . 3 ASP C 1 1 7 3877 1 1 3 ASP CA C -15.302 -5.676 5.904 1.00 . A A . 3 ASP CA 1 1 7 3878 1 1 3 ASP CB C -15.470 -6.036 7.381 1.00 . A A . 3 ASP CB 1 1 7 3879 1 1 3 ASP CG C -16.775 -5.520 7.957 1.00 . A A . 3 ASP CG 1 1 7 3880 1 1 3 ASP H H -16.532 -7.323 5.399 1.00 . A A . 3 ASP H 1 1 7 3881 1 1 3 ASP HA H -15.528 -4.629 5.770 1.00 . A A . 3 ASP HA 1 1 7 3882 1 1 3 ASP HB2 H -15.452 -7.110 7.488 1.00 . A A . 3 ASP HB2 1 1 7 3883 1 1 3 ASP HB3 H -14.654 -5.608 7.945 1.00 . A A . 3 ASP HB3 1 1 7 3884 1 1 3 ASP N N -16.235 -6.443 5.087 1.00 . A A . 3 ASP N 1 1 7 3885 1 1 3 ASP O O -13.141 -6.705 6.093 1.00 . A A . 3 ASP O 1 1 7 3886 1 1 3 ASP OD1 O -16.813 -5.227 9.171 1.00 . A A . 3 ASP OD1 1 1 7 3887 1 1 3 ASP OD2 O -17.757 -5.409 7.194 1.00 . A A . 3 ASP OD2 1 1 7 3888 1 1 4 CYS C C -11.692 -4.204 3.043 1.00 . A A . 4 CYS C 1 1 7 3889 1 1 4 CYS CA C -12.097 -5.418 3.872 1.00 . A A . 4 CYS CA 1 1 7 3890 1 1 4 CYS CB C -11.994 -6.685 3.020 1.00 . A A . 4 CYS CB 1 1 7 3891 1 1 4 CYS H H -14.072 -4.660 3.936 1.00 . A A . 4 CYS H 1 1 7 3892 1 1 4 CYS HA H -11.426 -5.505 4.713 1.00 . A A . 4 CYS HA 1 1 7 3893 1 1 4 CYS HB2 H -12.893 -6.788 2.432 1.00 . A A . 4 CYS HB2 1 1 7 3894 1 1 4 CYS HB3 H -11.145 -6.594 2.358 1.00 . A A . 4 CYS HB3 1 1 7 3895 1 1 4 CYS N N -13.451 -5.266 4.392 1.00 . A A . 4 CYS N 1 1 7 3896 1 1 4 CYS O O -12.523 -3.357 2.715 1.00 . A A . 4 CYS O 1 1 7 3897 1 1 4 CYS SG S -11.786 -8.218 3.984 1.00 . A A . 4 CYS SG 1 1 7 3898 1 1 5 THR C C -9.416 -3.513 0.546 1.00 . A A . 5 THR C 1 1 7 3899 1 1 5 THR CA C -9.889 -3.022 1.911 1.00 . A A . 5 THR CA 1 1 7 3900 1 1 5 THR CB C -8.739 -2.333 2.649 1.00 . A A . 5 THR CB 1 1 7 3901 1 1 5 THR CG2 C -8.828 -0.823 2.617 1.00 . A A . 5 THR CG2 1 1 7 3902 1 1 5 THR H H -9.797 -4.836 2.996 1.00 . A A . 5 THR H 1 1 7 3903 1 1 5 THR HA H -10.689 -2.310 1.768 1.00 . A A . 5 THR HA 1 1 7 3904 1 1 5 THR HB H -7.805 -2.619 2.187 1.00 . A A . 5 THR HB 1 1 7 3905 1 1 5 THR HG1 H -7.789 -2.832 4.288 1.00 . A A . 5 THR HG1 1 1 7 3906 1 1 5 THR HG21 H -9.757 -0.507 3.070 1.00 . A A . 5 THR HG21 1 1 7 3907 1 1 5 THR HG22 H -7.999 -0.401 3.166 1.00 . A A . 5 THR HG22 1 1 7 3908 1 1 5 THR HG23 H -8.794 -0.482 1.593 1.00 . A A . 5 THR HG23 1 1 7 3909 1 1 5 THR N N -10.409 -4.129 2.705 1.00 . A A . 5 THR N 1 1 7 3910 1 1 5 THR O O -8.995 -4.660 0.402 1.00 . A A . 5 THR O 1 1 7 3911 1 1 5 THR OG1 O -8.702 -2.732 4.008 1.00 . A A . 5 THR OG1 1 1 7 3912 1 1 6 THR C C -8.315 -1.835 -2.459 1.00 . A A . 6 THR C 1 1 7 3913 1 1 6 THR CA C -9.067 -2.989 -1.805 1.00 . A A . 6 THR CA 1 1 7 3914 1 1 6 THR CB C -10.280 -3.369 -2.656 1.00 . A A . 6 THR CB 1 1 7 3915 1 1 6 THR CG2 C -10.979 -4.622 -2.175 1.00 . A A . 6 THR CG2 1 1 7 3916 1 1 6 THR H H -9.834 -1.738 -0.277 1.00 . A A . 6 THR H 1 1 7 3917 1 1 6 THR HA H -8.407 -3.840 -1.735 1.00 . A A . 6 THR HA 1 1 7 3918 1 1 6 THR HB H -9.954 -3.542 -3.672 1.00 . A A . 6 THR HB 1 1 7 3919 1 1 6 THR HG1 H -11.389 -2.022 -1.768 1.00 . A A . 6 THR HG1 1 1 7 3920 1 1 6 THR HG21 H -11.263 -4.501 -1.140 1.00 . A A . 6 THR HG21 1 1 7 3921 1 1 6 THR HG22 H -11.862 -4.794 -2.773 1.00 . A A . 6 THR HG22 1 1 7 3922 1 1 6 THR HG23 H -10.311 -5.466 -2.269 1.00 . A A . 6 THR HG23 1 1 7 3923 1 1 6 THR N N -9.489 -2.639 -0.452 1.00 . A A . 6 THR N 1 1 7 3924 1 1 6 THR O O -8.805 -0.706 -2.502 1.00 . A A . 6 THR O 1 1 7 3925 1 1 6 THR OG1 O -11.233 -2.322 -2.666 1.00 . A A . 6 THR OG1 1 1 7 3926 1 1 7 GLY C C -4.914 -1.567 -3.934 1.00 . A A . 7 GLY C 1 1 7 3927 1 1 7 GLY CA C -6.323 -1.099 -3.615 1.00 . A A . 7 GLY CA 1 1 7 3928 1 1 7 GLY H H -6.781 -3.042 -2.906 1.00 . A A . 7 GLY H 1 1 7 3929 1 1 7 GLY HA2 H -6.267 -0.239 -2.966 1.00 . A A . 7 GLY HA2 1 1 7 3930 1 1 7 GLY HA3 H -6.809 -0.810 -4.535 1.00 . A A . 7 GLY HA3 1 1 7 3931 1 1 7 GLY N N -7.121 -2.125 -2.968 1.00 . A A . 7 GLY N 1 1 7 3932 1 1 7 GLY O O -4.701 -2.742 -4.233 1.00 . A A . 7 GLY O 1 1 7 3933 1 1 8 PRO C C -1.771 -1.551 -2.990 1.00 . A A . 8 PRO C 1 1 7 3934 1 1 8 PRO CA C -2.530 -0.988 -4.192 1.00 . A A . 8 PRO CA 1 1 7 3935 1 1 8 PRO CB C -1.957 0.366 -4.601 1.00 . A A . 8 PRO CB 1 1 7 3936 1 1 8 PRO CD C -4.086 0.771 -3.559 1.00 . A A . 8 PRO CD 1 1 7 3937 1 1 8 PRO CG C -2.710 1.353 -3.775 1.00 . A A . 8 PRO CG 1 1 7 3938 1 1 8 PRO HA H -2.456 -1.677 -5.019 1.00 . A A . 8 PRO HA 1 1 7 3939 1 1 8 PRO HB2 H -0.899 0.393 -4.387 1.00 . A A . 8 PRO HB2 1 1 7 3940 1 1 8 PRO HB3 H -2.122 0.529 -5.656 1.00 . A A . 8 PRO HB3 1 1 7 3941 1 1 8 PRO HD2 H -4.390 0.895 -2.530 1.00 . A A . 8 PRO HD2 1 1 7 3942 1 1 8 PRO HD3 H -4.800 1.240 -4.221 1.00 . A A . 8 PRO HD3 1 1 7 3943 1 1 8 PRO HG2 H -2.211 1.492 -2.827 1.00 . A A . 8 PRO HG2 1 1 7 3944 1 1 8 PRO HG3 H -2.780 2.293 -4.302 1.00 . A A . 8 PRO HG3 1 1 7 3945 1 1 8 PRO N N -3.923 -0.658 -3.890 1.00 . A A . 8 PRO N 1 1 7 3946 1 1 8 PRO O O -1.014 -2.513 -3.122 1.00 . A A . 8 PRO O 1 1 7 3947 1 1 9 CYS C C -1.912 -2.644 -0.033 1.00 . A A . 9 CYS C 1 1 7 3948 1 1 9 CYS CA C -1.279 -1.381 -0.609 1.00 . A A . 9 CYS CA 1 1 7 3949 1 1 9 CYS CB C -1.294 -0.273 0.445 1.00 . A A . 9 CYS CB 1 1 7 3950 1 1 9 CYS H H -2.570 -0.172 -1.779 1.00 . A A . 9 CYS H 1 1 7 3951 1 1 9 CYS HA H -0.256 -1.599 -0.870 1.00 . A A . 9 CYS HA 1 1 7 3952 1 1 9 CYS HB2 H -0.835 0.613 0.033 1.00 . A A . 9 CYS HB2 1 1 7 3953 1 1 9 CYS HB3 H -2.318 -0.052 0.709 1.00 . A A . 9 CYS HB3 1 1 7 3954 1 1 9 CYS N N -1.963 -0.941 -1.823 1.00 . A A . 9 CYS N 1 1 7 3955 1 1 9 CYS O O -1.257 -3.679 0.083 1.00 . A A . 9 CYS O 1 1 7 3956 1 1 9 CYS SG S -0.405 -0.697 1.977 1.00 . A A . 9 CYS SG 1 1 7 3957 1 1 10 CYS C C -3.903 -4.867 -0.056 1.00 . A A . 10 CYS C 1 1 7 3958 1 1 10 CYS CA C -3.891 -3.690 0.912 1.00 . A A . 10 CYS CA 1 1 7 3959 1 1 10 CYS CB C -5.320 -3.295 1.292 1.00 . A A . 10 CYS CB 1 1 7 3960 1 1 10 CYS H H -3.650 -1.699 0.233 1.00 . A A . 10 CYS H 1 1 7 3961 1 1 10 CYS HA H -3.363 -3.988 1.805 1.00 . A A . 10 CYS HA 1 1 7 3962 1 1 10 CYS HB2 H -5.785 -4.118 1.812 1.00 . A A . 10 CYS HB2 1 1 7 3963 1 1 10 CYS HB3 H -5.283 -2.438 1.947 1.00 . A A . 10 CYS HB3 1 1 7 3964 1 1 10 CYS N N -3.182 -2.552 0.339 1.00 . A A . 10 CYS N 1 1 7 3965 1 1 10 CYS O O -4.437 -4.774 -1.161 1.00 . A A . 10 CYS O 1 1 7 3966 1 1 10 CYS SG S -6.385 -2.868 -0.124 1.00 . A A . 10 CYS SG 1 1 7 3967 1 1 11 ARG C C -4.608 -7.591 -0.951 1.00 . A A . 11 ARG C 1 1 7 3968 1 1 11 ARG CA C -3.228 -7.176 -0.453 1.00 . A A . 11 ARG CA 1 1 7 3969 1 1 11 ARG CB C -2.590 -8.321 0.338 1.00 . A A . 11 ARG CB 1 1 7 3970 1 1 11 ARG CD C -0.451 -9.635 0.446 1.00 . A A . 11 ARG CD 1 1 7 3971 1 1 11 ARG CG C -1.556 -9.105 -0.453 1.00 . A A . 11 ARG CG 1 1 7 3972 1 1 11 ARG CZ C 1.728 -10.756 0.183 1.00 . A A . 11 ARG CZ 1 1 7 3973 1 1 11 ARG H H -2.889 -5.980 1.259 1.00 . A A . 11 ARG H 1 1 7 3974 1 1 11 ARG HA H -2.605 -6.954 -1.306 1.00 . A A . 11 ARG HA 1 1 7 3975 1 1 11 ARG HB2 H -2.108 -7.913 1.214 1.00 . A A . 11 ARG HB2 1 1 7 3976 1 1 11 ARG HB3 H -3.366 -9.004 0.652 1.00 . A A . 11 ARG HB3 1 1 7 3977 1 1 11 ARG HD2 H 0.046 -8.798 0.915 1.00 . A A . 11 ARG HD2 1 1 7 3978 1 1 11 ARG HD3 H -0.892 -10.262 1.206 1.00 . A A . 11 ARG HD3 1 1 7 3979 1 1 11 ARG HE H 0.296 -10.696 -1.207 1.00 . A A . 11 ARG HE 1 1 7 3980 1 1 11 ARG HG2 H -2.043 -9.938 -0.937 1.00 . A A . 11 ARG HG2 1 1 7 3981 1 1 11 ARG HG3 H -1.121 -8.456 -1.200 1.00 . A A . 11 ARG HG3 1 1 7 3982 1 1 11 ARG HH11 H 1.460 -9.855 1.974 1.00 . A A . 11 ARG HH11 1 1 7 3983 1 1 11 ARG HH12 H 2.983 -10.651 1.764 1.00 . A A . 11 ARG HH12 1 1 7 3984 1 1 11 ARG HH21 H 2.300 -11.744 -1.485 1.00 . A A . 11 ARG HH21 1 1 7 3985 1 1 11 ARG HH22 H 3.461 -11.723 -0.200 1.00 . A A . 11 ARG HH22 1 1 7 3986 1 1 11 ARG N N -3.300 -5.974 0.370 1.00 . A A . 11 ARG N 1 1 7 3987 1 1 11 ARG NE N 0.535 -10.413 -0.299 1.00 . A A . 11 ARG NE 1 1 7 3988 1 1 11 ARG NH1 N 2.086 -10.390 1.407 1.00 . A A . 11 ARG NH1 1 1 7 3989 1 1 11 ARG NH2 N 2.565 -11.466 -0.562 1.00 . A A . 11 ARG NH2 1 1 7 3990 1 1 11 ARG O O -4.910 -7.472 -2.138 1.00 . A A . 11 ARG O 1 1 7 3991 1 1 12 GLN C C -7.809 -8.195 0.680 1.00 . A A . 12 GLN C 1 1 7 3992 1 1 12 GLN CA C -6.783 -8.525 -0.404 1.00 . A A . 12 GLN CA 1 1 7 3993 1 1 12 GLN CB C -6.786 -10.030 -0.668 1.00 . A A . 12 GLN CB 1 1 7 3994 1 1 12 GLN CD C -5.689 -11.879 -1.994 1.00 . A A . 12 GLN CD 1 1 7 3995 1 1 12 GLN CG C -6.107 -10.422 -1.970 1.00 . A A . 12 GLN CG 1 1 7 3996 1 1 12 GLN H H -5.144 -8.166 0.889 1.00 . A A . 12 GLN H 1 1 7 3997 1 1 12 GLN HA H -7.062 -8.014 -1.312 1.00 . A A . 12 GLN HA 1 1 7 3998 1 1 12 GLN HB2 H -6.274 -10.525 0.144 1.00 . A A . 12 GLN HB2 1 1 7 3999 1 1 12 GLN HB3 H -7.809 -10.375 -0.701 1.00 . A A . 12 GLN HB3 1 1 7 4000 1 1 12 GLN HE21 H -6.477 -12.102 -3.806 1.00 . A A . 12 GLN HE21 1 1 7 4001 1 1 12 GLN HE22 H -5.742 -13.511 -3.128 1.00 . A A . 12 GLN HE22 1 1 7 4002 1 1 12 GLN HG2 H -6.793 -10.247 -2.786 1.00 . A A . 12 GLN HG2 1 1 7 4003 1 1 12 GLN HG3 H -5.229 -9.807 -2.102 1.00 . A A . 12 GLN HG3 1 1 7 4004 1 1 12 GLN N N -5.441 -8.087 -0.041 1.00 . A A . 12 GLN N 1 1 7 4005 1 1 12 GLN NE2 N -6.001 -12.566 -3.086 1.00 . A A . 12 GLN NE2 1 1 7 4006 1 1 12 GLN O O -8.959 -8.625 0.597 1.00 . A A . 12 GLN O 1 1 7 4007 1 1 12 GLN OE1 O -5.091 -12.380 -1.042 1.00 . A A . 12 GLN OE1 1 1 7 4008 1 1 13 CYS C C -7.689 -6.097 3.762 1.00 . A A . 13 CYS C 1 1 7 4009 1 1 13 CYS CA C -8.319 -7.073 2.770 1.00 . A A . 13 CYS CA 1 1 7 4010 1 1 13 CYS CB C -8.788 -8.329 3.508 1.00 . A A . 13 CYS CB 1 1 7 4011 1 1 13 CYS H H -6.479 -7.114 1.719 1.00 . A A . 13 CYS H 1 1 7 4012 1 1 13 CYS HA H -9.177 -6.598 2.320 1.00 . A A . 13 CYS HA 1 1 7 4013 1 1 13 CYS HB2 H -9.272 -8.991 2.806 1.00 . A A . 13 CYS HB2 1 1 7 4014 1 1 13 CYS HB3 H -7.930 -8.828 3.934 1.00 . A A . 13 CYS HB3 1 1 7 4015 1 1 13 CYS N N -7.402 -7.435 1.694 1.00 . A A . 13 CYS N 1 1 7 4016 1 1 13 CYS O O -8.373 -5.220 4.290 1.00 . A A . 13 CYS O 1 1 7 4017 1 1 13 CYS SG S -9.967 -8.001 4.860 1.00 . A A . 13 CYS SG 1 1 7 4018 1 1 14 LYS C C -4.516 -4.691 4.322 1.00 . A A . 14 LYS C 1 1 7 4019 1 1 14 LYS CA C -5.711 -5.375 4.970 1.00 . A A . 14 LYS CA 1 1 7 4020 1 1 14 LYS CB C -5.254 -6.170 6.194 1.00 . A A . 14 LYS CB 1 1 7 4021 1 1 14 LYS CD C -4.259 -5.819 8.475 1.00 . A A . 14 LYS CD 1 1 7 4022 1 1 14 LYS CE C -4.470 -7.250 8.939 1.00 . A A . 14 LYS CE 1 1 7 4023 1 1 14 LYS CG C -5.338 -5.387 7.494 1.00 . A A . 14 LYS CG 1 1 7 4024 1 1 14 LYS H H -5.890 -6.969 3.587 1.00 . A A . 14 LYS H 1 1 7 4025 1 1 14 LYS HA H -6.414 -4.619 5.288 1.00 . A A . 14 LYS HA 1 1 7 4026 1 1 14 LYS HB2 H -5.873 -7.050 6.289 1.00 . A A . 14 LYS HB2 1 1 7 4027 1 1 14 LYS HB3 H -4.229 -6.476 6.048 1.00 . A A . 14 LYS HB3 1 1 7 4028 1 1 14 LYS HD2 H -3.296 -5.746 7.991 1.00 . A A . 14 LYS HD2 1 1 7 4029 1 1 14 LYS HD3 H -4.283 -5.163 9.333 1.00 . A A . 14 LYS HD3 1 1 7 4030 1 1 14 LYS HE2 H -4.169 -7.328 9.974 1.00 . A A . 14 LYS HE2 1 1 7 4031 1 1 14 LYS HE3 H -5.519 -7.493 8.851 1.00 . A A . 14 LYS HE3 1 1 7 4032 1 1 14 LYS HG2 H -5.214 -4.336 7.279 1.00 . A A . 14 LYS HG2 1 1 7 4033 1 1 14 LYS HG3 H -6.306 -5.553 7.942 1.00 . A A . 14 LYS HG3 1 1 7 4034 1 1 14 LYS HZ1 H -2.741 -7.822 7.915 1.00 . A A . 14 LYS HZ1 1 1 7 4035 1 1 14 LYS HZ2 H -3.552 -9.106 8.660 1.00 . A A . 14 LYS HZ2 1 1 7 4036 1 1 14 LYS HZ3 H -4.170 -8.427 7.240 1.00 . A A . 14 LYS HZ3 1 1 7 4037 1 1 14 LYS N N -6.395 -6.251 4.026 1.00 . A A . 14 LYS N 1 1 7 4038 1 1 14 LYS NZ N -3.678 -8.219 8.132 1.00 . A A . 14 LYS NZ 1 1 7 4039 1 1 14 LYS O O -3.767 -5.309 3.566 1.00 . A A . 14 LYS O 1 1 7 4040 1 1 15 LEU C C -1.910 -3.382 4.289 1.00 . A A . 15 LEU C 1 1 7 4041 1 1 15 LEU CA C -3.227 -2.641 4.083 1.00 . A A . 15 LEU CA 1 1 7 4042 1 1 15 LEU CB C -3.148 -1.239 4.711 1.00 . A A . 15 LEU CB 1 1 7 4043 1 1 15 LEU CD1 C -5.082 -0.960 6.306 1.00 . A A . 15 LEU CD1 1 1 7 4044 1 1 15 LEU CD2 C -3.074 -2.283 7.016 1.00 . A A . 15 LEU CD2 1 1 7 4045 1 1 15 LEU CG C -3.572 -1.107 6.184 1.00 . A A . 15 LEU CG 1 1 7 4046 1 1 15 LEU H H -4.967 -2.977 5.241 1.00 . A A . 15 LEU H 1 1 7 4047 1 1 15 LEU HA H -3.397 -2.534 3.023 1.00 . A A . 15 LEU HA 1 1 7 4048 1 1 15 LEU HB2 H -2.128 -0.895 4.628 1.00 . A A . 15 LEU HB2 1 1 7 4049 1 1 15 LEU HB3 H -3.773 -0.581 4.126 1.00 . A A . 15 LEU HB3 1 1 7 4050 1 1 15 LEU HD11 H -5.515 -0.852 5.322 1.00 . A A . 15 LEU HD11 1 1 7 4051 1 1 15 LEU HD12 H -5.493 -1.836 6.785 1.00 . A A . 15 LEU HD12 1 1 7 4052 1 1 15 LEU HD13 H -5.312 -0.085 6.897 1.00 . A A . 15 LEU HD13 1 1 7 4053 1 1 15 LEU HD21 H -1.996 -2.327 6.966 1.00 . A A . 15 LEU HD21 1 1 7 4054 1 1 15 LEU HD22 H -3.380 -2.151 8.043 1.00 . A A . 15 LEU HD22 1 1 7 4055 1 1 15 LEU HD23 H -3.489 -3.201 6.633 1.00 . A A . 15 LEU HD23 1 1 7 4056 1 1 15 LEU HG H -3.127 -0.208 6.589 1.00 . A A . 15 LEU HG 1 1 7 4057 1 1 15 LEU N N -4.339 -3.409 4.631 1.00 . A A . 15 LEU N 1 1 7 4058 1 1 15 LEU O O -1.598 -3.817 5.396 1.00 . A A . 15 LEU O 1 1 7 4059 1 1 16 LYS C C 0.959 -3.734 4.478 1.00 . A A . 16 LYS C 1 1 7 4060 1 1 16 LYS CA C 0.136 -4.233 3.289 1.00 . A A . 16 LYS CA 1 1 7 4061 1 1 16 LYS CB C 0.923 -4.046 1.990 1.00 . A A . 16 LYS CB 1 1 7 4062 1 1 16 LYS CD C 1.242 -4.839 -0.373 1.00 . A A . 16 LYS CD 1 1 7 4063 1 1 16 LYS CE C 0.390 -5.529 -1.427 1.00 . A A . 16 LYS CE 1 1 7 4064 1 1 16 LYS CG C 0.805 -5.220 1.032 1.00 . A A . 16 LYS CG 1 1 7 4065 1 1 16 LYS H H -1.442 -3.176 2.351 1.00 . A A . 16 LYS H 1 1 7 4066 1 1 16 LYS HA H -0.074 -5.285 3.425 1.00 . A A . 16 LYS HA 1 1 7 4067 1 1 16 LYS HB2 H 0.561 -3.161 1.487 1.00 . A A . 16 LYS HB2 1 1 7 4068 1 1 16 LYS HB3 H 1.968 -3.910 2.230 1.00 . A A . 16 LYS HB3 1 1 7 4069 1 1 16 LYS HD2 H 1.147 -3.770 -0.492 1.00 . A A . 16 LYS HD2 1 1 7 4070 1 1 16 LYS HD3 H 2.273 -5.129 -0.510 1.00 . A A . 16 LYS HD3 1 1 7 4071 1 1 16 LYS HE2 H 0.793 -6.514 -1.609 1.00 . A A . 16 LYS HE2 1 1 7 4072 1 1 16 LYS HE3 H -0.620 -5.617 -1.055 1.00 . A A . 16 LYS HE3 1 1 7 4073 1 1 16 LYS HG2 H 1.430 -6.026 1.386 1.00 . A A . 16 LYS HG2 1 1 7 4074 1 1 16 LYS HG3 H -0.225 -5.546 1.004 1.00 . A A . 16 LYS HG3 1 1 7 4075 1 1 16 LYS HZ1 H 0.041 -3.798 -2.543 1.00 . A A . 16 LYS HZ1 1 1 7 4076 1 1 16 LYS HZ2 H 1.326 -4.737 -3.119 1.00 . A A . 16 LYS HZ2 1 1 7 4077 1 1 16 LYS HZ3 H -0.269 -5.231 -3.387 1.00 . A A . 16 LYS HZ3 1 1 7 4078 1 1 16 LYS N N -1.142 -3.535 3.214 1.00 . A A . 16 LYS N 1 1 7 4079 1 1 16 LYS NZ N 0.371 -4.771 -2.709 1.00 . A A . 16 LYS NZ 1 1 7 4080 1 1 16 LYS O O 0.794 -2.597 4.921 1.00 . A A . 16 LYS O 1 1 7 4081 1 1 17 PRO C C 3.439 -2.902 5.940 1.00 . A A . 17 PRO C 1 1 7 4082 1 1 17 PRO CA C 2.699 -4.218 6.157 1.00 . A A . 17 PRO CA 1 1 7 4083 1 1 17 PRO CB C 3.696 -5.383 6.266 1.00 . A A . 17 PRO CB 1 1 7 4084 1 1 17 PRO CD C 2.120 -5.947 4.555 1.00 . A A . 17 PRO CD 1 1 7 4085 1 1 17 PRO CG C 3.531 -6.176 5.010 1.00 . A A . 17 PRO CG 1 1 7 4086 1 1 17 PRO HA H 2.119 -4.153 7.066 1.00 . A A . 17 PRO HA 1 1 7 4087 1 1 17 PRO HB2 H 4.699 -4.991 6.353 1.00 . A A . 17 PRO HB2 1 1 7 4088 1 1 17 PRO HB3 H 3.463 -5.976 7.138 1.00 . A A . 17 PRO HB3 1 1 7 4089 1 1 17 PRO HD2 H 2.052 -6.016 3.479 1.00 . A A . 17 PRO HD2 1 1 7 4090 1 1 17 PRO HD3 H 1.449 -6.650 5.026 1.00 . A A . 17 PRO HD3 1 1 7 4091 1 1 17 PRO HG2 H 4.227 -5.827 4.262 1.00 . A A . 17 PRO HG2 1 1 7 4092 1 1 17 PRO HG3 H 3.693 -7.224 5.215 1.00 . A A . 17 PRO HG3 1 1 7 4093 1 1 17 PRO N N 1.855 -4.579 5.014 1.00 . A A . 17 PRO N 1 1 7 4094 1 1 17 PRO O O 4.057 -2.692 4.898 1.00 . A A . 17 PRO O 1 1 7 4095 1 1 18 ALA C C 5.485 -0.877 6.376 1.00 . A A . 18 ALA C 1 1 7 4096 1 1 18 ALA CA C 4.044 -0.723 6.854 1.00 . A A . 18 ALA CA 1 1 7 4097 1 1 18 ALA CB C 4.006 -0.026 8.205 1.00 . A A . 18 ALA CB 1 1 7 4098 1 1 18 ALA H H 2.869 -2.244 7.741 1.00 . A A . 18 ALA H 1 1 7 4099 1 1 18 ALA HA H 3.504 -0.113 6.144 1.00 . A A . 18 ALA HA 1 1 7 4100 1 1 18 ALA HB1 H 4.606 -0.578 8.912 1.00 . A A . 18 ALA HB1 1 1 7 4101 1 1 18 ALA HB2 H 4.398 0.976 8.104 1.00 . A A . 18 ALA HB2 1 1 7 4102 1 1 18 ALA HB3 H 2.986 0.021 8.557 1.00 . A A . 18 ALA HB3 1 1 7 4103 1 1 18 ALA N N 3.376 -2.019 6.934 1.00 . A A . 18 ALA N 1 1 7 4104 1 1 18 ALA O O 6.051 -1.970 6.426 1.00 . A A . 18 ALA O 1 1 7 4105 1 1 19 GLY C C 7.613 -0.817 4.289 1.00 . A A . 19 GLY C 1 1 7 4106 1 1 19 GLY CA C 7.439 0.174 5.424 1.00 . A A . 19 GLY CA 1 1 7 4107 1 1 19 GLY H H 5.573 1.062 5.888 1.00 . A A . 19 GLY H 1 1 7 4108 1 1 19 GLY HA2 H 8.090 -0.110 6.238 1.00 . A A . 19 GLY HA2 1 1 7 4109 1 1 19 GLY HA3 H 7.720 1.157 5.077 1.00 . A A . 19 GLY HA3 1 1 7 4110 1 1 19 GLY N N 6.072 0.219 5.909 1.00 . A A . 19 GLY N 1 1 7 4111 1 1 19 GLY O O 8.705 -1.344 4.075 1.00 . A A . 19 GLY O 1 1 7 4112 1 1 20 THR C C 6.009 -1.336 1.183 1.00 . A A . 20 THR C 1 1 7 4113 1 1 20 THR CA C 6.556 -2.000 2.440 1.00 . A A . 20 THR CA 1 1 7 4114 1 1 20 THR CB C 5.735 -3.248 2.768 1.00 . A A . 20 THR CB 1 1 7 4115 1 1 20 THR CG2 C 5.869 -4.345 1.735 1.00 . A A . 20 THR CG2 1 1 7 4116 1 1 20 THR H H 5.690 -0.615 3.781 1.00 . A A . 20 THR H 1 1 7 4117 1 1 20 THR HA H 7.583 -2.287 2.268 1.00 . A A . 20 THR HA 1 1 7 4118 1 1 20 THR HB H 4.691 -2.973 2.822 1.00 . A A . 20 THR HB 1 1 7 4119 1 1 20 THR HG1 H 5.355 -4.184 4.446 1.00 . A A . 20 THR HG1 1 1 7 4120 1 1 20 THR HG21 H 6.118 -3.911 0.778 1.00 . A A . 20 THR HG21 1 1 7 4121 1 1 20 THR HG22 H 6.651 -5.028 2.035 1.00 . A A . 20 THR HG22 1 1 7 4122 1 1 20 THR HG23 H 4.934 -4.881 1.656 1.00 . A A . 20 THR HG23 1 1 7 4123 1 1 20 THR N N 6.530 -1.069 3.560 1.00 . A A . 20 THR N 1 1 7 4124 1 1 20 THR O O 5.032 -0.590 1.240 1.00 . A A . 20 THR O 1 1 7 4125 1 1 20 THR OG1 O 6.118 -3.787 4.021 1.00 . A A . 20 THR OG1 1 1 7 4126 1 1 21 THR C C 4.768 -1.420 -1.523 1.00 . A A . 21 THR C 1 1 7 4127 1 1 21 THR CA C 6.210 -1.033 -1.217 1.00 . A A . 21 THR CA 1 1 7 4128 1 1 21 THR CB C 7.130 -1.478 -2.354 1.00 . A A . 21 THR CB 1 1 7 4129 1 1 21 THR CG2 C 7.837 -0.321 -3.023 1.00 . A A . 21 THR CG2 1 1 7 4130 1 1 21 THR H H 7.415 -2.212 0.064 1.00 . A A . 21 THR H 1 1 7 4131 1 1 21 THR HA H 6.265 0.041 -1.124 1.00 . A A . 21 THR HA 1 1 7 4132 1 1 21 THR HB H 6.543 -1.986 -3.106 1.00 . A A . 21 THR HB 1 1 7 4133 1 1 21 THR HG1 H 8.764 -1.897 -1.354 1.00 . A A . 21 THR HG1 1 1 7 4134 1 1 21 THR HG21 H 7.850 0.525 -2.351 1.00 . A A . 21 THR HG21 1 1 7 4135 1 1 21 THR HG22 H 8.850 -0.607 -3.262 1.00 . A A . 21 THR HG22 1 1 7 4136 1 1 21 THR HG23 H 7.312 -0.055 -3.928 1.00 . A A . 21 THR HG23 1 1 7 4137 1 1 21 THR N N 6.642 -1.610 0.049 1.00 . A A . 21 THR N 1 1 7 4138 1 1 21 THR O O 4.449 -2.600 -1.675 1.00 . A A . 21 THR O 1 1 7 4139 1 1 21 THR OG1 O 8.121 -2.376 -1.883 1.00 . A A . 21 THR OG1 1 1 7 4140 1 1 22 CYS C C 2.116 -0.152 -3.279 1.00 . A A . 22 CYS C 1 1 7 4141 1 1 22 CYS CA C 2.490 -0.655 -1.891 1.00 . A A . 22 CYS CA 1 1 7 4142 1 1 22 CYS CB C 1.605 0.022 -0.838 1.00 . A A . 22 CYS CB 1 1 7 4143 1 1 22 CYS H H 4.215 0.499 -1.475 1.00 . A A . 22 CYS H 1 1 7 4144 1 1 22 CYS HA H 2.323 -1.720 -1.854 1.00 . A A . 22 CYS HA 1 1 7 4145 1 1 22 CYS HB2 H 0.607 0.129 -1.237 1.00 . A A . 22 CYS HB2 1 1 7 4146 1 1 22 CYS HB3 H 1.568 -0.602 0.043 1.00 . A A . 22 CYS HB3 1 1 7 4147 1 1 22 CYS N N 3.900 -0.419 -1.608 1.00 . A A . 22 CYS N 1 1 7 4148 1 1 22 CYS O O 1.090 0.505 -3.454 1.00 . A A . 22 CYS O 1 1 7 4149 1 1 22 CYS SG S 2.168 1.679 -0.322 1.00 . A A . 22 CYS SG 1 1 7 4150 1 1 23 TRP C C 3.706 -0.569 -6.618 1.00 . A A . 23 TRP C 1 1 7 4151 1 1 23 TRP CA C 2.675 -0.029 -5.634 1.00 . A A . 23 TRP CA 1 1 7 4152 1 1 23 TRP CB C 2.638 1.498 -5.706 1.00 . A A . 23 TRP CB 1 1 7 4153 1 1 23 TRP CD1 C 0.850 1.291 -7.525 1.00 . A A . 23 TRP CD1 1 1 7 4154 1 1 23 TRP CD2 C 1.220 3.384 -6.833 1.00 . A A . 23 TRP CD2 1 1 7 4155 1 1 23 TRP CE2 C 0.222 3.409 -7.824 1.00 . A A . 23 TRP CE2 1 1 7 4156 1 1 23 TRP CE3 C 1.620 4.585 -6.247 1.00 . A A . 23 TRP CE3 1 1 7 4157 1 1 23 TRP CG C 1.606 2.019 -6.656 1.00 . A A . 23 TRP CG 1 1 7 4158 1 1 23 TRP CH2 C 0.030 5.755 -7.651 1.00 . A A . 23 TRP CH2 1 1 7 4159 1 1 23 TRP CZ2 C -0.381 4.591 -8.241 1.00 . A A . 23 TRP CZ2 1 1 7 4160 1 1 23 TRP CZ3 C 1.022 5.760 -6.663 1.00 . A A . 23 TRP CZ3 1 1 7 4161 1 1 23 TRP H H 3.750 -0.989 -4.080 1.00 . A A . 23 TRP H 1 1 7 4162 1 1 23 TRP HA H 1.708 -0.410 -5.911 1.00 . A A . 23 TRP HA 1 1 7 4163 1 1 23 TRP HB2 H 2.418 1.893 -4.726 1.00 . A A . 23 TRP HB2 1 1 7 4164 1 1 23 TRP HB3 H 3.602 1.863 -6.028 1.00 . A A . 23 TRP HB3 1 1 7 4165 1 1 23 TRP HD1 H 0.913 0.219 -7.631 1.00 . A A . 23 TRP HD1 1 1 7 4166 1 1 23 TRP HE1 H -0.626 1.833 -8.916 1.00 . A A . 23 TRP HE1 1 1 7 4167 1 1 23 TRP HE3 H 2.383 4.604 -5.485 1.00 . A A . 23 TRP HE3 1 1 7 4168 1 1 23 TRP HH2 H -0.408 6.695 -7.947 1.00 . A A . 23 TRP HH2 1 1 7 4169 1 1 23 TRP HZ2 H -1.148 4.602 -8.999 1.00 . A A . 23 TRP HZ2 1 1 7 4170 1 1 23 TRP HZ3 H 1.320 6.699 -6.222 1.00 . A A . 23 TRP HZ3 1 1 7 4171 1 1 23 TRP N N 2.946 -0.462 -4.270 1.00 . A A . 23 TRP N 1 1 7 4172 1 1 23 TRP NE1 N 0.014 2.119 -8.232 1.00 . A A . 23 TRP NE1 1 1 7 4173 1 1 23 TRP O O 3.413 -1.467 -7.408 1.00 . A A . 23 TRP O 1 1 7 4174 1 1 24 LYS C C 5.532 -0.237 -8.933 1.00 . A A . 24 LYS C 1 1 7 4175 1 1 24 LYS CA C 5.972 -0.418 -7.482 1.00 . A A . 24 LYS CA 1 1 7 4176 1 1 24 LYS CB C 6.353 -1.876 -7.223 1.00 . A A . 24 LYS CB 1 1 7 4177 1 1 24 LYS CD C 7.396 -3.795 -8.467 1.00 . A A . 24 LYS CD 1 1 7 4178 1 1 24 LYS CE C 8.747 -4.466 -8.655 1.00 . A A . 24 LYS CE 1 1 7 4179 1 1 24 LYS CG C 7.550 -2.346 -8.033 1.00 . A A . 24 LYS CG 1 1 7 4180 1 1 24 LYS H H 5.071 0.711 -5.934 1.00 . A A . 24 LYS H 1 1 7 4181 1 1 24 LYS HA H 6.829 0.211 -7.295 1.00 . A A . 24 LYS HA 1 1 7 4182 1 1 24 LYS HB2 H 6.587 -1.993 -6.175 1.00 . A A . 24 LYS HB2 1 1 7 4183 1 1 24 LYS HB3 H 5.510 -2.505 -7.467 1.00 . A A . 24 LYS HB3 1 1 7 4184 1 1 24 LYS HD2 H 6.842 -4.330 -7.710 1.00 . A A . 24 LYS HD2 1 1 7 4185 1 1 24 LYS HD3 H 6.855 -3.825 -9.401 1.00 . A A . 24 LYS HD3 1 1 7 4186 1 1 24 LYS HE2 H 8.603 -5.389 -9.198 1.00 . A A . 24 LYS HE2 1 1 7 4187 1 1 24 LYS HE3 H 9.385 -3.809 -9.228 1.00 . A A . 24 LYS HE3 1 1 7 4188 1 1 24 LYS HG2 H 7.643 -1.726 -8.913 1.00 . A A . 24 LYS HG2 1 1 7 4189 1 1 24 LYS HG3 H 8.441 -2.253 -7.429 1.00 . A A . 24 LYS HG3 1 1 7 4190 1 1 24 LYS HZ1 H 9.144 -4.050 -6.647 1.00 . A A . 24 LYS HZ1 1 1 7 4191 1 1 24 LYS HZ2 H 9.104 -5.703 -7.010 1.00 . A A . 24 LYS HZ2 1 1 7 4192 1 1 24 LYS HZ3 H 10.438 -4.769 -7.467 1.00 . A A . 24 LYS HZ3 1 1 7 4193 1 1 24 LYS N N 4.905 -0.005 -6.578 1.00 . A A . 24 LYS N 1 1 7 4194 1 1 24 LYS NZ N 9.404 -4.768 -7.354 1.00 . A A . 24 LYS NZ 1 1 7 4195 1 1 24 LYS O O 5.643 -1.152 -9.749 1.00 . A A . 24 LYS O 1 1 7 4196 1 1 25 THR C C 5.691 1.376 -11.578 1.00 . A A . 25 THR C 1 1 7 4197 1 1 25 THR CA C 4.538 1.266 -10.580 1.00 . A A . 25 THR CA 1 1 7 4198 1 1 25 THR CB C 3.730 2.569 -10.551 1.00 . A A . 25 THR CB 1 1 7 4199 1 1 25 THR CG2 C 3.270 3.031 -11.918 1.00 . A A . 25 THR CG2 1 1 7 4200 1 1 25 THR H H 4.947 1.632 -8.537 1.00 . A A . 25 THR H 1 1 7 4201 1 1 25 THR HA H 3.889 0.463 -10.892 1.00 . A A . 25 THR HA 1 1 7 4202 1 1 25 THR HB H 4.343 3.352 -10.126 1.00 . A A . 25 THR HB 1 1 7 4203 1 1 25 THR HG1 H 2.448 3.220 -9.221 1.00 . A A . 25 THR HG1 1 1 7 4204 1 1 25 THR HG21 H 3.707 2.400 -12.677 1.00 . A A . 25 THR HG21 1 1 7 4205 1 1 25 THR HG22 H 2.194 2.971 -11.974 1.00 . A A . 25 THR HG22 1 1 7 4206 1 1 25 THR HG23 H 3.582 4.053 -12.075 1.00 . A A . 25 THR HG23 1 1 7 4207 1 1 25 THR N N 5.017 0.951 -9.238 1.00 . A A . 25 THR N 1 1 7 4208 1 1 25 THR O O 5.927 2.437 -12.157 1.00 . A A . 25 THR O 1 1 7 4209 1 1 25 THR OG1 O 2.578 2.423 -9.741 1.00 . A A . 25 THR OG1 1 1 7 4210 1 1 26 SER C C 8.727 0.968 -12.167 1.00 . A A . 26 SER C 1 1 7 4211 1 1 26 SER CA C 7.521 0.219 -12.715 1.00 . A A . 26 SER CA 1 1 7 4212 1 1 26 SER CB C 7.118 0.802 -14.072 1.00 . A A . 26 SER CB 1 1 7 4213 1 1 26 SER H H 6.158 -0.540 -11.296 1.00 . A A . 26 SER H 1 1 7 4214 1 1 26 SER HA H 7.792 -0.814 -12.847 1.00 . A A . 26 SER HA 1 1 7 4215 1 1 26 SER HB2 H 6.119 0.473 -14.319 1.00 . A A . 26 SER HB2 1 1 7 4216 1 1 26 SER HB3 H 7.139 1.880 -14.019 1.00 . A A . 26 SER HB3 1 1 7 4217 1 1 26 SER HG H 7.508 -0.084 -15.775 1.00 . A A . 26 SER HG 1 1 7 4218 1 1 26 SER N N 6.399 0.268 -11.782 1.00 . A A . 26 SER N 1 1 7 4219 1 1 26 SER O O 9.821 0.415 -12.060 1.00 . A A . 26 SER O 1 1 7 4220 1 1 26 SER OG O 8.003 0.376 -15.093 1.00 . A A . 26 SER OG 1 1 7 4221 1 1 27 VAL C C 9.120 3.882 -10.107 1.00 . A A . 27 VAL C 1 1 7 4222 1 1 27 VAL CA C 9.587 3.068 -11.310 1.00 . A A . 27 VAL CA 1 1 7 4223 1 1 27 VAL CB C 10.119 4.017 -12.399 1.00 . A A . 27 VAL CB 1 1 7 4224 1 1 27 VAL CG1 C 9.100 5.102 -12.723 1.00 . A A . 27 VAL CG1 1 1 7 4225 1 1 27 VAL CG2 C 11.447 4.627 -11.976 1.00 . A A . 27 VAL CG2 1 1 7 4226 1 1 27 VAL H H 7.627 2.610 -11.955 1.00 . A A . 27 VAL H 1 1 7 4227 1 1 27 VAL HA H 10.393 2.422 -11.001 1.00 . A A . 27 VAL HA 1 1 7 4228 1 1 27 VAL HB H 10.282 3.434 -13.293 1.00 . A A . 27 VAL HB 1 1 7 4229 1 1 27 VAL HG11 H 8.885 5.671 -11.830 1.00 . A A . 27 VAL HG11 1 1 7 4230 1 1 27 VAL HG12 H 9.502 5.758 -13.480 1.00 . A A . 27 VAL HG12 1 1 7 4231 1 1 27 VAL HG13 H 8.192 4.646 -13.087 1.00 . A A . 27 VAL HG13 1 1 7 4232 1 1 27 VAL HG21 H 12.117 3.843 -11.655 1.00 . A A . 27 VAL HG21 1 1 7 4233 1 1 27 VAL HG22 H 11.883 5.154 -12.812 1.00 . A A . 27 VAL HG22 1 1 7 4234 1 1 27 VAL HG23 H 11.283 5.317 -11.161 1.00 . A A . 27 VAL HG23 1 1 7 4235 1 1 27 VAL N N 8.519 2.231 -11.835 1.00 . A A . 27 VAL N 1 1 7 4236 1 1 27 VAL O O 9.871 4.083 -9.153 1.00 . A A . 27 VAL O 1 1 7 4237 1 1 28 SER C C 7.613 4.526 -7.721 1.00 . A A . 28 SER C 1 1 7 4238 1 1 28 SER CA C 7.298 5.140 -9.081 1.00 . A A . 28 SER CA 1 1 7 4239 1 1 28 SER CB C 5.783 5.254 -9.268 1.00 . A A . 28 SER CB 1 1 7 4240 1 1 28 SER H H 7.330 4.152 -10.951 1.00 . A A . 28 SER H 1 1 7 4241 1 1 28 SER HA H 7.731 6.124 -9.124 1.00 . A A . 28 SER HA 1 1 7 4242 1 1 28 SER HB2 H 5.522 4.940 -10.267 1.00 . A A . 28 SER HB2 1 1 7 4243 1 1 28 SER HB3 H 5.283 4.621 -8.550 1.00 . A A . 28 SER HB3 1 1 7 4244 1 1 28 SER HG H 4.762 6.838 -9.803 1.00 . A A . 28 SER HG 1 1 7 4245 1 1 28 SER N N 7.876 4.347 -10.162 1.00 . A A . 28 SER N 1 1 7 4246 1 1 28 SER O O 8.377 5.086 -6.937 1.00 . A A . 28 SER O 1 1 7 4247 1 1 28 SER OG O 5.346 6.589 -9.083 1.00 . A A . 28 SER OG 1 1 7 4248 1 1 29 SER C C 6.972 3.539 -4.995 1.00 . A A . 29 SER C 1 1 7 4249 1 1 29 SER CA C 7.228 2.647 -6.206 1.00 . A A . 29 SER CA 1 1 7 4250 1 1 29 SER CB C 8.645 2.071 -6.142 1.00 . A A . 29 SER CB 1 1 7 4251 1 1 29 SER H H 6.431 2.979 -8.138 1.00 . A A . 29 SER H 1 1 7 4252 1 1 29 SER HA H 6.521 1.832 -6.181 1.00 . A A . 29 SER HA 1 1 7 4253 1 1 29 SER HB2 H 8.920 1.913 -5.110 1.00 . A A . 29 SER HB2 1 1 7 4254 1 1 29 SER HB3 H 8.671 1.128 -6.668 1.00 . A A . 29 SER HB3 1 1 7 4255 1 1 29 SER HG H 10.391 2.468 -6.936 1.00 . A A . 29 SER HG 1 1 7 4256 1 1 29 SER N N 7.021 3.366 -7.461 1.00 . A A . 29 SER N 1 1 7 4257 1 1 29 SER O O 7.719 4.480 -4.728 1.00 . A A . 29 SER O 1 1 7 4258 1 1 29 SER OG O 9.586 2.949 -6.734 1.00 . A A . 29 SER OG 1 1 7 4259 1 1 30 HIS C C 5.340 3.076 -1.879 1.00 . A A . 30 HIS C 1 1 7 4260 1 1 30 HIS CA C 5.546 3.997 -3.078 1.00 . A A . 30 HIS CA 1 1 7 4261 1 1 30 HIS CB C 4.277 4.805 -3.350 1.00 . A A . 30 HIS CB 1 1 7 4262 1 1 30 HIS CD2 C 4.707 5.344 -5.850 1.00 . A A . 30 HIS CD2 1 1 7 4263 1 1 30 HIS CE1 C 4.253 7.486 -5.802 1.00 . A A . 30 HIS CE1 1 1 7 4264 1 1 30 HIS CG C 4.370 5.659 -4.577 1.00 . A A . 30 HIS CG 1 1 7 4265 1 1 30 HIS H H 5.353 2.467 -4.525 1.00 . A A . 30 HIS H 1 1 7 4266 1 1 30 HIS HA H 6.356 4.677 -2.861 1.00 . A A . 30 HIS HA 1 1 7 4267 1 1 30 HIS HB2 H 3.448 4.126 -3.483 1.00 . A A . 30 HIS HB2 1 1 7 4268 1 1 30 HIS HB3 H 4.079 5.450 -2.507 1.00 . A A . 30 HIS HB3 1 1 7 4269 1 1 30 HIS HD1 H 3.816 7.538 -3.803 1.00 . A A . 30 HIS HD1 1 1 7 4270 1 1 30 HIS HD2 H 4.985 4.365 -6.216 1.00 . A A . 30 HIS HD2 1 1 7 4271 1 1 30 HIS HE1 H 4.106 8.511 -6.105 1.00 . A A . 30 HIS HE1 1 1 7 4272 1 1 30 HIS HE2 H 4.656 6.544 -7.567 1.00 . A A . 30 HIS HE2 1 1 7 4273 1 1 30 HIS N N 5.908 3.231 -4.263 1.00 . A A . 30 HIS N 1 1 7 4274 1 1 30 HIS ND1 N 4.092 7.009 -4.580 1.00 . A A . 30 HIS ND1 1 1 7 4275 1 1 30 HIS NE2 N 4.626 6.497 -6.591 1.00 . A A . 30 HIS NE2 1 1 7 4276 1 1 30 HIS O O 4.558 2.127 -1.939 1.00 . A A . 30 HIS O 1 1 7 4277 1 1 31 TYR C C 4.683 2.872 1.196 1.00 . A A . 31 TYR C 1 1 7 4278 1 1 31 TYR CA C 5.956 2.551 0.419 1.00 . A A . 31 TYR CA 1 1 7 4279 1 1 31 TYR CB C 7.180 2.781 1.308 1.00 . A A . 31 TYR CB 1 1 7 4280 1 1 31 TYR CD1 C 8.803 1.662 -0.269 1.00 . A A . 31 TYR CD1 1 1 7 4281 1 1 31 TYR CD2 C 8.921 1.109 2.047 1.00 . A A . 31 TYR CD2 1 1 7 4282 1 1 31 TYR CE1 C 9.847 0.796 -0.534 1.00 . A A . 31 TYR CE1 1 1 7 4283 1 1 31 TYR CE2 C 9.967 0.242 1.790 1.00 . A A . 31 TYR CE2 1 1 7 4284 1 1 31 TYR CG C 8.323 1.833 1.023 1.00 . A A . 31 TYR CG 1 1 7 4285 1 1 31 TYR CZ C 10.425 0.089 0.499 1.00 . A A . 31 TYR CZ 1 1 7 4286 1 1 31 TYR H H 6.664 4.124 -0.808 1.00 . A A . 31 TYR H 1 1 7 4287 1 1 31 TYR HA H 5.929 1.513 0.124 1.00 . A A . 31 TYR HA 1 1 7 4288 1 1 31 TYR HB2 H 7.540 3.787 1.159 1.00 . A A . 31 TYR HB2 1 1 7 4289 1 1 31 TYR HB3 H 6.893 2.655 2.342 1.00 . A A . 31 TYR HB3 1 1 7 4290 1 1 31 TYR HD1 H 8.348 2.217 -1.076 1.00 . A A . 31 TYR HD1 1 1 7 4291 1 1 31 TYR HD2 H 8.559 1.230 3.057 1.00 . A A . 31 TYR HD2 1 1 7 4292 1 1 31 TYR HE1 H 10.206 0.677 -1.545 1.00 . A A . 31 TYR HE1 1 1 7 4293 1 1 31 TYR HE2 H 10.419 -0.312 2.599 1.00 . A A . 31 TYR HE2 1 1 7 4294 1 1 31 TYR HH H 11.202 -1.670 0.461 1.00 . A A . 31 TYR HH 1 1 7 4295 1 1 31 TYR N N 6.053 3.358 -0.793 1.00 . A A . 31 TYR N 1 1 7 4296 1 1 31 TYR O O 4.164 3.986 1.125 1.00 . A A . 31 TYR O 1 1 7 4297 1 1 31 TYR OH O 11.466 -0.774 0.240 1.00 . A A . 31 TYR OH 1 1 7 4298 1 1 32 CYS C C 3.321 2.432 4.172 1.00 . A A . 32 CYS C 1 1 7 4299 1 1 32 CYS CA C 2.978 2.061 2.736 1.00 . A A . 32 CYS CA 1 1 7 4300 1 1 32 CYS CB C 2.138 0.783 2.717 1.00 . A A . 32 CYS CB 1 1 7 4301 1 1 32 CYS H H 4.649 1.023 1.958 1.00 . A A . 32 CYS H 1 1 7 4302 1 1 32 CYS HA H 2.403 2.863 2.300 1.00 . A A . 32 CYS HA 1 1 7 4303 1 1 32 CYS HB2 H 2.423 0.185 1.865 1.00 . A A . 32 CYS HB2 1 1 7 4304 1 1 32 CYS HB3 H 2.326 0.223 3.622 1.00 . A A . 32 CYS HB3 1 1 7 4305 1 1 32 CYS N N 4.188 1.887 1.941 1.00 . A A . 32 CYS N 1 1 7 4306 1 1 32 CYS O O 4.490 2.465 4.556 1.00 . A A . 32 CYS O 1 1 7 4307 1 1 32 CYS SG S 0.343 1.079 2.611 1.00 . A A . 32 CYS SG 1 1 7 4308 1 1 33 THR C C 1.618 2.187 7.263 1.00 . A A . 33 THR C 1 1 7 4309 1 1 33 THR CA C 2.471 3.071 6.358 1.00 . A A . 33 THR CA 1 1 7 4310 1 1 33 THR CB C 2.109 4.543 6.575 1.00 . A A . 33 THR CB 1 1 7 4311 1 1 33 THR CG2 C 2.564 5.447 5.448 1.00 . A A . 33 THR CG2 1 1 7 4312 1 1 33 THR H H 1.384 2.658 4.592 1.00 . A A . 33 THR H 1 1 7 4313 1 1 33 THR HA H 3.512 2.925 6.608 1.00 . A A . 33 THR HA 1 1 7 4314 1 1 33 THR HB H 2.579 4.888 7.485 1.00 . A A . 33 THR HB 1 1 7 4315 1 1 33 THR HG1 H 0.512 5.119 7.552 1.00 . A A . 33 THR HG1 1 1 7 4316 1 1 33 THR HG21 H 2.103 5.131 4.524 1.00 . A A . 33 THR HG21 1 1 7 4317 1 1 33 THR HG22 H 2.276 6.465 5.664 1.00 . A A . 33 THR HG22 1 1 7 4318 1 1 33 THR HG23 H 3.638 5.390 5.352 1.00 . A A . 33 THR HG23 1 1 7 4319 1 1 33 THR N N 2.291 2.706 4.960 1.00 . A A . 33 THR N 1 1 7 4320 1 1 33 THR O O 1.355 2.533 8.414 1.00 . A A . 33 THR O 1 1 7 4321 1 1 33 THR OG1 O 0.708 4.701 6.711 1.00 . A A . 33 THR OG1 1 1 7 4322 1 1 34 GLY C C -0.782 0.827 8.214 1.00 . A A . 34 GLY C 1 1 7 4323 1 1 34 GLY CA C 0.364 0.127 7.507 1.00 . A A . 34 GLY CA 1 1 7 4324 1 1 34 GLY H H 1.426 0.818 5.809 1.00 . A A . 34 GLY H 1 1 7 4325 1 1 34 GLY HA2 H 0.984 -0.359 8.245 1.00 . A A . 34 GLY HA2 1 1 7 4326 1 1 34 GLY HA3 H -0.042 -0.622 6.843 1.00 . A A . 34 GLY HA3 1 1 7 4327 1 1 34 GLY N N 1.186 1.043 6.733 1.00 . A A . 34 GLY N 1 1 7 4328 1 1 34 GLY O O -1.130 0.477 9.342 1.00 . A A . 34 GLY O 1 1 7 4329 1 1 35 ARG C C -3.726 2.468 7.262 1.00 . A A . 35 ARG C 1 1 7 4330 1 1 35 ARG CA C -2.475 2.575 8.128 1.00 . A A . 35 ARG CA 1 1 7 4331 1 1 35 ARG CB C -2.084 4.044 8.300 1.00 . A A . 35 ARG CB 1 1 7 4332 1 1 35 ARG CD C -2.385 5.906 9.959 1.00 . A A . 35 ARG CD 1 1 7 4333 1 1 35 ARG CG C -3.080 4.845 9.121 1.00 . A A . 35 ARG CG 1 1 7 4334 1 1 35 ARG CZ C -2.777 7.065 12.098 1.00 . A A . 35 ARG CZ 1 1 7 4335 1 1 35 ARG H H -1.042 2.056 6.657 1.00 . A A . 35 ARG H 1 1 7 4336 1 1 35 ARG HA H -2.689 2.155 9.096 1.00 . A A . 35 ARG HA 1 1 7 4337 1 1 35 ARG HB2 H -1.123 4.093 8.790 1.00 . A A . 35 ARG HB2 1 1 7 4338 1 1 35 ARG HB3 H -2.005 4.500 7.324 1.00 . A A . 35 ARG HB3 1 1 7 4339 1 1 35 ARG HD2 H -1.484 5.483 10.378 1.00 . A A . 35 ARG HD2 1 1 7 4340 1 1 35 ARG HD3 H -2.127 6.739 9.321 1.00 . A A . 35 ARG HD3 1 1 7 4341 1 1 35 ARG HE H -4.192 6.195 10.992 1.00 . A A . 35 ARG HE 1 1 7 4342 1 1 35 ARG HG2 H -3.777 5.329 8.453 1.00 . A A . 35 ARG HG2 1 1 7 4343 1 1 35 ARG HG3 H -3.614 4.174 9.777 1.00 . A A . 35 ARG HG3 1 1 7 4344 1 1 35 ARG HH11 H -0.845 7.045 11.498 1.00 . A A . 35 ARG HH11 1 1 7 4345 1 1 35 ARG HH12 H -1.148 7.853 12.999 1.00 . A A . 35 ARG HH12 1 1 7 4346 1 1 35 ARG HH21 H -4.592 7.258 12.967 1.00 . A A . 35 ARG HH21 1 1 7 4347 1 1 35 ARG HH22 H -3.274 7.974 13.833 1.00 . A A . 35 ARG HH22 1 1 7 4348 1 1 35 ARG N N -1.367 1.821 7.551 1.00 . A A . 35 ARG N 1 1 7 4349 1 1 35 ARG NE N -3.233 6.387 11.047 1.00 . A A . 35 ARG NE 1 1 7 4350 1 1 35 ARG NH1 N -1.484 7.344 12.207 1.00 . A A . 35 ARG NH1 1 1 7 4351 1 1 35 ARG NH2 N -3.616 7.465 13.044 1.00 . A A . 35 ARG NH2 1 1 7 4352 1 1 35 ARG O O -4.837 2.337 7.776 1.00 . A A . 35 ARG O 1 1 7 4353 1 1 36 SER C C -4.242 1.773 3.714 1.00 . A A . 36 SER C 1 1 7 4354 1 1 36 SER CA C -4.661 2.443 5.018 1.00 . A A . 36 SER CA 1 1 7 4355 1 1 36 SER CB C -5.219 3.838 4.730 1.00 . A A . 36 SER CB 1 1 7 4356 1 1 36 SER H H -2.631 2.637 5.599 1.00 . A A . 36 SER H 1 1 7 4357 1 1 36 SER HA H -5.432 1.847 5.483 1.00 . A A . 36 SER HA 1 1 7 4358 1 1 36 SER HB2 H -4.525 4.379 4.106 1.00 . A A . 36 SER HB2 1 1 7 4359 1 1 36 SER HB3 H -6.166 3.746 4.219 1.00 . A A . 36 SER HB3 1 1 7 4360 1 1 36 SER HG H -5.788 5.427 5.724 1.00 . A A . 36 SER HG 1 1 7 4361 1 1 36 SER N N -3.540 2.529 5.949 1.00 . A A . 36 SER N 1 1 7 4362 1 1 36 SER O O -3.058 1.728 3.380 1.00 . A A . 36 SER O 1 1 7 4363 1 1 36 SER OG O -5.416 4.566 5.930 1.00 . A A . 36 SER OG 1 1 7 4364 1 1 37 CYS C C -4.484 1.598 0.665 1.00 . A A . 37 CYS C 1 1 7 4365 1 1 37 CYS CA C -4.956 0.590 1.710 1.00 . A A . 37 CYS CA 1 1 7 4366 1 1 37 CYS CB C -6.211 -0.135 1.215 1.00 . A A . 37 CYS CB 1 1 7 4367 1 1 37 CYS H H -6.147 1.325 3.296 1.00 . A A . 37 CYS H 1 1 7 4368 1 1 37 CYS HA H -4.173 -0.135 1.873 1.00 . A A . 37 CYS HA 1 1 7 4369 1 1 37 CYS HB2 H -6.461 -0.920 1.911 1.00 . A A . 37 CYS HB2 1 1 7 4370 1 1 37 CYS HB3 H -7.029 0.570 1.168 1.00 . A A . 37 CYS HB3 1 1 7 4371 1 1 37 CYS N N -5.222 1.255 2.980 1.00 . A A . 37 CYS N 1 1 7 4372 1 1 37 CYS O O -3.811 1.237 -0.300 1.00 . A A . 37 CYS O 1 1 7 4373 1 1 37 CYS SG S -6.036 -0.891 -0.435 1.00 . A A . 37 CYS SG 1 1 7 4374 1 1 38 GLU C C -2.955 4.206 0.051 1.00 . A A . 38 GLU C 1 1 7 4375 1 1 38 GLU CA C -4.450 3.921 -0.056 1.00 . A A . 38 GLU CA 1 1 7 4376 1 1 38 GLU CB C -5.246 5.195 0.229 1.00 . A A . 38 GLU CB 1 1 7 4377 1 1 38 GLU CD C -7.351 4.625 1.503 1.00 . A A . 38 GLU CD 1 1 7 4378 1 1 38 GLU CG C -6.752 4.999 0.162 1.00 . A A . 38 GLU CG 1 1 7 4379 1 1 38 GLU H H -5.377 3.088 1.656 1.00 . A A . 38 GLU H 1 1 7 4380 1 1 38 GLU HA H -4.670 3.585 -1.058 1.00 . A A . 38 GLU HA 1 1 7 4381 1 1 38 GLU HB2 H -4.995 5.549 1.218 1.00 . A A . 38 GLU HB2 1 1 7 4382 1 1 38 GLU HB3 H -4.970 5.948 -0.494 1.00 . A A . 38 GLU HB3 1 1 7 4383 1 1 38 GLU HG2 H -7.207 5.919 -0.174 1.00 . A A . 38 GLU HG2 1 1 7 4384 1 1 38 GLU HG3 H -6.968 4.212 -0.545 1.00 . A A . 38 GLU HG3 1 1 7 4385 1 1 38 GLU N N -4.840 2.862 0.867 1.00 . A A . 38 GLU N 1 1 7 4386 1 1 38 GLU O O -2.524 5.015 0.872 1.00 . A A . 38 GLU O 1 1 7 4387 1 1 38 GLU OE1 O -8.335 3.856 1.520 1.00 . A A . 38 GLU OE1 1 1 7 4388 1 1 38 GLU OE2 O -6.837 5.102 2.537 1.00 . A A . 38 GLU OE2 1 1 7 4389 1 1 39 CYS C C -0.349 5.191 -0.907 1.00 . A A . 39 CYS C 1 1 7 4390 1 1 39 CYS CA C -0.718 3.712 -0.785 1.00 . A A . 39 CYS CA 1 1 7 4391 1 1 39 CYS CB C -0.092 2.919 -1.936 1.00 . A A . 39 CYS CB 1 1 7 4392 1 1 39 CYS H H -2.571 2.901 -1.415 1.00 . A A . 39 CYS H 1 1 7 4393 1 1 39 CYS HA H -0.339 3.331 0.151 1.00 . A A . 39 CYS HA 1 1 7 4394 1 1 39 CYS HB2 H -0.446 1.900 -1.895 1.00 . A A . 39 CYS HB2 1 1 7 4395 1 1 39 CYS HB3 H -0.394 3.363 -2.874 1.00 . A A . 39 CYS HB3 1 1 7 4396 1 1 39 CYS N N -2.168 3.534 -0.784 1.00 . A A . 39 CYS N 1 1 7 4397 1 1 39 CYS O O -0.893 5.906 -1.749 1.00 . A A . 39 CYS O 1 1 7 4398 1 1 39 CYS SG S 1.730 2.872 -1.906 1.00 . A A . 39 CYS SG 1 1 7 4399 1 1 40 PRO C C 1.409 7.543 -1.479 1.00 . A A . 40 PRO C 1 1 7 4400 1 1 40 PRO CA C 1.014 7.076 -0.083 1.00 . A A . 40 PRO CA 1 1 7 4401 1 1 40 PRO CB C 2.227 7.088 0.848 1.00 . A A . 40 PRO CB 1 1 7 4402 1 1 40 PRO CD C 1.284 4.896 0.977 1.00 . A A . 40 PRO CD 1 1 7 4403 1 1 40 PRO CG C 1.998 5.949 1.780 1.00 . A A . 40 PRO CG 1 1 7 4404 1 1 40 PRO HA H 0.249 7.730 0.310 1.00 . A A . 40 PRO HA 1 1 7 4405 1 1 40 PRO HB2 H 3.129 6.952 0.270 1.00 . A A . 40 PRO HB2 1 1 7 4406 1 1 40 PRO HB3 H 2.270 8.028 1.378 1.00 . A A . 40 PRO HB3 1 1 7 4407 1 1 40 PRO HD2 H 1.994 4.213 0.534 1.00 . A A . 40 PRO HD2 1 1 7 4408 1 1 40 PRO HD3 H 0.580 4.361 1.598 1.00 . A A . 40 PRO HD3 1 1 7 4409 1 1 40 PRO HG2 H 2.944 5.571 2.137 1.00 . A A . 40 PRO HG2 1 1 7 4410 1 1 40 PRO HG3 H 1.383 6.269 2.608 1.00 . A A . 40 PRO HG3 1 1 7 4411 1 1 40 PRO N N 0.582 5.674 -0.062 1.00 . A A . 40 PRO N 1 1 7 4412 1 1 40 PRO O O 1.662 6.730 -2.369 1.00 . A A . 40 PRO O 1 1 7 4413 1 1 41 SER C C 3.296 9.838 -2.975 1.00 . A A . 41 SER C 1 1 7 4414 1 1 41 SER CA C 1.825 9.435 -2.953 1.00 . A A . 41 SER CA 1 1 7 4415 1 1 41 SER CB C 0.947 10.651 -3.258 1.00 . A A . 41 SER CB 1 1 7 4416 1 1 41 SER H H 1.247 9.455 -0.917 1.00 . A A . 41 SER H 1 1 7 4417 1 1 41 SER HA H 1.659 8.684 -3.711 1.00 . A A . 41 SER HA 1 1 7 4418 1 1 41 SER HB2 H 0.833 11.243 -2.362 1.00 . A A . 41 SER HB2 1 1 7 4419 1 1 41 SER HB3 H 1.416 11.247 -4.027 1.00 . A A . 41 SER HB3 1 1 7 4420 1 1 41 SER HG H -1.006 10.599 -3.113 1.00 . A A . 41 SER HG 1 1 7 4421 1 1 41 SER N N 1.460 8.859 -1.665 1.00 . A A . 41 SER N 1 1 7 4422 1 1 41 SER O O 3.691 10.743 -3.712 1.00 . A A . 41 SER O 1 1 7 4423 1 1 41 SER OG O -0.337 10.253 -3.708 1.00 . A A . 41 SER OG 1 1 7 4424 1 1 42 TYR C C 6.346 8.156 -2.056 1.00 . A A . 42 TYR C 1 1 7 4425 1 1 42 TYR CA C 5.533 9.449 -2.097 1.00 . A A . 42 TYR CA 1 1 7 4426 1 1 42 TYR CB C 5.844 10.305 -0.867 1.00 . A A . 42 TYR CB 1 1 7 4427 1 1 42 TYR CD1 C 4.481 9.761 1.189 1.00 . A A . 42 TYR CD1 1 1 7 4428 1 1 42 TYR CD2 C 6.610 8.718 0.940 1.00 . A A . 42 TYR CD2 1 1 7 4429 1 1 42 TYR CE1 C 4.294 9.101 2.389 1.00 . A A . 42 TYR CE1 1 1 7 4430 1 1 42 TYR CE2 C 6.430 8.054 2.139 1.00 . A A . 42 TYR CE2 1 1 7 4431 1 1 42 TYR CG C 5.641 9.581 0.446 1.00 . A A . 42 TYR CG 1 1 7 4432 1 1 42 TYR CZ C 5.271 8.249 2.859 1.00 . A A . 42 TYR CZ 1 1 7 4433 1 1 42 TYR H H 3.734 8.450 -1.604 1.00 . A A . 42 TYR H 1 1 7 4434 1 1 42 TYR HA H 5.801 10.001 -2.986 1.00 . A A . 42 TYR HA 1 1 7 4435 1 1 42 TYR HB2 H 6.874 10.626 -0.912 1.00 . A A . 42 TYR HB2 1 1 7 4436 1 1 42 TYR HB3 H 5.201 11.173 -0.870 1.00 . A A . 42 TYR HB3 1 1 7 4437 1 1 42 TYR HD1 H 3.718 10.429 0.818 1.00 . A A . 42 TYR HD1 1 1 7 4438 1 1 42 TYR HD2 H 7.518 8.568 0.374 1.00 . A A . 42 TYR HD2 1 1 7 4439 1 1 42 TYR HE1 H 3.385 9.253 2.952 1.00 . A A . 42 TYR HE1 1 1 7 4440 1 1 42 TYR HE2 H 7.196 7.387 2.506 1.00 . A A . 42 TYR HE2 1 1 7 4441 1 1 42 TYR HH H 5.262 6.653 3.932 1.00 . A A . 42 TYR HH 1 1 7 4442 1 1 42 TYR N N 4.105 9.161 -2.166 1.00 . A A . 42 TYR N 1 1 7 4443 1 1 42 TYR O O 5.907 7.156 -1.488 1.00 . A A . 42 TYR O 1 1 7 4444 1 1 42 TYR OH O 5.087 7.590 4.053 1.00 . A A . 42 TYR OH 1 1 7 4445 1 1 43 PRO C C 9.065 6.706 -1.336 1.00 . A A . 43 PRO C 1 1 7 4446 1 1 43 PRO CA C 8.418 6.981 -2.689 1.00 . A A . 43 PRO CA 1 1 7 4447 1 1 43 PRO CB C 9.480 7.356 -3.724 1.00 . A A . 43 PRO CB 1 1 7 4448 1 1 43 PRO CD C 8.149 9.310 -3.363 1.00 . A A . 43 PRO CD 1 1 7 4449 1 1 43 PRO CG C 9.546 8.842 -3.669 1.00 . A A . 43 PRO CG 1 1 7 4450 1 1 43 PRO HA H 7.884 6.102 -3.018 1.00 . A A . 43 PRO HA 1 1 7 4451 1 1 43 PRO HB2 H 10.424 6.906 -3.454 1.00 . A A . 43 PRO HB2 1 1 7 4452 1 1 43 PRO HB3 H 9.174 7.010 -4.700 1.00 . A A . 43 PRO HB3 1 1 7 4453 1 1 43 PRO HD2 H 8.174 10.181 -2.725 1.00 . A A . 43 PRO HD2 1 1 7 4454 1 1 43 PRO HD3 H 7.614 9.525 -4.277 1.00 . A A . 43 PRO HD3 1 1 7 4455 1 1 43 PRO HG2 H 10.224 9.151 -2.887 1.00 . A A . 43 PRO HG2 1 1 7 4456 1 1 43 PRO HG3 H 9.870 9.231 -4.624 1.00 . A A . 43 PRO HG3 1 1 7 4457 1 1 43 PRO N N 7.547 8.160 -2.661 1.00 . A A . 43 PRO N 1 1 7 4458 1 1 43 PRO O O 9.325 7.628 -0.563 1.00 . A A . 43 PRO O 1 1 7 4459 1 1 44 GLY C C 11.295 5.707 0.400 1.00 . A A . 44 GLY C 1 1 7 4460 1 1 44 GLY CA C 9.939 5.059 0.202 1.00 . A A . 44 GLY CA 1 1 7 4461 1 1 44 GLY H H 9.095 4.742 -1.714 1.00 . A A . 44 GLY H 1 1 7 4462 1 1 44 GLY HA2 H 10.057 3.986 0.228 1.00 . A A . 44 GLY HA2 1 1 7 4463 1 1 44 GLY HA3 H 9.288 5.358 1.010 1.00 . A A . 44 GLY HA3 1 1 7 4464 1 1 44 GLY N N 9.324 5.433 -1.058 1.00 . A A . 44 GLY N 1 1 7 4465 1 1 44 GLY O O 12.116 5.736 -0.517 1.00 . A A . 44 GLY O 1 1 7 4466 1 1 45 ASN C C 13.034 8.079 1.004 1.00 . A A . 45 ASN C 1 1 7 4467 1 1 45 ASN CA C 12.797 6.879 1.915 1.00 . A A . 45 ASN CA 1 1 7 4468 1 1 45 ASN CB C 13.952 5.885 1.781 1.00 . A A . 45 ASN CB 1 1 7 4469 1 1 45 ASN CG C 15.283 6.487 2.189 1.00 . A A . 45 ASN CG 1 1 7 4470 1 1 45 ASN H H 10.836 6.174 2.289 1.00 . A A . 45 ASN H 1 1 7 4471 1 1 45 ASN HA H 12.747 7.222 2.938 1.00 . A A . 45 ASN HA 1 1 7 4472 1 1 45 ASN HB2 H 13.758 5.029 2.409 1.00 . A A . 45 ASN HB2 1 1 7 4473 1 1 45 ASN HB3 H 14.024 5.563 0.752 1.00 . A A . 45 ASN HB3 1 1 7 4474 1 1 45 ASN HD21 H 14.713 6.515 4.094 1.00 . A A . 45 ASN HD21 1 1 7 4475 1 1 45 ASN HD22 H 16.299 7.122 3.775 1.00 . A A . 45 ASN HD22 1 1 7 4476 1 1 45 ASN N N 11.530 6.228 1.600 1.00 . A A . 45 ASN N 1 1 7 4477 1 1 45 ASN ND2 N 15.449 6.733 3.483 1.00 . A A . 45 ASN ND2 1 1 7 4478 1 1 45 ASN O O 13.563 7.939 -0.098 1.00 . A A . 45 ASN O 1 1 7 4479 1 1 45 ASN OD1 O 16.151 6.728 1.351 1.00 . A A . 45 ASN OD1 1 1 7 4480 1 1 46 GLY C C 11.659 10.716 -0.261 1.00 . A A . 46 GLY C 1 1 7 4481 1 1 46 GLY CA C 12.816 10.465 0.687 1.00 . A A . 46 GLY CA 1 1 7 4482 1 1 46 GLY H H 12.222 9.309 2.358 1.00 . A A . 46 GLY H 1 1 7 4483 1 1 46 GLY HA2 H 13.725 10.376 0.112 1.00 . A A . 46 GLY HA2 1 1 7 4484 1 1 46 GLY HA3 H 12.907 11.307 1.357 1.00 . A A . 46 GLY HA3 1 1 7 4485 1 1 46 GLY N N 12.638 9.258 1.473 1.00 . A A . 46 GLY N 1 1 7 4486 1 1 46 GLY O O 10.501 10.471 0.138 1.00 . A A . 46 GLY O 1 1 7 4487 1 1 46 GLY OXT O 11.912 11.159 -1.401 1.00 . A A . 46 GLY OXT 1 1 8 4488 1 1 1 ALA C C -15.151 -3.395 9.719 1.00 . A A . 1 ALA C 1 1 8 4489 1 1 1 ALA CA C -14.991 -4.183 11.014 1.00 . A A . 1 ALA CA 1 1 8 4490 1 1 1 ALA CB C -14.775 -5.658 10.711 1.00 . A A . 1 ALA CB 1 1 8 4491 1 1 1 ALA H1 H -16.387 -2.989 11.941 1.00 . A A . 1 ALA H1 1 1 8 4492 1 1 1 ALA H2 H -16.964 -4.537 11.476 1.00 . A A . 1 ALA H2 1 1 8 4493 1 1 1 ALA H3 H -15.930 -4.382 12.834 1.00 . A A . 1 ALA H3 1 1 8 4494 1 1 1 ALA HA H -14.120 -3.818 11.539 1.00 . A A . 1 ALA HA 1 1 8 4495 1 1 1 ALA HB1 H -15.717 -6.110 10.436 1.00 . A A . 1 ALA HB1 1 1 8 4496 1 1 1 ALA HB2 H -14.076 -5.759 9.894 1.00 . A A . 1 ALA HB2 1 1 8 4497 1 1 1 ALA HB3 H -14.380 -6.151 11.586 1.00 . A A . 1 ALA HB3 1 1 8 4498 1 1 1 ALA N N -16.175 -4.007 11.895 1.00 . A A . 1 ALA N 1 1 8 4499 1 1 1 ALA O O -16.260 -3.006 9.350 1.00 . A A . 1 ALA O 1 1 8 4500 1 1 2 MET C C -13.953 -3.365 6.585 1.00 . A A . 2 MET C 1 1 8 4501 1 1 2 MET CA C -14.054 -2.420 7.777 1.00 . A A . 2 MET CA 1 1 8 4502 1 1 2 MET CB C -12.905 -1.411 7.741 1.00 . A A . 2 MET CB 1 1 8 4503 1 1 2 MET CE C -11.609 0.717 10.562 1.00 . A A . 2 MET CE 1 1 8 4504 1 1 2 MET CG C -13.216 -0.109 8.461 1.00 . A A . 2 MET CG 1 1 8 4505 1 1 2 MET H H -13.184 -3.497 9.378 1.00 . A A . 2 MET H 1 1 8 4506 1 1 2 MET HA H -14.991 -1.887 7.720 1.00 . A A . 2 MET HA 1 1 8 4507 1 1 2 MET HB2 H -12.037 -1.855 8.205 1.00 . A A . 2 MET HB2 1 1 8 4508 1 1 2 MET HB3 H -12.674 -1.182 6.712 1.00 . A A . 2 MET HB3 1 1 8 4509 1 1 2 MET HE1 H -11.763 1.726 10.209 1.00 . A A . 2 MET HE1 1 1 8 4510 1 1 2 MET HE2 H -11.404 0.734 11.623 1.00 . A A . 2 MET HE2 1 1 8 4511 1 1 2 MET HE3 H -10.771 0.278 10.041 1.00 . A A . 2 MET HE3 1 1 8 4512 1 1 2 MET HG2 H -12.524 0.648 8.124 1.00 . A A . 2 MET HG2 1 1 8 4513 1 1 2 MET HG3 H -14.224 0.191 8.214 1.00 . A A . 2 MET HG3 1 1 8 4514 1 1 2 MET N N -14.038 -3.162 9.032 1.00 . A A . 2 MET N 1 1 8 4515 1 1 2 MET O O -13.109 -4.261 6.559 1.00 . A A . 2 MET O 1 1 8 4516 1 1 2 MET SD S -13.080 -0.256 10.253 1.00 . A A . 2 MET SD 1 1 8 4517 1 1 3 ASP C C -13.493 -3.908 3.670 1.00 . A A . 3 ASP C 1 1 8 4518 1 1 3 ASP CA C -14.828 -3.994 4.402 1.00 . A A . 3 ASP CA 1 1 8 4519 1 1 3 ASP CB C -15.964 -3.572 3.468 1.00 . A A . 3 ASP CB 1 1 8 4520 1 1 3 ASP CG C -17.292 -3.453 4.190 1.00 . A A . 3 ASP CG 1 1 8 4521 1 1 3 ASP H H -15.470 -2.430 5.676 1.00 . A A . 3 ASP H 1 1 8 4522 1 1 3 ASP HA H -14.990 -5.016 4.712 1.00 . A A . 3 ASP HA 1 1 8 4523 1 1 3 ASP HB2 H -15.725 -2.613 3.032 1.00 . A A . 3 ASP HB2 1 1 8 4524 1 1 3 ASP HB3 H -16.066 -4.305 2.682 1.00 . A A . 3 ASP HB3 1 1 8 4525 1 1 3 ASP N N -14.820 -3.160 5.598 1.00 . A A . 3 ASP N 1 1 8 4526 1 1 3 ASP O O -12.575 -3.218 4.111 1.00 . A A . 3 ASP O 1 1 8 4527 1 1 3 ASP OD1 O -17.646 -2.327 4.600 1.00 . A A . 3 ASP OD1 1 1 8 4528 1 1 3 ASP OD2 O -17.979 -4.484 4.343 1.00 . A A . 3 ASP OD2 1 1 8 4529 1 1 4 CYS C C -12.015 -3.309 0.986 1.00 . A A . 4 CYS C 1 1 8 4530 1 1 4 CYS CA C -12.170 -4.617 1.754 1.00 . A A . 4 CYS CA 1 1 8 4531 1 1 4 CYS CB C -12.174 -5.793 0.776 1.00 . A A . 4 CYS CB 1 1 8 4532 1 1 4 CYS H H -14.160 -5.145 2.247 1.00 . A A . 4 CYS H 1 1 8 4533 1 1 4 CYS HA H -11.335 -4.726 2.430 1.00 . A A . 4 CYS HA 1 1 8 4534 1 1 4 CYS HB2 H -13.114 -5.808 0.245 1.00 . A A . 4 CYS HB2 1 1 8 4535 1 1 4 CYS HB3 H -11.368 -5.664 0.067 1.00 . A A . 4 CYS HB3 1 1 8 4536 1 1 4 CYS N N -13.393 -4.614 2.548 1.00 . A A . 4 CYS N 1 1 8 4537 1 1 4 CYS O O -12.971 -2.549 0.833 1.00 . A A . 4 CYS O 1 1 8 4538 1 1 4 CYS SG S -11.961 -7.421 1.565 1.00 . A A . 4 CYS SG 1 1 8 4539 1 1 5 THR C C -9.479 -2.123 -1.334 1.00 . A A . 5 THR C 1 1 8 4540 1 1 5 THR CA C -10.517 -1.845 -0.254 1.00 . A A . 5 THR CA 1 1 8 4541 1 1 5 THR CB C -10.029 -0.737 0.681 1.00 . A A . 5 THR CB 1 1 8 4542 1 1 5 THR CG2 C -9.785 0.580 -0.025 1.00 . A A . 5 THR CG2 1 1 8 4543 1 1 5 THR H H -10.084 -3.704 0.657 1.00 . A A . 5 THR H 1 1 8 4544 1 1 5 THR HA H -11.429 -1.528 -0.729 1.00 . A A . 5 THR HA 1 1 8 4545 1 1 5 THR HB H -9.099 -1.047 1.135 1.00 . A A . 5 THR HB 1 1 8 4546 1 1 5 THR HG1 H -11.793 -0.188 1.331 1.00 . A A . 5 THR HG1 1 1 8 4547 1 1 5 THR HG21 H -10.602 0.782 -0.702 1.00 . A A . 5 THR HG21 1 1 8 4548 1 1 5 THR HG22 H -9.720 1.373 0.706 1.00 . A A . 5 THR HG22 1 1 8 4549 1 1 5 THR HG23 H -8.862 0.526 -0.581 1.00 . A A . 5 THR HG23 1 1 8 4550 1 1 5 THR N N -10.804 -3.057 0.503 1.00 . A A . 5 THR N 1 1 8 4551 1 1 5 THR O O -8.413 -1.511 -1.364 1.00 . A A . 5 THR O 1 1 8 4552 1 1 5 THR OG1 O -10.970 -0.503 1.713 1.00 . A A . 5 THR OG1 1 1 8 4553 1 1 6 THR C C -8.343 -2.204 -4.016 1.00 . A A . 6 THR C 1 1 8 4554 1 1 6 THR CA C -8.899 -3.436 -3.304 1.00 . A A . 6 THR CA 1 1 8 4555 1 1 6 THR CB C -9.620 -4.341 -4.304 1.00 . A A . 6 THR CB 1 1 8 4556 1 1 6 THR CG2 C -9.353 -5.814 -4.074 1.00 . A A . 6 THR CG2 1 1 8 4557 1 1 6 THR H H -10.667 -3.510 -2.137 1.00 . A A . 6 THR H 1 1 8 4558 1 1 6 THR HA H -8.076 -3.983 -2.871 1.00 . A A . 6 THR HA 1 1 8 4559 1 1 6 THR HB H -9.288 -4.097 -5.303 1.00 . A A . 6 THR HB 1 1 8 4560 1 1 6 THR HG1 H -11.333 -3.791 -5.077 1.00 . A A . 6 THR HG1 1 1 8 4561 1 1 6 THR HG21 H -8.604 -5.929 -3.304 1.00 . A A . 6 THR HG21 1 1 8 4562 1 1 6 THR HG22 H -10.266 -6.302 -3.763 1.00 . A A . 6 THR HG22 1 1 8 4563 1 1 6 THR HG23 H -8.999 -6.264 -4.990 1.00 . A A . 6 THR HG23 1 1 8 4564 1 1 6 THR N N -9.801 -3.059 -2.218 1.00 . A A . 6 THR N 1 1 8 4565 1 1 6 THR O O -9.089 -1.303 -4.397 1.00 . A A . 6 THR O 1 1 8 4566 1 1 6 THR OG1 O -11.021 -4.143 -4.241 1.00 . A A . 6 THR OG1 1 1 8 4567 1 1 7 GLY C C -4.871 -1.194 -4.882 1.00 . A A . 7 GLY C 1 1 8 4568 1 1 7 GLY CA C -6.383 -1.055 -4.847 1.00 . A A . 7 GLY CA 1 1 8 4569 1 1 7 GLY H H -6.483 -2.924 -3.861 1.00 . A A . 7 GLY H 1 1 8 4570 1 1 7 GLY HA2 H -6.639 -0.148 -4.321 1.00 . A A . 7 GLY HA2 1 1 8 4571 1 1 7 GLY HA3 H -6.751 -0.989 -5.860 1.00 . A A . 7 GLY HA3 1 1 8 4572 1 1 7 GLY N N -7.025 -2.176 -4.187 1.00 . A A . 7 GLY N 1 1 8 4573 1 1 7 GLY O O -4.353 -2.299 -5.040 1.00 . A A . 7 GLY O 1 1 8 4574 1 1 8 PRO C C -2.068 -0.711 -3.496 1.00 . A A . 8 PRO C 1 1 8 4575 1 1 8 PRO CA C -2.664 -0.095 -4.761 1.00 . A A . 8 PRO CA 1 1 8 4576 1 1 8 PRO CB C -2.278 1.390 -4.866 1.00 . A A . 8 PRO CB 1 1 8 4577 1 1 8 PRO CD C -4.652 1.277 -4.552 1.00 . A A . 8 PRO CD 1 1 8 4578 1 1 8 PRO CG C -3.554 2.129 -5.116 1.00 . A A . 8 PRO CG 1 1 8 4579 1 1 8 PRO HA H -2.290 -0.627 -5.624 1.00 . A A . 8 PRO HA 1 1 8 4580 1 1 8 PRO HB2 H -1.818 1.708 -3.943 1.00 . A A . 8 PRO HB2 1 1 8 4581 1 1 8 PRO HB3 H -1.582 1.525 -5.682 1.00 . A A . 8 PRO HB3 1 1 8 4582 1 1 8 PRO HD2 H -4.802 1.495 -3.505 1.00 . A A . 8 PRO HD2 1 1 8 4583 1 1 8 PRO HD3 H -5.567 1.419 -5.107 1.00 . A A . 8 PRO HD3 1 1 8 4584 1 1 8 PRO HG2 H -3.527 3.085 -4.613 1.00 . A A . 8 PRO HG2 1 1 8 4585 1 1 8 PRO HG3 H -3.695 2.268 -6.178 1.00 . A A . 8 PRO HG3 1 1 8 4586 1 1 8 PRO N N -4.129 -0.081 -4.739 1.00 . A A . 8 PRO N 1 1 8 4587 1 1 8 PRO O O -1.138 -1.514 -3.565 1.00 . A A . 8 PRO O 1 1 8 4588 1 1 9 CYS C C -2.977 -2.003 -0.571 1.00 . A A . 9 CYS C 1 1 8 4589 1 1 9 CYS CA C -2.119 -0.838 -1.061 1.00 . A A . 9 CYS CA 1 1 8 4590 1 1 9 CYS CB C -2.108 0.279 -0.013 1.00 . A A . 9 CYS CB 1 1 8 4591 1 1 9 CYS H H -3.341 0.321 -2.348 1.00 . A A . 9 CYS H 1 1 8 4592 1 1 9 CYS HA H -1.108 -1.189 -1.209 1.00 . A A . 9 CYS HA 1 1 8 4593 1 1 9 CYS HB2 H -2.550 1.166 -0.440 1.00 . A A . 9 CYS HB2 1 1 8 4594 1 1 9 CYS HB3 H -2.690 -0.031 0.841 1.00 . A A . 9 CYS HB3 1 1 8 4595 1 1 9 CYS N N -2.604 -0.325 -2.340 1.00 . A A . 9 CYS N 1 1 8 4596 1 1 9 CYS O O -3.082 -2.244 0.631 1.00 . A A . 9 CYS O 1 1 8 4597 1 1 9 CYS SG S -0.447 0.726 0.585 1.00 . A A . 9 CYS SG 1 1 8 4598 1 1 10 CYS C C -3.962 -5.121 -1.879 1.00 . A A . 10 CYS C 1 1 8 4599 1 1 10 CYS CA C -4.436 -3.858 -1.167 1.00 . A A . 10 CYS CA 1 1 8 4600 1 1 10 CYS CB C -5.889 -3.563 -1.545 1.00 . A A . 10 CYS CB 1 1 8 4601 1 1 10 CYS H H -3.467 -2.481 -2.449 1.00 . A A . 10 CYS H 1 1 8 4602 1 1 10 CYS HA H -4.374 -4.013 -0.100 1.00 . A A . 10 CYS HA 1 1 8 4603 1 1 10 CYS HB2 H -5.971 -2.530 -1.841 1.00 . A A . 10 CYS HB2 1 1 8 4604 1 1 10 CYS HB3 H -6.169 -4.191 -2.378 1.00 . A A . 10 CYS HB3 1 1 8 4605 1 1 10 CYS N N -3.588 -2.721 -1.507 1.00 . A A . 10 CYS N 1 1 8 4606 1 1 10 CYS O O -4.003 -5.204 -3.107 1.00 . A A . 10 CYS O 1 1 8 4607 1 1 10 CYS SG S -7.091 -3.852 -0.206 1.00 . A A . 10 CYS SG 1 1 8 4608 1 1 11 ARG C C -3.550 -8.565 -0.889 1.00 . A A . 11 ARG C 1 1 8 4609 1 1 11 ARG CA C -3.030 -7.358 -1.670 1.00 . A A . 11 ARG CA 1 1 8 4610 1 1 11 ARG CB C -1.501 -7.375 -1.692 1.00 . A A . 11 ARG CB 1 1 8 4611 1 1 11 ARG CD C -1.136 -7.832 -4.136 1.00 . A A . 11 ARG CD 1 1 8 4612 1 1 11 ARG CG C -0.917 -8.333 -2.717 1.00 . A A . 11 ARG CG 1 1 8 4613 1 1 11 ARG CZ C -0.959 -9.898 -5.467 1.00 . A A . 11 ARG CZ 1 1 8 4614 1 1 11 ARG H H -3.501 -5.979 -0.132 1.00 . A A . 11 ARG H 1 1 8 4615 1 1 11 ARG HA H -3.392 -7.421 -2.685 1.00 . A A . 11 ARG HA 1 1 8 4616 1 1 11 ARG HB2 H -1.144 -6.380 -1.917 1.00 . A A . 11 ARG HB2 1 1 8 4617 1 1 11 ARG HB3 H -1.142 -7.664 -0.715 1.00 . A A . 11 ARG HB3 1 1 8 4618 1 1 11 ARG HD2 H -2.197 -7.798 -4.332 1.00 . A A . 11 ARG HD2 1 1 8 4619 1 1 11 ARG HD3 H -0.723 -6.837 -4.220 1.00 . A A . 11 ARG HD3 1 1 8 4620 1 1 11 ARG HE H 0.315 -8.364 -5.560 1.00 . A A . 11 ARG HE 1 1 8 4621 1 1 11 ARG HG2 H 0.143 -8.432 -2.541 1.00 . A A . 11 ARG HG2 1 1 8 4622 1 1 11 ARG HG3 H -1.394 -9.296 -2.607 1.00 . A A . 11 ARG HG3 1 1 8 4623 1 1 11 ARG HH11 H -2.545 -9.842 -4.214 1.00 . A A . 11 ARG HH11 1 1 8 4624 1 1 11 ARG HH12 H -2.398 -11.284 -5.161 1.00 . A A . 11 ARG HH12 1 1 8 4625 1 1 11 ARG HH21 H 0.510 -10.259 -6.807 1.00 . A A . 11 ARG HH21 1 1 8 4626 1 1 11 ARG HH22 H -0.663 -11.522 -6.633 1.00 . A A . 11 ARG HH22 1 1 8 4627 1 1 11 ARG N N -3.511 -6.102 -1.104 1.00 . A A . 11 ARG N 1 1 8 4628 1 1 11 ARG NE N -0.498 -8.696 -5.126 1.00 . A A . 11 ARG NE 1 1 8 4629 1 1 11 ARG NH1 N -2.057 -10.381 -4.901 1.00 . A A . 11 ARG NH1 1 1 8 4630 1 1 11 ARG NH2 N -0.318 -10.619 -6.377 1.00 . A A . 11 ARG NH2 1 1 8 4631 1 1 11 ARG O O -3.128 -9.695 -1.133 1.00 . A A . 11 ARG O 1 1 8 4632 1 1 12 GLN C C -6.443 -9.105 1.321 1.00 . A A . 12 GLN C 1 1 8 4633 1 1 12 GLN CA C -5.020 -9.411 0.856 1.00 . A A . 12 GLN CA 1 1 8 4634 1 1 12 GLN CB C -4.131 -9.667 2.070 1.00 . A A . 12 GLN CB 1 1 8 4635 1 1 12 GLN CD C -2.303 -11.181 2.934 1.00 . A A . 12 GLN CD 1 1 8 4636 1 1 12 GLN CG C -2.853 -10.421 1.743 1.00 . A A . 12 GLN CG 1 1 8 4637 1 1 12 GLN H H -4.763 -7.410 0.210 1.00 . A A . 12 GLN H 1 1 8 4638 1 1 12 GLN HA H -5.039 -10.299 0.244 1.00 . A A . 12 GLN HA 1 1 8 4639 1 1 12 GLN HB2 H -3.864 -8.717 2.507 1.00 . A A . 12 GLN HB2 1 1 8 4640 1 1 12 GLN HB3 H -4.689 -10.242 2.793 1.00 . A A . 12 GLN HB3 1 1 8 4641 1 1 12 GLN HE21 H -0.443 -10.888 2.294 1.00 . A A . 12 GLN HE21 1 1 8 4642 1 1 12 GLN HE22 H -0.599 -11.781 3.764 1.00 . A A . 12 GLN HE22 1 1 8 4643 1 1 12 GLN HG2 H -3.057 -11.124 0.950 1.00 . A A . 12 GLN HG2 1 1 8 4644 1 1 12 GLN HG3 H -2.108 -9.712 1.411 1.00 . A A . 12 GLN HG3 1 1 8 4645 1 1 12 GLN N N -4.463 -8.328 0.051 1.00 . A A . 12 GLN N 1 1 8 4646 1 1 12 GLN NE2 N -0.982 -11.295 3.005 1.00 . A A . 12 GLN NE2 1 1 8 4647 1 1 12 GLN O O -6.988 -9.809 2.171 1.00 . A A . 12 GLN O 1 1 8 4648 1 1 12 GLN OE1 O -3.057 -11.660 3.781 1.00 . A A . 12 GLN OE1 1 1 8 4649 1 1 13 CYS C C -8.455 -7.096 2.549 1.00 . A A . 13 CYS C 1 1 8 4650 1 1 13 CYS CA C -8.402 -7.668 1.132 1.00 . A A . 13 CYS CA 1 1 8 4651 1 1 13 CYS CB C -9.349 -8.867 1.018 1.00 . A A . 13 CYS CB 1 1 8 4652 1 1 13 CYS H H -6.563 -7.531 0.096 1.00 . A A . 13 CYS H 1 1 8 4653 1 1 13 CYS HA H -8.722 -6.904 0.440 1.00 . A A . 13 CYS HA 1 1 8 4654 1 1 13 CYS HB2 H -8.860 -9.649 0.456 1.00 . A A . 13 CYS HB2 1 1 8 4655 1 1 13 CYS HB3 H -9.577 -9.232 2.008 1.00 . A A . 13 CYS HB3 1 1 8 4656 1 1 13 CYS N N -7.042 -8.056 0.766 1.00 . A A . 13 CYS N 1 1 8 4657 1 1 13 CYS O O -9.536 -6.892 3.101 1.00 . A A . 13 CYS O 1 1 8 4658 1 1 13 CYS SG S -10.926 -8.493 0.186 1.00 . A A . 13 CYS SG 1 1 8 4659 1 1 14 LYS C C -5.966 -5.445 4.668 1.00 . A A . 14 LYS C 1 1 8 4660 1 1 14 LYS CA C -7.223 -6.282 4.483 1.00 . A A . 14 LYS CA 1 1 8 4661 1 1 14 LYS CB C -7.277 -7.401 5.526 1.00 . A A . 14 LYS CB 1 1 8 4662 1 1 14 LYS CD C -8.971 -7.026 7.344 1.00 . A A . 14 LYS CD 1 1 8 4663 1 1 14 LYS CE C -9.834 -7.897 8.242 1.00 . A A . 14 LYS CE 1 1 8 4664 1 1 14 LYS CG C -8.683 -7.708 6.016 1.00 . A A . 14 LYS CG 1 1 8 4665 1 1 14 LYS H H -6.455 -7.010 2.650 1.00 . A A . 14 LYS H 1 1 8 4666 1 1 14 LYS HA H -8.078 -5.638 4.610 1.00 . A A . 14 LYS HA 1 1 8 4667 1 1 14 LYS HB2 H -6.866 -8.301 5.092 1.00 . A A . 14 LYS HB2 1 1 8 4668 1 1 14 LYS HB3 H -6.677 -7.115 6.376 1.00 . A A . 14 LYS HB3 1 1 8 4669 1 1 14 LYS HD2 H -8.036 -6.826 7.846 1.00 . A A . 14 LYS HD2 1 1 8 4670 1 1 14 LYS HD3 H -9.487 -6.096 7.156 1.00 . A A . 14 LYS HD3 1 1 8 4671 1 1 14 LYS HE2 H -9.710 -8.929 7.948 1.00 . A A . 14 LYS HE2 1 1 8 4672 1 1 14 LYS HE3 H -9.508 -7.773 9.264 1.00 . A A . 14 LYS HE3 1 1 8 4673 1 1 14 LYS HG2 H -9.394 -7.359 5.283 1.00 . A A . 14 LYS HG2 1 1 8 4674 1 1 14 LYS HG3 H -8.785 -8.776 6.141 1.00 . A A . 14 LYS HG3 1 1 8 4675 1 1 14 LYS HZ1 H -11.553 -7.436 7.149 1.00 . A A . 14 LYS HZ1 1 1 8 4676 1 1 14 LYS HZ2 H -11.860 -8.279 8.583 1.00 . A A . 14 LYS HZ2 1 1 8 4677 1 1 14 LYS HZ3 H -11.453 -6.638 8.638 1.00 . A A . 14 LYS HZ3 1 1 8 4678 1 1 14 LYS N N -7.288 -6.834 3.135 1.00 . A A . 14 LYS N 1 1 8 4679 1 1 14 LYS NZ N -11.276 -7.537 8.146 1.00 . A A . 14 LYS NZ 1 1 8 4680 1 1 14 LYS O O -5.209 -5.631 5.621 1.00 . A A . 14 LYS O 1 1 8 4681 1 1 15 LEU C C -3.299 -4.376 3.812 1.00 . A A . 15 LEU C 1 1 8 4682 1 1 15 LEU CA C -4.618 -3.610 3.781 1.00 . A A . 15 LEU CA 1 1 8 4683 1 1 15 LEU CB C -4.700 -2.679 4.992 1.00 . A A . 15 LEU CB 1 1 8 4684 1 1 15 LEU CD1 C -6.065 -1.541 6.759 1.00 . A A . 15 LEU CD1 1 1 8 4685 1 1 15 LEU CD2 C -6.873 -1.583 4.388 1.00 . A A . 15 LEU CD2 1 1 8 4686 1 1 15 LEU CG C -6.115 -2.344 5.468 1.00 . A A . 15 LEU CG 1 1 8 4687 1 1 15 LEU H H -6.427 -4.419 3.030 1.00 . A A . 15 LEU H 1 1 8 4688 1 1 15 LEU HA H -4.644 -3.012 2.884 1.00 . A A . 15 LEU HA 1 1 8 4689 1 1 15 LEU HB2 H -4.168 -3.142 5.811 1.00 . A A . 15 LEU HB2 1 1 8 4690 1 1 15 LEU HB3 H -4.202 -1.755 4.740 1.00 . A A . 15 LEU HB3 1 1 8 4691 1 1 15 LEU HD11 H -5.096 -1.073 6.855 1.00 . A A . 15 LEU HD11 1 1 8 4692 1 1 15 LEU HD12 H -6.832 -0.780 6.740 1.00 . A A . 15 LEU HD12 1 1 8 4693 1 1 15 LEU HD13 H -6.231 -2.199 7.598 1.00 . A A . 15 LEU HD13 1 1 8 4694 1 1 15 LEU HD21 H -6.177 -1.225 3.643 1.00 . A A . 15 LEU HD21 1 1 8 4695 1 1 15 LEU HD22 H -7.592 -2.241 3.922 1.00 . A A . 15 LEU HD22 1 1 8 4696 1 1 15 LEU HD23 H -7.388 -0.744 4.832 1.00 . A A . 15 LEU HD23 1 1 8 4697 1 1 15 LEU HG H -6.647 -3.262 5.667 1.00 . A A . 15 LEU HG 1 1 8 4698 1 1 15 LEU N N -5.769 -4.512 3.749 1.00 . A A . 15 LEU N 1 1 8 4699 1 1 15 LEU O O -3.101 -5.268 4.636 1.00 . A A . 15 LEU O 1 1 8 4700 1 1 16 LYS C C -0.294 -4.374 4.131 1.00 . A A . 16 LYS C 1 1 8 4701 1 1 16 LYS CA C -1.083 -4.650 2.853 1.00 . A A . 16 LYS CA 1 1 8 4702 1 1 16 LYS CB C -0.301 -4.149 1.637 1.00 . A A . 16 LYS CB 1 1 8 4703 1 1 16 LYS CD C 0.594 -4.834 -0.609 1.00 . A A . 16 LYS CD 1 1 8 4704 1 1 16 LYS CE C 0.325 -3.762 -1.653 1.00 . A A . 16 LYS CE 1 1 8 4705 1 1 16 LYS CG C -0.559 -4.955 0.374 1.00 . A A . 16 LYS CG 1 1 8 4706 1 1 16 LYS H H -2.598 -3.283 2.292 1.00 . A A . 16 LYS H 1 1 8 4707 1 1 16 LYS HA H -1.237 -5.715 2.760 1.00 . A A . 16 LYS HA 1 1 8 4708 1 1 16 LYS HB2 H -0.576 -3.122 1.445 1.00 . A A . 16 LYS HB2 1 1 8 4709 1 1 16 LYS HB3 H 0.755 -4.195 1.858 1.00 . A A . 16 LYS HB3 1 1 8 4710 1 1 16 LYS HD2 H 1.491 -4.576 -0.067 1.00 . A A . 16 LYS HD2 1 1 8 4711 1 1 16 LYS HD3 H 0.731 -5.783 -1.107 1.00 . A A . 16 LYS HD3 1 1 8 4712 1 1 16 LYS HE2 H -0.690 -3.869 -2.008 1.00 . A A . 16 LYS HE2 1 1 8 4713 1 1 16 LYS HE3 H 0.444 -2.792 -1.194 1.00 . A A . 16 LYS HE3 1 1 8 4714 1 1 16 LYS HG2 H -0.684 -5.994 0.640 1.00 . A A . 16 LYS HG2 1 1 8 4715 1 1 16 LYS HG3 H -1.461 -4.591 -0.096 1.00 . A A . 16 LYS HG3 1 1 8 4716 1 1 16 LYS HZ1 H 2.241 -3.811 -2.483 1.00 . A A . 16 LYS HZ1 1 1 8 4717 1 1 16 LYS HZ2 H 1.116 -4.775 -3.300 1.00 . A A . 16 LYS HZ2 1 1 8 4718 1 1 16 LYS HZ3 H 1.079 -3.094 -3.483 1.00 . A A . 16 LYS HZ3 1 1 8 4719 1 1 16 LYS N N -2.389 -4.009 2.917 1.00 . A A . 16 LYS N 1 1 8 4720 1 1 16 LYS NZ N 1.255 -3.868 -2.811 1.00 . A A . 16 LYS NZ 1 1 8 4721 1 1 16 LYS O O -0.431 -3.309 4.733 1.00 . A A . 16 LYS O 1 1 8 4722 1 1 17 PRO C C 2.240 -3.940 5.728 1.00 . A A . 17 PRO C 1 1 8 4723 1 1 17 PRO CA C 1.351 -5.177 5.779 1.00 . A A . 17 PRO CA 1 1 8 4724 1 1 17 PRO CB C 2.206 -6.452 5.818 1.00 . A A . 17 PRO CB 1 1 8 4725 1 1 17 PRO CD C 0.773 -6.627 3.913 1.00 . A A . 17 PRO CD 1 1 8 4726 1 1 17 PRO CG C 2.117 -7.031 4.445 1.00 . A A . 17 PRO CG 1 1 8 4727 1 1 17 PRO HA H 0.729 -5.131 6.661 1.00 . A A . 17 PRO HA 1 1 8 4728 1 1 17 PRO HB2 H 3.224 -6.196 6.071 1.00 . A A . 17 PRO HB2 1 1 8 4729 1 1 17 PRO HB3 H 1.808 -7.131 6.557 1.00 . A A . 17 PRO HB3 1 1 8 4730 1 1 17 PRO HD2 H 0.807 -6.521 2.839 1.00 . A A . 17 PRO HD2 1 1 8 4731 1 1 17 PRO HD3 H 0.019 -7.343 4.203 1.00 . A A . 17 PRO HD3 1 1 8 4732 1 1 17 PRO HG2 H 2.903 -6.627 3.824 1.00 . A A . 17 PRO HG2 1 1 8 4733 1 1 17 PRO HG3 H 2.192 -8.107 4.495 1.00 . A A . 17 PRO HG3 1 1 8 4734 1 1 17 PRO N N 0.544 -5.329 4.565 1.00 . A A . 17 PRO N 1 1 8 4735 1 1 17 PRO O O 3.050 -3.785 4.814 1.00 . A A . 17 PRO O 1 1 8 4736 1 1 18 ALA C C 4.343 -2.097 6.483 1.00 . A A . 18 ALA C 1 1 8 4737 1 1 18 ALA CA C 2.872 -1.831 6.788 1.00 . A A . 18 ALA CA 1 1 8 4738 1 1 18 ALA CB C 2.724 -1.191 8.160 1.00 . A A . 18 ALA CB 1 1 8 4739 1 1 18 ALA H H 1.419 -3.239 7.413 1.00 . A A . 18 ALA H 1 1 8 4740 1 1 18 ALA HA H 2.482 -1.142 6.053 1.00 . A A . 18 ALA HA 1 1 8 4741 1 1 18 ALA HB1 H 2.961 -1.917 8.923 1.00 . A A . 18 ALA HB1 1 1 8 4742 1 1 18 ALA HB2 H 3.398 -0.351 8.240 1.00 . A A . 18 ALA HB2 1 1 8 4743 1 1 18 ALA HB3 H 1.707 -0.851 8.291 1.00 . A A . 18 ALA HB3 1 1 8 4744 1 1 18 ALA N N 2.083 -3.059 6.715 1.00 . A A . 18 ALA N 1 1 8 4745 1 1 18 ALA O O 4.794 -3.242 6.506 1.00 . A A . 18 ALA O 1 1 8 4746 1 1 19 GLY C C 6.721 -2.036 4.643 1.00 . A A . 19 GLY C 1 1 8 4747 1 1 19 GLY CA C 6.493 -1.182 5.876 1.00 . A A . 19 GLY CA 1 1 8 4748 1 1 19 GLY H H 4.672 -0.146 6.180 1.00 . A A . 19 GLY H 1 1 8 4749 1 1 19 GLY HA2 H 6.992 -1.642 6.716 1.00 . A A . 19 GLY HA2 1 1 8 4750 1 1 19 GLY HA3 H 6.919 -0.204 5.708 1.00 . A A . 19 GLY HA3 1 1 8 4751 1 1 19 GLY N N 5.085 -1.034 6.189 1.00 . A A . 19 GLY N 1 1 8 4752 1 1 19 GLY O O 7.815 -2.561 4.436 1.00 . A A . 19 GLY O 1 1 8 4753 1 1 20 THR C C 5.499 -2.099 1.377 1.00 . A A . 20 THR C 1 1 8 4754 1 1 20 THR CA C 5.771 -2.966 2.601 1.00 . A A . 20 THR CA 1 1 8 4755 1 1 20 THR CB C 4.774 -4.126 2.650 1.00 . A A . 20 THR CB 1 1 8 4756 1 1 20 THR CG2 C 4.831 -5.019 1.429 1.00 . A A . 20 THR CG2 1 1 8 4757 1 1 20 THR H H 4.839 -1.729 4.039 1.00 . A A . 20 THR H 1 1 8 4758 1 1 20 THR HA H 6.772 -3.364 2.532 1.00 . A A . 20 THR HA 1 1 8 4759 1 1 20 THR HB H 3.774 -3.723 2.718 1.00 . A A . 20 THR HB 1 1 8 4760 1 1 20 THR HG1 H 4.239 -4.905 4.365 1.00 . A A . 20 THR HG1 1 1 8 4761 1 1 20 THR HG21 H 5.149 -4.440 0.575 1.00 . A A . 20 THR HG21 1 1 8 4762 1 1 20 THR HG22 H 5.532 -5.821 1.603 1.00 . A A . 20 THR HG22 1 1 8 4763 1 1 20 THR HG23 H 3.850 -5.431 1.240 1.00 . A A . 20 THR HG23 1 1 8 4764 1 1 20 THR N N 5.684 -2.173 3.821 1.00 . A A . 20 THR N 1 1 8 4765 1 1 20 THR O O 4.578 -1.282 1.377 1.00 . A A . 20 THR O 1 1 8 4766 1 1 20 THR OG1 O 5.005 -4.938 3.787 1.00 . A A . 20 THR OG1 1 1 8 4767 1 1 21 THR C C 4.777 -1.752 -1.514 1.00 . A A . 21 THR C 1 1 8 4768 1 1 21 THR CA C 6.146 -1.507 -0.889 1.00 . A A . 21 THR CA 1 1 8 4769 1 1 21 THR CB C 7.252 -1.855 -1.888 1.00 . A A . 21 THR CB 1 1 8 4770 1 1 21 THR CG2 C 8.156 -0.683 -2.198 1.00 . A A . 21 THR CG2 1 1 8 4771 1 1 21 THR H H 7.022 -2.944 0.397 1.00 . A A . 21 THR H 1 1 8 4772 1 1 21 THR HA H 6.226 -0.463 -0.631 1.00 . A A . 21 THR HA 1 1 8 4773 1 1 21 THR HB H 6.800 -2.177 -2.816 1.00 . A A . 21 THR HB 1 1 8 4774 1 1 21 THR HG1 H 8.628 -2.581 -0.695 1.00 . A A . 21 THR HG1 1 1 8 4775 1 1 21 THR HG21 H 8.212 -0.035 -1.335 1.00 . A A . 21 THR HG21 1 1 8 4776 1 1 21 THR HG22 H 9.144 -1.044 -2.442 1.00 . A A . 21 THR HG22 1 1 8 4777 1 1 21 THR HG23 H 7.756 -0.132 -3.037 1.00 . A A . 21 THR HG23 1 1 8 4778 1 1 21 THR N N 6.304 -2.279 0.338 1.00 . A A . 21 THR N 1 1 8 4779 1 1 21 THR O O 4.365 -2.896 -1.702 1.00 . A A . 21 THR O 1 1 8 4780 1 1 21 THR OG1 O 8.064 -2.909 -1.400 1.00 . A A . 21 THR OG1 1 1 8 4781 1 1 22 CYS C C 2.770 -0.267 -3.877 1.00 . A A . 22 CYS C 1 1 8 4782 1 1 22 CYS CA C 2.754 -0.766 -2.437 1.00 . A A . 22 CYS CA 1 1 8 4783 1 1 22 CYS CB C 1.729 0.028 -1.623 1.00 . A A . 22 CYS CB 1 1 8 4784 1 1 22 CYS H H 4.460 0.217 -1.659 1.00 . A A . 22 CYS H 1 1 8 4785 1 1 22 CYS HA H 2.469 -1.807 -2.436 1.00 . A A . 22 CYS HA 1 1 8 4786 1 1 22 CYS HB2 H 0.848 0.185 -2.226 1.00 . A A . 22 CYS HB2 1 1 8 4787 1 1 22 CYS HB3 H 1.461 -0.544 -0.747 1.00 . A A . 22 CYS HB3 1 1 8 4788 1 1 22 CYS N N 4.077 -0.668 -1.833 1.00 . A A . 22 CYS N 1 1 8 4789 1 1 22 CYS O O 1.761 0.223 -4.384 1.00 . A A . 22 CYS O 1 1 8 4790 1 1 22 CYS SG S 2.313 1.662 -1.062 1.00 . A A . 22 CYS SG 1 1 8 4791 1 1 23 TRP C C 5.316 -0.509 -6.553 1.00 . A A . 23 TRP C 1 1 8 4792 1 1 23 TRP CA C 4.049 0.038 -5.918 1.00 . A A . 23 TRP CA 1 1 8 4793 1 1 23 TRP CB C 4.042 1.571 -6.005 1.00 . A A . 23 TRP CB 1 1 8 4794 1 1 23 TRP CD1 C 1.793 1.453 -7.196 1.00 . A A . 23 TRP CD1 1 1 8 4795 1 1 23 TRP CD2 C 2.884 3.374 -7.528 1.00 . A A . 23 TRP CD2 1 1 8 4796 1 1 23 TRP CE2 C 1.666 3.422 -8.230 1.00 . A A . 23 TRP CE2 1 1 8 4797 1 1 23 TRP CE3 C 3.737 4.477 -7.591 1.00 . A A . 23 TRP CE3 1 1 8 4798 1 1 23 TRP CG C 2.943 2.100 -6.873 1.00 . A A . 23 TRP CG 1 1 8 4799 1 1 23 TRP CH2 C 2.132 5.592 -9.026 1.00 . A A . 23 TRP CH2 1 1 8 4800 1 1 23 TRP CZ2 C 1.280 4.525 -8.982 1.00 . A A . 23 TRP CZ2 1 1 8 4801 1 1 23 TRP CZ3 C 3.352 5.575 -8.340 1.00 . A A . 23 TRP CZ3 1 1 8 4802 1 1 23 TRP H H 4.688 -0.799 -4.082 1.00 . A A . 23 TRP H 1 1 8 4803 1 1 23 TRP HA H 3.205 -0.346 -6.462 1.00 . A A . 23 TRP HA 1 1 8 4804 1 1 23 TRP HB2 H 3.912 1.981 -5.014 1.00 . A A . 23 TRP HB2 1 1 8 4805 1 1 23 TRP HB3 H 4.984 1.910 -6.411 1.00 . A A . 23 TRP HB3 1 1 8 4806 1 1 23 TRP HD1 H 1.546 0.463 -6.852 1.00 . A A . 23 TRP HD1 1 1 8 4807 1 1 23 TRP HE1 H 0.149 1.992 -8.379 1.00 . A A . 23 TRP HE1 1 1 8 4808 1 1 23 TRP HE3 H 4.682 4.481 -7.072 1.00 . A A . 23 TRP HE3 1 1 8 4809 1 1 23 TRP HH2 H 1.873 6.470 -9.598 1.00 . A A . 23 TRP HH2 1 1 8 4810 1 1 23 TRP HZ2 H 0.343 4.550 -9.516 1.00 . A A . 23 TRP HZ2 1 1 8 4811 1 1 23 TRP HZ3 H 3.998 6.438 -8.399 1.00 . A A . 23 TRP HZ3 1 1 8 4812 1 1 23 TRP N N 3.917 -0.398 -4.535 1.00 . A A . 23 TRP N 1 1 8 4813 1 1 23 TRP NE1 N 1.020 2.238 -8.013 1.00 . A A . 23 TRP NE1 1 1 8 4814 1 1 23 TRP O O 5.265 -1.404 -7.395 1.00 . A A . 23 TRP O 1 1 8 4815 1 1 24 LYS C C 7.691 -0.493 -8.202 1.00 . A A . 24 LYS C 1 1 8 4816 1 1 24 LYS CA C 7.745 -0.359 -6.681 1.00 . A A . 24 LYS CA 1 1 8 4817 1 1 24 LYS CB C 8.199 -1.674 -6.037 1.00 . A A . 24 LYS CB 1 1 8 4818 1 1 24 LYS CD C 6.310 -3.256 -5.531 1.00 . A A . 24 LYS CD 1 1 8 4819 1 1 24 LYS CE C 5.127 -3.889 -6.248 1.00 . A A . 24 LYS CE 1 1 8 4820 1 1 24 LYS CG C 7.426 -2.901 -6.501 1.00 . A A . 24 LYS CG 1 1 8 4821 1 1 24 LYS H H 6.405 0.764 -5.484 1.00 . A A . 24 LYS H 1 1 8 4822 1 1 24 LYS HA H 8.456 0.413 -6.432 1.00 . A A . 24 LYS HA 1 1 8 4823 1 1 24 LYS HB2 H 9.243 -1.828 -6.266 1.00 . A A . 24 LYS HB2 1 1 8 4824 1 1 24 LYS HB3 H 8.085 -1.589 -4.966 1.00 . A A . 24 LYS HB3 1 1 8 4825 1 1 24 LYS HD2 H 6.690 -3.954 -4.801 1.00 . A A . 24 LYS HD2 1 1 8 4826 1 1 24 LYS HD3 H 5.979 -2.356 -5.033 1.00 . A A . 24 LYS HD3 1 1 8 4827 1 1 24 LYS HE2 H 4.342 -3.153 -6.339 1.00 . A A . 24 LYS HE2 1 1 8 4828 1 1 24 LYS HE3 H 5.443 -4.201 -7.232 1.00 . A A . 24 LYS HE3 1 1 8 4829 1 1 24 LYS HG2 H 6.998 -2.704 -7.471 1.00 . A A . 24 LYS HG2 1 1 8 4830 1 1 24 LYS HG3 H 8.107 -3.736 -6.571 1.00 . A A . 24 LYS HG3 1 1 8 4831 1 1 24 LYS HZ1 H 5.366 -5.536 -4.986 1.00 . A A . 24 LYS HZ1 1 1 8 4832 1 1 24 LYS HZ2 H 3.864 -4.772 -4.838 1.00 . A A . 24 LYS HZ2 1 1 8 4833 1 1 24 LYS HZ3 H 4.185 -5.752 -6.179 1.00 . A A . 24 LYS HZ3 1 1 8 4834 1 1 24 LYS N N 6.447 0.050 -6.150 1.00 . A A . 24 LYS N 1 1 8 4835 1 1 24 LYS NZ N 4.599 -5.070 -5.511 1.00 . A A . 24 LYS NZ 1 1 8 4836 1 1 24 LYS O O 8.397 -1.310 -8.793 1.00 . A A . 24 LYS O 1 1 8 4837 1 1 25 THR C C 7.898 0.895 -10.965 1.00 . A A . 25 THR C 1 1 8 4838 1 1 25 THR CA C 6.674 0.306 -10.271 1.00 . A A . 25 THR CA 1 1 8 4839 1 1 25 THR CB C 5.418 1.092 -10.665 1.00 . A A . 25 THR CB 1 1 8 4840 1 1 25 THR CG2 C 4.476 0.311 -11.555 1.00 . A A . 25 THR CG2 1 1 8 4841 1 1 25 THR H H 6.306 0.946 -8.291 1.00 . A A . 25 THR H 1 1 8 4842 1 1 25 THR HA H 6.558 -0.721 -10.582 1.00 . A A . 25 THR HA 1 1 8 4843 1 1 25 THR HB H 5.713 1.984 -11.199 1.00 . A A . 25 THR HB 1 1 8 4844 1 1 25 THR HG1 H 4.371 0.706 -9.055 1.00 . A A . 25 THR HG1 1 1 8 4845 1 1 25 THR HG21 H 4.429 -0.714 -11.219 1.00 . A A . 25 THR HG21 1 1 8 4846 1 1 25 THR HG22 H 3.490 0.751 -11.508 1.00 . A A . 25 THR HG22 1 1 8 4847 1 1 25 THR HG23 H 4.835 0.340 -12.573 1.00 . A A . 25 THR HG23 1 1 8 4848 1 1 25 THR N N 6.840 0.320 -8.823 1.00 . A A . 25 THR N 1 1 8 4849 1 1 25 THR O O 8.765 1.486 -10.321 1.00 . A A . 25 THR O 1 1 8 4850 1 1 25 THR OG1 O 4.690 1.486 -9.515 1.00 . A A . 25 THR OG1 1 1 8 4851 1 1 26 SER C C 9.045 2.782 -13.114 1.00 . A A . 26 SER C 1 1 8 4852 1 1 26 SER CA C 9.076 1.255 -13.062 1.00 . A A . 26 SER CA 1 1 8 4853 1 1 26 SER CB C 9.043 0.685 -14.481 1.00 . A A . 26 SER CB 1 1 8 4854 1 1 26 SER H H 7.237 0.257 -12.740 1.00 . A A . 26 SER H 1 1 8 4855 1 1 26 SER HA H 9.991 0.943 -12.580 1.00 . A A . 26 SER HA 1 1 8 4856 1 1 26 SER HB2 H 8.511 -0.254 -14.477 1.00 . A A . 26 SER HB2 1 1 8 4857 1 1 26 SER HB3 H 8.538 1.382 -15.134 1.00 . A A . 26 SER HB3 1 1 8 4858 1 1 26 SER HG H 10.345 -0.274 -15.586 1.00 . A A . 26 SER HG 1 1 8 4859 1 1 26 SER N N 7.960 0.734 -12.281 1.00 . A A . 26 SER N 1 1 8 4860 1 1 26 SER O O 10.022 3.417 -13.510 1.00 . A A . 26 SER O 1 1 8 4861 1 1 26 SER OG O 10.353 0.464 -14.973 1.00 . A A . 26 SER OG 1 1 8 4862 1 1 27 VAL C C 7.932 5.398 -11.321 1.00 . A A . 27 VAL C 1 1 8 4863 1 1 27 VAL CA C 7.764 4.816 -12.720 1.00 . A A . 27 VAL CA 1 1 8 4864 1 1 27 VAL CB C 6.385 5.234 -13.269 1.00 . A A . 27 VAL CB 1 1 8 4865 1 1 27 VAL CG1 C 5.269 4.712 -12.374 1.00 . A A . 27 VAL CG1 1 1 8 4866 1 1 27 VAL CG2 C 6.300 6.747 -13.407 1.00 . A A . 27 VAL CG2 1 1 8 4867 1 1 27 VAL H H 7.170 2.811 -12.411 1.00 . A A . 27 VAL H 1 1 8 4868 1 1 27 VAL HA H 8.525 5.229 -13.366 1.00 . A A . 27 VAL HA 1 1 8 4869 1 1 27 VAL HB H 6.262 4.797 -14.250 1.00 . A A . 27 VAL HB 1 1 8 4870 1 1 27 VAL HG11 H 5.367 3.643 -12.261 1.00 . A A . 27 VAL HG11 1 1 8 4871 1 1 27 VAL HG12 H 5.334 5.184 -11.404 1.00 . A A . 27 VAL HG12 1 1 8 4872 1 1 27 VAL HG13 H 4.312 4.940 -12.821 1.00 . A A . 27 VAL HG13 1 1 8 4873 1 1 27 VAL HG21 H 7.257 7.133 -13.724 1.00 . A A . 27 VAL HG21 1 1 8 4874 1 1 27 VAL HG22 H 5.549 7.000 -14.141 1.00 . A A . 27 VAL HG22 1 1 8 4875 1 1 27 VAL HG23 H 6.034 7.181 -12.454 1.00 . A A . 27 VAL HG23 1 1 8 4876 1 1 27 VAL N N 7.917 3.366 -12.715 1.00 . A A . 27 VAL N 1 1 8 4877 1 1 27 VAL O O 8.384 6.531 -11.161 1.00 . A A . 27 VAL O 1 1 8 4878 1 1 28 SER C C 7.801 3.909 -7.963 1.00 . A A . 28 SER C 1 1 8 4879 1 1 28 SER CA C 7.651 5.079 -8.930 1.00 . A A . 28 SER CA 1 1 8 4880 1 1 28 SER CB C 6.410 5.892 -8.566 1.00 . A A . 28 SER CB 1 1 8 4881 1 1 28 SER H H 7.189 3.732 -10.498 1.00 . A A . 28 SER H 1 1 8 4882 1 1 28 SER HA H 8.521 5.712 -8.850 1.00 . A A . 28 SER HA 1 1 8 4883 1 1 28 SER HB2 H 5.599 5.617 -9.224 1.00 . A A . 28 SER HB2 1 1 8 4884 1 1 28 SER HB3 H 6.130 5.680 -7.545 1.00 . A A . 28 SER HB3 1 1 8 4885 1 1 28 SER HG H 5.867 7.770 -8.439 1.00 . A A . 28 SER HG 1 1 8 4886 1 1 28 SER N N 7.552 4.623 -10.310 1.00 . A A . 28 SER N 1 1 8 4887 1 1 28 SER O O 7.930 2.757 -8.375 1.00 . A A . 28 SER O 1 1 8 4888 1 1 28 SER OG O 6.653 7.282 -8.696 1.00 . A A . 28 SER OG 1 1 8 4889 1 1 29 SER C C 7.645 3.818 -4.256 1.00 . A A . 29 SER C 1 1 8 4890 1 1 29 SER CA C 7.906 3.209 -5.630 1.00 . A A . 29 SER CA 1 1 8 4891 1 1 29 SER CB C 9.301 2.580 -5.666 1.00 . A A . 29 SER CB 1 1 8 4892 1 1 29 SER H H 7.670 5.160 -6.410 1.00 . A A . 29 SER H 1 1 8 4893 1 1 29 SER HA H 7.166 2.444 -5.820 1.00 . A A . 29 SER HA 1 1 8 4894 1 1 29 SER HB2 H 9.324 1.722 -5.011 1.00 . A A . 29 SER HB2 1 1 8 4895 1 1 29 SER HB3 H 9.526 2.269 -6.676 1.00 . A A . 29 SER HB3 1 1 8 4896 1 1 29 SER HG H 10.511 3.335 -4.323 1.00 . A A . 29 SER HG 1 1 8 4897 1 1 29 SER N N 7.779 4.221 -6.671 1.00 . A A . 29 SER N 1 1 8 4898 1 1 29 SER O O 8.325 4.758 -3.844 1.00 . A A . 29 SER O 1 1 8 4899 1 1 29 SER OG O 10.288 3.504 -5.241 1.00 . A A . 29 SER OG 1 1 8 4900 1 1 30 HIS C C 6.174 2.645 -1.230 1.00 . A A . 30 HIS C 1 1 8 4901 1 1 30 HIS CA C 6.291 3.788 -2.234 1.00 . A A . 30 HIS CA 1 1 8 4902 1 1 30 HIS CB C 4.969 4.560 -2.300 1.00 . A A . 30 HIS CB 1 1 8 4903 1 1 30 HIS CD2 C 5.069 5.194 -4.816 1.00 . A A . 30 HIS CD2 1 1 8 4904 1 1 30 HIS CE1 C 4.404 7.274 -4.653 1.00 . A A . 30 HIS CE1 1 1 8 4905 1 1 30 HIS CG C 4.839 5.443 -3.505 1.00 . A A . 30 HIS CG 1 1 8 4906 1 1 30 HIS H H 6.137 2.544 -3.941 1.00 . A A . 30 HIS H 1 1 8 4907 1 1 30 HIS HA H 7.073 4.458 -1.910 1.00 . A A . 30 HIS HA 1 1 8 4908 1 1 30 HIS HB2 H 4.152 3.855 -2.321 1.00 . A A . 30 HIS HB2 1 1 8 4909 1 1 30 HIS HB3 H 4.879 5.180 -1.421 1.00 . A A . 30 HIS HB3 1 1 8 4910 1 1 30 HIS HD1 H 4.177 7.236 -2.619 1.00 . A A . 30 HIS HD1 1 1 8 4911 1 1 30 HIS HD2 H 5.409 4.258 -5.240 1.00 . A A . 30 HIS HD2 1 1 8 4912 1 1 30 HIS HE1 H 4.119 8.284 -4.908 1.00 . A A . 30 HIS HE1 1 1 8 4913 1 1 30 HIS HE2 H 4.758 6.432 -6.480 1.00 . A A . 30 HIS HE2 1 1 8 4914 1 1 30 HIS N N 6.649 3.286 -3.556 1.00 . A A . 30 HIS N 1 1 8 4915 1 1 30 HIS ND1 N 4.424 6.756 -3.436 1.00 . A A . 30 HIS ND1 1 1 8 4916 1 1 30 HIS NE2 N 4.791 6.347 -5.506 1.00 . A A . 30 HIS NE2 1 1 8 4917 1 1 30 HIS O O 6.615 1.527 -1.495 1.00 . A A . 30 HIS O 1 1 8 4918 1 1 31 TYR C C 4.011 2.049 1.596 1.00 . A A . 31 TYR C 1 1 8 4919 1 1 31 TYR CA C 5.394 1.931 0.965 1.00 . A A . 31 TYR CA 1 1 8 4920 1 1 31 TYR CB C 6.472 2.084 2.040 1.00 . A A . 31 TYR CB 1 1 8 4921 1 1 31 TYR CD1 C 8.577 1.762 0.683 1.00 . A A . 31 TYR CD1 1 1 8 4922 1 1 31 TYR CD2 C 8.140 0.236 2.462 1.00 . A A . 31 TYR CD2 1 1 8 4923 1 1 31 TYR CE1 C 9.749 1.090 0.390 1.00 . A A . 31 TYR CE1 1 1 8 4924 1 1 31 TYR CE2 C 9.310 -0.440 2.176 1.00 . A A . 31 TYR CE2 1 1 8 4925 1 1 31 TYR CG C 7.754 1.347 1.722 1.00 . A A . 31 TYR CG 1 1 8 4926 1 1 31 TYR CZ C 10.111 -0.009 1.139 1.00 . A A . 31 TYR CZ 1 1 8 4927 1 1 31 TYR H H 5.242 3.843 0.071 1.00 . A A . 31 TYR H 1 1 8 4928 1 1 31 TYR HA H 5.488 0.957 0.510 1.00 . A A . 31 TYR HA 1 1 8 4929 1 1 31 TYR HB2 H 6.712 3.131 2.152 1.00 . A A . 31 TYR HB2 1 1 8 4930 1 1 31 TYR HB3 H 6.093 1.704 2.977 1.00 . A A . 31 TYR HB3 1 1 8 4931 1 1 31 TYR HD1 H 8.291 2.623 0.098 1.00 . A A . 31 TYR HD1 1 1 8 4932 1 1 31 TYR HD2 H 7.510 -0.099 3.273 1.00 . A A . 31 TYR HD2 1 1 8 4933 1 1 31 TYR HE1 H 10.376 1.428 -0.422 1.00 . A A . 31 TYR HE1 1 1 8 4934 1 1 31 TYR HE2 H 9.594 -1.301 2.763 1.00 . A A . 31 TYR HE2 1 1 8 4935 1 1 31 TYR HH H 11.314 -0.869 -0.090 1.00 . A A . 31 TYR HH 1 1 8 4936 1 1 31 TYR N N 5.574 2.933 -0.079 1.00 . A A . 31 TYR N 1 1 8 4937 1 1 31 TYR O O 3.391 3.112 1.561 1.00 . A A . 31 TYR O 1 1 8 4938 1 1 31 TYR OH O 11.277 -0.680 0.850 1.00 . A A . 31 TYR OH 1 1 8 4939 1 1 32 CYS C C 2.340 1.214 4.301 1.00 . A A . 32 CYS C 1 1 8 4940 1 1 32 CYS CA C 2.219 0.936 2.807 1.00 . A A . 32 CYS CA 1 1 8 4941 1 1 32 CYS CB C 1.534 -0.413 2.581 1.00 . A A . 32 CYS CB 1 1 8 4942 1 1 32 CYS H H 4.067 0.133 2.169 1.00 . A A . 32 CYS H 1 1 8 4943 1 1 32 CYS HA H 1.622 1.713 2.355 1.00 . A A . 32 CYS HA 1 1 8 4944 1 1 32 CYS HB2 H 1.959 -0.882 1.706 1.00 . A A . 32 CYS HB2 1 1 8 4945 1 1 32 CYS HB3 H 1.707 -1.044 3.441 1.00 . A A . 32 CYS HB3 1 1 8 4946 1 1 32 CYS N N 3.529 0.951 2.171 1.00 . A A . 32 CYS N 1 1 8 4947 1 1 32 CYS O O 3.391 0.992 4.902 1.00 . A A . 32 CYS O 1 1 8 4948 1 1 32 CYS SG S -0.267 -0.299 2.328 1.00 . A A . 32 CYS SG 1 1 8 4949 1 1 33 THR C C 0.323 1.044 7.071 1.00 . A A . 33 THR C 1 1 8 4950 1 1 33 THR CA C 1.238 2.006 6.319 1.00 . A A . 33 THR CA 1 1 8 4951 1 1 33 THR CB C 0.777 3.448 6.546 1.00 . A A . 33 THR CB 1 1 8 4952 1 1 33 THR CG2 C 1.381 4.433 5.569 1.00 . A A . 33 THR CG2 1 1 8 4953 1 1 33 THR H H 0.449 1.853 4.362 1.00 . A A . 33 THR H 1 1 8 4954 1 1 33 THR HA H 2.244 1.896 6.695 1.00 . A A . 33 THR HA 1 1 8 4955 1 1 33 THR HB H 1.063 3.753 7.543 1.00 . A A . 33 THR HB 1 1 8 4956 1 1 33 THR HG1 H -0.902 3.324 5.544 1.00 . A A . 33 THR HG1 1 1 8 4957 1 1 33 THR HG21 H 2.458 4.374 5.617 1.00 . A A . 33 THR HG21 1 1 8 4958 1 1 33 THR HG22 H 1.052 4.196 4.568 1.00 . A A . 33 THR HG22 1 1 8 4959 1 1 33 THR HG23 H 1.064 5.434 5.824 1.00 . A A . 33 THR HG23 1 1 8 4960 1 1 33 THR N N 1.257 1.700 4.894 1.00 . A A . 33 THR N 1 1 8 4961 1 1 33 THR O O -0.058 1.302 8.213 1.00 . A A . 33 THR O 1 1 8 4962 1 1 33 THR OG1 O -0.632 3.546 6.439 1.00 . A A . 33 THR OG1 1 1 8 4963 1 1 34 GLY C C -2.124 -0.431 7.692 1.00 . A A . 34 GLY C 1 1 8 4964 1 1 34 GLY CA C -0.894 -1.052 7.052 1.00 . A A . 34 GLY CA 1 1 8 4965 1 1 34 GLY H H 0.309 -0.223 5.516 1.00 . A A . 34 GLY H 1 1 8 4966 1 1 34 GLY HA2 H -0.334 -1.576 7.812 1.00 . A A . 34 GLY HA2 1 1 8 4967 1 1 34 GLY HA3 H -1.213 -1.761 6.303 1.00 . A A . 34 GLY HA3 1 1 8 4968 1 1 34 GLY N N -0.026 -0.068 6.426 1.00 . A A . 34 GLY N 1 1 8 4969 1 1 34 GLY O O -2.674 -0.975 8.649 1.00 . A A . 34 GLY O 1 1 8 4970 1 1 35 ARG C C -4.865 1.400 6.677 1.00 . A A . 35 ARG C 1 1 8 4971 1 1 35 ARG CA C -3.725 1.405 7.691 1.00 . A A . 35 ARG CA 1 1 8 4972 1 1 35 ARG CB C -3.366 2.844 8.064 1.00 . A A . 35 ARG CB 1 1 8 4973 1 1 35 ARG CD C -4.260 4.927 9.148 1.00 . A A . 35 ARG CD 1 1 8 4974 1 1 35 ARG CG C -4.211 3.408 9.194 1.00 . A A . 35 ARG CG 1 1 8 4975 1 1 35 ARG CZ C -4.820 6.778 10.675 1.00 . A A . 35 ARG CZ 1 1 8 4976 1 1 35 ARG H H -2.074 1.096 6.401 1.00 . A A . 35 ARG H 1 1 8 4977 1 1 35 ARG HA H -4.048 0.882 8.578 1.00 . A A . 35 ARG HA 1 1 8 4978 1 1 35 ARG HB2 H -2.330 2.877 8.367 1.00 . A A . 35 ARG HB2 1 1 8 4979 1 1 35 ARG HB3 H -3.498 3.473 7.196 1.00 . A A . 35 ARG HB3 1 1 8 4980 1 1 35 ARG HD2 H -3.324 5.293 8.755 1.00 . A A . 35 ARG HD2 1 1 8 4981 1 1 35 ARG HD3 H -5.066 5.228 8.496 1.00 . A A . 35 ARG HD3 1 1 8 4982 1 1 35 ARG HE H -4.362 4.922 11.247 1.00 . A A . 35 ARG HE 1 1 8 4983 1 1 35 ARG HG2 H -5.215 3.023 9.107 1.00 . A A . 35 ARG HG2 1 1 8 4984 1 1 35 ARG HG3 H -3.785 3.099 10.138 1.00 . A A . 35 ARG HG3 1 1 8 4985 1 1 35 ARG HH11 H -4.853 7.271 8.713 1.00 . A A . 35 ARG HH11 1 1 8 4986 1 1 35 ARG HH12 H -5.244 8.555 9.808 1.00 . A A . 35 ARG HH12 1 1 8 4987 1 1 35 ARG HH21 H -4.876 6.609 12.688 1.00 . A A . 35 ARG HH21 1 1 8 4988 1 1 35 ARG HH22 H -5.256 8.180 12.064 1.00 . A A . 35 ARG HH22 1 1 8 4989 1 1 35 ARG N N -2.555 0.711 7.163 1.00 . A A . 35 ARG N 1 1 8 4990 1 1 35 ARG NE N -4.478 5.508 10.471 1.00 . A A . 35 ARG NE 1 1 8 4991 1 1 35 ARG NH1 N -4.986 7.602 9.648 1.00 . A A . 35 ARG NH1 1 1 8 4992 1 1 35 ARG NH2 N -4.999 7.226 11.910 1.00 . A A . 35 ARG NH2 1 1 8 4993 1 1 35 ARG O O -6.035 1.288 7.043 1.00 . A A . 35 ARG O 1 1 8 4994 1 1 36 SER C C -4.941 0.861 3.080 1.00 . A A . 36 SER C 1 1 8 4995 1 1 36 SER CA C -5.501 1.528 4.330 1.00 . A A . 36 SER CA 1 1 8 4996 1 1 36 SER CB C -5.929 2.962 4.011 1.00 . A A . 36 SER CB 1 1 8 4997 1 1 36 SER H H -3.563 1.605 5.177 1.00 . A A . 36 SER H 1 1 8 4998 1 1 36 SER HA H -6.362 0.970 4.668 1.00 . A A . 36 SER HA 1 1 8 4999 1 1 36 SER HB2 H -5.053 3.591 3.947 1.00 . A A . 36 SER HB2 1 1 8 5000 1 1 36 SER HB3 H -6.453 2.977 3.067 1.00 . A A . 36 SER HB3 1 1 8 5001 1 1 36 SER HG H -6.258 3.866 5.718 1.00 . A A . 36 SER HG 1 1 8 5002 1 1 36 SER N N -4.513 1.520 5.403 1.00 . A A . 36 SER N 1 1 8 5003 1 1 36 SER O O -3.751 0.550 3.014 1.00 . A A . 36 SER O 1 1 8 5004 1 1 36 SER OG O -6.785 3.475 5.017 1.00 . A A . 36 SER OG 1 1 8 5005 1 1 37 CYS C C -5.018 1.055 -0.210 1.00 . A A . 37 CYS C 1 1 8 5006 1 1 37 CYS CA C -5.374 0.012 0.847 1.00 . A A . 37 CYS CA 1 1 8 5007 1 1 37 CYS CB C -6.471 -0.912 0.323 1.00 . A A . 37 CYS CB 1 1 8 5008 1 1 37 CYS H H -6.736 0.911 2.194 1.00 . A A . 37 CYS H 1 1 8 5009 1 1 37 CYS HA H -4.497 -0.578 1.061 1.00 . A A . 37 CYS HA 1 1 8 5010 1 1 37 CYS HB2 H -7.423 -0.411 0.408 1.00 . A A . 37 CYS HB2 1 1 8 5011 1 1 37 CYS HB3 H -6.279 -1.133 -0.715 1.00 . A A . 37 CYS HB3 1 1 8 5012 1 1 37 CYS N N -5.799 0.642 2.089 1.00 . A A . 37 CYS N 1 1 8 5013 1 1 37 CYS O O -4.829 0.725 -1.380 1.00 . A A . 37 CYS O 1 1 8 5014 1 1 37 CYS SG S -6.593 -2.494 1.219 1.00 . A A . 37 CYS SG 1 1 8 5015 1 1 38 GLU C C -3.118 3.793 -0.557 1.00 . A A . 38 GLU C 1 1 8 5016 1 1 38 GLU CA C -4.586 3.400 -0.702 1.00 . A A . 38 GLU CA 1 1 8 5017 1 1 38 GLU CB C -5.479 4.614 -0.437 1.00 . A A . 38 GLU CB 1 1 8 5018 1 1 38 GLU CD C -7.470 4.890 -1.967 1.00 . A A . 38 GLU CD 1 1 8 5019 1 1 38 GLU CG C -6.958 4.338 -0.651 1.00 . A A . 38 GLU CG 1 1 8 5020 1 1 38 GLU H H -5.084 2.517 1.156 1.00 . A A . 38 GLU H 1 1 8 5021 1 1 38 GLU HA H -4.755 3.052 -1.710 1.00 . A A . 38 GLU HA 1 1 8 5022 1 1 38 GLU HB2 H -5.338 4.934 0.584 1.00 . A A . 38 GLU HB2 1 1 8 5023 1 1 38 GLU HB3 H -5.185 5.414 -1.100 1.00 . A A . 38 GLU HB3 1 1 8 5024 1 1 38 GLU HG2 H -7.118 3.270 -0.640 1.00 . A A . 38 GLU HG2 1 1 8 5025 1 1 38 GLU HG3 H -7.516 4.793 0.155 1.00 . A A . 38 GLU HG3 1 1 8 5026 1 1 38 GLU N N -4.924 2.314 0.210 1.00 . A A . 38 GLU N 1 1 8 5027 1 1 38 GLU O O -2.759 4.576 0.322 1.00 . A A . 38 GLU O 1 1 8 5028 1 1 38 GLU OE1 O -8.054 5.994 -1.961 1.00 . A A . 38 GLU OE1 1 1 8 5029 1 1 38 GLU OE2 O -7.287 4.218 -3.004 1.00 . A A . 38 GLU OE2 1 1 8 5030 1 1 39 CYS C C -0.594 5.034 -1.541 1.00 . A A . 39 CYS C 1 1 8 5031 1 1 39 CYS CA C -0.845 3.533 -1.395 1.00 . A A . 39 CYS CA 1 1 8 5032 1 1 39 CYS CB C -0.130 2.766 -2.511 1.00 . A A . 39 CYS CB 1 1 8 5033 1 1 39 CYS H H -2.622 2.624 -2.102 1.00 . A A . 39 CYS H 1 1 8 5034 1 1 39 CYS HA H -0.462 3.203 -0.442 1.00 . A A . 39 CYS HA 1 1 8 5035 1 1 39 CYS HB2 H -0.356 1.715 -2.416 1.00 . A A . 39 CYS HB2 1 1 8 5036 1 1 39 CYS HB3 H -0.493 3.119 -3.466 1.00 . A A . 39 CYS HB3 1 1 8 5037 1 1 39 CYS N N -2.275 3.242 -1.425 1.00 . A A . 39 CYS N 1 1 8 5038 1 1 39 CYS O O -1.196 5.690 -2.392 1.00 . A A . 39 CYS O 1 1 8 5039 1 1 39 CYS SG S 1.684 2.944 -2.508 1.00 . A A . 39 CYS SG 1 1 8 5040 1 1 40 PRO C C 1.128 7.473 -2.121 1.00 . A A . 40 PRO C 1 1 8 5041 1 1 40 PRO CA C 0.619 7.034 -0.753 1.00 . A A . 40 PRO CA 1 1 8 5042 1 1 40 PRO CB C 1.718 7.200 0.307 1.00 . A A . 40 PRO CB 1 1 8 5043 1 1 40 PRO CD C 1.063 4.904 0.336 1.00 . A A . 40 PRO CD 1 1 8 5044 1 1 40 PRO CG C 2.226 5.822 0.567 1.00 . A A . 40 PRO CG 1 1 8 5045 1 1 40 PRO HA H -0.236 7.636 -0.482 1.00 . A A . 40 PRO HA 1 1 8 5046 1 1 40 PRO HB2 H 2.498 7.841 -0.078 1.00 . A A . 40 PRO HB2 1 1 8 5047 1 1 40 PRO HB3 H 1.296 7.637 1.200 1.00 . A A . 40 PRO HB3 1 1 8 5048 1 1 40 PRO HD2 H 1.404 3.940 -0.012 1.00 . A A . 40 PRO HD2 1 1 8 5049 1 1 40 PRO HD3 H 0.477 4.799 1.237 1.00 . A A . 40 PRO HD3 1 1 8 5050 1 1 40 PRO HG2 H 3.029 5.591 -0.118 1.00 . A A . 40 PRO HG2 1 1 8 5051 1 1 40 PRO HG3 H 2.569 5.743 1.588 1.00 . A A . 40 PRO HG3 1 1 8 5052 1 1 40 PRO N N 0.299 5.603 -0.709 1.00 . A A . 40 PRO N 1 1 8 5053 1 1 40 PRO O O 1.635 6.663 -2.896 1.00 . A A . 40 PRO O 1 1 8 5054 1 1 41 SER C C 2.823 9.932 -3.567 1.00 . A A . 41 SER C 1 1 8 5055 1 1 41 SER CA C 1.433 9.313 -3.687 1.00 . A A . 41 SER CA 1 1 8 5056 1 1 41 SER CB C 0.438 10.361 -4.188 1.00 . A A . 41 SER CB 1 1 8 5057 1 1 41 SER H H 0.576 9.360 -1.752 1.00 . A A . 41 SER H 1 1 8 5058 1 1 41 SER HA H 1.474 8.502 -4.399 1.00 . A A . 41 SER HA 1 1 8 5059 1 1 41 SER HB2 H 0.600 11.289 -3.660 1.00 . A A . 41 SER HB2 1 1 8 5060 1 1 41 SER HB3 H 0.586 10.519 -5.246 1.00 . A A . 41 SER HB3 1 1 8 5061 1 1 41 SER HG H -1.494 10.679 -4.121 1.00 . A A . 41 SER HG 1 1 8 5062 1 1 41 SER N N 0.988 8.763 -2.411 1.00 . A A . 41 SER N 1 1 8 5063 1 1 41 SER O O 3.206 10.778 -4.375 1.00 . A A . 41 SER O 1 1 8 5064 1 1 41 SER OG O -0.899 9.942 -3.971 1.00 . A A . 41 SER OG 1 1 8 5065 1 1 42 TYR C C 5.866 8.899 -1.899 1.00 . A A . 42 TYR C 1 1 8 5066 1 1 42 TYR CA C 4.923 10.019 -2.340 1.00 . A A . 42 TYR CA 1 1 8 5067 1 1 42 TYR CB C 4.905 11.135 -1.292 1.00 . A A . 42 TYR CB 1 1 8 5068 1 1 42 TYR CD1 C 3.364 10.811 0.683 1.00 . A A . 42 TYR CD1 1 1 8 5069 1 1 42 TYR CD2 C 5.610 10.033 0.867 1.00 . A A . 42 TYR CD2 1 1 8 5070 1 1 42 TYR CE1 C 3.102 10.369 1.966 1.00 . A A . 42 TYR CE1 1 1 8 5071 1 1 42 TYR CE2 C 5.356 9.589 2.150 1.00 . A A . 42 TYR CE2 1 1 8 5072 1 1 42 TYR CG C 4.620 10.651 0.113 1.00 . A A . 42 TYR CG 1 1 8 5073 1 1 42 TYR CZ C 4.101 9.759 2.695 1.00 . A A . 42 TYR CZ 1 1 8 5074 1 1 42 TYR H H 3.219 8.827 -1.946 1.00 . A A . 42 TYR H 1 1 8 5075 1 1 42 TYR HA H 5.276 10.422 -3.277 1.00 . A A . 42 TYR HA 1 1 8 5076 1 1 42 TYR HB2 H 5.866 11.627 -1.284 1.00 . A A . 42 TYR HB2 1 1 8 5077 1 1 42 TYR HB3 H 4.142 11.854 -1.557 1.00 . A A . 42 TYR HB3 1 1 8 5078 1 1 42 TYR HD1 H 2.584 11.289 0.110 1.00 . A A . 42 TYR HD1 1 1 8 5079 1 1 42 TYR HD2 H 6.592 9.902 0.437 1.00 . A A . 42 TYR HD2 1 1 8 5080 1 1 42 TYR HE1 H 2.119 10.503 2.393 1.00 . A A . 42 TYR HE1 1 1 8 5081 1 1 42 TYR HE2 H 6.138 9.111 2.720 1.00 . A A . 42 TYR HE2 1 1 8 5082 1 1 42 TYR HH H 3.186 8.619 3.944 1.00 . A A . 42 TYR HH 1 1 8 5083 1 1 42 TYR N N 3.576 9.505 -2.557 1.00 . A A . 42 TYR N 1 1 8 5084 1 1 42 TYR O O 5.470 8.004 -1.152 1.00 . A A . 42 TYR O 1 1 8 5085 1 1 42 TYR OH O 3.844 9.318 3.973 1.00 . A A . 42 TYR OH 1 1 8 5086 1 1 43 PRO C C 8.608 8.051 -0.564 1.00 . A A . 43 PRO C 1 1 8 5087 1 1 43 PRO CA C 8.123 7.914 -2.003 1.00 . A A . 43 PRO CA 1 1 8 5088 1 1 43 PRO CB C 9.265 8.186 -2.982 1.00 . A A . 43 PRO CB 1 1 8 5089 1 1 43 PRO CD C 7.690 9.963 -3.253 1.00 . A A . 43 PRO CD 1 1 8 5090 1 1 43 PRO CG C 9.159 9.639 -3.285 1.00 . A A . 43 PRO CG 1 1 8 5091 1 1 43 PRO HA H 7.739 6.917 -2.160 1.00 . A A . 43 PRO HA 1 1 8 5092 1 1 43 PRO HB2 H 10.209 7.945 -2.514 1.00 . A A . 43 PRO HB2 1 1 8 5093 1 1 43 PRO HB3 H 9.133 7.586 -3.870 1.00 . A A . 43 PRO HB3 1 1 8 5094 1 1 43 PRO HD2 H 7.531 10.952 -2.849 1.00 . A A . 43 PRO HD2 1 1 8 5095 1 1 43 PRO HD3 H 7.264 9.885 -4.242 1.00 . A A . 43 PRO HD3 1 1 8 5096 1 1 43 PRO HG2 H 9.685 10.210 -2.535 1.00 . A A . 43 PRO HG2 1 1 8 5097 1 1 43 PRO HG3 H 9.565 9.841 -4.266 1.00 . A A . 43 PRO HG3 1 1 8 5098 1 1 43 PRO N N 7.130 8.933 -2.356 1.00 . A A . 43 PRO N 1 1 8 5099 1 1 43 PRO O O 8.659 9.153 -0.018 1.00 . A A . 43 PRO O 1 1 8 5100 1 1 44 GLY C C 10.944 7.117 1.503 1.00 . A A . 44 GLY C 1 1 8 5101 1 1 44 GLY CA C 9.441 6.940 1.414 1.00 . A A . 44 GLY CA 1 1 8 5102 1 1 44 GLY H H 8.902 6.076 -0.442 1.00 . A A . 44 GLY H 1 1 8 5103 1 1 44 GLY HA2 H 9.170 6.008 1.888 1.00 . A A . 44 GLY HA2 1 1 8 5104 1 1 44 GLY HA3 H 8.962 7.752 1.941 1.00 . A A . 44 GLY HA3 1 1 8 5105 1 1 44 GLY N N 8.964 6.925 0.044 1.00 . A A . 44 GLY N 1 1 8 5106 1 1 44 GLY O O 11.611 7.331 0.491 1.00 . A A . 44 GLY O 1 1 8 5107 1 1 45 ASN C C 13.388 8.555 2.481 1.00 . A A . 45 ASN C 1 1 8 5108 1 1 45 ASN CA C 12.911 7.179 2.935 1.00 . A A . 45 ASN CA 1 1 8 5109 1 1 45 ASN CB C 13.680 6.088 2.189 1.00 . A A . 45 ASN CB 1 1 8 5110 1 1 45 ASN CG C 13.421 4.707 2.757 1.00 . A A . 45 ASN CG 1 1 8 5111 1 1 45 ASN H H 10.892 6.855 3.485 1.00 . A A . 45 ASN H 1 1 8 5112 1 1 45 ASN HA H 13.097 7.079 3.994 1.00 . A A . 45 ASN HA 1 1 8 5113 1 1 45 ASN HB2 H 13.381 6.091 1.151 1.00 . A A . 45 ASN HB2 1 1 8 5114 1 1 45 ASN HB3 H 14.738 6.293 2.255 1.00 . A A . 45 ASN HB3 1 1 8 5115 1 1 45 ASN HD21 H 13.897 5.341 4.581 1.00 . A A . 45 ASN HD21 1 1 8 5116 1 1 45 ASN HD22 H 13.448 3.678 4.459 1.00 . A A . 45 ASN HD22 1 1 8 5117 1 1 45 ASN N N 11.477 7.028 2.717 1.00 . A A . 45 ASN N 1 1 8 5118 1 1 45 ASN ND2 N 13.608 4.560 4.064 1.00 . A A . 45 ASN ND2 1 1 8 5119 1 1 45 ASN O O 14.524 8.713 2.036 1.00 . A A . 45 ASN O 1 1 8 5120 1 1 45 ASN OD1 O 13.058 3.781 2.031 1.00 . A A . 45 ASN OD1 1 1 8 5121 1 1 46 GLY C C 13.153 11.002 0.709 1.00 . A A . 46 GLY C 1 1 8 5122 1 1 46 GLY CA C 12.862 10.897 2.193 1.00 . A A . 46 GLY CA 1 1 8 5123 1 1 46 GLY H H 11.620 9.362 2.958 1.00 . A A . 46 GLY H 1 1 8 5124 1 1 46 GLY HA2 H 13.737 11.209 2.743 1.00 . A A . 46 GLY HA2 1 1 8 5125 1 1 46 GLY HA3 H 12.042 11.557 2.435 1.00 . A A . 46 GLY HA3 1 1 8 5126 1 1 46 GLY N N 12.511 9.547 2.596 1.00 . A A . 46 GLY N 1 1 8 5127 1 1 46 GLY O O 14.258 11.460 0.352 1.00 . A A . 46 GLY O 1 1 8 5128 1 1 46 GLY OXT O 12.276 10.624 -0.097 1.00 . A A . 46 GLY OXT 1 1 9 5129 1 1 1 ALA C C -18.366 -3.596 -0.153 1.00 . A A . 1 ALA C 1 1 9 5130 1 1 1 ALA CA C -18.388 -3.582 -1.678 1.00 . A A . 1 ALA CA 1 1 9 5131 1 1 1 ALA CB C -19.720 -4.108 -2.190 1.00 . A A . 1 ALA CB 1 1 9 5132 1 1 1 ALA H1 H -16.411 -4.151 -1.695 1.00 . A A . 1 ALA H1 1 1 9 5133 1 1 1 ALA H2 H -17.517 -5.391 -2.127 1.00 . A A . 1 ALA H2 1 1 9 5134 1 1 1 ALA H3 H -17.164 -4.133 -3.237 1.00 . A A . 1 ALA H3 1 1 9 5135 1 1 1 ALA HA H -18.276 -2.563 -2.019 1.00 . A A . 1 ALA HA 1 1 9 5136 1 1 1 ALA HB1 H -20.508 -3.813 -1.513 1.00 . A A . 1 ALA HB1 1 1 9 5137 1 1 1 ALA HB2 H -19.916 -3.697 -3.170 1.00 . A A . 1 ALA HB2 1 1 9 5138 1 1 1 ALA HB3 H -19.683 -5.185 -2.253 1.00 . A A . 1 ALA HB3 1 1 9 5139 1 1 1 ALA N N -17.269 -4.387 -2.235 1.00 . A A . 1 ALA N 1 1 9 5140 1 1 1 ALA O O -19.082 -4.371 0.481 1.00 . A A . 1 ALA O 1 1 9 5141 1 1 2 MET C C -16.954 -3.971 2.469 1.00 . A A . 2 MET C 1 1 9 5142 1 1 2 MET CA C -17.424 -2.645 1.880 1.00 . A A . 2 MET CA 1 1 9 5143 1 1 2 MET CB C -18.767 -2.248 2.496 1.00 . A A . 2 MET CB 1 1 9 5144 1 1 2 MET CE C -19.435 -2.278 6.583 1.00 . A A . 2 MET CE 1 1 9 5145 1 1 2 MET CG C -18.668 -1.838 3.956 1.00 . A A . 2 MET CG 1 1 9 5146 1 1 2 MET H H -16.994 -2.141 -0.131 1.00 . A A . 2 MET H 1 1 9 5147 1 1 2 MET HA H -16.694 -1.884 2.109 1.00 . A A . 2 MET HA 1 1 9 5148 1 1 2 MET HB2 H -19.174 -1.418 1.938 1.00 . A A . 2 MET HB2 1 1 9 5149 1 1 2 MET HB3 H -19.445 -3.085 2.425 1.00 . A A . 2 MET HB3 1 1 9 5150 1 1 2 MET HE1 H -18.601 -1.593 6.604 1.00 . A A . 2 MET HE1 1 1 9 5151 1 1 2 MET HE2 H -20.202 -1.933 7.261 1.00 . A A . 2 MET HE2 1 1 9 5152 1 1 2 MET HE3 H -19.103 -3.260 6.884 1.00 . A A . 2 MET HE3 1 1 9 5153 1 1 2 MET HG2 H -17.783 -2.286 4.383 1.00 . A A . 2 MET HG2 1 1 9 5154 1 1 2 MET HG3 H -18.586 -0.762 4.009 1.00 . A A . 2 MET HG3 1 1 9 5155 1 1 2 MET N N -17.539 -2.733 0.429 1.00 . A A . 2 MET N 1 1 9 5156 1 1 2 MET O O -17.365 -4.356 3.564 1.00 . A A . 2 MET O 1 1 9 5157 1 1 2 MET SD S -20.100 -2.357 4.921 1.00 . A A . 2 MET SD 1 1 9 5158 1 1 3 ASP C C -14.072 -6.061 1.884 1.00 . A A . 3 ASP C 1 1 9 5159 1 1 3 ASP CA C -15.562 -5.948 2.187 1.00 . A A . 3 ASP CA 1 1 9 5160 1 1 3 ASP CB C -16.319 -7.097 1.518 1.00 . A A . 3 ASP CB 1 1 9 5161 1 1 3 ASP CG C -16.221 -7.051 0.006 1.00 . A A . 3 ASP CG 1 1 9 5162 1 1 3 ASP H H -15.798 -4.306 0.873 1.00 . A A . 3 ASP H 1 1 9 5163 1 1 3 ASP HA H -15.706 -6.008 3.256 1.00 . A A . 3 ASP HA 1 1 9 5164 1 1 3 ASP HB2 H -15.910 -8.036 1.859 1.00 . A A . 3 ASP HB2 1 1 9 5165 1 1 3 ASP HB3 H -17.362 -7.042 1.795 1.00 . A A . 3 ASP HB3 1 1 9 5166 1 1 3 ASP N N -16.089 -4.665 1.737 1.00 . A A . 3 ASP N 1 1 9 5167 1 1 3 ASP O O -13.646 -5.885 0.742 1.00 . A A . 3 ASP O 1 1 9 5168 1 1 3 ASP OD1 O -16.055 -5.943 -0.545 1.00 . A A . 3 ASP OD1 1 1 9 5169 1 1 3 ASP OD2 O -16.309 -8.124 -0.627 1.00 . A A . 3 ASP OD2 1 1 9 5170 1 1 4 CYS C C -11.208 -5.182 2.315 1.00 . A A . 4 CYS C 1 1 9 5171 1 1 4 CYS CA C -11.840 -6.495 2.763 1.00 . A A . 4 CYS CA 1 1 9 5172 1 1 4 CYS CB C -11.510 -7.598 1.756 1.00 . A A . 4 CYS CB 1 1 9 5173 1 1 4 CYS H H -13.686 -6.485 3.799 1.00 . A A . 4 CYS H 1 1 9 5174 1 1 4 CYS HA H -11.430 -6.765 3.724 1.00 . A A . 4 CYS HA 1 1 9 5175 1 1 4 CYS HB2 H -12.255 -7.599 0.976 1.00 . A A . 4 CYS HB2 1 1 9 5176 1 1 4 CYS HB3 H -10.541 -7.398 1.322 1.00 . A A . 4 CYS HB3 1 1 9 5177 1 1 4 CYS N N -13.285 -6.357 2.914 1.00 . A A . 4 CYS N 1 1 9 5178 1 1 4 CYS O O -11.667 -4.551 1.363 1.00 . A A . 4 CYS O 1 1 9 5179 1 1 4 CYS SG S -11.461 -9.272 2.476 1.00 . A A . 4 CYS SG 1 1 9 5180 1 1 5 THR C C -8.862 -3.612 1.272 1.00 . A A . 5 THR C 1 1 9 5181 1 1 5 THR CA C -9.443 -3.547 2.681 1.00 . A A . 5 THR CA 1 1 9 5182 1 1 5 THR CB C -8.327 -3.301 3.696 1.00 . A A . 5 THR CB 1 1 9 5183 1 1 5 THR CG2 C -8.051 -1.834 3.939 1.00 . A A . 5 THR CG2 1 1 9 5184 1 1 5 THR H H -9.828 -5.330 3.752 1.00 . A A . 5 THR H 1 1 9 5185 1 1 5 THR HA H -10.150 -2.732 2.732 1.00 . A A . 5 THR HA 1 1 9 5186 1 1 5 THR HB H -7.418 -3.755 3.330 1.00 . A A . 5 THR HB 1 1 9 5187 1 1 5 THR HG1 H -9.428 -3.466 5.308 1.00 . A A . 5 THR HG1 1 1 9 5188 1 1 5 THR HG21 H -8.216 -1.281 3.026 1.00 . A A . 5 THR HG21 1 1 9 5189 1 1 5 THR HG22 H -8.715 -1.465 4.707 1.00 . A A . 5 THR HG22 1 1 9 5190 1 1 5 THR HG23 H -7.027 -1.708 4.257 1.00 . A A . 5 THR HG23 1 1 9 5191 1 1 5 THR N N -10.148 -4.780 3.006 1.00 . A A . 5 THR N 1 1 9 5192 1 1 5 THR O O -7.695 -3.955 1.086 1.00 . A A . 5 THR O 1 1 9 5193 1 1 5 THR OG1 O -8.647 -3.890 4.944 1.00 . A A . 5 THR OG1 1 1 9 5194 1 1 6 THR C C -8.579 -2.003 -1.502 1.00 . A A . 6 THR C 1 1 9 5195 1 1 6 THR CA C -9.258 -3.312 -1.113 1.00 . A A . 6 THR CA 1 1 9 5196 1 1 6 THR CB C -10.453 -3.572 -2.031 1.00 . A A . 6 THR CB 1 1 9 5197 1 1 6 THR CG2 C -11.194 -4.850 -1.701 1.00 . A A . 6 THR CG2 1 1 9 5198 1 1 6 THR H H -10.608 -3.025 0.493 1.00 . A A . 6 THR H 1 1 9 5199 1 1 6 THR HA H -8.548 -4.118 -1.225 1.00 . A A . 6 THR HA 1 1 9 5200 1 1 6 THR HB H -10.102 -3.646 -3.050 1.00 . A A . 6 THR HB 1 1 9 5201 1 1 6 THR HG1 H -11.774 -2.481 -1.082 1.00 . A A . 6 THR HG1 1 1 9 5202 1 1 6 THR HG21 H -10.926 -5.176 -0.707 1.00 . A A . 6 THR HG21 1 1 9 5203 1 1 6 THR HG22 H -12.258 -4.671 -1.747 1.00 . A A . 6 THR HG22 1 1 9 5204 1 1 6 THR HG23 H -10.927 -5.615 -2.415 1.00 . A A . 6 THR HG23 1 1 9 5205 1 1 6 THR N N -9.687 -3.286 0.281 1.00 . A A . 6 THR N 1 1 9 5206 1 1 6 THR O O -9.145 -0.923 -1.331 1.00 . A A . 6 THR O 1 1 9 5207 1 1 6 THR OG1 O -11.382 -2.505 -1.958 1.00 . A A . 6 THR OG1 1 1 9 5208 1 1 7 GLY C C -5.173 -1.232 -2.759 1.00 . A A . 7 GLY C 1 1 9 5209 1 1 7 GLY CA C -6.624 -0.927 -2.435 1.00 . A A . 7 GLY CA 1 1 9 5210 1 1 7 GLY H H -6.962 -2.996 -2.140 1.00 . A A . 7 GLY H 1 1 9 5211 1 1 7 GLY HA2 H -6.658 -0.200 -1.638 1.00 . A A . 7 GLY HA2 1 1 9 5212 1 1 7 GLY HA3 H -7.096 -0.507 -3.311 1.00 . A A . 7 GLY HA3 1 1 9 5213 1 1 7 GLY N N -7.362 -2.108 -2.027 1.00 . A A . 7 GLY N 1 1 9 5214 1 1 7 GLY O O -4.742 -2.381 -2.660 1.00 . A A . 7 GLY O 1 1 9 5215 1 1 8 PRO C C -2.064 -0.509 -2.284 1.00 . A A . 8 PRO C 1 1 9 5216 1 1 8 PRO CA C -2.976 -0.392 -3.506 1.00 . A A . 8 PRO CA 1 1 9 5217 1 1 8 PRO CB C -2.656 0.882 -4.286 1.00 . A A . 8 PRO CB 1 1 9 5218 1 1 8 PRO CD C -4.825 1.187 -3.316 1.00 . A A . 8 PRO CD 1 1 9 5219 1 1 8 PRO CG C -3.563 1.911 -3.707 1.00 . A A . 8 PRO CG 1 1 9 5220 1 1 8 PRO HA H -2.831 -1.251 -4.143 1.00 . A A . 8 PRO HA 1 1 9 5221 1 1 8 PRO HB2 H -1.617 1.143 -4.146 1.00 . A A . 8 PRO HB2 1 1 9 5222 1 1 8 PRO HB3 H -2.856 0.726 -5.336 1.00 . A A . 8 PRO HB3 1 1 9 5223 1 1 8 PRO HD2 H -5.211 1.577 -2.387 1.00 . A A . 8 PRO HD2 1 1 9 5224 1 1 8 PRO HD3 H -5.566 1.274 -4.098 1.00 . A A . 8 PRO HD3 1 1 9 5225 1 1 8 PRO HG2 H -3.103 2.357 -2.837 1.00 . A A . 8 PRO HG2 1 1 9 5226 1 1 8 PRO HG3 H -3.779 2.668 -4.447 1.00 . A A . 8 PRO HG3 1 1 9 5227 1 1 8 PRO N N -4.390 -0.215 -3.159 1.00 . A A . 8 PRO N 1 1 9 5228 1 1 8 PRO O O -0.843 -0.577 -2.423 1.00 . A A . 8 PRO O 1 1 9 5229 1 1 9 CYS C C -2.303 -1.833 0.984 1.00 . A A . 9 CYS C 1 1 9 5230 1 1 9 CYS CA C -1.864 -0.639 0.139 1.00 . A A . 9 CYS CA 1 1 9 5231 1 1 9 CYS CB C -1.972 0.651 0.955 1.00 . A A . 9 CYS CB 1 1 9 5232 1 1 9 CYS H H -3.625 -0.472 -1.027 1.00 . A A . 9 CYS H 1 1 9 5233 1 1 9 CYS HA H -0.834 -0.784 -0.145 1.00 . A A . 9 CYS HA 1 1 9 5234 1 1 9 CYS HB2 H -2.415 1.420 0.341 1.00 . A A . 9 CYS HB2 1 1 9 5235 1 1 9 CYS HB3 H -2.604 0.474 1.813 1.00 . A A . 9 CYS HB3 1 1 9 5236 1 1 9 CYS N N -2.650 -0.531 -1.088 1.00 . A A . 9 CYS N 1 1 9 5237 1 1 9 CYS O O -2.016 -1.895 2.179 1.00 . A A . 9 CYS O 1 1 9 5238 1 1 9 CYS SG S -0.376 1.288 1.563 1.00 . A A . 9 CYS SG 1 1 9 5239 1 1 10 CYS C C -3.143 -5.232 0.263 1.00 . A A . 10 CYS C 1 1 9 5240 1 1 10 CYS CA C -3.460 -3.972 1.060 1.00 . A A . 10 CYS CA 1 1 9 5241 1 1 10 CYS CB C -4.962 -3.881 1.321 1.00 . A A . 10 CYS CB 1 1 9 5242 1 1 10 CYS H H -3.191 -2.681 -0.596 1.00 . A A . 10 CYS H 1 1 9 5243 1 1 10 CYS HA H -2.943 -4.022 2.006 1.00 . A A . 10 CYS HA 1 1 9 5244 1 1 10 CYS HB2 H -5.487 -3.916 0.378 1.00 . A A . 10 CYS HB2 1 1 9 5245 1 1 10 CYS HB3 H -5.267 -4.720 1.929 1.00 . A A . 10 CYS HB3 1 1 9 5246 1 1 10 CYS N N -2.993 -2.782 0.358 1.00 . A A . 10 CYS N 1 1 9 5247 1 1 10 CYS O O -3.346 -5.279 -0.950 1.00 . A A . 10 CYS O 1 1 9 5248 1 1 10 CYS SG S -5.469 -2.359 2.181 1.00 . A A . 10 CYS SG 1 1 9 5249 1 1 11 ARG C C -3.474 -8.071 -0.477 1.00 . A A . 11 ARG C 1 1 9 5250 1 1 11 ARG CA C -2.291 -7.514 0.311 1.00 . A A . 11 ARG CA 1 1 9 5251 1 1 11 ARG CB C -1.831 -8.532 1.357 1.00 . A A . 11 ARG CB 1 1 9 5252 1 1 11 ARG CD C 0.397 -9.556 0.807 1.00 . A A . 11 ARG CD 1 1 9 5253 1 1 11 ARG CG C -0.334 -8.500 1.619 1.00 . A A . 11 ARG CG 1 1 9 5254 1 1 11 ARG CZ C 0.425 -11.501 2.319 1.00 . A A . 11 ARG CZ 1 1 9 5255 1 1 11 ARG H H -2.500 -6.152 1.918 1.00 . A A . 11 ARG H 1 1 9 5256 1 1 11 ARG HA H -1.478 -7.322 -0.372 1.00 . A A . 11 ARG HA 1 1 9 5257 1 1 11 ARG HB2 H -2.342 -8.332 2.287 1.00 . A A . 11 ARG HB2 1 1 9 5258 1 1 11 ARG HB3 H -2.094 -9.523 1.018 1.00 . A A . 11 ARG HB3 1 1 9 5259 1 1 11 ARG HD2 H 0.162 -9.415 -0.238 1.00 . A A . 11 ARG HD2 1 1 9 5260 1 1 11 ARG HD3 H 1.460 -9.435 0.955 1.00 . A A . 11 ARG HD3 1 1 9 5261 1 1 11 ARG HE H -0.579 -11.406 0.597 1.00 . A A . 11 ARG HE 1 1 9 5262 1 1 11 ARG HG2 H 0.048 -7.526 1.351 1.00 . A A . 11 ARG HG2 1 1 9 5263 1 1 11 ARG HG3 H -0.158 -8.680 2.670 1.00 . A A . 11 ARG HG3 1 1 9 5264 1 1 11 ARG HH11 H 1.531 -9.931 2.953 1.00 . A A . 11 ARG HH11 1 1 9 5265 1 1 11 ARG HH12 H 1.534 -11.311 3.999 1.00 . A A . 11 ARG HH12 1 1 9 5266 1 1 11 ARG HH21 H -0.577 -13.222 1.971 1.00 . A A . 11 ARG HH21 1 1 9 5267 1 1 11 ARG HH22 H 0.338 -13.180 3.441 1.00 . A A . 11 ARG HH22 1 1 9 5268 1 1 11 ARG N N -2.640 -6.251 0.954 1.00 . A A . 11 ARG N 1 1 9 5269 1 1 11 ARG NE N 0.014 -10.910 1.199 1.00 . A A . 11 ARG NE 1 1 9 5270 1 1 11 ARG NH1 N 1.229 -10.862 3.159 1.00 . A A . 11 ARG NH1 1 1 9 5271 1 1 11 ARG NH2 N 0.029 -12.735 2.600 1.00 . A A . 11 ARG NH2 1 1 9 5272 1 1 11 ARG O O -3.536 -7.933 -1.698 1.00 . A A . 11 ARG O 1 1 9 5273 1 1 12 GLN C C -6.847 -9.073 0.421 1.00 . A A . 12 GLN C 1 1 9 5274 1 1 12 GLN CA C -5.583 -9.280 -0.416 1.00 . A A . 12 GLN CA 1 1 9 5275 1 1 12 GLN CB C -5.367 -10.773 -0.662 1.00 . A A . 12 GLN CB 1 1 9 5276 1 1 12 GLN CD C -4.477 -12.507 -2.269 1.00 . A A . 12 GLN CD 1 1 9 5277 1 1 12 GLN CG C -4.398 -11.069 -1.796 1.00 . A A . 12 GLN CG 1 1 9 5278 1 1 12 GLN H H -4.303 -8.785 1.198 1.00 . A A . 12 GLN H 1 1 9 5279 1 1 12 GLN HA H -5.714 -8.786 -1.367 1.00 . A A . 12 GLN HA 1 1 9 5280 1 1 12 GLN HB2 H -4.979 -11.221 0.241 1.00 . A A . 12 GLN HB2 1 1 9 5281 1 1 12 GLN HB3 H -6.317 -11.228 -0.901 1.00 . A A . 12 GLN HB3 1 1 9 5282 1 1 12 GLN HE21 H -5.211 -11.916 -4.020 1.00 . A A . 12 GLN HE21 1 1 9 5283 1 1 12 GLN HE22 H -5.008 -13.621 -3.828 1.00 . A A . 12 GLN HE22 1 1 9 5284 1 1 12 GLN HG2 H -4.628 -10.419 -2.627 1.00 . A A . 12 GLN HG2 1 1 9 5285 1 1 12 GLN HG3 H -3.393 -10.872 -1.453 1.00 . A A . 12 GLN HG3 1 1 9 5286 1 1 12 GLN N N -4.408 -8.703 0.227 1.00 . A A . 12 GLN N 1 1 9 5287 1 1 12 GLN NE2 N -4.946 -12.701 -3.496 1.00 . A A . 12 GLN NE2 1 1 9 5288 1 1 12 GLN O O -7.907 -9.600 0.085 1.00 . A A . 12 GLN O 1 1 9 5289 1 1 12 GLN OE1 O -4.121 -13.433 -1.541 1.00 . A A . 12 GLN OE1 1 1 9 5290 1 1 13 CYS C C -7.510 -7.136 3.540 1.00 . A A . 13 CYS C 1 1 9 5291 1 1 13 CYS CA C -7.884 -8.045 2.371 1.00 . A A . 13 CYS CA 1 1 9 5292 1 1 13 CYS CB C -8.459 -9.359 2.907 1.00 . A A . 13 CYS CB 1 1 9 5293 1 1 13 CYS H H -5.873 -7.907 1.727 1.00 . A A . 13 CYS H 1 1 9 5294 1 1 13 CYS HA H -8.637 -7.552 1.777 1.00 . A A . 13 CYS HA 1 1 9 5295 1 1 13 CYS HB2 H -8.678 -10.014 2.078 1.00 . A A . 13 CYS HB2 1 1 9 5296 1 1 13 CYS HB3 H -7.726 -9.829 3.547 1.00 . A A . 13 CYS HB3 1 1 9 5297 1 1 13 CYS N N -6.737 -8.306 1.506 1.00 . A A . 13 CYS N 1 1 9 5298 1 1 13 CYS O O -8.331 -6.344 4.002 1.00 . A A . 13 CYS O 1 1 9 5299 1 1 13 CYS SG S -9.991 -9.158 3.872 1.00 . A A . 13 CYS SG 1 1 9 5300 1 1 14 LYS C C -4.719 -5.480 4.710 1.00 . A A . 14 LYS C 1 1 9 5301 1 1 14 LYS CA C -5.818 -6.442 5.142 1.00 . A A . 14 LYS CA 1 1 9 5302 1 1 14 LYS CB C -5.311 -7.338 6.274 1.00 . A A . 14 LYS CB 1 1 9 5303 1 1 14 LYS CD C -4.211 -6.136 8.188 1.00 . A A . 14 LYS CD 1 1 9 5304 1 1 14 LYS CE C -4.351 -5.710 9.641 1.00 . A A . 14 LYS CE 1 1 9 5305 1 1 14 LYS CG C -5.503 -6.737 7.657 1.00 . A A . 14 LYS CG 1 1 9 5306 1 1 14 LYS H H -5.661 -7.904 3.621 1.00 . A A . 14 LYS H 1 1 9 5307 1 1 14 LYS HA H -6.660 -5.869 5.501 1.00 . A A . 14 LYS HA 1 1 9 5308 1 1 14 LYS HB2 H -5.840 -8.279 6.237 1.00 . A A . 14 LYS HB2 1 1 9 5309 1 1 14 LYS HB3 H -4.257 -7.522 6.127 1.00 . A A . 14 LYS HB3 1 1 9 5310 1 1 14 LYS HD2 H -3.425 -6.872 8.114 1.00 . A A . 14 LYS HD2 1 1 9 5311 1 1 14 LYS HD3 H -3.957 -5.272 7.592 1.00 . A A . 14 LYS HD3 1 1 9 5312 1 1 14 LYS HE2 H -4.923 -6.459 10.169 1.00 . A A . 14 LYS HE2 1 1 9 5313 1 1 14 LYS HE3 H -3.366 -5.637 10.078 1.00 . A A . 14 LYS HE3 1 1 9 5314 1 1 14 LYS HG2 H -6.253 -5.963 7.603 1.00 . A A . 14 LYS HG2 1 1 9 5315 1 1 14 LYS HG3 H -5.833 -7.513 8.333 1.00 . A A . 14 LYS HG3 1 1 9 5316 1 1 14 LYS HZ1 H -5.855 -4.354 9.127 1.00 . A A . 14 LYS HZ1 1 1 9 5317 1 1 14 LYS HZ2 H -5.375 -4.263 10.747 1.00 . A A . 14 LYS HZ2 1 1 9 5318 1 1 14 LYS HZ3 H -4.383 -3.624 9.535 1.00 . A A . 14 LYS HZ3 1 1 9 5319 1 1 14 LYS N N -6.276 -7.255 4.022 1.00 . A A . 14 LYS N 1 1 9 5320 1 1 14 LYS NZ N -5.039 -4.396 9.772 1.00 . A A . 14 LYS NZ 1 1 9 5321 1 1 14 LYS O O -4.047 -5.699 3.702 1.00 . A A . 14 LYS O 1 1 9 5322 1 1 15 LEU C C -2.136 -4.058 5.152 1.00 . A A . 15 LEU C 1 1 9 5323 1 1 15 LEU CA C -3.519 -3.418 5.188 1.00 . A A . 15 LEU CA 1 1 9 5324 1 1 15 LEU CB C -3.549 -2.302 6.234 1.00 . A A . 15 LEU CB 1 1 9 5325 1 1 15 LEU CD1 C -5.150 -1.559 8.019 1.00 . A A . 15 LEU CD1 1 1 9 5326 1 1 15 LEU CD2 C -5.113 -0.390 5.809 1.00 . A A . 15 LEU CD2 1 1 9 5327 1 1 15 LEU CG C -4.936 -1.722 6.521 1.00 . A A . 15 LEU CG 1 1 9 5328 1 1 15 LEU H H -5.105 -4.299 6.276 1.00 . A A . 15 LEU H 1 1 9 5329 1 1 15 LEU HA H -3.736 -2.998 4.218 1.00 . A A . 15 LEU HA 1 1 9 5330 1 1 15 LEU HB2 H -3.145 -2.693 7.157 1.00 . A A . 15 LEU HB2 1 1 9 5331 1 1 15 LEU HB3 H -2.911 -1.501 5.893 1.00 . A A . 15 LEU HB3 1 1 9 5332 1 1 15 LEU HD11 H -4.195 -1.426 8.506 1.00 . A A . 15 LEU HD11 1 1 9 5333 1 1 15 LEU HD12 H -5.771 -0.694 8.202 1.00 . A A . 15 LEU HD12 1 1 9 5334 1 1 15 LEU HD13 H -5.635 -2.440 8.411 1.00 . A A . 15 LEU HD13 1 1 9 5335 1 1 15 LEU HD21 H -4.154 0.099 5.719 1.00 . A A . 15 LEU HD21 1 1 9 5336 1 1 15 LEU HD22 H -5.524 -0.559 4.825 1.00 . A A . 15 LEU HD22 1 1 9 5337 1 1 15 LEU HD23 H -5.784 0.237 6.377 1.00 . A A . 15 LEU HD23 1 1 9 5338 1 1 15 LEU HG H -5.688 -2.402 6.150 1.00 . A A . 15 LEU HG 1 1 9 5339 1 1 15 LEU N N -4.539 -4.415 5.484 1.00 . A A . 15 LEU N 1 1 9 5340 1 1 15 LEU O O -1.738 -4.750 6.089 1.00 . A A . 15 LEU O 1 1 9 5341 1 1 16 LYS C C 0.839 -3.904 5.049 1.00 . A A . 16 LYS C 1 1 9 5342 1 1 16 LYS CA C -0.069 -4.380 3.917 1.00 . A A . 16 LYS CA 1 1 9 5343 1 1 16 LYS CB C 0.526 -3.979 2.565 1.00 . A A . 16 LYS CB 1 1 9 5344 1 1 16 LYS CD C 0.860 -4.886 0.246 1.00 . A A . 16 LYS CD 1 1 9 5345 1 1 16 LYS CE C 0.152 -4.979 -1.096 1.00 . A A . 16 LYS CE 1 1 9 5346 1 1 16 LYS CG C -0.127 -4.675 1.383 1.00 . A A . 16 LYS CG 1 1 9 5347 1 1 16 LYS H H -1.776 -3.263 3.353 1.00 . A A . 16 LYS H 1 1 9 5348 1 1 16 LYS HA H -0.153 -5.456 3.960 1.00 . A A . 16 LYS HA 1 1 9 5349 1 1 16 LYS HB2 H 0.410 -2.913 2.436 1.00 . A A . 16 LYS HB2 1 1 9 5350 1 1 16 LYS HB3 H 1.578 -4.221 2.562 1.00 . A A . 16 LYS HB3 1 1 9 5351 1 1 16 LYS HD2 H 1.549 -4.056 0.222 1.00 . A A . 16 LYS HD2 1 1 9 5352 1 1 16 LYS HD3 H 1.404 -5.803 0.421 1.00 . A A . 16 LYS HD3 1 1 9 5353 1 1 16 LYS HE2 H -0.824 -5.414 -0.945 1.00 . A A . 16 LYS HE2 1 1 9 5354 1 1 16 LYS HE3 H 0.043 -3.983 -1.500 1.00 . A A . 16 LYS HE3 1 1 9 5355 1 1 16 LYS HG2 H -0.501 -5.636 1.704 1.00 . A A . 16 LYS HG2 1 1 9 5356 1 1 16 LYS HG3 H -0.947 -4.068 1.028 1.00 . A A . 16 LYS HG3 1 1 9 5357 1 1 16 LYS HZ1 H 1.209 -6.704 -1.615 1.00 . A A . 16 LYS HZ1 1 1 9 5358 1 1 16 LYS HZ2 H 0.312 -6.042 -2.887 1.00 . A A . 16 LYS HZ2 1 1 9 5359 1 1 16 LYS HZ3 H 1.753 -5.305 -2.397 1.00 . A A . 16 LYS HZ3 1 1 9 5360 1 1 16 LYS N N -1.407 -3.824 4.067 1.00 . A A . 16 LYS N 1 1 9 5361 1 1 16 LYS NZ N 0.910 -5.816 -2.067 1.00 . A A . 16 LYS NZ 1 1 9 5362 1 1 16 LYS O O 0.748 -2.756 5.482 1.00 . A A . 16 LYS O 1 1 9 5363 1 1 17 PRO C C 3.460 -3.179 6.327 1.00 . A A . 17 PRO C 1 1 9 5364 1 1 17 PRO CA C 2.650 -4.434 6.632 1.00 . A A . 17 PRO CA 1 1 9 5365 1 1 17 PRO CB C 3.576 -5.657 6.737 1.00 . A A . 17 PRO CB 1 1 9 5366 1 1 17 PRO CD C 1.914 -6.163 5.094 1.00 . A A . 17 PRO CD 1 1 9 5367 1 1 17 PRO CG C 3.328 -6.454 5.499 1.00 . A A . 17 PRO CG 1 1 9 5368 1 1 17 PRO HA H 2.124 -4.299 7.566 1.00 . A A . 17 PRO HA 1 1 9 5369 1 1 17 PRO HB2 H 4.603 -5.327 6.792 1.00 . A A . 17 PRO HB2 1 1 9 5370 1 1 17 PRO HB3 H 3.328 -6.221 7.624 1.00 . A A . 17 PRO HB3 1 1 9 5371 1 1 17 PRO HD2 H 1.802 -6.241 4.022 1.00 . A A . 17 PRO HD2 1 1 9 5372 1 1 17 PRO HD3 H 1.229 -6.829 5.598 1.00 . A A . 17 PRO HD3 1 1 9 5373 1 1 17 PRO HG2 H 4.012 -6.147 4.722 1.00 . A A . 17 PRO HG2 1 1 9 5374 1 1 17 PRO HG3 H 3.449 -7.507 5.711 1.00 . A A . 17 PRO HG3 1 1 9 5375 1 1 17 PRO N N 1.729 -4.778 5.546 1.00 . A A . 17 PRO N 1 1 9 5376 1 1 17 PRO O O 4.153 -3.109 5.313 1.00 . A A . 17 PRO O 1 1 9 5377 1 1 18 ALA C C 5.536 -1.178 6.610 1.00 . A A . 18 ALA C 1 1 9 5378 1 1 18 ALA CA C 4.094 -0.931 7.042 1.00 . A A . 18 ALA CA 1 1 9 5379 1 1 18 ALA CB C 4.058 -0.124 8.331 1.00 . A A . 18 ALA CB 1 1 9 5380 1 1 18 ALA H H 2.798 -2.304 8.000 1.00 . A A . 18 ALA H 1 1 9 5381 1 1 18 ALA HA H 3.592 -0.360 6.274 1.00 . A A . 18 ALA HA 1 1 9 5382 1 1 18 ALA HB1 H 4.897 -0.402 8.952 1.00 . A A . 18 ALA HB1 1 1 9 5383 1 1 18 ALA HB2 H 4.117 0.929 8.098 1.00 . A A . 18 ALA HB2 1 1 9 5384 1 1 18 ALA HB3 H 3.137 -0.326 8.857 1.00 . A A . 18 ALA HB3 1 1 9 5385 1 1 18 ALA N N 3.368 -2.188 7.213 1.00 . A A . 18 ALA N 1 1 9 5386 1 1 18 ALA O O 6.061 -2.280 6.769 1.00 . A A . 18 ALA O 1 1 9 5387 1 1 19 GLY C C 7.672 -1.245 4.437 1.00 . A A . 19 GLY C 1 1 9 5388 1 1 19 GLY CA C 7.541 -0.285 5.605 1.00 . A A . 19 GLY CA 1 1 9 5389 1 1 19 GLY H H 5.701 0.703 5.949 1.00 . A A . 19 GLY H 1 1 9 5390 1 1 19 GLY HA2 H 8.145 -0.647 6.423 1.00 . A A . 19 GLY HA2 1 1 9 5391 1 1 19 GLY HA3 H 7.907 0.685 5.302 1.00 . A A . 19 GLY HA3 1 1 9 5392 1 1 19 GLY N N 6.170 -0.150 6.057 1.00 . A A . 19 GLY N 1 1 9 5393 1 1 19 GLY O O 8.763 -1.736 4.147 1.00 . A A . 19 GLY O 1 1 9 5394 1 1 20 THR C C 5.943 -1.730 1.402 1.00 . A A . 20 THR C 1 1 9 5395 1 1 20 THR CA C 6.545 -2.418 2.622 1.00 . A A . 20 THR CA 1 1 9 5396 1 1 20 THR CB C 5.747 -3.681 2.955 1.00 . A A . 20 THR CB 1 1 9 5397 1 1 20 THR CG2 C 5.678 -4.672 1.813 1.00 . A A . 20 THR CG2 1 1 9 5398 1 1 20 THR H H 5.716 -1.090 4.043 1.00 . A A . 20 THR H 1 1 9 5399 1 1 20 THR HA H 7.566 -2.692 2.402 1.00 . A A . 20 THR HA 1 1 9 5400 1 1 20 THR HB H 4.735 -3.398 3.207 1.00 . A A . 20 THR HB 1 1 9 5401 1 1 20 THR HG1 H 5.767 -5.108 4.297 1.00 . A A . 20 THR HG1 1 1 9 5402 1 1 20 THR HG21 H 5.905 -4.168 0.885 1.00 . A A . 20 THR HG21 1 1 9 5403 1 1 20 THR HG22 H 6.395 -5.463 1.978 1.00 . A A . 20 THR HG22 1 1 9 5404 1 1 20 THR HG23 H 4.684 -5.092 1.761 1.00 . A A . 20 THR HG23 1 1 9 5405 1 1 20 THR N N 6.555 -1.513 3.765 1.00 . A A . 20 THR N 1 1 9 5406 1 1 20 THR O O 4.849 -1.171 1.473 1.00 . A A . 20 THR O 1 1 9 5407 1 1 20 THR OG1 O 6.311 -4.350 4.070 1.00 . A A . 20 THR OG1 1 1 9 5408 1 1 21 THR C C 4.727 -1.478 -1.216 1.00 . A A . 21 THR C 1 1 9 5409 1 1 21 THR CA C 6.195 -1.147 -0.953 1.00 . A A . 21 THR CA 1 1 9 5410 1 1 21 THR CB C 7.055 -1.597 -2.134 1.00 . A A . 21 THR CB 1 1 9 5411 1 1 21 THR CG2 C 6.846 -3.045 -2.503 1.00 . A A . 21 THR CG2 1 1 9 5412 1 1 21 THR H H 7.528 -2.231 0.288 1.00 . A A . 21 THR H 1 1 9 5413 1 1 21 THR HA H 6.294 -0.081 -0.839 1.00 . A A . 21 THR HA 1 1 9 5414 1 1 21 THR HB H 8.096 -1.468 -1.877 1.00 . A A . 21 THR HB 1 1 9 5415 1 1 21 THR HG1 H 5.830 -0.716 -3.383 1.00 . A A . 21 THR HG1 1 1 9 5416 1 1 21 THR HG21 H 6.372 -3.558 -1.679 1.00 . A A . 21 THR HG21 1 1 9 5417 1 1 21 THR HG22 H 6.215 -3.105 -3.377 1.00 . A A . 21 THR HG22 1 1 9 5418 1 1 21 THR HG23 H 7.800 -3.504 -2.712 1.00 . A A . 21 THR HG23 1 1 9 5419 1 1 21 THR N N 6.662 -1.772 0.282 1.00 . A A . 21 THR N 1 1 9 5420 1 1 21 THR O O 4.366 -2.638 -1.417 1.00 . A A . 21 THR O 1 1 9 5421 1 1 21 THR OG1 O 6.780 -0.815 -3.282 1.00 . A A . 21 THR OG1 1 1 9 5422 1 1 22 CYS C C 2.125 -0.654 -2.915 1.00 . A A . 22 CYS C 1 1 9 5423 1 1 22 CYS CA C 2.458 -0.632 -1.425 1.00 . A A . 22 CYS CA 1 1 9 5424 1 1 22 CYS CB C 1.670 0.476 -0.721 1.00 . A A . 22 CYS CB 1 1 9 5425 1 1 22 CYS H H 4.231 0.448 -1.027 1.00 . A A . 22 CYS H 1 1 9 5426 1 1 22 CYS HA H 2.176 -1.580 -0.997 1.00 . A A . 22 CYS HA 1 1 9 5427 1 1 22 CYS HB2 H 0.641 0.171 -0.632 1.00 . A A . 22 CYS HB2 1 1 9 5428 1 1 22 CYS HB3 H 2.080 0.624 0.268 1.00 . A A . 22 CYS HB3 1 1 9 5429 1 1 22 CYS N N 3.885 -0.452 -1.201 1.00 . A A . 22 CYS N 1 1 9 5430 1 1 22 CYS O O 1.286 -1.437 -3.360 1.00 . A A . 22 CYS O 1 1 9 5431 1 1 22 CYS SG S 1.690 2.086 -1.574 1.00 . A A . 22 CYS SG 1 1 9 5432 1 1 23 TRP C C 3.615 -0.436 -5.907 1.00 . A A . 23 TRP C 1 1 9 5433 1 1 23 TRP CA C 2.535 0.290 -5.115 1.00 . A A . 23 TRP CA 1 1 9 5434 1 1 23 TRP CB C 2.446 1.750 -5.566 1.00 . A A . 23 TRP CB 1 1 9 5435 1 1 23 TRP CD1 C 0.744 1.020 -7.334 1.00 . A A . 23 TRP CD1 1 1 9 5436 1 1 23 TRP CD2 C 0.951 3.238 -7.120 1.00 . A A . 23 TRP CD2 1 1 9 5437 1 1 23 TRP CE2 C -0.008 2.970 -8.115 1.00 . A A . 23 TRP CE2 1 1 9 5438 1 1 23 TRP CE3 C 1.249 4.568 -6.813 1.00 . A A . 23 TRP CE3 1 1 9 5439 1 1 23 TRP CG C 1.419 1.977 -6.632 1.00 . A A . 23 TRP CG 1 1 9 5440 1 1 23 TRP CH2 C -0.360 5.275 -8.480 1.00 . A A . 23 TRP CH2 1 1 9 5441 1 1 23 TRP CZ2 C -0.671 3.982 -8.802 1.00 . A A . 23 TRP CZ2 1 1 9 5442 1 1 23 TRP CZ3 C 0.591 5.573 -7.496 1.00 . A A . 23 TRP CZ3 1 1 9 5443 1 1 23 TRP H H 3.432 0.819 -3.271 1.00 . A A . 23 TRP H 1 1 9 5444 1 1 23 TRP HA H 1.591 -0.188 -5.311 1.00 . A A . 23 TRP HA 1 1 9 5445 1 1 23 TRP HB2 H 2.188 2.367 -4.718 1.00 . A A . 23 TRP HB2 1 1 9 5446 1 1 23 TRP HB3 H 3.404 2.062 -5.953 1.00 . A A . 23 TRP HB3 1 1 9 5447 1 1 23 TRP HD1 H 0.879 -0.042 -7.195 1.00 . A A . 23 TRP HD1 1 1 9 5448 1 1 23 TRP HE1 H -0.711 1.133 -8.843 1.00 . A A . 23 TRP HE1 1 1 9 5449 1 1 23 TRP HE3 H 1.979 4.816 -6.057 1.00 . A A . 23 TRP HE3 1 1 9 5450 1 1 23 TRP HH2 H -0.849 6.091 -8.990 1.00 . A A . 23 TRP HH2 1 1 9 5451 1 1 23 TRP HZ2 H -1.407 3.769 -9.561 1.00 . A A . 23 TRP HZ2 1 1 9 5452 1 1 23 TRP HZ3 H 0.808 6.607 -7.272 1.00 . A A . 23 TRP HZ3 1 1 9 5453 1 1 23 TRP N N 2.778 0.214 -3.680 1.00 . A A . 23 TRP N 1 1 9 5454 1 1 23 TRP NE1 N -0.116 1.609 -8.227 1.00 . A A . 23 TRP NE1 1 1 9 5455 1 1 23 TRP O O 3.381 -1.516 -6.448 1.00 . A A . 23 TRP O 1 1 9 5456 1 1 24 LYS C C 5.518 -0.696 -8.164 1.00 . A A . 24 LYS C 1 1 9 5457 1 1 24 LYS CA C 5.909 -0.421 -6.713 1.00 . A A . 24 LYS CA 1 1 9 5458 1 1 24 LYS CB C 6.363 -1.716 -6.037 1.00 . A A . 24 LYS CB 1 1 9 5459 1 1 24 LYS CD C 8.306 -3.233 -5.550 1.00 . A A . 24 LYS CD 1 1 9 5460 1 1 24 LYS CE C 8.426 -4.054 -6.824 1.00 . A A . 24 LYS CE 1 1 9 5461 1 1 24 LYS CG C 7.868 -1.808 -5.846 1.00 . A A . 24 LYS CG 1 1 9 5462 1 1 24 LYS H H 4.917 1.026 -5.529 1.00 . A A . 24 LYS H 1 1 9 5463 1 1 24 LYS HA H 6.724 0.286 -6.700 1.00 . A A . 24 LYS HA 1 1 9 5464 1 1 24 LYS HB2 H 5.893 -1.784 -5.068 1.00 . A A . 24 LYS HB2 1 1 9 5465 1 1 24 LYS HB3 H 6.046 -2.555 -6.640 1.00 . A A . 24 LYS HB3 1 1 9 5466 1 1 24 LYS HD2 H 9.266 -3.210 -5.058 1.00 . A A . 24 LYS HD2 1 1 9 5467 1 1 24 LYS HD3 H 7.577 -3.696 -4.901 1.00 . A A . 24 LYS HD3 1 1 9 5468 1 1 24 LYS HE2 H 8.294 -5.097 -6.579 1.00 . A A . 24 LYS HE2 1 1 9 5469 1 1 24 LYS HE3 H 7.651 -3.746 -7.510 1.00 . A A . 24 LYS HE3 1 1 9 5470 1 1 24 LYS HG2 H 8.357 -1.472 -6.748 1.00 . A A . 24 LYS HG2 1 1 9 5471 1 1 24 LYS HG3 H 8.155 -1.174 -5.020 1.00 . A A . 24 LYS HG3 1 1 9 5472 1 1 24 LYS HZ1 H 10.508 -3.904 -6.764 1.00 . A A . 24 LYS HZ1 1 1 9 5473 1 1 24 LYS HZ2 H 9.914 -4.634 -8.171 1.00 . A A . 24 LYS HZ2 1 1 9 5474 1 1 24 LYS HZ3 H 9.788 -2.959 -7.968 1.00 . A A . 24 LYS HZ3 1 1 9 5475 1 1 24 LYS N N 4.795 0.166 -5.978 1.00 . A A . 24 LYS N 1 1 9 5476 1 1 24 LYS NZ N 9.752 -3.875 -7.477 1.00 . A A . 24 LYS NZ 1 1 9 5477 1 1 24 LYS O O 6.055 -1.604 -8.800 1.00 . A A . 24 LYS O 1 1 9 5478 1 1 25 THR C C 5.269 0.032 -11.041 1.00 . A A . 25 THR C 1 1 9 5479 1 1 25 THR CA C 4.111 -0.064 -10.053 1.00 . A A . 25 THR CA 1 1 9 5480 1 1 25 THR CB C 3.060 0.999 -10.379 1.00 . A A . 25 THR CB 1 1 9 5481 1 1 25 THR CG2 C 3.510 2.406 -10.051 1.00 . A A . 25 THR CG2 1 1 9 5482 1 1 25 THR H H 4.189 0.797 -8.121 1.00 . A A . 25 THR H 1 1 9 5483 1 1 25 THR HA H 3.660 -1.041 -10.142 1.00 . A A . 25 THR HA 1 1 9 5484 1 1 25 THR HB H 2.167 0.796 -9.805 1.00 . A A . 25 THR HB 1 1 9 5485 1 1 25 THR HG1 H 1.840 1.324 -11.876 1.00 . A A . 25 THR HG1 1 1 9 5486 1 1 25 THR HG21 H 4.481 2.373 -9.580 1.00 . A A . 25 THR HG21 1 1 9 5487 1 1 25 THR HG22 H 3.571 2.986 -10.960 1.00 . A A . 25 THR HG22 1 1 9 5488 1 1 25 THR HG23 H 2.799 2.864 -9.379 1.00 . A A . 25 THR HG23 1 1 9 5489 1 1 25 THR N N 4.579 0.093 -8.679 1.00 . A A . 25 THR N 1 1 9 5490 1 1 25 THR O O 6.401 0.331 -10.660 1.00 . A A . 25 THR O 1 1 9 5491 1 1 25 THR OG1 O 2.722 0.966 -11.754 1.00 . A A . 25 THR OG1 1 1 9 5492 1 1 26 SER C C 6.214 1.276 -13.824 1.00 . A A . 26 SER C 1 1 9 5493 1 1 26 SER CA C 5.993 -0.162 -13.360 1.00 . A A . 26 SER CA 1 1 9 5494 1 1 26 SER CB C 5.583 -1.039 -14.545 1.00 . A A . 26 SER CB 1 1 9 5495 1 1 26 SER H H 4.056 -0.453 -12.553 1.00 . A A . 26 SER H 1 1 9 5496 1 1 26 SER HA H 6.916 -0.540 -12.946 1.00 . A A . 26 SER HA 1 1 9 5497 1 1 26 SER HB2 H 4.728 -0.600 -15.037 1.00 . A A . 26 SER HB2 1 1 9 5498 1 1 26 SER HB3 H 6.405 -1.104 -15.243 1.00 . A A . 26 SER HB3 1 1 9 5499 1 1 26 SER HG H 4.564 -2.705 -14.697 1.00 . A A . 26 SER HG 1 1 9 5500 1 1 26 SER N N 4.977 -0.221 -12.313 1.00 . A A . 26 SER N 1 1 9 5501 1 1 26 SER O O 6.092 1.584 -15.009 1.00 . A A . 26 SER O 1 1 9 5502 1 1 26 SER OG O 5.242 -2.347 -14.120 1.00 . A A . 26 SER OG 1 1 9 5503 1 1 27 VAL C C 7.048 4.332 -11.884 1.00 . A A . 27 VAL C 1 1 9 5504 1 1 27 VAL CA C 6.784 3.557 -13.170 1.00 . A A . 27 VAL CA 1 1 9 5505 1 1 27 VAL CB C 5.591 4.197 -13.910 1.00 . A A . 27 VAL CB 1 1 9 5506 1 1 27 VAL CG1 C 4.326 4.103 -13.071 1.00 . A A . 27 VAL CG1 1 1 9 5507 1 1 27 VAL CG2 C 5.895 5.645 -14.268 1.00 . A A . 27 VAL CG2 1 1 9 5508 1 1 27 VAL H H 6.625 1.837 -11.952 1.00 . A A . 27 VAL H 1 1 9 5509 1 1 27 VAL HA H 7.656 3.622 -13.804 1.00 . A A . 27 VAL HA 1 1 9 5510 1 1 27 VAL HB H 5.427 3.651 -14.827 1.00 . A A . 27 VAL HB 1 1 9 5511 1 1 27 VAL HG11 H 4.480 4.607 -12.129 1.00 . A A . 27 VAL HG11 1 1 9 5512 1 1 27 VAL HG12 H 3.508 4.570 -13.599 1.00 . A A . 27 VAL HG12 1 1 9 5513 1 1 27 VAL HG13 H 4.091 3.064 -12.890 1.00 . A A . 27 VAL HG13 1 1 9 5514 1 1 27 VAL HG21 H 6.941 5.741 -14.522 1.00 . A A . 27 VAL HG21 1 1 9 5515 1 1 27 VAL HG22 H 5.291 5.942 -15.112 1.00 . A A . 27 VAL HG22 1 1 9 5516 1 1 27 VAL HG23 H 5.671 6.279 -13.423 1.00 . A A . 27 VAL HG23 1 1 9 5517 1 1 27 VAL N N 6.542 2.149 -12.876 1.00 . A A . 27 VAL N 1 1 9 5518 1 1 27 VAL O O 7.882 5.236 -11.847 1.00 . A A . 27 VAL O 1 1 9 5519 1 1 28 SER C C 6.703 3.569 -8.439 1.00 . A A . 28 SER C 1 1 9 5520 1 1 28 SER CA C 6.476 4.609 -9.532 1.00 . A A . 28 SER CA 1 1 9 5521 1 1 28 SER CB C 5.234 5.442 -9.210 1.00 . A A . 28 SER CB 1 1 9 5522 1 1 28 SER H H 5.684 3.232 -10.927 1.00 . A A . 28 SER H 1 1 9 5523 1 1 28 SER HA H 7.336 5.260 -9.579 1.00 . A A . 28 SER HA 1 1 9 5524 1 1 28 SER HB2 H 4.354 4.822 -9.300 1.00 . A A . 28 SER HB2 1 1 9 5525 1 1 28 SER HB3 H 5.307 5.818 -8.201 1.00 . A A . 28 SER HB3 1 1 9 5526 1 1 28 SER HG H 5.934 7.032 -10.115 1.00 . A A . 28 SER HG 1 1 9 5527 1 1 28 SER N N 6.329 3.962 -10.830 1.00 . A A . 28 SER N 1 1 9 5528 1 1 28 SER O O 6.803 2.374 -8.718 1.00 . A A . 28 SER O 1 1 9 5529 1 1 28 SER OG O 5.111 6.539 -10.099 1.00 . A A . 28 SER OG 1 1 9 5530 1 1 29 SER C C 6.703 3.838 -4.747 1.00 . A A . 29 SER C 1 1 9 5531 1 1 29 SER CA C 6.994 3.131 -6.065 1.00 . A A . 29 SER CA 1 1 9 5532 1 1 29 SER CB C 8.430 2.603 -6.069 1.00 . A A . 29 SER CB 1 1 9 5533 1 1 29 SER H H 6.693 4.990 -7.033 1.00 . A A . 29 SER H 1 1 9 5534 1 1 29 SER HA H 6.313 2.300 -6.171 1.00 . A A . 29 SER HA 1 1 9 5535 1 1 29 SER HB2 H 8.710 2.323 -5.065 1.00 . A A . 29 SER HB2 1 1 9 5536 1 1 29 SER HB3 H 8.491 1.739 -6.714 1.00 . A A . 29 SER HB3 1 1 9 5537 1 1 29 SER HG H 9.720 4.050 -5.789 1.00 . A A . 29 SER HG 1 1 9 5538 1 1 29 SER N N 6.781 4.028 -7.195 1.00 . A A . 29 SER N 1 1 9 5539 1 1 29 SER O O 7.214 4.928 -4.488 1.00 . A A . 29 SER O 1 1 9 5540 1 1 29 SER OG O 9.335 3.587 -6.537 1.00 . A A . 29 SER OG 1 1 9 5541 1 1 30 HIS C C 5.518 2.701 -1.548 1.00 . A A . 30 HIS C 1 1 9 5542 1 1 30 HIS CA C 5.513 3.778 -2.625 1.00 . A A . 30 HIS CA 1 1 9 5543 1 1 30 HIS CB C 4.132 4.432 -2.702 1.00 . A A . 30 HIS CB 1 1 9 5544 1 1 30 HIS CD2 C 4.192 5.352 -5.126 1.00 . A A . 30 HIS CD2 1 1 9 5545 1 1 30 HIS CE1 C 3.651 7.432 -4.693 1.00 . A A . 30 HIS CE1 1 1 9 5546 1 1 30 HIS CG C 4.015 5.456 -3.787 1.00 . A A . 30 HIS CG 1 1 9 5547 1 1 30 HIS H H 5.501 2.343 -4.181 1.00 . A A . 30 HIS H 1 1 9 5548 1 1 30 HIS HA H 6.246 4.529 -2.372 1.00 . A A . 30 HIS HA 1 1 9 5549 1 1 30 HIS HB2 H 3.390 3.669 -2.886 1.00 . A A . 30 HIS HB2 1 1 9 5550 1 1 30 HIS HB3 H 3.918 4.917 -1.761 1.00 . A A . 30 HIS HB3 1 1 9 5551 1 1 30 HIS HD1 H 3.486 7.163 -2.671 1.00 . A A . 30 HIS HD1 1 1 9 5552 1 1 30 HIS HD2 H 4.465 4.458 -5.668 1.00 . A A . 30 HIS HD2 1 1 9 5553 1 1 30 HIS HE1 H 3.417 8.479 -4.813 1.00 . A A . 30 HIS HE1 1 1 9 5554 1 1 30 HIS HE2 H 4.100 6.843 -6.602 1.00 . A A . 30 HIS HE2 1 1 9 5555 1 1 30 HIS N N 5.876 3.210 -3.918 1.00 . A A . 30 HIS N 1 1 9 5556 1 1 30 HIS ND1 N 3.678 6.772 -3.548 1.00 . A A . 30 HIS ND1 1 1 9 5557 1 1 30 HIS NE2 N 3.960 6.594 -5.664 1.00 . A A . 30 HIS NE2 1 1 9 5558 1 1 30 HIS O O 5.312 1.525 -1.839 1.00 . A A . 30 HIS O 1 1 9 5559 1 1 31 TYR C C 4.550 2.308 1.685 1.00 . A A . 31 TYR C 1 1 9 5560 1 1 31 TYR CA C 5.793 2.169 0.812 1.00 . A A . 31 TYR CA 1 1 9 5561 1 1 31 TYR CB C 7.053 2.393 1.652 1.00 . A A . 31 TYR CB 1 1 9 5562 1 1 31 TYR CD1 C 8.894 0.875 2.480 1.00 . A A . 31 TYR CD1 1 1 9 5563 1 1 31 TYR CD2 C 8.380 0.852 0.152 1.00 . A A . 31 TYR CD2 1 1 9 5564 1 1 31 TYR CE1 C 9.878 -0.074 2.276 1.00 . A A . 31 TYR CE1 1 1 9 5565 1 1 31 TYR CE2 C 9.362 -0.097 -0.060 1.00 . A A . 31 TYR CE2 1 1 9 5566 1 1 31 TYR CG C 8.129 1.354 1.423 1.00 . A A . 31 TYR CG 1 1 9 5567 1 1 31 TYR CZ C 10.108 -0.557 1.005 1.00 . A A . 31 TYR CZ 1 1 9 5568 1 1 31 TYR H H 5.918 4.059 -0.135 1.00 . A A . 31 TYR H 1 1 9 5569 1 1 31 TYR HA H 5.818 1.171 0.405 1.00 . A A . 31 TYR HA 1 1 9 5570 1 1 31 TYR HB2 H 7.470 3.359 1.411 1.00 . A A . 31 TYR HB2 1 1 9 5571 1 1 31 TYR HB3 H 6.789 2.372 2.700 1.00 . A A . 31 TYR HB3 1 1 9 5572 1 1 31 TYR HD1 H 8.712 1.255 3.474 1.00 . A A . 31 TYR HD1 1 1 9 5573 1 1 31 TYR HD2 H 7.795 1.215 -0.680 1.00 . A A . 31 TYR HD2 1 1 9 5574 1 1 31 TYR HE1 H 10.462 -0.434 3.110 1.00 . A A . 31 TYR HE1 1 1 9 5575 1 1 31 TYR HE2 H 9.541 -0.476 -1.056 1.00 . A A . 31 TYR HE2 1 1 9 5576 1 1 31 TYR HH H 11.880 -1.074 0.469 1.00 . A A . 31 TYR HH 1 1 9 5577 1 1 31 TYR N N 5.758 3.107 -0.305 1.00 . A A . 31 TYR N 1 1 9 5578 1 1 31 TYR O O 4.175 3.414 2.075 1.00 . A A . 31 TYR O 1 1 9 5579 1 1 31 TYR OH O 11.086 -1.502 0.798 1.00 . A A . 31 TYR OH 1 1 9 5580 1 1 32 CYS C C 3.072 1.497 4.268 1.00 . A A . 32 CYS C 1 1 9 5581 1 1 32 CYS CA C 2.720 1.181 2.821 1.00 . A A . 32 CYS CA 1 1 9 5582 1 1 32 CYS CB C 2.010 -0.173 2.743 1.00 . A A . 32 CYS CB 1 1 9 5583 1 1 32 CYS H H 4.262 0.325 1.655 1.00 . A A . 32 CYS H 1 1 9 5584 1 1 32 CYS HA H 2.059 1.948 2.448 1.00 . A A . 32 CYS HA 1 1 9 5585 1 1 32 CYS HB2 H 2.209 -0.621 1.782 1.00 . A A . 32 CYS HB2 1 1 9 5586 1 1 32 CYS HB3 H 2.395 -0.816 3.521 1.00 . A A . 32 CYS HB3 1 1 9 5587 1 1 32 CYS N N 3.916 1.179 1.991 1.00 . A A . 32 CYS N 1 1 9 5588 1 1 32 CYS O O 4.154 1.153 4.744 1.00 . A A . 32 CYS O 1 1 9 5589 1 1 32 CYS SG S 0.201 -0.080 2.947 1.00 . A A . 32 CYS SG 1 1 9 5590 1 1 33 THR C C 1.565 1.571 7.273 1.00 . A A . 33 THR C 1 1 9 5591 1 1 33 THR CA C 2.359 2.500 6.361 1.00 . A A . 33 THR CA 1 1 9 5592 1 1 33 THR CB C 1.947 3.953 6.610 1.00 . A A . 33 THR CB 1 1 9 5593 1 1 33 THR CG2 C 2.415 4.903 5.528 1.00 . A A . 33 THR CG2 1 1 9 5594 1 1 33 THR H H 1.305 2.386 4.532 1.00 . A A . 33 THR H 1 1 9 5595 1 1 33 THR HA H 3.410 2.389 6.579 1.00 . A A . 33 THR HA 1 1 9 5596 1 1 33 THR HB H 2.375 4.282 7.546 1.00 . A A . 33 THR HB 1 1 9 5597 1 1 33 THR HG1 H 0.274 4.046 7.624 1.00 . A A . 33 THR HG1 1 1 9 5598 1 1 33 THR HG21 H 3.470 4.758 5.353 1.00 . A A . 33 THR HG21 1 1 9 5599 1 1 33 THR HG22 H 1.869 4.707 4.616 1.00 . A A . 33 THR HG22 1 1 9 5600 1 1 33 THR HG23 H 2.238 5.921 5.841 1.00 . A A . 33 THR HG23 1 1 9 5601 1 1 33 THR N N 2.150 2.146 4.965 1.00 . A A . 33 THR N 1 1 9 5602 1 1 33 THR O O 1.352 1.872 8.447 1.00 . A A . 33 THR O 1 1 9 5603 1 1 33 THR OG1 O 0.538 4.066 6.701 1.00 . A A . 33 THR OG1 1 1 9 5604 1 1 34 GLY C C -0.726 0.131 8.336 1.00 . A A . 34 GLY C 1 1 9 5605 1 1 34 GLY CA C 0.359 -0.523 7.499 1.00 . A A . 34 GLY CA 1 1 9 5606 1 1 34 GLY H H 1.331 0.250 5.779 1.00 . A A . 34 GLY H 1 1 9 5607 1 1 34 GLY HA2 H 1.030 -1.058 8.155 1.00 . A A . 34 GLY HA2 1 1 9 5608 1 1 34 GLY HA3 H -0.103 -1.227 6.823 1.00 . A A . 34 GLY HA3 1 1 9 5609 1 1 34 GLY N N 1.128 0.437 6.723 1.00 . A A . 34 GLY N 1 1 9 5610 1 1 34 GLY O O -0.821 -0.112 9.539 1.00 . A A . 34 GLY O 1 1 9 5611 1 1 35 ARG C C -3.830 1.866 7.497 1.00 . A A . 35 ARG C 1 1 9 5612 1 1 35 ARG CA C -2.620 1.657 8.401 1.00 . A A . 35 ARG CA 1 1 9 5613 1 1 35 ARG CB C -2.127 3.005 8.930 1.00 . A A . 35 ARG CB 1 1 9 5614 1 1 35 ARG CD C -2.713 4.964 10.390 1.00 . A A . 35 ARG CD 1 1 9 5615 1 1 35 ARG CG C -2.844 3.463 10.190 1.00 . A A . 35 ARG CG 1 1 9 5616 1 1 35 ARG CZ C -3.592 5.321 12.665 1.00 . A A . 35 ARG CZ 1 1 9 5617 1 1 35 ARG H H -1.417 1.122 6.741 1.00 . A A . 35 ARG H 1 1 9 5618 1 1 35 ARG HA H -2.915 1.043 9.235 1.00 . A A . 35 ARG HA 1 1 9 5619 1 1 35 ARG HB2 H -1.072 2.929 9.150 1.00 . A A . 35 ARG HB2 1 1 9 5620 1 1 35 ARG HB3 H -2.273 3.754 8.166 1.00 . A A . 35 ARG HB3 1 1 9 5621 1 1 35 ARG HD2 H -1.839 5.311 9.858 1.00 . A A . 35 ARG HD2 1 1 9 5622 1 1 35 ARG HD3 H -3.592 5.446 9.990 1.00 . A A . 35 ARG HD3 1 1 9 5623 1 1 35 ARG HE H -1.687 5.567 12.123 1.00 . A A . 35 ARG HE 1 1 9 5624 1 1 35 ARG HG2 H -3.891 3.212 10.108 1.00 . A A . 35 ARG HG2 1 1 9 5625 1 1 35 ARG HG3 H -2.415 2.956 11.041 1.00 . A A . 35 ARG HG3 1 1 9 5626 1 1 35 ARG HH11 H -4.978 4.736 11.312 1.00 . A A . 35 ARG HH11 1 1 9 5627 1 1 35 ARG HH12 H -5.571 4.994 12.919 1.00 . A A . 35 ARG HH12 1 1 9 5628 1 1 35 ARG HH21 H -2.465 5.906 14.237 1.00 . A A . 35 ARG HH21 1 1 9 5629 1 1 35 ARG HH22 H -4.144 5.658 14.579 1.00 . A A . 35 ARG HH22 1 1 9 5630 1 1 35 ARG N N -1.543 0.966 7.700 1.00 . A A . 35 ARG N 1 1 9 5631 1 1 35 ARG NE N -2.579 5.318 11.801 1.00 . A A . 35 ARG NE 1 1 9 5632 1 1 35 ARG NH1 N -4.814 4.990 12.265 1.00 . A A . 35 ARG NH1 1 1 9 5633 1 1 35 ARG NH2 N -3.383 5.656 13.930 1.00 . A A . 35 ARG NH2 1 1 9 5634 1 1 35 ARG O O -4.970 1.657 7.913 1.00 . A A . 35 ARG O 1 1 9 5635 1 1 36 SER C C -4.361 1.855 3.967 1.00 . A A . 36 SER C 1 1 9 5636 1 1 36 SER CA C -4.653 2.526 5.306 1.00 . A A . 36 SER CA 1 1 9 5637 1 1 36 SER CB C -4.852 4.029 5.101 1.00 . A A . 36 SER CB 1 1 9 5638 1 1 36 SER H H -2.649 2.436 5.991 1.00 . A A . 36 SER H 1 1 9 5639 1 1 36 SER HA H -5.560 2.106 5.714 1.00 . A A . 36 SER HA 1 1 9 5640 1 1 36 SER HB2 H -5.043 4.498 6.055 1.00 . A A . 36 SER HB2 1 1 9 5641 1 1 36 SER HB3 H -3.959 4.452 4.665 1.00 . A A . 36 SER HB3 1 1 9 5642 1 1 36 SER HG H -6.731 4.467 4.764 1.00 . A A . 36 SER HG 1 1 9 5643 1 1 36 SER N N -3.578 2.284 6.263 1.00 . A A . 36 SER N 1 1 9 5644 1 1 36 SER O O -3.208 1.580 3.638 1.00 . A A . 36 SER O 1 1 9 5645 1 1 36 SER OG O -5.947 4.287 4.240 1.00 . A A . 36 SER OG 1 1 9 5646 1 1 37 CYS C C -4.793 1.960 0.841 1.00 . A A . 37 CYS C 1 1 9 5647 1 1 37 CYS CA C -5.278 0.963 1.893 1.00 . A A . 37 CYS CA 1 1 9 5648 1 1 37 CYS CB C -6.612 0.356 1.457 1.00 . A A . 37 CYS CB 1 1 9 5649 1 1 37 CYS H H -6.310 1.844 3.515 1.00 . A A . 37 CYS H 1 1 9 5650 1 1 37 CYS HA H -4.548 0.173 1.986 1.00 . A A . 37 CYS HA 1 1 9 5651 1 1 37 CYS HB2 H -7.270 0.302 2.310 1.00 . A A . 37 CYS HB2 1 1 9 5652 1 1 37 CYS HB3 H -7.058 0.989 0.704 1.00 . A A . 37 CYS HB3 1 1 9 5653 1 1 37 CYS N N -5.416 1.598 3.198 1.00 . A A . 37 CYS N 1 1 9 5654 1 1 37 CYS O O -4.496 1.582 -0.291 1.00 . A A . 37 CYS O 1 1 9 5655 1 1 37 CYS SG S -6.475 -1.320 0.759 1.00 . A A . 37 CYS SG 1 1 9 5656 1 1 38 GLU C C -2.748 4.308 0.215 1.00 . A A . 38 GLU C 1 1 9 5657 1 1 38 GLU CA C -4.271 4.276 0.302 1.00 . A A . 38 GLU CA 1 1 9 5658 1 1 38 GLU CB C -4.796 5.641 0.753 1.00 . A A . 38 GLU CB 1 1 9 5659 1 1 38 GLU CD C -6.826 6.992 1.412 1.00 . A A . 38 GLU CD 1 1 9 5660 1 1 38 GLU CG C -6.311 5.759 0.697 1.00 . A A . 38 GLU CG 1 1 9 5661 1 1 38 GLU H H -4.972 3.479 2.134 1.00 . A A . 38 GLU H 1 1 9 5662 1 1 38 GLU HA H -4.671 4.052 -0.675 1.00 . A A . 38 GLU HA 1 1 9 5663 1 1 38 GLU HB2 H -4.481 5.817 1.770 1.00 . A A . 38 GLU HB2 1 1 9 5664 1 1 38 GLU HB3 H -4.373 6.404 0.117 1.00 . A A . 38 GLU HB3 1 1 9 5665 1 1 38 GLU HG2 H -6.617 5.807 -0.338 1.00 . A A . 38 GLU HG2 1 1 9 5666 1 1 38 GLU HG3 H -6.744 4.884 1.159 1.00 . A A . 38 GLU HG3 1 1 9 5667 1 1 38 GLU N N -4.719 3.234 1.219 1.00 . A A . 38 GLU N 1 1 9 5668 1 1 38 GLU O O -2.056 3.885 1.141 1.00 . A A . 38 GLU O 1 1 9 5669 1 1 38 GLU OE1 O -6.034 7.937 1.612 1.00 . A A . 38 GLU OE1 1 1 9 5670 1 1 38 GLU OE2 O -8.022 7.014 1.771 1.00 . A A . 38 GLU OE2 1 1 9 5671 1 1 39 CYS C C -0.341 6.355 -1.215 1.00 . A A . 39 CYS C 1 1 9 5672 1 1 39 CYS CA C -0.791 4.898 -1.109 1.00 . A A . 39 CYS CA 1 1 9 5673 1 1 39 CYS CB C -0.389 4.138 -2.375 1.00 . A A . 39 CYS CB 1 1 9 5674 1 1 39 CYS H H -2.836 5.133 -1.604 1.00 . A A . 39 CYS H 1 1 9 5675 1 1 39 CYS HA H -0.309 4.442 -0.258 1.00 . A A . 39 CYS HA 1 1 9 5676 1 1 39 CYS HB2 H -1.130 4.310 -3.141 1.00 . A A . 39 CYS HB2 1 1 9 5677 1 1 39 CYS HB3 H 0.567 4.505 -2.717 1.00 . A A . 39 CYS HB3 1 1 9 5678 1 1 39 CYS N N -2.233 4.812 -0.902 1.00 . A A . 39 CYS N 1 1 9 5679 1 1 39 CYS O O -0.957 7.150 -1.925 1.00 . A A . 39 CYS O 1 1 9 5680 1 1 39 CYS SG S -0.240 2.339 -2.147 1.00 . A A . 39 CYS SG 1 1 9 5681 1 1 40 PRO C C 1.556 8.573 -1.961 1.00 . A A . 40 PRO C 1 1 9 5682 1 1 40 PRO CA C 1.268 8.098 -0.542 1.00 . A A . 40 PRO CA 1 1 9 5683 1 1 40 PRO CB C 2.567 8.007 0.263 1.00 . A A . 40 PRO CB 1 1 9 5684 1 1 40 PRO CD C 1.547 5.850 0.360 1.00 . A A . 40 PRO CD 1 1 9 5685 1 1 40 PRO CG C 2.391 6.817 1.140 1.00 . A A . 40 PRO CG 1 1 9 5686 1 1 40 PRO HA H 0.591 8.791 -0.063 1.00 . A A . 40 PRO HA 1 1 9 5687 1 1 40 PRO HB2 H 3.403 7.882 -0.410 1.00 . A A . 40 PRO HB2 1 1 9 5688 1 1 40 PRO HB3 H 2.698 8.908 0.844 1.00 . A A . 40 PRO HB3 1 1 9 5689 1 1 40 PRO HD2 H 2.171 5.190 -0.225 1.00 . A A . 40 PRO HD2 1 1 9 5690 1 1 40 PRO HD3 H 0.912 5.282 1.024 1.00 . A A . 40 PRO HD3 1 1 9 5691 1 1 40 PRO HG2 H 3.353 6.379 1.364 1.00 . A A . 40 PRO HG2 1 1 9 5692 1 1 40 PRO HG3 H 1.887 7.103 2.052 1.00 . A A . 40 PRO HG3 1 1 9 5693 1 1 40 PRO N N 0.745 6.728 -0.512 1.00 . A A . 40 PRO N 1 1 9 5694 1 1 40 PRO O O 1.384 7.825 -2.924 1.00 . A A . 40 PRO O 1 1 9 5695 1 1 41 SER C C 3.815 10.590 -3.548 1.00 . A A . 41 SER C 1 1 9 5696 1 1 41 SER CA C 2.311 10.395 -3.388 1.00 . A A . 41 SER CA 1 1 9 5697 1 1 41 SER CB C 1.589 11.731 -3.567 1.00 . A A . 41 SER CB 1 1 9 5698 1 1 41 SER H H 2.114 10.367 -1.280 1.00 . A A . 41 SER H 1 1 9 5699 1 1 41 SER HA H 1.967 9.705 -4.145 1.00 . A A . 41 SER HA 1 1 9 5700 1 1 41 SER HB2 H 0.522 11.573 -3.512 1.00 . A A . 41 SER HB2 1 1 9 5701 1 1 41 SER HB3 H 1.893 12.410 -2.783 1.00 . A A . 41 SER HB3 1 1 9 5702 1 1 41 SER HG H 1.726 11.680 -5.521 1.00 . A A . 41 SER HG 1 1 9 5703 1 1 41 SER N N 1.997 9.820 -2.084 1.00 . A A . 41 SER N 1 1 9 5704 1 1 41 SER O O 4.262 11.508 -4.235 1.00 . A A . 41 SER O 1 1 9 5705 1 1 41 SER OG O 1.899 12.314 -4.821 1.00 . A A . 41 SER OG 1 1 9 5706 1 1 42 TYR C C 6.681 8.498 -2.481 1.00 . A A . 42 TYR C 1 1 9 5707 1 1 42 TYR CA C 6.045 9.793 -2.984 1.00 . A A . 42 TYR CA 1 1 9 5708 1 1 42 TYR CB C 6.558 10.981 -2.167 1.00 . A A . 42 TYR CB 1 1 9 5709 1 1 42 TYR CD1 C 5.202 11.388 -0.076 1.00 . A A . 42 TYR CD1 1 1 9 5710 1 1 42 TYR CD2 C 7.236 10.160 0.122 1.00 . A A . 42 TYR CD2 1 1 9 5711 1 1 42 TYR CE1 C 4.989 11.262 1.284 1.00 . A A . 42 TYR CE1 1 1 9 5712 1 1 42 TYR CE2 C 7.030 10.029 1.482 1.00 . A A . 42 TYR CE2 1 1 9 5713 1 1 42 TYR CG C 6.328 10.840 -0.679 1.00 . A A . 42 TYR CG 1 1 9 5714 1 1 42 TYR CZ C 5.905 10.581 2.058 1.00 . A A . 42 TYR CZ 1 1 9 5715 1 1 42 TYR H H 4.175 9.008 -2.380 1.00 . A A . 42 TYR H 1 1 9 5716 1 1 42 TYR HA H 6.317 9.935 -4.019 1.00 . A A . 42 TYR HA 1 1 9 5717 1 1 42 TYR HB2 H 7.620 11.087 -2.328 1.00 . A A . 42 TYR HB2 1 1 9 5718 1 1 42 TYR HB3 H 6.057 11.879 -2.498 1.00 . A A . 42 TYR HB3 1 1 9 5719 1 1 42 TYR HD1 H 4.487 11.920 -0.685 1.00 . A A . 42 TYR HD1 1 1 9 5720 1 1 42 TYR HD2 H 8.116 9.729 -0.331 1.00 . A A . 42 TYR HD2 1 1 9 5721 1 1 42 TYR HE1 H 4.108 11.694 1.734 1.00 . A A . 42 TYR HE1 1 1 9 5722 1 1 42 TYR HE2 H 7.748 9.496 2.088 1.00 . A A . 42 TYR HE2 1 1 9 5723 1 1 42 TYR HH H 5.495 11.313 3.788 1.00 . A A . 42 TYR HH 1 1 9 5724 1 1 42 TYR N N 4.590 9.719 -2.911 1.00 . A A . 42 TYR N 1 1 9 5725 1 1 42 TYR O O 6.144 7.840 -1.590 1.00 . A A . 42 TYR O 1 1 9 5726 1 1 42 TYR OH O 5.696 10.453 3.412 1.00 . A A . 42 TYR OH 1 1 9 5727 1 1 43 PRO C C 9.199 7.021 -1.283 1.00 . A A . 43 PRO C 1 1 9 5728 1 1 43 PRO CA C 8.543 6.893 -2.653 1.00 . A A . 43 PRO CA 1 1 9 5729 1 1 43 PRO CB C 9.605 6.731 -3.741 1.00 . A A . 43 PRO CB 1 1 9 5730 1 1 43 PRO CD C 8.547 8.841 -4.120 1.00 . A A . 43 PRO CD 1 1 9 5731 1 1 43 PRO CG C 9.861 8.116 -4.224 1.00 . A A . 43 PRO CG 1 1 9 5732 1 1 43 PRO HA H 7.885 6.037 -2.657 1.00 . A A . 43 PRO HA 1 1 9 5733 1 1 43 PRO HB2 H 10.494 6.287 -3.318 1.00 . A A . 43 PRO HB2 1 1 9 5734 1 1 43 PRO HB3 H 9.222 6.102 -4.531 1.00 . A A . 43 PRO HB3 1 1 9 5735 1 1 43 PRO HD2 H 8.707 9.873 -3.844 1.00 . A A . 43 PRO HD2 1 1 9 5736 1 1 43 PRO HD3 H 8.005 8.778 -5.052 1.00 . A A . 43 PRO HD3 1 1 9 5737 1 1 43 PRO HG2 H 10.602 8.591 -3.600 1.00 . A A . 43 PRO HG2 1 1 9 5738 1 1 43 PRO HG3 H 10.194 8.091 -5.251 1.00 . A A . 43 PRO HG3 1 1 9 5739 1 1 43 PRO N N 7.837 8.115 -3.049 1.00 . A A . 43 PRO N 1 1 9 5740 1 1 43 PRO O O 9.582 8.114 -0.866 1.00 . A A . 43 PRO O 1 1 9 5741 1 1 44 GLY C C 11.368 6.401 0.703 1.00 . A A . 44 GLY C 1 1 9 5742 1 1 44 GLY CA C 9.936 5.904 0.730 1.00 . A A . 44 GLY CA 1 1 9 5743 1 1 44 GLY H H 9.002 5.055 -0.969 1.00 . A A . 44 GLY H 1 1 9 5744 1 1 44 GLY HA2 H 9.922 4.900 1.127 1.00 . A A . 44 GLY HA2 1 1 9 5745 1 1 44 GLY HA3 H 9.357 6.544 1.380 1.00 . A A . 44 GLY HA3 1 1 9 5746 1 1 44 GLY N N 9.326 5.896 -0.586 1.00 . A A . 44 GLY N 1 1 9 5747 1 1 44 GLY O O 11.875 6.795 -0.347 1.00 . A A . 44 GLY O 1 1 9 5748 1 1 45 ASN C C 13.530 8.297 1.555 1.00 . A A . 45 ASN C 1 1 9 5749 1 1 45 ASN CA C 13.404 6.834 1.966 1.00 . A A . 45 ASN CA 1 1 9 5750 1 1 45 ASN CB C 14.313 5.966 1.094 1.00 . A A . 45 ASN CB 1 1 9 5751 1 1 45 ASN CG C 14.523 4.582 1.675 1.00 . A A . 45 ASN CG 1 1 9 5752 1 1 45 ASN H H 11.562 6.056 2.663 1.00 . A A . 45 ASN H 1 1 9 5753 1 1 45 ASN HA H 13.707 6.734 2.997 1.00 . A A . 45 ASN HA 1 1 9 5754 1 1 45 ASN HB2 H 13.870 5.861 0.115 1.00 . A A . 45 ASN HB2 1 1 9 5755 1 1 45 ASN HB3 H 15.276 6.447 0.999 1.00 . A A . 45 ASN HB3 1 1 9 5756 1 1 45 ASN HD21 H 15.554 5.349 3.193 1.00 . A A . 45 ASN HD21 1 1 9 5757 1 1 45 ASN HD22 H 15.370 3.631 3.202 1.00 . A A . 45 ASN HD22 1 1 9 5758 1 1 45 ASN N N 12.021 6.382 1.861 1.00 . A A . 45 ASN N 1 1 9 5759 1 1 45 ASN ND2 N 15.219 4.514 2.804 1.00 . A A . 45 ASN ND2 1 1 9 5760 1 1 45 ASN O O 13.940 8.605 0.435 1.00 . A A . 45 ASN O 1 1 9 5761 1 1 45 ASN OD1 O 14.065 3.585 1.117 1.00 . A A . 45 ASN OD1 1 1 9 5762 1 1 46 GLY C C 12.060 11.383 2.706 1.00 . A A . 46 GLY C 1 1 9 5763 1 1 46 GLY CA C 13.257 10.616 2.181 1.00 . A A . 46 GLY CA 1 1 9 5764 1 1 46 GLY H H 12.856 8.892 3.343 1.00 . A A . 46 GLY H 1 1 9 5765 1 1 46 GLY HA2 H 13.318 10.753 1.111 1.00 . A A . 46 GLY HA2 1 1 9 5766 1 1 46 GLY HA3 H 14.153 11.013 2.636 1.00 . A A . 46 GLY HA3 1 1 9 5767 1 1 46 GLY N N 13.176 9.196 2.468 1.00 . A A . 46 GLY N 1 1 9 5768 1 1 46 GLY O O 11.128 10.741 3.234 1.00 . A A . 46 GLY O 1 1 9 5769 1 1 46 GLY OXT O 12.054 12.627 2.590 1.00 . A A . 46 GLY OXT 1 1 10 5770 1 1 1 ALA C C -16.842 -7.708 4.494 1.00 . A A . 1 ALA C 1 1 10 5771 1 1 1 ALA CA C -15.953 -8.614 5.338 1.00 . A A . 1 ALA CA 1 1 10 5772 1 1 1 ALA CB C -14.510 -8.135 5.285 1.00 . A A . 1 ALA CB 1 1 10 5773 1 1 1 ALA H1 H -17.029 -10.207 4.607 1.00 . A A . 1 ALA H1 1 1 10 5774 1 1 1 ALA H2 H -15.400 -10.138 4.072 1.00 . A A . 1 ALA H2 1 1 10 5775 1 1 1 ALA H3 H -15.759 -10.634 5.675 1.00 . A A . 1 ALA H3 1 1 10 5776 1 1 1 ALA HA H -16.283 -8.567 6.366 1.00 . A A . 1 ALA HA 1 1 10 5777 1 1 1 ALA HB1 H -13.874 -8.850 5.785 1.00 . A A . 1 ALA HB1 1 1 10 5778 1 1 1 ALA HB2 H -14.430 -7.177 5.776 1.00 . A A . 1 ALA HB2 1 1 10 5779 1 1 1 ALA HB3 H -14.200 -8.038 4.254 1.00 . A A . 1 ALA HB3 1 1 10 5780 1 1 1 ALA N N -16.043 -10.025 4.882 1.00 . A A . 1 ALA N 1 1 10 5781 1 1 1 ALA O O -17.247 -8.073 3.390 1.00 . A A . 1 ALA O 1 1 10 5782 1 1 2 MET C C -17.143 -4.444 3.713 1.00 . A A . 2 MET C 1 1 10 5783 1 1 2 MET CA C -17.983 -5.566 4.314 1.00 . A A . 2 MET CA 1 1 10 5784 1 1 2 MET CB C -19.032 -4.982 5.262 1.00 . A A . 2 MET CB 1 1 10 5785 1 1 2 MET CE C -22.376 -6.514 7.162 1.00 . A A . 2 MET CE 1 1 10 5786 1 1 2 MET CG C -20.136 -5.962 5.627 1.00 . A A . 2 MET CG 1 1 10 5787 1 1 2 MET H H -16.789 -6.291 5.904 1.00 . A A . 2 MET H 1 1 10 5788 1 1 2 MET HA H -18.486 -6.091 3.516 1.00 . A A . 2 MET HA 1 1 10 5789 1 1 2 MET HB2 H -18.543 -4.669 6.173 1.00 . A A . 2 MET HB2 1 1 10 5790 1 1 2 MET HB3 H -19.485 -4.121 4.793 1.00 . A A . 2 MET HB3 1 1 10 5791 1 1 2 MET HE1 H -21.703 -7.359 7.185 1.00 . A A . 2 MET HE1 1 1 10 5792 1 1 2 MET HE2 H -22.619 -6.221 8.172 1.00 . A A . 2 MET HE2 1 1 10 5793 1 1 2 MET HE3 H -23.280 -6.789 6.639 1.00 . A A . 2 MET HE3 1 1 10 5794 1 1 2 MET HG2 H -20.430 -6.498 4.737 1.00 . A A . 2 MET HG2 1 1 10 5795 1 1 2 MET HG3 H -19.752 -6.660 6.356 1.00 . A A . 2 MET HG3 1 1 10 5796 1 1 2 MET N N -17.142 -6.525 5.020 1.00 . A A . 2 MET N 1 1 10 5797 1 1 2 MET O O -17.479 -3.899 2.661 1.00 . A A . 2 MET O 1 1 10 5798 1 1 2 MET SD S -21.589 -5.146 6.316 1.00 . A A . 2 MET SD 1 1 10 5799 1 1 3 ASP C C -13.714 -3.524 3.894 1.00 . A A . 3 ASP C 1 1 10 5800 1 1 3 ASP CA C -15.162 -3.045 3.921 1.00 . A A . 3 ASP CA 1 1 10 5801 1 1 3 ASP CB C -15.287 -1.812 4.817 1.00 . A A . 3 ASP CB 1 1 10 5802 1 1 3 ASP CG C -15.027 -2.129 6.277 1.00 . A A . 3 ASP CG 1 1 10 5803 1 1 3 ASP H H -15.836 -4.574 5.220 1.00 . A A . 3 ASP H 1 1 10 5804 1 1 3 ASP HA H -15.460 -2.782 2.917 1.00 . A A . 3 ASP HA 1 1 10 5805 1 1 3 ASP HB2 H -14.573 -1.068 4.497 1.00 . A A . 3 ASP HB2 1 1 10 5806 1 1 3 ASP HB3 H -16.285 -1.409 4.727 1.00 . A A . 3 ASP HB3 1 1 10 5807 1 1 3 ASP N N -16.050 -4.103 4.388 1.00 . A A . 3 ASP N 1 1 10 5808 1 1 3 ASP O O -13.068 -3.637 4.935 1.00 . A A . 3 ASP O 1 1 10 5809 1 1 3 ASP OD1 O -15.993 -2.470 6.991 1.00 . A A . 3 ASP OD1 1 1 10 5810 1 1 3 ASP OD2 O -13.857 -2.038 6.705 1.00 . A A . 3 ASP OD2 1 1 10 5811 1 1 4 CYS C C -10.928 -3.140 2.055 1.00 . A A . 4 CYS C 1 1 10 5812 1 1 4 CYS CA C -11.838 -4.269 2.533 1.00 . A A . 4 CYS CA 1 1 10 5813 1 1 4 CYS CB C -11.785 -5.433 1.542 1.00 . A A . 4 CYS CB 1 1 10 5814 1 1 4 CYS H H -13.775 -3.692 1.902 1.00 . A A . 4 CYS H 1 1 10 5815 1 1 4 CYS HA H -11.489 -4.612 3.496 1.00 . A A . 4 CYS HA 1 1 10 5816 1 1 4 CYS HB2 H -12.424 -5.209 0.701 1.00 . A A . 4 CYS HB2 1 1 10 5817 1 1 4 CYS HB3 H -10.770 -5.554 1.194 1.00 . A A . 4 CYS HB3 1 1 10 5818 1 1 4 CYS N N -13.210 -3.803 2.696 1.00 . A A . 4 CYS N 1 1 10 5819 1 1 4 CYS O O -9.717 -3.175 2.269 1.00 . A A . 4 CYS O 1 1 10 5820 1 1 4 CYS SG S -12.328 -7.030 2.235 1.00 . A A . 4 CYS SG 1 1 10 5821 1 1 5 THR C C -9.765 -1.463 -0.180 1.00 . A A . 5 THR C 1 1 10 5822 1 1 5 THR CA C -10.747 -1.008 0.895 1.00 . A A . 5 THR CA 1 1 10 5823 1 1 5 THR CB C -9.994 -0.319 2.036 1.00 . A A . 5 THR CB 1 1 10 5824 1 1 5 THR CG2 C -9.614 1.112 1.724 1.00 . A A . 5 THR CG2 1 1 10 5825 1 1 5 THR H H -12.483 -2.165 1.258 1.00 . A A . 5 THR H 1 1 10 5826 1 1 5 THR HA H -11.441 -0.306 0.458 1.00 . A A . 5 THR HA 1 1 10 5827 1 1 5 THR HB H -9.085 -0.867 2.236 1.00 . A A . 5 THR HB 1 1 10 5828 1 1 5 THR HG1 H -11.643 0.056 3.024 1.00 . A A . 5 THR HG1 1 1 10 5829 1 1 5 THR HG21 H -9.123 1.152 0.762 1.00 . A A . 5 THR HG21 1 1 10 5830 1 1 5 THR HG22 H -10.503 1.724 1.700 1.00 . A A . 5 THR HG22 1 1 10 5831 1 1 5 THR HG23 H -8.943 1.481 2.486 1.00 . A A . 5 THR HG23 1 1 10 5832 1 1 5 THR N N -11.515 -2.140 1.403 1.00 . A A . 5 THR N 1 1 10 5833 1 1 5 THR O O -8.551 -1.374 -0.006 1.00 . A A . 5 THR O 1 1 10 5834 1 1 5 THR OG1 O -10.776 -0.307 3.217 1.00 . A A . 5 THR OG1 1 1 10 5835 1 1 6 THR C C -8.556 -1.320 -2.908 1.00 . A A . 6 THR C 1 1 10 5836 1 1 6 THR CA C -9.473 -2.427 -2.396 1.00 . A A . 6 THR CA 1 1 10 5837 1 1 6 THR CB C -10.352 -2.946 -3.535 1.00 . A A . 6 THR CB 1 1 10 5838 1 1 6 THR CG2 C -10.626 -4.432 -3.449 1.00 . A A . 6 THR CG2 1 1 10 5839 1 1 6 THR H H -11.277 -2.002 -1.373 1.00 . A A . 6 THR H 1 1 10 5840 1 1 6 THR HA H -8.864 -3.239 -2.027 1.00 . A A . 6 THR HA 1 1 10 5841 1 1 6 THR HB H -9.855 -2.756 -4.476 1.00 . A A . 6 THR HB 1 1 10 5842 1 1 6 THR HG1 H -11.554 -1.521 -4.135 1.00 . A A . 6 THR HG1 1 1 10 5843 1 1 6 THR HG21 H -10.038 -4.861 -2.650 1.00 . A A . 6 THR HG21 1 1 10 5844 1 1 6 THR HG22 H -11.675 -4.594 -3.250 1.00 . A A . 6 THR HG22 1 1 10 5845 1 1 6 THR HG23 H -10.359 -4.902 -4.384 1.00 . A A . 6 THR HG23 1 1 10 5846 1 1 6 THR N N -10.301 -1.954 -1.293 1.00 . A A . 6 THR N 1 1 10 5847 1 1 6 THR O O -8.997 -0.196 -3.149 1.00 . A A . 6 THR O 1 1 10 5848 1 1 6 THR OG1 O -11.601 -2.279 -3.548 1.00 . A A . 6 THR OG1 1 1 10 5849 1 1 7 GLY C C -4.927 -1.263 -3.706 1.00 . A A . 7 GLY C 1 1 10 5850 1 1 7 GLY CA C -6.317 -0.674 -3.552 1.00 . A A . 7 GLY CA 1 1 10 5851 1 1 7 GLY H H -6.986 -2.559 -2.862 1.00 . A A . 7 GLY H 1 1 10 5852 1 1 7 GLY HA2 H -6.272 0.148 -2.854 1.00 . A A . 7 GLY HA2 1 1 10 5853 1 1 7 GLY HA3 H -6.646 -0.302 -4.511 1.00 . A A . 7 GLY HA3 1 1 10 5854 1 1 7 GLY N N -7.279 -1.648 -3.071 1.00 . A A . 7 GLY N 1 1 10 5855 1 1 7 GLY O O -4.708 -2.430 -3.382 1.00 . A A . 7 GLY O 1 1 10 5856 1 1 8 PRO C C -1.905 -1.300 -3.068 1.00 . A A . 8 PRO C 1 1 10 5857 1 1 8 PRO CA C -2.580 -0.943 -4.389 1.00 . A A . 8 PRO CA 1 1 10 5858 1 1 8 PRO CB C -1.878 0.247 -5.053 1.00 . A A . 8 PRO CB 1 1 10 5859 1 1 8 PRO CD C -4.126 0.930 -4.612 1.00 . A A . 8 PRO CD 1 1 10 5860 1 1 8 PRO CG C -2.713 1.432 -4.708 1.00 . A A . 8 PRO CG 1 1 10 5861 1 1 8 PRO HA H -2.544 -1.798 -5.049 1.00 . A A . 8 PRO HA 1 1 10 5862 1 1 8 PRO HB2 H -0.877 0.341 -4.660 1.00 . A A . 8 PRO HB2 1 1 10 5863 1 1 8 PRO HB3 H -1.837 0.093 -6.121 1.00 . A A . 8 PRO HB3 1 1 10 5864 1 1 8 PRO HD2 H -4.675 1.488 -3.868 1.00 . A A . 8 PRO HD2 1 1 10 5865 1 1 8 PRO HD3 H -4.616 0.993 -5.573 1.00 . A A . 8 PRO HD3 1 1 10 5866 1 1 8 PRO HG2 H -2.396 1.841 -3.761 1.00 . A A . 8 PRO HG2 1 1 10 5867 1 1 8 PRO HG3 H -2.632 2.177 -5.486 1.00 . A A . 8 PRO HG3 1 1 10 5868 1 1 8 PRO N N -3.957 -0.474 -4.200 1.00 . A A . 8 PRO N 1 1 10 5869 1 1 8 PRO O O -1.027 -2.162 -3.023 1.00 . A A . 8 PRO O 1 1 10 5870 1 1 9 CYS C C -2.400 -2.138 -0.051 1.00 . A A . 9 CYS C 1 1 10 5871 1 1 9 CYS CA C -1.763 -0.896 -0.670 1.00 . A A . 9 CYS CA 1 1 10 5872 1 1 9 CYS CB C -1.971 0.315 0.245 1.00 . A A . 9 CYS CB 1 1 10 5873 1 1 9 CYS H H -3.031 0.033 -2.089 1.00 . A A . 9 CYS H 1 1 10 5874 1 1 9 CYS HA H -0.704 -1.070 -0.787 1.00 . A A . 9 CYS HA 1 1 10 5875 1 1 9 CYS HB2 H -2.435 1.108 -0.322 1.00 . A A . 9 CYS HB2 1 1 10 5876 1 1 9 CYS HB3 H -2.623 0.034 1.059 1.00 . A A . 9 CYS HB3 1 1 10 5877 1 1 9 CYS N N -2.324 -0.639 -1.992 1.00 . A A . 9 CYS N 1 1 10 5878 1 1 9 CYS O O -1.754 -2.877 0.692 1.00 . A A . 9 CYS O 1 1 10 5879 1 1 9 CYS SG S -0.435 0.979 0.967 1.00 . A A . 9 CYS SG 1 1 10 5880 1 1 10 CYS C C -3.860 -4.806 -0.452 1.00 . A A . 10 CYS C 1 1 10 5881 1 1 10 CYS CA C -4.405 -3.511 0.143 1.00 . A A . 10 CYS CA 1 1 10 5882 1 1 10 CYS CB C -5.894 -3.372 -0.184 1.00 . A A . 10 CYS CB 1 1 10 5883 1 1 10 CYS H H -4.128 -1.734 -0.970 1.00 . A A . 10 CYS H 1 1 10 5884 1 1 10 CYS HA H -4.280 -3.537 1.216 1.00 . A A . 10 CYS HA 1 1 10 5885 1 1 10 CYS HB2 H -6.064 -2.407 -0.637 1.00 . A A . 10 CYS HB2 1 1 10 5886 1 1 10 CYS HB3 H -6.174 -4.144 -0.886 1.00 . A A . 10 CYS HB3 1 1 10 5887 1 1 10 CYS N N -3.671 -2.359 -0.370 1.00 . A A . 10 CYS N 1 1 10 5888 1 1 10 CYS O O -3.520 -4.861 -1.634 1.00 . A A . 10 CYS O 1 1 10 5889 1 1 10 CYS SG S -6.998 -3.507 1.259 1.00 . A A . 10 CYS SG 1 1 10 5890 1 1 11 ARG C C -4.436 -8.076 -0.424 1.00 . A A . 11 ARG C 1 1 10 5891 1 1 11 ARG CA C -3.281 -7.140 -0.081 1.00 . A A . 11 ARG CA 1 1 10 5892 1 1 11 ARG CB C -2.392 -7.772 0.991 1.00 . A A . 11 ARG CB 1 1 10 5893 1 1 11 ARG CD C -0.808 -9.708 1.233 1.00 . A A . 11 ARG CD 1 1 10 5894 1 1 11 ARG CG C -1.163 -8.468 0.429 1.00 . A A . 11 ARG CG 1 1 10 5895 1 1 11 ARG CZ C 1.489 -9.312 2.032 1.00 . A A . 11 ARG CZ 1 1 10 5896 1 1 11 ARG H H -4.070 -5.744 1.302 1.00 . A A . 11 ARG H 1 1 10 5897 1 1 11 ARG HA H -2.694 -6.973 -0.972 1.00 . A A . 11 ARG HA 1 1 10 5898 1 1 11 ARG HB2 H -2.062 -6.999 1.670 1.00 . A A . 11 ARG HB2 1 1 10 5899 1 1 11 ARG HB3 H -2.970 -8.499 1.542 1.00 . A A . 11 ARG HB3 1 1 10 5900 1 1 11 ARG HD2 H -1.149 -9.573 2.249 1.00 . A A . 11 ARG HD2 1 1 10 5901 1 1 11 ARG HD3 H -1.308 -10.560 0.797 1.00 . A A . 11 ARG HD3 1 1 10 5902 1 1 11 ARG HE H 0.977 -10.645 0.638 1.00 . A A . 11 ARG HE 1 1 10 5903 1 1 11 ARG HG2 H -1.361 -8.758 -0.592 1.00 . A A . 11 ARG HG2 1 1 10 5904 1 1 11 ARG HG3 H -0.329 -7.782 0.455 1.00 . A A . 11 ARG HG3 1 1 10 5905 1 1 11 ARG HH11 H 0.085 -8.152 2.912 1.00 . A A . 11 ARG HH11 1 1 10 5906 1 1 11 ARG HH12 H 1.708 -7.894 3.457 1.00 . A A . 11 ARG HH12 1 1 10 5907 1 1 11 ARG HH21 H 3.112 -10.307 1.353 1.00 . A A . 11 ARG HH21 1 1 10 5908 1 1 11 ARG HH22 H 3.427 -9.117 2.572 1.00 . A A . 11 ARG HH22 1 1 10 5909 1 1 11 ARG N N -3.782 -5.847 0.371 1.00 . A A . 11 ARG N 1 1 10 5910 1 1 11 ARG NE N 0.631 -9.959 1.247 1.00 . A A . 11 ARG NE 1 1 10 5911 1 1 11 ARG NH1 N 1.059 -8.376 2.869 1.00 . A A . 11 ARG NH1 1 1 10 5912 1 1 11 ARG NH2 N 2.782 -9.602 1.982 1.00 . A A . 11 ARG NH2 1 1 10 5913 1 1 11 ARG O O -4.676 -8.381 -1.592 1.00 . A A . 11 ARG O 1 1 10 5914 1 1 12 GLN C C -7.580 -8.791 0.900 1.00 . A A . 12 GLN C 1 1 10 5915 1 1 12 GLN CA C -6.280 -9.430 0.413 1.00 . A A . 12 GLN CA 1 1 10 5916 1 1 12 GLN CB C -6.036 -10.748 1.152 1.00 . A A . 12 GLN CB 1 1 10 5917 1 1 12 GLN CD C -6.856 -13.137 1.189 1.00 . A A . 12 GLN CD 1 1 10 5918 1 1 12 GLN CG C -6.386 -11.978 0.331 1.00 . A A . 12 GLN CG 1 1 10 5919 1 1 12 GLN H H -4.907 -8.249 1.511 1.00 . A A . 12 GLN H 1 1 10 5920 1 1 12 GLN HA H -6.367 -9.632 -0.644 1.00 . A A . 12 GLN HA 1 1 10 5921 1 1 12 GLN HB2 H -4.992 -10.808 1.422 1.00 . A A . 12 GLN HB2 1 1 10 5922 1 1 12 GLN HB3 H -6.633 -10.760 2.052 1.00 . A A . 12 GLN HB3 1 1 10 5923 1 1 12 GLN HE21 H -4.988 -13.499 1.766 1.00 . A A . 12 GLN HE21 1 1 10 5924 1 1 12 GLN HE22 H -6.193 -14.548 2.423 1.00 . A A . 12 GLN HE22 1 1 10 5925 1 1 12 GLN HG2 H -7.173 -11.722 -0.362 1.00 . A A . 12 GLN HG2 1 1 10 5926 1 1 12 GLN HG3 H -5.510 -12.289 -0.220 1.00 . A A . 12 GLN HG3 1 1 10 5927 1 1 12 GLN N N -5.148 -8.529 0.603 1.00 . A A . 12 GLN N 1 1 10 5928 1 1 12 GLN NE2 N -5.917 -13.794 1.861 1.00 . A A . 12 GLN NE2 1 1 10 5929 1 1 12 GLN O O -8.667 -9.170 0.466 1.00 . A A . 12 GLN O 1 1 10 5930 1 1 12 GLN OE1 O -8.048 -13.438 1.247 1.00 . A A . 12 GLN OE1 1 1 10 5931 1 1 13 CYS C C -8.206 -6.081 3.379 1.00 . A A . 13 CYS C 1 1 10 5932 1 1 13 CYS CA C -8.624 -7.127 2.348 1.00 . A A . 13 CYS CA 1 1 10 5933 1 1 13 CYS CB C -9.594 -8.126 2.985 1.00 . A A . 13 CYS CB 1 1 10 5934 1 1 13 CYS H H -6.567 -7.561 2.106 1.00 . A A . 13 CYS H 1 1 10 5935 1 1 13 CYS HA H -9.122 -6.628 1.531 1.00 . A A . 13 CYS HA 1 1 10 5936 1 1 13 CYS HB2 H -9.957 -8.800 2.224 1.00 . A A . 13 CYS HB2 1 1 10 5937 1 1 13 CYS HB3 H -9.071 -8.693 3.740 1.00 . A A . 13 CYS HB3 1 1 10 5938 1 1 13 CYS N N -7.459 -7.820 1.802 1.00 . A A . 13 CYS N 1 1 10 5939 1 1 13 CYS O O -8.894 -5.079 3.571 1.00 . A A . 13 CYS O 1 1 10 5940 1 1 13 CYS SG S -11.046 -7.356 3.776 1.00 . A A . 13 CYS SG 1 1 10 5941 1 1 14 LYS C C -5.281 -4.743 4.593 1.00 . A A . 14 LYS C 1 1 10 5942 1 1 14 LYS CA C -6.581 -5.389 5.052 1.00 . A A . 14 LYS CA 1 1 10 5943 1 1 14 LYS CB C -6.364 -6.114 6.381 1.00 . A A . 14 LYS CB 1 1 10 5944 1 1 14 LYS CD C -6.165 -5.906 8.878 1.00 . A A . 14 LYS CD 1 1 10 5945 1 1 14 LYS CE C -5.925 -4.874 9.968 1.00 . A A . 14 LYS CE 1 1 10 5946 1 1 14 LYS CG C -6.671 -5.258 7.599 1.00 . A A . 14 LYS CG 1 1 10 5947 1 1 14 LYS H H -6.567 -7.130 3.855 1.00 . A A . 14 LYS H 1 1 10 5948 1 1 14 LYS HA H -7.324 -4.618 5.190 1.00 . A A . 14 LYS HA 1 1 10 5949 1 1 14 LYS HB2 H -7.001 -6.986 6.411 1.00 . A A . 14 LYS HB2 1 1 10 5950 1 1 14 LYS HB3 H -5.333 -6.431 6.441 1.00 . A A . 14 LYS HB3 1 1 10 5951 1 1 14 LYS HD2 H -6.899 -6.617 9.225 1.00 . A A . 14 LYS HD2 1 1 10 5952 1 1 14 LYS HD3 H -5.237 -6.417 8.667 1.00 . A A . 14 LYS HD3 1 1 10 5953 1 1 14 LYS HE2 H -6.520 -3.998 9.754 1.00 . A A . 14 LYS HE2 1 1 10 5954 1 1 14 LYS HE3 H -6.229 -5.293 10.916 1.00 . A A . 14 LYS HE3 1 1 10 5955 1 1 14 LYS HG2 H -6.193 -4.297 7.481 1.00 . A A . 14 LYS HG2 1 1 10 5956 1 1 14 LYS HG3 H -7.740 -5.124 7.672 1.00 . A A . 14 LYS HG3 1 1 10 5957 1 1 14 LYS HZ1 H -4.063 -4.484 9.103 1.00 . A A . 14 LYS HZ1 1 1 10 5958 1 1 14 LYS HZ2 H -4.410 -3.519 10.448 1.00 . A A . 14 LYS HZ2 1 1 10 5959 1 1 14 LYS HZ3 H -3.972 -5.138 10.662 1.00 . A A . 14 LYS HZ3 1 1 10 5960 1 1 14 LYS N N -7.078 -6.316 4.045 1.00 . A A . 14 LYS N 1 1 10 5961 1 1 14 LYS NZ N -4.492 -4.476 10.051 1.00 . A A . 14 LYS NZ 1 1 10 5962 1 1 14 LYS O O -4.440 -5.393 3.971 1.00 . A A . 14 LYS O 1 1 10 5963 1 1 15 LEU C C -2.659 -3.524 4.816 1.00 . A A . 15 LEU C 1 1 10 5964 1 1 15 LEU CA C -3.921 -2.721 4.516 1.00 . A A . 15 LEU CA 1 1 10 5965 1 1 15 LEU CB C -3.857 -1.352 5.216 1.00 . A A . 15 LEU CB 1 1 10 5966 1 1 15 LEU CD1 C -5.916 -1.087 6.646 1.00 . A A . 15 LEU CD1 1 1 10 5967 1 1 15 LEU CD2 C -4.020 -2.509 7.461 1.00 . A A . 15 LEU CD2 1 1 10 5968 1 1 15 LEU CG C -4.406 -1.277 6.651 1.00 . A A . 15 LEU CG 1 1 10 5969 1 1 15 LEU H H -5.829 -2.999 5.393 1.00 . A A . 15 LEU H 1 1 10 5970 1 1 15 LEU HA H -3.971 -2.558 3.449 1.00 . A A . 15 LEU HA 1 1 10 5971 1 1 15 LEU HB2 H -2.823 -1.040 5.241 1.00 . A A . 15 LEU HB2 1 1 10 5972 1 1 15 LEU HB3 H -4.407 -0.646 4.613 1.00 . A A . 15 LEU HB3 1 1 10 5973 1 1 15 LEU HD11 H -6.250 -0.873 5.641 1.00 . A A . 15 LEU HD11 1 1 10 5974 1 1 15 LEU HD12 H -6.395 -1.988 7.001 1.00 . A A . 15 LEU HD12 1 1 10 5975 1 1 15 LEU HD13 H -6.177 -0.263 7.294 1.00 . A A . 15 LEU HD13 1 1 10 5976 1 1 15 LEU HD21 H -4.419 -3.394 6.990 1.00 . A A . 15 LEU HD21 1 1 10 5977 1 1 15 LEU HD22 H -2.943 -2.582 7.511 1.00 . A A . 15 LEU HD22 1 1 10 5978 1 1 15 LEU HD23 H -4.420 -2.422 8.460 1.00 . A A . 15 LEU HD23 1 1 10 5979 1 1 15 LEU HG H -3.973 -0.415 7.139 1.00 . A A . 15 LEU HG 1 1 10 5980 1 1 15 LEU N N -5.122 -3.459 4.900 1.00 . A A . 15 LEU N 1 1 10 5981 1 1 15 LEU O O -2.483 -4.042 5.918 1.00 . A A . 15 LEU O 1 1 10 5982 1 1 16 LYS C C 0.254 -3.858 5.176 1.00 . A A . 16 LYS C 1 1 10 5983 1 1 16 LYS CA C -0.541 -4.376 3.979 1.00 . A A . 16 LYS CA 1 1 10 5984 1 1 16 LYS CB C 0.304 -4.273 2.707 1.00 . A A . 16 LYS CB 1 1 10 5985 1 1 16 LYS CD C 0.842 -5.193 0.431 1.00 . A A . 16 LYS CD 1 1 10 5986 1 1 16 LYS CE C 0.042 -5.501 -0.824 1.00 . A A . 16 LYS CE 1 1 10 5987 1 1 16 LYS CG C -0.003 -5.355 1.684 1.00 . A A . 16 LYS CG 1 1 10 5988 1 1 16 LYS H H -1.981 -3.202 2.962 1.00 . A A . 16 LYS H 1 1 10 5989 1 1 16 LYS HA H -0.796 -5.411 4.150 1.00 . A A . 16 LYS HA 1 1 10 5990 1 1 16 LYS HB2 H 0.127 -3.312 2.247 1.00 . A A . 16 LYS HB2 1 1 10 5991 1 1 16 LYS HB3 H 1.348 -4.347 2.975 1.00 . A A . 16 LYS HB3 1 1 10 5992 1 1 16 LYS HD2 H 1.198 -4.175 0.378 1.00 . A A . 16 LYS HD2 1 1 10 5993 1 1 16 LYS HD3 H 1.683 -5.868 0.487 1.00 . A A . 16 LYS HD3 1 1 10 5994 1 1 16 LYS HE2 H -0.799 -6.122 -0.557 1.00 . A A . 16 LYS HE2 1 1 10 5995 1 1 16 LYS HE3 H -0.316 -4.572 -1.244 1.00 . A A . 16 LYS HE3 1 1 10 5996 1 1 16 LYS HG2 H 0.202 -6.320 2.122 1.00 . A A . 16 LYS HG2 1 1 10 5997 1 1 16 LYS HG3 H -1.048 -5.294 1.414 1.00 . A A . 16 LYS HG3 1 1 10 5998 1 1 16 LYS HZ1 H 1.602 -6.774 -1.380 1.00 . A A . 16 LYS HZ1 1 1 10 5999 1 1 16 LYS HZ2 H 0.261 -6.844 -2.409 1.00 . A A . 16 LYS HZ2 1 1 10 6000 1 1 16 LYS HZ3 H 1.314 -5.522 -2.482 1.00 . A A . 16 LYS HZ3 1 1 10 6001 1 1 16 LYS N N -1.784 -3.631 3.822 1.00 . A A . 16 LYS N 1 1 10 6002 1 1 16 LYS NZ N 0.862 -6.210 -1.845 1.00 . A A . 16 LYS NZ 1 1 10 6003 1 1 16 LYS O O 0.012 -2.752 5.659 1.00 . A A . 16 LYS O 1 1 10 6004 1 1 17 PRO C C 2.878 -3.018 6.536 1.00 . A A . 17 PRO C 1 1 10 6005 1 1 17 PRO CA C 2.045 -4.263 6.820 1.00 . A A . 17 PRO CA 1 1 10 6006 1 1 17 PRO CB C 2.955 -5.477 7.042 1.00 . A A . 17 PRO CB 1 1 10 6007 1 1 17 PRO CD C 1.575 -5.984 5.160 1.00 . A A . 17 PRO CD 1 1 10 6008 1 1 17 PRO CG C 2.937 -6.218 5.748 1.00 . A A . 17 PRO CG 1 1 10 6009 1 1 17 PRO HA H 1.443 -4.096 7.701 1.00 . A A . 17 PRO HA 1 1 10 6010 1 1 17 PRO HB2 H 3.952 -5.142 7.290 1.00 . A A . 17 PRO HB2 1 1 10 6011 1 1 17 PRO HB3 H 2.563 -6.081 7.846 1.00 . A A . 17 PRO HB3 1 1 10 6012 1 1 17 PRO HD2 H 1.624 -5.984 4.081 1.00 . A A . 17 PRO HD2 1 1 10 6013 1 1 17 PRO HD3 H 0.879 -6.732 5.509 1.00 . A A . 17 PRO HD3 1 1 10 6014 1 1 17 PRO HG2 H 3.701 -5.829 5.092 1.00 . A A . 17 PRO HG2 1 1 10 6015 1 1 17 PRO HG3 H 3.093 -7.272 5.926 1.00 . A A . 17 PRO HG3 1 1 10 6016 1 1 17 PRO N N 1.217 -4.652 5.673 1.00 . A A . 17 PRO N 1 1 10 6017 1 1 17 PRO O O 3.585 -2.948 5.530 1.00 . A A . 17 PRO O 1 1 10 6018 1 1 18 ALA C C 4.993 -1.053 6.921 1.00 . A A . 18 ALA C 1 1 10 6019 1 1 18 ALA CA C 3.533 -0.787 7.276 1.00 . A A . 18 ALA CA 1 1 10 6020 1 1 18 ALA CB C 3.441 0.039 8.551 1.00 . A A . 18 ALA CB 1 1 10 6021 1 1 18 ALA H H 2.207 -2.149 8.208 1.00 . A A . 18 ALA H 1 1 10 6022 1 1 18 ALA HA H 3.076 -0.222 6.477 1.00 . A A . 18 ALA HA 1 1 10 6023 1 1 18 ALA HB1 H 3.942 -0.482 9.354 1.00 . A A . 18 ALA HB1 1 1 10 6024 1 1 18 ALA HB2 H 3.913 0.997 8.393 1.00 . A A . 18 ALA HB2 1 1 10 6025 1 1 18 ALA HB3 H 2.404 0.187 8.810 1.00 . A A . 18 ALA HB3 1 1 10 6026 1 1 18 ALA N N 2.788 -2.034 7.428 1.00 . A A . 18 ALA N 1 1 10 6027 1 1 18 ALA O O 5.563 -2.070 7.316 1.00 . A A . 18 ALA O 1 1 10 6028 1 1 19 GLY C C 7.160 -1.412 4.761 1.00 . A A . 19 GLY C 1 1 10 6029 1 1 19 GLY CA C 6.976 -0.295 5.769 1.00 . A A . 19 GLY CA 1 1 10 6030 1 1 19 GLY H H 5.087 0.653 5.879 1.00 . A A . 19 GLY H 1 1 10 6031 1 1 19 GLY HA2 H 7.570 -0.513 6.644 1.00 . A A . 19 GLY HA2 1 1 10 6032 1 1 19 GLY HA3 H 7.323 0.631 5.333 1.00 . A A . 19 GLY HA3 1 1 10 6033 1 1 19 GLY N N 5.591 -0.136 6.169 1.00 . A A . 19 GLY N 1 1 10 6034 1 1 19 GLY O O 8.245 -1.982 4.646 1.00 . A A . 19 GLY O 1 1 10 6035 1 1 20 THR C C 5.771 -2.237 1.650 1.00 . A A . 20 THR C 1 1 10 6036 1 1 20 THR CA C 6.139 -2.783 3.026 1.00 . A A . 20 THR CA 1 1 10 6037 1 1 20 THR CB C 5.187 -3.917 3.409 1.00 . A A . 20 THR CB 1 1 10 6038 1 1 20 THR CG2 C 5.197 -5.069 2.427 1.00 . A A . 20 THR CG2 1 1 10 6039 1 1 20 THR H H 5.258 -1.235 4.168 1.00 . A A . 20 THR H 1 1 10 6040 1 1 20 THR HA H 7.148 -3.167 2.991 1.00 . A A . 20 THR HA 1 1 10 6041 1 1 20 THR HB H 4.179 -3.528 3.451 1.00 . A A . 20 THR HB 1 1 10 6042 1 1 20 THR HG1 H 6.448 -4.665 4.707 1.00 . A A . 20 THR HG1 1 1 10 6043 1 1 20 THR HG21 H 5.506 -4.711 1.456 1.00 . A A . 20 THR HG21 1 1 10 6044 1 1 20 THR HG22 H 5.888 -5.826 2.768 1.00 . A A . 20 THR HG22 1 1 10 6045 1 1 20 THR HG23 H 4.206 -5.491 2.357 1.00 . A A . 20 THR HG23 1 1 10 6046 1 1 20 THR N N 6.095 -1.726 4.030 1.00 . A A . 20 THR N 1 1 10 6047 1 1 20 THR O O 4.695 -1.669 1.465 1.00 . A A . 20 THR O 1 1 10 6048 1 1 20 THR OG1 O 5.515 -4.438 4.685 1.00 . A A . 20 THR OG1 1 1 10 6049 1 1 21 THR C C 5.163 -2.541 -1.248 1.00 . A A . 21 THR C 1 1 10 6050 1 1 21 THR CA C 6.439 -1.936 -0.672 1.00 . A A . 21 THR CA 1 1 10 6051 1 1 21 THR CB C 7.633 -2.272 -1.569 1.00 . A A . 21 THR CB 1 1 10 6052 1 1 21 THR CG2 C 8.223 -1.058 -2.251 1.00 . A A . 21 THR CG2 1 1 10 6053 1 1 21 THR H H 7.511 -2.873 0.896 1.00 . A A . 21 THR H 1 1 10 6054 1 1 21 THR HA H 6.324 -0.863 -0.630 1.00 . A A . 21 THR HA 1 1 10 6055 1 1 21 THR HB H 7.313 -2.960 -2.338 1.00 . A A . 21 THR HB 1 1 10 6056 1 1 21 THR HG1 H 8.699 -3.826 -1.033 1.00 . A A . 21 THR HG1 1 1 10 6057 1 1 21 THR HG21 H 7.957 -0.170 -1.695 1.00 . A A . 21 THR HG21 1 1 10 6058 1 1 21 THR HG22 H 9.298 -1.152 -2.288 1.00 . A A . 21 THR HG22 1 1 10 6059 1 1 21 THR HG23 H 7.832 -0.984 -3.255 1.00 . A A . 21 THR HG23 1 1 10 6060 1 1 21 THR N N 6.671 -2.413 0.688 1.00 . A A . 21 THR N 1 1 10 6061 1 1 21 THR O O 5.069 -3.754 -1.437 1.00 . A A . 21 THR O 1 1 10 6062 1 1 21 THR OG1 O 8.668 -2.890 -0.823 1.00 . A A . 21 THR OG1 1 1 10 6063 1 1 22 CYS C C 2.840 -1.871 -3.572 1.00 . A A . 22 CYS C 1 1 10 6064 1 1 22 CYS CA C 2.910 -2.135 -2.072 1.00 . A A . 22 CYS CA 1 1 10 6065 1 1 22 CYS CB C 1.753 -1.426 -1.368 1.00 . A A . 22 CYS CB 1 1 10 6066 1 1 22 CYS H H 4.319 -0.733 -1.345 1.00 . A A . 22 CYS H 1 1 10 6067 1 1 22 CYS HA H 2.828 -3.197 -1.900 1.00 . A A . 22 CYS HA 1 1 10 6068 1 1 22 CYS HB2 H 0.828 -1.687 -1.860 1.00 . A A . 22 CYS HB2 1 1 10 6069 1 1 22 CYS HB3 H 1.712 -1.752 -0.339 1.00 . A A . 22 CYS HB3 1 1 10 6070 1 1 22 CYS N N 4.183 -1.687 -1.521 1.00 . A A . 22 CYS N 1 1 10 6071 1 1 22 CYS O O 2.376 -2.714 -4.340 1.00 . A A . 22 CYS O 1 1 10 6072 1 1 22 CYS SG S 1.886 0.392 -1.370 1.00 . A A . 22 CYS SG 1 1 10 6073 1 1 23 TRP C C 4.568 -0.743 -6.086 1.00 . A A . 23 TRP C 1 1 10 6074 1 1 23 TRP CA C 3.283 -0.315 -5.388 1.00 . A A . 23 TRP CA 1 1 10 6075 1 1 23 TRP CB C 3.090 1.197 -5.526 1.00 . A A . 23 TRP CB 1 1 10 6076 1 1 23 TRP CD1 C 1.713 0.759 -7.643 1.00 . A A . 23 TRP CD1 1 1 10 6077 1 1 23 TRP CD2 C 1.755 2.901 -6.999 1.00 . A A . 23 TRP CD2 1 1 10 6078 1 1 23 TRP CE2 C 0.973 2.798 -8.165 1.00 . A A . 23 TRP CE2 1 1 10 6079 1 1 23 TRP CE3 C 1.924 4.156 -6.410 1.00 . A A . 23 TRP CE3 1 1 10 6080 1 1 23 TRP CG C 2.220 1.585 -6.682 1.00 . A A . 23 TRP CG 1 1 10 6081 1 1 23 TRP CH2 C 0.545 5.119 -8.154 1.00 . A A . 23 TRP CH2 1 1 10 6082 1 1 23 TRP CZ2 C 0.362 3.903 -8.751 1.00 . A A . 23 TRP CZ2 1 1 10 6083 1 1 23 TRP CZ3 C 1.317 5.252 -6.994 1.00 . A A . 23 TRP CZ3 1 1 10 6084 1 1 23 TRP H H 3.653 -0.062 -3.320 1.00 . A A . 23 TRP H 1 1 10 6085 1 1 23 TRP HA H 2.454 -0.817 -5.855 1.00 . A A . 23 TRP HA 1 1 10 6086 1 1 23 TRP HB2 H 2.635 1.578 -4.625 1.00 . A A . 23 TRP HB2 1 1 10 6087 1 1 23 TRP HB3 H 4.054 1.665 -5.662 1.00 . A A . 23 TRP HB3 1 1 10 6088 1 1 23 TRP HD1 H 1.888 -0.305 -7.681 1.00 . A A . 23 TRP HD1 1 1 10 6089 1 1 23 TRP HE1 H 0.498 1.114 -9.318 1.00 . A A . 23 TRP HE1 1 1 10 6090 1 1 23 TRP HE3 H 2.514 4.277 -5.516 1.00 . A A . 23 TRP HE3 1 1 10 6091 1 1 23 TRP HH2 H 0.090 6.003 -8.576 1.00 . A A . 23 TRP HH2 1 1 10 6092 1 1 23 TRP HZ2 H -0.237 3.817 -9.644 1.00 . A A . 23 TRP HZ2 1 1 10 6093 1 1 23 TRP HZ3 H 1.438 6.230 -6.554 1.00 . A A . 23 TRP HZ3 1 1 10 6094 1 1 23 TRP N N 3.299 -0.693 -3.981 1.00 . A A . 23 TRP N 1 1 10 6095 1 1 23 TRP NE1 N 0.964 1.481 -8.539 1.00 . A A . 23 TRP NE1 1 1 10 6096 1 1 23 TRP O O 4.565 -1.652 -6.916 1.00 . A A . 23 TRP O 1 1 10 6097 1 1 24 LYS C C 6.925 -0.247 -7.846 1.00 . A A . 24 LYS C 1 1 10 6098 1 1 24 LYS CA C 6.963 -0.386 -6.327 1.00 . A A . 24 LYS CA 1 1 10 6099 1 1 24 LYS CB C 7.397 -1.801 -5.944 1.00 . A A . 24 LYS CB 1 1 10 6100 1 1 24 LYS CD C 9.077 -3.525 -6.665 1.00 . A A . 24 LYS CD 1 1 10 6101 1 1 24 LYS CE C 10.552 -3.890 -6.679 1.00 . A A . 24 LYS CE 1 1 10 6102 1 1 24 LYS CG C 8.863 -2.085 -6.226 1.00 . A A . 24 LYS CG 1 1 10 6103 1 1 24 LYS H H 5.596 0.628 -5.072 1.00 . A A . 24 LYS H 1 1 10 6104 1 1 24 LYS HA H 7.678 0.319 -5.932 1.00 . A A . 24 LYS HA 1 1 10 6105 1 1 24 LYS HB2 H 7.221 -1.944 -4.888 1.00 . A A . 24 LYS HB2 1 1 10 6106 1 1 24 LYS HB3 H 6.801 -2.510 -6.499 1.00 . A A . 24 LYS HB3 1 1 10 6107 1 1 24 LYS HD2 H 8.561 -4.181 -5.980 1.00 . A A . 24 LYS HD2 1 1 10 6108 1 1 24 LYS HD3 H 8.674 -3.651 -7.660 1.00 . A A . 24 LYS HD3 1 1 10 6109 1 1 24 LYS HE2 H 11.122 -3.022 -6.977 1.00 . A A . 24 LYS HE2 1 1 10 6110 1 1 24 LYS HE3 H 10.846 -4.187 -5.683 1.00 . A A . 24 LYS HE3 1 1 10 6111 1 1 24 LYS HG2 H 9.203 -1.426 -7.010 1.00 . A A . 24 LYS HG2 1 1 10 6112 1 1 24 LYS HG3 H 9.434 -1.904 -5.327 1.00 . A A . 24 LYS HG3 1 1 10 6113 1 1 24 LYS HZ1 H 10.051 -5.681 -7.629 1.00 . A A . 24 LYS HZ1 1 1 10 6114 1 1 24 LYS HZ2 H 10.971 -4.633 -8.586 1.00 . A A . 24 LYS HZ2 1 1 10 6115 1 1 24 LYS HZ3 H 11.707 -5.503 -7.334 1.00 . A A . 24 LYS HZ3 1 1 10 6116 1 1 24 LYS N N 5.663 -0.082 -5.740 1.00 . A A . 24 LYS N 1 1 10 6117 1 1 24 LYS NZ N 10.840 -5.004 -7.623 1.00 . A A . 24 LYS NZ 1 1 10 6118 1 1 24 LYS O O 7.654 -0.936 -8.560 1.00 . A A . 24 LYS O 1 1 10 6119 1 1 25 THR C C 7.276 1.321 -10.368 1.00 . A A . 25 THR C 1 1 10 6120 1 1 25 THR CA C 5.945 0.877 -9.770 1.00 . A A . 25 THR CA 1 1 10 6121 1 1 25 THR CB C 4.868 1.928 -10.048 1.00 . A A . 25 THR CB 1 1 10 6122 1 1 25 THR CG2 C 4.412 1.957 -11.490 1.00 . A A . 25 THR CG2 1 1 10 6123 1 1 25 THR H H 5.518 1.169 -7.717 1.00 . A A . 25 THR H 1 1 10 6124 1 1 25 THR HA H 5.651 -0.056 -10.229 1.00 . A A . 25 THR HA 1 1 10 6125 1 1 25 THR HB H 5.262 2.905 -9.807 1.00 . A A . 25 THR HB 1 1 10 6126 1 1 25 THR HG1 H 3.280 0.902 -9.541 1.00 . A A . 25 THR HG1 1 1 10 6127 1 1 25 THR HG21 H 5.273 1.930 -12.141 1.00 . A A . 25 THR HG21 1 1 10 6128 1 1 25 THR HG22 H 3.785 1.100 -11.686 1.00 . A A . 25 THR HG22 1 1 10 6129 1 1 25 THR HG23 H 3.852 2.863 -11.671 1.00 . A A . 25 THR HG23 1 1 10 6130 1 1 25 THR N N 6.073 0.648 -8.335 1.00 . A A . 25 THR N 1 1 10 6131 1 1 25 THR O O 7.968 2.168 -9.803 1.00 . A A . 25 THR O 1 1 10 6132 1 1 25 THR OG1 O 3.726 1.698 -9.243 1.00 . A A . 25 THR OG1 1 1 10 6133 1 1 26 SER C C 9.029 2.585 -12.359 1.00 . A A . 26 SER C 1 1 10 6134 1 1 26 SER CA C 8.881 1.075 -12.186 1.00 . A A . 26 SER CA 1 1 10 6135 1 1 26 SER CB C 8.946 0.387 -13.551 1.00 . A A . 26 SER CB 1 1 10 6136 1 1 26 SER H H 7.036 0.072 -11.911 1.00 . A A . 26 SER H 1 1 10 6137 1 1 26 SER HA H 9.693 0.715 -11.573 1.00 . A A . 26 SER HA 1 1 10 6138 1 1 26 SER HB2 H 9.114 -0.671 -13.410 1.00 . A A . 26 SER HB2 1 1 10 6139 1 1 26 SER HB3 H 8.013 0.537 -14.072 1.00 . A A . 26 SER HB3 1 1 10 6140 1 1 26 SER HG H 10.842 0.615 -13.989 1.00 . A A . 26 SER HG 1 1 10 6141 1 1 26 SER N N 7.630 0.742 -11.511 1.00 . A A . 26 SER N 1 1 10 6142 1 1 26 SER O O 10.143 3.103 -12.441 1.00 . A A . 26 SER O 1 1 10 6143 1 1 26 SER OG O 10.000 0.914 -14.339 1.00 . A A . 26 SER OG 1 1 10 6144 1 1 27 VAL C C 7.749 5.445 -11.237 1.00 . A A . 27 VAL C 1 1 10 6145 1 1 27 VAL CA C 7.907 4.733 -12.578 1.00 . A A . 27 VAL CA 1 1 10 6146 1 1 27 VAL CB C 6.784 5.194 -13.529 1.00 . A A . 27 VAL CB 1 1 10 6147 1 1 27 VAL CG1 C 5.419 4.834 -12.963 1.00 . A A . 27 VAL CG1 1 1 10 6148 1 1 27 VAL CG2 C 6.884 6.690 -13.790 1.00 . A A . 27 VAL CG2 1 1 10 6149 1 1 27 VAL H H 7.043 2.816 -12.345 1.00 . A A . 27 VAL H 1 1 10 6150 1 1 27 VAL HA H 8.855 5.014 -13.014 1.00 . A A . 27 VAL HA 1 1 10 6151 1 1 27 VAL HB H 6.904 4.678 -14.471 1.00 . A A . 27 VAL HB 1 1 10 6152 1 1 27 VAL HG11 H 5.345 5.191 -11.946 1.00 . A A . 27 VAL HG11 1 1 10 6153 1 1 27 VAL HG12 H 4.647 5.294 -13.562 1.00 . A A . 27 VAL HG12 1 1 10 6154 1 1 27 VAL HG13 H 5.294 3.761 -12.978 1.00 . A A . 27 VAL HG13 1 1 10 6155 1 1 27 VAL HG21 H 7.915 6.956 -13.970 1.00 . A A . 27 VAL HG21 1 1 10 6156 1 1 27 VAL HG22 H 6.290 6.945 -14.655 1.00 . A A . 27 VAL HG22 1 1 10 6157 1 1 27 VAL HG23 H 6.517 7.231 -12.930 1.00 . A A . 27 VAL HG23 1 1 10 6158 1 1 27 VAL N N 7.901 3.285 -12.415 1.00 . A A . 27 VAL N 1 1 10 6159 1 1 27 VAL O O 8.119 6.611 -11.098 1.00 . A A . 27 VAL O 1 1 10 6160 1 1 28 SER C C 6.833 4.235 -7.869 1.00 . A A . 28 SER C 1 1 10 6161 1 1 28 SER CA C 6.987 5.321 -8.930 1.00 . A A . 28 SER CA 1 1 10 6162 1 1 28 SER CB C 5.748 6.218 -8.940 1.00 . A A . 28 SER CB 1 1 10 6163 1 1 28 SER H H 6.914 3.819 -10.420 1.00 . A A . 28 SER H 1 1 10 6164 1 1 28 SER HA H 7.852 5.921 -8.691 1.00 . A A . 28 SER HA 1 1 10 6165 1 1 28 SER HB2 H 5.682 6.727 -9.889 1.00 . A A . 28 SER HB2 1 1 10 6166 1 1 28 SER HB3 H 4.866 5.610 -8.794 1.00 . A A . 28 SER HB3 1 1 10 6167 1 1 28 SER HG H 6.011 8.046 -8.285 1.00 . A A . 28 SER HG 1 1 10 6168 1 1 28 SER N N 7.194 4.743 -10.253 1.00 . A A . 28 SER N 1 1 10 6169 1 1 28 SER O O 5.809 3.555 -7.807 1.00 . A A . 28 SER O 1 1 10 6170 1 1 28 SER OG O 5.811 7.186 -7.907 1.00 . A A . 28 SER OG 1 1 10 6171 1 1 29 SER C C 7.432 3.716 -4.638 1.00 . A A . 29 SER C 1 1 10 6172 1 1 29 SER CA C 7.824 3.082 -5.969 1.00 . A A . 29 SER CA 1 1 10 6173 1 1 29 SER CB C 9.188 2.401 -5.842 1.00 . A A . 29 SER CB 1 1 10 6174 1 1 29 SER H H 8.641 4.657 -7.125 1.00 . A A . 29 SER H 1 1 10 6175 1 1 29 SER HA H 7.083 2.341 -6.232 1.00 . A A . 29 SER HA 1 1 10 6176 1 1 29 SER HB2 H 9.923 3.127 -5.526 1.00 . A A . 29 SER HB2 1 1 10 6177 1 1 29 SER HB3 H 9.126 1.609 -5.109 1.00 . A A . 29 SER HB3 1 1 10 6178 1 1 29 SER HG H 8.888 1.315 -7.444 1.00 . A A . 29 SER HG 1 1 10 6179 1 1 29 SER N N 7.853 4.082 -7.030 1.00 . A A . 29 SER N 1 1 10 6180 1 1 29 SER O O 8.046 4.687 -4.195 1.00 . A A . 29 SER O 1 1 10 6181 1 1 29 SER OG O 9.599 1.847 -7.080 1.00 . A A . 29 SER OG 1 1 10 6182 1 1 30 HIS C C 5.939 2.587 -1.662 1.00 . A A . 30 HIS C 1 1 10 6183 1 1 30 HIS CA C 5.917 3.675 -2.732 1.00 . A A . 30 HIS CA 1 1 10 6184 1 1 30 HIS CB C 4.497 4.220 -2.890 1.00 . A A . 30 HIS CB 1 1 10 6185 1 1 30 HIS CD2 C 4.773 5.100 -5.314 1.00 . A A . 30 HIS CD2 1 1 10 6186 1 1 30 HIS CE1 C 3.717 7.006 -5.086 1.00 . A A . 30 HIS CE1 1 1 10 6187 1 1 30 HIS CG C 4.348 5.178 -4.031 1.00 . A A . 30 HIS CG 1 1 10 6188 1 1 30 HIS H H 5.950 2.394 -4.414 1.00 . A A . 30 HIS H 1 1 10 6189 1 1 30 HIS HA H 6.570 4.478 -2.427 1.00 . A A . 30 HIS HA 1 1 10 6190 1 1 30 HIS HB2 H 3.819 3.396 -3.059 1.00 . A A . 30 HIS HB2 1 1 10 6191 1 1 30 HIS HB3 H 4.213 4.734 -1.983 1.00 . A A . 30 HIS HB3 1 1 10 6192 1 1 30 HIS HD1 H 3.266 6.733 -3.108 1.00 . A A . 30 HIS HD1 1 1 10 6193 1 1 30 HIS HD2 H 5.322 4.282 -5.758 1.00 . A A . 30 HIS HD2 1 1 10 6194 1 1 30 HIS HE1 H 3.279 7.969 -5.298 1.00 . A A . 30 HIS HE1 1 1 10 6195 1 1 30 HIS HE2 H 4.404 6.403 -6.914 1.00 . A A . 30 HIS HE2 1 1 10 6196 1 1 30 HIS N N 6.400 3.163 -4.008 1.00 . A A . 30 HIS N 1 1 10 6197 1 1 30 HIS ND1 N 3.690 6.384 -3.920 1.00 . A A . 30 HIS ND1 1 1 10 6198 1 1 30 HIS NE2 N 4.368 6.248 -5.948 1.00 . A A . 30 HIS NE2 1 1 10 6199 1 1 30 HIS O O 6.486 1.505 -1.874 1.00 . A A . 30 HIS O 1 1 10 6200 1 1 31 TYR C C 4.006 2.117 1.399 1.00 . A A . 31 TYR C 1 1 10 6201 1 1 31 TYR CA C 5.287 1.936 0.592 1.00 . A A . 31 TYR CA 1 1 10 6202 1 1 31 TYR CB C 6.505 2.113 1.500 1.00 . A A . 31 TYR CB 1 1 10 6203 1 1 31 TYR CD1 C 8.594 1.631 0.167 1.00 . A A . 31 TYR CD1 1 1 10 6204 1 1 31 TYR CD2 C 7.860 -0.003 1.739 1.00 . A A . 31 TYR CD2 1 1 10 6205 1 1 31 TYR CE1 C 9.665 0.827 -0.174 1.00 . A A . 31 TYR CE1 1 1 10 6206 1 1 31 TYR CE2 C 8.928 -0.813 1.403 1.00 . A A . 31 TYR CE2 1 1 10 6207 1 1 31 TYR CG C 7.675 1.230 1.128 1.00 . A A . 31 TYR CG 1 1 10 6208 1 1 31 TYR CZ C 9.827 -0.394 0.446 1.00 . A A . 31 TYR CZ 1 1 10 6209 1 1 31 TYR H H 4.922 3.764 -0.408 1.00 . A A . 31 TYR H 1 1 10 6210 1 1 31 TYR HA H 5.300 0.939 0.176 1.00 . A A . 31 TYR HA 1 1 10 6211 1 1 31 TYR HB2 H 6.836 3.140 1.450 1.00 . A A . 31 TYR HB2 1 1 10 6212 1 1 31 TYR HB3 H 6.223 1.881 2.517 1.00 . A A . 31 TYR HB3 1 1 10 6213 1 1 31 TYR HD1 H 8.465 2.588 -0.317 1.00 . A A . 31 TYR HD1 1 1 10 6214 1 1 31 TYR HD2 H 7.153 -0.329 2.488 1.00 . A A . 31 TYR HD2 1 1 10 6215 1 1 31 TYR HE1 H 10.370 1.156 -0.924 1.00 . A A . 31 TYR HE1 1 1 10 6216 1 1 31 TYR HE2 H 9.054 -1.769 1.890 1.00 . A A . 31 TYR HE2 1 1 10 6217 1 1 31 TYR HH H 10.929 -1.297 -0.845 1.00 . A A . 31 TYR HH 1 1 10 6218 1 1 31 TYR N N 5.340 2.885 -0.514 1.00 . A A . 31 TYR N 1 1 10 6219 1 1 31 TYR O O 3.427 3.203 1.425 1.00 . A A . 31 TYR O 1 1 10 6220 1 1 31 TYR OH O 10.892 -1.197 0.109 1.00 . A A . 31 TYR OH 1 1 10 6221 1 1 32 CYS C C 2.691 1.462 4.312 1.00 . A A . 32 CYS C 1 1 10 6222 1 1 32 CYS CA C 2.359 1.098 2.869 1.00 . A A . 32 CYS CA 1 1 10 6223 1 1 32 CYS CB C 1.631 -0.248 2.822 1.00 . A A . 32 CYS CB 1 1 10 6224 1 1 32 CYS H H 4.073 0.211 2.004 1.00 . A A . 32 CYS H 1 1 10 6225 1 1 32 CYS HA H 1.715 1.860 2.458 1.00 . A A . 32 CYS HA 1 1 10 6226 1 1 32 CYS HB2 H 1.993 -0.815 1.977 1.00 . A A . 32 CYS HB2 1 1 10 6227 1 1 32 CYS HB3 H 1.840 -0.794 3.730 1.00 . A A . 32 CYS HB3 1 1 10 6228 1 1 32 CYS N N 3.569 1.049 2.060 1.00 . A A . 32 CYS N 1 1 10 6229 1 1 32 CYS O O 3.755 1.110 4.821 1.00 . A A . 32 CYS O 1 1 10 6230 1 1 32 CYS SG S -0.179 -0.112 2.660 1.00 . A A . 32 CYS SG 1 1 10 6231 1 1 33 THR C C 1.081 1.771 7.287 1.00 . A A . 33 THR C 1 1 10 6232 1 1 33 THR CA C 1.973 2.578 6.349 1.00 . A A . 33 THR CA 1 1 10 6233 1 1 33 THR CB C 1.679 4.071 6.508 1.00 . A A . 33 THR CB 1 1 10 6234 1 1 33 THR CG2 C 2.272 4.920 5.403 1.00 . A A . 33 THR CG2 1 1 10 6235 1 1 33 THR H H 0.947 2.417 4.506 1.00 . A A . 33 THR H 1 1 10 6236 1 1 33 THR HA H 3.005 2.394 6.606 1.00 . A A . 33 THR HA 1 1 10 6237 1 1 33 THR HB H 2.096 4.412 7.445 1.00 . A A . 33 THR HB 1 1 10 6238 1 1 33 THR HG1 H 0.119 5.247 6.643 1.00 . A A . 33 THR HG1 1 1 10 6239 1 1 33 THR HG21 H 3.344 4.790 5.384 1.00 . A A . 33 THR HG21 1 1 10 6240 1 1 33 THR HG22 H 1.856 4.615 4.453 1.00 . A A . 33 THR HG22 1 1 10 6241 1 1 33 THR HG23 H 2.038 5.959 5.582 1.00 . A A . 33 THR HG23 1 1 10 6242 1 1 33 THR N N 1.776 2.167 4.965 1.00 . A A . 33 THR N 1 1 10 6243 1 1 33 THR O O 0.772 2.209 8.395 1.00 . A A . 33 THR O 1 1 10 6244 1 1 33 THR OG1 O 0.283 4.308 6.529 1.00 . A A . 33 THR OG1 1 1 10 6245 1 1 34 GLY C C -1.383 0.478 8.214 1.00 . A A . 34 GLY C 1 1 10 6246 1 1 34 GLY CA C -0.184 -0.262 7.649 1.00 . A A . 34 GLY CA 1 1 10 6247 1 1 34 GLY H H 0.949 0.289 5.944 1.00 . A A . 34 GLY H 1 1 10 6248 1 1 34 GLY HA2 H 0.398 -0.658 8.468 1.00 . A A . 34 GLY HA2 1 1 10 6249 1 1 34 GLY HA3 H -0.536 -1.083 7.043 1.00 . A A . 34 GLY HA3 1 1 10 6250 1 1 34 GLY N N 0.670 0.588 6.836 1.00 . A A . 34 GLY N 1 1 10 6251 1 1 34 GLY O O -1.915 0.105 9.260 1.00 . A A . 34 GLY O 1 1 10 6252 1 1 35 ARG C C -4.102 2.219 6.971 1.00 . A A . 35 ARG C 1 1 10 6253 1 1 35 ARG CA C -2.949 2.326 7.961 1.00 . A A . 35 ARG CA 1 1 10 6254 1 1 35 ARG CB C -2.542 3.791 8.131 1.00 . A A . 35 ARG CB 1 1 10 6255 1 1 35 ARG CD C -2.676 4.464 10.549 1.00 . A A . 35 ARG CD 1 1 10 6256 1 1 35 ARG CG C -3.350 4.528 9.187 1.00 . A A . 35 ARG CG 1 1 10 6257 1 1 35 ARG CZ C -3.327 4.246 12.915 1.00 . A A . 35 ARG CZ 1 1 10 6258 1 1 35 ARG H H -1.342 1.780 6.696 1.00 . A A . 35 ARG H 1 1 10 6259 1 1 35 ARG HA H -3.274 1.940 8.912 1.00 . A A . 35 ARG HA 1 1 10 6260 1 1 35 ARG HB2 H -1.500 3.833 8.411 1.00 . A A . 35 ARG HB2 1 1 10 6261 1 1 35 ARG HB3 H -2.673 4.301 7.188 1.00 . A A . 35 ARG HB3 1 1 10 6262 1 1 35 ARG HD2 H -2.082 3.564 10.600 1.00 . A A . 35 ARG HD2 1 1 10 6263 1 1 35 ARG HD3 H -2.034 5.325 10.659 1.00 . A A . 35 ARG HD3 1 1 10 6264 1 1 35 ARG HE H -4.587 4.608 11.411 1.00 . A A . 35 ARG HE 1 1 10 6265 1 1 35 ARG HG2 H -3.449 5.562 8.894 1.00 . A A . 35 ARG HG2 1 1 10 6266 1 1 35 ARG HG3 H -4.329 4.076 9.258 1.00 . A A . 35 ARG HG3 1 1 10 6267 1 1 35 ARG HH11 H -1.346 4.026 12.567 1.00 . A A . 35 ARG HH11 1 1 10 6268 1 1 35 ARG HH12 H -1.829 3.878 14.223 1.00 . A A . 35 ARG HH12 1 1 10 6269 1 1 35 ARG HH21 H -5.225 4.413 13.589 1.00 . A A . 35 ARG HH21 1 1 10 6270 1 1 35 ARG HH22 H -4.031 4.097 14.804 1.00 . A A . 35 ARG HH22 1 1 10 6271 1 1 35 ARG N N -1.808 1.531 7.521 1.00 . A A . 35 ARG N 1 1 10 6272 1 1 35 ARG NE N -3.647 4.453 11.640 1.00 . A A . 35 ARG NE 1 1 10 6273 1 1 35 ARG NH1 N -2.064 4.033 13.263 1.00 . A A . 35 ARG NH1 1 1 10 6274 1 1 35 ARG NH2 N -4.272 4.253 13.846 1.00 . A A . 35 ARG NH2 1 1 10 6275 1 1 35 ARG O O -5.184 1.738 7.308 1.00 . A A . 35 ARG O 1 1 10 6276 1 1 36 SER C C -4.495 1.610 3.628 1.00 . A A . 36 SER C 1 1 10 6277 1 1 36 SER CA C -4.871 2.628 4.699 1.00 . A A . 36 SER CA 1 1 10 6278 1 1 36 SER CB C -5.040 4.011 4.069 1.00 . A A . 36 SER CB 1 1 10 6279 1 1 36 SER H H -2.975 3.039 5.547 1.00 . A A . 36 SER H 1 1 10 6280 1 1 36 SER HA H -5.805 2.330 5.151 1.00 . A A . 36 SER HA 1 1 10 6281 1 1 36 SER HB2 H -4.402 4.089 3.201 1.00 . A A . 36 SER HB2 1 1 10 6282 1 1 36 SER HB3 H -6.070 4.145 3.771 1.00 . A A . 36 SER HB3 1 1 10 6283 1 1 36 SER HG H -5.301 5.771 4.888 1.00 . A A . 36 SER HG 1 1 10 6284 1 1 36 SER N N -3.859 2.670 5.749 1.00 . A A . 36 SER N 1 1 10 6285 1 1 36 SER O O -3.381 1.086 3.621 1.00 . A A . 36 SER O 1 1 10 6286 1 1 36 SER OG O -4.692 5.035 4.984 1.00 . A A . 36 SER OG 1 1 10 6287 1 1 37 CYS C C -4.853 1.094 0.343 1.00 . A A . 37 CYS C 1 1 10 6288 1 1 37 CYS CA C -5.185 0.378 1.649 1.00 . A A . 37 CYS CA 1 1 10 6289 1 1 37 CYS CB C -6.401 -0.529 1.457 1.00 . A A . 37 CYS CB 1 1 10 6290 1 1 37 CYS H H -6.297 1.783 2.775 1.00 . A A . 37 CYS H 1 1 10 6291 1 1 37 CYS HA H -4.340 -0.230 1.936 1.00 . A A . 37 CYS HA 1 1 10 6292 1 1 37 CYS HB2 H -7.296 0.027 1.696 1.00 . A A . 37 CYS HB2 1 1 10 6293 1 1 37 CYS HB3 H -6.444 -0.846 0.427 1.00 . A A . 37 CYS HB3 1 1 10 6294 1 1 37 CYS N N -5.428 1.333 2.723 1.00 . A A . 37 CYS N 1 1 10 6295 1 1 37 CYS O O -4.899 0.497 -0.732 1.00 . A A . 37 CYS O 1 1 10 6296 1 1 37 CYS SG S -6.382 -2.023 2.501 1.00 . A A . 37 CYS SG 1 1 10 6297 1 1 38 GLU C C -2.756 3.729 -0.611 1.00 . A A . 38 GLU C 1 1 10 6298 1 1 38 GLU CA C -4.172 3.173 -0.729 1.00 . A A . 38 GLU CA 1 1 10 6299 1 1 38 GLU CB C -5.170 4.319 -0.904 1.00 . A A . 38 GLU CB 1 1 10 6300 1 1 38 GLU CD C -4.043 5.915 -2.505 1.00 . A A . 38 GLU CD 1 1 10 6301 1 1 38 GLU CG C -5.168 4.920 -2.300 1.00 . A A . 38 GLU CG 1 1 10 6302 1 1 38 GLU H H -4.495 2.798 1.328 1.00 . A A . 38 GLU H 1 1 10 6303 1 1 38 GLU HA H -4.222 2.528 -1.594 1.00 . A A . 38 GLU HA 1 1 10 6304 1 1 38 GLU HB2 H -6.164 3.951 -0.695 1.00 . A A . 38 GLU HB2 1 1 10 6305 1 1 38 GLU HB3 H -4.930 5.101 -0.199 1.00 . A A . 38 GLU HB3 1 1 10 6306 1 1 38 GLU HG2 H -5.058 4.123 -3.021 1.00 . A A . 38 GLU HG2 1 1 10 6307 1 1 38 GLU HG3 H -6.110 5.424 -2.463 1.00 . A A . 38 GLU HG3 1 1 10 6308 1 1 38 GLU N N -4.516 2.377 0.444 1.00 . A A . 38 GLU N 1 1 10 6309 1 1 38 GLU O O -2.512 4.678 0.135 1.00 . A A . 38 GLU O 1 1 10 6310 1 1 38 GLU OE1 O -3.398 5.870 -3.573 1.00 . A A . 38 GLU OE1 1 1 10 6311 1 1 38 GLU OE2 O -3.808 6.741 -1.598 1.00 . A A . 38 GLU OE2 1 1 10 6312 1 1 39 CYS C C -0.317 5.070 -1.556 1.00 . A A . 39 CYS C 1 1 10 6313 1 1 39 CYS CA C -0.431 3.562 -1.330 1.00 . A A . 39 CYS CA 1 1 10 6314 1 1 39 CYS CB C 0.370 2.815 -2.399 1.00 . A A . 39 CYS CB 1 1 10 6315 1 1 39 CYS H H -2.084 2.379 -1.923 1.00 . A A . 39 CYS H 1 1 10 6316 1 1 39 CYS HA H -0.027 3.322 -0.358 1.00 . A A . 39 CYS HA 1 1 10 6317 1 1 39 CYS HB2 H 0.038 3.134 -3.376 1.00 . A A . 39 CYS HB2 1 1 10 6318 1 1 39 CYS HB3 H 1.417 3.052 -2.285 1.00 . A A . 39 CYS HB3 1 1 10 6319 1 1 39 CYS N N -1.826 3.130 -1.350 1.00 . A A . 39 CYS N 1 1 10 6320 1 1 39 CYS O O -1.051 5.640 -2.363 1.00 . A A . 39 CYS O 1 1 10 6321 1 1 39 CYS SG S 0.200 1.001 -2.324 1.00 . A A . 39 CYS SG 1 1 10 6322 1 1 40 PRO C C 1.033 7.611 -2.419 1.00 . A A . 40 PRO C 1 1 10 6323 1 1 40 PRO CA C 0.810 7.186 -0.973 1.00 . A A . 40 PRO CA 1 1 10 6324 1 1 40 PRO CB C 2.066 7.449 -0.139 1.00 . A A . 40 PRO CB 1 1 10 6325 1 1 40 PRO CD C 1.527 5.139 0.144 1.00 . A A . 40 PRO CD 1 1 10 6326 1 1 40 PRO CG C 2.110 6.333 0.846 1.00 . A A . 40 PRO CG 1 1 10 6327 1 1 40 PRO HA H -0.022 7.739 -0.561 1.00 . A A . 40 PRO HA 1 1 10 6328 1 1 40 PRO HB2 H 2.935 7.445 -0.782 1.00 . A A . 40 PRO HB2 1 1 10 6329 1 1 40 PRO HB3 H 1.981 8.406 0.353 1.00 . A A . 40 PRO HB3 1 1 10 6330 1 1 40 PRO HD2 H 2.304 4.573 -0.347 1.00 . A A . 40 PRO HD2 1 1 10 6331 1 1 40 PRO HD3 H 0.989 4.517 0.843 1.00 . A A . 40 PRO HD3 1 1 10 6332 1 1 40 PRO HG2 H 3.133 6.137 1.133 1.00 . A A . 40 PRO HG2 1 1 10 6333 1 1 40 PRO HG3 H 1.517 6.585 1.713 1.00 . A A . 40 PRO HG3 1 1 10 6334 1 1 40 PRO N N 0.608 5.738 -0.842 1.00 . A A . 40 PRO N 1 1 10 6335 1 1 40 PRO O O 1.072 6.776 -3.324 1.00 . A A . 40 PRO O 1 1 10 6336 1 1 41 SER C C 2.789 10.074 -4.082 1.00 . A A . 41 SER C 1 1 10 6337 1 1 41 SER CA C 1.401 9.452 -3.968 1.00 . A A . 41 SER CA 1 1 10 6338 1 1 41 SER CB C 0.333 10.494 -4.305 1.00 . A A . 41 SER CB 1 1 10 6339 1 1 41 SER H H 1.140 9.530 -1.869 1.00 . A A . 41 SER H 1 1 10 6340 1 1 41 SER HA H 1.329 8.635 -4.670 1.00 . A A . 41 SER HA 1 1 10 6341 1 1 41 SER HB2 H 0.320 11.254 -3.538 1.00 . A A . 41 SER HB2 1 1 10 6342 1 1 41 SER HB3 H 0.564 10.949 -5.258 1.00 . A A . 41 SER HB3 1 1 10 6343 1 1 41 SER HG H -1.566 10.520 -4.784 1.00 . A A . 41 SER HG 1 1 10 6344 1 1 41 SER N N 1.180 8.915 -2.631 1.00 . A A . 41 SER N 1 1 10 6345 1 1 41 SER O O 2.980 11.069 -4.781 1.00 . A A . 41 SER O 1 1 10 6346 1 1 41 SER OG O -0.952 9.902 -4.382 1.00 . A A . 41 SER OG 1 1 10 6347 1 1 42 TYR C C 6.120 8.824 -3.241 1.00 . A A . 42 TYR C 1 1 10 6348 1 1 42 TYR CA C 5.128 9.973 -3.413 1.00 . A A . 42 TYR CA 1 1 10 6349 1 1 42 TYR CB C 5.337 11.015 -2.312 1.00 . A A . 42 TYR CB 1 1 10 6350 1 1 42 TYR CD1 C 6.310 9.862 -0.288 1.00 . A A . 42 TYR CD1 1 1 10 6351 1 1 42 TYR CD2 C 4.018 10.514 -0.218 1.00 . A A . 42 TYR CD2 1 1 10 6352 1 1 42 TYR CE1 C 6.206 9.347 0.991 1.00 . A A . 42 TYR CE1 1 1 10 6353 1 1 42 TYR CE2 C 3.907 10.001 1.061 1.00 . A A . 42 TYR CE2 1 1 10 6354 1 1 42 TYR CG C 5.219 10.453 -0.913 1.00 . A A . 42 TYR CG 1 1 10 6355 1 1 42 TYR CZ C 5.003 9.419 1.660 1.00 . A A . 42 TYR CZ 1 1 10 6356 1 1 42 TYR H H 3.541 8.690 -2.851 1.00 . A A . 42 TYR H 1 1 10 6357 1 1 42 TYR HA H 5.296 10.438 -4.373 1.00 . A A . 42 TYR HA 1 1 10 6358 1 1 42 TYR HB2 H 6.323 11.443 -2.414 1.00 . A A . 42 TYR HB2 1 1 10 6359 1 1 42 TYR HB3 H 4.598 11.795 -2.420 1.00 . A A . 42 TYR HB3 1 1 10 6360 1 1 42 TYR HD1 H 7.251 9.807 -0.814 1.00 . A A . 42 TYR HD1 1 1 10 6361 1 1 42 TYR HD2 H 3.160 10.970 -0.691 1.00 . A A . 42 TYR HD2 1 1 10 6362 1 1 42 TYR HE1 H 7.066 8.891 1.460 1.00 . A A . 42 TYR HE1 1 1 10 6363 1 1 42 TYR HE2 H 2.964 10.058 1.585 1.00 . A A . 42 TYR HE2 1 1 10 6364 1 1 42 TYR HH H 4.354 9.491 3.468 1.00 . A A . 42 TYR HH 1 1 10 6365 1 1 42 TYR N N 3.756 9.480 -3.390 1.00 . A A . 42 TYR N 1 1 10 6366 1 1 42 TYR O O 5.832 7.843 -2.557 1.00 . A A . 42 TYR O 1 1 10 6367 1 1 42 TYR OH O 4.896 8.908 2.933 1.00 . A A . 42 TYR OH 1 1 10 6368 1 1 43 PRO C C 8.989 7.842 -2.396 1.00 . A A . 43 PRO C 1 1 10 6369 1 1 43 PRO CA C 8.340 7.897 -3.775 1.00 . A A . 43 PRO CA 1 1 10 6370 1 1 43 PRO CB C 9.362 8.326 -4.829 1.00 . A A . 43 PRO CB 1 1 10 6371 1 1 43 PRO CD C 7.733 10.070 -4.700 1.00 . A A . 43 PRO CD 1 1 10 6372 1 1 43 PRO CG C 9.194 9.801 -4.938 1.00 . A A . 43 PRO CG 1 1 10 6373 1 1 43 PRO HA H 7.947 6.923 -4.025 1.00 . A A . 43 PRO HA 1 1 10 6374 1 1 43 PRO HB2 H 10.357 8.063 -4.499 1.00 . A A . 43 PRO HB2 1 1 10 6375 1 1 43 PRO HB3 H 9.146 7.834 -5.766 1.00 . A A . 43 PRO HB3 1 1 10 6376 1 1 43 PRO HD2 H 7.602 11.005 -4.175 1.00 . A A . 43 PRO HD2 1 1 10 6377 1 1 43 PRO HD3 H 7.194 10.083 -5.636 1.00 . A A . 43 PRO HD3 1 1 10 6378 1 1 43 PRO HG2 H 9.793 10.296 -4.188 1.00 . A A . 43 PRO HG2 1 1 10 6379 1 1 43 PRO HG3 H 9.479 10.132 -5.926 1.00 . A A . 43 PRO HG3 1 1 10 6380 1 1 43 PRO N N 7.307 8.933 -3.863 1.00 . A A . 43 PRO N 1 1 10 6381 1 1 43 PRO O O 9.746 8.736 -2.018 1.00 . A A . 43 PRO O 1 1 10 6382 1 1 44 GLY C C 10.649 6.058 -0.343 1.00 . A A . 44 GLY C 1 1 10 6383 1 1 44 GLY CA C 9.247 6.634 -0.318 1.00 . A A . 44 GLY CA 1 1 10 6384 1 1 44 GLY H H 8.076 6.105 -2.000 1.00 . A A . 44 GLY H 1 1 10 6385 1 1 44 GLY HA2 H 8.611 5.978 0.257 1.00 . A A . 44 GLY HA2 1 1 10 6386 1 1 44 GLY HA3 H 9.276 7.601 0.162 1.00 . A A . 44 GLY HA3 1 1 10 6387 1 1 44 GLY N N 8.686 6.786 -1.647 1.00 . A A . 44 GLY N 1 1 10 6388 1 1 44 GLY O O 10.898 5.040 -0.989 1.00 . A A . 44 GLY O 1 1 10 6389 1 1 45 ASN C C 13.708 6.954 1.546 1.00 . A A . 45 ASN C 1 1 10 6390 1 1 45 ASN CA C 12.953 6.258 0.418 1.00 . A A . 45 ASN CA 1 1 10 6391 1 1 45 ASN CB C 13.652 6.521 -0.917 1.00 . A A . 45 ASN CB 1 1 10 6392 1 1 45 ASN CG C 14.818 5.582 -1.154 1.00 . A A . 45 ASN CG 1 1 10 6393 1 1 45 ASN H H 11.308 7.517 0.856 1.00 . A A . 45 ASN H 1 1 10 6394 1 1 45 ASN HA H 12.946 5.195 0.607 1.00 . A A . 45 ASN HA 1 1 10 6395 1 1 45 ASN HB2 H 12.941 6.392 -1.720 1.00 . A A . 45 ASN HB2 1 1 10 6396 1 1 45 ASN HB3 H 14.021 7.536 -0.929 1.00 . A A . 45 ASN HB3 1 1 10 6397 1 1 45 ASN HD21 H 13.981 4.927 -2.834 1.00 . A A . 45 ASN HD21 1 1 10 6398 1 1 45 ASN HD22 H 15.502 4.216 -2.427 1.00 . A A . 45 ASN HD22 1 1 10 6399 1 1 45 ASN N N 11.568 6.711 0.362 1.00 . A A . 45 ASN N 1 1 10 6400 1 1 45 ASN ND2 N 14.761 4.833 -2.249 1.00 . A A . 45 ASN ND2 1 1 10 6401 1 1 45 ASN O O 14.457 6.320 2.288 1.00 . A A . 45 ASN O 1 1 10 6402 1 1 45 ASN OD1 O 15.759 5.531 -0.363 1.00 . A A . 45 ASN OD1 1 1 10 6403 1 1 46 GLY C C 13.850 10.502 2.643 1.00 . A A . 46 GLY C 1 1 10 6404 1 1 46 GLY CA C 14.173 9.022 2.707 1.00 . A A . 46 GLY CA 1 1 10 6405 1 1 46 GLY H H 12.897 8.715 1.047 1.00 . A A . 46 GLY H 1 1 10 6406 1 1 46 GLY HA2 H 15.241 8.894 2.602 1.00 . A A . 46 GLY HA2 1 1 10 6407 1 1 46 GLY HA3 H 13.869 8.639 3.670 1.00 . A A . 46 GLY HA3 1 1 10 6408 1 1 46 GLY N N 13.505 8.262 1.668 1.00 . A A . 46 GLY N 1 1 10 6409 1 1 46 GLY O O 13.003 10.959 3.440 1.00 . A A . 46 GLY O 1 1 10 6410 1 1 46 GLY OXT O 14.443 11.204 1.798 1.00 . A A . 46 GLY OXT 1 1 11 6411 1 1 1 ALA C C -19.157 -4.242 5.658 1.00 . A A . 1 ALA C 1 1 11 6412 1 1 1 ALA CA C -20.356 -3.377 5.283 1.00 . A A . 1 ALA CA 1 1 11 6413 1 1 1 ALA CB C -21.651 -4.137 5.530 1.00 . A A . 1 ALA CB 1 1 11 6414 1 1 1 ALA H1 H -20.153 -3.791 3.279 1.00 . A A . 1 ALA H1 1 1 11 6415 1 1 1 ALA H2 H -21.164 -2.453 3.633 1.00 . A A . 1 ALA H2 1 1 11 6416 1 1 1 ALA H3 H -19.461 -2.302 3.776 1.00 . A A . 1 ALA H3 1 1 11 6417 1 1 1 ALA HA H -20.360 -2.497 5.910 1.00 . A A . 1 ALA HA 1 1 11 6418 1 1 1 ALA HB1 H -22.464 -3.435 5.644 1.00 . A A . 1 ALA HB1 1 1 11 6419 1 1 1 ALA HB2 H -21.556 -4.727 6.429 1.00 . A A . 1 ALA HB2 1 1 11 6420 1 1 1 ALA HB3 H -21.852 -4.787 4.691 1.00 . A A . 1 ALA HB3 1 1 11 6421 1 1 1 ALA N N -20.276 -2.942 3.865 1.00 . A A . 1 ALA N 1 1 11 6422 1 1 1 ALA O O -18.247 -3.790 6.353 1.00 . A A . 1 ALA O 1 1 11 6423 1 1 2 MET C C -17.094 -6.480 4.314 1.00 . A A . 2 MET C 1 1 11 6424 1 1 2 MET CA C -18.076 -6.415 5.480 1.00 . A A . 2 MET CA 1 1 11 6425 1 1 2 MET CB C -18.631 -7.810 5.773 1.00 . A A . 2 MET CB 1 1 11 6426 1 1 2 MET CE C -22.219 -8.910 5.862 1.00 . A A . 2 MET CE 1 1 11 6427 1 1 2 MET CG C -19.825 -7.804 6.714 1.00 . A A . 2 MET CG 1 1 11 6428 1 1 2 MET H H -19.917 -5.789 4.645 1.00 . A A . 2 MET H 1 1 11 6429 1 1 2 MET HA H -17.554 -6.055 6.354 1.00 . A A . 2 MET HA 1 1 11 6430 1 1 2 MET HB2 H -18.936 -8.266 4.842 1.00 . A A . 2 MET HB2 1 1 11 6431 1 1 2 MET HB3 H -17.852 -8.409 6.219 1.00 . A A . 2 MET HB3 1 1 11 6432 1 1 2 MET HE1 H -21.974 -8.288 5.014 1.00 . A A . 2 MET HE1 1 1 11 6433 1 1 2 MET HE2 H -22.727 -9.800 5.521 1.00 . A A . 2 MET HE2 1 1 11 6434 1 1 2 MET HE3 H -22.863 -8.364 6.536 1.00 . A A . 2 MET HE3 1 1 11 6435 1 1 2 MET HG2 H -19.476 -7.603 7.716 1.00 . A A . 2 MET HG2 1 1 11 6436 1 1 2 MET HG3 H -20.504 -7.022 6.407 1.00 . A A . 2 MET HG3 1 1 11 6437 1 1 2 MET N N -19.163 -5.487 5.194 1.00 . A A . 2 MET N 1 1 11 6438 1 1 2 MET O O -16.543 -7.539 4.012 1.00 . A A . 2 MET O 1 1 11 6439 1 1 2 MET SD S -20.715 -9.373 6.717 1.00 . A A . 2 MET SD 1 1 11 6440 1 1 3 ASP C C -14.517 -5.382 2.992 1.00 . A A . 3 ASP C 1 1 11 6441 1 1 3 ASP CA C -15.966 -5.270 2.529 1.00 . A A . 3 ASP CA 1 1 11 6442 1 1 3 ASP CB C -16.170 -3.960 1.765 1.00 . A A . 3 ASP CB 1 1 11 6443 1 1 3 ASP CG C -15.689 -4.047 0.330 1.00 . A A . 3 ASP CG 1 1 11 6444 1 1 3 ASP H H -17.350 -4.531 3.951 1.00 . A A . 3 ASP H 1 1 11 6445 1 1 3 ASP HA H -16.187 -6.098 1.872 1.00 . A A . 3 ASP HA 1 1 11 6446 1 1 3 ASP HB2 H -17.221 -3.715 1.758 1.00 . A A . 3 ASP HB2 1 1 11 6447 1 1 3 ASP HB3 H -15.623 -3.172 2.262 1.00 . A A . 3 ASP HB3 1 1 11 6448 1 1 3 ASP N N -16.881 -5.342 3.663 1.00 . A A . 3 ASP N 1 1 11 6449 1 1 3 ASP O O -14.173 -4.961 4.097 1.00 . A A . 3 ASP O 1 1 11 6450 1 1 3 ASP OD1 O -14.729 -3.328 -0.019 1.00 . A A . 3 ASP OD1 1 1 11 6451 1 1 3 ASP OD2 O -16.271 -4.836 -0.444 1.00 . A A . 3 ASP OD2 1 1 11 6452 1 1 4 CYS C C -11.430 -4.978 1.881 1.00 . A A . 4 CYS C 1 1 11 6453 1 1 4 CYS CA C -12.259 -6.119 2.461 1.00 . A A . 4 CYS CA 1 1 11 6454 1 1 4 CYS CB C -11.746 -7.456 1.923 1.00 . A A . 4 CYS CB 1 1 11 6455 1 1 4 CYS H H -14.005 -6.267 1.274 1.00 . A A . 4 CYS H 1 1 11 6456 1 1 4 CYS HA H -12.160 -6.111 3.536 1.00 . A A . 4 CYS HA 1 1 11 6457 1 1 4 CYS HB2 H -12.242 -7.674 0.989 1.00 . A A . 4 CYS HB2 1 1 11 6458 1 1 4 CYS HB3 H -10.682 -7.380 1.749 1.00 . A A . 4 CYS HB3 1 1 11 6459 1 1 4 CYS N N -13.672 -5.951 2.140 1.00 . A A . 4 CYS N 1 1 11 6460 1 1 4 CYS O O -11.759 -4.430 0.829 1.00 . A A . 4 CYS O 1 1 11 6461 1 1 4 CYS SG S -12.027 -8.867 3.040 1.00 . A A . 4 CYS SG 1 1 11 6462 1 1 5 THR C C -8.897 -3.871 0.745 1.00 . A A . 5 THR C 1 1 11 6463 1 1 5 THR CA C -9.470 -3.555 2.123 1.00 . A A . 5 THR CA 1 1 11 6464 1 1 5 THR CB C -8.334 -3.342 3.129 1.00 . A A . 5 THR CB 1 1 11 6465 1 1 5 THR CG2 C -8.336 -1.961 3.748 1.00 . A A . 5 THR CG2 1 1 11 6466 1 1 5 THR H H -10.139 -5.104 3.402 1.00 . A A . 5 THR H 1 1 11 6467 1 1 5 THR HA H -10.055 -2.649 2.058 1.00 . A A . 5 THR HA 1 1 11 6468 1 1 5 THR HB H -7.388 -3.476 2.624 1.00 . A A . 5 THR HB 1 1 11 6469 1 1 5 THR HG1 H -7.572 -4.744 4.264 1.00 . A A . 5 THR HG1 1 1 11 6470 1 1 5 THR HG21 H -9.233 -1.436 3.455 1.00 . A A . 5 THR HG21 1 1 11 6471 1 1 5 THR HG22 H -8.306 -2.049 4.824 1.00 . A A . 5 THR HG22 1 1 11 6472 1 1 5 THR HG23 H -7.470 -1.412 3.407 1.00 . A A . 5 THR HG23 1 1 11 6473 1 1 5 THR N N -10.350 -4.627 2.572 1.00 . A A . 5 THR N 1 1 11 6474 1 1 5 THR O O -8.294 -4.924 0.539 1.00 . A A . 5 THR O 1 1 11 6475 1 1 5 THR OG1 O -8.411 -4.284 4.184 1.00 . A A . 5 THR OG1 1 1 11 6476 1 1 6 THR C C -7.895 -1.883 -2.057 1.00 . A A . 6 THR C 1 1 11 6477 1 1 6 THR CA C -8.597 -3.140 -1.556 1.00 . A A . 6 THR CA 1 1 11 6478 1 1 6 THR CB C -9.747 -3.506 -2.495 1.00 . A A . 6 THR CB 1 1 11 6479 1 1 6 THR CG2 C -9.969 -4.999 -2.616 1.00 . A A . 6 THR CG2 1 1 11 6480 1 1 6 THR H H -9.583 -2.136 0.025 1.00 . A A . 6 THR H 1 1 11 6481 1 1 6 THR HA H -7.886 -3.952 -1.540 1.00 . A A . 6 THR HA 1 1 11 6482 1 1 6 THR HB H -9.528 -3.124 -3.482 1.00 . A A . 6 THR HB 1 1 11 6483 1 1 6 THR HG1 H -10.832 -1.986 -1.906 1.00 . A A . 6 THR HG1 1 1 11 6484 1 1 6 THR HG21 H -9.206 -5.522 -2.058 1.00 . A A . 6 THR HG21 1 1 11 6485 1 1 6 THR HG22 H -10.941 -5.251 -2.220 1.00 . A A . 6 THR HG22 1 1 11 6486 1 1 6 THR HG23 H -9.917 -5.287 -3.655 1.00 . A A . 6 THR HG23 1 1 11 6487 1 1 6 THR N N -9.093 -2.955 -0.197 1.00 . A A . 6 THR N 1 1 11 6488 1 1 6 THR O O -8.196 -0.774 -1.616 1.00 . A A . 6 THR O 1 1 11 6489 1 1 6 THR OG1 O -10.961 -2.926 -2.052 1.00 . A A . 6 THR OG1 1 1 11 6490 1 1 7 GLY C C -4.824 -1.318 -3.966 1.00 . A A . 7 GLY C 1 1 11 6491 1 1 7 GLY CA C -6.226 -0.939 -3.528 1.00 . A A . 7 GLY CA 1 1 11 6492 1 1 7 GLY H H -6.761 -2.973 -3.294 1.00 . A A . 7 GLY H 1 1 11 6493 1 1 7 GLY HA2 H -6.160 -0.167 -2.776 1.00 . A A . 7 GLY HA2 1 1 11 6494 1 1 7 GLY HA3 H -6.766 -0.552 -4.380 1.00 . A A . 7 GLY HA3 1 1 11 6495 1 1 7 GLY N N -6.958 -2.065 -2.981 1.00 . A A . 7 GLY N 1 1 11 6496 1 1 7 GLY O O -4.555 -2.485 -4.249 1.00 . A A . 7 GLY O 1 1 11 6497 1 1 8 PRO C C -1.704 -1.271 -3.344 1.00 . A A . 8 PRO C 1 1 11 6498 1 1 8 PRO CA C -2.518 -0.591 -4.442 1.00 . A A . 8 PRO CA 1 1 11 6499 1 1 8 PRO CB C -1.957 0.813 -4.733 1.00 . A A . 8 PRO CB 1 1 11 6500 1 1 8 PRO CD C -4.123 1.069 -3.719 1.00 . A A . 8 PRO CD 1 1 11 6501 1 1 8 PRO CG C -3.105 1.762 -4.576 1.00 . A A . 8 PRO CG 1 1 11 6502 1 1 8 PRO HA H -2.474 -1.190 -5.340 1.00 . A A . 8 PRO HA 1 1 11 6503 1 1 8 PRO HB2 H -1.168 1.037 -4.031 1.00 . A A . 8 PRO HB2 1 1 11 6504 1 1 8 PRO HB3 H -1.563 0.840 -5.738 1.00 . A A . 8 PRO HB3 1 1 11 6505 1 1 8 PRO HD2 H -3.938 1.268 -2.674 1.00 . A A . 8 PRO HD2 1 1 11 6506 1 1 8 PRO HD3 H -5.122 1.373 -3.994 1.00 . A A . 8 PRO HD3 1 1 11 6507 1 1 8 PRO HG2 H -2.766 2.667 -4.093 1.00 . A A . 8 PRO HG2 1 1 11 6508 1 1 8 PRO HG3 H -3.525 1.990 -5.545 1.00 . A A . 8 PRO HG3 1 1 11 6509 1 1 8 PRO N N -3.900 -0.345 -4.034 1.00 . A A . 8 PRO N 1 1 11 6510 1 1 8 PRO O O -0.713 -1.946 -3.620 1.00 . A A . 8 PRO O 1 1 11 6511 1 1 9 CYS C C -2.247 -2.825 -0.353 1.00 . A A . 9 CYS C 1 1 11 6512 1 1 9 CYS CA C -1.437 -1.680 -0.957 1.00 . A A . 9 CYS CA 1 1 11 6513 1 1 9 CYS CB C -1.167 -0.618 0.110 1.00 . A A . 9 CYS CB 1 1 11 6514 1 1 9 CYS H H -2.924 -0.537 -1.938 1.00 . A A . 9 CYS H 1 1 11 6515 1 1 9 CYS HA H -0.495 -2.071 -1.309 1.00 . A A . 9 CYS HA 1 1 11 6516 1 1 9 CYS HB2 H -0.662 0.220 -0.346 1.00 . A A . 9 CYS HB2 1 1 11 6517 1 1 9 CYS HB3 H -2.108 -0.284 0.520 1.00 . A A . 9 CYS HB3 1 1 11 6518 1 1 9 CYS N N -2.129 -1.087 -2.097 1.00 . A A . 9 CYS N 1 1 11 6519 1 1 9 CYS O O -1.693 -3.713 0.295 1.00 . A A . 9 CYS O 1 1 11 6520 1 1 9 CYS SG S -0.133 -1.199 1.493 1.00 . A A . 9 CYS SG 1 1 11 6521 1 1 10 CYS C C -4.725 -4.897 -1.094 1.00 . A A . 10 CYS C 1 1 11 6522 1 1 10 CYS CA C -4.436 -3.836 -0.037 1.00 . A A . 10 CYS CA 1 1 11 6523 1 1 10 CYS CB C -5.747 -3.224 0.458 1.00 . A A . 10 CYS CB 1 1 11 6524 1 1 10 CYS H H -3.946 -2.065 -1.087 1.00 . A A . 10 CYS H 1 1 11 6525 1 1 10 CYS HA H -3.932 -4.303 0.795 1.00 . A A . 10 CYS HA 1 1 11 6526 1 1 10 CYS HB2 H -6.308 -2.859 -0.389 1.00 . A A . 10 CYS HB2 1 1 11 6527 1 1 10 CYS HB3 H -6.322 -3.986 0.963 1.00 . A A . 10 CYS HB3 1 1 11 6528 1 1 10 CYS N N -3.559 -2.798 -0.566 1.00 . A A . 10 CYS N 1 1 11 6529 1 1 10 CYS O O -5.252 -4.595 -2.165 1.00 . A A . 10 CYS O 1 1 11 6530 1 1 10 CYS SG S -5.528 -1.835 1.617 1.00 . A A . 10 CYS SG 1 1 11 6531 1 1 11 ARG C C -4.783 -8.565 -0.947 1.00 . A A . 11 ARG C 1 1 11 6532 1 1 11 ARG CA C -4.601 -7.251 -1.704 1.00 . A A . 11 ARG CA 1 1 11 6533 1 1 11 ARG CB C -3.431 -7.371 -2.682 1.00 . A A . 11 ARG CB 1 1 11 6534 1 1 11 ARG CD C -2.512 -9.009 -4.351 1.00 . A A . 11 ARG CD 1 1 11 6535 1 1 11 ARG CG C -3.738 -8.236 -3.894 1.00 . A A . 11 ARG CG 1 1 11 6536 1 1 11 ARG CZ C -2.266 -8.365 -6.717 1.00 . A A . 11 ARG CZ 1 1 11 6537 1 1 11 ARG H H -3.964 -6.317 0.088 1.00 . A A . 11 ARG H 1 1 11 6538 1 1 11 ARG HA H -5.503 -7.043 -2.260 1.00 . A A . 11 ARG HA 1 1 11 6539 1 1 11 ARG HB2 H -3.164 -6.384 -3.029 1.00 . A A . 11 ARG HB2 1 1 11 6540 1 1 11 ARG HB3 H -2.587 -7.802 -2.164 1.00 . A A . 11 ARG HB3 1 1 11 6541 1 1 11 ARG HD2 H -1.827 -9.097 -3.521 1.00 . A A . 11 ARG HD2 1 1 11 6542 1 1 11 ARG HD3 H -2.821 -9.994 -4.668 1.00 . A A . 11 ARG HD3 1 1 11 6543 1 1 11 ARG HE H -1.001 -7.862 -5.257 1.00 . A A . 11 ARG HE 1 1 11 6544 1 1 11 ARG HG2 H -4.517 -8.937 -3.636 1.00 . A A . 11 ARG HG2 1 1 11 6545 1 1 11 ARG HG3 H -4.075 -7.601 -4.700 1.00 . A A . 11 ARG HG3 1 1 11 6546 1 1 11 ARG HH11 H -3.902 -9.487 -6.320 1.00 . A A . 11 ARG HH11 1 1 11 6547 1 1 11 ARG HH12 H -3.706 -9.021 -7.976 1.00 . A A . 11 ARG HH12 1 1 11 6548 1 1 11 ARG HH21 H -0.742 -7.248 -7.435 1.00 . A A . 11 ARG HH21 1 1 11 6549 1 1 11 ARG HH22 H -1.912 -7.750 -8.609 1.00 . A A . 11 ARG HH22 1 1 11 6550 1 1 11 ARG N N -4.378 -6.141 -0.783 1.00 . A A . 11 ARG N 1 1 11 6551 1 1 11 ARG NE N -1.829 -8.346 -5.460 1.00 . A A . 11 ARG NE 1 1 11 6552 1 1 11 ARG NH1 N -3.383 -9.011 -7.029 1.00 . A A . 11 ARG NH1 1 1 11 6553 1 1 11 ARG NH2 N -1.584 -7.736 -7.665 1.00 . A A . 11 ARG NH2 1 1 11 6554 1 1 11 ARG O O -4.567 -9.644 -1.497 1.00 . A A . 11 ARG O 1 1 11 6555 1 1 12 GLN C C -6.410 -9.370 2.252 1.00 . A A . 12 GLN C 1 1 11 6556 1 1 12 GLN CA C -5.387 -9.644 1.153 1.00 . A A . 12 GLN CA 1 1 11 6557 1 1 12 GLN CB C -4.068 -10.068 1.787 1.00 . A A . 12 GLN CB 1 1 11 6558 1 1 12 GLN CD C -2.544 -12.076 1.633 1.00 . A A . 12 GLN CD 1 1 11 6559 1 1 12 GLN CG C -3.206 -10.936 0.885 1.00 . A A . 12 GLN CG 1 1 11 6560 1 1 12 GLN H H -5.332 -7.577 0.703 1.00 . A A . 12 GLN H 1 1 11 6561 1 1 12 GLN HA H -5.749 -10.442 0.524 1.00 . A A . 12 GLN HA 1 1 11 6562 1 1 12 GLN HB2 H -3.511 -9.179 2.039 1.00 . A A . 12 GLN HB2 1 1 11 6563 1 1 12 GLN HB3 H -4.280 -10.618 2.690 1.00 . A A . 12 GLN HB3 1 1 11 6564 1 1 12 GLN HE21 H -3.858 -13.365 0.882 1.00 . A A . 12 GLN HE21 1 1 11 6565 1 1 12 GLN HE22 H -2.670 -14.037 1.941 1.00 . A A . 12 GLN HE22 1 1 11 6566 1 1 12 GLN HG2 H -3.827 -11.351 0.105 1.00 . A A . 12 GLN HG2 1 1 11 6567 1 1 12 GLN HG3 H -2.437 -10.320 0.442 1.00 . A A . 12 GLN HG3 1 1 11 6568 1 1 12 GLN N N -5.179 -8.465 0.319 1.00 . A A . 12 GLN N 1 1 11 6569 1 1 12 GLN NE2 N -3.078 -13.281 1.469 1.00 . A A . 12 GLN NE2 1 1 11 6570 1 1 12 GLN O O -6.476 -10.094 3.245 1.00 . A A . 12 GLN O 1 1 11 6571 1 1 12 GLN OE1 O -1.564 -11.877 2.351 1.00 . A A . 12 GLN OE1 1 1 11 6572 1 1 13 CYS C C -7.579 -7.242 4.253 1.00 . A A . 13 CYS C 1 1 11 6573 1 1 13 CYS CA C -8.213 -7.923 3.042 1.00 . A A . 13 CYS CA 1 1 11 6574 1 1 13 CYS CB C -9.036 -9.133 3.494 1.00 . A A . 13 CYS CB 1 1 11 6575 1 1 13 CYS H H -7.080 -7.779 1.263 1.00 . A A . 13 CYS H 1 1 11 6576 1 1 13 CYS HA H -8.870 -7.216 2.557 1.00 . A A . 13 CYS HA 1 1 11 6577 1 1 13 CYS HB2 H -9.335 -9.701 2.626 1.00 . A A . 13 CYS HB2 1 1 11 6578 1 1 13 CYS HB3 H -8.428 -9.755 4.134 1.00 . A A . 13 CYS HB3 1 1 11 6579 1 1 13 CYS N N -7.194 -8.315 2.070 1.00 . A A . 13 CYS N 1 1 11 6580 1 1 13 CYS O O -8.212 -7.106 5.300 1.00 . A A . 13 CYS O 1 1 11 6581 1 1 13 CYS SG S -10.546 -8.699 4.418 1.00 . A A . 13 CYS SG 1 1 11 6582 1 1 14 LYS C C -4.402 -5.407 4.634 1.00 . A A . 14 LYS C 1 1 11 6583 1 1 14 LYS CA C -5.618 -6.142 5.182 1.00 . A A . 14 LYS CA 1 1 11 6584 1 1 14 LYS CB C -5.184 -7.153 6.245 1.00 . A A . 14 LYS CB 1 1 11 6585 1 1 14 LYS CD C -4.520 -7.572 8.631 1.00 . A A . 14 LYS CD 1 1 11 6586 1 1 14 LYS CE C -5.773 -8.312 9.073 1.00 . A A . 14 LYS CE 1 1 11 6587 1 1 14 LYS CG C -4.836 -6.519 7.582 1.00 . A A . 14 LYS CG 1 1 11 6588 1 1 14 LYS H H -5.871 -6.943 3.247 1.00 . A A . 14 LYS H 1 1 11 6589 1 1 14 LYS HA H -6.289 -5.424 5.629 1.00 . A A . 14 LYS HA 1 1 11 6590 1 1 14 LYS HB2 H -5.987 -7.858 6.403 1.00 . A A . 14 LYS HB2 1 1 11 6591 1 1 14 LYS HB3 H -4.316 -7.685 5.886 1.00 . A A . 14 LYS HB3 1 1 11 6592 1 1 14 LYS HD2 H -3.822 -8.283 8.216 1.00 . A A . 14 LYS HD2 1 1 11 6593 1 1 14 LYS HD3 H -4.076 -7.089 9.490 1.00 . A A . 14 LYS HD3 1 1 11 6594 1 1 14 LYS HE2 H -5.710 -8.497 10.135 1.00 . A A . 14 LYS HE2 1 1 11 6595 1 1 14 LYS HE3 H -6.633 -7.692 8.867 1.00 . A A . 14 LYS HE3 1 1 11 6596 1 1 14 LYS HG2 H -3.973 -5.883 7.454 1.00 . A A . 14 LYS HG2 1 1 11 6597 1 1 14 LYS HG3 H -5.675 -5.928 7.918 1.00 . A A . 14 LYS HG3 1 1 11 6598 1 1 14 LYS HZ1 H -5.428 -9.584 7.453 1.00 . A A . 14 LYS HZ1 1 1 11 6599 1 1 14 LYS HZ2 H -5.537 -10.383 8.939 1.00 . A A . 14 LYS HZ2 1 1 11 6600 1 1 14 LYS HZ3 H -6.937 -9.803 8.187 1.00 . A A . 14 LYS HZ3 1 1 11 6601 1 1 14 LYS N N -6.328 -6.811 4.104 1.00 . A A . 14 LYS N 1 1 11 6602 1 1 14 LYS NZ N -5.930 -9.611 8.363 1.00 . A A . 14 LYS NZ 1 1 11 6603 1 1 14 LYS O O -3.411 -6.031 4.256 1.00 . A A . 14 LYS O 1 1 11 6604 1 1 15 LEU C C -2.043 -3.808 4.497 1.00 . A A . 15 LEU C 1 1 11 6605 1 1 15 LEU CA C -3.397 -3.246 4.078 1.00 . A A . 15 LEU CA 1 1 11 6606 1 1 15 LEU CB C -3.540 -1.804 4.575 1.00 . A A . 15 LEU CB 1 1 11 6607 1 1 15 LEU CD1 C -3.611 -0.548 6.746 1.00 . A A . 15 LEU CD1 1 1 11 6608 1 1 15 LEU CD2 C -5.736 -1.340 5.688 1.00 . A A . 15 LEU CD2 1 1 11 6609 1 1 15 LEU CG C -4.262 -1.643 5.915 1.00 . A A . 15 LEU CG 1 1 11 6610 1 1 15 LEU H H -5.311 -3.645 4.899 1.00 . A A . 15 LEU H 1 1 11 6611 1 1 15 LEU HA H -3.455 -3.252 3.000 1.00 . A A . 15 LEU HA 1 1 11 6612 1 1 15 LEU HB2 H -2.550 -1.380 4.670 1.00 . A A . 15 LEU HB2 1 1 11 6613 1 1 15 LEU HB3 H -4.082 -1.242 3.830 1.00 . A A . 15 LEU HB3 1 1 11 6614 1 1 15 LEU HD11 H -3.088 0.135 6.094 1.00 . A A . 15 LEU HD11 1 1 11 6615 1 1 15 LEU HD12 H -4.372 -0.012 7.294 1.00 . A A . 15 LEU HD12 1 1 11 6616 1 1 15 LEU HD13 H -2.912 -0.991 7.440 1.00 . A A . 15 LEU HD13 1 1 11 6617 1 1 15 LEU HD21 H -6.060 -1.801 4.766 1.00 . A A . 15 LEU HD21 1 1 11 6618 1 1 15 LEU HD22 H -6.315 -1.733 6.510 1.00 . A A . 15 LEU HD22 1 1 11 6619 1 1 15 LEU HD23 H -5.879 -0.271 5.625 1.00 . A A . 15 LEU HD23 1 1 11 6620 1 1 15 LEU HG H -4.192 -2.568 6.468 1.00 . A A . 15 LEU HG 1 1 11 6621 1 1 15 LEU N N -4.489 -4.077 4.587 1.00 . A A . 15 LEU N 1 1 11 6622 1 1 15 LEU O O -1.784 -4.009 5.683 1.00 . A A . 15 LEU O 1 1 11 6623 1 1 16 LYS C C 0.820 -3.912 4.936 1.00 . A A . 16 LYS C 1 1 11 6624 1 1 16 LYS CA C 0.134 -4.631 3.773 1.00 . A A . 16 LYS CA 1 1 11 6625 1 1 16 LYS CB C 1.004 -4.545 2.518 1.00 . A A . 16 LYS CB 1 1 11 6626 1 1 16 LYS CD C 1.422 -5.508 0.235 1.00 . A A . 16 LYS CD 1 1 11 6627 1 1 16 LYS CE C 0.584 -6.249 -0.794 1.00 . A A . 16 LYS CE 1 1 11 6628 1 1 16 LYS CG C 0.945 -5.791 1.650 1.00 . A A . 16 LYS CG 1 1 11 6629 1 1 16 LYS H H -1.461 -3.903 2.585 1.00 . A A . 16 LYS H 1 1 11 6630 1 1 16 LYS HA H 0.001 -5.671 4.036 1.00 . A A . 16 LYS HA 1 1 11 6631 1 1 16 LYS HB2 H 0.678 -3.704 1.925 1.00 . A A . 16 LYS HB2 1 1 11 6632 1 1 16 LYS HB3 H 2.031 -4.387 2.815 1.00 . A A . 16 LYS HB3 1 1 11 6633 1 1 16 LYS HD2 H 1.350 -4.447 0.046 1.00 . A A . 16 LYS HD2 1 1 11 6634 1 1 16 LYS HD3 H 2.451 -5.822 0.143 1.00 . A A . 16 LYS HD3 1 1 11 6635 1 1 16 LYS HE2 H 0.437 -7.264 -0.456 1.00 . A A . 16 LYS HE2 1 1 11 6636 1 1 16 LYS HE3 H -0.374 -5.757 -0.881 1.00 . A A . 16 LYS HE3 1 1 11 6637 1 1 16 LYS HG2 H 1.576 -6.552 2.086 1.00 . A A . 16 LYS HG2 1 1 11 6638 1 1 16 LYS HG3 H -0.075 -6.144 1.614 1.00 . A A . 16 LYS HG3 1 1 11 6639 1 1 16 LYS HZ1 H 2.268 -6.153 -2.027 1.00 . A A . 16 LYS HZ1 1 1 11 6640 1 1 16 LYS HZ2 H 1.055 -7.183 -2.602 1.00 . A A . 16 LYS HZ2 1 1 11 6641 1 1 16 LYS HZ3 H 0.870 -5.507 -2.725 1.00 . A A . 16 LYS HZ3 1 1 11 6642 1 1 16 LYS N N -1.189 -4.075 3.512 1.00 . A A . 16 LYS N 1 1 11 6643 1 1 16 LYS NZ N 1.240 -6.275 -2.130 1.00 . A A . 16 LYS NZ 1 1 11 6644 1 1 16 LYS O O 0.379 -2.845 5.365 1.00 . A A . 16 LYS O 1 1 11 6645 1 1 17 PRO C C 3.408 -2.646 6.187 1.00 . A A . 17 PRO C 1 1 11 6646 1 1 17 PRO CA C 2.656 -3.910 6.584 1.00 . A A . 17 PRO CA 1 1 11 6647 1 1 17 PRO CB C 3.651 -5.010 6.986 1.00 . A A . 17 PRO CB 1 1 11 6648 1 1 17 PRO CD C 2.501 -5.760 5.020 1.00 . A A . 17 PRO CD 1 1 11 6649 1 1 17 PRO CG C 3.231 -6.235 6.242 1.00 . A A . 17 PRO CG 1 1 11 6650 1 1 17 PRO HA H 2.007 -3.688 7.418 1.00 . A A . 17 PRO HA 1 1 11 6651 1 1 17 PRO HB2 H 4.651 -4.710 6.711 1.00 . A A . 17 PRO HB2 1 1 11 6652 1 1 17 PRO HB3 H 3.601 -5.166 8.054 1.00 . A A . 17 PRO HB3 1 1 11 6653 1 1 17 PRO HD2 H 3.192 -5.601 4.204 1.00 . A A . 17 PRO HD2 1 1 11 6654 1 1 17 PRO HD3 H 1.734 -6.465 4.738 1.00 . A A . 17 PRO HD3 1 1 11 6655 1 1 17 PRO HG2 H 4.102 -6.805 5.956 1.00 . A A . 17 PRO HG2 1 1 11 6656 1 1 17 PRO HG3 H 2.577 -6.833 6.859 1.00 . A A . 17 PRO HG3 1 1 11 6657 1 1 17 PRO N N 1.911 -4.492 5.465 1.00 . A A . 17 PRO N 1 1 11 6658 1 1 17 PRO O O 3.860 -2.510 5.051 1.00 . A A . 17 PRO O 1 1 11 6659 1 1 18 ALA C C 5.683 -0.742 6.444 1.00 . A A . 18 ALA C 1 1 11 6660 1 1 18 ALA CA C 4.250 -0.475 6.890 1.00 . A A . 18 ALA CA 1 1 11 6661 1 1 18 ALA CB C 4.235 0.395 8.138 1.00 . A A . 18 ALA CB 1 1 11 6662 1 1 18 ALA H H 3.165 -1.896 8.023 1.00 . A A . 18 ALA H 1 1 11 6663 1 1 18 ALA HA H 3.730 0.053 6.104 1.00 . A A . 18 ALA HA 1 1 11 6664 1 1 18 ALA HB1 H 4.887 -0.035 8.884 1.00 . A A . 18 ALA HB1 1 1 11 6665 1 1 18 ALA HB2 H 4.578 1.388 7.889 1.00 . A A . 18 ALA HB2 1 1 11 6666 1 1 18 ALA HB3 H 3.229 0.448 8.528 1.00 . A A . 18 ALA HB3 1 1 11 6667 1 1 18 ALA N N 3.544 -1.726 7.136 1.00 . A A . 18 ALA N 1 1 11 6668 1 1 18 ALA O O 6.215 -1.832 6.657 1.00 . A A . 18 ALA O 1 1 11 6669 1 1 19 GLY C C 7.793 -0.970 4.281 1.00 . A A . 19 GLY C 1 1 11 6670 1 1 19 GLY CA C 7.666 0.097 5.353 1.00 . A A . 19 GLY CA 1 1 11 6671 1 1 19 GLY H H 5.829 1.099 5.675 1.00 . A A . 19 GLY H 1 1 11 6672 1 1 19 GLY HA2 H 8.293 -0.172 6.189 1.00 . A A . 19 GLY HA2 1 1 11 6673 1 1 19 GLY HA3 H 8.007 1.039 4.949 1.00 . A A . 19 GLY HA3 1 1 11 6674 1 1 19 GLY N N 6.302 0.254 5.821 1.00 . A A . 19 GLY N 1 1 11 6675 1 1 19 GLY O O 8.895 -1.433 3.986 1.00 . A A . 19 GLY O 1 1 11 6676 1 1 20 THR C C 6.101 -1.796 1.352 1.00 . A A . 20 THR C 1 1 11 6677 1 1 20 THR CA C 6.655 -2.374 2.648 1.00 . A A . 20 THR CA 1 1 11 6678 1 1 20 THR CB C 5.819 -3.579 3.082 1.00 . A A . 20 THR CB 1 1 11 6679 1 1 20 THR CG2 C 5.876 -4.732 2.103 1.00 . A A . 20 THR CG2 1 1 11 6680 1 1 20 THR H H 5.816 -0.954 3.967 1.00 . A A . 20 THR H 1 1 11 6681 1 1 20 THR HA H 7.673 -2.692 2.482 1.00 . A A . 20 THR HA 1 1 11 6682 1 1 20 THR HB H 4.787 -3.274 3.173 1.00 . A A . 20 THR HB 1 1 11 6683 1 1 20 THR HG1 H 6.255 -3.343 4.977 1.00 . A A . 20 THR HG1 1 1 11 6684 1 1 20 THR HG21 H 6.072 -4.353 1.111 1.00 . A A . 20 THR HG21 1 1 11 6685 1 1 20 THR HG22 H 6.665 -5.411 2.392 1.00 . A A . 20 THR HG22 1 1 11 6686 1 1 20 THR HG23 H 4.931 -5.255 2.108 1.00 . A A . 20 THR HG23 1 1 11 6687 1 1 20 THR N N 6.664 -1.360 3.694 1.00 . A A . 20 THR N 1 1 11 6688 1 1 20 THR O O 5.068 -1.127 1.352 1.00 . A A . 20 THR O 1 1 11 6689 1 1 20 THR OG1 O 6.252 -4.063 4.341 1.00 . A A . 20 THR OG1 1 1 11 6690 1 1 21 THR C C 4.939 -1.968 -1.363 1.00 . A A . 21 THR C 1 1 11 6691 1 1 21 THR CA C 6.371 -1.549 -1.052 1.00 . A A . 21 THR CA 1 1 11 6692 1 1 21 THR CB C 7.315 -2.041 -2.150 1.00 . A A . 21 THR CB 1 1 11 6693 1 1 21 THR CG2 C 8.065 -0.916 -2.824 1.00 . A A . 21 THR CG2 1 1 11 6694 1 1 21 THR H H 7.613 -2.588 0.312 1.00 . A A . 21 THR H 1 1 11 6695 1 1 21 THR HA H 6.413 -0.471 -1.015 1.00 . A A . 21 THR HA 1 1 11 6696 1 1 21 THR HB H 6.740 -2.556 -2.906 1.00 . A A . 21 THR HB 1 1 11 6697 1 1 21 THR HG1 H 8.858 -3.235 -2.330 1.00 . A A . 21 THR HG1 1 1 11 6698 1 1 21 THR HG21 H 8.179 -0.096 -2.131 1.00 . A A . 21 THR HG21 1 1 11 6699 1 1 21 THR HG22 H 9.039 -1.265 -3.133 1.00 . A A . 21 THR HG22 1 1 11 6700 1 1 21 THR HG23 H 7.510 -0.583 -3.689 1.00 . A A . 21 THR HG23 1 1 11 6701 1 1 21 THR N N 6.795 -2.052 0.250 1.00 . A A . 21 THR N 1 1 11 6702 1 1 21 THR O O 4.591 -3.146 -1.275 1.00 . A A . 21 THR O 1 1 11 6703 1 1 21 THR OG1 O 8.273 -2.945 -1.626 1.00 . A A . 21 THR OG1 1 1 11 6704 1 1 22 CYS C C 2.455 -1.059 -3.538 1.00 . A A . 22 CYS C 1 1 11 6705 1 1 22 CYS CA C 2.717 -1.257 -2.050 1.00 . A A . 22 CYS CA 1 1 11 6706 1 1 22 CYS CB C 1.802 -0.342 -1.235 1.00 . A A . 22 CYS CB 1 1 11 6707 1 1 22 CYS H H 4.450 -0.075 -1.777 1.00 . A A . 22 CYS H 1 1 11 6708 1 1 22 CYS HA H 2.507 -2.283 -1.794 1.00 . A A . 22 CYS HA 1 1 11 6709 1 1 22 CYS HB2 H 0.774 -0.574 -1.469 1.00 . A A . 22 CYS HB2 1 1 11 6710 1 1 22 CYS HB3 H 1.975 -0.516 -0.184 1.00 . A A . 22 CYS HB3 1 1 11 6711 1 1 22 CYS N N 4.113 -0.994 -1.727 1.00 . A A . 22 CYS N 1 1 11 6712 1 1 22 CYS O O 1.711 -1.821 -4.154 1.00 . A A . 22 CYS O 1 1 11 6713 1 1 22 CYS SG S 2.051 1.436 -1.552 1.00 . A A . 22 CYS SG 1 1 11 6714 1 1 23 TRP C C 4.002 -0.359 -6.361 1.00 . A A . 23 TRP C 1 1 11 6715 1 1 23 TRP CA C 2.894 0.269 -5.526 1.00 . A A . 23 TRP CA 1 1 11 6716 1 1 23 TRP CB C 2.859 1.782 -5.752 1.00 . A A . 23 TRP CB 1 1 11 6717 1 1 23 TRP CD1 C 1.132 1.396 -7.605 1.00 . A A . 23 TRP CD1 1 1 11 6718 1 1 23 TRP CD2 C 1.449 3.547 -7.077 1.00 . A A . 23 TRP CD2 1 1 11 6719 1 1 23 TRP CE2 C 0.484 3.473 -8.099 1.00 . A A . 23 TRP CE2 1 1 11 6720 1 1 23 TRP CE3 C 1.812 4.802 -6.582 1.00 . A A . 23 TRP CE3 1 1 11 6721 1 1 23 TRP CG C 1.850 2.207 -6.775 1.00 . A A . 23 TRP CG 1 1 11 6722 1 1 23 TRP CH2 C 0.252 5.822 -8.131 1.00 . A A . 23 TRP CH2 1 1 11 6723 1 1 23 TRP CZ2 C -0.122 4.606 -8.634 1.00 . A A . 23 TRP CZ2 1 1 11 6724 1 1 23 TRP CZ3 C 1.210 5.927 -7.115 1.00 . A A . 23 TRP CZ3 1 1 11 6725 1 1 23 TRP H H 3.647 0.547 -3.567 1.00 . A A . 23 TRP H 1 1 11 6726 1 1 23 TRP HA H 1.952 -0.150 -5.835 1.00 . A A . 23 TRP HA 1 1 11 6727 1 1 23 TRP HB2 H 2.616 2.273 -4.821 1.00 . A A . 23 TRP HB2 1 1 11 6728 1 1 23 TRP HB3 H 3.831 2.114 -6.085 1.00 . A A . 23 TRP HB3 1 1 11 6729 1 1 23 TRP HD1 H 1.211 0.320 -7.620 1.00 . A A . 23 TRP HD1 1 1 11 6730 1 1 23 TRP HE1 H -0.306 1.798 -9.082 1.00 . A A . 23 TRP HE1 1 1 11 6731 1 1 23 TRP HE3 H 2.548 4.901 -5.799 1.00 . A A . 23 TRP HE3 1 1 11 6732 1 1 23 TRP HH2 H -0.191 6.726 -8.518 1.00 . A A . 23 TRP HH2 1 1 11 6733 1 1 23 TRP HZ2 H -0.863 4.541 -9.416 1.00 . A A . 23 TRP HZ2 1 1 11 6734 1 1 23 TRP HZ3 H 1.478 6.906 -6.745 1.00 . A A . 23 TRP HZ3 1 1 11 6735 1 1 23 TRP N N 3.068 -0.028 -4.110 1.00 . A A . 23 TRP N 1 1 11 6736 1 1 23 TRP NE1 N 0.308 2.150 -8.404 1.00 . A A . 23 TRP NE1 1 1 11 6737 1 1 23 TRP O O 3.776 -1.333 -7.080 1.00 . A A . 23 TRP O 1 1 11 6738 1 1 24 LYS C C 6.021 -0.397 -8.503 1.00 . A A . 24 LYS C 1 1 11 6739 1 1 24 LYS CA C 6.345 -0.295 -7.015 1.00 . A A . 24 LYS CA 1 1 11 6740 1 1 24 LYS CB C 6.771 -1.662 -6.477 1.00 . A A . 24 LYS CB 1 1 11 6741 1 1 24 LYS CD C 8.140 -3.630 -7.231 1.00 . A A . 24 LYS CD 1 1 11 6742 1 1 24 LYS CE C 9.535 -4.121 -7.582 1.00 . A A . 24 LYS CE 1 1 11 6743 1 1 24 LYS CG C 8.120 -2.128 -7.000 1.00 . A A . 24 LYS CG 1 1 11 6744 1 1 24 LYS H H 5.312 0.979 -5.676 1.00 . A A . 24 LYS H 1 1 11 6745 1 1 24 LYS HA H 7.158 0.402 -6.883 1.00 . A A . 24 LYS HA 1 1 11 6746 1 1 24 LYS HB2 H 6.824 -1.610 -5.400 1.00 . A A . 24 LYS HB2 1 1 11 6747 1 1 24 LYS HB3 H 6.028 -2.393 -6.758 1.00 . A A . 24 LYS HB3 1 1 11 6748 1 1 24 LYS HD2 H 7.811 -4.128 -6.331 1.00 . A A . 24 LYS HD2 1 1 11 6749 1 1 24 LYS HD3 H 7.469 -3.868 -8.043 1.00 . A A . 24 LYS HD3 1 1 11 6750 1 1 24 LYS HE2 H 9.646 -4.112 -8.656 1.00 . A A . 24 LYS HE2 1 1 11 6751 1 1 24 LYS HE3 H 10.260 -3.453 -7.141 1.00 . A A . 24 LYS HE3 1 1 11 6752 1 1 24 LYS HG2 H 8.327 -1.628 -7.934 1.00 . A A . 24 LYS HG2 1 1 11 6753 1 1 24 LYS HG3 H 8.882 -1.873 -6.277 1.00 . A A . 24 LYS HG3 1 1 11 6754 1 1 24 LYS HZ1 H 9.371 -5.617 -6.133 1.00 . A A . 24 LYS HZ1 1 1 11 6755 1 1 24 LYS HZ2 H 9.345 -6.197 -7.723 1.00 . A A . 24 LYS HZ2 1 1 11 6756 1 1 24 LYS HZ3 H 10.802 -5.688 -7.031 1.00 . A A . 24 LYS HZ3 1 1 11 6757 1 1 24 LYS N N 5.198 0.206 -6.265 1.00 . A A . 24 LYS N 1 1 11 6758 1 1 24 LYS NZ N 9.780 -5.502 -7.082 1.00 . A A . 24 LYS NZ 1 1 11 6759 1 1 24 LYS O O 6.501 -1.296 -9.193 1.00 . A A . 24 LYS O 1 1 11 6760 1 1 25 THR C C 6.033 0.588 -11.304 1.00 . A A . 25 THR C 1 1 11 6761 1 1 25 THR CA C 4.807 0.544 -10.395 1.00 . A A . 25 THR CA 1 1 11 6762 1 1 25 THR CB C 3.894 1.740 -10.681 1.00 . A A . 25 THR CB 1 1 11 6763 1 1 25 THR CG2 C 4.600 3.075 -10.582 1.00 . A A . 25 THR CG2 1 1 11 6764 1 1 25 THR H H 4.848 1.219 -8.388 1.00 . A A . 25 THR H 1 1 11 6765 1 1 25 THR HA H 4.262 -0.367 -10.593 1.00 . A A . 25 THR HA 1 1 11 6766 1 1 25 THR HB H 3.085 1.741 -9.964 1.00 . A A . 25 THR HB 1 1 11 6767 1 1 25 THR HG1 H 4.014 1.816 -12.635 1.00 . A A . 25 THR HG1 1 1 11 6768 1 1 25 THR HG21 H 5.542 2.946 -10.069 1.00 . A A . 25 THR HG21 1 1 11 6769 1 1 25 THR HG22 H 4.780 3.461 -11.574 1.00 . A A . 25 THR HG22 1 1 11 6770 1 1 25 THR HG23 H 3.983 3.769 -10.031 1.00 . A A . 25 THR HG23 1 1 11 6771 1 1 25 THR N N 5.199 0.530 -8.989 1.00 . A A . 25 THR N 1 1 11 6772 1 1 25 THR O O 7.142 0.877 -10.853 1.00 . A A . 25 THR O 1 1 11 6773 1 1 25 THR OG1 O 3.335 1.645 -11.979 1.00 . A A . 25 THR OG1 1 1 11 6774 1 1 26 SER C C 7.498 1.695 -13.738 1.00 . A A . 26 SER C 1 1 11 6775 1 1 26 SER CA C 6.914 0.295 -13.554 1.00 . A A . 26 SER CA 1 1 11 6776 1 1 26 SER CB C 6.421 -0.242 -14.899 1.00 . A A . 26 SER CB 1 1 11 6777 1 1 26 SER H H 4.920 0.069 -12.880 1.00 . A A . 26 SER H 1 1 11 6778 1 1 26 SER HA H 7.689 -0.357 -13.181 1.00 . A A . 26 SER HA 1 1 11 6779 1 1 26 SER HB2 H 5.541 -0.847 -14.742 1.00 . A A . 26 SER HB2 1 1 11 6780 1 1 26 SER HB3 H 6.177 0.586 -15.548 1.00 . A A . 26 SER HB3 1 1 11 6781 1 1 26 SER HG H 7.023 -1.861 -15.824 1.00 . A A . 26 SER HG 1 1 11 6782 1 1 26 SER N N 5.826 0.295 -12.582 1.00 . A A . 26 SER N 1 1 11 6783 1 1 26 SER O O 8.629 1.846 -14.201 1.00 . A A . 26 SER O 1 1 11 6784 1 1 26 SER OG O 7.413 -1.036 -15.526 1.00 . A A . 26 SER OG 1 1 11 6785 1 1 27 VAL C C 7.168 4.825 -12.177 1.00 . A A . 27 VAL C 1 1 11 6786 1 1 27 VAL CA C 7.177 4.097 -13.518 1.00 . A A . 27 VAL CA 1 1 11 6787 1 1 27 VAL CB C 6.301 4.878 -14.517 1.00 . A A . 27 VAL CB 1 1 11 6788 1 1 27 VAL CG1 C 6.938 6.218 -14.854 1.00 . A A . 27 VAL CG1 1 1 11 6789 1 1 27 VAL CG2 C 6.067 4.060 -15.779 1.00 . A A . 27 VAL CG2 1 1 11 6790 1 1 27 VAL H H 5.830 2.539 -13.022 1.00 . A A . 27 VAL H 1 1 11 6791 1 1 27 VAL HA H 8.188 4.079 -13.899 1.00 . A A . 27 VAL HA 1 1 11 6792 1 1 27 VAL HB H 5.343 5.067 -14.054 1.00 . A A . 27 VAL HB 1 1 11 6793 1 1 27 VAL HG11 H 8.012 6.133 -14.785 1.00 . A A . 27 VAL HG11 1 1 11 6794 1 1 27 VAL HG12 H 6.662 6.505 -15.857 1.00 . A A . 27 VAL HG12 1 1 11 6795 1 1 27 VAL HG13 H 6.591 6.966 -14.157 1.00 . A A . 27 VAL HG13 1 1 11 6796 1 1 27 VAL HG21 H 5.576 3.133 -15.521 1.00 . A A . 27 VAL HG21 1 1 11 6797 1 1 27 VAL HG22 H 5.445 4.620 -16.461 1.00 . A A . 27 VAL HG22 1 1 11 6798 1 1 27 VAL HG23 H 7.015 3.846 -16.250 1.00 . A A . 27 VAL HG23 1 1 11 6799 1 1 27 VAL N N 6.724 2.716 -13.381 1.00 . A A . 27 VAL N 1 1 11 6800 1 1 27 VAL O O 7.023 6.047 -12.127 1.00 . A A . 27 VAL O 1 1 11 6801 1 1 28 SER C C 7.507 3.578 -8.688 1.00 . A A . 28 SER C 1 1 11 6802 1 1 28 SER CA C 7.339 4.656 -9.754 1.00 . A A . 28 SER CA 1 1 11 6803 1 1 28 SER CB C 6.048 5.440 -9.500 1.00 . A A . 28 SER CB 1 1 11 6804 1 1 28 SER H H 7.440 3.104 -11.193 1.00 . A A . 28 SER H 1 1 11 6805 1 1 28 SER HA H 8.177 5.334 -9.697 1.00 . A A . 28 SER HA 1 1 11 6806 1 1 28 SER HB2 H 5.592 5.694 -10.445 1.00 . A A . 28 SER HB2 1 1 11 6807 1 1 28 SER HB3 H 5.367 4.831 -8.923 1.00 . A A . 28 SER HB3 1 1 11 6808 1 1 28 SER HG H 6.420 7.361 -9.403 1.00 . A A . 28 SER HG 1 1 11 6809 1 1 28 SER N N 7.326 4.072 -11.092 1.00 . A A . 28 SER N 1 1 11 6810 1 1 28 SER O O 7.755 2.413 -9.000 1.00 . A A . 28 SER O 1 1 11 6811 1 1 28 SER OG O 6.310 6.635 -8.785 1.00 . A A . 28 SER OG 1 1 11 6812 1 1 29 SER C C 7.237 3.757 -4.987 1.00 . A A . 29 SER C 1 1 11 6813 1 1 29 SER CA C 7.500 3.048 -6.310 1.00 . A A . 29 SER CA 1 1 11 6814 1 1 29 SER CB C 8.895 2.421 -6.300 1.00 . A A . 29 SER CB 1 1 11 6815 1 1 29 SER H H 7.168 4.918 -7.244 1.00 . A A . 29 SER H 1 1 11 6816 1 1 29 SER HA H 6.764 2.269 -6.439 1.00 . A A . 29 SER HA 1 1 11 6817 1 1 29 SER HB2 H 9.155 2.142 -5.290 1.00 . A A . 29 SER HB2 1 1 11 6818 1 1 29 SER HB3 H 8.896 1.541 -6.928 1.00 . A A . 29 SER HB3 1 1 11 6819 1 1 29 SER HG H 10.654 3.281 -6.239 1.00 . A A . 29 SER HG 1 1 11 6820 1 1 29 SER N N 7.367 3.976 -7.427 1.00 . A A . 29 SER N 1 1 11 6821 1 1 29 SER O O 8.008 4.621 -4.569 1.00 . A A . 29 SER O 1 1 11 6822 1 1 29 SER OG O 9.867 3.330 -6.787 1.00 . A A . 29 SER OG 1 1 11 6823 1 1 30 HIS C C 5.552 2.931 -1.991 1.00 . A A . 30 HIS C 1 1 11 6824 1 1 30 HIS CA C 5.767 3.995 -3.062 1.00 . A A . 30 HIS CA 1 1 11 6825 1 1 30 HIS CB C 4.497 4.829 -3.232 1.00 . A A . 30 HIS CB 1 1 11 6826 1 1 30 HIS CD2 C 4.914 5.576 -5.681 1.00 . A A . 30 HIS CD2 1 1 11 6827 1 1 30 HIS CE1 C 4.382 7.692 -5.466 1.00 . A A . 30 HIS CE1 1 1 11 6828 1 1 30 HIS CG C 4.558 5.777 -4.390 1.00 . A A . 30 HIS CG 1 1 11 6829 1 1 30 HIS H H 5.562 2.699 -4.723 1.00 . A A . 30 HIS H 1 1 11 6830 1 1 30 HIS HA H 6.573 4.642 -2.754 1.00 . A A . 30 HIS HA 1 1 11 6831 1 1 30 HIS HB2 H 3.657 4.168 -3.390 1.00 . A A . 30 HIS HB2 1 1 11 6832 1 1 30 HIS HB3 H 4.331 5.408 -2.335 1.00 . A A . 30 HIS HB3 1 1 11 6833 1 1 30 HIS HD1 H 3.931 7.568 -3.474 1.00 . A A . 30 HIS HD1 1 1 11 6834 1 1 30 HIS HD2 H 5.229 4.640 -6.122 1.00 . A A . 30 HIS HD2 1 1 11 6835 1 1 30 HIS HE1 H 4.200 8.734 -5.686 1.00 . A A . 30 HIS HE1 1 1 11 6836 1 1 30 HIS HE2 H 4.904 6.924 -7.291 1.00 . A A . 30 HIS HE2 1 1 11 6837 1 1 30 HIS N N 6.139 3.390 -4.335 1.00 . A A . 30 HIS N 1 1 11 6838 1 1 30 HIS ND1 N 4.231 7.113 -4.288 1.00 . A A . 30 HIS ND1 1 1 11 6839 1 1 30 HIS NE2 N 4.797 6.782 -6.328 1.00 . A A . 30 HIS NE2 1 1 11 6840 1 1 30 HIS O O 4.892 1.920 -2.228 1.00 . A A . 30 HIS O 1 1 11 6841 1 1 31 TYR C C 4.650 2.428 1.019 1.00 . A A . 31 TYR C 1 1 11 6842 1 1 31 TYR CA C 5.982 2.233 0.302 1.00 . A A . 31 TYR CA 1 1 11 6843 1 1 31 TYR CB C 7.137 2.415 1.289 1.00 . A A . 31 TYR CB 1 1 11 6844 1 1 31 TYR CD1 C 9.067 0.901 1.885 1.00 . A A . 31 TYR CD1 1 1 11 6845 1 1 31 TYR CD2 C 8.853 1.612 -0.380 1.00 . A A . 31 TYR CD2 1 1 11 6846 1 1 31 TYR CE1 C 10.200 0.181 1.556 1.00 . A A . 31 TYR CE1 1 1 11 6847 1 1 31 TYR CE2 C 9.985 0.894 -0.717 1.00 . A A . 31 TYR CE2 1 1 11 6848 1 1 31 TYR CG C 8.376 1.628 0.924 1.00 . A A . 31 TYR CG 1 1 11 6849 1 1 31 TYR CZ C 10.654 0.181 0.255 1.00 . A A . 31 TYR CZ 1 1 11 6850 1 1 31 TYR H H 6.626 3.994 -0.681 1.00 . A A . 31 TYR H 1 1 11 6851 1 1 31 TYR HA H 6.018 1.232 -0.101 1.00 . A A . 31 TYR HA 1 1 11 6852 1 1 31 TYR HB2 H 7.408 3.460 1.326 1.00 . A A . 31 TYR HB2 1 1 11 6853 1 1 31 TYR HB3 H 6.816 2.096 2.270 1.00 . A A . 31 TYR HB3 1 1 11 6854 1 1 31 TYR HD1 H 8.709 0.903 2.904 1.00 . A A . 31 TYR HD1 1 1 11 6855 1 1 31 TYR HD2 H 8.327 2.173 -1.139 1.00 . A A . 31 TYR HD2 1 1 11 6856 1 1 31 TYR HE1 H 10.724 -0.378 2.318 1.00 . A A . 31 TYR HE1 1 1 11 6857 1 1 31 TYR HE2 H 10.341 0.894 -1.736 1.00 . A A . 31 TYR HE2 1 1 11 6858 1 1 31 TYR HH H 11.559 -1.466 -0.152 1.00 . A A . 31 TYR HH 1 1 11 6859 1 1 31 TYR N N 6.113 3.168 -0.809 1.00 . A A . 31 TYR N 1 1 11 6860 1 1 31 TYR O O 3.927 3.388 0.754 1.00 . A A . 31 TYR O 1 1 11 6861 1 1 31 TYR OH O 11.782 -0.535 -0.076 1.00 . A A . 31 TYR OH 1 1 11 6862 1 1 32 CYS C C 3.356 1.871 4.152 1.00 . A A . 32 CYS C 1 1 11 6863 1 1 32 CYS CA C 3.085 1.588 2.679 1.00 . A A . 32 CYS CA 1 1 11 6864 1 1 32 CYS CB C 2.299 0.284 2.537 1.00 . A A . 32 CYS CB 1 1 11 6865 1 1 32 CYS H H 4.945 0.769 2.097 1.00 . A A . 32 CYS H 1 1 11 6866 1 1 32 CYS HA H 2.500 2.397 2.271 1.00 . A A . 32 CYS HA 1 1 11 6867 1 1 32 CYS HB2 H 2.641 -0.240 1.657 1.00 . A A . 32 CYS HB2 1 1 11 6868 1 1 32 CYS HB3 H 2.476 -0.332 3.406 1.00 . A A . 32 CYS HB3 1 1 11 6869 1 1 32 CYS N N 4.330 1.512 1.927 1.00 . A A . 32 CYS N 1 1 11 6870 1 1 32 CYS O O 4.448 1.609 4.655 1.00 . A A . 32 CYS O 1 1 11 6871 1 1 32 CYS SG S 0.499 0.515 2.378 1.00 . A A . 32 CYS SG 1 1 11 6872 1 1 33 THR C C 1.503 1.883 7.081 1.00 . A A . 33 THR C 1 1 11 6873 1 1 33 THR CA C 2.476 2.719 6.255 1.00 . A A . 33 THR CA 1 1 11 6874 1 1 33 THR CB C 2.217 4.208 6.495 1.00 . A A . 33 THR CB 1 1 11 6875 1 1 33 THR CG2 C 2.889 5.106 5.479 1.00 . A A . 33 THR CG2 1 1 11 6876 1 1 33 THR H H 1.505 2.586 4.381 1.00 . A A . 33 THR H 1 1 11 6877 1 1 33 THR HA H 3.485 2.484 6.561 1.00 . A A . 33 THR HA 1 1 11 6878 1 1 33 THR HB H 2.594 4.475 7.472 1.00 . A A . 33 THR HB 1 1 11 6879 1 1 33 THR HG1 H 0.679 5.399 6.724 1.00 . A A . 33 THR HG1 1 1 11 6880 1 1 33 THR HG21 H 3.734 4.590 5.045 1.00 . A A . 33 THR HG21 1 1 11 6881 1 1 33 THR HG22 H 2.184 5.359 4.701 1.00 . A A . 33 THR HG22 1 1 11 6882 1 1 33 THR HG23 H 3.229 6.008 5.964 1.00 . A A . 33 THR HG23 1 1 11 6883 1 1 33 THR N N 2.352 2.404 4.838 1.00 . A A . 33 THR N 1 1 11 6884 1 1 33 THR O O 1.174 2.236 8.214 1.00 . A A . 33 THR O 1 1 11 6885 1 1 33 THR OG1 O 0.829 4.487 6.463 1.00 . A A . 33 THR OG1 1 1 11 6886 1 1 34 GLY C C -1.042 0.665 7.833 1.00 . A A . 34 GLY C 1 1 11 6887 1 1 34 GLY CA C 0.110 -0.096 7.202 1.00 . A A . 34 GLY CA 1 1 11 6888 1 1 34 GLY H H 1.341 0.542 5.600 1.00 . A A . 34 GLY H 1 1 11 6889 1 1 34 GLY HA2 H 0.642 -0.628 7.977 1.00 . A A . 34 GLY HA2 1 1 11 6890 1 1 34 GLY HA3 H -0.290 -0.812 6.500 1.00 . A A . 34 GLY HA3 1 1 11 6891 1 1 34 GLY N N 1.043 0.773 6.506 1.00 . A A . 34 GLY N 1 1 11 6892 1 1 34 GLY O O -1.496 0.323 8.925 1.00 . A A . 34 GLY O 1 1 11 6893 1 1 35 ARG C C -3.826 2.436 6.727 1.00 . A A . 35 ARG C 1 1 11 6894 1 1 35 ARG CA C -2.614 2.516 7.650 1.00 . A A . 35 ARG CA 1 1 11 6895 1 1 35 ARG CB C -2.171 3.973 7.801 1.00 . A A . 35 ARG CB 1 1 11 6896 1 1 35 ARG CD C -1.132 5.708 9.292 1.00 . A A . 35 ARG CD 1 1 11 6897 1 1 35 ARG CG C -1.308 4.221 9.028 1.00 . A A . 35 ARG CG 1 1 11 6898 1 1 35 ARG CZ C -1.085 7.234 11.226 1.00 . A A . 35 ARG CZ 1 1 11 6899 1 1 35 ARG H H -1.107 1.928 6.283 1.00 . A A . 35 ARG H 1 1 11 6900 1 1 35 ARG HA H -2.891 2.133 8.619 1.00 . A A . 35 ARG HA 1 1 11 6901 1 1 35 ARG HB2 H -1.606 4.258 6.926 1.00 . A A . 35 ARG HB2 1 1 11 6902 1 1 35 ARG HB3 H -3.049 4.598 7.872 1.00 . A A . 35 ARG HB3 1 1 11 6903 1 1 35 ARG HD2 H -0.225 6.041 8.810 1.00 . A A . 35 ARG HD2 1 1 11 6904 1 1 35 ARG HD3 H -1.976 6.237 8.875 1.00 . A A . 35 ARG HD3 1 1 11 6905 1 1 35 ARG HE H -0.952 5.246 11.334 1.00 . A A . 35 ARG HE 1 1 11 6906 1 1 35 ARG HG2 H -1.780 3.767 9.886 1.00 . A A . 35 ARG HG2 1 1 11 6907 1 1 35 ARG HG3 H -0.338 3.775 8.869 1.00 . A A . 35 ARG HG3 1 1 11 6908 1 1 35 ARG HH11 H -1.275 8.156 9.436 1.00 . A A . 35 ARG HH11 1 1 11 6909 1 1 35 ARG HH12 H -1.239 9.207 10.811 1.00 . A A . 35 ARG HH12 1 1 11 6910 1 1 35 ARG HH21 H -0.905 6.626 13.145 1.00 . A A . 35 ARG HH21 1 1 11 6911 1 1 35 ARG HH22 H -1.029 8.339 12.917 1.00 . A A . 35 ARG HH22 1 1 11 6912 1 1 35 ARG N N -1.512 1.703 7.146 1.00 . A A . 35 ARG N 1 1 11 6913 1 1 35 ARG NE N -1.045 6.004 10.720 1.00 . A A . 35 ARG NE 1 1 11 6914 1 1 35 ARG NH1 N -1.210 8.285 10.425 1.00 . A A . 35 ARG NH1 1 1 11 6915 1 1 35 ARG NH2 N -0.999 7.415 12.537 1.00 . A A . 35 ARG NH2 1 1 11 6916 1 1 35 ARG O O -4.967 2.413 7.187 1.00 . A A . 35 ARG O 1 1 11 6917 1 1 36 SER C C -4.107 1.897 3.075 1.00 . A A . 36 SER C 1 1 11 6918 1 1 36 SER CA C -4.644 2.319 4.439 1.00 . A A . 36 SER CA 1 1 11 6919 1 1 36 SER CB C -5.353 3.669 4.324 1.00 . A A . 36 SER CB 1 1 11 6920 1 1 36 SER H H -2.641 2.416 5.119 1.00 . A A . 36 SER H 1 1 11 6921 1 1 36 SER HA H -5.353 1.578 4.777 1.00 . A A . 36 SER HA 1 1 11 6922 1 1 36 SER HB2 H -4.660 4.459 4.571 1.00 . A A . 36 SER HB2 1 1 11 6923 1 1 36 SER HB3 H -5.706 3.803 3.312 1.00 . A A . 36 SER HB3 1 1 11 6924 1 1 36 SER HG H -7.019 2.970 5.084 1.00 . A A . 36 SER HG 1 1 11 6925 1 1 36 SER N N -3.571 2.394 5.424 1.00 . A A . 36 SER N 1 1 11 6926 1 1 36 SER O O -2.896 1.795 2.877 1.00 . A A . 36 SER O 1 1 11 6927 1 1 36 SER OG O -6.460 3.741 5.207 1.00 . A A . 36 SER OG 1 1 11 6928 1 1 37 CYS C C -4.005 2.403 0.027 1.00 . A A . 37 CYS C 1 1 11 6929 1 1 37 CYS CA C -4.637 1.244 0.790 1.00 . A A . 37 CYS CA 1 1 11 6930 1 1 37 CYS CB C -5.859 0.726 0.030 1.00 . A A . 37 CYS CB 1 1 11 6931 1 1 37 CYS H H -5.967 1.754 2.356 1.00 . A A . 37 CYS H 1 1 11 6932 1 1 37 CYS HA H -3.914 0.448 0.877 1.00 . A A . 37 CYS HA 1 1 11 6933 1 1 37 CYS HB2 H -6.491 1.561 -0.234 1.00 . A A . 37 CYS HB2 1 1 11 6934 1 1 37 CYS HB3 H -5.530 0.231 -0.871 1.00 . A A . 37 CYS HB3 1 1 11 6935 1 1 37 CYS N N -5.017 1.654 2.137 1.00 . A A . 37 CYS N 1 1 11 6936 1 1 37 CYS O O -3.126 2.202 -0.810 1.00 . A A . 37 CYS O 1 1 11 6937 1 1 37 CYS SG S -6.872 -0.457 0.975 1.00 . A A . 37 CYS SG 1 1 11 6938 1 1 38 GLU C C -2.434 4.935 -0.129 1.00 . A A . 38 GLU C 1 1 11 6939 1 1 38 GLU CA C -3.941 4.809 -0.335 1.00 . A A . 38 GLU CA 1 1 11 6940 1 1 38 GLU CB C -4.646 6.058 0.198 1.00 . A A . 38 GLU CB 1 1 11 6941 1 1 38 GLU CD C -5.647 8.315 -0.334 1.00 . A A . 38 GLU CD 1 1 11 6942 1 1 38 GLU CG C -4.836 7.143 -0.850 1.00 . A A . 38 GLU CG 1 1 11 6943 1 1 38 GLU H H -5.163 3.710 1.000 1.00 . A A . 38 GLU H 1 1 11 6944 1 1 38 GLU HA H -4.141 4.718 -1.392 1.00 . A A . 38 GLU HA 1 1 11 6945 1 1 38 GLU HB2 H -5.618 5.776 0.573 1.00 . A A . 38 GLU HB2 1 1 11 6946 1 1 38 GLU HB3 H -4.062 6.469 1.008 1.00 . A A . 38 GLU HB3 1 1 11 6947 1 1 38 GLU HG2 H -3.865 7.504 -1.156 1.00 . A A . 38 GLU HG2 1 1 11 6948 1 1 38 GLU HG3 H -5.345 6.718 -1.702 1.00 . A A . 38 GLU HG3 1 1 11 6949 1 1 38 GLU N N -4.460 3.616 0.323 1.00 . A A . 38 GLU N 1 1 11 6950 1 1 38 GLU O O -1.973 5.274 0.961 1.00 . A A . 38 GLU O 1 1 11 6951 1 1 38 GLU OE1 O -5.220 8.943 0.657 1.00 . A A . 38 GLU OE1 1 1 11 6952 1 1 38 GLU OE2 O -6.710 8.606 -0.922 1.00 . A A . 38 GLU OE2 1 1 11 6953 1 1 39 CYS C C 0.250 6.192 -1.225 1.00 . A A . 39 CYS C 1 1 11 6954 1 1 39 CYS CA C -0.218 4.743 -1.116 1.00 . A A . 39 CYS CA 1 1 11 6955 1 1 39 CYS CB C 0.415 3.904 -2.228 1.00 . A A . 39 CYS CB 1 1 11 6956 1 1 39 CYS H H -2.098 4.395 -2.025 1.00 . A A . 39 CYS H 1 1 11 6957 1 1 39 CYS HA H 0.091 4.348 -0.160 1.00 . A A . 39 CYS HA 1 1 11 6958 1 1 39 CYS HB2 H -0.026 4.182 -3.174 1.00 . A A . 39 CYS HB2 1 1 11 6959 1 1 39 CYS HB3 H 1.477 4.104 -2.259 1.00 . A A . 39 CYS HB3 1 1 11 6960 1 1 39 CYS N N -1.672 4.660 -1.183 1.00 . A A . 39 CYS N 1 1 11 6961 1 1 39 CYS O O -0.379 7.007 -1.901 1.00 . A A . 39 CYS O 1 1 11 6962 1 1 39 CYS SG S 0.194 2.108 -2.021 1.00 . A A . 39 CYS SG 1 1 11 6963 1 1 40 PRO C C 2.103 8.415 -2.005 1.00 . A A . 40 PRO C 1 1 11 6964 1 1 40 PRO CA C 1.915 7.895 -0.585 1.00 . A A . 40 PRO CA 1 1 11 6965 1 1 40 PRO CB C 3.269 7.747 0.114 1.00 . A A . 40 PRO CB 1 1 11 6966 1 1 40 PRO CD C 2.179 5.626 0.272 1.00 . A A . 40 PRO CD 1 1 11 6967 1 1 40 PRO CG C 3.112 6.557 0.995 1.00 . A A . 40 PRO CG 1 1 11 6968 1 1 40 PRO HA H 1.294 8.583 -0.030 1.00 . A A . 40 PRO HA 1 1 11 6969 1 1 40 PRO HB2 H 4.043 7.595 -0.624 1.00 . A A . 40 PRO HB2 1 1 11 6970 1 1 40 PRO HB3 H 3.480 8.637 0.688 1.00 . A A . 40 PRO HB3 1 1 11 6971 1 1 40 PRO HD2 H 2.737 4.936 -0.345 1.00 . A A . 40 PRO HD2 1 1 11 6972 1 1 40 PRO HD3 H 1.560 5.090 0.975 1.00 . A A . 40 PRO HD3 1 1 11 6973 1 1 40 PRO HG2 H 4.071 6.083 1.146 1.00 . A A . 40 PRO HG2 1 1 11 6974 1 1 40 PRO HG3 H 2.686 6.854 1.942 1.00 . A A . 40 PRO HG3 1 1 11 6975 1 1 40 PRO N N 1.366 6.535 -0.558 1.00 . A A . 40 PRO N 1 1 11 6976 1 1 40 PRO O O 1.851 7.703 -2.977 1.00 . A A . 40 PRO O 1 1 11 6977 1 1 41 SER C C 4.253 10.567 -3.645 1.00 . A A . 41 SER C 1 1 11 6978 1 1 41 SER CA C 2.771 10.278 -3.423 1.00 . A A . 41 SER CA 1 1 11 6979 1 1 41 SER CB C 1.964 11.573 -3.542 1.00 . A A . 41 SER CB 1 1 11 6980 1 1 41 SER H H 2.732 10.181 -1.308 1.00 . A A . 41 SER H 1 1 11 6981 1 1 41 SER HA H 2.435 9.584 -4.179 1.00 . A A . 41 SER HA 1 1 11 6982 1 1 41 SER HB2 H 1.850 12.015 -2.564 1.00 . A A . 41 SER HB2 1 1 11 6983 1 1 41 SER HB3 H 2.487 12.261 -4.190 1.00 . A A . 41 SER HB3 1 1 11 6984 1 1 41 SER HG H 0.556 11.852 -4.875 1.00 . A A . 41 SER HG 1 1 11 6985 1 1 41 SER N N 2.549 9.662 -2.119 1.00 . A A . 41 SER N 1 1 11 6986 1 1 41 SER O O 4.612 11.492 -4.374 1.00 . A A . 41 SER O 1 1 11 6987 1 1 41 SER OG O 0.678 11.324 -4.083 1.00 . A A . 41 SER OG 1 1 11 6988 1 1 42 TYR C C 7.286 8.653 -2.778 1.00 . A A . 42 TYR C 1 1 11 6989 1 1 42 TYR CA C 6.551 9.940 -3.145 1.00 . A A . 42 TYR CA 1 1 11 6990 1 1 42 TYR CB C 7.033 11.089 -2.257 1.00 . A A . 42 TYR CB 1 1 11 6991 1 1 42 TYR CD1 C 5.787 11.334 -0.074 1.00 . A A . 42 TYR CD1 1 1 11 6992 1 1 42 TYR CD2 C 7.804 10.062 -0.083 1.00 . A A . 42 TYR CD2 1 1 11 6993 1 1 42 TYR CE1 C 5.637 11.093 1.278 1.00 . A A . 42 TYR CE1 1 1 11 6994 1 1 42 TYR CE2 C 7.660 9.817 1.269 1.00 . A A . 42 TYR CE2 1 1 11 6995 1 1 42 TYR CG C 6.871 10.824 -0.777 1.00 . A A . 42 TYR CG 1 1 11 6996 1 1 42 TYR CZ C 6.575 10.334 1.945 1.00 . A A . 42 TYR CZ 1 1 11 6997 1 1 42 TYR H H 4.763 9.049 -2.447 1.00 . A A . 42 TYR H 1 1 11 6998 1 1 42 TYR HA H 6.763 10.180 -4.176 1.00 . A A . 42 TYR HA 1 1 11 6999 1 1 42 TYR HB2 H 8.081 11.268 -2.448 1.00 . A A . 42 TYR HB2 1 1 11 7000 1 1 42 TYR HB3 H 6.472 11.980 -2.498 1.00 . A A . 42 TYR HB3 1 1 11 7001 1 1 42 TYR HD1 H 5.053 11.927 -0.599 1.00 . A A . 42 TYR HD1 1 1 11 7002 1 1 42 TYR HD2 H 8.653 9.659 -0.615 1.00 . A A . 42 TYR HD2 1 1 11 7003 1 1 42 TYR HE1 H 4.787 11.498 1.807 1.00 . A A . 42 TYR HE1 1 1 11 7004 1 1 42 TYR HE2 H 8.396 9.222 1.791 1.00 . A A . 42 TYR HE2 1 1 11 7005 1 1 42 TYR HH H 7.205 10.406 3.760 1.00 . A A . 42 TYR HH 1 1 11 7006 1 1 42 TYR N N 5.109 9.770 -3.013 1.00 . A A . 42 TYR N 1 1 11 7007 1 1 42 TYR O O 6.831 7.890 -1.926 1.00 . A A . 42 TYR O 1 1 11 7008 1 1 42 TYR OH O 6.429 10.092 3.292 1.00 . A A . 42 TYR OH 1 1 11 7009 1 1 43 PRO C C 9.933 7.245 -1.801 1.00 . A A . 43 PRO C 1 1 11 7010 1 1 43 PRO CA C 9.235 7.191 -3.156 1.00 . A A . 43 PRO CA 1 1 11 7011 1 1 43 PRO CB C 10.264 7.194 -4.287 1.00 . A A . 43 PRO CB 1 1 11 7012 1 1 43 PRO CD C 9.055 9.250 -4.451 1.00 . A A . 43 PRO CD 1 1 11 7013 1 1 43 PRO CG C 10.408 8.628 -4.660 1.00 . A A . 43 PRO CG 1 1 11 7014 1 1 43 PRO HA H 8.633 6.297 -3.214 1.00 . A A . 43 PRO HA 1 1 11 7015 1 1 43 PRO HB2 H 11.196 6.781 -3.931 1.00 . A A . 43 PRO HB2 1 1 11 7016 1 1 43 PRO HB3 H 9.895 6.607 -5.115 1.00 . A A . 43 PRO HB3 1 1 11 7017 1 1 43 PRO HD2 H 9.157 10.266 -4.098 1.00 . A A . 43 PRO HD2 1 1 11 7018 1 1 43 PRO HD3 H 8.482 9.223 -5.366 1.00 . A A . 43 PRO HD3 1 1 11 7019 1 1 43 PRO HG2 H 11.141 9.101 -4.022 1.00 . A A . 43 PRO HG2 1 1 11 7020 1 1 43 PRO HG3 H 10.702 8.711 -5.696 1.00 . A A . 43 PRO HG3 1 1 11 7021 1 1 43 PRO N N 8.439 8.393 -3.419 1.00 . A A . 43 PRO N 1 1 11 7022 1 1 43 PRO O O 10.457 8.285 -1.402 1.00 . A A . 43 PRO O 1 1 11 7023 1 1 44 GLY C C 9.622 6.415 1.332 1.00 . A A . 44 GLY C 1 1 11 7024 1 1 44 GLY CA C 10.571 6.057 0.205 1.00 . A A . 44 GLY CA 1 1 11 7025 1 1 44 GLY H H 9.502 5.319 -1.466 1.00 . A A . 44 GLY H 1 1 11 7026 1 1 44 GLY HA2 H 11.404 6.744 0.219 1.00 . A A . 44 GLY HA2 1 1 11 7027 1 1 44 GLY HA3 H 10.942 5.055 0.367 1.00 . A A . 44 GLY HA3 1 1 11 7028 1 1 44 GLY N N 9.935 6.117 -1.098 1.00 . A A . 44 GLY N 1 1 11 7029 1 1 44 GLY O O 8.523 6.914 1.091 1.00 . A A . 44 GLY O 1 1 11 7030 1 1 45 ASN C C 10.061 7.110 4.831 1.00 . A A . 45 ASN C 1 1 11 7031 1 1 45 ASN CA C 9.227 6.458 3.733 1.00 . A A . 45 ASN CA 1 1 11 7032 1 1 45 ASN CB C 8.573 5.181 4.263 1.00 . A A . 45 ASN CB 1 1 11 7033 1 1 45 ASN CG C 7.384 5.469 5.159 1.00 . A A . 45 ASN CG 1 1 11 7034 1 1 45 ASN H H 10.933 5.761 2.692 1.00 . A A . 45 ASN H 1 1 11 7035 1 1 45 ASN HA H 8.454 7.147 3.427 1.00 . A A . 45 ASN HA 1 1 11 7036 1 1 45 ASN HB2 H 8.235 4.584 3.429 1.00 . A A . 45 ASN HB2 1 1 11 7037 1 1 45 ASN HB3 H 9.301 4.620 4.830 1.00 . A A . 45 ASN HB3 1 1 11 7038 1 1 45 ASN HD21 H 7.657 3.747 6.115 1.00 . A A . 45 ASN HD21 1 1 11 7039 1 1 45 ASN HD22 H 6.332 4.709 6.665 1.00 . A A . 45 ASN HD22 1 1 11 7040 1 1 45 ASN N N 10.047 6.160 2.565 1.00 . A A . 45 ASN N 1 1 11 7041 1 1 45 ASN ND2 N 7.095 4.549 6.072 1.00 . A A . 45 ASN ND2 1 1 11 7042 1 1 45 ASN O O 10.473 6.450 5.785 1.00 . A A . 45 ASN O 1 1 11 7043 1 1 45 ASN OD1 O 6.734 6.506 5.033 1.00 . A A . 45 ASN OD1 1 1 11 7044 1 1 46 GLY C C 12.520 9.353 5.230 1.00 . A A . 46 GLY C 1 1 11 7045 1 1 46 GLY CA C 11.089 9.127 5.677 1.00 . A A . 46 GLY CA 1 1 11 7046 1 1 46 GLY H H 9.951 8.882 3.909 1.00 . A A . 46 GLY H 1 1 11 7047 1 1 46 GLY HA2 H 11.096 8.561 6.597 1.00 . A A . 46 GLY HA2 1 1 11 7048 1 1 46 GLY HA3 H 10.625 10.085 5.860 1.00 . A A . 46 GLY HA3 1 1 11 7049 1 1 46 GLY N N 10.305 8.408 4.690 1.00 . A A . 46 GLY N 1 1 11 7050 1 1 46 GLY O O 13.204 8.360 4.906 1.00 . A A . 46 GLY O 1 1 11 7051 1 1 46 GLY OXT O 12.955 10.523 5.202 1.00 . A A . 46 GLY OXT 1 1 12 7052 1 1 1 ALA C C -17.080 -7.781 4.182 1.00 . A A . 1 ALA C 1 1 12 7053 1 1 1 ALA CA C -16.357 -8.925 4.886 1.00 . A A . 1 ALA CA 1 1 12 7054 1 1 1 ALA CB C -15.274 -8.378 5.803 1.00 . A A . 1 ALA CB 1 1 12 7055 1 1 1 ALA H1 H -16.498 -10.078 3.189 1.00 . A A . 1 ALA H1 1 1 12 7056 1 1 1 ALA H2 H -14.946 -9.407 3.470 1.00 . A A . 1 ALA H2 1 1 12 7057 1 1 1 ALA H3 H -15.492 -10.731 4.417 1.00 . A A . 1 ALA H3 1 1 12 7058 1 1 1 ALA HA H -17.069 -9.465 5.493 1.00 . A A . 1 ALA HA 1 1 12 7059 1 1 1 ALA HB1 H -14.596 -9.175 6.073 1.00 . A A . 1 ALA HB1 1 1 12 7060 1 1 1 ALA HB2 H -14.728 -7.599 5.291 1.00 . A A . 1 ALA HB2 1 1 12 7061 1 1 1 ALA HB3 H -15.728 -7.973 6.695 1.00 . A A . 1 ALA HB3 1 1 12 7062 1 1 1 ALA N N -15.770 -9.870 3.901 1.00 . A A . 1 ALA N 1 1 12 7063 1 1 1 ALA O O -17.261 -7.804 2.965 1.00 . A A . 1 ALA O 1 1 12 7064 1 1 2 MET C C -17.319 -4.886 3.403 1.00 . A A . 2 MET C 1 1 12 7065 1 1 2 MET CA C -18.194 -5.629 4.407 1.00 . A A . 2 MET CA 1 1 12 7066 1 1 2 MET CB C -18.619 -4.681 5.530 1.00 . A A . 2 MET CB 1 1 12 7067 1 1 2 MET CE C -20.151 -7.737 5.684 1.00 . A A . 2 MET CE 1 1 12 7068 1 1 2 MET CG C -19.983 -5.005 6.116 1.00 . A A . 2 MET CG 1 1 12 7069 1 1 2 MET H H -17.317 -6.822 5.920 1.00 . A A . 2 MET H 1 1 12 7070 1 1 2 MET HA H -19.077 -5.990 3.900 1.00 . A A . 2 MET HA 1 1 12 7071 1 1 2 MET HB2 H -17.888 -4.733 6.324 1.00 . A A . 2 MET HB2 1 1 12 7072 1 1 2 MET HB3 H -18.647 -3.673 5.144 1.00 . A A . 2 MET HB3 1 1 12 7073 1 1 2 MET HE1 H -20.396 -7.213 4.773 1.00 . A A . 2 MET HE1 1 1 12 7074 1 1 2 MET HE2 H -19.216 -8.263 5.557 1.00 . A A . 2 MET HE2 1 1 12 7075 1 1 2 MET HE3 H -20.933 -8.446 5.914 1.00 . A A . 2 MET HE3 1 1 12 7076 1 1 2 MET HG2 H -20.269 -4.210 6.788 1.00 . A A . 2 MET HG2 1 1 12 7077 1 1 2 MET HG3 H -20.700 -5.069 5.311 1.00 . A A . 2 MET HG3 1 1 12 7078 1 1 2 MET N N -17.491 -6.782 4.956 1.00 . A A . 2 MET N 1 1 12 7079 1 1 2 MET O O -17.537 -4.969 2.194 1.00 . A A . 2 MET O 1 1 12 7080 1 1 2 MET SD S -19.996 -6.562 7.027 1.00 . A A . 2 MET SD 1 1 12 7081 1 1 3 ASP C C -14.088 -4.126 2.904 1.00 . A A . 3 ASP C 1 1 12 7082 1 1 3 ASP CA C -15.421 -3.402 3.059 1.00 . A A . 3 ASP CA 1 1 12 7083 1 1 3 ASP CB C -15.191 -2.005 3.638 1.00 . A A . 3 ASP CB 1 1 12 7084 1 1 3 ASP CG C -16.207 -0.997 3.137 1.00 . A A . 3 ASP CG 1 1 12 7085 1 1 3 ASP H H -16.207 -4.133 4.883 1.00 . A A . 3 ASP H 1 1 12 7086 1 1 3 ASP HA H -15.881 -3.307 2.086 1.00 . A A . 3 ASP HA 1 1 12 7087 1 1 3 ASP HB2 H -15.260 -2.052 4.714 1.00 . A A . 3 ASP HB2 1 1 12 7088 1 1 3 ASP HB3 H -14.205 -1.664 3.359 1.00 . A A . 3 ASP HB3 1 1 12 7089 1 1 3 ASP N N -16.329 -4.160 3.911 1.00 . A A . 3 ASP N 1 1 12 7090 1 1 3 ASP O O -13.796 -4.692 1.851 1.00 . A A . 3 ASP O 1 1 12 7091 1 1 3 ASP OD1 O -15.807 -0.061 2.412 1.00 . A A . 3 ASP OD1 1 1 12 7092 1 1 3 ASP OD2 O -17.402 -1.143 3.468 1.00 . A A . 3 ASP OD2 1 1 12 7093 1 1 4 CYS C C -10.987 -4.023 3.044 1.00 . A A . 4 CYS C 1 1 12 7094 1 1 4 CYS CA C -11.974 -4.760 3.950 1.00 . A A . 4 CYS CA 1 1 12 7095 1 1 4 CYS CB C -12.114 -6.216 3.500 1.00 . A A . 4 CYS CB 1 1 12 7096 1 1 4 CYS H H -13.572 -3.637 4.774 1.00 . A A . 4 CYS H 1 1 12 7097 1 1 4 CYS HA H -11.591 -4.744 4.959 1.00 . A A . 4 CYS HA 1 1 12 7098 1 1 4 CYS HB2 H -13.130 -6.388 3.179 1.00 . A A . 4 CYS HB2 1 1 12 7099 1 1 4 CYS HB3 H -11.446 -6.395 2.671 1.00 . A A . 4 CYS HB3 1 1 12 7100 1 1 4 CYS N N -13.281 -4.105 3.963 1.00 . A A . 4 CYS N 1 1 12 7101 1 1 4 CYS O O -9.887 -4.509 2.788 1.00 . A A . 4 CYS O 1 1 12 7102 1 1 4 CYS SG S -11.731 -7.435 4.800 1.00 . A A . 4 CYS SG 1 1 12 7103 1 1 5 THR C C -10.169 -2.822 0.423 1.00 . A A . 5 THR C 1 1 12 7104 1 1 5 THR CA C -10.524 -2.053 1.692 1.00 . A A . 5 THR CA 1 1 12 7105 1 1 5 THR CB C -9.248 -1.646 2.431 1.00 . A A . 5 THR CB 1 1 12 7106 1 1 5 THR CG2 C -8.848 -0.207 2.186 1.00 . A A . 5 THR CG2 1 1 12 7107 1 1 5 THR H H -12.267 -2.508 2.801 1.00 . A A . 5 THR H 1 1 12 7108 1 1 5 THR HA H -11.068 -1.161 1.417 1.00 . A A . 5 THR HA 1 1 12 7109 1 1 5 THR HB H -8.434 -2.276 2.100 1.00 . A A . 5 THR HB 1 1 12 7110 1 1 5 THR HG1 H -8.951 -2.618 4.106 1.00 . A A . 5 THR HG1 1 1 12 7111 1 1 5 THR HG21 H -9.680 0.442 2.418 1.00 . A A . 5 THR HG21 1 1 12 7112 1 1 5 THR HG22 H -8.008 0.046 2.816 1.00 . A A . 5 THR HG22 1 1 12 7113 1 1 5 THR HG23 H -8.571 -0.082 1.149 1.00 . A A . 5 THR HG23 1 1 12 7114 1 1 5 THR N N -11.382 -2.849 2.563 1.00 . A A . 5 THR N 1 1 12 7115 1 1 5 THR O O -10.482 -4.006 0.293 1.00 . A A . 5 THR O 1 1 12 7116 1 1 5 THR OG1 O -9.400 -1.816 3.829 1.00 . A A . 5 THR OG1 1 1 12 7117 1 1 6 THR C C -8.298 -1.771 -2.610 1.00 . A A . 6 THR C 1 1 12 7118 1 1 6 THR CA C -9.109 -2.753 -1.770 1.00 . A A . 6 THR CA 1 1 12 7119 1 1 6 THR CB C -10.339 -3.220 -2.551 1.00 . A A . 6 THR CB 1 1 12 7120 1 1 6 THR CG2 C -10.648 -4.689 -2.358 1.00 . A A . 6 THR CG2 1 1 12 7121 1 1 6 THR H H -9.291 -1.199 -0.344 1.00 . A A . 6 THR H 1 1 12 7122 1 1 6 THR HA H -8.491 -3.608 -1.540 1.00 . A A . 6 THR HA 1 1 12 7123 1 1 6 THR HB H -10.169 -3.054 -3.605 1.00 . A A . 6 THR HB 1 1 12 7124 1 1 6 THR HG1 H -11.737 -1.887 -2.872 1.00 . A A . 6 THR HG1 1 1 12 7125 1 1 6 THR HG21 H -9.896 -5.134 -1.723 1.00 . A A . 6 THR HG21 1 1 12 7126 1 1 6 THR HG22 H -11.618 -4.795 -1.896 1.00 . A A . 6 THR HG22 1 1 12 7127 1 1 6 THR HG23 H -10.649 -5.186 -3.317 1.00 . A A . 6 THR HG23 1 1 12 7128 1 1 6 THR N N -9.512 -2.140 -0.509 1.00 . A A . 6 THR N 1 1 12 7129 1 1 6 THR O O -8.706 -0.626 -2.807 1.00 . A A . 6 THR O 1 1 12 7130 1 1 6 THR OG1 O -11.487 -2.485 -2.164 1.00 . A A . 6 THR OG1 1 1 12 7131 1 1 7 GLY C C -4.857 -1.828 -3.947 1.00 . A A . 7 GLY C 1 1 12 7132 1 1 7 GLY CA C -6.302 -1.363 -3.906 1.00 . A A . 7 GLY CA 1 1 12 7133 1 1 7 GLY H H -6.869 -3.142 -2.907 1.00 . A A . 7 GLY H 1 1 12 7134 1 1 7 GLY HA2 H -6.335 -0.363 -3.499 1.00 . A A . 7 GLY HA2 1 1 12 7135 1 1 7 GLY HA3 H -6.690 -1.342 -4.914 1.00 . A A . 7 GLY HA3 1 1 12 7136 1 1 7 GLY N N -7.147 -2.222 -3.099 1.00 . A A . 7 GLY N 1 1 12 7137 1 1 7 GLY O O -4.587 -3.028 -3.887 1.00 . A A . 7 GLY O 1 1 12 7138 1 1 8 PRO C C -1.809 -1.336 -2.762 1.00 . A A . 8 PRO C 1 1 12 7139 1 1 8 PRO CA C -2.475 -1.213 -4.133 1.00 . A A . 8 PRO CA 1 1 12 7140 1 1 8 PRO CB C -1.909 -0.017 -4.892 1.00 . A A . 8 PRO CB 1 1 12 7141 1 1 8 PRO CD C -4.133 0.563 -4.166 1.00 . A A . 8 PRO CD 1 1 12 7142 1 1 8 PRO CG C -2.768 1.131 -4.476 1.00 . A A . 8 PRO CG 1 1 12 7143 1 1 8 PRO HA H -2.299 -2.115 -4.701 1.00 . A A . 8 PRO HA 1 1 12 7144 1 1 8 PRO HB2 H -0.877 0.137 -4.611 1.00 . A A . 8 PRO HB2 1 1 12 7145 1 1 8 PRO HB3 H -1.977 -0.194 -5.956 1.00 . A A . 8 PRO HB3 1 1 12 7146 1 1 8 PRO HD2 H -4.501 0.957 -3.230 1.00 . A A . 8 PRO HD2 1 1 12 7147 1 1 8 PRO HD3 H -4.823 0.786 -4.966 1.00 . A A . 8 PRO HD3 1 1 12 7148 1 1 8 PRO HG2 H -2.352 1.598 -3.597 1.00 . A A . 8 PRO HG2 1 1 12 7149 1 1 8 PRO HG3 H -2.837 1.846 -5.282 1.00 . A A . 8 PRO HG3 1 1 12 7150 1 1 8 PRO N N -3.899 -0.891 -4.065 1.00 . A A . 8 PRO N 1 1 12 7151 1 1 8 PRO O O -0.882 -2.127 -2.587 1.00 . A A . 8 PRO O 1 1 12 7152 1 1 9 CYS C C -2.467 -1.493 0.484 1.00 . A A . 9 CYS C 1 1 12 7153 1 1 9 CYS CA C -1.691 -0.570 -0.452 1.00 . A A . 9 CYS CA 1 1 12 7154 1 1 9 CYS CB C -1.636 0.844 0.131 1.00 . A A . 9 CYS CB 1 1 12 7155 1 1 9 CYS H H -3.003 0.076 -1.991 1.00 . A A . 9 CYS H 1 1 12 7156 1 1 9 CYS HA H -0.684 -0.946 -0.540 1.00 . A A . 9 CYS HA 1 1 12 7157 1 1 9 CYS HB2 H -1.929 1.551 -0.631 1.00 . A A . 9 CYS HB2 1 1 12 7158 1 1 9 CYS HB3 H -2.323 0.912 0.961 1.00 . A A . 9 CYS HB3 1 1 12 7159 1 1 9 CYS N N -2.270 -0.545 -1.796 1.00 . A A . 9 CYS N 1 1 12 7160 1 1 9 CYS O O -2.535 -1.252 1.689 1.00 . A A . 9 CYS O 1 1 12 7161 1 1 9 CYS SG S 0.013 1.334 0.734 1.00 . A A . 9 CYS SG 1 1 12 7162 1 1 10 CYS C C -3.977 -4.822 -0.040 1.00 . A A . 10 CYS C 1 1 12 7163 1 1 10 CYS CA C -3.791 -3.518 0.726 1.00 . A A . 10 CYS CA 1 1 12 7164 1 1 10 CYS CB C -5.149 -2.937 1.129 1.00 . A A . 10 CYS CB 1 1 12 7165 1 1 10 CYS H H -2.940 -2.704 -1.032 1.00 . A A . 10 CYS H 1 1 12 7166 1 1 10 CYS HA H -3.220 -3.723 1.619 1.00 . A A . 10 CYS HA 1 1 12 7167 1 1 10 CYS HB2 H -5.636 -3.621 1.807 1.00 . A A . 10 CYS HB2 1 1 12 7168 1 1 10 CYS HB3 H -4.992 -1.993 1.631 1.00 . A A . 10 CYS HB3 1 1 12 7169 1 1 10 CYS N N -3.037 -2.557 -0.070 1.00 . A A . 10 CYS N 1 1 12 7170 1 1 10 CYS O O -4.552 -4.840 -1.129 1.00 . A A . 10 CYS O 1 1 12 7171 1 1 10 CYS SG S -6.282 -2.642 -0.265 1.00 . A A . 10 CYS SG 1 1 12 7172 1 1 11 ARG C C -4.985 -7.498 -0.610 1.00 . A A . 11 ARG C 1 1 12 7173 1 1 11 ARG CA C -3.573 -7.229 -0.090 1.00 . A A . 11 ARG CA 1 1 12 7174 1 1 11 ARG CB C -3.155 -8.318 0.904 1.00 . A A . 11 ARG CB 1 1 12 7175 1 1 11 ARG CD C -2.795 -10.767 1.353 1.00 . A A . 11 ARG CD 1 1 12 7176 1 1 11 ARG CG C -3.298 -9.731 0.360 1.00 . A A . 11 ARG CG 1 1 12 7177 1 1 11 ARG CZ C -0.878 -9.810 2.577 1.00 . A A . 11 ARG CZ 1 1 12 7178 1 1 11 ARG H H -3.024 -5.829 1.400 1.00 . A A . 11 ARG H 1 1 12 7179 1 1 11 ARG HA H -2.891 -7.243 -0.927 1.00 . A A . 11 ARG HA 1 1 12 7180 1 1 11 ARG HB2 H -2.120 -8.164 1.172 1.00 . A A . 11 ARG HB2 1 1 12 7181 1 1 11 ARG HB3 H -3.763 -8.233 1.792 1.00 . A A . 11 ARG HB3 1 1 12 7182 1 1 11 ARG HD2 H -3.348 -10.663 2.274 1.00 . A A . 11 ARG HD2 1 1 12 7183 1 1 11 ARG HD3 H -2.966 -11.751 0.942 1.00 . A A . 11 ARG HD3 1 1 12 7184 1 1 11 ARG HE H -0.743 -11.132 1.089 1.00 . A A . 11 ARG HE 1 1 12 7185 1 1 11 ARG HG2 H -4.341 -9.922 0.153 1.00 . A A . 11 ARG HG2 1 1 12 7186 1 1 11 ARG HG3 H -2.727 -9.814 -0.554 1.00 . A A . 11 ARG HG3 1 1 12 7187 1 1 11 ARG HH11 H -2.680 -9.136 3.203 1.00 . A A . 11 ARG HH11 1 1 12 7188 1 1 11 ARG HH12 H -1.313 -8.486 4.042 1.00 . A A . 11 ARG HH12 1 1 12 7189 1 1 11 ARG HH21 H 1.051 -10.276 2.194 1.00 . A A . 11 ARG HH21 1 1 12 7190 1 1 11 ARG HH22 H 0.803 -9.132 3.471 1.00 . A A . 11 ARG HH22 1 1 12 7191 1 1 11 ARG N N -3.477 -5.913 0.535 1.00 . A A . 11 ARG N 1 1 12 7192 1 1 11 ARG NE N -1.369 -10.611 1.633 1.00 . A A . 11 ARG NE 1 1 12 7193 1 1 11 ARG NH1 N -1.691 -9.085 3.336 1.00 . A A . 11 ARG NH1 1 1 12 7194 1 1 11 ARG NH2 N 0.433 -9.733 2.763 1.00 . A A . 11 ARG NH2 1 1 12 7195 1 1 11 ARG O O -5.261 -7.316 -1.796 1.00 . A A . 11 ARG O 1 1 12 7196 1 1 12 GLN C C -8.232 -7.996 1.028 1.00 . A A . 12 GLN C 1 1 12 7197 1 1 12 GLN CA C -7.248 -8.236 -0.115 1.00 . A A . 12 GLN CA 1 1 12 7198 1 1 12 GLN CB C -7.353 -9.685 -0.580 1.00 . A A . 12 GLN CB 1 1 12 7199 1 1 12 GLN CD C -9.702 -10.431 -1.136 1.00 . A A . 12 GLN CD 1 1 12 7200 1 1 12 GLN CG C -8.387 -9.902 -1.674 1.00 . A A . 12 GLN CG 1 1 12 7201 1 1 12 GLN H H -5.599 -8.074 1.205 1.00 . A A . 12 GLN H 1 1 12 7202 1 1 12 GLN HA H -7.505 -7.587 -0.938 1.00 . A A . 12 GLN HA 1 1 12 7203 1 1 12 GLN HB2 H -6.391 -10.001 -0.954 1.00 . A A . 12 GLN HB2 1 1 12 7204 1 1 12 GLN HB3 H -7.620 -10.300 0.266 1.00 . A A . 12 GLN HB3 1 1 12 7205 1 1 12 GLN HE21 H -8.793 -12.056 -0.440 1.00 . A A . 12 GLN HE21 1 1 12 7206 1 1 12 GLN HE22 H -10.495 -11.969 -0.158 1.00 . A A . 12 GLN HE22 1 1 12 7207 1 1 12 GLN HG2 H -8.571 -8.960 -2.169 1.00 . A A . 12 GLN HG2 1 1 12 7208 1 1 12 GLN HG3 H -7.994 -10.612 -2.386 1.00 . A A . 12 GLN HG3 1 1 12 7209 1 1 12 GLN N N -5.874 -7.939 0.276 1.00 . A A . 12 GLN N 1 1 12 7210 1 1 12 GLN NE2 N -9.659 -11.604 -0.515 1.00 . A A . 12 GLN NE2 1 1 12 7211 1 1 12 GLN O O -9.399 -8.375 0.934 1.00 . A A . 12 GLN O 1 1 12 7212 1 1 12 GLN OE1 O -10.745 -9.792 -1.276 1.00 . A A . 12 GLN OE1 1 1 12 7213 1 1 13 CYS C C -8.013 -6.098 4.218 1.00 . A A . 13 CYS C 1 1 12 7214 1 1 13 CYS CA C -8.637 -7.099 3.246 1.00 . A A . 13 CYS CA 1 1 12 7215 1 1 13 CYS CB C -8.974 -8.401 3.976 1.00 . A A . 13 CYS CB 1 1 12 7216 1 1 13 CYS H H -6.835 -7.088 2.134 1.00 . A A . 13 CYS H 1 1 12 7217 1 1 13 CYS HA H -9.551 -6.676 2.862 1.00 . A A . 13 CYS HA 1 1 12 7218 1 1 13 CYS HB2 H -8.367 -9.198 3.573 1.00 . A A . 13 CYS HB2 1 1 12 7219 1 1 13 CYS HB3 H -8.755 -8.285 5.028 1.00 . A A . 13 CYS HB3 1 1 12 7220 1 1 13 CYS N N -7.769 -7.370 2.106 1.00 . A A . 13 CYS N 1 1 12 7221 1 1 13 CYS O O -8.721 -5.290 4.819 1.00 . A A . 13 CYS O 1 1 12 7222 1 1 13 CYS SG S -10.719 -8.900 3.823 1.00 . A A . 13 CYS SG 1 1 12 7223 1 1 14 LYS C C -4.792 -4.621 4.617 1.00 . A A . 14 LYS C 1 1 12 7224 1 1 14 LYS CA C -6.011 -5.238 5.286 1.00 . A A . 14 LYS CA 1 1 12 7225 1 1 14 LYS CB C -5.592 -5.973 6.561 1.00 . A A . 14 LYS CB 1 1 12 7226 1 1 14 LYS CD C -5.319 -5.908 9.058 1.00 . A A . 14 LYS CD 1 1 12 7227 1 1 14 LYS CE C -6.017 -5.340 10.283 1.00 . A A . 14 LYS CE 1 1 12 7228 1 1 14 LYS CG C -5.647 -5.106 7.808 1.00 . A A . 14 LYS CG 1 1 12 7229 1 1 14 LYS H H -6.167 -6.811 3.881 1.00 . A A . 14 LYS H 1 1 12 7230 1 1 14 LYS HA H -6.702 -4.450 5.546 1.00 . A A . 14 LYS HA 1 1 12 7231 1 1 14 LYS HB2 H -6.247 -6.819 6.707 1.00 . A A . 14 LYS HB2 1 1 12 7232 1 1 14 LYS HB3 H -4.579 -6.329 6.440 1.00 . A A . 14 LYS HB3 1 1 12 7233 1 1 14 LYS HD2 H -5.640 -6.928 8.914 1.00 . A A . 14 LYS HD2 1 1 12 7234 1 1 14 LYS HD3 H -4.251 -5.884 9.219 1.00 . A A . 14 LYS HD3 1 1 12 7235 1 1 14 LYS HE2 H -5.355 -4.636 10.765 1.00 . A A . 14 LYS HE2 1 1 12 7236 1 1 14 LYS HE3 H -6.915 -4.830 9.965 1.00 . A A . 14 LYS HE3 1 1 12 7237 1 1 14 LYS HG2 H -4.932 -4.304 7.710 1.00 . A A . 14 LYS HG2 1 1 12 7238 1 1 14 LYS HG3 H -6.641 -4.695 7.905 1.00 . A A . 14 LYS HG3 1 1 12 7239 1 1 14 LYS HZ1 H -5.571 -7.033 11.422 1.00 . A A . 14 LYS HZ1 1 1 12 7240 1 1 14 LYS HZ2 H -6.666 -5.978 12.163 1.00 . A A . 14 LYS HZ2 1 1 12 7241 1 1 14 LYS HZ3 H -7.175 -6.969 10.889 1.00 . A A . 14 LYS HZ3 1 1 12 7242 1 1 14 LYS N N -6.694 -6.149 4.378 1.00 . A A . 14 LYS N 1 1 12 7243 1 1 14 LYS NZ N -6.383 -6.405 11.257 1.00 . A A . 14 LYS NZ 1 1 12 7244 1 1 14 LYS O O -4.002 -5.320 3.983 1.00 . A A . 14 LYS O 1 1 12 7245 1 1 15 LEU C C -2.212 -3.353 4.420 1.00 . A A . 15 LEU C 1 1 12 7246 1 1 15 LEU CA C -3.513 -2.597 4.170 1.00 . A A . 15 LEU CA 1 1 12 7247 1 1 15 LEU CB C -3.405 -1.161 4.711 1.00 . A A . 15 LEU CB 1 1 12 7248 1 1 15 LEU CD1 C -5.261 -0.769 6.369 1.00 . A A . 15 LEU CD1 1 1 12 7249 1 1 15 LEU CD2 C -3.247 -2.093 7.056 1.00 . A A . 15 LEU CD2 1 1 12 7250 1 1 15 LEU CG C -3.760 -0.949 6.192 1.00 . A A . 15 LEU CG 1 1 12 7251 1 1 15 LEU H H -5.307 -2.807 5.277 1.00 . A A . 15 LEU H 1 1 12 7252 1 1 15 LEU HA H -3.682 -2.554 3.105 1.00 . A A . 15 LEU HA 1 1 12 7253 1 1 15 LEU HB2 H -2.390 -0.826 4.562 1.00 . A A . 15 LEU HB2 1 1 12 7254 1 1 15 LEU HB3 H -4.056 -0.534 4.119 1.00 . A A . 15 LEU HB3 1 1 12 7255 1 1 15 LEU HD11 H -5.725 -0.638 5.403 1.00 . A A . 15 LEU HD11 1 1 12 7256 1 1 15 LEU HD12 H -5.674 -1.643 6.851 1.00 . A A . 15 LEU HD12 1 1 12 7257 1 1 15 LEU HD13 H -5.449 0.101 6.980 1.00 . A A . 15 LEU HD13 1 1 12 7258 1 1 15 LEU HD21 H -2.179 -2.188 6.929 1.00 . A A . 15 LEU HD21 1 1 12 7259 1 1 15 LEU HD22 H -3.467 -1.886 8.093 1.00 . A A . 15 LEU HD22 1 1 12 7260 1 1 15 LEU HD23 H -3.728 -3.013 6.764 1.00 . A A . 15 LEU HD23 1 1 12 7261 1 1 15 LEU HG H -3.283 -0.041 6.532 1.00 . A A . 15 LEU HG 1 1 12 7262 1 1 15 LEU N N -4.643 -3.306 4.762 1.00 . A A . 15 LEU N 1 1 12 7263 1 1 15 LEU O O -1.980 -3.865 5.515 1.00 . A A . 15 LEU O 1 1 12 7264 1 1 16 LYS C C 0.698 -3.614 4.707 1.00 . A A . 16 LYS C 1 1 12 7265 1 1 16 LYS CA C -0.102 -4.140 3.516 1.00 . A A . 16 LYS CA 1 1 12 7266 1 1 16 LYS CB C 0.713 -3.993 2.230 1.00 . A A . 16 LYS CB 1 1 12 7267 1 1 16 LYS CD C 0.759 -4.194 -0.274 1.00 . A A . 16 LYS CD 1 1 12 7268 1 1 16 LYS CE C 0.577 -5.254 -1.348 1.00 . A A . 16 LYS CE 1 1 12 7269 1 1 16 LYS CG C 0.021 -4.563 1.003 1.00 . A A . 16 LYS CG 1 1 12 7270 1 1 16 LYS H H -1.610 -3.016 2.544 1.00 . A A . 16 LYS H 1 1 12 7271 1 1 16 LYS HA H -0.325 -5.186 3.677 1.00 . A A . 16 LYS HA 1 1 12 7272 1 1 16 LYS HB2 H 0.903 -2.944 2.056 1.00 . A A . 16 LYS HB2 1 1 12 7273 1 1 16 LYS HB3 H 1.656 -4.505 2.355 1.00 . A A . 16 LYS HB3 1 1 12 7274 1 1 16 LYS HD2 H 0.375 -3.254 -0.642 1.00 . A A . 16 LYS HD2 1 1 12 7275 1 1 16 LYS HD3 H 1.812 -4.094 -0.053 1.00 . A A . 16 LYS HD3 1 1 12 7276 1 1 16 LYS HE2 H 0.328 -6.191 -0.873 1.00 . A A . 16 LYS HE2 1 1 12 7277 1 1 16 LYS HE3 H -0.232 -4.955 -1.998 1.00 . A A . 16 LYS HE3 1 1 12 7278 1 1 16 LYS HG2 H -0.014 -5.639 1.088 1.00 . A A . 16 LYS HG2 1 1 12 7279 1 1 16 LYS HG3 H -0.984 -4.170 0.954 1.00 . A A . 16 LYS HG3 1 1 12 7280 1 1 16 LYS HZ1 H 2.650 -5.190 -1.599 1.00 . A A . 16 LYS HZ1 1 1 12 7281 1 1 16 LYS HZ2 H 1.892 -6.428 -2.469 1.00 . A A . 16 LYS HZ2 1 1 12 7282 1 1 16 LYS HZ3 H 1.779 -4.828 -3.003 1.00 . A A . 16 LYS HZ3 1 1 12 7283 1 1 16 LYS N N -1.370 -3.433 3.397 1.00 . A A . 16 LYS N 1 1 12 7284 1 1 16 LYS NZ N 1.811 -5.438 -2.161 1.00 . A A . 16 LYS NZ 1 1 12 7285 1 1 16 LYS O O 0.618 -2.433 5.044 1.00 . A A . 16 LYS O 1 1 12 7286 1 1 17 PRO C C 3.186 -2.899 6.228 1.00 . A A . 17 PRO C 1 1 12 7287 1 1 17 PRO CA C 2.295 -4.101 6.521 1.00 . A A . 17 PRO CA 1 1 12 7288 1 1 17 PRO CB C 3.149 -5.347 6.806 1.00 . A A . 17 PRO CB 1 1 12 7289 1 1 17 PRO CD C 1.643 -5.907 5.034 1.00 . A A . 17 PRO CD 1 1 12 7290 1 1 17 PRO CG C 2.992 -6.225 5.608 1.00 . A A . 17 PRO CG 1 1 12 7291 1 1 17 PRO HA H 1.676 -3.883 7.379 1.00 . A A . 17 PRO HA 1 1 12 7292 1 1 17 PRO HB2 H 4.179 -5.054 6.945 1.00 . A A . 17 PRO HB2 1 1 12 7293 1 1 17 PRO HB3 H 2.787 -5.834 7.699 1.00 . A A . 17 PRO HB3 1 1 12 7294 1 1 17 PRO HD2 H 1.638 -6.062 3.965 1.00 . A A . 17 PRO HD2 1 1 12 7295 1 1 17 PRO HD3 H 0.877 -6.503 5.510 1.00 . A A . 17 PRO HD3 1 1 12 7296 1 1 17 PRO HG2 H 3.766 -6.005 4.888 1.00 . A A . 17 PRO HG2 1 1 12 7297 1 1 17 PRO HG3 H 3.038 -7.262 5.905 1.00 . A A . 17 PRO HG3 1 1 12 7298 1 1 17 PRO N N 1.482 -4.485 5.363 1.00 . A A . 17 PRO N 1 1 12 7299 1 1 17 PRO O O 3.944 -2.898 5.258 1.00 . A A . 17 PRO O 1 1 12 7300 1 1 18 ALA C C 5.341 -0.987 6.585 1.00 . A A . 18 ALA C 1 1 12 7301 1 1 18 ALA CA C 3.885 -0.660 6.910 1.00 . A A . 18 ALA CA 1 1 12 7302 1 1 18 ALA CB C 3.804 0.195 8.165 1.00 . A A . 18 ALA CB 1 1 12 7303 1 1 18 ALA H H 2.465 -1.935 7.825 1.00 . A A . 18 ALA H 1 1 12 7304 1 1 18 ALA HA H 3.463 -0.095 6.092 1.00 . A A . 18 ALA HA 1 1 12 7305 1 1 18 ALA HB1 H 4.559 -0.124 8.868 1.00 . A A . 18 ALA HB1 1 1 12 7306 1 1 18 ALA HB2 H 3.967 1.231 7.907 1.00 . A A . 18 ALA HB2 1 1 12 7307 1 1 18 ALA HB3 H 2.827 0.085 8.613 1.00 . A A . 18 ALA HB3 1 1 12 7308 1 1 18 ALA N N 3.090 -1.874 7.073 1.00 . A A . 18 ALA N 1 1 12 7309 1 1 18 ALA O O 5.818 -2.086 6.866 1.00 . A A . 18 ALA O 1 1 12 7310 1 1 19 GLY C C 7.595 -1.253 4.516 1.00 . A A . 19 GLY C 1 1 12 7311 1 1 19 GLY CA C 7.430 -0.236 5.630 1.00 . A A . 19 GLY CA 1 1 12 7312 1 1 19 GLY H H 5.606 0.828 5.785 1.00 . A A . 19 GLY H 1 1 12 7313 1 1 19 GLY HA2 H 7.966 -0.582 6.501 1.00 . A A . 19 GLY HA2 1 1 12 7314 1 1 19 GLY HA3 H 7.852 0.705 5.310 1.00 . A A . 19 GLY HA3 1 1 12 7315 1 1 19 GLY N N 6.039 -0.027 5.988 1.00 . A A . 19 GLY N 1 1 12 7316 1 1 19 GLY O O 8.687 -1.782 4.308 1.00 . A A . 19 GLY O 1 1 12 7317 1 1 20 THR C C 5.987 -1.849 1.425 1.00 . A A . 20 THR C 1 1 12 7318 1 1 20 THR CA C 6.536 -2.481 2.699 1.00 . A A . 20 THR CA 1 1 12 7319 1 1 20 THR CB C 5.719 -3.724 3.060 1.00 . A A . 20 THR CB 1 1 12 7320 1 1 20 THR CG2 C 5.685 -4.764 1.960 1.00 . A A . 20 THR CG2 1 1 12 7321 1 1 20 THR H H 5.669 -1.069 4.011 1.00 . A A . 20 THR H 1 1 12 7322 1 1 20 THR HA H 7.563 -2.770 2.532 1.00 . A A . 20 THR HA 1 1 12 7323 1 1 20 THR HB H 4.700 -3.425 3.261 1.00 . A A . 20 THR HB 1 1 12 7324 1 1 20 THR HG1 H 6.350 -3.689 4.913 1.00 . A A . 20 THR HG1 1 1 12 7325 1 1 20 THR HG21 H 5.989 -4.313 1.028 1.00 . A A . 20 THR HG21 1 1 12 7326 1 1 20 THR HG22 H 6.358 -5.571 2.207 1.00 . A A . 20 THR HG22 1 1 12 7327 1 1 20 THR HG23 H 4.680 -5.151 1.862 1.00 . A A . 20 THR HG23 1 1 12 7328 1 1 20 THR N N 6.509 -1.524 3.798 1.00 . A A . 20 THR N 1 1 12 7329 1 1 20 THR O O 4.900 -1.272 1.429 1.00 . A A . 20 THR O 1 1 12 7330 1 1 20 THR OG1 O 6.237 -4.345 4.222 1.00 . A A . 20 THR OG1 1 1 12 7331 1 1 21 THR C C 4.902 -1.837 -1.291 1.00 . A A . 21 THR C 1 1 12 7332 1 1 21 THR CA C 6.322 -1.397 -0.943 1.00 . A A . 21 THR CA 1 1 12 7333 1 1 21 THR CB C 7.290 -1.811 -2.051 1.00 . A A . 21 THR CB 1 1 12 7334 1 1 21 THR CG2 C 7.211 -3.281 -2.390 1.00 . A A . 21 THR CG2 1 1 12 7335 1 1 21 THR H H 7.598 -2.433 0.393 1.00 . A A . 21 THR H 1 1 12 7336 1 1 21 THR HA H 6.339 -0.324 -0.850 1.00 . A A . 21 THR HA 1 1 12 7337 1 1 21 THR HB H 8.300 -1.599 -1.731 1.00 . A A . 21 THR HB 1 1 12 7338 1 1 21 THR HG1 H 6.945 -0.148 -3.026 1.00 . A A . 21 THR HG1 1 1 12 7339 1 1 21 THR HG21 H 6.588 -3.782 -1.664 1.00 . A A . 21 THR HG21 1 1 12 7340 1 1 21 THR HG22 H 6.785 -3.399 -3.375 1.00 . A A . 21 THR HG22 1 1 12 7341 1 1 21 THR HG23 H 8.203 -3.707 -2.372 1.00 . A A . 21 THR HG23 1 1 12 7342 1 1 21 THR N N 6.741 -1.961 0.336 1.00 . A A . 21 THR N 1 1 12 7343 1 1 21 THR O O 4.552 -3.008 -1.145 1.00 . A A . 21 THR O 1 1 12 7344 1 1 21 THR OG1 O 7.036 -1.080 -3.237 1.00 . A A . 21 THR OG1 1 1 12 7345 1 1 22 CYS C C 2.507 -1.202 -3.609 1.00 . A A . 22 CYS C 1 1 12 7346 1 1 22 CYS CA C 2.705 -1.186 -2.097 1.00 . A A . 22 CYS CA 1 1 12 7347 1 1 22 CYS CB C 1.764 -0.165 -1.459 1.00 . A A . 22 CYS CB 1 1 12 7348 1 1 22 CYS H H 4.418 0.026 -1.831 1.00 . A A . 22 CYS H 1 1 12 7349 1 1 22 CYS HA H 2.468 -2.163 -1.710 1.00 . A A . 22 CYS HA 1 1 12 7350 1 1 22 CYS HB2 H 0.745 -0.472 -1.634 1.00 . A A . 22 CYS HB2 1 1 12 7351 1 1 22 CYS HB3 H 1.948 -0.134 -0.395 1.00 . A A . 22 CYS HB3 1 1 12 7352 1 1 22 CYS N N 4.086 -0.891 -1.742 1.00 . A A . 22 CYS N 1 1 12 7353 1 1 22 CYS O O 1.806 -2.063 -4.140 1.00 . A A . 22 CYS O 1 1 12 7354 1 1 22 CYS SG S 1.946 1.526 -2.104 1.00 . A A . 22 CYS SG 1 1 12 7355 1 1 23 TRP C C 4.177 -0.823 -6.447 1.00 . A A . 23 TRP C 1 1 12 7356 1 1 23 TRP CA C 2.992 -0.168 -5.751 1.00 . A A . 23 TRP CA 1 1 12 7357 1 1 23 TRP CB C 2.853 1.293 -6.205 1.00 . A A . 23 TRP CB 1 1 12 7358 1 1 23 TRP CD1 C 0.798 0.582 -7.547 1.00 . A A . 23 TRP CD1 1 1 12 7359 1 1 23 TRP CD2 C 1.369 2.723 -7.841 1.00 . A A . 23 TRP CD2 1 1 12 7360 1 1 23 TRP CE2 C 0.231 2.450 -8.623 1.00 . A A . 23 TRP CE2 1 1 12 7361 1 1 23 TRP CE3 C 1.907 4.011 -7.868 1.00 . A A . 23 TRP CE3 1 1 12 7362 1 1 23 TRP CG C 1.714 1.510 -7.158 1.00 . A A . 23 TRP CG 1 1 12 7363 1 1 23 TRP CH2 C 0.173 4.668 -9.426 1.00 . A A . 23 TRP CH2 1 1 12 7364 1 1 23 TRP CZ2 C -0.376 3.416 -9.419 1.00 . A A . 23 TRP CZ2 1 1 12 7365 1 1 23 TRP CZ3 C 1.304 4.970 -8.660 1.00 . A A . 23 TRP CZ3 1 1 12 7366 1 1 23 TRP H H 3.664 0.417 -3.829 1.00 . A A . 23 TRP H 1 1 12 7367 1 1 23 TRP HA H 2.102 -0.705 -6.022 1.00 . A A . 23 TRP HA 1 1 12 7368 1 1 23 TRP HB2 H 2.687 1.917 -5.340 1.00 . A A . 23 TRP HB2 1 1 12 7369 1 1 23 TRP HB3 H 3.764 1.600 -6.696 1.00 . A A . 23 TRP HB3 1 1 12 7370 1 1 23 TRP HD1 H 0.794 -0.438 -7.202 1.00 . A A . 23 TRP HD1 1 1 12 7371 1 1 23 TRP HE1 H -0.848 0.669 -8.844 1.00 . A A . 23 TRP HE1 1 1 12 7372 1 1 23 TRP HE3 H 2.776 4.263 -7.287 1.00 . A A . 23 TRP HE3 1 1 12 7373 1 1 23 TRP HH2 H -0.265 5.447 -10.032 1.00 . A A . 23 TRP HH2 1 1 12 7374 1 1 23 TRP HZ2 H -1.250 3.197 -10.013 1.00 . A A . 23 TRP HZ2 1 1 12 7375 1 1 23 TRP HZ3 H 1.708 5.971 -8.693 1.00 . A A . 23 TRP HZ3 1 1 12 7376 1 1 23 TRP N N 3.120 -0.247 -4.301 1.00 . A A . 23 TRP N 1 1 12 7377 1 1 23 TRP NE1 N -0.097 1.137 -8.426 1.00 . A A . 23 TRP NE1 1 1 12 7378 1 1 23 TRP O O 4.009 -1.691 -7.304 1.00 . A A . 23 TRP O 1 1 12 7379 1 1 24 LYS C C 6.538 -0.932 -8.177 1.00 . A A . 24 LYS C 1 1 12 7380 1 1 24 LYS CA C 6.600 -0.933 -6.652 1.00 . A A . 24 LYS CA 1 1 12 7381 1 1 24 LYS CB C 6.847 -2.350 -6.140 1.00 . A A . 24 LYS CB 1 1 12 7382 1 1 24 LYS CD C 8.664 -4.001 -5.604 1.00 . A A . 24 LYS CD 1 1 12 7383 1 1 24 LYS CE C 7.772 -5.230 -5.648 1.00 . A A . 24 LYS CE 1 1 12 7384 1 1 24 LYS CG C 8.185 -2.929 -6.570 1.00 . A A . 24 LYS CG 1 1 12 7385 1 1 24 LYS H H 5.429 0.293 -5.385 1.00 . A A . 24 LYS H 1 1 12 7386 1 1 24 LYS HA H 7.416 -0.300 -6.338 1.00 . A A . 24 LYS HA 1 1 12 7387 1 1 24 LYS HB2 H 6.813 -2.339 -5.061 1.00 . A A . 24 LYS HB2 1 1 12 7388 1 1 24 LYS HB3 H 6.064 -2.994 -6.510 1.00 . A A . 24 LYS HB3 1 1 12 7389 1 1 24 LYS HD2 H 9.670 -4.289 -5.871 1.00 . A A . 24 LYS HD2 1 1 12 7390 1 1 24 LYS HD3 H 8.658 -3.597 -4.602 1.00 . A A . 24 LYS HD3 1 1 12 7391 1 1 24 LYS HE2 H 7.041 -5.157 -4.856 1.00 . A A . 24 LYS HE2 1 1 12 7392 1 1 24 LYS HE3 H 7.266 -5.258 -6.602 1.00 . A A . 24 LYS HE3 1 1 12 7393 1 1 24 LYS HG2 H 8.078 -3.366 -7.552 1.00 . A A . 24 LYS HG2 1 1 12 7394 1 1 24 LYS HG3 H 8.916 -2.135 -6.605 1.00 . A A . 24 LYS HG3 1 1 12 7395 1 1 24 LYS HZ1 H 9.361 -6.322 -4.845 1.00 . A A . 24 LYS HZ1 1 1 12 7396 1 1 24 LYS HZ2 H 7.946 -7.226 -5.058 1.00 . A A . 24 LYS HZ2 1 1 12 7397 1 1 24 LYS HZ3 H 8.901 -6.821 -6.394 1.00 . A A . 24 LYS HZ3 1 1 12 7398 1 1 24 LYS N N 5.372 -0.399 -6.072 1.00 . A A . 24 LYS N 1 1 12 7399 1 1 24 LYS NZ N 8.549 -6.488 -5.474 1.00 . A A . 24 LYS NZ 1 1 12 7400 1 1 24 LYS O O 7.180 -1.750 -8.835 1.00 . A A . 24 LYS O 1 1 12 7401 1 1 25 THR C C 6.951 0.474 -10.825 1.00 . A A . 25 THR C 1 1 12 7402 1 1 25 THR CA C 5.619 0.107 -10.177 1.00 . A A . 25 THR CA 1 1 12 7403 1 1 25 THR CB C 4.559 1.157 -10.517 1.00 . A A . 25 THR CB 1 1 12 7404 1 1 25 THR CG2 C 4.250 1.246 -11.995 1.00 . A A . 25 THR CG2 1 1 12 7405 1 1 25 THR H H 5.279 0.621 -8.154 1.00 . A A . 25 THR H 1 1 12 7406 1 1 25 THR HA H 5.298 -0.853 -10.555 1.00 . A A . 25 THR HA 1 1 12 7407 1 1 25 THR HB H 4.912 2.125 -10.195 1.00 . A A . 25 THR HB 1 1 12 7408 1 1 25 THR HG1 H 2.822 1.682 -9.782 1.00 . A A . 25 THR HG1 1 1 12 7409 1 1 25 THR HG21 H 3.967 0.271 -12.363 1.00 . A A . 25 THR HG21 1 1 12 7410 1 1 25 THR HG22 H 3.437 1.940 -12.151 1.00 . A A . 25 THR HG22 1 1 12 7411 1 1 25 THR HG23 H 5.125 1.591 -12.526 1.00 . A A . 25 THR HG23 1 1 12 7412 1 1 25 THR N N 5.763 -0.005 -8.731 1.00 . A A . 25 THR N 1 1 12 7413 1 1 25 THR O O 7.881 0.908 -10.145 1.00 . A A . 25 THR O 1 1 12 7414 1 1 25 THR OG1 O 3.345 0.880 -9.842 1.00 . A A . 25 THR OG1 1 1 12 7415 1 1 26 SER C C 8.322 2.100 -13.225 1.00 . A A . 26 SER C 1 1 12 7416 1 1 26 SER CA C 8.262 0.615 -12.873 1.00 . A A . 26 SER CA 1 1 12 7417 1 1 26 SER CB C 8.349 -0.230 -14.146 1.00 . A A . 26 SER CB 1 1 12 7418 1 1 26 SER H H 6.266 -0.051 -12.630 1.00 . A A . 26 SER H 1 1 12 7419 1 1 26 SER HA H 9.101 0.375 -12.236 1.00 . A A . 26 SER HA 1 1 12 7420 1 1 26 SER HB2 H 7.469 -0.061 -14.749 1.00 . A A . 26 SER HB2 1 1 12 7421 1 1 26 SER HB3 H 9.228 0.056 -14.706 1.00 . A A . 26 SER HB3 1 1 12 7422 1 1 26 SER HG H 7.745 -2.086 -14.311 1.00 . A A . 26 SER HG 1 1 12 7423 1 1 26 SER N N 7.039 0.299 -12.140 1.00 . A A . 26 SER N 1 1 12 7424 1 1 26 SER O O 8.538 2.467 -14.380 1.00 . A A . 26 SER O 1 1 12 7425 1 1 26 SER OG O 8.432 -1.610 -13.839 1.00 . A A . 26 SER OG 1 1 12 7426 1 1 27 VAL C C 7.718 5.102 -11.124 1.00 . A A . 27 VAL C 1 1 12 7427 1 1 27 VAL CA C 8.157 4.395 -12.400 1.00 . A A . 27 VAL CA 1 1 12 7428 1 1 27 VAL CB C 7.232 4.847 -13.551 1.00 . A A . 27 VAL CB 1 1 12 7429 1 1 27 VAL CG1 C 5.793 4.436 -13.273 1.00 . A A . 27 VAL CG1 1 1 12 7430 1 1 27 VAL CG2 C 7.330 6.352 -13.756 1.00 . A A . 27 VAL CG2 1 1 12 7431 1 1 27 VAL H H 7.965 2.588 -11.321 1.00 . A A . 27 VAL H 1 1 12 7432 1 1 27 VAL HA H 9.169 4.687 -12.637 1.00 . A A . 27 VAL HA 1 1 12 7433 1 1 27 VAL HB H 7.553 4.360 -14.459 1.00 . A A . 27 VAL HB 1 1 12 7434 1 1 27 VAL HG11 H 5.465 4.880 -12.344 1.00 . A A . 27 VAL HG11 1 1 12 7435 1 1 27 VAL HG12 H 5.159 4.776 -14.078 1.00 . A A . 27 VAL HG12 1 1 12 7436 1 1 27 VAL HG13 H 5.734 3.360 -13.198 1.00 . A A . 27 VAL HG13 1 1 12 7437 1 1 27 VAL HG21 H 8.362 6.628 -13.912 1.00 . A A . 27 VAL HG21 1 1 12 7438 1 1 27 VAL HG22 H 6.747 6.637 -14.619 1.00 . A A . 27 VAL HG22 1 1 12 7439 1 1 27 VAL HG23 H 6.950 6.860 -12.881 1.00 . A A . 27 VAL HG23 1 1 12 7440 1 1 27 VAL N N 8.129 2.947 -12.217 1.00 . A A . 27 VAL N 1 1 12 7441 1 1 27 VAL O O 8.223 6.172 -10.785 1.00 . A A . 27 VAL O 1 1 12 7442 1 1 28 SER C C 6.892 4.420 -7.975 1.00 . A A . 28 SER C 1 1 12 7443 1 1 28 SER CA C 6.236 5.058 -9.197 1.00 . A A . 28 SER CA 1 1 12 7444 1 1 28 SER CB C 4.716 4.872 -9.148 1.00 . A A . 28 SER CB 1 1 12 7445 1 1 28 SER H H 6.400 3.647 -10.759 1.00 . A A . 28 SER H 1 1 12 7446 1 1 28 SER HA H 6.458 6.112 -9.195 1.00 . A A . 28 SER HA 1 1 12 7447 1 1 28 SER HB2 H 4.451 4.279 -8.285 1.00 . A A . 28 SER HB2 1 1 12 7448 1 1 28 SER HB3 H 4.241 5.839 -9.079 1.00 . A A . 28 SER HB3 1 1 12 7449 1 1 28 SER HG H 3.514 4.719 -10.688 1.00 . A A . 28 SER HG 1 1 12 7450 1 1 28 SER N N 6.765 4.494 -10.429 1.00 . A A . 28 SER N 1 1 12 7451 1 1 28 SER O O 7.789 5.003 -7.366 1.00 . A A . 28 SER O 1 1 12 7452 1 1 28 SER OG O 4.241 4.217 -10.312 1.00 . A A . 28 SER OG 1 1 12 7453 1 1 29 SER C C 6.784 3.308 -5.191 1.00 . A A . 29 SER C 1 1 12 7454 1 1 29 SER CA C 6.975 2.503 -6.473 1.00 . A A . 29 SER CA 1 1 12 7455 1 1 29 SER CB C 8.458 2.192 -6.681 1.00 . A A . 29 SER CB 1 1 12 7456 1 1 29 SER H H 5.722 2.815 -8.151 1.00 . A A . 29 SER H 1 1 12 7457 1 1 29 SER HA H 6.429 1.576 -6.386 1.00 . A A . 29 SER HA 1 1 12 7458 1 1 29 SER HB2 H 9.050 3.027 -6.337 1.00 . A A . 29 SER HB2 1 1 12 7459 1 1 29 SER HB3 H 8.720 1.308 -6.117 1.00 . A A . 29 SER HB3 1 1 12 7460 1 1 29 SER HG H 9.606 1.547 -8.131 1.00 . A A . 29 SER HG 1 1 12 7461 1 1 29 SER N N 6.438 3.224 -7.624 1.00 . A A . 29 SER N 1 1 12 7462 1 1 29 SER O O 7.330 4.401 -5.044 1.00 . A A . 29 SER O 1 1 12 7463 1 1 29 SER OG O 8.745 1.963 -8.050 1.00 . A A . 29 SER OG 1 1 12 7464 1 1 30 HIS C C 5.733 2.448 -1.844 1.00 . A A . 30 HIS C 1 1 12 7465 1 1 30 HIS CA C 5.726 3.437 -3.002 1.00 . A A . 30 HIS CA 1 1 12 7466 1 1 30 HIS CB C 4.373 4.146 -3.070 1.00 . A A . 30 HIS CB 1 1 12 7467 1 1 30 HIS CD2 C 4.262 4.740 -5.583 1.00 . A A . 30 HIS CD2 1 1 12 7468 1 1 30 HIS CE1 C 3.945 6.897 -5.400 1.00 . A A . 30 HIS CE1 1 1 12 7469 1 1 30 HIS CG C 4.232 5.032 -4.265 1.00 . A A . 30 HIS CG 1 1 12 7470 1 1 30 HIS H H 5.585 1.894 -4.442 1.00 . A A . 30 HIS H 1 1 12 7471 1 1 30 HIS HA H 6.500 4.172 -2.842 1.00 . A A . 30 HIS HA 1 1 12 7472 1 1 30 HIS HB2 H 3.587 3.403 -3.116 1.00 . A A . 30 HIS HB2 1 1 12 7473 1 1 30 HIS HB3 H 4.243 4.751 -2.186 1.00 . A A . 30 HIS HB3 1 1 12 7474 1 1 30 HIS HD1 H 3.963 6.912 -3.353 1.00 . A A . 30 HIS HD1 1 1 12 7475 1 1 30 HIS HD2 H 4.410 3.760 -6.017 1.00 . A A . 30 HIS HD2 1 1 12 7476 1 1 30 HIS HE1 H 3.795 7.936 -5.648 1.00 . A A . 30 HIS HE1 1 1 12 7477 1 1 30 HIS HE2 H 3.853 5.981 -7.216 1.00 . A A . 30 HIS HE2 1 1 12 7478 1 1 30 HIS N N 5.997 2.765 -4.267 1.00 . A A . 30 HIS N 1 1 12 7479 1 1 30 HIS ND1 N 4.032 6.393 -4.181 1.00 . A A . 30 HIS ND1 1 1 12 7480 1 1 30 HIS NE2 N 4.080 5.915 -6.269 1.00 . A A . 30 HIS NE2 1 1 12 7481 1 1 30 HIS O O 5.470 1.262 -2.030 1.00 . A A . 30 HIS O 1 1 12 7482 1 1 31 TYR C C 4.811 2.301 1.379 1.00 . A A . 31 TYR C 1 1 12 7483 1 1 31 TYR CA C 6.069 2.106 0.541 1.00 . A A . 31 TYR CA 1 1 12 7484 1 1 31 TYR CB C 7.314 2.419 1.375 1.00 . A A . 31 TYR CB 1 1 12 7485 1 1 31 TYR CD1 C 8.674 0.857 -0.075 1.00 . A A . 31 TYR CD1 1 1 12 7486 1 1 31 TYR CD2 C 9.278 1.074 2.222 1.00 . A A . 31 TYR CD2 1 1 12 7487 1 1 31 TYR CE1 C 9.703 -0.045 -0.265 1.00 . A A . 31 TYR CE1 1 1 12 7488 1 1 31 TYR CE2 C 10.309 0.173 2.039 1.00 . A A . 31 TYR CE2 1 1 12 7489 1 1 31 TYR CG C 8.443 1.432 1.170 1.00 . A A . 31 TYR CG 1 1 12 7490 1 1 31 TYR CZ C 10.518 -0.384 0.795 1.00 . A A . 31 TYR CZ 1 1 12 7491 1 1 31 TYR H H 6.229 3.903 -0.566 1.00 . A A . 31 TYR H 1 1 12 7492 1 1 31 TYR HA H 6.112 1.079 0.220 1.00 . A A . 31 TYR HA 1 1 12 7493 1 1 31 TYR HB2 H 7.679 3.399 1.110 1.00 . A A . 31 TYR HB2 1 1 12 7494 1 1 31 TYR HB3 H 7.050 2.409 2.423 1.00 . A A . 31 TYR HB3 1 1 12 7495 1 1 31 TYR HD1 H 8.034 1.125 -0.903 1.00 . A A . 31 TYR HD1 1 1 12 7496 1 1 31 TYR HD2 H 9.112 1.511 3.195 1.00 . A A . 31 TYR HD2 1 1 12 7497 1 1 31 TYR HE1 H 9.866 -0.481 -1.240 1.00 . A A . 31 TYR HE1 1 1 12 7498 1 1 31 TYR HE2 H 10.947 -0.092 2.869 1.00 . A A . 31 TYR HE2 1 1 12 7499 1 1 31 TYR HH H 12.201 -0.901 0.022 1.00 . A A . 31 TYR HH 1 1 12 7500 1 1 31 TYR N N 6.032 2.947 -0.649 1.00 . A A . 31 TYR N 1 1 12 7501 1 1 31 TYR O O 4.471 3.424 1.754 1.00 . A A . 31 TYR O 1 1 12 7502 1 1 31 TYR OH O 11.544 -1.282 0.609 1.00 . A A . 31 TYR OH 1 1 12 7503 1 1 32 CYS C C 3.215 1.593 3.910 1.00 . A A . 32 CYS C 1 1 12 7504 1 1 32 CYS CA C 2.899 1.261 2.458 1.00 . A A . 32 CYS CA 1 1 12 7505 1 1 32 CYS CB C 2.147 -0.069 2.376 1.00 . A A . 32 CYS CB 1 1 12 7506 1 1 32 CYS H H 4.437 0.334 1.342 1.00 . A A . 32 CYS H 1 1 12 7507 1 1 32 CYS HA H 2.277 2.043 2.050 1.00 . A A . 32 CYS HA 1 1 12 7508 1 1 32 CYS HB2 H 2.454 -0.593 1.483 1.00 . A A . 32 CYS HB2 1 1 12 7509 1 1 32 CYS HB3 H 2.393 -0.667 3.241 1.00 . A A . 32 CYS HB3 1 1 12 7510 1 1 32 CYS N N 4.119 1.203 1.667 1.00 . A A . 32 CYS N 1 1 12 7511 1 1 32 CYS O O 4.234 1.161 4.449 1.00 . A A . 32 CYS O 1 1 12 7512 1 1 32 CYS SG S 0.334 0.105 2.318 1.00 . A A . 32 CYS SG 1 1 12 7513 1 1 33 THR C C 1.635 1.895 6.841 1.00 . A A . 33 THR C 1 1 12 7514 1 1 33 THR CA C 2.514 2.746 5.930 1.00 . A A . 33 THR CA 1 1 12 7515 1 1 33 THR CB C 2.181 4.228 6.119 1.00 . A A . 33 THR CB 1 1 12 7516 1 1 33 THR CG2 C 2.710 5.109 5.007 1.00 . A A . 33 THR CG2 1 1 12 7517 1 1 33 THR H H 1.540 2.669 4.055 1.00 . A A . 33 THR H 1 1 12 7518 1 1 33 THR HA H 3.548 2.580 6.190 1.00 . A A . 33 THR HA 1 1 12 7519 1 1 33 THR HB H 2.619 4.568 7.047 1.00 . A A . 33 THR HB 1 1 12 7520 1 1 33 THR HG1 H 0.386 4.230 5.338 1.00 . A A . 33 THR HG1 1 1 12 7521 1 1 33 THR HG21 H 3.765 4.923 4.871 1.00 . A A . 33 THR HG21 1 1 12 7522 1 1 33 THR HG22 H 2.184 4.886 4.090 1.00 . A A . 33 THR HG22 1 1 12 7523 1 1 33 THR HG23 H 2.558 6.146 5.267 1.00 . A A . 33 THR HG23 1 1 12 7524 1 1 33 THR N N 2.333 2.359 4.538 1.00 . A A . 33 THR N 1 1 12 7525 1 1 33 THR O O 1.376 2.261 7.988 1.00 . A A . 33 THR O 1 1 12 7526 1 1 33 THR OG1 O 0.780 4.422 6.192 1.00 . A A . 33 THR OG1 1 1 12 7527 1 1 34 GLY C C -0.785 0.603 7.827 1.00 . A A . 34 GLY C 1 1 12 7528 1 1 34 GLY CA C 0.328 -0.132 7.101 1.00 . A A . 34 GLY CA 1 1 12 7529 1 1 34 GLY H H 1.418 0.515 5.399 1.00 . A A . 34 GLY H 1 1 12 7530 1 1 34 GLY HA2 H 0.939 -0.645 7.829 1.00 . A A . 34 GLY HA2 1 1 12 7531 1 1 34 GLY HA3 H -0.112 -0.862 6.439 1.00 . A A . 34 GLY HA3 1 1 12 7532 1 1 34 GLY N N 1.176 0.756 6.322 1.00 . A A . 34 GLY N 1 1 12 7533 1 1 34 GLY O O -1.126 0.262 8.960 1.00 . A A . 34 GLY O 1 1 12 7534 1 1 35 ARG C C -3.673 2.381 6.891 1.00 . A A . 35 ARG C 1 1 12 7535 1 1 35 ARG CA C -2.428 2.401 7.772 1.00 . A A . 35 ARG CA 1 1 12 7536 1 1 35 ARG CB C -1.971 3.844 7.997 1.00 . A A . 35 ARG CB 1 1 12 7537 1 1 35 ARG CD C -3.780 5.293 8.967 1.00 . A A . 35 ARG CD 1 1 12 7538 1 1 35 ARG CG C -2.536 4.470 9.261 1.00 . A A . 35 ARG CG 1 1 12 7539 1 1 35 ARG CZ C -4.624 7.542 9.515 1.00 . A A . 35 ARG CZ 1 1 12 7540 1 1 35 ARG H H -1.034 1.843 6.277 1.00 . A A . 35 ARG H 1 1 12 7541 1 1 35 ARG HA H -2.671 1.958 8.723 1.00 . A A . 35 ARG HA 1 1 12 7542 1 1 35 ARG HB2 H -0.894 3.862 8.062 1.00 . A A . 35 ARG HB2 1 1 12 7543 1 1 35 ARG HB3 H -2.283 4.443 7.154 1.00 . A A . 35 ARG HB3 1 1 12 7544 1 1 35 ARG HD2 H -3.768 5.580 7.927 1.00 . A A . 35 ARG HD2 1 1 12 7545 1 1 35 ARG HD3 H -4.652 4.685 9.163 1.00 . A A . 35 ARG HD3 1 1 12 7546 1 1 35 ARG HE H -3.282 6.530 10.592 1.00 . A A . 35 ARG HE 1 1 12 7547 1 1 35 ARG HG2 H -2.792 3.685 9.957 1.00 . A A . 35 ARG HG2 1 1 12 7548 1 1 35 ARG HG3 H -1.786 5.111 9.699 1.00 . A A . 35 ARG HG3 1 1 12 7549 1 1 35 ARG HH11 H -5.406 6.741 7.831 1.00 . A A . 35 ARG HH11 1 1 12 7550 1 1 35 ARG HH12 H -5.983 8.322 8.238 1.00 . A A . 35 ARG HH12 1 1 12 7551 1 1 35 ARG HH21 H -4.041 8.609 11.129 1.00 . A A . 35 ARG HH21 1 1 12 7552 1 1 35 ARG HH22 H -5.208 9.383 10.110 1.00 . A A . 35 ARG HH22 1 1 12 7553 1 1 35 ARG N N -1.350 1.616 7.177 1.00 . A A . 35 ARG N 1 1 12 7554 1 1 35 ARG NE N -3.847 6.497 9.791 1.00 . A A . 35 ARG NE 1 1 12 7555 1 1 35 ARG NH1 N -5.402 7.534 8.440 1.00 . A A . 35 ARG NH1 1 1 12 7556 1 1 35 ARG NH2 N -4.624 8.598 10.318 1.00 . A A . 35 ARG NH2 1 1 12 7557 1 1 35 ARG O O -4.792 2.237 7.384 1.00 . A A . 35 ARG O 1 1 12 7558 1 1 36 SER C C -4.171 1.832 3.339 1.00 . A A . 36 SER C 1 1 12 7559 1 1 36 SER CA C -4.574 2.526 4.636 1.00 . A A . 36 SER CA 1 1 12 7560 1 1 36 SER CB C -5.023 3.959 4.343 1.00 . A A . 36 SER CB 1 1 12 7561 1 1 36 SER H H -2.553 2.638 5.260 1.00 . A A . 36 SER H 1 1 12 7562 1 1 36 SER HA H -5.395 1.984 5.080 1.00 . A A . 36 SER HA 1 1 12 7563 1 1 36 SER HB2 H -4.157 4.601 4.281 1.00 . A A . 36 SER HB2 1 1 12 7564 1 1 36 SER HB3 H -5.556 3.982 3.404 1.00 . A A . 36 SER HB3 1 1 12 7565 1 1 36 SER HG H -5.400 4.469 6.197 1.00 . A A . 36 SER HG 1 1 12 7566 1 1 36 SER N N -3.469 2.527 5.589 1.00 . A A . 36 SER N 1 1 12 7567 1 1 36 SER O O -3.004 1.495 3.141 1.00 . A A . 36 SER O 1 1 12 7568 1 1 36 SER OG O -5.877 4.445 5.364 1.00 . A A . 36 SER OG 1 1 12 7569 1 1 37 CYS C C -4.412 1.968 0.124 1.00 . A A . 37 CYS C 1 1 12 7570 1 1 37 CYS CA C -4.883 0.967 1.180 1.00 . A A . 37 CYS CA 1 1 12 7571 1 1 37 CYS CB C -6.136 0.241 0.688 1.00 . A A . 37 CYS CB 1 1 12 7572 1 1 37 CYS H H -6.055 1.912 2.669 1.00 . A A . 37 CYS H 1 1 12 7573 1 1 37 CYS HA H -4.102 0.240 1.339 1.00 . A A . 37 CYS HA 1 1 12 7574 1 1 37 CYS HB2 H -6.477 -0.435 1.458 1.00 . A A . 37 CYS HB2 1 1 12 7575 1 1 37 CYS HB3 H -6.909 0.968 0.486 1.00 . A A . 37 CYS HB3 1 1 12 7576 1 1 37 CYS N N -5.143 1.621 2.457 1.00 . A A . 37 CYS N 1 1 12 7577 1 1 37 CYS O O -4.139 1.594 -1.016 1.00 . A A . 37 CYS O 1 1 12 7578 1 1 37 CYS SG S -5.877 -0.734 -0.829 1.00 . A A . 37 CYS SG 1 1 12 7579 1 1 38 GLU C C -2.350 4.390 -0.421 1.00 . A A . 38 GLU C 1 1 12 7580 1 1 38 GLU CA C -3.872 4.280 -0.415 1.00 . A A . 38 GLU CA 1 1 12 7581 1 1 38 GLU CB C -4.491 5.626 -0.032 1.00 . A A . 38 GLU CB 1 1 12 7582 1 1 38 GLU CD C -6.603 6.600 0.952 1.00 . A A . 38 GLU CD 1 1 12 7583 1 1 38 GLU CG C -6.011 5.622 -0.043 1.00 . A A . 38 GLU CG 1 1 12 7584 1 1 38 GLU H H -4.542 3.482 1.428 1.00 . A A . 38 GLU H 1 1 12 7585 1 1 38 GLU HA H -4.206 4.009 -1.405 1.00 . A A . 38 GLU HA 1 1 12 7586 1 1 38 GLU HB2 H -4.160 5.891 0.962 1.00 . A A . 38 GLU HB2 1 1 12 7587 1 1 38 GLU HB3 H -4.149 6.377 -0.728 1.00 . A A . 38 GLU HB3 1 1 12 7588 1 1 38 GLU HG2 H -6.351 5.888 -1.033 1.00 . A A . 38 GLU HG2 1 1 12 7589 1 1 38 GLU HG3 H -6.357 4.628 0.200 1.00 . A A . 38 GLU HG3 1 1 12 7590 1 1 38 GLU N N -4.314 3.239 0.507 1.00 . A A . 38 GLU N 1 1 12 7591 1 1 38 GLU O O -1.706 4.272 0.621 1.00 . A A . 38 GLU O 1 1 12 7592 1 1 38 GLU OE1 O -7.026 6.157 2.040 1.00 . A A . 38 GLU OE1 1 1 12 7593 1 1 38 GLU OE2 O -6.645 7.810 0.642 1.00 . A A . 38 GLU OE2 1 1 12 7594 1 1 39 CYS C C 0.067 6.192 -2.000 1.00 . A A . 39 CYS C 1 1 12 7595 1 1 39 CYS CA C -0.334 4.740 -1.741 1.00 . A A . 39 CYS CA 1 1 12 7596 1 1 39 CYS CB C 0.170 3.851 -2.881 1.00 . A A . 39 CYS CB 1 1 12 7597 1 1 39 CYS H H -2.347 4.699 -2.397 1.00 . A A . 39 CYS H 1 1 12 7598 1 1 39 CYS HA H 0.115 4.412 -0.816 1.00 . A A . 39 CYS HA 1 1 12 7599 1 1 39 CYS HB2 H -0.404 4.058 -3.771 1.00 . A A . 39 CYS HB2 1 1 12 7600 1 1 39 CYS HB3 H 1.210 4.074 -3.069 1.00 . A A . 39 CYS HB3 1 1 12 7601 1 1 39 CYS N N -1.781 4.615 -1.602 1.00 . A A . 39 CYS N 1 1 12 7602 1 1 39 CYS O O -0.565 6.883 -2.798 1.00 . A A . 39 CYS O 1 1 12 7603 1 1 39 CYS SG S 0.041 2.068 -2.544 1.00 . A A . 39 CYS SG 1 1 12 7604 1 1 40 PRO C C 1.887 8.386 -2.961 1.00 . A A . 40 PRO C 1 1 12 7605 1 1 40 PRO CA C 1.607 8.052 -1.501 1.00 . A A . 40 PRO CA 1 1 12 7606 1 1 40 PRO CB C 2.905 8.087 -0.688 1.00 . A A . 40 PRO CB 1 1 12 7607 1 1 40 PRO CD C 1.948 5.923 -0.360 1.00 . A A . 40 PRO CD 1 1 12 7608 1 1 40 PRO CG C 2.758 6.995 0.314 1.00 . A A . 40 PRO CG 1 1 12 7609 1 1 40 PRO HA H 0.907 8.768 -1.097 1.00 . A A . 40 PRO HA 1 1 12 7610 1 1 40 PRO HB2 H 3.747 7.913 -1.342 1.00 . A A . 40 PRO HB2 1 1 12 7611 1 1 40 PRO HB3 H 3.007 9.049 -0.209 1.00 . A A . 40 PRO HB3 1 1 12 7612 1 1 40 PRO HD2 H 2.595 5.221 -0.863 1.00 . A A . 40 PRO HD2 1 1 12 7613 1 1 40 PRO HD3 H 1.323 5.416 0.360 1.00 . A A . 40 PRO HD3 1 1 12 7614 1 1 40 PRO HG2 H 3.731 6.613 0.587 1.00 . A A . 40 PRO HG2 1 1 12 7615 1 1 40 PRO HG3 H 2.239 7.364 1.186 1.00 . A A . 40 PRO HG3 1 1 12 7616 1 1 40 PRO N N 1.130 6.675 -1.330 1.00 . A A . 40 PRO N 1 1 12 7617 1 1 40 PRO O O 1.737 7.539 -3.842 1.00 . A A . 40 PRO O 1 1 12 7618 1 1 41 SER C C 4.100 10.236 -4.765 1.00 . A A . 41 SER C 1 1 12 7619 1 1 41 SER CA C 2.596 10.070 -4.567 1.00 . A A . 41 SER CA 1 1 12 7620 1 1 41 SER CB C 1.881 11.390 -4.865 1.00 . A A . 41 SER CB 1 1 12 7621 1 1 41 SER H H 2.395 10.255 -2.467 1.00 . A A . 41 SER H 1 1 12 7622 1 1 41 SER HA H 2.238 9.315 -5.251 1.00 . A A . 41 SER HA 1 1 12 7623 1 1 41 SER HB2 H 2.442 11.942 -5.604 1.00 . A A . 41 SER HB2 1 1 12 7624 1 1 41 SER HB3 H 0.892 11.183 -5.244 1.00 . A A . 41 SER HB3 1 1 12 7625 1 1 41 SER HG H 0.999 12.755 -3.772 1.00 . A A . 41 SER HG 1 1 12 7626 1 1 41 SER N N 2.295 9.625 -3.211 1.00 . A A . 41 SER N 1 1 12 7627 1 1 41 SER O O 4.543 11.054 -5.572 1.00 . A A . 41 SER O 1 1 12 7628 1 1 41 SER OG O 1.766 12.183 -3.696 1.00 . A A . 41 SER OG 1 1 12 7629 1 1 42 TYR C C 6.964 8.260 -3.510 1.00 . A A . 42 TYR C 1 1 12 7630 1 1 42 TYR CA C 6.332 9.510 -4.122 1.00 . A A . 42 TYR CA 1 1 12 7631 1 1 42 TYR CB C 6.864 10.765 -3.424 1.00 . A A . 42 TYR CB 1 1 12 7632 1 1 42 TYR CD1 C 5.725 11.432 -1.270 1.00 . A A . 42 TYR CD1 1 1 12 7633 1 1 42 TYR CD2 C 7.617 9.988 -1.143 1.00 . A A . 42 TYR CD2 1 1 12 7634 1 1 42 TYR CE1 C 5.603 11.399 0.106 1.00 . A A . 42 TYR CE1 1 1 12 7635 1 1 42 TYR CE2 C 7.502 9.950 0.233 1.00 . A A . 42 TYR CE2 1 1 12 7636 1 1 42 TYR CG C 6.732 10.728 -1.917 1.00 . A A . 42 TYR CG 1 1 12 7637 1 1 42 TYR CZ C 6.493 10.657 0.853 1.00 . A A . 42 TYR CZ 1 1 12 7638 1 1 42 TYR H H 4.466 8.820 -3.402 1.00 . A A . 42 TYR H 1 1 12 7639 1 1 42 TYR HA H 6.591 9.554 -5.169 1.00 . A A . 42 TYR HA 1 1 12 7640 1 1 42 TYR HB2 H 7.910 10.883 -3.661 1.00 . A A . 42 TYR HB2 1 1 12 7641 1 1 42 TYR HB3 H 6.319 11.625 -3.784 1.00 . A A . 42 TYR HB3 1 1 12 7642 1 1 42 TYR HD1 H 5.029 12.012 -1.858 1.00 . A A . 42 TYR HD1 1 1 12 7643 1 1 42 TYR HD2 H 8.407 9.435 -1.631 1.00 . A A . 42 TYR HD2 1 1 12 7644 1 1 42 TYR HE1 H 4.813 11.953 0.591 1.00 . A A . 42 TYR HE1 1 1 12 7645 1 1 42 TYR HE2 H 8.200 9.369 0.817 1.00 . A A . 42 TYR HE2 1 1 12 7646 1 1 42 TYR HH H 6.372 11.519 2.568 1.00 . A A . 42 TYR HH 1 1 12 7647 1 1 42 TYR N N 4.879 9.453 -4.026 1.00 . A A . 42 TYR N 1 1 12 7648 1 1 42 TYR O O 6.467 7.728 -2.517 1.00 . A A . 42 TYR O 1 1 12 7649 1 1 42 TYR OH O 6.375 10.623 2.224 1.00 . A A . 42 TYR OH 1 1 12 7650 1 1 43 PRO C C 9.552 6.854 -2.326 1.00 . A A . 43 PRO C 1 1 12 7651 1 1 43 PRO CA C 8.764 6.580 -3.602 1.00 . A A . 43 PRO CA 1 1 12 7652 1 1 43 PRO CB C 9.710 6.227 -4.750 1.00 . A A . 43 PRO CB 1 1 12 7653 1 1 43 PRO CD C 8.733 8.343 -5.287 1.00 . A A . 43 PRO CD 1 1 12 7654 1 1 43 PRO CG C 9.993 7.530 -5.412 1.00 . A A . 43 PRO CG 1 1 12 7655 1 1 43 PRO HA H 8.077 5.764 -3.433 1.00 . A A . 43 PRO HA 1 1 12 7656 1 1 43 PRO HB2 H 10.610 5.778 -4.354 1.00 . A A . 43 PRO HB2 1 1 12 7657 1 1 43 PRO HB3 H 9.223 5.539 -5.424 1.00 . A A . 43 PRO HB3 1 1 12 7658 1 1 43 PRO HD2 H 8.970 9.385 -5.133 1.00 . A A . 43 PRO HD2 1 1 12 7659 1 1 43 PRO HD3 H 8.116 8.221 -6.165 1.00 . A A . 43 PRO HD3 1 1 12 7660 1 1 43 PRO HG2 H 10.811 8.027 -4.910 1.00 . A A . 43 PRO HG2 1 1 12 7661 1 1 43 PRO HG3 H 10.233 7.369 -6.453 1.00 . A A . 43 PRO HG3 1 1 12 7662 1 1 43 PRO N N 8.071 7.772 -4.097 1.00 . A A . 43 PRO N 1 1 12 7663 1 1 43 PRO O O 10.034 7.965 -2.108 1.00 . A A . 43 PRO O 1 1 12 7664 1 1 44 GLY C C 9.517 6.430 0.905 1.00 . A A . 44 GLY C 1 1 12 7665 1 1 44 GLY CA C 10.407 5.984 -0.239 1.00 . A A . 44 GLY CA 1 1 12 7666 1 1 44 GLY H H 9.271 4.970 -1.710 1.00 . A A . 44 GLY H 1 1 12 7667 1 1 44 GLY HA2 H 11.189 6.716 -0.379 1.00 . A A . 44 GLY HA2 1 1 12 7668 1 1 44 GLY HA3 H 10.857 5.036 0.019 1.00 . A A . 44 GLY HA3 1 1 12 7669 1 1 44 GLY N N 9.677 5.833 -1.484 1.00 . A A . 44 GLY N 1 1 12 7670 1 1 44 GLY O O 8.543 7.153 0.696 1.00 . A A . 44 GLY O 1 1 12 7671 1 1 45 ASN C C 9.987 6.855 4.415 1.00 . A A . 45 ASN C 1 1 12 7672 1 1 45 ASN CA C 9.077 6.358 3.297 1.00 . A A . 45 ASN CA 1 1 12 7673 1 1 45 ASN CB C 8.263 5.157 3.783 1.00 . A A . 45 ASN CB 1 1 12 7674 1 1 45 ASN CG C 9.139 3.978 4.158 1.00 . A A . 45 ASN CG 1 1 12 7675 1 1 45 ASN H H 10.641 5.425 2.218 1.00 . A A . 45 ASN H 1 1 12 7676 1 1 45 ASN HA H 8.400 7.152 3.020 1.00 . A A . 45 ASN HA 1 1 12 7677 1 1 45 ASN HB2 H 7.690 5.446 4.651 1.00 . A A . 45 ASN HB2 1 1 12 7678 1 1 45 ASN HB3 H 7.588 4.847 2.999 1.00 . A A . 45 ASN HB3 1 1 12 7679 1 1 45 ASN HD21 H 7.896 3.492 5.632 1.00 . A A . 45 ASN HD21 1 1 12 7680 1 1 45 ASN HD22 H 9.277 2.470 5.446 1.00 . A A . 45 ASN HD22 1 1 12 7681 1 1 45 ASN N N 9.853 5.998 2.116 1.00 . A A . 45 ASN N 1 1 12 7682 1 1 45 ASN ND2 N 8.729 3.239 5.182 1.00 . A A . 45 ASN ND2 1 1 12 7683 1 1 45 ASN O O 10.868 6.132 4.881 1.00 . A A . 45 ASN O 1 1 12 7684 1 1 45 ASN OD1 O 10.172 3.734 3.535 1.00 . A A . 45 ASN OD1 1 1 12 7685 1 1 46 GLY C C 10.832 10.149 5.701 1.00 . A A . 46 GLY C 1 1 12 7686 1 1 46 GLY CA C 10.578 8.668 5.901 1.00 . A A . 46 GLY CA 1 1 12 7687 1 1 46 GLY H H 9.054 8.625 4.433 1.00 . A A . 46 GLY H 1 1 12 7688 1 1 46 GLY HA2 H 11.527 8.153 5.934 1.00 . A A . 46 GLY HA2 1 1 12 7689 1 1 46 GLY HA3 H 10.070 8.525 6.844 1.00 . A A . 46 GLY HA3 1 1 12 7690 1 1 46 GLY N N 9.769 8.095 4.841 1.00 . A A . 46 GLY N 1 1 12 7691 1 1 46 GLY O O 10.746 10.905 6.692 1.00 . A A . 46 GLY O 1 1 12 7692 1 1 46 GLY OXT O 11.118 10.553 4.555 1.00 . A A . 46 GLY OXT 1 1 13 7693 1 1 1 ALA C C -14.869 -4.979 9.093 1.00 . A A . 1 ALA C 1 1 13 7694 1 1 1 ALA CA C -13.646 -5.336 9.930 1.00 . A A . 1 ALA CA 1 1 13 7695 1 1 1 ALA CB C -13.550 -6.844 10.107 1.00 . A A . 1 ALA CB 1 1 13 7696 1 1 1 ALA H1 H -14.669 -4.724 11.607 1.00 . A A . 1 ALA H1 1 1 13 7697 1 1 1 ALA H2 H -13.034 -5.165 11.886 1.00 . A A . 1 ALA H2 1 1 13 7698 1 1 1 ALA H3 H -13.404 -3.675 11.119 1.00 . A A . 1 ALA H3 1 1 13 7699 1 1 1 ALA HA H -12.759 -5.003 9.411 1.00 . A A . 1 ALA HA 1 1 13 7700 1 1 1 ALA HB1 H -14.360 -7.185 10.735 1.00 . A A . 1 ALA HB1 1 1 13 7701 1 1 1 ALA HB2 H -13.617 -7.325 9.142 1.00 . A A . 1 ALA HB2 1 1 13 7702 1 1 1 ALA HB3 H -12.607 -7.093 10.569 1.00 . A A . 1 ALA HB3 1 1 13 7703 1 1 1 ALA N N -13.692 -4.665 11.255 1.00 . A A . 1 ALA N 1 1 13 7704 1 1 1 ALA O O -15.813 -5.762 8.989 1.00 . A A . 1 ALA O 1 1 13 7705 1 1 2 MET C C -15.942 -4.024 6.309 1.00 . A A . 2 MET C 1 1 13 7706 1 1 2 MET CA C -15.953 -3.330 7.667 1.00 . A A . 2 MET CA 1 1 13 7707 1 1 2 MET CB C -15.880 -1.814 7.479 1.00 . A A . 2 MET CB 1 1 13 7708 1 1 2 MET CE C -18.933 0.625 7.444 1.00 . A A . 2 MET CE 1 1 13 7709 1 1 2 MET CG C -17.037 -1.244 6.675 1.00 . A A . 2 MET CG 1 1 13 7710 1 1 2 MET H H -14.065 -3.211 8.617 1.00 . A A . 2 MET H 1 1 13 7711 1 1 2 MET HA H -16.873 -3.577 8.176 1.00 . A A . 2 MET HA 1 1 13 7712 1 1 2 MET HB2 H -15.878 -1.342 8.450 1.00 . A A . 2 MET HB2 1 1 13 7713 1 1 2 MET HB3 H -14.960 -1.571 6.968 1.00 . A A . 2 MET HB3 1 1 13 7714 1 1 2 MET HE1 H -18.706 0.932 6.434 1.00 . A A . 2 MET HE1 1 1 13 7715 1 1 2 MET HE2 H -19.982 0.790 7.643 1.00 . A A . 2 MET HE2 1 1 13 7716 1 1 2 MET HE3 H -18.340 1.201 8.138 1.00 . A A . 2 MET HE3 1 1 13 7717 1 1 2 MET HG2 H -16.765 -0.259 6.326 1.00 . A A . 2 MET HG2 1 1 13 7718 1 1 2 MET HG3 H -17.219 -1.888 5.826 1.00 . A A . 2 MET HG3 1 1 13 7719 1 1 2 MET N N -14.846 -3.791 8.497 1.00 . A A . 2 MET N 1 1 13 7720 1 1 2 MET O O -16.829 -4.819 6.000 1.00 . A A . 2 MET O 1 1 13 7721 1 1 2 MET SD S -18.556 -1.115 7.638 1.00 . A A . 2 MET SD 1 1 13 7722 1 1 3 ASP C C -13.384 -4.821 3.943 1.00 . A A . 3 ASP C 1 1 13 7723 1 1 3 ASP CA C -14.803 -4.313 4.177 1.00 . A A . 3 ASP CA 1 1 13 7724 1 1 3 ASP CB C -15.178 -3.294 3.100 1.00 . A A . 3 ASP CB 1 1 13 7725 1 1 3 ASP CG C -16.660 -3.306 2.783 1.00 . A A . 3 ASP CG 1 1 13 7726 1 1 3 ASP H H -14.254 -3.078 5.806 1.00 . A A . 3 ASP H 1 1 13 7727 1 1 3 ASP HA H -15.485 -5.149 4.122 1.00 . A A . 3 ASP HA 1 1 13 7728 1 1 3 ASP HB2 H -14.910 -2.305 3.441 1.00 . A A . 3 ASP HB2 1 1 13 7729 1 1 3 ASP HB3 H -14.632 -3.519 2.195 1.00 . A A . 3 ASP HB3 1 1 13 7730 1 1 3 ASP N N -14.931 -3.719 5.503 1.00 . A A . 3 ASP N 1 1 13 7731 1 1 3 ASP O O -12.476 -4.537 4.724 1.00 . A A . 3 ASP O 1 1 13 7732 1 1 3 ASP OD1 O -17.067 -4.064 1.877 1.00 . A A . 3 ASP OD1 1 1 13 7733 1 1 3 ASP OD2 O -17.414 -2.559 3.440 1.00 . A A . 3 ASP OD2 1 1 13 7734 1 1 4 CYS C C -10.941 -5.017 2.071 1.00 . A A . 4 CYS C 1 1 13 7735 1 1 4 CYS CA C -11.892 -6.119 2.525 1.00 . A A . 4 CYS CA 1 1 13 7736 1 1 4 CYS CB C -12.025 -7.178 1.428 1.00 . A A . 4 CYS CB 1 1 13 7737 1 1 4 CYS H H -13.964 -5.764 2.278 1.00 . A A . 4 CYS H 1 1 13 7738 1 1 4 CYS HA H -11.488 -6.583 3.412 1.00 . A A . 4 CYS HA 1 1 13 7739 1 1 4 CYS HB2 H -12.973 -7.050 0.928 1.00 . A A . 4 CYS HB2 1 1 13 7740 1 1 4 CYS HB3 H -11.226 -7.048 0.712 1.00 . A A . 4 CYS HB3 1 1 13 7741 1 1 4 CYS N N -13.201 -5.572 2.862 1.00 . A A . 4 CYS N 1 1 13 7742 1 1 4 CYS O O -9.729 -5.110 2.268 1.00 . A A . 4 CYS O 1 1 13 7743 1 1 4 CYS SG S -11.950 -8.893 2.038 1.00 . A A . 4 CYS SG 1 1 13 7744 1 1 5 THR C C -9.730 -3.317 -0.112 1.00 . A A . 5 THR C 1 1 13 7745 1 1 5 THR CA C -10.692 -2.856 0.979 1.00 . A A . 5 THR CA 1 1 13 7746 1 1 5 THR CB C -9.912 -2.222 2.134 1.00 . A A . 5 THR CB 1 1 13 7747 1 1 5 THR CG2 C -9.968 -0.709 2.135 1.00 . A A . 5 THR CG2 1 1 13 7748 1 1 5 THR H H -12.467 -3.956 1.332 1.00 . A A . 5 THR H 1 1 13 7749 1 1 5 THR HA H -11.363 -2.119 0.562 1.00 . A A . 5 THR HA 1 1 13 7750 1 1 5 THR HB H -8.875 -2.514 2.059 1.00 . A A . 5 THR HB 1 1 13 7751 1 1 5 THR HG1 H -9.892 -3.419 3.685 1.00 . A A . 5 THR HG1 1 1 13 7752 1 1 5 THR HG21 H -10.342 -0.362 1.183 1.00 . A A . 5 THR HG21 1 1 13 7753 1 1 5 THR HG22 H -10.625 -0.374 2.924 1.00 . A A . 5 THR HG22 1 1 13 7754 1 1 5 THR HG23 H -8.977 -0.312 2.298 1.00 . A A . 5 THR HG23 1 1 13 7755 1 1 5 THR N N -11.496 -3.973 1.461 1.00 . A A . 5 THR N 1 1 13 7756 1 1 5 THR O O -8.914 -4.212 0.107 1.00 . A A . 5 THR O 1 1 13 7757 1 1 5 THR OG1 O -10.410 -2.669 3.383 1.00 . A A . 5 THR OG1 1 1 13 7758 1 1 6 THR C C -8.236 -1.827 -2.942 1.00 . A A . 6 THR C 1 1 13 7759 1 1 6 THR CA C -8.970 -3.055 -2.409 1.00 . A A . 6 THR CA 1 1 13 7760 1 1 6 THR CB C -9.790 -3.702 -3.527 1.00 . A A . 6 THR CB 1 1 13 7761 1 1 6 THR CG2 C -9.715 -5.215 -3.524 1.00 . A A . 6 THR CG2 1 1 13 7762 1 1 6 THR H H -10.503 -1.998 -1.401 1.00 . A A . 6 THR H 1 1 13 7763 1 1 6 THR HA H -8.241 -3.768 -2.054 1.00 . A A . 6 THR HA 1 1 13 7764 1 1 6 THR HB H -9.420 -3.355 -4.481 1.00 . A A . 6 THR HB 1 1 13 7765 1 1 6 THR HG1 H -11.245 -2.391 -3.539 1.00 . A A . 6 THR HG1 1 1 13 7766 1 1 6 THR HG21 H -8.839 -5.531 -2.977 1.00 . A A . 6 THR HG21 1 1 13 7767 1 1 6 THR HG22 H -10.599 -5.618 -3.051 1.00 . A A . 6 THR HG22 1 1 13 7768 1 1 6 THR HG23 H -9.655 -5.574 -4.540 1.00 . A A . 6 THR HG23 1 1 13 7769 1 1 6 THR N N -9.832 -2.703 -1.286 1.00 . A A . 6 THR N 1 1 13 7770 1 1 6 THR O O -8.584 -0.693 -2.613 1.00 . A A . 6 THR O 1 1 13 7771 1 1 6 THR OG1 O -11.156 -3.340 -3.421 1.00 . A A . 6 THR OG1 1 1 13 7772 1 1 7 GLY C C -4.986 -1.324 -4.514 1.00 . A A . 7 GLY C 1 1 13 7773 1 1 7 GLY CA C -6.451 -0.969 -4.330 1.00 . A A . 7 GLY CA 1 1 13 7774 1 1 7 GLY H H -6.988 -2.988 -3.990 1.00 . A A . 7 GLY H 1 1 13 7775 1 1 7 GLY HA2 H -6.523 -0.115 -3.672 1.00 . A A . 7 GLY HA2 1 1 13 7776 1 1 7 GLY HA3 H -6.870 -0.707 -5.290 1.00 . A A . 7 GLY HA3 1 1 13 7777 1 1 7 GLY N N -7.219 -2.063 -3.765 1.00 . A A . 7 GLY N 1 1 13 7778 1 1 7 GLY O O -4.630 -2.502 -4.515 1.00 . A A . 7 GLY O 1 1 13 7779 1 1 8 PRO C C -2.019 -1.142 -3.601 1.00 . A A . 8 PRO C 1 1 13 7780 1 1 8 PRO CA C -2.669 -0.554 -4.851 1.00 . A A . 8 PRO CA 1 1 13 7781 1 1 8 PRO CB C -2.111 0.842 -5.148 1.00 . A A . 8 PRO CB 1 1 13 7782 1 1 8 PRO CD C -4.439 1.116 -4.678 1.00 . A A . 8 PRO CD 1 1 13 7783 1 1 8 PRO CG C -3.098 1.783 -4.549 1.00 . A A . 8 PRO CG 1 1 13 7784 1 1 8 PRO HA H -2.480 -1.206 -5.692 1.00 . A A . 8 PRO HA 1 1 13 7785 1 1 8 PRO HB2 H -1.137 0.947 -4.693 1.00 . A A . 8 PRO HB2 1 1 13 7786 1 1 8 PRO HB3 H -2.032 0.982 -6.217 1.00 . A A . 8 PRO HB3 1 1 13 7787 1 1 8 PRO HD2 H -5.070 1.370 -3.839 1.00 . A A . 8 PRO HD2 1 1 13 7788 1 1 8 PRO HD3 H -4.912 1.396 -5.608 1.00 . A A . 8 PRO HD3 1 1 13 7789 1 1 8 PRO HG2 H -2.861 1.951 -3.509 1.00 . A A . 8 PRO HG2 1 1 13 7790 1 1 8 PRO HG3 H -3.091 2.717 -5.092 1.00 . A A . 8 PRO HG3 1 1 13 7791 1 1 8 PRO N N -4.106 -0.320 -4.670 1.00 . A A . 8 PRO N 1 1 13 7792 1 1 8 PRO O O -0.985 -1.805 -3.681 1.00 . A A . 8 PRO O 1 1 13 7793 1 1 9 CYS C C -3.071 -2.464 -0.603 1.00 . A A . 9 CYS C 1 1 13 7794 1 1 9 CYS CA C -2.125 -1.414 -1.180 1.00 . A A . 9 CYS CA 1 1 13 7795 1 1 9 CYS CB C -1.937 -0.270 -0.180 1.00 . A A . 9 CYS CB 1 1 13 7796 1 1 9 CYS H H -3.461 -0.371 -2.449 1.00 . A A . 9 CYS H 1 1 13 7797 1 1 9 CYS HA H -1.169 -1.877 -1.371 1.00 . A A . 9 CYS HA 1 1 13 7798 1 1 9 CYS HB2 H -1.352 0.509 -0.644 1.00 . A A . 9 CYS HB2 1 1 13 7799 1 1 9 CYS HB3 H -2.906 0.126 0.087 1.00 . A A . 9 CYS HB3 1 1 13 7800 1 1 9 CYS N N -2.637 -0.901 -2.447 1.00 . A A . 9 CYS N 1 1 13 7801 1 1 9 CYS O O -3.140 -2.656 0.611 1.00 . A A . 9 CYS O 1 1 13 7802 1 1 9 CYS SG S -1.091 -0.754 1.361 1.00 . A A . 9 CYS SG 1 1 13 7803 1 1 10 CYS C C -4.910 -5.217 -2.168 1.00 . A A . 10 CYS C 1 1 13 7804 1 1 10 CYS CA C -4.744 -4.169 -1.073 1.00 . A A . 10 CYS CA 1 1 13 7805 1 1 10 CYS CB C -6.098 -3.541 -0.746 1.00 . A A . 10 CYS CB 1 1 13 7806 1 1 10 CYS H H -3.699 -2.941 -2.440 1.00 . A A . 10 CYS H 1 1 13 7807 1 1 10 CYS HA H -4.353 -4.646 -0.186 1.00 . A A . 10 CYS HA 1 1 13 7808 1 1 10 CYS HB2 H -6.485 -3.060 -1.631 1.00 . A A . 10 CYS HB2 1 1 13 7809 1 1 10 CYS HB3 H -6.781 -4.319 -0.436 1.00 . A A . 10 CYS HB3 1 1 13 7810 1 1 10 CYS N N -3.799 -3.140 -1.486 1.00 . A A . 10 CYS N 1 1 13 7811 1 1 10 CYS O O -5.567 -4.971 -3.180 1.00 . A A . 10 CYS O 1 1 13 7812 1 1 10 CYS SG S -6.040 -2.292 0.579 1.00 . A A . 10 CYS SG 1 1 13 7813 1 1 11 ARG C C -4.533 -8.822 -2.255 1.00 . A A . 11 ARG C 1 1 13 7814 1 1 11 ARG CA C -4.393 -7.465 -2.940 1.00 . A A . 11 ARG CA 1 1 13 7815 1 1 11 ARG CB C -3.155 -7.462 -3.838 1.00 . A A . 11 ARG CB 1 1 13 7816 1 1 11 ARG CD C -0.786 -8.289 -3.982 1.00 . A A . 11 ARG CD 1 1 13 7817 1 1 11 ARG CG C -1.855 -7.688 -3.084 1.00 . A A . 11 ARG CG 1 1 13 7818 1 1 11 ARG CZ C 1.499 -9.190 -3.791 1.00 . A A . 11 ARG CZ 1 1 13 7819 1 1 11 ARG H H -3.798 -6.521 -1.137 1.00 . A A . 11 ARG H 1 1 13 7820 1 1 11 ARG HA H -5.267 -7.292 -3.549 1.00 . A A . 11 ARG HA 1 1 13 7821 1 1 11 ARG HB2 H -3.258 -8.244 -4.576 1.00 . A A . 11 ARG HB2 1 1 13 7822 1 1 11 ARG HB3 H -3.093 -6.510 -4.343 1.00 . A A . 11 ARG HB3 1 1 13 7823 1 1 11 ARG HD2 H -1.180 -9.185 -4.438 1.00 . A A . 11 ARG HD2 1 1 13 7824 1 1 11 ARG HD3 H -0.538 -7.574 -4.753 1.00 . A A . 11 ARG HD3 1 1 13 7825 1 1 11 ARG HE H 0.441 -8.425 -2.282 1.00 . A A . 11 ARG HE 1 1 13 7826 1 1 11 ARG HG2 H -1.501 -6.741 -2.705 1.00 . A A . 11 ARG HG2 1 1 13 7827 1 1 11 ARG HG3 H -2.041 -8.361 -2.260 1.00 . A A . 11 ARG HG3 1 1 13 7828 1 1 11 ARG HH11 H 0.718 -9.274 -5.655 1.00 . A A . 11 ARG HH11 1 1 13 7829 1 1 11 ARG HH12 H 2.324 -9.901 -5.494 1.00 . A A . 11 ARG HH12 1 1 13 7830 1 1 11 ARG HH21 H 2.554 -9.249 -2.068 1.00 . A A . 11 ARG HH21 1 1 13 7831 1 1 11 ARG HH22 H 3.366 -9.887 -3.458 1.00 . A A . 11 ARG HH22 1 1 13 7832 1 1 11 ARG N N -4.310 -6.384 -1.963 1.00 . A A . 11 ARG N 1 1 13 7833 1 1 11 ARG NE N 0.426 -8.627 -3.241 1.00 . A A . 11 ARG NE 1 1 13 7834 1 1 11 ARG NH1 N 1.515 -9.478 -5.087 1.00 . A A . 11 ARG NH1 1 1 13 7835 1 1 11 ARG NH2 N 2.560 -9.464 -3.045 1.00 . A A . 11 ARG NH2 1 1 13 7836 1 1 11 ARG O O -4.241 -9.860 -2.849 1.00 . A A . 11 ARG O 1 1 13 7837 1 1 12 GLN C C -6.306 -9.924 0.752 1.00 . A A . 12 GLN C 1 1 13 7838 1 1 12 GLN CA C -5.155 -10.042 -0.242 1.00 . A A . 12 GLN CA 1 1 13 7839 1 1 12 GLN CB C -3.871 -10.375 0.508 1.00 . A A . 12 GLN CB 1 1 13 7840 1 1 12 GLN CD C -2.012 -12.082 0.402 1.00 . A A . 12 GLN CD 1 1 13 7841 1 1 12 GLN CG C -2.812 -11.041 -0.356 1.00 . A A . 12 GLN CG 1 1 13 7842 1 1 12 GLN H H -5.194 -7.953 -0.580 1.00 . A A . 12 GLN H 1 1 13 7843 1 1 12 GLN HA H -5.372 -10.837 -0.939 1.00 . A A . 12 GLN HA 1 1 13 7844 1 1 12 GLN HB2 H -3.460 -9.459 0.905 1.00 . A A . 12 GLN HB2 1 1 13 7845 1 1 12 GLN HB3 H -4.109 -11.037 1.326 1.00 . A A . 12 GLN HB3 1 1 13 7846 1 1 12 GLN HE21 H -0.464 -11.817 -0.817 1.00 . A A . 12 GLN HE21 1 1 13 7847 1 1 12 GLN HE22 H -0.242 -12.988 0.433 1.00 . A A . 12 GLN HE22 1 1 13 7848 1 1 12 GLN HG2 H -3.298 -11.522 -1.192 1.00 . A A . 12 GLN HG2 1 1 13 7849 1 1 12 GLN HG3 H -2.135 -10.283 -0.721 1.00 . A A . 12 GLN HG3 1 1 13 7850 1 1 12 GLN N N -4.980 -8.809 -1.003 1.00 . A A . 12 GLN N 1 1 13 7851 1 1 12 GLN NE2 N -0.782 -12.320 -0.038 1.00 . A A . 12 GLN NE2 1 1 13 7852 1 1 12 GLN O O -6.427 -10.731 1.674 1.00 . A A . 12 GLN O 1 1 13 7853 1 1 12 GLN OE1 O -2.494 -12.666 1.373 1.00 . A A . 12 GLN OE1 1 1 13 7854 1 1 13 CYS C C -7.807 -8.239 2.834 1.00 . A A . 13 CYS C 1 1 13 7855 1 1 13 CYS CA C -8.280 -8.680 1.451 1.00 . A A . 13 CYS CA 1 1 13 7856 1 1 13 CYS CB C -9.141 -9.943 1.566 1.00 . A A . 13 CYS CB 1 1 13 7857 1 1 13 CYS H H -6.990 -8.300 -0.179 1.00 . A A . 13 CYS H 1 1 13 7858 1 1 13 CYS HA H -8.876 -7.889 1.021 1.00 . A A . 13 CYS HA 1 1 13 7859 1 1 13 CYS HB2 H -8.601 -10.778 1.146 1.00 . A A . 13 CYS HB2 1 1 13 7860 1 1 13 CYS HB3 H -9.344 -10.140 2.609 1.00 . A A . 13 CYS HB3 1 1 13 7861 1 1 13 CYS N N -7.144 -8.912 0.566 1.00 . A A . 13 CYS N 1 1 13 7862 1 1 13 CYS O O -8.545 -8.339 3.814 1.00 . A A . 13 CYS O 1 1 13 7863 1 1 13 CYS SG S -10.742 -9.830 0.702 1.00 . A A . 13 CYS SG 1 1 13 7864 1 1 14 LYS C C -4.940 -6.226 3.899 1.00 . A A . 14 LYS C 1 1 13 7865 1 1 14 LYS CA C -6.003 -7.284 4.161 1.00 . A A . 14 LYS CA 1 1 13 7866 1 1 14 LYS CB C -5.397 -8.457 4.935 1.00 . A A . 14 LYS CB 1 1 13 7867 1 1 14 LYS CD C -4.919 -7.088 6.988 1.00 . A A . 14 LYS CD 1 1 13 7868 1 1 14 LYS CE C -5.941 -5.989 7.229 1.00 . A A . 14 LYS CE 1 1 13 7869 1 1 14 LYS CG C -5.572 -8.347 6.441 1.00 . A A . 14 LYS CG 1 1 13 7870 1 1 14 LYS H H -6.031 -7.686 2.090 1.00 . A A . 14 LYS H 1 1 13 7871 1 1 14 LYS HA H -6.797 -6.846 4.747 1.00 . A A . 14 LYS HA 1 1 13 7872 1 1 14 LYS HB2 H -5.866 -9.372 4.605 1.00 . A A . 14 LYS HB2 1 1 13 7873 1 1 14 LYS HB3 H -4.339 -8.507 4.720 1.00 . A A . 14 LYS HB3 1 1 13 7874 1 1 14 LYS HD2 H -4.432 -7.324 7.922 1.00 . A A . 14 LYS HD2 1 1 13 7875 1 1 14 LYS HD3 H -4.185 -6.736 6.276 1.00 . A A . 14 LYS HD3 1 1 13 7876 1 1 14 LYS HE2 H -5.943 -5.324 6.378 1.00 . A A . 14 LYS HE2 1 1 13 7877 1 1 14 LYS HE3 H -6.917 -6.440 7.336 1.00 . A A . 14 LYS HE3 1 1 13 7878 1 1 14 LYS HG2 H -6.627 -8.321 6.670 1.00 . A A . 14 LYS HG2 1 1 13 7879 1 1 14 LYS HG3 H -5.121 -9.209 6.909 1.00 . A A . 14 LYS HG3 1 1 13 7880 1 1 14 LYS HZ1 H -4.618 -5.264 8.674 1.00 . A A . 14 LYS HZ1 1 1 13 7881 1 1 14 LYS HZ2 H -5.885 -4.204 8.312 1.00 . A A . 14 LYS HZ2 1 1 13 7882 1 1 14 LYS HZ3 H -6.173 -5.574 9.263 1.00 . A A . 14 LYS HZ3 1 1 13 7883 1 1 14 LYS N N -6.573 -7.746 2.905 1.00 . A A . 14 LYS N 1 1 13 7884 1 1 14 LYS NZ N -5.633 -5.203 8.455 1.00 . A A . 14 LYS NZ 1 1 13 7885 1 1 14 LYS O O -3.828 -6.545 3.476 1.00 . A A . 14 LYS O 1 1 13 7886 1 1 15 LEU C C -2.947 -4.214 4.290 1.00 . A A . 15 LEU C 1 1 13 7887 1 1 15 LEU CA C -4.383 -3.842 3.931 1.00 . A A . 15 LEU CA 1 1 13 7888 1 1 15 LEU CB C -4.833 -2.637 4.762 1.00 . A A . 15 LEU CB 1 1 13 7889 1 1 15 LEU CD1 C -6.191 -0.534 4.858 1.00 . A A . 15 LEU CD1 1 1 13 7890 1 1 15 LEU CD2 C -4.296 -0.725 3.235 1.00 . A A . 15 LEU CD2 1 1 13 7891 1 1 15 LEU CG C -5.408 -1.474 3.955 1.00 . A A . 15 LEU CG 1 1 13 7892 1 1 15 LEU H H -6.200 -4.785 4.472 1.00 . A A . 15 LEU H 1 1 13 7893 1 1 15 LEU HA H -4.422 -3.580 2.884 1.00 . A A . 15 LEU HA 1 1 13 7894 1 1 15 LEU HB2 H -5.587 -2.971 5.460 1.00 . A A . 15 LEU HB2 1 1 13 7895 1 1 15 LEU HB3 H -3.985 -2.272 5.322 1.00 . A A . 15 LEU HB3 1 1 13 7896 1 1 15 LEU HD11 H -5.554 -0.193 5.661 1.00 . A A . 15 LEU HD11 1 1 13 7897 1 1 15 LEU HD12 H -6.532 0.315 4.285 1.00 . A A . 15 LEU HD12 1 1 13 7898 1 1 15 LEU HD13 H -7.041 -1.056 5.271 1.00 . A A . 15 LEU HD13 1 1 13 7899 1 1 15 LEU HD21 H -3.414 -1.347 3.190 1.00 . A A . 15 LEU HD21 1 1 13 7900 1 1 15 LEU HD22 H -4.616 -0.482 2.233 1.00 . A A . 15 LEU HD22 1 1 13 7901 1 1 15 LEU HD23 H -4.069 0.184 3.771 1.00 . A A . 15 LEU HD23 1 1 13 7902 1 1 15 LEU HG H -6.088 -1.862 3.210 1.00 . A A . 15 LEU HG 1 1 13 7903 1 1 15 LEU N N -5.295 -4.966 4.144 1.00 . A A . 15 LEU N 1 1 13 7904 1 1 15 LEU O O -2.651 -4.556 5.435 1.00 . A A . 15 LEU O 1 1 13 7905 1 1 16 LYS C C -0.108 -3.793 4.757 1.00 . A A . 16 LYS C 1 1 13 7906 1 1 16 LYS CA C -0.656 -4.484 3.509 1.00 . A A . 16 LYS CA 1 1 13 7907 1 1 16 LYS CB C 0.172 -4.085 2.285 1.00 . A A . 16 LYS CB 1 1 13 7908 1 1 16 LYS CD C 0.608 -4.393 -0.170 1.00 . A A . 16 LYS CD 1 1 13 7909 1 1 16 LYS CE C 0.709 -5.573 -1.123 1.00 . A A . 16 LYS CE 1 1 13 7910 1 1 16 LYS CG C -0.334 -4.689 0.985 1.00 . A A . 16 LYS CG 1 1 13 7911 1 1 16 LYS H H -2.359 -3.873 2.409 1.00 . A A . 16 LYS H 1 1 13 7912 1 1 16 LYS HA H -0.591 -5.554 3.643 1.00 . A A . 16 LYS HA 1 1 13 7913 1 1 16 LYS HB2 H 0.154 -3.010 2.188 1.00 . A A . 16 LYS HB2 1 1 13 7914 1 1 16 LYS HB3 H 1.191 -4.408 2.434 1.00 . A A . 16 LYS HB3 1 1 13 7915 1 1 16 LYS HD2 H 0.239 -3.536 -0.713 1.00 . A A . 16 LYS HD2 1 1 13 7916 1 1 16 LYS HD3 H 1.590 -4.176 0.225 1.00 . A A . 16 LYS HD3 1 1 13 7917 1 1 16 LYS HE2 H -0.178 -6.180 -1.019 1.00 . A A . 16 LYS HE2 1 1 13 7918 1 1 16 LYS HE3 H 0.771 -5.198 -2.134 1.00 . A A . 16 LYS HE3 1 1 13 7919 1 1 16 LYS HG2 H -0.416 -5.759 1.104 1.00 . A A . 16 LYS HG2 1 1 13 7920 1 1 16 LYS HG3 H -1.306 -4.274 0.761 1.00 . A A . 16 LYS HG3 1 1 13 7921 1 1 16 LYS HZ1 H 2.014 -6.551 0.183 1.00 . A A . 16 LYS HZ1 1 1 13 7922 1 1 16 LYS HZ2 H 1.806 -7.342 -1.298 1.00 . A A . 16 LYS HZ2 1 1 13 7923 1 1 16 LYS HZ3 H 2.762 -5.950 -1.211 1.00 . A A . 16 LYS HZ3 1 1 13 7924 1 1 16 LYS N N -2.061 -4.149 3.301 1.00 . A A . 16 LYS N 1 1 13 7925 1 1 16 LYS NZ N 1.906 -6.413 -0.843 1.00 . A A . 16 LYS NZ 1 1 13 7926 1 1 16 LYS O O -0.562 -2.710 5.125 1.00 . A A . 16 LYS O 1 1 13 7927 1 1 17 PRO C C 2.198 -2.529 6.380 1.00 . A A . 17 PRO C 1 1 13 7928 1 1 17 PRO CA C 1.481 -3.849 6.642 1.00 . A A . 17 PRO CA 1 1 13 7929 1 1 17 PRO CB C 2.485 -4.921 7.080 1.00 . A A . 17 PRO CB 1 1 13 7930 1 1 17 PRO CD C 1.477 -5.706 5.062 1.00 . A A . 17 PRO CD 1 1 13 7931 1 1 17 PRO CG C 2.752 -5.726 5.854 1.00 . A A . 17 PRO CG 1 1 13 7932 1 1 17 PRO HA H 0.743 -3.707 7.418 1.00 . A A . 17 PRO HA 1 1 13 7933 1 1 17 PRO HB2 H 3.385 -4.446 7.443 1.00 . A A . 17 PRO HB2 1 1 13 7934 1 1 17 PRO HB3 H 2.051 -5.527 7.861 1.00 . A A . 17 PRO HB3 1 1 13 7935 1 1 17 PRO HD2 H 1.688 -5.749 4.004 1.00 . A A . 17 PRO HD2 1 1 13 7936 1 1 17 PRO HD3 H 0.836 -6.525 5.355 1.00 . A A . 17 PRO HD3 1 1 13 7937 1 1 17 PRO HG2 H 3.554 -5.276 5.287 1.00 . A A . 17 PRO HG2 1 1 13 7938 1 1 17 PRO HG3 H 3.008 -6.739 6.128 1.00 . A A . 17 PRO HG3 1 1 13 7939 1 1 17 PRO N N 0.877 -4.412 5.428 1.00 . A A . 17 PRO N 1 1 13 7940 1 1 17 PRO O O 2.959 -2.405 5.421 1.00 . A A . 17 PRO O 1 1 13 7941 1 1 18 ALA C C 4.081 -0.362 6.871 1.00 . A A . 18 ALA C 1 1 13 7942 1 1 18 ALA CA C 2.581 -0.234 7.111 1.00 . A A . 18 ALA CA 1 1 13 7943 1 1 18 ALA CB C 2.315 0.604 8.353 1.00 . A A . 18 ALA CB 1 1 13 7944 1 1 18 ALA H H 1.340 -1.706 7.989 1.00 . A A . 18 ALA H 1 1 13 7945 1 1 18 ALA HA H 2.132 0.267 6.265 1.00 . A A . 18 ALA HA 1 1 13 7946 1 1 18 ALA HB1 H 2.850 0.184 9.192 1.00 . A A . 18 ALA HB1 1 1 13 7947 1 1 18 ALA HB2 H 2.649 1.617 8.183 1.00 . A A . 18 ALA HB2 1 1 13 7948 1 1 18 ALA HB3 H 1.256 0.606 8.566 1.00 . A A . 18 ALA HB3 1 1 13 7949 1 1 18 ALA N N 1.954 -1.545 7.244 1.00 . A A . 18 ALA N 1 1 13 7950 1 1 18 ALA O O 4.663 -1.427 7.074 1.00 . A A . 18 ALA O 1 1 13 7951 1 1 19 GLY C C 6.505 -0.308 5.105 1.00 . A A . 19 GLY C 1 1 13 7952 1 1 19 GLY CA C 6.128 0.709 6.166 1.00 . A A . 19 GLY CA 1 1 13 7953 1 1 19 GLY H H 4.188 1.548 6.283 1.00 . A A . 19 GLY H 1 1 13 7954 1 1 19 GLY HA2 H 6.650 0.469 7.080 1.00 . A A . 19 GLY HA2 1 1 13 7955 1 1 19 GLY HA3 H 6.434 1.690 5.834 1.00 . A A . 19 GLY HA3 1 1 13 7956 1 1 19 GLY N N 4.702 0.728 6.432 1.00 . A A . 19 GLY N 1 1 13 7957 1 1 19 GLY O O 7.668 -0.695 4.993 1.00 . A A . 19 GLY O 1 1 13 7958 1 1 20 THR C C 5.269 -1.179 1.924 1.00 . A A . 20 THR C 1 1 13 7959 1 1 20 THR CA C 5.753 -1.717 3.265 1.00 . A A . 20 THR CA 1 1 13 7960 1 1 20 THR CB C 5.038 -3.031 3.587 1.00 . A A . 20 THR CB 1 1 13 7961 1 1 20 THR CG2 C 5.407 -4.160 2.650 1.00 . A A . 20 THR CG2 1 1 13 7962 1 1 20 THR H H 4.613 -0.395 4.458 1.00 . A A . 20 THR H 1 1 13 7963 1 1 20 THR HA H 6.815 -1.898 3.207 1.00 . A A . 20 THR HA 1 1 13 7964 1 1 20 THR HB H 3.972 -2.875 3.513 1.00 . A A . 20 THR HB 1 1 13 7965 1 1 20 THR HG1 H 6.280 -3.601 4.990 1.00 . A A . 20 THR HG1 1 1 13 7966 1 1 20 THR HG21 H 5.745 -3.751 1.709 1.00 . A A . 20 THR HG21 1 1 13 7967 1 1 20 THR HG22 H 6.197 -4.750 3.090 1.00 . A A . 20 THR HG22 1 1 13 7968 1 1 20 THR HG23 H 4.542 -4.784 2.481 1.00 . A A . 20 THR HG23 1 1 13 7969 1 1 20 THR N N 5.519 -0.741 4.323 1.00 . A A . 20 THR N 1 1 13 7970 1 1 20 THR O O 4.142 -0.699 1.808 1.00 . A A . 20 THR O 1 1 13 7971 1 1 20 THR OG1 O 5.335 -3.453 4.906 1.00 . A A . 20 THR OG1 1 1 13 7972 1 1 21 THR C C 4.519 -1.458 -0.936 1.00 . A A . 21 THR C 1 1 13 7973 1 1 21 THR CA C 5.782 -0.779 -0.419 1.00 . A A . 21 THR CA 1 1 13 7974 1 1 21 THR CB C 6.940 -1.013 -1.388 1.00 . A A . 21 THR CB 1 1 13 7975 1 1 21 THR CG2 C 7.187 -2.474 -1.677 1.00 . A A . 21 THR CG2 1 1 13 7976 1 1 21 THR H H 7.012 -1.653 1.066 1.00 . A A . 21 THR H 1 1 13 7977 1 1 21 THR HA H 5.597 0.279 -0.347 1.00 . A A . 21 THR HA 1 1 13 7978 1 1 21 THR HB H 7.844 -0.603 -0.959 1.00 . A A . 21 THR HB 1 1 13 7979 1 1 21 THR HG1 H 7.453 0.187 -2.848 1.00 . A A . 21 THR HG1 1 1 13 7980 1 1 21 THR HG21 H 6.624 -3.076 -0.978 1.00 . A A . 21 THR HG21 1 1 13 7981 1 1 21 THR HG22 H 6.869 -2.699 -2.684 1.00 . A A . 21 THR HG22 1 1 13 7982 1 1 21 THR HG23 H 8.239 -2.690 -1.573 1.00 . A A . 21 THR HG23 1 1 13 7983 1 1 21 THR N N 6.127 -1.261 0.913 1.00 . A A . 21 THR N 1 1 13 7984 1 1 21 THR O O 4.421 -2.685 -0.951 1.00 . A A . 21 THR O 1 1 13 7985 1 1 21 THR OG1 O 6.700 -0.365 -2.624 1.00 . A A . 21 THR OG1 1 1 13 7986 1 1 22 CYS C C 2.241 -1.031 -3.394 1.00 . A A . 22 CYS C 1 1 13 7987 1 1 22 CYS CA C 2.296 -1.164 -1.878 1.00 . A A . 22 CYS CA 1 1 13 7988 1 1 22 CYS CB C 1.117 -0.420 -1.250 1.00 . A A . 22 CYS CB 1 1 13 7989 1 1 22 CYS H H 3.698 0.319 -1.320 1.00 . A A . 22 CYS H 1 1 13 7990 1 1 22 CYS HA H 2.232 -2.210 -1.617 1.00 . A A . 22 CYS HA 1 1 13 7991 1 1 22 CYS HB2 H 0.224 -0.636 -1.816 1.00 . A A . 22 CYS HB2 1 1 13 7992 1 1 22 CYS HB3 H 0.987 -0.764 -0.236 1.00 . A A . 22 CYS HB3 1 1 13 7993 1 1 22 CYS N N 3.557 -0.649 -1.358 1.00 . A A . 22 CYS N 1 1 13 7994 1 1 22 CYS O O 1.578 -1.815 -4.073 1.00 . A A . 22 CYS O 1 1 13 7995 1 1 22 CYS SG S 1.313 1.392 -1.203 1.00 . A A . 22 CYS SG 1 1 13 7996 1 1 23 TRP C C 4.189 -0.434 -5.992 1.00 . A A . 23 TRP C 1 1 13 7997 1 1 23 TRP CA C 2.966 0.208 -5.352 1.00 . A A . 23 TRP CA 1 1 13 7998 1 1 23 TRP CB C 2.952 1.711 -5.636 1.00 . A A . 23 TRP CB 1 1 13 7999 1 1 23 TRP CD1 C 1.543 1.225 -7.715 1.00 . A A . 23 TRP CD1 1 1 13 8000 1 1 23 TRP CD2 C 1.764 3.400 -7.246 1.00 . A A . 23 TRP CD2 1 1 13 8001 1 1 23 TRP CE2 C 0.977 3.269 -8.404 1.00 . A A . 23 TRP CE2 1 1 13 8002 1 1 23 TRP CE3 C 2.038 4.679 -6.760 1.00 . A A . 23 TRP CE3 1 1 13 8003 1 1 23 TRP CG C 2.117 2.080 -6.823 1.00 . A A . 23 TRP CG 1 1 13 8004 1 1 23 TRP CH2 C 0.744 5.609 -8.584 1.00 . A A . 23 TRP CH2 1 1 13 8005 1 1 23 TRP CZ2 C 0.461 4.368 -9.082 1.00 . A A . 23 TRP CZ2 1 1 13 8006 1 1 23 TRP CZ3 C 1.526 5.771 -7.433 1.00 . A A . 23 TRP CZ3 1 1 13 8007 1 1 23 TRP H H 3.445 0.562 -3.324 1.00 . A A . 23 TRP H 1 1 13 8008 1 1 23 TRP HA H 2.082 -0.235 -5.776 1.00 . A A . 23 TRP HA 1 1 13 8009 1 1 23 TRP HB2 H 2.556 2.230 -4.776 1.00 . A A . 23 TRP HB2 1 1 13 8010 1 1 23 TRP HB3 H 3.962 2.046 -5.820 1.00 . A A . 23 TRP HB3 1 1 13 8011 1 1 23 TRP HD1 H 1.629 0.151 -7.666 1.00 . A A . 23 TRP HD1 1 1 13 8012 1 1 23 TRP HE1 H 0.363 1.543 -9.422 1.00 . A A . 23 TRP HE1 1 1 13 8013 1 1 23 TRP HE3 H 2.636 4.821 -5.874 1.00 . A A . 23 TRP HE3 1 1 13 8014 1 1 23 TRP HH2 H 0.367 6.490 -9.080 1.00 . A A . 23 TRP HH2 1 1 13 8015 1 1 23 TRP HZ2 H -0.145 4.259 -9.968 1.00 . A A . 23 TRP HZ2 1 1 13 8016 1 1 23 TRP HZ3 H 1.728 6.768 -7.073 1.00 . A A . 23 TRP HZ3 1 1 13 8017 1 1 23 TRP N N 2.939 -0.031 -3.917 1.00 . A A . 23 TRP N 1 1 13 8018 1 1 23 TRP NE1 N 0.857 1.932 -8.672 1.00 . A A . 23 TRP NE1 1 1 13 8019 1 1 23 TRP O O 4.076 -1.403 -6.744 1.00 . A A . 23 TRP O 1 1 13 8020 1 1 24 LYS C C 6.604 -0.345 -7.759 1.00 . A A . 24 LYS C 1 1 13 8021 1 1 24 LYS CA C 6.608 -0.398 -6.234 1.00 . A A . 24 LYS CA 1 1 13 8022 1 1 24 LYS CB C 6.842 -1.835 -5.763 1.00 . A A . 24 LYS CB 1 1 13 8023 1 1 24 LYS CD C 8.325 -3.809 -6.225 1.00 . A A . 24 LYS CD 1 1 13 8024 1 1 24 LYS CE C 8.095 -4.121 -7.695 1.00 . A A . 24 LYS CE 1 1 13 8025 1 1 24 LYS CG C 8.271 -2.314 -5.957 1.00 . A A . 24 LYS CG 1 1 13 8026 1 1 24 LYS H H 5.376 0.883 -5.087 1.00 . A A . 24 LYS H 1 1 13 8027 1 1 24 LYS HA H 7.409 0.226 -5.866 1.00 . A A . 24 LYS HA 1 1 13 8028 1 1 24 LYS HB2 H 6.602 -1.900 -4.712 1.00 . A A . 24 LYS HB2 1 1 13 8029 1 1 24 LYS HB3 H 6.186 -2.493 -6.314 1.00 . A A . 24 LYS HB3 1 1 13 8030 1 1 24 LYS HD2 H 9.297 -4.182 -5.936 1.00 . A A . 24 LYS HD2 1 1 13 8031 1 1 24 LYS HD3 H 7.562 -4.298 -5.638 1.00 . A A . 24 LYS HD3 1 1 13 8032 1 1 24 LYS HE2 H 7.666 -5.108 -7.777 1.00 . A A . 24 LYS HE2 1 1 13 8033 1 1 24 LYS HE3 H 7.406 -3.394 -8.100 1.00 . A A . 24 LYS HE3 1 1 13 8034 1 1 24 LYS HG2 H 8.704 -1.792 -6.797 1.00 . A A . 24 LYS HG2 1 1 13 8035 1 1 24 LYS HG3 H 8.838 -2.096 -5.064 1.00 . A A . 24 LYS HG3 1 1 13 8036 1 1 24 LYS HZ1 H 10.081 -4.678 -8.027 1.00 . A A . 24 LYS HZ1 1 1 13 8037 1 1 24 LYS HZ2 H 9.195 -4.418 -9.445 1.00 . A A . 24 LYS HZ2 1 1 13 8038 1 1 24 LYS HZ3 H 9.720 -3.102 -8.522 1.00 . A A . 24 LYS HZ3 1 1 13 8039 1 1 24 LYS N N 5.357 0.114 -5.690 1.00 . A A . 24 LYS N 1 1 13 8040 1 1 24 LYS NZ N 9.361 -4.077 -8.477 1.00 . A A . 24 LYS NZ 1 1 13 8041 1 1 24 LYS O O 7.271 -1.143 -8.418 1.00 . A A . 24 LYS O 1 1 13 8042 1 1 25 THR C C 7.142 1.037 -10.357 1.00 . A A . 25 THR C 1 1 13 8043 1 1 25 THR CA C 5.766 0.754 -9.763 1.00 . A A . 25 THR CA 1 1 13 8044 1 1 25 THR CB C 4.796 1.881 -10.126 1.00 . A A . 25 THR CB 1 1 13 8045 1 1 25 THR CG2 C 4.394 1.881 -11.584 1.00 . A A . 25 THR CG2 1 1 13 8046 1 1 25 THR H H 5.343 1.209 -7.739 1.00 . A A . 25 THR H 1 1 13 8047 1 1 25 THR HA H 5.395 -0.174 -10.173 1.00 . A A . 25 THR HA 1 1 13 8048 1 1 25 THR HB H 5.265 2.831 -9.913 1.00 . A A . 25 THR HB 1 1 13 8049 1 1 25 THR HG1 H 3.116 1.012 -9.625 1.00 . A A . 25 THR HG1 1 1 13 8050 1 1 25 THR HG21 H 5.251 1.639 -12.194 1.00 . A A . 25 THR HG21 1 1 13 8051 1 1 25 THR HG22 H 3.619 1.146 -11.744 1.00 . A A . 25 THR HG22 1 1 13 8052 1 1 25 THR HG23 H 4.024 2.859 -11.855 1.00 . A A . 25 THR HG23 1 1 13 8053 1 1 25 THR N N 5.851 0.600 -8.315 1.00 . A A . 25 THR N 1 1 13 8054 1 1 25 THR O O 7.889 1.872 -9.847 1.00 . A A . 25 THR O 1 1 13 8055 1 1 25 THR OG1 O 3.612 1.789 -9.357 1.00 . A A . 25 THR OG1 1 1 13 8056 1 1 26 SER C C 9.044 1.984 -12.374 1.00 . A A . 26 SER C 1 1 13 8057 1 1 26 SER CA C 8.760 0.509 -12.102 1.00 . A A . 26 SER CA 1 1 13 8058 1 1 26 SER CB C 8.789 -0.277 -13.414 1.00 . A A . 26 SER CB 1 1 13 8059 1 1 26 SER H H 6.833 -0.317 -11.796 1.00 . A A . 26 SER H 1 1 13 8060 1 1 26 SER HA H 9.525 0.122 -11.446 1.00 . A A . 26 SER HA 1 1 13 8061 1 1 26 SER HB2 H 9.813 -0.408 -13.730 1.00 . A A . 26 SER HB2 1 1 13 8062 1 1 26 SER HB3 H 8.333 -1.244 -13.262 1.00 . A A . 26 SER HB3 1 1 13 8063 1 1 26 SER HG H 7.671 -0.232 -15.022 1.00 . A A . 26 SER HG 1 1 13 8064 1 1 26 SER N N 7.471 0.335 -11.437 1.00 . A A . 26 SER N 1 1 13 8065 1 1 26 SER O O 10.201 2.397 -12.458 1.00 . A A . 26 SER O 1 1 13 8066 1 1 26 SER OG O 8.082 0.406 -14.434 1.00 . A A . 26 SER OG 1 1 13 8067 1 1 27 VAL C C 8.004 5.014 -11.486 1.00 . A A . 27 VAL C 1 1 13 8068 1 1 27 VAL CA C 8.119 4.198 -12.771 1.00 . A A . 27 VAL CA 1 1 13 8069 1 1 27 VAL CB C 7.056 4.688 -13.775 1.00 . A A . 27 VAL CB 1 1 13 8070 1 1 27 VAL CG1 C 5.655 4.487 -13.216 1.00 . A A . 27 VAL CG1 1 1 13 8071 1 1 27 VAL CG2 C 7.289 6.149 -14.132 1.00 . A A . 27 VAL CG2 1 1 13 8072 1 1 27 VAL H H 7.086 2.385 -12.433 1.00 . A A . 27 VAL H 1 1 13 8073 1 1 27 VAL HA H 9.095 4.365 -13.204 1.00 . A A . 27 VAL HA 1 1 13 8074 1 1 27 VAL HB H 7.146 4.102 -14.677 1.00 . A A . 27 VAL HB 1 1 13 8075 1 1 27 VAL HG11 H 5.622 4.831 -12.192 1.00 . A A . 27 VAL HG11 1 1 13 8076 1 1 27 VAL HG12 H 4.947 5.049 -13.807 1.00 . A A . 27 VAL HG12 1 1 13 8077 1 1 27 VAL HG13 H 5.401 3.438 -13.251 1.00 . A A . 27 VAL HG13 1 1 13 8078 1 1 27 VAL HG21 H 8.339 6.308 -14.329 1.00 . A A . 27 VAL HG21 1 1 13 8079 1 1 27 VAL HG22 H 6.715 6.401 -15.011 1.00 . A A . 27 VAL HG22 1 1 13 8080 1 1 27 VAL HG23 H 6.979 6.775 -13.308 1.00 . A A . 27 VAL HG23 1 1 13 8081 1 1 27 VAL N N 7.983 2.772 -12.509 1.00 . A A . 27 VAL N 1 1 13 8082 1 1 27 VAL O O 8.471 6.151 -11.422 1.00 . A A . 27 VAL O 1 1 13 8083 1 1 28 SER C C 6.940 4.152 -8.052 1.00 . A A . 28 SER C 1 1 13 8084 1 1 28 SER CA C 7.198 5.130 -9.196 1.00 . A A . 28 SER CA 1 1 13 8085 1 1 28 SER CB C 6.038 6.121 -9.300 1.00 . A A . 28 SER CB 1 1 13 8086 1 1 28 SER H H 7.014 3.531 -10.573 1.00 . A A . 28 SER H 1 1 13 8087 1 1 28 SER HA H 8.105 5.675 -8.989 1.00 . A A . 28 SER HA 1 1 13 8088 1 1 28 SER HB2 H 5.105 5.599 -9.142 1.00 . A A . 28 SER HB2 1 1 13 8089 1 1 28 SER HB3 H 6.154 6.887 -8.548 1.00 . A A . 28 SER HB3 1 1 13 8090 1 1 28 SER HG H 5.102 6.748 -10.903 1.00 . A A . 28 SER HG 1 1 13 8091 1 1 28 SER N N 7.373 4.436 -10.467 1.00 . A A . 28 SER N 1 1 13 8092 1 1 28 SER O O 5.864 3.561 -7.958 1.00 . A A . 28 SER O 1 1 13 8093 1 1 28 SER OG O 6.005 6.736 -10.576 1.00 . A A . 28 SER OG 1 1 13 8094 1 1 29 SER C C 7.417 3.893 -4.783 1.00 . A A . 29 SER C 1 1 13 8095 1 1 29 SER CA C 7.800 3.103 -6.030 1.00 . A A . 29 SER CA 1 1 13 8096 1 1 29 SER CB C 9.109 2.347 -5.793 1.00 . A A . 29 SER CB 1 1 13 8097 1 1 29 SER H H 8.758 4.504 -7.297 1.00 . A A . 29 SER H 1 1 13 8098 1 1 29 SER HA H 7.014 2.394 -6.248 1.00 . A A . 29 SER HA 1 1 13 8099 1 1 29 SER HB2 H 9.007 1.721 -4.919 1.00 . A A . 29 SER HB2 1 1 13 8100 1 1 29 SER HB3 H 9.327 1.732 -6.653 1.00 . A A . 29 SER HB3 1 1 13 8101 1 1 29 SER HG H 10.677 3.348 -6.405 1.00 . A A . 29 SER HG 1 1 13 8102 1 1 29 SER N N 7.928 3.997 -7.176 1.00 . A A . 29 SER N 1 1 13 8103 1 1 29 SER O O 7.988 4.948 -4.507 1.00 . A A . 29 SER O 1 1 13 8104 1 1 29 SER OG O 10.186 3.244 -5.586 1.00 . A A . 29 SER OG 1 1 13 8105 1 1 30 HIS C C 5.888 3.100 -1.653 1.00 . A A . 30 HIS C 1 1 13 8106 1 1 30 HIS CA C 5.973 4.062 -2.834 1.00 . A A . 30 HIS CA 1 1 13 8107 1 1 30 HIS CB C 4.606 4.699 -3.088 1.00 . A A . 30 HIS CB 1 1 13 8108 1 1 30 HIS CD2 C 4.935 5.333 -5.581 1.00 . A A . 30 HIS CD2 1 1 13 8109 1 1 30 HIS CE1 C 4.194 7.391 -5.493 1.00 . A A . 30 HIS CE1 1 1 13 8110 1 1 30 HIS CG C 4.571 5.577 -4.300 1.00 . A A . 30 HIS CG 1 1 13 8111 1 1 30 HIS H H 6.011 2.547 -4.315 1.00 . A A . 30 HIS H 1 1 13 8112 1 1 30 HIS HA H 6.682 4.841 -2.597 1.00 . A A . 30 HIS HA 1 1 13 8113 1 1 30 HIS HB2 H 3.873 3.917 -3.225 1.00 . A A . 30 HIS HB2 1 1 13 8114 1 1 30 HIS HB3 H 4.330 5.299 -2.233 1.00 . A A . 30 HIS HB3 1 1 13 8115 1 1 30 HIS HD1 H 3.777 7.352 -3.490 1.00 . A A . 30 HIS HD1 1 1 13 8116 1 1 30 HIS HD2 H 5.337 4.408 -5.967 1.00 . A A . 30 HIS HD2 1 1 13 8117 1 1 30 HIS HE1 H 3.902 8.391 -5.777 1.00 . A A . 30 HIS HE1 1 1 13 8118 1 1 30 HIS HE2 H 4.698 6.538 -7.278 1.00 . A A . 30 HIS HE2 1 1 13 8119 1 1 30 HIS N N 6.438 3.387 -4.040 1.00 . A A . 30 HIS N 1 1 13 8120 1 1 30 HIS ND1 N 4.112 6.877 -4.278 1.00 . A A . 30 HIS ND1 1 1 13 8121 1 1 30 HIS NE2 N 4.691 6.475 -6.302 1.00 . A A . 30 HIS NE2 1 1 13 8122 1 1 30 HIS O O 6.026 1.888 -1.814 1.00 . A A . 30 HIS O 1 1 13 8123 1 1 31 TYR C C 4.182 3.050 1.403 1.00 . A A . 31 TYR C 1 1 13 8124 1 1 31 TYR CA C 5.547 2.855 0.750 1.00 . A A . 31 TYR CA 1 1 13 8125 1 1 31 TYR CB C 6.657 3.232 1.734 1.00 . A A . 31 TYR CB 1 1 13 8126 1 1 31 TYR CD1 C 8.347 1.741 0.596 1.00 . A A . 31 TYR CD1 1 1 13 8127 1 1 31 TYR CD2 C 8.323 1.801 2.979 1.00 . A A . 31 TYR CD2 1 1 13 8128 1 1 31 TYR CE1 C 9.389 0.833 0.625 1.00 . A A . 31 TYR CE1 1 1 13 8129 1 1 31 TYR CE2 C 9.365 0.893 3.017 1.00 . A A . 31 TYR CE2 1 1 13 8130 1 1 31 TYR CG C 7.797 2.239 1.771 1.00 . A A . 31 TYR CG 1 1 13 8131 1 1 31 TYR CZ C 9.894 0.413 1.838 1.00 . A A . 31 TYR CZ 1 1 13 8132 1 1 31 TYR H H 5.554 4.627 -0.406 1.00 . A A . 31 TYR H 1 1 13 8133 1 1 31 TYR HA H 5.657 1.819 0.478 1.00 . A A . 31 TYR HA 1 1 13 8134 1 1 31 TYR HB2 H 7.064 4.193 1.456 1.00 . A A . 31 TYR HB2 1 1 13 8135 1 1 31 TYR HB3 H 6.241 3.297 2.729 1.00 . A A . 31 TYR HB3 1 1 13 8136 1 1 31 TYR HD1 H 7.949 2.072 -0.352 1.00 . A A . 31 TYR HD1 1 1 13 8137 1 1 31 TYR HD2 H 7.906 2.178 3.901 1.00 . A A . 31 TYR HD2 1 1 13 8138 1 1 31 TYR HE1 H 9.803 0.457 -0.298 1.00 . A A . 31 TYR HE1 1 1 13 8139 1 1 31 TYR HE2 H 9.760 0.564 3.967 1.00 . A A . 31 TYR HE2 1 1 13 8140 1 1 31 TYR HH H 11.599 -0.189 2.491 1.00 . A A . 31 TYR HH 1 1 13 8141 1 1 31 TYR N N 5.656 3.654 -0.466 1.00 . A A . 31 TYR N 1 1 13 8142 1 1 31 TYR O O 3.715 4.179 1.554 1.00 . A A . 31 TYR O 1 1 13 8143 1 1 31 TYR OH O 10.931 -0.491 1.871 1.00 . A A . 31 TYR OH 1 1 13 8144 1 1 32 CYS C C 2.365 2.237 3.923 1.00 . A A . 32 CYS C 1 1 13 8145 1 1 32 CYS CA C 2.233 2.018 2.422 1.00 . A A . 32 CYS CA 1 1 13 8146 1 1 32 CYS CB C 1.435 0.742 2.151 1.00 . A A . 32 CYS CB 1 1 13 8147 1 1 32 CYS H H 3.960 1.071 1.645 1.00 . A A . 32 CYS H 1 1 13 8148 1 1 32 CYS HA H 1.706 2.857 1.995 1.00 . A A . 32 CYS HA 1 1 13 8149 1 1 32 CYS HB2 H 1.742 0.328 1.203 1.00 . A A . 32 CYS HB2 1 1 13 8150 1 1 32 CYS HB3 H 1.638 0.026 2.934 1.00 . A A . 32 CYS HB3 1 1 13 8151 1 1 32 CYS N N 3.543 1.948 1.789 1.00 . A A . 32 CYS N 1 1 13 8152 1 1 32 CYS O O 3.437 2.053 4.499 1.00 . A A . 32 CYS O 1 1 13 8153 1 1 32 CYS SG S -0.369 0.999 2.086 1.00 . A A . 32 CYS SG 1 1 13 8154 1 1 33 THR C C 0.241 1.938 6.668 1.00 . A A . 33 THR C 1 1 13 8155 1 1 33 THR CA C 1.241 2.866 5.987 1.00 . A A . 33 THR CA 1 1 13 8156 1 1 33 THR CB C 0.881 4.326 6.279 1.00 . A A . 33 THR CB 1 1 13 8157 1 1 33 THR CG2 C 1.525 5.307 5.322 1.00 . A A . 33 THR CG2 1 1 13 8158 1 1 33 THR H H 0.439 2.748 4.036 1.00 . A A . 33 THR H 1 1 13 8159 1 1 33 THR HA H 2.228 2.662 6.374 1.00 . A A . 33 THR HA 1 1 13 8160 1 1 33 THR HB H 1.211 4.573 7.277 1.00 . A A . 33 THR HB 1 1 13 8161 1 1 33 THR HG1 H -0.734 5.413 6.492 1.00 . A A . 33 THR HG1 1 1 13 8162 1 1 33 THR HG21 H 2.584 5.107 5.259 1.00 . A A . 33 THR HG21 1 1 13 8163 1 1 33 THR HG22 H 1.080 5.200 4.343 1.00 . A A . 33 THR HG22 1 1 13 8164 1 1 33 THR HG23 H 1.369 6.314 5.680 1.00 . A A . 33 THR HG23 1 1 13 8165 1 1 33 THR N N 1.262 2.626 4.551 1.00 . A A . 33 THR N 1 1 13 8166 1 1 33 THR O O -0.199 2.198 7.788 1.00 . A A . 33 THR O 1 1 13 8167 1 1 33 THR OG1 O -0.521 4.520 6.212 1.00 . A A . 33 THR OG1 1 1 13 8168 1 1 34 GLY C C -2.291 0.564 7.129 1.00 . A A . 34 GLY C 1 1 13 8169 1 1 34 GLY CA C -1.063 -0.102 6.534 1.00 . A A . 34 GLY CA 1 1 13 8170 1 1 34 GLY H H 0.272 0.697 5.091 1.00 . A A . 34 GLY H 1 1 13 8171 1 1 34 GLY HA2 H -0.570 -0.676 7.305 1.00 . A A . 34 GLY HA2 1 1 13 8172 1 1 34 GLY HA3 H -1.378 -0.771 5.749 1.00 . A A . 34 GLY HA3 1 1 13 8173 1 1 34 GLY N N -0.115 0.852 5.982 1.00 . A A . 34 GLY N 1 1 13 8174 1 1 34 GLY O O -2.705 0.236 8.241 1.00 . A A . 34 GLY O 1 1 13 8175 1 1 35 ARG C C -5.128 2.263 5.764 1.00 . A A . 35 ARG C 1 1 13 8176 1 1 35 ARG CA C -4.060 2.214 6.851 1.00 . A A . 35 ARG CA 1 1 13 8177 1 1 35 ARG CB C -3.691 3.634 7.284 1.00 . A A . 35 ARG CB 1 1 13 8178 1 1 35 ARG CD C -3.279 5.187 9.216 1.00 . A A . 35 ARG CD 1 1 13 8179 1 1 35 ARG CG C -3.301 3.741 8.749 1.00 . A A . 35 ARG CG 1 1 13 8180 1 1 35 ARG CZ C -2.693 4.977 11.600 1.00 . A A . 35 ARG CZ 1 1 13 8181 1 1 35 ARG H H -2.497 1.720 5.510 1.00 . A A . 35 ARG H 1 1 13 8182 1 1 35 ARG HA H -4.454 1.680 7.699 1.00 . A A . 35 ARG HA 1 1 13 8183 1 1 35 ARG HB2 H -2.859 3.976 6.687 1.00 . A A . 35 ARG HB2 1 1 13 8184 1 1 35 ARG HB3 H -4.537 4.282 7.112 1.00 . A A . 35 ARG HB3 1 1 13 8185 1 1 35 ARG HD2 H -2.302 5.602 9.015 1.00 . A A . 35 ARG HD2 1 1 13 8186 1 1 35 ARG HD3 H -4.025 5.741 8.665 1.00 . A A . 35 ARG HD3 1 1 13 8187 1 1 35 ARG HE H -4.440 5.649 10.906 1.00 . A A . 35 ARG HE 1 1 13 8188 1 1 35 ARG HG2 H -4.016 3.192 9.344 1.00 . A A . 35 ARG HG2 1 1 13 8189 1 1 35 ARG HG3 H -2.317 3.314 8.882 1.00 . A A . 35 ARG HG3 1 1 13 8190 1 1 35 ARG HH11 H -1.232 4.402 10.325 1.00 . A A . 35 ARG HH11 1 1 13 8191 1 1 35 ARG HH12 H -0.846 4.264 12.007 1.00 . A A . 35 ARG HH12 1 1 13 8192 1 1 35 ARG HH21 H -3.932 5.469 13.119 1.00 . A A . 35 ARG HH21 1 1 13 8193 1 1 35 ARG HH22 H -2.378 4.870 13.594 1.00 . A A . 35 ARG HH22 1 1 13 8194 1 1 35 ARG N N -2.873 1.502 6.387 1.00 . A A . 35 ARG N 1 1 13 8195 1 1 35 ARG NE N -3.559 5.306 10.645 1.00 . A A . 35 ARG NE 1 1 13 8196 1 1 35 ARG NH1 N -1.492 4.509 11.284 1.00 . A A . 35 ARG NH1 1 1 13 8197 1 1 35 ARG NH2 N -3.029 5.117 12.876 1.00 . A A . 35 ARG NH2 1 1 13 8198 1 1 35 ARG O O -6.303 2.000 6.020 1.00 . A A . 35 ARG O 1 1 13 8199 1 1 36 SER C C -5.053 1.973 2.202 1.00 . A A . 36 SER C 1 1 13 8200 1 1 36 SER CA C -5.626 2.690 3.421 1.00 . A A . 36 SER CA 1 1 13 8201 1 1 36 SER CB C -5.910 4.154 3.080 1.00 . A A . 36 SER CB 1 1 13 8202 1 1 36 SER H H -3.761 2.801 4.415 1.00 . A A . 36 SER H 1 1 13 8203 1 1 36 SER HA H -6.551 2.210 3.705 1.00 . A A . 36 SER HA 1 1 13 8204 1 1 36 SER HB2 H -6.844 4.222 2.543 1.00 . A A . 36 SER HB2 1 1 13 8205 1 1 36 SER HB3 H -5.977 4.727 3.993 1.00 . A A . 36 SER HB3 1 1 13 8206 1 1 36 SER HG H -4.027 4.503 2.666 1.00 . A A . 36 SER HG 1 1 13 8207 1 1 36 SER N N -4.710 2.603 4.552 1.00 . A A . 36 SER N 1 1 13 8208 1 1 36 SER O O -3.844 1.762 2.108 1.00 . A A . 36 SER O 1 1 13 8209 1 1 36 SER OG O -4.880 4.700 2.273 1.00 . A A . 36 SER OG 1 1 13 8210 1 1 37 CYS C C -4.691 1.848 -0.832 1.00 . A A . 37 CYS C 1 1 13 8211 1 1 37 CYS CA C -5.499 0.914 0.059 1.00 . A A . 37 CYS CA 1 1 13 8212 1 1 37 CYS CB C -6.710 0.377 -0.706 1.00 . A A . 37 CYS CB 1 1 13 8213 1 1 37 CYS H H -6.878 1.801 1.397 1.00 . A A . 37 CYS H 1 1 13 8214 1 1 37 CYS HA H -4.873 0.085 0.353 1.00 . A A . 37 CYS HA 1 1 13 8215 1 1 37 CYS HB2 H -7.432 1.171 -0.824 1.00 . A A . 37 CYS HB2 1 1 13 8216 1 1 37 CYS HB3 H -6.389 0.043 -1.682 1.00 . A A . 37 CYS HB3 1 1 13 8217 1 1 37 CYS N N -5.926 1.603 1.270 1.00 . A A . 37 CYS N 1 1 13 8218 1 1 37 CYS O O -3.807 1.411 -1.569 1.00 . A A . 37 CYS O 1 1 13 8219 1 1 37 CYS SG S -7.550 -1.018 0.111 1.00 . A A . 37 CYS SG 1 1 13 8220 1 1 38 GLU C C -2.848 4.270 -1.102 1.00 . A A . 38 GLU C 1 1 13 8221 1 1 38 GLU CA C -4.299 4.139 -1.553 1.00 . A A . 38 GLU CA 1 1 13 8222 1 1 38 GLU CB C -5.004 5.492 -1.445 1.00 . A A . 38 GLU CB 1 1 13 8223 1 1 38 GLU CD C -3.688 7.300 -2.620 1.00 . A A . 38 GLU CD 1 1 13 8224 1 1 38 GLU CG C -4.867 6.350 -2.692 1.00 . A A . 38 GLU CG 1 1 13 8225 1 1 38 GLU H H -5.712 3.424 -0.147 1.00 . A A . 38 GLU H 1 1 13 8226 1 1 38 GLU HA H -4.316 3.814 -2.582 1.00 . A A . 38 GLU HA 1 1 13 8227 1 1 38 GLU HB2 H -6.055 5.324 -1.263 1.00 . A A . 38 GLU HB2 1 1 13 8228 1 1 38 GLU HB3 H -4.586 6.038 -0.612 1.00 . A A . 38 GLU HB3 1 1 13 8229 1 1 38 GLU HG2 H -4.736 5.703 -3.546 1.00 . A A . 38 GLU HG2 1 1 13 8230 1 1 38 GLU HG3 H -5.771 6.929 -2.816 1.00 . A A . 38 GLU HG3 1 1 13 8231 1 1 38 GLU N N -4.999 3.138 -0.756 1.00 . A A . 38 GLU N 1 1 13 8232 1 1 38 GLU O O -2.537 4.097 0.077 1.00 . A A . 38 GLU O 1 1 13 8233 1 1 38 GLU OE1 O -3.371 7.770 -1.507 1.00 . A A . 38 GLU OE1 1 1 13 8234 1 1 38 GLU OE2 O -3.080 7.574 -3.677 1.00 . A A . 38 GLU OE2 1 1 13 8235 1 1 39 CYS C C -0.110 6.185 -1.878 1.00 . A A . 39 CYS C 1 1 13 8236 1 1 39 CYS CA C -0.546 4.726 -1.742 1.00 . A A . 39 CYS CA 1 1 13 8237 1 1 39 CYS CB C 0.291 3.844 -2.671 1.00 . A A . 39 CYS CB 1 1 13 8238 1 1 39 CYS H H -2.272 4.699 -2.968 1.00 . A A . 39 CYS H 1 1 13 8239 1 1 39 CYS HA H -0.390 4.408 -0.722 1.00 . A A . 39 CYS HA 1 1 13 8240 1 1 39 CYS HB2 H 0.107 4.135 -3.695 1.00 . A A . 39 CYS HB2 1 1 13 8241 1 1 39 CYS HB3 H 1.338 3.987 -2.444 1.00 . A A . 39 CYS HB3 1 1 13 8242 1 1 39 CYS N N -1.964 4.575 -2.046 1.00 . A A . 39 CYS N 1 1 13 8243 1 1 39 CYS O O -0.562 6.893 -2.778 1.00 . A A . 39 CYS O 1 1 13 8244 1 1 39 CYS SG S -0.071 2.064 -2.528 1.00 . A A . 39 CYS SG 1 1 13 8245 1 1 40 PRO C C 1.826 8.421 -2.379 1.00 . A A . 40 PRO C 1 1 13 8246 1 1 40 PRO CA C 1.273 8.035 -1.013 1.00 . A A . 40 PRO CA 1 1 13 8247 1 1 40 PRO CB C 2.388 8.039 0.035 1.00 . A A . 40 PRO CB 1 1 13 8248 1 1 40 PRO CD C 1.373 5.878 0.122 1.00 . A A . 40 PRO CD 1 1 13 8249 1 1 40 PRO CG C 2.040 6.929 0.964 1.00 . A A . 40 PRO CG 1 1 13 8250 1 1 40 PRO HA H 0.504 8.738 -0.728 1.00 . A A . 40 PRO HA 1 1 13 8251 1 1 40 PRO HB2 H 3.339 7.868 -0.448 1.00 . A A . 40 PRO HB2 1 1 13 8252 1 1 40 PRO HB3 H 2.403 8.991 0.545 1.00 . A A . 40 PRO HB3 1 1 13 8253 1 1 40 PRO HD2 H 2.102 5.173 -0.250 1.00 . A A . 40 PRO HD2 1 1 13 8254 1 1 40 PRO HD3 H 0.608 5.370 0.690 1.00 . A A . 40 PRO HD3 1 1 13 8255 1 1 40 PRO HG2 H 2.938 6.534 1.416 1.00 . A A . 40 PRO HG2 1 1 13 8256 1 1 40 PRO HG3 H 1.362 7.286 1.725 1.00 . A A . 40 PRO HG3 1 1 13 8257 1 1 40 PRO N N 0.779 6.654 -0.984 1.00 . A A . 40 PRO N 1 1 13 8258 1 1 40 PRO O O 1.834 7.613 -3.309 1.00 . A A . 40 PRO O 1 1 13 8259 1 1 41 SER C C 4.372 10.127 -3.714 1.00 . A A . 41 SER C 1 1 13 8260 1 1 41 SER CA C 2.847 10.156 -3.746 1.00 . A A . 41 SER CA 1 1 13 8261 1 1 41 SER CB C 2.358 11.580 -4.017 1.00 . A A . 41 SER CB 1 1 13 8262 1 1 41 SER H H 2.254 10.255 -1.715 1.00 . A A . 41 SER H 1 1 13 8263 1 1 41 SER HA H 2.504 9.510 -4.540 1.00 . A A . 41 SER HA 1 1 13 8264 1 1 41 SER HB2 H 1.400 11.727 -3.540 1.00 . A A . 41 SER HB2 1 1 13 8265 1 1 41 SER HB3 H 3.071 12.286 -3.617 1.00 . A A . 41 SER HB3 1 1 13 8266 1 1 41 SER HG H 1.763 11.070 -5.813 1.00 . A A . 41 SER HG 1 1 13 8267 1 1 41 SER N N 2.289 9.660 -2.493 1.00 . A A . 41 SER N 1 1 13 8268 1 1 41 SER O O 5.021 10.022 -4.755 1.00 . A A . 41 SER O 1 1 13 8269 1 1 41 SER OG O 2.214 11.814 -5.408 1.00 . A A . 41 SER OG 1 1 13 8270 1 1 42 TYR C C 6.892 8.780 -2.119 1.00 . A A . 42 TYR C 1 1 13 8271 1 1 42 TYR CA C 6.389 10.202 -2.355 1.00 . A A . 42 TYR CA 1 1 13 8272 1 1 42 TYR CB C 6.806 11.106 -1.192 1.00 . A A . 42 TYR CB 1 1 13 8273 1 1 42 TYR CD1 C 7.127 9.751 0.913 1.00 . A A . 42 TYR CD1 1 1 13 8274 1 1 42 TYR CD2 C 5.115 11.008 0.681 1.00 . A A . 42 TYR CD2 1 1 13 8275 1 1 42 TYR CE1 C 6.706 9.297 2.149 1.00 . A A . 42 TYR CE1 1 1 13 8276 1 1 42 TYR CE2 C 4.687 10.559 1.915 1.00 . A A . 42 TYR CE2 1 1 13 8277 1 1 42 TYR CG C 6.340 10.613 0.159 1.00 . A A . 42 TYR CG 1 1 13 8278 1 1 42 TYR CZ C 5.485 9.704 2.645 1.00 . A A . 42 TYR CZ 1 1 13 8279 1 1 42 TYR H H 4.372 10.302 -1.722 1.00 . A A . 42 TYR H 1 1 13 8280 1 1 42 TYR HA H 6.827 10.580 -3.267 1.00 . A A . 42 TYR HA 1 1 13 8281 1 1 42 TYR HB2 H 7.883 11.173 -1.167 1.00 . A A . 42 TYR HB2 1 1 13 8282 1 1 42 TYR HB3 H 6.393 12.092 -1.347 1.00 . A A . 42 TYR HB3 1 1 13 8283 1 1 42 TYR HD1 H 8.083 9.435 0.522 1.00 . A A . 42 TYR HD1 1 1 13 8284 1 1 42 TYR HD2 H 4.491 11.677 0.106 1.00 . A A . 42 TYR HD2 1 1 13 8285 1 1 42 TYR HE1 H 7.332 8.628 2.720 1.00 . A A . 42 TYR HE1 1 1 13 8286 1 1 42 TYR HE2 H 3.731 10.877 2.304 1.00 . A A . 42 TYR HE2 1 1 13 8287 1 1 42 TYR HH H 4.461 8.516 3.756 1.00 . A A . 42 TYR HH 1 1 13 8288 1 1 42 TYR N N 4.940 10.220 -2.516 1.00 . A A . 42 TYR N 1 1 13 8289 1 1 42 TYR O O 6.201 7.961 -1.513 1.00 . A A . 42 TYR O 1 1 13 8290 1 1 42 TYR OH O 5.063 9.254 3.875 1.00 . A A . 42 TYR OH 1 1 13 8291 1 1 43 PRO C C 9.130 6.862 -0.996 1.00 . A A . 43 PRO C 1 1 13 8292 1 1 43 PRO CA C 8.701 7.134 -2.434 1.00 . A A . 43 PRO CA 1 1 13 8293 1 1 43 PRO CB C 9.919 7.174 -3.357 1.00 . A A . 43 PRO CB 1 1 13 8294 1 1 43 PRO CD C 9.002 9.382 -3.332 1.00 . A A . 43 PRO CD 1 1 13 8295 1 1 43 PRO CG C 10.292 8.614 -3.424 1.00 . A A . 43 PRO CG 1 1 13 8296 1 1 43 PRO HA H 8.023 6.358 -2.759 1.00 . A A . 43 PRO HA 1 1 13 8297 1 1 43 PRO HB2 H 10.714 6.577 -2.935 1.00 . A A . 43 PRO HB2 1 1 13 8298 1 1 43 PRO HB3 H 9.650 6.791 -4.330 1.00 . A A . 43 PRO HB3 1 1 13 8299 1 1 43 PRO HD2 H 9.148 10.300 -2.784 1.00 . A A . 43 PRO HD2 1 1 13 8300 1 1 43 PRO HD3 H 8.614 9.587 -4.319 1.00 . A A . 43 PRO HD3 1 1 13 8301 1 1 43 PRO HG2 H 10.938 8.864 -2.595 1.00 . A A . 43 PRO HG2 1 1 13 8302 1 1 43 PRO HG3 H 10.786 8.822 -4.362 1.00 . A A . 43 PRO HG3 1 1 13 8303 1 1 43 PRO N N 8.109 8.465 -2.597 1.00 . A A . 43 PRO N 1 1 13 8304 1 1 43 PRO O O 9.408 7.789 -0.235 1.00 . A A . 43 PRO O 1 1 13 8305 1 1 44 GLY C C 11.055 4.884 0.815 1.00 . A A . 44 GLY C 1 1 13 8306 1 1 44 GLY CA C 9.579 5.215 0.715 1.00 . A A . 44 GLY CA 1 1 13 8307 1 1 44 GLY H H 8.950 4.890 -1.280 1.00 . A A . 44 GLY H 1 1 13 8308 1 1 44 GLY HA2 H 9.006 4.353 1.023 1.00 . A A . 44 GLY HA2 1 1 13 8309 1 1 44 GLY HA3 H 9.360 6.036 1.382 1.00 . A A . 44 GLY HA3 1 1 13 8310 1 1 44 GLY N N 9.182 5.586 -0.631 1.00 . A A . 44 GLY N 1 1 13 8311 1 1 44 GLY O O 11.461 3.749 0.565 1.00 . A A . 44 GLY O 1 1 13 8312 1 1 45 ASN C C 13.858 6.530 2.452 1.00 . A A . 45 ASN C 1 1 13 8313 1 1 45 ASN CA C 13.299 5.685 1.312 1.00 . A A . 45 ASN CA 1 1 13 8314 1 1 45 ASN CB C 14.004 6.044 0.002 1.00 . A A . 45 ASN CB 1 1 13 8315 1 1 45 ASN CG C 15.179 5.132 -0.290 1.00 . A A . 45 ASN CG 1 1 13 8316 1 1 45 ASN H H 11.475 6.760 1.365 1.00 . A A . 45 ASN H 1 1 13 8317 1 1 45 ASN HA H 13.475 4.643 1.532 1.00 . A A . 45 ASN HA 1 1 13 8318 1 1 45 ASN HB2 H 13.300 5.964 -0.812 1.00 . A A . 45 ASN HB2 1 1 13 8319 1 1 45 ASN HB3 H 14.365 7.060 0.062 1.00 . A A . 45 ASN HB3 1 1 13 8320 1 1 45 ASN HD21 H 16.453 6.602 0.122 1.00 . A A . 45 ASN HD21 1 1 13 8321 1 1 45 ASN HD22 H 17.167 5.097 -0.337 1.00 . A A . 45 ASN HD22 1 1 13 8322 1 1 45 ASN N N 11.859 5.877 1.180 1.00 . A A . 45 ASN N 1 1 13 8323 1 1 45 ASN ND2 N 16.389 5.664 -0.155 1.00 . A A . 45 ASN ND2 1 1 13 8324 1 1 45 ASN O O 14.977 7.037 2.371 1.00 . A A . 45 ASN O 1 1 13 8325 1 1 45 ASN OD1 O 15.003 3.963 -0.632 1.00 . A A . 45 ASN OD1 1 1 13 8326 1 1 46 GLY C C 13.934 6.597 5.823 1.00 . A A . 46 GLY C 1 1 13 8327 1 1 46 GLY CA C 13.506 7.461 4.654 1.00 . A A . 46 GLY CA 1 1 13 8328 1 1 46 GLY H H 12.190 6.250 3.521 1.00 . A A . 46 GLY H 1 1 13 8329 1 1 46 GLY HA2 H 12.692 8.097 4.970 1.00 . A A . 46 GLY HA2 1 1 13 8330 1 1 46 GLY HA3 H 14.338 8.082 4.356 1.00 . A A . 46 GLY HA3 1 1 13 8331 1 1 46 GLY N N 13.072 6.677 3.513 1.00 . A A . 46 GLY N 1 1 13 8332 1 1 46 GLY O O 13.075 6.279 6.673 1.00 . A A . 46 GLY O 1 1 13 8333 1 1 46 GLY OXT O 15.128 6.236 5.889 1.00 . A A . 46 GLY OXT 1 1 14 8334 1 1 1 ALA C C -14.626 -3.701 9.507 1.00 . A A . 1 ALA C 1 1 14 8335 1 1 1 ALA CA C -15.521 -2.601 10.068 1.00 . A A . 1 ALA CA 1 1 14 8336 1 1 1 ALA CB C -16.929 -3.130 10.291 1.00 . A A . 1 ALA CB 1 1 14 8337 1 1 1 ALA H1 H -14.574 -1.238 8.852 1.00 . A A . 1 ALA H1 1 1 14 8338 1 1 1 ALA H2 H -16.162 -1.661 8.355 1.00 . A A . 1 ALA H2 1 1 14 8339 1 1 1 ALA H3 H -15.934 -0.621 9.698 1.00 . A A . 1 ALA H3 1 1 14 8340 1 1 1 ALA HA H -15.126 -2.285 11.023 1.00 . A A . 1 ALA HA 1 1 14 8341 1 1 1 ALA HB1 H -17.640 -2.326 10.168 1.00 . A A . 1 ALA HB1 1 1 14 8342 1 1 1 ALA HB2 H -17.009 -3.531 11.291 1.00 . A A . 1 ALA HB2 1 1 14 8343 1 1 1 ALA HB3 H -17.139 -3.909 9.573 1.00 . A A . 1 ALA HB3 1 1 14 8344 1 1 1 ALA N N -15.550 -1.424 9.162 1.00 . A A . 1 ALA N 1 1 14 8345 1 1 1 ALA O O -13.578 -4.012 10.073 1.00 . A A . 1 ALA O 1 1 14 8346 1 1 2 MET C C -14.237 -5.159 6.240 1.00 . A A . 2 MET C 1 1 14 8347 1 1 2 MET CA C -14.283 -5.353 7.752 1.00 . A A . 2 MET CA 1 1 14 8348 1 1 2 MET CB C -14.893 -6.716 8.085 1.00 . A A . 2 MET CB 1 1 14 8349 1 1 2 MET CE C -16.222 -9.390 9.036 1.00 . A A . 2 MET CE 1 1 14 8350 1 1 2 MET CG C -14.671 -7.146 9.526 1.00 . A A . 2 MET CG 1 1 14 8351 1 1 2 MET H H -15.890 -3.996 7.986 1.00 . A A . 2 MET H 1 1 14 8352 1 1 2 MET HA H -13.275 -5.316 8.139 1.00 . A A . 2 MET HA 1 1 14 8353 1 1 2 MET HB2 H -15.957 -6.675 7.904 1.00 . A A . 2 MET HB2 1 1 14 8354 1 1 2 MET HB3 H -14.455 -7.461 7.438 1.00 . A A . 2 MET HB3 1 1 14 8355 1 1 2 MET HE1 H -15.355 -9.400 8.392 1.00 . A A . 2 MET HE1 1 1 14 8356 1 1 2 MET HE2 H -16.285 -10.326 9.570 1.00 . A A . 2 MET HE2 1 1 14 8357 1 1 2 MET HE3 H -17.112 -9.255 8.440 1.00 . A A . 2 MET HE3 1 1 14 8358 1 1 2 MET HG2 H -13.802 -7.786 9.567 1.00 . A A . 2 MET HG2 1 1 14 8359 1 1 2 MET HG3 H -14.497 -6.266 10.128 1.00 . A A . 2 MET HG3 1 1 14 8360 1 1 2 MET N N -15.046 -4.287 8.391 1.00 . A A . 2 MET N 1 1 14 8361 1 1 2 MET O O -14.257 -6.127 5.480 1.00 . A A . 2 MET O 1 1 14 8362 1 1 2 MET SD S -16.079 -8.043 10.208 1.00 . A A . 2 MET SD 1 1 14 8363 1 1 3 ASP C C -12.684 -3.433 3.915 1.00 . A A . 3 ASP C 1 1 14 8364 1 1 3 ASP CA C -14.126 -3.582 4.390 1.00 . A A . 3 ASP CA 1 1 14 8365 1 1 3 ASP CB C -14.903 -2.295 4.109 1.00 . A A . 3 ASP CB 1 1 14 8366 1 1 3 ASP CG C -16.377 -2.552 3.863 1.00 . A A . 3 ASP CG 1 1 14 8367 1 1 3 ASP H H -14.162 -3.174 6.466 1.00 . A A . 3 ASP H 1 1 14 8368 1 1 3 ASP HA H -14.587 -4.396 3.850 1.00 . A A . 3 ASP HA 1 1 14 8369 1 1 3 ASP HB2 H -14.809 -1.633 4.956 1.00 . A A . 3 ASP HB2 1 1 14 8370 1 1 3 ASP HB3 H -14.489 -1.816 3.234 1.00 . A A . 3 ASP HB3 1 1 14 8371 1 1 3 ASP N N -14.175 -3.903 5.811 1.00 . A A . 3 ASP N 1 1 14 8372 1 1 3 ASP O O -11.765 -3.297 4.723 1.00 . A A . 3 ASP O 1 1 14 8373 1 1 3 ASP OD1 O -16.854 -2.252 2.749 1.00 . A A . 3 ASP OD1 1 1 14 8374 1 1 3 ASP OD2 O -17.054 -3.053 4.785 1.00 . A A . 3 ASP OD2 1 1 14 8375 1 1 4 CYS C C -11.201 -2.492 0.744 1.00 . A A . 4 CYS C 1 1 14 8376 1 1 4 CYS CA C -11.163 -3.327 2.017 1.00 . A A . 4 CYS CA 1 1 14 8377 1 1 4 CYS CB C -10.569 -4.700 1.712 1.00 . A A . 4 CYS CB 1 1 14 8378 1 1 4 CYS H H -13.266 -3.570 2.007 1.00 . A A . 4 CYS H 1 1 14 8379 1 1 4 CYS HA H -10.532 -2.831 2.739 1.00 . A A . 4 CYS HA 1 1 14 8380 1 1 4 CYS HB2 H -9.786 -4.585 0.979 1.00 . A A . 4 CYS HB2 1 1 14 8381 1 1 4 CYS HB3 H -10.148 -5.109 2.618 1.00 . A A . 4 CYS HB3 1 1 14 8382 1 1 4 CYS N N -12.494 -3.459 2.600 1.00 . A A . 4 CYS N 1 1 14 8383 1 1 4 CYS O O -12.228 -2.415 0.068 1.00 . A A . 4 CYS O 1 1 14 8384 1 1 4 CYS SG S -11.760 -5.915 1.056 1.00 . A A . 4 CYS SG 1 1 14 8385 1 1 5 THR C C -9.068 -1.722 -1.811 1.00 . A A . 5 THR C 1 1 14 8386 1 1 5 THR CA C -9.967 -1.050 -0.778 1.00 . A A . 5 THR CA 1 1 14 8387 1 1 5 THR CB C -9.419 0.332 -0.427 1.00 . A A . 5 THR CB 1 1 14 8388 1 1 5 THR CG2 C -9.795 1.398 -1.433 1.00 . A A . 5 THR CG2 1 1 14 8389 1 1 5 THR H H -9.286 -1.980 0.996 1.00 . A A . 5 THR H 1 1 14 8390 1 1 5 THR HA H -10.956 -0.941 -1.192 1.00 . A A . 5 THR HA 1 1 14 8391 1 1 5 THR HB H -8.342 0.280 -0.389 1.00 . A A . 5 THR HB 1 1 14 8392 1 1 5 THR HG1 H -9.588 0.139 1.515 1.00 . A A . 5 THR HG1 1 1 14 8393 1 1 5 THR HG21 H -10.421 0.965 -2.199 1.00 . A A . 5 THR HG21 1 1 14 8394 1 1 5 THR HG22 H -10.334 2.190 -0.934 1.00 . A A . 5 THR HG22 1 1 14 8395 1 1 5 THR HG23 H -8.900 1.800 -1.884 1.00 . A A . 5 THR HG23 1 1 14 8396 1 1 5 THR N N -10.072 -1.874 0.419 1.00 . A A . 5 THR N 1 1 14 8397 1 1 5 THR O O -7.913 -1.337 -1.986 1.00 . A A . 5 THR O 1 1 14 8398 1 1 5 THR OG1 O -9.890 0.753 0.841 1.00 . A A . 5 THR OG1 1 1 14 8399 1 1 6 THR C C -8.060 -2.534 -4.405 1.00 . A A . 6 THR C 1 1 14 8400 1 1 6 THR CA C -8.857 -3.474 -3.504 1.00 . A A . 6 THR CA 1 1 14 8401 1 1 6 THR CB C -9.808 -4.326 -4.347 1.00 . A A . 6 THR CB 1 1 14 8402 1 1 6 THR CG2 C -9.897 -5.763 -3.879 1.00 . A A . 6 THR CG2 1 1 14 8403 1 1 6 THR H H -10.532 -2.996 -2.297 1.00 . A A . 6 THR H 1 1 14 8404 1 1 6 THR HA H -8.168 -4.127 -2.991 1.00 . A A . 6 THR HA 1 1 14 8405 1 1 6 THR HB H -9.459 -4.332 -5.370 1.00 . A A . 6 THR HB 1 1 14 8406 1 1 6 THR HG1 H -11.626 -4.152 -5.054 1.00 . A A . 6 THR HG1 1 1 14 8407 1 1 6 THR HG21 H -9.085 -5.971 -3.198 1.00 . A A . 6 THR HG21 1 1 14 8408 1 1 6 THR HG22 H -10.839 -5.919 -3.375 1.00 . A A . 6 THR HG22 1 1 14 8409 1 1 6 THR HG23 H -9.830 -6.424 -4.731 1.00 . A A . 6 THR HG23 1 1 14 8410 1 1 6 THR N N -9.607 -2.735 -2.489 1.00 . A A . 6 THR N 1 1 14 8411 1 1 6 THR O O -8.588 -1.986 -5.372 1.00 . A A . 6 THR O 1 1 14 8412 1 1 6 THR OG1 O -11.117 -3.785 -4.327 1.00 . A A . 6 THR OG1 1 1 14 8413 1 1 7 GLY C C -4.458 -1.807 -4.695 1.00 . A A . 7 GLY C 1 1 14 8414 1 1 7 GLY CA C -5.931 -1.480 -4.859 1.00 . A A . 7 GLY CA 1 1 14 8415 1 1 7 GLY H H -6.420 -2.816 -3.293 1.00 . A A . 7 GLY H 1 1 14 8416 1 1 7 GLY HA2 H -6.099 -0.459 -4.549 1.00 . A A . 7 GLY HA2 1 1 14 8417 1 1 7 GLY HA3 H -6.197 -1.578 -5.901 1.00 . A A . 7 GLY HA3 1 1 14 8418 1 1 7 GLY N N -6.784 -2.353 -4.075 1.00 . A A . 7 GLY N 1 1 14 8419 1 1 7 GLY O O -4.100 -2.956 -4.436 1.00 . A A . 7 GLY O 1 1 14 8420 1 1 8 PRO C C -1.690 -1.320 -3.286 1.00 . A A . 8 PRO C 1 1 14 8421 1 1 8 PRO CA C -2.125 -1.006 -4.719 1.00 . A A . 8 PRO CA 1 1 14 8422 1 1 8 PRO CB C -1.537 0.331 -5.183 1.00 . A A . 8 PRO CB 1 1 14 8423 1 1 8 PRO CD C -3.917 0.590 -5.166 1.00 . A A . 8 PRO CD 1 1 14 8424 1 1 8 PRO CG C -2.622 1.327 -4.966 1.00 . A A . 8 PRO CG 1 1 14 8425 1 1 8 PRO HA H -1.780 -1.794 -5.373 1.00 . A A . 8 PRO HA 1 1 14 8426 1 1 8 PRO HB2 H -0.663 0.566 -4.595 1.00 . A A . 8 PRO HB2 1 1 14 8427 1 1 8 PRO HB3 H -1.266 0.266 -6.228 1.00 . A A . 8 PRO HB3 1 1 14 8428 1 1 8 PRO HD2 H -4.672 0.964 -4.490 1.00 . A A . 8 PRO HD2 1 1 14 8429 1 1 8 PRO HD3 H -4.248 0.681 -6.190 1.00 . A A . 8 PRO HD3 1 1 14 8430 1 1 8 PRO HG2 H -2.566 1.716 -3.963 1.00 . A A . 8 PRO HG2 1 1 14 8431 1 1 8 PRO HG3 H -2.533 2.128 -5.685 1.00 . A A . 8 PRO HG3 1 1 14 8432 1 1 8 PRO N N -3.573 -0.808 -4.848 1.00 . A A . 8 PRO N 1 1 14 8433 1 1 8 PRO O O -0.598 -1.843 -3.065 1.00 . A A . 8 PRO O 1 1 14 8434 1 1 9 CYS C C -3.199 -2.297 -0.317 1.00 . A A . 9 CYS C 1 1 14 8435 1 1 9 CYS CA C -2.238 -1.268 -0.908 1.00 . A A . 9 CYS CA 1 1 14 8436 1 1 9 CYS CB C -2.310 0.028 -0.095 1.00 . A A . 9 CYS CB 1 1 14 8437 1 1 9 CYS H H -3.405 -0.595 -2.548 1.00 . A A . 9 CYS H 1 1 14 8438 1 1 9 CYS HA H -1.233 -1.659 -0.857 1.00 . A A . 9 CYS HA 1 1 14 8439 1 1 9 CYS HB2 H -2.738 0.804 -0.708 1.00 . A A . 9 CYS HB2 1 1 14 8440 1 1 9 CYS HB3 H -2.942 -0.130 0.767 1.00 . A A . 9 CYS HB3 1 1 14 8441 1 1 9 CYS N N -2.547 -1.007 -2.315 1.00 . A A . 9 CYS N 1 1 14 8442 1 1 9 CYS O O -3.391 -2.353 0.897 1.00 . A A . 9 CYS O 1 1 14 8443 1 1 9 CYS SG S -0.696 0.626 0.505 1.00 . A A . 9 CYS SG 1 1 14 8444 1 1 10 CYS C C -4.547 -5.427 -1.503 1.00 . A A . 10 CYS C 1 1 14 8445 1 1 10 CYS CA C -4.749 -4.123 -0.738 1.00 . A A . 10 CYS CA 1 1 14 8446 1 1 10 CYS CB C -6.179 -3.620 -0.933 1.00 . A A . 10 CYS CB 1 1 14 8447 1 1 10 CYS H H -3.616 -3.012 -2.136 1.00 . A A . 10 CYS H 1 1 14 8448 1 1 10 CYS HA H -4.579 -4.303 0.312 1.00 . A A . 10 CYS HA 1 1 14 8449 1 1 10 CYS HB2 H -6.155 -2.554 -1.091 1.00 . A A . 10 CYS HB2 1 1 14 8450 1 1 10 CYS HB3 H -6.604 -4.098 -1.802 1.00 . A A . 10 CYS HB3 1 1 14 8451 1 1 10 CYS N N -3.804 -3.105 -1.180 1.00 . A A . 10 CYS N 1 1 14 8452 1 1 10 CYS O O -4.808 -5.500 -2.704 1.00 . A A . 10 CYS O 1 1 14 8453 1 1 10 CYS SG S -7.287 -3.943 0.475 1.00 . A A . 10 CYS SG 1 1 14 8454 1 1 11 ARG C C -4.499 -8.886 -0.626 1.00 . A A . 11 ARG C 1 1 14 8455 1 1 11 ARG CA C -3.844 -7.755 -1.420 1.00 . A A . 11 ARG CA 1 1 14 8456 1 1 11 ARG CB C -2.341 -8.013 -1.545 1.00 . A A . 11 ARG CB 1 1 14 8457 1 1 11 ARG CD C -2.175 -8.159 -4.048 1.00 . A A . 11 ARG CD 1 1 14 8458 1 1 11 ARG CG C -1.972 -8.890 -2.731 1.00 . A A . 11 ARG CG 1 1 14 8459 1 1 11 ARG CZ C -1.627 -8.467 -6.431 1.00 . A A . 11 ARG CZ 1 1 14 8460 1 1 11 ARG H H -3.889 -6.335 0.152 1.00 . A A . 11 ARG H 1 1 14 8461 1 1 11 ARG HA H -4.276 -7.732 -2.409 1.00 . A A . 11 ARG HA 1 1 14 8462 1 1 11 ARG HB2 H -1.832 -7.067 -1.652 1.00 . A A . 11 ARG HB2 1 1 14 8463 1 1 11 ARG HB3 H -1.995 -8.498 -0.645 1.00 . A A . 11 ARG HB3 1 1 14 8464 1 1 11 ARG HD2 H -3.230 -7.973 -4.183 1.00 . A A . 11 ARG HD2 1 1 14 8465 1 1 11 ARG HD3 H -1.647 -7.218 -4.008 1.00 . A A . 11 ARG HD3 1 1 14 8466 1 1 11 ARG HE H -1.373 -9.847 -5.011 1.00 . A A . 11 ARG HE 1 1 14 8467 1 1 11 ARG HG2 H -0.934 -9.175 -2.646 1.00 . A A . 11 ARG HG2 1 1 14 8468 1 1 11 ARG HG3 H -2.592 -9.774 -2.720 1.00 . A A . 11 ARG HG3 1 1 14 8469 1 1 11 ARG HH11 H -2.386 -6.649 -5.974 1.00 . A A . 11 ARG HH11 1 1 14 8470 1 1 11 ARG HH12 H -1.992 -6.891 -7.643 1.00 . A A . 11 ARG HH12 1 1 14 8471 1 1 11 ARG HH21 H -0.854 -10.166 -7.206 1.00 . A A . 11 ARG HH21 1 1 14 8472 1 1 11 ARG HH22 H -1.123 -8.888 -8.343 1.00 . A A . 11 ARG HH22 1 1 14 8473 1 1 11 ARG N N -4.080 -6.454 -0.802 1.00 . A A . 11 ARG N 1 1 14 8474 1 1 11 ARG NE N -1.681 -8.933 -5.185 1.00 . A A . 11 ARG NE 1 1 14 8475 1 1 11 ARG NH1 N -2.035 -7.234 -6.705 1.00 . A A . 11 ARG NH1 1 1 14 8476 1 1 11 ARG NH2 N -1.163 -9.237 -7.406 1.00 . A A . 11 ARG NH2 1 1 14 8477 1 1 11 ARG O O -4.413 -10.051 -1.013 1.00 . A A . 11 ARG O 1 1 14 8478 1 1 12 GLN C C -7.099 -9.025 1.938 1.00 . A A . 12 GLN C 1 1 14 8479 1 1 12 GLN CA C -5.804 -9.552 1.318 1.00 . A A . 12 GLN CA 1 1 14 8480 1 1 12 GLN CB C -4.858 -10.009 2.425 1.00 . A A . 12 GLN CB 1 1 14 8481 1 1 12 GLN CD C -3.419 -12.019 2.945 1.00 . A A . 12 GLN CD 1 1 14 8482 1 1 12 GLN CG C -3.754 -10.934 1.940 1.00 . A A . 12 GLN CG 1 1 14 8483 1 1 12 GLN H H -5.186 -7.606 0.755 1.00 . A A . 12 GLN H 1 1 14 8484 1 1 12 GLN HA H -6.040 -10.397 0.689 1.00 . A A . 12 GLN HA 1 1 14 8485 1 1 12 GLN HB2 H -4.400 -9.137 2.869 1.00 . A A . 12 GLN HB2 1 1 14 8486 1 1 12 GLN HB3 H -5.429 -10.528 3.179 1.00 . A A . 12 GLN HB3 1 1 14 8487 1 1 12 GLN HE21 H -1.529 -11.405 3.016 1.00 . A A . 12 GLN HE21 1 1 14 8488 1 1 12 GLN HE22 H -1.917 -12.756 4.021 1.00 . A A . 12 GLN HE22 1 1 14 8489 1 1 12 GLN HG2 H -4.072 -11.403 1.021 1.00 . A A . 12 GLN HG2 1 1 14 8490 1 1 12 GLN HG3 H -2.865 -10.348 1.755 1.00 . A A . 12 GLN HG3 1 1 14 8491 1 1 12 GLN N N -5.150 -8.546 0.486 1.00 . A A . 12 GLN N 1 1 14 8492 1 1 12 GLN NE2 N -2.162 -12.064 3.370 1.00 . A A . 12 GLN NE2 1 1 14 8493 1 1 12 GLN O O -7.680 -9.670 2.810 1.00 . A A . 12 GLN O 1 1 14 8494 1 1 12 GLN OE1 O -4.280 -12.807 3.336 1.00 . A A . 12 GLN OE1 1 1 14 8495 1 1 13 CYS C C -8.595 -6.830 3.468 1.00 . A A . 13 CYS C 1 1 14 8496 1 1 13 CYS CA C -8.767 -7.252 2.010 1.00 . A A . 13 CYS CA 1 1 14 8497 1 1 13 CYS CB C -9.947 -8.222 1.874 1.00 . A A . 13 CYS CB 1 1 14 8498 1 1 13 CYS H H -7.043 -7.381 0.800 1.00 . A A . 13 CYS H 1 1 14 8499 1 1 13 CYS HA H -8.969 -6.374 1.419 1.00 . A A . 13 CYS HA 1 1 14 8500 1 1 13 CYS HB2 H -10.004 -8.564 0.852 1.00 . A A . 13 CYS HB2 1 1 14 8501 1 1 13 CYS HB3 H -9.781 -9.070 2.522 1.00 . A A . 13 CYS HB3 1 1 14 8502 1 1 13 CYS N N -7.546 -7.854 1.491 1.00 . A A . 13 CYS N 1 1 14 8503 1 1 13 CYS O O -9.575 -6.628 4.185 1.00 . A A . 13 CYS O 1 1 14 8504 1 1 13 CYS SG S -11.568 -7.504 2.306 1.00 . A A . 13 CYS SG 1 1 14 8505 1 1 14 LYS C C -5.790 -5.446 5.333 1.00 . A A . 14 LYS C 1 1 14 8506 1 1 14 LYS CA C -7.059 -6.279 5.272 1.00 . A A . 14 LYS CA 1 1 14 8507 1 1 14 LYS CB C -6.943 -7.498 6.188 1.00 . A A . 14 LYS CB 1 1 14 8508 1 1 14 LYS CD C -7.117 -8.424 8.518 1.00 . A A . 14 LYS CD 1 1 14 8509 1 1 14 LYS CE C -8.047 -9.584 8.199 1.00 . A A . 14 LYS CE 1 1 14 8510 1 1 14 LYS CG C -7.388 -7.230 7.617 1.00 . A A . 14 LYS CG 1 1 14 8511 1 1 14 LYS H H -6.600 -6.855 3.287 1.00 . A A . 14 LYS H 1 1 14 8512 1 1 14 LYS HA H -7.879 -5.664 5.600 1.00 . A A . 14 LYS HA 1 1 14 8513 1 1 14 LYS HB2 H -7.553 -8.295 5.788 1.00 . A A . 14 LYS HB2 1 1 14 8514 1 1 14 LYS HB3 H -5.913 -7.821 6.210 1.00 . A A . 14 LYS HB3 1 1 14 8515 1 1 14 LYS HD2 H -6.096 -8.745 8.377 1.00 . A A . 14 LYS HD2 1 1 14 8516 1 1 14 LYS HD3 H -7.265 -8.127 9.546 1.00 . A A . 14 LYS HD3 1 1 14 8517 1 1 14 LYS HE2 H -8.136 -9.673 7.127 1.00 . A A . 14 LYS HE2 1 1 14 8518 1 1 14 LYS HE3 H -7.620 -10.491 8.601 1.00 . A A . 14 LYS HE3 1 1 14 8519 1 1 14 LYS HG2 H -6.848 -6.376 7.997 1.00 . A A . 14 LYS HG2 1 1 14 8520 1 1 14 LYS HG3 H -8.447 -7.020 7.620 1.00 . A A . 14 LYS HG3 1 1 14 8521 1 1 14 LYS HZ1 H -9.624 -8.371 8.836 1.00 . A A . 14 LYS HZ1 1 1 14 8522 1 1 14 LYS HZ2 H -10.118 -9.854 8.191 1.00 . A A . 14 LYS HZ2 1 1 14 8523 1 1 14 LYS HZ3 H -9.442 -9.790 9.740 1.00 . A A . 14 LYS HZ3 1 1 14 8524 1 1 14 LYS N N -7.345 -6.689 3.902 1.00 . A A . 14 LYS N 1 1 14 8525 1 1 14 LYS NZ N -9.403 -9.386 8.782 1.00 . A A . 14 LYS NZ 1 1 14 8526 1 1 14 LYS O O -4.924 -5.662 6.180 1.00 . A A . 14 LYS O 1 1 14 8527 1 1 15 LEU C C -3.247 -4.312 4.244 1.00 . A A . 15 LEU C 1 1 14 8528 1 1 15 LEU CA C -4.576 -3.567 4.346 1.00 . A A . 15 LEU CA 1 1 14 8529 1 1 15 LEU CB C -4.555 -2.636 5.556 1.00 . A A . 15 LEU CB 1 1 14 8530 1 1 15 LEU CD1 C -5.776 -1.147 7.158 1.00 . A A . 15 LEU CD1 1 1 14 8531 1 1 15 LEU CD2 C -6.609 -1.411 4.811 1.00 . A A . 15 LEU CD2 1 1 14 8532 1 1 15 LEU CG C -5.921 -2.100 5.982 1.00 . A A . 15 LEU CG 1 1 14 8533 1 1 15 LEU H H -6.462 -4.370 3.808 1.00 . A A . 15 LEU H 1 1 14 8534 1 1 15 LEU HA H -4.700 -2.971 3.456 1.00 . A A . 15 LEU HA 1 1 14 8535 1 1 15 LEU HB2 H -4.124 -3.172 6.389 1.00 . A A . 15 LEU HB2 1 1 14 8536 1 1 15 LEU HB3 H -3.920 -1.795 5.323 1.00 . A A . 15 LEU HB3 1 1 14 8537 1 1 15 LEU HD11 H -4.783 -0.722 7.156 1.00 . A A . 15 LEU HD11 1 1 14 8538 1 1 15 LEU HD12 H -6.506 -0.356 7.072 1.00 . A A . 15 LEU HD12 1 1 14 8539 1 1 15 LEU HD13 H -5.936 -1.685 8.080 1.00 . A A . 15 LEU HD13 1 1 14 8540 1 1 15 LEU HD21 H -5.892 -1.243 4.020 1.00 . A A . 15 LEU HD21 1 1 14 8541 1 1 15 LEU HD22 H -7.408 -2.038 4.444 1.00 . A A . 15 LEU HD22 1 1 14 8542 1 1 15 LEU HD23 H -7.015 -0.465 5.136 1.00 . A A . 15 LEU HD23 1 1 14 8543 1 1 15 LEU HG H -6.543 -2.926 6.297 1.00 . A A . 15 LEU HG 1 1 14 8544 1 1 15 LEU N N -5.714 -4.481 4.431 1.00 . A A . 15 LEU N 1 1 14 8545 1 1 15 LEU O O -3.003 -5.283 4.959 1.00 . A A . 15 LEU O 1 1 14 8546 1 1 16 LYS C C -0.153 -4.085 4.336 1.00 . A A . 16 LYS C 1 1 14 8547 1 1 16 LYS CA C -1.071 -4.444 3.169 1.00 . A A . 16 LYS CA 1 1 14 8548 1 1 16 LYS CB C -0.450 -3.979 1.850 1.00 . A A . 16 LYS CB 1 1 14 8549 1 1 16 LYS CD C 0.707 -4.626 -0.285 1.00 . A A . 16 LYS CD 1 1 14 8550 1 1 16 LYS CE C -0.261 -5.131 -1.343 1.00 . A A . 16 LYS CE 1 1 14 8551 1 1 16 LYS CG C 0.295 -5.076 1.107 1.00 . A A . 16 LYS CG 1 1 14 8552 1 1 16 LYS H H -2.626 -3.053 2.820 1.00 . A A . 16 LYS H 1 1 14 8553 1 1 16 LYS HA H -1.201 -5.515 3.140 1.00 . A A . 16 LYS HA 1 1 14 8554 1 1 16 LYS HB2 H -1.235 -3.608 1.207 1.00 . A A . 16 LYS HB2 1 1 14 8555 1 1 16 LYS HB3 H 0.244 -3.177 2.054 1.00 . A A . 16 LYS HB3 1 1 14 8556 1 1 16 LYS HD2 H 0.725 -3.547 -0.313 1.00 . A A . 16 LYS HD2 1 1 14 8557 1 1 16 LYS HD3 H 1.693 -5.010 -0.499 1.00 . A A . 16 LYS HD3 1 1 14 8558 1 1 16 LYS HE2 H -0.048 -6.171 -1.541 1.00 . A A . 16 LYS HE2 1 1 14 8559 1 1 16 LYS HE3 H -1.269 -5.036 -0.965 1.00 . A A . 16 LYS HE3 1 1 14 8560 1 1 16 LYS HG2 H 1.180 -5.339 1.666 1.00 . A A . 16 LYS HG2 1 1 14 8561 1 1 16 LYS HG3 H -0.349 -5.940 1.021 1.00 . A A . 16 LYS HG3 1 1 14 8562 1 1 16 LYS HZ1 H 0.231 -3.412 -2.424 1.00 . A A . 16 LYS HZ1 1 1 14 8563 1 1 16 LYS HZ2 H 0.496 -4.853 -3.270 1.00 . A A . 16 LYS HZ2 1 1 14 8564 1 1 16 LYS HZ3 H -1.079 -4.271 -3.062 1.00 . A A . 16 LYS HZ3 1 1 14 8565 1 1 16 LYS N N -2.381 -3.837 3.355 1.00 . A A . 16 LYS N 1 1 14 8566 1 1 16 LYS NZ N -0.145 -4.363 -2.613 1.00 . A A . 16 LYS NZ 1 1 14 8567 1 1 16 LYS O O -0.166 -2.952 4.815 1.00 . A A . 16 LYS O 1 1 14 8568 1 1 17 PRO C C 2.469 -3.599 5.705 1.00 . A A . 17 PRO C 1 1 14 8569 1 1 17 PRO CA C 1.577 -4.815 5.931 1.00 . A A . 17 PRO CA 1 1 14 8570 1 1 17 PRO CB C 2.422 -6.098 5.986 1.00 . A A . 17 PRO CB 1 1 14 8571 1 1 17 PRO CD C 0.746 -6.421 4.311 1.00 . A A . 17 PRO CD 1 1 14 8572 1 1 17 PRO CG C 2.133 -6.827 4.716 1.00 . A A . 17 PRO CG 1 1 14 8573 1 1 17 PRO HA H 1.041 -4.695 6.861 1.00 . A A . 17 PRO HA 1 1 14 8574 1 1 17 PRO HB2 H 3.468 -5.837 6.059 1.00 . A A . 17 PRO HB2 1 1 14 8575 1 1 17 PRO HB3 H 2.134 -6.682 6.848 1.00 . A A . 17 PRO HB3 1 1 14 8576 1 1 17 PRO HD2 H 0.641 -6.450 3.236 1.00 . A A . 17 PRO HD2 1 1 14 8577 1 1 17 PRO HD3 H 0.011 -7.054 4.784 1.00 . A A . 17 PRO HD3 1 1 14 8578 1 1 17 PRO HG2 H 2.844 -6.539 3.956 1.00 . A A . 17 PRO HG2 1 1 14 8579 1 1 17 PRO HG3 H 2.176 -7.893 4.886 1.00 . A A . 17 PRO HG3 1 1 14 8580 1 1 17 PRO N N 0.657 -5.045 4.813 1.00 . A A . 17 PRO N 1 1 14 8581 1 1 17 PRO O O 3.203 -3.532 4.720 1.00 . A A . 17 PRO O 1 1 14 8582 1 1 18 ALA C C 4.646 -1.740 6.159 1.00 . A A . 18 ALA C 1 1 14 8583 1 1 18 ALA CA C 3.202 -1.421 6.533 1.00 . A A . 18 ALA CA 1 1 14 8584 1 1 18 ALA CB C 3.152 -0.656 7.847 1.00 . A A . 18 ALA CB 1 1 14 8585 1 1 18 ALA H H 1.794 -2.751 7.388 1.00 . A A . 18 ALA H 1 1 14 8586 1 1 18 ALA HA H 2.771 -0.797 5.764 1.00 . A A . 18 ALA HA 1 1 14 8587 1 1 18 ALA HB1 H 3.525 -1.283 8.643 1.00 . A A . 18 ALA HB1 1 1 14 8588 1 1 18 ALA HB2 H 3.764 0.231 7.770 1.00 . A A . 18 ALA HB2 1 1 14 8589 1 1 18 ALA HB3 H 2.132 -0.372 8.060 1.00 . A A . 18 ALA HB3 1 1 14 8590 1 1 18 ALA N N 2.399 -2.638 6.626 1.00 . A A . 18 ALA N 1 1 14 8591 1 1 18 ALA O O 5.073 -2.893 6.224 1.00 . A A . 18 ALA O 1 1 14 8592 1 1 19 GLY C C 6.904 -1.869 4.197 1.00 . A A . 19 GLY C 1 1 14 8593 1 1 19 GLY CA C 6.775 -0.921 5.374 1.00 . A A . 19 GLY CA 1 1 14 8594 1 1 19 GLY H H 5.000 0.181 5.721 1.00 . A A . 19 GLY H 1 1 14 8595 1 1 19 GLY HA2 H 7.317 -1.329 6.214 1.00 . A A . 19 GLY HA2 1 1 14 8596 1 1 19 GLY HA3 H 7.208 0.032 5.106 1.00 . A A . 19 GLY HA3 1 1 14 8597 1 1 19 GLY N N 5.392 -0.717 5.760 1.00 . A A . 19 GLY N 1 1 14 8598 1 1 19 GLY O O 7.964 -2.454 3.975 1.00 . A A . 19 GLY O 1 1 14 8599 1 1 20 THR C C 5.467 -2.111 1.021 1.00 . A A . 20 THR C 1 1 14 8600 1 1 20 THR CA C 5.807 -2.898 2.280 1.00 . A A . 20 THR CA 1 1 14 8601 1 1 20 THR CB C 4.796 -4.028 2.478 1.00 . A A . 20 THR CB 1 1 14 8602 1 1 20 THR CG2 C 4.755 -5.007 1.324 1.00 . A A . 20 THR CG2 1 1 14 8603 1 1 20 THR H H 5.006 -1.523 3.669 1.00 . A A . 20 THR H 1 1 14 8604 1 1 20 THR HA H 6.794 -3.322 2.172 1.00 . A A . 20 THR HA 1 1 14 8605 1 1 20 THR HB H 3.809 -3.599 2.582 1.00 . A A . 20 THR HB 1 1 14 8606 1 1 20 THR HG1 H 4.309 -4.793 4.214 1.00 . A A . 20 THR HG1 1 1 14 8607 1 1 20 THR HG21 H 5.014 -4.495 0.409 1.00 . A A . 20 THR HG21 1 1 14 8608 1 1 20 THR HG22 H 5.461 -5.804 1.504 1.00 . A A . 20 THR HG22 1 1 14 8609 1 1 20 THR HG23 H 3.760 -5.419 1.237 1.00 . A A . 20 THR HG23 1 1 14 8610 1 1 20 THR N N 5.820 -2.019 3.441 1.00 . A A . 20 THR N 1 1 14 8611 1 1 20 THR O O 4.458 -1.408 0.971 1.00 . A A . 20 THR O 1 1 14 8612 1 1 20 THR OG1 O 5.088 -4.762 3.654 1.00 . A A . 20 THR OG1 1 1 14 8613 1 1 21 THR C C 4.734 -1.820 -1.833 1.00 . A A . 21 THR C 1 1 14 8614 1 1 21 THR CA C 6.109 -1.516 -1.247 1.00 . A A . 21 THR CA 1 1 14 8615 1 1 21 THR CB C 7.201 -1.880 -2.255 1.00 . A A . 21 THR CB 1 1 14 8616 1 1 21 THR CG2 C 7.961 -0.674 -2.759 1.00 . A A . 21 THR CG2 1 1 14 8617 1 1 21 THR H H 7.108 -2.796 0.110 1.00 . A A . 21 THR H 1 1 14 8618 1 1 21 THR HA H 6.168 -0.458 -1.039 1.00 . A A . 21 THR HA 1 1 14 8619 1 1 21 THR HB H 6.748 -2.365 -3.107 1.00 . A A . 21 THR HB 1 1 14 8620 1 1 21 THR HG1 H 8.196 -3.567 -2.218 1.00 . A A . 21 THR HG1 1 1 14 8621 1 1 21 THR HG21 H 8.135 0.007 -1.939 1.00 . A A . 21 THR HG21 1 1 14 8622 1 1 21 THR HG22 H 8.907 -0.991 -3.172 1.00 . A A . 21 THR HG22 1 1 14 8623 1 1 21 THR HG23 H 7.381 -0.178 -3.523 1.00 . A A . 21 THR HG23 1 1 14 8624 1 1 21 THR N N 6.318 -2.225 0.009 1.00 . A A . 21 THR N 1 1 14 8625 1 1 21 THR O O 4.459 -2.947 -2.245 1.00 . A A . 21 THR O 1 1 14 8626 1 1 21 THR OG1 O 8.141 -2.772 -1.682 1.00 . A A . 21 THR OG1 1 1 14 8627 1 1 22 CYS C C 2.477 -0.490 -3.861 1.00 . A A . 22 CYS C 1 1 14 8628 1 1 22 CYS CA C 2.533 -0.962 -2.415 1.00 . A A . 22 CYS CA 1 1 14 8629 1 1 22 CYS CB C 1.515 -0.182 -1.579 1.00 . A A . 22 CYS CB 1 1 14 8630 1 1 22 CYS H H 4.157 0.071 -1.533 1.00 . A A . 22 CYS H 1 1 14 8631 1 1 22 CYS HA H 2.285 -2.012 -2.383 1.00 . A A . 22 CYS HA 1 1 14 8632 1 1 22 CYS HB2 H 0.563 -0.190 -2.089 1.00 . A A . 22 CYS HB2 1 1 14 8633 1 1 22 CYS HB3 H 1.406 -0.665 -0.619 1.00 . A A . 22 CYS HB3 1 1 14 8634 1 1 22 CYS N N 3.877 -0.804 -1.872 1.00 . A A . 22 CYS N 1 1 14 8635 1 1 22 CYS O O 1.438 -0.028 -4.331 1.00 . A A . 22 CYS O 1 1 14 8636 1 1 22 CYS SG S 1.962 1.561 -1.275 1.00 . A A . 22 CYS SG 1 1 14 8637 1 1 23 TRP C C 5.022 -0.465 -6.564 1.00 . A A . 23 TRP C 1 1 14 8638 1 1 23 TRP CA C 3.659 -0.174 -5.954 1.00 . A A . 23 TRP CA 1 1 14 8639 1 1 23 TRP CB C 3.358 1.322 -6.052 1.00 . A A . 23 TRP CB 1 1 14 8640 1 1 23 TRP CD1 C 1.929 0.835 -8.121 1.00 . A A . 23 TRP CD1 1 1 14 8641 1 1 23 TRP CD2 C 1.908 2.971 -7.465 1.00 . A A . 23 TRP CD2 1 1 14 8642 1 1 23 TRP CE2 C 1.089 2.844 -8.600 1.00 . A A . 23 TRP CE2 1 1 14 8643 1 1 23 TRP CE3 C 2.051 4.225 -6.873 1.00 . A A . 23 TRP CE3 1 1 14 8644 1 1 23 TRP CG C 2.434 1.676 -7.174 1.00 . A A . 23 TRP CG 1 1 14 8645 1 1 23 TRP CH2 C 0.573 5.145 -8.554 1.00 . A A . 23 TRP CH2 1 1 14 8646 1 1 23 TRP CZ2 C 0.415 3.926 -9.154 1.00 . A A . 23 TRP CZ2 1 1 14 8647 1 1 23 TRP CZ3 C 1.384 5.301 -7.424 1.00 . A A . 23 TRP CZ3 1 1 14 8648 1 1 23 TRP H H 4.399 -0.973 -4.139 1.00 . A A . 23 TRP H 1 1 14 8649 1 1 23 TRP HA H 2.911 -0.721 -6.499 1.00 . A A . 23 TRP HA 1 1 14 8650 1 1 23 TRP HB2 H 2.901 1.650 -5.131 1.00 . A A . 23 TRP HB2 1 1 14 8651 1 1 23 TRP HB3 H 4.284 1.859 -6.200 1.00 . A A . 23 TRP HB3 1 1 14 8652 1 1 23 TRP HD1 H 2.145 -0.219 -8.172 1.00 . A A . 23 TRP HD1 1 1 14 8653 1 1 23 TRP HE1 H 0.637 1.148 -9.747 1.00 . A A . 23 TRP HE1 1 1 14 8654 1 1 23 TRP HE3 H 2.672 4.360 -6.002 1.00 . A A . 23 TRP HE3 1 1 14 8655 1 1 23 TRP HH2 H 0.074 6.013 -8.954 1.00 . A A . 23 TRP HH2 1 1 14 8656 1 1 23 TRP HZ2 H -0.217 3.821 -10.021 1.00 . A A . 23 TRP HZ2 1 1 14 8657 1 1 23 TRP HZ3 H 1.484 6.281 -6.980 1.00 . A A . 23 TRP HZ3 1 1 14 8658 1 1 23 TRP N N 3.598 -0.601 -4.564 1.00 . A A . 23 TRP N 1 1 14 8659 1 1 23 TRP NE1 N 1.117 1.530 -8.983 1.00 . A A . 23 TRP NE1 1 1 14 8660 1 1 23 TRP O O 5.126 -1.122 -7.600 1.00 . A A . 23 TRP O 1 1 14 8661 1 1 24 LYS C C 7.546 0.169 -7.878 1.00 . A A . 24 LYS C 1 1 14 8662 1 1 24 LYS CA C 7.431 -0.139 -6.387 1.00 . A A . 24 LYS CA 1 1 14 8663 1 1 24 LYS CB C 7.912 -1.561 -6.095 1.00 . A A . 24 LYS CB 1 1 14 8664 1 1 24 LYS CD C 8.016 -3.945 -6.885 1.00 . A A . 24 LYS CD 1 1 14 8665 1 1 24 LYS CE C 7.607 -4.756 -5.666 1.00 . A A . 24 LYS CE 1 1 14 8666 1 1 24 LYS CG C 7.258 -2.629 -6.958 1.00 . A A . 24 LYS CG 1 1 14 8667 1 1 24 LYS H H 5.903 0.564 -5.106 1.00 . A A . 24 LYS H 1 1 14 8668 1 1 24 LYS HA H 8.056 0.556 -5.846 1.00 . A A . 24 LYS HA 1 1 14 8669 1 1 24 LYS HB2 H 8.978 -1.605 -6.253 1.00 . A A . 24 LYS HB2 1 1 14 8670 1 1 24 LYS HB3 H 7.703 -1.788 -5.060 1.00 . A A . 24 LYS HB3 1 1 14 8671 1 1 24 LYS HD2 H 7.805 -4.520 -7.775 1.00 . A A . 24 LYS HD2 1 1 14 8672 1 1 24 LYS HD3 H 9.074 -3.737 -6.830 1.00 . A A . 24 LYS HD3 1 1 14 8673 1 1 24 LYS HE2 H 7.898 -4.217 -4.777 1.00 . A A . 24 LYS HE2 1 1 14 8674 1 1 24 LYS HE3 H 6.534 -4.880 -5.676 1.00 . A A . 24 LYS HE3 1 1 14 8675 1 1 24 LYS HG2 H 6.247 -2.788 -6.613 1.00 . A A . 24 LYS HG2 1 1 14 8676 1 1 24 LYS HG3 H 7.241 -2.289 -7.983 1.00 . A A . 24 LYS HG3 1 1 14 8677 1 1 24 LYS HZ1 H 9.127 -6.081 -6.210 1.00 . A A . 24 LYS HZ1 1 1 14 8678 1 1 24 LYS HZ2 H 8.480 -6.374 -4.675 1.00 . A A . 24 LYS HZ2 1 1 14 8679 1 1 24 LYS HZ3 H 7.607 -6.808 -6.059 1.00 . A A . 24 LYS HZ3 1 1 14 8680 1 1 24 LYS N N 6.062 0.044 -5.918 1.00 . A A . 24 LYS N 1 1 14 8681 1 1 24 LYS NZ N 8.250 -6.099 -5.652 1.00 . A A . 24 LYS NZ 1 1 14 8682 1 1 24 LYS O O 8.391 -0.391 -8.576 1.00 . A A . 24 LYS O 1 1 14 8683 1 1 25 THR C C 8.046 2.052 -10.148 1.00 . A A . 25 THR C 1 1 14 8684 1 1 25 THR CA C 6.693 1.456 -9.763 1.00 . A A . 25 THR CA 1 1 14 8685 1 1 25 THR CB C 5.558 2.452 -10.043 1.00 . A A . 25 THR CB 1 1 14 8686 1 1 25 THR CG2 C 5.653 3.116 -11.400 1.00 . A A . 25 THR CG2 1 1 14 8687 1 1 25 THR H H 6.040 1.482 -7.750 1.00 . A A . 25 THR H 1 1 14 8688 1 1 25 THR HA H 6.529 0.564 -10.349 1.00 . A A . 25 THR HA 1 1 14 8689 1 1 25 THR HB H 5.575 3.229 -9.292 1.00 . A A . 25 THR HB 1 1 14 8690 1 1 25 THR HG1 H 4.308 1.030 -10.544 1.00 . A A . 25 THR HG1 1 1 14 8691 1 1 25 THR HG21 H 6.291 2.529 -12.044 1.00 . A A . 25 THR HG21 1 1 14 8692 1 1 25 THR HG22 H 4.668 3.187 -11.835 1.00 . A A . 25 THR HG22 1 1 14 8693 1 1 25 THR HG23 H 6.069 4.106 -11.286 1.00 . A A . 25 THR HG23 1 1 14 8694 1 1 25 THR N N 6.689 1.068 -8.357 1.00 . A A . 25 THR N 1 1 14 8695 1 1 25 THR O O 8.538 2.976 -9.499 1.00 . A A . 25 THR O 1 1 14 8696 1 1 25 THR OG1 O 4.301 1.803 -9.975 1.00 . A A . 25 THR OG1 1 1 14 8697 1 1 26 SER C C 9.986 3.485 -11.847 1.00 . A A . 26 SER C 1 1 14 8698 1 1 26 SER CA C 9.949 1.968 -11.679 1.00 . A A . 26 SER CA 1 1 14 8699 1 1 26 SER CB C 10.295 1.291 -13.006 1.00 . A A . 26 SER CB 1 1 14 8700 1 1 26 SER H H 8.204 0.768 -11.672 1.00 . A A . 26 SER H 1 1 14 8701 1 1 26 SER HA H 10.686 1.684 -10.943 1.00 . A A . 26 SER HA 1 1 14 8702 1 1 26 SER HB2 H 10.120 0.229 -12.923 1.00 . A A . 26 SER HB2 1 1 14 8703 1 1 26 SER HB3 H 9.671 1.699 -13.789 1.00 . A A . 26 SER HB3 1 1 14 8704 1 1 26 SER HG H 11.883 0.955 -14.102 1.00 . A A . 26 SER HG 1 1 14 8705 1 1 26 SER N N 8.646 1.507 -11.203 1.00 . A A . 26 SER N 1 1 14 8706 1 1 26 SER O O 11.051 4.098 -11.779 1.00 . A A . 26 SER O 1 1 14 8707 1 1 26 SER OG O 11.653 1.504 -13.349 1.00 . A A . 26 SER OG 1 1 14 8708 1 1 27 VAL C C 8.093 6.197 -11.030 1.00 . A A . 27 VAL C 1 1 14 8709 1 1 27 VAL CA C 8.734 5.531 -12.244 1.00 . A A . 27 VAL CA 1 1 14 8710 1 1 27 VAL CB C 7.928 5.891 -13.510 1.00 . A A . 27 VAL CB 1 1 14 8711 1 1 27 VAL CG1 C 6.481 5.437 -13.377 1.00 . A A . 27 VAL CG1 1 1 14 8712 1 1 27 VAL CG2 C 8.003 7.385 -13.786 1.00 . A A . 27 VAL CG2 1 1 14 8713 1 1 27 VAL H H 8.006 3.549 -12.111 1.00 . A A . 27 VAL H 1 1 14 8714 1 1 27 VAL HA H 9.738 5.913 -12.363 1.00 . A A . 27 VAL HA 1 1 14 8715 1 1 27 VAL HB H 8.367 5.371 -14.349 1.00 . A A . 27 VAL HB 1 1 14 8716 1 1 27 VAL HG11 H 6.081 5.780 -12.434 1.00 . A A . 27 VAL HG11 1 1 14 8717 1 1 27 VAL HG12 H 5.899 5.851 -14.187 1.00 . A A . 27 VAL HG12 1 1 14 8718 1 1 27 VAL HG13 H 6.437 4.359 -13.416 1.00 . A A . 27 VAL HG13 1 1 14 8719 1 1 27 VAL HG21 H 8.957 7.766 -13.451 1.00 . A A . 27 VAL HG21 1 1 14 8720 1 1 27 VAL HG22 H 7.898 7.561 -14.846 1.00 . A A . 27 VAL HG22 1 1 14 8721 1 1 27 VAL HG23 H 7.208 7.890 -13.256 1.00 . A A . 27 VAL HG23 1 1 14 8722 1 1 27 VAL N N 8.822 4.087 -12.067 1.00 . A A . 27 VAL N 1 1 14 8723 1 1 27 VAL O O 7.585 7.315 -11.119 1.00 . A A . 27 VAL O 1 1 14 8724 1 1 28 SER C C 8.003 5.259 -7.446 1.00 . A A . 28 SER C 1 1 14 8725 1 1 28 SER CA C 7.529 6.036 -8.672 1.00 . A A . 28 SER CA 1 1 14 8726 1 1 28 SER CB C 6.001 5.997 -8.765 1.00 . A A . 28 SER CB 1 1 14 8727 1 1 28 SER H H 8.528 4.616 -9.883 1.00 . A A . 28 SER H 1 1 14 8728 1 1 28 SER HA H 7.845 7.061 -8.573 1.00 . A A . 28 SER HA 1 1 14 8729 1 1 28 SER HB2 H 5.711 5.661 -9.749 1.00 . A A . 28 SER HB2 1 1 14 8730 1 1 28 SER HB3 H 5.612 5.314 -8.024 1.00 . A A . 28 SER HB3 1 1 14 8731 1 1 28 SER HG H 4.854 7.505 -9.262 1.00 . A A . 28 SER HG 1 1 14 8732 1 1 28 SER N N 8.114 5.504 -9.896 1.00 . A A . 28 SER N 1 1 14 8733 1 1 28 SER O O 8.854 5.728 -6.690 1.00 . A A . 28 SER O 1 1 14 8734 1 1 28 SER OG O 5.444 7.280 -8.539 1.00 . A A . 28 SER OG 1 1 14 8735 1 1 29 SER C C 7.359 3.851 -4.810 1.00 . A A . 29 SER C 1 1 14 8736 1 1 29 SER CA C 7.792 3.219 -6.127 1.00 . A A . 29 SER CA 1 1 14 8737 1 1 29 SER CB C 9.296 2.939 -6.108 1.00 . A A . 29 SER CB 1 1 14 8738 1 1 29 SER H H 6.770 3.761 -7.897 1.00 . A A . 29 SER H 1 1 14 8739 1 1 29 SER HA H 7.261 2.288 -6.249 1.00 . A A . 29 SER HA 1 1 14 8740 1 1 29 SER HB2 H 9.602 2.560 -7.072 1.00 . A A . 29 SER HB2 1 1 14 8741 1 1 29 SER HB3 H 9.828 3.856 -5.897 1.00 . A A . 29 SER HB3 1 1 14 8742 1 1 29 SER HG H 10.310 2.336 -4.544 1.00 . A A . 29 SER HG 1 1 14 8743 1 1 29 SER N N 7.441 4.072 -7.258 1.00 . A A . 29 SER N 1 1 14 8744 1 1 29 SER O O 7.855 4.908 -4.419 1.00 . A A . 29 SER O 1 1 14 8745 1 1 29 SER OG O 9.625 1.982 -5.116 1.00 . A A . 29 SER OG 1 1 14 8746 1 1 30 HIS C C 5.909 2.596 -1.806 1.00 . A A . 30 HIS C 1 1 14 8747 1 1 30 HIS CA C 5.889 3.690 -2.873 1.00 . A A . 30 HIS CA 1 1 14 8748 1 1 30 HIS CB C 4.463 4.198 -3.077 1.00 . A A . 30 HIS CB 1 1 14 8749 1 1 30 HIS CD2 C 4.774 5.153 -5.467 1.00 . A A . 30 HIS CD2 1 1 14 8750 1 1 30 HIS CE1 C 3.763 7.074 -5.179 1.00 . A A . 30 HIS CE1 1 1 14 8751 1 1 30 HIS CG C 4.344 5.197 -4.184 1.00 . A A . 30 HIS CG 1 1 14 8752 1 1 30 HIS H H 6.055 2.368 -4.513 1.00 . A A . 30 HIS H 1 1 14 8753 1 1 30 HIS HA H 6.512 4.509 -2.547 1.00 . A A . 30 HIS HA 1 1 14 8754 1 1 30 HIS HB2 H 3.824 3.361 -3.320 1.00 . A A . 30 HIS HB2 1 1 14 8755 1 1 30 HIS HB3 H 4.115 4.662 -2.167 1.00 . A A . 30 HIS HB3 1 1 14 8756 1 1 30 HIS HD1 H 3.295 6.746 -3.215 1.00 . A A . 30 HIS HD1 1 1 14 8757 1 1 30 HIS HD2 H 5.304 4.333 -5.938 1.00 . A A . 30 HIS HD2 1 1 14 8758 1 1 30 HIS HE1 H 3.350 8.055 -5.361 1.00 . A A . 30 HIS HE1 1 1 14 8759 1 1 30 HIS HE2 H 4.417 6.507 -7.027 1.00 . A A . 30 HIS HE2 1 1 14 8760 1 1 30 HIS N N 6.415 3.198 -4.139 1.00 . A A . 30 HIS N 1 1 14 8761 1 1 30 HIS ND1 N 3.715 6.415 -4.036 1.00 . A A . 30 HIS ND1 1 1 14 8762 1 1 30 HIS NE2 N 4.400 6.332 -6.064 1.00 . A A . 30 HIS NE2 1 1 14 8763 1 1 30 HIS O O 6.506 1.538 -2.000 1.00 . A A . 30 HIS O 1 1 14 8764 1 1 31 TYR C C 3.878 2.019 1.182 1.00 . A A . 31 TYR C 1 1 14 8765 1 1 31 TYR CA C 5.195 1.901 0.419 1.00 . A A . 31 TYR CA 1 1 14 8766 1 1 31 TYR CB C 6.370 2.118 1.374 1.00 . A A . 31 TYR CB 1 1 14 8767 1 1 31 TYR CD1 C 7.919 0.135 1.572 1.00 . A A . 31 TYR CD1 1 1 14 8768 1 1 31 TYR CD2 C 8.494 1.863 0.034 1.00 . A A . 31 TYR CD2 1 1 14 8769 1 1 31 TYR CE1 C 9.058 -0.563 1.220 1.00 . A A . 31 TYR CE1 1 1 14 8770 1 1 31 TYR CE2 C 9.635 1.171 -0.324 1.00 . A A . 31 TYR CE2 1 1 14 8771 1 1 31 TYR CG C 7.617 1.358 0.986 1.00 . A A . 31 TYR CG 1 1 14 8772 1 1 31 TYR CZ C 9.913 -0.041 0.272 1.00 . A A . 31 TYR CZ 1 1 14 8773 1 1 31 TYR H H 4.796 3.723 -0.582 1.00 . A A . 31 TYR H 1 1 14 8774 1 1 31 TYR HA H 5.264 0.910 -0.003 1.00 . A A . 31 TYR HA 1 1 14 8775 1 1 31 TYR HB2 H 6.616 3.169 1.397 1.00 . A A . 31 TYR HB2 1 1 14 8776 1 1 31 TYR HB3 H 6.082 1.800 2.366 1.00 . A A . 31 TYR HB3 1 1 14 8777 1 1 31 TYR HD1 H 7.247 -0.271 2.314 1.00 . A A . 31 TYR HD1 1 1 14 8778 1 1 31 TYR HD2 H 8.274 2.813 -0.431 1.00 . A A . 31 TYR HD2 1 1 14 8779 1 1 31 TYR HE1 H 9.275 -1.512 1.687 1.00 . A A . 31 TYR HE1 1 1 14 8780 1 1 31 TYR HE2 H 10.304 1.580 -1.066 1.00 . A A . 31 TYR HE2 1 1 14 8781 1 1 31 TYR HH H 10.928 -1.125 -0.949 1.00 . A A . 31 TYR HH 1 1 14 8782 1 1 31 TYR N N 5.252 2.861 -0.679 1.00 . A A . 31 TYR N 1 1 14 8783 1 1 31 TYR O O 3.329 3.111 1.326 1.00 . A A . 31 TYR O 1 1 14 8784 1 1 31 TYR OH O 11.049 -0.733 -0.081 1.00 . A A . 31 TYR OH 1 1 14 8785 1 1 32 CYS C C 2.378 1.210 3.887 1.00 . A A . 32 CYS C 1 1 14 8786 1 1 32 CYS CA C 2.129 0.866 2.423 1.00 . A A . 32 CYS CA 1 1 14 8787 1 1 32 CYS CB C 1.463 -0.509 2.314 1.00 . A A . 32 CYS CB 1 1 14 8788 1 1 32 CYS H H 3.860 0.048 1.530 1.00 . A A . 32 CYS H 1 1 14 8789 1 1 32 CYS HA H 1.473 1.610 1.997 1.00 . A A . 32 CYS HA 1 1 14 8790 1 1 32 CYS HB2 H 1.836 -1.011 1.433 1.00 . A A . 32 CYS HB2 1 1 14 8791 1 1 32 CYS HB3 H 1.716 -1.093 3.187 1.00 . A A . 32 CYS HB3 1 1 14 8792 1 1 32 CYS N N 3.377 0.887 1.673 1.00 . A A . 32 CYS N 1 1 14 8793 1 1 32 CYS O O 3.431 0.891 4.439 1.00 . A A . 32 CYS O 1 1 14 8794 1 1 32 CYS SG S -0.356 -0.454 2.190 1.00 . A A . 32 CYS SG 1 1 14 8795 1 1 33 THR C C 0.692 1.334 6.801 1.00 . A A . 33 THR C 1 1 14 8796 1 1 33 THR CA C 1.523 2.251 5.910 1.00 . A A . 33 THR CA 1 1 14 8797 1 1 33 THR CB C 1.078 3.704 6.098 1.00 . A A . 33 THR CB 1 1 14 8798 1 1 33 THR CG2 C 1.554 4.626 4.996 1.00 . A A . 33 THR CG2 1 1 14 8799 1 1 33 THR H H 0.590 2.090 4.018 1.00 . A A . 33 THR H 1 1 14 8800 1 1 33 THR HA H 2.561 2.163 6.192 1.00 . A A . 33 THR HA 1 1 14 8801 1 1 33 THR HB H 1.476 4.072 7.033 1.00 . A A . 33 THR HB 1 1 14 8802 1 1 33 THR HG1 H -0.705 3.526 5.307 1.00 . A A . 33 THR HG1 1 1 14 8803 1 1 33 THR HG21 H 2.633 4.615 4.958 1.00 . A A . 33 THR HG21 1 1 14 8804 1 1 33 THR HG22 H 1.157 4.290 4.049 1.00 . A A . 33 THR HG22 1 1 14 8805 1 1 33 THR HG23 H 1.211 5.631 5.194 1.00 . A A . 33 THR HG23 1 1 14 8806 1 1 33 THR N N 1.406 1.864 4.510 1.00 . A A . 33 THR N 1 1 14 8807 1 1 33 THR O O 0.416 1.660 7.956 1.00 . A A . 33 THR O 1 1 14 8808 1 1 33 THR OG1 O -0.335 3.792 6.152 1.00 . A A . 33 THR OG1 1 1 14 8809 1 1 34 GLY C C -1.670 -0.104 7.743 1.00 . A A . 34 GLY C 1 1 14 8810 1 1 34 GLY CA C -0.505 -0.762 7.024 1.00 . A A . 34 GLY CA 1 1 14 8811 1 1 34 GLY H H 0.543 -0.026 5.333 1.00 . A A . 34 GLY H 1 1 14 8812 1 1 34 GLY HA2 H 0.130 -1.241 7.755 1.00 . A A . 34 GLY HA2 1 1 14 8813 1 1 34 GLY HA3 H -0.892 -1.513 6.352 1.00 . A A . 34 GLY HA3 1 1 14 8814 1 1 34 GLY N N 0.293 0.184 6.260 1.00 . A A . 34 GLY N 1 1 14 8815 1 1 34 GLY O O -2.126 -0.595 8.776 1.00 . A A . 34 GLY O 1 1 14 8816 1 1 35 ARG C C -4.478 1.732 6.870 1.00 . A A . 35 ARG C 1 1 14 8817 1 1 35 ARG CA C -3.266 1.735 7.796 1.00 . A A . 35 ARG CA 1 1 14 8818 1 1 35 ARG CB C -2.855 3.174 8.111 1.00 . A A . 35 ARG CB 1 1 14 8819 1 1 35 ARG CD C -2.543 3.535 10.578 1.00 . A A . 35 ARG CD 1 1 14 8820 1 1 35 ARG CG C -3.472 3.717 9.389 1.00 . A A . 35 ARG CG 1 1 14 8821 1 1 35 ARG CZ C -1.440 1.654 11.727 1.00 . A A . 35 ARG CZ 1 1 14 8822 1 1 35 ARG H H -1.744 1.352 6.374 1.00 . A A . 35 ARG H 1 1 14 8823 1 1 35 ARG HA H -3.530 1.236 8.715 1.00 . A A . 35 ARG HA 1 1 14 8824 1 1 35 ARG HB2 H -1.780 3.216 8.210 1.00 . A A . 35 ARG HB2 1 1 14 8825 1 1 35 ARG HB3 H -3.157 3.811 7.292 1.00 . A A . 35 ARG HB3 1 1 14 8826 1 1 35 ARG HD2 H -1.564 3.907 10.314 1.00 . A A . 35 ARG HD2 1 1 14 8827 1 1 35 ARG HD3 H -2.930 4.102 11.412 1.00 . A A . 35 ARG HD3 1 1 14 8828 1 1 35 ARG HE H -3.118 1.515 10.656 1.00 . A A . 35 ARG HE 1 1 14 8829 1 1 35 ARG HG2 H -3.674 4.770 9.261 1.00 . A A . 35 ARG HG2 1 1 14 8830 1 1 35 ARG HG3 H -4.397 3.192 9.582 1.00 . A A . 35 ARG HG3 1 1 14 8831 1 1 35 ARG HH11 H -0.502 3.434 11.941 1.00 . A A . 35 ARG HH11 1 1 14 8832 1 1 35 ARG HH12 H 0.253 2.096 12.740 1.00 . A A . 35 ARG HH12 1 1 14 8833 1 1 35 ARG HH21 H -2.126 -0.246 11.706 1.00 . A A . 35 ARG HH21 1 1 14 8834 1 1 35 ARG HH22 H -0.668 0.006 12.606 1.00 . A A . 35 ARG HH22 1 1 14 8835 1 1 35 ARG N N -2.150 1.009 7.198 1.00 . A A . 35 ARG N 1 1 14 8836 1 1 35 ARG NE N -2.426 2.133 10.972 1.00 . A A . 35 ARG NE 1 1 14 8837 1 1 35 ARG NH1 N -0.485 2.461 12.172 1.00 . A A . 35 ARG NH1 1 1 14 8838 1 1 35 ARG NH2 N -1.409 0.366 12.039 1.00 . A A . 35 ARG NH2 1 1 14 8839 1 1 35 ARG O O -5.620 1.677 7.326 1.00 . A A . 35 ARG O 1 1 14 8840 1 1 36 SER C C -4.908 0.937 3.373 1.00 . A A . 36 SER C 1 1 14 8841 1 1 36 SER CA C -5.289 1.793 4.575 1.00 . A A . 36 SER CA 1 1 14 8842 1 1 36 SER CB C -5.591 3.223 4.123 1.00 . A A . 36 SER CB 1 1 14 8843 1 1 36 SER H H -3.290 1.833 5.267 1.00 . A A . 36 SER H 1 1 14 8844 1 1 36 SER HA H -6.172 1.375 5.034 1.00 . A A . 36 SER HA 1 1 14 8845 1 1 36 SER HB2 H -6.268 3.197 3.282 1.00 . A A . 36 SER HB2 1 1 14 8846 1 1 36 SER HB3 H -6.048 3.767 4.937 1.00 . A A . 36 SER HB3 1 1 14 8847 1 1 36 SER HG H -3.878 4.091 4.510 1.00 . A A . 36 SER HG 1 1 14 8848 1 1 36 SER N N -4.221 1.791 5.568 1.00 . A A . 36 SER N 1 1 14 8849 1 1 36 SER O O -3.774 0.470 3.268 1.00 . A A . 36 SER O 1 1 14 8850 1 1 36 SER OG O -4.406 3.896 3.733 1.00 . A A . 36 SER OG 1 1 14 8851 1 1 37 CYS C C -5.353 0.835 0.065 1.00 . A A . 37 CYS C 1 1 14 8852 1 1 37 CYS CA C -5.614 -0.061 1.274 1.00 . A A . 37 CYS CA 1 1 14 8853 1 1 37 CYS CB C -6.805 -0.981 1.002 1.00 . A A . 37 CYS CB 1 1 14 8854 1 1 37 CYS H H -6.742 1.137 2.601 1.00 . A A . 37 CYS H 1 1 14 8855 1 1 37 CYS HA H -4.738 -0.665 1.454 1.00 . A A . 37 CYS HA 1 1 14 8856 1 1 37 CYS HB2 H -7.711 -0.486 1.318 1.00 . A A . 37 CYS HB2 1 1 14 8857 1 1 37 CYS HB3 H -6.862 -1.181 -0.056 1.00 . A A . 37 CYS HB3 1 1 14 8858 1 1 37 CYS N N -5.858 0.737 2.467 1.00 . A A . 37 CYS N 1 1 14 8859 1 1 37 CYS O O -5.427 0.387 -1.079 1.00 . A A . 37 CYS O 1 1 14 8860 1 1 37 CYS SG S -6.720 -2.582 1.869 1.00 . A A . 37 CYS SG 1 1 14 8861 1 1 38 GLU C C -3.313 3.501 -0.719 1.00 . A A . 38 GLU C 1 1 14 8862 1 1 38 GLU CA C -4.776 3.063 -0.735 1.00 . A A . 38 GLU CA 1 1 14 8863 1 1 38 GLU CB C -5.686 4.284 -0.594 1.00 . A A . 38 GLU CB 1 1 14 8864 1 1 38 GLU CD C -5.115 5.795 -2.535 1.00 . A A . 38 GLU CD 1 1 14 8865 1 1 38 GLU CG C -6.141 4.861 -1.924 1.00 . A A . 38 GLU CG 1 1 14 8866 1 1 38 GLU H H -5.005 2.401 1.262 1.00 . A A . 38 GLU H 1 1 14 8867 1 1 38 GLU HA H -4.983 2.579 -1.678 1.00 . A A . 38 GLU HA 1 1 14 8868 1 1 38 GLU HB2 H -6.563 4.001 -0.030 1.00 . A A . 38 GLU HB2 1 1 14 8869 1 1 38 GLU HB3 H -5.155 5.054 -0.054 1.00 . A A . 38 GLU HB3 1 1 14 8870 1 1 38 GLU HG2 H -6.320 4.049 -2.612 1.00 . A A . 38 GLU HG2 1 1 14 8871 1 1 38 GLU HG3 H -7.058 5.410 -1.769 1.00 . A A . 38 GLU HG3 1 1 14 8872 1 1 38 GLU N N -5.048 2.103 0.329 1.00 . A A . 38 GLU N 1 1 14 8873 1 1 38 GLU O O -2.919 4.358 0.071 1.00 . A A . 38 GLU O 1 1 14 8874 1 1 38 GLU OE1 O -4.015 5.320 -2.887 1.00 . A A . 38 GLU OE1 1 1 14 8875 1 1 38 GLU OE2 O -5.411 7.002 -2.663 1.00 . A A . 38 GLU OE2 1 1 14 8876 1 1 39 CYS C C -0.892 4.738 -1.870 1.00 . A A . 39 CYS C 1 1 14 8877 1 1 39 CYS CA C -1.094 3.230 -1.702 1.00 . A A . 39 CYS CA 1 1 14 8878 1 1 39 CYS CB C -0.469 2.475 -2.880 1.00 . A A . 39 CYS CB 1 1 14 8879 1 1 39 CYS H H -2.893 2.234 -2.204 1.00 . A A . 39 CYS H 1 1 14 8880 1 1 39 CYS HA H -0.618 2.913 -0.788 1.00 . A A . 39 CYS HA 1 1 14 8881 1 1 39 CYS HB2 H -0.753 1.436 -2.821 1.00 . A A . 39 CYS HB2 1 1 14 8882 1 1 39 CYS HB3 H -0.846 2.892 -3.804 1.00 . A A . 39 CYS HB3 1 1 14 8883 1 1 39 CYS N N -2.515 2.907 -1.602 1.00 . A A . 39 CYS N 1 1 14 8884 1 1 39 CYS O O -1.437 5.343 -2.794 1.00 . A A . 39 CYS O 1 1 14 8885 1 1 39 CYS SG S 1.352 2.543 -2.947 1.00 . A A . 39 CYS SG 1 1 14 8886 1 1 40 PRO C C 0.832 7.235 -2.326 1.00 . A A . 40 PRO C 1 1 14 8887 1 1 40 PRO CA C 0.149 6.814 -1.030 1.00 . A A . 40 PRO CA 1 1 14 8888 1 1 40 PRO CB C 1.071 7.070 0.169 1.00 . A A . 40 PRO CB 1 1 14 8889 1 1 40 PRO CD C 0.577 4.735 0.164 1.00 . A A . 40 PRO CD 1 1 14 8890 1 1 40 PRO CG C 1.637 5.737 0.518 1.00 . A A . 40 PRO CG 1 1 14 8891 1 1 40 PRO HA H -0.764 7.380 -0.910 1.00 . A A . 40 PRO HA 1 1 14 8892 1 1 40 PRO HB2 H 1.846 7.767 -0.113 1.00 . A A . 40 PRO HB2 1 1 14 8893 1 1 40 PRO HB3 H 0.495 7.478 0.987 1.00 . A A . 40 PRO HB3 1 1 14 8894 1 1 40 PRO HD2 H 1.026 3.797 -0.129 1.00 . A A . 40 PRO HD2 1 1 14 8895 1 1 40 PRO HD3 H -0.100 4.591 0.992 1.00 . A A . 40 PRO HD3 1 1 14 8896 1 1 40 PRO HG2 H 2.532 5.556 -0.059 1.00 . A A . 40 PRO HG2 1 1 14 8897 1 1 40 PRO HG3 H 1.855 5.694 1.575 1.00 . A A . 40 PRO HG3 1 1 14 8898 1 1 40 PRO N N -0.110 5.370 -0.974 1.00 . A A . 40 PRO N 1 1 14 8899 1 1 40 PRO O O 1.299 6.395 -3.095 1.00 . A A . 40 PRO O 1 1 14 8900 1 1 41 SER C C 2.923 9.579 -3.468 1.00 . A A . 41 SER C 1 1 14 8901 1 1 41 SER CA C 1.511 9.080 -3.762 1.00 . A A . 41 SER CA 1 1 14 8902 1 1 41 SER CB C 0.665 10.218 -4.335 1.00 . A A . 41 SER CB 1 1 14 8903 1 1 41 SER H H 0.495 9.160 -1.907 1.00 . A A . 41 SER H 1 1 14 8904 1 1 41 SER HA H 1.568 8.284 -4.489 1.00 . A A . 41 SER HA 1 1 14 8905 1 1 41 SER HB2 H 0.490 10.957 -3.567 1.00 . A A . 41 SER HB2 1 1 14 8906 1 1 41 SER HB3 H 1.192 10.675 -5.160 1.00 . A A . 41 SER HB3 1 1 14 8907 1 1 41 SER HG H -1.118 10.480 -5.103 1.00 . A A . 41 SER HG 1 1 14 8908 1 1 41 SER N N 0.886 8.542 -2.559 1.00 . A A . 41 SER N 1 1 14 8909 1 1 41 SER O O 3.424 10.481 -4.139 1.00 . A A . 41 SER O 1 1 14 8910 1 1 41 SER OG O -0.585 9.740 -4.801 1.00 . A A . 41 SER OG 1 1 14 8911 1 1 42 TYR C C 5.782 8.133 -1.848 1.00 . A A . 42 TYR C 1 1 14 8912 1 1 42 TYR CA C 4.915 9.368 -2.087 1.00 . A A . 42 TYR CA 1 1 14 8913 1 1 42 TYR CB C 4.891 10.245 -0.832 1.00 . A A . 42 TYR CB 1 1 14 8914 1 1 42 TYR CD1 C 3.191 9.606 0.924 1.00 . A A . 42 TYR CD1 1 1 14 8915 1 1 42 TYR CD2 C 5.390 8.702 1.103 1.00 . A A . 42 TYR CD2 1 1 14 8916 1 1 42 TYR CE1 C 2.816 8.930 2.069 1.00 . A A . 42 TYR CE1 1 1 14 8917 1 1 42 TYR CE2 C 5.022 8.022 2.249 1.00 . A A . 42 TYR CE2 1 1 14 8918 1 1 42 TYR CG C 4.482 9.504 0.422 1.00 . A A . 42 TYR CG 1 1 14 8919 1 1 42 TYR CZ C 3.734 8.140 2.728 1.00 . A A . 42 TYR CZ 1 1 14 8920 1 1 42 TYR H H 3.111 8.270 -1.967 1.00 . A A . 42 TYR H 1 1 14 8921 1 1 42 TYR HA H 5.336 9.936 -2.903 1.00 . A A . 42 TYR HA 1 1 14 8922 1 1 42 TYR HB2 H 5.877 10.653 -0.668 1.00 . A A . 42 TYR HB2 1 1 14 8923 1 1 42 TYR HB3 H 4.192 11.055 -0.982 1.00 . A A . 42 TYR HB3 1 1 14 8924 1 1 42 TYR HD1 H 2.474 10.225 0.406 1.00 . A A . 42 TYR HD1 1 1 14 8925 1 1 42 TYR HD2 H 6.398 8.612 0.726 1.00 . A A . 42 TYR HD2 1 1 14 8926 1 1 42 TYR HE1 H 1.807 9.022 2.444 1.00 . A A . 42 TYR HE1 1 1 14 8927 1 1 42 TYR HE2 H 5.742 7.404 2.764 1.00 . A A . 42 TYR HE2 1 1 14 8928 1 1 42 TYR HH H 3.147 8.097 4.558 1.00 . A A . 42 TYR HH 1 1 14 8929 1 1 42 TYR N N 3.560 8.985 -2.464 1.00 . A A . 42 TYR N 1 1 14 8930 1 1 42 TYR O O 5.301 7.115 -1.352 1.00 . A A . 42 TYR O 1 1 14 8931 1 1 42 TYR OH O 3.364 7.465 3.868 1.00 . A A . 42 TYR OH 1 1 14 8932 1 1 43 PRO C C 8.391 6.881 -0.560 1.00 . A A . 43 PRO C 1 1 14 8933 1 1 43 PRO CA C 8.007 7.087 -2.021 1.00 . A A . 43 PRO CA 1 1 14 8934 1 1 43 PRO CB C 9.226 7.510 -2.841 1.00 . A A . 43 PRO CB 1 1 14 8935 1 1 43 PRO CD C 7.738 9.382 -2.800 1.00 . A A . 43 PRO CD 1 1 14 8936 1 1 43 PRO CG C 9.193 8.998 -2.816 1.00 . A A . 43 PRO CG 1 1 14 8937 1 1 43 PRO HA H 7.602 6.168 -2.419 1.00 . A A . 43 PRO HA 1 1 14 8938 1 1 43 PRO HB2 H 10.124 7.124 -2.381 1.00 . A A . 43 PRO HB2 1 1 14 8939 1 1 43 PRO HB3 H 9.136 7.129 -3.847 1.00 . A A . 43 PRO HB3 1 1 14 8940 1 1 43 PRO HD2 H 7.587 10.261 -2.191 1.00 . A A . 43 PRO HD2 1 1 14 8941 1 1 43 PRO HD3 H 7.382 9.552 -3.805 1.00 . A A . 43 PRO HD3 1 1 14 8942 1 1 43 PRO HG2 H 9.686 9.361 -1.927 1.00 . A A . 43 PRO HG2 1 1 14 8943 1 1 43 PRO HG3 H 9.674 9.390 -3.700 1.00 . A A . 43 PRO HG3 1 1 14 8944 1 1 43 PRO N N 7.078 8.206 -2.200 1.00 . A A . 43 PRO N 1 1 14 8945 1 1 43 PRO O O 8.443 7.832 0.219 1.00 . A A . 43 PRO O 1 1 14 8946 1 1 44 GLY C C 10.318 6.013 1.591 1.00 . A A . 44 GLY C 1 1 14 8947 1 1 44 GLY CA C 9.035 5.323 1.172 1.00 . A A . 44 GLY CA 1 1 14 8948 1 1 44 GLY H H 8.601 4.913 -0.859 1.00 . A A . 44 GLY H 1 1 14 8949 1 1 44 GLY HA2 H 9.167 4.255 1.265 1.00 . A A . 44 GLY HA2 1 1 14 8950 1 1 44 GLY HA3 H 8.239 5.635 1.832 1.00 . A A . 44 GLY HA3 1 1 14 8951 1 1 44 GLY N N 8.659 5.631 -0.195 1.00 . A A . 44 GLY N 1 1 14 8952 1 1 44 GLY O O 10.500 6.343 2.763 1.00 . A A . 44 GLY O 1 1 14 8953 1 1 45 ASN C C 12.314 8.400 0.972 1.00 . A A . 45 ASN C 1 1 14 8954 1 1 45 ASN CA C 12.484 6.886 0.906 1.00 . A A . 45 ASN CA 1 1 14 8955 1 1 45 ASN CB C 13.511 6.523 -0.169 1.00 . A A . 45 ASN CB 1 1 14 8956 1 1 45 ASN CG C 13.955 5.076 -0.080 1.00 . A A . 45 ASN CG 1 1 14 8957 1 1 45 ASN H H 11.009 5.945 -0.284 1.00 . A A . 45 ASN H 1 1 14 8958 1 1 45 ASN HA H 12.839 6.533 1.863 1.00 . A A . 45 ASN HA 1 1 14 8959 1 1 45 ASN HB2 H 13.076 6.687 -1.144 1.00 . A A . 45 ASN HB2 1 1 14 8960 1 1 45 ASN HB3 H 14.380 7.155 -0.056 1.00 . A A . 45 ASN HB3 1 1 14 8961 1 1 45 ASN HD21 H 15.477 5.589 1.092 1.00 . A A . 45 ASN HD21 1 1 14 8962 1 1 45 ASN HD22 H 15.343 3.905 0.730 1.00 . A A . 45 ASN HD22 1 1 14 8963 1 1 45 ASN N N 11.211 6.231 0.631 1.00 . A A . 45 ASN N 1 1 14 8964 1 1 45 ASN ND2 N 15.034 4.832 0.655 1.00 . A A . 45 ASN ND2 1 1 14 8965 1 1 45 ASN O O 12.554 9.106 -0.008 1.00 . A A . 45 ASN O 1 1 14 8966 1 1 45 ASN OD1 O 13.335 4.188 -0.664 1.00 . A A . 45 ASN OD1 1 1 14 8967 1 1 46 GLY C C 12.802 10.961 3.133 1.00 . A A . 46 GLY C 1 1 14 8968 1 1 46 GLY CA C 11.704 10.321 2.307 1.00 . A A . 46 GLY CA 1 1 14 8969 1 1 46 GLY H H 11.724 8.283 2.881 1.00 . A A . 46 GLY H 1 1 14 8970 1 1 46 GLY HA2 H 10.756 10.487 2.798 1.00 . A A . 46 GLY HA2 1 1 14 8971 1 1 46 GLY HA3 H 11.680 10.790 1.334 1.00 . A A . 46 GLY HA3 1 1 14 8972 1 1 46 GLY N N 11.899 8.893 2.134 1.00 . A A . 46 GLY N 1 1 14 8973 1 1 46 GLY O O 13.512 10.225 3.849 1.00 . A A . 46 GLY O 1 1 14 8974 1 1 46 GLY OXT O 12.953 12.199 3.062 1.00 . A A . 46 GLY OXT 1 1 15 8975 1 1 1 ALA C C -19.066 -6.275 5.755 1.00 . A A . 1 ALA C 1 1 15 8976 1 1 1 ALA CA C -20.283 -6.972 5.158 1.00 . A A . 1 ALA CA 1 1 15 8977 1 1 1 ALA CB C -20.190 -8.475 5.376 1.00 . A A . 1 ALA CB 1 1 15 8978 1 1 1 ALA H1 H -19.493 -6.852 3.263 1.00 . A A . 1 ALA H1 1 1 15 8979 1 1 1 ALA H2 H -21.148 -7.294 3.320 1.00 . A A . 1 ALA H2 1 1 15 8980 1 1 1 ALA H3 H -20.684 -5.669 3.618 1.00 . A A . 1 ALA H3 1 1 15 8981 1 1 1 ALA HA H -21.170 -6.616 5.661 1.00 . A A . 1 ALA HA 1 1 15 8982 1 1 1 ALA HB1 H -20.886 -8.978 4.720 1.00 . A A . 1 ALA HB1 1 1 15 8983 1 1 1 ALA HB2 H -20.431 -8.706 6.403 1.00 . A A . 1 ALA HB2 1 1 15 8984 1 1 1 ALA HB3 H -19.186 -8.809 5.159 1.00 . A A . 1 ALA HB3 1 1 15 8985 1 1 1 ALA N N -20.414 -6.669 3.709 1.00 . A A . 1 ALA N 1 1 15 8986 1 1 1 ALA O O -19.198 -5.378 6.588 1.00 . A A . 1 ALA O 1 1 15 8987 1 1 2 MET C C -16.094 -5.079 4.834 1.00 . A A . 2 MET C 1 1 15 8988 1 1 2 MET CA C -16.638 -6.110 5.818 1.00 . A A . 2 MET CA 1 1 15 8989 1 1 2 MET CB C -15.595 -7.203 6.057 1.00 . A A . 2 MET CB 1 1 15 8990 1 1 2 MET CE C -13.297 -9.327 7.336 1.00 . A A . 2 MET CE 1 1 15 8991 1 1 2 MET CG C -14.705 -6.941 7.260 1.00 . A A . 2 MET CG 1 1 15 8992 1 1 2 MET H H -17.839 -7.413 4.660 1.00 . A A . 2 MET H 1 1 15 8993 1 1 2 MET HA H -16.852 -5.618 6.755 1.00 . A A . 2 MET HA 1 1 15 8994 1 1 2 MET HB2 H -16.104 -8.143 6.210 1.00 . A A . 2 MET HB2 1 1 15 8995 1 1 2 MET HB3 H -14.967 -7.283 5.182 1.00 . A A . 2 MET HB3 1 1 15 8996 1 1 2 MET HE1 H -14.211 -9.640 6.854 1.00 . A A . 2 MET HE1 1 1 15 8997 1 1 2 MET HE2 H -12.467 -9.890 6.935 1.00 . A A . 2 MET HE2 1 1 15 8998 1 1 2 MET HE3 H -13.372 -9.505 8.399 1.00 . A A . 2 MET HE3 1 1 15 8999 1 1 2 MET HG2 H -14.647 -5.876 7.424 1.00 . A A . 2 MET HG2 1 1 15 9000 1 1 2 MET HG3 H -15.145 -7.414 8.126 1.00 . A A . 2 MET HG3 1 1 15 9001 1 1 2 MET N N -17.880 -6.694 5.325 1.00 . A A . 2 MET N 1 1 15 9002 1 1 2 MET O O -15.531 -4.060 5.235 1.00 . A A . 2 MET O 1 1 15 9003 1 1 2 MET SD S -13.033 -7.581 7.040 1.00 . A A . 2 MET SD 1 1 15 9004 1 1 3 ASP C C -14.282 -4.263 2.587 1.00 . A A . 3 ASP C 1 1 15 9005 1 1 3 ASP CA C -15.794 -4.445 2.503 1.00 . A A . 3 ASP CA 1 1 15 9006 1 1 3 ASP CB C -16.490 -3.088 2.622 1.00 . A A . 3 ASP CB 1 1 15 9007 1 1 3 ASP CG C -17.875 -3.093 2.005 1.00 . A A . 3 ASP CG 1 1 15 9008 1 1 3 ASP H H -16.724 -6.178 3.287 1.00 . A A . 3 ASP H 1 1 15 9009 1 1 3 ASP HA H -16.040 -4.883 1.547 1.00 . A A . 3 ASP HA 1 1 15 9010 1 1 3 ASP HB2 H -16.583 -2.828 3.666 1.00 . A A . 3 ASP HB2 1 1 15 9011 1 1 3 ASP HB3 H -15.895 -2.340 2.121 1.00 . A A . 3 ASP HB3 1 1 15 9012 1 1 3 ASP N N -16.267 -5.350 3.544 1.00 . A A . 3 ASP N 1 1 15 9013 1 1 3 ASP O O -13.781 -3.541 3.448 1.00 . A A . 3 ASP O 1 1 15 9014 1 1 3 ASP OD1 O -18.852 -3.346 2.740 1.00 . A A . 3 ASP OD1 1 1 15 9015 1 1 3 ASP OD2 O -17.982 -2.843 0.786 1.00 . A A . 3 ASP OD2 1 1 15 9016 1 1 4 CYS C C -11.652 -3.489 1.100 1.00 . A A . 4 CYS C 1 1 15 9017 1 1 4 CYS CA C -12.106 -4.832 1.657 1.00 . A A . 4 CYS CA 1 1 15 9018 1 1 4 CYS CB C -11.519 -5.964 0.814 1.00 . A A . 4 CYS CB 1 1 15 9019 1 1 4 CYS H H -14.019 -5.482 1.024 1.00 . A A . 4 CYS H 1 1 15 9020 1 1 4 CYS HA H -11.746 -4.929 2.671 1.00 . A A . 4 CYS HA 1 1 15 9021 1 1 4 CYS HB2 H -11.759 -5.792 -0.224 1.00 . A A . 4 CYS HB2 1 1 15 9022 1 1 4 CYS HB3 H -10.445 -5.969 0.933 1.00 . A A . 4 CYS HB3 1 1 15 9023 1 1 4 CYS N N -13.561 -4.922 1.686 1.00 . A A . 4 CYS N 1 1 15 9024 1 1 4 CYS O O -12.090 -3.069 0.029 1.00 . A A . 4 CYS O 1 1 15 9025 1 1 4 CYS SG S -12.135 -7.620 1.258 1.00 . A A . 4 CYS SG 1 1 15 9026 1 1 5 THR C C -9.340 -1.692 0.190 1.00 . A A . 5 THR C 1 1 15 9027 1 1 5 THR CA C -10.243 -1.531 1.409 1.00 . A A . 5 THR CA 1 1 15 9028 1 1 5 THR CB C -9.469 -0.878 2.554 1.00 . A A . 5 THR CB 1 1 15 9029 1 1 5 THR CG2 C -9.285 0.614 2.379 1.00 . A A . 5 THR CG2 1 1 15 9030 1 1 5 THR H H -10.452 -3.213 2.674 1.00 . A A . 5 THR H 1 1 15 9031 1 1 5 THR HA H -11.078 -0.900 1.146 1.00 . A A . 5 THR HA 1 1 15 9032 1 1 5 THR HB H -8.491 -1.330 2.614 1.00 . A A . 5 THR HB 1 1 15 9033 1 1 5 THR HG1 H -10.982 -0.642 3.776 1.00 . A A . 5 THR HG1 1 1 15 9034 1 1 5 THR HG21 H -10.251 1.086 2.274 1.00 . A A . 5 THR HG21 1 1 15 9035 1 1 5 THR HG22 H -8.779 1.018 3.243 1.00 . A A . 5 THR HG22 1 1 15 9036 1 1 5 THR HG23 H -8.694 0.802 1.495 1.00 . A A . 5 THR HG23 1 1 15 9037 1 1 5 THR N N -10.766 -2.823 1.832 1.00 . A A . 5 THR N 1 1 15 9038 1 1 5 THR O O -8.124 -1.541 0.282 1.00 . A A . 5 THR O 1 1 15 9039 1 1 5 THR OG1 O -10.131 -1.087 3.789 1.00 . A A . 5 THR OG1 1 1 15 9040 1 1 6 THR C C -8.221 -1.049 -2.436 1.00 . A A . 6 THR C 1 1 15 9041 1 1 6 THR CA C -9.195 -2.199 -2.191 1.00 . A A . 6 THR CA 1 1 15 9042 1 1 6 THR CB C -10.154 -2.332 -3.374 1.00 . A A . 6 THR CB 1 1 15 9043 1 1 6 THR CG2 C -10.547 -3.764 -3.666 1.00 . A A . 6 THR CG2 1 1 15 9044 1 1 6 THR H H -10.918 -2.120 -0.961 1.00 . A A . 6 THR H 1 1 15 9045 1 1 6 THR HA H -8.631 -3.114 -2.096 1.00 . A A . 6 THR HA 1 1 15 9046 1 1 6 THR HB H -9.677 -1.933 -4.258 1.00 . A A . 6 THR HB 1 1 15 9047 1 1 6 THR HG1 H -11.215 -0.685 -3.409 1.00 . A A . 6 THR HG1 1 1 15 9048 1 1 6 THR HG21 H -10.027 -4.425 -2.987 1.00 . A A . 6 THR HG21 1 1 15 9049 1 1 6 THR HG22 H -11.613 -3.879 -3.534 1.00 . A A . 6 THR HG22 1 1 15 9050 1 1 6 THR HG23 H -10.282 -4.010 -4.683 1.00 . A A . 6 THR HG23 1 1 15 9051 1 1 6 THR N N -9.944 -2.007 -0.952 1.00 . A A . 6 THR N 1 1 15 9052 1 1 6 THR O O -8.602 0.121 -2.401 1.00 . A A . 6 THR O 1 1 15 9053 1 1 6 THR OG1 O -11.343 -1.598 -3.141 1.00 . A A . 6 THR OG1 1 1 15 9054 1 1 7 GLY C C -4.566 -0.988 -3.117 1.00 . A A . 7 GLY C 1 1 15 9055 1 1 7 GLY CA C -5.947 -0.386 -2.932 1.00 . A A . 7 GLY CA 1 1 15 9056 1 1 7 GLY H H -6.718 -2.343 -2.699 1.00 . A A . 7 GLY H 1 1 15 9057 1 1 7 GLY HA2 H -5.921 0.297 -2.096 1.00 . A A . 7 GLY HA2 1 1 15 9058 1 1 7 GLY HA3 H -6.211 0.163 -3.824 1.00 . A A . 7 GLY HA3 1 1 15 9059 1 1 7 GLY N N -6.961 -1.394 -2.684 1.00 . A A . 7 GLY N 1 1 15 9060 1 1 7 GLY O O -4.320 -2.119 -2.699 1.00 . A A . 7 GLY O 1 1 15 9061 1 1 8 PRO C C -1.581 -1.171 -2.686 1.00 . A A . 8 PRO C 1 1 15 9062 1 1 8 PRO CA C -2.269 -0.731 -3.979 1.00 . A A . 8 PRO CA 1 1 15 9063 1 1 8 PRO CB C -1.548 0.479 -4.597 1.00 . A A . 8 PRO CB 1 1 15 9064 1 1 8 PRO CD C -3.836 1.105 -4.277 1.00 . A A . 8 PRO CD 1 1 15 9065 1 1 8 PRO CG C -2.439 1.650 -4.341 1.00 . A A . 8 PRO CG 1 1 15 9066 1 1 8 PRO HA H -2.259 -1.553 -4.681 1.00 . A A . 8 PRO HA 1 1 15 9067 1 1 8 PRO HB2 H -0.586 0.608 -4.123 1.00 . A A . 8 PRO HB2 1 1 15 9068 1 1 8 PRO HB3 H -1.411 0.317 -5.657 1.00 . A A . 8 PRO HB3 1 1 15 9069 1 1 8 PRO HD2 H -4.442 1.697 -3.607 1.00 . A A . 8 PRO HD2 1 1 15 9070 1 1 8 PRO HD3 H -4.276 1.072 -5.262 1.00 . A A . 8 PRO HD3 1 1 15 9071 1 1 8 PRO HG2 H -2.174 2.114 -3.404 1.00 . A A . 8 PRO HG2 1 1 15 9072 1 1 8 PRO HG3 H -2.351 2.360 -5.150 1.00 . A A . 8 PRO HG3 1 1 15 9073 1 1 8 PRO N N -3.634 -0.250 -3.745 1.00 . A A . 8 PRO N 1 1 15 9074 1 1 8 PRO O O -0.712 -2.042 -2.701 1.00 . A A . 8 PRO O 1 1 15 9075 1 1 9 CYS C C -2.321 -1.870 0.488 1.00 . A A . 9 CYS C 1 1 15 9076 1 1 9 CYS CA C -1.411 -0.898 -0.265 1.00 . A A . 9 CYS CA 1 1 15 9077 1 1 9 CYS CB C -1.196 0.383 0.551 1.00 . A A . 9 CYS CB 1 1 15 9078 1 1 9 CYS H H -2.683 0.116 -1.623 1.00 . A A . 9 CYS H 1 1 15 9079 1 1 9 CYS HA H -0.456 -1.374 -0.433 1.00 . A A . 9 CYS HA 1 1 15 9080 1 1 9 CYS HB2 H -0.504 1.019 0.023 1.00 . A A . 9 CYS HB2 1 1 15 9081 1 1 9 CYS HB3 H -2.140 0.898 0.650 1.00 . A A . 9 CYS HB3 1 1 15 9082 1 1 9 CYS N N -1.982 -0.567 -1.570 1.00 . A A . 9 CYS N 1 1 15 9083 1 1 9 CYS O O -2.424 -1.828 1.713 1.00 . A A . 9 CYS O 1 1 15 9084 1 1 9 CYS SG S -0.526 0.127 2.231 1.00 . A A . 9 CYS SG 1 1 15 9085 1 1 10 CYS C C -3.594 -5.128 -0.197 1.00 . A A . 10 CYS C 1 1 15 9086 1 1 10 CYS CA C -3.884 -3.728 0.335 1.00 . A A . 10 CYS CA 1 1 15 9087 1 1 10 CYS CB C -5.337 -3.352 0.041 1.00 . A A . 10 CYS CB 1 1 15 9088 1 1 10 CYS H H -2.862 -2.736 -1.231 1.00 . A A . 10 CYS H 1 1 15 9089 1 1 10 CYS HA H -3.728 -3.721 1.403 1.00 . A A . 10 CYS HA 1 1 15 9090 1 1 10 CYS HB2 H -5.386 -2.301 -0.194 1.00 . A A . 10 CYS HB2 1 1 15 9091 1 1 10 CYS HB3 H -5.683 -3.921 -0.809 1.00 . A A . 10 CYS HB3 1 1 15 9092 1 1 10 CYS N N -2.982 -2.748 -0.259 1.00 . A A . 10 CYS N 1 1 15 9093 1 1 10 CYS O O -3.275 -5.303 -1.373 1.00 . A A . 10 CYS O 1 1 15 9094 1 1 10 CYS SG S -6.484 -3.664 1.422 1.00 . A A . 10 CYS SG 1 1 15 9095 1 1 11 ARG C C -4.783 -8.214 -0.028 1.00 . A A . 11 ARG C 1 1 15 9096 1 1 11 ARG CA C -3.470 -7.508 0.294 1.00 . A A . 11 ARG CA 1 1 15 9097 1 1 11 ARG CB C -2.738 -8.248 1.415 1.00 . A A . 11 ARG CB 1 1 15 9098 1 1 11 ARG CD C -0.746 -9.695 1.919 1.00 . A A . 11 ARG CD 1 1 15 9099 1 1 11 ARG CG C -1.845 -9.374 0.920 1.00 . A A . 11 ARG CG 1 1 15 9100 1 1 11 ARG CZ C 0.977 -11.433 2.209 1.00 . A A . 11 ARG CZ 1 1 15 9101 1 1 11 ARG H H -3.975 -5.920 1.599 1.00 . A A . 11 ARG H 1 1 15 9102 1 1 11 ARG HA H -2.850 -7.505 -0.590 1.00 . A A . 11 ARG HA 1 1 15 9103 1 1 11 ARG HB2 H -2.124 -7.542 1.955 1.00 . A A . 11 ARG HB2 1 1 15 9104 1 1 11 ARG HB3 H -3.468 -8.667 2.091 1.00 . A A . 11 ARG HB3 1 1 15 9105 1 1 11 ARG HD2 H -0.174 -8.798 2.105 1.00 . A A . 11 ARG HD2 1 1 15 9106 1 1 11 ARG HD3 H -1.201 -10.029 2.840 1.00 . A A . 11 ARG HD3 1 1 15 9107 1 1 11 ARG HE H 0.143 -10.927 0.467 1.00 . A A . 11 ARG HE 1 1 15 9108 1 1 11 ARG HG2 H -2.448 -10.257 0.767 1.00 . A A . 11 ARG HG2 1 1 15 9109 1 1 11 ARG HG3 H -1.394 -9.077 -0.016 1.00 . A A . 11 ARG HG3 1 1 15 9110 1 1 11 ARG HH11 H 0.429 -10.502 3.919 1.00 . A A . 11 ARG HH11 1 1 15 9111 1 1 11 ARG HH12 H 1.639 -11.728 4.096 1.00 . A A . 11 ARG HH12 1 1 15 9112 1 1 11 ARG HH21 H 1.734 -12.541 0.698 1.00 . A A . 11 ARG HH21 1 1 15 9113 1 1 11 ARG HH22 H 2.380 -12.886 2.267 1.00 . A A . 11 ARG HH22 1 1 15 9114 1 1 11 ARG N N -3.713 -6.122 0.676 1.00 . A A . 11 ARG N 1 1 15 9115 1 1 11 ARG NE N 0.153 -10.736 1.428 1.00 . A A . 11 ARG NE 1 1 15 9116 1 1 11 ARG NH1 N 1.018 -11.202 3.515 1.00 . A A . 11 ARG NH1 1 1 15 9117 1 1 11 ARG NH2 N 1.761 -12.363 1.681 1.00 . A A . 11 ARG NH2 1 1 15 9118 1 1 11 ARG O O -4.999 -9.357 0.375 1.00 . A A . 11 ARG O 1 1 15 9119 1 1 12 GLN C C -8.013 -7.816 -0.055 1.00 . A A . 12 GLN C 1 1 15 9120 1 1 12 GLN CA C -6.968 -8.048 -1.146 1.00 . A A . 12 GLN CA 1 1 15 9121 1 1 12 GLN CB C -6.884 -9.542 -1.481 1.00 . A A . 12 GLN CB 1 1 15 9122 1 1 12 GLN CD C -4.905 -11.091 -1.750 1.00 . A A . 12 GLN CD 1 1 15 9123 1 1 12 GLN CG C -5.672 -9.914 -2.321 1.00 . A A . 12 GLN CG 1 1 15 9124 1 1 12 GLN H H -5.417 -6.608 -1.036 1.00 . A A . 12 GLN H 1 1 15 9125 1 1 12 GLN HA H -7.279 -7.514 -2.032 1.00 . A A . 12 GLN HA 1 1 15 9126 1 1 12 GLN HB2 H -6.845 -10.104 -0.560 1.00 . A A . 12 GLN HB2 1 1 15 9127 1 1 12 GLN HB3 H -7.773 -9.826 -2.026 1.00 . A A . 12 GLN HB3 1 1 15 9128 1 1 12 GLN HE21 H -3.183 -10.279 -2.326 1.00 . A A . 12 GLN HE21 1 1 15 9129 1 1 12 GLN HE22 H -3.063 -11.802 -1.518 1.00 . A A . 12 GLN HE22 1 1 15 9130 1 1 12 GLN HG2 H -6.005 -10.170 -3.316 1.00 . A A . 12 GLN HG2 1 1 15 9131 1 1 12 GLN HG3 H -5.010 -9.062 -2.372 1.00 . A A . 12 GLN HG3 1 1 15 9132 1 1 12 GLN N N -5.658 -7.515 -0.755 1.00 . A A . 12 GLN N 1 1 15 9133 1 1 12 GLN NE2 N -3.584 -11.053 -1.877 1.00 . A A . 12 GLN NE2 1 1 15 9134 1 1 12 GLN O O -9.209 -7.742 -0.341 1.00 . A A . 12 GLN O 1 1 15 9135 1 1 12 GLN OE1 O -5.493 -12.023 -1.202 1.00 . A A . 12 GLN OE1 1 1 15 9136 1 1 13 CYS C C -7.696 -7.388 3.630 1.00 . A A . 13 CYS C 1 1 15 9137 1 1 13 CYS CA C -8.466 -7.477 2.315 1.00 . A A . 13 CYS CA 1 1 15 9138 1 1 13 CYS CB C -9.501 -8.602 2.397 1.00 . A A . 13 CYS CB 1 1 15 9139 1 1 13 CYS H H -6.604 -7.766 1.361 1.00 . A A . 13 CYS H 1 1 15 9140 1 1 13 CYS HA H -8.977 -6.541 2.147 1.00 . A A . 13 CYS HA 1 1 15 9141 1 1 13 CYS HB2 H -9.625 -9.040 1.419 1.00 . A A . 13 CYS HB2 1 1 15 9142 1 1 13 CYS HB3 H -9.145 -9.358 3.082 1.00 . A A . 13 CYS HB3 1 1 15 9143 1 1 13 CYS N N -7.562 -7.701 1.192 1.00 . A A . 13 CYS N 1 1 15 9144 1 1 13 CYS O O -8.178 -7.835 4.671 1.00 . A A . 13 CYS O 1 1 15 9145 1 1 13 CYS SG S -11.143 -8.061 2.973 1.00 . A A . 13 CYS SG 1 1 15 9146 1 1 14 LYS C C -4.636 -5.569 4.589 1.00 . A A . 14 LYS C 1 1 15 9147 1 1 14 LYS CA C -5.675 -6.668 4.774 1.00 . A A . 14 LYS CA 1 1 15 9148 1 1 14 LYS CB C -4.981 -7.992 5.100 1.00 . A A . 14 LYS CB 1 1 15 9149 1 1 14 LYS CD C -3.638 -9.211 6.840 1.00 . A A . 14 LYS CD 1 1 15 9150 1 1 14 LYS CE C -4.178 -10.627 6.963 1.00 . A A . 14 LYS CE 1 1 15 9151 1 1 14 LYS CG C -4.754 -8.210 6.587 1.00 . A A . 14 LYS CG 1 1 15 9152 1 1 14 LYS H H -6.161 -6.469 2.726 1.00 . A A . 14 LYS H 1 1 15 9153 1 1 14 LYS HA H -6.323 -6.400 5.595 1.00 . A A . 14 LYS HA 1 1 15 9154 1 1 14 LYS HB2 H -5.587 -8.804 4.728 1.00 . A A . 14 LYS HB2 1 1 15 9155 1 1 14 LYS HB3 H -4.022 -8.014 4.605 1.00 . A A . 14 LYS HB3 1 1 15 9156 1 1 14 LYS HD2 H -2.941 -9.173 6.017 1.00 . A A . 14 LYS HD2 1 1 15 9157 1 1 14 LYS HD3 H -3.132 -8.947 7.757 1.00 . A A . 14 LYS HD3 1 1 15 9158 1 1 14 LYS HE2 H -4.974 -10.759 6.246 1.00 . A A . 14 LYS HE2 1 1 15 9159 1 1 14 LYS HE3 H -3.380 -11.322 6.747 1.00 . A A . 14 LYS HE3 1 1 15 9160 1 1 14 LYS HG2 H -4.489 -7.268 7.043 1.00 . A A . 14 LYS HG2 1 1 15 9161 1 1 14 LYS HG3 H -5.667 -8.582 7.030 1.00 . A A . 14 LYS HG3 1 1 15 9162 1 1 14 LYS HZ1 H -4.252 -10.274 9.021 1.00 . A A . 14 LYS HZ1 1 1 15 9163 1 1 14 LYS HZ2 H -5.734 -10.745 8.352 1.00 . A A . 14 LYS HZ2 1 1 15 9164 1 1 14 LYS HZ3 H -4.512 -11.890 8.593 1.00 . A A . 14 LYS HZ3 1 1 15 9165 1 1 14 LYS N N -6.498 -6.809 3.581 1.00 . A A . 14 LYS N 1 1 15 9166 1 1 14 LYS NZ N -4.706 -10.903 8.328 1.00 . A A . 14 LYS NZ 1 1 15 9167 1 1 14 LYS O O -3.742 -5.681 3.750 1.00 . A A . 14 LYS O 1 1 15 9168 1 1 15 LEU C C -2.387 -3.872 5.286 1.00 . A A . 15 LEU C 1 1 15 9169 1 1 15 LEU CA C -3.830 -3.383 5.309 1.00 . A A . 15 LEU CA 1 1 15 9170 1 1 15 LEU CB C -4.045 -2.445 6.498 1.00 . A A . 15 LEU CB 1 1 15 9171 1 1 15 LEU CD1 C -3.831 -0.174 7.534 1.00 . A A . 15 LEU CD1 1 1 15 9172 1 1 15 LEU CD2 C -2.105 -0.969 5.907 1.00 . A A . 15 LEU CD2 1 1 15 9173 1 1 15 LEU CG C -3.579 -1.004 6.285 1.00 . A A . 15 LEU CG 1 1 15 9174 1 1 15 LEU H H -5.492 -4.478 6.029 1.00 . A A . 15 LEU H 1 1 15 9175 1 1 15 LEU HA H -4.027 -2.844 4.397 1.00 . A A . 15 LEU HA 1 1 15 9176 1 1 15 LEU HB2 H -5.100 -2.429 6.727 1.00 . A A . 15 LEU HB2 1 1 15 9177 1 1 15 LEU HB3 H -3.515 -2.848 7.347 1.00 . A A . 15 LEU HB3 1 1 15 9178 1 1 15 LEU HD11 H -3.919 -0.828 8.390 1.00 . A A . 15 LEU HD11 1 1 15 9179 1 1 15 LEU HD12 H -3.008 0.508 7.687 1.00 . A A . 15 LEU HD12 1 1 15 9180 1 1 15 LEU HD13 H -4.746 0.387 7.415 1.00 . A A . 15 LEU HD13 1 1 15 9181 1 1 15 LEU HD21 H -1.589 -1.781 6.399 1.00 . A A . 15 LEU HD21 1 1 15 9182 1 1 15 LEU HD22 H -2.005 -1.075 4.837 1.00 . A A . 15 LEU HD22 1 1 15 9183 1 1 15 LEU HD23 H -1.676 -0.029 6.218 1.00 . A A . 15 LEU HD23 1 1 15 9184 1 1 15 LEU HG H -4.144 -0.566 5.474 1.00 . A A . 15 LEU HG 1 1 15 9185 1 1 15 LEU N N -4.759 -4.506 5.380 1.00 . A A . 15 LEU N 1 1 15 9186 1 1 15 LEU O O -1.849 -4.301 6.307 1.00 . A A . 15 LEU O 1 1 15 9187 1 1 16 LYS C C 0.505 -3.650 5.047 1.00 . A A . 16 LYS C 1 1 15 9188 1 1 16 LYS CA C -0.385 -4.248 3.956 1.00 . A A . 16 LYS CA 1 1 15 9189 1 1 16 LYS CB C 0.143 -3.856 2.574 1.00 . A A . 16 LYS CB 1 1 15 9190 1 1 16 LYS CD C 0.595 -4.538 0.198 1.00 . A A . 16 LYS CD 1 1 15 9191 1 1 16 LYS CE C 1.076 -5.716 -0.633 1.00 . A A . 16 LYS CE 1 1 15 9192 1 1 16 LYS CG C 0.088 -4.986 1.559 1.00 . A A . 16 LYS CG 1 1 15 9193 1 1 16 LYS H H -2.248 -3.458 3.334 1.00 . A A . 16 LYS H 1 1 15 9194 1 1 16 LYS HA H -0.375 -5.324 4.043 1.00 . A A . 16 LYS HA 1 1 15 9195 1 1 16 LYS HB2 H -0.446 -3.033 2.196 1.00 . A A . 16 LYS HB2 1 1 15 9196 1 1 16 LYS HB3 H 1.171 -3.537 2.670 1.00 . A A . 16 LYS HB3 1 1 15 9197 1 1 16 LYS HD2 H -0.207 -4.043 -0.329 1.00 . A A . 16 LYS HD2 1 1 15 9198 1 1 16 LYS HD3 H 1.415 -3.849 0.339 1.00 . A A . 16 LYS HD3 1 1 15 9199 1 1 16 LYS HE2 H 1.449 -6.481 0.032 1.00 . A A . 16 LYS HE2 1 1 15 9200 1 1 16 LYS HE3 H 0.243 -6.106 -1.198 1.00 . A A . 16 LYS HE3 1 1 15 9201 1 1 16 LYS HG2 H 0.702 -5.802 1.909 1.00 . A A . 16 LYS HG2 1 1 15 9202 1 1 16 LYS HG3 H -0.935 -5.319 1.461 1.00 . A A . 16 LYS HG3 1 1 15 9203 1 1 16 LYS HZ1 H 2.854 -4.720 -1.092 1.00 . A A . 16 LYS HZ1 1 1 15 9204 1 1 16 LYS HZ2 H 2.646 -6.173 -1.933 1.00 . A A . 16 LYS HZ2 1 1 15 9205 1 1 16 LYS HZ3 H 1.762 -4.801 -2.381 1.00 . A A . 16 LYS HZ3 1 1 15 9206 1 1 16 LYS N N -1.765 -3.807 4.113 1.00 . A A . 16 LYS N 1 1 15 9207 1 1 16 LYS NZ N 2.160 -5.325 -1.576 1.00 . A A . 16 LYS NZ 1 1 15 9208 1 1 16 LYS O O 0.319 -2.500 5.447 1.00 . A A . 16 LYS O 1 1 15 9209 1 1 17 PRO C C 3.270 -2.798 6.142 1.00 . A A . 17 PRO C 1 1 15 9210 1 1 17 PRO CA C 2.394 -3.959 6.600 1.00 . A A . 17 PRO CA 1 1 15 9211 1 1 17 PRO CB C 3.256 -5.189 6.903 1.00 . A A . 17 PRO CB 1 1 15 9212 1 1 17 PRO CD C 1.776 -5.807 5.134 1.00 . A A . 17 PRO CD 1 1 15 9213 1 1 17 PRO CG C 3.152 -6.043 5.686 1.00 . A A . 17 PRO CG 1 1 15 9214 1 1 17 PRO HA H 1.853 -3.669 7.489 1.00 . A A . 17 PRO HA 1 1 15 9215 1 1 17 PRO HB2 H 4.276 -4.881 7.083 1.00 . A A . 17 PRO HB2 1 1 15 9216 1 1 17 PRO HB3 H 2.870 -5.697 7.774 1.00 . A A . 17 PRO HB3 1 1 15 9217 1 1 17 PRO HD2 H 1.780 -5.895 4.057 1.00 . A A . 17 PRO HD2 1 1 15 9218 1 1 17 PRO HD3 H 1.070 -6.497 5.569 1.00 . A A . 17 PRO HD3 1 1 15 9219 1 1 17 PRO HG2 H 3.902 -5.749 4.966 1.00 . A A . 17 PRO HG2 1 1 15 9220 1 1 17 PRO HG3 H 3.275 -7.082 5.954 1.00 . A A . 17 PRO HG3 1 1 15 9221 1 1 17 PRO N N 1.483 -4.423 5.548 1.00 . A A . 17 PRO N 1 1 15 9222 1 1 17 PRO O O 3.841 -2.831 5.052 1.00 . A A . 17 PRO O 1 1 15 9223 1 1 18 ALA C C 5.600 -1.013 6.262 1.00 . A A . 18 ALA C 1 1 15 9224 1 1 18 ALA CA C 4.189 -0.604 6.672 1.00 . A A . 18 ALA CA 1 1 15 9225 1 1 18 ALA CB C 4.236 0.341 7.863 1.00 . A A . 18 ALA CB 1 1 15 9226 1 1 18 ALA H H 2.900 -1.808 7.841 1.00 . A A . 18 ALA H 1 1 15 9227 1 1 18 ALA HA H 3.721 -0.083 5.848 1.00 . A A . 18 ALA HA 1 1 15 9228 1 1 18 ALA HB1 H 4.983 1.102 7.690 1.00 . A A . 18 ALA HB1 1 1 15 9229 1 1 18 ALA HB2 H 3.270 0.806 7.993 1.00 . A A . 18 ALA HB2 1 1 15 9230 1 1 18 ALA HB3 H 4.489 -0.216 8.754 1.00 . A A . 18 ALA HB3 1 1 15 9231 1 1 18 ALA N N 3.377 -1.774 6.986 1.00 . A A . 18 ALA N 1 1 15 9232 1 1 18 ALA O O 6.006 -2.158 6.463 1.00 . A A . 18 ALA O 1 1 15 9233 1 1 19 GLY C C 7.736 -1.396 4.131 1.00 . A A . 19 GLY C 1 1 15 9234 1 1 19 GLY CA C 7.694 -0.369 5.249 1.00 . A A . 19 GLY CA 1 1 15 9235 1 1 19 GLY H H 5.965 0.818 5.541 1.00 . A A . 19 GLY H 1 1 15 9236 1 1 19 GLY HA2 H 8.256 -0.746 6.090 1.00 . A A . 19 GLY HA2 1 1 15 9237 1 1 19 GLY HA3 H 8.155 0.544 4.901 1.00 . A A . 19 GLY HA3 1 1 15 9238 1 1 19 GLY N N 6.341 -0.076 5.681 1.00 . A A . 19 GLY N 1 1 15 9239 1 1 19 GLY O O 8.793 -1.949 3.828 1.00 . A A . 19 GLY O 1 1 15 9240 1 1 20 THR C C 6.005 -1.934 1.151 1.00 . A A . 20 THR C 1 1 15 9241 1 1 20 THR CA C 6.491 -2.613 2.427 1.00 . A A . 20 THR CA 1 1 15 9242 1 1 20 THR CB C 5.544 -3.753 2.806 1.00 . A A . 20 THR CB 1 1 15 9243 1 1 20 THR CG2 C 5.412 -4.809 1.729 1.00 . A A . 20 THR CG2 1 1 15 9244 1 1 20 THR H H 5.775 -1.176 3.801 1.00 . A A . 20 THR H 1 1 15 9245 1 1 20 THR HA H 7.478 -3.017 2.254 1.00 . A A . 20 THR HA 1 1 15 9246 1 1 20 THR HB H 4.561 -3.344 2.989 1.00 . A A . 20 THR HB 1 1 15 9247 1 1 20 THR HG1 H 6.813 -4.852 3.815 1.00 . A A . 20 THR HG1 1 1 15 9248 1 1 20 THR HG21 H 5.619 -4.368 0.765 1.00 . A A . 20 THR HG21 1 1 15 9249 1 1 20 THR HG22 H 6.116 -5.606 1.918 1.00 . A A . 20 THR HG22 1 1 15 9250 1 1 20 THR HG23 H 4.408 -5.206 1.735 1.00 . A A . 20 THR HG23 1 1 15 9251 1 1 20 THR N N 6.583 -1.650 3.517 1.00 . A A . 20 THR N 1 1 15 9252 1 1 20 THR O O 4.936 -1.325 1.129 1.00 . A A . 20 THR O 1 1 15 9253 1 1 20 THR OG1 O 5.984 -4.399 3.987 1.00 . A A . 20 THR OG1 1 1 15 9254 1 1 21 THR C C 5.084 -1.908 -1.671 1.00 . A A . 21 THR C 1 1 15 9255 1 1 21 THR CA C 6.450 -1.428 -1.188 1.00 . A A . 21 THR CA 1 1 15 9256 1 1 21 THR CB C 7.518 -1.740 -2.239 1.00 . A A . 21 THR CB 1 1 15 9257 1 1 21 THR CG2 C 8.208 -0.501 -2.766 1.00 . A A . 21 THR CG2 1 1 15 9258 1 1 21 THR H H 7.641 -2.533 0.170 1.00 . A A . 21 THR H 1 1 15 9259 1 1 21 THR HA H 6.408 -0.360 -1.042 1.00 . A A . 21 THR HA 1 1 15 9260 1 1 21 THR HB H 7.053 -2.240 -3.077 1.00 . A A . 21 THR HB 1 1 15 9261 1 1 21 THR HG1 H 8.467 -3.451 -2.141 1.00 . A A . 21 THR HG1 1 1 15 9262 1 1 21 THR HG21 H 7.872 0.361 -2.209 1.00 . A A . 21 THR HG21 1 1 15 9263 1 1 21 THR HG22 H 9.277 -0.609 -2.653 1.00 . A A . 21 THR HG22 1 1 15 9264 1 1 21 THR HG23 H 7.968 -0.371 -3.811 1.00 . A A . 21 THR HG23 1 1 15 9265 1 1 21 THR N N 6.799 -2.038 0.090 1.00 . A A . 21 THR N 1 1 15 9266 1 1 21 THR O O 4.864 -3.106 -1.850 1.00 . A A . 21 THR O 1 1 15 9267 1 1 21 THR OG1 O 8.516 -2.595 -1.708 1.00 . A A . 21 THR OG1 1 1 15 9268 1 1 22 CYS C C 2.576 -0.736 -3.737 1.00 . A A . 22 CYS C 1 1 15 9269 1 1 22 CYS CA C 2.828 -1.294 -2.343 1.00 . A A . 22 CYS CA 1 1 15 9270 1 1 22 CYS CB C 1.770 -0.757 -1.375 1.00 . A A . 22 CYS CB 1 1 15 9271 1 1 22 CYS H H 4.406 -0.027 -1.721 1.00 . A A . 22 CYS H 1 1 15 9272 1 1 22 CYS HA H 2.749 -2.370 -2.383 1.00 . A A . 22 CYS HA 1 1 15 9273 1 1 22 CYS HB2 H 0.824 -0.696 -1.889 1.00 . A A . 22 CYS HB2 1 1 15 9274 1 1 22 CYS HB3 H 1.677 -1.442 -0.547 1.00 . A A . 22 CYS HB3 1 1 15 9275 1 1 22 CYS N N 4.171 -0.964 -1.880 1.00 . A A . 22 CYS N 1 1 15 9276 1 1 22 CYS O O 1.506 -0.192 -4.013 1.00 . A A . 22 CYS O 1 1 15 9277 1 1 22 CYS SG S 2.129 0.898 -0.694 1.00 . A A . 22 CYS SG 1 1 15 9278 1 1 23 TRP C C 4.606 -0.747 -6.850 1.00 . A A . 23 TRP C 1 1 15 9279 1 1 23 TRP CA C 3.415 -0.378 -5.979 1.00 . A A . 23 TRP CA 1 1 15 9280 1 1 23 TRP CB C 3.225 1.139 -5.975 1.00 . A A . 23 TRP CB 1 1 15 9281 1 1 23 TRP CD1 C 1.690 0.864 -8.000 1.00 . A A . 23 TRP CD1 1 1 15 9282 1 1 23 TRP CD2 C 1.684 2.917 -7.116 1.00 . A A . 23 TRP CD2 1 1 15 9283 1 1 23 TRP CE2 C 0.802 2.897 -8.212 1.00 . A A . 23 TRP CE2 1 1 15 9284 1 1 23 TRP CE3 C 1.844 4.106 -6.403 1.00 . A A . 23 TRP CE3 1 1 15 9285 1 1 23 TRP CG C 2.238 1.606 -6.996 1.00 . A A . 23 TRP CG 1 1 15 9286 1 1 23 TRP CH2 C 0.261 5.168 -7.895 1.00 . A A . 23 TRP CH2 1 1 15 9287 1 1 23 TRP CZ2 C 0.085 4.017 -8.610 1.00 . A A . 23 TRP CZ2 1 1 15 9288 1 1 23 TRP CZ3 C 1.132 5.221 -6.801 1.00 . A A . 23 TRP CZ3 1 1 15 9289 1 1 23 TRP H H 4.391 -1.317 -4.351 1.00 . A A . 23 TRP H 1 1 15 9290 1 1 23 TRP HA H 2.534 -0.833 -6.397 1.00 . A A . 23 TRP HA 1 1 15 9291 1 1 23 TRP HB2 H 2.873 1.449 -5.003 1.00 . A A . 23 TRP HB2 1 1 15 9292 1 1 23 TRP HB3 H 4.171 1.617 -6.181 1.00 . A A . 23 TRP HB3 1 1 15 9293 1 1 23 TRP HD1 H 1.915 -0.177 -8.177 1.00 . A A . 23 TRP HD1 1 1 15 9294 1 1 23 TRP HE1 H 0.306 1.326 -9.508 1.00 . A A . 23 TRP HE1 1 1 15 9295 1 1 23 TRP HE3 H 2.512 4.163 -5.556 1.00 . A A . 23 TRP HE3 1 1 15 9296 1 1 23 TRP HH2 H -0.273 6.062 -8.174 1.00 . A A . 23 TRP HH2 1 1 15 9297 1 1 23 TRP HZ2 H -0.593 3.991 -9.447 1.00 . A A . 23 TRP HZ2 1 1 15 9298 1 1 23 TRP HZ3 H 1.243 6.151 -6.262 1.00 . A A . 23 TRP HZ3 1 1 15 9299 1 1 23 TRP N N 3.559 -0.874 -4.619 1.00 . A A . 23 TRP N 1 1 15 9300 1 1 23 TRP NE1 N 0.824 1.632 -8.736 1.00 . A A . 23 TRP NE1 1 1 15 9301 1 1 23 TRP O O 4.498 -1.597 -7.734 1.00 . A A . 23 TRP O 1 1 15 9302 1 1 24 LYS C C 6.626 -0.342 -8.884 1.00 . A A . 24 LYS C 1 1 15 9303 1 1 24 LYS CA C 6.944 -0.329 -7.390 1.00 . A A . 24 LYS CA 1 1 15 9304 1 1 24 LYS CB C 7.603 -1.647 -6.970 1.00 . A A . 24 LYS CB 1 1 15 9305 1 1 24 LYS CD C 7.667 -4.144 -7.246 1.00 . A A . 24 LYS CD 1 1 15 9306 1 1 24 LYS CE C 7.363 -5.138 -8.356 1.00 . A A . 24 LYS CE 1 1 15 9307 1 1 24 LYS CG C 6.823 -2.887 -7.377 1.00 . A A . 24 LYS CG 1 1 15 9308 1 1 24 LYS H H 5.747 0.588 -5.904 1.00 . A A . 24 LYS H 1 1 15 9309 1 1 24 LYS HA H 7.629 0.483 -7.191 1.00 . A A . 24 LYS HA 1 1 15 9310 1 1 24 LYS HB2 H 8.583 -1.703 -7.420 1.00 . A A . 24 LYS HB2 1 1 15 9311 1 1 24 LYS HB3 H 7.711 -1.653 -5.896 1.00 . A A . 24 LYS HB3 1 1 15 9312 1 1 24 LYS HD2 H 8.711 -3.872 -7.297 1.00 . A A . 24 LYS HD2 1 1 15 9313 1 1 24 LYS HD3 H 7.460 -4.608 -6.293 1.00 . A A . 24 LYS HD3 1 1 15 9314 1 1 24 LYS HE2 H 7.265 -4.599 -9.286 1.00 . A A . 24 LYS HE2 1 1 15 9315 1 1 24 LYS HE3 H 8.183 -5.837 -8.430 1.00 . A A . 24 LYS HE3 1 1 15 9316 1 1 24 LYS HG2 H 5.956 -2.980 -6.740 1.00 . A A . 24 LYS HG2 1 1 15 9317 1 1 24 LYS HG3 H 6.507 -2.781 -8.405 1.00 . A A . 24 LYS HG3 1 1 15 9318 1 1 24 LYS HZ1 H 6.007 -6.085 -7.080 1.00 . A A . 24 LYS HZ1 1 1 15 9319 1 1 24 LYS HZ2 H 5.284 -5.336 -8.414 1.00 . A A . 24 LYS HZ2 1 1 15 9320 1 1 24 LYS HZ3 H 6.118 -6.796 -8.611 1.00 . A A . 24 LYS HZ3 1 1 15 9321 1 1 24 LYS N N 5.733 -0.087 -6.612 1.00 . A A . 24 LYS N 1 1 15 9322 1 1 24 LYS NZ N 6.105 -5.891 -8.097 1.00 . A A . 24 LYS NZ 1 1 15 9323 1 1 24 LYS O O 7.246 -1.071 -9.659 1.00 . A A . 24 LYS O 1 1 15 9324 1 1 25 THR C C 6.425 0.670 -11.607 1.00 . A A . 25 THR C 1 1 15 9325 1 1 25 THR CA C 5.222 0.570 -10.670 1.00 . A A . 25 THR CA 1 1 15 9326 1 1 25 THR CB C 4.307 1.785 -10.857 1.00 . A A . 25 THR CB 1 1 15 9327 1 1 25 THR CG2 C 4.842 3.042 -10.206 1.00 . A A . 25 THR CG2 1 1 15 9328 1 1 25 THR H H 5.193 1.024 -8.603 1.00 . A A . 25 THR H 1 1 15 9329 1 1 25 THR HA H 4.668 -0.325 -10.910 1.00 . A A . 25 THR HA 1 1 15 9330 1 1 25 THR HB H 3.343 1.572 -10.415 1.00 . A A . 25 THR HB 1 1 15 9331 1 1 25 THR HG1 H 4.913 2.447 -12.600 1.00 . A A . 25 THR HG1 1 1 15 9332 1 1 25 THR HG21 H 5.777 2.822 -9.712 1.00 . A A . 25 THR HG21 1 1 15 9333 1 1 25 THR HG22 H 5.003 3.798 -10.960 1.00 . A A . 25 THR HG22 1 1 15 9334 1 1 25 THR HG23 H 4.128 3.404 -9.481 1.00 . A A . 25 THR HG23 1 1 15 9335 1 1 25 THR N N 5.646 0.473 -9.275 1.00 . A A . 25 THR N 1 1 15 9336 1 1 25 THR O O 7.554 0.880 -11.162 1.00 . A A . 25 THR O 1 1 15 9337 1 1 25 THR OG1 O 4.113 2.062 -12.233 1.00 . A A . 25 THR OG1 1 1 15 9338 1 1 26 SER C C 7.608 2.037 -14.211 1.00 . A A . 26 SER C 1 1 15 9339 1 1 26 SER CA C 7.242 0.587 -13.902 1.00 . A A . 26 SER CA 1 1 15 9340 1 1 26 SER CB C 6.815 -0.130 -15.184 1.00 . A A . 26 SER CB 1 1 15 9341 1 1 26 SER H H 5.258 0.351 -13.199 1.00 . A A . 26 SER H 1 1 15 9342 1 1 26 SER HA H 8.109 0.090 -13.495 1.00 . A A . 26 SER HA 1 1 15 9343 1 1 26 SER HB2 H 6.349 -1.071 -14.930 1.00 . A A . 26 SER HB2 1 1 15 9344 1 1 26 SER HB3 H 6.109 0.487 -15.721 1.00 . A A . 26 SER HB3 1 1 15 9345 1 1 26 SER HG H 8.474 0.403 -16.079 1.00 . A A . 26 SER HG 1 1 15 9346 1 1 26 SER N N 6.178 0.516 -12.905 1.00 . A A . 26 SER N 1 1 15 9347 1 1 26 SER O O 7.576 2.464 -15.365 1.00 . A A . 26 SER O 1 1 15 9348 1 1 26 SER OG O 7.929 -0.385 -16.022 1.00 . A A . 26 SER OG 1 1 15 9349 1 1 27 VAL C C 8.433 4.850 -11.932 1.00 . A A . 27 VAL C 1 1 15 9350 1 1 27 VAL CA C 8.339 4.189 -13.304 1.00 . A A . 27 VAL CA 1 1 15 9351 1 1 27 VAL CB C 7.333 4.977 -14.173 1.00 . A A . 27 VAL CB 1 1 15 9352 1 1 27 VAL CG1 C 5.926 4.858 -13.609 1.00 . A A . 27 VAL CG1 1 1 15 9353 1 1 27 VAL CG2 C 7.747 6.438 -14.287 1.00 . A A . 27 VAL CG2 1 1 15 9354 1 1 27 VAL H H 7.969 2.378 -12.278 1.00 . A A . 27 VAL H 1 1 15 9355 1 1 27 VAL HA H 9.308 4.229 -13.780 1.00 . A A . 27 VAL HA 1 1 15 9356 1 1 27 VAL HB H 7.334 4.551 -15.165 1.00 . A A . 27 VAL HB 1 1 15 9357 1 1 27 VAL HG11 H 5.953 5.005 -12.540 1.00 . A A . 27 VAL HG11 1 1 15 9358 1 1 27 VAL HG12 H 5.293 5.608 -14.059 1.00 . A A . 27 VAL HG12 1 1 15 9359 1 1 27 VAL HG13 H 5.532 3.876 -13.828 1.00 . A A . 27 VAL HG13 1 1 15 9360 1 1 27 VAL HG21 H 8.820 6.500 -14.400 1.00 . A A . 27 VAL HG21 1 1 15 9361 1 1 27 VAL HG22 H 7.268 6.882 -15.147 1.00 . A A . 27 VAL HG22 1 1 15 9362 1 1 27 VAL HG23 H 7.448 6.967 -13.394 1.00 . A A . 27 VAL HG23 1 1 15 9363 1 1 27 VAL N N 7.960 2.785 -13.168 1.00 . A A . 27 VAL N 1 1 15 9364 1 1 27 VAL O O 9.241 5.755 -11.719 1.00 . A A . 27 VAL O 1 1 15 9365 1 1 28 SER C C 7.790 3.823 -8.621 1.00 . A A . 28 SER C 1 1 15 9366 1 1 28 SER CA C 7.579 4.929 -9.651 1.00 . A A . 28 SER CA 1 1 15 9367 1 1 28 SER CB C 6.250 5.641 -9.385 1.00 . A A . 28 SER CB 1 1 15 9368 1 1 28 SER H H 6.979 3.669 -11.239 1.00 . A A . 28 SER H 1 1 15 9369 1 1 28 SER HA H 8.383 5.644 -9.566 1.00 . A A . 28 SER HA 1 1 15 9370 1 1 28 SER HB2 H 5.789 5.901 -10.326 1.00 . A A . 28 SER HB2 1 1 15 9371 1 1 28 SER HB3 H 5.594 4.981 -8.835 1.00 . A A . 28 SER HB3 1 1 15 9372 1 1 28 SER HG H 6.719 7.535 -9.215 1.00 . A A . 28 SER HG 1 1 15 9373 1 1 28 SER N N 7.598 4.390 -11.005 1.00 . A A . 28 SER N 1 1 15 9374 1 1 28 SER O O 8.135 2.694 -8.969 1.00 . A A . 28 SER O 1 1 15 9375 1 1 28 SER OG O 6.446 6.824 -8.631 1.00 . A A . 28 SER OG 1 1 15 9376 1 1 29 SER C C 7.312 3.818 -4.941 1.00 . A A . 29 SER C 1 1 15 9377 1 1 29 SER CA C 7.737 3.198 -6.267 1.00 . A A . 29 SER CA 1 1 15 9378 1 1 29 SER CB C 9.189 2.723 -6.183 1.00 . A A . 29 SER CB 1 1 15 9379 1 1 29 SER H H 7.300 5.074 -7.142 1.00 . A A . 29 SER H 1 1 15 9380 1 1 29 SER HA H 7.098 2.352 -6.476 1.00 . A A . 29 SER HA 1 1 15 9381 1 1 29 SER HB2 H 9.494 2.333 -7.143 1.00 . A A . 29 SER HB2 1 1 15 9382 1 1 29 SER HB3 H 9.823 3.556 -5.916 1.00 . A A . 29 SER HB3 1 1 15 9383 1 1 29 SER HG H 9.537 0.872 -5.645 1.00 . A A . 29 SER HG 1 1 15 9384 1 1 29 SER N N 7.576 4.158 -7.353 1.00 . A A . 29 SER N 1 1 15 9385 1 1 29 SER O O 7.858 4.836 -4.516 1.00 . A A . 29 SER O 1 1 15 9386 1 1 29 SER OG O 9.337 1.705 -5.210 1.00 . A A . 29 SER OG 1 1 15 9387 1 1 30 HIS C C 5.779 2.604 -1.973 1.00 . A A . 30 HIS C 1 1 15 9388 1 1 30 HIS CA C 5.812 3.706 -3.030 1.00 . A A . 30 HIS CA 1 1 15 9389 1 1 30 HIS CB C 4.413 4.286 -3.234 1.00 . A A . 30 HIS CB 1 1 15 9390 1 1 30 HIS CD2 C 4.755 5.215 -5.632 1.00 . A A . 30 HIS CD2 1 1 15 9391 1 1 30 HIS CE1 C 3.883 7.203 -5.334 1.00 . A A . 30 HIS CE1 1 1 15 9392 1 1 30 HIS CG C 4.344 5.290 -4.343 1.00 . A A . 30 HIS CG 1 1 15 9393 1 1 30 HIS H H 5.921 2.404 -4.695 1.00 . A A . 30 HIS H 1 1 15 9394 1 1 30 HIS HA H 6.471 4.492 -2.693 1.00 . A A . 30 HIS HA 1 1 15 9395 1 1 30 HIS HB2 H 3.731 3.484 -3.473 1.00 . A A . 30 HIS HB2 1 1 15 9396 1 1 30 HIS HB3 H 4.092 4.770 -2.324 1.00 . A A . 30 HIS HB3 1 1 15 9397 1 1 30 HIS HD1 H 3.413 6.906 -3.365 1.00 . A A . 30 HIS HD1 1 1 15 9398 1 1 30 HIS HD2 H 5.226 4.365 -6.107 1.00 . A A . 30 HIS HD2 1 1 15 9399 1 1 30 HIS HE1 H 3.539 8.211 -5.511 1.00 . A A . 30 HIS HE1 1 1 15 9400 1 1 30 HIS HE2 H 4.560 6.622 -7.177 1.00 . A A . 30 HIS HE2 1 1 15 9401 1 1 30 HIS N N 6.323 3.206 -4.299 1.00 . A A . 30 HIS N 1 1 15 9402 1 1 30 HIS ND1 N 3.803 6.548 -4.189 1.00 . A A . 30 HIS ND1 1 1 15 9403 1 1 30 HIS NE2 N 4.458 6.417 -6.225 1.00 . A A . 30 HIS NE2 1 1 15 9404 1 1 30 HIS O O 5.896 1.421 -2.293 1.00 . A A . 30 HIS O 1 1 15 9405 1 1 31 TYR C C 4.303 2.199 1.207 1.00 . A A . 31 TYR C 1 1 15 9406 1 1 31 TYR CA C 5.586 2.049 0.394 1.00 . A A . 31 TYR CA 1 1 15 9407 1 1 31 TYR CB C 6.801 2.243 1.303 1.00 . A A . 31 TYR CB 1 1 15 9408 1 1 31 TYR CD1 C 8.736 0.635 1.495 1.00 . A A . 31 TYR CD1 1 1 15 9409 1 1 31 TYR CD2 C 8.593 1.993 -0.459 1.00 . A A . 31 TYR CD2 1 1 15 9410 1 1 31 TYR CE1 C 9.894 0.056 1.013 1.00 . A A . 31 TYR CE1 1 1 15 9411 1 1 31 TYR CE2 C 9.750 1.418 -0.948 1.00 . A A . 31 TYR CE2 1 1 15 9412 1 1 31 TYR CG C 8.067 1.612 0.769 1.00 . A A . 31 TYR CG 1 1 15 9413 1 1 31 TYR CZ C 10.397 0.450 -0.209 1.00 . A A . 31 TYR CZ 1 1 15 9414 1 1 31 TYR H H 5.544 3.960 -0.521 1.00 . A A . 31 TYR H 1 1 15 9415 1 1 31 TYR HA H 5.617 1.055 -0.024 1.00 . A A . 31 TYR HA 1 1 15 9416 1 1 31 TYR HB2 H 6.984 3.300 1.425 1.00 . A A . 31 TYR HB2 1 1 15 9417 1 1 31 TYR HB3 H 6.592 1.806 2.268 1.00 . A A . 31 TYR HB3 1 1 15 9418 1 1 31 TYR HD1 H 8.340 0.328 2.451 1.00 . A A . 31 TYR HD1 1 1 15 9419 1 1 31 TYR HD2 H 8.085 2.752 -1.035 1.00 . A A . 31 TYR HD2 1 1 15 9420 1 1 31 TYR HE1 H 10.400 -0.703 1.592 1.00 . A A . 31 TYR HE1 1 1 15 9421 1 1 31 TYR HE2 H 10.144 1.728 -1.905 1.00 . A A . 31 TYR HE2 1 1 15 9422 1 1 31 TYR HH H 11.403 -1.063 -0.837 1.00 . A A . 31 TYR HH 1 1 15 9423 1 1 31 TYR N N 5.627 3.002 -0.712 1.00 . A A . 31 TYR N 1 1 15 9424 1 1 31 TYR O O 3.611 3.212 1.112 1.00 . A A . 31 TYR O 1 1 15 9425 1 1 31 TYR OH O 11.549 -0.125 -0.693 1.00 . A A . 31 TYR OH 1 1 15 9426 1 1 32 CYS C C 3.065 1.937 4.149 1.00 . A A . 32 CYS C 1 1 15 9427 1 1 32 CYS CA C 2.801 1.198 2.844 1.00 . A A . 32 CYS CA 1 1 15 9428 1 1 32 CYS CB C 2.346 -0.232 3.148 1.00 . A A . 32 CYS CB 1 1 15 9429 1 1 32 CYS H H 4.589 0.405 2.044 1.00 . A A . 32 CYS H 1 1 15 9430 1 1 32 CYS HA H 2.019 1.709 2.303 1.00 . A A . 32 CYS HA 1 1 15 9431 1 1 32 CYS HB2 H 3.211 -0.878 3.176 1.00 . A A . 32 CYS HB2 1 1 15 9432 1 1 32 CYS HB3 H 1.861 -0.249 4.113 1.00 . A A . 32 CYS HB3 1 1 15 9433 1 1 32 CYS N N 3.996 1.183 2.010 1.00 . A A . 32 CYS N 1 1 15 9434 1 1 32 CYS O O 4.165 1.877 4.697 1.00 . A A . 32 CYS O 1 1 15 9435 1 1 32 CYS SG S 1.182 -0.925 1.930 1.00 . A A . 32 CYS SG 1 1 15 9436 1 1 33 THR C C 1.508 2.608 7.041 1.00 . A A . 33 THR C 1 1 15 9437 1 1 33 THR CA C 2.167 3.368 5.894 1.00 . A A . 33 THR CA 1 1 15 9438 1 1 33 THR CB C 1.535 4.753 5.751 1.00 . A A . 33 THR CB 1 1 15 9439 1 1 33 THR CG2 C 1.944 5.467 4.482 1.00 . A A . 33 THR CG2 1 1 15 9440 1 1 33 THR H H 1.192 2.630 4.169 1.00 . A A . 33 THR H 1 1 15 9441 1 1 33 THR HA H 3.219 3.483 6.112 1.00 . A A . 33 THR HA 1 1 15 9442 1 1 33 THR HB H 1.839 5.365 6.588 1.00 . A A . 33 THR HB 1 1 15 9443 1 1 33 THR HG1 H -0.189 4.552 6.659 1.00 . A A . 33 THR HG1 1 1 15 9444 1 1 33 THR HG21 H 2.584 4.822 3.898 1.00 . A A . 33 THR HG21 1 1 15 9445 1 1 33 THR HG22 H 1.064 5.715 3.908 1.00 . A A . 33 THR HG22 1 1 15 9446 1 1 33 THR HG23 H 2.478 6.371 4.734 1.00 . A A . 33 THR HG23 1 1 15 9447 1 1 33 THR N N 2.047 2.627 4.647 1.00 . A A . 33 THR N 1 1 15 9448 1 1 33 THR O O 1.285 3.162 8.118 1.00 . A A . 33 THR O 1 1 15 9449 1 1 33 THR OG1 O 0.121 4.662 5.757 1.00 . A A . 33 THR OG1 1 1 15 9450 1 1 34 GLY C C -0.591 1.215 8.516 1.00 . A A . 34 GLY C 1 1 15 9451 1 1 34 GLY CA C 0.567 0.514 7.826 1.00 . A A . 34 GLY CA 1 1 15 9452 1 1 34 GLY H H 1.402 0.942 5.926 1.00 . A A . 34 GLY H 1 1 15 9453 1 1 34 GLY HA2 H 1.307 0.253 8.568 1.00 . A A . 34 GLY HA2 1 1 15 9454 1 1 34 GLY HA3 H 0.200 -0.393 7.368 1.00 . A A . 34 GLY HA3 1 1 15 9455 1 1 34 GLY N N 1.198 1.333 6.804 1.00 . A A . 34 GLY N 1 1 15 9456 1 1 34 GLY O O -0.893 0.929 9.675 1.00 . A A . 34 GLY O 1 1 15 9457 1 1 35 ARG C C -3.500 3.025 7.354 1.00 . A A . 35 ARG C 1 1 15 9458 1 1 35 ARG CA C -2.364 2.876 8.367 1.00 . A A . 35 ARG CA 1 1 15 9459 1 1 35 ARG CB C -1.905 4.256 8.838 1.00 . A A . 35 ARG CB 1 1 15 9460 1 1 35 ARG CD C -2.406 6.221 10.323 1.00 . A A . 35 ARG CD 1 1 15 9461 1 1 35 ARG CG C -2.601 4.729 10.104 1.00 . A A . 35 ARG CG 1 1 15 9462 1 1 35 ARG CZ C -3.644 8.100 11.326 1.00 . A A . 35 ARG CZ 1 1 15 9463 1 1 35 ARG H H -0.950 2.322 6.888 1.00 . A A . 35 ARG H 1 1 15 9464 1 1 35 ARG HA H -2.731 2.322 9.218 1.00 . A A . 35 ARG HA 1 1 15 9465 1 1 35 ARG HB2 H -0.842 4.224 9.028 1.00 . A A . 35 ARG HB2 1 1 15 9466 1 1 35 ARG HB3 H -2.101 4.975 8.056 1.00 . A A . 35 ARG HB3 1 1 15 9467 1 1 35 ARG HD2 H -1.450 6.379 10.801 1.00 . A A . 35 ARG HD2 1 1 15 9468 1 1 35 ARG HD3 H -2.414 6.716 9.364 1.00 . A A . 35 ARG HD3 1 1 15 9469 1 1 35 ARG HE H -4.052 6.170 11.629 1.00 . A A . 35 ARG HE 1 1 15 9470 1 1 35 ARG HG2 H -3.657 4.523 10.021 1.00 . A A . 35 ARG HG2 1 1 15 9471 1 1 35 ARG HG3 H -2.192 4.193 10.949 1.00 . A A . 35 ARG HG3 1 1 15 9472 1 1 35 ARG HH11 H -2.117 8.651 10.120 1.00 . A A . 35 ARG HH11 1 1 15 9473 1 1 35 ARG HH12 H -3.003 9.954 10.837 1.00 . A A . 35 ARG HH12 1 1 15 9474 1 1 35 ARG HH21 H -5.220 7.882 12.573 1.00 . A A . 35 ARG HH21 1 1 15 9475 1 1 35 ARG HH22 H -4.765 9.518 12.230 1.00 . A A . 35 ARG HH22 1 1 15 9476 1 1 35 ARG N N -1.237 2.135 7.806 1.00 . A A . 35 ARG N 1 1 15 9477 1 1 35 ARG NE N -3.456 6.793 11.162 1.00 . A A . 35 ARG NE 1 1 15 9478 1 1 35 ARG NH1 N -2.856 8.973 10.711 1.00 . A A . 35 ARG NH1 1 1 15 9479 1 1 35 ARG NH2 N -4.623 8.536 12.107 1.00 . A A . 35 ARG NH2 1 1 15 9480 1 1 35 ARG O O -4.446 3.779 7.583 1.00 . A A . 35 ARG O 1 1 15 9481 1 1 36 SER C C -4.076 1.467 4.027 1.00 . A A . 36 SER C 1 1 15 9482 1 1 36 SER CA C -4.436 2.369 5.202 1.00 . A A . 36 SER CA 1 1 15 9483 1 1 36 SER CB C -4.618 3.808 4.716 1.00 . A A . 36 SER CB 1 1 15 9484 1 1 36 SER H H -2.634 1.720 6.105 1.00 . A A . 36 SER H 1 1 15 9485 1 1 36 SER HA H -5.363 2.024 5.635 1.00 . A A . 36 SER HA 1 1 15 9486 1 1 36 SER HB2 H -5.144 4.376 5.469 1.00 . A A . 36 SER HB2 1 1 15 9487 1 1 36 SER HB3 H -3.648 4.253 4.543 1.00 . A A . 36 SER HB3 1 1 15 9488 1 1 36 SER HG H -5.789 4.705 3.427 1.00 . A A . 36 SER HG 1 1 15 9489 1 1 36 SER N N -3.408 2.307 6.237 1.00 . A A . 36 SER N 1 1 15 9490 1 1 36 SER O O -2.910 1.124 3.831 1.00 . A A . 36 SER O 1 1 15 9491 1 1 36 SER OG O -5.361 3.850 3.511 1.00 . A A . 36 SER OG 1 1 15 9492 1 1 37 CYS C C -4.599 1.051 0.832 1.00 . A A . 37 CYS C 1 1 15 9493 1 1 37 CYS CA C -4.861 0.227 2.090 1.00 . A A . 37 CYS CA 1 1 15 9494 1 1 37 CYS CB C -6.067 -0.684 1.870 1.00 . A A . 37 CYS CB 1 1 15 9495 1 1 37 CYS H H -5.992 1.392 3.447 1.00 . A A . 37 CYS H 1 1 15 9496 1 1 37 CYS HA H -3.994 -0.383 2.293 1.00 . A A . 37 CYS HA 1 1 15 9497 1 1 37 CYS HB2 H -6.961 -0.164 2.176 1.00 . A A . 37 CYS HB2 1 1 15 9498 1 1 37 CYS HB3 H -6.138 -0.923 0.821 1.00 . A A . 37 CYS HB3 1 1 15 9499 1 1 37 CYS N N -5.082 1.086 3.245 1.00 . A A . 37 CYS N 1 1 15 9500 1 1 37 CYS O O -4.522 0.508 -0.270 1.00 . A A . 37 CYS O 1 1 15 9501 1 1 37 CYS SG S -5.995 -2.252 2.796 1.00 . A A . 37 CYS SG 1 1 15 9502 1 1 38 GLU C C -2.739 3.657 -0.182 1.00 . A A . 38 GLU C 1 1 15 9503 1 1 38 GLU CA C -4.209 3.254 -0.125 1.00 . A A . 38 GLU CA 1 1 15 9504 1 1 38 GLU CB C -5.088 4.502 -0.023 1.00 . A A . 38 GLU CB 1 1 15 9505 1 1 38 GLU CD C -4.449 5.492 -2.257 1.00 . A A . 38 GLU CD 1 1 15 9506 1 1 38 GLU CG C -5.579 5.011 -1.368 1.00 . A A . 38 GLU CG 1 1 15 9507 1 1 38 GLU H H -4.534 2.742 1.901 1.00 . A A . 38 GLU H 1 1 15 9508 1 1 38 GLU HA H -4.459 2.722 -1.031 1.00 . A A . 38 GLU HA 1 1 15 9509 1 1 38 GLU HB2 H -5.949 4.272 0.587 1.00 . A A . 38 GLU HB2 1 1 15 9510 1 1 38 GLU HB3 H -4.522 5.289 0.451 1.00 . A A . 38 GLU HB3 1 1 15 9511 1 1 38 GLU HG2 H -6.099 4.212 -1.874 1.00 . A A . 38 GLU HG2 1 1 15 9512 1 1 38 GLU HG3 H -6.261 5.833 -1.200 1.00 . A A . 38 GLU HG3 1 1 15 9513 1 1 38 GLU N N -4.462 2.364 1.000 1.00 . A A . 38 GLU N 1 1 15 9514 1 1 38 GLU O O -2.319 4.606 0.481 1.00 . A A . 38 GLU O 1 1 15 9515 1 1 38 GLU OE1 O -4.362 5.025 -3.412 1.00 . A A . 38 GLU OE1 1 1 15 9516 1 1 38 GLU OE2 O -3.651 6.337 -1.798 1.00 . A A . 38 GLU OE2 1 1 15 9517 1 1 39 CYS C C -0.293 4.707 -1.346 1.00 . A A . 39 CYS C 1 1 15 9518 1 1 39 CYS CA C -0.535 3.209 -1.133 1.00 . A A . 39 CYS CA 1 1 15 9519 1 1 39 CYS CB C 0.031 2.410 -2.312 1.00 . A A . 39 CYS CB 1 1 15 9520 1 1 39 CYS H H -2.357 2.188 -1.483 1.00 . A A . 39 CYS H 1 1 15 9521 1 1 39 CYS HA H -0.040 2.898 -0.228 1.00 . A A . 39 CYS HA 1 1 15 9522 1 1 39 CYS HB2 H -0.432 1.435 -2.329 1.00 . A A . 39 CYS HB2 1 1 15 9523 1 1 39 CYS HB3 H -0.202 2.927 -3.232 1.00 . A A . 39 CYS HB3 1 1 15 9524 1 1 39 CYS N N -1.961 2.930 -0.981 1.00 . A A . 39 CYS N 1 1 15 9525 1 1 39 CYS O O -0.842 5.303 -2.273 1.00 . A A . 39 CYS O 1 1 15 9526 1 1 39 CYS SG S 1.837 2.159 -2.259 1.00 . A A . 39 CYS SG 1 1 15 9527 1 1 40 PRO C C 1.356 7.165 -1.956 1.00 . A A . 40 PRO C 1 1 15 9528 1 1 40 PRO CA C 0.823 6.774 -0.583 1.00 . A A . 40 PRO CA 1 1 15 9529 1 1 40 PRO CB C 1.891 7.009 0.496 1.00 . A A . 40 PRO CB 1 1 15 9530 1 1 40 PRO CD C 1.221 4.721 0.654 1.00 . A A . 40 PRO CD 1 1 15 9531 1 1 40 PRO CG C 2.375 5.651 0.881 1.00 . A A . 40 PRO CG 1 1 15 9532 1 1 40 PRO HA H -0.050 7.369 -0.360 1.00 . A A . 40 PRO HA 1 1 15 9533 1 1 40 PRO HB2 H 2.691 7.609 0.087 1.00 . A A . 40 PRO HB2 1 1 15 9534 1 1 40 PRO HB3 H 1.448 7.520 1.337 1.00 . A A . 40 PRO HB3 1 1 15 9535 1 1 40 PRO HD2 H 1.576 3.733 0.401 1.00 . A A . 40 PRO HD2 1 1 15 9536 1 1 40 PRO HD3 H 0.583 4.686 1.524 1.00 . A A . 40 PRO HD3 1 1 15 9537 1 1 40 PRO HG2 H 3.212 5.369 0.260 1.00 . A A . 40 PRO HG2 1 1 15 9538 1 1 40 PRO HG3 H 2.662 5.645 1.923 1.00 . A A . 40 PRO HG3 1 1 15 9539 1 1 40 PRO N N 0.526 5.340 -0.483 1.00 . A A . 40 PRO N 1 1 15 9540 1 1 40 PRO O O 1.647 6.307 -2.789 1.00 . A A . 40 PRO O 1 1 15 9541 1 1 41 SER C C 3.429 9.426 -3.341 1.00 . A A . 41 SER C 1 1 15 9542 1 1 41 SER CA C 1.974 8.980 -3.457 1.00 . A A . 41 SER CA 1 1 15 9543 1 1 41 SER CB C 1.108 10.148 -3.933 1.00 . A A . 41 SER CB 1 1 15 9544 1 1 41 SER H H 1.227 9.103 -1.481 1.00 . A A . 41 SER H 1 1 15 9545 1 1 41 SER HA H 1.912 8.181 -4.181 1.00 . A A . 41 SER HA 1 1 15 9546 1 1 41 SER HB2 H 0.117 10.052 -3.515 1.00 . A A . 41 SER HB2 1 1 15 9547 1 1 41 SER HB3 H 1.549 11.078 -3.604 1.00 . A A . 41 SER HB3 1 1 15 9548 1 1 41 SER HG H 0.147 9.831 -5.610 1.00 . A A . 41 SER HG 1 1 15 9549 1 1 41 SER N N 1.478 8.469 -2.185 1.00 . A A . 41 SER N 1 1 15 9550 1 1 41 SER O O 3.894 10.263 -4.114 1.00 . A A . 41 SER O 1 1 15 9551 1 1 41 SER OG O 1.007 10.166 -5.346 1.00 . A A . 41 SER OG 1 1 15 9552 1 1 42 TYR C C 6.379 7.942 -1.923 1.00 . A A . 42 TYR C 1 1 15 9553 1 1 42 TYR CA C 5.546 9.201 -2.162 1.00 . A A . 42 TYR CA 1 1 15 9554 1 1 42 TYR CB C 5.689 10.160 -0.977 1.00 . A A . 42 TYR CB 1 1 15 9555 1 1 42 TYR CD1 C 4.165 9.736 0.992 1.00 . A A . 42 TYR CD1 1 1 15 9556 1 1 42 TYR CD2 C 6.320 8.715 0.995 1.00 . A A . 42 TYR CD2 1 1 15 9557 1 1 42 TYR CE1 C 3.885 9.157 2.216 1.00 . A A . 42 TYR CE1 1 1 15 9558 1 1 42 TYR CE2 C 6.047 8.132 2.218 1.00 . A A . 42 TYR CE2 1 1 15 9559 1 1 42 TYR CG C 5.385 9.525 0.362 1.00 . A A . 42 TYR CG 1 1 15 9560 1 1 42 TYR CZ C 4.829 8.357 2.824 1.00 . A A . 42 TYR CZ 1 1 15 9561 1 1 42 TYR H H 3.721 8.198 -1.789 1.00 . A A . 42 TYR H 1 1 15 9562 1 1 42 TYR HA H 5.904 9.691 -3.055 1.00 . A A . 42 TYR HA 1 1 15 9563 1 1 42 TYR HB2 H 6.703 10.531 -0.944 1.00 . A A . 42 TYR HB2 1 1 15 9564 1 1 42 TYR HB3 H 5.012 10.991 -1.112 1.00 . A A . 42 TYR HB3 1 1 15 9565 1 1 42 TYR HD1 H 3.428 10.363 0.513 1.00 . A A . 42 TYR HD1 1 1 15 9566 1 1 42 TYR HD2 H 7.273 8.542 0.518 1.00 . A A . 42 TYR HD2 1 1 15 9567 1 1 42 TYR HE1 H 2.931 9.333 2.690 1.00 . A A . 42 TYR HE1 1 1 15 9568 1 1 42 TYR HE2 H 6.787 7.505 2.693 1.00 . A A . 42 TYR HE2 1 1 15 9569 1 1 42 TYR HH H 4.230 6.885 3.907 1.00 . A A . 42 TYR HH 1 1 15 9570 1 1 42 TYR N N 4.144 8.861 -2.373 1.00 . A A . 42 TYR N 1 1 15 9571 1 1 42 TYR O O 5.908 6.986 -1.308 1.00 . A A . 42 TYR O 1 1 15 9572 1 1 42 TYR OH O 4.554 7.778 4.042 1.00 . A A . 42 TYR OH 1 1 15 9573 1 1 43 PRO C C 9.057 6.654 -0.819 1.00 . A A . 43 PRO C 1 1 15 9574 1 1 43 PRO CA C 8.525 6.775 -2.243 1.00 . A A . 43 PRO CA 1 1 15 9575 1 1 43 PRO CB C 9.665 7.076 -3.216 1.00 . A A . 43 PRO CB 1 1 15 9576 1 1 43 PRO CD C 8.277 9.023 -3.156 1.00 . A A . 43 PRO CD 1 1 15 9577 1 1 43 PRO CG C 9.703 8.562 -3.298 1.00 . A A . 43 PRO CG 1 1 15 9578 1 1 43 PRO HA H 8.040 5.853 -2.525 1.00 . A A . 43 PRO HA 1 1 15 9579 1 1 43 PRO HB2 H 10.590 6.675 -2.828 1.00 . A A . 43 PRO HB2 1 1 15 9580 1 1 43 PRO HB3 H 9.448 6.634 -4.177 1.00 . A A . 43 PRO HB3 1 1 15 9581 1 1 43 PRO HD2 H 8.233 9.946 -2.598 1.00 . A A . 43 PRO HD2 1 1 15 9582 1 1 43 PRO HD3 H 7.822 9.145 -4.128 1.00 . A A . 43 PRO HD3 1 1 15 9583 1 1 43 PRO HG2 H 10.306 8.958 -2.494 1.00 . A A . 43 PRO HG2 1 1 15 9584 1 1 43 PRO HG3 H 10.102 8.868 -4.254 1.00 . A A . 43 PRO HG3 1 1 15 9585 1 1 43 PRO N N 7.632 7.925 -2.408 1.00 . A A . 43 PRO N 1 1 15 9586 1 1 43 PRO O O 9.233 7.655 -0.124 1.00 . A A . 43 PRO O 1 1 15 9587 1 1 44 GLY C C 11.146 5.887 1.191 1.00 . A A . 44 GLY C 1 1 15 9588 1 1 44 GLY CA C 9.821 5.192 0.948 1.00 . A A . 44 GLY CA 1 1 15 9589 1 1 44 GLY H H 9.152 4.662 -0.990 1.00 . A A . 44 GLY H 1 1 15 9590 1 1 44 GLY HA2 H 9.952 4.130 1.094 1.00 . A A . 44 GLY HA2 1 1 15 9591 1 1 44 GLY HA3 H 9.099 5.557 1.663 1.00 . A A . 44 GLY HA3 1 1 15 9592 1 1 44 GLY N N 9.312 5.422 -0.391 1.00 . A A . 44 GLY N 1 1 15 9593 1 1 44 GLY O O 12.207 5.337 0.894 1.00 . A A . 44 GLY O 1 1 15 9594 1 1 45 ASN C C 11.970 9.080 2.889 1.00 . A A . 45 ASN C 1 1 15 9595 1 1 45 ASN CA C 12.291 7.870 2.017 1.00 . A A . 45 ASN CA 1 1 15 9596 1 1 45 ASN CB C 12.949 8.326 0.714 1.00 . A A . 45 ASN CB 1 1 15 9597 1 1 45 ASN CG C 13.970 7.329 0.202 1.00 . A A . 45 ASN CG 1 1 15 9598 1 1 45 ASN H H 10.211 7.483 1.949 1.00 . A A . 45 ASN H 1 1 15 9599 1 1 45 ASN HA H 12.977 7.229 2.551 1.00 . A A . 45 ASN HA 1 1 15 9600 1 1 45 ASN HB2 H 12.187 8.452 -0.042 1.00 . A A . 45 ASN HB2 1 1 15 9601 1 1 45 ASN HB3 H 13.445 9.271 0.879 1.00 . A A . 45 ASN HB3 1 1 15 9602 1 1 45 ASN HD21 H 15.303 7.978 1.527 1.00 . A A . 45 ASN HD21 1 1 15 9603 1 1 45 ASN HD22 H 15.836 6.704 0.489 1.00 . A A . 45 ASN HD22 1 1 15 9604 1 1 45 ASN N N 11.086 7.099 1.734 1.00 . A A . 45 ASN N 1 1 15 9605 1 1 45 ASN ND2 N 15.156 7.338 0.800 1.00 . A A . 45 ASN ND2 1 1 15 9606 1 1 45 ASN O O 12.696 9.385 3.835 1.00 . A A . 45 ASN O 1 1 15 9607 1 1 45 ASN OD1 O 13.697 6.560 -0.720 1.00 . A A . 45 ASN OD1 1 1 15 9608 1 1 46 GLY C C 10.775 12.229 2.597 1.00 . A A . 46 GLY C 1 1 15 9609 1 1 46 GLY CA C 10.481 10.933 3.326 1.00 . A A . 46 GLY CA 1 1 15 9610 1 1 46 GLY H H 10.339 9.474 1.799 1.00 . A A . 46 GLY H 1 1 15 9611 1 1 46 GLY HA2 H 11.013 10.933 4.266 1.00 . A A . 46 GLY HA2 1 1 15 9612 1 1 46 GLY HA3 H 9.421 10.876 3.524 1.00 . A A . 46 GLY HA3 1 1 15 9613 1 1 46 GLY N N 10.879 9.764 2.563 1.00 . A A . 46 GLY N 1 1 15 9614 1 1 46 GLY O O 11.626 13.003 3.082 1.00 . A A . 46 GLY O 1 1 15 9615 1 1 46 GLY OXT O 10.153 12.470 1.540 1.00 . A A . 46 GLY OXT 1 1 16 9616 1 1 1 ALA C C -19.645 -8.173 5.054 1.00 . A A . 1 ALA C 1 1 16 9617 1 1 1 ALA CA C -21.095 -8.630 4.938 1.00 . A A . 1 ALA CA 1 1 16 9618 1 1 1 ALA CB C -21.720 -8.083 3.663 1.00 . A A . 1 ALA CB 1 1 16 9619 1 1 1 ALA H1 H -21.292 -8.338 6.964 1.00 . A A . 1 ALA H1 1 1 16 9620 1 1 1 ALA H2 H -22.132 -7.201 5.992 1.00 . A A . 1 ALA H2 1 1 16 9621 1 1 1 ALA H3 H -22.737 -8.798 6.166 1.00 . A A . 1 ALA H3 1 1 16 9622 1 1 1 ALA HA H -21.117 -9.709 4.885 1.00 . A A . 1 ALA HA 1 1 16 9623 1 1 1 ALA HB1 H -21.544 -8.773 2.851 1.00 . A A . 1 ALA HB1 1 1 16 9624 1 1 1 ALA HB2 H -22.783 -7.961 3.807 1.00 . A A . 1 ALA HB2 1 1 16 9625 1 1 1 ALA HB3 H -21.276 -7.128 3.425 1.00 . A A . 1 ALA HB3 1 1 16 9626 1 1 1 ALA N N -21.885 -8.203 6.122 1.00 . A A . 1 ALA N 1 1 16 9627 1 1 1 ALA O O -18.733 -8.839 4.563 1.00 . A A . 1 ALA O 1 1 16 9628 1 1 2 MET C C -17.444 -6.198 4.539 1.00 . A A . 2 MET C 1 1 16 9629 1 1 2 MET CA C -18.100 -6.487 5.886 1.00 . A A . 2 MET CA 1 1 16 9630 1 1 2 MET CB C -17.234 -7.459 6.689 1.00 . A A . 2 MET CB 1 1 16 9631 1 1 2 MET CE C -13.310 -7.704 7.522 1.00 . A A . 2 MET CE 1 1 16 9632 1 1 2 MET CG C -15.923 -6.855 7.166 1.00 . A A . 2 MET CG 1 1 16 9633 1 1 2 MET H H -20.207 -6.548 6.073 1.00 . A A . 2 MET H 1 1 16 9634 1 1 2 MET HA H -18.190 -5.561 6.434 1.00 . A A . 2 MET HA 1 1 16 9635 1 1 2 MET HB2 H -17.790 -7.787 7.555 1.00 . A A . 2 MET HB2 1 1 16 9636 1 1 2 MET HB3 H -17.007 -8.315 6.072 1.00 . A A . 2 MET HB3 1 1 16 9637 1 1 2 MET HE1 H -13.171 -6.645 7.360 1.00 . A A . 2 MET HE1 1 1 16 9638 1 1 2 MET HE2 H -12.576 -8.059 8.231 1.00 . A A . 2 MET HE2 1 1 16 9639 1 1 2 MET HE3 H -13.190 -8.230 6.586 1.00 . A A . 2 MET HE3 1 1 16 9640 1 1 2 MET HG2 H -15.339 -6.570 6.304 1.00 . A A . 2 MET HG2 1 1 16 9641 1 1 2 MET HG3 H -16.141 -5.977 7.757 1.00 . A A . 2 MET HG3 1 1 16 9642 1 1 2 MET N N -19.440 -7.033 5.705 1.00 . A A . 2 MET N 1 1 16 9643 1 1 2 MET O O -17.861 -6.726 3.508 1.00 . A A . 2 MET O 1 1 16 9644 1 1 2 MET SD S -14.954 -7.999 8.167 1.00 . A A . 2 MET SD 1 1 16 9645 1 1 3 ASP C C -14.219 -5.331 3.455 1.00 . A A . 3 ASP C 1 1 16 9646 1 1 3 ASP CA C -15.702 -4.996 3.336 1.00 . A A . 3 ASP CA 1 1 16 9647 1 1 3 ASP CB C -15.877 -3.505 3.038 1.00 . A A . 3 ASP CB 1 1 16 9648 1 1 3 ASP CG C -17.159 -3.214 2.283 1.00 . A A . 3 ASP CG 1 1 16 9649 1 1 3 ASP H H -16.131 -4.966 5.409 1.00 . A A . 3 ASP H 1 1 16 9650 1 1 3 ASP HA H -16.124 -5.568 2.524 1.00 . A A . 3 ASP HA 1 1 16 9651 1 1 3 ASP HB2 H -15.898 -2.958 3.969 1.00 . A A . 3 ASP HB2 1 1 16 9652 1 1 3 ASP HB3 H -15.044 -3.163 2.443 1.00 . A A . 3 ASP HB3 1 1 16 9653 1 1 3 ASP N N -16.416 -5.355 4.556 1.00 . A A . 3 ASP N 1 1 16 9654 1 1 3 ASP O O -13.668 -5.372 4.555 1.00 . A A . 3 ASP O 1 1 16 9655 1 1 3 ASP OD1 O -17.140 -2.331 1.400 1.00 . A A . 3 ASP OD1 1 1 16 9656 1 1 3 ASP OD2 O -18.182 -3.868 2.575 1.00 . A A . 3 ASP OD2 1 1 16 9657 1 1 4 CYS C C -11.328 -4.714 1.821 1.00 . A A . 4 CYS C 1 1 16 9658 1 1 4 CYS CA C -12.158 -5.901 2.292 1.00 . A A . 4 CYS CA 1 1 16 9659 1 1 4 CYS CB C -11.907 -7.102 1.381 1.00 . A A . 4 CYS CB 1 1 16 9660 1 1 4 CYS H H -14.071 -5.522 1.471 1.00 . A A . 4 CYS H 1 1 16 9661 1 1 4 CYS HA H -11.859 -6.157 3.298 1.00 . A A . 4 CYS HA 1 1 16 9662 1 1 4 CYS HB2 H -12.538 -7.022 0.509 1.00 . A A . 4 CYS HB2 1 1 16 9663 1 1 4 CYS HB3 H -10.871 -7.098 1.071 1.00 . A A . 4 CYS HB3 1 1 16 9664 1 1 4 CYS N N -13.578 -5.570 2.316 1.00 . A A . 4 CYS N 1 1 16 9665 1 1 4 CYS O O -11.723 -3.989 0.907 1.00 . A A . 4 CYS O 1 1 16 9666 1 1 4 CYS SG S -12.245 -8.712 2.164 1.00 . A A . 4 CYS SG 1 1 16 9667 1 1 5 THR C C -8.842 -3.543 0.635 1.00 . A A . 5 THR C 1 1 16 9668 1 1 5 THR CA C -9.281 -3.428 2.092 1.00 . A A . 5 THR CA 1 1 16 9669 1 1 5 THR CB C -8.057 -3.421 3.012 1.00 . A A . 5 THR CB 1 1 16 9670 1 1 5 THR CG2 C -7.791 -2.073 3.646 1.00 . A A . 5 THR CG2 1 1 16 9671 1 1 5 THR H H -9.912 -5.138 3.165 1.00 . A A . 5 THR H 1 1 16 9672 1 1 5 THR HA H -9.822 -2.502 2.220 1.00 . A A . 5 THR HA 1 1 16 9673 1 1 5 THR HB H -7.184 -3.694 2.436 1.00 . A A . 5 THR HB 1 1 16 9674 1 1 5 THR HG1 H -8.001 -5.242 3.732 1.00 . A A . 5 THR HG1 1 1 16 9675 1 1 5 THR HG21 H -8.288 -1.303 3.075 1.00 . A A . 5 THR HG21 1 1 16 9676 1 1 5 THR HG22 H -8.169 -2.071 4.658 1.00 . A A . 5 THR HG22 1 1 16 9677 1 1 5 THR HG23 H -6.728 -1.884 3.658 1.00 . A A . 5 THR HG23 1 1 16 9678 1 1 5 THR N N -10.173 -4.524 2.448 1.00 . A A . 5 THR N 1 1 16 9679 1 1 5 THR O O -7.959 -4.334 0.304 1.00 . A A . 5 THR O 1 1 16 9680 1 1 5 THR OG1 O -8.209 -4.364 4.059 1.00 . A A . 5 THR OG1 1 1 16 9681 1 1 6 THR C C -8.290 -1.569 -2.038 1.00 . A A . 6 THR C 1 1 16 9682 1 1 6 THR CA C -9.141 -2.774 -1.654 1.00 . A A . 6 THR CA 1 1 16 9683 1 1 6 THR CB C -10.421 -2.797 -2.491 1.00 . A A . 6 THR CB 1 1 16 9684 1 1 6 THR CG2 C -11.082 -4.158 -2.535 1.00 . A A . 6 THR CG2 1 1 16 9685 1 1 6 THR H H -10.165 -2.147 0.089 1.00 . A A . 6 THR H 1 1 16 9686 1 1 6 THR HA H -8.578 -3.674 -1.852 1.00 . A A . 6 THR HA 1 1 16 9687 1 1 6 THR HB H -10.181 -2.513 -3.506 1.00 . A A . 6 THR HB 1 1 16 9688 1 1 6 THR HG1 H -11.908 -1.540 -2.704 1.00 . A A . 6 THR HG1 1 1 16 9689 1 1 6 THR HG21 H -10.503 -4.858 -1.952 1.00 . A A . 6 THR HG21 1 1 16 9690 1 1 6 THR HG22 H -12.079 -4.087 -2.125 1.00 . A A . 6 THR HG22 1 1 16 9691 1 1 6 THR HG23 H -11.137 -4.499 -3.558 1.00 . A A . 6 THR HG23 1 1 16 9692 1 1 6 THR N N -9.467 -2.754 -0.233 1.00 . A A . 6 THR N 1 1 16 9693 1 1 6 THR O O -8.554 -0.446 -1.608 1.00 . A A . 6 THR O 1 1 16 9694 1 1 6 THR OG1 O -11.369 -1.874 -1.984 1.00 . A A . 6 THR OG1 1 1 16 9695 1 1 7 GLY C C -4.952 -1.195 -3.450 1.00 . A A . 7 GLY C 1 1 16 9696 1 1 7 GLY CA C -6.389 -0.737 -3.281 1.00 . A A . 7 GLY CA 1 1 16 9697 1 1 7 GLY H H -7.105 -2.726 -3.162 1.00 . A A . 7 GLY H 1 1 16 9698 1 1 7 GLY HA2 H -6.420 0.054 -2.547 1.00 . A A . 7 GLY HA2 1 1 16 9699 1 1 7 GLY HA3 H -6.746 -0.352 -4.225 1.00 . A A . 7 GLY HA3 1 1 16 9700 1 1 7 GLY N N -7.266 -1.810 -2.851 1.00 . A A . 7 GLY N 1 1 16 9701 1 1 7 GLY O O -4.658 -2.383 -3.317 1.00 . A A . 7 GLY O 1 1 16 9702 1 1 8 PRO C C -1.908 -0.921 -2.617 1.00 . A A . 8 PRO C 1 1 16 9703 1 1 8 PRO CA C -2.609 -0.596 -3.934 1.00 . A A . 8 PRO CA 1 1 16 9704 1 1 8 PRO CB C -2.033 0.678 -4.552 1.00 . A A . 8 PRO CB 1 1 16 9705 1 1 8 PRO CD C -4.287 1.174 -3.928 1.00 . A A . 8 PRO CD 1 1 16 9706 1 1 8 PRO CG C -2.909 1.769 -4.043 1.00 . A A . 8 PRO CG 1 1 16 9707 1 1 8 PRO HA H -2.483 -1.421 -4.620 1.00 . A A . 8 PRO HA 1 1 16 9708 1 1 8 PRO HB2 H -1.010 0.807 -4.231 1.00 . A A . 8 PRO HB2 1 1 16 9709 1 1 8 PRO HB3 H -2.073 0.611 -5.629 1.00 . A A . 8 PRO HB3 1 1 16 9710 1 1 8 PRO HD2 H -4.803 1.582 -3.071 1.00 . A A . 8 PRO HD2 1 1 16 9711 1 1 8 PRO HD3 H -4.851 1.353 -4.831 1.00 . A A . 8 PRO HD3 1 1 16 9712 1 1 8 PRO HG2 H -2.560 2.099 -3.075 1.00 . A A . 8 PRO HG2 1 1 16 9713 1 1 8 PRO HG3 H -2.914 2.593 -4.742 1.00 . A A . 8 PRO HG3 1 1 16 9714 1 1 8 PRO N N -4.026 -0.267 -3.748 1.00 . A A . 8 PRO N 1 1 16 9715 1 1 8 PRO O O -0.914 -1.647 -2.596 1.00 . A A . 8 PRO O 1 1 16 9716 1 1 9 CYS C C -2.683 -1.642 0.577 1.00 . A A . 9 CYS C 1 1 16 9717 1 1 9 CYS CA C -1.856 -0.620 -0.200 1.00 . A A . 9 CYS CA 1 1 16 9718 1 1 9 CYS CB C -1.762 0.695 0.582 1.00 . A A . 9 CYS CB 1 1 16 9719 1 1 9 CYS H H -3.227 0.186 -1.599 1.00 . A A . 9 CYS H 1 1 16 9720 1 1 9 CYS HA H -0.861 -1.015 -0.340 1.00 . A A . 9 CYS HA 1 1 16 9721 1 1 9 CYS HB2 H -2.208 1.484 -0.003 1.00 . A A . 9 CYS HB2 1 1 16 9722 1 1 9 CYS HB3 H -2.302 0.596 1.512 1.00 . A A . 9 CYS HB3 1 1 16 9723 1 1 9 CYS N N -2.432 -0.383 -1.520 1.00 . A A . 9 CYS N 1 1 16 9724 1 1 9 CYS O O -3.106 -1.392 1.706 1.00 . A A . 9 CYS O 1 1 16 9725 1 1 9 CYS SG S -0.061 1.205 0.983 1.00 . A A . 9 CYS SG 1 1 16 9726 1 1 10 CYS C C -3.714 -5.100 -0.302 1.00 . A A . 10 CYS C 1 1 16 9727 1 1 10 CYS CA C -3.689 -3.860 0.586 1.00 . A A . 10 CYS CA 1 1 16 9728 1 1 10 CYS CB C -5.121 -3.390 0.873 1.00 . A A . 10 CYS CB 1 1 16 9729 1 1 10 CYS H H -2.550 -2.935 -0.940 1.00 . A A . 10 CYS H 1 1 16 9730 1 1 10 CYS HA H -3.210 -4.113 1.520 1.00 . A A . 10 CYS HA 1 1 16 9731 1 1 10 CYS HB2 H -5.791 -4.231 0.777 1.00 . A A . 10 CYS HB2 1 1 16 9732 1 1 10 CYS HB3 H -5.169 -3.014 1.885 1.00 . A A . 10 CYS HB3 1 1 16 9733 1 1 10 CYS N N -2.912 -2.795 -0.040 1.00 . A A . 10 CYS N 1 1 16 9734 1 1 10 CYS O O -4.063 -5.025 -1.480 1.00 . A A . 10 CYS O 1 1 16 9735 1 1 10 CYS SG S -5.727 -2.075 -0.237 1.00 . A A . 10 CYS SG 1 1 16 9736 1 1 11 ARG C C -4.684 -7.821 -1.055 1.00 . A A . 11 ARG C 1 1 16 9737 1 1 11 ARG CA C -3.307 -7.494 -0.472 1.00 . A A . 11 ARG CA 1 1 16 9738 1 1 11 ARG CB C -2.811 -8.631 0.428 1.00 . A A . 11 ARG CB 1 1 16 9739 1 1 11 ARG CD C -3.589 -11.017 0.619 1.00 . A A . 11 ARG CD 1 1 16 9740 1 1 11 ARG CG C -2.848 -10.000 -0.235 1.00 . A A . 11 ARG CG 1 1 16 9741 1 1 11 ARG CZ C -1.835 -12.734 0.842 1.00 . A A . 11 ARG CZ 1 1 16 9742 1 1 11 ARG H H -3.063 -6.233 1.212 1.00 . A A . 11 ARG H 1 1 16 9743 1 1 11 ARG HA H -2.612 -7.372 -1.289 1.00 . A A . 11 ARG HA 1 1 16 9744 1 1 11 ARG HB2 H -1.791 -8.425 0.717 1.00 . A A . 11 ARG HB2 1 1 16 9745 1 1 11 ARG HB3 H -3.425 -8.666 1.316 1.00 . A A . 11 ARG HB3 1 1 16 9746 1 1 11 ARG HD2 H -4.238 -10.490 1.301 1.00 . A A . 11 ARG HD2 1 1 16 9747 1 1 11 ARG HD3 H -4.182 -11.647 -0.028 1.00 . A A . 11 ARG HD3 1 1 16 9748 1 1 11 ARG HE H -2.683 -11.760 2.364 1.00 . A A . 11 ARG HE 1 1 16 9749 1 1 11 ARG HG2 H -3.348 -9.914 -1.188 1.00 . A A . 11 ARG HG2 1 1 16 9750 1 1 11 ARG HG3 H -1.835 -10.342 -0.389 1.00 . A A . 11 ARG HG3 1 1 16 9751 1 1 11 ARG HH11 H -2.393 -12.349 -1.064 1.00 . A A . 11 ARG HH11 1 1 16 9752 1 1 11 ARG HH12 H -1.162 -13.553 -0.880 1.00 . A A . 11 ARG HH12 1 1 16 9753 1 1 11 ARG HH21 H -1.063 -13.343 2.608 1.00 . A A . 11 ARG HH21 1 1 16 9754 1 1 11 ARG HH22 H -0.407 -14.117 1.204 1.00 . A A . 11 ARG HH22 1 1 16 9755 1 1 11 ARG N N -3.335 -6.238 0.270 1.00 . A A . 11 ARG N 1 1 16 9756 1 1 11 ARG NE N -2.673 -11.856 1.388 1.00 . A A . 11 ARG NE 1 1 16 9757 1 1 11 ARG NH1 N -1.794 -12.891 -0.476 1.00 . A A . 11 ARG NH1 1 1 16 9758 1 1 11 ARG NH2 N -1.036 -13.457 1.614 1.00 . A A . 11 ARG NH2 1 1 16 9759 1 1 11 ARG O O -5.009 -7.397 -2.164 1.00 . A A . 11 ARG O 1 1 16 9760 1 1 12 GLN C C -7.892 -8.635 0.272 1.00 . A A . 12 GLN C 1 1 16 9761 1 1 12 GLN CA C -6.822 -8.951 -0.773 1.00 . A A . 12 GLN CA 1 1 16 9762 1 1 12 GLN CB C -6.861 -10.441 -1.118 1.00 . A A . 12 GLN CB 1 1 16 9763 1 1 12 GLN CD C -7.596 -10.800 -3.508 1.00 . A A . 12 GLN CD 1 1 16 9764 1 1 12 GLN CG C -6.428 -10.747 -2.543 1.00 . A A . 12 GLN CG 1 1 16 9765 1 1 12 GLN H H -5.182 -8.891 0.562 1.00 . A A . 12 GLN H 1 1 16 9766 1 1 12 GLN HA H -7.033 -8.382 -1.666 1.00 . A A . 12 GLN HA 1 1 16 9767 1 1 12 GLN HB2 H -6.205 -10.972 -0.444 1.00 . A A . 12 GLN HB2 1 1 16 9768 1 1 12 GLN HB3 H -7.869 -10.804 -0.986 1.00 . A A . 12 GLN HB3 1 1 16 9769 1 1 12 GLN HE21 H -6.899 -9.210 -4.478 1.00 . A A . 12 GLN HE21 1 1 16 9770 1 1 12 GLN HE22 H -8.368 -9.881 -5.093 1.00 . A A . 12 GLN HE22 1 1 16 9771 1 1 12 GLN HG2 H -5.745 -9.978 -2.871 1.00 . A A . 12 GLN HG2 1 1 16 9772 1 1 12 GLN HG3 H -5.925 -11.703 -2.555 1.00 . A A . 12 GLN HG3 1 1 16 9773 1 1 12 GLN N N -5.490 -8.576 -0.311 1.00 . A A . 12 GLN N 1 1 16 9774 1 1 12 GLN NE2 N -7.624 -9.870 -4.455 1.00 . A A . 12 GLN NE2 1 1 16 9775 1 1 12 GLN O O -9.084 -8.633 -0.034 1.00 . A A . 12 GLN O 1 1 16 9776 1 1 12 GLN OE1 O -8.463 -11.668 -3.404 1.00 . A A . 12 GLN OE1 1 1 16 9777 1 1 13 CYS C C -7.662 -7.706 3.868 1.00 . A A . 13 CYS C 1 1 16 9778 1 1 13 CYS CA C -8.401 -8.059 2.580 1.00 . A A . 13 CYS CA 1 1 16 9779 1 1 13 CYS CB C -9.335 -9.245 2.827 1.00 . A A . 13 CYS CB 1 1 16 9780 1 1 13 CYS H H -6.508 -8.386 1.698 1.00 . A A . 13 CYS H 1 1 16 9781 1 1 13 CYS HA H -8.989 -7.208 2.272 1.00 . A A . 13 CYS HA 1 1 16 9782 1 1 13 CYS HB2 H -9.592 -9.694 1.879 1.00 . A A . 13 CYS HB2 1 1 16 9783 1 1 13 CYS HB3 H -8.823 -9.976 3.436 1.00 . A A . 13 CYS HB3 1 1 16 9784 1 1 13 CYS N N -7.466 -8.370 1.506 1.00 . A A . 13 CYS N 1 1 16 9785 1 1 13 CYS O O -8.127 -8.018 4.964 1.00 . A A . 13 CYS O 1 1 16 9786 1 1 13 CYS SG S -10.889 -8.808 3.671 1.00 . A A . 13 CYS SG 1 1 16 9787 1 1 14 LYS C C -4.789 -5.508 4.538 1.00 . A A . 14 LYS C 1 1 16 9788 1 1 14 LYS CA C -5.719 -6.661 4.889 1.00 . A A . 14 LYS CA 1 1 16 9789 1 1 14 LYS CB C -4.906 -7.850 5.404 1.00 . A A . 14 LYS CB 1 1 16 9790 1 1 14 LYS CD C -4.768 -9.423 7.359 1.00 . A A . 14 LYS CD 1 1 16 9791 1 1 14 LYS CE C -5.448 -9.565 8.712 1.00 . A A . 14 LYS CE 1 1 16 9792 1 1 14 LYS CG C -5.683 -8.758 6.344 1.00 . A A . 14 LYS CG 1 1 16 9793 1 1 14 LYS H H -6.187 -6.828 2.834 1.00 . A A . 14 LYS H 1 1 16 9794 1 1 14 LYS HA H -6.399 -6.338 5.663 1.00 . A A . 14 LYS HA 1 1 16 9795 1 1 14 LYS HB2 H -4.577 -8.439 4.561 1.00 . A A . 14 LYS HB2 1 1 16 9796 1 1 14 LYS HB3 H -4.040 -7.478 5.932 1.00 . A A . 14 LYS HB3 1 1 16 9797 1 1 14 LYS HD2 H -4.499 -10.404 6.998 1.00 . A A . 14 LYS HD2 1 1 16 9798 1 1 14 LYS HD3 H -3.878 -8.822 7.475 1.00 . A A . 14 LYS HD3 1 1 16 9799 1 1 14 LYS HE2 H -6.426 -9.997 8.565 1.00 . A A . 14 LYS HE2 1 1 16 9800 1 1 14 LYS HE3 H -4.854 -10.222 9.331 1.00 . A A . 14 LYS HE3 1 1 16 9801 1 1 14 LYS HG2 H -6.420 -8.169 6.870 1.00 . A A . 14 LYS HG2 1 1 16 9802 1 1 14 LYS HG3 H -6.179 -9.522 5.763 1.00 . A A . 14 LYS HG3 1 1 16 9803 1 1 14 LYS HZ1 H -5.767 -7.501 8.702 1.00 . A A . 14 LYS HZ1 1 1 16 9804 1 1 14 LYS HZ2 H -6.397 -8.285 10.062 1.00 . A A . 14 LYS HZ2 1 1 16 9805 1 1 14 LYS HZ3 H -4.731 -8.028 9.931 1.00 . A A . 14 LYS HZ3 1 1 16 9806 1 1 14 LYS N N -6.511 -7.053 3.732 1.00 . A A . 14 LYS N 1 1 16 9807 1 1 14 LYS NZ N -5.596 -8.253 9.400 1.00 . A A . 14 LYS NZ 1 1 16 9808 1 1 14 LYS O O -3.907 -5.646 3.691 1.00 . A A . 14 LYS O 1 1 16 9809 1 1 15 LEU C C -2.689 -3.555 4.924 1.00 . A A . 15 LEU C 1 1 16 9810 1 1 15 LEU CA C -4.168 -3.187 4.955 1.00 . A A . 15 LEU CA 1 1 16 9811 1 1 15 LEU CB C -4.426 -2.133 6.034 1.00 . A A . 15 LEU CB 1 1 16 9812 1 1 15 LEU CD1 C -5.669 0.025 6.324 1.00 . A A . 15 LEU CD1 1 1 16 9813 1 1 15 LEU CD2 C -3.288 0.047 5.554 1.00 . A A . 15 LEU CD2 1 1 16 9814 1 1 15 LEU CG C -4.609 -0.707 5.514 1.00 . A A . 15 LEU CG 1 1 16 9815 1 1 15 LEU H H -5.710 -4.322 5.859 1.00 . A A . 15 LEU H 1 1 16 9816 1 1 15 LEU HA H -4.446 -2.781 3.994 1.00 . A A . 15 LEU HA 1 1 16 9817 1 1 15 LEU HB2 H -5.317 -2.415 6.577 1.00 . A A . 15 LEU HB2 1 1 16 9818 1 1 15 LEU HB3 H -3.592 -2.137 6.720 1.00 . A A . 15 LEU HB3 1 1 16 9819 1 1 15 LEU HD11 H -5.767 -0.441 7.293 1.00 . A A . 15 LEU HD11 1 1 16 9820 1 1 15 LEU HD12 H -5.378 1.057 6.449 1.00 . A A . 15 LEU HD12 1 1 16 9821 1 1 15 LEU HD13 H -6.614 -0.022 5.805 1.00 . A A . 15 LEU HD13 1 1 16 9822 1 1 15 LEU HD21 H -2.471 -0.660 5.540 1.00 . A A . 15 LEU HD21 1 1 16 9823 1 1 15 LEU HD22 H -3.217 0.695 4.694 1.00 . A A . 15 LEU HD22 1 1 16 9824 1 1 15 LEU HD23 H -3.237 0.638 6.456 1.00 . A A . 15 LEU HD23 1 1 16 9825 1 1 15 LEU HG H -4.942 -0.745 4.487 1.00 . A A . 15 LEU HG 1 1 16 9826 1 1 15 LEU N N -4.991 -4.369 5.196 1.00 . A A . 15 LEU N 1 1 16 9827 1 1 15 LEU O O -2.132 -4.011 5.923 1.00 . A A . 15 LEU O 1 1 16 9828 1 1 16 LYS C C 0.181 -3.130 4.765 1.00 . A A . 16 LYS C 1 1 16 9829 1 1 16 LYS CA C -0.647 -3.682 3.603 1.00 . A A . 16 LYS CA 1 1 16 9830 1 1 16 LYS CB C -0.127 -3.120 2.278 1.00 . A A . 16 LYS CB 1 1 16 9831 1 1 16 LYS CD C 0.521 -3.588 -0.104 1.00 . A A . 16 LYS CD 1 1 16 9832 1 1 16 LYS CE C 0.977 -4.725 -1.004 1.00 . A A . 16 LYS CE 1 1 16 9833 1 1 16 LYS CG C -0.204 -4.109 1.126 1.00 . A A . 16 LYS CG 1 1 16 9834 1 1 16 LYS H H -2.560 -3.001 3.007 1.00 . A A . 16 LYS H 1 1 16 9835 1 1 16 LYS HA H -0.557 -4.758 3.587 1.00 . A A . 16 LYS HA 1 1 16 9836 1 1 16 LYS HB2 H -0.711 -2.250 2.016 1.00 . A A . 16 LYS HB2 1 1 16 9837 1 1 16 LYS HB3 H 0.904 -2.826 2.404 1.00 . A A . 16 LYS HB3 1 1 16 9838 1 1 16 LYS HD2 H -0.147 -2.948 -0.660 1.00 . A A . 16 LYS HD2 1 1 16 9839 1 1 16 LYS HD3 H 1.385 -3.022 0.212 1.00 . A A . 16 LYS HD3 1 1 16 9840 1 1 16 LYS HE2 H 1.774 -4.367 -1.639 1.00 . A A . 16 LYS HE2 1 1 16 9841 1 1 16 LYS HE3 H 1.344 -5.531 -0.387 1.00 . A A . 16 LYS HE3 1 1 16 9842 1 1 16 LYS HG2 H 0.250 -5.039 1.432 1.00 . A A . 16 LYS HG2 1 1 16 9843 1 1 16 LYS HG3 H -1.242 -4.277 0.878 1.00 . A A . 16 LYS HG3 1 1 16 9844 1 1 16 LYS HZ1 H -1.048 -5.031 -1.416 1.00 . A A . 16 LYS HZ1 1 1 16 9845 1 1 16 LYS HZ2 H -0.100 -4.776 -2.793 1.00 . A A . 16 LYS HZ2 1 1 16 9846 1 1 16 LYS HZ3 H -0.040 -6.262 -1.987 1.00 . A A . 16 LYS HZ3 1 1 16 9847 1 1 16 LYS N N -2.060 -3.362 3.769 1.00 . A A . 16 LYS N 1 1 16 9848 1 1 16 LYS NZ N -0.130 -5.234 -1.860 1.00 . A A . 16 LYS NZ 1 1 16 9849 1 1 16 LYS O O -0.030 -1.998 5.202 1.00 . A A . 16 LYS O 1 1 16 9850 1 1 17 PRO C C 2.905 -2.342 6.029 1.00 . A A . 17 PRO C 1 1 16 9851 1 1 17 PRO CA C 1.988 -3.501 6.402 1.00 . A A . 17 PRO CA 1 1 16 9852 1 1 17 PRO CB C 2.814 -4.751 6.720 1.00 . A A . 17 PRO CB 1 1 16 9853 1 1 17 PRO CD C 1.457 -5.287 4.829 1.00 . A A . 17 PRO CD 1 1 16 9854 1 1 17 PRO CG C 2.791 -5.556 5.466 1.00 . A A . 17 PRO CG 1 1 16 9855 1 1 17 PRO HA H 1.399 -3.227 7.265 1.00 . A A . 17 PRO HA 1 1 16 9856 1 1 17 PRO HB2 H 3.821 -4.462 6.984 1.00 . A A . 17 PRO HB2 1 1 16 9857 1 1 17 PRO HB3 H 2.361 -5.287 7.540 1.00 . A A . 17 PRO HB3 1 1 16 9858 1 1 17 PRO HD2 H 1.538 -5.326 3.753 1.00 . A A . 17 PRO HD2 1 1 16 9859 1 1 17 PRO HD3 H 0.721 -5.994 5.180 1.00 . A A . 17 PRO HD3 1 1 16 9860 1 1 17 PRO HG2 H 3.590 -5.240 4.812 1.00 . A A . 17 PRO HG2 1 1 16 9861 1 1 17 PRO HG3 H 2.889 -6.605 5.701 1.00 . A A . 17 PRO HG3 1 1 16 9862 1 1 17 PRO N N 1.136 -3.923 5.285 1.00 . A A . 17 PRO N 1 1 16 9863 1 1 17 PRO O O 3.417 -2.277 4.912 1.00 . A A . 17 PRO O 1 1 16 9864 1 1 18 ALA C C 5.387 -0.710 6.396 1.00 . A A . 18 ALA C 1 1 16 9865 1 1 18 ALA CA C 3.968 -0.274 6.742 1.00 . A A . 18 ALA CA 1 1 16 9866 1 1 18 ALA CB C 3.975 0.631 7.965 1.00 . A A . 18 ALA CB 1 1 16 9867 1 1 18 ALA H H 2.674 -1.534 7.843 1.00 . A A . 18 ALA H 1 1 16 9868 1 1 18 ALA HA H 3.560 0.284 5.912 1.00 . A A . 18 ALA HA 1 1 16 9869 1 1 18 ALA HB1 H 4.883 1.216 7.976 1.00 . A A . 18 ALA HB1 1 1 16 9870 1 1 18 ALA HB2 H 3.121 1.292 7.929 1.00 . A A . 18 ALA HB2 1 1 16 9871 1 1 18 ALA HB3 H 3.925 0.028 8.860 1.00 . A A . 18 ALA HB3 1 1 16 9872 1 1 18 ALA N N 3.109 -1.428 6.972 1.00 . A A . 18 ALA N 1 1 16 9873 1 1 18 ALA O O 5.747 -1.875 6.566 1.00 . A A . 18 ALA O 1 1 16 9874 1 1 19 GLY C C 7.651 -1.177 4.500 1.00 . A A . 19 GLY C 1 1 16 9875 1 1 19 GLY CA C 7.560 -0.081 5.546 1.00 . A A . 19 GLY CA 1 1 16 9876 1 1 19 GLY H H 5.849 1.142 5.794 1.00 . A A . 19 GLY H 1 1 16 9877 1 1 19 GLY HA2 H 8.092 -0.399 6.430 1.00 . A A . 19 GLY HA2 1 1 16 9878 1 1 19 GLY HA3 H 8.030 0.811 5.158 1.00 . A A . 19 GLY HA3 1 1 16 9879 1 1 19 GLY N N 6.190 0.230 5.909 1.00 . A A . 19 GLY N 1 1 16 9880 1 1 19 GLY O O 8.682 -1.838 4.372 1.00 . A A . 19 GLY O 1 1 16 9881 1 1 20 THR C C 6.040 -1.797 1.393 1.00 . A A . 20 THR C 1 1 16 9882 1 1 20 THR CA C 6.531 -2.390 2.709 1.00 . A A . 20 THR CA 1 1 16 9883 1 1 20 THR CB C 5.621 -3.545 3.133 1.00 . A A . 20 THR CB 1 1 16 9884 1 1 20 THR CG2 C 5.540 -4.654 2.107 1.00 . A A . 20 THR CG2 1 1 16 9885 1 1 20 THR H H 5.779 -0.810 3.898 1.00 . A A . 20 THR H 1 1 16 9886 1 1 20 THR HA H 7.534 -2.763 2.572 1.00 . A A . 20 THR HA 1 1 16 9887 1 1 20 THR HB H 4.622 -3.164 3.287 1.00 . A A . 20 THR HB 1 1 16 9888 1 1 20 THR HG1 H 6.138 -3.433 5.019 1.00 . A A . 20 THR HG1 1 1 16 9889 1 1 20 THR HG21 H 5.857 -4.278 1.145 1.00 . A A . 20 THR HG21 1 1 16 9890 1 1 20 THR HG22 H 6.183 -5.469 2.405 1.00 . A A . 20 THR HG22 1 1 16 9891 1 1 20 THR HG23 H 4.521 -5.006 2.038 1.00 . A A . 20 THR HG23 1 1 16 9892 1 1 20 THR N N 6.570 -1.369 3.750 1.00 . A A . 20 THR N 1 1 16 9893 1 1 20 THR O O 5.055 -1.060 1.363 1.00 . A A . 20 THR O 1 1 16 9894 1 1 20 THR OG1 O 6.071 -4.117 4.349 1.00 . A A . 20 THR OG1 1 1 16 9895 1 1 21 THR C C 4.930 -1.999 -1.358 1.00 . A A . 21 THR C 1 1 16 9896 1 1 21 THR CA C 6.364 -1.616 -1.010 1.00 . A A . 21 THR CA 1 1 16 9897 1 1 21 THR CB C 7.325 -2.144 -2.077 1.00 . A A . 21 THR CB 1 1 16 9898 1 1 21 THR CG2 C 7.997 -1.039 -2.860 1.00 . A A . 21 THR CG2 1 1 16 9899 1 1 21 THR H H 7.510 -2.712 0.393 1.00 . A A . 21 THR H 1 1 16 9900 1 1 21 THR HA H 6.435 -0.539 -0.981 1.00 . A A . 21 THR HA 1 1 16 9901 1 1 21 THR HB H 6.775 -2.757 -2.776 1.00 . A A . 21 THR HB 1 1 16 9902 1 1 21 THR HG1 H 8.927 -2.380 -0.974 1.00 . A A . 21 THR HG1 1 1 16 9903 1 1 21 THR HG21 H 8.026 -0.141 -2.259 1.00 . A A . 21 THR HG21 1 1 16 9904 1 1 21 THR HG22 H 9.003 -1.336 -3.113 1.00 . A A . 21 THR HG22 1 1 16 9905 1 1 21 THR HG23 H 7.438 -0.848 -3.764 1.00 . A A . 21 THR HG23 1 1 16 9906 1 1 21 THR N N 6.733 -2.121 0.307 1.00 . A A . 21 THR N 1 1 16 9907 1 1 21 THR O O 4.595 -3.181 -1.443 1.00 . A A . 21 THR O 1 1 16 9908 1 1 21 THR OG1 O 8.343 -2.938 -1.493 1.00 . A A . 21 THR OG1 1 1 16 9909 1 1 22 CYS C C 2.453 -1.090 -3.386 1.00 . A A . 22 CYS C 1 1 16 9910 1 1 22 CYS CA C 2.689 -1.220 -1.887 1.00 . A A . 22 CYS CA 1 1 16 9911 1 1 22 CYS CB C 1.797 -0.233 -1.134 1.00 . A A . 22 CYS CB 1 1 16 9912 1 1 22 CYS H H 4.415 -0.071 -1.468 1.00 . A A . 22 CYS H 1 1 16 9913 1 1 22 CYS HA H 2.436 -2.222 -1.581 1.00 . A A . 22 CYS HA 1 1 16 9914 1 1 22 CYS HB2 H 0.763 -0.486 -1.313 1.00 . A A . 22 CYS HB2 1 1 16 9915 1 1 22 CYS HB3 H 2.003 -0.307 -0.077 1.00 . A A . 22 CYS HB3 1 1 16 9916 1 1 22 CYS N N 4.088 -0.991 -1.553 1.00 . A A . 22 CYS N 1 1 16 9917 1 1 22 CYS O O 1.599 -1.774 -3.951 1.00 . A A . 22 CYS O 1 1 16 9918 1 1 22 CYS SG S 2.031 1.506 -1.625 1.00 . A A . 22 CYS SG 1 1 16 9919 1 1 23 TRP C C 4.224 -0.616 -6.230 1.00 . A A . 23 TRP C 1 1 16 9920 1 1 23 TRP CA C 3.069 0.012 -5.460 1.00 . A A . 23 TRP CA 1 1 16 9921 1 1 23 TRP CB C 2.985 1.510 -5.766 1.00 . A A . 23 TRP CB 1 1 16 9922 1 1 23 TRP CD1 C 1.283 0.959 -7.594 1.00 . A A . 23 TRP CD1 1 1 16 9923 1 1 23 TRP CD2 C 1.533 3.147 -7.210 1.00 . A A . 23 TRP CD2 1 1 16 9924 1 1 23 TRP CE2 C 0.577 2.976 -8.229 1.00 . A A . 23 TRP CE2 1 1 16 9925 1 1 23 TRP CE3 C 1.854 4.441 -6.799 1.00 . A A . 23 TRP CE3 1 1 16 9926 1 1 23 TRP CG C 1.971 1.842 -6.818 1.00 . A A . 23 TRP CG 1 1 16 9927 1 1 23 TRP CH2 C 0.277 5.309 -8.420 1.00 . A A . 23 TRP CH2 1 1 16 9928 1 1 23 TRP CZ2 C -0.058 4.052 -8.842 1.00 . A A . 23 TRP CZ2 1 1 16 9929 1 1 23 TRP CZ3 C 1.224 5.510 -7.408 1.00 . A A . 23 TRP CZ3 1 1 16 9930 1 1 23 TRP H H 3.869 0.315 -3.524 1.00 . A A . 23 TRP H 1 1 16 9931 1 1 23 TRP HA H 2.154 -0.458 -5.773 1.00 . A A . 23 TRP HA 1 1 16 9932 1 1 23 TRP HB2 H 2.716 2.041 -4.865 1.00 . A A . 23 TRP HB2 1 1 16 9933 1 1 23 TRP HB3 H 3.948 1.858 -6.109 1.00 . A A . 23 TRP HB3 1 1 16 9934 1 1 23 TRP HD1 H 1.396 -0.111 -7.535 1.00 . A A . 23 TRP HD1 1 1 16 9935 1 1 23 TRP HE1 H -0.157 1.216 -9.101 1.00 . A A . 23 TRP HE1 1 1 16 9936 1 1 23 TRP HE3 H 2.580 4.614 -6.020 1.00 . A A . 23 TRP HE3 1 1 16 9937 1 1 23 TRP HH2 H -0.188 6.172 -8.869 1.00 . A A . 23 TRP HH2 1 1 16 9938 1 1 23 TRP HZ2 H -0.791 3.913 -9.621 1.00 . A A . 23 TRP HZ2 1 1 16 9939 1 1 23 TRP HZ3 H 1.461 6.518 -7.104 1.00 . A A . 23 TRP HZ3 1 1 16 9940 1 1 23 TRP N N 3.208 -0.206 -4.027 1.00 . A A . 23 TRP N 1 1 16 9941 1 1 23 TRP NE1 N 0.442 1.631 -8.446 1.00 . A A . 23 TRP NE1 1 1 16 9942 1 1 23 TRP O O 4.052 -1.623 -6.918 1.00 . A A . 23 TRP O 1 1 16 9943 1 1 24 LYS C C 6.388 -0.499 -8.311 1.00 . A A . 24 LYS C 1 1 16 9944 1 1 24 LYS CA C 6.585 -0.511 -6.797 1.00 . A A . 24 LYS CA 1 1 16 9945 1 1 24 LYS CB C 6.917 -1.926 -6.325 1.00 . A A . 24 LYS CB 1 1 16 9946 1 1 24 LYS CD C 8.532 -3.848 -6.439 1.00 . A A . 24 LYS CD 1 1 16 9947 1 1 24 LYS CE C 9.915 -4.296 -6.881 1.00 . A A . 24 LYS CE 1 1 16 9948 1 1 24 LYS CG C 8.344 -2.351 -6.629 1.00 . A A . 24 LYS CG 1 1 16 9949 1 1 24 LYS H H 5.468 0.781 -5.550 1.00 . A A . 24 LYS H 1 1 16 9950 1 1 24 LYS HA H 7.408 0.143 -6.549 1.00 . A A . 24 LYS HA 1 1 16 9951 1 1 24 LYS HB2 H 6.767 -1.980 -5.257 1.00 . A A . 24 LYS HB2 1 1 16 9952 1 1 24 LYS HB3 H 6.246 -2.621 -6.809 1.00 . A A . 24 LYS HB3 1 1 16 9953 1 1 24 LYS HD2 H 8.404 -4.087 -5.394 1.00 . A A . 24 LYS HD2 1 1 16 9954 1 1 24 LYS HD3 H 7.789 -4.371 -7.024 1.00 . A A . 24 LYS HD3 1 1 16 9955 1 1 24 LYS HE2 H 9.859 -4.643 -7.902 1.00 . A A . 24 LYS HE2 1 1 16 9956 1 1 24 LYS HE3 H 10.588 -3.453 -6.825 1.00 . A A . 24 LYS HE3 1 1 16 9957 1 1 24 LYS HG2 H 8.575 -2.097 -7.653 1.00 . A A . 24 LYS HG2 1 1 16 9958 1 1 24 LYS HG3 H 9.015 -1.826 -5.965 1.00 . A A . 24 LYS HG3 1 1 16 9959 1 1 24 LYS HZ1 H 9.759 -6.177 -5.986 1.00 . A A . 24 LYS HZ1 1 1 16 9960 1 1 24 LYS HZ2 H 11.339 -5.752 -6.415 1.00 . A A . 24 LYS HZ2 1 1 16 9961 1 1 24 LYS HZ3 H 10.612 -5.047 -5.061 1.00 . A A . 24 LYS HZ3 1 1 16 9962 1 1 24 LYS N N 5.398 -0.015 -6.112 1.00 . A A . 24 LYS N 1 1 16 9963 1 1 24 LYS NZ N 10.443 -5.395 -6.026 1.00 . A A . 24 LYS NZ 1 1 16 9964 1 1 24 LYS O O 6.993 -1.294 -9.030 1.00 . A A . 24 LYS O 1 1 16 9965 1 1 25 THR C C 6.558 0.799 -10.989 1.00 . A A . 25 THR C 1 1 16 9966 1 1 25 THR CA C 5.270 0.523 -10.218 1.00 . A A . 25 THR CA 1 1 16 9967 1 1 25 THR CB C 4.250 1.635 -10.478 1.00 . A A . 25 THR CB 1 1 16 9968 1 1 25 THR CG2 C 3.904 1.805 -11.941 1.00 . A A . 25 THR CG2 1 1 16 9969 1 1 25 THR H H 5.090 1.017 -8.167 1.00 . A A . 25 THR H 1 1 16 9970 1 1 25 THR HA H 4.858 -0.417 -10.554 1.00 . A A . 25 THR HA 1 1 16 9971 1 1 25 THR HB H 4.654 2.573 -10.124 1.00 . A A . 25 THR HB 1 1 16 9972 1 1 25 THR HG1 H 2.560 2.202 -9.666 1.00 . A A . 25 THR HG1 1 1 16 9973 1 1 25 THR HG21 H 3.560 0.863 -12.341 1.00 . A A . 25 THR HG21 1 1 16 9974 1 1 25 THR HG22 H 3.124 2.546 -12.042 1.00 . A A . 25 THR HG22 1 1 16 9975 1 1 25 THR HG23 H 4.780 2.128 -12.483 1.00 . A A . 25 THR HG23 1 1 16 9976 1 1 25 THR N N 5.541 0.408 -8.789 1.00 . A A . 25 THR N 1 1 16 9977 1 1 25 THR O O 7.563 1.209 -10.407 1.00 . A A . 25 THR O 1 1 16 9978 1 1 25 THR OG1 O 3.044 1.381 -9.780 1.00 . A A . 25 THR OG1 1 1 16 9979 1 1 26 SER C C 8.334 2.146 -12.855 1.00 . A A . 26 SER C 1 1 16 9980 1 1 26 SER CA C 7.694 0.793 -13.149 1.00 . A A . 26 SER CA 1 1 16 9981 1 1 26 SER CB C 7.301 0.711 -14.625 1.00 . A A . 26 SER CB 1 1 16 9982 1 1 26 SER H H 5.695 0.242 -12.706 1.00 . A A . 26 SER H 1 1 16 9983 1 1 26 SER HA H 8.410 0.018 -12.933 1.00 . A A . 26 SER HA 1 1 16 9984 1 1 26 SER HB2 H 8.181 0.841 -15.237 1.00 . A A . 26 SER HB2 1 1 16 9985 1 1 26 SER HB3 H 6.862 -0.255 -14.825 1.00 . A A . 26 SER HB3 1 1 16 9986 1 1 26 SER HG H 6.437 1.929 -15.893 1.00 . A A . 26 SER HG 1 1 16 9987 1 1 26 SER N N 6.524 0.570 -12.300 1.00 . A A . 26 SER N 1 1 16 9988 1 1 26 SER O O 9.554 2.258 -12.738 1.00 . A A . 26 SER O 1 1 16 9989 1 1 26 SER OG O 6.362 1.718 -14.960 1.00 . A A . 26 SER OG 1 1 16 9990 1 1 27 VAL C C 7.458 5.005 -11.096 1.00 . A A . 27 VAL C 1 1 16 9991 1 1 27 VAL CA C 7.968 4.518 -12.450 1.00 . A A . 27 VAL CA 1 1 16 9992 1 1 27 VAL CB C 7.518 5.511 -13.540 1.00 . A A . 27 VAL CB 1 1 16 9993 1 1 27 VAL CG1 C 7.947 6.930 -13.192 1.00 . A A . 27 VAL CG1 1 1 16 9994 1 1 27 VAL CG2 C 8.069 5.098 -14.896 1.00 . A A . 27 VAL CG2 1 1 16 9995 1 1 27 VAL H H 6.537 3.008 -12.838 1.00 . A A . 27 VAL H 1 1 16 9996 1 1 27 VAL HA H 9.048 4.499 -12.432 1.00 . A A . 27 VAL HA 1 1 16 9997 1 1 27 VAL HB H 6.439 5.489 -13.594 1.00 . A A . 27 VAL HB 1 1 16 9998 1 1 27 VAL HG11 H 9.023 6.971 -13.107 1.00 . A A . 27 VAL HG11 1 1 16 9999 1 1 27 VAL HG12 H 7.621 7.606 -13.969 1.00 . A A . 27 VAL HG12 1 1 16 10000 1 1 27 VAL HG13 H 7.500 7.221 -12.252 1.00 . A A . 27 VAL HG13 1 1 16 10001 1 1 27 VAL HG21 H 9.047 4.659 -14.769 1.00 . A A . 27 VAL HG21 1 1 16 10002 1 1 27 VAL HG22 H 7.406 4.375 -15.348 1.00 . A A . 27 VAL HG22 1 1 16 10003 1 1 27 VAL HG23 H 8.144 5.966 -15.534 1.00 . A A . 27 VAL HG23 1 1 16 10004 1 1 27 VAL N N 7.497 3.168 -12.735 1.00 . A A . 27 VAL N 1 1 16 10005 1 1 27 VAL O O 8.036 5.910 -10.495 1.00 . A A . 27 VAL O 1 1 16 10006 1 1 28 SER C C 6.043 3.761 -8.270 1.00 . A A . 28 SER C 1 1 16 10007 1 1 28 SER CA C 5.776 4.801 -9.354 1.00 . A A . 28 SER CA 1 1 16 10008 1 1 28 SER CB C 4.269 5.013 -9.516 1.00 . A A . 28 SER CB 1 1 16 10009 1 1 28 SER H H 5.939 3.703 -11.153 1.00 . A A . 28 SER H 1 1 16 10010 1 1 28 SER HA H 6.228 5.735 -9.055 1.00 . A A . 28 SER HA 1 1 16 10011 1 1 28 SER HB2 H 4.015 4.984 -10.565 1.00 . A A . 28 SER HB2 1 1 16 10012 1 1 28 SER HB3 H 3.738 4.229 -8.995 1.00 . A A . 28 SER HB3 1 1 16 10013 1 1 28 SER HG H 4.249 6.972 -9.515 1.00 . A A . 28 SER HG 1 1 16 10014 1 1 28 SER N N 6.365 4.411 -10.627 1.00 . A A . 28 SER N 1 1 16 10015 1 1 28 SER O O 5.236 2.858 -8.049 1.00 . A A . 28 SER O 1 1 16 10016 1 1 28 SER OG O 3.870 6.265 -8.986 1.00 . A A . 28 SER OG 1 1 16 10017 1 1 29 SER C C 7.276 3.660 -5.149 1.00 . A A . 29 SER C 1 1 16 10018 1 1 29 SER CA C 7.526 2.994 -6.498 1.00 . A A . 29 SER CA 1 1 16 10019 1 1 29 SER CB C 8.991 2.571 -6.615 1.00 . A A . 29 SER CB 1 1 16 10020 1 1 29 SER H H 7.764 4.657 -7.787 1.00 . A A . 29 SER H 1 1 16 10021 1 1 29 SER HA H 6.894 2.120 -6.579 1.00 . A A . 29 SER HA 1 1 16 10022 1 1 29 SER HB2 H 9.197 2.270 -7.632 1.00 . A A . 29 SER HB2 1 1 16 10023 1 1 29 SER HB3 H 9.626 3.404 -6.350 1.00 . A A . 29 SER HB3 1 1 16 10024 1 1 29 SER HG H 10.011 1.719 -5.175 1.00 . A A . 29 SER HG 1 1 16 10025 1 1 29 SER N N 7.168 3.907 -7.578 1.00 . A A . 29 SER N 1 1 16 10026 1 1 29 SER O O 8.019 4.553 -4.742 1.00 . A A . 29 SER O 1 1 16 10027 1 1 29 SER OG O 9.280 1.485 -5.752 1.00 . A A . 29 SER OG 1 1 16 10028 1 1 30 HIS C C 5.627 2.737 -2.134 1.00 . A A . 30 HIS C 1 1 16 10029 1 1 30 HIS CA C 5.849 3.820 -3.185 1.00 . A A . 30 HIS CA 1 1 16 10030 1 1 30 HIS CB C 4.585 4.671 -3.342 1.00 . A A . 30 HIS CB 1 1 16 10031 1 1 30 HIS CD2 C 4.869 5.252 -5.848 1.00 . A A . 30 HIS CD2 1 1 16 10032 1 1 30 HIS CE1 C 4.468 7.402 -5.745 1.00 . A A . 30 HIS CE1 1 1 16 10033 1 1 30 HIS CG C 4.612 5.551 -4.555 1.00 . A A . 30 HIS CG 1 1 16 10034 1 1 30 HIS H H 5.646 2.540 -4.857 1.00 . A A . 30 HIS H 1 1 16 10035 1 1 30 HIS HA H 6.661 4.455 -2.866 1.00 . A A . 30 HIS HA 1 1 16 10036 1 1 30 HIS HB2 H 3.728 4.015 -3.430 1.00 . A A . 30 HIS HB2 1 1 16 10037 1 1 30 HIS HB3 H 4.467 5.299 -2.473 1.00 . A A . 30 HIS HB3 1 1 16 10038 1 1 30 HIS HD1 H 4.145 7.431 -3.722 1.00 . A A . 30 HIS HD1 1 1 16 10039 1 1 30 HIS HD2 H 5.102 4.275 -6.239 1.00 . A A . 30 HIS HD2 1 1 16 10040 1 1 30 HIS HE1 H 4.328 8.434 -6.027 1.00 . A A . 30 HIS HE1 1 1 16 10041 1 1 30 HIS HE2 H 4.999 6.520 -7.514 1.00 . A A . 30 HIS HE2 1 1 16 10042 1 1 30 HIS N N 6.212 3.241 -4.473 1.00 . A A . 30 HIS N 1 1 16 10043 1 1 30 HIS ND1 N 4.365 6.908 -4.521 1.00 . A A . 30 HIS ND1 1 1 16 10044 1 1 30 HIS NE2 N 4.774 6.416 -6.566 1.00 . A A . 30 HIS NE2 1 1 16 10045 1 1 30 HIS O O 5.146 1.647 -2.442 1.00 . A A . 30 HIS O 1 1 16 10046 1 1 31 TYR C C 4.479 2.314 0.908 1.00 . A A . 31 TYR C 1 1 16 10047 1 1 31 TYR CA C 5.819 2.108 0.211 1.00 . A A . 31 TYR CA 1 1 16 10048 1 1 31 TYR CB C 6.961 2.267 1.216 1.00 . A A . 31 TYR CB 1 1 16 10049 1 1 31 TYR CD1 C 8.775 0.603 1.777 1.00 . A A . 31 TYR CD1 1 1 16 10050 1 1 31 TYR CD2 C 8.785 1.591 -0.393 1.00 . A A . 31 TYR CD2 1 1 16 10051 1 1 31 TYR CE1 C 9.905 -0.125 1.456 1.00 . A A . 31 TYR CE1 1 1 16 10052 1 1 31 TYR CE2 C 9.915 0.866 -0.722 1.00 . A A . 31 TYR CE2 1 1 16 10053 1 1 31 TYR CG C 8.197 1.472 0.860 1.00 . A A . 31 TYR CG 1 1 16 10054 1 1 31 TYR CZ C 10.470 0.010 0.206 1.00 . A A . 31 TYR CZ 1 1 16 10055 1 1 31 TYR H H 6.356 3.937 -0.710 1.00 . A A . 31 TYR H 1 1 16 10056 1 1 31 TYR HA H 5.848 1.111 -0.199 1.00 . A A . 31 TYR HA 1 1 16 10057 1 1 31 TYR HB2 H 7.241 3.308 1.270 1.00 . A A . 31 TYR HB2 1 1 16 10058 1 1 31 TYR HB3 H 6.623 1.939 2.188 1.00 . A A . 31 TYR HB3 1 1 16 10059 1 1 31 TYR HD1 H 8.329 0.499 2.755 1.00 . A A . 31 TYR HD1 1 1 16 10060 1 1 31 TYR HD2 H 8.348 2.263 -1.116 1.00 . A A . 31 TYR HD2 1 1 16 10061 1 1 31 TYR HE1 H 10.339 -0.796 2.182 1.00 . A A . 31 TYR HE1 1 1 16 10062 1 1 31 TYR HE2 H 10.358 0.972 -1.701 1.00 . A A . 31 TYR HE2 1 1 16 10063 1 1 31 TYR HH H 11.432 -1.646 0.037 1.00 . A A . 31 TYR HH 1 1 16 10064 1 1 31 TYR N N 5.979 3.050 -0.891 1.00 . A A . 31 TYR N 1 1 16 10065 1 1 31 TYR O O 3.778 3.292 0.650 1.00 . A A . 31 TYR O 1 1 16 10066 1 1 31 TYR OH O 11.595 -0.713 -0.118 1.00 . A A . 31 TYR OH 1 1 16 10067 1 1 32 CYS C C 3.091 2.046 3.915 1.00 . A A . 32 CYS C 1 1 16 10068 1 1 32 CYS CA C 2.872 1.469 2.523 1.00 . A A . 32 CYS CA 1 1 16 10069 1 1 32 CYS CB C 2.227 0.085 2.631 1.00 . A A . 32 CYS CB 1 1 16 10070 1 1 32 CYS H H 4.726 0.629 1.956 1.00 . A A . 32 CYS H 1 1 16 10071 1 1 32 CYS HA H 2.212 2.123 1.975 1.00 . A A . 32 CYS HA 1 1 16 10072 1 1 32 CYS HB2 H 2.549 -0.520 1.797 1.00 . A A . 32 CYS HB2 1 1 16 10073 1 1 32 CYS HB3 H 2.548 -0.381 3.551 1.00 . A A . 32 CYS HB3 1 1 16 10074 1 1 32 CYS N N 4.127 1.386 1.792 1.00 . A A . 32 CYS N 1 1 16 10075 1 1 32 CYS O O 4.162 1.892 4.502 1.00 . A A . 32 CYS O 1 1 16 10076 1 1 32 CYS SG S 0.405 0.109 2.626 1.00 . A A . 32 CYS SG 1 1 16 10077 1 1 33 THR C C 1.270 2.522 6.752 1.00 . A A . 33 THR C 1 1 16 10078 1 1 33 THR CA C 2.138 3.300 5.767 1.00 . A A . 33 THR CA 1 1 16 10079 1 1 33 THR CB C 1.690 4.763 5.723 1.00 . A A . 33 THR CB 1 1 16 10080 1 1 33 THR CG2 C 2.215 5.518 4.520 1.00 . A A . 33 THR CG2 1 1 16 10081 1 1 33 THR H H 1.238 2.789 3.923 1.00 . A A . 33 THR H 1 1 16 10082 1 1 33 THR HA H 3.165 3.256 6.096 1.00 . A A . 33 THR HA 1 1 16 10083 1 1 33 THR HB H 2.050 5.265 6.610 1.00 . A A . 33 THR HB 1 1 16 10084 1 1 33 THR HG1 H -0.010 5.529 6.323 1.00 . A A . 33 THR HG1 1 1 16 10085 1 1 33 THR HG21 H 2.095 4.911 3.635 1.00 . A A . 33 THR HG21 1 1 16 10086 1 1 33 THR HG22 H 1.662 6.438 4.404 1.00 . A A . 33 THR HG22 1 1 16 10087 1 1 33 THR HG23 H 3.262 5.742 4.664 1.00 . A A . 33 THR HG23 1 1 16 10088 1 1 33 THR N N 2.066 2.706 4.439 1.00 . A A . 33 THR N 1 1 16 10089 1 1 33 THR O O 0.984 2.998 7.851 1.00 . A A . 33 THR O 1 1 16 10090 1 1 33 THR OG1 O 0.277 4.854 5.703 1.00 . A A . 33 THR OG1 1 1 16 10091 1 1 34 GLY C C -1.117 1.272 7.851 1.00 . A A . 34 GLY C 1 1 16 10092 1 1 34 GLY CA C 0.017 0.494 7.207 1.00 . A A . 34 GLY CA 1 1 16 10093 1 1 34 GLY H H 1.112 0.993 5.462 1.00 . A A . 34 GLY H 1 1 16 10094 1 1 34 GLY HA2 H 0.633 0.068 7.985 1.00 . A A . 34 GLY HA2 1 1 16 10095 1 1 34 GLY HA3 H -0.403 -0.307 6.617 1.00 . A A . 34 GLY HA3 1 1 16 10096 1 1 34 GLY N N 0.851 1.321 6.350 1.00 . A A . 34 GLY N 1 1 16 10097 1 1 34 GLY O O -1.524 0.973 8.974 1.00 . A A . 34 GLY O 1 1 16 10098 1 1 35 ARG C C -3.930 3.063 6.745 1.00 . A A . 35 ARG C 1 1 16 10099 1 1 35 ARG CA C -2.708 3.106 7.660 1.00 . A A . 35 ARG CA 1 1 16 10100 1 1 35 ARG CB C -2.237 4.551 7.828 1.00 . A A . 35 ARG CB 1 1 16 10101 1 1 35 ARG CD C -4.182 5.864 8.726 1.00 . A A . 35 ARG CD 1 1 16 10102 1 1 35 ARG CG C -2.830 5.246 9.043 1.00 . A A . 35 ARG CG 1 1 16 10103 1 1 35 ARG CZ C -6.160 6.705 9.932 1.00 . A A . 35 ARG CZ 1 1 16 10104 1 1 35 ARG H H -1.251 2.473 6.257 1.00 . A A . 35 ARG H 1 1 16 10105 1 1 35 ARG HA H -2.987 2.716 8.626 1.00 . A A . 35 ARG HA 1 1 16 10106 1 1 35 ARG HB2 H -1.162 4.558 7.925 1.00 . A A . 35 ARG HB2 1 1 16 10107 1 1 35 ARG HB3 H -2.514 5.113 6.948 1.00 . A A . 35 ARG HB3 1 1 16 10108 1 1 35 ARG HD2 H -4.026 6.771 8.162 1.00 . A A . 35 ARG HD2 1 1 16 10109 1 1 35 ARG HD3 H -4.753 5.165 8.132 1.00 . A A . 35 ARG HD3 1 1 16 10110 1 1 35 ARG HE H -4.507 5.998 10.798 1.00 . A A . 35 ARG HE 1 1 16 10111 1 1 35 ARG HG2 H -2.953 4.523 9.835 1.00 . A A . 35 ARG HG2 1 1 16 10112 1 1 35 ARG HG3 H -2.154 6.025 9.365 1.00 . A A . 35 ARG HG3 1 1 16 10113 1 1 35 ARG HH11 H -6.315 6.776 7.917 1.00 . A A . 35 ARG HH11 1 1 16 10114 1 1 35 ARG HH12 H -7.692 7.361 8.788 1.00 . A A . 35 ARG HH12 1 1 16 10115 1 1 35 ARG HH21 H -6.317 6.768 11.946 1.00 . A A . 35 ARG HH21 1 1 16 10116 1 1 35 ARG HH22 H -7.694 7.357 11.075 1.00 . A A . 35 ARG HH22 1 1 16 10117 1 1 35 ARG N N -1.622 2.279 7.143 1.00 . A A . 35 ARG N 1 1 16 10118 1 1 35 ARG NE N -4.936 6.183 9.937 1.00 . A A . 35 ARG NE 1 1 16 10119 1 1 35 ARG NH1 N -6.772 6.969 8.784 1.00 . A A . 35 ARG NH1 1 1 16 10120 1 1 35 ARG NH2 N -6.774 6.965 11.078 1.00 . A A . 35 ARG NH2 1 1 16 10121 1 1 35 ARG O O -5.066 3.140 7.212 1.00 . A A . 35 ARG O 1 1 16 10122 1 1 36 SER C C -4.320 2.311 3.145 1.00 . A A . 36 SER C 1 1 16 10123 1 1 36 SER CA C -4.786 2.899 4.473 1.00 . A A . 36 SER CA 1 1 16 10124 1 1 36 SER CB C -5.353 4.303 4.251 1.00 . A A . 36 SER CB 1 1 16 10125 1 1 36 SER H H -2.770 2.891 5.125 1.00 . A A . 36 SER H 1 1 16 10126 1 1 36 SER HA H -5.562 2.269 4.879 1.00 . A A . 36 SER HA 1 1 16 10127 1 1 36 SER HB2 H -6.366 4.226 3.886 1.00 . A A . 36 SER HB2 1 1 16 10128 1 1 36 SER HB3 H -5.347 4.843 5.187 1.00 . A A . 36 SER HB3 1 1 16 10129 1 1 36 SER HG H -3.723 5.229 3.681 1.00 . A A . 36 SER HG 1 1 16 10130 1 1 36 SER N N -3.695 2.945 5.442 1.00 . A A . 36 SER N 1 1 16 10131 1 1 36 SER O O -3.129 2.079 2.940 1.00 . A A . 36 SER O 1 1 16 10132 1 1 36 SER OG O -4.582 5.022 3.305 1.00 . A A . 36 SER OG 1 1 16 10133 1 1 37 CYS C C -4.416 2.581 -0.014 1.00 . A A . 37 CYS C 1 1 16 10134 1 1 37 CYS CA C -4.963 1.514 0.933 1.00 . A A . 37 CYS CA 1 1 16 10135 1 1 37 CYS CB C -6.212 0.873 0.323 1.00 . A A . 37 CYS CB 1 1 16 10136 1 1 37 CYS H H -6.202 2.282 2.468 1.00 . A A . 37 CYS H 1 1 16 10137 1 1 37 CYS HA H -4.211 0.752 1.068 1.00 . A A . 37 CYS HA 1 1 16 10138 1 1 37 CYS HB2 H -7.057 1.524 0.487 1.00 . A A . 37 CYS HB2 1 1 16 10139 1 1 37 CYS HB3 H -6.060 0.748 -0.738 1.00 . A A . 37 CYS HB3 1 1 16 10140 1 1 37 CYS N N -5.271 2.074 2.245 1.00 . A A . 37 CYS N 1 1 16 10141 1 1 37 CYS O O -3.962 2.270 -1.115 1.00 . A A . 37 CYS O 1 1 16 10142 1 1 37 CYS SG S -6.627 -0.759 1.021 1.00 . A A . 37 CYS SG 1 1 16 10143 1 1 38 GLU C C -2.452 5.089 -0.258 1.00 . A A . 38 GLU C 1 1 16 10144 1 1 38 GLU CA C -3.964 4.941 -0.401 1.00 . A A . 38 GLU CA 1 1 16 10145 1 1 38 GLU CB C -4.655 6.248 -0.006 1.00 . A A . 38 GLU CB 1 1 16 10146 1 1 38 GLU CD C -6.574 6.013 1.619 1.00 . A A . 38 GLU CD 1 1 16 10147 1 1 38 GLU CG C -6.159 6.113 0.165 1.00 . A A . 38 GLU CG 1 1 16 10148 1 1 38 GLU H H -4.832 4.032 1.302 1.00 . A A . 38 GLU H 1 1 16 10149 1 1 38 GLU HA H -4.196 4.719 -1.432 1.00 . A A . 38 GLU HA 1 1 16 10150 1 1 38 GLU HB2 H -4.238 6.594 0.928 1.00 . A A . 38 GLU HB2 1 1 16 10151 1 1 38 GLU HB3 H -4.466 6.987 -0.771 1.00 . A A . 38 GLU HB3 1 1 16 10152 1 1 38 GLU HG2 H -6.638 6.977 -0.271 1.00 . A A . 38 GLU HG2 1 1 16 10153 1 1 38 GLU HG3 H -6.489 5.222 -0.351 1.00 . A A . 38 GLU HG3 1 1 16 10154 1 1 38 GLU N N -4.459 3.840 0.416 1.00 . A A . 38 GLU N 1 1 16 10155 1 1 38 GLU O O -1.963 5.635 0.730 1.00 . A A . 38 GLU O 1 1 16 10156 1 1 38 GLU OE1 O -6.078 6.818 2.435 1.00 . A A . 38 GLU OE1 1 1 16 10157 1 1 38 GLU OE2 O -7.395 5.129 1.943 1.00 . A A . 38 GLU OE2 1 1 16 10158 1 1 39 CYS C C 0.207 6.129 -1.292 1.00 . A A . 39 CYS C 1 1 16 10159 1 1 39 CYS CA C -0.261 4.676 -1.235 1.00 . A A . 39 CYS CA 1 1 16 10160 1 1 39 CYS CB C 0.330 3.890 -2.408 1.00 . A A . 39 CYS CB 1 1 16 10161 1 1 39 CYS H H -2.164 4.174 -2.014 1.00 . A A . 39 CYS H 1 1 16 10162 1 1 39 CYS HA H 0.083 4.237 -0.310 1.00 . A A . 39 CYS HA 1 1 16 10163 1 1 39 CYS HB2 H -0.179 4.176 -3.317 1.00 . A A . 39 CYS HB2 1 1 16 10164 1 1 39 CYS HB3 H 1.379 4.128 -2.499 1.00 . A A . 39 CYS HB3 1 1 16 10165 1 1 39 CYS N N -1.717 4.598 -1.252 1.00 . A A . 39 CYS N 1 1 16 10166 1 1 39 CYS O O -0.460 6.982 -1.877 1.00 . A A . 39 CYS O 1 1 16 10167 1 1 39 CYS SG S 0.184 2.083 -2.239 1.00 . A A . 39 CYS SG 1 1 16 10168 1 1 40 PRO C C 2.403 8.232 -2.042 1.00 . A A . 40 PRO C 1 1 16 10169 1 1 40 PRO CA C 1.923 7.786 -0.665 1.00 . A A . 40 PRO CA 1 1 16 10170 1 1 40 PRO CB C 3.103 7.677 0.303 1.00 . A A . 40 PRO CB 1 1 16 10171 1 1 40 PRO CD C 2.225 5.471 0.040 1.00 . A A . 40 PRO CD 1 1 16 10172 1 1 40 PRO CG C 3.496 6.242 0.262 1.00 . A A . 40 PRO CG 1 1 16 10173 1 1 40 PRO HA H 1.208 8.502 -0.287 1.00 . A A . 40 PRO HA 1 1 16 10174 1 1 40 PRO HB2 H 3.906 8.318 -0.030 1.00 . A A . 40 PRO HB2 1 1 16 10175 1 1 40 PRO HB3 H 2.788 7.971 1.294 1.00 . A A . 40 PRO HB3 1 1 16 10176 1 1 40 PRO HD2 H 2.416 4.595 -0.563 1.00 . A A . 40 PRO HD2 1 1 16 10177 1 1 40 PRO HD3 H 1.782 5.192 0.984 1.00 . A A . 40 PRO HD3 1 1 16 10178 1 1 40 PRO HG2 H 4.185 6.073 -0.553 1.00 . A A . 40 PRO HG2 1 1 16 10179 1 1 40 PRO HG3 H 3.948 5.957 1.201 1.00 . A A . 40 PRO HG3 1 1 16 10180 1 1 40 PRO N N 1.367 6.429 -0.681 1.00 . A A . 40 PRO N 1 1 16 10181 1 1 40 PRO O O 2.338 7.474 -3.009 1.00 . A A . 40 PRO O 1 1 16 10182 1 1 41 SER C C 4.890 9.845 -3.494 1.00 . A A . 41 SER C 1 1 16 10183 1 1 41 SER CA C 3.378 10.017 -3.379 1.00 . A A . 41 SER CA 1 1 16 10184 1 1 41 SER CB C 3.010 11.498 -3.491 1.00 . A A . 41 SER CB 1 1 16 10185 1 1 41 SER H H 2.911 10.023 -1.314 1.00 . A A . 41 SER H 1 1 16 10186 1 1 41 SER HA H 2.905 9.475 -4.185 1.00 . A A . 41 SER HA 1 1 16 10187 1 1 41 SER HB2 H 3.812 12.031 -3.978 1.00 . A A . 41 SER HB2 1 1 16 10188 1 1 41 SER HB3 H 2.106 11.598 -4.073 1.00 . A A . 41 SER HB3 1 1 16 10189 1 1 41 SER HG H 2.964 13.012 -2.249 1.00 . A A . 41 SER HG 1 1 16 10190 1 1 41 SER N N 2.886 9.467 -2.121 1.00 . A A . 41 SER N 1 1 16 10191 1 1 41 SER O O 5.428 9.726 -4.595 1.00 . A A . 41 SER O 1 1 16 10192 1 1 41 SER OG O 2.795 12.068 -2.212 1.00 . A A . 41 SER OG 1 1 16 10193 1 1 42 TYR C C 7.400 8.210 -2.132 1.00 . A A . 42 TYR C 1 1 16 10194 1 1 42 TYR CA C 7.018 9.675 -2.330 1.00 . A A . 42 TYR CA 1 1 16 10195 1 1 42 TYR CB C 7.630 10.532 -1.220 1.00 . A A . 42 TYR CB 1 1 16 10196 1 1 42 TYR CD1 C 8.115 9.276 0.915 1.00 . A A . 42 TYR CD1 1 1 16 10197 1 1 42 TYR CD2 C 6.048 10.451 0.746 1.00 . A A . 42 TYR CD2 1 1 16 10198 1 1 42 TYR CE1 C 7.778 8.858 2.188 1.00 . A A . 42 TYR CE1 1 1 16 10199 1 1 42 TYR CE2 C 5.704 10.038 2.019 1.00 . A A . 42 TYR CE2 1 1 16 10200 1 1 42 TYR CG C 7.257 10.078 0.173 1.00 . A A . 42 TYR CG 1 1 16 10201 1 1 42 TYR CZ C 6.572 9.241 2.735 1.00 . A A . 42 TYR CZ 1 1 16 10202 1 1 42 TYR H H 5.086 9.933 -1.506 1.00 . A A . 42 TYR H 1 1 16 10203 1 1 42 TYR HA H 7.402 10.008 -3.283 1.00 . A A . 42 TYR HA 1 1 16 10204 1 1 42 TYR HB2 H 8.706 10.499 -1.302 1.00 . A A . 42 TYR HB2 1 1 16 10205 1 1 42 TYR HB3 H 7.296 11.553 -1.338 1.00 . A A . 42 TYR HB3 1 1 16 10206 1 1 42 TYR HD1 H 9.059 8.977 0.483 1.00 . A A . 42 TYR HD1 1 1 16 10207 1 1 42 TYR HD2 H 5.370 11.075 0.182 1.00 . A A . 42 TYR HD2 1 1 16 10208 1 1 42 TYR HE1 H 8.459 8.234 2.748 1.00 . A A . 42 TYR HE1 1 1 16 10209 1 1 42 TYR HE2 H 4.759 10.338 2.446 1.00 . A A . 42 TYR HE2 1 1 16 10210 1 1 42 TYR HH H 5.308 8.572 4.020 1.00 . A A . 42 TYR HH 1 1 16 10211 1 1 42 TYR N N 5.569 9.834 -2.353 1.00 . A A . 42 TYR N 1 1 16 10212 1 1 42 TYR O O 6.684 7.458 -1.471 1.00 . A A . 42 TYR O 1 1 16 10213 1 1 42 TYR OH O 6.233 8.827 4.003 1.00 . A A . 42 TYR OH 1 1 16 10214 1 1 43 PRO C C 9.562 6.092 -1.200 1.00 . A A . 43 PRO C 1 1 16 10215 1 1 43 PRO CA C 9.010 6.401 -2.588 1.00 . A A . 43 PRO CA 1 1 16 10216 1 1 43 PRO CB C 10.120 6.322 -3.636 1.00 . A A . 43 PRO CB 1 1 16 10217 1 1 43 PRO CD C 9.453 8.613 -3.512 1.00 . A A . 43 PRO CD 1 1 16 10218 1 1 43 PRO CG C 10.639 7.714 -3.734 1.00 . A A . 43 PRO CG 1 1 16 10219 1 1 43 PRO HA H 8.230 5.694 -2.830 1.00 . A A . 43 PRO HA 1 1 16 10220 1 1 43 PRO HB2 H 10.885 5.635 -3.304 1.00 . A A . 43 PRO HB2 1 1 16 10221 1 1 43 PRO HB3 H 9.709 5.987 -4.576 1.00 . A A . 43 PRO HB3 1 1 16 10222 1 1 43 PRO HD2 H 9.748 9.500 -2.971 1.00 . A A . 43 PRO HD2 1 1 16 10223 1 1 43 PRO HD3 H 9.000 8.880 -4.456 1.00 . A A . 43 PRO HD3 1 1 16 10224 1 1 43 PRO HG2 H 11.385 7.882 -2.971 1.00 . A A . 43 PRO HG2 1 1 16 10225 1 1 43 PRO HG3 H 11.058 7.881 -4.715 1.00 . A A . 43 PRO HG3 1 1 16 10226 1 1 43 PRO N N 8.538 7.783 -2.705 1.00 . A A . 43 PRO N 1 1 16 10227 1 1 43 PRO O O 9.639 6.971 -0.342 1.00 . A A . 43 PRO O 1 1 16 10228 1 1 44 GLY C C 11.824 5.084 0.594 1.00 . A A . 44 GLY C 1 1 16 10229 1 1 44 GLY CA C 10.486 4.436 0.298 1.00 . A A . 44 GLY CA 1 1 16 10230 1 1 44 GLY H H 9.862 4.180 -1.708 1.00 . A A . 44 GLY H 1 1 16 10231 1 1 44 GLY HA2 H 10.610 3.363 0.305 1.00 . A A . 44 GLY HA2 1 1 16 10232 1 1 44 GLY HA3 H 9.786 4.712 1.073 1.00 . A A . 44 GLY HA3 1 1 16 10233 1 1 44 GLY N N 9.946 4.838 -0.987 1.00 . A A . 44 GLY N 1 1 16 10234 1 1 44 GLY O O 12.870 4.445 0.481 1.00 . A A . 44 GLY O 1 1 16 10235 1 1 45 ASN C C 12.711 8.284 2.191 1.00 . A A . 45 ASN C 1 1 16 10236 1 1 45 ASN CA C 13.011 7.094 1.285 1.00 . A A . 45 ASN CA 1 1 16 10237 1 1 45 ASN CB C 13.685 7.574 -0.001 1.00 . A A . 45 ASN CB 1 1 16 10238 1 1 45 ASN CG C 14.579 6.514 -0.616 1.00 . A A . 45 ASN CG 1 1 16 10239 1 1 45 ASN H H 10.927 6.813 1.044 1.00 . A A . 45 ASN H 1 1 16 10240 1 1 45 ASN HA H 13.680 6.422 1.803 1.00 . A A . 45 ASN HA 1 1 16 10241 1 1 45 ASN HB2 H 12.926 7.839 -0.721 1.00 . A A . 45 ASN HB2 1 1 16 10242 1 1 45 ASN HB3 H 14.287 8.444 0.219 1.00 . A A . 45 ASN HB3 1 1 16 10243 1 1 45 ASN HD21 H 15.740 6.522 0.998 1.00 . A A . 45 ASN HD21 1 1 16 10244 1 1 45 ASN HD22 H 16.207 5.431 -0.258 1.00 . A A . 45 ASN HD22 1 1 16 10245 1 1 45 ASN N N 11.792 6.358 0.973 1.00 . A A . 45 ASN N 1 1 16 10246 1 1 45 ASN ND2 N 15.613 6.116 0.115 1.00 . A A . 45 ASN ND2 1 1 16 10247 1 1 45 ASN O O 13.295 8.421 3.266 1.00 . A A . 45 ASN O 1 1 16 10248 1 1 45 ASN OD1 O 14.342 6.059 -1.734 1.00 . A A . 45 ASN OD1 1 1 16 10249 1 1 46 GLY C C 12.071 11.581 2.004 1.00 . A A . 46 GLY C 1 1 16 10250 1 1 46 GLY CA C 11.437 10.309 2.532 1.00 . A A . 46 GLY CA 1 1 16 10251 1 1 46 GLY H H 11.365 8.981 0.884 1.00 . A A . 46 GLY H 1 1 16 10252 1 1 46 GLY HA2 H 11.756 10.157 3.552 1.00 . A A . 46 GLY HA2 1 1 16 10253 1 1 46 GLY HA3 H 10.363 10.422 2.514 1.00 . A A . 46 GLY HA3 1 1 16 10254 1 1 46 GLY N N 11.798 9.142 1.749 1.00 . A A . 46 GLY N 1 1 16 10255 1 1 46 GLY O O 12.918 12.161 2.715 1.00 . A A . 46 GLY O 1 1 16 10256 1 1 46 GLY OXT O 11.722 11.996 0.879 1.00 . A A . 46 GLY OXT 1 1 17 10257 1 1 1 ALA C C -18.459 -0.948 2.215 1.00 . A A . 1 ALA C 1 1 17 10258 1 1 1 ALA CA C -18.512 0.571 2.344 1.00 . A A . 1 ALA CA 1 1 17 10259 1 1 1 ALA CB C -19.142 1.183 1.102 1.00 . A A . 1 ALA CB 1 1 17 10260 1 1 1 ALA H1 H -16.640 0.485 3.192 1.00 . A A . 1 ALA H1 1 1 17 10261 1 1 1 ALA H2 H -16.688 1.210 1.640 1.00 . A A . 1 ALA H2 1 1 17 10262 1 1 1 ALA H3 H -17.270 2.070 3.006 1.00 . A A . 1 ALA H3 1 1 17 10263 1 1 1 ALA HA H -19.129 0.827 3.193 1.00 . A A . 1 ALA HA 1 1 17 10264 1 1 1 ALA HB1 H -20.116 0.747 0.940 1.00 . A A . 1 ALA HB1 1 1 17 10265 1 1 1 ALA HB2 H -18.513 0.988 0.246 1.00 . A A . 1 ALA HB2 1 1 17 10266 1 1 1 ALA HB3 H -19.243 2.250 1.239 1.00 . A A . 1 ALA HB3 1 1 17 10267 1 1 1 ALA N N -17.155 1.135 2.565 1.00 . A A . 1 ALA N 1 1 17 10268 1 1 1 ALA O O -19.367 -1.651 2.660 1.00 . A A . 1 ALA O 1 1 17 10269 1 1 2 MET C C -16.161 -3.434 2.369 1.00 . A A . 2 MET C 1 1 17 10270 1 1 2 MET CA C -17.219 -2.884 1.417 1.00 . A A . 2 MET CA 1 1 17 10271 1 1 2 MET CB C -16.827 -3.187 -0.030 1.00 . A A . 2 MET CB 1 1 17 10272 1 1 2 MET CE C -15.796 -1.033 -2.397 1.00 . A A . 2 MET CE 1 1 17 10273 1 1 2 MET CG C -17.719 -2.510 -1.057 1.00 . A A . 2 MET CG 1 1 17 10274 1 1 2 MET H H -16.700 -0.837 1.272 1.00 . A A . 2 MET H 1 1 17 10275 1 1 2 MET HA H -18.163 -3.361 1.633 1.00 . A A . 2 MET HA 1 1 17 10276 1 1 2 MET HB2 H -15.812 -2.857 -0.193 1.00 . A A . 2 MET HB2 1 1 17 10277 1 1 2 MET HB3 H -16.878 -4.255 -0.188 1.00 . A A . 2 MET HB3 1 1 17 10278 1 1 2 MET HE1 H -15.762 -2.054 -2.745 1.00 . A A . 2 MET HE1 1 1 17 10279 1 1 2 MET HE2 H -15.844 -0.365 -3.245 1.00 . A A . 2 MET HE2 1 1 17 10280 1 1 2 MET HE3 H -14.907 -0.819 -1.821 1.00 . A A . 2 MET HE3 1 1 17 10281 1 1 2 MET HG2 H -17.660 -3.059 -1.984 1.00 . A A . 2 MET HG2 1 1 17 10282 1 1 2 MET HG3 H -18.737 -2.525 -0.695 1.00 . A A . 2 MET HG3 1 1 17 10283 1 1 2 MET N N -17.390 -1.448 1.605 1.00 . A A . 2 MET N 1 1 17 10284 1 1 2 MET O O -15.138 -2.795 2.612 1.00 . A A . 2 MET O 1 1 17 10285 1 1 2 MET SD S -17.243 -0.799 -1.369 1.00 . A A . 2 MET SD 1 1 17 10286 1 1 3 ASP C C -14.134 -5.500 3.162 1.00 . A A . 3 ASP C 1 1 17 10287 1 1 3 ASP CA C -15.485 -5.260 3.829 1.00 . A A . 3 ASP CA 1 1 17 10288 1 1 3 ASP CB C -16.060 -6.585 4.332 1.00 . A A . 3 ASP CB 1 1 17 10289 1 1 3 ASP CG C -16.537 -7.476 3.202 1.00 . A A . 3 ASP CG 1 1 17 10290 1 1 3 ASP H H -17.248 -5.085 2.671 1.00 . A A . 3 ASP H 1 1 17 10291 1 1 3 ASP HA H -15.346 -4.596 4.668 1.00 . A A . 3 ASP HA 1 1 17 10292 1 1 3 ASP HB2 H -15.298 -7.115 4.885 1.00 . A A . 3 ASP HB2 1 1 17 10293 1 1 3 ASP HB3 H -16.897 -6.382 4.985 1.00 . A A . 3 ASP HB3 1 1 17 10294 1 1 3 ASP N N -16.415 -4.624 2.904 1.00 . A A . 3 ASP N 1 1 17 10295 1 1 3 ASP O O -13.966 -5.249 1.969 1.00 . A A . 3 ASP O 1 1 17 10296 1 1 3 ASP OD1 O -15.891 -8.515 2.952 1.00 . A A . 3 ASP OD1 1 1 17 10297 1 1 3 ASP OD2 O -17.557 -7.134 2.567 1.00 . A A . 3 ASP OD2 1 1 17 10298 1 1 4 CYS C C -11.190 -4.990 2.887 1.00 . A A . 4 CYS C 1 1 17 10299 1 1 4 CYS CA C -11.837 -6.261 3.427 1.00 . A A . 4 CYS CA 1 1 17 10300 1 1 4 CYS CB C -11.898 -7.320 2.325 1.00 . A A . 4 CYS CB 1 1 17 10301 1 1 4 CYS H H -13.369 -6.167 4.885 1.00 . A A . 4 CYS H 1 1 17 10302 1 1 4 CYS HA H -11.238 -6.637 4.242 1.00 . A A . 4 CYS HA 1 1 17 10303 1 1 4 CYS HB2 H -12.701 -7.077 1.646 1.00 . A A . 4 CYS HB2 1 1 17 10304 1 1 4 CYS HB3 H -10.963 -7.319 1.783 1.00 . A A . 4 CYS HB3 1 1 17 10305 1 1 4 CYS N N -13.174 -5.987 3.942 1.00 . A A . 4 CYS N 1 1 17 10306 1 1 4 CYS O O -11.778 -3.909 2.942 1.00 . A A . 4 CYS O 1 1 17 10307 1 1 4 CYS SG S -12.185 -9.013 2.934 1.00 . A A . 4 CYS SG 1 1 17 10308 1 1 5 THR C C -8.699 -4.330 0.427 1.00 . A A . 5 THR C 1 1 17 10309 1 1 5 THR CA C -9.246 -3.995 1.812 1.00 . A A . 5 THR CA 1 1 17 10310 1 1 5 THR CB C -8.101 -3.594 2.745 1.00 . A A . 5 THR CB 1 1 17 10311 1 1 5 THR CG2 C -7.970 -2.097 2.922 1.00 . A A . 5 THR CG2 1 1 17 10312 1 1 5 THR H H -9.562 -6.017 2.350 1.00 . A A . 5 THR H 1 1 17 10313 1 1 5 THR HA H -9.933 -3.166 1.724 1.00 . A A . 5 THR HA 1 1 17 10314 1 1 5 THR HB H -7.170 -3.961 2.337 1.00 . A A . 5 THR HB 1 1 17 10315 1 1 5 THR HG1 H -7.563 -3.883 4.607 1.00 . A A . 5 THR HG1 1 1 17 10316 1 1 5 THR HG21 H -8.114 -1.608 1.969 1.00 . A A . 5 THR HG21 1 1 17 10317 1 1 5 THR HG22 H -8.718 -1.750 3.620 1.00 . A A . 5 THR HG22 1 1 17 10318 1 1 5 THR HG23 H -6.987 -1.863 3.302 1.00 . A A . 5 THR HG23 1 1 17 10319 1 1 5 THR N N -9.977 -5.129 2.365 1.00 . A A . 5 THR N 1 1 17 10320 1 1 5 THR O O -7.815 -5.174 0.287 1.00 . A A . 5 THR O 1 1 17 10321 1 1 5 THR OG1 O -8.277 -4.164 4.030 1.00 . A A . 5 THR OG1 1 1 17 10322 1 1 6 THR C C -8.115 -2.655 -2.534 1.00 . A A . 6 THR C 1 1 17 10323 1 1 6 THR CA C -8.799 -3.894 -1.966 1.00 . A A . 6 THR CA 1 1 17 10324 1 1 6 THR CB C -9.992 -4.279 -2.842 1.00 . A A . 6 THR CB 1 1 17 10325 1 1 6 THR CG2 C -10.228 -5.773 -2.909 1.00 . A A . 6 THR CG2 1 1 17 10326 1 1 6 THR H H -9.937 -3.005 -0.417 1.00 . A A . 6 THR H 1 1 17 10327 1 1 6 THR HA H -8.092 -4.710 -1.958 1.00 . A A . 6 THR HA 1 1 17 10328 1 1 6 THR HB H -9.815 -3.927 -3.848 1.00 . A A . 6 THR HB 1 1 17 10329 1 1 6 THR HG1 H -11.861 -3.728 -3.039 1.00 . A A . 6 THR HG1 1 1 17 10330 1 1 6 THR HG21 H -9.410 -6.288 -2.428 1.00 . A A . 6 THR HG21 1 1 17 10331 1 1 6 THR HG22 H -11.152 -6.014 -2.404 1.00 . A A . 6 THR HG22 1 1 17 10332 1 1 6 THR HG23 H -10.291 -6.081 -3.942 1.00 . A A . 6 THR HG23 1 1 17 10333 1 1 6 THR N N -9.234 -3.665 -0.592 1.00 . A A . 6 THR N 1 1 17 10334 1 1 6 THR O O -8.647 -1.548 -2.454 1.00 . A A . 6 THR O 1 1 17 10335 1 1 6 THR OG1 O -11.182 -3.677 -2.363 1.00 . A A . 6 THR OG1 1 1 17 10336 1 1 7 GLY C C -4.710 -2.031 -3.816 1.00 . A A . 7 GLY C 1 1 17 10337 1 1 7 GLY CA C -6.193 -1.738 -3.676 1.00 . A A . 7 GLY CA 1 1 17 10338 1 1 7 GLY H H -6.555 -3.754 -3.139 1.00 . A A . 7 GLY H 1 1 17 10339 1 1 7 GLY HA2 H -6.319 -0.873 -3.042 1.00 . A A . 7 GLY HA2 1 1 17 10340 1 1 7 GLY HA3 H -6.597 -1.516 -4.653 1.00 . A A . 7 GLY HA3 1 1 17 10341 1 1 7 GLY N N -6.930 -2.849 -3.106 1.00 . A A . 7 GLY N 1 1 17 10342 1 1 7 GLY O O -4.312 -3.190 -3.936 1.00 . A A . 7 GLY O 1 1 17 10343 1 1 8 PRO C C -1.720 -1.528 -2.642 1.00 . A A . 8 PRO C 1 1 17 10344 1 1 8 PRO CA C -2.412 -1.146 -3.952 1.00 . A A . 8 PRO CA 1 1 17 10345 1 1 8 PRO CB C -1.966 0.241 -4.410 1.00 . A A . 8 PRO CB 1 1 17 10346 1 1 8 PRO CD C -4.251 0.429 -3.688 1.00 . A A . 8 PRO CD 1 1 17 10347 1 1 8 PRO CG C -2.944 1.175 -3.781 1.00 . A A . 8 PRO CG 1 1 17 10348 1 1 8 PRO HA H -2.165 -1.873 -4.711 1.00 . A A . 8 PRO HA 1 1 17 10349 1 1 8 PRO HB2 H -0.959 0.430 -4.068 1.00 . A A . 8 PRO HB2 1 1 17 10350 1 1 8 PRO HB3 H -2.004 0.299 -5.488 1.00 . A A . 8 PRO HB3 1 1 17 10351 1 1 8 PRO HD2 H -4.722 0.615 -2.734 1.00 . A A . 8 PRO HD2 1 1 17 10352 1 1 8 PRO HD3 H -4.907 0.719 -4.496 1.00 . A A . 8 PRO HD3 1 1 17 10353 1 1 8 PRO HG2 H -2.603 1.454 -2.796 1.00 . A A . 8 PRO HG2 1 1 17 10354 1 1 8 PRO HG3 H -3.059 2.054 -4.399 1.00 . A A . 8 PRO HG3 1 1 17 10355 1 1 8 PRO N N -3.860 -0.989 -3.813 1.00 . A A . 8 PRO N 1 1 17 10356 1 1 8 PRO O O -0.877 -2.424 -2.617 1.00 . A A . 8 PRO O 1 1 17 10357 1 1 9 CYS C C -2.315 -2.096 0.553 1.00 . A A . 9 CYS C 1 1 17 10358 1 1 9 CYS CA C -1.471 -1.110 -0.253 1.00 . A A . 9 CYS CA 1 1 17 10359 1 1 9 CYS CB C -1.297 0.197 0.530 1.00 . A A . 9 CYS CB 1 1 17 10360 1 1 9 CYS H H -2.745 -0.132 -1.638 1.00 . A A . 9 CYS H 1 1 17 10361 1 1 9 CYS HA H -0.499 -1.546 -0.423 1.00 . A A . 9 CYS HA 1 1 17 10362 1 1 9 CYS HB2 H -0.700 0.879 -0.054 1.00 . A A . 9 CYS HB2 1 1 17 10363 1 1 9 CYS HB3 H -2.267 0.635 0.700 1.00 . A A . 9 CYS HB3 1 1 17 10364 1 1 9 CYS N N -2.072 -0.840 -1.558 1.00 . A A . 9 CYS N 1 1 17 10365 1 1 9 CYS O O -2.618 -1.861 1.722 1.00 . A A . 9 CYS O 1 1 17 10366 1 1 9 CYS SG S -0.483 0.003 2.150 1.00 . A A . 9 CYS SG 1 1 17 10367 1 1 10 CYS C C -3.737 -5.414 -0.330 1.00 . A A . 10 CYS C 1 1 17 10368 1 1 10 CYS CA C -3.490 -4.224 0.590 1.00 . A A . 10 CYS CA 1 1 17 10369 1 1 10 CYS CB C -4.826 -3.637 1.050 1.00 . A A . 10 CYS CB 1 1 17 10370 1 1 10 CYS H H -2.414 -3.343 -1.007 1.00 . A A . 10 CYS H 1 1 17 10371 1 1 10 CYS HA H -2.941 -4.563 1.455 1.00 . A A . 10 CYS HA 1 1 17 10372 1 1 10 CYS HB2 H -5.371 -4.391 1.599 1.00 . A A . 10 CYS HB2 1 1 17 10373 1 1 10 CYS HB3 H -4.636 -2.795 1.699 1.00 . A A . 10 CYS HB3 1 1 17 10374 1 1 10 CYS N N -2.687 -3.205 -0.077 1.00 . A A . 10 CYS N 1 1 17 10375 1 1 10 CYS O O -4.000 -5.248 -1.521 1.00 . A A . 10 CYS O 1 1 17 10376 1 1 10 CYS SG S -5.893 -3.062 -0.307 1.00 . A A . 10 CYS SG 1 1 17 10377 1 1 11 ARG C C -4.650 -8.855 0.286 1.00 . A A . 11 ARG C 1 1 17 10378 1 1 11 ARG CA C -3.866 -7.836 -0.533 1.00 . A A . 11 ARG CA 1 1 17 10379 1 1 11 ARG CB C -2.527 -8.433 -0.968 1.00 . A A . 11 ARG CB 1 1 17 10380 1 1 11 ARG CD C -2.057 -8.097 -3.414 1.00 . A A . 11 ARG CD 1 1 17 10381 1 1 11 ARG CG C -2.562 -9.061 -2.352 1.00 . A A . 11 ARG CG 1 1 17 10382 1 1 11 ARG CZ C -0.032 -9.306 -4.129 1.00 . A A . 11 ARG CZ 1 1 17 10383 1 1 11 ARG H H -3.439 -6.680 1.187 1.00 . A A . 11 ARG H 1 1 17 10384 1 1 11 ARG HA H -4.439 -7.580 -1.412 1.00 . A A . 11 ARG HA 1 1 17 10385 1 1 11 ARG HB2 H -1.781 -7.652 -0.970 1.00 . A A . 11 ARG HB2 1 1 17 10386 1 1 11 ARG HB3 H -2.237 -9.194 -0.259 1.00 . A A . 11 ARG HB3 1 1 17 10387 1 1 11 ARG HD2 H -2.567 -8.306 -4.343 1.00 . A A . 11 ARG HD2 1 1 17 10388 1 1 11 ARG HD3 H -2.280 -7.088 -3.101 1.00 . A A . 11 ARG HD3 1 1 17 10389 1 1 11 ARG HE H -0.056 -7.456 -3.381 1.00 . A A . 11 ARG HE 1 1 17 10390 1 1 11 ARG HG2 H -1.936 -9.941 -2.353 1.00 . A A . 11 ARG HG2 1 1 17 10391 1 1 11 ARG HG3 H -3.579 -9.340 -2.585 1.00 . A A . 11 ARG HG3 1 1 17 10392 1 1 11 ARG HH11 H -1.752 -10.347 -4.353 1.00 . A A . 11 ARG HH11 1 1 17 10393 1 1 11 ARG HH12 H -0.314 -11.174 -4.848 1.00 . A A . 11 ARG HH12 1 1 17 10394 1 1 11 ARG HH21 H 1.836 -8.543 -4.033 1.00 . A A . 11 ARG HH21 1 1 17 10395 1 1 11 ARG HH22 H 1.723 -10.151 -4.666 1.00 . A A . 11 ARG HH22 1 1 17 10396 1 1 11 ARG N N -3.651 -6.614 0.232 1.00 . A A . 11 ARG N 1 1 17 10397 1 1 11 ARG NE N -0.617 -8.221 -3.626 1.00 . A A . 11 ARG NE 1 1 17 10398 1 1 11 ARG NH1 N -0.760 -10.362 -4.471 1.00 . A A . 11 ARG NH1 1 1 17 10399 1 1 11 ARG NH2 N 1.284 -9.336 -4.289 1.00 . A A . 11 ARG NH2 1 1 17 10400 1 1 11 ARG O O -4.770 -8.727 1.504 1.00 . A A . 11 ARG O 1 1 17 10401 1 1 12 GLN C C -7.267 -10.359 0.817 1.00 . A A . 12 GLN C 1 1 17 10402 1 1 12 GLN CA C -5.955 -10.913 0.274 1.00 . A A . 12 GLN CA 1 1 17 10403 1 1 12 GLN CB C -5.140 -11.543 1.408 1.00 . A A . 12 GLN CB 1 1 17 10404 1 1 12 GLN CD C -4.752 -13.695 2.673 1.00 . A A . 12 GLN CD 1 1 17 10405 1 1 12 GLN CG C -5.067 -13.060 1.333 1.00 . A A . 12 GLN CG 1 1 17 10406 1 1 12 GLN H H -5.051 -9.916 -1.361 1.00 . A A . 12 GLN H 1 1 17 10407 1 1 12 GLN HA H -6.179 -11.670 -0.457 1.00 . A A . 12 GLN HA 1 1 17 10408 1 1 12 GLN HB2 H -4.133 -11.154 1.371 1.00 . A A . 12 GLN HB2 1 1 17 10409 1 1 12 GLN HB3 H -5.586 -11.273 2.353 1.00 . A A . 12 GLN HB3 1 1 17 10410 1 1 12 GLN HE21 H -6.200 -15.033 2.406 1.00 . A A . 12 GLN HE21 1 1 17 10411 1 1 12 GLN HE22 H -5.316 -15.167 3.885 1.00 . A A . 12 GLN HE22 1 1 17 10412 1 1 12 GLN HG2 H -6.018 -13.437 0.988 1.00 . A A . 12 GLN HG2 1 1 17 10413 1 1 12 GLN HG3 H -4.295 -13.336 0.629 1.00 . A A . 12 GLN HG3 1 1 17 10414 1 1 12 GLN N N -5.182 -9.869 -0.391 1.00 . A A . 12 GLN N 1 1 17 10415 1 1 12 GLN NE2 N -5.498 -14.737 3.023 1.00 . A A . 12 GLN NE2 1 1 17 10416 1 1 12 GLN O O -8.338 -10.624 0.272 1.00 . A A . 12 GLN O 1 1 17 10417 1 1 12 GLN OE1 O -3.850 -13.255 3.385 1.00 . A A . 12 GLN OE1 1 1 17 10418 1 1 13 CYS C C -7.971 -8.171 3.744 1.00 . A A . 13 CYS C 1 1 17 10419 1 1 13 CYS CA C -8.353 -8.997 2.517 1.00 . A A . 13 CYS CA 1 1 17 10420 1 1 13 CYS CB C -9.350 -10.092 2.912 1.00 . A A . 13 CYS CB 1 1 17 10421 1 1 13 CYS H H -6.292 -9.419 2.281 1.00 . A A . 13 CYS H 1 1 17 10422 1 1 13 CYS HA H -8.818 -8.347 1.792 1.00 . A A . 13 CYS HA 1 1 17 10423 1 1 13 CYS HB2 H -8.868 -11.055 2.823 1.00 . A A . 13 CYS HB2 1 1 17 10424 1 1 13 CYS HB3 H -9.655 -9.943 3.938 1.00 . A A . 13 CYS HB3 1 1 17 10425 1 1 13 CYS N N -7.174 -9.590 1.895 1.00 . A A . 13 CYS N 1 1 17 10426 1 1 13 CYS O O -8.709 -8.126 4.728 1.00 . A A . 13 CYS O 1 1 17 10427 1 1 13 CYS SG S -10.855 -10.133 1.886 1.00 . A A . 13 CYS SG 1 1 17 10428 1 1 14 LYS C C -5.195 -5.798 4.348 1.00 . A A . 14 LYS C 1 1 17 10429 1 1 14 LYS CA C -6.346 -6.694 4.789 1.00 . A A . 14 LYS CA 1 1 17 10430 1 1 14 LYS CB C -5.902 -7.578 5.956 1.00 . A A . 14 LYS CB 1 1 17 10431 1 1 14 LYS CD C -4.116 -9.086 6.880 1.00 . A A . 14 LYS CD 1 1 17 10432 1 1 14 LYS CE C -2.972 -8.244 7.421 1.00 . A A . 14 LYS CE 1 1 17 10433 1 1 14 LYS CG C -4.716 -8.470 5.626 1.00 . A A . 14 LYS CG 1 1 17 10434 1 1 14 LYS H H -6.265 -7.585 2.872 1.00 . A A . 14 LYS H 1 1 17 10435 1 1 14 LYS HA H -7.167 -6.073 5.112 1.00 . A A . 14 LYS HA 1 1 17 10436 1 1 14 LYS HB2 H -5.629 -6.946 6.788 1.00 . A A . 14 LYS HB2 1 1 17 10437 1 1 14 LYS HB3 H -6.728 -8.208 6.250 1.00 . A A . 14 LYS HB3 1 1 17 10438 1 1 14 LYS HD2 H -4.884 -9.160 7.635 1.00 . A A . 14 LYS HD2 1 1 17 10439 1 1 14 LYS HD3 H -3.746 -10.072 6.643 1.00 . A A . 14 LYS HD3 1 1 17 10440 1 1 14 LYS HE2 H -2.535 -8.754 8.267 1.00 . A A . 14 LYS HE2 1 1 17 10441 1 1 14 LYS HE3 H -2.228 -8.132 6.646 1.00 . A A . 14 LYS HE3 1 1 17 10442 1 1 14 LYS HG2 H -5.045 -9.262 4.970 1.00 . A A . 14 LYS HG2 1 1 17 10443 1 1 14 LYS HG3 H -3.961 -7.879 5.129 1.00 . A A . 14 LYS HG3 1 1 17 10444 1 1 14 LYS HZ1 H -4.263 -6.982 8.471 1.00 . A A . 14 LYS HZ1 1 1 17 10445 1 1 14 LYS HZ2 H -2.672 -6.411 8.376 1.00 . A A . 14 LYS HZ2 1 1 17 10446 1 1 14 LYS HZ3 H -3.686 -6.322 7.024 1.00 . A A . 14 LYS HZ3 1 1 17 10447 1 1 14 LYS N N -6.815 -7.516 3.681 1.00 . A A . 14 LYS N 1 1 17 10448 1 1 14 LYS NZ N -3.430 -6.895 7.853 1.00 . A A . 14 LYS NZ 1 1 17 10449 1 1 14 LYS O O -4.358 -6.200 3.539 1.00 . A A . 14 LYS O 1 1 17 10450 1 1 15 LEU C C -2.730 -4.277 4.618 1.00 . A A . 15 LEU C 1 1 17 10451 1 1 15 LEU CA C -4.110 -3.626 4.542 1.00 . A A . 15 LEU CA 1 1 17 10452 1 1 15 LEU CB C -4.192 -2.389 5.455 1.00 . A A . 15 LEU CB 1 1 17 10453 1 1 15 LEU CD1 C -3.816 -3.788 7.528 1.00 . A A . 15 LEU CD1 1 1 17 10454 1 1 15 LEU CD2 C -1.980 -2.327 6.650 1.00 . A A . 15 LEU CD2 1 1 17 10455 1 1 15 LEU CG C -3.484 -2.483 6.816 1.00 . A A . 15 LEU CG 1 1 17 10456 1 1 15 LEU H H -5.856 -4.319 5.519 1.00 . A A . 15 LEU H 1 1 17 10457 1 1 15 LEU HA H -4.280 -3.313 3.524 1.00 . A A . 15 LEU HA 1 1 17 10458 1 1 15 LEU HB2 H -3.769 -1.553 4.918 1.00 . A A . 15 LEU HB2 1 1 17 10459 1 1 15 LEU HB3 H -5.236 -2.179 5.636 1.00 . A A . 15 LEU HB3 1 1 17 10460 1 1 15 LEU HD11 H -4.615 -4.291 7.009 1.00 . A A . 15 LEU HD11 1 1 17 10461 1 1 15 LEU HD12 H -2.943 -4.422 7.548 1.00 . A A . 15 LEU HD12 1 1 17 10462 1 1 15 LEU HD13 H -4.126 -3.574 8.540 1.00 . A A . 15 LEU HD13 1 1 17 10463 1 1 15 LEU HD21 H -1.774 -1.759 5.755 1.00 . A A . 15 LEU HD21 1 1 17 10464 1 1 15 LEU HD22 H -1.576 -1.807 7.506 1.00 . A A . 15 LEU HD22 1 1 17 10465 1 1 15 LEU HD23 H -1.522 -3.301 6.572 1.00 . A A . 15 LEU HD23 1 1 17 10466 1 1 15 LEU HG H -3.831 -1.674 7.442 1.00 . A A . 15 LEU HG 1 1 17 10467 1 1 15 LEU N N -5.159 -4.581 4.883 1.00 . A A . 15 LEU N 1 1 17 10468 1 1 15 LEU O O -2.442 -5.045 5.535 1.00 . A A . 15 LEU O 1 1 17 10469 1 1 16 LYS C C 0.322 -3.979 4.724 1.00 . A A . 16 LYS C 1 1 17 10470 1 1 16 LYS CA C -0.541 -4.536 3.592 1.00 . A A . 16 LYS CA 1 1 17 10471 1 1 16 LYS CB C 0.111 -4.241 2.238 1.00 . A A . 16 LYS CB 1 1 17 10472 1 1 16 LYS CD C 1.302 -5.331 0.313 1.00 . A A . 16 LYS CD 1 1 17 10473 1 1 16 LYS CE C 0.850 -4.648 -0.968 1.00 . A A . 16 LYS CE 1 1 17 10474 1 1 16 LYS CG C 0.164 -5.447 1.314 1.00 . A A . 16 LYS CG 1 1 17 10475 1 1 16 LYS H H -2.173 -3.362 2.929 1.00 . A A . 16 LYS H 1 1 17 10476 1 1 16 LYS HA H -0.629 -5.606 3.713 1.00 . A A . 16 LYS HA 1 1 17 10477 1 1 16 LYS HB2 H -0.450 -3.461 1.745 1.00 . A A . 16 LYS HB2 1 1 17 10478 1 1 16 LYS HB3 H 1.121 -3.897 2.403 1.00 . A A . 16 LYS HB3 1 1 17 10479 1 1 16 LYS HD2 H 2.100 -4.753 0.755 1.00 . A A . 16 LYS HD2 1 1 17 10480 1 1 16 LYS HD3 H 1.661 -6.322 0.075 1.00 . A A . 16 LYS HD3 1 1 17 10481 1 1 16 LYS HE2 H 0.092 -3.919 -0.724 1.00 . A A . 16 LYS HE2 1 1 17 10482 1 1 16 LYS HE3 H 1.698 -4.150 -1.413 1.00 . A A . 16 LYS HE3 1 1 17 10483 1 1 16 LYS HG2 H 0.309 -6.337 1.907 1.00 . A A . 16 LYS HG2 1 1 17 10484 1 1 16 LYS HG3 H -0.771 -5.518 0.777 1.00 . A A . 16 LYS HG3 1 1 17 10485 1 1 16 LYS HZ1 H -0.057 -6.467 -1.452 1.00 . A A . 16 LYS HZ1 1 1 17 10486 1 1 16 LYS HZ2 H -0.503 -5.188 -2.465 1.00 . A A . 16 LYS HZ2 1 1 17 10487 1 1 16 LYS HZ3 H 1.021 -5.903 -2.629 1.00 . A A . 16 LYS HZ3 1 1 17 10488 1 1 16 LYS N N -1.884 -3.973 3.639 1.00 . A A . 16 LYS N 1 1 17 10489 1 1 16 LYS NZ N 0.288 -5.620 -1.947 1.00 . A A . 16 LYS NZ 1 1 17 10490 1 1 16 LYS O O 0.199 -2.810 5.089 1.00 . A A . 16 LYS O 1 1 17 10491 1 1 17 PRO C C 2.994 -3.228 6.002 1.00 . A A . 17 PRO C 1 1 17 10492 1 1 17 PRO CA C 2.093 -4.394 6.391 1.00 . A A . 17 PRO CA 1 1 17 10493 1 1 17 PRO CB C 2.938 -5.642 6.679 1.00 . A A . 17 PRO CB 1 1 17 10494 1 1 17 PRO CD C 1.425 -6.218 4.923 1.00 . A A . 17 PRO CD 1 1 17 10495 1 1 17 PRO CG C 2.792 -6.504 5.471 1.00 . A A . 17 PRO CG 1 1 17 10496 1 1 17 PRO HA H 1.528 -4.128 7.272 1.00 . A A . 17 PRO HA 1 1 17 10497 1 1 17 PRO HB2 H 3.967 -5.352 6.834 1.00 . A A . 17 PRO HB2 1 1 17 10498 1 1 17 PRO HB3 H 2.562 -6.136 7.563 1.00 . A A . 17 PRO HB3 1 1 17 10499 1 1 17 PRO HD2 H 1.414 -6.340 3.850 1.00 . A A . 17 PRO HD2 1 1 17 10500 1 1 17 PRO HD3 H 0.689 -6.857 5.387 1.00 . A A . 17 PRO HD3 1 1 17 10501 1 1 17 PRO HG2 H 3.549 -6.249 4.745 1.00 . A A . 17 PRO HG2 1 1 17 10502 1 1 17 PRO HG3 H 2.874 -7.544 5.750 1.00 . A A . 17 PRO HG3 1 1 17 10503 1 1 17 PRO N N 1.210 -4.811 5.295 1.00 . A A . 17 PRO N 1 1 17 10504 1 1 17 PRO O O 3.431 -3.122 4.857 1.00 . A A . 17 PRO O 1 1 17 10505 1 1 18 ALA C C 5.517 -1.638 6.284 1.00 . A A . 18 ALA C 1 1 17 10506 1 1 18 ALA CA C 4.125 -1.201 6.727 1.00 . A A . 18 ALA CA 1 1 17 10507 1 1 18 ALA CB C 4.211 -0.339 7.979 1.00 . A A . 18 ALA CB 1 1 17 10508 1 1 18 ALA H H 2.894 -2.496 7.860 1.00 . A A . 18 ALA H 1 1 17 10509 1 1 18 ALA HA H 3.676 -0.611 5.942 1.00 . A A . 18 ALA HA 1 1 17 10510 1 1 18 ALA HB1 H 5.187 -0.452 8.429 1.00 . A A . 18 ALA HB1 1 1 17 10511 1 1 18 ALA HB2 H 3.453 -0.650 8.683 1.00 . A A . 18 ALA HB2 1 1 17 10512 1 1 18 ALA HB3 H 4.054 0.696 7.715 1.00 . A A . 18 ALA HB3 1 1 17 10513 1 1 18 ALA N N 3.271 -2.356 6.966 1.00 . A A . 18 ALA N 1 1 17 10514 1 1 18 ALA O O 5.855 -2.820 6.345 1.00 . A A . 18 ALA O 1 1 17 10515 1 1 19 GLY C C 7.675 -1.973 4.227 1.00 . A A . 19 GLY C 1 1 17 10516 1 1 19 GLY CA C 7.665 -0.993 5.385 1.00 . A A . 19 GLY CA 1 1 17 10517 1 1 19 GLY H H 5.998 0.246 5.806 1.00 . A A . 19 GLY H 1 1 17 10518 1 1 19 GLY HA2 H 8.217 -1.420 6.209 1.00 . A A . 19 GLY HA2 1 1 17 10519 1 1 19 GLY HA3 H 8.150 -0.080 5.074 1.00 . A A . 19 GLY HA3 1 1 17 10520 1 1 19 GLY N N 6.321 -0.680 5.835 1.00 . A A . 19 GLY N 1 1 17 10521 1 1 19 GLY O O 8.692 -2.611 3.953 1.00 . A A . 19 GLY O 1 1 17 10522 1 1 20 THR C C 5.879 -2.247 1.195 1.00 . A A . 20 THR C 1 1 17 10523 1 1 20 THR CA C 6.416 -2.995 2.409 1.00 . A A . 20 THR CA 1 1 17 10524 1 1 20 THR CB C 5.489 -4.162 2.760 1.00 . A A . 20 THR CB 1 1 17 10525 1 1 20 THR CG2 C 5.282 -5.134 1.618 1.00 . A A . 20 THR CG2 1 1 17 10526 1 1 20 THR H H 5.765 -1.555 3.810 1.00 . A A . 20 THR H 1 1 17 10527 1 1 20 THR HA H 7.398 -3.379 2.179 1.00 . A A . 20 THR HA 1 1 17 10528 1 1 20 THR HB H 4.523 -3.768 3.038 1.00 . A A . 20 THR HB 1 1 17 10529 1 1 20 THR HG1 H 5.774 -4.447 4.677 1.00 . A A . 20 THR HG1 1 1 17 10530 1 1 20 THR HG21 H 5.563 -4.663 0.688 1.00 . A A . 20 THR HG21 1 1 17 10531 1 1 20 THR HG22 H 5.891 -6.011 1.777 1.00 . A A . 20 THR HG22 1 1 17 10532 1 1 20 THR HG23 H 4.241 -5.422 1.576 1.00 . A A . 20 THR HG23 1 1 17 10533 1 1 20 THR N N 6.540 -2.091 3.545 1.00 . A A . 20 THR N 1 1 17 10534 1 1 20 THR O O 4.855 -1.568 1.277 1.00 . A A . 20 THR O 1 1 17 10535 1 1 20 THR OG1 O 6.001 -4.895 3.859 1.00 . A A . 20 THR OG1 1 1 17 10536 1 1 21 THR C C 4.680 -1.911 -1.431 1.00 . A A . 21 THR C 1 1 17 10537 1 1 21 THR CA C 6.164 -1.699 -1.160 1.00 . A A . 21 THR CA 1 1 17 10538 1 1 21 THR CB C 6.993 -2.193 -2.345 1.00 . A A . 21 THR CB 1 1 17 10539 1 1 21 THR CG2 C 7.774 -1.086 -3.011 1.00 . A A . 21 THR CG2 1 1 17 10540 1 1 21 THR H H 7.384 -2.923 0.065 1.00 . A A . 21 THR H 1 1 17 10541 1 1 21 THR HA H 6.341 -0.641 -1.031 1.00 . A A . 21 THR HA 1 1 17 10542 1 1 21 THR HB H 6.333 -2.623 -3.085 1.00 . A A . 21 THR HB 1 1 17 10543 1 1 21 THR HG1 H 8.216 -3.681 -2.706 1.00 . A A . 21 THR HG1 1 1 17 10544 1 1 21 THR HG21 H 8.220 -0.458 -2.253 1.00 . A A . 21 THR HG21 1 1 17 10545 1 1 21 THR HG22 H 8.549 -1.511 -3.629 1.00 . A A . 21 THR HG22 1 1 17 10546 1 1 21 THR HG23 H 7.108 -0.494 -3.620 1.00 . A A . 21 THR HG23 1 1 17 10547 1 1 21 THR N N 6.575 -2.371 0.069 1.00 . A A . 21 THR N 1 1 17 10548 1 1 21 THR O O 4.208 -3.044 -1.518 1.00 . A A . 21 THR O 1 1 17 10549 1 1 21 THR OG1 O 7.916 -3.189 -1.938 1.00 . A A . 21 THR OG1 1 1 17 10550 1 1 22 CYS C C 2.204 -0.718 -3.288 1.00 . A A . 22 CYS C 1 1 17 10551 1 1 22 CYS CA C 2.516 -0.873 -1.803 1.00 . A A . 22 CYS CA 1 1 17 10552 1 1 22 CYS CB C 1.791 0.204 -0.987 1.00 . A A . 22 CYS CB 1 1 17 10553 1 1 22 CYS H H 4.381 0.065 -1.467 1.00 . A A . 22 CYS H 1 1 17 10554 1 1 22 CYS HA H 2.174 -1.843 -1.480 1.00 . A A . 22 CYS HA 1 1 17 10555 1 1 22 CYS HB2 H 0.758 -0.083 -0.871 1.00 . A A . 22 CYS HB2 1 1 17 10556 1 1 22 CYS HB3 H 2.250 0.272 -0.012 1.00 . A A . 22 CYS HB3 1 1 17 10557 1 1 22 CYS N N 3.948 -0.810 -1.554 1.00 . A A . 22 CYS N 1 1 17 10558 1 1 22 CYS O O 1.198 -1.234 -3.776 1.00 . A A . 22 CYS O 1 1 17 10559 1 1 22 CYS SG S 1.817 1.873 -1.726 1.00 . A A . 22 CYS SG 1 1 17 10560 1 1 23 TRP C C 4.047 -0.281 -6.243 1.00 . A A . 23 TRP C 1 1 17 10561 1 1 23 TRP CA C 2.863 0.223 -5.427 1.00 . A A . 23 TRP CA 1 1 17 10562 1 1 23 TRP CB C 2.630 1.710 -5.707 1.00 . A A . 23 TRP CB 1 1 17 10563 1 1 23 TRP CD1 C 0.949 1.028 -7.513 1.00 . A A . 23 TRP CD1 1 1 17 10564 1 1 23 TRP CD2 C 0.992 3.223 -7.083 1.00 . A A . 23 TRP CD2 1 1 17 10565 1 1 23 TRP CE2 C 0.034 2.980 -8.085 1.00 . A A . 23 TRP CE2 1 1 17 10566 1 1 23 TRP CE3 C 1.195 4.536 -6.650 1.00 . A A . 23 TRP CE3 1 1 17 10567 1 1 23 TRP CG C 1.565 1.960 -6.730 1.00 . A A . 23 TRP CG 1 1 17 10568 1 1 23 TRP CH2 C -0.500 5.274 -8.216 1.00 . A A . 23 TRP CH2 1 1 17 10569 1 1 23 TRP CZ2 C -0.719 3.999 -8.659 1.00 . A A . 23 TRP CZ2 1 1 17 10570 1 1 23 TRP CZ3 C 0.447 5.548 -7.221 1.00 . A A . 23 TRP CZ3 1 1 17 10571 1 1 23 TRP H H 3.845 0.393 -3.559 1.00 . A A . 23 TRP H 1 1 17 10572 1 1 23 TRP HA H 1.987 -0.326 -5.723 1.00 . A A . 23 TRP HA 1 1 17 10573 1 1 23 TRP HB2 H 2.334 2.200 -4.791 1.00 . A A . 23 TRP HB2 1 1 17 10574 1 1 23 TRP HB3 H 3.549 2.151 -6.065 1.00 . A A . 23 TRP HB3 1 1 17 10575 1 1 23 TRP HD1 H 1.167 -0.028 -7.483 1.00 . A A . 23 TRP HD1 1 1 17 10576 1 1 23 TRP HE1 H -0.544 1.175 -8.982 1.00 . A A . 23 TRP HE1 1 1 17 10577 1 1 23 TRP HE3 H 1.920 4.765 -5.884 1.00 . A A . 23 TRP HE3 1 1 17 10578 1 1 23 TRP HH2 H -1.061 6.095 -8.635 1.00 . A A . 23 TRP HH2 1 1 17 10579 1 1 23 TRP HZ2 H -1.454 3.803 -9.424 1.00 . A A . 23 TRP HZ2 1 1 17 10580 1 1 23 TRP HZ3 H 0.589 6.569 -6.899 1.00 . A A . 23 TRP HZ3 1 1 17 10581 1 1 23 TRP N N 3.064 0.001 -4.001 1.00 . A A . 23 TRP N 1 1 17 10582 1 1 23 TRP NE1 N 0.026 1.633 -8.330 1.00 . A A . 23 TRP NE1 1 1 17 10583 1 1 23 TRP O O 3.943 -1.278 -6.957 1.00 . A A . 23 TRP O 1 1 17 10584 1 1 24 LYS C C 6.081 -0.078 -8.363 1.00 . A A . 24 LYS C 1 1 17 10585 1 1 24 LYS CA C 6.373 0.050 -6.870 1.00 . A A . 24 LYS CA 1 1 17 10586 1 1 24 LYS CB C 6.935 -1.265 -6.332 1.00 . A A . 24 LYS CB 1 1 17 10587 1 1 24 LYS CD C 8.977 -1.872 -7.669 1.00 . A A . 24 LYS CD 1 1 17 10588 1 1 24 LYS CE C 9.560 -0.766 -8.535 1.00 . A A . 24 LYS CE 1 1 17 10589 1 1 24 LYS CG C 8.454 -1.331 -6.347 1.00 . A A . 24 LYS CG 1 1 17 10590 1 1 24 LYS H H 5.183 1.203 -5.554 1.00 . A A . 24 LYS H 1 1 17 10591 1 1 24 LYS HA H 7.104 0.831 -6.723 1.00 . A A . 24 LYS HA 1 1 17 10592 1 1 24 LYS HB2 H 6.601 -1.393 -5.314 1.00 . A A . 24 LYS HB2 1 1 17 10593 1 1 24 LYS HB3 H 6.554 -2.078 -6.932 1.00 . A A . 24 LYS HB3 1 1 17 10594 1 1 24 LYS HD2 H 9.748 -2.601 -7.468 1.00 . A A . 24 LYS HD2 1 1 17 10595 1 1 24 LYS HD3 H 8.164 -2.344 -8.202 1.00 . A A . 24 LYS HD3 1 1 17 10596 1 1 24 LYS HE2 H 8.825 -0.477 -9.271 1.00 . A A . 24 LYS HE2 1 1 17 10597 1 1 24 LYS HE3 H 9.791 0.082 -7.906 1.00 . A A . 24 LYS HE3 1 1 17 10598 1 1 24 LYS HG2 H 8.849 -0.338 -6.194 1.00 . A A . 24 LYS HG2 1 1 17 10599 1 1 24 LYS HG3 H 8.784 -1.979 -5.548 1.00 . A A . 24 LYS HG3 1 1 17 10600 1 1 24 LYS HZ1 H 10.639 -2.111 -9.714 1.00 . A A . 24 LYS HZ1 1 1 17 10601 1 1 24 LYS HZ2 H 11.079 -0.494 -9.943 1.00 . A A . 24 LYS HZ2 1 1 17 10602 1 1 24 LYS HZ3 H 11.575 -1.317 -8.550 1.00 . A A . 24 LYS HZ3 1 1 17 10603 1 1 24 LYS N N 5.168 0.419 -6.137 1.00 . A A . 24 LYS N 1 1 17 10604 1 1 24 LYS NZ N 10.800 -1.203 -9.234 1.00 . A A . 24 LYS NZ 1 1 17 10605 1 1 24 LYS O O 6.645 -0.933 -9.046 1.00 . A A . 24 LYS O 1 1 17 10606 1 1 25 THR C C 6.051 0.914 -11.165 1.00 . A A . 25 THR C 1 1 17 10607 1 1 25 THR CA C 4.821 0.761 -10.273 1.00 . A A . 25 THR CA 1 1 17 10608 1 1 25 THR CB C 3.806 1.867 -10.571 1.00 . A A . 25 THR CB 1 1 17 10609 1 1 25 THR CG2 C 4.201 3.210 -9.999 1.00 . A A . 25 THR CG2 1 1 17 10610 1 1 25 THR H H 4.776 1.435 -8.267 1.00 . A A . 25 THR H 1 1 17 10611 1 1 25 THR HA H 4.365 -0.195 -10.481 1.00 . A A . 25 THR HA 1 1 17 10612 1 1 25 THR HB H 2.854 1.593 -10.136 1.00 . A A . 25 THR HB 1 1 17 10613 1 1 25 THR HG1 H 4.337 2.561 -12.328 1.00 . A A . 25 THR HG1 1 1 17 10614 1 1 25 THR HG21 H 5.273 3.252 -9.896 1.00 . A A . 25 THR HG21 1 1 17 10615 1 1 25 THR HG22 H 3.871 3.995 -10.663 1.00 . A A . 25 THR HG22 1 1 17 10616 1 1 25 THR HG23 H 3.740 3.339 -9.031 1.00 . A A . 25 THR HG23 1 1 17 10617 1 1 25 THR N N 5.193 0.778 -8.862 1.00 . A A . 25 THR N 1 1 17 10618 1 1 25 THR O O 7.165 1.110 -10.679 1.00 . A A . 25 THR O 1 1 17 10619 1 1 25 THR OG1 O 3.625 2.026 -11.968 1.00 . A A . 25 THR OG1 1 1 17 10620 1 1 26 SER C C 7.755 2.176 -13.251 1.00 . A A . 26 SER C 1 1 17 10621 1 1 26 SER CA C 6.923 0.909 -13.445 1.00 . A A . 26 SER CA 1 1 17 10622 1 1 26 SER CB C 6.357 0.875 -14.865 1.00 . A A . 26 SER CB 1 1 17 10623 1 1 26 SER H H 4.928 0.635 -12.790 1.00 . A A . 26 SER H 1 1 17 10624 1 1 26 SER HA H 7.565 0.056 -13.309 1.00 . A A . 26 SER HA 1 1 17 10625 1 1 26 SER HB2 H 7.062 1.334 -15.542 1.00 . A A . 26 SER HB2 1 1 17 10626 1 1 26 SER HB3 H 6.191 -0.151 -15.160 1.00 . A A . 26 SER HB3 1 1 17 10627 1 1 26 SER HG H 5.291 2.475 -15.244 1.00 . A A . 26 SER HG 1 1 17 10628 1 1 26 SER N N 5.839 0.804 -12.471 1.00 . A A . 26 SER N 1 1 17 10629 1 1 26 SER O O 8.978 2.146 -13.381 1.00 . A A . 26 SER O 1 1 17 10630 1 1 26 SER OG O 5.129 1.578 -14.943 1.00 . A A . 26 SER OG 1 1 17 10631 1 1 27 VAL C C 7.796 5.001 -11.312 1.00 . A A . 27 VAL C 1 1 17 10632 1 1 27 VAL CA C 7.789 4.558 -12.773 1.00 . A A . 27 VAL CA 1 1 17 10633 1 1 27 VAL CB C 7.167 5.674 -13.640 1.00 . A A . 27 VAL CB 1 1 17 10634 1 1 27 VAL CG1 C 5.721 5.927 -13.244 1.00 . A A . 27 VAL CG1 1 1 17 10635 1 1 27 VAL CG2 C 7.988 6.951 -13.538 1.00 . A A . 27 VAL CG2 1 1 17 10636 1 1 27 VAL H H 6.116 3.256 -12.880 1.00 . A A . 27 VAL H 1 1 17 10637 1 1 27 VAL HA H 8.808 4.420 -13.091 1.00 . A A . 27 VAL HA 1 1 17 10638 1 1 27 VAL HB H 7.180 5.347 -14.670 1.00 . A A . 27 VAL HB 1 1 17 10639 1 1 27 VAL HG11 H 5.190 4.988 -13.197 1.00 . A A . 27 VAL HG11 1 1 17 10640 1 1 27 VAL HG12 H 5.692 6.406 -12.276 1.00 . A A . 27 VAL HG12 1 1 17 10641 1 1 27 VAL HG13 H 5.254 6.568 -13.977 1.00 . A A . 27 VAL HG13 1 1 17 10642 1 1 27 VAL HG21 H 9.027 6.728 -13.727 1.00 . A A . 27 VAL HG21 1 1 17 10643 1 1 27 VAL HG22 H 7.635 7.665 -14.268 1.00 . A A . 27 VAL HG22 1 1 17 10644 1 1 27 VAL HG23 H 7.883 7.368 -12.547 1.00 . A A . 27 VAL HG23 1 1 17 10645 1 1 27 VAL N N 7.091 3.288 -12.959 1.00 . A A . 27 VAL N 1 1 17 10646 1 1 27 VAL O O 8.839 5.373 -10.774 1.00 . A A . 27 VAL O 1 1 17 10647 1 1 28 SER C C 6.871 4.228 -8.342 1.00 . A A . 28 SER C 1 1 17 10648 1 1 28 SER CA C 6.512 5.374 -9.283 1.00 . A A . 28 SER CA 1 1 17 10649 1 1 28 SER CB C 5.091 5.863 -8.993 1.00 . A A . 28 SER CB 1 1 17 10650 1 1 28 SER H H 5.838 4.665 -11.162 1.00 . A A . 28 SER H 1 1 17 10651 1 1 28 SER HA H 7.202 6.187 -9.117 1.00 . A A . 28 SER HA 1 1 17 10652 1 1 28 SER HB2 H 4.576 6.040 -9.926 1.00 . A A . 28 SER HB2 1 1 17 10653 1 1 28 SER HB3 H 4.561 5.111 -8.427 1.00 . A A . 28 SER HB3 1 1 17 10654 1 1 28 SER HG H 4.827 7.796 -8.808 1.00 . A A . 28 SER HG 1 1 17 10655 1 1 28 SER N N 6.633 4.967 -10.680 1.00 . A A . 28 SER N 1 1 17 10656 1 1 28 SER O O 7.260 3.147 -8.783 1.00 . A A . 28 SER O 1 1 17 10657 1 1 28 SER OG O 5.108 7.068 -8.248 1.00 . A A . 28 SER OG 1 1 17 10658 1 1 29 SER C C 6.730 3.986 -4.638 1.00 . A A . 29 SER C 1 1 17 10659 1 1 29 SER CA C 7.042 3.465 -6.036 1.00 . A A . 29 SER CA 1 1 17 10660 1 1 29 SER CB C 8.512 3.053 -6.125 1.00 . A A . 29 SER CB 1 1 17 10661 1 1 29 SER H H 6.419 5.356 -6.755 1.00 . A A . 29 SER H 1 1 17 10662 1 1 29 SER HA H 6.421 2.604 -6.233 1.00 . A A . 29 SER HA 1 1 17 10663 1 1 29 SER HB2 H 8.789 2.517 -5.229 1.00 . A A . 29 SER HB2 1 1 17 10664 1 1 29 SER HB3 H 8.653 2.414 -6.985 1.00 . A A . 29 SER HB3 1 1 17 10665 1 1 29 SER HG H 9.623 4.281 -7.172 1.00 . A A . 29 SER HG 1 1 17 10666 1 1 29 SER N N 6.735 4.474 -7.044 1.00 . A A . 29 SER N 1 1 17 10667 1 1 29 SER O O 7.424 4.861 -4.120 1.00 . A A . 29 SER O 1 1 17 10668 1 1 29 SER OG O 9.353 4.186 -6.256 1.00 . A A . 29 SER OG 1 1 17 10669 1 1 30 HIS C C 5.190 2.663 -1.757 1.00 . A A . 30 HIS C 1 1 17 10670 1 1 30 HIS CA C 5.262 3.859 -2.701 1.00 . A A . 30 HIS CA 1 1 17 10671 1 1 30 HIS CB C 3.904 4.556 -2.772 1.00 . A A . 30 HIS CB 1 1 17 10672 1 1 30 HIS CD2 C 4.141 5.576 -5.142 1.00 . A A . 30 HIS CD2 1 1 17 10673 1 1 30 HIS CE1 C 3.495 7.619 -4.679 1.00 . A A . 30 HIS CE1 1 1 17 10674 1 1 30 HIS CG C 3.843 5.620 -3.822 1.00 . A A . 30 HIS CG 1 1 17 10675 1 1 30 HIS H H 5.160 2.759 -4.503 1.00 . A A . 30 HIS H 1 1 17 10676 1 1 30 HIS HA H 5.995 4.556 -2.325 1.00 . A A . 30 HIS HA 1 1 17 10677 1 1 30 HIS HB2 H 3.142 3.823 -2.997 1.00 . A A . 30 HIS HB2 1 1 17 10678 1 1 30 HIS HB3 H 3.689 5.013 -1.818 1.00 . A A . 30 HIS HB3 1 1 17 10679 1 1 30 HIS HD1 H 3.161 7.262 -2.692 1.00 . A A . 30 HIS HD1 1 1 17 10680 1 1 30 HIS HD2 H 4.492 4.713 -5.691 1.00 . A A . 30 HIS HD2 1 1 17 10681 1 1 30 HIS HE1 H 3.238 8.664 -4.779 1.00 . A A . 30 HIS HE1 1 1 17 10682 1 1 30 HIS HE2 H 4.132 7.124 -6.561 1.00 . A A . 30 HIS HE2 1 1 17 10683 1 1 30 HIS N N 5.676 3.447 -4.036 1.00 . A A . 30 HIS N 1 1 17 10684 1 1 30 HIS ND1 N 3.442 6.913 -3.564 1.00 . A A . 30 HIS ND1 1 1 17 10685 1 1 30 HIS NE2 N 3.916 6.832 -5.651 1.00 . A A . 30 HIS NE2 1 1 17 10686 1 1 30 HIS O O 4.769 1.575 -2.149 1.00 . A A . 30 HIS O 1 1 17 10687 1 1 31 TYR C C 4.320 1.883 1.335 1.00 . A A . 31 TYR C 1 1 17 10688 1 1 31 TYR CA C 5.587 1.814 0.489 1.00 . A A . 31 TYR CA 1 1 17 10689 1 1 31 TYR CB C 6.820 1.915 1.388 1.00 . A A . 31 TYR CB 1 1 17 10690 1 1 31 TYR CD1 C 8.720 1.641 -0.252 1.00 . A A . 31 TYR CD1 1 1 17 10691 1 1 31 TYR CD2 C 8.461 -0.003 1.456 1.00 . A A . 31 TYR CD2 1 1 17 10692 1 1 31 TYR CE1 C 9.820 0.963 -0.743 1.00 . A A . 31 TYR CE1 1 1 17 10693 1 1 31 TYR CE2 C 9.560 -0.686 0.971 1.00 . A A . 31 TYR CE2 1 1 17 10694 1 1 31 TYR CG C 8.023 1.170 0.854 1.00 . A A . 31 TYR CG 1 1 17 10695 1 1 31 TYR CZ C 10.235 -0.199 -0.128 1.00 . A A . 31 TYR CZ 1 1 17 10696 1 1 31 TYR H H 5.928 3.764 -0.261 1.00 . A A . 31 TYR H 1 1 17 10697 1 1 31 TYR HA H 5.607 0.868 -0.030 1.00 . A A . 31 TYR HA 1 1 17 10698 1 1 31 TYR HB2 H 7.095 2.953 1.496 1.00 . A A . 31 TYR HB2 1 1 17 10699 1 1 31 TYR HB3 H 6.582 1.508 2.360 1.00 . A A . 31 TYR HB3 1 1 17 10700 1 1 31 TYR HD1 H 8.392 2.551 -0.731 1.00 . A A . 31 TYR HD1 1 1 17 10701 1 1 31 TYR HD2 H 7.929 -0.382 2.316 1.00 . A A . 31 TYR HD2 1 1 17 10702 1 1 31 TYR HE1 H 10.349 1.345 -1.603 1.00 . A A . 31 TYR HE1 1 1 17 10703 1 1 31 TYR HE2 H 9.885 -1.596 1.453 1.00 . A A . 31 TYR HE2 1 1 17 10704 1 1 31 TYR HH H 11.039 -1.576 -1.203 1.00 . A A . 31 TYR HH 1 1 17 10705 1 1 31 TYR N N 5.603 2.874 -0.512 1.00 . A A . 31 TYR N 1 1 17 10706 1 1 31 TYR O O 3.663 2.921 1.404 1.00 . A A . 31 TYR O 1 1 17 10707 1 1 31 TYR OH O 11.330 -0.877 -0.614 1.00 . A A . 31 TYR OH 1 1 17 10708 1 1 32 CYS C C 3.082 1.309 4.194 1.00 . A A . 32 CYS C 1 1 17 10709 1 1 32 CYS CA C 2.800 0.705 2.824 1.00 . A A . 32 CYS CA 1 1 17 10710 1 1 32 CYS CB C 2.337 -0.746 2.977 1.00 . A A . 32 CYS CB 1 1 17 10711 1 1 32 CYS H H 4.550 -0.025 1.888 1.00 . A A . 32 CYS H 1 1 17 10712 1 1 32 CYS HA H 2.018 1.275 2.345 1.00 . A A . 32 CYS HA 1 1 17 10713 1 1 32 CYS HB2 H 3.186 -1.402 2.852 1.00 . A A . 32 CYS HB2 1 1 17 10714 1 1 32 CYS HB3 H 1.928 -0.882 3.968 1.00 . A A . 32 CYS HB3 1 1 17 10715 1 1 32 CYS N N 3.985 0.770 1.980 1.00 . A A . 32 CYS N 1 1 17 10716 1 1 32 CYS O O 4.183 1.176 4.728 1.00 . A A . 32 CYS O 1 1 17 10717 1 1 32 CYS SG S 1.065 -1.254 1.776 1.00 . A A . 32 CYS SG 1 1 17 10718 1 1 33 THR C C 1.593 1.718 7.156 1.00 . A A . 33 THR C 1 1 17 10719 1 1 33 THR CA C 2.219 2.590 6.071 1.00 . A A . 33 THR CA 1 1 17 10720 1 1 33 THR CB C 1.567 3.974 6.075 1.00 . A A . 33 THR CB 1 1 17 10721 1 1 33 THR CG2 C 2.003 4.844 4.916 1.00 . A A . 33 THR CG2 1 1 17 10722 1 1 33 THR H H 1.224 2.039 4.287 1.00 . A A . 33 THR H 1 1 17 10723 1 1 33 THR HA H 3.273 2.698 6.276 1.00 . A A . 33 THR HA 1 1 17 10724 1 1 33 THR HB H 1.834 4.484 6.990 1.00 . A A . 33 THR HB 1 1 17 10725 1 1 33 THR HG1 H -0.096 3.328 5.267 1.00 . A A . 33 THR HG1 1 1 17 10726 1 1 33 THR HG21 H 3.033 4.629 4.672 1.00 . A A . 33 THR HG21 1 1 17 10727 1 1 33 THR HG22 H 1.380 4.640 4.058 1.00 . A A . 33 THR HG22 1 1 17 10728 1 1 33 THR HG23 H 1.908 5.884 5.191 1.00 . A A . 33 THR HG23 1 1 17 10729 1 1 33 THR N N 2.079 1.970 4.760 1.00 . A A . 33 THR N 1 1 17 10730 1 1 33 THR O O 1.364 2.175 8.275 1.00 . A A . 33 THR O 1 1 17 10731 1 1 33 THR OG1 O 0.156 3.864 6.023 1.00 . A A . 33 THR OG1 1 1 17 10732 1 1 34 GLY C C -0.449 0.151 8.526 1.00 . A A . 34 GLY C 1 1 17 10733 1 1 34 GLY CA C 0.721 -0.459 7.775 1.00 . A A . 34 GLY CA 1 1 17 10734 1 1 34 GLY H H 1.525 0.147 5.910 1.00 . A A . 34 GLY H 1 1 17 10735 1 1 34 GLY HA2 H 1.476 -0.756 8.488 1.00 . A A . 34 GLY HA2 1 1 17 10736 1 1 34 GLY HA3 H 0.376 -1.336 7.247 1.00 . A A . 34 GLY HA3 1 1 17 10737 1 1 34 GLY N N 1.318 0.458 6.817 1.00 . A A . 34 GLY N 1 1 17 10738 1 1 34 GLY O O -0.468 0.156 9.756 1.00 . A A . 34 GLY O 1 1 17 10739 1 1 35 ARG C C -3.804 1.213 7.463 1.00 . A A . 35 ARG C 1 1 17 10740 1 1 35 ARG CA C -2.599 1.282 8.395 1.00 . A A . 35 ARG CA 1 1 17 10741 1 1 35 ARG CB C -2.306 2.738 8.760 1.00 . A A . 35 ARG CB 1 1 17 10742 1 1 35 ARG CD C -4.406 4.108 8.931 1.00 . A A . 35 ARG CD 1 1 17 10743 1 1 35 ARG CG C -3.335 3.349 9.698 1.00 . A A . 35 ARG CG 1 1 17 10744 1 1 35 ARG CZ C -3.895 6.480 9.360 1.00 . A A . 35 ARG CZ 1 1 17 10745 1 1 35 ARG H H -1.354 0.635 6.808 1.00 . A A . 35 ARG H 1 1 17 10746 1 1 35 ARG HA H -2.828 0.735 9.293 1.00 . A A . 35 ARG HA 1 1 17 10747 1 1 35 ARG HB2 H -1.339 2.789 9.239 1.00 . A A . 35 ARG HB2 1 1 17 10748 1 1 35 ARG HB3 H -2.281 3.327 7.855 1.00 . A A . 35 ARG HB3 1 1 17 10749 1 1 35 ARG HD2 H -4.663 3.546 8.045 1.00 . A A . 35 ARG HD2 1 1 17 10750 1 1 35 ARG HD3 H -5.278 4.207 9.560 1.00 . A A . 35 ARG HD3 1 1 17 10751 1 1 35 ARG HE H -3.680 5.564 7.600 1.00 . A A . 35 ARG HE 1 1 17 10752 1 1 35 ARG HG2 H -3.805 2.559 10.265 1.00 . A A . 35 ARG HG2 1 1 17 10753 1 1 35 ARG HG3 H -2.835 4.030 10.371 1.00 . A A . 35 ARG HG3 1 1 17 10754 1 1 35 ARG HH11 H -4.577 5.465 10.971 1.00 . A A . 35 ARG HH11 1 1 17 10755 1 1 35 ARG HH12 H -4.211 7.135 11.247 1.00 . A A . 35 ARG HH12 1 1 17 10756 1 1 35 ARG HH21 H -3.198 7.761 7.961 1.00 . A A . 35 ARG HH21 1 1 17 10757 1 1 35 ARG HH22 H -3.428 8.439 9.538 1.00 . A A . 35 ARG HH22 1 1 17 10758 1 1 35 ARG N N -1.425 0.667 7.785 1.00 . A A . 35 ARG N 1 1 17 10759 1 1 35 ARG NE N -3.954 5.439 8.533 1.00 . A A . 35 ARG NE 1 1 17 10760 1 1 35 ARG NH1 N -4.258 6.349 10.630 1.00 . A A . 35 ARG NH1 1 1 17 10761 1 1 35 ARG NH2 N -3.472 7.656 8.917 1.00 . A A . 35 ARG NH2 1 1 17 10762 1 1 35 ARG O O -4.888 0.789 7.862 1.00 . A A . 35 ARG O 1 1 17 10763 1 1 36 SER C C -4.155 1.167 3.872 1.00 . A A . 36 SER C 1 1 17 10764 1 1 36 SER CA C -4.674 1.628 5.229 1.00 . A A . 36 SER CA 1 1 17 10765 1 1 36 SER CB C -5.293 3.021 5.104 1.00 . A A . 36 SER CB 1 1 17 10766 1 1 36 SER H H -2.718 1.963 5.968 1.00 . A A . 36 SER H 1 1 17 10767 1 1 36 SER HA H -5.432 0.936 5.563 1.00 . A A . 36 SER HA 1 1 17 10768 1 1 36 SER HB2 H -5.635 3.171 4.091 1.00 . A A . 36 SER HB2 1 1 17 10769 1 1 36 SER HB3 H -6.129 3.103 5.782 1.00 . A A . 36 SER HB3 1 1 17 10770 1 1 36 SER HG H -3.724 4.121 4.697 1.00 . A A . 36 SER HG 1 1 17 10771 1 1 36 SER N N -3.605 1.636 6.222 1.00 . A A . 36 SER N 1 1 17 10772 1 1 36 SER O O -2.954 0.968 3.689 1.00 . A A . 36 SER O 1 1 17 10773 1 1 36 SER OG O -4.348 4.029 5.420 1.00 . A A . 36 SER OG 1 1 17 10774 1 1 37 CYS C C -4.436 1.755 0.661 1.00 . A A . 37 CYS C 1 1 17 10775 1 1 37 CYS CA C -4.703 0.563 1.580 1.00 . A A . 37 CYS CA 1 1 17 10776 1 1 37 CYS CB C -5.804 -0.316 0.985 1.00 . A A . 37 CYS CB 1 1 17 10777 1 1 37 CYS H H -6.010 1.175 3.128 1.00 . A A . 37 CYS H 1 1 17 10778 1 1 37 CYS HA H -3.800 -0.019 1.661 1.00 . A A . 37 CYS HA 1 1 17 10779 1 1 37 CYS HB2 H -6.059 -1.089 1.694 1.00 . A A . 37 CYS HB2 1 1 17 10780 1 1 37 CYS HB3 H -6.677 0.292 0.794 1.00 . A A . 37 CYS HB3 1 1 17 10781 1 1 37 CYS N N -5.069 1.000 2.922 1.00 . A A . 37 CYS N 1 1 17 10782 1 1 37 CYS O O -4.256 1.589 -0.546 1.00 . A A . 37 CYS O 1 1 17 10783 1 1 37 CYS SG S -5.339 -1.128 -0.578 1.00 . A A . 37 CYS SG 1 1 17 10784 1 1 38 GLU C C -2.660 4.446 0.361 1.00 . A A . 38 GLU C 1 1 17 10785 1 1 38 GLU CA C -4.157 4.165 0.460 1.00 . A A . 38 GLU CA 1 1 17 10786 1 1 38 GLU CB C -4.872 5.359 1.094 1.00 . A A . 38 GLU CB 1 1 17 10787 1 1 38 GLU CD C -6.959 6.227 2.222 1.00 . A A . 38 GLU CD 1 1 17 10788 1 1 38 GLU CG C -6.306 5.063 1.503 1.00 . A A . 38 GLU CG 1 1 17 10789 1 1 38 GLU H H -4.556 3.027 2.201 1.00 . A A . 38 GLU H 1 1 17 10790 1 1 38 GLU HA H -4.548 4.008 -0.534 1.00 . A A . 38 GLU HA 1 1 17 10791 1 1 38 GLU HB2 H -4.326 5.665 1.974 1.00 . A A . 38 GLU HB2 1 1 17 10792 1 1 38 GLU HB3 H -4.883 6.175 0.387 1.00 . A A . 38 GLU HB3 1 1 17 10793 1 1 38 GLU HG2 H -6.880 4.840 0.616 1.00 . A A . 38 GLU HG2 1 1 17 10794 1 1 38 GLU HG3 H -6.310 4.205 2.158 1.00 . A A . 38 GLU HG3 1 1 17 10795 1 1 38 GLU N N -4.407 2.954 1.235 1.00 . A A . 38 GLU N 1 1 17 10796 1 1 38 GLU O O -1.994 4.674 1.371 1.00 . A A . 38 GLU O 1 1 17 10797 1 1 38 GLU OE1 O -6.554 6.520 3.366 1.00 . A A . 38 GLU OE1 1 1 17 10798 1 1 38 GLU OE2 O -7.875 6.845 1.641 1.00 . A A . 38 GLU OE2 1 1 17 10799 1 1 39 CYS C C -0.435 6.182 -1.175 1.00 . A A . 39 CYS C 1 1 17 10800 1 1 39 CYS CA C -0.717 4.682 -1.089 1.00 . A A . 39 CYS CA 1 1 17 10801 1 1 39 CYS CB C -0.252 4.001 -2.378 1.00 . A A . 39 CYS CB 1 1 17 10802 1 1 39 CYS H H -2.717 4.241 -1.628 1.00 . A A . 39 CYS H 1 1 17 10803 1 1 39 CYS HA H -0.170 4.268 -0.257 1.00 . A A . 39 CYS HA 1 1 17 10804 1 1 39 CYS HB2 H -0.955 4.225 -3.167 1.00 . A A . 39 CYS HB2 1 1 17 10805 1 1 39 CYS HB3 H 0.719 4.387 -2.650 1.00 . A A . 39 CYS HB3 1 1 17 10806 1 1 39 CYS N N -2.136 4.429 -0.862 1.00 . A A . 39 CYS N 1 1 17 10807 1 1 39 CYS O O -1.103 6.902 -1.917 1.00 . A A . 39 CYS O 1 1 17 10808 1 1 39 CYS SG S -0.116 2.189 -2.260 1.00 . A A . 39 CYS SG 1 1 17 10809 1 1 40 PRO C C 1.238 8.592 -1.843 1.00 . A A . 40 PRO C 1 1 17 10810 1 1 40 PRO CA C 0.929 8.097 -0.437 1.00 . A A . 40 PRO CA 1 1 17 10811 1 1 40 PRO CB C 2.184 8.159 0.438 1.00 . A A . 40 PRO CB 1 1 17 10812 1 1 40 PRO CD C 1.426 5.895 0.485 1.00 . A A . 40 PRO CD 1 1 17 10813 1 1 40 PRO CG C 2.107 6.952 1.307 1.00 . A A . 40 PRO CG 1 1 17 10814 1 1 40 PRO HA H 0.153 8.710 -0.004 1.00 . A A . 40 PRO HA 1 1 17 10815 1 1 40 PRO HB2 H 3.064 8.139 -0.189 1.00 . A A . 40 PRO HB2 1 1 17 10816 1 1 40 PRO HB3 H 2.174 9.067 1.024 1.00 . A A . 40 PRO HB3 1 1 17 10817 1 1 40 PRO HD2 H 2.153 5.321 -0.069 1.00 . A A . 40 PRO HD2 1 1 17 10818 1 1 40 PRO HD3 H 0.833 5.250 1.116 1.00 . A A . 40 PRO HD3 1 1 17 10819 1 1 40 PRO HG2 H 3.101 6.632 1.581 1.00 . A A . 40 PRO HG2 1 1 17 10820 1 1 40 PRO HG3 H 1.526 7.172 2.191 1.00 . A A . 40 PRO HG3 1 1 17 10821 1 1 40 PRO N N 0.566 6.676 -0.424 1.00 . A A . 40 PRO N 1 1 17 10822 1 1 40 PRO O O 1.160 7.835 -2.810 1.00 . A A . 40 PRO O 1 1 17 10823 1 1 41 SER C C 3.403 10.774 -3.337 1.00 . A A . 41 SER C 1 1 17 10824 1 1 41 SER CA C 1.912 10.464 -3.240 1.00 . A A . 41 SER CA 1 1 17 10825 1 1 41 SER CB C 1.097 11.740 -3.456 1.00 . A A . 41 SER CB 1 1 17 10826 1 1 41 SER H H 1.632 10.419 -1.141 1.00 . A A . 41 SER H 1 1 17 10827 1 1 41 SER HA H 1.657 9.748 -4.009 1.00 . A A . 41 SER HA 1 1 17 10828 1 1 41 SER HB2 H 1.683 12.595 -3.152 1.00 . A A . 41 SER HB2 1 1 17 10829 1 1 41 SER HB3 H 0.844 11.831 -4.502 1.00 . A A . 41 SER HB3 1 1 17 10830 1 1 41 SER HG H -0.077 12.416 -2.041 1.00 . A A . 41 SER HG 1 1 17 10831 1 1 41 SER N N 1.589 9.867 -1.950 1.00 . A A . 41 SER N 1 1 17 10832 1 1 41 SER O O 3.801 11.785 -3.915 1.00 . A A . 41 SER O 1 1 17 10833 1 1 41 SER OG O -0.099 11.716 -2.697 1.00 . A A . 41 SER OG 1 1 17 10834 1 1 42 TYR C C 6.377 8.801 -2.326 1.00 . A A . 42 TYR C 1 1 17 10835 1 1 42 TYR CA C 5.668 10.072 -2.789 1.00 . A A . 42 TYR CA 1 1 17 10836 1 1 42 TYR CB C 6.074 11.252 -1.902 1.00 . A A . 42 TYR CB 1 1 17 10837 1 1 42 TYR CD1 C 6.779 10.388 0.363 1.00 . A A . 42 TYR CD1 1 1 17 10838 1 1 42 TYR CD2 C 4.642 11.428 0.171 1.00 . A A . 42 TYR CD2 1 1 17 10839 1 1 42 TYR CE1 C 6.558 10.172 1.710 1.00 . A A . 42 TYR CE1 1 1 17 10840 1 1 42 TYR CE2 C 4.414 11.216 1.517 1.00 . A A . 42 TYR CE2 1 1 17 10841 1 1 42 TYR CG C 5.827 11.018 -0.428 1.00 . A A . 42 TYR CG 1 1 17 10842 1 1 42 TYR CZ C 5.374 10.588 2.282 1.00 . A A . 42 TYR CZ 1 1 17 10843 1 1 42 TYR H H 3.843 9.109 -2.322 1.00 . A A . 42 TYR H 1 1 17 10844 1 1 42 TYR HA H 5.960 10.282 -3.807 1.00 . A A . 42 TYR HA 1 1 17 10845 1 1 42 TYR HB2 H 7.127 11.446 -2.034 1.00 . A A . 42 TYR HB2 1 1 17 10846 1 1 42 TYR HB3 H 5.512 12.125 -2.199 1.00 . A A . 42 TYR HB3 1 1 17 10847 1 1 42 TYR HD1 H 7.705 10.064 -0.088 1.00 . A A . 42 TYR HD1 1 1 17 10848 1 1 42 TYR HD2 H 3.892 11.918 -0.431 1.00 . A A . 42 TYR HD2 1 1 17 10849 1 1 42 TYR HE1 H 7.310 9.681 2.308 1.00 . A A . 42 TYR HE1 1 1 17 10850 1 1 42 TYR HE2 H 3.486 11.541 1.965 1.00 . A A . 42 TYR HE2 1 1 17 10851 1 1 42 TYR HH H 5.041 9.435 3.784 1.00 . A A . 42 TYR HH 1 1 17 10852 1 1 42 TYR N N 4.221 9.895 -2.767 1.00 . A A . 42 TYR N 1 1 17 10853 1 1 42 TYR O O 5.865 8.069 -1.479 1.00 . A A . 42 TYR O 1 1 17 10854 1 1 42 TYR OH O 5.150 10.375 3.623 1.00 . A A . 42 TYR OH 1 1 17 10855 1 1 43 PRO C C 8.972 7.445 -1.132 1.00 . A A . 43 PRO C 1 1 17 10856 1 1 43 PRO CA C 8.346 7.330 -2.517 1.00 . A A . 43 PRO CA 1 1 17 10857 1 1 43 PRO CB C 9.431 7.279 -3.593 1.00 . A A . 43 PRO CB 1 1 17 10858 1 1 43 PRO CD C 8.255 9.338 -3.898 1.00 . A A . 43 PRO CD 1 1 17 10859 1 1 43 PRO CG C 9.611 8.696 -4.011 1.00 . A A . 43 PRO CG 1 1 17 10860 1 1 43 PRO HA H 7.743 6.435 -2.565 1.00 . A A . 43 PRO HA 1 1 17 10861 1 1 43 PRO HB2 H 10.339 6.870 -3.174 1.00 . A A . 43 PRO HB2 1 1 17 10862 1 1 43 PRO HB3 H 9.097 6.664 -4.416 1.00 . A A . 43 PRO HB3 1 1 17 10863 1 1 43 PRO HD2 H 8.349 10.363 -3.570 1.00 . A A . 43 PRO HD2 1 1 17 10864 1 1 43 PRO HD3 H 7.735 9.290 -4.844 1.00 . A A . 43 PRO HD3 1 1 17 10865 1 1 43 PRO HG2 H 10.314 9.186 -3.354 1.00 . A A . 43 PRO HG2 1 1 17 10866 1 1 43 PRO HG3 H 9.960 8.736 -5.032 1.00 . A A . 43 PRO HG3 1 1 17 10867 1 1 43 PRO N N 7.570 8.520 -2.879 1.00 . A A . 43 PRO N 1 1 17 10868 1 1 43 PRO O O 9.258 8.545 -0.659 1.00 . A A . 43 PRO O 1 1 17 10869 1 1 44 GLY C C 11.177 6.874 0.849 1.00 . A A . 44 GLY C 1 1 17 10870 1 1 44 GLY CA C 9.775 6.297 0.838 1.00 . A A . 44 GLY CA 1 1 17 10871 1 1 44 GLY H H 8.935 5.457 -0.915 1.00 . A A . 44 GLY H 1 1 17 10872 1 1 44 GLY HA2 H 9.813 5.280 1.198 1.00 . A A . 44 GLY HA2 1 1 17 10873 1 1 44 GLY HA3 H 9.152 6.880 1.500 1.00 . A A . 44 GLY HA3 1 1 17 10874 1 1 44 GLY N N 9.183 6.303 -0.487 1.00 . A A . 44 GLY N 1 1 17 10875 1 1 44 GLY O O 11.647 7.402 -0.159 1.00 . A A . 44 GLY O 1 1 17 10876 1 1 45 ASN C C 13.246 8.790 1.859 1.00 . A A . 45 ASN C 1 1 17 10877 1 1 45 ASN CA C 13.203 7.290 2.133 1.00 . A A . 45 ASN CA 1 1 17 10878 1 1 45 ASN CB C 14.150 6.557 1.181 1.00 . A A . 45 ASN CB 1 1 17 10879 1 1 45 ASN CG C 14.661 5.254 1.763 1.00 . A A . 45 ASN CG 1 1 17 10880 1 1 45 ASN H H 11.417 6.342 2.762 1.00 . A A . 45 ASN H 1 1 17 10881 1 1 45 ASN HA H 13.521 7.113 3.149 1.00 . A A . 45 ASN HA 1 1 17 10882 1 1 45 ASN HB2 H 13.628 6.339 0.261 1.00 . A A . 45 ASN HB2 1 1 17 10883 1 1 45 ASN HB3 H 14.998 7.192 0.967 1.00 . A A . 45 ASN HB3 1 1 17 10884 1 1 45 ASN HD21 H 14.841 4.481 -0.060 1.00 . A A . 45 ASN HD21 1 1 17 10885 1 1 45 ASN HD22 H 15.295 3.443 1.244 1.00 . A A . 45 ASN HD22 1 1 17 10886 1 1 45 ASN N N 11.846 6.774 1.993 1.00 . A A . 45 ASN N 1 1 17 10887 1 1 45 ASN ND2 N 14.963 4.296 0.895 1.00 . A A . 45 ASN ND2 1 1 17 10888 1 1 45 ASN O O 13.711 9.227 0.806 1.00 . A A . 45 ASN O 1 1 17 10889 1 1 45 ASN OD1 O 14.783 5.109 2.980 1.00 . A A . 45 ASN OD1 1 1 17 10890 1 1 46 GLY C C 12.445 11.741 3.953 1.00 . A A . 46 GLY C 1 1 17 10891 1 1 46 GLY CA C 12.748 11.017 2.655 1.00 . A A . 46 GLY CA 1 1 17 10892 1 1 46 GLY H H 12.398 9.171 3.631 1.00 . A A . 46 GLY H 1 1 17 10893 1 1 46 GLY HA2 H 11.999 11.284 1.924 1.00 . A A . 46 GLY HA2 1 1 17 10894 1 1 46 GLY HA3 H 13.716 11.335 2.297 1.00 . A A . 46 GLY HA3 1 1 17 10895 1 1 46 GLY N N 12.756 9.575 2.813 1.00 . A A . 46 GLY N 1 1 17 10896 1 1 46 GLY O O 11.757 11.153 4.814 1.00 . A A . 46 GLY O 1 1 17 10897 1 1 46 GLY OXT O 12.896 12.895 4.108 1.00 . A A . 46 GLY OXT 1 1 18 10898 1 1 1 ALA C C -17.464 -6.103 9.475 1.00 . A A . 1 ALA C 1 1 18 10899 1 1 1 ALA CA C -18.885 -6.473 9.885 1.00 . A A . 1 ALA CA 1 1 18 10900 1 1 1 ALA CB C -19.608 -5.254 10.438 1.00 . A A . 1 ALA CB 1 1 18 10901 1 1 1 ALA H1 H -18.110 -8.220 10.644 1.00 . A A . 1 ALA H1 1 1 18 10902 1 1 1 ALA H2 H -18.732 -7.143 11.823 1.00 . A A . 1 ALA H2 1 1 18 10903 1 1 1 ALA H3 H -19.806 -8.047 10.836 1.00 . A A . 1 ALA H3 1 1 18 10904 1 1 1 ALA HA H -19.422 -6.813 9.011 1.00 . A A . 1 ALA HA 1 1 18 10905 1 1 1 ALA HB1 H -19.419 -5.174 11.498 1.00 . A A . 1 ALA HB1 1 1 18 10906 1 1 1 ALA HB2 H -20.670 -5.358 10.269 1.00 . A A . 1 ALA HB2 1 1 18 10907 1 1 1 ALA HB3 H -19.249 -4.366 9.940 1.00 . A A . 1 ALA HB3 1 1 18 10908 1 1 1 ALA N N -18.883 -7.570 10.887 1.00 . A A . 1 ALA N 1 1 18 10909 1 1 1 ALA O O -16.675 -5.630 10.293 1.00 . A A . 1 ALA O 1 1 18 10910 1 1 2 MET C C -15.898 -5.513 6.246 1.00 . A A . 2 MET C 1 1 18 10911 1 1 2 MET CA C -15.817 -6.012 7.685 1.00 . A A . 2 MET CA 1 1 18 10912 1 1 2 MET CB C -14.916 -7.246 7.760 1.00 . A A . 2 MET CB 1 1 18 10913 1 1 2 MET CE C -13.239 -8.802 9.981 1.00 . A A . 2 MET CE 1 1 18 10914 1 1 2 MET CG C -13.446 -6.915 7.962 1.00 . A A . 2 MET CG 1 1 18 10915 1 1 2 MET H H -17.816 -6.702 7.600 1.00 . A A . 2 MET H 1 1 18 10916 1 1 2 MET HA H -15.395 -5.232 8.301 1.00 . A A . 2 MET HA 1 1 18 10917 1 1 2 MET HB2 H -15.240 -7.865 8.583 1.00 . A A . 2 MET HB2 1 1 18 10918 1 1 2 MET HB3 H -15.013 -7.804 6.840 1.00 . A A . 2 MET HB3 1 1 18 10919 1 1 2 MET HE1 H -13.616 -7.913 10.464 1.00 . A A . 2 MET HE1 1 1 18 10920 1 1 2 MET HE2 H -14.056 -9.484 9.794 1.00 . A A . 2 MET HE2 1 1 18 10921 1 1 2 MET HE3 H -12.511 -9.279 10.621 1.00 . A A . 2 MET HE3 1 1 18 10922 1 1 2 MET HG2 H -13.051 -6.512 7.042 1.00 . A A . 2 MET HG2 1 1 18 10923 1 1 2 MET HG3 H -13.363 -6.173 8.743 1.00 . A A . 2 MET HG3 1 1 18 10924 1 1 2 MET N N -17.144 -6.322 8.204 1.00 . A A . 2 MET N 1 1 18 10925 1 1 2 MET O O -16.735 -5.968 5.467 1.00 . A A . 2 MET O 1 1 18 10926 1 1 2 MET SD S -12.467 -8.356 8.428 1.00 . A A . 2 MET SD 1 1 18 10927 1 1 3 ASP C C -13.571 -3.985 4.006 1.00 . A A . 3 ASP C 1 1 18 10928 1 1 3 ASP CA C -14.994 -4.014 4.554 1.00 . A A . 3 ASP CA 1 1 18 10929 1 1 3 ASP CB C -15.582 -2.602 4.556 1.00 . A A . 3 ASP CB 1 1 18 10930 1 1 3 ASP CG C -14.975 -1.724 5.632 1.00 . A A . 3 ASP CG 1 1 18 10931 1 1 3 ASP H H -14.379 -4.252 6.566 1.00 . A A . 3 ASP H 1 1 18 10932 1 1 3 ASP HA H -15.599 -4.645 3.920 1.00 . A A . 3 ASP HA 1 1 18 10933 1 1 3 ASP HB2 H -15.399 -2.141 3.596 1.00 . A A . 3 ASP HB2 1 1 18 10934 1 1 3 ASP HB3 H -16.648 -2.662 4.724 1.00 . A A . 3 ASP HB3 1 1 18 10935 1 1 3 ASP N N -15.022 -4.575 5.900 1.00 . A A . 3 ASP N 1 1 18 10936 1 1 3 ASP O O -12.613 -3.781 4.751 1.00 . A A . 3 ASP O 1 1 18 10937 1 1 3 ASP OD1 O -15.444 -1.791 6.788 1.00 . A A . 3 ASP OD1 1 1 18 10938 1 1 3 ASP OD2 O -14.030 -0.969 5.320 1.00 . A A . 3 ASP OD2 1 1 18 10939 1 1 4 CYS C C -11.926 -2.903 1.253 1.00 . A A . 4 CYS C 1 1 18 10940 1 1 4 CYS CA C -12.135 -4.186 2.051 1.00 . A A . 4 CYS CA 1 1 18 10941 1 1 4 CYS CB C -11.996 -5.399 1.131 1.00 . A A . 4 CYS CB 1 1 18 10942 1 1 4 CYS H H -14.243 -4.346 2.158 1.00 . A A . 4 CYS H 1 1 18 10943 1 1 4 CYS HA H -11.382 -4.243 2.823 1.00 . A A . 4 CYS HA 1 1 18 10944 1 1 4 CYS HB2 H -12.629 -5.261 0.267 1.00 . A A . 4 CYS HB2 1 1 18 10945 1 1 4 CYS HB3 H -10.969 -5.479 0.807 1.00 . A A . 4 CYS HB3 1 1 18 10946 1 1 4 CYS N N -13.442 -4.189 2.700 1.00 . A A . 4 CYS N 1 1 18 10947 1 1 4 CYS O O -12.881 -2.309 0.752 1.00 . A A . 4 CYS O 1 1 18 10948 1 1 4 CYS SG S -12.458 -6.982 1.907 1.00 . A A . 4 CYS SG 1 1 18 10949 1 1 5 THR C C -9.500 -1.607 -0.833 1.00 . A A . 5 THR C 1 1 18 10950 1 1 5 THR CA C -10.333 -1.272 0.400 1.00 . A A . 5 THR CA 1 1 18 10951 1 1 5 THR CB C -9.569 -0.299 1.301 1.00 . A A . 5 THR CB 1 1 18 10952 1 1 5 THR CG2 C -9.186 0.989 0.605 1.00 . A A . 5 THR CG2 1 1 18 10953 1 1 5 THR H H -9.954 -3.001 1.560 1.00 . A A . 5 THR H 1 1 18 10954 1 1 5 THR HA H -11.254 -0.807 0.083 1.00 . A A . 5 THR HA 1 1 18 10955 1 1 5 THR HB H -8.659 -0.776 1.637 1.00 . A A . 5 THR HB 1 1 18 10956 1 1 5 THR HG1 H -10.358 -0.703 3.047 1.00 . A A . 5 THR HG1 1 1 18 10957 1 1 5 THR HG21 H -8.755 0.764 -0.359 1.00 . A A . 5 THR HG21 1 1 18 10958 1 1 5 THR HG22 H -10.067 1.601 0.471 1.00 . A A . 5 THR HG22 1 1 18 10959 1 1 5 THR HG23 H -8.465 1.523 1.206 1.00 . A A . 5 THR HG23 1 1 18 10960 1 1 5 THR N N -10.671 -2.483 1.139 1.00 . A A . 5 THR N 1 1 18 10961 1 1 5 THR O O -8.290 -1.382 -0.858 1.00 . A A . 5 THR O 1 1 18 10962 1 1 5 THR OG1 O -10.340 0.040 2.439 1.00 . A A . 5 THR OG1 1 1 18 10963 1 1 6 THR C C -8.528 -1.434 -3.568 1.00 . A A . 6 THR C 1 1 18 10964 1 1 6 THR CA C -9.485 -2.527 -3.097 1.00 . A A . 6 THR CA 1 1 18 10965 1 1 6 THR CB C -10.515 -2.821 -4.188 1.00 . A A . 6 THR CB 1 1 18 10966 1 1 6 THR CG2 C -10.942 -4.273 -4.230 1.00 . A A . 6 THR CG2 1 1 18 10967 1 1 6 THR H H -11.122 -2.306 -1.771 1.00 . A A . 6 THR H 1 1 18 10968 1 1 6 THR HA H -8.916 -3.424 -2.904 1.00 . A A . 6 THR HA 1 1 18 10969 1 1 6 THR HB H -10.087 -2.575 -5.149 1.00 . A A . 6 THR HB 1 1 18 10970 1 1 6 THR HG1 H -12.151 -1.963 -4.837 1.00 . A A . 6 THR HG1 1 1 18 10971 1 1 6 THR HG21 H -10.381 -4.834 -3.497 1.00 . A A . 6 THR HG21 1 1 18 10972 1 1 6 THR HG22 H -11.997 -4.344 -4.008 1.00 . A A . 6 THR HG22 1 1 18 10973 1 1 6 THR HG23 H -10.753 -4.676 -5.214 1.00 . A A . 6 THR HG23 1 1 18 10974 1 1 6 THR N N -10.158 -2.151 -1.855 1.00 . A A . 6 THR N 1 1 18 10975 1 1 6 THR O O -8.954 -0.360 -3.994 1.00 . A A . 6 THR O 1 1 18 10976 1 1 6 THR OG1 O -11.679 -2.036 -4.004 1.00 . A A . 6 THR OG1 1 1 18 10977 1 1 7 GLY C C -4.907 -1.417 -4.250 1.00 . A A . 7 GLY C 1 1 18 10978 1 1 7 GLY CA C -6.230 -0.758 -3.906 1.00 . A A . 7 GLY CA 1 1 18 10979 1 1 7 GLY H H -6.954 -2.592 -3.139 1.00 . A A . 7 GLY H 1 1 18 10980 1 1 7 GLY HA2 H -6.069 -0.049 -3.108 1.00 . A A . 7 GLY HA2 1 1 18 10981 1 1 7 GLY HA3 H -6.594 -0.230 -4.775 1.00 . A A . 7 GLY HA3 1 1 18 10982 1 1 7 GLY N N -7.232 -1.719 -3.487 1.00 . A A . 7 GLY N 1 1 18 10983 1 1 7 GLY O O -4.825 -2.643 -4.325 1.00 . A A . 7 GLY O 1 1 18 10984 1 1 8 PRO C C -1.865 -1.864 -3.627 1.00 . A A . 8 PRO C 1 1 18 10985 1 1 8 PRO CA C -2.520 -1.153 -4.808 1.00 . A A . 8 PRO CA 1 1 18 10986 1 1 8 PRO CB C -1.709 0.093 -5.200 1.00 . A A . 8 PRO CB 1 1 18 10987 1 1 8 PRO CD C -3.844 0.841 -4.405 1.00 . A A . 8 PRO CD 1 1 18 10988 1 1 8 PRO CG C -2.699 1.210 -5.301 1.00 . A A . 8 PRO CG 1 1 18 10989 1 1 8 PRO HA H -2.571 -1.831 -5.647 1.00 . A A . 8 PRO HA 1 1 18 10990 1 1 8 PRO HB2 H -0.968 0.294 -4.442 1.00 . A A . 8 PRO HB2 1 1 18 10991 1 1 8 PRO HB3 H -1.219 -0.081 -6.147 1.00 . A A . 8 PRO HB3 1 1 18 10992 1 1 8 PRO HD2 H -3.663 1.186 -3.397 1.00 . A A . 8 PRO HD2 1 1 18 10993 1 1 8 PRO HD3 H -4.770 1.245 -4.785 1.00 . A A . 8 PRO HD3 1 1 18 10994 1 1 8 PRO HG2 H -2.245 2.132 -4.968 1.00 . A A . 8 PRO HG2 1 1 18 10995 1 1 8 PRO HG3 H -3.038 1.307 -6.322 1.00 . A A . 8 PRO HG3 1 1 18 10996 1 1 8 PRO N N -3.844 -0.625 -4.469 1.00 . A A . 8 PRO N 1 1 18 10997 1 1 8 PRO O O -1.162 -2.858 -3.801 1.00 . A A . 8 PRO O 1 1 18 10998 1 1 9 CYS C C -2.379 -3.112 -0.737 1.00 . A A . 9 CYS C 1 1 18 10999 1 1 9 CYS CA C -1.538 -1.933 -1.213 1.00 . A A . 9 CYS CA 1 1 18 11000 1 1 9 CYS CB C -1.443 -0.879 -0.108 1.00 . A A . 9 CYS CB 1 1 18 11001 1 1 9 CYS H H -2.673 -0.553 -2.350 1.00 . A A . 9 CYS H 1 1 18 11002 1 1 9 CYS HA H -0.545 -2.286 -1.448 1.00 . A A . 9 CYS HA 1 1 18 11003 1 1 9 CYS HB2 H -0.947 -0.003 -0.497 1.00 . A A . 9 CYS HB2 1 1 18 11004 1 1 9 CYS HB3 H -2.440 -0.610 0.209 1.00 . A A . 9 CYS HB3 1 1 18 11005 1 1 9 CYS N N -2.103 -1.347 -2.425 1.00 . A A . 9 CYS N 1 1 18 11006 1 1 9 CYS O O -1.861 -4.058 -0.144 1.00 . A A . 9 CYS O 1 1 18 11007 1 1 9 CYS SG S -0.522 -1.428 1.365 1.00 . A A . 9 CYS SG 1 1 18 11008 1 1 10 CYS C C -4.241 -5.419 -1.310 1.00 . A A . 10 CYS C 1 1 18 11009 1 1 10 CYS CA C -4.594 -4.111 -0.605 1.00 . A A . 10 CYS CA 1 1 18 11010 1 1 10 CYS CB C -6.035 -3.711 -0.930 1.00 . A A . 10 CYS CB 1 1 18 11011 1 1 10 CYS H H -4.031 -2.269 -1.479 1.00 . A A . 10 CYS H 1 1 18 11012 1 1 10 CYS HA H -4.499 -4.252 0.462 1.00 . A A . 10 CYS HA 1 1 18 11013 1 1 10 CYS HB2 H -6.033 -2.728 -1.374 1.00 . A A . 10 CYS HB2 1 1 18 11014 1 1 10 CYS HB3 H -6.446 -4.417 -1.637 1.00 . A A . 10 CYS HB3 1 1 18 11015 1 1 10 CYS N N -3.679 -3.049 -1.002 1.00 . A A . 10 CYS N 1 1 18 11016 1 1 10 CYS O O -4.530 -5.593 -2.494 1.00 . A A . 10 CYS O 1 1 18 11017 1 1 10 CYS SG S -7.146 -3.663 0.514 1.00 . A A . 10 CYS SG 1 1 18 11018 1 1 11 ARG C C -4.436 -8.504 -1.416 1.00 . A A . 11 ARG C 1 1 18 11019 1 1 11 ARG CA C -3.221 -7.623 -1.138 1.00 . A A . 11 ARG CA 1 1 18 11020 1 1 11 ARG CB C -2.260 -8.344 -0.191 1.00 . A A . 11 ARG CB 1 1 18 11021 1 1 11 ARG CD C -0.407 -10.041 -0.230 1.00 . A A . 11 ARG CD 1 1 18 11022 1 1 11 ARG CG C -1.815 -9.708 -0.694 1.00 . A A . 11 ARG CG 1 1 18 11023 1 1 11 ARG CZ C 1.895 -9.960 -1.106 1.00 . A A . 11 ARG CZ 1 1 18 11024 1 1 11 ARG H H -3.408 -6.137 0.361 1.00 . A A . 11 ARG H 1 1 18 11025 1 1 11 ARG HA H -2.715 -7.433 -2.069 1.00 . A A . 11 ARG HA 1 1 18 11026 1 1 11 ARG HB2 H -1.382 -7.733 -0.054 1.00 . A A . 11 ARG HB2 1 1 18 11027 1 1 11 ARG HB3 H -2.747 -8.478 0.764 1.00 . A A . 11 ARG HB3 1 1 18 11028 1 1 11 ARG HD2 H -0.202 -9.494 0.679 1.00 . A A . 11 ARG HD2 1 1 18 11029 1 1 11 ARG HD3 H -0.348 -11.102 -0.031 1.00 . A A . 11 ARG HD3 1 1 18 11030 1 1 11 ARG HE H 0.289 -9.228 -2.038 1.00 . A A . 11 ARG HE 1 1 18 11031 1 1 11 ARG HG2 H -2.494 -10.459 -0.318 1.00 . A A . 11 ARG HG2 1 1 18 11032 1 1 11 ARG HG3 H -1.838 -9.708 -1.774 1.00 . A A . 11 ARG HG3 1 1 18 11033 1 1 11 ARG HH11 H 1.717 -10.854 0.699 1.00 . A A . 11 ARG HH11 1 1 18 11034 1 1 11 ARG HH12 H 3.325 -10.784 0.061 1.00 . A A . 11 ARG HH12 1 1 18 11035 1 1 11 ARG HH21 H 2.404 -9.135 -2.879 1.00 . A A . 11 ARG HH21 1 1 18 11036 1 1 11 ARG HH22 H 3.715 -9.807 -1.970 1.00 . A A . 11 ARG HH22 1 1 18 11037 1 1 11 ARG N N -3.614 -6.333 -0.577 1.00 . A A . 11 ARG N 1 1 18 11038 1 1 11 ARG NE N 0.597 -9.690 -1.231 1.00 . A A . 11 ARG NE 1 1 18 11039 1 1 11 ARG NH1 N 2.349 -10.584 -0.026 1.00 . A A . 11 ARG NH1 1 1 18 11040 1 1 11 ARG NH2 N 2.741 -9.605 -2.064 1.00 . A A . 11 ARG NH2 1 1 18 11041 1 1 11 ARG O O -4.324 -9.536 -2.079 1.00 . A A . 11 ARG O 1 1 18 11042 1 1 12 GLN C C -7.967 -8.244 -0.295 1.00 . A A . 12 GLN C 1 1 18 11043 1 1 12 GLN CA C -6.826 -8.852 -1.103 1.00 . A A . 12 GLN CA 1 1 18 11044 1 1 12 GLN CB C -6.628 -10.319 -0.703 1.00 . A A . 12 GLN CB 1 1 18 11045 1 1 12 GLN CD C -6.380 -11.031 -3.114 1.00 . A A . 12 GLN CD 1 1 18 11046 1 1 12 GLN CG C -7.049 -11.305 -1.780 1.00 . A A . 12 GLN CG 1 1 18 11047 1 1 12 GLN H H -5.621 -7.267 -0.389 1.00 . A A . 12 GLN H 1 1 18 11048 1 1 12 GLN HA H -7.080 -8.806 -2.151 1.00 . A A . 12 GLN HA 1 1 18 11049 1 1 12 GLN HB2 H -5.584 -10.483 -0.483 1.00 . A A . 12 GLN HB2 1 1 18 11050 1 1 12 GLN HB3 H -7.209 -10.521 0.186 1.00 . A A . 12 GLN HB3 1 1 18 11051 1 1 12 GLN HE21 H -4.878 -12.243 -2.637 1.00 . A A . 12 GLN HE21 1 1 18 11052 1 1 12 GLN HE22 H -4.774 -11.493 -4.190 1.00 . A A . 12 GLN HE22 1 1 18 11053 1 1 12 GLN HG2 H -6.785 -12.302 -1.461 1.00 . A A . 12 GLN HG2 1 1 18 11054 1 1 12 GLN HG3 H -8.119 -11.241 -1.911 1.00 . A A . 12 GLN HG3 1 1 18 11055 1 1 12 GLN N N -5.593 -8.096 -0.908 1.00 . A A . 12 GLN N 1 1 18 11056 1 1 12 GLN NE2 N -5.228 -11.652 -3.336 1.00 . A A . 12 GLN NE2 1 1 18 11057 1 1 12 GLN O O -9.134 -8.363 -0.667 1.00 . A A . 12 GLN O 1 1 18 11058 1 1 12 GLN OE1 O -6.894 -10.271 -3.934 1.00 . A A . 12 GLN OE1 1 1 18 11059 1 1 13 CYS C C -7.992 -6.243 2.855 1.00 . A A . 13 CYS C 1 1 18 11060 1 1 13 CYS CA C -8.628 -6.969 1.670 1.00 . A A . 13 CYS CA 1 1 18 11061 1 1 13 CYS CB C -9.618 -8.018 2.180 1.00 . A A . 13 CYS CB 1 1 18 11062 1 1 13 CYS H H -6.677 -7.530 1.058 1.00 . A A . 13 CYS H 1 1 18 11063 1 1 13 CYS HA H -9.165 -6.248 1.073 1.00 . A A . 13 CYS HA 1 1 18 11064 1 1 13 CYS HB2 H -10.080 -8.508 1.336 1.00 . A A . 13 CYS HB2 1 1 18 11065 1 1 13 CYS HB3 H -9.084 -8.751 2.767 1.00 . A A . 13 CYS HB3 1 1 18 11066 1 1 13 CYS N N -7.624 -7.593 0.814 1.00 . A A . 13 CYS N 1 1 18 11067 1 1 13 CYS O O -8.557 -5.280 3.372 1.00 . A A . 13 CYS O 1 1 18 11068 1 1 13 CYS SG S -10.951 -7.338 3.220 1.00 . A A . 13 CYS SG 1 1 18 11069 1 1 14 LYS C C -4.914 -5.312 3.941 1.00 . A A . 14 LYS C 1 1 18 11070 1 1 14 LYS CA C -6.136 -6.085 4.414 1.00 . A A . 14 LYS CA 1 1 18 11071 1 1 14 LYS CB C -5.720 -7.147 5.434 1.00 . A A . 14 LYS CB 1 1 18 11072 1 1 14 LYS CD C -4.350 -7.377 7.527 1.00 . A A . 14 LYS CD 1 1 18 11073 1 1 14 LYS CE C -2.983 -6.734 7.352 1.00 . A A . 14 LYS CE 1 1 18 11074 1 1 14 LYS CG C -5.434 -6.583 6.816 1.00 . A A . 14 LYS CG 1 1 18 11075 1 1 14 LYS H H -6.407 -7.475 2.847 1.00 . A A . 14 LYS H 1 1 18 11076 1 1 14 LYS HA H -6.823 -5.397 4.883 1.00 . A A . 14 LYS HA 1 1 18 11077 1 1 14 LYS HB2 H -6.514 -7.874 5.523 1.00 . A A . 14 LYS HB2 1 1 18 11078 1 1 14 LYS HB3 H -4.828 -7.641 5.078 1.00 . A A . 14 LYS HB3 1 1 18 11079 1 1 14 LYS HD2 H -4.582 -7.422 8.580 1.00 . A A . 14 LYS HD2 1 1 18 11080 1 1 14 LYS HD3 H -4.323 -8.377 7.119 1.00 . A A . 14 LYS HD3 1 1 18 11081 1 1 14 LYS HE2 H -2.246 -7.513 7.228 1.00 . A A . 14 LYS HE2 1 1 18 11082 1 1 14 LYS HE3 H -3.002 -6.113 6.468 1.00 . A A . 14 LYS HE3 1 1 18 11083 1 1 14 LYS HG2 H -5.109 -5.559 6.717 1.00 . A A . 14 LYS HG2 1 1 18 11084 1 1 14 LYS HG3 H -6.339 -6.620 7.404 1.00 . A A . 14 LYS HG3 1 1 18 11085 1 1 14 LYS HZ1 H -3.006 -6.304 9.396 1.00 . A A . 14 LYS HZ1 1 1 18 11086 1 1 14 LYS HZ2 H -1.574 -5.852 8.616 1.00 . A A . 14 LYS HZ2 1 1 18 11087 1 1 14 LYS HZ3 H -2.977 -4.931 8.408 1.00 . A A . 14 LYS HZ3 1 1 18 11088 1 1 14 LYS N N -6.820 -6.704 3.289 1.00 . A A . 14 LYS N 1 1 18 11089 1 1 14 LYS NZ N -2.609 -5.897 8.525 1.00 . A A . 14 LYS NZ 1 1 18 11090 1 1 14 LYS O O -3.986 -5.890 3.374 1.00 . A A . 14 LYS O 1 1 18 11091 1 1 15 LEU C C -2.470 -3.802 4.098 1.00 . A A . 15 LEU C 1 1 18 11092 1 1 15 LEU CA C -3.808 -3.147 3.770 1.00 . A A . 15 LEU CA 1 1 18 11093 1 1 15 LEU CB C -3.896 -1.760 4.430 1.00 . A A . 15 LEU CB 1 1 18 11094 1 1 15 LEU CD1 C -6.009 -1.664 5.805 1.00 . A A . 15 LEU CD1 1 1 18 11095 1 1 15 LEU CD2 C -3.998 -2.855 6.711 1.00 . A A . 15 LEU CD2 1 1 18 11096 1 1 15 LEU CG C -4.488 -1.698 5.850 1.00 . A A . 15 LEU CG 1 1 18 11097 1 1 15 LEU H H -5.690 -3.605 4.626 1.00 . A A . 15 LEU H 1 1 18 11098 1 1 15 LEU HA H -3.869 -3.023 2.699 1.00 . A A . 15 LEU HA 1 1 18 11099 1 1 15 LEU HB2 H -2.900 -1.346 4.469 1.00 . A A . 15 LEU HB2 1 1 18 11100 1 1 15 LEU HB3 H -4.498 -1.130 3.793 1.00 . A A . 15 LEU HB3 1 1 18 11101 1 1 15 LEU HD11 H -6.336 -1.526 4.785 1.00 . A A . 15 LEU HD11 1 1 18 11102 1 1 15 LEU HD12 H -6.402 -2.595 6.186 1.00 . A A . 15 LEU HD12 1 1 18 11103 1 1 15 LEU HD13 H -6.368 -0.846 6.411 1.00 . A A . 15 LEU HD13 1 1 18 11104 1 1 15 LEU HD21 H -4.166 -3.788 6.198 1.00 . A A . 15 LEU HD21 1 1 18 11105 1 1 15 LEU HD22 H -2.942 -2.737 6.905 1.00 . A A . 15 LEU HD22 1 1 18 11106 1 1 15 LEU HD23 H -4.537 -2.858 7.647 1.00 . A A . 15 LEU HD23 1 1 18 11107 1 1 15 LEU HG H -4.159 -0.781 6.317 1.00 . A A . 15 LEU HG 1 1 18 11108 1 1 15 LEU N N -4.920 -4.002 4.175 1.00 . A A . 15 LEU N 1 1 18 11109 1 1 15 LEU O O -2.138 -4.016 5.263 1.00 . A A . 15 LEU O 1 1 18 11110 1 1 16 LYS C C 0.384 -4.119 4.359 1.00 . A A . 16 LYS C 1 1 18 11111 1 1 16 LYS CA C -0.413 -4.778 3.229 1.00 . A A . 16 LYS CA 1 1 18 11112 1 1 16 LYS CB C 0.385 -4.725 1.923 1.00 . A A . 16 LYS CB 1 1 18 11113 1 1 16 LYS CD C 1.119 -5.931 -0.157 1.00 . A A . 16 LYS CD 1 1 18 11114 1 1 16 LYS CE C 0.081 -6.107 -1.254 1.00 . A A . 16 LYS CE 1 1 18 11115 1 1 16 LYS CG C 0.501 -6.070 1.226 1.00 . A A . 16 LYS CG 1 1 18 11116 1 1 16 LYS H H -2.035 -3.946 2.150 1.00 . A A . 16 LYS H 1 1 18 11117 1 1 16 LYS HA H -0.598 -5.812 3.487 1.00 . A A . 16 LYS HA 1 1 18 11118 1 1 16 LYS HB2 H -0.099 -4.036 1.248 1.00 . A A . 16 LYS HB2 1 1 18 11119 1 1 16 LYS HB3 H 1.382 -4.367 2.136 1.00 . A A . 16 LYS HB3 1 1 18 11120 1 1 16 LYS HD2 H 1.559 -4.949 -0.248 1.00 . A A . 16 LYS HD2 1 1 18 11121 1 1 16 LYS HD3 H 1.885 -6.683 -0.274 1.00 . A A . 16 LYS HD3 1 1 18 11122 1 1 16 LYS HE2 H 0.156 -7.111 -1.645 1.00 . A A . 16 LYS HE2 1 1 18 11123 1 1 16 LYS HE3 H -0.901 -5.960 -0.830 1.00 . A A . 16 LYS HE3 1 1 18 11124 1 1 16 LYS HG2 H 1.121 -6.721 1.822 1.00 . A A . 16 LYS HG2 1 1 18 11125 1 1 16 LYS HG3 H -0.486 -6.498 1.130 1.00 . A A . 16 LYS HG3 1 1 18 11126 1 1 16 LYS HZ1 H 0.643 -4.238 -1.997 1.00 . A A . 16 LYS HZ1 1 1 18 11127 1 1 16 LYS HZ2 H 0.961 -5.518 -3.055 1.00 . A A . 16 LYS HZ2 1 1 18 11128 1 1 16 LYS HZ3 H -0.624 -4.961 -2.852 1.00 . A A . 16 LYS HZ3 1 1 18 11129 1 1 16 LYS N N -1.711 -4.132 3.057 1.00 . A A . 16 LYS N 1 1 18 11130 1 1 16 LYS NZ N 0.279 -5.138 -2.367 1.00 . A A . 16 LYS NZ 1 1 18 11131 1 1 16 LYS O O 0.237 -2.924 4.616 1.00 . A A . 16 LYS O 1 1 18 11132 1 1 17 PRO C C 2.817 -3.116 5.785 1.00 . A A . 17 PRO C 1 1 18 11133 1 1 17 PRO CA C 2.052 -4.382 6.158 1.00 . A A . 17 PRO CA 1 1 18 11134 1 1 17 PRO CB C 3.032 -5.529 6.458 1.00 . A A . 17 PRO CB 1 1 18 11135 1 1 17 PRO CD C 1.475 -6.321 4.820 1.00 . A A . 17 PRO CD 1 1 18 11136 1 1 17 PRO CG C 2.871 -6.505 5.338 1.00 . A A . 17 PRO CG 1 1 18 11137 1 1 17 PRO HA H 1.448 -4.187 7.032 1.00 . A A . 17 PRO HA 1 1 18 11138 1 1 17 PRO HB2 H 4.039 -5.140 6.496 1.00 . A A . 17 PRO HB2 1 1 18 11139 1 1 17 PRO HB3 H 2.781 -5.977 7.408 1.00 . A A . 17 PRO HB3 1 1 18 11140 1 1 17 PRO HD2 H 1.427 -6.557 3.767 1.00 . A A . 17 PRO HD2 1 1 18 11141 1 1 17 PRO HD3 H 0.778 -6.926 5.380 1.00 . A A . 17 PRO HD3 1 1 18 11142 1 1 17 PRO HG2 H 3.590 -6.294 4.560 1.00 . A A . 17 PRO HG2 1 1 18 11143 1 1 17 PRO HG3 H 3.003 -7.512 5.707 1.00 . A A . 17 PRO HG3 1 1 18 11144 1 1 17 PRO N N 1.237 -4.892 5.052 1.00 . A A . 17 PRO N 1 1 18 11145 1 1 17 PRO O O 3.338 -2.997 4.676 1.00 . A A . 17 PRO O 1 1 18 11146 1 1 18 ALA C C 5.029 -1.171 6.058 1.00 . A A . 18 ALA C 1 1 18 11147 1 1 18 ALA CA C 3.590 -0.918 6.496 1.00 . A A . 18 ALA CA 1 1 18 11148 1 1 18 ALA CB C 3.562 -0.063 7.754 1.00 . A A . 18 ALA CB 1 1 18 11149 1 1 18 ALA H H 2.451 -2.328 7.587 1.00 . A A . 18 ALA H 1 1 18 11150 1 1 18 ALA HA H 3.075 -0.381 5.713 1.00 . A A . 18 ALA HA 1 1 18 11151 1 1 18 ALA HB1 H 4.418 -0.299 8.369 1.00 . A A . 18 ALA HB1 1 1 18 11152 1 1 18 ALA HB2 H 3.592 0.981 7.481 1.00 . A A . 18 ALA HB2 1 1 18 11153 1 1 18 ALA HB3 H 2.656 -0.265 8.306 1.00 . A A . 18 ALA HB3 1 1 18 11154 1 1 18 ALA N N 2.884 -2.174 6.722 1.00 . A A . 18 ALA N 1 1 18 11155 1 1 18 ALA O O 5.504 -2.307 6.084 1.00 . A A . 18 ALA O 1 1 18 11156 1 1 19 GLY C C 7.227 -1.194 4.031 1.00 . A A . 19 GLY C 1 1 18 11157 1 1 19 GLY CA C 7.090 -0.245 5.206 1.00 . A A . 19 GLY CA 1 1 18 11158 1 1 19 GLY H H 5.286 0.770 5.646 1.00 . A A . 19 GLY H 1 1 18 11159 1 1 19 GLY HA2 H 7.688 -0.616 6.026 1.00 . A A . 19 GLY HA2 1 1 18 11160 1 1 19 GLY HA3 H 7.460 0.727 4.916 1.00 . A A . 19 GLY HA3 1 1 18 11161 1 1 19 GLY N N 5.716 -0.110 5.650 1.00 . A A . 19 GLY N 1 1 18 11162 1 1 19 GLY O O 8.317 -1.692 3.750 1.00 . A A . 19 GLY O 1 1 18 11163 1 1 20 THR C C 5.644 -1.615 0.938 1.00 . A A . 20 THR C 1 1 18 11164 1 1 20 THR CA C 6.113 -2.344 2.194 1.00 . A A . 20 THR CA 1 1 18 11165 1 1 20 THR CB C 5.209 -3.547 2.468 1.00 . A A . 20 THR CB 1 1 18 11166 1 1 20 THR CG2 C 5.160 -4.539 1.325 1.00 . A A . 20 THR CG2 1 1 18 11167 1 1 20 THR H H 5.277 -1.022 3.615 1.00 . A A . 20 THR H 1 1 18 11168 1 1 20 THR HA H 7.124 -2.691 2.039 1.00 . A A . 20 THR HA 1 1 18 11169 1 1 20 THR HB H 4.202 -3.194 2.641 1.00 . A A . 20 THR HB 1 1 18 11170 1 1 20 THR HG1 H 6.586 -4.397 3.571 1.00 . A A . 20 THR HG1 1 1 18 11171 1 1 20 THR HG21 H 5.254 -4.013 0.387 1.00 . A A . 20 THR HG21 1 1 18 11172 1 1 20 THR HG22 H 5.972 -5.244 1.426 1.00 . A A . 20 THR HG22 1 1 18 11173 1 1 20 THR HG23 H 4.218 -5.068 1.349 1.00 . A A . 20 THR HG23 1 1 18 11174 1 1 20 THR N N 6.116 -1.447 3.343 1.00 . A A . 20 THR N 1 1 18 11175 1 1 20 THR O O 4.487 -1.204 0.844 1.00 . A A . 20 THR O 1 1 18 11176 1 1 20 THR OG1 O 5.639 -4.245 3.623 1.00 . A A . 20 THR OG1 1 1 18 11177 1 1 21 THR C C 4.916 -1.312 -1.862 1.00 . A A . 21 THR C 1 1 18 11178 1 1 21 THR CA C 6.227 -0.790 -1.283 1.00 . A A . 21 THR CA 1 1 18 11179 1 1 21 THR CB C 7.356 -0.994 -2.292 1.00 . A A . 21 THR CB 1 1 18 11180 1 1 21 THR CG2 C 7.857 -2.419 -2.336 1.00 . A A . 21 THR CG2 1 1 18 11181 1 1 21 THR H H 7.451 -1.818 0.108 1.00 . A A . 21 THR H 1 1 18 11182 1 1 21 THR HA H 6.123 0.265 -1.081 1.00 . A A . 21 THR HA 1 1 18 11183 1 1 21 THR HB H 8.187 -0.359 -2.022 1.00 . A A . 21 THR HB 1 1 18 11184 1 1 21 THR HG1 H 6.793 0.304 -3.646 1.00 . A A . 21 THR HG1 1 1 18 11185 1 1 21 THR HG21 H 7.336 -3.004 -1.592 1.00 . A A . 21 THR HG21 1 1 18 11186 1 1 21 THR HG22 H 7.673 -2.835 -3.316 1.00 . A A . 21 THR HG22 1 1 18 11187 1 1 21 THR HG23 H 8.916 -2.435 -2.130 1.00 . A A . 21 THR HG23 1 1 18 11188 1 1 21 THR N N 6.547 -1.464 -0.026 1.00 . A A . 21 THR N 1 1 18 11189 1 1 21 THR O O 4.845 -2.440 -2.347 1.00 . A A . 21 THR O 1 1 18 11190 1 1 21 THR OG1 O 6.933 -0.644 -3.598 1.00 . A A . 21 THR OG1 1 1 18 11191 1 1 22 CYS C C 2.379 -0.393 -3.748 1.00 . A A . 22 CYS C 1 1 18 11192 1 1 22 CYS CA C 2.569 -0.865 -2.309 1.00 . A A . 22 CYS CA 1 1 18 11193 1 1 22 CYS CB C 1.469 -0.285 -1.420 1.00 . A A . 22 CYS CB 1 1 18 11194 1 1 22 CYS H H 3.998 0.400 -1.395 1.00 . A A . 22 CYS H 1 1 18 11195 1 1 22 CYS HA H 2.505 -1.942 -2.286 1.00 . A A . 22 CYS HA 1 1 18 11196 1 1 22 CYS HB2 H 0.512 -0.652 -1.759 1.00 . A A . 22 CYS HB2 1 1 18 11197 1 1 22 CYS HB3 H 1.632 -0.607 -0.402 1.00 . A A . 22 CYS HB3 1 1 18 11198 1 1 22 CYS N N 3.880 -0.485 -1.799 1.00 . A A . 22 CYS N 1 1 18 11199 1 1 22 CYS O O 1.312 0.102 -4.112 1.00 . A A . 22 CYS O 1 1 18 11200 1 1 22 CYS SG S 1.392 1.535 -1.422 1.00 . A A . 22 CYS SG 1 1 18 11201 1 1 23 TRP C C 4.497 -0.732 -6.769 1.00 . A A . 23 TRP C 1 1 18 11202 1 1 23 TRP CA C 3.347 -0.143 -5.963 1.00 . A A . 23 TRP CA 1 1 18 11203 1 1 23 TRP CB C 3.349 1.388 -6.074 1.00 . A A . 23 TRP CB 1 1 18 11204 1 1 23 TRP CD1 C 0.928 1.317 -6.868 1.00 . A A . 23 TRP CD1 1 1 18 11205 1 1 23 TRP CD2 C 2.016 3.177 -7.459 1.00 . A A . 23 TRP CD2 1 1 18 11206 1 1 23 TRP CE2 C 0.700 3.251 -7.953 1.00 . A A . 23 TRP CE2 1 1 18 11207 1 1 23 TRP CE3 C 2.889 4.240 -7.709 1.00 . A A . 23 TRP CE3 1 1 18 11208 1 1 23 TRP CG C 2.138 1.927 -6.768 1.00 . A A . 23 TRP CG 1 1 18 11209 1 1 23 TRP CH2 C 1.113 5.370 -8.909 1.00 . A A . 23 TRP CH2 1 1 18 11210 1 1 23 TRP CZ2 C 0.237 4.344 -8.680 1.00 . A A . 23 TRP CZ2 1 1 18 11211 1 1 23 TRP CZ3 C 2.428 5.325 -8.431 1.00 . A A . 23 TRP CZ3 1 1 18 11212 1 1 23 TRP H H 4.240 -0.956 -4.223 1.00 . A A . 23 TRP H 1 1 18 11213 1 1 23 TRP HA H 2.423 -0.520 -6.366 1.00 . A A . 23 TRP HA 1 1 18 11214 1 1 23 TRP HB2 H 3.384 1.815 -5.083 1.00 . A A . 23 TRP HB2 1 1 18 11215 1 1 23 TRP HB3 H 4.220 1.704 -6.628 1.00 . A A . 23 TRP HB3 1 1 18 11216 1 1 23 TRP HD1 H 0.707 0.351 -6.443 1.00 . A A . 23 TRP HD1 1 1 18 11217 1 1 23 TRP HE1 H -0.876 1.877 -7.785 1.00 . A A . 23 TRP HE1 1 1 18 11218 1 1 23 TRP HE3 H 3.906 4.223 -7.349 1.00 . A A . 23 TRP HE3 1 1 18 11219 1 1 23 TRP HH2 H 0.796 6.237 -9.470 1.00 . A A . 23 TRP HH2 1 1 18 11220 1 1 23 TRP HZ2 H -0.774 4.393 -9.056 1.00 . A A . 23 TRP HZ2 1 1 18 11221 1 1 23 TRP HZ3 H 3.089 6.155 -8.634 1.00 . A A . 23 TRP HZ3 1 1 18 11222 1 1 23 TRP N N 3.415 -0.552 -4.565 1.00 . A A . 23 TRP N 1 1 18 11223 1 1 23 TRP NE1 N 0.055 2.102 -7.579 1.00 . A A . 23 TRP NE1 1 1 18 11224 1 1 23 TRP O O 4.326 -1.713 -7.492 1.00 . A A . 23 TRP O 1 1 18 11225 1 1 24 LYS C C 6.574 -0.656 -8.861 1.00 . A A . 24 LYS C 1 1 18 11226 1 1 24 LYS CA C 6.851 -0.573 -7.362 1.00 . A A . 24 LYS CA 1 1 18 11227 1 1 24 LYS CB C 7.300 -1.935 -6.834 1.00 . A A . 24 LYS CB 1 1 18 11228 1 1 24 LYS CD C 9.755 -2.076 -6.311 1.00 . A A . 24 LYS CD 1 1 18 11229 1 1 24 LYS CE C 11.082 -1.757 -6.979 1.00 . A A . 24 LYS CE 1 1 18 11230 1 1 24 LYS CG C 8.670 -2.362 -7.337 1.00 . A A . 24 LYS CG 1 1 18 11231 1 1 24 LYS H H 5.729 0.654 -6.054 1.00 . A A . 24 LYS H 1 1 18 11232 1 1 24 LYS HA H 7.637 0.147 -7.192 1.00 . A A . 24 LYS HA 1 1 18 11233 1 1 24 LYS HB2 H 7.332 -1.895 -5.755 1.00 . A A . 24 LYS HB2 1 1 18 11234 1 1 24 LYS HB3 H 6.580 -2.681 -7.136 1.00 . A A . 24 LYS HB3 1 1 18 11235 1 1 24 LYS HD2 H 9.454 -1.232 -5.709 1.00 . A A . 24 LYS HD2 1 1 18 11236 1 1 24 LYS HD3 H 9.878 -2.945 -5.680 1.00 . A A . 24 LYS HD3 1 1 18 11237 1 1 24 LYS HE2 H 10.906 -1.068 -7.791 1.00 . A A . 24 LYS HE2 1 1 18 11238 1 1 24 LYS HE3 H 11.734 -1.295 -6.252 1.00 . A A . 24 LYS HE3 1 1 18 11239 1 1 24 LYS HG2 H 8.653 -3.422 -7.541 1.00 . A A . 24 LYS HG2 1 1 18 11240 1 1 24 LYS HG3 H 8.894 -1.822 -8.245 1.00 . A A . 24 LYS HG3 1 1 18 11241 1 1 24 LYS HZ1 H 11.033 -3.616 -7.930 1.00 . A A . 24 LYS HZ1 1 1 18 11242 1 1 24 LYS HZ2 H 12.431 -2.719 -8.251 1.00 . A A . 24 LYS HZ2 1 1 18 11243 1 1 24 LYS HZ3 H 12.239 -3.481 -6.752 1.00 . A A . 24 LYS HZ3 1 1 18 11244 1 1 24 LYS N N 5.665 -0.121 -6.643 1.00 . A A . 24 LYS N 1 1 18 11245 1 1 24 LYS NZ N 11.742 -2.979 -7.516 1.00 . A A . 24 LYS NZ 1 1 18 11246 1 1 24 LYS O O 7.097 -1.528 -9.554 1.00 . A A . 24 LYS O 1 1 18 11247 1 1 25 THR C C 6.563 0.755 -11.619 1.00 . A A . 25 THR C 1 1 18 11248 1 1 25 THR CA C 5.384 0.298 -10.762 1.00 . A A . 25 THR CA 1 1 18 11249 1 1 25 THR CB C 4.190 1.232 -10.973 1.00 . A A . 25 THR CB 1 1 18 11250 1 1 25 THR CG2 C 3.322 0.843 -12.150 1.00 . A A . 25 THR CG2 1 1 18 11251 1 1 25 THR H H 5.358 0.925 -8.742 1.00 . A A . 25 THR H 1 1 18 11252 1 1 25 THR HA H 5.103 -0.701 -11.060 1.00 . A A . 25 THR HA 1 1 18 11253 1 1 25 THR HB H 4.556 2.234 -11.149 1.00 . A A . 25 THR HB 1 1 18 11254 1 1 25 THR HG1 H 3.197 0.359 -9.528 1.00 . A A . 25 THR HG1 1 1 18 11255 1 1 25 THR HG21 H 3.195 -0.230 -12.164 1.00 . A A . 25 THR HG21 1 1 18 11256 1 1 25 THR HG22 H 2.356 1.318 -12.057 1.00 . A A . 25 THR HG22 1 1 18 11257 1 1 25 THR HG23 H 3.794 1.162 -13.067 1.00 . A A . 25 THR HG23 1 1 18 11258 1 1 25 THR N N 5.743 0.260 -9.349 1.00 . A A . 25 THR N 1 1 18 11259 1 1 25 THR O O 6.518 1.818 -12.239 1.00 . A A . 25 THR O 1 1 18 11260 1 1 25 THR OG1 O 3.365 1.257 -9.822 1.00 . A A . 25 THR OG1 1 1 18 11261 1 1 26 SER C C 9.686 1.273 -11.698 1.00 . A A . 26 SER C 1 1 18 11262 1 1 26 SER CA C 8.820 0.251 -12.421 1.00 . A A . 26 SER CA 1 1 18 11263 1 1 26 SER CB C 8.452 0.768 -13.816 1.00 . A A . 26 SER CB 1 1 18 11264 1 1 26 SER H H 7.594 -0.884 -11.128 1.00 . A A . 26 SER H 1 1 18 11265 1 1 26 SER HA H 9.383 -0.661 -12.526 1.00 . A A . 26 SER HA 1 1 18 11266 1 1 26 SER HB2 H 8.220 1.821 -13.757 1.00 . A A . 26 SER HB2 1 1 18 11267 1 1 26 SER HB3 H 9.288 0.621 -14.484 1.00 . A A . 26 SER HB3 1 1 18 11268 1 1 26 SER HG H 7.599 -0.779 -14.662 1.00 . A A . 26 SER HG 1 1 18 11269 1 1 26 SER N N 7.620 -0.057 -11.646 1.00 . A A . 26 SER N 1 1 18 11270 1 1 26 SER O O 10.865 1.032 -11.437 1.00 . A A . 26 SER O 1 1 18 11271 1 1 26 SER OG O 7.326 0.081 -14.334 1.00 . A A . 26 SER OG 1 1 18 11272 1 1 27 VAL C C 8.976 4.028 -9.533 1.00 . A A . 27 VAL C 1 1 18 11273 1 1 27 VAL CA C 9.801 3.477 -10.688 1.00 . A A . 27 VAL CA 1 1 18 11274 1 1 27 VAL CB C 10.157 4.623 -11.654 1.00 . A A . 27 VAL CB 1 1 18 11275 1 1 27 VAL CG1 C 8.911 5.400 -12.062 1.00 . A A . 27 VAL CG1 1 1 18 11276 1 1 27 VAL CG2 C 11.190 5.548 -11.029 1.00 . A A . 27 VAL CG2 1 1 18 11277 1 1 27 VAL H H 8.153 2.540 -11.619 1.00 . A A . 27 VAL H 1 1 18 11278 1 1 27 VAL HA H 10.718 3.067 -10.297 1.00 . A A . 27 VAL HA 1 1 18 11279 1 1 27 VAL HB H 10.585 4.186 -12.543 1.00 . A A . 27 VAL HB 1 1 18 11280 1 1 27 VAL HG11 H 8.168 4.716 -12.442 1.00 . A A . 27 VAL HG11 1 1 18 11281 1 1 27 VAL HG12 H 8.514 5.922 -11.203 1.00 . A A . 27 VAL HG12 1 1 18 11282 1 1 27 VAL HG13 H 9.169 6.115 -12.830 1.00 . A A . 27 VAL HG13 1 1 18 11283 1 1 27 VAL HG21 H 12.001 4.960 -10.625 1.00 . A A . 27 VAL HG21 1 1 18 11284 1 1 27 VAL HG22 H 11.573 6.221 -11.781 1.00 . A A . 27 VAL HG22 1 1 18 11285 1 1 27 VAL HG23 H 10.729 6.118 -10.236 1.00 . A A . 27 VAL HG23 1 1 18 11286 1 1 27 VAL N N 9.092 2.412 -11.380 1.00 . A A . 27 VAL N 1 1 18 11287 1 1 27 VAL O O 9.489 4.255 -8.437 1.00 . A A . 27 VAL O 1 1 18 11288 1 1 28 SER C C 6.549 3.745 -7.679 1.00 . A A . 28 SER C 1 1 18 11289 1 1 28 SER CA C 6.788 4.767 -8.783 1.00 . A A . 28 SER CA 1 1 18 11290 1 1 28 SER CB C 5.457 5.166 -9.423 1.00 . A A . 28 SER CB 1 1 18 11291 1 1 28 SER H H 7.349 4.041 -10.685 1.00 . A A . 28 SER H 1 1 18 11292 1 1 28 SER HA H 7.246 5.645 -8.352 1.00 . A A . 28 SER HA 1 1 18 11293 1 1 28 SER HB2 H 4.767 4.339 -9.357 1.00 . A A . 28 SER HB2 1 1 18 11294 1 1 28 SER HB3 H 5.050 6.018 -8.900 1.00 . A A . 28 SER HB3 1 1 18 11295 1 1 28 SER HG H 5.595 6.460 -10.887 1.00 . A A . 28 SER HG 1 1 18 11296 1 1 28 SER N N 7.693 4.241 -9.791 1.00 . A A . 28 SER N 1 1 18 11297 1 1 28 SER O O 5.629 2.933 -7.760 1.00 . A A . 28 SER O 1 1 18 11298 1 1 28 SER OG O 5.630 5.506 -10.788 1.00 . A A . 28 SER OG 1 1 18 11299 1 1 29 SER C C 6.996 3.666 -4.238 1.00 . A A . 29 SER C 1 1 18 11300 1 1 29 SER CA C 7.256 2.883 -5.516 1.00 . A A . 29 SER CA 1 1 18 11301 1 1 29 SER CB C 8.521 2.035 -5.369 1.00 . A A . 29 SER CB 1 1 18 11302 1 1 29 SER H H 8.091 4.471 -6.637 1.00 . A A . 29 SER H 1 1 18 11303 1 1 29 SER HA H 6.412 2.235 -5.704 1.00 . A A . 29 SER HA 1 1 18 11304 1 1 29 SER HB2 H 8.323 1.211 -4.699 1.00 . A A . 29 SER HB2 1 1 18 11305 1 1 29 SER HB3 H 8.809 1.651 -6.336 1.00 . A A . 29 SER HB3 1 1 18 11306 1 1 29 SER HG H 9.781 3.533 -5.434 1.00 . A A . 29 SER HG 1 1 18 11307 1 1 29 SER N N 7.380 3.797 -6.645 1.00 . A A . 29 SER N 1 1 18 11308 1 1 29 SER O O 7.676 4.651 -3.955 1.00 . A A . 29 SER O 1 1 18 11309 1 1 29 SER OG O 9.591 2.801 -4.844 1.00 . A A . 29 SER OG 1 1 18 11310 1 1 30 HIS C C 5.375 2.935 -1.116 1.00 . A A . 30 HIS C 1 1 18 11311 1 1 30 HIS CA C 5.636 3.926 -2.246 1.00 . A A . 30 HIS CA 1 1 18 11312 1 1 30 HIS CB C 4.401 4.802 -2.482 1.00 . A A . 30 HIS CB 1 1 18 11313 1 1 30 HIS CD2 C 4.486 4.992 -5.070 1.00 . A A . 30 HIS CD2 1 1 18 11314 1 1 30 HIS CE1 C 4.400 7.174 -5.241 1.00 . A A . 30 HIS CE1 1 1 18 11315 1 1 30 HIS CG C 4.411 5.494 -3.814 1.00 . A A . 30 HIS CG 1 1 18 11316 1 1 30 HIS H H 5.476 2.458 -3.763 1.00 . A A . 30 HIS H 1 1 18 11317 1 1 30 HIS HA H 6.464 4.559 -1.967 1.00 . A A . 30 HIS HA 1 1 18 11318 1 1 30 HIS HB2 H 3.516 4.185 -2.434 1.00 . A A . 30 HIS HB2 1 1 18 11319 1 1 30 HIS HB3 H 4.351 5.558 -1.713 1.00 . A A . 30 HIS HB3 1 1 18 11320 1 1 30 HIS HD1 H 4.292 7.512 -3.225 1.00 . A A . 30 HIS HD1 1 1 18 11321 1 1 30 HIS HD2 H 4.551 3.948 -5.339 1.00 . A A . 30 HIS HD2 1 1 18 11322 1 1 30 HIS HE1 H 4.386 8.171 -5.654 1.00 . A A . 30 HIS HE1 1 1 18 11323 1 1 30 HIS HE2 H 4.639 6.003 -6.902 1.00 . A A . 30 HIS HE2 1 1 18 11324 1 1 30 HIS N N 5.995 3.240 -3.480 1.00 . A A . 30 HIS N 1 1 18 11325 1 1 30 HIS ND1 N 4.357 6.864 -3.956 1.00 . A A . 30 HIS ND1 1 1 18 11326 1 1 30 HIS NE2 N 4.478 6.056 -5.936 1.00 . A A . 30 HIS NE2 1 1 18 11327 1 1 30 HIS O O 4.399 2.186 -1.144 1.00 . A A . 30 HIS O 1 1 18 11328 1 1 31 TYR C C 4.816 2.291 1.756 1.00 . A A . 31 TYR C 1 1 18 11329 1 1 31 TYR CA C 6.130 2.050 1.024 1.00 . A A . 31 TYR CA 1 1 18 11330 1 1 31 TYR CB C 7.306 2.248 1.982 1.00 . A A . 31 TYR CB 1 1 18 11331 1 1 31 TYR CD1 C 8.796 0.938 0.417 1.00 . A A . 31 TYR CD1 1 1 18 11332 1 1 31 TYR CD2 C 9.252 0.837 2.754 1.00 . A A . 31 TYR CD2 1 1 18 11333 1 1 31 TYR CE1 C 9.860 0.094 0.168 1.00 . A A . 31 TYR CE1 1 1 18 11334 1 1 31 TYR CE2 C 10.319 -0.007 2.514 1.00 . A A . 31 TYR CE2 1 1 18 11335 1 1 31 TYR CG C 8.473 1.324 1.712 1.00 . A A . 31 TYR CG 1 1 18 11336 1 1 31 TYR CZ C 10.619 -0.376 1.219 1.00 . A A . 31 TYR CZ 1 1 18 11337 1 1 31 TYR H H 7.013 3.565 -0.159 1.00 . A A . 31 TYR H 1 1 18 11338 1 1 31 TYR HA H 6.143 1.035 0.659 1.00 . A A . 31 TYR HA 1 1 18 11339 1 1 31 TYR HB2 H 7.663 3.264 1.898 1.00 . A A . 31 TYR HB2 1 1 18 11340 1 1 31 TYR HB3 H 6.971 2.073 2.994 1.00 . A A . 31 TYR HB3 1 1 18 11341 1 1 31 TYR HD1 H 8.200 1.308 -0.405 1.00 . A A . 31 TYR HD1 1 1 18 11342 1 1 31 TYR HD2 H 9.015 1.128 3.767 1.00 . A A . 31 TYR HD2 1 1 18 11343 1 1 31 TYR HE1 H 10.094 -0.194 -0.846 1.00 . A A . 31 TYR HE1 1 1 18 11344 1 1 31 TYR HE2 H 10.912 -0.375 3.338 1.00 . A A . 31 TYR HE2 1 1 18 11345 1 1 31 TYR HH H 11.379 -1.974 0.467 1.00 . A A . 31 TYR HH 1 1 18 11346 1 1 31 TYR N N 6.257 2.942 -0.122 1.00 . A A . 31 TYR N 1 1 18 11347 1 1 31 TYR O O 4.551 3.397 2.227 1.00 . A A . 31 TYR O 1 1 18 11348 1 1 31 TYR OH O 11.680 -1.217 0.976 1.00 . A A . 31 TYR OH 1 1 18 11349 1 1 32 CYS C C 2.906 1.684 4.006 1.00 . A A . 32 CYS C 1 1 18 11350 1 1 32 CYS CA C 2.711 1.358 2.529 1.00 . A A . 32 CYS CA 1 1 18 11351 1 1 32 CYS CB C 1.918 0.059 2.381 1.00 . A A . 32 CYS CB 1 1 18 11352 1 1 32 CYS H H 4.261 0.391 1.457 1.00 . A A . 32 CYS H 1 1 18 11353 1 1 32 CYS HA H 2.158 2.162 2.066 1.00 . A A . 32 CYS HA 1 1 18 11354 1 1 32 CYS HB2 H 2.264 -0.467 1.504 1.00 . A A . 32 CYS HB2 1 1 18 11355 1 1 32 CYS HB3 H 2.085 -0.557 3.253 1.00 . A A . 32 CYS HB3 1 1 18 11356 1 1 32 CYS N N 3.996 1.250 1.851 1.00 . A A . 32 CYS N 1 1 18 11357 1 1 32 CYS O O 3.976 1.448 4.566 1.00 . A A . 32 CYS O 1 1 18 11358 1 1 32 CYS SG S 0.121 0.303 2.208 1.00 . A A . 32 CYS SG 1 1 18 11359 1 1 33 THR C C 1.153 1.579 6.894 1.00 . A A . 33 THR C 1 1 18 11360 1 1 33 THR CA C 1.928 2.581 6.043 1.00 . A A . 33 THR CA 1 1 18 11361 1 1 33 THR CB C 1.372 3.989 6.260 1.00 . A A . 33 THR CB 1 1 18 11362 1 1 33 THR CG2 C 1.889 4.998 5.258 1.00 . A A . 33 THR CG2 1 1 18 11363 1 1 33 THR H H 1.040 2.388 4.131 1.00 . A A . 33 THR H 1 1 18 11364 1 1 33 THR HA H 2.965 2.563 6.344 1.00 . A A . 33 THR HA 1 1 18 11365 1 1 33 THR HB H 1.653 4.328 7.247 1.00 . A A . 33 THR HB 1 1 18 11366 1 1 33 THR HG1 H -0.313 3.620 5.332 1.00 . A A . 33 THR HG1 1 1 18 11367 1 1 33 THR HG21 H 2.966 4.932 5.203 1.00 . A A . 33 THR HG21 1 1 18 11368 1 1 33 THR HG22 H 1.466 4.791 4.286 1.00 . A A . 33 THR HG22 1 1 18 11369 1 1 33 THR HG23 H 1.606 5.993 5.570 1.00 . A A . 33 THR HG23 1 1 18 11370 1 1 33 THR N N 1.867 2.225 4.630 1.00 . A A . 33 THR N 1 1 18 11371 1 1 33 THR O O 0.833 1.852 8.051 1.00 . A A . 33 THR O 1 1 18 11372 1 1 33 THR OG1 O -0.042 3.987 6.177 1.00 . A A . 33 THR OG1 1 1 18 11373 1 1 34 GLY C C -1.112 -0.061 7.747 1.00 . A A . 34 GLY C 1 1 18 11374 1 1 34 GLY CA C 0.116 -0.607 7.041 1.00 . A A . 34 GLY CA 1 1 18 11375 1 1 34 GLY H H 1.133 0.251 5.391 1.00 . A A . 34 GLY H 1 1 18 11376 1 1 34 GLY HA2 H 0.771 -1.052 7.775 1.00 . A A . 34 GLY HA2 1 1 18 11377 1 1 34 GLY HA3 H -0.195 -1.371 6.343 1.00 . A A . 34 GLY HA3 1 1 18 11378 1 1 34 GLY N N 0.852 0.416 6.316 1.00 . A A . 34 GLY N 1 1 18 11379 1 1 34 GLY O O -1.548 -0.609 8.759 1.00 . A A . 34 GLY O 1 1 18 11380 1 1 35 ARG C C -4.013 1.646 6.813 1.00 . A A . 35 ARG C 1 1 18 11381 1 1 35 ARG CA C -2.852 1.642 7.801 1.00 . A A . 35 ARG CA 1 1 18 11382 1 1 35 ARG CB C -2.538 3.073 8.243 1.00 . A A . 35 ARG CB 1 1 18 11383 1 1 35 ARG CD C -2.863 4.590 10.219 1.00 . A A . 35 ARG CD 1 1 18 11384 1 1 35 ARG CG C -3.532 3.631 9.248 1.00 . A A . 35 ARG CG 1 1 18 11385 1 1 35 ARG CZ C -3.352 3.434 12.339 1.00 . A A . 35 ARG CZ 1 1 18 11386 1 1 35 ARG H H -1.275 1.414 6.406 1.00 . A A . 35 ARG H 1 1 18 11387 1 1 35 ARG HA H -3.135 1.062 8.665 1.00 . A A . 35 ARG HA 1 1 18 11388 1 1 35 ARG HB2 H -1.556 3.091 8.692 1.00 . A A . 35 ARG HB2 1 1 18 11389 1 1 35 ARG HB3 H -2.539 3.714 7.374 1.00 . A A . 35 ARG HB3 1 1 18 11390 1 1 35 ARG HD2 H -1.978 4.997 9.752 1.00 . A A . 35 ARG HD2 1 1 18 11391 1 1 35 ARG HD3 H -3.551 5.392 10.444 1.00 . A A . 35 ARG HD3 1 1 18 11392 1 1 35 ARG HE H -1.522 3.853 11.660 1.00 . A A . 35 ARG HE 1 1 18 11393 1 1 35 ARG HG2 H -4.310 4.158 8.716 1.00 . A A . 35 ARG HG2 1 1 18 11394 1 1 35 ARG HG3 H -3.964 2.812 9.805 1.00 . A A . 35 ARG HG3 1 1 18 11395 1 1 35 ARG HH11 H -4.989 3.960 11.275 1.00 . A A . 35 ARG HH11 1 1 18 11396 1 1 35 ARG HH12 H -5.306 3.145 12.770 1.00 . A A . 35 ARG HH12 1 1 18 11397 1 1 35 ARG HH21 H -1.937 2.780 13.626 1.00 . A A . 35 ARG HH21 1 1 18 11398 1 1 35 ARG HH22 H -3.573 2.476 14.105 1.00 . A A . 35 ARG HH22 1 1 18 11399 1 1 35 ARG N N -1.669 1.022 7.213 1.00 . A A . 35 ARG N 1 1 18 11400 1 1 35 ARG NE N -2.480 3.930 11.465 1.00 . A A . 35 ARG NE 1 1 18 11401 1 1 35 ARG NH1 N -4.656 3.520 12.109 1.00 . A A . 35 ARG NH1 1 1 18 11402 1 1 35 ARG NH2 N -2.918 2.849 13.448 1.00 . A A . 35 ARG NH2 1 1 18 11403 1 1 35 ARG O O -5.160 1.395 7.185 1.00 . A A . 35 ARG O 1 1 18 11404 1 1 36 SER C C -4.233 1.244 3.257 1.00 . A A . 36 SER C 1 1 18 11405 1 1 36 SER CA C -4.721 1.968 4.507 1.00 . A A . 36 SER CA 1 1 18 11406 1 1 36 SER CB C -5.082 3.415 4.166 1.00 . A A . 36 SER CB 1 1 18 11407 1 1 36 SER H H -2.774 2.121 5.323 1.00 . A A . 36 SER H 1 1 18 11408 1 1 36 SER HA H -5.601 1.465 4.880 1.00 . A A . 36 SER HA 1 1 18 11409 1 1 36 SER HB2 H -4.195 4.028 4.223 1.00 . A A . 36 SER HB2 1 1 18 11410 1 1 36 SER HB3 H -5.485 3.457 3.165 1.00 . A A . 36 SER HB3 1 1 18 11411 1 1 36 SER HG H -5.622 4.525 5.687 1.00 . A A . 36 SER HG 1 1 18 11412 1 1 36 SER N N -3.707 1.932 5.554 1.00 . A A . 36 SER N 1 1 18 11413 1 1 36 SER O O -3.031 1.157 3.009 1.00 . A A . 36 SER O 1 1 18 11414 1 1 36 SER OG O -6.047 3.927 5.069 1.00 . A A . 36 SER OG 1 1 18 11415 1 1 37 CYS C C -4.417 0.989 0.143 1.00 . A A . 37 CYS C 1 1 18 11416 1 1 37 CYS CA C -4.830 0.015 1.245 1.00 . A A . 37 CYS CA 1 1 18 11417 1 1 37 CYS CB C -6.008 -0.846 0.781 1.00 . A A . 37 CYS CB 1 1 18 11418 1 1 37 CYS H H -6.114 0.832 2.716 1.00 . A A . 37 CYS H 1 1 18 11419 1 1 37 CYS HA H -3.993 -0.630 1.465 1.00 . A A . 37 CYS HA 1 1 18 11420 1 1 37 CYS HB2 H -6.915 -0.261 0.831 1.00 . A A . 37 CYS HB2 1 1 18 11421 1 1 37 CYS HB3 H -5.840 -1.154 -0.240 1.00 . A A . 37 CYS HB3 1 1 18 11422 1 1 37 CYS N N -5.172 0.728 2.470 1.00 . A A . 37 CYS N 1 1 18 11423 1 1 37 CYS O O -3.938 0.577 -0.914 1.00 . A A . 37 CYS O 1 1 18 11424 1 1 37 CYS SG S -6.260 -2.348 1.784 1.00 . A A . 37 CYS SG 1 1 18 11425 1 1 38 GLU C C -2.716 3.511 -0.577 1.00 . A A . 38 GLU C 1 1 18 11426 1 1 38 GLU CA C -4.227 3.311 -0.566 1.00 . A A . 38 GLU CA 1 1 18 11427 1 1 38 GLU CB C -4.930 4.629 -0.235 1.00 . A A . 38 GLU CB 1 1 18 11428 1 1 38 GLU CD C -6.345 4.520 -2.325 1.00 . A A . 38 GLU CD 1 1 18 11429 1 1 38 GLU CG C -5.437 5.373 -1.460 1.00 . A A . 38 GLU CG 1 1 18 11430 1 1 38 GLU H H -4.975 2.553 1.262 1.00 . A A . 38 GLU H 1 1 18 11431 1 1 38 GLU HA H -4.542 2.978 -1.544 1.00 . A A . 38 GLU HA 1 1 18 11432 1 1 38 GLU HB2 H -5.773 4.423 0.408 1.00 . A A . 38 GLU HB2 1 1 18 11433 1 1 38 GLU HB3 H -4.238 5.272 0.288 1.00 . A A . 38 GLU HB3 1 1 18 11434 1 1 38 GLU HG2 H -5.988 6.242 -1.135 1.00 . A A . 38 GLU HG2 1 1 18 11435 1 1 38 GLU HG3 H -4.590 5.685 -2.052 1.00 . A A . 38 GLU HG3 1 1 18 11436 1 1 38 GLU N N -4.595 2.283 0.400 1.00 . A A . 38 GLU N 1 1 18 11437 1 1 38 GLU O O -2.002 2.950 0.255 1.00 . A A . 38 GLU O 1 1 18 11438 1 1 38 GLU OE1 O -5.943 4.187 -3.459 1.00 . A A . 38 GLU OE1 1 1 18 11439 1 1 38 GLU OE2 O -7.458 4.186 -1.867 1.00 . A A . 38 GLU OE2 1 1 18 11440 1 1 39 CYS C C -0.520 6.052 -1.865 1.00 . A A . 39 CYS C 1 1 18 11441 1 1 39 CYS CA C -0.799 4.568 -1.630 1.00 . A A . 39 CYS CA 1 1 18 11442 1 1 39 CYS CB C -0.197 3.742 -2.766 1.00 . A A . 39 CYS CB 1 1 18 11443 1 1 39 CYS H H -2.845 4.725 -2.160 1.00 . A A . 39 CYS H 1 1 18 11444 1 1 39 CYS HA H -0.341 4.267 -0.701 1.00 . A A . 39 CYS HA 1 1 18 11445 1 1 39 CYS HB2 H -0.727 3.961 -3.681 1.00 . A A . 39 CYS HB2 1 1 18 11446 1 1 39 CYS HB3 H 0.842 4.009 -2.885 1.00 . A A . 39 CYS HB3 1 1 18 11447 1 1 39 CYS N N -2.230 4.308 -1.522 1.00 . A A . 39 CYS N 1 1 18 11448 1 1 39 CYS O O -1.094 6.662 -2.767 1.00 . A A . 39 CYS O 1 1 18 11449 1 1 39 CYS SG S -0.281 1.943 -2.495 1.00 . A A . 39 CYS SG 1 1 18 11450 1 1 40 PRO C C 1.246 8.400 -2.589 1.00 . A A . 40 PRO C 1 1 18 11451 1 1 40 PRO CA C 0.726 8.073 -1.195 1.00 . A A . 40 PRO CA 1 1 18 11452 1 1 40 PRO CB C 1.830 8.277 -0.152 1.00 . A A . 40 PRO CB 1 1 18 11453 1 1 40 PRO CD C 1.113 6.008 0.042 1.00 . A A . 40 PRO CD 1 1 18 11454 1 1 40 PRO CG C 1.644 7.171 0.829 1.00 . A A . 40 PRO CG 1 1 18 11455 1 1 40 PRO HA H -0.113 8.714 -0.966 1.00 . A A . 40 PRO HA 1 1 18 11456 1 1 40 PRO HB2 H 2.796 8.221 -0.632 1.00 . A A . 40 PRO HB2 1 1 18 11457 1 1 40 PRO HB3 H 1.712 9.242 0.317 1.00 . A A . 40 PRO HB3 1 1 18 11458 1 1 40 PRO HD2 H 1.925 5.407 -0.340 1.00 . A A . 40 PRO HD2 1 1 18 11459 1 1 40 PRO HD3 H 0.452 5.411 0.652 1.00 . A A . 40 PRO HD3 1 1 18 11460 1 1 40 PRO HG2 H 2.592 6.916 1.280 1.00 . A A . 40 PRO HG2 1 1 18 11461 1 1 40 PRO HG3 H 0.934 7.466 1.586 1.00 . A A . 40 PRO HG3 1 1 18 11462 1 1 40 PRO N N 0.374 6.656 -1.058 1.00 . A A . 40 PRO N 1 1 18 11463 1 1 40 PRO O O 1.366 7.518 -3.440 1.00 . A A . 40 PRO O 1 1 18 11464 1 1 41 SER C C 3.567 10.364 -4.061 1.00 . A A . 41 SER C 1 1 18 11465 1 1 41 SER CA C 2.062 10.110 -4.114 1.00 . A A . 41 SER CA 1 1 18 11466 1 1 41 SER CB C 1.333 11.376 -4.567 1.00 . A A . 41 SER CB 1 1 18 11467 1 1 41 SER H H 1.437 10.329 -2.102 1.00 . A A . 41 SER H 1 1 18 11468 1 1 41 SER HA H 1.871 9.320 -4.827 1.00 . A A . 41 SER HA 1 1 18 11469 1 1 41 SER HB2 H 1.370 11.445 -5.644 1.00 . A A . 41 SER HB2 1 1 18 11470 1 1 41 SER HB3 H 0.303 11.329 -4.245 1.00 . A A . 41 SER HB3 1 1 18 11471 1 1 41 SER HG H 1.581 12.691 -3.136 1.00 . A A . 41 SER HG 1 1 18 11472 1 1 41 SER N N 1.554 9.671 -2.819 1.00 . A A . 41 SER N 1 1 18 11473 1 1 41 SER O O 4.119 11.053 -4.919 1.00 . A A . 41 SER O 1 1 18 11474 1 1 41 SER OG O 1.931 12.537 -4.016 1.00 . A A . 41 SER OG 1 1 18 11475 1 1 42 TYR C C 6.296 8.674 -2.364 1.00 . A A . 42 TYR C 1 1 18 11476 1 1 42 TYR CA C 5.667 9.960 -2.898 1.00 . A A . 42 TYR CA 1 1 18 11477 1 1 42 TYR CB C 5.974 11.130 -1.959 1.00 . A A . 42 TYR CB 1 1 18 11478 1 1 42 TYR CD1 C 4.349 11.122 -0.026 1.00 . A A . 42 TYR CD1 1 1 18 11479 1 1 42 TYR CD2 C 6.565 10.332 0.361 1.00 . A A . 42 TYR CD2 1 1 18 11480 1 1 42 TYR CE1 C 4.025 10.872 1.294 1.00 . A A . 42 TYR CE1 1 1 18 11481 1 1 42 TYR CE2 C 6.249 10.079 1.681 1.00 . A A . 42 TYR CE2 1 1 18 11482 1 1 42 TYR CG C 5.623 10.857 -0.514 1.00 . A A . 42 TYR CG 1 1 18 11483 1 1 42 TYR CZ C 4.979 10.351 2.143 1.00 . A A . 42 TYR CZ 1 1 18 11484 1 1 42 TYR H H 3.736 9.256 -2.405 1.00 . A A . 42 TYR H 1 1 18 11485 1 1 42 TYR HA H 6.083 10.173 -3.872 1.00 . A A . 42 TYR HA 1 1 18 11486 1 1 42 TYR HB2 H 7.029 11.353 -2.006 1.00 . A A . 42 TYR HB2 1 1 18 11487 1 1 42 TYR HB3 H 5.414 11.996 -2.280 1.00 . A A . 42 TYR HB3 1 1 18 11488 1 1 42 TYR HD1 H 3.606 11.530 -0.694 1.00 . A A . 42 TYR HD1 1 1 18 11489 1 1 42 TYR HD2 H 7.560 10.122 -0.004 1.00 . A A . 42 TYR HD2 1 1 18 11490 1 1 42 TYR HE1 H 3.030 11.084 1.654 1.00 . A A . 42 TYR HE1 1 1 18 11491 1 1 42 TYR HE2 H 6.997 9.671 2.345 1.00 . A A . 42 TYR HE2 1 1 18 11492 1 1 42 TYR HH H 4.344 10.907 3.871 1.00 . A A . 42 TYR HH 1 1 18 11493 1 1 42 TYR N N 4.227 9.799 -3.055 1.00 . A A . 42 TYR N 1 1 18 11494 1 1 42 TYR O O 5.693 7.973 -1.551 1.00 . A A . 42 TYR O 1 1 18 11495 1 1 42 TYR OH O 4.660 10.100 3.458 1.00 . A A . 42 TYR OH 1 1 18 11496 1 1 43 PRO C C 8.791 7.264 -0.974 1.00 . A A . 43 PRO C 1 1 18 11497 1 1 43 PRO CA C 8.217 7.132 -2.380 1.00 . A A . 43 PRO CA 1 1 18 11498 1 1 43 PRO CB C 9.339 6.997 -3.407 1.00 . A A . 43 PRO CB 1 1 18 11499 1 1 43 PRO CD C 8.310 9.119 -3.790 1.00 . A A . 43 PRO CD 1 1 18 11500 1 1 43 PRO CG C 9.631 8.398 -3.816 1.00 . A A . 43 PRO CG 1 1 18 11501 1 1 43 PRO HA H 7.575 6.265 -2.426 1.00 . A A . 43 PRO HA 1 1 18 11502 1 1 43 PRO HB2 H 10.197 6.528 -2.949 1.00 . A A . 43 PRO HB2 1 1 18 11503 1 1 43 PRO HB3 H 8.997 6.405 -4.243 1.00 . A A . 43 PRO HB3 1 1 18 11504 1 1 43 PRO HD2 H 8.442 10.137 -3.457 1.00 . A A . 43 PRO HD2 1 1 18 11505 1 1 43 PRO HD3 H 7.849 9.097 -4.767 1.00 . A A . 43 PRO HD3 1 1 18 11506 1 1 43 PRO HG2 H 10.318 8.850 -3.115 1.00 . A A . 43 PRO HG2 1 1 18 11507 1 1 43 PRO HG3 H 10.046 8.412 -4.813 1.00 . A A . 43 PRO HG3 1 1 18 11508 1 1 43 PRO N N 7.516 8.344 -2.816 1.00 . A A . 43 PRO N 1 1 18 11509 1 1 43 PRO O O 8.890 8.366 -0.433 1.00 . A A . 43 PRO O 1 1 18 11510 1 1 44 GLY C C 11.011 6.946 1.038 1.00 . A A . 44 GLY C 1 1 18 11511 1 1 44 GLY CA C 9.729 6.142 0.952 1.00 . A A . 44 GLY CA 1 1 18 11512 1 1 44 GLY H H 9.065 5.285 -0.866 1.00 . A A . 44 GLY H 1 1 18 11513 1 1 44 GLY HA2 H 9.933 5.125 1.251 1.00 . A A . 44 GLY HA2 1 1 18 11514 1 1 44 GLY HA3 H 9.004 6.567 1.631 1.00 . A A . 44 GLY HA3 1 1 18 11515 1 1 44 GLY N N 9.168 6.133 -0.387 1.00 . A A . 44 GLY N 1 1 18 11516 1 1 44 GLY O O 11.433 7.561 0.059 1.00 . A A . 44 GLY O 1 1 18 11517 1 1 45 ASN C C 12.675 9.166 2.176 1.00 . A A . 45 ASN C 1 1 18 11518 1 1 45 ASN CA C 12.875 7.674 2.424 1.00 . A A . 45 ASN CA 1 1 18 11519 1 1 45 ASN CB C 13.973 7.135 1.505 1.00 . A A . 45 ASN CB 1 1 18 11520 1 1 45 ASN CG C 14.212 5.651 1.698 1.00 . A A . 45 ASN CG 1 1 18 11521 1 1 45 ASN H H 11.247 6.430 2.956 1.00 . A A . 45 ASN H 1 1 18 11522 1 1 45 ASN HA H 13.175 7.529 3.451 1.00 . A A . 45 ASN HA 1 1 18 11523 1 1 45 ASN HB2 H 13.688 7.303 0.477 1.00 . A A . 45 ASN HB2 1 1 18 11524 1 1 45 ASN HB3 H 14.894 7.660 1.709 1.00 . A A . 45 ASN HB3 1 1 18 11525 1 1 45 ASN HD21 H 14.315 5.899 3.669 1.00 . A A . 45 ASN HD21 1 1 18 11526 1 1 45 ASN HD22 H 14.520 4.279 3.104 1.00 . A A . 45 ASN HD22 1 1 18 11527 1 1 45 ASN N N 11.633 6.940 2.213 1.00 . A A . 45 ASN N 1 1 18 11528 1 1 45 ASN ND2 N 14.364 5.234 2.950 1.00 . A A . 45 ASN ND2 1 1 18 11529 1 1 45 ASN O O 12.968 9.669 1.092 1.00 . A A . 45 ASN O 1 1 18 11530 1 1 45 ASN OD1 O 14.258 4.887 0.734 1.00 . A A . 45 ASN OD1 1 1 18 11531 1 1 46 GLY C C 10.606 11.719 3.631 1.00 . A A . 46 GLY C 1 1 18 11532 1 1 46 GLY CA C 11.944 11.293 3.060 1.00 . A A . 46 GLY CA 1 1 18 11533 1 1 46 GLY H H 11.960 9.411 4.029 1.00 . A A . 46 GLY H 1 1 18 11534 1 1 46 GLY HA2 H 11.977 11.559 2.014 1.00 . A A . 46 GLY HA2 1 1 18 11535 1 1 46 GLY HA3 H 12.729 11.822 3.580 1.00 . A A . 46 GLY HA3 1 1 18 11536 1 1 46 GLY N N 12.174 9.867 3.188 1.00 . A A . 46 GLY N 1 1 18 11537 1 1 46 GLY O O 9.722 12.114 2.842 1.00 . A A . 46 GLY O 1 1 18 11538 1 1 46 GLY OXT O 10.441 11.656 4.868 1.00 . A A . 46 GLY OXT 1 1 19 11539 1 1 1 ALA C C -17.617 -1.554 4.624 1.00 . A A . 1 ALA C 1 1 19 11540 1 1 1 ALA CA C -18.717 -0.609 4.153 1.00 . A A . 1 ALA CA 1 1 19 11541 1 1 1 ALA CB C -18.494 -0.226 2.698 1.00 . A A . 1 ALA CB 1 1 19 11542 1 1 1 ALA H1 H -17.802 0.950 5.134 1.00 . A A . 1 ALA H1 1 1 19 11543 1 1 1 ALA H2 H -19.358 1.313 4.507 1.00 . A A . 1 ALA H2 1 1 19 11544 1 1 1 ALA H3 H -19.202 0.340 5.912 1.00 . A A . 1 ALA H3 1 1 19 11545 1 1 1 ALA HA H -19.668 -1.118 4.223 1.00 . A A . 1 ALA HA 1 1 19 11546 1 1 1 ALA HB1 H -18.168 -1.093 2.143 1.00 . A A . 1 ALA HB1 1 1 19 11547 1 1 1 ALA HB2 H -19.418 0.144 2.278 1.00 . A A . 1 ALA HB2 1 1 19 11548 1 1 1 ALA HB3 H -17.739 0.544 2.640 1.00 . A A . 1 ALA HB3 1 1 19 11549 1 1 1 ALA N N -18.775 0.608 5.003 1.00 . A A . 1 ALA N 1 1 19 11550 1 1 1 ALA O O -16.493 -1.130 4.890 1.00 . A A . 1 ALA O 1 1 19 11551 1 1 2 MET C C -16.997 -5.047 4.230 1.00 . A A . 2 MET C 1 1 19 11552 1 1 2 MET CA C -16.990 -3.843 5.166 1.00 . A A . 2 MET CA 1 1 19 11553 1 1 2 MET CB C -17.307 -4.290 6.594 1.00 . A A . 2 MET CB 1 1 19 11554 1 1 2 MET CE C -15.742 -4.881 9.365 1.00 . A A . 2 MET CE 1 1 19 11555 1 1 2 MET CG C -17.103 -3.199 7.632 1.00 . A A . 2 MET CG 1 1 19 11556 1 1 2 MET H H -18.863 -3.114 4.500 1.00 . A A . 2 MET H 1 1 19 11557 1 1 2 MET HA H -16.008 -3.394 5.148 1.00 . A A . 2 MET HA 1 1 19 11558 1 1 2 MET HB2 H -18.337 -4.612 6.638 1.00 . A A . 2 MET HB2 1 1 19 11559 1 1 2 MET HB3 H -16.667 -5.123 6.848 1.00 . A A . 2 MET HB3 1 1 19 11560 1 1 2 MET HE1 H -15.230 -4.830 8.415 1.00 . A A . 2 MET HE1 1 1 19 11561 1 1 2 MET HE2 H -15.078 -4.550 10.149 1.00 . A A . 2 MET HE2 1 1 19 11562 1 1 2 MET HE3 H -16.046 -5.899 9.555 1.00 . A A . 2 MET HE3 1 1 19 11563 1 1 2 MET HG2 H -16.133 -2.751 7.478 1.00 . A A . 2 MET HG2 1 1 19 11564 1 1 2 MET HG3 H -17.869 -2.449 7.502 1.00 . A A . 2 MET HG3 1 1 19 11565 1 1 2 MET N N -17.950 -2.837 4.726 1.00 . A A . 2 MET N 1 1 19 11566 1 1 2 MET O O -17.606 -6.074 4.528 1.00 . A A . 2 MET O 1 1 19 11567 1 1 2 MET SD S -17.187 -3.824 9.322 1.00 . A A . 2 MET SD 1 1 19 11568 1 1 3 ASP C C -14.874 -6.662 2.146 1.00 . A A . 3 ASP C 1 1 19 11569 1 1 3 ASP CA C -16.243 -5.991 2.117 1.00 . A A . 3 ASP CA 1 1 19 11570 1 1 3 ASP CB C -16.531 -5.453 0.714 1.00 . A A . 3 ASP CB 1 1 19 11571 1 1 3 ASP CG C -17.955 -4.954 0.567 1.00 . A A . 3 ASP CG 1 1 19 11572 1 1 3 ASP H H -15.850 -4.071 2.915 1.00 . A A . 3 ASP H 1 1 19 11573 1 1 3 ASP HA H -16.995 -6.723 2.373 1.00 . A A . 3 ASP HA 1 1 19 11574 1 1 3 ASP HB2 H -15.859 -4.634 0.504 1.00 . A A . 3 ASP HB2 1 1 19 11575 1 1 3 ASP HB3 H -16.368 -6.241 -0.007 1.00 . A A . 3 ASP HB3 1 1 19 11576 1 1 3 ASP N N -16.316 -4.914 3.097 1.00 . A A . 3 ASP N 1 1 19 11577 1 1 3 ASP O O -14.766 -7.866 2.377 1.00 . A A . 3 ASP O 1 1 19 11578 1 1 3 ASP OD1 O -18.138 -3.810 0.100 1.00 . A A . 3 ASP OD1 1 1 19 11579 1 1 3 ASP OD2 O -18.887 -5.708 0.918 1.00 . A A . 3 ASP OD2 1 1 19 11580 1 1 4 CYS C C -11.457 -5.266 1.705 1.00 . A A . 4 CYS C 1 1 19 11581 1 1 4 CYS CA C -12.466 -6.392 1.909 1.00 . A A . 4 CYS CA 1 1 19 11582 1 1 4 CYS CB C -12.301 -7.451 0.816 1.00 . A A . 4 CYS CB 1 1 19 11583 1 1 4 CYS H H -13.979 -4.922 1.732 1.00 . A A . 4 CYS H 1 1 19 11584 1 1 4 CYS HA H -12.286 -6.849 2.870 1.00 . A A . 4 CYS HA 1 1 19 11585 1 1 4 CYS HB2 H -13.178 -7.446 0.185 1.00 . A A . 4 CYS HB2 1 1 19 11586 1 1 4 CYS HB3 H -11.433 -7.211 0.219 1.00 . A A . 4 CYS HB3 1 1 19 11587 1 1 4 CYS N N -13.830 -5.874 1.910 1.00 . A A . 4 CYS N 1 1 19 11588 1 1 4 CYS O O -11.745 -4.275 1.035 1.00 . A A . 4 CYS O 1 1 19 11589 1 1 4 CYS SG S -12.088 -9.145 1.451 1.00 . A A . 4 CYS SG 1 1 19 11590 1 1 5 THR C C -8.727 -4.325 0.732 1.00 . A A . 5 THR C 1 1 19 11591 1 1 5 THR CA C -9.221 -4.427 2.171 1.00 . A A . 5 THR CA 1 1 19 11592 1 1 5 THR CB C -8.056 -4.773 3.101 1.00 . A A . 5 THR CB 1 1 19 11593 1 1 5 THR CG2 C -7.376 -3.554 3.687 1.00 . A A . 5 THR CG2 1 1 19 11594 1 1 5 THR H H -10.105 -6.241 2.809 1.00 . A A . 5 THR H 1 1 19 11595 1 1 5 THR HA H -9.635 -3.474 2.466 1.00 . A A . 5 THR HA 1 1 19 11596 1 1 5 THR HB H -7.316 -5.329 2.544 1.00 . A A . 5 THR HB 1 1 19 11597 1 1 5 THR HG1 H -8.468 -6.502 3.923 1.00 . A A . 5 THR HG1 1 1 19 11598 1 1 5 THR HG21 H -7.982 -2.680 3.501 1.00 . A A . 5 THR HG21 1 1 19 11599 1 1 5 THR HG22 H -7.253 -3.688 4.752 1.00 . A A . 5 THR HG22 1 1 19 11600 1 1 5 THR HG23 H -6.408 -3.426 3.226 1.00 . A A . 5 THR HG23 1 1 19 11601 1 1 5 THR N N -10.274 -5.428 2.288 1.00 . A A . 5 THR N 1 1 19 11602 1 1 5 THR O O -7.662 -4.840 0.391 1.00 . A A . 5 THR O 1 1 19 11603 1 1 5 THR OG1 O -8.498 -5.577 4.180 1.00 . A A . 5 THR OG1 1 1 19 11604 1 1 6 THR C C -8.443 -2.157 -1.737 1.00 . A A . 6 THR C 1 1 19 11605 1 1 6 THR CA C -9.154 -3.488 -1.514 1.00 . A A . 6 THR CA 1 1 19 11606 1 1 6 THR CB C -10.404 -3.565 -2.391 1.00 . A A . 6 THR CB 1 1 19 11607 1 1 6 THR CG2 C -10.768 -4.978 -2.791 1.00 . A A . 6 THR CG2 1 1 19 11608 1 1 6 THR H H -10.347 -3.270 0.221 1.00 . A A . 6 THR H 1 1 19 11609 1 1 6 THR HA H -8.485 -4.290 -1.785 1.00 . A A . 6 THR HA 1 1 19 11610 1 1 6 THR HB H -10.232 -2.999 -3.295 1.00 . A A . 6 THR HB 1 1 19 11611 1 1 6 THR HG1 H -11.558 -2.062 -1.894 1.00 . A A . 6 THR HG1 1 1 19 11612 1 1 6 THR HG21 H -10.164 -5.677 -2.233 1.00 . A A . 6 THR HG21 1 1 19 11613 1 1 6 THR HG22 H -11.813 -5.155 -2.579 1.00 . A A . 6 THR HG22 1 1 19 11614 1 1 6 THR HG23 H -10.589 -5.111 -3.848 1.00 . A A . 6 THR HG23 1 1 19 11615 1 1 6 THR N N -9.510 -3.657 -0.110 1.00 . A A . 6 THR N 1 1 19 11616 1 1 6 THR O O -8.718 -1.172 -1.053 1.00 . A A . 6 THR O 1 1 19 11617 1 1 6 THR OG1 O -11.521 -3.006 -1.723 1.00 . A A . 6 THR OG1 1 1 19 11618 1 1 7 GLY C C -5.334 -1.194 -3.325 1.00 . A A . 7 GLY C 1 1 19 11619 1 1 7 GLY CA C -6.790 -0.923 -2.997 1.00 . A A . 7 GLY CA 1 1 19 11620 1 1 7 GLY H H -7.350 -2.953 -3.212 1.00 . A A . 7 GLY H 1 1 19 11621 1 1 7 GLY HA2 H -6.839 -0.267 -2.141 1.00 . A A . 7 GLY HA2 1 1 19 11622 1 1 7 GLY HA3 H -7.253 -0.432 -3.840 1.00 . A A . 7 GLY HA3 1 1 19 11623 1 1 7 GLY N N -7.527 -2.137 -2.700 1.00 . A A . 7 GLY N 1 1 19 11624 1 1 7 GLY O O -4.885 -2.338 -3.258 1.00 . A A . 7 GLY O 1 1 19 11625 1 1 8 PRO C C -2.265 -0.524 -2.802 1.00 . A A . 8 PRO C 1 1 19 11626 1 1 8 PRO CA C -3.149 -0.300 -4.029 1.00 . A A . 8 PRO CA 1 1 19 11627 1 1 8 PRO CB C -2.811 1.034 -4.696 1.00 . A A . 8 PRO CB 1 1 19 11628 1 1 8 PRO CD C -5.020 1.247 -3.798 1.00 . A A . 8 PRO CD 1 1 19 11629 1 1 8 PRO CG C -3.753 2.010 -4.080 1.00 . A A . 8 PRO CG 1 1 19 11630 1 1 8 PRO HA H -2.994 -1.105 -4.732 1.00 . A A . 8 PRO HA 1 1 19 11631 1 1 8 PRO HB2 H -1.782 1.293 -4.491 1.00 . A A . 8 PRO HB2 1 1 19 11632 1 1 8 PRO HB3 H -2.964 0.958 -5.762 1.00 . A A . 8 PRO HB3 1 1 19 11633 1 1 8 PRO HD2 H -5.463 1.582 -2.871 1.00 . A A . 8 PRO HD2 1 1 19 11634 1 1 8 PRO HD3 H -5.718 1.362 -4.614 1.00 . A A . 8 PRO HD3 1 1 19 11635 1 1 8 PRO HG2 H -3.334 2.394 -3.162 1.00 . A A . 8 PRO HG2 1 1 19 11636 1 1 8 PRO HG3 H -3.948 2.817 -4.771 1.00 . A A . 8 PRO HG3 1 1 19 11637 1 1 8 PRO N N -4.566 -0.153 -3.688 1.00 . A A . 8 PRO N 1 1 19 11638 1 1 8 PRO O O -1.072 -0.794 -2.933 1.00 . A A . 8 PRO O 1 1 19 11639 1 1 9 CYS C C -2.730 -1.691 0.493 1.00 . A A . 9 CYS C 1 1 19 11640 1 1 9 CYS CA C -2.104 -0.597 -0.370 1.00 . A A . 9 CYS CA 1 1 19 11641 1 1 9 CYS CB C -2.033 0.719 0.412 1.00 . A A . 9 CYS CB 1 1 19 11642 1 1 9 CYS H H -3.805 -0.189 -1.564 1.00 . A A . 9 CYS H 1 1 19 11643 1 1 9 CYS HA H -1.103 -0.900 -0.633 1.00 . A A . 9 CYS HA 1 1 19 11644 1 1 9 CYS HB2 H -2.417 1.515 -0.207 1.00 . A A . 9 CYS HB2 1 1 19 11645 1 1 9 CYS HB3 H -2.642 0.637 1.299 1.00 . A A . 9 CYS HB3 1 1 19 11646 1 1 9 CYS N N -2.852 -0.408 -1.611 1.00 . A A . 9 CYS N 1 1 19 11647 1 1 9 CYS O O -3.033 -1.474 1.666 1.00 . A A . 9 CYS O 1 1 19 11648 1 1 9 CYS SG S -0.351 1.194 0.934 1.00 . A A . 9 CYS SG 1 1 19 11649 1 1 10 CYS C C -3.584 -5.238 -0.241 1.00 . A A . 10 CYS C 1 1 19 11650 1 1 10 CYS CA C -3.494 -3.996 0.636 1.00 . A A . 10 CYS CA 1 1 19 11651 1 1 10 CYS CB C -4.883 -3.635 1.173 1.00 . A A . 10 CYS CB 1 1 19 11652 1 1 10 CYS H H -2.646 -2.991 -1.026 1.00 . A A . 10 CYS H 1 1 19 11653 1 1 10 CYS HA H -2.847 -4.215 1.469 1.00 . A A . 10 CYS HA 1 1 19 11654 1 1 10 CYS HB2 H -5.447 -4.542 1.326 1.00 . A A . 10 CYS HB2 1 1 19 11655 1 1 10 CYS HB3 H -4.771 -3.125 2.119 1.00 . A A . 10 CYS HB3 1 1 19 11656 1 1 10 CYS N N -2.913 -2.872 -0.091 1.00 . A A . 10 CYS N 1 1 19 11657 1 1 10 CYS O O -4.239 -5.231 -1.284 1.00 . A A . 10 CYS O 1 1 19 11658 1 1 10 CYS SG S -5.861 -2.557 0.075 1.00 . A A . 10 CYS SG 1 1 19 11659 1 1 11 ARG C C -4.295 -8.238 -0.421 1.00 . A A . 11 ARG C 1 1 19 11660 1 1 11 ARG CA C -2.931 -7.564 -0.535 1.00 . A A . 11 ARG CA 1 1 19 11661 1 1 11 ARG CB C -1.830 -8.486 -0.005 1.00 . A A . 11 ARG CB 1 1 19 11662 1 1 11 ARG CD C 0.371 -9.437 -0.759 1.00 . A A . 11 ARG CD 1 1 19 11663 1 1 11 ARG CG C -1.099 -9.251 -1.097 1.00 . A A . 11 ARG CG 1 1 19 11664 1 1 11 ARG CZ C 0.742 -11.865 -0.962 1.00 . A A . 11 ARG CZ 1 1 19 11665 1 1 11 ARG H H -2.428 -6.246 1.040 1.00 . A A . 11 ARG H 1 1 19 11666 1 1 11 ARG HA H -2.740 -7.344 -1.574 1.00 . A A . 11 ARG HA 1 1 19 11667 1 1 11 ARG HB2 H -1.106 -7.892 0.533 1.00 . A A . 11 ARG HB2 1 1 19 11668 1 1 11 ARG HB3 H -2.270 -9.202 0.672 1.00 . A A . 11 ARG HB3 1 1 19 11669 1 1 11 ARG HD2 H 0.917 -8.567 -1.091 1.00 . A A . 11 ARG HD2 1 1 19 11670 1 1 11 ARG HD3 H 0.471 -9.537 0.312 1.00 . A A . 11 ARG HD3 1 1 19 11671 1 1 11 ARG HE H 1.485 -10.487 -2.199 1.00 . A A . 11 ARG HE 1 1 19 11672 1 1 11 ARG HG2 H -1.557 -10.221 -1.212 1.00 . A A . 11 ARG HG2 1 1 19 11673 1 1 11 ARG HG3 H -1.180 -8.700 -2.024 1.00 . A A . 11 ARG HG3 1 1 19 11674 1 1 11 ARG HH11 H -0.414 -11.322 0.606 1.00 . A A . 11 ARG HH11 1 1 19 11675 1 1 11 ARG HH12 H -0.138 -13.024 0.441 1.00 . A A . 11 ARG HH12 1 1 19 11676 1 1 11 ARG HH21 H 1.849 -12.724 -2.418 1.00 . A A . 11 ARG HH21 1 1 19 11677 1 1 11 ARG HH22 H 1.147 -13.820 -1.275 1.00 . A A . 11 ARG HH22 1 1 19 11678 1 1 11 ARG N N -2.926 -6.305 0.197 1.00 . A A . 11 ARG N 1 1 19 11679 1 1 11 ARG NE N 0.934 -10.623 -1.400 1.00 . A A . 11 ARG NE 1 1 19 11680 1 1 11 ARG NH1 N 0.002 -12.088 0.117 1.00 . A A . 11 ARG NH1 1 1 19 11681 1 1 11 ARG NH2 N 1.291 -12.887 -1.605 1.00 . A A . 11 ARG NH2 1 1 19 11682 1 1 11 ARG O O -5.304 -7.571 -0.187 1.00 . A A . 11 ARG O 1 1 19 11683 1 1 12 GLN C C -6.316 -9.994 0.796 1.00 . A A . 12 GLN C 1 1 19 11684 1 1 12 GLN CA C -5.583 -10.295 -0.505 1.00 . A A . 12 GLN CA 1 1 19 11685 1 1 12 GLN CB C -5.342 -11.794 -0.618 1.00 . A A . 12 GLN CB 1 1 19 11686 1 1 12 GLN CD C -2.971 -12.453 -1.189 1.00 . A A . 12 GLN CD 1 1 19 11687 1 1 12 GLN CG C -4.365 -12.177 -1.718 1.00 . A A . 12 GLN CG 1 1 19 11688 1 1 12 GLN H H -3.500 -10.042 -0.777 1.00 . A A . 12 GLN H 1 1 19 11689 1 1 12 GLN HA H -6.204 -9.980 -1.330 1.00 . A A . 12 GLN HA 1 1 19 11690 1 1 12 GLN HB2 H -4.956 -12.155 0.322 1.00 . A A . 12 GLN HB2 1 1 19 11691 1 1 12 GLN HB3 H -6.286 -12.276 -0.819 1.00 . A A . 12 GLN HB3 1 1 19 11692 1 1 12 GLN HE21 H -2.547 -13.538 -2.801 1.00 . A A . 12 GLN HE21 1 1 19 11693 1 1 12 GLN HE22 H -1.281 -13.401 -1.634 1.00 . A A . 12 GLN HE22 1 1 19 11694 1 1 12 GLN HG2 H -4.728 -13.066 -2.212 1.00 . A A . 12 GLN HG2 1 1 19 11695 1 1 12 GLN HG3 H -4.310 -11.367 -2.431 1.00 . A A . 12 GLN HG3 1 1 19 11696 1 1 12 GLN N N -4.330 -9.557 -0.589 1.00 . A A . 12 GLN N 1 1 19 11697 1 1 12 GLN NE2 N -2.187 -13.207 -1.952 1.00 . A A . 12 GLN NE2 1 1 19 11698 1 1 12 GLN O O -6.058 -10.609 1.831 1.00 . A A . 12 GLN O 1 1 19 11699 1 1 12 GLN OE1 O -2.602 -11.994 -0.108 1.00 . A A . 12 GLN OE1 1 1 19 11700 1 1 13 CYS C C -7.203 -8.506 3.142 1.00 . A A . 13 CYS C 1 1 19 11701 1 1 13 CYS CA C -8.044 -8.644 1.870 1.00 . A A . 13 CYS CA 1 1 19 11702 1 1 13 CYS CB C -9.169 -9.655 2.100 1.00 . A A . 13 CYS CB 1 1 19 11703 1 1 13 CYS H H -7.390 -8.616 -0.143 1.00 . A A . 13 CYS H 1 1 19 11704 1 1 13 CYS HA H -8.483 -7.684 1.642 1.00 . A A . 13 CYS HA 1 1 19 11705 1 1 13 CYS HB2 H -9.464 -10.075 1.150 1.00 . A A . 13 CYS HB2 1 1 19 11706 1 1 13 CYS HB3 H -8.806 -10.447 2.739 1.00 . A A . 13 CYS HB3 1 1 19 11707 1 1 13 CYS N N -7.238 -9.049 0.720 1.00 . A A . 13 CYS N 1 1 19 11708 1 1 13 CYS O O -7.476 -9.163 4.147 1.00 . A A . 13 CYS O 1 1 19 11709 1 1 13 CYS SG S -10.657 -8.951 2.878 1.00 . A A . 13 CYS SG 1 1 19 11710 1 1 14 LYS C C -4.468 -6.194 4.071 1.00 . A A . 14 LYS C 1 1 19 11711 1 1 14 LYS CA C -5.329 -7.436 4.257 1.00 . A A . 14 LYS CA 1 1 19 11712 1 1 14 LYS CB C -4.440 -8.658 4.491 1.00 . A A . 14 LYS CB 1 1 19 11713 1 1 14 LYS CD C -5.105 -9.965 6.532 1.00 . A A . 14 LYS CD 1 1 19 11714 1 1 14 LYS CE C -6.266 -9.309 7.262 1.00 . A A . 14 LYS CE 1 1 19 11715 1 1 14 LYS CG C -4.151 -8.929 5.959 1.00 . A A . 14 LYS CG 1 1 19 11716 1 1 14 LYS H H -6.009 -7.144 2.276 1.00 . A A . 14 LYS H 1 1 19 11717 1 1 14 LYS HA H -5.964 -7.294 5.119 1.00 . A A . 14 LYS HA 1 1 19 11718 1 1 14 LYS HB2 H -4.927 -9.528 4.076 1.00 . A A . 14 LYS HB2 1 1 19 11719 1 1 14 LYS HB3 H -3.499 -8.507 3.984 1.00 . A A . 14 LYS HB3 1 1 19 11720 1 1 14 LYS HD2 H -5.494 -10.567 5.725 1.00 . A A . 14 LYS HD2 1 1 19 11721 1 1 14 LYS HD3 H -4.564 -10.593 7.225 1.00 . A A . 14 LYS HD3 1 1 19 11722 1 1 14 LYS HE2 H -6.659 -8.515 6.646 1.00 . A A . 14 LYS HE2 1 1 19 11723 1 1 14 LYS HE3 H -7.035 -10.050 7.428 1.00 . A A . 14 LYS HE3 1 1 19 11724 1 1 14 LYS HG2 H -3.140 -9.293 6.056 1.00 . A A . 14 LYS HG2 1 1 19 11725 1 1 14 LYS HG3 H -4.259 -8.008 6.513 1.00 . A A . 14 LYS HG3 1 1 19 11726 1 1 14 LYS HZ1 H -4.837 -8.501 8.554 1.00 . A A . 14 LYS HZ1 1 1 19 11727 1 1 14 LYS HZ2 H -6.394 -7.883 8.783 1.00 . A A . 14 LYS HZ2 1 1 19 11728 1 1 14 LYS HZ3 H -6.013 -9.436 9.332 1.00 . A A . 14 LYS HZ3 1 1 19 11729 1 1 14 LYS N N -6.187 -7.648 3.100 1.00 . A A . 14 LYS N 1 1 19 11730 1 1 14 LYS NZ N -5.848 -8.743 8.575 1.00 . A A . 14 LYS NZ 1 1 19 11731 1 1 14 LYS O O -3.671 -6.119 3.136 1.00 . A A . 14 LYS O 1 1 19 11732 1 1 15 LEU C C -2.379 -4.298 4.672 1.00 . A A . 15 LEU C 1 1 19 11733 1 1 15 LEU CA C -3.853 -3.985 4.896 1.00 . A A . 15 LEU CA 1 1 19 11734 1 1 15 LEU CB C -4.033 -3.164 6.176 1.00 . A A . 15 LEU CB 1 1 19 11735 1 1 15 LEU CD1 C -5.806 -1.557 5.430 1.00 . A A . 15 LEU CD1 1 1 19 11736 1 1 15 LEU CD2 C -4.216 -0.906 7.247 1.00 . A A . 15 LEU CD2 1 1 19 11737 1 1 15 LEU CG C -4.386 -1.692 5.956 1.00 . A A . 15 LEU CG 1 1 19 11738 1 1 15 LEU H H -5.276 -5.340 5.693 1.00 . A A . 15 LEU H 1 1 19 11739 1 1 15 LEU HA H -4.219 -3.414 4.056 1.00 . A A . 15 LEU HA 1 1 19 11740 1 1 15 LEU HB2 H -4.819 -3.617 6.762 1.00 . A A . 15 LEU HB2 1 1 19 11741 1 1 15 LEU HB3 H -3.114 -3.209 6.742 1.00 . A A . 15 LEU HB3 1 1 19 11742 1 1 15 LEU HD11 H -6.440 -2.284 5.915 1.00 . A A . 15 LEU HD11 1 1 19 11743 1 1 15 LEU HD12 H -6.174 -0.563 5.637 1.00 . A A . 15 LEU HD12 1 1 19 11744 1 1 15 LEU HD13 H -5.813 -1.728 4.363 1.00 . A A . 15 LEU HD13 1 1 19 11745 1 1 15 LEU HD21 H -4.312 -1.574 8.091 1.00 . A A . 15 LEU HD21 1 1 19 11746 1 1 15 LEU HD22 H -3.240 -0.445 7.263 1.00 . A A . 15 LEU HD22 1 1 19 11747 1 1 15 LEU HD23 H -4.976 -0.141 7.306 1.00 . A A . 15 LEU HD23 1 1 19 11748 1 1 15 LEU HG H -3.716 -1.274 5.219 1.00 . A A . 15 LEU HG 1 1 19 11749 1 1 15 LEU N N -4.627 -5.221 4.967 1.00 . A A . 15 LEU N 1 1 19 11750 1 1 15 LEU O O -1.752 -4.989 5.475 1.00 . A A . 15 LEU O 1 1 19 11751 1 1 16 LYS C C 0.478 -3.662 4.397 1.00 . A A . 16 LYS C 1 1 19 11752 1 1 16 LYS CA C -0.438 -4.048 3.234 1.00 . A A . 16 LYS CA 1 1 19 11753 1 1 16 LYS CB C -0.046 -3.271 1.975 1.00 . A A . 16 LYS CB 1 1 19 11754 1 1 16 LYS CD C 1.539 -4.520 0.477 1.00 . A A . 16 LYS CD 1 1 19 11755 1 1 16 LYS CE C 1.795 -4.755 -1.003 1.00 . A A . 16 LYS CE 1 1 19 11756 1 1 16 LYS CG C 0.089 -4.146 0.739 1.00 . A A . 16 LYS CG 1 1 19 11757 1 1 16 LYS H H -2.385 -3.267 2.961 1.00 . A A . 16 LYS H 1 1 19 11758 1 1 16 LYS HA H -0.336 -5.107 3.039 1.00 . A A . 16 LYS HA 1 1 19 11759 1 1 16 LYS HB2 H -0.800 -2.525 1.779 1.00 . A A . 16 LYS HB2 1 1 19 11760 1 1 16 LYS HB3 H 0.900 -2.779 2.146 1.00 . A A . 16 LYS HB3 1 1 19 11761 1 1 16 LYS HD2 H 2.175 -3.717 0.818 1.00 . A A . 16 LYS HD2 1 1 19 11762 1 1 16 LYS HD3 H 1.772 -5.423 1.021 1.00 . A A . 16 LYS HD3 1 1 19 11763 1 1 16 LYS HE2 H 1.234 -5.622 -1.319 1.00 . A A . 16 LYS HE2 1 1 19 11764 1 1 16 LYS HE3 H 1.459 -3.889 -1.555 1.00 . A A . 16 LYS HE3 1 1 19 11765 1 1 16 LYS HG2 H -0.484 -5.049 0.884 1.00 . A A . 16 LYS HG2 1 1 19 11766 1 1 16 LYS HG3 H -0.295 -3.607 -0.115 1.00 . A A . 16 LYS HG3 1 1 19 11767 1 1 16 LYS HZ1 H 3.809 -4.219 -0.873 1.00 . A A . 16 LYS HZ1 1 1 19 11768 1 1 16 LYS HZ2 H 3.545 -5.889 -0.882 1.00 . A A . 16 LYS HZ2 1 1 19 11769 1 1 16 LYS HZ3 H 3.401 -5.001 -2.316 1.00 . A A . 16 LYS HZ3 1 1 19 11770 1 1 16 LYS N N -1.834 -3.802 3.568 1.00 . A A . 16 LYS N 1 1 19 11771 1 1 16 LYS NZ N 3.238 -4.982 -1.288 1.00 . A A . 16 LYS NZ 1 1 19 11772 1 1 16 LYS O O 0.310 -2.602 4.999 1.00 . A A . 16 LYS O 1 1 19 11773 1 1 17 PRO C C 3.217 -2.986 5.600 1.00 . A A . 17 PRO C 1 1 19 11774 1 1 17 PRO CA C 2.396 -4.251 5.829 1.00 . A A . 17 PRO CA 1 1 19 11775 1 1 17 PRO CB C 3.308 -5.484 5.841 1.00 . A A . 17 PRO CB 1 1 19 11776 1 1 17 PRO CD C 1.739 -5.803 4.071 1.00 . A A . 17 PRO CD 1 1 19 11777 1 1 17 PRO CG C 3.147 -6.101 4.494 1.00 . A A . 17 PRO CG 1 1 19 11778 1 1 17 PRO HA H 1.880 -4.174 6.775 1.00 . A A . 17 PRO HA 1 1 19 11779 1 1 17 PRO HB2 H 4.330 -5.176 6.014 1.00 . A A . 17 PRO HB2 1 1 19 11780 1 1 17 PRO HB3 H 2.994 -6.159 6.623 1.00 . A A . 17 PRO HB3 1 1 19 11781 1 1 17 PRO HD2 H 1.679 -5.708 2.996 1.00 . A A . 17 PRO HD2 1 1 19 11782 1 1 17 PRO HD3 H 1.066 -6.571 4.423 1.00 . A A . 17 PRO HD3 1 1 19 11783 1 1 17 PRO HG2 H 3.849 -5.660 3.802 1.00 . A A . 17 PRO HG2 1 1 19 11784 1 1 17 PRO HG3 H 3.302 -7.168 4.558 1.00 . A A . 17 PRO HG3 1 1 19 11785 1 1 17 PRO N N 1.461 -4.517 4.731 1.00 . A A . 17 PRO N 1 1 19 11786 1 1 17 PRO O O 3.848 -2.825 4.556 1.00 . A A . 17 PRO O 1 1 19 11787 1 1 18 ALA C C 5.405 -1.095 6.096 1.00 . A A . 18 ALA C 1 1 19 11788 1 1 18 ALA CA C 3.953 -0.841 6.493 1.00 . A A . 18 ALA CA 1 1 19 11789 1 1 18 ALA CB C 3.889 -0.090 7.814 1.00 . A A . 18 ALA CB 1 1 19 11790 1 1 18 ALA H H 2.686 -2.277 7.393 1.00 . A A . 18 ALA H 1 1 19 11791 1 1 18 ALA HA H 3.485 -0.230 5.736 1.00 . A A . 18 ALA HA 1 1 19 11792 1 1 18 ALA HB1 H 4.300 -0.708 8.599 1.00 . A A . 18 ALA HB1 1 1 19 11793 1 1 18 ALA HB2 H 4.462 0.822 7.738 1.00 . A A . 18 ALA HB2 1 1 19 11794 1 1 18 ALA HB3 H 2.861 0.148 8.044 1.00 . A A . 18 ALA HB3 1 1 19 11795 1 1 18 ALA N N 3.207 -2.092 6.585 1.00 . A A . 18 ALA N 1 1 19 11796 1 1 18 ALA O O 5.956 -2.160 6.374 1.00 . A A . 18 ALA O 1 1 19 11797 1 1 19 GLY C C 7.538 -1.221 3.850 1.00 . A A . 19 GLY C 1 1 19 11798 1 1 19 GLY CA C 7.394 -0.259 5.013 1.00 . A A . 19 GLY CA 1 1 19 11799 1 1 19 GLY H H 5.528 0.711 5.241 1.00 . A A . 19 GLY H 1 1 19 11800 1 1 19 GLY HA2 H 7.982 -0.624 5.843 1.00 . A A . 19 GLY HA2 1 1 19 11801 1 1 19 GLY HA3 H 7.771 0.709 4.716 1.00 . A A . 19 GLY HA3 1 1 19 11802 1 1 19 GLY N N 6.016 -0.115 5.440 1.00 . A A . 19 GLY N 1 1 19 11803 1 1 19 GLY O O 8.612 -1.779 3.625 1.00 . A A . 19 GLY O 1 1 19 11804 1 1 20 THR C C 5.862 -1.642 0.734 1.00 . A A . 20 THR C 1 1 19 11805 1 1 20 THR CA C 6.456 -2.321 1.966 1.00 . A A . 20 THR CA 1 1 19 11806 1 1 20 THR CB C 5.669 -3.592 2.293 1.00 . A A . 20 THR CB 1 1 19 11807 1 1 20 THR CG2 C 5.605 -4.575 1.144 1.00 . A A . 20 THR CG2 1 1 19 11808 1 1 20 THR H H 5.623 -0.946 3.340 1.00 . A A . 20 THR H 1 1 19 11809 1 1 20 THR HA H 7.481 -2.586 1.757 1.00 . A A . 20 THR HA 1 1 19 11810 1 1 20 THR HB H 4.656 -3.318 2.550 1.00 . A A . 20 THR HB 1 1 19 11811 1 1 20 THR HG1 H 5.738 -5.059 3.589 1.00 . A A . 20 THR HG1 1 1 19 11812 1 1 20 THR HG21 H 5.914 -4.086 0.233 1.00 . A A . 20 THR HG21 1 1 19 11813 1 1 20 THR HG22 H 6.262 -5.408 1.346 1.00 . A A . 20 THR HG22 1 1 19 11814 1 1 20 THR HG23 H 4.591 -4.934 1.034 1.00 . A A . 20 THR HG23 1 1 19 11815 1 1 20 THR N N 6.450 -1.418 3.110 1.00 . A A . 20 THR N 1 1 19 11816 1 1 20 THR O O 4.695 -1.255 0.731 1.00 . A A . 20 THR O 1 1 19 11817 1 1 20 THR OG1 O 6.242 -4.263 3.401 1.00 . A A . 20 THR OG1 1 1 19 11818 1 1 21 THR C C 4.875 -1.411 -1.992 1.00 . A A . 21 THR C 1 1 19 11819 1 1 21 THR CA C 6.240 -0.886 -1.561 1.00 . A A . 21 THR CA 1 1 19 11820 1 1 21 THR CB C 7.263 -1.155 -2.659 1.00 . A A . 21 THR CB 1 1 19 11821 1 1 21 THR CG2 C 7.719 -2.592 -2.689 1.00 . A A . 21 THR CG2 1 1 19 11822 1 1 21 THR H H 7.594 -1.846 -0.243 1.00 . A A . 21 THR H 1 1 19 11823 1 1 21 THR HA H 6.171 0.178 -1.400 1.00 . A A . 21 THR HA 1 1 19 11824 1 1 21 THR HB H 8.132 -0.534 -2.492 1.00 . A A . 21 THR HB 1 1 19 11825 1 1 21 THR HG1 H 7.106 -0.018 -4.247 1.00 . A A . 21 THR HG1 1 1 19 11826 1 1 21 THR HG21 H 7.241 -3.132 -1.883 1.00 . A A . 21 THR HG21 1 1 19 11827 1 1 21 THR HG22 H 7.447 -3.037 -3.634 1.00 . A A . 21 THR HG22 1 1 19 11828 1 1 21 THR HG23 H 8.791 -2.633 -2.564 1.00 . A A . 21 THR HG23 1 1 19 11829 1 1 21 THR N N 6.675 -1.510 -0.311 1.00 . A A . 21 THR N 1 1 19 11830 1 1 21 THR O O 4.773 -2.445 -2.652 1.00 . A A . 21 THR O 1 1 19 11831 1 1 21 THR OG1 O 6.729 -0.843 -3.934 1.00 . A A . 21 THR OG1 1 1 19 11832 1 1 22 CYS C C 2.231 -1.008 -3.450 1.00 . A A . 22 CYS C 1 1 19 11833 1 1 22 CYS CA C 2.468 -1.071 -1.947 1.00 . A A . 22 CYS CA 1 1 19 11834 1 1 22 CYS CB C 1.480 -0.154 -1.236 1.00 . A A . 22 CYS CB 1 1 19 11835 1 1 22 CYS H H 3.981 0.123 -1.084 1.00 . A A . 22 CYS H 1 1 19 11836 1 1 22 CYS HA H 2.310 -2.081 -1.611 1.00 . A A . 22 CYS HA 1 1 19 11837 1 1 22 CYS HB2 H 0.480 -0.512 -1.412 1.00 . A A . 22 CYS HB2 1 1 19 11838 1 1 22 CYS HB3 H 1.682 -0.171 -0.176 1.00 . A A . 22 CYS HB3 1 1 19 11839 1 1 22 CYS N N 3.831 -0.690 -1.610 1.00 . A A . 22 CYS N 1 1 19 11840 1 1 22 CYS O O 1.546 -1.859 -4.017 1.00 . A A . 22 CYS O 1 1 19 11841 1 1 22 CYS SG S 1.549 1.580 -1.786 1.00 . A A . 22 CYS SG 1 1 19 11842 1 1 23 TRP C C 3.712 -0.510 -6.310 1.00 . A A . 23 TRP C 1 1 19 11843 1 1 23 TRP CA C 2.620 0.197 -5.520 1.00 . A A . 23 TRP CA 1 1 19 11844 1 1 23 TRP CB C 2.609 1.687 -5.866 1.00 . A A . 23 TRP CB 1 1 19 11845 1 1 23 TRP CD1 C 0.863 1.173 -7.662 1.00 . A A . 23 TRP CD1 1 1 19 11846 1 1 23 TRP CD2 C 1.211 3.355 -7.324 1.00 . A A . 23 TRP CD2 1 1 19 11847 1 1 23 TRP CE2 C 0.234 3.206 -8.325 1.00 . A A . 23 TRP CE2 1 1 19 11848 1 1 23 TRP CE3 C 1.594 4.643 -6.943 1.00 . A A . 23 TRP CE3 1 1 19 11849 1 1 23 TRP CG C 1.598 2.041 -6.911 1.00 . A A . 23 TRP CG 1 1 19 11850 1 1 23 TRP CH2 C 0.032 5.545 -8.557 1.00 . A A . 23 TRP CH2 1 1 19 11851 1 1 23 TRP CZ2 C -0.363 4.296 -8.949 1.00 . A A . 23 TRP CZ2 1 1 19 11852 1 1 23 TRP CZ3 C 1.002 5.725 -7.564 1.00 . A A . 23 TRP CZ3 1 1 19 11853 1 1 23 TRP H H 3.313 0.667 -3.578 1.00 . A A . 23 TRP H 1 1 19 11854 1 1 23 TRP HA H 1.671 -0.228 -5.793 1.00 . A A . 23 TRP HA 1 1 19 11855 1 1 23 TRP HB2 H 2.383 2.256 -4.976 1.00 . A A . 23 TRP HB2 1 1 19 11856 1 1 23 TRP HB3 H 3.584 1.973 -6.233 1.00 . A A . 23 TRP HB3 1 1 19 11857 1 1 23 TRP HD1 H 0.931 0.100 -7.583 1.00 . A A . 23 TRP HD1 1 1 19 11858 1 1 23 TRP HE1 H -0.588 1.462 -9.152 1.00 . A A . 23 TRP HE1 1 1 19 11859 1 1 23 TRP HE3 H 2.340 4.799 -6.178 1.00 . A A . 23 TRP HE3 1 1 19 11860 1 1 23 TRP HH2 H -0.402 6.418 -9.018 1.00 . A A . 23 TRP HH2 1 1 19 11861 1 1 23 TRP HZ2 H -1.114 4.174 -9.714 1.00 . A A . 23 TRP HZ2 1 1 19 11862 1 1 23 TRP HZ3 H 1.286 6.728 -7.283 1.00 . A A . 23 TRP HZ3 1 1 19 11863 1 1 23 TRP N N 2.788 0.014 -4.086 1.00 . A A . 23 TRP N 1 1 19 11864 1 1 23 TRP NE1 N 0.038 1.864 -8.513 1.00 . A A . 23 TRP NE1 1 1 19 11865 1 1 23 TRP O O 3.453 -1.489 -7.010 1.00 . A A . 23 TRP O 1 1 19 11866 1 1 24 LYS C C 5.868 -0.407 -8.430 1.00 . A A . 24 LYS C 1 1 19 11867 1 1 24 LYS CA C 6.062 -0.567 -6.925 1.00 . A A . 24 LYS CA 1 1 19 11868 1 1 24 LYS CB C 6.233 -2.047 -6.572 1.00 . A A . 24 LYS CB 1 1 19 11869 1 1 24 LYS CD C 8.121 -3.266 -7.701 1.00 . A A . 24 LYS CD 1 1 19 11870 1 1 24 LYS CE C 9.536 -2.902 -8.121 1.00 . A A . 24 LYS CE 1 1 19 11871 1 1 24 LYS CG C 7.686 -2.484 -6.471 1.00 . A A . 24 LYS CG 1 1 19 11872 1 1 24 LYS H H 5.065 0.789 -5.642 1.00 . A A . 24 LYS H 1 1 19 11873 1 1 24 LYS HA H 6.949 -0.028 -6.628 1.00 . A A . 24 LYS HA 1 1 19 11874 1 1 24 LYS HB2 H 5.757 -2.235 -5.621 1.00 . A A . 24 LYS HB2 1 1 19 11875 1 1 24 LYS HB3 H 5.750 -2.645 -7.330 1.00 . A A . 24 LYS HB3 1 1 19 11876 1 1 24 LYS HD2 H 8.083 -4.321 -7.477 1.00 . A A . 24 LYS HD2 1 1 19 11877 1 1 24 LYS HD3 H 7.445 -3.044 -8.514 1.00 . A A . 24 LYS HD3 1 1 19 11878 1 1 24 LYS HE2 H 9.793 -3.470 -9.003 1.00 . A A . 24 LYS HE2 1 1 19 11879 1 1 24 LYS HE3 H 9.569 -1.847 -8.352 1.00 . A A . 24 LYS HE3 1 1 19 11880 1 1 24 LYS HG2 H 8.310 -1.608 -6.376 1.00 . A A . 24 LYS HG2 1 1 19 11881 1 1 24 LYS HG3 H 7.804 -3.109 -5.598 1.00 . A A . 24 LYS HG3 1 1 19 11882 1 1 24 LYS HZ1 H 10.232 -4.036 -6.511 1.00 . A A . 24 LYS HZ1 1 1 19 11883 1 1 24 LYS HZ2 H 11.462 -3.375 -7.467 1.00 . A A . 24 LYS HZ2 1 1 19 11884 1 1 24 LYS HZ3 H 10.599 -2.389 -6.398 1.00 . A A . 24 LYS HZ3 1 1 19 11885 1 1 24 LYS N N 4.929 0.002 -6.206 1.00 . A A . 24 LYS N 1 1 19 11886 1 1 24 LYS NZ N 10.527 -3.196 -7.050 1.00 . A A . 24 LYS NZ 1 1 19 11887 1 1 24 LYS O O 6.357 -1.215 -9.220 1.00 . A A . 24 LYS O 1 1 19 11888 1 1 25 THR C C 6.175 0.961 -11.031 1.00 . A A . 25 THR C 1 1 19 11889 1 1 25 THR CA C 4.878 0.920 -10.225 1.00 . A A . 25 THR CA 1 1 19 11890 1 1 25 THR CB C 4.124 2.245 -10.365 1.00 . A A . 25 THR CB 1 1 19 11891 1 1 25 THR CG2 C 3.722 2.565 -11.788 1.00 . A A . 25 THR CG2 1 1 19 11892 1 1 25 THR H H 4.784 1.248 -8.138 1.00 . A A . 25 THR H 1 1 19 11893 1 1 25 THR HA H 4.258 0.122 -10.606 1.00 . A A . 25 THR HA 1 1 19 11894 1 1 25 THR HB H 4.755 3.048 -10.012 1.00 . A A . 25 THR HB 1 1 19 11895 1 1 25 THR HG1 H 2.739 3.127 -9.297 1.00 . A A . 25 THR HG1 1 1 19 11896 1 1 25 THR HG21 H 4.559 2.395 -12.446 1.00 . A A . 25 THR HG21 1 1 19 11897 1 1 25 THR HG22 H 2.898 1.931 -12.080 1.00 . A A . 25 THR HG22 1 1 19 11898 1 1 25 THR HG23 H 3.419 3.601 -11.851 1.00 . A A . 25 THR HG23 1 1 19 11899 1 1 25 THR N N 5.147 0.643 -8.817 1.00 . A A . 25 THR N 1 1 19 11900 1 1 25 THR O O 7.237 1.279 -10.497 1.00 . A A . 25 THR O 1 1 19 11901 1 1 25 THR OG1 O 2.944 2.233 -9.581 1.00 . A A . 25 THR OG1 1 1 19 11902 1 1 26 SER C C 8.087 1.884 -13.019 1.00 . A A . 26 SER C 1 1 19 11903 1 1 26 SER CA C 7.244 0.624 -13.202 1.00 . A A . 26 SER CA 1 1 19 11904 1 1 26 SER CB C 6.800 0.504 -14.661 1.00 . A A . 26 SER CB 1 1 19 11905 1 1 26 SER H H 5.204 0.384 -12.682 1.00 . A A . 26 SER H 1 1 19 11906 1 1 26 SER HA H 7.845 -0.235 -12.948 1.00 . A A . 26 SER HA 1 1 19 11907 1 1 26 SER HB2 H 7.561 0.923 -15.302 1.00 . A A . 26 SER HB2 1 1 19 11908 1 1 26 SER HB3 H 6.655 -0.538 -14.906 1.00 . A A . 26 SER HB3 1 1 19 11909 1 1 26 SER HG H 5.638 2.072 -14.488 1.00 . A A . 26 SER HG 1 1 19 11910 1 1 26 SER N N 6.079 0.632 -12.318 1.00 . A A . 26 SER N 1 1 19 11911 1 1 26 SER O O 9.305 1.860 -13.198 1.00 . A A . 26 SER O 1 1 19 11912 1 1 26 SER OG O 5.585 1.199 -14.883 1.00 . A A . 26 SER OG 1 1 19 11913 1 1 27 VAL C C 7.550 4.979 -11.233 1.00 . A A . 27 VAL C 1 1 19 11914 1 1 27 VAL CA C 8.117 4.248 -12.446 1.00 . A A . 27 VAL CA 1 1 19 11915 1 1 27 VAL CB C 8.005 5.161 -13.684 1.00 . A A . 27 VAL CB 1 1 19 11916 1 1 27 VAL CG1 C 6.559 5.571 -13.923 1.00 . A A . 27 VAL CG1 1 1 19 11917 1 1 27 VAL CG2 C 8.894 6.386 -13.526 1.00 . A A . 27 VAL CG2 1 1 19 11918 1 1 27 VAL H H 6.461 2.935 -12.528 1.00 . A A . 27 VAL H 1 1 19 11919 1 1 27 VAL HA H 9.162 4.037 -12.272 1.00 . A A . 27 VAL HA 1 1 19 11920 1 1 27 VAL HB H 8.345 4.606 -14.546 1.00 . A A . 27 VAL HB 1 1 19 11921 1 1 27 VAL HG11 H 6.158 6.020 -13.025 1.00 . A A . 27 VAL HG11 1 1 19 11922 1 1 27 VAL HG12 H 6.515 6.284 -14.733 1.00 . A A . 27 VAL HG12 1 1 19 11923 1 1 27 VAL HG13 H 5.975 4.699 -14.179 1.00 . A A . 27 VAL HG13 1 1 19 11924 1 1 27 VAL HG21 H 9.755 6.131 -12.925 1.00 . A A . 27 VAL HG21 1 1 19 11925 1 1 27 VAL HG22 H 9.221 6.722 -14.499 1.00 . A A . 27 VAL HG22 1 1 19 11926 1 1 27 VAL HG23 H 8.337 7.174 -13.041 1.00 . A A . 27 VAL HG23 1 1 19 11927 1 1 27 VAL N N 7.430 2.980 -12.658 1.00 . A A . 27 VAL N 1 1 19 11928 1 1 27 VAL O O 7.583 6.207 -11.165 1.00 . A A . 27 VAL O 1 1 19 11929 1 1 28 SER C C 6.283 3.772 -7.971 1.00 . A A . 28 SER C 1 1 19 11930 1 1 28 SER CA C 6.444 4.808 -9.080 1.00 . A A . 28 SER CA 1 1 19 11931 1 1 28 SER CB C 5.088 5.443 -9.405 1.00 . A A . 28 SER CB 1 1 19 11932 1 1 28 SER H H 7.017 3.245 -10.387 1.00 . A A . 28 SER H 1 1 19 11933 1 1 28 SER HA H 7.116 5.580 -8.737 1.00 . A A . 28 SER HA 1 1 19 11934 1 1 28 SER HB2 H 4.337 5.049 -8.736 1.00 . A A . 28 SER HB2 1 1 19 11935 1 1 28 SER HB3 H 5.156 6.514 -9.278 1.00 . A A . 28 SER HB3 1 1 19 11936 1 1 28 SER HG H 3.778 5.413 -10.862 1.00 . A A . 28 SER HG 1 1 19 11937 1 1 28 SER N N 7.022 4.219 -10.280 1.00 . A A . 28 SER N 1 1 19 11938 1 1 28 SER O O 5.246 3.118 -7.864 1.00 . A A . 28 SER O 1 1 19 11939 1 1 28 SER OG O 4.698 5.167 -10.739 1.00 . A A . 28 SER OG 1 1 19 11940 1 1 29 SER C C 6.963 3.440 -4.729 1.00 . A A . 29 SER C 1 1 19 11941 1 1 29 SER CA C 7.275 2.699 -6.024 1.00 . A A . 29 SER CA 1 1 19 11942 1 1 29 SER CB C 8.609 1.961 -5.902 1.00 . A A . 29 SER CB 1 1 19 11943 1 1 29 SER H H 8.105 4.198 -7.267 1.00 . A A . 29 SER H 1 1 19 11944 1 1 29 SER HA H 6.487 1.984 -6.218 1.00 . A A . 29 SER HA 1 1 19 11945 1 1 29 SER HB2 H 8.676 1.500 -4.928 1.00 . A A . 29 SER HB2 1 1 19 11946 1 1 29 SER HB3 H 8.668 1.199 -6.666 1.00 . A A . 29 SER HB3 1 1 19 11947 1 1 29 SER HG H 9.622 3.570 -5.429 1.00 . A A . 29 SER HG 1 1 19 11948 1 1 29 SER N N 7.310 3.640 -7.138 1.00 . A A . 29 SER N 1 1 19 11949 1 1 29 SER O O 7.652 4.393 -4.370 1.00 . A A . 29 SER O 1 1 19 11950 1 1 29 SER OG O 9.701 2.850 -6.060 1.00 . A A . 29 SER OG 1 1 19 11951 1 1 30 HIS C C 5.270 2.645 -1.690 1.00 . A A . 30 HIS C 1 1 19 11952 1 1 30 HIS CA C 5.495 3.663 -2.804 1.00 . A A . 30 HIS CA 1 1 19 11953 1 1 30 HIS CB C 4.222 4.476 -3.047 1.00 . A A . 30 HIS CB 1 1 19 11954 1 1 30 HIS CD2 C 4.650 5.079 -5.531 1.00 . A A . 30 HIS CD2 1 1 19 11955 1 1 30 HIS CE1 C 4.221 7.223 -5.432 1.00 . A A . 30 HIS CE1 1 1 19 11956 1 1 30 HIS CG C 4.312 5.363 -4.252 1.00 . A A . 30 HIS CG 1 1 19 11957 1 1 30 HIS H H 5.384 2.260 -4.387 1.00 . A A . 30 HIS H 1 1 19 11958 1 1 30 HIS HA H 6.285 4.334 -2.504 1.00 . A A . 30 HIS HA 1 1 19 11959 1 1 30 HIS HB2 H 3.392 3.799 -3.194 1.00 . A A . 30 HIS HB2 1 1 19 11960 1 1 30 HIS HB3 H 4.027 5.099 -2.186 1.00 . A A . 30 HIS HB3 1 1 19 11961 1 1 30 HIS HD1 H 3.773 7.229 -3.433 1.00 . A A . 30 HIS HD1 1 1 19 11962 1 1 30 HIS HD2 H 4.919 4.108 -5.920 1.00 . A A . 30 HIS HD2 1 1 19 11963 1 1 30 HIS HE1 H 4.088 8.256 -5.711 1.00 . A A . 30 HIS HE1 1 1 19 11964 1 1 30 HIS HE2 H 4.917 6.377 -7.155 1.00 . A A . 30 HIS HE2 1 1 19 11965 1 1 30 HIS N N 5.907 3.015 -4.044 1.00 . A A . 30 HIS N 1 1 19 11966 1 1 30 HIS ND1 N 4.047 6.716 -4.222 1.00 . A A . 30 HIS ND1 1 1 19 11967 1 1 30 HIS NE2 N 4.587 6.250 -6.242 1.00 . A A . 30 HIS NE2 1 1 19 11968 1 1 30 HIS O O 4.468 1.725 -1.829 1.00 . A A . 30 HIS O 1 1 19 11969 1 1 31 TYR C C 4.575 2.147 1.317 1.00 . A A . 31 TYR C 1 1 19 11970 1 1 31 TYR CA C 5.880 1.925 0.561 1.00 . A A . 31 TYR CA 1 1 19 11971 1 1 31 TYR CB C 7.063 2.135 1.507 1.00 . A A . 31 TYR CB 1 1 19 11972 1 1 31 TYR CD1 C 8.720 1.408 -0.254 1.00 . A A . 31 TYR CD1 1 1 19 11973 1 1 31 TYR CD2 C 9.112 0.750 2.003 1.00 . A A . 31 TYR CD2 1 1 19 11974 1 1 31 TYR CE1 C 9.871 0.753 -0.649 1.00 . A A . 31 TYR CE1 1 1 19 11975 1 1 31 TYR CE2 C 10.263 0.093 1.617 1.00 . A A . 31 TYR CE2 1 1 19 11976 1 1 31 TYR CG C 8.322 1.418 1.077 1.00 . A A . 31 TYR CG 1 1 19 11977 1 1 31 TYR CZ C 10.638 0.096 0.290 1.00 . A A . 31 TYR CZ 1 1 19 11978 1 1 31 TYR H H 6.613 3.577 -0.540 1.00 . A A . 31 TYR H 1 1 19 11979 1 1 31 TYR HA H 5.901 0.911 0.196 1.00 . A A . 31 TYR HA 1 1 19 11980 1 1 31 TYR HB2 H 7.287 3.190 1.563 1.00 . A A . 31 TYR HB2 1 1 19 11981 1 1 31 TYR HB3 H 6.796 1.777 2.490 1.00 . A A . 31 TYR HB3 1 1 19 11982 1 1 31 TYR HD1 H 8.116 1.923 -0.987 1.00 . A A . 31 TYR HD1 1 1 19 11983 1 1 31 TYR HD2 H 8.815 0.748 3.041 1.00 . A A . 31 TYR HD2 1 1 19 11984 1 1 31 TYR HE1 H 10.164 0.757 -1.688 1.00 . A A . 31 TYR HE1 1 1 19 11985 1 1 31 TYR HE2 H 10.863 -0.421 2.353 1.00 . A A . 31 TYR HE2 1 1 19 11986 1 1 31 TYR HH H 11.573 -1.463 -0.335 1.00 . A A . 31 TYR HH 1 1 19 11987 1 1 31 TYR N N 5.989 2.822 -0.585 1.00 . A A . 31 TYR N 1 1 19 11988 1 1 31 TYR O O 4.205 3.283 1.612 1.00 . A A . 31 TYR O 1 1 19 11989 1 1 31 TYR OH O 11.785 -0.557 -0.099 1.00 . A A . 31 TYR OH 1 1 19 11990 1 1 32 CYS C C 2.890 1.609 3.803 1.00 . A A . 32 CYS C 1 1 19 11991 1 1 32 CYS CA C 2.632 1.142 2.377 1.00 . A A . 32 CYS CA 1 1 19 11992 1 1 32 CYS CB C 1.921 -0.215 2.395 1.00 . A A . 32 CYS CB 1 1 19 11993 1 1 32 CYS H H 4.238 0.172 1.386 1.00 . A A . 32 CYS H 1 1 19 11994 1 1 32 CYS HA H 2.002 1.865 1.882 1.00 . A A . 32 CYS HA 1 1 19 11995 1 1 32 CYS HB2 H 2.202 -0.773 1.516 1.00 . A A . 32 CYS HB2 1 1 19 11996 1 1 32 CYS HB3 H 2.232 -0.761 3.274 1.00 . A A . 32 CYS HB3 1 1 19 11997 1 1 32 CYS N N 3.888 1.055 1.640 1.00 . A A . 32 CYS N 1 1 19 11998 1 1 32 CYS O O 3.977 1.409 4.344 1.00 . A A . 32 CYS O 1 1 19 11999 1 1 32 CYS SG S 0.098 -0.108 2.427 1.00 . A A . 32 CYS SG 1 1 19 12000 1 1 33 THR C C 1.259 1.810 6.744 1.00 . A A . 33 THR C 1 1 19 12001 1 1 33 THR CA C 2.009 2.718 5.774 1.00 . A A . 33 THR CA 1 1 19 12002 1 1 33 THR CB C 1.473 4.147 5.877 1.00 . A A . 33 THR CB 1 1 19 12003 1 1 33 THR CG2 C 2.177 5.118 4.954 1.00 . A A . 33 THR CG2 1 1 19 12004 1 1 33 THR H H 1.043 2.356 3.928 1.00 . A A . 33 THR H 1 1 19 12005 1 1 33 THR HA H 3.057 2.716 6.035 1.00 . A A . 33 THR HA 1 1 19 12006 1 1 33 THR HB H 1.605 4.498 6.890 1.00 . A A . 33 THR HB 1 1 19 12007 1 1 33 THR HG1 H -0.045 3.891 4.666 1.00 . A A . 33 THR HG1 1 1 19 12008 1 1 33 THR HG21 H 3.186 4.777 4.775 1.00 . A A . 33 THR HG21 1 1 19 12009 1 1 33 THR HG22 H 1.644 5.174 4.016 1.00 . A A . 33 THR HG22 1 1 19 12010 1 1 33 THR HG23 H 2.204 6.095 5.412 1.00 . A A . 33 THR HG23 1 1 19 12011 1 1 33 THR N N 1.886 2.229 4.408 1.00 . A A . 33 THR N 1 1 19 12012 1 1 33 THR O O 1.019 2.181 7.893 1.00 . A A . 33 THR O 1 1 19 12013 1 1 33 THR OG1 O 0.091 4.187 5.569 1.00 . A A . 33 THR OG1 1 1 19 12014 1 1 34 GLY C C -0.950 0.327 7.903 1.00 . A A . 34 GLY C 1 1 19 12015 1 1 34 GLY CA C 0.168 -0.326 7.112 1.00 . A A . 34 GLY CA 1 1 19 12016 1 1 34 GLY H H 1.111 0.375 5.347 1.00 . A A . 34 GLY H 1 1 19 12017 1 1 34 GLY HA2 H 0.863 -0.781 7.803 1.00 . A A . 34 GLY HA2 1 1 19 12018 1 1 34 GLY HA3 H -0.255 -1.097 6.486 1.00 . A A . 34 GLY HA3 1 1 19 12019 1 1 34 GLY N N 0.890 0.617 6.273 1.00 . A A . 34 GLY N 1 1 19 12020 1 1 34 GLY O O -1.285 -0.116 9.002 1.00 . A A . 34 GLY O 1 1 19 12021 1 1 35 ARG C C -3.881 2.101 7.178 1.00 . A A . 35 ARG C 1 1 19 12022 1 1 35 ARG CA C -2.602 2.112 8.012 1.00 . A A . 35 ARG CA 1 1 19 12023 1 1 35 ARG CB C -2.178 3.554 8.292 1.00 . A A . 35 ARG CB 1 1 19 12024 1 1 35 ARG CD C -0.569 5.045 9.518 1.00 . A A . 35 ARG CD 1 1 19 12025 1 1 35 ARG CG C -1.272 3.697 9.504 1.00 . A A . 35 ARG CG 1 1 19 12026 1 1 35 ARG CZ C -0.900 7.288 10.483 1.00 . A A . 35 ARG CZ 1 1 19 12027 1 1 35 ARG H H -1.208 1.700 6.472 1.00 . A A . 35 ARG H 1 1 19 12028 1 1 35 ARG HA H -2.798 1.618 8.951 1.00 . A A . 35 ARG HA 1 1 19 12029 1 1 35 ARG HB2 H -1.653 3.937 7.430 1.00 . A A . 35 ARG HB2 1 1 19 12030 1 1 35 ARG HB3 H -3.063 4.151 8.458 1.00 . A A . 35 ARG HB3 1 1 19 12031 1 1 35 ARG HD2 H 0.388 4.933 10.005 1.00 . A A . 35 ARG HD2 1 1 19 12032 1 1 35 ARG HD3 H -0.417 5.368 8.498 1.00 . A A . 35 ARG HD3 1 1 19 12033 1 1 35 ARG HE H -2.245 5.814 10.526 1.00 . A A . 35 ARG HE 1 1 19 12034 1 1 35 ARG HG2 H -1.868 3.605 10.400 1.00 . A A . 35 ARG HG2 1 1 19 12035 1 1 35 ARG HG3 H -0.529 2.914 9.480 1.00 . A A . 35 ARG HG3 1 1 19 12036 1 1 35 ARG HH11 H 0.900 7.012 9.602 1.00 . A A . 35 ARG HH11 1 1 19 12037 1 1 35 ARG HH12 H 0.643 8.581 10.288 1.00 . A A . 35 ARG HH12 1 1 19 12038 1 1 35 ARG HH21 H -2.585 7.877 11.430 1.00 . A A . 35 ARG HH21 1 1 19 12039 1 1 35 ARG HH22 H -1.336 9.072 11.326 1.00 . A A . 35 ARG HH22 1 1 19 12040 1 1 35 ARG N N -1.523 1.390 7.346 1.00 . A A . 35 ARG N 1 1 19 12041 1 1 35 ARG NE N -1.345 6.060 10.226 1.00 . A A . 35 ARG NE 1 1 19 12042 1 1 35 ARG NH1 N 0.314 7.657 10.092 1.00 . A A . 35 ARG NH1 1 1 19 12043 1 1 35 ARG NH2 N -1.670 8.150 11.133 1.00 . A A . 35 ARG NH2 1 1 19 12044 1 1 35 ARG O O -4.983 2.171 7.723 1.00 . A A . 35 ARG O 1 1 19 12045 1 1 36 SER C C -4.527 1.499 3.582 1.00 . A A . 36 SER C 1 1 19 12046 1 1 36 SER CA C -4.895 2.009 4.971 1.00 . A A . 36 SER CA 1 1 19 12047 1 1 36 SER CB C -5.494 3.412 4.866 1.00 . A A . 36 SER CB 1 1 19 12048 1 1 36 SER H H -2.835 1.970 5.473 1.00 . A A . 36 SER H 1 1 19 12049 1 1 36 SER HA H -5.632 1.346 5.398 1.00 . A A . 36 SER HA 1 1 19 12050 1 1 36 SER HB2 H -5.835 3.729 5.840 1.00 . A A . 36 SER HB2 1 1 19 12051 1 1 36 SER HB3 H -4.739 4.097 4.508 1.00 . A A . 36 SER HB3 1 1 19 12052 1 1 36 SER HG H -6.428 4.078 3.278 1.00 . A A . 36 SER HG 1 1 19 12053 1 1 36 SER N N -3.736 2.020 5.858 1.00 . A A . 36 SER N 1 1 19 12054 1 1 36 SER O O -3.359 1.242 3.291 1.00 . A A . 36 SER O 1 1 19 12055 1 1 36 SER OG O -6.591 3.433 3.970 1.00 . A A . 36 SER OG 1 1 19 12056 1 1 37 CYS C C -4.862 1.999 0.445 1.00 . A A . 37 CYS C 1 1 19 12057 1 1 37 CYS CA C -5.338 0.876 1.367 1.00 . A A . 37 CYS CA 1 1 19 12058 1 1 37 CYS CB C -6.636 0.279 0.822 1.00 . A A . 37 CYS CB 1 1 19 12059 1 1 37 CYS H H -6.444 1.578 3.030 1.00 . A A . 37 CYS H 1 1 19 12060 1 1 37 CYS HA H -4.583 0.106 1.395 1.00 . A A . 37 CYS HA 1 1 19 12061 1 1 37 CYS HB2 H -7.467 0.885 1.149 1.00 . A A . 37 CYS HB2 1 1 19 12062 1 1 37 CYS HB3 H -6.598 0.282 -0.257 1.00 . A A . 37 CYS HB3 1 1 19 12063 1 1 37 CYS N N -5.538 1.355 2.731 1.00 . A A . 37 CYS N 1 1 19 12064 1 1 37 CYS O O -4.548 1.760 -0.721 1.00 . A A . 37 CYS O 1 1 19 12065 1 1 37 CYS SG S -6.955 -1.431 1.362 1.00 . A A . 37 CYS SG 1 1 19 12066 1 1 38 GLU C C -2.857 4.471 0.158 1.00 . A A . 38 GLU C 1 1 19 12067 1 1 38 GLU CA C -4.379 4.369 0.179 1.00 . A A . 38 GLU CA 1 1 19 12068 1 1 38 GLU CB C -4.980 5.658 0.742 1.00 . A A . 38 GLU CB 1 1 19 12069 1 1 38 GLU CD C -3.528 7.723 0.634 1.00 . A A . 38 GLU CD 1 1 19 12070 1 1 38 GLU CG C -4.604 6.901 -0.049 1.00 . A A . 38 GLU CG 1 1 19 12071 1 1 38 GLU H H -5.079 3.356 1.900 1.00 . A A . 38 GLU H 1 1 19 12072 1 1 38 GLU HA H -4.732 4.230 -0.832 1.00 . A A . 38 GLU HA 1 1 19 12073 1 1 38 GLU HB2 H -6.056 5.570 0.742 1.00 . A A . 38 GLU HB2 1 1 19 12074 1 1 38 GLU HB3 H -4.638 5.787 1.758 1.00 . A A . 38 GLU HB3 1 1 19 12075 1 1 38 GLU HG2 H -4.242 6.598 -1.020 1.00 . A A . 38 GLU HG2 1 1 19 12076 1 1 38 GLU HG3 H -5.484 7.515 -0.169 1.00 . A A . 38 GLU HG3 1 1 19 12077 1 1 38 GLU N N -4.814 3.222 0.967 1.00 . A A . 38 GLU N 1 1 19 12078 1 1 38 GLU O O -2.219 4.590 1.204 1.00 . A A . 38 GLU O 1 1 19 12079 1 1 38 GLU OE1 O -2.625 7.122 1.253 1.00 . A A . 38 GLU OE1 1 1 19 12080 1 1 38 GLU OE2 O -3.588 8.967 0.548 1.00 . A A . 38 GLU OE2 1 1 19 12081 1 1 39 CYS C C -0.379 5.971 -1.228 1.00 . A A . 39 CYS C 1 1 19 12082 1 1 39 CYS CA C -0.833 4.513 -1.193 1.00 . A A . 39 CYS CA 1 1 19 12083 1 1 39 CYS CB C -0.388 3.795 -2.470 1.00 . A A . 39 CYS CB 1 1 19 12084 1 1 39 CYS H H -2.842 4.329 -1.837 1.00 . A A . 39 CYS H 1 1 19 12085 1 1 39 CYS HA H -0.381 4.027 -0.342 1.00 . A A . 39 CYS HA 1 1 19 12086 1 1 39 CYS HB2 H -1.059 4.052 -3.275 1.00 . A A . 39 CYS HB2 1 1 19 12087 1 1 39 CYS HB3 H 0.612 4.116 -2.725 1.00 . A A . 39 CYS HB3 1 1 19 12088 1 1 39 CYS N N -2.281 4.424 -1.039 1.00 . A A . 39 CYS N 1 1 19 12089 1 1 39 CYS O O -1.057 6.826 -1.798 1.00 . A A . 39 CYS O 1 1 19 12090 1 1 39 CYS SG S -0.363 1.982 -2.330 1.00 . A A . 39 CYS SG 1 1 19 12091 1 1 40 PRO C C 1.832 8.096 -1.939 1.00 . A A . 40 PRO C 1 1 19 12092 1 1 40 PRO CA C 1.316 7.641 -0.579 1.00 . A A . 40 PRO CA 1 1 19 12093 1 1 40 PRO CB C 2.466 7.543 0.424 1.00 . A A . 40 PRO CB 1 1 19 12094 1 1 40 PRO CD C 1.652 5.320 0.092 1.00 . A A . 40 PRO CD 1 1 19 12095 1 1 40 PRO CG C 2.897 6.118 0.367 1.00 . A A . 40 PRO CG 1 1 19 12096 1 1 40 PRO HA H 0.580 8.346 -0.220 1.00 . A A . 40 PRO HA 1 1 19 12097 1 1 40 PRO HB2 H 3.263 8.210 0.129 1.00 . A A . 40 PRO HB2 1 1 19 12098 1 1 40 PRO HB3 H 2.113 7.808 1.410 1.00 . A A . 40 PRO HB3 1 1 19 12099 1 1 40 PRO HD2 H 1.880 4.470 -0.535 1.00 . A A . 40 PRO HD2 1 1 19 12100 1 1 40 PRO HD3 H 1.199 4.996 1.018 1.00 . A A . 40 PRO HD3 1 1 19 12101 1 1 40 PRO HG2 H 3.612 5.983 -0.431 1.00 . A A . 40 PRO HG2 1 1 19 12102 1 1 40 PRO HG3 H 3.328 5.826 1.313 1.00 . A A . 40 PRO HG3 1 1 19 12103 1 1 40 PRO N N 0.778 6.277 -0.614 1.00 . A A . 40 PRO N 1 1 19 12104 1 1 40 PRO O O 1.905 7.308 -2.882 1.00 . A A . 40 PRO O 1 1 19 12105 1 1 41 SER C C 4.221 10.074 -3.231 1.00 . A A . 41 SER C 1 1 19 12106 1 1 41 SER CA C 2.702 9.933 -3.278 1.00 . A A . 41 SER CA 1 1 19 12107 1 1 41 SER CB C 2.060 11.294 -3.551 1.00 . A A . 41 SER CB 1 1 19 12108 1 1 41 SER H H 2.110 9.951 -1.246 1.00 . A A . 41 SER H 1 1 19 12109 1 1 41 SER HA H 2.441 9.256 -4.078 1.00 . A A . 41 SER HA 1 1 19 12110 1 1 41 SER HB2 H 2.703 12.075 -3.174 1.00 . A A . 41 SER HB2 1 1 19 12111 1 1 41 SER HB3 H 1.926 11.420 -4.615 1.00 . A A . 41 SER HB3 1 1 19 12112 1 1 41 SER HG H 0.162 10.843 -3.373 1.00 . A A . 41 SER HG 1 1 19 12113 1 1 41 SER N N 2.191 9.372 -2.033 1.00 . A A . 41 SER N 1 1 19 12114 1 1 41 SER O O 4.794 10.935 -3.898 1.00 . A A . 41 SER O 1 1 19 12115 1 1 41 SER OG O 0.797 11.399 -2.916 1.00 . A A . 41 SER OG 1 1 19 12116 1 1 42 TYR C C 6.856 7.874 -1.929 1.00 . A A . 42 TYR C 1 1 19 12117 1 1 42 TYR CA C 6.318 9.254 -2.308 1.00 . A A . 42 TYR CA 1 1 19 12118 1 1 42 TYR CB C 6.737 10.288 -1.259 1.00 . A A . 42 TYR CB 1 1 19 12119 1 1 42 TYR CD1 C 7.123 8.962 0.854 1.00 . A A . 42 TYR CD1 1 1 19 12120 1 1 42 TYR CD2 C 5.283 10.478 0.798 1.00 . A A . 42 TYR CD2 1 1 19 12121 1 1 42 TYR CE1 C 6.796 8.606 2.148 1.00 . A A . 42 TYR CE1 1 1 19 12122 1 1 42 TYR CE2 C 4.950 10.127 2.093 1.00 . A A . 42 TYR CE2 1 1 19 12123 1 1 42 TYR CG C 6.374 9.902 0.158 1.00 . A A . 42 TYR CG 1 1 19 12124 1 1 42 TYR CZ C 5.709 9.191 2.763 1.00 . A A . 42 TYR CZ 1 1 19 12125 1 1 42 TYR H H 4.355 8.559 -1.933 1.00 . A A . 42 TYR H 1 1 19 12126 1 1 42 TYR HA H 6.729 9.538 -3.265 1.00 . A A . 42 TYR HA 1 1 19 12127 1 1 42 TYR HB2 H 7.807 10.420 -1.302 1.00 . A A . 42 TYR HB2 1 1 19 12128 1 1 42 TYR HB3 H 6.255 11.229 -1.481 1.00 . A A . 42 TYR HB3 1 1 19 12129 1 1 42 TYR HD1 H 7.974 8.506 0.370 1.00 . A A . 42 TYR HD1 1 1 19 12130 1 1 42 TYR HD2 H 4.691 11.210 0.270 1.00 . A A . 42 TYR HD2 1 1 19 12131 1 1 42 TYR HE1 H 7.391 7.873 2.673 1.00 . A A . 42 TYR HE1 1 1 19 12132 1 1 42 TYR HE2 H 4.099 10.586 2.574 1.00 . A A . 42 TYR HE2 1 1 19 12133 1 1 42 TYR HH H 5.556 9.577 4.640 1.00 . A A . 42 TYR HH 1 1 19 12134 1 1 42 TYR N N 4.866 9.224 -2.439 1.00 . A A . 42 TYR N 1 1 19 12135 1 1 42 TYR O O 6.240 7.155 -1.143 1.00 . A A . 42 TYR O 1 1 19 12136 1 1 42 TYR OH O 5.380 8.840 4.052 1.00 . A A . 42 TYR OH 1 1 19 12137 1 1 43 PRO C C 9.096 6.061 -0.751 1.00 . A A . 43 PRO C 1 1 19 12138 1 1 43 PRO CA C 8.626 6.182 -2.202 1.00 . A A . 43 PRO CA 1 1 19 12139 1 1 43 PRO CB C 9.807 6.114 -3.178 1.00 . A A . 43 PRO CB 1 1 19 12140 1 1 43 PRO CD C 8.817 8.277 -3.439 1.00 . A A . 43 PRO CD 1 1 19 12141 1 1 43 PRO CG C 10.122 7.535 -3.500 1.00 . A A . 43 PRO CG 1 1 19 12142 1 1 43 PRO HA H 7.940 5.377 -2.414 1.00 . A A . 43 PRO HA 1 1 19 12143 1 1 43 PRO HB2 H 10.642 5.622 -2.703 1.00 . A A . 43 PRO HB2 1 1 19 12144 1 1 43 PRO HB3 H 9.514 5.567 -4.061 1.00 . A A . 43 PRO HB3 1 1 19 12145 1 1 43 PRO HD2 H 8.970 9.280 -3.071 1.00 . A A . 43 PRO HD2 1 1 19 12146 1 1 43 PRO HD3 H 8.348 8.297 -4.411 1.00 . A A . 43 PRO HD3 1 1 19 12147 1 1 43 PRO HG2 H 10.814 7.933 -2.774 1.00 . A A . 43 PRO HG2 1 1 19 12148 1 1 43 PRO HG3 H 10.542 7.600 -4.493 1.00 . A A . 43 PRO HG3 1 1 19 12149 1 1 43 PRO N N 8.016 7.484 -2.487 1.00 . A A . 43 PRO N 1 1 19 12150 1 1 43 PRO O O 8.360 5.569 0.105 1.00 . A A . 43 PRO O 1 1 19 12151 1 1 44 GLY C C 11.612 7.681 1.268 1.00 . A A . 44 GLY C 1 1 19 12152 1 1 44 GLY CA C 10.847 6.433 0.875 1.00 . A A . 44 GLY CA 1 1 19 12153 1 1 44 GLY H H 10.865 6.890 -1.189 1.00 . A A . 44 GLY H 1 1 19 12154 1 1 44 GLY HA2 H 11.508 5.582 0.944 1.00 . A A . 44 GLY HA2 1 1 19 12155 1 1 44 GLY HA3 H 10.026 6.295 1.563 1.00 . A A . 44 GLY HA3 1 1 19 12156 1 1 44 GLY N N 10.319 6.508 -0.475 1.00 . A A . 44 GLY N 1 1 19 12157 1 1 44 GLY O O 11.041 8.769 1.342 1.00 . A A . 44 GLY O 1 1 19 12158 1 1 45 ASN C C 13.318 9.221 3.254 1.00 . A A . 45 ASN C 1 1 19 12159 1 1 45 ASN CA C 13.757 8.645 1.910 1.00 . A A . 45 ASN CA 1 1 19 12160 1 1 45 ASN CB C 13.726 9.735 0.835 1.00 . A A . 45 ASN CB 1 1 19 12161 1 1 45 ASN CG C 14.874 9.611 -0.146 1.00 . A A . 45 ASN CG 1 1 19 12162 1 1 45 ASN H H 13.303 6.630 1.444 1.00 . A A . 45 ASN H 1 1 19 12163 1 1 45 ASN HA H 14.767 8.276 2.005 1.00 . A A . 45 ASN HA 1 1 19 12164 1 1 45 ASN HB2 H 12.799 9.665 0.286 1.00 . A A . 45 ASN HB2 1 1 19 12165 1 1 45 ASN HB3 H 13.785 10.703 1.311 1.00 . A A . 45 ASN HB3 1 1 19 12166 1 1 45 ASN HD21 H 13.632 8.960 -1.556 1.00 . A A . 45 ASN HD21 1 1 19 12167 1 1 45 ASN HD22 H 15.292 9.085 -2.018 1.00 . A A . 45 ASN HD22 1 1 19 12168 1 1 45 ASN N N 12.908 7.524 1.521 1.00 . A A . 45 ASN N 1 1 19 12169 1 1 45 ASN ND2 N 14.569 9.175 -1.363 1.00 . A A . 45 ASN ND2 1 1 19 12170 1 1 45 ASN O O 13.926 8.942 4.287 1.00 . A A . 45 ASN O 1 1 19 12171 1 1 45 ASN OD1 O 16.023 9.905 0.184 1.00 . A A . 45 ASN OD1 1 1 19 12172 1 1 46 GLY C C 10.785 9.729 5.187 1.00 . A A . 46 GLY C 1 1 19 12173 1 1 46 GLY CA C 11.762 10.628 4.455 1.00 . A A . 46 GLY CA 1 1 19 12174 1 1 46 GLY H H 11.816 10.214 2.379 1.00 . A A . 46 GLY H 1 1 19 12175 1 1 46 GLY HA2 H 11.266 11.556 4.211 1.00 . A A . 46 GLY HA2 1 1 19 12176 1 1 46 GLY HA3 H 12.597 10.839 5.106 1.00 . A A . 46 GLY HA3 1 1 19 12177 1 1 46 GLY N N 12.261 10.027 3.232 1.00 . A A . 46 GLY N 1 1 19 12178 1 1 46 GLY O O 10.599 8.574 4.749 1.00 . A A . 46 GLY O 1 1 19 12179 1 1 46 GLY OXT O 10.207 10.179 6.198 1.00 . A A . 46 GLY OXT 1 1 20 12180 1 1 1 ALA C C -16.908 -6.973 7.859 1.00 . A A . 1 ALA C 1 1 20 12181 1 1 1 ALA CA C -18.163 -6.924 8.723 1.00 . A A . 1 ALA CA 1 1 20 12182 1 1 1 ALA CB C -19.354 -7.477 7.956 1.00 . A A . 1 ALA CB 1 1 20 12183 1 1 1 ALA H1 H -18.381 -4.913 8.349 1.00 . A A . 1 ALA H1 1 1 20 12184 1 1 1 ALA H2 H -19.400 -5.523 9.584 1.00 . A A . 1 ALA H2 1 1 20 12185 1 1 1 ALA H3 H -17.728 -5.287 9.891 1.00 . A A . 1 ALA H3 1 1 20 12186 1 1 1 ALA HA H -18.010 -7.542 9.596 1.00 . A A . 1 ALA HA 1 1 20 12187 1 1 1 ALA HB1 H -19.700 -6.739 7.247 1.00 . A A . 1 ALA HB1 1 1 20 12188 1 1 1 ALA HB2 H -19.058 -8.372 7.428 1.00 . A A . 1 ALA HB2 1 1 20 12189 1 1 1 ALA HB3 H -20.150 -7.714 8.647 1.00 . A A . 1 ALA HB3 1 1 20 12190 1 1 1 ALA N N -18.444 -5.537 9.178 1.00 . A A . 1 ALA N 1 1 20 12191 1 1 1 ALA O O -15.892 -7.543 8.256 1.00 . A A . 1 ALA O 1 1 20 12192 1 1 2 MET C C -15.242 -4.953 5.685 1.00 . A A . 2 MET C 1 1 20 12193 1 1 2 MET CA C -15.856 -6.348 5.755 1.00 . A A . 2 MET CA 1 1 20 12194 1 1 2 MET CB C -16.298 -6.794 4.360 1.00 . A A . 2 MET CB 1 1 20 12195 1 1 2 MET CE C -19.474 -7.342 3.186 1.00 . A A . 2 MET CE 1 1 20 12196 1 1 2 MET CG C -17.080 -8.098 4.358 1.00 . A A . 2 MET CG 1 1 20 12197 1 1 2 MET H H -17.824 -5.935 6.417 1.00 . A A . 2 MET H 1 1 20 12198 1 1 2 MET HA H -15.112 -7.037 6.125 1.00 . A A . 2 MET HA 1 1 20 12199 1 1 2 MET HB2 H -16.921 -6.025 3.930 1.00 . A A . 2 MET HB2 1 1 20 12200 1 1 2 MET HB3 H -15.422 -6.924 3.742 1.00 . A A . 2 MET HB3 1 1 20 12201 1 1 2 MET HE1 H -18.663 -7.218 2.484 1.00 . A A . 2 MET HE1 1 1 20 12202 1 1 2 MET HE2 H -20.160 -8.090 2.815 1.00 . A A . 2 MET HE2 1 1 20 12203 1 1 2 MET HE3 H -19.995 -6.403 3.304 1.00 . A A . 2 MET HE3 1 1 20 12204 1 1 2 MET HG2 H -17.013 -8.540 3.376 1.00 . A A . 2 MET HG2 1 1 20 12205 1 1 2 MET HG3 H -16.640 -8.767 5.083 1.00 . A A . 2 MET HG3 1 1 20 12206 1 1 2 MET N N -16.986 -6.372 6.676 1.00 . A A . 2 MET N 1 1 20 12207 1 1 2 MET O O -15.814 -4.042 5.087 1.00 . A A . 2 MET O 1 1 20 12208 1 1 2 MET SD S -18.820 -7.864 4.769 1.00 . A A . 2 MET SD 1 1 20 12209 1 1 3 ASP C C -12.231 -3.508 5.304 1.00 . A A . 3 ASP C 1 1 20 12210 1 1 3 ASP CA C -13.382 -3.511 6.305 1.00 . A A . 3 ASP CA 1 1 20 12211 1 1 3 ASP CB C -12.857 -3.198 7.708 1.00 . A A . 3 ASP CB 1 1 20 12212 1 1 3 ASP CG C -12.520 -1.731 7.885 1.00 . A A . 3 ASP CG 1 1 20 12213 1 1 3 ASP H H -13.668 -5.559 6.758 1.00 . A A . 3 ASP H 1 1 20 12214 1 1 3 ASP HA H -14.093 -2.751 6.019 1.00 . A A . 3 ASP HA 1 1 20 12215 1 1 3 ASP HB2 H -13.609 -3.466 8.435 1.00 . A A . 3 ASP HB2 1 1 20 12216 1 1 3 ASP HB3 H -11.965 -3.779 7.889 1.00 . A A . 3 ASP HB3 1 1 20 12217 1 1 3 ASP N N -14.074 -4.795 6.299 1.00 . A A . 3 ASP N 1 1 20 12218 1 1 3 ASP O O -11.133 -3.038 5.604 1.00 . A A . 3 ASP O 1 1 20 12219 1 1 3 ASP OD1 O -11.369 -1.428 8.262 1.00 . A A . 3 ASP OD1 1 1 20 12220 1 1 3 ASP OD2 O -13.407 -0.885 7.647 1.00 . A A . 3 ASP OD2 1 1 20 12221 1 1 4 CYS C C -11.462 -2.804 2.249 1.00 . A A . 4 CYS C 1 1 20 12222 1 1 4 CYS CA C -11.478 -4.093 3.065 1.00 . A A . 4 CYS CA 1 1 20 12223 1 1 4 CYS CB C -11.734 -5.287 2.144 1.00 . A A . 4 CYS CB 1 1 20 12224 1 1 4 CYS H H -13.385 -4.392 3.932 1.00 . A A . 4 CYS H 1 1 20 12225 1 1 4 CYS HA H -10.516 -4.217 3.540 1.00 . A A . 4 CYS HA 1 1 20 12226 1 1 4 CYS HB2 H -12.573 -5.063 1.503 1.00 . A A . 4 CYS HB2 1 1 20 12227 1 1 4 CYS HB3 H -10.858 -5.456 1.535 1.00 . A A . 4 CYS HB3 1 1 20 12228 1 1 4 CYS N N -12.491 -4.035 4.112 1.00 . A A . 4 CYS N 1 1 20 12229 1 1 4 CYS O O -12.259 -1.896 2.488 1.00 . A A . 4 CYS O 1 1 20 12230 1 1 4 CYS SG S -12.107 -6.838 3.023 1.00 . A A . 4 CYS SG 1 1 20 12231 1 1 5 THR C C -9.588 -1.886 -0.805 1.00 . A A . 5 THR C 1 1 20 12232 1 1 5 THR CA C -10.427 -1.561 0.428 1.00 . A A . 5 THR CA 1 1 20 12233 1 1 5 THR CB C -9.797 -0.401 1.203 1.00 . A A . 5 THR CB 1 1 20 12234 1 1 5 THR CG2 C -9.642 0.858 0.377 1.00 . A A . 5 THR CG2 1 1 20 12235 1 1 5 THR H H -9.947 -3.493 1.145 1.00 . A A . 5 THR H 1 1 20 12236 1 1 5 THR HA H -11.418 -1.275 0.110 1.00 . A A . 5 THR HA 1 1 20 12237 1 1 5 THR HB H -8.814 -0.699 1.539 1.00 . A A . 5 THR HB 1 1 20 12238 1 1 5 THR HG1 H -11.430 0.260 2.057 1.00 . A A . 5 THR HG1 1 1 20 12239 1 1 5 THR HG21 H -10.536 1.017 -0.208 1.00 . A A . 5 THR HG21 1 1 20 12240 1 1 5 THR HG22 H -9.486 1.702 1.032 1.00 . A A . 5 THR HG22 1 1 20 12241 1 1 5 THR HG23 H -8.794 0.753 -0.284 1.00 . A A . 5 THR HG23 1 1 20 12242 1 1 5 THR N N -10.551 -2.734 1.285 1.00 . A A . 5 THR N 1 1 20 12243 1 1 5 THR O O -8.465 -1.403 -0.949 1.00 . A A . 5 THR O 1 1 20 12244 1 1 5 THR OG1 O -10.576 -0.075 2.340 1.00 . A A . 5 THR OG1 1 1 20 12245 1 1 6 THR C C -8.739 -1.946 -3.572 1.00 . A A . 6 THR C 1 1 20 12246 1 1 6 THR CA C -9.453 -3.122 -2.911 1.00 . A A . 6 THR CA 1 1 20 12247 1 1 6 THR CB C -10.444 -3.749 -3.892 1.00 . A A . 6 THR CB 1 1 20 12248 1 1 6 THR CG2 C -10.648 -5.232 -3.669 1.00 . A A . 6 THR CG2 1 1 20 12249 1 1 6 THR H H -11.039 -3.068 -1.508 1.00 . A A . 6 THR H 1 1 20 12250 1 1 6 THR HA H -8.716 -3.864 -2.640 1.00 . A A . 6 THR HA 1 1 20 12251 1 1 6 THR HB H -10.073 -3.613 -4.898 1.00 . A A . 6 THR HB 1 1 20 12252 1 1 6 THR HG1 H -12.101 -3.053 -4.670 1.00 . A A . 6 THR HG1 1 1 20 12253 1 1 6 THR HG21 H -10.040 -5.559 -2.838 1.00 . A A . 6 THR HG21 1 1 20 12254 1 1 6 THR HG22 H -11.689 -5.423 -3.451 1.00 . A A . 6 THR HG22 1 1 20 12255 1 1 6 THR HG23 H -10.362 -5.773 -4.559 1.00 . A A . 6 THR HG23 1 1 20 12256 1 1 6 THR N N -10.143 -2.715 -1.687 1.00 . A A . 6 THR N 1 1 20 12257 1 1 6 THR O O -9.376 -1.056 -4.136 1.00 . A A . 6 THR O 1 1 20 12258 1 1 6 THR OG1 O -11.710 -3.121 -3.796 1.00 . A A . 6 THR OG1 1 1 20 12259 1 1 7 GLY C C -5.224 -1.337 -4.453 1.00 . A A . 7 GLY C 1 1 20 12260 1 1 7 GLY CA C -6.627 -0.887 -4.088 1.00 . A A . 7 GLY CA 1 1 20 12261 1 1 7 GLY H H -6.963 -2.690 -3.034 1.00 . A A . 7 GLY H 1 1 20 12262 1 1 7 GLY HA2 H -6.560 -0.070 -3.385 1.00 . A A . 7 GLY HA2 1 1 20 12263 1 1 7 GLY HA3 H -7.126 -0.540 -4.981 1.00 . A A . 7 GLY HA3 1 1 20 12264 1 1 7 GLY N N -7.413 -1.953 -3.497 1.00 . A A . 7 GLY N 1 1 20 12265 1 1 7 GLY O O -4.991 -2.525 -4.677 1.00 . A A . 7 GLY O 1 1 20 12266 1 1 8 PRO C C -2.103 -1.344 -3.706 1.00 . A A . 8 PRO C 1 1 20 12267 1 1 8 PRO CA C -2.874 -0.722 -4.869 1.00 . A A . 8 PRO CA 1 1 20 12268 1 1 8 PRO CB C -2.289 0.642 -5.232 1.00 . A A . 8 PRO CB 1 1 20 12269 1 1 8 PRO CD C -4.450 1.041 -4.277 1.00 . A A . 8 PRO CD 1 1 20 12270 1 1 8 PRO CG C -3.060 1.608 -4.401 1.00 . A A . 8 PRO CG 1 1 20 12271 1 1 8 PRO HA H -2.821 -1.378 -5.726 1.00 . A A . 8 PRO HA 1 1 20 12272 1 1 8 PRO HB2 H -1.236 0.661 -4.992 1.00 . A A . 8 PRO HB2 1 1 20 12273 1 1 8 PRO HB3 H -2.429 0.830 -6.286 1.00 . A A . 8 PRO HB3 1 1 20 12274 1 1 8 PRO HD2 H -4.841 1.214 -3.286 1.00 . A A . 8 PRO HD2 1 1 20 12275 1 1 8 PRO HD3 H -5.101 1.475 -5.021 1.00 . A A . 8 PRO HD3 1 1 20 12276 1 1 8 PRO HG2 H -2.604 1.697 -3.425 1.00 . A A . 8 PRO HG2 1 1 20 12277 1 1 8 PRO HG3 H -3.090 2.571 -4.890 1.00 . A A . 8 PRO HG3 1 1 20 12278 1 1 8 PRO N N -4.261 -0.403 -4.523 1.00 . A A . 8 PRO N 1 1 20 12279 1 1 8 PRO O O -1.075 -1.990 -3.909 1.00 . A A . 8 PRO O 1 1 20 12280 1 1 9 CYS C C -2.947 -2.383 -0.380 1.00 . A A . 9 CYS C 1 1 20 12281 1 1 9 CYS CA C -1.945 -1.691 -1.300 1.00 . A A . 9 CYS CA 1 1 20 12282 1 1 9 CYS CB C -1.219 -0.583 -0.534 1.00 . A A . 9 CYS CB 1 1 20 12283 1 1 9 CYS H H -3.421 -0.622 -2.381 1.00 . A A . 9 CYS H 1 1 20 12284 1 1 9 CYS HA H -1.219 -2.419 -1.630 1.00 . A A . 9 CYS HA 1 1 20 12285 1 1 9 CYS HB2 H -0.513 -0.102 -1.193 1.00 . A A . 9 CYS HB2 1 1 20 12286 1 1 9 CYS HB3 H -1.943 0.145 -0.197 1.00 . A A . 9 CYS HB3 1 1 20 12287 1 1 9 CYS N N -2.600 -1.146 -2.486 1.00 . A A . 9 CYS N 1 1 20 12288 1 1 9 CYS O O -3.051 -2.053 0.799 1.00 . A A . 9 CYS O 1 1 20 12289 1 1 9 CYS SG S -0.300 -1.170 0.927 1.00 . A A . 9 CYS SG 1 1 20 12290 1 1 10 CYS C C -4.376 -5.586 -0.189 1.00 . A A . 10 CYS C 1 1 20 12291 1 1 10 CYS CA C -4.667 -4.089 -0.149 1.00 . A A . 10 CYS CA 1 1 20 12292 1 1 10 CYS CB C -6.074 -3.816 -0.682 1.00 . A A . 10 CYS CB 1 1 20 12293 1 1 10 CYS H H -3.551 -3.570 -1.865 1.00 . A A . 10 CYS H 1 1 20 12294 1 1 10 CYS HA H -4.609 -3.751 0.874 1.00 . A A . 10 CYS HA 1 1 20 12295 1 1 10 CYS HB2 H -6.053 -2.925 -1.291 1.00 . A A . 10 CYS HB2 1 1 20 12296 1 1 10 CYS HB3 H -6.390 -4.652 -1.288 1.00 . A A . 10 CYS HB3 1 1 20 12297 1 1 10 CYS N N -3.679 -3.348 -0.923 1.00 . A A . 10 CYS N 1 1 20 12298 1 1 10 CYS O O -4.749 -6.275 -1.139 1.00 . A A . 10 CYS O 1 1 20 12299 1 1 10 CYS SG S -7.326 -3.568 0.617 1.00 . A A . 10 CYS SG 1 1 20 12300 1 1 11 ARG C C -4.620 -8.362 0.924 1.00 . A A . 11 ARG C 1 1 20 12301 1 1 11 ARG CA C -3.364 -7.496 0.929 1.00 . A A . 11 ARG CA 1 1 20 12302 1 1 11 ARG CB C -2.546 -7.771 2.192 1.00 . A A . 11 ARG CB 1 1 20 12303 1 1 11 ARG CD C -0.535 -9.086 2.926 1.00 . A A . 11 ARG CD 1 1 20 12304 1 1 11 ARG CG C -1.865 -9.129 2.192 1.00 . A A . 11 ARG CG 1 1 20 12305 1 1 11 ARG CZ C -0.345 -11.288 4.015 1.00 . A A . 11 ARG CZ 1 1 20 12306 1 1 11 ARG H H -3.436 -5.480 1.572 1.00 . A A . 11 ARG H 1 1 20 12307 1 1 11 ARG HA H -2.768 -7.743 0.064 1.00 . A A . 11 ARG HA 1 1 20 12308 1 1 11 ARG HB2 H -1.785 -7.010 2.286 1.00 . A A . 11 ARG HB2 1 1 20 12309 1 1 11 ARG HB3 H -3.201 -7.720 3.049 1.00 . A A . 11 ARG HB3 1 1 20 12310 1 1 11 ARG HD2 H 0.152 -8.470 2.364 1.00 . A A . 11 ARG HD2 1 1 20 12311 1 1 11 ARG HD3 H -0.691 -8.650 3.902 1.00 . A A . 11 ARG HD3 1 1 20 12312 1 1 11 ARG HE H 0.764 -10.675 2.474 1.00 . A A . 11 ARG HE 1 1 20 12313 1 1 11 ARG HG2 H -2.510 -9.845 2.680 1.00 . A A . 11 ARG HG2 1 1 20 12314 1 1 11 ARG HG3 H -1.693 -9.435 1.170 1.00 . A A . 11 ARG HG3 1 1 20 12315 1 1 11 ARG HH11 H -1.758 -10.079 4.811 1.00 . A A . 11 ARG HH11 1 1 20 12316 1 1 11 ARG HH12 H -1.605 -11.633 5.558 1.00 . A A . 11 ARG HH12 1 1 20 12317 1 1 11 ARG HH21 H 0.967 -12.720 3.455 1.00 . A A . 11 ARG HH21 1 1 20 12318 1 1 11 ARG HH22 H -0.058 -13.133 4.789 1.00 . A A . 11 ARG HH22 1 1 20 12319 1 1 11 ARG N N -3.707 -6.081 0.846 1.00 . A A . 11 ARG N 1 1 20 12320 1 1 11 ARG NE N 0.045 -10.417 3.088 1.00 . A A . 11 ARG NE 1 1 20 12321 1 1 11 ARG NH1 N -1.316 -10.974 4.864 1.00 . A A . 11 ARG NH1 1 1 20 12322 1 1 11 ARG NH2 N 0.235 -12.478 4.093 1.00 . A A . 11 ARG NH2 1 1 20 12323 1 1 11 ARG O O -5.134 -8.732 1.980 1.00 . A A . 11 ARG O 1 1 20 12324 1 1 12 GLN C C -7.549 -8.754 0.028 1.00 . A A . 12 GLN C 1 1 20 12325 1 1 12 GLN CA C -6.303 -9.508 -0.420 1.00 . A A . 12 GLN CA 1 1 20 12326 1 1 12 GLN CB C -6.162 -10.806 0.382 1.00 . A A . 12 GLN CB 1 1 20 12327 1 1 12 GLN CD C -7.393 -12.940 0.940 1.00 . A A . 12 GLN CD 1 1 20 12328 1 1 12 GLN CG C -7.030 -11.940 -0.140 1.00 . A A . 12 GLN CG 1 1 20 12329 1 1 12 GLN H H -4.650 -8.358 -1.075 1.00 . A A . 12 GLN H 1 1 20 12330 1 1 12 GLN HA H -6.406 -9.753 -1.462 1.00 . A A . 12 GLN HA 1 1 20 12331 1 1 12 GLN HB2 H -5.131 -11.125 0.349 1.00 . A A . 12 GLN HB2 1 1 20 12332 1 1 12 GLN HB3 H -6.438 -10.613 1.408 1.00 . A A . 12 GLN HB3 1 1 20 12333 1 1 12 GLN HE21 H -7.175 -14.442 -0.344 1.00 . A A . 12 GLN HE21 1 1 20 12334 1 1 12 GLN HE22 H -7.632 -14.887 1.262 1.00 . A A . 12 GLN HE22 1 1 20 12335 1 1 12 GLN HG2 H -7.940 -11.523 -0.544 1.00 . A A . 12 GLN HG2 1 1 20 12336 1 1 12 GLN HG3 H -6.493 -12.455 -0.923 1.00 . A A . 12 GLN HG3 1 1 20 12337 1 1 12 GLN N N -5.107 -8.683 -0.271 1.00 . A A . 12 GLN N 1 1 20 12338 1 1 12 GLN NE2 N -7.401 -14.219 0.583 1.00 . A A . 12 GLN NE2 1 1 20 12339 1 1 12 GLN O O -8.434 -8.462 -0.776 1.00 . A A . 12 GLN O 1 1 20 12340 1 1 12 GLN OE1 O -7.663 -12.567 2.082 1.00 . A A . 12 GLN OE1 1 1 20 12341 1 1 13 CYS C C -8.320 -6.871 3.070 1.00 . A A . 13 CYS C 1 1 20 12342 1 1 13 CYS CA C -8.746 -7.727 1.879 1.00 . A A . 13 CYS CA 1 1 20 12343 1 1 13 CYS CB C -9.833 -8.715 2.308 1.00 . A A . 13 CYS CB 1 1 20 12344 1 1 13 CYS H H -6.873 -8.708 1.900 1.00 . A A . 13 CYS H 1 1 20 12345 1 1 13 CYS HA H -9.143 -7.081 1.111 1.00 . A A . 13 CYS HA 1 1 20 12346 1 1 13 CYS HB2 H -9.595 -9.692 1.915 1.00 . A A . 13 CYS HB2 1 1 20 12347 1 1 13 CYS HB3 H -9.862 -8.764 3.387 1.00 . A A . 13 CYS HB3 1 1 20 12348 1 1 13 CYS N N -7.610 -8.445 1.315 1.00 . A A . 13 CYS N 1 1 20 12349 1 1 13 CYS O O -9.147 -6.498 3.902 1.00 . A A . 13 CYS O 1 1 20 12350 1 1 13 CYS SG S -11.505 -8.281 1.728 1.00 . A A . 13 CYS SG 1 1 20 12351 1 1 14 LYS C C -5.219 -5.053 3.812 1.00 . A A . 14 LYS C 1 1 20 12352 1 1 14 LYS CA C -6.506 -5.746 4.238 1.00 . A A . 14 LYS CA 1 1 20 12353 1 1 14 LYS CB C -6.251 -6.611 5.474 1.00 . A A . 14 LYS CB 1 1 20 12354 1 1 14 LYS CD C -7.163 -7.518 7.632 1.00 . A A . 14 LYS CD 1 1 20 12355 1 1 14 LYS CE C -7.335 -9.028 7.596 1.00 . A A . 14 LYS CE 1 1 20 12356 1 1 14 LYS CG C -7.502 -6.887 6.292 1.00 . A A . 14 LYS CG 1 1 20 12357 1 1 14 LYS H H -6.410 -6.880 2.458 1.00 . A A . 14 LYS H 1 1 20 12358 1 1 14 LYS HA H -7.245 -4.996 4.478 1.00 . A A . 14 LYS HA 1 1 20 12359 1 1 14 LYS HB2 H -5.838 -7.558 5.157 1.00 . A A . 14 LYS HB2 1 1 20 12360 1 1 14 LYS HB3 H -5.535 -6.110 6.108 1.00 . A A . 14 LYS HB3 1 1 20 12361 1 1 14 LYS HD2 H -6.136 -7.289 7.878 1.00 . A A . 14 LYS HD2 1 1 20 12362 1 1 14 LYS HD3 H -7.816 -7.107 8.388 1.00 . A A . 14 LYS HD3 1 1 20 12363 1 1 14 LYS HE2 H -8.061 -9.277 6.837 1.00 . A A . 14 LYS HE2 1 1 20 12364 1 1 14 LYS HE3 H -6.386 -9.480 7.348 1.00 . A A . 14 LYS HE3 1 1 20 12365 1 1 14 LYS HG2 H -8.020 -5.955 6.465 1.00 . A A . 14 LYS HG2 1 1 20 12366 1 1 14 LYS HG3 H -8.141 -7.559 5.738 1.00 . A A . 14 LYS HG3 1 1 20 12367 1 1 14 LYS HZ1 H -8.651 -9.054 9.219 1.00 . A A . 14 LYS HZ1 1 1 20 12368 1 1 14 LYS HZ2 H -8.032 -10.575 8.815 1.00 . A A . 14 LYS HZ2 1 1 20 12369 1 1 14 LYS HZ3 H -7.057 -9.453 9.622 1.00 . A A . 14 LYS HZ3 1 1 20 12370 1 1 14 LYS N N -7.028 -6.559 3.149 1.00 . A A . 14 LYS N 1 1 20 12371 1 1 14 LYS NZ N -7.801 -9.565 8.905 1.00 . A A . 14 LYS NZ 1 1 20 12372 1 1 14 LYS O O -4.272 -5.704 3.370 1.00 . A A . 14 LYS O 1 1 20 12373 1 1 15 LEU C C -2.733 -3.609 4.033 1.00 . A A . 15 LEU C 1 1 20 12374 1 1 15 LEU CA C -4.021 -2.944 3.559 1.00 . A A . 15 LEU CA 1 1 20 12375 1 1 15 LEU CB C -4.104 -1.508 4.100 1.00 . A A . 15 LEU CB 1 1 20 12376 1 1 15 LEU CD1 C -6.301 -1.233 5.294 1.00 . A A . 15 LEU CD1 1 1 20 12377 1 1 15 LEU CD2 C -4.416 -2.436 6.428 1.00 . A A . 15 LEU CD2 1 1 20 12378 1 1 15 LEU CG C -4.792 -1.321 5.461 1.00 . A A . 15 LEU CG 1 1 20 12379 1 1 15 LEU H H -5.982 -3.271 4.289 1.00 . A A . 15 LEU H 1 1 20 12380 1 1 15 LEU HA H -4.002 -2.904 2.482 1.00 . A A . 15 LEU HA 1 1 20 12381 1 1 15 LEU HB2 H -3.097 -1.125 4.182 1.00 . A A . 15 LEU HB2 1 1 20 12382 1 1 15 LEU HB3 H -4.634 -0.911 3.374 1.00 . A A . 15 LEU HB3 1 1 20 12383 1 1 15 LEU HD11 H -6.543 -1.147 4.245 1.00 . A A . 15 LEU HD11 1 1 20 12384 1 1 15 LEU HD12 H -6.762 -2.123 5.697 1.00 . A A . 15 LEU HD12 1 1 20 12385 1 1 15 LEU HD13 H -6.671 -0.366 5.820 1.00 . A A . 15 LEU HD13 1 1 20 12386 1 1 15 LEU HD21 H -3.344 -2.464 6.545 1.00 . A A . 15 LEU HD21 1 1 20 12387 1 1 15 LEU HD22 H -4.877 -2.249 7.387 1.00 . A A . 15 LEU HD22 1 1 20 12388 1 1 15 LEU HD23 H -4.761 -3.383 6.043 1.00 . A A . 15 LEU HD23 1 1 20 12389 1 1 15 LEU HG H -4.457 -0.387 5.890 1.00 . A A . 15 LEU HG 1 1 20 12390 1 1 15 LEU N N -5.194 -3.729 3.939 1.00 . A A . 15 LEU N 1 1 20 12391 1 1 15 LEU O O -2.622 -4.028 5.185 1.00 . A A . 15 LEU O 1 1 20 12392 1 1 16 LYS C C 0.159 -3.656 4.662 1.00 . A A . 16 LYS C 1 1 20 12393 1 1 16 LYS CA C -0.487 -4.333 3.454 1.00 . A A . 16 LYS CA 1 1 20 12394 1 1 16 LYS CB C 0.457 -4.267 2.251 1.00 . A A . 16 LYS CB 1 1 20 12395 1 1 16 LYS CD C 0.819 -5.090 -0.095 1.00 . A A . 16 LYS CD 1 1 20 12396 1 1 16 LYS CE C 0.155 -5.760 -1.287 1.00 . A A . 16 LYS CE 1 1 20 12397 1 1 16 LYS CG C -0.205 -4.646 0.936 1.00 . A A . 16 LYS CG 1 1 20 12398 1 1 16 LYS H H -1.914 -3.366 2.226 1.00 . A A . 16 LYS H 1 1 20 12399 1 1 16 LYS HA H -0.679 -5.370 3.693 1.00 . A A . 16 LYS HA 1 1 20 12400 1 1 16 LYS HB2 H 0.836 -3.260 2.161 1.00 . A A . 16 LYS HB2 1 1 20 12401 1 1 16 LYS HB3 H 1.284 -4.940 2.419 1.00 . A A . 16 LYS HB3 1 1 20 12402 1 1 16 LYS HD2 H 1.366 -4.226 -0.440 1.00 . A A . 16 LYS HD2 1 1 20 12403 1 1 16 LYS HD3 H 1.501 -5.790 0.366 1.00 . A A . 16 LYS HD3 1 1 20 12404 1 1 16 LYS HE2 H -0.799 -6.159 -0.974 1.00 . A A . 16 LYS HE2 1 1 20 12405 1 1 16 LYS HE3 H -0.001 -5.020 -2.059 1.00 . A A . 16 LYS HE3 1 1 20 12406 1 1 16 LYS HG2 H -0.897 -5.456 1.113 1.00 . A A . 16 LYS HG2 1 1 20 12407 1 1 16 LYS HG3 H -0.741 -3.790 0.554 1.00 . A A . 16 LYS HG3 1 1 20 12408 1 1 16 LYS HZ1 H 1.962 -6.540 -1.987 1.00 . A A . 16 LYS HZ1 1 1 20 12409 1 1 16 LYS HZ2 H 0.999 -7.668 -1.174 1.00 . A A . 16 LYS HZ2 1 1 20 12410 1 1 16 LYS HZ3 H 0.595 -7.189 -2.745 1.00 . A A . 16 LYS HZ3 1 1 20 12411 1 1 16 LYS N N -1.764 -3.711 3.131 1.00 . A A . 16 LYS N 1 1 20 12412 1 1 16 LYS NZ N 0.986 -6.867 -1.837 1.00 . A A . 16 LYS NZ 1 1 20 12413 1 1 16 LYS O O -0.281 -2.590 5.094 1.00 . A A . 16 LYS O 1 1 20 12414 1 1 17 PRO C C 2.631 -2.411 6.075 1.00 . A A . 17 PRO C 1 1 20 12415 1 1 17 PRO CA C 1.916 -3.720 6.392 1.00 . A A . 17 PRO CA 1 1 20 12416 1 1 17 PRO CB C 2.939 -4.807 6.755 1.00 . A A . 17 PRO CB 1 1 20 12417 1 1 17 PRO CD C 1.801 -5.538 4.782 1.00 . A A . 17 PRO CD 1 1 20 12418 1 1 17 PRO CG C 2.510 -6.027 6.011 1.00 . A A . 17 PRO CG 1 1 20 12419 1 1 17 PRO HA H 1.242 -3.566 7.222 1.00 . A A . 17 PRO HA 1 1 20 12420 1 1 17 PRO HB2 H 3.926 -4.490 6.452 1.00 . A A . 17 PRO HB2 1 1 20 12421 1 1 17 PRO HB3 H 2.924 -4.973 7.822 1.00 . A A . 17 PRO HB3 1 1 20 12422 1 1 17 PRO HD2 H 2.504 -5.379 3.977 1.00 . A A . 17 PRO HD2 1 1 20 12423 1 1 17 PRO HD3 H 1.033 -6.236 4.484 1.00 . A A . 17 PRO HD3 1 1 20 12424 1 1 17 PRO HG2 H 3.375 -6.611 5.736 1.00 . A A . 17 PRO HG2 1 1 20 12425 1 1 17 PRO HG3 H 1.839 -6.613 6.622 1.00 . A A . 17 PRO HG3 1 1 20 12426 1 1 17 PRO N N 1.213 -4.268 5.227 1.00 . A A . 17 PRO N 1 1 20 12427 1 1 17 PRO O O 3.198 -2.249 4.994 1.00 . A A . 17 PRO O 1 1 20 12428 1 1 18 ALA C C 4.749 -0.369 6.572 1.00 . A A . 18 ALA C 1 1 20 12429 1 1 18 ALA CA C 3.260 -0.190 6.848 1.00 . A A . 18 ALA CA 1 1 20 12430 1 1 18 ALA CB C 3.049 0.682 8.076 1.00 . A A . 18 ALA CB 1 1 20 12431 1 1 18 ALA H H 2.143 -1.670 7.867 1.00 . A A . 18 ALA H 1 1 20 12432 1 1 18 ALA HA H 2.803 0.302 6.002 1.00 . A A . 18 ALA HA 1 1 20 12433 1 1 18 ALA HB1 H 3.879 0.554 8.755 1.00 . A A . 18 ALA HB1 1 1 20 12434 1 1 18 ALA HB2 H 2.133 0.394 8.570 1.00 . A A . 18 ALA HB2 1 1 20 12435 1 1 18 ALA HB3 H 2.986 1.718 7.776 1.00 . A A . 18 ALA HB3 1 1 20 12436 1 1 18 ALA N N 2.607 -1.481 7.026 1.00 . A A . 18 ALA N 1 1 20 12437 1 1 18 ALA O O 5.376 -1.297 7.083 1.00 . A A . 18 ALA O 1 1 20 12438 1 1 19 GLY C C 7.004 -0.672 4.422 1.00 . A A . 19 GLY C 1 1 20 12439 1 1 19 GLY CA C 6.717 0.429 5.425 1.00 . A A . 19 GLY CA 1 1 20 12440 1 1 19 GLY H H 4.760 1.233 5.373 1.00 . A A . 19 GLY H 1 1 20 12441 1 1 19 GLY HA2 H 7.278 0.235 6.327 1.00 . A A . 19 GLY HA2 1 1 20 12442 1 1 19 GLY HA3 H 7.038 1.373 5.009 1.00 . A A . 19 GLY HA3 1 1 20 12443 1 1 19 GLY N N 5.308 0.518 5.756 1.00 . A A . 19 GLY N 1 1 20 12444 1 1 19 GLY O O 8.143 -1.117 4.288 1.00 . A A . 19 GLY O 1 1 20 12445 1 1 20 THR C C 5.720 -1.653 1.337 1.00 . A A . 20 THR C 1 1 20 12446 1 1 20 THR CA C 6.107 -2.166 2.720 1.00 . A A . 20 THR CA 1 1 20 12447 1 1 20 THR CB C 5.237 -3.367 3.097 1.00 . A A . 20 THR CB 1 1 20 12448 1 1 20 THR CG2 C 5.315 -4.505 2.101 1.00 . A A . 20 THR CG2 1 1 20 12449 1 1 20 THR H H 5.081 -0.716 3.868 1.00 . A A . 20 THR H 1 1 20 12450 1 1 20 THR HA H 7.143 -2.471 2.703 1.00 . A A . 20 THR HA 1 1 20 12451 1 1 20 THR HB H 4.207 -3.048 3.154 1.00 . A A . 20 THR HB 1 1 20 12452 1 1 20 THR HG1 H 6.569 -3.970 4.401 1.00 . A A . 20 THR HG1 1 1 20 12453 1 1 20 THR HG21 H 5.695 -4.135 1.160 1.00 . A A . 20 THR HG21 1 1 20 12454 1 1 20 THR HG22 H 5.975 -5.271 2.480 1.00 . A A . 20 THR HG22 1 1 20 12455 1 1 20 THR HG23 H 4.329 -4.921 1.953 1.00 . A A . 20 THR HG23 1 1 20 12456 1 1 20 THR N N 5.965 -1.111 3.716 1.00 . A A . 20 THR N 1 1 20 12457 1 1 20 THR O O 4.615 -1.146 1.141 1.00 . A A . 20 THR O 1 1 20 12458 1 1 20 THR OG1 O 5.614 -3.880 4.363 1.00 . A A . 20 THR OG1 1 1 20 12459 1 1 21 THR C C 5.111 -1.971 -1.537 1.00 . A A . 21 THR C 1 1 20 12460 1 1 21 THR CA C 6.382 -1.334 -0.983 1.00 . A A . 21 THR CA 1 1 20 12461 1 1 21 THR CB C 7.573 -1.661 -1.887 1.00 . A A . 21 THR CB 1 1 20 12462 1 1 21 THR CG2 C 8.188 -0.433 -2.520 1.00 . A A . 21 THR CG2 1 1 20 12463 1 1 21 THR H H 7.497 -2.198 0.597 1.00 . A A . 21 THR H 1 1 20 12464 1 1 21 THR HA H 6.247 -0.263 -0.956 1.00 . A A . 21 THR HA 1 1 20 12465 1 1 21 THR HB H 7.244 -2.314 -2.683 1.00 . A A . 21 THR HB 1 1 20 12466 1 1 21 THR HG1 H 9.139 -2.832 -1.764 1.00 . A A . 21 THR HG1 1 1 20 12467 1 1 21 THR HG21 H 7.827 0.451 -2.013 1.00 . A A . 21 THR HG21 1 1 20 12468 1 1 21 THR HG22 H 9.263 -0.484 -2.435 1.00 . A A . 21 THR HG22 1 1 20 12469 1 1 21 THR HG23 H 7.910 -0.388 -3.563 1.00 . A A . 21 THR HG23 1 1 20 12470 1 1 21 THR N N 6.634 -1.786 0.381 1.00 . A A . 21 THR N 1 1 20 12471 1 1 21 THR O O 4.975 -3.194 -1.558 1.00 . A A . 21 THR O 1 1 20 12472 1 1 21 THR OG1 O 8.592 -2.326 -1.160 1.00 . A A . 21 THR OG1 1 1 20 12473 1 1 22 CYS C C 2.850 -1.416 -4.027 1.00 . A A . 22 CYS C 1 1 20 12474 1 1 22 CYS CA C 2.916 -1.610 -2.517 1.00 . A A . 22 CYS CA 1 1 20 12475 1 1 22 CYS CB C 1.749 -0.882 -1.850 1.00 . A A . 22 CYS CB 1 1 20 12476 1 1 22 CYS H H 4.344 -0.166 -1.924 1.00 . A A . 22 CYS H 1 1 20 12477 1 1 22 CYS HA H 2.840 -2.664 -2.298 1.00 . A A . 22 CYS HA 1 1 20 12478 1 1 22 CYS HB2 H 0.834 -1.139 -2.361 1.00 . A A . 22 CYS HB2 1 1 20 12479 1 1 22 CYS HB3 H 1.681 -1.198 -0.820 1.00 . A A . 22 CYS HB3 1 1 20 12480 1 1 22 CYS N N 4.180 -1.131 -1.974 1.00 . A A . 22 CYS N 1 1 20 12481 1 1 22 CYS O O 2.152 -2.152 -4.724 1.00 . A A . 22 CYS O 1 1 20 12482 1 1 22 CYS SG S 1.900 0.934 -1.865 1.00 . A A . 22 CYS SG 1 1 20 12483 1 1 23 TRP C C 4.854 -0.640 -6.622 1.00 . A A . 23 TRP C 1 1 20 12484 1 1 23 TRP CA C 3.578 -0.139 -5.959 1.00 . A A . 23 TRP CA 1 1 20 12485 1 1 23 TRP CB C 3.411 1.362 -6.210 1.00 . A A . 23 TRP CB 1 1 20 12486 1 1 23 TRP CD1 C 1.950 0.788 -8.235 1.00 . A A . 23 TRP CD1 1 1 20 12487 1 1 23 TRP CD2 C 1.959 2.958 -7.693 1.00 . A A . 23 TRP CD2 1 1 20 12488 1 1 23 TRP CE2 C 1.123 2.777 -8.811 1.00 . A A . 23 TRP CE2 1 1 20 12489 1 1 23 TRP CE3 C 2.121 4.245 -7.174 1.00 . A A . 23 TRP CE3 1 1 20 12490 1 1 23 TRP CG C 2.476 1.672 -7.338 1.00 . A A . 23 TRP CG 1 1 20 12491 1 1 23 TRP CH2 C 0.627 5.083 -8.887 1.00 . A A . 23 TRP CH2 1 1 20 12492 1 1 23 TRP CZ2 C 0.451 3.834 -9.416 1.00 . A A . 23 TRP CZ2 1 1 20 12493 1 1 23 TRP CZ3 C 1.454 5.294 -7.777 1.00 . A A . 23 TRP CZ3 1 1 20 12494 1 1 23 TRP H H 4.107 0.138 -3.927 1.00 . A A . 23 TRP H 1 1 20 12495 1 1 23 TRP HA H 2.742 -0.657 -6.395 1.00 . A A . 23 TRP HA 1 1 20 12496 1 1 23 TRP HB2 H 3.021 1.828 -5.317 1.00 . A A . 23 TRP HB2 1 1 20 12497 1 1 23 TRP HB3 H 4.372 1.793 -6.445 1.00 . A A . 23 TRP HB3 1 1 20 12498 1 1 23 TRP HD1 H 2.155 -0.272 -8.232 1.00 . A A . 23 TRP HD1 1 1 20 12499 1 1 23 TRP HE1 H 0.639 1.025 -9.857 1.00 . A A . 23 TRP HE1 1 1 20 12500 1 1 23 TRP HE3 H 2.755 4.425 -6.318 1.00 . A A . 23 TRP HE3 1 1 20 12501 1 1 23 TRP HH2 H 0.128 5.931 -9.328 1.00 . A A . 23 TRP HH2 1 1 20 12502 1 1 23 TRP HZ2 H -0.192 3.687 -10.271 1.00 . A A . 23 TRP HZ2 1 1 20 12503 1 1 23 TRP HZ3 H 1.567 6.296 -7.390 1.00 . A A . 23 TRP HZ3 1 1 20 12504 1 1 23 TRP N N 3.573 -0.421 -4.530 1.00 . A A . 23 TRP N 1 1 20 12505 1 1 23 TRP NE1 N 1.133 1.444 -9.122 1.00 . A A . 23 TRP NE1 1 1 20 12506 1 1 23 TRP O O 4.843 -1.647 -7.331 1.00 . A A . 23 TRP O 1 1 20 12507 1 1 24 LYS C C 7.126 -0.418 -8.497 1.00 . A A . 24 LYS C 1 1 20 12508 1 1 24 LYS CA C 7.234 -0.302 -6.978 1.00 . A A . 24 LYS CA 1 1 20 12509 1 1 24 LYS CB C 7.722 -1.624 -6.386 1.00 . A A . 24 LYS CB 1 1 20 12510 1 1 24 LYS CD C 10.115 -1.626 -5.615 1.00 . A A . 24 LYS CD 1 1 20 12511 1 1 24 LYS CE C 11.401 -2.430 -5.714 1.00 . A A . 24 LYS CE 1 1 20 12512 1 1 24 LYS CG C 9.159 -1.961 -6.749 1.00 . A A . 24 LYS CG 1 1 20 12513 1 1 24 LYS H H 5.895 0.862 -5.824 1.00 . A A . 24 LYS H 1 1 20 12514 1 1 24 LYS HA H 7.945 0.473 -6.739 1.00 . A A . 24 LYS HA 1 1 20 12515 1 1 24 LYS HB2 H 7.648 -1.570 -5.310 1.00 . A A . 24 LYS HB2 1 1 20 12516 1 1 24 LYS HB3 H 7.086 -2.421 -6.742 1.00 . A A . 24 LYS HB3 1 1 20 12517 1 1 24 LYS HD2 H 10.355 -0.574 -5.659 1.00 . A A . 24 LYS HD2 1 1 20 12518 1 1 24 LYS HD3 H 9.633 -1.848 -4.674 1.00 . A A . 24 LYS HD3 1 1 20 12519 1 1 24 LYS HE2 H 11.150 -3.470 -5.858 1.00 . A A . 24 LYS HE2 1 1 20 12520 1 1 24 LYS HE3 H 11.967 -2.076 -6.564 1.00 . A A . 24 LYS HE3 1 1 20 12521 1 1 24 LYS HG2 H 9.228 -3.018 -6.963 1.00 . A A . 24 LYS HG2 1 1 20 12522 1 1 24 LYS HG3 H 9.441 -1.396 -7.625 1.00 . A A . 24 LYS HG3 1 1 20 12523 1 1 24 LYS HZ1 H 11.625 -2.226 -3.647 1.00 . A A . 24 LYS HZ1 1 1 20 12524 1 1 24 LYS HZ2 H 12.852 -3.128 -4.384 1.00 . A A . 24 LYS HZ2 1 1 20 12525 1 1 24 LYS HZ3 H 12.827 -1.445 -4.548 1.00 . A A . 24 LYS HZ3 1 1 20 12526 1 1 24 LYS N N 5.951 0.069 -6.395 1.00 . A A . 24 LYS N 1 1 20 12527 1 1 24 LYS NZ N 12.234 -2.298 -4.488 1.00 . A A . 24 LYS NZ 1 1 20 12528 1 1 24 LYS O O 7.772 -1.265 -9.113 1.00 . A A . 24 LYS O 1 1 20 12529 1 1 25 THR C C 7.434 0.562 -11.276 1.00 . A A . 25 THR C 1 1 20 12530 1 1 25 THR CA C 6.103 0.434 -10.540 1.00 . A A . 25 THR CA 1 1 20 12531 1 1 25 THR CB C 5.156 1.563 -10.958 1.00 . A A . 25 THR CB 1 1 20 12532 1 1 25 THR CG2 C 5.731 2.940 -10.728 1.00 . A A . 25 THR CG2 1 1 20 12533 1 1 25 THR H H 5.812 1.091 -8.548 1.00 . A A . 25 THR H 1 1 20 12534 1 1 25 THR HA H 5.656 -0.511 -10.809 1.00 . A A . 25 THR HA 1 1 20 12535 1 1 25 THR HB H 4.243 1.486 -10.383 1.00 . A A . 25 THR HB 1 1 20 12536 1 1 25 THR HG1 H 3.873 1.420 -12.431 1.00 . A A . 25 THR HG1 1 1 20 12537 1 1 25 THR HG21 H 6.637 2.854 -10.150 1.00 . A A . 25 THR HG21 1 1 20 12538 1 1 25 THR HG22 H 5.952 3.403 -11.678 1.00 . A A . 25 THR HG22 1 1 20 12539 1 1 25 THR HG23 H 5.017 3.545 -10.189 1.00 . A A . 25 THR HG23 1 1 20 12540 1 1 25 THR N N 6.301 0.440 -9.094 1.00 . A A . 25 THR N 1 1 20 12541 1 1 25 THR O O 8.491 0.686 -10.658 1.00 . A A . 25 THR O 1 1 20 12542 1 1 25 THR OG1 O 4.827 1.459 -12.332 1.00 . A A . 25 THR OG1 1 1 20 12543 1 1 26 SER C C 9.304 1.927 -13.242 1.00 . A A . 26 SER C 1 1 20 12544 1 1 26 SER CA C 8.560 0.606 -13.437 1.00 . A A . 26 SER CA 1 1 20 12545 1 1 26 SER CB C 8.180 0.440 -14.909 1.00 . A A . 26 SER CB 1 1 20 12546 1 1 26 SER H H 6.493 0.400 -13.025 1.00 . A A . 26 SER H 1 1 20 12547 1 1 26 SER HA H 9.218 -0.203 -13.158 1.00 . A A . 26 SER HA 1 1 20 12548 1 1 26 SER HB2 H 7.511 1.237 -15.198 1.00 . A A . 26 SER HB2 1 1 20 12549 1 1 26 SER HB3 H 9.073 0.483 -15.516 1.00 . A A . 26 SER HB3 1 1 20 12550 1 1 26 SER HG H 8.194 -1.494 -15.216 1.00 . A A . 26 SER HG 1 1 20 12551 1 1 26 SER N N 7.368 0.514 -12.599 1.00 . A A . 26 SER N 1 1 20 12552 1 1 26 SER O O 10.499 2.015 -13.526 1.00 . A A . 26 SER O 1 1 20 12553 1 1 26 SER OG O 7.535 -0.801 -15.134 1.00 . A A . 26 SER OG 1 1 20 12554 1 1 27 VAL C C 8.500 5.062 -11.483 1.00 . A A . 27 VAL C 1 1 20 12555 1 1 27 VAL CA C 9.227 4.260 -12.559 1.00 . A A . 27 VAL CA 1 1 20 12556 1 1 27 VAL CB C 9.258 5.084 -13.863 1.00 . A A . 27 VAL CB 1 1 20 12557 1 1 27 VAL CG1 C 10.065 6.359 -13.670 1.00 . A A . 27 VAL CG1 1 1 20 12558 1 1 27 VAL CG2 C 9.823 4.258 -15.009 1.00 . A A . 27 VAL CG2 1 1 20 12559 1 1 27 VAL H H 7.654 2.837 -12.562 1.00 . A A . 27 VAL H 1 1 20 12560 1 1 27 VAL HA H 10.245 4.093 -12.241 1.00 . A A . 27 VAL HA 1 1 20 12561 1 1 27 VAL HB H 8.244 5.362 -14.113 1.00 . A A . 27 VAL HB 1 1 20 12562 1 1 27 VAL HG11 H 10.819 6.198 -12.915 1.00 . A A . 27 VAL HG11 1 1 20 12563 1 1 27 VAL HG12 H 10.540 6.629 -14.602 1.00 . A A . 27 VAL HG12 1 1 20 12564 1 1 27 VAL HG13 H 9.408 7.158 -13.358 1.00 . A A . 27 VAL HG13 1 1 20 12565 1 1 27 VAL HG21 H 10.794 3.875 -14.732 1.00 . A A . 27 VAL HG21 1 1 20 12566 1 1 27 VAL HG22 H 9.157 3.434 -15.221 1.00 . A A . 27 VAL HG22 1 1 20 12567 1 1 27 VAL HG23 H 9.918 4.879 -15.887 1.00 . A A . 27 VAL HG23 1 1 20 12568 1 1 27 VAL N N 8.604 2.955 -12.769 1.00 . A A . 27 VAL N 1 1 20 12569 1 1 27 VAL O O 8.198 6.241 -11.669 1.00 . A A . 27 VAL O 1 1 20 12570 1 1 28 SER C C 7.237 4.086 -8.123 1.00 . A A . 28 SER C 1 1 20 12571 1 1 28 SER CA C 7.535 5.075 -9.247 1.00 . A A . 28 SER CA 1 1 20 12572 1 1 28 SER CB C 6.232 5.719 -9.733 1.00 . A A . 28 SER CB 1 1 20 12573 1 1 28 SER H H 8.490 3.479 -10.265 1.00 . A A . 28 SER H 1 1 20 12574 1 1 28 SER HA H 8.186 5.847 -8.865 1.00 . A A . 28 SER HA 1 1 20 12575 1 1 28 SER HB2 H 6.043 5.418 -10.752 1.00 . A A . 28 SER HB2 1 1 20 12576 1 1 28 SER HB3 H 5.415 5.396 -9.105 1.00 . A A . 28 SER HB3 1 1 20 12577 1 1 28 SER HG H 6.291 7.424 -8.770 1.00 . A A . 28 SER HG 1 1 20 12578 1 1 28 SER N N 8.224 4.418 -10.355 1.00 . A A . 28 SER N 1 1 20 12579 1 1 28 SER O O 6.161 3.491 -8.076 1.00 . A A . 28 SER O 1 1 20 12580 1 1 28 SER OG O 6.314 7.133 -9.685 1.00 . A A . 28 SER OG 1 1 20 12581 1 1 29 SER C C 7.549 3.746 -4.856 1.00 . A A . 29 SER C 1 1 20 12582 1 1 29 SER CA C 8.029 3.001 -6.096 1.00 . A A . 29 SER CA 1 1 20 12583 1 1 29 SER CB C 9.346 2.282 -5.797 1.00 . A A . 29 SER CB 1 1 20 12584 1 1 29 SER H H 9.032 4.420 -7.307 1.00 . A A . 29 SER H 1 1 20 12585 1 1 29 SER HA H 7.282 2.271 -6.373 1.00 . A A . 29 SER HA 1 1 20 12586 1 1 29 SER HB2 H 9.965 2.912 -5.176 1.00 . A A . 29 SER HB2 1 1 20 12587 1 1 29 SER HB3 H 9.138 1.358 -5.278 1.00 . A A . 29 SER HB3 1 1 20 12588 1 1 29 SER HG H 10.223 1.044 -7.036 1.00 . A A . 29 SER HG 1 1 20 12589 1 1 29 SER N N 8.195 3.917 -7.219 1.00 . A A . 29 SER N 1 1 20 12590 1 1 29 SER O O 8.193 4.689 -4.396 1.00 . A A . 29 SER O 1 1 20 12591 1 1 29 SER OG O 10.050 1.987 -6.991 1.00 . A A . 29 SER OG 1 1 20 12592 1 1 30 HIS C C 5.781 2.965 -1.974 1.00 . A A . 30 HIS C 1 1 20 12593 1 1 30 HIS CA C 5.835 3.946 -3.141 1.00 . A A . 30 HIS CA 1 1 20 12594 1 1 30 HIS CB C 4.434 4.472 -3.454 1.00 . A A . 30 HIS CB 1 1 20 12595 1 1 30 HIS CD2 C 5.000 5.335 -5.833 1.00 . A A . 30 HIS CD2 1 1 20 12596 1 1 30 HIS CE1 C 3.849 7.200 -5.780 1.00 . A A . 30 HIS CE1 1 1 20 12597 1 1 30 HIS CG C 4.399 5.408 -4.621 1.00 . A A . 30 HIS CG 1 1 20 12598 1 1 30 HIS H H 5.941 2.565 -4.739 1.00 . A A . 30 HIS H 1 1 20 12599 1 1 30 HIS HA H 6.468 4.777 -2.867 1.00 . A A . 30 HIS HA 1 1 20 12600 1 1 30 HIS HB2 H 3.785 3.637 -3.678 1.00 . A A . 30 HIS HB2 1 1 20 12601 1 1 30 HIS HB3 H 4.052 4.998 -2.591 1.00 . A A . 30 HIS HB3 1 1 20 12602 1 1 30 HIS HD1 H 3.141 6.927 -3.880 1.00 . A A . 30 HIS HD1 1 1 20 12603 1 1 30 HIS HD2 H 5.640 4.538 -6.184 1.00 . A A . 30 HIS HD2 1 1 20 12604 1 1 30 HIS HE1 H 3.409 8.145 -6.063 1.00 . A A . 30 HIS HE1 1 1 20 12605 1 1 30 HIS HE2 H 4.997 6.724 -7.408 1.00 . A A . 30 HIS HE2 1 1 20 12606 1 1 30 HIS N N 6.409 3.319 -4.324 1.00 . A A . 30 HIS N 1 1 20 12607 1 1 30 HIS ND1 N 3.686 6.589 -4.620 1.00 . A A . 30 HIS ND1 1 1 20 12608 1 1 30 HIS NE2 N 4.641 6.461 -6.533 1.00 . A A . 30 HIS NE2 1 1 20 12609 1 1 30 HIS O O 6.015 1.769 -2.145 1.00 . A A . 30 HIS O 1 1 20 12610 1 1 31 TYR C C 4.050 2.823 1.105 1.00 . A A . 31 TYR C 1 1 20 12611 1 1 31 TYR CA C 5.395 2.652 0.408 1.00 . A A . 31 TYR CA 1 1 20 12612 1 1 31 TYR CB C 6.525 3.010 1.373 1.00 . A A . 31 TYR CB 1 1 20 12613 1 1 31 TYR CD1 C 8.108 1.070 1.675 1.00 . A A . 31 TYR CD1 1 1 20 12614 1 1 31 TYR CD2 C 8.758 2.833 0.210 1.00 . A A . 31 TYR CD2 1 1 20 12615 1 1 31 TYR CE1 C 9.291 0.408 1.412 1.00 . A A . 31 TYR CE1 1 1 20 12616 1 1 31 TYR CE2 C 9.944 2.178 -0.060 1.00 . A A . 31 TYR CE2 1 1 20 12617 1 1 31 TYR CG C 7.821 2.291 1.080 1.00 . A A . 31 TYR CG 1 1 20 12618 1 1 31 TYR CZ C 10.206 0.966 0.543 1.00 . A A . 31 TYR CZ 1 1 20 12619 1 1 31 TYR H H 5.302 4.443 -0.716 1.00 . A A . 31 TYR H 1 1 20 12620 1 1 31 TYR HA H 5.503 1.622 0.107 1.00 . A A . 31 TYR HA 1 1 20 12621 1 1 31 TYR HB2 H 6.715 4.071 1.317 1.00 . A A . 31 TYR HB2 1 1 20 12622 1 1 31 TYR HB3 H 6.224 2.756 2.379 1.00 . A A . 31 TYR HB3 1 1 20 12623 1 1 31 TYR HD1 H 7.389 0.635 2.353 1.00 . A A . 31 TYR HD1 1 1 20 12624 1 1 31 TYR HD2 H 8.549 3.783 -0.261 1.00 . A A . 31 TYR HD2 1 1 20 12625 1 1 31 TYR HE1 H 9.495 -0.541 1.885 1.00 . A A . 31 TYR HE1 1 1 20 12626 1 1 31 TYR HE2 H 10.659 2.617 -0.740 1.00 . A A . 31 TYR HE2 1 1 20 12627 1 1 31 TYR HH H 11.217 -0.630 0.186 1.00 . A A . 31 TYR HH 1 1 20 12628 1 1 31 TYR N N 5.475 3.481 -0.789 1.00 . A A . 31 TYR N 1 1 20 12629 1 1 31 TYR O O 3.407 3.866 0.988 1.00 . A A . 31 TYR O 1 1 20 12630 1 1 31 TYR OH O 11.386 0.310 0.278 1.00 . A A . 31 TYR OH 1 1 20 12631 1 1 32 CYS C C 2.577 2.287 3.993 1.00 . A A . 32 CYS C 1 1 20 12632 1 1 32 CYS CA C 2.366 1.832 2.554 1.00 . A A . 32 CYS CA 1 1 20 12633 1 1 32 CYS CB C 1.696 0.457 2.529 1.00 . A A . 32 CYS CB 1 1 20 12634 1 1 32 CYS H H 4.191 0.990 1.892 1.00 . A A . 32 CYS H 1 1 20 12635 1 1 32 CYS HA H 1.725 2.543 2.056 1.00 . A A . 32 CYS HA 1 1 20 12636 1 1 32 CYS HB2 H 2.210 -0.173 1.819 1.00 . A A . 32 CYS HB2 1 1 20 12637 1 1 32 CYS HB3 H 1.764 0.012 3.511 1.00 . A A . 32 CYS HB3 1 1 20 12638 1 1 32 CYS N N 3.632 1.793 1.834 1.00 . A A . 32 CYS N 1 1 20 12639 1 1 32 CYS O O 3.684 2.208 4.525 1.00 . A A . 32 CYS O 1 1 20 12640 1 1 32 CYS SG S -0.064 0.498 2.058 1.00 . A A . 32 CYS SG 1 1 20 12641 1 1 33 THR C C 0.729 2.356 6.916 1.00 . A A . 33 THR C 1 1 20 12642 1 1 33 THR CA C 1.575 3.234 5.999 1.00 . A A . 33 THR CA 1 1 20 12643 1 1 33 THR CB C 1.104 4.687 6.089 1.00 . A A . 33 THR CB 1 1 20 12644 1 1 33 THR CG2 C 1.623 5.558 4.964 1.00 . A A . 33 THR CG2 1 1 20 12645 1 1 33 THR H H 0.652 2.803 4.143 1.00 . A A . 33 THR H 1 1 20 12646 1 1 33 THR HA H 2.605 3.178 6.317 1.00 . A A . 33 THR HA 1 1 20 12647 1 1 33 THR HB H 1.452 5.109 7.021 1.00 . A A . 33 THR HB 1 1 20 12648 1 1 33 THR HG1 H -0.637 4.891 6.963 1.00 . A A . 33 THR HG1 1 1 20 12649 1 1 33 THR HG21 H 1.300 5.152 4.017 1.00 . A A . 33 THR HG21 1 1 20 12650 1 1 33 THR HG22 H 1.236 6.560 5.077 1.00 . A A . 33 THR HG22 1 1 20 12651 1 1 33 THR HG23 H 2.702 5.583 4.996 1.00 . A A . 33 THR HG23 1 1 20 12652 1 1 33 THR N N 1.507 2.765 4.619 1.00 . A A . 33 THR N 1 1 20 12653 1 1 33 THR O O 0.320 2.783 7.995 1.00 . A A . 33 THR O 1 1 20 12654 1 1 33 THR OG1 O -0.310 4.758 6.070 1.00 . A A . 33 THR OG1 1 1 20 12655 1 1 34 GLY C C -1.634 0.821 7.750 1.00 . A A . 34 GLY C 1 1 20 12656 1 1 34 GLY CA C -0.329 0.207 7.275 1.00 . A A . 34 GLY CA 1 1 20 12657 1 1 34 GLY H H 0.821 0.837 5.611 1.00 . A A . 34 GLY H 1 1 20 12658 1 1 34 GLY HA2 H 0.246 -0.096 8.137 1.00 . A A . 34 GLY HA2 1 1 20 12659 1 1 34 GLY HA3 H -0.552 -0.666 6.680 1.00 . A A . 34 GLY HA3 1 1 20 12660 1 1 34 GLY N N 0.468 1.125 6.480 1.00 . A A . 34 GLY N 1 1 20 12661 1 1 34 GLY O O -2.184 0.412 8.772 1.00 . A A . 34 GLY O 1 1 20 12662 1 1 35 ARG C C -4.461 2.179 6.332 1.00 . A A . 35 ARG C 1 1 20 12663 1 1 35 ARG CA C -3.376 2.478 7.358 1.00 . A A . 35 ARG CA 1 1 20 12664 1 1 35 ARG CB C -3.155 3.988 7.460 1.00 . A A . 35 ARG CB 1 1 20 12665 1 1 35 ARG CD C -3.296 4.245 9.956 1.00 . A A . 35 ARG CD 1 1 20 12666 1 1 35 ARG CG C -2.423 4.412 8.723 1.00 . A A . 35 ARG CG 1 1 20 12667 1 1 35 ARG CZ C -2.794 6.300 11.219 1.00 . A A . 35 ARG CZ 1 1 20 12668 1 1 35 ARG H H -1.645 2.089 6.203 1.00 . A A . 35 ARG H 1 1 20 12669 1 1 35 ARG HA H -3.694 2.105 8.316 1.00 . A A . 35 ARG HA 1 1 20 12670 1 1 35 ARG HB2 H -2.577 4.314 6.608 1.00 . A A . 35 ARG HB2 1 1 20 12671 1 1 35 ARG HB3 H -4.115 4.482 7.443 1.00 . A A . 35 ARG HB3 1 1 20 12672 1 1 35 ARG HD2 H -4.286 4.614 9.733 1.00 . A A . 35 ARG HD2 1 1 20 12673 1 1 35 ARG HD3 H -3.352 3.194 10.202 1.00 . A A . 35 ARG HD3 1 1 20 12674 1 1 35 ARG HE H -2.368 4.448 11.830 1.00 . A A . 35 ARG HE 1 1 20 12675 1 1 35 ARG HG2 H -1.538 3.803 8.836 1.00 . A A . 35 ARG HG2 1 1 20 12676 1 1 35 ARG HG3 H -2.139 5.450 8.631 1.00 . A A . 35 ARG HG3 1 1 20 12677 1 1 35 ARG HH11 H -3.707 6.611 9.441 1.00 . A A . 35 ARG HH11 1 1 20 12678 1 1 35 ARG HH12 H -3.343 8.040 10.349 1.00 . A A . 35 ARG HH12 1 1 20 12679 1 1 35 ARG HH21 H -1.890 6.327 13.026 1.00 . A A . 35 ARG HH21 1 1 20 12680 1 1 35 ARG HH22 H -2.311 7.879 12.384 1.00 . A A . 35 ARG HH22 1 1 20 12681 1 1 35 ARG N N -2.129 1.806 7.007 1.00 . A A . 35 ARG N 1 1 20 12682 1 1 35 ARG NE N -2.766 4.974 11.105 1.00 . A A . 35 ARG NE 1 1 20 12683 1 1 35 ARG NH1 N -3.325 7.045 10.257 1.00 . A A . 35 ARG NH1 1 1 20 12684 1 1 35 ARG NH2 N -2.290 6.883 12.298 1.00 . A A . 35 ARG NH2 1 1 20 12685 1 1 35 ARG O O -5.436 1.486 6.624 1.00 . A A . 35 ARG O 1 1 20 12686 1 1 36 SER C C -4.683 1.531 3.016 1.00 . A A . 36 SER C 1 1 20 12687 1 1 36 SER CA C -5.240 2.502 4.050 1.00 . A A . 36 SER CA 1 1 20 12688 1 1 36 SER CB C -5.585 3.835 3.383 1.00 . A A . 36 SER CB 1 1 20 12689 1 1 36 SER H H -3.483 3.249 4.965 1.00 . A A . 36 SER H 1 1 20 12690 1 1 36 SER HA H -6.137 2.080 4.478 1.00 . A A . 36 SER HA 1 1 20 12691 1 1 36 SER HB2 H -4.761 4.147 2.759 1.00 . A A . 36 SER HB2 1 1 20 12692 1 1 36 SER HB3 H -6.470 3.713 2.776 1.00 . A A . 36 SER HB3 1 1 20 12693 1 1 36 SER HG H -5.034 4.989 4.867 1.00 . A A . 36 SER HG 1 1 20 12694 1 1 36 SER N N -4.282 2.708 5.130 1.00 . A A . 36 SER N 1 1 20 12695 1 1 36 SER O O -3.513 1.155 3.073 1.00 . A A . 36 SER O 1 1 20 12696 1 1 36 SER OG O -5.830 4.841 4.350 1.00 . A A . 36 SER OG 1 1 20 12697 1 1 37 CYS C C -4.577 0.953 -0.196 1.00 . A A . 37 CYS C 1 1 20 12698 1 1 37 CYS CA C -5.104 0.202 1.025 1.00 . A A . 37 CYS CA 1 1 20 12699 1 1 37 CYS CB C -6.261 -0.715 0.624 1.00 . A A . 37 CYS CB 1 1 20 12700 1 1 37 CYS H H -6.445 1.463 2.071 1.00 . A A . 37 CYS H 1 1 20 12701 1 1 37 CYS HA H -4.306 -0.401 1.429 1.00 . A A . 37 CYS HA 1 1 20 12702 1 1 37 CYS HB2 H -7.171 -0.136 0.578 1.00 . A A . 37 CYS HB2 1 1 20 12703 1 1 37 CYS HB3 H -6.058 -1.135 -0.350 1.00 . A A . 37 CYS HB3 1 1 20 12704 1 1 37 CYS N N -5.525 1.128 2.069 1.00 . A A . 37 CYS N 1 1 20 12705 1 1 37 CYS O O -4.310 0.352 -1.237 1.00 . A A . 37 CYS O 1 1 20 12706 1 1 37 CYS SG S -6.541 -2.098 1.778 1.00 . A A . 37 CYS SG 1 1 20 12707 1 1 38 GLU C C -2.461 3.470 -0.911 1.00 . A A . 38 GLU C 1 1 20 12708 1 1 38 GLU CA C -3.920 3.096 -1.149 1.00 . A A . 38 GLU CA 1 1 20 12709 1 1 38 GLU CB C -4.768 4.362 -1.290 1.00 . A A . 38 GLU CB 1 1 20 12710 1 1 38 GLU CD C -5.684 6.429 -0.164 1.00 . A A . 38 GLU CD 1 1 20 12711 1 1 38 GLU CG C -4.990 5.094 0.023 1.00 . A A . 38 GLU CG 1 1 20 12712 1 1 38 GLU H H -4.648 2.690 0.795 1.00 . A A . 38 GLU H 1 1 20 12713 1 1 38 GLU HA H -3.989 2.523 -2.062 1.00 . A A . 38 GLU HA 1 1 20 12714 1 1 38 GLU HB2 H -4.275 5.037 -1.975 1.00 . A A . 38 GLU HB2 1 1 20 12715 1 1 38 GLU HB3 H -5.732 4.093 -1.695 1.00 . A A . 38 GLU HB3 1 1 20 12716 1 1 38 GLU HG2 H -5.600 4.477 0.666 1.00 . A A . 38 GLU HG2 1 1 20 12717 1 1 38 GLU HG3 H -4.032 5.265 0.492 1.00 . A A . 38 GLU HG3 1 1 20 12718 1 1 38 GLU N N -4.423 2.268 -0.060 1.00 . A A . 38 GLU N 1 1 20 12719 1 1 38 GLU O O -2.020 3.586 0.233 1.00 . A A . 38 GLU O 1 1 20 12720 1 1 38 GLU OE1 O -5.435 7.088 -1.196 1.00 . A A . 38 GLU OE1 1 1 20 12721 1 1 38 GLU OE2 O -6.476 6.816 0.721 1.00 . A A . 38 GLU OE2 1 1 20 12722 1 1 39 CYS C C -0.118 5.527 -1.942 1.00 . A A . 39 CYS C 1 1 20 12723 1 1 39 CYS CA C -0.304 4.010 -1.896 1.00 . A A . 39 CYS CA 1 1 20 12724 1 1 39 CYS CB C 0.490 3.358 -3.030 1.00 . A A . 39 CYS CB 1 1 20 12725 1 1 39 CYS H H -2.120 3.545 -2.879 1.00 . A A . 39 CYS H 1 1 20 12726 1 1 39 CYS HA H 0.065 3.639 -0.952 1.00 . A A . 39 CYS HA 1 1 20 12727 1 1 39 CYS HB2 H 0.122 3.727 -3.975 1.00 . A A . 39 CYS HB2 1 1 20 12728 1 1 39 CYS HB3 H 1.532 3.622 -2.928 1.00 . A A . 39 CYS HB3 1 1 20 12729 1 1 39 CYS N N -1.714 3.653 -1.994 1.00 . A A . 39 CYS N 1 1 20 12730 1 1 39 CYS O O -0.473 6.171 -2.929 1.00 . A A . 39 CYS O 1 1 20 12731 1 1 39 CYS SG S 0.380 1.539 -3.067 1.00 . A A . 39 CYS SG 1 1 20 12732 1 1 40 PRO C C 1.676 8.028 -1.880 1.00 . A A . 40 PRO C 1 1 20 12733 1 1 40 PRO CA C 0.686 7.569 -0.816 1.00 . A A . 40 PRO CA 1 1 20 12734 1 1 40 PRO CB C 1.267 7.786 0.585 1.00 . A A . 40 PRO CB 1 1 20 12735 1 1 40 PRO CD C 0.917 5.438 0.343 1.00 . A A . 40 PRO CD 1 1 20 12736 1 1 40 PRO CG C 1.810 6.459 0.987 1.00 . A A . 40 PRO CG 1 1 20 12737 1 1 40 PRO HA H -0.234 8.125 -0.918 1.00 . A A . 40 PRO HA 1 1 20 12738 1 1 40 PRO HB2 H 2.044 8.535 0.542 1.00 . A A . 40 PRO HB2 1 1 20 12739 1 1 40 PRO HB3 H 0.484 8.111 1.255 1.00 . A A . 40 PRO HB3 1 1 20 12740 1 1 40 PRO HD2 H 1.477 4.548 0.097 1.00 . A A . 40 PRO HD2 1 1 20 12741 1 1 40 PRO HD3 H 0.087 5.198 0.991 1.00 . A A . 40 PRO HD3 1 1 20 12742 1 1 40 PRO HG2 H 2.823 6.352 0.628 1.00 . A A . 40 PRO HG2 1 1 20 12743 1 1 40 PRO HG3 H 1.779 6.359 2.062 1.00 . A A . 40 PRO HG3 1 1 20 12744 1 1 40 PRO N N 0.451 6.122 -0.876 1.00 . A A . 40 PRO N 1 1 20 12745 1 1 40 PRO O O 2.401 7.217 -2.455 1.00 . A A . 40 PRO O 1 1 20 12746 1 1 41 SER C C 4.011 10.063 -2.542 1.00 . A A . 41 SER C 1 1 20 12747 1 1 41 SER CA C 2.613 9.893 -3.129 1.00 . A A . 41 SER CA 1 1 20 12748 1 1 41 SER CB C 2.085 11.238 -3.630 1.00 . A A . 41 SER CB 1 1 20 12749 1 1 41 SER H H 1.108 9.928 -1.642 1.00 . A A . 41 SER H 1 1 20 12750 1 1 41 SER HA H 2.665 9.203 -3.958 1.00 . A A . 41 SER HA 1 1 20 12751 1 1 41 SER HB2 H 2.903 11.817 -4.031 1.00 . A A . 41 SER HB2 1 1 20 12752 1 1 41 SER HB3 H 1.351 11.069 -4.404 1.00 . A A . 41 SER HB3 1 1 20 12753 1 1 41 SER HG H 0.567 12.164 -2.807 1.00 . A A . 41 SER HG 1 1 20 12754 1 1 41 SER N N 1.706 9.331 -2.135 1.00 . A A . 41 SER N 1 1 20 12755 1 1 41 SER O O 4.556 11.167 -2.516 1.00 . A A . 41 SER O 1 1 20 12756 1 1 41 SER OG O 1.480 11.972 -2.580 1.00 . A A . 41 SER OG 1 1 20 12757 1 1 42 TYR C C 6.856 8.020 -2.181 1.00 . A A . 42 TYR C 1 1 20 12758 1 1 42 TYR CA C 5.911 8.987 -1.470 1.00 . A A . 42 TYR CA 1 1 20 12759 1 1 42 TYR CB C 5.829 8.633 0.014 1.00 . A A . 42 TYR CB 1 1 20 12760 1 1 42 TYR CD1 C 6.796 10.598 1.260 1.00 . A A . 42 TYR CD1 1 1 20 12761 1 1 42 TYR CD2 C 4.447 10.222 1.400 1.00 . A A . 42 TYR CD2 1 1 20 12762 1 1 42 TYR CE1 C 6.672 11.706 2.075 1.00 . A A . 42 TYR CE1 1 1 20 12763 1 1 42 TYR CE2 C 4.313 11.327 2.215 1.00 . A A . 42 TYR CE2 1 1 20 12764 1 1 42 TYR CG C 5.688 9.839 0.909 1.00 . A A . 42 TYR CG 1 1 20 12765 1 1 42 TYR CZ C 5.429 12.067 2.551 1.00 . A A . 42 TYR CZ 1 1 20 12766 1 1 42 TYR H H 4.094 8.114 -2.109 1.00 . A A . 42 TYR H 1 1 20 12767 1 1 42 TYR HA H 6.298 9.990 -1.567 1.00 . A A . 42 TYR HA 1 1 20 12768 1 1 42 TYR HB2 H 4.974 7.995 0.179 1.00 . A A . 42 TYR HB2 1 1 20 12769 1 1 42 TYR HB3 H 6.727 8.106 0.303 1.00 . A A . 42 TYR HB3 1 1 20 12770 1 1 42 TYR HD1 H 7.768 10.312 0.886 1.00 . A A . 42 TYR HD1 1 1 20 12771 1 1 42 TYR HD2 H 3.577 9.640 1.136 1.00 . A A . 42 TYR HD2 1 1 20 12772 1 1 42 TYR HE1 H 7.547 12.283 2.335 1.00 . A A . 42 TYR HE1 1 1 20 12773 1 1 42 TYR HE2 H 3.338 11.608 2.586 1.00 . A A . 42 TYR HE2 1 1 20 12774 1 1 42 TYR HH H 5.076 13.936 2.830 1.00 . A A . 42 TYR HH 1 1 20 12775 1 1 42 TYR N N 4.581 8.962 -2.065 1.00 . A A . 42 TYR N 1 1 20 12776 1 1 42 TYR O O 6.778 6.808 -1.982 1.00 . A A . 42 TYR O 1 1 20 12777 1 1 42 TYR OH O 5.300 13.170 3.363 1.00 . A A . 42 TYR OH 1 1 20 12778 1 1 43 PRO C C 9.792 7.116 -2.826 1.00 . A A . 43 PRO C 1 1 20 12779 1 1 43 PRO CA C 8.734 7.716 -3.747 1.00 . A A . 43 PRO CA 1 1 20 12780 1 1 43 PRO CB C 9.374 8.701 -4.727 1.00 . A A . 43 PRO CB 1 1 20 12781 1 1 43 PRO CD C 7.941 9.980 -3.310 1.00 . A A . 43 PRO CD 1 1 20 12782 1 1 43 PRO CG C 9.239 10.028 -4.066 1.00 . A A . 43 PRO CG 1 1 20 12783 1 1 43 PRO HA H 8.243 6.925 -4.294 1.00 . A A . 43 PRO HA 1 1 20 12784 1 1 43 PRO HB2 H 10.411 8.438 -4.881 1.00 . A A . 43 PRO HB2 1 1 20 12785 1 1 43 PRO HB3 H 8.845 8.673 -5.668 1.00 . A A . 43 PRO HB3 1 1 20 12786 1 1 43 PRO HD2 H 8.014 10.554 -2.398 1.00 . A A . 43 PRO HD2 1 1 20 12787 1 1 43 PRO HD3 H 7.132 10.347 -3.924 1.00 . A A . 43 PRO HD3 1 1 20 12788 1 1 43 PRO HG2 H 10.063 10.187 -3.385 1.00 . A A . 43 PRO HG2 1 1 20 12789 1 1 43 PRO HG3 H 9.210 10.810 -4.810 1.00 . A A . 43 PRO HG3 1 1 20 12790 1 1 43 PRO N N 7.770 8.544 -3.017 1.00 . A A . 43 PRO N 1 1 20 12791 1 1 43 PRO O O 10.434 6.123 -3.166 1.00 . A A . 43 PRO O 1 1 20 12792 1 1 44 GLY C C 10.312 6.561 0.488 1.00 . A A . 44 GLY C 1 1 20 12793 1 1 44 GLY CA C 10.950 7.243 -0.706 1.00 . A A . 44 GLY CA 1 1 20 12794 1 1 44 GLY H H 9.430 8.516 -1.441 1.00 . A A . 44 GLY H 1 1 20 12795 1 1 44 GLY HA2 H 11.538 8.079 -0.356 1.00 . A A . 44 GLY HA2 1 1 20 12796 1 1 44 GLY HA3 H 11.602 6.540 -1.202 1.00 . A A . 44 GLY HA3 1 1 20 12797 1 1 44 GLY N N 9.969 7.728 -1.658 1.00 . A A . 44 GLY N 1 1 20 12798 1 1 44 GLY O O 10.243 5.333 0.547 1.00 . A A . 44 GLY O 1 1 20 12799 1 1 45 ASN C C 10.184 5.966 3.439 1.00 . A A . 45 ASN C 1 1 20 12800 1 1 45 ASN CA C 9.209 6.827 2.643 1.00 . A A . 45 ASN CA 1 1 20 12801 1 1 45 ASN CB C 7.972 6.006 2.270 1.00 . A A . 45 ASN CB 1 1 20 12802 1 1 45 ASN CG C 6.830 6.206 3.247 1.00 . A A . 45 ASN CG 1 1 20 12803 1 1 45 ASN H H 9.929 8.330 1.338 1.00 . A A . 45 ASN H 1 1 20 12804 1 1 45 ASN HA H 8.904 7.662 3.254 1.00 . A A . 45 ASN HA 1 1 20 12805 1 1 45 ASN HB2 H 7.636 6.300 1.287 1.00 . A A . 45 ASN HB2 1 1 20 12806 1 1 45 ASN HB3 H 8.234 4.958 2.258 1.00 . A A . 45 ASN HB3 1 1 20 12807 1 1 45 ASN HD21 H 5.629 6.767 1.765 1.00 . A A . 45 ASN HD21 1 1 20 12808 1 1 45 ASN HD22 H 4.921 6.754 3.341 1.00 . A A . 45 ASN HD22 1 1 20 12809 1 1 45 ASN N N 9.844 7.359 1.443 1.00 . A A . 45 ASN N 1 1 20 12810 1 1 45 ASN ND2 N 5.677 6.617 2.732 1.00 . A A . 45 ASN ND2 1 1 20 12811 1 1 45 ASN O O 10.332 4.772 3.175 1.00 . A A . 45 ASN O 1 1 20 12812 1 1 45 ASN OD1 O 6.982 5.992 4.449 1.00 . A A . 45 ASN OD1 1 1 20 12813 1 1 46 GLY C C 12.291 6.670 6.412 1.00 . A A . 46 GLY C 1 1 20 12814 1 1 46 GLY CA C 11.800 5.854 5.233 1.00 . A A . 46 GLY CA 1 1 20 12815 1 1 46 GLY H H 10.688 7.532 4.578 1.00 . A A . 46 GLY H 1 1 20 12816 1 1 46 GLY HA2 H 12.647 5.578 4.622 1.00 . A A . 46 GLY HA2 1 1 20 12817 1 1 46 GLY HA3 H 11.329 4.955 5.603 1.00 . A A . 46 GLY HA3 1 1 20 12818 1 1 46 GLY N N 10.847 6.579 4.413 1.00 . A A . 46 GLY N 1 1 20 12819 1 1 46 GLY O O 12.187 6.182 7.557 1.00 . A A . 46 GLY O 1 1 20 12820 1 1 46 GLY OXT O 12.780 7.798 6.191 1.00 . A A . 46 GLY OXT 1 1 21 12821 1 1 1 ALA C C -18.437 -5.562 7.642 1.00 . A A . 1 ALA C 1 1 21 12822 1 1 1 ALA CA C -18.629 -6.483 8.842 1.00 . A A . 1 ALA CA 1 1 21 12823 1 1 1 ALA CB C -18.257 -5.758 10.127 1.00 . A A . 1 ALA CB 1 1 21 12824 1 1 1 ALA H1 H -17.855 -8.008 7.699 1.00 . A A . 1 ALA H1 1 1 21 12825 1 1 1 ALA H2 H -16.849 -7.502 8.994 1.00 . A A . 1 ALA H2 1 1 21 12826 1 1 1 ALA H3 H -18.245 -8.449 9.308 1.00 . A A . 1 ALA H3 1 1 21 12827 1 1 1 ALA HA H -19.671 -6.762 8.904 1.00 . A A . 1 ALA HA 1 1 21 12828 1 1 1 ALA HB1 H -17.223 -5.958 10.366 1.00 . A A . 1 ALA HB1 1 1 21 12829 1 1 1 ALA HB2 H -18.397 -4.696 9.994 1.00 . A A . 1 ALA HB2 1 1 21 12830 1 1 1 ALA HB3 H -18.887 -6.107 10.932 1.00 . A A . 1 ALA HB3 1 1 21 12831 1 1 1 ALA N N -17.822 -7.722 8.698 1.00 . A A . 1 ALA N 1 1 21 12832 1 1 1 ALA O O -19.407 -5.105 7.036 1.00 . A A . 1 ALA O 1 1 21 12833 1 1 2 MET C C -16.377 -5.245 4.981 1.00 . A A . 2 MET C 1 1 21 12834 1 1 2 MET CA C -16.862 -4.428 6.174 1.00 . A A . 2 MET CA 1 1 21 12835 1 1 2 MET CB C -15.796 -3.406 6.574 1.00 . A A . 2 MET CB 1 1 21 12836 1 1 2 MET CE C -14.007 -2.145 9.173 1.00 . A A . 2 MET CE 1 1 21 12837 1 1 2 MET CG C -16.277 -2.397 7.605 1.00 . A A . 2 MET CG 1 1 21 12838 1 1 2 MET H H -16.450 -5.689 7.823 1.00 . A A . 2 MET H 1 1 21 12839 1 1 2 MET HA H -17.763 -3.904 5.893 1.00 . A A . 2 MET HA 1 1 21 12840 1 1 2 MET HB2 H -14.946 -3.930 6.984 1.00 . A A . 2 MET HB2 1 1 21 12841 1 1 2 MET HB3 H -15.483 -2.865 5.692 1.00 . A A . 2 MET HB3 1 1 21 12842 1 1 2 MET HE1 H -13.629 -3.022 8.669 1.00 . A A . 2 MET HE1 1 1 21 12843 1 1 2 MET HE2 H -13.179 -1.542 9.517 1.00 . A A . 2 MET HE2 1 1 21 12844 1 1 2 MET HE3 H -14.607 -2.446 10.019 1.00 . A A . 2 MET HE3 1 1 21 12845 1 1 2 MET HG2 H -17.132 -1.873 7.204 1.00 . A A . 2 MET HG2 1 1 21 12846 1 1 2 MET HG3 H -16.570 -2.929 8.498 1.00 . A A . 2 MET HG3 1 1 21 12847 1 1 2 MET N N -17.181 -5.294 7.302 1.00 . A A . 2 MET N 1 1 21 12848 1 1 2 MET O O -16.239 -6.465 5.066 1.00 . A A . 2 MET O 1 1 21 12849 1 1 2 MET SD S -15.010 -1.190 8.038 1.00 . A A . 2 MET SD 1 1 21 12850 1 1 3 ASP C C -14.152 -5.508 2.739 1.00 . A A . 3 ASP C 1 1 21 12851 1 1 3 ASP CA C -15.648 -5.226 2.658 1.00 . A A . 3 ASP CA 1 1 21 12852 1 1 3 ASP CB C -15.952 -4.366 1.430 1.00 . A A . 3 ASP CB 1 1 21 12853 1 1 3 ASP CG C -17.357 -4.584 0.904 1.00 . A A . 3 ASP CG 1 1 21 12854 1 1 3 ASP H H -16.247 -3.592 3.863 1.00 . A A . 3 ASP H 1 1 21 12855 1 1 3 ASP HA H -16.175 -6.164 2.568 1.00 . A A . 3 ASP HA 1 1 21 12856 1 1 3 ASP HB2 H -15.844 -3.324 1.693 1.00 . A A . 3 ASP HB2 1 1 21 12857 1 1 3 ASP HB3 H -15.250 -4.609 0.646 1.00 . A A . 3 ASP HB3 1 1 21 12858 1 1 3 ASP N N -16.118 -4.563 3.869 1.00 . A A . 3 ASP N 1 1 21 12859 1 1 3 ASP O O -13.498 -5.170 3.726 1.00 . A A . 3 ASP O 1 1 21 12860 1 1 3 ASP OD1 O -18.262 -4.853 1.722 1.00 . A A . 3 ASP OD1 1 1 21 12861 1 1 3 ASP OD2 O -17.552 -4.486 -0.326 1.00 . A A . 3 ASP OD2 1 1 21 12862 1 1 4 CYS C C -11.389 -5.310 1.050 1.00 . A A . 4 CYS C 1 1 21 12863 1 1 4 CYS CA C -12.195 -6.457 1.646 1.00 . A A . 4 CYS CA 1 1 21 12864 1 1 4 CYS CB C -11.967 -7.726 0.825 1.00 . A A . 4 CYS CB 1 1 21 12865 1 1 4 CYS H H -14.187 -6.373 0.936 1.00 . A A . 4 CYS H 1 1 21 12866 1 1 4 CYS HA H -11.858 -6.629 2.657 1.00 . A A . 4 CYS HA 1 1 21 12867 1 1 4 CYS HB2 H -12.570 -7.682 -0.069 1.00 . A A . 4 CYS HB2 1 1 21 12868 1 1 4 CYS HB3 H -10.924 -7.782 0.547 1.00 . A A . 4 CYS HB3 1 1 21 12869 1 1 4 CYS N N -13.615 -6.129 1.693 1.00 . A A . 4 CYS N 1 1 21 12870 1 1 4 CYS O O -11.816 -4.669 0.089 1.00 . A A . 4 CYS O 1 1 21 12871 1 1 4 CYS SG S -12.391 -9.265 1.704 1.00 . A A . 4 CYS SG 1 1 21 12872 1 1 5 THR C C -8.961 -4.231 -0.313 1.00 . A A . 5 THR C 1 1 21 12873 1 1 5 THR CA C -9.342 -3.999 1.148 1.00 . A A . 5 THR CA 1 1 21 12874 1 1 5 THR CB C -8.082 -3.928 2.015 1.00 . A A . 5 THR CB 1 1 21 12875 1 1 5 THR CG2 C -7.827 -2.550 2.588 1.00 . A A . 5 THR CG2 1 1 21 12876 1 1 5 THR H H -9.932 -5.613 2.381 1.00 . A A . 5 THR H 1 1 21 12877 1 1 5 THR HA H -9.877 -3.064 1.226 1.00 . A A . 5 THR HA 1 1 21 12878 1 1 5 THR HB H -7.227 -4.201 1.414 1.00 . A A . 5 THR HB 1 1 21 12879 1 1 5 THR HG1 H -7.349 -5.330 3.170 1.00 . A A . 5 THR HG1 1 1 21 12880 1 1 5 THR HG21 H -8.363 -1.814 2.007 1.00 . A A . 5 THR HG21 1 1 21 12881 1 1 5 THR HG22 H -8.167 -2.517 3.612 1.00 . A A . 5 THR HG22 1 1 21 12882 1 1 5 THR HG23 H -6.769 -2.336 2.552 1.00 . A A . 5 THR HG23 1 1 21 12883 1 1 5 THR N N -10.217 -5.062 1.623 1.00 . A A . 5 THR N 1 1 21 12884 1 1 5 THR O O -8.461 -5.297 -0.670 1.00 . A A . 5 THR O 1 1 21 12885 1 1 5 THR OG1 O -8.167 -4.833 3.102 1.00 . A A . 5 THR OG1 1 1 21 12886 1 1 6 THR C C -8.179 -2.072 -3.069 1.00 . A A . 6 THR C 1 1 21 12887 1 1 6 THR CA C -8.882 -3.332 -2.572 1.00 . A A . 6 THR CA 1 1 21 12888 1 1 6 THR CB C -10.155 -3.575 -3.385 1.00 . A A . 6 THR CB 1 1 21 12889 1 1 6 THR CG2 C -10.706 -4.975 -3.228 1.00 . A A . 6 THR CG2 1 1 21 12890 1 1 6 THR H H -9.603 -2.403 -0.810 1.00 . A A . 6 THR H 1 1 21 12891 1 1 6 THR HA H -8.219 -4.173 -2.701 1.00 . A A . 6 THR HA 1 1 21 12892 1 1 6 THR HB H -9.936 -3.421 -4.432 1.00 . A A . 6 THR HB 1 1 21 12893 1 1 6 THR HG1 H -11.405 -2.811 -2.085 1.00 . A A . 6 THR HG1 1 1 21 12894 1 1 6 THR HG21 H -10.075 -5.537 -2.555 1.00 . A A . 6 THR HG21 1 1 21 12895 1 1 6 THR HG22 H -10.731 -5.463 -4.191 1.00 . A A . 6 THR HG22 1 1 21 12896 1 1 6 THR HG23 H -11.707 -4.925 -2.824 1.00 . A A . 6 THR HG23 1 1 21 12897 1 1 6 THR N N -9.202 -3.229 -1.152 1.00 . A A . 6 THR N 1 1 21 12898 1 1 6 THR O O -8.597 -0.954 -2.766 1.00 . A A . 6 THR O 1 1 21 12899 1 1 6 THR OG1 O -11.173 -2.666 -3.005 1.00 . A A . 6 THR OG1 1 1 21 12900 1 1 7 GLY C C -4.879 -1.427 -4.492 1.00 . A A . 7 GLY C 1 1 21 12901 1 1 7 GLY CA C -6.365 -1.136 -4.368 1.00 . A A . 7 GLY CA 1 1 21 12902 1 1 7 GLY H H -6.826 -3.177 -4.046 1.00 . A A . 7 GLY H 1 1 21 12903 1 1 7 GLY HA2 H -6.502 -0.286 -3.717 1.00 . A A . 7 GLY HA2 1 1 21 12904 1 1 7 GLY HA3 H -6.754 -0.891 -5.346 1.00 . A A . 7 GLY HA3 1 1 21 12905 1 1 7 GLY N N -7.110 -2.263 -3.837 1.00 . A A . 7 GLY N 1 1 21 12906 1 1 7 GLY O O -4.484 -2.582 -4.646 1.00 . A A . 7 GLY O 1 1 21 12907 1 1 8 PRO C C -1.936 -1.115 -3.281 1.00 . A A . 8 PRO C 1 1 21 12908 1 1 8 PRO CA C -2.574 -0.555 -4.553 1.00 . A A . 8 PRO CA 1 1 21 12909 1 1 8 PRO CB C -2.081 0.867 -4.823 1.00 . A A . 8 PRO CB 1 1 21 12910 1 1 8 PRO CD C -4.409 1.025 -4.264 1.00 . A A . 8 PRO CD 1 1 21 12911 1 1 8 PRO CG C -3.089 1.745 -4.166 1.00 . A A . 8 PRO CG 1 1 21 12912 1 1 8 PRO HA H -2.317 -1.190 -5.388 1.00 . A A . 8 PRO HA 1 1 21 12913 1 1 8 PRO HB2 H -1.099 0.999 -4.392 1.00 . A A . 8 PRO HB2 1 1 21 12914 1 1 8 PRO HB3 H -2.040 1.043 -5.888 1.00 . A A . 8 PRO HB3 1 1 21 12915 1 1 8 PRO HD2 H -4.980 1.161 -3.358 1.00 . A A . 8 PRO HD2 1 1 21 12916 1 1 8 PRO HD3 H -4.967 1.378 -5.119 1.00 . A A . 8 PRO HD3 1 1 21 12917 1 1 8 PRO HG2 H -2.822 1.897 -3.132 1.00 . A A . 8 PRO HG2 1 1 21 12918 1 1 8 PRO HG3 H -3.141 2.692 -4.683 1.00 . A A . 8 PRO HG3 1 1 21 12919 1 1 8 PRO N N -4.025 -0.390 -4.436 1.00 . A A . 8 PRO N 1 1 21 12920 1 1 8 PRO O O -1.021 -1.936 -3.349 1.00 . A A . 8 PRO O 1 1 21 12921 1 1 9 CYS C C -2.871 -2.045 -0.123 1.00 . A A . 9 CYS C 1 1 21 12922 1 1 9 CYS CA C -1.879 -1.134 -0.845 1.00 . A A . 9 CYS CA 1 1 21 12923 1 1 9 CYS CB C -1.516 0.054 0.050 1.00 . A A . 9 CYS CB 1 1 21 12924 1 1 9 CYS H H -3.145 -0.013 -2.126 1.00 . A A . 9 CYS H 1 1 21 12925 1 1 9 CYS HA H -0.983 -1.699 -1.054 1.00 . A A . 9 CYS HA 1 1 21 12926 1 1 9 CYS HB2 H -0.830 0.696 -0.476 1.00 . A A . 9 CYS HB2 1 1 21 12927 1 1 9 CYS HB3 H -2.410 0.609 0.281 1.00 . A A . 9 CYS HB3 1 1 21 12928 1 1 9 CYS N N -2.417 -0.669 -2.123 1.00 . A A . 9 CYS N 1 1 21 12929 1 1 9 CYS O O -3.174 -1.844 1.053 1.00 . A A . 9 CYS O 1 1 21 12930 1 1 9 CYS SG S -0.733 -0.417 1.627 1.00 . A A . 9 CYS SG 1 1 21 12931 1 1 10 CYS C C -3.881 -5.433 -0.497 1.00 . A A . 10 CYS C 1 1 21 12932 1 1 10 CYS CA C -4.320 -3.993 -0.252 1.00 . A A . 10 CYS CA 1 1 21 12933 1 1 10 CYS CB C -5.714 -3.768 -0.835 1.00 . A A . 10 CYS CB 1 1 21 12934 1 1 10 CYS H H -3.091 -3.164 -1.764 1.00 . A A . 10 CYS H 1 1 21 12935 1 1 10 CYS HA H -4.353 -3.817 0.813 1.00 . A A . 10 CYS HA 1 1 21 12936 1 1 10 CYS HB2 H -5.643 -3.718 -1.911 1.00 . A A . 10 CYS HB2 1 1 21 12937 1 1 10 CYS HB3 H -6.349 -4.596 -0.558 1.00 . A A . 10 CYS HB3 1 1 21 12938 1 1 10 CYS N N -3.369 -3.051 -0.832 1.00 . A A . 10 CYS N 1 1 21 12939 1 1 10 CYS O O -3.646 -5.836 -1.636 1.00 . A A . 10 CYS O 1 1 21 12940 1 1 10 CYS SG S -6.515 -2.239 -0.262 1.00 . A A . 10 CYS SG 1 1 21 12941 1 1 11 ARG C C -4.582 -8.509 0.326 1.00 . A A . 11 ARG C 1 1 21 12942 1 1 11 ARG CA C -3.367 -7.599 0.485 1.00 . A A . 11 ARG CA 1 1 21 12943 1 1 11 ARG CB C -2.567 -8.005 1.724 1.00 . A A . 11 ARG CB 1 1 21 12944 1 1 11 ARG CD C -0.482 -9.247 2.375 1.00 . A A . 11 ARG CD 1 1 21 12945 1 1 11 ARG CG C -1.746 -9.270 1.532 1.00 . A A . 11 ARG CG 1 1 21 12946 1 1 11 ARG CZ C 1.919 -9.693 2.039 1.00 . A A . 11 ARG CZ 1 1 21 12947 1 1 11 ARG H H -3.978 -5.824 1.461 1.00 . A A . 11 ARG H 1 1 21 12948 1 1 11 ARG HA H -2.739 -7.702 -0.388 1.00 . A A . 11 ARG HA 1 1 21 12949 1 1 11 ARG HB2 H -1.894 -7.201 1.983 1.00 . A A . 11 ARG HB2 1 1 21 12950 1 1 11 ARG HB3 H -3.251 -8.167 2.544 1.00 . A A . 11 ARG HB3 1 1 21 12951 1 1 11 ARG HD2 H -0.233 -8.221 2.600 1.00 . A A . 11 ARG HD2 1 1 21 12952 1 1 11 ARG HD3 H -0.668 -9.782 3.295 1.00 . A A . 11 ARG HD3 1 1 21 12953 1 1 11 ARG HE H 0.448 -10.446 0.920 1.00 . A A . 11 ARG HE 1 1 21 12954 1 1 11 ARG HG2 H -2.343 -10.122 1.820 1.00 . A A . 11 ARG HG2 1 1 21 12955 1 1 11 ARG HG3 H -1.473 -9.355 0.490 1.00 . A A . 11 ARG HG3 1 1 21 12956 1 1 11 ARG HH11 H 1.504 -8.460 3.588 1.00 . A A . 11 ARG HH11 1 1 21 12957 1 1 11 ARG HH12 H 3.184 -8.790 3.331 1.00 . A A . 11 ARG HH12 1 1 21 12958 1 1 11 ARG HH21 H 2.657 -10.880 0.580 1.00 . A A . 11 ARG HH21 1 1 21 12959 1 1 11 ARG HH22 H 3.840 -10.163 1.623 1.00 . A A . 11 ARG HH22 1 1 21 12960 1 1 11 ARG N N -3.775 -6.203 0.581 1.00 . A A . 11 ARG N 1 1 21 12961 1 1 11 ARG NE N 0.647 -9.868 1.686 1.00 . A A . 11 ARG NE 1 1 21 12962 1 1 11 ARG NH1 N 2.227 -8.917 3.071 1.00 . A A . 11 ARG NH1 1 1 21 12963 1 1 11 ARG NH2 N 2.884 -10.295 1.358 1.00 . A A . 11 ARG NH2 1 1 21 12964 1 1 11 ARG O O -4.910 -9.287 1.221 1.00 . A A . 11 ARG O 1 1 21 12965 1 1 12 GLN C C -7.607 -8.783 -0.245 1.00 . A A . 12 GLN C 1 1 21 12966 1 1 12 GLN CA C -6.426 -9.215 -1.106 1.00 . A A . 12 GLN CA 1 1 21 12967 1 1 12 GLN CB C -6.127 -10.699 -0.875 1.00 . A A . 12 GLN CB 1 1 21 12968 1 1 12 GLN CD C -8.364 -11.440 -1.785 1.00 . A A . 12 GLN CD 1 1 21 12969 1 1 12 GLN CG C -6.860 -11.623 -1.833 1.00 . A A . 12 GLN CG 1 1 21 12970 1 1 12 GLN H H -4.933 -7.765 -1.497 1.00 . A A . 12 GLN H 1 1 21 12971 1 1 12 GLN HA H -6.684 -9.069 -2.140 1.00 . A A . 12 GLN HA 1 1 21 12972 1 1 12 GLN HB2 H -5.066 -10.863 -0.991 1.00 . A A . 12 GLN HB2 1 1 21 12973 1 1 12 GLN HB3 H -6.414 -10.959 0.133 1.00 . A A . 12 GLN HB3 1 1 21 12974 1 1 12 GLN HE21 H -8.380 -10.863 -3.687 1.00 . A A . 12 GLN HE21 1 1 21 12975 1 1 12 GLN HE22 H -9.918 -10.898 -2.901 1.00 . A A . 12 GLN HE22 1 1 21 12976 1 1 12 GLN HG2 H -6.521 -11.421 -2.838 1.00 . A A . 12 GLN HG2 1 1 21 12977 1 1 12 GLN HG3 H -6.628 -12.646 -1.575 1.00 . A A . 12 GLN HG3 1 1 21 12978 1 1 12 GLN N N -5.245 -8.404 -0.822 1.00 . A A . 12 GLN N 1 1 21 12979 1 1 12 GLN NE2 N -8.946 -11.025 -2.904 1.00 . A A . 12 GLN NE2 1 1 21 12980 1 1 12 GLN O O -8.613 -8.289 -0.754 1.00 . A A . 12 GLN O 1 1 21 12981 1 1 12 GLN OE1 O -8.996 -11.669 -0.753 1.00 . A A . 12 GLN OE1 1 1 21 12982 1 1 13 CYS C C -7.943 -8.134 3.324 1.00 . A A . 13 CYS C 1 1 21 12983 1 1 13 CYS CA C -8.530 -8.611 1.998 1.00 . A A . 13 CYS CA 1 1 21 12984 1 1 13 CYS CB C -9.456 -9.805 2.239 1.00 . A A . 13 CYS CB 1 1 21 12985 1 1 13 CYS H H -6.651 -9.375 1.398 1.00 . A A . 13 CYS H 1 1 21 12986 1 1 13 CYS HA H -9.101 -7.807 1.560 1.00 . A A . 13 CYS HA 1 1 21 12987 1 1 13 CYS HB2 H -9.749 -10.222 1.287 1.00 . A A . 13 CYS HB2 1 1 21 12988 1 1 13 CYS HB3 H -8.923 -10.555 2.806 1.00 . A A . 13 CYS HB3 1 1 21 12989 1 1 13 CYS N N -7.476 -8.976 1.059 1.00 . A A . 13 CYS N 1 1 21 12990 1 1 13 CYS O O -8.579 -8.254 4.371 1.00 . A A . 13 CYS O 1 1 21 12991 1 1 13 CYS SG S -10.978 -9.396 3.154 1.00 . A A . 13 CYS SG 1 1 21 12992 1 1 14 LYS C C -5.134 -5.942 4.144 1.00 . A A . 14 LYS C 1 1 21 12993 1 1 14 LYS CA C -6.069 -7.098 4.476 1.00 . A A . 14 LYS CA 1 1 21 12994 1 1 14 LYS CB C -5.286 -8.226 5.152 1.00 . A A . 14 LYS CB 1 1 21 12995 1 1 14 LYS CD C -4.635 -9.364 7.295 1.00 . A A . 14 LYS CD 1 1 21 12996 1 1 14 LYS CE C -5.468 -10.616 7.076 1.00 . A A . 14 LYS CE 1 1 21 12997 1 1 14 LYS CG C -5.289 -8.143 6.670 1.00 . A A . 14 LYS CG 1 1 21 12998 1 1 14 LYS H H -6.268 -7.519 2.413 1.00 . A A . 14 LYS H 1 1 21 12999 1 1 14 LYS HA H -6.832 -6.746 5.153 1.00 . A A . 14 LYS HA 1 1 21 13000 1 1 14 LYS HB2 H -5.719 -9.172 4.864 1.00 . A A . 14 LYS HB2 1 1 21 13001 1 1 14 LYS HB3 H -4.261 -8.190 4.813 1.00 . A A . 14 LYS HB3 1 1 21 13002 1 1 14 LYS HD2 H -3.663 -9.508 6.848 1.00 . A A . 14 LYS HD2 1 1 21 13003 1 1 14 LYS HD3 H -4.524 -9.197 8.357 1.00 . A A . 14 LYS HD3 1 1 21 13004 1 1 14 LYS HE2 H -5.426 -11.222 7.968 1.00 . A A . 14 LYS HE2 1 1 21 13005 1 1 14 LYS HE3 H -6.491 -10.324 6.889 1.00 . A A . 14 LYS HE3 1 1 21 13006 1 1 14 LYS HG2 H -4.746 -7.261 6.973 1.00 . A A . 14 LYS HG2 1 1 21 13007 1 1 14 LYS HG3 H -6.310 -8.076 7.015 1.00 . A A . 14 LYS HG3 1 1 21 13008 1 1 14 LYS HZ1 H -3.966 -11.222 5.756 1.00 . A A . 14 LYS HZ1 1 1 21 13009 1 1 14 LYS HZ2 H -5.090 -12.433 6.117 1.00 . A A . 14 LYS HZ2 1 1 21 13010 1 1 14 LYS HZ3 H -5.509 -11.177 5.064 1.00 . A A . 14 LYS HZ3 1 1 21 13011 1 1 14 LYS N N -6.730 -7.591 3.275 1.00 . A A . 14 LYS N 1 1 21 13012 1 1 14 LYS NZ N -4.974 -11.418 5.923 1.00 . A A . 14 LYS NZ 1 1 21 13013 1 1 14 LYS O O -4.215 -6.087 3.338 1.00 . A A . 14 LYS O 1 1 21 13014 1 1 15 LEU C C -3.066 -3.957 4.618 1.00 . A A . 15 LEU C 1 1 21 13015 1 1 15 LEU CA C -4.550 -3.610 4.546 1.00 . A A . 15 LEU CA 1 1 21 13016 1 1 15 LEU CB C -4.885 -2.529 5.578 1.00 . A A . 15 LEU CB 1 1 21 13017 1 1 15 LEU CD1 C -6.128 -0.359 5.767 1.00 . A A . 15 LEU CD1 1 1 21 13018 1 1 15 LEU CD2 C -3.725 -0.369 5.062 1.00 . A A . 15 LEU CD2 1 1 21 13019 1 1 15 LEU CG C -5.048 -1.119 5.010 1.00 . A A . 15 LEU CG 1 1 21 13020 1 1 15 LEU H H -6.120 -4.743 5.404 1.00 . A A . 15 LEU H 1 1 21 13021 1 1 15 LEU HA H -4.773 -3.234 3.559 1.00 . A A . 15 LEU HA 1 1 21 13022 1 1 15 LEU HB2 H -5.806 -2.806 6.070 1.00 . A A . 15 LEU HB2 1 1 21 13023 1 1 15 LEU HB3 H -4.096 -2.506 6.315 1.00 . A A . 15 LEU HB3 1 1 21 13024 1 1 15 LEU HD11 H -6.651 -1.035 6.427 1.00 . A A . 15 LEU HD11 1 1 21 13025 1 1 15 LEU HD12 H -5.674 0.431 6.348 1.00 . A A . 15 LEU HD12 1 1 21 13026 1 1 15 LEU HD13 H -6.827 0.069 5.064 1.00 . A A . 15 LEU HD13 1 1 21 13027 1 1 15 LEU HD21 H -2.917 -1.073 5.201 1.00 . A A . 15 LEU HD21 1 1 21 13028 1 1 15 LEU HD22 H -3.578 0.168 4.137 1.00 . A A . 15 LEU HD22 1 1 21 13029 1 1 15 LEU HD23 H -3.738 0.329 5.886 1.00 . A A . 15 LEU HD23 1 1 21 13030 1 1 15 LEU HG H -5.353 -1.188 3.975 1.00 . A A . 15 LEU HG 1 1 21 13031 1 1 15 LEU N N -5.373 -4.794 4.772 1.00 . A A . 15 LEU N 1 1 21 13032 1 1 15 LEU O O -2.573 -4.402 5.654 1.00 . A A . 15 LEU O 1 1 21 13033 1 1 16 LYS C C -0.197 -3.460 4.650 1.00 . A A . 16 LYS C 1 1 21 13034 1 1 16 LYS CA C -0.933 -4.056 3.448 1.00 . A A . 16 LYS CA 1 1 21 13035 1 1 16 LYS CB C -0.333 -3.521 2.145 1.00 . A A . 16 LYS CB 1 1 21 13036 1 1 16 LYS CD C 0.425 -4.215 -0.147 1.00 . A A . 16 LYS CD 1 1 21 13037 1 1 16 LYS CE C 0.693 -5.434 -1.016 1.00 . A A . 16 LYS CE 1 1 21 13038 1 1 16 LYS CG C 0.388 -4.580 1.328 1.00 . A A . 16 LYS CG 1 1 21 13039 1 1 16 LYS H H -2.809 -3.404 2.712 1.00 . A A . 16 LYS H 1 1 21 13040 1 1 16 LYS HA H -0.824 -5.131 3.468 1.00 . A A . 16 LYS HA 1 1 21 13041 1 1 16 LYS HB2 H -1.127 -3.109 1.540 1.00 . A A . 16 LYS HB2 1 1 21 13042 1 1 16 LYS HB3 H 0.372 -2.737 2.380 1.00 . A A . 16 LYS HB3 1 1 21 13043 1 1 16 LYS HD2 H -0.526 -3.788 -0.427 1.00 . A A . 16 LYS HD2 1 1 21 13044 1 1 16 LYS HD3 H 1.209 -3.489 -0.309 1.00 . A A . 16 LYS HD3 1 1 21 13045 1 1 16 LYS HE2 H -0.052 -6.184 -0.800 1.00 . A A . 16 LYS HE2 1 1 21 13046 1 1 16 LYS HE3 H 0.620 -5.143 -2.054 1.00 . A A . 16 LYS HE3 1 1 21 13047 1 1 16 LYS HG2 H 1.400 -4.674 1.691 1.00 . A A . 16 LYS HG2 1 1 21 13048 1 1 16 LYS HG3 H -0.127 -5.522 1.444 1.00 . A A . 16 LYS HG3 1 1 21 13049 1 1 16 LYS HZ1 H 2.321 -5.854 0.224 1.00 . A A . 16 LYS HZ1 1 1 21 13050 1 1 16 LYS HZ2 H 2.039 -7.030 -0.959 1.00 . A A . 16 LYS HZ2 1 1 21 13051 1 1 16 LYS HZ3 H 2.746 -5.553 -1.385 1.00 . A A . 16 LYS HZ3 1 1 21 13052 1 1 16 LYS N N -2.360 -3.757 3.509 1.00 . A A . 16 LYS N 1 1 21 13053 1 1 16 LYS NZ N 2.044 -6.008 -0.766 1.00 . A A . 16 LYS NZ 1 1 21 13054 1 1 16 LYS O O -0.552 -2.386 5.134 1.00 . A A . 16 LYS O 1 1 21 13055 1 1 17 PRO C C 2.390 -2.406 6.005 1.00 . A A . 17 PRO C 1 1 21 13056 1 1 17 PRO CA C 1.621 -3.688 6.301 1.00 . A A . 17 PRO CA 1 1 21 13057 1 1 17 PRO CB C 2.595 -4.840 6.570 1.00 . A A . 17 PRO CB 1 1 21 13058 1 1 17 PRO CD C 1.331 -5.446 4.636 1.00 . A A . 17 PRO CD 1 1 21 13059 1 1 17 PRO CG C 2.681 -5.580 5.279 1.00 . A A . 17 PRO CG 1 1 21 13060 1 1 17 PRO HA H 0.995 -3.535 7.168 1.00 . A A . 17 PRO HA 1 1 21 13061 1 1 17 PRO HB2 H 3.555 -4.441 6.861 1.00 . A A . 17 PRO HB2 1 1 21 13062 1 1 17 PRO HB3 H 2.205 -5.468 7.358 1.00 . A A . 17 PRO HB3 1 1 21 13063 1 1 17 PRO HD2 H 1.425 -5.423 3.560 1.00 . A A . 17 PRO HD2 1 1 21 13064 1 1 17 PRO HD3 H 0.683 -6.254 4.943 1.00 . A A . 17 PRO HD3 1 1 21 13065 1 1 17 PRO HG2 H 3.441 -5.137 4.653 1.00 . A A . 17 PRO HG2 1 1 21 13066 1 1 17 PRO HG3 H 2.906 -6.619 5.466 1.00 . A A . 17 PRO HG3 1 1 21 13067 1 1 17 PRO N N 0.840 -4.154 5.150 1.00 . A A . 17 PRO N 1 1 21 13068 1 1 17 PRO O O 2.827 -2.178 4.878 1.00 . A A . 17 PRO O 1 1 21 13069 1 1 18 ALA C C 4.739 -0.570 6.538 1.00 . A A . 18 ALA C 1 1 21 13070 1 1 18 ALA CA C 3.275 -0.318 6.883 1.00 . A A . 18 ALA CA 1 1 21 13071 1 1 18 ALA CB C 3.164 0.506 8.157 1.00 . A A . 18 ALA CB 1 1 21 13072 1 1 18 ALA H H 2.183 -1.816 7.903 1.00 . A A . 18 ALA H 1 1 21 13073 1 1 18 ALA HA H 2.816 0.240 6.079 1.00 . A A . 18 ALA HA 1 1 21 13074 1 1 18 ALA HB1 H 3.766 0.055 8.931 1.00 . A A . 18 ALA HB1 1 1 21 13075 1 1 18 ALA HB2 H 3.515 1.510 7.968 1.00 . A A . 18 ALA HB2 1 1 21 13076 1 1 18 ALA HB3 H 2.132 0.539 8.475 1.00 . A A . 18 ALA HB3 1 1 21 13077 1 1 18 ALA N N 2.554 -1.575 7.028 1.00 . A A . 18 ALA N 1 1 21 13078 1 1 18 ALA O O 5.231 -1.691 6.670 1.00 . A A . 18 ALA O 1 1 21 13079 1 1 19 GLY C C 7.055 -0.740 4.691 1.00 . A A . 19 GLY C 1 1 21 13080 1 1 19 GLY CA C 6.830 0.336 5.736 1.00 . A A . 19 GLY CA 1 1 21 13081 1 1 19 GLY H H 4.986 1.344 6.007 1.00 . A A . 19 GLY H 1 1 21 13082 1 1 19 GLY HA2 H 7.395 0.086 6.622 1.00 . A A . 19 GLY HA2 1 1 21 13083 1 1 19 GLY HA3 H 7.186 1.279 5.348 1.00 . A A . 19 GLY HA3 1 1 21 13084 1 1 19 GLY N N 5.430 0.474 6.094 1.00 . A A . 19 GLY N 1 1 21 13085 1 1 19 GLY O O 8.130 -1.336 4.623 1.00 . A A . 19 GLY O 1 1 21 13086 1 1 20 THR C C 5.650 -1.420 1.497 1.00 . A A . 20 THR C 1 1 21 13087 1 1 20 THR CA C 6.115 -1.997 2.829 1.00 . A A . 20 THR CA 1 1 21 13088 1 1 20 THR CB C 5.264 -3.215 3.199 1.00 . A A . 20 THR CB 1 1 21 13089 1 1 20 THR CG2 C 5.275 -4.303 2.146 1.00 . A A . 20 THR CG2 1 1 21 13090 1 1 20 THR H H 5.204 -0.479 3.982 1.00 . A A . 20 THR H 1 1 21 13091 1 1 20 THR HA H 7.147 -2.302 2.737 1.00 . A A . 20 THR HA 1 1 21 13092 1 1 20 THR HB H 4.241 -2.897 3.334 1.00 . A A . 20 THR HB 1 1 21 13093 1 1 20 THR HG1 H 6.644 -4.015 4.336 1.00 . A A . 20 THR HG1 1 1 21 13094 1 1 20 THR HG21 H 5.630 -3.896 1.211 1.00 . A A . 20 THR HG21 1 1 21 13095 1 1 20 THR HG22 H 5.928 -5.103 2.462 1.00 . A A . 20 THR HG22 1 1 21 13096 1 1 20 THR HG23 H 4.273 -4.686 2.015 1.00 . A A . 20 THR HG23 1 1 21 13097 1 1 20 THR N N 6.034 -0.989 3.876 1.00 . A A . 20 THR N 1 1 21 13098 1 1 20 THR O O 4.561 -0.854 1.403 1.00 . A A . 20 THR O 1 1 21 13099 1 1 20 THR OG1 O 5.714 -3.789 4.413 1.00 . A A . 20 THR OG1 1 1 21 13100 1 1 21 THR C C 4.785 -1.556 -1.311 1.00 . A A . 21 THR C 1 1 21 13101 1 1 21 THR CA C 6.150 -1.051 -0.854 1.00 . A A . 21 THR CA 1 1 21 13102 1 1 21 THR CB C 7.225 -1.450 -1.867 1.00 . A A . 21 THR CB 1 1 21 13103 1 1 21 THR CG2 C 7.762 -0.274 -2.649 1.00 . A A . 21 THR CG2 1 1 21 13104 1 1 21 THR H H 7.336 -2.022 0.607 1.00 . A A . 21 THR H 1 1 21 13105 1 1 21 THR HA H 6.115 0.027 -0.790 1.00 . A A . 21 THR HA 1 1 21 13106 1 1 21 THR HB H 6.802 -2.151 -2.572 1.00 . A A . 21 THR HB 1 1 21 13107 1 1 21 THR HG1 H 8.108 -2.994 -1.044 1.00 . A A . 21 THR HG1 1 1 21 13108 1 1 21 THR HG21 H 7.934 0.555 -1.978 1.00 . A A . 21 THR HG21 1 1 21 13109 1 1 21 THR HG22 H 8.691 -0.551 -3.125 1.00 . A A . 21 THR HG22 1 1 21 13110 1 1 21 THR HG23 H 7.044 0.015 -3.402 1.00 . A A . 21 THR HG23 1 1 21 13111 1 1 21 THR N N 6.480 -1.564 0.471 1.00 . A A . 21 THR N 1 1 21 13112 1 1 21 THR O O 4.617 -2.737 -1.612 1.00 . A A . 21 THR O 1 1 21 13113 1 1 21 THR OG1 O 8.321 -2.074 -1.221 1.00 . A A . 21 THR OG1 1 1 21 13114 1 1 22 CYS C C 2.299 -0.877 -3.278 1.00 . A A . 22 CYS C 1 1 21 13115 1 1 22 CYS CA C 2.462 -1.003 -1.770 1.00 . A A . 22 CYS CA 1 1 21 13116 1 1 22 CYS CB C 1.440 -0.110 -1.066 1.00 . A A . 22 CYS CB 1 1 21 13117 1 1 22 CYS H H 4.010 0.275 -1.100 1.00 . A A . 22 CYS H 1 1 21 13118 1 1 22 CYS HA H 2.286 -2.028 -1.485 1.00 . A A . 22 CYS HA 1 1 21 13119 1 1 22 CYS HB2 H 0.455 -0.342 -1.441 1.00 . A A . 22 CYS HB2 1 1 21 13120 1 1 22 CYS HB3 H 1.472 -0.307 -0.004 1.00 . A A . 22 CYS HB3 1 1 21 13121 1 1 22 CYS N N 3.814 -0.651 -1.355 1.00 . A A . 22 CYS N 1 1 21 13122 1 1 22 CYS O O 1.678 -1.726 -3.918 1.00 . A A . 22 CYS O 1 1 21 13123 1 1 22 CYS SG S 1.717 1.677 -1.309 1.00 . A A . 22 CYS SG 1 1 21 13124 1 1 23 TRP C C 3.912 -0.213 -6.024 1.00 . A A . 23 TRP C 1 1 21 13125 1 1 23 TRP CA C 2.752 0.428 -5.274 1.00 . A A . 23 TRP CA 1 1 21 13126 1 1 23 TRP CB C 2.709 1.930 -5.564 1.00 . A A . 23 TRP CB 1 1 21 13127 1 1 23 TRP CD1 C 1.062 1.428 -7.459 1.00 . A A . 23 TRP CD1 1 1 21 13128 1 1 23 TRP CD2 C 1.477 3.606 -7.160 1.00 . A A . 23 TRP CD2 1 1 21 13129 1 1 23 TRP CE2 C 0.563 3.463 -8.220 1.00 . A A . 23 TRP CE2 1 1 21 13130 1 1 23 TRP CE3 C 1.885 4.890 -6.791 1.00 . A A . 23 TRP CE3 1 1 21 13131 1 1 23 TRP CG C 1.782 2.290 -6.685 1.00 . A A . 23 TRP CG 1 1 21 13132 1 1 23 TRP CH2 C 0.469 5.799 -8.534 1.00 . A A . 23 TRP CH2 1 1 21 13133 1 1 23 TRP CZ2 C 0.053 4.554 -8.915 1.00 . A A . 23 TRP CZ2 1 1 21 13134 1 1 23 TRP CZ3 C 1.378 5.973 -7.483 1.00 . A A . 23 TRP CZ3 1 1 21 13135 1 1 23 TRP H H 3.326 0.838 -3.280 1.00 . A A . 23 TRP H 1 1 21 13136 1 1 23 TRP HA H 1.836 -0.018 -5.615 1.00 . A A . 23 TRP HA 1 1 21 13137 1 1 23 TRP HB2 H 2.380 2.452 -4.678 1.00 . A A . 23 TRP HB2 1 1 21 13138 1 1 23 TRP HB3 H 3.701 2.268 -5.829 1.00 . A A . 23 TRP HB3 1 1 21 13139 1 1 23 TRP HD1 H 1.081 0.356 -7.349 1.00 . A A . 23 TRP HD1 1 1 21 13140 1 1 23 TRP HE1 H -0.270 1.730 -9.052 1.00 . A A . 23 TRP HE1 1 1 21 13141 1 1 23 TRP HE3 H 2.584 5.043 -5.983 1.00 . A A . 23 TRP HE3 1 1 21 13142 1 1 23 TRP HH2 H 0.101 6.674 -9.048 1.00 . A A . 23 TRP HH2 1 1 21 13143 1 1 23 TRP HZ2 H -0.650 4.436 -9.724 1.00 . A A . 23 TRP HZ2 1 1 21 13144 1 1 23 TRP HZ3 H 1.683 6.973 -7.214 1.00 . A A . 23 TRP HZ3 1 1 21 13145 1 1 23 TRP N N 2.850 0.192 -3.841 1.00 . A A . 23 TRP N 1 1 21 13146 1 1 23 TRP NE1 N 0.327 2.126 -8.384 1.00 . A A . 23 TRP NE1 1 1 21 13147 1 1 23 TRP O O 3.710 -1.071 -6.882 1.00 . A A . 23 TRP O 1 1 21 13148 1 1 24 LYS C C 6.168 -0.377 -7.852 1.00 . A A . 24 LYS C 1 1 21 13149 1 1 24 LYS CA C 6.331 -0.301 -6.335 1.00 . A A . 24 LYS CA 1 1 21 13150 1 1 24 LYS CB C 6.689 -1.679 -5.766 1.00 . A A . 24 LYS CB 1 1 21 13151 1 1 24 LYS CD C 4.624 -2.986 -5.163 1.00 . A A . 24 LYS CD 1 1 21 13152 1 1 24 LYS CE C 4.825 -4.255 -4.350 1.00 . A A . 24 LYS CE 1 1 21 13153 1 1 24 LYS CG C 5.738 -2.793 -6.181 1.00 . A A . 24 LYS CG 1 1 21 13154 1 1 24 LYS H H 5.207 0.906 -5.008 1.00 . A A . 24 LYS H 1 1 21 13155 1 1 24 LYS HA H 7.134 0.383 -6.112 1.00 . A A . 24 LYS HA 1 1 21 13156 1 1 24 LYS HB2 H 7.681 -1.942 -6.098 1.00 . A A . 24 LYS HB2 1 1 21 13157 1 1 24 LYS HB3 H 6.686 -1.617 -4.688 1.00 . A A . 24 LYS HB3 1 1 21 13158 1 1 24 LYS HD2 H 4.610 -2.140 -4.493 1.00 . A A . 24 LYS HD2 1 1 21 13159 1 1 24 LYS HD3 H 3.681 -3.049 -5.686 1.00 . A A . 24 LYS HD3 1 1 21 13160 1 1 24 LYS HE2 H 3.999 -4.360 -3.662 1.00 . A A . 24 LYS HE2 1 1 21 13161 1 1 24 LYS HE3 H 4.842 -5.100 -5.023 1.00 . A A . 24 LYS HE3 1 1 21 13162 1 1 24 LYS HG2 H 5.301 -2.547 -7.136 1.00 . A A . 24 LYS HG2 1 1 21 13163 1 1 24 LYS HG3 H 6.297 -3.713 -6.268 1.00 . A A . 24 LYS HG3 1 1 21 13164 1 1 24 LYS HZ1 H 6.760 -3.546 -4.004 1.00 . A A . 24 LYS HZ1 1 1 21 13165 1 1 24 LYS HZ2 H 5.912 -3.939 -2.594 1.00 . A A . 24 LYS HZ2 1 1 21 13166 1 1 24 LYS HZ3 H 6.537 -5.167 -3.576 1.00 . A A . 24 LYS HZ3 1 1 21 13167 1 1 24 LYS N N 5.123 0.217 -5.696 1.00 . A A . 24 LYS N 1 1 21 13168 1 1 24 LYS NZ N 6.097 -4.225 -3.577 1.00 . A A . 24 LYS NZ 1 1 21 13169 1 1 24 LYS O O 6.757 -1.236 -8.508 1.00 . A A . 24 LYS O 1 1 21 13170 1 1 25 THR C C 6.428 0.788 -10.601 1.00 . A A . 25 THR C 1 1 21 13171 1 1 25 THR CA C 5.124 0.573 -9.838 1.00 . A A . 25 THR CA 1 1 21 13172 1 1 25 THR CB C 4.129 1.686 -10.176 1.00 . A A . 25 THR CB 1 1 21 13173 1 1 25 THR CG2 C 3.554 1.575 -11.571 1.00 . A A . 25 THR CG2 1 1 21 13174 1 1 25 THR H H 4.926 1.190 -7.823 1.00 . A A . 25 THR H 1 1 21 13175 1 1 25 THR HA H 4.702 -0.377 -10.131 1.00 . A A . 25 THR HA 1 1 21 13176 1 1 25 THR HB H 4.629 2.640 -10.101 1.00 . A A . 25 THR HB 1 1 21 13177 1 1 25 THR HG1 H 2.516 0.891 -9.404 1.00 . A A . 25 THR HG1 1 1 21 13178 1 1 25 THR HG21 H 4.356 1.450 -12.282 1.00 . A A . 25 THR HG21 1 1 21 13179 1 1 25 THR HG22 H 2.891 0.724 -11.620 1.00 . A A . 25 THR HG22 1 1 21 13180 1 1 25 THR HG23 H 3.003 2.475 -11.803 1.00 . A A . 25 THR HG23 1 1 21 13181 1 1 25 THR N N 5.366 0.531 -8.400 1.00 . A A . 25 THR N 1 1 21 13182 1 1 25 THR O O 7.297 1.542 -10.163 1.00 . A A . 25 THR O 1 1 21 13183 1 1 25 THR OG1 O 3.046 1.680 -9.266 1.00 . A A . 25 THR OG1 1 1 21 13184 1 1 26 SER C C 8.089 1.700 -12.850 1.00 . A A . 26 SER C 1 1 21 13185 1 1 26 SER CA C 7.756 0.237 -12.569 1.00 . A A . 26 SER CA 1 1 21 13186 1 1 26 SER CB C 7.568 -0.517 -13.886 1.00 . A A . 26 SER CB 1 1 21 13187 1 1 26 SER H H 5.830 -0.467 -12.039 1.00 . A A . 26 SER H 1 1 21 13188 1 1 26 SER HA H 8.576 -0.208 -12.025 1.00 . A A . 26 SER HA 1 1 21 13189 1 1 26 SER HB2 H 8.486 -0.480 -14.454 1.00 . A A . 26 SER HB2 1 1 21 13190 1 1 26 SER HB3 H 7.316 -1.546 -13.677 1.00 . A A . 26 SER HB3 1 1 21 13191 1 1 26 SER HG H 6.800 0.931 -14.960 1.00 . A A . 26 SER HG 1 1 21 13192 1 1 26 SER N N 6.557 0.119 -11.743 1.00 . A A . 26 SER N 1 1 21 13193 1 1 26 SER O O 9.246 2.050 -13.081 1.00 . A A . 26 SER O 1 1 21 13194 1 1 26 SER OG O 6.531 0.059 -14.661 1.00 . A A . 26 SER OG 1 1 21 13195 1 1 27 VAL C C 7.360 4.755 -11.773 1.00 . A A . 27 VAL C 1 1 21 13196 1 1 27 VAL CA C 7.249 3.973 -13.078 1.00 . A A . 27 VAL CA 1 1 21 13197 1 1 27 VAL CB C 6.086 4.550 -13.909 1.00 . A A . 27 VAL CB 1 1 21 13198 1 1 27 VAL CG1 C 4.771 4.426 -13.153 1.00 . A A . 27 VAL CG1 1 1 21 13199 1 1 27 VAL CG2 C 6.360 6.001 -14.277 1.00 . A A . 27 VAL CG2 1 1 21 13200 1 1 27 VAL H H 6.167 2.210 -12.637 1.00 . A A . 27 VAL H 1 1 21 13201 1 1 27 VAL HA H 8.163 4.098 -13.641 1.00 . A A . 27 VAL HA 1 1 21 13202 1 1 27 VAL HB H 6.005 3.979 -14.823 1.00 . A A . 27 VAL HB 1 1 21 13203 1 1 27 VAL HG11 H 4.845 4.952 -12.212 1.00 . A A . 27 VAL HG11 1 1 21 13204 1 1 27 VAL HG12 H 3.974 4.854 -13.742 1.00 . A A . 27 VAL HG12 1 1 21 13205 1 1 27 VAL HG13 H 4.561 3.383 -12.966 1.00 . A A . 27 VAL HG13 1 1 21 13206 1 1 27 VAL HG21 H 7.391 6.107 -14.581 1.00 . A A . 27 VAL HG21 1 1 21 13207 1 1 27 VAL HG22 H 5.713 6.295 -15.091 1.00 . A A . 27 VAL HG22 1 1 21 13208 1 1 27 VAL HG23 H 6.171 6.632 -13.421 1.00 . A A . 27 VAL HG23 1 1 21 13209 1 1 27 VAL N N 7.066 2.549 -12.827 1.00 . A A . 27 VAL N 1 1 21 13210 1 1 27 VAL O O 7.935 5.842 -11.738 1.00 . A A . 27 VAL O 1 1 21 13211 1 1 28 SER C C 6.650 3.857 -8.268 1.00 . A A . 28 SER C 1 1 21 13212 1 1 28 SER CA C 6.827 4.861 -9.404 1.00 . A A . 28 SER CA 1 1 21 13213 1 1 28 SER CB C 5.728 5.921 -9.337 1.00 . A A . 28 SER CB 1 1 21 13214 1 1 28 SER H H 6.344 3.337 -10.791 1.00 . A A . 28 SER H 1 1 21 13215 1 1 28 SER HA H 7.786 5.343 -9.298 1.00 . A A . 28 SER HA 1 1 21 13216 1 1 28 SER HB2 H 5.471 6.234 -10.338 1.00 . A A . 28 SER HB2 1 1 21 13217 1 1 28 SER HB3 H 4.856 5.503 -8.855 1.00 . A A . 28 SER HB3 1 1 21 13218 1 1 28 SER HG H 5.932 7.853 -9.083 1.00 . A A . 28 SER HG 1 1 21 13219 1 1 28 SER N N 6.796 4.202 -10.703 1.00 . A A . 28 SER N 1 1 21 13220 1 1 28 SER O O 5.691 3.087 -8.249 1.00 . A A . 28 SER O 1 1 21 13221 1 1 28 SER OG O 6.157 7.054 -8.601 1.00 . A A . 28 SER OG 1 1 21 13222 1 1 29 SER C C 7.279 3.749 -4.883 1.00 . A A . 29 SER C 1 1 21 13223 1 1 29 SER CA C 7.523 2.972 -6.173 1.00 . A A . 29 SER CA 1 1 21 13224 1 1 29 SER CB C 8.823 2.174 -6.064 1.00 . A A . 29 SER CB 1 1 21 13225 1 1 29 SER H H 8.318 4.517 -7.384 1.00 . A A . 29 SER H 1 1 21 13226 1 1 29 SER HA H 6.700 2.289 -6.330 1.00 . A A . 29 SER HA 1 1 21 13227 1 1 29 SER HB2 H 9.659 2.856 -6.014 1.00 . A A . 29 SER HB2 1 1 21 13228 1 1 29 SER HB3 H 8.798 1.569 -5.169 1.00 . A A . 29 SER HB3 1 1 21 13229 1 1 29 SER HG H 9.888 1.420 -7.526 1.00 . A A . 29 SER HG 1 1 21 13230 1 1 29 SER N N 7.579 3.877 -7.317 1.00 . A A . 29 SER N 1 1 21 13231 1 1 29 SER O O 8.085 4.594 -4.494 1.00 . A A . 29 SER O 1 1 21 13232 1 1 29 SER OG O 8.996 1.324 -7.185 1.00 . A A . 29 SER OG 1 1 21 13233 1 1 30 HIS C C 5.599 3.139 -1.851 1.00 . A A . 30 HIS C 1 1 21 13234 1 1 30 HIS CA C 5.803 4.138 -2.986 1.00 . A A . 30 HIS CA 1 1 21 13235 1 1 30 HIS CB C 4.530 4.963 -3.183 1.00 . A A . 30 HIS CB 1 1 21 13236 1 1 30 HIS CD2 C 4.960 5.602 -5.660 1.00 . A A . 30 HIS CD2 1 1 21 13237 1 1 30 HIS CE1 C 4.330 7.698 -5.565 1.00 . A A . 30 HIS CE1 1 1 21 13238 1 1 30 HIS CG C 4.573 5.852 -4.387 1.00 . A A . 30 HIS CG 1 1 21 13239 1 1 30 HIS H H 5.553 2.782 -4.592 1.00 . A A . 30 HIS H 1 1 21 13240 1 1 30 HIS HA H 6.614 4.802 -2.725 1.00 . A A . 30 HIS HA 1 1 21 13241 1 1 30 HIS HB2 H 3.690 4.293 -3.297 1.00 . A A . 30 HIS HB2 1 1 21 13242 1 1 30 HIS HB3 H 4.373 5.585 -2.314 1.00 . A A . 30 HIS HB3 1 1 21 13243 1 1 30 HIS HD1 H 3.851 7.658 -3.577 1.00 . A A . 30 HIS HD1 1 1 21 13244 1 1 30 HIS HD2 H 5.321 4.659 -6.047 1.00 . A A . 30 HIS HD2 1 1 21 13245 1 1 30 HIS HE1 H 4.102 8.715 -5.846 1.00 . A A . 30 HIS HE1 1 1 21 13246 1 1 30 HIS HE2 H 5.140 6.928 -7.273 1.00 . A A . 30 HIS HE2 1 1 21 13247 1 1 30 HIS N N 6.159 3.461 -4.228 1.00 . A A . 30 HIS N 1 1 21 13248 1 1 30 HIS ND1 N 4.184 7.175 -4.361 1.00 . A A . 30 HIS ND1 1 1 21 13249 1 1 30 HIS NE2 N 4.800 6.766 -6.370 1.00 . A A . 30 HIS NE2 1 1 21 13250 1 1 30 HIS O O 5.188 2.001 -2.077 1.00 . A A . 30 HIS O 1 1 21 13251 1 1 31 TYR C C 4.399 3.030 1.244 1.00 . A A . 31 TYR C 1 1 21 13252 1 1 31 TYR CA C 5.722 2.730 0.548 1.00 . A A . 31 TYR CA 1 1 21 13253 1 1 31 TYR CB C 6.885 2.942 1.519 1.00 . A A . 31 TYR CB 1 1 21 13254 1 1 31 TYR CD1 C 8.497 1.159 2.293 1.00 . A A . 31 TYR CD1 1 1 21 13255 1 1 31 TYR CD2 C 8.697 1.963 0.058 1.00 . A A . 31 TYR CD2 1 1 21 13256 1 1 31 TYR CE1 C 9.560 0.301 2.084 1.00 . A A . 31 TYR CE1 1 1 21 13257 1 1 31 TYR CE2 C 9.760 1.107 -0.160 1.00 . A A . 31 TYR CE2 1 1 21 13258 1 1 31 TYR CG C 8.048 2.004 1.286 1.00 . A A . 31 TYR CG 1 1 21 13259 1 1 31 TYR CZ C 10.187 0.279 0.856 1.00 . A A . 31 TYR CZ 1 1 21 13260 1 1 31 TYR H H 6.200 4.498 -0.513 1.00 . A A . 31 TYR H 1 1 21 13261 1 1 31 TYR HA H 5.719 1.702 0.218 1.00 . A A . 31 TYR HA 1 1 21 13262 1 1 31 TYR HB2 H 7.250 3.953 1.418 1.00 . A A . 31 TYR HB2 1 1 21 13263 1 1 31 TYR HB3 H 6.533 2.790 2.529 1.00 . A A . 31 TYR HB3 1 1 21 13264 1 1 31 TYR HD1 H 8.003 1.179 3.253 1.00 . A A . 31 TYR HD1 1 1 21 13265 1 1 31 TYR HD2 H 8.360 2.614 -0.736 1.00 . A A . 31 TYR HD2 1 1 21 13266 1 1 31 TYR HE1 H 9.894 -0.348 2.879 1.00 . A A . 31 TYR HE1 1 1 21 13267 1 1 31 TYR HE2 H 10.251 1.090 -1.121 1.00 . A A . 31 TYR HE2 1 1 21 13268 1 1 31 TYR HH H 11.106 -1.061 -0.172 1.00 . A A . 31 TYR HH 1 1 21 13269 1 1 31 TYR N N 5.882 3.579 -0.628 1.00 . A A . 31 TYR N 1 1 21 13270 1 1 31 TYR O O 3.838 4.113 1.085 1.00 . A A . 31 TYR O 1 1 21 13271 1 1 31 TYR OH O 11.245 -0.575 0.644 1.00 . A A . 31 TYR OH 1 1 21 13272 1 1 32 CYS C C 2.875 2.541 4.197 1.00 . A A . 32 CYS C 1 1 21 13273 1 1 32 CYS CA C 2.641 2.240 2.722 1.00 . A A . 32 CYS CA 1 1 21 13274 1 1 32 CYS CB C 1.776 0.987 2.579 1.00 . A A . 32 CYS CB 1 1 21 13275 1 1 32 CYS H H 4.388 1.222 2.103 1.00 . A A . 32 CYS H 1 1 21 13276 1 1 32 CYS HA H 2.122 3.075 2.275 1.00 . A A . 32 CYS HA 1 1 21 13277 1 1 32 CYS HB2 H 2.116 0.420 1.725 1.00 . A A . 32 CYS HB2 1 1 21 13278 1 1 32 CYS HB3 H 1.879 0.384 3.469 1.00 . A A . 32 CYS HB3 1 1 21 13279 1 1 32 CYS N N 3.901 2.067 2.013 1.00 . A A . 32 CYS N 1 1 21 13280 1 1 32 CYS O O 4.000 2.459 4.689 1.00 . A A . 32 CYS O 1 1 21 13281 1 1 32 CYS SG S 0.004 1.333 2.343 1.00 . A A . 32 CYS SG 1 1 21 13282 1 1 33 THR C C 0.903 2.332 7.114 1.00 . A A . 33 THR C 1 1 21 13283 1 1 33 THR CA C 1.876 3.198 6.317 1.00 . A A . 33 THR CA 1 1 21 13284 1 1 33 THR CB C 1.571 4.680 6.554 1.00 . A A . 33 THR CB 1 1 21 13285 1 1 33 THR CG2 C 2.176 5.593 5.509 1.00 . A A . 33 THR CG2 1 1 21 13286 1 1 33 THR H H 0.931 2.930 4.444 1.00 . A A . 33 THR H 1 1 21 13287 1 1 33 THR HA H 2.882 2.988 6.650 1.00 . A A . 33 THR HA 1 1 21 13288 1 1 33 THR HB H 1.970 4.968 7.516 1.00 . A A . 33 THR HB 1 1 21 13289 1 1 33 THR HG1 H -0.188 4.729 5.695 1.00 . A A . 33 THR HG1 1 1 21 13290 1 1 33 THR HG21 H 3.247 5.450 5.482 1.00 . A A . 33 THR HG21 1 1 21 13291 1 1 33 THR HG22 H 1.757 5.360 4.541 1.00 . A A . 33 THR HG22 1 1 21 13292 1 1 33 THR HG23 H 1.956 6.621 5.758 1.00 . A A . 33 THR HG23 1 1 21 13293 1 1 33 THR N N 1.800 2.886 4.896 1.00 . A A . 33 THR N 1 1 21 13294 1 1 33 THR O O 0.549 2.661 8.246 1.00 . A A . 33 THR O 1 1 21 13295 1 1 33 THR OG1 O 0.174 4.909 6.566 1.00 . A A . 33 THR OG1 1 1 21 13296 1 1 34 GLY C C -1.669 1.047 7.743 1.00 . A A . 34 GLY C 1 1 21 13297 1 1 34 GLY CA C -0.456 0.326 7.183 1.00 . A A . 34 GLY CA 1 1 21 13298 1 1 34 GLY H H 0.790 1.010 5.611 1.00 . A A . 34 GLY H 1 1 21 13299 1 1 34 GLY HA2 H 0.060 -0.168 7.993 1.00 . A A . 34 GLY HA2 1 1 21 13300 1 1 34 GLY HA3 H -0.789 -0.419 6.477 1.00 . A A . 34 GLY HA3 1 1 21 13301 1 1 34 GLY N N 0.473 1.223 6.515 1.00 . A A . 34 GLY N 1 1 21 13302 1 1 34 GLY O O -2.118 0.751 8.850 1.00 . A A . 34 GLY O 1 1 21 13303 1 1 35 ARG C C -4.511 2.641 6.408 1.00 . A A . 35 ARG C 1 1 21 13304 1 1 35 ARG CA C -3.364 2.765 7.409 1.00 . A A . 35 ARG CA 1 1 21 13305 1 1 35 ARG CB C -2.991 4.237 7.592 1.00 . A A . 35 ARG CB 1 1 21 13306 1 1 35 ARG CD C -5.080 5.632 7.654 1.00 . A A . 35 ARG CD 1 1 21 13307 1 1 35 ARG CG C -3.963 5.005 8.473 1.00 . A A . 35 ARG CG 1 1 21 13308 1 1 35 ARG CZ C -4.365 7.988 7.570 1.00 . A A . 35 ARG CZ 1 1 21 13309 1 1 35 ARG H H -1.793 2.191 6.107 1.00 . A A . 35 ARG H 1 1 21 13310 1 1 35 ARG HA H -3.689 2.366 8.357 1.00 . A A . 35 ARG HA 1 1 21 13311 1 1 35 ARG HB2 H -2.010 4.294 8.041 1.00 . A A . 35 ARG HB2 1 1 21 13312 1 1 35 ARG HB3 H -2.963 4.713 6.623 1.00 . A A . 35 ARG HB3 1 1 21 13313 1 1 35 ARG HD2 H -5.421 4.912 6.924 1.00 . A A . 35 ARG HD2 1 1 21 13314 1 1 35 ARG HD3 H -5.895 5.886 8.316 1.00 . A A . 35 ARG HD3 1 1 21 13315 1 1 35 ARG HE H -4.541 6.789 5.984 1.00 . A A . 35 ARG HE 1 1 21 13316 1 1 35 ARG HG2 H -4.395 4.327 9.193 1.00 . A A . 35 ARG HG2 1 1 21 13317 1 1 35 ARG HG3 H -3.425 5.787 8.989 1.00 . A A . 35 ARG HG3 1 1 21 13318 1 1 35 ARG HH11 H -4.783 7.305 9.427 1.00 . A A . 35 ARG HH11 1 1 21 13319 1 1 35 ARG HH12 H -4.278 8.959 9.341 1.00 . A A . 35 ARG HH12 1 1 21 13320 1 1 35 ARG HH21 H -3.876 8.965 5.869 1.00 . A A . 35 ARG HH21 1 1 21 13321 1 1 35 ARG HH22 H -3.763 9.902 7.321 1.00 . A A . 35 ARG HH22 1 1 21 13322 1 1 35 ARG N N -2.198 1.998 6.978 1.00 . A A . 35 ARG N 1 1 21 13323 1 1 35 ARG NE N -4.639 6.838 6.958 1.00 . A A . 35 ARG NE 1 1 21 13324 1 1 35 ARG NH1 N -4.485 8.093 8.888 1.00 . A A . 35 ARG NH1 1 1 21 13325 1 1 35 ARG NH2 N -3.969 9.038 6.862 1.00 . A A . 35 ARG NH2 1 1 21 13326 1 1 35 ARG O O -5.681 2.632 6.790 1.00 . A A . 35 ARG O 1 1 21 13327 1 1 36 SER C C -4.525 2.003 2.760 1.00 . A A . 36 SER C 1 1 21 13328 1 1 36 SER CA C -5.171 2.430 4.073 1.00 . A A . 36 SER CA 1 1 21 13329 1 1 36 SER CB C -5.905 3.758 3.886 1.00 . A A . 36 SER CB 1 1 21 13330 1 1 36 SER H H -3.221 2.563 4.885 1.00 . A A . 36 SER H 1 1 21 13331 1 1 36 SER HA H -5.881 1.675 4.374 1.00 . A A . 36 SER HA 1 1 21 13332 1 1 36 SER HB2 H -6.406 4.023 4.805 1.00 . A A . 36 SER HB2 1 1 21 13333 1 1 36 SER HB3 H -5.192 4.528 3.630 1.00 . A A . 36 SER HB3 1 1 21 13334 1 1 36 SER HG H -7.730 3.920 3.193 1.00 . A A . 36 SER HG 1 1 21 13335 1 1 36 SER N N -4.169 2.549 5.127 1.00 . A A . 36 SER N 1 1 21 13336 1 1 36 SER O O -3.300 1.957 2.648 1.00 . A A . 36 SER O 1 1 21 13337 1 1 36 SER OG O -6.870 3.667 2.851 1.00 . A A . 36 SER OG 1 1 21 13338 1 1 37 CYS C C -4.161 2.426 -0.246 1.00 . A A . 37 CYS C 1 1 21 13339 1 1 37 CYS CA C -4.852 1.271 0.467 1.00 . A A . 37 CYS CA 1 1 21 13340 1 1 37 CYS CB C -5.992 0.734 -0.396 1.00 . A A . 37 CYS CB 1 1 21 13341 1 1 37 CYS H H -6.320 1.747 1.912 1.00 . A A . 37 CYS H 1 1 21 13342 1 1 37 CYS HA H -4.136 0.481 0.630 1.00 . A A . 37 CYS HA 1 1 21 13343 1 1 37 CYS HB2 H -6.838 0.512 0.235 1.00 . A A . 37 CYS HB2 1 1 21 13344 1 1 37 CYS HB3 H -6.274 1.486 -1.119 1.00 . A A . 37 CYS HB3 1 1 21 13345 1 1 37 CYS N N -5.352 1.692 1.768 1.00 . A A . 37 CYS N 1 1 21 13346 1 1 37 CYS O O -3.217 2.226 -1.009 1.00 . A A . 37 CYS O 1 1 21 13347 1 1 37 CYS SG S -5.572 -0.782 -1.310 1.00 . A A . 37 CYS SG 1 1 21 13348 1 1 38 GLU C C -2.577 4.926 -0.377 1.00 . A A . 38 GLU C 1 1 21 13349 1 1 38 GLU CA C -4.082 4.833 -0.614 1.00 . A A . 38 GLU CA 1 1 21 13350 1 1 38 GLU CB C -4.772 6.085 -0.070 1.00 . A A . 38 GLU CB 1 1 21 13351 1 1 38 GLU CD C -3.347 8.171 -0.030 1.00 . A A . 38 GLU CD 1 1 21 13352 1 1 38 GLU CG C -4.377 7.361 -0.795 1.00 . A A . 38 GLU CG 1 1 21 13353 1 1 38 GLU H H -5.403 3.728 0.623 1.00 . A A . 38 GLU H 1 1 21 13354 1 1 38 GLU HA H -4.262 4.770 -1.677 1.00 . A A . 38 GLU HA 1 1 21 13355 1 1 38 GLU HB2 H -5.841 5.962 -0.161 1.00 . A A . 38 GLU HB2 1 1 21 13356 1 1 38 GLU HB3 H -4.520 6.197 0.974 1.00 . A A . 38 GLU HB3 1 1 21 13357 1 1 38 GLU HG2 H -3.963 7.101 -1.757 1.00 . A A . 38 GLU HG2 1 1 21 13358 1 1 38 GLU HG3 H -5.259 7.969 -0.935 1.00 . A A . 38 GLU HG3 1 1 21 13359 1 1 38 GLU N N -4.645 3.637 0.006 1.00 . A A . 38 GLU N 1 1 21 13360 1 1 38 GLU O O -2.125 5.075 0.759 1.00 . A A . 38 GLU O 1 1 21 13361 1 1 38 GLU OE1 O -3.743 8.918 0.889 1.00 . A A . 38 GLU OE1 1 1 21 13362 1 1 38 GLU OE2 O -2.146 8.057 -0.350 1.00 . A A . 38 GLU OE2 1 1 21 13363 1 1 39 CYS C C 0.114 6.375 -1.467 1.00 . A A . 39 CYS C 1 1 21 13364 1 1 39 CYS CA C -0.351 4.924 -1.369 1.00 . A A . 39 CYS CA 1 1 21 13365 1 1 39 CYS CB C 0.301 4.097 -2.480 1.00 . A A . 39 CYS CB 1 1 21 13366 1 1 39 CYS H H -2.225 4.728 -2.336 1.00 . A A . 39 CYS H 1 1 21 13367 1 1 39 CYS HA H -0.054 4.524 -0.410 1.00 . A A . 39 CYS HA 1 1 21 13368 1 1 39 CYS HB2 H -0.116 4.394 -3.431 1.00 . A A . 39 CYS HB2 1 1 21 13369 1 1 39 CYS HB3 H 1.364 4.289 -2.485 1.00 . A A . 39 CYS HB3 1 1 21 13370 1 1 39 CYS N N -1.806 4.843 -1.458 1.00 . A A . 39 CYS N 1 1 21 13371 1 1 39 CYS O O -0.473 7.174 -2.196 1.00 . A A . 39 CYS O 1 1 21 13372 1 1 39 CYS SG S 0.065 2.297 -2.315 1.00 . A A . 39 CYS SG 1 1 21 13373 1 1 40 PRO C C 2.026 8.582 -2.164 1.00 . A A . 40 PRO C 1 1 21 13374 1 1 40 PRO CA C 1.720 8.102 -0.750 1.00 . A A . 40 PRO CA 1 1 21 13375 1 1 40 PRO CB C 3.010 7.989 0.066 1.00 . A A . 40 PRO CB 1 1 21 13376 1 1 40 PRO CD C 1.946 5.852 0.161 1.00 . A A . 40 PRO CD 1 1 21 13377 1 1 40 PRO CG C 2.801 6.806 0.947 1.00 . A A . 40 PRO CG 1 1 21 13378 1 1 40 PRO HA H 1.048 8.799 -0.272 1.00 . A A . 40 PRO HA 1 1 21 13379 1 1 40 PRO HB2 H 3.849 7.843 -0.600 1.00 . A A . 40 PRO HB2 1 1 21 13380 1 1 40 PRO HB3 H 3.155 8.889 0.644 1.00 . A A . 40 PRO HB3 1 1 21 13381 1 1 40 PRO HD2 H 2.564 5.171 -0.406 1.00 . A A . 40 PRO HD2 1 1 21 13382 1 1 40 PRO HD3 H 1.286 5.307 0.820 1.00 . A A . 40 PRO HD3 1 1 21 13383 1 1 40 PRO HG2 H 3.752 6.352 1.183 1.00 . A A . 40 PRO HG2 1 1 21 13384 1 1 40 PRO HG3 H 2.293 7.107 1.851 1.00 . A A . 40 PRO HG3 1 1 21 13385 1 1 40 PRO N N 1.181 6.738 -0.734 1.00 . A A . 40 PRO N 1 1 21 13386 1 1 40 PRO O O 1.856 7.841 -3.132 1.00 . A A . 40 PRO O 1 1 21 13387 1 1 41 SER C C 4.307 10.670 -3.686 1.00 . A A . 41 SER C 1 1 21 13388 1 1 41 SER CA C 2.809 10.404 -3.574 1.00 . A A . 41 SER CA 1 1 21 13389 1 1 41 SER CB C 2.031 11.703 -3.791 1.00 . A A . 41 SER CB 1 1 21 13390 1 1 41 SER H H 2.594 10.368 -1.468 1.00 . A A . 41 SER H 1 1 21 13391 1 1 41 SER HA H 2.525 9.693 -4.336 1.00 . A A . 41 SER HA 1 1 21 13392 1 1 41 SER HB2 H 2.410 12.463 -3.123 1.00 . A A . 41 SER HB2 1 1 21 13393 1 1 41 SER HB3 H 2.155 12.028 -4.813 1.00 . A A . 41 SER HB3 1 1 21 13394 1 1 41 SER HG H 0.228 11.138 -4.308 1.00 . A A . 41 SER HG 1 1 21 13395 1 1 41 SER N N 2.479 9.826 -2.276 1.00 . A A . 41 SER N 1 1 21 13396 1 1 41 SER O O 4.733 11.607 -4.361 1.00 . A A . 41 SER O 1 1 21 13397 1 1 41 SER OG O 0.650 11.519 -3.534 1.00 . A A . 41 SER OG 1 1 21 13398 1 1 42 TYR C C 7.236 8.666 -2.684 1.00 . A A . 42 TYR C 1 1 21 13399 1 1 42 TYR CA C 6.552 9.983 -3.046 1.00 . A A . 42 TYR CA 1 1 21 13400 1 1 42 TYR CB C 6.994 11.085 -2.081 1.00 . A A . 42 TYR CB 1 1 21 13401 1 1 42 TYR CD1 C 5.609 11.268 0.023 1.00 . A A . 42 TYR CD1 1 1 21 13402 1 1 42 TYR CD2 C 7.596 9.952 0.094 1.00 . A A . 42 TYR CD2 1 1 21 13403 1 1 42 TYR CE1 C 5.363 10.976 1.351 1.00 . A A . 42 TYR CE1 1 1 21 13404 1 1 42 TYR CE2 C 7.356 9.655 1.422 1.00 . A A . 42 TYR CE2 1 1 21 13405 1 1 42 TYR CG C 6.728 10.762 -0.627 1.00 . A A . 42 TYR CG 1 1 21 13406 1 1 42 TYR CZ C 6.239 10.169 2.046 1.00 . A A . 42 TYR CZ 1 1 21 13407 1 1 42 TYR H H 4.703 9.110 -2.500 1.00 . A A . 42 TYR H 1 1 21 13408 1 1 42 TYR HA H 6.839 10.259 -4.049 1.00 . A A . 42 TYR HA 1 1 21 13409 1 1 42 TYR HB2 H 8.055 11.249 -2.194 1.00 . A A . 42 TYR HB2 1 1 21 13410 1 1 42 TYR HB3 H 6.466 11.996 -2.321 1.00 . A A . 42 TYR HB3 1 1 21 13411 1 1 42 TYR HD1 H 4.924 11.899 -0.524 1.00 . A A . 42 TYR HD1 1 1 21 13412 1 1 42 TYR HD2 H 8.470 9.552 -0.397 1.00 . A A . 42 TYR HD2 1 1 21 13413 1 1 42 TYR HE1 H 4.487 11.378 1.839 1.00 . A A . 42 TYR HE1 1 1 21 13414 1 1 42 TYR HE2 H 8.043 9.023 1.966 1.00 . A A . 42 TYR HE2 1 1 21 13415 1 1 42 TYR HH H 5.190 9.360 3.440 1.00 . A A . 42 TYR HH 1 1 21 13416 1 1 42 TYR N N 5.102 9.838 -3.020 1.00 . A A . 42 TYR N 1 1 21 13417 1 1 42 TYR O O 6.708 7.879 -1.898 1.00 . A A . 42 TYR O 1 1 21 13418 1 1 42 TYR OH O 5.997 9.875 3.368 1.00 . A A . 42 TYR OH 1 1 21 13419 1 1 43 PRO C C 9.787 7.166 -1.590 1.00 . A A . 43 PRO C 1 1 21 13420 1 1 43 PRO CA C 9.179 7.179 -2.988 1.00 . A A . 43 PRO CA 1 1 21 13421 1 1 43 PRO CB C 10.279 7.203 -4.050 1.00 . A A . 43 PRO CB 1 1 21 13422 1 1 43 PRO CD C 9.127 9.292 -4.205 1.00 . A A . 43 PRO CD 1 1 21 13423 1 1 43 PRO CG C 10.478 8.647 -4.352 1.00 . A A . 43 PRO CG 1 1 21 13424 1 1 43 PRO HA H 8.564 6.301 -3.121 1.00 . A A . 43 PRO HA 1 1 21 13425 1 1 43 PRO HB2 H 11.177 6.753 -3.652 1.00 . A A . 43 PRO HB2 1 1 21 13426 1 1 43 PRO HB3 H 9.952 6.659 -4.923 1.00 . A A . 43 PRO HB3 1 1 21 13427 1 1 43 PRO HD2 H 9.227 10.289 -3.802 1.00 . A A . 43 PRO HD2 1 1 21 13428 1 1 43 PRO HD3 H 8.616 9.318 -5.156 1.00 . A A . 43 PRO HD3 1 1 21 13429 1 1 43 PRO HG2 H 11.177 9.076 -3.649 1.00 . A A . 43 PRO HG2 1 1 21 13430 1 1 43 PRO HG3 H 10.842 8.765 -5.362 1.00 . A A . 43 PRO HG3 1 1 21 13431 1 1 43 PRO N N 8.425 8.408 -3.255 1.00 . A A . 43 PRO N 1 1 21 13432 1 1 43 PRO O O 10.312 8.175 -1.120 1.00 . A A . 43 PRO O 1 1 21 13433 1 1 44 GLY C C 11.776 5.935 0.422 1.00 . A A . 44 GLY C 1 1 21 13434 1 1 44 GLY CA C 10.260 5.892 0.409 1.00 . A A . 44 GLY CA 1 1 21 13435 1 1 44 GLY H H 9.283 5.243 -1.354 1.00 . A A . 44 GLY H 1 1 21 13436 1 1 44 GLY HA2 H 9.934 4.954 0.834 1.00 . A A . 44 GLY HA2 1 1 21 13437 1 1 44 GLY HA3 H 9.883 6.701 1.017 1.00 . A A . 44 GLY HA3 1 1 21 13438 1 1 44 GLY N N 9.713 6.015 -0.929 1.00 . A A . 44 GLY N 1 1 21 13439 1 1 44 GLY O O 12.428 5.331 -0.429 1.00 . A A . 44 GLY O 1 1 21 13440 1 1 45 ASN C C 14.215 6.717 2.974 1.00 . A A . 45 ASN C 1 1 21 13441 1 1 45 ASN CA C 13.785 6.772 1.512 1.00 . A A . 45 ASN CA 1 1 21 13442 1 1 45 ASN CB C 14.264 8.078 0.876 1.00 . A A . 45 ASN CB 1 1 21 13443 1 1 45 ASN CG C 14.028 8.112 -0.622 1.00 . A A . 45 ASN CG 1 1 21 13444 1 1 45 ASN H H 11.763 7.110 2.040 1.00 . A A . 45 ASN H 1 1 21 13445 1 1 45 ASN HA H 14.231 5.941 0.986 1.00 . A A . 45 ASN HA 1 1 21 13446 1 1 45 ASN HB2 H 13.733 8.905 1.323 1.00 . A A . 45 ASN HB2 1 1 21 13447 1 1 45 ASN HB3 H 15.322 8.193 1.058 1.00 . A A . 45 ASN HB3 1 1 21 13448 1 1 45 ASN HD21 H 15.988 8.157 -0.954 1.00 . A A . 45 ASN HD21 1 1 21 13449 1 1 45 ASN HD22 H 14.988 8.175 -2.362 1.00 . A A . 45 ASN HD22 1 1 21 13450 1 1 45 ASN N N 12.337 6.652 1.391 1.00 . A A . 45 ASN N 1 1 21 13451 1 1 45 ASN ND2 N 15.111 8.152 -1.390 1.00 . A A . 45 ASN ND2 1 1 21 13452 1 1 45 ASN O O 15.117 5.963 3.338 1.00 . A A . 45 ASN O 1 1 21 13453 1 1 45 ASN OD1 O 12.887 8.103 -1.083 1.00 . A A . 45 ASN OD1 1 1 21 13454 1 1 46 GLY C C 15.299 8.056 5.479 1.00 . A A . 46 GLY C 1 1 21 13455 1 1 46 GLY CA C 13.894 7.549 5.221 1.00 . A A . 46 GLY CA 1 1 21 13456 1 1 46 GLY H H 12.854 8.101 3.461 1.00 . A A . 46 GLY H 1 1 21 13457 1 1 46 GLY HA2 H 13.805 6.549 5.619 1.00 . A A . 46 GLY HA2 1 1 21 13458 1 1 46 GLY HA3 H 13.192 8.192 5.730 1.00 . A A . 46 GLY HA3 1 1 21 13459 1 1 46 GLY N N 13.564 7.521 3.808 1.00 . A A . 46 GLY N 1 1 21 13460 1 1 46 GLY O O 15.924 8.581 4.533 1.00 . A A . 46 GLY O 1 1 21 13461 1 1 46 GLY OXT O 15.775 7.928 6.627 1.00 . A A . 46 GLY OXT 1 1 22 13462 1 1 1 ALA C C -18.789 -7.714 8.742 1.00 . A A . 1 ALA C 1 1 22 13463 1 1 1 ALA CA C -20.140 -7.211 9.239 1.00 . A A . 1 ALA CA 1 1 22 13464 1 1 1 ALA CB C -20.246 -5.706 9.043 1.00 . A A . 1 ALA CB 1 1 22 13465 1 1 1 ALA H1 H -20.226 -8.587 10.766 1.00 . A A . 1 ALA H1 1 1 22 13466 1 1 1 ALA H2 H -19.632 -7.044 11.226 1.00 . A A . 1 ALA H2 1 1 22 13467 1 1 1 ALA H3 H -21.308 -7.268 10.931 1.00 . A A . 1 ALA H3 1 1 22 13468 1 1 1 ALA HA H -20.921 -7.681 8.660 1.00 . A A . 1 ALA HA 1 1 22 13469 1 1 1 ALA HB1 H -19.804 -5.200 9.888 1.00 . A A . 1 ALA HB1 1 1 22 13470 1 1 1 ALA HB2 H -19.725 -5.423 8.140 1.00 . A A . 1 ALA HB2 1 1 22 13471 1 1 1 ALA HB3 H -21.286 -5.427 8.960 1.00 . A A . 1 ALA HB3 1 1 22 13472 1 1 1 ALA N N -20.345 -7.559 10.669 1.00 . A A . 1 ALA N 1 1 22 13473 1 1 1 ALA O O -17.995 -8.256 9.512 1.00 . A A . 1 ALA O 1 1 22 13474 1 1 2 MET C C -17.030 -7.249 5.528 1.00 . A A . 2 MET C 1 1 22 13475 1 1 2 MET CA C -17.278 -7.967 6.850 1.00 . A A . 2 MET CA 1 1 22 13476 1 1 2 MET CB C -17.293 -9.480 6.628 1.00 . A A . 2 MET CB 1 1 22 13477 1 1 2 MET CE C -13.808 -11.523 7.675 1.00 . A A . 2 MET CE 1 1 22 13478 1 1 2 MET CG C -15.906 -10.098 6.558 1.00 . A A . 2 MET CG 1 1 22 13479 1 1 2 MET H H -19.206 -7.093 6.888 1.00 . A A . 2 MET H 1 1 22 13480 1 1 2 MET HA H -16.481 -7.720 7.535 1.00 . A A . 2 MET HA 1 1 22 13481 1 1 2 MET HB2 H -17.831 -9.947 7.440 1.00 . A A . 2 MET HB2 1 1 22 13482 1 1 2 MET HB3 H -17.805 -9.691 5.701 1.00 . A A . 2 MET HB3 1 1 22 13483 1 1 2 MET HE1 H -13.887 -11.925 6.676 1.00 . A A . 2 MET HE1 1 1 22 13484 1 1 2 MET HE2 H -13.026 -10.779 7.704 1.00 . A A . 2 MET HE2 1 1 22 13485 1 1 2 MET HE3 H -13.573 -12.320 8.366 1.00 . A A . 2 MET HE3 1 1 22 13486 1 1 2 MET HG2 H -15.918 -10.896 5.831 1.00 . A A . 2 MET HG2 1 1 22 13487 1 1 2 MET HG3 H -15.204 -9.339 6.246 1.00 . A A . 2 MET HG3 1 1 22 13488 1 1 2 MET N N -18.534 -7.531 7.451 1.00 . A A . 2 MET N 1 1 22 13489 1 1 2 MET O O -17.730 -7.482 4.542 1.00 . A A . 2 MET O 1 1 22 13490 1 1 2 MET SD S -15.365 -10.771 8.141 1.00 . A A . 2 MET SD 1 1 22 13491 1 1 3 ASP C C -14.180 -5.625 4.078 1.00 . A A . 3 ASP C 1 1 22 13492 1 1 3 ASP CA C -15.688 -5.623 4.311 1.00 . A A . 3 ASP CA 1 1 22 13493 1 1 3 ASP CB C -16.196 -4.185 4.423 1.00 . A A . 3 ASP CB 1 1 22 13494 1 1 3 ASP CG C -16.437 -3.550 3.067 1.00 . A A . 3 ASP CG 1 1 22 13495 1 1 3 ASP H H -15.507 -6.233 6.330 1.00 . A A . 3 ASP H 1 1 22 13496 1 1 3 ASP HA H -16.170 -6.103 3.473 1.00 . A A . 3 ASP HA 1 1 22 13497 1 1 3 ASP HB2 H -17.126 -4.180 4.971 1.00 . A A . 3 ASP HB2 1 1 22 13498 1 1 3 ASP HB3 H -15.467 -3.592 4.954 1.00 . A A . 3 ASP HB3 1 1 22 13499 1 1 3 ASP N N -16.029 -6.375 5.513 1.00 . A A . 3 ASP N 1 1 22 13500 1 1 3 ASP O O -13.396 -5.539 5.022 1.00 . A A . 3 ASP O 1 1 22 13501 1 1 3 ASP OD1 O -17.391 -3.967 2.377 1.00 . A A . 3 ASP OD1 1 1 22 13502 1 1 3 ASP OD2 O -15.671 -2.636 2.696 1.00 . A A . 3 ASP OD2 1 1 22 13503 1 1 4 CYS C C -11.903 -4.351 2.026 1.00 . A A . 4 CYS C 1 1 22 13504 1 1 4 CYS CA C -12.369 -5.738 2.456 1.00 . A A . 4 CYS CA 1 1 22 13505 1 1 4 CYS CB C -12.114 -6.743 1.332 1.00 . A A . 4 CYS CB 1 1 22 13506 1 1 4 CYS H H -14.456 -5.790 2.104 1.00 . A A . 4 CYS H 1 1 22 13507 1 1 4 CYS HA H -11.809 -6.038 3.328 1.00 . A A . 4 CYS HA 1 1 22 13508 1 1 4 CYS HB2 H -12.906 -6.665 0.602 1.00 . A A . 4 CYS HB2 1 1 22 13509 1 1 4 CYS HB3 H -11.172 -6.510 0.858 1.00 . A A . 4 CYS HB3 1 1 22 13510 1 1 4 CYS N N -13.783 -5.725 2.813 1.00 . A A . 4 CYS N 1 1 22 13511 1 1 4 CYS O O -12.715 -3.462 1.768 1.00 . A A . 4 CYS O 1 1 22 13512 1 1 4 CYS SG S -12.044 -8.478 1.886 1.00 . A A . 4 CYS SG 1 1 22 13513 1 1 5 THR C C -9.372 -3.007 0.167 1.00 . A A . 5 THR C 1 1 22 13514 1 1 5 THR CA C -10.006 -2.899 1.551 1.00 . A A . 5 THR CA 1 1 22 13515 1 1 5 THR CB C -8.962 -2.450 2.576 1.00 . A A . 5 THR CB 1 1 22 13516 1 1 5 THR CG2 C -9.054 -0.978 2.915 1.00 . A A . 5 THR CG2 1 1 22 13517 1 1 5 THR H H -9.994 -4.923 2.168 1.00 . A A . 5 THR H 1 1 22 13518 1 1 5 THR HA H -10.799 -2.167 1.514 1.00 . A A . 5 THR HA 1 1 22 13519 1 1 5 THR HB H -7.976 -2.637 2.177 1.00 . A A . 5 THR HB 1 1 22 13520 1 1 5 THR HG1 H -9.973 -3.029 4.150 1.00 . A A . 5 THR HG1 1 1 22 13521 1 1 5 THR HG21 H -9.696 -0.483 2.201 1.00 . A A . 5 THR HG21 1 1 22 13522 1 1 5 THR HG22 H -9.464 -0.862 3.907 1.00 . A A . 5 THR HG22 1 1 22 13523 1 1 5 THR HG23 H -8.069 -0.537 2.879 1.00 . A A . 5 THR HG23 1 1 22 13524 1 1 5 THR N N -10.589 -4.175 1.950 1.00 . A A . 5 THR N 1 1 22 13525 1 1 5 THR O O -8.364 -3.690 -0.013 1.00 . A A . 5 THR O 1 1 22 13526 1 1 5 THR OG1 O -9.098 -3.177 3.784 1.00 . A A . 5 THR OG1 1 1 22 13527 1 1 6 THR C C -8.538 -1.168 -2.437 1.00 . A A . 6 THR C 1 1 22 13528 1 1 6 THR CA C -9.464 -2.352 -2.176 1.00 . A A . 6 THR CA 1 1 22 13529 1 1 6 THR CB C -10.626 -2.334 -3.171 1.00 . A A . 6 THR CB 1 1 22 13530 1 1 6 THR CG2 C -11.538 -3.535 -3.047 1.00 . A A . 6 THR CG2 1 1 22 13531 1 1 6 THR H H -10.772 -1.804 -0.603 1.00 . A A . 6 THR H 1 1 22 13532 1 1 6 THR HA H -8.905 -3.266 -2.307 1.00 . A A . 6 THR HA 1 1 22 13533 1 1 6 THR HB H -10.226 -2.325 -4.175 1.00 . A A . 6 THR HB 1 1 22 13534 1 1 6 THR HG1 H -11.884 -1.226 -2.159 1.00 . A A . 6 THR HG1 1 1 22 13535 1 1 6 THR HG21 H -11.036 -4.313 -2.491 1.00 . A A . 6 THR HG21 1 1 22 13536 1 1 6 THR HG22 H -12.442 -3.249 -2.530 1.00 . A A . 6 THR HG22 1 1 22 13537 1 1 6 THR HG23 H -11.787 -3.901 -4.032 1.00 . A A . 6 THR HG23 1 1 22 13538 1 1 6 THR N N -9.970 -2.330 -0.808 1.00 . A A . 6 THR N 1 1 22 13539 1 1 6 THR O O -8.727 -0.085 -1.883 1.00 . A A . 6 THR O 1 1 22 13540 1 1 6 THR OG1 O -11.418 -1.173 -2.997 1.00 . A A . 6 THR OG1 1 1 22 13541 1 1 7 GLY C C -5.173 -0.837 -3.736 1.00 . A A . 7 GLY C 1 1 22 13542 1 1 7 GLY CA C -6.597 -0.327 -3.608 1.00 . A A . 7 GLY CA 1 1 22 13543 1 1 7 GLY H H -7.439 -2.267 -3.697 1.00 . A A . 7 GLY H 1 1 22 13544 1 1 7 GLY HA2 H -6.631 0.421 -2.830 1.00 . A A . 7 GLY HA2 1 1 22 13545 1 1 7 GLY HA3 H -6.890 0.128 -4.543 1.00 . A A . 7 GLY HA3 1 1 22 13546 1 1 7 GLY N N -7.538 -1.383 -3.286 1.00 . A A . 7 GLY N 1 1 22 13547 1 1 7 GLY O O -4.919 -2.025 -3.538 1.00 . A A . 7 GLY O 1 1 22 13548 1 1 8 PRO C C -2.128 -0.614 -2.887 1.00 . A A . 8 PRO C 1 1 22 13549 1 1 8 PRO CA C -2.809 -0.342 -4.225 1.00 . A A . 8 PRO CA 1 1 22 13550 1 1 8 PRO CB C -2.183 0.875 -4.906 1.00 . A A . 8 PRO CB 1 1 22 13551 1 1 8 PRO CD C -4.427 1.481 -4.331 1.00 . A A . 8 PRO CD 1 1 22 13552 1 1 8 PRO CG C -3.031 2.024 -4.482 1.00 . A A . 8 PRO CG 1 1 22 13553 1 1 8 PRO HA H -2.705 -1.207 -4.863 1.00 . A A . 8 PRO HA 1 1 22 13554 1 1 8 PRO HB2 H -1.162 0.992 -4.573 1.00 . A A . 8 PRO HB2 1 1 22 13555 1 1 8 PRO HB3 H -2.206 0.744 -5.978 1.00 . A A . 8 PRO HB3 1 1 22 13556 1 1 8 PRO HD2 H -4.927 1.953 -3.498 1.00 . A A . 8 PRO HD2 1 1 22 13557 1 1 8 PRO HD3 H -4.989 1.628 -5.242 1.00 . A A . 8 PRO HD3 1 1 22 13558 1 1 8 PRO HG2 H -2.676 2.413 -3.539 1.00 . A A . 8 PRO HG2 1 1 22 13559 1 1 8 PRO HG3 H -3.009 2.795 -5.239 1.00 . A A . 8 PRO HG3 1 1 22 13560 1 1 8 PRO N N -4.215 0.043 -4.072 1.00 . A A . 8 PRO N 1 1 22 13561 1 1 8 PRO O O -1.212 -1.431 -2.804 1.00 . A A . 8 PRO O 1 1 22 13562 1 1 9 CYS C C -2.739 -1.184 0.270 1.00 . A A . 9 CYS C 1 1 22 13563 1 1 9 CYS CA C -2.009 -0.091 -0.510 1.00 . A A . 9 CYS CA 1 1 22 13564 1 1 9 CYS CB C -2.069 1.231 0.259 1.00 . A A . 9 CYS CB 1 1 22 13565 1 1 9 CYS H H -3.312 0.714 -1.973 1.00 . A A . 9 CYS H 1 1 22 13566 1 1 9 CYS HA H -0.976 -0.380 -0.626 1.00 . A A . 9 CYS HA 1 1 22 13567 1 1 9 CYS HB2 H -2.245 2.036 -0.439 1.00 . A A . 9 CYS HB2 1 1 22 13568 1 1 9 CYS HB3 H -2.884 1.192 0.965 1.00 . A A . 9 CYS HB3 1 1 22 13569 1 1 9 CYS N N -2.580 0.076 -1.844 1.00 . A A . 9 CYS N 1 1 22 13570 1 1 9 CYS O O -3.086 -1.002 1.437 1.00 . A A . 9 CYS O 1 1 22 13571 1 1 9 CYS SG S -0.551 1.629 1.185 1.00 . A A . 9 CYS SG 1 1 22 13572 1 1 10 CYS C C -3.400 -4.732 -0.526 1.00 . A A . 10 CYS C 1 1 22 13573 1 1 10 CYS CA C -3.651 -3.443 0.249 1.00 . A A . 10 CYS CA 1 1 22 13574 1 1 10 CYS CB C -5.159 -3.178 0.354 1.00 . A A . 10 CYS CB 1 1 22 13575 1 1 10 CYS H H -2.664 -2.406 -1.310 1.00 . A A . 10 CYS H 1 1 22 13576 1 1 10 CYS HA H -3.247 -3.556 1.244 1.00 . A A . 10 CYS HA 1 1 22 13577 1 1 10 CYS HB2 H -5.692 -4.085 0.113 1.00 . A A . 10 CYS HB2 1 1 22 13578 1 1 10 CYS HB3 H -5.393 -2.892 1.370 1.00 . A A . 10 CYS HB3 1 1 22 13579 1 1 10 CYS N N -2.966 -2.319 -0.382 1.00 . A A . 10 CYS N 1 1 22 13580 1 1 10 CYS O O -3.495 -4.759 -1.753 1.00 . A A . 10 CYS O 1 1 22 13581 1 1 10 CYS SG S -5.785 -1.866 -0.748 1.00 . A A . 10 CYS SG 1 1 22 13582 1 1 11 ARG C C -4.008 -7.565 -1.238 1.00 . A A . 11 ARG C 1 1 22 13583 1 1 11 ARG CA C -2.810 -7.091 -0.419 1.00 . A A . 11 ARG CA 1 1 22 13584 1 1 11 ARG CB C -2.458 -8.129 0.649 1.00 . A A . 11 ARG CB 1 1 22 13585 1 1 11 ARG CD C -0.608 -9.448 1.721 1.00 . A A . 11 ARG CD 1 1 22 13586 1 1 11 ARG CG C -0.980 -8.161 1.003 1.00 . A A . 11 ARG CG 1 1 22 13587 1 1 11 ARG CZ C -0.431 -10.220 4.055 1.00 . A A . 11 ARG CZ 1 1 22 13588 1 1 11 ARG H H -3.015 -5.713 1.174 1.00 . A A . 11 ARG H 1 1 22 13589 1 1 11 ARG HA H -1.965 -6.971 -1.081 1.00 . A A . 11 ARG HA 1 1 22 13590 1 1 11 ARG HB2 H -3.017 -7.908 1.547 1.00 . A A . 11 ARG HB2 1 1 22 13591 1 1 11 ARG HB3 H -2.742 -9.108 0.291 1.00 . A A . 11 ARG HB3 1 1 22 13592 1 1 11 ARG HD2 H -1.139 -10.268 1.263 1.00 . A A . 11 ARG HD2 1 1 22 13593 1 1 11 ARG HD3 H 0.456 -9.607 1.619 1.00 . A A . 11 ARG HD3 1 1 22 13594 1 1 11 ARG HE H -1.591 -8.721 3.431 1.00 . A A . 11 ARG HE 1 1 22 13595 1 1 11 ARG HG2 H -0.401 -8.087 0.095 1.00 . A A . 11 ARG HG2 1 1 22 13596 1 1 11 ARG HG3 H -0.756 -7.322 1.646 1.00 . A A . 11 ARG HG3 1 1 22 13597 1 1 11 ARG HH11 H 0.722 -11.242 2.744 1.00 . A A . 11 ARG HH11 1 1 22 13598 1 1 11 ARG HH12 H 0.828 -11.766 4.391 1.00 . A A . 11 ARG HH12 1 1 22 13599 1 1 11 ARG HH21 H -1.452 -9.408 5.598 1.00 . A A . 11 ARG HH21 1 1 22 13600 1 1 11 ARG HH22 H -0.406 -10.725 6.012 1.00 . A A . 11 ARG HH22 1 1 22 13601 1 1 11 ARG N N -3.077 -5.798 0.199 1.00 . A A . 11 ARG N 1 1 22 13602 1 1 11 ARG NE N -0.946 -9.400 3.142 1.00 . A A . 11 ARG NE 1 1 22 13603 1 1 11 ARG NH1 N 0.445 -11.153 3.701 1.00 . A A . 11 ARG NH1 1 1 22 13604 1 1 11 ARG NH2 N -0.793 -10.108 5.326 1.00 . A A . 11 ARG NH2 1 1 22 13605 1 1 11 ARG O O -4.034 -7.412 -2.460 1.00 . A A . 11 ARG O 1 1 22 13606 1 1 12 GLN C C -7.449 -8.425 -0.396 1.00 . A A . 12 GLN C 1 1 22 13607 1 1 12 GLN CA C -6.191 -8.640 -1.237 1.00 . A A . 12 GLN CA 1 1 22 13608 1 1 12 GLN CB C -6.033 -10.127 -1.550 1.00 . A A . 12 GLN CB 1 1 22 13609 1 1 12 GLN CD C -5.501 -11.616 -3.520 1.00 . A A . 12 GLN CD 1 1 22 13610 1 1 12 GLN CG C -5.083 -10.410 -2.702 1.00 . A A . 12 GLN CG 1 1 22 13611 1 1 12 GLN H H -4.918 -8.242 0.409 1.00 . A A . 12 GLN H 1 1 22 13612 1 1 12 GLN HA H -6.296 -8.098 -2.165 1.00 . A A . 12 GLN HA 1 1 22 13613 1 1 12 GLN HB2 H -5.657 -10.627 -0.670 1.00 . A A . 12 GLN HB2 1 1 22 13614 1 1 12 GLN HB3 H -7.000 -10.535 -1.800 1.00 . A A . 12 GLN HB3 1 1 22 13615 1 1 12 GLN HE21 H -5.751 -10.472 -5.126 1.00 . A A . 12 GLN HE21 1 1 22 13616 1 1 12 GLN HE22 H -6.083 -12.154 -5.343 1.00 . A A . 12 GLN HE22 1 1 22 13617 1 1 12 GLN HG2 H -5.056 -9.547 -3.351 1.00 . A A . 12 GLN HG2 1 1 22 13618 1 1 12 GLN HG3 H -4.095 -10.588 -2.302 1.00 . A A . 12 GLN HG3 1 1 22 13619 1 1 12 GLN N N -4.996 -8.143 -0.562 1.00 . A A . 12 GLN N 1 1 22 13620 1 1 12 GLN NE2 N -5.810 -11.391 -4.791 1.00 . A A . 12 GLN NE2 1 1 22 13621 1 1 12 GLN O O -8.519 -8.932 -0.734 1.00 . A A . 12 GLN O 1 1 22 13622 1 1 12 GLN OE1 O -5.545 -12.738 -3.014 1.00 . A A . 12 GLN OE1 1 1 22 13623 1 1 13 CYS C C -8.080 -6.488 2.724 1.00 . A A . 13 CYS C 1 1 22 13624 1 1 13 CYS CA C -8.462 -7.411 1.570 1.00 . A A . 13 CYS CA 1 1 22 13625 1 1 13 CYS CB C -9.028 -8.721 2.121 1.00 . A A . 13 CYS CB 1 1 22 13626 1 1 13 CYS H H -6.451 -7.298 0.920 1.00 . A A . 13 CYS H 1 1 22 13627 1 1 13 CYS HA H -9.224 -6.926 0.977 1.00 . A A . 13 CYS HA 1 1 22 13628 1 1 13 CYS HB2 H -9.315 -9.357 1.297 1.00 . A A . 13 CYS HB2 1 1 22 13629 1 1 13 CYS HB3 H -8.264 -9.217 2.703 1.00 . A A . 13 CYS HB3 1 1 22 13630 1 1 13 CYS N N -7.323 -7.677 0.697 1.00 . A A . 13 CYS N 1 1 22 13631 1 1 13 CYS O O -8.896 -5.687 3.181 1.00 . A A . 13 CYS O 1 1 22 13632 1 1 13 CYS SG S -10.488 -8.509 3.190 1.00 . A A . 13 CYS SG 1 1 22 13633 1 1 14 LYS C C -5.209 -4.897 3.870 1.00 . A A . 14 LYS C 1 1 22 13634 1 1 14 LYS CA C -6.376 -5.774 4.303 1.00 . A A . 14 LYS CA 1 1 22 13635 1 1 14 LYS CB C -5.958 -6.652 5.485 1.00 . A A . 14 LYS CB 1 1 22 13636 1 1 14 LYS CD C -7.326 -5.819 7.420 1.00 . A A . 14 LYS CD 1 1 22 13637 1 1 14 LYS CE C -6.295 -5.822 8.537 1.00 . A A . 14 LYS CE 1 1 22 13638 1 1 14 LYS CG C -7.094 -6.961 6.445 1.00 . A A . 14 LYS CG 1 1 22 13639 1 1 14 LYS H H -6.232 -7.258 2.802 1.00 . A A . 14 LYS H 1 1 22 13640 1 1 14 LYS HA H -7.193 -5.139 4.611 1.00 . A A . 14 LYS HA 1 1 22 13641 1 1 14 LYS HB2 H -5.571 -7.586 5.105 1.00 . A A . 14 LYS HB2 1 1 22 13642 1 1 14 LYS HB3 H -5.178 -6.147 6.035 1.00 . A A . 14 LYS HB3 1 1 22 13643 1 1 14 LYS HD2 H -7.260 -4.883 6.886 1.00 . A A . 14 LYS HD2 1 1 22 13644 1 1 14 LYS HD3 H -8.311 -5.921 7.852 1.00 . A A . 14 LYS HD3 1 1 22 13645 1 1 14 LYS HE2 H -6.616 -6.510 9.304 1.00 . A A . 14 LYS HE2 1 1 22 13646 1 1 14 LYS HE3 H -5.348 -6.149 8.134 1.00 . A A . 14 LYS HE3 1 1 22 13647 1 1 14 LYS HG2 H -7.998 -7.125 5.877 1.00 . A A . 14 LYS HG2 1 1 22 13648 1 1 14 LYS HG3 H -6.849 -7.854 7.001 1.00 . A A . 14 LYS HG3 1 1 22 13649 1 1 14 LYS HZ1 H -6.234 -3.738 8.410 1.00 . A A . 14 LYS HZ1 1 1 22 13650 1 1 14 LYS HZ2 H -6.838 -4.317 9.880 1.00 . A A . 14 LYS HZ2 1 1 22 13651 1 1 14 LYS HZ3 H -5.178 -4.385 9.563 1.00 . A A . 14 LYS HZ3 1 1 22 13652 1 1 14 LYS N N -6.843 -6.602 3.199 1.00 . A A . 14 LYS N 1 1 22 13653 1 1 14 LYS NZ N -6.124 -4.471 9.140 1.00 . A A . 14 LYS NZ 1 1 22 13654 1 1 14 LYS O O -4.492 -5.223 2.924 1.00 . A A . 14 LYS O 1 1 22 13655 1 1 15 LEU C C -2.595 -3.586 4.287 1.00 . A A . 15 LEU C 1 1 22 13656 1 1 15 LEU CA C -3.935 -2.861 4.259 1.00 . A A . 15 LEU CA 1 1 22 13657 1 1 15 LEU CB C -3.913 -1.693 5.252 1.00 . A A . 15 LEU CB 1 1 22 13658 1 1 15 LEU CD1 C -6.282 -1.257 4.495 1.00 . A A . 15 LEU CD1 1 1 22 13659 1 1 15 LEU CD2 C -5.805 -1.754 6.903 1.00 . A A . 15 LEU CD2 1 1 22 13660 1 1 15 LEU CG C -5.280 -1.104 5.631 1.00 . A A . 15 LEU CG 1 1 22 13661 1 1 15 LEU H H -5.623 -3.581 5.315 1.00 . A A . 15 LEU H 1 1 22 13662 1 1 15 LEU HA H -4.102 -2.476 3.264 1.00 . A A . 15 LEU HA 1 1 22 13663 1 1 15 LEU HB2 H -3.431 -2.031 6.157 1.00 . A A . 15 LEU HB2 1 1 22 13664 1 1 15 LEU HB3 H -3.315 -0.901 4.824 1.00 . A A . 15 LEU HB3 1 1 22 13665 1 1 15 LEU HD11 H -5.755 -1.300 3.553 1.00 . A A . 15 LEU HD11 1 1 22 13666 1 1 15 LEU HD12 H -6.847 -2.167 4.633 1.00 . A A . 15 LEU HD12 1 1 22 13667 1 1 15 LEU HD13 H -6.954 -0.412 4.493 1.00 . A A . 15 LEU HD13 1 1 22 13668 1 1 15 LEU HD21 H -4.998 -2.262 7.409 1.00 . A A . 15 LEU HD21 1 1 22 13669 1 1 15 LEU HD22 H -6.214 -0.993 7.553 1.00 . A A . 15 LEU HD22 1 1 22 13670 1 1 15 LEU HD23 H -6.578 -2.465 6.652 1.00 . A A . 15 LEU HD23 1 1 22 13671 1 1 15 LEU HG H -5.162 -0.049 5.823 1.00 . A A . 15 LEU HG 1 1 22 13672 1 1 15 LEU N N -5.020 -3.784 4.571 1.00 . A A . 15 LEU N 1 1 22 13673 1 1 15 LEU O O -2.314 -4.352 5.209 1.00 . A A . 15 LEU O 1 1 22 13674 1 1 16 LYS C C 0.340 -3.729 4.468 1.00 . A A . 16 LYS C 1 1 22 13675 1 1 16 LYS CA C -0.463 -3.981 3.192 1.00 . A A . 16 LYS CA 1 1 22 13676 1 1 16 LYS CB C 0.307 -3.463 1.976 1.00 . A A . 16 LYS CB 1 1 22 13677 1 1 16 LYS CD C 1.305 -4.150 -0.225 1.00 . A A . 16 LYS CD 1 1 22 13678 1 1 16 LYS CE C 0.988 -4.730 -1.594 1.00 . A A . 16 LYS CE 1 1 22 13679 1 1 16 LYS CG C 0.144 -4.331 0.738 1.00 . A A . 16 LYS CG 1 1 22 13680 1 1 16 LYS H H -2.049 -2.724 2.567 1.00 . A A . 16 LYS H 1 1 22 13681 1 1 16 LYS HA H -0.623 -5.044 3.083 1.00 . A A . 16 LYS HA 1 1 22 13682 1 1 16 LYS HB2 H -0.041 -2.469 1.740 1.00 . A A . 16 LYS HB2 1 1 22 13683 1 1 16 LYS HB3 H 1.358 -3.419 2.221 1.00 . A A . 16 LYS HB3 1 1 22 13684 1 1 16 LYS HD2 H 1.512 -3.096 -0.332 1.00 . A A . 16 LYS HD2 1 1 22 13685 1 1 16 LYS HD3 H 2.174 -4.651 0.176 1.00 . A A . 16 LYS HD3 1 1 22 13686 1 1 16 LYS HE2 H -0.072 -4.637 -1.774 1.00 . A A . 16 LYS HE2 1 1 22 13687 1 1 16 LYS HE3 H 1.530 -4.171 -2.342 1.00 . A A . 16 LYS HE3 1 1 22 13688 1 1 16 LYS HG2 H 0.097 -5.366 1.040 1.00 . A A . 16 LYS HG2 1 1 22 13689 1 1 16 LYS HG3 H -0.774 -4.057 0.238 1.00 . A A . 16 LYS HG3 1 1 22 13690 1 1 16 LYS HZ1 H 2.332 -6.306 -1.321 1.00 . A A . 16 LYS HZ1 1 1 22 13691 1 1 16 LYS HZ2 H 0.710 -6.750 -1.139 1.00 . A A . 16 LYS HZ2 1 1 22 13692 1 1 16 LYS HZ3 H 1.344 -6.477 -2.684 1.00 . A A . 16 LYS HZ3 1 1 22 13693 1 1 16 LYS N N -1.771 -3.344 3.274 1.00 . A A . 16 LYS N 1 1 22 13694 1 1 16 LYS NZ N 1.370 -6.166 -1.691 1.00 . A A . 16 LYS NZ 1 1 22 13695 1 1 16 LYS O O 0.253 -2.653 5.061 1.00 . A A . 16 LYS O 1 1 22 13696 1 1 17 PRO C C 2.752 -3.302 6.159 1.00 . A A . 17 PRO C 1 1 22 13697 1 1 17 PRO CA C 1.945 -4.596 6.126 1.00 . A A . 17 PRO CA 1 1 22 13698 1 1 17 PRO CB C 2.876 -5.806 6.050 1.00 . A A . 17 PRO CB 1 1 22 13699 1 1 17 PRO CD C 1.295 -6.039 4.269 1.00 . A A . 17 PRO CD 1 1 22 13700 1 1 17 PRO CG C 2.116 -6.816 5.262 1.00 . A A . 17 PRO CG 1 1 22 13701 1 1 17 PRO HA H 1.337 -4.661 7.016 1.00 . A A . 17 PRO HA 1 1 22 13702 1 1 17 PRO HB2 H 3.795 -5.526 5.555 1.00 . A A . 17 PRO HB2 1 1 22 13703 1 1 17 PRO HB3 H 3.090 -6.162 7.046 1.00 . A A . 17 PRO HB3 1 1 22 13704 1 1 17 PRO HD2 H 1.823 -5.948 3.332 1.00 . A A . 17 PRO HD2 1 1 22 13705 1 1 17 PRO HD3 H 0.337 -6.514 4.119 1.00 . A A . 17 PRO HD3 1 1 22 13706 1 1 17 PRO HG2 H 2.803 -7.472 4.748 1.00 . A A . 17 PRO HG2 1 1 22 13707 1 1 17 PRO HG3 H 1.473 -7.384 5.918 1.00 . A A . 17 PRO HG3 1 1 22 13708 1 1 17 PRO N N 1.132 -4.720 4.912 1.00 . A A . 17 PRO N 1 1 22 13709 1 1 17 PRO O O 3.611 -3.074 5.307 1.00 . A A . 17 PRO O 1 1 22 13710 1 1 18 ALA C C 4.677 -1.356 7.133 1.00 . A A . 18 ALA C 1 1 22 13711 1 1 18 ALA CA C 3.170 -1.185 7.302 1.00 . A A . 18 ALA CA 1 1 22 13712 1 1 18 ALA CB C 2.857 -0.571 8.658 1.00 . A A . 18 ALA CB 1 1 22 13713 1 1 18 ALA H H 1.775 -2.698 7.796 1.00 . A A . 18 ALA H 1 1 22 13714 1 1 18 ALA HA H 2.807 -0.514 6.538 1.00 . A A . 18 ALA HA 1 1 22 13715 1 1 18 ALA HB1 H 3.267 -1.194 9.438 1.00 . A A . 18 ALA HB1 1 1 22 13716 1 1 18 ALA HB2 H 3.295 0.415 8.716 1.00 . A A . 18 ALA HB2 1 1 22 13717 1 1 18 ALA HB3 H 1.786 -0.497 8.781 1.00 . A A . 18 ALA HB3 1 1 22 13718 1 1 18 ALA N N 2.471 -2.458 7.150 1.00 . A A . 18 ALA N 1 1 22 13719 1 1 18 ALA O O 5.341 -1.967 7.971 1.00 . A A . 18 ALA O 1 1 22 13720 1 1 19 GLY C C 6.923 -1.831 4.591 1.00 . A A . 19 GLY C 1 1 22 13721 1 1 19 GLY CA C 6.629 -0.928 5.773 1.00 . A A . 19 GLY CA 1 1 22 13722 1 1 19 GLY H H 4.627 -0.349 5.406 1.00 . A A . 19 GLY H 1 1 22 13723 1 1 19 GLY HA2 H 7.121 -1.327 6.648 1.00 . A A . 19 GLY HA2 1 1 22 13724 1 1 19 GLY HA3 H 7.023 0.057 5.567 1.00 . A A . 19 GLY HA3 1 1 22 13725 1 1 19 GLY N N 5.208 -0.819 6.040 1.00 . A A . 19 GLY N 1 1 22 13726 1 1 19 GLY O O 8.020 -2.378 4.475 1.00 . A A . 19 GLY O 1 1 22 13727 1 1 20 THR C C 5.647 -2.084 1.277 1.00 . A A . 20 THR C 1 1 22 13728 1 1 20 THR CA C 6.089 -2.831 2.532 1.00 . A A . 20 THR CA 1 1 22 13729 1 1 20 THR CB C 5.273 -4.116 2.693 1.00 . A A . 20 THR CB 1 1 22 13730 1 1 20 THR CG2 C 5.354 -5.035 1.493 1.00 . A A . 20 THR CG2 1 1 22 13731 1 1 20 THR H H 5.087 -1.527 3.861 1.00 . A A . 20 THR H 1 1 22 13732 1 1 20 THR HA H 7.133 -3.086 2.437 1.00 . A A . 20 THR HA 1 1 22 13733 1 1 20 THR HB H 4.235 -3.854 2.839 1.00 . A A . 20 THR HB 1 1 22 13734 1 1 20 THR HG1 H 5.147 -5.616 3.945 1.00 . A A . 20 THR HG1 1 1 22 13735 1 1 20 THR HG21 H 5.780 -4.500 0.657 1.00 . A A . 20 THR HG21 1 1 22 13736 1 1 20 THR HG22 H 5.977 -5.885 1.732 1.00 . A A . 20 THR HG22 1 1 22 13737 1 1 20 THR HG23 H 4.363 -5.377 1.234 1.00 . A A . 20 THR HG23 1 1 22 13738 1 1 20 THR N N 5.938 -1.989 3.712 1.00 . A A . 20 THR N 1 1 22 13739 1 1 20 THR O O 4.613 -1.417 1.272 1.00 . A A . 20 THR O 1 1 22 13740 1 1 20 THR OG1 O 5.709 -4.848 3.824 1.00 . A A . 20 THR OG1 1 1 22 13741 1 1 21 THR C C 4.735 -1.916 -1.537 1.00 . A A . 21 THR C 1 1 22 13742 1 1 21 THR CA C 6.127 -1.536 -1.046 1.00 . A A . 21 THR CA 1 1 22 13743 1 1 21 THR CB C 7.173 -1.888 -2.106 1.00 . A A . 21 THR CB 1 1 22 13744 1 1 21 THR CG2 C 8.002 -0.699 -2.530 1.00 . A A . 21 THR CG2 1 1 22 13745 1 1 21 THR H H 7.249 -2.747 0.281 1.00 . A A . 21 THR H 1 1 22 13746 1 1 21 THR HA H 6.153 -0.470 -0.874 1.00 . A A . 21 THR HA 1 1 22 13747 1 1 21 THR HB H 6.671 -2.271 -2.983 1.00 . A A . 21 THR HB 1 1 22 13748 1 1 21 THR HG1 H 8.599 -3.208 -2.356 1.00 . A A . 21 THR HG1 1 1 22 13749 1 1 21 THR HG21 H 7.530 0.209 -2.182 1.00 . A A . 21 THR HG21 1 1 22 13750 1 1 21 THR HG22 H 8.990 -0.777 -2.101 1.00 . A A . 21 THR HG22 1 1 22 13751 1 1 21 THR HG23 H 8.076 -0.677 -3.606 1.00 . A A . 21 THR HG23 1 1 22 13752 1 1 21 THR N N 6.437 -2.201 0.215 1.00 . A A . 21 THR N 1 1 22 13753 1 1 21 THR O O 4.384 -3.094 -1.593 1.00 . A A . 21 THR O 1 1 22 13754 1 1 21 THR OG1 O 8.060 -2.885 -1.630 1.00 . A A . 21 THR OG1 1 1 22 13755 1 1 22 CYS C C 2.400 -0.551 -3.767 1.00 . A A . 22 CYS C 1 1 22 13756 1 1 22 CYS CA C 2.589 -1.131 -2.369 1.00 . A A . 22 CYS CA 1 1 22 13757 1 1 22 CYS CB C 1.578 -0.506 -1.408 1.00 . A A . 22 CYS CB 1 1 22 13758 1 1 22 CYS H H 4.283 0.011 -1.817 1.00 . A A . 22 CYS H 1 1 22 13759 1 1 22 CYS HA H 2.423 -2.196 -2.409 1.00 . A A . 22 CYS HA 1 1 22 13760 1 1 22 CYS HB2 H 0.582 -0.775 -1.723 1.00 . A A . 22 CYS HB2 1 1 22 13761 1 1 22 CYS HB3 H 1.752 -0.892 -0.414 1.00 . A A . 22 CYS HB3 1 1 22 13762 1 1 22 CYS N N 3.945 -0.907 -1.887 1.00 . A A . 22 CYS N 1 1 22 13763 1 1 22 CYS O O 1.283 -0.216 -4.161 1.00 . A A . 22 CYS O 1 1 22 13764 1 1 22 CYS SG S 1.657 1.313 -1.320 1.00 . A A . 22 CYS SG 1 1 22 13765 1 1 23 TRP C C 4.582 -0.395 -6.720 1.00 . A A . 23 TRP C 1 1 22 13766 1 1 23 TRP CA C 3.429 0.107 -5.866 1.00 . A A . 23 TRP CA 1 1 22 13767 1 1 23 TRP CB C 3.435 1.641 -5.831 1.00 . A A . 23 TRP CB 1 1 22 13768 1 1 23 TRP CD1 C 1.086 1.653 -6.813 1.00 . A A . 23 TRP CD1 1 1 22 13769 1 1 23 TRP CD2 C 2.203 3.560 -7.143 1.00 . A A . 23 TRP CD2 1 1 22 13770 1 1 23 TRP CE2 C 0.926 3.680 -7.726 1.00 . A A . 23 TRP CE2 1 1 22 13771 1 1 23 TRP CE3 C 3.082 4.643 -7.226 1.00 . A A . 23 TRP CE3 1 1 22 13772 1 1 23 TRP CG C 2.280 2.249 -6.565 1.00 . A A . 23 TRP CG 1 1 22 13773 1 1 23 TRP CH2 C 1.390 5.880 -8.443 1.00 . A A . 23 TRP CH2 1 1 22 13774 1 1 23 TRP CZ2 C 0.510 4.836 -8.380 1.00 . A A . 23 TRP CZ2 1 1 22 13775 1 1 23 TRP CZ3 C 2.667 5.791 -7.875 1.00 . A A . 23 TRP CZ3 1 1 22 13776 1 1 23 TRP H H 4.358 -0.717 -4.151 1.00 . A A . 23 TRP H 1 1 22 13777 1 1 23 TRP HA H 2.507 -0.229 -6.308 1.00 . A A . 23 TRP HA 1 1 22 13778 1 1 23 TRP HB2 H 3.389 1.972 -4.804 1.00 . A A . 23 TRP HB2 1 1 22 13779 1 1 23 TRP HB3 H 4.346 2.004 -6.280 1.00 . A A . 23 TRP HB3 1 1 22 13780 1 1 23 TRP HD1 H 0.841 0.652 -6.499 1.00 . A A . 23 TRP HD1 1 1 22 13781 1 1 23 TRP HE1 H -0.643 2.296 -7.811 1.00 . A A . 23 TRP HE1 1 1 22 13782 1 1 23 TRP HE3 H 4.070 4.593 -6.797 1.00 . A A . 23 TRP HE3 1 1 22 13783 1 1 23 TRP HH2 H 1.108 6.795 -8.940 1.00 . A A . 23 TRP HH2 1 1 22 13784 1 1 23 TRP HZ2 H -0.471 4.920 -8.823 1.00 . A A . 23 TRP HZ2 1 1 22 13785 1 1 23 TRP HZ3 H 3.332 6.639 -7.947 1.00 . A A . 23 TRP HZ3 1 1 22 13786 1 1 23 TRP N N 3.493 -0.434 -4.515 1.00 . A A . 23 TRP N 1 1 22 13787 1 1 23 TRP NE1 N 0.266 2.501 -7.514 1.00 . A A . 23 TRP NE1 1 1 22 13788 1 1 23 TRP O O 4.399 -1.229 -7.607 1.00 . A A . 23 TRP O 1 1 22 13789 1 1 24 LYS C C 6.693 -0.230 -8.698 1.00 . A A . 24 LYS C 1 1 22 13790 1 1 24 LYS CA C 6.965 -0.247 -7.194 1.00 . A A . 24 LYS CA 1 1 22 13791 1 1 24 LYS CB C 7.442 -1.634 -6.760 1.00 . A A . 24 LYS CB 1 1 22 13792 1 1 24 LYS CD C 8.821 -3.519 -7.687 1.00 . A A . 24 LYS CD 1 1 22 13793 1 1 24 LYS CE C 10.249 -4.008 -7.872 1.00 . A A . 24 LYS CE 1 1 22 13794 1 1 24 LYS CG C 8.779 -2.034 -7.363 1.00 . A A . 24 LYS CG 1 1 22 13795 1 1 24 LYS H H 5.833 0.789 -5.733 1.00 . A A . 24 LYS H 1 1 22 13796 1 1 24 LYS HA H 7.735 0.476 -6.971 1.00 . A A . 24 LYS HA 1 1 22 13797 1 1 24 LYS HB2 H 7.538 -1.646 -5.684 1.00 . A A . 24 LYS HB2 1 1 22 13798 1 1 24 LYS HB3 H 6.704 -2.364 -7.056 1.00 . A A . 24 LYS HB3 1 1 22 13799 1 1 24 LYS HD2 H 8.366 -4.068 -6.877 1.00 . A A . 24 LYS HD2 1 1 22 13800 1 1 24 LYS HD3 H 8.269 -3.694 -8.599 1.00 . A A . 24 LYS HD3 1 1 22 13801 1 1 24 LYS HE2 H 10.840 -3.204 -8.285 1.00 . A A . 24 LYS HE2 1 1 22 13802 1 1 24 LYS HE3 H 10.647 -4.288 -6.908 1.00 . A A . 24 LYS HE3 1 1 22 13803 1 1 24 LYS HG2 H 8.935 -1.473 -8.272 1.00 . A A . 24 LYS HG2 1 1 22 13804 1 1 24 LYS HG3 H 9.564 -1.806 -6.657 1.00 . A A . 24 LYS HG3 1 1 22 13805 1 1 24 LYS HZ1 H 9.407 -5.678 -8.802 1.00 . A A . 24 LYS HZ1 1 1 22 13806 1 1 24 LYS HZ2 H 10.548 -4.868 -9.752 1.00 . A A . 24 LYS HZ2 1 1 22 13807 1 1 24 LYS HZ3 H 11.058 -5.840 -8.465 1.00 . A A . 24 LYS HZ3 1 1 22 13808 1 1 24 LYS N N 5.766 0.129 -6.450 1.00 . A A . 24 LYS N 1 1 22 13809 1 1 24 LYS NZ N 10.320 -5.180 -8.787 1.00 . A A . 24 LYS NZ 1 1 22 13810 1 1 24 LYS O O 7.027 -1.174 -9.413 1.00 . A A . 24 LYS O 1 1 22 13811 1 1 25 THR C C 6.964 1.345 -11.413 1.00 . A A . 25 THR C 1 1 22 13812 1 1 25 THR CA C 5.735 0.995 -10.577 1.00 . A A . 25 THR CA 1 1 22 13813 1 1 25 THR CB C 4.654 2.064 -10.751 1.00 . A A . 25 THR CB 1 1 22 13814 1 1 25 THR CG2 C 3.882 1.931 -12.046 1.00 . A A . 25 THR CG2 1 1 22 13815 1 1 25 THR H H 5.823 1.563 -8.540 1.00 . A A . 25 THR H 1 1 22 13816 1 1 25 THR HA H 5.346 0.048 -10.919 1.00 . A A . 25 THR HA 1 1 22 13817 1 1 25 THR HB H 5.119 3.038 -10.742 1.00 . A A . 25 THR HB 1 1 22 13818 1 1 25 THR HG1 H 3.234 2.835 -9.645 1.00 . A A . 25 THR HG1 1 1 22 13819 1 1 25 THR HG21 H 4.147 1.003 -12.530 1.00 . A A . 25 THR HG21 1 1 22 13820 1 1 25 THR HG22 H 2.822 1.937 -11.835 1.00 . A A . 25 THR HG22 1 1 22 13821 1 1 25 THR HG23 H 4.124 2.759 -12.696 1.00 . A A . 25 THR HG23 1 1 22 13822 1 1 25 THR N N 6.071 0.850 -9.164 1.00 . A A . 25 THR N 1 1 22 13823 1 1 25 THR O O 7.016 2.396 -12.053 1.00 . A A . 25 THR O 1 1 22 13824 1 1 25 THR OG1 O 3.719 2.008 -9.688 1.00 . A A . 25 THR OG1 1 1 22 13825 1 1 26 SER C C 9.871 1.958 -11.826 1.00 . A A . 26 SER C 1 1 22 13826 1 1 26 SER CA C 9.175 0.641 -12.176 1.00 . A A . 26 SER CA 1 1 22 13827 1 1 26 SER CB C 8.874 0.600 -13.675 1.00 . A A . 26 SER CB 1 1 22 13828 1 1 26 SER H H 7.834 -0.373 -10.888 1.00 . A A . 26 SER H 1 1 22 13829 1 1 26 SER HA H 9.841 -0.174 -11.936 1.00 . A A . 26 SER HA 1 1 22 13830 1 1 26 SER HB2 H 7.893 1.014 -13.854 1.00 . A A . 26 SER HB2 1 1 22 13831 1 1 26 SER HB3 H 9.613 1.183 -14.205 1.00 . A A . 26 SER HB3 1 1 22 13832 1 1 26 SER HG H 8.866 -0.718 -15.125 1.00 . A A . 26 SER HG 1 1 22 13833 1 1 26 SER N N 7.945 0.448 -11.411 1.00 . A A . 26 SER N 1 1 22 13834 1 1 26 SER O O 10.711 2.437 -12.585 1.00 . A A . 26 SER O 1 1 22 13835 1 1 26 SER OG O 8.903 -0.729 -14.166 1.00 . A A . 26 SER OG 1 1 22 13836 1 1 27 VAL C C 9.314 4.386 -9.078 1.00 . A A . 27 VAL C 1 1 22 13837 1 1 27 VAL CA C 10.123 3.789 -10.222 1.00 . A A . 27 VAL CA 1 1 22 13838 1 1 27 VAL CB C 10.225 4.833 -11.359 1.00 . A A . 27 VAL CB 1 1 22 13839 1 1 27 VAL CG1 C 8.877 5.028 -12.034 1.00 . A A . 27 VAL CG1 1 1 22 13840 1 1 27 VAL CG2 C 10.756 6.159 -10.828 1.00 . A A . 27 VAL CG2 1 1 22 13841 1 1 27 VAL H H 8.855 2.097 -10.108 1.00 . A A . 27 VAL H 1 1 22 13842 1 1 27 VAL HA H 11.118 3.574 -9.868 1.00 . A A . 27 VAL HA 1 1 22 13843 1 1 27 VAL HB H 10.921 4.466 -12.098 1.00 . A A . 27 VAL HB 1 1 22 13844 1 1 27 VAL HG11 H 8.456 4.066 -12.282 1.00 . A A . 27 VAL HG11 1 1 22 13845 1 1 27 VAL HG12 H 8.210 5.551 -11.364 1.00 . A A . 27 VAL HG12 1 1 22 13846 1 1 27 VAL HG13 H 9.006 5.607 -12.937 1.00 . A A . 27 VAL HG13 1 1 22 13847 1 1 27 VAL HG21 H 11.732 6.007 -10.391 1.00 . A A . 27 VAL HG21 1 1 22 13848 1 1 27 VAL HG22 H 10.832 6.868 -11.640 1.00 . A A . 27 VAL HG22 1 1 22 13849 1 1 27 VAL HG23 H 10.081 6.543 -10.077 1.00 . A A . 27 VAL HG23 1 1 22 13850 1 1 27 VAL N N 9.525 2.532 -10.675 1.00 . A A . 27 VAL N 1 1 22 13851 1 1 27 VAL O O 9.864 4.774 -8.047 1.00 . A A . 27 VAL O 1 1 22 13852 1 1 28 SER C C 6.778 3.949 -7.213 1.00 . A A . 28 SER C 1 1 22 13853 1 1 28 SER CA C 7.111 5.001 -8.262 1.00 . A A . 28 SER CA 1 1 22 13854 1 1 28 SER CB C 5.827 5.514 -8.915 1.00 . A A . 28 SER CB 1 1 22 13855 1 1 28 SER H H 7.632 4.126 -10.114 1.00 . A A . 28 SER H 1 1 22 13856 1 1 28 SER HA H 7.616 5.826 -7.782 1.00 . A A . 28 SER HA 1 1 22 13857 1 1 28 SER HB2 H 5.407 4.738 -9.538 1.00 . A A . 28 SER HB2 1 1 22 13858 1 1 28 SER HB3 H 5.118 5.780 -8.146 1.00 . A A . 28 SER HB3 1 1 22 13859 1 1 28 SER HG H 6.873 6.509 -10.239 1.00 . A A . 28 SER HG 1 1 22 13860 1 1 28 SER N N 8.006 4.454 -9.271 1.00 . A A . 28 SER N 1 1 22 13861 1 1 28 SER O O 5.764 3.261 -7.313 1.00 . A A . 28 SER O 1 1 22 13862 1 1 28 SER OG O 6.081 6.655 -9.716 1.00 . A A . 28 SER OG 1 1 22 13863 1 1 29 SER C C 7.141 3.560 -3.823 1.00 . A A . 29 SER C 1 1 22 13864 1 1 29 SER CA C 7.431 2.857 -5.142 1.00 . A A . 29 SER CA 1 1 22 13865 1 1 29 SER CB C 8.656 1.953 -4.998 1.00 . A A . 29 SER CB 1 1 22 13866 1 1 29 SER H H 8.430 4.404 -6.184 1.00 . A A . 29 SER H 1 1 22 13867 1 1 29 SER HA H 6.575 2.254 -5.406 1.00 . A A . 29 SER HA 1 1 22 13868 1 1 29 SER HB2 H 8.372 1.043 -4.493 1.00 . A A . 29 SER HB2 1 1 22 13869 1 1 29 SER HB3 H 9.043 1.715 -5.978 1.00 . A A . 29 SER HB3 1 1 22 13870 1 1 29 SER HG H 10.372 2.886 -4.839 1.00 . A A . 29 SER HG 1 1 22 13871 1 1 29 SER N N 7.638 3.828 -6.209 1.00 . A A . 29 SER N 1 1 22 13872 1 1 29 SER O O 7.772 4.563 -3.490 1.00 . A A . 29 SER O 1 1 22 13873 1 1 29 SER OG O 9.676 2.591 -4.247 1.00 . A A . 29 SER OG 1 1 22 13874 1 1 30 HIS C C 5.406 2.550 -0.795 1.00 . A A . 30 HIS C 1 1 22 13875 1 1 30 HIS CA C 5.789 3.625 -1.805 1.00 . A A . 30 HIS CA 1 1 22 13876 1 1 30 HIS CB C 4.620 4.592 -2.010 1.00 . A A . 30 HIS CB 1 1 22 13877 1 1 30 HIS CD2 C 4.725 5.089 -4.550 1.00 . A A . 30 HIS CD2 1 1 22 13878 1 1 30 HIS CE1 C 5.075 7.248 -4.448 1.00 . A A . 30 HIS CE1 1 1 22 13879 1 1 30 HIS CG C 4.759 5.432 -3.242 1.00 . A A . 30 HIS CG 1 1 22 13880 1 1 30 HIS H H 5.698 2.242 -3.404 1.00 . A A . 30 HIS H 1 1 22 13881 1 1 30 HIS HA H 6.636 4.175 -1.425 1.00 . A A . 30 HIS HA 1 1 22 13882 1 1 30 HIS HB2 H 3.704 4.026 -2.097 1.00 . A A . 30 HIS HB2 1 1 22 13883 1 1 30 HIS HB3 H 4.553 5.253 -1.159 1.00 . A A . 30 HIS HB3 1 1 22 13884 1 1 30 HIS HD1 H 5.052 7.342 -2.403 1.00 . A A . 30 HIS HD1 1 1 22 13885 1 1 30 HIS HD2 H 4.577 4.094 -4.948 1.00 . A A . 30 HIS HD2 1 1 22 13886 1 1 30 HIS HE1 H 5.258 8.274 -4.733 1.00 . A A . 30 HIS HE1 1 1 22 13887 1 1 30 HIS HE2 H 5.039 6.279 -6.249 1.00 . A A . 30 HIS HE2 1 1 22 13888 1 1 30 HIS N N 6.172 3.036 -3.081 1.00 . A A . 30 HIS N 1 1 22 13889 1 1 30 HIS ND1 N 4.980 6.792 -3.211 1.00 . A A . 30 HIS ND1 1 1 22 13890 1 1 30 HIS NE2 N 4.924 6.235 -5.278 1.00 . A A . 30 HIS NE2 1 1 22 13891 1 1 30 HIS O O 4.534 1.721 -1.054 1.00 . A A . 30 HIS O 1 1 22 13892 1 1 31 TYR C C 4.440 1.888 2.065 1.00 . A A . 31 TYR C 1 1 22 13893 1 1 31 TYR CA C 5.789 1.606 1.413 1.00 . A A . 31 TYR CA 1 1 22 13894 1 1 31 TYR CB C 6.896 1.643 2.469 1.00 . A A . 31 TYR CB 1 1 22 13895 1 1 31 TYR CD1 C 8.606 0.848 0.789 1.00 . A A . 31 TYR CD1 1 1 22 13896 1 1 31 TYR CD2 C 8.798 0.084 3.039 1.00 . A A . 31 TYR CD2 1 1 22 13897 1 1 31 TYR CE1 C 9.727 0.118 0.442 1.00 . A A . 31 TYR CE1 1 1 22 13898 1 1 31 TYR CE2 C 9.919 -0.648 2.700 1.00 . A A . 31 TYR CE2 1 1 22 13899 1 1 31 TYR CG C 8.123 0.843 2.092 1.00 . A A . 31 TYR CG 1 1 22 13900 1 1 31 TYR CZ C 10.379 -0.628 1.400 1.00 . A A . 31 TYR CZ 1 1 22 13901 1 1 31 TYR H H 6.744 3.262 0.508 1.00 . A A . 31 TYR H 1 1 22 13902 1 1 31 TYR HA H 5.762 0.624 0.965 1.00 . A A . 31 TYR HA 1 1 22 13903 1 1 31 TYR HB2 H 7.203 2.667 2.623 1.00 . A A . 31 TYR HB2 1 1 22 13904 1 1 31 TYR HB3 H 6.512 1.245 3.397 1.00 . A A . 31 TYR HB3 1 1 22 13905 1 1 31 TYR HD1 H 8.093 1.433 0.041 1.00 . A A . 31 TYR HD1 1 1 22 13906 1 1 31 TYR HD2 H 8.435 0.070 4.056 1.00 . A A . 31 TYR HD2 1 1 22 13907 1 1 31 TYR HE1 H 10.087 0.135 -0.576 1.00 . A A . 31 TYR HE1 1 1 22 13908 1 1 31 TYR HE2 H 10.430 -1.232 3.451 1.00 . A A . 31 TYR HE2 1 1 22 13909 1 1 31 TYR HH H 12.036 -0.847 0.449 1.00 . A A . 31 TYR HH 1 1 22 13910 1 1 31 TYR N N 6.062 2.574 0.360 1.00 . A A . 31 TYR N 1 1 22 13911 1 1 31 TYR O O 4.154 3.021 2.453 1.00 . A A . 31 TYR O 1 1 22 13912 1 1 31 TYR OH O 11.496 -1.356 1.058 1.00 . A A . 31 TYR OH 1 1 22 13913 1 1 32 CYS C C 2.423 1.216 4.290 1.00 . A A . 32 CYS C 1 1 22 13914 1 1 32 CYS CA C 2.300 1.000 2.788 1.00 . A A . 32 CYS CA 1 1 22 13915 1 1 32 CYS CB C 1.444 -0.238 2.507 1.00 . A A . 32 CYS CB 1 1 22 13916 1 1 32 CYS H H 3.895 -0.025 1.858 1.00 . A A . 32 CYS H 1 1 22 13917 1 1 32 CYS HA H 1.826 1.864 2.349 1.00 . A A . 32 CYS HA 1 1 22 13918 1 1 32 CYS HB2 H 1.716 -0.641 1.543 1.00 . A A . 32 CYS HB2 1 1 22 13919 1 1 32 CYS HB3 H 1.637 -0.979 3.268 1.00 . A A . 32 CYS HB3 1 1 22 13920 1 1 32 CYS N N 3.615 0.854 2.183 1.00 . A A . 32 CYS N 1 1 22 13921 1 1 32 CYS O O 3.420 0.838 4.903 1.00 . A A . 32 CYS O 1 1 22 13922 1 1 32 CYS SG S -0.350 0.084 2.486 1.00 . A A . 32 CYS SG 1 1 22 13923 1 1 33 THR C C 0.379 1.174 7.008 1.00 . A A . 33 THR C 1 1 22 13924 1 1 33 THR CA C 1.385 2.082 6.308 1.00 . A A . 33 THR CA 1 1 22 13925 1 1 33 THR CB C 1.042 3.548 6.575 1.00 . A A . 33 THR CB 1 1 22 13926 1 1 33 THR CG2 C 1.903 4.517 5.794 1.00 . A A . 33 THR CG2 1 1 22 13927 1 1 33 THR H H 0.631 2.093 4.334 1.00 . A A . 33 THR H 1 1 22 13928 1 1 33 THR HA H 2.372 1.874 6.694 1.00 . A A . 33 THR HA 1 1 22 13929 1 1 33 THR HB H 1.183 3.755 7.627 1.00 . A A . 33 THR HB 1 1 22 13930 1 1 33 THR HG1 H -0.886 3.301 6.816 1.00 . A A . 33 THR HG1 1 1 22 13931 1 1 33 THR HG21 H 2.904 4.120 5.707 1.00 . A A . 33 THR HG21 1 1 22 13932 1 1 33 THR HG22 H 1.484 4.656 4.808 1.00 . A A . 33 THR HG22 1 1 22 13933 1 1 33 THR HG23 H 1.935 5.466 6.308 1.00 . A A . 33 THR HG23 1 1 22 13934 1 1 33 THR N N 1.399 1.821 4.876 1.00 . A A . 33 THR N 1 1 22 13935 1 1 33 THR O O 0.027 1.400 8.166 1.00 . A A . 33 THR O 1 1 22 13936 1 1 33 THR OG1 O -0.310 3.815 6.246 1.00 . A A . 33 THR OG1 1 1 22 13937 1 1 34 GLY C C -2.188 -0.085 7.582 1.00 . A A . 34 GLY C 1 1 22 13938 1 1 34 GLY CA C -1.045 -0.785 6.867 1.00 . A A . 34 GLY CA 1 1 22 13939 1 1 34 GLY H H 0.239 0.011 5.376 1.00 . A A . 34 GLY H 1 1 22 13940 1 1 34 GLY HA2 H -0.535 -1.427 7.570 1.00 . A A . 34 GLY HA2 1 1 22 13941 1 1 34 GLY HA3 H -1.452 -1.393 6.073 1.00 . A A . 34 GLY HA3 1 1 22 13942 1 1 34 GLY N N -0.081 0.143 6.297 1.00 . A A . 34 GLY N 1 1 22 13943 1 1 34 GLY O O -2.774 -0.636 8.514 1.00 . A A . 34 GLY O 1 1 22 13944 1 1 35 ARG C C -4.712 2.161 6.764 1.00 . A A . 35 ARG C 1 1 22 13945 1 1 35 ARG CA C -3.582 1.906 7.759 1.00 . A A . 35 ARG CA 1 1 22 13946 1 1 35 ARG CB C -3.046 3.237 8.289 1.00 . A A . 35 ARG CB 1 1 22 13947 1 1 35 ARG CD C -2.086 4.022 10.477 1.00 . A A . 35 ARG CD 1 1 22 13948 1 1 35 ARG CG C -1.916 3.082 9.294 1.00 . A A . 35 ARG CG 1 1 22 13949 1 1 35 ARG CZ C -1.357 4.185 12.825 1.00 . A A . 35 ARG CZ 1 1 22 13950 1 1 35 ARG H H -2.000 1.521 6.403 1.00 . A A . 35 ARG H 1 1 22 13951 1 1 35 ARG HA H -3.972 1.332 8.586 1.00 . A A . 35 ARG HA 1 1 22 13952 1 1 35 ARG HB2 H -2.683 3.823 7.458 1.00 . A A . 35 ARG HB2 1 1 22 13953 1 1 35 ARG HB3 H -3.854 3.771 8.768 1.00 . A A . 35 ARG HB3 1 1 22 13954 1 1 35 ARG HD2 H -1.648 4.977 10.227 1.00 . A A . 35 ARG HD2 1 1 22 13955 1 1 35 ARG HD3 H -3.141 4.150 10.670 1.00 . A A . 35 ARG HD3 1 1 22 13956 1 1 35 ARG HE H -1.052 2.609 11.640 1.00 . A A . 35 ARG HE 1 1 22 13957 1 1 35 ARG HG2 H -1.906 2.064 9.656 1.00 . A A . 35 ARG HG2 1 1 22 13958 1 1 35 ARG HG3 H -0.979 3.300 8.804 1.00 . A A . 35 ARG HG3 1 1 22 13959 1 1 35 ARG HH11 H -2.328 5.819 12.134 1.00 . A A . 35 ARG HH11 1 1 22 13960 1 1 35 ARG HH12 H -1.805 5.909 13.782 1.00 . A A . 35 ARG HH12 1 1 22 13961 1 1 35 ARG HH21 H -0.364 2.724 13.808 1.00 . A A . 35 ARG HH21 1 1 22 13962 1 1 35 ARG HH22 H -0.690 4.152 14.733 1.00 . A A . 35 ARG HH22 1 1 22 13963 1 1 35 ARG N N -2.504 1.133 7.148 1.00 . A A . 35 ARG N 1 1 22 13964 1 1 35 ARG NE N -1.442 3.507 11.683 1.00 . A A . 35 ARG NE 1 1 22 13965 1 1 35 ARG NH1 N -1.872 5.404 12.921 1.00 . A A . 35 ARG NH1 1 1 22 13966 1 1 35 ARG NH2 N -0.754 3.643 13.875 1.00 . A A . 35 ARG NH2 1 1 22 13967 1 1 35 ARG O O -5.878 2.247 7.147 1.00 . A A . 35 ARG O 1 1 22 13968 1 1 36 SER C C -4.865 1.990 3.099 1.00 . A A . 36 SER C 1 1 22 13969 1 1 36 SER CA C -5.348 2.528 4.443 1.00 . A A . 36 SER CA 1 1 22 13970 1 1 36 SER CB C -5.641 4.025 4.332 1.00 . A A . 36 SER CB 1 1 22 13971 1 1 36 SER H H -3.415 2.205 5.242 1.00 . A A . 36 SER H 1 1 22 13972 1 1 36 SER HA H -6.256 2.012 4.718 1.00 . A A . 36 SER HA 1 1 22 13973 1 1 36 SER HB2 H -6.609 4.168 3.875 1.00 . A A . 36 SER HB2 1 1 22 13974 1 1 36 SER HB3 H -5.641 4.464 5.319 1.00 . A A . 36 SER HB3 1 1 22 13975 1 1 36 SER HG H -3.788 4.389 3.809 1.00 . A A . 36 SER HG 1 1 22 13976 1 1 36 SER N N -4.360 2.282 5.488 1.00 . A A . 36 SER N 1 1 22 13977 1 1 36 SER O O -3.689 1.666 2.939 1.00 . A A . 36 SER O 1 1 22 13978 1 1 36 SER OG O -4.664 4.680 3.542 1.00 . A A . 36 SER OG 1 1 22 13979 1 1 37 CYS C C -4.776 2.483 -0.041 1.00 . A A . 37 CYS C 1 1 22 13980 1 1 37 CYS CA C -5.446 1.402 0.806 1.00 . A A . 37 CYS CA 1 1 22 13981 1 1 37 CYS CB C -6.704 0.902 0.097 1.00 . A A . 37 CYS CB 1 1 22 13982 1 1 37 CYS H H -6.702 2.174 2.327 1.00 . A A . 37 CYS H 1 1 22 13983 1 1 37 CYS HA H -4.760 0.577 0.924 1.00 . A A . 37 CYS HA 1 1 22 13984 1 1 37 CYS HB2 H -7.549 1.491 0.420 1.00 . A A . 37 CYS HB2 1 1 22 13985 1 1 37 CYS HB3 H -6.576 1.019 -0.969 1.00 . A A . 37 CYS HB3 1 1 22 13986 1 1 37 CYS N N -5.780 1.900 2.137 1.00 . A A . 37 CYS N 1 1 22 13987 1 1 37 CYS O O -4.325 2.215 -1.155 1.00 . A A . 37 CYS O 1 1 22 13988 1 1 37 CYS SG S -7.095 -0.846 0.420 1.00 . A A . 37 CYS SG 1 1 22 13989 1 1 38 GLU C C -2.588 4.802 -0.077 1.00 . A A . 38 GLU C 1 1 22 13990 1 1 38 GLU CA C -4.105 4.814 -0.237 1.00 . A A . 38 GLU CA 1 1 22 13991 1 1 38 GLU CB C -4.670 6.145 0.261 1.00 . A A . 38 GLU CB 1 1 22 13992 1 1 38 GLU CD C -5.076 8.585 -0.250 1.00 . A A . 38 GLU CD 1 1 22 13993 1 1 38 GLU CG C -4.332 7.323 -0.638 1.00 . A A . 38 GLU CG 1 1 22 13994 1 1 38 GLU H H -5.097 3.862 1.373 1.00 . A A . 38 GLU H 1 1 22 13995 1 1 38 GLU HA H -4.345 4.701 -1.283 1.00 . A A . 38 GLU HA 1 1 22 13996 1 1 38 GLU HB2 H -5.746 6.066 0.324 1.00 . A A . 38 GLU HB2 1 1 22 13997 1 1 38 GLU HB3 H -4.275 6.346 1.246 1.00 . A A . 38 GLU HB3 1 1 22 13998 1 1 38 GLU HG2 H -3.271 7.516 -0.573 1.00 . A A . 38 GLU HG2 1 1 22 13999 1 1 38 GLU HG3 H -4.589 7.069 -1.656 1.00 . A A . 38 GLU HG3 1 1 22 14000 1 1 38 GLU N N -4.717 3.703 0.484 1.00 . A A . 38 GLU N 1 1 22 14001 1 1 38 GLU O O -2.067 4.993 1.022 1.00 . A A . 38 GLU O 1 1 22 14002 1 1 38 GLU OE1 O -4.413 9.574 0.128 1.00 . A A . 38 GLU OE1 1 1 22 14003 1 1 38 GLU OE2 O -6.323 8.586 -0.324 1.00 . A A . 38 GLU OE2 1 1 22 14004 1 1 39 CYS C C 0.146 5.964 -1.242 1.00 . A A . 39 CYS C 1 1 22 14005 1 1 39 CYS CA C -0.425 4.549 -1.168 1.00 . A A . 39 CYS CA 1 1 22 14006 1 1 39 CYS CB C 0.103 3.715 -2.338 1.00 . A A . 39 CYS CB 1 1 22 14007 1 1 39 CYS H H -2.355 4.438 -2.030 1.00 . A A . 39 CYS H 1 1 22 14008 1 1 39 CYS HA H -0.112 4.093 -0.240 1.00 . A A . 39 CYS HA 1 1 22 14009 1 1 39 CYS HB2 H -0.419 4.002 -3.238 1.00 . A A . 39 CYS HB2 1 1 22 14010 1 1 39 CYS HB3 H 1.158 3.912 -2.462 1.00 . A A . 39 CYS HB3 1 1 22 14011 1 1 39 CYS N N -1.883 4.580 -1.183 1.00 . A A . 39 CYS N 1 1 22 14012 1 1 39 CYS O O -0.440 6.844 -1.873 1.00 . A A . 39 CYS O 1 1 22 14013 1 1 39 CYS SG S -0.105 1.917 -2.129 1.00 . A A . 39 CYS SG 1 1 22 14014 1 1 40 PRO C C 2.163 8.053 -2.011 1.00 . A A . 40 PRO C 1 1 22 14015 1 1 40 PRO CA C 1.944 7.521 -0.599 1.00 . A A . 40 PRO CA 1 1 22 14016 1 1 40 PRO CB C 3.287 7.268 0.091 1.00 . A A . 40 PRO CB 1 1 22 14017 1 1 40 PRO CD C 2.070 5.213 0.179 1.00 . A A . 40 PRO CD 1 1 22 14018 1 1 40 PRO CG C 3.064 6.055 0.927 1.00 . A A . 40 PRO CG 1 1 22 14019 1 1 40 PRO HA H 1.373 8.240 -0.030 1.00 . A A . 40 PRO HA 1 1 22 14020 1 1 40 PRO HB2 H 4.051 7.101 -0.654 1.00 . A A . 40 PRO HB2 1 1 22 14021 1 1 40 PRO HB3 H 3.549 8.122 0.698 1.00 . A A . 40 PRO HB3 1 1 22 14022 1 1 40 PRO HD2 H 2.578 4.520 -0.476 1.00 . A A . 40 PRO HD2 1 1 22 14023 1 1 40 PRO HD3 H 1.429 4.683 0.868 1.00 . A A . 40 PRO HD3 1 1 22 14024 1 1 40 PRO HG2 H 3.993 5.518 1.050 1.00 . A A . 40 PRO HG2 1 1 22 14025 1 1 40 PRO HG3 H 2.665 6.341 1.889 1.00 . A A . 40 PRO HG3 1 1 22 14026 1 1 40 PRO N N 1.301 6.203 -0.597 1.00 . A A . 40 PRO N 1 1 22 14027 1 1 40 PRO O O 2.451 7.290 -2.934 1.00 . A A . 40 PRO O 1 1 22 14028 1 1 41 SER C C 3.686 10.167 -3.798 1.00 . A A . 41 SER C 1 1 22 14029 1 1 41 SER CA C 2.205 9.995 -3.476 1.00 . A A . 41 SER CA 1 1 22 14030 1 1 41 SER CB C 1.502 11.353 -3.512 1.00 . A A . 41 SER CB 1 1 22 14031 1 1 41 SER H H 1.792 9.921 -1.401 1.00 . A A . 41 SER H 1 1 22 14032 1 1 41 SER HA H 1.762 9.350 -4.220 1.00 . A A . 41 SER HA 1 1 22 14033 1 1 41 SER HB2 H 1.308 11.628 -4.538 1.00 . A A . 41 SER HB2 1 1 22 14034 1 1 41 SER HB3 H 0.568 11.286 -2.974 1.00 . A A . 41 SER HB3 1 1 22 14035 1 1 41 SER HG H 3.023 12.588 -3.506 1.00 . A A . 41 SER HG 1 1 22 14036 1 1 41 SER N N 2.023 9.364 -2.174 1.00 . A A . 41 SER N 1 1 22 14037 1 1 41 SER O O 4.085 10.148 -4.962 1.00 . A A . 41 SER O 1 1 22 14038 1 1 41 SER OG O 2.302 12.359 -2.915 1.00 . A A . 41 SER OG 1 1 22 14039 1 1 42 TYR C C 6.672 9.192 -2.666 1.00 . A A . 42 TYR C 1 1 22 14040 1 1 42 TYR CA C 5.935 10.505 -2.933 1.00 . A A . 42 TYR CA 1 1 22 14041 1 1 42 TYR CB C 6.457 11.602 -2.000 1.00 . A A . 42 TYR CB 1 1 22 14042 1 1 42 TYR CD1 C 7.688 10.745 0.030 1.00 . A A . 42 TYR CD1 1 1 22 14043 1 1 42 TYR CD2 C 5.369 11.253 0.253 1.00 . A A . 42 TYR CD2 1 1 22 14044 1 1 42 TYR CE1 C 7.737 10.367 1.358 1.00 . A A . 42 TYR CE1 1 1 22 14045 1 1 42 TYR CE2 C 5.411 10.879 1.582 1.00 . A A . 42 TYR CE2 1 1 22 14046 1 1 42 TYR CG C 6.505 11.193 -0.545 1.00 . A A . 42 TYR CG 1 1 22 14047 1 1 42 TYR CZ C 6.597 10.436 2.130 1.00 . A A . 42 TYR CZ 1 1 22 14048 1 1 42 TYR H H 4.123 10.338 -1.853 1.00 . A A . 42 TYR H 1 1 22 14049 1 1 42 TYR HA H 6.110 10.801 -3.956 1.00 . A A . 42 TYR HA 1 1 22 14050 1 1 42 TYR HB2 H 7.458 11.873 -2.301 1.00 . A A . 42 TYR HB2 1 1 22 14051 1 1 42 TYR HB3 H 5.816 12.467 -2.082 1.00 . A A . 42 TYR HB3 1 1 22 14052 1 1 42 TYR HD1 H 8.579 10.692 -0.577 1.00 . A A . 42 TYR HD1 1 1 22 14053 1 1 42 TYR HD2 H 4.442 11.600 -0.179 1.00 . A A . 42 TYR HD2 1 1 22 14054 1 1 42 TYR HE1 H 8.666 10.021 1.785 1.00 . A A . 42 TYR HE1 1 1 22 14055 1 1 42 TYR HE2 H 4.517 10.932 2.186 1.00 . A A . 42 TYR HE2 1 1 22 14056 1 1 42 TYR HH H 5.839 9.588 3.680 1.00 . A A . 42 TYR HH 1 1 22 14057 1 1 42 TYR N N 4.498 10.333 -2.758 1.00 . A A . 42 TYR N 1 1 22 14058 1 1 42 TYR O O 6.316 8.450 -1.751 1.00 . A A . 42 TYR O 1 1 22 14059 1 1 42 TYR OH O 6.642 10.062 3.453 1.00 . A A . 42 TYR OH 1 1 22 14060 1 1 43 PRO C C 9.367 7.680 -2.055 1.00 . A A . 43 PRO C 1 1 22 14061 1 1 43 PRO CA C 8.488 7.654 -3.302 1.00 . A A . 43 PRO CA 1 1 22 14062 1 1 43 PRO CB C 9.350 7.615 -4.564 1.00 . A A . 43 PRO CB 1 1 22 14063 1 1 43 PRO CD C 8.207 9.711 -4.580 1.00 . A A . 43 PRO CD 1 1 22 14064 1 1 43 PRO CG C 9.501 9.043 -4.955 1.00 . A A . 43 PRO CG 1 1 22 14065 1 1 43 PRO HA H 7.849 6.784 -3.272 1.00 . A A . 43 PRO HA 1 1 22 14066 1 1 43 PRO HB2 H 10.305 7.161 -4.338 1.00 . A A . 43 PRO HB2 1 1 22 14067 1 1 43 PRO HB3 H 8.846 7.047 -5.331 1.00 . A A . 43 PRO HB3 1 1 22 14068 1 1 43 PRO HD2 H 8.385 10.727 -4.260 1.00 . A A . 43 PRO HD2 1 1 22 14069 1 1 43 PRO HD3 H 7.517 9.690 -5.411 1.00 . A A . 43 PRO HD3 1 1 22 14070 1 1 43 PRO HG2 H 10.323 9.488 -4.413 1.00 . A A . 43 PRO HG2 1 1 22 14071 1 1 43 PRO HG3 H 9.667 9.118 -6.019 1.00 . A A . 43 PRO HG3 1 1 22 14072 1 1 43 PRO N N 7.710 8.886 -3.463 1.00 . A A . 43 PRO N 1 1 22 14073 1 1 43 PRO O O 9.697 8.747 -1.538 1.00 . A A . 43 PRO O 1 1 22 14074 1 1 44 GLY C C 11.908 7.113 -0.569 1.00 . A A . 44 GLY C 1 1 22 14075 1 1 44 GLY CA C 10.578 6.406 -0.395 1.00 . A A . 44 GLY CA 1 1 22 14076 1 1 44 GLY H H 9.448 5.680 -2.031 1.00 . A A . 44 GLY H 1 1 22 14077 1 1 44 GLY HA2 H 10.763 5.365 -0.178 1.00 . A A . 44 GLY HA2 1 1 22 14078 1 1 44 GLY HA3 H 10.054 6.850 0.438 1.00 . A A . 44 GLY HA3 1 1 22 14079 1 1 44 GLY N N 9.742 6.498 -1.577 1.00 . A A . 44 GLY N 1 1 22 14080 1 1 44 GLY O O 12.214 8.062 0.153 1.00 . A A . 44 GLY O 1 1 22 14081 1 1 45 ASN C C 13.864 8.709 -2.198 1.00 . A A . 45 ASN C 1 1 22 14082 1 1 45 ASN CA C 14.006 7.245 -1.797 1.00 . A A . 45 ASN CA 1 1 22 14083 1 1 45 ASN CB C 14.727 6.469 -2.900 1.00 . A A . 45 ASN CB 1 1 22 14084 1 1 45 ASN CG C 13.846 6.233 -4.112 1.00 . A A . 45 ASN CG 1 1 22 14085 1 1 45 ASN H H 12.401 5.891 -2.073 1.00 . A A . 45 ASN H 1 1 22 14086 1 1 45 ASN HA H 14.588 7.187 -0.889 1.00 . A A . 45 ASN HA 1 1 22 14087 1 1 45 ASN HB2 H 15.597 7.026 -3.214 1.00 . A A . 45 ASN HB2 1 1 22 14088 1 1 45 ASN HB3 H 15.039 5.510 -2.512 1.00 . A A . 45 ASN HB3 1 1 22 14089 1 1 45 ASN HD21 H 15.074 4.809 -4.758 1.00 . A A . 45 ASN HD21 1 1 22 14090 1 1 45 ASN HD22 H 13.695 5.118 -5.751 1.00 . A A . 45 ASN HD22 1 1 22 14091 1 1 45 ASN N N 12.701 6.651 -1.530 1.00 . A A . 45 ASN N 1 1 22 14092 1 1 45 ASN ND2 N 14.245 5.292 -4.959 1.00 . A A . 45 ASN ND2 1 1 22 14093 1 1 45 ASN O O 13.755 9.031 -3.382 1.00 . A A . 45 ASN O 1 1 22 14094 1 1 45 ASN OD1 O 12.819 6.889 -4.284 1.00 . A A . 45 ASN OD1 1 1 22 14095 1 1 46 GLY C C 13.225 11.787 -0.279 1.00 . A A . 46 GLY C 1 1 22 14096 1 1 46 GLY CA C 13.739 11.013 -1.476 1.00 . A A . 46 GLY CA 1 1 22 14097 1 1 46 GLY H H 13.958 9.278 -0.282 1.00 . A A . 46 GLY H 1 1 22 14098 1 1 46 GLY HA2 H 13.056 11.150 -2.301 1.00 . A A . 46 GLY HA2 1 1 22 14099 1 1 46 GLY HA3 H 14.707 11.404 -1.755 1.00 . A A . 46 GLY HA3 1 1 22 14100 1 1 46 GLY N N 13.868 9.593 -1.206 1.00 . A A . 46 GLY N 1 1 22 14101 1 1 46 GLY O O 13.569 12.981 -0.152 1.00 . A A . 46 GLY O 1 1 22 14102 1 1 46 GLY OXT O 12.477 11.200 0.531 1.00 . A A . 46 GLY OXT 1 1 23 14103 1 1 1 ALA C C -15.923 -3.957 8.619 1.00 . A A . 1 ALA C 1 1 23 14104 1 1 1 ALA CA C -16.452 -2.600 9.071 1.00 . A A . 1 ALA CA 1 1 23 14105 1 1 1 ALA CB C -15.589 -1.482 8.505 1.00 . A A . 1 ALA CB 1 1 23 14106 1 1 1 ALA H1 H -16.774 -3.447 10.918 1.00 . A A . 1 ALA H1 1 1 23 14107 1 1 1 ALA H2 H -15.550 -2.247 10.886 1.00 . A A . 1 ALA H2 1 1 23 14108 1 1 1 ALA H3 H -17.203 -1.789 10.806 1.00 . A A . 1 ALA H3 1 1 23 14109 1 1 1 ALA HA H -17.456 -2.474 8.692 1.00 . A A . 1 ALA HA 1 1 23 14110 1 1 1 ALA HB1 H -14.581 -1.581 8.879 1.00 . A A . 1 ALA HB1 1 1 23 14111 1 1 1 ALA HB2 H -15.993 -0.527 8.807 1.00 . A A . 1 ALA HB2 1 1 23 14112 1 1 1 ALA HB3 H -15.581 -1.545 7.427 1.00 . A A . 1 ALA HB3 1 1 23 14113 1 1 1 ALA N N -16.499 -2.513 10.554 1.00 . A A . 1 ALA N 1 1 23 14114 1 1 1 ALA O O -14.754 -4.280 8.830 1.00 . A A . 1 ALA O 1 1 23 14115 1 1 2 MET C C -16.266 -6.074 5.996 1.00 . A A . 2 MET C 1 1 23 14116 1 1 2 MET CA C -16.411 -6.070 7.514 1.00 . A A . 2 MET CA 1 1 23 14117 1 1 2 MET CB C -17.448 -7.109 7.942 1.00 . A A . 2 MET CB 1 1 23 14118 1 1 2 MET CE C -18.139 -8.577 10.726 1.00 . A A . 2 MET CE 1 1 23 14119 1 1 2 MET CG C -16.849 -8.465 8.276 1.00 . A A . 2 MET CG 1 1 23 14120 1 1 2 MET H H -17.709 -4.434 7.858 1.00 . A A . 2 MET H 1 1 23 14121 1 1 2 MET HA H -15.459 -6.322 7.956 1.00 . A A . 2 MET HA 1 1 23 14122 1 1 2 MET HB2 H -17.968 -6.744 8.816 1.00 . A A . 2 MET HB2 1 1 23 14123 1 1 2 MET HB3 H -18.160 -7.242 7.141 1.00 . A A . 2 MET HB3 1 1 23 14124 1 1 2 MET HE1 H -18.803 -9.198 10.143 1.00 . A A . 2 MET HE1 1 1 23 14125 1 1 2 MET HE2 H -18.118 -8.932 11.746 1.00 . A A . 2 MET HE2 1 1 23 14126 1 1 2 MET HE3 H -18.492 -7.557 10.707 1.00 . A A . 2 MET HE3 1 1 23 14127 1 1 2 MET HG2 H -17.547 -9.235 7.983 1.00 . A A . 2 MET HG2 1 1 23 14128 1 1 2 MET HG3 H -15.930 -8.585 7.720 1.00 . A A . 2 MET HG3 1 1 23 14129 1 1 2 MET N N -16.791 -4.747 7.997 1.00 . A A . 2 MET N 1 1 23 14130 1 1 2 MET O O -16.525 -7.084 5.341 1.00 . A A . 2 MET O 1 1 23 14131 1 1 2 MET SD S -16.489 -8.652 10.033 1.00 . A A . 2 MET SD 1 1 23 14132 1 1 3 ASP C C -14.193 -4.875 3.630 1.00 . A A . 3 ASP C 1 1 23 14133 1 1 3 ASP CA C -15.671 -4.813 4.001 1.00 . A A . 3 ASP CA 1 1 23 14134 1 1 3 ASP CB C -16.279 -3.500 3.504 1.00 . A A . 3 ASP CB 1 1 23 14135 1 1 3 ASP CG C -16.852 -3.622 2.105 1.00 . A A . 3 ASP CG 1 1 23 14136 1 1 3 ASP H H -15.660 -4.169 6.018 1.00 . A A . 3 ASP H 1 1 23 14137 1 1 3 ASP HA H -16.183 -5.638 3.530 1.00 . A A . 3 ASP HA 1 1 23 14138 1 1 3 ASP HB2 H -17.073 -3.202 4.173 1.00 . A A . 3 ASP HB2 1 1 23 14139 1 1 3 ASP HB3 H -15.515 -2.737 3.496 1.00 . A A . 3 ASP HB3 1 1 23 14140 1 1 3 ASP N N -15.851 -4.939 5.443 1.00 . A A . 3 ASP N 1 1 23 14141 1 1 3 ASP O O -13.355 -4.239 4.269 1.00 . A A . 3 ASP O 1 1 23 14142 1 1 3 ASP OD1 O -18.033 -3.266 1.914 1.00 . A A . 3 ASP OD1 1 1 23 14143 1 1 3 ASP OD2 O -16.118 -4.072 1.201 1.00 . A A . 3 ASP OD2 1 1 23 14144 1 1 4 CYS C C -11.981 -4.477 1.559 1.00 . A A . 4 CYS C 1 1 23 14145 1 1 4 CYS CA C -12.504 -5.789 2.135 1.00 . A A . 4 CYS CA 1 1 23 14146 1 1 4 CYS CB C -12.407 -6.897 1.084 1.00 . A A . 4 CYS CB 1 1 23 14147 1 1 4 CYS H H -14.593 -6.126 2.123 1.00 . A A . 4 CYS H 1 1 23 14148 1 1 4 CYS HA H -11.899 -6.060 2.987 1.00 . A A . 4 CYS HA 1 1 23 14149 1 1 4 CYS HB2 H -13.278 -6.855 0.447 1.00 . A A . 4 CYS HB2 1 1 23 14150 1 1 4 CYS HB3 H -11.522 -6.739 0.486 1.00 . A A . 4 CYS HB3 1 1 23 14151 1 1 4 CYS N N -13.881 -5.644 2.592 1.00 . A A . 4 CYS N 1 1 23 14152 1 1 4 CYS O O -12.547 -3.934 0.611 1.00 . A A . 4 CYS O 1 1 23 14153 1 1 4 CYS SG S -12.313 -8.577 1.782 1.00 . A A . 4 CYS SG 1 1 23 14154 1 1 5 THR C C -9.922 -2.803 0.207 1.00 . A A . 5 THR C 1 1 23 14155 1 1 5 THR CA C -10.293 -2.724 1.685 1.00 . A A . 5 THR CA 1 1 23 14156 1 1 5 THR CB C -9.051 -2.404 2.519 1.00 . A A . 5 THR CB 1 1 23 14157 1 1 5 THR CG2 C -8.473 -1.035 2.232 1.00 . A A . 5 THR CG2 1 1 23 14158 1 1 5 THR H H -10.490 -4.454 2.891 1.00 . A A . 5 THR H 1 1 23 14159 1 1 5 THR HA H -11.018 -1.937 1.821 1.00 . A A . 5 THR HA 1 1 23 14160 1 1 5 THR HB H -8.286 -3.137 2.303 1.00 . A A . 5 THR HB 1 1 23 14161 1 1 5 THR HG1 H -9.933 -1.741 4.136 1.00 . A A . 5 THR HG1 1 1 23 14162 1 1 5 THR HG21 H -9.240 -0.286 2.365 1.00 . A A . 5 THR HG21 1 1 23 14163 1 1 5 THR HG22 H -7.656 -0.839 2.910 1.00 . A A . 5 THR HG22 1 1 23 14164 1 1 5 THR HG23 H -8.112 -1.003 1.214 1.00 . A A . 5 THR HG23 1 1 23 14165 1 1 5 THR N N -10.895 -3.973 2.139 1.00 . A A . 5 THR N 1 1 23 14166 1 1 5 THR O O -9.849 -3.889 -0.368 1.00 . A A . 5 THR O 1 1 23 14167 1 1 5 THR OG1 O -9.346 -2.464 3.903 1.00 . A A . 5 THR OG1 1 1 23 14168 1 1 6 THR C C -8.264 -0.513 -2.056 1.00 . A A . 6 THR C 1 1 23 14169 1 1 6 THR CA C -9.324 -1.583 -1.813 1.00 . A A . 6 THR CA 1 1 23 14170 1 1 6 THR CB C -10.560 -1.297 -2.668 1.00 . A A . 6 THR CB 1 1 23 14171 1 1 6 THR CG2 C -11.385 -2.531 -2.959 1.00 . A A . 6 THR CG2 1 1 23 14172 1 1 6 THR H H -9.762 -0.812 0.109 1.00 . A A . 6 THR H 1 1 23 14173 1 1 6 THR HA H -8.919 -2.544 -2.093 1.00 . A A . 6 THR HA 1 1 23 14174 1 1 6 THR HB H -10.242 -0.881 -3.614 1.00 . A A . 6 THR HB 1 1 23 14175 1 1 6 THR HG1 H -11.748 -0.733 -1.217 1.00 . A A . 6 THR HG1 1 1 23 14176 1 1 6 THR HG21 H -10.884 -3.401 -2.562 1.00 . A A . 6 THR HG21 1 1 23 14177 1 1 6 THR HG22 H -12.356 -2.432 -2.496 1.00 . A A . 6 THR HG22 1 1 23 14178 1 1 6 THR HG23 H -11.506 -2.641 -4.027 1.00 . A A . 6 THR HG23 1 1 23 14179 1 1 6 THR N N -9.688 -1.645 -0.402 1.00 . A A . 6 THR N 1 1 23 14180 1 1 6 THR O O -8.360 0.598 -1.536 1.00 . A A . 6 THR O 1 1 23 14181 1 1 6 THR OG1 O -11.404 -0.355 -2.030 1.00 . A A . 6 THR OG1 1 1 23 14182 1 1 7 GLY C C -4.924 -0.599 -3.625 1.00 . A A . 7 GLY C 1 1 23 14183 1 1 7 GLY CA C -6.191 0.086 -3.148 1.00 . A A . 7 GLY CA 1 1 23 14184 1 1 7 GLY H H -7.231 -1.757 -3.236 1.00 . A A . 7 GLY H 1 1 23 14185 1 1 7 GLY HA2 H -5.967 0.652 -2.256 1.00 . A A . 7 GLY HA2 1 1 23 14186 1 1 7 GLY HA3 H -6.532 0.764 -3.916 1.00 . A A . 7 GLY HA3 1 1 23 14187 1 1 7 GLY N N -7.254 -0.857 -2.850 1.00 . A A . 7 GLY N 1 1 23 14188 1 1 7 GLY O O -4.840 -1.827 -3.618 1.00 . A A . 7 GLY O 1 1 23 14189 1 1 8 PRO C C -1.876 -1.127 -3.443 1.00 . A A . 8 PRO C 1 1 23 14190 1 1 8 PRO CA C -2.639 -0.376 -4.532 1.00 . A A . 8 PRO CA 1 1 23 14191 1 1 8 PRO CB C -1.853 0.859 -4.984 1.00 . A A . 8 PRO CB 1 1 23 14192 1 1 8 PRO CD C -3.923 1.649 -4.092 1.00 . A A . 8 PRO CD 1 1 23 14193 1 1 8 PRO CG C -2.471 1.999 -4.250 1.00 . A A . 8 PRO CG 1 1 23 14194 1 1 8 PRO HA H -2.792 -1.034 -5.374 1.00 . A A . 8 PRO HA 1 1 23 14195 1 1 8 PRO HB2 H -0.811 0.741 -4.724 1.00 . A A . 8 PRO HB2 1 1 23 14196 1 1 8 PRO HB3 H -1.951 0.981 -6.053 1.00 . A A . 8 PRO HB3 1 1 23 14197 1 1 8 PRO HD2 H -4.313 2.059 -3.172 1.00 . A A . 8 PRO HD2 1 1 23 14198 1 1 8 PRO HD3 H -4.492 2.005 -4.938 1.00 . A A . 8 PRO HD3 1 1 23 14199 1 1 8 PRO HG2 H -2.004 2.108 -3.284 1.00 . A A . 8 PRO HG2 1 1 23 14200 1 1 8 PRO HG3 H -2.364 2.907 -4.825 1.00 . A A . 8 PRO HG3 1 1 23 14201 1 1 8 PRO N N -3.910 0.176 -4.049 1.00 . A A . 8 PRO N 1 1 23 14202 1 1 8 PRO O O -0.938 -1.870 -3.733 1.00 . A A . 8 PRO O 1 1 23 14203 1 1 9 CYS C C -2.596 -2.528 -0.341 1.00 . A A . 9 CYS C 1 1 23 14204 1 1 9 CYS CA C -1.628 -1.600 -1.068 1.00 . A A . 9 CYS CA 1 1 23 14205 1 1 9 CYS CB C -1.062 -0.572 -0.089 1.00 . A A . 9 CYS CB 1 1 23 14206 1 1 9 CYS H H -3.034 -0.332 -2.015 1.00 . A A . 9 CYS H 1 1 23 14207 1 1 9 CYS HA H -0.815 -2.191 -1.463 1.00 . A A . 9 CYS HA 1 1 23 14208 1 1 9 CYS HB2 H -0.435 0.122 -0.627 1.00 . A A . 9 CYS HB2 1 1 23 14209 1 1 9 CYS HB3 H -1.877 -0.033 0.368 1.00 . A A . 9 CYS HB3 1 1 23 14210 1 1 9 CYS N N -2.281 -0.934 -2.190 1.00 . A A . 9 CYS N 1 1 23 14211 1 1 9 CYS O O -2.682 -2.516 0.887 1.00 . A A . 9 CYS O 1 1 23 14212 1 1 9 CYS SG S -0.062 -1.304 1.247 1.00 . A A . 9 CYS SG 1 1 23 14213 1 1 10 CYS C C -3.879 -5.710 -0.864 1.00 . A A . 10 CYS C 1 1 23 14214 1 1 10 CYS CA C -4.278 -4.274 -0.537 1.00 . A A . 10 CYS CA 1 1 23 14215 1 1 10 CYS CB C -5.685 -3.983 -1.070 1.00 . A A . 10 CYS CB 1 1 23 14216 1 1 10 CYS H H -3.204 -3.302 -2.079 1.00 . A A . 10 CYS H 1 1 23 14217 1 1 10 CYS HA H -4.273 -4.150 0.535 1.00 . A A . 10 CYS HA 1 1 23 14218 1 1 10 CYS HB2 H -5.603 -3.379 -1.961 1.00 . A A . 10 CYS HB2 1 1 23 14219 1 1 10 CYS HB3 H -6.166 -4.917 -1.320 1.00 . A A . 10 CYS HB3 1 1 23 14220 1 1 10 CYS N N -3.320 -3.335 -1.106 1.00 . A A . 10 CYS N 1 1 23 14221 1 1 10 CYS O O -3.397 -5.995 -1.961 1.00 . A A . 10 CYS O 1 1 23 14222 1 1 10 CYS SG S -6.777 -3.095 0.092 1.00 . A A . 10 CYS SG 1 1 23 14223 1 1 11 ARG C C -4.918 -8.793 -0.673 1.00 . A A . 11 ARG C 1 1 23 14224 1 1 11 ARG CA C -3.737 -8.016 -0.097 1.00 . A A . 11 ARG CA 1 1 23 14225 1 1 11 ARG CB C -3.298 -8.638 1.230 1.00 . A A . 11 ARG CB 1 1 23 14226 1 1 11 ARG CD C -1.292 -9.778 2.224 1.00 . A A . 11 ARG CD 1 1 23 14227 1 1 11 ARG CG C -2.281 -9.756 1.070 1.00 . A A . 11 ARG CG 1 1 23 14228 1 1 11 ARG CZ C 0.504 -11.263 3.026 1.00 . A A . 11 ARG CZ 1 1 23 14229 1 1 11 ARG H H -4.466 -6.323 0.946 1.00 . A A . 11 ARG H 1 1 23 14230 1 1 11 ARG HA H -2.916 -8.064 -0.796 1.00 . A A . 11 ARG HA 1 1 23 14231 1 1 11 ARG HB2 H -2.860 -7.868 1.847 1.00 . A A . 11 ARG HB2 1 1 23 14232 1 1 11 ARG HB3 H -4.166 -9.038 1.731 1.00 . A A . 11 ARG HB3 1 1 23 14233 1 1 11 ARG HD2 H -0.545 -9.017 2.055 1.00 . A A . 11 ARG HD2 1 1 23 14234 1 1 11 ARG HD3 H -1.822 -9.564 3.140 1.00 . A A . 11 ARG HD3 1 1 23 14235 1 1 11 ARG HE H -1.047 -11.842 1.911 1.00 . A A . 11 ARG HE 1 1 23 14236 1 1 11 ARG HG2 H -2.802 -10.701 1.039 1.00 . A A . 11 ARG HG2 1 1 23 14237 1 1 11 ARG HG3 H -1.741 -9.610 0.146 1.00 . A A . 11 ARG HG3 1 1 23 14238 1 1 11 ARG HH11 H 0.701 -9.330 3.589 1.00 . A A . 11 ARG HH11 1 1 23 14239 1 1 11 ARG HH12 H 1.950 -10.395 4.140 1.00 . A A . 11 ARG HH12 1 1 23 14240 1 1 11 ARG HH21 H 0.595 -13.244 2.636 1.00 . A A . 11 ARG HH21 1 1 23 14241 1 1 11 ARG HH22 H 1.891 -12.617 3.599 1.00 . A A . 11 ARG HH22 1 1 23 14242 1 1 11 ARG N N -4.080 -6.610 0.092 1.00 . A A . 11 ARG N 1 1 23 14243 1 1 11 ARG NE N -0.628 -11.073 2.351 1.00 . A A . 11 ARG NE 1 1 23 14244 1 1 11 ARG NH1 N 1.101 -10.245 3.635 1.00 . A A . 11 ARG NH1 1 1 23 14245 1 1 11 ARG NH2 N 1.041 -12.474 3.092 1.00 . A A . 11 ARG NH2 1 1 23 14246 1 1 11 ARG O O -5.228 -9.896 -0.221 1.00 . A A . 11 ARG O 1 1 23 14247 1 1 12 GLN C C -7.947 -8.850 -1.403 1.00 . A A . 12 GLN C 1 1 23 14248 1 1 12 GLN CA C -6.722 -8.844 -2.318 1.00 . A A . 12 GLN CA 1 1 23 14249 1 1 12 GLN CB C -6.379 -10.276 -2.732 1.00 . A A . 12 GLN CB 1 1 23 14250 1 1 12 GLN CD C -5.058 -9.994 -4.867 1.00 . A A . 12 GLN CD 1 1 23 14251 1 1 12 GLN CG C -5.024 -10.407 -3.408 1.00 . A A . 12 GLN CG 1 1 23 14252 1 1 12 GLN H H -5.278 -7.333 -1.990 1.00 . A A . 12 GLN H 1 1 23 14253 1 1 12 GLN HA H -6.956 -8.273 -3.204 1.00 . A A . 12 GLN HA 1 1 23 14254 1 1 12 GLN HB2 H -6.381 -10.902 -1.852 1.00 . A A . 12 GLN HB2 1 1 23 14255 1 1 12 GLN HB3 H -7.135 -10.631 -3.417 1.00 . A A . 12 GLN HB3 1 1 23 14256 1 1 12 GLN HE21 H -6.388 -11.417 -5.264 1.00 . A A . 12 GLN HE21 1 1 23 14257 1 1 12 GLN HE22 H -5.908 -10.442 -6.607 1.00 . A A . 12 GLN HE22 1 1 23 14258 1 1 12 GLN HG2 H -4.315 -9.780 -2.889 1.00 . A A . 12 GLN HG2 1 1 23 14259 1 1 12 GLN HG3 H -4.704 -11.437 -3.348 1.00 . A A . 12 GLN HG3 1 1 23 14260 1 1 12 GLN N N -5.573 -8.211 -1.674 1.00 . A A . 12 GLN N 1 1 23 14261 1 1 12 GLN NE2 N -5.867 -10.688 -5.659 1.00 . A A . 12 GLN NE2 1 1 23 14262 1 1 12 GLN O O -8.982 -9.417 -1.753 1.00 . A A . 12 GLN O 1 1 23 14263 1 1 12 GLN OE1 O -4.366 -9.062 -5.276 1.00 . A A . 12 GLN OE1 1 1 23 14264 1 1 13 CYS C C -8.486 -7.612 2.069 1.00 . A A . 13 CYS C 1 1 23 14265 1 1 13 CYS CA C -8.942 -8.155 0.716 1.00 . A A . 13 CYS CA 1 1 23 14266 1 1 13 CYS CB C -9.574 -9.540 0.901 1.00 . A A . 13 CYS CB 1 1 23 14267 1 1 13 CYS H H -6.989 -7.777 -0.009 1.00 . A A . 13 CYS H 1 1 23 14268 1 1 13 CYS HA H -9.685 -7.486 0.310 1.00 . A A . 13 CYS HA 1 1 23 14269 1 1 13 CYS HB2 H -9.015 -10.263 0.327 1.00 . A A . 13 CYS HB2 1 1 23 14270 1 1 13 CYS HB3 H -9.534 -9.811 1.946 1.00 . A A . 13 CYS HB3 1 1 23 14271 1 1 13 CYS N N -7.833 -8.216 -0.235 1.00 . A A . 13 CYS N 1 1 23 14272 1 1 13 CYS O O -9.272 -7.007 2.798 1.00 . A A . 13 CYS O 1 1 23 14273 1 1 13 CYS SG S -11.313 -9.637 0.368 1.00 . A A . 13 CYS SG 1 1 23 14274 1 1 14 LYS C C -5.622 -6.294 3.467 1.00 . A A . 14 LYS C 1 1 23 14275 1 1 14 LYS CA C -6.681 -7.369 3.680 1.00 . A A . 14 LYS CA 1 1 23 14276 1 1 14 LYS CB C -6.084 -8.539 4.464 1.00 . A A . 14 LYS CB 1 1 23 14277 1 1 14 LYS CD C -5.052 -8.995 6.709 1.00 . A A . 14 LYS CD 1 1 23 14278 1 1 14 LYS CE C -5.193 -8.831 8.214 1.00 . A A . 14 LYS CE 1 1 23 14279 1 1 14 LYS CG C -6.242 -8.405 5.970 1.00 . A A . 14 LYS CG 1 1 23 14280 1 1 14 LYS H H -6.632 -8.327 1.795 1.00 . A A . 14 LYS H 1 1 23 14281 1 1 14 LYS HA H -7.495 -6.946 4.249 1.00 . A A . 14 LYS HA 1 1 23 14282 1 1 14 LYS HB2 H -6.570 -9.451 4.153 1.00 . A A . 14 LYS HB2 1 1 23 14283 1 1 14 LYS HB3 H -5.030 -8.608 4.239 1.00 . A A . 14 LYS HB3 1 1 23 14284 1 1 14 LYS HD2 H -4.982 -10.048 6.478 1.00 . A A . 14 LYS HD2 1 1 23 14285 1 1 14 LYS HD3 H -4.153 -8.493 6.384 1.00 . A A . 14 LYS HD3 1 1 23 14286 1 1 14 LYS HE2 H -5.667 -7.882 8.417 1.00 . A A . 14 LYS HE2 1 1 23 14287 1 1 14 LYS HE3 H -5.813 -9.630 8.594 1.00 . A A . 14 LYS HE3 1 1 23 14288 1 1 14 LYS HG2 H -6.326 -7.359 6.222 1.00 . A A . 14 LYS HG2 1 1 23 14289 1 1 14 LYS HG3 H -7.138 -8.924 6.276 1.00 . A A . 14 LYS HG3 1 1 23 14290 1 1 14 LYS HZ1 H -3.258 -9.579 8.457 1.00 . A A . 14 LYS HZ1 1 1 23 14291 1 1 14 LYS HZ2 H -3.413 -7.939 8.847 1.00 . A A . 14 LYS HZ2 1 1 23 14292 1 1 14 LYS HZ3 H -4.002 -9.121 9.905 1.00 . A A . 14 LYS HZ3 1 1 23 14293 1 1 14 LYS N N -7.218 -7.836 2.408 1.00 . A A . 14 LYS N 1 1 23 14294 1 1 14 LYS NZ N -3.874 -8.870 8.904 1.00 . A A . 14 LYS NZ 1 1 23 14295 1 1 14 LYS O O -4.754 -6.424 2.605 1.00 . A A . 14 LYS O 1 1 23 14296 1 1 15 LEU C C -3.316 -4.652 4.295 1.00 . A A . 15 LEU C 1 1 23 14297 1 1 15 LEU CA C -4.745 -4.135 4.173 1.00 . A A . 15 LEU CA 1 1 23 14298 1 1 15 LEU CB C -5.025 -3.104 5.268 1.00 . A A . 15 LEU CB 1 1 23 14299 1 1 15 LEU CD1 C -5.928 -0.772 5.461 1.00 . A A . 15 LEU CD1 1 1 23 14300 1 1 15 LEU CD2 C -3.460 -1.146 5.264 1.00 . A A . 15 LEU CD2 1 1 23 14301 1 1 15 LEU CG C -4.838 -1.644 4.853 1.00 . A A . 15 LEU CG 1 1 23 14302 1 1 15 LEU H H -6.412 -5.192 4.935 1.00 . A A . 15 LEU H 1 1 23 14303 1 1 15 LEU HA H -4.867 -3.667 3.208 1.00 . A A . 15 LEU HA 1 1 23 14304 1 1 15 LEU HB2 H -6.044 -3.235 5.599 1.00 . A A . 15 LEU HB2 1 1 23 14305 1 1 15 LEU HB3 H -4.366 -3.305 6.099 1.00 . A A . 15 LEU HB3 1 1 23 14306 1 1 15 LEU HD11 H -6.558 -1.373 6.100 1.00 . A A . 15 LEU HD11 1 1 23 14307 1 1 15 LEU HD12 H -5.477 0.019 6.042 1.00 . A A . 15 LEU HD12 1 1 23 14308 1 1 15 LEU HD13 H -6.526 -0.341 4.671 1.00 . A A . 15 LEU HD13 1 1 23 14309 1 1 15 LEU HD21 H -2.710 -1.853 4.939 1.00 . A A . 15 LEU HD21 1 1 23 14310 1 1 15 LEU HD22 H -3.272 -0.186 4.806 1.00 . A A . 15 LEU HD22 1 1 23 14311 1 1 15 LEU HD23 H -3.419 -1.047 6.339 1.00 . A A . 15 LEU HD23 1 1 23 14312 1 1 15 LEU HG H -4.914 -1.570 3.778 1.00 . A A . 15 LEU HG 1 1 23 14313 1 1 15 LEU N N -5.699 -5.234 4.265 1.00 . A A . 15 LEU N 1 1 23 14314 1 1 15 LEU O O -2.911 -5.135 5.352 1.00 . A A . 15 LEU O 1 1 23 14315 1 1 16 LYS C C -0.414 -4.506 4.420 1.00 . A A . 16 LYS C 1 1 23 14316 1 1 16 LYS CA C -1.175 -5.018 3.195 1.00 . A A . 16 LYS CA 1 1 23 14317 1 1 16 LYS CB C -0.473 -4.563 1.913 1.00 . A A . 16 LYS CB 1 1 23 14318 1 1 16 LYS CD C 0.230 -5.473 -0.321 1.00 . A A . 16 LYS CD 1 1 23 14319 1 1 16 LYS CE C 0.165 -6.795 -1.069 1.00 . A A . 16 LYS CE 1 1 23 14320 1 1 16 LYS CG C 0.248 -5.685 1.184 1.00 . A A . 16 LYS CG 1 1 23 14321 1 1 16 LYS H H -2.939 -4.163 2.393 1.00 . A A . 16 LYS H 1 1 23 14322 1 1 16 LYS HA H -1.194 -6.099 3.220 1.00 . A A . 16 LYS HA 1 1 23 14323 1 1 16 LYS HB2 H -1.209 -4.144 1.243 1.00 . A A . 16 LYS HB2 1 1 23 14324 1 1 16 LYS HB3 H 0.251 -3.801 2.161 1.00 . A A . 16 LYS HB3 1 1 23 14325 1 1 16 LYS HD2 H -0.635 -4.881 -0.582 1.00 . A A . 16 LYS HD2 1 1 23 14326 1 1 16 LYS HD3 H 1.128 -4.948 -0.612 1.00 . A A . 16 LYS HD3 1 1 23 14327 1 1 16 LYS HE2 H 0.690 -7.544 -0.496 1.00 . A A . 16 LYS HE2 1 1 23 14328 1 1 16 LYS HE3 H -0.871 -7.083 -1.175 1.00 . A A . 16 LYS HE3 1 1 23 14329 1 1 16 LYS HG2 H 1.274 -5.719 1.519 1.00 . A A . 16 LYS HG2 1 1 23 14330 1 1 16 LYS HG3 H -0.239 -6.622 1.413 1.00 . A A . 16 LYS HG3 1 1 23 14331 1 1 16 LYS HZ1 H 0.741 -5.719 -2.765 1.00 . A A . 16 LYS HZ1 1 1 23 14332 1 1 16 LYS HZ2 H 1.778 -6.999 -2.381 1.00 . A A . 16 LYS HZ2 1 1 23 14333 1 1 16 LYS HZ3 H 0.274 -7.312 -3.090 1.00 . A A . 16 LYS HZ3 1 1 23 14334 1 1 16 LYS N N -2.558 -4.553 3.207 1.00 . A A . 16 LYS N 1 1 23 14335 1 1 16 LYS NZ N 0.783 -6.699 -2.421 1.00 . A A . 16 LYS NZ 1 1 23 14336 1 1 16 LYS O O -0.671 -3.403 4.902 1.00 . A A . 16 LYS O 1 1 23 14337 1 1 17 PRO C C 2.189 -3.696 5.878 1.00 . A A . 17 PRO C 1 1 23 14338 1 1 17 PRO CA C 1.324 -4.928 6.122 1.00 . A A . 17 PRO CA 1 1 23 14339 1 1 17 PRO CB C 2.210 -6.153 6.374 1.00 . A A . 17 PRO CB 1 1 23 14340 1 1 17 PRO CD C 0.899 -6.638 4.437 1.00 . A A . 17 PRO CD 1 1 23 14341 1 1 17 PRO CG C 2.233 -6.890 5.079 1.00 . A A . 17 PRO CG 1 1 23 14342 1 1 17 PRO HA H 0.693 -4.756 6.981 1.00 . A A . 17 PRO HA 1 1 23 14343 1 1 17 PRO HB2 H 3.200 -5.829 6.660 1.00 . A A . 17 PRO HB2 1 1 23 14344 1 1 17 PRO HB3 H 1.781 -6.754 7.162 1.00 . A A . 17 PRO HB3 1 1 23 14345 1 1 17 PRO HD2 H 0.993 -6.630 3.361 1.00 . A A . 17 PRO HD2 1 1 23 14346 1 1 17 PRO HD3 H 0.182 -7.381 4.751 1.00 . A A . 17 PRO HD3 1 1 23 14347 1 1 17 PRO HG2 H 3.028 -6.510 4.454 1.00 . A A . 17 PRO HG2 1 1 23 14348 1 1 17 PRO HG3 H 2.368 -7.946 5.260 1.00 . A A . 17 PRO HG3 1 1 23 14349 1 1 17 PRO N N 0.531 -5.305 4.944 1.00 . A A . 17 PRO N 1 1 23 14350 1 1 17 PRO O O 2.717 -3.502 4.783 1.00 . A A . 17 PRO O 1 1 23 14351 1 1 18 ALA C C 4.585 -2.005 6.446 1.00 . A A . 18 ALA C 1 1 23 14352 1 1 18 ALA CA C 3.147 -1.664 6.816 1.00 . A A . 18 ALA CA 1 1 23 14353 1 1 18 ALA CB C 3.106 -0.895 8.128 1.00 . A A . 18 ALA CB 1 1 23 14354 1 1 18 ALA H H 1.895 -3.084 7.759 1.00 . A A . 18 ALA H 1 1 23 14355 1 1 18 ALA HA H 2.724 -1.037 6.044 1.00 . A A . 18 ALA HA 1 1 23 14356 1 1 18 ALA HB1 H 3.449 -1.533 8.930 1.00 . A A . 18 ALA HB1 1 1 23 14357 1 1 18 ALA HB2 H 3.748 -0.029 8.058 1.00 . A A . 18 ALA HB2 1 1 23 14358 1 1 18 ALA HB3 H 2.094 -0.577 8.329 1.00 . A A . 18 ALA HB3 1 1 23 14359 1 1 18 ALA N N 2.337 -2.872 6.911 1.00 . A A . 18 ALA N 1 1 23 14360 1 1 18 ALA O O 4.966 -3.175 6.412 1.00 . A A . 18 ALA O 1 1 23 14361 1 1 19 GLY C C 6.908 -2.075 4.566 1.00 . A A . 19 GLY C 1 1 23 14362 1 1 19 GLY CA C 6.767 -1.198 5.796 1.00 . A A . 19 GLY CA 1 1 23 14363 1 1 19 GLY H H 5.023 -0.067 6.205 1.00 . A A . 19 GLY H 1 1 23 14364 1 1 19 GLY HA2 H 7.277 -1.670 6.622 1.00 . A A . 19 GLY HA2 1 1 23 14365 1 1 19 GLY HA3 H 7.231 -0.242 5.599 1.00 . A A . 19 GLY HA3 1 1 23 14366 1 1 19 GLY N N 5.381 -0.979 6.165 1.00 . A A . 19 GLY N 1 1 23 14367 1 1 19 GLY O O 7.977 -2.630 4.311 1.00 . A A . 19 GLY O 1 1 23 14368 1 1 20 THR C C 5.541 -2.148 1.370 1.00 . A A . 20 THR C 1 1 23 14369 1 1 20 THR CA C 5.832 -3.011 2.592 1.00 . A A . 20 THR CA 1 1 23 14370 1 1 20 THR CB C 4.794 -4.131 2.702 1.00 . A A . 20 THR CB 1 1 23 14371 1 1 20 THR CG2 C 4.737 -5.022 1.479 1.00 . A A . 20 THR CG2 1 1 23 14372 1 1 20 THR H H 5.006 -1.732 4.054 1.00 . A A . 20 THR H 1 1 23 14373 1 1 20 THR HA H 6.813 -3.448 2.487 1.00 . A A . 20 THR HA 1 1 23 14374 1 1 20 THR HB H 3.817 -3.689 2.835 1.00 . A A . 20 THR HB 1 1 23 14375 1 1 20 THR HG1 H 4.516 -4.683 4.560 1.00 . A A . 20 THR HG1 1 1 23 14376 1 1 20 THR HG21 H 4.880 -4.424 0.591 1.00 . A A . 20 THR HG21 1 1 23 14377 1 1 20 THR HG22 H 5.516 -5.767 1.541 1.00 . A A . 20 THR HG22 1 1 23 14378 1 1 20 THR HG23 H 3.774 -5.509 1.434 1.00 . A A . 20 THR HG23 1 1 23 14379 1 1 20 THR N N 5.827 -2.200 3.801 1.00 . A A . 20 THR N 1 1 23 14380 1 1 20 THR O O 4.574 -1.386 1.353 1.00 . A A . 20 THR O 1 1 23 14381 1 1 20 THR OG1 O 5.064 -4.956 3.821 1.00 . A A . 20 THR OG1 1 1 23 14382 1 1 21 THR C C 4.823 -1.683 -1.457 1.00 . A A . 21 THR C 1 1 23 14383 1 1 21 THR CA C 6.218 -1.491 -0.872 1.00 . A A . 21 THR CA 1 1 23 14384 1 1 21 THR CB C 7.280 -1.879 -1.903 1.00 . A A . 21 THR CB 1 1 23 14385 1 1 21 THR CG2 C 8.204 -0.736 -2.253 1.00 . A A . 21 THR CG2 1 1 23 14386 1 1 21 THR H H 7.140 -2.888 0.424 1.00 . A A . 21 THR H 1 1 23 14387 1 1 21 THR HA H 6.344 -0.449 -0.620 1.00 . A A . 21 THR HA 1 1 23 14388 1 1 21 THR HB H 6.790 -2.199 -2.812 1.00 . A A . 21 THR HB 1 1 23 14389 1 1 21 THR HG1 H 7.758 -3.776 -1.795 1.00 . A A . 21 THR HG1 1 1 23 14390 1 1 21 THR HG21 H 8.225 -0.030 -1.435 1.00 . A A . 21 THR HG21 1 1 23 14391 1 1 21 THR HG22 H 9.199 -1.117 -2.426 1.00 . A A . 21 THR HG22 1 1 23 14392 1 1 21 THR HG23 H 7.845 -0.244 -3.145 1.00 . A A . 21 THR HG23 1 1 23 14393 1 1 21 THR N N 6.385 -2.267 0.351 1.00 . A A . 21 THR N 1 1 23 14394 1 1 21 THR O O 4.369 -2.811 -1.649 1.00 . A A . 21 THR O 1 1 23 14395 1 1 21 THR OG1 O 8.078 -2.949 -1.428 1.00 . A A . 21 THR OG1 1 1 23 14396 1 1 22 CYS C C 2.807 -0.182 -3.760 1.00 . A A . 22 CYS C 1 1 23 14397 1 1 22 CYS CA C 2.806 -0.620 -2.301 1.00 . A A . 22 CYS CA 1 1 23 14398 1 1 22 CYS CB C 1.850 0.262 -1.493 1.00 . A A . 22 CYS CB 1 1 23 14399 1 1 22 CYS H H 4.567 0.296 -1.563 1.00 . A A . 22 CYS H 1 1 23 14400 1 1 22 CYS HA H 2.465 -1.643 -2.248 1.00 . A A . 22 CYS HA 1 1 23 14401 1 1 22 CYS HB2 H 0.965 0.450 -2.083 1.00 . A A . 22 CYS HB2 1 1 23 14402 1 1 22 CYS HB3 H 1.568 -0.262 -0.591 1.00 . A A . 22 CYS HB3 1 1 23 14403 1 1 22 CYS N N 4.150 -0.573 -1.738 1.00 . A A . 22 CYS N 1 1 23 14404 1 1 22 CYS O O 1.796 0.299 -4.273 1.00 . A A . 22 CYS O 1 1 23 14405 1 1 22 CYS SG S 2.542 1.877 -1.004 1.00 . A A . 22 CYS SG 1 1 23 14406 1 1 23 TRP C C 5.290 -0.600 -6.467 1.00 . A A . 23 TRP C 1 1 23 14407 1 1 23 TRP CA C 4.059 0.021 -5.830 1.00 . A A . 23 TRP CA 1 1 23 14408 1 1 23 TRP CB C 4.104 1.549 -5.981 1.00 . A A . 23 TRP CB 1 1 23 14409 1 1 23 TRP CD1 C 1.801 1.461 -7.069 1.00 . A A . 23 TRP CD1 1 1 23 14410 1 1 23 TRP CD2 C 2.918 3.350 -7.487 1.00 . A A . 23 TRP CD2 1 1 23 14411 1 1 23 TRP CE2 C 1.671 3.413 -8.134 1.00 . A A . 23 TRP CE2 1 1 23 14412 1 1 23 TRP CE3 C 3.791 4.433 -7.610 1.00 . A A . 23 TRP CE3 1 1 23 14413 1 1 23 TRP CG C 2.979 2.087 -6.810 1.00 . A A . 23 TRP CG 1 1 23 14414 1 1 23 TRP CH2 C 2.148 5.557 -8.992 1.00 . A A . 23 TRP CH2 1 1 23 14415 1 1 23 TRP CZ2 C 1.276 4.510 -8.890 1.00 . A A . 23 TRP CZ2 1 1 23 14416 1 1 23 TRP CZ3 C 3.397 5.526 -8.361 1.00 . A A . 23 TRP CZ3 1 1 23 14417 1 1 23 TRP H H 4.715 -0.747 -3.971 1.00 . A A . 23 TRP H 1 1 23 14418 1 1 23 TRP HA H 3.190 -0.354 -6.340 1.00 . A A . 23 TRP HA 1 1 23 14419 1 1 23 TRP HB2 H 4.045 2.003 -5.003 1.00 . A A . 23 TRP HB2 1 1 23 14420 1 1 23 TRP HB3 H 5.034 1.834 -6.451 1.00 . A A . 23 TRP HB3 1 1 23 14421 1 1 23 TRP HD1 H 1.547 0.484 -6.695 1.00 . A A . 23 TRP HD1 1 1 23 14422 1 1 23 TRP HE1 H 0.118 2.015 -8.188 1.00 . A A . 23 TRP HE1 1 1 23 14423 1 1 23 TRP HE3 H 4.758 4.426 -7.135 1.00 . A A . 23 TRP HE3 1 1 23 14424 1 1 23 TRP HH2 H 1.882 6.430 -9.569 1.00 . A A . 23 TRP HH2 1 1 23 14425 1 1 23 TRP HZ2 H 0.316 4.547 -9.382 1.00 . A A . 23 TRP HZ2 1 1 23 14426 1 1 23 TRP HZ3 H 4.057 6.374 -8.465 1.00 . A A . 23 TRP HZ3 1 1 23 14427 1 1 23 TRP N N 3.942 -0.354 -4.428 1.00 . A A . 23 TRP N 1 1 23 14428 1 1 23 TRP NE1 N 1.010 2.248 -7.866 1.00 . A A . 23 TRP NE1 1 1 23 14429 1 1 23 TRP O O 5.190 -1.541 -7.253 1.00 . A A . 23 TRP O 1 1 23 14430 1 1 24 LYS C C 7.616 -0.664 -8.202 1.00 . A A . 24 LYS C 1 1 23 14431 1 1 24 LYS CA C 7.707 -0.546 -6.682 1.00 . A A . 24 LYS CA 1 1 23 14432 1 1 24 LYS CB C 8.060 -1.900 -6.067 1.00 . A A . 24 LYS CB 1 1 23 14433 1 1 24 LYS CD C 10.038 -3.312 -5.429 1.00 . A A . 24 LYS CD 1 1 23 14434 1 1 24 LYS CE C 9.530 -4.742 -5.519 1.00 . A A . 24 LYS CE 1 1 23 14435 1 1 24 LYS CG C 9.416 -2.432 -6.501 1.00 . A A . 24 LYS CG 1 1 23 14436 1 1 24 LYS H H 6.454 0.696 -5.507 1.00 . A A . 24 LYS H 1 1 23 14437 1 1 24 LYS HA H 8.479 0.166 -6.433 1.00 . A A . 24 LYS HA 1 1 23 14438 1 1 24 LYS HB2 H 8.062 -1.801 -4.992 1.00 . A A . 24 LYS HB2 1 1 23 14439 1 1 24 LYS HB3 H 7.306 -2.618 -6.353 1.00 . A A . 24 LYS HB3 1 1 23 14440 1 1 24 LYS HD2 H 11.110 -3.313 -5.555 1.00 . A A . 24 LYS HD2 1 1 23 14441 1 1 24 LYS HD3 H 9.787 -2.911 -4.458 1.00 . A A . 24 LYS HD3 1 1 23 14442 1 1 24 LYS HE2 H 8.568 -4.739 -6.011 1.00 . A A . 24 LYS HE2 1 1 23 14443 1 1 24 LYS HE3 H 10.229 -5.323 -6.103 1.00 . A A . 24 LYS HE3 1 1 23 14444 1 1 24 LYS HG2 H 9.293 -3.013 -7.403 1.00 . A A . 24 LYS HG2 1 1 23 14445 1 1 24 LYS HG3 H 10.074 -1.597 -6.695 1.00 . A A . 24 LYS HG3 1 1 23 14446 1 1 24 LYS HZ1 H 9.161 -4.640 -3.466 1.00 . A A . 24 LYS HZ1 1 1 23 14447 1 1 24 LYS HZ2 H 8.617 -6.069 -4.188 1.00 . A A . 24 LYS HZ2 1 1 23 14448 1 1 24 LYS HZ3 H 10.270 -5.840 -3.903 1.00 . A A . 24 LYS HZ3 1 1 23 14449 1 1 24 LYS N N 6.448 -0.056 -6.132 1.00 . A A . 24 LYS N 1 1 23 14450 1 1 24 LYS NZ N 9.384 -5.366 -4.175 1.00 . A A . 24 LYS NZ 1 1 23 14451 1 1 24 LYS O O 8.291 -1.491 -8.816 1.00 . A A . 24 LYS O 1 1 23 14452 1 1 25 THR C C 7.808 0.684 -10.965 1.00 . A A . 25 THR C 1 1 23 14453 1 1 25 THR CA C 6.568 0.171 -10.242 1.00 . A A . 25 THR CA 1 1 23 14454 1 1 25 THR CB C 5.355 1.035 -10.603 1.00 . A A . 25 THR CB 1 1 23 14455 1 1 25 THR CG2 C 4.440 0.393 -11.624 1.00 . A A . 25 THR CG2 1 1 23 14456 1 1 25 THR H H 6.258 0.802 -8.250 1.00 . A A . 25 THR H 1 1 23 14457 1 1 25 THR HA H 6.379 -0.846 -10.552 1.00 . A A . 25 THR HA 1 1 23 14458 1 1 25 THR HB H 5.701 1.973 -11.014 1.00 . A A . 25 THR HB 1 1 23 14459 1 1 25 THR HG1 H 4.729 2.224 -9.178 1.00 . A A . 25 THR HG1 1 1 23 14460 1 1 25 THR HG21 H 4.334 -0.659 -11.401 1.00 . A A . 25 THR HG21 1 1 23 14461 1 1 25 THR HG22 H 3.471 0.869 -11.587 1.00 . A A . 25 THR HG22 1 1 23 14462 1 1 25 THR HG23 H 4.863 0.511 -12.610 1.00 . A A . 25 THR HG23 1 1 23 14463 1 1 25 THR N N 6.768 0.170 -8.798 1.00 . A A . 25 THR N 1 1 23 14464 1 1 25 THR O O 8.725 1.220 -10.343 1.00 . A A . 25 THR O 1 1 23 14465 1 1 25 THR OG1 O 4.578 1.316 -9.452 1.00 . A A . 25 THR OG1 1 1 23 14466 1 1 26 SER C C 9.005 2.499 -13.144 1.00 . A A . 26 SER C 1 1 23 14467 1 1 26 SER CA C 8.953 0.974 -13.091 1.00 . A A . 26 SER CA 1 1 23 14468 1 1 26 SER CB C 8.853 0.406 -14.507 1.00 . A A . 26 SER CB 1 1 23 14469 1 1 26 SER H H 7.066 0.090 -12.723 1.00 . A A . 26 SER H 1 1 23 14470 1 1 26 SER HA H 9.860 0.611 -12.630 1.00 . A A . 26 SER HA 1 1 23 14471 1 1 26 SER HB2 H 7.815 0.239 -14.753 1.00 . A A . 26 SER HB2 1 1 23 14472 1 1 26 SER HB3 H 9.280 1.110 -15.206 1.00 . A A . 26 SER HB3 1 1 23 14473 1 1 26 SER HG H 10.493 -0.666 -14.521 1.00 . A A . 26 SER HG 1 1 23 14474 1 1 26 SER N N 7.828 0.521 -12.283 1.00 . A A . 26 SER N 1 1 23 14475 1 1 26 SER O O 10.055 3.085 -13.405 1.00 . A A . 26 SER O 1 1 23 14476 1 1 26 SER OG O 9.550 -0.823 -14.615 1.00 . A A . 26 SER OG 1 1 23 14477 1 1 27 VAL C C 7.972 5.175 -11.520 1.00 . A A . 27 VAL C 1 1 23 14478 1 1 27 VAL CA C 7.778 4.590 -12.914 1.00 . A A . 27 VAL CA 1 1 23 14479 1 1 27 VAL CB C 6.420 5.067 -13.469 1.00 . A A . 27 VAL CB 1 1 23 14480 1 1 27 VAL CG1 C 5.280 4.608 -12.569 1.00 . A A . 27 VAL CG1 1 1 23 14481 1 1 27 VAL CG2 C 6.408 6.581 -13.623 1.00 . A A . 27 VAL CG2 1 1 23 14482 1 1 27 VAL H H 7.058 2.614 -12.693 1.00 . A A . 27 VAL H 1 1 23 14483 1 1 27 VAL HA H 8.558 4.961 -13.562 1.00 . A A . 27 VAL HA 1 1 23 14484 1 1 27 VAL HB H 6.278 4.626 -14.445 1.00 . A A . 27 VAL HB 1 1 23 14485 1 1 27 VAL HG11 H 5.307 3.533 -12.473 1.00 . A A . 27 VAL HG11 1 1 23 14486 1 1 27 VAL HG12 H 5.387 5.060 -11.593 1.00 . A A . 27 VAL HG12 1 1 23 14487 1 1 27 VAL HG13 H 4.337 4.908 -13.002 1.00 . A A . 27 VAL HG13 1 1 23 14488 1 1 27 VAL HG21 H 7.373 6.915 -13.973 1.00 . A A . 27 VAL HG21 1 1 23 14489 1 1 27 VAL HG22 H 5.648 6.864 -14.336 1.00 . A A . 27 VAL HG22 1 1 23 14490 1 1 27 VAL HG23 H 6.193 7.038 -12.667 1.00 . A A . 27 VAL HG23 1 1 23 14491 1 1 27 VAL N N 7.863 3.135 -12.894 1.00 . A A . 27 VAL N 1 1 23 14492 1 1 27 VAL O O 8.490 6.281 -11.368 1.00 . A A . 27 VAL O 1 1 23 14493 1 1 28 SER C C 7.769 3.731 -8.152 1.00 . A A . 28 SER C 1 1 23 14494 1 1 28 SER CA C 7.657 4.897 -9.128 1.00 . A A . 28 SER CA 1 1 23 14495 1 1 28 SER CB C 6.446 5.754 -8.765 1.00 . A A . 28 SER CB 1 1 23 14496 1 1 28 SER H H 7.126 3.565 -10.687 1.00 . A A . 28 SER H 1 1 23 14497 1 1 28 SER HA H 8.548 5.501 -9.055 1.00 . A A . 28 SER HA 1 1 23 14498 1 1 28 SER HB2 H 5.604 5.457 -9.373 1.00 . A A . 28 SER HB2 1 1 23 14499 1 1 28 SER HB3 H 6.206 5.607 -7.724 1.00 . A A . 28 SER HB3 1 1 23 14500 1 1 28 SER HG H 7.149 7.499 -8.218 1.00 . A A . 28 SER HG 1 1 23 14501 1 1 28 SER N N 7.540 4.435 -10.505 1.00 . A A . 28 SER N 1 1 23 14502 1 1 28 SER O O 7.708 2.566 -8.543 1.00 . A A . 28 SER O 1 1 23 14503 1 1 28 SER OG O 6.708 7.129 -8.986 1.00 . A A . 28 SER OG 1 1 23 14504 1 1 29 SER C C 7.851 3.704 -4.452 1.00 . A A . 29 SER C 1 1 23 14505 1 1 29 SER CA C 8.041 3.060 -5.822 1.00 . A A . 29 SER CA 1 1 23 14506 1 1 29 SER CB C 9.405 2.369 -5.889 1.00 . A A . 29 SER CB 1 1 23 14507 1 1 29 SER H H 7.961 5.012 -6.631 1.00 . A A . 29 SER H 1 1 23 14508 1 1 29 SER HA H 7.262 2.327 -5.975 1.00 . A A . 29 SER HA 1 1 23 14509 1 1 29 SER HB2 H 10.175 3.070 -5.602 1.00 . A A . 29 SER HB2 1 1 23 14510 1 1 29 SER HB3 H 9.413 1.528 -5.211 1.00 . A A . 29 SER HB3 1 1 23 14511 1 1 29 SER HG H 10.597 1.632 -7.257 1.00 . A A . 29 SER HG 1 1 23 14512 1 1 29 SER N N 7.926 4.063 -6.874 1.00 . A A . 29 SER N 1 1 23 14513 1 1 29 SER O O 8.582 4.624 -4.083 1.00 . A A . 29 SER O 1 1 23 14514 1 1 29 SER OG O 9.678 1.904 -7.199 1.00 . A A . 29 SER OG 1 1 23 14515 1 1 30 HIS C C 6.414 2.664 -1.353 1.00 . A A . 30 HIS C 1 1 23 14516 1 1 30 HIS CA C 6.569 3.773 -2.386 1.00 . A A . 30 HIS CA 1 1 23 14517 1 1 30 HIS CB C 5.291 4.616 -2.426 1.00 . A A . 30 HIS CB 1 1 23 14518 1 1 30 HIS CD2 C 5.327 5.182 -4.956 1.00 . A A . 30 HIS CD2 1 1 23 14519 1 1 30 HIS CE1 C 4.793 7.301 -4.824 1.00 . A A . 30 HIS CE1 1 1 23 14520 1 1 30 HIS CG C 5.168 5.477 -3.646 1.00 . A A . 30 HIS CG 1 1 23 14521 1 1 30 HIS H H 6.303 2.500 -4.058 1.00 . A A . 30 HIS H 1 1 23 14522 1 1 30 HIS HA H 7.396 4.404 -2.098 1.00 . A A . 30 HIS HA 1 1 23 14523 1 1 30 HIS HB2 H 4.435 3.958 -2.401 1.00 . A A . 30 HIS HB2 1 1 23 14524 1 1 30 HIS HB3 H 5.267 5.261 -1.560 1.00 . A A . 30 HIS HB3 1 1 23 14525 1 1 30 HIS HD1 H 4.652 7.327 -2.782 1.00 . A A . 30 HIS HD1 1 1 23 14526 1 1 30 HIS HD2 H 5.596 4.218 -5.368 1.00 . A A . 30 HIS HD2 1 1 23 14527 1 1 30 HIS HE1 H 4.560 8.320 -5.093 1.00 . A A . 30 HIS HE1 1 1 23 14528 1 1 30 HIS HE2 H 4.964 6.382 -6.636 1.00 . A A . 30 HIS HE2 1 1 23 14529 1 1 30 HIS N N 6.859 3.228 -3.707 1.00 . A A . 30 HIS N 1 1 23 14530 1 1 30 HIS ND1 N 4.835 6.813 -3.596 1.00 . A A . 30 HIS ND1 1 1 23 14531 1 1 30 HIS NE2 N 5.088 6.333 -5.667 1.00 . A A . 30 HIS NE2 1 1 23 14532 1 1 30 HIS O O 6.566 1.483 -1.664 1.00 . A A . 30 HIS O 1 1 23 14533 1 1 31 TYR C C 4.531 2.288 1.591 1.00 . A A . 31 TYR C 1 1 23 14534 1 1 31 TYR CA C 5.911 2.108 0.966 1.00 . A A . 31 TYR CA 1 1 23 14535 1 1 31 TYR CB C 6.995 2.292 2.030 1.00 . A A . 31 TYR CB 1 1 23 14536 1 1 31 TYR CD1 C 8.951 1.646 0.570 1.00 . A A . 31 TYR CD1 1 1 23 14537 1 1 31 TYR CD2 C 8.736 0.590 2.696 1.00 . A A . 31 TYR CD2 1 1 23 14538 1 1 31 TYR CE1 C 10.099 0.919 0.320 1.00 . A A . 31 TYR CE1 1 1 23 14539 1 1 31 TYR CE2 C 9.884 -0.141 2.453 1.00 . A A . 31 TYR CE2 1 1 23 14540 1 1 31 TYR CG C 8.251 1.494 1.760 1.00 . A A . 31 TYR CG 1 1 23 14541 1 1 31 TYR CZ C 10.561 0.027 1.264 1.00 . A A . 31 TYR CZ 1 1 23 14542 1 1 31 TYR H H 5.988 4.015 0.056 1.00 . A A . 31 TYR H 1 1 23 14543 1 1 31 TYR HA H 5.982 1.112 0.556 1.00 . A A . 31 TYR HA 1 1 23 14544 1 1 31 TYR HB2 H 7.269 3.335 2.077 1.00 . A A . 31 TYR HB2 1 1 23 14545 1 1 31 TYR HB3 H 6.604 1.983 2.989 1.00 . A A . 31 TYR HB3 1 1 23 14546 1 1 31 TYR HD1 H 8.586 2.345 -0.168 1.00 . A A . 31 TYR HD1 1 1 23 14547 1 1 31 TYR HD2 H 8.203 0.460 3.626 1.00 . A A . 31 TYR HD2 1 1 23 14548 1 1 31 TYR HE1 H 10.629 1.051 -0.612 1.00 . A A . 31 TYR HE1 1 1 23 14549 1 1 31 TYR HE2 H 10.246 -0.839 3.194 1.00 . A A . 31 TYR HE2 1 1 23 14550 1 1 31 TYR HH H 11.542 -1.320 0.306 1.00 . A A . 31 TYR HH 1 1 23 14551 1 1 31 TYR N N 6.101 3.058 -0.123 1.00 . A A . 31 TYR N 1 1 23 14552 1 1 31 TYR O O 3.850 3.279 1.332 1.00 . A A . 31 TYR O 1 1 23 14553 1 1 31 TYR OH O 11.704 -0.698 1.019 1.00 . A A . 31 TYR OH 1 1 23 14554 1 1 32 CYS C C 2.962 1.720 4.542 1.00 . A A . 32 CYS C 1 1 23 14555 1 1 32 CYS CA C 2.820 1.391 3.062 1.00 . A A . 32 CYS CA 1 1 23 14556 1 1 32 CYS CB C 2.076 0.067 2.892 1.00 . A A . 32 CYS CB 1 1 23 14557 1 1 32 CYS H H 4.704 0.557 2.581 1.00 . A A . 32 CYS H 1 1 23 14558 1 1 32 CYS HA H 2.251 2.175 2.585 1.00 . A A . 32 CYS HA 1 1 23 14559 1 1 32 CYS HB2 H 2.536 -0.496 2.094 1.00 . A A . 32 CYS HB2 1 1 23 14560 1 1 32 CYS HB3 H 2.145 -0.498 3.810 1.00 . A A . 32 CYS HB3 1 1 23 14561 1 1 32 CYS N N 4.121 1.327 2.411 1.00 . A A . 32 CYS N 1 1 23 14562 1 1 32 CYS O O 4.063 1.703 5.092 1.00 . A A . 32 CYS O 1 1 23 14563 1 1 32 CYS SG S 0.311 0.256 2.488 1.00 . A A . 32 CYS SG 1 1 23 14564 1 1 33 THR C C 0.908 1.393 7.369 1.00 . A A . 33 THR C 1 1 23 14565 1 1 33 THR CA C 1.823 2.344 6.600 1.00 . A A . 33 THR CA 1 1 23 14566 1 1 33 THR CB C 1.364 3.791 6.805 1.00 . A A . 33 THR CB 1 1 23 14567 1 1 33 THR CG2 C 1.893 4.746 5.755 1.00 . A A . 33 THR CG2 1 1 23 14568 1 1 33 THR H H 0.992 2.007 4.685 1.00 . A A . 33 THR H 1 1 23 14569 1 1 33 THR HA H 2.830 2.239 6.975 1.00 . A A . 33 THR HA 1 1 23 14570 1 1 33 THR HB H 1.712 4.134 7.769 1.00 . A A . 33 THR HB 1 1 23 14571 1 1 33 THR HG1 H -0.377 3.978 7.685 1.00 . A A . 33 THR HG1 1 1 23 14572 1 1 33 THR HG21 H 2.971 4.693 5.732 1.00 . A A . 33 THR HG21 1 1 23 14573 1 1 33 THR HG22 H 1.498 4.472 4.788 1.00 . A A . 33 THR HG22 1 1 23 14574 1 1 33 THR HG23 H 1.587 5.753 5.997 1.00 . A A . 33 THR HG23 1 1 23 14575 1 1 33 THR N N 1.837 2.015 5.181 1.00 . A A . 33 THR N 1 1 23 14576 1 1 33 THR O O 0.537 1.662 8.511 1.00 . A A . 33 THR O 1 1 23 14577 1 1 33 THR OG1 O -0.050 3.876 6.788 1.00 . A A . 33 THR OG1 1 1 23 14578 1 1 34 GLY C C -1.551 -0.068 8.006 1.00 . A A . 34 GLY C 1 1 23 14579 1 1 34 GLY CA C -0.323 -0.697 7.372 1.00 . A A . 34 GLY CA 1 1 23 14580 1 1 34 GLY H H 0.874 0.115 5.823 1.00 . A A . 34 GLY H 1 1 23 14581 1 1 34 GLY HA2 H 0.236 -1.215 8.137 1.00 . A A . 34 GLY HA2 1 1 23 14582 1 1 34 GLY HA3 H -0.644 -1.414 6.631 1.00 . A A . 34 GLY HA3 1 1 23 14583 1 1 34 GLY N N 0.546 0.278 6.734 1.00 . A A . 34 GLY N 1 1 23 14584 1 1 34 GLY O O -2.111 -0.609 8.959 1.00 . A A . 34 GLY O 1 1 23 14585 1 1 35 ARG C C -4.206 1.972 6.932 1.00 . A A . 35 ARG C 1 1 23 14586 1 1 35 ARG CA C -3.135 1.784 8.006 1.00 . A A . 35 ARG CA 1 1 23 14587 1 1 35 ARG CB C -2.721 3.144 8.570 1.00 . A A . 35 ARG CB 1 1 23 14588 1 1 35 ARG CD C -3.791 5.313 9.260 1.00 . A A . 35 ARG CD 1 1 23 14589 1 1 35 ARG CG C -3.794 3.801 9.423 1.00 . A A . 35 ARG CG 1 1 23 14590 1 1 35 ARG CZ C -2.022 6.123 10.774 1.00 . A A . 35 ARG CZ 1 1 23 14591 1 1 35 ARG H H -1.478 1.465 6.724 1.00 . A A . 35 ARG H 1 1 23 14592 1 1 35 ARG HA H -3.547 1.186 8.805 1.00 . A A . 35 ARG HA 1 1 23 14593 1 1 35 ARG HB2 H -1.837 3.015 9.178 1.00 . A A . 35 ARG HB2 1 1 23 14594 1 1 35 ARG HB3 H -2.488 3.806 7.749 1.00 . A A . 35 ARG HB3 1 1 23 14595 1 1 35 ARG HD2 H -3.150 5.573 8.430 1.00 . A A . 35 ARG HD2 1 1 23 14596 1 1 35 ARG HD3 H -4.798 5.642 9.051 1.00 . A A . 35 ARG HD3 1 1 23 14597 1 1 35 ARG HE H -3.981 6.371 11.066 1.00 . A A . 35 ARG HE 1 1 23 14598 1 1 35 ARG HG2 H -4.760 3.420 9.125 1.00 . A A . 35 ARG HG2 1 1 23 14599 1 1 35 ARG HG3 H -3.614 3.559 10.460 1.00 . A A . 35 ARG HG3 1 1 23 14600 1 1 35 ARG HH11 H -1.341 5.145 9.139 1.00 . A A . 35 ARG HH11 1 1 23 14601 1 1 35 ARG HH12 H -0.119 5.725 10.220 1.00 . A A . 35 ARG HH12 1 1 23 14602 1 1 35 ARG HH21 H -2.374 7.134 12.488 1.00 . A A . 35 ARG HH21 1 1 23 14603 1 1 35 ARG HH22 H -0.704 6.853 12.121 1.00 . A A . 35 ARG HH22 1 1 23 14604 1 1 35 ARG N N -1.968 1.080 7.480 1.00 . A A . 35 ARG N 1 1 23 14605 1 1 35 ARG NE N -3.309 5.992 10.461 1.00 . A A . 35 ARG NE 1 1 23 14606 1 1 35 ARG NH1 N -1.084 5.623 9.979 1.00 . A A . 35 ARG NH1 1 1 23 14607 1 1 35 ARG NH2 N -1.671 6.755 11.885 1.00 . A A . 35 ARG NH2 1 1 23 14608 1 1 35 ARG O O -5.385 2.137 7.245 1.00 . A A . 35 ARG O 1 1 23 14609 1 1 36 SER C C -4.119 1.592 3.261 1.00 . A A . 36 SER C 1 1 23 14610 1 1 36 SER CA C -4.721 2.123 4.557 1.00 . A A . 36 SER CA 1 1 23 14611 1 1 36 SER CB C -5.086 3.600 4.396 1.00 . A A . 36 SER CB 1 1 23 14612 1 1 36 SER H H -2.842 1.818 5.478 1.00 . A A . 36 SER H 1 1 23 14613 1 1 36 SER HA H -5.616 1.563 4.782 1.00 . A A . 36 SER HA 1 1 23 14614 1 1 36 SER HB2 H -4.251 4.211 4.703 1.00 . A A . 36 SER HB2 1 1 23 14615 1 1 36 SER HB3 H -5.316 3.800 3.360 1.00 . A A . 36 SER HB3 1 1 23 14616 1 1 36 SER HG H -6.646 4.708 4.815 1.00 . A A . 36 SER HG 1 1 23 14617 1 1 36 SER N N -3.792 1.951 5.669 1.00 . A A . 36 SER N 1 1 23 14618 1 1 36 SER O O -2.899 1.579 3.093 1.00 . A A . 36 SER O 1 1 23 14619 1 1 36 SER OG O -6.212 3.937 5.187 1.00 . A A . 36 SER OG 1 1 23 14620 1 1 37 CYS C C -4.239 1.757 0.073 1.00 . A A . 37 CYS C 1 1 23 14621 1 1 37 CYS CA C -4.522 0.631 1.065 1.00 . A A . 37 CYS CA 1 1 23 14622 1 1 37 CYS CB C -5.560 -0.333 0.487 1.00 . A A . 37 CYS CB 1 1 23 14623 1 1 37 CYS H H -5.939 1.196 2.532 1.00 . A A . 37 CYS H 1 1 23 14624 1 1 37 CYS HA H -3.606 0.089 1.243 1.00 . A A . 37 CYS HA 1 1 23 14625 1 1 37 CYS HB2 H -6.547 0.075 0.644 1.00 . A A . 37 CYS HB2 1 1 23 14626 1 1 37 CYS HB3 H -5.385 -0.447 -0.573 1.00 . A A . 37 CYS HB3 1 1 23 14627 1 1 37 CYS N N -4.978 1.158 2.345 1.00 . A A . 37 CYS N 1 1 23 14628 1 1 37 CYS O O -3.819 1.508 -1.057 1.00 . A A . 37 CYS O 1 1 23 14629 1 1 37 CYS SG S -5.517 -1.991 1.239 1.00 . A A . 37 CYS SG 1 1 23 14630 1 1 38 GLU C C -2.746 4.516 -0.372 1.00 . A A . 38 GLU C 1 1 23 14631 1 1 38 GLU CA C -4.228 4.155 -0.352 1.00 . A A . 38 GLU CA 1 1 23 14632 1 1 38 GLU CB C -5.051 5.350 0.132 1.00 . A A . 38 GLU CB 1 1 23 14633 1 1 38 GLU CD C -7.232 5.526 -1.130 1.00 . A A . 38 GLU CD 1 1 23 14634 1 1 38 GLU CG C -6.549 5.090 0.151 1.00 . A A . 38 GLU CG 1 1 23 14635 1 1 38 GLU H H -4.798 3.137 1.412 1.00 . A A . 38 GLU H 1 1 23 14636 1 1 38 GLU HA H -4.537 3.898 -1.354 1.00 . A A . 38 GLU HA 1 1 23 14637 1 1 38 GLU HB2 H -4.739 5.605 1.134 1.00 . A A . 38 GLU HB2 1 1 23 14638 1 1 38 GLU HB3 H -4.862 6.191 -0.519 1.00 . A A . 38 GLU HB3 1 1 23 14639 1 1 38 GLU HG2 H -6.716 4.032 0.288 1.00 . A A . 38 GLU HG2 1 1 23 14640 1 1 38 GLU HG3 H -6.985 5.633 0.978 1.00 . A A . 38 GLU HG3 1 1 23 14641 1 1 38 GLU N N -4.466 2.997 0.501 1.00 . A A . 38 GLU N 1 1 23 14642 1 1 38 GLU O O -2.322 5.484 0.260 1.00 . A A . 38 GLU O 1 1 23 14643 1 1 38 GLU OE1 O -7.827 6.624 -1.141 1.00 . A A . 38 GLU OE1 1 1 23 14644 1 1 38 GLU OE2 O -7.172 4.769 -2.122 1.00 . A A . 38 GLU OE2 1 1 23 14645 1 1 39 CYS C C -0.215 5.423 -1.508 1.00 . A A . 39 CYS C 1 1 23 14646 1 1 39 CYS CA C -0.522 3.954 -1.209 1.00 . A A . 39 CYS CA 1 1 23 14647 1 1 39 CYS CB C 0.068 3.067 -2.308 1.00 . A A . 39 CYS CB 1 1 23 14648 1 1 39 CYS H H -2.361 2.971 -1.580 1.00 . A A . 39 CYS H 1 1 23 14649 1 1 39 CYS HA H -0.074 3.686 -0.264 1.00 . A A . 39 CYS HA 1 1 23 14650 1 1 39 CYS HB2 H -0.199 2.040 -2.112 1.00 . A A . 39 CYS HB2 1 1 23 14651 1 1 39 CYS HB3 H -0.346 3.364 -3.261 1.00 . A A . 39 CYS HB3 1 1 23 14652 1 1 39 CYS N N -1.962 3.727 -1.102 1.00 . A A . 39 CYS N 1 1 23 14653 1 1 39 CYS O O -0.620 5.949 -2.545 1.00 . A A . 39 CYS O 1 1 23 14654 1 1 39 CYS SG S 1.884 3.150 -2.443 1.00 . A A . 39 CYS SG 1 1 23 14655 1 1 40 PRO C C 1.501 7.789 -2.140 1.00 . A A . 40 PRO C 1 1 23 14656 1 1 40 PRO CA C 0.861 7.521 -0.781 1.00 . A A . 40 PRO CA 1 1 23 14657 1 1 40 PRO CB C 1.864 7.782 0.344 1.00 . A A . 40 PRO CB 1 1 23 14658 1 1 40 PRO CD C 1.034 5.564 0.665 1.00 . A A . 40 PRO CD 1 1 23 14659 1 1 40 PRO CG C 1.520 6.785 1.396 1.00 . A A . 40 PRO CG 1 1 23 14660 1 1 40 PRO HA H 0.001 8.163 -0.657 1.00 . A A . 40 PRO HA 1 1 23 14661 1 1 40 PRO HB2 H 2.869 7.638 -0.025 1.00 . A A . 40 PRO HB2 1 1 23 14662 1 1 40 PRO HB3 H 1.749 8.792 0.707 1.00 . A A . 40 PRO HB3 1 1 23 14663 1 1 40 PRO HD2 H 1.852 4.883 0.482 1.00 . A A . 40 PRO HD2 1 1 23 14664 1 1 40 PRO HD3 H 0.253 5.074 1.228 1.00 . A A . 40 PRO HD3 1 1 23 14665 1 1 40 PRO HG2 H 2.398 6.547 1.979 1.00 . A A . 40 PRO HG2 1 1 23 14666 1 1 40 PRO HG3 H 0.741 7.176 2.032 1.00 . A A . 40 PRO HG3 1 1 23 14667 1 1 40 PRO N N 0.507 6.109 -0.601 1.00 . A A . 40 PRO N 1 1 23 14668 1 1 40 PRO O O 2.013 6.875 -2.786 1.00 . A A . 40 PRO O 1 1 23 14669 1 1 41 SER C C 3.449 10.005 -3.670 1.00 . A A . 41 SER C 1 1 23 14670 1 1 41 SER CA C 2.045 9.433 -3.850 1.00 . A A . 41 SER CA 1 1 23 14671 1 1 41 SER CB C 1.147 10.453 -4.552 1.00 . A A . 41 SER CB 1 1 23 14672 1 1 41 SER H H 1.046 9.732 -2.008 1.00 . A A . 41 SER H 1 1 23 14673 1 1 41 SER HA H 2.110 8.545 -4.462 1.00 . A A . 41 SER HA 1 1 23 14674 1 1 41 SER HB2 H 0.233 9.970 -4.863 1.00 . A A . 41 SER HB2 1 1 23 14675 1 1 41 SER HB3 H 0.916 11.256 -3.868 1.00 . A A . 41 SER HB3 1 1 23 14676 1 1 41 SER HG H 1.221 10.878 -6.463 1.00 . A A . 41 SER HG 1 1 23 14677 1 1 41 SER N N 1.468 9.047 -2.567 1.00 . A A . 41 SER N 1 1 23 14678 1 1 41 SER O O 3.907 10.818 -4.472 1.00 . A A . 41 SER O 1 1 23 14679 1 1 41 SER OG O 1.785 10.997 -5.695 1.00 . A A . 41 SER OG 1 1 23 14680 1 1 42 TYR C C 6.355 8.873 -1.847 1.00 . A A . 42 TYR C 1 1 23 14681 1 1 42 TYR CA C 5.483 10.030 -2.335 1.00 . A A . 42 TYR CA 1 1 23 14682 1 1 42 TYR CB C 5.459 11.153 -1.292 1.00 . A A . 42 TYR CB 1 1 23 14683 1 1 42 TYR CD1 C 6.183 10.142 0.904 1.00 . A A . 42 TYR CD1 1 1 23 14684 1 1 42 TYR CD2 C 3.893 10.756 0.650 1.00 . A A . 42 TYR CD2 1 1 23 14685 1 1 42 TYR CE1 C 5.928 9.703 2.189 1.00 . A A . 42 TYR CE1 1 1 23 14686 1 1 42 TYR CE2 C 3.630 10.320 1.935 1.00 . A A . 42 TYR CE2 1 1 23 14687 1 1 42 TYR CG C 5.172 10.675 0.114 1.00 . A A . 42 TYR CG 1 1 23 14688 1 1 42 TYR CZ C 4.650 9.794 2.700 1.00 . A A . 42 TYR CZ 1 1 23 14689 1 1 42 TYR H H 3.715 8.916 -2.015 1.00 . A A . 42 TYR H 1 1 23 14690 1 1 42 TYR HA H 5.896 10.415 -3.255 1.00 . A A . 42 TYR HA 1 1 23 14691 1 1 42 TYR HB2 H 6.419 11.647 -1.284 1.00 . A A . 42 TYR HB2 1 1 23 14692 1 1 42 TYR HB3 H 4.695 11.868 -1.563 1.00 . A A . 42 TYR HB3 1 1 23 14693 1 1 42 TYR HD1 H 7.182 10.073 0.502 1.00 . A A . 42 TYR HD1 1 1 23 14694 1 1 42 TYR HD2 H 3.097 11.168 0.048 1.00 . A A . 42 TYR HD2 1 1 23 14695 1 1 42 TYR HE1 H 6.727 9.292 2.787 1.00 . A A . 42 TYR HE1 1 1 23 14696 1 1 42 TYR HE2 H 2.629 10.391 2.334 1.00 . A A . 42 TYR HE2 1 1 23 14697 1 1 42 TYR HH H 3.806 9.980 4.417 1.00 . A A . 42 TYR HH 1 1 23 14698 1 1 42 TYR N N 4.130 9.569 -2.616 1.00 . A A . 42 TYR N 1 1 23 14699 1 1 42 TYR O O 5.911 8.047 -1.050 1.00 . A A . 42 TYR O 1 1 23 14700 1 1 42 TYR OH O 4.391 9.358 3.979 1.00 . A A . 42 TYR OH 1 1 23 14701 1 1 43 PRO C C 9.048 7.897 -0.502 1.00 . A A . 43 PRO C 1 1 23 14702 1 1 43 PRO CA C 8.534 7.725 -1.927 1.00 . A A . 43 PRO CA 1 1 23 14703 1 1 43 PRO CB C 9.679 7.866 -2.930 1.00 . A A . 43 PRO CB 1 1 23 14704 1 1 43 PRO CD C 8.229 9.731 -3.279 1.00 . A A . 43 PRO CD 1 1 23 14705 1 1 43 PRO CG C 9.672 9.308 -3.300 1.00 . A A . 43 PRO CG 1 1 23 14706 1 1 43 PRO HA H 8.080 6.750 -2.030 1.00 . A A . 43 PRO HA 1 1 23 14707 1 1 43 PRO HB2 H 10.610 7.580 -2.462 1.00 . A A . 43 PRO HB2 1 1 23 14708 1 1 43 PRO HB3 H 9.491 7.238 -3.788 1.00 . A A . 43 PRO HB3 1 1 23 14709 1 1 43 PRO HD2 H 8.139 10.750 -2.932 1.00 . A A . 43 PRO HD2 1 1 23 14710 1 1 43 PRO HD3 H 7.790 9.625 -4.260 1.00 . A A . 43 PRO HD3 1 1 23 14711 1 1 43 PRO HG2 H 10.239 9.875 -2.576 1.00 . A A . 43 PRO HG2 1 1 23 14712 1 1 43 PRO HG3 H 10.086 9.437 -4.288 1.00 . A A . 43 PRO HG3 1 1 23 14713 1 1 43 PRO N N 7.611 8.793 -2.322 1.00 . A A . 43 PRO N 1 1 23 14714 1 1 43 PRO O O 9.099 9.011 0.020 1.00 . A A . 43 PRO O 1 1 23 14715 1 1 44 GLY C C 11.167 7.708 1.612 1.00 . A A . 44 GLY C 1 1 23 14716 1 1 44 GLY CA C 9.933 6.836 1.482 1.00 . A A . 44 GLY CA 1 1 23 14717 1 1 44 GLY H H 9.364 5.928 -0.343 1.00 . A A . 44 GLY H 1 1 23 14718 1 1 44 GLY HA2 H 10.179 5.834 1.799 1.00 . A A . 44 GLY HA2 1 1 23 14719 1 1 44 GLY HA3 H 9.160 7.227 2.127 1.00 . A A . 44 GLY HA3 1 1 23 14720 1 1 44 GLY N N 9.428 6.787 0.123 1.00 . A A . 44 GLY N 1 1 23 14721 1 1 44 GLY O O 11.364 8.369 2.631 1.00 . A A . 44 GLY O 1 1 23 14722 1 1 45 ASN C C 12.902 9.991 0.709 1.00 . A A . 45 ASN C 1 1 23 14723 1 1 45 ASN CA C 13.221 8.505 0.578 1.00 . A A . 45 ASN CA 1 1 23 14724 1 1 45 ASN CB C 14.020 8.254 -0.702 1.00 . A A . 45 ASN CB 1 1 23 14725 1 1 45 ASN CG C 14.350 6.788 -0.900 1.00 . A A . 45 ASN CG 1 1 23 14726 1 1 45 ASN H H 11.787 7.161 -0.209 1.00 . A A . 45 ASN H 1 1 23 14727 1 1 45 ASN HA H 13.814 8.200 1.427 1.00 . A A . 45 ASN HA 1 1 23 14728 1 1 45 ASN HB2 H 13.444 8.592 -1.551 1.00 . A A . 45 ASN HB2 1 1 23 14729 1 1 45 ASN HB3 H 14.945 8.810 -0.656 1.00 . A A . 45 ASN HB3 1 1 23 14730 1 1 45 ASN HD21 H 16.016 7.269 -1.873 1.00 . A A . 45 ASN HD21 1 1 23 14731 1 1 45 ASN HD22 H 15.709 5.577 -1.700 1.00 . A A . 45 ASN HD22 1 1 23 14732 1 1 45 ASN N N 11.999 7.709 0.576 1.00 . A A . 45 ASN N 1 1 23 14733 1 1 45 ASN ND2 N 15.472 6.517 -1.557 1.00 . A A . 45 ASN ND2 1 1 23 14734 1 1 45 ASN O O 13.678 10.754 1.284 1.00 . A A . 45 ASN O 1 1 23 14735 1 1 45 ASN OD1 O 13.605 5.908 -0.467 1.00 . A A . 45 ASN OD1 1 1 23 14736 1 1 46 GLY C C 9.862 11.951 0.455 1.00 . A A . 46 GLY C 1 1 23 14737 1 1 46 GLY CA C 11.353 11.787 0.241 1.00 . A A . 46 GLY CA 1 1 23 14738 1 1 46 GLY H H 11.176 9.740 -0.273 1.00 . A A . 46 GLY H 1 1 23 14739 1 1 46 GLY HA2 H 11.629 12.275 -0.682 1.00 . A A . 46 GLY HA2 1 1 23 14740 1 1 46 GLY HA3 H 11.877 12.261 1.057 1.00 . A A . 46 GLY HA3 1 1 23 14741 1 1 46 GLY N N 11.755 10.394 0.173 1.00 . A A . 46 GLY N 1 1 23 14742 1 1 46 GLY O O 9.225 12.678 -0.336 1.00 . A A . 46 GLY O 1 1 23 14743 1 1 46 GLY OXT O 9.330 11.351 1.412 1.00 . A A . 46 GLY OXT 1 1 24 14744 1 1 1 ALA C C -18.079 -2.249 7.114 1.00 . A A . 1 ALA C 1 1 24 14745 1 1 1 ALA CA C -19.302 -1.642 7.793 1.00 . A A . 1 ALA CA 1 1 24 14746 1 1 1 ALA CB C -20.413 -1.422 6.779 1.00 . A A . 1 ALA CB 1 1 24 14747 1 1 1 ALA H1 H -18.329 0.170 7.831 1.00 . A A . 1 ALA H1 1 1 24 14748 1 1 1 ALA H2 H -19.845 0.155 8.635 1.00 . A A . 1 ALA H2 1 1 24 14749 1 1 1 ALA H3 H -18.480 -0.592 9.359 1.00 . A A . 1 ALA H3 1 1 24 14750 1 1 1 ALA HA H -19.663 -2.332 8.542 1.00 . A A . 1 ALA HA 1 1 24 14751 1 1 1 ALA HB1 H -20.886 -2.367 6.552 1.00 . A A . 1 ALA HB1 1 1 24 14752 1 1 1 ALA HB2 H -21.146 -0.742 7.188 1.00 . A A . 1 ALA HB2 1 1 24 14753 1 1 1 ALA HB3 H -19.998 -1.002 5.875 1.00 . A A . 1 ALA HB3 1 1 24 14754 1 1 1 ALA N N -18.958 -0.362 8.465 1.00 . A A . 1 ALA N 1 1 24 14755 1 1 1 ALA O O -17.731 -1.879 5.993 1.00 . A A . 1 ALA O 1 1 24 14756 1 1 2 MET C C -16.572 -4.577 5.967 1.00 . A A . 2 MET C 1 1 24 14757 1 1 2 MET CA C -16.245 -3.843 7.263 1.00 . A A . 2 MET CA 1 1 24 14758 1 1 2 MET CB C -15.673 -4.824 8.288 1.00 . A A . 2 MET CB 1 1 24 14759 1 1 2 MET CE C -12.852 -3.943 10.039 1.00 . A A . 2 MET CE 1 1 24 14760 1 1 2 MET CG C -15.585 -4.253 9.694 1.00 . A A . 2 MET CG 1 1 24 14761 1 1 2 MET H H -17.756 -3.436 8.690 1.00 . A A . 2 MET H 1 1 24 14762 1 1 2 MET HA H -15.508 -3.082 7.056 1.00 . A A . 2 MET HA 1 1 24 14763 1 1 2 MET HB2 H -16.301 -5.702 8.318 1.00 . A A . 2 MET HB2 1 1 24 14764 1 1 2 MET HB3 H -14.680 -5.113 7.977 1.00 . A A . 2 MET HB3 1 1 24 14765 1 1 2 MET HE1 H -13.215 -2.958 9.783 1.00 . A A . 2 MET HE1 1 1 24 14766 1 1 2 MET HE2 H -12.099 -3.861 10.808 1.00 . A A . 2 MET HE2 1 1 24 14767 1 1 2 MET HE3 H -12.423 -4.407 9.163 1.00 . A A . 2 MET HE3 1 1 24 14768 1 1 2 MET HG2 H -15.454 -3.183 9.626 1.00 . A A . 2 MET HG2 1 1 24 14769 1 1 2 MET HG3 H -16.506 -4.469 10.214 1.00 . A A . 2 MET HG3 1 1 24 14770 1 1 2 MET N N -17.430 -3.184 7.801 1.00 . A A . 2 MET N 1 1 24 14771 1 1 2 MET O O -17.688 -5.062 5.781 1.00 . A A . 2 MET O 1 1 24 14772 1 1 2 MET SD S -14.212 -4.942 10.639 1.00 . A A . 2 MET SD 1 1 24 14773 1 1 3 ASP C C -14.446 -5.470 3.058 1.00 . A A . 3 ASP C 1 1 24 14774 1 1 3 ASP CA C -15.774 -5.329 3.794 1.00 . A A . 3 ASP CA 1 1 24 14775 1 1 3 ASP CB C -16.772 -4.560 2.926 1.00 . A A . 3 ASP CB 1 1 24 14776 1 1 3 ASP CG C -17.305 -5.396 1.779 1.00 . A A . 3 ASP CG 1 1 24 14777 1 1 3 ASP H H -14.724 -4.247 5.279 1.00 . A A . 3 ASP H 1 1 24 14778 1 1 3 ASP HA H -16.168 -6.314 3.993 1.00 . A A . 3 ASP HA 1 1 24 14779 1 1 3 ASP HB2 H -17.607 -4.249 3.537 1.00 . A A . 3 ASP HB2 1 1 24 14780 1 1 3 ASP HB3 H -16.286 -3.687 2.517 1.00 . A A . 3 ASP HB3 1 1 24 14781 1 1 3 ASP N N -15.591 -4.654 5.073 1.00 . A A . 3 ASP N 1 1 24 14782 1 1 3 ASP O O -14.392 -5.383 1.831 1.00 . A A . 3 ASP O 1 1 24 14783 1 1 3 ASP OD1 O -16.643 -5.442 0.721 1.00 . A A . 3 ASP OD1 1 1 24 14784 1 1 3 ASP OD2 O -18.384 -6.005 1.938 1.00 . A A . 3 ASP OD2 1 1 24 14785 1 1 4 CYS C C -11.636 -4.584 2.475 1.00 . A A . 4 CYS C 1 1 24 14786 1 1 4 CYS CA C -12.047 -5.841 3.235 1.00 . A A . 4 CYS CA 1 1 24 14787 1 1 4 CYS CB C -12.012 -7.050 2.299 1.00 . A A . 4 CYS CB 1 1 24 14788 1 1 4 CYS H H -13.482 -5.747 4.788 1.00 . A A . 4 CYS H 1 1 24 14789 1 1 4 CYS HA H -11.349 -6.002 4.042 1.00 . A A . 4 CYS HA 1 1 24 14790 1 1 4 CYS HB2 H -12.967 -7.142 1.805 1.00 . A A . 4 CYS HB2 1 1 24 14791 1 1 4 CYS HB3 H -11.241 -6.899 1.557 1.00 . A A . 4 CYS HB3 1 1 24 14792 1 1 4 CYS N N -13.376 -5.688 3.815 1.00 . A A . 4 CYS N 1 1 24 14793 1 1 4 CYS O O -12.367 -3.594 2.449 1.00 . A A . 4 CYS O 1 1 24 14794 1 1 4 CYS SG S -11.671 -8.631 3.141 1.00 . A A . 4 CYS SG 1 1 24 14795 1 1 5 THR C C -9.365 -3.971 -0.235 1.00 . A A . 5 THR C 1 1 24 14796 1 1 5 THR CA C -9.945 -3.502 1.097 1.00 . A A . 5 THR CA 1 1 24 14797 1 1 5 THR CB C -8.878 -2.761 1.907 1.00 . A A . 5 THR CB 1 1 24 14798 1 1 5 THR CG2 C -9.117 -1.269 1.982 1.00 . A A . 5 THR CG2 1 1 24 14799 1 1 5 THR H H -9.925 -5.452 1.918 1.00 . A A . 5 THR H 1 1 24 14800 1 1 5 THR HA H -10.766 -2.829 0.902 1.00 . A A . 5 THR HA 1 1 24 14801 1 1 5 THR HB H -7.915 -2.919 1.445 1.00 . A A . 5 THR HB 1 1 24 14802 1 1 5 THR HG1 H -8.194 -3.979 3.280 1.00 . A A . 5 THR HG1 1 1 24 14803 1 1 5 THR HG21 H -9.124 -0.854 0.985 1.00 . A A . 5 THR HG21 1 1 24 14804 1 1 5 THR HG22 H -10.069 -1.080 2.457 1.00 . A A . 5 THR HG22 1 1 24 14805 1 1 5 THR HG23 H -8.329 -0.807 2.558 1.00 . A A . 5 THR HG23 1 1 24 14806 1 1 5 THR N N -10.461 -4.633 1.859 1.00 . A A . 5 THR N 1 1 24 14807 1 1 5 THR O O -8.802 -5.061 -0.327 1.00 . A A . 5 THR O 1 1 24 14808 1 1 5 THR OG1 O -8.821 -3.253 3.234 1.00 . A A . 5 THR OG1 1 1 24 14809 1 1 6 THR C C -8.219 -2.310 -3.191 1.00 . A A . 6 THR C 1 1 24 14810 1 1 6 THR CA C -8.995 -3.479 -2.591 1.00 . A A . 6 THR CA 1 1 24 14811 1 1 6 THR CB C -10.145 -3.872 -3.519 1.00 . A A . 6 THR CB 1 1 24 14812 1 1 6 THR CG2 C -10.922 -5.076 -3.033 1.00 . A A . 6 THR CG2 1 1 24 14813 1 1 6 THR H H -9.965 -2.287 -1.133 1.00 . A A . 6 THR H 1 1 24 14814 1 1 6 THR HA H -8.327 -4.321 -2.484 1.00 . A A . 6 THR HA 1 1 24 14815 1 1 6 THR HB H -9.743 -4.109 -4.494 1.00 . A A . 6 THR HB 1 1 24 14816 1 1 6 THR HG1 H -11.294 -2.459 -2.798 1.00 . A A . 6 THR HG1 1 1 24 14817 1 1 6 THR HG21 H -10.632 -5.305 -2.018 1.00 . A A . 6 THR HG21 1 1 24 14818 1 1 6 THR HG22 H -11.979 -4.860 -3.066 1.00 . A A . 6 THR HG22 1 1 24 14819 1 1 6 THR HG23 H -10.707 -5.923 -3.668 1.00 . A A . 6 THR HG23 1 1 24 14820 1 1 6 THR N N -9.506 -3.142 -1.266 1.00 . A A . 6 THR N 1 1 24 14821 1 1 6 THR O O -8.751 -1.209 -3.336 1.00 . A A . 6 THR O 1 1 24 14822 1 1 6 THR OG1 O -11.061 -2.800 -3.664 1.00 . A A . 6 THR OG1 1 1 24 14823 1 1 7 GLY C C -4.668 -1.908 -4.209 1.00 . A A . 7 GLY C 1 1 24 14824 1 1 7 GLY CA C -6.131 -1.512 -4.116 1.00 . A A . 7 GLY CA 1 1 24 14825 1 1 7 GLY H H -6.587 -3.452 -3.398 1.00 . A A . 7 GLY H 1 1 24 14826 1 1 7 GLY HA2 H -6.215 -0.623 -3.508 1.00 . A A . 7 GLY HA2 1 1 24 14827 1 1 7 GLY HA3 H -6.495 -1.290 -5.108 1.00 . A A . 7 GLY HA3 1 1 24 14828 1 1 7 GLY N N -6.958 -2.556 -3.537 1.00 . A A . 7 GLY N 1 1 24 14829 1 1 7 GLY O O -4.347 -3.095 -4.267 1.00 . A A . 7 GLY O 1 1 24 14830 1 1 8 PRO C C -1.672 -1.514 -2.984 1.00 . A A . 8 PRO C 1 1 24 14831 1 1 8 PRO CA C -2.314 -1.183 -4.332 1.00 . A A . 8 PRO CA 1 1 24 14832 1 1 8 PRO CB C -1.772 0.138 -4.874 1.00 . A A . 8 PRO CB 1 1 24 14833 1 1 8 PRO CD C -4.046 0.521 -4.182 1.00 . A A . 8 PRO CD 1 1 24 14834 1 1 8 PRO CG C -2.693 1.176 -4.329 1.00 . A A . 8 PRO CG 1 1 24 14835 1 1 8 PRO HA H -2.102 -1.976 -5.034 1.00 . A A . 8 PRO HA 1 1 24 14836 1 1 8 PRO HB2 H -0.760 0.285 -4.527 1.00 . A A . 8 PRO HB2 1 1 24 14837 1 1 8 PRO HB3 H -1.790 0.124 -5.954 1.00 . A A . 8 PRO HB3 1 1 24 14838 1 1 8 PRO HD2 H -4.491 0.787 -3.235 1.00 . A A . 8 PRO HD2 1 1 24 14839 1 1 8 PRO HD3 H -4.693 0.810 -4.997 1.00 . A A . 8 PRO HD3 1 1 24 14840 1 1 8 PRO HG2 H -2.336 1.513 -3.367 1.00 . A A . 8 PRO HG2 1 1 24 14841 1 1 8 PRO HG3 H -2.755 2.007 -5.016 1.00 . A A . 8 PRO HG3 1 1 24 14842 1 1 8 PRO N N -3.750 -0.924 -4.234 1.00 . A A . 8 PRO N 1 1 24 14843 1 1 8 PRO O O -0.901 -2.467 -2.874 1.00 . A A . 8 PRO O 1 1 24 14844 1 1 9 CYS C C -1.899 -2.256 -0.039 1.00 . A A . 9 CYS C 1 1 24 14845 1 1 9 CYS CA C -1.432 -0.930 -0.630 1.00 . A A . 9 CYS CA 1 1 24 14846 1 1 9 CYS CB C -1.825 0.226 0.296 1.00 . A A . 9 CYS CB 1 1 24 14847 1 1 9 CYS H H -2.603 0.027 -2.114 1.00 . A A . 9 CYS H 1 1 24 14848 1 1 9 CYS HA H -0.358 -0.954 -0.720 1.00 . A A . 9 CYS HA 1 1 24 14849 1 1 9 CYS HB2 H -2.317 0.989 -0.286 1.00 . A A . 9 CYS HB2 1 1 24 14850 1 1 9 CYS HB3 H -2.507 -0.141 1.050 1.00 . A A . 9 CYS HB3 1 1 24 14851 1 1 9 CYS N N -1.987 -0.720 -1.965 1.00 . A A . 9 CYS N 1 1 24 14852 1 1 9 CYS O O -1.093 -3.044 0.455 1.00 . A A . 9 CYS O 1 1 24 14853 1 1 9 CYS SG S -0.420 1.010 1.152 1.00 . A A . 9 CYS SG 1 1 24 14854 1 1 10 CYS C C -3.616 -4.875 -0.544 1.00 . A A . 10 CYS C 1 1 24 14855 1 1 10 CYS CA C -3.775 -3.725 0.444 1.00 . A A . 10 CYS CA 1 1 24 14856 1 1 10 CYS CB C -5.252 -3.521 0.786 1.00 . A A . 10 CYS CB 1 1 24 14857 1 1 10 CYS H H -3.796 -1.828 -0.493 1.00 . A A . 10 CYS H 1 1 24 14858 1 1 10 CYS HA H -3.239 -3.971 1.347 1.00 . A A . 10 CYS HA 1 1 24 14859 1 1 10 CYS HB2 H -5.616 -4.396 1.303 1.00 . A A . 10 CYS HB2 1 1 24 14860 1 1 10 CYS HB3 H -5.345 -2.664 1.434 1.00 . A A . 10 CYS HB3 1 1 24 14861 1 1 10 CYS N N -3.204 -2.495 -0.090 1.00 . A A . 10 CYS N 1 1 24 14862 1 1 10 CYS O O -3.841 -4.714 -1.743 1.00 . A A . 10 CYS O 1 1 24 14863 1 1 10 CYS SG S -6.326 -3.248 -0.660 1.00 . A A . 10 CYS SG 1 1 24 14864 1 1 11 ARG C C -4.300 -7.560 -1.634 1.00 . A A . 11 ARG C 1 1 24 14865 1 1 11 ARG CA C -3.027 -7.216 -0.863 1.00 . A A . 11 ARG CA 1 1 24 14866 1 1 11 ARG CB C -2.590 -8.406 -0.004 1.00 . A A . 11 ARG CB 1 1 24 14867 1 1 11 ARG CD C -1.608 -10.720 -0.011 1.00 . A A . 11 ARG CD 1 1 24 14868 1 1 11 ARG CG C -2.421 -9.698 -0.788 1.00 . A A . 11 ARG CG 1 1 24 14869 1 1 11 ARG CZ C 0.106 -12.426 -0.483 1.00 . A A . 11 ARG CZ 1 1 24 14870 1 1 11 ARG H H -3.056 -6.100 0.934 1.00 . A A . 11 ARG H 1 1 24 14871 1 1 11 ARG HA H -2.244 -6.992 -1.572 1.00 . A A . 11 ARG HA 1 1 24 14872 1 1 11 ARG HB2 H -1.645 -8.169 0.463 1.00 . A A . 11 ARG HB2 1 1 24 14873 1 1 11 ARG HB3 H -3.329 -8.571 0.766 1.00 . A A . 11 ARG HB3 1 1 24 14874 1 1 11 ARG HD2 H -0.907 -10.196 0.623 1.00 . A A . 11 ARG HD2 1 1 24 14875 1 1 11 ARG HD3 H -2.278 -11.304 0.602 1.00 . A A . 11 ARG HD3 1 1 24 14876 1 1 11 ARG HE H -1.109 -11.618 -1.844 1.00 . A A . 11 ARG HE 1 1 24 14877 1 1 11 ARG HG2 H -3.397 -10.112 -0.995 1.00 . A A . 11 ARG HG2 1 1 24 14878 1 1 11 ARG HG3 H -1.916 -9.480 -1.718 1.00 . A A . 11 ARG HG3 1 1 24 14879 1 1 11 ARG HH11 H -0.004 -11.863 1.457 1.00 . A A . 11 ARG HH11 1 1 24 14880 1 1 11 ARG HH12 H 1.193 -13.062 1.098 1.00 . A A . 11 ARG HH12 1 1 24 14881 1 1 11 ARG HH21 H 0.464 -13.195 -2.317 1.00 . A A . 11 ARG HH21 1 1 24 14882 1 1 11 ARG HH22 H 1.460 -13.818 -1.044 1.00 . A A . 11 ARG HH22 1 1 24 14883 1 1 11 ARG N N -3.222 -6.036 -0.030 1.00 . A A . 11 ARG N 1 1 24 14884 1 1 11 ARG NE N -0.868 -11.617 -0.894 1.00 . A A . 11 ARG NE 1 1 24 14885 1 1 11 ARG NH1 N 0.461 -12.452 0.796 1.00 . A A . 11 ARG NH1 1 1 24 14886 1 1 11 ARG NH2 N 0.728 -13.211 -1.353 1.00 . A A . 11 ARG NH2 1 1 24 14887 1 1 11 ARG O O -4.417 -7.256 -2.821 1.00 . A A . 11 ARG O 1 1 24 14888 1 1 12 GLN C C -7.679 -8.522 -0.615 1.00 . A A . 12 GLN C 1 1 24 14889 1 1 12 GLN CA C -6.504 -8.585 -1.590 1.00 . A A . 12 GLN CA 1 1 24 14890 1 1 12 GLN CB C -6.389 -9.999 -2.156 1.00 . A A . 12 GLN CB 1 1 24 14891 1 1 12 GLN CD C -6.739 -11.414 -4.219 1.00 . A A . 12 GLN CD 1 1 24 14892 1 1 12 GLN CG C -7.217 -10.224 -3.410 1.00 . A A . 12 GLN CG 1 1 24 14893 1 1 12 GLN H H -5.098 -8.422 -0.014 1.00 . A A . 12 GLN H 1 1 24 14894 1 1 12 GLN HA H -6.689 -7.899 -2.402 1.00 . A A . 12 GLN HA 1 1 24 14895 1 1 12 GLN HB2 H -5.354 -10.195 -2.392 1.00 . A A . 12 GLN HB2 1 1 24 14896 1 1 12 GLN HB3 H -6.716 -10.699 -1.403 1.00 . A A . 12 GLN HB3 1 1 24 14897 1 1 12 GLN HE21 H -8.498 -12.310 -3.987 1.00 . A A . 12 GLN HE21 1 1 24 14898 1 1 12 GLN HE22 H -7.326 -13.184 -4.907 1.00 . A A . 12 GLN HE22 1 1 24 14899 1 1 12 GLN HG2 H -8.244 -10.393 -3.123 1.00 . A A . 12 GLN HG2 1 1 24 14900 1 1 12 GLN HG3 H -7.158 -9.340 -4.028 1.00 . A A . 12 GLN HG3 1 1 24 14901 1 1 12 GLN N N -5.248 -8.200 -0.956 1.00 . A A . 12 GLN N 1 1 24 14902 1 1 12 GLN NE2 N -7.609 -12.402 -4.388 1.00 . A A . 12 GLN NE2 1 1 24 14903 1 1 12 GLN O O -8.775 -8.986 -0.929 1.00 . A A . 12 GLN O 1 1 24 14904 1 1 12 GLN OE1 O -5.600 -11.444 -4.687 1.00 . A A . 12 GLN OE1 1 1 24 14905 1 1 13 CYS C C -8.104 -6.946 2.727 1.00 . A A . 13 CYS C 1 1 24 14906 1 1 13 CYS CA C -8.514 -7.845 1.563 1.00 . A A . 13 CYS CA 1 1 24 14907 1 1 13 CYS CB C -8.892 -9.235 2.082 1.00 . A A . 13 CYS CB 1 1 24 14908 1 1 13 CYS H H -6.568 -7.598 0.769 1.00 . A A . 13 CYS H 1 1 24 14909 1 1 13 CYS HA H -9.376 -7.410 1.080 1.00 . A A . 13 CYS HA 1 1 24 14910 1 1 13 CYS HB2 H -8.264 -9.972 1.605 1.00 . A A . 13 CYS HB2 1 1 24 14911 1 1 13 CYS HB3 H -8.731 -9.270 3.150 1.00 . A A . 13 CYS HB3 1 1 24 14912 1 1 13 CYS N N -7.456 -7.951 0.565 1.00 . A A . 13 CYS N 1 1 24 14913 1 1 13 CYS O O -8.921 -6.188 3.249 1.00 . A A . 13 CYS O 1 1 24 14914 1 1 13 CYS SG S -10.626 -9.698 1.767 1.00 . A A . 13 CYS SG 1 1 24 14915 1 1 14 LYS C C -5.099 -5.453 3.851 1.00 . A A . 14 LYS C 1 1 24 14916 1 1 14 LYS CA C -6.351 -6.226 4.248 1.00 . A A . 14 LYS CA 1 1 24 14917 1 1 14 LYS CB C -6.054 -7.111 5.459 1.00 . A A . 14 LYS CB 1 1 24 14918 1 1 14 LYS CD C -7.982 -8.631 5.994 1.00 . A A . 14 LYS CD 1 1 24 14919 1 1 14 LYS CE C -8.769 -9.176 7.175 1.00 . A A . 14 LYS CE 1 1 24 14920 1 1 14 LYS CG C -7.260 -7.342 6.354 1.00 . A A . 14 LYS CG 1 1 24 14921 1 1 14 LYS H H -6.230 -7.658 2.693 1.00 . A A . 14 LYS H 1 1 24 14922 1 1 14 LYS HA H -7.125 -5.521 4.512 1.00 . A A . 14 LYS HA 1 1 24 14923 1 1 14 LYS HB2 H -5.702 -8.071 5.111 1.00 . A A . 14 LYS HB2 1 1 24 14924 1 1 14 LYS HB3 H -5.278 -6.646 6.049 1.00 . A A . 14 LYS HB3 1 1 24 14925 1 1 14 LYS HD2 H -8.664 -8.435 5.180 1.00 . A A . 14 LYS HD2 1 1 24 14926 1 1 14 LYS HD3 H -7.254 -9.366 5.687 1.00 . A A . 14 LYS HD3 1 1 24 14927 1 1 14 LYS HE2 H -8.083 -9.391 7.980 1.00 . A A . 14 LYS HE2 1 1 24 14928 1 1 14 LYS HE3 H -9.478 -8.427 7.496 1.00 . A A . 14 LYS HE3 1 1 24 14929 1 1 14 LYS HG2 H -6.929 -7.402 7.380 1.00 . A A . 14 LYS HG2 1 1 24 14930 1 1 14 LYS HG3 H -7.944 -6.513 6.242 1.00 . A A . 14 LYS HG3 1 1 24 14931 1 1 14 LYS HZ1 H -8.966 -10.972 6.125 1.00 . A A . 14 LYS HZ1 1 1 24 14932 1 1 14 LYS HZ2 H -9.648 -11.005 7.673 1.00 . A A . 14 LYS HZ2 1 1 24 14933 1 1 14 LYS HZ3 H -10.435 -10.185 6.418 1.00 . A A . 14 LYS HZ3 1 1 24 14934 1 1 14 LYS N N -6.842 -7.035 3.139 1.00 . A A . 14 LYS N 1 1 24 14935 1 1 14 LYS NZ N -9.506 -10.422 6.823 1.00 . A A . 14 LYS NZ 1 1 24 14936 1 1 14 LYS O O -4.265 -5.947 3.093 1.00 . A A . 14 LYS O 1 1 24 14937 1 1 15 LEU C C -2.521 -4.143 4.361 1.00 . A A . 15 LEU C 1 1 24 14938 1 1 15 LEU CA C -3.820 -3.394 4.084 1.00 . A A . 15 LEU CA 1 1 24 14939 1 1 15 LEU CB C -3.874 -2.117 4.925 1.00 . A A . 15 LEU CB 1 1 24 14940 1 1 15 LEU CD1 C -3.135 -2.012 7.323 1.00 . A A . 15 LEU CD1 1 1 24 14941 1 1 15 LEU CD2 C -5.500 -1.462 6.723 1.00 . A A . 15 LEU CD2 1 1 24 14942 1 1 15 LEU CG C -4.291 -2.323 6.385 1.00 . A A . 15 LEU CG 1 1 24 14943 1 1 15 LEU H H -5.671 -3.902 4.976 1.00 . A A . 15 LEU H 1 1 24 14944 1 1 15 LEU HA H -3.856 -3.129 3.038 1.00 . A A . 15 LEU HA 1 1 24 14945 1 1 15 LEU HB2 H -2.895 -1.660 4.909 1.00 . A A . 15 LEU HB2 1 1 24 14946 1 1 15 LEU HB3 H -4.576 -1.438 4.464 1.00 . A A . 15 LEU HB3 1 1 24 14947 1 1 15 LEU HD11 H -2.206 -2.039 6.772 1.00 . A A . 15 LEU HD11 1 1 24 14948 1 1 15 LEU HD12 H -3.271 -1.030 7.750 1.00 . A A . 15 LEU HD12 1 1 24 14949 1 1 15 LEU HD13 H -3.106 -2.747 8.114 1.00 . A A . 15 LEU HD13 1 1 24 14950 1 1 15 LEU HD21 H -5.518 -0.596 6.077 1.00 . A A . 15 LEU HD21 1 1 24 14951 1 1 15 LEU HD22 H -6.403 -2.037 6.579 1.00 . A A . 15 LEU HD22 1 1 24 14952 1 1 15 LEU HD23 H -5.438 -1.142 7.752 1.00 . A A . 15 LEU HD23 1 1 24 14953 1 1 15 LEU HG H -4.567 -3.357 6.530 1.00 . A A . 15 LEU HG 1 1 24 14954 1 1 15 LEU N N -4.973 -4.238 4.376 1.00 . A A . 15 LEU N 1 1 24 14955 1 1 15 LEU O O -2.339 -4.711 5.438 1.00 . A A . 15 LEU O 1 1 24 14956 1 1 16 LYS C C 0.442 -4.251 4.705 1.00 . A A . 16 LYS C 1 1 24 14957 1 1 16 LYS CA C -0.344 -4.828 3.531 1.00 . A A . 16 LYS CA 1 1 24 14958 1 1 16 LYS CB C 0.475 -4.710 2.244 1.00 . A A . 16 LYS CB 1 1 24 14959 1 1 16 LYS CD C 0.793 -5.414 -0.149 1.00 . A A . 16 LYS CD 1 1 24 14960 1 1 16 LYS CE C -0.060 -5.160 -1.382 1.00 . A A . 16 LYS CE 1 1 24 14961 1 1 16 LYS CG C -0.061 -5.558 1.102 1.00 . A A . 16 LYS CG 1 1 24 14962 1 1 16 LYS H H -1.820 -3.675 2.548 1.00 . A A . 16 LYS H 1 1 24 14963 1 1 16 LYS HA H -0.551 -5.871 3.724 1.00 . A A . 16 LYS HA 1 1 24 14964 1 1 16 LYS HB2 H 0.479 -3.678 1.927 1.00 . A A . 16 LYS HB2 1 1 24 14965 1 1 16 LYS HB3 H 1.490 -5.019 2.448 1.00 . A A . 16 LYS HB3 1 1 24 14966 1 1 16 LYS HD2 H 1.471 -4.584 -0.018 1.00 . A A . 16 LYS HD2 1 1 24 14967 1 1 16 LYS HD3 H 1.358 -6.323 -0.294 1.00 . A A . 16 LYS HD3 1 1 24 14968 1 1 16 LYS HE2 H -1.083 -5.424 -1.158 1.00 . A A . 16 LYS HE2 1 1 24 14969 1 1 16 LYS HE3 H -0.007 -4.111 -1.632 1.00 . A A . 16 LYS HE3 1 1 24 14970 1 1 16 LYS HG2 H -0.062 -6.594 1.406 1.00 . A A . 16 LYS HG2 1 1 24 14971 1 1 16 LYS HG3 H -1.070 -5.246 0.878 1.00 . A A . 16 LYS HG3 1 1 24 14972 1 1 16 LYS HZ1 H 0.451 -6.968 -2.296 1.00 . A A . 16 LYS HZ1 1 1 24 14973 1 1 16 LYS HZ2 H -0.261 -5.848 -3.345 1.00 . A A . 16 LYS HZ2 1 1 24 14974 1 1 16 LYS HZ3 H 1.344 -5.642 -2.852 1.00 . A A . 16 LYS HZ3 1 1 24 14975 1 1 16 LYS N N -1.621 -4.144 3.384 1.00 . A A . 16 LYS N 1 1 24 14976 1 1 16 LYS NZ N 0.400 -5.961 -2.551 1.00 . A A . 16 LYS NZ 1 1 24 14977 1 1 16 LYS O O 0.231 -3.104 5.097 1.00 . A A . 16 LYS O 1 1 24 14978 1 1 17 PRO C C 3.032 -3.376 6.076 1.00 . A A . 17 PRO C 1 1 24 14979 1 1 17 PRO CA C 2.180 -4.593 6.418 1.00 . A A . 17 PRO CA 1 1 24 14980 1 1 17 PRO CB C 3.075 -5.802 6.723 1.00 . A A . 17 PRO CB 1 1 24 14981 1 1 17 PRO CD C 1.684 -6.416 4.880 1.00 . A A . 17 PRO CD 1 1 24 14982 1 1 17 PRO CG C 3.039 -6.637 5.488 1.00 . A A . 17 PRO CG 1 1 24 14983 1 1 17 PRO HA H 1.568 -4.370 7.279 1.00 . A A . 17 PRO HA 1 1 24 14984 1 1 17 PRO HB2 H 4.077 -5.463 6.941 1.00 . A A . 17 PRO HB2 1 1 24 14985 1 1 17 PRO HB3 H 2.679 -6.339 7.572 1.00 . A A . 17 PRO HB3 1 1 24 14986 1 1 17 PRO HD2 H 1.733 -6.504 3.805 1.00 . A A . 17 PRO HD2 1 1 24 14987 1 1 17 PRO HD3 H 0.968 -7.114 5.288 1.00 . A A . 17 PRO HD3 1 1 24 14988 1 1 17 PRO HG2 H 3.813 -6.318 4.806 1.00 . A A . 17 PRO HG2 1 1 24 14989 1 1 17 PRO HG3 H 3.169 -7.678 5.745 1.00 . A A . 17 PRO HG3 1 1 24 14990 1 1 17 PRO N N 1.364 -5.038 5.283 1.00 . A A . 17 PRO N 1 1 24 14991 1 1 17 PRO O O 3.710 -3.350 5.049 1.00 . A A . 17 PRO O 1 1 24 14992 1 1 18 ALA C C 5.202 -1.460 6.334 1.00 . A A . 18 ALA C 1 1 24 14993 1 1 18 ALA CA C 3.765 -1.144 6.739 1.00 . A A . 18 ALA CA 1 1 24 14994 1 1 18 ALA CB C 3.745 -0.291 7.998 1.00 . A A . 18 ALA CB 1 1 24 14995 1 1 18 ALA H H 2.435 -2.448 7.745 1.00 . A A . 18 ALA H 1 1 24 14996 1 1 18 ALA HA H 3.293 -0.583 5.945 1.00 . A A . 18 ALA HA 1 1 24 14997 1 1 18 ALA HB1 H 4.459 -0.681 8.708 1.00 . A A . 18 ALA HB1 1 1 24 14998 1 1 18 ALA HB2 H 4.006 0.727 7.747 1.00 . A A . 18 ALA HB2 1 1 24 14999 1 1 18 ALA HB3 H 2.757 -0.312 8.432 1.00 . A A . 18 ALA HB3 1 1 24 15000 1 1 18 ALA N N 2.994 -2.367 6.945 1.00 . A A . 18 ALA N 1 1 24 15001 1 1 18 ALA O O 5.683 -2.574 6.539 1.00 . A A . 18 ALA O 1 1 24 15002 1 1 19 GLY C C 7.343 -1.569 4.093 1.00 . A A . 19 GLY C 1 1 24 15003 1 1 19 GLY CA C 7.248 -0.680 5.319 1.00 . A A . 19 GLY CA 1 1 24 15004 1 1 19 GLY H H 5.443 0.389 5.605 1.00 . A A . 19 GLY H 1 1 24 15005 1 1 19 GLY HA2 H 7.804 -1.136 6.125 1.00 . A A . 19 GLY HA2 1 1 24 15006 1 1 19 GLY HA3 H 7.688 0.280 5.090 1.00 . A A . 19 GLY HA3 1 1 24 15007 1 1 19 GLY N N 5.878 -0.477 5.750 1.00 . A A . 19 GLY N 1 1 24 15008 1 1 19 GLY O O 8.435 -1.976 3.696 1.00 . A A . 19 GLY O 1 1 24 15009 1 1 20 THR C C 5.693 -1.903 1.092 1.00 . A A . 20 THR C 1 1 24 15010 1 1 20 THR CA C 6.152 -2.711 2.300 1.00 . A A . 20 THR CA 1 1 24 15011 1 1 20 THR CB C 5.213 -3.898 2.524 1.00 . A A . 20 THR CB 1 1 24 15012 1 1 20 THR CG2 C 5.123 -4.828 1.333 1.00 . A A . 20 THR CG2 1 1 24 15013 1 1 20 THR H H 5.355 -1.513 3.848 1.00 . A A . 20 THR H 1 1 24 15014 1 1 20 THR HA H 7.150 -3.080 2.116 1.00 . A A . 20 THR HA 1 1 24 15015 1 1 20 THR HB H 4.220 -3.524 2.728 1.00 . A A . 20 THR HB 1 1 24 15016 1 1 20 THR HG1 H 5.548 -4.146 4.438 1.00 . A A . 20 THR HG1 1 1 24 15017 1 1 20 THR HG21 H 5.188 -4.252 0.421 1.00 . A A . 20 THR HG21 1 1 24 15018 1 1 20 THR HG22 H 5.935 -5.539 1.369 1.00 . A A . 20 THR HG22 1 1 24 15019 1 1 20 THR HG23 H 4.181 -5.355 1.359 1.00 . A A . 20 THR HG23 1 1 24 15020 1 1 20 THR N N 6.195 -1.869 3.488 1.00 . A A . 20 THR N 1 1 24 15021 1 1 20 THR O O 4.589 -1.359 1.084 1.00 . A A . 20 THR O 1 1 24 15022 1 1 20 THR OG1 O 5.635 -4.667 3.637 1.00 . A A . 20 THR OG1 1 1 24 15023 1 1 21 THR C C 4.816 -1.368 -1.618 1.00 . A A . 21 THR C 1 1 24 15024 1 1 21 THR CA C 6.233 -1.071 -1.135 1.00 . A A . 21 THR CA 1 1 24 15025 1 1 21 THR CB C 7.243 -1.390 -2.236 1.00 . A A . 21 THR CB 1 1 24 15026 1 1 21 THR CG2 C 7.400 -2.871 -2.483 1.00 . A A . 21 THR CG2 1 1 24 15027 1 1 21 THR H H 7.416 -2.274 0.146 1.00 . A A . 21 THR H 1 1 24 15028 1 1 21 THR HA H 6.303 -0.025 -0.897 1.00 . A A . 21 THR HA 1 1 24 15029 1 1 21 THR HB H 8.208 -0.999 -1.948 1.00 . A A . 21 THR HB 1 1 24 15030 1 1 21 THR HG1 H 6.144 -1.280 -3.856 1.00 . A A . 21 THR HG1 1 1 24 15031 1 1 21 THR HG21 H 6.551 -3.394 -2.070 1.00 . A A . 21 THR HG21 1 1 24 15032 1 1 21 THR HG22 H 7.455 -3.053 -3.546 1.00 . A A . 21 THR HG22 1 1 24 15033 1 1 21 THR HG23 H 8.305 -3.219 -2.008 1.00 . A A . 21 THR HG23 1 1 24 15034 1 1 21 THR N N 6.549 -1.822 0.077 1.00 . A A . 21 THR N 1 1 24 15035 1 1 21 THR O O 4.501 -2.496 -1.998 1.00 . A A . 21 THR O 1 1 24 15036 1 1 21 THR OG1 O 6.864 -0.784 -3.460 1.00 . A A . 21 THR OG1 1 1 24 15037 1 1 22 CYS C C 2.416 -0.149 -3.498 1.00 . A A . 22 CYS C 1 1 24 15038 1 1 22 CYS CA C 2.578 -0.494 -2.024 1.00 . A A . 22 CYS CA 1 1 24 15039 1 1 22 CYS CB C 1.658 0.397 -1.186 1.00 . A A . 22 CYS CB 1 1 24 15040 1 1 22 CYS H H 4.277 0.527 -1.278 1.00 . A A . 22 CYS H 1 1 24 15041 1 1 22 CYS HA H 2.295 -1.525 -1.876 1.00 . A A . 22 CYS HA 1 1 24 15042 1 1 22 CYS HB2 H 0.671 0.392 -1.623 1.00 . A A . 22 CYS HB2 1 1 24 15043 1 1 22 CYS HB3 H 1.604 -0.001 -0.185 1.00 . A A . 22 CYS HB3 1 1 24 15044 1 1 22 CYS N N 3.965 -0.346 -1.595 1.00 . A A . 22 CYS N 1 1 24 15045 1 1 22 CYS O O 1.381 0.374 -3.910 1.00 . A A . 22 CYS O 1 1 24 15046 1 1 22 CYS SG S 2.194 2.136 -1.065 1.00 . A A . 22 CYS SG 1 1 24 15047 1 1 23 TRP C C 4.640 -0.641 -6.431 1.00 . A A . 23 TRP C 1 1 24 15048 1 1 23 TRP CA C 3.387 -0.153 -5.717 1.00 . A A . 23 TRP CA 1 1 24 15049 1 1 23 TRP CB C 3.210 1.350 -5.942 1.00 . A A . 23 TRP CB 1 1 24 15050 1 1 23 TRP CD1 C 1.585 0.806 -7.842 1.00 . A A . 23 TRP CD1 1 1 24 15051 1 1 23 TRP CD2 C 1.672 2.972 -7.299 1.00 . A A . 23 TRP CD2 1 1 24 15052 1 1 23 TRP CE2 C 0.750 2.810 -8.348 1.00 . A A . 23 TRP CE2 1 1 24 15053 1 1 23 TRP CE3 C 1.896 4.251 -6.790 1.00 . A A . 23 TRP CE3 1 1 24 15054 1 1 23 TRP CG C 2.194 1.678 -6.990 1.00 . A A . 23 TRP CG 1 1 24 15055 1 1 23 TRP CH2 C 0.292 5.123 -8.378 1.00 . A A . 23 TRP CH2 1 1 24 15056 1 1 23 TRP CZ2 C 0.053 3.880 -8.895 1.00 . A A . 23 TRP CZ2 1 1 24 15057 1 1 23 TRP CZ3 C 1.204 5.315 -7.335 1.00 . A A . 23 TRP CZ3 1 1 24 15058 1 1 23 TRP H H 4.239 -0.858 -3.916 1.00 . A A . 23 TRP H 1 1 24 15059 1 1 23 TRP HA H 2.536 -0.669 -6.125 1.00 . A A . 23 TRP HA 1 1 24 15060 1 1 23 TRP HB2 H 2.895 1.811 -5.018 1.00 . A A . 23 TRP HB2 1 1 24 15061 1 1 23 TRP HB3 H 4.154 1.777 -6.248 1.00 . A A . 23 TRP HB3 1 1 24 15062 1 1 23 TRP HD1 H 1.773 -0.255 -7.855 1.00 . A A . 23 TRP HD1 1 1 24 15063 1 1 23 TRP HE1 H 0.158 1.071 -9.358 1.00 . A A . 23 TRP HE1 1 1 24 15064 1 1 23 TRP HE3 H 2.593 4.414 -5.985 1.00 . A A . 23 TRP HE3 1 1 24 15065 1 1 23 TRP HH2 H -0.223 5.982 -8.777 1.00 . A A . 23 TRP HH2 1 1 24 15066 1 1 23 TRP HZ2 H -0.657 3.748 -9.696 1.00 . A A . 23 TRP HZ2 1 1 24 15067 1 1 23 TRP HZ3 H 1.365 6.313 -6.954 1.00 . A A . 23 TRP HZ3 1 1 24 15068 1 1 23 TRP N N 3.438 -0.442 -4.293 1.00 . A A . 23 TRP N 1 1 24 15069 1 1 23 TRP NE1 N 0.714 1.478 -8.662 1.00 . A A . 23 TRP NE1 1 1 24 15070 1 1 23 TRP O O 4.599 -1.607 -7.193 1.00 . A A . 23 TRP O 1 1 24 15071 1 1 24 LYS C C 6.948 -0.086 -8.319 1.00 . A A . 24 LYS C 1 1 24 15072 1 1 24 LYS CA C 7.016 -0.308 -6.812 1.00 . A A . 24 LYS CA 1 1 24 15073 1 1 24 LYS CB C 7.374 -1.764 -6.511 1.00 . A A . 24 LYS CB 1 1 24 15074 1 1 24 LYS CD C 9.711 -2.110 -5.653 1.00 . A A . 24 LYS CD 1 1 24 15075 1 1 24 LYS CE C 11.135 -1.726 -6.022 1.00 . A A . 24 LYS CE 1 1 24 15076 1 1 24 LYS CG C 8.805 -2.128 -6.874 1.00 . A A . 24 LYS CG 1 1 24 15077 1 1 24 LYS H H 5.710 0.804 -5.577 1.00 . A A . 24 LYS H 1 1 24 15078 1 1 24 LYS HA H 7.779 0.334 -6.399 1.00 . A A . 24 LYS HA 1 1 24 15079 1 1 24 LYS HB2 H 7.235 -1.943 -5.456 1.00 . A A . 24 LYS HB2 1 1 24 15080 1 1 24 LYS HB3 H 6.709 -2.407 -7.067 1.00 . A A . 24 LYS HB3 1 1 24 15081 1 1 24 LYS HD2 H 9.328 -1.393 -4.943 1.00 . A A . 24 LYS HD2 1 1 24 15082 1 1 24 LYS HD3 H 9.716 -3.094 -5.207 1.00 . A A . 24 LYS HD3 1 1 24 15083 1 1 24 LYS HE2 H 11.705 -2.628 -6.190 1.00 . A A . 24 LYS HE2 1 1 24 15084 1 1 24 LYS HE3 H 11.112 -1.141 -6.929 1.00 . A A . 24 LYS HE3 1 1 24 15085 1 1 24 LYS HG2 H 8.816 -3.118 -7.304 1.00 . A A . 24 LYS HG2 1 1 24 15086 1 1 24 LYS HG3 H 9.175 -1.415 -7.596 1.00 . A A . 24 LYS HG3 1 1 24 15087 1 1 24 LYS HZ1 H 11.124 -0.236 -4.558 1.00 . A A . 24 LYS HZ1 1 1 24 15088 1 1 24 LYS HZ2 H 12.107 -1.560 -4.181 1.00 . A A . 24 LYS HZ2 1 1 24 15089 1 1 24 LYS HZ3 H 12.617 -0.427 -5.330 1.00 . A A . 24 LYS HZ3 1 1 24 15090 1 1 24 LYS N N 5.748 0.042 -6.187 1.00 . A A . 24 LYS N 1 1 24 15091 1 1 24 LYS NZ N 11.792 -0.932 -4.948 1.00 . A A . 24 LYS NZ 1 1 24 15092 1 1 24 LYS O O 7.640 -0.752 -9.089 1.00 . A A . 24 LYS O 1 1 24 15093 1 1 25 THR C C 7.298 1.466 -10.795 1.00 . A A . 25 THR C 1 1 24 15094 1 1 25 THR CA C 5.943 1.178 -10.149 1.00 . A A . 25 THR CA 1 1 24 15095 1 1 25 THR CB C 4.993 2.375 -10.312 1.00 . A A . 25 THR CB 1 1 24 15096 1 1 25 THR CG2 C 5.058 3.028 -11.677 1.00 . A A . 25 THR CG2 1 1 24 15097 1 1 25 THR H H 5.583 1.357 -8.071 1.00 . A A . 25 THR H 1 1 24 15098 1 1 25 THR HA H 5.506 0.316 -10.631 1.00 . A A . 25 THR HA 1 1 24 15099 1 1 25 THR HB H 5.241 3.125 -9.574 1.00 . A A . 25 THR HB 1 1 24 15100 1 1 25 THR HG1 H 3.341 2.330 -9.261 1.00 . A A . 25 THR HG1 1 1 24 15101 1 1 25 THR HG21 H 6.069 3.351 -11.874 1.00 . A A . 25 THR HG21 1 1 24 15102 1 1 25 THR HG22 H 4.753 2.318 -12.432 1.00 . A A . 25 THR HG22 1 1 24 15103 1 1 25 THR HG23 H 4.397 3.882 -11.699 1.00 . A A . 25 THR HG23 1 1 24 15104 1 1 25 THR N N 6.106 0.860 -8.734 1.00 . A A . 25 THR N 1 1 24 15105 1 1 25 THR O O 8.235 1.901 -10.125 1.00 . A A . 25 THR O 1 1 24 15106 1 1 25 THR OG1 O 3.651 1.975 -10.098 1.00 . A A . 25 THR OG1 1 1 24 15107 1 1 26 SER C C 8.842 2.922 -13.127 1.00 . A A . 26 SER C 1 1 24 15108 1 1 26 SER CA C 8.641 1.439 -12.830 1.00 . A A . 26 SER CA 1 1 24 15109 1 1 26 SER CB C 8.637 0.639 -14.135 1.00 . A A . 26 SER CB 1 1 24 15110 1 1 26 SER H H 6.619 0.864 -12.575 1.00 . A A . 26 SER H 1 1 24 15111 1 1 26 SER HA H 9.456 1.095 -12.211 1.00 . A A . 26 SER HA 1 1 24 15112 1 1 26 SER HB2 H 8.316 -0.372 -13.934 1.00 . A A . 26 SER HB2 1 1 24 15113 1 1 26 SER HB3 H 7.957 1.100 -14.835 1.00 . A A . 26 SER HB3 1 1 24 15114 1 1 26 SER HG H 10.082 -0.264 -15.102 1.00 . A A . 26 SER HG 1 1 24 15115 1 1 26 SER N N 7.398 1.213 -12.097 1.00 . A A . 26 SER N 1 1 24 15116 1 1 26 SER O O 9.014 3.317 -14.280 1.00 . A A . 26 SER O 1 1 24 15117 1 1 26 SER OG O 9.931 0.600 -14.712 1.00 . A A . 26 SER OG 1 1 24 15118 1 1 27 VAL C C 8.615 5.879 -10.897 1.00 . A A . 27 VAL C 1 1 24 15119 1 1 27 VAL CA C 9.004 5.179 -12.195 1.00 . A A . 27 VAL CA 1 1 24 15120 1 1 27 VAL CB C 8.163 5.772 -13.349 1.00 . A A . 27 VAL CB 1 1 24 15121 1 1 27 VAL CG1 C 6.694 5.421 -13.176 1.00 . A A . 27 VAL CG1 1 1 24 15122 1 1 27 VAL CG2 C 8.350 7.281 -13.431 1.00 . A A . 27 VAL CG2 1 1 24 15123 1 1 27 VAL H H 8.687 3.350 -11.184 1.00 . A A . 27 VAL H 1 1 24 15124 1 1 27 VAL HA H 10.048 5.371 -12.399 1.00 . A A . 27 VAL HA 1 1 24 15125 1 1 27 VAL HB H 8.505 5.341 -14.277 1.00 . A A . 27 VAL HB 1 1 24 15126 1 1 27 VAL HG11 H 6.418 5.522 -12.137 1.00 . A A . 27 VAL HG11 1 1 24 15127 1 1 27 VAL HG12 H 6.091 6.089 -13.774 1.00 . A A . 27 VAL HG12 1 1 24 15128 1 1 27 VAL HG13 H 6.527 4.403 -13.496 1.00 . A A . 27 VAL HG13 1 1 24 15129 1 1 27 VAL HG21 H 9.404 7.515 -13.422 1.00 . A A . 27 VAL HG21 1 1 24 15130 1 1 27 VAL HG22 H 7.907 7.650 -14.345 1.00 . A A . 27 VAL HG22 1 1 24 15131 1 1 27 VAL HG23 H 7.870 7.750 -12.584 1.00 . A A . 27 VAL HG23 1 1 24 15132 1 1 27 VAL N N 8.823 3.734 -12.073 1.00 . A A . 27 VAL N 1 1 24 15133 1 1 27 VAL O O 9.157 6.931 -10.559 1.00 . A A . 27 VAL O 1 1 24 15134 1 1 28 SER C C 7.742 5.100 -7.722 1.00 . A A . 28 SER C 1 1 24 15135 1 1 28 SER CA C 7.189 5.858 -8.925 1.00 . A A . 28 SER CA 1 1 24 15136 1 1 28 SER CB C 5.659 5.845 -8.894 1.00 . A A . 28 SER CB 1 1 24 15137 1 1 28 SER H H 7.264 4.458 -10.506 1.00 . A A . 28 SER H 1 1 24 15138 1 1 28 SER HA H 7.529 6.878 -8.875 1.00 . A A . 28 SER HA 1 1 24 15139 1 1 28 SER HB2 H 5.285 5.500 -9.847 1.00 . A A . 28 SER HB2 1 1 24 15140 1 1 28 SER HB3 H 5.320 5.180 -8.113 1.00 . A A . 28 SER HB3 1 1 24 15141 1 1 28 SER HG H 4.547 7.391 -9.356 1.00 . A A . 28 SER HG 1 1 24 15142 1 1 28 SER N N 7.664 5.290 -10.179 1.00 . A A . 28 SER N 1 1 24 15143 1 1 28 SER O O 8.626 5.589 -7.018 1.00 . A A . 28 SER O 1 1 24 15144 1 1 28 SER OG O 5.144 7.142 -8.646 1.00 . A A . 28 SER OG 1 1 24 15145 1 1 29 SER C C 7.317 3.788 -5.044 1.00 . A A . 29 SER C 1 1 24 15146 1 1 29 SER CA C 7.629 3.085 -6.359 1.00 . A A . 29 SER CA 1 1 24 15147 1 1 29 SER CB C 9.123 2.770 -6.449 1.00 . A A . 29 SER CB 1 1 24 15148 1 1 29 SER H H 6.498 3.584 -8.079 1.00 . A A . 29 SER H 1 1 24 15149 1 1 29 SER HA H 7.068 2.163 -6.399 1.00 . A A . 29 SER HA 1 1 24 15150 1 1 29 SER HB2 H 9.670 3.441 -5.804 1.00 . A A . 29 SER HB2 1 1 24 15151 1 1 29 SER HB3 H 9.292 1.750 -6.134 1.00 . A A . 29 SER HB3 1 1 24 15152 1 1 29 SER HG H 9.383 2.139 -8.286 1.00 . A A . 29 SER HG 1 1 24 15153 1 1 29 SER N N 7.205 3.910 -7.486 1.00 . A A . 29 SER N 1 1 24 15154 1 1 29 SER O O 7.829 4.873 -4.770 1.00 . A A . 29 SER O 1 1 24 15155 1 1 29 SER OG O 9.599 2.923 -7.775 1.00 . A A . 29 SER OG 1 1 24 15156 1 1 30 HIS C C 6.180 2.726 -1.840 1.00 . A A . 30 HIS C 1 1 24 15157 1 1 30 HIS CA C 6.050 3.746 -2.968 1.00 . A A . 30 HIS CA 1 1 24 15158 1 1 30 HIS CB C 4.609 4.248 -3.075 1.00 . A A . 30 HIS CB 1 1 24 15159 1 1 30 HIS CD2 C 4.716 5.154 -5.501 1.00 . A A . 30 HIS CD2 1 1 24 15160 1 1 30 HIS CE1 C 3.810 7.117 -5.154 1.00 . A A . 30 HIS CE1 1 1 24 15161 1 1 30 HIS CG C 4.414 5.234 -4.184 1.00 . A A . 30 HIS CG 1 1 24 15162 1 1 30 HIS H H 6.068 2.316 -4.525 1.00 . A A . 30 HIS H 1 1 24 15163 1 1 30 HIS HA H 6.699 4.582 -2.759 1.00 . A A . 30 HIS HA 1 1 24 15164 1 1 30 HIS HB2 H 3.956 3.406 -3.261 1.00 . A A . 30 HIS HB2 1 1 24 15165 1 1 30 HIS HB3 H 4.326 4.724 -2.149 1.00 . A A . 30 HIS HB3 1 1 24 15166 1 1 30 HIS HD1 H 3.521 6.836 -3.147 1.00 . A A . 30 HIS HD1 1 1 24 15167 1 1 30 HIS HD2 H 5.167 4.309 -6.005 1.00 . A A . 30 HIS HD2 1 1 24 15168 1 1 30 HIS HE1 H 3.420 8.110 -5.314 1.00 . A A . 30 HIS HE1 1 1 24 15169 1 1 30 HIS HE2 H 4.268 6.499 -7.044 1.00 . A A . 30 HIS HE2 1 1 24 15170 1 1 30 HIS N N 6.454 3.171 -4.243 1.00 . A A . 30 HIS N 1 1 24 15171 1 1 30 HIS ND1 N 3.847 6.477 -3.998 1.00 . A A . 30 HIS ND1 1 1 24 15172 1 1 30 HIS NE2 N 4.330 6.337 -6.081 1.00 . A A . 30 HIS NE2 1 1 24 15173 1 1 30 HIS O O 6.849 1.705 -1.996 1.00 . A A . 30 HIS O 1 1 24 15174 1 1 31 TYR C C 4.333 2.204 1.286 1.00 . A A . 31 TYR C 1 1 24 15175 1 1 31 TYR CA C 5.600 2.109 0.445 1.00 . A A . 31 TYR CA 1 1 24 15176 1 1 31 TYR CB C 6.827 2.421 1.304 1.00 . A A . 31 TYR CB 1 1 24 15177 1 1 31 TYR CD1 C 9.095 2.170 0.224 1.00 . A A . 31 TYR CD1 1 1 24 15178 1 1 31 TYR CD2 C 8.133 0.263 1.280 1.00 . A A . 31 TYR CD2 1 1 24 15179 1 1 31 TYR CE1 C 10.205 1.423 -0.123 1.00 . A A . 31 TYR CE1 1 1 24 15180 1 1 31 TYR CE2 C 9.239 -0.491 0.938 1.00 . A A . 31 TYR CE2 1 1 24 15181 1 1 31 TYR CG C 8.042 1.604 0.931 1.00 . A A . 31 TYR CG 1 1 24 15182 1 1 31 TYR CZ C 10.272 0.093 0.236 1.00 . A A . 31 TYR CZ 1 1 24 15183 1 1 31 TYR H H 5.031 3.839 -0.635 1.00 . A A . 31 TYR H 1 1 24 15184 1 1 31 TYR HA H 5.686 1.104 0.071 1.00 . A A . 31 TYR HA 1 1 24 15185 1 1 31 TYR HB2 H 7.081 3.465 1.192 1.00 . A A . 31 TYR HB2 1 1 24 15186 1 1 31 TYR HB3 H 6.595 2.220 2.339 1.00 . A A . 31 TYR HB3 1 1 24 15187 1 1 31 TYR HD1 H 9.040 3.212 -0.055 1.00 . A A . 31 TYR HD1 1 1 24 15188 1 1 31 TYR HD2 H 7.322 -0.192 1.830 1.00 . A A . 31 TYR HD2 1 1 24 15189 1 1 31 TYR HE1 H 11.014 1.881 -0.672 1.00 . A A . 31 TYR HE1 1 1 24 15190 1 1 31 TYR HE2 H 9.289 -1.533 1.219 1.00 . A A . 31 TYR HE2 1 1 24 15191 1 1 31 TYR HH H 12.145 -0.321 0.358 1.00 . A A . 31 TYR HH 1 1 24 15192 1 1 31 TYR N N 5.545 3.008 -0.704 1.00 . A A . 31 TYR N 1 1 24 15193 1 1 31 TYR O O 3.827 3.295 1.546 1.00 . A A . 31 TYR O 1 1 24 15194 1 1 31 TYR OH O 11.375 -0.654 -0.107 1.00 . A A . 31 TYR OH 1 1 24 15195 1 1 32 CYS C C 2.927 1.319 3.976 1.00 . A A . 32 CYS C 1 1 24 15196 1 1 32 CYS CA C 2.616 0.996 2.520 1.00 . A A . 32 CYS CA 1 1 24 15197 1 1 32 CYS CB C 1.966 -0.386 2.419 1.00 . A A . 32 CYS CB 1 1 24 15198 1 1 32 CYS H H 4.274 0.210 1.468 1.00 . A A . 32 CYS H 1 1 24 15199 1 1 32 CYS HA H 1.931 1.735 2.139 1.00 . A A . 32 CYS HA 1 1 24 15200 1 1 32 CYS HB2 H 2.231 -0.832 1.472 1.00 . A A . 32 CYS HB2 1 1 24 15201 1 1 32 CYS HB3 H 2.339 -1.009 3.219 1.00 . A A . 32 CYS HB3 1 1 24 15202 1 1 32 CYS N N 3.825 1.048 1.708 1.00 . A A . 32 CYS N 1 1 24 15203 1 1 32 CYS O O 3.991 0.969 4.487 1.00 . A A . 32 CYS O 1 1 24 15204 1 1 32 CYS SG S 0.146 -0.369 2.532 1.00 . A A . 32 CYS SG 1 1 24 15205 1 1 33 THR C C 1.369 1.406 6.943 1.00 . A A . 33 THR C 1 1 24 15206 1 1 33 THR CA C 2.157 2.350 6.039 1.00 . A A . 33 THR CA 1 1 24 15207 1 1 33 THR CB C 1.701 3.793 6.272 1.00 . A A . 33 THR CB 1 1 24 15208 1 1 33 THR CG2 C 2.077 4.734 5.147 1.00 . A A . 33 THR CG2 1 1 24 15209 1 1 33 THR H H 1.161 2.229 4.177 1.00 . A A . 33 THR H 1 1 24 15210 1 1 33 THR HA H 3.206 2.269 6.280 1.00 . A A . 33 THR HA 1 1 24 15211 1 1 33 THR HB H 2.161 4.162 7.178 1.00 . A A . 33 THR HB 1 1 24 15212 1 1 33 THR HG1 H -0.129 3.342 5.740 1.00 . A A . 33 THR HG1 1 1 24 15213 1 1 33 THR HG21 H 2.800 4.255 4.504 1.00 . A A . 33 THR HG21 1 1 24 15214 1 1 33 THR HG22 H 1.195 4.980 4.575 1.00 . A A . 33 THR HG22 1 1 24 15215 1 1 33 THR HG23 H 2.503 5.637 5.559 1.00 . A A . 33 THR HG23 1 1 24 15216 1 1 33 THR N N 1.989 1.983 4.639 1.00 . A A . 33 THR N 1 1 24 15217 1 1 33 THR O O 1.127 1.710 8.111 1.00 . A A . 33 THR O 1 1 24 15218 1 1 33 THR OG1 O 0.295 3.856 6.431 1.00 . A A . 33 THR OG1 1 1 24 15219 1 1 34 GLY C C -0.937 -0.075 7.936 1.00 . A A . 34 GLY C 1 1 24 15220 1 1 34 GLY CA C 0.208 -0.709 7.168 1.00 . A A . 34 GLY CA 1 1 24 15221 1 1 34 GLY H H 1.190 0.069 5.457 1.00 . A A . 34 GLY H 1 1 24 15222 1 1 34 GLY HA2 H 0.872 -1.194 7.868 1.00 . A A . 34 GLY HA2 1 1 24 15223 1 1 34 GLY HA3 H -0.193 -1.452 6.496 1.00 . A A . 34 GLY HA3 1 1 24 15224 1 1 34 GLY N N 0.968 0.259 6.395 1.00 . A A . 34 GLY N 1 1 24 15225 1 1 34 GLY O O -1.105 -0.324 9.130 1.00 . A A . 34 GLY O 1 1 24 15226 1 1 35 ARG C C -4.082 1.417 6.978 1.00 . A A . 35 ARG C 1 1 24 15227 1 1 35 ARG CA C -2.854 1.424 7.882 1.00 . A A . 35 ARG CA 1 1 24 15228 1 1 35 ARG CB C -2.480 2.863 8.241 1.00 . A A . 35 ARG CB 1 1 24 15229 1 1 35 ARG CD C -1.968 4.392 10.171 1.00 . A A . 35 ARG CD 1 1 24 15230 1 1 35 ARG CG C -1.798 2.996 9.593 1.00 . A A . 35 ARG CG 1 1 24 15231 1 1 35 ARG CZ C -0.215 5.753 9.099 1.00 . A A . 35 ARG CZ 1 1 24 15232 1 1 35 ARG H H -1.538 0.912 6.303 1.00 . A A . 35 ARG H 1 1 24 15233 1 1 35 ARG HA H -3.091 0.890 8.787 1.00 . A A . 35 ARG HA 1 1 24 15234 1 1 35 ARG HB2 H -1.811 3.248 7.485 1.00 . A A . 35 ARG HB2 1 1 24 15235 1 1 35 ARG HB3 H -3.378 3.464 8.254 1.00 . A A . 35 ARG HB3 1 1 24 15236 1 1 35 ARG HD2 H -2.696 4.928 9.580 1.00 . A A . 35 ARG HD2 1 1 24 15237 1 1 35 ARG HD3 H -2.325 4.306 11.187 1.00 . A A . 35 ARG HD3 1 1 24 15238 1 1 35 ARG HE H -0.216 5.191 11.013 1.00 . A A . 35 ARG HE 1 1 24 15239 1 1 35 ARG HG2 H -2.232 2.280 10.276 1.00 . A A . 35 ARG HG2 1 1 24 15240 1 1 35 ARG HG3 H -0.744 2.790 9.475 1.00 . A A . 35 ARG HG3 1 1 24 15241 1 1 35 ARG HH11 H -1.726 5.213 7.866 1.00 . A A . 35 ARG HH11 1 1 24 15242 1 1 35 ARG HH12 H -0.480 6.170 7.138 1.00 . A A . 35 ARG HH12 1 1 24 15243 1 1 35 ARG HH21 H 1.422 6.450 10.057 1.00 . A A . 35 ARG HH21 1 1 24 15244 1 1 35 ARG HH22 H 1.307 6.872 8.381 1.00 . A A . 35 ARG HH22 1 1 24 15245 1 1 35 ARG N N -1.724 0.750 7.251 1.00 . A A . 35 ARG N 1 1 24 15246 1 1 35 ARG NE N -0.714 5.141 10.171 1.00 . A A . 35 ARG NE 1 1 24 15247 1 1 35 ARG NH1 N -0.860 5.708 7.939 1.00 . A A . 35 ARG NH1 1 1 24 15248 1 1 35 ARG NH2 N 0.932 6.413 9.186 1.00 . A A . 35 ARG NH2 1 1 24 15249 1 1 35 ARG O O -5.198 1.166 7.432 1.00 . A A . 35 ARG O 1 1 24 15250 1 1 36 SER C C -4.541 1.136 3.396 1.00 . A A . 36 SER C 1 1 24 15251 1 1 36 SER CA C -4.966 1.733 4.734 1.00 . A A . 36 SER CA 1 1 24 15252 1 1 36 SER CB C -5.447 3.171 4.531 1.00 . A A . 36 SER CB 1 1 24 15253 1 1 36 SER H H -2.961 1.898 5.398 1.00 . A A . 36 SER H 1 1 24 15254 1 1 36 SER HA H -5.778 1.146 5.134 1.00 . A A . 36 SER HA 1 1 24 15255 1 1 36 SER HB2 H -6.344 3.168 3.931 1.00 . A A . 36 SER HB2 1 1 24 15256 1 1 36 SER HB3 H -5.658 3.617 5.492 1.00 . A A . 36 SER HB3 1 1 24 15257 1 1 36 SER HG H -4.297 3.589 3.000 1.00 . A A . 36 SER HG 1 1 24 15258 1 1 36 SER N N -3.872 1.701 5.698 1.00 . A A . 36 SER N 1 1 24 15259 1 1 36 SER O O -3.350 1.005 3.113 1.00 . A A . 36 SER O 1 1 24 15260 1 1 36 SER OG O -4.463 3.951 3.874 1.00 . A A . 36 SER OG 1 1 24 15261 1 1 37 CYS C C -4.849 1.272 0.254 1.00 . A A . 37 CYS C 1 1 24 15262 1 1 37 CYS CA C -5.255 0.197 1.263 1.00 . A A . 37 CYS CA 1 1 24 15263 1 1 37 CYS CB C -6.490 -0.553 0.757 1.00 . A A . 37 CYS CB 1 1 24 15264 1 1 37 CYS H H -6.455 0.909 2.855 1.00 . A A . 37 CYS H 1 1 24 15265 1 1 37 CYS HA H -4.441 -0.503 1.373 1.00 . A A . 37 CYS HA 1 1 24 15266 1 1 37 CYS HB2 H -6.702 -1.374 1.424 1.00 . A A . 37 CYS HB2 1 1 24 15267 1 1 37 CYS HB3 H -7.332 0.123 0.750 1.00 . A A . 37 CYS HB3 1 1 24 15268 1 1 37 CYS N N -5.524 0.778 2.574 1.00 . A A . 37 CYS N 1 1 24 15269 1 1 37 CYS O O -4.422 0.959 -0.858 1.00 . A A . 37 CYS O 1 1 24 15270 1 1 37 CYS SG S -6.311 -1.234 -0.924 1.00 . A A . 37 CYS SG 1 1 24 15271 1 1 38 GLU C C -3.135 3.918 -0.209 1.00 . A A . 38 GLU C 1 1 24 15272 1 1 38 GLU CA C -4.636 3.644 -0.241 1.00 . A A . 38 GLU CA 1 1 24 15273 1 1 38 GLU CB C -5.404 4.905 0.161 1.00 . A A . 38 GLU CB 1 1 24 15274 1 1 38 GLU CD C -4.427 7.082 -0.668 1.00 . A A . 38 GLU CD 1 1 24 15275 1 1 38 GLU CG C -5.429 5.973 -0.921 1.00 . A A . 38 GLU CG 1 1 24 15276 1 1 38 GLU H H -5.338 2.730 1.534 1.00 . A A . 38 GLU H 1 1 24 15277 1 1 38 GLU HA H -4.918 3.369 -1.246 1.00 . A A . 38 GLU HA 1 1 24 15278 1 1 38 GLU HB2 H -6.423 4.634 0.392 1.00 . A A . 38 GLU HB2 1 1 24 15279 1 1 38 GLU HB3 H -4.944 5.327 1.042 1.00 . A A . 38 GLU HB3 1 1 24 15280 1 1 38 GLU HG2 H -5.200 5.511 -1.870 1.00 . A A . 38 GLU HG2 1 1 24 15281 1 1 38 GLU HG3 H -6.419 6.404 -0.960 1.00 . A A . 38 GLU HG3 1 1 24 15282 1 1 38 GLU N N -4.988 2.537 0.640 1.00 . A A . 38 GLU N 1 1 24 15283 1 1 38 GLU O O -2.628 4.536 0.726 1.00 . A A . 38 GLU O 1 1 24 15284 1 1 38 GLU OE1 O -4.169 7.391 0.514 1.00 . A A . 38 GLU OE1 1 1 24 15285 1 1 38 GLU OE2 O -3.899 7.641 -1.653 1.00 . A A . 38 GLU OE2 1 1 24 15286 1 1 39 CYS C C -0.667 5.142 -1.525 1.00 . A A . 39 CYS C 1 1 24 15287 1 1 39 CYS CA C -0.989 3.659 -1.329 1.00 . A A . 39 CYS CA 1 1 24 15288 1 1 39 CYS CB C -0.410 2.839 -2.487 1.00 . A A . 39 CYS CB 1 1 24 15289 1 1 39 CYS H H -2.892 2.976 -1.957 1.00 . A A . 39 CYS H 1 1 24 15290 1 1 39 CYS HA H -0.551 3.321 -0.404 1.00 . A A . 39 CYS HA 1 1 24 15291 1 1 39 CYS HB2 H -0.613 1.793 -2.314 1.00 . A A . 39 CYS HB2 1 1 24 15292 1 1 39 CYS HB3 H -0.886 3.144 -3.409 1.00 . A A . 39 CYS HB3 1 1 24 15293 1 1 39 CYS N N -2.431 3.458 -1.239 1.00 . A A . 39 CYS N 1 1 24 15294 1 1 39 CYS O O -1.132 5.760 -2.483 1.00 . A A . 39 CYS O 1 1 24 15295 1 1 39 CYS SG S 1.391 3.023 -2.708 1.00 . A A . 39 CYS SG 1 1 24 15296 1 1 40 PRO C C 1.127 7.508 -2.053 1.00 . A A . 40 PRO C 1 1 24 15297 1 1 40 PRO CA C 0.500 7.156 -0.708 1.00 . A A . 40 PRO CA 1 1 24 15298 1 1 40 PRO CB C 1.517 7.350 0.427 1.00 . A A . 40 PRO CB 1 1 24 15299 1 1 40 PRO CD C 0.734 5.095 0.556 1.00 . A A . 40 PRO CD 1 1 24 15300 1 1 40 PRO CG C 1.916 5.974 0.844 1.00 . A A . 40 PRO CG 1 1 24 15301 1 1 40 PRO HA H -0.355 7.795 -0.539 1.00 . A A . 40 PRO HA 1 1 24 15302 1 1 40 PRO HB2 H 2.365 7.910 0.061 1.00 . A A . 40 PRO HB2 1 1 24 15303 1 1 40 PRO HB3 H 1.051 7.887 1.240 1.00 . A A . 40 PRO HB3 1 1 24 15304 1 1 40 PRO HD2 H 1.057 4.091 0.327 1.00 . A A . 40 PRO HD2 1 1 24 15305 1 1 40 PRO HD3 H 0.049 5.094 1.391 1.00 . A A . 40 PRO HD3 1 1 24 15306 1 1 40 PRO HG2 H 2.772 5.650 0.272 1.00 . A A . 40 PRO HG2 1 1 24 15307 1 1 40 PRO HG3 H 2.143 5.962 1.900 1.00 . A A . 40 PRO HG3 1 1 24 15308 1 1 40 PRO N N 0.131 5.740 -0.619 1.00 . A A . 40 PRO N 1 1 24 15309 1 1 40 PRO O O 1.549 6.627 -2.803 1.00 . A A . 40 PRO O 1 1 24 15310 1 1 41 SER C C 3.206 9.709 -3.420 1.00 . A A . 41 SER C 1 1 24 15311 1 1 41 SER CA C 1.756 9.272 -3.608 1.00 . A A . 41 SER CA 1 1 24 15312 1 1 41 SER CB C 0.931 10.434 -4.165 1.00 . A A . 41 SER CB 1 1 24 15313 1 1 41 SER H H 0.829 9.456 -1.714 1.00 . A A . 41 SER H 1 1 24 15314 1 1 41 SER HA H 1.728 8.454 -4.311 1.00 . A A . 41 SER HA 1 1 24 15315 1 1 41 SER HB2 H 1.258 11.356 -3.709 1.00 . A A . 41 SER HB2 1 1 24 15316 1 1 41 SER HB3 H 1.072 10.492 -5.235 1.00 . A A . 41 SER HB3 1 1 24 15317 1 1 41 SER HG H -0.934 10.211 -4.722 1.00 . A A . 41 SER HG 1 1 24 15318 1 1 41 SER N N 1.183 8.802 -2.352 1.00 . A A . 41 SER N 1 1 24 15319 1 1 41 SER O O 3.699 10.582 -4.134 1.00 . A A . 41 SER O 1 1 24 15320 1 1 41 SER OG O -0.448 10.256 -3.895 1.00 . A A . 41 SER OG 1 1 24 15321 1 1 42 TYR C C 6.027 8.199 -1.645 1.00 . A A . 42 TYR C 1 1 24 15322 1 1 42 TYR CA C 5.280 9.420 -2.181 1.00 . A A . 42 TYR CA 1 1 24 15323 1 1 42 TYR CB C 5.369 10.574 -1.179 1.00 . A A . 42 TYR CB 1 1 24 15324 1 1 42 TYR CD1 C 5.827 9.490 1.055 1.00 . A A . 42 TYR CD1 1 1 24 15325 1 1 42 TYR CD2 C 3.713 10.542 0.729 1.00 . A A . 42 TYR CD2 1 1 24 15326 1 1 42 TYR CE1 C 5.460 9.141 2.340 1.00 . A A . 42 TYR CE1 1 1 24 15327 1 1 42 TYR CE2 C 3.339 10.198 2.014 1.00 . A A . 42 TYR CE2 1 1 24 15328 1 1 42 TYR CG C 4.962 10.195 0.228 1.00 . A A . 42 TYR CG 1 1 24 15329 1 1 42 TYR CZ C 4.216 9.497 2.815 1.00 . A A . 42 TYR CZ 1 1 24 15330 1 1 42 TYR H H 3.442 8.405 -1.922 1.00 . A A . 42 TYR H 1 1 24 15331 1 1 42 TYR HA H 5.737 9.726 -3.110 1.00 . A A . 42 TYR HA 1 1 24 15332 1 1 42 TYR HB2 H 6.387 10.932 -1.143 1.00 . A A . 42 TYR HB2 1 1 24 15333 1 1 42 TYR HB3 H 4.724 11.376 -1.507 1.00 . A A . 42 TYR HB3 1 1 24 15334 1 1 42 TYR HD1 H 6.801 9.213 0.680 1.00 . A A . 42 TYR HD1 1 1 24 15335 1 1 42 TYR HD2 H 3.029 11.091 0.098 1.00 . A A . 42 TYR HD2 1 1 24 15336 1 1 42 TYR HE1 H 6.148 8.592 2.967 1.00 . A A . 42 TYR HE1 1 1 24 15337 1 1 42 TYR HE2 H 2.364 10.477 2.385 1.00 . A A . 42 TYR HE2 1 1 24 15338 1 1 42 TYR HH H 3.710 8.203 4.144 1.00 . A A . 42 TYR HH 1 1 24 15339 1 1 42 TYR N N 3.886 9.094 -2.457 1.00 . A A . 42 TYR N 1 1 24 15340 1 1 42 TYR O O 5.464 7.395 -0.902 1.00 . A A . 42 TYR O 1 1 24 15341 1 1 42 TYR OH O 3.847 9.152 4.095 1.00 . A A . 42 TYR OH 1 1 24 15342 1 1 43 PRO C C 8.591 7.067 -0.126 1.00 . A A . 43 PRO C 1 1 24 15343 1 1 43 PRO CA C 8.128 6.912 -1.570 1.00 . A A . 43 PRO CA 1 1 24 15344 1 1 43 PRO CB C 9.321 6.953 -2.523 1.00 . A A . 43 PRO CB 1 1 24 15345 1 1 43 PRO CD C 8.063 8.952 -2.904 1.00 . A A . 43 PRO CD 1 1 24 15346 1 1 43 PRO CG C 9.460 8.391 -2.883 1.00 . A A . 43 PRO CG 1 1 24 15347 1 1 43 PRO HA H 7.604 5.975 -1.682 1.00 . A A . 43 PRO HA 1 1 24 15348 1 1 43 PRO HB2 H 10.201 6.582 -2.018 1.00 . A A . 43 PRO HB2 1 1 24 15349 1 1 43 PRO HB3 H 9.113 6.347 -3.392 1.00 . A A . 43 PRO HB3 1 1 24 15350 1 1 43 PRO HD2 H 8.056 9.960 -2.515 1.00 . A A . 43 PRO HD2 1 1 24 15351 1 1 43 PRO HD3 H 7.663 8.930 -3.907 1.00 . A A . 43 PRO HD3 1 1 24 15352 1 1 43 PRO HG2 H 10.056 8.899 -2.139 1.00 . A A . 43 PRO HG2 1 1 24 15353 1 1 43 PRO HG3 H 9.915 8.483 -3.857 1.00 . A A . 43 PRO HG3 1 1 24 15354 1 1 43 PRO N N 7.309 8.042 -2.018 1.00 . A A . 43 PRO N 1 1 24 15355 1 1 43 PRO O O 8.880 8.174 0.329 1.00 . A A . 43 PRO O 1 1 24 15356 1 1 44 GLY C C 10.486 6.546 2.139 1.00 . A A . 44 GLY C 1 1 24 15357 1 1 44 GLY CA C 9.087 5.984 1.978 1.00 . A A . 44 GLY CA 1 1 24 15358 1 1 44 GLY H H 8.416 5.097 0.176 1.00 . A A . 44 GLY H 1 1 24 15359 1 1 44 GLY HA2 H 9.067 4.980 2.374 1.00 . A A . 44 GLY HA2 1 1 24 15360 1 1 44 GLY HA3 H 8.398 6.596 2.541 1.00 . A A . 44 GLY HA3 1 1 24 15361 1 1 44 GLY N N 8.658 5.951 0.592 1.00 . A A . 44 GLY N 1 1 24 15362 1 1 44 GLY O O 10.786 7.205 3.135 1.00 . A A . 44 GLY O 1 1 24 15363 1 1 45 ASN C C 12.853 8.084 0.434 1.00 . A A . 45 ASN C 1 1 24 15364 1 1 45 ASN CA C 12.718 6.769 1.195 1.00 . A A . 45 ASN CA 1 1 24 15365 1 1 45 ASN CB C 13.665 5.724 0.603 1.00 . A A . 45 ASN CB 1 1 24 15366 1 1 45 ASN CG C 15.064 5.818 1.180 1.00 . A A . 45 ASN CG 1 1 24 15367 1 1 45 ASN H H 11.044 5.754 0.390 1.00 . A A . 45 ASN H 1 1 24 15368 1 1 45 ASN HA H 12.982 6.936 2.229 1.00 . A A . 45 ASN HA 1 1 24 15369 1 1 45 ASN HB2 H 13.277 4.737 0.809 1.00 . A A . 45 ASN HB2 1 1 24 15370 1 1 45 ASN HB3 H 13.726 5.866 -0.466 1.00 . A A . 45 ASN HB3 1 1 24 15371 1 1 45 ASN HD21 H 14.416 5.130 2.929 1.00 . A A . 45 ASN HD21 1 1 24 15372 1 1 45 ASN HD22 H 16.103 5.494 2.844 1.00 . A A . 45 ASN HD22 1 1 24 15373 1 1 45 ASN N N 11.343 6.285 1.158 1.00 . A A . 45 ASN N 1 1 24 15374 1 1 45 ASN ND2 N 15.209 5.443 2.446 1.00 . A A . 45 ASN ND2 1 1 24 15375 1 1 45 ASN O O 13.308 8.107 -0.709 1.00 . A A . 45 ASN O 1 1 24 15376 1 1 45 ASN OD1 O 16.004 6.224 0.496 1.00 . A A . 45 ASN OD1 1 1 24 15377 1 1 46 GLY C C 11.324 11.342 0.728 1.00 . A A . 46 GLY C 1 1 24 15378 1 1 46 GLY CA C 12.538 10.480 0.445 1.00 . A A . 46 GLY CA 1 1 24 15379 1 1 46 GLY H H 12.099 9.097 1.987 1.00 . A A . 46 GLY H 1 1 24 15380 1 1 46 GLY HA2 H 12.629 10.345 -0.623 1.00 . A A . 46 GLY HA2 1 1 24 15381 1 1 46 GLY HA3 H 13.419 10.988 0.809 1.00 . A A . 46 GLY HA3 1 1 24 15382 1 1 46 GLY N N 12.454 9.177 1.076 1.00 . A A . 46 GLY N 1 1 24 15383 1 1 46 GLY O O 10.335 11.242 -0.030 1.00 . A A . 46 GLY O 1 1 24 15384 1 1 46 GLY OXT O 11.360 12.116 1.707 1.00 . A A . 46 GLY OXT 1 1 25 15385 1 1 1 ALA C C -19.055 -7.037 4.772 1.00 . A A . 1 ALA C 1 1 25 15386 1 1 1 ALA CA C -20.373 -6.274 4.699 1.00 . A A . 1 ALA CA 1 1 25 15387 1 1 1 ALA CB C -20.750 -5.740 6.072 1.00 . A A . 1 ALA CB 1 1 25 15388 1 1 1 ALA H1 H -21.556 -7.953 4.803 1.00 . A A . 1 ALA H1 1 1 25 15389 1 1 1 ALA H2 H -22.332 -6.571 4.145 1.00 . A A . 1 ALA H2 1 1 25 15390 1 1 1 ALA H3 H -21.186 -7.437 3.209 1.00 . A A . 1 ALA H3 1 1 25 15391 1 1 1 ALA HA H -20.252 -5.431 4.034 1.00 . A A . 1 ALA HA 1 1 25 15392 1 1 1 ALA HB1 H -21.825 -5.740 6.176 1.00 . A A . 1 ALA HB1 1 1 25 15393 1 1 1 ALA HB2 H -20.379 -4.731 6.181 1.00 . A A . 1 ALA HB2 1 1 25 15394 1 1 1 ALA HB3 H -20.315 -6.368 6.835 1.00 . A A . 1 ALA HB3 1 1 25 15395 1 1 1 ALA N N -21.460 -7.137 4.166 1.00 . A A . 1 ALA N 1 1 25 15396 1 1 1 ALA O O -19.032 -8.265 4.691 1.00 . A A . 1 ALA O 1 1 25 15397 1 1 2 MET C C -15.569 -5.853 5.283 1.00 . A A . 2 MET C 1 1 25 15398 1 1 2 MET CA C -16.636 -6.908 5.011 1.00 . A A . 2 MET CA 1 1 25 15399 1 1 2 MET CB C -16.312 -7.656 3.716 1.00 . A A . 2 MET CB 1 1 25 15400 1 1 2 MET CE C -15.084 -6.653 0.123 1.00 . A A . 2 MET CE 1 1 25 15401 1 1 2 MET CG C -16.560 -6.835 2.461 1.00 . A A . 2 MET CG 1 1 25 15402 1 1 2 MET H H -18.042 -5.326 4.984 1.00 . A A . 2 MET H 1 1 25 15403 1 1 2 MET HA H -16.647 -7.612 5.829 1.00 . A A . 2 MET HA 1 1 25 15404 1 1 2 MET HB2 H -15.271 -7.944 3.732 1.00 . A A . 2 MET HB2 1 1 25 15405 1 1 2 MET HB3 H -16.922 -8.545 3.665 1.00 . A A . 2 MET HB3 1 1 25 15406 1 1 2 MET HE1 H -15.975 -7.241 -0.043 1.00 . A A . 2 MET HE1 1 1 25 15407 1 1 2 MET HE2 H -15.082 -5.805 -0.546 1.00 . A A . 2 MET HE2 1 1 25 15408 1 1 2 MET HE3 H -14.211 -7.262 -0.064 1.00 . A A . 2 MET HE3 1 1 25 15409 1 1 2 MET HG2 H -16.973 -7.481 1.701 1.00 . A A . 2 MET HG2 1 1 25 15410 1 1 2 MET HG3 H -17.271 -6.055 2.692 1.00 . A A . 2 MET HG3 1 1 25 15411 1 1 2 MET N N -17.959 -6.301 4.926 1.00 . A A . 2 MET N 1 1 25 15412 1 1 2 MET O O -14.713 -6.031 6.149 1.00 . A A . 2 MET O 1 1 25 15413 1 1 2 MET SD S -15.056 -6.076 1.818 1.00 . A A . 2 MET SD 1 1 25 15414 1 1 3 ASP C C -13.247 -4.155 4.426 1.00 . A A . 3 ASP C 1 1 25 15415 1 1 3 ASP CA C -14.667 -3.669 4.700 1.00 . A A . 3 ASP CA 1 1 25 15416 1 1 3 ASP CB C -14.755 -3.086 6.111 1.00 . A A . 3 ASP CB 1 1 25 15417 1 1 3 ASP CG C -16.161 -2.645 6.467 1.00 . A A . 3 ASP CG 1 1 25 15418 1 1 3 ASP H H -16.335 -4.670 3.864 1.00 . A A . 3 ASP H 1 1 25 15419 1 1 3 ASP HA H -14.914 -2.898 3.986 1.00 . A A . 3 ASP HA 1 1 25 15420 1 1 3 ASP HB2 H -14.443 -3.835 6.823 1.00 . A A . 3 ASP HB2 1 1 25 15421 1 1 3 ASP HB3 H -14.099 -2.231 6.183 1.00 . A A . 3 ASP HB3 1 1 25 15422 1 1 3 ASP N N -15.628 -4.753 4.538 1.00 . A A . 3 ASP N 1 1 25 15423 1 1 3 ASP O O -12.496 -4.461 5.351 1.00 . A A . 3 ASP O 1 1 25 15424 1 1 3 ASP OD1 O -17.064 -3.507 6.501 1.00 . A A . 3 ASP OD1 1 1 25 15425 1 1 3 ASP OD2 O -16.360 -1.436 6.712 1.00 . A A . 3 ASP OD2 1 1 25 15426 1 1 4 CYS C C -10.700 -3.498 2.282 1.00 . A A . 4 CYS C 1 1 25 15427 1 1 4 CYS CA C -11.556 -4.671 2.753 1.00 . A A . 4 CYS CA 1 1 25 15428 1 1 4 CYS CB C -11.657 -5.720 1.643 1.00 . A A . 4 CYS CB 1 1 25 15429 1 1 4 CYS H H -13.530 -3.964 2.456 1.00 . A A . 4 CYS H 1 1 25 15430 1 1 4 CYS HA H -11.088 -5.119 3.616 1.00 . A A . 4 CYS HA 1 1 25 15431 1 1 4 CYS HB2 H -12.457 -5.445 0.971 1.00 . A A . 4 CYS HB2 1 1 25 15432 1 1 4 CYS HB3 H -10.727 -5.744 1.095 1.00 . A A . 4 CYS HB3 1 1 25 15433 1 1 4 CYS N N -12.886 -4.222 3.148 1.00 . A A . 4 CYS N 1 1 25 15434 1 1 4 CYS O O -9.472 -3.549 2.349 1.00 . A A . 4 CYS O 1 1 25 15435 1 1 4 CYS SG S -11.994 -7.408 2.241 1.00 . A A . 4 CYS SG 1 1 25 15436 1 1 5 THR C C -9.740 -1.615 0.146 1.00 . A A . 5 THR C 1 1 25 15437 1 1 5 THR CA C -10.642 -1.262 1.325 1.00 . A A . 5 THR CA 1 1 25 15438 1 1 5 THR CB C -9.812 -0.646 2.454 1.00 . A A . 5 THR CB 1 1 25 15439 1 1 5 THR CG2 C -9.616 0.848 2.306 1.00 . A A . 5 THR CG2 1 1 25 15440 1 1 5 THR H H -12.331 -2.456 1.775 1.00 . A A . 5 THR H 1 1 25 15441 1 1 5 THR HA H -11.377 -0.542 0.998 1.00 . A A . 5 THR HA 1 1 25 15442 1 1 5 THR HB H -8.835 -1.108 2.462 1.00 . A A . 5 THR HB 1 1 25 15443 1 1 5 THR HG1 H -11.345 -0.609 3.672 1.00 . A A . 5 THR HG1 1 1 25 15444 1 1 5 THR HG21 H -9.346 1.076 1.286 1.00 . A A . 5 THR HG21 1 1 25 15445 1 1 5 THR HG22 H -10.535 1.357 2.558 1.00 . A A . 5 THR HG22 1 1 25 15446 1 1 5 THR HG23 H -8.829 1.175 2.969 1.00 . A A . 5 THR HG23 1 1 25 15447 1 1 5 THR N N -11.352 -2.442 1.806 1.00 . A A . 5 THR N 1 1 25 15448 1 1 5 THR O O -8.517 -1.514 0.233 1.00 . A A . 5 THR O 1 1 25 15449 1 1 5 THR OG1 O -10.424 -0.877 3.710 1.00 . A A . 5 THR OG1 1 1 25 15450 1 1 6 THR C C -8.738 -1.247 -2.636 1.00 . A A . 6 THR C 1 1 25 15451 1 1 6 THR CA C -9.606 -2.404 -2.153 1.00 . A A . 6 THR CA 1 1 25 15452 1 1 6 THR CB C -10.562 -2.839 -3.264 1.00 . A A . 6 THR CB 1 1 25 15453 1 1 6 THR CG2 C -11.263 -4.148 -2.971 1.00 . A A . 6 THR CG2 1 1 25 15454 1 1 6 THR H H -11.331 -2.095 -0.965 1.00 . A A . 6 THR H 1 1 25 15455 1 1 6 THR HA H -8.965 -3.235 -1.897 1.00 . A A . 6 THR HA 1 1 25 15456 1 1 6 THR HB H -10.001 -2.962 -4.179 1.00 . A A . 6 THR HB 1 1 25 15457 1 1 6 THR HG1 H -12.168 -1.845 -2.742 1.00 . A A . 6 THR HG1 1 1 25 15458 1 1 6 THR HG21 H -10.650 -4.744 -2.311 1.00 . A A . 6 THR HG21 1 1 25 15459 1 1 6 THR HG22 H -12.214 -3.949 -2.499 1.00 . A A . 6 THR HG22 1 1 25 15460 1 1 6 THR HG23 H -11.424 -4.685 -3.894 1.00 . A A . 6 THR HG23 1 1 25 15461 1 1 6 THR N N -10.353 -2.033 -0.956 1.00 . A A . 6 THR N 1 1 25 15462 1 1 6 THR O O -9.247 -0.218 -3.082 1.00 . A A . 6 THR O 1 1 25 15463 1 1 6 THR OG1 O -11.558 -1.856 -3.484 1.00 . A A . 6 THR OG1 1 1 25 15464 1 1 7 GLY C C -5.119 -0.931 -3.278 1.00 . A A . 7 GLY C 1 1 25 15465 1 1 7 GLY CA C -6.503 -0.387 -2.976 1.00 . A A . 7 GLY CA 1 1 25 15466 1 1 7 GLY H H -7.076 -2.264 -2.181 1.00 . A A . 7 GLY H 1 1 25 15467 1 1 7 GLY HA2 H -6.424 0.356 -2.196 1.00 . A A . 7 GLY HA2 1 1 25 15468 1 1 7 GLY HA3 H -6.897 0.081 -3.866 1.00 . A A . 7 GLY HA3 1 1 25 15469 1 1 7 GLY N N -7.423 -1.423 -2.545 1.00 . A A . 7 GLY N 1 1 25 15470 1 1 7 GLY O O -4.860 -2.117 -3.076 1.00 . A A . 7 GLY O 1 1 25 15471 1 1 8 PRO C C -2.091 -1.051 -2.882 1.00 . A A . 8 PRO C 1 1 25 15472 1 1 8 PRO CA C -2.834 -0.499 -4.097 1.00 . A A . 8 PRO CA 1 1 25 15473 1 1 8 PRO CB C -2.166 0.787 -4.601 1.00 . A A . 8 PRO CB 1 1 25 15474 1 1 8 PRO CD C -4.421 1.348 -4.043 1.00 . A A . 8 PRO CD 1 1 25 15475 1 1 8 PRO CG C -3.290 1.695 -4.967 1.00 . A A . 8 PRO CG 1 1 25 15476 1 1 8 PRO HA H -2.829 -1.241 -4.883 1.00 . A A . 8 PRO HA 1 1 25 15477 1 1 8 PRO HB2 H -1.559 1.209 -3.817 1.00 . A A . 8 PRO HB2 1 1 25 15478 1 1 8 PRO HB3 H -1.548 0.563 -5.459 1.00 . A A . 8 PRO HB3 1 1 25 15479 1 1 8 PRO HD2 H -4.360 1.930 -3.135 1.00 . A A . 8 PRO HD2 1 1 25 15480 1 1 8 PRO HD3 H -5.372 1.505 -4.532 1.00 . A A . 8 PRO HD3 1 1 25 15481 1 1 8 PRO HG2 H -2.992 2.724 -4.824 1.00 . A A . 8 PRO HG2 1 1 25 15482 1 1 8 PRO HG3 H -3.580 1.526 -5.993 1.00 . A A . 8 PRO HG3 1 1 25 15483 1 1 8 PRO N N -4.201 -0.081 -3.769 1.00 . A A . 8 PRO N 1 1 25 15484 1 1 8 PRO O O -1.405 -2.068 -2.973 1.00 . A A . 8 PRO O 1 1 25 15485 1 1 9 CYS C C -2.180 -2.129 -0.023 1.00 . A A . 9 CYS C 1 1 25 15486 1 1 9 CYS CA C -1.583 -0.812 -0.510 1.00 . A A . 9 CYS CA 1 1 25 15487 1 1 9 CYS CB C -1.720 0.261 0.577 1.00 . A A . 9 CYS CB 1 1 25 15488 1 1 9 CYS H H -2.801 0.424 -1.728 1.00 . A A . 9 CYS H 1 1 25 15489 1 1 9 CYS HA H -0.536 -0.963 -0.725 1.00 . A A . 9 CYS HA 1 1 25 15490 1 1 9 CYS HB2 H -2.360 1.050 0.213 1.00 . A A . 9 CYS HB2 1 1 25 15491 1 1 9 CYS HB3 H -2.169 -0.181 1.455 1.00 . A A . 9 CYS HB3 1 1 25 15492 1 1 9 CYS N N -2.237 -0.378 -1.742 1.00 . A A . 9 CYS N 1 1 25 15493 1 1 9 CYS O O -1.483 -2.966 0.550 1.00 . A A . 9 CYS O 1 1 25 15494 1 1 9 CYS SG S -0.142 1.022 1.084 1.00 . A A . 9 CYS SG 1 1 25 15495 1 1 10 CYS C C -3.568 -4.746 -0.522 1.00 . A A . 10 CYS C 1 1 25 15496 1 1 10 CYS CA C -4.176 -3.516 0.146 1.00 . A A . 10 CYS CA 1 1 25 15497 1 1 10 CYS CB C -5.662 -3.410 -0.210 1.00 . A A . 10 CYS CB 1 1 25 15498 1 1 10 CYS H H -3.975 -1.598 -0.723 1.00 . A A . 10 CYS H 1 1 25 15499 1 1 10 CYS HA H -4.077 -3.614 1.217 1.00 . A A . 10 CYS HA 1 1 25 15500 1 1 10 CYS HB2 H -5.858 -2.428 -0.611 1.00 . A A . 10 CYS HB2 1 1 25 15501 1 1 10 CYS HB3 H -5.899 -4.151 -0.960 1.00 . A A . 10 CYS HB3 1 1 25 15502 1 1 10 CYS N N -3.476 -2.303 -0.261 1.00 . A A . 10 CYS N 1 1 25 15503 1 1 10 CYS O O -3.412 -4.788 -1.742 1.00 . A A . 10 CYS O 1 1 25 15504 1 1 10 CYS SG S -6.791 -3.666 1.198 1.00 . A A . 10 CYS SG 1 1 25 15505 1 1 11 ARG C C -3.728 -7.965 -0.670 1.00 . A A . 11 ARG C 1 1 25 15506 1 1 11 ARG CA C -2.645 -6.980 -0.232 1.00 . A A . 11 ARG CA 1 1 25 15507 1 1 11 ARG CB C -1.751 -7.627 0.829 1.00 . A A . 11 ARG CB 1 1 25 15508 1 1 11 ARG CD C 0.344 -8.927 1.317 1.00 . A A . 11 ARG CD 1 1 25 15509 1 1 11 ARG CG C -0.410 -8.098 0.290 1.00 . A A . 11 ARG CG 1 1 25 15510 1 1 11 ARG CZ C 1.655 -11.012 1.369 1.00 . A A . 11 ARG CZ 1 1 25 15511 1 1 11 ARG H H -3.382 -5.657 1.248 1.00 . A A . 11 ARG H 1 1 25 15512 1 1 11 ARG HA H -2.043 -6.725 -1.089 1.00 . A A . 11 ARG HA 1 1 25 15513 1 1 11 ARG HB2 H -1.566 -6.909 1.614 1.00 . A A . 11 ARG HB2 1 1 25 15514 1 1 11 ARG HB3 H -2.265 -8.479 1.248 1.00 . A A . 11 ARG HB3 1 1 25 15515 1 1 11 ARG HD2 H 1.014 -8.279 1.862 1.00 . A A . 11 ARG HD2 1 1 25 15516 1 1 11 ARG HD3 H -0.369 -9.363 2.002 1.00 . A A . 11 ARG HD3 1 1 25 15517 1 1 11 ARG HE H 1.249 -9.956 -0.276 1.00 . A A . 11 ARG HE 1 1 25 15518 1 1 11 ARG HG2 H -0.578 -8.701 -0.590 1.00 . A A . 11 ARG HG2 1 1 25 15519 1 1 11 ARG HG3 H 0.185 -7.235 0.029 1.00 . A A . 11 ARG HG3 1 1 25 15520 1 1 11 ARG HH11 H 0.981 -10.402 3.175 1.00 . A A . 11 ARG HH11 1 1 25 15521 1 1 11 ARG HH12 H 1.906 -11.865 3.184 1.00 . A A . 11 ARG HH12 1 1 25 15522 1 1 11 ARG HH21 H 2.466 -11.882 -0.266 1.00 . A A . 11 ARG HH21 1 1 25 15523 1 1 11 ARG HH22 H 2.749 -12.706 1.231 1.00 . A A . 11 ARG HH22 1 1 25 15524 1 1 11 ARG N N -3.231 -5.747 0.284 1.00 . A A . 11 ARG N 1 1 25 15525 1 1 11 ARG NE N 1.120 -9.997 0.695 1.00 . A A . 11 ARG NE 1 1 25 15526 1 1 11 ARG NH1 N 1.501 -11.100 2.684 1.00 . A A . 11 ARG NH1 1 1 25 15527 1 1 11 ARG NH2 N 2.347 -11.943 0.725 1.00 . A A . 11 ARG NH2 1 1 25 15528 1 1 11 ARG O O -3.437 -8.978 -1.306 1.00 . A A . 11 ARG O 1 1 25 15529 1 1 12 GLN C C -7.360 -8.079 0.084 1.00 . A A . 12 GLN C 1 1 25 15530 1 1 12 GLN CA C -6.110 -8.515 -0.673 1.00 . A A . 12 GLN CA 1 1 25 15531 1 1 12 GLN CB C -5.801 -9.982 -0.361 1.00 . A A . 12 GLN CB 1 1 25 15532 1 1 12 GLN CD C -5.202 -11.613 1.473 1.00 . A A . 12 GLN CD 1 1 25 15533 1 1 12 GLN CG C -5.096 -10.187 0.970 1.00 . A A . 12 GLN CG 1 1 25 15534 1 1 12 GLN H H -5.143 -6.840 0.184 1.00 . A A . 12 GLN H 1 1 25 15535 1 1 12 GLN HA H -6.289 -8.410 -1.733 1.00 . A A . 12 GLN HA 1 1 25 15536 1 1 12 GLN HB2 H -6.728 -10.536 -0.340 1.00 . A A . 12 GLN HB2 1 1 25 15537 1 1 12 GLN HB3 H -5.172 -10.380 -1.143 1.00 . A A . 12 GLN HB3 1 1 25 15538 1 1 12 GLN HE21 H -3.947 -12.231 0.060 1.00 . A A . 12 GLN HE21 1 1 25 15539 1 1 12 GLN HE22 H -4.542 -13.456 1.124 1.00 . A A . 12 GLN HE22 1 1 25 15540 1 1 12 GLN HG2 H -4.051 -9.941 0.851 1.00 . A A . 12 GLN HG2 1 1 25 15541 1 1 12 GLN HG3 H -5.538 -9.528 1.703 1.00 . A A . 12 GLN HG3 1 1 25 15542 1 1 12 GLN N N -4.977 -7.661 -0.323 1.00 . A A . 12 GLN N 1 1 25 15543 1 1 12 GLN NE2 N -4.492 -12.525 0.820 1.00 . A A . 12 GLN NE2 1 1 25 15544 1 1 12 GLN O O -8.482 -8.255 -0.393 1.00 . A A . 12 GLN O 1 1 25 15545 1 1 12 GLN OE1 O -5.913 -11.892 2.438 1.00 . A A . 12 GLN OE1 1 1 25 15546 1 1 13 CYS C C -7.757 -6.220 3.279 1.00 . A A . 13 CYS C 1 1 25 15547 1 1 13 CYS CA C -8.263 -7.040 2.094 1.00 . A A . 13 CYS CA 1 1 25 15548 1 1 13 CYS CB C -9.091 -8.224 2.596 1.00 . A A . 13 CYS CB 1 1 25 15549 1 1 13 CYS H H -6.239 -7.393 1.588 1.00 . A A . 13 CYS H 1 1 25 15550 1 1 13 CYS HA H -8.890 -6.411 1.481 1.00 . A A . 13 CYS HA 1 1 25 15551 1 1 13 CYS HB2 H -9.457 -8.784 1.748 1.00 . A A . 13 CYS HB2 1 1 25 15552 1 1 13 CYS HB3 H -8.463 -8.863 3.199 1.00 . A A . 13 CYS HB3 1 1 25 15553 1 1 13 CYS N N -7.156 -7.506 1.266 1.00 . A A . 13 CYS N 1 1 25 15554 1 1 13 CYS O O -8.424 -5.288 3.727 1.00 . A A . 13 CYS O 1 1 25 15555 1 1 13 CYS SG S -10.530 -7.746 3.607 1.00 . A A . 13 CYS SG 1 1 25 15556 1 1 14 LYS C C -4.805 -5.018 4.464 1.00 . A A . 14 LYS C 1 1 25 15557 1 1 14 LYS CA C -5.994 -5.857 4.915 1.00 . A A . 14 LYS CA 1 1 25 15558 1 1 14 LYS CB C -5.556 -6.845 5.998 1.00 . A A . 14 LYS CB 1 1 25 15559 1 1 14 LYS CD C -6.090 -7.901 8.214 1.00 . A A . 14 LYS CD 1 1 25 15560 1 1 14 LYS CE C -5.310 -6.968 9.127 1.00 . A A . 14 LYS CE 1 1 25 15561 1 1 14 LYS CG C -6.647 -7.162 7.008 1.00 . A A . 14 LYS CG 1 1 25 15562 1 1 14 LYS H H -6.086 -7.319 3.391 1.00 . A A . 14 LYS H 1 1 25 15563 1 1 14 LYS HA H -6.750 -5.202 5.321 1.00 . A A . 14 LYS HA 1 1 25 15564 1 1 14 LYS HB2 H -5.253 -7.768 5.526 1.00 . A A . 14 LYS HB2 1 1 25 15565 1 1 14 LYS HB3 H -4.713 -6.429 6.529 1.00 . A A . 14 LYS HB3 1 1 25 15566 1 1 14 LYS HD2 H -6.910 -8.330 8.771 1.00 . A A . 14 LYS HD2 1 1 25 15567 1 1 14 LYS HD3 H -5.435 -8.688 7.872 1.00 . A A . 14 LYS HD3 1 1 25 15568 1 1 14 LYS HE2 H -4.906 -6.161 8.534 1.00 . A A . 14 LYS HE2 1 1 25 15569 1 1 14 LYS HE3 H -5.982 -6.567 9.870 1.00 . A A . 14 LYS HE3 1 1 25 15570 1 1 14 LYS HG2 H -7.097 -6.239 7.340 1.00 . A A . 14 LYS HG2 1 1 25 15571 1 1 14 LYS HG3 H -7.396 -7.779 6.533 1.00 . A A . 14 LYS HG3 1 1 25 15572 1 1 14 LYS HZ1 H -3.732 -8.337 9.160 1.00 . A A . 14 LYS HZ1 1 1 25 15573 1 1 14 LYS HZ2 H -3.484 -6.982 10.141 1.00 . A A . 14 LYS HZ2 1 1 25 15574 1 1 14 LYS HZ3 H -4.551 -8.200 10.633 1.00 . A A . 14 LYS HZ3 1 1 25 15575 1 1 14 LYS N N -6.577 -6.569 3.785 1.00 . A A . 14 LYS N 1 1 25 15576 1 1 14 LYS NZ N -4.191 -7.671 9.813 1.00 . A A . 14 LYS NZ 1 1 25 15577 1 1 14 LYS O O -3.921 -5.506 3.759 1.00 . A A . 14 LYS O 1 1 25 15578 1 1 15 LEU C C -2.345 -3.498 4.728 1.00 . A A . 15 LEU C 1 1 25 15579 1 1 15 LEU CA C -3.704 -2.843 4.512 1.00 . A A . 15 LEU CA 1 1 25 15580 1 1 15 LEU CB C -3.797 -1.551 5.328 1.00 . A A . 15 LEU CB 1 1 25 15581 1 1 15 LEU CD1 C -3.489 -0.842 7.717 1.00 . A A . 15 LEU CD1 1 1 25 15582 1 1 15 LEU CD2 C -5.772 -1.407 6.866 1.00 . A A . 15 LEU CD2 1 1 25 15583 1 1 15 LEU CG C -4.287 -1.724 6.769 1.00 . A A . 15 LEU CG 1 1 25 15584 1 1 15 LEU H H -5.522 -3.423 5.434 1.00 . A A . 15 LEU H 1 1 25 15585 1 1 15 LEU HA H -3.809 -2.603 3.465 1.00 . A A . 15 LEU HA 1 1 25 15586 1 1 15 LEU HB2 H -2.816 -1.097 5.354 1.00 . A A . 15 LEU HB2 1 1 25 15587 1 1 15 LEU HB3 H -4.472 -0.878 4.821 1.00 . A A . 15 LEU HB3 1 1 25 15588 1 1 15 LEU HD11 H -2.557 -0.561 7.250 1.00 . A A . 15 LEU HD11 1 1 25 15589 1 1 15 LEU HD12 H -4.058 0.047 7.947 1.00 . A A . 15 LEU HD12 1 1 25 15590 1 1 15 LEU HD13 H -3.286 -1.385 8.628 1.00 . A A . 15 LEU HD13 1 1 25 15591 1 1 15 LEU HD21 H -6.226 -1.504 5.890 1.00 . A A . 15 LEU HD21 1 1 25 15592 1 1 15 LEU HD22 H -6.243 -2.097 7.551 1.00 . A A . 15 LEU HD22 1 1 25 15593 1 1 15 LEU HD23 H -5.902 -0.397 7.225 1.00 . A A . 15 LEU HD23 1 1 25 15594 1 1 15 LEU HG H -4.143 -2.752 7.069 1.00 . A A . 15 LEU HG 1 1 25 15595 1 1 15 LEU N N -4.788 -3.753 4.874 1.00 . A A . 15 LEU N 1 1 25 15596 1 1 15 LEU O O -1.989 -3.858 5.851 1.00 . A A . 15 LEU O 1 1 25 15597 1 1 16 LYS C C 0.552 -3.686 4.857 1.00 . A A . 16 LYS C 1 1 25 15598 1 1 16 LYS CA C -0.271 -4.271 3.709 1.00 . A A . 16 LYS CA 1 1 25 15599 1 1 16 LYS CB C 0.473 -4.075 2.387 1.00 . A A . 16 LYS CB 1 1 25 15600 1 1 16 LYS CD C 0.832 -4.824 0.015 1.00 . A A . 16 LYS CD 1 1 25 15601 1 1 16 LYS CE C -0.076 -5.052 -1.182 1.00 . A A . 16 LYS CE 1 1 25 15602 1 1 16 LYS CG C 0.110 -5.099 1.324 1.00 . A A . 16 LYS CG 1 1 25 15603 1 1 16 LYS H H -1.933 -3.349 2.777 1.00 . A A . 16 LYS H 1 1 25 15604 1 1 16 LYS HA H -0.411 -5.329 3.881 1.00 . A A . 16 LYS HA 1 1 25 15605 1 1 16 LYS HB2 H 0.245 -3.092 2.001 1.00 . A A . 16 LYS HB2 1 1 25 15606 1 1 16 LYS HB3 H 1.535 -4.141 2.571 1.00 . A A . 16 LYS HB3 1 1 25 15607 1 1 16 LYS HD2 H 1.168 -3.798 0.009 1.00 . A A . 16 LYS HD2 1 1 25 15608 1 1 16 LYS HD3 H 1.684 -5.484 -0.060 1.00 . A A . 16 LYS HD3 1 1 25 15609 1 1 16 LYS HE2 H 0.105 -6.043 -1.572 1.00 . A A . 16 LYS HE2 1 1 25 15610 1 1 16 LYS HE3 H -1.104 -4.976 -0.857 1.00 . A A . 16 LYS HE3 1 1 25 15611 1 1 16 LYS HG2 H 0.385 -6.082 1.676 1.00 . A A . 16 LYS HG2 1 1 25 15612 1 1 16 LYS HG3 H -0.956 -5.062 1.152 1.00 . A A . 16 LYS HG3 1 1 25 15613 1 1 16 LYS HZ1 H 1.179 -3.821 -2.311 1.00 . A A . 16 LYS HZ1 1 1 25 15614 1 1 16 LYS HZ2 H -0.135 -4.442 -3.179 1.00 . A A . 16 LYS HZ2 1 1 25 15615 1 1 16 LYS HZ3 H -0.370 -3.185 -2.072 1.00 . A A . 16 LYS HZ3 1 1 25 15616 1 1 16 LYS N N -1.591 -3.654 3.644 1.00 . A A . 16 LYS N 1 1 25 15617 1 1 16 LYS NZ N 0.166 -4.055 -2.261 1.00 . A A . 16 LYS NZ 1 1 25 15618 1 1 16 LYS O O 0.418 -2.509 5.188 1.00 . A A . 16 LYS O 1 1 25 15619 1 1 17 PRO C C 3.172 -2.902 6.203 1.00 . A A . 17 PRO C 1 1 25 15620 1 1 17 PRO CA C 2.260 -4.058 6.595 1.00 . A A . 17 PRO CA 1 1 25 15621 1 1 17 PRO CB C 3.093 -5.299 6.946 1.00 . A A . 17 PRO CB 1 1 25 15622 1 1 17 PRO CD C 1.643 -5.919 5.151 1.00 . A A . 17 PRO CD 1 1 25 15623 1 1 17 PRO CG C 2.988 -6.193 5.758 1.00 . A A . 17 PRO CG 1 1 25 15624 1 1 17 PRO HA H 1.664 -3.769 7.448 1.00 . A A . 17 PRO HA 1 1 25 15625 1 1 17 PRO HB2 H 4.116 -5.005 7.129 1.00 . A A . 17 PRO HB2 1 1 25 15626 1 1 17 PRO HB3 H 2.685 -5.769 7.829 1.00 . A A . 17 PRO HB3 1 1 25 15627 1 1 17 PRO HD2 H 1.672 -6.069 4.082 1.00 . A A . 17 PRO HD2 1 1 25 15628 1 1 17 PRO HD3 H 0.889 -6.546 5.604 1.00 . A A . 17 PRO HD3 1 1 25 15629 1 1 17 PRO HG2 H 3.772 -5.960 5.052 1.00 . A A . 17 PRO HG2 1 1 25 15630 1 1 17 PRO HG3 H 3.056 -7.225 6.068 1.00 . A A . 17 PRO HG3 1 1 25 15631 1 1 17 PRO N N 1.417 -4.504 5.480 1.00 . A A . 17 PRO N 1 1 25 15632 1 1 17 PRO O O 3.843 -2.949 5.172 1.00 . A A . 17 PRO O 1 1 25 15633 1 1 18 ALA C C 5.452 -1.102 6.414 1.00 . A A . 18 ALA C 1 1 25 15634 1 1 18 ALA CA C 4.029 -0.693 6.780 1.00 . A A . 18 ALA CA 1 1 25 15635 1 1 18 ALA CB C 4.038 0.223 7.995 1.00 . A A . 18 ALA CB 1 1 25 15636 1 1 18 ALA H H 2.640 -1.885 7.842 1.00 . A A . 18 ALA H 1 1 25 15637 1 1 18 ALA HA H 3.596 -0.150 5.952 1.00 . A A . 18 ALA HA 1 1 25 15638 1 1 18 ALA HB1 H 4.576 -0.253 8.801 1.00 . A A . 18 ALA HB1 1 1 25 15639 1 1 18 ALA HB2 H 3.022 0.418 8.306 1.00 . A A . 18 ALA HB2 1 1 25 15640 1 1 18 ALA HB3 H 4.521 1.155 7.740 1.00 . A A . 18 ALA HB3 1 1 25 15641 1 1 18 ALA N N 3.195 -1.863 7.036 1.00 . A A . 18 ALA N 1 1 25 15642 1 1 18 ALA O O 5.852 -2.247 6.625 1.00 . A A . 18 ALA O 1 1 25 15643 1 1 19 GLY C C 7.652 -1.456 4.328 1.00 . A A . 19 GLY C 1 1 25 15644 1 1 19 GLY CA C 7.575 -0.455 5.467 1.00 . A A . 19 GLY CA 1 1 25 15645 1 1 19 GLY H H 5.837 0.730 5.709 1.00 . A A . 19 GLY H 1 1 25 15646 1 1 19 GLY HA2 H 8.105 -0.854 6.318 1.00 . A A . 19 GLY HA2 1 1 25 15647 1 1 19 GLY HA3 H 8.052 0.464 5.157 1.00 . A A . 19 GLY HA3 1 1 25 15648 1 1 19 GLY N N 6.209 -0.164 5.858 1.00 . A A . 19 GLY N 1 1 25 15649 1 1 19 GLY O O 8.719 -1.997 4.041 1.00 . A A . 19 GLY O 1 1 25 15650 1 1 20 THR C C 5.957 -1.945 1.304 1.00 . A A . 20 THR C 1 1 25 15651 1 1 20 THR CA C 6.462 -2.640 2.562 1.00 . A A . 20 THR CA 1 1 25 15652 1 1 20 THR CB C 5.556 -3.823 2.908 1.00 . A A . 20 THR CB 1 1 25 15653 1 1 20 THR CG2 C 5.460 -4.850 1.800 1.00 . A A . 20 THR CG2 1 1 25 15654 1 1 20 THR H H 5.697 -1.238 3.948 1.00 . A A . 20 THR H 1 1 25 15655 1 1 20 THR HA H 7.463 -3.004 2.383 1.00 . A A . 20 THR HA 1 1 25 15656 1 1 20 THR HB H 4.559 -3.454 3.105 1.00 . A A . 20 THR HB 1 1 25 15657 1 1 20 THR HG1 H 5.448 -5.233 4.264 1.00 . A A . 20 THR HG1 1 1 25 15658 1 1 20 THR HG21 H 5.738 -4.394 0.862 1.00 . A A . 20 THR HG21 1 1 25 15659 1 1 20 THR HG22 H 6.126 -5.673 2.013 1.00 . A A . 20 THR HG22 1 1 25 15660 1 1 20 THR HG23 H 4.446 -5.216 1.736 1.00 . A A . 20 THR HG23 1 1 25 15661 1 1 20 THR N N 6.517 -1.702 3.676 1.00 . A A . 20 THR N 1 1 25 15662 1 1 20 THR O O 4.880 -1.348 1.303 1.00 . A A . 20 THR O 1 1 25 15663 1 1 20 THR OG1 O 6.021 -4.487 4.070 1.00 . A A . 20 THR OG1 1 1 25 15664 1 1 21 THR C C 4.936 -1.715 -1.421 1.00 . A A . 21 THR C 1 1 25 15665 1 1 21 THR CA C 6.376 -1.387 -1.030 1.00 . A A . 21 THR CA 1 1 25 15666 1 1 21 THR CB C 7.334 -1.820 -2.140 1.00 . A A . 21 THR CB 1 1 25 15667 1 1 21 THR CG2 C 7.162 -3.264 -2.548 1.00 . A A . 21 THR CG2 1 1 25 15668 1 1 21 THR H H 7.591 -2.504 0.297 1.00 . A A . 21 THR H 1 1 25 15669 1 1 21 THR HA H 6.461 -0.323 -0.898 1.00 . A A . 21 THR HA 1 1 25 15670 1 1 21 THR HB H 8.350 -1.693 -1.795 1.00 . A A . 21 THR HB 1 1 25 15671 1 1 21 THR HG1 H 7.338 -0.105 -3.085 1.00 . A A . 21 THR HG1 1 1 25 15672 1 1 21 THR HG21 H 6.587 -3.782 -1.795 1.00 . A A . 21 THR HG21 1 1 25 15673 1 1 21 THR HG22 H 6.644 -3.310 -3.494 1.00 . A A . 21 THR HG22 1 1 25 15674 1 1 21 THR HG23 H 8.132 -3.728 -2.644 1.00 . A A . 21 THR HG23 1 1 25 15675 1 1 21 THR N N 6.742 -2.019 0.234 1.00 . A A . 21 THR N 1 1 25 15676 1 1 21 THR O O 4.563 -2.882 -1.535 1.00 . A A . 21 THR O 1 1 25 15677 1 1 21 THR OG1 O 7.155 -1.023 -3.297 1.00 . A A . 21 THR OG1 1 1 25 15678 1 1 22 CYS C C 2.535 -0.517 -3.482 1.00 . A A . 22 CYS C 1 1 25 15679 1 1 22 CYS CA C 2.739 -0.851 -2.012 1.00 . A A . 22 CYS CA 1 1 25 15680 1 1 22 CYS CB C 1.825 0.030 -1.158 1.00 . A A . 22 CYS CB 1 1 25 15681 1 1 22 CYS H H 4.493 0.231 -1.527 1.00 . A A . 22 CYS H 1 1 25 15682 1 1 22 CYS HA H 2.479 -1.887 -1.851 1.00 . A A . 22 CYS HA 1 1 25 15683 1 1 22 CYS HB2 H 0.854 0.084 -1.625 1.00 . A A . 22 CYS HB2 1 1 25 15684 1 1 22 CYS HB3 H 1.722 -0.416 -0.181 1.00 . A A . 22 CYS HB3 1 1 25 15685 1 1 22 CYS N N 4.135 -0.675 -1.629 1.00 . A A . 22 CYS N 1 1 25 15686 1 1 22 CYS O O 1.472 -0.039 -3.877 1.00 . A A . 22 CYS O 1 1 25 15687 1 1 22 CYS SG S 2.420 1.738 -0.930 1.00 . A A . 22 CYS SG 1 1 25 15688 1 1 23 TRP C C 4.705 -0.978 -6.457 1.00 . A A . 23 TRP C 1 1 25 15689 1 1 23 TRP CA C 3.474 -0.478 -5.713 1.00 . A A . 23 TRP CA 1 1 25 15690 1 1 23 TRP CB C 3.307 1.026 -5.933 1.00 . A A . 23 TRP CB 1 1 25 15691 1 1 23 TRP CD1 C 1.729 0.497 -7.876 1.00 . A A . 23 TRP CD1 1 1 25 15692 1 1 23 TRP CD2 C 1.801 2.660 -7.314 1.00 . A A . 23 TRP CD2 1 1 25 15693 1 1 23 TRP CE2 C 0.905 2.505 -8.386 1.00 . A A . 23 TRP CE2 1 1 25 15694 1 1 23 TRP CE3 C 2.009 3.937 -6.789 1.00 . A A . 23 TRP CE3 1 1 25 15695 1 1 23 TRP CG C 2.316 1.363 -7.002 1.00 . A A . 23 TRP CG 1 1 25 15696 1 1 23 TRP CH2 C 0.443 4.817 -8.411 1.00 . A A . 23 TRP CH2 1 1 25 15697 1 1 23 TRP CZ2 C 0.220 3.578 -8.943 1.00 . A A . 23 TRP CZ2 1 1 25 15698 1 1 23 TRP CZ3 C 1.329 5.003 -7.344 1.00 . A A . 23 TRP CZ3 1 1 25 15699 1 1 23 TRP H H 4.383 -1.143 -3.921 1.00 . A A . 23 TRP H 1 1 25 15700 1 1 23 TRP HA H 2.608 -0.985 -6.100 1.00 . A A . 23 TRP HA 1 1 25 15701 1 1 23 TRP HB2 H 2.971 1.482 -5.014 1.00 . A A . 23 TRP HB2 1 1 25 15702 1 1 23 TRP HB3 H 4.259 1.452 -6.213 1.00 . A A . 23 TRP HB3 1 1 25 15703 1 1 23 TRP HD1 H 1.918 -0.564 -7.896 1.00 . A A . 23 TRP HD1 1 1 25 15704 1 1 23 TRP HE1 H 0.342 0.776 -9.427 1.00 . A A . 23 TRP HE1 1 1 25 15705 1 1 23 TRP HE3 H 2.687 4.098 -5.965 1.00 . A A . 23 TRP HE3 1 1 25 15706 1 1 23 TRP HH2 H -0.063 5.678 -8.817 1.00 . A A . 23 TRP HH2 1 1 25 15707 1 1 23 TRP HZ2 H -0.469 3.451 -9.762 1.00 . A A . 23 TRP HZ2 1 1 25 15708 1 1 23 TRP HZ3 H 1.479 5.999 -6.954 1.00 . A A . 23 TRP HZ3 1 1 25 15709 1 1 23 TRP N N 3.558 -0.765 -4.290 1.00 . A A . 23 TRP N 1 1 25 15710 1 1 23 TRP NE1 N 0.879 1.177 -8.713 1.00 . A A . 23 TRP NE1 1 1 25 15711 1 1 23 TRP O O 4.636 -1.944 -7.217 1.00 . A A . 23 TRP O 1 1 25 15712 1 1 24 LYS C C 6.938 -0.556 -8.411 1.00 . A A . 24 LYS C 1 1 25 15713 1 1 24 LYS CA C 7.074 -0.672 -6.895 1.00 . A A . 24 LYS CA 1 1 25 15714 1 1 24 LYS CB C 7.479 -2.097 -6.513 1.00 . A A . 24 LYS CB 1 1 25 15715 1 1 24 LYS CD C 9.050 -3.890 -7.307 1.00 . A A . 24 LYS CD 1 1 25 15716 1 1 24 LYS CE C 8.709 -4.066 -8.778 1.00 . A A . 24 LYS CE 1 1 25 15717 1 1 24 LYS CG C 8.915 -2.439 -6.874 1.00 . A A . 24 LYS CG 1 1 25 15718 1 1 24 LYS H H 5.812 0.455 -5.628 1.00 . A A . 24 LYS H 1 1 25 15719 1 1 24 LYS HA H 7.838 0.013 -6.560 1.00 . A A . 24 LYS HA 1 1 25 15720 1 1 24 LYS HB2 H 7.360 -2.217 -5.447 1.00 . A A . 24 LYS HB2 1 1 25 15721 1 1 24 LYS HB3 H 6.827 -2.792 -7.021 1.00 . A A . 24 LYS HB3 1 1 25 15722 1 1 24 LYS HD2 H 10.067 -4.212 -7.143 1.00 . A A . 24 LYS HD2 1 1 25 15723 1 1 24 LYS HD3 H 8.379 -4.496 -6.716 1.00 . A A . 24 LYS HD3 1 1 25 15724 1 1 24 LYS HE2 H 8.924 -3.144 -9.298 1.00 . A A . 24 LYS HE2 1 1 25 15725 1 1 24 LYS HE3 H 9.322 -4.858 -9.184 1.00 . A A . 24 LYS HE3 1 1 25 15726 1 1 24 LYS HG2 H 9.234 -1.801 -7.685 1.00 . A A . 24 LYS HG2 1 1 25 15727 1 1 24 LYS HG3 H 9.543 -2.270 -6.012 1.00 . A A . 24 LYS HG3 1 1 25 15728 1 1 24 LYS HZ1 H 6.962 -5.079 -8.246 1.00 . A A . 24 LYS HZ1 1 1 25 15729 1 1 24 LYS HZ2 H 6.690 -3.553 -8.925 1.00 . A A . 24 LYS HZ2 1 1 25 15730 1 1 24 LYS HZ3 H 7.140 -4.850 -9.912 1.00 . A A . 24 LYS HZ3 1 1 25 15731 1 1 24 LYS N N 5.826 -0.308 -6.239 1.00 . A A . 24 LYS N 1 1 25 15732 1 1 24 LYS NZ N 7.275 -4.411 -8.979 1.00 . A A . 24 LYS NZ 1 1 25 15733 1 1 24 LYS O O 7.644 -1.229 -9.161 1.00 . A A . 24 LYS O 1 1 25 15734 1 1 25 THR C C 7.078 0.956 -10.974 1.00 . A A . 25 THR C 1 1 25 15735 1 1 25 THR CA C 5.795 0.511 -10.280 1.00 . A A . 25 THR CA 1 1 25 15736 1 1 25 THR CB C 4.689 1.549 -10.498 1.00 . A A . 25 THR CB 1 1 25 15737 1 1 25 THR CG2 C 4.191 1.605 -11.926 1.00 . A A . 25 THR CG2 1 1 25 15738 1 1 25 THR H H 5.492 0.814 -8.208 1.00 . A A . 25 THR H 1 1 25 15739 1 1 25 THR HA H 5.480 -0.431 -10.703 1.00 . A A . 25 THR HA 1 1 25 15740 1 1 25 THR HB H 5.067 2.528 -10.243 1.00 . A A . 25 THR HB 1 1 25 15741 1 1 25 THR HG1 H 3.164 0.453 -9.948 1.00 . A A . 25 THR HG1 1 1 25 15742 1 1 25 THR HG21 H 5.017 1.445 -12.602 1.00 . A A . 25 THR HG21 1 1 25 15743 1 1 25 THR HG22 H 3.447 0.838 -12.077 1.00 . A A . 25 THR HG22 1 1 25 15744 1 1 25 THR HG23 H 3.753 2.574 -12.115 1.00 . A A . 25 THR HG23 1 1 25 15745 1 1 25 THR N N 6.024 0.305 -8.855 1.00 . A A . 25 THR N 1 1 25 15746 1 1 25 THR O O 7.774 1.852 -10.497 1.00 . A A . 25 THR O 1 1 25 15747 1 1 25 THR OG1 O 3.576 1.274 -9.669 1.00 . A A . 25 THR OG1 1 1 25 15748 1 1 26 SER C C 8.725 2.156 -13.060 1.00 . A A . 26 SER C 1 1 25 15749 1 1 26 SER CA C 8.589 0.649 -12.863 1.00 . A A . 26 SER CA 1 1 25 15750 1 1 26 SER CB C 8.563 -0.053 -14.222 1.00 . A A . 26 SER CB 1 1 25 15751 1 1 26 SER H H 6.792 -0.386 -12.429 1.00 . A A . 26 SER H 1 1 25 15752 1 1 26 SER HA H 9.441 0.294 -12.303 1.00 . A A . 26 SER HA 1 1 25 15753 1 1 26 SER HB2 H 7.577 0.038 -14.653 1.00 . A A . 26 SER HB2 1 1 25 15754 1 1 26 SER HB3 H 9.286 0.409 -14.878 1.00 . A A . 26 SER HB3 1 1 25 15755 1 1 26 SER HG H 8.071 -1.948 -14.143 1.00 . A A . 26 SER HG 1 1 25 15756 1 1 26 SER N N 7.387 0.321 -12.102 1.00 . A A . 26 SER N 1 1 25 15757 1 1 26 SER O O 9.832 2.677 -13.199 1.00 . A A . 26 SER O 1 1 25 15758 1 1 26 SER OG O 8.877 -1.429 -14.092 1.00 . A A . 26 SER OG 1 1 25 15759 1 1 27 VAL C C 7.516 5.027 -11.914 1.00 . A A . 27 VAL C 1 1 25 15760 1 1 27 VAL CA C 7.586 4.297 -13.253 1.00 . A A . 27 VAL CA 1 1 25 15761 1 1 27 VAL CB C 6.401 4.747 -14.132 1.00 . A A . 27 VAL CB 1 1 25 15762 1 1 27 VAL CG1 C 5.076 4.389 -13.474 1.00 . A A . 27 VAL CG1 1 1 25 15763 1 1 27 VAL CG2 C 6.478 6.241 -14.410 1.00 . A A . 27 VAL CG2 1 1 25 15764 1 1 27 VAL H H 6.740 2.381 -12.958 1.00 . A A . 27 VAL H 1 1 25 15765 1 1 27 VAL HA H 8.502 4.573 -13.754 1.00 . A A . 27 VAL HA 1 1 25 15766 1 1 27 VAL HB H 6.461 4.224 -15.075 1.00 . A A . 27 VAL HB 1 1 25 15767 1 1 27 VAL HG11 H 5.112 4.648 -12.426 1.00 . A A . 27 VAL HG11 1 1 25 15768 1 1 27 VAL HG12 H 4.277 4.935 -13.953 1.00 . A A . 27 VAL HG12 1 1 25 15769 1 1 27 VAL HG13 H 4.899 3.328 -13.576 1.00 . A A . 27 VAL HG13 1 1 25 15770 1 1 27 VAL HG21 H 7.487 6.503 -14.692 1.00 . A A . 27 VAL HG21 1 1 25 15771 1 1 27 VAL HG22 H 5.802 6.493 -15.214 1.00 . A A . 27 VAL HG22 1 1 25 15772 1 1 27 VAL HG23 H 6.200 6.788 -13.521 1.00 . A A . 27 VAL HG23 1 1 25 15773 1 1 27 VAL N N 7.592 2.851 -13.072 1.00 . A A . 27 VAL N 1 1 25 15774 1 1 27 VAL O O 7.889 6.196 -11.818 1.00 . A A . 27 VAL O 1 1 25 15775 1 1 28 SER C C 6.826 3.898 -8.459 1.00 . A A . 28 SER C 1 1 25 15776 1 1 28 SER CA C 6.904 4.950 -9.564 1.00 . A A . 28 SER CA 1 1 25 15777 1 1 28 SER CB C 5.661 5.839 -9.518 1.00 . A A . 28 SER CB 1 1 25 15778 1 1 28 SER H H 6.734 3.416 -11.015 1.00 . A A . 28 SER H 1 1 25 15779 1 1 28 SER HA H 7.777 5.562 -9.400 1.00 . A A . 28 SER HA 1 1 25 15780 1 1 28 SER HB2 H 5.437 6.192 -10.513 1.00 . A A . 28 SER HB2 1 1 25 15781 1 1 28 SER HB3 H 4.824 5.265 -9.144 1.00 . A A . 28 SER HB3 1 1 25 15782 1 1 28 SER HG H 6.378 6.695 -7.906 1.00 . A A . 28 SER HG 1 1 25 15783 1 1 28 SER N N 7.026 4.341 -10.884 1.00 . A A . 28 SER N 1 1 25 15784 1 1 28 SER O O 5.825 3.195 -8.326 1.00 . A A . 28 SER O 1 1 25 15785 1 1 28 SER OG O 5.863 6.959 -8.672 1.00 . A A . 28 SER OG 1 1 25 15786 1 1 29 SER C C 7.560 3.553 -5.243 1.00 . A A . 29 SER C 1 1 25 15787 1 1 29 SER CA C 7.926 2.857 -6.550 1.00 . A A . 29 SER CA 1 1 25 15788 1 1 29 SER CB C 9.316 2.229 -6.440 1.00 . A A . 29 SER CB 1 1 25 15789 1 1 29 SER H H 8.646 4.406 -7.804 1.00 . A A . 29 SER H 1 1 25 15790 1 1 29 SER HA H 7.200 2.082 -6.750 1.00 . A A . 29 SER HA 1 1 25 15791 1 1 29 SER HB2 H 10.018 2.970 -6.089 1.00 . A A . 29 SER HB2 1 1 25 15792 1 1 29 SER HB3 H 9.282 1.406 -5.740 1.00 . A A . 29 SER HB3 1 1 25 15793 1 1 29 SER HG H 9.697 0.784 -7.707 1.00 . A A . 29 SER HG 1 1 25 15794 1 1 29 SER N N 7.883 3.809 -7.657 1.00 . A A . 29 SER N 1 1 25 15795 1 1 29 SER O O 8.054 4.642 -4.951 1.00 . A A . 29 SER O 1 1 25 15796 1 1 29 SER OG O 9.757 1.742 -7.696 1.00 . A A . 29 SER OG 1 1 25 15797 1 1 30 HIS C C 6.274 2.475 -2.077 1.00 . A A . 30 HIS C 1 1 25 15798 1 1 30 HIS CA C 6.241 3.507 -3.199 1.00 . A A . 30 HIS CA 1 1 25 15799 1 1 30 HIS CB C 4.828 4.068 -3.346 1.00 . A A . 30 HIS CB 1 1 25 15800 1 1 30 HIS CD2 C 4.958 4.869 -5.808 1.00 . A A . 30 HIS CD2 1 1 25 15801 1 1 30 HIS CE1 C 4.135 6.880 -5.537 1.00 . A A . 30 HIS CE1 1 1 25 15802 1 1 30 HIS CG C 4.673 5.017 -4.493 1.00 . A A . 30 HIS CG 1 1 25 15803 1 1 30 HIS H H 6.310 2.067 -4.752 1.00 . A A . 30 HIS H 1 1 25 15804 1 1 30 HIS HA H 6.915 4.312 -2.951 1.00 . A A . 30 HIS HA 1 1 25 15805 1 1 30 HIS HB2 H 4.142 3.249 -3.502 1.00 . A A . 30 HIS HB2 1 1 25 15806 1 1 30 HIS HB3 H 4.558 4.591 -2.440 1.00 . A A . 30 HIS HB3 1 1 25 15807 1 1 30 HIS HD1 H 3.858 6.696 -3.518 1.00 . A A . 30 HIS HD1 1 1 25 15808 1 1 30 HIS HD2 H 5.375 3.989 -6.278 1.00 . A A . 30 HIS HD2 1 1 25 15809 1 1 30 HIS HE1 H 3.783 7.881 -5.735 1.00 . A A . 30 HIS HE1 1 1 25 15810 1 1 30 HIS HE2 H 4.539 6.161 -7.403 1.00 . A A . 30 HIS HE2 1 1 25 15811 1 1 30 HIS N N 6.680 2.929 -4.465 1.00 . A A . 30 HIS N 1 1 25 15812 1 1 30 HIS ND1 N 4.160 6.288 -4.356 1.00 . A A . 30 HIS ND1 1 1 25 15813 1 1 30 HIS NE2 N 4.614 6.041 -6.435 1.00 . A A . 30 HIS NE2 1 1 25 15814 1 1 30 HIS O O 6.516 1.293 -2.317 1.00 . A A . 30 HIS O 1 1 25 15815 1 1 31 TYR C C 4.762 2.244 1.150 1.00 . A A . 31 TYR C 1 1 25 15816 1 1 31 TYR CA C 6.027 2.056 0.316 1.00 . A A . 31 TYR CA 1 1 25 15817 1 1 31 TYR CB C 7.266 2.322 1.177 1.00 . A A . 31 TYR CB 1 1 25 15818 1 1 31 TYR CD1 C 8.882 0.715 2.264 1.00 . A A . 31 TYR CD1 1 1 25 15819 1 1 31 TYR CD2 C 8.700 0.693 -0.113 1.00 . A A . 31 TYR CD2 1 1 25 15820 1 1 31 TYR CE1 C 9.830 -0.289 2.204 1.00 . A A . 31 TYR CE1 1 1 25 15821 1 1 31 TYR CE2 C 9.646 -0.312 -0.180 1.00 . A A . 31 TYR CE2 1 1 25 15822 1 1 31 TYR CG C 8.302 1.223 1.108 1.00 . A A . 31 TYR CG 1 1 25 15823 1 1 31 TYR CZ C 10.207 -0.800 0.981 1.00 . A A . 31 TYR CZ 1 1 25 15824 1 1 31 TYR H H 5.840 3.889 -0.728 1.00 . A A . 31 TYR H 1 1 25 15825 1 1 31 TYR HA H 6.059 1.040 -0.036 1.00 . A A . 31 TYR HA 1 1 25 15826 1 1 31 TYR HB2 H 7.733 3.238 0.848 1.00 . A A . 31 TYR HB2 1 1 25 15827 1 1 31 TYR HB3 H 6.964 2.430 2.209 1.00 . A A . 31 TYR HB3 1 1 25 15828 1 1 31 TYR HD1 H 8.584 1.117 3.221 1.00 . A A . 31 TYR HD1 1 1 25 15829 1 1 31 TYR HD2 H 8.260 1.077 -1.020 1.00 . A A . 31 TYR HD2 1 1 25 15830 1 1 31 TYR HE1 H 10.269 -0.670 3.114 1.00 . A A . 31 TYR HE1 1 1 25 15831 1 1 31 TYR HE2 H 9.941 -0.712 -1.140 1.00 . A A . 31 TYR HE2 1 1 25 15832 1 1 31 TYR HH H 10.782 -2.610 1.277 1.00 . A A . 31 TYR HH 1 1 25 15833 1 1 31 TYR N N 6.027 2.934 -0.850 1.00 . A A . 31 TYR N 1 1 25 15834 1 1 31 TYR O O 4.316 3.369 1.374 1.00 . A A . 31 TYR O 1 1 25 15835 1 1 31 TYR OH O 11.150 -1.800 0.918 1.00 . A A . 31 TYR OH 1 1 25 15836 1 1 32 CYS C C 3.313 1.612 3.851 1.00 . A A . 32 CYS C 1 1 25 15837 1 1 32 CYS CA C 2.982 1.179 2.428 1.00 . A A . 32 CYS CA 1 1 25 15838 1 1 32 CYS CB C 2.298 -0.191 2.447 1.00 . A A . 32 CYS CB 1 1 25 15839 1 1 32 CYS H H 4.594 0.264 1.407 1.00 . A A . 32 CYS H 1 1 25 15840 1 1 32 CYS HA H 2.313 1.902 1.990 1.00 . A A . 32 CYS HA 1 1 25 15841 1 1 32 CYS HB2 H 2.510 -0.704 1.522 1.00 . A A . 32 CYS HB2 1 1 25 15842 1 1 32 CYS HB3 H 2.694 -0.769 3.269 1.00 . A A . 32 CYS HB3 1 1 25 15843 1 1 32 CYS N N 4.191 1.133 1.614 1.00 . A A . 32 CYS N 1 1 25 15844 1 1 32 CYS O O 4.363 1.261 4.389 1.00 . A A . 32 CYS O 1 1 25 15845 1 1 32 CYS SG S 0.484 -0.123 2.641 1.00 . A A . 32 CYS SG 1 1 25 15846 1 1 33 THR C C 1.798 2.012 6.809 1.00 . A A . 33 THR C 1 1 25 15847 1 1 33 THR CA C 2.607 2.847 5.821 1.00 . A A . 33 THR CA 1 1 25 15848 1 1 33 THR CB C 2.208 4.319 5.933 1.00 . A A . 33 THR CB 1 1 25 15849 1 1 33 THR CG2 C 2.758 5.175 4.813 1.00 . A A . 33 THR CG2 1 1 25 15850 1 1 33 THR H H 1.591 2.614 3.981 1.00 . A A . 33 THR H 1 1 25 15851 1 1 33 THR HA H 3.655 2.748 6.059 1.00 . A A . 33 THR HA 1 1 25 15852 1 1 33 THR HB H 2.584 4.713 6.866 1.00 . A A . 33 THR HB 1 1 25 15853 1 1 33 THR HG1 H 0.433 3.992 5.172 1.00 . A A . 33 THR HG1 1 1 25 15854 1 1 33 THR HG21 H 3.826 5.031 4.741 1.00 . A A . 33 THR HG21 1 1 25 15855 1 1 33 THR HG22 H 2.293 4.891 3.881 1.00 . A A . 33 THR HG22 1 1 25 15856 1 1 33 THR HG23 H 2.549 6.215 5.018 1.00 . A A . 33 THR HG23 1 1 25 15857 1 1 33 THR N N 2.410 2.371 4.458 1.00 . A A . 33 THR N 1 1 25 15858 1 1 33 THR O O 1.569 2.428 7.944 1.00 . A A . 33 THR O 1 1 25 15859 1 1 33 THR OG1 O 0.798 4.458 5.927 1.00 . A A . 33 THR OG1 1 1 25 15860 1 1 34 GLY C C -0.519 0.681 7.969 1.00 . A A . 34 GLY C 1 1 25 15861 1 1 34 GLY CA C 0.588 -0.048 7.228 1.00 . A A . 34 GLY CA 1 1 25 15862 1 1 34 GLY H H 1.584 0.548 5.453 1.00 . A A . 34 GLY H 1 1 25 15863 1 1 34 GLY HA2 H 1.249 -0.503 7.951 1.00 . A A . 34 GLY HA2 1 1 25 15864 1 1 34 GLY HA3 H 0.147 -0.825 6.623 1.00 . A A . 34 GLY HA3 1 1 25 15865 1 1 34 GLY N N 1.368 0.829 6.369 1.00 . A A . 34 GLY N 1 1 25 15866 1 1 34 GLY O O -0.836 0.346 9.110 1.00 . A A . 34 GLY O 1 1 25 15867 1 1 35 ARG C C -3.473 2.331 7.131 1.00 . A A . 35 ARG C 1 1 25 15868 1 1 35 ARG CA C -2.181 2.460 7.929 1.00 . A A . 35 ARG CA 1 1 25 15869 1 1 35 ARG CB C -1.777 3.932 8.032 1.00 . A A . 35 ARG CB 1 1 25 15870 1 1 35 ARG CD C -1.573 5.910 9.568 1.00 . A A . 35 ARG CD 1 1 25 15871 1 1 35 ARG CG C -2.335 4.631 9.261 1.00 . A A . 35 ARG CG 1 1 25 15872 1 1 35 ARG CZ C -1.812 6.187 12.005 1.00 . A A . 35 ARG CZ 1 1 25 15873 1 1 35 ARG H H -0.810 1.905 6.413 1.00 . A A . 35 ARG H 1 1 25 15874 1 1 35 ARG HA H -2.347 2.073 8.921 1.00 . A A . 35 ARG HA 1 1 25 15875 1 1 35 ARG HB2 H -0.700 3.996 8.065 1.00 . A A . 35 ARG HB2 1 1 25 15876 1 1 35 ARG HB3 H -2.133 4.453 7.156 1.00 . A A . 35 ARG HB3 1 1 25 15877 1 1 35 ARG HD2 H -0.532 5.666 9.722 1.00 . A A . 35 ARG HD2 1 1 25 15878 1 1 35 ARG HD3 H -1.663 6.579 8.725 1.00 . A A . 35 ARG HD3 1 1 25 15879 1 1 35 ARG HE H -2.660 7.361 10.631 1.00 . A A . 35 ARG HE 1 1 25 15880 1 1 35 ARG HG2 H -3.371 4.876 9.085 1.00 . A A . 35 ARG HG2 1 1 25 15881 1 1 35 ARG HG3 H -2.258 3.965 10.108 1.00 . A A . 35 ARG HG3 1 1 25 15882 1 1 35 ARG HH11 H -0.652 4.626 11.449 1.00 . A A . 35 ARG HH11 1 1 25 15883 1 1 35 ARG HH12 H -0.836 4.843 13.157 1.00 . A A . 35 ARG HH12 1 1 25 15884 1 1 35 ARG HH21 H -2.903 7.648 12.877 1.00 . A A . 35 ARG HH21 1 1 25 15885 1 1 35 ARG HH22 H -2.115 6.558 13.968 1.00 . A A . 35 ARG HH22 1 1 25 15886 1 1 35 ARG N N -1.107 1.682 7.320 1.00 . A A . 35 ARG N 1 1 25 15887 1 1 35 ARG NE N -2.084 6.579 10.762 1.00 . A A . 35 ARG NE 1 1 25 15888 1 1 35 ARG NH1 N -1.037 5.132 12.221 1.00 . A A . 35 ARG NH1 1 1 25 15889 1 1 35 ARG NH2 N -2.318 6.852 13.035 1.00 . A A . 35 ARG NH2 1 1 25 15890 1 1 35 ARG O O -4.559 2.222 7.701 1.00 . A A . 35 ARG O 1 1 25 15891 1 1 36 SER C C -4.198 1.336 3.735 1.00 . A A . 36 SER C 1 1 25 15892 1 1 36 SER CA C -4.507 2.230 4.931 1.00 . A A . 36 SER CA 1 1 25 15893 1 1 36 SER CB C -4.945 3.613 4.448 1.00 . A A . 36 SER CB 1 1 25 15894 1 1 36 SER H H -2.456 2.434 5.416 1.00 . A A . 36 SER H 1 1 25 15895 1 1 36 SER HA H -5.311 1.785 5.498 1.00 . A A . 36 SER HA 1 1 25 15896 1 1 36 SER HB2 H -5.287 4.195 5.291 1.00 . A A . 36 SER HB2 1 1 25 15897 1 1 36 SER HB3 H -4.107 4.112 3.983 1.00 . A A . 36 SER HB3 1 1 25 15898 1 1 36 SER HG H -6.162 4.377 3.116 1.00 . A A . 36 SER HG 1 1 25 15899 1 1 36 SER N N -3.349 2.344 5.810 1.00 . A A . 36 SER N 1 1 25 15900 1 1 36 SER O O -3.055 0.925 3.534 1.00 . A A . 36 SER O 1 1 25 15901 1 1 36 SER OG O -5.999 3.515 3.505 1.00 . A A . 36 SER OG 1 1 25 15902 1 1 37 CYS C C -4.825 1.040 0.513 1.00 . A A . 37 CYS C 1 1 25 15903 1 1 37 CYS CA C -5.059 0.197 1.765 1.00 . A A . 37 CYS CA 1 1 25 15904 1 1 37 CYS CB C -6.291 -0.689 1.573 1.00 . A A . 37 CYS CB 1 1 25 15905 1 1 37 CYS H H -6.110 1.401 3.153 1.00 . A A . 37 CYS H 1 1 25 15906 1 1 37 CYS HA H -4.197 -0.432 1.926 1.00 . A A . 37 CYS HA 1 1 25 15907 1 1 37 CYS HB2 H -7.170 -0.141 1.875 1.00 . A A . 37 CYS HB2 1 1 25 15908 1 1 37 CYS HB3 H -6.377 -0.951 0.530 1.00 . A A . 37 CYS HB3 1 1 25 15909 1 1 37 CYS N N -5.223 1.041 2.943 1.00 . A A . 37 CYS N 1 1 25 15910 1 1 37 CYS O O -4.850 0.526 -0.605 1.00 . A A . 37 CYS O 1 1 25 15911 1 1 37 CYS SG S -6.248 -2.237 2.535 1.00 . A A . 37 CYS SG 1 1 25 15912 1 1 38 GLU C C -2.898 3.701 -0.435 1.00 . A A . 38 GLU C 1 1 25 15913 1 1 38 GLU CA C -4.354 3.244 -0.410 1.00 . A A . 38 GLU CA 1 1 25 15914 1 1 38 GLU CB C -5.280 4.458 -0.315 1.00 . A A . 38 GLU CB 1 1 25 15915 1 1 38 GLU CD C -7.524 5.294 0.487 1.00 . A A . 38 GLU CD 1 1 25 15916 1 1 38 GLU CG C -6.721 4.100 0.009 1.00 . A A . 38 GLU CG 1 1 25 15917 1 1 38 GLU H H -4.585 2.691 1.619 1.00 . A A . 38 GLU H 1 1 25 15918 1 1 38 GLU HA H -4.567 2.710 -1.323 1.00 . A A . 38 GLU HA 1 1 25 15919 1 1 38 GLU HB2 H -4.913 5.118 0.457 1.00 . A A . 38 GLU HB2 1 1 25 15920 1 1 38 GLU HB3 H -5.265 4.982 -1.260 1.00 . A A . 38 GLU HB3 1 1 25 15921 1 1 38 GLU HG2 H -7.189 3.705 -0.880 1.00 . A A . 38 GLU HG2 1 1 25 15922 1 1 38 GLU HG3 H -6.726 3.347 0.783 1.00 . A A . 38 GLU HG3 1 1 25 15923 1 1 38 GLU N N -4.594 2.337 0.706 1.00 . A A . 38 GLU N 1 1 25 15924 1 1 38 GLU O O -2.503 4.590 0.319 1.00 . A A . 38 GLU O 1 1 25 15925 1 1 38 GLU OE1 O -7.262 6.417 0.008 1.00 . A A . 38 GLU OE1 1 1 25 15926 1 1 38 GLU OE2 O -8.416 5.105 1.341 1.00 . A A . 38 GLU OE2 1 1 25 15927 1 1 39 CYS C C -0.522 4.915 -1.762 1.00 . A A . 39 CYS C 1 1 25 15928 1 1 39 CYS CA C -0.693 3.431 -1.434 1.00 . A A . 39 CYS CA 1 1 25 15929 1 1 39 CYS CB C -0.038 2.576 -2.521 1.00 . A A . 39 CYS CB 1 1 25 15930 1 1 39 CYS H H -2.480 2.387 -1.883 1.00 . A A . 39 CYS H 1 1 25 15931 1 1 39 CYS HA H -0.217 3.221 -0.489 1.00 . A A . 39 CYS HA 1 1 25 15932 1 1 39 CYS HB2 H -0.280 1.539 -2.346 1.00 . A A . 39 CYS HB2 1 1 25 15933 1 1 39 CYS HB3 H -0.428 2.872 -3.485 1.00 . A A . 39 CYS HB3 1 1 25 15934 1 1 39 CYS N N -2.106 3.087 -1.308 1.00 . A A . 39 CYS N 1 1 25 15935 1 1 39 CYS O O -0.865 5.357 -2.859 1.00 . A A . 39 CYS O 1 1 25 15936 1 1 39 CYS SG S 1.777 2.714 -2.592 1.00 . A A . 39 CYS SG 1 1 25 15937 1 1 40 PRO C C 0.921 7.458 -2.332 1.00 . A A . 40 PRO C 1 1 25 15938 1 1 40 PRO CA C 0.219 7.147 -1.014 1.00 . A A . 40 PRO CA 1 1 25 15939 1 1 40 PRO CB C 1.103 7.542 0.169 1.00 . A A . 40 PRO CB 1 1 25 15940 1 1 40 PRO CD C 0.447 5.270 0.527 1.00 . A A . 40 PRO CD 1 1 25 15941 1 1 40 PRO CG C 0.764 6.560 1.235 1.00 . A A . 40 PRO CG 1 1 25 15942 1 1 40 PRO HA H -0.713 7.691 -0.967 1.00 . A A . 40 PRO HA 1 1 25 15943 1 1 40 PRO HB2 H 2.143 7.475 -0.116 1.00 . A A . 40 PRO HB2 1 1 25 15944 1 1 40 PRO HB3 H 0.871 8.551 0.475 1.00 . A A . 40 PRO HB3 1 1 25 15945 1 1 40 PRO HD2 H 1.329 4.650 0.461 1.00 . A A . 40 PRO HD2 1 1 25 15946 1 1 40 PRO HD3 H -0.346 4.745 1.038 1.00 . A A . 40 PRO HD3 1 1 25 15947 1 1 40 PRO HG2 H 1.609 6.428 1.895 1.00 . A A . 40 PRO HG2 1 1 25 15948 1 1 40 PRO HG3 H -0.096 6.903 1.791 1.00 . A A . 40 PRO HG3 1 1 25 15949 1 1 40 PRO N N 0.010 5.709 -0.813 1.00 . A A . 40 PRO N 1 1 25 15950 1 1 40 PRO O O 1.301 6.553 -3.073 1.00 . A A . 40 PRO O 1 1 25 15951 1 1 41 SER C C 3.217 9.493 -3.600 1.00 . A A . 41 SER C 1 1 25 15952 1 1 41 SER CA C 1.744 9.178 -3.845 1.00 . A A . 41 SER CA 1 1 25 15953 1 1 41 SER CB C 1.037 10.408 -4.418 1.00 . A A . 41 SER CB 1 1 25 15954 1 1 41 SER H H 0.763 9.421 -1.985 1.00 . A A . 41 SER H 1 1 25 15955 1 1 41 SER HA H 1.675 8.371 -4.558 1.00 . A A . 41 SER HA 1 1 25 15956 1 1 41 SER HB2 H 1.759 11.036 -4.918 1.00 . A A . 41 SER HB2 1 1 25 15957 1 1 41 SER HB3 H 0.285 10.091 -5.126 1.00 . A A . 41 SER HB3 1 1 25 15958 1 1 41 SER HG H 1.061 11.724 -2.968 1.00 . A A . 41 SER HG 1 1 25 15959 1 1 41 SER N N 1.089 8.746 -2.616 1.00 . A A . 41 SER N 1 1 25 15960 1 1 41 SER O O 3.812 10.310 -4.304 1.00 . A A . 41 SER O 1 1 25 15961 1 1 41 SER OG O 0.411 11.161 -3.394 1.00 . A A . 41 SER OG 1 1 25 15962 1 1 42 TYR C C 5.795 7.812 -1.596 1.00 . A A . 42 TYR C 1 1 25 15963 1 1 42 TYR CA C 5.205 9.050 -2.268 1.00 . A A . 42 TYR CA 1 1 25 15964 1 1 42 TYR CB C 5.359 10.270 -1.355 1.00 . A A . 42 TYR CB 1 1 25 15965 1 1 42 TYR CD1 C 5.640 9.706 1.090 1.00 . A A . 42 TYR CD1 1 1 25 15966 1 1 42 TYR CD2 C 3.451 10.223 0.300 1.00 . A A . 42 TYR CD2 1 1 25 15967 1 1 42 TYR CE1 C 5.140 9.515 2.364 1.00 . A A . 42 TYR CE1 1 1 25 15968 1 1 42 TYR CE2 C 2.943 10.034 1.571 1.00 . A A . 42 TYR CE2 1 1 25 15969 1 1 42 TYR CG C 4.806 10.063 0.038 1.00 . A A . 42 TYR CG 1 1 25 15970 1 1 42 TYR CZ C 3.791 9.680 2.599 1.00 . A A . 42 TYR CZ 1 1 25 15971 1 1 42 TYR H H 3.277 8.200 -2.076 1.00 . A A . 42 TYR H 1 1 25 15972 1 1 42 TYR HA H 5.738 9.233 -3.189 1.00 . A A . 42 TYR HA 1 1 25 15973 1 1 42 TYR HB2 H 6.407 10.510 -1.261 1.00 . A A . 42 TYR HB2 1 1 25 15974 1 1 42 TYR HB3 H 4.841 11.108 -1.797 1.00 . A A . 42 TYR HB3 1 1 25 15975 1 1 42 TYR HD1 H 6.696 9.578 0.902 1.00 . A A . 42 TYR HD1 1 1 25 15976 1 1 42 TYR HD2 H 2.789 10.499 -0.508 1.00 . A A . 42 TYR HD2 1 1 25 15977 1 1 42 TYR HE1 H 5.805 9.238 3.168 1.00 . A A . 42 TYR HE1 1 1 25 15978 1 1 42 TYR HE2 H 1.887 10.163 1.755 1.00 . A A . 42 TYR HE2 1 1 25 15979 1 1 42 TYR HH H 3.352 10.311 4.361 1.00 . A A . 42 TYR HH 1 1 25 15980 1 1 42 TYR N N 3.801 8.840 -2.601 1.00 . A A . 42 TYR N 1 1 25 15981 1 1 42 TYR O O 5.101 7.101 -0.868 1.00 . A A . 42 TYR O 1 1 25 15982 1 1 42 TYR OH O 3.290 9.491 3.866 1.00 . A A . 42 TYR OH 1 1 25 15983 1 1 43 PRO C C 8.082 6.572 0.232 1.00 . A A . 43 PRO C 1 1 25 15984 1 1 43 PRO CA C 7.767 6.376 -1.247 1.00 . A A . 43 PRO CA 1 1 25 15985 1 1 43 PRO CB C 9.057 6.281 -2.061 1.00 . A A . 43 PRO CB 1 1 25 15986 1 1 43 PRO CD C 7.992 8.329 -2.689 1.00 . A A . 43 PRO CD 1 1 25 15987 1 1 43 PRO CG C 9.335 7.683 -2.479 1.00 . A A . 43 PRO CG 1 1 25 15988 1 1 43 PRO HA H 7.190 5.472 -1.374 1.00 . A A . 43 PRO HA 1 1 25 15989 1 1 43 PRO HB2 H 9.850 5.886 -1.442 1.00 . A A . 43 PRO HB2 1 1 25 15990 1 1 43 PRO HB3 H 8.902 5.638 -2.914 1.00 . A A . 43 PRO HB3 1 1 25 15991 1 1 43 PRO HD2 H 8.016 9.361 -2.372 1.00 . A A . 43 PRO HD2 1 1 25 15992 1 1 43 PRO HD3 H 7.698 8.259 -3.726 1.00 . A A . 43 PRO HD3 1 1 25 15993 1 1 43 PRO HG2 H 9.880 8.197 -1.701 1.00 . A A . 43 PRO HG2 1 1 25 15994 1 1 43 PRO HG3 H 9.901 7.687 -3.399 1.00 . A A . 43 PRO HG3 1 1 25 15995 1 1 43 PRO N N 7.089 7.535 -1.832 1.00 . A A . 43 PRO N 1 1 25 15996 1 1 43 PRO O O 7.772 7.614 0.810 1.00 . A A . 43 PRO O 1 1 25 15997 1 1 44 GLY C C 10.157 6.642 2.513 1.00 . A A . 44 GLY C 1 1 25 15998 1 1 44 GLY CA C 9.047 5.645 2.246 1.00 . A A . 44 GLY CA 1 1 25 15999 1 1 44 GLY H H 8.922 4.758 0.328 1.00 . A A . 44 GLY H 1 1 25 16000 1 1 44 GLY HA2 H 9.365 4.670 2.584 1.00 . A A . 44 GLY HA2 1 1 25 16001 1 1 44 GLY HA3 H 8.171 5.940 2.805 1.00 . A A . 44 GLY HA3 1 1 25 16002 1 1 44 GLY N N 8.700 5.564 0.839 1.00 . A A . 44 GLY N 1 1 25 16003 1 1 44 GLY O O 9.954 7.635 3.212 1.00 . A A . 44 GLY O 1 1 25 16004 1 1 45 ASN C C 12.358 8.500 1.259 1.00 . A A . 45 ASN C 1 1 25 16005 1 1 45 ASN CA C 12.481 7.260 2.138 1.00 . A A . 45 ASN CA 1 1 25 16006 1 1 45 ASN CB C 13.778 6.517 1.813 1.00 . A A . 45 ASN CB 1 1 25 16007 1 1 45 ASN CG C 14.209 5.589 2.932 1.00 . A A . 45 ASN CG 1 1 25 16008 1 1 45 ASN H H 11.433 5.571 1.409 1.00 . A A . 45 ASN H 1 1 25 16009 1 1 45 ASN HA H 12.502 7.567 3.172 1.00 . A A . 45 ASN HA 1 1 25 16010 1 1 45 ASN HB2 H 13.635 5.929 0.918 1.00 . A A . 45 ASN HB2 1 1 25 16011 1 1 45 ASN HB3 H 14.565 7.237 1.644 1.00 . A A . 45 ASN HB3 1 1 25 16012 1 1 45 ASN HD21 H 16.102 5.710 2.338 1.00 . A A . 45 ASN HD21 1 1 25 16013 1 1 45 ASN HD22 H 15.811 4.710 3.716 1.00 . A A . 45 ASN HD22 1 1 25 16014 1 1 45 ASN N N 11.334 6.378 1.956 1.00 . A A . 45 ASN N 1 1 25 16015 1 1 45 ASN ND2 N 15.505 5.308 3.002 1.00 . A A . 45 ASN ND2 1 1 25 16016 1 1 45 ASN O O 12.860 8.530 0.135 1.00 . A A . 45 ASN O 1 1 25 16017 1 1 45 ASN OD1 O 13.386 5.129 3.724 1.00 . A A . 45 ASN OD1 1 1 25 16018 1 1 46 GLY C C 10.100 11.297 1.130 1.00 . A A . 46 GLY C 1 1 25 16019 1 1 46 GLY CA C 11.511 10.752 1.028 1.00 . A A . 46 GLY CA 1 1 25 16020 1 1 46 GLY H H 11.309 9.443 2.679 1.00 . A A . 46 GLY H 1 1 25 16021 1 1 46 GLY HA2 H 11.738 10.562 -0.011 1.00 . A A . 46 GLY HA2 1 1 25 16022 1 1 46 GLY HA3 H 12.200 11.494 1.405 1.00 . A A . 46 GLY HA3 1 1 25 16023 1 1 46 GLY N N 11.688 9.523 1.779 1.00 . A A . 46 GLY N 1 1 25 16024 1 1 46 GLY O O 9.213 10.561 1.611 1.00 . A A . 46 GLY O 1 1 25 16025 1 1 46 GLY OXT O 9.882 12.460 0.730 1.00 . A A . 46 GLY OXT 1 1 26 16026 1 1 1 ALA C C -19.242 -4.860 6.425 1.00 . A A . 1 ALA C 1 1 26 16027 1 1 1 ALA CA C -20.239 -5.754 7.153 1.00 . A A . 1 ALA CA 1 1 26 16028 1 1 1 ALA CB C -19.550 -7.015 7.652 1.00 . A A . 1 ALA CB 1 1 26 16029 1 1 1 ALA H1 H -21.647 -5.253 5.739 1.00 . A A . 1 ALA H1 1 1 26 16030 1 1 1 ALA H2 H -21.067 -6.865 5.633 1.00 . A A . 1 ALA H2 1 1 26 16031 1 1 1 ALA H3 H -22.164 -6.425 6.878 1.00 . A A . 1 ALA H3 1 1 26 16032 1 1 1 ALA HA H -20.623 -5.221 8.010 1.00 . A A . 1 ALA HA 1 1 26 16033 1 1 1 ALA HB1 H -18.888 -7.391 6.886 1.00 . A A . 1 ALA HB1 1 1 26 16034 1 1 1 ALA HB2 H -20.294 -7.763 7.884 1.00 . A A . 1 ALA HB2 1 1 26 16035 1 1 1 ALA HB3 H -18.980 -6.787 8.540 1.00 . A A . 1 ALA HB3 1 1 26 16036 1 1 1 ALA N N -21.382 -6.106 6.271 1.00 . A A . 1 ALA N 1 1 26 16037 1 1 1 ALA O O -19.451 -4.493 5.268 1.00 . A A . 1 ALA O 1 1 26 16038 1 1 2 MET C C -16.516 -4.313 5.289 1.00 . A A . 2 MET C 1 1 26 16039 1 1 2 MET CA C -17.125 -3.662 6.526 1.00 . A A . 2 MET CA 1 1 26 16040 1 1 2 MET CB C -16.031 -3.373 7.556 1.00 . A A . 2 MET CB 1 1 26 16041 1 1 2 MET CE C -17.163 -0.785 8.568 1.00 . A A . 2 MET CE 1 1 26 16042 1 1 2 MET CG C -15.178 -2.163 7.213 1.00 . A A . 2 MET CG 1 1 26 16043 1 1 2 MET H H -18.046 -4.838 8.027 1.00 . A A . 2 MET H 1 1 26 16044 1 1 2 MET HA H -17.589 -2.731 6.237 1.00 . A A . 2 MET HA 1 1 26 16045 1 1 2 MET HB2 H -16.494 -3.200 8.517 1.00 . A A . 2 MET HB2 1 1 26 16046 1 1 2 MET HB3 H -15.384 -4.235 7.628 1.00 . A A . 2 MET HB3 1 1 26 16047 1 1 2 MET HE1 H -16.636 -1.349 9.323 1.00 . A A . 2 MET HE1 1 1 26 16048 1 1 2 MET HE2 H -17.388 0.201 8.948 1.00 . A A . 2 MET HE2 1 1 26 16049 1 1 2 MET HE3 H -18.083 -1.292 8.316 1.00 . A A . 2 MET HE3 1 1 26 16050 1 1 2 MET HG2 H -14.425 -2.042 7.979 1.00 . A A . 2 MET HG2 1 1 26 16051 1 1 2 MET HG3 H -14.696 -2.337 6.262 1.00 . A A . 2 MET HG3 1 1 26 16052 1 1 2 MET N N -18.156 -4.513 7.109 1.00 . A A . 2 MET N 1 1 26 16053 1 1 2 MET O O -16.590 -5.530 5.116 1.00 . A A . 2 MET O 1 1 26 16054 1 1 2 MET SD S -16.140 -0.642 7.105 1.00 . A A . 2 MET SD 1 1 26 16055 1 1 3 ASP C C -13.883 -4.504 3.487 1.00 . A A . 3 ASP C 1 1 26 16056 1 1 3 ASP CA C -15.293 -3.993 3.210 1.00 . A A . 3 ASP CA 1 1 26 16057 1 1 3 ASP CB C -15.248 -2.890 2.150 1.00 . A A . 3 ASP CB 1 1 26 16058 1 1 3 ASP CG C -15.329 -3.440 0.740 1.00 . A A . 3 ASP CG 1 1 26 16059 1 1 3 ASP H H -15.888 -2.535 4.625 1.00 . A A . 3 ASP H 1 1 26 16060 1 1 3 ASP HA H -15.893 -4.810 2.841 1.00 . A A . 3 ASP HA 1 1 26 16061 1 1 3 ASP HB2 H -16.081 -2.219 2.303 1.00 . A A . 3 ASP HB2 1 1 26 16062 1 1 3 ASP HB3 H -14.325 -2.340 2.251 1.00 . A A . 3 ASP HB3 1 1 26 16063 1 1 3 ASP N N -15.915 -3.496 4.432 1.00 . A A . 3 ASP N 1 1 26 16064 1 1 3 ASP O O -13.327 -4.273 4.561 1.00 . A A . 3 ASP O 1 1 26 16065 1 1 3 ASP OD1 O -16.150 -4.352 0.504 1.00 . A A . 3 ASP OD1 1 1 26 16066 1 1 3 ASP OD2 O -14.571 -2.960 -0.129 1.00 . A A . 3 ASP OD2 1 1 26 16067 1 1 4 CYS C C -10.915 -4.799 2.062 1.00 . A A . 4 CYS C 1 1 26 16068 1 1 4 CYS CA C -11.963 -5.745 2.649 1.00 . A A . 4 CYS CA 1 1 26 16069 1 1 4 CYS CB C -11.876 -7.116 1.973 1.00 . A A . 4 CYS CB 1 1 26 16070 1 1 4 CYS H H -13.802 -5.352 1.677 1.00 . A A . 4 CYS H 1 1 26 16071 1 1 4 CYS HA H -11.764 -5.866 3.704 1.00 . A A . 4 CYS HA 1 1 26 16072 1 1 4 CYS HB2 H -12.786 -7.294 1.420 1.00 . A A . 4 CYS HB2 1 1 26 16073 1 1 4 CYS HB3 H -11.040 -7.122 1.289 1.00 . A A . 4 CYS HB3 1 1 26 16074 1 1 4 CYS N N -13.309 -5.201 2.511 1.00 . A A . 4 CYS N 1 1 26 16075 1 1 4 CYS O O -9.717 -5.067 2.139 1.00 . A A . 4 CYS O 1 1 26 16076 1 1 4 CYS SG S -11.655 -8.502 3.136 1.00 . A A . 4 CYS SG 1 1 26 16077 1 1 5 THR C C -9.669 -3.319 -0.263 1.00 . A A . 5 THR C 1 1 26 16078 1 1 5 THR CA C -10.462 -2.710 0.891 1.00 . A A . 5 THR CA 1 1 26 16079 1 1 5 THR CB C -9.504 -2.162 1.953 1.00 . A A . 5 THR CB 1 1 26 16080 1 1 5 THR CG2 C -9.395 -0.653 1.937 1.00 . A A . 5 THR CG2 1 1 26 16081 1 1 5 THR H H -12.333 -3.524 1.451 1.00 . A A . 5 THR H 1 1 26 16082 1 1 5 THR HA H -11.059 -1.896 0.508 1.00 . A A . 5 THR HA 1 1 26 16083 1 1 5 THR HB H -8.518 -2.567 1.779 1.00 . A A . 5 THR HB 1 1 26 16084 1 1 5 THR HG1 H -9.340 -3.238 3.582 1.00 . A A . 5 THR HG1 1 1 26 16085 1 1 5 THR HG21 H -9.175 -0.319 0.934 1.00 . A A . 5 THR HG21 1 1 26 16086 1 1 5 THR HG22 H -10.330 -0.221 2.263 1.00 . A A . 5 THR HG22 1 1 26 16087 1 1 5 THR HG23 H -8.604 -0.342 2.603 1.00 . A A . 5 THR HG23 1 1 26 16088 1 1 5 THR N N -11.369 -3.690 1.481 1.00 . A A . 5 THR N 1 1 26 16089 1 1 5 THR O O -9.035 -4.363 -0.112 1.00 . A A . 5 THR O 1 1 26 16090 1 1 5 THR OG1 O -9.919 -2.547 3.253 1.00 . A A . 5 THR OG1 1 1 26 16091 1 1 6 THR C C -8.217 -1.990 -3.246 1.00 . A A . 6 THR C 1 1 26 16092 1 1 6 THR CA C -8.993 -3.129 -2.594 1.00 . A A . 6 THR CA 1 1 26 16093 1 1 6 THR CB C -9.970 -3.739 -3.600 1.00 . A A . 6 THR CB 1 1 26 16094 1 1 6 THR CG2 C -10.690 -4.961 -3.071 1.00 . A A . 6 THR CG2 1 1 26 16095 1 1 6 THR H H -10.230 -1.829 -1.471 1.00 . A A . 6 THR H 1 1 26 16096 1 1 6 THR HA H -8.295 -3.890 -2.276 1.00 . A A . 6 THR HA 1 1 26 16097 1 1 6 THR HB H -9.423 -4.034 -4.484 1.00 . A A . 6 THR HB 1 1 26 16098 1 1 6 THR HG1 H -11.295 -2.353 -3.199 1.00 . A A . 6 THR HG1 1 1 26 16099 1 1 6 THR HG21 H -10.041 -5.495 -2.393 1.00 . A A . 6 THR HG21 1 1 26 16100 1 1 6 THR HG22 H -11.583 -4.654 -2.547 1.00 . A A . 6 THR HG22 1 1 26 16101 1 1 6 THR HG23 H -10.959 -5.605 -3.894 1.00 . A A . 6 THR HG23 1 1 26 16102 1 1 6 THR N N -9.709 -2.657 -1.414 1.00 . A A . 6 THR N 1 1 26 16103 1 1 6 THR O O -8.779 -0.935 -3.542 1.00 . A A . 6 THR O 1 1 26 16104 1 1 6 THR OG1 O -10.953 -2.793 -3.981 1.00 . A A . 6 THR OG1 1 1 26 16105 1 1 7 GLY C C -4.636 -1.580 -4.164 1.00 . A A . 7 GLY C 1 1 26 16106 1 1 7 GLY CA C -6.098 -1.182 -4.077 1.00 . A A . 7 GLY CA 1 1 26 16107 1 1 7 GLY H H -6.528 -3.064 -3.206 1.00 . A A . 7 GLY H 1 1 26 16108 1 1 7 GLY HA2 H -6.179 -0.276 -3.495 1.00 . A A . 7 GLY HA2 1 1 26 16109 1 1 7 GLY HA3 H -6.466 -0.989 -5.074 1.00 . A A . 7 GLY HA3 1 1 26 16110 1 1 7 GLY N N -6.924 -2.206 -3.465 1.00 . A A . 7 GLY N 1 1 26 16111 1 1 7 GLY O O -4.317 -2.765 -4.262 1.00 . A A . 7 GLY O 1 1 26 16112 1 1 8 PRO C C -1.665 -1.265 -2.888 1.00 . A A . 8 PRO C 1 1 26 16113 1 1 8 PRO CA C -2.279 -0.856 -4.227 1.00 . A A . 8 PRO CA 1 1 26 16114 1 1 8 PRO CB C -1.724 0.493 -4.679 1.00 . A A . 8 PRO CB 1 1 26 16115 1 1 8 PRO CD C -4.012 0.845 -4.038 1.00 . A A . 8 PRO CD 1 1 26 16116 1 1 8 PRO CG C -2.652 1.496 -4.082 1.00 . A A . 8 PRO CG 1 1 26 16117 1 1 8 PRO HA H -2.054 -1.607 -4.970 1.00 . A A . 8 PRO HA 1 1 26 16118 1 1 8 PRO HB2 H -0.717 0.615 -4.309 1.00 . A A . 8 PRO HB2 1 1 26 16119 1 1 8 PRO HB3 H -1.728 0.547 -5.758 1.00 . A A . 8 PRO HB3 1 1 26 16120 1 1 8 PRO HD2 H -4.506 1.070 -3.104 1.00 . A A . 8 PRO HD2 1 1 26 16121 1 1 8 PRO HD3 H -4.613 1.174 -4.872 1.00 . A A . 8 PRO HD3 1 1 26 16122 1 1 8 PRO HG2 H -2.325 1.748 -3.084 1.00 . A A . 8 PRO HG2 1 1 26 16123 1 1 8 PRO HG3 H -2.681 2.380 -4.701 1.00 . A A . 8 PRO HG3 1 1 26 16124 1 1 8 PRO N N -3.717 -0.599 -4.140 1.00 . A A . 8 PRO N 1 1 26 16125 1 1 8 PRO O O -0.855 -2.190 -2.825 1.00 . A A . 8 PRO O 1 1 26 16126 1 1 9 CYS C C -2.091 -2.165 0.057 1.00 . A A . 9 CYS C 1 1 26 16127 1 1 9 CYS CA C -1.525 -0.858 -0.490 1.00 . A A . 9 CYS CA 1 1 26 16128 1 1 9 CYS CB C -1.842 0.294 0.468 1.00 . A A . 9 CYS CB 1 1 26 16129 1 1 9 CYS H H -2.693 0.162 -1.935 1.00 . A A . 9 CYS H 1 1 26 16130 1 1 9 CYS HA H -0.454 -0.957 -0.573 1.00 . A A . 9 CYS HA 1 1 26 16131 1 1 9 CYS HB2 H -2.332 1.083 -0.081 1.00 . A A . 9 CYS HB2 1 1 26 16132 1 1 9 CYS HB3 H -2.504 -0.062 1.244 1.00 . A A . 9 CYS HB3 1 1 26 16133 1 1 9 CYS N N -2.049 -0.568 -1.823 1.00 . A A . 9 CYS N 1 1 26 16134 1 1 9 CYS O O -1.345 -3.095 0.360 1.00 . A A . 9 CYS O 1 1 26 16135 1 1 9 CYS SG S -0.375 1.013 1.275 1.00 . A A . 9 CYS SG 1 1 26 16136 1 1 10 CYS C C -3.900 -4.594 -0.260 1.00 . A A . 10 CYS C 1 1 26 16137 1 1 10 CYS CA C -4.063 -3.426 0.705 1.00 . A A . 10 CYS CA 1 1 26 16138 1 1 10 CYS CB C -5.546 -3.157 0.968 1.00 . A A . 10 CYS CB 1 1 26 16139 1 1 10 CYS H H -3.955 -1.456 -0.063 1.00 . A A . 10 CYS H 1 1 26 16140 1 1 10 CYS HA H -3.585 -3.683 1.637 1.00 . A A . 10 CYS HA 1 1 26 16141 1 1 10 CYS HB2 H -5.972 -4.008 1.478 1.00 . A A . 10 CYS HB2 1 1 26 16142 1 1 10 CYS HB3 H -5.638 -2.286 1.598 1.00 . A A . 10 CYS HB3 1 1 26 16143 1 1 10 CYS N N -3.410 -2.229 0.189 1.00 . A A . 10 CYS N 1 1 26 16144 1 1 10 CYS O O -4.291 -4.511 -1.425 1.00 . A A . 10 CYS O 1 1 26 16145 1 1 10 CYS SG S -6.536 -2.864 -0.535 1.00 . A A . 10 CYS SG 1 1 26 16146 1 1 11 ARG C C -4.392 -7.346 -1.224 1.00 . A A . 11 ARG C 1 1 26 16147 1 1 11 ARG CA C -3.093 -6.870 -0.580 1.00 . A A . 11 ARG CA 1 1 26 16148 1 1 11 ARG CB C -2.490 -7.990 0.271 1.00 . A A . 11 ARG CB 1 1 26 16149 1 1 11 ARG CD C -0.436 -8.712 1.524 1.00 . A A . 11 ARG CD 1 1 26 16150 1 1 11 ARG CG C -0.971 -7.975 0.307 1.00 . A A . 11 ARG CG 1 1 26 16151 1 1 11 ARG CZ C -0.815 -11.069 0.912 1.00 . A A . 11 ARG CZ 1 1 26 16152 1 1 11 ARG H H -3.025 -5.682 1.170 1.00 . A A . 11 ARG H 1 1 26 16153 1 1 11 ARG HA H -2.395 -6.609 -1.361 1.00 . A A . 11 ARG HA 1 1 26 16154 1 1 11 ARG HB2 H -2.854 -7.893 1.283 1.00 . A A . 11 ARG HB2 1 1 26 16155 1 1 11 ARG HB3 H -2.810 -8.941 -0.128 1.00 . A A . 11 ARG HB3 1 1 26 16156 1 1 11 ARG HD2 H 0.629 -8.849 1.407 1.00 . A A . 11 ARG HD2 1 1 26 16157 1 1 11 ARG HD3 H -0.627 -8.115 2.403 1.00 . A A . 11 ARG HD3 1 1 26 16158 1 1 11 ARG HE H -1.707 -10.122 2.426 1.00 . A A . 11 ARG HE 1 1 26 16159 1 1 11 ARG HG2 H -0.594 -8.453 -0.585 1.00 . A A . 11 ARG HG2 1 1 26 16160 1 1 11 ARG HG3 H -0.631 -6.950 0.339 1.00 . A A . 11 ARG HG3 1 1 26 16161 1 1 11 ARG HH11 H 0.517 -10.102 -0.264 1.00 . A A . 11 ARG HH11 1 1 26 16162 1 1 11 ARG HH12 H 0.232 -11.760 -0.673 1.00 . A A . 11 ARG HH12 1 1 26 16163 1 1 11 ARG HH21 H -2.083 -12.303 1.889 1.00 . A A . 11 ARG HH21 1 1 26 16164 1 1 11 ARG HH22 H -1.244 -13.010 0.549 1.00 . A A . 11 ARG HH22 1 1 26 16165 1 1 11 ARG N N -3.316 -5.681 0.234 1.00 . A A . 11 ARG N 1 1 26 16166 1 1 11 ARG NE N -1.065 -10.020 1.693 1.00 . A A . 11 ARG NE 1 1 26 16167 1 1 11 ARG NH1 N 0.049 -10.968 -0.090 1.00 . A A . 11 ARG NH1 1 1 26 16168 1 1 11 ARG NH2 N -1.431 -12.222 1.135 1.00 . A A . 11 ARG NH2 1 1 26 16169 1 1 11 ARG O O -4.632 -7.108 -2.407 1.00 . A A . 11 ARG O 1 1 26 16170 1 1 12 GLN C C -7.599 -8.464 0.109 1.00 . A A . 12 GLN C 1 1 26 16171 1 1 12 GLN CA C -6.494 -8.535 -0.946 1.00 . A A . 12 GLN CA 1 1 26 16172 1 1 12 GLN CB C -6.326 -9.980 -1.411 1.00 . A A . 12 GLN CB 1 1 26 16173 1 1 12 GLN CD C -5.536 -11.541 -3.233 1.00 . A A . 12 GLN CD 1 1 26 16174 1 1 12 GLN CG C -5.572 -10.113 -2.724 1.00 . A A . 12 GLN CG 1 1 26 16175 1 1 12 GLN H H -4.978 -8.189 0.493 1.00 . A A . 12 GLN H 1 1 26 16176 1 1 12 GLN HA H -6.782 -7.929 -1.791 1.00 . A A . 12 GLN HA 1 1 26 16177 1 1 12 GLN HB2 H -5.785 -10.526 -0.652 1.00 . A A . 12 GLN HB2 1 1 26 16178 1 1 12 GLN HB3 H -7.303 -10.422 -1.534 1.00 . A A . 12 GLN HB3 1 1 26 16179 1 1 12 GLN HE21 H -7.070 -11.175 -4.443 1.00 . A A . 12 GLN HE21 1 1 26 16180 1 1 12 GLN HE22 H -6.439 -12.782 -4.496 1.00 . A A . 12 GLN HE22 1 1 26 16181 1 1 12 GLN HG2 H -6.055 -9.495 -3.466 1.00 . A A . 12 GLN HG2 1 1 26 16182 1 1 12 GLN HG3 H -4.557 -9.772 -2.578 1.00 . A A . 12 GLN HG3 1 1 26 16183 1 1 12 GLN N N -5.225 -8.024 -0.441 1.00 . A A . 12 GLN N 1 1 26 16184 1 1 12 GLN NE2 N -6.440 -11.865 -4.150 1.00 . A A . 12 GLN NE2 1 1 26 16185 1 1 12 GLN O O -8.685 -9.006 -0.092 1.00 . A A . 12 GLN O 1 1 26 16186 1 1 12 GLN OE1 O -4.705 -12.343 -2.806 1.00 . A A . 12 GLN OE1 1 1 26 16187 1 1 13 CYS C C -7.824 -6.787 3.434 1.00 . A A . 13 CYS C 1 1 26 16188 1 1 13 CYS CA C -8.318 -7.677 2.293 1.00 . A A . 13 CYS CA 1 1 26 16189 1 1 13 CYS CB C -8.686 -9.061 2.834 1.00 . A A . 13 CYS CB 1 1 26 16190 1 1 13 CYS H H -6.449 -7.384 1.341 1.00 . A A . 13 CYS H 1 1 26 16191 1 1 13 CYS HA H -9.200 -7.228 1.866 1.00 . A A . 13 CYS HA 1 1 26 16192 1 1 13 CYS HB2 H -7.924 -9.768 2.543 1.00 . A A . 13 CYS HB2 1 1 26 16193 1 1 13 CYS HB3 H -8.737 -9.018 3.912 1.00 . A A . 13 CYS HB3 1 1 26 16194 1 1 13 CYS N N -7.326 -7.799 1.229 1.00 . A A . 13 CYS N 1 1 26 16195 1 1 13 CYS O O -8.618 -6.103 4.079 1.00 . A A . 13 CYS O 1 1 26 16196 1 1 13 CYS SG S -10.285 -9.693 2.228 1.00 . A A . 13 CYS SG 1 1 26 16197 1 1 14 LYS C C -4.771 -5.167 4.256 1.00 . A A . 14 LYS C 1 1 26 16198 1 1 14 LYS CA C -5.952 -5.987 4.758 1.00 . A A . 14 LYS CA 1 1 26 16199 1 1 14 LYS CB C -5.511 -6.878 5.921 1.00 . A A . 14 LYS CB 1 1 26 16200 1 1 14 LYS CD C -7.187 -6.139 7.641 1.00 . A A . 14 LYS CD 1 1 26 16201 1 1 14 LYS CE C -7.674 -7.388 8.358 1.00 . A A . 14 LYS CE 1 1 26 16202 1 1 14 LYS CG C -5.712 -6.240 7.286 1.00 . A A . 14 LYS CG 1 1 26 16203 1 1 14 LYS H H -5.924 -7.362 3.149 1.00 . A A . 14 LYS H 1 1 26 16204 1 1 14 LYS HA H -6.720 -5.313 5.106 1.00 . A A . 14 LYS HA 1 1 26 16205 1 1 14 LYS HB2 H -6.076 -7.797 5.890 1.00 . A A . 14 LYS HB2 1 1 26 16206 1 1 14 LYS HB3 H -4.461 -7.106 5.806 1.00 . A A . 14 LYS HB3 1 1 26 16207 1 1 14 LYS HD2 H -7.335 -5.286 8.286 1.00 . A A . 14 LYS HD2 1 1 26 16208 1 1 14 LYS HD3 H -7.758 -6.010 6.733 1.00 . A A . 14 LYS HD3 1 1 26 16209 1 1 14 LYS HE2 H -7.036 -8.215 8.086 1.00 . A A . 14 LYS HE2 1 1 26 16210 1 1 14 LYS HE3 H -7.614 -7.222 9.424 1.00 . A A . 14 LYS HE3 1 1 26 16211 1 1 14 LYS HG2 H -5.214 -6.842 8.031 1.00 . A A . 14 LYS HG2 1 1 26 16212 1 1 14 LYS HG3 H -5.284 -5.248 7.276 1.00 . A A . 14 LYS HG3 1 1 26 16213 1 1 14 LYS HZ1 H -9.632 -6.850 7.865 1.00 . A A . 14 LYS HZ1 1 1 26 16214 1 1 14 LYS HZ2 H -9.103 -8.271 7.116 1.00 . A A . 14 LYS HZ2 1 1 26 16215 1 1 14 LYS HZ3 H -9.518 -8.285 8.755 1.00 . A A . 14 LYS HZ3 1 1 26 16216 1 1 14 LYS N N -6.518 -6.798 3.687 1.00 . A A . 14 LYS N 1 1 26 16217 1 1 14 LYS NZ N -9.080 -7.722 7.998 1.00 . A A . 14 LYS NZ 1 1 26 16218 1 1 14 LYS O O -3.959 -5.651 3.467 1.00 . A A . 14 LYS O 1 1 26 16219 1 1 15 LEU C C -2.246 -3.753 4.410 1.00 . A A . 15 LEU C 1 1 26 16220 1 1 15 LEU CA C -3.591 -3.037 4.316 1.00 . A A . 15 LEU CA 1 1 26 16221 1 1 15 LEU CB C -3.568 -1.754 5.167 1.00 . A A . 15 LEU CB 1 1 26 16222 1 1 15 LEU CD1 C -5.446 -1.849 6.846 1.00 . A A . 15 LEU CD1 1 1 26 16223 1 1 15 LEU CD2 C -3.357 -3.174 7.250 1.00 . A A . 15 LEU CD2 1 1 26 16224 1 1 15 LEU CG C -3.937 -1.898 6.653 1.00 . A A . 15 LEU CG 1 1 26 16225 1 1 15 LEU H H -5.356 -3.598 5.344 1.00 . A A . 15 LEU H 1 1 26 16226 1 1 15 LEU HA H -3.761 -2.764 3.286 1.00 . A A . 15 LEU HA 1 1 26 16227 1 1 15 LEU HB2 H -2.573 -1.337 5.111 1.00 . A A . 15 LEU HB2 1 1 26 16228 1 1 15 LEU HB3 H -4.254 -1.049 4.721 1.00 . A A . 15 LEU HB3 1 1 26 16229 1 1 15 LEU HD11 H -5.917 -1.539 5.925 1.00 . A A . 15 LEU HD11 1 1 26 16230 1 1 15 LEU HD12 H -5.806 -2.828 7.123 1.00 . A A . 15 LEU HD12 1 1 26 16231 1 1 15 LEU HD13 H -5.685 -1.143 7.628 1.00 . A A . 15 LEU HD13 1 1 26 16232 1 1 15 LEU HD21 H -2.285 -3.175 7.124 1.00 . A A . 15 LEU HD21 1 1 26 16233 1 1 15 LEU HD22 H -3.595 -3.218 8.302 1.00 . A A . 15 LEU HD22 1 1 26 16234 1 1 15 LEU HD23 H -3.779 -4.033 6.751 1.00 . A A . 15 LEU HD23 1 1 26 16235 1 1 15 LEU HG H -3.515 -1.062 7.194 1.00 . A A . 15 LEU HG 1 1 26 16236 1 1 15 LEU N N -4.679 -3.923 4.719 1.00 . A A . 15 LEU N 1 1 26 16237 1 1 15 LEU O O -1.982 -4.475 5.371 1.00 . A A . 15 LEU O 1 1 26 16238 1 1 16 LYS C C 0.667 -3.931 4.678 1.00 . A A . 16 LYS C 1 1 26 16239 1 1 16 LYS CA C -0.093 -4.207 3.380 1.00 . A A . 16 LYS CA 1 1 26 16240 1 1 16 LYS CB C 0.724 -3.721 2.181 1.00 . A A . 16 LYS CB 1 1 26 16241 1 1 16 LYS CD C 1.357 -4.086 -0.224 1.00 . A A . 16 LYS CD 1 1 26 16242 1 1 16 LYS CE C 0.647 -4.563 -1.480 1.00 . A A . 16 LYS CE 1 1 26 16243 1 1 16 LYS CG C 0.755 -4.709 1.026 1.00 . A A . 16 LYS CG 1 1 26 16244 1 1 16 LYS H H -1.665 -2.987 2.653 1.00 . A A . 16 LYS H 1 1 26 16245 1 1 16 LYS HA H -0.256 -5.272 3.288 1.00 . A A . 16 LYS HA 1 1 26 16246 1 1 16 LYS HB2 H 0.300 -2.795 1.823 1.00 . A A . 16 LYS HB2 1 1 26 16247 1 1 16 LYS HB3 H 1.740 -3.541 2.499 1.00 . A A . 16 LYS HB3 1 1 26 16248 1 1 16 LYS HD2 H 1.267 -3.012 -0.158 1.00 . A A . 16 LYS HD2 1 1 26 16249 1 1 16 LYS HD3 H 2.400 -4.360 -0.284 1.00 . A A . 16 LYS HD3 1 1 26 16250 1 1 16 LYS HE2 H 0.429 -5.616 -1.378 1.00 . A A . 16 LYS HE2 1 1 26 16251 1 1 16 LYS HE3 H -0.278 -4.014 -1.586 1.00 . A A . 16 LYS HE3 1 1 26 16252 1 1 16 LYS HG2 H 1.350 -5.563 1.312 1.00 . A A . 16 LYS HG2 1 1 26 16253 1 1 16 LYS HG3 H -0.254 -5.027 0.809 1.00 . A A . 16 LYS HG3 1 1 26 16254 1 1 16 LYS HZ1 H 2.140 -3.570 -2.551 1.00 . A A . 16 LYS HZ1 1 1 26 16255 1 1 16 LYS HZ2 H 2.019 -5.218 -2.913 1.00 . A A . 16 LYS HZ2 1 1 26 16256 1 1 16 LYS HZ3 H 0.867 -4.134 -3.513 1.00 . A A . 16 LYS HZ3 1 1 26 16257 1 1 16 LYS N N -1.402 -3.564 3.401 1.00 . A A . 16 LYS N 1 1 26 16258 1 1 16 LYS NZ N 1.476 -4.357 -2.699 1.00 . A A . 16 LYS NZ 1 1 26 16259 1 1 16 LYS O O 0.603 -2.828 5.219 1.00 . A A . 16 LYS O 1 1 26 16260 1 1 17 PRO C C 3.055 -3.550 6.434 1.00 . A A . 17 PRO C 1 1 26 16261 1 1 17 PRO CA C 2.163 -4.787 6.440 1.00 . A A . 17 PRO CA 1 1 26 16262 1 1 17 PRO CB C 3.016 -6.056 6.483 1.00 . A A . 17 PRO CB 1 1 26 16263 1 1 17 PRO CD C 1.529 -6.284 4.621 1.00 . A A . 17 PRO CD 1 1 26 16264 1 1 17 PRO CG C 2.247 -7.057 5.693 1.00 . A A . 17 PRO CG 1 1 26 16265 1 1 17 PRO HA H 1.515 -4.757 7.304 1.00 . A A . 17 PRO HA 1 1 26 16266 1 1 17 PRO HB2 H 3.981 -5.859 6.039 1.00 . A A . 17 PRO HB2 1 1 26 16267 1 1 17 PRO HB3 H 3.142 -6.374 7.507 1.00 . A A . 17 PRO HB3 1 1 26 16268 1 1 17 PRO HD2 H 2.118 -6.259 3.716 1.00 . A A . 17 PRO HD2 1 1 26 16269 1 1 17 PRO HD3 H 0.559 -6.718 4.429 1.00 . A A . 17 PRO HD3 1 1 26 16270 1 1 17 PRO HG2 H 2.924 -7.772 5.249 1.00 . A A . 17 PRO HG2 1 1 26 16271 1 1 17 PRO HG3 H 1.536 -7.560 6.332 1.00 . A A . 17 PRO HG3 1 1 26 16272 1 1 17 PRO N N 1.396 -4.933 5.199 1.00 . A A . 17 PRO N 1 1 26 16273 1 1 17 PRO O O 3.813 -3.325 5.490 1.00 . A A . 17 PRO O 1 1 26 16274 1 1 18 ALA C C 5.228 -1.815 7.285 1.00 . A A . 18 ALA C 1 1 26 16275 1 1 18 ALA CA C 3.765 -1.538 7.616 1.00 . A A . 18 ALA CA 1 1 26 16276 1 1 18 ALA CB C 3.639 -0.959 9.017 1.00 . A A . 18 ALA CB 1 1 26 16277 1 1 18 ALA H H 2.341 -2.985 8.216 1.00 . A A . 18 ALA H 1 1 26 16278 1 1 18 ALA HA H 3.379 -0.812 6.915 1.00 . A A . 18 ALA HA 1 1 26 16279 1 1 18 ALA HB1 H 4.433 -0.247 9.185 1.00 . A A . 18 ALA HB1 1 1 26 16280 1 1 18 ALA HB2 H 3.710 -1.756 9.743 1.00 . A A . 18 ALA HB2 1 1 26 16281 1 1 18 ALA HB3 H 2.684 -0.465 9.118 1.00 . A A . 18 ALA HB3 1 1 26 16282 1 1 18 ALA N N 2.962 -2.752 7.495 1.00 . A A . 18 ALA N 1 1 26 16283 1 1 18 ALA O O 5.948 -2.433 8.070 1.00 . A A . 18 ALA O 1 1 26 16284 1 1 19 GLY C C 7.116 -2.452 4.455 1.00 . A A . 19 GLY C 1 1 26 16285 1 1 19 GLY CA C 7.028 -1.575 5.689 1.00 . A A . 19 GLY CA 1 1 26 16286 1 1 19 GLY H H 5.035 -0.881 5.529 1.00 . A A . 19 GLY H 1 1 26 16287 1 1 19 GLY HA2 H 7.574 -2.046 6.493 1.00 . A A . 19 GLY HA2 1 1 26 16288 1 1 19 GLY HA3 H 7.480 -0.618 5.472 1.00 . A A . 19 GLY HA3 1 1 26 16289 1 1 19 GLY N N 5.657 -1.361 6.113 1.00 . A A . 19 GLY N 1 1 26 16290 1 1 19 GLY O O 8.133 -3.105 4.219 1.00 . A A . 19 GLY O 1 1 26 16291 1 1 20 THR C C 5.626 -2.382 1.259 1.00 . A A . 20 THR C 1 1 26 16292 1 1 20 THR CA C 6.000 -3.260 2.446 1.00 . A A . 20 THR CA 1 1 26 16293 1 1 20 THR CB C 4.994 -4.402 2.592 1.00 . A A . 20 THR CB 1 1 26 16294 1 1 20 THR CG2 C 5.270 -5.566 1.665 1.00 . A A . 20 THR CG2 1 1 26 16295 1 1 20 THR H H 5.270 -1.920 3.903 1.00 . A A . 20 THR H 1 1 26 16296 1 1 20 THR HA H 6.984 -3.673 2.280 1.00 . A A . 20 THR HA 1 1 26 16297 1 1 20 THR HB H 4.005 -4.028 2.367 1.00 . A A . 20 THR HB 1 1 26 16298 1 1 20 THR HG1 H 4.087 -4.937 4.244 1.00 . A A . 20 THR HG1 1 1 26 16299 1 1 20 THR HG21 H 6.009 -5.275 0.933 1.00 . A A . 20 THR HG21 1 1 26 16300 1 1 20 THR HG22 H 5.642 -6.402 2.239 1.00 . A A . 20 THR HG22 1 1 26 16301 1 1 20 THR HG23 H 4.358 -5.851 1.163 1.00 . A A . 20 THR HG23 1 1 26 16302 1 1 20 THR N N 6.047 -2.464 3.664 1.00 . A A . 20 THR N 1 1 26 16303 1 1 20 THR O O 4.687 -1.591 1.333 1.00 . A A . 20 THR O 1 1 26 16304 1 1 20 THR OG1 O 4.990 -4.900 3.918 1.00 . A A . 20 THR OG1 1 1 26 16305 1 1 21 THR C C 4.667 -1.833 -1.476 1.00 . A A . 21 THR C 1 1 26 16306 1 1 21 THR CA C 6.121 -1.726 -1.028 1.00 . A A . 21 THR CA 1 1 26 16307 1 1 21 THR CB C 7.053 -2.159 -2.159 1.00 . A A . 21 THR CB 1 1 26 16308 1 1 21 THR CG2 C 7.912 -1.027 -2.670 1.00 . A A . 21 THR CG2 1 1 26 16309 1 1 21 THR H H 7.111 -3.160 0.173 1.00 . A A . 21 THR H 1 1 26 16310 1 1 21 THR HA H 6.329 -0.697 -0.785 1.00 . A A . 21 THR HA 1 1 26 16311 1 1 21 THR HB H 6.460 -2.524 -2.986 1.00 . A A . 21 THR HB 1 1 26 16312 1 1 21 THR HG1 H 8.197 -3.713 -2.496 1.00 . A A . 21 THR HG1 1 1 26 16313 1 1 21 THR HG21 H 8.017 -0.282 -1.894 1.00 . A A . 21 THR HG21 1 1 26 16314 1 1 21 THR HG22 H 8.885 -1.406 -2.941 1.00 . A A . 21 THR HG22 1 1 26 16315 1 1 21 THR HG23 H 7.442 -0.582 -3.535 1.00 . A A . 21 THR HG23 1 1 26 16316 1 1 21 THR N N 6.371 -2.518 0.170 1.00 . A A . 21 THR N 1 1 26 16317 1 1 21 THR O O 4.195 -2.911 -1.838 1.00 . A A . 21 THR O 1 1 26 16318 1 1 21 THR OG1 O 7.917 -3.199 -1.735 1.00 . A A . 21 THR OG1 1 1 26 16319 1 1 22 CYS C C 2.439 -0.208 -3.315 1.00 . A A . 22 CYS C 1 1 26 16320 1 1 22 CYS CA C 2.567 -0.670 -1.870 1.00 . A A . 22 CYS CA 1 1 26 16321 1 1 22 CYS CB C 1.754 0.254 -0.960 1.00 . A A . 22 CYS CB 1 1 26 16322 1 1 22 CYS H H 4.397 0.125 -1.165 1.00 . A A . 22 CYS H 1 1 26 16323 1 1 22 CYS HA H 2.177 -1.673 -1.791 1.00 . A A . 22 CYS HA 1 1 26 16324 1 1 22 CYS HB2 H 0.742 0.309 -1.332 1.00 . A A . 22 CYS HB2 1 1 26 16325 1 1 22 CYS HB3 H 1.742 -0.156 0.039 1.00 . A A . 22 CYS HB3 1 1 26 16326 1 1 22 CYS N N 3.964 -0.704 -1.457 1.00 . A A . 22 CYS N 1 1 26 16327 1 1 22 CYS O O 1.389 0.283 -3.726 1.00 . A A . 22 CYS O 1 1 26 16328 1 1 22 CYS SG S 2.392 1.958 -0.855 1.00 . A A . 22 CYS SG 1 1 26 16329 1 1 23 TRP C C 4.727 -0.469 -6.221 1.00 . A A . 23 TRP C 1 1 26 16330 1 1 23 TRP CA C 3.497 0.041 -5.483 1.00 . A A . 23 TRP CA 1 1 26 16331 1 1 23 TRP CB C 3.413 1.567 -5.591 1.00 . A A . 23 TRP CB 1 1 26 16332 1 1 23 TRP CD1 C 1.688 1.262 -7.457 1.00 . A A . 23 TRP CD1 1 1 26 16333 1 1 23 TRP CD2 C 1.998 3.388 -6.838 1.00 . A A . 23 TRP CD2 1 1 26 16334 1 1 23 TRP CE2 C 1.032 3.354 -7.861 1.00 . A A . 23 TRP CE2 1 1 26 16335 1 1 23 TRP CE3 C 2.357 4.622 -6.292 1.00 . A A . 23 TRP CE3 1 1 26 16336 1 1 23 TRP CG C 2.403 2.037 -6.593 1.00 . A A . 23 TRP CG 1 1 26 16337 1 1 23 TRP CH2 C 0.793 5.699 -7.795 1.00 . A A . 23 TRP CH2 1 1 26 16338 1 1 23 TRP CZ2 C 0.423 4.504 -8.347 1.00 . A A . 23 TRP CZ2 1 1 26 16339 1 1 23 TRP CZ3 C 1.751 5.765 -6.777 1.00 . A A . 23 TRP CZ3 1 1 26 16340 1 1 23 TRP H H 4.322 -0.764 -3.709 1.00 . A A . 23 TRP H 1 1 26 16341 1 1 23 TRP HA H 2.623 -0.389 -5.937 1.00 . A A . 23 TRP HA 1 1 26 16342 1 1 23 TRP HB2 H 3.141 1.975 -4.629 1.00 . A A . 23 TRP HB2 1 1 26 16343 1 1 23 TRP HB3 H 4.378 1.956 -5.882 1.00 . A A . 23 TRP HB3 1 1 26 16344 1 1 23 TRP HD1 H 1.774 0.190 -7.516 1.00 . A A . 23 TRP HD1 1 1 26 16345 1 1 23 TRP HE1 H 0.246 1.718 -8.912 1.00 . A A . 23 TRP HE1 1 1 26 16346 1 1 23 TRP HE3 H 3.092 4.692 -5.506 1.00 . A A . 23 TRP HE3 1 1 26 16347 1 1 23 TRP HH2 H 0.349 6.617 -8.146 1.00 . A A . 23 TRP HH2 1 1 26 16348 1 1 23 TRP HZ2 H -0.320 4.469 -9.129 1.00 . A A . 23 TRP HZ2 1 1 26 16349 1 1 23 TRP HZ3 H 2.017 6.729 -6.369 1.00 . A A . 23 TRP HZ3 1 1 26 16350 1 1 23 TRP N N 3.510 -0.366 -4.086 1.00 . A A . 23 TRP N 1 1 26 16351 1 1 23 TRP NE1 N 0.860 2.044 -8.221 1.00 . A A . 23 TRP NE1 1 1 26 16352 1 1 23 TRP O O 4.638 -1.383 -7.041 1.00 . A A . 23 TRP O 1 1 26 16353 1 1 24 LYS C C 7.038 -0.047 -8.082 1.00 . A A . 24 LYS C 1 1 26 16354 1 1 24 LYS CA C 7.120 -0.253 -6.572 1.00 . A A . 24 LYS CA 1 1 26 16355 1 1 24 LYS CB C 7.445 -1.713 -6.257 1.00 . A A . 24 LYS CB 1 1 26 16356 1 1 24 LYS CD C 9.770 -1.514 -7.191 1.00 . A A . 24 LYS CD 1 1 26 16357 1 1 24 LYS CE C 11.254 -1.574 -6.866 1.00 . A A . 24 LYS CE 1 1 26 16358 1 1 24 LYS CG C 8.923 -1.971 -6.014 1.00 . A A . 24 LYS CG 1 1 26 16359 1 1 24 LYS H H 5.873 0.855 -5.273 1.00 . A A . 24 LYS H 1 1 26 16360 1 1 24 LYS HA H 7.905 0.374 -6.176 1.00 . A A . 24 LYS HA 1 1 26 16361 1 1 24 LYS HB2 H 6.900 -2.005 -5.372 1.00 . A A . 24 LYS HB2 1 1 26 16362 1 1 24 LYS HB3 H 7.125 -2.327 -7.085 1.00 . A A . 24 LYS HB3 1 1 26 16363 1 1 24 LYS HD2 H 9.570 -2.155 -8.036 1.00 . A A . 24 LYS HD2 1 1 26 16364 1 1 24 LYS HD3 H 9.505 -0.496 -7.438 1.00 . A A . 24 LYS HD3 1 1 26 16365 1 1 24 LYS HE2 H 11.456 -2.492 -6.334 1.00 . A A . 24 LYS HE2 1 1 26 16366 1 1 24 LYS HE3 H 11.812 -1.565 -7.791 1.00 . A A . 24 LYS HE3 1 1 26 16367 1 1 24 LYS HG2 H 9.232 -1.432 -5.131 1.00 . A A . 24 LYS HG2 1 1 26 16368 1 1 24 LYS HG3 H 9.073 -3.030 -5.863 1.00 . A A . 24 LYS HG3 1 1 26 16369 1 1 24 LYS HZ1 H 11.175 0.437 -6.309 1.00 . A A . 24 LYS HZ1 1 1 26 16370 1 1 24 LYS HZ2 H 11.487 -0.618 -5.024 1.00 . A A . 24 LYS HZ2 1 1 26 16371 1 1 24 LYS HZ3 H 12.707 -0.262 -6.140 1.00 . A A . 24 LYS HZ3 1 1 26 16372 1 1 24 LYS N N 5.871 0.133 -5.930 1.00 . A A . 24 LYS N 1 1 26 16373 1 1 24 LYS NZ N 11.686 -0.424 -6.026 1.00 . A A . 24 LYS NZ 1 1 26 16374 1 1 24 LYS O O 7.747 -0.700 -8.847 1.00 . A A . 24 LYS O 1 1 26 16375 1 1 25 THR C C 7.312 1.620 -10.540 1.00 . A A . 25 THR C 1 1 26 16376 1 1 25 THR CA C 5.995 1.161 -9.922 1.00 . A A . 25 THR CA 1 1 26 16377 1 1 25 THR CB C 4.915 2.231 -10.118 1.00 . A A . 25 THR CB 1 1 26 16378 1 1 25 THR CG2 C 4.670 2.581 -11.569 1.00 . A A . 25 THR CG2 1 1 26 16379 1 1 25 THR H H 5.632 1.358 -7.847 1.00 . A A . 25 THR H 1 1 26 16380 1 1 25 THR HA H 5.680 0.252 -10.411 1.00 . A A . 25 THR HA 1 1 26 16381 1 1 25 THR HB H 5.216 3.135 -9.608 1.00 . A A . 25 THR HB 1 1 26 16382 1 1 25 THR HG1 H 3.834 1.409 -8.707 1.00 . A A . 25 THR HG1 1 1 26 16383 1 1 25 THR HG21 H 5.529 2.297 -12.159 1.00 . A A . 25 THR HG21 1 1 26 16384 1 1 25 THR HG22 H 3.798 2.052 -11.925 1.00 . A A . 25 THR HG22 1 1 26 16385 1 1 25 THR HG23 H 4.507 3.645 -11.660 1.00 . A A . 25 THR HG23 1 1 26 16386 1 1 25 THR N N 6.168 0.868 -8.504 1.00 . A A . 25 THR N 1 1 26 16387 1 1 25 THR O O 8.094 2.328 -9.905 1.00 . A A . 25 THR O 1 1 26 16388 1 1 25 THR OG1 O 3.682 1.803 -9.569 1.00 . A A . 25 THR OG1 1 1 26 16389 1 1 26 SER C C 9.085 3.058 -12.355 1.00 . A A . 26 SER C 1 1 26 16390 1 1 26 SER CA C 8.782 1.567 -12.488 1.00 . A A . 26 SER CA 1 1 26 16391 1 1 26 SER CB C 8.670 1.190 -13.966 1.00 . A A . 26 SER CB 1 1 26 16392 1 1 26 SER H H 6.894 0.640 -12.232 1.00 . A A . 26 SER H 1 1 26 16393 1 1 26 SER HA H 9.593 1.008 -12.046 1.00 . A A . 26 SER HA 1 1 26 16394 1 1 26 SER HB2 H 8.294 0.181 -14.050 1.00 . A A . 26 SER HB2 1 1 26 16395 1 1 26 SER HB3 H 7.989 1.869 -14.458 1.00 . A A . 26 SER HB3 1 1 26 16396 1 1 26 SER HG H 10.306 2.136 -14.481 1.00 . A A . 26 SER HG 1 1 26 16397 1 1 26 SER N N 7.555 1.206 -11.781 1.00 . A A . 26 SER N 1 1 26 16398 1 1 26 SER O O 10.243 3.472 -12.412 1.00 . A A . 26 SER O 1 1 26 16399 1 1 26 SER OG O 9.931 1.262 -14.608 1.00 . A A . 26 SER OG 1 1 26 16400 1 1 27 VAL C C 7.867 5.777 -10.632 1.00 . A A . 27 VAL C 1 1 26 16401 1 1 27 VAL CA C 8.199 5.302 -12.045 1.00 . A A . 27 VAL CA 1 1 26 16402 1 1 27 VAL CB C 7.307 6.061 -13.047 1.00 . A A . 27 VAL CB 1 1 26 16403 1 1 27 VAL CG1 C 5.836 5.774 -12.780 1.00 . A A . 27 VAL CG1 1 1 26 16404 1 1 27 VAL CG2 C 7.584 7.556 -12.985 1.00 . A A . 27 VAL CG2 1 1 26 16405 1 1 27 VAL H H 7.139 3.474 -12.147 1.00 . A A . 27 VAL H 1 1 26 16406 1 1 27 VAL HA H 9.230 5.544 -12.261 1.00 . A A . 27 VAL HA 1 1 26 16407 1 1 27 VAL HB H 7.543 5.714 -14.043 1.00 . A A . 27 VAL HB 1 1 26 16408 1 1 27 VAL HG11 H 5.590 6.069 -11.770 1.00 . A A . 27 VAL HG11 1 1 26 16409 1 1 27 VAL HG12 H 5.228 6.332 -13.477 1.00 . A A . 27 VAL HG12 1 1 26 16410 1 1 27 VAL HG13 H 5.648 4.718 -12.904 1.00 . A A . 27 VAL HG13 1 1 26 16411 1 1 27 VAL HG21 H 8.638 7.734 -13.140 1.00 . A A . 27 VAL HG21 1 1 26 16412 1 1 27 VAL HG22 H 7.017 8.060 -13.754 1.00 . A A . 27 VAL HG22 1 1 26 16413 1 1 27 VAL HG23 H 7.294 7.936 -12.016 1.00 . A A . 27 VAL HG23 1 1 26 16414 1 1 27 VAL N N 8.039 3.860 -12.181 1.00 . A A . 27 VAL N 1 1 26 16415 1 1 27 VAL O O 8.215 6.894 -10.251 1.00 . A A . 27 VAL O 1 1 26 16416 1 1 28 SER C C 6.829 4.101 -7.559 1.00 . A A . 28 SER C 1 1 26 16417 1 1 28 SER CA C 6.803 5.303 -8.502 1.00 . A A . 28 SER CA 1 1 26 16418 1 1 28 SER CB C 5.408 5.934 -8.505 1.00 . A A . 28 SER CB 1 1 26 16419 1 1 28 SER H H 6.918 4.061 -10.214 1.00 . A A . 28 SER H 1 1 26 16420 1 1 28 SER HA H 7.513 6.035 -8.149 1.00 . A A . 28 SER HA 1 1 26 16421 1 1 28 SER HB2 H 5.053 6.012 -9.522 1.00 . A A . 28 SER HB2 1 1 26 16422 1 1 28 SER HB3 H 4.732 5.314 -7.934 1.00 . A A . 28 SER HB3 1 1 26 16423 1 1 28 SER HG H 4.610 7.682 -8.127 1.00 . A A . 28 SER HG 1 1 26 16424 1 1 28 SER N N 7.182 4.936 -9.861 1.00 . A A . 28 SER N 1 1 26 16425 1 1 28 SER O O 5.928 3.264 -7.579 1.00 . A A . 28 SER O 1 1 26 16426 1 1 28 SER OG O 5.434 7.229 -7.932 1.00 . A A . 28 SER OG 1 1 26 16427 1 1 29 SER C C 7.694 3.469 -4.343 1.00 . A A . 29 SER C 1 1 26 16428 1 1 29 SER CA C 7.984 2.953 -5.749 1.00 . A A . 29 SER CA 1 1 26 16429 1 1 29 SER CB C 9.387 2.346 -5.808 1.00 . A A . 29 SER CB 1 1 26 16430 1 1 29 SER H H 8.533 4.745 -6.735 1.00 . A A . 29 SER H 1 1 26 16431 1 1 29 SER HA H 7.256 2.194 -6.000 1.00 . A A . 29 SER HA 1 1 26 16432 1 1 29 SER HB2 H 10.087 3.012 -5.325 1.00 . A A . 29 SER HB2 1 1 26 16433 1 1 29 SER HB3 H 9.387 1.394 -5.298 1.00 . A A . 29 SER HB3 1 1 26 16434 1 1 29 SER HG H 9.082 1.753 -7.650 1.00 . A A . 29 SER HG 1 1 26 16435 1 1 29 SER N N 7.855 4.038 -6.717 1.00 . A A . 29 SER N 1 1 26 16436 1 1 29 SER O O 8.459 4.260 -3.791 1.00 . A A . 29 SER O 1 1 26 16437 1 1 29 SER OG O 9.801 2.145 -7.148 1.00 . A A . 29 SER OG 1 1 26 16438 1 1 30 HIS C C 5.952 2.302 -1.506 1.00 . A A . 30 HIS C 1 1 26 16439 1 1 30 HIS CA C 6.161 3.481 -2.452 1.00 . A A . 30 HIS CA 1 1 26 16440 1 1 30 HIS CB C 4.876 4.301 -2.567 1.00 . A A . 30 HIS CB 1 1 26 16441 1 1 30 HIS CD2 C 5.362 5.306 -4.905 1.00 . A A . 30 HIS CD2 1 1 26 16442 1 1 30 HIS CE1 C 4.791 7.379 -4.497 1.00 . A A . 30 HIS CE1 1 1 26 16443 1 1 30 HIS CG C 4.955 5.367 -3.616 1.00 . A A . 30 HIS CG 1 1 26 16444 1 1 30 HIS H H 5.990 2.427 -4.277 1.00 . A A . 30 HIS H 1 1 26 16445 1 1 30 HIS HA H 6.943 4.111 -2.056 1.00 . A A . 30 HIS HA 1 1 26 16446 1 1 30 HIS HB2 H 4.059 3.642 -2.824 1.00 . A A . 30 HIS HB2 1 1 26 16447 1 1 30 HIS HB3 H 4.669 4.776 -1.619 1.00 . A A . 30 HIS HB3 1 1 26 16448 1 1 30 HIS HD1 H 4.264 7.046 -2.547 1.00 . A A . 30 HIS HD1 1 1 26 16449 1 1 30 HIS HD2 H 5.702 4.421 -5.426 1.00 . A A . 30 HIS HD2 1 1 26 16450 1 1 30 HIS HE1 H 4.600 8.434 -4.619 1.00 . A A . 30 HIS HE1 1 1 26 16451 1 1 30 HIS HE2 H 5.643 6.862 -6.279 1.00 . A A . 30 HIS HE2 1 1 26 16452 1 1 30 HIS N N 6.570 3.039 -3.780 1.00 . A A . 30 HIS N 1 1 26 16453 1 1 30 HIS ND1 N 4.603 6.680 -3.391 1.00 . A A . 30 HIS ND1 1 1 26 16454 1 1 30 HIS NE2 N 5.253 6.569 -5.430 1.00 . A A . 30 HIS NE2 1 1 26 16455 1 1 30 HIS O O 5.860 1.153 -1.938 1.00 . A A . 30 HIS O 1 1 26 16456 1 1 31 TYR C C 4.391 1.802 1.580 1.00 . A A . 31 TYR C 1 1 26 16457 1 1 31 TYR CA C 5.685 1.570 0.806 1.00 . A A . 31 TYR CA 1 1 26 16458 1 1 31 TYR CB C 6.871 1.546 1.772 1.00 . A A . 31 TYR CB 1 1 26 16459 1 1 31 TYR CD1 C 8.995 1.297 0.430 1.00 . A A . 31 TYR CD1 1 1 26 16460 1 1 31 TYR CD2 C 8.200 -0.596 1.641 1.00 . A A . 31 TYR CD2 1 1 26 16461 1 1 31 TYR CE1 C 10.068 0.558 -0.030 1.00 . A A . 31 TYR CE1 1 1 26 16462 1 1 31 TYR CE2 C 9.271 -1.341 1.186 1.00 . A A . 31 TYR CE2 1 1 26 16463 1 1 31 TYR CG C 8.044 0.734 1.272 1.00 . A A . 31 TYR CG 1 1 26 16464 1 1 31 TYR CZ C 10.202 -0.760 0.351 1.00 . A A . 31 TYR CZ 1 1 26 16465 1 1 31 TYR H H 5.962 3.535 0.069 1.00 . A A . 31 TYR H 1 1 26 16466 1 1 31 TYR HA H 5.622 0.618 0.306 1.00 . A A . 31 TYR HA 1 1 26 16467 1 1 31 TYR HB2 H 7.214 2.557 1.935 1.00 . A A . 31 TYR HB2 1 1 26 16468 1 1 31 TYR HB3 H 6.551 1.124 2.713 1.00 . A A . 31 TYR HB3 1 1 26 16469 1 1 31 TYR HD1 H 8.887 2.330 0.133 1.00 . A A . 31 TYR HD1 1 1 26 16470 1 1 31 TYR HD2 H 7.469 -1.049 2.295 1.00 . A A . 31 TYR HD2 1 1 26 16471 1 1 31 TYR HE1 H 10.797 1.014 -0.684 1.00 . A A . 31 TYR HE1 1 1 26 16472 1 1 31 TYR HE2 H 9.376 -2.374 1.485 1.00 . A A . 31 TYR HE2 1 1 26 16473 1 1 31 TYR HH H 11.263 -1.515 -1.064 1.00 . A A . 31 TYR HH 1 1 26 16474 1 1 31 TYR N N 5.880 2.599 -0.210 1.00 . A A . 31 TYR N 1 1 26 16475 1 1 31 TYR O O 3.900 2.928 1.665 1.00 . A A . 31 TYR O 1 1 26 16476 1 1 31 TYR OH O 11.270 -1.499 -0.104 1.00 . A A . 31 TYR OH 1 1 26 16477 1 1 32 CYS C C 2.903 1.082 4.379 1.00 . A A . 32 CYS C 1 1 26 16478 1 1 32 CYS CA C 2.608 0.814 2.909 1.00 . A A . 32 CYS CA 1 1 26 16479 1 1 32 CYS CB C 1.805 -0.481 2.768 1.00 . A A . 32 CYS CB 1 1 26 16480 1 1 32 CYS H H 4.281 -0.141 2.041 1.00 . A A . 32 CYS H 1 1 26 16481 1 1 32 CYS HA H 2.026 1.633 2.515 1.00 . A A . 32 CYS HA 1 1 26 16482 1 1 32 CYS HB2 H 2.048 -0.945 1.824 1.00 . A A . 32 CYS HB2 1 1 26 16483 1 1 32 CYS HB3 H 2.075 -1.151 3.571 1.00 . A A . 32 CYS HB3 1 1 26 16484 1 1 32 CYS N N 3.843 0.729 2.143 1.00 . A A . 32 CYS N 1 1 26 16485 1 1 32 CYS O O 4.020 0.867 4.849 1.00 . A A . 32 CYS O 1 1 26 16486 1 1 32 CYS SG S -0.002 -0.249 2.821 1.00 . A A . 32 CYS SG 1 1 26 16487 1 1 33 THR C C 1.129 0.940 7.351 1.00 . A A . 33 THR C 1 1 26 16488 1 1 33 THR CA C 2.038 1.840 6.520 1.00 . A A . 33 THR CA 1 1 26 16489 1 1 33 THR CB C 1.712 3.310 6.797 1.00 . A A . 33 THR CB 1 1 26 16490 1 1 33 THR CG2 C 2.267 4.256 5.754 1.00 . A A . 33 THR CG2 1 1 26 16491 1 1 33 THR H H 1.025 1.693 4.670 1.00 . A A . 33 THR H 1 1 26 16492 1 1 33 THR HA H 3.064 1.649 6.796 1.00 . A A . 33 THR HA 1 1 26 16493 1 1 33 THR HB H 2.134 3.587 7.753 1.00 . A A . 33 THR HB 1 1 26 16494 1 1 33 THR HG1 H 0.124 4.336 7.308 1.00 . A A . 33 THR HG1 1 1 26 16495 1 1 33 THR HG21 H 3.334 4.110 5.666 1.00 . A A . 33 THR HG21 1 1 26 16496 1 1 33 THR HG22 H 1.797 4.058 4.802 1.00 . A A . 33 THR HG22 1 1 26 16497 1 1 33 THR HG23 H 2.067 5.275 6.049 1.00 . A A . 33 THR HG23 1 1 26 16498 1 1 33 THR N N 1.892 1.548 5.101 1.00 . A A . 33 THR N 1 1 26 16499 1 1 33 THR O O 0.842 1.234 8.511 1.00 . A A . 33 THR O 1 1 26 16500 1 1 33 THR OG1 O 0.311 3.510 6.856 1.00 . A A . 33 THR OG1 1 1 26 16501 1 1 34 GLY C C -1.323 -0.388 8.189 1.00 . A A . 34 GLY C 1 1 26 16502 1 1 34 GLY CA C -0.199 -1.087 7.445 1.00 . A A . 34 GLY CA 1 1 26 16503 1 1 34 GLY H H 0.940 -0.343 5.819 1.00 . A A . 34 GLY H 1 1 26 16504 1 1 34 GLY HA2 H 0.387 -1.653 8.154 1.00 . A A . 34 GLY HA2 1 1 26 16505 1 1 34 GLY HA3 H -0.630 -1.768 6.726 1.00 . A A . 34 GLY HA3 1 1 26 16506 1 1 34 GLY N N 0.676 -0.159 6.747 1.00 . A A . 34 GLY N 1 1 26 16507 1 1 34 GLY O O -1.644 -0.748 9.321 1.00 . A A . 34 GLY O 1 1 26 16508 1 1 35 ARG C C -4.232 1.409 7.261 1.00 . A A . 35 ARG C 1 1 26 16509 1 1 35 ARG CA C -3.006 1.370 8.167 1.00 . A A . 35 ARG CA 1 1 26 16510 1 1 35 ARG CB C -2.550 2.795 8.486 1.00 . A A . 35 ARG CB 1 1 26 16511 1 1 35 ARG CD C -4.668 3.425 9.683 1.00 . A A . 35 ARG CD 1 1 26 16512 1 1 35 ARG CG C -3.152 3.354 9.765 1.00 . A A . 35 ARG CG 1 1 26 16513 1 1 35 ARG CZ C -5.116 5.814 10.088 1.00 . A A . 35 ARG CZ 1 1 26 16514 1 1 35 ARG H H -1.615 0.861 6.653 1.00 . A A . 35 ARG H 1 1 26 16515 1 1 35 ARG HA H -3.271 0.875 9.085 1.00 . A A . 35 ARG HA 1 1 26 16516 1 1 35 ARG HB2 H -1.475 2.803 8.586 1.00 . A A . 35 ARG HB2 1 1 26 16517 1 1 35 ARG HB3 H -2.832 3.443 7.669 1.00 . A A . 35 ARG HB3 1 1 26 16518 1 1 35 ARG HD2 H -4.954 3.548 8.649 1.00 . A A . 35 ARG HD2 1 1 26 16519 1 1 35 ARG HD3 H -5.080 2.501 10.062 1.00 . A A . 35 ARG HD3 1 1 26 16520 1 1 35 ARG HE H -5.659 4.326 11.302 1.00 . A A . 35 ARG HE 1 1 26 16521 1 1 35 ARG HG2 H -2.876 2.715 10.590 1.00 . A A . 35 ARG HG2 1 1 26 16522 1 1 35 ARG HG3 H -2.762 4.348 9.931 1.00 . A A . 35 ARG HG3 1 1 26 16523 1 1 35 ARG HH11 H -4.118 5.428 8.372 1.00 . A A . 35 ARG HH11 1 1 26 16524 1 1 35 ARG HH12 H -4.446 7.100 8.679 1.00 . A A . 35 ARG HH12 1 1 26 16525 1 1 35 ARG HH21 H -6.092 6.525 11.709 1.00 . A A . 35 ARG HH21 1 1 26 16526 1 1 35 ARG HH22 H -5.566 7.724 10.574 1.00 . A A . 35 ARG HH22 1 1 26 16527 1 1 35 ARG N N -1.917 0.618 7.553 1.00 . A A . 35 ARG N 1 1 26 16528 1 1 35 ARG NE N -5.207 4.539 10.460 1.00 . A A . 35 ARG NE 1 1 26 16529 1 1 35 ARG NH1 N -4.510 6.141 8.953 1.00 . A A . 35 ARG NH1 1 1 26 16530 1 1 35 ARG NH2 N -5.634 6.766 10.853 1.00 . A A . 35 ARG NH2 1 1 26 16531 1 1 35 ARG O O -5.361 1.236 7.722 1.00 . A A . 35 ARG O 1 1 26 16532 1 1 36 SER C C -4.667 1.157 3.651 1.00 . A A . 36 SER C 1 1 26 16533 1 1 36 SER CA C -5.097 1.704 5.008 1.00 . A A . 36 SER CA 1 1 26 16534 1 1 36 SER CB C -5.585 3.146 4.857 1.00 . A A . 36 SER CB 1 1 26 16535 1 1 36 SER H H -3.085 1.771 5.668 1.00 . A A . 36 SER H 1 1 26 16536 1 1 36 SER HA H -5.908 1.099 5.385 1.00 . A A . 36 SER HA 1 1 26 16537 1 1 36 SER HB2 H -4.744 3.818 4.934 1.00 . A A . 36 SER HB2 1 1 26 16538 1 1 36 SER HB3 H -6.054 3.265 3.891 1.00 . A A . 36 SER HB3 1 1 26 16539 1 1 36 SER HG H -7.384 3.629 5.465 1.00 . A A . 36 SER HG 1 1 26 16540 1 1 36 SER N N -4.006 1.639 5.974 1.00 . A A . 36 SER N 1 1 26 16541 1 1 36 SER O O -3.487 0.894 3.421 1.00 . A A . 36 SER O 1 1 26 16542 1 1 36 SER OG O -6.525 3.476 5.865 1.00 . A A . 36 SER OG 1 1 26 16543 1 1 37 CYS C C -4.846 1.573 0.492 1.00 . A A . 37 CYS C 1 1 26 16544 1 1 37 CYS CA C -5.365 0.473 1.419 1.00 . A A . 37 CYS CA 1 1 26 16545 1 1 37 CYS CB C -6.633 -0.146 0.827 1.00 . A A . 37 CYS CB 1 1 26 16546 1 1 37 CYS H H -6.557 1.216 3.001 1.00 . A A . 37 CYS H 1 1 26 16547 1 1 37 CYS HA H -4.610 -0.294 1.506 1.00 . A A . 37 CYS HA 1 1 26 16548 1 1 37 CYS HB2 H -6.978 -0.934 1.479 1.00 . A A . 37 CYS HB2 1 1 26 16549 1 1 37 CYS HB3 H -7.396 0.615 0.758 1.00 . A A . 37 CYS HB3 1 1 26 16550 1 1 37 CYS N N -5.636 0.988 2.756 1.00 . A A . 37 CYS N 1 1 26 16551 1 1 37 CYS O O -4.473 1.306 -0.650 1.00 . A A . 37 CYS O 1 1 26 16552 1 1 37 CYS SG S -6.407 -0.859 -0.834 1.00 . A A . 37 CYS SG 1 1 26 16553 1 1 38 GLU C C -2.836 4.046 0.228 1.00 . A A . 38 GLU C 1 1 26 16554 1 1 38 GLU CA C -4.358 3.938 0.191 1.00 . A A . 38 GLU CA 1 1 26 16555 1 1 38 GLU CB C -4.983 5.239 0.699 1.00 . A A . 38 GLU CB 1 1 26 16556 1 1 38 GLU CD C -7.101 6.467 1.320 1.00 . A A . 38 GLU CD 1 1 26 16557 1 1 38 GLU CG C -6.476 5.133 0.964 1.00 . A A . 38 GLU CG 1 1 26 16558 1 1 38 GLU H H -5.139 2.966 1.900 1.00 . A A . 38 GLU H 1 1 26 16559 1 1 38 GLU HA H -4.669 3.776 -0.830 1.00 . A A . 38 GLU HA 1 1 26 16560 1 1 38 GLU HB2 H -4.495 5.524 1.619 1.00 . A A . 38 GLU HB2 1 1 26 16561 1 1 38 GLU HB3 H -4.824 6.013 -0.037 1.00 . A A . 38 GLU HB3 1 1 26 16562 1 1 38 GLU HG2 H -6.960 4.751 0.078 1.00 . A A . 38 GLU HG2 1 1 26 16563 1 1 38 GLU HG3 H -6.635 4.447 1.784 1.00 . A A . 38 GLU HG3 1 1 26 16564 1 1 38 GLU N N -4.827 2.809 0.985 1.00 . A A . 38 GLU N 1 1 26 16565 1 1 38 GLU O O -2.258 4.489 1.220 1.00 . A A . 38 GLU O 1 1 26 16566 1 1 38 GLU OE1 O -6.839 6.967 2.434 1.00 . A A . 38 GLU OE1 1 1 26 16567 1 1 38 GLU OE2 O -7.851 7.013 0.483 1.00 . A A . 38 GLU OE2 1 1 26 16568 1 1 39 CYS C C -0.279 5.146 -1.179 1.00 . A A . 39 CYS C 1 1 26 16569 1 1 39 CYS CA C -0.739 3.703 -0.963 1.00 . A A . 39 CYS CA 1 1 26 16570 1 1 39 CYS CB C -0.251 2.813 -2.112 1.00 . A A . 39 CYS CB 1 1 26 16571 1 1 39 CYS H H -2.710 3.306 -1.626 1.00 . A A . 39 CYS H 1 1 26 16572 1 1 39 CYS HA H -0.329 3.338 -0.034 1.00 . A A . 39 CYS HA 1 1 26 16573 1 1 39 CYS HB2 H -0.487 1.784 -1.883 1.00 . A A . 39 CYS HB2 1 1 26 16574 1 1 39 CYS HB3 H -0.765 3.099 -3.020 1.00 . A A . 39 CYS HB3 1 1 26 16575 1 1 39 CYS N N -2.193 3.644 -0.865 1.00 . A A . 39 CYS N 1 1 26 16576 1 1 39 CYS O O -0.705 5.801 -2.131 1.00 . A A . 39 CYS O 1 1 26 16577 1 1 39 CYS SG S 1.541 2.907 -2.437 1.00 . A A . 39 CYS SG 1 1 26 16578 1 1 40 PRO C C 1.468 7.428 -1.827 1.00 . A A . 40 PRO C 1 1 26 16579 1 1 40 PRO CA C 1.101 7.039 -0.398 1.00 . A A . 40 PRO CA 1 1 26 16580 1 1 40 PRO CB C 2.344 7.010 0.488 1.00 . A A . 40 PRO CB 1 1 26 16581 1 1 40 PRO CD C 1.157 4.962 0.876 1.00 . A A . 40 PRO CD 1 1 26 16582 1 1 40 PRO CG C 2.030 6.000 1.536 1.00 . A A . 40 PRO CG 1 1 26 16583 1 1 40 PRO HA H 0.392 7.752 -0.003 1.00 . A A . 40 PRO HA 1 1 26 16584 1 1 40 PRO HB2 H 3.202 6.719 -0.101 1.00 . A A . 40 PRO HB2 1 1 26 16585 1 1 40 PRO HB3 H 2.507 7.987 0.918 1.00 . A A . 40 PRO HB3 1 1 26 16586 1 1 40 PRO HD2 H 1.749 4.115 0.566 1.00 . A A . 40 PRO HD2 1 1 26 16587 1 1 40 PRO HD3 H 0.372 4.649 1.548 1.00 . A A . 40 PRO HD3 1 1 26 16588 1 1 40 PRO HG2 H 2.943 5.547 1.894 1.00 . A A . 40 PRO HG2 1 1 26 16589 1 1 40 PRO HG3 H 1.499 6.470 2.351 1.00 . A A . 40 PRO HG3 1 1 26 16590 1 1 40 PRO N N 0.595 5.667 -0.295 1.00 . A A . 40 PRO N 1 1 26 16591 1 1 40 PRO O O 1.946 6.602 -2.603 1.00 . A A . 40 PRO O 1 1 26 16592 1 1 41 SER C C 2.906 9.880 -3.533 1.00 . A A . 41 SER C 1 1 26 16593 1 1 41 SER CA C 1.543 9.196 -3.500 1.00 . A A . 41 SER CA 1 1 26 16594 1 1 41 SER CB C 0.459 10.173 -3.959 1.00 . A A . 41 SER CB 1 1 26 16595 1 1 41 SER H H 0.855 9.304 -1.501 1.00 . A A . 41 SER H 1 1 26 16596 1 1 41 SER HA H 1.561 8.352 -4.174 1.00 . A A . 41 SER HA 1 1 26 16597 1 1 41 SER HB2 H 0.450 11.031 -3.303 1.00 . A A . 41 SER HB2 1 1 26 16598 1 1 41 SER HB3 H 0.670 10.494 -4.968 1.00 . A A . 41 SER HB3 1 1 26 16599 1 1 41 SER HG H -0.769 8.690 -4.322 1.00 . A A . 41 SER HG 1 1 26 16600 1 1 41 SER N N 1.239 8.694 -2.165 1.00 . A A . 41 SER N 1 1 26 16601 1 1 41 SER O O 3.156 10.746 -4.372 1.00 . A A . 41 SER O 1 1 26 16602 1 1 41 SER OG O -0.821 9.565 -3.931 1.00 . A A . 41 SER OG 1 1 26 16603 1 1 42 TYR C C 6.168 8.974 -2.291 1.00 . A A . 42 TYR C 1 1 26 16604 1 1 42 TYR CA C 5.125 10.060 -2.548 1.00 . A A . 42 TYR CA 1 1 26 16605 1 1 42 TYR CB C 5.191 11.123 -1.448 1.00 . A A . 42 TYR CB 1 1 26 16606 1 1 42 TYR CD1 C 6.128 9.949 0.581 1.00 . A A . 42 TYR CD1 1 1 26 16607 1 1 42 TYR CD2 C 3.849 10.646 0.638 1.00 . A A . 42 TYR CD2 1 1 26 16608 1 1 42 TYR CE1 C 6.007 9.434 1.858 1.00 . A A . 42 TYR CE1 1 1 26 16609 1 1 42 TYR CE2 C 3.721 10.135 1.916 1.00 . A A . 42 TYR CE2 1 1 26 16610 1 1 42 TYR CG C 5.053 10.562 -0.050 1.00 . A A . 42 TYR CG 1 1 26 16611 1 1 42 TYR CZ C 4.802 9.530 2.521 1.00 . A A . 42 TYR CZ 1 1 26 16612 1 1 42 TYR H H 3.533 8.790 -1.977 1.00 . A A . 42 TYR H 1 1 26 16613 1 1 42 TYR HA H 5.334 10.526 -3.499 1.00 . A A . 42 TYR HA 1 1 26 16614 1 1 42 TYR HB2 H 6.140 11.634 -1.507 1.00 . A A . 42 TYR HB2 1 1 26 16615 1 1 42 TYR HB3 H 4.394 11.837 -1.600 1.00 . A A . 42 TYR HB3 1 1 26 16616 1 1 42 TYR HD1 H 7.071 9.875 0.059 1.00 . A A . 42 TYR HD1 1 1 26 16617 1 1 42 TYR HD2 H 3.004 11.120 0.161 1.00 . A A . 42 TYR HD2 1 1 26 16618 1 1 42 TYR HE1 H 6.855 8.961 2.331 1.00 . A A . 42 TYR HE1 1 1 26 16619 1 1 42 TYR HE2 H 2.777 10.210 2.434 1.00 . A A . 42 TYR HE2 1 1 26 16620 1 1 42 TYR HH H 5.441 9.275 4.316 1.00 . A A . 42 TYR HH 1 1 26 16621 1 1 42 TYR N N 3.787 9.486 -2.618 1.00 . A A . 42 TYR N 1 1 26 16622 1 1 42 TYR O O 5.903 8.005 -1.580 1.00 . A A . 42 TYR O 1 1 26 16623 1 1 42 TYR OH O 4.678 9.019 3.792 1.00 . A A . 42 TYR OH 1 1 26 16624 1 1 43 PRO C C 9.048 8.181 -1.292 1.00 . A A . 43 PRO C 1 1 26 16625 1 1 43 PRO CA C 8.454 8.146 -2.696 1.00 . A A . 43 PRO CA 1 1 26 16626 1 1 43 PRO CB C 9.494 8.584 -3.728 1.00 . A A . 43 PRO CB 1 1 26 16627 1 1 43 PRO CD C 7.777 10.247 -3.732 1.00 . A A . 43 PRO CD 1 1 26 16628 1 1 43 PRO CG C 9.258 10.044 -3.901 1.00 . A A . 43 PRO CG 1 1 26 16629 1 1 43 PRO HA H 8.121 7.143 -2.919 1.00 . A A . 43 PRO HA 1 1 26 16630 1 1 43 PRO HB2 H 10.486 8.384 -3.351 1.00 . A A . 43 PRO HB2 1 1 26 16631 1 1 43 PRO HB3 H 9.338 8.047 -4.652 1.00 . A A . 43 PRO HB3 1 1 26 16632 1 1 43 PRO HD2 H 7.579 11.193 -3.250 1.00 . A A . 43 PRO HD2 1 1 26 16633 1 1 43 PRO HD3 H 7.278 10.197 -4.688 1.00 . A A . 43 PRO HD3 1 1 26 16634 1 1 43 PRO HG2 H 9.801 10.596 -3.148 1.00 . A A . 43 PRO HG2 1 1 26 16635 1 1 43 PRO HG3 H 9.568 10.352 -4.889 1.00 . A A . 43 PRO HG3 1 1 26 16636 1 1 43 PRO N N 7.374 9.121 -2.868 1.00 . A A . 43 PRO N 1 1 26 16637 1 1 43 PRO O O 9.236 9.250 -0.713 1.00 . A A . 43 PRO O 1 1 26 16638 1 1 44 GLY C C 11.329 7.459 0.640 1.00 . A A . 44 GLY C 1 1 26 16639 1 1 44 GLY CA C 9.913 6.921 0.581 1.00 . A A . 44 GLY CA 1 1 26 16640 1 1 44 GLY H H 9.172 6.184 -1.260 1.00 . A A . 44 GLY H 1 1 26 16641 1 1 44 GLY HA2 H 9.919 5.888 0.895 1.00 . A A . 44 GLY HA2 1 1 26 16642 1 1 44 GLY HA3 H 9.295 7.489 1.261 1.00 . A A . 44 GLY HA3 1 1 26 16643 1 1 44 GLY N N 9.343 7.003 -0.751 1.00 . A A . 44 GLY N 1 1 26 16644 1 1 44 GLY O O 11.712 8.112 1.611 1.00 . A A . 44 GLY O 1 1 26 16645 1 1 45 ASN C C 13.603 8.916 -1.300 1.00 . A A . 45 ASN C 1 1 26 16646 1 1 45 ASN CA C 13.490 7.646 -0.464 1.00 . A A . 45 ASN CA 1 1 26 16647 1 1 45 ASN CB C 14.388 6.554 -1.050 1.00 . A A . 45 ASN CB 1 1 26 16648 1 1 45 ASN CG C 14.243 5.233 -0.320 1.00 . A A . 45 ASN CG 1 1 26 16649 1 1 45 ASN H H 11.745 6.660 -1.145 1.00 . A A . 45 ASN H 1 1 26 16650 1 1 45 ASN HA H 13.813 7.862 0.544 1.00 . A A . 45 ASN HA 1 1 26 16651 1 1 45 ASN HB2 H 14.128 6.402 -2.087 1.00 . A A . 45 ASN HB2 1 1 26 16652 1 1 45 ASN HB3 H 15.419 6.871 -0.984 1.00 . A A . 45 ASN HB3 1 1 26 16653 1 1 45 ASN HD21 H 12.756 4.701 -1.528 1.00 . A A . 45 ASN HD21 1 1 26 16654 1 1 45 ASN HD22 H 13.184 3.551 -0.312 1.00 . A A . 45 ASN HD22 1 1 26 16655 1 1 45 ASN N N 12.108 7.185 -0.401 1.00 . A A . 45 ASN N 1 1 26 16656 1 1 45 ASN ND2 N 13.299 4.412 -0.765 1.00 . A A . 45 ASN ND2 1 1 26 16657 1 1 45 ASN O O 14.588 9.120 -2.009 1.00 . A A . 45 ASN O 1 1 26 16658 1 1 45 ASN OD1 O 14.972 4.953 0.631 1.00 . A A . 45 ASN OD1 1 1 26 16659 1 1 46 GLY C C 12.644 10.777 -3.463 1.00 . A A . 46 GLY C 1 1 26 16660 1 1 46 GLY CA C 12.591 11.008 -1.965 1.00 . A A . 46 GLY CA 1 1 26 16661 1 1 46 GLY H H 11.828 9.553 -0.630 1.00 . A A . 46 GLY H 1 1 26 16662 1 1 46 GLY HA2 H 13.452 11.592 -1.672 1.00 . A A . 46 GLY HA2 1 1 26 16663 1 1 46 GLY HA3 H 11.696 11.564 -1.729 1.00 . A A . 46 GLY HA3 1 1 26 16664 1 1 46 GLY N N 12.587 9.768 -1.212 1.00 . A A . 46 GLY N 1 1 26 16665 1 1 46 GLY O O 13.098 11.687 -4.188 1.00 . A A . 46 GLY O 1 1 26 16666 1 1 46 GLY OXT O 12.231 9.686 -3.910 1.00 . A A . 46 GLY OXT 1 1 27 16667 1 1 1 ALA C C -17.128 -7.450 4.466 1.00 . A A . 1 ALA C 1 1 27 16668 1 1 1 ALA CA C -16.549 -8.836 4.206 1.00 . A A . 1 ALA CA 1 1 27 16669 1 1 1 ALA CB C -17.009 -9.810 5.280 1.00 . A A . 1 ALA CB 1 1 27 16670 1 1 1 ALA H1 H -14.736 -8.211 4.950 1.00 . A A . 1 ALA H1 1 1 27 16671 1 1 1 ALA H2 H -14.716 -9.769 4.231 1.00 . A A . 1 ALA H2 1 1 27 16672 1 1 1 ALA H3 H -14.792 -8.367 3.244 1.00 . A A . 1 ALA H3 1 1 27 16673 1 1 1 ALA HA H -16.912 -9.192 3.253 1.00 . A A . 1 ALA HA 1 1 27 16674 1 1 1 ALA HB1 H -16.382 -9.704 6.154 1.00 . A A . 1 ALA HB1 1 1 27 16675 1 1 1 ALA HB2 H -18.034 -9.596 5.544 1.00 . A A . 1 ALA HB2 1 1 27 16676 1 1 1 ALA HB3 H -16.937 -10.820 4.905 1.00 . A A . 1 ALA HB3 1 1 27 16677 1 1 1 ALA N N -15.064 -8.792 4.153 1.00 . A A . 1 ALA N 1 1 27 16678 1 1 1 ALA O O -17.700 -6.827 3.571 1.00 . A A . 1 ALA O 1 1 27 16679 1 1 2 MET C C -16.809 -4.559 5.264 1.00 . A A . 2 MET C 1 1 27 16680 1 1 2 MET CA C -17.486 -5.659 6.075 1.00 . A A . 2 MET CA 1 1 27 16681 1 1 2 MET CB C -17.267 -5.415 7.570 1.00 . A A . 2 MET CB 1 1 27 16682 1 1 2 MET CE C -15.057 -3.689 9.884 1.00 . A A . 2 MET CE 1 1 27 16683 1 1 2 MET CG C -15.821 -5.580 8.008 1.00 . A A . 2 MET CG 1 1 27 16684 1 1 2 MET H H -16.513 -7.516 6.367 1.00 . A A . 2 MET H 1 1 27 16685 1 1 2 MET HA H -18.546 -5.642 5.868 1.00 . A A . 2 MET HA 1 1 27 16686 1 1 2 MET HB2 H -17.581 -4.409 7.808 1.00 . A A . 2 MET HB2 1 1 27 16687 1 1 2 MET HB3 H -17.872 -6.113 8.129 1.00 . A A . 2 MET HB3 1 1 27 16688 1 1 2 MET HE1 H -15.684 -4.437 10.346 1.00 . A A . 2 MET HE1 1 1 27 16689 1 1 2 MET HE2 H -14.070 -3.727 10.319 1.00 . A A . 2 MET HE2 1 1 27 16690 1 1 2 MET HE3 H -15.484 -2.710 10.046 1.00 . A A . 2 MET HE3 1 1 27 16691 1 1 2 MET HG2 H -15.805 -6.057 8.976 1.00 . A A . 2 MET HG2 1 1 27 16692 1 1 2 MET HG3 H -15.311 -6.207 7.291 1.00 . A A . 2 MET HG3 1 1 27 16693 1 1 2 MET N N -16.977 -6.972 5.697 1.00 . A A . 2 MET N 1 1 27 16694 1 1 2 MET O O -17.452 -3.595 4.849 1.00 . A A . 2 MET O 1 1 27 16695 1 1 2 MET SD S -14.947 -4.007 8.125 1.00 . A A . 2 MET SD 1 1 27 16696 1 1 3 ASP C C -13.325 -4.229 4.020 1.00 . A A . 3 ASP C 1 1 27 16697 1 1 3 ASP CA C -14.743 -3.729 4.281 1.00 . A A . 3 ASP CA 1 1 27 16698 1 1 3 ASP CB C -14.696 -2.396 5.029 1.00 . A A . 3 ASP CB 1 1 27 16699 1 1 3 ASP CG C -14.631 -1.208 4.088 1.00 . A A . 3 ASP CG 1 1 27 16700 1 1 3 ASP H H -15.050 -5.500 5.400 1.00 . A A . 3 ASP H 1 1 27 16701 1 1 3 ASP HA H -15.241 -3.584 3.334 1.00 . A A . 3 ASP HA 1 1 27 16702 1 1 3 ASP HB2 H -15.583 -2.300 5.637 1.00 . A A . 3 ASP HB2 1 1 27 16703 1 1 3 ASP HB3 H -13.824 -2.377 5.665 1.00 . A A . 3 ASP HB3 1 1 27 16704 1 1 3 ASP N N -15.507 -4.710 5.043 1.00 . A A . 3 ASP N 1 1 27 16705 1 1 3 ASP O O -12.620 -4.635 4.943 1.00 . A A . 3 ASP O 1 1 27 16706 1 1 3 ASP OD1 O -13.723 -0.367 4.256 1.00 . A A . 3 ASP OD1 1 1 27 16707 1 1 3 ASP OD2 O -15.488 -1.119 3.184 1.00 . A A . 3 ASP OD2 1 1 27 16708 1 1 4 CYS C C -10.684 -3.459 2.034 1.00 . A A . 4 CYS C 1 1 27 16709 1 1 4 CYS CA C -11.581 -4.643 2.373 1.00 . A A . 4 CYS CA 1 1 27 16710 1 1 4 CYS CB C -11.662 -5.591 1.176 1.00 . A A . 4 CYS CB 1 1 27 16711 1 1 4 CYS H H -13.523 -3.859 2.065 1.00 . A A . 4 CYS H 1 1 27 16712 1 1 4 CYS HA H -11.155 -5.173 3.212 1.00 . A A . 4 CYS HA 1 1 27 16713 1 1 4 CYS HB2 H -12.439 -5.251 0.508 1.00 . A A . 4 CYS HB2 1 1 27 16714 1 1 4 CYS HB3 H -10.716 -5.581 0.654 1.00 . A A . 4 CYS HB3 1 1 27 16715 1 1 4 CYS N N -12.915 -4.194 2.756 1.00 . A A . 4 CYS N 1 1 27 16716 1 1 4 CYS O O -9.477 -3.497 2.269 1.00 . A A . 4 CYS O 1 1 27 16717 1 1 4 CYS SG S -12.031 -7.320 1.618 1.00 . A A . 4 CYS SG 1 1 27 16718 1 1 5 THR C C -9.543 -1.531 -0.018 1.00 . A A . 5 THR C 1 1 27 16719 1 1 5 THR CA C -10.528 -1.215 1.101 1.00 . A A . 5 THR CA 1 1 27 16720 1 1 5 THR CB C -9.784 -0.648 2.313 1.00 . A A . 5 THR CB 1 1 27 16721 1 1 5 THR CG2 C -9.636 0.858 2.273 1.00 . A A . 5 THR CG2 1 1 27 16722 1 1 5 THR H H -12.244 -2.438 1.312 1.00 . A A . 5 THR H 1 1 27 16723 1 1 5 THR HA H -11.231 -0.478 0.745 1.00 . A A . 5 THR HA 1 1 27 16724 1 1 5 THR HB H -8.792 -1.077 2.346 1.00 . A A . 5 THR HB 1 1 27 16725 1 1 5 THR HG1 H -11.294 -0.519 3.553 1.00 . A A . 5 THR HG1 1 1 27 16726 1 1 5 THR HG21 H -9.519 1.182 1.249 1.00 . A A . 5 THR HG21 1 1 27 16727 1 1 5 THR HG22 H -10.516 1.318 2.698 1.00 . A A . 5 THR HG22 1 1 27 16728 1 1 5 THR HG23 H -8.766 1.150 2.844 1.00 . A A . 5 THR HG23 1 1 27 16729 1 1 5 THR N N -11.279 -2.408 1.477 1.00 . A A . 5 THR N 1 1 27 16730 1 1 5 THR O O -8.332 -1.415 0.154 1.00 . A A . 5 THR O 1 1 27 16731 1 1 5 THR OG1 O -10.454 -0.982 3.515 1.00 . A A . 5 THR OG1 1 1 27 16732 1 1 6 THR C C -8.359 -1.096 -2.723 1.00 . A A . 6 THR C 1 1 27 16733 1 1 6 THR CA C -9.239 -2.275 -2.315 1.00 . A A . 6 THR CA 1 1 27 16734 1 1 6 THR CB C -10.109 -2.710 -3.495 1.00 . A A . 6 THR CB 1 1 27 16735 1 1 6 THR CG2 C -10.761 -4.061 -3.289 1.00 . A A . 6 THR CG2 1 1 27 16736 1 1 6 THR H H -11.046 -2.011 -1.242 1.00 . A A . 6 THR H 1 1 27 16737 1 1 6 THR HA H -8.602 -3.098 -2.029 1.00 . A A . 6 THR HA 1 1 27 16738 1 1 6 THR HB H -9.491 -2.774 -4.380 1.00 . A A . 6 THR HB 1 1 27 16739 1 1 6 THR HG1 H -11.804 -1.831 -3.051 1.00 . A A . 6 THR HG1 1 1 27 16740 1 1 6 THR HG21 H -10.145 -4.663 -2.637 1.00 . A A . 6 THR HG21 1 1 27 16741 1 1 6 THR HG22 H -11.734 -3.926 -2.841 1.00 . A A . 6 THR HG22 1 1 27 16742 1 1 6 THR HG23 H -10.870 -4.557 -4.242 1.00 . A A . 6 THR HG23 1 1 27 16743 1 1 6 THR N N -10.072 -1.936 -1.167 1.00 . A A . 6 THR N 1 1 27 16744 1 1 6 THR O O -8.854 -0.001 -2.991 1.00 . A A . 6 THR O 1 1 27 16745 1 1 6 THR OG1 O -11.137 -1.766 -3.739 1.00 . A A . 6 THR OG1 1 1 27 16746 1 1 7 GLY C C -4.691 -0.788 -3.244 1.00 . A A . 7 GLY C 1 1 27 16747 1 1 7 GLY CA C -6.120 -0.283 -3.144 1.00 . A A . 7 GLY CA 1 1 27 16748 1 1 7 GLY H H -6.716 -2.224 -2.544 1.00 . A A . 7 GLY H 1 1 27 16749 1 1 7 GLY HA2 H -6.162 0.503 -2.405 1.00 . A A . 7 GLY HA2 1 1 27 16750 1 1 7 GLY HA3 H -6.416 0.120 -4.101 1.00 . A A . 7 GLY HA3 1 1 27 16751 1 1 7 GLY N N -7.051 -1.331 -2.768 1.00 . A A . 7 GLY N 1 1 27 16752 1 1 7 GLY O O -4.381 -1.875 -2.757 1.00 . A A . 7 GLY O 1 1 27 16753 1 1 8 PRO C C -1.730 -0.781 -2.711 1.00 . A A . 8 PRO C 1 1 27 16754 1 1 8 PRO CA C -2.388 -0.405 -4.039 1.00 . A A . 8 PRO CA 1 1 27 16755 1 1 8 PRO CB C -1.720 0.839 -4.647 1.00 . A A . 8 PRO CB 1 1 27 16756 1 1 8 PRO CD C -4.071 1.288 -4.494 1.00 . A A . 8 PRO CD 1 1 27 16757 1 1 8 PRO CG C -2.720 1.942 -4.523 1.00 . A A . 8 PRO CG 1 1 27 16758 1 1 8 PRO HA H -2.291 -1.234 -4.725 1.00 . A A . 8 PRO HA 1 1 27 16759 1 1 8 PRO HB2 H -0.818 1.067 -4.100 1.00 . A A . 8 PRO HB2 1 1 27 16760 1 1 8 PRO HB3 H -1.476 0.647 -5.682 1.00 . A A . 8 PRO HB3 1 1 27 16761 1 1 8 PRO HD2 H -4.756 1.863 -3.889 1.00 . A A . 8 PRO HD2 1 1 27 16762 1 1 8 PRO HD3 H -4.456 1.168 -5.496 1.00 . A A . 8 PRO HD3 1 1 27 16763 1 1 8 PRO HG2 H -2.550 2.491 -3.610 1.00 . A A . 8 PRO HG2 1 1 27 16764 1 1 8 PRO HG3 H -2.643 2.602 -5.375 1.00 . A A . 8 PRO HG3 1 1 27 16765 1 1 8 PRO N N -3.792 -0.016 -3.879 1.00 . A A . 8 PRO N 1 1 27 16766 1 1 8 PRO O O -0.803 -1.589 -2.678 1.00 . A A . 8 PRO O 1 1 27 16767 1 1 9 CYS C C -2.349 -1.724 0.316 1.00 . A A . 9 CYS C 1 1 27 16768 1 1 9 CYS CA C -1.677 -0.492 -0.291 1.00 . A A . 9 CYS CA 1 1 27 16769 1 1 9 CYS CB C -1.853 0.712 0.640 1.00 . A A . 9 CYS CB 1 1 27 16770 1 1 9 CYS H H -2.964 0.430 -1.702 1.00 . A A . 9 CYS H 1 1 27 16771 1 1 9 CYS HA H -0.623 -0.696 -0.404 1.00 . A A . 9 CYS HA 1 1 27 16772 1 1 9 CYS HB2 H -2.366 1.497 0.107 1.00 . A A . 9 CYS HB2 1 1 27 16773 1 1 9 CYS HB3 H -2.448 0.416 1.491 1.00 . A A . 9 CYS HB3 1 1 27 16774 1 1 9 CYS N N -2.219 -0.201 -1.617 1.00 . A A . 9 CYS N 1 1 27 16775 1 1 9 CYS O O -1.867 -2.282 1.302 1.00 . A A . 9 CYS O 1 1 27 16776 1 1 9 CYS SG S -0.289 1.404 1.274 1.00 . A A . 9 CYS SG 1 1 27 16777 1 1 10 CYS C C -3.760 -4.565 -0.549 1.00 . A A . 10 CYS C 1 1 27 16778 1 1 10 CYS CA C -4.196 -3.308 0.200 1.00 . A A . 10 CYS CA 1 1 27 16779 1 1 10 CYS CB C -5.699 -3.088 0.022 1.00 . A A . 10 CYS CB 1 1 27 16780 1 1 10 CYS H H -3.798 -1.660 -1.062 1.00 . A A . 10 CYS H 1 1 27 16781 1 1 10 CYS HA H -3.978 -3.432 1.251 1.00 . A A . 10 CYS HA 1 1 27 16782 1 1 10 CYS HB2 H -5.869 -2.073 -0.296 1.00 . A A . 10 CYS HB2 1 1 27 16783 1 1 10 CYS HB3 H -6.066 -3.761 -0.738 1.00 . A A . 10 CYS HB3 1 1 27 16784 1 1 10 CYS N N -3.462 -2.144 -0.279 1.00 . A A . 10 CYS N 1 1 27 16785 1 1 10 CYS O O -3.893 -4.646 -1.770 1.00 . A A . 10 CYS O 1 1 27 16786 1 1 10 CYS SG S -6.686 -3.367 1.529 1.00 . A A . 10 CYS SG 1 1 27 16787 1 1 11 ARG C C -3.934 -7.488 -1.148 1.00 . A A . 11 ARG C 1 1 27 16788 1 1 11 ARG CA C -2.786 -6.789 -0.418 1.00 . A A . 11 ARG CA 1 1 27 16789 1 1 11 ARG CB C -2.182 -7.710 0.649 1.00 . A A . 11 ARG CB 1 1 27 16790 1 1 11 ARG CD C -2.413 -10.199 0.936 1.00 . A A . 11 ARG CD 1 1 27 16791 1 1 11 ARG CG C -1.783 -9.080 0.122 1.00 . A A . 11 ARG CG 1 1 27 16792 1 1 11 ARG CZ C -0.854 -10.386 2.836 1.00 . A A . 11 ARG CZ 1 1 27 16793 1 1 11 ARG H H -3.157 -5.421 1.155 1.00 . A A . 11 ARG H 1 1 27 16794 1 1 11 ARG HA H -2.022 -6.544 -1.139 1.00 . A A . 11 ARG HA 1 1 27 16795 1 1 11 ARG HB2 H -1.301 -7.236 1.057 1.00 . A A . 11 ARG HB2 1 1 27 16796 1 1 11 ARG HB3 H -2.904 -7.846 1.441 1.00 . A A . 11 ARG HB3 1 1 27 16797 1 1 11 ARG HD2 H -3.486 -10.139 0.836 1.00 . A A . 11 ARG HD2 1 1 27 16798 1 1 11 ARG HD3 H -2.068 -11.147 0.549 1.00 . A A . 11 ARG HD3 1 1 27 16799 1 1 11 ARG HE H -2.765 -9.829 2.975 1.00 . A A . 11 ARG HE 1 1 27 16800 1 1 11 ARG HG2 H -2.108 -9.169 -0.904 1.00 . A A . 11 ARG HG2 1 1 27 16801 1 1 11 ARG HG3 H -0.708 -9.173 0.170 1.00 . A A . 11 ARG HG3 1 1 27 16802 1 1 11 ARG HH11 H -0.047 -10.852 1.040 1.00 . A A . 11 ARG HH11 1 1 27 16803 1 1 11 ARG HH12 H 1.028 -10.976 2.392 1.00 . A A . 11 ARG HH12 1 1 27 16804 1 1 11 ARG HH21 H -1.353 -9.991 4.754 1.00 . A A . 11 ARG HH21 1 1 27 16805 1 1 11 ARG HH22 H 0.287 -10.487 4.500 1.00 . A A . 11 ARG HH22 1 1 27 16806 1 1 11 ARG N N -3.239 -5.542 0.186 1.00 . A A . 11 ARG N 1 1 27 16807 1 1 11 ARG NE N -2.063 -10.110 2.352 1.00 . A A . 11 ARG NE 1 1 27 16808 1 1 11 ARG NH1 N 0.122 -10.770 2.022 1.00 . A A . 11 ARG NH1 1 1 27 16809 1 1 11 ARG NH2 N -0.621 -10.279 4.137 1.00 . A A . 11 ARG NH2 1 1 27 16810 1 1 11 ARG O O -4.116 -7.303 -2.351 1.00 . A A . 11 ARG O 1 1 27 16811 1 1 12 GLN C C -7.150 -8.553 -0.368 1.00 . A A . 12 GLN C 1 1 27 16812 1 1 12 GLN CA C -5.835 -9.001 -1.000 1.00 . A A . 12 GLN CA 1 1 27 16813 1 1 12 GLN CB C -5.657 -10.510 -0.819 1.00 . A A . 12 GLN CB 1 1 27 16814 1 1 12 GLN CD C -5.235 -11.156 -3.224 1.00 . A A . 12 GLN CD 1 1 27 16815 1 1 12 GLN CG C -4.687 -11.131 -1.811 1.00 . A A . 12 GLN CG 1 1 27 16816 1 1 12 GLN H H -4.516 -8.393 0.537 1.00 . A A . 12 GLN H 1 1 27 16817 1 1 12 GLN HA H -5.861 -8.775 -2.056 1.00 . A A . 12 GLN HA 1 1 27 16818 1 1 12 GLN HB2 H -5.289 -10.700 0.178 1.00 . A A . 12 GLN HB2 1 1 27 16819 1 1 12 GLN HB3 H -6.616 -10.991 -0.937 1.00 . A A . 12 GLN HB3 1 1 27 16820 1 1 12 GLN HE21 H -3.910 -12.546 -3.740 1.00 . A A . 12 GLN HE21 1 1 27 16821 1 1 12 GLN HE22 H -4.985 -12.033 -4.991 1.00 . A A . 12 GLN HE22 1 1 27 16822 1 1 12 GLN HG2 H -3.771 -10.559 -1.807 1.00 . A A . 12 GLN HG2 1 1 27 16823 1 1 12 GLN HG3 H -4.478 -12.146 -1.503 1.00 . A A . 12 GLN HG3 1 1 27 16824 1 1 12 GLN N N -4.706 -8.285 -0.417 1.00 . A A . 12 GLN N 1 1 27 16825 1 1 12 GLN NE2 N -4.651 -11.996 -4.071 1.00 . A A . 12 GLN NE2 1 1 27 16826 1 1 12 GLN O O -8.214 -8.677 -0.974 1.00 . A A . 12 GLN O 1 1 27 16827 1 1 12 GLN OE1 O -6.172 -10.429 -3.552 1.00 . A A . 12 GLN OE1 1 1 27 16828 1 1 13 CYS C C -7.883 -7.131 2.992 1.00 . A A . 13 CYS C 1 1 27 16829 1 1 13 CYS CA C -8.248 -7.566 1.574 1.00 . A A . 13 CYS CA 1 1 27 16830 1 1 13 CYS CB C -9.313 -8.668 1.622 1.00 . A A . 13 CYS CB 1 1 27 16831 1 1 13 CYS H H -6.192 -7.962 1.283 1.00 . A A . 13 CYS H 1 1 27 16832 1 1 13 CYS HA H -8.647 -6.715 1.041 1.00 . A A . 13 CYS HA 1 1 27 16833 1 1 13 CYS HB2 H -8.858 -9.608 1.350 1.00 . A A . 13 CYS HB2 1 1 27 16834 1 1 13 CYS HB3 H -9.704 -8.741 2.626 1.00 . A A . 13 CYS HB3 1 1 27 16835 1 1 13 CYS N N -7.068 -8.033 0.854 1.00 . A A . 13 CYS N 1 1 27 16836 1 1 13 CYS O O -8.668 -7.304 3.925 1.00 . A A . 13 CYS O 1 1 27 16837 1 1 13 CYS SG S -10.721 -8.392 0.498 1.00 . A A . 13 CYS SG 1 1 27 16838 1 1 14 LYS C C -5.118 -5.080 4.317 1.00 . A A . 14 LYS C 1 1 27 16839 1 1 14 LYS CA C -6.231 -6.113 4.459 1.00 . A A . 14 LYS CA 1 1 27 16840 1 1 14 LYS CB C -5.740 -7.301 5.290 1.00 . A A . 14 LYS CB 1 1 27 16841 1 1 14 LYS CD C -6.718 -9.323 6.419 1.00 . A A . 14 LYS CD 1 1 27 16842 1 1 14 LYS CE C -8.030 -9.879 6.947 1.00 . A A . 14 LYS CE 1 1 27 16843 1 1 14 LYS CG C -6.766 -7.809 6.290 1.00 . A A . 14 LYS CG 1 1 27 16844 1 1 14 LYS H H -6.101 -6.451 2.376 1.00 . A A . 14 LYS H 1 1 27 16845 1 1 14 LYS HA H -7.068 -5.655 4.962 1.00 . A A . 14 LYS HA 1 1 27 16846 1 1 14 LYS HB2 H -5.487 -8.112 4.624 1.00 . A A . 14 LYS HB2 1 1 27 16847 1 1 14 LYS HB3 H -4.855 -7.005 5.835 1.00 . A A . 14 LYS HB3 1 1 27 16848 1 1 14 LYS HD2 H -6.522 -9.751 5.448 1.00 . A A . 14 LYS HD2 1 1 27 16849 1 1 14 LYS HD3 H -5.923 -9.591 7.100 1.00 . A A . 14 LYS HD3 1 1 27 16850 1 1 14 LYS HE2 H -7.873 -10.901 7.260 1.00 . A A . 14 LYS HE2 1 1 27 16851 1 1 14 LYS HE3 H -8.342 -9.287 7.795 1.00 . A A . 14 LYS HE3 1 1 27 16852 1 1 14 LYS HG2 H -6.563 -7.369 7.255 1.00 . A A . 14 LYS HG2 1 1 27 16853 1 1 14 LYS HG3 H -7.752 -7.516 5.959 1.00 . A A . 14 LYS HG3 1 1 27 16854 1 1 14 LYS HZ1 H -8.914 -9.091 5.226 1.00 . A A . 14 LYS HZ1 1 1 27 16855 1 1 14 LYS HZ2 H -9.139 -10.757 5.410 1.00 . A A . 14 LYS HZ2 1 1 27 16856 1 1 14 LYS HZ3 H -10.025 -9.675 6.362 1.00 . A A . 14 LYS HZ3 1 1 27 16857 1 1 14 LYS N N -6.688 -6.566 3.152 1.00 . A A . 14 LYS N 1 1 27 16858 1 1 14 LYS NZ N -9.102 -9.848 5.914 1.00 . A A . 14 LYS NZ 1 1 27 16859 1 1 14 LYS O O -4.251 -5.200 3.451 1.00 . A A . 14 LYS O 1 1 27 16860 1 1 15 LEU C C -2.744 -3.586 5.310 1.00 . A A . 15 LEU C 1 1 27 16861 1 1 15 LEU CA C -4.147 -3.010 5.152 1.00 . A A . 15 LEU CA 1 1 27 16862 1 1 15 LEU CB C -4.429 -1.999 6.265 1.00 . A A . 15 LEU CB 1 1 27 16863 1 1 15 LEU CD1 C -6.153 -0.326 5.549 1.00 . A A . 15 LEU CD1 1 1 27 16864 1 1 15 LEU CD2 C -4.132 0.427 6.817 1.00 . A A . 15 LEU CD2 1 1 27 16865 1 1 15 LEU CG C -4.670 -0.564 5.795 1.00 . A A . 15 LEU CG 1 1 27 16866 1 1 15 LEU H H -5.867 -4.030 5.841 1.00 . A A . 15 LEU H 1 1 27 16867 1 1 15 LEU HA H -4.210 -2.510 4.199 1.00 . A A . 15 LEU HA 1 1 27 16868 1 1 15 LEU HB2 H -5.305 -2.329 6.804 1.00 . A A . 15 LEU HB2 1 1 27 16869 1 1 15 LEU HB3 H -3.590 -1.995 6.944 1.00 . A A . 15 LEU HB3 1 1 27 16870 1 1 15 LEU HD11 H -6.637 -1.267 5.335 1.00 . A A . 15 LEU HD11 1 1 27 16871 1 1 15 LEU HD12 H -6.597 0.115 6.429 1.00 . A A . 15 LEU HD12 1 1 27 16872 1 1 15 LEU HD13 H -6.276 0.341 4.709 1.00 . A A . 15 LEU HD13 1 1 27 16873 1 1 15 LEU HD21 H -3.991 -0.073 7.764 1.00 . A A . 15 LEU HD21 1 1 27 16874 1 1 15 LEU HD22 H -3.186 0.819 6.474 1.00 . A A . 15 LEU HD22 1 1 27 16875 1 1 15 LEU HD23 H -4.835 1.237 6.940 1.00 . A A . 15 LEU HD23 1 1 27 16876 1 1 15 LEU HG H -4.147 -0.404 4.864 1.00 . A A . 15 LEU HG 1 1 27 16877 1 1 15 LEU N N -5.150 -4.067 5.174 1.00 . A A . 15 LEU N 1 1 27 16878 1 1 15 LEU O O -2.405 -4.140 6.356 1.00 . A A . 15 LEU O 1 1 27 16879 1 1 16 LYS C C 0.220 -3.320 5.443 1.00 . A A . 16 LYS C 1 1 27 16880 1 1 16 LYS CA C -0.567 -3.959 4.298 1.00 . A A . 16 LYS CA 1 1 27 16881 1 1 16 LYS CB C 0.136 -3.686 2.967 1.00 . A A . 16 LYS CB 1 1 27 16882 1 1 16 LYS CD C 0.856 -4.732 0.798 1.00 . A A . 16 LYS CD 1 1 27 16883 1 1 16 LYS CE C 0.245 -4.801 -0.593 1.00 . A A . 16 LYS CE 1 1 27 16884 1 1 16 LYS CG C -0.216 -4.684 1.876 1.00 . A A . 16 LYS CG 1 1 27 16885 1 1 16 LYS H H -2.257 -2.999 3.460 1.00 . A A . 16 LYS H 1 1 27 16886 1 1 16 LYS HA H -0.620 -5.026 4.456 1.00 . A A . 16 LYS HA 1 1 27 16887 1 1 16 LYS HB2 H -0.137 -2.699 2.625 1.00 . A A . 16 LYS HB2 1 1 27 16888 1 1 16 LYS HB3 H 1.204 -3.719 3.124 1.00 . A A . 16 LYS HB3 1 1 27 16889 1 1 16 LYS HD2 H 1.465 -3.844 0.869 1.00 . A A . 16 LYS HD2 1 1 27 16890 1 1 16 LYS HD3 H 1.471 -5.606 0.955 1.00 . A A . 16 LYS HD3 1 1 27 16891 1 1 16 LYS HE2 H 0.792 -5.527 -1.177 1.00 . A A . 16 LYS HE2 1 1 27 16892 1 1 16 LYS HE3 H -0.785 -5.113 -0.506 1.00 . A A . 16 LYS HE3 1 1 27 16893 1 1 16 LYS HG2 H -0.312 -5.665 2.317 1.00 . A A . 16 LYS HG2 1 1 27 16894 1 1 16 LYS HG3 H -1.154 -4.396 1.427 1.00 . A A . 16 LYS HG3 1 1 27 16895 1 1 16 LYS HZ1 H 0.330 -2.714 -0.590 1.00 . A A . 16 LYS HZ1 1 1 27 16896 1 1 16 LYS HZ2 H 1.143 -3.431 -1.890 1.00 . A A . 16 LYS HZ2 1 1 27 16897 1 1 16 LYS HZ3 H -0.547 -3.362 -1.883 1.00 . A A . 16 LYS HZ3 1 1 27 16898 1 1 16 LYS N N -1.932 -3.451 4.267 1.00 . A A . 16 LYS N 1 1 27 16899 1 1 16 LYS NZ N 0.296 -3.485 -1.288 1.00 . A A . 16 LYS NZ 1 1 27 16900 1 1 16 LYS O O 0.071 -2.129 5.715 1.00 . A A . 16 LYS O 1 1 27 16901 1 1 17 PRO C C 2.818 -2.478 6.838 1.00 . A A . 17 PRO C 1 1 27 16902 1 1 17 PRO CA C 1.868 -3.596 7.256 1.00 . A A . 17 PRO CA 1 1 27 16903 1 1 17 PRO CB C 2.668 -4.820 7.720 1.00 . A A . 17 PRO CB 1 1 27 16904 1 1 17 PRO CD C 1.308 -5.534 5.888 1.00 . A A . 17 PRO CD 1 1 27 16905 1 1 17 PRO CG C 1.943 -5.998 7.167 1.00 . A A . 17 PRO CG 1 1 27 16906 1 1 17 PRO HA H 1.240 -3.248 8.063 1.00 . A A . 17 PRO HA 1 1 27 16907 1 1 17 PRO HB2 H 3.675 -4.761 7.333 1.00 . A A . 17 PRO HB2 1 1 27 16908 1 1 17 PRO HB3 H 2.694 -4.846 8.799 1.00 . A A . 17 PRO HB3 1 1 27 16909 1 1 17 PRO HD2 H 1.984 -5.675 5.057 1.00 . A A . 17 PRO HD2 1 1 27 16910 1 1 17 PRO HD3 H 0.380 -6.058 5.716 1.00 . A A . 17 PRO HD3 1 1 27 16911 1 1 17 PRO HG2 H 2.641 -6.798 6.969 1.00 . A A . 17 PRO HG2 1 1 27 16912 1 1 17 PRO HG3 H 1.185 -6.324 7.864 1.00 . A A . 17 PRO HG3 1 1 27 16913 1 1 17 PRO N N 1.067 -4.103 6.135 1.00 . A A . 17 PRO N 1 1 27 16914 1 1 17 PRO O O 3.600 -2.635 5.900 1.00 . A A . 17 PRO O 1 1 27 16915 1 1 18 ALA C C 5.055 -0.641 7.051 1.00 . A A . 18 ALA C 1 1 27 16916 1 1 18 ALA CA C 3.608 -0.206 7.256 1.00 . A A . 18 ALA CA 1 1 27 16917 1 1 18 ALA CB C 3.518 0.815 8.380 1.00 . A A . 18 ALA CB 1 1 27 16918 1 1 18 ALA H H 2.107 -1.288 8.281 1.00 . A A . 18 ALA H 1 1 27 16919 1 1 18 ALA HA H 3.250 0.260 6.349 1.00 . A A . 18 ALA HA 1 1 27 16920 1 1 18 ALA HB1 H 4.105 0.475 9.221 1.00 . A A . 18 ALA HB1 1 1 27 16921 1 1 18 ALA HB2 H 3.899 1.765 8.036 1.00 . A A . 18 ALA HB2 1 1 27 16922 1 1 18 ALA HB3 H 2.488 0.928 8.683 1.00 . A A . 18 ALA HB3 1 1 27 16923 1 1 18 ALA N N 2.749 -1.351 7.544 1.00 . A A . 18 ALA N 1 1 27 16924 1 1 18 ALA O O 5.681 -1.196 7.954 1.00 . A A . 18 ALA O 1 1 27 16925 1 1 19 GLY C C 7.031 -1.708 4.359 1.00 . A A . 19 GLY C 1 1 27 16926 1 1 19 GLY CA C 6.942 -0.769 5.548 1.00 . A A . 19 GLY CA 1 1 27 16927 1 1 19 GLY H H 5.027 0.049 5.176 1.00 . A A . 19 GLY H 1 1 27 16928 1 1 19 GLY HA2 H 7.374 -1.257 6.410 1.00 . A A . 19 GLY HA2 1 1 27 16929 1 1 19 GLY HA3 H 7.511 0.123 5.331 1.00 . A A . 19 GLY HA3 1 1 27 16930 1 1 19 GLY N N 5.577 -0.391 5.857 1.00 . A A . 19 GLY N 1 1 27 16931 1 1 19 GLY O O 8.115 -2.173 4.008 1.00 . A A . 19 GLY O 1 1 27 16932 1 1 20 THR C C 5.445 -2.098 1.329 1.00 . A A . 20 THR C 1 1 27 16933 1 1 20 THR CA C 5.847 -2.872 2.578 1.00 . A A . 20 THR CA 1 1 27 16934 1 1 20 THR CB C 4.865 -4.020 2.820 1.00 . A A . 20 THR CB 1 1 27 16935 1 1 20 THR CG2 C 4.827 -5.024 1.689 1.00 . A A . 20 THR CG2 1 1 27 16936 1 1 20 THR H H 5.054 -1.586 4.056 1.00 . A A . 20 THR H 1 1 27 16937 1 1 20 THR HA H 6.837 -3.279 2.433 1.00 . A A . 20 THR HA 1 1 27 16938 1 1 20 THR HB H 3.871 -3.612 2.934 1.00 . A A . 20 THR HB 1 1 27 16939 1 1 20 THR HG1 H 6.136 -4.921 4.008 1.00 . A A . 20 THR HG1 1 1 27 16940 1 1 20 THR HG21 H 4.938 -4.508 0.746 1.00 . A A . 20 THR HG21 1 1 27 16941 1 1 20 THR HG22 H 5.633 -5.733 1.809 1.00 . A A . 20 THR HG22 1 1 27 16942 1 1 20 THR HG23 H 3.882 -5.548 1.704 1.00 . A A . 20 THR HG23 1 1 27 16943 1 1 20 THR N N 5.888 -1.987 3.734 1.00 . A A . 20 THR N 1 1 27 16944 1 1 20 THR O O 4.426 -1.407 1.317 1.00 . A A . 20 THR O 1 1 27 16945 1 1 20 THR OG1 O 5.197 -4.721 4.006 1.00 . A A . 20 THR OG1 1 1 27 16946 1 1 21 THR C C 4.530 -1.699 -1.408 1.00 . A A . 21 THR C 1 1 27 16947 1 1 21 THR CA C 5.982 -1.515 -0.974 1.00 . A A . 21 THR CA 1 1 27 16948 1 1 21 THR CB C 6.922 -2.013 -2.071 1.00 . A A . 21 THR CB 1 1 27 16949 1 1 21 THR CG2 C 6.643 -3.435 -2.490 1.00 . A A . 21 THR CG2 1 1 27 16950 1 1 21 THR H H 7.052 -2.774 0.351 1.00 . A A . 21 THR H 1 1 27 16951 1 1 21 THR HA H 6.164 -0.468 -0.812 1.00 . A A . 21 THR HA 1 1 27 16952 1 1 21 THR HB H 7.939 -1.968 -1.709 1.00 . A A . 21 THR HB 1 1 27 16953 1 1 21 THR HG1 H 6.869 -0.273 -2.969 1.00 . A A . 21 THR HG1 1 1 27 16954 1 1 21 THR HG21 H 6.026 -3.912 -1.742 1.00 . A A . 21 THR HG21 1 1 27 16955 1 1 21 THR HG22 H 6.125 -3.434 -3.438 1.00 . A A . 21 THR HG22 1 1 27 16956 1 1 21 THR HG23 H 7.574 -3.972 -2.586 1.00 . A A . 21 THR HG23 1 1 27 16957 1 1 21 THR N N 6.253 -2.212 0.279 1.00 . A A . 21 THR N 1 1 27 16958 1 1 21 THR O O 4.087 -2.817 -1.671 1.00 . A A . 21 THR O 1 1 27 16959 1 1 21 THR OG1 O 6.824 -1.197 -3.225 1.00 . A A . 21 THR OG1 1 1 27 16960 1 1 22 CYS C C 2.240 -0.273 -3.355 1.00 . A A . 22 CYS C 1 1 27 16961 1 1 22 CYS CA C 2.395 -0.640 -1.887 1.00 . A A . 22 CYS CA 1 1 27 16962 1 1 22 CYS CB C 1.552 0.305 -1.028 1.00 . A A . 22 CYS CB 1 1 27 16963 1 1 22 CYS H H 4.204 0.267 -1.263 1.00 . A A . 22 CYS H 1 1 27 16964 1 1 22 CYS HA H 2.042 -1.650 -1.743 1.00 . A A . 22 CYS HA 1 1 27 16965 1 1 22 CYS HB2 H 0.576 0.406 -1.475 1.00 . A A . 22 CYS HB2 1 1 27 16966 1 1 22 CYS HB3 H 1.446 -0.120 -0.041 1.00 . A A . 22 CYS HB3 1 1 27 16967 1 1 22 CYS N N 3.795 -0.595 -1.483 1.00 . A A . 22 CYS N 1 1 27 16968 1 1 22 CYS O O 1.252 0.346 -3.749 1.00 . A A . 22 CYS O 1 1 27 16969 1 1 22 CYS SG S 2.246 1.981 -0.839 1.00 . A A . 22 CYS SG 1 1 27 16970 1 1 23 TRP C C 4.375 -0.952 -6.319 1.00 . A A . 23 TRP C 1 1 27 16971 1 1 23 TRP CA C 3.179 -0.355 -5.589 1.00 . A A . 23 TRP CA 1 1 27 16972 1 1 23 TRP CB C 3.136 1.159 -5.805 1.00 . A A . 23 TRP CB 1 1 27 16973 1 1 23 TRP CD1 C 1.576 0.762 -7.795 1.00 . A A . 23 TRP CD1 1 1 27 16974 1 1 23 TRP CD2 C 1.805 2.911 -7.221 1.00 . A A . 23 TRP CD2 1 1 27 16975 1 1 23 TRP CE2 C 0.932 2.831 -8.319 1.00 . A A . 23 TRP CE2 1 1 27 16976 1 1 23 TRP CE3 C 2.100 4.166 -6.684 1.00 . A A . 23 TRP CE3 1 1 27 16977 1 1 23 TRP CG C 2.206 1.576 -6.901 1.00 . A A . 23 TRP CG 1 1 27 16978 1 1 23 TRP CH2 C 0.658 5.173 -8.346 1.00 . A A . 23 TRP CH2 1 1 27 16979 1 1 23 TRP CZ2 C 0.351 3.957 -8.891 1.00 . A A . 23 TRP CZ2 1 1 27 16980 1 1 23 TRP CZ3 C 1.524 5.284 -7.253 1.00 . A A . 23 TRP CZ3 1 1 27 16981 1 1 23 TRP H H 3.986 -1.144 -3.798 1.00 . A A . 23 TRP H 1 1 27 16982 1 1 23 TRP HA H 2.280 -0.790 -5.989 1.00 . A A . 23 TRP HA 1 1 27 16983 1 1 23 TRP HB2 H 2.811 1.637 -4.894 1.00 . A A . 23 TRP HB2 1 1 27 16984 1 1 23 TRP HB3 H 4.126 1.509 -6.056 1.00 . A A . 23 TRP HB3 1 1 27 16985 1 1 23 TRP HD1 H 1.679 -0.312 -7.814 1.00 . A A . 23 TRP HD1 1 1 27 16986 1 1 23 TRP HE1 H 0.261 1.155 -9.384 1.00 . A A . 23 TRP HE1 1 1 27 16987 1 1 23 TRP HE3 H 2.763 4.269 -5.840 1.00 . A A . 23 TRP HE3 1 1 27 16988 1 1 23 TRP HH2 H 0.234 6.073 -8.762 1.00 . A A . 23 TRP HH2 1 1 27 16989 1 1 23 TRP HZ2 H -0.321 3.888 -9.730 1.00 . A A . 23 TRP HZ2 1 1 27 16990 1 1 23 TRP HZ3 H 1.742 6.263 -6.853 1.00 . A A . 23 TRP HZ3 1 1 27 16991 1 1 23 TRP N N 3.221 -0.654 -4.165 1.00 . A A . 23 TRP N 1 1 27 16992 1 1 23 TRP NE1 N 0.808 1.509 -8.653 1.00 . A A . 23 TRP NE1 1 1 27 16993 1 1 23 TRP O O 4.238 -1.907 -7.083 1.00 . A A . 23 TRP O 1 1 27 16994 1 1 24 LYS C C 6.669 -0.707 -8.239 1.00 . A A . 24 LYS C 1 1 27 16995 1 1 24 LYS CA C 6.768 -0.840 -6.722 1.00 . A A . 24 LYS CA 1 1 27 16996 1 1 24 LYS CB C 7.048 -2.294 -6.341 1.00 . A A . 24 LYS CB 1 1 27 16997 1 1 24 LYS CD C 8.497 -4.216 -7.062 1.00 . A A . 24 LYS CD 1 1 27 16998 1 1 24 LYS CE C 7.837 -4.448 -8.412 1.00 . A A . 24 LYS CE 1 1 27 16999 1 1 24 LYS CG C 8.461 -2.748 -6.669 1.00 . A A . 24 LYS CG 1 1 27 17000 1 1 24 LYS H H 5.583 0.383 -5.468 1.00 . A A . 24 LYS H 1 1 27 17001 1 1 24 LYS HA H 7.581 -0.221 -6.371 1.00 . A A . 24 LYS HA 1 1 27 17002 1 1 24 LYS HB2 H 6.893 -2.411 -5.278 1.00 . A A . 24 LYS HB2 1 1 27 17003 1 1 24 LYS HB3 H 6.356 -2.932 -6.869 1.00 . A A . 24 LYS HB3 1 1 27 17004 1 1 24 LYS HD2 H 9.526 -4.540 -7.116 1.00 . A A . 24 LYS HD2 1 1 27 17005 1 1 24 LYS HD3 H 7.975 -4.792 -6.312 1.00 . A A . 24 LYS HD3 1 1 27 17006 1 1 24 LYS HE2 H 7.316 -5.393 -8.386 1.00 . A A . 24 LYS HE2 1 1 27 17007 1 1 24 LYS HE3 H 7.129 -3.652 -8.593 1.00 . A A . 24 LYS HE3 1 1 27 17008 1 1 24 LYS HG2 H 8.837 -2.157 -7.490 1.00 . A A . 24 LYS HG2 1 1 27 17009 1 1 24 LYS HG3 H 9.087 -2.602 -5.801 1.00 . A A . 24 LYS HG3 1 1 27 17010 1 1 24 LYS HZ1 H 9.555 -3.742 -9.368 1.00 . A A . 24 LYS HZ1 1 1 27 17011 1 1 24 LYS HZ2 H 9.298 -5.403 -9.560 1.00 . A A . 24 LYS HZ2 1 1 27 17012 1 1 24 LYS HZ3 H 8.359 -4.294 -10.429 1.00 . A A . 24 LYS HZ3 1 1 27 17013 1 1 24 LYS N N 5.544 -0.376 -6.083 1.00 . A A . 24 LYS N 1 1 27 17014 1 1 24 LYS NZ N 8.832 -4.473 -9.519 1.00 . A A . 24 LYS NZ 1 1 27 17015 1 1 24 LYS O O 7.316 -1.448 -8.980 1.00 . A A . 24 LYS O 1 1 27 17016 1 1 25 THR C C 7.000 0.815 -10.789 1.00 . A A . 25 THR C 1 1 27 17017 1 1 25 THR CA C 5.672 0.469 -10.125 1.00 . A A . 25 THR CA 1 1 27 17018 1 1 25 THR CB C 4.656 1.591 -10.362 1.00 . A A . 25 THR CB 1 1 27 17019 1 1 25 THR CG2 C 4.135 1.637 -11.782 1.00 . A A . 25 THR CG2 1 1 27 17020 1 1 25 THR H H 5.365 0.801 -8.057 1.00 . A A . 25 THR H 1 1 27 17021 1 1 25 THR HA H 5.294 -0.444 -10.559 1.00 . A A . 25 THR HA 1 1 27 17022 1 1 25 THR HB H 5.123 2.542 -10.151 1.00 . A A . 25 THR HB 1 1 27 17023 1 1 25 THR HG1 H 2.918 2.157 -9.664 1.00 . A A . 25 THR HG1 1 1 27 17024 1 1 25 THR HG21 H 4.959 1.534 -12.471 1.00 . A A . 25 THR HG21 1 1 27 17025 1 1 25 THR HG22 H 3.434 0.829 -11.934 1.00 . A A . 25 THR HG22 1 1 27 17026 1 1 25 THR HG23 H 3.639 2.581 -11.952 1.00 . A A . 25 THR HG23 1 1 27 17027 1 1 25 THR N N 5.854 0.241 -8.696 1.00 . A A . 25 THR N 1 1 27 17028 1 1 25 THR O O 7.749 1.659 -10.299 1.00 . A A . 25 THR O 1 1 27 17029 1 1 25 THR OG1 O 3.541 1.446 -9.503 1.00 . A A . 25 THR OG1 1 1 27 17030 1 1 26 SER C C 8.766 1.885 -12.855 1.00 . A A . 26 SER C 1 1 27 17031 1 1 26 SER CA C 8.526 0.392 -12.644 1.00 . A A . 26 SER CA 1 1 27 17032 1 1 26 SER CB C 8.486 -0.325 -13.994 1.00 . A A . 26 SER CB 1 1 27 17033 1 1 26 SER H H 6.648 -0.505 -12.250 1.00 . A A . 26 SER H 1 1 27 17034 1 1 26 SER HA H 9.338 -0.011 -12.058 1.00 . A A . 26 SER HA 1 1 27 17035 1 1 26 SER HB2 H 9.226 0.106 -14.651 1.00 . A A . 26 SER HB2 1 1 27 17036 1 1 26 SER HB3 H 8.700 -1.374 -13.849 1.00 . A A . 26 SER HB3 1 1 27 17037 1 1 26 SER HG H 7.310 0.171 -15.481 1.00 . A A . 26 SER HG 1 1 27 17038 1 1 26 SER N N 7.286 0.157 -11.909 1.00 . A A . 26 SER N 1 1 27 17039 1 1 26 SER O O 9.908 2.329 -12.973 1.00 . A A . 26 SER O 1 1 27 17040 1 1 26 SER OG O 7.211 -0.200 -14.601 1.00 . A A . 26 SER OG 1 1 27 17041 1 1 27 VAL C C 7.746 4.839 -11.768 1.00 . A A . 27 VAL C 1 1 27 17042 1 1 27 VAL CA C 7.775 4.093 -13.100 1.00 . A A . 27 VAL CA 1 1 27 17043 1 1 27 VAL CB C 6.630 4.612 -13.992 1.00 . A A . 27 VAL CB 1 1 27 17044 1 1 27 VAL CG1 C 5.280 4.355 -13.338 1.00 . A A . 27 VAL CG1 1 1 27 17045 1 1 27 VAL CG2 C 6.812 6.094 -14.289 1.00 . A A . 27 VAL CG2 1 1 27 17046 1 1 27 VAL H H 6.799 2.241 -12.804 1.00 . A A . 27 VAL H 1 1 27 17047 1 1 27 VAL HA H 8.712 4.301 -13.597 1.00 . A A . 27 VAL HA 1 1 27 17048 1 1 27 VAL HB H 6.658 4.074 -14.928 1.00 . A A . 27 VAL HB 1 1 27 17049 1 1 27 VAL HG11 H 5.318 4.658 -12.302 1.00 . A A . 27 VAL HG11 1 1 27 17050 1 1 27 VAL HG12 H 4.518 4.923 -13.851 1.00 . A A . 27 VAL HG12 1 1 27 17051 1 1 27 VAL HG13 H 5.046 3.303 -13.397 1.00 . A A . 27 VAL HG13 1 1 27 17052 1 1 27 VAL HG21 H 7.838 6.281 -14.569 1.00 . A A . 27 VAL HG21 1 1 27 17053 1 1 27 VAL HG22 H 6.159 6.381 -15.100 1.00 . A A . 27 VAL HG22 1 1 27 17054 1 1 27 VAL HG23 H 6.568 6.670 -13.409 1.00 . A A . 27 VAL HG23 1 1 27 17055 1 1 27 VAL N N 7.682 2.652 -12.903 1.00 . A A . 27 VAL N 1 1 27 17056 1 1 27 VAL O O 8.210 5.976 -11.676 1.00 . A A . 27 VAL O 1 1 27 17057 1 1 28 SER C C 6.923 3.784 -8.321 1.00 . A A . 28 SER C 1 1 27 17058 1 1 28 SER CA C 7.101 4.825 -9.425 1.00 . A A . 28 SER CA 1 1 27 17059 1 1 28 SER CB C 5.936 5.813 -9.398 1.00 . A A . 28 SER CB 1 1 27 17060 1 1 28 SER H H 6.831 3.300 -10.870 1.00 . A A . 28 SER H 1 1 27 17061 1 1 28 SER HA H 8.020 5.363 -9.250 1.00 . A A . 28 SER HA 1 1 27 17062 1 1 28 SER HB2 H 5.835 6.275 -10.369 1.00 . A A . 28 SER HB2 1 1 27 17063 1 1 28 SER HB3 H 5.024 5.285 -9.155 1.00 . A A . 28 SER HB3 1 1 27 17064 1 1 28 SER HG H 6.072 7.688 -8.847 1.00 . A A . 28 SER HG 1 1 27 17065 1 1 28 SER N N 7.192 4.202 -10.740 1.00 . A A . 28 SER N 1 1 27 17066 1 1 28 SER O O 5.867 3.164 -8.204 1.00 . A A . 28 SER O 1 1 27 17067 1 1 28 SER OG O 6.148 6.827 -8.431 1.00 . A A . 28 SER OG 1 1 27 17068 1 1 29 SER C C 7.576 3.371 -5.095 1.00 . A A . 29 SER C 1 1 27 17069 1 1 29 SER CA C 7.908 2.656 -6.401 1.00 . A A . 29 SER CA 1 1 27 17070 1 1 29 SER CB C 9.243 1.919 -6.272 1.00 . A A . 29 SER CB 1 1 27 17071 1 1 29 SER H H 8.769 4.141 -7.641 1.00 . A A . 29 SER H 1 1 27 17072 1 1 29 SER HA H 7.127 1.940 -6.615 1.00 . A A . 29 SER HA 1 1 27 17073 1 1 29 SER HB2 H 10.001 2.609 -5.931 1.00 . A A . 29 SER HB2 1 1 27 17074 1 1 29 SER HB3 H 9.140 1.116 -5.557 1.00 . A A . 29 SER HB3 1 1 27 17075 1 1 29 SER HG H 8.995 0.738 -7.815 1.00 . A A . 29 SER HG 1 1 27 17076 1 1 29 SER N N 7.957 3.610 -7.504 1.00 . A A . 29 SER N 1 1 27 17077 1 1 29 SER O O 8.142 4.422 -4.792 1.00 . A A . 29 SER O 1 1 27 17078 1 1 29 SER OG O 9.648 1.375 -7.516 1.00 . A A . 29 SER OG 1 1 27 17079 1 1 30 HIS C C 6.171 2.355 -1.956 1.00 . A A . 30 HIS C 1 1 27 17080 1 1 30 HIS CA C 6.237 3.402 -3.064 1.00 . A A . 30 HIS CA 1 1 27 17081 1 1 30 HIS CB C 4.874 4.076 -3.224 1.00 . A A . 30 HIS CB 1 1 27 17082 1 1 30 HIS CD2 C 5.082 4.847 -5.691 1.00 . A A . 30 HIS CD2 1 1 27 17083 1 1 30 HIS CE1 C 4.445 6.927 -5.433 1.00 . A A . 30 HIS CE1 1 1 27 17084 1 1 30 HIS CG C 4.807 5.028 -4.377 1.00 . A A . 30 HIS CG 1 1 27 17085 1 1 30 HIS H H 6.227 1.971 -4.625 1.00 . A A . 30 HIS H 1 1 27 17086 1 1 30 HIS HA H 6.968 4.149 -2.795 1.00 . A A . 30 HIS HA 1 1 27 17087 1 1 30 HIS HB2 H 4.123 3.316 -3.380 1.00 . A A . 30 HIS HB2 1 1 27 17088 1 1 30 HIS HB3 H 4.642 4.625 -2.323 1.00 . A A . 30 HIS HB3 1 1 27 17089 1 1 30 HIS HD1 H 4.144 6.780 -3.415 1.00 . A A . 30 HIS HD1 1 1 27 17090 1 1 30 HIS HD2 H 5.419 3.931 -6.154 1.00 . A A . 30 HIS HD2 1 1 27 17091 1 1 30 HIS HE1 H 4.187 7.954 -5.639 1.00 . A A . 30 HIS HE1 1 1 27 17092 1 1 30 HIS HE2 H 4.803 6.167 -7.294 1.00 . A A . 30 HIS HE2 1 1 27 17093 1 1 30 HIS N N 6.649 2.804 -4.329 1.00 . A A . 30 HIS N 1 1 27 17094 1 1 30 HIS ND1 N 4.411 6.342 -4.249 1.00 . A A . 30 HIS ND1 1 1 27 17095 1 1 30 HIS NE2 N 4.849 6.043 -6.325 1.00 . A A . 30 HIS NE2 1 1 27 17096 1 1 30 HIS O O 6.276 1.158 -2.217 1.00 . A A . 30 HIS O 1 1 27 17097 1 1 31 TYR C C 4.657 2.202 1.252 1.00 . A A . 31 TYR C 1 1 27 17098 1 1 31 TYR CA C 5.914 1.926 0.432 1.00 . A A . 31 TYR CA 1 1 27 17099 1 1 31 TYR CB C 7.158 2.087 1.312 1.00 . A A . 31 TYR CB 1 1 27 17100 1 1 31 TYR CD1 C 8.710 0.393 2.357 1.00 . A A . 31 TYR CD1 1 1 27 17101 1 1 31 TYR CD2 C 8.458 0.375 -0.013 1.00 . A A . 31 TYR CD2 1 1 27 17102 1 1 31 TYR CE1 C 9.597 -0.664 2.275 1.00 . A A . 31 TYR CE1 1 1 27 17103 1 1 31 TYR CE2 C 9.344 -0.683 -0.103 1.00 . A A . 31 TYR CE2 1 1 27 17104 1 1 31 TYR CG C 8.126 0.930 1.216 1.00 . A A . 31 TYR CG 1 1 27 17105 1 1 31 TYR CZ C 9.910 -1.198 1.043 1.00 . A A . 31 TYR CZ 1 1 27 17106 1 1 31 TYR H H 5.917 3.786 -0.581 1.00 . A A . 31 TYR H 1 1 27 17107 1 1 31 TYR HA H 5.873 0.915 0.067 1.00 . A A . 31 TYR HA 1 1 27 17108 1 1 31 TYR HB2 H 7.684 2.983 1.017 1.00 . A A . 31 TYR HB2 1 1 27 17109 1 1 31 TYR HB3 H 6.852 2.180 2.344 1.00 . A A . 31 TYR HB3 1 1 27 17110 1 1 31 TYR HD1 H 8.463 0.813 3.321 1.00 . A A . 31 TYR HD1 1 1 27 17111 1 1 31 TYR HD2 H 8.015 0.781 -0.909 1.00 . A A . 31 TYR HD2 1 1 27 17112 1 1 31 TYR HE1 H 10.040 -1.068 3.173 1.00 . A A . 31 TYR HE1 1 1 27 17113 1 1 31 TYR HE2 H 9.588 -1.101 -1.069 1.00 . A A . 31 TYR HE2 1 1 27 17114 1 1 31 TYR HH H 11.640 -1.989 1.322 1.00 . A A . 31 TYR HH 1 1 27 17115 1 1 31 TYR N N 5.994 2.819 -0.721 1.00 . A A . 31 TYR N 1 1 27 17116 1 1 31 TYR O O 4.278 3.356 1.452 1.00 . A A . 31 TYR O 1 1 27 17117 1 1 31 TYR OH O 10.792 -2.251 0.958 1.00 . A A . 31 TYR OH 1 1 27 17118 1 1 32 CYS C C 3.156 1.740 3.941 1.00 . A A . 32 CYS C 1 1 27 17119 1 1 32 CYS CA C 2.808 1.278 2.533 1.00 . A A . 32 CYS CA 1 1 27 17120 1 1 32 CYS CB C 2.044 -0.047 2.588 1.00 . A A . 32 CYS CB 1 1 27 17121 1 1 32 CYS H H 4.363 0.240 1.546 1.00 . A A . 32 CYS H 1 1 27 17122 1 1 32 CYS HA H 2.186 2.024 2.066 1.00 . A A . 32 CYS HA 1 1 27 17123 1 1 32 CYS HB2 H 2.226 -0.597 1.678 1.00 . A A . 32 CYS HB2 1 1 27 17124 1 1 32 CYS HB3 H 2.402 -0.624 3.428 1.00 . A A . 32 CYS HB3 1 1 27 17125 1 1 32 CYS N N 4.015 1.138 1.731 1.00 . A A . 32 CYS N 1 1 27 17126 1 1 32 CYS O O 4.153 1.306 4.519 1.00 . A A . 32 CYS O 1 1 27 17127 1 1 32 CYS SG S 0.237 0.137 2.772 1.00 . A A . 32 CYS SG 1 1 27 17128 1 1 33 THR C C 1.602 2.467 6.822 1.00 . A A . 33 THR C 1 1 27 17129 1 1 33 THR CA C 2.548 3.136 5.833 1.00 . A A . 33 THR CA 1 1 27 17130 1 1 33 THR CB C 2.347 4.652 5.861 1.00 . A A . 33 THR CB 1 1 27 17131 1 1 33 THR CG2 C 2.967 5.362 4.676 1.00 . A A . 33 THR CG2 1 1 27 17132 1 1 33 THR H H 1.550 2.923 3.983 1.00 . A A . 33 THR H 1 1 27 17133 1 1 33 THR HA H 3.566 2.910 6.115 1.00 . A A . 33 THR HA 1 1 27 17134 1 1 33 THR HB H 2.800 5.049 6.758 1.00 . A A . 33 THR HB 1 1 27 17135 1 1 33 THR HG1 H 0.570 4.732 5.040 1.00 . A A . 33 THR HG1 1 1 27 17136 1 1 33 THR HG21 H 4.005 5.076 4.588 1.00 . A A . 33 THR HG21 1 1 27 17137 1 1 33 THR HG22 H 2.440 5.086 3.774 1.00 . A A . 33 THR HG22 1 1 27 17138 1 1 33 THR HG23 H 2.899 6.430 4.820 1.00 . A A . 33 THR HG23 1 1 27 17139 1 1 33 THR N N 2.329 2.619 4.490 1.00 . A A . 33 THR N 1 1 27 17140 1 1 33 THR O O 1.355 2.990 7.909 1.00 . A A . 33 THR O 1 1 27 17141 1 1 33 THR OG1 O 0.967 4.974 5.880 1.00 . A A . 33 THR OG1 1 1 27 17142 1 1 34 GLY C C -0.899 1.472 7.929 1.00 . A A . 34 GLY C 1 1 27 17143 1 1 34 GLY CA C 0.158 0.578 7.301 1.00 . A A . 34 GLY CA 1 1 27 17144 1 1 34 GLY H H 1.314 0.937 5.555 1.00 . A A . 34 GLY H 1 1 27 17145 1 1 34 GLY HA2 H 0.725 0.104 8.088 1.00 . A A . 34 GLY HA2 1 1 27 17146 1 1 34 GLY HA3 H -0.335 -0.185 6.719 1.00 . A A . 34 GLY HA3 1 1 27 17147 1 1 34 GLY N N 1.075 1.306 6.437 1.00 . A A . 34 GLY N 1 1 27 17148 1 1 34 GLY O O -1.395 1.184 9.018 1.00 . A A . 34 GLY O 1 1 27 17149 1 1 35 ARG C C -3.549 3.356 6.966 1.00 . A A . 35 ARG C 1 1 27 17150 1 1 35 ARG CA C -2.244 3.493 7.742 1.00 . A A . 35 ARG CA 1 1 27 17151 1 1 35 ARG CB C -1.726 4.929 7.642 1.00 . A A . 35 ARG CB 1 1 27 17152 1 1 35 ARG CD C -1.468 6.980 9.071 1.00 . A A . 35 ARG CD 1 1 27 17153 1 1 35 ARG CG C -2.417 5.893 8.593 1.00 . A A . 35 ARG CG 1 1 27 17154 1 1 35 ARG CZ C -1.312 6.361 11.452 1.00 . A A . 35 ARG CZ 1 1 27 17155 1 1 35 ARG H H -0.812 2.734 6.380 1.00 . A A . 35 ARG H 1 1 27 17156 1 1 35 ARG HA H -2.429 3.258 8.779 1.00 . A A . 35 ARG HA 1 1 27 17157 1 1 35 ARG HB2 H -0.669 4.935 7.863 1.00 . A A . 35 ARG HB2 1 1 27 17158 1 1 35 ARG HB3 H -1.876 5.284 6.633 1.00 . A A . 35 ARG HB3 1 1 27 17159 1 1 35 ARG HD2 H -0.760 7.193 8.285 1.00 . A A . 35 ARG HD2 1 1 27 17160 1 1 35 ARG HD3 H -2.041 7.869 9.290 1.00 . A A . 35 ARG HD3 1 1 27 17161 1 1 35 ARG HE H 0.234 6.467 10.193 1.00 . A A . 35 ARG HE 1 1 27 17162 1 1 35 ARG HG2 H -3.249 6.354 8.082 1.00 . A A . 35 ARG HG2 1 1 27 17163 1 1 35 ARG HG3 H -2.779 5.341 9.449 1.00 . A A . 35 ARG HG3 1 1 27 17164 1 1 35 ARG HH11 H -3.187 6.775 10.815 1.00 . A A . 35 ARG HH11 1 1 27 17165 1 1 35 ARG HH12 H -3.050 6.337 12.485 1.00 . A A . 35 ARG HH12 1 1 27 17166 1 1 35 ARG HH21 H 0.416 5.891 12.389 1.00 . A A . 35 ARG HH21 1 1 27 17167 1 1 35 ARG HH22 H -1.005 5.836 13.379 1.00 . A A . 35 ARG HH22 1 1 27 17168 1 1 35 ARG N N -1.242 2.558 7.242 1.00 . A A . 35 ARG N 1 1 27 17169 1 1 35 ARG NE N -0.737 6.579 10.271 1.00 . A A . 35 ARG NE 1 1 27 17170 1 1 35 ARG NH1 N -2.624 6.503 11.595 1.00 . A A . 35 ARG NH1 1 1 27 17171 1 1 35 ARG NH2 N -0.573 5.999 12.492 1.00 . A A . 35 ARG NH2 1 1 27 17172 1 1 35 ARG O O -4.634 3.559 7.512 1.00 . A A . 35 ARG O 1 1 27 17173 1 1 36 SER C C -4.284 1.889 3.680 1.00 . A A . 36 SER C 1 1 27 17174 1 1 36 SER CA C -4.602 2.835 4.832 1.00 . A A . 36 SER CA 1 1 27 17175 1 1 36 SER CB C -5.064 4.187 4.286 1.00 . A A . 36 SER CB 1 1 27 17176 1 1 36 SER H H -2.542 2.856 5.314 1.00 . A A . 36 SER H 1 1 27 17177 1 1 36 SER HA H -5.393 2.406 5.428 1.00 . A A . 36 SER HA 1 1 27 17178 1 1 36 SER HB2 H -4.207 4.829 4.147 1.00 . A A . 36 SER HB2 1 1 27 17179 1 1 36 SER HB3 H -5.561 4.039 3.339 1.00 . A A . 36 SER HB3 1 1 27 17180 1 1 36 SER HG H -6.618 4.181 5.479 1.00 . A A . 36 SER HG 1 1 27 17181 1 1 36 SER N N -3.435 3.006 5.689 1.00 . A A . 36 SER N 1 1 27 17182 1 1 36 SER O O -3.130 1.513 3.476 1.00 . A A . 36 SER O 1 1 27 17183 1 1 36 SER OG O -5.964 4.818 5.181 1.00 . A A . 36 SER OG 1 1 27 17184 1 1 37 CYS C C -4.922 1.389 0.499 1.00 . A A . 37 CYS C 1 1 27 17185 1 1 37 CYS CA C -5.124 0.608 1.795 1.00 . A A . 37 CYS CA 1 1 27 17186 1 1 37 CYS CB C -6.321 -0.333 1.661 1.00 . A A . 37 CYS CB 1 1 27 17187 1 1 37 CYS H H -6.208 1.840 3.131 1.00 . A A . 37 CYS H 1 1 27 17188 1 1 37 CYS HA H -4.240 0.019 1.986 1.00 . A A . 37 CYS HA 1 1 27 17189 1 1 37 CYS HB2 H -7.223 0.205 1.915 1.00 . A A . 37 CYS HB2 1 1 27 17190 1 1 37 CYS HB3 H -6.387 -0.673 0.642 1.00 . A A . 37 CYS HB3 1 1 27 17191 1 1 37 CYS N N -5.309 1.508 2.926 1.00 . A A . 37 CYS N 1 1 27 17192 1 1 37 CYS O O -4.926 0.813 -0.589 1.00 . A A . 37 CYS O 1 1 27 17193 1 1 37 CYS SG S -6.229 -1.800 2.739 1.00 . A A . 37 CYS SG 1 1 27 17194 1 1 38 GLU C C -3.105 4.076 -0.596 1.00 . A A . 38 GLU C 1 1 27 17195 1 1 38 GLU CA C -4.539 3.557 -0.544 1.00 . A A . 38 GLU CA 1 1 27 17196 1 1 38 GLU CB C -5.518 4.733 -0.517 1.00 . A A . 38 GLU CB 1 1 27 17197 1 1 38 GLU CD C -7.794 5.301 0.420 1.00 . A A . 38 GLU CD 1 1 27 17198 1 1 38 GLU CG C -6.972 4.311 -0.382 1.00 . A A . 38 GLU CG 1 1 27 17199 1 1 38 GLU H H -4.749 3.107 1.513 1.00 . A A . 38 GLU H 1 1 27 17200 1 1 38 GLU HA H -4.727 2.965 -1.426 1.00 . A A . 38 GLU HA 1 1 27 17201 1 1 38 GLU HB2 H -5.272 5.372 0.318 1.00 . A A . 38 GLU HB2 1 1 27 17202 1 1 38 GLU HB3 H -5.412 5.295 -1.433 1.00 . A A . 38 GLU HB3 1 1 27 17203 1 1 38 GLU HG2 H -7.402 4.226 -1.369 1.00 . A A . 38 GLU HG2 1 1 27 17204 1 1 38 GLU HG3 H -7.010 3.350 0.111 1.00 . A A . 38 GLU HG3 1 1 27 17205 1 1 38 GLU N N -4.744 2.703 0.620 1.00 . A A . 38 GLU N 1 1 27 17206 1 1 38 GLU O O -2.790 5.120 -0.025 1.00 . A A . 38 GLU O 1 1 27 17207 1 1 38 GLU OE1 O -7.509 6.514 0.338 1.00 . A A . 38 GLU OE1 1 1 27 17208 1 1 38 GLU OE2 O -8.723 4.863 1.131 1.00 . A A . 38 GLU OE2 1 1 27 17209 1 1 39 CYS C C -0.693 5.197 -1.780 1.00 . A A . 39 CYS C 1 1 27 17210 1 1 39 CYS CA C -0.834 3.716 -1.423 1.00 . A A . 39 CYS CA 1 1 27 17211 1 1 39 CYS CB C -0.162 2.854 -2.496 1.00 . A A . 39 CYS CB 1 1 27 17212 1 1 39 CYS H H -2.554 2.517 -1.717 1.00 . A A . 39 CYS H 1 1 27 17213 1 1 39 CYS HA H -0.351 3.535 -0.475 1.00 . A A . 39 CYS HA 1 1 27 17214 1 1 39 CYS HB2 H -0.426 1.821 -2.332 1.00 . A A . 39 CYS HB2 1 1 27 17215 1 1 39 CYS HB3 H -0.521 3.160 -3.469 1.00 . A A . 39 CYS HB3 1 1 27 17216 1 1 39 CYS N N -2.240 3.338 -1.287 1.00 . A A . 39 CYS N 1 1 27 17217 1 1 39 CYS O O -1.382 5.694 -2.672 1.00 . A A . 39 CYS O 1 1 27 17218 1 1 39 CYS SG S 1.658 2.962 -2.518 1.00 . A A . 39 CYS SG 1 1 27 17219 1 1 40 PRO C C 1.029 7.616 -2.712 1.00 . A A . 40 PRO C 1 1 27 17220 1 1 40 PRO CA C 0.418 7.356 -1.340 1.00 . A A . 40 PRO CA 1 1 27 17221 1 1 40 PRO CB C 1.390 7.775 -0.234 1.00 . A A . 40 PRO CB 1 1 27 17222 1 1 40 PRO CD C 1.065 5.421 -0.004 1.00 . A A . 40 PRO CD 1 1 27 17223 1 1 40 PRO CG C 2.078 6.517 0.168 1.00 . A A . 40 PRO CG 1 1 27 17224 1 1 40 PRO HA H -0.501 7.916 -1.247 1.00 . A A . 40 PRO HA 1 1 27 17225 1 1 40 PRO HB2 H 2.089 8.501 -0.623 1.00 . A A . 40 PRO HB2 1 1 27 17226 1 1 40 PRO HB3 H 0.839 8.203 0.590 1.00 . A A . 40 PRO HB3 1 1 27 17227 1 1 40 PRO HD2 H 1.549 4.501 -0.295 1.00 . A A . 40 PRO HD2 1 1 27 17228 1 1 40 PRO HD3 H 0.500 5.282 0.906 1.00 . A A . 40 PRO HD3 1 1 27 17229 1 1 40 PRO HG2 H 2.930 6.344 -0.472 1.00 . A A . 40 PRO HG2 1 1 27 17230 1 1 40 PRO HG3 H 2.389 6.581 1.200 1.00 . A A . 40 PRO HG3 1 1 27 17231 1 1 40 PRO N N 0.200 5.927 -1.087 1.00 . A A . 40 PRO N 1 1 27 17232 1 1 40 PRO O O 1.389 6.683 -3.430 1.00 . A A . 40 PRO O 1 1 27 17233 1 1 41 SER C C 3.163 9.711 -4.205 1.00 . A A . 41 SER C 1 1 27 17234 1 1 41 SER CA C 1.709 9.276 -4.358 1.00 . A A . 41 SER CA 1 1 27 17235 1 1 41 SER CB C 0.890 10.407 -4.981 1.00 . A A . 41 SER CB 1 1 27 17236 1 1 41 SER H H 0.836 9.589 -2.455 1.00 . A A . 41 SER H 1 1 27 17237 1 1 41 SER HA H 1.670 8.415 -5.008 1.00 . A A . 41 SER HA 1 1 27 17238 1 1 41 SER HB2 H 0.821 11.227 -4.282 1.00 . A A . 41 SER HB2 1 1 27 17239 1 1 41 SER HB3 H 1.376 10.745 -5.885 1.00 . A A . 41 SER HB3 1 1 27 17240 1 1 41 SER HG H -0.392 9.432 -6.097 1.00 . A A . 41 SER HG 1 1 27 17241 1 1 41 SER N N 1.142 8.891 -3.071 1.00 . A A . 41 SER N 1 1 27 17242 1 1 41 SER O O 3.653 10.551 -4.960 1.00 . A A . 41 SER O 1 1 27 17243 1 1 41 SER OG O -0.420 9.972 -5.303 1.00 . A A . 41 SER OG 1 1 27 17244 1 1 42 TYR C C 6.055 8.200 -2.666 1.00 . A A . 42 TYR C 1 1 27 17245 1 1 42 TYR CA C 5.249 9.460 -2.975 1.00 . A A . 42 TYR CA 1 1 27 17246 1 1 42 TYR CB C 5.365 10.454 -1.818 1.00 . A A . 42 TYR CB 1 1 27 17247 1 1 42 TYR CD1 C 3.707 10.269 0.078 1.00 . A A . 42 TYR CD1 1 1 27 17248 1 1 42 TYR CD2 C 5.710 8.984 0.206 1.00 . A A . 42 TYR CD2 1 1 27 17249 1 1 42 TYR CE1 C 3.297 9.758 1.295 1.00 . A A . 42 TYR CE1 1 1 27 17250 1 1 42 TYR CE2 C 5.307 8.468 1.422 1.00 . A A . 42 TYR CE2 1 1 27 17251 1 1 42 TYR CG C 4.919 9.891 -0.486 1.00 . A A . 42 TYR CG 1 1 27 17252 1 1 42 TYR CZ C 4.100 8.858 1.963 1.00 . A A . 42 TYR CZ 1 1 27 17253 1 1 42 TYR H H 3.406 8.469 -2.656 1.00 . A A . 42 TYR H 1 1 27 17254 1 1 42 TYR HA H 5.646 9.916 -3.870 1.00 . A A . 42 TYR HA 1 1 27 17255 1 1 42 TYR HB2 H 6.395 10.761 -1.718 1.00 . A A . 42 TYR HB2 1 1 27 17256 1 1 42 TYR HB3 H 4.756 11.319 -2.034 1.00 . A A . 42 TYR HB3 1 1 27 17257 1 1 42 TYR HD1 H 3.080 10.974 -0.447 1.00 . A A . 42 TYR HD1 1 1 27 17258 1 1 42 TYR HD2 H 6.656 8.681 -0.219 1.00 . A A . 42 TYR HD2 1 1 27 17259 1 1 42 TYR HE1 H 2.351 10.063 1.717 1.00 . A A . 42 TYR HE1 1 1 27 17260 1 1 42 TYR HE2 H 5.936 7.763 1.945 1.00 . A A . 42 TYR HE2 1 1 27 17261 1 1 42 TYR HH H 3.397 9.062 3.740 1.00 . A A . 42 TYR HH 1 1 27 17262 1 1 42 TYR N N 3.850 9.132 -3.225 1.00 . A A . 42 TYR N 1 1 27 17263 1 1 42 TYR O O 5.534 7.245 -2.090 1.00 . A A . 42 TYR O 1 1 27 17264 1 1 42 TYR OH O 3.694 8.346 3.174 1.00 . A A . 42 TYR OH 1 1 27 17265 1 1 43 PRO C C 8.583 6.875 -1.334 1.00 . A A . 43 PRO C 1 1 27 17266 1 1 43 PRO CA C 8.221 7.031 -2.807 1.00 . A A . 43 PRO CA 1 1 27 17267 1 1 43 PRO CB C 9.467 7.358 -3.632 1.00 . A A . 43 PRO CB 1 1 27 17268 1 1 43 PRO CD C 8.048 9.278 -3.739 1.00 . A A . 43 PRO CD 1 1 27 17269 1 1 43 PRO CG C 9.488 8.845 -3.708 1.00 . A A . 43 PRO CG 1 1 27 17270 1 1 43 PRO HA H 7.778 6.114 -3.166 1.00 . A A . 43 PRO HA 1 1 27 17271 1 1 43 PRO HB2 H 10.344 6.974 -3.132 1.00 . A A . 43 PRO HB2 1 1 27 17272 1 1 43 PRO HB3 H 9.380 6.914 -4.612 1.00 . A A . 43 PRO HB3 1 1 27 17273 1 1 43 PRO HD2 H 7.923 10.211 -3.209 1.00 . A A . 43 PRO HD2 1 1 27 17274 1 1 43 PRO HD3 H 7.704 9.372 -4.758 1.00 . A A . 43 PRO HD3 1 1 27 17275 1 1 43 PRO HG2 H 9.983 9.250 -2.837 1.00 . A A . 43 PRO HG2 1 1 27 17276 1 1 43 PRO HG3 H 9.994 9.160 -4.608 1.00 . A A . 43 PRO HG3 1 1 27 17277 1 1 43 PRO N N 7.345 8.181 -3.046 1.00 . A A . 43 PRO N 1 1 27 17278 1 1 43 PRO O O 8.706 7.860 -0.606 1.00 . A A . 43 PRO O 1 1 27 17279 1 1 44 GLY C C 10.439 5.964 0.869 1.00 . A A . 44 GLY C 1 1 27 17280 1 1 44 GLY CA C 9.101 5.366 0.482 1.00 . A A . 44 GLY CA 1 1 27 17281 1 1 44 GLY H H 8.643 4.885 -1.528 1.00 . A A . 44 GLY H 1 1 27 17282 1 1 44 GLY HA2 H 9.138 4.298 0.635 1.00 . A A . 44 GLY HA2 1 1 27 17283 1 1 44 GLY HA3 H 8.335 5.784 1.120 1.00 . A A . 44 GLY HA3 1 1 27 17284 1 1 44 GLY N N 8.754 5.630 -0.902 1.00 . A A . 44 GLY N 1 1 27 17285 1 1 44 GLY O O 10.845 6.994 0.331 1.00 . A A . 44 GLY O 1 1 27 17286 1 1 45 ASN C C 12.315 7.184 2.870 1.00 . A A . 45 ASN C 1 1 27 17287 1 1 45 ASN CA C 12.427 5.789 2.263 1.00 . A A . 45 ASN CA 1 1 27 17288 1 1 45 ASN CB C 13.426 5.803 1.104 1.00 . A A . 45 ASN CB 1 1 27 17289 1 1 45 ASN CG C 13.425 4.502 0.326 1.00 . A A . 45 ASN CG 1 1 27 17290 1 1 45 ASN H H 10.749 4.500 2.195 1.00 . A A . 45 ASN H 1 1 27 17291 1 1 45 ASN HA H 12.779 5.107 3.022 1.00 . A A . 45 ASN HA 1 1 27 17292 1 1 45 ASN HB2 H 13.172 6.606 0.428 1.00 . A A . 45 ASN HB2 1 1 27 17293 1 1 45 ASN HB3 H 14.419 5.967 1.496 1.00 . A A . 45 ASN HB3 1 1 27 17294 1 1 45 ASN HD21 H 12.880 5.463 -1.327 1.00 . A A . 45 ASN HD21 1 1 27 17295 1 1 45 ASN HD22 H 13.090 3.756 -1.487 1.00 . A A . 45 ASN HD22 1 1 27 17296 1 1 45 ASN N N 11.126 5.316 1.804 1.00 . A A . 45 ASN N 1 1 27 17297 1 1 45 ASN ND2 N 13.099 4.582 -0.959 1.00 . A A . 45 ASN ND2 1 1 27 17298 1 1 45 ASN O O 13.219 8.008 2.728 1.00 . A A . 45 ASN O 1 1 27 17299 1 1 45 ASN OD1 O 13.715 3.438 0.872 1.00 . A A . 45 ASN OD1 1 1 27 17300 1 1 46 GLY C C 10.767 9.838 3.143 1.00 . A A . 46 GLY C 1 1 27 17301 1 1 46 GLY CA C 10.991 8.739 4.163 1.00 . A A . 46 GLY CA 1 1 27 17302 1 1 46 GLY H H 10.514 6.748 3.625 1.00 . A A . 46 GLY H 1 1 27 17303 1 1 46 GLY HA2 H 11.858 8.986 4.758 1.00 . A A . 46 GLY HA2 1 1 27 17304 1 1 46 GLY HA3 H 10.128 8.682 4.810 1.00 . A A . 46 GLY HA3 1 1 27 17305 1 1 46 GLY N N 11.200 7.443 3.545 1.00 . A A . 46 GLY N 1 1 27 17306 1 1 46 GLY O O 10.943 11.023 3.499 1.00 . A A . 46 GLY O 1 1 27 17307 1 1 46 GLY OXT O 10.417 9.515 1.989 1.00 . A A . 46 GLY OXT 1 1 28 17308 1 1 1 ALA C C -18.278 -1.681 2.629 1.00 . A A . 1 ALA C 1 1 28 17309 1 1 1 ALA CA C -19.476 -0.917 3.182 1.00 . A A . 1 ALA CA 1 1 28 17310 1 1 1 ALA CB C -19.541 -1.061 4.695 1.00 . A A . 1 ALA CB 1 1 28 17311 1 1 1 ALA H1 H -20.549 -1.598 1.565 1.00 . A A . 1 ALA H1 1 1 28 17312 1 1 1 ALA H2 H -21.041 -2.248 3.075 1.00 . A A . 1 ALA H2 1 1 28 17313 1 1 1 ALA H3 H -21.445 -0.632 2.661 1.00 . A A . 1 ALA H3 1 1 28 17314 1 1 1 ALA HA H -19.357 0.132 2.950 1.00 . A A . 1 ALA HA 1 1 28 17315 1 1 1 ALA HB1 H -19.030 -0.230 5.158 1.00 . A A . 1 ALA HB1 1 1 28 17316 1 1 1 ALA HB2 H -19.065 -1.985 4.989 1.00 . A A . 1 ALA HB2 1 1 28 17317 1 1 1 ALA HB3 H -20.573 -1.071 5.012 1.00 . A A . 1 ALA HB3 1 1 28 17318 1 1 1 ALA N N -20.742 -1.391 2.565 1.00 . A A . 1 ALA N 1 1 28 17319 1 1 1 ALA O O -18.400 -2.431 1.660 1.00 . A A . 1 ALA O 1 1 28 17320 1 1 2 MET C C -15.164 -2.766 4.013 1.00 . A A . 2 MET C 1 1 28 17321 1 1 2 MET CA C -15.899 -2.158 2.822 1.00 . A A . 2 MET CA 1 1 28 17322 1 1 2 MET CB C -14.982 -1.175 2.090 1.00 . A A . 2 MET CB 1 1 28 17323 1 1 2 MET CE C -14.048 -1.000 -1.047 1.00 . A A . 2 MET CE 1 1 28 17324 1 1 2 MET CG C -15.706 -0.316 1.066 1.00 . A A . 2 MET CG 1 1 28 17325 1 1 2 MET H H -17.086 -0.877 4.018 1.00 . A A . 2 MET H 1 1 28 17326 1 1 2 MET HA H -16.177 -2.950 2.143 1.00 . A A . 2 MET HA 1 1 28 17327 1 1 2 MET HB2 H -14.522 -0.521 2.816 1.00 . A A . 2 MET HB2 1 1 28 17328 1 1 2 MET HB3 H -14.211 -1.733 1.580 1.00 . A A . 2 MET HB3 1 1 28 17329 1 1 2 MET HE1 H -14.486 -1.888 -0.615 1.00 . A A . 2 MET HE1 1 1 28 17330 1 1 2 MET HE2 H -14.366 -0.907 -2.075 1.00 . A A . 2 MET HE2 1 1 28 17331 1 1 2 MET HE3 H -12.972 -1.074 -1.008 1.00 . A A . 2 MET HE3 1 1 28 17332 1 1 2 MET HG2 H -16.411 -0.935 0.531 1.00 . A A . 2 MET HG2 1 1 28 17333 1 1 2 MET HG3 H -16.238 0.467 1.585 1.00 . A A . 2 MET HG3 1 1 28 17334 1 1 2 MET N N -17.120 -1.486 3.252 1.00 . A A . 2 MET N 1 1 28 17335 1 1 2 MET O O -14.599 -2.049 4.838 1.00 . A A . 2 MET O 1 1 28 17336 1 1 2 MET SD S -14.582 0.439 -0.124 1.00 . A A . 2 MET SD 1 1 28 17337 1 1 3 ASP C C -13.166 -5.354 4.730 1.00 . A A . 3 ASP C 1 1 28 17338 1 1 3 ASP CA C -14.512 -4.797 5.184 1.00 . A A . 3 ASP CA 1 1 28 17339 1 1 3 ASP CB C -15.398 -5.931 5.702 1.00 . A A . 3 ASP CB 1 1 28 17340 1 1 3 ASP CG C -15.884 -6.839 4.590 1.00 . A A . 3 ASP CG 1 1 28 17341 1 1 3 ASP H H -15.644 -4.609 3.406 1.00 . A A . 3 ASP H 1 1 28 17342 1 1 3 ASP HA H -14.344 -4.090 5.982 1.00 . A A . 3 ASP HA 1 1 28 17343 1 1 3 ASP HB2 H -14.837 -6.525 6.408 1.00 . A A . 3 ASP HB2 1 1 28 17344 1 1 3 ASP HB3 H -16.259 -5.508 6.199 1.00 . A A . 3 ASP HB3 1 1 28 17345 1 1 3 ASP N N -15.177 -4.092 4.094 1.00 . A A . 3 ASP N 1 1 28 17346 1 1 3 ASP O O -12.731 -6.407 5.196 1.00 . A A . 3 ASP O 1 1 28 17347 1 1 3 ASP OD1 O -17.017 -6.633 4.107 1.00 . A A . 3 ASP OD1 1 1 28 17348 1 1 3 ASP OD2 O -15.130 -7.757 4.202 1.00 . A A . 3 ASP OD2 1 1 28 17349 1 1 4 CYS C C -10.424 -3.877 2.765 1.00 . A A . 4 CYS C 1 1 28 17350 1 1 4 CYS CA C -11.215 -5.064 3.304 1.00 . A A . 4 CYS CA 1 1 28 17351 1 1 4 CYS CB C -11.395 -6.113 2.204 1.00 . A A . 4 CYS CB 1 1 28 17352 1 1 4 CYS H H -12.911 -3.809 3.489 1.00 . A A . 4 CYS H 1 1 28 17353 1 1 4 CYS HA H -10.665 -5.503 4.119 1.00 . A A . 4 CYS HA 1 1 28 17354 1 1 4 CYS HB2 H -12.222 -5.823 1.573 1.00 . A A . 4 CYS HB2 1 1 28 17355 1 1 4 CYS HB3 H -10.495 -6.157 1.609 1.00 . A A . 4 CYS HB3 1 1 28 17356 1 1 4 CYS N N -12.512 -4.640 3.820 1.00 . A A . 4 CYS N 1 1 28 17357 1 1 4 CYS O O -9.219 -3.769 2.989 1.00 . A A . 4 CYS O 1 1 28 17358 1 1 4 CYS SG S -11.736 -7.794 2.822 1.00 . A A . 4 CYS SG 1 1 28 17359 1 1 5 THR C C -9.590 -2.192 0.290 1.00 . A A . 5 THR C 1 1 28 17360 1 1 5 THR CA C -10.469 -1.808 1.476 1.00 . A A . 5 THR CA 1 1 28 17361 1 1 5 THR CB C -9.634 -1.081 2.534 1.00 . A A . 5 THR CB 1 1 28 17362 1 1 5 THR CG2 C -9.330 0.357 2.171 1.00 . A A . 5 THR CG2 1 1 28 17363 1 1 5 THR H H -12.065 -3.132 1.906 1.00 . A A . 5 THR H 1 1 28 17364 1 1 5 THR HA H -11.246 -1.146 1.130 1.00 . A A . 5 THR HA 1 1 28 17365 1 1 5 THR HB H -8.692 -1.598 2.653 1.00 . A A . 5 THR HB 1 1 28 17366 1 1 5 THR HG1 H -9.702 -1.386 4.467 1.00 . A A . 5 THR HG1 1 1 28 17367 1 1 5 THR HG21 H -10.249 0.869 1.929 1.00 . A A . 5 THR HG21 1 1 28 17368 1 1 5 THR HG22 H -8.854 0.847 3.008 1.00 . A A . 5 THR HG22 1 1 28 17369 1 1 5 THR HG23 H -8.669 0.381 1.318 1.00 . A A . 5 THR HG23 1 1 28 17370 1 1 5 THR N N -11.108 -2.989 2.051 1.00 . A A . 5 THR N 1 1 28 17371 1 1 5 THR O O -8.372 -2.036 0.332 1.00 . A A . 5 THR O 1 1 28 17372 1 1 5 THR OG1 O -10.300 -1.076 3.784 1.00 . A A . 5 THR OG1 1 1 28 17373 1 1 6 THR C C -8.631 -1.948 -2.499 1.00 . A A . 6 THR C 1 1 28 17374 1 1 6 THR CA C -9.480 -3.099 -1.966 1.00 . A A . 6 THR CA 1 1 28 17375 1 1 6 THR CB C -10.449 -3.579 -3.048 1.00 . A A . 6 THR CB 1 1 28 17376 1 1 6 THR CG2 C -11.119 -4.893 -2.709 1.00 . A A . 6 THR CG2 1 1 28 17377 1 1 6 THR H H -11.188 -2.797 -0.748 1.00 . A A . 6 THR H 1 1 28 17378 1 1 6 THR HA H -8.828 -3.914 -1.693 1.00 . A A . 6 THR HA 1 1 28 17379 1 1 6 THR HB H -9.903 -3.714 -3.970 1.00 . A A . 6 THR HB 1 1 28 17380 1 1 6 THR HG1 H -12.062 -2.601 -2.517 1.00 . A A . 6 THR HG1 1 1 28 17381 1 1 6 THR HG21 H -10.493 -5.452 -2.029 1.00 . A A . 6 THR HG21 1 1 28 17382 1 1 6 THR HG22 H -12.074 -4.702 -2.244 1.00 . A A . 6 THR HG22 1 1 28 17383 1 1 6 THR HG23 H -11.267 -5.465 -3.613 1.00 . A A . 6 THR HG23 1 1 28 17384 1 1 6 THR N N -10.214 -2.695 -0.770 1.00 . A A . 6 THR N 1 1 28 17385 1 1 6 THR O O -9.155 -0.895 -2.865 1.00 . A A . 6 THR O 1 1 28 17386 1 1 6 THR OG1 O -11.469 -2.620 -3.271 1.00 . A A . 6 THR OG1 1 1 28 17387 1 1 7 GLY C C -5.037 -1.658 -3.352 1.00 . A A . 7 GLY C 1 1 28 17388 1 1 7 GLY CA C -6.420 -1.124 -3.025 1.00 . A A . 7 GLY CA 1 1 28 17389 1 1 7 GLY H H -6.957 -3.013 -2.232 1.00 . A A . 7 GLY H 1 1 28 17390 1 1 7 GLY HA2 H -6.328 -0.357 -2.269 1.00 . A A . 7 GLY HA2 1 1 28 17391 1 1 7 GLY HA3 H -6.844 -0.685 -3.916 1.00 . A A . 7 GLY HA3 1 1 28 17392 1 1 7 GLY N N -7.318 -2.155 -2.538 1.00 . A A . 7 GLY N 1 1 28 17393 1 1 7 GLY O O -4.729 -2.812 -3.057 1.00 . A A . 7 GLY O 1 1 28 17394 1 1 8 PRO C C -1.998 -1.726 -3.150 1.00 . A A . 8 PRO C 1 1 28 17395 1 1 8 PRO CA C -2.814 -1.232 -4.344 1.00 . A A . 8 PRO CA 1 1 28 17396 1 1 8 PRO CB C -2.196 0.049 -4.928 1.00 . A A . 8 PRO CB 1 1 28 17397 1 1 8 PRO CD C -4.465 0.556 -4.365 1.00 . A A . 8 PRO CD 1 1 28 17398 1 1 8 PRO CG C -3.098 1.159 -4.501 1.00 . A A . 8 PRO CG 1 1 28 17399 1 1 8 PRO HA H -2.828 -2.001 -5.102 1.00 . A A . 8 PRO HA 1 1 28 17400 1 1 8 PRO HB2 H -1.199 0.181 -4.536 1.00 . A A . 8 PRO HB2 1 1 28 17401 1 1 8 PRO HB3 H -2.154 -0.028 -6.006 1.00 . A A . 8 PRO HB3 1 1 28 17402 1 1 8 PRO HD2 H -5.029 1.066 -3.597 1.00 . A A . 8 PRO HD2 1 1 28 17403 1 1 8 PRO HD3 H -4.989 0.589 -5.308 1.00 . A A . 8 PRO HD3 1 1 28 17404 1 1 8 PRO HG2 H -2.769 1.555 -3.553 1.00 . A A . 8 PRO HG2 1 1 28 17405 1 1 8 PRO HG3 H -3.105 1.935 -5.251 1.00 . A A . 8 PRO HG3 1 1 28 17406 1 1 8 PRO N N -4.176 -0.831 -3.972 1.00 . A A . 8 PRO N 1 1 28 17407 1 1 8 PRO O O -1.065 -2.513 -3.314 1.00 . A A . 8 PRO O 1 1 28 17408 1 1 9 CYS C C -2.274 -2.905 -0.110 1.00 . A A . 9 CYS C 1 1 28 17409 1 1 9 CYS CA C -1.635 -1.671 -0.743 1.00 . A A . 9 CYS CA 1 1 28 17410 1 1 9 CYS CB C -1.584 -0.519 0.266 1.00 . A A . 9 CYS CB 1 1 28 17411 1 1 9 CYS H H -3.099 -0.640 -1.879 1.00 . A A . 9 CYS H 1 1 28 17412 1 1 9 CYS HA H -0.628 -1.923 -1.029 1.00 . A A . 9 CYS HA 1 1 28 17413 1 1 9 CYS HB2 H -2.133 0.320 -0.133 1.00 . A A . 9 CYS HB2 1 1 28 17414 1 1 9 CYS HB3 H -2.042 -0.835 1.192 1.00 . A A . 9 CYS HB3 1 1 28 17415 1 1 9 CYS N N -2.348 -1.265 -1.952 1.00 . A A . 9 CYS N 1 1 28 17416 1 1 9 CYS O O -1.608 -3.666 0.591 1.00 . A A . 9 CYS O 1 1 28 17417 1 1 9 CYS SG S 0.101 0.063 0.648 1.00 . A A . 9 CYS SG 1 1 28 17418 1 1 10 CYS C C -3.747 -5.551 -0.432 1.00 . A A . 10 CYS C 1 1 28 17419 1 1 10 CYS CA C -4.275 -4.254 0.177 1.00 . A A . 10 CYS CA 1 1 28 17420 1 1 10 CYS CB C -5.776 -4.124 -0.087 1.00 . A A . 10 CYS CB 1 1 28 17421 1 1 10 CYS H H -4.043 -2.469 -0.935 1.00 . A A . 10 CYS H 1 1 28 17422 1 1 10 CYS HA H -4.106 -4.276 1.243 1.00 . A A . 10 CYS HA 1 1 28 17423 1 1 10 CYS HB2 H -5.972 -3.163 -0.536 1.00 . A A . 10 CYS HB2 1 1 28 17424 1 1 10 CYS HB3 H -6.085 -4.903 -0.770 1.00 . A A . 10 CYS HB3 1 1 28 17425 1 1 10 CYS N N -3.562 -3.104 -0.366 1.00 . A A . 10 CYS N 1 1 28 17426 1 1 10 CYS O O -3.948 -5.818 -1.616 1.00 . A A . 10 CYS O 1 1 28 17427 1 1 10 CYS SG S -6.809 -4.257 1.408 1.00 . A A . 10 CYS SG 1 1 28 17428 1 1 11 ARG C C -3.611 -8.637 -0.377 1.00 . A A . 11 ARG C 1 1 28 17429 1 1 11 ARG CA C -2.512 -7.619 -0.074 1.00 . A A . 11 ARG CA 1 1 28 17430 1 1 11 ARG CB C -1.553 -8.186 0.974 1.00 . A A . 11 ARG CB 1 1 28 17431 1 1 11 ARG CD C 0.318 -9.786 1.476 1.00 . A A . 11 ARG CD 1 1 28 17432 1 1 11 ARG CG C -0.463 -9.068 0.387 1.00 . A A . 11 ARG CG 1 1 28 17433 1 1 11 ARG CZ C 1.495 -11.927 1.796 1.00 . A A . 11 ARG CZ 1 1 28 17434 1 1 11 ARG H H -2.942 -6.083 1.319 1.00 . A A . 11 ARG H 1 1 28 17435 1 1 11 ARG HA H -1.963 -7.426 -0.981 1.00 . A A . 11 ARG HA 1 1 28 17436 1 1 11 ARG HB2 H -1.081 -7.366 1.495 1.00 . A A . 11 ARG HB2 1 1 28 17437 1 1 11 ARG HB3 H -2.119 -8.773 1.682 1.00 . A A . 11 ARG HB3 1 1 28 17438 1 1 11 ARG HD2 H 1.207 -9.215 1.699 1.00 . A A . 11 ARG HD2 1 1 28 17439 1 1 11 ARG HD3 H -0.299 -9.851 2.360 1.00 . A A . 11 ARG HD3 1 1 28 17440 1 1 11 ARG HE H 0.371 -11.465 0.213 1.00 . A A . 11 ARG HE 1 1 28 17441 1 1 11 ARG HG2 H -0.918 -9.804 -0.260 1.00 . A A . 11 ARG HG2 1 1 28 17442 1 1 11 ARG HG3 H 0.215 -8.453 -0.185 1.00 . A A . 11 ARG HG3 1 1 28 17443 1 1 11 ARG HH11 H 1.745 -10.599 3.302 1.00 . A A . 11 ARG HH11 1 1 28 17444 1 1 11 ARG HH12 H 2.562 -12.113 3.503 1.00 . A A . 11 ARG HH12 1 1 28 17445 1 1 11 ARG HH21 H 1.446 -13.456 0.476 1.00 . A A . 11 ARG HH21 1 1 28 17446 1 1 11 ARG HH22 H 2.393 -13.734 1.899 1.00 . A A . 11 ARG HH22 1 1 28 17447 1 1 11 ARG N N -3.070 -6.351 0.385 1.00 . A A . 11 ARG N 1 1 28 17448 1 1 11 ARG NE N 0.710 -11.133 1.071 1.00 . A A . 11 ARG NE 1 1 28 17449 1 1 11 ARG NH1 N 1.973 -11.512 2.963 1.00 . A A . 11 ARG NH1 1 1 28 17450 1 1 11 ARG NH2 N 1.803 -13.138 1.354 1.00 . A A . 11 ARG NH2 1 1 28 17451 1 1 11 ARG O O -3.350 -9.685 -0.967 1.00 . A A . 11 ARG O 1 1 28 17452 1 1 12 GLN C C -7.197 -8.731 0.582 1.00 . A A . 12 GLN C 1 1 28 17453 1 1 12 GLN CA C -5.976 -9.212 -0.195 1.00 . A A . 12 GLN CA 1 1 28 17454 1 1 12 GLN CB C -5.633 -10.647 0.218 1.00 . A A . 12 GLN CB 1 1 28 17455 1 1 12 GLN CD C -5.131 -12.032 2.270 1.00 . A A . 12 GLN CD 1 1 28 17456 1 1 12 GLN CG C -4.865 -10.737 1.527 1.00 . A A . 12 GLN CG 1 1 28 17457 1 1 12 GLN H H -4.984 -7.476 0.496 1.00 . A A . 12 GLN H 1 1 28 17458 1 1 12 GLN HA H -6.205 -9.195 -1.249 1.00 . A A . 12 GLN HA 1 1 28 17459 1 1 12 GLN HB2 H -6.550 -11.207 0.325 1.00 . A A . 12 GLN HB2 1 1 28 17460 1 1 12 GLN HB3 H -5.034 -11.099 -0.558 1.00 . A A . 12 GLN HB3 1 1 28 17461 1 1 12 GLN HE21 H -3.990 -13.033 0.986 1.00 . A A . 12 GLN HE21 1 1 28 17462 1 1 12 GLN HE22 H -4.705 -13.974 2.246 1.00 . A A . 12 GLN HE22 1 1 28 17463 1 1 12 GLN HG2 H -3.808 -10.673 1.314 1.00 . A A . 12 GLN HG2 1 1 28 17464 1 1 12 GLN HG3 H -5.155 -9.910 2.158 1.00 . A A . 12 GLN HG3 1 1 28 17465 1 1 12 GLN N N -4.838 -8.324 0.031 1.00 . A A . 12 GLN N 1 1 28 17466 1 1 12 GLN NE2 N -4.550 -13.123 1.785 1.00 . A A . 12 GLN NE2 1 1 28 17467 1 1 12 GLN O O -8.335 -8.980 0.186 1.00 . A A . 12 GLN O 1 1 28 17468 1 1 12 GLN OE1 O -5.850 -12.051 3.269 1.00 . A A . 12 GLN OE1 1 1 28 17469 1 1 13 CYS C C -7.492 -6.637 3.646 1.00 . A A . 13 CYS C 1 1 28 17470 1 1 13 CYS CA C -8.031 -7.523 2.525 1.00 . A A . 13 CYS CA 1 1 28 17471 1 1 13 CYS CB C -8.844 -8.675 3.118 1.00 . A A . 13 CYS CB 1 1 28 17472 1 1 13 CYS H H -6.023 -7.874 1.953 1.00 . A A . 13 CYS H 1 1 28 17473 1 1 13 CYS HA H -8.676 -6.930 1.895 1.00 . A A . 13 CYS HA 1 1 28 17474 1 1 13 CYS HB2 H -9.243 -9.275 2.314 1.00 . A A . 13 CYS HB2 1 1 28 17475 1 1 13 CYS HB3 H -8.196 -9.286 3.729 1.00 . A A . 13 CYS HB3 1 1 28 17476 1 1 13 CYS N N -6.951 -8.040 1.691 1.00 . A A . 13 CYS N 1 1 28 17477 1 1 13 CYS O O -8.169 -5.709 4.090 1.00 . A A . 13 CYS O 1 1 28 17478 1 1 13 CYS SG S -10.243 -8.139 4.155 1.00 . A A . 13 CYS SG 1 1 28 17479 1 1 14 LYS C C -4.485 -5.338 4.637 1.00 . A A . 14 LYS C 1 1 28 17480 1 1 14 LYS CA C -5.663 -6.141 5.170 1.00 . A A . 14 LYS CA 1 1 28 17481 1 1 14 LYS CB C -5.201 -7.059 6.303 1.00 . A A . 14 LYS CB 1 1 28 17482 1 1 14 LYS CD C -5.838 -8.803 7.996 1.00 . A A . 14 LYS CD 1 1 28 17483 1 1 14 LYS CE C -6.224 -10.273 7.956 1.00 . A A . 14 LYS CE 1 1 28 17484 1 1 14 LYS CG C -6.241 -8.086 6.717 1.00 . A A . 14 LYS CG 1 1 28 17485 1 1 14 LYS H H -5.776 -7.670 3.716 1.00 . A A . 14 LYS H 1 1 28 17486 1 1 14 LYS HA H -6.407 -5.458 5.551 1.00 . A A . 14 LYS HA 1 1 28 17487 1 1 14 LYS HB2 H -4.313 -7.585 5.985 1.00 . A A . 14 LYS HB2 1 1 28 17488 1 1 14 LYS HB3 H -4.960 -6.454 7.165 1.00 . A A . 14 LYS HB3 1 1 28 17489 1 1 14 LYS HD2 H -4.768 -8.726 8.118 1.00 . A A . 14 LYS HD2 1 1 28 17490 1 1 14 LYS HD3 H -6.333 -8.332 8.832 1.00 . A A . 14 LYS HD3 1 1 28 17491 1 1 14 LYS HE2 H -6.426 -10.606 8.963 1.00 . A A . 14 LYS HE2 1 1 28 17492 1 1 14 LYS HE3 H -7.115 -10.382 7.356 1.00 . A A . 14 LYS HE3 1 1 28 17493 1 1 14 LYS HG2 H -7.184 -7.585 6.879 1.00 . A A . 14 LYS HG2 1 1 28 17494 1 1 14 LYS HG3 H -6.350 -8.814 5.926 1.00 . A A . 14 LYS HG3 1 1 28 17495 1 1 14 LYS HZ1 H -4.217 -10.668 7.531 1.00 . A A . 14 LYS HZ1 1 1 28 17496 1 1 14 LYS HZ2 H -5.141 -12.054 7.823 1.00 . A A . 14 LYS HZ2 1 1 28 17497 1 1 14 LYS HZ3 H -5.291 -11.232 6.352 1.00 . A A . 14 LYS HZ3 1 1 28 17498 1 1 14 LYS N N -6.275 -6.922 4.103 1.00 . A A . 14 LYS N 1 1 28 17499 1 1 14 LYS NZ N -5.142 -11.116 7.375 1.00 . A A . 14 LYS NZ 1 1 28 17500 1 1 14 LYS O O -3.616 -5.877 3.951 1.00 . A A . 14 LYS O 1 1 28 17501 1 1 15 LEU C C -2.025 -3.831 4.657 1.00 . A A . 15 LEU C 1 1 28 17502 1 1 15 LEU CA C -3.388 -3.163 4.501 1.00 . A A . 15 LEU CA 1 1 28 17503 1 1 15 LEU CB C -3.409 -1.823 5.258 1.00 . A A . 15 LEU CB 1 1 28 17504 1 1 15 LEU CD1 C -5.395 -1.826 6.810 1.00 . A A . 15 LEU CD1 1 1 28 17505 1 1 15 LEU CD2 C -3.316 -3.071 7.457 1.00 . A A . 15 LEU CD2 1 1 28 17506 1 1 15 LEU CG C -3.875 -1.858 6.723 1.00 . A A . 15 LEU CG 1 1 28 17507 1 1 15 LEU H H -5.186 -3.679 5.496 1.00 . A A . 15 LEU H 1 1 28 17508 1 1 15 LEU HA H -3.551 -2.968 3.452 1.00 . A A . 15 LEU HA 1 1 28 17509 1 1 15 LEU HB2 H -2.409 -1.416 5.238 1.00 . A A . 15 LEU HB2 1 1 28 17510 1 1 15 LEU HB3 H -4.057 -1.149 4.719 1.00 . A A . 15 LEU HB3 1 1 28 17511 1 1 15 LEU HD11 H -5.808 -1.642 5.829 1.00 . A A . 15 LEU HD11 1 1 28 17512 1 1 15 LEU HD12 H -5.755 -2.774 7.180 1.00 . A A . 15 LEU HD12 1 1 28 17513 1 1 15 LEU HD13 H -5.700 -1.038 7.482 1.00 . A A . 15 LEU HD13 1 1 28 17514 1 1 15 LEU HD21 H -3.635 -3.975 6.963 1.00 . A A . 15 LEU HD21 1 1 28 17515 1 1 15 LEU HD22 H -2.238 -3.023 7.460 1.00 . A A . 15 LEU HD22 1 1 28 17516 1 1 15 LEU HD23 H -3.678 -3.071 8.475 1.00 . A A . 15 LEU HD23 1 1 28 17517 1 1 15 LEU HG H -3.505 -0.974 7.222 1.00 . A A . 15 LEU HG 1 1 28 17518 1 1 15 LEU N N -4.463 -4.045 4.952 1.00 . A A . 15 LEU N 1 1 28 17519 1 1 15 LEU O O -1.660 -4.283 5.742 1.00 . A A . 15 LEU O 1 1 28 17520 1 1 16 LYS C C 0.885 -3.982 4.731 1.00 . A A . 16 LYS C 1 1 28 17521 1 1 16 LYS CA C 0.042 -4.520 3.574 1.00 . A A . 16 LYS CA 1 1 28 17522 1 1 16 LYS CB C 0.760 -4.275 2.245 1.00 . A A . 16 LYS CB 1 1 28 17523 1 1 16 LYS CD C 1.351 -5.128 -0.043 1.00 . A A . 16 LYS CD 1 1 28 17524 1 1 16 LYS CE C 0.832 -5.983 -1.188 1.00 . A A . 16 LYS CE 1 1 28 17525 1 1 16 LYS CG C 0.599 -5.411 1.248 1.00 . A A . 16 LYS CG 1 1 28 17526 1 1 16 LYS H H -1.623 -3.529 2.722 1.00 . A A . 16 LYS H 1 1 28 17527 1 1 16 LYS HA H -0.098 -5.584 3.708 1.00 . A A . 16 LYS HA 1 1 28 17528 1 1 16 LYS HB2 H 0.366 -3.374 1.798 1.00 . A A . 16 LYS HB2 1 1 28 17529 1 1 16 LYS HB3 H 1.814 -4.140 2.437 1.00 . A A . 16 LYS HB3 1 1 28 17530 1 1 16 LYS HD2 H 1.227 -4.087 -0.300 1.00 . A A . 16 LYS HD2 1 1 28 17531 1 1 16 LYS HD3 H 2.399 -5.342 0.108 1.00 . A A . 16 LYS HD3 1 1 28 17532 1 1 16 LYS HE2 H -0.159 -6.334 -0.939 1.00 . A A . 16 LYS HE2 1 1 28 17533 1 1 16 LYS HE3 H 0.783 -5.376 -2.080 1.00 . A A . 16 LYS HE3 1 1 28 17534 1 1 16 LYS HG2 H 0.986 -6.319 1.686 1.00 . A A . 16 LYS HG2 1 1 28 17535 1 1 16 LYS HG3 H -0.450 -5.535 1.024 1.00 . A A . 16 LYS HG3 1 1 28 17536 1 1 16 LYS HZ1 H 2.026 -7.573 -0.549 1.00 . A A . 16 LYS HZ1 1 1 28 17537 1 1 16 LYS HZ2 H 1.192 -7.879 -1.989 1.00 . A A . 16 LYS HZ2 1 1 28 17538 1 1 16 LYS HZ3 H 2.546 -6.864 -1.994 1.00 . A A . 16 LYS HZ3 1 1 28 17539 1 1 16 LYS N N -1.277 -3.899 3.560 1.00 . A A . 16 LYS N 1 1 28 17540 1 1 16 LYS NZ N 1.710 -7.157 -1.448 1.00 . A A . 16 LYS NZ 1 1 28 17541 1 1 16 LYS O O 0.759 -2.818 5.109 1.00 . A A . 16 LYS O 1 1 28 17542 1 1 17 PRO C C 3.369 -3.129 6.156 1.00 . A A . 17 PRO C 1 1 28 17543 1 1 17 PRO CA C 2.615 -4.426 6.431 1.00 . A A . 17 PRO CA 1 1 28 17544 1 1 17 PRO CB C 3.595 -5.592 6.559 1.00 . A A . 17 PRO CB 1 1 28 17545 1 1 17 PRO CD C 1.970 -6.232 4.923 1.00 . A A . 17 PRO CD 1 1 28 17546 1 1 17 PRO CG C 2.865 -6.766 6.007 1.00 . A A . 17 PRO CG 1 1 28 17547 1 1 17 PRO HA H 2.050 -4.325 7.345 1.00 . A A . 17 PRO HA 1 1 28 17548 1 1 17 PRO HB2 H 4.489 -5.378 5.991 1.00 . A A . 17 PRO HB2 1 1 28 17549 1 1 17 PRO HB3 H 3.850 -5.739 7.598 1.00 . A A . 17 PRO HB3 1 1 28 17550 1 1 17 PRO HD2 H 2.461 -6.296 3.963 1.00 . A A . 17 PRO HD2 1 1 28 17551 1 1 17 PRO HD3 H 1.035 -6.773 4.906 1.00 . A A . 17 PRO HD3 1 1 28 17552 1 1 17 PRO HG2 H 3.569 -7.474 5.596 1.00 . A A . 17 PRO HG2 1 1 28 17553 1 1 17 PRO HG3 H 2.276 -7.230 6.784 1.00 . A A . 17 PRO HG3 1 1 28 17554 1 1 17 PRO N N 1.756 -4.825 5.311 1.00 . A A . 17 PRO N 1 1 28 17555 1 1 17 PRO O O 4.054 -3.002 5.142 1.00 . A A . 17 PRO O 1 1 28 17556 1 1 18 ALA C C 5.388 -1.070 6.562 1.00 . A A . 18 ALA C 1 1 28 17557 1 1 18 ALA CA C 3.918 -0.883 6.927 1.00 . A A . 18 ALA CA 1 1 28 17558 1 1 18 ALA CB C 3.790 -0.076 8.210 1.00 . A A . 18 ALA CB 1 1 28 17559 1 1 18 ALA H H 2.685 -2.330 7.857 1.00 . A A . 18 ALA H 1 1 28 17560 1 1 18 ALA HA H 3.428 -0.335 6.135 1.00 . A A . 18 ALA HA 1 1 28 17561 1 1 18 ALA HB1 H 4.725 -0.104 8.749 1.00 . A A . 18 ALA HB1 1 1 28 17562 1 1 18 ALA HB2 H 3.008 -0.498 8.824 1.00 . A A . 18 ALA HB2 1 1 28 17563 1 1 18 ALA HB3 H 3.545 0.948 7.969 1.00 . A A . 18 ALA HB3 1 1 28 17564 1 1 18 ALA N N 3.243 -2.169 7.069 1.00 . A A . 18 ALA N 1 1 28 17565 1 1 18 ALA O O 6.010 -2.062 6.943 1.00 . A A . 18 ALA O 1 1 28 17566 1 1 19 GLY C C 7.541 -1.174 4.267 1.00 . A A . 19 GLY C 1 1 28 17567 1 1 19 GLY CA C 7.324 -0.200 5.411 1.00 . A A . 19 GLY CA 1 1 28 17568 1 1 19 GLY H H 5.389 0.650 5.540 1.00 . A A . 19 GLY H 1 1 28 17569 1 1 19 GLY HA2 H 7.916 -0.518 6.257 1.00 . A A . 19 GLY HA2 1 1 28 17570 1 1 19 GLY HA3 H 7.656 0.780 5.102 1.00 . A A . 19 GLY HA3 1 1 28 17571 1 1 19 GLY N N 5.935 -0.116 5.818 1.00 . A A . 19 GLY N 1 1 28 17572 1 1 19 GLY O O 8.678 -1.421 3.865 1.00 . A A . 19 GLY O 1 1 28 17573 1 1 20 THR C C 5.962 -2.082 1.358 1.00 . A A . 20 THR C 1 1 28 17574 1 1 20 THR CA C 6.539 -2.680 2.636 1.00 . A A . 20 THR CA 1 1 28 17575 1 1 20 THR CB C 5.798 -3.972 2.986 1.00 . A A . 20 THR CB 1 1 28 17576 1 1 20 THR CG2 C 5.835 -5.003 1.879 1.00 . A A . 20 THR CG2 1 1 28 17577 1 1 20 THR H H 5.570 -1.497 4.098 1.00 . A A . 20 THR H 1 1 28 17578 1 1 20 THR HA H 7.582 -2.906 2.475 1.00 . A A . 20 THR HA 1 1 28 17579 1 1 20 THR HB H 4.762 -3.737 3.184 1.00 . A A . 20 THR HB 1 1 28 17580 1 1 20 THR HG1 H 5.816 -5.324 4.403 1.00 . A A . 20 THR HG1 1 1 28 17581 1 1 20 THR HG21 H 6.180 -4.540 0.967 1.00 . A A . 20 THR HG21 1 1 28 17582 1 1 20 THR HG22 H 6.507 -5.803 2.154 1.00 . A A . 20 THR HG22 1 1 28 17583 1 1 20 THR HG23 H 4.843 -5.403 1.727 1.00 . A A . 20 THR HG23 1 1 28 17584 1 1 20 THR N N 6.452 -1.730 3.739 1.00 . A A . 20 THR N 1 1 28 17585 1 1 20 THR O O 4.758 -1.848 1.259 1.00 . A A . 20 THR O 1 1 28 17586 1 1 20 THR OG1 O 6.349 -4.568 4.148 1.00 . A A . 20 THR OG1 1 1 28 17587 1 1 21 THR C C 5.322 -2.131 -1.539 1.00 . A A . 21 THR C 1 1 28 17588 1 1 21 THR CA C 6.403 -1.273 -0.895 1.00 . A A . 21 THR CA 1 1 28 17589 1 1 21 THR CB C 7.594 -1.139 -1.841 1.00 . A A . 21 THR CB 1 1 28 17590 1 1 21 THR CG2 C 8.484 -2.359 -1.849 1.00 . A A . 21 THR CG2 1 1 28 17591 1 1 21 THR H H 7.775 -2.051 0.518 1.00 . A A . 21 THR H 1 1 28 17592 1 1 21 THR HA H 5.997 -0.294 -0.702 1.00 . A A . 21 THR HA 1 1 28 17593 1 1 21 THR HB H 8.192 -0.296 -1.533 1.00 . A A . 21 THR HB 1 1 28 17594 1 1 21 THR HG1 H 7.344 -0.007 -3.419 1.00 . A A . 21 THR HG1 1 1 28 17595 1 1 21 THR HG21 H 8.099 -3.086 -1.149 1.00 . A A . 21 THR HG21 1 1 28 17596 1 1 21 THR HG22 H 8.501 -2.786 -2.840 1.00 . A A . 21 THR HG22 1 1 28 17597 1 1 21 THR HG23 H 9.485 -2.076 -1.560 1.00 . A A . 21 THR HG23 1 1 28 17598 1 1 21 THR N N 6.828 -1.841 0.380 1.00 . A A . 21 THR N 1 1 28 17599 1 1 21 THR O O 5.542 -3.304 -1.841 1.00 . A A . 21 THR O 1 1 28 17600 1 1 21 THR OG1 O 7.158 -0.915 -3.170 1.00 . A A . 21 THR OG1 1 1 28 17601 1 1 22 CYS C C 2.986 -1.991 -3.852 1.00 . A A . 22 CYS C 1 1 28 17602 1 1 22 CYS CA C 3.035 -2.241 -2.351 1.00 . A A . 22 CYS CA 1 1 28 17603 1 1 22 CYS CB C 1.717 -1.795 -1.702 1.00 . A A . 22 CYS CB 1 1 28 17604 1 1 22 CYS H H 4.043 -0.599 -1.480 1.00 . A A . 22 CYS H 1 1 28 17605 1 1 22 CYS HA H 3.173 -3.297 -2.177 1.00 . A A . 22 CYS HA 1 1 28 17606 1 1 22 CYS HB2 H 1.045 -2.639 -1.665 1.00 . A A . 22 CYS HB2 1 1 28 17607 1 1 22 CYS HB3 H 1.918 -1.461 -0.694 1.00 . A A . 22 CYS HB3 1 1 28 17608 1 1 22 CYS N N 4.155 -1.536 -1.745 1.00 . A A . 22 CYS N 1 1 28 17609 1 1 22 CYS O O 2.621 -2.871 -4.631 1.00 . A A . 22 CYS O 1 1 28 17610 1 1 22 CYS SG S 0.845 -0.441 -2.572 1.00 . A A . 22 CYS SG 1 1 28 17611 1 1 23 TRP C C 4.583 -0.777 -6.372 1.00 . A A . 23 TRP C 1 1 28 17612 1 1 23 TRP CA C 3.306 -0.385 -5.641 1.00 . A A . 23 TRP CA 1 1 28 17613 1 1 23 TRP CB C 3.072 1.120 -5.760 1.00 . A A . 23 TRP CB 1 1 28 17614 1 1 23 TRP CD1 C 1.951 0.712 -8.015 1.00 . A A . 23 TRP CD1 1 1 28 17615 1 1 23 TRP CD2 C 1.494 2.702 -7.108 1.00 . A A . 23 TRP CD2 1 1 28 17616 1 1 23 TRP CE2 C 0.818 2.603 -8.336 1.00 . A A . 23 TRP CE2 1 1 28 17617 1 1 23 TRP CE3 C 1.357 3.867 -6.354 1.00 . A A . 23 TRP CE3 1 1 28 17618 1 1 23 TRP CG C 2.210 1.482 -6.922 1.00 . A A . 23 TRP CG 1 1 28 17619 1 1 23 TRP CH2 C -0.100 4.754 -8.071 1.00 . A A . 23 TRP CH2 1 1 28 17620 1 1 23 TRP CZ2 C 0.018 3.624 -8.826 1.00 . A A . 23 TRP CZ2 1 1 28 17621 1 1 23 TRP CZ3 C 0.562 4.885 -6.844 1.00 . A A . 23 TRP CZ3 1 1 28 17622 1 1 23 TRP H H 3.596 -0.112 -3.568 1.00 . A A . 23 TRP H 1 1 28 17623 1 1 23 TRP HA H 2.480 -0.896 -6.104 1.00 . A A . 23 TRP HA 1 1 28 17624 1 1 23 TRP HB2 H 2.589 1.476 -4.863 1.00 . A A . 23 TRP HB2 1 1 28 17625 1 1 23 TRP HB3 H 4.019 1.623 -5.878 1.00 . A A . 23 TRP HB3 1 1 28 17626 1 1 23 TRP HD1 H 2.355 -0.276 -8.170 1.00 . A A . 23 TRP HD1 1 1 28 17627 1 1 23 TRP HE1 H 0.783 1.038 -9.728 1.00 . A A . 23 TRP HE1 1 1 28 17628 1 1 23 TRP HE3 H 1.861 3.981 -5.406 1.00 . A A . 23 TRP HE3 1 1 28 17629 1 1 23 TRP HH2 H -0.706 5.571 -8.420 1.00 . A A . 23 TRP HH2 1 1 28 17630 1 1 23 TRP HZ2 H -0.502 3.537 -9.764 1.00 . A A . 23 TRP HZ2 1 1 28 17631 1 1 23 TRP HZ3 H 0.443 5.796 -6.277 1.00 . A A . 23 TRP HZ3 1 1 28 17632 1 1 23 TRP N N 3.334 -0.773 -4.242 1.00 . A A . 23 TRP N 1 1 28 17633 1 1 23 TRP NE1 N 1.114 1.380 -8.873 1.00 . A A . 23 TRP NE1 1 1 28 17634 1 1 23 TRP O O 4.604 -1.755 -7.120 1.00 . A A . 23 TRP O 1 1 28 17635 1 1 24 LYS C C 6.740 -0.227 -8.350 1.00 . A A . 24 LYS C 1 1 28 17636 1 1 24 LYS CA C 6.908 -0.266 -6.831 1.00 . A A . 24 LYS CA 1 1 28 17637 1 1 24 LYS CB C 7.458 -1.624 -6.398 1.00 . A A . 24 LYS CB 1 1 28 17638 1 1 24 LYS CD C 9.839 -1.553 -5.598 1.00 . A A . 24 LYS CD 1 1 28 17639 1 1 24 LYS CE C 11.300 -1.583 -6.018 1.00 . A A . 24 LYS CE 1 1 28 17640 1 1 24 LYS CG C 8.916 -1.838 -6.772 1.00 . A A . 24 LYS CG 1 1 28 17641 1 1 24 LYS H H 5.560 0.768 -5.573 1.00 . A A . 24 LYS H 1 1 28 17642 1 1 24 LYS HA H 7.602 0.506 -6.537 1.00 . A A . 24 LYS HA 1 1 28 17643 1 1 24 LYS HB2 H 7.366 -1.710 -5.326 1.00 . A A . 24 LYS HB2 1 1 28 17644 1 1 24 LYS HB3 H 6.871 -2.402 -6.864 1.00 . A A . 24 LYS HB3 1 1 28 17645 1 1 24 LYS HD2 H 9.610 -0.576 -5.201 1.00 . A A . 24 LYS HD2 1 1 28 17646 1 1 24 LYS HD3 H 9.678 -2.301 -4.836 1.00 . A A . 24 LYS HD3 1 1 28 17647 1 1 24 LYS HE2 H 11.708 -2.556 -5.787 1.00 . A A . 24 LYS HE2 1 1 28 17648 1 1 24 LYS HE3 H 11.359 -1.413 -7.083 1.00 . A A . 24 LYS HE3 1 1 28 17649 1 1 24 LYS HG2 H 9.052 -2.863 -7.082 1.00 . A A . 24 LYS HG2 1 1 28 17650 1 1 24 LYS HG3 H 9.169 -1.176 -7.587 1.00 . A A . 24 LYS HG3 1 1 28 17651 1 1 24 LYS HZ1 H 11.605 0.370 -5.342 1.00 . A A . 24 LYS HZ1 1 1 28 17652 1 1 24 LYS HZ2 H 12.250 -0.816 -4.324 1.00 . A A . 24 LYS HZ2 1 1 28 17653 1 1 24 LYS HZ3 H 13.028 -0.434 -5.777 1.00 . A A . 24 LYS HZ3 1 1 28 17654 1 1 24 LYS N N 5.639 -0.002 -6.170 1.00 . A A . 24 LYS N 1 1 28 17655 1 1 24 LYS NZ N 12.102 -0.543 -5.316 1.00 . A A . 24 LYS NZ 1 1 28 17656 1 1 24 LYS O O 7.533 -0.814 -9.085 1.00 . A A . 24 LYS O 1 1 28 17657 1 1 25 THR C C 6.669 1.077 -10.989 1.00 . A A . 25 THR C 1 1 28 17658 1 1 25 THR CA C 5.429 0.583 -10.245 1.00 . A A . 25 THR CA 1 1 28 17659 1 1 25 THR CB C 4.248 1.529 -10.496 1.00 . A A . 25 THR CB 1 1 28 17660 1 1 25 THR CG2 C 4.505 2.941 -10.028 1.00 . A A . 25 THR CG2 1 1 28 17661 1 1 25 THR H H 5.101 0.916 -8.179 1.00 . A A . 25 THR H 1 1 28 17662 1 1 25 THR HA H 5.174 -0.400 -10.611 1.00 . A A . 25 THR HA 1 1 28 17663 1 1 25 THR HB H 3.379 1.162 -9.966 1.00 . A A . 25 THR HB 1 1 28 17664 1 1 25 THR HG1 H 4.633 2.046 -12.346 1.00 . A A . 25 THR HG1 1 1 28 17665 1 1 25 THR HG21 H 5.453 2.981 -9.515 1.00 . A A . 25 THR HG21 1 1 28 17666 1 1 25 THR HG22 H 4.528 3.605 -10.880 1.00 . A A . 25 THR HG22 1 1 28 17667 1 1 25 THR HG23 H 3.718 3.247 -9.355 1.00 . A A . 25 THR HG23 1 1 28 17668 1 1 25 THR N N 5.699 0.469 -8.813 1.00 . A A . 25 THR N 1 1 28 17669 1 1 25 THR O O 7.601 1.600 -10.379 1.00 . A A . 25 THR O 1 1 28 17670 1 1 25 THR OG1 O 3.934 1.585 -11.876 1.00 . A A . 25 THR OG1 1 1 28 17671 1 1 26 SER C C 7.705 2.799 -13.495 1.00 . A A . 26 SER C 1 1 28 17672 1 1 26 SER CA C 7.808 1.321 -13.127 1.00 . A A . 26 SER CA 1 1 28 17673 1 1 26 SER CB C 7.885 0.470 -14.396 1.00 . A A . 26 SER CB 1 1 28 17674 1 1 26 SER H H 5.908 0.474 -12.735 1.00 . A A . 26 SER H 1 1 28 17675 1 1 26 SER HA H 8.708 1.170 -12.550 1.00 . A A . 26 SER HA 1 1 28 17676 1 1 26 SER HB2 H 8.758 0.753 -14.965 1.00 . A A . 26 SER HB2 1 1 28 17677 1 1 26 SER HB3 H 7.956 -0.573 -14.123 1.00 . A A . 26 SER HB3 1 1 28 17678 1 1 26 SER HG H 6.583 -0.137 -15.728 1.00 . A A . 26 SER HG 1 1 28 17679 1 1 26 SER N N 6.677 0.901 -12.306 1.00 . A A . 26 SER N 1 1 28 17680 1 1 26 SER O O 7.706 3.157 -14.673 1.00 . A A . 26 SER O 1 1 28 17681 1 1 26 SER OG O 6.736 0.653 -15.204 1.00 . A A . 26 SER OG 1 1 28 17682 1 1 27 VAL C C 7.382 5.846 -11.373 1.00 . A A . 27 VAL C 1 1 28 17683 1 1 27 VAL CA C 7.524 5.094 -12.694 1.00 . A A . 27 VAL CA 1 1 28 17684 1 1 27 VAL CB C 6.329 5.448 -13.604 1.00 . A A . 27 VAL CB 1 1 28 17685 1 1 27 VAL CG1 C 5.021 4.997 -12.971 1.00 . A A . 27 VAL CG1 1 1 28 17686 1 1 27 VAL CG2 C 6.301 6.942 -13.896 1.00 . A A . 27 VAL CG2 1 1 28 17687 1 1 27 VAL H H 7.632 3.305 -11.563 1.00 . A A . 27 VAL H 1 1 28 17688 1 1 27 VAL HA H 8.430 5.419 -13.185 1.00 . A A . 27 VAL HA 1 1 28 17689 1 1 27 VAL HB H 6.447 4.924 -14.540 1.00 . A A . 27 VAL HB 1 1 28 17690 1 1 27 VAL HG11 H 4.962 5.371 -11.960 1.00 . A A . 27 VAL HG11 1 1 28 17691 1 1 27 VAL HG12 H 4.192 5.382 -13.546 1.00 . A A . 27 VAL HG12 1 1 28 17692 1 1 27 VAL HG13 H 4.981 3.918 -12.959 1.00 . A A . 27 VAL HG13 1 1 28 17693 1 1 27 VAL HG21 H 7.311 7.306 -14.006 1.00 . A A . 27 VAL HG21 1 1 28 17694 1 1 27 VAL HG22 H 5.752 7.119 -14.810 1.00 . A A . 27 VAL HG22 1 1 28 17695 1 1 27 VAL HG23 H 5.818 7.459 -13.080 1.00 . A A . 27 VAL HG23 1 1 28 17696 1 1 27 VAL N N 7.623 3.653 -12.479 1.00 . A A . 27 VAL N 1 1 28 17697 1 1 27 VAL O O 7.854 6.975 -11.236 1.00 . A A . 27 VAL O 1 1 28 17698 1 1 28 SER C C 6.292 4.772 -8.022 1.00 . A A . 28 SER C 1 1 28 17699 1 1 28 SER CA C 6.505 5.830 -9.101 1.00 . A A . 28 SER CA 1 1 28 17700 1 1 28 SER CB C 5.291 6.759 -9.152 1.00 . A A . 28 SER CB 1 1 28 17701 1 1 28 SER H H 6.363 4.325 -10.580 1.00 . A A . 28 SER H 1 1 28 17702 1 1 28 SER HA H 7.382 6.410 -8.855 1.00 . A A . 28 SER HA 1 1 28 17703 1 1 28 SER HB2 H 5.279 7.281 -10.096 1.00 . A A . 28 SER HB2 1 1 28 17704 1 1 28 SER HB3 H 4.388 6.171 -9.054 1.00 . A A . 28 SER HB3 1 1 28 17705 1 1 28 SER HG H 6.060 8.319 -8.251 1.00 . A A . 28 SER HG 1 1 28 17706 1 1 28 SER N N 6.720 5.217 -10.407 1.00 . A A . 28 SER N 1 1 28 17707 1 1 28 SER O O 5.169 4.326 -7.797 1.00 . A A . 28 SER O 1 1 28 17708 1 1 28 SER OG O 5.331 7.711 -8.104 1.00 . A A . 28 SER OG 1 1 28 17709 1 1 29 SER C C 6.817 4.011 -4.989 1.00 . A A . 29 SER C 1 1 28 17710 1 1 29 SER CA C 7.288 3.377 -6.293 1.00 . A A . 29 SER CA 1 1 28 17711 1 1 29 SER CB C 8.646 2.704 -6.087 1.00 . A A . 29 SER CB 1 1 28 17712 1 1 29 SER H H 8.242 4.773 -7.571 1.00 . A A . 29 SER H 1 1 28 17713 1 1 29 SER HA H 6.566 2.633 -6.596 1.00 . A A . 29 SER HA 1 1 28 17714 1 1 29 SER HB2 H 8.606 2.078 -5.208 1.00 . A A . 29 SER HB2 1 1 28 17715 1 1 29 SER HB3 H 8.879 2.097 -6.951 1.00 . A A . 29 SER HB3 1 1 28 17716 1 1 29 SER HG H 10.022 3.919 -6.773 1.00 . A A . 29 SER HG 1 1 28 17717 1 1 29 SER N N 7.372 4.379 -7.352 1.00 . A A . 29 SER N 1 1 28 17718 1 1 29 SER O O 6.927 5.223 -4.805 1.00 . A A . 29 SER O 1 1 28 17719 1 1 29 SER OG O 9.672 3.666 -5.915 1.00 . A A . 29 SER OG 1 1 28 17720 1 1 30 HIS C C 5.956 2.660 -1.700 1.00 . A A . 30 HIS C 1 1 28 17721 1 1 30 HIS CA C 5.782 3.690 -2.812 1.00 . A A . 30 HIS CA 1 1 28 17722 1 1 30 HIS CB C 4.308 4.074 -2.939 1.00 . A A . 30 HIS CB 1 1 28 17723 1 1 30 HIS CD2 C 4.051 4.940 -5.365 1.00 . A A . 30 HIS CD2 1 1 28 17724 1 1 30 HIS CE1 C 3.573 7.031 -4.916 1.00 . A A . 30 HIS CE1 1 1 28 17725 1 1 30 HIS CG C 4.048 5.075 -4.020 1.00 . A A . 30 HIS CG 1 1 28 17726 1 1 30 HIS H H 6.208 2.233 -4.293 1.00 . A A . 30 HIS H 1 1 28 17727 1 1 30 HIS HA H 6.351 4.572 -2.559 1.00 . A A . 30 HIS HA 1 1 28 17728 1 1 30 HIS HB2 H 3.731 3.188 -3.163 1.00 . A A . 30 HIS HB2 1 1 28 17729 1 1 30 HIS HB3 H 3.969 4.494 -2.004 1.00 . A A . 30 HIS HB3 1 1 28 17730 1 1 30 HIS HD1 H 3.668 6.808 -2.884 1.00 . A A . 30 HIS HD1 1 1 28 17731 1 1 30 HIS HD2 H 4.250 4.031 -5.915 1.00 . A A . 30 HIS HD2 1 1 28 17732 1 1 30 HIS HE1 H 3.329 8.076 -5.030 1.00 . A A . 30 HIS HE1 1 1 28 17733 1 1 30 HIS HE2 H 3.591 6.352 -6.848 1.00 . A A . 30 HIS HE2 1 1 28 17734 1 1 30 HIS N N 6.279 3.191 -4.090 1.00 . A A . 30 HIS N 1 1 28 17735 1 1 30 HIS ND1 N 3.746 6.396 -3.770 1.00 . A A . 30 HIS ND1 1 1 28 17736 1 1 30 HIS NE2 N 3.754 6.169 -5.900 1.00 . A A . 30 HIS NE2 1 1 28 17737 1 1 30 HIS O O 6.325 1.514 -1.951 1.00 . A A . 30 HIS O 1 1 28 17738 1 1 31 TYR C C 4.495 2.204 1.489 1.00 . A A . 31 TYR C 1 1 28 17739 1 1 31 TYR CA C 5.797 2.214 0.694 1.00 . A A . 31 TYR CA 1 1 28 17740 1 1 31 TYR CB C 6.951 2.677 1.588 1.00 . A A . 31 TYR CB 1 1 28 17741 1 1 31 TYR CD1 C 8.651 1.358 0.268 1.00 . A A . 31 TYR CD1 1 1 28 17742 1 1 31 TYR CD2 C 8.872 1.422 2.640 1.00 . A A . 31 TYR CD2 1 1 28 17743 1 1 31 TYR CE1 C 9.774 0.558 0.180 1.00 . A A . 31 TYR CE1 1 1 28 17744 1 1 31 TYR CE2 C 9.997 0.623 2.561 1.00 . A A . 31 TYR CE2 1 1 28 17745 1 1 31 TYR CG C 8.181 1.802 1.496 1.00 . A A . 31 TYR CG 1 1 28 17746 1 1 31 TYR CZ C 10.444 0.194 1.330 1.00 . A A . 31 TYR CZ 1 1 28 17747 1 1 31 TYR H H 5.389 4.012 -0.342 1.00 . A A . 31 TYR H 1 1 28 17748 1 1 31 TYR HA H 6.001 1.215 0.344 1.00 . A A . 31 TYR HA 1 1 28 17749 1 1 31 TYR HB2 H 7.237 3.679 1.303 1.00 . A A . 31 TYR HB2 1 1 28 17750 1 1 31 TYR HB3 H 6.622 2.681 2.617 1.00 . A A . 31 TYR HB3 1 1 28 17751 1 1 31 TYR HD1 H 8.125 1.645 -0.631 1.00 . A A . 31 TYR HD1 1 1 28 17752 1 1 31 TYR HD2 H 8.519 1.759 3.603 1.00 . A A . 31 TYR HD2 1 1 28 17753 1 1 31 TYR HE1 H 10.124 0.222 -0.785 1.00 . A A . 31 TYR HE1 1 1 28 17754 1 1 31 TYR HE2 H 10.520 0.338 3.462 1.00 . A A . 31 TYR HE2 1 1 28 17755 1 1 31 TYR HH H 11.369 -1.373 0.709 1.00 . A A . 31 TYR HH 1 1 28 17756 1 1 31 TYR N N 5.680 3.085 -0.470 1.00 . A A . 31 TYR N 1 1 28 17757 1 1 31 TYR O O 3.919 3.258 1.761 1.00 . A A . 31 TYR O 1 1 28 17758 1 1 31 TYR OH O 11.563 -0.602 1.247 1.00 . A A . 31 TYR OH 1 1 28 17759 1 1 32 CYS C C 3.011 1.380 4.061 1.00 . A A . 32 CYS C 1 1 28 17760 1 1 32 CYS CA C 2.800 0.892 2.633 1.00 . A A . 32 CYS CA 1 1 28 17761 1 1 32 CYS CB C 2.308 -0.558 2.638 1.00 . A A . 32 CYS CB 1 1 28 17762 1 1 32 CYS H H 4.534 0.204 1.627 1.00 . A A . 32 CYS H 1 1 28 17763 1 1 32 CYS HA H 2.056 1.513 2.160 1.00 . A A . 32 CYS HA 1 1 28 17764 1 1 32 CYS HB2 H 2.764 -1.087 1.815 1.00 . A A . 32 CYS HB2 1 1 28 17765 1 1 32 CYS HB3 H 2.600 -1.026 3.567 1.00 . A A . 32 CYS HB3 1 1 28 17766 1 1 32 CYS N N 4.034 1.014 1.866 1.00 . A A . 32 CYS N 1 1 28 17767 1 1 32 CYS O O 4.079 1.189 4.639 1.00 . A A . 32 CYS O 1 1 28 17768 1 1 32 CYS SG S 0.500 -0.732 2.473 1.00 . A A . 32 CYS SG 1 1 28 17769 1 1 33 THR C C 1.354 1.593 6.959 1.00 . A A . 33 THR C 1 1 28 17770 1 1 33 THR CA C 2.067 2.525 5.984 1.00 . A A . 33 THR CA 1 1 28 17771 1 1 33 THR CB C 1.456 3.925 6.059 1.00 . A A . 33 THR CB 1 1 28 17772 1 1 33 THR CG2 C 2.101 4.911 5.110 1.00 . A A . 33 THR CG2 1 1 28 17773 1 1 33 THR H H 1.162 2.133 4.113 1.00 . A A . 33 THR H 1 1 28 17774 1 1 33 THR HA H 3.110 2.582 6.257 1.00 . A A . 33 THR HA 1 1 28 17775 1 1 33 THR HB H 1.576 4.305 7.063 1.00 . A A . 33 THR HB 1 1 28 17776 1 1 33 THR HG1 H -0.321 4.741 5.943 1.00 . A A . 33 THR HG1 1 1 28 17777 1 1 33 THR HG21 H 3.173 4.887 5.240 1.00 . A A . 33 THR HG21 1 1 28 17778 1 1 33 THR HG22 H 1.856 4.645 4.093 1.00 . A A . 33 THR HG22 1 1 28 17779 1 1 33 THR HG23 H 1.736 5.905 5.321 1.00 . A A . 33 THR HG23 1 1 28 17780 1 1 33 THR N N 1.988 2.011 4.623 1.00 . A A . 33 THR N 1 1 28 17781 1 1 33 THR O O 0.978 2.001 8.058 1.00 . A A . 33 THR O 1 1 28 17782 1 1 33 THR OG1 O 0.072 3.884 5.761 1.00 . A A . 33 THR OG1 1 1 28 17783 1 1 34 GLY C C -0.781 -0.094 8.012 1.00 . A A . 34 GLY C 1 1 28 17784 1 1 34 GLY CA C 0.502 -0.631 7.401 1.00 . A A . 34 GLY CA 1 1 28 17785 1 1 34 GLY H H 1.494 0.069 5.661 1.00 . A A . 34 GLY H 1 1 28 17786 1 1 34 GLY HA2 H 1.173 -0.916 8.198 1.00 . A A . 34 GLY HA2 1 1 28 17787 1 1 34 GLY HA3 H 0.266 -1.505 6.814 1.00 . A A . 34 GLY HA3 1 1 28 17788 1 1 34 GLY N N 1.171 0.339 6.550 1.00 . A A . 34 GLY N 1 1 28 17789 1 1 34 GLY O O -1.191 -0.527 9.089 1.00 . A A . 34 GLY O 1 1 28 17790 1 1 35 ARG C C -3.715 1.453 6.714 1.00 . A A . 35 ARG C 1 1 28 17791 1 1 35 ARG CA C -2.655 1.448 7.807 1.00 . A A . 35 ARG CA 1 1 28 17792 1 1 35 ARG CB C -2.404 2.874 8.298 1.00 . A A . 35 ARG CB 1 1 28 17793 1 1 35 ARG CD C -3.083 2.543 10.695 1.00 . A A . 35 ARG CD 1 1 28 17794 1 1 35 ARG CG C -1.962 2.948 9.751 1.00 . A A . 35 ARG CG 1 1 28 17795 1 1 35 ARG CZ C -3.428 4.561 12.067 1.00 . A A . 35 ARG CZ 1 1 28 17796 1 1 35 ARG H H -1.037 1.156 6.472 1.00 . A A . 35 ARG H 1 1 28 17797 1 1 35 ARG HA H -3.010 0.851 8.629 1.00 . A A . 35 ARG HA 1 1 28 17798 1 1 35 ARG HB2 H -1.634 3.323 7.687 1.00 . A A . 35 ARG HB2 1 1 28 17799 1 1 35 ARG HB3 H -3.314 3.445 8.192 1.00 . A A . 35 ARG HB3 1 1 28 17800 1 1 35 ARG HD2 H -4.030 2.727 10.209 1.00 . A A . 35 ARG HD2 1 1 28 17801 1 1 35 ARG HD3 H -2.990 1.490 10.913 1.00 . A A . 35 ARG HD3 1 1 28 17802 1 1 35 ARG HE H -2.707 2.827 12.743 1.00 . A A . 35 ARG HE 1 1 28 17803 1 1 35 ARG HG2 H -1.125 2.283 9.897 1.00 . A A . 35 ARG HG2 1 1 28 17804 1 1 35 ARG HG3 H -1.663 3.962 9.975 1.00 . A A . 35 ARG HG3 1 1 28 17805 1 1 35 ARG HH11 H -3.942 4.772 10.122 1.00 . A A . 35 ARG HH11 1 1 28 17806 1 1 35 ARG HH12 H -4.175 6.176 11.108 1.00 . A A . 35 ARG HH12 1 1 28 17807 1 1 35 ARG HH21 H -3.013 4.673 14.042 1.00 . A A . 35 ARG HH21 1 1 28 17808 1 1 35 ARG HH22 H -3.647 6.121 13.333 1.00 . A A . 35 ARG HH22 1 1 28 17809 1 1 35 ARG N N -1.414 0.852 7.324 1.00 . A A . 35 ARG N 1 1 28 17810 1 1 35 ARG NE N -3.041 3.293 11.948 1.00 . A A . 35 ARG NE 1 1 28 17811 1 1 35 ARG NH1 N -3.886 5.224 11.012 1.00 . A A . 35 ARG NH1 1 1 28 17812 1 1 35 ARG NH2 N -3.357 5.168 13.244 1.00 . A A . 35 ARG NH2 1 1 28 17813 1 1 35 ARG O O -4.825 0.955 6.904 1.00 . A A . 35 ARG O 1 1 28 17814 1 1 36 SER C C -3.993 0.963 3.446 1.00 . A A . 36 SER C 1 1 28 17815 1 1 36 SER CA C -4.277 2.088 4.434 1.00 . A A . 36 SER CA 1 1 28 17816 1 1 36 SER CB C -4.154 3.443 3.734 1.00 . A A . 36 SER CB 1 1 28 17817 1 1 36 SER H H -2.462 2.392 5.481 1.00 . A A . 36 SER H 1 1 28 17818 1 1 36 SER HA H -5.283 1.976 4.811 1.00 . A A . 36 SER HA 1 1 28 17819 1 1 36 SER HB2 H -3.114 3.642 3.521 1.00 . A A . 36 SER HB2 1 1 28 17820 1 1 36 SER HB3 H -4.713 3.421 2.810 1.00 . A A . 36 SER HB3 1 1 28 17821 1 1 36 SER HG H -4.150 4.535 5.361 1.00 . A A . 36 SER HG 1 1 28 17822 1 1 36 SER N N -3.363 2.017 5.567 1.00 . A A . 36 SER N 1 1 28 17823 1 1 36 SER O O -2.882 0.436 3.396 1.00 . A A . 36 SER O 1 1 28 17824 1 1 36 SER OG O -4.660 4.486 4.549 1.00 . A A . 36 SER OG 1 1 28 17825 1 1 37 CYS C C -4.511 0.100 0.300 1.00 . A A . 37 CYS C 1 1 28 17826 1 1 37 CYS CA C -4.845 -0.467 1.677 1.00 . A A . 37 CYS CA 1 1 28 17827 1 1 37 CYS CB C -6.118 -1.307 1.600 1.00 . A A . 37 CYS CB 1 1 28 17828 1 1 37 CYS H H -5.864 1.052 2.740 1.00 . A A . 37 CYS H 1 1 28 17829 1 1 37 CYS HA H -4.030 -1.097 1.999 1.00 . A A . 37 CYS HA 1 1 28 17830 1 1 37 CYS HB2 H -6.957 -0.707 1.922 1.00 . A A . 37 CYS HB2 1 1 28 17831 1 1 37 CYS HB3 H -6.274 -1.614 0.577 1.00 . A A . 37 CYS HB3 1 1 28 17832 1 1 37 CYS N N -5.000 0.597 2.660 1.00 . A A . 37 CYS N 1 1 28 17833 1 1 37 CYS O O -4.558 -0.613 -0.703 1.00 . A A . 37 CYS O 1 1 28 17834 1 1 37 CYS SG S -6.084 -2.808 2.632 1.00 . A A . 37 CYS SG 1 1 28 17835 1 1 38 GLU C C -2.541 2.859 -0.846 1.00 . A A . 38 GLU C 1 1 28 17836 1 1 38 GLU CA C -3.819 2.040 -0.998 1.00 . A A . 38 GLU CA 1 1 28 17837 1 1 38 GLU CB C -4.965 2.942 -1.462 1.00 . A A . 38 GLU CB 1 1 28 17838 1 1 38 GLU CD C -6.861 4.415 -0.678 1.00 . A A . 38 GLU CD 1 1 28 17839 1 1 38 GLU CG C -5.471 3.886 -0.383 1.00 . A A . 38 GLU CG 1 1 28 17840 1 1 38 GLU H H -4.144 1.902 1.089 1.00 . A A . 38 GLU H 1 1 28 17841 1 1 38 GLU HA H -3.655 1.272 -1.739 1.00 . A A . 38 GLU HA 1 1 28 17842 1 1 38 GLU HB2 H -4.625 3.535 -2.298 1.00 . A A . 38 GLU HB2 1 1 28 17843 1 1 38 GLU HB3 H -5.788 2.322 -1.783 1.00 . A A . 38 GLU HB3 1 1 28 17844 1 1 38 GLU HG2 H -5.497 3.356 0.557 1.00 . A A . 38 GLU HG2 1 1 28 17845 1 1 38 GLU HG3 H -4.791 4.722 -0.307 1.00 . A A . 38 GLU HG3 1 1 28 17846 1 1 38 GLU N N -4.167 1.384 0.257 1.00 . A A . 38 GLU N 1 1 28 17847 1 1 38 GLU O O -2.515 3.857 -0.126 1.00 . A A . 38 GLU O 1 1 28 17848 1 1 38 GLU OE1 O -7.584 3.777 -1.472 1.00 . A A . 38 GLU OE1 1 1 28 17849 1 1 38 GLU OE2 O -7.226 5.469 -0.115 1.00 . A A . 38 GLU OE2 1 1 28 17850 1 1 39 CYS C C -0.374 4.633 -1.623 1.00 . A A . 39 CYS C 1 1 28 17851 1 1 39 CYS CA C -0.194 3.121 -1.472 1.00 . A A . 39 CYS CA 1 1 28 17852 1 1 39 CYS CB C 0.742 2.593 -2.563 1.00 . A A . 39 CYS CB 1 1 28 17853 1 1 39 CYS H H -1.563 1.627 -2.084 1.00 . A A . 39 CYS H 1 1 28 17854 1 1 39 CYS HA H 0.245 2.918 -0.507 1.00 . A A . 39 CYS HA 1 1 28 17855 1 1 39 CYS HB2 H 0.150 2.221 -3.388 1.00 . A A . 39 CYS HB2 1 1 28 17856 1 1 39 CYS HB3 H 1.368 3.401 -2.914 1.00 . A A . 39 CYS HB3 1 1 28 17857 1 1 39 CYS N N -1.480 2.430 -1.529 1.00 . A A . 39 CYS N 1 1 28 17858 1 1 39 CYS O O -1.218 5.091 -2.393 1.00 . A A . 39 CYS O 1 1 28 17859 1 1 39 CYS SG S 1.836 1.240 -2.012 1.00 . A A . 39 CYS SG 1 1 28 17860 1 1 40 PRO C C 0.667 7.447 -2.318 1.00 . A A . 40 PRO C 1 1 28 17861 1 1 40 PRO CA C 0.335 6.895 -0.936 1.00 . A A . 40 PRO CA 1 1 28 17862 1 1 40 PRO CB C 1.379 7.358 0.089 1.00 . A A . 40 PRO CB 1 1 28 17863 1 1 40 PRO CD C 1.448 4.972 0.064 1.00 . A A . 40 PRO CD 1 1 28 17864 1 1 40 PRO CG C 2.295 6.196 0.261 1.00 . A A . 40 PRO CG 1 1 28 17865 1 1 40 PRO HA H -0.642 7.245 -0.639 1.00 . A A . 40 PRO HA 1 1 28 17866 1 1 40 PRO HB2 H 1.903 8.221 -0.294 1.00 . A A . 40 PRO HB2 1 1 28 17867 1 1 40 PRO HB3 H 0.887 7.612 1.016 1.00 . A A . 40 PRO HB3 1 1 28 17868 1 1 40 PRO HD2 H 2.034 4.170 -0.361 1.00 . A A . 40 PRO HD2 1 1 28 17869 1 1 40 PRO HD3 H 1.004 4.664 0.999 1.00 . A A . 40 PRO HD3 1 1 28 17870 1 1 40 PRO HG2 H 3.080 6.233 -0.480 1.00 . A A . 40 PRO HG2 1 1 28 17871 1 1 40 PRO HG3 H 2.716 6.204 1.256 1.00 . A A . 40 PRO HG3 1 1 28 17872 1 1 40 PRO N N 0.417 5.431 -0.883 1.00 . A A . 40 PRO N 1 1 28 17873 1 1 40 PRO O O 0.996 6.696 -3.236 1.00 . A A . 40 PRO O 1 1 28 17874 1 1 41 SER C C 2.301 9.940 -3.763 1.00 . A A . 41 SER C 1 1 28 17875 1 1 41 SER CA C 0.865 9.423 -3.728 1.00 . A A . 41 SER CA 1 1 28 17876 1 1 41 SER CB C -0.111 10.577 -3.962 1.00 . A A . 41 SER CB 1 1 28 17877 1 1 41 SER H H 0.307 9.310 -1.689 1.00 . A A . 41 SER H 1 1 28 17878 1 1 41 SER HA H 0.739 8.693 -4.513 1.00 . A A . 41 SER HA 1 1 28 17879 1 1 41 SER HB2 H -0.130 10.822 -5.013 1.00 . A A . 41 SER HB2 1 1 28 17880 1 1 41 SER HB3 H -1.099 10.281 -3.643 1.00 . A A . 41 SER HB3 1 1 28 17881 1 1 41 SER HG H 0.029 11.625 -2.312 1.00 . A A . 41 SER HG 1 1 28 17882 1 1 41 SER N N 0.576 8.766 -2.458 1.00 . A A . 41 SER N 1 1 28 17883 1 1 41 SER O O 2.610 10.889 -4.484 1.00 . A A . 41 SER O 1 1 28 17884 1 1 41 SER OG O 0.278 11.729 -3.233 1.00 . A A . 41 SER OG 1 1 28 17885 1 1 42 TYR C C 5.458 8.518 -2.545 1.00 . A A . 42 TYR C 1 1 28 17886 1 1 42 TYR CA C 4.576 9.705 -2.931 1.00 . A A . 42 TYR CA 1 1 28 17887 1 1 42 TYR CB C 4.770 10.851 -1.934 1.00 . A A . 42 TYR CB 1 1 28 17888 1 1 42 TYR CD1 C 5.617 9.871 0.233 1.00 . A A . 42 TYR CD1 1 1 28 17889 1 1 42 TYR CD2 C 3.358 10.629 0.148 1.00 . A A . 42 TYR CD2 1 1 28 17890 1 1 42 TYR CE1 C 5.446 9.496 1.552 1.00 . A A . 42 TYR CE1 1 1 28 17891 1 1 42 TYR CE2 C 3.180 10.257 1.467 1.00 . A A . 42 TYR CE2 1 1 28 17892 1 1 42 TYR CG C 4.578 10.443 -0.490 1.00 . A A . 42 TYR CG 1 1 28 17893 1 1 42 TYR CZ C 4.226 9.691 2.164 1.00 . A A . 42 TYR CZ 1 1 28 17894 1 1 42 TYR H H 2.870 8.559 -2.434 1.00 . A A . 42 TYR H 1 1 28 17895 1 1 42 TYR HA H 4.860 10.044 -3.916 1.00 . A A . 42 TYR HA 1 1 28 17896 1 1 42 TYR HB2 H 5.771 11.242 -2.037 1.00 . A A . 42 TYR HB2 1 1 28 17897 1 1 42 TYR HB3 H 4.059 11.634 -2.156 1.00 . A A . 42 TYR HB3 1 1 28 17898 1 1 42 TYR HD1 H 6.571 9.719 -0.250 1.00 . A A . 42 TYR HD1 1 1 28 17899 1 1 42 TYR HD2 H 2.540 11.072 -0.400 1.00 . A A . 42 TYR HD2 1 1 28 17900 1 1 42 TYR HE1 H 6.266 9.053 2.097 1.00 . A A . 42 TYR HE1 1 1 28 17901 1 1 42 TYR HE2 H 2.224 10.410 1.947 1.00 . A A . 42 TYR HE2 1 1 28 17902 1 1 42 TYR HH H 3.342 8.676 3.537 1.00 . A A . 42 TYR HH 1 1 28 17903 1 1 42 TYR N N 3.174 9.309 -2.984 1.00 . A A . 42 TYR N 1 1 28 17904 1 1 42 TYR O O 5.057 7.672 -1.746 1.00 . A A . 42 TYR O 1 1 28 17905 1 1 42 TYR OH O 4.053 9.319 3.477 1.00 . A A . 42 TYR OH 1 1 28 17906 1 1 43 PRO C C 8.236 7.473 -1.436 1.00 . A A . 43 PRO C 1 1 28 17907 1 1 43 PRO CA C 7.608 7.347 -2.820 1.00 . A A . 43 PRO CA 1 1 28 17908 1 1 43 PRO CB C 8.672 7.498 -3.907 1.00 . A A . 43 PRO CB 1 1 28 17909 1 1 43 PRO CD C 7.237 9.403 -4.076 1.00 . A A . 43 PRO CD 1 1 28 17910 1 1 43 PRO CG C 8.663 8.950 -4.237 1.00 . A A . 43 PRO CG 1 1 28 17911 1 1 43 PRO HA H 7.130 6.383 -2.911 1.00 . A A . 43 PRO HA 1 1 28 17912 1 1 43 PRO HB2 H 9.632 7.184 -3.522 1.00 . A A . 43 PRO HB2 1 1 28 17913 1 1 43 PRO HB3 H 8.405 6.898 -4.763 1.00 . A A . 43 PRO HB3 1 1 28 17914 1 1 43 PRO HD2 H 7.202 10.408 -3.681 1.00 . A A . 43 PRO HD2 1 1 28 17915 1 1 43 PRO HD3 H 6.715 9.350 -5.021 1.00 . A A . 43 PRO HD3 1 1 28 17916 1 1 43 PRO HG2 H 9.305 9.486 -3.553 1.00 . A A . 43 PRO HG2 1 1 28 17917 1 1 43 PRO HG3 H 8.990 9.098 -5.255 1.00 . A A . 43 PRO HG3 1 1 28 17918 1 1 43 PRO N N 6.675 8.439 -3.110 1.00 . A A . 43 PRO N 1 1 28 17919 1 1 43 PRO O O 8.390 8.576 -0.911 1.00 . A A . 43 PRO O 1 1 28 17920 1 1 44 GLY C C 10.484 7.146 0.516 1.00 . A A . 44 GLY C 1 1 28 17921 1 1 44 GLY CA C 9.201 6.340 0.469 1.00 . A A . 44 GLY CA 1 1 28 17922 1 1 44 GLY H H 8.447 5.487 -1.315 1.00 . A A . 44 GLY H 1 1 28 17923 1 1 44 GLY HA2 H 9.418 5.322 0.757 1.00 . A A . 44 GLY HA2 1 1 28 17924 1 1 44 GLY HA3 H 8.499 6.761 1.175 1.00 . A A . 44 GLY HA3 1 1 28 17925 1 1 44 GLY N N 8.595 6.336 -0.849 1.00 . A A . 44 GLY N 1 1 28 17926 1 1 44 GLY O O 11.003 7.562 -0.520 1.00 . A A . 44 GLY O 1 1 28 17927 1 1 45 ASN C C 12.658 8.129 3.365 1.00 . A A . 45 ASN C 1 1 28 17928 1 1 45 ASN CA C 12.227 8.129 1.901 1.00 . A A . 45 ASN CA 1 1 28 17929 1 1 45 ASN CB C 12.038 9.567 1.413 1.00 . A A . 45 ASN CB 1 1 28 17930 1 1 45 ASN CG C 13.335 10.351 1.406 1.00 . A A . 45 ASN CG 1 1 28 17931 1 1 45 ASN H H 10.537 7.010 2.510 1.00 . A A . 45 ASN H 1 1 28 17932 1 1 45 ASN HA H 12.998 7.657 1.311 1.00 . A A . 45 ASN HA 1 1 28 17933 1 1 45 ASN HB2 H 11.644 9.550 0.408 1.00 . A A . 45 ASN HB2 1 1 28 17934 1 1 45 ASN HB3 H 11.337 10.071 2.062 1.00 . A A . 45 ASN HB3 1 1 28 17935 1 1 45 ASN HD21 H 13.536 10.049 -0.549 1.00 . A A . 45 ASN HD21 1 1 28 17936 1 1 45 ASN HD22 H 14.790 10.970 0.201 1.00 . A A . 45 ASN HD22 1 1 28 17937 1 1 45 ASN N N 10.997 7.368 1.722 1.00 . A A . 45 ASN N 1 1 28 17938 1 1 45 ASN ND2 N 13.949 10.469 0.234 1.00 . A A . 45 ASN ND2 1 1 28 17939 1 1 45 ASN O O 13.820 7.871 3.680 1.00 . A A . 45 ASN O 1 1 28 17940 1 1 45 ASN OD1 O 13.781 10.845 2.442 1.00 . A A . 45 ASN OD1 1 1 28 17941 1 1 46 GLY C C 10.767 8.433 6.532 1.00 . A A . 46 GLY C 1 1 28 17942 1 1 46 GLY CA C 12.016 8.449 5.673 1.00 . A A . 46 GLY CA 1 1 28 17943 1 1 46 GLY H H 10.806 8.618 3.944 1.00 . A A . 46 GLY H 1 1 28 17944 1 1 46 GLY HA2 H 12.580 9.344 5.892 1.00 . A A . 46 GLY HA2 1 1 28 17945 1 1 46 GLY HA3 H 12.619 7.587 5.919 1.00 . A A . 46 GLY HA3 1 1 28 17946 1 1 46 GLY N N 11.715 8.421 4.254 1.00 . A A . 46 GLY N 1 1 28 17947 1 1 46 GLY O O 10.674 9.265 7.459 1.00 . A A . 46 GLY O 1 1 28 17948 1 1 46 GLY OXT O 9.882 7.590 6.277 1.00 . A A . 46 GLY OXT 1 1 29 17949 1 1 1 ALA C C -13.650 -4.799 9.844 1.00 . A A . 1 ALA C 1 1 29 17950 1 1 1 ALA CA C -12.596 -3.730 10.110 1.00 . A A . 1 ALA CA 1 1 29 17951 1 1 1 ALA CB C -13.163 -2.643 11.010 1.00 . A A . 1 ALA CB 1 1 29 17952 1 1 1 ALA H1 H -11.994 -3.915 8.151 1.00 . A A . 1 ALA H1 1 1 29 17953 1 1 1 ALA H2 H -12.807 -2.448 8.515 1.00 . A A . 1 ALA H2 1 1 29 17954 1 1 1 ALA H3 H -11.191 -2.681 9.034 1.00 . A A . 1 ALA H3 1 1 29 17955 1 1 1 ALA HA H -11.759 -4.185 10.620 1.00 . A A . 1 ALA HA 1 1 29 17956 1 1 1 ALA HB1 H -12.366 -1.986 11.326 1.00 . A A . 1 ALA HB1 1 1 29 17957 1 1 1 ALA HB2 H -13.903 -2.075 10.466 1.00 . A A . 1 ALA HB2 1 1 29 17958 1 1 1 ALA HB3 H -13.621 -3.095 11.876 1.00 . A A . 1 ALA HB3 1 1 29 17959 1 1 1 ALA N N -12.102 -3.140 8.838 1.00 . A A . 1 ALA N 1 1 29 17960 1 1 1 ALA O O -13.765 -5.771 10.591 1.00 . A A . 1 ALA O 1 1 29 17961 1 1 2 MET C C -15.400 -5.899 6.926 1.00 . A A . 2 MET C 1 1 29 17962 1 1 2 MET CA C -15.464 -5.562 8.412 1.00 . A A . 2 MET CA 1 1 29 17963 1 1 2 MET CB C -16.842 -4.992 8.758 1.00 . A A . 2 MET CB 1 1 29 17964 1 1 2 MET CE C -19.115 -1.926 7.151 1.00 . A A . 2 MET CE 1 1 29 17965 1 1 2 MET CG C -17.180 -3.717 8.003 1.00 . A A . 2 MET CG 1 1 29 17966 1 1 2 MET H H -14.279 -3.818 8.219 1.00 . A A . 2 MET H 1 1 29 17967 1 1 2 MET HA H -15.305 -6.465 8.981 1.00 . A A . 2 MET HA 1 1 29 17968 1 1 2 MET HB2 H -17.593 -5.733 8.526 1.00 . A A . 2 MET HB2 1 1 29 17969 1 1 2 MET HB3 H -16.874 -4.778 9.816 1.00 . A A . 2 MET HB3 1 1 29 17970 1 1 2 MET HE1 H -18.665 -2.335 6.259 1.00 . A A . 2 MET HE1 1 1 29 17971 1 1 2 MET HE2 H -20.186 -1.875 7.023 1.00 . A A . 2 MET HE2 1 1 29 17972 1 1 2 MET HE3 H -18.726 -0.934 7.329 1.00 . A A . 2 MET HE3 1 1 29 17973 1 1 2 MET HG2 H -16.384 -3.003 8.154 1.00 . A A . 2 MET HG2 1 1 29 17974 1 1 2 MET HG3 H -17.258 -3.949 6.950 1.00 . A A . 2 MET HG3 1 1 29 17975 1 1 2 MET N N -14.419 -4.613 8.776 1.00 . A A . 2 MET N 1 1 29 17976 1 1 2 MET O O -15.465 -7.067 6.541 1.00 . A A . 2 MET O 1 1 29 17977 1 1 2 MET SD S -18.731 -2.977 8.549 1.00 . A A . 2 MET SD 1 1 29 17978 1 1 3 ASP C C -13.763 -4.901 4.155 1.00 . A A . 3 ASP C 1 1 29 17979 1 1 3 ASP CA C -15.197 -5.057 4.651 1.00 . A A . 3 ASP CA 1 1 29 17980 1 1 3 ASP CB C -16.108 -4.056 3.939 1.00 . A A . 3 ASP CB 1 1 29 17981 1 1 3 ASP CG C -17.507 -4.598 3.722 1.00 . A A . 3 ASP CG 1 1 29 17982 1 1 3 ASP H H -15.225 -3.962 6.463 1.00 . A A . 3 ASP H 1 1 29 17983 1 1 3 ASP HA H -15.535 -6.058 4.430 1.00 . A A . 3 ASP HA 1 1 29 17984 1 1 3 ASP HB2 H -16.179 -3.157 4.533 1.00 . A A . 3 ASP HB2 1 1 29 17985 1 1 3 ASP HB3 H -15.682 -3.813 2.976 1.00 . A A . 3 ASP HB3 1 1 29 17986 1 1 3 ASP N N -15.271 -4.870 6.096 1.00 . A A . 3 ASP N 1 1 29 17987 1 1 3 ASP O O -12.882 -4.470 4.899 1.00 . A A . 3 ASP O 1 1 29 17988 1 1 3 ASP OD1 O -17.699 -5.378 2.766 1.00 . A A . 3 ASP OD1 1 1 29 17989 1 1 3 ASP OD2 O -18.409 -4.243 4.509 1.00 . A A . 3 ASP OD2 1 1 29 17990 1 1 4 CYS C C -12.128 -3.971 1.342 1.00 . A A . 4 CYS C 1 1 29 17991 1 1 4 CYS CA C -12.210 -5.154 2.298 1.00 . A A . 4 CYS CA 1 1 29 17992 1 1 4 CYS CB C -11.860 -6.441 1.554 1.00 . A A . 4 CYS CB 1 1 29 17993 1 1 4 CYS H H -14.281 -5.591 2.351 1.00 . A A . 4 CYS H 1 1 29 17994 1 1 4 CYS HA H -11.497 -5.007 3.095 1.00 . A A . 4 CYS HA 1 1 29 17995 1 1 4 CYS HB2 H -12.615 -6.633 0.807 1.00 . A A . 4 CYS HB2 1 1 29 17996 1 1 4 CYS HB3 H -10.904 -6.314 1.069 1.00 . A A . 4 CYS HB3 1 1 29 17997 1 1 4 CYS N N -13.537 -5.255 2.894 1.00 . A A . 4 CYS N 1 1 29 17998 1 1 4 CYS O O -13.009 -3.770 0.505 1.00 . A A . 4 CYS O 1 1 29 17999 1 1 4 CYS SG S -11.752 -7.913 2.624 1.00 . A A . 4 CYS SG 1 1 29 18000 1 1 5 THR C C -10.184 -2.449 -0.694 1.00 . A A . 5 THR C 1 1 29 18001 1 1 5 THR CA C -10.848 -2.033 0.616 1.00 . A A . 5 THR CA 1 1 29 18002 1 1 5 THR CB C -9.982 -1.005 1.343 1.00 . A A . 5 THR CB 1 1 29 18003 1 1 5 THR CG2 C -9.852 0.308 0.602 1.00 . A A . 5 THR CG2 1 1 29 18004 1 1 5 THR H H -10.391 -3.412 2.152 1.00 . A A . 5 THR H 1 1 29 18005 1 1 5 THR HA H -11.810 -1.595 0.399 1.00 . A A . 5 THR HA 1 1 29 18006 1 1 5 THR HB H -8.992 -1.416 1.469 1.00 . A A . 5 THR HB 1 1 29 18007 1 1 5 THR HG1 H -11.353 -0.269 2.532 1.00 . A A . 5 THR HG1 1 1 29 18008 1 1 5 THR HG21 H -10.825 0.624 0.257 1.00 . A A . 5 THR HG21 1 1 29 18009 1 1 5 THR HG22 H -9.445 1.056 1.265 1.00 . A A . 5 THR HG22 1 1 29 18010 1 1 5 THR HG23 H -9.194 0.180 -0.244 1.00 . A A . 5 THR HG23 1 1 29 18011 1 1 5 THR N N -11.059 -3.195 1.469 1.00 . A A . 5 THR N 1 1 29 18012 1 1 5 THR O O -9.700 -3.574 -0.821 1.00 . A A . 5 THR O 1 1 29 18013 1 1 5 THR OG1 O -10.513 -0.723 2.626 1.00 . A A . 5 THR OG1 1 1 29 18014 1 1 6 THR C C -8.571 -0.743 -3.361 1.00 . A A . 6 THR C 1 1 29 18015 1 1 6 THR CA C -9.559 -1.835 -2.962 1.00 . A A . 6 THR CA 1 1 29 18016 1 1 6 THR CB C -10.639 -1.983 -4.034 1.00 . A A . 6 THR CB 1 1 29 18017 1 1 6 THR CG2 C -11.083 -3.415 -4.238 1.00 . A A . 6 THR CG2 1 1 29 18018 1 1 6 THR H H -10.570 -0.666 -1.514 1.00 . A A . 6 THR H 1 1 29 18019 1 1 6 THR HA H -9.025 -2.769 -2.873 1.00 . A A . 6 THR HA 1 1 29 18020 1 1 6 THR HB H -10.252 -1.619 -4.974 1.00 . A A . 6 THR HB 1 1 29 18021 1 1 6 THR HG1 H -12.410 -1.245 -4.428 1.00 . A A . 6 THR HG1 1 1 29 18022 1 1 6 THR HG21 H -10.497 -4.067 -3.606 1.00 . A A . 6 THR HG21 1 1 29 18023 1 1 6 THR HG22 H -12.128 -3.509 -3.981 1.00 . A A . 6 THR HG22 1 1 29 18024 1 1 6 THR HG23 H -10.941 -3.692 -5.272 1.00 . A A . 6 THR HG23 1 1 29 18025 1 1 6 THR N N -10.166 -1.545 -1.667 1.00 . A A . 6 THR N 1 1 29 18026 1 1 6 THR O O -8.936 0.425 -3.488 1.00 . A A . 6 THR O 1 1 29 18027 1 1 6 THR OG1 O -11.786 -1.221 -3.699 1.00 . A A . 6 THR OG1 1 1 29 18028 1 1 7 GLY C C -4.930 -0.838 -4.116 1.00 . A A . 7 GLY C 1 1 29 18029 1 1 7 GLY CA C -6.289 -0.184 -3.941 1.00 . A A . 7 GLY CA 1 1 29 18030 1 1 7 GLY H H -7.084 -2.081 -3.441 1.00 . A A . 7 GLY H 1 1 29 18031 1 1 7 GLY HA2 H -6.216 0.577 -3.179 1.00 . A A . 7 GLY HA2 1 1 29 18032 1 1 7 GLY HA3 H -6.575 0.281 -4.873 1.00 . A A . 7 GLY HA3 1 1 29 18033 1 1 7 GLY N N -7.316 -1.136 -3.558 1.00 . A A . 7 GLY N 1 1 29 18034 1 1 7 GLY O O -4.739 -1.988 -3.720 1.00 . A A . 7 GLY O 1 1 29 18035 1 1 8 PRO C C -1.935 -1.102 -3.638 1.00 . A A . 8 PRO C 1 1 29 18036 1 1 8 PRO CA C -2.611 -0.659 -4.935 1.00 . A A . 8 PRO CA 1 1 29 18037 1 1 8 PRO CB C -1.847 0.512 -5.572 1.00 . A A . 8 PRO CB 1 1 29 18038 1 1 8 PRO CD C -4.097 1.248 -5.219 1.00 . A A . 8 PRO CD 1 1 29 18039 1 1 8 PRO CG C -2.676 1.723 -5.302 1.00 . A A . 8 PRO CG 1 1 29 18040 1 1 8 PRO HA H -2.630 -1.492 -5.624 1.00 . A A . 8 PRO HA 1 1 29 18041 1 1 8 PRO HB2 H -0.871 0.595 -5.119 1.00 . A A . 8 PRO HB2 1 1 29 18042 1 1 8 PRO HB3 H -1.741 0.339 -6.633 1.00 . A A . 8 PRO HB3 1 1 29 18043 1 1 8 PRO HD2 H -4.661 1.859 -4.529 1.00 . A A . 8 PRO HD2 1 1 29 18044 1 1 8 PRO HD3 H -4.557 1.254 -6.196 1.00 . A A . 8 PRO HD3 1 1 29 18045 1 1 8 PRO HG2 H -2.375 2.172 -4.368 1.00 . A A . 8 PRO HG2 1 1 29 18046 1 1 8 PRO HG3 H -2.565 2.430 -6.111 1.00 . A A . 8 PRO HG3 1 1 29 18047 1 1 8 PRO N N -3.959 -0.126 -4.712 1.00 . A A . 8 PRO N 1 1 29 18048 1 1 8 PRO O O -1.042 -1.950 -3.654 1.00 . A A . 8 PRO O 1 1 29 18049 1 1 9 CYS C C -2.396 -2.185 -0.697 1.00 . A A . 9 CYS C 1 1 29 18050 1 1 9 CYS CA C -1.801 -0.878 -1.215 1.00 . A A . 9 CYS CA 1 1 29 18051 1 1 9 CYS CB C -2.047 0.248 -0.207 1.00 . A A . 9 CYS CB 1 1 29 18052 1 1 9 CYS H H -3.084 0.136 -2.564 1.00 . A A . 9 CYS H 1 1 29 18053 1 1 9 CYS HA H -0.738 -1.008 -1.341 1.00 . A A . 9 CYS HA 1 1 29 18054 1 1 9 CYS HB2 H -2.537 1.068 -0.709 1.00 . A A . 9 CYS HB2 1 1 29 18055 1 1 9 CYS HB3 H -2.688 -0.117 0.583 1.00 . A A . 9 CYS HB3 1 1 29 18056 1 1 9 CYS N N -2.367 -0.531 -2.517 1.00 . A A . 9 CYS N 1 1 29 18057 1 1 9 CYS O O -1.761 -2.905 0.074 1.00 . A A . 9 CYS O 1 1 29 18058 1 1 9 CYS SG S -0.532 0.904 0.566 1.00 . A A . 9 CYS SG 1 1 29 18059 1 1 10 CYS C C -3.578 -4.939 -1.236 1.00 . A A . 10 CYS C 1 1 29 18060 1 1 10 CYS CA C -4.299 -3.703 -0.708 1.00 . A A . 10 CYS CA 1 1 29 18061 1 1 10 CYS CB C -5.747 -3.694 -1.204 1.00 . A A . 10 CYS CB 1 1 29 18062 1 1 10 CYS H H -4.073 -1.870 -1.738 1.00 . A A . 10 CYS H 1 1 29 18063 1 1 10 CYS HA H -4.297 -3.732 0.371 1.00 . A A . 10 CYS HA 1 1 29 18064 1 1 10 CYS HB2 H -5.952 -2.745 -1.674 1.00 . A A . 10 CYS HB2 1 1 29 18065 1 1 10 CYS HB3 H -5.877 -4.484 -1.930 1.00 . A A . 10 CYS HB3 1 1 29 18066 1 1 10 CYS N N -3.618 -2.484 -1.126 1.00 . A A . 10 CYS N 1 1 29 18067 1 1 10 CYS O O -3.137 -4.969 -2.385 1.00 . A A . 10 CYS O 1 1 29 18068 1 1 10 CYS SG S -6.986 -3.940 0.109 1.00 . A A . 10 CYS SG 1 1 29 18069 1 1 11 ARG C C -3.795 -8.146 -1.453 1.00 . A A . 11 ARG C 1 1 29 18070 1 1 11 ARG CA C -2.807 -7.201 -0.780 1.00 . A A . 11 ARG CA 1 1 29 18071 1 1 11 ARG CB C -2.185 -7.880 0.442 1.00 . A A . 11 ARG CB 1 1 29 18072 1 1 11 ARG CD C -2.818 -9.204 2.482 1.00 . A A . 11 ARG CD 1 1 29 18073 1 1 11 ARG CG C -3.130 -7.986 1.628 1.00 . A A . 11 ARG CG 1 1 29 18074 1 1 11 ARG CZ C -3.752 -10.364 4.445 1.00 . A A . 11 ARG CZ 1 1 29 18075 1 1 11 ARG H H -3.843 -5.879 0.509 1.00 . A A . 11 ARG H 1 1 29 18076 1 1 11 ARG HA H -2.026 -6.956 -1.482 1.00 . A A . 11 ARG HA 1 1 29 18077 1 1 11 ARG HB2 H -1.876 -8.878 0.166 1.00 . A A . 11 ARG HB2 1 1 29 18078 1 1 11 ARG HB3 H -1.317 -7.317 0.750 1.00 . A A . 11 ARG HB3 1 1 29 18079 1 1 11 ARG HD2 H -2.737 -10.068 1.839 1.00 . A A . 11 ARG HD2 1 1 29 18080 1 1 11 ARG HD3 H -1.877 -9.042 2.986 1.00 . A A . 11 ARG HD3 1 1 29 18081 1 1 11 ARG HE H -4.671 -8.912 3.430 1.00 . A A . 11 ARG HE 1 1 29 18082 1 1 11 ARG HG2 H -3.031 -7.098 2.235 1.00 . A A . 11 ARG HG2 1 1 29 18083 1 1 11 ARG HG3 H -4.143 -8.063 1.262 1.00 . A A . 11 ARG HG3 1 1 29 18084 1 1 11 ARG HH11 H -1.912 -10.998 3.894 1.00 . A A . 11 ARG HH11 1 1 29 18085 1 1 11 ARG HH12 H -2.591 -11.797 5.272 1.00 . A A . 11 ARG HH12 1 1 29 18086 1 1 11 ARG HH21 H -5.566 -9.962 5.242 1.00 . A A . 11 ARG HH21 1 1 29 18087 1 1 11 ARG HH22 H -4.666 -11.210 6.037 1.00 . A A . 11 ARG HH22 1 1 29 18088 1 1 11 ARG N N -3.467 -5.960 -0.393 1.00 . A A . 11 ARG N 1 1 29 18089 1 1 11 ARG NE N -3.855 -9.452 3.481 1.00 . A A . 11 ARG NE 1 1 29 18090 1 1 11 ARG NH1 N -2.662 -11.115 4.545 1.00 . A A . 11 ARG NH1 1 1 29 18091 1 1 11 ARG NH2 N -4.742 -10.525 5.312 1.00 . A A . 11 ARG NH2 1 1 29 18092 1 1 11 ARG O O -3.435 -8.898 -2.359 1.00 . A A . 11 ARG O 1 1 29 18093 1 1 12 GLN C C -7.408 -8.818 -0.770 1.00 . A A . 12 GLN C 1 1 29 18094 1 1 12 GLN CA C -6.099 -8.944 -1.557 1.00 . A A . 12 GLN CA 1 1 29 18095 1 1 12 GLN CB C -5.649 -10.409 -1.576 1.00 . A A . 12 GLN CB 1 1 29 18096 1 1 12 GLN CD C -6.294 -11.707 -3.644 1.00 . A A . 12 GLN CD 1 1 29 18097 1 1 12 GLN CG C -5.218 -10.895 -2.950 1.00 . A A . 12 GLN CG 1 1 29 18098 1 1 12 GLN H H -5.260 -7.473 -0.282 1.00 . A A . 12 GLN H 1 1 29 18099 1 1 12 GLN HA H -6.276 -8.624 -2.573 1.00 . A A . 12 GLN HA 1 1 29 18100 1 1 12 GLN HB2 H -4.815 -10.525 -0.900 1.00 . A A . 12 GLN HB2 1 1 29 18101 1 1 12 GLN HB3 H -6.465 -11.031 -1.238 1.00 . A A . 12 GLN HB3 1 1 29 18102 1 1 12 GLN HE21 H -5.736 -13.338 -2.653 1.00 . A A . 12 GLN HE21 1 1 29 18103 1 1 12 GLN HE22 H -7.056 -13.541 -3.749 1.00 . A A . 12 GLN HE22 1 1 29 18104 1 1 12 GLN HG2 H -4.984 -10.038 -3.564 1.00 . A A . 12 GLN HG2 1 1 29 18105 1 1 12 GLN HG3 H -4.337 -11.509 -2.841 1.00 . A A . 12 GLN HG3 1 1 29 18106 1 1 12 GLN N N -5.044 -8.096 -1.002 1.00 . A A . 12 GLN N 1 1 29 18107 1 1 12 GLN NE2 N -6.370 -12.992 -3.316 1.00 . A A . 12 GLN NE2 1 1 29 18108 1 1 12 GLN O O -8.376 -9.523 -1.057 1.00 . A A . 12 GLN O 1 1 29 18109 1 1 12 GLN OE1 O -7.048 -11.187 -4.467 1.00 . A A . 12 GLN OE1 1 1 29 18110 1 1 13 CYS C C -8.372 -6.726 2.155 1.00 . A A . 13 CYS C 1 1 29 18111 1 1 13 CYS CA C -8.639 -7.720 1.027 1.00 . A A . 13 CYS CA 1 1 29 18112 1 1 13 CYS CB C -9.127 -9.049 1.613 1.00 . A A . 13 CYS CB 1 1 29 18113 1 1 13 CYS H H -6.651 -7.382 0.405 1.00 . A A . 13 CYS H 1 1 29 18114 1 1 13 CYS HA H -9.407 -7.318 0.384 1.00 . A A . 13 CYS HA 1 1 29 18115 1 1 13 CYS HB2 H -8.617 -9.862 1.119 1.00 . A A . 13 CYS HB2 1 1 29 18116 1 1 13 CYS HB3 H -8.897 -9.076 2.668 1.00 . A A . 13 CYS HB3 1 1 29 18117 1 1 13 CYS N N -7.443 -7.921 0.217 1.00 . A A . 13 CYS N 1 1 29 18118 1 1 13 CYS O O -9.252 -5.952 2.532 1.00 . A A . 13 CYS O 1 1 29 18119 1 1 13 CYS SG S -10.918 -9.326 1.428 1.00 . A A . 13 CYS SG 1 1 29 18120 1 1 14 LYS C C -5.513 -5.083 3.433 1.00 . A A . 14 LYS C 1 1 29 18121 1 1 14 LYS CA C -6.782 -5.853 3.777 1.00 . A A . 14 LYS CA 1 1 29 18122 1 1 14 LYS CB C -6.580 -6.640 5.073 1.00 . A A . 14 LYS CB 1 1 29 18123 1 1 14 LYS CD C -7.506 -6.787 7.404 1.00 . A A . 14 LYS CD 1 1 29 18124 1 1 14 LYS CE C -7.512 -6.106 8.763 1.00 . A A . 14 LYS CE 1 1 29 18125 1 1 14 LYS CG C -6.968 -5.865 6.322 1.00 . A A . 14 LYS CG 1 1 29 18126 1 1 14 LYS H H -6.492 -7.391 2.353 1.00 . A A . 14 LYS H 1 1 29 18127 1 1 14 LYS HA H -7.589 -5.149 3.916 1.00 . A A . 14 LYS HA 1 1 29 18128 1 1 14 LYS HB2 H -7.178 -7.538 5.032 1.00 . A A . 14 LYS HB2 1 1 29 18129 1 1 14 LYS HB3 H -5.539 -6.914 5.155 1.00 . A A . 14 LYS HB3 1 1 29 18130 1 1 14 LYS HD2 H -8.515 -7.073 7.151 1.00 . A A . 14 LYS HD2 1 1 29 18131 1 1 14 LYS HD3 H -6.882 -7.668 7.456 1.00 . A A . 14 LYS HD3 1 1 29 18132 1 1 14 LYS HE2 H -6.548 -5.650 8.928 1.00 . A A . 14 LYS HE2 1 1 29 18133 1 1 14 LYS HE3 H -8.276 -5.342 8.764 1.00 . A A . 14 LYS HE3 1 1 29 18134 1 1 14 LYS HG2 H -6.097 -5.352 6.700 1.00 . A A . 14 LYS HG2 1 1 29 18135 1 1 14 LYS HG3 H -7.730 -5.144 6.064 1.00 . A A . 14 LYS HG3 1 1 29 18136 1 1 14 LYS HZ1 H -8.310 -7.890 9.501 1.00 . A A . 14 LYS HZ1 1 1 29 18137 1 1 14 LYS HZ2 H -6.895 -7.397 10.284 1.00 . A A . 14 LYS HZ2 1 1 29 18138 1 1 14 LYS HZ3 H -8.356 -6.610 10.606 1.00 . A A . 14 LYS HZ3 1 1 29 18139 1 1 14 LYS N N -7.155 -6.752 2.692 1.00 . A A . 14 LYS N 1 1 29 18140 1 1 14 LYS NZ N -7.788 -7.068 9.866 1.00 . A A . 14 LYS NZ 1 1 29 18141 1 1 14 LYS O O -4.619 -5.604 2.766 1.00 . A A . 14 LYS O 1 1 29 18142 1 1 15 LEU C C -2.996 -3.675 4.089 1.00 . A A . 15 LEU C 1 1 29 18143 1 1 15 LEU CA C -4.281 -2.992 3.636 1.00 . A A . 15 LEU CA 1 1 29 18144 1 1 15 LEU CB C -4.436 -1.646 4.348 1.00 . A A . 15 LEU CB 1 1 29 18145 1 1 15 LEU CD1 C -4.382 -0.796 6.708 1.00 . A A . 15 LEU CD1 1 1 29 18146 1 1 15 LEU CD2 C -6.571 -1.341 5.628 1.00 . A A . 15 LEU CD2 1 1 29 18147 1 1 15 LEU CG C -5.098 -1.711 5.727 1.00 . A A . 15 LEU CG 1 1 29 18148 1 1 15 LEU H H -6.187 -3.482 4.418 1.00 . A A . 15 LEU H 1 1 29 18149 1 1 15 LEU HA H -4.224 -2.821 2.572 1.00 . A A . 15 LEU HA 1 1 29 18150 1 1 15 LEU HB2 H -3.454 -1.209 4.462 1.00 . A A . 15 LEU HB2 1 1 29 18151 1 1 15 LEU HB3 H -5.028 -0.998 3.720 1.00 . A A . 15 LEU HB3 1 1 29 18152 1 1 15 LEU HD11 H -3.835 -0.042 6.162 1.00 . A A . 15 LEU HD11 1 1 29 18153 1 1 15 LEU HD12 H -5.106 -0.320 7.352 1.00 . A A . 15 LEU HD12 1 1 29 18154 1 1 15 LEU HD13 H -3.695 -1.377 7.306 1.00 . A A . 15 LEU HD13 1 1 29 18155 1 1 15 LEU HD21 H -6.913 -1.492 4.614 1.00 . A A . 15 LEU HD21 1 1 29 18156 1 1 15 LEU HD22 H -7.145 -1.964 6.298 1.00 . A A . 15 LEU HD22 1 1 29 18157 1 1 15 LEU HD23 H -6.701 -0.304 5.900 1.00 . A A . 15 LEU HD23 1 1 29 18158 1 1 15 LEU HG H -5.031 -2.721 6.104 1.00 . A A . 15 LEU HG 1 1 29 18159 1 1 15 LEU N N -5.441 -3.839 3.893 1.00 . A A . 15 LEU N 1 1 29 18160 1 1 15 LEU O O -2.886 -4.117 5.233 1.00 . A A . 15 LEU O 1 1 29 18161 1 1 16 LYS C C -0.125 -3.779 4.742 1.00 . A A . 16 LYS C 1 1 29 18162 1 1 16 LYS CA C -0.748 -4.388 3.487 1.00 . A A . 16 LYS CA 1 1 29 18163 1 1 16 LYS CB C 0.211 -4.237 2.305 1.00 . A A . 16 LYS CB 1 1 29 18164 1 1 16 LYS CD C 1.185 -5.243 0.219 1.00 . A A . 16 LYS CD 1 1 29 18165 1 1 16 LYS CE C 0.672 -5.750 -1.119 1.00 . A A . 16 LYS CE 1 1 29 18166 1 1 16 LYS CG C 0.134 -5.381 1.308 1.00 . A A . 16 LYS CG 1 1 29 18167 1 1 16 LYS H H -2.176 -3.387 2.288 1.00 . A A . 16 LYS H 1 1 29 18168 1 1 16 LYS HA H -0.932 -5.439 3.660 1.00 . A A . 16 LYS HA 1 1 29 18169 1 1 16 LYS HB2 H -0.020 -3.319 1.784 1.00 . A A . 16 LYS HB2 1 1 29 18170 1 1 16 LYS HB3 H 1.222 -4.183 2.680 1.00 . A A . 16 LYS HB3 1 1 29 18171 1 1 16 LYS HD2 H 1.452 -4.202 0.119 1.00 . A A . 16 LYS HD2 1 1 29 18172 1 1 16 LYS HD3 H 2.058 -5.815 0.500 1.00 . A A . 16 LYS HD3 1 1 29 18173 1 1 16 LYS HE2 H 0.616 -6.828 -1.084 1.00 . A A . 16 LYS HE2 1 1 29 18174 1 1 16 LYS HE3 H -0.315 -5.345 -1.288 1.00 . A A . 16 LYS HE3 1 1 29 18175 1 1 16 LYS HG2 H 0.292 -6.313 1.830 1.00 . A A . 16 LYS HG2 1 1 29 18176 1 1 16 LYS HG3 H -0.846 -5.383 0.852 1.00 . A A . 16 LYS HG3 1 1 29 18177 1 1 16 LYS HZ1 H 2.555 -5.368 -1.938 1.00 . A A . 16 LYS HZ1 1 1 29 18178 1 1 16 LYS HZ2 H 1.442 -6.002 -3.044 1.00 . A A . 16 LYS HZ2 1 1 29 18179 1 1 16 LYS HZ3 H 1.326 -4.386 -2.559 1.00 . A A . 16 LYS HZ3 1 1 29 18180 1 1 16 LYS N N -2.027 -3.758 3.183 1.00 . A A . 16 LYS N 1 1 29 18181 1 1 16 LYS NZ N 1.561 -5.348 -2.244 1.00 . A A . 16 LYS NZ 1 1 29 18182 1 1 16 LYS O O -0.517 -2.695 5.176 1.00 . A A . 16 LYS O 1 1 29 18183 1 1 17 PRO C C 2.370 -2.739 6.293 1.00 . A A . 17 PRO C 1 1 29 18184 1 1 17 PRO CA C 1.533 -3.987 6.554 1.00 . A A . 17 PRO CA 1 1 29 18185 1 1 17 PRO CB C 2.434 -5.158 6.955 1.00 . A A . 17 PRO CB 1 1 29 18186 1 1 17 PRO CD C 1.389 -5.769 4.895 1.00 . A A . 17 PRO CD 1 1 29 18187 1 1 17 PRO CG C 2.653 -5.921 5.694 1.00 . A A . 17 PRO CG 1 1 29 18188 1 1 17 PRO HA H 0.827 -3.785 7.346 1.00 . A A . 17 PRO HA 1 1 29 18189 1 1 17 PRO HB2 H 3.364 -4.780 7.354 1.00 . A A . 17 PRO HB2 1 1 29 18190 1 1 17 PRO HB3 H 1.936 -5.762 7.699 1.00 . A A . 17 PRO HB3 1 1 29 18191 1 1 17 PRO HD2 H 1.610 -5.752 3.838 1.00 . A A . 17 PRO HD2 1 1 29 18192 1 1 17 PRO HD3 H 0.698 -6.567 5.125 1.00 . A A . 17 PRO HD3 1 1 29 18193 1 1 17 PRO HG2 H 3.490 -5.505 5.154 1.00 . A A . 17 PRO HG2 1 1 29 18194 1 1 17 PRO HG3 H 2.830 -6.962 5.920 1.00 . A A . 17 PRO HG3 1 1 29 18195 1 1 17 PRO N N 0.858 -4.469 5.344 1.00 . A A . 17 PRO N 1 1 29 18196 1 1 17 PRO O O 3.118 -2.675 5.317 1.00 . A A . 17 PRO O 1 1 29 18197 1 1 18 ALA C C 4.478 -0.767 6.870 1.00 . A A . 18 ALA C 1 1 29 18198 1 1 18 ALA CA C 2.985 -0.501 7.038 1.00 . A A . 18 ALA CA 1 1 29 18199 1 1 18 ALA CB C 2.739 0.392 8.244 1.00 . A A . 18 ALA CB 1 1 29 18200 1 1 18 ALA H H 1.628 -1.859 7.929 1.00 . A A . 18 ALA H 1 1 29 18201 1 1 18 ALA HA H 2.620 0.012 6.160 1.00 . A A . 18 ALA HA 1 1 29 18202 1 1 18 ALA HB1 H 3.084 -0.107 9.138 1.00 . A A . 18 ALA HB1 1 1 29 18203 1 1 18 ALA HB2 H 3.276 1.321 8.120 1.00 . A A . 18 ALA HB2 1 1 29 18204 1 1 18 ALA HB3 H 1.682 0.596 8.331 1.00 . A A . 18 ALA HB3 1 1 29 18205 1 1 18 ALA N N 2.240 -1.748 7.172 1.00 . A A . 18 ALA N 1 1 29 18206 1 1 18 ALA O O 5.038 -1.652 7.518 1.00 . A A . 18 ALA O 1 1 29 18207 1 1 19 GLY C C 6.822 -1.288 4.765 1.00 . A A . 19 GLY C 1 1 29 18208 1 1 19 GLY CA C 6.537 -0.173 5.753 1.00 . A A . 19 GLY CA 1 1 29 18209 1 1 19 GLY H H 4.619 0.687 5.502 1.00 . A A . 19 GLY H 1 1 29 18210 1 1 19 GLY HA2 H 7.024 -0.403 6.689 1.00 . A A . 19 GLY HA2 1 1 29 18211 1 1 19 GLY HA3 H 6.941 0.750 5.365 1.00 . A A . 19 GLY HA3 1 1 29 18212 1 1 19 GLY N N 5.117 0.001 5.993 1.00 . A A . 19 GLY N 1 1 29 18213 1 1 19 GLY O O 7.924 -1.835 4.736 1.00 . A A . 19 GLY O 1 1 29 18214 1 1 20 THR C C 5.612 -2.165 1.570 1.00 . A A . 20 THR C 1 1 29 18215 1 1 20 THR CA C 5.967 -2.681 2.960 1.00 . A A . 20 THR CA 1 1 29 18216 1 1 20 THR CB C 5.075 -3.871 3.321 1.00 . A A . 20 THR CB 1 1 29 18217 1 1 20 THR CG2 C 5.156 -5.009 2.326 1.00 . A A . 20 THR CG2 1 1 29 18218 1 1 20 THR H H 4.968 -1.152 4.025 1.00 . A A . 20 THR H 1 1 29 18219 1 1 20 THR HA H 6.999 -3.001 2.960 1.00 . A A . 20 THR HA 1 1 29 18220 1 1 20 THR HB H 4.048 -3.538 3.360 1.00 . A A . 20 THR HB 1 1 29 18221 1 1 20 THR HG1 H 5.513 -3.667 5.219 1.00 . A A . 20 THR HG1 1 1 29 18222 1 1 20 THR HG21 H 5.594 -4.653 1.405 1.00 . A A . 20 THR HG21 1 1 29 18223 1 1 20 THR HG22 H 5.768 -5.801 2.733 1.00 . A A . 20 THR HG22 1 1 29 18224 1 1 20 THR HG23 H 4.163 -5.386 2.130 1.00 . A A . 20 THR HG23 1 1 29 18225 1 1 20 THR N N 5.823 -1.625 3.954 1.00 . A A . 20 THR N 1 1 29 18226 1 1 20 THR O O 4.512 -1.658 1.349 1.00 . A A . 20 THR O 1 1 29 18227 1 1 20 THR OG1 O 5.423 -4.389 4.593 1.00 . A A . 20 THR OG1 1 1 29 18228 1 1 21 THR C C 5.063 -2.459 -1.316 1.00 . A A . 21 THR C 1 1 29 18229 1 1 21 THR CA C 6.330 -1.840 -0.734 1.00 . A A . 21 THR CA 1 1 29 18230 1 1 21 THR CB C 7.536 -2.184 -1.612 1.00 . A A . 21 THR CB 1 1 29 18231 1 1 21 THR CG2 C 8.231 -0.961 -2.167 1.00 . A A . 21 THR CG2 1 1 29 18232 1 1 21 THR H H 7.406 -2.708 0.871 1.00 . A A . 21 THR H 1 1 29 18233 1 1 21 THR HA H 6.210 -0.767 -0.710 1.00 . A A . 21 THR HA 1 1 29 18234 1 1 21 THR HB H 7.204 -2.783 -2.449 1.00 . A A . 21 THR HB 1 1 29 18235 1 1 21 THR HG1 H 8.196 -3.839 -0.797 1.00 . A A . 21 THR HG1 1 1 29 18236 1 1 21 THR HG21 H 7.995 -0.104 -1.552 1.00 . A A . 21 THR HG21 1 1 29 18237 1 1 21 THR HG22 H 9.299 -1.122 -2.167 1.00 . A A . 21 THR HG22 1 1 29 18238 1 1 21 THR HG23 H 7.894 -0.783 -3.177 1.00 . A A . 21 THR HG23 1 1 29 18239 1 1 21 THR N N 6.548 -2.296 0.635 1.00 . A A . 21 THR N 1 1 29 18240 1 1 21 THR O O 4.882 -3.676 -1.284 1.00 . A A . 21 THR O 1 1 29 18241 1 1 21 THR OG1 O 8.495 -2.931 -0.884 1.00 . A A . 21 THR OG1 1 1 29 18242 1 1 22 CYS C C 2.884 -1.787 -3.919 1.00 . A A . 22 CYS C 1 1 29 18243 1 1 22 CYS CA C 2.932 -2.070 -2.423 1.00 . A A . 22 CYS CA 1 1 29 18244 1 1 22 CYS CB C 1.752 -1.387 -1.733 1.00 . A A . 22 CYS CB 1 1 29 18245 1 1 22 CYS H H 4.386 -0.651 -1.831 1.00 . A A . 22 CYS H 1 1 29 18246 1 1 22 CYS HA H 2.863 -3.136 -2.266 1.00 . A A . 22 CYS HA 1 1 29 18247 1 1 22 CYS HB2 H 0.842 -1.651 -2.251 1.00 . A A . 22 CYS HB2 1 1 29 18248 1 1 22 CYS HB3 H 1.692 -1.732 -0.711 1.00 . A A . 22 CYS HB3 1 1 29 18249 1 1 22 CYS N N 4.187 -1.610 -1.841 1.00 . A A . 22 CYS N 1 1 29 18250 1 1 22 CYS O O 2.447 -2.626 -4.706 1.00 . A A . 22 CYS O 1 1 29 18251 1 1 22 CYS SG S 1.864 0.432 -1.701 1.00 . A A . 22 CYS SG 1 1 29 18252 1 1 23 TRP C C 4.554 -0.719 -6.432 1.00 . A A . 23 TRP C 1 1 29 18253 1 1 23 TRP CA C 3.322 -0.198 -5.705 1.00 . A A . 23 TRP CA 1 1 29 18254 1 1 23 TRP CB C 3.248 1.326 -5.822 1.00 . A A . 23 TRP CB 1 1 29 18255 1 1 23 TRP CD1 C 1.851 1.020 -7.949 1.00 . A A . 23 TRP CD1 1 1 29 18256 1 1 23 TRP CD2 C 2.039 3.143 -7.268 1.00 . A A . 23 TRP CD2 1 1 29 18257 1 1 23 TRP CE2 C 1.255 3.114 -8.436 1.00 . A A . 23 TRP CE2 1 1 29 18258 1 1 23 TRP CE3 C 2.292 4.374 -6.658 1.00 . A A . 23 TRP CE3 1 1 29 18259 1 1 23 TRP CG C 2.410 1.793 -6.973 1.00 . A A . 23 TRP CG 1 1 29 18260 1 1 23 TRP CH2 C 0.988 5.458 -8.387 1.00 . A A . 23 TRP CH2 1 1 29 18261 1 1 23 TRP CZ2 C 0.724 4.267 -9.005 1.00 . A A . 23 TRP CZ2 1 1 29 18262 1 1 23 TRP CZ3 C 1.765 5.519 -7.224 1.00 . A A . 23 TRP CZ3 1 1 29 18263 1 1 23 TRP H H 3.655 0.034 -3.629 1.00 . A A . 23 TRP H 1 1 29 18264 1 1 23 TRP HA H 2.447 -0.624 -6.164 1.00 . A A . 23 TRP HA 1 1 29 18265 1 1 23 TRP HB2 H 2.823 1.730 -4.916 1.00 . A A . 23 TRP HB2 1 1 29 18266 1 1 23 TRP HB3 H 4.245 1.720 -5.954 1.00 . A A . 23 TRP HB3 1 1 29 18267 1 1 23 TRP HD1 H 1.951 -0.053 -8.006 1.00 . A A . 23 TRP HD1 1 1 29 18268 1 1 23 TRP HE1 H 0.669 1.487 -9.620 1.00 . A A . 23 TRP HE1 1 1 29 18269 1 1 23 TRP HE3 H 2.888 4.439 -5.760 1.00 . A A . 23 TRP HE3 1 1 29 18270 1 1 23 TRP HH2 H 0.598 6.378 -8.796 1.00 . A A . 23 TRP HH2 1 1 29 18271 1 1 23 TRP HZ2 H 0.122 4.237 -9.899 1.00 . A A . 23 TRP HZ2 1 1 29 18272 1 1 23 TRP HZ3 H 1.952 6.479 -6.767 1.00 . A A . 23 TRP HZ3 1 1 29 18273 1 1 23 TRP N N 3.325 -0.596 -4.304 1.00 . A A . 23 TRP N 1 1 29 18274 1 1 23 TRP NE1 N 1.156 1.808 -8.833 1.00 . A A . 23 TRP NE1 1 1 29 18275 1 1 23 TRP O O 4.461 -1.624 -7.262 1.00 . A A . 23 TRP O 1 1 29 18276 1 1 24 LYS C C 6.851 -0.446 -8.271 1.00 . A A . 24 LYS C 1 1 29 18277 1 1 24 LYS CA C 6.957 -0.538 -6.752 1.00 . A A . 24 LYS CA 1 1 29 18278 1 1 24 LYS CB C 7.327 -1.963 -6.337 1.00 . A A . 24 LYS CB 1 1 29 18279 1 1 24 LYS CD C 9.355 -3.372 -5.876 1.00 . A A . 24 LYS CD 1 1 29 18280 1 1 24 LYS CE C 10.862 -3.406 -6.073 1.00 . A A . 24 LYS CE 1 1 29 18281 1 1 24 LYS CG C 8.687 -2.411 -6.845 1.00 . A A . 24 LYS CG 1 1 29 18282 1 1 24 LYS H H 5.710 0.579 -5.457 1.00 . A A . 24 LYS H 1 1 29 18283 1 1 24 LYS HA H 7.729 0.138 -6.415 1.00 . A A . 24 LYS HA 1 1 29 18284 1 1 24 LYS HB2 H 7.332 -2.020 -5.259 1.00 . A A . 24 LYS HB2 1 1 29 18285 1 1 24 LYS HB3 H 6.581 -2.642 -6.721 1.00 . A A . 24 LYS HB3 1 1 29 18286 1 1 24 LYS HD2 H 9.141 -3.056 -4.866 1.00 . A A . 24 LYS HD2 1 1 29 18287 1 1 24 LYS HD3 H 8.958 -4.364 -6.036 1.00 . A A . 24 LYS HD3 1 1 29 18288 1 1 24 LYS HE2 H 11.258 -2.418 -5.890 1.00 . A A . 24 LYS HE2 1 1 29 18289 1 1 24 LYS HE3 H 11.289 -4.101 -5.365 1.00 . A A . 24 LYS HE3 1 1 29 18290 1 1 24 LYS HG2 H 8.561 -2.906 -7.797 1.00 . A A . 24 LYS HG2 1 1 29 18291 1 1 24 LYS HG3 H 9.318 -1.543 -6.970 1.00 . A A . 24 LYS HG3 1 1 29 18292 1 1 24 LYS HZ1 H 10.487 -4.431 -7.854 1.00 . A A . 24 LYS HZ1 1 1 29 18293 1 1 24 LYS HZ2 H 11.353 -2.993 -8.061 1.00 . A A . 24 LYS HZ2 1 1 29 18294 1 1 24 LYS HZ3 H 12.124 -4.363 -7.434 1.00 . A A . 24 LYS HZ3 1 1 29 18295 1 1 24 LYS N N 5.704 -0.138 -6.122 1.00 . A A . 24 LYS N 1 1 29 18296 1 1 24 LYS NZ N 11.233 -3.828 -7.452 1.00 . A A . 24 LYS NZ 1 1 29 18297 1 1 24 LYS O O 7.500 -1.198 -8.998 1.00 . A A . 24 LYS O 1 1 29 18298 1 1 25 THR C C 7.156 0.812 -10.904 1.00 . A A . 25 THR C 1 1 29 18299 1 1 25 THR CA C 5.821 0.687 -10.174 1.00 . A A . 25 THR CA 1 1 29 18300 1 1 25 THR CB C 4.973 1.940 -10.408 1.00 . A A . 25 THR CB 1 1 29 18301 1 1 25 THR CG2 C 4.704 2.225 -11.869 1.00 . A A . 25 THR CG2 1 1 29 18302 1 1 25 THR H H 5.535 1.051 -8.109 1.00 . A A . 25 THR H 1 1 29 18303 1 1 25 THR HA H 5.292 -0.172 -10.559 1.00 . A A . 25 THR HA 1 1 29 18304 1 1 25 THR HB H 5.490 2.795 -9.994 1.00 . A A . 25 THR HB 1 1 29 18305 1 1 25 THR HG1 H 3.206 2.620 -9.911 1.00 . A A . 25 THR HG1 1 1 29 18306 1 1 25 THR HG21 H 4.224 1.369 -12.320 1.00 . A A . 25 THR HG21 1 1 29 18307 1 1 25 THR HG22 H 4.057 3.087 -11.953 1.00 . A A . 25 THR HG22 1 1 29 18308 1 1 25 THR HG23 H 5.636 2.424 -12.375 1.00 . A A . 25 THR HG23 1 1 29 18309 1 1 25 THR N N 6.024 0.485 -8.742 1.00 . A A . 25 THR N 1 1 29 18310 1 1 25 THR O O 8.191 1.058 -10.284 1.00 . A A . 25 THR O 1 1 29 18311 1 1 25 THR OG1 O 3.720 1.824 -9.758 1.00 . A A . 25 THR OG1 1 1 29 18312 1 1 26 SER C C 8.695 2.201 -13.305 1.00 . A A . 26 SER C 1 1 29 18313 1 1 26 SER CA C 8.338 0.741 -13.034 1.00 . A A . 26 SER CA 1 1 29 18314 1 1 26 SER CB C 8.153 -0.008 -14.355 1.00 . A A . 26 SER CB 1 1 29 18315 1 1 26 SER H H 6.272 0.451 -12.662 1.00 . A A . 26 SER H 1 1 29 18316 1 1 26 SER HA H 9.144 0.283 -12.480 1.00 . A A . 26 SER HA 1 1 29 18317 1 1 26 SER HB2 H 7.826 -1.017 -14.152 1.00 . A A . 26 SER HB2 1 1 29 18318 1 1 26 SER HB3 H 7.408 0.498 -14.952 1.00 . A A . 26 SER HB3 1 1 29 18319 1 1 26 SER HG H 9.182 0.063 -16.021 1.00 . A A . 26 SER HG 1 1 29 18320 1 1 26 SER N N 7.127 0.644 -12.223 1.00 . A A . 26 SER N 1 1 29 18321 1 1 26 SER O O 8.874 2.604 -14.454 1.00 . A A . 26 SER O 1 1 29 18322 1 1 26 SER OG O 9.365 -0.061 -15.087 1.00 . A A . 26 SER OG 1 1 29 18323 1 1 27 VAL C C 8.907 5.086 -10.983 1.00 . A A . 27 VAL C 1 1 29 18324 1 1 27 VAL CA C 9.130 4.402 -12.327 1.00 . A A . 27 VAL CA 1 1 29 18325 1 1 27 VAL CB C 8.284 5.127 -13.398 1.00 . A A . 27 VAL CB 1 1 29 18326 1 1 27 VAL CG1 C 6.800 4.989 -13.094 1.00 . A A . 27 VAL CG1 1 1 29 18327 1 1 27 VAL CG2 C 8.680 6.594 -13.490 1.00 . A A . 27 VAL CG2 1 1 29 18328 1 1 27 VAL H H 8.644 2.595 -11.349 1.00 . A A . 27 VAL H 1 1 29 18329 1 1 27 VAL HA H 10.172 4.486 -12.598 1.00 . A A . 27 VAL HA 1 1 29 18330 1 1 27 VAL HB H 8.476 4.666 -14.355 1.00 . A A . 27 VAL HB 1 1 29 18331 1 1 27 VAL HG11 H 6.613 5.276 -12.069 1.00 . A A . 27 VAL HG11 1 1 29 18332 1 1 27 VAL HG12 H 6.236 5.630 -13.755 1.00 . A A . 27 VAL HG12 1 1 29 18333 1 1 27 VAL HG13 H 6.496 3.964 -13.241 1.00 . A A . 27 VAL HG13 1 1 29 18334 1 1 27 VAL HG21 H 9.756 6.679 -13.471 1.00 . A A . 27 VAL HG21 1 1 29 18335 1 1 27 VAL HG22 H 8.302 7.012 -14.412 1.00 . A A . 27 VAL HG22 1 1 29 18336 1 1 27 VAL HG23 H 8.261 7.133 -12.653 1.00 . A A . 27 VAL HG23 1 1 29 18337 1 1 27 VAL N N 8.796 2.984 -12.233 1.00 . A A . 27 VAL N 1 1 29 18338 1 1 27 VAL O O 9.617 6.027 -10.626 1.00 . A A . 27 VAL O 1 1 29 18339 1 1 28 SER C C 7.283 4.072 -7.930 1.00 . A A . 28 SER C 1 1 29 18340 1 1 28 SER CA C 7.578 5.172 -8.947 1.00 . A A . 28 SER CA 1 1 29 18341 1 1 28 SER CB C 6.369 6.100 -9.074 1.00 . A A . 28 SER CB 1 1 29 18342 1 1 28 SER H H 7.376 3.862 -10.592 1.00 . A A . 28 SER H 1 1 29 18343 1 1 28 SER HA H 8.427 5.745 -8.606 1.00 . A A . 28 SER HA 1 1 29 18344 1 1 28 SER HB2 H 6.365 6.549 -10.056 1.00 . A A . 28 SER HB2 1 1 29 18345 1 1 28 SER HB3 H 5.463 5.528 -8.936 1.00 . A A . 28 SER HB3 1 1 29 18346 1 1 28 SER HG H 6.428 7.984 -8.540 1.00 . A A . 28 SER HG 1 1 29 18347 1 1 28 SER N N 7.909 4.609 -10.247 1.00 . A A . 28 SER N 1 1 29 18348 1 1 28 SER O O 6.204 3.479 -7.938 1.00 . A A . 28 SER O 1 1 29 18349 1 1 28 SER OG O 6.412 7.130 -8.102 1.00 . A A . 28 SER OG 1 1 29 18350 1 1 29 SER C C 7.698 3.423 -4.691 1.00 . A A . 29 SER C 1 1 29 18351 1 1 29 SER CA C 8.084 2.787 -6.022 1.00 . A A . 29 SER CA 1 1 29 18352 1 1 29 SER CB C 9.376 1.983 -5.864 1.00 . A A . 29 SER CB 1 1 29 18353 1 1 29 SER H H 9.081 4.320 -7.091 1.00 . A A . 29 SER H 1 1 29 18354 1 1 29 SER HA H 7.291 2.124 -6.335 1.00 . A A . 29 SER HA 1 1 29 18355 1 1 29 SER HB2 H 9.316 1.382 -4.969 1.00 . A A . 29 SER HB2 1 1 29 18356 1 1 29 SER HB3 H 9.505 1.339 -6.721 1.00 . A A . 29 SER HB3 1 1 29 18357 1 1 29 SER HG H 10.797 3.084 -6.642 1.00 . A A . 29 SER HG 1 1 29 18358 1 1 29 SER N N 8.245 3.810 -7.051 1.00 . A A . 29 SER N 1 1 29 18359 1 1 29 SER O O 8.420 4.269 -4.165 1.00 . A A . 29 SER O 1 1 29 18360 1 1 29 SER OG O 10.501 2.839 -5.762 1.00 . A A . 29 SER OG 1 1 29 18361 1 1 30 HIS C C 5.935 2.469 -1.837 1.00 . A A . 30 HIS C 1 1 29 18362 1 1 30 HIS CA C 6.061 3.561 -2.895 1.00 . A A . 30 HIS CA 1 1 29 18363 1 1 30 HIS CB C 4.708 4.244 -3.102 1.00 . A A . 30 HIS CB 1 1 29 18364 1 1 30 HIS CD2 C 5.212 5.133 -5.488 1.00 . A A . 30 HIS CD2 1 1 29 18365 1 1 30 HIS CE1 C 4.243 7.090 -5.314 1.00 . A A . 30 HIS CE1 1 1 29 18366 1 1 30 HIS CG C 4.696 5.220 -4.239 1.00 . A A . 30 HIS CG 1 1 29 18367 1 1 30 HIS H H 6.013 2.347 -4.628 1.00 . A A . 30 HIS H 1 1 29 18368 1 1 30 HIS HA H 6.774 4.295 -2.552 1.00 . A A . 30 HIS HA 1 1 29 18369 1 1 30 HIS HB2 H 3.961 3.491 -3.305 1.00 . A A . 30 HIS HB2 1 1 29 18370 1 1 30 HIS HB3 H 4.440 4.777 -2.202 1.00 . A A . 30 HIS HB3 1 1 29 18371 1 1 30 HIS HD1 H 3.631 6.823 -3.379 1.00 . A A . 30 HIS HD1 1 1 29 18372 1 1 30 HIS HD2 H 5.749 4.293 -5.903 1.00 . A A . 30 HIS HD2 1 1 29 18373 1 1 30 HIS HE1 H 3.874 8.077 -5.547 1.00 . A A . 30 HIS HE1 1 1 29 18374 1 1 30 HIS HE2 H 5.251 6.572 -7.013 1.00 . A A . 30 HIS HE2 1 1 29 18375 1 1 30 HIS N N 6.549 3.019 -4.158 1.00 . A A . 30 HIS N 1 1 29 18376 1 1 30 HIS ND1 N 4.096 6.460 -4.161 1.00 . A A . 30 HIS ND1 1 1 29 18377 1 1 30 HIS NE2 N 4.917 6.308 -6.133 1.00 . A A . 30 HIS NE2 1 1 29 18378 1 1 30 HIS O O 6.346 1.329 -2.052 1.00 . A A . 30 HIS O 1 1 29 18379 1 1 31 TYR C C 3.806 2.068 1.047 1.00 . A A . 31 TYR C 1 1 29 18380 1 1 31 TYR CA C 5.177 1.889 0.404 1.00 . A A . 31 TYR CA 1 1 29 18381 1 1 31 TYR CB C 6.269 2.084 1.457 1.00 . A A . 31 TYR CB 1 1 29 18382 1 1 31 TYR CD1 C 8.495 1.834 0.296 1.00 . A A . 31 TYR CD1 1 1 29 18383 1 1 31 TYR CD2 C 7.788 0.092 1.761 1.00 . A A . 31 TYR CD2 1 1 29 18384 1 1 31 TYR CE1 C 9.660 1.141 0.028 1.00 . A A . 31 TYR CE1 1 1 29 18385 1 1 31 TYR CE2 C 8.950 -0.607 1.499 1.00 . A A . 31 TYR CE2 1 1 29 18386 1 1 31 TYR CG C 7.541 1.322 1.165 1.00 . A A . 31 TYR CG 1 1 29 18387 1 1 31 TYR CZ C 9.883 -0.079 0.632 1.00 . A A . 31 TYR CZ 1 1 29 18388 1 1 31 TYR H H 5.055 3.755 -0.585 1.00 . A A . 31 TYR H 1 1 29 18389 1 1 31 TYR HA H 5.249 0.890 0.002 1.00 . A A . 31 TYR HA 1 1 29 18390 1 1 31 TYR HB2 H 6.518 3.133 1.516 1.00 . A A . 31 TYR HB2 1 1 29 18391 1 1 31 TYR HB3 H 5.896 1.754 2.416 1.00 . A A . 31 TYR HB3 1 1 29 18392 1 1 31 TYR HD1 H 8.318 2.789 -0.176 1.00 . A A . 31 TYR HD1 1 1 29 18393 1 1 31 TYR HD2 H 7.054 -0.319 2.439 1.00 . A A . 31 TYR HD2 1 1 29 18394 1 1 31 TYR HE1 H 10.391 1.556 -0.651 1.00 . A A . 31 TYR HE1 1 1 29 18395 1 1 31 TYR HE2 H 9.123 -1.562 1.973 1.00 . A A . 31 TYR HE2 1 1 29 18396 1 1 31 TYR HH H 10.826 -1.619 -0.029 1.00 . A A . 31 TYR HH 1 1 29 18397 1 1 31 TYR N N 5.362 2.831 -0.694 1.00 . A A . 31 TYR N 1 1 29 18398 1 1 31 TYR O O 3.122 3.063 0.807 1.00 . A A . 31 TYR O 1 1 29 18399 1 1 31 TYR OH O 11.042 -0.772 0.368 1.00 . A A . 31 TYR OH 1 1 29 18400 1 1 32 CYS C C 2.305 1.661 3.983 1.00 . A A . 32 CYS C 1 1 29 18401 1 1 32 CYS CA C 2.128 1.158 2.554 1.00 . A A . 32 CYS CA 1 1 29 18402 1 1 32 CYS CB C 1.464 -0.222 2.560 1.00 . A A . 32 CYS CB 1 1 29 18403 1 1 32 CYS H H 4.005 0.336 2.026 1.00 . A A . 32 CYS H 1 1 29 18404 1 1 32 CYS HA H 1.498 1.850 2.018 1.00 . A A . 32 CYS HA 1 1 29 18405 1 1 32 CYS HB2 H 1.909 -0.829 1.786 1.00 . A A . 32 CYS HB2 1 1 29 18406 1 1 32 CYS HB3 H 1.633 -0.690 3.519 1.00 . A A . 32 CYS HB3 1 1 29 18407 1 1 32 CYS N N 3.414 1.101 1.871 1.00 . A A . 32 CYS N 1 1 29 18408 1 1 32 CYS O O 3.342 1.433 4.606 1.00 . A A . 32 CYS O 1 1 29 18409 1 1 32 CYS SG S -0.335 -0.186 2.268 1.00 . A A . 32 CYS SG 1 1 29 18410 1 1 33 THR C C 0.414 2.111 6.782 1.00 . A A . 33 THR C 1 1 29 18411 1 1 33 THR CA C 1.341 2.886 5.851 1.00 . A A . 33 THR CA 1 1 29 18412 1 1 33 THR CB C 0.957 4.366 5.849 1.00 . A A . 33 THR CB 1 1 29 18413 1 1 33 THR CG2 C 1.641 5.161 4.757 1.00 . A A . 33 THR CG2 1 1 29 18414 1 1 33 THR H H 0.492 2.501 3.950 1.00 . A A . 33 THR H 1 1 29 18415 1 1 33 THR HA H 2.355 2.787 6.208 1.00 . A A . 33 THR HA 1 1 29 18416 1 1 33 THR HB H 1.236 4.801 6.798 1.00 . A A . 33 THR HB 1 1 29 18417 1 1 33 THR HG1 H -0.723 4.057 4.891 1.00 . A A . 33 THR HG1 1 1 29 18418 1 1 33 THR HG21 H 2.408 4.556 4.298 1.00 . A A . 33 THR HG21 1 1 29 18419 1 1 33 THR HG22 H 0.914 5.448 4.012 1.00 . A A . 33 THR HG22 1 1 29 18420 1 1 33 THR HG23 H 2.088 6.047 5.183 1.00 . A A . 33 THR HG23 1 1 29 18421 1 1 33 THR N N 1.291 2.349 4.495 1.00 . A A . 33 THR N 1 1 29 18422 1 1 33 THR O O 0.006 2.617 7.827 1.00 . A A . 33 THR O 1 1 29 18423 1 1 33 THR OG1 O -0.441 4.522 5.683 1.00 . A A . 33 THR OG1 1 1 29 18424 1 1 34 GLY C C -2.038 0.794 7.666 1.00 . A A . 34 GLY C 1 1 29 18425 1 1 34 GLY CA C -0.791 0.055 7.213 1.00 . A A . 34 GLY CA 1 1 29 18426 1 1 34 GLY H H 0.442 0.526 5.555 1.00 . A A . 34 GLY H 1 1 29 18427 1 1 34 GLY HA2 H -0.246 -0.275 8.085 1.00 . A A . 34 GLY HA2 1 1 29 18428 1 1 34 GLY HA3 H -1.089 -0.810 6.640 1.00 . A A . 34 GLY HA3 1 1 29 18429 1 1 34 GLY N N 0.085 0.879 6.398 1.00 . A A . 34 GLY N 1 1 29 18430 1 1 34 GLY O O -2.580 0.512 8.735 1.00 . A A . 34 GLY O 1 1 29 18431 1 1 35 ARG C C -4.801 2.252 6.177 1.00 . A A . 35 ARG C 1 1 29 18432 1 1 35 ARG CA C -3.682 2.522 7.175 1.00 . A A . 35 ARG CA 1 1 29 18433 1 1 35 ARG CB C -3.348 4.015 7.194 1.00 . A A . 35 ARG CB 1 1 29 18434 1 1 35 ARG CD C -4.134 4.427 9.545 1.00 . A A . 35 ARG CD 1 1 29 18435 1 1 35 ARG CG C -4.267 4.833 8.086 1.00 . A A . 35 ARG CG 1 1 29 18436 1 1 35 ARG CZ C -4.568 5.441 11.748 1.00 . A A . 35 ARG CZ 1 1 29 18437 1 1 35 ARG H H -2.017 1.920 6.014 1.00 . A A . 35 ARG H 1 1 29 18438 1 1 35 ARG HA H -4.015 2.226 8.155 1.00 . A A . 35 ARG HA 1 1 29 18439 1 1 35 ARG HB2 H -2.335 4.141 7.546 1.00 . A A . 35 ARG HB2 1 1 29 18440 1 1 35 ARG HB3 H -3.421 4.401 6.188 1.00 . A A . 35 ARG HB3 1 1 29 18441 1 1 35 ARG HD2 H -4.883 3.681 9.767 1.00 . A A . 35 ARG HD2 1 1 29 18442 1 1 35 ARG HD3 H -3.151 4.006 9.699 1.00 . A A . 35 ARG HD3 1 1 29 18443 1 1 35 ARG HE H -4.237 6.461 10.064 1.00 . A A . 35 ARG HE 1 1 29 18444 1 1 35 ARG HG2 H -4.012 5.877 7.989 1.00 . A A . 35 ARG HG2 1 1 29 18445 1 1 35 ARG HG3 H -5.289 4.679 7.770 1.00 . A A . 35 ARG HG3 1 1 29 18446 1 1 35 ARG HH11 H -4.566 3.418 11.743 1.00 . A A . 35 ARG HH11 1 1 29 18447 1 1 35 ARG HH12 H -4.868 4.156 13.280 1.00 . A A . 35 ARG HH12 1 1 29 18448 1 1 35 ARG HH21 H -4.634 7.433 12.086 1.00 . A A . 35 ARG HH21 1 1 29 18449 1 1 35 ARG HH22 H -4.908 6.435 13.475 1.00 . A A . 35 ARG HH22 1 1 29 18450 1 1 35 ARG N N -2.493 1.741 6.852 1.00 . A A . 35 ARG N 1 1 29 18451 1 1 35 ARG NE N -4.312 5.562 10.447 1.00 . A A . 35 ARG NE 1 1 29 18452 1 1 35 ARG NH1 N -4.676 4.240 12.302 1.00 . A A . 35 ARG NH1 1 1 29 18453 1 1 35 ARG NH2 N -4.715 6.525 12.498 1.00 . A A . 35 ARG NH2 1 1 29 18454 1 1 35 ARG O O -5.900 1.843 6.553 1.00 . A A . 35 ARG O 1 1 29 18455 1 1 36 SER C C -4.947 1.304 2.795 1.00 . A A . 36 SER C 1 1 29 18456 1 1 36 SER CA C -5.488 2.271 3.842 1.00 . A A . 36 SER CA 1 1 29 18457 1 1 36 SER CB C -5.856 3.602 3.183 1.00 . A A . 36 SER CB 1 1 29 18458 1 1 36 SER H H -3.618 2.811 4.675 1.00 . A A . 36 SER H 1 1 29 18459 1 1 36 SER HA H -6.374 1.842 4.286 1.00 . A A . 36 SER HA 1 1 29 18460 1 1 36 SER HB2 H -6.805 3.501 2.679 1.00 . A A . 36 SER HB2 1 1 29 18461 1 1 36 SER HB3 H -5.930 4.368 3.941 1.00 . A A . 36 SER HB3 1 1 29 18462 1 1 36 SER HG H -4.130 4.387 2.691 1.00 . A A . 36 SER HG 1 1 29 18463 1 1 36 SER N N -4.512 2.486 4.905 1.00 . A A . 36 SER N 1 1 29 18464 1 1 36 SER O O -3.779 0.917 2.839 1.00 . A A . 36 SER O 1 1 29 18465 1 1 36 SER OG O -4.876 3.990 2.236 1.00 . A A . 36 SER OG 1 1 29 18466 1 1 37 CYS C C -4.967 0.756 -0.457 1.00 . A A . 37 CYS C 1 1 29 18467 1 1 37 CYS CA C -5.405 -0.001 0.794 1.00 . A A . 37 CYS CA 1 1 29 18468 1 1 37 CYS CB C -6.556 -0.950 0.456 1.00 . A A . 37 CYS CB 1 1 29 18469 1 1 37 CYS H H -6.719 1.264 1.869 1.00 . A A . 37 CYS H 1 1 29 18470 1 1 37 CYS HA H -4.570 -0.581 1.158 1.00 . A A . 37 CYS HA 1 1 29 18471 1 1 37 CYS HB2 H -7.492 -0.439 0.620 1.00 . A A . 37 CYS HB2 1 1 29 18472 1 1 37 CYS HB3 H -6.484 -1.235 -0.582 1.00 . A A . 37 CYS HB3 1 1 29 18473 1 1 37 CYS N N -5.802 0.919 1.853 1.00 . A A . 37 CYS N 1 1 29 18474 1 1 37 CYS O O -4.792 0.163 -1.521 1.00 . A A . 37 CYS O 1 1 29 18475 1 1 37 CYS SG S -6.575 -2.475 1.453 1.00 . A A . 37 CYS SG 1 1 29 18476 1 1 38 GLU C C -2.999 3.527 -1.172 1.00 . A A . 38 GLU C 1 1 29 18477 1 1 38 GLU CA C -4.365 2.901 -1.443 1.00 . A A . 38 GLU CA 1 1 29 18478 1 1 38 GLU CB C -5.398 3.998 -1.708 1.00 . A A . 38 GLU CB 1 1 29 18479 1 1 38 GLU CD C -7.450 3.386 -0.368 1.00 . A A . 38 GLU CD 1 1 29 18480 1 1 38 GLU CG C -6.829 3.489 -1.748 1.00 . A A . 38 GLU CG 1 1 29 18481 1 1 38 GLU H H -4.939 2.485 0.551 1.00 . A A . 38 GLU H 1 1 29 18482 1 1 38 GLU HA H -4.292 2.270 -2.316 1.00 . A A . 38 GLU HA 1 1 29 18483 1 1 38 GLU HB2 H -5.324 4.741 -0.928 1.00 . A A . 38 GLU HB2 1 1 29 18484 1 1 38 GLU HB3 H -5.177 4.462 -2.658 1.00 . A A . 38 GLU HB3 1 1 29 18485 1 1 38 GLU HG2 H -7.423 4.166 -2.343 1.00 . A A . 38 GLU HG2 1 1 29 18486 1 1 38 GLU HG3 H -6.837 2.509 -2.204 1.00 . A A . 38 GLU HG3 1 1 29 18487 1 1 38 GLU N N -4.787 2.068 -0.322 1.00 . A A . 38 GLU N 1 1 29 18488 1 1 38 GLU O O -2.877 4.451 -0.368 1.00 . A A . 38 GLU O 1 1 29 18489 1 1 38 GLU OE1 O -7.960 4.411 0.131 1.00 . A A . 38 GLU OE1 1 1 29 18490 1 1 38 GLU OE2 O -7.427 2.281 0.213 1.00 . A A . 38 GLU OE2 1 1 29 18491 1 1 39 CYS C C -0.565 5.040 -1.853 1.00 . A A . 39 CYS C 1 1 29 18492 1 1 39 CYS CA C -0.613 3.522 -1.684 1.00 . A A . 39 CYS CA 1 1 29 18493 1 1 39 CYS CB C 0.328 2.859 -2.694 1.00 . A A . 39 CYS CB 1 1 29 18494 1 1 39 CYS H H -2.135 2.280 -2.474 1.00 . A A . 39 CYS H 1 1 29 18495 1 1 39 CYS HA H -0.287 3.271 -0.685 1.00 . A A . 39 CYS HA 1 1 29 18496 1 1 39 CYS HB2 H 0.092 3.220 -3.685 1.00 . A A . 39 CYS HB2 1 1 29 18497 1 1 39 CYS HB3 H 1.347 3.125 -2.453 1.00 . A A . 39 CYS HB3 1 1 29 18498 1 1 39 CYS N N -1.974 3.016 -1.849 1.00 . A A . 39 CYS N 1 1 29 18499 1 1 39 CYS O O -1.308 5.607 -2.653 1.00 . A A . 39 CYS O 1 1 29 18500 1 1 39 CYS SG S 0.223 1.040 -2.730 1.00 . A A . 39 CYS SG 1 1 29 18501 1 1 40 PRO C C 1.178 7.626 -2.435 1.00 . A A . 40 PRO C 1 1 29 18502 1 1 40 PRO CA C 0.458 7.176 -1.169 1.00 . A A . 40 PRO CA 1 1 29 18503 1 1 40 PRO CB C 1.293 7.507 0.067 1.00 . A A . 40 PRO CB 1 1 29 18504 1 1 40 PRO CD C 1.243 5.122 -0.116 1.00 . A A . 40 PRO CD 1 1 29 18505 1 1 40 PRO CG C 2.102 6.281 0.312 1.00 . A A . 40 PRO CG 1 1 29 18506 1 1 40 PRO HA H -0.500 7.672 -1.105 1.00 . A A . 40 PRO HA 1 1 29 18507 1 1 40 PRO HB2 H 1.920 8.363 -0.137 1.00 . A A . 40 PRO HB2 1 1 29 18508 1 1 40 PRO HB3 H 0.641 7.722 0.900 1.00 . A A . 40 PRO HB3 1 1 29 18509 1 1 40 PRO HD2 H 1.848 4.354 -0.576 1.00 . A A . 40 PRO HD2 1 1 29 18510 1 1 40 PRO HD3 H 0.703 4.721 0.729 1.00 . A A . 40 PRO HD3 1 1 29 18511 1 1 40 PRO HG2 H 3.007 6.315 -0.277 1.00 . A A . 40 PRO HG2 1 1 29 18512 1 1 40 PRO HG3 H 2.340 6.203 1.362 1.00 . A A . 40 PRO HG3 1 1 29 18513 1 1 40 PRO N N 0.316 5.720 -1.097 1.00 . A A . 40 PRO N 1 1 29 18514 1 1 40 PRO O O 1.593 6.803 -3.251 1.00 . A A . 40 PRO O 1 1 29 18515 1 1 41 SER C C 3.450 9.830 -3.446 1.00 . A A . 41 SER C 1 1 29 18516 1 1 41 SER CA C 1.994 9.498 -3.759 1.00 . A A . 41 SER CA 1 1 29 18517 1 1 41 SER CB C 1.264 10.753 -4.239 1.00 . A A . 41 SER CB 1 1 29 18518 1 1 41 SER H H 0.970 9.542 -1.906 1.00 . A A . 41 SER H 1 1 29 18519 1 1 41 SER HA H 1.968 8.756 -4.543 1.00 . A A . 41 SER HA 1 1 29 18520 1 1 41 SER HB2 H 0.203 10.633 -4.081 1.00 . A A . 41 SER HB2 1 1 29 18521 1 1 41 SER HB3 H 1.616 11.608 -3.680 1.00 . A A . 41 SER HB3 1 1 29 18522 1 1 41 SER HG H 1.714 11.908 -5.756 1.00 . A A . 41 SER HG 1 1 29 18523 1 1 41 SER N N 1.323 8.937 -2.592 1.00 . A A . 41 SER N 1 1 29 18524 1 1 41 SER O O 4.033 10.732 -4.047 1.00 . A A . 41 SER O 1 1 29 18525 1 1 41 SER OG O 1.496 10.983 -5.618 1.00 . A A . 41 SER OG 1 1 29 18526 1 1 42 TYR C C 6.149 7.978 -1.948 1.00 . A A . 42 TYR C 1 1 29 18527 1 1 42 TYR CA C 5.421 9.310 -2.116 1.00 . A A . 42 TYR CA 1 1 29 18528 1 1 42 TYR CB C 5.492 10.113 -0.815 1.00 . A A . 42 TYR CB 1 1 29 18529 1 1 42 TYR CD1 C 5.561 8.326 0.967 1.00 . A A . 42 TYR CD1 1 1 29 18530 1 1 42 TYR CD2 C 3.678 9.787 0.911 1.00 . A A . 42 TYR CD2 1 1 29 18531 1 1 42 TYR CE1 C 5.023 7.667 2.056 1.00 . A A . 42 TYR CE1 1 1 29 18532 1 1 42 TYR CE2 C 3.133 9.134 2.000 1.00 . A A . 42 TYR CE2 1 1 29 18533 1 1 42 TYR CG C 4.899 9.395 0.376 1.00 . A A . 42 TYR CG 1 1 29 18534 1 1 42 TYR CZ C 3.809 8.075 2.569 1.00 . A A . 42 TYR CZ 1 1 29 18535 1 1 42 TYR H H 3.518 8.388 -2.062 1.00 . A A . 42 TYR H 1 1 29 18536 1 1 42 TYR HA H 5.901 9.873 -2.903 1.00 . A A . 42 TYR HA 1 1 29 18537 1 1 42 TYR HB2 H 6.525 10.330 -0.590 1.00 . A A . 42 TYR HB2 1 1 29 18538 1 1 42 TYR HB3 H 4.955 11.042 -0.945 1.00 . A A . 42 TYR HB3 1 1 29 18539 1 1 42 TYR HD1 H 6.512 8.009 0.564 1.00 . A A . 42 TYR HD1 1 1 29 18540 1 1 42 TYR HD2 H 3.151 10.616 0.462 1.00 . A A . 42 TYR HD2 1 1 29 18541 1 1 42 TYR HE1 H 5.553 6.839 2.502 1.00 . A A . 42 TYR HE1 1 1 29 18542 1 1 42 TYR HE2 H 2.183 9.453 2.401 1.00 . A A . 42 TYR HE2 1 1 29 18543 1 1 42 TYR HH H 3.940 7.324 4.334 1.00 . A A . 42 TYR HH 1 1 29 18544 1 1 42 TYR N N 4.032 9.094 -2.504 1.00 . A A . 42 TYR N 1 1 29 18545 1 1 42 TYR O O 5.558 6.992 -1.508 1.00 . A A . 42 TYR O 1 1 29 18546 1 1 42 TYR OH O 3.270 7.422 3.653 1.00 . A A . 42 TYR OH 1 1 29 18547 1 1 43 PRO C C 8.326 6.194 -0.750 1.00 . A A . 43 PRO C 1 1 29 18548 1 1 43 PRO CA C 8.247 6.707 -2.185 1.00 . A A . 43 PRO CA 1 1 29 18549 1 1 43 PRO CB C 9.634 7.125 -2.694 1.00 . A A . 43 PRO CB 1 1 29 18550 1 1 43 PRO CD C 8.229 9.055 -2.834 1.00 . A A . 43 PRO CD 1 1 29 18551 1 1 43 PRO CG C 9.649 8.614 -2.622 1.00 . A A . 43 PRO CG 1 1 29 18552 1 1 43 PRO HA H 7.855 5.926 -2.815 1.00 . A A . 43 PRO HA 1 1 29 18553 1 1 43 PRO HB2 H 10.395 6.692 -2.061 1.00 . A A . 43 PRO HB2 1 1 29 18554 1 1 43 PRO HB3 H 9.765 6.779 -3.708 1.00 . A A . 43 PRO HB3 1 1 29 18555 1 1 43 PRO HD2 H 8.029 9.962 -2.283 1.00 . A A . 43 PRO HD2 1 1 29 18556 1 1 43 PRO HD3 H 8.030 9.198 -3.886 1.00 . A A . 43 PRO HD3 1 1 29 18557 1 1 43 PRO HG2 H 9.999 8.933 -1.652 1.00 . A A . 43 PRO HG2 1 1 29 18558 1 1 43 PRO HG3 H 10.284 9.012 -3.400 1.00 . A A . 43 PRO HG3 1 1 29 18559 1 1 43 PRO N N 7.446 7.930 -2.299 1.00 . A A . 43 PRO N 1 1 29 18560 1 1 43 PRO O O 7.637 5.242 -0.384 1.00 . A A . 43 PRO O 1 1 29 18561 1 1 44 GLY C C 10.769 6.340 1.870 1.00 . A A . 44 GLY C 1 1 29 18562 1 1 44 GLY CA C 9.317 6.420 1.443 1.00 . A A . 44 GLY CA 1 1 29 18563 1 1 44 GLY H H 9.689 7.580 -0.287 1.00 . A A . 44 GLY H 1 1 29 18564 1 1 44 GLY HA2 H 8.861 5.449 1.571 1.00 . A A . 44 GLY HA2 1 1 29 18565 1 1 44 GLY HA3 H 8.806 7.132 2.074 1.00 . A A . 44 GLY HA3 1 1 29 18566 1 1 44 GLY N N 9.167 6.829 0.058 1.00 . A A . 44 GLY N 1 1 29 18567 1 1 44 GLY O O 11.176 5.387 2.534 1.00 . A A . 44 GLY O 1 1 29 18568 1 1 45 ASN C C 13.206 8.278 3.048 1.00 . A A . 45 ASN C 1 1 29 18569 1 1 45 ASN CA C 12.968 7.383 1.836 1.00 . A A . 45 ASN CA 1 1 29 18570 1 1 45 ASN CB C 13.792 7.883 0.649 1.00 . A A . 45 ASN CB 1 1 29 18571 1 1 45 ASN CG C 13.353 9.255 0.176 1.00 . A A . 45 ASN CG 1 1 29 18572 1 1 45 ASN H H 11.169 8.075 0.961 1.00 . A A . 45 ASN H 1 1 29 18573 1 1 45 ASN HA H 13.277 6.378 2.080 1.00 . A A . 45 ASN HA 1 1 29 18574 1 1 45 ASN HB2 H 14.831 7.938 0.937 1.00 . A A . 45 ASN HB2 1 1 29 18575 1 1 45 ASN HB3 H 13.687 7.188 -0.172 1.00 . A A . 45 ASN HB3 1 1 29 18576 1 1 45 ASN HD21 H 14.846 9.307 -1.137 1.00 . A A . 45 ASN HD21 1 1 29 18577 1 1 45 ASN HD22 H 13.817 10.695 -1.113 1.00 . A A . 45 ASN HD22 1 1 29 18578 1 1 45 ASN N N 11.552 7.344 1.489 1.00 . A A . 45 ASN N 1 1 29 18579 1 1 45 ASN ND2 N 14.079 9.808 -0.789 1.00 . A A . 45 ASN ND2 1 1 29 18580 1 1 45 ASN O O 14.259 8.902 3.174 1.00 . A A . 45 ASN O 1 1 29 18581 1 1 45 ASN OD1 O 12.373 9.811 0.672 1.00 . A A . 45 ASN OD1 1 1 29 18582 1 1 46 GLY C C 11.077 9.940 5.424 1.00 . A A . 46 GLY C 1 1 29 18583 1 1 46 GLY CA C 12.341 9.159 5.127 1.00 . A A . 46 GLY CA 1 1 29 18584 1 1 46 GLY H H 11.402 7.818 3.784 1.00 . A A . 46 GLY H 1 1 29 18585 1 1 46 GLY HA2 H 13.157 9.854 4.989 1.00 . A A . 46 GLY HA2 1 1 29 18586 1 1 46 GLY HA3 H 12.565 8.521 5.969 1.00 . A A . 46 GLY HA3 1 1 29 18587 1 1 46 GLY N N 12.219 8.337 3.937 1.00 . A A . 46 GLY N 1 1 29 18588 1 1 46 GLY O O 10.590 9.867 6.572 1.00 . A A . 46 GLY O 1 1 29 18589 1 1 46 GLY OXT O 10.573 10.626 4.510 1.00 . A A . 46 GLY OXT 1 1 30 18590 1 1 1 ALA C C -18.437 -6.514 7.130 1.00 . A A . 1 ALA C 1 1 30 18591 1 1 1 ALA CA C -19.199 -5.809 8.247 1.00 . A A . 1 ALA CA 1 1 30 18592 1 1 1 ALA CB C -18.254 -5.450 9.384 1.00 . A A . 1 ALA CB 1 1 30 18593 1 1 1 ALA H1 H -20.723 -7.154 7.937 1.00 . A A . 1 ALA H1 1 1 30 18594 1 1 1 ALA H2 H -19.913 -7.325 9.440 1.00 . A A . 1 ALA H2 1 1 30 18595 1 1 1 ALA H3 H -21.010 -6.028 9.196 1.00 . A A . 1 ALA H3 1 1 30 18596 1 1 1 ALA HA H -19.618 -4.892 7.858 1.00 . A A . 1 ALA HA 1 1 30 18597 1 1 1 ALA HB1 H -18.808 -4.964 10.173 1.00 . A A . 1 ALA HB1 1 1 30 18598 1 1 1 ALA HB2 H -17.794 -6.349 9.768 1.00 . A A . 1 ALA HB2 1 1 30 18599 1 1 1 ALA HB3 H -17.488 -4.783 9.019 1.00 . A A . 1 ALA HB3 1 1 30 18600 1 1 1 ALA N N -20.312 -6.655 8.750 1.00 . A A . 1 ALA N 1 1 30 18601 1 1 1 ALA O O -17.483 -7.248 7.383 1.00 . A A . 1 ALA O 1 1 30 18602 1 1 2 MET C C -17.363 -5.884 3.990 1.00 . A A . 2 MET C 1 1 30 18603 1 1 2 MET CA C -18.224 -6.898 4.736 1.00 . A A . 2 MET CA 1 1 30 18604 1 1 2 MET CB C -19.277 -7.482 3.792 1.00 . A A . 2 MET CB 1 1 30 18605 1 1 2 MET CE C -22.032 -10.232 4.869 1.00 . A A . 2 MET CE 1 1 30 18606 1 1 2 MET CG C -19.713 -8.890 4.162 1.00 . A A . 2 MET CG 1 1 30 18607 1 1 2 MET H H -19.632 -5.689 5.755 1.00 . A A . 2 MET H 1 1 30 18608 1 1 2 MET HA H -17.591 -7.697 5.093 1.00 . A A . 2 MET HA 1 1 30 18609 1 1 2 MET HB2 H -20.149 -6.844 3.805 1.00 . A A . 2 MET HB2 1 1 30 18610 1 1 2 MET HB3 H -18.873 -7.504 2.791 1.00 . A A . 2 MET HB3 1 1 30 18611 1 1 2 MET HE1 H -21.469 -10.023 5.767 1.00 . A A . 2 MET HE1 1 1 30 18612 1 1 2 MET HE2 H -23.061 -9.939 5.013 1.00 . A A . 2 MET HE2 1 1 30 18613 1 1 2 MET HE3 H -21.986 -11.289 4.653 1.00 . A A . 2 MET HE3 1 1 30 18614 1 1 2 MET HG2 H -18.988 -9.590 3.774 1.00 . A A . 2 MET HG2 1 1 30 18615 1 1 2 MET HG3 H -19.747 -8.970 5.239 1.00 . A A . 2 MET HG3 1 1 30 18616 1 1 2 MET N N -18.866 -6.285 5.893 1.00 . A A . 2 MET N 1 1 30 18617 1 1 2 MET O O -17.786 -5.315 2.984 1.00 . A A . 2 MET O 1 1 30 18618 1 1 2 MET SD S -21.335 -9.312 3.499 1.00 . A A . 2 MET SD 1 1 30 18619 1 1 3 ASP C C -13.829 -5.312 3.767 1.00 . A A . 3 ASP C 1 1 30 18620 1 1 3 ASP CA C -15.230 -4.717 3.872 1.00 . A A . 3 ASP CA 1 1 30 18621 1 1 3 ASP CB C -15.185 -3.416 4.676 1.00 . A A . 3 ASP CB 1 1 30 18622 1 1 3 ASP CG C -14.700 -3.631 6.096 1.00 . A A . 3 ASP CG 1 1 30 18623 1 1 3 ASP H H -15.871 -6.147 5.295 1.00 . A A . 3 ASP H 1 1 30 18624 1 1 3 ASP HA H -15.593 -4.503 2.878 1.00 . A A . 3 ASP HA 1 1 30 18625 1 1 3 ASP HB2 H -14.517 -2.722 4.189 1.00 . A A . 3 ASP HB2 1 1 30 18626 1 1 3 ASP HB3 H -16.177 -2.990 4.714 1.00 . A A . 3 ASP HB3 1 1 30 18627 1 1 3 ASP N N -16.151 -5.663 4.491 1.00 . A A . 3 ASP N 1 1 30 18628 1 1 3 ASP O O -13.214 -5.659 4.775 1.00 . A A . 3 ASP O 1 1 30 18629 1 1 3 ASP OD1 O -13.625 -3.098 6.443 1.00 . A A . 3 ASP OD1 1 1 30 18630 1 1 3 ASP OD2 O -15.395 -4.331 6.862 1.00 . A A . 3 ASP OD2 1 1 30 18631 1 1 4 CYS C C -11.005 -4.875 1.965 1.00 . A A . 4 CYS C 1 1 30 18632 1 1 4 CYS CA C -12.002 -5.979 2.303 1.00 . A A . 4 CYS CA 1 1 30 18633 1 1 4 CYS CB C -12.048 -7.005 1.167 1.00 . A A . 4 CYS CB 1 1 30 18634 1 1 4 CYS H H -13.869 -5.131 1.776 1.00 . A A . 4 CYS H 1 1 30 18635 1 1 4 CYS HA H -11.682 -6.471 3.209 1.00 . A A . 4 CYS HA 1 1 30 18636 1 1 4 CYS HB2 H -12.953 -6.858 0.597 1.00 . A A . 4 CYS HB2 1 1 30 18637 1 1 4 CYS HB3 H -11.195 -6.854 0.521 1.00 . A A . 4 CYS HB3 1 1 30 18638 1 1 4 CYS N N -13.331 -5.426 2.540 1.00 . A A . 4 CYS N 1 1 30 18639 1 1 4 CYS O O -9.815 -4.991 2.254 1.00 . A A . 4 CYS O 1 1 30 18640 1 1 4 CYS SG S -12.023 -8.741 1.722 1.00 . A A . 4 CYS SG 1 1 30 18641 1 1 5 THR C C -9.639 -3.122 -0.099 1.00 . A A . 5 THR C 1 1 30 18642 1 1 5 THR CA C -10.643 -2.686 0.962 1.00 . A A . 5 THR CA 1 1 30 18643 1 1 5 THR CB C -9.908 -2.128 2.185 1.00 . A A . 5 THR CB 1 1 30 18644 1 1 5 THR CG2 C -9.885 -0.616 2.229 1.00 . A A . 5 THR CG2 1 1 30 18645 1 1 5 THR H H -12.454 -3.771 1.136 1.00 . A A . 5 THR H 1 1 30 18646 1 1 5 THR HA H -11.274 -1.914 0.548 1.00 . A A . 5 THR HA 1 1 30 18647 1 1 5 THR HB H -8.884 -2.474 2.167 1.00 . A A . 5 THR HB 1 1 30 18648 1 1 5 THR HG1 H -11.457 -2.430 3.346 1.00 . A A . 5 THR HG1 1 1 30 18649 1 1 5 THR HG21 H -10.061 -0.224 1.238 1.00 . A A . 5 THR HG21 1 1 30 18650 1 1 5 THR HG22 H -10.657 -0.264 2.898 1.00 . A A . 5 THR HG22 1 1 30 18651 1 1 5 THR HG23 H -8.921 -0.281 2.583 1.00 . A A . 5 THR HG23 1 1 30 18652 1 1 5 THR N N -11.497 -3.806 1.345 1.00 . A A . 5 THR N 1 1 30 18653 1 1 5 THR O O -8.736 -3.912 0.175 1.00 . A A . 5 THR O 1 1 30 18654 1 1 5 THR OG1 O -10.510 -2.583 3.384 1.00 . A A . 5 THR OG1 1 1 30 18655 1 1 6 THR C C -8.059 -1.759 -2.822 1.00 . A A . 6 THR C 1 1 30 18656 1 1 6 THR CA C -8.918 -2.953 -2.418 1.00 . A A . 6 THR CA 1 1 30 18657 1 1 6 THR CB C -9.728 -3.442 -3.619 1.00 . A A . 6 THR CB 1 1 30 18658 1 1 6 THR CG2 C -10.212 -4.868 -3.475 1.00 . A A . 6 THR CG2 1 1 30 18659 1 1 6 THR H H -10.549 -1.990 -1.473 1.00 . A A . 6 THR H 1 1 30 18660 1 1 6 THR HA H -8.270 -3.750 -2.085 1.00 . A A . 6 THR HA 1 1 30 18661 1 1 6 THR HB H -9.108 -3.391 -4.503 1.00 . A A . 6 THR HB 1 1 30 18662 1 1 6 THR HG1 H -11.068 -2.585 -4.762 1.00 . A A . 6 THR HG1 1 1 30 18663 1 1 6 THR HG21 H -9.517 -5.423 -2.861 1.00 . A A . 6 THR HG21 1 1 30 18664 1 1 6 THR HG22 H -11.186 -4.873 -3.009 1.00 . A A . 6 THR HG22 1 1 30 18665 1 1 6 THR HG23 H -10.277 -5.327 -4.450 1.00 . A A . 6 THR HG23 1 1 30 18666 1 1 6 THR N N -9.807 -2.610 -1.314 1.00 . A A . 6 THR N 1 1 30 18667 1 1 6 THR O O -8.486 -0.609 -2.715 1.00 . A A . 6 THR O 1 1 30 18668 1 1 6 THR OG1 O -10.864 -2.621 -3.825 1.00 . A A . 6 THR OG1 1 1 30 18669 1 1 7 GLY C C -4.493 -1.420 -3.697 1.00 . A A . 7 GLY C 1 1 30 18670 1 1 7 GLY CA C -5.946 -0.982 -3.701 1.00 . A A . 7 GLY CA 1 1 30 18671 1 1 7 GLY H H -6.561 -2.977 -3.350 1.00 . A A . 7 GLY H 1 1 30 18672 1 1 7 GLY HA2 H -6.059 -0.144 -3.030 1.00 . A A . 7 GLY HA2 1 1 30 18673 1 1 7 GLY HA3 H -6.212 -0.669 -4.700 1.00 . A A . 7 GLY HA3 1 1 30 18674 1 1 7 GLY N N -6.847 -2.041 -3.287 1.00 . A A . 7 GLY N 1 1 30 18675 1 1 7 GLY O O -4.203 -2.612 -3.598 1.00 . A A . 7 GLY O 1 1 30 18676 1 1 8 PRO C C -1.605 -1.253 -2.460 1.00 . A A . 8 PRO C 1 1 30 18677 1 1 8 PRO CA C -2.115 -0.777 -3.820 1.00 . A A . 8 PRO CA 1 1 30 18678 1 1 8 PRO CB C -1.470 0.559 -4.202 1.00 . A A . 8 PRO CB 1 1 30 18679 1 1 8 PRO CD C -3.807 0.977 -3.936 1.00 . A A . 8 PRO CD 1 1 30 18680 1 1 8 PRO CG C -2.447 1.591 -3.757 1.00 . A A . 8 PRO CG 1 1 30 18681 1 1 8 PRO HA H -1.878 -1.519 -4.568 1.00 . A A . 8 PRO HA 1 1 30 18682 1 1 8 PRO HB2 H -0.523 0.663 -3.695 1.00 . A A . 8 PRO HB2 1 1 30 18683 1 1 8 PRO HB3 H -1.319 0.596 -5.271 1.00 . A A . 8 PRO HB3 1 1 30 18684 1 1 8 PRO HD2 H -4.481 1.318 -3.164 1.00 . A A . 8 PRO HD2 1 1 30 18685 1 1 8 PRO HD3 H -4.201 1.212 -4.914 1.00 . A A . 8 PRO HD3 1 1 30 18686 1 1 8 PRO HG2 H -2.280 1.832 -2.718 1.00 . A A . 8 PRO HG2 1 1 30 18687 1 1 8 PRO HG3 H -2.352 2.475 -4.369 1.00 . A A . 8 PRO HG3 1 1 30 18688 1 1 8 PRO N N -3.549 -0.470 -3.808 1.00 . A A . 8 PRO N 1 1 30 18689 1 1 8 PRO O O -0.893 -2.254 -2.372 1.00 . A A . 8 PRO O 1 1 30 18690 1 1 9 CYS C C -2.040 -2.285 0.324 1.00 . A A . 9 CYS C 1 1 30 18691 1 1 9 CYS CA C -1.547 -0.891 -0.049 1.00 . A A . 9 CYS CA 1 1 30 18692 1 1 9 CYS CB C -2.066 0.137 0.961 1.00 . A A . 9 CYS CB 1 1 30 18693 1 1 9 CYS H H -2.540 0.254 -1.532 1.00 . A A . 9 CYS H 1 1 30 18694 1 1 9 CYS HA H -0.468 -0.887 -0.029 1.00 . A A . 9 CYS HA 1 1 30 18695 1 1 9 CYS HB2 H -2.684 0.853 0.445 1.00 . A A . 9 CYS HB2 1 1 30 18696 1 1 9 CYS HB3 H -2.659 -0.370 1.709 1.00 . A A . 9 CYS HB3 1 1 30 18697 1 1 9 CYS N N -1.971 -0.534 -1.402 1.00 . A A . 9 CYS N 1 1 30 18698 1 1 9 CYS O O -1.253 -3.224 0.439 1.00 . A A . 9 CYS O 1 1 30 18699 1 1 9 CYS SG S -0.756 1.063 1.825 1.00 . A A . 9 CYS SG 1 1 30 18700 1 1 10 CYS C C -3.577 -4.776 -0.133 1.00 . A A . 10 CYS C 1 1 30 18701 1 1 10 CYS CA C -3.949 -3.693 0.876 1.00 . A A . 10 CYS CA 1 1 30 18702 1 1 10 CYS CB C -5.472 -3.564 0.965 1.00 . A A . 10 CYS CB 1 1 30 18703 1 1 10 CYS H H -3.923 -1.627 0.410 1.00 . A A . 10 CYS H 1 1 30 18704 1 1 10 CYS HA H -3.565 -3.976 1.844 1.00 . A A . 10 CYS HA 1 1 30 18705 1 1 10 CYS HB2 H -5.912 -4.549 0.927 1.00 . A A . 10 CYS HB2 1 1 30 18706 1 1 10 CYS HB3 H -5.731 -3.097 1.905 1.00 . A A . 10 CYS HB3 1 1 30 18707 1 1 10 CYS N N -3.348 -2.413 0.514 1.00 . A A . 10 CYS N 1 1 30 18708 1 1 10 CYS O O -3.763 -4.607 -1.338 1.00 . A A . 10 CYS O 1 1 30 18709 1 1 10 CYS SG S -6.221 -2.574 -0.370 1.00 . A A . 10 CYS SG 1 1 30 18710 1 1 11 ARG C C -3.821 -7.516 -1.307 1.00 . A A . 11 ARG C 1 1 30 18711 1 1 11 ARG CA C -2.646 -6.999 -0.486 1.00 . A A . 11 ARG CA 1 1 30 18712 1 1 11 ARG CB C -2.060 -8.133 0.357 1.00 . A A . 11 ARG CB 1 1 30 18713 1 1 11 ARG CD C -2.619 -10.141 1.761 1.00 . A A . 11 ARG CD 1 1 30 18714 1 1 11 ARG CG C -3.060 -8.756 1.318 1.00 . A A . 11 ARG CG 1 1 30 18715 1 1 11 ARG CZ C -4.402 -11.613 0.910 1.00 . A A . 11 ARG CZ 1 1 30 18716 1 1 11 ARG H H -2.923 -5.962 1.338 1.00 . A A . 11 ARG H 1 1 30 18717 1 1 11 ARG HA H -1.891 -6.639 -1.159 1.00 . A A . 11 ARG HA 1 1 30 18718 1 1 11 ARG HB2 H -1.698 -8.908 -0.303 1.00 . A A . 11 ARG HB2 1 1 30 18719 1 1 11 ARG HB3 H -1.232 -7.747 0.933 1.00 . A A . 11 ARG HB3 1 1 30 18720 1 1 11 ARG HD2 H -1.949 -10.547 1.017 1.00 . A A . 11 ARG HD2 1 1 30 18721 1 1 11 ARG HD3 H -2.098 -10.055 2.704 1.00 . A A . 11 ARG HD3 1 1 30 18722 1 1 11 ARG HE H -4.041 -11.252 2.839 1.00 . A A . 11 ARG HE 1 1 30 18723 1 1 11 ARG HG2 H -3.151 -8.123 2.188 1.00 . A A . 11 ARG HG2 1 1 30 18724 1 1 11 ARG HG3 H -4.018 -8.833 0.825 1.00 . A A . 11 ARG HG3 1 1 30 18725 1 1 11 ARG HH11 H -3.270 -10.751 -0.528 1.00 . A A . 11 ARG HH11 1 1 30 18726 1 1 11 ARG HH12 H -4.531 -11.790 -1.100 1.00 . A A . 11 ARG HH12 1 1 30 18727 1 1 11 ARG HH21 H -5.699 -12.620 2.088 1.00 . A A . 11 ARG HH21 1 1 30 18728 1 1 11 ARG HH22 H -5.911 -12.852 0.385 1.00 . A A . 11 ARG HH22 1 1 30 18729 1 1 11 ARG N N -3.048 -5.888 0.369 1.00 . A A . 11 ARG N 1 1 30 18730 1 1 11 ARG NE N -3.751 -11.050 1.925 1.00 . A A . 11 ARG NE 1 1 30 18731 1 1 11 ARG NH1 N -4.038 -11.364 -0.342 1.00 . A A . 11 ARG NH1 1 1 30 18732 1 1 11 ARG NH2 N -5.421 -12.429 1.147 1.00 . A A . 11 ARG NH2 1 1 30 18733 1 1 11 ARG O O -3.642 -8.041 -2.405 1.00 . A A . 11 ARG O 1 1 30 18734 1 1 12 GLN C C -7.434 -7.636 -0.493 1.00 . A A . 12 GLN C 1 1 30 18735 1 1 12 GLN CA C -6.241 -7.803 -1.426 1.00 . A A . 12 GLN CA 1 1 30 18736 1 1 12 GLN CB C -6.121 -9.269 -1.859 1.00 . A A . 12 GLN CB 1 1 30 18737 1 1 12 GLN CD C -7.124 -10.850 -3.557 1.00 . A A . 12 GLN CD 1 1 30 18738 1 1 12 GLN CG C -7.397 -9.835 -2.463 1.00 . A A . 12 GLN CG 1 1 30 18739 1 1 12 GLN H H -5.087 -6.929 0.115 1.00 . A A . 12 GLN H 1 1 30 18740 1 1 12 GLN HA H -6.389 -7.186 -2.300 1.00 . A A . 12 GLN HA 1 1 30 18741 1 1 12 GLN HB2 H -5.336 -9.354 -2.594 1.00 . A A . 12 GLN HB2 1 1 30 18742 1 1 12 GLN HB3 H -5.861 -9.867 -0.998 1.00 . A A . 12 GLN HB3 1 1 30 18743 1 1 12 GLN HE21 H -9.069 -11.224 -3.729 1.00 . A A . 12 GLN HE21 1 1 30 18744 1 1 12 GLN HE22 H -8.036 -12.121 -4.784 1.00 . A A . 12 GLN HE22 1 1 30 18745 1 1 12 GLN HG2 H -7.968 -10.315 -1.683 1.00 . A A . 12 GLN HG2 1 1 30 18746 1 1 12 GLN HG3 H -7.973 -9.023 -2.882 1.00 . A A . 12 GLN HG3 1 1 30 18747 1 1 12 GLN N N -5.020 -7.359 -0.762 1.00 . A A . 12 GLN N 1 1 30 18748 1 1 12 GLN NE2 N -8.184 -11.460 -4.075 1.00 . A A . 12 GLN NE2 1 1 30 18749 1 1 12 GLN O O -8.558 -7.408 -0.938 1.00 . A A . 12 GLN O 1 1 30 18750 1 1 12 GLN OE1 O -5.975 -11.083 -3.931 1.00 . A A . 12 GLN OE1 1 1 30 18751 1 1 13 CYS C C -7.650 -7.188 3.158 1.00 . A A . 13 CYS C 1 1 30 18752 1 1 13 CYS CA C -8.226 -7.611 1.807 1.00 . A A . 13 CYS CA 1 1 30 18753 1 1 13 CYS CB C -8.996 -8.927 1.953 1.00 . A A . 13 CYS CB 1 1 30 18754 1 1 13 CYS H H -6.255 -7.932 1.096 1.00 . A A . 13 CYS H 1 1 30 18755 1 1 13 CYS HA H -8.906 -6.846 1.466 1.00 . A A . 13 CYS HA 1 1 30 18756 1 1 13 CYS HB2 H -9.326 -9.252 0.978 1.00 . A A . 13 CYS HB2 1 1 30 18757 1 1 13 CYS HB3 H -8.338 -9.675 2.372 1.00 . A A . 13 CYS HB3 1 1 30 18758 1 1 13 CYS N N -7.175 -7.750 0.805 1.00 . A A . 13 CYS N 1 1 30 18759 1 1 13 CYS O O -8.261 -7.419 4.202 1.00 . A A . 13 CYS O 1 1 30 18760 1 1 13 CYS SG S -10.467 -8.818 3.025 1.00 . A A . 13 CYS SG 1 1 30 18761 1 1 14 LYS C C -4.685 -5.168 4.061 1.00 . A A . 14 LYS C 1 1 30 18762 1 1 14 LYS CA C -5.836 -6.117 4.367 1.00 . A A . 14 LYS CA 1 1 30 18763 1 1 14 LYS CB C -5.326 -7.315 5.170 1.00 . A A . 14 LYS CB 1 1 30 18764 1 1 14 LYS CD C -4.793 -8.192 7.463 1.00 . A A . 14 LYS CD 1 1 30 18765 1 1 14 LYS CE C -5.267 -7.899 8.878 1.00 . A A . 14 LYS CE 1 1 30 18766 1 1 14 LYS CG C -4.883 -6.959 6.579 1.00 . A A . 14 LYS CG 1 1 30 18767 1 1 14 LYS H H -6.026 -6.403 2.282 1.00 . A A . 14 LYS H 1 1 30 18768 1 1 14 LYS HA H -6.575 -5.591 4.952 1.00 . A A . 14 LYS HA 1 1 30 18769 1 1 14 LYS HB2 H -6.114 -8.050 5.238 1.00 . A A . 14 LYS HB2 1 1 30 18770 1 1 14 LYS HB3 H -4.485 -7.750 4.650 1.00 . A A . 14 LYS HB3 1 1 30 18771 1 1 14 LYS HD2 H -5.410 -8.971 7.042 1.00 . A A . 14 LYS HD2 1 1 30 18772 1 1 14 LYS HD3 H -3.765 -8.523 7.499 1.00 . A A . 14 LYS HD3 1 1 30 18773 1 1 14 LYS HE2 H -6.288 -7.550 8.836 1.00 . A A . 14 LYS HE2 1 1 30 18774 1 1 14 LYS HE3 H -5.223 -8.811 9.454 1.00 . A A . 14 LYS HE3 1 1 30 18775 1 1 14 LYS HG2 H -3.911 -6.490 6.533 1.00 . A A . 14 LYS HG2 1 1 30 18776 1 1 14 LYS HG3 H -5.597 -6.271 7.008 1.00 . A A . 14 LYS HG3 1 1 30 18777 1 1 14 LYS HZ1 H -4.389 -6.005 8.957 1.00 . A A . 14 LYS HZ1 1 1 30 18778 1 1 14 LYS HZ2 H -4.830 -6.620 10.470 1.00 . A A . 14 LYS HZ2 1 1 30 18779 1 1 14 LYS HZ3 H -3.460 -7.221 9.678 1.00 . A A . 14 LYS HZ3 1 1 30 18780 1 1 14 LYS N N -6.474 -6.566 3.138 1.00 . A A . 14 LYS N 1 1 30 18781 1 1 14 LYS NZ N -4.428 -6.864 9.542 1.00 . A A . 14 LYS NZ 1 1 30 18782 1 1 14 LYS O O -3.702 -5.555 3.428 1.00 . A A . 14 LYS O 1 1 30 18783 1 1 15 LEU C C -2.395 -3.491 4.583 1.00 . A A . 15 LEU C 1 1 30 18784 1 1 15 LEU CA C -3.778 -2.915 4.297 1.00 . A A . 15 LEU CA 1 1 30 18785 1 1 15 LEU CB C -4.028 -1.693 5.185 1.00 . A A . 15 LEU CB 1 1 30 18786 1 1 15 LEU CD1 C -3.939 -1.179 7.641 1.00 . A A . 15 LEU CD1 1 1 30 18787 1 1 15 LEU CD2 C -6.125 -1.738 6.561 1.00 . A A . 15 LEU CD2 1 1 30 18788 1 1 15 LEU CG C -4.626 -2.001 6.561 1.00 . A A . 15 LEU CG 1 1 30 18789 1 1 15 LEU H H -5.618 -3.679 5.017 1.00 . A A . 15 LEU H 1 1 30 18790 1 1 15 LEU HA H -3.824 -2.614 3.262 1.00 . A A . 15 LEU HA 1 1 30 18791 1 1 15 LEU HB2 H -3.086 -1.183 5.329 1.00 . A A . 15 LEU HB2 1 1 30 18792 1 1 15 LEU HB3 H -4.701 -1.029 4.665 1.00 . A A . 15 LEU HB3 1 1 30 18793 1 1 15 LEU HD11 H -3.944 -0.137 7.358 1.00 . A A . 15 LEU HD11 1 1 30 18794 1 1 15 LEU HD12 H -4.467 -1.300 8.576 1.00 . A A . 15 LEU HD12 1 1 30 18795 1 1 15 LEU HD13 H -2.920 -1.516 7.756 1.00 . A A . 15 LEU HD13 1 1 30 18796 1 1 15 LEU HD21 H -6.367 -1.033 5.780 1.00 . A A . 15 LEU HD21 1 1 30 18797 1 1 15 LEU HD22 H -6.653 -2.664 6.387 1.00 . A A . 15 LEU HD22 1 1 30 18798 1 1 15 LEU HD23 H -6.420 -1.331 7.517 1.00 . A A . 15 LEU HD23 1 1 30 18799 1 1 15 LEU HG H -4.469 -3.045 6.788 1.00 . A A . 15 LEU HG 1 1 30 18800 1 1 15 LEU N N -4.812 -3.924 4.518 1.00 . A A . 15 LEU N 1 1 30 18801 1 1 15 LEU O O -2.105 -3.899 5.707 1.00 . A A . 15 LEU O 1 1 30 18802 1 1 16 LYS C C 0.465 -3.580 4.981 1.00 . A A . 16 LYS C 1 1 30 18803 1 1 16 LYS CA C -0.199 -4.073 3.695 1.00 . A A . 16 LYS CA 1 1 30 18804 1 1 16 LYS CB C 0.657 -3.688 2.486 1.00 . A A . 16 LYS CB 1 1 30 18805 1 1 16 LYS CD C 1.311 -4.249 0.126 1.00 . A A . 16 LYS CD 1 1 30 18806 1 1 16 LYS CE C 0.683 -4.943 -1.072 1.00 . A A . 16 LYS CE 1 1 30 18807 1 1 16 LYS CG C 0.752 -4.782 1.435 1.00 . A A . 16 LYS CG 1 1 30 18808 1 1 16 LYS H H -1.842 -3.201 2.680 1.00 . A A . 16 LYS H 1 1 30 18809 1 1 16 LYS HA H -0.284 -5.150 3.735 1.00 . A A . 16 LYS HA 1 1 30 18810 1 1 16 LYS HB2 H 0.234 -2.809 2.024 1.00 . A A . 16 LYS HB2 1 1 30 18811 1 1 16 LYS HB3 H 1.657 -3.459 2.825 1.00 . A A . 16 LYS HB3 1 1 30 18812 1 1 16 LYS HD2 H 1.108 -3.190 0.063 1.00 . A A . 16 LYS HD2 1 1 30 18813 1 1 16 LYS HD3 H 2.378 -4.415 0.108 1.00 . A A . 16 LYS HD3 1 1 30 18814 1 1 16 LYS HE2 H 0.322 -5.912 -0.762 1.00 . A A . 16 LYS HE2 1 1 30 18815 1 1 16 LYS HE3 H -0.147 -4.346 -1.423 1.00 . A A . 16 LYS HE3 1 1 30 18816 1 1 16 LYS HG2 H 1.400 -5.564 1.800 1.00 . A A . 16 LYS HG2 1 1 30 18817 1 1 16 LYS HG3 H -0.235 -5.183 1.257 1.00 . A A . 16 LYS HG3 1 1 30 18818 1 1 16 LYS HZ1 H 2.628 -5.125 -1.812 1.00 . A A . 16 LYS HZ1 1 1 30 18819 1 1 16 LYS HZ2 H 1.480 -6.023 -2.672 1.00 . A A . 16 LYS HZ2 1 1 30 18820 1 1 16 LYS HZ3 H 1.563 -4.346 -2.870 1.00 . A A . 16 LYS HZ3 1 1 30 18821 1 1 16 LYS N N -1.549 -3.533 3.555 1.00 . A A . 16 LYS N 1 1 30 18822 1 1 16 LYS NZ N 1.656 -5.122 -2.184 1.00 . A A . 16 LYS NZ 1 1 30 18823 1 1 16 LYS O O 0.141 -2.505 5.484 1.00 . A A . 16 LYS O 1 1 30 18824 1 1 17 PRO C C 2.951 -2.743 6.609 1.00 . A A . 17 PRO C 1 1 30 18825 1 1 17 PRO CA C 2.112 -4.006 6.767 1.00 . A A . 17 PRO CA 1 1 30 18826 1 1 17 PRO CB C 3.013 -5.215 7.038 1.00 . A A . 17 PRO CB 1 1 30 18827 1 1 17 PRO CD C 1.852 -5.665 5.001 1.00 . A A . 17 PRO CD 1 1 30 18828 1 1 17 PRO CG C 3.148 -5.900 5.721 1.00 . A A . 17 PRO CG 1 1 30 18829 1 1 17 PRO HA H 1.424 -3.876 7.590 1.00 . A A . 17 PRO HA 1 1 30 18830 1 1 17 PRO HB2 H 3.971 -4.877 7.407 1.00 . A A . 17 PRO HB2 1 1 30 18831 1 1 17 PRO HB3 H 2.547 -5.858 7.769 1.00 . A A . 17 PRO HB3 1 1 30 18832 1 1 17 PRO HD2 H 2.016 -5.610 3.934 1.00 . A A . 17 PRO HD2 1 1 30 18833 1 1 17 PRO HD3 H 1.141 -6.443 5.237 1.00 . A A . 17 PRO HD3 1 1 30 18834 1 1 17 PRO HG2 H 3.969 -5.470 5.166 1.00 . A A . 17 PRO HG2 1 1 30 18835 1 1 17 PRO HG3 H 3.308 -6.957 5.871 1.00 . A A . 17 PRO HG3 1 1 30 18836 1 1 17 PRO N N 1.405 -4.366 5.533 1.00 . A A . 17 PRO N 1 1 30 18837 1 1 17 PRO O O 3.748 -2.627 5.678 1.00 . A A . 17 PRO O 1 1 30 18838 1 1 18 ALA C C 5.010 -0.790 7.356 1.00 . A A . 18 ALA C 1 1 30 18839 1 1 18 ALA CA C 3.511 -0.542 7.496 1.00 . A A . 18 ALA CA 1 1 30 18840 1 1 18 ALA CB C 3.224 0.271 8.749 1.00 . A A . 18 ALA CB 1 1 30 18841 1 1 18 ALA H H 2.121 -1.949 8.246 1.00 . A A . 18 ALA H 1 1 30 18842 1 1 18 ALA HA H 3.168 0.025 6.643 1.00 . A A . 18 ALA HA 1 1 30 18843 1 1 18 ALA HB1 H 3.862 -0.068 9.552 1.00 . A A . 18 ALA HB1 1 1 30 18844 1 1 18 ALA HB2 H 3.417 1.316 8.553 1.00 . A A . 18 ALA HB2 1 1 30 18845 1 1 18 ALA HB3 H 2.190 0.144 9.033 1.00 . A A . 18 ALA HB3 1 1 30 18846 1 1 18 ALA N N 2.769 -1.798 7.528 1.00 . A A . 18 ALA N 1 1 30 18847 1 1 18 ALA O O 5.650 -1.317 8.265 1.00 . A A . 18 ALA O 1 1 30 18848 1 1 19 GLY C C 7.245 -1.614 4.869 1.00 . A A . 19 GLY C 1 1 30 18849 1 1 19 GLY CA C 6.980 -0.601 5.967 1.00 . A A . 19 GLY CA 1 1 30 18850 1 1 19 GLY H H 5.001 0.004 5.519 1.00 . A A . 19 GLY H 1 1 30 18851 1 1 19 GLY HA2 H 7.447 -0.944 6.878 1.00 . A A . 19 GLY HA2 1 1 30 18852 1 1 19 GLY HA3 H 7.417 0.344 5.683 1.00 . A A . 19 GLY HA3 1 1 30 18853 1 1 19 GLY N N 5.562 -0.409 6.209 1.00 . A A . 19 GLY N 1 1 30 18854 1 1 19 GLY O O 8.301 -2.246 4.840 1.00 . A A . 19 GLY O 1 1 30 18855 1 1 20 THR C C 5.938 -2.078 1.553 1.00 . A A . 20 THR C 1 1 30 18856 1 1 20 THR CA C 6.414 -2.708 2.859 1.00 . A A . 20 THR CA 1 1 30 18857 1 1 20 THR CB C 5.613 -3.979 3.150 1.00 . A A . 20 THR CB 1 1 30 18858 1 1 20 THR CG2 C 5.677 -5.001 2.035 1.00 . A A . 20 THR CG2 1 1 30 18859 1 1 20 THR H H 5.465 -1.234 4.042 1.00 . A A . 20 THR H 1 1 30 18860 1 1 20 THR HA H 7.459 -2.965 2.762 1.00 . A A . 20 THR HA 1 1 30 18861 1 1 20 THR HB H 4.575 -3.712 3.293 1.00 . A A . 20 THR HB 1 1 30 18862 1 1 20 THR HG1 H 5.819 -4.082 5.095 1.00 . A A . 20 THR HG1 1 1 30 18863 1 1 20 THR HG21 H 6.074 -4.538 1.144 1.00 . A A . 20 THR HG21 1 1 30 18864 1 1 20 THR HG22 H 6.319 -5.818 2.332 1.00 . A A . 20 THR HG22 1 1 30 18865 1 1 20 THR HG23 H 4.685 -5.377 1.834 1.00 . A A . 20 THR HG23 1 1 30 18866 1 1 20 THR N N 6.283 -1.767 3.964 1.00 . A A . 20 THR N 1 1 30 18867 1 1 20 THR O O 4.905 -1.411 1.516 1.00 . A A . 20 THR O 1 1 30 18868 1 1 20 THR OG1 O 6.078 -4.605 4.332 1.00 . A A . 20 THR OG1 1 1 30 18869 1 1 21 THR C C 4.960 -2.207 -1.251 1.00 . A A . 21 THR C 1 1 30 18870 1 1 21 THR CA C 6.350 -1.746 -0.824 1.00 . A A . 21 THR CA 1 1 30 18871 1 1 21 THR CB C 7.387 -2.157 -1.872 1.00 . A A . 21 THR CB 1 1 30 18872 1 1 21 THR CG2 C 8.057 -0.974 -2.536 1.00 . A A . 21 THR CG2 1 1 30 18873 1 1 21 THR H H 7.510 -2.835 0.574 1.00 . A A . 21 THR H 1 1 30 18874 1 1 21 THR HA H 6.346 -0.669 -0.740 1.00 . A A . 21 THR HA 1 1 30 18875 1 1 21 THR HB H 6.898 -2.735 -2.644 1.00 . A A . 21 THR HB 1 1 30 18876 1 1 21 THR HG1 H 8.954 -2.415 -0.724 1.00 . A A . 21 THR HG1 1 1 30 18877 1 1 21 THR HG21 H 7.728 -0.062 -2.059 1.00 . A A . 21 THR HG21 1 1 30 18878 1 1 21 THR HG22 H 9.129 -1.065 -2.438 1.00 . A A . 21 THR HG22 1 1 30 18879 1 1 21 THR HG23 H 7.792 -0.949 -3.582 1.00 . A A . 21 THR HG23 1 1 30 18880 1 1 21 THR N N 6.698 -2.294 0.483 1.00 . A A . 21 THR N 1 1 30 18881 1 1 21 THR O O 4.670 -3.403 -1.271 1.00 . A A . 21 THR O 1 1 30 18882 1 1 21 THR OG1 O 8.403 -2.958 -1.293 1.00 . A A . 21 THR OG1 1 1 30 18883 1 1 22 CYS C C 2.550 -1.301 -3.494 1.00 . A A . 22 CYS C 1 1 30 18884 1 1 22 CYS CA C 2.741 -1.554 -2.004 1.00 . A A . 22 CYS CA 1 1 30 18885 1 1 22 CYS CB C 1.742 -0.713 -1.211 1.00 . A A . 22 CYS CB 1 1 30 18886 1 1 22 CYS H H 4.392 -0.313 -1.544 1.00 . A A . 22 CYS H 1 1 30 18887 1 1 22 CYS HA H 2.558 -2.598 -1.802 1.00 . A A . 22 CYS HA 1 1 30 18888 1 1 22 CYS HB2 H 0.741 -0.997 -1.497 1.00 . A A . 22 CYS HB2 1 1 30 18889 1 1 22 CYS HB3 H 1.878 -0.904 -0.157 1.00 . A A . 22 CYS HB3 1 1 30 18890 1 1 22 CYS N N 4.103 -1.248 -1.585 1.00 . A A . 22 CYS N 1 1 30 18891 1 1 22 CYS O O 1.727 -1.947 -4.141 1.00 . A A . 22 CYS O 1 1 30 18892 1 1 22 CYS SG S 1.902 1.084 -1.477 1.00 . A A . 22 CYS SG 1 1 30 18893 1 1 23 TRP C C 4.368 -0.557 -6.245 1.00 . A A . 23 TRP C 1 1 30 18894 1 1 23 TRP CA C 3.197 -0.008 -5.443 1.00 . A A . 23 TRP CA 1 1 30 18895 1 1 23 TRP CB C 3.110 1.510 -5.617 1.00 . A A . 23 TRP CB 1 1 30 18896 1 1 23 TRP CD1 C 1.370 1.133 -7.459 1.00 . A A . 23 TRP CD1 1 1 30 18897 1 1 23 TRP CD2 C 1.581 3.265 -6.813 1.00 . A A . 23 TRP CD2 1 1 30 18898 1 1 23 TRP CE2 C 0.599 3.194 -7.818 1.00 . A A . 23 TRP CE2 1 1 30 18899 1 1 23 TRP CE3 C 1.885 4.509 -6.254 1.00 . A A . 23 TRP CE3 1 1 30 18900 1 1 23 TRP CG C 2.059 1.935 -6.595 1.00 . A A . 23 TRP CG 1 1 30 18901 1 1 23 TRP CH2 C 0.238 5.523 -7.711 1.00 . A A . 23 TRP CH2 1 1 30 18902 1 1 23 TRP CZ2 C -0.080 4.318 -8.274 1.00 . A A . 23 TRP CZ2 1 1 30 18903 1 1 23 TRP CZ3 C 1.211 5.625 -6.710 1.00 . A A . 23 TRP CZ3 1 1 30 18904 1 1 23 TRP H H 3.936 0.142 -3.465 1.00 . A A . 23 TRP H 1 1 30 18905 1 1 23 TRP HA H 2.290 -0.451 -5.816 1.00 . A A . 23 TRP HA 1 1 30 18906 1 1 23 TRP HB2 H 2.881 1.962 -4.664 1.00 . A A . 23 TRP HB2 1 1 30 18907 1 1 23 TRP HB3 H 4.062 1.883 -5.967 1.00 . A A . 23 TRP HB3 1 1 30 18908 1 1 23 TRP HD1 H 1.509 0.066 -7.538 1.00 . A A . 23 TRP HD1 1 1 30 18909 1 1 23 TRP HE1 H -0.122 1.536 -8.880 1.00 . A A . 23 TRP HE1 1 1 30 18910 1 1 23 TRP HE3 H 2.633 4.606 -5.481 1.00 . A A . 23 TRP HE3 1 1 30 18911 1 1 23 TRP HH2 H -0.261 6.420 -8.039 1.00 . A A . 23 TRP HH2 1 1 30 18912 1 1 23 TRP HZ2 H -0.834 4.256 -9.042 1.00 . A A . 23 TRP HZ2 1 1 30 18913 1 1 23 TRP HZ3 H 1.433 6.596 -6.291 1.00 . A A . 23 TRP HZ3 1 1 30 18914 1 1 23 TRP N N 3.303 -0.349 -4.031 1.00 . A A . 23 TRP N 1 1 30 18915 1 1 23 TRP NE1 N 0.487 1.883 -8.196 1.00 . A A . 23 TRP NE1 1 1 30 18916 1 1 23 TRP O O 4.219 -1.514 -7.006 1.00 . A A . 23 TRP O 1 1 30 18917 1 1 24 LYS C C 6.484 -0.316 -8.310 1.00 . A A . 24 LYS C 1 1 30 18918 1 1 24 LYS CA C 6.723 -0.359 -6.803 1.00 . A A . 24 LYS CA 1 1 30 18919 1 1 24 LYS CB C 7.132 -1.770 -6.377 1.00 . A A . 24 LYS CB 1 1 30 18920 1 1 24 LYS CD C 9.196 -3.163 -6.041 1.00 . A A . 24 LYS CD 1 1 30 18921 1 1 24 LYS CE C 10.698 -2.941 -6.116 1.00 . A A . 24 LYS CE 1 1 30 18922 1 1 24 LYS CG C 8.448 -2.231 -6.981 1.00 . A A . 24 LYS CG 1 1 30 18923 1 1 24 LYS H H 5.581 0.820 -5.467 1.00 . A A . 24 LYS H 1 1 30 18924 1 1 24 LYS HA H 7.519 0.327 -6.556 1.00 . A A . 24 LYS HA 1 1 30 18925 1 1 24 LYS HB2 H 7.225 -1.796 -5.301 1.00 . A A . 24 LYS HB2 1 1 30 18926 1 1 24 LYS HB3 H 6.360 -2.462 -6.679 1.00 . A A . 24 LYS HB3 1 1 30 18927 1 1 24 LYS HD2 H 8.865 -2.980 -5.029 1.00 . A A . 24 LYS HD2 1 1 30 18928 1 1 24 LYS HD3 H 8.977 -4.185 -6.314 1.00 . A A . 24 LYS HD3 1 1 30 18929 1 1 24 LYS HE2 H 11.196 -3.888 -5.970 1.00 . A A . 24 LYS HE2 1 1 30 18930 1 1 24 LYS HE3 H 10.943 -2.553 -7.093 1.00 . A A . 24 LYS HE3 1 1 30 18931 1 1 24 LYS HG2 H 8.246 -2.754 -7.904 1.00 . A A . 24 LYS HG2 1 1 30 18932 1 1 24 LYS HG3 H 9.063 -1.366 -7.181 1.00 . A A . 24 LYS HG3 1 1 30 18933 1 1 24 LYS HZ1 H 10.508 -1.183 -5.003 1.00 . A A . 24 LYS HZ1 1 1 30 18934 1 1 24 LYS HZ2 H 11.233 -2.455 -4.156 1.00 . A A . 24 LYS HZ2 1 1 30 18935 1 1 24 LYS HZ3 H 12.110 -1.616 -5.334 1.00 . A A . 24 LYS HZ3 1 1 30 18936 1 1 24 LYS N N 5.529 0.061 -6.081 1.00 . A A . 24 LYS N 1 1 30 18937 1 1 24 LYS NZ N 11.170 -1.982 -5.080 1.00 . A A . 24 LYS NZ 1 1 30 18938 1 1 24 LYS O O 7.063 -1.100 -9.063 1.00 . A A . 24 LYS O 1 1 30 18939 1 1 25 THR C C 6.575 0.915 -10.994 1.00 . A A . 25 THR C 1 1 30 18940 1 1 25 THR CA C 5.303 0.747 -10.163 1.00 . A A . 25 THR CA 1 1 30 18941 1 1 25 THR CB C 4.357 1.934 -10.382 1.00 . A A . 25 THR CB 1 1 30 18942 1 1 25 THR CG2 C 5.016 3.275 -10.151 1.00 . A A . 25 THR CG2 1 1 30 18943 1 1 25 THR H H 5.191 1.198 -8.096 1.00 . A A . 25 THR H 1 1 30 18944 1 1 25 THR HA H 4.805 -0.158 -10.478 1.00 . A A . 25 THR HA 1 1 30 18945 1 1 25 THR HB H 3.527 1.853 -9.692 1.00 . A A . 25 THR HB 1 1 30 18946 1 1 25 THR HG1 H 4.459 2.351 -12.298 1.00 . A A . 25 THR HG1 1 1 30 18947 1 1 25 THR HG21 H 5.988 3.121 -9.714 1.00 . A A . 25 THR HG21 1 1 30 18948 1 1 25 THR HG22 H 5.121 3.793 -11.093 1.00 . A A . 25 THR HG22 1 1 30 18949 1 1 25 THR HG23 H 4.408 3.865 -9.481 1.00 . A A . 25 THR HG23 1 1 30 18950 1 1 25 THR N N 5.623 0.604 -8.745 1.00 . A A . 25 THR N 1 1 30 18951 1 1 25 THR O O 7.672 1.043 -10.451 1.00 . A A . 25 THR O 1 1 30 18952 1 1 25 THR OG1 O 3.837 1.927 -11.702 1.00 . A A . 25 THR OG1 1 1 30 18953 1 1 26 SER C C 8.292 2.355 -13.045 1.00 . A A . 26 SER C 1 1 30 18954 1 1 26 SER CA C 7.552 1.029 -13.226 1.00 . A A . 26 SER CA 1 1 30 18955 1 1 26 SER CB C 7.076 0.899 -14.674 1.00 . A A . 26 SER CB 1 1 30 18956 1 1 26 SER H H 5.521 0.778 -12.685 1.00 . A A . 26 SER H 1 1 30 18957 1 1 26 SER HA H 8.237 0.222 -13.015 1.00 . A A . 26 SER HA 1 1 30 18958 1 1 26 SER HB2 H 7.722 1.478 -15.317 1.00 . A A . 26 SER HB2 1 1 30 18959 1 1 26 SER HB3 H 7.111 -0.139 -14.970 1.00 . A A . 26 SER HB3 1 1 30 18960 1 1 26 SER HG H 5.669 2.236 -14.411 1.00 . A A . 26 SER HG 1 1 30 18961 1 1 26 SER N N 6.420 0.897 -12.313 1.00 . A A . 26 SER N 1 1 30 18962 1 1 26 SER O O 9.435 2.493 -13.481 1.00 . A A . 26 SER O 1 1 30 18963 1 1 26 SER OG O 5.748 1.371 -14.819 1.00 . A A . 26 SER OG 1 1 30 18964 1 1 27 VAL C C 7.692 5.342 -10.976 1.00 . A A . 27 VAL C 1 1 30 18965 1 1 27 VAL CA C 8.271 4.635 -12.199 1.00 . A A . 27 VAL CA 1 1 30 18966 1 1 27 VAL CB C 8.102 5.546 -13.432 1.00 . A A . 27 VAL CB 1 1 30 18967 1 1 27 VAL CG1 C 8.909 6.825 -13.266 1.00 . A A . 27 VAL CG1 1 1 30 18968 1 1 27 VAL CG2 C 8.510 4.813 -14.701 1.00 . A A . 27 VAL CG2 1 1 30 18969 1 1 27 VAL H H 6.737 3.176 -12.084 1.00 . A A . 27 VAL H 1 1 30 18970 1 1 27 VAL HA H 9.327 4.475 -12.040 1.00 . A A . 27 VAL HA 1 1 30 18971 1 1 27 VAL HB H 7.059 5.814 -13.516 1.00 . A A . 27 VAL HB 1 1 30 18972 1 1 27 VAL HG11 H 9.758 6.635 -12.626 1.00 . A A . 27 VAL HG11 1 1 30 18973 1 1 27 VAL HG12 H 9.254 7.160 -14.233 1.00 . A A . 27 VAL HG12 1 1 30 18974 1 1 27 VAL HG13 H 8.286 7.588 -12.822 1.00 . A A . 27 VAL HG13 1 1 30 18975 1 1 27 VAL HG21 H 9.516 4.437 -14.592 1.00 . A A . 27 VAL HG21 1 1 30 18976 1 1 27 VAL HG22 H 7.834 3.989 -14.874 1.00 . A A . 27 VAL HG22 1 1 30 18977 1 1 27 VAL HG23 H 8.469 5.494 -15.538 1.00 . A A . 27 VAL HG23 1 1 30 18978 1 1 27 VAL N N 7.647 3.331 -12.411 1.00 . A A . 27 VAL N 1 1 30 18979 1 1 27 VAL O O 7.349 6.524 -11.033 1.00 . A A . 27 VAL O 1 1 30 18980 1 1 28 SER C C 6.823 4.076 -7.592 1.00 . A A . 28 SER C 1 1 30 18981 1 1 28 SER CA C 7.047 5.170 -8.631 1.00 . A A . 28 SER CA 1 1 30 18982 1 1 28 SER CB C 5.731 5.909 -8.900 1.00 . A A . 28 SER CB 1 1 30 18983 1 1 28 SER H H 7.874 3.676 -9.888 1.00 . A A . 28 SER H 1 1 30 18984 1 1 28 SER HA H 7.770 5.873 -8.244 1.00 . A A . 28 SER HA 1 1 30 18985 1 1 28 SER HB2 H 5.422 5.729 -9.919 1.00 . A A . 28 SER HB2 1 1 30 18986 1 1 28 SER HB3 H 4.970 5.547 -8.224 1.00 . A A . 28 SER HB3 1 1 30 18987 1 1 28 SER HG H 6.293 7.691 -9.488 1.00 . A A . 28 SER HG 1 1 30 18988 1 1 28 SER N N 7.585 4.613 -9.871 1.00 . A A . 28 SER N 1 1 30 18989 1 1 28 SER O O 5.758 3.460 -7.544 1.00 . A A . 28 SER O 1 1 30 18990 1 1 28 SER OG O 5.882 7.305 -8.711 1.00 . A A . 28 SER OG 1 1 30 18991 1 1 29 SER C C 7.378 3.444 -4.376 1.00 . A A . 29 SER C 1 1 30 18992 1 1 29 SER CA C 7.734 2.819 -5.721 1.00 . A A . 29 SER CA 1 1 30 18993 1 1 29 SER CB C 9.052 2.050 -5.608 1.00 . A A . 29 SER CB 1 1 30 18994 1 1 29 SER H H 8.654 4.362 -6.842 1.00 . A A . 29 SER H 1 1 30 18995 1 1 29 SER HA H 6.949 2.133 -6.004 1.00 . A A . 29 SER HA 1 1 30 18996 1 1 29 SER HB2 H 9.763 2.639 -5.047 1.00 . A A . 29 SER HB2 1 1 30 18997 1 1 29 SER HB3 H 8.877 1.114 -5.097 1.00 . A A . 29 SER HB3 1 1 30 18998 1 1 29 SER HG H 9.875 2.599 -7.299 1.00 . A A . 29 SER HG 1 1 30 18999 1 1 29 SER N N 7.830 3.839 -6.758 1.00 . A A . 29 SER N 1 1 30 19000 1 1 29 SER O O 8.149 4.226 -3.820 1.00 . A A . 29 SER O 1 1 30 19001 1 1 29 SER OG O 9.595 1.778 -6.888 1.00 . A A . 29 SER OG 1 1 30 19002 1 1 30 HIS C C 5.523 2.493 -1.576 1.00 . A A . 30 HIS C 1 1 30 19003 1 1 30 HIS CA C 5.745 3.620 -2.579 1.00 . A A . 30 HIS CA 1 1 30 19004 1 1 30 HIS CB C 4.451 4.413 -2.766 1.00 . A A . 30 HIS CB 1 1 30 19005 1 1 30 HIS CD2 C 4.990 5.329 -5.131 1.00 . A A . 30 HIS CD2 1 1 30 19006 1 1 30 HIS CE1 C 4.286 7.386 -4.847 1.00 . A A . 30 HIS CE1 1 1 30 19007 1 1 30 HIS CG C 4.526 5.429 -3.863 1.00 . A A . 30 HIS CG 1 1 30 19008 1 1 30 HIS H H 5.635 2.467 -4.350 1.00 . A A . 30 HIS H 1 1 30 19009 1 1 30 HIS HA H 6.510 4.280 -2.197 1.00 . A A . 30 HIS HA 1 1 30 19010 1 1 30 HIS HB2 H 3.649 3.730 -3.002 1.00 . A A . 30 HIS HB2 1 1 30 19011 1 1 30 HIS HB3 H 4.218 4.931 -1.847 1.00 . A A . 30 HIS HB3 1 1 30 19012 1 1 30 HIS HD1 H 3.702 7.115 -2.905 1.00 . A A . 30 HIS HD1 1 1 30 19013 1 1 30 HIS HD2 H 5.407 4.446 -5.591 1.00 . A A . 30 HIS HD2 1 1 30 19014 1 1 30 HIS HE1 H 4.042 8.422 -5.026 1.00 . A A . 30 HIS HE1 1 1 30 19015 1 1 30 HIS HE2 H 5.158 6.811 -6.609 1.00 . A A . 30 HIS HE2 1 1 30 19016 1 1 30 HIS N N 6.205 3.094 -3.859 1.00 . A A . 30 HIS N 1 1 30 19017 1 1 30 HIS ND1 N 4.093 6.730 -3.716 1.00 . A A . 30 HIS ND1 1 1 30 19018 1 1 30 HIS NE2 N 4.829 6.558 -5.721 1.00 . A A . 30 HIS NE2 1 1 30 19019 1 1 30 HIS O O 5.151 1.381 -1.948 1.00 . A A . 30 HIS O 1 1 30 19020 1 1 31 TYR C C 4.256 2.014 1.483 1.00 . A A . 31 TYR C 1 1 30 19021 1 1 31 TYR CA C 5.580 1.803 0.757 1.00 . A A . 31 TYR CA 1 1 30 19022 1 1 31 TYR CB C 6.739 1.883 1.752 1.00 . A A . 31 TYR CB 1 1 30 19023 1 1 31 TYR CD1 C 8.750 1.598 0.252 1.00 . A A . 31 TYR CD1 1 1 30 19024 1 1 31 TYR CD2 C 8.363 -0.040 1.939 1.00 . A A . 31 TYR CD2 1 1 30 19025 1 1 31 TYR CE1 C 9.879 0.915 -0.158 1.00 . A A . 31 TYR CE1 1 1 30 19026 1 1 31 TYR CE2 C 9.491 -0.729 1.536 1.00 . A A . 31 TYR CE2 1 1 30 19027 1 1 31 TYR CG C 7.974 1.133 1.306 1.00 . A A . 31 TYR CG 1 1 30 19028 1 1 31 TYR CZ C 10.245 -0.247 0.487 1.00 . A A . 31 TYR CZ 1 1 30 19029 1 1 31 TYR H H 6.049 3.695 -0.067 1.00 . A A . 31 TYR H 1 1 30 19030 1 1 31 TYR HA H 5.575 0.825 0.300 1.00 . A A . 31 TYR HA 1 1 30 19031 1 1 31 TYR HB2 H 7.013 2.918 1.892 1.00 . A A . 31 TYR HB2 1 1 30 19032 1 1 31 TYR HB3 H 6.421 1.468 2.697 1.00 . A A . 31 TYR HB3 1 1 30 19033 1 1 31 TYR HD1 H 8.461 2.509 -0.251 1.00 . A A . 31 TYR HD1 1 1 30 19034 1 1 31 TYR HD2 H 7.769 -0.415 2.759 1.00 . A A . 31 TYR HD2 1 1 30 19035 1 1 31 TYR HE1 H 10.470 1.293 -0.979 1.00 . A A . 31 TYR HE1 1 1 30 19036 1 1 31 TYR HE2 H 9.776 -1.639 2.042 1.00 . A A . 31 TYR HE2 1 1 30 19037 1 1 31 TYR HH H 12.107 -0.698 0.650 1.00 . A A . 31 TYR HH 1 1 30 19038 1 1 31 TYR N N 5.755 2.790 -0.302 1.00 . A A . 31 TYR N 1 1 30 19039 1 1 31 TYR O O 3.728 3.125 1.520 1.00 . A A . 31 TYR O 1 1 30 19040 1 1 31 TYR OH O 11.369 -0.930 0.082 1.00 . A A . 31 TYR OH 1 1 30 19041 1 1 32 CYS C C 2.703 1.451 4.227 1.00 . A A . 32 CYS C 1 1 30 19042 1 1 32 CYS CA C 2.467 1.013 2.789 1.00 . A A . 32 CYS CA 1 1 30 19043 1 1 32 CYS CB C 1.761 -0.344 2.769 1.00 . A A . 32 CYS CB 1 1 30 19044 1 1 32 CYS H H 4.193 0.084 2.002 1.00 . A A . 32 CYS H 1 1 30 19045 1 1 32 CYS HA H 1.840 1.744 2.299 1.00 . A A . 32 CYS HA 1 1 30 19046 1 1 32 CYS HB2 H 1.858 -0.777 1.785 1.00 . A A . 32 CYS HB2 1 1 30 19047 1 1 32 CYS HB3 H 2.231 -0.996 3.490 1.00 . A A . 32 CYS HB3 1 1 30 19048 1 1 32 CYS N N 3.726 0.942 2.062 1.00 . A A . 32 CYS N 1 1 30 19049 1 1 32 CYS O O 3.730 1.129 4.823 1.00 . A A . 32 CYS O 1 1 30 19050 1 1 32 CYS SG S -0.016 -0.269 3.166 1.00 . A A . 32 CYS SG 1 1 30 19051 1 1 33 THR C C 0.893 1.869 7.057 1.00 . A A . 33 THR C 1 1 30 19052 1 1 33 THR CA C 1.841 2.651 6.155 1.00 . A A . 33 THR CA 1 1 30 19053 1 1 33 THR CB C 1.520 4.145 6.229 1.00 . A A . 33 THR CB 1 1 30 19054 1 1 33 THR CG2 C 2.190 4.957 5.142 1.00 . A A . 33 THR CG2 1 1 30 19055 1 1 33 THR H H 0.945 2.396 4.257 1.00 . A A . 33 THR H 1 1 30 19056 1 1 33 THR HA H 2.855 2.491 6.491 1.00 . A A . 33 THR HA 1 1 30 19057 1 1 33 THR HB H 1.856 4.528 7.182 1.00 . A A . 33 THR HB 1 1 30 19058 1 1 33 THR HG1 H -0.296 4.131 6.960 1.00 . A A . 33 THR HG1 1 1 30 19059 1 1 33 THR HG21 H 2.942 4.354 4.654 1.00 . A A . 33 THR HG21 1 1 30 19060 1 1 33 THR HG22 H 1.452 5.268 4.417 1.00 . A A . 33 THR HG22 1 1 30 19061 1 1 33 THR HG23 H 2.656 5.829 5.578 1.00 . A A . 33 THR HG23 1 1 30 19062 1 1 33 THR N N 1.743 2.178 4.781 1.00 . A A . 33 THR N 1 1 30 19063 1 1 33 THR O O 0.552 2.317 8.151 1.00 . A A . 33 THR O 1 1 30 19064 1 1 33 THR OG1 O 0.124 4.363 6.129 1.00 . A A . 33 THR OG1 1 1 30 19065 1 1 34 GLY C C -1.601 0.659 7.943 1.00 . A A . 34 GLY C 1 1 30 19066 1 1 34 GLY CA C -0.444 -0.131 7.360 1.00 . A A . 34 GLY CA 1 1 30 19067 1 1 34 GLY H H 0.773 0.391 5.704 1.00 . A A . 34 GLY H 1 1 30 19068 1 1 34 GLY HA2 H 0.105 -0.592 8.169 1.00 . A A . 34 GLY HA2 1 1 30 19069 1 1 34 GLY HA3 H -0.839 -0.907 6.721 1.00 . A A . 34 GLY HA3 1 1 30 19070 1 1 34 GLY N N 0.466 0.696 6.586 1.00 . A A . 34 GLY N 1 1 30 19071 1 1 34 GLY O O -1.903 0.546 9.131 1.00 . A A . 34 GLY O 1 1 30 19072 1 1 35 ARG C C -4.560 2.162 6.605 1.00 . A A . 35 ARG C 1 1 30 19073 1 1 35 ARG CA C -3.371 2.284 7.552 1.00 . A A . 35 ARG CA 1 1 30 19074 1 1 35 ARG CB C -2.947 3.749 7.669 1.00 . A A . 35 ARG CB 1 1 30 19075 1 1 35 ARG CD C -3.298 4.651 9.988 1.00 . A A . 35 ARG CD 1 1 30 19076 1 1 35 ARG CG C -3.849 4.573 8.573 1.00 . A A . 35 ARG CG 1 1 30 19077 1 1 35 ARG CZ C -5.128 5.657 11.297 1.00 . A A . 35 ARG CZ 1 1 30 19078 1 1 35 ARG H H -1.957 1.520 6.172 1.00 . A A . 35 ARG H 1 1 30 19079 1 1 35 ARG HA H -3.668 1.930 8.525 1.00 . A A . 35 ARG HA 1 1 30 19080 1 1 35 ARG HB2 H -1.943 3.791 8.063 1.00 . A A . 35 ARG HB2 1 1 30 19081 1 1 35 ARG HB3 H -2.957 4.194 6.685 1.00 . A A . 35 ARG HB3 1 1 30 19082 1 1 35 ARG HD2 H -2.635 3.814 10.149 1.00 . A A . 35 ARG HD2 1 1 30 19083 1 1 35 ARG HD3 H -2.746 5.572 10.095 1.00 . A A . 35 ARG HD3 1 1 30 19084 1 1 35 ARG HE H -4.507 3.767 11.463 1.00 . A A . 35 ARG HE 1 1 30 19085 1 1 35 ARG HG2 H -3.927 5.573 8.173 1.00 . A A . 35 ARG HG2 1 1 30 19086 1 1 35 ARG HG3 H -4.828 4.117 8.602 1.00 . A A . 35 ARG HG3 1 1 30 19087 1 1 35 ARG HH11 H -4.248 6.916 9.981 1.00 . A A . 35 ARG HH11 1 1 30 19088 1 1 35 ARG HH12 H -5.538 7.599 10.913 1.00 . A A . 35 ARG HH12 1 1 30 19089 1 1 35 ARG HH21 H -6.204 4.664 12.690 1.00 . A A . 35 ARG HH21 1 1 30 19090 1 1 35 ARG HH22 H -6.648 6.321 12.452 1.00 . A A . 35 ARG HH22 1 1 30 19091 1 1 35 ARG N N -2.247 1.468 7.107 1.00 . A A . 35 ARG N 1 1 30 19092 1 1 35 ARG NE N -4.359 4.614 10.991 1.00 . A A . 35 ARG NE 1 1 30 19093 1 1 35 ARG NH1 N -4.957 6.819 10.679 1.00 . A A . 35 ARG NH1 1 1 30 19094 1 1 35 ARG NH2 N -6.070 5.537 12.222 1.00 . A A . 35 ARG NH2 1 1 30 19095 1 1 35 ARG O O -5.705 2.052 7.045 1.00 . A A . 35 ARG O 1 1 30 19096 1 1 36 SER C C -4.784 1.648 2.955 1.00 . A A . 36 SER C 1 1 30 19097 1 1 36 SER CA C -5.342 2.087 4.304 1.00 . A A . 36 SER CA 1 1 30 19098 1 1 36 SER CB C -6.061 3.429 4.157 1.00 . A A . 36 SER CB 1 1 30 19099 1 1 36 SER H H -3.355 2.282 5.018 1.00 . A A . 36 SER H 1 1 30 19100 1 1 36 SER HA H -6.051 1.347 4.643 1.00 . A A . 36 SER HA 1 1 30 19101 1 1 36 SER HB2 H -6.497 3.708 5.104 1.00 . A A . 36 SER HB2 1 1 30 19102 1 1 36 SER HB3 H -5.351 4.184 3.851 1.00 . A A . 36 SER HB3 1 1 30 19103 1 1 36 SER HG H -6.938 4.008 2.503 1.00 . A A . 36 SER HG 1 1 30 19104 1 1 36 SER N N -4.286 2.189 5.307 1.00 . A A . 36 SER N 1 1 30 19105 1 1 36 SER O O -3.572 1.523 2.783 1.00 . A A . 36 SER O 1 1 30 19106 1 1 36 SER OG O -7.092 3.352 3.187 1.00 . A A . 36 SER OG 1 1 30 19107 1 1 37 CYS C C -4.661 2.139 -0.120 1.00 . A A . 37 CYS C 1 1 30 19108 1 1 37 CYS CA C -5.287 0.988 0.665 1.00 . A A . 37 CYS CA 1 1 30 19109 1 1 37 CYS CB C -6.496 0.438 -0.094 1.00 . A A . 37 CYS CB 1 1 30 19110 1 1 37 CYS H H -6.633 1.533 2.205 1.00 . A A . 37 CYS H 1 1 30 19111 1 1 37 CYS HA H -4.555 0.203 0.772 1.00 . A A . 37 CYS HA 1 1 30 19112 1 1 37 CYS HB2 H -7.278 1.182 -0.099 1.00 . A A . 37 CYS HB2 1 1 30 19113 1 1 37 CYS HB3 H -6.205 0.223 -1.112 1.00 . A A . 37 CYS HB3 1 1 30 19114 1 1 37 CYS N N -5.681 1.415 2.002 1.00 . A A . 37 CYS N 1 1 30 19115 1 1 37 CYS O O -3.926 1.916 -1.083 1.00 . A A . 37 CYS O 1 1 30 19116 1 1 37 CYS SG S -7.191 -1.089 0.618 1.00 . A A . 37 CYS SG 1 1 30 19117 1 1 38 GLU C C -2.930 4.724 -0.054 1.00 . A A . 38 GLU C 1 1 30 19118 1 1 38 GLU CA C -4.411 4.545 -0.376 1.00 . A A . 38 GLU CA 1 1 30 19119 1 1 38 GLU CB C -5.189 5.796 0.038 1.00 . A A . 38 GLU CB 1 1 30 19120 1 1 38 GLU CD C -5.818 8.106 -0.766 1.00 . A A . 38 GLU CD 1 1 30 19121 1 1 38 GLU CG C -4.724 7.061 -0.663 1.00 . A A . 38 GLU CG 1 1 30 19122 1 1 38 GLU H H -5.543 3.486 1.067 1.00 . A A . 38 GLU H 1 1 30 19123 1 1 38 GLU HA H -4.521 4.400 -1.440 1.00 . A A . 38 GLU HA 1 1 30 19124 1 1 38 GLU HB2 H -6.235 5.647 -0.190 1.00 . A A . 38 GLU HB2 1 1 30 19125 1 1 38 GLU HB3 H -5.079 5.938 1.103 1.00 . A A . 38 GLU HB3 1 1 30 19126 1 1 38 GLU HG2 H -3.898 7.481 -0.108 1.00 . A A . 38 GLU HG2 1 1 30 19127 1 1 38 GLU HG3 H -4.395 6.806 -1.659 1.00 . A A . 38 GLU HG3 1 1 30 19128 1 1 38 GLU N N -4.952 3.368 0.294 1.00 . A A . 38 GLU N 1 1 30 19129 1 1 38 GLU O O -2.573 5.204 1.022 1.00 . A A . 38 GLU O 1 1 30 19130 1 1 38 GLU OE1 O -7.005 7.735 -0.659 1.00 . A A . 38 GLU OE1 1 1 30 19131 1 1 38 GLU OE2 O -5.487 9.296 -0.954 1.00 . A A . 38 GLU OE2 1 1 30 19132 1 1 39 CYS C C -0.173 5.897 -1.007 1.00 . A A . 39 CYS C 1 1 30 19133 1 1 39 CYS CA C -0.630 4.454 -0.806 1.00 . A A . 39 CYS CA 1 1 30 19134 1 1 39 CYS CB C 0.113 3.529 -1.774 1.00 . A A . 39 CYS CB 1 1 30 19135 1 1 39 CYS H H -2.416 3.960 -1.830 1.00 . A A . 39 CYS H 1 1 30 19136 1 1 39 CYS HA H -0.403 4.156 0.207 1.00 . A A . 39 CYS HA 1 1 30 19137 1 1 39 CYS HB2 H -0.295 3.657 -2.767 1.00 . A A . 39 CYS HB2 1 1 30 19138 1 1 39 CYS HB3 H 1.160 3.795 -1.784 1.00 . A A . 39 CYS HB3 1 1 30 19139 1 1 39 CYS N N -2.072 4.335 -0.992 1.00 . A A . 39 CYS N 1 1 30 19140 1 1 39 CYS O O -0.750 6.633 -1.807 1.00 . A A . 39 CYS O 1 1 30 19141 1 1 39 CYS SG S -0.009 1.761 -1.348 1.00 . A A . 39 CYS SG 1 1 30 19142 1 1 40 PRO C C 1.683 8.096 -1.823 1.00 . A A . 40 PRO C 1 1 30 19143 1 1 40 PRO CA C 1.405 7.687 -0.380 1.00 . A A . 40 PRO CA 1 1 30 19144 1 1 40 PRO CB C 2.709 7.620 0.417 1.00 . A A . 40 PRO CB 1 1 30 19145 1 1 40 PRO CD C 1.621 5.510 0.701 1.00 . A A . 40 PRO CD 1 1 30 19146 1 1 40 PRO CG C 2.498 6.516 1.394 1.00 . A A . 40 PRO CG 1 1 30 19147 1 1 40 PRO HA H 0.739 8.405 0.074 1.00 . A A . 40 PRO HA 1 1 30 19148 1 1 40 PRO HB2 H 3.532 7.407 -0.250 1.00 . A A . 40 PRO HB2 1 1 30 19149 1 1 40 PRO HB3 H 2.878 8.562 0.917 1.00 . A A . 40 PRO HB3 1 1 30 19150 1 1 40 PRO HD2 H 2.223 4.764 0.204 1.00 . A A . 40 PRO HD2 1 1 30 19151 1 1 40 PRO HD3 H 0.949 5.046 1.407 1.00 . A A . 40 PRO HD3 1 1 30 19152 1 1 40 PRO HG2 H 3.446 6.070 1.655 1.00 . A A . 40 PRO HG2 1 1 30 19153 1 1 40 PRO HG3 H 2.006 6.897 2.277 1.00 . A A . 40 PRO HG3 1 1 30 19154 1 1 40 PRO N N 0.874 6.323 -0.278 1.00 . A A . 40 PRO N 1 1 30 19155 1 1 40 PRO O O 1.716 7.255 -2.722 1.00 . A A . 40 PRO O 1 1 30 19156 1 1 41 SER C C 3.617 10.342 -3.496 1.00 . A A . 41 SER C 1 1 30 19157 1 1 41 SER CA C 2.158 9.914 -3.370 1.00 . A A . 41 SER CA 1 1 30 19158 1 1 41 SER CB C 1.239 11.097 -3.678 1.00 . A A . 41 SER CB 1 1 30 19159 1 1 41 SER H H 1.844 10.013 -1.279 1.00 . A A . 41 SER H 1 1 30 19160 1 1 41 SER HA H 1.965 9.124 -4.081 1.00 . A A . 41 SER HA 1 1 30 19161 1 1 41 SER HB2 H 1.642 11.991 -3.226 1.00 . A A . 41 SER HB2 1 1 30 19162 1 1 41 SER HB3 H 1.175 11.232 -4.748 1.00 . A A . 41 SER HB3 1 1 30 19163 1 1 41 SER HG H -0.552 11.704 -3.165 1.00 . A A . 41 SER HG 1 1 30 19164 1 1 41 SER N N 1.883 9.392 -2.036 1.00 . A A . 41 SER N 1 1 30 19165 1 1 41 SER O O 3.939 11.274 -4.233 1.00 . A A . 41 SER O 1 1 30 19166 1 1 41 SER OG O -0.065 10.877 -3.167 1.00 . A A . 41 SER OG 1 1 30 19167 1 1 42 TYR C C 6.753 8.706 -2.570 1.00 . A A . 42 TYR C 1 1 30 19168 1 1 42 TYR CA C 5.919 9.964 -2.803 1.00 . A A . 42 TYR CA 1 1 30 19169 1 1 42 TYR CB C 6.258 11.017 -1.746 1.00 . A A . 42 TYR CB 1 1 30 19170 1 1 42 TYR CD1 C 7.025 9.886 0.376 1.00 . A A . 42 TYR CD1 1 1 30 19171 1 1 42 TYR CD2 C 4.813 10.771 0.309 1.00 . A A . 42 TYR CD2 1 1 30 19172 1 1 42 TYR CE1 C 6.819 9.457 1.673 1.00 . A A . 42 TYR CE1 1 1 30 19173 1 1 42 TYR CE2 C 4.599 10.345 1.607 1.00 . A A . 42 TYR CE2 1 1 30 19174 1 1 42 TYR CG C 6.028 10.549 -0.327 1.00 . A A . 42 TYR CG 1 1 30 19175 1 1 42 TYR CZ C 5.605 9.689 2.284 1.00 . A A . 42 TYR CZ 1 1 30 19176 1 1 42 TYR H H 4.176 8.923 -2.203 1.00 . A A . 42 TYR H 1 1 30 19177 1 1 42 TYR HA H 6.151 10.359 -3.780 1.00 . A A . 42 TYR HA 1 1 30 19178 1 1 42 TYR HB2 H 7.298 11.290 -1.841 1.00 . A A . 42 TYR HB2 1 1 30 19179 1 1 42 TYR HB3 H 5.645 11.892 -1.912 1.00 . A A . 42 TYR HB3 1 1 30 19180 1 1 42 TYR HD1 H 7.976 9.707 -0.105 1.00 . A A . 42 TYR HD1 1 1 30 19181 1 1 42 TYR HD2 H 4.026 11.284 -0.224 1.00 . A A . 42 TYR HD2 1 1 30 19182 1 1 42 TYR HE1 H 7.608 8.943 2.204 1.00 . A A . 42 TYR HE1 1 1 30 19183 1 1 42 TYR HE2 H 3.648 10.526 2.084 1.00 . A A . 42 TYR HE2 1 1 30 19184 1 1 42 TYR HH H 4.539 8.834 3.637 1.00 . A A . 42 TYR HH 1 1 30 19185 1 1 42 TYR N N 4.494 9.655 -2.772 1.00 . A A . 42 TYR N 1 1 30 19186 1 1 42 TYR O O 6.328 7.791 -1.865 1.00 . A A . 42 TYR O 1 1 30 19187 1 1 42 TYR OH O 5.396 9.263 3.576 1.00 . A A . 42 TYR OH 1 1 30 19188 1 1 43 PRO C C 9.437 7.386 -1.612 1.00 . A A . 43 PRO C 1 1 30 19189 1 1 43 PRO CA C 8.851 7.490 -3.016 1.00 . A A . 43 PRO CA 1 1 30 19190 1 1 43 PRO CB C 9.956 7.764 -4.038 1.00 . A A . 43 PRO CB 1 1 30 19191 1 1 43 PRO CD C 8.543 9.691 -4.022 1.00 . A A . 43 PRO CD 1 1 30 19192 1 1 43 PRO CG C 9.969 9.245 -4.194 1.00 . A A . 43 PRO CG 1 1 30 19193 1 1 43 PRO HA H 8.348 6.567 -3.264 1.00 . A A . 43 PRO HA 1 1 30 19194 1 1 43 PRO HB2 H 10.899 7.397 -3.659 1.00 . A A . 43 PRO HB2 1 1 30 19195 1 1 43 PRO HB3 H 9.720 7.271 -4.970 1.00 . A A . 43 PRO HB3 1 1 30 19196 1 1 43 PRO HD2 H 8.506 10.654 -3.534 1.00 . A A . 43 PRO HD2 1 1 30 19197 1 1 43 PRO HD3 H 8.041 9.730 -4.977 1.00 . A A . 43 PRO HD3 1 1 30 19198 1 1 43 PRO HG2 H 10.595 9.689 -3.435 1.00 . A A . 43 PRO HG2 1 1 30 19199 1 1 43 PRO HG3 H 10.327 9.507 -5.178 1.00 . A A . 43 PRO HG3 1 1 30 19200 1 1 43 PRO N N 7.958 8.644 -3.163 1.00 . A A . 43 PRO N 1 1 30 19201 1 1 43 PRO O O 10.454 8.008 -1.306 1.00 . A A . 43 PRO O 1 1 30 19202 1 1 44 GLY C C 10.642 5.809 0.661 1.00 . A A . 44 GLY C 1 1 30 19203 1 1 44 GLY CA C 9.259 6.426 0.599 1.00 . A A . 44 GLY CA 1 1 30 19204 1 1 44 GLY H H 7.982 6.126 -1.063 1.00 . A A . 44 GLY H 1 1 30 19205 1 1 44 GLY HA2 H 8.568 5.788 1.130 1.00 . A A . 44 GLY HA2 1 1 30 19206 1 1 44 GLY HA3 H 9.285 7.391 1.082 1.00 . A A . 44 GLY HA3 1 1 30 19207 1 1 44 GLY N N 8.788 6.596 -0.763 1.00 . A A . 44 GLY N 1 1 30 19208 1 1 44 GLY O O 10.782 4.588 0.744 1.00 . A A . 44 GLY O 1 1 30 19209 1 1 45 ASN C C 14.021 7.358 0.692 1.00 . A A . 45 ASN C 1 1 30 19210 1 1 45 ASN CA C 13.047 6.184 0.673 1.00 . A A . 45 ASN CA 1 1 30 19211 1 1 45 ASN CB C 13.346 5.278 -0.522 1.00 . A A . 45 ASN CB 1 1 30 19212 1 1 45 ASN CG C 12.889 5.883 -1.835 1.00 . A A . 45 ASN CG 1 1 30 19213 1 1 45 ASN H H 11.492 7.615 0.555 1.00 . A A . 45 ASN H 1 1 30 19214 1 1 45 ASN HA H 13.169 5.616 1.583 1.00 . A A . 45 ASN HA 1 1 30 19215 1 1 45 ASN HB2 H 14.410 5.106 -0.579 1.00 . A A . 45 ASN HB2 1 1 30 19216 1 1 45 ASN HB3 H 12.839 4.334 -0.386 1.00 . A A . 45 ASN HB3 1 1 30 19217 1 1 45 ASN HD21 H 11.647 4.360 -2.134 1.00 . A A . 45 ASN HD21 1 1 30 19218 1 1 45 ASN HD22 H 11.659 5.571 -3.366 1.00 . A A . 45 ASN HD22 1 1 30 19219 1 1 45 ASN N N 11.667 6.654 0.621 1.00 . A A . 45 ASN N 1 1 30 19220 1 1 45 ASN ND2 N 11.972 5.203 -2.513 1.00 . A A . 45 ASN ND2 1 1 30 19221 1 1 45 ASN O O 15.021 7.337 1.409 1.00 . A A . 45 ASN O 1 1 30 19222 1 1 45 ASN OD1 O 13.354 6.951 -2.235 1.00 . A A . 45 ASN OD1 1 1 30 19223 1 1 46 GLY C C 13.851 10.780 -0.667 1.00 . A A . 46 GLY C 1 1 30 19224 1 1 46 GLY CA C 14.579 9.550 -0.160 1.00 . A A . 46 GLY CA 1 1 30 19225 1 1 46 GLY H H 12.910 8.343 -0.650 1.00 . A A . 46 GLY H 1 1 30 19226 1 1 46 GLY HA2 H 15.409 9.340 -0.818 1.00 . A A . 46 GLY HA2 1 1 30 19227 1 1 46 GLY HA3 H 14.961 9.754 0.830 1.00 . A A . 46 GLY HA3 1 1 30 19228 1 1 46 GLY N N 13.721 8.382 -0.101 1.00 . A A . 46 GLY N 1 1 30 19229 1 1 46 GLY O O 13.619 10.870 -1.891 1.00 . A A . 46 GLY O 1 1 30 19230 1 1 46 GLY OXT O 13.513 11.652 0.160 1.00 . A A . 46 GLY OXT 1 1 31 19231 1 1 1 ALA C C -15.357 0.228 7.897 1.00 . A A . 1 ALA C 1 1 31 19232 1 1 1 ALA CA C -16.525 0.077 8.866 1.00 . A A . 1 ALA CA 1 1 31 19233 1 1 1 ALA CB C -17.800 -0.254 8.106 1.00 . A A . 1 ALA CB 1 1 31 19234 1 1 1 ALA H1 H -16.766 2.115 9.015 1.00 . A A . 1 ALA H1 1 1 31 19235 1 1 1 ALA H2 H -17.596 1.206 10.211 1.00 . A A . 1 ALA H2 1 1 31 19236 1 1 1 ALA H3 H -15.893 1.403 10.307 1.00 . A A . 1 ALA H3 1 1 31 19237 1 1 1 ALA HA H -16.315 -0.740 9.540 1.00 . A A . 1 ALA HA 1 1 31 19238 1 1 1 ALA HB1 H -18.657 -0.023 8.722 1.00 . A A . 1 ALA HB1 1 1 31 19239 1 1 1 ALA HB2 H -17.841 0.331 7.199 1.00 . A A . 1 ALA HB2 1 1 31 19240 1 1 1 ALA HB3 H -17.809 -1.305 7.857 1.00 . A A . 1 ALA HB3 1 1 31 19241 1 1 1 ALA N N -16.712 1.311 9.672 1.00 . A A . 1 ALA N 1 1 31 19242 1 1 1 ALA O O -15.388 1.068 6.998 1.00 . A A . 1 ALA O 1 1 31 19243 1 1 2 MET C C -13.284 -1.529 6.070 1.00 . A A . 2 MET C 1 1 31 19244 1 1 2 MET CA C -13.149 -0.548 7.230 1.00 . A A . 2 MET CA 1 1 31 19245 1 1 2 MET CB C -11.891 -0.869 8.040 1.00 . A A . 2 MET CB 1 1 31 19246 1 1 2 MET CE C -9.094 0.194 5.248 1.00 . A A . 2 MET CE 1 1 31 19247 1 1 2 MET CG C -10.640 -0.183 7.517 1.00 . A A . 2 MET CG 1 1 31 19248 1 1 2 MET H H -14.361 -1.239 8.822 1.00 . A A . 2 MET H 1 1 31 19249 1 1 2 MET HA H -13.064 0.452 6.832 1.00 . A A . 2 MET HA 1 1 31 19250 1 1 2 MET HB2 H -12.046 -0.556 9.062 1.00 . A A . 2 MET HB2 1 1 31 19251 1 1 2 MET HB3 H -11.726 -1.936 8.020 1.00 . A A . 2 MET HB3 1 1 31 19252 1 1 2 MET HE1 H -8.573 0.874 5.905 1.00 . A A . 2 MET HE1 1 1 31 19253 1 1 2 MET HE2 H -8.397 -0.224 4.537 1.00 . A A . 2 MET HE2 1 1 31 19254 1 1 2 MET HE3 H -9.871 0.727 4.720 1.00 . A A . 2 MET HE3 1 1 31 19255 1 1 2 MET HG2 H -10.913 0.785 7.124 1.00 . A A . 2 MET HG2 1 1 31 19256 1 1 2 MET HG3 H -9.947 -0.055 8.336 1.00 . A A . 2 MET HG3 1 1 31 19257 1 1 2 MET N N -14.328 -0.591 8.087 1.00 . A A . 2 MET N 1 1 31 19258 1 1 2 MET O O -13.374 -1.126 4.910 1.00 . A A . 2 MET O 1 1 31 19259 1 1 2 MET SD S -9.825 -1.126 6.213 1.00 . A A . 2 MET SD 1 1 31 19260 1 1 3 ASP C C -12.263 -3.794 4.386 1.00 . A A . 3 ASP C 1 1 31 19261 1 1 3 ASP CA C -13.422 -3.858 5.375 1.00 . A A . 3 ASP CA 1 1 31 19262 1 1 3 ASP CB C -14.751 -3.716 4.631 1.00 . A A . 3 ASP CB 1 1 31 19263 1 1 3 ASP CG C -15.344 -5.058 4.247 1.00 . A A . 3 ASP CG 1 1 31 19264 1 1 3 ASP H H -13.222 -3.078 7.333 1.00 . A A . 3 ASP H 1 1 31 19265 1 1 3 ASP HA H -13.400 -4.814 5.876 1.00 . A A . 3 ASP HA 1 1 31 19266 1 1 3 ASP HB2 H -15.458 -3.200 5.264 1.00 . A A . 3 ASP HB2 1 1 31 19267 1 1 3 ASP HB3 H -14.593 -3.141 3.731 1.00 . A A . 3 ASP HB3 1 1 31 19268 1 1 3 ASP N N -13.298 -2.819 6.391 1.00 . A A . 3 ASP N 1 1 31 19269 1 1 3 ASP O O -11.367 -2.960 4.518 1.00 . A A . 3 ASP O 1 1 31 19270 1 1 3 ASP OD1 O -15.506 -5.914 5.142 1.00 . A A . 3 ASP OD1 1 1 31 19271 1 1 3 ASP OD2 O -15.647 -5.252 3.051 1.00 . A A . 3 ASP OD2 1 1 31 19272 1 1 4 CYS C C -11.250 -3.458 1.532 1.00 . A A . 4 CYS C 1 1 31 19273 1 1 4 CYS CA C -11.238 -4.723 2.384 1.00 . A A . 4 CYS CA 1 1 31 19274 1 1 4 CYS CB C -11.411 -5.955 1.493 1.00 . A A . 4 CYS CB 1 1 31 19275 1 1 4 CYS H H -13.028 -5.319 3.344 1.00 . A A . 4 CYS H 1 1 31 19276 1 1 4 CYS HA H -10.288 -4.790 2.894 1.00 . A A . 4 CYS HA 1 1 31 19277 1 1 4 CYS HB2 H -12.239 -5.789 0.820 1.00 . A A . 4 CYS HB2 1 1 31 19278 1 1 4 CYS HB3 H -10.509 -6.102 0.917 1.00 . A A . 4 CYS HB3 1 1 31 19279 1 1 4 CYS N N -12.287 -4.680 3.396 1.00 . A A . 4 CYS N 1 1 31 19280 1 1 4 CYS O O -12.231 -2.714 1.522 1.00 . A A . 4 CYS O 1 1 31 19281 1 1 4 CYS SG S -11.743 -7.494 2.410 1.00 . A A . 4 CYS SG 1 1 31 19282 1 1 5 THR C C -9.100 -2.323 -1.210 1.00 . A A . 5 THR C 1 1 31 19283 1 1 5 THR CA C -10.036 -2.046 -0.037 1.00 . A A . 5 THR CA 1 1 31 19284 1 1 5 THR CB C -9.526 -0.852 0.773 1.00 . A A . 5 THR CB 1 1 31 19285 1 1 5 THR CG2 C -9.358 0.406 -0.052 1.00 . A A . 5 THR CG2 1 1 31 19286 1 1 5 THR H H -9.406 -3.852 0.870 1.00 . A A . 5 THR H 1 1 31 19287 1 1 5 THR HA H -11.018 -1.816 -0.421 1.00 . A A . 5 THR HA 1 1 31 19288 1 1 5 THR HB H -8.564 -1.103 1.195 1.00 . A A . 5 THR HB 1 1 31 19289 1 1 5 THR HG1 H -9.945 -0.059 2.514 1.00 . A A . 5 THR HG1 1 1 31 19290 1 1 5 THR HG21 H -9.632 0.204 -1.077 1.00 . A A . 5 THR HG21 1 1 31 19291 1 1 5 THR HG22 H -9.994 1.183 0.344 1.00 . A A . 5 THR HG22 1 1 31 19292 1 1 5 THR HG23 H -8.328 0.728 -0.011 1.00 . A A . 5 THR HG23 1 1 31 19293 1 1 5 THR N N -10.154 -3.221 0.819 1.00 . A A . 5 THR N 1 1 31 19294 1 1 5 THR O O -7.950 -1.884 -1.215 1.00 . A A . 5 THR O 1 1 31 19295 1 1 5 THR OG1 O -10.413 -0.553 1.836 1.00 . A A . 5 THR OG1 1 1 31 19296 1 1 6 THR C C -8.029 -2.198 -3.904 1.00 . A A . 6 THR C 1 1 31 19297 1 1 6 THR CA C -8.814 -3.401 -3.384 1.00 . A A . 6 THR CA 1 1 31 19298 1 1 6 THR CB C -9.726 -3.941 -4.487 1.00 . A A . 6 THR CB 1 1 31 19299 1 1 6 THR CG2 C -9.924 -5.440 -4.418 1.00 . A A . 6 THR CG2 1 1 31 19300 1 1 6 THR H H -10.525 -3.377 -2.135 1.00 . A A . 6 THR H 1 1 31 19301 1 1 6 THR HA H -8.116 -4.174 -3.101 1.00 . A A . 6 THR HA 1 1 31 19302 1 1 6 THR HB H -9.290 -3.709 -5.447 1.00 . A A . 6 THR HB 1 1 31 19303 1 1 6 THR HG1 H -11.134 -2.774 -5.188 1.00 . A A . 6 THR HG1 1 1 31 19304 1 1 6 THR HG21 H -9.367 -5.839 -3.583 1.00 . A A . 6 THR HG21 1 1 31 19305 1 1 6 THR HG22 H -9.572 -5.892 -5.334 1.00 . A A . 6 THR HG22 1 1 31 19306 1 1 6 THR HG23 H -10.973 -5.660 -4.289 1.00 . A A . 6 THR HG23 1 1 31 19307 1 1 6 THR N N -9.602 -3.056 -2.201 1.00 . A A . 6 THR N 1 1 31 19308 1 1 6 THR O O -8.610 -1.188 -4.301 1.00 . A A . 6 THR O 1 1 31 19309 1 1 6 THR OG1 O -11.005 -3.336 -4.421 1.00 . A A . 6 THR OG1 1 1 31 19310 1 1 7 GLY C C -4.433 -1.692 -4.629 1.00 . A A . 7 GLY C 1 1 31 19311 1 1 7 GLY CA C -5.858 -1.238 -4.367 1.00 . A A . 7 GLY CA 1 1 31 19312 1 1 7 GLY H H -6.300 -3.148 -3.568 1.00 . A A . 7 GLY H 1 1 31 19313 1 1 7 GLY HA2 H -5.844 -0.456 -3.623 1.00 . A A . 7 GLY HA2 1 1 31 19314 1 1 7 GLY HA3 H -6.272 -0.843 -5.283 1.00 . A A . 7 GLY HA3 1 1 31 19315 1 1 7 GLY N N -6.705 -2.318 -3.897 1.00 . A A . 7 GLY N 1 1 31 19316 1 1 7 GLY O O -4.154 -2.891 -4.636 1.00 . A A . 7 GLY O 1 1 31 19317 1 1 8 PRO C C -1.385 -1.650 -3.894 1.00 . A A . 8 PRO C 1 1 31 19318 1 1 8 PRO CA C -2.096 -1.073 -5.117 1.00 . A A . 8 PRO CA 1 1 31 19319 1 1 8 PRO CB C -1.486 0.275 -5.511 1.00 . A A . 8 PRO CB 1 1 31 19320 1 1 8 PRO CD C -3.747 0.706 -4.865 1.00 . A A . 8 PRO CD 1 1 31 19321 1 1 8 PRO CG C -2.363 1.293 -4.871 1.00 . A A . 8 PRO CG 1 1 31 19322 1 1 8 PRO HA H -2.003 -1.765 -5.940 1.00 . A A . 8 PRO HA 1 1 31 19323 1 1 8 PRO HB2 H -0.473 0.337 -5.140 1.00 . A A . 8 PRO HB2 1 1 31 19324 1 1 8 PRO HB3 H -1.487 0.375 -6.587 1.00 . A A . 8 PRO HB3 1 1 31 19325 1 1 8 PRO HD2 H -4.284 1.014 -3.980 1.00 . A A . 8 PRO HD2 1 1 31 19326 1 1 8 PRO HD3 H -4.285 0.997 -5.755 1.00 . A A . 8 PRO HD3 1 1 31 19327 1 1 8 PRO HG2 H -2.031 1.480 -3.862 1.00 . A A . 8 PRO HG2 1 1 31 19328 1 1 8 PRO HG3 H -2.347 2.207 -5.447 1.00 . A A . 8 PRO HG3 1 1 31 19329 1 1 8 PRO N N -3.502 -0.748 -4.851 1.00 . A A . 8 PRO N 1 1 31 19330 1 1 8 PRO O O -0.346 -2.298 -4.021 1.00 . A A . 8 PRO O 1 1 31 19331 1 1 9 CYS C C -2.088 -3.175 -0.996 1.00 . A A . 9 CYS C 1 1 31 19332 1 1 9 CYS CA C -1.360 -1.923 -1.473 1.00 . A A . 9 CYS CA 1 1 31 19333 1 1 9 CYS CB C -1.402 -0.854 -0.379 1.00 . A A . 9 CYS CB 1 1 31 19334 1 1 9 CYS H H -2.777 -0.896 -2.668 1.00 . A A . 9 CYS H 1 1 31 19335 1 1 9 CYS HA H -0.330 -2.177 -1.676 1.00 . A A . 9 CYS HA 1 1 31 19336 1 1 9 CYS HB2 H -0.905 0.036 -0.734 1.00 . A A . 9 CYS HB2 1 1 31 19337 1 1 9 CYS HB3 H -2.432 -0.620 -0.157 1.00 . A A . 9 CYS HB3 1 1 31 19338 1 1 9 CYS N N -1.948 -1.417 -2.710 1.00 . A A . 9 CYS N 1 1 31 19339 1 1 9 CYS O O -1.478 -4.086 -0.436 1.00 . A A . 9 CYS O 1 1 31 19340 1 1 9 CYS SG S -0.598 -1.357 1.177 1.00 . A A . 9 CYS SG 1 1 31 19341 1 1 10 CYS C C -3.718 -5.632 -1.490 1.00 . A A . 10 CYS C 1 1 31 19342 1 1 10 CYS CA C -4.211 -4.352 -0.818 1.00 . A A . 10 CYS CA 1 1 31 19343 1 1 10 CYS CB C -5.678 -4.103 -1.176 1.00 . A A . 10 CYS CB 1 1 31 19344 1 1 10 CYS H H -3.826 -2.455 -1.673 1.00 . A A . 10 CYS H 1 1 31 19345 1 1 10 CYS HA H -4.123 -4.462 0.252 1.00 . A A . 10 CYS HA 1 1 31 19346 1 1 10 CYS HB2 H -5.764 -3.140 -1.655 1.00 . A A . 10 CYS HB2 1 1 31 19347 1 1 10 CYS HB3 H -6.009 -4.869 -1.862 1.00 . A A . 10 CYS HB3 1 1 31 19348 1 1 10 CYS N N -3.397 -3.212 -1.222 1.00 . A A . 10 CYS N 1 1 31 19349 1 1 10 CYS O O -3.299 -5.613 -2.647 1.00 . A A . 10 CYS O 1 1 31 19350 1 1 10 CYS SG S -6.813 -4.112 0.251 1.00 . A A . 10 CYS SG 1 1 31 19351 1 1 11 ARG C C -4.525 -8.934 -1.582 1.00 . A A . 11 ARG C 1 1 31 19352 1 1 11 ARG CA C -3.331 -8.027 -1.293 1.00 . A A . 11 ARG CA 1 1 31 19353 1 1 11 ARG CB C -2.357 -8.716 -0.325 1.00 . A A . 11 ARG CB 1 1 31 19354 1 1 11 ARG CD C -1.961 -9.363 2.072 1.00 . A A . 11 ARG CD 1 1 31 19355 1 1 11 ARG CG C -2.545 -8.321 1.132 1.00 . A A . 11 ARG CG 1 1 31 19356 1 1 11 ARG CZ C -1.842 -11.821 2.203 1.00 . A A . 11 ARG CZ 1 1 31 19357 1 1 11 ARG H H -4.118 -6.695 0.156 1.00 . A A . 11 ARG H 1 1 31 19358 1 1 11 ARG HA H -2.818 -7.834 -2.222 1.00 . A A . 11 ARG HA 1 1 31 19359 1 1 11 ARG HB2 H -2.489 -9.785 -0.404 1.00 . A A . 11 ARG HB2 1 1 31 19360 1 1 11 ARG HB3 H -1.347 -8.467 -0.615 1.00 . A A . 11 ARG HB3 1 1 31 19361 1 1 11 ARG HD2 H -0.884 -9.334 1.997 1.00 . A A . 11 ARG HD2 1 1 31 19362 1 1 11 ARG HD3 H -2.256 -9.124 3.083 1.00 . A A . 11 ARG HD3 1 1 31 19363 1 1 11 ARG HE H -3.204 -10.795 1.166 1.00 . A A . 11 ARG HE 1 1 31 19364 1 1 11 ARG HG2 H -2.050 -7.377 1.306 1.00 . A A . 11 ARG HG2 1 1 31 19365 1 1 11 ARG HG3 H -3.601 -8.218 1.335 1.00 . A A . 11 ARG HG3 1 1 31 19366 1 1 11 ARG HH11 H -0.410 -10.856 3.257 1.00 . A A . 11 ARG HH11 1 1 31 19367 1 1 11 ARG HH12 H -0.349 -12.584 3.333 1.00 . A A . 11 ARG HH12 1 1 31 19368 1 1 11 ARG HH21 H -3.125 -13.069 1.265 1.00 . A A . 11 ARG HH21 1 1 31 19369 1 1 11 ARG HH22 H -1.889 -13.842 2.201 1.00 . A A . 11 ARG HH22 1 1 31 19370 1 1 11 ARG N N -3.772 -6.741 -0.759 1.00 . A A . 11 ARG N 1 1 31 19371 1 1 11 ARG NE N -2.422 -10.712 1.750 1.00 . A A . 11 ARG NE 1 1 31 19372 1 1 11 ARG NH1 N -0.780 -11.747 2.996 1.00 . A A . 11 ARG NH1 1 1 31 19373 1 1 11 ARG NH2 N -2.325 -13.008 1.862 1.00 . A A . 11 ARG NH2 1 1 31 19374 1 1 11 ARG O O -5.030 -8.967 -2.704 1.00 . A A . 11 ARG O 1 1 31 19375 1 1 12 GLN C C -7.380 -9.913 -0.166 1.00 . A A . 12 GLN C 1 1 31 19376 1 1 12 GLN CA C -6.117 -10.559 -0.721 1.00 . A A . 12 GLN CA 1 1 31 19377 1 1 12 GLN CB C -5.851 -11.887 -0.008 1.00 . A A . 12 GLN CB 1 1 31 19378 1 1 12 GLN CD C -6.013 -13.870 -1.564 1.00 . A A . 12 GLN CD 1 1 31 19379 1 1 12 GLN CG C -5.093 -12.893 -0.858 1.00 . A A . 12 GLN CG 1 1 31 19380 1 1 12 GLN H H -4.541 -9.594 0.307 1.00 . A A . 12 GLN H 1 1 31 19381 1 1 12 GLN HA H -6.253 -10.746 -1.775 1.00 . A A . 12 GLN HA 1 1 31 19382 1 1 12 GLN HB2 H -5.273 -11.694 0.884 1.00 . A A . 12 GLN HB2 1 1 31 19383 1 1 12 GLN HB3 H -6.797 -12.326 0.275 1.00 . A A . 12 GLN HB3 1 1 31 19384 1 1 12 GLN HE21 H -5.070 -13.554 -3.285 1.00 . A A . 12 GLN HE21 1 1 31 19385 1 1 12 GLN HE22 H -6.379 -14.679 -3.343 1.00 . A A . 12 GLN HE22 1 1 31 19386 1 1 12 GLN HG2 H -4.522 -12.358 -1.603 1.00 . A A . 12 GLN HG2 1 1 31 19387 1 1 12 GLN HG3 H -4.421 -13.449 -0.221 1.00 . A A . 12 GLN HG3 1 1 31 19388 1 1 12 GLN N N -4.978 -9.663 -0.567 1.00 . A A . 12 GLN N 1 1 31 19389 1 1 12 GLN NE2 N -5.799 -14.053 -2.861 1.00 . A A . 12 GLN NE2 1 1 31 19390 1 1 12 GLN O O -8.481 -10.144 -0.665 1.00 . A A . 12 GLN O 1 1 31 19391 1 1 12 GLN OE1 O -6.906 -14.454 -0.950 1.00 . A A . 12 GLN OE1 1 1 31 19392 1 1 13 CYS C C -7.870 -7.661 2.755 1.00 . A A . 13 CYS C 1 1 31 19393 1 1 13 CYS CA C -8.326 -8.403 1.502 1.00 . A A . 13 CYS CA 1 1 31 19394 1 1 13 CYS CB C -9.441 -9.393 1.858 1.00 . A A . 13 CYS CB 1 1 31 19395 1 1 13 CYS H H -6.302 -8.954 1.215 1.00 . A A . 13 CYS H 1 1 31 19396 1 1 13 CYS HA H -8.710 -7.684 0.794 1.00 . A A . 13 CYS HA 1 1 31 19397 1 1 13 CYS HB2 H -9.179 -10.370 1.480 1.00 . A A . 13 CYS HB2 1 1 31 19398 1 1 13 CYS HB3 H -9.541 -9.443 2.932 1.00 . A A . 13 CYS HB3 1 1 31 19399 1 1 13 CYS N N -7.207 -9.096 0.870 1.00 . A A . 13 CYS N 1 1 31 19400 1 1 13 CYS O O -8.603 -7.579 3.741 1.00 . A A . 13 CYS O 1 1 31 19401 1 1 13 CYS SG S -11.070 -8.954 1.169 1.00 . A A . 13 CYS SG 1 1 31 19402 1 1 14 LYS C C -4.839 -5.647 3.437 1.00 . A A . 14 LYS C 1 1 31 19403 1 1 14 LYS CA C -6.108 -6.384 3.844 1.00 . A A . 14 LYS CA 1 1 31 19404 1 1 14 LYS CB C -5.810 -7.337 5.004 1.00 . A A . 14 LYS CB 1 1 31 19405 1 1 14 LYS CD C -5.408 -7.539 7.476 1.00 . A A . 14 LYS CD 1 1 31 19406 1 1 14 LYS CE C -4.503 -7.055 8.597 1.00 . A A . 14 LYS CE 1 1 31 19407 1 1 14 LYS CG C -5.321 -6.632 6.259 1.00 . A A . 14 LYS CG 1 1 31 19408 1 1 14 LYS H H -6.114 -7.213 1.901 1.00 . A A . 14 LYS H 1 1 31 19409 1 1 14 LYS HA H -6.845 -5.662 4.161 1.00 . A A . 14 LYS HA 1 1 31 19410 1 1 14 LYS HB2 H -6.711 -7.879 5.249 1.00 . A A . 14 LYS HB2 1 1 31 19411 1 1 14 LYS HB3 H -5.051 -8.039 4.692 1.00 . A A . 14 LYS HB3 1 1 31 19412 1 1 14 LYS HD2 H -6.428 -7.552 7.831 1.00 . A A . 14 LYS HD2 1 1 31 19413 1 1 14 LYS HD3 H -5.112 -8.538 7.190 1.00 . A A . 14 LYS HD3 1 1 31 19414 1 1 14 LYS HE2 H -3.551 -6.767 8.174 1.00 . A A . 14 LYS HE2 1 1 31 19415 1 1 14 LYS HE3 H -4.961 -6.198 9.068 1.00 . A A . 14 LYS HE3 1 1 31 19416 1 1 14 LYS HG2 H -4.293 -6.336 6.117 1.00 . A A . 14 LYS HG2 1 1 31 19417 1 1 14 LYS HG3 H -5.931 -5.757 6.429 1.00 . A A . 14 LYS HG3 1 1 31 19418 1 1 14 LYS HZ1 H -4.262 -9.049 9.174 1.00 . A A . 14 LYS HZ1 1 1 31 19419 1 1 14 LYS HZ2 H -3.367 -7.953 10.102 1.00 . A A . 14 LYS HZ2 1 1 31 19420 1 1 14 LYS HZ3 H -5.037 -8.089 10.331 1.00 . A A . 14 LYS HZ3 1 1 31 19421 1 1 14 LYS N N -6.656 -7.119 2.713 1.00 . A A . 14 LYS N 1 1 31 19422 1 1 14 LYS NZ N -4.276 -8.110 9.623 1.00 . A A . 14 LYS NZ 1 1 31 19423 1 1 14 LYS O O -3.905 -6.248 2.907 1.00 . A A . 14 LYS O 1 1 31 19424 1 1 15 LEU C C -2.352 -4.200 3.708 1.00 . A A . 15 LEU C 1 1 31 19425 1 1 15 LEU CA C -3.661 -3.513 3.332 1.00 . A A . 15 LEU CA 1 1 31 19426 1 1 15 LEU CB C -3.743 -2.129 3.997 1.00 . A A . 15 LEU CB 1 1 31 19427 1 1 15 LEU CD1 C -5.873 -2.001 5.340 1.00 . A A . 15 LEU CD1 1 1 31 19428 1 1 15 LEU CD2 C -3.903 -3.245 6.263 1.00 . A A . 15 LEU CD2 1 1 31 19429 1 1 15 LEU CG C -4.354 -2.068 5.408 1.00 . A A . 15 LEU CG 1 1 31 19430 1 1 15 LEU H H -5.594 -3.921 4.097 1.00 . A A . 15 LEU H 1 1 31 19431 1 1 15 LEU HA H -3.674 -3.380 2.261 1.00 . A A . 15 LEU HA 1 1 31 19432 1 1 15 LEU HB2 H -2.742 -1.727 4.052 1.00 . A A . 15 LEU HB2 1 1 31 19433 1 1 15 LEU HB3 H -4.327 -1.489 3.355 1.00 . A A . 15 LEU HB3 1 1 31 19434 1 1 15 LEU HD11 H -6.181 -1.819 4.321 1.00 . A A . 15 LEU HD11 1 1 31 19435 1 1 15 LEU HD12 H -6.291 -2.937 5.681 1.00 . A A . 15 LEU HD12 1 1 31 19436 1 1 15 LEU HD13 H -6.226 -1.199 5.972 1.00 . A A . 15 LEU HD13 1 1 31 19437 1 1 15 LEU HD21 H -4.185 -4.170 5.786 1.00 . A A . 15 LEU HD21 1 1 31 19438 1 1 15 LEU HD22 H -2.830 -3.213 6.382 1.00 . A A . 15 LEU HD22 1 1 31 19439 1 1 15 LEU HD23 H -4.373 -3.185 7.234 1.00 . A A . 15 LEU HD23 1 1 31 19440 1 1 15 LEU HG H -4.012 -1.163 5.891 1.00 . A A . 15 LEU HG 1 1 31 19441 1 1 15 LEU N N -4.815 -4.339 3.680 1.00 . A A . 15 LEU N 1 1 31 19442 1 1 15 LEU O O -2.174 -4.655 4.837 1.00 . A A . 15 LEU O 1 1 31 19443 1 1 16 LYS C C 0.521 -4.359 4.230 1.00 . A A . 16 LYS C 1 1 31 19444 1 1 16 LYS CA C -0.148 -4.919 2.974 1.00 . A A . 16 LYS CA 1 1 31 19445 1 1 16 LYS CB C 0.766 -4.722 1.763 1.00 . A A . 16 LYS CB 1 1 31 19446 1 1 16 LYS CD C 1.170 -5.389 -0.626 1.00 . A A . 16 LYS CD 1 1 31 19447 1 1 16 LYS CE C 0.546 -6.202 -1.748 1.00 . A A . 16 LYS CE 1 1 31 19448 1 1 16 LYS CG C 0.662 -5.837 0.735 1.00 . A A . 16 LYS CG 1 1 31 19449 1 1 16 LYS H H -1.639 -3.907 1.861 1.00 . A A . 16 LYS H 1 1 31 19450 1 1 16 LYS HA H -0.325 -5.976 3.113 1.00 . A A . 16 LYS HA 1 1 31 19451 1 1 16 LYS HB2 H 0.508 -3.791 1.279 1.00 . A A . 16 LYS HB2 1 1 31 19452 1 1 16 LYS HB3 H 1.789 -4.669 2.103 1.00 . A A . 16 LYS HB3 1 1 31 19453 1 1 16 LYS HD2 H 0.920 -4.348 -0.768 1.00 . A A . 16 LYS HD2 1 1 31 19454 1 1 16 LYS HD3 H 2.242 -5.512 -0.657 1.00 . A A . 16 LYS HD3 1 1 31 19455 1 1 16 LYS HE2 H -0.473 -6.439 -1.481 1.00 . A A . 16 LYS HE2 1 1 31 19456 1 1 16 LYS HE3 H 0.552 -5.610 -2.651 1.00 . A A . 16 LYS HE3 1 1 31 19457 1 1 16 LYS HG2 H 1.252 -6.677 1.069 1.00 . A A . 16 LYS HG2 1 1 31 19458 1 1 16 LYS HG3 H -0.373 -6.134 0.644 1.00 . A A . 16 LYS HG3 1 1 31 19459 1 1 16 LYS HZ1 H 1.416 -7.989 -1.103 1.00 . A A . 16 LYS HZ1 1 1 31 19460 1 1 16 LYS HZ2 H 0.758 -8.070 -2.659 1.00 . A A . 16 LYS HZ2 1 1 31 19461 1 1 16 LYS HZ3 H 2.223 -7.263 -2.400 1.00 . A A . 16 LYS HZ3 1 1 31 19462 1 1 16 LYS N N -1.438 -4.281 2.746 1.00 . A A . 16 LYS N 1 1 31 19463 1 1 16 LYS NZ N 1.287 -7.470 -1.995 1.00 . A A . 16 LYS NZ 1 1 31 19464 1 1 16 LYS O O 0.143 -3.295 4.720 1.00 . A A . 16 LYS O 1 1 31 19465 1 1 17 PRO C C 2.923 -3.286 5.790 1.00 . A A . 17 PRO C 1 1 31 19466 1 1 17 PRO CA C 2.241 -4.638 5.973 1.00 . A A . 17 PRO CA 1 1 31 19467 1 1 17 PRO CB C 3.291 -5.736 6.192 1.00 . A A . 17 PRO CB 1 1 31 19468 1 1 17 PRO CD C 2.039 -6.348 4.251 1.00 . A A . 17 PRO CD 1 1 31 19469 1 1 17 PRO CG C 3.397 -6.443 4.883 1.00 . A A . 17 PRO CG 1 1 31 19470 1 1 17 PRO HA H 1.583 -4.592 6.828 1.00 . A A . 17 PRO HA 1 1 31 19471 1 1 17 PRO HB2 H 4.232 -5.284 6.472 1.00 . A A . 17 PRO HB2 1 1 31 19472 1 1 17 PRO HB3 H 2.959 -6.402 6.974 1.00 . A A . 17 PRO HB3 1 1 31 19473 1 1 17 PRO HD2 H 2.123 -6.324 3.175 1.00 . A A . 17 PRO HD2 1 1 31 19474 1 1 17 PRO HD3 H 1.415 -7.171 4.566 1.00 . A A . 17 PRO HD3 1 1 31 19475 1 1 17 PRO HG2 H 4.135 -5.958 4.262 1.00 . A A . 17 PRO HG2 1 1 31 19476 1 1 17 PRO HG3 H 3.663 -7.477 5.046 1.00 . A A . 17 PRO HG3 1 1 31 19477 1 1 17 PRO N N 1.524 -5.071 4.769 1.00 . A A . 17 PRO N 1 1 31 19478 1 1 17 PRO O O 3.480 -3.000 4.731 1.00 . A A . 17 PRO O 1 1 31 19479 1 1 18 ALA C C 4.970 -1.245 6.392 1.00 . A A . 18 ALA C 1 1 31 19480 1 1 18 ALA CA C 3.500 -1.140 6.784 1.00 . A A . 18 ALA CA 1 1 31 19481 1 1 18 ALA CB C 3.358 -0.441 8.128 1.00 . A A . 18 ALA CB 1 1 31 19482 1 1 18 ALA H H 2.424 -2.744 7.650 1.00 . A A . 18 ALA H 1 1 31 19483 1 1 18 ALA HA H 2.980 -0.552 6.041 1.00 . A A . 18 ALA HA 1 1 31 19484 1 1 18 ALA HB1 H 4.069 -0.856 8.826 1.00 . A A . 18 ALA HB1 1 1 31 19485 1 1 18 ALA HB2 H 3.546 0.615 8.006 1.00 . A A . 18 ALA HB2 1 1 31 19486 1 1 18 ALA HB3 H 2.356 -0.587 8.505 1.00 . A A . 18 ALA HB3 1 1 31 19487 1 1 18 ALA N N 2.880 -2.459 6.831 1.00 . A A . 18 ALA N 1 1 31 19488 1 1 18 ALA O O 5.580 -2.307 6.522 1.00 . A A . 18 ALA O 1 1 31 19489 1 1 19 GLY C C 7.190 -1.139 4.383 1.00 . A A . 19 GLY C 1 1 31 19490 1 1 19 GLY CA C 6.924 -0.148 5.499 1.00 . A A . 19 GLY CA 1 1 31 19491 1 1 19 GLY H H 4.999 0.672 5.819 1.00 . A A . 19 GLY H 1 1 31 19492 1 1 19 GLY HA2 H 7.538 -0.406 6.349 1.00 . A A . 19 GLY HA2 1 1 31 19493 1 1 19 GLY HA3 H 7.193 0.842 5.160 1.00 . A A . 19 GLY HA3 1 1 31 19494 1 1 19 GLY N N 5.533 -0.145 5.906 1.00 . A A . 19 GLY N 1 1 31 19495 1 1 19 GLY O O 8.308 -1.633 4.234 1.00 . A A . 19 GLY O 1 1 31 19496 1 1 20 THR C C 5.826 -1.708 1.186 1.00 . A A . 20 THR C 1 1 31 19497 1 1 20 THR CA C 6.278 -2.362 2.485 1.00 . A A . 20 THR CA 1 1 31 19498 1 1 20 THR CB C 5.443 -3.616 2.754 1.00 . A A . 20 THR CB 1 1 31 19499 1 1 20 THR CG2 C 5.642 -4.703 1.721 1.00 . A A . 20 THR CG2 1 1 31 19500 1 1 20 THR H H 5.293 -0.998 3.765 1.00 . A A . 20 THR H 1 1 31 19501 1 1 20 THR HA H 7.316 -2.642 2.394 1.00 . A A . 20 THR HA 1 1 31 19502 1 1 20 THR HB H 4.397 -3.346 2.751 1.00 . A A . 20 THR HB 1 1 31 19503 1 1 20 THR HG1 H 4.987 -4.114 4.593 1.00 . A A . 20 THR HG1 1 1 31 19504 1 1 20 THR HG21 H 5.904 -4.256 0.773 1.00 . A A . 20 THR HG21 1 1 31 19505 1 1 20 THR HG22 H 6.436 -5.362 2.040 1.00 . A A . 20 THR HG22 1 1 31 19506 1 1 20 THR HG23 H 4.727 -5.268 1.612 1.00 . A A . 20 THR HG23 1 1 31 19507 1 1 20 THR N N 6.158 -1.427 3.596 1.00 . A A . 20 THR N 1 1 31 19508 1 1 20 THR O O 4.755 -1.105 1.124 1.00 . A A . 20 THR O 1 1 31 19509 1 1 20 THR OG1 O 5.757 -4.165 4.022 1.00 . A A . 20 THR OG1 1 1 31 19510 1 1 21 THR C C 4.957 -1.705 -1.630 1.00 . A A . 21 THR C 1 1 31 19511 1 1 21 THR CA C 6.328 -1.243 -1.148 1.00 . A A . 21 THR CA 1 1 31 19512 1 1 21 THR CB C 7.399 -1.606 -2.179 1.00 . A A . 21 THR CB 1 1 31 19513 1 1 21 THR CG2 C 8.086 -0.395 -2.767 1.00 . A A . 21 THR CG2 1 1 31 19514 1 1 21 THR H H 7.489 -2.319 0.259 1.00 . A A . 21 THR H 1 1 31 19515 1 1 21 THR HA H 6.309 -0.171 -1.028 1.00 . A A . 21 THR HA 1 1 31 19516 1 1 21 THR HB H 6.937 -2.151 -2.990 1.00 . A A . 21 THR HB 1 1 31 19517 1 1 21 THR HG1 H 8.644 -3.118 -2.224 1.00 . A A . 21 THR HG1 1 1 31 19518 1 1 21 THR HG21 H 8.138 0.385 -2.021 1.00 . A A . 21 THR HG21 1 1 31 19519 1 1 21 THR HG22 H 9.084 -0.663 -3.079 1.00 . A A . 21 THR HG22 1 1 31 19520 1 1 21 THR HG23 H 7.523 -0.041 -3.618 1.00 . A A . 21 THR HG23 1 1 31 19521 1 1 21 THR N N 6.648 -1.828 0.149 1.00 . A A . 21 THR N 1 1 31 19522 1 1 21 THR O O 4.749 -2.886 -1.904 1.00 . A A . 21 THR O 1 1 31 19523 1 1 21 THR OG1 O 8.398 -2.430 -1.602 1.00 . A A . 21 THR OG1 1 1 31 19524 1 1 22 CYS C C 2.422 -0.562 -3.584 1.00 . A A . 22 CYS C 1 1 31 19525 1 1 22 CYS CA C 2.672 -1.078 -2.174 1.00 . A A . 22 CYS CA 1 1 31 19526 1 1 22 CYS CB C 1.634 -0.483 -1.218 1.00 . A A . 22 CYS CB 1 1 31 19527 1 1 22 CYS H H 4.249 0.160 -1.493 1.00 . A A . 22 CYS H 1 1 31 19528 1 1 22 CYS HA H 2.568 -2.152 -2.176 1.00 . A A . 22 CYS HA 1 1 31 19529 1 1 22 CYS HB2 H 0.671 -0.486 -1.705 1.00 . A A . 22 CYS HB2 1 1 31 19530 1 1 22 CYS HB3 H 1.583 -1.096 -0.330 1.00 . A A . 22 CYS HB3 1 1 31 19531 1 1 22 CYS N N 4.023 -0.764 -1.728 1.00 . A A . 22 CYS N 1 1 31 19532 1 1 22 CYS O O 1.314 -0.138 -3.909 1.00 . A A . 22 CYS O 1 1 31 19533 1 1 22 CYS SG S 1.976 1.230 -0.693 1.00 . A A . 22 CYS SG 1 1 31 19534 1 1 23 TRP C C 4.500 -0.545 -6.650 1.00 . A A . 23 TRP C 1 1 31 19535 1 1 23 TRP CA C 3.315 -0.127 -5.791 1.00 . A A . 23 TRP CA 1 1 31 19536 1 1 23 TRP CB C 3.160 1.395 -5.816 1.00 . A A . 23 TRP CB 1 1 31 19537 1 1 23 TRP CD1 C 1.704 1.118 -7.903 1.00 . A A . 23 TRP CD1 1 1 31 19538 1 1 23 TRP CD2 C 1.962 3.238 -7.239 1.00 . A A . 23 TRP CD2 1 1 31 19539 1 1 23 TRP CE2 C 1.149 3.222 -8.387 1.00 . A A . 23 TRP CE2 1 1 31 19540 1 1 23 TRP CE3 C 2.261 4.465 -6.643 1.00 . A A . 23 TRP CE3 1 1 31 19541 1 1 23 TRP CG C 2.306 1.881 -6.946 1.00 . A A . 23 TRP CG 1 1 31 19542 1 1 23 TRP CH2 C 0.941 5.570 -8.346 1.00 . A A . 23 TRP CH2 1 1 31 19543 1 1 23 TRP CZ2 C 0.632 4.383 -8.949 1.00 . A A . 23 TRP CZ2 1 1 31 19544 1 1 23 TRP CZ3 C 1.748 5.619 -7.204 1.00 . A A . 23 TRP CZ3 1 1 31 19545 1 1 23 TRP H H 4.314 -0.944 -4.112 1.00 . A A . 23 TRP H 1 1 31 19546 1 1 23 TRP HA H 2.425 -0.571 -6.200 1.00 . A A . 23 TRP HA 1 1 31 19547 1 1 23 TRP HB2 H 2.706 1.720 -4.892 1.00 . A A . 23 TRP HB2 1 1 31 19548 1 1 23 TRP HB3 H 4.134 1.850 -5.914 1.00 . A A . 23 TRP HB3 1 1 31 19549 1 1 23 TRP HD1 H 1.777 0.043 -7.956 1.00 . A A . 23 TRP HD1 1 1 31 19550 1 1 23 TRP HE1 H 0.492 1.605 -9.546 1.00 . A A . 23 TRP HE1 1 1 31 19551 1 1 23 TRP HE3 H 2.880 4.520 -5.762 1.00 . A A . 23 TRP HE3 1 1 31 19552 1 1 23 TRP HH2 H 0.565 6.496 -8.753 1.00 . A A . 23 TRP HH2 1 1 31 19553 1 1 23 TRP HZ2 H 0.006 4.361 -9.826 1.00 . A A . 23 TRP HZ2 1 1 31 19554 1 1 23 TRP HZ3 H 1.969 6.577 -6.758 1.00 . A A . 23 TRP HZ3 1 1 31 19555 1 1 23 TRP N N 3.451 -0.597 -4.421 1.00 . A A . 23 TRP N 1 1 31 19556 1 1 23 TRP NE1 N 1.007 1.917 -8.774 1.00 . A A . 23 TRP NE1 1 1 31 19557 1 1 23 TRP O O 4.367 -1.389 -7.535 1.00 . A A . 23 TRP O 1 1 31 19558 1 1 24 LYS C C 6.577 -0.281 -8.651 1.00 . A A . 24 LYS C 1 1 31 19559 1 1 24 LYS CA C 6.868 -0.233 -7.152 1.00 . A A . 24 LYS CA 1 1 31 19560 1 1 24 LYS CB C 7.490 -1.552 -6.680 1.00 . A A . 24 LYS CB 1 1 31 19561 1 1 24 LYS CD C 5.793 -3.274 -5.985 1.00 . A A . 24 LYS CD 1 1 31 19562 1 1 24 LYS CE C 4.545 -3.937 -6.545 1.00 . A A . 24 LYS CE 1 1 31 19563 1 1 24 LYS CG C 6.717 -2.796 -7.094 1.00 . A A . 24 LYS CG 1 1 31 19564 1 1 24 LYS H H 5.687 0.732 -5.681 1.00 . A A . 24 LYS H 1 1 31 19565 1 1 24 LYS HA H 7.569 0.566 -6.967 1.00 . A A . 24 LYS HA 1 1 31 19566 1 1 24 LYS HB2 H 8.488 -1.626 -7.085 1.00 . A A . 24 LYS HB2 1 1 31 19567 1 1 24 LYS HB3 H 7.552 -1.536 -5.602 1.00 . A A . 24 LYS HB3 1 1 31 19568 1 1 24 LYS HD2 H 6.322 -3.987 -5.372 1.00 . A A . 24 LYS HD2 1 1 31 19569 1 1 24 LYS HD3 H 5.501 -2.426 -5.383 1.00 . A A . 24 LYS HD3 1 1 31 19570 1 1 24 LYS HE2 H 3.691 -3.612 -5.969 1.00 . A A . 24 LYS HE2 1 1 31 19571 1 1 24 LYS HE3 H 4.421 -3.632 -7.574 1.00 . A A . 24 LYS HE3 1 1 31 19572 1 1 24 LYS HG2 H 6.128 -2.572 -7.969 1.00 . A A . 24 LYS HG2 1 1 31 19573 1 1 24 LYS HG3 H 7.421 -3.582 -7.326 1.00 . A A . 24 LYS HG3 1 1 31 19574 1 1 24 LYS HZ1 H 5.584 -5.736 -6.762 1.00 . A A . 24 LYS HZ1 1 1 31 19575 1 1 24 LYS HZ2 H 4.434 -5.754 -5.521 1.00 . A A . 24 LYS HZ2 1 1 31 19576 1 1 24 LYS HZ3 H 3.938 -5.846 -7.135 1.00 . A A . 24 LYS HZ3 1 1 31 19577 1 1 24 LYS N N 5.653 0.062 -6.394 1.00 . A A . 24 LYS N 1 1 31 19578 1 1 24 LYS NZ N 4.631 -5.422 -6.487 1.00 . A A . 24 LYS NZ 1 1 31 19579 1 1 24 LYS O O 7.211 -1.026 -9.397 1.00 . A A . 24 LYS O 1 1 31 19580 1 1 25 THR C C 6.427 0.787 -11.385 1.00 . A A . 25 THR C 1 1 31 19581 1 1 25 THR CA C 5.212 0.587 -10.483 1.00 . A A . 25 THR CA 1 1 31 19582 1 1 25 THR CB C 4.208 1.725 -10.697 1.00 . A A . 25 THR CB 1 1 31 19583 1 1 25 THR CG2 C 3.050 1.341 -11.592 1.00 . A A . 25 THR CG2 1 1 31 19584 1 1 25 THR H H 5.140 1.091 -8.429 1.00 . A A . 25 THR H 1 1 31 19585 1 1 25 THR HA H 4.740 -0.349 -10.737 1.00 . A A . 25 THR HA 1 1 31 19586 1 1 25 THR HB H 4.715 2.563 -11.154 1.00 . A A . 25 THR HB 1 1 31 19587 1 1 25 THR HG1 H 3.807 3.103 -9.365 1.00 . A A . 25 THR HG1 1 1 31 19588 1 1 25 THR HG21 H 2.775 0.314 -11.405 1.00 . A A . 25 THR HG21 1 1 31 19589 1 1 25 THR HG22 H 2.207 1.984 -11.384 1.00 . A A . 25 THR HG22 1 1 31 19590 1 1 25 THR HG23 H 3.341 1.453 -12.626 1.00 . A A . 25 THR HG23 1 1 31 19591 1 1 25 THR N N 5.606 0.524 -9.078 1.00 . A A . 25 THR N 1 1 31 19592 1 1 25 THR O O 7.537 1.018 -10.906 1.00 . A A . 25 THR O 1 1 31 19593 1 1 25 THR OG1 O 3.669 2.158 -9.461 1.00 . A A . 25 THR OG1 1 1 31 19594 1 1 26 SER C C 7.536 2.358 -13.928 1.00 . A A . 26 SER C 1 1 31 19595 1 1 26 SER CA C 7.287 0.876 -13.661 1.00 . A A . 26 SER CA 1 1 31 19596 1 1 26 SER CB C 6.949 0.156 -14.969 1.00 . A A . 26 SER CB 1 1 31 19597 1 1 26 SER H H 5.302 0.517 -13.016 1.00 . A A . 26 SER H 1 1 31 19598 1 1 26 SER HA H 8.182 0.442 -13.242 1.00 . A A . 26 SER HA 1 1 31 19599 1 1 26 SER HB2 H 5.962 0.450 -15.295 1.00 . A A . 26 SER HB2 1 1 31 19600 1 1 26 SER HB3 H 7.673 0.427 -15.724 1.00 . A A . 26 SER HB3 1 1 31 19601 1 1 26 SER HG H 7.871 -1.538 -14.627 1.00 . A A . 26 SER HG 1 1 31 19602 1 1 26 SER N N 6.209 0.700 -12.694 1.00 . A A . 26 SER N 1 1 31 19603 1 1 26 SER O O 7.527 2.805 -15.075 1.00 . A A . 26 SER O 1 1 31 19604 1 1 26 SER OG O 6.971 -1.251 -14.798 1.00 . A A . 26 SER OG 1 1 31 19605 1 1 27 VAL C C 8.116 5.169 -11.568 1.00 . A A . 27 VAL C 1 1 31 19606 1 1 27 VAL CA C 8.007 4.545 -12.954 1.00 . A A . 27 VAL CA 1 1 31 19607 1 1 27 VAL CB C 6.889 5.265 -13.738 1.00 . A A . 27 VAL CB 1 1 31 19608 1 1 27 VAL CG1 C 5.545 5.081 -13.047 1.00 . A A . 27 VAL CG1 1 1 31 19609 1 1 27 VAL CG2 C 7.214 6.743 -13.900 1.00 . A A . 27 VAL CG2 1 1 31 19610 1 1 27 VAL H H 7.752 2.694 -11.971 1.00 . A A . 27 VAL H 1 1 31 19611 1 1 27 VAL HA H 8.939 4.688 -13.479 1.00 . A A . 27 VAL HA 1 1 31 19612 1 1 27 VAL HB H 6.824 4.825 -14.722 1.00 . A A . 27 VAL HB 1 1 31 19613 1 1 27 VAL HG11 H 5.373 4.030 -12.870 1.00 . A A . 27 VAL HG11 1 1 31 19614 1 1 27 VAL HG12 H 5.550 5.609 -12.104 1.00 . A A . 27 VAL HG12 1 1 31 19615 1 1 27 VAL HG13 H 4.760 5.474 -13.676 1.00 . A A . 27 VAL HG13 1 1 31 19616 1 1 27 VAL HG21 H 8.278 6.865 -14.038 1.00 . A A . 27 VAL HG21 1 1 31 19617 1 1 27 VAL HG22 H 6.691 7.135 -14.760 1.00 . A A . 27 VAL HG22 1 1 31 19618 1 1 27 VAL HG23 H 6.902 7.279 -13.015 1.00 . A A . 27 VAL HG23 1 1 31 19619 1 1 27 VAL N N 7.757 3.112 -12.855 1.00 . A A . 27 VAL N 1 1 31 19620 1 1 27 VAL O O 8.895 6.097 -11.350 1.00 . A A . 27 VAL O 1 1 31 19621 1 1 28 SER C C 7.143 4.033 -8.260 1.00 . A A . 28 SER C 1 1 31 19622 1 1 28 SER CA C 7.316 5.164 -9.270 1.00 . A A . 28 SER CA 1 1 31 19623 1 1 28 SER CB C 6.194 6.187 -9.098 1.00 . A A . 28 SER CB 1 1 31 19624 1 1 28 SER H H 6.717 3.922 -10.873 1.00 . A A . 28 SER H 1 1 31 19625 1 1 28 SER HA H 8.264 5.649 -9.093 1.00 . A A . 28 SER HA 1 1 31 19626 1 1 28 SER HB2 H 6.029 6.699 -10.034 1.00 . A A . 28 SER HB2 1 1 31 19627 1 1 28 SER HB3 H 5.287 5.677 -8.803 1.00 . A A . 28 SER HB3 1 1 31 19628 1 1 28 SER HG H 6.713 7.987 -8.526 1.00 . A A . 28 SER HG 1 1 31 19629 1 1 28 SER N N 7.320 4.656 -10.635 1.00 . A A . 28 SER N 1 1 31 19630 1 1 28 SER O O 6.275 3.174 -8.416 1.00 . A A . 28 SER O 1 1 31 19631 1 1 28 SER OG O 6.523 7.145 -8.107 1.00 . A A . 28 SER OG 1 1 31 19632 1 1 29 SER C C 7.563 3.671 -4.832 1.00 . A A . 29 SER C 1 1 31 19633 1 1 29 SER CA C 7.904 3.031 -6.173 1.00 . A A . 29 SER CA 1 1 31 19634 1 1 29 SER CB C 9.233 2.280 -6.073 1.00 . A A . 29 SER CB 1 1 31 19635 1 1 29 SER H H 8.635 4.763 -7.147 1.00 . A A . 29 SER H 1 1 31 19636 1 1 29 SER HA H 7.121 2.335 -6.435 1.00 . A A . 29 SER HA 1 1 31 19637 1 1 29 SER HB2 H 9.194 1.592 -5.242 1.00 . A A . 29 SER HB2 1 1 31 19638 1 1 29 SER HB3 H 9.402 1.730 -6.988 1.00 . A A . 29 SER HB3 1 1 31 19639 1 1 29 SER HG H 10.131 3.730 -5.111 1.00 . A A . 29 SER HG 1 1 31 19640 1 1 29 SER N N 7.969 4.047 -7.218 1.00 . A A . 29 SER N 1 1 31 19641 1 1 29 SER O O 8.344 4.452 -4.290 1.00 . A A . 29 SER O 1 1 31 19642 1 1 29 SER OG O 10.312 3.176 -5.873 1.00 . A A . 29 SER OG 1 1 31 19643 1 1 30 HIS C C 5.826 2.837 -1.963 1.00 . A A . 30 HIS C 1 1 31 19644 1 1 30 HIS CA C 5.929 3.908 -3.044 1.00 . A A . 30 HIS CA 1 1 31 19645 1 1 30 HIS CB C 4.575 4.591 -3.235 1.00 . A A . 30 HIS CB 1 1 31 19646 1 1 30 HIS CD2 C 5.113 5.554 -5.583 1.00 . A A . 30 HIS CD2 1 1 31 19647 1 1 30 HIS CE1 C 4.106 7.489 -5.375 1.00 . A A . 30 HIS CE1 1 1 31 19648 1 1 30 HIS CG C 4.568 5.598 -4.343 1.00 . A A . 30 HIS CG 1 1 31 19649 1 1 30 HIS H H 5.799 2.731 -4.798 1.00 . A A . 30 HIS H 1 1 31 19650 1 1 30 HIS HA H 6.651 4.648 -2.731 1.00 . A A . 30 HIS HA 1 1 31 19651 1 1 30 HIS HB2 H 3.831 3.841 -3.464 1.00 . A A . 30 HIS HB2 1 1 31 19652 1 1 30 HIS HB3 H 4.301 5.097 -2.321 1.00 . A A . 30 HIS HB3 1 1 31 19653 1 1 30 HIS HD1 H 3.455 7.156 -3.463 1.00 . A A . 30 HIS HD1 1 1 31 19654 1 1 30 HIS HD2 H 5.676 4.734 -6.009 1.00 . A A . 30 HIS HD2 1 1 31 19655 1 1 30 HIS HE1 H 3.724 8.476 -5.588 1.00 . A A . 30 HIS HE1 1 1 31 19656 1 1 30 HIS HE2 H 5.181 7.046 -7.056 1.00 . A A . 30 HIS HE2 1 1 31 19657 1 1 30 HIS N N 6.383 3.349 -4.312 1.00 . A A . 30 HIS N 1 1 31 19658 1 1 30 HIS ND1 N 3.944 6.824 -4.245 1.00 . A A . 30 HIS ND1 1 1 31 19659 1 1 30 HIS NE2 N 4.811 6.742 -6.202 1.00 . A A . 30 HIS NE2 1 1 31 19660 1 1 30 HIS O O 5.863 1.641 -2.251 1.00 . A A . 30 HIS O 1 1 31 19661 1 1 31 TYR C C 4.230 2.529 1.105 1.00 . A A . 31 TYR C 1 1 31 19662 1 1 31 TYR CA C 5.583 2.373 0.419 1.00 . A A . 31 TYR CA 1 1 31 19663 1 1 31 TYR CB C 6.705 2.643 1.423 1.00 . A A . 31 TYR CB 1 1 31 19664 1 1 31 TYR CD1 C 8.456 0.929 2.025 1.00 . A A . 31 TYR CD1 1 1 31 19665 1 1 31 TYR CD2 C 8.701 2.113 -0.029 1.00 . A A . 31 TYR CD2 1 1 31 19666 1 1 31 TYR CE1 C 9.619 0.231 1.767 1.00 . A A . 31 TYR CE1 1 1 31 19667 1 1 31 TYR CE2 C 9.866 1.418 -0.295 1.00 . A A . 31 TYR CE2 1 1 31 19668 1 1 31 TYR CG C 7.978 1.881 1.134 1.00 . A A . 31 TYR CG 1 1 31 19669 1 1 31 TYR CZ C 10.320 0.478 0.606 1.00 . A A . 31 TYR CZ 1 1 31 19670 1 1 31 TYR H H 5.671 4.248 -0.556 1.00 . A A . 31 TYR H 1 1 31 19671 1 1 31 TYR HA H 5.675 1.363 0.050 1.00 . A A . 31 TYR HA 1 1 31 19672 1 1 31 TYR HB2 H 6.942 3.696 1.413 1.00 . A A . 31 TYR HB2 1 1 31 19673 1 1 31 TYR HB3 H 6.368 2.364 2.411 1.00 . A A . 31 TYR HB3 1 1 31 19674 1 1 31 TYR HD1 H 7.904 0.738 2.933 1.00 . A A . 31 TYR HD1 1 1 31 19675 1 1 31 TYR HD2 H 8.343 2.851 -0.732 1.00 . A A . 31 TYR HD2 1 1 31 19676 1 1 31 TYR HE1 H 9.974 -0.505 2.473 1.00 . A A . 31 TYR HE1 1 1 31 19677 1 1 31 TYR HE2 H 10.415 1.614 -1.204 1.00 . A A . 31 TYR HE2 1 1 31 19678 1 1 31 TYR HH H 11.487 -0.493 -0.574 1.00 . A A . 31 TYR HH 1 1 31 19679 1 1 31 TYR N N 5.695 3.282 -0.716 1.00 . A A . 31 TYR N 1 1 31 19680 1 1 31 TYR O O 3.599 3.582 1.017 1.00 . A A . 31 TYR O 1 1 31 19681 1 1 31 TYR OH O 11.480 -0.216 0.345 1.00 . A A . 31 TYR OH 1 1 31 19682 1 1 32 CYS C C 2.709 1.796 3.975 1.00 . A A . 32 CYS C 1 1 31 19683 1 1 32 CYS CA C 2.511 1.512 2.491 1.00 . A A . 32 CYS CA 1 1 31 19684 1 1 32 CYS CB C 1.759 0.192 2.306 1.00 . A A . 32 CYS CB 1 1 31 19685 1 1 32 CYS H H 4.336 0.666 1.829 1.00 . A A . 32 CYS H 1 1 31 19686 1 1 32 CYS HA H 1.924 2.310 2.065 1.00 . A A . 32 CYS HA 1 1 31 19687 1 1 32 CYS HB2 H 2.169 -0.333 1.456 1.00 . A A . 32 CYS HB2 1 1 31 19688 1 1 32 CYS HB3 H 1.884 -0.413 3.192 1.00 . A A . 32 CYS HB3 1 1 31 19689 1 1 32 CYS N N 3.789 1.479 1.791 1.00 . A A . 32 CYS N 1 1 31 19690 1 1 32 CYS O O 3.838 1.861 4.461 1.00 . A A . 32 CYS O 1 1 31 19691 1 1 32 CYS SG S -0.030 0.399 2.022 1.00 . A A . 32 CYS SG 1 1 31 19692 1 1 33 THR C C 0.855 1.219 6.913 1.00 . A A . 33 THR C 1 1 31 19693 1 1 33 THR CA C 1.650 2.254 6.118 1.00 . A A . 33 THR CA 1 1 31 19694 1 1 33 THR CB C 1.103 3.657 6.398 1.00 . A A . 33 THR CB 1 1 31 19695 1 1 33 THR CG2 C 1.500 4.677 5.351 1.00 . A A . 33 THR CG2 1 1 31 19696 1 1 33 THR H H 0.733 1.909 4.241 1.00 . A A . 33 THR H 1 1 31 19697 1 1 33 THR HA H 2.682 2.212 6.430 1.00 . A A . 33 THR HA 1 1 31 19698 1 1 33 THR HB H 1.484 3.996 7.351 1.00 . A A . 33 THR HB 1 1 31 19699 1 1 33 THR HG1 H -0.587 3.462 7.367 1.00 . A A . 33 THR HG1 1 1 31 19700 1 1 33 THR HG21 H 1.191 4.331 4.375 1.00 . A A . 33 THR HG21 1 1 31 19701 1 1 33 THR HG22 H 1.020 5.620 5.567 1.00 . A A . 33 THR HG22 1 1 31 19702 1 1 33 THR HG23 H 2.572 4.807 5.363 1.00 . A A . 33 THR HG23 1 1 31 19703 1 1 33 THR N N 1.603 1.970 4.688 1.00 . A A . 33 THR N 1 1 31 19704 1 1 33 THR O O 0.524 1.440 8.077 1.00 . A A . 33 THR O 1 1 31 19705 1 1 33 THR OG1 O -0.312 3.641 6.465 1.00 . A A . 33 THR OG1 1 1 31 19706 1 1 34 GLY C C -1.478 -0.451 7.588 1.00 . A A . 34 GLY C 1 1 31 19707 1 1 34 GLY CA C -0.200 -0.961 6.947 1.00 . A A . 34 GLY CA 1 1 31 19708 1 1 34 GLY H H 0.842 -0.038 5.351 1.00 . A A . 34 GLY H 1 1 31 19709 1 1 34 GLY HA2 H 0.422 -1.401 7.713 1.00 . A A . 34 GLY HA2 1 1 31 19710 1 1 34 GLY HA3 H -0.453 -1.722 6.224 1.00 . A A . 34 GLY HA3 1 1 31 19711 1 1 34 GLY N N 0.552 0.088 6.279 1.00 . A A . 34 GLY N 1 1 31 19712 1 1 34 GLY O O -1.978 -1.042 8.545 1.00 . A A . 34 GLY O 1 1 31 19713 1 1 35 ARG C C -4.339 1.226 6.540 1.00 . A A . 35 ARG C 1 1 31 19714 1 1 35 ARG CA C -3.235 1.236 7.590 1.00 . A A . 35 ARG CA 1 1 31 19715 1 1 35 ARG CB C -2.978 2.667 8.064 1.00 . A A . 35 ARG CB 1 1 31 19716 1 1 35 ARG CD C -3.828 4.600 9.426 1.00 . A A . 35 ARG CD 1 1 31 19717 1 1 35 ARG CG C -4.202 3.338 8.666 1.00 . A A . 35 ARG CG 1 1 31 19718 1 1 35 ARG CZ C -4.932 6.610 10.329 1.00 . A A . 35 ARG CZ 1 1 31 19719 1 1 35 ARG H H -1.564 1.076 6.299 1.00 . A A . 35 ARG H 1 1 31 19720 1 1 35 ARG HA H -3.551 0.639 8.430 1.00 . A A . 35 ARG HA 1 1 31 19721 1 1 35 ARG HB2 H -2.198 2.652 8.812 1.00 . A A . 35 ARG HB2 1 1 31 19722 1 1 35 ARG HB3 H -2.647 3.259 7.223 1.00 . A A . 35 ARG HB3 1 1 31 19723 1 1 35 ARG HD2 H -3.363 4.319 10.359 1.00 . A A . 35 ARG HD2 1 1 31 19724 1 1 35 ARG HD3 H -3.128 5.168 8.832 1.00 . A A . 35 ARG HD3 1 1 31 19725 1 1 35 ARG HE H -5.870 5.098 9.426 1.00 . A A . 35 ARG HE 1 1 31 19726 1 1 35 ARG HG2 H -4.885 3.597 7.871 1.00 . A A . 35 ARG HG2 1 1 31 19727 1 1 35 ARG HG3 H -4.681 2.648 9.345 1.00 . A A . 35 ARG HG3 1 1 31 19728 1 1 35 ARG HH11 H -2.923 6.579 10.566 1.00 . A A . 35 ARG HH11 1 1 31 19729 1 1 35 ARG HH12 H -3.722 7.981 11.192 1.00 . A A . 35 ARG HH12 1 1 31 19730 1 1 35 ARG HH21 H -6.924 6.942 10.248 1.00 . A A . 35 ARG HH21 1 1 31 19731 1 1 35 ARG HH22 H -5.994 8.188 11.012 1.00 . A A . 35 ARG HH22 1 1 31 19732 1 1 35 ARG N N -2.008 0.649 7.061 1.00 . A A . 35 ARG N 1 1 31 19733 1 1 35 ARG NE N -4.995 5.433 9.710 1.00 . A A . 35 ARG NE 1 1 31 19734 1 1 35 ARG NH1 N -3.763 7.096 10.728 1.00 . A A . 35 ARG NH1 1 1 31 19735 1 1 35 ARG NH2 N -6.040 7.304 10.548 1.00 . A A . 35 ARG NH2 1 1 31 19736 1 1 35 ARG O O -5.490 0.905 6.835 1.00 . A A . 35 ARG O 1 1 31 19737 1 1 36 SER C C -4.354 0.927 2.977 1.00 . A A . 36 SER C 1 1 31 19738 1 1 36 SER CA C -4.932 1.610 4.211 1.00 . A A . 36 SER CA 1 1 31 19739 1 1 36 SER CB C -5.313 3.054 3.879 1.00 . A A . 36 SER CB 1 1 31 19740 1 1 36 SER H H -3.044 1.820 5.144 1.00 . A A . 36 SER H 1 1 31 19741 1 1 36 SER HA H -5.817 1.076 4.523 1.00 . A A . 36 SER HA 1 1 31 19742 1 1 36 SER HB2 H -5.304 3.643 4.784 1.00 . A A . 36 SER HB2 1 1 31 19743 1 1 36 SER HB3 H -4.598 3.460 3.178 1.00 . A A . 36 SER HB3 1 1 31 19744 1 1 36 SER HG H -6.562 2.853 2.383 1.00 . A A . 36 SER HG 1 1 31 19745 1 1 36 SER N N -3.978 1.578 5.313 1.00 . A A . 36 SER N 1 1 31 19746 1 1 36 SER O O -3.136 0.845 2.816 1.00 . A A . 36 SER O 1 1 31 19747 1 1 36 SER OG O -6.606 3.122 3.304 1.00 . A A . 36 SER OG 1 1 31 19748 1 1 37 CYS C C -4.475 0.771 -0.214 1.00 . A A . 37 CYS C 1 1 31 19749 1 1 37 CYS CA C -4.799 -0.237 0.888 1.00 . A A . 37 CYS CA 1 1 31 19750 1 1 37 CYS CB C -5.875 -1.212 0.407 1.00 . A A . 37 CYS CB 1 1 31 19751 1 1 37 CYS H H -6.190 0.534 2.286 1.00 . A A . 37 CYS H 1 1 31 19752 1 1 37 CYS HA H -3.904 -0.793 1.122 1.00 . A A . 37 CYS HA 1 1 31 19753 1 1 37 CYS HB2 H -6.823 -0.697 0.361 1.00 . A A . 37 CYS HB2 1 1 31 19754 1 1 37 CYS HB3 H -5.615 -1.565 -0.578 1.00 . A A . 37 CYS HB3 1 1 31 19755 1 1 37 CYS N N -5.232 0.438 2.106 1.00 . A A . 37 CYS N 1 1 31 19756 1 1 37 CYS O O -4.086 0.390 -1.318 1.00 . A A . 37 CYS O 1 1 31 19757 1 1 37 CYS SG S -6.087 -2.669 1.484 1.00 . A A . 37 CYS SG 1 1 31 19758 1 1 38 GLU C C -2.904 3.577 -0.767 1.00 . A A . 38 GLU C 1 1 31 19759 1 1 38 GLU CA C -4.353 3.111 -0.876 1.00 . A A . 38 GLU CA 1 1 31 19760 1 1 38 GLU CB C -5.299 4.293 -0.661 1.00 . A A . 38 GLU CB 1 1 31 19761 1 1 38 GLU CD C -7.439 2.962 -0.818 1.00 . A A . 38 GLU CD 1 1 31 19762 1 1 38 GLU CG C -6.641 4.133 -1.356 1.00 . A A . 38 GLU CG 1 1 31 19763 1 1 38 GLU H H -4.945 2.302 0.987 1.00 . A A . 38 GLU H 1 1 31 19764 1 1 38 GLU HA H -4.515 2.706 -1.863 1.00 . A A . 38 GLU HA 1 1 31 19765 1 1 38 GLU HB2 H -5.478 4.409 0.397 1.00 . A A . 38 GLU HB2 1 1 31 19766 1 1 38 GLU HB3 H -4.828 5.189 -1.038 1.00 . A A . 38 GLU HB3 1 1 31 19767 1 1 38 GLU HG2 H -7.216 5.036 -1.214 1.00 . A A . 38 GLU HG2 1 1 31 19768 1 1 38 GLU HG3 H -6.469 3.978 -2.412 1.00 . A A . 38 GLU HG3 1 1 31 19769 1 1 38 GLU N N -4.634 2.056 0.091 1.00 . A A . 38 GLU N 1 1 31 19770 1 1 38 GLU O O -2.591 4.492 -0.005 1.00 . A A . 38 GLU O 1 1 31 19771 1 1 38 GLU OE1 O -8.103 2.275 -1.624 1.00 . A A . 38 GLU OE1 1 1 31 19772 1 1 38 GLU OE2 O -7.401 2.730 0.409 1.00 . A A . 38 GLU OE2 1 1 31 19773 1 1 39 CYS C C -0.406 4.800 -1.647 1.00 . A A . 39 CYS C 1 1 31 19774 1 1 39 CYS CA C -0.603 3.286 -1.532 1.00 . A A . 39 CYS CA 1 1 31 19775 1 1 39 CYS CB C 0.113 2.578 -2.686 1.00 . A A . 39 CYS CB 1 1 31 19776 1 1 39 CYS H H -2.336 2.221 -2.120 1.00 . A A . 39 CYS H 1 1 31 19777 1 1 39 CYS HA H -0.182 2.946 -0.597 1.00 . A A . 39 CYS HA 1 1 31 19778 1 1 39 CYS HB2 H -0.341 1.612 -2.843 1.00 . A A . 39 CYS HB2 1 1 31 19779 1 1 39 CYS HB3 H 0.004 3.170 -3.585 1.00 . A A . 39 CYS HB3 1 1 31 19780 1 1 39 CYS N N -2.023 2.941 -1.535 1.00 . A A . 39 CYS N 1 1 31 19781 1 1 39 CYS O O -0.770 5.403 -2.656 1.00 . A A . 39 CYS O 1 1 31 19782 1 1 39 CYS SG S 1.896 2.311 -2.411 1.00 . A A . 39 CYS SG 1 1 31 19783 1 1 40 PRO C C 1.060 7.375 -1.895 1.00 . A A . 40 PRO C 1 1 31 19784 1 1 40 PRO CA C 0.408 6.885 -0.606 1.00 . A A . 40 PRO CA 1 1 31 19785 1 1 40 PRO CB C 1.351 7.082 0.580 1.00 . A A . 40 PRO CB 1 1 31 19786 1 1 40 PRO CD C 0.637 4.800 0.639 1.00 . A A . 40 PRO CD 1 1 31 19787 1 1 40 PRO CG C 1.024 5.966 1.508 1.00 . A A . 40 PRO CG 1 1 31 19788 1 1 40 PRO HA H -0.507 7.433 -0.437 1.00 . A A . 40 PRO HA 1 1 31 19789 1 1 40 PRO HB2 H 2.376 7.030 0.241 1.00 . A A . 40 PRO HB2 1 1 31 19790 1 1 40 PRO HB3 H 1.164 8.043 1.037 1.00 . A A . 40 PRO HB3 1 1 31 19791 1 1 40 PRO HD2 H 1.493 4.168 0.452 1.00 . A A . 40 PRO HD2 1 1 31 19792 1 1 40 PRO HD3 H -0.158 4.233 1.100 1.00 . A A . 40 PRO HD3 1 1 31 19793 1 1 40 PRO HG2 H 1.891 5.718 2.104 1.00 . A A . 40 PRO HG2 1 1 31 19794 1 1 40 PRO HG3 H 0.199 6.248 2.145 1.00 . A A . 40 PRO HG3 1 1 31 19795 1 1 40 PRO N N 0.172 5.437 -0.610 1.00 . A A . 40 PRO N 1 1 31 19796 1 1 40 PRO O O 1.469 6.577 -2.738 1.00 . A A . 40 PRO O 1 1 31 19797 1 1 41 SER C C 3.208 9.674 -2.971 1.00 . A A . 41 SER C 1 1 31 19798 1 1 41 SER CA C 1.754 9.291 -3.227 1.00 . A A . 41 SER CA 1 1 31 19799 1 1 41 SER CB C 0.958 10.524 -3.659 1.00 . A A . 41 SER CB 1 1 31 19800 1 1 41 SER H H 0.807 9.277 -1.333 1.00 . A A . 41 SER H 1 1 31 19801 1 1 41 SER HA H 1.722 8.558 -4.019 1.00 . A A . 41 SER HA 1 1 31 19802 1 1 41 SER HB2 H 0.483 10.964 -2.795 1.00 . A A . 41 SER HB2 1 1 31 19803 1 1 41 SER HB3 H 1.629 11.243 -4.107 1.00 . A A . 41 SER HB3 1 1 31 19804 1 1 41 SER HG H -0.870 10.021 -4.149 1.00 . A A . 41 SER HG 1 1 31 19805 1 1 41 SER N N 1.152 8.693 -2.040 1.00 . A A . 41 SER N 1 1 31 19806 1 1 41 SER O O 3.741 10.582 -3.609 1.00 . A A . 41 SER O 1 1 31 19807 1 1 41 SER OG O -0.041 10.182 -4.604 1.00 . A A . 41 SER OG 1 1 31 19808 1 1 42 TYR C C 6.069 7.964 -1.764 1.00 . A A . 42 TYR C 1 1 31 19809 1 1 42 TYR CA C 5.241 9.245 -1.703 1.00 . A A . 42 TYR CA 1 1 31 19810 1 1 42 TYR CB C 5.346 9.871 -0.310 1.00 . A A . 42 TYR CB 1 1 31 19811 1 1 42 TYR CD1 C 5.646 7.862 1.192 1.00 . A A . 42 TYR CD1 1 1 31 19812 1 1 42 TYR CD2 C 3.688 9.194 1.471 1.00 . A A . 42 TYR CD2 1 1 31 19813 1 1 42 TYR CE1 C 5.228 7.027 2.211 1.00 . A A . 42 TYR CE1 1 1 31 19814 1 1 42 TYR CE2 C 3.264 8.363 2.491 1.00 . A A . 42 TYR CE2 1 1 31 19815 1 1 42 TYR CG C 4.884 8.958 0.805 1.00 . A A . 42 TYR CG 1 1 31 19816 1 1 42 TYR CZ C 4.037 7.282 2.857 1.00 . A A . 42 TYR CZ 1 1 31 19817 1 1 42 TYR H H 3.372 8.263 -1.562 1.00 . A A . 42 TYR H 1 1 31 19818 1 1 42 TYR HA H 5.626 9.944 -2.430 1.00 . A A . 42 TYR HA 1 1 31 19819 1 1 42 TYR HB2 H 6.375 10.133 -0.117 1.00 . A A . 42 TYR HB2 1 1 31 19820 1 1 42 TYR HB3 H 4.740 10.765 -0.279 1.00 . A A . 42 TYR HB3 1 1 31 19821 1 1 42 TYR HD1 H 6.579 7.665 0.684 1.00 . A A . 42 TYR HD1 1 1 31 19822 1 1 42 TYR HD2 H 3.084 10.041 1.182 1.00 . A A . 42 TYR HD2 1 1 31 19823 1 1 42 TYR HE1 H 5.834 6.181 2.497 1.00 . A A . 42 TYR HE1 1 1 31 19824 1 1 42 TYR HE2 H 2.331 8.563 2.996 1.00 . A A . 42 TYR HE2 1 1 31 19825 1 1 42 TYR HH H 3.769 6.881 4.718 1.00 . A A . 42 TYR HH 1 1 31 19826 1 1 42 TYR N N 3.847 8.977 -2.036 1.00 . A A . 42 TYR N 1 1 31 19827 1 1 42 TYR O O 5.579 6.883 -1.440 1.00 . A A . 42 TYR O 1 1 31 19828 1 1 42 TYR OH O 3.618 6.453 3.872 1.00 . A A . 42 TYR OH 1 1 31 19829 1 1 43 PRO C C 8.430 6.203 -0.951 1.00 . A A . 43 PRO C 1 1 31 19830 1 1 43 PRO CA C 8.234 6.908 -2.290 1.00 . A A . 43 PRO CA 1 1 31 19831 1 1 43 PRO CB C 9.557 7.502 -2.792 1.00 . A A . 43 PRO CB 1 1 31 19832 1 1 43 PRO CD C 8.008 9.314 -2.595 1.00 . A A . 43 PRO CD 1 1 31 19833 1 1 43 PRO CG C 9.466 8.964 -2.510 1.00 . A A . 43 PRO CG 1 1 31 19834 1 1 43 PRO HA H 7.865 6.197 -3.010 1.00 . A A . 43 PRO HA 1 1 31 19835 1 1 43 PRO HB2 H 10.381 7.050 -2.259 1.00 . A A . 43 PRO HB2 1 1 31 19836 1 1 43 PRO HB3 H 9.660 7.312 -3.850 1.00 . A A . 43 PRO HB3 1 1 31 19837 1 1 43 PRO HD2 H 7.773 10.120 -1.915 1.00 . A A . 43 PRO HD2 1 1 31 19838 1 1 43 PRO HD3 H 7.741 9.580 -3.607 1.00 . A A . 43 PRO HD3 1 1 31 19839 1 1 43 PRO HG2 H 9.845 9.173 -1.521 1.00 . A A . 43 PRO HG2 1 1 31 19840 1 1 43 PRO HG3 H 10.026 9.516 -3.251 1.00 . A A . 43 PRO HG3 1 1 31 19841 1 1 43 PRO N N 7.342 8.067 -2.186 1.00 . A A . 43 PRO N 1 1 31 19842 1 1 43 PRO O O 7.851 5.144 -0.707 1.00 . A A . 43 PRO O 1 1 31 19843 1 1 44 GLY C C 9.109 7.129 2.353 1.00 . A A . 44 GLY C 1 1 31 19844 1 1 44 GLY CA C 9.503 6.208 1.215 1.00 . A A . 44 GLY CA 1 1 31 19845 1 1 44 GLY H H 9.679 7.635 -0.337 1.00 . A A . 44 GLY H 1 1 31 19846 1 1 44 GLY HA2 H 10.556 5.984 1.296 1.00 . A A . 44 GLY HA2 1 1 31 19847 1 1 44 GLY HA3 H 8.943 5.288 1.301 1.00 . A A . 44 GLY HA3 1 1 31 19848 1 1 44 GLY N N 9.246 6.794 -0.088 1.00 . A A . 44 GLY N 1 1 31 19849 1 1 44 GLY O O 7.933 7.227 2.703 1.00 . A A . 44 GLY O 1 1 31 19850 1 1 45 ASN C C 9.234 7.988 5.227 1.00 . A A . 45 ASN C 1 1 31 19851 1 1 45 ASN CA C 9.846 8.723 4.038 1.00 . A A . 45 ASN CA 1 1 31 19852 1 1 45 ASN CB C 8.920 9.854 3.590 1.00 . A A . 45 ASN CB 1 1 31 19853 1 1 45 ASN CG C 9.315 11.193 4.182 1.00 . A A . 45 ASN CG 1 1 31 19854 1 1 45 ASN H H 11.013 7.684 2.609 1.00 . A A . 45 ASN H 1 1 31 19855 1 1 45 ASN HA H 10.794 9.143 4.339 1.00 . A A . 45 ASN HA 1 1 31 19856 1 1 45 ASN HB2 H 8.953 9.934 2.514 1.00 . A A . 45 ASN HB2 1 1 31 19857 1 1 45 ASN HB3 H 7.910 9.628 3.899 1.00 . A A . 45 ASN HB3 1 1 31 19858 1 1 45 ASN HD21 H 9.986 11.805 2.413 1.00 . A A . 45 ASN HD21 1 1 31 19859 1 1 45 ASN HD22 H 10.131 12.942 3.705 1.00 . A A . 45 ASN HD22 1 1 31 19860 1 1 45 ASN N N 10.095 7.805 2.933 1.00 . A A . 45 ASN N 1 1 31 19861 1 1 45 ASN ND2 N 9.866 12.069 3.349 1.00 . A A . 45 ASN ND2 1 1 31 19862 1 1 45 ASN O O 9.168 6.759 5.243 1.00 . A A . 45 ASN O 1 1 31 19863 1 1 45 ASN OD1 O 9.126 11.439 5.373 1.00 . A A . 45 ASN OD1 1 1 31 19864 1 1 46 GLY C C 8.542 8.900 8.671 1.00 . A A . 46 GLY C 1 1 31 19865 1 1 46 GLY CA C 8.188 8.154 7.400 1.00 . A A . 46 GLY CA 1 1 31 19866 1 1 46 GLY H H 8.867 9.725 6.153 1.00 . A A . 46 GLY H 1 1 31 19867 1 1 46 GLY HA2 H 8.529 7.134 7.487 1.00 . A A . 46 GLY HA2 1 1 31 19868 1 1 46 GLY HA3 H 7.114 8.155 7.282 1.00 . A A . 46 GLY HA3 1 1 31 19869 1 1 46 GLY N N 8.788 8.750 6.221 1.00 . A A . 46 GLY N 1 1 31 19870 1 1 46 GLY O O 9.493 9.710 8.639 1.00 . A A . 46 GLY O 1 1 31 19871 1 1 46 GLY OXT O 7.868 8.675 9.698 1.00 . A A . 46 GLY OXT 1 1 32 19872 1 1 1 ALA C C -19.332 -7.297 5.041 1.00 . A A . 1 ALA C 1 1 32 19873 1 1 1 ALA CA C -20.620 -7.439 4.237 1.00 . A A . 1 ALA CA 1 1 32 19874 1 1 1 ALA CB C -20.667 -8.798 3.554 1.00 . A A . 1 ALA CB 1 1 32 19875 1 1 1 ALA H1 H -20.508 -5.456 3.703 1.00 . A A . 1 ALA H1 1 1 32 19876 1 1 1 ALA H2 H -20.078 -6.559 2.459 1.00 . A A . 1 ALA H2 1 1 32 19877 1 1 1 ALA H3 H -21.726 -6.347 2.890 1.00 . A A . 1 ALA H3 1 1 32 19878 1 1 1 ALA HA H -21.460 -7.375 4.913 1.00 . A A . 1 ALA HA 1 1 32 19879 1 1 1 ALA HB1 H -20.266 -8.712 2.554 1.00 . A A . 1 ALA HB1 1 1 32 19880 1 1 1 ALA HB2 H -20.078 -9.506 4.118 1.00 . A A . 1 ALA HB2 1 1 32 19881 1 1 1 ALA HB3 H -21.690 -9.140 3.503 1.00 . A A . 1 ALA HB3 1 1 32 19882 1 1 1 ALA N N -20.744 -6.352 3.232 1.00 . A A . 1 ALA N 1 1 32 19883 1 1 1 ALA O O -19.347 -7.341 6.271 1.00 . A A . 1 ALA O 1 1 32 19884 1 1 2 MET C C -16.106 -5.868 4.324 1.00 . A A . 2 MET C 1 1 32 19885 1 1 2 MET CA C -16.920 -6.976 4.985 1.00 . A A . 2 MET CA 1 1 32 19886 1 1 2 MET CB C -16.145 -8.294 4.933 1.00 . A A . 2 MET CB 1 1 32 19887 1 1 2 MET CE C -14.411 -10.875 5.293 1.00 . A A . 2 MET CE 1 1 32 19888 1 1 2 MET CG C -16.581 -9.298 5.988 1.00 . A A . 2 MET CG 1 1 32 19889 1 1 2 MET H H -18.269 -7.098 3.359 1.00 . A A . 2 MET H 1 1 32 19890 1 1 2 MET HA H -17.093 -6.712 6.017 1.00 . A A . 2 MET HA 1 1 32 19891 1 1 2 MET HB2 H -16.286 -8.743 3.960 1.00 . A A . 2 MET HB2 1 1 32 19892 1 1 2 MET HB3 H -15.095 -8.087 5.076 1.00 . A A . 2 MET HB3 1 1 32 19893 1 1 2 MET HE1 H -14.031 -10.020 5.832 1.00 . A A . 2 MET HE1 1 1 32 19894 1 1 2 MET HE2 H -13.934 -11.772 5.660 1.00 . A A . 2 MET HE2 1 1 32 19895 1 1 2 MET HE3 H -14.200 -10.760 4.240 1.00 . A A . 2 MET HE3 1 1 32 19896 1 1 2 MET HG2 H -16.084 -9.061 6.917 1.00 . A A . 2 MET HG2 1 1 32 19897 1 1 2 MET HG3 H -17.650 -9.218 6.122 1.00 . A A . 2 MET HG3 1 1 32 19898 1 1 2 MET N N -18.217 -7.125 4.337 1.00 . A A . 2 MET N 1 1 32 19899 1 1 2 MET O O -16.167 -5.680 3.109 1.00 . A A . 2 MET O 1 1 32 19900 1 1 2 MET SD S -16.181 -10.997 5.537 1.00 . A A . 2 MET SD 1 1 32 19901 1 1 3 ASP C C -13.115 -4.544 4.284 1.00 . A A . 3 ASP C 1 1 32 19902 1 1 3 ASP CA C -14.517 -4.049 4.626 1.00 . A A . 3 ASP CA 1 1 32 19903 1 1 3 ASP CB C -14.436 -2.921 5.656 1.00 . A A . 3 ASP CB 1 1 32 19904 1 1 3 ASP CG C -15.685 -2.063 5.674 1.00 . A A . 3 ASP CG 1 1 32 19905 1 1 3 ASP H H -15.337 -5.337 6.092 1.00 . A A . 3 ASP H 1 1 32 19906 1 1 3 ASP HA H -14.981 -3.671 3.728 1.00 . A A . 3 ASP HA 1 1 32 19907 1 1 3 ASP HB2 H -14.301 -3.348 6.639 1.00 . A A . 3 ASP HB2 1 1 32 19908 1 1 3 ASP HB3 H -13.590 -2.290 5.424 1.00 . A A . 3 ASP HB3 1 1 32 19909 1 1 3 ASP N N -15.344 -5.138 5.132 1.00 . A A . 3 ASP N 1 1 32 19910 1 1 3 ASP O O -12.357 -4.949 5.166 1.00 . A A . 3 ASP O 1 1 32 19911 1 1 3 ASP OD1 O -15.571 -0.843 5.434 1.00 . A A . 3 ASP OD1 1 1 32 19912 1 1 3 ASP OD2 O -16.779 -2.611 5.927 1.00 . A A . 3 ASP OD2 1 1 32 19913 1 1 4 CYS C C -10.577 -3.763 2.186 1.00 . A A . 4 CYS C 1 1 32 19914 1 1 4 CYS CA C -11.466 -4.952 2.541 1.00 . A A . 4 CYS CA 1 1 32 19915 1 1 4 CYS CB C -11.609 -5.871 1.326 1.00 . A A . 4 CYS CB 1 1 32 19916 1 1 4 CYS H H -13.425 -4.174 2.344 1.00 . A A . 4 CYS H 1 1 32 19917 1 1 4 CYS HA H -11.003 -5.503 3.346 1.00 . A A . 4 CYS HA 1 1 32 19918 1 1 4 CYS HB2 H -12.378 -5.479 0.677 1.00 . A A . 4 CYS HB2 1 1 32 19919 1 1 4 CYS HB3 H -10.671 -5.894 0.790 1.00 . A A . 4 CYS HB3 1 1 32 19920 1 1 4 CYS N N -12.777 -4.507 3.000 1.00 . A A . 4 CYS N 1 1 32 19921 1 1 4 CYS O O -9.351 -3.858 2.234 1.00 . A A . 4 CYS O 1 1 32 19922 1 1 4 CYS SG S -12.055 -7.590 1.736 1.00 . A A . 4 CYS SG 1 1 32 19923 1 1 5 THR C C -9.588 -1.714 0.232 1.00 . A A . 5 THR C 1 1 32 19924 1 1 5 THR CA C -10.460 -1.445 1.452 1.00 . A A . 5 THR CA 1 1 32 19925 1 1 5 THR CB C -9.599 -0.966 2.622 1.00 . A A . 5 THR CB 1 1 32 19926 1 1 5 THR CG2 C -9.428 0.537 2.663 1.00 . A A . 5 THR CG2 1 1 32 19927 1 1 5 THR H H -12.180 -2.630 1.797 1.00 . A A . 5 THR H 1 1 32 19928 1 1 5 THR HA H -11.176 -0.678 1.201 1.00 . A A . 5 THR HA 1 1 32 19929 1 1 5 THR HB H -8.617 -1.408 2.538 1.00 . A A . 5 THR HB 1 1 32 19930 1 1 5 THR HG1 H -11.077 -1.076 3.902 1.00 . A A . 5 THR HG1 1 1 32 19931 1 1 5 THR HG21 H -9.315 0.914 1.657 1.00 . A A . 5 THR HG21 1 1 32 19932 1 1 5 THR HG22 H -10.298 0.986 3.119 1.00 . A A . 5 THR HG22 1 1 32 19933 1 1 5 THR HG23 H -8.551 0.784 3.241 1.00 . A A . 5 THR HG23 1 1 32 19934 1 1 5 THR N N -11.201 -2.646 1.822 1.00 . A A . 5 THR N 1 1 32 19935 1 1 5 THR O O -8.368 -1.567 0.278 1.00 . A A . 5 THR O 1 1 32 19936 1 1 5 THR OG1 O -10.164 -1.368 3.858 1.00 . A A . 5 THR OG1 1 1 32 19937 1 1 6 THR C C -8.718 -1.208 -2.577 1.00 . A A . 6 THR C 1 1 32 19938 1 1 6 THR CA C -9.523 -2.411 -2.099 1.00 . A A . 6 THR CA 1 1 32 19939 1 1 6 THR CB C -10.512 -2.845 -3.181 1.00 . A A . 6 THR CB 1 1 32 19940 1 1 6 THR CG2 C -10.687 -4.346 -3.262 1.00 . A A . 6 THR CG2 1 1 32 19941 1 1 6 THR H H -11.204 -2.209 -0.827 1.00 . A A . 6 THR H 1 1 32 19942 1 1 6 THR HA H -8.843 -3.226 -1.901 1.00 . A A . 6 THR HA 1 1 32 19943 1 1 6 THR HB H -10.154 -2.501 -4.141 1.00 . A A . 6 THR HB 1 1 32 19944 1 1 6 THR HG1 H -12.005 -1.674 -3.669 1.00 . A A . 6 THR HG1 1 1 32 19945 1 1 6 THR HG21 H -10.005 -4.826 -2.574 1.00 . A A . 6 THR HG21 1 1 32 19946 1 1 6 THR HG22 H -11.702 -4.605 -3.002 1.00 . A A . 6 THR HG22 1 1 32 19947 1 1 6 THR HG23 H -10.477 -4.680 -4.268 1.00 . A A . 6 THR HG23 1 1 32 19948 1 1 6 THR N N -10.230 -2.112 -0.858 1.00 . A A . 6 THR N 1 1 32 19949 1 1 6 THR O O -9.280 -0.183 -2.963 1.00 . A A . 6 THR O 1 1 32 19950 1 1 6 THR OG1 O -11.789 -2.275 -2.953 1.00 . A A . 6 THR OG1 1 1 32 19951 1 1 7 GLY C C -5.106 -0.741 -3.227 1.00 . A A . 7 GLY C 1 1 32 19952 1 1 7 GLY CA C -6.527 -0.268 -2.982 1.00 . A A . 7 GLY CA 1 1 32 19953 1 1 7 GLY H H -7.008 -2.187 -2.232 1.00 . A A . 7 GLY H 1 1 32 19954 1 1 7 GLY HA2 H -6.515 0.499 -2.223 1.00 . A A . 7 GLY HA2 1 1 32 19955 1 1 7 GLY HA3 H -6.918 0.151 -3.898 1.00 . A A . 7 GLY HA3 1 1 32 19956 1 1 7 GLY N N -7.397 -1.345 -2.549 1.00 . A A . 7 GLY N 1 1 32 19957 1 1 7 GLY O O -4.740 -1.843 -2.819 1.00 . A A . 7 GLY O 1 1 32 19958 1 1 8 PRO C C -2.104 -0.673 -2.935 1.00 . A A . 8 PRO C 1 1 32 19959 1 1 8 PRO CA C -2.885 -0.287 -4.192 1.00 . A A . 8 PRO CA 1 1 32 19960 1 1 8 PRO CB C -2.302 0.978 -4.843 1.00 . A A . 8 PRO CB 1 1 32 19961 1 1 8 PRO CD C -4.622 1.400 -4.427 1.00 . A A . 8 PRO CD 1 1 32 19962 1 1 8 PRO CG C -3.285 2.067 -4.562 1.00 . A A . 8 PRO CG 1 1 32 19963 1 1 8 PRO HA H -2.839 -1.105 -4.897 1.00 . A A . 8 PRO HA 1 1 32 19964 1 1 8 PRO HB2 H -1.340 1.196 -4.410 1.00 . A A . 8 PRO HB2 1 1 32 19965 1 1 8 PRO HB3 H -2.191 0.817 -5.906 1.00 . A A . 8 PRO HB3 1 1 32 19966 1 1 8 PRO HD2 H -5.247 1.942 -3.733 1.00 . A A . 8 PRO HD2 1 1 32 19967 1 1 8 PRO HD3 H -5.104 1.318 -5.390 1.00 . A A . 8 PRO HD3 1 1 32 19968 1 1 8 PRO HG2 H -3.023 2.569 -3.644 1.00 . A A . 8 PRO HG2 1 1 32 19969 1 1 8 PRO HG3 H -3.298 2.768 -5.383 1.00 . A A . 8 PRO HG3 1 1 32 19970 1 1 8 PRO N N -4.275 0.073 -3.898 1.00 . A A . 8 PRO N 1 1 32 19971 1 1 8 PRO O O -1.139 -1.434 -3.007 1.00 . A A . 8 PRO O 1 1 32 19972 1 1 9 CYS C C -2.603 -1.634 0.192 1.00 . A A . 9 CYS C 1 1 32 19973 1 1 9 CYS CA C -1.880 -0.483 -0.509 1.00 . A A . 9 CYS CA 1 1 32 19974 1 1 9 CYS CB C -1.848 0.746 0.409 1.00 . A A . 9 CYS CB 1 1 32 19975 1 1 9 CYS H H -3.319 0.425 -1.780 1.00 . A A . 9 CYS H 1 1 32 19976 1 1 9 CYS HA H -0.867 -0.788 -0.726 1.00 . A A . 9 CYS HA 1 1 32 19977 1 1 9 CYS HB2 H -2.289 1.583 -0.110 1.00 . A A . 9 CYS HB2 1 1 32 19978 1 1 9 CYS HB3 H -2.426 0.539 1.297 1.00 . A A . 9 CYS HB3 1 1 32 19979 1 1 9 CYS N N -2.536 -0.164 -1.780 1.00 . A A . 9 CYS N 1 1 32 19980 1 1 9 CYS O O -2.441 -1.842 1.395 1.00 . A A . 9 CYS O 1 1 32 19981 1 1 9 CYS SG S -0.176 1.250 0.944 1.00 . A A . 9 CYS SG 1 1 32 19982 1 1 10 CYS C C -3.865 -4.773 -0.819 1.00 . A A . 10 CYS C 1 1 32 19983 1 1 10 CYS CA C -4.163 -3.499 -0.033 1.00 . A A . 10 CYS CA 1 1 32 19984 1 1 10 CYS CB C -5.662 -3.192 -0.096 1.00 . A A . 10 CYS CB 1 1 32 19985 1 1 10 CYS H H -3.496 -2.156 -1.520 1.00 . A A . 10 CYS H 1 1 32 19986 1 1 10 CYS HA H -3.873 -3.641 0.999 1.00 . A A . 10 CYS HA 1 1 32 19987 1 1 10 CYS HB2 H -5.796 -2.155 -0.357 1.00 . A A . 10 CYS HB2 1 1 32 19988 1 1 10 CYS HB3 H -6.114 -3.807 -0.861 1.00 . A A . 10 CYS HB3 1 1 32 19989 1 1 10 CYS N N -3.406 -2.374 -0.570 1.00 . A A . 10 CYS N 1 1 32 19990 1 1 10 CYS O O -4.124 -4.842 -2.020 1.00 . A A . 10 CYS O 1 1 32 19991 1 1 10 CYS SG S -6.563 -3.495 1.459 1.00 . A A . 10 CYS SG 1 1 32 19992 1 1 11 ARG C C -4.269 -7.679 -1.377 1.00 . A A . 11 ARG C 1 1 32 19993 1 1 11 ARG CA C -3.007 -7.046 -0.791 1.00 . A A . 11 ARG CA 1 1 32 19994 1 1 11 ARG CB C -2.325 -7.998 0.199 1.00 . A A . 11 ARG CB 1 1 32 19995 1 1 11 ARG CD C -1.118 -10.181 0.508 1.00 . A A . 11 ARG CD 1 1 32 19996 1 1 11 ARG CG C -2.090 -9.394 -0.356 1.00 . A A . 11 ARG CG 1 1 32 19997 1 1 11 ARG CZ C -1.314 -12.434 -0.471 1.00 . A A . 11 ARG CZ 1 1 32 19998 1 1 11 ARG H H -3.145 -5.672 0.817 1.00 . A A . 11 ARG H 1 1 32 19999 1 1 11 ARG HA H -2.325 -6.834 -1.597 1.00 . A A . 11 ARG HA 1 1 32 20000 1 1 11 ARG HB2 H -1.369 -7.582 0.479 1.00 . A A . 11 ARG HB2 1 1 32 20001 1 1 11 ARG HB3 H -2.941 -8.083 1.082 1.00 . A A . 11 ARG HB3 1 1 32 20002 1 1 11 ARG HD2 H -0.124 -10.072 0.099 1.00 . A A . 11 ARG HD2 1 1 32 20003 1 1 11 ARG HD3 H -1.140 -9.779 1.510 1.00 . A A . 11 ARG HD3 1 1 32 20004 1 1 11 ARG HE H -1.806 -11.954 1.403 1.00 . A A . 11 ARG HE 1 1 32 20005 1 1 11 ARG HG2 H -3.032 -9.921 -0.390 1.00 . A A . 11 ARG HG2 1 1 32 20006 1 1 11 ARG HG3 H -1.686 -9.311 -1.354 1.00 . A A . 11 ARG HG3 1 1 32 20007 1 1 11 ARG HH11 H -0.590 -11.031 -1.736 1.00 . A A . 11 ARG HH11 1 1 32 20008 1 1 11 ARG HH12 H -0.737 -12.623 -2.399 1.00 . A A . 11 ARG HH12 1 1 32 20009 1 1 11 ARG HH21 H -2.001 -14.049 0.531 1.00 . A A . 11 ARG HH21 1 1 32 20010 1 1 11 ARG HH22 H -1.539 -14.337 -1.113 1.00 . A A . 11 ARG HH22 1 1 32 20011 1 1 11 ARG N N -3.327 -5.780 -0.139 1.00 . A A . 11 ARG N 1 1 32 20012 1 1 11 ARG NE N -1.455 -11.601 0.558 1.00 . A A . 11 ARG NE 1 1 32 20013 1 1 11 ARG NH1 N -0.842 -11.993 -1.630 1.00 . A A . 11 ARG NH1 1 1 32 20014 1 1 11 ARG NH2 N -1.645 -13.711 -0.340 1.00 . A A . 11 ARG NH2 1 1 32 20015 1 1 11 ARG O O -4.621 -7.425 -2.528 1.00 . A A . 11 ARG O 1 1 32 20016 1 1 12 GLN C C -7.367 -8.644 -0.194 1.00 . A A . 12 GLN C 1 1 32 20017 1 1 12 GLN CA C -6.182 -9.140 -1.017 1.00 . A A . 12 GLN CA 1 1 32 20018 1 1 12 GLN CB C -6.055 -10.659 -0.892 1.00 . A A . 12 GLN CB 1 1 32 20019 1 1 12 GLN CD C -7.125 -12.861 -1.516 1.00 . A A . 12 GLN CD 1 1 32 20020 1 1 12 GLN CG C -6.866 -11.424 -1.926 1.00 . A A . 12 GLN CG 1 1 32 20021 1 1 12 GLN H H -4.632 -8.648 0.333 1.00 . A A . 12 GLN H 1 1 32 20022 1 1 12 GLN HA H -6.343 -8.882 -2.053 1.00 . A A . 12 GLN HA 1 1 32 20023 1 1 12 GLN HB2 H -5.017 -10.933 -1.007 1.00 . A A . 12 GLN HB2 1 1 32 20024 1 1 12 GLN HB3 H -6.391 -10.957 0.090 1.00 . A A . 12 GLN HB3 1 1 32 20025 1 1 12 GLN HE21 H -7.471 -13.364 -3.408 1.00 . A A . 12 GLN HE21 1 1 32 20026 1 1 12 GLN HE22 H -7.603 -14.643 -2.255 1.00 . A A . 12 GLN HE22 1 1 32 20027 1 1 12 GLN HG2 H -7.815 -10.927 -2.059 1.00 . A A . 12 GLN HG2 1 1 32 20028 1 1 12 GLN HG3 H -6.325 -11.423 -2.861 1.00 . A A . 12 GLN HG3 1 1 32 20029 1 1 12 GLN N N -4.954 -8.489 -0.578 1.00 . A A . 12 GLN N 1 1 32 20030 1 1 12 GLN NE2 N -7.430 -13.708 -2.492 1.00 . A A . 12 GLN NE2 1 1 32 20031 1 1 12 GLN O O -8.502 -8.621 -0.669 1.00 . A A . 12 GLN O 1 1 32 20032 1 1 12 GLN OE1 O -7.052 -13.205 -0.336 1.00 . A A . 12 GLN OE1 1 1 32 20033 1 1 13 CYS C C -7.502 -7.467 3.333 1.00 . A A . 13 CYS C 1 1 32 20034 1 1 13 CYS CA C -8.106 -7.739 1.956 1.00 . A A . 13 CYS CA 1 1 32 20035 1 1 13 CYS CB C -9.262 -8.738 2.083 1.00 . A A . 13 CYS CB 1 1 32 20036 1 1 13 CYS H H -6.155 -8.285 1.352 1.00 . A A . 13 CYS H 1 1 32 20037 1 1 13 CYS HA H -8.483 -6.812 1.551 1.00 . A A . 13 CYS HA 1 1 32 20038 1 1 13 CYS HB2 H -9.648 -8.960 1.100 1.00 . A A . 13 CYS HB2 1 1 32 20039 1 1 13 CYS HB3 H -8.893 -9.649 2.532 1.00 . A A . 13 CYS HB3 1 1 32 20040 1 1 13 CYS N N -7.083 -8.244 1.044 1.00 . A A . 13 CYS N 1 1 32 20041 1 1 13 CYS O O -8.131 -7.722 4.360 1.00 . A A . 13 CYS O 1 1 32 20042 1 1 13 CYS SG S -10.656 -8.145 3.098 1.00 . A A . 13 CYS SG 1 1 32 20043 1 1 14 LYS C C -4.546 -5.567 4.403 1.00 . A A . 14 LYS C 1 1 32 20044 1 1 14 LYS CA C -5.595 -6.653 4.602 1.00 . A A . 14 LYS CA 1 1 32 20045 1 1 14 LYS CB C -4.940 -7.915 5.164 1.00 . A A . 14 LYS CB 1 1 32 20046 1 1 14 LYS CD C -5.133 -9.925 6.659 1.00 . A A . 14 LYS CD 1 1 32 20047 1 1 14 LYS CE C -5.552 -10.178 8.098 1.00 . A A . 14 LYS CE 1 1 32 20048 1 1 14 LYS CG C -5.852 -8.722 6.073 1.00 . A A . 14 LYS CG 1 1 32 20049 1 1 14 LYS H H -5.817 -6.770 2.502 1.00 . A A . 14 LYS H 1 1 32 20050 1 1 14 LYS HA H -6.335 -6.299 5.304 1.00 . A A . 14 LYS HA 1 1 32 20051 1 1 14 LYS HB2 H -4.637 -8.547 4.342 1.00 . A A . 14 LYS HB2 1 1 32 20052 1 1 14 LYS HB3 H -4.064 -7.631 5.729 1.00 . A A . 14 LYS HB3 1 1 32 20053 1 1 14 LYS HD2 H -5.369 -10.797 6.068 1.00 . A A . 14 LYS HD2 1 1 32 20054 1 1 14 LYS HD3 H -4.068 -9.745 6.630 1.00 . A A . 14 LYS HD3 1 1 32 20055 1 1 14 LYS HE2 H -5.020 -11.042 8.468 1.00 . A A . 14 LYS HE2 1 1 32 20056 1 1 14 LYS HE3 H -5.292 -9.315 8.693 1.00 . A A . 14 LYS HE3 1 1 32 20057 1 1 14 LYS HG2 H -6.191 -8.089 6.880 1.00 . A A . 14 LYS HG2 1 1 32 20058 1 1 14 LYS HG3 H -6.702 -9.065 5.501 1.00 . A A . 14 LYS HG3 1 1 32 20059 1 1 14 LYS HZ1 H -7.376 -10.859 7.342 1.00 . A A . 14 LYS HZ1 1 1 32 20060 1 1 14 LYS HZ2 H -7.208 -11.066 9.012 1.00 . A A . 14 LYS HZ2 1 1 32 20061 1 1 14 LYS HZ3 H -7.518 -9.529 8.377 1.00 . A A . 14 LYS HZ3 1 1 32 20062 1 1 14 LYS N N -6.276 -6.952 3.349 1.00 . A A . 14 LYS N 1 1 32 20063 1 1 14 LYS NZ N -7.016 -10.425 8.215 1.00 . A A . 14 LYS NZ 1 1 32 20064 1 1 14 LYS O O -3.597 -5.738 3.638 1.00 . A A . 14 LYS O 1 1 32 20065 1 1 15 LEU C C -2.351 -3.798 5.085 1.00 . A A . 15 LEU C 1 1 32 20066 1 1 15 LEU CA C -3.798 -3.325 5.008 1.00 . A A . 15 LEU CA 1 1 32 20067 1 1 15 LEU CB C -4.077 -2.322 6.129 1.00 . A A . 15 LEU CB 1 1 32 20068 1 1 15 LEU CD1 C -4.215 0.052 6.919 1.00 . A A . 15 LEU CD1 1 1 32 20069 1 1 15 LEU CD2 C -2.309 -0.678 5.467 1.00 . A A . 15 LEU CD2 1 1 32 20070 1 1 15 LEU CG C -3.787 -0.863 5.781 1.00 . A A . 15 LEU CG 1 1 32 20071 1 1 15 LEU H H -5.502 -4.376 5.689 1.00 . A A . 15 LEU H 1 1 32 20072 1 1 15 LEU HA H -3.954 -2.840 4.058 1.00 . A A . 15 LEU HA 1 1 32 20073 1 1 15 LEU HB2 H -5.118 -2.405 6.405 1.00 . A A . 15 LEU HB2 1 1 32 20074 1 1 15 LEU HB3 H -3.474 -2.591 6.983 1.00 . A A . 15 LEU HB3 1 1 32 20075 1 1 15 LEU HD11 H -4.800 -0.509 7.633 1.00 . A A . 15 LEU HD11 1 1 32 20076 1 1 15 LEU HD12 H -3.340 0.453 7.408 1.00 . A A . 15 LEU HD12 1 1 32 20077 1 1 15 LEU HD13 H -4.810 0.862 6.524 1.00 . A A . 15 LEU HD13 1 1 32 20078 1 1 15 LEU HD21 H -1.739 -1.460 5.947 1.00 . A A . 15 LEU HD21 1 1 32 20079 1 1 15 LEU HD22 H -2.159 -0.726 4.399 1.00 . A A . 15 LEU HD22 1 1 32 20080 1 1 15 LEU HD23 H -1.981 0.284 5.834 1.00 . A A . 15 LEU HD23 1 1 32 20081 1 1 15 LEU HG H -4.353 -0.590 4.902 1.00 . A A . 15 LEU HG 1 1 32 20082 1 1 15 LEU N N -4.725 -4.448 5.099 1.00 . A A . 15 LEU N 1 1 32 20083 1 1 15 LEU O O -1.907 -4.307 6.115 1.00 . A A . 15 LEU O 1 1 32 20084 1 1 16 LYS C C 0.557 -3.486 5.123 1.00 . A A . 16 LYS C 1 1 32 20085 1 1 16 LYS CA C -0.222 -4.041 3.931 1.00 . A A . 16 LYS CA 1 1 32 20086 1 1 16 LYS CB C 0.419 -3.570 2.624 1.00 . A A . 16 LYS CB 1 1 32 20087 1 1 16 LYS CD C 0.387 -3.874 0.130 1.00 . A A . 16 LYS CD 1 1 32 20088 1 1 16 LYS CE C 0.150 -4.848 -1.013 1.00 . A A . 16 LYS CE 1 1 32 20089 1 1 16 LYS CG C 0.268 -4.560 1.481 1.00 . A A . 16 LYS CG 1 1 32 20090 1 1 16 LYS H H -2.029 -3.218 3.198 1.00 . A A . 16 LYS H 1 1 32 20091 1 1 16 LYS HA H -0.197 -5.120 3.966 1.00 . A A . 16 LYS HA 1 1 32 20092 1 1 16 LYS HB2 H -0.040 -2.638 2.327 1.00 . A A . 16 LYS HB2 1 1 32 20093 1 1 16 LYS HB3 H 1.473 -3.405 2.792 1.00 . A A . 16 LYS HB3 1 1 32 20094 1 1 16 LYS HD2 H -0.346 -3.083 0.073 1.00 . A A . 16 LYS HD2 1 1 32 20095 1 1 16 LYS HD3 H 1.378 -3.456 0.035 1.00 . A A . 16 LYS HD3 1 1 32 20096 1 1 16 LYS HE2 H 0.355 -5.849 -0.664 1.00 . A A . 16 LYS HE2 1 1 32 20097 1 1 16 LYS HE3 H -0.884 -4.779 -1.319 1.00 . A A . 16 LYS HE3 1 1 32 20098 1 1 16 LYS HG2 H 1.041 -5.309 1.562 1.00 . A A . 16 LYS HG2 1 1 32 20099 1 1 16 LYS HG3 H -0.702 -5.032 1.551 1.00 . A A . 16 LYS HG3 1 1 32 20100 1 1 16 LYS HZ1 H 1.059 -3.531 -2.355 1.00 . A A . 16 LYS HZ1 1 1 32 20101 1 1 16 LYS HZ2 H 1.989 -4.899 -2.003 1.00 . A A . 16 LYS HZ2 1 1 32 20102 1 1 16 LYS HZ3 H 0.653 -5.028 -3.032 1.00 . A A . 16 LYS HZ3 1 1 32 20103 1 1 16 LYS N N -1.619 -3.629 3.988 1.00 . A A . 16 LYS N 1 1 32 20104 1 1 16 LYS NZ N 1.024 -4.556 -2.182 1.00 . A A . 16 LYS NZ 1 1 32 20105 1 1 16 LYS O O 0.310 -2.365 5.566 1.00 . A A . 16 LYS O 1 1 32 20106 1 1 17 PRO C C 3.180 -2.621 6.502 1.00 . A A . 17 PRO C 1 1 32 20107 1 1 17 PRO CA C 2.318 -3.840 6.813 1.00 . A A . 17 PRO CA 1 1 32 20108 1 1 17 PRO CB C 3.202 -5.058 7.107 1.00 . A A . 17 PRO CB 1 1 32 20109 1 1 17 PRO CD C 1.872 -5.616 5.204 1.00 . A A . 17 PRO CD 1 1 32 20110 1 1 17 PRO CG C 3.212 -5.844 5.841 1.00 . A A . 17 PRO CG 1 1 32 20111 1 1 17 PRO HA H 1.698 -3.628 7.672 1.00 . A A . 17 PRO HA 1 1 32 20112 1 1 17 PRO HB2 H 4.195 -4.727 7.374 1.00 . A A . 17 PRO HB2 1 1 32 20113 1 1 17 PRO HB3 H 2.776 -5.626 7.920 1.00 . A A . 17 PRO HB3 1 1 32 20114 1 1 17 PRO HD2 H 1.954 -5.650 4.128 1.00 . A A . 17 PRO HD2 1 1 32 20115 1 1 17 PRO HD3 H 1.157 -6.347 5.554 1.00 . A A . 17 PRO HD3 1 1 32 20116 1 1 17 PRO HG2 H 4.000 -5.489 5.194 1.00 . A A . 17 PRO HG2 1 1 32 20117 1 1 17 PRO HG3 H 3.349 -6.892 6.061 1.00 . A A . 17 PRO HG3 1 1 32 20118 1 1 17 PRO N N 1.510 -4.265 5.664 1.00 . A A . 17 PRO N 1 1 32 20119 1 1 17 PRO O O 3.974 -2.635 5.562 1.00 . A A . 17 PRO O 1 1 32 20120 1 1 18 ALA C C 5.257 -0.624 6.865 1.00 . A A . 18 ALA C 1 1 32 20121 1 1 18 ALA CA C 3.780 -0.335 7.120 1.00 . A A . 18 ALA CA 1 1 32 20122 1 1 18 ALA CB C 3.623 0.564 8.337 1.00 . A A . 18 ALA CB 1 1 32 20123 1 1 18 ALA H H 2.368 -1.619 8.031 1.00 . A A . 18 ALA H 1 1 32 20124 1 1 18 ALA HA H 3.372 0.184 6.266 1.00 . A A . 18 ALA HA 1 1 32 20125 1 1 18 ALA HB1 H 4.386 0.323 9.063 1.00 . A A . 18 ALA HB1 1 1 32 20126 1 1 18 ALA HB2 H 3.723 1.597 8.038 1.00 . A A . 18 ALA HB2 1 1 32 20127 1 1 18 ALA HB3 H 2.648 0.409 8.775 1.00 . A A . 18 ALA HB3 1 1 32 20128 1 1 18 ALA N N 3.018 -1.567 7.301 1.00 . A A . 18 ALA N 1 1 32 20129 1 1 18 ALA O O 5.792 -1.631 7.329 1.00 . A A . 18 ALA O 1 1 32 20130 1 1 19 GLY C C 7.547 -0.991 4.769 1.00 . A A . 19 GLY C 1 1 32 20131 1 1 19 GLY CA C 7.316 0.082 5.814 1.00 . A A . 19 GLY CA 1 1 32 20132 1 1 19 GLY H H 5.432 1.046 5.775 1.00 . A A . 19 GLY H 1 1 32 20133 1 1 19 GLY HA2 H 7.838 -0.192 6.718 1.00 . A A . 19 GLY HA2 1 1 32 20134 1 1 19 GLY HA3 H 7.716 1.017 5.449 1.00 . A A . 19 GLY HA3 1 1 32 20135 1 1 19 GLY N N 5.910 0.264 6.121 1.00 . A A . 19 GLY N 1 1 32 20136 1 1 19 GLY O O 8.660 -1.495 4.622 1.00 . A A . 19 GLY O 1 1 32 20137 1 1 20 THR C C 6.031 -1.827 1.682 1.00 . A A . 20 THR C 1 1 32 20138 1 1 20 THR CA C 6.583 -2.358 3.000 1.00 . A A . 20 THR CA 1 1 32 20139 1 1 20 THR CB C 5.818 -3.615 3.421 1.00 . A A . 20 THR CB 1 1 32 20140 1 1 20 THR CG2 C 5.834 -4.709 2.375 1.00 . A A . 20 THR CG2 1 1 32 20141 1 1 20 THR H H 5.631 -0.902 4.200 1.00 . A A . 20 THR H 1 1 32 20142 1 1 20 THR HA H 7.625 -2.607 2.868 1.00 . A A . 20 THR HA 1 1 32 20143 1 1 20 THR HB H 4.787 -3.350 3.607 1.00 . A A . 20 THR HB 1 1 32 20144 1 1 20 THR HG1 H 5.882 -4.951 4.853 1.00 . A A . 20 THR HG1 1 1 32 20145 1 1 20 THR HG21 H 6.189 -4.307 1.438 1.00 . A A . 20 THR HG21 1 1 32 20146 1 1 20 THR HG22 H 6.489 -5.505 2.696 1.00 . A A . 20 THR HG22 1 1 32 20147 1 1 20 THR HG23 H 4.834 -5.096 2.244 1.00 . A A . 20 THR HG23 1 1 32 20148 1 1 20 THR N N 6.492 -1.340 4.039 1.00 . A A . 20 THR N 1 1 32 20149 1 1 20 THR O O 4.869 -1.429 1.599 1.00 . A A . 20 THR O 1 1 32 20150 1 1 20 THR OG1 O 6.361 -4.154 4.614 1.00 . A A . 20 THR OG1 1 1 32 20151 1 1 21 THR C C 5.170 -1.998 -1.110 1.00 . A A . 21 THR C 1 1 32 20152 1 1 21 THR CA C 6.466 -1.336 -0.663 1.00 . A A . 21 THR CA 1 1 32 20153 1 1 21 THR CB C 7.565 -1.594 -1.687 1.00 . A A . 21 THR CB 1 1 32 20154 1 1 21 THR CG2 C 7.922 -3.052 -1.802 1.00 . A A . 21 THR CG2 1 1 32 20155 1 1 21 THR H H 7.786 -2.150 0.778 1.00 . A A . 21 THR H 1 1 32 20156 1 1 21 THR HA H 6.302 -0.275 -0.588 1.00 . A A . 21 THR HA 1 1 32 20157 1 1 21 THR HB H 8.455 -1.057 -1.391 1.00 . A A . 21 THR HB 1 1 32 20158 1 1 21 THR HG1 H 7.202 -0.181 -2.994 1.00 . A A . 21 THR HG1 1 1 32 20159 1 1 21 THR HG21 H 7.249 -3.631 -1.187 1.00 . A A . 21 THR HG21 1 1 32 20160 1 1 21 THR HG22 H 7.830 -3.363 -2.832 1.00 . A A . 21 THR HG22 1 1 32 20161 1 1 21 THR HG23 H 8.936 -3.201 -1.466 1.00 . A A . 21 THR HG23 1 1 32 20162 1 1 21 THR N N 6.872 -1.821 0.651 1.00 . A A . 21 THR N 1 1 32 20163 1 1 21 THR O O 5.053 -3.224 -1.119 1.00 . A A . 21 THR O 1 1 32 20164 1 1 21 THR OG1 O 7.174 -1.140 -2.971 1.00 . A A . 21 THR OG1 1 1 32 20165 1 1 22 CYS C C 2.755 -1.547 -3.417 1.00 . A A . 22 CYS C 1 1 32 20166 1 1 22 CYS CA C 2.899 -1.661 -1.907 1.00 . A A . 22 CYS CA 1 1 32 20167 1 1 22 CYS CB C 1.798 -0.851 -1.234 1.00 . A A . 22 CYS CB 1 1 32 20168 1 1 22 CYS H H 4.356 -0.208 -1.430 1.00 . A A . 22 CYS H 1 1 32 20169 1 1 22 CYS HA H 2.808 -2.695 -1.618 1.00 . A A . 22 CYS HA 1 1 32 20170 1 1 22 CYS HB2 H 0.840 -1.167 -1.619 1.00 . A A . 22 CYS HB2 1 1 32 20171 1 1 22 CYS HB3 H 1.829 -1.026 -0.169 1.00 . A A . 22 CYS HB3 1 1 32 20172 1 1 22 CYS N N 4.198 -1.174 -1.469 1.00 . A A . 22 CYS N 1 1 32 20173 1 1 22 CYS O O 2.187 -2.425 -4.068 1.00 . A A . 22 CYS O 1 1 32 20174 1 1 22 CYS SG S 1.945 0.943 -1.510 1.00 . A A . 22 CYS SG 1 1 32 20175 1 1 23 TRP C C 4.328 -0.841 -6.148 1.00 . A A . 23 TRP C 1 1 32 20176 1 1 23 TRP CA C 3.171 -0.202 -5.394 1.00 . A A . 23 TRP CA 1 1 32 20177 1 1 23 TRP CB C 3.137 1.301 -5.666 1.00 . A A . 23 TRP CB 1 1 32 20178 1 1 23 TRP CD1 C 1.862 0.825 -7.828 1.00 . A A . 23 TRP CD1 1 1 32 20179 1 1 23 TRP CD2 C 1.795 2.960 -7.171 1.00 . A A . 23 TRP CD2 1 1 32 20180 1 1 23 TRP CE2 C 1.059 2.834 -8.362 1.00 . A A . 23 TRP CE2 1 1 32 20181 1 1 23 TRP CE3 C 1.894 4.216 -6.569 1.00 . A A . 23 TRP CE3 1 1 32 20182 1 1 23 TRP CG C 2.298 1.664 -6.847 1.00 . A A . 23 TRP CG 1 1 32 20183 1 1 23 TRP CH2 C 0.539 5.132 -8.353 1.00 . A A . 23 TRP CH2 1 1 32 20184 1 1 23 TRP CZ2 C 0.426 3.915 -8.961 1.00 . A A . 23 TRP CZ2 1 1 32 20185 1 1 23 TRP CZ3 C 1.266 5.290 -7.167 1.00 . A A . 23 TRP CZ3 1 1 32 20186 1 1 23 TRP H H 3.686 0.219 -3.390 1.00 . A A . 23 TRP H 1 1 32 20187 1 1 23 TRP HA H 2.252 -0.637 -5.747 1.00 . A A . 23 TRP HA 1 1 32 20188 1 1 23 TRP HB2 H 2.734 1.808 -4.802 1.00 . A A . 23 TRP HB2 1 1 32 20189 1 1 23 TRP HB3 H 4.141 1.653 -5.848 1.00 . A A . 23 TRP HB3 1 1 32 20190 1 1 23 TRP HD1 H 2.082 -0.231 -7.866 1.00 . A A . 23 TRP HD1 1 1 32 20191 1 1 23 TRP HE1 H 0.693 1.142 -9.542 1.00 . A A . 23 TRP HE1 1 1 32 20192 1 1 23 TRP HE3 H 2.451 4.353 -5.655 1.00 . A A . 23 TRP HE3 1 1 32 20193 1 1 23 TRP HH2 H 0.067 5.996 -8.788 1.00 . A A . 23 TRP HH2 1 1 32 20194 1 1 23 TRP HZ2 H -0.141 3.810 -9.871 1.00 . A A . 23 TRP HZ2 1 1 32 20195 1 1 23 TRP HZ3 H 1.331 6.270 -6.717 1.00 . A A . 23 TRP HZ3 1 1 32 20196 1 1 23 TRP N N 3.257 -0.449 -3.965 1.00 . A A . 23 TRP N 1 1 32 20197 1 1 23 TRP NE1 N 1.115 1.522 -8.745 1.00 . A A . 23 TRP NE1 1 1 32 20198 1 1 23 TRP O O 4.156 -1.851 -6.830 1.00 . A A . 23 TRP O 1 1 32 20199 1 1 24 LYS C C 6.448 -0.848 -8.216 1.00 . A A . 24 LYS C 1 1 32 20200 1 1 24 LYS CA C 6.687 -0.748 -6.710 1.00 . A A . 24 LYS CA 1 1 32 20201 1 1 24 LYS CB C 7.073 -2.117 -6.148 1.00 . A A . 24 LYS CB 1 1 32 20202 1 1 24 LYS CD C 9.292 -2.101 -7.328 1.00 . A A . 24 LYS CD 1 1 32 20203 1 1 24 LYS CE C 10.789 -2.326 -7.191 1.00 . A A . 24 LYS CE 1 1 32 20204 1 1 24 LYS CG C 8.573 -2.317 -6.006 1.00 . A A . 24 LYS CG 1 1 32 20205 1 1 24 LYS H H 5.576 0.561 -5.476 1.00 . A A . 24 LYS H 1 1 32 20206 1 1 24 LYS HA H 7.495 -0.055 -6.531 1.00 . A A . 24 LYS HA 1 1 32 20207 1 1 24 LYS HB2 H 6.623 -2.230 -5.173 1.00 . A A . 24 LYS HB2 1 1 32 20208 1 1 24 LYS HB3 H 6.689 -2.884 -6.804 1.00 . A A . 24 LYS HB3 1 1 32 20209 1 1 24 LYS HD2 H 8.900 -2.793 -8.058 1.00 . A A . 24 LYS HD2 1 1 32 20210 1 1 24 LYS HD3 H 9.118 -1.088 -7.660 1.00 . A A . 24 LYS HD3 1 1 32 20211 1 1 24 LYS HE2 H 11.169 -1.677 -6.416 1.00 . A A . 24 LYS HE2 1 1 32 20212 1 1 24 LYS HE3 H 10.961 -3.356 -6.913 1.00 . A A . 24 LYS HE3 1 1 32 20213 1 1 24 LYS HG2 H 8.954 -1.612 -5.282 1.00 . A A . 24 LYS HG2 1 1 32 20214 1 1 24 LYS HG3 H 8.761 -3.324 -5.665 1.00 . A A . 24 LYS HG3 1 1 32 20215 1 1 24 LYS HZ1 H 10.969 -1.367 -9.038 1.00 . A A . 24 LYS HZ1 1 1 32 20216 1 1 24 LYS HZ2 H 12.446 -1.629 -8.255 1.00 . A A . 24 LYS HZ2 1 1 32 20217 1 1 24 LYS HZ3 H 11.645 -2.917 -9.003 1.00 . A A . 24 LYS HZ3 1 1 32 20218 1 1 24 LYS N N 5.504 -0.242 -6.030 1.00 . A A . 24 LYS N 1 1 32 20219 1 1 24 LYS NZ N 11.513 -2.040 -8.460 1.00 . A A . 24 LYS NZ 1 1 32 20220 1 1 24 LYS O O 7.106 -1.625 -8.908 1.00 . A A . 24 LYS O 1 1 32 20221 1 1 25 THR C C 6.436 0.202 -10.977 1.00 . A A . 25 THR C 1 1 32 20222 1 1 25 THR CA C 5.181 -0.054 -10.144 1.00 . A A . 25 THR CA 1 1 32 20223 1 1 25 THR CB C 4.116 1.004 -10.455 1.00 . A A . 25 THR CB 1 1 32 20224 1 1 25 THR CG2 C 4.552 2.407 -10.107 1.00 . A A . 25 THR CG2 1 1 32 20225 1 1 25 THR H H 5.011 0.546 -8.121 1.00 . A A . 25 THR H 1 1 32 20226 1 1 25 THR HA H 4.791 -1.029 -10.395 1.00 . A A . 25 THR HA 1 1 32 20227 1 1 25 THR HB H 3.224 0.786 -9.882 1.00 . A A . 25 THR HB 1 1 32 20228 1 1 25 THR HG1 H 4.485 1.377 -12.343 1.00 . A A . 25 THR HG1 1 1 32 20229 1 1 25 THR HG21 H 5.530 2.374 -9.654 1.00 . A A . 25 THR HG21 1 1 32 20230 1 1 25 THR HG22 H 4.591 3.006 -11.005 1.00 . A A . 25 THR HG22 1 1 32 20231 1 1 25 THR HG23 H 3.847 2.842 -9.414 1.00 . A A . 25 THR HG23 1 1 32 20232 1 1 25 THR N N 5.502 -0.054 -8.720 1.00 . A A . 25 THR N 1 1 32 20233 1 1 25 THR O O 7.473 0.599 -10.445 1.00 . A A . 25 THR O 1 1 32 20234 1 1 25 THR OG1 O 3.774 0.986 -11.830 1.00 . A A . 25 THR OG1 1 1 32 20235 1 1 26 SER C C 7.577 1.626 -13.619 1.00 . A A . 26 SER C 1 1 32 20236 1 1 26 SER CA C 7.471 0.168 -13.180 1.00 . A A . 26 SER CA 1 1 32 20237 1 1 26 SER CB C 7.340 -0.740 -14.405 1.00 . A A . 26 SER CB 1 1 32 20238 1 1 26 SER H H 5.488 -0.351 -12.648 1.00 . A A . 26 SER H 1 1 32 20239 1 1 26 SER HA H 8.369 -0.098 -12.642 1.00 . A A . 26 SER HA 1 1 32 20240 1 1 26 SER HB2 H 6.363 -0.607 -14.846 1.00 . A A . 26 SER HB2 1 1 32 20241 1 1 26 SER HB3 H 8.100 -0.478 -15.127 1.00 . A A . 26 SER HB3 1 1 32 20242 1 1 26 SER HG H 8.230 -2.479 -14.543 1.00 . A A . 26 SER HG 1 1 32 20243 1 1 26 SER N N 6.338 -0.032 -12.281 1.00 . A A . 26 SER N 1 1 32 20244 1 1 26 SER O O 7.572 1.927 -14.813 1.00 . A A . 26 SER O 1 1 32 20245 1 1 26 SER OG O 7.498 -2.103 -14.050 1.00 . A A . 26 SER OG 1 1 32 20246 1 1 27 VAL C C 7.846 4.780 -11.650 1.00 . A A . 27 VAL C 1 1 32 20247 1 1 27 VAL CA C 7.791 3.955 -12.935 1.00 . A A . 27 VAL CA 1 1 32 20248 1 1 27 VAL CB C 6.612 4.451 -13.798 1.00 . A A . 27 VAL CB 1 1 32 20249 1 1 27 VAL CG1 C 5.290 4.240 -13.075 1.00 . A A . 27 VAL CG1 1 1 32 20250 1 1 27 VAL CG2 C 6.797 5.915 -14.170 1.00 . A A . 27 VAL CG2 1 1 32 20251 1 1 27 VAL H H 7.681 2.226 -11.715 1.00 . A A . 27 VAL H 1 1 32 20252 1 1 27 VAL HA H 8.704 4.111 -13.488 1.00 . A A . 27 VAL HA 1 1 32 20253 1 1 27 VAL HB H 6.591 3.872 -14.709 1.00 . A A . 27 VAL HB 1 1 32 20254 1 1 27 VAL HG11 H 5.325 4.729 -12.112 1.00 . A A . 27 VAL HG11 1 1 32 20255 1 1 27 VAL HG12 H 4.487 4.659 -13.663 1.00 . A A . 27 VAL HG12 1 1 32 20256 1 1 27 VAL HG13 H 5.121 3.183 -12.935 1.00 . A A . 27 VAL HG13 1 1 32 20257 1 1 27 VAL HG21 H 7.787 6.061 -14.575 1.00 . A A . 27 VAL HG21 1 1 32 20258 1 1 27 VAL HG22 H 6.061 6.195 -14.909 1.00 . A A . 27 VAL HG22 1 1 32 20259 1 1 27 VAL HG23 H 6.674 6.529 -13.289 1.00 . A A . 27 VAL HG23 1 1 32 20260 1 1 27 VAL N N 7.678 2.528 -12.646 1.00 . A A . 27 VAL N 1 1 32 20261 1 1 27 VAL O O 8.523 5.806 -11.588 1.00 . A A . 27 VAL O 1 1 32 20262 1 1 28 SER C C 6.783 4.066 -8.204 1.00 . A A . 28 SER C 1 1 32 20263 1 1 28 SER CA C 7.082 5.028 -9.351 1.00 . A A . 28 SER CA 1 1 32 20264 1 1 28 SER CB C 6.019 6.127 -9.390 1.00 . A A . 28 SER CB 1 1 32 20265 1 1 28 SER H H 6.602 3.510 -10.746 1.00 . A A . 28 SER H 1 1 32 20266 1 1 28 SER HA H 8.048 5.479 -9.187 1.00 . A A . 28 SER HA 1 1 32 20267 1 1 28 SER HB2 H 6.035 6.607 -10.356 1.00 . A A . 28 SER HB2 1 1 32 20268 1 1 28 SER HB3 H 5.045 5.688 -9.222 1.00 . A A . 28 SER HB3 1 1 32 20269 1 1 28 SER HG H 6.315 6.677 -7.533 1.00 . A A . 28 SER HG 1 1 32 20270 1 1 28 SER N N 7.123 4.328 -10.632 1.00 . A A . 28 SER N 1 1 32 20271 1 1 28 SER O O 5.629 3.708 -7.970 1.00 . A A . 28 SER O 1 1 32 20272 1 1 28 SER OG O 6.258 7.104 -8.391 1.00 . A A . 28 SER OG 1 1 32 20273 1 1 29 SER C C 7.336 3.517 -5.083 1.00 . A A . 29 SER C 1 1 32 20274 1 1 29 SER CA C 7.663 2.746 -6.357 1.00 . A A . 29 SER CA 1 1 32 20275 1 1 29 SER CB C 8.934 1.918 -6.157 1.00 . A A . 29 SER CB 1 1 32 20276 1 1 29 SER H H 8.720 3.983 -7.714 1.00 . A A . 29 SER H 1 1 32 20277 1 1 29 SER HA H 6.841 2.083 -6.582 1.00 . A A . 29 SER HA 1 1 32 20278 1 1 29 SER HB2 H 9.738 2.567 -5.842 1.00 . A A . 29 SER HB2 1 1 32 20279 1 1 29 SER HB3 H 8.758 1.170 -5.398 1.00 . A A . 29 SER HB3 1 1 32 20280 1 1 29 SER HG H 9.865 1.860 -7.880 1.00 . A A . 29 SER HG 1 1 32 20281 1 1 29 SER N N 7.824 3.659 -7.485 1.00 . A A . 29 SER N 1 1 32 20282 1 1 29 SER O O 7.672 4.694 -4.958 1.00 . A A . 29 SER O 1 1 32 20283 1 1 29 SER OG O 9.316 1.270 -7.358 1.00 . A A . 29 SER OG 1 1 32 20284 1 1 30 HIS C C 6.395 2.512 -1.717 1.00 . A A . 30 HIS C 1 1 32 20285 1 1 30 HIS CA C 6.300 3.490 -2.882 1.00 . A A . 30 HIS CA 1 1 32 20286 1 1 30 HIS CB C 4.878 4.051 -2.974 1.00 . A A . 30 HIS CB 1 1 32 20287 1 1 30 HIS CD2 C 4.784 4.921 -5.411 1.00 . A A . 30 HIS CD2 1 1 32 20288 1 1 30 HIS CE1 C 4.307 7.018 -4.990 1.00 . A A . 30 HIS CE1 1 1 32 20289 1 1 30 HIS CG C 4.701 5.055 -4.069 1.00 . A A . 30 HIS CG 1 1 32 20290 1 1 30 HIS H H 6.427 1.912 -4.295 1.00 . A A . 30 HIS H 1 1 32 20291 1 1 30 HIS HA H 6.986 4.305 -2.708 1.00 . A A . 30 HIS HA 1 1 32 20292 1 1 30 HIS HB2 H 4.190 3.239 -3.155 1.00 . A A . 30 HIS HB2 1 1 32 20293 1 1 30 HIS HB3 H 4.625 4.529 -2.039 1.00 . A A . 30 HIS HB3 1 1 32 20294 1 1 30 HIS HD1 H 4.274 6.794 -2.956 1.00 . A A . 30 HIS HD1 1 1 32 20295 1 1 30 HIS HD2 H 5.003 4.009 -5.949 1.00 . A A . 30 HIS HD2 1 1 32 20296 1 1 30 HIS HE1 H 4.083 8.066 -5.118 1.00 . A A . 30 HIS HE1 1 1 32 20297 1 1 30 HIS HE2 H 4.438 6.341 -6.919 1.00 . A A . 30 HIS HE2 1 1 32 20298 1 1 30 HIS N N 6.673 2.851 -4.140 1.00 . A A . 30 HIS N 1 1 32 20299 1 1 30 HIS ND1 N 4.401 6.381 -3.836 1.00 . A A . 30 HIS ND1 1 1 32 20300 1 1 30 HIS NE2 N 4.536 6.154 -5.962 1.00 . A A . 30 HIS NE2 1 1 32 20301 1 1 30 HIS O O 6.884 1.393 -1.871 1.00 . A A . 30 HIS O 1 1 32 20302 1 1 31 TYR C C 4.680 2.307 1.464 1.00 . A A . 31 TYR C 1 1 32 20303 1 1 31 TYR CA C 5.951 2.115 0.646 1.00 . A A . 31 TYR CA 1 1 32 20304 1 1 31 TYR CB C 7.177 2.452 1.497 1.00 . A A . 31 TYR CB 1 1 32 20305 1 1 31 TYR CD1 C 8.423 0.278 1.794 1.00 . A A . 31 TYR CD1 1 1 32 20306 1 1 31 TYR CD2 C 9.414 1.964 0.431 1.00 . A A . 31 TYR CD2 1 1 32 20307 1 1 31 TYR CE1 C 9.502 -0.553 1.558 1.00 . A A . 31 TYR CE1 1 1 32 20308 1 1 31 TYR CE2 C 10.496 1.139 0.190 1.00 . A A . 31 TYR CE2 1 1 32 20309 1 1 31 TYR CG C 8.361 1.548 1.236 1.00 . A A . 31 TYR CG 1 1 32 20310 1 1 31 TYR CZ C 10.535 -0.118 0.755 1.00 . A A . 31 TYR CZ 1 1 32 20311 1 1 31 TYR H H 5.549 3.848 -0.495 1.00 . A A . 31 TYR H 1 1 32 20312 1 1 31 TYR HA H 6.011 1.086 0.336 1.00 . A A . 31 TYR HA 1 1 32 20313 1 1 31 TYR HB2 H 7.483 3.466 1.289 1.00 . A A . 31 TYR HB2 1 1 32 20314 1 1 31 TYR HB3 H 6.917 2.366 2.542 1.00 . A A . 31 TYR HB3 1 1 32 20315 1 1 31 TYR HD1 H 7.613 -0.060 2.422 1.00 . A A . 31 TYR HD1 1 1 32 20316 1 1 31 TYR HD2 H 9.380 2.949 -0.010 1.00 . A A . 31 TYR HD2 1 1 32 20317 1 1 31 TYR HE1 H 9.531 -1.538 1.999 1.00 . A A . 31 TYR HE1 1 1 32 20318 1 1 31 TYR HE2 H 11.305 1.480 -0.439 1.00 . A A . 31 TYR HE2 1 1 32 20319 1 1 31 TYR HH H 11.362 -1.619 -0.116 1.00 . A A . 31 TYR HH 1 1 32 20320 1 1 31 TYR N N 5.924 2.945 -0.552 1.00 . A A . 31 TYR N 1 1 32 20321 1 1 31 TYR O O 4.322 3.433 1.811 1.00 . A A . 31 TYR O 1 1 32 20322 1 1 31 TYR OH O 11.611 -0.942 0.517 1.00 . A A . 31 TYR OH 1 1 32 20323 1 1 32 CYS C C 3.103 1.693 3.992 1.00 . A A . 32 CYS C 1 1 32 20324 1 1 32 CYS CA C 2.779 1.277 2.564 1.00 . A A . 32 CYS CA 1 1 32 20325 1 1 32 CYS CB C 2.050 -0.070 2.555 1.00 . A A . 32 CYS CB 1 1 32 20326 1 1 32 CYS H H 4.336 0.330 1.484 1.00 . A A . 32 CYS H 1 1 32 20327 1 1 32 CYS HA H 2.142 2.027 2.119 1.00 . A A . 32 CYS HA 1 1 32 20328 1 1 32 CYS HB2 H 2.346 -0.624 1.677 1.00 . A A . 32 CYS HB2 1 1 32 20329 1 1 32 CYS HB3 H 2.332 -0.628 3.436 1.00 . A A . 32 CYS HB3 1 1 32 20330 1 1 32 CYS N N 4.002 1.206 1.778 1.00 . A A . 32 CYS N 1 1 32 20331 1 1 32 CYS O O 4.108 1.263 4.558 1.00 . A A . 32 CYS O 1 1 32 20332 1 1 32 CYS SG S 0.227 0.057 2.539 1.00 . A A . 32 CYS SG 1 1 32 20333 1 1 33 THR C C 1.588 2.229 6.908 1.00 . A A . 33 THR C 1 1 32 20334 1 1 33 THR CA C 2.461 3.006 5.931 1.00 . A A . 33 THR CA 1 1 32 20335 1 1 33 THR CB C 2.151 4.501 6.028 1.00 . A A . 33 THR CB 1 1 32 20336 1 1 33 THR CG2 C 2.742 5.311 4.895 1.00 . A A . 33 THR CG2 1 1 32 20337 1 1 33 THR H H 1.475 2.844 4.068 1.00 . A A . 33 THR H 1 1 32 20338 1 1 33 THR HA H 3.498 2.844 6.185 1.00 . A A . 33 THR HA 1 1 32 20339 1 1 33 THR HB H 2.557 4.882 6.954 1.00 . A A . 33 THR HB 1 1 32 20340 1 1 33 THR HG1 H 0.348 4.234 5.311 1.00 . A A . 33 THR HG1 1 1 32 20341 1 1 33 THR HG21 H 3.520 4.739 4.411 1.00 . A A . 33 THR HG21 1 1 32 20342 1 1 33 THR HG22 H 1.968 5.545 4.178 1.00 . A A . 33 THR HG22 1 1 32 20343 1 1 33 THR HG23 H 3.159 6.227 5.286 1.00 . A A . 33 THR HG23 1 1 32 20344 1 1 33 THR N N 2.256 2.534 4.568 1.00 . A A . 33 THR N 1 1 32 20345 1 1 33 THR O O 1.337 2.680 8.025 1.00 . A A . 33 THR O 1 1 32 20346 1 1 33 THR OG1 O 0.752 4.723 6.031 1.00 . A A . 33 THR OG1 1 1 32 20347 1 1 34 GLY C C -0.825 1.024 8.008 1.00 . A A . 34 GLY C 1 1 32 20348 1 1 34 GLY CA C 0.280 0.232 7.329 1.00 . A A . 34 GLY CA 1 1 32 20349 1 1 34 GLY H H 1.360 0.745 5.574 1.00 . A A . 34 GLY H 1 1 32 20350 1 1 34 GLY HA2 H 0.895 -0.228 8.088 1.00 . A A . 34 GLY HA2 1 1 32 20351 1 1 34 GLY HA3 H -0.168 -0.543 6.728 1.00 . A A . 34 GLY HA3 1 1 32 20352 1 1 34 GLY N N 1.125 1.055 6.478 1.00 . A A . 34 GLY N 1 1 32 20353 1 1 34 GLY O O -1.288 0.654 9.087 1.00 . A A . 34 GLY O 1 1 32 20354 1 1 35 ARG C C -3.541 2.945 7.042 1.00 . A A . 35 ARG C 1 1 32 20355 1 1 35 ARG CA C -2.298 2.964 7.929 1.00 . A A . 35 ARG CA 1 1 32 20356 1 1 35 ARG CB C -1.794 4.400 8.087 1.00 . A A . 35 ARG CB 1 1 32 20357 1 1 35 ARG CD C -1.120 6.039 9.868 1.00 . A A . 35 ARG CD 1 1 32 20358 1 1 35 ARG CG C -0.971 4.620 9.346 1.00 . A A . 35 ARG CG 1 1 32 20359 1 1 35 ARG CZ C 0.058 5.917 12.029 1.00 . A A . 35 ARG CZ 1 1 32 20360 1 1 35 ARG H H -0.835 2.361 6.521 1.00 . A A . 35 ARG H 1 1 32 20361 1 1 35 ARG HA H -2.559 2.575 8.901 1.00 . A A . 35 ARG HA 1 1 32 20362 1 1 35 ARG HB2 H -1.182 4.651 7.234 1.00 . A A . 35 ARG HB2 1 1 32 20363 1 1 35 ARG HB3 H -2.644 5.066 8.118 1.00 . A A . 35 ARG HB3 1 1 32 20364 1 1 35 ARG HD2 H -0.325 6.645 9.461 1.00 . A A . 35 ARG HD2 1 1 32 20365 1 1 35 ARG HD3 H -2.073 6.431 9.542 1.00 . A A . 35 ARG HD3 1 1 32 20366 1 1 35 ARG HE H -1.893 6.275 11.809 1.00 . A A . 35 ARG HE 1 1 32 20367 1 1 35 ARG HG2 H -1.303 3.930 10.107 1.00 . A A . 35 ARG HG2 1 1 32 20368 1 1 35 ARG HG3 H 0.070 4.436 9.120 1.00 . A A . 35 ARG HG3 1 1 32 20369 1 1 35 ARG HH11 H 1.238 5.620 10.413 1.00 . A A . 35 ARG HH11 1 1 32 20370 1 1 35 ARG HH12 H 2.042 5.539 11.944 1.00 . A A . 35 ARG HH12 1 1 32 20371 1 1 35 ARG HH21 H -0.836 6.169 13.824 1.00 . A A . 35 ARG HH21 1 1 32 20372 1 1 35 ARG HH22 H 0.865 5.850 13.881 1.00 . A A . 35 ARG HH22 1 1 32 20373 1 1 35 ARG N N -1.245 2.117 7.377 1.00 . A A . 35 ARG N 1 1 32 20374 1 1 35 ARG NE N -1.059 6.095 11.327 1.00 . A A . 35 ARG NE 1 1 32 20375 1 1 35 ARG NH1 N 1.207 5.672 11.411 1.00 . A A . 35 ARG NH1 1 1 32 20376 1 1 35 ARG NH2 N 0.026 5.984 13.353 1.00 . A A . 35 ARG NH2 1 1 32 20377 1 1 35 ARG O O -4.660 3.126 7.523 1.00 . A A . 35 ARG O 1 1 32 20378 1 1 36 SER C C -4.148 1.679 3.681 1.00 . A A . 36 SER C 1 1 32 20379 1 1 36 SER CA C -4.441 2.678 4.795 1.00 . A A . 36 SER CA 1 1 32 20380 1 1 36 SER CB C -4.687 4.065 4.201 1.00 . A A . 36 SER CB 1 1 32 20381 1 1 36 SER H H -2.424 2.584 5.424 1.00 . A A . 36 SER H 1 1 32 20382 1 1 36 SER HA H -5.326 2.359 5.326 1.00 . A A . 36 SER HA 1 1 32 20383 1 1 36 SER HB2 H -4.490 4.816 4.951 1.00 . A A . 36 SER HB2 1 1 32 20384 1 1 36 SER HB3 H -4.028 4.216 3.359 1.00 . A A . 36 SER HB3 1 1 32 20385 1 1 36 SER HG H -6.531 4.692 4.415 1.00 . A A . 36 SER HG 1 1 32 20386 1 1 36 SER N N -3.338 2.723 5.748 1.00 . A A . 36 SER N 1 1 32 20387 1 1 36 SER O O -3.036 1.161 3.579 1.00 . A A . 36 SER O 1 1 32 20388 1 1 36 SER OG O -6.028 4.202 3.761 1.00 . A A . 36 SER OG 1 1 32 20389 1 1 37 CYS C C -4.796 1.217 0.420 1.00 . A A . 37 CYS C 1 1 32 20390 1 1 37 CYS CA C -4.982 0.477 1.742 1.00 . A A . 37 CYS CA 1 1 32 20391 1 1 37 CYS CB C -6.185 -0.466 1.662 1.00 . A A . 37 CYS CB 1 1 32 20392 1 1 37 CYS H H -6.010 1.858 2.972 1.00 . A A . 37 CYS H 1 1 32 20393 1 1 37 CYS HA H -4.096 -0.108 1.938 1.00 . A A . 37 CYS HA 1 1 32 20394 1 1 37 CYS HB2 H -7.066 0.057 2.002 1.00 . A A . 37 CYS HB2 1 1 32 20395 1 1 37 CYS HB3 H -6.326 -0.772 0.639 1.00 . A A . 37 CYS HB3 1 1 32 20396 1 1 37 CYS N N -5.146 1.413 2.846 1.00 . A A . 37 CYS N 1 1 32 20397 1 1 37 CYS O O -4.959 0.639 -0.654 1.00 . A A . 37 CYS O 1 1 32 20398 1 1 37 CYS SG S -6.004 -1.969 2.679 1.00 . A A . 37 CYS SG 1 1 32 20399 1 1 38 GLU C C -2.859 3.987 -0.640 1.00 . A A . 38 GLU C 1 1 32 20400 1 1 38 GLU CA C -4.233 3.319 -0.680 1.00 . A A . 38 GLU CA 1 1 32 20401 1 1 38 GLU CB C -5.326 4.383 -0.796 1.00 . A A . 38 GLU CB 1 1 32 20402 1 1 38 GLU CD C -7.747 4.937 -0.332 1.00 . A A . 38 GLU CD 1 1 32 20403 1 1 38 GLU CG C -6.729 3.840 -0.578 1.00 . A A . 38 GLU CG 1 1 32 20404 1 1 38 GLU H H -4.330 2.902 1.393 1.00 . A A . 38 GLU H 1 1 32 20405 1 1 38 GLU HA H -4.280 2.672 -1.543 1.00 . A A . 38 GLU HA 1 1 32 20406 1 1 38 GLU HB2 H -5.143 5.153 -0.060 1.00 . A A . 38 GLU HB2 1 1 32 20407 1 1 38 GLU HB3 H -5.282 4.822 -1.781 1.00 . A A . 38 GLU HB3 1 1 32 20408 1 1 38 GLU HG2 H -7.026 3.284 -1.454 1.00 . A A . 38 GLU HG2 1 1 32 20409 1 1 38 GLU HG3 H -6.717 3.182 0.279 1.00 . A A . 38 GLU HG3 1 1 32 20410 1 1 38 GLU N N -4.448 2.499 0.508 1.00 . A A . 38 GLU N 1 1 32 20411 1 1 38 GLU O O -2.651 4.958 0.087 1.00 . A A . 38 GLU O 1 1 32 20412 1 1 38 GLU OE1 O -7.469 6.098 -0.702 1.00 . A A . 38 GLU OE1 1 1 32 20413 1 1 38 GLU OE2 O -8.821 4.635 0.228 1.00 . A A . 38 GLU OE2 1 1 32 20414 1 1 39 CYS C C -0.572 5.486 -1.786 1.00 . A A . 39 CYS C 1 1 32 20415 1 1 39 CYS CA C -0.567 3.990 -1.479 1.00 . A A . 39 CYS CA 1 1 32 20416 1 1 39 CYS CB C 0.252 3.246 -2.537 1.00 . A A . 39 CYS CB 1 1 32 20417 1 1 39 CYS H H -2.152 2.678 -1.974 1.00 . A A . 39 CYS H 1 1 32 20418 1 1 39 CYS HA H -0.112 3.834 -0.512 1.00 . A A . 39 CYS HA 1 1 32 20419 1 1 39 CYS HB2 H -0.117 3.506 -3.519 1.00 . A A . 39 CYS HB2 1 1 32 20420 1 1 39 CYS HB3 H 1.287 3.544 -2.456 1.00 . A A . 39 CYS HB3 1 1 32 20421 1 1 39 CYS N N -1.925 3.454 -1.423 1.00 . A A . 39 CYS N 1 1 32 20422 1 1 39 CYS O O -1.399 5.966 -2.561 1.00 . A A . 39 CYS O 1 1 32 20423 1 1 39 CYS SG S 0.182 1.433 -2.383 1.00 . A A . 39 CYS SG 1 1 32 20424 1 1 40 PRO C C 1.089 8.028 -2.743 1.00 . A A . 40 PRO C 1 1 32 20425 1 1 40 PRO CA C 0.462 7.689 -1.395 1.00 . A A . 40 PRO CA 1 1 32 20426 1 1 40 PRO CB C 1.368 8.147 -0.253 1.00 . A A . 40 PRO CB 1 1 32 20427 1 1 40 PRO CD C 1.388 5.751 -0.242 1.00 . A A . 40 PRO CD 1 1 32 20428 1 1 40 PRO CG C 2.230 6.968 0.038 1.00 . A A . 40 PRO CG 1 1 32 20429 1 1 40 PRO HA H -0.500 8.173 -1.313 1.00 . A A . 40 PRO HA 1 1 32 20430 1 1 40 PRO HB2 H 1.953 8.997 -0.572 1.00 . A A . 40 PRO HB2 1 1 32 20431 1 1 40 PRO HB3 H 0.767 8.416 0.602 1.00 . A A . 40 PRO HB3 1 1 32 20432 1 1 40 PRO HD2 H 1.985 4.977 -0.700 1.00 . A A . 40 PRO HD2 1 1 32 20433 1 1 40 PRO HD3 H 0.934 5.390 0.669 1.00 . A A . 40 PRO HD3 1 1 32 20434 1 1 40 PRO HG2 H 3.097 6.979 -0.607 1.00 . A A . 40 PRO HG2 1 1 32 20435 1 1 40 PRO HG3 H 2.533 6.982 1.074 1.00 . A A . 40 PRO HG3 1 1 32 20436 1 1 40 PRO N N 0.360 6.245 -1.181 1.00 . A A . 40 PRO N 1 1 32 20437 1 1 40 PRO O O 1.476 7.138 -3.500 1.00 . A A . 40 PRO O 1 1 32 20438 1 1 41 SER C C 3.227 10.175 -4.109 1.00 . A A . 41 SER C 1 1 32 20439 1 1 41 SER CA C 1.767 9.774 -4.295 1.00 . A A . 41 SER CA 1 1 32 20440 1 1 41 SER CB C 0.969 10.954 -4.853 1.00 . A A . 41 SER CB 1 1 32 20441 1 1 41 SER H H 0.860 9.983 -2.393 1.00 . A A . 41 SER H 1 1 32 20442 1 1 41 SER HA H 1.719 8.954 -4.997 1.00 . A A . 41 SER HA 1 1 32 20443 1 1 41 SER HB2 H -0.071 10.842 -4.584 1.00 . A A . 41 SER HB2 1 1 32 20444 1 1 41 SER HB3 H 1.351 11.874 -4.437 1.00 . A A . 41 SER HB3 1 1 32 20445 1 1 41 SER HG H 0.313 10.575 -6.660 1.00 . A A . 41 SER HG 1 1 32 20446 1 1 41 SER N N 1.186 9.320 -3.037 1.00 . A A . 41 SER N 1 1 32 20447 1 1 41 SER O O 3.708 11.114 -4.742 1.00 . A A . 41 SER O 1 1 32 20448 1 1 41 SER OG O 1.069 11.015 -6.266 1.00 . A A . 41 SER OG 1 1 32 20449 1 1 42 TYR C C 6.054 8.472 -2.497 1.00 . A A . 42 TYR C 1 1 32 20450 1 1 42 TYR CA C 5.332 9.733 -2.971 1.00 . A A . 42 TYR CA 1 1 32 20451 1 1 42 TYR CB C 5.466 10.842 -1.924 1.00 . A A . 42 TYR CB 1 1 32 20452 1 1 42 TYR CD1 C 5.864 9.642 0.261 1.00 . A A . 42 TYR CD1 1 1 32 20453 1 1 42 TYR CD2 C 3.807 10.814 -0.020 1.00 . A A . 42 TYR CD2 1 1 32 20454 1 1 42 TYR CE1 C 5.476 9.258 1.531 1.00 . A A . 42 TYR CE1 1 1 32 20455 1 1 42 TYR CE2 C 3.412 10.435 1.249 1.00 . A A . 42 TYR CE2 1 1 32 20456 1 1 42 TYR CG C 5.037 10.425 -0.535 1.00 . A A . 42 TYR CG 1 1 32 20457 1 1 42 TYR CZ C 4.250 9.657 2.020 1.00 . A A . 42 TYR CZ 1 1 32 20458 1 1 42 TYR H H 3.487 8.717 -2.766 1.00 . A A . 42 TYR H 1 1 32 20459 1 1 42 TYR HA H 5.783 10.066 -3.894 1.00 . A A . 42 TYR HA 1 1 32 20460 1 1 42 TYR HB2 H 6.499 11.154 -1.871 1.00 . A A . 42 TYR HB2 1 1 32 20461 1 1 42 TYR HB3 H 4.857 11.683 -2.222 1.00 . A A . 42 TYR HB3 1 1 32 20462 1 1 42 TYR HD1 H 6.823 9.332 -0.125 1.00 . A A . 42 TYR HD1 1 1 32 20463 1 1 42 TYR HD2 H 3.152 11.423 -0.627 1.00 . A A . 42 TYR HD2 1 1 32 20464 1 1 42 TYR HE1 H 6.133 8.650 2.134 1.00 . A A . 42 TYR HE1 1 1 32 20465 1 1 42 TYR HE2 H 2.452 10.747 1.631 1.00 . A A . 42 TYR HE2 1 1 32 20466 1 1 42 TYR HH H 3.829 8.319 3.335 1.00 . A A . 42 TYR HH 1 1 32 20467 1 1 42 TYR N N 3.926 9.455 -3.238 1.00 . A A . 42 TYR N 1 1 32 20468 1 1 42 TYR O O 5.479 7.652 -1.781 1.00 . A A . 42 TYR O 1 1 32 20469 1 1 42 TYR OH O 3.861 9.277 3.284 1.00 . A A . 42 TYR OH 1 1 32 20470 1 1 43 PRO C C 8.552 7.184 -1.039 1.00 . A A . 43 PRO C 1 1 32 20471 1 1 43 PRO CA C 8.121 7.130 -2.501 1.00 . A A . 43 PRO CA 1 1 32 20472 1 1 43 PRO CB C 9.338 7.211 -3.421 1.00 . A A . 43 PRO CB 1 1 32 20473 1 1 43 PRO CD C 8.093 9.226 -3.747 1.00 . A A . 43 PRO CD 1 1 32 20474 1 1 43 PRO CG C 9.488 8.663 -3.715 1.00 . A A . 43 PRO CG 1 1 32 20475 1 1 43 PRO HA H 7.586 6.210 -2.685 1.00 . A A . 43 PRO HA 1 1 32 20476 1 1 43 PRO HB2 H 10.205 6.816 -2.912 1.00 . A A . 43 PRO HB2 1 1 32 20477 1 1 43 PRO HB3 H 9.151 6.643 -4.321 1.00 . A A . 43 PRO HB3 1 1 32 20478 1 1 43 PRO HD2 H 8.082 10.226 -3.338 1.00 . A A . 43 PRO HD2 1 1 32 20479 1 1 43 PRO HD3 H 7.709 9.225 -4.756 1.00 . A A . 43 PRO HD3 1 1 32 20480 1 1 43 PRO HG2 H 10.067 9.137 -2.936 1.00 . A A . 43 PRO HG2 1 1 32 20481 1 1 43 PRO HG3 H 9.968 8.796 -4.674 1.00 . A A . 43 PRO HG3 1 1 32 20482 1 1 43 PRO N N 7.327 8.299 -2.891 1.00 . A A . 43 PRO N 1 1 32 20483 1 1 43 PRO O O 8.764 8.261 -0.483 1.00 . A A . 43 PRO O 1 1 32 20484 1 1 44 GLY C C 10.566 5.674 1.130 1.00 . A A . 44 GLY C 1 1 32 20485 1 1 44 GLY CA C 9.084 5.949 0.969 1.00 . A A . 44 GLY CA 1 1 32 20486 1 1 44 GLY H H 8.496 5.187 -0.917 1.00 . A A . 44 GLY H 1 1 32 20487 1 1 44 GLY HA2 H 8.528 5.163 1.458 1.00 . A A . 44 GLY HA2 1 1 32 20488 1 1 44 GLY HA3 H 8.850 6.890 1.445 1.00 . A A . 44 GLY HA3 1 1 32 20489 1 1 44 GLY N N 8.679 6.014 -0.423 1.00 . A A . 44 GLY N 1 1 32 20490 1 1 44 GLY O O 11.048 4.601 0.767 1.00 . A A . 44 GLY O 1 1 32 20491 1 1 45 ASN C C 13.244 7.559 2.855 1.00 . A A . 45 ASN C 1 1 32 20492 1 1 45 ASN CA C 12.727 6.504 1.882 1.00 . A A . 45 ASN CA 1 1 32 20493 1 1 45 ASN CB C 13.470 6.615 0.549 1.00 . A A . 45 ASN CB 1 1 32 20494 1 1 45 ASN CG C 14.839 5.966 0.594 1.00 . A A . 45 ASN CG 1 1 32 20495 1 1 45 ASN H H 10.849 7.478 1.943 1.00 . A A . 45 ASN H 1 1 32 20496 1 1 45 ASN HA H 12.906 5.525 2.302 1.00 . A A . 45 ASN HA 1 1 32 20497 1 1 45 ASN HB2 H 12.889 6.132 -0.222 1.00 . A A . 45 ASN HB2 1 1 32 20498 1 1 45 ASN HB3 H 13.594 7.659 0.300 1.00 . A A . 45 ASN HB3 1 1 32 20499 1 1 45 ASN HD21 H 14.327 4.727 -0.873 1.00 . A A . 45 ASN HD21 1 1 32 20500 1 1 45 ASN HD22 H 15.931 4.540 -0.259 1.00 . A A . 45 ASN HD22 1 1 32 20501 1 1 45 ASN N N 11.291 6.646 1.674 1.00 . A A . 45 ASN N 1 1 32 20502 1 1 45 ASN ND2 N 15.054 4.978 -0.266 1.00 . A A . 45 ASN ND2 1 1 32 20503 1 1 45 ASN O O 14.029 7.257 3.754 1.00 . A A . 45 ASN O 1 1 32 20504 1 1 45 ASN OD1 O 15.695 6.349 1.393 1.00 . A A . 45 ASN OD1 1 1 32 20505 1 1 46 GLY C C 12.090 10.816 3.898 1.00 . A A . 46 GLY C 1 1 32 20506 1 1 46 GLY CA C 13.225 9.877 3.538 1.00 . A A . 46 GLY CA 1 1 32 20507 1 1 46 GLY H H 12.173 8.978 1.936 1.00 . A A . 46 GLY H 1 1 32 20508 1 1 46 GLY HA2 H 13.999 10.441 3.038 1.00 . A A . 46 GLY HA2 1 1 32 20509 1 1 46 GLY HA3 H 13.630 9.455 4.446 1.00 . A A . 46 GLY HA3 1 1 32 20510 1 1 46 GLY N N 12.797 8.797 2.669 1.00 . A A . 46 GLY N 1 1 32 20511 1 1 46 GLY O O 11.267 10.448 4.763 1.00 . A A . 46 GLY O 1 1 32 20512 1 1 46 GLY OXT O 12.024 11.919 3.315 1.00 . A A . 46 GLY OXT 1 1 33 20513 1 1 1 ALA C C -16.278 -3.618 9.003 1.00 . A A . 1 ALA C 1 1 33 20514 1 1 1 ALA CA C -16.600 -2.244 9.582 1.00 . A A . 1 ALA CA 1 1 33 20515 1 1 1 ALA CB C -16.073 -2.135 11.005 1.00 . A A . 1 ALA CB 1 1 33 20516 1 1 1 ALA H1 H -18.546 -2.851 9.862 1.00 . A A . 1 ALA H1 1 1 33 20517 1 1 1 ALA H2 H -18.256 -1.194 10.204 1.00 . A A . 1 ALA H2 1 1 33 20518 1 1 1 ALA H3 H -18.322 -1.738 8.578 1.00 . A A . 1 ALA H3 1 1 33 20519 1 1 1 ALA HA H -16.109 -1.490 8.984 1.00 . A A . 1 ALA HA 1 1 33 20520 1 1 1 ALA HB1 H -16.747 -1.530 11.593 1.00 . A A . 1 ALA HB1 1 1 33 20521 1 1 1 ALA HB2 H -15.095 -1.677 10.993 1.00 . A A . 1 ALA HB2 1 1 33 20522 1 1 1 ALA HB3 H -16.003 -3.121 11.440 1.00 . A A . 1 ALA HB3 1 1 33 20523 1 1 1 ALA N N -18.063 -1.983 9.554 1.00 . A A . 1 ALA N 1 1 33 20524 1 1 1 ALA O O -15.371 -4.303 9.474 1.00 . A A . 1 ALA O 1 1 33 20525 1 1 2 MET C C -16.803 -5.161 5.818 1.00 . A A . 2 MET C 1 1 33 20526 1 1 2 MET CA C -16.823 -5.306 7.337 1.00 . A A . 2 MET CA 1 1 33 20527 1 1 2 MET CB C -17.920 -6.287 7.753 1.00 . A A . 2 MET CB 1 1 33 20528 1 1 2 MET CE C -17.473 -10.234 9.028 1.00 . A A . 2 MET CE 1 1 33 20529 1 1 2 MET CG C -17.444 -7.727 7.847 1.00 . A A . 2 MET CG 1 1 33 20530 1 1 2 MET H H -17.737 -3.422 7.650 1.00 . A A . 2 MET H 1 1 33 20531 1 1 2 MET HA H -15.867 -5.689 7.662 1.00 . A A . 2 MET HA 1 1 33 20532 1 1 2 MET HB2 H -18.302 -5.993 8.719 1.00 . A A . 2 MET HB2 1 1 33 20533 1 1 2 MET HB3 H -18.721 -6.241 7.030 1.00 . A A . 2 MET HB3 1 1 33 20534 1 1 2 MET HE1 H -16.413 -10.027 9.008 1.00 . A A . 2 MET HE1 1 1 33 20535 1 1 2 MET HE2 H -17.712 -10.805 9.913 1.00 . A A . 2 MET HE2 1 1 33 20536 1 1 2 MET HE3 H -17.745 -10.801 8.150 1.00 . A A . 2 MET HE3 1 1 33 20537 1 1 2 MET HG2 H -17.548 -8.190 6.877 1.00 . A A . 2 MET HG2 1 1 33 20538 1 1 2 MET HG3 H -16.404 -7.731 8.136 1.00 . A A . 2 MET HG3 1 1 33 20539 1 1 2 MET N N -17.028 -4.013 7.980 1.00 . A A . 2 MET N 1 1 33 20540 1 1 2 MET O O -17.827 -5.332 5.156 1.00 . A A . 2 MET O 1 1 33 20541 1 1 2 MET SD S -18.382 -8.691 9.048 1.00 . A A . 2 MET SD 1 1 33 20542 1 1 3 ASP C C -14.258 -5.432 3.324 1.00 . A A . 3 ASP C 1 1 33 20543 1 1 3 ASP CA C -15.481 -4.676 3.833 1.00 . A A . 3 ASP CA 1 1 33 20544 1 1 3 ASP CB C -15.361 -3.192 3.482 1.00 . A A . 3 ASP CB 1 1 33 20545 1 1 3 ASP CG C -16.618 -2.415 3.818 1.00 . A A . 3 ASP CG 1 1 33 20546 1 1 3 ASP H H -14.853 -4.721 5.855 1.00 . A A . 3 ASP H 1 1 33 20547 1 1 3 ASP HA H -16.362 -5.080 3.358 1.00 . A A . 3 ASP HA 1 1 33 20548 1 1 3 ASP HB2 H -14.537 -2.764 4.032 1.00 . A A . 3 ASP HB2 1 1 33 20549 1 1 3 ASP HB3 H -15.171 -3.094 2.423 1.00 . A A . 3 ASP HB3 1 1 33 20550 1 1 3 ASP N N -15.633 -4.844 5.274 1.00 . A A . 3 ASP N 1 1 33 20551 1 1 3 ASP O O -13.555 -6.086 4.094 1.00 . A A . 3 ASP O 1 1 33 20552 1 1 3 ASP OD1 O -16.742 -1.958 4.974 1.00 . A A . 3 ASP OD1 1 1 33 20553 1 1 3 ASP OD2 O -17.479 -2.263 2.926 1.00 . A A . 3 ASP OD2 1 1 33 20554 1 1 4 CYS C C -11.613 -5.157 1.514 1.00 . A A . 4 CYS C 1 1 33 20555 1 1 4 CYS CA C -12.871 -6.011 1.409 1.00 . A A . 4 CYS CA 1 1 33 20556 1 1 4 CYS CB C -13.170 -6.329 -0.058 1.00 . A A . 4 CYS CB 1 1 33 20557 1 1 4 CYS H H -14.607 -4.800 1.459 1.00 . A A . 4 CYS H 1 1 33 20558 1 1 4 CYS HA H -12.709 -6.934 1.942 1.00 . A A . 4 CYS HA 1 1 33 20559 1 1 4 CYS HB2 H -14.209 -6.116 -0.261 1.00 . A A . 4 CYS HB2 1 1 33 20560 1 1 4 CYS HB3 H -12.551 -5.707 -0.689 1.00 . A A . 4 CYS HB3 1 1 33 20561 1 1 4 CYS N N -14.010 -5.337 2.022 1.00 . A A . 4 CYS N 1 1 33 20562 1 1 4 CYS O O -10.522 -5.667 1.768 1.00 . A A . 4 CYS O 1 1 33 20563 1 1 4 CYS SG S -12.863 -8.065 -0.520 1.00 . A A . 4 CYS SG 1 1 33 20564 1 1 5 THR C C -9.575 -3.296 0.370 1.00 . A A . 5 THR C 1 1 33 20565 1 1 5 THR CA C -10.652 -2.926 1.387 1.00 . A A . 5 THR CA 1 1 33 20566 1 1 5 THR CB C -10.059 -2.917 2.797 1.00 . A A . 5 THR CB 1 1 33 20567 1 1 5 THR CG2 C -9.180 -1.716 3.069 1.00 . A A . 5 THR CG2 1 1 33 20568 1 1 5 THR H H -12.668 -3.510 1.117 1.00 . A A . 5 THR H 1 1 33 20569 1 1 5 THR HA H -11.024 -1.939 1.156 1.00 . A A . 5 THR HA 1 1 33 20570 1 1 5 THR HB H -9.457 -3.804 2.929 1.00 . A A . 5 THR HB 1 1 33 20571 1 1 5 THR HG1 H -10.768 -3.358 4.569 1.00 . A A . 5 THR HG1 1 1 33 20572 1 1 5 THR HG21 H -9.309 -0.989 2.281 1.00 . A A . 5 THR HG21 1 1 33 20573 1 1 5 THR HG22 H -9.456 -1.274 4.015 1.00 . A A . 5 THR HG22 1 1 33 20574 1 1 5 THR HG23 H -8.146 -2.027 3.106 1.00 . A A . 5 THR HG23 1 1 33 20575 1 1 5 THR N N -11.774 -3.855 1.316 1.00 . A A . 5 THR N 1 1 33 20576 1 1 5 THR O O -8.481 -3.725 0.736 1.00 . A A . 5 THR O 1 1 33 20577 1 1 5 THR OG1 O -11.086 -2.927 3.772 1.00 . A A . 5 THR OG1 1 1 33 20578 1 1 6 THR C C -8.186 -2.197 -2.409 1.00 . A A . 6 THR C 1 1 33 20579 1 1 6 THR CA C -8.955 -3.441 -1.979 1.00 . A A . 6 THR CA 1 1 33 20580 1 1 6 THR CB C -9.696 -4.036 -3.178 1.00 . A A . 6 THR CB 1 1 33 20581 1 1 6 THR CG2 C -10.090 -5.484 -2.979 1.00 . A A . 6 THR CG2 1 1 33 20582 1 1 6 THR H H -10.782 -2.781 -1.138 1.00 . A A . 6 THR H 1 1 33 20583 1 1 6 THR HA H -8.255 -4.171 -1.601 1.00 . A A . 6 THR HA 1 1 33 20584 1 1 6 THR HB H -9.055 -3.984 -4.046 1.00 . A A . 6 THR HB 1 1 33 20585 1 1 6 THR HG1 H -10.667 -2.560 -4.023 1.00 . A A . 6 THR HG1 1 1 33 20586 1 1 6 THR HG21 H -9.317 -5.995 -2.425 1.00 . A A . 6 THR HG21 1 1 33 20587 1 1 6 THR HG22 H -11.019 -5.532 -2.429 1.00 . A A . 6 THR HG22 1 1 33 20588 1 1 6 THR HG23 H -10.217 -5.958 -3.941 1.00 . A A . 6 THR HG23 1 1 33 20589 1 1 6 THR N N -9.894 -3.126 -0.909 1.00 . A A . 6 THR N 1 1 33 20590 1 1 6 THR O O -8.626 -1.072 -2.175 1.00 . A A . 6 THR O 1 1 33 20591 1 1 6 THR OG1 O -10.876 -3.303 -3.452 1.00 . A A . 6 THR OG1 1 1 33 20592 1 1 7 GLY C C -4.764 -1.662 -3.671 1.00 . A A . 7 GLY C 1 1 33 20593 1 1 7 GLY CA C -6.224 -1.289 -3.487 1.00 . A A . 7 GLY CA 1 1 33 20594 1 1 7 GLY H H -6.731 -3.324 -3.196 1.00 . A A . 7 GLY H 1 1 33 20595 1 1 7 GLY HA2 H -6.291 -0.494 -2.758 1.00 . A A . 7 GLY HA2 1 1 33 20596 1 1 7 GLY HA3 H -6.614 -0.933 -4.429 1.00 . A A . 7 GLY HA3 1 1 33 20597 1 1 7 GLY N N -7.034 -2.406 -3.037 1.00 . A A . 7 GLY N 1 1 33 20598 1 1 7 GLY O O -4.388 -2.819 -3.484 1.00 . A A . 7 GLY O 1 1 33 20599 1 1 8 PRO C C -1.736 -1.249 -2.963 1.00 . A A . 8 PRO C 1 1 33 20600 1 1 8 PRO CA C -2.480 -0.933 -4.258 1.00 . A A . 8 PRO CA 1 1 33 20601 1 1 8 PRO CB C -1.981 0.387 -4.853 1.00 . A A . 8 PRO CB 1 1 33 20602 1 1 8 PRO CD C -4.280 0.714 -4.294 1.00 . A A . 8 PRO CD 1 1 33 20603 1 1 8 PRO CG C -2.952 1.410 -4.376 1.00 . A A . 8 PRO CG 1 1 33 20604 1 1 8 PRO HA H -2.316 -1.733 -4.965 1.00 . A A . 8 PRO HA 1 1 33 20605 1 1 8 PRO HB2 H -0.982 0.591 -4.496 1.00 . A A . 8 PRO HB2 1 1 33 20606 1 1 8 PRO HB3 H -1.976 0.321 -5.932 1.00 . A A . 8 PRO HB3 1 1 33 20607 1 1 8 PRO HD2 H -4.864 1.110 -3.477 1.00 . A A . 8 PRO HD2 1 1 33 20608 1 1 8 PRO HD3 H -4.816 0.812 -5.226 1.00 . A A . 8 PRO HD3 1 1 33 20609 1 1 8 PRO HG2 H -2.657 1.771 -3.402 1.00 . A A . 8 PRO HG2 1 1 33 20610 1 1 8 PRO HG3 H -3.000 2.228 -5.080 1.00 . A A . 8 PRO HG3 1 1 33 20611 1 1 8 PRO N N -3.912 -0.693 -4.045 1.00 . A A . 8 PRO N 1 1 33 20612 1 1 8 PRO O O -0.683 -1.886 -2.983 1.00 . A A . 8 PRO O 1 1 33 20613 1 1 9 CYS C C -2.443 -2.075 0.267 1.00 . A A . 9 CYS C 1 1 33 20614 1 1 9 CYS CA C -1.661 -1.038 -0.538 1.00 . A A . 9 CYS CA 1 1 33 20615 1 1 9 CYS CB C -1.556 0.273 0.245 1.00 . A A . 9 CYS CB 1 1 33 20616 1 1 9 CYS H H -3.124 -0.296 -1.881 1.00 . A A . 9 CYS H 1 1 33 20617 1 1 9 CYS HA H -0.666 -1.418 -0.716 1.00 . A A . 9 CYS HA 1 1 33 20618 1 1 9 CYS HB2 H -0.989 0.985 -0.335 1.00 . A A . 9 CYS HB2 1 1 33 20619 1 1 9 CYS HB3 H -2.547 0.664 0.412 1.00 . A A . 9 CYS HB3 1 1 33 20620 1 1 9 CYS N N -2.284 -0.800 -1.837 1.00 . A A . 9 CYS N 1 1 33 20621 1 1 9 CYS O O -2.826 -1.832 1.412 1.00 . A A . 9 CYS O 1 1 33 20622 1 1 9 CYS SG S -0.743 0.115 1.868 1.00 . A A . 9 CYS SG 1 1 33 20623 1 1 10 CYS C C -3.489 -5.542 -0.576 1.00 . A A . 10 CYS C 1 1 33 20624 1 1 10 CYS CA C -3.401 -4.314 0.321 1.00 . A A . 10 CYS CA 1 1 33 20625 1 1 10 CYS CB C -4.807 -3.854 0.723 1.00 . A A . 10 CYS CB 1 1 33 20626 1 1 10 CYS H H -2.339 -3.372 -1.250 1.00 . A A . 10 CYS H 1 1 33 20627 1 1 10 CYS HA H -2.855 -4.581 1.212 1.00 . A A . 10 CYS HA 1 1 33 20628 1 1 10 CYS HB2 H -5.458 -4.715 0.769 1.00 . A A . 10 CYS HB2 1 1 33 20629 1 1 10 CYS HB3 H -4.760 -3.394 1.700 1.00 . A A . 10 CYS HB3 1 1 33 20630 1 1 10 CYS N N -2.672 -3.235 -0.339 1.00 . A A . 10 CYS N 1 1 33 20631 1 1 10 CYS O O -4.114 -5.508 -1.636 1.00 . A A . 10 CYS O 1 1 33 20632 1 1 10 CYS SG S -5.566 -2.653 -0.419 1.00 . A A . 10 CYS SG 1 1 33 20633 1 1 11 ARG C C -4.143 -8.650 -0.670 1.00 . A A . 11 ARG C 1 1 33 20634 1 1 11 ARG CA C -2.857 -7.870 -0.905 1.00 . A A . 11 ARG CA 1 1 33 20635 1 1 11 ARG CB C -1.648 -8.728 -0.531 1.00 . A A . 11 ARG CB 1 1 33 20636 1 1 11 ARG CD C -1.706 -11.005 -1.592 1.00 . A A . 11 ARG CD 1 1 33 20637 1 1 11 ARG CG C -1.141 -9.596 -1.671 1.00 . A A . 11 ARG CG 1 1 33 20638 1 1 11 ARG CZ C 0.383 -12.307 -1.484 1.00 . A A . 11 ARG CZ 1 1 33 20639 1 1 11 ARG H H -2.374 -6.591 0.710 1.00 . A A . 11 ARG H 1 1 33 20640 1 1 11 ARG HA H -2.798 -7.615 -1.952 1.00 . A A . 11 ARG HA 1 1 33 20641 1 1 11 ARG HB2 H -0.844 -8.079 -0.216 1.00 . A A . 11 ARG HB2 1 1 33 20642 1 1 11 ARG HB3 H -1.919 -9.374 0.291 1.00 . A A . 11 ARG HB3 1 1 33 20643 1 1 11 ARG HD2 H -2.624 -10.979 -1.024 1.00 . A A . 11 ARG HD2 1 1 33 20644 1 1 11 ARG HD3 H -1.913 -11.352 -2.594 1.00 . A A . 11 ARG HD3 1 1 33 20645 1 1 11 ARG HE H -1.031 -12.294 -0.076 1.00 . A A . 11 ARG HE 1 1 33 20646 1 1 11 ARG HG2 H -1.439 -9.151 -2.609 1.00 . A A . 11 ARG HG2 1 1 33 20647 1 1 11 ARG HG3 H -0.063 -9.646 -1.621 1.00 . A A . 11 ARG HG3 1 1 33 20648 1 1 11 ARG HH11 H 0.173 -11.197 -3.163 1.00 . A A . 11 ARG HH11 1 1 33 20649 1 1 11 ARG HH12 H 1.634 -12.122 -3.062 1.00 . A A . 11 ARG HH12 1 1 33 20650 1 1 11 ARG HH21 H 0.890 -13.511 0.058 1.00 . A A . 11 ARG HH21 1 1 33 20651 1 1 11 ARG HH22 H 2.041 -13.436 -1.235 1.00 . A A . 11 ARG HH22 1 1 33 20652 1 1 11 ARG N N -2.855 -6.627 -0.143 1.00 . A A . 11 ARG N 1 1 33 20653 1 1 11 ARG NE N -0.777 -11.932 -0.951 1.00 . A A . 11 ARG NE 1 1 33 20654 1 1 11 ARG NH1 N 0.761 -11.837 -2.667 1.00 . A A . 11 ARG NH1 1 1 33 20655 1 1 11 ARG NH2 N 1.169 -13.154 -0.834 1.00 . A A . 11 ARG NH2 1 1 33 20656 1 1 11 ARG O O -4.407 -9.119 0.437 1.00 . A A . 11 ARG O 1 1 33 20657 1 1 12 GLN C C -7.010 -9.089 -0.422 1.00 . A A . 12 GLN C 1 1 33 20658 1 1 12 GLN CA C -6.211 -9.492 -1.652 1.00 . A A . 12 GLN CA 1 1 33 20659 1 1 12 GLN CB C -5.993 -10.996 -1.640 1.00 . A A . 12 GLN CB 1 1 33 20660 1 1 12 GLN CD C -4.460 -12.890 -2.307 1.00 . A A . 12 GLN CD 1 1 33 20661 1 1 12 GLN CG C -4.906 -11.469 -2.592 1.00 . A A . 12 GLN CG 1 1 33 20662 1 1 12 GLN H H -4.672 -8.375 -2.575 1.00 . A A . 12 GLN H 1 1 33 20663 1 1 12 GLN HA H -6.781 -9.232 -2.531 1.00 . A A . 12 GLN HA 1 1 33 20664 1 1 12 GLN HB2 H -5.728 -11.297 -0.640 1.00 . A A . 12 GLN HB2 1 1 33 20665 1 1 12 GLN HB3 H -6.920 -11.471 -1.917 1.00 . A A . 12 GLN HB3 1 1 33 20666 1 1 12 GLN HE21 H -5.064 -13.468 -4.111 1.00 . A A . 12 GLN HE21 1 1 33 20667 1 1 12 GLN HE22 H -4.373 -14.702 -3.120 1.00 . A A . 12 GLN HE22 1 1 33 20668 1 1 12 GLN HG2 H -5.285 -11.423 -3.602 1.00 . A A . 12 GLN HG2 1 1 33 20669 1 1 12 GLN HG3 H -4.053 -10.813 -2.498 1.00 . A A . 12 GLN HG3 1 1 33 20670 1 1 12 GLN N N -4.942 -8.777 -1.723 1.00 . A A . 12 GLN N 1 1 33 20671 1 1 12 GLN NE2 N -4.652 -13.776 -3.277 1.00 . A A . 12 GLN NE2 1 1 33 20672 1 1 12 GLN O O -6.921 -9.720 0.632 1.00 . A A . 12 GLN O 1 1 33 20673 1 1 12 GLN OE1 O -3.949 -13.188 -1.227 1.00 . A A . 12 GLN OE1 1 1 33 20674 1 1 13 CYS C C -8.004 -7.643 1.862 1.00 . A A . 13 CYS C 1 1 33 20675 1 1 13 CYS CA C -8.651 -7.512 0.481 1.00 . A A . 13 CYS CA 1 1 33 20676 1 1 13 CYS CB C -10.001 -8.233 0.471 1.00 . A A . 13 CYS CB 1 1 33 20677 1 1 13 CYS H H -7.810 -7.612 -1.461 1.00 . A A . 13 CYS H 1 1 33 20678 1 1 13 CYS HA H -8.818 -6.466 0.277 1.00 . A A . 13 CYS HA 1 1 33 20679 1 1 13 CYS HB2 H -9.839 -9.286 0.650 1.00 . A A . 13 CYS HB2 1 1 33 20680 1 1 13 CYS HB3 H -10.622 -7.831 1.257 1.00 . A A . 13 CYS HB3 1 1 33 20681 1 1 13 CYS N N -7.796 -8.041 -0.585 1.00 . A A . 13 CYS N 1 1 33 20682 1 1 13 CYS O O -8.601 -8.200 2.784 1.00 . A A . 13 CYS O 1 1 33 20683 1 1 13 CYS SG S -10.917 -8.075 -1.096 1.00 . A A . 13 CYS SG 1 1 33 20684 1 1 14 LYS C C -5.093 -6.044 3.408 1.00 . A A . 14 LYS C 1 1 33 20685 1 1 14 LYS CA C -6.082 -7.194 3.277 1.00 . A A . 14 LYS CA 1 1 33 20686 1 1 14 LYS CB C -5.350 -8.531 3.410 1.00 . A A . 14 LYS CB 1 1 33 20687 1 1 14 LYS CD C -6.135 -9.206 5.699 1.00 . A A . 14 LYS CD 1 1 33 20688 1 1 14 LYS CE C -6.334 -10.709 5.797 1.00 . A A . 14 LYS CE 1 1 33 20689 1 1 14 LYS CG C -4.935 -8.857 4.835 1.00 . A A . 14 LYS CG 1 1 33 20690 1 1 14 LYS H H -6.352 -6.691 1.241 1.00 . A A . 14 LYS H 1 1 33 20691 1 1 14 LYS HA H -6.815 -7.115 4.066 1.00 . A A . 14 LYS HA 1 1 33 20692 1 1 14 LYS HB2 H -5.998 -9.319 3.057 1.00 . A A . 14 LYS HB2 1 1 33 20693 1 1 14 LYS HB3 H -4.462 -8.504 2.796 1.00 . A A . 14 LYS HB3 1 1 33 20694 1 1 14 LYS HD2 H -5.980 -8.808 6.691 1.00 . A A . 14 LYS HD2 1 1 33 20695 1 1 14 LYS HD3 H -7.020 -8.762 5.265 1.00 . A A . 14 LYS HD3 1 1 33 20696 1 1 14 LYS HE2 H -7.044 -11.016 5.044 1.00 . A A . 14 LYS HE2 1 1 33 20697 1 1 14 LYS HE3 H -5.387 -11.197 5.618 1.00 . A A . 14 LYS HE3 1 1 33 20698 1 1 14 LYS HG2 H -4.259 -9.700 4.819 1.00 . A A . 14 LYS HG2 1 1 33 20699 1 1 14 LYS HG3 H -4.433 -7.999 5.259 1.00 . A A . 14 LYS HG3 1 1 33 20700 1 1 14 LYS HZ1 H -6.586 -10.405 7.848 1.00 . A A . 14 LYS HZ1 1 1 33 20701 1 1 14 LYS HZ2 H -7.879 -11.208 7.111 1.00 . A A . 14 LYS HZ2 1 1 33 20702 1 1 14 LYS HZ3 H -6.432 -12.031 7.412 1.00 . A A . 14 LYS HZ3 1 1 33 20703 1 1 14 LYS N N -6.786 -7.127 2.004 1.00 . A A . 14 LYS N 1 1 33 20704 1 1 14 LYS NZ N -6.844 -11.117 7.136 1.00 . A A . 14 LYS NZ 1 1 33 20705 1 1 14 LYS O O -4.112 -5.971 2.668 1.00 . A A . 14 LYS O 1 1 33 20706 1 1 15 LEU C C -3.021 -4.444 4.634 1.00 . A A . 15 LEU C 1 1 33 20707 1 1 15 LEU CA C -4.478 -4.001 4.587 1.00 . A A . 15 LEU CA 1 1 33 20708 1 1 15 LEU CB C -4.854 -3.295 5.891 1.00 . A A . 15 LEU CB 1 1 33 20709 1 1 15 LEU CD1 C -6.188 -1.552 7.100 1.00 . A A . 15 LEU CD1 1 1 33 20710 1 1 15 LEU CD2 C -5.566 -1.208 4.702 1.00 . A A . 15 LEU CD2 1 1 33 20711 1 1 15 LEU CG C -5.945 -2.232 5.761 1.00 . A A . 15 LEU CG 1 1 33 20712 1 1 15 LEU H H -6.149 -5.261 4.918 1.00 . A A . 15 LEU H 1 1 33 20713 1 1 15 LEU HA H -4.607 -3.315 3.764 1.00 . A A . 15 LEU HA 1 1 33 20714 1 1 15 LEU HB2 H -5.189 -4.042 6.596 1.00 . A A . 15 LEU HB2 1 1 33 20715 1 1 15 LEU HB3 H -3.968 -2.823 6.288 1.00 . A A . 15 LEU HB3 1 1 33 20716 1 1 15 LEU HD11 H -5.250 -1.195 7.498 1.00 . A A . 15 LEU HD11 1 1 33 20717 1 1 15 LEU HD12 H -6.861 -0.718 6.963 1.00 . A A . 15 LEU HD12 1 1 33 20718 1 1 15 LEU HD13 H -6.627 -2.259 7.788 1.00 . A A . 15 LEU HD13 1 1 33 20719 1 1 15 LEU HD21 H -4.534 -0.916 4.836 1.00 . A A . 15 LEU HD21 1 1 33 20720 1 1 15 LEU HD22 H -5.693 -1.640 3.721 1.00 . A A . 15 LEU HD22 1 1 33 20721 1 1 15 LEU HD23 H -6.200 -0.339 4.798 1.00 . A A . 15 LEU HD23 1 1 33 20722 1 1 15 LEU HG H -6.866 -2.706 5.455 1.00 . A A . 15 LEU HG 1 1 33 20723 1 1 15 LEU N N -5.353 -5.147 4.358 1.00 . A A . 15 LEU N 1 1 33 20724 1 1 15 LEU O O -2.580 -5.058 5.606 1.00 . A A . 15 LEU O 1 1 33 20725 1 1 16 LYS C C -0.094 -3.968 4.681 1.00 . A A . 16 LYS C 1 1 33 20726 1 1 16 LYS CA C -0.879 -4.523 3.492 1.00 . A A . 16 LYS CA 1 1 33 20727 1 1 16 LYS CB C -0.267 -4.029 2.181 1.00 . A A . 16 LYS CB 1 1 33 20728 1 1 16 LYS CD C 1.134 -5.049 0.359 1.00 . A A . 16 LYS CD 1 1 33 20729 1 1 16 LYS CE C 0.987 -5.542 -1.072 1.00 . A A . 16 LYS CE 1 1 33 20730 1 1 16 LYS CG C -0.190 -5.100 1.104 1.00 . A A . 16 LYS CG 1 1 33 20731 1 1 16 LYS H H -2.692 -3.657 2.827 1.00 . A A . 16 LYS H 1 1 33 20732 1 1 16 LYS HA H -0.836 -5.602 3.514 1.00 . A A . 16 LYS HA 1 1 33 20733 1 1 16 LYS HB2 H -0.864 -3.212 1.803 1.00 . A A . 16 LYS HB2 1 1 33 20734 1 1 16 LYS HB3 H 0.734 -3.672 2.375 1.00 . A A . 16 LYS HB3 1 1 33 20735 1 1 16 LYS HD2 H 1.488 -4.030 0.343 1.00 . A A . 16 LYS HD2 1 1 33 20736 1 1 16 LYS HD3 H 1.850 -5.673 0.873 1.00 . A A . 16 LYS HD3 1 1 33 20737 1 1 16 LYS HE2 H 1.968 -5.762 -1.466 1.00 . A A . 16 LYS HE2 1 1 33 20738 1 1 16 LYS HE3 H 0.391 -6.442 -1.069 1.00 . A A . 16 LYS HE3 1 1 33 20739 1 1 16 LYS HG2 H -0.293 -6.070 1.568 1.00 . A A . 16 LYS HG2 1 1 33 20740 1 1 16 LYS HG3 H -0.995 -4.948 0.401 1.00 . A A . 16 LYS HG3 1 1 33 20741 1 1 16 LYS HZ1 H 0.659 -3.574 -1.691 1.00 . A A . 16 LYS HZ1 1 1 33 20742 1 1 16 LYS HZ2 H 0.564 -4.710 -2.941 1.00 . A A . 16 LYS HZ2 1 1 33 20743 1 1 16 LYS HZ3 H -0.701 -4.571 -1.827 1.00 . A A . 16 LYS HZ3 1 1 33 20744 1 1 16 LYS N N -2.282 -4.141 3.574 1.00 . A A . 16 LYS N 1 1 33 20745 1 1 16 LYS NZ N 0.331 -4.528 -1.944 1.00 . A A . 16 LYS NZ 1 1 33 20746 1 1 16 LYS O O -0.383 -2.875 5.168 1.00 . A A . 16 LYS O 1 1 33 20747 1 1 17 PRO C C 2.637 -3.114 5.962 1.00 . A A . 17 PRO C 1 1 33 20748 1 1 17 PRO CA C 1.732 -4.292 6.304 1.00 . A A . 17 PRO CA 1 1 33 20749 1 1 17 PRO CB C 2.572 -5.532 6.621 1.00 . A A . 17 PRO CB 1 1 33 20750 1 1 17 PRO CD C 1.322 -6.035 4.646 1.00 . A A . 17 PRO CD 1 1 33 20751 1 1 17 PRO CG C 2.632 -6.288 5.339 1.00 . A A . 17 PRO CG 1 1 33 20752 1 1 17 PRO HA H 1.123 -4.039 7.159 1.00 . A A . 17 PRO HA 1 1 33 20753 1 1 17 PRO HB2 H 3.556 -5.228 6.947 1.00 . A A . 17 PRO HB2 1 1 33 20754 1 1 17 PRO HB3 H 2.090 -6.108 7.396 1.00 . A A . 17 PRO HB3 1 1 33 20755 1 1 17 PRO HD2 H 1.462 -6.001 3.576 1.00 . A A . 17 PRO HD2 1 1 33 20756 1 1 17 PRO HD3 H 0.602 -6.795 4.911 1.00 . A A . 17 PRO HD3 1 1 33 20757 1 1 17 PRO HG2 H 3.452 -5.924 4.736 1.00 . A A . 17 PRO HG2 1 1 33 20758 1 1 17 PRO HG3 H 2.752 -7.342 5.540 1.00 . A A . 17 PRO HG3 1 1 33 20759 1 1 17 PRO N N 0.910 -4.717 5.166 1.00 . A A . 17 PRO N 1 1 33 20760 1 1 17 PRO O O 3.326 -3.123 4.941 1.00 . A A . 17 PRO O 1 1 33 20761 1 1 18 ALA C C 4.904 -1.298 6.306 1.00 . A A . 18 ALA C 1 1 33 20762 1 1 18 ALA CA C 3.461 -0.914 6.618 1.00 . A A . 18 ALA CA 1 1 33 20763 1 1 18 ALA CB C 3.403 -0.012 7.842 1.00 . A A . 18 ALA CB 1 1 33 20764 1 1 18 ALA H H 2.067 -2.152 7.621 1.00 . A A . 18 ALA H 1 1 33 20765 1 1 18 ALA HA H 3.054 -0.369 5.778 1.00 . A A . 18 ALA HA 1 1 33 20766 1 1 18 ALA HB1 H 4.379 0.037 8.302 1.00 . A A . 18 ALA HB1 1 1 33 20767 1 1 18 ALA HB2 H 2.691 -0.411 8.550 1.00 . A A . 18 ALA HB2 1 1 33 20768 1 1 18 ALA HB3 H 3.096 0.980 7.544 1.00 . A A . 18 ALA HB3 1 1 33 20769 1 1 18 ALA N N 2.635 -2.100 6.825 1.00 . A A . 18 ALA N 1 1 33 20770 1 1 18 ALA O O 5.319 -2.434 6.540 1.00 . A A . 18 ALA O 1 1 33 20771 1 1 19 GLY C C 7.189 -1.542 4.236 1.00 . A A . 19 GLY C 1 1 33 20772 1 1 19 GLY CA C 7.050 -0.614 5.431 1.00 . A A . 19 GLY CA 1 1 33 20773 1 1 19 GLY H H 5.280 0.537 5.602 1.00 . A A . 19 GLY H 1 1 33 20774 1 1 19 GLY HA2 H 7.537 -1.066 6.282 1.00 . A A . 19 GLY HA2 1 1 33 20775 1 1 19 GLY HA3 H 7.539 0.322 5.204 1.00 . A A . 19 GLY HA3 1 1 33 20776 1 1 19 GLY N N 5.664 -0.349 5.771 1.00 . A A . 19 GLY N 1 1 33 20777 1 1 19 GLY O O 8.288 -2.000 3.924 1.00 . A A . 19 GLY O 1 1 33 20778 1 1 20 THR C C 5.651 -1.923 1.155 1.00 . A A . 20 THR C 1 1 33 20779 1 1 20 THR CA C 6.072 -2.694 2.402 1.00 . A A . 20 THR CA 1 1 33 20780 1 1 20 THR CB C 5.126 -3.876 2.634 1.00 . A A . 20 THR CB 1 1 33 20781 1 1 20 THR CG2 C 5.027 -4.816 1.451 1.00 . A A . 20 THR CG2 1 1 33 20782 1 1 20 THR H H 5.227 -1.423 3.862 1.00 . A A . 20 THR H 1 1 33 20783 1 1 20 THR HA H 7.076 -3.067 2.263 1.00 . A A . 20 THR HA 1 1 33 20784 1 1 20 THR HB H 4.135 -3.494 2.835 1.00 . A A . 20 THR HB 1 1 33 20785 1 1 20 THR HG1 H 5.040 -4.374 4.526 1.00 . A A . 20 THR HG1 1 1 33 20786 1 1 20 THR HG21 H 5.360 -4.308 0.558 1.00 . A A . 20 THR HG21 1 1 33 20787 1 1 20 THR HG22 H 5.649 -5.681 1.626 1.00 . A A . 20 THR HG22 1 1 33 20788 1 1 20 THR HG23 H 4.001 -5.130 1.326 1.00 . A A . 20 THR HG23 1 1 33 20789 1 1 20 THR N N 6.073 -1.819 3.567 1.00 . A A . 20 THR N 1 1 33 20790 1 1 20 THR O O 4.538 -1.406 1.083 1.00 . A A . 20 THR O 1 1 33 20791 1 1 20 THR OG1 O 5.543 -4.638 3.752 1.00 . A A . 20 THR OG1 1 1 33 20792 1 1 21 THR C C 4.868 -1.445 -1.589 1.00 . A A . 21 THR C 1 1 33 20793 1 1 21 THR CA C 6.271 -1.131 -1.070 1.00 . A A . 21 THR CA 1 1 33 20794 1 1 21 THR CB C 7.310 -1.491 -2.129 1.00 . A A . 21 THR CB 1 1 33 20795 1 1 21 THR CG2 C 7.287 -2.953 -2.500 1.00 . A A . 21 THR CG2 1 1 33 20796 1 1 21 THR H H 7.422 -2.276 0.292 1.00 . A A . 21 THR H 1 1 33 20797 1 1 21 THR HA H 6.337 -0.076 -0.865 1.00 . A A . 21 THR HA 1 1 33 20798 1 1 21 THR HB H 8.294 -1.261 -1.748 1.00 . A A . 21 THR HB 1 1 33 20799 1 1 21 THR HG1 H 7.292 0.185 -3.143 1.00 . A A . 21 THR HG1 1 1 33 20800 1 1 21 THR HG21 H 6.650 -3.485 -1.809 1.00 . A A . 21 THR HG21 1 1 33 20801 1 1 21 THR HG22 H 6.901 -3.061 -3.503 1.00 . A A . 21 THR HG22 1 1 33 20802 1 1 21 THR HG23 H 8.288 -3.353 -2.452 1.00 . A A . 21 THR HG23 1 1 33 20803 1 1 21 THR N N 6.549 -1.845 0.175 1.00 . A A . 21 THR N 1 1 33 20804 1 1 21 THR O O 4.649 -2.461 -2.249 1.00 . A A . 21 THR O 1 1 33 20805 1 1 21 THR OG1 O 7.102 -0.741 -3.313 1.00 . A A . 21 THR OG1 1 1 33 20806 1 1 22 CYS C C 2.426 -0.789 -3.222 1.00 . A A . 22 CYS C 1 1 33 20807 1 1 22 CYS CA C 2.539 -0.751 -1.701 1.00 . A A . 22 CYS CA 1 1 33 20808 1 1 22 CYS CB C 1.658 0.365 -1.128 1.00 . A A . 22 CYS CB 1 1 33 20809 1 1 22 CYS H H 4.156 0.219 -0.743 1.00 . A A . 22 CYS H 1 1 33 20810 1 1 22 CYS HA H 2.198 -1.695 -1.308 1.00 . A A . 22 CYS HA 1 1 33 20811 1 1 22 CYS HB2 H 0.629 0.038 -1.133 1.00 . A A . 22 CYS HB2 1 1 33 20812 1 1 22 CYS HB3 H 1.961 0.562 -0.111 1.00 . A A . 22 CYS HB3 1 1 33 20813 1 1 22 CYS N N 3.920 -0.568 -1.277 1.00 . A A . 22 CYS N 1 1 33 20814 1 1 22 CYS O O 1.645 -1.563 -3.776 1.00 . A A . 22 CYS O 1 1 33 20815 1 1 22 CYS SG S 1.735 1.941 -2.040 1.00 . A A . 22 CYS SG 1 1 33 20816 1 1 23 TRP C C 4.412 -0.544 -5.957 1.00 . A A . 23 TRP C 1 1 33 20817 1 1 23 TRP CA C 3.178 0.113 -5.350 1.00 . A A . 23 TRP CA 1 1 33 20818 1 1 23 TRP CB C 3.069 1.566 -5.822 1.00 . A A . 23 TRP CB 1 1 33 20819 1 1 23 TRP CD1 C 1.556 0.759 -7.718 1.00 . A A . 23 TRP CD1 1 1 33 20820 1 1 23 TRP CD2 C 1.589 2.980 -7.462 1.00 . A A . 23 TRP CD2 1 1 33 20821 1 1 23 TRP CE2 C 0.725 2.664 -8.527 1.00 . A A . 23 TRP CE2 1 1 33 20822 1 1 23 TRP CE3 C 1.769 4.321 -7.116 1.00 . A A . 23 TRP CE3 1 1 33 20823 1 1 23 TRP CG C 2.108 1.745 -6.957 1.00 . A A . 23 TRP CG 1 1 33 20824 1 1 23 TRP CH2 C 0.239 4.945 -8.887 1.00 . A A . 23 TRP CH2 1 1 33 20825 1 1 23 TRP CZ2 C 0.044 3.640 -9.248 1.00 . A A . 23 TRP CZ2 1 1 33 20826 1 1 23 TRP CZ3 C 1.093 5.290 -7.832 1.00 . A A . 23 TRP CZ3 1 1 33 20827 1 1 23 TRP H H 3.804 0.651 -3.399 1.00 . A A . 23 TRP H 1 1 33 20828 1 1 23 TRP HA H 2.307 -0.425 -5.682 1.00 . A A . 23 TRP HA 1 1 33 20829 1 1 23 TRP HB2 H 2.733 2.181 -5.001 1.00 . A A . 23 TRP HB2 1 1 33 20830 1 1 23 TRP HB3 H 4.039 1.908 -6.149 1.00 . A A . 23 TRP HB3 1 1 33 20831 1 1 23 TRP HD1 H 1.756 -0.292 -7.581 1.00 . A A . 23 TRP HD1 1 1 33 20832 1 1 23 TRP HE1 H 0.207 0.795 -9.327 1.00 . A A . 23 TRP HE1 1 1 33 20833 1 1 23 TRP HE3 H 2.423 4.605 -6.306 1.00 . A A . 23 TRP HE3 1 1 33 20834 1 1 23 TRP HH2 H -0.268 5.735 -9.421 1.00 . A A . 23 TRP HH2 1 1 33 20835 1 1 23 TRP HZ2 H -0.619 3.390 -10.062 1.00 . A A . 23 TRP HZ2 1 1 33 20836 1 1 23 TRP HZ3 H 1.220 6.332 -7.580 1.00 . A A . 23 TRP HZ3 1 1 33 20837 1 1 23 TRP N N 3.204 0.053 -3.894 1.00 . A A . 23 TRP N 1 1 33 20838 1 1 23 TRP NE1 N 0.721 1.301 -8.664 1.00 . A A . 23 TRP NE1 1 1 33 20839 1 1 23 TRP O O 4.332 -1.631 -6.529 1.00 . A A . 23 TRP O 1 1 33 20840 1 1 24 LYS C C 6.819 -0.297 -7.897 1.00 . A A . 24 LYS C 1 1 33 20841 1 1 24 LYS CA C 6.807 -0.380 -6.373 1.00 . A A . 24 LYS CA 1 1 33 20842 1 1 24 LYS CB C 7.040 -1.826 -5.927 1.00 . A A . 24 LYS CB 1 1 33 20843 1 1 24 LYS CD C 8.904 -3.511 -5.923 1.00 . A A . 24 LYS CD 1 1 33 20844 1 1 24 LYS CE C 10.315 -3.821 -5.450 1.00 . A A . 24 LYS CE 1 1 33 20845 1 1 24 LYS CG C 8.474 -2.112 -5.514 1.00 . A A . 24 LYS CG 1 1 33 20846 1 1 24 LYS H H 5.542 0.987 -5.371 1.00 . A A . 24 LYS H 1 1 33 20847 1 1 24 LYS HA H 7.603 0.238 -5.988 1.00 . A A . 24 LYS HA 1 1 33 20848 1 1 24 LYS HB2 H 6.396 -2.038 -5.086 1.00 . A A . 24 LYS HB2 1 1 33 20849 1 1 24 LYS HB3 H 6.783 -2.488 -6.741 1.00 . A A . 24 LYS HB3 1 1 33 20850 1 1 24 LYS HD2 H 8.224 -4.228 -5.487 1.00 . A A . 24 LYS HD2 1 1 33 20851 1 1 24 LYS HD3 H 8.869 -3.588 -7.000 1.00 . A A . 24 LYS HD3 1 1 33 20852 1 1 24 LYS HE2 H 11.016 -3.298 -6.083 1.00 . A A . 24 LYS HE2 1 1 33 20853 1 1 24 LYS HE3 H 10.424 -3.477 -4.433 1.00 . A A . 24 LYS HE3 1 1 33 20854 1 1 24 LYS HG2 H 9.126 -1.393 -5.990 1.00 . A A . 24 LYS HG2 1 1 33 20855 1 1 24 LYS HG3 H 8.555 -2.019 -4.441 1.00 . A A . 24 LYS HG3 1 1 33 20856 1 1 24 LYS HZ1 H 10.067 -5.727 -6.269 1.00 . A A . 24 LYS HZ1 1 1 33 20857 1 1 24 LYS HZ2 H 11.624 -5.433 -5.678 1.00 . A A . 24 LYS HZ2 1 1 33 20858 1 1 24 LYS HZ3 H 10.354 -5.729 -4.601 1.00 . A A . 24 LYS HZ3 1 1 33 20859 1 1 24 LYS N N 5.549 0.127 -5.834 1.00 . A A . 24 LYS N 1 1 33 20860 1 1 24 LYS NZ N 10.611 -5.280 -5.503 1.00 . A A . 24 LYS NZ 1 1 33 20861 1 1 24 LYS O O 7.538 -1.042 -8.562 1.00 . A A . 24 LYS O 1 1 33 20862 1 1 25 THR C C 7.305 1.222 -10.444 1.00 . A A . 25 THR C 1 1 33 20863 1 1 25 THR CA C 5.949 0.795 -9.890 1.00 . A A . 25 THR CA 1 1 33 20864 1 1 25 THR CB C 4.878 1.829 -10.246 1.00 . A A . 25 THR CB 1 1 33 20865 1 1 25 THR CG2 C 4.774 2.104 -11.731 1.00 . A A . 25 THR CG2 1 1 33 20866 1 1 25 THR H H 5.473 1.185 -7.865 1.00 . A A . 25 THR H 1 1 33 20867 1 1 25 THR HA H 5.679 -0.155 -10.327 1.00 . A A . 25 THR HA 1 1 33 20868 1 1 25 THR HB H 5.112 2.761 -9.754 1.00 . A A . 25 THR HB 1 1 33 20869 1 1 25 THR HG1 H 2.989 2.140 -9.831 1.00 . A A . 25 THR HG1 1 1 33 20870 1 1 25 THR HG21 H 5.251 1.304 -12.279 1.00 . A A . 25 THR HG21 1 1 33 20871 1 1 25 THR HG22 H 3.734 2.164 -12.014 1.00 . A A . 25 THR HG22 1 1 33 20872 1 1 25 THR HG23 H 5.264 3.039 -11.959 1.00 . A A . 25 THR HG23 1 1 33 20873 1 1 25 THR N N 6.022 0.617 -8.445 1.00 . A A . 25 THR N 1 1 33 20874 1 1 25 THR O O 8.076 1.904 -9.769 1.00 . A A . 25 THR O 1 1 33 20875 1 1 25 THR OG1 O 3.603 1.402 -9.801 1.00 . A A . 25 THR OG1 1 1 33 20876 1 1 26 SER C C 9.195 2.624 -12.174 1.00 . A A . 26 SER C 1 1 33 20877 1 1 26 SER CA C 8.860 1.142 -12.322 1.00 . A A . 26 SER CA 1 1 33 20878 1 1 26 SER CB C 8.809 0.768 -13.805 1.00 . A A . 26 SER CB 1 1 33 20879 1 1 26 SER H H 6.939 0.264 -12.160 1.00 . A A . 26 SER H 1 1 33 20880 1 1 26 SER HA H 9.635 0.562 -11.844 1.00 . A A . 26 SER HA 1 1 33 20881 1 1 26 SER HB2 H 8.655 -0.297 -13.900 1.00 . A A . 26 SER HB2 1 1 33 20882 1 1 26 SER HB3 H 7.993 1.294 -14.279 1.00 . A A . 26 SER HB3 1 1 33 20883 1 1 26 SER HG H 10.486 0.314 -14.710 1.00 . A A . 26 SER HG 1 1 33 20884 1 1 26 SER N N 7.593 0.810 -11.675 1.00 . A A . 26 SER N 1 1 33 20885 1 1 26 SER O O 10.365 3.006 -12.165 1.00 . A A . 26 SER O 1 1 33 20886 1 1 26 SER OG O 10.017 1.113 -14.460 1.00 . A A . 26 SER OG 1 1 33 20887 1 1 27 VAL C C 7.782 5.419 -10.611 1.00 . A A . 27 VAL C 1 1 33 20888 1 1 27 VAL CA C 8.359 4.895 -11.924 1.00 . A A . 27 VAL CA 1 1 33 20889 1 1 27 VAL CB C 7.710 5.664 -13.092 1.00 . A A . 27 VAL CB 1 1 33 20890 1 1 27 VAL CG1 C 6.204 5.443 -13.108 1.00 . A A . 27 VAL CG1 1 1 33 20891 1 1 27 VAL CG2 C 8.036 7.148 -13.002 1.00 . A A . 27 VAL CG2 1 1 33 20892 1 1 27 VAL H H 7.254 3.095 -12.083 1.00 . A A . 27 VAL H 1 1 33 20893 1 1 27 VAL HA H 9.421 5.090 -11.941 1.00 . A A . 27 VAL HA 1 1 33 20894 1 1 27 VAL HB H 8.117 5.283 -14.017 1.00 . A A . 27 VAL HB 1 1 33 20895 1 1 27 VAL HG11 H 5.783 5.764 -12.167 1.00 . A A . 27 VAL HG11 1 1 33 20896 1 1 27 VAL HG12 H 5.765 6.015 -13.913 1.00 . A A . 27 VAL HG12 1 1 33 20897 1 1 27 VAL HG13 H 5.995 4.394 -13.257 1.00 . A A . 27 VAL HG13 1 1 33 20898 1 1 27 VAL HG21 H 9.108 7.280 -12.986 1.00 . A A . 27 VAL HG21 1 1 33 20899 1 1 27 VAL HG22 H 7.623 7.659 -13.859 1.00 . A A . 27 VAL HG22 1 1 33 20900 1 1 27 VAL HG23 H 7.608 7.556 -12.098 1.00 . A A . 27 VAL HG23 1 1 33 20901 1 1 27 VAL N N 8.164 3.456 -12.064 1.00 . A A . 27 VAL N 1 1 33 20902 1 1 27 VAL O O 8.244 6.430 -10.082 1.00 . A A . 27 VAL O 1 1 33 20903 1 1 28 SER C C 6.248 4.099 -7.764 1.00 . A A . 28 SER C 1 1 33 20904 1 1 28 SER CA C 6.123 5.159 -8.854 1.00 . A A . 28 SER CA 1 1 33 20905 1 1 28 SER CB C 4.646 5.472 -9.105 1.00 . A A . 28 SER CB 1 1 33 20906 1 1 28 SER H H 6.427 3.947 -10.564 1.00 . A A . 28 SER H 1 1 33 20907 1 1 28 SER HA H 6.615 6.059 -8.519 1.00 . A A . 28 SER HA 1 1 33 20908 1 1 28 SER HB2 H 4.071 5.211 -8.229 1.00 . A A . 28 SER HB2 1 1 33 20909 1 1 28 SER HB3 H 4.534 6.527 -9.308 1.00 . A A . 28 SER HB3 1 1 33 20910 1 1 28 SER HG H 4.030 5.328 -10.959 1.00 . A A . 28 SER HG 1 1 33 20911 1 1 28 SER N N 6.763 4.739 -10.095 1.00 . A A . 28 SER N 1 1 33 20912 1 1 28 SER O O 5.402 3.214 -7.644 1.00 . A A . 28 SER O 1 1 33 20913 1 1 28 SER OG O 4.149 4.738 -10.210 1.00 . A A . 28 SER OG 1 1 33 20914 1 1 29 SER C C 7.065 3.909 -4.545 1.00 . A A . 29 SER C 1 1 33 20915 1 1 29 SER CA C 7.516 3.277 -5.857 1.00 . A A . 29 SER CA 1 1 33 20916 1 1 29 SER CB C 8.991 2.881 -5.775 1.00 . A A . 29 SER CB 1 1 33 20917 1 1 29 SER H H 7.927 4.949 -7.089 1.00 . A A . 29 SER H 1 1 33 20918 1 1 29 SER HA H 6.918 2.396 -6.045 1.00 . A A . 29 SER HA 1 1 33 20919 1 1 29 SER HB2 H 9.493 3.516 -5.060 1.00 . A A . 29 SER HB2 1 1 33 20920 1 1 29 SER HB3 H 9.068 1.851 -5.458 1.00 . A A . 29 SER HB3 1 1 33 20921 1 1 29 SER HG H 9.948 2.163 -7.326 1.00 . A A . 29 SER HG 1 1 33 20922 1 1 29 SER N N 7.296 4.211 -6.955 1.00 . A A . 29 SER N 1 1 33 20923 1 1 29 SER O O 7.521 4.992 -4.182 1.00 . A A . 29 SER O 1 1 33 20924 1 1 29 SER OG O 9.628 3.020 -7.033 1.00 . A A . 29 SER OG 1 1 33 20925 1 1 30 HIS C C 5.526 2.656 -1.545 1.00 . A A . 30 HIS C 1 1 33 20926 1 1 30 HIS CA C 5.628 3.760 -2.591 1.00 . A A . 30 HIS CA 1 1 33 20927 1 1 30 HIS CB C 4.256 4.396 -2.827 1.00 . A A . 30 HIS CB 1 1 33 20928 1 1 30 HIS CD2 C 4.549 5.166 -5.284 1.00 . A A . 30 HIS CD2 1 1 33 20929 1 1 30 HIS CE1 C 3.949 7.259 -5.050 1.00 . A A . 30 HIS CE1 1 1 33 20930 1 1 30 HIS CG C 4.236 5.352 -3.981 1.00 . A A . 30 HIS CG 1 1 33 20931 1 1 30 HIS H H 5.814 2.389 -4.193 1.00 . A A . 30 HIS H 1 1 33 20932 1 1 30 HIS HA H 6.310 4.517 -2.234 1.00 . A A . 30 HIS HA 1 1 33 20933 1 1 30 HIS HB2 H 3.537 3.615 -3.033 1.00 . A A . 30 HIS HB2 1 1 33 20934 1 1 30 HIS HB3 H 3.956 4.934 -1.941 1.00 . A A . 30 HIS HB3 1 1 33 20935 1 1 30 HIS HD1 H 3.580 7.120 -3.040 1.00 . A A . 30 HIS HD1 1 1 33 20936 1 1 30 HIS HD2 H 4.886 4.244 -5.734 1.00 . A A . 30 HIS HD2 1 1 33 20937 1 1 30 HIS HE1 H 3.722 8.292 -5.266 1.00 . A A . 30 HIS HE1 1 1 33 20938 1 1 30 HIS HE2 H 4.609 6.556 -6.855 1.00 . A A . 30 HIS HE2 1 1 33 20939 1 1 30 HIS N N 6.153 3.241 -3.849 1.00 . A A . 30 HIS N 1 1 33 20940 1 1 30 HIS ND1 N 3.864 6.675 -3.866 1.00 . A A . 30 HIS ND1 1 1 33 20941 1 1 30 HIS NE2 N 4.363 6.364 -5.926 1.00 . A A . 30 HIS NE2 1 1 33 20942 1 1 30 HIS O O 5.263 1.501 -1.876 1.00 . A A . 30 HIS O 1 1 33 20943 1 1 31 TYR C C 4.335 2.116 1.529 1.00 . A A . 31 TYR C 1 1 33 20944 1 1 31 TYR CA C 5.680 2.057 0.812 1.00 . A A . 31 TYR CA 1 1 33 20945 1 1 31 TYR CB C 6.815 2.317 1.806 1.00 . A A . 31 TYR CB 1 1 33 20946 1 1 31 TYR CD1 C 8.374 0.919 0.389 1.00 . A A . 31 TYR CD1 1 1 33 20947 1 1 31 TYR CD2 C 8.728 0.963 2.747 1.00 . A A . 31 TYR CD2 1 1 33 20948 1 1 31 TYR CE1 C 9.450 0.065 0.239 1.00 . A A . 31 TYR CE1 1 1 33 20949 1 1 31 TYR CE2 C 9.806 0.110 2.604 1.00 . A A . 31 TYR CE2 1 1 33 20950 1 1 31 TYR CG C 7.994 1.382 1.644 1.00 . A A . 31 TYR CG 1 1 33 20951 1 1 31 TYR CZ C 10.163 -0.336 1.349 1.00 . A A . 31 TYR CZ 1 1 33 20952 1 1 31 TYR H H 5.951 3.955 -0.085 1.00 . A A . 31 TYR H 1 1 33 20953 1 1 31 TYR HA H 5.803 1.072 0.394 1.00 . A A . 31 TYR HA 1 1 33 20954 1 1 31 TYR HB2 H 7.174 3.327 1.675 1.00 . A A . 31 TYR HB2 1 1 33 20955 1 1 31 TYR HB3 H 6.437 2.203 2.812 1.00 . A A . 31 TYR HB3 1 1 33 20956 1 1 31 TYR HD1 H 7.814 1.235 -0.478 1.00 . A A . 31 TYR HD1 1 1 33 20957 1 1 31 TYR HD2 H 8.446 1.313 3.729 1.00 . A A . 31 TYR HD2 1 1 33 20958 1 1 31 TYR HE1 H 9.729 -0.283 -0.744 1.00 . A A . 31 TYR HE1 1 1 33 20959 1 1 31 TYR HE2 H 10.364 -0.204 3.474 1.00 . A A . 31 TYR HE2 1 1 33 20960 1 1 31 TYR HH H 12.046 -0.717 1.414 1.00 . A A . 31 TYR HH 1 1 33 20961 1 1 31 TYR N N 5.741 3.019 -0.284 1.00 . A A . 31 TYR N 1 1 33 20962 1 1 31 TYR O O 3.809 3.196 1.797 1.00 . A A . 31 TYR O 1 1 33 20963 1 1 31 TYR OH O 11.235 -1.185 1.204 1.00 . A A . 31 TYR OH 1 1 33 20964 1 1 32 CYS C C 2.588 1.525 3.901 1.00 . A A . 32 CYS C 1 1 33 20965 1 1 32 CYS CA C 2.506 0.860 2.533 1.00 . A A . 32 CYS CA 1 1 33 20966 1 1 32 CYS CB C 2.083 -0.602 2.696 1.00 . A A . 32 CYS CB 1 1 33 20967 1 1 32 CYS H H 4.256 0.116 1.605 1.00 . A A . 32 CYS H 1 1 33 20968 1 1 32 CYS HA H 1.769 1.377 1.937 1.00 . A A . 32 CYS HA 1 1 33 20969 1 1 32 CYS HB2 H 2.945 -1.236 2.561 1.00 . A A . 32 CYS HB2 1 1 33 20970 1 1 32 CYS HB3 H 1.690 -0.747 3.692 1.00 . A A . 32 CYS HB3 1 1 33 20971 1 1 32 CYS N N 3.786 0.945 1.842 1.00 . A A . 32 CYS N 1 1 33 20972 1 1 32 CYS O O 3.605 1.434 4.588 1.00 . A A . 32 CYS O 1 1 33 20973 1 1 32 CYS SG S 0.808 -1.144 1.514 1.00 . A A . 32 CYS SG 1 1 33 20974 1 1 33 THR C C 0.826 1.935 6.637 1.00 . A A . 33 THR C 1 1 33 20975 1 1 33 THR CA C 1.451 2.851 5.588 1.00 . A A . 33 THR CA 1 1 33 20976 1 1 33 THR CB C 0.651 4.149 5.482 1.00 . A A . 33 THR CB 1 1 33 20977 1 1 33 THR CG2 C 1.040 4.996 4.290 1.00 . A A . 33 THR CG2 1 1 33 20978 1 1 33 THR H H 0.723 2.213 3.708 1.00 . A A . 33 THR H 1 1 33 20979 1 1 33 THR HA H 2.463 3.083 5.885 1.00 . A A . 33 THR HA 1 1 33 20980 1 1 33 THR HB H 0.817 4.737 6.374 1.00 . A A . 33 THR HB 1 1 33 20981 1 1 33 THR HG1 H -0.884 3.220 4.697 1.00 . A A . 33 THR HG1 1 1 33 20982 1 1 33 THR HG21 H 1.775 4.469 3.699 1.00 . A A . 33 THR HG21 1 1 33 20983 1 1 33 THR HG22 H 0.166 5.193 3.687 1.00 . A A . 33 THR HG22 1 1 33 20984 1 1 33 THR HG23 H 1.458 5.931 4.634 1.00 . A A . 33 THR HG23 1 1 33 20985 1 1 33 THR N N 1.506 2.184 4.295 1.00 . A A . 33 THR N 1 1 33 20986 1 1 33 THR O O 0.513 2.371 7.745 1.00 . A A . 33 THR O 1 1 33 20987 1 1 33 THR OG1 O -0.736 3.877 5.381 1.00 . A A . 33 THR OG1 1 1 33 20988 1 1 34 GLY C C -1.161 0.240 7.918 1.00 . A A . 34 GLY C 1 1 33 20989 1 1 34 GLY CA C 0.061 -0.300 7.198 1.00 . A A . 34 GLY CA 1 1 33 20990 1 1 34 GLY H H 0.921 0.372 5.381 1.00 . A A . 34 GLY H 1 1 33 20991 1 1 34 GLY HA2 H 0.804 -0.577 7.932 1.00 . A A . 34 GLY HA2 1 1 33 20992 1 1 34 GLY HA3 H -0.224 -1.181 6.643 1.00 . A A . 34 GLY HA3 1 1 33 20993 1 1 34 GLY N N 0.648 0.662 6.279 1.00 . A A . 34 GLY N 1 1 33 20994 1 1 34 GLY O O -1.206 0.254 9.148 1.00 . A A . 34 GLY O 1 1 33 20995 1 1 35 ARG C C -4.462 1.428 6.689 1.00 . A A . 35 ARG C 1 1 33 20996 1 1 35 ARG CA C -3.374 1.231 7.740 1.00 . A A . 35 ARG CA 1 1 33 20997 1 1 35 ARG CB C -3.079 2.560 8.438 1.00 . A A . 35 ARG CB 1 1 33 20998 1 1 35 ARG CD C -4.292 4.627 9.190 1.00 . A A . 35 ARG CD 1 1 33 20999 1 1 35 ARG CG C -4.257 3.108 9.226 1.00 . A A . 35 ARG CG 1 1 33 21000 1 1 35 ARG CZ C -6.529 5.058 10.130 1.00 . A A . 35 ARG CZ 1 1 33 21001 1 1 35 ARG H H -2.062 0.653 6.179 1.00 . A A . 35 ARG H 1 1 33 21002 1 1 35 ARG HA H -3.727 0.525 8.473 1.00 . A A . 35 ARG HA 1 1 33 21003 1 1 35 ARG HB2 H -2.252 2.420 9.119 1.00 . A A . 35 ARG HB2 1 1 33 21004 1 1 35 ARG HB3 H -2.800 3.291 7.693 1.00 . A A . 35 ARG HB3 1 1 33 21005 1 1 35 ARG HD2 H -3.816 5.006 10.083 1.00 . A A . 35 ARG HD2 1 1 33 21006 1 1 35 ARG HD3 H -3.749 4.967 8.321 1.00 . A A . 35 ARG HD3 1 1 33 21007 1 1 35 ARG HE H -5.941 5.572 8.293 1.00 . A A . 35 ARG HE 1 1 33 21008 1 1 35 ARG HG2 H -5.172 2.727 8.798 1.00 . A A . 35 ARG HG2 1 1 33 21009 1 1 35 ARG HG3 H -4.174 2.782 10.252 1.00 . A A . 35 ARG HG3 1 1 33 21010 1 1 35 ARG HH11 H -5.261 4.108 11.387 1.00 . A A . 35 ARG HH11 1 1 33 21011 1 1 35 ARG HH12 H -6.840 4.423 12.024 1.00 . A A . 35 ARG HH12 1 1 33 21012 1 1 35 ARG HH21 H -8.019 5.988 9.130 1.00 . A A . 35 ARG HH21 1 1 33 21013 1 1 35 ARG HH22 H -8.406 5.490 10.743 1.00 . A A . 35 ARG HH22 1 1 33 21014 1 1 35 ARG N N -2.153 0.688 7.154 1.00 . A A . 35 ARG N 1 1 33 21015 1 1 35 ARG NE N -5.658 5.142 9.127 1.00 . A A . 35 ARG NE 1 1 33 21016 1 1 35 ARG NH1 N -6.181 4.482 11.274 1.00 . A A . 35 ARG NH1 1 1 33 21017 1 1 35 ARG NH2 N -7.752 5.553 9.989 1.00 . A A . 35 ARG NH2 1 1 33 21018 1 1 35 ARG O O -5.637 1.164 6.945 1.00 . A A . 35 ARG O 1 1 33 21019 1 1 36 SER C C -4.515 1.576 3.108 1.00 . A A . 36 SER C 1 1 33 21020 1 1 36 SER CA C -5.024 2.136 4.432 1.00 . A A . 36 SER CA 1 1 33 21021 1 1 36 SER CB C -5.302 3.633 4.291 1.00 . A A . 36 SER CB 1 1 33 21022 1 1 36 SER H H -3.121 2.096 5.366 1.00 . A A . 36 SER H 1 1 33 21023 1 1 36 SER HA H -5.945 1.633 4.690 1.00 . A A . 36 SER HA 1 1 33 21024 1 1 36 SER HB2 H -4.430 4.190 4.601 1.00 . A A . 36 SER HB2 1 1 33 21025 1 1 36 SER HB3 H -5.525 3.860 3.258 1.00 . A A . 36 SER HB3 1 1 33 21026 1 1 36 SER HG H -6.276 3.705 5.988 1.00 . A A . 36 SER HG 1 1 33 21027 1 1 36 SER N N -4.070 1.899 5.511 1.00 . A A . 36 SER N 1 1 33 21028 1 1 36 SER O O -3.325 1.303 2.953 1.00 . A A . 36 SER O 1 1 33 21029 1 1 36 SER OG O -6.402 4.027 5.093 1.00 . A A . 36 SER OG 1 1 33 21030 1 1 37 CYS C C -4.533 1.989 -0.065 1.00 . A A . 37 CYS C 1 1 33 21031 1 1 37 CYS CA C -5.077 0.886 0.840 1.00 . A A . 37 CYS CA 1 1 33 21032 1 1 37 CYS CB C -6.293 0.229 0.186 1.00 . A A . 37 CYS CB 1 1 33 21033 1 1 37 CYS H H -6.360 1.648 2.341 1.00 . A A . 37 CYS H 1 1 33 21034 1 1 37 CYS HA H -4.310 0.139 0.978 1.00 . A A . 37 CYS HA 1 1 33 21035 1 1 37 CYS HB2 H -7.165 0.839 0.369 1.00 . A A . 37 CYS HB2 1 1 33 21036 1 1 37 CYS HB3 H -6.125 0.160 -0.879 1.00 . A A . 37 CYS HB3 1 1 33 21037 1 1 37 CYS N N -5.428 1.410 2.155 1.00 . A A . 37 CYS N 1 1 33 21038 1 1 37 CYS O O -3.863 1.711 -1.060 1.00 . A A . 37 CYS O 1 1 33 21039 1 1 37 CYS SG S -6.653 -1.448 0.801 1.00 . A A . 37 CYS SG 1 1 33 21040 1 1 38 GLU C C -2.834 4.477 -0.460 1.00 . A A . 38 GLU C 1 1 33 21041 1 1 38 GLU CA C -4.355 4.377 -0.503 1.00 . A A . 38 GLU CA 1 1 33 21042 1 1 38 GLU CB C -4.978 5.674 0.016 1.00 . A A . 38 GLU CB 1 1 33 21043 1 1 38 GLU CD C -6.996 7.172 -0.238 1.00 . A A . 38 GLU CD 1 1 33 21044 1 1 38 GLU CG C -6.484 5.746 -0.180 1.00 . A A . 38 GLU CG 1 1 33 21045 1 1 38 GLU H H -5.358 3.404 1.086 1.00 . A A . 38 GLU H 1 1 33 21046 1 1 38 GLU HA H -4.665 4.223 -1.526 1.00 . A A . 38 GLU HA 1 1 33 21047 1 1 38 GLU HB2 H -4.770 5.762 1.072 1.00 . A A . 38 GLU HB2 1 1 33 21048 1 1 38 GLU HB3 H -4.529 6.508 -0.501 1.00 . A A . 38 GLU HB3 1 1 33 21049 1 1 38 GLU HG2 H -6.738 5.251 -1.105 1.00 . A A . 38 GLU HG2 1 1 33 21050 1 1 38 GLU HG3 H -6.966 5.239 0.643 1.00 . A A . 38 GLU HG3 1 1 33 21051 1 1 38 GLU N N -4.821 3.240 0.283 1.00 . A A . 38 GLU N 1 1 33 21052 1 1 38 GLU O O -2.220 4.294 0.591 1.00 . A A . 38 GLU O 1 1 33 21053 1 1 38 GLU OE1 O -6.903 7.879 0.787 1.00 . A A . 38 GLU OE1 1 1 33 21054 1 1 38 GLU OE2 O -7.489 7.582 -1.310 1.00 . A A . 38 GLU OE2 1 1 33 21055 1 1 39 CYS C C -0.360 6.348 -1.857 1.00 . A A . 39 CYS C 1 1 33 21056 1 1 39 CYS CA C -0.779 4.887 -1.699 1.00 . A A . 39 CYS CA 1 1 33 21057 1 1 39 CYS CB C -0.251 4.068 -2.878 1.00 . A A . 39 CYS CB 1 1 33 21058 1 1 39 CYS H H -2.772 4.899 -2.414 1.00 . A A . 39 CYS H 1 1 33 21059 1 1 39 CYS HA H -0.359 4.497 -0.786 1.00 . A A . 39 CYS HA 1 1 33 21060 1 1 39 CYS HB2 H -0.885 4.232 -3.735 1.00 . A A . 39 CYS HB2 1 1 33 21061 1 1 39 CYS HB3 H 0.753 4.392 -3.111 1.00 . A A . 39 CYS HB3 1 1 33 21062 1 1 39 CYS N N -2.230 4.766 -1.609 1.00 . A A . 39 CYS N 1 1 33 21063 1 1 39 CYS O O -0.881 7.059 -2.717 1.00 . A A . 39 CYS O 1 1 33 21064 1 1 39 CYS SG S -0.194 2.275 -2.570 1.00 . A A . 39 CYS SG 1 1 33 21065 1 1 40 PRO C C 1.564 8.574 -2.491 1.00 . A A . 40 PRO C 1 1 33 21066 1 1 40 PRO CA C 1.075 8.202 -1.096 1.00 . A A . 40 PRO CA 1 1 33 21067 1 1 40 PRO CB C 2.238 8.227 -0.099 1.00 . A A . 40 PRO CB 1 1 33 21068 1 1 40 PRO CD C 1.275 6.045 0.023 1.00 . A A . 40 PRO CD 1 1 33 21069 1 1 40 PRO CG C 1.962 7.103 0.838 1.00 . A A . 40 PRO CG 1 1 33 21070 1 1 40 PRO HA H 0.314 8.903 -0.785 1.00 . A A . 40 PRO HA 1 1 33 21071 1 1 40 PRO HB2 H 3.170 8.083 -0.626 1.00 . A A . 40 PRO HB2 1 1 33 21072 1 1 40 PRO HB3 H 2.253 9.176 0.417 1.00 . A A . 40 PRO HB3 1 1 33 21073 1 1 40 PRO HD2 H 2.000 5.367 -0.404 1.00 . A A . 40 PRO HD2 1 1 33 21074 1 1 40 PRO HD3 H 0.562 5.506 0.629 1.00 . A A . 40 PRO HD3 1 1 33 21075 1 1 40 PRO HG2 H 2.890 6.724 1.240 1.00 . A A . 40 PRO HG2 1 1 33 21076 1 1 40 PRO HG3 H 1.317 7.440 1.636 1.00 . A A . 40 PRO HG3 1 1 33 21077 1 1 40 PRO N N 0.593 6.819 -1.031 1.00 . A A . 40 PRO N 1 1 33 21078 1 1 40 PRO O O 1.555 7.747 -3.403 1.00 . A A . 40 PRO O 1 1 33 21079 1 1 41 SER C C 3.994 10.518 -3.891 1.00 . A A . 41 SER C 1 1 33 21080 1 1 41 SER CA C 2.485 10.301 -3.935 1.00 . A A . 41 SER CA 1 1 33 21081 1 1 41 SER CB C 1.781 11.603 -4.322 1.00 . A A . 41 SER CB 1 1 33 21082 1 1 41 SER H H 1.973 10.433 -1.884 1.00 . A A . 41 SER H 1 1 33 21083 1 1 41 SER HA H 2.263 9.548 -4.677 1.00 . A A . 41 SER HA 1 1 33 21084 1 1 41 SER HB2 H 0.731 11.409 -4.481 1.00 . A A . 41 SER HB2 1 1 33 21085 1 1 41 SER HB3 H 1.898 12.323 -3.526 1.00 . A A . 41 SER HB3 1 1 33 21086 1 1 41 SER HG H 1.922 11.723 -6.273 1.00 . A A . 41 SER HG 1 1 33 21087 1 1 41 SER N N 1.991 9.821 -2.650 1.00 . A A . 41 SER N 1 1 33 21088 1 1 41 SER O O 4.526 11.389 -4.579 1.00 . A A . 41 SER O 1 1 33 21089 1 1 41 SER OG O 2.329 12.145 -5.512 1.00 . A A . 41 SER OG 1 1 33 21090 1 1 42 TYR C C 6.710 8.538 -2.358 1.00 . A A . 42 TYR C 1 1 33 21091 1 1 42 TYR CA C 6.126 9.821 -2.947 1.00 . A A . 42 TYR CA 1 1 33 21092 1 1 42 TYR CB C 6.497 11.019 -2.069 1.00 . A A . 42 TYR CB 1 1 33 21093 1 1 42 TYR CD1 C 4.923 11.375 -0.126 1.00 . A A . 42 TYR CD1 1 1 33 21094 1 1 42 TYR CD2 C 6.942 10.170 0.266 1.00 . A A . 42 TYR CD2 1 1 33 21095 1 1 42 TYR CE1 C 4.570 11.224 1.202 1.00 . A A . 42 TYR CE1 1 1 33 21096 1 1 42 TYR CE2 C 6.596 10.014 1.595 1.00 . A A . 42 TYR CE2 1 1 33 21097 1 1 42 TYR CG C 6.113 10.852 -0.616 1.00 . A A . 42 TYR CG 1 1 33 21098 1 1 42 TYR CZ C 5.409 10.543 2.057 1.00 . A A . 42 TYR CZ 1 1 33 21099 1 1 42 TYR H H 4.197 9.042 -2.558 1.00 . A A . 42 TYR H 1 1 33 21100 1 1 42 TYR HA H 6.538 9.969 -3.934 1.00 . A A . 42 TYR HA 1 1 33 21101 1 1 42 TYR HB2 H 7.564 11.172 -2.113 1.00 . A A . 42 TYR HB2 1 1 33 21102 1 1 42 TYR HB3 H 5.997 11.900 -2.446 1.00 . A A . 42 TYR HB3 1 1 33 21103 1 1 42 TYR HD1 H 4.268 11.908 -0.799 1.00 . A A . 42 TYR HD1 1 1 33 21104 1 1 42 TYR HD2 H 7.870 9.757 -0.099 1.00 . A A . 42 TYR HD2 1 1 33 21105 1 1 42 TYR HE1 H 3.640 11.638 1.563 1.00 . A A . 42 TYR HE1 1 1 33 21106 1 1 42 TYR HE2 H 7.254 9.480 2.264 1.00 . A A . 42 TYR HE2 1 1 33 21107 1 1 42 TYR HH H 4.535 9.594 3.483 1.00 . A A . 42 TYR HH 1 1 33 21108 1 1 42 TYR N N 4.678 9.718 -3.079 1.00 . A A . 42 TYR N 1 1 33 21109 1 1 42 TYR O O 6.071 7.875 -1.541 1.00 . A A . 42 TYR O 1 1 33 21110 1 1 42 TYR OH O 5.061 10.390 3.380 1.00 . A A . 42 TYR OH 1 1 33 21111 1 1 43 PRO C C 9.150 7.131 -0.864 1.00 . A A . 43 PRO C 1 1 33 21112 1 1 43 PRO CA C 8.602 6.960 -2.277 1.00 . A A . 43 PRO CA 1 1 33 21113 1 1 43 PRO CB C 9.742 6.766 -3.274 1.00 . A A . 43 PRO CB 1 1 33 21114 1 1 43 PRO CD C 8.769 8.902 -3.742 1.00 . A A . 43 PRO CD 1 1 33 21115 1 1 43 PRO CG C 10.070 8.143 -3.736 1.00 . A A . 43 PRO CG 1 1 33 21116 1 1 43 PRO HA H 7.943 6.106 -2.306 1.00 . A A . 43 PRO HA 1 1 33 21117 1 1 43 PRO HB2 H 10.583 6.301 -2.780 1.00 . A A . 43 PRO HB2 1 1 33 21118 1 1 43 PRO HB3 H 9.408 6.145 -4.092 1.00 . A A . 43 PRO HB3 1 1 33 21119 1 1 43 PRO HD2 H 8.927 9.922 -3.424 1.00 . A A . 43 PRO HD2 1 1 33 21120 1 1 43 PRO HD3 H 8.323 8.877 -4.725 1.00 . A A . 43 PRO HD3 1 1 33 21121 1 1 43 PRO HG2 H 10.769 8.603 -3.052 1.00 . A A . 43 PRO HG2 1 1 33 21122 1 1 43 PRO HG3 H 10.487 8.107 -4.732 1.00 . A A . 43 PRO HG3 1 1 33 21123 1 1 43 PRO N N 7.936 8.170 -2.768 1.00 . A A . 43 PRO N 1 1 33 21124 1 1 43 PRO O O 9.487 8.239 -0.448 1.00 . A A . 43 PRO O 1 1 33 21125 1 1 44 GLY C C 11.237 6.330 1.279 1.00 . A A . 44 GLY C 1 1 33 21126 1 1 44 GLY CA C 9.744 6.074 1.227 1.00 . A A . 44 GLY CA 1 1 33 21127 1 1 44 GLY H H 8.953 5.170 -0.516 1.00 . A A . 44 GLY H 1 1 33 21128 1 1 44 GLY HA2 H 9.535 5.132 1.711 1.00 . A A . 44 GLY HA2 1 1 33 21129 1 1 44 GLY HA3 H 9.236 6.862 1.762 1.00 . A A . 44 GLY HA3 1 1 33 21130 1 1 44 GLY N N 9.236 6.026 -0.132 1.00 . A A . 44 GLY N 1 1 33 21131 1 1 44 GLY O O 11.890 6.441 0.241 1.00 . A A . 44 GLY O 1 1 33 21132 1 1 45 ASN C C 13.721 7.760 1.752 1.00 . A A . 45 ASN C 1 1 33 21133 1 1 45 ASN CA C 13.205 6.673 2.693 1.00 . A A . 45 ASN CA 1 1 33 21134 1 1 45 ASN CB C 14.002 5.381 2.491 1.00 . A A . 45 ASN CB 1 1 33 21135 1 1 45 ASN CG C 13.928 4.866 1.067 1.00 . A A . 45 ASN CG 1 1 33 21136 1 1 45 ASN H H 11.198 6.330 3.278 1.00 . A A . 45 ASN H 1 1 33 21137 1 1 45 ASN HA H 13.339 7.008 3.711 1.00 . A A . 45 ASN HA 1 1 33 21138 1 1 45 ASN HB2 H 15.039 5.565 2.733 1.00 . A A . 45 ASN HB2 1 1 33 21139 1 1 45 ASN HB3 H 13.613 4.620 3.151 1.00 . A A . 45 ASN HB3 1 1 33 21140 1 1 45 ASN HD21 H 15.709 5.652 0.663 1.00 . A A . 45 ASN HD21 1 1 33 21141 1 1 45 ASN HD22 H 14.943 4.819 -0.642 1.00 . A A . 45 ASN HD22 1 1 33 21142 1 1 45 ASN N N 11.777 6.427 2.493 1.00 . A A . 45 ASN N 1 1 33 21143 1 1 45 ASN ND2 N 14.965 5.140 0.284 1.00 . A A . 45 ASN ND2 1 1 33 21144 1 1 45 ASN O O 14.861 7.705 1.291 1.00 . A A . 45 ASN O 1 1 33 21145 1 1 45 ASN OD1 O 12.951 4.228 0.676 1.00 . A A . 45 ASN OD1 1 1 33 21146 1 1 46 GLY C C 12.175 10.183 -0.407 1.00 . A A . 46 GLY C 1 1 33 21147 1 1 46 GLY CA C 13.262 9.828 0.589 1.00 . A A . 46 GLY CA 1 1 33 21148 1 1 46 GLY H H 11.977 8.735 1.869 1.00 . A A . 46 GLY H 1 1 33 21149 1 1 46 GLY HA2 H 14.150 9.536 0.048 1.00 . A A . 46 GLY HA2 1 1 33 21150 1 1 46 GLY HA3 H 13.487 10.700 1.185 1.00 . A A . 46 GLY HA3 1 1 33 21151 1 1 46 GLY N N 12.874 8.745 1.472 1.00 . A A . 46 GLY N 1 1 33 21152 1 1 46 GLY O O 12.467 10.206 -1.621 1.00 . A A . 46 GLY O 1 1 33 21153 1 1 46 GLY OXT O 11.032 10.436 0.027 1.00 . A A . 46 GLY OXT 1 1 34 21154 1 1 1 ALA C C -18.033 -4.693 8.249 1.00 . A A . 1 ALA C 1 1 34 21155 1 1 1 ALA CA C -19.362 -4.126 8.738 1.00 . A A . 1 ALA CA 1 1 34 21156 1 1 1 ALA CB C -20.098 -3.446 7.594 1.00 . A A . 1 ALA CB 1 1 34 21157 1 1 1 ALA H1 H -18.427 -3.568 10.483 1.00 . A A . 1 ALA H1 1 1 34 21158 1 1 1 ALA H2 H -18.843 -2.267 9.449 1.00 . A A . 1 ALA H2 1 1 34 21159 1 1 1 ALA H3 H -20.063 -3.065 10.355 1.00 . A A . 1 ALA H3 1 1 34 21160 1 1 1 ALA HA H -19.977 -4.939 9.096 1.00 . A A . 1 ALA HA 1 1 34 21161 1 1 1 ALA HB1 H -20.481 -4.195 6.917 1.00 . A A . 1 ALA HB1 1 1 34 21162 1 1 1 ALA HB2 H -20.918 -2.864 7.988 1.00 . A A . 1 ALA HB2 1 1 34 21163 1 1 1 ALA HB3 H -19.418 -2.796 7.064 1.00 . A A . 1 ALA HB3 1 1 34 21164 1 1 1 ALA N N -19.155 -3.171 9.857 1.00 . A A . 1 ALA N 1 1 34 21165 1 1 1 ALA O O -17.965 -5.831 7.786 1.00 . A A . 1 ALA O 1 1 34 21166 1 1 2 MET C C -15.643 -4.646 6.437 1.00 . A A . 2 MET C 1 1 34 21167 1 1 2 MET CA C -15.651 -4.313 7.925 1.00 . A A . 2 MET CA 1 1 34 21168 1 1 2 MET CB C -15.191 -5.527 8.734 1.00 . A A . 2 MET CB 1 1 34 21169 1 1 2 MET CE C -14.368 -6.440 12.629 1.00 . A A . 2 MET CE 1 1 34 21170 1 1 2 MET CG C -15.011 -5.238 10.216 1.00 . A A . 2 MET CG 1 1 34 21171 1 1 2 MET H H -17.096 -2.994 8.735 1.00 . A A . 2 MET H 1 1 34 21172 1 1 2 MET HA H -14.970 -3.494 8.103 1.00 . A A . 2 MET HA 1 1 34 21173 1 1 2 MET HB2 H -15.924 -6.313 8.629 1.00 . A A . 2 MET HB2 1 1 34 21174 1 1 2 MET HB3 H -14.247 -5.871 8.339 1.00 . A A . 2 MET HB3 1 1 34 21175 1 1 2 MET HE1 H -15.408 -6.149 12.646 1.00 . A A . 2 MET HE1 1 1 34 21176 1 1 2 MET HE2 H -14.277 -7.472 12.934 1.00 . A A . 2 MET HE2 1 1 34 21177 1 1 2 MET HE3 H -13.808 -5.813 13.307 1.00 . A A . 2 MET HE3 1 1 34 21178 1 1 2 MET HG2 H -14.749 -4.198 10.337 1.00 . A A . 2 MET HG2 1 1 34 21179 1 1 2 MET HG3 H -15.945 -5.433 10.722 1.00 . A A . 2 MET HG3 1 1 34 21180 1 1 2 MET N N -16.979 -3.891 8.357 1.00 . A A . 2 MET N 1 1 34 21181 1 1 2 MET O O -16.224 -5.644 6.011 1.00 . A A . 2 MET O 1 1 34 21182 1 1 2 MET SD S -13.722 -6.249 10.969 1.00 . A A . 2 MET SD 1 1 34 21183 1 1 3 ASP C C -13.457 -3.870 3.724 1.00 . A A . 3 ASP C 1 1 34 21184 1 1 3 ASP CA C -14.896 -4.009 4.210 1.00 . A A . 3 ASP CA 1 1 34 21185 1 1 3 ASP CB C -15.792 -3.008 3.478 1.00 . A A . 3 ASP CB 1 1 34 21186 1 1 3 ASP CG C -16.345 -3.568 2.182 1.00 . A A . 3 ASP CG 1 1 34 21187 1 1 3 ASP H H -14.537 -3.026 6.050 1.00 . A A . 3 ASP H 1 1 34 21188 1 1 3 ASP HA H -15.240 -5.010 3.997 1.00 . A A . 3 ASP HA 1 1 34 21189 1 1 3 ASP HB2 H -16.622 -2.744 4.116 1.00 . A A . 3 ASP HB2 1 1 34 21190 1 1 3 ASP HB3 H -15.220 -2.121 3.251 1.00 . A A . 3 ASP HB3 1 1 34 21191 1 1 3 ASP N N -14.980 -3.804 5.651 1.00 . A A . 3 ASP N 1 1 34 21192 1 1 3 ASP O O -12.648 -3.176 4.338 1.00 . A A . 3 ASP O 1 1 34 21193 1 1 3 ASP OD1 O -17.575 -3.490 1.978 1.00 . A A . 3 ASP OD1 1 1 34 21194 1 1 3 ASP OD2 O -15.547 -4.083 1.370 1.00 . A A . 3 ASP OD2 1 1 34 21195 1 1 4 CYS C C -11.589 -3.195 1.269 1.00 . A A . 4 CYS C 1 1 34 21196 1 1 4 CYS CA C -11.803 -4.488 2.047 1.00 . A A . 4 CYS CA 1 1 34 21197 1 1 4 CYS CB C -11.565 -5.685 1.125 1.00 . A A . 4 CYS CB 1 1 34 21198 1 1 4 CYS H H -13.834 -5.073 2.172 1.00 . A A . 4 CYS H 1 1 34 21199 1 1 4 CYS HA H -11.094 -4.527 2.861 1.00 . A A . 4 CYS HA 1 1 34 21200 1 1 4 CYS HB2 H -11.996 -5.475 0.158 1.00 . A A . 4 CYS HB2 1 1 34 21201 1 1 4 CYS HB3 H -10.501 -5.834 1.012 1.00 . A A . 4 CYS HB3 1 1 34 21202 1 1 4 CYS N N -13.145 -4.536 2.617 1.00 . A A . 4 CYS N 1 1 34 21203 1 1 4 CYS O O -12.528 -2.638 0.698 1.00 . A A . 4 CYS O 1 1 34 21204 1 1 4 CYS SG S -12.286 -7.250 1.722 1.00 . A A . 4 CYS SG 1 1 34 21205 1 1 5 THR C C -9.108 -1.826 -0.666 1.00 . A A . 5 THR C 1 1 34 21206 1 1 5 THR CA C -10.002 -1.506 0.527 1.00 . A A . 5 THR CA 1 1 34 21207 1 1 5 THR CB C -9.303 -0.522 1.465 1.00 . A A . 5 THR CB 1 1 34 21208 1 1 5 THR CG2 C -8.999 0.812 0.818 1.00 . A A . 5 THR CG2 1 1 34 21209 1 1 5 THR H H -9.642 -3.220 1.713 1.00 . A A . 5 THR H 1 1 34 21210 1 1 5 THR HA H -10.916 -1.061 0.168 1.00 . A A . 5 THR HA 1 1 34 21211 1 1 5 THR HB H -8.369 -0.954 1.789 1.00 . A A . 5 THR HB 1 1 34 21212 1 1 5 THR HG1 H -9.842 -0.872 3.315 1.00 . A A . 5 THR HG1 1 1 34 21213 1 1 5 THR HG21 H -9.905 1.221 0.394 1.00 . A A . 5 THR HG21 1 1 34 21214 1 1 5 THR HG22 H -8.610 1.493 1.561 1.00 . A A . 5 THR HG22 1 1 34 21215 1 1 5 THR HG23 H -8.267 0.676 0.037 1.00 . A A . 5 THR HG23 1 1 34 21216 1 1 5 THR N N -10.347 -2.727 1.243 1.00 . A A . 5 THR N 1 1 34 21217 1 1 5 THR O O -7.958 -1.392 -0.731 1.00 . A A . 5 THR O 1 1 34 21218 1 1 5 THR OG1 O -10.098 -0.272 2.611 1.00 . A A . 5 THR OG1 1 1 34 21219 1 1 6 THR C C -8.104 -1.843 -3.382 1.00 . A A . 6 THR C 1 1 34 21220 1 1 6 THR CA C -8.913 -3.001 -2.804 1.00 . A A . 6 THR CA 1 1 34 21221 1 1 6 THR CB C -9.878 -3.540 -3.860 1.00 . A A . 6 THR CB 1 1 34 21222 1 1 6 THR CG2 C -10.164 -5.019 -3.709 1.00 . A A . 6 THR CG2 1 1 34 21223 1 1 6 THR H H -10.569 -2.915 -1.487 1.00 . A A . 6 THR H 1 1 34 21224 1 1 6 THR HA H -8.232 -3.790 -2.521 1.00 . A A . 6 THR HA 1 1 34 21225 1 1 6 THR HB H -9.448 -3.384 -4.839 1.00 . A A . 6 THR HB 1 1 34 21226 1 1 6 THR HG1 H -11.708 -3.207 -4.474 1.00 . A A . 6 THR HG1 1 1 34 21227 1 1 6 THR HG21 H -9.614 -5.407 -2.864 1.00 . A A . 6 THR HG21 1 1 34 21228 1 1 6 THR HG22 H -11.221 -5.167 -3.550 1.00 . A A . 6 THR HG22 1 1 34 21229 1 1 6 THR HG23 H -9.859 -5.537 -4.606 1.00 . A A . 6 THR HG23 1 1 34 21230 1 1 6 THR N N -9.649 -2.599 -1.606 1.00 . A A . 6 THR N 1 1 34 21231 1 1 6 THR O O -8.659 -0.822 -3.786 1.00 . A A . 6 THR O 1 1 34 21232 1 1 6 THR OG1 O -11.117 -2.855 -3.804 1.00 . A A . 6 THR OG1 1 1 34 21233 1 1 7 GLY C C -4.545 -1.521 -4.316 1.00 . A A . 7 GLY C 1 1 34 21234 1 1 7 GLY CA C -5.914 -0.984 -3.944 1.00 . A A . 7 GLY CA 1 1 34 21235 1 1 7 GLY H H -6.403 -2.852 -3.079 1.00 . A A . 7 GLY H 1 1 34 21236 1 1 7 GLY HA2 H -5.796 -0.212 -3.199 1.00 . A A . 7 GLY HA2 1 1 34 21237 1 1 7 GLY HA3 H -6.372 -0.555 -4.823 1.00 . A A . 7 GLY HA3 1 1 34 21238 1 1 7 GLY N N -6.786 -2.015 -3.416 1.00 . A A . 7 GLY N 1 1 34 21239 1 1 7 GLY O O -4.352 -2.735 -4.390 1.00 . A A . 7 GLY O 1 1 34 21240 1 1 8 PRO C C -1.410 -1.595 -3.750 1.00 . A A . 8 PRO C 1 1 34 21241 1 1 8 PRO CA C -2.207 -1.039 -4.931 1.00 . A A . 8 PRO CA 1 1 34 21242 1 1 8 PRO CB C -1.580 0.263 -5.431 1.00 . A A . 8 PRO CB 1 1 34 21243 1 1 8 PRO CD C -3.710 0.833 -4.499 1.00 . A A . 8 PRO CD 1 1 34 21244 1 1 8 PRO CG C -2.304 1.335 -4.694 1.00 . A A . 8 PRO CG 1 1 34 21245 1 1 8 PRO HA H -2.216 -1.766 -5.729 1.00 . A A . 8 PRO HA 1 1 34 21246 1 1 8 PRO HB2 H -0.524 0.269 -5.204 1.00 . A A . 8 PRO HB2 1 1 34 21247 1 1 8 PRO HB3 H -1.726 0.351 -6.498 1.00 . A A . 8 PRO HB3 1 1 34 21248 1 1 8 PRO HD2 H -4.090 1.143 -3.537 1.00 . A A . 8 PRO HD2 1 1 34 21249 1 1 8 PRO HD3 H -4.351 1.190 -5.292 1.00 . A A . 8 PRO HD3 1 1 34 21250 1 1 8 PRO HG2 H -1.832 1.506 -3.738 1.00 . A A . 8 PRO HG2 1 1 34 21251 1 1 8 PRO HG3 H -2.309 2.243 -5.278 1.00 . A A . 8 PRO HG3 1 1 34 21252 1 1 8 PRO N N -3.566 -0.634 -4.560 1.00 . A A . 8 PRO N 1 1 34 21253 1 1 8 PRO O O -0.316 -2.129 -3.930 1.00 . A A . 8 PRO O 1 1 34 21254 1 1 9 CYS C C -2.101 -3.018 -0.626 1.00 . A A . 9 CYS C 1 1 34 21255 1 1 9 CYS CA C -1.280 -1.948 -1.343 1.00 . A A . 9 CYS CA 1 1 34 21256 1 1 9 CYS CB C -0.993 -0.786 -0.390 1.00 . A A . 9 CYS CB 1 1 34 21257 1 1 9 CYS H H -2.827 -1.021 -2.456 1.00 . A A . 9 CYS H 1 1 34 21258 1 1 9 CYS HA H -0.342 -2.385 -1.650 1.00 . A A . 9 CYS HA 1 1 34 21259 1 1 9 CYS HB2 H -0.393 -0.049 -0.902 1.00 . A A . 9 CYS HB2 1 1 34 21260 1 1 9 CYS HB3 H -1.929 -0.336 -0.092 1.00 . A A . 9 CYS HB3 1 1 34 21261 1 1 9 CYS N N -1.956 -1.461 -2.543 1.00 . A A . 9 CYS N 1 1 34 21262 1 1 9 CYS O O -1.554 -3.828 0.123 1.00 . A A . 9 CYS O 1 1 34 21263 1 1 9 CYS SG S -0.103 -1.268 1.125 1.00 . A A . 9 CYS SG 1 1 34 21264 1 1 10 CYS C C -3.874 -5.418 -0.560 1.00 . A A . 10 CYS C 1 1 34 21265 1 1 10 CYS CA C -4.290 -3.992 -0.214 1.00 . A A . 10 CYS CA 1 1 34 21266 1 1 10 CYS CB C -5.741 -3.757 -0.637 1.00 . A A . 10 CYS CB 1 1 34 21267 1 1 10 CYS H H -3.795 -2.348 -1.452 1.00 . A A . 10 CYS H 1 1 34 21268 1 1 10 CYS HA H -4.212 -3.858 0.855 1.00 . A A . 10 CYS HA 1 1 34 21269 1 1 10 CYS HB2 H -5.803 -2.831 -1.186 1.00 . A A . 10 CYS HB2 1 1 34 21270 1 1 10 CYS HB3 H -6.060 -4.570 -1.274 1.00 . A A . 10 CYS HB3 1 1 34 21271 1 1 10 CYS N N -3.411 -3.018 -0.850 1.00 . A A . 10 CYS N 1 1 34 21272 1 1 10 CYS O O -3.543 -5.719 -1.707 1.00 . A A . 10 CYS O 1 1 34 21273 1 1 10 CYS SG S -6.911 -3.654 0.755 1.00 . A A . 10 CYS SG 1 1 34 21274 1 1 11 ARG C C -4.692 -8.603 0.627 1.00 . A A . 11 ARG C 1 1 34 21275 1 1 11 ARG CA C -3.533 -7.689 0.246 1.00 . A A . 11 ARG CA 1 1 34 21276 1 1 11 ARG CB C -2.298 -8.037 1.080 1.00 . A A . 11 ARG CB 1 1 34 21277 1 1 11 ARG CD C -0.365 -9.635 1.232 1.00 . A A . 11 ARG CD 1 1 34 21278 1 1 11 ARG CG C -1.846 -9.480 0.927 1.00 . A A . 11 ARG CG 1 1 34 21279 1 1 11 ARG CZ C 1.228 -11.435 1.774 1.00 . A A . 11 ARG CZ 1 1 34 21280 1 1 11 ARG H H -4.177 -5.990 1.330 1.00 . A A . 11 ARG H 1 1 34 21281 1 1 11 ARG HA H -3.305 -7.832 -0.799 1.00 . A A . 11 ARG HA 1 1 34 21282 1 1 11 ARG HB2 H -1.483 -7.394 0.780 1.00 . A A . 11 ARG HB2 1 1 34 21283 1 1 11 ARG HB3 H -2.519 -7.860 2.122 1.00 . A A . 11 ARG HB3 1 1 34 21284 1 1 11 ARG HD2 H 0.203 -9.208 0.419 1.00 . A A . 11 ARG HD2 1 1 34 21285 1 1 11 ARG HD3 H -0.141 -9.103 2.145 1.00 . A A . 11 ARG HD3 1 1 34 21286 1 1 11 ARG HE H -0.664 -11.715 1.206 1.00 . A A . 11 ARG HE 1 1 34 21287 1 1 11 ARG HG2 H -2.410 -10.098 1.610 1.00 . A A . 11 ARG HG2 1 1 34 21288 1 1 11 ARG HG3 H -2.031 -9.799 -0.088 1.00 . A A . 11 ARG HG3 1 1 34 21289 1 1 11 ARG HH11 H 1.985 -9.567 1.945 1.00 . A A . 11 ARG HH11 1 1 34 21290 1 1 11 ARG HH12 H 3.085 -10.850 2.321 1.00 . A A . 11 ARG HH12 1 1 34 21291 1 1 11 ARG HH21 H 0.781 -13.405 1.701 1.00 . A A . 11 ARG HH21 1 1 34 21292 1 1 11 ARG HH22 H 2.402 -13.029 2.182 1.00 . A A . 11 ARG HH22 1 1 34 21293 1 1 11 ARG N N -3.900 -6.292 0.440 1.00 . A A . 11 ARG N 1 1 34 21294 1 1 11 ARG NE N 0.017 -11.036 1.393 1.00 . A A . 11 ARG NE 1 1 34 21295 1 1 11 ARG NH1 N 2.177 -10.544 2.035 1.00 . A A . 11 ARG NH1 1 1 34 21296 1 1 11 ARG NH2 N 1.492 -12.729 1.896 1.00 . A A . 11 ARG NH2 1 1 34 21297 1 1 11 ARG O O -4.851 -8.968 1.792 1.00 . A A . 11 ARG O 1 1 34 21298 1 1 12 GLN C C -7.819 -9.056 0.473 1.00 . A A . 12 GLN C 1 1 34 21299 1 1 12 GLN CA C -6.661 -9.833 -0.143 1.00 . A A . 12 GLN CA 1 1 34 21300 1 1 12 GLN CB C -6.289 -11.018 0.755 1.00 . A A . 12 GLN CB 1 1 34 21301 1 1 12 GLN CD C -6.941 -13.319 1.567 1.00 . A A . 12 GLN CD 1 1 34 21302 1 1 12 GLN CG C -7.118 -12.264 0.493 1.00 . A A . 12 GLN CG 1 1 34 21303 1 1 12 GLN H H -5.325 -8.636 -1.269 1.00 . A A . 12 GLN H 1 1 34 21304 1 1 12 GLN HA H -6.974 -10.209 -1.101 1.00 . A A . 12 GLN HA 1 1 34 21305 1 1 12 GLN HB2 H -5.249 -11.263 0.595 1.00 . A A . 12 GLN HB2 1 1 34 21306 1 1 12 GLN HB3 H -6.427 -10.730 1.787 1.00 . A A . 12 GLN HB3 1 1 34 21307 1 1 12 GLN HE21 H -7.204 -14.764 0.226 1.00 . A A . 12 GLN HE21 1 1 34 21308 1 1 12 GLN HE22 H -6.920 -15.288 1.847 1.00 . A A . 12 GLN HE22 1 1 34 21309 1 1 12 GLN HG2 H -8.161 -11.985 0.453 1.00 . A A . 12 GLN HG2 1 1 34 21310 1 1 12 GLN HG3 H -6.822 -12.684 -0.457 1.00 . A A . 12 GLN HG3 1 1 34 21311 1 1 12 GLN N N -5.505 -8.965 -0.364 1.00 . A A . 12 GLN N 1 1 34 21312 1 1 12 GLN NE2 N -7.031 -14.585 1.173 1.00 . A A . 12 GLN NE2 1 1 34 21313 1 1 12 GLN O O -8.914 -9.006 -0.086 1.00 . A A . 12 GLN O 1 1 34 21314 1 1 12 GLN OE1 O -6.725 -13.001 2.736 1.00 . A A . 12 GLN OE1 1 1 34 21315 1 1 13 CYS C C -8.006 -6.987 3.555 1.00 . A A . 13 CYS C 1 1 34 21316 1 1 13 CYS CA C -8.587 -7.676 2.323 1.00 . A A . 13 CYS CA 1 1 34 21317 1 1 13 CYS CB C -9.752 -8.579 2.731 1.00 . A A . 13 CYS CB 1 1 34 21318 1 1 13 CYS H H -6.678 -8.531 2.019 1.00 . A A . 13 CYS H 1 1 34 21319 1 1 13 CYS HA H -8.951 -6.922 1.641 1.00 . A A . 13 CYS HA 1 1 34 21320 1 1 13 CYS HB2 H -10.077 -9.146 1.871 1.00 . A A . 13 CYS HB2 1 1 34 21321 1 1 13 CYS HB3 H -9.416 -9.262 3.499 1.00 . A A . 13 CYS HB3 1 1 34 21322 1 1 13 CYS N N -7.568 -8.452 1.627 1.00 . A A . 13 CYS N 1 1 34 21323 1 1 13 CYS O O -8.697 -6.806 4.558 1.00 . A A . 13 CYS O 1 1 34 21324 1 1 13 CYS SG S -11.200 -7.683 3.380 1.00 . A A . 13 CYS SG 1 1 34 21325 1 1 14 LYS C C -4.825 -5.207 4.111 1.00 . A A . 14 LYS C 1 1 34 21326 1 1 14 LYS CA C -6.076 -5.931 4.588 1.00 . A A . 14 LYS CA 1 1 34 21327 1 1 14 LYS CB C -5.713 -6.941 5.678 1.00 . A A . 14 LYS CB 1 1 34 21328 1 1 14 LYS CD C -6.403 -7.913 7.890 1.00 . A A . 14 LYS CD 1 1 34 21329 1 1 14 LYS CE C -7.571 -8.299 8.783 1.00 . A A . 14 LYS CE 1 1 34 21330 1 1 14 LYS CG C -6.880 -7.312 6.578 1.00 . A A . 14 LYS CG 1 1 34 21331 1 1 14 LYS H H -6.229 -6.766 2.654 1.00 . A A . 14 LYS H 1 1 34 21332 1 1 14 LYS HA H -6.765 -5.206 4.996 1.00 . A A . 14 LYS HA 1 1 34 21333 1 1 14 LYS HB2 H -5.347 -7.843 5.209 1.00 . A A . 14 LYS HB2 1 1 34 21334 1 1 14 LYS HB3 H -4.930 -6.523 6.294 1.00 . A A . 14 LYS HB3 1 1 34 21335 1 1 14 LYS HD2 H -5.817 -8.795 7.679 1.00 . A A . 14 LYS HD2 1 1 34 21336 1 1 14 LYS HD3 H -5.791 -7.187 8.406 1.00 . A A . 14 LYS HD3 1 1 34 21337 1 1 14 LYS HE2 H -8.022 -7.399 9.174 1.00 . A A . 14 LYS HE2 1 1 34 21338 1 1 14 LYS HE3 H -8.297 -8.837 8.192 1.00 . A A . 14 LYS HE3 1 1 34 21339 1 1 14 LYS HG2 H -7.456 -6.423 6.789 1.00 . A A . 14 LYS HG2 1 1 34 21340 1 1 14 LYS HG3 H -7.501 -8.033 6.067 1.00 . A A . 14 LYS HG3 1 1 34 21341 1 1 14 LYS HZ1 H -6.418 -8.666 10.486 1.00 . A A . 14 LYS HZ1 1 1 34 21342 1 1 14 LYS HZ2 H -7.953 -9.374 10.533 1.00 . A A . 14 LYS HZ2 1 1 34 21343 1 1 14 LYS HZ3 H -6.739 -10.048 9.565 1.00 . A A . 14 LYS HZ3 1 1 34 21344 1 1 14 LYS N N -6.736 -6.600 3.477 1.00 . A A . 14 LYS N 1 1 34 21345 1 1 14 LYS NZ N -7.140 -9.157 9.921 1.00 . A A . 14 LYS NZ 1 1 34 21346 1 1 14 LYS O O -3.891 -5.831 3.608 1.00 . A A . 14 LYS O 1 1 34 21347 1 1 15 LEU C C -2.363 -3.707 4.315 1.00 . A A . 15 LEU C 1 1 34 21348 1 1 15 LEU CA C -3.672 -3.074 3.858 1.00 . A A . 15 LEU CA 1 1 34 21349 1 1 15 LEU CB C -3.796 -1.660 4.425 1.00 . A A . 15 LEU CB 1 1 34 21350 1 1 15 LEU CD1 C -3.196 -1.091 6.796 1.00 . A A . 15 LEU CD1 1 1 34 21351 1 1 15 LEU CD2 C -5.519 -0.681 5.965 1.00 . A A . 15 LEU CD2 1 1 34 21352 1 1 15 LEU CG C -4.298 -1.584 5.870 1.00 . A A . 15 LEU CG 1 1 34 21353 1 1 15 LEU H H -5.587 -3.448 4.681 1.00 . A A . 15 LEU H 1 1 34 21354 1 1 15 LEU HA H -3.675 -3.023 2.780 1.00 . A A . 15 LEU HA 1 1 34 21355 1 1 15 LEU HB2 H -2.824 -1.189 4.375 1.00 . A A . 15 LEU HB2 1 1 34 21356 1 1 15 LEU HB3 H -4.478 -1.104 3.800 1.00 . A A . 15 LEU HB3 1 1 34 21357 1 1 15 LEU HD11 H -2.236 -1.250 6.330 1.00 . A A . 15 LEU HD11 1 1 34 21358 1 1 15 LEU HD12 H -3.333 -0.037 6.989 1.00 . A A . 15 LEU HD12 1 1 34 21359 1 1 15 LEU HD13 H -3.239 -1.635 7.728 1.00 . A A . 15 LEU HD13 1 1 34 21360 1 1 15 LEU HD21 H -6.092 -0.752 5.052 1.00 . A A . 15 LEU HD21 1 1 34 21361 1 1 15 LEU HD22 H -6.132 -0.990 6.799 1.00 . A A . 15 LEU HD22 1 1 34 21362 1 1 15 LEU HD23 H -5.201 0.341 6.111 1.00 . A A . 15 LEU HD23 1 1 34 21363 1 1 15 LEU HG H -4.587 -2.572 6.196 1.00 . A A . 15 LEU HG 1 1 34 21364 1 1 15 LEU N N -4.812 -3.886 4.273 1.00 . A A . 15 LEU N 1 1 34 21365 1 1 15 LEU O O -2.144 -3.908 5.510 1.00 . A A . 15 LEU O 1 1 34 21366 1 1 16 LYS C C 0.486 -3.934 4.815 1.00 . A A . 16 LYS C 1 1 34 21367 1 1 16 LYS CA C -0.216 -4.651 3.659 1.00 . A A . 16 LYS CA 1 1 34 21368 1 1 16 LYS CB C 0.683 -4.649 2.421 1.00 . A A . 16 LYS CB 1 1 34 21369 1 1 16 LYS CD C 1.407 -5.831 0.325 1.00 . A A . 16 LYS CD 1 1 34 21370 1 1 16 LYS CE C 0.799 -6.395 -0.949 1.00 . A A . 16 LYS CE 1 1 34 21371 1 1 16 LYS CG C 0.389 -5.783 1.454 1.00 . A A . 16 LYS CG 1 1 34 21372 1 1 16 LYS H H -1.737 -3.850 2.420 1.00 . A A . 16 LYS H 1 1 34 21373 1 1 16 LYS HA H -0.411 -5.673 3.948 1.00 . A A . 16 LYS HA 1 1 34 21374 1 1 16 LYS HB2 H 0.552 -3.714 1.897 1.00 . A A . 16 LYS HB2 1 1 34 21375 1 1 16 LYS HB3 H 1.712 -4.732 2.737 1.00 . A A . 16 LYS HB3 1 1 34 21376 1 1 16 LYS HD2 H 1.761 -4.830 0.131 1.00 . A A . 16 LYS HD2 1 1 34 21377 1 1 16 LYS HD3 H 2.234 -6.456 0.627 1.00 . A A . 16 LYS HD3 1 1 34 21378 1 1 16 LYS HE2 H 0.744 -7.469 -0.861 1.00 . A A . 16 LYS HE2 1 1 34 21379 1 1 16 LYS HE3 H -0.196 -5.992 -1.067 1.00 . A A . 16 LYS HE3 1 1 34 21380 1 1 16 LYS HG2 H 0.418 -6.719 1.991 1.00 . A A . 16 LYS HG2 1 1 34 21381 1 1 16 LYS HG3 H -0.595 -5.637 1.033 1.00 . A A . 16 LYS HG3 1 1 34 21382 1 1 16 LYS HZ1 H 1.889 -5.047 -2.115 1.00 . A A . 16 LYS HZ1 1 1 34 21383 1 1 16 LYS HZ2 H 2.464 -6.637 -2.186 1.00 . A A . 16 LYS HZ2 1 1 34 21384 1 1 16 LYS HZ3 H 1.053 -6.211 -3.014 1.00 . A A . 16 LYS HZ3 1 1 34 21385 1 1 16 LYS N N -1.500 -4.028 3.356 1.00 . A A . 16 LYS N 1 1 34 21386 1 1 16 LYS NZ N 1.608 -6.048 -2.150 1.00 . A A . 16 LYS NZ 1 1 34 21387 1 1 16 LYS O O 0.076 -2.847 5.221 1.00 . A A . 16 LYS O 1 1 34 21388 1 1 17 PRO C C 3.027 -2.672 6.086 1.00 . A A . 17 PRO C 1 1 34 21389 1 1 17 PRO CA C 2.306 -3.956 6.479 1.00 . A A . 17 PRO CA 1 1 34 21390 1 1 17 PRO CB C 3.328 -5.042 6.847 1.00 . A A . 17 PRO CB 1 1 34 21391 1 1 17 PRO CD C 2.107 -5.834 4.945 1.00 . A A . 17 PRO CD 1 1 34 21392 1 1 17 PRO CG C 2.867 -6.283 6.159 1.00 . A A . 17 PRO CG 1 1 34 21393 1 1 17 PRO HA H 1.666 -3.760 7.326 1.00 . A A . 17 PRO HA 1 1 34 21394 1 1 17 PRO HB2 H 4.309 -4.746 6.505 1.00 . A A . 17 PRO HB2 1 1 34 21395 1 1 17 PRO HB3 H 3.343 -5.172 7.919 1.00 . A A . 17 PRO HB3 1 1 34 21396 1 1 17 PRO HD2 H 2.775 -5.716 4.103 1.00 . A A . 17 PRO HD2 1 1 34 21397 1 1 17 PRO HD3 H 1.319 -6.533 4.710 1.00 . A A . 17 PRO HD3 1 1 34 21398 1 1 17 PRO HG2 H 3.720 -6.876 5.866 1.00 . A A . 17 PRO HG2 1 1 34 21399 1 1 17 PRO HG3 H 2.223 -6.849 6.815 1.00 . A A . 17 PRO HG3 1 1 34 21400 1 1 17 PRO N N 1.553 -4.539 5.363 1.00 . A A . 17 PRO N 1 1 34 21401 1 1 17 PRO O O 3.495 -2.531 4.957 1.00 . A A . 17 PRO O 1 1 34 21402 1 1 18 ALA C C 5.254 -0.704 6.410 1.00 . A A . 18 ALA C 1 1 34 21403 1 1 18 ALA CA C 3.794 -0.473 6.784 1.00 . A A . 18 ALA CA 1 1 34 21404 1 1 18 ALA CB C 3.694 0.424 8.008 1.00 . A A . 18 ALA CB 1 1 34 21405 1 1 18 ALA H H 2.732 -1.914 7.912 1.00 . A A . 18 ALA H 1 1 34 21406 1 1 18 ALA HA H 3.293 0.018 5.962 1.00 . A A . 18 ALA HA 1 1 34 21407 1 1 18 ALA HB1 H 4.415 0.107 8.747 1.00 . A A . 18 ALA HB1 1 1 34 21408 1 1 18 ALA HB2 H 3.898 1.446 7.723 1.00 . A A . 18 ALA HB2 1 1 34 21409 1 1 18 ALA HB3 H 2.700 0.358 8.424 1.00 . A A . 18 ALA HB3 1 1 34 21410 1 1 18 ALA N N 3.120 -1.741 7.030 1.00 . A A . 18 ALA N 1 1 34 21411 1 1 18 ALA O O 5.841 -1.725 6.768 1.00 . A A . 18 ALA O 1 1 34 21412 1 1 19 GLY C C 7.424 -1.018 4.284 1.00 . A A . 19 GLY C 1 1 34 21413 1 1 19 GLY CA C 7.218 0.115 5.272 1.00 . A A . 19 GLY CA 1 1 34 21414 1 1 19 GLY H H 5.318 1.035 5.423 1.00 . A A . 19 GLY H 1 1 34 21415 1 1 19 GLY HA2 H 7.827 -0.069 6.145 1.00 . A A . 19 GLY HA2 1 1 34 21416 1 1 19 GLY HA3 H 7.534 1.040 4.814 1.00 . A A . 19 GLY HA3 1 1 34 21417 1 1 19 GLY N N 5.834 0.244 5.684 1.00 . A A . 19 GLY N 1 1 34 21418 1 1 19 GLY O O 8.546 -1.488 4.095 1.00 . A A . 19 GLY O 1 1 34 21419 1 1 20 THR C C 5.974 -2.035 1.301 1.00 . A A . 20 THR C 1 1 34 21420 1 1 20 THR CA C 6.404 -2.534 2.674 1.00 . A A . 20 THR CA 1 1 34 21421 1 1 20 THR CB C 5.512 -3.698 3.110 1.00 . A A . 20 THR CB 1 1 34 21422 1 1 20 THR CG2 C 5.548 -4.873 2.156 1.00 . A A . 20 THR CG2 1 1 34 21423 1 1 20 THR H H 5.473 -1.038 3.839 1.00 . A A . 20 THR H 1 1 34 21424 1 1 20 THR HA H 7.428 -2.874 2.619 1.00 . A A . 20 THR HA 1 1 34 21425 1 1 20 THR HB H 4.490 -3.352 3.167 1.00 . A A . 20 THR HB 1 1 34 21426 1 1 20 THR HG1 H 5.405 -3.697 5.065 1.00 . A A . 20 THR HG1 1 1 34 21427 1 1 20 THR HG21 H 5.775 -4.522 1.161 1.00 . A A . 20 THR HG21 1 1 34 21428 1 1 20 THR HG22 H 6.307 -5.572 2.474 1.00 . A A . 20 THR HG22 1 1 34 21429 1 1 20 THR HG23 H 4.585 -5.364 2.154 1.00 . A A . 20 THR HG23 1 1 34 21430 1 1 20 THR N N 6.339 -1.455 3.650 1.00 . A A . 20 THR N 1 1 34 21431 1 1 20 THR O O 4.879 -1.495 1.142 1.00 . A A . 20 THR O 1 1 34 21432 1 1 20 THR OG1 O 5.894 -4.172 4.389 1.00 . A A . 20 THR OG1 1 1 34 21433 1 1 21 THR C C 5.175 -2.267 -1.498 1.00 . A A . 21 THR C 1 1 34 21434 1 1 21 THR CA C 6.546 -1.773 -1.049 1.00 . A A . 21 THR CA 1 1 34 21435 1 1 21 THR CB C 7.625 -2.260 -2.018 1.00 . A A . 21 THR CB 1 1 34 21436 1 1 21 THR CG2 C 8.371 -1.126 -2.682 1.00 . A A . 21 THR CG2 1 1 34 21437 1 1 21 THR H H 7.700 -2.647 0.497 1.00 . A A . 21 THR H 1 1 34 21438 1 1 21 THR HA H 6.540 -0.693 -1.050 1.00 . A A . 21 THR HA 1 1 34 21439 1 1 21 THR HB H 7.162 -2.851 -2.795 1.00 . A A . 21 THR HB 1 1 34 21440 1 1 21 THR HG1 H 9.176 -3.456 -1.992 1.00 . A A . 21 THR HG1 1 1 34 21441 1 1 21 THR HG21 H 8.138 -0.201 -2.175 1.00 . A A . 21 THR HG21 1 1 34 21442 1 1 21 THR HG22 H 9.433 -1.311 -2.626 1.00 . A A . 21 THR HG22 1 1 34 21443 1 1 21 THR HG23 H 8.070 -1.055 -3.716 1.00 . A A . 21 THR HG23 1 1 34 21444 1 1 21 THR N N 6.841 -2.213 0.310 1.00 . A A . 21 THR N 1 1 34 21445 1 1 21 THR O O 4.894 -3.465 -1.470 1.00 . A A . 21 THR O 1 1 34 21446 1 1 21 THR OG1 O 8.577 -3.069 -1.350 1.00 . A A . 21 THR OG1 1 1 34 21447 1 1 22 CYS C C 2.815 -1.433 -3.844 1.00 . A A . 22 CYS C 1 1 34 21448 1 1 22 CYS CA C 2.978 -1.668 -2.347 1.00 . A A . 22 CYS CA 1 1 34 21449 1 1 22 CYS CB C 1.948 -0.842 -1.577 1.00 . A A . 22 CYS CB 1 1 34 21450 1 1 22 CYS H H 4.604 -0.393 -1.895 1.00 . A A . 22 CYS H 1 1 34 21451 1 1 22 CYS HA H 2.814 -2.714 -2.139 1.00 . A A . 22 CYS HA 1 1 34 21452 1 1 22 CYS HB2 H 0.964 -1.059 -1.963 1.00 . A A . 22 CYS HB2 1 1 34 21453 1 1 22 CYS HB3 H 1.988 -1.112 -0.532 1.00 . A A . 22 CYS HB3 1 1 34 21454 1 1 22 CYS N N 4.323 -1.332 -1.902 1.00 . A A . 22 CYS N 1 1 34 21455 1 1 22 CYS O O 2.104 -2.174 -4.522 1.00 . A A . 22 CYS O 1 1 34 21456 1 1 22 CYS SG S 2.199 0.959 -1.695 1.00 . A A . 22 CYS SG 1 1 34 21457 1 1 23 TRP C C 4.604 -0.560 -6.534 1.00 . A A . 23 TRP C 1 1 34 21458 1 1 23 TRP CA C 3.380 -0.067 -5.771 1.00 . A A . 23 TRP CA 1 1 34 21459 1 1 23 TRP CB C 3.211 1.442 -5.959 1.00 . A A . 23 TRP CB 1 1 34 21460 1 1 23 TRP CD1 C 1.731 0.938 -7.987 1.00 . A A . 23 TRP CD1 1 1 34 21461 1 1 23 TRP CD2 C 1.912 3.113 -7.500 1.00 . A A . 23 TRP CD2 1 1 34 21462 1 1 23 TRP CE2 C 1.079 2.973 -8.626 1.00 . A A . 23 TRP CE2 1 1 34 21463 1 1 23 TRP CE3 C 2.172 4.393 -7.008 1.00 . A A . 23 TRP CE3 1 1 34 21464 1 1 23 TRP CG C 2.317 1.799 -7.106 1.00 . A A . 23 TRP CG 1 1 34 21465 1 1 23 TRP CH2 C 0.779 5.310 -8.765 1.00 . A A . 23 TRP CH2 1 1 34 21466 1 1 23 TRP CZ2 C 0.506 4.067 -9.267 1.00 . A A . 23 TRP CZ2 1 1 34 21467 1 1 23 TRP CZ3 C 1.604 5.479 -7.646 1.00 . A A . 23 TRP CZ3 1 1 34 21468 1 1 23 TRP H H 4.016 0.165 -3.764 1.00 . A A . 23 TRP H 1 1 34 21469 1 1 23 TRP HA H 2.511 -0.564 -6.165 1.00 . A A . 23 TRP HA 1 1 34 21470 1 1 23 TRP HB2 H 2.786 1.865 -5.061 1.00 . A A . 23 TRP HB2 1 1 34 21471 1 1 23 TRP HB3 H 4.178 1.888 -6.137 1.00 . A A . 23 TRP HB3 1 1 34 21472 1 1 23 TRP HD1 H 1.848 -0.133 -7.954 1.00 . A A . 23 TRP HD1 1 1 34 21473 1 1 23 TRP HE1 H 0.467 1.240 -9.636 1.00 . A A . 23 TRP HE1 1 1 34 21474 1 1 23 TRP HE3 H 2.804 4.540 -6.147 1.00 . A A . 23 TRP HE3 1 1 34 21475 1 1 23 TRP HH2 H 0.358 6.186 -9.234 1.00 . A A . 23 TRP HH2 1 1 34 21476 1 1 23 TRP HZ2 H -0.133 3.953 -10.129 1.00 . A A . 23 TRP HZ2 1 1 34 21477 1 1 23 TRP HZ3 H 1.795 6.477 -7.281 1.00 . A A . 23 TRP HZ3 1 1 34 21478 1 1 23 TRP N N 3.468 -0.395 -4.354 1.00 . A A . 23 TRP N 1 1 34 21479 1 1 23 TRP NE1 N 0.984 1.636 -8.903 1.00 . A A . 23 TRP NE1 1 1 34 21480 1 1 23 TRP O O 4.529 -1.534 -7.282 1.00 . A A . 23 TRP O 1 1 34 21481 1 1 24 LYS C C 6.822 -0.154 -8.527 1.00 . A A . 24 LYS C 1 1 34 21482 1 1 24 LYS CA C 6.968 -0.256 -7.011 1.00 . A A . 24 LYS CA 1 1 34 21483 1 1 24 LYS CB C 7.367 -1.674 -6.615 1.00 . A A . 24 LYS CB 1 1 34 21484 1 1 24 LYS CD C 8.605 -3.438 -7.913 1.00 . A A . 24 LYS CD 1 1 34 21485 1 1 24 LYS CE C 9.977 -4.012 -8.227 1.00 . A A . 24 LYS CE 1 1 34 21486 1 1 24 LYS CG C 8.711 -2.111 -7.178 1.00 . A A . 24 LYS CG 1 1 34 21487 1 1 24 LYS H H 5.724 0.880 -5.730 1.00 . A A . 24 LYS H 1 1 34 21488 1 1 24 LYS HA H 7.739 0.425 -6.689 1.00 . A A . 24 LYS HA 1 1 34 21489 1 1 24 LYS HB2 H 7.417 -1.727 -5.537 1.00 . A A . 24 LYS HB2 1 1 34 21490 1 1 24 LYS HB3 H 6.610 -2.358 -6.966 1.00 . A A . 24 LYS HB3 1 1 34 21491 1 1 24 LYS HD2 H 8.066 -4.140 -7.294 1.00 . A A . 24 LYS HD2 1 1 34 21492 1 1 24 LYS HD3 H 8.068 -3.284 -8.837 1.00 . A A . 24 LYS HD3 1 1 34 21493 1 1 24 LYS HE2 H 9.938 -4.499 -9.190 1.00 . A A . 24 LYS HE2 1 1 34 21494 1 1 24 LYS HE3 H 10.692 -3.203 -8.263 1.00 . A A . 24 LYS HE3 1 1 34 21495 1 1 24 LYS HG2 H 9.064 -1.358 -7.866 1.00 . A A . 24 LYS HG2 1 1 34 21496 1 1 24 LYS HG3 H 9.414 -2.216 -6.364 1.00 . A A . 24 LYS HG3 1 1 34 21497 1 1 24 LYS HZ1 H 9.713 -5.764 -7.121 1.00 . A A . 24 LYS HZ1 1 1 34 21498 1 1 24 LYS HZ2 H 11.330 -5.413 -7.472 1.00 . A A . 24 LYS HZ2 1 1 34 21499 1 1 24 LYS HZ3 H 10.515 -4.535 -6.278 1.00 . A A . 24 LYS HZ3 1 1 34 21500 1 1 24 LYS N N 5.728 0.116 -6.340 1.00 . A A . 24 LYS N 1 1 34 21501 1 1 24 LYS NZ N 10.414 -5.000 -7.203 1.00 . A A . 24 LYS NZ 1 1 34 21502 1 1 24 LYS O O 7.359 -0.977 -9.269 1.00 . A A . 24 LYS O 1 1 34 21503 1 1 25 THR C C 7.198 1.357 -11.119 1.00 . A A . 25 THR C 1 1 34 21504 1 1 25 THR CA C 5.879 1.076 -10.406 1.00 . A A . 25 THR CA 1 1 34 21505 1 1 25 THR CB C 4.903 2.234 -10.632 1.00 . A A . 25 THR CB 1 1 34 21506 1 1 25 THR CG2 C 3.809 1.909 -11.626 1.00 . A A . 25 THR CG2 1 1 34 21507 1 1 25 THR H H 5.694 1.485 -8.337 1.00 . A A . 25 THR H 1 1 34 21508 1 1 25 THR HA H 5.451 0.173 -10.815 1.00 . A A . 25 THR HA 1 1 34 21509 1 1 25 THR HB H 5.450 3.086 -11.011 1.00 . A A . 25 THR HB 1 1 34 21510 1 1 25 THR HG1 H 3.859 1.844 -9.024 1.00 . A A . 25 THR HG1 1 1 34 21511 1 1 25 THR HG21 H 3.416 0.925 -11.419 1.00 . A A . 25 THR HG21 1 1 34 21512 1 1 25 THR HG22 H 3.017 2.638 -11.539 1.00 . A A . 25 THR HG22 1 1 34 21513 1 1 25 THR HG23 H 4.213 1.934 -12.627 1.00 . A A . 25 THR HG23 1 1 34 21514 1 1 25 THR N N 6.095 0.862 -8.979 1.00 . A A . 25 THR N 1 1 34 21515 1 1 25 THR O O 8.244 1.488 -10.483 1.00 . A A . 25 THR O 1 1 34 21516 1 1 25 THR OG1 O 4.280 2.611 -9.418 1.00 . A A . 25 THR OG1 1 1 34 21517 1 1 26 SER C C 8.857 3.118 -13.007 1.00 . A A . 26 SER C 1 1 34 21518 1 1 26 SER CA C 8.328 1.706 -13.247 1.00 . A A . 26 SER CA 1 1 34 21519 1 1 26 SER CB C 8.016 1.514 -14.732 1.00 . A A . 26 SER CB 1 1 34 21520 1 1 26 SER H H 6.276 1.328 -12.890 1.00 . A A . 26 SER H 1 1 34 21521 1 1 26 SER HA H 9.088 0.997 -12.955 1.00 . A A . 26 SER HA 1 1 34 21522 1 1 26 SER HB2 H 7.193 2.156 -15.011 1.00 . A A . 26 SER HB2 1 1 34 21523 1 1 26 SER HB3 H 8.887 1.770 -15.318 1.00 . A A . 26 SER HB3 1 1 34 21524 1 1 26 SER HG H 8.305 -0.420 -14.615 1.00 . A A . 26 SER HG 1 1 34 21525 1 1 26 SER N N 7.140 1.445 -12.443 1.00 . A A . 26 SER N 1 1 34 21526 1 1 26 SER O O 10.058 3.367 -13.119 1.00 . A A . 26 SER O 1 1 34 21527 1 1 26 SER OG O 7.659 0.170 -15.009 1.00 . A A . 26 SER OG 1 1 34 21528 1 1 27 VAL C C 7.571 5.997 -11.239 1.00 . A A . 27 VAL C 1 1 34 21529 1 1 27 VAL CA C 8.338 5.424 -12.428 1.00 . A A . 27 VAL CA 1 1 34 21530 1 1 27 VAL CB C 8.091 6.308 -13.667 1.00 . A A . 27 VAL CB 1 1 34 21531 1 1 27 VAL CG1 C 6.607 6.364 -14.002 1.00 . A A . 27 VAL CG1 1 1 34 21532 1 1 27 VAL CG2 C 8.652 7.707 -13.448 1.00 . A A . 27 VAL CG2 1 1 34 21533 1 1 27 VAL H H 7.014 3.781 -12.607 1.00 . A A . 27 VAL H 1 1 34 21534 1 1 27 VAL HA H 9.394 5.442 -12.204 1.00 . A A . 27 VAL HA 1 1 34 21535 1 1 27 VAL HB H 8.607 5.865 -14.506 1.00 . A A . 27 VAL HB 1 1 34 21536 1 1 27 VAL HG11 H 6.047 6.623 -13.116 1.00 . A A . 27 VAL HG11 1 1 34 21537 1 1 27 VAL HG12 H 6.438 7.109 -14.765 1.00 . A A . 27 VAL HG12 1 1 34 21538 1 1 27 VAL HG13 H 6.283 5.399 -14.364 1.00 . A A . 27 VAL HG13 1 1 34 21539 1 1 27 VAL HG21 H 8.945 7.821 -12.415 1.00 . A A . 27 VAL HG21 1 1 34 21540 1 1 27 VAL HG22 H 9.513 7.853 -14.084 1.00 . A A . 27 VAL HG22 1 1 34 21541 1 1 27 VAL HG23 H 7.897 8.441 -13.691 1.00 . A A . 27 VAL HG23 1 1 34 21542 1 1 27 VAL N N 7.956 4.039 -12.680 1.00 . A A . 27 VAL N 1 1 34 21543 1 1 27 VAL O O 7.155 7.156 -11.253 1.00 . A A . 27 VAL O 1 1 34 21544 1 1 28 SER C C 7.310 5.036 -7.758 1.00 . A A . 28 SER C 1 1 34 21545 1 1 28 SER CA C 6.667 5.606 -9.018 1.00 . A A . 28 SER CA 1 1 34 21546 1 1 28 SER CB C 5.200 5.176 -9.104 1.00 . A A . 28 SER CB 1 1 34 21547 1 1 28 SER H H 7.738 4.264 -10.257 1.00 . A A . 28 SER H 1 1 34 21548 1 1 28 SER HA H 6.714 6.681 -8.973 1.00 . A A . 28 SER HA 1 1 34 21549 1 1 28 SER HB2 H 5.023 4.697 -10.055 1.00 . A A . 28 SER HB2 1 1 34 21550 1 1 28 SER HB3 H 4.980 4.483 -8.305 1.00 . A A . 28 SER HB3 1 1 34 21551 1 1 28 SER HG H 3.870 6.423 -9.821 1.00 . A A . 28 SER HG 1 1 34 21552 1 1 28 SER N N 7.386 5.178 -10.211 1.00 . A A . 28 SER N 1 1 34 21553 1 1 28 SER O O 7.994 5.745 -7.020 1.00 . A A . 28 SER O 1 1 34 21554 1 1 28 SER OG O 4.334 6.292 -8.991 1.00 . A A . 28 SER OG 1 1 34 21555 1 1 29 SER C C 7.266 3.811 -5.066 1.00 . A A . 29 SER C 1 1 34 21556 1 1 29 SER CA C 7.627 3.073 -6.349 1.00 . A A . 29 SER CA 1 1 34 21557 1 1 29 SER CB C 9.147 2.939 -6.469 1.00 . A A . 29 SER CB 1 1 34 21558 1 1 29 SER H H 6.524 3.248 -8.147 1.00 . A A . 29 SER H 1 1 34 21559 1 1 29 SER HA H 7.189 2.090 -6.310 1.00 . A A . 29 SER HA 1 1 34 21560 1 1 29 SER HB2 H 9.570 3.895 -6.737 1.00 . A A . 29 SER HB2 1 1 34 21561 1 1 29 SER HB3 H 9.553 2.618 -5.521 1.00 . A A . 29 SER HB3 1 1 34 21562 1 1 29 SER HG H 10.123 1.360 -7.095 1.00 . A A . 29 SER HG 1 1 34 21563 1 1 29 SER N N 7.080 3.752 -7.520 1.00 . A A . 29 SER N 1 1 34 21564 1 1 29 SER O O 7.911 4.792 -4.697 1.00 . A A . 29 SER O 1 1 34 21565 1 1 29 SER OG O 9.499 1.991 -7.462 1.00 . A A . 29 SER OG 1 1 34 21566 1 1 30 HIS C C 5.529 2.904 -2.080 1.00 . A A . 30 HIS C 1 1 34 21567 1 1 30 HIS CA C 5.752 3.951 -3.166 1.00 . A A . 30 HIS CA 1 1 34 21568 1 1 30 HIS CB C 4.456 4.718 -3.433 1.00 . A A . 30 HIS CB 1 1 34 21569 1 1 30 HIS CD2 C 4.971 5.469 -5.858 1.00 . A A . 30 HIS CD2 1 1 34 21570 1 1 30 HIS CE1 C 4.450 7.588 -5.658 1.00 . A A . 30 HIS CE1 1 1 34 21571 1 1 30 HIS CG C 4.563 5.669 -4.583 1.00 . A A . 30 HIS CG 1 1 34 21572 1 1 30 HIS H H 5.742 2.557 -4.754 1.00 . A A . 30 HIS H 1 1 34 21573 1 1 30 HIS HA H 6.508 4.646 -2.833 1.00 . A A . 30 HIS HA 1 1 34 21574 1 1 30 HIS HB2 H 3.668 4.012 -3.657 1.00 . A A . 30 HIS HB2 1 1 34 21575 1 1 30 HIS HB3 H 4.190 5.283 -2.552 1.00 . A A . 30 HIS HB3 1 1 34 21576 1 1 30 HIS HD1 H 3.912 7.461 -3.688 1.00 . A A . 30 HIS HD1 1 1 34 21577 1 1 30 HIS HD2 H 5.289 4.527 -6.289 1.00 . A A . 30 HIS HD2 1 1 34 21578 1 1 30 HIS HE1 H 4.286 8.631 -5.882 1.00 . A A . 30 HIS HE1 1 1 34 21579 1 1 30 HIS HE2 H 5.282 6.876 -7.381 1.00 . A A . 30 HIS HE2 1 1 34 21580 1 1 30 HIS N N 6.219 3.336 -4.400 1.00 . A A . 30 HIS N 1 1 34 21581 1 1 30 HIS ND1 N 4.243 7.006 -4.490 1.00 . A A . 30 HIS ND1 1 1 34 21582 1 1 30 HIS NE2 N 4.894 6.679 -6.505 1.00 . A A . 30 HIS NE2 1 1 34 21583 1 1 30 HIS O O 4.904 1.870 -2.318 1.00 . A A . 30 HIS O 1 1 34 21584 1 1 31 TYR C C 4.582 2.508 0.968 1.00 . A A . 31 TYR C 1 1 34 21585 1 1 31 TYR CA C 5.900 2.267 0.241 1.00 . A A . 31 TYR CA 1 1 34 21586 1 1 31 TYR CB C 7.068 2.440 1.214 1.00 . A A . 31 TYR CB 1 1 34 21587 1 1 31 TYR CD1 C 8.806 1.530 -0.376 1.00 . A A . 31 TYR CD1 1 1 34 21588 1 1 31 TYR CD2 C 8.833 0.764 1.881 1.00 . A A . 31 TYR CD2 1 1 34 21589 1 1 31 TYR CE1 C 9.893 0.728 -0.666 1.00 . A A . 31 TYR CE1 1 1 34 21590 1 1 31 TYR CE2 C 9.921 -0.040 1.599 1.00 . A A . 31 TYR CE2 1 1 34 21591 1 1 31 TYR CG C 8.257 1.561 0.900 1.00 . A A . 31 TYR CG 1 1 34 21592 1 1 31 TYR CZ C 10.447 -0.054 0.325 1.00 . A A . 31 TYR CZ 1 1 34 21593 1 1 31 TYR H H 6.529 4.023 -0.760 1.00 . A A . 31 TYR H 1 1 34 21594 1 1 31 TYR HA H 5.909 1.259 -0.145 1.00 . A A . 31 TYR HA 1 1 34 21595 1 1 31 TYR HB2 H 7.400 3.467 1.188 1.00 . A A . 31 TYR HB2 1 1 34 21596 1 1 31 TYR HB3 H 6.732 2.201 2.212 1.00 . A A . 31 TYR HB3 1 1 34 21597 1 1 31 TYR HD1 H 8.370 2.144 -1.150 1.00 . A A . 31 TYR HD1 1 1 34 21598 1 1 31 TYR HD2 H 8.418 0.777 2.877 1.00 . A A . 31 TYR HD2 1 1 34 21599 1 1 31 TYR HE1 H 10.306 0.718 -1.664 1.00 . A A . 31 TYR HE1 1 1 34 21600 1 1 31 TYR HE2 H 10.353 -0.653 2.376 1.00 . A A . 31 TYR HE2 1 1 34 21601 1 1 31 TYR HH H 12.156 -0.366 -0.500 1.00 . A A . 31 TYR HH 1 1 34 21602 1 1 31 TYR N N 6.043 3.182 -0.886 1.00 . A A . 31 TYR N 1 1 34 21603 1 1 31 TYR O O 3.974 3.569 0.834 1.00 . A A . 31 TYR O 1 1 34 21604 1 1 31 TYR OH O 11.531 -0.854 0.041 1.00 . A A . 31 TYR OH 1 1 34 21605 1 1 32 CYS C C 3.180 2.029 3.938 1.00 . A A . 32 CYS C 1 1 34 21606 1 1 32 CYS CA C 2.903 1.632 2.492 1.00 . A A . 32 CYS CA 1 1 34 21607 1 1 32 CYS CB C 2.127 0.313 2.445 1.00 . A A . 32 CYS CB 1 1 34 21608 1 1 32 CYS H H 4.675 0.697 1.814 1.00 . A A . 32 CYS H 1 1 34 21609 1 1 32 CYS HA H 2.309 2.405 2.029 1.00 . A A . 32 CYS HA 1 1 34 21610 1 1 32 CYS HB2 H 2.583 -0.337 1.714 1.00 . A A . 32 CYS HB2 1 1 34 21611 1 1 32 CYS HB3 H 2.171 -0.158 3.416 1.00 . A A . 32 CYS HB3 1 1 34 21612 1 1 32 CYS N N 4.146 1.519 1.743 1.00 . A A . 32 CYS N 1 1 34 21613 1 1 32 CYS O O 4.307 1.911 4.419 1.00 . A A . 32 CYS O 1 1 34 21614 1 1 32 CYS SG S 0.371 0.502 1.998 1.00 . A A . 32 CYS SG 1 1 34 21615 1 1 33 THR C C 1.405 2.064 6.929 1.00 . A A . 33 THR C 1 1 34 21616 1 1 33 THR CA C 2.282 2.917 6.017 1.00 . A A . 33 THR CA 1 1 34 21617 1 1 33 THR CB C 1.909 4.393 6.169 1.00 . A A . 33 THR CB 1 1 34 21618 1 1 33 THR CG2 C 2.459 5.268 5.062 1.00 . A A . 33 THR CG2 1 1 34 21619 1 1 33 THR H H 1.273 2.572 4.188 1.00 . A A . 33 THR H 1 1 34 21620 1 1 33 THR HA H 3.314 2.785 6.304 1.00 . A A . 33 THR HA 1 1 34 21621 1 1 33 THR HB H 2.303 4.759 7.106 1.00 . A A . 33 THR HB 1 1 34 21622 1 1 33 THR HG1 H 0.263 5.217 6.839 1.00 . A A . 33 THR HG1 1 1 34 21623 1 1 33 THR HG21 H 2.082 4.925 4.110 1.00 . A A . 33 THR HG21 1 1 34 21624 1 1 33 THR HG22 H 2.150 6.290 5.224 1.00 . A A . 33 THR HG22 1 1 34 21625 1 1 33 THR HG23 H 3.538 5.214 5.063 1.00 . A A . 33 THR HG23 1 1 34 21626 1 1 33 THR N N 2.147 2.501 4.626 1.00 . A A . 33 THR N 1 1 34 21627 1 1 33 THR O O 1.081 2.467 8.047 1.00 . A A . 33 THR O 1 1 34 21628 1 1 33 THR OG1 O 0.502 4.556 6.185 1.00 . A A . 33 THR OG1 1 1 34 21629 1 1 34 GLY C C -1.022 0.694 7.829 1.00 . A A . 34 GLY C 1 1 34 21630 1 1 34 GLY CA C 0.187 -0.007 7.235 1.00 . A A . 34 GLY CA 1 1 34 21631 1 1 34 GLY H H 1.313 0.613 5.550 1.00 . A A . 34 GLY H 1 1 34 21632 1 1 34 GLY HA2 H 0.779 -0.420 8.039 1.00 . A A . 34 GLY HA2 1 1 34 21633 1 1 34 GLY HA3 H -0.154 -0.814 6.604 1.00 . A A . 34 GLY HA3 1 1 34 21634 1 1 34 GLY N N 1.023 0.883 6.448 1.00 . A A . 34 GLY N 1 1 34 21635 1 1 34 GLY O O -1.542 0.277 8.864 1.00 . A A . 34 GLY O 1 1 34 21636 1 1 35 ARG C C -3.791 2.395 6.669 1.00 . A A . 35 ARG C 1 1 34 21637 1 1 35 ARG CA C -2.624 2.519 7.643 1.00 . A A . 35 ARG CA 1 1 34 21638 1 1 35 ARG CB C -2.252 3.992 7.827 1.00 . A A . 35 ARG CB 1 1 34 21639 1 1 35 ARG CD C -2.656 4.790 10.175 1.00 . A A . 35 ARG CD 1 1 34 21640 1 1 35 ARG CG C -1.622 4.296 9.176 1.00 . A A . 35 ARG CG 1 1 34 21641 1 1 35 ARG CZ C -2.652 5.762 12.439 1.00 . A A . 35 ARG CZ 1 1 34 21642 1 1 35 ARG H H -1.013 2.044 6.353 1.00 . A A . 35 ARG H 1 1 34 21643 1 1 35 ARG HA H -2.923 2.111 8.596 1.00 . A A . 35 ARG HA 1 1 34 21644 1 1 35 ARG HB2 H -1.552 4.273 7.054 1.00 . A A . 35 ARG HB2 1 1 34 21645 1 1 35 ARG HB3 H -3.145 4.592 7.727 1.00 . A A . 35 ARG HB3 1 1 34 21646 1 1 35 ARG HD2 H -3.077 5.715 9.810 1.00 . A A . 35 ARG HD2 1 1 34 21647 1 1 35 ARG HD3 H -3.437 4.049 10.261 1.00 . A A . 35 ARG HD3 1 1 34 21648 1 1 35 ARG HE H -1.207 4.608 11.687 1.00 . A A . 35 ARG HE 1 1 34 21649 1 1 35 ARG HG2 H -1.166 3.396 9.560 1.00 . A A . 35 ARG HG2 1 1 34 21650 1 1 35 ARG HG3 H -0.867 5.058 9.046 1.00 . A A . 35 ARG HG3 1 1 34 21651 1 1 35 ARG HH11 H -4.281 6.223 11.332 1.00 . A A . 35 ARG HH11 1 1 34 21652 1 1 35 ARG HH12 H -4.254 6.894 12.929 1.00 . A A . 35 ARG HH12 1 1 34 21653 1 1 35 ARG HH21 H -1.170 5.490 13.787 1.00 . A A . 35 ARG HH21 1 1 34 21654 1 1 35 ARG HH22 H -2.488 6.478 14.322 1.00 . A A . 35 ARG HH22 1 1 34 21655 1 1 35 ARG N N -1.470 1.760 7.173 1.00 . A A . 35 ARG N 1 1 34 21656 1 1 35 ARG NE N -2.074 5.024 11.494 1.00 . A A . 35 ARG NE 1 1 34 21657 1 1 35 ARG NH1 N -3.825 6.340 12.215 1.00 . A A . 35 ARG NH1 1 1 34 21658 1 1 35 ARG NH2 N -2.054 5.923 13.612 1.00 . A A . 35 ARG NH2 1 1 34 21659 1 1 35 ARG O O -4.951 2.341 7.077 1.00 . A A . 35 ARG O 1 1 34 21660 1 1 36 SER C C -4.034 1.272 3.248 1.00 . A A . 36 SER C 1 1 34 21661 1 1 36 SER CA C -4.492 2.230 4.343 1.00 . A A . 36 SER CA 1 1 34 21662 1 1 36 SER CB C -4.803 3.601 3.741 1.00 . A A . 36 SER CB 1 1 34 21663 1 1 36 SER H H -2.531 2.396 5.120 1.00 . A A . 36 SER H 1 1 34 21664 1 1 36 SER HA H -5.387 1.835 4.800 1.00 . A A . 36 SER HA 1 1 34 21665 1 1 36 SER HB2 H -3.920 3.986 3.252 1.00 . A A . 36 SER HB2 1 1 34 21666 1 1 36 SER HB3 H -5.600 3.503 3.020 1.00 . A A . 36 SER HB3 1 1 34 21667 1 1 36 SER HG H -4.469 5.096 4.963 1.00 . A A . 36 SER HG 1 1 34 21668 1 1 36 SER N N -3.474 2.350 5.380 1.00 . A A . 36 SER N 1 1 34 21669 1 1 36 SER O O -2.880 0.844 3.230 1.00 . A A . 36 SER O 1 1 34 21670 1 1 36 SER OG O -5.204 4.519 4.744 1.00 . A A . 36 SER OG 1 1 34 21671 1 1 37 CYS C C -4.137 0.801 0.012 1.00 . A A . 37 CYS C 1 1 34 21672 1 1 37 CYS CA C -4.620 0.033 1.241 1.00 . A A . 37 CYS CA 1 1 34 21673 1 1 37 CYS CB C -5.840 -0.816 0.883 1.00 . A A . 37 CYS CB 1 1 34 21674 1 1 37 CYS H H -5.846 1.313 2.399 1.00 . A A . 37 CYS H 1 1 34 21675 1 1 37 CYS HA H -3.827 -0.619 1.576 1.00 . A A . 37 CYS HA 1 1 34 21676 1 1 37 CYS HB2 H -6.726 -0.203 0.943 1.00 . A A . 37 CYS HB2 1 1 34 21677 1 1 37 CYS HB3 H -5.730 -1.183 -0.127 1.00 . A A . 37 CYS HB3 1 1 34 21678 1 1 37 CYS N N -4.942 0.940 2.336 1.00 . A A . 37 CYS N 1 1 34 21679 1 1 37 CYS O O -3.954 0.221 -1.059 1.00 . A A . 37 CYS O 1 1 34 21680 1 1 37 CYS SG S -6.087 -2.255 1.974 1.00 . A A . 37 CYS SG 1 1 34 21681 1 1 38 GLU C C -1.991 3.313 -0.737 1.00 . A A . 38 GLU C 1 1 34 21682 1 1 38 GLU CA C -3.459 2.944 -0.926 1.00 . A A . 38 GLU CA 1 1 34 21683 1 1 38 GLU CB C -4.309 4.213 -1.024 1.00 . A A . 38 GLU CB 1 1 34 21684 1 1 38 GLU CD C -5.924 4.314 -2.963 1.00 . A A . 38 GLU CD 1 1 34 21685 1 1 38 GLU CG C -4.544 4.679 -2.451 1.00 . A A . 38 GLU CG 1 1 34 21686 1 1 38 GLU H H -4.086 2.512 1.048 1.00 . A A . 38 GLU H 1 1 34 21687 1 1 38 GLU HA H -3.562 2.381 -1.841 1.00 . A A . 38 GLU HA 1 1 34 21688 1 1 38 GLU HB2 H -5.269 4.026 -0.566 1.00 . A A . 38 GLU HB2 1 1 34 21689 1 1 38 GLU HB3 H -3.812 5.007 -0.486 1.00 . A A . 38 GLU HB3 1 1 34 21690 1 1 38 GLU HG2 H -4.436 5.752 -2.488 1.00 . A A . 38 GLU HG2 1 1 34 21691 1 1 38 GLU HG3 H -3.806 4.221 -3.092 1.00 . A A . 38 GLU HG3 1 1 34 21692 1 1 38 GLU N N -3.926 2.105 0.172 1.00 . A A . 38 GLU N 1 1 34 21693 1 1 38 GLU O O -1.466 3.258 0.375 1.00 . A A . 38 GLU O 1 1 34 21694 1 1 38 GLU OE1 O -6.022 3.820 -4.106 1.00 . A A . 38 GLU OE1 1 1 34 21695 1 1 38 GLU OE2 O -6.907 4.522 -2.220 1.00 . A A . 38 GLU OE2 1 1 34 21696 1 1 39 CYS C C 0.241 5.581 -1.875 1.00 . A A . 39 CYS C 1 1 34 21697 1 1 39 CYS CA C 0.076 4.065 -1.780 1.00 . A A . 39 CYS CA 1 1 34 21698 1 1 39 CYS CB C 0.846 3.387 -2.915 1.00 . A A . 39 CYS CB 1 1 34 21699 1 1 39 CYS H H -1.804 3.712 -2.688 1.00 . A A . 39 CYS H 1 1 34 21700 1 1 39 CYS HA H 0.474 3.727 -0.836 1.00 . A A . 39 CYS HA 1 1 34 21701 1 1 39 CYS HB2 H 0.473 3.751 -3.861 1.00 . A A . 39 CYS HB2 1 1 34 21702 1 1 39 CYS HB3 H 1.894 3.637 -2.828 1.00 . A A . 39 CYS HB3 1 1 34 21703 1 1 39 CYS N N -1.333 3.689 -1.830 1.00 . A A . 39 CYS N 1 1 34 21704 1 1 39 CYS O O -0.398 6.229 -2.704 1.00 . A A . 39 CYS O 1 1 34 21705 1 1 39 CYS SG S 0.707 1.571 -2.929 1.00 . A A . 39 CYS SG 1 1 34 21706 1 1 40 PRO C C 1.761 8.129 -2.407 1.00 . A A . 40 PRO C 1 1 34 21707 1 1 40 PRO CA C 1.346 7.618 -1.032 1.00 . A A . 40 PRO CA 1 1 34 21708 1 1 40 PRO CB C 2.490 7.798 -0.030 1.00 . A A . 40 PRO CB 1 1 34 21709 1 1 40 PRO CD C 1.914 5.480 -0.007 1.00 . A A . 40 PRO CD 1 1 34 21710 1 1 40 PRO CG C 2.414 6.603 0.856 1.00 . A A . 40 PRO CG 1 1 34 21711 1 1 40 PRO HA H 0.478 8.165 -0.694 1.00 . A A . 40 PRO HA 1 1 34 21712 1 1 40 PRO HB2 H 3.431 7.838 -0.558 1.00 . A A . 40 PRO HB2 1 1 34 21713 1 1 40 PRO HB3 H 2.344 8.711 0.528 1.00 . A A . 40 PRO HB3 1 1 34 21714 1 1 40 PRO HD2 H 2.742 4.955 -0.461 1.00 . A A . 40 PRO HD2 1 1 34 21715 1 1 40 PRO HD3 H 1.306 4.801 0.572 1.00 . A A . 40 PRO HD3 1 1 34 21716 1 1 40 PRO HG2 H 3.394 6.370 1.245 1.00 . A A . 40 PRO HG2 1 1 34 21717 1 1 40 PRO HG3 H 1.723 6.789 1.665 1.00 . A A . 40 PRO HG3 1 1 34 21718 1 1 40 PRO N N 1.105 6.171 -1.028 1.00 . A A . 40 PRO N 1 1 34 21719 1 1 40 PRO O O 1.900 7.353 -3.352 1.00 . A A . 40 PRO O 1 1 34 21720 1 1 41 SER C C 3.853 10.367 -3.777 1.00 . A A . 41 SER C 1 1 34 21721 1 1 41 SER CA C 2.360 10.052 -3.772 1.00 . A A . 41 SER CA 1 1 34 21722 1 1 41 SER CB C 1.556 11.330 -4.019 1.00 . A A . 41 SER CB 1 1 34 21723 1 1 41 SER H H 1.833 10.006 -1.721 1.00 . A A . 41 SER H 1 1 34 21724 1 1 41 SER HA H 2.151 9.348 -4.563 1.00 . A A . 41 SER HA 1 1 34 21725 1 1 41 SER HB2 H 0.525 11.163 -3.748 1.00 . A A . 41 SER HB2 1 1 34 21726 1 1 41 SER HB3 H 1.962 12.130 -3.417 1.00 . A A . 41 SER HB3 1 1 34 21727 1 1 41 SER HG H 2.468 12.102 -5.572 1.00 . A A . 41 SER HG 1 1 34 21728 1 1 41 SER N N 1.959 9.439 -2.511 1.00 . A A . 41 SER N 1 1 34 21729 1 1 41 SER O O 4.307 11.252 -4.503 1.00 . A A . 41 SER O 1 1 34 21730 1 1 41 SER OG O 1.612 11.712 -5.383 1.00 . A A . 41 SER OG 1 1 34 21731 1 1 42 TYR C C 6.769 8.531 -2.552 1.00 . A A . 42 TYR C 1 1 34 21732 1 1 42 TYR CA C 6.055 9.840 -2.883 1.00 . A A . 42 TYR CA 1 1 34 21733 1 1 42 TYR CB C 6.383 10.899 -1.828 1.00 . A A . 42 TYR CB 1 1 34 21734 1 1 42 TYR CD1 C 4.778 10.585 0.096 1.00 . A A . 42 TYR CD1 1 1 34 21735 1 1 42 TYR CD2 C 7.052 9.944 0.411 1.00 . A A . 42 TYR CD2 1 1 34 21736 1 1 42 TYR CE1 C 4.484 10.193 1.388 1.00 . A A . 42 TYR CE1 1 1 34 21737 1 1 42 TYR CE2 C 6.766 9.549 1.704 1.00 . A A . 42 TYR CE2 1 1 34 21738 1 1 42 TYR CG C 6.065 10.468 -0.414 1.00 . A A . 42 TYR CG 1 1 34 21739 1 1 42 TYR CZ C 5.481 9.676 2.188 1.00 . A A . 42 TYR CZ 1 1 34 21740 1 1 42 TYR H H 4.196 8.945 -2.413 1.00 . A A . 42 TYR H 1 1 34 21741 1 1 42 TYR HA H 6.396 10.188 -3.847 1.00 . A A . 42 TYR HA 1 1 34 21742 1 1 42 TYR HB2 H 7.437 11.128 -1.874 1.00 . A A . 42 TYR HB2 1 1 34 21743 1 1 42 TYR HB3 H 5.816 11.794 -2.039 1.00 . A A . 42 TYR HB3 1 1 34 21744 1 1 42 TYR HD1 H 3.999 10.991 -0.533 1.00 . A A . 42 TYR HD1 1 1 34 21745 1 1 42 TYR HD2 H 8.058 9.848 0.030 1.00 . A A . 42 TYR HD2 1 1 34 21746 1 1 42 TYR HE1 H 3.477 10.291 1.767 1.00 . A A . 42 TYR HE1 1 1 34 21747 1 1 42 TYR HE2 H 7.548 9.144 2.330 1.00 . A A . 42 TYR HE2 1 1 34 21748 1 1 42 TYR HH H 5.537 9.933 4.092 1.00 . A A . 42 TYR HH 1 1 34 21749 1 1 42 TYR N N 4.613 9.637 -2.967 1.00 . A A . 42 TYR N 1 1 34 21750 1 1 42 TYR O O 6.226 7.679 -1.849 1.00 . A A . 42 TYR O 1 1 34 21751 1 1 42 TYR OH O 5.192 9.283 3.475 1.00 . A A . 42 TYR OH 1 1 34 21752 1 1 43 PRO C C 9.320 7.071 -1.385 1.00 . A A . 43 PRO C 1 1 34 21753 1 1 43 PRO CA C 8.788 7.140 -2.813 1.00 . A A . 43 PRO CA 1 1 34 21754 1 1 43 PRO CB C 9.942 7.262 -3.808 1.00 . A A . 43 PRO CB 1 1 34 21755 1 1 43 PRO CD C 8.725 9.318 -3.909 1.00 . A A . 43 PRO CD 1 1 34 21756 1 1 43 PRO CG C 10.105 8.728 -4.013 1.00 . A A . 43 PRO CG 1 1 34 21757 1 1 43 PRO HA H 8.217 6.248 -3.026 1.00 . A A . 43 PRO HA 1 1 34 21758 1 1 43 PRO HB2 H 10.833 6.819 -3.387 1.00 . A A . 43 PRO HB2 1 1 34 21759 1 1 43 PRO HB3 H 9.683 6.761 -4.728 1.00 . A A . 43 PRO HB3 1 1 34 21760 1 1 43 PRO HD2 H 8.765 10.290 -3.440 1.00 . A A . 43 PRO HD2 1 1 34 21761 1 1 43 PRO HD3 H 8.269 9.387 -4.885 1.00 . A A . 43 PRO HD3 1 1 34 21762 1 1 43 PRO HG2 H 10.747 9.137 -3.246 1.00 . A A . 43 PRO HG2 1 1 34 21763 1 1 43 PRO HG3 H 10.521 8.918 -4.992 1.00 . A A . 43 PRO HG3 1 1 34 21764 1 1 43 PRO N N 8.002 8.353 -3.058 1.00 . A A . 43 PRO N 1 1 34 21765 1 1 43 PRO O O 8.909 7.846 -0.521 1.00 . A A . 43 PRO O 1 1 34 21766 1 1 44 GLY C C 10.042 4.997 1.033 1.00 . A A . 44 GLY C 1 1 34 21767 1 1 44 GLY CA C 10.809 5.986 0.179 1.00 . A A . 44 GLY CA 1 1 34 21768 1 1 44 GLY H H 10.525 5.550 -1.873 1.00 . A A . 44 GLY H 1 1 34 21769 1 1 44 GLY HA2 H 10.810 6.947 0.673 1.00 . A A . 44 GLY HA2 1 1 34 21770 1 1 44 GLY HA3 H 11.829 5.644 0.080 1.00 . A A . 44 GLY HA3 1 1 34 21771 1 1 44 GLY N N 10.236 6.139 -1.145 1.00 . A A . 44 GLY N 1 1 34 21772 1 1 44 GLY O O 9.462 4.041 0.518 1.00 . A A . 44 GLY O 1 1 34 21773 1 1 45 ASN C C 7.933 4.871 3.560 1.00 . A A . 45 ASN C 1 1 34 21774 1 1 45 ASN CA C 9.336 4.347 3.270 1.00 . A A . 45 ASN CA 1 1 34 21775 1 1 45 ASN CB C 10.123 4.215 4.575 1.00 . A A . 45 ASN CB 1 1 34 21776 1 1 45 ASN CG C 11.588 3.908 4.338 1.00 . A A . 45 ASN CG 1 1 34 21777 1 1 45 ASN H H 10.519 6.005 2.693 1.00 . A A . 45 ASN H 1 1 34 21778 1 1 45 ASN HA H 9.255 3.374 2.809 1.00 . A A . 45 ASN HA 1 1 34 21779 1 1 45 ASN HB2 H 10.053 5.141 5.126 1.00 . A A . 45 ASN HB2 1 1 34 21780 1 1 45 ASN HB3 H 9.697 3.417 5.166 1.00 . A A . 45 ASN HB3 1 1 34 21781 1 1 45 ASN HD21 H 12.037 4.502 6.182 1.00 . A A . 45 ASN HD21 1 1 34 21782 1 1 45 ASN HD22 H 13.368 3.957 5.224 1.00 . A A . 45 ASN HD22 1 1 34 21783 1 1 45 ASN N N 10.038 5.226 2.342 1.00 . A A . 45 ASN N 1 1 34 21784 1 1 45 ASN ND2 N 12.414 4.146 5.350 1.00 . A A . 45 ASN ND2 1 1 34 21785 1 1 45 ASN O O 6.962 4.115 3.547 1.00 . A A . 45 ASN O 1 1 34 21786 1 1 45 ASN OD1 O 11.974 3.462 3.257 1.00 . A A . 45 ASN OD1 1 1 34 21787 1 1 46 GLY C C 5.560 6.610 2.971 1.00 . A A . 46 GLY C 1 1 34 21788 1 1 46 GLY CA C 6.546 6.773 4.111 1.00 . A A . 46 GLY CA 1 1 34 21789 1 1 46 GLY H H 8.643 6.724 3.819 1.00 . A A . 46 GLY H 1 1 34 21790 1 1 46 GLY HA2 H 6.689 7.826 4.301 1.00 . A A . 46 GLY HA2 1 1 34 21791 1 1 46 GLY HA3 H 6.136 6.310 4.997 1.00 . A A . 46 GLY HA3 1 1 34 21792 1 1 46 GLY N N 7.834 6.170 3.822 1.00 . A A . 46 GLY N 1 1 34 21793 1 1 46 GLY O O 4.425 6.157 3.228 1.00 . A A . 46 GLY O 1 1 34 21794 1 1 46 GLY OXT O 5.923 6.935 1.821 1.00 . A A . 46 GLY OXT 1 1 35 21795 1 1 1 ALA C C -16.990 -2.173 1.265 1.00 . A A . 1 ALA C 1 1 35 21796 1 1 1 ALA CA C -16.186 -1.362 0.255 1.00 . A A . 1 ALA CA 1 1 35 21797 1 1 1 ALA CB C -17.067 -0.957 -0.917 1.00 . A A . 1 ALA CB 1 1 35 21798 1 1 1 ALA H1 H -14.627 -2.663 0.580 1.00 . A A . 1 ALA H1 1 1 35 21799 1 1 1 ALA H2 H -15.332 -2.766 -0.982 1.00 . A A . 1 ALA H2 1 1 35 21800 1 1 1 ALA H3 H -14.312 -1.446 -0.588 1.00 . A A . 1 ALA H3 1 1 35 21801 1 1 1 ALA HA H -15.832 -0.461 0.735 1.00 . A A . 1 ALA HA 1 1 35 21802 1 1 1 ALA HB1 H -18.092 -0.878 -0.587 1.00 . A A . 1 ALA HB1 1 1 35 21803 1 1 1 ALA HB2 H -16.995 -1.702 -1.696 1.00 . A A . 1 ALA HB2 1 1 35 21804 1 1 1 ALA HB3 H -16.738 -0.002 -1.301 1.00 . A A . 1 ALA HB3 1 1 35 21805 1 1 1 ALA N N -15.008 -2.128 -0.227 1.00 . A A . 1 ALA N 1 1 35 21806 1 1 1 ALA O O -17.033 -1.841 2.450 1.00 . A A . 1 ALA O 1 1 35 21807 1 1 2 MET C C -17.563 -4.772 2.707 1.00 . A A . 2 MET C 1 1 35 21808 1 1 2 MET CA C -18.431 -4.097 1.650 1.00 . A A . 2 MET CA 1 1 35 21809 1 1 2 MET CB C -19.156 -5.155 0.817 1.00 . A A . 2 MET CB 1 1 35 21810 1 1 2 MET CE C -22.412 -4.865 -1.558 1.00 . A A . 2 MET CE 1 1 35 21811 1 1 2 MET CG C -19.931 -4.580 -0.357 1.00 . A A . 2 MET CG 1 1 35 21812 1 1 2 MET H H -17.555 -3.451 -0.166 1.00 . A A . 2 MET H 1 1 35 21813 1 1 2 MET HA H -19.163 -3.478 2.145 1.00 . A A . 2 MET HA 1 1 35 21814 1 1 2 MET HB2 H -18.428 -5.855 0.432 1.00 . A A . 2 MET HB2 1 1 35 21815 1 1 2 MET HB3 H -19.849 -5.685 1.453 1.00 . A A . 2 MET HB3 1 1 35 21816 1 1 2 MET HE1 H -21.791 -4.516 -2.370 1.00 . A A . 2 MET HE1 1 1 35 21817 1 1 2 MET HE2 H -22.485 -5.942 -1.598 1.00 . A A . 2 MET HE2 1 1 35 21818 1 1 2 MET HE3 H -23.398 -4.433 -1.648 1.00 . A A . 2 MET HE3 1 1 35 21819 1 1 2 MET HG2 H -19.514 -3.616 -0.608 1.00 . A A . 2 MET HG2 1 1 35 21820 1 1 2 MET HG3 H -19.827 -5.246 -1.201 1.00 . A A . 2 MET HG3 1 1 35 21821 1 1 2 MET N N -17.627 -3.238 0.788 1.00 . A A . 2 MET N 1 1 35 21822 1 1 2 MET O O -17.702 -4.506 3.901 1.00 . A A . 2 MET O 1 1 35 21823 1 1 2 MET SD S -21.685 -4.373 0.003 1.00 . A A . 2 MET SD 1 1 35 21824 1 1 3 ASP C C -14.335 -6.303 2.672 1.00 . A A . 3 ASP C 1 1 35 21825 1 1 3 ASP CA C -15.776 -6.360 3.167 1.00 . A A . 3 ASP CA 1 1 35 21826 1 1 3 ASP CB C -16.221 -7.816 3.312 1.00 . A A . 3 ASP CB 1 1 35 21827 1 1 3 ASP CG C -17.675 -7.939 3.723 1.00 . A A . 3 ASP CG 1 1 35 21828 1 1 3 ASP H H -16.604 -5.816 1.297 1.00 . A A . 3 ASP H 1 1 35 21829 1 1 3 ASP HA H -15.832 -5.878 4.132 1.00 . A A . 3 ASP HA 1 1 35 21830 1 1 3 ASP HB2 H -16.090 -8.322 2.367 1.00 . A A . 3 ASP HB2 1 1 35 21831 1 1 3 ASP HB3 H -15.611 -8.300 4.061 1.00 . A A . 3 ASP HB3 1 1 35 21832 1 1 3 ASP N N -16.667 -5.646 2.260 1.00 . A A . 3 ASP N 1 1 35 21833 1 1 3 ASP O O -14.085 -6.117 1.481 1.00 . A A . 3 ASP O 1 1 35 21834 1 1 3 ASP OD1 O -18.366 -8.838 3.200 1.00 . A A . 3 ASP OD1 1 1 35 21835 1 1 3 ASP OD2 O -18.122 -7.136 4.569 1.00 . A A . 3 ASP OD2 1 1 35 21836 1 1 4 CYS C C -11.578 -5.072 2.683 1.00 . A A . 4 CYS C 1 1 35 21837 1 1 4 CYS CA C -11.973 -6.431 3.254 1.00 . A A . 4 CYS CA 1 1 35 21838 1 1 4 CYS CB C -11.639 -7.534 2.247 1.00 . A A . 4 CYS CB 1 1 35 21839 1 1 4 CYS H H -13.655 -6.608 4.527 1.00 . A A . 4 CYS H 1 1 35 21840 1 1 4 CYS HA H -11.411 -6.603 4.160 1.00 . A A . 4 CYS HA 1 1 35 21841 1 1 4 CYS HB2 H -12.318 -7.464 1.410 1.00 . A A . 4 CYS HB2 1 1 35 21842 1 1 4 CYS HB3 H -10.628 -7.394 1.895 1.00 . A A . 4 CYS HB3 1 1 35 21843 1 1 4 CYS N N -13.391 -6.463 3.594 1.00 . A A . 4 CYS N 1 1 35 21844 1 1 4 CYS O O -12.374 -4.412 2.015 1.00 . A A . 4 CYS O 1 1 35 21845 1 1 4 CYS SG S -11.766 -9.224 2.919 1.00 . A A . 4 CYS SG 1 1 35 21846 1 1 5 THR C C -9.197 -3.545 1.086 1.00 . A A . 5 THR C 1 1 35 21847 1 1 5 THR CA C -9.836 -3.384 2.462 1.00 . A A . 5 THR CA 1 1 35 21848 1 1 5 THR CB C -8.817 -2.808 3.446 1.00 . A A . 5 THR CB 1 1 35 21849 1 1 5 THR CG2 C -8.750 -1.296 3.421 1.00 . A A . 5 THR CG2 1 1 35 21850 1 1 5 THR H H -9.755 -5.234 3.486 1.00 . A A . 5 THR H 1 1 35 21851 1 1 5 THR HA H -10.670 -2.704 2.381 1.00 . A A . 5 THR HA 1 1 35 21852 1 1 5 THR HB H -7.837 -3.187 3.196 1.00 . A A . 5 THR HB 1 1 35 21853 1 1 5 THR HG1 H -9.962 -2.819 5.035 1.00 . A A . 5 THR HG1 1 1 35 21854 1 1 5 THR HG21 H -9.063 -0.938 2.451 1.00 . A A . 5 THR HG21 1 1 35 21855 1 1 5 THR HG22 H -9.402 -0.894 4.182 1.00 . A A . 5 THR HG22 1 1 35 21856 1 1 5 THR HG23 H -7.735 -0.978 3.611 1.00 . A A . 5 THR HG23 1 1 35 21857 1 1 5 THR N N -10.342 -4.662 2.950 1.00 . A A . 5 THR N 1 1 35 21858 1 1 5 THR O O -8.129 -4.143 0.954 1.00 . A A . 5 THR O 1 1 35 21859 1 1 5 THR OG1 O -9.123 -3.202 4.772 1.00 . A A . 5 THR OG1 1 1 35 21860 1 1 6 THR C C -8.573 -1.837 -1.672 1.00 . A A . 6 THR C 1 1 35 21861 1 1 6 THR CA C -9.349 -3.097 -1.300 1.00 . A A . 6 THR CA 1 1 35 21862 1 1 6 THR CB C -10.500 -3.315 -2.284 1.00 . A A . 6 THR CB 1 1 35 21863 1 1 6 THR CG2 C -10.687 -4.766 -2.671 1.00 . A A . 6 THR CG2 1 1 35 21864 1 1 6 THR H H -10.703 -2.546 0.231 1.00 . A A . 6 THR H 1 1 35 21865 1 1 6 THR HA H -8.680 -3.943 -1.350 1.00 . A A . 6 THR HA 1 1 35 21866 1 1 6 THR HB H -10.302 -2.755 -3.186 1.00 . A A . 6 THR HB 1 1 35 21867 1 1 6 THR HG1 H -11.987 -3.431 -1.014 1.00 . A A . 6 THR HG1 1 1 35 21868 1 1 6 THR HG21 H -9.889 -5.358 -2.245 1.00 . A A . 6 THR HG21 1 1 35 21869 1 1 6 THR HG22 H -11.636 -5.119 -2.298 1.00 . A A . 6 THR HG22 1 1 35 21870 1 1 6 THR HG23 H -10.667 -4.857 -3.747 1.00 . A A . 6 THR HG23 1 1 35 21871 1 1 6 THR N N -9.856 -3.010 0.064 1.00 . A A . 6 THR N 1 1 35 21872 1 1 6 THR O O -8.825 -0.759 -1.134 1.00 . A A . 6 THR O 1 1 35 21873 1 1 6 THR OG1 O -11.723 -2.856 -1.735 1.00 . A A . 6 THR OG1 1 1 35 21874 1 1 7 GLY C C -5.409 -1.250 -3.400 1.00 . A A . 7 GLY C 1 1 35 21875 1 1 7 GLY CA C -6.822 -0.850 -3.015 1.00 . A A . 7 GLY CA 1 1 35 21876 1 1 7 GLY H H -7.466 -2.867 -2.984 1.00 . A A . 7 GLY H 1 1 35 21877 1 1 7 GLY HA2 H -6.775 -0.135 -2.208 1.00 . A A . 7 GLY HA2 1 1 35 21878 1 1 7 GLY HA3 H -7.297 -0.385 -3.867 1.00 . A A . 7 GLY HA3 1 1 35 21879 1 1 7 GLY N N -7.624 -1.982 -2.592 1.00 . A A . 7 GLY N 1 1 35 21880 1 1 7 GLY O O -5.143 -2.424 -3.658 1.00 . A A . 7 GLY O 1 1 35 21881 1 1 8 PRO C C -2.268 -1.163 -2.679 1.00 . A A . 8 PRO C 1 1 35 21882 1 1 8 PRO CA C -3.081 -0.553 -3.821 1.00 . A A . 8 PRO CA 1 1 35 21883 1 1 8 PRO CB C -2.550 0.836 -4.173 1.00 . A A . 8 PRO CB 1 1 35 21884 1 1 8 PRO CD C -4.706 1.145 -3.173 1.00 . A A . 8 PRO CD 1 1 35 21885 1 1 8 PRO CG C -3.339 1.763 -3.315 1.00 . A A . 8 PRO CG 1 1 35 21886 1 1 8 PRO HA H -3.017 -1.194 -4.688 1.00 . A A . 8 PRO HA 1 1 35 21887 1 1 8 PRO HB2 H -1.494 0.889 -3.952 1.00 . A A . 8 PRO HB2 1 1 35 21888 1 1 8 PRO HB3 H -2.714 1.035 -5.223 1.00 . A A . 8 PRO HB3 1 1 35 21889 1 1 8 PRO HD2 H -5.080 1.284 -2.170 1.00 . A A . 8 PRO HD2 1 1 35 21890 1 1 8 PRO HD3 H -5.388 1.572 -3.893 1.00 . A A . 8 PRO HD3 1 1 35 21891 1 1 8 PRO HG2 H -2.868 1.856 -2.347 1.00 . A A . 8 PRO HG2 1 1 35 21892 1 1 8 PRO HG3 H -3.413 2.730 -3.791 1.00 . A A . 8 PRO HG3 1 1 35 21893 1 1 8 PRO N N -4.474 -0.286 -3.454 1.00 . A A . 8 PRO N 1 1 35 21894 1 1 8 PRO O O -1.273 -1.848 -2.917 1.00 . A A . 8 PRO O 1 1 35 21895 1 1 9 CYS C C -2.847 -2.437 0.493 1.00 . A A . 9 CYS C 1 1 35 21896 1 1 9 CYS CA C -1.983 -1.441 -0.275 1.00 . A A . 9 CYS CA 1 1 35 21897 1 1 9 CYS CB C -1.555 -0.305 0.657 1.00 . A A . 9 CYS CB 1 1 35 21898 1 1 9 CYS H H -3.486 -0.357 -1.309 1.00 . A A . 9 CYS H 1 1 35 21899 1 1 9 CYS HA H -1.101 -1.953 -0.629 1.00 . A A . 9 CYS HA 1 1 35 21900 1 1 9 CYS HB2 H -0.916 0.375 0.115 1.00 . A A . 9 CYS HB2 1 1 35 21901 1 1 9 CYS HB3 H -2.433 0.225 0.993 1.00 . A A . 9 CYS HB3 1 1 35 21902 1 1 9 CYS N N -2.689 -0.911 -1.441 1.00 . A A . 9 CYS N 1 1 35 21903 1 1 9 CYS O O -3.282 -2.162 1.610 1.00 . A A . 9 CYS O 1 1 35 21904 1 1 9 CYS SG S -0.645 -0.864 2.134 1.00 . A A . 9 CYS SG 1 1 35 21905 1 1 10 CYS C C -3.422 -6.019 0.093 1.00 . A A . 10 CYS C 1 1 35 21906 1 1 10 CYS CA C -3.893 -4.635 0.524 1.00 . A A . 10 CYS CA 1 1 35 21907 1 1 10 CYS CB C -5.379 -4.464 0.182 1.00 . A A . 10 CYS CB 1 1 35 21908 1 1 10 CYS H H -2.708 -3.758 -0.997 1.00 . A A . 10 CYS H 1 1 35 21909 1 1 10 CYS HA H -3.767 -4.544 1.593 1.00 . A A . 10 CYS HA 1 1 35 21910 1 1 10 CYS HB2 H -5.633 -5.136 -0.623 1.00 . A A . 10 CYS HB2 1 1 35 21911 1 1 10 CYS HB3 H -5.969 -4.717 1.052 1.00 . A A . 10 CYS HB3 1 1 35 21912 1 1 10 CYS N N -3.086 -3.596 -0.109 1.00 . A A . 10 CYS N 1 1 35 21913 1 1 10 CYS O O -3.434 -6.347 -1.094 1.00 . A A . 10 CYS O 1 1 35 21914 1 1 10 CYS SG S -5.855 -2.782 -0.338 1.00 . A A . 10 CYS SG 1 1 35 21915 1 1 11 ARG C C -3.615 -9.000 0.082 1.00 . A A . 11 ARG C 1 1 35 21916 1 1 11 ARG CA C -2.532 -8.178 0.777 1.00 . A A . 11 ARG CA 1 1 35 21917 1 1 11 ARG CB C -2.090 -8.871 2.069 1.00 . A A . 11 ARG CB 1 1 35 21918 1 1 11 ARG CD C 0.214 -9.863 1.919 1.00 . A A . 11 ARG CD 1 1 35 21919 1 1 11 ARG CG C -0.616 -8.680 2.388 1.00 . A A . 11 ARG CG 1 1 35 21920 1 1 11 ARG CZ C 0.587 -11.073 -0.196 1.00 . A A . 11 ARG CZ 1 1 35 21921 1 1 11 ARG H H -3.019 -6.512 1.989 1.00 . A A . 11 ARG H 1 1 35 21922 1 1 11 ARG HA H -1.682 -8.096 0.116 1.00 . A A . 11 ARG HA 1 1 35 21923 1 1 11 ARG HB2 H -2.668 -8.477 2.891 1.00 . A A . 11 ARG HB2 1 1 35 21924 1 1 11 ARG HB3 H -2.282 -9.930 1.980 1.00 . A A . 11 ARG HB3 1 1 35 21925 1 1 11 ARG HD2 H 1.224 -9.746 2.283 1.00 . A A . 11 ARG HD2 1 1 35 21926 1 1 11 ARG HD3 H -0.211 -10.769 2.326 1.00 . A A . 11 ARG HD3 1 1 35 21927 1 1 11 ARG HE H -0.003 -9.171 -0.054 1.00 . A A . 11 ARG HE 1 1 35 21928 1 1 11 ARG HG2 H -0.263 -7.787 1.894 1.00 . A A . 11 ARG HG2 1 1 35 21929 1 1 11 ARG HG3 H -0.501 -8.571 3.457 1.00 . A A . 11 ARG HG3 1 1 35 21930 1 1 11 ARG HH11 H 0.930 -12.170 1.469 1.00 . A A . 11 ARG HH11 1 1 35 21931 1 1 11 ARG HH12 H 1.185 -12.997 -0.031 1.00 . A A . 11 ARG HH12 1 1 35 21932 1 1 11 ARG HH21 H 0.332 -10.258 -2.027 1.00 . A A . 11 ARG HH21 1 1 35 21933 1 1 11 ARG HH22 H 0.846 -11.912 -2.016 1.00 . A A . 11 ARG HH22 1 1 35 21934 1 1 11 ARG N N -3.006 -6.829 1.062 1.00 . A A . 11 ARG N 1 1 35 21935 1 1 11 ARG NE N 0.245 -9.967 0.462 1.00 . A A . 11 ARG NE 1 1 35 21936 1 1 11 ARG NH1 N 0.929 -12.170 0.469 1.00 . A A . 11 ARG NH1 1 1 35 21937 1 1 11 ARG NH2 N 0.589 -11.082 -1.522 1.00 . A A . 11 ARG NH2 1 1 35 21938 1 1 11 ARG O O -3.615 -9.134 -1.141 1.00 . A A . 11 ARG O 1 1 35 21939 1 1 12 GLN C C -6.962 -10.019 0.987 1.00 . A A . 12 GLN C 1 1 35 21940 1 1 12 GLN CA C -5.626 -10.351 0.321 1.00 . A A . 12 GLN CA 1 1 35 21941 1 1 12 GLN CB C -5.318 -11.840 0.492 1.00 . A A . 12 GLN CB 1 1 35 21942 1 1 12 GLN CD C -4.918 -12.754 -1.829 1.00 . A A . 12 GLN CD 1 1 35 21943 1 1 12 GLN CG C -4.295 -12.367 -0.501 1.00 . A A . 12 GLN CG 1 1 35 21944 1 1 12 GLN H H -4.488 -9.406 1.836 1.00 . A A . 12 GLN H 1 1 35 21945 1 1 12 GLN HA H -5.701 -10.130 -0.733 1.00 . A A . 12 GLN HA 1 1 35 21946 1 1 12 GLN HB2 H -4.938 -12.004 1.489 1.00 . A A . 12 GLN HB2 1 1 35 21947 1 1 12 GLN HB3 H -6.232 -12.401 0.367 1.00 . A A . 12 GLN HB3 1 1 35 21948 1 1 12 GLN HE21 H -6.012 -14.153 -0.936 1.00 . A A . 12 GLN HE21 1 1 35 21949 1 1 12 GLN HE22 H -6.227 -14.008 -2.644 1.00 . A A . 12 GLN HE22 1 1 35 21950 1 1 12 GLN HG2 H -3.555 -11.601 -0.678 1.00 . A A . 12 GLN HG2 1 1 35 21951 1 1 12 GLN HG3 H -3.817 -13.238 -0.077 1.00 . A A . 12 GLN HG3 1 1 35 21952 1 1 12 GLN N N -4.539 -9.546 0.868 1.00 . A A . 12 GLN N 1 1 35 21953 1 1 12 GLN NE2 N -5.809 -13.738 -1.800 1.00 . A A . 12 GLN NE2 1 1 35 21954 1 1 12 GLN O O -7.969 -10.676 0.727 1.00 . A A . 12 GLN O 1 1 35 21955 1 1 12 GLN OE1 O -4.601 -12.175 -2.868 1.00 . A A . 12 GLN OE1 1 1 35 21956 1 1 13 CYS C C -7.909 -7.429 3.491 1.00 . A A . 13 CYS C 1 1 35 21957 1 1 13 CYS CA C -8.187 -8.583 2.533 1.00 . A A . 13 CYS CA 1 1 35 21958 1 1 13 CYS CB C -8.798 -9.760 3.302 1.00 . A A . 13 CYS CB 1 1 35 21959 1 1 13 CYS H H -6.141 -8.503 2.006 1.00 . A A . 13 CYS H 1 1 35 21960 1 1 13 CYS HA H -8.892 -8.251 1.786 1.00 . A A . 13 CYS HA 1 1 35 21961 1 1 13 CYS HB2 H -9.091 -10.526 2.601 1.00 . A A . 13 CYS HB2 1 1 35 21962 1 1 13 CYS HB3 H -8.057 -10.162 3.977 1.00 . A A . 13 CYS HB3 1 1 35 21963 1 1 13 CYS N N -6.969 -8.995 1.841 1.00 . A A . 13 CYS N 1 1 35 21964 1 1 13 CYS O O -8.754 -6.556 3.684 1.00 . A A . 13 CYS O 1 1 35 21965 1 1 13 CYS SG S -10.269 -9.323 4.288 1.00 . A A . 13 CYS SG 1 1 35 21966 1 1 14 LYS C C -5.222 -5.527 4.456 1.00 . A A . 14 LYS C 1 1 35 21967 1 1 14 LYS CA C -6.346 -6.378 5.029 1.00 . A A . 14 LYS CA 1 1 35 21968 1 1 14 LYS CB C -5.914 -6.985 6.364 1.00 . A A . 14 LYS CB 1 1 35 21969 1 1 14 LYS CD C -3.843 -7.876 7.473 1.00 . A A . 14 LYS CD 1 1 35 21970 1 1 14 LYS CE C -4.162 -8.994 8.453 1.00 . A A . 14 LYS CE 1 1 35 21971 1 1 14 LYS CG C -4.737 -7.940 6.246 1.00 . A A . 14 LYS CG 1 1 35 21972 1 1 14 LYS H H -6.085 -8.148 3.903 1.00 . A A . 14 LYS H 1 1 35 21973 1 1 14 LYS HA H -7.210 -5.751 5.190 1.00 . A A . 14 LYS HA 1 1 35 21974 1 1 14 LYS HB2 H -5.636 -6.187 7.037 1.00 . A A . 14 LYS HB2 1 1 35 21975 1 1 14 LYS HB3 H -6.747 -7.527 6.787 1.00 . A A . 14 LYS HB3 1 1 35 21976 1 1 14 LYS HD2 H -2.813 -7.968 7.162 1.00 . A A . 14 LYS HD2 1 1 35 21977 1 1 14 LYS HD3 H -3.989 -6.926 7.965 1.00 . A A . 14 LYS HD3 1 1 35 21978 1 1 14 LYS HE2 H -5.009 -8.698 9.054 1.00 . A A . 14 LYS HE2 1 1 35 21979 1 1 14 LYS HE3 H -4.411 -9.884 7.895 1.00 . A A . 14 LYS HE3 1 1 35 21980 1 1 14 LYS HG2 H -5.111 -8.947 6.138 1.00 . A A . 14 LYS HG2 1 1 35 21981 1 1 14 LYS HG3 H -4.157 -7.674 5.374 1.00 . A A . 14 LYS HG3 1 1 35 21982 1 1 14 LYS HZ1 H -2.117 -9.061 8.874 1.00 . A A . 14 LYS HZ1 1 1 35 21983 1 1 14 LYS HZ2 H -3.082 -8.726 10.221 1.00 . A A . 14 LYS HZ2 1 1 35 21984 1 1 14 LYS HZ3 H -3.008 -10.300 9.605 1.00 . A A . 14 LYS HZ3 1 1 35 21985 1 1 14 LYS N N -6.722 -7.428 4.092 1.00 . A A . 14 LYS N 1 1 35 21986 1 1 14 LYS NZ N -3.012 -9.291 9.351 1.00 . A A . 14 LYS NZ 1 1 35 21987 1 1 14 LYS O O -4.309 -6.042 3.809 1.00 . A A . 14 LYS O 1 1 35 21988 1 1 15 LEU C C -2.875 -3.797 4.569 1.00 . A A . 15 LEU C 1 1 35 21989 1 1 15 LEU CA C -4.272 -3.305 4.199 1.00 . A A . 15 LEU CA 1 1 35 21990 1 1 15 LEU CB C -4.506 -1.897 4.755 1.00 . A A . 15 LEU CB 1 1 35 21991 1 1 15 LEU CD1 C -2.697 -1.045 6.265 1.00 . A A . 15 LEU CD1 1 1 35 21992 1 1 15 LEU CD2 C -5.094 -0.841 6.953 1.00 . A A . 15 LEU CD2 1 1 35 21993 1 1 15 LEU CG C -4.074 -1.689 6.208 1.00 . A A . 15 LEU CG 1 1 35 21994 1 1 15 LEU H H -6.040 -3.868 5.217 1.00 . A A . 15 LEU H 1 1 35 21995 1 1 15 LEU HA H -4.355 -3.275 3.123 1.00 . A A . 15 LEU HA 1 1 35 21996 1 1 15 LEU HB2 H -3.965 -1.196 4.136 1.00 . A A . 15 LEU HB2 1 1 35 21997 1 1 15 LEU HB3 H -5.560 -1.676 4.681 1.00 . A A . 15 LEU HB3 1 1 35 21998 1 1 15 LEU HD11 H -2.187 -1.201 5.325 1.00 . A A . 15 LEU HD11 1 1 35 21999 1 1 15 LEU HD12 H -2.803 0.015 6.446 1.00 . A A . 15 LEU HD12 1 1 35 22000 1 1 15 LEU HD13 H -2.124 -1.491 7.064 1.00 . A A . 15 LEU HD13 1 1 35 22001 1 1 15 LEU HD21 H -6.050 -0.907 6.454 1.00 . A A . 15 LEU HD21 1 1 35 22002 1 1 15 LEU HD22 H -5.191 -1.201 7.966 1.00 . A A . 15 LEU HD22 1 1 35 22003 1 1 15 LEU HD23 H -4.766 0.188 6.966 1.00 . A A . 15 LEU HD23 1 1 35 22004 1 1 15 LEU HG H -4.013 -2.649 6.700 1.00 . A A . 15 LEU HG 1 1 35 22005 1 1 15 LEU N N -5.290 -4.222 4.695 1.00 . A A . 15 LEU N 1 1 35 22006 1 1 15 LEU O O -2.598 -4.092 5.731 1.00 . A A . 15 LEU O 1 1 35 22007 1 1 16 LYS C C 0.006 -3.667 4.991 1.00 . A A . 16 LYS C 1 1 35 22008 1 1 16 LYS CA C -0.637 -4.365 3.789 1.00 . A A . 16 LYS CA 1 1 35 22009 1 1 16 LYS CB C 0.210 -4.136 2.534 1.00 . A A . 16 LYS CB 1 1 35 22010 1 1 16 LYS CD C 1.746 -5.209 0.860 1.00 . A A . 16 LYS CD 1 1 35 22011 1 1 16 LYS CE C 1.574 -6.003 -0.425 1.00 . A A . 16 LYS CE 1 1 35 22012 1 1 16 LYS CG C 0.575 -5.419 1.806 1.00 . A A . 16 LYS CG 1 1 35 22013 1 1 16 LYS H H -2.284 -3.653 2.664 1.00 . A A . 16 LYS H 1 1 35 22014 1 1 16 LYS HA H -0.687 -5.426 3.989 1.00 . A A . 16 LYS HA 1 1 35 22015 1 1 16 LYS HB2 H -0.342 -3.506 1.852 1.00 . A A . 16 LYS HB2 1 1 35 22016 1 1 16 LYS HB3 H 1.124 -3.634 2.814 1.00 . A A . 16 LYS HB3 1 1 35 22017 1 1 16 LYS HD2 H 1.816 -4.160 0.617 1.00 . A A . 16 LYS HD2 1 1 35 22018 1 1 16 LYS HD3 H 2.654 -5.528 1.351 1.00 . A A . 16 LYS HD3 1 1 35 22019 1 1 16 LYS HE2 H 1.642 -7.056 -0.195 1.00 . A A . 16 LYS HE2 1 1 35 22020 1 1 16 LYS HE3 H 0.599 -5.787 -0.838 1.00 . A A . 16 LYS HE3 1 1 35 22021 1 1 16 LYS HG2 H 0.843 -6.171 2.533 1.00 . A A . 16 LYS HG2 1 1 35 22022 1 1 16 LYS HG3 H -0.280 -5.755 1.237 1.00 . A A . 16 LYS HG3 1 1 35 22023 1 1 16 LYS HZ1 H 2.973 -4.699 -1.265 1.00 . A A . 16 LYS HZ1 1 1 35 22024 1 1 16 LYS HZ2 H 3.408 -6.330 -1.369 1.00 . A A . 16 LYS HZ2 1 1 35 22025 1 1 16 LYS HZ3 H 2.212 -5.705 -2.391 1.00 . A A . 16 LYS HZ3 1 1 35 22026 1 1 16 LYS N N -2.002 -3.895 3.571 1.00 . A A . 16 LYS N 1 1 35 22027 1 1 16 LYS NZ N 2.615 -5.660 -1.433 1.00 . A A . 16 LYS NZ 1 1 35 22028 1 1 16 LYS O O -0.449 -2.608 5.421 1.00 . A A . 16 LYS O 1 1 35 22029 1 1 17 PRO C C 2.645 -2.504 6.363 1.00 . A A . 17 PRO C 1 1 35 22030 1 1 17 PRO CA C 1.776 -3.705 6.713 1.00 . A A . 17 PRO CA 1 1 35 22031 1 1 17 PRO CB C 2.651 -4.865 7.183 1.00 . A A . 17 PRO CB 1 1 35 22032 1 1 17 PRO CD C 1.671 -5.536 5.103 1.00 . A A . 17 PRO CD 1 1 35 22033 1 1 17 PRO CG C 2.905 -5.668 5.954 1.00 . A A . 17 PRO CG 1 1 35 22034 1 1 17 PRO HA H 1.089 -3.429 7.499 1.00 . A A . 17 PRO HA 1 1 35 22035 1 1 17 PRO HB2 H 3.570 -4.478 7.599 1.00 . A A . 17 PRO HB2 1 1 35 22036 1 1 17 PRO HB3 H 2.124 -5.441 7.929 1.00 . A A . 17 PRO HB3 1 1 35 22037 1 1 17 PRO HD2 H 1.938 -5.487 4.058 1.00 . A A . 17 PRO HD2 1 1 35 22038 1 1 17 PRO HD3 H 0.999 -6.362 5.283 1.00 . A A . 17 PRO HD3 1 1 35 22039 1 1 17 PRO HG2 H 3.765 -5.276 5.431 1.00 . A A . 17 PRO HG2 1 1 35 22040 1 1 17 PRO HG3 H 3.068 -6.703 6.219 1.00 . A A . 17 PRO HG3 1 1 35 22041 1 1 17 PRO N N 1.073 -4.263 5.552 1.00 . A A . 17 PRO N 1 1 35 22042 1 1 17 PRO O O 3.137 -2.382 5.241 1.00 . A A . 17 PRO O 1 1 35 22043 1 1 18 ALA C C 5.072 -0.803 6.742 1.00 . A A . 18 ALA C 1 1 35 22044 1 1 18 ALA CA C 3.653 -0.433 7.156 1.00 . A A . 18 ALA CA 1 1 35 22045 1 1 18 ALA CB C 3.676 0.393 8.433 1.00 . A A . 18 ALA CB 1 1 35 22046 1 1 18 ALA H H 2.418 -1.786 8.211 1.00 . A A . 18 ALA H 1 1 35 22047 1 1 18 ALA HA H 3.205 0.164 6.375 1.00 . A A . 18 ALA HA 1 1 35 22048 1 1 18 ALA HB1 H 4.409 -0.015 9.113 1.00 . A A . 18 ALA HB1 1 1 35 22049 1 1 18 ALA HB2 H 2.701 0.367 8.896 1.00 . A A . 18 ALA HB2 1 1 35 22050 1 1 18 ALA HB3 H 3.935 1.415 8.197 1.00 . A A . 18 ALA HB3 1 1 35 22051 1 1 18 ALA N N 2.835 -1.625 7.340 1.00 . A A . 18 ALA N 1 1 35 22052 1 1 18 ALA O O 5.475 -1.962 6.840 1.00 . A A . 18 ALA O 1 1 35 22053 1 1 19 GLY C C 7.278 -1.091 4.744 1.00 . A A . 19 GLY C 1 1 35 22054 1 1 19 GLY CA C 7.190 -0.058 5.852 1.00 . A A . 19 GLY CA 1 1 35 22055 1 1 19 GLY H H 5.450 1.091 6.219 1.00 . A A . 19 GLY H 1 1 35 22056 1 1 19 GLY HA2 H 7.762 -0.405 6.699 1.00 . A A . 19 GLY HA2 1 1 35 22057 1 1 19 GLY HA3 H 7.617 0.869 5.499 1.00 . A A . 19 GLY HA3 1 1 35 22058 1 1 19 GLY N N 5.825 0.187 6.277 1.00 . A A . 19 GLY N 1 1 35 22059 1 1 19 GLY O O 8.345 -1.653 4.496 1.00 . A A . 19 GLY O 1 1 35 22060 1 1 20 THR C C 5.542 -1.679 1.725 1.00 . A A . 20 THR C 1 1 35 22061 1 1 20 THR CA C 6.115 -2.311 2.988 1.00 . A A . 20 THR CA 1 1 35 22062 1 1 20 THR CB C 5.276 -3.525 3.390 1.00 . A A . 20 THR CB 1 1 35 22063 1 1 20 THR CG2 C 5.314 -4.644 2.373 1.00 . A A . 20 THR CG2 1 1 35 22064 1 1 20 THR H H 5.336 -0.860 4.314 1.00 . A A . 20 THR H 1 1 35 22065 1 1 20 THR HA H 7.126 -2.632 2.790 1.00 . A A . 20 THR HA 1 1 35 22066 1 1 20 THR HB H 4.246 -3.216 3.503 1.00 . A A . 20 THR HB 1 1 35 22067 1 1 20 THR HG1 H 5.543 -3.420 5.328 1.00 . A A . 20 THR HG1 1 1 35 22068 1 1 20 THR HG21 H 5.555 -4.239 1.401 1.00 . A A . 20 THR HG21 1 1 35 22069 1 1 20 THR HG22 H 6.066 -5.364 2.658 1.00 . A A . 20 THR HG22 1 1 35 22070 1 1 20 THR HG23 H 4.349 -5.127 2.333 1.00 . A A . 20 THR HG23 1 1 35 22071 1 1 20 THR N N 6.156 -1.340 4.074 1.00 . A A . 20 THR N 1 1 35 22072 1 1 20 THR O O 4.372 -1.299 1.685 1.00 . A A . 20 THR O 1 1 35 22073 1 1 20 THR OG1 O 5.719 -4.053 4.627 1.00 . A A . 20 THR OG1 1 1 35 22074 1 1 21 THR C C 4.642 -1.597 -1.052 1.00 . A A . 21 THR C 1 1 35 22075 1 1 21 THR CA C 5.950 -0.977 -0.572 1.00 . A A . 21 THR CA 1 1 35 22076 1 1 21 THR CB C 7.036 -1.158 -1.630 1.00 . A A . 21 THR CB 1 1 35 22077 1 1 21 THR CG2 C 7.266 -2.603 -2.001 1.00 . A A . 21 THR CG2 1 1 35 22078 1 1 21 THR H H 7.296 -1.886 0.787 1.00 . A A . 21 THR H 1 1 35 22079 1 1 21 THR HA H 5.793 0.076 -0.409 1.00 . A A . 21 THR HA 1 1 35 22080 1 1 21 THR HB H 7.966 -0.761 -1.249 1.00 . A A . 21 THR HB 1 1 35 22081 1 1 21 THR HG1 H 7.049 0.440 -2.763 1.00 . A A . 21 THR HG1 1 1 35 22082 1 1 21 THR HG21 H 6.774 -3.239 -1.280 1.00 . A A . 21 THR HG21 1 1 35 22083 1 1 21 THR HG22 H 6.860 -2.791 -2.983 1.00 . A A . 21 THR HG22 1 1 35 22084 1 1 21 THR HG23 H 8.326 -2.811 -2.002 1.00 . A A . 21 THR HG23 1 1 35 22085 1 1 21 THR N N 6.375 -1.567 0.694 1.00 . A A . 21 THR N 1 1 35 22086 1 1 21 THR O O 4.580 -2.787 -1.359 1.00 . A A . 21 THR O 1 1 35 22087 1 1 21 THR OG1 O 6.705 -0.455 -2.814 1.00 . A A . 21 THR OG1 1 1 35 22088 1 1 22 CYS C C 2.122 -1.082 -3.051 1.00 . A A . 22 CYS C 1 1 35 22089 1 1 22 CYS CA C 2.288 -1.239 -1.545 1.00 . A A . 22 CYS CA 1 1 35 22090 1 1 22 CYS CB C 1.185 -0.467 -0.821 1.00 . A A . 22 CYS CB 1 1 35 22091 1 1 22 CYS H H 3.715 0.158 -0.847 1.00 . A A . 22 CYS H 1 1 35 22092 1 1 22 CYS HA H 2.205 -2.286 -1.294 1.00 . A A . 22 CYS HA 1 1 35 22093 1 1 22 CYS HB2 H 0.236 -0.698 -1.278 1.00 . A A . 22 CYS HB2 1 1 35 22094 1 1 22 CYS HB3 H 1.164 -0.774 0.214 1.00 . A A . 22 CYS HB3 1 1 35 22095 1 1 22 CYS N N 3.600 -0.778 -1.109 1.00 . A A . 22 CYS N 1 1 35 22096 1 1 22 CYS O O 1.404 -1.851 -3.689 1.00 . A A . 22 CYS O 1 1 35 22097 1 1 22 CYS SG S 1.388 1.345 -0.859 1.00 . A A . 22 CYS SG 1 1 35 22098 1 1 23 TRP C C 3.878 -0.428 -5.788 1.00 . A A . 23 TRP C 1 1 35 22099 1 1 23 TRP CA C 2.694 0.177 -5.044 1.00 . A A . 23 TRP CA 1 1 35 22100 1 1 23 TRP CB C 2.613 1.682 -5.314 1.00 . A A . 23 TRP CB 1 1 35 22101 1 1 23 TRP CD1 C 0.964 1.174 -7.202 1.00 . A A . 23 TRP CD1 1 1 35 22102 1 1 23 TRP CD2 C 1.208 3.351 -6.761 1.00 . A A . 23 TRP CD2 1 1 35 22103 1 1 23 TRP CE2 C 0.281 3.207 -7.809 1.00 . A A . 23 TRP CE2 1 1 35 22104 1 1 23 TRP CE3 C 1.522 4.634 -6.311 1.00 . A A . 23 TRP CE3 1 1 35 22105 1 1 23 TRP CG C 1.631 2.038 -6.386 1.00 . A A . 23 TRP CG 1 1 35 22106 1 1 23 TRP CH2 C -0.009 5.543 -7.953 1.00 . A A . 23 TRP CH2 1 1 35 22107 1 1 23 TRP CZ2 C -0.335 4.297 -8.413 1.00 . A A . 23 TRP CZ2 1 1 35 22108 1 1 23 TRP CZ3 C 0.911 5.718 -6.912 1.00 . A A . 23 TRP CZ3 1 1 35 22109 1 1 23 TRP H H 3.335 0.507 -3.055 1.00 . A A . 23 TRP H 1 1 35 22110 1 1 23 TRP HA H 1.793 -0.288 -5.402 1.00 . A A . 23 TRP HA 1 1 35 22111 1 1 23 TRP HB2 H 2.314 2.188 -4.408 1.00 . A A . 23 TRP HB2 1 1 35 22112 1 1 23 TRP HB3 H 3.584 2.043 -5.618 1.00 . A A . 23 TRP HB3 1 1 35 22113 1 1 23 TRP HD1 H 1.073 0.102 -7.165 1.00 . A A . 23 TRP HD1 1 1 35 22114 1 1 23 TRP HE1 H -0.432 1.470 -8.742 1.00 . A A . 23 TRP HE1 1 1 35 22115 1 1 23 TRP HE3 H 2.228 4.785 -5.510 1.00 . A A . 23 TRP HE3 1 1 35 22116 1 1 23 TRP HH2 H -0.461 6.416 -8.396 1.00 . A A . 23 TRP HH2 1 1 35 22117 1 1 23 TRP HZ2 H -1.048 4.178 -9.213 1.00 . A A . 23 TRP HZ2 1 1 35 22118 1 1 23 TRP HZ3 H 1.142 6.719 -6.578 1.00 . A A . 23 TRP HZ3 1 1 35 22119 1 1 23 TRP N N 2.782 -0.077 -3.614 1.00 . A A . 23 TRP N 1 1 35 22120 1 1 23 TRP NE1 N 0.149 1.868 -8.061 1.00 . A A . 23 TRP NE1 1 1 35 22121 1 1 23 TRP O O 3.748 -1.456 -6.452 1.00 . A A . 23 TRP O 1 1 35 22122 1 1 24 LYS C C 6.046 -0.319 -7.847 1.00 . A A . 24 LYS C 1 1 35 22123 1 1 24 LYS CA C 6.239 -0.254 -6.335 1.00 . A A . 24 LYS CA 1 1 35 22124 1 1 24 LYS CB C 6.626 -1.629 -5.797 1.00 . A A . 24 LYS CB 1 1 35 22125 1 1 24 LYS CD C 9.011 -2.063 -5.125 1.00 . A A . 24 LYS CD 1 1 35 22126 1 1 24 LYS CE C 10.051 -3.161 -5.273 1.00 . A A . 24 LYS CE 1 1 35 22127 1 1 24 LYS CG C 7.997 -2.100 -6.258 1.00 . A A . 24 LYS CG 1 1 35 22128 1 1 24 LYS H H 5.067 1.028 -5.131 1.00 . A A . 24 LYS H 1 1 35 22129 1 1 24 LYS HA H 7.032 0.444 -6.114 1.00 . A A . 24 LYS HA 1 1 35 22130 1 1 24 LYS HB2 H 6.624 -1.590 -4.718 1.00 . A A . 24 LYS HB2 1 1 35 22131 1 1 24 LYS HB3 H 5.892 -2.349 -6.124 1.00 . A A . 24 LYS HB3 1 1 35 22132 1 1 24 LYS HD2 H 9.510 -1.105 -5.133 1.00 . A A . 24 LYS HD2 1 1 35 22133 1 1 24 LYS HD3 H 8.492 -2.194 -4.186 1.00 . A A . 24 LYS HD3 1 1 35 22134 1 1 24 LYS HE2 H 9.635 -4.086 -4.903 1.00 . A A . 24 LYS HE2 1 1 35 22135 1 1 24 LYS HE3 H 10.295 -3.270 -6.319 1.00 . A A . 24 LYS HE3 1 1 35 22136 1 1 24 LYS HG2 H 7.915 -3.114 -6.620 1.00 . A A . 24 LYS HG2 1 1 35 22137 1 1 24 LYS HG3 H 8.338 -1.457 -7.056 1.00 . A A . 24 LYS HG3 1 1 35 22138 1 1 24 LYS HZ1 H 11.057 -2.497 -3.566 1.00 . A A . 24 LYS HZ1 1 1 35 22139 1 1 24 LYS HZ2 H 11.874 -3.712 -4.414 1.00 . A A . 24 LYS HZ2 1 1 35 22140 1 1 24 LYS HZ3 H 11.850 -2.132 -5.015 1.00 . A A . 24 LYS HZ3 1 1 35 22141 1 1 24 LYS N N 5.030 0.217 -5.674 1.00 . A A . 24 LYS N 1 1 35 22142 1 1 24 LYS NZ N 11.295 -2.854 -4.514 1.00 . A A . 24 LYS NZ 1 1 35 22143 1 1 24 LYS O O 6.688 -1.118 -8.529 1.00 . A A . 24 LYS O 1 1 35 22144 1 1 25 THR C C 6.186 0.796 -10.581 1.00 . A A . 25 THR C 1 1 35 22145 1 1 25 THR CA C 4.893 0.565 -9.801 1.00 . A A . 25 THR CA 1 1 35 22146 1 1 25 THR CB C 3.876 1.662 -10.127 1.00 . A A . 25 THR CB 1 1 35 22147 1 1 25 THR CG2 C 4.311 3.033 -9.666 1.00 . A A . 25 THR CG2 1 1 35 22148 1 1 25 THR H H 4.682 1.145 -7.775 1.00 . A A . 25 THR H 1 1 35 22149 1 1 25 THR HA H 4.482 -0.392 -10.085 1.00 . A A . 25 THR HA 1 1 35 22150 1 1 25 THR HB H 2.940 1.431 -9.638 1.00 . A A . 25 THR HB 1 1 35 22151 1 1 25 THR HG1 H 3.040 1.031 -11.783 1.00 . A A . 25 THR HG1 1 1 35 22152 1 1 25 THR HG21 H 5.342 2.993 -9.353 1.00 . A A . 25 THR HG21 1 1 35 22153 1 1 25 THR HG22 H 4.208 3.737 -10.479 1.00 . A A . 25 THR HG22 1 1 35 22154 1 1 25 THR HG23 H 3.695 3.347 -8.837 1.00 . A A . 25 THR HG23 1 1 35 22155 1 1 25 THR N N 5.161 0.529 -8.368 1.00 . A A . 25 THR N 1 1 35 22156 1 1 25 THR O O 7.221 1.119 -9.999 1.00 . A A . 25 THR O 1 1 35 22157 1 1 25 THR OG1 O 3.643 1.732 -11.523 1.00 . A A . 25 THR OG1 1 1 35 22158 1 1 26 SER C C 7.433 2.253 -13.202 1.00 . A A . 26 SER C 1 1 35 22159 1 1 26 SER CA C 7.297 0.803 -12.745 1.00 . A A . 26 SER CA 1 1 35 22160 1 1 26 SER CB C 7.217 -0.123 -13.961 1.00 . A A . 26 SER CB 1 1 35 22161 1 1 26 SER H H 5.273 0.357 -12.305 1.00 . A A . 26 SER H 1 1 35 22162 1 1 26 SER HA H 8.167 0.540 -12.164 1.00 . A A . 26 SER HA 1 1 35 22163 1 1 26 SER HB2 H 6.590 -0.970 -13.726 1.00 . A A . 26 SER HB2 1 1 35 22164 1 1 26 SER HB3 H 6.794 0.417 -14.795 1.00 . A A . 26 SER HB3 1 1 35 22165 1 1 26 SER HG H 8.412 -1.287 -14.988 1.00 . A A . 26 SER HG 1 1 35 22166 1 1 26 SER N N 6.124 0.621 -11.897 1.00 . A A . 26 SER N 1 1 35 22167 1 1 26 SER O O 7.474 2.534 -14.400 1.00 . A A . 26 SER O 1 1 35 22168 1 1 26 SER OG O 8.502 -0.596 -14.328 1.00 . A A . 26 SER OG 1 1 35 22169 1 1 27 VAL C C 7.647 5.442 -11.281 1.00 . A A . 27 VAL C 1 1 35 22170 1 1 27 VAL CA C 7.650 4.592 -12.550 1.00 . A A . 27 VAL CA 1 1 35 22171 1 1 27 VAL CB C 6.521 5.081 -13.482 1.00 . A A . 27 VAL CB 1 1 35 22172 1 1 27 VAL CG1 C 5.162 4.890 -12.825 1.00 . A A . 27 VAL CG1 1 1 35 22173 1 1 27 VAL CG2 C 6.735 6.538 -13.867 1.00 . A A . 27 VAL CG2 1 1 35 22174 1 1 27 VAL H H 7.479 2.886 -11.304 1.00 . A A . 27 VAL H 1 1 35 22175 1 1 27 VAL HA H 8.592 4.730 -13.059 1.00 . A A . 27 VAL HA 1 1 35 22176 1 1 27 VAL HB H 6.543 4.488 -14.384 1.00 . A A . 27 VAL HB 1 1 35 22177 1 1 27 VAL HG11 H 5.040 3.853 -12.546 1.00 . A A . 27 VAL HG11 1 1 35 22178 1 1 27 VAL HG12 H 5.098 5.510 -11.943 1.00 . A A . 27 VAL HG12 1 1 35 22179 1 1 27 VAL HG13 H 4.384 5.170 -13.519 1.00 . A A . 27 VAL HG13 1 1 35 22180 1 1 27 VAL HG21 H 7.793 6.750 -13.900 1.00 . A A . 27 VAL HG21 1 1 35 22181 1 1 27 VAL HG22 H 6.300 6.721 -14.838 1.00 . A A . 27 VAL HG22 1 1 35 22182 1 1 27 VAL HG23 H 6.263 7.177 -13.135 1.00 . A A . 27 VAL HG23 1 1 35 22183 1 1 27 VAL N N 7.511 3.171 -12.241 1.00 . A A . 27 VAL N 1 1 35 22184 1 1 27 VAL O O 8.335 6.459 -11.203 1.00 . A A . 27 VAL O 1 1 35 22185 1 1 28 SER C C 7.395 4.983 -7.886 1.00 . A A . 28 SER C 1 1 35 22186 1 1 28 SER CA C 6.755 5.755 -9.038 1.00 . A A . 28 SER CA 1 1 35 22187 1 1 28 SER CB C 5.285 6.049 -8.722 1.00 . A A . 28 SER CB 1 1 35 22188 1 1 28 SER H H 6.329 4.214 -10.425 1.00 . A A . 28 SER H 1 1 35 22189 1 1 28 SER HA H 7.277 6.690 -9.156 1.00 . A A . 28 SER HA 1 1 35 22190 1 1 28 SER HB2 H 4.659 5.600 -9.479 1.00 . A A . 28 SER HB2 1 1 35 22191 1 1 28 SER HB3 H 5.033 5.633 -7.757 1.00 . A A . 28 SER HB3 1 1 35 22192 1 1 28 SER HG H 4.797 7.744 -9.575 1.00 . A A . 28 SER HG 1 1 35 22193 1 1 28 SER N N 6.859 5.025 -10.297 1.00 . A A . 28 SER N 1 1 35 22194 1 1 28 SER O O 8.515 5.282 -7.472 1.00 . A A . 28 SER O 1 1 35 22195 1 1 28 SER OG O 5.038 7.444 -8.695 1.00 . A A . 28 SER OG 1 1 35 22196 1 1 29 SER C C 6.966 3.928 -4.932 1.00 . A A . 29 SER C 1 1 35 22197 1 1 29 SER CA C 7.141 3.181 -6.248 1.00 . A A . 29 SER CA 1 1 35 22198 1 1 29 SER CB C 8.608 2.783 -6.441 1.00 . A A . 29 SER CB 1 1 35 22199 1 1 29 SER H H 5.779 3.823 -7.735 1.00 . A A . 29 SER H 1 1 35 22200 1 1 29 SER HA H 6.534 2.289 -6.218 1.00 . A A . 29 SER HA 1 1 35 22201 1 1 29 SER HB2 H 9.245 3.574 -6.075 1.00 . A A . 29 SER HB2 1 1 35 22202 1 1 29 SER HB3 H 8.808 1.876 -5.888 1.00 . A A . 29 SER HB3 1 1 35 22203 1 1 29 SER HG H 9.121 1.633 -7.942 1.00 . A A . 29 SER HG 1 1 35 22204 1 1 29 SER N N 6.667 3.998 -7.365 1.00 . A A . 29 SER N 1 1 35 22205 1 1 29 SER O O 7.517 5.012 -4.742 1.00 . A A . 29 SER O 1 1 35 22206 1 1 29 SER OG O 8.901 2.558 -7.809 1.00 . A A . 29 SER OG 1 1 35 22207 1 1 30 HIS C C 6.001 2.964 -1.601 1.00 . A A . 30 HIS C 1 1 35 22208 1 1 30 HIS CA C 5.905 3.971 -2.743 1.00 . A A . 30 HIS CA 1 1 35 22209 1 1 30 HIS CB C 4.512 4.601 -2.761 1.00 . A A . 30 HIS CB 1 1 35 22210 1 1 30 HIS CD2 C 4.481 5.523 -5.182 1.00 . A A . 30 HIS CD2 1 1 35 22211 1 1 30 HIS CE1 C 3.902 7.589 -4.732 1.00 . A A . 30 HIS CE1 1 1 35 22212 1 1 30 HIS CG C 4.338 5.623 -3.840 1.00 . A A . 30 HIS CG 1 1 35 22213 1 1 30 HIS H H 5.752 2.494 -4.247 1.00 . A A . 30 HIS H 1 1 35 22214 1 1 30 HIS HA H 6.638 4.748 -2.587 1.00 . A A . 30 HIS HA 1 1 35 22215 1 1 30 HIS HB2 H 3.776 3.824 -2.921 1.00 . A A . 30 HIS HB2 1 1 35 22216 1 1 30 HIS HB3 H 4.326 5.080 -1.812 1.00 . A A . 30 HIS HB3 1 1 35 22217 1 1 30 HIS HD1 H 3.797 7.314 -2.707 1.00 . A A . 30 HIS HD1 1 1 35 22218 1 1 30 HIS HD2 H 4.756 4.633 -5.733 1.00 . A A . 30 HIS HD2 1 1 35 22219 1 1 30 HIS HE1 H 3.640 8.631 -4.843 1.00 . A A . 30 HIS HE1 1 1 35 22220 1 1 30 HIS HE2 H 4.106 6.959 -6.667 1.00 . A A . 30 HIS HE2 1 1 35 22221 1 1 30 HIS N N 6.176 3.350 -4.032 1.00 . A A . 30 HIS N 1 1 35 22222 1 1 30 HIS ND1 N 3.976 6.929 -3.590 1.00 . A A . 30 HIS ND1 1 1 35 22223 1 1 30 HIS NE2 N 4.205 6.760 -5.713 1.00 . A A . 30 HIS NE2 1 1 35 22224 1 1 30 HIS O O 6.137 1.761 -1.826 1.00 . A A . 30 HIS O 1 1 35 22225 1 1 31 TYR C C 4.736 2.827 1.670 1.00 . A A . 31 TYR C 1 1 35 22226 1 1 31 TYR CA C 5.984 2.631 0.816 1.00 . A A . 31 TYR CA 1 1 35 22227 1 1 31 TYR CB C 7.237 2.960 1.631 1.00 . A A . 31 TYR CB 1 1 35 22228 1 1 31 TYR CD1 C 8.658 1.454 0.186 1.00 . A A . 31 TYR CD1 1 1 35 22229 1 1 31 TYR CD2 C 9.124 1.539 2.522 1.00 . A A . 31 TYR CD2 1 1 35 22230 1 1 31 TYR CE1 C 9.684 0.545 0.010 1.00 . A A . 31 TYR CE1 1 1 35 22231 1 1 31 TYR CE2 C 10.152 0.630 2.354 1.00 . A A . 31 TYR CE2 1 1 35 22232 1 1 31 TYR CG C 8.361 1.966 1.443 1.00 . A A . 31 TYR CG 1 1 35 22233 1 1 31 TYR CZ C 10.427 0.136 1.097 1.00 . A A . 31 TYR CZ 1 1 35 22234 1 1 31 TYR H H 5.804 4.439 -0.267 1.00 . A A . 31 TYR H 1 1 35 22235 1 1 31 TYR HA H 6.031 1.604 0.497 1.00 . A A . 31 TYR HA 1 1 35 22236 1 1 31 TYR HB2 H 7.604 3.933 1.339 1.00 . A A . 31 TYR HB2 1 1 35 22237 1 1 31 TYR HB3 H 6.982 2.979 2.681 1.00 . A A . 31 TYR HB3 1 1 35 22238 1 1 31 TYR HD1 H 8.075 1.777 -0.664 1.00 . A A . 31 TYR HD1 1 1 35 22239 1 1 31 TYR HD2 H 8.905 1.926 3.506 1.00 . A A . 31 TYR HD2 1 1 35 22240 1 1 31 TYR HE1 H 9.900 0.159 -0.975 1.00 . A A . 31 TYR HE1 1 1 35 22241 1 1 31 TYR HE2 H 10.734 0.310 3.206 1.00 . A A . 31 TYR HE2 1 1 35 22242 1 1 31 TYR HH H 12.287 -0.302 0.883 1.00 . A A . 31 TYR HH 1 1 35 22243 1 1 31 TYR N N 5.919 3.471 -0.374 1.00 . A A . 31 TYR N 1 1 35 22244 1 1 31 TYR O O 4.389 3.955 2.022 1.00 . A A . 31 TYR O 1 1 35 22245 1 1 31 TYR OH O 11.450 -0.769 0.926 1.00 . A A . 31 TYR OH 1 1 35 22246 1 1 32 CYS C C 3.176 2.017 4.273 1.00 . A A . 32 CYS C 1 1 35 22247 1 1 32 CYS CA C 2.846 1.810 2.802 1.00 . A A . 32 CYS CA 1 1 35 22248 1 1 32 CYS CB C 1.998 0.550 2.629 1.00 . A A . 32 CYS CB 1 1 35 22249 1 1 32 CYS H H 4.373 0.855 1.687 1.00 . A A . 32 CYS H 1 1 35 22250 1 1 32 CYS HA H 2.279 2.659 2.455 1.00 . A A . 32 CYS HA 1 1 35 22251 1 1 32 CYS HB2 H 2.150 0.156 1.636 1.00 . A A . 32 CYS HB2 1 1 35 22252 1 1 32 CYS HB3 H 2.308 -0.187 3.355 1.00 . A A . 32 CYS HB3 1 1 35 22253 1 1 32 CYS N N 4.057 1.731 1.997 1.00 . A A . 32 CYS N 1 1 35 22254 1 1 32 CYS O O 4.248 1.634 4.743 1.00 . A A . 32 CYS O 1 1 35 22255 1 1 32 CYS SG S 0.211 0.831 2.849 1.00 . A A . 32 CYS SG 1 1 35 22256 1 1 33 THR C C 1.490 1.996 7.241 1.00 . A A . 33 THR C 1 1 35 22257 1 1 33 THR CA C 2.417 2.883 6.417 1.00 . A A . 33 THR CA 1 1 35 22258 1 1 33 THR CB C 2.145 4.357 6.727 1.00 . A A . 33 THR CB 1 1 35 22259 1 1 33 THR CG2 C 2.680 5.303 5.672 1.00 . A A . 33 THR CG2 1 1 35 22260 1 1 33 THR H H 1.408 2.898 4.561 1.00 . A A . 33 THR H 1 1 35 22261 1 1 33 THR HA H 3.441 2.652 6.673 1.00 . A A . 33 THR HA 1 1 35 22262 1 1 33 THR HB H 2.616 4.609 7.666 1.00 . A A . 33 THR HB 1 1 35 22263 1 1 33 THR HG1 H 0.329 4.460 6.000 1.00 . A A . 33 THR HG1 1 1 35 22264 1 1 33 THR HG21 H 3.741 5.143 5.549 1.00 . A A . 33 THR HG21 1 1 35 22265 1 1 33 THR HG22 H 2.177 5.117 4.734 1.00 . A A . 33 THR HG22 1 1 35 22266 1 1 33 THR HG23 H 2.503 6.323 5.979 1.00 . A A . 33 THR HG23 1 1 35 22267 1 1 33 THR N N 2.241 2.623 4.995 1.00 . A A . 33 THR N 1 1 35 22268 1 1 33 THR O O 1.187 2.302 8.395 1.00 . A A . 33 THR O 1 1 35 22269 1 1 33 THR OG1 O 0.754 4.596 6.850 1.00 . A A . 33 THR OG1 1 1 35 22270 1 1 34 GLY C C -0.995 0.682 8.031 1.00 . A A . 34 GLY C 1 1 35 22271 1 1 34 GLY CA C 0.155 -0.024 7.334 1.00 . A A . 34 GLY CA 1 1 35 22272 1 1 34 GLY H H 1.322 0.701 5.718 1.00 . A A . 34 GLY H 1 1 35 22273 1 1 34 GLY HA2 H 0.725 -0.571 8.071 1.00 . A A . 34 GLY HA2 1 1 35 22274 1 1 34 GLY HA3 H -0.250 -0.724 6.618 1.00 . A A . 34 GLY HA3 1 1 35 22275 1 1 34 GLY N N 1.043 0.894 6.641 1.00 . A A . 34 GLY N 1 1 35 22276 1 1 34 GLY O O -1.515 0.192 9.034 1.00 . A A . 34 GLY O 1 1 35 22277 1 1 35 ARG C C -3.761 2.440 7.265 1.00 . A A . 35 ARG C 1 1 35 22278 1 1 35 ARG CA C -2.483 2.608 8.080 1.00 . A A . 35 ARG CA 1 1 35 22279 1 1 35 ARG CB C -2.104 4.088 8.156 1.00 . A A . 35 ARG CB 1 1 35 22280 1 1 35 ARG CD C -1.933 4.897 10.528 1.00 . A A . 35 ARG CD 1 1 35 22281 1 1 35 ARG CG C -1.167 4.418 9.306 1.00 . A A . 35 ARG CG 1 1 35 22282 1 1 35 ARG CZ C -2.816 7.032 11.386 1.00 . A A . 35 ARG CZ 1 1 35 22283 1 1 35 ARG H H -0.936 2.174 6.702 1.00 . A A . 35 ARG H 1 1 35 22284 1 1 35 ARG HA H -2.656 2.239 9.080 1.00 . A A . 35 ARG HA 1 1 35 22285 1 1 35 ARG HB2 H -1.620 4.372 7.233 1.00 . A A . 35 ARG HB2 1 1 35 22286 1 1 35 ARG HB3 H -3.004 4.673 8.274 1.00 . A A . 35 ARG HB3 1 1 35 22287 1 1 35 ARG HD2 H -2.946 4.528 10.470 1.00 . A A . 35 ARG HD2 1 1 35 22288 1 1 35 ARG HD3 H -1.456 4.500 11.413 1.00 . A A . 35 ARG HD3 1 1 35 22289 1 1 35 ARG HE H -1.316 6.855 10.080 1.00 . A A . 35 ARG HE 1 1 35 22290 1 1 35 ARG HG2 H -0.608 3.532 9.568 1.00 . A A . 35 ARG HG2 1 1 35 22291 1 1 35 ARG HG3 H -0.486 5.196 8.991 1.00 . A A . 35 ARG HG3 1 1 35 22292 1 1 35 ARG HH11 H -3.742 5.388 12.116 1.00 . A A . 35 ARG HH11 1 1 35 22293 1 1 35 ARG HH12 H -4.344 6.902 12.703 1.00 . A A . 35 ARG HH12 1 1 35 22294 1 1 35 ARG HH21 H -2.107 8.847 10.851 1.00 . A A . 35 ARG HH21 1 1 35 22295 1 1 35 ARG HH22 H -3.416 8.866 11.985 1.00 . A A . 35 ARG HH22 1 1 35 22296 1 1 35 ARG N N -1.390 1.835 7.501 1.00 . A A . 35 ARG N 1 1 35 22297 1 1 35 ARG NE N -1.964 6.355 10.619 1.00 . A A . 35 ARG NE 1 1 35 22298 1 1 35 ARG NH1 N -3.707 6.387 12.129 1.00 . A A . 35 ARG NH1 1 1 35 22299 1 1 35 ARG NH2 N -2.776 8.357 11.409 1.00 . A A . 35 ARG NH2 1 1 35 22300 1 1 35 ARG O O -4.865 2.463 7.811 1.00 . A A . 35 ARG O 1 1 35 22301 1 1 36 SER C C -4.302 1.522 3.725 1.00 . A A . 36 SER C 1 1 35 22302 1 1 36 SER CA C -4.746 2.097 5.065 1.00 . A A . 36 SER CA 1 1 35 22303 1 1 36 SER CB C -5.459 3.433 4.850 1.00 . A A . 36 SER CB 1 1 35 22304 1 1 36 SER H H -2.700 2.260 5.582 1.00 . A A . 36 SER H 1 1 35 22305 1 1 36 SER HA H -5.430 1.404 5.532 1.00 . A A . 36 SER HA 1 1 35 22306 1 1 36 SER HB2 H -5.901 3.757 5.780 1.00 . A A . 36 SER HB2 1 1 35 22307 1 1 36 SER HB3 H -4.745 4.170 4.514 1.00 . A A . 36 SER HB3 1 1 35 22308 1 1 36 SER HG H -7.249 2.889 4.269 1.00 . A A . 36 SER HG 1 1 35 22309 1 1 36 SER N N -3.605 2.270 5.957 1.00 . A A . 36 SER N 1 1 35 22310 1 1 36 SER O O -3.106 1.423 3.447 1.00 . A A . 36 SER O 1 1 35 22311 1 1 36 SER OG O -6.483 3.314 3.877 1.00 . A A . 36 SER OG 1 1 35 22312 1 1 37 CYS C C -4.449 1.653 0.632 1.00 . A A . 37 CYS C 1 1 35 22313 1 1 37 CYS CA C -4.971 0.580 1.585 1.00 . A A . 37 CYS CA 1 1 35 22314 1 1 37 CYS CB C -6.215 -0.085 0.996 1.00 . A A . 37 CYS CB 1 1 35 22315 1 1 37 CYS H H -6.205 1.247 3.170 1.00 . A A . 37 CYS H 1 1 35 22316 1 1 37 CYS HA H -4.205 -0.168 1.717 1.00 . A A . 37 CYS HA 1 1 35 22317 1 1 37 CYS HB2 H -7.095 0.413 1.374 1.00 . A A . 37 CYS HB2 1 1 35 22318 1 1 37 CYS HB3 H -6.188 0.009 -0.080 1.00 . A A . 37 CYS HB3 1 1 35 22319 1 1 37 CYS N N -5.269 1.144 2.895 1.00 . A A . 37 CYS N 1 1 35 22320 1 1 37 CYS O O -3.785 1.346 -0.358 1.00 . A A . 37 CYS O 1 1 35 22321 1 1 37 CYS SG S -6.366 -1.856 1.394 1.00 . A A . 37 CYS SG 1 1 35 22322 1 1 38 GLU C C -2.805 4.254 0.260 1.00 . A A . 38 GLU C 1 1 35 22323 1 1 38 GLU CA C -4.306 4.025 0.105 1.00 . A A . 38 GLU CA 1 1 35 22324 1 1 38 GLU CB C -5.069 5.299 0.472 1.00 . A A . 38 GLU CB 1 1 35 22325 1 1 38 GLU CD C -5.559 7.714 -0.081 1.00 . A A . 38 GLU CD 1 1 35 22326 1 1 38 GLU CG C -4.779 6.469 -0.454 1.00 . A A . 38 GLU CG 1 1 35 22327 1 1 38 GLU H H -5.281 3.097 1.739 1.00 . A A . 38 GLU H 1 1 35 22328 1 1 38 GLU HA H -4.515 3.774 -0.924 1.00 . A A . 38 GLU HA 1 1 35 22329 1 1 38 GLU HB2 H -6.129 5.093 0.435 1.00 . A A . 38 GLU HB2 1 1 35 22330 1 1 38 GLU HB3 H -4.802 5.588 1.477 1.00 . A A . 38 GLU HB3 1 1 35 22331 1 1 38 GLU HG2 H -3.724 6.697 -0.406 1.00 . A A . 38 GLU HG2 1 1 35 22332 1 1 38 GLU HG3 H -5.040 6.187 -1.463 1.00 . A A . 38 GLU HG3 1 1 35 22333 1 1 38 GLU N N -4.750 2.912 0.937 1.00 . A A . 38 GLU N 1 1 35 22334 1 1 38 GLU O O -2.291 4.329 1.376 1.00 . A A . 38 GLU O 1 1 35 22335 1 1 38 GLU OE1 O -4.982 8.600 0.585 1.00 . A A . 38 GLU OE1 1 1 35 22336 1 1 38 GLU OE2 O -6.748 7.805 -0.455 1.00 . A A . 38 GLU OE2 1 1 35 22337 1 1 39 CYS C C -0.338 6.070 -0.993 1.00 . A A . 39 CYS C 1 1 35 22338 1 1 39 CYS CA C -0.665 4.584 -0.854 1.00 . A A . 39 CYS CA 1 1 35 22339 1 1 39 CYS CB C 0.001 3.798 -1.986 1.00 . A A . 39 CYS CB 1 1 35 22340 1 1 39 CYS H H -2.573 4.295 -1.726 1.00 . A A . 39 CYS H 1 1 35 22341 1 1 39 CYS HA H -0.285 4.228 0.092 1.00 . A A . 39 CYS HA 1 1 35 22342 1 1 39 CYS HB2 H -0.405 4.128 -2.931 1.00 . A A . 39 CYS HB2 1 1 35 22343 1 1 39 CYS HB3 H 1.064 3.990 -1.970 1.00 . A A . 39 CYS HB3 1 1 35 22344 1 1 39 CYS N N -2.107 4.364 -0.866 1.00 . A A . 39 CYS N 1 1 35 22345 1 1 39 CYS O O -1.013 6.794 -1.725 1.00 . A A . 39 CYS O 1 1 35 22346 1 1 39 CYS SG S -0.239 1.995 -1.883 1.00 . A A . 39 CYS SG 1 1 35 22347 1 1 40 PRO C C 1.379 8.421 -1.775 1.00 . A A . 40 PRO C 1 1 35 22348 1 1 40 PRO CA C 1.117 7.953 -0.347 1.00 . A A . 40 PRO CA 1 1 35 22349 1 1 40 PRO CB C 2.413 7.985 0.469 1.00 . A A . 40 PRO CB 1 1 35 22350 1 1 40 PRO CD C 1.570 5.754 0.604 1.00 . A A . 40 PRO CD 1 1 35 22351 1 1 40 PRO CG C 2.326 6.802 1.370 1.00 . A A . 40 PRO CG 1 1 35 22352 1 1 40 PRO HA H 0.382 8.598 0.112 1.00 . A A . 40 PRO HA 1 1 35 22353 1 1 40 PRO HB2 H 3.261 7.914 -0.195 1.00 . A A . 40 PRO HB2 1 1 35 22354 1 1 40 PRO HB3 H 2.464 8.905 1.031 1.00 . A A . 40 PRO HB3 1 1 35 22355 1 1 40 PRO HD2 H 2.251 5.135 0.038 1.00 . A A . 40 PRO HD2 1 1 35 22356 1 1 40 PRO HD3 H 0.977 5.150 1.275 1.00 . A A . 40 PRO HD3 1 1 35 22357 1 1 40 PRO HG2 H 3.318 6.449 1.610 1.00 . A A . 40 PRO HG2 1 1 35 22358 1 1 40 PRO HG3 H 1.792 7.065 2.272 1.00 . A A . 40 PRO HG3 1 1 35 22359 1 1 40 PRO N N 0.707 6.546 -0.292 1.00 . A A . 40 PRO N 1 1 35 22360 1 1 40 PRO O O 1.282 7.641 -2.722 1.00 . A A . 40 PRO O 1 1 35 22361 1 1 41 SER C C 3.466 10.628 -3.373 1.00 . A A . 41 SER C 1 1 35 22362 1 1 41 SER CA C 1.989 10.270 -3.235 1.00 . A A . 41 SER CA 1 1 35 22363 1 1 41 SER CB C 1.127 11.512 -3.466 1.00 . A A . 41 SER CB 1 1 35 22364 1 1 41 SER H H 1.774 10.271 -1.128 1.00 . A A . 41 SER H 1 1 35 22365 1 1 41 SER HA H 1.741 9.526 -3.978 1.00 . A A . 41 SER HA 1 1 35 22366 1 1 41 SER HB2 H 1.596 12.365 -3.000 1.00 . A A . 41 SER HB2 1 1 35 22367 1 1 41 SER HB3 H 1.032 11.688 -4.528 1.00 . A A . 41 SER HB3 1 1 35 22368 1 1 41 SER HG H -0.214 11.796 -2.067 1.00 . A A . 41 SER HG 1 1 35 22369 1 1 41 SER N N 1.712 9.699 -1.921 1.00 . A A . 41 SER N 1 1 35 22370 1 1 41 SER O O 3.825 11.543 -4.115 1.00 . A A . 41 SER O 1 1 35 22371 1 1 41 SER OG O -0.167 11.345 -2.913 1.00 . A A . 41 SER OG 1 1 35 22372 1 1 42 TYR C C 6.528 8.839 -2.493 1.00 . A A . 42 TYR C 1 1 35 22373 1 1 42 TYR CA C 5.754 10.140 -2.704 1.00 . A A . 42 TYR CA 1 1 35 22374 1 1 42 TYR CB C 6.157 11.168 -1.643 1.00 . A A . 42 TYR CB 1 1 35 22375 1 1 42 TYR CD1 C 6.937 9.842 0.359 1.00 . A A . 42 TYR CD1 1 1 35 22376 1 1 42 TYR CD2 C 4.885 11.042 0.535 1.00 . A A . 42 TYR CD2 1 1 35 22377 1 1 42 TYR CE1 C 6.788 9.389 1.656 1.00 . A A . 42 TYR CE1 1 1 35 22378 1 1 42 TYR CE2 C 4.729 10.593 1.833 1.00 . A A . 42 TYR CE2 1 1 35 22379 1 1 42 TYR CG C 5.990 10.675 -0.223 1.00 . A A . 42 TYR CG 1 1 35 22380 1 1 42 TYR CZ C 5.683 9.767 2.388 1.00 . A A . 42 TYR CZ 1 1 35 22381 1 1 42 TYR H H 3.971 9.184 -2.086 1.00 . A A . 42 TYR H 1 1 35 22382 1 1 42 TYR HA H 5.992 10.532 -3.681 1.00 . A A . 42 TYR HA 1 1 35 22383 1 1 42 TYR HB2 H 7.195 11.429 -1.782 1.00 . A A . 42 TYR HB2 1 1 35 22384 1 1 42 TYR HB3 H 5.549 12.053 -1.762 1.00 . A A . 42 TYR HB3 1 1 35 22385 1 1 42 TYR HD1 H 7.802 9.548 -0.217 1.00 . A A . 42 TYR HD1 1 1 35 22386 1 1 42 TYR HD2 H 4.139 11.688 0.097 1.00 . A A . 42 TYR HD2 1 1 35 22387 1 1 42 TYR HE1 H 7.536 8.742 2.090 1.00 . A A . 42 TYR HE1 1 1 35 22388 1 1 42 TYR HE2 H 3.863 10.890 2.406 1.00 . A A . 42 TYR HE2 1 1 35 22389 1 1 42 TYR HH H 4.618 9.065 3.826 1.00 . A A . 42 TYR HH 1 1 35 22390 1 1 42 TYR N N 4.317 9.900 -2.658 1.00 . A A . 42 TYR N 1 1 35 22391 1 1 42 TYR O O 6.088 7.961 -1.752 1.00 . A A . 42 TYR O 1 1 35 22392 1 1 42 TYR OH O 5.532 9.318 3.680 1.00 . A A . 42 TYR OH 1 1 35 22393 1 1 43 PRO C C 9.212 7.402 -1.666 1.00 . A A . 43 PRO C 1 1 35 22394 1 1 43 PRO CA C 8.526 7.497 -3.024 1.00 . A A . 43 PRO CA 1 1 35 22395 1 1 43 PRO CB C 9.561 7.671 -4.136 1.00 . A A . 43 PRO CB 1 1 35 22396 1 1 43 PRO CD C 8.295 9.697 -4.052 1.00 . A A . 43 PRO CD 1 1 35 22397 1 1 43 PRO CG C 9.668 9.145 -4.322 1.00 . A A . 43 PRO CG 1 1 35 22398 1 1 43 PRO HA H 7.951 6.599 -3.200 1.00 . A A . 43 PRO HA 1 1 35 22399 1 1 43 PRO HB2 H 10.502 7.241 -3.826 1.00 . A A . 43 PRO HB2 1 1 35 22400 1 1 43 PRO HB3 H 9.214 7.184 -5.035 1.00 . A A . 43 PRO HB3 1 1 35 22401 1 1 43 PRO HD2 H 8.365 10.662 -3.570 1.00 . A A . 43 PRO HD2 1 1 35 22402 1 1 43 PRO HD3 H 7.731 9.772 -4.969 1.00 . A A . 43 PRO HD3 1 1 35 22403 1 1 43 PRO HG2 H 10.381 9.552 -3.621 1.00 . A A . 43 PRO HG2 1 1 35 22404 1 1 43 PRO HG3 H 9.967 9.366 -5.336 1.00 . A A . 43 PRO HG3 1 1 35 22405 1 1 43 PRO N N 7.695 8.699 -3.146 1.00 . A A . 43 PRO N 1 1 35 22406 1 1 43 PRO O O 9.847 8.354 -1.212 1.00 . A A . 43 PRO O 1 1 35 22407 1 1 44 GLY C C 11.051 5.382 0.184 1.00 . A A . 44 GLY C 1 1 35 22408 1 1 44 GLY CA C 9.693 6.049 0.279 1.00 . A A . 44 GLY CA 1 1 35 22409 1 1 44 GLY H H 8.562 5.524 -1.432 1.00 . A A . 44 GLY H 1 1 35 22410 1 1 44 GLY HA2 H 9.042 5.433 0.881 1.00 . A A . 44 GLY HA2 1 1 35 22411 1 1 44 GLY HA3 H 9.809 7.009 0.760 1.00 . A A . 44 GLY HA3 1 1 35 22412 1 1 44 GLY N N 9.080 6.247 -1.022 1.00 . A A . 44 GLY N 1 1 35 22413 1 1 44 GLY O O 11.376 4.506 0.986 1.00 . A A . 44 GLY O 1 1 35 22414 1 1 45 ASN C C 14.103 5.613 0.156 1.00 . A A . 45 ASN C 1 1 35 22415 1 1 45 ASN CA C 13.175 5.232 -0.994 1.00 . A A . 45 ASN CA 1 1 35 22416 1 1 45 ASN CB C 13.765 5.713 -2.321 1.00 . A A . 45 ASN CB 1 1 35 22417 1 1 45 ASN CG C 13.415 4.795 -3.476 1.00 . A A . 45 ASN CG 1 1 35 22418 1 1 45 ASN H H 11.529 6.498 -1.404 1.00 . A A . 45 ASN H 1 1 35 22419 1 1 45 ASN HA H 13.079 4.157 -1.022 1.00 . A A . 45 ASN HA 1 1 35 22420 1 1 45 ASN HB2 H 13.383 6.699 -2.541 1.00 . A A . 45 ASN HB2 1 1 35 22421 1 1 45 ASN HB3 H 14.841 5.759 -2.234 1.00 . A A . 45 ASN HB3 1 1 35 22422 1 1 45 ASN HD21 H 14.159 6.105 -4.774 1.00 . A A . 45 ASN HD21 1 1 35 22423 1 1 45 ASN HD22 H 13.512 4.655 -5.457 1.00 . A A . 45 ASN HD22 1 1 35 22424 1 1 45 ASN N N 11.845 5.796 -0.797 1.00 . A A . 45 ASN N 1 1 35 22425 1 1 45 ASN ND2 N 13.727 5.229 -4.692 1.00 . A A . 45 ASN ND2 1 1 35 22426 1 1 45 ASN O O 14.997 4.851 0.523 1.00 . A A . 45 ASN O 1 1 35 22427 1 1 45 ASN OD1 O 12.872 3.709 -3.278 1.00 . A A . 45 ASN OD1 1 1 35 22428 1 1 46 GLY C C 14.360 8.667 2.256 1.00 . A A . 46 GLY C 1 1 35 22429 1 1 46 GLY CA C 14.708 7.257 1.821 1.00 . A A . 46 GLY CA 1 1 35 22430 1 1 46 GLY H H 13.157 7.361 0.384 1.00 . A A . 46 GLY H 1 1 35 22431 1 1 46 GLY HA2 H 15.744 7.231 1.516 1.00 . A A . 46 GLY HA2 1 1 35 22432 1 1 46 GLY HA3 H 14.574 6.590 2.659 1.00 . A A . 46 GLY HA3 1 1 35 22433 1 1 46 GLY N N 13.884 6.796 0.719 1.00 . A A . 46 GLY N 1 1 35 22434 1 1 46 GLY O O 13.729 9.395 1.461 1.00 . A A . 46 GLY O 1 1 35 22435 1 1 46 GLY OXT O 14.718 9.043 3.392 1.00 . A A . 46 GLY OXT 1 1 36 22436 1 1 1 ALA C C -17.145 -6.900 6.769 1.00 . A A . 1 ALA C 1 1 36 22437 1 1 1 ALA CA C -16.933 -6.767 8.273 1.00 . A A . 1 ALA CA 1 1 36 22438 1 1 1 ALA CB C -15.449 -6.657 8.588 1.00 . A A . 1 ALA CB 1 1 36 22439 1 1 1 ALA H1 H -18.448 -8.129 8.561 1.00 . A A . 1 ALA H1 1 1 36 22440 1 1 1 ALA H2 H -16.878 -8.724 8.905 1.00 . A A . 1 ALA H2 1 1 36 22441 1 1 1 ALA H3 H -17.642 -7.640 9.995 1.00 . A A . 1 ALA H3 1 1 36 22442 1 1 1 ALA HA H -17.416 -5.863 8.615 1.00 . A A . 1 ALA HA 1 1 36 22443 1 1 1 ALA HB1 H -15.307 -5.995 9.430 1.00 . A A . 1 ALA HB1 1 1 36 22444 1 1 1 ALA HB2 H -15.058 -7.634 8.828 1.00 . A A . 1 ALA HB2 1 1 36 22445 1 1 1 ALA HB3 H -14.927 -6.262 7.728 1.00 . A A . 1 ALA HB3 1 1 36 22446 1 1 1 ALA N N -17.529 -7.919 8.999 1.00 . A A . 1 ALA N 1 1 36 22447 1 1 1 ALA O O -16.737 -7.888 6.158 1.00 . A A . 1 ALA O 1 1 36 22448 1 1 2 MET C C -17.142 -4.919 4.016 1.00 . A A . 2 MET C 1 1 36 22449 1 1 2 MET CA C -18.054 -5.902 4.743 1.00 . A A . 2 MET CA 1 1 36 22450 1 1 2 MET CB C -19.518 -5.551 4.474 1.00 . A A . 2 MET CB 1 1 36 22451 1 1 2 MET CE C -22.111 -7.289 4.930 1.00 . A A . 2 MET CE 1 1 36 22452 1 1 2 MET CG C -20.114 -6.290 3.288 1.00 . A A . 2 MET CG 1 1 36 22453 1 1 2 MET H H -18.088 -5.137 6.716 1.00 . A A . 2 MET H 1 1 36 22454 1 1 2 MET HA H -17.858 -6.897 4.373 1.00 . A A . 2 MET HA 1 1 36 22455 1 1 2 MET HB2 H -20.101 -5.792 5.351 1.00 . A A . 2 MET HB2 1 1 36 22456 1 1 2 MET HB3 H -19.593 -4.490 4.284 1.00 . A A . 2 MET HB3 1 1 36 22457 1 1 2 MET HE1 H -21.244 -7.907 5.110 1.00 . A A . 2 MET HE1 1 1 36 22458 1 1 2 MET HE2 H -22.216 -6.575 5.733 1.00 . A A . 2 MET HE2 1 1 36 22459 1 1 2 MET HE3 H -22.992 -7.911 4.882 1.00 . A A . 2 MET HE3 1 1 36 22460 1 1 2 MET HG2 H -19.850 -5.763 2.383 1.00 . A A . 2 MET HG2 1 1 36 22461 1 1 2 MET HG3 H -19.698 -7.287 3.256 1.00 . A A . 2 MET HG3 1 1 36 22462 1 1 2 MET N N -17.787 -5.898 6.176 1.00 . A A . 2 MET N 1 1 36 22463 1 1 2 MET O O -17.542 -4.295 3.034 1.00 . A A . 2 MET O 1 1 36 22464 1 1 2 MET SD S -21.910 -6.417 3.378 1.00 . A A . 2 MET SD 1 1 36 22465 1 1 3 ASP C C -13.558 -4.515 3.860 1.00 . A A . 3 ASP C 1 1 36 22466 1 1 3 ASP CA C -14.944 -3.879 3.904 1.00 . A A . 3 ASP CA 1 1 36 22467 1 1 3 ASP CB C -14.890 -2.565 4.685 1.00 . A A . 3 ASP CB 1 1 36 22468 1 1 3 ASP CG C -14.339 -1.422 3.855 1.00 . A A . 3 ASP CG 1 1 36 22469 1 1 3 ASP H H -15.653 -5.311 5.292 1.00 . A A . 3 ASP H 1 1 36 22470 1 1 3 ASP HA H -15.265 -3.675 2.894 1.00 . A A . 3 ASP HA 1 1 36 22471 1 1 3 ASP HB2 H -15.887 -2.303 5.006 1.00 . A A . 3 ASP HB2 1 1 36 22472 1 1 3 ASP HB3 H -14.259 -2.694 5.552 1.00 . A A . 3 ASP HB3 1 1 36 22473 1 1 3 ASP N N -15.914 -4.787 4.507 1.00 . A A . 3 ASP N 1 1 36 22474 1 1 3 ASP O O -12.898 -4.659 4.889 1.00 . A A . 3 ASP O 1 1 36 22475 1 1 3 ASP OD1 O -15.119 -0.509 3.510 1.00 . A A . 3 ASP OD1 1 1 36 22476 1 1 3 ASP OD2 O -13.128 -1.440 3.550 1.00 . A A . 3 ASP OD2 1 1 36 22477 1 1 4 CYS C C -10.823 -4.535 1.861 1.00 . A A . 4 CYS C 1 1 36 22478 1 1 4 CYS CA C -11.816 -5.514 2.485 1.00 . A A . 4 CYS CA 1 1 36 22479 1 1 4 CYS CB C -11.936 -6.766 1.613 1.00 . A A . 4 CYS CB 1 1 36 22480 1 1 4 CYS H H -13.696 -4.752 1.880 1.00 . A A . 4 CYS H 1 1 36 22481 1 1 4 CYS HA H -11.452 -5.801 3.460 1.00 . A A . 4 CYS HA 1 1 36 22482 1 1 4 CYS HB2 H -12.893 -6.756 1.112 1.00 . A A . 4 CYS HB2 1 1 36 22483 1 1 4 CYS HB3 H -11.149 -6.759 0.873 1.00 . A A . 4 CYS HB3 1 1 36 22484 1 1 4 CYS N N -13.124 -4.893 2.663 1.00 . A A . 4 CYS N 1 1 36 22485 1 1 4 CYS O O -9.611 -4.704 1.987 1.00 . A A . 4 CYS O 1 1 36 22486 1 1 4 CYS SG S -11.813 -8.330 2.539 1.00 . A A . 4 CYS SG 1 1 36 22487 1 1 5 THR C C -9.657 -3.144 -0.564 1.00 . A A . 5 THR C 1 1 36 22488 1 1 5 THR CA C -10.494 -2.513 0.545 1.00 . A A . 5 THR CA 1 1 36 22489 1 1 5 THR CB C -9.582 -1.844 1.577 1.00 . A A . 5 THR CB 1 1 36 22490 1 1 5 THR CG2 C -9.548 -0.336 1.454 1.00 . A A . 5 THR CG2 1 1 36 22491 1 1 5 THR H H -12.316 -3.428 1.117 1.00 . A A . 5 THR H 1 1 36 22492 1 1 5 THR HA H -11.137 -1.763 0.110 1.00 . A A . 5 THR HA 1 1 36 22493 1 1 5 THR HB H -8.574 -2.209 1.444 1.00 . A A . 5 THR HB 1 1 36 22494 1 1 5 THR HG1 H -9.467 -2.880 3.235 1.00 . A A . 5 THR HG1 1 1 36 22495 1 1 5 THR HG21 H -9.336 -0.063 0.431 1.00 . A A . 5 THR HG21 1 1 36 22496 1 1 5 THR HG22 H -10.505 0.071 1.744 1.00 . A A . 5 THR HG22 1 1 36 22497 1 1 5 THR HG23 H -8.777 0.061 2.099 1.00 . A A . 5 THR HG23 1 1 36 22498 1 1 5 THR N N -11.342 -3.513 1.186 1.00 . A A . 5 THR N 1 1 36 22499 1 1 5 THR O O -9.009 -4.170 -0.358 1.00 . A A . 5 THR O 1 1 36 22500 1 1 5 THR OG1 O -9.997 -2.155 2.895 1.00 . A A . 5 THR OG1 1 1 36 22501 1 1 6 THR C C -8.104 -1.907 -3.525 1.00 . A A . 6 THR C 1 1 36 22502 1 1 6 THR CA C -8.917 -3.026 -2.881 1.00 . A A . 6 THR CA 1 1 36 22503 1 1 6 THR CB C -9.860 -3.647 -3.913 1.00 . A A . 6 THR CB 1 1 36 22504 1 1 6 THR CG2 C -10.275 -5.061 -3.570 1.00 . A A . 6 THR CG2 1 1 36 22505 1 1 6 THR H H -10.211 -1.711 -1.842 1.00 . A A . 6 THR H 1 1 36 22506 1 1 6 THR HA H -8.240 -3.786 -2.521 1.00 . A A . 6 THR HA 1 1 36 22507 1 1 6 THR HB H -9.361 -3.672 -4.872 1.00 . A A . 6 THR HB 1 1 36 22508 1 1 6 THR HG1 H -10.803 -1.959 -4.224 1.00 . A A . 6 THR HG1 1 1 36 22509 1 1 6 THR HG21 H -9.414 -5.617 -3.231 1.00 . A A . 6 THR HG21 1 1 36 22510 1 1 6 THR HG22 H -11.019 -5.037 -2.787 1.00 . A A . 6 THR HG22 1 1 36 22511 1 1 6 THR HG23 H -10.690 -5.537 -4.446 1.00 . A A . 6 THR HG23 1 1 36 22512 1 1 6 THR N N -9.675 -2.525 -1.740 1.00 . A A . 6 THR N 1 1 36 22513 1 1 6 THR O O -8.638 -0.845 -3.844 1.00 . A A . 6 THR O 1 1 36 22514 1 1 6 THR OG1 O -11.038 -2.872 -4.046 1.00 . A A . 6 THR OG1 1 1 36 22515 1 1 7 GLY C C -4.478 -1.511 -4.228 1.00 . A A . 7 GLY C 1 1 36 22516 1 1 7 GLY CA C -5.950 -1.148 -4.311 1.00 . A A . 7 GLY CA 1 1 36 22517 1 1 7 GLY H H -6.437 -3.013 -3.434 1.00 . A A . 7 GLY H 1 1 36 22518 1 1 7 GLY HA2 H -6.106 -0.207 -3.805 1.00 . A A . 7 GLY HA2 1 1 36 22519 1 1 7 GLY HA3 H -6.222 -1.034 -5.350 1.00 . A A . 7 GLY HA3 1 1 36 22520 1 1 7 GLY N N -6.810 -2.150 -3.710 1.00 . A A . 7 GLY N 1 1 36 22521 1 1 7 GLY O O -4.128 -2.690 -4.176 1.00 . A A . 7 GLY O 1 1 36 22522 1 1 8 PRO C C -1.637 -1.040 -2.752 1.00 . A A . 8 PRO C 1 1 36 22523 1 1 8 PRO CA C -2.138 -0.729 -4.163 1.00 . A A . 8 PRO CA 1 1 36 22524 1 1 8 PRO CB C -1.564 0.599 -4.656 1.00 . A A . 8 PRO CB 1 1 36 22525 1 1 8 PRO CD C -3.920 0.930 -4.302 1.00 . A A . 8 PRO CD 1 1 36 22526 1 1 8 PRO CG C -2.580 1.621 -4.273 1.00 . A A . 8 PRO CG 1 1 36 22527 1 1 8 PRO HA H -1.834 -1.522 -4.830 1.00 . A A . 8 PRO HA 1 1 36 22528 1 1 8 PRO HB2 H -0.616 0.785 -4.174 1.00 . A A . 8 PRO HB2 1 1 36 22529 1 1 8 PRO HB3 H -1.429 0.561 -5.727 1.00 . A A . 8 PRO HB3 1 1 36 22530 1 1 8 PRO HD2 H -4.515 1.230 -3.453 1.00 . A A . 8 PRO HD2 1 1 36 22531 1 1 8 PRO HD3 H -4.438 1.155 -5.223 1.00 . A A . 8 PRO HD3 1 1 36 22532 1 1 8 PRO HG2 H -2.373 1.989 -3.280 1.00 . A A . 8 PRO HG2 1 1 36 22533 1 1 8 PRO HG3 H -2.565 2.434 -4.983 1.00 . A A . 8 PRO HG3 1 1 36 22534 1 1 8 PRO N N -3.584 -0.505 -4.226 1.00 . A A . 8 PRO N 1 1 36 22535 1 1 8 PRO O O -0.910 -2.011 -2.545 1.00 . A A . 8 PRO O 1 1 36 22536 1 1 9 CYS C C -2.123 -1.711 0.167 1.00 . A A . 9 CYS C 1 1 36 22537 1 1 9 CYS CA C -1.593 -0.398 -0.401 1.00 . A A . 9 CYS CA 1 1 36 22538 1 1 9 CYS CB C -2.058 0.775 0.466 1.00 . A A . 9 CYS CB 1 1 36 22539 1 1 9 CYS H H -2.593 0.553 -2.009 1.00 . A A . 9 CYS H 1 1 36 22540 1 1 9 CYS HA H -0.514 -0.431 -0.391 1.00 . A A . 9 CYS HA 1 1 36 22541 1 1 9 CYS HB2 H -2.473 1.540 -0.172 1.00 . A A . 9 CYS HB2 1 1 36 22542 1 1 9 CYS HB3 H -2.822 0.431 1.149 1.00 . A A . 9 CYS HB3 1 1 36 22543 1 1 9 CYS N N -2.019 -0.208 -1.786 1.00 . A A . 9 CYS N 1 1 36 22544 1 1 9 CYS O O -1.372 -2.498 0.744 1.00 . A A . 9 CYS O 1 1 36 22545 1 1 9 CYS SG S -0.734 1.544 1.456 1.00 . A A . 9 CYS SG 1 1 36 22546 1 1 10 CYS C C -3.832 -4.319 -0.467 1.00 . A A . 10 CYS C 1 1 36 22547 1 1 10 CYS CA C -4.044 -3.162 0.504 1.00 . A A . 10 CYS CA 1 1 36 22548 1 1 10 CYS CB C -5.539 -2.938 0.746 1.00 . A A . 10 CYS CB 1 1 36 22549 1 1 10 CYS H H -3.970 -1.280 -0.462 1.00 . A A . 10 CYS H 1 1 36 22550 1 1 10 CYS HA H -3.573 -3.410 1.442 1.00 . A A . 10 CYS HA 1 1 36 22551 1 1 10 CYS HB2 H -5.942 -3.794 1.267 1.00 . A A . 10 CYS HB2 1 1 36 22552 1 1 10 CYS HB3 H -5.667 -2.059 1.359 1.00 . A A . 10 CYS HB3 1 1 36 22553 1 1 10 CYS N N -3.420 -1.943 0.004 1.00 . A A . 10 CYS N 1 1 36 22554 1 1 10 CYS O O -4.129 -4.207 -1.656 1.00 . A A . 10 CYS O 1 1 36 22555 1 1 10 CYS SG S -6.521 -2.706 -0.772 1.00 . A A . 10 CYS SG 1 1 36 22556 1 1 11 ARG C C -4.313 -7.054 -1.507 1.00 . A A . 11 ARG C 1 1 36 22557 1 1 11 ARG CA C -3.051 -6.607 -0.771 1.00 . A A . 11 ARG CA 1 1 36 22558 1 1 11 ARG CB C -2.508 -7.747 0.096 1.00 . A A . 11 ARG CB 1 1 36 22559 1 1 11 ARG CD C -1.487 -10.042 0.157 1.00 . A A . 11 ARG CD 1 1 36 22560 1 1 11 ARG CG C -2.281 -9.042 -0.667 1.00 . A A . 11 ARG CG 1 1 36 22561 1 1 11 ARG CZ C -2.885 -12.056 -0.095 1.00 . A A . 11 ARG CZ 1 1 36 22562 1 1 11 ARG H H -3.092 -5.454 1.004 1.00 . A A . 11 ARG H 1 1 36 22563 1 1 11 ARG HA H -2.303 -6.339 -1.502 1.00 . A A . 11 ARG HA 1 1 36 22564 1 1 11 ARG HB2 H -1.565 -7.438 0.525 1.00 . A A . 11 ARG HB2 1 1 36 22565 1 1 11 ARG HB3 H -3.208 -7.942 0.895 1.00 . A A . 11 ARG HB3 1 1 36 22566 1 1 11 ARG HD2 H -0.435 -9.823 0.051 1.00 . A A . 11 ARG HD2 1 1 36 22567 1 1 11 ARG HD3 H -1.772 -9.941 1.194 1.00 . A A . 11 ARG HD3 1 1 36 22568 1 1 11 ARG HE H -0.994 -11.892 -0.710 1.00 . A A . 11 ARG HE 1 1 36 22569 1 1 11 ARG HG2 H -3.238 -9.474 -0.916 1.00 . A A . 11 ARG HG2 1 1 36 22570 1 1 11 ARG HG3 H -1.736 -8.823 -1.574 1.00 . A A . 11 ARG HG3 1 1 36 22571 1 1 11 ARG HH11 H -3.808 -10.504 0.816 1.00 . A A . 11 ARG HH11 1 1 36 22572 1 1 11 ARG HH12 H -4.769 -11.931 0.627 1.00 . A A . 11 ARG HH12 1 1 36 22573 1 1 11 ARG HH21 H -2.257 -13.771 -0.961 1.00 . A A . 11 ARG HH21 1 1 36 22574 1 1 11 ARG HH22 H -3.889 -13.787 -0.381 1.00 . A A . 11 ARG HH22 1 1 36 22575 1 1 11 ARG N N -3.311 -5.428 0.049 1.00 . A A . 11 ARG N 1 1 36 22576 1 1 11 ARG NE N -1.730 -11.418 -0.270 1.00 . A A . 11 ARG NE 1 1 36 22577 1 1 11 ARG NH1 N -3.904 -11.447 0.498 1.00 . A A . 11 ARG NH1 1 1 36 22578 1 1 11 ARG NH2 N -3.021 -13.307 -0.513 1.00 . A A . 11 ARG NH2 1 1 36 22579 1 1 11 ARG O O -4.495 -6.745 -2.685 1.00 . A A . 11 ARG O 1 1 36 22580 1 1 12 GLN C C -7.575 -8.265 -0.419 1.00 . A A . 12 GLN C 1 1 36 22581 1 1 12 GLN CA C -6.415 -8.275 -1.414 1.00 . A A . 12 GLN CA 1 1 36 22582 1 1 12 GLN CB C -6.211 -9.692 -1.949 1.00 . A A . 12 GLN CB 1 1 36 22583 1 1 12 GLN CD C -8.425 -10.565 -2.797 1.00 . A A . 12 GLN CD 1 1 36 22584 1 1 12 GLN CG C -7.062 -10.012 -3.167 1.00 . A A . 12 GLN CG 1 1 36 22585 1 1 12 GLN H H -4.980 -8.008 0.120 1.00 . A A . 12 GLN H 1 1 36 22586 1 1 12 GLN HA H -6.660 -7.624 -2.240 1.00 . A A . 12 GLN HA 1 1 36 22587 1 1 12 GLN HB2 H -5.173 -9.816 -2.217 1.00 . A A . 12 GLN HB2 1 1 36 22588 1 1 12 GLN HB3 H -6.459 -10.395 -1.167 1.00 . A A . 12 GLN HB3 1 1 36 22589 1 1 12 GLN HE21 H -7.611 -12.311 -2.306 1.00 . A A . 12 GLN HE21 1 1 36 22590 1 1 12 GLN HE22 H -9.325 -12.202 -2.117 1.00 . A A . 12 GLN HE22 1 1 36 22591 1 1 12 GLN HG2 H -7.201 -9.108 -3.741 1.00 . A A . 12 GLN HG2 1 1 36 22592 1 1 12 GLN HG3 H -6.544 -10.744 -3.769 1.00 . A A . 12 GLN HG3 1 1 36 22593 1 1 12 GLN N N -5.179 -7.787 -0.812 1.00 . A A . 12 GLN N 1 1 36 22594 1 1 12 GLN NE2 N -8.457 -11.819 -2.363 1.00 . A A . 12 GLN NE2 1 1 36 22595 1 1 12 GLN O O -8.649 -8.792 -0.709 1.00 . A A . 12 GLN O 1 1 36 22596 1 1 12 GLN OE1 O -9.437 -9.872 -2.900 1.00 . A A . 12 GLN OE1 1 1 36 22597 1 1 13 CYS C C -7.924 -6.881 3.026 1.00 . A A . 13 CYS C 1 1 36 22598 1 1 13 CYS CA C -8.407 -7.604 1.770 1.00 . A A . 13 CYS CA 1 1 36 22599 1 1 13 CYS CB C -8.884 -9.014 2.131 1.00 . A A . 13 CYS CB 1 1 36 22600 1 1 13 CYS H H -6.491 -7.263 0.932 1.00 . A A . 13 CYS H 1 1 36 22601 1 1 13 CYS HA H -9.237 -7.054 1.354 1.00 . A A . 13 CYS HA 1 1 36 22602 1 1 13 CYS HB2 H -8.172 -9.734 1.757 1.00 . A A . 13 CYS HB2 1 1 36 22603 1 1 13 CYS HB3 H -8.946 -9.103 3.206 1.00 . A A . 13 CYS HB3 1 1 36 22604 1 1 13 CYS N N -7.362 -7.668 0.751 1.00 . A A . 13 CYS N 1 1 36 22605 1 1 13 CYS O O -8.708 -6.222 3.708 1.00 . A A . 13 CYS O 1 1 36 22606 1 1 13 CYS SG S -10.516 -9.444 1.444 1.00 . A A . 13 CYS SG 1 1 36 22607 1 1 14 LYS C C -4.942 -5.420 4.130 1.00 . A A . 14 LYS C 1 1 36 22608 1 1 14 LYS CA C -6.073 -6.365 4.514 1.00 . A A . 14 LYS CA 1 1 36 22609 1 1 14 LYS CB C -5.562 -7.417 5.500 1.00 . A A . 14 LYS CB 1 1 36 22610 1 1 14 LYS CD C -5.915 -8.156 7.875 1.00 . A A . 14 LYS CD 1 1 36 22611 1 1 14 LYS CE C -7.403 -8.329 8.132 1.00 . A A . 14 LYS CE 1 1 36 22612 1 1 14 LYS CG C -5.642 -6.979 6.953 1.00 . A A . 14 LYS CG 1 1 36 22613 1 1 14 LYS H H -6.053 -7.549 2.761 1.00 . A A . 14 LYS H 1 1 36 22614 1 1 14 LYS HA H -6.858 -5.794 4.987 1.00 . A A . 14 LYS HA 1 1 36 22615 1 1 14 LYS HB2 H -6.148 -8.317 5.384 1.00 . A A . 14 LYS HB2 1 1 36 22616 1 1 14 LYS HB3 H -4.530 -7.638 5.269 1.00 . A A . 14 LYS HB3 1 1 36 22617 1 1 14 LYS HD2 H -5.532 -9.056 7.418 1.00 . A A . 14 LYS HD2 1 1 36 22618 1 1 14 LYS HD3 H -5.413 -7.987 8.817 1.00 . A A . 14 LYS HD3 1 1 36 22619 1 1 14 LYS HE2 H -7.884 -7.366 8.051 1.00 . A A . 14 LYS HE2 1 1 36 22620 1 1 14 LYS HE3 H -7.808 -8.998 7.387 1.00 . A A . 14 LYS HE3 1 1 36 22621 1 1 14 LYS HG2 H -4.704 -6.524 7.234 1.00 . A A . 14 LYS HG2 1 1 36 22622 1 1 14 LYS HG3 H -6.440 -6.258 7.058 1.00 . A A . 14 LYS HG3 1 1 36 22623 1 1 14 LYS HZ1 H -6.947 -8.566 10.157 1.00 . A A . 14 LYS HZ1 1 1 36 22624 1 1 14 LYS HZ2 H -8.606 -8.582 9.822 1.00 . A A . 14 LYS HZ2 1 1 36 22625 1 1 14 LYS HZ3 H -7.654 -9.930 9.451 1.00 . A A . 14 LYS HZ3 1 1 36 22626 1 1 14 LYS N N -6.636 -7.009 3.334 1.00 . A A . 14 LYS N 1 1 36 22627 1 1 14 LYS NZ N -7.671 -8.891 9.485 1.00 . A A . 14 LYS NZ 1 1 36 22628 1 1 14 LYS O O -4.021 -5.800 3.406 1.00 . A A . 14 LYS O 1 1 36 22629 1 1 15 LEU C C -2.598 -3.753 4.605 1.00 . A A . 15 LEU C 1 1 36 22630 1 1 15 LEU CA C -3.989 -3.188 4.338 1.00 . A A . 15 LEU CA 1 1 36 22631 1 1 15 LEU CB C -4.216 -1.936 5.187 1.00 . A A . 15 LEU CB 1 1 36 22632 1 1 15 LEU CD1 C -3.674 -1.599 7.617 1.00 . A A . 15 LEU CD1 1 1 36 22633 1 1 15 LEU CD2 C -6.060 -1.657 6.870 1.00 . A A . 15 LEU CD2 1 1 36 22634 1 1 15 LEU CG C -4.660 -2.204 6.629 1.00 . A A . 15 LEU CG 1 1 36 22635 1 1 15 LEU H H -5.769 -3.946 5.199 1.00 . A A . 15 LEU H 1 1 36 22636 1 1 15 LEU HA H -4.065 -2.925 3.294 1.00 . A A . 15 LEU HA 1 1 36 22637 1 1 15 LEU HB2 H -3.294 -1.373 5.212 1.00 . A A . 15 LEU HB2 1 1 36 22638 1 1 15 LEU HB3 H -4.973 -1.334 4.707 1.00 . A A . 15 LEU HB3 1 1 36 22639 1 1 15 LEU HD11 H -2.676 -1.653 7.208 1.00 . A A . 15 LEU HD11 1 1 36 22640 1 1 15 LEU HD12 H -3.933 -0.566 7.797 1.00 . A A . 15 LEU HD12 1 1 36 22641 1 1 15 LEU HD13 H -3.713 -2.147 8.546 1.00 . A A . 15 LEU HD13 1 1 36 22642 1 1 15 LEU HD21 H -6.565 -1.531 5.923 1.00 . A A . 15 LEU HD21 1 1 36 22643 1 1 15 LEU HD22 H -6.616 -2.349 7.485 1.00 . A A . 15 LEU HD22 1 1 36 22644 1 1 15 LEU HD23 H -5.993 -0.704 7.372 1.00 . A A . 15 LEU HD23 1 1 36 22645 1 1 15 LEU HG H -4.685 -3.271 6.797 1.00 . A A . 15 LEU HG 1 1 36 22646 1 1 15 LEU N N -5.013 -4.188 4.625 1.00 . A A . 15 LEU N 1 1 36 22647 1 1 15 LEU O O -2.274 -4.118 5.735 1.00 . A A . 15 LEU O 1 1 36 22648 1 1 16 LYS C C 0.299 -3.721 4.871 1.00 . A A . 16 LYS C 1 1 36 22649 1 1 16 LYS CA C -0.428 -4.359 3.687 1.00 . A A . 16 LYS CA 1 1 36 22650 1 1 16 LYS CB C 0.361 -4.118 2.399 1.00 . A A . 16 LYS CB 1 1 36 22651 1 1 16 LYS CD C 0.642 -4.616 -0.048 1.00 . A A . 16 LYS CD 1 1 36 22652 1 1 16 LYS CE C -0.001 -5.249 -1.271 1.00 . A A . 16 LYS CE 1 1 36 22653 1 1 16 LYS CG C -0.136 -4.935 1.218 1.00 . A A . 16 LYS CG 1 1 36 22654 1 1 16 LYS H H -2.095 -3.528 2.682 1.00 . A A . 16 LYS H 1 1 36 22655 1 1 16 LYS HA H -0.509 -5.423 3.855 1.00 . A A . 16 LYS HA 1 1 36 22656 1 1 16 LYS HB2 H 0.293 -3.072 2.139 1.00 . A A . 16 LYS HB2 1 1 36 22657 1 1 16 LYS HB3 H 1.397 -4.369 2.572 1.00 . A A . 16 LYS HB3 1 1 36 22658 1 1 16 LYS HD2 H 0.668 -3.545 -0.182 1.00 . A A . 16 LYS HD2 1 1 36 22659 1 1 16 LYS HD3 H 1.649 -4.993 0.055 1.00 . A A . 16 LYS HD3 1 1 36 22660 1 1 16 LYS HE2 H -0.310 -6.253 -1.021 1.00 . A A . 16 LYS HE2 1 1 36 22661 1 1 16 LYS HE3 H -0.866 -4.666 -1.551 1.00 . A A . 16 LYS HE3 1 1 36 22662 1 1 16 LYS HG2 H -0.020 -5.985 1.444 1.00 . A A . 16 LYS HG2 1 1 36 22663 1 1 16 LYS HG3 H -1.181 -4.714 1.054 1.00 . A A . 16 LYS HG3 1 1 36 22664 1 1 16 LYS HZ1 H 1.619 -4.522 -2.372 1.00 . A A . 16 LYS HZ1 1 1 36 22665 1 1 16 LYS HZ2 H 1.461 -6.206 -2.416 1.00 . A A . 16 LYS HZ2 1 1 36 22666 1 1 16 LYS HZ3 H 0.412 -5.234 -3.319 1.00 . A A . 16 LYS HZ3 1 1 36 22667 1 1 16 LYS N N -1.781 -3.830 3.559 1.00 . A A . 16 LYS N 1 1 36 22668 1 1 16 LYS NZ N 0.938 -5.307 -2.425 1.00 . A A . 16 LYS NZ 1 1 36 22669 1 1 16 LYS O O 0.189 -2.516 5.096 1.00 . A A . 16 LYS O 1 1 36 22670 1 1 17 PRO C C 2.716 -2.864 6.459 1.00 . A A . 17 PRO C 1 1 36 22671 1 1 17 PRO CA C 1.790 -4.022 6.812 1.00 . A A . 17 PRO CA 1 1 36 22672 1 1 17 PRO CB C 2.606 -5.237 7.282 1.00 . A A . 17 PRO CB 1 1 36 22673 1 1 17 PRO CD C 1.242 -5.965 5.459 1.00 . A A . 17 PRO CD 1 1 36 22674 1 1 17 PRO CG C 2.545 -6.218 6.158 1.00 . A A . 17 PRO CG 1 1 36 22675 1 1 17 PRO HA H 1.118 -3.713 7.600 1.00 . A A . 17 PRO HA 1 1 36 22676 1 1 17 PRO HB2 H 3.623 -4.932 7.483 1.00 . A A . 17 PRO HB2 1 1 36 22677 1 1 17 PRO HB3 H 2.164 -5.642 8.180 1.00 . A A . 17 PRO HB3 1 1 36 22678 1 1 17 PRO HD2 H 1.320 -6.212 4.410 1.00 . A A . 17 PRO HD2 1 1 36 22679 1 1 17 PRO HD3 H 0.445 -6.525 5.925 1.00 . A A . 17 PRO HD3 1 1 36 22680 1 1 17 PRO HG2 H 3.371 -6.054 5.483 1.00 . A A . 17 PRO HG2 1 1 36 22681 1 1 17 PRO HG3 H 2.572 -7.225 6.548 1.00 . A A . 17 PRO HG3 1 1 36 22682 1 1 17 PRO N N 1.050 -4.520 5.648 1.00 . A A . 17 PRO N 1 1 36 22683 1 1 17 PRO O O 3.362 -2.870 5.411 1.00 . A A . 17 PRO O 1 1 36 22684 1 1 18 ALA C C 5.028 -1.112 6.690 1.00 . A A . 18 ALA C 1 1 36 22685 1 1 18 ALA CA C 3.626 -0.702 7.131 1.00 . A A . 18 ALA CA 1 1 36 22686 1 1 18 ALA CB C 3.695 0.137 8.398 1.00 . A A . 18 ALA CB 1 1 36 22687 1 1 18 ALA H H 2.238 -1.925 8.160 1.00 . A A . 18 ALA H 1 1 36 22688 1 1 18 ALA HA H 3.176 -0.101 6.354 1.00 . A A . 18 ALA HA 1 1 36 22689 1 1 18 ALA HB1 H 4.166 -0.435 9.184 1.00 . A A . 18 ALA HB1 1 1 36 22690 1 1 18 ALA HB2 H 2.695 0.412 8.703 1.00 . A A . 18 ALA HB2 1 1 36 22691 1 1 18 ALA HB3 H 4.271 1.030 8.208 1.00 . A A . 18 ALA HB3 1 1 36 22692 1 1 18 ALA N N 2.777 -1.870 7.344 1.00 . A A . 18 ALA N 1 1 36 22693 1 1 18 ALA O O 5.519 -2.178 7.061 1.00 . A A . 18 ALA O 1 1 36 22694 1 1 19 GLY C C 6.982 -1.489 4.203 1.00 . A A . 19 GLY C 1 1 36 22695 1 1 19 GLY CA C 6.997 -0.563 5.406 1.00 . A A . 19 GLY CA 1 1 36 22696 1 1 19 GLY H H 5.222 0.568 5.620 1.00 . A A . 19 GLY H 1 1 36 22697 1 1 19 GLY HA2 H 7.560 -1.031 6.200 1.00 . A A . 19 GLY HA2 1 1 36 22698 1 1 19 GLY HA3 H 7.484 0.361 5.130 1.00 . A A . 19 GLY HA3 1 1 36 22699 1 1 19 GLY N N 5.663 -0.264 5.889 1.00 . A A . 19 GLY N 1 1 36 22700 1 1 19 GLY O O 8.029 -1.974 3.774 1.00 . A A . 19 GLY O 1 1 36 22701 1 1 20 THR C C 5.274 -1.789 1.263 1.00 . A A . 20 THR C 1 1 36 22702 1 1 20 THR CA C 5.650 -2.602 2.495 1.00 . A A . 20 THR CA 1 1 36 22703 1 1 20 THR CB C 4.590 -3.672 2.759 1.00 . A A . 20 THR CB 1 1 36 22704 1 1 20 THR CG2 C 4.474 -4.687 1.642 1.00 . A A . 20 THR CG2 1 1 36 22705 1 1 20 THR H H 4.994 -1.315 4.039 1.00 . A A . 20 THR H 1 1 36 22706 1 1 20 THR HA H 6.601 -3.082 2.320 1.00 . A A . 20 THR HA 1 1 36 22707 1 1 20 THR HB H 3.629 -3.192 2.871 1.00 . A A . 20 THR HB 1 1 36 22708 1 1 20 THR HG1 H 5.800 -4.642 3.955 1.00 . A A . 20 THR HG1 1 1 36 22709 1 1 20 THR HG21 H 5.422 -4.773 1.133 1.00 . A A . 20 THR HG21 1 1 36 22710 1 1 20 THR HG22 H 4.199 -5.647 2.055 1.00 . A A . 20 THR HG22 1 1 36 22711 1 1 20 THR HG23 H 3.716 -4.367 0.942 1.00 . A A . 20 THR HG23 1 1 36 22712 1 1 20 THR N N 5.794 -1.733 3.656 1.00 . A A . 20 THR N 1 1 36 22713 1 1 20 THR O O 4.207 -1.177 1.215 1.00 . A A . 20 THR O 1 1 36 22714 1 1 20 THR OG1 O 4.877 -4.378 3.953 1.00 . A A . 20 THR OG1 1 1 36 22715 1 1 21 THR C C 4.500 -1.208 -1.463 1.00 . A A . 21 THR C 1 1 36 22716 1 1 21 THR CA C 5.932 -1.035 -0.965 1.00 . A A . 21 THR CA 1 1 36 22717 1 1 21 THR CB C 6.917 -1.483 -2.040 1.00 . A A . 21 THR CB 1 1 36 22718 1 1 21 THR CG2 C 6.912 -2.977 -2.258 1.00 . A A . 21 THR CG2 1 1 36 22719 1 1 21 THR H H 6.995 -2.285 0.375 1.00 . A A . 21 THR H 1 1 36 22720 1 1 21 THR HA H 6.099 0.006 -0.754 1.00 . A A . 21 THR HA 1 1 36 22721 1 1 21 THR HB H 7.915 -1.195 -1.744 1.00 . A A . 21 THR HB 1 1 36 22722 1 1 21 THR HG1 H 7.218 -0.121 -3.415 1.00 . A A . 21 THR HG1 1 1 36 22723 1 1 21 THR HG21 H 6.039 -3.404 -1.786 1.00 . A A . 21 THR HG21 1 1 36 22724 1 1 21 THR HG22 H 6.888 -3.186 -3.317 1.00 . A A . 21 THR HG22 1 1 36 22725 1 1 21 THR HG23 H 7.803 -3.405 -1.824 1.00 . A A . 21 THR HG23 1 1 36 22726 1 1 21 THR N N 6.161 -1.780 0.271 1.00 . A A . 21 THR N 1 1 36 22727 1 1 21 THR O O 4.169 -2.209 -2.099 1.00 . A A . 21 THR O 1 1 36 22728 1 1 21 THR OG1 O 6.623 -0.862 -3.279 1.00 . A A . 21 THR OG1 1 1 36 22729 1 1 22 CYS C C 2.120 -0.240 -3.091 1.00 . A A . 22 CYS C 1 1 36 22730 1 1 22 CYS CA C 2.258 -0.268 -1.572 1.00 . A A . 22 CYS CA 1 1 36 22731 1 1 22 CYS CB C 1.487 0.903 -0.959 1.00 . A A . 22 CYS CB 1 1 36 22732 1 1 22 CYS H H 3.981 0.542 -0.649 1.00 . A A . 22 CYS H 1 1 36 22733 1 1 22 CYS HA H 1.836 -1.191 -1.205 1.00 . A A . 22 CYS HA 1 1 36 22734 1 1 22 CYS HB2 H 0.506 0.951 -1.406 1.00 . A A . 22 CYS HB2 1 1 36 22735 1 1 22 CYS HB3 H 1.383 0.736 0.102 1.00 . A A . 22 CYS HB3 1 1 36 22736 1 1 22 CYS N N 3.656 -0.227 -1.163 1.00 . A A . 22 CYS N 1 1 36 22737 1 1 22 CYS O O 1.064 -0.575 -3.628 1.00 . A A . 22 CYS O 1 1 36 22738 1 1 22 CYS SG S 2.277 2.530 -1.188 1.00 . A A . 22 CYS SG 1 1 36 22739 1 1 23 TRP C C 4.298 -0.539 -5.871 1.00 . A A . 23 TRP C 1 1 36 22740 1 1 23 TRP CA C 3.145 0.233 -5.239 1.00 . A A . 23 TRP CA 1 1 36 22741 1 1 23 TRP CB C 3.167 1.691 -5.707 1.00 . A A . 23 TRP CB 1 1 36 22742 1 1 23 TRP CD1 C 1.524 1.046 -7.554 1.00 . A A . 23 TRP CD1 1 1 36 22743 1 1 23 TRP CD2 C 1.732 3.250 -7.246 1.00 . A A . 23 TRP CD2 1 1 36 22744 1 1 23 TRP CE2 C 0.803 3.027 -8.279 1.00 . A A . 23 TRP CE2 1 1 36 22745 1 1 23 TRP CE3 C 2.025 4.564 -6.876 1.00 . A A . 23 TRP CE3 1 1 36 22746 1 1 23 TRP CG C 2.178 1.969 -6.794 1.00 . A A . 23 TRP CG 1 1 36 22747 1 1 23 TRP CH2 C 0.472 5.344 -8.563 1.00 . A A . 23 TRP CH2 1 1 36 22748 1 1 23 TRP CZ2 C 0.166 4.068 -8.944 1.00 . A A . 23 TRP CZ2 1 1 36 22749 1 1 23 TRP CZ3 C 1.393 5.599 -7.539 1.00 . A A . 23 TRP CZ3 1 1 36 22750 1 1 23 TRP H H 3.997 0.427 -3.310 1.00 . A A . 23 TRP H 1 1 36 22751 1 1 23 TRP HA H 2.221 -0.217 -5.561 1.00 . A A . 23 TRP HA 1 1 36 22752 1 1 23 TRP HB2 H 2.935 2.335 -4.872 1.00 . A A . 23 TRP HB2 1 1 36 22753 1 1 23 TRP HB3 H 4.150 1.933 -6.081 1.00 . A A . 23 TRP HB3 1 1 36 22754 1 1 23 TRP HD1 H 1.654 -0.020 -7.452 1.00 . A A . 23 TRP HD1 1 1 36 22755 1 1 23 TRP HE1 H 0.116 1.224 -9.101 1.00 . A A . 23 TRP HE1 1 1 36 22756 1 1 23 TRP HE3 H 2.732 4.777 -6.090 1.00 . A A . 23 TRP HE3 1 1 36 22757 1 1 23 TRP HH2 H 0.004 6.182 -9.056 1.00 . A A . 23 TRP HH2 1 1 36 22758 1 1 23 TRP HZ2 H -0.548 3.888 -9.732 1.00 . A A . 23 TRP HZ2 1 1 36 22759 1 1 23 TRP HZ3 H 1.608 6.622 -7.268 1.00 . A A . 23 TRP HZ3 1 1 36 22760 1 1 23 TRP N N 3.181 0.165 -3.784 1.00 . A A . 23 TRP N 1 1 36 22761 1 1 23 TRP NE1 N 0.693 1.672 -8.448 1.00 . A A . 23 TRP NE1 1 1 36 22762 1 1 23 TRP O O 4.110 -1.640 -6.388 1.00 . A A . 23 TRP O 1 1 36 22763 1 1 24 LYS C C 6.540 -0.670 -7.939 1.00 . A A . 24 LYS C 1 1 36 22764 1 1 24 LYS CA C 6.666 -0.579 -6.419 1.00 . A A . 24 LYS CA 1 1 36 22765 1 1 24 LYS CB C 6.875 -1.976 -5.827 1.00 . A A . 24 LYS CB 1 1 36 22766 1 1 24 LYS CD C 8.767 -3.612 -5.577 1.00 . A A . 24 LYS CD 1 1 36 22767 1 1 24 LYS CE C 10.147 -3.856 -4.987 1.00 . A A . 24 LYS CE 1 1 36 22768 1 1 24 LYS CG C 8.277 -2.203 -5.284 1.00 . A A . 24 LYS CG 1 1 36 22769 1 1 24 LYS H H 5.570 0.928 -5.419 1.00 . A A . 24 LYS H 1 1 36 22770 1 1 24 LYS HA H 7.520 0.035 -6.178 1.00 . A A . 24 LYS HA 1 1 36 22771 1 1 24 LYS HB2 H 6.172 -2.120 -5.021 1.00 . A A . 24 LYS HB2 1 1 36 22772 1 1 24 LYS HB3 H 6.685 -2.712 -6.594 1.00 . A A . 24 LYS HB3 1 1 36 22773 1 1 24 LYS HD2 H 8.074 -4.320 -5.148 1.00 . A A . 24 LYS HD2 1 1 36 22774 1 1 24 LYS HD3 H 8.812 -3.752 -6.647 1.00 . A A . 24 LYS HD3 1 1 36 22775 1 1 24 LYS HE2 H 10.835 -3.136 -5.405 1.00 . A A . 24 LYS HE2 1 1 36 22776 1 1 24 LYS HE3 H 10.095 -3.724 -3.916 1.00 . A A . 24 LYS HE3 1 1 36 22777 1 1 24 LYS HG2 H 8.950 -1.496 -5.745 1.00 . A A . 24 LYS HG2 1 1 36 22778 1 1 24 LYS HG3 H 8.268 -2.050 -4.215 1.00 . A A . 24 LYS HG3 1 1 36 22779 1 1 24 LYS HZ1 H 10.283 -5.547 -6.205 1.00 . A A . 24 LYS HZ1 1 1 36 22780 1 1 24 LYS HZ2 H 11.683 -5.234 -5.308 1.00 . A A . 24 LYS HZ2 1 1 36 22781 1 1 24 LYS HZ3 H 10.322 -5.891 -4.549 1.00 . A A . 24 LYS HZ3 1 1 36 22782 1 1 24 LYS N N 5.486 0.049 -5.838 1.00 . A A . 24 LYS N 1 1 36 22783 1 1 24 LYS NZ N 10.643 -5.228 -5.283 1.00 . A A . 24 LYS NZ 1 1 36 22784 1 1 24 LYS O O 7.189 -1.502 -8.574 1.00 . A A . 24 LYS O 1 1 36 22785 1 1 25 THR C C 6.834 0.352 -10.694 1.00 . A A . 25 THR C 1 1 36 22786 1 1 25 THR CA C 5.501 0.202 -9.965 1.00 . A A . 25 THR CA 1 1 36 22787 1 1 25 THR CB C 4.542 1.333 -10.361 1.00 . A A . 25 THR CB 1 1 36 22788 1 1 25 THR CG2 C 5.139 2.714 -10.194 1.00 . A A . 25 THR CG2 1 1 36 22789 1 1 25 THR H H 5.214 0.831 -7.963 1.00 . A A . 25 THR H 1 1 36 22790 1 1 25 THR HA H 5.060 -0.743 -10.245 1.00 . A A . 25 THR HA 1 1 36 22791 1 1 25 THR HB H 3.661 1.279 -9.736 1.00 . A A . 25 THR HB 1 1 36 22792 1 1 25 THR HG1 H 4.770 1.623 -12.290 1.00 . A A . 25 THR HG1 1 1 36 22793 1 1 25 THR HG21 H 6.102 2.630 -9.715 1.00 . A A . 25 THR HG21 1 1 36 22794 1 1 25 THR HG22 H 5.258 3.176 -11.163 1.00 . A A . 25 THR HG22 1 1 36 22795 1 1 25 THR HG23 H 4.485 3.318 -9.583 1.00 . A A . 25 THR HG23 1 1 36 22796 1 1 25 THR N N 5.704 0.190 -8.519 1.00 . A A . 25 THR N 1 1 36 22797 1 1 25 THR O O 7.876 0.539 -10.067 1.00 . A A . 25 THR O 1 1 36 22798 1 1 25 THR OG1 O 4.132 1.197 -11.713 1.00 . A A . 25 THR OG1 1 1 36 22799 1 1 26 SER C C 8.362 1.834 -13.113 1.00 . A A . 26 SER C 1 1 36 22800 1 1 26 SER CA C 8.003 0.374 -12.829 1.00 . A A . 26 SER CA 1 1 36 22801 1 1 26 SER CB C 7.826 -0.381 -14.148 1.00 . A A . 26 SER CB 1 1 36 22802 1 1 26 SER H H 5.935 0.100 -12.460 1.00 . A A . 26 SER H 1 1 36 22803 1 1 26 SER HA H 8.813 -0.079 -12.277 1.00 . A A . 26 SER HA 1 1 36 22804 1 1 26 SER HB2 H 8.739 -0.319 -14.721 1.00 . A A . 26 SER HB2 1 1 36 22805 1 1 26 SER HB3 H 7.601 -1.416 -13.940 1.00 . A A . 26 SER HB3 1 1 36 22806 1 1 26 SER HG H 5.929 -0.140 -14.571 1.00 . A A . 26 SER HG 1 1 36 22807 1 1 26 SER N N 6.794 0.258 -12.018 1.00 . A A . 26 SER N 1 1 36 22808 1 1 26 SER O O 9.210 2.113 -13.960 1.00 . A A . 26 SER O 1 1 36 22809 1 1 26 SER OG O 6.770 0.171 -14.914 1.00 . A A . 26 SER OG 1 1 36 22810 1 1 27 VAL C C 7.515 5.007 -11.406 1.00 . A A . 27 VAL C 1 1 36 22811 1 1 27 VAL CA C 7.989 4.184 -12.600 1.00 . A A . 27 VAL CA 1 1 36 22812 1 1 27 VAL CB C 7.308 4.717 -13.875 1.00 . A A . 27 VAL CB 1 1 36 22813 1 1 27 VAL CG1 C 8.104 4.329 -15.111 1.00 . A A . 27 VAL CG1 1 1 36 22814 1 1 27 VAL CG2 C 5.877 4.209 -13.972 1.00 . A A . 27 VAL CG2 1 1 36 22815 1 1 27 VAL H H 7.055 2.490 -11.745 1.00 . A A . 27 VAL H 1 1 36 22816 1 1 27 VAL HA H 9.056 4.309 -12.709 1.00 . A A . 27 VAL HA 1 1 36 22817 1 1 27 VAL HB H 7.280 5.795 -13.818 1.00 . A A . 27 VAL HB 1 1 36 22818 1 1 27 VAL HG11 H 9.159 4.343 -14.879 1.00 . A A . 27 VAL HG11 1 1 36 22819 1 1 27 VAL HG12 H 7.818 3.336 -15.426 1.00 . A A . 27 VAL HG12 1 1 36 22820 1 1 27 VAL HG13 H 7.901 5.031 -15.906 1.00 . A A . 27 VAL HG13 1 1 36 22821 1 1 27 VAL HG21 H 5.364 4.398 -13.040 1.00 . A A . 27 VAL HG21 1 1 36 22822 1 1 27 VAL HG22 H 5.367 4.721 -14.774 1.00 . A A . 27 VAL HG22 1 1 36 22823 1 1 27 VAL HG23 H 5.884 3.148 -14.170 1.00 . A A . 27 VAL HG23 1 1 36 22824 1 1 27 VAL N N 7.720 2.763 -12.407 1.00 . A A . 27 VAL N 1 1 36 22825 1 1 27 VAL O O 7.165 6.179 -11.551 1.00 . A A . 27 VAL O 1 1 36 22826 1 1 28 SER C C 6.879 4.075 -7.861 1.00 . A A . 28 SER C 1 1 36 22827 1 1 28 SER CA C 7.072 5.070 -9.003 1.00 . A A . 28 SER CA 1 1 36 22828 1 1 28 SER CB C 5.766 5.836 -9.246 1.00 . A A . 28 SER CB 1 1 36 22829 1 1 28 SER H H 7.797 3.457 -10.173 1.00 . A A . 28 SER H 1 1 36 22830 1 1 28 SER HA H 7.843 5.772 -8.725 1.00 . A A . 28 SER HA 1 1 36 22831 1 1 28 SER HB2 H 5.399 5.613 -10.237 1.00 . A A . 28 SER HB2 1 1 36 22832 1 1 28 SER HB3 H 5.030 5.535 -8.514 1.00 . A A . 28 SER HB3 1 1 36 22833 1 1 28 SER HG H 6.134 7.466 -8.223 1.00 . A A . 28 SER HG 1 1 36 22834 1 1 28 SER N N 7.505 4.391 -10.225 1.00 . A A . 28 SER N 1 1 36 22835 1 1 28 SER O O 5.799 3.507 -7.698 1.00 . A A . 28 SER O 1 1 36 22836 1 1 28 SER OG O 5.968 7.235 -9.140 1.00 . A A . 28 SER OG 1 1 36 22837 1 1 29 SER C C 7.537 3.691 -4.652 1.00 . A A . 29 SER C 1 1 36 22838 1 1 29 SER CA C 7.859 2.946 -5.943 1.00 . A A . 29 SER CA 1 1 36 22839 1 1 29 SER CB C 9.179 2.187 -5.796 1.00 . A A . 29 SER CB 1 1 36 22840 1 1 29 SER H H 8.761 4.354 -7.245 1.00 . A A . 29 SER H 1 1 36 22841 1 1 29 SER HA H 7.066 2.240 -6.143 1.00 . A A . 29 SER HA 1 1 36 22842 1 1 29 SER HB2 H 9.956 2.875 -5.495 1.00 . A A . 29 SER HB2 1 1 36 22843 1 1 29 SER HB3 H 9.068 1.419 -5.045 1.00 . A A . 29 SER HB3 1 1 36 22844 1 1 29 SER HG H 8.841 1.025 -7.337 1.00 . A A . 29 SER HG 1 1 36 22845 1 1 29 SER N N 7.926 3.871 -7.070 1.00 . A A . 29 SER N 1 1 36 22846 1 1 29 SER O O 8.134 4.726 -4.355 1.00 . A A . 29 SER O 1 1 36 22847 1 1 29 SER OG O 9.558 1.580 -7.019 1.00 . A A . 29 SER OG 1 1 36 22848 1 1 30 HIS C C 6.238 2.778 -1.488 1.00 . A A . 30 HIS C 1 1 36 22849 1 1 30 HIS CA C 6.174 3.782 -2.637 1.00 . A A . 30 HIS CA 1 1 36 22850 1 1 30 HIS CB C 4.760 4.348 -2.781 1.00 . A A . 30 HIS CB 1 1 36 22851 1 1 30 HIS CD2 C 4.961 5.148 -5.237 1.00 . A A . 30 HIS CD2 1 1 36 22852 1 1 30 HIS CE1 C 4.094 7.147 -4.998 1.00 . A A . 30 HIS CE1 1 1 36 22853 1 1 30 HIS CG C 4.619 5.290 -3.935 1.00 . A A . 30 HIS CG 1 1 36 22854 1 1 30 HIS H H 6.139 2.337 -4.186 1.00 . A A . 30 HIS H 1 1 36 22855 1 1 30 HIS HA H 6.856 4.592 -2.430 1.00 . A A . 30 HIS HA 1 1 36 22856 1 1 30 HIS HB2 H 4.066 3.534 -2.930 1.00 . A A . 30 HIS HB2 1 1 36 22857 1 1 30 HIS HB3 H 4.496 4.883 -1.881 1.00 . A A . 30 HIS HB3 1 1 36 22858 1 1 30 HIS HD1 H 3.735 6.953 -2.993 1.00 . A A . 30 HIS HD1 1 1 36 22859 1 1 30 HIS HD2 H 5.408 4.274 -5.690 1.00 . A A . 30 HIS HD2 1 1 36 22860 1 1 30 HIS HE1 H 3.735 8.143 -5.208 1.00 . A A . 30 HIS HE1 1 1 36 22861 1 1 30 HIS HE2 H 4.846 6.541 -6.804 1.00 . A A . 30 HIS HE2 1 1 36 22862 1 1 30 HIS N N 6.583 3.162 -3.892 1.00 . A A . 30 HIS N 1 1 36 22863 1 1 30 HIS ND1 N 4.080 6.553 -3.818 1.00 . A A . 30 HIS ND1 1 1 36 22864 1 1 30 HIS NE2 N 4.625 6.316 -5.876 1.00 . A A . 30 HIS NE2 1 1 36 22865 1 1 30 HIS O O 6.922 1.761 -1.586 1.00 . A A . 30 HIS O 1 1 36 22866 1 1 31 TYR C C 4.246 2.369 1.583 1.00 . A A . 31 TYR C 1 1 36 22867 1 1 31 TYR CA C 5.519 2.187 0.765 1.00 . A A . 31 TYR CA 1 1 36 22868 1 1 31 TYR CB C 6.748 2.445 1.638 1.00 . A A . 31 TYR CB 1 1 36 22869 1 1 31 TYR CD1 C 7.942 0.231 1.452 1.00 . A A . 31 TYR CD1 1 1 36 22870 1 1 31 TYR CD2 C 9.072 2.184 0.685 1.00 . A A . 31 TYR CD2 1 1 36 22871 1 1 31 TYR CE1 C 9.029 -0.544 1.097 1.00 . A A . 31 TYR CE1 1 1 36 22872 1 1 31 TYR CE2 C 10.164 1.417 0.327 1.00 . A A . 31 TYR CE2 1 1 36 22873 1 1 31 TYR CG C 7.944 1.605 1.253 1.00 . A A . 31 TYR CG 1 1 36 22874 1 1 31 TYR CZ C 10.138 0.054 0.535 1.00 . A A . 31 TYR CZ 1 1 36 22875 1 1 31 TYR H H 5.008 3.898 -0.370 1.00 . A A . 31 TYR H 1 1 36 22876 1 1 31 TYR HA H 5.554 1.172 0.407 1.00 . A A . 31 TYR HA 1 1 36 22877 1 1 31 TYR HB2 H 7.030 3.484 1.554 1.00 . A A . 31 TYR HB2 1 1 36 22878 1 1 31 TYR HB3 H 6.503 2.225 2.667 1.00 . A A . 31 TYR HB3 1 1 36 22879 1 1 31 TYR HD1 H 7.073 -0.233 1.893 1.00 . A A . 31 TYR HD1 1 1 36 22880 1 1 31 TYR HD2 H 9.089 3.252 0.524 1.00 . A A . 31 TYR HD2 1 1 36 22881 1 1 31 TYR HE1 H 9.006 -1.611 1.258 1.00 . A A . 31 TYR HE1 1 1 36 22882 1 1 31 TYR HE2 H 11.032 1.885 -0.113 1.00 . A A . 31 TYR HE2 1 1 36 22883 1 1 31 TYR HH H 10.930 -1.454 -0.358 1.00 . A A . 31 TYR HH 1 1 36 22884 1 1 31 TYR N N 5.530 3.070 -0.396 1.00 . A A . 31 TYR N 1 1 36 22885 1 1 31 TYR O O 3.866 3.491 1.919 1.00 . A A . 31 TYR O 1 1 36 22886 1 1 31 TYR OH O 11.223 -0.714 0.179 1.00 . A A . 31 TYR OH 1 1 36 22887 1 1 32 CYS C C 2.658 1.596 4.142 1.00 . A A . 32 CYS C 1 1 36 22888 1 1 32 CYS CA C 2.360 1.292 2.680 1.00 . A A . 32 CYS CA 1 1 36 22889 1 1 32 CYS CB C 1.615 -0.041 2.564 1.00 . A A . 32 CYS CB 1 1 36 22890 1 1 32 CYS H H 3.942 0.390 1.605 1.00 . A A . 32 CYS H 1 1 36 22891 1 1 32 CYS HA H 1.739 2.078 2.281 1.00 . A A . 32 CYS HA 1 1 36 22892 1 1 32 CYS HB2 H 1.805 -0.467 1.591 1.00 . A A . 32 CYS HB2 1 1 36 22893 1 1 32 CYS HB3 H 1.983 -0.715 3.323 1.00 . A A . 32 CYS HB3 1 1 36 22894 1 1 32 CYS N N 3.590 1.256 1.900 1.00 . A A . 32 CYS N 1 1 36 22895 1 1 32 CYS O O 3.715 1.234 4.659 1.00 . A A . 32 CYS O 1 1 36 22896 1 1 32 CYS SG S -0.193 0.090 2.767 1.00 . A A . 32 CYS SG 1 1 36 22897 1 1 33 THR C C 1.037 1.703 7.093 1.00 . A A . 33 THR C 1 1 36 22898 1 1 33 THR CA C 1.881 2.614 6.208 1.00 . A A . 33 THR CA 1 1 36 22899 1 1 33 THR CB C 1.490 4.075 6.439 1.00 . A A . 33 THR CB 1 1 36 22900 1 1 33 THR CG2 C 1.999 5.011 5.364 1.00 . A A . 33 THR CG2 1 1 36 22901 1 1 33 THR H H 0.900 2.522 4.337 1.00 . A A . 33 THR H 1 1 36 22902 1 1 33 THR HA H 2.922 2.483 6.466 1.00 . A A . 33 THR HA 1 1 36 22903 1 1 33 THR HB H 1.901 4.401 7.384 1.00 . A A . 33 THR HB 1 1 36 22904 1 1 33 THR HG1 H -0.146 4.931 7.092 1.00 . A A . 33 THR HG1 1 1 36 22905 1 1 33 THR HG21 H 3.075 4.936 5.301 1.00 . A A . 33 THR HG21 1 1 36 22906 1 1 33 THR HG22 H 1.563 4.739 4.413 1.00 . A A . 33 THR HG22 1 1 36 22907 1 1 33 THR HG23 H 1.723 6.026 5.609 1.00 . A A . 33 THR HG23 1 1 36 22908 1 1 33 THR N N 1.721 2.263 4.803 1.00 . A A . 33 THR N 1 1 36 22909 1 1 33 THR O O 0.756 2.030 8.246 1.00 . A A . 33 THR O 1 1 36 22910 1 1 33 THR OG1 O 0.081 4.213 6.497 1.00 . A A . 33 THR OG1 1 1 36 22911 1 1 34 GLY C C -1.332 0.284 8.029 1.00 . A A . 34 GLY C 1 1 36 22912 1 1 34 GLY CA C -0.179 -0.384 7.302 1.00 . A A . 34 GLY CA 1 1 36 22913 1 1 34 GLY H H 0.887 0.348 5.621 1.00 . A A . 34 GLY H 1 1 36 22914 1 1 34 GLY HA2 H 0.449 -0.880 8.027 1.00 . A A . 34 GLY HA2 1 1 36 22915 1 1 34 GLY HA3 H -0.579 -1.122 6.624 1.00 . A A . 34 GLY HA3 1 1 36 22916 1 1 34 GLY N N 0.632 0.557 6.546 1.00 . A A . 34 GLY N 1 1 36 22917 1 1 34 GLY O O -1.542 0.051 9.219 1.00 . A A . 34 GLY O 1 1 36 22918 1 1 35 ARG C C -4.440 1.746 7.001 1.00 . A A . 35 ARG C 1 1 36 22919 1 1 35 ARG CA C -3.213 1.824 7.902 1.00 . A A . 35 ARG CA 1 1 36 22920 1 1 35 ARG CB C -2.850 3.287 8.163 1.00 . A A . 35 ARG CB 1 1 36 22921 1 1 35 ARG CD C -4.758 4.604 9.133 1.00 . A A . 35 ARG CD 1 1 36 22922 1 1 35 ARG CG C -3.471 3.851 9.430 1.00 . A A . 35 ARG CG 1 1 36 22923 1 1 35 ARG CZ C -5.498 6.954 9.090 1.00 . A A . 35 ARG CZ 1 1 36 22924 1 1 35 ARG H H -1.861 1.267 6.369 1.00 . A A . 35 ARG H 1 1 36 22925 1 1 35 ARG HA H -3.444 1.349 8.840 1.00 . A A . 35 ARG HA 1 1 36 22926 1 1 35 ARG HB2 H -1.777 3.371 8.246 1.00 . A A . 35 ARG HB2 1 1 36 22927 1 1 35 ARG HB3 H -3.185 3.884 7.327 1.00 . A A . 35 ARG HB3 1 1 36 22928 1 1 35 ARG HD2 H -5.175 4.228 8.210 1.00 . A A . 35 ARG HD2 1 1 36 22929 1 1 35 ARG HD3 H -5.456 4.431 9.939 1.00 . A A . 35 ARG HD3 1 1 36 22930 1 1 35 ARG HE H -3.615 6.343 8.836 1.00 . A A . 35 ARG HE 1 1 36 22931 1 1 35 ARG HG2 H -3.691 3.037 10.105 1.00 . A A . 35 ARG HG2 1 1 36 22932 1 1 35 ARG HG3 H -2.768 4.527 9.894 1.00 . A A . 35 ARG HG3 1 1 36 22933 1 1 35 ARG HH11 H -6.979 5.615 9.412 1.00 . A A . 35 ARG HH11 1 1 36 22934 1 1 35 ARG HH12 H -7.473 7.274 9.378 1.00 . A A . 35 ARG HH12 1 1 36 22935 1 1 35 ARG HH21 H -4.263 8.526 8.790 1.00 . A A . 35 ARG HH21 1 1 36 22936 1 1 35 ARG HH22 H -5.932 8.927 9.024 1.00 . A A . 35 ARG HH22 1 1 36 22937 1 1 35 ARG N N -2.079 1.120 7.313 1.00 . A A . 35 ARG N 1 1 36 22938 1 1 35 ARG NE N -4.533 6.041 9.000 1.00 . A A . 35 ARG NE 1 1 36 22939 1 1 35 ARG NH1 N -6.753 6.583 9.311 1.00 . A A . 35 ARG NH1 1 1 36 22940 1 1 35 ARG NH2 N -5.207 8.241 8.957 1.00 . A A . 35 ARG NH2 1 1 36 22941 1 1 35 ARG O O -5.550 1.491 7.467 1.00 . A A . 35 ARG O 1 1 36 22942 1 1 36 SER C C -4.852 1.366 3.406 1.00 . A A . 36 SER C 1 1 36 22943 1 1 36 SER CA C -5.324 1.929 4.742 1.00 . A A . 36 SER CA 1 1 36 22944 1 1 36 SER CB C -5.905 3.330 4.539 1.00 . A A . 36 SER CB 1 1 36 22945 1 1 36 SER H H -3.326 2.171 5.401 1.00 . A A . 36 SER H 1 1 36 22946 1 1 36 SER HA H -6.094 1.285 5.137 1.00 . A A . 36 SER HA 1 1 36 22947 1 1 36 SER HB2 H -5.128 4.065 4.687 1.00 . A A . 36 SER HB2 1 1 36 22948 1 1 36 SER HB3 H -6.294 3.414 3.535 1.00 . A A . 36 SER HB3 1 1 36 22949 1 1 36 SER HG H -6.589 3.693 6.339 1.00 . A A . 36 SER HG 1 1 36 22950 1 1 36 SER N N -4.233 1.970 5.710 1.00 . A A . 36 SER N 1 1 36 22951 1 1 36 SER O O -3.664 1.109 3.212 1.00 . A A . 36 SER O 1 1 36 22952 1 1 36 SER OG O -6.954 3.585 5.458 1.00 . A A . 36 SER OG 1 1 36 22953 1 1 37 CYS C C -4.929 1.739 0.248 1.00 . A A . 37 CYS C 1 1 36 22954 1 1 37 CYS CA C -5.482 0.648 1.166 1.00 . A A . 37 CYS CA 1 1 36 22955 1 1 37 CYS CB C -6.733 0.028 0.541 1.00 . A A . 37 CYS CB 1 1 36 22956 1 1 37 CYS H H -6.722 1.406 2.704 1.00 . A A . 37 CYS H 1 1 36 22957 1 1 37 CYS HA H -4.733 -0.119 1.285 1.00 . A A . 37 CYS HA 1 1 36 22958 1 1 37 CYS HB2 H -7.102 -0.752 1.189 1.00 . A A . 37 CYS HB2 1 1 36 22959 1 1 37 CYS HB3 H -7.490 0.791 0.439 1.00 . A A . 37 CYS HB3 1 1 36 22960 1 1 37 CYS N N -5.794 1.179 2.488 1.00 . A A . 37 CYS N 1 1 36 22961 1 1 37 CYS O O -4.556 1.470 -0.894 1.00 . A A . 37 CYS O 1 1 36 22962 1 1 37 CYS SG S -6.458 -0.704 -1.104 1.00 . A A . 37 CYS SG 1 1 36 22963 1 1 38 GLU C C -2.852 4.131 -0.024 1.00 . A A . 38 GLU C 1 1 36 22964 1 1 38 GLU CA C -4.378 4.093 -0.033 1.00 . A A . 38 GLU CA 1 1 36 22965 1 1 38 GLU CB C -4.934 5.410 0.512 1.00 . A A . 38 GLU CB 1 1 36 22966 1 1 38 GLU CD C -4.459 6.997 2.419 1.00 . A A . 38 GLU CD 1 1 36 22967 1 1 38 GLU CG C -4.762 5.568 2.014 1.00 . A A . 38 GLU CG 1 1 36 22968 1 1 38 GLU H H -5.197 3.128 1.664 1.00 . A A . 38 GLU H 1 1 36 22969 1 1 38 GLU HA H -4.716 3.965 -1.050 1.00 . A A . 38 GLU HA 1 1 36 22970 1 1 38 GLU HB2 H -4.428 6.230 0.025 1.00 . A A . 38 GLU HB2 1 1 36 22971 1 1 38 GLU HB3 H -5.989 5.464 0.285 1.00 . A A . 38 GLU HB3 1 1 36 22972 1 1 38 GLU HG2 H -5.673 5.258 2.503 1.00 . A A . 38 GLU HG2 1 1 36 22973 1 1 38 GLU HG3 H -3.948 4.937 2.338 1.00 . A A . 38 GLU HG3 1 1 36 22974 1 1 38 GLU N N -4.882 2.970 0.749 1.00 . A A . 38 GLU N 1 1 36 22975 1 1 38 GLU O O -2.229 4.222 1.034 1.00 . A A . 38 GLU O 1 1 36 22976 1 1 38 GLU OE1 O -5.365 7.667 2.958 1.00 . A A . 38 GLU OE1 1 1 36 22977 1 1 38 GLU OE2 O -3.315 7.447 2.197 1.00 . A A . 38 GLU OE2 1 1 36 22978 1 1 39 CYS C C -0.320 5.539 -1.538 1.00 . A A . 39 CYS C 1 1 36 22979 1 1 39 CYS CA C -0.806 4.101 -1.348 1.00 . A A . 39 CYS CA 1 1 36 22980 1 1 39 CYS CB C -0.368 3.236 -2.535 1.00 . A A . 39 CYS CB 1 1 36 22981 1 1 39 CYS H H -2.811 4.001 -2.019 1.00 . A A . 39 CYS H 1 1 36 22982 1 1 39 CYS HA H -0.378 3.699 -0.442 1.00 . A A . 39 CYS HA 1 1 36 22983 1 1 39 CYS HB2 H -0.644 2.211 -2.344 1.00 . A A . 39 CYS HB2 1 1 36 22984 1 1 39 CYS HB3 H -0.877 3.579 -3.426 1.00 . A A . 39 CYS HB3 1 1 36 22985 1 1 39 CYS N N -2.258 4.067 -1.212 1.00 . A A . 39 CYS N 1 1 36 22986 1 1 39 CYS O O -0.647 6.182 -2.535 1.00 . A A . 39 CYS O 1 1 36 22987 1 1 39 CYS SG S 1.423 3.269 -2.877 1.00 . A A . 39 CYS SG 1 1 36 22988 1 1 40 PRO C C 1.502 7.798 -2.042 1.00 . A A . 40 PRO C 1 1 36 22989 1 1 40 PRO CA C 0.986 7.437 -0.652 1.00 . A A . 40 PRO CA 1 1 36 22990 1 1 40 PRO CB C 2.131 7.421 0.358 1.00 . A A . 40 PRO CB 1 1 36 22991 1 1 40 PRO CD C 0.907 5.379 0.650 1.00 . A A . 40 PRO CD 1 1 36 22992 1 1 40 PRO CG C 1.707 6.426 1.382 1.00 . A A . 40 PRO CG 1 1 36 22993 1 1 40 PRO HA H 0.244 8.160 -0.347 1.00 . A A . 40 PRO HA 1 1 36 22994 1 1 40 PRO HB2 H 3.045 7.122 -0.133 1.00 . A A . 40 PRO HB2 1 1 36 22995 1 1 40 PRO HB3 H 2.250 8.404 0.788 1.00 . A A . 40 PRO HB3 1 1 36 22996 1 1 40 PRO HD2 H 1.529 4.530 0.412 1.00 . A A . 40 PRO HD2 1 1 36 22997 1 1 40 PRO HD3 H 0.059 5.071 1.243 1.00 . A A . 40 PRO HD3 1 1 36 22998 1 1 40 PRO HG2 H 2.577 5.979 1.840 1.00 . A A . 40 PRO HG2 1 1 36 22999 1 1 40 PRO HG3 H 1.095 6.908 2.130 1.00 . A A . 40 PRO HG3 1 1 36 23000 1 1 40 PRO N N 0.466 6.069 -0.580 1.00 . A A . 40 PRO N 1 1 36 23001 1 1 40 PRO O O 1.703 6.925 -2.887 1.00 . A A . 40 PRO O 1 1 36 23002 1 1 41 SER C C 3.676 9.947 -3.482 1.00 . A A . 41 SER C 1 1 36 23003 1 1 41 SER CA C 2.200 9.567 -3.562 1.00 . A A . 41 SER CA 1 1 36 23004 1 1 41 SER CB C 1.377 10.769 -4.029 1.00 . A A . 41 SER CB 1 1 36 23005 1 1 41 SER H H 1.530 9.739 -1.561 1.00 . A A . 41 SER H 1 1 36 23006 1 1 41 SER HA H 2.086 8.765 -4.276 1.00 . A A . 41 SER HA 1 1 36 23007 1 1 41 SER HB2 H 1.482 10.881 -5.098 1.00 . A A . 41 SER HB2 1 1 36 23008 1 1 41 SER HB3 H 0.338 10.607 -3.785 1.00 . A A . 41 SER HB3 1 1 36 23009 1 1 41 SER HG H 1.260 12.143 -2.638 1.00 . A A . 41 SER HG 1 1 36 23010 1 1 41 SER N N 1.711 9.090 -2.273 1.00 . A A . 41 SER N 1 1 36 23011 1 1 41 SER O O 4.149 10.795 -4.239 1.00 . A A . 41 SER O 1 1 36 23012 1 1 41 SER OG O 1.814 11.962 -3.401 1.00 . A A . 41 SER OG 1 1 36 23013 1 1 42 TYR C C 6.570 8.325 -1.970 1.00 . A A . 42 TYR C 1 1 36 23014 1 1 42 TYR CA C 5.820 9.588 -2.390 1.00 . A A . 42 TYR CA 1 1 36 23015 1 1 42 TYR CB C 6.027 10.691 -1.349 1.00 . A A . 42 TYR CB 1 1 36 23016 1 1 42 TYR CD1 C 4.350 10.511 0.530 1.00 . A A . 42 TYR CD1 1 1 36 23017 1 1 42 TYR CD2 C 6.551 9.675 0.901 1.00 . A A . 42 TYR CD2 1 1 36 23018 1 1 42 TYR CE1 C 3.989 10.141 1.812 1.00 . A A . 42 TYR CE1 1 1 36 23019 1 1 42 TYR CE2 C 6.198 9.302 2.184 1.00 . A A . 42 TYR CE2 1 1 36 23020 1 1 42 TYR CG C 5.635 10.285 0.054 1.00 . A A . 42 TYR CG 1 1 36 23021 1 1 42 TYR CZ C 4.916 9.537 2.634 1.00 . A A . 42 TYR CZ 1 1 36 23022 1 1 42 TYR H H 3.967 8.648 -1.990 1.00 . A A . 42 TYR H 1 1 36 23023 1 1 42 TYR HA H 6.210 9.925 -3.339 1.00 . A A . 42 TYR HA 1 1 36 23024 1 1 42 TYR HB2 H 7.069 10.971 -1.334 1.00 . A A . 42 TYR HB2 1 1 36 23025 1 1 42 TYR HB3 H 5.433 11.551 -1.625 1.00 . A A . 42 TYR HB3 1 1 36 23026 1 1 42 TYR HD1 H 3.626 10.984 -0.116 1.00 . A A . 42 TYR HD1 1 1 36 23027 1 1 42 TYR HD2 H 7.555 9.493 0.546 1.00 . A A . 42 TYR HD2 1 1 36 23028 1 1 42 TYR HE1 H 2.985 10.325 2.164 1.00 . A A . 42 TYR HE1 1 1 36 23029 1 1 42 TYR HE2 H 6.925 8.829 2.827 1.00 . A A . 42 TYR HE2 1 1 36 23030 1 1 42 TYR HH H 4.503 9.947 4.467 1.00 . A A . 42 TYR HH 1 1 36 23031 1 1 42 TYR N N 4.399 9.315 -2.564 1.00 . A A . 42 TYR N 1 1 36 23032 1 1 42 TYR O O 6.024 7.474 -1.269 1.00 . A A . 42 TYR O 1 1 36 23033 1 1 42 TYR OH O 4.561 9.167 3.911 1.00 . A A . 42 TYR OH 1 1 36 23034 1 1 43 PRO C C 9.120 7.035 -0.607 1.00 . A A . 43 PRO C 1 1 36 23035 1 1 43 PRO CA C 8.660 7.021 -2.061 1.00 . A A . 43 PRO CA 1 1 36 23036 1 1 43 PRO CB C 9.857 7.155 -3.002 1.00 . A A . 43 PRO CB 1 1 36 23037 1 1 43 PRO CD C 8.568 9.155 -3.237 1.00 . A A . 43 PRO CD 1 1 36 23038 1 1 43 PRO CG C 9.974 8.618 -3.252 1.00 . A A . 43 PRO CG 1 1 36 23039 1 1 43 PRO HA H 8.139 6.098 -2.264 1.00 . A A . 43 PRO HA 1 1 36 23040 1 1 43 PRO HB2 H 10.742 6.762 -2.522 1.00 . A A . 43 PRO HB2 1 1 36 23041 1 1 43 PRO HB3 H 9.663 6.612 -3.915 1.00 . A A . 43 PRO HB3 1 1 36 23042 1 1 43 PRO HD2 H 8.547 10.142 -2.797 1.00 . A A . 43 PRO HD2 1 1 36 23043 1 1 43 PRO HD3 H 8.163 9.179 -4.238 1.00 . A A . 43 PRO HD3 1 1 36 23044 1 1 43 PRO HG2 H 10.560 9.078 -2.470 1.00 . A A . 43 PRO HG2 1 1 36 23045 1 1 43 PRO HG3 H 10.431 8.790 -4.215 1.00 . A A . 43 PRO HG3 1 1 36 23046 1 1 43 PRO N N 7.838 8.187 -2.396 1.00 . A A . 43 PRO N 1 1 36 23047 1 1 43 PRO O O 9.228 8.095 0.010 1.00 . A A . 43 PRO O 1 1 36 23048 1 1 44 GLY C C 11.123 6.509 1.563 1.00 . A A . 44 GLY C 1 1 36 23049 1 1 44 GLY CA C 9.834 5.751 1.312 1.00 . A A . 44 GLY CA 1 1 36 23050 1 1 44 GLY H H 9.285 5.041 -0.605 1.00 . A A . 44 GLY H 1 1 36 23051 1 1 44 GLY HA2 H 9.989 4.710 1.553 1.00 . A A . 44 GLY HA2 1 1 36 23052 1 1 44 GLY HA3 H 9.065 6.148 1.958 1.00 . A A . 44 GLY HA3 1 1 36 23053 1 1 44 GLY N N 9.389 5.852 -0.065 1.00 . A A . 44 GLY N 1 1 36 23054 1 1 44 GLY O O 11.193 7.348 2.461 1.00 . A A . 44 GLY O 1 1 36 23055 1 1 45 ASN C C 13.469 8.182 0.125 1.00 . A A . 45 ASN C 1 1 36 23056 1 1 45 ASN CA C 13.439 6.873 0.906 1.00 . A A . 45 ASN CA 1 1 36 23057 1 1 45 ASN CB C 14.560 5.951 0.423 1.00 . A A . 45 ASN CB 1 1 36 23058 1 1 45 ASN CG C 15.049 5.016 1.511 1.00 . A A . 45 ASN CG 1 1 36 23059 1 1 45 ASN H H 12.028 5.535 0.069 1.00 . A A . 45 ASN H 1 1 36 23060 1 1 45 ASN HA H 13.589 7.089 1.953 1.00 . A A . 45 ASN HA 1 1 36 23061 1 1 45 ASN HB2 H 14.197 5.355 -0.401 1.00 . A A . 45 ASN HB2 1 1 36 23062 1 1 45 ASN HB3 H 15.392 6.552 0.088 1.00 . A A . 45 ASN HB3 1 1 36 23063 1 1 45 ASN HD21 H 15.033 3.487 0.240 1.00 . A A . 45 ASN HD21 1 1 36 23064 1 1 45 ASN HD22 H 15.542 3.119 1.850 1.00 . A A . 45 ASN HD22 1 1 36 23065 1 1 45 ASN N N 12.146 6.213 0.767 1.00 . A A . 45 ASN N 1 1 36 23066 1 1 45 ASN ND2 N 15.226 3.746 1.165 1.00 . A A . 45 ASN ND2 1 1 36 23067 1 1 45 ASN O O 13.816 8.204 -1.056 1.00 . A A . 45 ASN O 1 1 36 23068 1 1 45 ASN OD1 O 15.266 5.430 2.650 1.00 . A A . 45 ASN OD1 1 1 36 23069 1 1 46 GLY C C 14.450 11.248 0.186 1.00 . A A . 46 GLY C 1 1 36 23070 1 1 46 GLY CA C 13.094 10.570 0.143 1.00 . A A . 46 GLY CA 1 1 36 23071 1 1 46 GLY H H 12.835 9.194 1.731 1.00 . A A . 46 GLY H 1 1 36 23072 1 1 46 GLY HA2 H 12.372 11.202 0.637 1.00 . A A . 46 GLY HA2 1 1 36 23073 1 1 46 GLY HA3 H 12.800 10.443 -0.888 1.00 . A A . 46 GLY HA3 1 1 36 23074 1 1 46 GLY N N 13.102 9.272 0.791 1.00 . A A . 46 GLY N 1 1 36 23075 1 1 46 GLY O O 14.496 12.467 0.454 1.00 . A A . 46 GLY O 1 1 36 23076 1 1 46 GLY OXT O 15.465 10.560 -0.049 1.00 . A A . 46 GLY OXT 1 1 37 23077 1 1 1 ALA C C -14.672 -8.285 6.458 1.00 . A A . 1 ALA C 1 1 37 23078 1 1 1 ALA CA C -13.796 -8.566 7.673 1.00 . A A . 1 ALA CA 1 1 37 23079 1 1 1 ALA CB C -14.147 -9.918 8.275 1.00 . A A . 1 ALA CB 1 1 37 23080 1 1 1 ALA H1 H -13.982 -6.584 8.194 1.00 . A A . 1 ALA H1 1 1 37 23081 1 1 1 ALA H2 H -14.818 -7.677 9.221 1.00 . A A . 1 ALA H2 1 1 37 23082 1 1 1 ALA H3 H -13.110 -7.540 9.319 1.00 . A A . 1 ALA H3 1 1 37 23083 1 1 1 ALA HA H -12.763 -8.597 7.358 1.00 . A A . 1 ALA HA 1 1 37 23084 1 1 1 ALA HB1 H -15.171 -10.163 8.036 1.00 . A A . 1 ALA HB1 1 1 37 23085 1 1 1 ALA HB2 H -13.491 -10.674 7.869 1.00 . A A . 1 ALA HB2 1 1 37 23086 1 1 1 ALA HB3 H -14.027 -9.877 9.348 1.00 . A A . 1 ALA HB3 1 1 37 23087 1 1 1 ALA N N -13.939 -7.495 8.694 1.00 . A A . 1 ALA N 1 1 37 23088 1 1 1 ALA O O -14.328 -8.648 5.334 1.00 . A A . 1 ALA O 1 1 37 23089 1 1 2 MET C C -16.558 -5.857 5.170 1.00 . A A . 2 MET C 1 1 37 23090 1 1 2 MET CA C -16.735 -7.305 5.615 1.00 . A A . 2 MET CA 1 1 37 23091 1 1 2 MET CB C -18.178 -7.539 6.067 1.00 . A A . 2 MET CB 1 1 37 23092 1 1 2 MET CE C -17.552 -10.344 5.179 1.00 . A A . 2 MET CE 1 1 37 23093 1 1 2 MET CG C -19.087 -8.047 4.960 1.00 . A A . 2 MET CG 1 1 37 23094 1 1 2 MET H H -16.028 -7.371 7.609 1.00 . A A . 2 MET H 1 1 37 23095 1 1 2 MET HA H -16.518 -7.954 4.781 1.00 . A A . 2 MET HA 1 1 37 23096 1 1 2 MET HB2 H -18.179 -8.265 6.866 1.00 . A A . 2 MET HB2 1 1 37 23097 1 1 2 MET HB3 H -18.582 -6.608 6.436 1.00 . A A . 2 MET HB3 1 1 37 23098 1 1 2 MET HE1 H -16.951 -9.907 4.396 1.00 . A A . 2 MET HE1 1 1 37 23099 1 1 2 MET HE2 H -17.192 -10.008 6.140 1.00 . A A . 2 MET HE2 1 1 37 23100 1 1 2 MET HE3 H -17.485 -11.421 5.127 1.00 . A A . 2 MET HE3 1 1 37 23101 1 1 2 MET HG2 H -20.064 -7.606 5.084 1.00 . A A . 2 MET HG2 1 1 37 23102 1 1 2 MET HG3 H -18.675 -7.745 4.008 1.00 . A A . 2 MET HG3 1 1 37 23103 1 1 2 MET N N -15.808 -7.635 6.691 1.00 . A A . 2 MET N 1 1 37 23104 1 1 2 MET O O -17.524 -5.186 4.807 1.00 . A A . 2 MET O 1 1 37 23105 1 1 2 MET SD S -19.259 -9.842 4.972 1.00 . A A . 2 MET SD 1 1 37 23106 1 1 3 ASP C C -13.600 -3.912 4.233 1.00 . A A . 3 ASP C 1 1 37 23107 1 1 3 ASP CA C -15.013 -4.013 4.798 1.00 . A A . 3 ASP CA 1 1 37 23108 1 1 3 ASP CB C -15.167 -3.064 5.989 1.00 . A A . 3 ASP CB 1 1 37 23109 1 1 3 ASP CG C -15.349 -1.622 5.559 1.00 . A A . 3 ASP CG 1 1 37 23110 1 1 3 ASP H H -14.589 -5.965 5.498 1.00 . A A . 3 ASP H 1 1 37 23111 1 1 3 ASP HA H -15.717 -3.729 4.030 1.00 . A A . 3 ASP HA 1 1 37 23112 1 1 3 ASP HB2 H -16.030 -3.359 6.567 1.00 . A A . 3 ASP HB2 1 1 37 23113 1 1 3 ASP HB3 H -14.285 -3.128 6.608 1.00 . A A . 3 ASP HB3 1 1 37 23114 1 1 3 ASP N N -15.317 -5.381 5.199 1.00 . A A . 3 ASP N 1 1 37 23115 1 1 3 ASP O O -12.655 -3.589 4.952 1.00 . A A . 3 ASP O 1 1 37 23116 1 1 3 ASP OD1 O -14.440 -0.806 5.818 1.00 . A A . 3 ASP OD1 1 1 37 23117 1 1 3 ASP OD2 O -16.401 -1.308 4.962 1.00 . A A . 3 ASP OD2 1 1 37 23118 1 1 4 CYS C C -12.045 -2.870 1.431 1.00 . A A . 4 CYS C 1 1 37 23119 1 1 4 CYS CA C -12.166 -4.133 2.278 1.00 . A A . 4 CYS CA 1 1 37 23120 1 1 4 CYS CB C -11.960 -5.372 1.405 1.00 . A A . 4 CYS CB 1 1 37 23121 1 1 4 CYS H H -14.255 -4.444 2.420 1.00 . A A . 4 CYS H 1 1 37 23122 1 1 4 CYS HA H -11.405 -4.113 3.044 1.00 . A A . 4 CYS HA 1 1 37 23123 1 1 4 CYS HB2 H -12.625 -5.319 0.556 1.00 . A A . 4 CYS HB2 1 1 37 23124 1 1 4 CYS HB3 H -10.938 -5.390 1.055 1.00 . A A . 4 CYS HB3 1 1 37 23125 1 1 4 CYS N N -13.464 -4.192 2.941 1.00 . A A . 4 CYS N 1 1 37 23126 1 1 4 CYS O O -13.042 -2.337 0.946 1.00 . A A . 4 CYS O 1 1 37 23127 1 1 4 CYS SG S -12.282 -6.947 2.263 1.00 . A A . 4 CYS SG 1 1 37 23128 1 1 5 THR C C -9.641 -1.501 -0.706 1.00 . A A . 5 THR C 1 1 37 23129 1 1 5 THR CA C -10.559 -1.195 0.474 1.00 . A A . 5 THR CA 1 1 37 23130 1 1 5 THR CB C -9.937 -0.111 1.358 1.00 . A A . 5 THR CB 1 1 37 23131 1 1 5 THR CG2 C -9.588 1.155 0.604 1.00 . A A . 5 THR CG2 1 1 37 23132 1 1 5 THR H H -10.060 -2.866 1.673 1.00 . A A . 5 THR H 1 1 37 23133 1 1 5 THR HA H -11.504 -0.837 0.096 1.00 . A A . 5 THR HA 1 1 37 23134 1 1 5 THR HB H -9.029 -0.498 1.796 1.00 . A A . 5 THR HB 1 1 37 23135 1 1 5 THR HG1 H -10.951 -0.510 2.985 1.00 . A A . 5 THR HG1 1 1 37 23136 1 1 5 THR HG21 H -10.470 1.535 0.111 1.00 . A A . 5 THR HG21 1 1 37 23137 1 1 5 THR HG22 H -9.215 1.895 1.296 1.00 . A A . 5 THR HG22 1 1 37 23138 1 1 5 THR HG23 H -8.829 0.937 -0.133 1.00 . A A . 5 THR HG23 1 1 37 23139 1 1 5 THR N N -10.815 -2.396 1.260 1.00 . A A . 5 THR N 1 1 37 23140 1 1 5 THR O O -8.434 -1.274 -0.641 1.00 . A A . 5 THR O 1 1 37 23141 1 1 5 THR OG1 O -10.819 0.245 2.407 1.00 . A A . 5 THR OG1 1 1 37 23142 1 1 6 THR C C -8.519 -1.218 -3.384 1.00 . A A . 6 THR C 1 1 37 23143 1 1 6 THR CA C -9.451 -2.359 -2.981 1.00 . A A . 6 THR CA 1 1 37 23144 1 1 6 THR CB C -10.394 -2.695 -4.138 1.00 . A A . 6 THR CB 1 1 37 23145 1 1 6 THR CG2 C -10.749 -4.164 -4.213 1.00 . A A . 6 THR CG2 1 1 37 23146 1 1 6 THR H H -11.187 -2.179 -1.778 1.00 . A A . 6 THR H 1 1 37 23147 1 1 6 THR HA H -8.855 -3.230 -2.753 1.00 . A A . 6 THR HA 1 1 37 23148 1 1 6 THR HB H -9.916 -2.422 -5.068 1.00 . A A . 6 THR HB 1 1 37 23149 1 1 6 THR HG1 H -11.862 -1.641 -4.893 1.00 . A A . 6 THR HG1 1 1 37 23150 1 1 6 THR HG21 H -10.201 -4.706 -3.456 1.00 . A A . 6 THR HG21 1 1 37 23151 1 1 6 THR HG22 H -11.809 -4.287 -4.048 1.00 . A A . 6 THR HG22 1 1 37 23152 1 1 6 THR HG23 H -10.490 -4.547 -5.189 1.00 . A A . 6 THR HG23 1 1 37 23153 1 1 6 THR N N -10.220 -2.020 -1.785 1.00 . A A . 6 THR N 1 1 37 23154 1 1 6 THR O O -8.969 -0.170 -3.848 1.00 . A A . 6 THR O 1 1 37 23155 1 1 6 THR OG1 O -11.603 -1.965 -4.028 1.00 . A A . 6 THR OG1 1 1 37 23156 1 1 7 GLY C C -4.842 -0.979 -3.694 1.00 . A A . 7 GLY C 1 1 37 23157 1 1 7 GLY CA C -6.244 -0.414 -3.548 1.00 . A A . 7 GLY CA 1 1 37 23158 1 1 7 GLY H H -6.921 -2.286 -2.826 1.00 . A A . 7 GLY H 1 1 37 23159 1 1 7 GLY HA2 H -6.237 0.341 -2.777 1.00 . A A . 7 GLY HA2 1 1 37 23160 1 1 7 GLY HA3 H -6.534 0.044 -4.483 1.00 . A A . 7 GLY HA3 1 1 37 23161 1 1 7 GLY N N -7.220 -1.431 -3.201 1.00 . A A . 7 GLY N 1 1 37 23162 1 1 7 GLY O O -4.584 -2.113 -3.290 1.00 . A A . 7 GLY O 1 1 37 23163 1 1 8 PRO C C -1.847 -1.051 -3.159 1.00 . A A . 8 PRO C 1 1 37 23164 1 1 8 PRO CA C -2.522 -0.649 -4.469 1.00 . A A . 8 PRO CA 1 1 37 23165 1 1 8 PRO CB C -1.824 0.573 -5.085 1.00 . A A . 8 PRO CB 1 1 37 23166 1 1 8 PRO CD C -4.126 1.155 -4.787 1.00 . A A . 8 PRO CD 1 1 37 23167 1 1 8 PRO CG C -2.738 1.725 -4.835 1.00 . A A . 8 PRO CG 1 1 37 23168 1 1 8 PRO HA H -2.472 -1.478 -5.160 1.00 . A A . 8 PRO HA 1 1 37 23169 1 1 8 PRO HB2 H -0.866 0.721 -4.607 1.00 . A A . 8 PRO HB2 1 1 37 23170 1 1 8 PRO HB3 H -1.679 0.410 -6.144 1.00 . A A . 8 PRO HB3 1 1 37 23171 1 1 8 PRO HD2 H -4.747 1.727 -4.114 1.00 . A A . 8 PRO HD2 1 1 37 23172 1 1 8 PRO HD3 H -4.559 1.129 -5.776 1.00 . A A . 8 PRO HD3 1 1 37 23173 1 1 8 PRO HG2 H -2.492 2.190 -3.894 1.00 . A A . 8 PRO HG2 1 1 37 23174 1 1 8 PRO HG3 H -2.655 2.440 -5.640 1.00 . A A . 8 PRO HG3 1 1 37 23175 1 1 8 PRO N N -3.907 -0.206 -4.274 1.00 . A A . 8 PRO N 1 1 37 23176 1 1 8 PRO O O -0.866 -1.795 -3.161 1.00 . A A . 8 PRO O 1 1 37 23177 1 1 9 CYS C C -2.478 -2.126 -0.149 1.00 . A A . 9 CYS C 1 1 37 23178 1 1 9 CYS CA C -1.818 -0.878 -0.728 1.00 . A A . 9 CYS CA 1 1 37 23179 1 1 9 CYS CB C -1.995 0.303 0.230 1.00 . A A . 9 CYS CB 1 1 37 23180 1 1 9 CYS H H -3.159 0.026 -2.097 1.00 . A A . 9 CYS H 1 1 37 23181 1 1 9 CYS HA H -0.764 -1.072 -0.855 1.00 . A A . 9 CYS HA 1 1 37 23182 1 1 9 CYS HB2 H -2.486 1.110 -0.293 1.00 . A A . 9 CYS HB2 1 1 37 23183 1 1 9 CYS HB3 H -2.609 -0.005 1.062 1.00 . A A . 9 CYS HB3 1 1 37 23184 1 1 9 CYS N N -2.376 -0.560 -2.040 1.00 . A A . 9 CYS N 1 1 37 23185 1 1 9 CYS O O -1.842 -2.905 0.562 1.00 . A A . 9 CYS O 1 1 37 23186 1 1 9 CYS SG S -0.433 0.955 0.906 1.00 . A A . 9 CYS SG 1 1 37 23187 1 1 10 CYS C C -3.859 -4.766 -0.450 1.00 . A A . 10 CYS C 1 1 37 23188 1 1 10 CYS CA C -4.504 -3.465 0.024 1.00 . A A . 10 CYS CA 1 1 37 23189 1 1 10 CYS CB C -5.956 -3.396 -0.459 1.00 . A A . 10 CYS CB 1 1 37 23190 1 1 10 CYS H H -4.209 -1.656 -1.032 1.00 . A A . 10 CYS H 1 1 37 23191 1 1 10 CYS HA H -4.490 -3.442 1.104 1.00 . A A . 10 CYS HA 1 1 37 23192 1 1 10 CYS HB2 H -6.096 -2.486 -1.021 1.00 . A A . 10 CYS HB2 1 1 37 23193 1 1 10 CYS HB3 H -6.155 -4.241 -1.101 1.00 . A A . 10 CYS HB3 1 1 37 23194 1 1 10 CYS N N -3.757 -2.311 -0.460 1.00 . A A . 10 CYS N 1 1 37 23195 1 1 10 CYS O O -3.781 -5.028 -1.650 1.00 . A A . 10 CYS O 1 1 37 23196 1 1 10 CYS SG S -7.193 -3.415 0.880 1.00 . A A . 10 CYS SG 1 1 37 23197 1 1 11 ARG C C -3.750 -7.801 -0.503 1.00 . A A . 11 ARG C 1 1 37 23198 1 1 11 ARG CA C -2.766 -6.850 0.174 1.00 . A A . 11 ARG CA 1 1 37 23199 1 1 11 ARG CB C -2.203 -7.500 1.440 1.00 . A A . 11 ARG CB 1 1 37 23200 1 1 11 ARG CD C -0.329 -8.784 2.514 1.00 . A A . 11 ARG CD 1 1 37 23201 1 1 11 ARG CG C -0.905 -8.255 1.210 1.00 . A A . 11 ARG CG 1 1 37 23202 1 1 11 ARG CZ C 0.984 -10.739 3.239 1.00 . A A . 11 ARG CZ 1 1 37 23203 1 1 11 ARG H H -3.494 -5.314 1.438 1.00 . A A . 11 ARG H 1 1 37 23204 1 1 11 ARG HA H -1.956 -6.650 -0.506 1.00 . A A . 11 ARG HA 1 1 37 23205 1 1 11 ARG HB2 H -2.022 -6.730 2.175 1.00 . A A . 11 ARG HB2 1 1 37 23206 1 1 11 ARG HB3 H -2.933 -8.193 1.830 1.00 . A A . 11 ARG HB3 1 1 37 23207 1 1 11 ARG HD2 H 0.185 -7.979 3.018 1.00 . A A . 11 ARG HD2 1 1 37 23208 1 1 11 ARG HD3 H -1.141 -9.136 3.134 1.00 . A A . 11 ARG HD3 1 1 37 23209 1 1 11 ARG HE H 0.982 -9.983 1.392 1.00 . A A . 11 ARG HE 1 1 37 23210 1 1 11 ARG HG2 H -1.095 -9.087 0.549 1.00 . A A . 11 ARG HG2 1 1 37 23211 1 1 11 ARG HG3 H -0.187 -7.588 0.754 1.00 . A A . 11 ARG HG3 1 1 37 23212 1 1 11 ARG HH11 H -0.147 -9.902 4.693 1.00 . A A . 11 ARG HH11 1 1 37 23213 1 1 11 ARG HH12 H 0.785 -11.278 5.178 1.00 . A A . 11 ARG HH12 1 1 37 23214 1 1 11 ARG HH21 H 2.209 -11.794 2.028 1.00 . A A . 11 ARG HH21 1 1 37 23215 1 1 11 ARG HH22 H 2.123 -12.352 3.665 1.00 . A A . 11 ARG HH22 1 1 37 23216 1 1 11 ARG N N -3.402 -5.577 0.499 1.00 . A A . 11 ARG N 1 1 37 23217 1 1 11 ARG NE N 0.610 -9.881 2.293 1.00 . A A . 11 ARG NE 1 1 37 23218 1 1 11 ARG NH1 N 0.501 -10.630 4.471 1.00 . A A . 11 ARG NH1 1 1 37 23219 1 1 11 ARG NH2 N 1.842 -11.708 2.954 1.00 . A A . 11 ARG NH2 1 1 37 23220 1 1 11 ARG O O -3.350 -8.788 -1.120 1.00 . A A . 11 ARG O 1 1 37 23221 1 1 12 GLN C C -7.456 -7.885 -0.452 1.00 . A A . 12 GLN C 1 1 37 23222 1 1 12 GLN CA C -6.091 -8.318 -0.975 1.00 . A A . 12 GLN CA 1 1 37 23223 1 1 12 GLN CB C -5.859 -9.801 -0.666 1.00 . A A . 12 GLN CB 1 1 37 23224 1 1 12 GLN CD C -6.360 -11.345 -2.602 1.00 . A A . 12 GLN CD 1 1 37 23225 1 1 12 GLN CG C -5.293 -10.585 -1.838 1.00 . A A . 12 GLN CG 1 1 37 23226 1 1 12 GLN H H -5.292 -6.698 0.123 1.00 . A A . 12 GLN H 1 1 37 23227 1 1 12 GLN HA H -6.063 -8.171 -2.044 1.00 . A A . 12 GLN HA 1 1 37 23228 1 1 12 GLN HB2 H -5.168 -9.882 0.160 1.00 . A A . 12 GLN HB2 1 1 37 23229 1 1 12 GLN HB3 H -6.800 -10.251 -0.382 1.00 . A A . 12 GLN HB3 1 1 37 23230 1 1 12 GLN HE21 H -6.935 -9.674 -3.511 1.00 . A A . 12 GLN HE21 1 1 37 23231 1 1 12 GLN HE22 H -7.808 -11.101 -3.942 1.00 . A A . 12 GLN HE22 1 1 37 23232 1 1 12 GLN HG2 H -4.810 -9.896 -2.516 1.00 . A A . 12 GLN HG2 1 1 37 23233 1 1 12 GLN HG3 H -4.565 -11.291 -1.465 1.00 . A A . 12 GLN HG3 1 1 37 23234 1 1 12 GLN N N -5.039 -7.497 -0.381 1.00 . A A . 12 GLN N 1 1 37 23235 1 1 12 GLN NE2 N -7.110 -10.635 -3.436 1.00 . A A . 12 GLN NE2 1 1 37 23236 1 1 12 GLN O O -8.468 -8.016 -1.139 1.00 . A A . 12 GLN O 1 1 37 23237 1 1 12 GLN OE1 O -6.508 -12.557 -2.443 1.00 . A A . 12 GLN OE1 1 1 37 23238 1 1 13 CYS C C -8.411 -5.886 2.495 1.00 . A A . 13 CYS C 1 1 37 23239 1 1 13 CYS CA C -8.704 -6.904 1.395 1.00 . A A . 13 CYS CA 1 1 37 23240 1 1 13 CYS CB C -9.486 -8.089 1.968 1.00 . A A . 13 CYS CB 1 1 37 23241 1 1 13 CYS H H -6.628 -7.285 1.265 1.00 . A A . 13 CYS H 1 1 37 23242 1 1 13 CYS HA H -9.301 -6.427 0.632 1.00 . A A . 13 CYS HA 1 1 37 23243 1 1 13 CYS HB2 H -8.934 -8.998 1.781 1.00 . A A . 13 CYS HB2 1 1 37 23244 1 1 13 CYS HB3 H -9.600 -7.957 3.034 1.00 . A A . 13 CYS HB3 1 1 37 23245 1 1 13 CYS N N -7.470 -7.364 0.771 1.00 . A A . 13 CYS N 1 1 37 23246 1 1 13 CYS O O -9.124 -4.893 2.639 1.00 . A A . 13 CYS O 1 1 37 23247 1 1 13 CYS SG S -11.149 -8.295 1.252 1.00 . A A . 13 CYS SG 1 1 37 23248 1 1 14 LYS C C -5.662 -4.530 4.016 1.00 . A A . 14 LYS C 1 1 37 23249 1 1 14 LYS CA C -6.970 -5.238 4.347 1.00 . A A . 14 LYS CA 1 1 37 23250 1 1 14 LYS CB C -6.827 -6.014 5.658 1.00 . A A . 14 LYS CB 1 1 37 23251 1 1 14 LYS CD C -8.941 -7.322 6.027 1.00 . A A . 14 LYS CD 1 1 37 23252 1 1 14 LYS CE C -10.354 -7.259 6.583 1.00 . A A . 14 LYS CE 1 1 37 23253 1 1 14 LYS CG C -8.121 -6.114 6.450 1.00 . A A . 14 LYS CG 1 1 37 23254 1 1 14 LYS H H -6.822 -6.942 3.104 1.00 . A A . 14 LYS H 1 1 37 23255 1 1 14 LYS HA H -7.749 -4.499 4.459 1.00 . A A . 14 LYS HA 1 1 37 23256 1 1 14 LYS HB2 H -6.489 -7.015 5.435 1.00 . A A . 14 LYS HB2 1 1 37 23257 1 1 14 LYS HB3 H -6.090 -5.523 6.275 1.00 . A A . 14 LYS HB3 1 1 37 23258 1 1 14 LYS HD2 H -8.991 -7.352 4.949 1.00 . A A . 14 LYS HD2 1 1 37 23259 1 1 14 LYS HD3 H -8.459 -8.217 6.392 1.00 . A A . 14 LYS HD3 1 1 37 23260 1 1 14 LYS HE2 H -10.910 -6.514 6.034 1.00 . A A . 14 LYS HE2 1 1 37 23261 1 1 14 LYS HE3 H -10.822 -8.224 6.454 1.00 . A A . 14 LYS HE3 1 1 37 23262 1 1 14 LYS HG2 H -7.883 -6.203 7.499 1.00 . A A . 14 LYS HG2 1 1 37 23263 1 1 14 LYS HG3 H -8.703 -5.219 6.284 1.00 . A A . 14 LYS HG3 1 1 37 23264 1 1 14 LYS HZ1 H -9.774 -7.569 8.566 1.00 . A A . 14 LYS HZ1 1 1 37 23265 1 1 14 LYS HZ2 H -9.996 -5.940 8.164 1.00 . A A . 14 LYS HZ2 1 1 37 23266 1 1 14 LYS HZ3 H -11.337 -6.944 8.399 1.00 . A A . 14 LYS HZ3 1 1 37 23267 1 1 14 LYS N N -7.356 -6.136 3.266 1.00 . A A . 14 LYS N 1 1 37 23268 1 1 14 LYS NZ N -10.366 -6.903 8.029 1.00 . A A . 14 LYS NZ 1 1 37 23269 1 1 14 LYS O O -4.801 -5.083 3.332 1.00 . A A . 14 LYS O 1 1 37 23270 1 1 15 LEU C C -3.064 -3.293 4.651 1.00 . A A . 15 LEU C 1 1 37 23271 1 1 15 LEU CA C -4.314 -2.515 4.257 1.00 . A A . 15 LEU CA 1 1 37 23272 1 1 15 LEU CB C -4.371 -1.196 5.028 1.00 . A A . 15 LEU CB 1 1 37 23273 1 1 15 LEU CD1 C -4.195 -0.466 7.424 1.00 . A A . 15 LEU CD1 1 1 37 23274 1 1 15 LEU CD2 C -6.445 -0.819 6.385 1.00 . A A . 15 LEU CD2 1 1 37 23275 1 1 15 LEU CG C -4.997 -1.285 6.423 1.00 . A A . 15 LEU CG 1 1 37 23276 1 1 15 LEU H H -6.242 -2.914 5.040 1.00 . A A . 15 LEU H 1 1 37 23277 1 1 15 LEU HA H -4.269 -2.301 3.200 1.00 . A A . 15 LEU HA 1 1 37 23278 1 1 15 LEU HB2 H -3.363 -0.820 5.130 1.00 . A A . 15 LEU HB2 1 1 37 23279 1 1 15 LEU HB3 H -4.943 -0.489 4.447 1.00 . A A . 15 LEU HB3 1 1 37 23280 1 1 15 LEU HD11 H -3.545 0.214 6.894 1.00 . A A . 15 LEU HD11 1 1 37 23281 1 1 15 LEU HD12 H -4.869 0.096 8.054 1.00 . A A . 15 LEU HD12 1 1 37 23282 1 1 15 LEU HD13 H -3.600 -1.129 8.036 1.00 . A A . 15 LEU HD13 1 1 37 23283 1 1 15 LEU HD21 H -6.822 -0.895 5.375 1.00 . A A . 15 LEU HD21 1 1 37 23284 1 1 15 LEU HD22 H -7.040 -1.440 7.039 1.00 . A A . 15 LEU HD22 1 1 37 23285 1 1 15 LEU HD23 H -6.502 0.208 6.714 1.00 . A A . 15 LEU HD23 1 1 37 23286 1 1 15 LEU HG H -4.985 -2.315 6.749 1.00 . A A . 15 LEU HG 1 1 37 23287 1 1 15 LEU N N -5.519 -3.302 4.503 1.00 . A A . 15 LEU N 1 1 37 23288 1 1 15 LEU O O -2.943 -3.760 5.783 1.00 . A A . 15 LEU O 1 1 37 23289 1 1 16 LYS C C -0.194 -3.614 5.205 1.00 . A A . 16 LYS C 1 1 37 23290 1 1 16 LYS CA C -0.895 -4.151 3.958 1.00 . A A . 16 LYS CA 1 1 37 23291 1 1 16 LYS CB C 0.037 -4.038 2.749 1.00 . A A . 16 LYS CB 1 1 37 23292 1 1 16 LYS CD C 0.579 -4.780 0.409 1.00 . A A . 16 LYS CD 1 1 37 23293 1 1 16 LYS CE C -0.247 -4.816 -0.868 1.00 . A A . 16 LYS CE 1 1 37 23294 1 1 16 LYS CG C -0.279 -5.029 1.640 1.00 . A A . 16 LYS CG 1 1 37 23295 1 1 16 LYS H H -2.291 -3.034 2.824 1.00 . A A . 16 LYS H 1 1 37 23296 1 1 16 LYS HA H -1.144 -5.190 4.115 1.00 . A A . 16 LYS HA 1 1 37 23297 1 1 16 LYS HB2 H -0.038 -3.040 2.343 1.00 . A A . 16 LYS HB2 1 1 37 23298 1 1 16 LYS HB3 H 1.052 -4.209 3.075 1.00 . A A . 16 LYS HB3 1 1 37 23299 1 1 16 LYS HD2 H 1.045 -3.810 0.496 1.00 . A A . 16 LYS HD2 1 1 37 23300 1 1 16 LYS HD3 H 1.342 -5.544 0.355 1.00 . A A . 16 LYS HD3 1 1 37 23301 1 1 16 LYS HE2 H -1.294 -4.770 -0.607 1.00 . A A . 16 LYS HE2 1 1 37 23302 1 1 16 LYS HE3 H 0.010 -3.957 -1.471 1.00 . A A . 16 LYS HE3 1 1 37 23303 1 1 16 LYS HG2 H -0.093 -6.029 2.001 1.00 . A A . 16 LYS HG2 1 1 37 23304 1 1 16 LYS HG3 H -1.320 -4.930 1.370 1.00 . A A . 16 LYS HG3 1 1 37 23305 1 1 16 LYS HZ1 H 0.301 -6.825 -1.026 1.00 . A A . 16 LYS HZ1 1 1 37 23306 1 1 16 LYS HZ2 H -0.865 -6.343 -2.152 1.00 . A A . 16 LYS HZ2 1 1 37 23307 1 1 16 LYS HZ3 H 0.750 -5.886 -2.359 1.00 . A A . 16 LYS HZ3 1 1 37 23308 1 1 16 LYS N N -2.137 -3.429 3.708 1.00 . A A . 16 LYS N 1 1 37 23309 1 1 16 LYS NZ N 0.002 -6.054 -1.656 1.00 . A A . 16 LYS NZ 1 1 37 23310 1 1 16 LYS O O -0.456 -2.492 5.639 1.00 . A A . 16 LYS O 1 1 37 23311 1 1 17 PRO C C 2.393 -2.842 6.740 1.00 . A A . 17 PRO C 1 1 37 23312 1 1 17 PRO CA C 1.446 -4.008 7.003 1.00 . A A . 17 PRO CA 1 1 37 23313 1 1 17 PRO CB C 2.239 -5.263 7.379 1.00 . A A . 17 PRO CB 1 1 37 23314 1 1 17 PRO CD C 1.082 -5.763 5.349 1.00 . A A . 17 PRO CD 1 1 37 23315 1 1 17 PRO CG C 2.344 -6.044 6.115 1.00 . A A . 17 PRO CG 1 1 37 23316 1 1 17 PRO HA H 0.774 -3.748 7.808 1.00 . A A . 17 PRO HA 1 1 37 23317 1 1 17 PRO HB2 H 3.213 -4.977 7.748 1.00 . A A . 17 PRO HB2 1 1 37 23318 1 1 17 PRO HB3 H 1.707 -5.814 8.139 1.00 . A A . 17 PRO HB3 1 1 37 23319 1 1 17 PRO HD2 H 1.274 -5.778 4.287 1.00 . A A . 17 PRO HD2 1 1 37 23320 1 1 17 PRO HD3 H 0.317 -6.480 5.607 1.00 . A A . 17 PRO HD3 1 1 37 23321 1 1 17 PRO HG2 H 3.205 -5.717 5.551 1.00 . A A . 17 PRO HG2 1 1 37 23322 1 1 17 PRO HG3 H 2.420 -7.098 6.339 1.00 . A A . 17 PRO HG3 1 1 37 23323 1 1 17 PRO N N 0.709 -4.411 5.800 1.00 . A A . 17 PRO N 1 1 37 23324 1 1 17 PRO O O 3.168 -2.863 5.784 1.00 . A A . 17 PRO O 1 1 37 23325 1 1 18 ALA C C 4.644 -1.057 7.264 1.00 . A A . 18 ALA C 1 1 37 23326 1 1 18 ALA CA C 3.187 -0.653 7.463 1.00 . A A . 18 ALA CA 1 1 37 23327 1 1 18 ALA CB C 3.048 0.245 8.683 1.00 . A A . 18 ALA CB 1 1 37 23328 1 1 18 ALA H H 1.694 -1.869 8.342 1.00 . A A . 18 ALA H 1 1 37 23329 1 1 18 ALA HA H 2.856 -0.097 6.597 1.00 . A A . 18 ALA HA 1 1 37 23330 1 1 18 ALA HB1 H 3.251 -0.328 9.576 1.00 . A A . 18 ALA HB1 1 1 37 23331 1 1 18 ALA HB2 H 3.751 1.061 8.611 1.00 . A A . 18 ALA HB2 1 1 37 23332 1 1 18 ALA HB3 H 2.043 0.638 8.729 1.00 . A A . 18 ALA HB3 1 1 37 23333 1 1 18 ALA N N 2.330 -1.827 7.599 1.00 . A A . 18 ALA N 1 1 37 23334 1 1 18 ALA O O 5.254 -1.672 8.138 1.00 . A A . 18 ALA O 1 1 37 23335 1 1 19 GLY C C 6.690 -2.030 4.651 1.00 . A A . 19 GLY C 1 1 37 23336 1 1 19 GLY CA C 6.572 -1.051 5.805 1.00 . A A . 19 GLY CA 1 1 37 23337 1 1 19 GLY H H 4.656 -0.226 5.445 1.00 . A A . 19 GLY H 1 1 37 23338 1 1 19 GLY HA2 H 7.023 -1.490 6.682 1.00 . A A . 19 GLY HA2 1 1 37 23339 1 1 19 GLY HA3 H 7.106 -0.147 5.552 1.00 . A A . 19 GLY HA3 1 1 37 23340 1 1 19 GLY N N 5.193 -0.712 6.105 1.00 . A A . 19 GLY N 1 1 37 23341 1 1 19 GLY O O 7.738 -2.643 4.454 1.00 . A A . 19 GLY O 1 1 37 23342 1 1 20 THR C C 5.297 -2.313 1.461 1.00 . A A . 20 THR C 1 1 37 23343 1 1 20 THR CA C 5.596 -3.079 2.744 1.00 . A A . 20 THR CA 1 1 37 23344 1 1 20 THR CB C 4.555 -4.180 2.951 1.00 . A A . 20 THR CB 1 1 37 23345 1 1 20 THR CG2 C 4.523 -5.192 1.827 1.00 . A A . 20 THR CG2 1 1 37 23346 1 1 20 THR H H 4.807 -1.655 4.089 1.00 . A A . 20 THR H 1 1 37 23347 1 1 20 THR HA H 6.574 -3.529 2.662 1.00 . A A . 20 THR HA 1 1 37 23348 1 1 20 THR HB H 3.576 -3.727 3.016 1.00 . A A . 20 THR HB 1 1 37 23349 1 1 20 THR HG1 H 4.977 -4.257 4.862 1.00 . A A . 20 THR HG1 1 1 37 23350 1 1 20 THR HG21 H 4.706 -4.693 0.887 1.00 . A A . 20 THR HG21 1 1 37 23351 1 1 20 THR HG22 H 5.286 -5.938 1.992 1.00 . A A . 20 THR HG22 1 1 37 23352 1 1 20 THR HG23 H 3.554 -5.669 1.799 1.00 . A A . 20 THR HG23 1 1 37 23353 1 1 20 THR N N 5.611 -2.174 3.885 1.00 . A A . 20 THR N 1 1 37 23354 1 1 20 THR O O 4.419 -1.451 1.432 1.00 . A A . 20 THR O 1 1 37 23355 1 1 20 THR OG1 O 4.801 -4.883 4.156 1.00 . A A . 20 THR OG1 1 1 37 23356 1 1 21 THR C C 4.429 -2.135 -1.394 1.00 . A A . 21 THR C 1 1 37 23357 1 1 21 THR CA C 5.852 -1.957 -0.878 1.00 . A A . 21 THR CA 1 1 37 23358 1 1 21 THR CB C 6.855 -2.485 -1.905 1.00 . A A . 21 THR CB 1 1 37 23359 1 1 21 THR CG2 C 7.805 -1.418 -2.396 1.00 . A A . 21 THR CG2 1 1 37 23360 1 1 21 THR H H 6.726 -3.317 0.489 1.00 . A A . 21 THR H 1 1 37 23361 1 1 21 THR HA H 6.034 -0.905 -0.726 1.00 . A A . 21 THR HA 1 1 37 23362 1 1 21 THR HB H 6.316 -2.868 -2.760 1.00 . A A . 21 THR HB 1 1 37 23363 1 1 21 THR HG1 H 7.171 -4.371 -1.480 1.00 . A A . 21 THR HG1 1 1 37 23364 1 1 21 THR HG21 H 7.825 -0.603 -1.687 1.00 . A A . 21 THR HG21 1 1 37 23365 1 1 21 THR HG22 H 8.796 -1.836 -2.494 1.00 . A A . 21 THR HG22 1 1 37 23366 1 1 21 THR HG23 H 7.470 -1.053 -3.355 1.00 . A A . 21 THR HG23 1 1 37 23367 1 1 21 THR N N 6.037 -2.625 0.404 1.00 . A A . 21 THR N 1 1 37 23368 1 1 21 THR O O 3.945 -3.258 -1.537 1.00 . A A . 21 THR O 1 1 37 23369 1 1 21 THR OG1 O 7.632 -3.538 -1.360 1.00 . A A . 21 THR OG1 1 1 37 23370 1 1 22 CYS C C 2.350 -0.642 -3.651 1.00 . A A . 22 CYS C 1 1 37 23371 1 1 22 CYS CA C 2.399 -1.051 -2.184 1.00 . A A . 22 CYS CA 1 1 37 23372 1 1 22 CYS CB C 1.496 -0.128 -1.363 1.00 . A A . 22 CYS CB 1 1 37 23373 1 1 22 CYS H H 4.206 -0.153 -1.546 1.00 . A A . 22 CYS H 1 1 37 23374 1 1 22 CYS HA H 2.039 -2.064 -2.094 1.00 . A A . 22 CYS HA 1 1 37 23375 1 1 22 CYS HB2 H 0.542 -0.038 -1.860 1.00 . A A . 22 CYS HB2 1 1 37 23376 1 1 22 CYS HB3 H 1.347 -0.561 -0.385 1.00 . A A . 22 CYS HB3 1 1 37 23377 1 1 22 CYS N N 3.765 -1.018 -1.678 1.00 . A A . 22 CYS N 1 1 37 23378 1 1 22 CYS O O 1.323 -0.167 -4.135 1.00 . A A . 22 CYS O 1 1 37 23379 1 1 22 CYS SG S 2.155 1.556 -1.130 1.00 . A A . 22 CYS SG 1 1 37 23380 1 1 23 TRP C C 4.765 -1.041 -6.435 1.00 . A A . 23 TRP C 1 1 37 23381 1 1 23 TRP CA C 3.520 -0.472 -5.767 1.00 . A A . 23 TRP CA 1 1 37 23382 1 1 23 TRP CB C 3.484 1.050 -5.931 1.00 . A A . 23 TRP CB 1 1 37 23383 1 1 23 TRP CD1 C 1.905 0.721 -7.918 1.00 . A A . 23 TRP CD1 1 1 37 23384 1 1 23 TRP CD2 C 2.194 2.854 -7.322 1.00 . A A . 23 TRP CD2 1 1 37 23385 1 1 23 TRP CE2 C 1.311 2.811 -8.415 1.00 . A A . 23 TRP CE2 1 1 37 23386 1 1 23 TRP CE3 C 2.527 4.093 -6.773 1.00 . A A . 23 TRP CE3 1 1 37 23387 1 1 23 TRP CG C 2.560 1.506 -7.018 1.00 . A A . 23 TRP CG 1 1 37 23388 1 1 23 TRP CH2 C 1.102 5.160 -8.414 1.00 . A A . 23 TRP CH2 1 1 37 23389 1 1 23 TRP CZ2 C 0.757 3.959 -8.970 1.00 . A A . 23 TRP CZ2 1 1 37 23390 1 1 23 TRP CZ3 C 1.979 5.235 -7.326 1.00 . A A . 23 TRP CZ3 1 1 37 23391 1 1 23 TRP H H 4.250 -1.211 -3.923 1.00 . A A . 23 TRP H 1 1 37 23392 1 1 23 TRP HA H 2.654 -0.894 -6.244 1.00 . A A . 23 TRP HA 1 1 37 23393 1 1 23 TRP HB2 H 3.155 1.497 -5.006 1.00 . A A . 23 TRP HB2 1 1 37 23394 1 1 23 TRP HB3 H 4.476 1.406 -6.165 1.00 . A A . 23 TRP HB3 1 1 37 23395 1 1 23 TRP HD1 H 1.980 -0.353 -7.947 1.00 . A A . 23 TRP HD1 1 1 37 23396 1 1 23 TRP HE1 H 0.586 1.162 -9.491 1.00 . A A . 23 TRP HE1 1 1 37 23397 1 1 23 TRP HE3 H 3.200 4.167 -5.934 1.00 . A A . 23 TRP HE3 1 1 37 23398 1 1 23 TRP HH2 H 0.700 6.077 -8.816 1.00 . A A . 23 TRP HH2 1 1 37 23399 1 1 23 TRP HZ2 H 0.077 3.918 -9.806 1.00 . A A . 23 TRP HZ2 1 1 37 23400 1 1 23 TRP HZ3 H 2.226 6.203 -6.916 1.00 . A A . 23 TRP HZ3 1 1 37 23401 1 1 23 TRP N N 3.460 -0.828 -4.357 1.00 . A A . 23 TRP N 1 1 37 23402 1 1 23 TRP NE1 N 1.148 1.496 -8.761 1.00 . A A . 23 TRP NE1 1 1 37 23403 1 1 23 TRP O O 4.685 -1.990 -7.214 1.00 . A A . 23 TRP O 1 1 37 23404 1 1 24 LYS C C 7.172 -0.706 -8.220 1.00 . A A . 24 LYS C 1 1 37 23405 1 1 24 LYS CA C 7.176 -0.896 -6.707 1.00 . A A . 24 LYS CA 1 1 37 23406 1 1 24 LYS CB C 7.424 -2.359 -6.356 1.00 . A A . 24 LYS CB 1 1 37 23407 1 1 24 LYS CD C 9.288 -3.986 -5.918 1.00 . A A . 24 LYS CD 1 1 37 23408 1 1 24 LYS CE C 8.413 -5.226 -6.000 1.00 . A A . 24 LYS CE 1 1 37 23409 1 1 24 LYS CG C 8.773 -2.880 -6.824 1.00 . A A . 24 LYS CG 1 1 37 23410 1 1 24 LYS H H 5.909 0.300 -5.506 1.00 . A A . 24 LYS H 1 1 37 23411 1 1 24 LYS HA H 7.966 -0.295 -6.282 1.00 . A A . 24 LYS HA 1 1 37 23412 1 1 24 LYS HB2 H 7.371 -2.468 -5.284 1.00 . A A . 24 LYS HB2 1 1 37 23413 1 1 24 LYS HB3 H 6.651 -2.959 -6.809 1.00 . A A . 24 LYS HB3 1 1 37 23414 1 1 24 LYS HD2 H 10.292 -4.247 -6.218 1.00 . A A . 24 LYS HD2 1 1 37 23415 1 1 24 LYS HD3 H 9.296 -3.628 -4.899 1.00 . A A . 24 LYS HD3 1 1 37 23416 1 1 24 LYS HE2 H 7.874 -5.210 -6.935 1.00 . A A . 24 LYS HE2 1 1 37 23417 1 1 24 LYS HE3 H 9.045 -6.101 -5.964 1.00 . A A . 24 LYS HE3 1 1 37 23418 1 1 24 LYS HG2 H 8.670 -3.269 -7.826 1.00 . A A . 24 LYS HG2 1 1 37 23419 1 1 24 LYS HG3 H 9.483 -2.066 -6.823 1.00 . A A . 24 LYS HG3 1 1 37 23420 1 1 24 LYS HZ1 H 7.204 -4.330 -4.550 1.00 . A A . 24 LYS HZ1 1 1 37 23421 1 1 24 LYS HZ2 H 6.558 -5.754 -5.195 1.00 . A A . 24 LYS HZ2 1 1 37 23422 1 1 24 LYS HZ3 H 7.833 -5.831 -4.086 1.00 . A A . 24 LYS HZ3 1 1 37 23423 1 1 24 LYS N N 5.913 -0.451 -6.130 1.00 . A A . 24 LYS N 1 1 37 23424 1 1 24 LYS NZ N 7.434 -5.290 -4.879 1.00 . A A . 24 LYS NZ 1 1 37 23425 1 1 24 LYS O O 7.782 -1.481 -8.957 1.00 . A A . 24 LYS O 1 1 37 23426 1 1 25 THR C C 7.744 1.072 -10.648 1.00 . A A . 25 THR C 1 1 37 23427 1 1 25 THR CA C 6.388 0.633 -10.099 1.00 . A A . 25 THR CA 1 1 37 23428 1 1 25 THR CB C 5.337 1.719 -10.343 1.00 . A A . 25 THR CB 1 1 37 23429 1 1 25 THR CG2 C 4.990 1.901 -11.805 1.00 . A A . 25 THR CG2 1 1 37 23430 1 1 25 THR H H 6.013 0.913 -8.035 1.00 . A A . 25 THR H 1 1 37 23431 1 1 25 THR HA H 6.084 -0.270 -10.607 1.00 . A A . 25 THR HA 1 1 37 23432 1 1 25 THR HB H 5.713 2.660 -9.972 1.00 . A A . 25 THR HB 1 1 37 23433 1 1 25 THR HG1 H 3.878 2.171 -9.118 1.00 . A A . 25 THR HG1 1 1 37 23434 1 1 25 THR HG21 H 4.741 0.944 -12.238 1.00 . A A . 25 THR HG21 1 1 37 23435 1 1 25 THR HG22 H 4.144 2.567 -11.893 1.00 . A A . 25 THR HG22 1 1 37 23436 1 1 25 THR HG23 H 5.835 2.324 -12.326 1.00 . A A . 25 THR HG23 1 1 37 23437 1 1 25 THR N N 6.478 0.333 -8.675 1.00 . A A . 25 THR N 1 1 37 23438 1 1 25 THR O O 8.659 1.389 -9.888 1.00 . A A . 25 THR O 1 1 37 23439 1 1 25 THR OG1 O 4.138 1.417 -9.653 1.00 . A A . 25 THR OG1 1 1 37 23440 1 1 26 SER C C 9.429 2.943 -12.412 1.00 . A A . 26 SER C 1 1 37 23441 1 1 26 SER CA C 9.115 1.463 -12.625 1.00 . A A . 26 SER CA 1 1 37 23442 1 1 26 SER CB C 9.042 1.160 -14.122 1.00 . A A . 26 SER CB 1 1 37 23443 1 1 26 SER H H 7.106 0.805 -12.523 1.00 . A A . 26 SER H 1 1 37 23444 1 1 26 SER HA H 9.910 0.876 -12.190 1.00 . A A . 26 SER HA 1 1 37 23445 1 1 26 SER HB2 H 8.515 1.958 -14.623 1.00 . A A . 26 SER HB2 1 1 37 23446 1 1 26 SER HB3 H 10.043 1.083 -14.521 1.00 . A A . 26 SER HB3 1 1 37 23447 1 1 26 SER HG H 7.662 0.087 -15.006 1.00 . A A . 26 SER HG 1 1 37 23448 1 1 26 SER N N 7.868 1.076 -11.971 1.00 . A A . 26 SER N 1 1 37 23449 1 1 26 SER O O 10.592 3.347 -12.444 1.00 . A A . 26 SER O 1 1 37 23450 1 1 26 SER OG O 8.360 -0.059 -14.363 1.00 . A A . 26 SER OG 1 1 37 23451 1 1 27 VAL C C 7.806 5.661 -10.763 1.00 . A A . 27 VAL C 1 1 37 23452 1 1 27 VAL CA C 8.574 5.180 -11.990 1.00 . A A . 27 VAL CA 1 1 37 23453 1 1 27 VAL CB C 8.119 5.991 -13.220 1.00 . A A . 27 VAL CB 1 1 37 23454 1 1 27 VAL CG1 C 6.618 5.847 -13.435 1.00 . A A . 27 VAL CG1 1 1 37 23455 1 1 27 VAL CG2 C 8.508 7.456 -13.071 1.00 . A A . 27 VAL CG2 1 1 37 23456 1 1 27 VAL H H 7.489 3.373 -12.188 1.00 . A A . 27 VAL H 1 1 37 23457 1 1 27 VAL HA H 9.628 5.363 -11.836 1.00 . A A . 27 VAL HA 1 1 37 23458 1 1 27 VAL HB H 8.621 5.596 -14.091 1.00 . A A . 27 VAL HB 1 1 37 23459 1 1 27 VAL HG11 H 6.097 6.118 -12.528 1.00 . A A . 27 VAL HG11 1 1 37 23460 1 1 27 VAL HG12 H 6.305 6.498 -14.238 1.00 . A A . 27 VAL HG12 1 1 37 23461 1 1 27 VAL HG13 H 6.387 4.823 -13.690 1.00 . A A . 27 VAL HG13 1 1 37 23462 1 1 27 VAL HG21 H 8.873 7.632 -12.069 1.00 . A A . 27 VAL HG21 1 1 37 23463 1 1 27 VAL HG22 H 9.283 7.697 -13.783 1.00 . A A . 27 VAL HG22 1 1 37 23464 1 1 27 VAL HG23 H 7.645 8.079 -13.253 1.00 . A A . 27 VAL HG23 1 1 37 23465 1 1 27 VAL N N 8.393 3.748 -12.200 1.00 . A A . 27 VAL N 1 1 37 23466 1 1 27 VAL O O 7.296 6.781 -10.736 1.00 . A A . 27 VAL O 1 1 37 23467 1 1 28 SER C C 7.635 4.471 -7.314 1.00 . A A . 28 SER C 1 1 37 23468 1 1 28 SER CA C 7.013 5.156 -8.528 1.00 . A A . 28 SER CA 1 1 37 23469 1 1 28 SER CB C 5.534 4.778 -8.654 1.00 . A A . 28 SER CB 1 1 37 23470 1 1 28 SER H H 8.146 3.928 -9.828 1.00 . A A . 28 SER H 1 1 37 23471 1 1 28 SER HA H 7.089 6.222 -8.396 1.00 . A A . 28 SER HA 1 1 37 23472 1 1 28 SER HB2 H 5.339 4.432 -9.657 1.00 . A A . 28 SER HB2 1 1 37 23473 1 1 28 SER HB3 H 5.300 3.994 -7.949 1.00 . A A . 28 SER HB3 1 1 37 23474 1 1 28 SER HG H 4.794 6.537 -9.097 1.00 . A A . 28 SER HG 1 1 37 23475 1 1 28 SER N N 7.724 4.808 -9.750 1.00 . A A . 28 SER N 1 1 37 23476 1 1 28 SER O O 8.331 5.105 -6.521 1.00 . A A . 28 SER O 1 1 37 23477 1 1 28 SER OG O 4.698 5.892 -8.393 1.00 . A A . 28 SER OG 1 1 37 23478 1 1 29 SER C C 7.593 3.071 -4.725 1.00 . A A . 29 SER C 1 1 37 23479 1 1 29 SER CA C 7.903 2.397 -6.058 1.00 . A A . 29 SER CA 1 1 37 23480 1 1 29 SER CB C 9.412 2.196 -6.208 1.00 . A A . 29 SER CB 1 1 37 23481 1 1 29 SER H H 6.812 2.735 -7.843 1.00 . A A . 29 SER H 1 1 37 23482 1 1 29 SER HA H 7.415 1.438 -6.076 1.00 . A A . 29 SER HA 1 1 37 23483 1 1 29 SER HB2 H 9.882 3.149 -6.403 1.00 . A A . 29 SER HB2 1 1 37 23484 1 1 29 SER HB3 H 9.810 1.778 -5.295 1.00 . A A . 29 SER HB3 1 1 37 23485 1 1 29 SER HG H 9.380 1.691 -8.101 1.00 . A A . 29 SER HG 1 1 37 23486 1 1 29 SER N N 7.376 3.177 -7.176 1.00 . A A . 29 SER N 1 1 37 23487 1 1 29 SER O O 8.285 4.000 -4.308 1.00 . A A . 29 SER O 1 1 37 23488 1 1 29 SER OG O 9.705 1.316 -7.280 1.00 . A A . 29 SER OG 1 1 37 23489 1 1 30 HIS C C 5.883 2.082 -1.753 1.00 . A A . 30 HIS C 1 1 37 23490 1 1 30 HIS CA C 6.107 3.170 -2.799 1.00 . A A . 30 HIS CA 1 1 37 23491 1 1 30 HIS CB C 4.825 3.973 -3.009 1.00 . A A . 30 HIS CB 1 1 37 23492 1 1 30 HIS CD2 C 5.368 4.869 -5.375 1.00 . A A . 30 HIS CD2 1 1 37 23493 1 1 30 HIS CE1 C 4.882 6.979 -5.045 1.00 . A A . 30 HIS CE1 1 1 37 23494 1 1 30 HIS CG C 4.953 4.994 -4.094 1.00 . A A . 30 HIS CG 1 1 37 23495 1 1 30 HIS H H 6.015 1.875 -4.465 1.00 . A A . 30 HIS H 1 1 37 23496 1 1 30 HIS HA H 6.884 3.834 -2.452 1.00 . A A . 30 HIS HA 1 1 37 23497 1 1 30 HIS HB2 H 4.027 3.297 -3.283 1.00 . A A . 30 HIS HB2 1 1 37 23498 1 1 30 HIS HB3 H 4.567 4.483 -2.094 1.00 . A A . 30 HIS HB3 1 1 37 23499 1 1 30 HIS HD1 H 4.321 6.736 -3.092 1.00 . A A . 30 HIS HD1 1 1 37 23500 1 1 30 HIS HD2 H 5.670 3.950 -5.864 1.00 . A A . 30 HIS HD2 1 1 37 23501 1 1 30 HIS HE1 H 4.739 8.037 -5.206 1.00 . A A . 30 HIS HE1 1 1 37 23502 1 1 30 HIS HE2 H 5.706 6.362 -6.808 1.00 . A A . 30 HIS HE2 1 1 37 23503 1 1 30 HIS N N 6.533 2.606 -4.072 1.00 . A A . 30 HIS N 1 1 37 23504 1 1 30 HIS ND1 N 4.654 6.328 -3.918 1.00 . A A . 30 HIS ND1 1 1 37 23505 1 1 30 HIS NE2 N 5.317 6.118 -5.944 1.00 . A A . 30 HIS NE2 1 1 37 23506 1 1 30 HIS O O 5.948 0.891 -2.057 1.00 . A A . 30 HIS O 1 1 37 23507 1 1 31 TYR C C 4.107 1.914 1.330 1.00 . A A . 31 TYR C 1 1 37 23508 1 1 31 TYR CA C 5.387 1.568 0.578 1.00 . A A . 31 TYR CA 1 1 37 23509 1 1 31 TYR CB C 6.575 1.574 1.542 1.00 . A A . 31 TYR CB 1 1 37 23510 1 1 31 TYR CD1 C 8.629 1.082 0.158 1.00 . A A . 31 TYR CD1 1 1 37 23511 1 1 31 TYR CD2 C 7.858 -0.597 1.666 1.00 . A A . 31 TYR CD2 1 1 37 23512 1 1 31 TYR CE1 C 9.666 0.258 -0.235 1.00 . A A . 31 TYR CE1 1 1 37 23513 1 1 31 TYR CE2 C 8.893 -1.426 1.277 1.00 . A A . 31 TYR CE2 1 1 37 23514 1 1 31 TYR CG C 7.709 0.669 1.114 1.00 . A A . 31 TYR CG 1 1 37 23515 1 1 31 TYR CZ C 9.794 -0.994 0.327 1.00 . A A . 31 TYR CZ 1 1 37 23516 1 1 31 TYR H H 5.583 3.466 -0.339 1.00 . A A . 31 TYR H 1 1 37 23517 1 1 31 TYR HA H 5.284 0.581 0.155 1.00 . A A . 31 TYR HA 1 1 37 23518 1 1 31 TYR HB2 H 6.964 2.578 1.617 1.00 . A A . 31 TYR HB2 1 1 37 23519 1 1 31 TYR HB3 H 6.240 1.249 2.516 1.00 . A A . 31 TYR HB3 1 1 37 23520 1 1 31 TYR HD1 H 8.526 2.063 -0.280 1.00 . A A . 31 TYR HD1 1 1 37 23521 1 1 31 TYR HD2 H 7.151 -0.932 2.409 1.00 . A A . 31 TYR HD2 1 1 37 23522 1 1 31 TYR HE1 H 10.372 0.597 -0.980 1.00 . A A . 31 TYR HE1 1 1 37 23523 1 1 31 TYR HE2 H 8.993 -2.407 1.718 1.00 . A A . 31 TYR HE2 1 1 37 23524 1 1 31 TYR HH H 11.660 -1.353 0.036 1.00 . A A . 31 TYR HH 1 1 37 23525 1 1 31 TYR N N 5.620 2.503 -0.518 1.00 . A A . 31 TYR N 1 1 37 23526 1 1 31 TYR O O 3.622 3.043 1.264 1.00 . A A . 31 TYR O 1 1 37 23527 1 1 31 TYR OH O 10.826 -1.817 -0.062 1.00 . A A . 31 TYR OH 1 1 37 23528 1 1 32 CYS C C 2.660 1.645 4.213 1.00 . A A . 32 CYS C 1 1 37 23529 1 1 32 CYS CA C 2.342 1.133 2.813 1.00 . A A . 32 CYS CA 1 1 37 23530 1 1 32 CYS CB C 1.551 -0.175 2.902 1.00 . A A . 32 CYS CB 1 1 37 23531 1 1 32 CYS H H 3.998 0.055 2.062 1.00 . A A . 32 CYS H 1 1 37 23532 1 1 32 CYS HA H 1.745 1.871 2.299 1.00 . A A . 32 CYS HA 1 1 37 23533 1 1 32 CYS HB2 H 1.893 -0.847 2.130 1.00 . A A . 32 CYS HB2 1 1 37 23534 1 1 32 CYS HB3 H 1.726 -0.628 3.868 1.00 . A A . 32 CYS HB3 1 1 37 23535 1 1 32 CYS N N 3.565 0.933 2.047 1.00 . A A . 32 CYS N 1 1 37 23536 1 1 32 CYS O O 3.738 1.388 4.749 1.00 . A A . 32 CYS O 1 1 37 23537 1 1 32 CYS SG S -0.249 0.026 2.701 1.00 . A A . 32 CYS SG 1 1 37 23538 1 1 33 THR C C 0.953 2.218 7.129 1.00 . A A . 33 THR C 1 1 37 23539 1 1 33 THR CA C 1.889 2.910 6.141 1.00 . A A . 33 THR CA 1 1 37 23540 1 1 33 THR CB C 1.633 4.419 6.135 1.00 . A A . 33 THR CB 1 1 37 23541 1 1 33 THR CG2 C 0.389 4.814 5.369 1.00 . A A . 33 THR CG2 1 1 37 23542 1 1 33 THR H H 0.874 2.531 4.324 1.00 . A A . 33 THR H 1 1 37 23543 1 1 33 THR HA H 2.910 2.727 6.442 1.00 . A A . 33 THR HA 1 1 37 23544 1 1 33 THR HB H 2.476 4.913 5.672 1.00 . A A . 33 THR HB 1 1 37 23545 1 1 33 THR HG1 H 0.677 4.599 7.835 1.00 . A A . 33 THR HG1 1 1 37 23546 1 1 33 THR HG21 H -0.228 3.942 5.210 1.00 . A A . 33 THR HG21 1 1 37 23547 1 1 33 THR HG22 H -0.165 5.548 5.936 1.00 . A A . 33 THR HG22 1 1 37 23548 1 1 33 THR HG23 H 0.672 5.234 4.415 1.00 . A A . 33 THR HG23 1 1 37 23549 1 1 33 THR N N 1.713 2.365 4.801 1.00 . A A . 33 THR N 1 1 37 23550 1 1 33 THR O O 0.622 2.769 8.178 1.00 . A A . 33 THR O 1 1 37 23551 1 1 33 THR OG1 O 1.501 4.915 7.456 1.00 . A A . 33 THR OG1 1 1 37 23552 1 1 34 GLY C C -1.551 1.071 8.120 1.00 . A A . 34 GLY C 1 1 37 23553 1 1 34 GLY CA C -0.362 0.252 7.652 1.00 . A A . 34 GLY CA 1 1 37 23554 1 1 34 GLY H H 0.830 0.611 5.936 1.00 . A A . 34 GLY H 1 1 37 23555 1 1 34 GLY HA2 H 0.192 -0.083 8.516 1.00 . A A . 34 GLY HA2 1 1 37 23556 1 1 34 GLY HA3 H -0.724 -0.612 7.114 1.00 . A A . 34 GLY HA3 1 1 37 23557 1 1 34 GLY N N 0.531 1.003 6.785 1.00 . A A . 34 GLY N 1 1 37 23558 1 1 34 GLY O O -2.089 0.835 9.202 1.00 . A A . 34 GLY O 1 1 37 23559 1 1 35 ARG C C -4.297 2.581 6.764 1.00 . A A . 35 ARG C 1 1 37 23560 1 1 35 ARG CA C -3.092 2.895 7.641 1.00 . A A . 35 ARG CA 1 1 37 23561 1 1 35 ARG CB C -2.705 4.367 7.489 1.00 . A A . 35 ARG CB 1 1 37 23562 1 1 35 ARG CD C -4.795 5.602 8.137 1.00 . A A . 35 ARG CD 1 1 37 23563 1 1 35 ARG CG C -3.359 5.277 8.515 1.00 . A A . 35 ARG CG 1 1 37 23564 1 1 35 ARG CZ C -6.012 7.513 7.167 1.00 . A A . 35 ARG CZ 1 1 37 23565 1 1 35 ARG H H -1.491 2.178 6.455 1.00 . A A . 35 ARG H 1 1 37 23566 1 1 35 ARG HA H -3.355 2.707 8.668 1.00 . A A . 35 ARG HA 1 1 37 23567 1 1 35 ARG HB2 H -1.634 4.458 7.589 1.00 . A A . 35 ARG HB2 1 1 37 23568 1 1 35 ARG HB3 H -2.995 4.704 6.504 1.00 . A A . 35 ARG HB3 1 1 37 23569 1 1 35 ARG HD2 H -5.200 4.778 7.569 1.00 . A A . 35 ARG HD2 1 1 37 23570 1 1 35 ARG HD3 H -5.372 5.732 9.041 1.00 . A A . 35 ARG HD3 1 1 37 23571 1 1 35 ARG HE H -4.070 7.138 6.899 1.00 . A A . 35 ARG HE 1 1 37 23572 1 1 35 ARG HG2 H -3.354 4.784 9.475 1.00 . A A . 35 ARG HG2 1 1 37 23573 1 1 35 ARG HG3 H -2.796 6.197 8.578 1.00 . A A . 35 ARG HG3 1 1 37 23574 1 1 35 ARG HH11 H -7.149 6.287 8.306 1.00 . A A . 35 ARG HH11 1 1 37 23575 1 1 35 ARG HH12 H -7.980 7.638 7.613 1.00 . A A . 35 ARG HH12 1 1 37 23576 1 1 35 ARG HH21 H -5.163 8.917 5.987 1.00 . A A . 35 ARG HH21 1 1 37 23577 1 1 35 ARG HH22 H -6.854 9.131 6.296 1.00 . A A . 35 ARG HH22 1 1 37 23578 1 1 35 ARG N N -1.961 2.037 7.304 1.00 . A A . 35 ARG N 1 1 37 23579 1 1 35 ARG NE N -4.888 6.820 7.335 1.00 . A A . 35 ARG NE 1 1 37 23580 1 1 35 ARG NH1 N -7.139 7.113 7.743 1.00 . A A . 35 ARG NH1 1 1 37 23581 1 1 35 ARG NH2 N -6.009 8.610 6.422 1.00 . A A . 35 ARG NH2 1 1 37 23582 1 1 35 ARG O O -5.337 2.138 7.251 1.00 . A A . 35 ARG O 1 1 37 23583 1 1 36 SER C C -4.717 1.717 3.346 1.00 . A A . 36 SER C 1 1 37 23584 1 1 36 SER CA C -5.219 2.561 4.512 1.00 . A A . 36 SER CA 1 1 37 23585 1 1 36 SER CB C -5.792 3.881 3.993 1.00 . A A . 36 SER CB 1 1 37 23586 1 1 36 SER H H -3.292 3.169 5.147 1.00 . A A . 36 SER H 1 1 37 23587 1 1 36 SER HA H -5.999 2.018 5.025 1.00 . A A . 36 SER HA 1 1 37 23588 1 1 36 SER HB2 H -6.410 3.688 3.128 1.00 . A A . 36 SER HB2 1 1 37 23589 1 1 36 SER HB3 H -6.389 4.341 4.766 1.00 . A A . 36 SER HB3 1 1 37 23590 1 1 36 SER HG H -4.483 4.592 2.721 1.00 . A A . 36 SER HG 1 1 37 23591 1 1 36 SER N N -4.147 2.816 5.468 1.00 . A A . 36 SER N 1 1 37 23592 1 1 36 SER O O -3.518 1.469 3.219 1.00 . A A . 36 SER O 1 1 37 23593 1 1 36 SER OG O -4.758 4.776 3.622 1.00 . A A . 36 SER OG 1 1 37 23594 1 1 37 CYS C C -4.919 1.336 0.140 1.00 . A A . 37 CYS C 1 1 37 23595 1 1 37 CYS CA C -5.285 0.464 1.340 1.00 . A A . 37 CYS CA 1 1 37 23596 1 1 37 CYS CB C -6.440 -0.466 0.971 1.00 . A A . 37 CYS CB 1 1 37 23597 1 1 37 CYS H H -6.581 1.510 2.646 1.00 . A A . 37 CYS H 1 1 37 23598 1 1 37 CYS HA H -4.428 -0.133 1.609 1.00 . A A . 37 CYS HA 1 1 37 23599 1 1 37 CYS HB2 H -7.361 0.095 0.987 1.00 . A A . 37 CYS HB2 1 1 37 23600 1 1 37 CYS HB3 H -6.277 -0.853 -0.023 1.00 . A A . 37 CYS HB3 1 1 37 23601 1 1 37 CYS N N -5.640 1.279 2.495 1.00 . A A . 37 CYS N 1 1 37 23602 1 1 37 CYS O O -4.652 0.826 -0.948 1.00 . A A . 37 CYS O 1 1 37 23603 1 1 37 CYS SG S -6.636 -1.886 2.096 1.00 . A A . 37 CYS SG 1 1 37 23604 1 1 38 GLU C C -3.090 3.924 -0.718 1.00 . A A . 38 GLU C 1 1 37 23605 1 1 38 GLU CA C -4.577 3.584 -0.729 1.00 . A A . 38 GLU CA 1 1 37 23606 1 1 38 GLU CB C -5.405 4.863 -0.593 1.00 . A A . 38 GLU CB 1 1 37 23607 1 1 38 GLU CD C -7.764 5.749 -0.769 1.00 . A A . 38 GLU CD 1 1 37 23608 1 1 38 GLU CG C -6.877 4.608 -0.312 1.00 . A A . 38 GLU CG 1 1 37 23609 1 1 38 GLU H H -5.132 3.003 1.228 1.00 . A A . 38 GLU H 1 1 37 23610 1 1 38 GLU HA H -4.818 3.109 -1.668 1.00 . A A . 38 GLU HA 1 1 37 23611 1 1 38 GLU HB2 H -5.003 5.454 0.216 1.00 . A A . 38 GLU HB2 1 1 37 23612 1 1 38 GLU HB3 H -5.329 5.427 -1.511 1.00 . A A . 38 GLU HB3 1 1 37 23613 1 1 38 GLU HG2 H -7.179 3.709 -0.828 1.00 . A A . 38 GLU HG2 1 1 37 23614 1 1 38 GLU HG3 H -7.009 4.473 0.752 1.00 . A A . 38 GLU HG3 1 1 37 23615 1 1 38 GLU N N -4.909 2.651 0.341 1.00 . A A . 38 GLU N 1 1 37 23616 1 1 38 GLU O O -2.660 4.852 -0.033 1.00 . A A . 38 GLU O 1 1 37 23617 1 1 38 GLU OE1 O -8.897 5.863 -0.256 1.00 . A A . 38 GLU OE1 1 1 37 23618 1 1 38 GLU OE2 O -7.326 6.529 -1.641 1.00 . A A . 38 GLU OE2 1 1 37 23619 1 1 39 CYS C C -0.557 4.869 -1.818 1.00 . A A . 39 CYS C 1 1 37 23620 1 1 39 CYS CA C -0.867 3.390 -1.574 1.00 . A A . 39 CYS CA 1 1 37 23621 1 1 39 CYS CB C -0.272 2.533 -2.696 1.00 . A A . 39 CYS CB 1 1 37 23622 1 1 39 CYS H H -2.713 2.447 -2.011 1.00 . A A . 39 CYS H 1 1 37 23623 1 1 39 CYS HA H -0.432 3.090 -0.635 1.00 . A A . 39 CYS HA 1 1 37 23624 1 1 39 CYS HB2 H -0.573 1.507 -2.553 1.00 . A A . 39 CYS HB2 1 1 37 23625 1 1 39 CYS HB3 H -0.653 2.884 -3.646 1.00 . A A . 39 CYS HB3 1 1 37 23626 1 1 39 CYS N N -2.310 3.169 -1.487 1.00 . A A . 39 CYS N 1 1 37 23627 1 1 39 CYS O O -1.083 5.472 -2.754 1.00 . A A . 39 CYS O 1 1 37 23628 1 1 39 CYS SG S 1.548 2.565 -2.786 1.00 . A A . 39 CYS SG 1 1 37 23629 1 1 40 PRO C C 1.236 7.222 -2.480 1.00 . A A . 40 PRO C 1 1 37 23630 1 1 40 PRO CA C 0.663 6.893 -1.106 1.00 . A A . 40 PRO CA 1 1 37 23631 1 1 40 PRO CB C 1.725 7.106 -0.017 1.00 . A A . 40 PRO CB 1 1 37 23632 1 1 40 PRO CD C 0.971 4.847 0.171 1.00 . A A . 40 PRO CD 1 1 37 23633 1 1 40 PRO CG C 2.159 5.737 0.388 1.00 . A A . 40 PRO CG 1 1 37 23634 1 1 40 PRO HA H -0.184 7.535 -0.912 1.00 . A A . 40 PRO HA 1 1 37 23635 1 1 40 PRO HB2 H 2.549 7.675 -0.422 1.00 . A A . 40 PRO HB2 1 1 37 23636 1 1 40 PRO HB3 H 1.288 7.640 0.814 1.00 . A A . 40 PRO HB3 1 1 37 23637 1 1 40 PRO HD2 H 1.289 3.844 -0.070 1.00 . A A . 40 PRO HD2 1 1 37 23638 1 1 40 PRO HD3 H 0.332 4.847 1.042 1.00 . A A . 40 PRO HD3 1 1 37 23639 1 1 40 PRO HG2 H 2.985 5.416 -0.229 1.00 . A A . 40 PRO HG2 1 1 37 23640 1 1 40 PRO HG3 H 2.443 5.735 1.430 1.00 . A A . 40 PRO HG3 1 1 37 23641 1 1 40 PRO N N 0.298 5.478 -0.974 1.00 . A A . 40 PRO N 1 1 37 23642 1 1 40 PRO O O 1.695 6.338 -3.202 1.00 . A A . 40 PRO O 1 1 37 23643 1 1 41 SER C C 3.139 9.493 -3.984 1.00 . A A . 41 SER C 1 1 37 23644 1 1 41 SER CA C 1.717 8.956 -4.121 1.00 . A A . 41 SER CA 1 1 37 23645 1 1 41 SER CB C 0.805 10.036 -4.705 1.00 . A A . 41 SER CB 1 1 37 23646 1 1 41 SER H H 0.823 9.161 -2.214 1.00 . A A . 41 SER H 1 1 37 23647 1 1 41 SER HA H 1.729 8.108 -4.789 1.00 . A A . 41 SER HA 1 1 37 23648 1 1 41 SER HB2 H 0.938 10.077 -5.775 1.00 . A A . 41 SER HB2 1 1 37 23649 1 1 41 SER HB3 H -0.224 9.796 -4.479 1.00 . A A . 41 SER HB3 1 1 37 23650 1 1 41 SER HG H 0.337 11.650 -3.697 1.00 . A A . 41 SER HG 1 1 37 23651 1 1 41 SER N N 1.203 8.504 -2.834 1.00 . A A . 41 SER N 1 1 37 23652 1 1 41 SER O O 3.581 10.317 -4.786 1.00 . A A . 41 SER O 1 1 37 23653 1 1 41 SER OG O 1.106 11.310 -4.160 1.00 . A A . 41 SER OG 1 1 37 23654 1 1 42 TYR C C 6.098 8.273 -2.306 1.00 . A A . 42 TYR C 1 1 37 23655 1 1 42 TYR CA C 5.224 9.453 -2.729 1.00 . A A . 42 TYR CA 1 1 37 23656 1 1 42 TYR CB C 5.260 10.543 -1.655 1.00 . A A . 42 TYR CB 1 1 37 23657 1 1 42 TYR CD1 C 5.819 9.732 0.668 1.00 . A A . 42 TYR CD1 1 1 37 23658 1 1 42 TYR CD2 C 3.520 9.920 0.066 1.00 . A A . 42 TYR CD2 1 1 37 23659 1 1 42 TYR CE1 C 5.458 9.285 1.925 1.00 . A A . 42 TYR CE1 1 1 37 23660 1 1 42 TYR CE2 C 3.151 9.474 1.320 1.00 . A A . 42 TYR CE2 1 1 37 23661 1 1 42 TYR CG C 4.859 10.056 -0.281 1.00 . A A . 42 TYR CG 1 1 37 23662 1 1 42 TYR CZ C 4.123 9.158 2.246 1.00 . A A . 42 TYR CZ 1 1 37 23663 1 1 42 TYR H H 3.448 8.365 -2.362 1.00 . A A . 42 TYR H 1 1 37 23664 1 1 42 TYR HA H 5.609 9.857 -3.653 1.00 . A A . 42 TYR HA 1 1 37 23665 1 1 42 TYR HB2 H 6.262 10.938 -1.587 1.00 . A A . 42 TYR HB2 1 1 37 23666 1 1 42 TYR HB3 H 4.584 11.338 -1.937 1.00 . A A . 42 TYR HB3 1 1 37 23667 1 1 42 TYR HD1 H 6.864 9.832 0.414 1.00 . A A . 42 TYR HD1 1 1 37 23668 1 1 42 TYR HD2 H 2.761 10.167 -0.661 1.00 . A A . 42 TYR HD2 1 1 37 23669 1 1 42 TYR HE1 H 6.220 9.038 2.649 1.00 . A A . 42 TYR HE1 1 1 37 23670 1 1 42 TYR HE2 H 2.105 9.375 1.571 1.00 . A A . 42 TYR HE2 1 1 37 23671 1 1 42 TYR HH H 3.028 8.096 3.417 1.00 . A A . 42 TYR HH 1 1 37 23672 1 1 42 TYR N N 3.852 9.021 -2.966 1.00 . A A . 42 TYR N 1 1 37 23673 1 1 42 TYR O O 5.626 7.347 -1.648 1.00 . A A . 42 TYR O 1 1 37 23674 1 1 42 TYR OH O 3.759 8.714 3.496 1.00 . A A . 42 TYR OH 1 1 37 23675 1 1 43 PRO C C 8.691 7.220 -0.856 1.00 . A A . 43 PRO C 1 1 37 23676 1 1 43 PRO CA C 8.324 7.216 -2.336 1.00 . A A . 43 PRO CA 1 1 37 23677 1 1 43 PRO CB C 9.551 7.531 -3.193 1.00 . A A . 43 PRO CB 1 1 37 23678 1 1 43 PRO CD C 8.036 9.357 -3.468 1.00 . A A . 43 PRO CD 1 1 37 23679 1 1 43 PRO CG C 9.497 9.004 -3.396 1.00 . A A . 43 PRO CG 1 1 37 23680 1 1 43 PRO HA H 7.931 6.247 -2.606 1.00 . A A . 43 PRO HA 1 1 37 23681 1 1 43 PRO HB2 H 10.447 7.235 -2.666 1.00 . A A . 43 PRO HB2 1 1 37 23682 1 1 43 PRO HB3 H 9.485 7.000 -4.131 1.00 . A A . 43 PRO HB3 1 1 37 23683 1 1 43 PRO HD2 H 7.860 10.326 -3.024 1.00 . A A . 43 PRO HD2 1 1 37 23684 1 1 43 PRO HD3 H 7.694 9.342 -4.492 1.00 . A A . 43 PRO HD3 1 1 37 23685 1 1 43 PRO HG2 H 9.964 9.508 -2.562 1.00 . A A . 43 PRO HG2 1 1 37 23686 1 1 43 PRO HG3 H 9.991 9.267 -4.320 1.00 . A A . 43 PRO HG3 1 1 37 23687 1 1 43 PRO N N 7.388 8.291 -2.680 1.00 . A A . 43 PRO N 1 1 37 23688 1 1 43 PRO O O 8.608 8.250 -0.188 1.00 . A A . 43 PRO O 1 1 37 23689 1 1 44 GLY C C 10.973 5.870 1.242 1.00 . A A . 44 GLY C 1 1 37 23690 1 1 44 GLY CA C 9.472 5.951 1.048 1.00 . A A . 44 GLY CA 1 1 37 23691 1 1 44 GLY H H 9.144 5.272 -0.931 1.00 . A A . 44 GLY H 1 1 37 23692 1 1 44 GLY HA2 H 9.018 5.063 1.462 1.00 . A A . 44 GLY HA2 1 1 37 23693 1 1 44 GLY HA3 H 9.097 6.814 1.577 1.00 . A A . 44 GLY HA3 1 1 37 23694 1 1 44 GLY N N 9.098 6.060 -0.350 1.00 . A A . 44 GLY N 1 1 37 23695 1 1 44 GLY O O 11.450 5.282 2.212 1.00 . A A . 44 GLY O 1 1 37 23696 1 1 45 ASN C C 13.723 7.876 0.507 1.00 . A A . 45 ASN C 1 1 37 23697 1 1 45 ASN CA C 13.177 6.457 0.390 1.00 . A A . 45 ASN CA 1 1 37 23698 1 1 45 ASN CB C 13.767 5.771 -0.844 1.00 . A A . 45 ASN CB 1 1 37 23699 1 1 45 ASN CG C 13.299 6.407 -2.138 1.00 . A A . 45 ASN CG 1 1 37 23700 1 1 45 ASN H H 11.282 6.917 -0.433 1.00 . A A . 45 ASN H 1 1 37 23701 1 1 45 ASN HA H 13.462 5.901 1.271 1.00 . A A . 45 ASN HA 1 1 37 23702 1 1 45 ASN HB2 H 14.844 5.835 -0.802 1.00 . A A . 45 ASN HB2 1 1 37 23703 1 1 45 ASN HB3 H 13.472 4.732 -0.846 1.00 . A A . 45 ASN HB3 1 1 37 23704 1 1 45 ASN HD21 H 14.081 4.909 -3.186 1.00 . A A . 45 ASN HD21 1 1 37 23705 1 1 45 ASN HD22 H 13.298 6.142 -4.108 1.00 . A A . 45 ASN HD22 1 1 37 23706 1 1 45 ASN N N 11.721 6.464 0.317 1.00 . A A . 45 ASN N 1 1 37 23707 1 1 45 ASN ND2 N 13.588 5.753 -3.257 1.00 . A A . 45 ASN ND2 1 1 37 23708 1 1 45 ASN O O 14.818 8.172 0.029 1.00 . A A . 45 ASN O 1 1 37 23709 1 1 45 ASN OD1 O 12.685 7.474 -2.133 1.00 . A A . 45 ASN OD1 1 1 37 23710 1 1 46 GLY C C 12.253 11.115 1.052 1.00 . A A . 46 GLY C 1 1 37 23711 1 1 46 GLY CA C 13.374 10.129 1.312 1.00 . A A . 46 GLY CA 1 1 37 23712 1 1 46 GLY H H 12.088 8.458 1.504 1.00 . A A . 46 GLY H 1 1 37 23713 1 1 46 GLY HA2 H 14.183 10.331 0.626 1.00 . A A . 46 GLY HA2 1 1 37 23714 1 1 46 GLY HA3 H 13.731 10.264 2.322 1.00 . A A . 46 GLY HA3 1 1 37 23715 1 1 46 GLY N N 12.951 8.751 1.144 1.00 . A A . 46 GLY N 1 1 37 23716 1 1 46 GLY O O 12.303 11.812 0.017 1.00 . A A . 46 GLY O 1 1 37 23717 1 1 46 GLY OXT O 11.324 11.191 1.884 1.00 . A A . 46 GLY OXT 1 1 38 23718 1 1 1 ALA C C -15.879 -7.810 7.439 1.00 . A A . 1 ALA C 1 1 38 23719 1 1 1 ALA CA C -14.734 -7.501 8.397 1.00 . A A . 1 ALA CA 1 1 38 23720 1 1 1 ALA CB C -13.757 -8.667 8.444 1.00 . A A . 1 ALA CB 1 1 38 23721 1 1 1 ALA H1 H -15.916 -7.954 10.018 1.00 . A A . 1 ALA H1 1 1 38 23722 1 1 1 ALA H2 H -14.431 -7.186 10.407 1.00 . A A . 1 ALA H2 1 1 38 23723 1 1 1 ALA H3 H -15.713 -6.275 9.726 1.00 . A A . 1 ALA H3 1 1 38 23724 1 1 1 ALA HA H -14.202 -6.633 8.036 1.00 . A A . 1 ALA HA 1 1 38 23725 1 1 1 ALA HB1 H -13.491 -8.955 7.438 1.00 . A A . 1 ALA HB1 1 1 38 23726 1 1 1 ALA HB2 H -12.868 -8.370 8.981 1.00 . A A . 1 ALA HB2 1 1 38 23727 1 1 1 ALA HB3 H -14.219 -9.503 8.948 1.00 . A A . 1 ALA HB3 1 1 38 23728 1 1 1 ALA N N -15.245 -7.202 9.760 1.00 . A A . 1 ALA N 1 1 38 23729 1 1 1 ALA O O -16.257 -8.968 7.260 1.00 . A A . 1 ALA O 1 1 38 23730 1 1 2 MET C C -17.051 -6.747 4.448 1.00 . A A . 2 MET C 1 1 38 23731 1 1 2 MET CA C -17.530 -6.927 5.884 1.00 . A A . 2 MET CA 1 1 38 23732 1 1 2 MET CB C -18.641 -5.922 6.193 1.00 . A A . 2 MET CB 1 1 38 23733 1 1 2 MET CE C -21.157 -5.578 9.503 1.00 . A A . 2 MET CE 1 1 38 23734 1 1 2 MET CG C -19.188 -6.034 7.607 1.00 . A A . 2 MET CG 1 1 38 23735 1 1 2 MET H H -16.083 -5.868 7.009 1.00 . A A . 2 MET H 1 1 38 23736 1 1 2 MET HA H -17.920 -7.927 5.998 1.00 . A A . 2 MET HA 1 1 38 23737 1 1 2 MET HB2 H -18.255 -4.923 6.058 1.00 . A A . 2 MET HB2 1 1 38 23738 1 1 2 MET HB3 H -19.456 -6.080 5.502 1.00 . A A . 2 MET HB3 1 1 38 23739 1 1 2 MET HE1 H -20.523 -6.393 9.821 1.00 . A A . 2 MET HE1 1 1 38 23740 1 1 2 MET HE2 H -21.037 -4.744 10.178 1.00 . A A . 2 MET HE2 1 1 38 23741 1 1 2 MET HE3 H -22.188 -5.900 9.508 1.00 . A A . 2 MET HE3 1 1 38 23742 1 1 2 MET HG2 H -19.401 -7.072 7.815 1.00 . A A . 2 MET HG2 1 1 38 23743 1 1 2 MET HG3 H -18.438 -5.677 8.297 1.00 . A A . 2 MET HG3 1 1 38 23744 1 1 2 MET N N -16.428 -6.767 6.825 1.00 . A A . 2 MET N 1 1 38 23745 1 1 2 MET O O -17.184 -7.649 3.621 1.00 . A A . 2 MET O 1 1 38 23746 1 1 2 MET SD S -20.696 -5.076 7.846 1.00 . A A . 2 MET SD 1 1 38 23747 1 1 3 ASP C C -14.467 -5.322 2.788 1.00 . A A . 3 ASP C 1 1 38 23748 1 1 3 ASP CA C -15.992 -5.278 2.821 1.00 . A A . 3 ASP CA 1 1 38 23749 1 1 3 ASP CB C -16.484 -3.904 2.365 1.00 . A A . 3 ASP CB 1 1 38 23750 1 1 3 ASP CG C -17.890 -3.952 1.800 1.00 . A A . 3 ASP CG 1 1 38 23751 1 1 3 ASP H H -16.413 -4.898 4.860 1.00 . A A . 3 ASP H 1 1 38 23752 1 1 3 ASP HA H -16.376 -6.030 2.148 1.00 . A A . 3 ASP HA 1 1 38 23753 1 1 3 ASP HB2 H -16.478 -3.228 3.207 1.00 . A A . 3 ASP HB2 1 1 38 23754 1 1 3 ASP HB3 H -15.820 -3.526 1.601 1.00 . A A . 3 ASP HB3 1 1 38 23755 1 1 3 ASP N N -16.492 -5.577 4.158 1.00 . A A . 3 ASP N 1 1 38 23756 1 1 3 ASP O O -13.804 -4.914 3.741 1.00 . A A . 3 ASP O 1 1 38 23757 1 1 3 ASP OD1 O -18.593 -2.922 1.869 1.00 . A A . 3 ASP OD1 1 1 38 23758 1 1 3 ASP OD2 O -18.288 -5.019 1.287 1.00 . A A . 3 ASP OD2 1 1 38 23759 1 1 4 CYS C C -11.880 -4.584 1.084 1.00 . A A . 4 CYS C 1 1 38 23760 1 1 4 CYS CA C -12.472 -5.917 1.527 1.00 . A A . 4 CYS CA 1 1 38 23761 1 1 4 CYS CB C -12.118 -7.002 0.510 1.00 . A A . 4 CYS CB 1 1 38 23762 1 1 4 CYS H H -14.500 -6.129 0.959 1.00 . A A . 4 CYS H 1 1 38 23763 1 1 4 CYS HA H -12.050 -6.183 2.485 1.00 . A A . 4 CYS HA 1 1 38 23764 1 1 4 CYS HB2 H -12.804 -6.942 -0.322 1.00 . A A . 4 CYS HB2 1 1 38 23765 1 1 4 CYS HB3 H -11.112 -6.833 0.153 1.00 . A A . 4 CYS HB3 1 1 38 23766 1 1 4 CYS N N -13.919 -5.820 1.685 1.00 . A A . 4 CYS N 1 1 38 23767 1 1 4 CYS O O -12.297 -4.012 0.077 1.00 . A A . 4 CYS O 1 1 38 23768 1 1 4 CYS SG S -12.196 -8.698 1.171 1.00 . A A . 4 CYS SG 1 1 38 23769 1 1 5 THR C C -9.615 -2.891 0.136 1.00 . A A . 5 THR C 1 1 38 23770 1 1 5 THR CA C -10.244 -2.838 1.525 1.00 . A A . 5 THR CA 1 1 38 23771 1 1 5 THR CB C -9.176 -2.529 2.572 1.00 . A A . 5 THR CB 1 1 38 23772 1 1 5 THR CG2 C -8.886 -1.051 2.714 1.00 . A A . 5 THR CG2 1 1 38 23773 1 1 5 THR H H -10.612 -4.605 2.627 1.00 . A A . 5 THR H 1 1 38 23774 1 1 5 THR HA H -10.989 -2.056 1.542 1.00 . A A . 5 THR HA 1 1 38 23775 1 1 5 THR HB H -8.258 -3.023 2.290 1.00 . A A . 5 THR HB 1 1 38 23776 1 1 5 THR HG1 H -10.372 -2.569 4.123 1.00 . A A . 5 THR HG1 1 1 38 23777 1 1 5 THR HG21 H -9.216 -0.533 1.826 1.00 . A A . 5 THR HG21 1 1 38 23778 1 1 5 THR HG22 H -9.411 -0.662 3.574 1.00 . A A . 5 THR HG22 1 1 38 23779 1 1 5 THR HG23 H -7.824 -0.903 2.843 1.00 . A A . 5 THR HG23 1 1 38 23780 1 1 5 THR N N -10.902 -4.099 1.840 1.00 . A A . 5 THR N 1 1 38 23781 1 1 5 THR O O -8.485 -3.353 -0.027 1.00 . A A . 5 THR O 1 1 38 23782 1 1 5 THR OG1 O -9.568 -3.014 3.845 1.00 . A A . 5 THR OG1 1 1 38 23783 1 1 6 THR C C -9.010 -1.194 -2.518 1.00 . A A . 6 THR C 1 1 38 23784 1 1 6 THR CA C -9.872 -2.421 -2.240 1.00 . A A . 6 THR CA 1 1 38 23785 1 1 6 THR CB C -11.049 -2.463 -3.215 1.00 . A A . 6 THR CB 1 1 38 23786 1 1 6 THR CG2 C -11.491 -3.869 -3.559 1.00 . A A . 6 THR CG2 1 1 38 23787 1 1 6 THR H H -11.250 -2.070 -0.671 1.00 . A A . 6 THR H 1 1 38 23788 1 1 6 THR HA H -9.270 -3.307 -2.379 1.00 . A A . 6 THR HA 1 1 38 23789 1 1 6 THR HB H -10.759 -1.974 -4.134 1.00 . A A . 6 THR HB 1 1 38 23790 1 1 6 THR HG1 H -12.510 -1.165 -3.333 1.00 . A A . 6 THR HG1 1 1 38 23791 1 1 6 THR HG21 H -10.871 -4.580 -3.032 1.00 . A A . 6 THR HG21 1 1 38 23792 1 1 6 THR HG22 H -12.522 -4.004 -3.266 1.00 . A A . 6 THR HG22 1 1 38 23793 1 1 6 THR HG23 H -11.395 -4.027 -4.623 1.00 . A A . 6 THR HG23 1 1 38 23794 1 1 6 THR N N -10.355 -2.421 -0.863 1.00 . A A . 6 THR N 1 1 38 23795 1 1 6 THR O O -9.431 -0.061 -2.288 1.00 . A A . 6 THR O 1 1 38 23796 1 1 6 THR OG1 O -12.168 -1.779 -2.680 1.00 . A A . 6 THR OG1 1 1 38 23797 1 1 7 GLY C C -5.471 -0.810 -3.552 1.00 . A A . 7 GLY C 1 1 38 23798 1 1 7 GLY CA C -6.894 -0.337 -3.317 1.00 . A A . 7 GLY CA 1 1 38 23799 1 1 7 GLY H H -7.518 -2.355 -3.176 1.00 . A A . 7 GLY H 1 1 38 23800 1 1 7 GLY HA2 H -6.898 0.361 -2.493 1.00 . A A . 7 GLY HA2 1 1 38 23801 1 1 7 GLY HA3 H -7.243 0.169 -4.204 1.00 . A A . 7 GLY HA3 1 1 38 23802 1 1 7 GLY N N -7.799 -1.430 -3.014 1.00 . A A . 7 GLY N 1 1 38 23803 1 1 7 GLY O O -5.194 -2.008 -3.484 1.00 . A A . 7 GLY O 1 1 38 23804 1 1 8 PRO C C -2.337 -0.492 -2.825 1.00 . A A . 8 PRO C 1 1 38 23805 1 1 8 PRO CA C -3.139 -0.226 -4.100 1.00 . A A . 8 PRO CA 1 1 38 23806 1 1 8 PRO CB C -2.611 1.021 -4.809 1.00 . A A . 8 PRO CB 1 1 38 23807 1 1 8 PRO CD C -4.786 1.566 -3.958 1.00 . A A . 8 PRO CD 1 1 38 23808 1 1 8 PRO CG C -3.422 2.138 -4.249 1.00 . A A . 8 PRO CG 1 1 38 23809 1 1 8 PRO HA H -3.054 -1.076 -4.759 1.00 . A A . 8 PRO HA 1 1 38 23810 1 1 8 PRO HB2 H -1.560 1.146 -4.592 1.00 . A A . 8 PRO HB2 1 1 38 23811 1 1 8 PRO HB3 H -2.757 0.925 -5.874 1.00 . A A . 8 PRO HB3 1 1 38 23812 1 1 8 PRO HD2 H -5.172 1.966 -3.032 1.00 . A A . 8 PRO HD2 1 1 38 23813 1 1 8 PRO HD3 H -5.463 1.777 -4.772 1.00 . A A . 8 PRO HD3 1 1 38 23814 1 1 8 PRO HG2 H -2.967 2.501 -3.339 1.00 . A A . 8 PRO HG2 1 1 38 23815 1 1 8 PRO HG3 H -3.498 2.936 -4.973 1.00 . A A . 8 PRO HG3 1 1 38 23816 1 1 8 PRO N N -4.540 0.115 -3.843 1.00 . A A . 8 PRO N 1 1 38 23817 1 1 8 PRO O O -1.236 -1.037 -2.886 1.00 . A A . 8 PRO O 1 1 38 23818 1 1 9 CYS C C -2.732 -1.514 0.354 1.00 . A A . 9 CYS C 1 1 38 23819 1 1 9 CYS CA C -2.190 -0.302 -0.401 1.00 . A A . 9 CYS CA 1 1 38 23820 1 1 9 CYS CB C -2.307 0.949 0.476 1.00 . A A . 9 CYS CB 1 1 38 23821 1 1 9 CYS H H -3.759 0.335 -1.680 1.00 . A A . 9 CYS H 1 1 38 23822 1 1 9 CYS HA H -1.149 -0.474 -0.622 1.00 . A A . 9 CYS HA 1 1 38 23823 1 1 9 CYS HB2 H -2.435 1.811 -0.160 1.00 . A A . 9 CYS HB2 1 1 38 23824 1 1 9 CYS HB3 H -3.174 0.849 1.112 1.00 . A A . 9 CYS HB3 1 1 38 23825 1 1 9 CYS N N -2.882 -0.101 -1.674 1.00 . A A . 9 CYS N 1 1 38 23826 1 1 9 CYS O O -2.569 -1.619 1.570 1.00 . A A . 9 CYS O 1 1 38 23827 1 1 9 CYS SG S -0.866 1.272 1.553 1.00 . A A . 9 CYS SG 1 1 38 23828 1 1 10 CYS C C -3.544 -4.875 -0.539 1.00 . A A . 10 CYS C 1 1 38 23829 1 1 10 CYS CA C -3.925 -3.630 0.253 1.00 . A A . 10 CYS CA 1 1 38 23830 1 1 10 CYS CB C -5.445 -3.524 0.359 1.00 . A A . 10 CYS CB 1 1 38 23831 1 1 10 CYS H H -3.473 -2.297 -1.330 1.00 . A A . 10 CYS H 1 1 38 23832 1 1 10 CYS HA H -3.511 -3.712 1.246 1.00 . A A . 10 CYS HA 1 1 38 23833 1 1 10 CYS HB2 H -5.867 -3.488 -0.634 1.00 . A A . 10 CYS HB2 1 1 38 23834 1 1 10 CYS HB3 H -5.825 -4.393 0.876 1.00 . A A . 10 CYS HB3 1 1 38 23835 1 1 10 CYS N N -3.372 -2.429 -0.365 1.00 . A A . 10 CYS N 1 1 38 23836 1 1 10 CYS O O -3.628 -4.893 -1.767 1.00 . A A . 10 CYS O 1 1 38 23837 1 1 10 CYS SG S -6.020 -2.049 1.257 1.00 . A A . 10 CYS SG 1 1 38 23838 1 1 11 ARG C C -3.847 -7.701 -1.354 1.00 . A A . 11 ARG C 1 1 38 23839 1 1 11 ARG CA C -2.729 -7.168 -0.461 1.00 . A A . 11 ARG CA 1 1 38 23840 1 1 11 ARG CB C -2.361 -8.209 0.599 1.00 . A A . 11 ARG CB 1 1 38 23841 1 1 11 ARG CD C -1.984 -10.647 1.076 1.00 . A A . 11 ARG CD 1 1 38 23842 1 1 11 ARG CG C -1.958 -9.555 0.019 1.00 . A A . 11 ARG CG 1 1 38 23843 1 1 11 ARG CZ C -3.453 -12.522 1.710 1.00 . A A . 11 ARG CZ 1 1 38 23844 1 1 11 ARG H H -3.079 -5.841 1.149 1.00 . A A . 11 ARG H 1 1 38 23845 1 1 11 ARG HA H -1.862 -6.969 -1.073 1.00 . A A . 11 ARG HA 1 1 38 23846 1 1 11 ARG HB2 H -1.535 -7.832 1.184 1.00 . A A . 11 ARG HB2 1 1 38 23847 1 1 11 ARG HB3 H -3.210 -8.360 1.249 1.00 . A A . 11 ARG HB3 1 1 38 23848 1 1 11 ARG HD2 H -1.199 -11.356 0.862 1.00 . A A . 11 ARG HD2 1 1 38 23849 1 1 11 ARG HD3 H -1.810 -10.199 2.043 1.00 . A A . 11 ARG HD3 1 1 38 23850 1 1 11 ARG HE H -4.022 -10.932 0.647 1.00 . A A . 11 ARG HE 1 1 38 23851 1 1 11 ARG HG2 H -2.647 -9.816 -0.771 1.00 . A A . 11 ARG HG2 1 1 38 23852 1 1 11 ARG HG3 H -0.959 -9.478 -0.383 1.00 . A A . 11 ARG HG3 1 1 38 23853 1 1 11 ARG HH11 H -1.545 -12.695 2.359 1.00 . A A . 11 ARG HH11 1 1 38 23854 1 1 11 ARG HH12 H -2.597 -14.000 2.792 1.00 . A A . 11 ARG HH12 1 1 38 23855 1 1 11 ARG HH21 H -5.408 -12.648 1.215 1.00 . A A . 11 ARG HH21 1 1 38 23856 1 1 11 ARG HH22 H -4.790 -13.974 2.142 1.00 . A A . 11 ARG HH22 1 1 38 23857 1 1 11 ARG N N -3.124 -5.916 0.173 1.00 . A A . 11 ARG N 1 1 38 23858 1 1 11 ARG NE N -3.264 -11.352 1.104 1.00 . A A . 11 ARG NE 1 1 38 23859 1 1 11 ARG NH1 N -2.449 -13.121 2.338 1.00 . A A . 11 ARG NH1 1 1 38 23860 1 1 11 ARG NH2 N -4.648 -13.095 1.687 1.00 . A A . 11 ARG NH2 1 1 38 23861 1 1 11 ARG O O -3.769 -7.614 -2.579 1.00 . A A . 11 ARG O 1 1 38 23862 1 1 12 GLN C C -7.336 -8.602 -0.740 1.00 . A A . 12 GLN C 1 1 38 23863 1 1 12 GLN CA C -6.012 -8.798 -1.480 1.00 . A A . 12 GLN CA 1 1 38 23864 1 1 12 GLN CB C -5.791 -10.286 -1.751 1.00 . A A . 12 GLN CB 1 1 38 23865 1 1 12 GLN CD C -5.760 -11.991 -3.615 1.00 . A A . 12 GLN CD 1 1 38 23866 1 1 12 GLN CG C -6.454 -10.778 -3.027 1.00 . A A . 12 GLN CG 1 1 38 23867 1 1 12 GLN H H -4.890 -8.297 0.245 1.00 . A A . 12 GLN H 1 1 38 23868 1 1 12 GLN HA H -6.064 -8.278 -2.424 1.00 . A A . 12 GLN HA 1 1 38 23869 1 1 12 GLN HB2 H -4.730 -10.472 -1.828 1.00 . A A . 12 GLN HB2 1 1 38 23870 1 1 12 GLN HB3 H -6.188 -10.853 -0.923 1.00 . A A . 12 GLN HB3 1 1 38 23871 1 1 12 GLN HE21 H -7.218 -13.174 -2.958 1.00 . A A . 12 GLN HE21 1 1 38 23872 1 1 12 GLN HE22 H -5.941 -13.961 -3.816 1.00 . A A . 12 GLN HE22 1 1 38 23873 1 1 12 GLN HG2 H -7.478 -11.040 -2.807 1.00 . A A . 12 GLN HG2 1 1 38 23874 1 1 12 GLN HG3 H -6.436 -9.982 -3.757 1.00 . A A . 12 GLN HG3 1 1 38 23875 1 1 12 GLN N N -4.884 -8.253 -0.733 1.00 . A A . 12 GLN N 1 1 38 23876 1 1 12 GLN NE2 N -6.368 -13.160 -3.446 1.00 . A A . 12 GLN NE2 1 1 38 23877 1 1 12 GLN O O -8.371 -9.107 -1.175 1.00 . A A . 12 GLN O 1 1 38 23878 1 1 12 GLN OE1 O -4.691 -11.879 -4.215 1.00 . A A . 12 GLN OE1 1 1 38 23879 1 1 13 CYS C C -8.224 -6.815 2.417 1.00 . A A . 13 CYS C 1 1 38 23880 1 1 13 CYS CA C -8.521 -7.620 1.153 1.00 . A A . 13 CYS CA 1 1 38 23881 1 1 13 CYS CB C -9.193 -8.944 1.535 1.00 . A A . 13 CYS CB 1 1 38 23882 1 1 13 CYS H H -6.463 -7.484 0.676 1.00 . A A . 13 CYS H 1 1 38 23883 1 1 13 CYS HA H -9.198 -7.053 0.533 1.00 . A A . 13 CYS HA 1 1 38 23884 1 1 13 CYS HB2 H -9.467 -9.474 0.636 1.00 . A A . 13 CYS HB2 1 1 38 23885 1 1 13 CYS HB3 H -8.493 -9.543 2.099 1.00 . A A . 13 CYS HB3 1 1 38 23886 1 1 13 CYS N N -7.309 -7.868 0.374 1.00 . A A . 13 CYS N 1 1 38 23887 1 1 13 CYS O O -9.074 -6.060 2.890 1.00 . A A . 13 CYS O 1 1 38 23888 1 1 13 CYS SG S -10.700 -8.753 2.542 1.00 . A A . 13 CYS SG 1 1 38 23889 1 1 14 LYS C C -5.546 -5.256 3.915 1.00 . A A . 14 LYS C 1 1 38 23890 1 1 14 LYS CA C -6.648 -6.272 4.187 1.00 . A A . 14 LYS CA 1 1 38 23891 1 1 14 LYS CB C -6.189 -7.263 5.258 1.00 . A A . 14 LYS CB 1 1 38 23892 1 1 14 LYS CD C -6.883 -9.273 6.597 1.00 . A A . 14 LYS CD 1 1 38 23893 1 1 14 LYS CE C -5.812 -9.044 7.652 1.00 . A A . 14 LYS CE 1 1 38 23894 1 1 14 LYS CG C -7.335 -7.964 5.970 1.00 . A A . 14 LYS CG 1 1 38 23895 1 1 14 LYS H H -6.385 -7.601 2.562 1.00 . A A . 14 LYS H 1 1 38 23896 1 1 14 LYS HA H -7.521 -5.748 4.548 1.00 . A A . 14 LYS HA 1 1 38 23897 1 1 14 LYS HB2 H -5.568 -8.014 4.794 1.00 . A A . 14 LYS HB2 1 1 38 23898 1 1 14 LYS HB3 H -5.606 -6.732 5.997 1.00 . A A . 14 LYS HB3 1 1 38 23899 1 1 14 LYS HD2 H -7.733 -9.752 7.060 1.00 . A A . 14 LYS HD2 1 1 38 23900 1 1 14 LYS HD3 H -6.483 -9.912 5.824 1.00 . A A . 14 LYS HD3 1 1 38 23901 1 1 14 LYS HE2 H -4.853 -8.969 7.162 1.00 . A A . 14 LYS HE2 1 1 38 23902 1 1 14 LYS HE3 H -6.025 -8.119 8.168 1.00 . A A . 14 LYS HE3 1 1 38 23903 1 1 14 LYS HG2 H -7.714 -7.317 6.746 1.00 . A A . 14 LYS HG2 1 1 38 23904 1 1 14 LYS HG3 H -8.118 -8.169 5.254 1.00 . A A . 14 LYS HG3 1 1 38 23905 1 1 14 LYS HZ1 H -6.720 -10.526 8.811 1.00 . A A . 14 LYS HZ1 1 1 38 23906 1 1 14 LYS HZ2 H -5.161 -10.923 8.291 1.00 . A A . 14 LYS HZ2 1 1 38 23907 1 1 14 LYS HZ3 H -5.376 -9.809 9.546 1.00 . A A . 14 LYS HZ3 1 1 38 23908 1 1 14 LYS N N -7.026 -6.983 2.972 1.00 . A A . 14 LYS N 1 1 38 23909 1 1 14 LYS NZ N -5.764 -10.153 8.644 1.00 . A A . 14 LYS NZ 1 1 38 23910 1 1 14 LYS O O -4.762 -5.408 2.978 1.00 . A A . 14 LYS O 1 1 38 23911 1 1 15 LEU C C -3.082 -3.768 4.719 1.00 . A A . 15 LEU C 1 1 38 23912 1 1 15 LEU CA C -4.483 -3.179 4.607 1.00 . A A . 15 LEU CA 1 1 38 23913 1 1 15 LEU CB C -4.686 -2.101 5.675 1.00 . A A . 15 LEU CB 1 1 38 23914 1 1 15 LEU CD1 C -3.400 -0.412 4.338 1.00 . A A . 15 LEU CD1 1 1 38 23915 1 1 15 LEU CD2 C -5.903 -0.364 4.339 1.00 . A A . 15 LEU CD2 1 1 38 23916 1 1 15 LEU CG C -4.656 -0.661 5.160 1.00 . A A . 15 LEU CG 1 1 38 23917 1 1 15 LEU H H -6.142 -4.161 5.477 1.00 . A A . 15 LEU H 1 1 38 23918 1 1 15 LEU HA H -4.599 -2.734 3.630 1.00 . A A . 15 LEU HA 1 1 38 23919 1 1 15 LEU HB2 H -5.641 -2.271 6.150 1.00 . A A . 15 LEU HB2 1 1 38 23920 1 1 15 LEU HB3 H -3.910 -2.208 6.419 1.00 . A A . 15 LEU HB3 1 1 38 23921 1 1 15 LEU HD11 H -2.665 -1.171 4.563 1.00 . A A . 15 LEU HD11 1 1 38 23922 1 1 15 LEU HD12 H -3.644 -0.448 3.287 1.00 . A A . 15 LEU HD12 1 1 38 23923 1 1 15 LEU HD13 H -2.998 0.561 4.581 1.00 . A A . 15 LEU HD13 1 1 38 23924 1 1 15 LEU HD21 H -6.646 -1.127 4.521 1.00 . A A . 15 LEU HD21 1 1 38 23925 1 1 15 LEU HD22 H -6.300 0.599 4.623 1.00 . A A . 15 LEU HD22 1 1 38 23926 1 1 15 LEU HD23 H -5.649 -0.353 3.289 1.00 . A A . 15 LEU HD23 1 1 38 23927 1 1 15 LEU HG H -4.642 0.014 6.002 1.00 . A A . 15 LEU HG 1 1 38 23928 1 1 15 LEU N N -5.491 -4.222 4.747 1.00 . A A . 15 LEU N 1 1 38 23929 1 1 15 LEU O O -2.732 -4.372 5.734 1.00 . A A . 15 LEU O 1 1 38 23930 1 1 16 LYS C C -0.137 -3.595 4.870 1.00 . A A . 16 LYS C 1 1 38 23931 1 1 16 LYS CA C -0.919 -4.109 3.661 1.00 . A A . 16 LYS CA 1 1 38 23932 1 1 16 LYS CB C -0.210 -3.709 2.365 1.00 . A A . 16 LYS CB 1 1 38 23933 1 1 16 LYS CD C 0.659 -4.417 0.116 1.00 . A A . 16 LYS CD 1 1 38 23934 1 1 16 LYS CE C -0.410 -4.297 -0.957 1.00 . A A . 16 LYS CE 1 1 38 23935 1 1 16 LYS CG C 0.071 -4.881 1.439 1.00 . A A . 16 LYS CG 1 1 38 23936 1 1 16 LYS H H -2.616 -3.102 2.892 1.00 . A A . 16 LYS H 1 1 38 23937 1 1 16 LYS HA H -0.977 -5.187 3.713 1.00 . A A . 16 LYS HA 1 1 38 23938 1 1 16 LYS HB2 H -0.828 -3.000 1.835 1.00 . A A . 16 LYS HB2 1 1 38 23939 1 1 16 LYS HB3 H 0.732 -3.239 2.611 1.00 . A A . 16 LYS HB3 1 1 38 23940 1 1 16 LYS HD2 H 1.123 -3.452 0.258 1.00 . A A . 16 LYS HD2 1 1 38 23941 1 1 16 LYS HD3 H 1.402 -5.132 -0.206 1.00 . A A . 16 LYS HD3 1 1 38 23942 1 1 16 LYS HE2 H -1.081 -5.139 -0.875 1.00 . A A . 16 LYS HE2 1 1 38 23943 1 1 16 LYS HE3 H -0.960 -3.381 -0.798 1.00 . A A . 16 LYS HE3 1 1 38 23944 1 1 16 LYS HG2 H 0.772 -5.547 1.919 1.00 . A A . 16 LYS HG2 1 1 38 23945 1 1 16 LYS HG3 H -0.854 -5.405 1.247 1.00 . A A . 16 LYS HG3 1 1 38 23946 1 1 16 LYS HZ1 H 1.006 -4.905 -2.368 1.00 . A A . 16 LYS HZ1 1 1 38 23947 1 1 16 LYS HZ2 H -0.526 -4.603 -3.021 1.00 . A A . 16 LYS HZ2 1 1 38 23948 1 1 16 LYS HZ3 H 0.473 -3.313 -2.575 1.00 . A A . 16 LYS HZ3 1 1 38 23949 1 1 16 LYS N N -2.282 -3.592 3.673 1.00 . A A . 16 LYS N 1 1 38 23950 1 1 16 LYS NZ N 0.177 -4.278 -2.326 1.00 . A A . 16 LYS NZ 1 1 38 23951 1 1 16 LYS O O -0.351 -2.471 5.324 1.00 . A A . 16 LYS O 1 1 38 23952 1 1 17 PRO C C 2.482 -2.828 6.290 1.00 . A A . 17 PRO C 1 1 38 23953 1 1 17 PRO CA C 1.592 -4.033 6.572 1.00 . A A . 17 PRO CA 1 1 38 23954 1 1 17 PRO CB C 2.448 -5.276 6.845 1.00 . A A . 17 PRO CB 1 1 38 23955 1 1 17 PRO CD C 1.102 -5.770 4.935 1.00 . A A . 17 PRO CD 1 1 38 23956 1 1 17 PRO CG C 2.436 -6.044 5.567 1.00 . A A . 17 PRO CG 1 1 38 23957 1 1 17 PRO HA H 0.973 -3.825 7.433 1.00 . A A . 17 PRO HA 1 1 38 23958 1 1 17 PRO HB2 H 3.450 -4.972 7.113 1.00 . A A . 17 PRO HB2 1 1 38 23959 1 1 17 PRO HB3 H 2.012 -5.846 7.651 1.00 . A A . 17 PRO HB3 1 1 38 23960 1 1 17 PRO HD2 H 1.182 -5.795 3.858 1.00 . A A . 17 PRO HD2 1 1 38 23961 1 1 17 PRO HD3 H 0.367 -6.483 5.278 1.00 . A A . 17 PRO HD3 1 1 38 23962 1 1 17 PRO HG2 H 3.234 -5.700 4.925 1.00 . A A . 17 PRO HG2 1 1 38 23963 1 1 17 PRO HG3 H 2.545 -7.098 5.772 1.00 . A A . 17 PRO HG3 1 1 38 23964 1 1 17 PRO N N 0.782 -4.414 5.410 1.00 . A A . 17 PRO N 1 1 38 23965 1 1 17 PRO O O 3.174 -2.781 5.274 1.00 . A A . 17 PRO O 1 1 38 23966 1 1 18 ALA C C 4.729 -1.000 6.768 1.00 . A A . 18 ALA C 1 1 38 23967 1 1 18 ALA CA C 3.270 -0.650 7.047 1.00 . A A . 18 ALA CA 1 1 38 23968 1 1 18 ALA CB C 3.163 0.216 8.293 1.00 . A A . 18 ALA CB 1 1 38 23969 1 1 18 ALA H H 1.890 -1.951 7.987 1.00 . A A . 18 ALA H 1 1 38 23970 1 1 18 ALA HA H 2.879 -0.089 6.211 1.00 . A A . 18 ALA HA 1 1 38 23971 1 1 18 ALA HB1 H 3.583 -0.312 9.136 1.00 . A A . 18 ALA HB1 1 1 38 23972 1 1 18 ALA HB2 H 3.704 1.138 8.138 1.00 . A A . 18 ALA HB2 1 1 38 23973 1 1 18 ALA HB3 H 2.124 0.437 8.488 1.00 . A A . 18 ALA HB3 1 1 38 23974 1 1 18 ALA N N 2.462 -1.855 7.197 1.00 . A A . 18 ALA N 1 1 38 23975 1 1 18 ALA O O 5.198 -2.078 7.132 1.00 . A A . 18 ALA O 1 1 38 23976 1 1 19 GLY C C 7.007 -1.382 4.722 1.00 . A A . 19 GLY C 1 1 38 23977 1 1 19 GLY CA C 6.834 -0.325 5.796 1.00 . A A . 19 GLY CA 1 1 38 23978 1 1 19 GLY H H 5.013 0.753 5.846 1.00 . A A . 19 GLY H 1 1 38 23979 1 1 19 GLY HA2 H 7.347 -0.647 6.690 1.00 . A A . 19 GLY HA2 1 1 38 23980 1 1 19 GLY HA3 H 7.276 0.599 5.452 1.00 . A A . 19 GLY HA3 1 1 38 23981 1 1 19 GLY N N 5.439 -0.087 6.116 1.00 . A A . 19 GLY N 1 1 38 23982 1 1 19 GLY O O 8.078 -1.974 4.592 1.00 . A A . 19 GLY O 1 1 38 23983 1 1 20 THR C C 5.523 -1.997 1.564 1.00 . A A . 20 THR C 1 1 38 23984 1 1 20 THR CA C 5.987 -2.609 2.882 1.00 . A A . 20 THR CA 1 1 38 23985 1 1 20 THR CB C 5.106 -3.807 3.240 1.00 . A A . 20 THR CB 1 1 38 23986 1 1 20 THR CG2 C 5.087 -4.883 2.175 1.00 . A A . 20 THR CG2 1 1 38 23987 1 1 20 THR H H 5.123 -1.113 4.102 1.00 . A A . 20 THR H 1 1 38 23988 1 1 20 THR HA H 7.008 -2.942 2.772 1.00 . A A . 20 THR HA 1 1 38 23989 1 1 20 THR HB H 4.091 -3.464 3.379 1.00 . A A . 20 THR HB 1 1 38 23990 1 1 20 THR HG1 H 4.807 -4.456 5.064 1.00 . A A . 20 THR HG1 1 1 38 23991 1 1 20 THR HG21 H 5.435 -4.470 1.240 1.00 . A A . 20 THR HG21 1 1 38 23992 1 1 20 THR HG22 H 5.734 -5.695 2.473 1.00 . A A . 20 THR HG22 1 1 38 23993 1 1 20 THR HG23 H 4.079 -5.251 2.054 1.00 . A A . 20 THR HG23 1 1 38 23994 1 1 20 THR N N 5.950 -1.618 3.950 1.00 . A A . 20 THR N 1 1 38 23995 1 1 20 THR O O 4.486 -1.336 1.509 1.00 . A A . 20 THR O 1 1 38 23996 1 1 20 THR OG1 O 5.541 -4.406 4.448 1.00 . A A . 20 THR OG1 1 1 38 23997 1 1 21 THR C C 4.541 -2.090 -1.209 1.00 . A A . 21 THR C 1 1 38 23998 1 1 21 THR CA C 5.956 -1.688 -0.811 1.00 . A A . 21 THR CA 1 1 38 23999 1 1 21 THR CB C 6.958 -2.172 -1.860 1.00 . A A . 21 THR CB 1 1 38 24000 1 1 21 THR CG2 C 7.877 -1.074 -2.344 1.00 . A A . 21 THR CG2 1 1 38 24001 1 1 21 THR H H 7.110 -2.755 0.610 1.00 . A A . 21 THR H 1 1 38 24002 1 1 21 THR HA H 6.005 -0.611 -0.754 1.00 . A A . 21 THR HA 1 1 38 24003 1 1 21 THR HB H 6.418 -2.552 -2.715 1.00 . A A . 21 THR HB 1 1 38 24004 1 1 21 THR HG1 H 7.363 -4.063 -1.544 1.00 . A A . 21 THR HG1 1 1 38 24005 1 1 21 THR HG21 H 7.580 -0.136 -1.897 1.00 . A A . 21 THR HG21 1 1 38 24006 1 1 21 THR HG22 H 8.893 -1.303 -2.059 1.00 . A A . 21 THR HG22 1 1 38 24007 1 1 21 THR HG23 H 7.813 -0.998 -3.419 1.00 . A A . 21 THR HG23 1 1 38 24008 1 1 21 THR N N 6.295 -2.220 0.505 1.00 . A A . 21 THR N 1 1 38 24009 1 1 21 THR O O 4.106 -3.211 -0.943 1.00 . A A . 21 THR O 1 1 38 24010 1 1 21 THR OG1 O 7.766 -3.215 -1.343 1.00 . A A . 21 THR OG1 1 1 38 24011 1 1 22 CYS C C 2.161 -0.807 -3.616 1.00 . A A . 22 CYS C 1 1 38 24012 1 1 22 CYS CA C 2.454 -1.425 -2.255 1.00 . A A . 22 CYS CA 1 1 38 24013 1 1 22 CYS CB C 1.479 -0.874 -1.217 1.00 . A A . 22 CYS CB 1 1 38 24014 1 1 22 CYS H H 4.221 -0.288 -2.012 1.00 . A A . 22 CYS H 1 1 38 24015 1 1 22 CYS HA H 2.324 -2.495 -2.322 1.00 . A A . 22 CYS HA 1 1 38 24016 1 1 22 CYS HB2 H 0.472 -1.128 -1.507 1.00 . A A . 22 CYS HB2 1 1 38 24017 1 1 22 CYS HB3 H 1.697 -1.324 -0.260 1.00 . A A . 22 CYS HB3 1 1 38 24018 1 1 22 CYS N N 3.823 -1.166 -1.835 1.00 . A A . 22 CYS N 1 1 38 24019 1 1 22 CYS O O 1.014 -0.483 -3.924 1.00 . A A . 22 CYS O 1 1 38 24020 1 1 22 CYS SG S 1.558 0.937 -1.011 1.00 . A A . 22 CYS SG 1 1 38 24021 1 1 23 TRP C C 4.156 -0.458 -6.697 1.00 . A A . 23 TRP C 1 1 38 24022 1 1 23 TRP CA C 3.022 -0.070 -5.758 1.00 . A A . 23 TRP CA 1 1 38 24023 1 1 23 TRP CB C 2.914 1.455 -5.673 1.00 . A A . 23 TRP CB 1 1 38 24024 1 1 23 TRP CD1 C 1.379 1.360 -7.716 1.00 . A A . 23 TRP CD1 1 1 38 24025 1 1 23 TRP CD2 C 1.578 3.399 -6.821 1.00 . A A . 23 TRP CD2 1 1 38 24026 1 1 23 TRP CE2 C 0.713 3.477 -7.928 1.00 . A A . 23 TRP CE2 1 1 38 24027 1 1 23 TRP CE3 C 1.852 4.561 -6.099 1.00 . A A . 23 TRP CE3 1 1 38 24028 1 1 23 TRP CG C 1.992 2.034 -6.702 1.00 . A A . 23 TRP CG 1 1 38 24029 1 1 23 TRP CH2 C 0.409 5.794 -7.604 1.00 . A A . 23 TRP CH2 1 1 38 24030 1 1 23 TRP CZ2 C 0.122 4.671 -8.329 1.00 . A A . 23 TRP CZ2 1 1 38 24031 1 1 23 TRP CZ3 C 1.266 5.748 -6.498 1.00 . A A . 23 TRP CZ3 1 1 38 24032 1 1 23 TRP H H 4.090 -0.925 -4.142 1.00 . A A . 23 TRP H 1 1 38 24033 1 1 23 TRP HA H 2.102 -0.456 -6.161 1.00 . A A . 23 TRP HA 1 1 38 24034 1 1 23 TRP HB2 H 2.543 1.730 -4.697 1.00 . A A . 23 TRP HB2 1 1 38 24035 1 1 23 TRP HB3 H 3.893 1.888 -5.817 1.00 . A A . 23 TRP HB3 1 1 38 24036 1 1 23 TRP HD1 H 1.496 0.303 -7.896 1.00 . A A . 23 TRP HD1 1 1 38 24037 1 1 23 TRP HE1 H 0.070 1.972 -9.239 1.00 . A A . 23 TRP HE1 1 1 38 24038 1 1 23 TRP HE3 H 2.509 4.544 -5.244 1.00 . A A . 23 TRP HE3 1 1 38 24039 1 1 23 TRP HH2 H -0.026 6.743 -7.882 1.00 . A A . 23 TRP HH2 1 1 38 24040 1 1 23 TRP HZ2 H -0.543 4.722 -9.178 1.00 . A A . 23 TRP HZ2 1 1 38 24041 1 1 23 TRP HZ3 H 1.468 6.657 -5.953 1.00 . A A . 23 TRP HZ3 1 1 38 24042 1 1 23 TRP N N 3.196 -0.647 -4.433 1.00 . A A . 23 TRP N 1 1 38 24043 1 1 23 TRP NE1 N 0.608 2.219 -8.458 1.00 . A A . 23 TRP NE1 1 1 38 24044 1 1 23 TRP O O 3.940 -1.156 -7.687 1.00 . A A . 23 TRP O 1 1 38 24045 1 1 24 LYS C C 6.210 -0.066 -8.693 1.00 . A A . 24 LYS C 1 1 38 24046 1 1 24 LYS CA C 6.534 -0.269 -7.214 1.00 . A A . 24 LYS CA 1 1 38 24047 1 1 24 LYS CB C 7.037 -1.695 -6.968 1.00 . A A . 24 LYS CB 1 1 38 24048 1 1 24 LYS CD C 6.705 -4.139 -7.447 1.00 . A A . 24 LYS CD 1 1 38 24049 1 1 24 LYS CE C 6.622 -4.896 -6.131 1.00 . A A . 24 LYS CE 1 1 38 24050 1 1 24 LYS CG C 6.039 -2.776 -7.348 1.00 . A A . 24 LYS CG 1 1 38 24051 1 1 24 LYS H H 5.457 0.575 -5.594 1.00 . A A . 24 LYS H 1 1 38 24052 1 1 24 LYS HA H 7.308 0.429 -6.932 1.00 . A A . 24 LYS HA 1 1 38 24053 1 1 24 LYS HB2 H 7.937 -1.850 -7.545 1.00 . A A . 24 LYS HB2 1 1 38 24054 1 1 24 LYS HB3 H 7.270 -1.804 -5.919 1.00 . A A . 24 LYS HB3 1 1 38 24055 1 1 24 LYS HD2 H 6.210 -4.716 -8.214 1.00 . A A . 24 LYS HD2 1 1 38 24056 1 1 24 LYS HD3 H 7.744 -4.003 -7.710 1.00 . A A . 24 LYS HD3 1 1 38 24057 1 1 24 LYS HE2 H 7.504 -5.510 -6.028 1.00 . A A . 24 LYS HE2 1 1 38 24058 1 1 24 LYS HE3 H 6.585 -4.182 -5.322 1.00 . A A . 24 LYS HE3 1 1 38 24059 1 1 24 LYS HG2 H 5.265 -2.819 -6.596 1.00 . A A . 24 LYS HG2 1 1 38 24060 1 1 24 LYS HG3 H 5.601 -2.529 -8.304 1.00 . A A . 24 LYS HG3 1 1 38 24061 1 1 24 LYS HZ1 H 4.587 -5.257 -6.432 1.00 . A A . 24 LYS HZ1 1 1 38 24062 1 1 24 LYS HZ2 H 5.562 -6.623 -6.637 1.00 . A A . 24 LYS HZ2 1 1 38 24063 1 1 24 LYS HZ3 H 5.231 -6.048 -5.082 1.00 . A A . 24 LYS HZ3 1 1 38 24064 1 1 24 LYS N N 5.359 0.013 -6.389 1.00 . A A . 24 LYS N 1 1 38 24065 1 1 24 LYS NZ N 5.416 -5.767 -6.066 1.00 . A A . 24 LYS NZ 1 1 38 24066 1 1 24 LYS O O 6.510 -0.915 -9.533 1.00 . A A . 24 LYS O 1 1 38 24067 1 1 25 THR C C 6.407 1.657 -11.242 1.00 . A A . 25 THR C 1 1 38 24068 1 1 25 THR CA C 5.188 1.408 -10.353 1.00 . A A . 25 THR CA 1 1 38 24069 1 1 25 THR CB C 4.287 2.646 -10.326 1.00 . A A . 25 THR CB 1 1 38 24070 1 1 25 THR CG2 C 3.861 3.122 -11.697 1.00 . A A . 25 THR CG2 1 1 38 24071 1 1 25 THR H H 5.366 1.691 -8.266 1.00 . A A . 25 THR H 1 1 38 24072 1 1 25 THR HA H 4.629 0.577 -10.754 1.00 . A A . 25 THR HA 1 1 38 24073 1 1 25 THR HB H 4.820 3.456 -9.847 1.00 . A A . 25 THR HB 1 1 38 24074 1 1 25 THR HG1 H 2.562 3.178 -9.568 1.00 . A A . 25 THR HG1 1 1 38 24075 1 1 25 THR HG21 H 4.503 2.685 -12.446 1.00 . A A . 25 THR HG21 1 1 38 24076 1 1 25 THR HG22 H 2.839 2.824 -11.878 1.00 . A A . 25 THR HG22 1 1 38 24077 1 1 25 THR HG23 H 3.935 4.199 -11.741 1.00 . A A . 25 THR HG23 1 1 38 24078 1 1 25 THR N N 5.582 1.066 -8.990 1.00 . A A . 25 THR N 1 1 38 24079 1 1 25 THR O O 6.622 2.771 -11.720 1.00 . A A . 25 THR O 1 1 38 24080 1 1 25 THR OG1 O 3.111 2.391 -9.580 1.00 . A A . 25 THR OG1 1 1 38 24081 1 1 26 SER C C 9.488 1.487 -11.565 1.00 . A A . 26 SER C 1 1 38 24082 1 1 26 SER CA C 8.402 0.704 -12.286 1.00 . A A . 26 SER CA 1 1 38 24083 1 1 26 SER CB C 8.082 1.365 -13.629 1.00 . A A . 26 SER CB 1 1 38 24084 1 1 26 SER H H 6.981 -0.243 -11.048 1.00 . A A . 26 SER H 1 1 38 24085 1 1 26 SER HA H 8.759 -0.298 -12.463 1.00 . A A . 26 SER HA 1 1 38 24086 1 1 26 SER HB2 H 8.032 2.435 -13.499 1.00 . A A . 26 SER HB2 1 1 38 24087 1 1 26 SER HB3 H 8.860 1.125 -14.340 1.00 . A A . 26 SER HB3 1 1 38 24088 1 1 26 SER HG H 6.954 0.621 -15.048 1.00 . A A . 26 SER HG 1 1 38 24089 1 1 26 SER N N 7.203 0.611 -11.458 1.00 . A A . 26 SER N 1 1 38 24090 1 1 26 SER O O 10.596 0.995 -11.354 1.00 . A A . 26 SER O 1 1 38 24091 1 1 26 SER OG O 6.841 0.910 -14.139 1.00 . A A . 26 SER OG 1 1 38 24092 1 1 27 VAL C C 9.430 4.151 -9.232 1.00 . A A . 27 VAL C 1 1 38 24093 1 1 27 VAL CA C 10.076 3.582 -10.489 1.00 . A A . 27 VAL CA 1 1 38 24094 1 1 27 VAL CB C 10.537 4.734 -11.401 1.00 . A A . 27 VAL CB 1 1 38 24095 1 1 27 VAL CG1 C 9.427 5.761 -11.590 1.00 . A A . 27 VAL CG1 1 1 38 24096 1 1 27 VAL CG2 C 11.793 5.388 -10.846 1.00 . A A . 27 VAL CG2 1 1 38 24097 1 1 27 VAL H H 8.253 3.033 -11.393 1.00 . A A . 27 VAL H 1 1 38 24098 1 1 27 VAL HA H 10.940 3.001 -10.209 1.00 . A A . 27 VAL HA 1 1 38 24099 1 1 27 VAL HB H 10.772 4.314 -12.368 1.00 . A A . 27 VAL HB 1 1 38 24100 1 1 27 VAL HG11 H 8.553 5.275 -11.999 1.00 . A A . 27 VAL HG11 1 1 38 24101 1 1 27 VAL HG12 H 9.179 6.203 -10.636 1.00 . A A . 27 VAL HG12 1 1 38 24102 1 1 27 VAL HG13 H 9.761 6.532 -12.268 1.00 . A A . 27 VAL HG13 1 1 38 24103 1 1 27 VAL HG21 H 12.488 4.623 -10.532 1.00 . A A . 27 VAL HG21 1 1 38 24104 1 1 27 VAL HG22 H 12.249 5.998 -11.611 1.00 . A A . 27 VAL HG22 1 1 38 24105 1 1 27 VAL HG23 H 11.532 6.006 -10.000 1.00 . A A . 27 VAL HG23 1 1 38 24106 1 1 27 VAL N N 9.152 2.709 -11.191 1.00 . A A . 27 VAL N 1 1 38 24107 1 1 27 VAL O O 10.062 4.248 -8.181 1.00 . A A . 27 VAL O 1 1 38 24108 1 1 28 SER C C 7.005 3.979 -7.264 1.00 . A A . 28 SER C 1 1 38 24109 1 1 28 SER CA C 7.411 5.076 -8.242 1.00 . A A . 28 SER CA 1 1 38 24110 1 1 28 SER CB C 6.167 5.810 -8.754 1.00 . A A . 28 SER CB 1 1 38 24111 1 1 28 SER H H 7.718 4.413 -10.222 1.00 . A A . 28 SER H 1 1 38 24112 1 1 28 SER HA H 8.049 5.781 -7.730 1.00 . A A . 28 SER HA 1 1 38 24113 1 1 28 SER HB2 H 5.280 5.304 -8.403 1.00 . A A . 28 SER HB2 1 1 38 24114 1 1 28 SER HB3 H 6.173 6.824 -8.382 1.00 . A A . 28 SER HB3 1 1 38 24115 1 1 28 SER HG H 5.245 5.681 -10.478 1.00 . A A . 28 SER HG 1 1 38 24116 1 1 28 SER N N 8.161 4.520 -9.356 1.00 . A A . 28 SER N 1 1 38 24117 1 1 28 SER O O 5.915 3.416 -7.365 1.00 . A A . 28 SER O 1 1 38 24118 1 1 28 SER OG O 6.140 5.845 -10.171 1.00 . A A . 28 SER OG 1 1 38 24119 1 1 29 SER C C 7.175 3.302 -4.006 1.00 . A A . 29 SER C 1 1 38 24120 1 1 29 SER CA C 7.618 2.658 -5.314 1.00 . A A . 29 SER CA 1 1 38 24121 1 1 29 SER CB C 8.862 1.797 -5.083 1.00 . A A . 29 SER CB 1 1 38 24122 1 1 29 SER H H 8.737 4.169 -6.285 1.00 . A A . 29 SER H 1 1 38 24123 1 1 29 SER HA H 6.818 2.033 -5.684 1.00 . A A . 29 SER HA 1 1 38 24124 1 1 29 SER HB2 H 9.550 1.935 -5.903 1.00 . A A . 29 SER HB2 1 1 38 24125 1 1 29 SER HB3 H 9.338 2.095 -4.160 1.00 . A A . 29 SER HB3 1 1 38 24126 1 1 29 SER HG H 9.272 -0.070 -4.657 1.00 . A A . 29 SER HG 1 1 38 24127 1 1 29 SER N N 7.887 3.683 -6.315 1.00 . A A . 29 SER N 1 1 38 24128 1 1 29 SER O O 7.964 3.961 -3.328 1.00 . A A . 29 SER O 1 1 38 24129 1 1 29 SER OG O 8.524 0.424 -4.999 1.00 . A A . 29 SER OG 1 1 38 24130 1 1 30 HIS C C 5.026 2.622 -1.421 1.00 . A A . 30 HIS C 1 1 38 24131 1 1 30 HIS CA C 5.351 3.701 -2.449 1.00 . A A . 30 HIS CA 1 1 38 24132 1 1 30 HIS CB C 4.098 4.511 -2.786 1.00 . A A . 30 HIS CB 1 1 38 24133 1 1 30 HIS CD2 C 4.875 5.294 -5.132 1.00 . A A . 30 HIS CD2 1 1 38 24134 1 1 30 HIS CE1 C 4.218 7.380 -5.018 1.00 . A A . 30 HIS CE1 1 1 38 24135 1 1 30 HIS CG C 4.304 5.472 -3.917 1.00 . A A . 30 HIS CG 1 1 38 24136 1 1 30 HIS H H 5.322 2.598 -4.253 1.00 . A A . 30 HIS H 1 1 38 24137 1 1 30 HIS HA H 6.093 4.365 -2.031 1.00 . A A . 30 HIS HA 1 1 38 24138 1 1 30 HIS HB2 H 3.304 3.833 -3.068 1.00 . A A . 30 HIS HB2 1 1 38 24139 1 1 30 HIS HB3 H 3.794 5.076 -1.917 1.00 . A A . 30 HIS HB3 1 1 38 24140 1 1 30 HIS HD1 H 3.454 7.230 -3.124 1.00 . A A . 30 HIS HD1 1 1 38 24141 1 1 30 HIS HD2 H 5.301 4.377 -5.509 1.00 . A A . 30 HIS HD2 1 1 38 24142 1 1 30 HIS HE1 H 4.026 8.410 -5.274 1.00 . A A . 30 HIS HE1 1 1 38 24143 1 1 30 HIS HE2 H 5.244 6.695 -6.647 1.00 . A A . 30 HIS HE2 1 1 38 24144 1 1 30 HIS N N 5.905 3.123 -3.666 1.00 . A A . 30 HIS N 1 1 38 24145 1 1 30 HIS ND1 N 3.903 6.791 -3.876 1.00 . A A . 30 HIS ND1 1 1 38 24146 1 1 30 HIS NE2 N 4.809 6.493 -5.794 1.00 . A A . 30 HIS NE2 1 1 38 24147 1 1 30 HIS O O 4.294 1.675 -1.709 1.00 . A A . 30 HIS O 1 1 38 24148 1 1 31 TYR C C 4.015 2.074 1.539 1.00 . A A . 31 TYR C 1 1 38 24149 1 1 31 TYR CA C 5.353 1.818 0.856 1.00 . A A . 31 TYR CA 1 1 38 24150 1 1 31 TYR CB C 6.483 1.906 1.884 1.00 . A A . 31 TYR CB 1 1 38 24151 1 1 31 TYR CD1 C 8.458 0.439 2.445 1.00 . A A . 31 TYR CD1 1 1 38 24152 1 1 31 TYR CD2 C 8.171 1.116 0.178 1.00 . A A . 31 TYR CD2 1 1 38 24153 1 1 31 TYR CE1 C 9.596 -0.262 2.096 1.00 . A A . 31 TYR CE1 1 1 38 24154 1 1 31 TYR CE2 C 9.308 0.417 -0.179 1.00 . A A . 31 TYR CE2 1 1 38 24155 1 1 31 TYR CG C 7.727 1.139 1.494 1.00 . A A . 31 TYR CG 1 1 38 24156 1 1 31 TYR CZ C 10.017 -0.270 0.784 1.00 . A A . 31 TYR CZ 1 1 38 24157 1 1 31 TYR H H 6.153 3.552 -0.057 1.00 . A A . 31 TYR H 1 1 38 24158 1 1 31 TYR HA H 5.344 0.828 0.426 1.00 . A A . 31 TYR HA 1 1 38 24159 1 1 31 TYR HB2 H 6.761 2.941 2.015 1.00 . A A . 31 TYR HB2 1 1 38 24160 1 1 31 TYR HB3 H 6.132 1.512 2.827 1.00 . A A . 31 TYR HB3 1 1 38 24161 1 1 31 TYR HD1 H 8.126 0.447 3.473 1.00 . A A . 31 TYR HD1 1 1 38 24162 1 1 31 TYR HD2 H 7.614 1.656 -0.574 1.00 . A A . 31 TYR HD2 1 1 38 24163 1 1 31 TYR HE1 H 10.150 -0.801 2.851 1.00 . A A . 31 TYR HE1 1 1 38 24164 1 1 31 TYR HE2 H 9.638 0.411 -1.208 1.00 . A A . 31 TYR HE2 1 1 38 24165 1 1 31 TYR HH H 10.902 -1.759 -0.052 1.00 . A A . 31 TYR HH 1 1 38 24166 1 1 31 TYR N N 5.578 2.775 -0.222 1.00 . A A . 31 TYR N 1 1 38 24167 1 1 31 TYR O O 3.533 3.206 1.576 1.00 . A A . 31 TYR O 1 1 38 24168 1 1 31 TYR OH O 11.150 -0.968 0.432 1.00 . A A . 31 TYR OH 1 1 38 24169 1 1 32 CYS C C 2.336 1.710 4.171 1.00 . A A . 32 CYS C 1 1 38 24170 1 1 32 CYS CA C 2.142 1.136 2.774 1.00 . A A . 32 CYS CA 1 1 38 24171 1 1 32 CYS CB C 1.451 -0.229 2.869 1.00 . A A . 32 CYS CB 1 1 38 24172 1 1 32 CYS H H 3.856 0.141 2.029 1.00 . A A . 32 CYS H 1 1 38 24173 1 1 32 CYS HA H 1.522 1.809 2.206 1.00 . A A . 32 CYS HA 1 1 38 24174 1 1 32 CYS HB2 H 2.188 -1.004 2.723 1.00 . A A . 32 CYS HB2 1 1 38 24175 1 1 32 CYS HB3 H 1.019 -0.336 3.854 1.00 . A A . 32 CYS HB3 1 1 38 24176 1 1 32 CYS N N 3.421 1.018 2.086 1.00 . A A . 32 CYS N 1 1 38 24177 1 1 32 CYS O O 3.394 1.549 4.779 1.00 . A A . 32 CYS O 1 1 38 24178 1 1 32 CYS SG S 0.121 -0.503 1.650 1.00 . A A . 32 CYS SG 1 1 38 24179 1 1 33 THR C C 0.535 2.126 6.995 1.00 . A A . 33 THR C 1 1 38 24180 1 1 33 THR CA C 1.353 2.957 6.010 1.00 . A A . 33 THR CA 1 1 38 24181 1 1 33 THR CB C 0.830 4.394 5.979 1.00 . A A . 33 THR CB 1 1 38 24182 1 1 33 THR CG2 C 1.446 5.231 4.878 1.00 . A A . 33 THR CG2 1 1 38 24183 1 1 33 THR H H 0.484 2.457 4.149 1.00 . A A . 33 THR H 1 1 38 24184 1 1 33 THR HA H 2.384 2.964 6.332 1.00 . A A . 33 THR HA 1 1 38 24185 1 1 33 THR HB H 1.057 4.869 6.922 1.00 . A A . 33 THR HB 1 1 38 24186 1 1 33 THR HG1 H -0.790 4.073 4.926 1.00 . A A . 33 THR HG1 1 1 38 24187 1 1 33 THR HG21 H 2.029 4.596 4.227 1.00 . A A . 33 THR HG21 1 1 38 24188 1 1 33 THR HG22 H 0.663 5.708 4.308 1.00 . A A . 33 THR HG22 1 1 38 24189 1 1 33 THR HG23 H 2.085 5.984 5.314 1.00 . A A . 33 THR HG23 1 1 38 24190 1 1 33 THR N N 1.303 2.370 4.679 1.00 . A A . 33 THR N 1 1 38 24191 1 1 33 THR O O 0.252 2.568 8.108 1.00 . A A . 33 THR O 1 1 38 24192 1 1 33 THR OG1 O -0.574 4.412 5.798 1.00 . A A . 33 THR OG1 1 1 38 24193 1 1 34 GLY C C -1.778 0.758 8.110 1.00 . A A . 34 GLY C 1 1 38 24194 1 1 34 GLY CA C -0.627 0.040 7.430 1.00 . A A . 34 GLY CA 1 1 38 24195 1 1 34 GLY H H 0.414 0.616 5.677 1.00 . A A . 34 GLY H 1 1 38 24196 1 1 34 GLY HA2 H 0.020 -0.377 8.188 1.00 . A A . 34 GLY HA2 1 1 38 24197 1 1 34 GLY HA3 H -1.025 -0.765 6.830 1.00 . A A . 34 GLY HA3 1 1 38 24198 1 1 34 GLY N N 0.157 0.917 6.575 1.00 . A A . 34 GLY N 1 1 38 24199 1 1 34 GLY O O -1.893 0.734 9.336 1.00 . A A . 34 GLY O 1 1 38 24200 1 1 35 ARG C C -4.846 2.363 6.807 1.00 . A A . 35 ARG C 1 1 38 24201 1 1 35 ARG CA C -3.769 2.130 7.862 1.00 . A A . 35 ARG CA 1 1 38 24202 1 1 35 ARG CB C -3.312 3.470 8.442 1.00 . A A . 35 ARG CB 1 1 38 24203 1 1 35 ARG CD C -4.302 5.575 9.393 1.00 . A A . 35 ARG CD 1 1 38 24204 1 1 35 ARG CG C -4.280 4.056 9.456 1.00 . A A . 35 ARG CG 1 1 38 24205 1 1 35 ARG CZ C -2.199 6.273 10.472 1.00 . A A . 35 ARG CZ 1 1 38 24206 1 1 35 ARG H H -2.486 1.388 6.348 1.00 . A A . 35 ARG H 1 1 38 24207 1 1 35 ARG HA H -4.189 1.534 8.655 1.00 . A A . 35 ARG HA 1 1 38 24208 1 1 35 ARG HB2 H -2.356 3.332 8.926 1.00 . A A . 35 ARG HB2 1 1 38 24209 1 1 35 ARG HB3 H -3.198 4.178 7.635 1.00 . A A . 35 ARG HB3 1 1 38 24210 1 1 35 ARG HD2 H -4.814 5.877 8.492 1.00 . A A . 35 ARG HD2 1 1 38 24211 1 1 35 ARG HD3 H -4.835 5.950 10.253 1.00 . A A . 35 ARG HD3 1 1 38 24212 1 1 35 ARG HE H -2.595 6.440 8.523 1.00 . A A . 35 ARG HE 1 1 38 24213 1 1 35 ARG HG2 H -5.272 3.683 9.250 1.00 . A A . 35 ARG HG2 1 1 38 24214 1 1 35 ARG HG3 H -3.977 3.750 10.447 1.00 . A A . 35 ARG HG3 1 1 38 24215 1 1 35 ARG HH11 H -3.567 5.482 11.735 1.00 . A A . 35 ARG HH11 1 1 38 24216 1 1 35 ARG HH12 H -2.080 5.980 12.469 1.00 . A A . 35 ARG HH12 1 1 38 24217 1 1 35 ARG HH21 H -0.639 7.096 9.487 1.00 . A A . 35 ARG HH21 1 1 38 24218 1 1 35 ARG HH22 H -0.418 6.897 11.193 1.00 . A A . 35 ARG HH22 1 1 38 24219 1 1 35 ARG N N -2.629 1.401 7.317 1.00 . A A . 35 ARG N 1 1 38 24220 1 1 35 ARG NE N -2.955 6.141 9.384 1.00 . A A . 35 ARG NE 1 1 38 24221 1 1 35 ARG NH1 N -2.653 5.879 11.656 1.00 . A A . 35 ARG NH1 1 1 38 24222 1 1 35 ARG NH2 N -0.986 6.798 10.376 1.00 . A A . 35 ARG NH2 1 1 38 24223 1 1 35 ARG O O -6.038 2.239 7.088 1.00 . A A . 35 ARG O 1 1 38 24224 1 1 36 SER C C -4.955 2.241 3.233 1.00 . A A . 36 SER C 1 1 38 24225 1 1 36 SER CA C -5.365 2.967 4.510 1.00 . A A . 36 SER CA 1 1 38 24226 1 1 36 SER CB C -5.465 4.470 4.243 1.00 . A A . 36 SER CB 1 1 38 24227 1 1 36 SER H H -3.462 2.800 5.431 1.00 . A A . 36 SER H 1 1 38 24228 1 1 36 SER HA H -6.333 2.603 4.819 1.00 . A A . 36 SER HA 1 1 38 24229 1 1 36 SER HB2 H -5.270 5.010 5.158 1.00 . A A . 36 SER HB2 1 1 38 24230 1 1 36 SER HB3 H -4.737 4.750 3.497 1.00 . A A . 36 SER HB3 1 1 38 24231 1 1 36 SER HG H -6.865 4.511 2.873 1.00 . A A . 36 SER HG 1 1 38 24232 1 1 36 SER N N -4.424 2.710 5.596 1.00 . A A . 36 SER N 1 1 38 24233 1 1 36 SER O O -3.776 1.962 3.014 1.00 . A A . 36 SER O 1 1 38 24234 1 1 36 SER OG O -6.756 4.820 3.775 1.00 . A A . 36 SER OG 1 1 38 24235 1 1 37 CYS C C -5.017 2.184 0.122 1.00 . A A . 37 CYS C 1 1 38 24236 1 1 37 CYS CA C -5.693 1.257 1.129 1.00 . A A . 37 CYS CA 1 1 38 24237 1 1 37 CYS CB C -7.006 0.733 0.549 1.00 . A A . 37 CYS CB 1 1 38 24238 1 1 37 CYS H H -6.858 2.197 2.619 1.00 . A A . 37 CYS H 1 1 38 24239 1 1 37 CYS HA H -5.039 0.422 1.329 1.00 . A A . 37 CYS HA 1 1 38 24240 1 1 37 CYS HB2 H -7.744 0.687 1.335 1.00 . A A . 37 CYS HB2 1 1 38 24241 1 1 37 CYS HB3 H -7.348 1.411 -0.218 1.00 . A A . 37 CYS HB3 1 1 38 24242 1 1 37 CYS N N -5.940 1.944 2.390 1.00 . A A . 37 CYS N 1 1 38 24243 1 1 37 CYS O O -4.523 1.736 -0.912 1.00 . A A . 37 CYS O 1 1 38 24244 1 1 37 CYS SG S -6.886 -0.925 -0.191 1.00 . A A . 37 CYS SG 1 1 38 24245 1 1 38 GLU C C -2.899 4.615 -0.154 1.00 . A A . 38 GLU C 1 1 38 24246 1 1 38 GLU CA C -4.387 4.463 -0.456 1.00 . A A . 38 GLU CA 1 1 38 24247 1 1 38 GLU CB C -5.089 5.815 -0.313 1.00 . A A . 38 GLU CB 1 1 38 24248 1 1 38 GLU CD C -4.681 8.283 -0.665 1.00 . A A . 38 GLU CD 1 1 38 24249 1 1 38 GLU CG C -4.538 6.887 -1.239 1.00 . A A . 38 GLU CG 1 1 38 24250 1 1 38 GLU H H -5.415 3.778 1.264 1.00 . A A . 38 GLU H 1 1 38 24251 1 1 38 GLU HA H -4.502 4.114 -1.472 1.00 . A A . 38 GLU HA 1 1 38 24252 1 1 38 GLU HB2 H -6.139 5.687 -0.530 1.00 . A A . 38 GLU HB2 1 1 38 24253 1 1 38 GLU HB3 H -4.979 6.158 0.705 1.00 . A A . 38 GLU HB3 1 1 38 24254 1 1 38 GLU HG2 H -3.491 6.692 -1.413 1.00 . A A . 38 GLU HG2 1 1 38 24255 1 1 38 GLU HG3 H -5.072 6.843 -2.178 1.00 . A A . 38 GLU HG3 1 1 38 24256 1 1 38 GLU N N -5.001 3.478 0.427 1.00 . A A . 38 GLU N 1 1 38 24257 1 1 38 GLU O O -2.519 5.175 0.874 1.00 . A A . 38 GLU O 1 1 38 24258 1 1 38 GLU OE1 O -5.102 9.192 -1.412 1.00 . A A . 38 GLU OE1 1 1 38 24259 1 1 38 GLU OE2 O -4.373 8.467 0.531 1.00 . A A . 38 GLU OE2 1 1 38 24260 1 1 39 CYS C C -0.150 5.651 -0.901 1.00 . A A . 39 CYS C 1 1 38 24261 1 1 39 CYS CA C -0.615 4.196 -0.887 1.00 . A A . 39 CYS CA 1 1 38 24262 1 1 39 CYS CB C 0.097 3.413 -1.993 1.00 . A A . 39 CYS CB 1 1 38 24263 1 1 39 CYS H H -2.425 3.680 -1.857 1.00 . A A . 39 CYS H 1 1 38 24264 1 1 39 CYS HA H -0.368 3.760 0.069 1.00 . A A . 39 CYS HA 1 1 38 24265 1 1 39 CYS HB2 H -0.272 3.743 -2.952 1.00 . A A . 39 CYS HB2 1 1 38 24266 1 1 39 CYS HB3 H 1.158 3.609 -1.935 1.00 . A A . 39 CYS HB3 1 1 38 24267 1 1 39 CYS N N -2.062 4.114 -1.057 1.00 . A A . 39 CYS N 1 1 38 24268 1 1 39 CYS O O -0.742 6.493 -1.577 1.00 . A A . 39 CYS O 1 1 38 24269 1 1 39 CYS SG S -0.140 1.608 -1.902 1.00 . A A . 39 CYS SG 1 1 38 24270 1 1 40 PRO C C 1.726 7.912 -1.470 1.00 . A A . 40 PRO C 1 1 38 24271 1 1 40 PRO CA C 1.463 7.327 -0.087 1.00 . A A . 40 PRO CA 1 1 38 24272 1 1 40 PRO CB C 2.776 7.152 0.678 1.00 . A A . 40 PRO CB 1 1 38 24273 1 1 40 PRO CD C 1.689 5.024 0.681 1.00 . A A . 40 PRO CD 1 1 38 24274 1 1 40 PRO CG C 2.577 5.923 1.496 1.00 . A A . 40 PRO CG 1 1 38 24275 1 1 40 PRO HA H 0.807 7.987 0.462 1.00 . A A . 40 PRO HA 1 1 38 24276 1 1 40 PRO HB2 H 3.591 7.034 -0.022 1.00 . A A . 40 PRO HB2 1 1 38 24277 1 1 40 PRO HB3 H 2.951 8.016 1.302 1.00 . A A . 40 PRO HB3 1 1 38 24278 1 1 40 PRO HD2 H 2.283 4.361 0.069 1.00 . A A . 40 PRO HD2 1 1 38 24279 1 1 40 PRO HD3 H 1.032 4.457 1.325 1.00 . A A . 40 PRO HD3 1 1 38 24280 1 1 40 PRO HG2 H 3.528 5.446 1.679 1.00 . A A . 40 PRO HG2 1 1 38 24281 1 1 40 PRO HG3 H 2.097 6.177 2.430 1.00 . A A . 40 PRO HG3 1 1 38 24282 1 1 40 PRO N N 0.921 5.966 -0.154 1.00 . A A . 40 PRO N 1 1 38 24283 1 1 40 PRO O O 1.526 7.245 -2.485 1.00 . A A . 40 PRO O 1 1 38 24284 1 1 41 SER C C 3.941 10.205 -2.859 1.00 . A A . 41 SER C 1 1 38 24285 1 1 41 SER CA C 2.464 9.836 -2.764 1.00 . A A . 41 SER CA 1 1 38 24286 1 1 41 SER CB C 1.603 11.093 -2.905 1.00 . A A . 41 SER CB 1 1 38 24287 1 1 41 SER H H 2.313 9.643 -0.661 1.00 . A A . 41 SER H 1 1 38 24288 1 1 41 SER HA H 2.224 9.155 -3.567 1.00 . A A . 41 SER HA 1 1 38 24289 1 1 41 SER HB2 H 0.624 10.904 -2.489 1.00 . A A . 41 SER HB2 1 1 38 24290 1 1 41 SER HB3 H 2.069 11.908 -2.372 1.00 . A A . 41 SER HB3 1 1 38 24291 1 1 41 SER HG H 2.319 11.648 -4.642 1.00 . A A . 41 SER HG 1 1 38 24292 1 1 41 SER N N 2.174 9.162 -1.504 1.00 . A A . 41 SER N 1 1 38 24293 1 1 41 SER O O 4.296 11.258 -3.389 1.00 . A A . 41 SER O 1 1 38 24294 1 1 41 SER OG O 1.456 11.462 -4.265 1.00 . A A . 41 SER OG 1 1 38 24295 1 1 42 TYR C C 7.004 8.244 -2.358 1.00 . A A . 42 TYR C 1 1 38 24296 1 1 42 TYR CA C 6.238 9.565 -2.369 1.00 . A A . 42 TYR CA 1 1 38 24297 1 1 42 TYR CB C 6.660 10.425 -1.177 1.00 . A A . 42 TYR CB 1 1 38 24298 1 1 42 TYR CD1 C 5.240 9.750 0.800 1.00 . A A . 42 TYR CD1 1 1 38 24299 1 1 42 TYR CD2 C 7.533 9.097 0.785 1.00 . A A . 42 TYR CD2 1 1 38 24300 1 1 42 TYR CE1 C 5.067 9.130 2.022 1.00 . A A . 42 TYR CE1 1 1 38 24301 1 1 42 TYR CE2 C 7.367 8.474 2.007 1.00 . A A . 42 TYR CE2 1 1 38 24302 1 1 42 TYR CG C 6.474 9.745 0.161 1.00 . A A . 42 TYR CG 1 1 38 24303 1 1 42 TYR CZ C 6.133 8.493 2.622 1.00 . A A . 42 TYR CZ 1 1 38 24304 1 1 42 TYR H H 4.455 8.509 -1.933 1.00 . A A . 42 TYR H 1 1 38 24305 1 1 42 TYR HA H 6.469 10.093 -3.282 1.00 . A A . 42 TYR HA 1 1 38 24306 1 1 42 TYR HB2 H 7.705 10.678 -1.276 1.00 . A A . 42 TYR HB2 1 1 38 24307 1 1 42 TYR HB3 H 6.074 11.333 -1.172 1.00 . A A . 42 TYR HB3 1 1 38 24308 1 1 42 TYR HD1 H 4.407 10.249 0.327 1.00 . A A . 42 TYR HD1 1 1 38 24309 1 1 42 TYR HD2 H 8.498 9.085 0.302 1.00 . A A . 42 TYR HD2 1 1 38 24310 1 1 42 TYR HE1 H 4.100 9.145 2.503 1.00 . A A . 42 TYR HE1 1 1 38 24311 1 1 42 TYR HE2 H 8.203 7.976 2.476 1.00 . A A . 42 TYR HE2 1 1 38 24312 1 1 42 TYR HH H 6.264 6.964 3.779 1.00 . A A . 42 TYR HH 1 1 38 24313 1 1 42 TYR N N 4.798 9.331 -2.342 1.00 . A A . 42 TYR N 1 1 38 24314 1 1 42 TYR O O 6.549 7.258 -1.777 1.00 . A A . 42 TYR O 1 1 38 24315 1 1 42 TYR OH O 5.964 7.874 3.839 1.00 . A A . 42 TYR OH 1 1 38 24316 1 1 43 PRO C C 9.651 6.666 -1.721 1.00 . A A . 43 PRO C 1 1 38 24317 1 1 43 PRO CA C 9.010 6.997 -3.065 1.00 . A A . 43 PRO CA 1 1 38 24318 1 1 43 PRO CB C 10.082 7.354 -4.096 1.00 . A A . 43 PRO CB 1 1 38 24319 1 1 43 PRO CD C 8.799 9.336 -3.723 1.00 . A A . 43 PRO CD 1 1 38 24320 1 1 43 PRO CG C 10.184 8.838 -4.035 1.00 . A A . 43 PRO CG 1 1 38 24321 1 1 43 PRO HA H 8.442 6.146 -3.410 1.00 . A A . 43 PRO HA 1 1 38 24322 1 1 43 PRO HB2 H 11.015 6.880 -3.828 1.00 . A A . 43 PRO HB2 1 1 38 24323 1 1 43 PRO HB3 H 9.770 7.020 -5.074 1.00 . A A . 43 PRO HB3 1 1 38 24324 1 1 43 PRO HD2 H 8.847 10.214 -3.095 1.00 . A A . 43 PRO HD2 1 1 38 24325 1 1 43 PRO HD3 H 8.262 9.552 -4.634 1.00 . A A . 43 PRO HD3 1 1 38 24326 1 1 43 PRO HG2 H 10.871 9.127 -3.254 1.00 . A A . 43 PRO HG2 1 1 38 24327 1 1 43 PRO HG3 H 10.514 9.223 -4.989 1.00 . A A . 43 PRO HG3 1 1 38 24328 1 1 43 PRO N N 8.182 8.206 -3.003 1.00 . A A . 43 PRO N 1 1 38 24329 1 1 43 PRO O O 9.290 7.236 -0.692 1.00 . A A . 43 PRO O 1 1 38 24330 1 1 44 GLY C C 12.257 6.403 -0.031 1.00 . A A . 44 GLY C 1 1 38 24331 1 1 44 GLY CA C 11.281 5.349 -0.517 1.00 . A A . 44 GLY CA 1 1 38 24332 1 1 44 GLY H H 10.851 5.319 -2.589 1.00 . A A . 44 GLY H 1 1 38 24333 1 1 44 GLY HA2 H 11.821 4.430 -0.695 1.00 . A A . 44 GLY HA2 1 1 38 24334 1 1 44 GLY HA3 H 10.542 5.177 0.252 1.00 . A A . 44 GLY HA3 1 1 38 24335 1 1 44 GLY N N 10.605 5.740 -1.739 1.00 . A A . 44 GLY N 1 1 38 24336 1 1 44 GLY O O 11.953 7.162 0.889 1.00 . A A . 44 GLY O 1 1 38 24337 1 1 45 ASN C C 14.349 8.679 -1.126 1.00 . A A . 45 ASN C 1 1 38 24338 1 1 45 ASN CA C 14.456 7.418 -0.275 1.00 . A A . 45 ASN CA 1 1 38 24339 1 1 45 ASN CB C 15.848 6.803 -0.425 1.00 . A A . 45 ASN CB 1 1 38 24340 1 1 45 ASN CG C 16.035 5.576 0.446 1.00 . A A . 45 ASN CG 1 1 38 24341 1 1 45 ASN H H 13.615 5.817 -1.376 1.00 . A A . 45 ASN H 1 1 38 24342 1 1 45 ASN HA H 14.298 7.682 0.760 1.00 . A A . 45 ASN HA 1 1 38 24343 1 1 45 ASN HB2 H 16.000 6.517 -1.455 1.00 . A A . 45 ASN HB2 1 1 38 24344 1 1 45 ASN HB3 H 16.591 7.536 -0.146 1.00 . A A . 45 ASN HB3 1 1 38 24345 1 1 45 ASN HD21 H 17.670 6.368 1.255 1.00 . A A . 45 ASN HD21 1 1 38 24346 1 1 45 ASN HD22 H 17.229 4.802 1.835 1.00 . A A . 45 ASN HD22 1 1 38 24347 1 1 45 ASN N N 13.432 6.449 -0.650 1.00 . A A . 45 ASN N 1 1 38 24348 1 1 45 ASN ND2 N 17.084 5.583 1.261 1.00 . A A . 45 ASN ND2 1 1 38 24349 1 1 45 ASN O O 14.738 8.686 -2.294 1.00 . A A . 45 ASN O 1 1 38 24350 1 1 45 ASN OD1 O 15.247 4.633 0.387 1.00 . A A . 45 ASN OD1 1 1 38 24351 1 1 46 GLY C C 13.813 12.204 -0.347 1.00 . A A . 46 GLY C 1 1 38 24352 1 1 46 GLY CA C 13.673 10.996 -1.252 1.00 . A A . 46 GLY CA 1 1 38 24353 1 1 46 GLY H H 13.528 9.680 0.400 1.00 . A A . 46 GLY H 1 1 38 24354 1 1 46 GLY HA2 H 12.698 11.019 -1.716 1.00 . A A . 46 GLY HA2 1 1 38 24355 1 1 46 GLY HA3 H 14.428 11.047 -2.022 1.00 . A A . 46 GLY HA3 1 1 38 24356 1 1 46 GLY N N 13.821 9.744 -0.533 1.00 . A A . 46 GLY N 1 1 38 24357 1 1 46 GLY O O 14.113 13.301 -0.864 1.00 . A A . 46 GLY O 1 1 38 24358 1 1 46 GLY OXT O 13.622 12.054 0.878 1.00 . A A . 46 GLY OXT 1 1 39 24359 1 1 1 ALA C C -10.791 -2.666 8.220 1.00 . A A . 1 ALA C 1 1 39 24360 1 1 1 ALA CA C -9.388 -3.093 7.805 1.00 . A A . 1 ALA CA 1 1 39 24361 1 1 1 ALA CB C -9.369 -4.574 7.456 1.00 . A A . 1 ALA CB 1 1 39 24362 1 1 1 ALA H1 H -8.664 -1.896 9.313 1.00 . A A . 1 ALA H1 1 1 39 24363 1 1 1 ALA H2 H -8.454 -3.579 9.572 1.00 . A A . 1 ALA H2 1 1 39 24364 1 1 1 ALA H3 H -7.461 -2.756 8.443 1.00 . A A . 1 ALA H3 1 1 39 24365 1 1 1 ALA HA H -9.101 -2.538 6.924 1.00 . A A . 1 ALA HA 1 1 39 24366 1 1 1 ALA HB1 H -9.496 -4.694 6.390 1.00 . A A . 1 ALA HB1 1 1 39 24367 1 1 1 ALA HB2 H -10.173 -5.076 7.973 1.00 . A A . 1 ALA HB2 1 1 39 24368 1 1 1 ALA HB3 H -8.424 -5.002 7.757 1.00 . A A . 1 ALA HB3 1 1 39 24369 1 1 1 ALA N N -8.403 -2.805 8.880 1.00 . A A . 1 ALA N 1 1 39 24370 1 1 1 ALA O O -11.393 -3.261 9.114 1.00 . A A . 1 ALA O 1 1 39 24371 1 1 2 MET C C -13.621 -1.474 6.749 1.00 . A A . 2 MET C 1 1 39 24372 1 1 2 MET CA C -12.642 -1.125 7.865 1.00 . A A . 2 MET CA 1 1 39 24373 1 1 2 MET CB C -12.600 0.391 8.067 1.00 . A A . 2 MET CB 1 1 39 24374 1 1 2 MET CE C -12.923 3.347 8.575 1.00 . A A . 2 MET CE 1 1 39 24375 1 1 2 MET CG C -12.323 0.806 9.503 1.00 . A A . 2 MET CG 1 1 39 24376 1 1 2 MET H H -10.779 -1.199 6.862 1.00 . A A . 2 MET H 1 1 39 24377 1 1 2 MET HA H -12.975 -1.592 8.780 1.00 . A A . 2 MET HA 1 1 39 24378 1 1 2 MET HB2 H -11.825 0.805 7.439 1.00 . A A . 2 MET HB2 1 1 39 24379 1 1 2 MET HB3 H -13.552 0.808 7.772 1.00 . A A . 2 MET HB3 1 1 39 24380 1 1 2 MET HE1 H -11.862 3.387 8.379 1.00 . A A . 2 MET HE1 1 1 39 24381 1 1 2 MET HE2 H -13.435 2.952 7.710 1.00 . A A . 2 MET HE2 1 1 39 24382 1 1 2 MET HE3 H -13.287 4.342 8.786 1.00 . A A . 2 MET HE3 1 1 39 24383 1 1 2 MET HG2 H -12.609 -0.003 10.159 1.00 . A A . 2 MET HG2 1 1 39 24384 1 1 2 MET HG3 H -11.265 0.997 9.610 1.00 . A A . 2 MET HG3 1 1 39 24385 1 1 2 MET N N -11.308 -1.632 7.564 1.00 . A A . 2 MET N 1 1 39 24386 1 1 2 MET O O -14.805 -1.701 6.997 1.00 . A A . 2 MET O 1 1 39 24387 1 1 2 MET SD S -13.230 2.287 9.986 1.00 . A A . 2 MET SD 1 1 39 24388 1 1 3 ASP C C -13.103 -2.389 3.223 1.00 . A A . 3 ASP C 1 1 39 24389 1 1 3 ASP CA C -13.949 -1.837 4.365 1.00 . A A . 3 ASP CA 1 1 39 24390 1 1 3 ASP CB C -14.711 -0.596 3.897 1.00 . A A . 3 ASP CB 1 1 39 24391 1 1 3 ASP CG C -15.831 -0.934 2.933 1.00 . A A . 3 ASP CG 1 1 39 24392 1 1 3 ASP H H -12.167 -1.324 5.385 1.00 . A A . 3 ASP H 1 1 39 24393 1 1 3 ASP HA H -14.660 -2.591 4.668 1.00 . A A . 3 ASP HA 1 1 39 24394 1 1 3 ASP HB2 H -15.138 -0.098 4.754 1.00 . A A . 3 ASP HB2 1 1 39 24395 1 1 3 ASP HB3 H -14.024 0.075 3.401 1.00 . A A . 3 ASP HB3 1 1 39 24396 1 1 3 ASP N N -13.119 -1.515 5.519 1.00 . A A . 3 ASP N 1 1 39 24397 1 1 3 ASP O O -13.409 -2.171 2.051 1.00 . A A . 3 ASP O 1 1 39 24398 1 1 3 ASP OD1 O -15.667 -0.683 1.720 1.00 . A A . 3 ASP OD1 1 1 39 24399 1 1 3 ASP OD2 O -16.872 -1.450 3.390 1.00 . A A . 3 ASP OD2 1 1 39 24400 1 1 4 CYS C C -10.456 -2.613 1.756 1.00 . A A . 4 CYS C 1 1 39 24401 1 1 4 CYS CA C -11.143 -3.693 2.584 1.00 . A A . 4 CYS CA 1 1 39 24402 1 1 4 CYS CB C -11.910 -4.652 1.670 1.00 . A A . 4 CYS CB 1 1 39 24403 1 1 4 CYS H H -11.851 -3.242 4.527 1.00 . A A . 4 CYS H 1 1 39 24404 1 1 4 CYS HA H -10.388 -4.250 3.115 1.00 . A A . 4 CYS HA 1 1 39 24405 1 1 4 CYS HB2 H -12.870 -4.219 1.429 1.00 . A A . 4 CYS HB2 1 1 39 24406 1 1 4 CYS HB3 H -11.348 -4.797 0.759 1.00 . A A . 4 CYS HB3 1 1 39 24407 1 1 4 CYS N N -12.039 -3.105 3.575 1.00 . A A . 4 CYS N 1 1 39 24408 1 1 4 CYS O O -9.290 -2.291 1.984 1.00 . A A . 4 CYS O 1 1 39 24409 1 1 4 CYS SG S -12.213 -6.293 2.403 1.00 . A A . 4 CYS SG 1 1 39 24410 1 1 5 THR C C -9.683 -1.589 -1.099 1.00 . A A . 5 THR C 1 1 39 24411 1 1 5 THR CA C -10.652 -1.008 -0.073 1.00 . A A . 5 THR CA 1 1 39 24412 1 1 5 THR CB C -9.952 0.074 0.755 1.00 . A A . 5 THR CB 1 1 39 24413 1 1 5 THR CG2 C -9.745 1.367 -0.003 1.00 . A A . 5 THR CG2 1 1 39 24414 1 1 5 THR H H -12.108 -2.359 0.667 1.00 . A A . 5 THR H 1 1 39 24415 1 1 5 THR HA H -11.482 -0.561 -0.597 1.00 . A A . 5 THR HA 1 1 39 24416 1 1 5 THR HB H -8.982 -0.291 1.059 1.00 . A A . 5 THR HB 1 1 39 24417 1 1 5 THR HG1 H -11.548 0.746 1.671 1.00 . A A . 5 THR HG1 1 1 39 24418 1 1 5 THR HG21 H -9.283 1.155 -0.956 1.00 . A A . 5 THR HG21 1 1 39 24419 1 1 5 THR HG22 H -10.699 1.847 -0.163 1.00 . A A . 5 THR HG22 1 1 39 24420 1 1 5 THR HG23 H -9.104 2.021 0.570 1.00 . A A . 5 THR HG23 1 1 39 24421 1 1 5 THR N N -11.186 -2.056 0.795 1.00 . A A . 5 THR N 1 1 39 24422 1 1 5 THR O O -8.473 -1.391 -1.007 1.00 . A A . 5 THR O 1 1 39 24423 1 1 5 THR OG1 O -10.699 0.374 1.921 1.00 . A A . 5 THR OG1 1 1 39 24424 1 1 6 THR C C -8.548 -1.866 -3.828 1.00 . A A . 6 THR C 1 1 39 24425 1 1 6 THR CA C -9.403 -2.915 -3.122 1.00 . A A . 6 THR CA 1 1 39 24426 1 1 6 THR CB C -10.287 -3.640 -4.139 1.00 . A A . 6 THR CB 1 1 39 24427 1 1 6 THR CG2 C -9.699 -4.950 -4.616 1.00 . A A . 6 THR CG2 1 1 39 24428 1 1 6 THR H H -11.195 -2.431 -2.102 1.00 . A A . 6 THR H 1 1 39 24429 1 1 6 THR HA H -8.750 -3.635 -2.651 1.00 . A A . 6 THR HA 1 1 39 24430 1 1 6 THR HB H -10.421 -3.004 -5.002 1.00 . A A . 6 THR HB 1 1 39 24431 1 1 6 THR HG1 H -12.146 -3.170 -3.742 1.00 . A A . 6 THR HG1 1 1 39 24432 1 1 6 THR HG21 H -9.425 -5.554 -3.764 1.00 . A A . 6 THR HG21 1 1 39 24433 1 1 6 THR HG22 H -10.430 -5.478 -5.211 1.00 . A A . 6 THR HG22 1 1 39 24434 1 1 6 THR HG23 H -8.821 -4.754 -5.215 1.00 . A A . 6 THR HG23 1 1 39 24435 1 1 6 THR N N -10.223 -2.307 -2.079 1.00 . A A . 6 THR N 1 1 39 24436 1 1 6 THR O O -9.059 -0.854 -4.307 1.00 . A A . 6 THR O 1 1 39 24437 1 1 6 THR OG1 O -11.562 -3.917 -3.589 1.00 . A A . 6 THR OG1 1 1 39 24438 1 1 7 GLY C C -4.931 -1.739 -4.671 1.00 . A A . 7 GLY C 1 1 39 24439 1 1 7 GLY CA C -6.337 -1.183 -4.536 1.00 . A A . 7 GLY CA 1 1 39 24440 1 1 7 GLY H H -6.892 -2.938 -3.488 1.00 . A A . 7 GLY H 1 1 39 24441 1 1 7 GLY HA2 H -6.298 -0.274 -3.955 1.00 . A A . 7 GLY HA2 1 1 39 24442 1 1 7 GLY HA3 H -6.718 -0.954 -5.520 1.00 . A A . 7 GLY HA3 1 1 39 24443 1 1 7 GLY N N -7.243 -2.115 -3.888 1.00 . A A . 7 GLY N 1 1 39 24444 1 1 7 GLY O O -4.748 -2.954 -4.743 1.00 . A A . 7 GLY O 1 1 39 24445 1 1 8 PRO C C -1.989 -1.956 -3.565 1.00 . A A . 8 PRO C 1 1 39 24446 1 1 8 PRO CA C -2.511 -1.294 -4.838 1.00 . A A . 8 PRO CA 1 1 39 24447 1 1 8 PRO CB C -1.766 0.014 -5.113 1.00 . A A . 8 PRO CB 1 1 39 24448 1 1 8 PRO CD C -4.033 0.601 -4.630 1.00 . A A . 8 PRO CD 1 1 39 24449 1 1 8 PRO CG C -2.609 1.065 -4.481 1.00 . A A . 8 PRO CG 1 1 39 24450 1 1 8 PRO HA H -2.380 -1.969 -5.672 1.00 . A A . 8 PRO HA 1 1 39 24451 1 1 8 PRO HB2 H -0.783 -0.028 -4.668 1.00 . A A . 8 PRO HB2 1 1 39 24452 1 1 8 PRO HB3 H -1.679 0.167 -6.179 1.00 . A A . 8 PRO HB3 1 1 39 24453 1 1 8 PRO HD2 H -4.617 0.892 -3.769 1.00 . A A . 8 PRO HD2 1 1 39 24454 1 1 8 PRO HD3 H -4.467 1.000 -5.535 1.00 . A A . 8 PRO HD3 1 1 39 24455 1 1 8 PRO HG2 H -2.354 1.161 -3.436 1.00 . A A . 8 PRO HG2 1 1 39 24456 1 1 8 PRO HG3 H -2.467 2.007 -4.990 1.00 . A A . 8 PRO HG3 1 1 39 24457 1 1 8 PRO N N -3.908 -0.867 -4.709 1.00 . A A . 8 PRO N 1 1 39 24458 1 1 8 PRO O O -1.355 -3.010 -3.618 1.00 . A A . 8 PRO O 1 1 39 24459 1 1 9 CYS C C -2.638 -3.112 -0.770 1.00 . A A . 9 CYS C 1 1 39 24460 1 1 9 CYS CA C -1.828 -1.873 -1.135 1.00 . A A . 9 CYS CA 1 1 39 24461 1 1 9 CYS CB C -1.972 -0.816 -0.036 1.00 . A A . 9 CYS CB 1 1 39 24462 1 1 9 CYS H H -2.779 -0.502 -2.440 1.00 . A A . 9 CYS H 1 1 39 24463 1 1 9 CYS HA H -0.790 -2.150 -1.225 1.00 . A A . 9 CYS HA 1 1 39 24464 1 1 9 CYS HB2 H -2.577 -0.003 -0.408 1.00 . A A . 9 CYS HB2 1 1 39 24465 1 1 9 CYS HB3 H -2.461 -1.259 0.819 1.00 . A A . 9 CYS HB3 1 1 39 24466 1 1 9 CYS N N -2.265 -1.336 -2.420 1.00 . A A . 9 CYS N 1 1 39 24467 1 1 9 CYS O O -2.119 -4.058 -0.178 1.00 . A A . 9 CYS O 1 1 39 24468 1 1 9 CYS SG S -0.393 -0.111 0.536 1.00 . A A . 9 CYS SG 1 1 39 24469 1 1 10 CYS C C -4.439 -5.429 -1.689 1.00 . A A . 10 CYS C 1 1 39 24470 1 1 10 CYS CA C -4.809 -4.210 -0.849 1.00 . A A . 10 CYS CA 1 1 39 24471 1 1 10 CYS CB C -6.257 -3.802 -1.130 1.00 . A A . 10 CYS CB 1 1 39 24472 1 1 10 CYS H H -4.267 -2.310 -1.601 1.00 . A A . 10 CYS H 1 1 39 24473 1 1 10 CYS HA H -4.710 -4.461 0.196 1.00 . A A . 10 CYS HA 1 1 39 24474 1 1 10 CYS HB2 H -6.260 -2.834 -1.605 1.00 . A A . 10 CYS HB2 1 1 39 24475 1 1 10 CYS HB3 H -6.703 -4.524 -1.797 1.00 . A A . 10 CYS HB3 1 1 39 24476 1 1 10 CYS N N -3.916 -3.095 -1.131 1.00 . A A . 10 CYS N 1 1 39 24477 1 1 10 CYS O O -3.644 -5.334 -2.624 1.00 . A A . 10 CYS O 1 1 39 24478 1 1 10 CYS SG S -7.312 -3.691 0.352 1.00 . A A . 10 CYS SG 1 1 39 24479 1 1 11 ARG C C -5.781 -8.882 -1.682 1.00 . A A . 11 ARG C 1 1 39 24480 1 1 11 ARG CA C -4.766 -7.813 -2.072 1.00 . A A . 11 ARG CA 1 1 39 24481 1 1 11 ARG CB C -3.345 -8.307 -1.785 1.00 . A A . 11 ARG CB 1 1 39 24482 1 1 11 ARG CD C -2.171 -9.221 -3.811 1.00 . A A . 11 ARG CD 1 1 39 24483 1 1 11 ARG CG C -2.362 -8.014 -2.907 1.00 . A A . 11 ARG CG 1 1 39 24484 1 1 11 ARG CZ C -1.089 -9.773 -5.955 1.00 . A A . 11 ARG CZ 1 1 39 24485 1 1 11 ARG H H -5.652 -6.581 -0.596 1.00 . A A . 11 ARG H 1 1 39 24486 1 1 11 ARG HA H -4.862 -7.609 -3.128 1.00 . A A . 11 ARG HA 1 1 39 24487 1 1 11 ARG HB2 H -2.985 -7.830 -0.886 1.00 . A A . 11 ARG HB2 1 1 39 24488 1 1 11 ARG HB3 H -3.371 -9.376 -1.630 1.00 . A A . 11 ARG HB3 1 1 39 24489 1 1 11 ARG HD2 H -1.660 -9.993 -3.256 1.00 . A A . 11 ARG HD2 1 1 39 24490 1 1 11 ARG HD3 H -3.141 -9.581 -4.118 1.00 . A A . 11 ARG HD3 1 1 39 24491 1 1 11 ARG HE H -1.066 -7.974 -5.092 1.00 . A A . 11 ARG HE 1 1 39 24492 1 1 11 ARG HG2 H -2.738 -7.191 -3.496 1.00 . A A . 11 ARG HG2 1 1 39 24493 1 1 11 ARG HG3 H -1.409 -7.744 -2.475 1.00 . A A . 11 ARG HG3 1 1 39 24494 1 1 11 ARG HH11 H -2.048 -11.322 -5.076 1.00 . A A . 11 ARG HH11 1 1 39 24495 1 1 11 ARG HH12 H -1.280 -11.685 -6.585 1.00 . A A . 11 ARG HH12 1 1 39 24496 1 1 11 ARG HH21 H -0.055 -8.449 -7.077 1.00 . A A . 11 ARG HH21 1 1 39 24497 1 1 11 ARG HH22 H -0.148 -10.054 -7.721 1.00 . A A . 11 ARG HH22 1 1 39 24498 1 1 11 ARG N N -5.026 -6.572 -1.350 1.00 . A A . 11 ARG N 1 1 39 24499 1 1 11 ARG NE N -1.387 -8.895 -5.000 1.00 . A A . 11 ARG NE 1 1 39 24500 1 1 11 ARG NH1 N -1.507 -11.030 -5.864 1.00 . A A . 11 ARG NH1 1 1 39 24501 1 1 11 ARG NH2 N -0.372 -9.394 -7.004 1.00 . A A . 11 ARG NH2 1 1 39 24502 1 1 11 ARG O O -6.611 -9.293 -2.493 1.00 . A A . 11 ARG O 1 1 39 24503 1 1 12 GLN C C -7.772 -9.690 0.855 1.00 . A A . 12 GLN C 1 1 39 24504 1 1 12 GLN CA C -6.626 -10.334 0.083 1.00 . A A . 12 GLN CA 1 1 39 24505 1 1 12 GLN CB C -5.876 -11.292 0.998 1.00 . A A . 12 GLN CB 1 1 39 24506 1 1 12 GLN CD C -4.931 -13.629 1.158 1.00 . A A . 12 GLN CD 1 1 39 24507 1 1 12 GLN CG C -5.192 -12.433 0.263 1.00 . A A . 12 GLN CG 1 1 39 24508 1 1 12 GLN H H -5.031 -8.947 0.167 1.00 . A A . 12 GLN H 1 1 39 24509 1 1 12 GLN HA H -7.027 -10.883 -0.755 1.00 . A A . 12 GLN HA 1 1 39 24510 1 1 12 GLN HB2 H -5.125 -10.733 1.534 1.00 . A A . 12 GLN HB2 1 1 39 24511 1 1 12 GLN HB3 H -6.574 -11.711 1.706 1.00 . A A . 12 GLN HB3 1 1 39 24512 1 1 12 GLN HE21 H -3.020 -13.653 0.609 1.00 . A A . 12 GLN HE21 1 1 39 24513 1 1 12 GLN HE22 H -3.492 -14.872 1.740 1.00 . A A . 12 GLN HE22 1 1 39 24514 1 1 12 GLN HG2 H -5.823 -12.747 -0.555 1.00 . A A . 12 GLN HG2 1 1 39 24515 1 1 12 GLN HG3 H -4.249 -12.080 -0.126 1.00 . A A . 12 GLN HG3 1 1 39 24516 1 1 12 GLN N N -5.712 -9.320 -0.430 1.00 . A A . 12 GLN N 1 1 39 24517 1 1 12 GLN NE2 N -3.689 -14.099 1.170 1.00 . A A . 12 GLN NE2 1 1 39 24518 1 1 12 GLN O O -8.433 -10.340 1.665 1.00 . A A . 12 GLN O 1 1 39 24519 1 1 12 GLN OE1 O -5.835 -14.126 1.830 1.00 . A A . 12 GLN OE1 1 1 39 24520 1 1 13 CYS C C -8.552 -7.143 2.631 1.00 . A A . 13 CYS C 1 1 39 24521 1 1 13 CYS CA C -9.034 -7.631 1.270 1.00 . A A . 13 CYS CA 1 1 39 24522 1 1 13 CYS CB C -10.319 -8.454 1.423 1.00 . A A . 13 CYS CB 1 1 39 24523 1 1 13 CYS H H -7.407 -7.953 -0.042 1.00 . A A . 13 CYS H 1 1 39 24524 1 1 13 CYS HA H -9.244 -6.769 0.653 1.00 . A A . 13 CYS HA 1 1 39 24525 1 1 13 CYS HB2 H -10.234 -9.354 0.833 1.00 . A A . 13 CYS HB2 1 1 39 24526 1 1 13 CYS HB3 H -10.447 -8.722 2.462 1.00 . A A . 13 CYS HB3 1 1 39 24527 1 1 13 CYS N N -7.985 -8.402 0.604 1.00 . A A . 13 CYS N 1 1 39 24528 1 1 13 CYS O O -9.336 -7.001 3.569 1.00 . A A . 13 CYS O 1 1 39 24529 1 1 13 CYS SG S -11.827 -7.583 0.884 1.00 . A A . 13 CYS SG 1 1 39 24530 1 1 14 LYS C C -5.379 -5.613 3.653 1.00 . A A . 14 LYS C 1 1 39 24531 1 1 14 LYS CA C -6.644 -6.408 3.959 1.00 . A A . 14 LYS CA 1 1 39 24532 1 1 14 LYS CB C -6.314 -7.583 4.881 1.00 . A A . 14 LYS CB 1 1 39 24533 1 1 14 LYS CD C -4.912 -6.822 6.822 1.00 . A A . 14 LYS CD 1 1 39 24534 1 1 14 LYS CE C -4.089 -8.040 7.208 1.00 . A A . 14 LYS CE 1 1 39 24535 1 1 14 LYS CG C -6.304 -7.215 6.356 1.00 . A A . 14 LYS CG 1 1 39 24536 1 1 14 LYS H H -6.682 -7.017 1.937 1.00 . A A . 14 LYS H 1 1 39 24537 1 1 14 LYS HA H -7.354 -5.760 4.451 1.00 . A A . 14 LYS HA 1 1 39 24538 1 1 14 LYS HB2 H -7.049 -8.360 4.731 1.00 . A A . 14 LYS HB2 1 1 39 24539 1 1 14 LYS HB3 H -5.339 -7.967 4.622 1.00 . A A . 14 LYS HB3 1 1 39 24540 1 1 14 LYS HD2 H -4.409 -6.299 6.023 1.00 . A A . 14 LYS HD2 1 1 39 24541 1 1 14 LYS HD3 H -5.001 -6.172 7.680 1.00 . A A . 14 LYS HD3 1 1 39 24542 1 1 14 LYS HE2 H -4.053 -8.716 6.367 1.00 . A A . 14 LYS HE2 1 1 39 24543 1 1 14 LYS HE3 H -3.087 -7.719 7.454 1.00 . A A . 14 LYS HE3 1 1 39 24544 1 1 14 LYS HG2 H -6.974 -6.383 6.514 1.00 . A A . 14 LYS HG2 1 1 39 24545 1 1 14 LYS HG3 H -6.641 -8.065 6.931 1.00 . A A . 14 LYS HG3 1 1 39 24546 1 1 14 LYS HZ1 H -5.254 -8.104 8.941 1.00 . A A . 14 LYS HZ1 1 1 39 24547 1 1 14 LYS HZ2 H -5.262 -9.546 8.055 1.00 . A A . 14 LYS HZ2 1 1 39 24548 1 1 14 LYS HZ3 H -3.910 -9.130 8.982 1.00 . A A . 14 LYS HZ3 1 1 39 24549 1 1 14 LYS N N -7.251 -6.885 2.724 1.00 . A A . 14 LYS N 1 1 39 24550 1 1 14 LYS NZ N -4.669 -8.755 8.378 1.00 . A A . 14 LYS NZ 1 1 39 24551 1 1 14 LYS O O -4.390 -6.167 3.174 1.00 . A A . 14 LYS O 1 1 39 24552 1 1 15 LEU C C -2.958 -4.083 4.015 1.00 . A A . 15 LEU C 1 1 39 24553 1 1 15 LEU CA C -4.289 -3.422 3.665 1.00 . A A . 15 LEU CA 1 1 39 24554 1 1 15 LEU CB C -4.433 -2.094 4.429 1.00 . A A . 15 LEU CB 1 1 39 24555 1 1 15 LEU CD1 C -6.623 -2.139 5.678 1.00 . A A . 15 LEU CD1 1 1 39 24556 1 1 15 LEU CD2 C -4.646 -3.371 6.603 1.00 . A A . 15 LEU CD2 1 1 39 24557 1 1 15 LEU CG C -5.107 -2.154 5.811 1.00 . A A . 15 LEU CG 1 1 39 24558 1 1 15 LEU H H -6.249 -3.933 4.289 1.00 . A A . 15 LEU H 1 1 39 24559 1 1 15 LEU HA H -4.284 -3.207 2.608 1.00 . A A . 15 LEU HA 1 1 39 24560 1 1 15 LEU HB2 H -3.446 -1.678 4.560 1.00 . A A . 15 LEU HB2 1 1 39 24561 1 1 15 LEU HB3 H -5.004 -1.416 3.810 1.00 . A A . 15 LEU HB3 1 1 39 24562 1 1 15 LEU HD11 H -6.894 -1.895 4.661 1.00 . A A . 15 LEU HD11 1 1 39 24563 1 1 15 LEU HD12 H -7.017 -3.112 5.932 1.00 . A A . 15 LEU HD12 1 1 39 24564 1 1 15 LEU HD13 H -7.035 -1.399 6.347 1.00 . A A . 15 LEU HD13 1 1 39 24565 1 1 15 LEU HD21 H -4.797 -4.265 6.019 1.00 . A A . 15 LEU HD21 1 1 39 24566 1 1 15 LEU HD22 H -3.597 -3.269 6.839 1.00 . A A . 15 LEU HD22 1 1 39 24567 1 1 15 LEU HD23 H -5.215 -3.440 7.518 1.00 . A A . 15 LEU HD23 1 1 39 24568 1 1 15 LEU HG H -4.824 -1.273 6.369 1.00 . A A . 15 LEU HG 1 1 39 24569 1 1 15 LEU N N -5.426 -4.309 3.921 1.00 . A A . 15 LEU N 1 1 39 24570 1 1 15 LEU O O -2.708 -4.441 5.165 1.00 . A A . 15 LEU O 1 1 39 24571 1 1 16 LYS C C -0.090 -4.281 4.423 1.00 . A A . 16 LYS C 1 1 39 24572 1 1 16 LYS CA C -0.794 -4.856 3.194 1.00 . A A . 16 LYS CA 1 1 39 24573 1 1 16 LYS CB C 0.074 -4.647 1.951 1.00 . A A . 16 LYS CB 1 1 39 24574 1 1 16 LYS CD C 0.754 -5.460 -0.327 1.00 . A A . 16 LYS CD 1 1 39 24575 1 1 16 LYS CE C 0.018 -5.896 -1.583 1.00 . A A . 16 LYS CE 1 1 39 24576 1 1 16 LYS CG C -0.053 -5.761 0.926 1.00 . A A . 16 LYS CG 1 1 39 24577 1 1 16 LYS H H -2.367 -3.935 2.108 1.00 . A A . 16 LYS H 1 1 39 24578 1 1 16 LYS HA H -0.944 -5.915 3.342 1.00 . A A . 16 LYS HA 1 1 39 24579 1 1 16 LYS HB2 H -0.212 -3.718 1.479 1.00 . A A . 16 LYS HB2 1 1 39 24580 1 1 16 LYS HB3 H 1.108 -4.582 2.255 1.00 . A A . 16 LYS HB3 1 1 39 24581 1 1 16 LYS HD2 H 0.936 -4.397 -0.379 1.00 . A A . 16 LYS HD2 1 1 39 24582 1 1 16 LYS HD3 H 1.697 -5.985 -0.271 1.00 . A A . 16 LYS HD3 1 1 39 24583 1 1 16 LYS HE2 H 0.285 -6.919 -1.805 1.00 . A A . 16 LYS HE2 1 1 39 24584 1 1 16 LYS HE3 H -1.045 -5.835 -1.401 1.00 . A A . 16 LYS HE3 1 1 39 24585 1 1 16 LYS HG2 H 0.308 -6.681 1.361 1.00 . A A . 16 LYS HG2 1 1 39 24586 1 1 16 LYS HG3 H -1.093 -5.872 0.655 1.00 . A A . 16 LYS HG3 1 1 39 24587 1 1 16 LYS HZ1 H 0.428 -4.046 -2.461 1.00 . A A . 16 LYS HZ1 1 1 39 24588 1 1 16 LYS HZ2 H 1.272 -5.337 -3.156 1.00 . A A . 16 LYS HZ2 1 1 39 24589 1 1 16 LYS HZ3 H -0.373 -5.127 -3.485 1.00 . A A . 16 LYS HZ3 1 1 39 24590 1 1 16 LYS N N -2.106 -4.241 3.005 1.00 . A A . 16 LYS N 1 1 39 24591 1 1 16 LYS NZ N 0.360 -5.042 -2.753 1.00 . A A . 16 LYS NZ 1 1 39 24592 1 1 16 LYS O O -0.319 -3.130 4.796 1.00 . A A . 16 LYS O 1 1 39 24593 1 1 17 PRO C C 2.374 -3.414 5.997 1.00 . A A . 17 PRO C 1 1 39 24594 1 1 17 PRO CA C 1.511 -4.641 6.265 1.00 . A A . 17 PRO CA 1 1 39 24595 1 1 17 PRO CB C 2.391 -5.848 6.617 1.00 . A A . 17 PRO CB 1 1 39 24596 1 1 17 PRO CD C 1.108 -6.461 4.698 1.00 . A A . 17 PRO CD 1 1 39 24597 1 1 17 PRO CG C 2.424 -6.684 5.383 1.00 . A A . 17 PRO CG 1 1 39 24598 1 1 17 PRO HA H 0.839 -4.432 7.084 1.00 . A A . 17 PRO HA 1 1 39 24599 1 1 17 PRO HB2 H 3.379 -5.507 6.889 1.00 . A A . 17 PRO HB2 1 1 39 24600 1 1 17 PRO HB3 H 1.952 -6.386 7.445 1.00 . A A . 17 PRO HB3 1 1 39 24601 1 1 17 PRO HD2 H 1.217 -6.558 3.628 1.00 . A A . 17 PRO HD2 1 1 39 24602 1 1 17 PRO HD3 H 0.365 -7.150 5.070 1.00 . A A . 17 PRO HD3 1 1 39 24603 1 1 17 PRO HG2 H 3.237 -6.368 4.747 1.00 . A A . 17 PRO HG2 1 1 39 24604 1 1 17 PRO HG3 H 2.537 -7.725 5.648 1.00 . A A . 17 PRO HG3 1 1 39 24605 1 1 17 PRO N N 0.776 -5.077 5.072 1.00 . A A . 17 PRO N 1 1 39 24606 1 1 17 PRO O O 2.955 -3.274 4.921 1.00 . A A . 17 PRO O 1 1 39 24607 1 1 18 ALA C C 4.708 -1.639 6.549 1.00 . A A . 18 ALA C 1 1 39 24608 1 1 18 ALA CA C 3.250 -1.311 6.854 1.00 . A A . 18 ALA CA 1 1 39 24609 1 1 18 ALA CB C 3.149 -0.477 8.123 1.00 . A A . 18 ALA CB 1 1 39 24610 1 1 18 ALA H H 1.970 -2.693 7.817 1.00 . A A . 18 ALA H 1 1 39 24611 1 1 18 ALA HA H 2.843 -0.732 6.038 1.00 . A A . 18 ALA HA 1 1 39 24612 1 1 18 ALA HB1 H 3.576 -1.026 8.949 1.00 . A A . 18 ALA HB1 1 1 39 24613 1 1 18 ALA HB2 H 3.687 0.449 7.989 1.00 . A A . 18 ALA HB2 1 1 39 24614 1 1 18 ALA HB3 H 2.111 -0.264 8.332 1.00 . A A . 18 ALA HB3 1 1 39 24615 1 1 18 ALA N N 2.455 -2.526 6.983 1.00 . A A . 18 ALA N 1 1 39 24616 1 1 18 ALA O O 5.142 -2.781 6.701 1.00 . A A . 18 ALA O 1 1 39 24617 1 1 19 GLY C C 7.062 -1.883 4.718 1.00 . A A . 19 GLY C 1 1 39 24618 1 1 19 GLY CA C 6.859 -0.836 5.796 1.00 . A A . 19 GLY CA 1 1 39 24619 1 1 19 GLY H H 5.059 0.257 6.014 1.00 . A A . 19 GLY H 1 1 39 24620 1 1 19 GLY HA2 H 7.380 -1.149 6.689 1.00 . A A . 19 GLY HA2 1 1 39 24621 1 1 19 GLY HA3 H 7.280 0.100 5.458 1.00 . A A . 19 GLY HA3 1 1 39 24622 1 1 19 GLY N N 5.459 -0.631 6.117 1.00 . A A . 19 GLY N 1 1 39 24623 1 1 19 GLY O O 8.135 -2.478 4.615 1.00 . A A . 19 GLY O 1 1 39 24624 1 1 20 THR C C 5.762 -2.446 1.494 1.00 . A A . 20 THR C 1 1 39 24625 1 1 20 THR CA C 6.098 -3.090 2.835 1.00 . A A . 20 THR CA 1 1 39 24626 1 1 20 THR CB C 5.137 -4.247 3.112 1.00 . A A . 20 THR CB 1 1 39 24627 1 1 20 THR CG2 C 5.172 -5.326 2.052 1.00 . A A . 20 THR CG2 1 1 39 24628 1 1 20 THR H H 5.201 -1.602 4.042 1.00 . A A . 20 THR H 1 1 39 24629 1 1 20 THR HA H 7.107 -3.471 2.796 1.00 . A A . 20 THR HA 1 1 39 24630 1 1 20 THR HB H 4.129 -3.860 3.156 1.00 . A A . 20 THR HB 1 1 39 24631 1 1 20 THR HG1 H 4.953 -4.408 5.055 1.00 . A A . 20 THR HG1 1 1 39 24632 1 1 20 THR HG21 H 5.496 -4.900 1.114 1.00 . A A . 20 THR HG21 1 1 39 24633 1 1 20 THR HG22 H 5.859 -6.104 2.351 1.00 . A A . 20 THR HG22 1 1 39 24634 1 1 20 THR HG23 H 4.183 -5.746 1.933 1.00 . A A . 20 THR HG23 1 1 39 24635 1 1 20 THR N N 6.030 -2.108 3.911 1.00 . A A . 20 THR N 1 1 39 24636 1 1 20 THR O O 4.692 -1.859 1.329 1.00 . A A . 20 THR O 1 1 39 24637 1 1 20 THR OG1 O 5.433 -4.857 4.356 1.00 . A A . 20 THR OG1 1 1 39 24638 1 1 21 THR C C 5.174 -2.499 -1.401 1.00 . A A . 21 THR C 1 1 39 24639 1 1 21 THR CA C 6.473 -1.987 -0.788 1.00 . A A . 21 THR CA 1 1 39 24640 1 1 21 THR CB C 7.654 -2.315 -1.705 1.00 . A A . 21 THR CB 1 1 39 24641 1 1 21 THR CG2 C 8.281 -1.085 -2.323 1.00 . A A . 21 THR CG2 1 1 39 24642 1 1 21 THR H H 7.512 -3.039 0.728 1.00 . A A . 21 THR H 1 1 39 24643 1 1 21 THR HA H 6.403 -0.915 -0.677 1.00 . A A . 21 THR HA 1 1 39 24644 1 1 21 THR HB H 7.310 -2.950 -2.509 1.00 . A A . 21 THR HB 1 1 39 24645 1 1 21 THR HG1 H 8.658 -3.932 -1.242 1.00 . A A . 21 THR HG1 1 1 39 24646 1 1 21 THR HG21 H 8.539 -0.383 -1.544 1.00 . A A . 21 THR HG21 1 1 39 24647 1 1 21 THR HG22 H 9.173 -1.368 -2.863 1.00 . A A . 21 THR HG22 1 1 39 24648 1 1 21 THR HG23 H 7.579 -0.627 -3.003 1.00 . A A . 21 THR HG23 1 1 39 24649 1 1 21 THR N N 6.679 -2.559 0.538 1.00 . A A . 21 THR N 1 1 39 24650 1 1 21 THR O O 5.037 -3.688 -1.690 1.00 . A A . 21 THR O 1 1 39 24651 1 1 21 THR OG1 O 8.668 -3.004 -0.995 1.00 . A A . 21 THR OG1 1 1 39 24652 1 1 22 CYS C C 2.892 -1.710 -3.655 1.00 . A A . 22 CYS C 1 1 39 24653 1 1 22 CYS CA C 2.926 -1.952 -2.151 1.00 . A A . 22 CYS CA 1 1 39 24654 1 1 22 CYS CB C 1.817 -1.144 -1.478 1.00 . A A . 22 CYS CB 1 1 39 24655 1 1 22 CYS H H 4.388 -0.664 -1.327 1.00 . A A . 22 CYS H 1 1 39 24656 1 1 22 CYS HA H 2.759 -3.001 -1.962 1.00 . A A . 22 CYS HA 1 1 39 24657 1 1 22 CYS HB2 H 0.865 -1.450 -1.883 1.00 . A A . 22 CYS HB2 1 1 39 24658 1 1 22 CYS HB3 H 1.832 -1.341 -0.416 1.00 . A A . 22 CYS HB3 1 1 39 24659 1 1 22 CYS N N 4.220 -1.594 -1.585 1.00 . A A . 22 CYS N 1 1 39 24660 1 1 22 CYS O O 2.334 -2.508 -4.409 1.00 . A A . 22 CYS O 1 1 39 24661 1 1 22 CYS SG S 1.963 0.658 -1.713 1.00 . A A . 22 CYS SG 1 1 39 24662 1 1 23 TRP C C 4.823 -0.622 -6.149 1.00 . A A . 23 TRP C 1 1 39 24663 1 1 23 TRP CA C 3.497 -0.251 -5.499 1.00 . A A . 23 TRP CA 1 1 39 24664 1 1 23 TRP CB C 3.231 1.246 -5.675 1.00 . A A . 23 TRP CB 1 1 39 24665 1 1 23 TRP CD1 C 1.866 0.682 -7.770 1.00 . A A . 23 TRP CD1 1 1 39 24666 1 1 23 TRP CD2 C 1.868 2.853 -7.229 1.00 . A A . 23 TRP CD2 1 1 39 24667 1 1 23 TRP CE2 C 1.090 2.680 -8.388 1.00 . A A . 23 TRP CE2 1 1 39 24668 1 1 23 TRP CE3 C 2.013 4.138 -6.702 1.00 . A A . 23 TRP CE3 1 1 39 24669 1 1 23 TRP CG C 2.356 1.563 -6.849 1.00 . A A . 23 TRP CG 1 1 39 24670 1 1 23 TRP CH2 C 0.619 4.989 -8.490 1.00 . A A . 23 TRP CH2 1 1 39 24671 1 1 23 TRP CZ2 C 0.460 3.742 -9.028 1.00 . A A . 23 TRP CZ2 1 1 39 24672 1 1 23 TRP CZ3 C 1.388 5.193 -7.338 1.00 . A A . 23 TRP CZ3 1 1 39 24673 1 1 23 TRP H H 3.897 0.003 -3.437 1.00 . A A . 23 TRP H 1 1 39 24674 1 1 23 TRP HA H 2.711 -0.803 -5.982 1.00 . A A . 23 TRP HA 1 1 39 24675 1 1 23 TRP HB2 H 2.747 1.625 -4.788 1.00 . A A . 23 TRP HB2 1 1 39 24676 1 1 23 TRP HB3 H 4.172 1.757 -5.812 1.00 . A A . 23 TRP HB3 1 1 39 24677 1 1 23 TRP HD1 H 2.061 -0.379 -7.758 1.00 . A A . 23 TRP HD1 1 1 39 24678 1 1 23 TRP HE1 H 0.647 0.934 -9.460 1.00 . A A . 23 TRP HE1 1 1 39 24679 1 1 23 TRP HE3 H 2.601 4.314 -5.814 1.00 . A A . 23 TRP HE3 1 1 39 24680 1 1 23 TRP HH2 H 0.151 5.842 -8.956 1.00 . A A . 23 TRP HH2 1 1 39 24681 1 1 23 TRP HZ2 H -0.138 3.600 -9.914 1.00 . A A . 23 TRP HZ2 1 1 39 24682 1 1 23 TRP HZ3 H 1.490 6.194 -6.946 1.00 . A A . 23 TRP HZ3 1 1 39 24683 1 1 23 TRP N N 3.477 -0.600 -4.085 1.00 . A A . 23 TRP N 1 1 39 24684 1 1 23 TRP NE1 N 1.105 1.347 -8.699 1.00 . A A . 23 TRP NE1 1 1 39 24685 1 1 23 TRP O O 4.862 -1.389 -7.111 1.00 . A A . 23 TRP O 1 1 39 24686 1 1 24 LYS C C 7.269 -0.217 -7.669 1.00 . A A . 24 LYS C 1 1 39 24687 1 1 24 LYS CA C 7.243 -0.319 -6.145 1.00 . A A . 24 LYS CA 1 1 39 24688 1 1 24 LYS CB C 7.738 -1.697 -5.698 1.00 . A A . 24 LYS CB 1 1 39 24689 1 1 24 LYS CD C 7.718 -4.176 -6.110 1.00 . A A . 24 LYS CD 1 1 39 24690 1 1 24 LYS CE C 7.112 -4.935 -4.940 1.00 . A A . 24 LYS CE 1 1 39 24691 1 1 24 LYS CG C 7.001 -2.857 -6.349 1.00 . A A . 24 LYS CG 1 1 39 24692 1 1 24 LYS H H 5.797 0.541 -4.861 1.00 . A A . 24 LYS H 1 1 39 24693 1 1 24 LYS HA H 7.901 0.434 -5.739 1.00 . A A . 24 LYS HA 1 1 39 24694 1 1 24 LYS HB2 H 8.786 -1.785 -5.940 1.00 . A A . 24 LYS HB2 1 1 39 24695 1 1 24 LYS HB3 H 7.617 -1.778 -4.628 1.00 . A A . 24 LYS HB3 1 1 39 24696 1 1 24 LYS HD2 H 7.639 -4.784 -6.999 1.00 . A A . 24 LYS HD2 1 1 39 24697 1 1 24 LYS HD3 H 8.758 -3.977 -5.899 1.00 . A A . 24 LYS HD3 1 1 39 24698 1 1 24 LYS HE2 H 7.677 -5.843 -4.786 1.00 . A A . 24 LYS HE2 1 1 39 24699 1 1 24 LYS HE3 H 7.175 -4.318 -4.056 1.00 . A A . 24 LYS HE3 1 1 39 24700 1 1 24 LYS HG2 H 6.007 -2.919 -5.933 1.00 . A A . 24 LYS HG2 1 1 39 24701 1 1 24 LYS HG3 H 6.938 -2.679 -7.413 1.00 . A A . 24 LYS HG3 1 1 39 24702 1 1 24 LYS HZ1 H 5.556 -5.583 -6.174 1.00 . A A . 24 LYS HZ1 1 1 39 24703 1 1 24 LYS HZ2 H 5.400 -6.069 -4.561 1.00 . A A . 24 LYS HZ2 1 1 39 24704 1 1 24 LYS HZ3 H 5.077 -4.467 -4.996 1.00 . A A . 24 LYS HZ3 1 1 39 24705 1 1 24 LYS N N 5.903 -0.063 -5.621 1.00 . A A . 24 LYS N 1 1 39 24706 1 1 24 LYS NZ N 5.687 -5.288 -5.185 1.00 . A A . 24 LYS NZ 1 1 39 24707 1 1 24 LYS O O 8.058 -0.889 -8.333 1.00 . A A . 24 LYS O 1 1 39 24708 1 1 25 THR C C 7.624 1.390 -10.204 1.00 . A A . 25 THR C 1 1 39 24709 1 1 25 THR CA C 6.319 0.819 -9.659 1.00 . A A . 25 THR CA 1 1 39 24710 1 1 25 THR CB C 5.154 1.748 -10.009 1.00 . A A . 25 THR CB 1 1 39 24711 1 1 25 THR CG2 C 4.784 1.719 -11.475 1.00 . A A . 25 THR CG2 1 1 39 24712 1 1 25 THR H H 5.795 1.135 -7.633 1.00 . A A . 25 THR H 1 1 39 24713 1 1 25 THR HA H 6.146 -0.146 -10.111 1.00 . A A . 25 THR HA 1 1 39 24714 1 1 25 THR HB H 5.424 2.763 -9.756 1.00 . A A . 25 THR HB 1 1 39 24715 1 1 25 THR HG1 H 3.306 2.044 -9.435 1.00 . A A . 25 THR HG1 1 1 39 24716 1 1 25 THR HG21 H 5.682 1.735 -12.074 1.00 . A A . 25 THR HG21 1 1 39 24717 1 1 25 THR HG22 H 4.224 0.820 -11.688 1.00 . A A . 25 THR HG22 1 1 39 24718 1 1 25 THR HG23 H 4.180 2.583 -11.711 1.00 . A A . 25 THR HG23 1 1 39 24719 1 1 25 THR N N 6.399 0.628 -8.215 1.00 . A A . 25 THR N 1 1 39 24720 1 1 25 THR O O 8.251 2.243 -9.576 1.00 . A A . 25 THR O 1 1 39 24721 1 1 25 THR OG1 O 3.998 1.400 -9.269 1.00 . A A . 25 THR OG1 1 1 39 24722 1 1 26 SER C C 9.268 2.891 -12.151 1.00 . A A . 26 SER C 1 1 39 24723 1 1 26 SER CA C 9.262 1.372 -12.009 1.00 . A A . 26 SER CA 1 1 39 24724 1 1 26 SER CB C 9.431 0.720 -13.382 1.00 . A A . 26 SER CB 1 1 39 24725 1 1 26 SER H H 7.488 0.231 -11.829 1.00 . A A . 26 SER H 1 1 39 24726 1 1 26 SER HA H 10.087 1.079 -11.378 1.00 . A A . 26 SER HA 1 1 39 24727 1 1 26 SER HB2 H 9.074 -0.299 -13.340 1.00 . A A . 26 SER HB2 1 1 39 24728 1 1 26 SER HB3 H 8.859 1.272 -14.113 1.00 . A A . 26 SER HB3 1 1 39 24729 1 1 26 SER HG H 10.864 0.342 -14.663 1.00 . A A . 26 SER HG 1 1 39 24730 1 1 26 SER N N 8.030 0.911 -11.377 1.00 . A A . 26 SER N 1 1 39 24731 1 1 26 SER O O 10.323 3.525 -12.113 1.00 . A A . 26 SER O 1 1 39 24732 1 1 26 SER OG O 10.791 0.710 -13.779 1.00 . A A . 26 SER OG 1 1 39 24733 1 1 27 VAL C C 7.771 5.588 -11.104 1.00 . A A . 27 VAL C 1 1 39 24734 1 1 27 VAL CA C 7.950 4.913 -12.459 1.00 . A A . 27 VAL CA 1 1 39 24735 1 1 27 VAL CB C 6.755 5.281 -13.362 1.00 . A A . 27 VAL CB 1 1 39 24736 1 1 27 VAL CG1 C 5.449 4.795 -12.750 1.00 . A A . 27 VAL CG1 1 1 39 24737 1 1 27 VAL CG2 C 6.710 6.782 -13.606 1.00 . A A . 27 VAL CG2 1 1 39 24738 1 1 27 VAL H H 7.278 2.911 -12.334 1.00 . A A . 27 VAL H 1 1 39 24739 1 1 27 VAL HA H 8.852 5.287 -12.921 1.00 . A A . 27 VAL HA 1 1 39 24740 1 1 27 VAL HB H 6.885 4.787 -14.315 1.00 . A A . 27 VAL HB 1 1 39 24741 1 1 27 VAL HG11 H 5.406 5.089 -11.711 1.00 . A A . 27 VAL HG11 1 1 39 24742 1 1 27 VAL HG12 H 4.617 5.233 -13.282 1.00 . A A . 27 VAL HG12 1 1 39 24743 1 1 27 VAL HG13 H 5.396 3.719 -12.822 1.00 . A A . 27 VAL HG13 1 1 39 24744 1 1 27 VAL HG21 H 7.707 7.143 -13.813 1.00 . A A . 27 VAL HG21 1 1 39 24745 1 1 27 VAL HG22 H 6.069 6.991 -14.449 1.00 . A A . 27 VAL HG22 1 1 39 24746 1 1 27 VAL HG23 H 6.323 7.278 -12.728 1.00 . A A . 27 VAL HG23 1 1 39 24747 1 1 27 VAL N N 8.083 3.469 -12.314 1.00 . A A . 27 VAL N 1 1 39 24748 1 1 27 VAL O O 8.139 6.749 -10.924 1.00 . A A . 27 VAL O 1 1 39 24749 1 1 28 SER C C 6.852 4.273 -7.789 1.00 . A A . 28 SER C 1 1 39 24750 1 1 28 SER CA C 6.958 5.392 -8.822 1.00 . A A . 28 SER CA 1 1 39 24751 1 1 28 SER CB C 5.678 6.228 -8.819 1.00 . A A . 28 SER CB 1 1 39 24752 1 1 28 SER H H 6.915 3.940 -10.360 1.00 . A A . 28 SER H 1 1 39 24753 1 1 28 SER HA H 7.792 6.027 -8.566 1.00 . A A . 28 SER HA 1 1 39 24754 1 1 28 SER HB2 H 5.540 6.675 -9.792 1.00 . A A . 28 SER HB2 1 1 39 24755 1 1 28 SER HB3 H 4.835 5.590 -8.593 1.00 . A A . 28 SER HB3 1 1 39 24756 1 1 28 SER HG H 6.197 8.020 -8.221 1.00 . A A . 28 SER HG 1 1 39 24757 1 1 28 SER N N 7.194 4.857 -10.156 1.00 . A A . 28 SER N 1 1 39 24758 1 1 28 SER O O 5.861 3.545 -7.748 1.00 . A A . 28 SER O 1 1 39 24759 1 1 28 SER OG O 5.744 7.259 -7.849 1.00 . A A . 28 SER OG 1 1 39 24760 1 1 29 SER C C 7.484 3.693 -4.570 1.00 . A A . 29 SER C 1 1 39 24761 1 1 29 SER CA C 7.898 3.116 -5.920 1.00 . A A . 29 SER CA 1 1 39 24762 1 1 29 SER CB C 9.292 2.494 -5.816 1.00 . A A . 29 SER CB 1 1 39 24763 1 1 29 SER H H 8.640 4.757 -7.034 1.00 . A A . 29 SER H 1 1 39 24764 1 1 29 SER HA H 7.191 2.349 -6.202 1.00 . A A . 29 SER HA 1 1 39 24765 1 1 29 SER HB2 H 9.394 2.001 -4.861 1.00 . A A . 29 SER HB2 1 1 39 24766 1 1 29 SER HB3 H 9.421 1.772 -6.609 1.00 . A A . 29 SER HB3 1 1 39 24767 1 1 29 SER HG H 10.163 4.159 -5.264 1.00 . A A . 29 SER HG 1 1 39 24768 1 1 29 SER N N 7.879 4.145 -6.954 1.00 . A A . 29 SER N 1 1 39 24769 1 1 29 SER O O 8.096 4.639 -4.073 1.00 . A A . 29 SER O 1 1 39 24770 1 1 29 SER OG O 10.302 3.482 -5.929 1.00 . A A . 29 SER OG 1 1 39 24771 1 1 30 HIS C C 5.943 2.442 -1.673 1.00 . A A . 30 HIS C 1 1 39 24772 1 1 30 HIS CA C 5.933 3.575 -2.695 1.00 . A A . 30 HIS CA 1 1 39 24773 1 1 30 HIS CB C 4.513 4.122 -2.850 1.00 . A A . 30 HIS CB 1 1 39 24774 1 1 30 HIS CD2 C 4.828 5.105 -5.229 1.00 . A A . 30 HIS CD2 1 1 39 24775 1 1 30 HIS CE1 C 3.747 6.989 -4.944 1.00 . A A . 30 HIS CE1 1 1 39 24776 1 1 30 HIS CG C 4.376 5.124 -3.953 1.00 . A A . 30 HIS CG 1 1 39 24777 1 1 30 HIS H H 5.991 2.372 -4.433 1.00 . A A . 30 HIS H 1 1 39 24778 1 1 30 HIS HA H 6.579 4.366 -2.346 1.00 . A A . 30 HIS HA 1 1 39 24779 1 1 30 HIS HB2 H 3.841 3.303 -3.062 1.00 . A A . 30 HIS HB2 1 1 39 24780 1 1 30 HIS HB3 H 4.215 4.597 -1.927 1.00 . A A . 30 HIS HB3 1 1 39 24781 1 1 30 HIS HD1 H 3.260 6.630 -2.989 1.00 . A A . 30 HIS HD1 1 1 39 24782 1 1 30 HIS HD2 H 5.394 4.312 -5.696 1.00 . A A . 30 HIS HD2 1 1 39 24783 1 1 30 HIS HE1 H 3.304 7.955 -5.128 1.00 . A A . 30 HIS HE1 1 1 39 24784 1 1 30 HIS HE2 H 4.710 6.593 -6.700 1.00 . A A . 30 HIS HE2 1 1 39 24785 1 1 30 HIS N N 6.438 3.119 -3.984 1.00 . A A . 30 HIS N 1 1 39 24786 1 1 30 HIS ND1 N 3.703 6.319 -3.806 1.00 . A A . 30 HIS ND1 1 1 39 24787 1 1 30 HIS NE2 N 4.424 6.275 -5.821 1.00 . A A . 30 HIS NE2 1 1 39 24788 1 1 30 HIS O O 6.498 1.372 -1.922 1.00 . A A . 30 HIS O 1 1 39 24789 1 1 31 TYR C C 3.901 1.737 1.238 1.00 . A A . 31 TYR C 1 1 39 24790 1 1 31 TYR CA C 5.255 1.689 0.539 1.00 . A A . 31 TYR CA 1 1 39 24791 1 1 31 TYR CB C 6.376 1.919 1.555 1.00 . A A . 31 TYR CB 1 1 39 24792 1 1 31 TYR CD1 C 8.622 1.677 0.428 1.00 . A A . 31 TYR CD1 1 1 39 24793 1 1 31 TYR CD2 C 7.846 -0.120 1.789 1.00 . A A . 31 TYR CD2 1 1 39 24794 1 1 31 TYR CE1 C 9.777 0.971 0.148 1.00 . A A . 31 TYR CE1 1 1 39 24795 1 1 31 TYR CE2 C 8.999 -0.831 1.515 1.00 . A A . 31 TYR CE2 1 1 39 24796 1 1 31 TYR CG C 7.638 1.144 1.251 1.00 . A A . 31 TYR CG 1 1 39 24797 1 1 31 TYR CZ C 9.961 -0.281 0.694 1.00 . A A . 31 TYR CZ 1 1 39 24798 1 1 31 TYR H H 4.898 3.559 -0.386 1.00 . A A . 31 TYR H 1 1 39 24799 1 1 31 TYR HA H 5.381 0.716 0.089 1.00 . A A . 31 TYR HA 1 1 39 24800 1 1 31 TYR HB2 H 6.628 2.969 1.571 1.00 . A A . 31 TYR HB2 1 1 39 24801 1 1 31 TYR HB3 H 6.030 1.622 2.534 1.00 . A A . 31 TYR HB3 1 1 39 24802 1 1 31 TYR HD1 H 8.475 2.658 0.002 1.00 . A A . 31 TYR HD1 1 1 39 24803 1 1 31 TYR HD2 H 7.090 -0.548 2.431 1.00 . A A . 31 TYR HD2 1 1 39 24804 1 1 31 TYR HE1 H 10.531 1.403 -0.494 1.00 . A A . 31 TYR HE1 1 1 39 24805 1 1 31 TYR HE2 H 9.142 -1.813 1.942 1.00 . A A . 31 TYR HE2 1 1 39 24806 1 1 31 TYR HH H 11.845 -0.601 0.900 1.00 . A A . 31 TYR HH 1 1 39 24807 1 1 31 TYR N N 5.323 2.686 -0.523 1.00 . A A . 31 TYR N 1 1 39 24808 1 1 31 TYR O O 3.211 2.757 1.207 1.00 . A A . 31 TYR O 1 1 39 24809 1 1 31 TYR OH O 11.110 -0.987 0.419 1.00 . A A . 31 TYR OH 1 1 39 24810 1 1 32 CYS C C 2.402 1.040 4.015 1.00 . A A . 32 CYS C 1 1 39 24811 1 1 32 CYS CA C 2.253 0.552 2.578 1.00 . A A . 32 CYS CA 1 1 39 24812 1 1 32 CYS CB C 1.725 -0.884 2.566 1.00 . A A . 32 CYS CB 1 1 39 24813 1 1 32 CYS H H 4.116 -0.150 1.864 1.00 . A A . 32 CYS H 1 1 39 24814 1 1 32 CYS HA H 1.549 1.190 2.065 1.00 . A A . 32 CYS HA 1 1 39 24815 1 1 32 CYS HB2 H 2.201 -1.428 1.764 1.00 . A A . 32 CYS HB2 1 1 39 24816 1 1 32 CYS HB3 H 1.966 -1.356 3.507 1.00 . A A . 32 CYS HB3 1 1 39 24817 1 1 32 CYS N N 3.525 0.631 1.871 1.00 . A A . 32 CYS N 1 1 39 24818 1 1 32 CYS O O 3.458 0.882 4.628 1.00 . A A . 32 CYS O 1 1 39 24819 1 1 32 CYS SG S -0.077 -1.012 2.327 1.00 . A A . 32 CYS SG 1 1 39 24820 1 1 33 THR C C 0.582 1.207 6.849 1.00 . A A . 33 THR C 1 1 39 24821 1 1 33 THR CA C 1.352 2.137 5.914 1.00 . A A . 33 THR CA 1 1 39 24822 1 1 33 THR CB C 0.749 3.542 5.964 1.00 . A A . 33 THR CB 1 1 39 24823 1 1 33 THR CG2 C 1.447 4.525 5.049 1.00 . A A . 33 THR CG2 1 1 39 24824 1 1 33 THR H H 0.525 1.725 4.010 1.00 . A A . 33 THR H 1 1 39 24825 1 1 33 THR HA H 2.380 2.185 6.239 1.00 . A A . 33 THR HA 1 1 39 24826 1 1 33 THR HB H 0.825 3.919 6.974 1.00 . A A . 33 THR HB 1 1 39 24827 1 1 33 THR HG1 H -1.065 4.281 5.969 1.00 . A A . 33 THR HG1 1 1 39 24828 1 1 33 THR HG21 H 2.503 4.538 5.273 1.00 . A A . 33 THR HG21 1 1 39 24829 1 1 33 THR HG22 H 1.300 4.228 4.022 1.00 . A A . 33 THR HG22 1 1 39 24830 1 1 33 THR HG23 H 1.035 5.512 5.201 1.00 . A A . 33 THR HG23 1 1 39 24831 1 1 33 THR N N 1.338 1.630 4.547 1.00 . A A . 33 THR N 1 1 39 24832 1 1 33 THR O O 0.229 1.590 7.964 1.00 . A A . 33 THR O 1 1 39 24833 1 1 33 THR OG1 O -0.620 3.514 5.601 1.00 . A A . 33 THR OG1 1 1 39 24834 1 1 34 GLY C C -1.646 -0.398 7.839 1.00 . A A . 34 GLY C 1 1 39 24835 1 1 34 GLY CA C -0.400 -0.982 7.198 1.00 . A A . 34 GLY CA 1 1 39 24836 1 1 34 GLY H H 0.634 -0.268 5.491 1.00 . A A . 34 GLY H 1 1 39 24837 1 1 34 GLY HA2 H 0.255 -1.344 7.976 1.00 . A A . 34 GLY HA2 1 1 39 24838 1 1 34 GLY HA3 H -0.689 -1.813 6.572 1.00 . A A . 34 GLY HA3 1 1 39 24839 1 1 34 GLY N N 0.326 -0.017 6.388 1.00 . A A . 34 GLY N 1 1 39 24840 1 1 34 GLY O O -2.012 -0.773 8.953 1.00 . A A . 34 GLY O 1 1 39 24841 1 1 35 ARG C C -4.600 1.199 6.587 1.00 . A A . 35 ARG C 1 1 39 24842 1 1 35 ARG CA C -3.507 1.161 7.649 1.00 . A A . 35 ARG CA 1 1 39 24843 1 1 35 ARG CB C -3.197 2.579 8.130 1.00 . A A . 35 ARG CB 1 1 39 24844 1 1 35 ARG CD C -4.336 4.470 9.330 1.00 . A A . 35 ARG CD 1 1 39 24845 1 1 35 ARG CG C -3.988 2.991 9.361 1.00 . A A . 35 ARG CG 1 1 39 24846 1 1 35 ARG CZ C -6.793 4.514 9.513 1.00 . A A . 35 ARG CZ 1 1 39 24847 1 1 35 ARG H H -1.957 0.784 6.255 1.00 . A A . 35 ARG H 1 1 39 24848 1 1 35 ARG HA H -3.857 0.577 8.484 1.00 . A A . 35 ARG HA 1 1 39 24849 1 1 35 ARG HB2 H -2.145 2.646 8.365 1.00 . A A . 35 ARG HB2 1 1 39 24850 1 1 35 ARG HB3 H -3.423 3.274 7.334 1.00 . A A . 35 ARG HB3 1 1 39 24851 1 1 35 ARG HD2 H -3.539 5.024 9.804 1.00 . A A . 35 ARG HD2 1 1 39 24852 1 1 35 ARG HD3 H -4.429 4.784 8.301 1.00 . A A . 35 ARG HD3 1 1 39 24853 1 1 35 ARG HE H -5.530 5.140 10.925 1.00 . A A . 35 ARG HE 1 1 39 24854 1 1 35 ARG HG2 H -4.902 2.417 9.398 1.00 . A A . 35 ARG HG2 1 1 39 24855 1 1 35 ARG HG3 H -3.396 2.787 10.241 1.00 . A A . 35 ARG HG3 1 1 39 24856 1 1 35 ARG HH11 H -6.096 3.770 7.766 1.00 . A A . 35 ARG HH11 1 1 39 24857 1 1 35 ARG HH12 H -7.820 3.812 7.920 1.00 . A A . 35 ARG HH12 1 1 39 24858 1 1 35 ARG HH21 H -7.797 5.195 11.129 1.00 . A A . 35 ARG HH21 1 1 39 24859 1 1 35 ARG HH22 H -8.786 4.621 9.829 1.00 . A A . 35 ARG HH22 1 1 39 24860 1 1 35 ARG N N -2.297 0.525 7.137 1.00 . A A . 35 ARG N 1 1 39 24861 1 1 35 ARG NE N -5.589 4.752 10.027 1.00 . A A . 35 ARG NE 1 1 39 24862 1 1 35 ARG NH1 N -6.912 3.989 8.300 1.00 . A A . 35 ARG NH1 1 1 39 24863 1 1 35 ARG NH2 N -7.881 4.800 10.215 1.00 . A A . 35 ARG NH2 1 1 39 24864 1 1 35 ARG O O -5.755 0.869 6.857 1.00 . A A . 35 ARG O 1 1 39 24865 1 1 36 SER C C -4.647 0.936 3.055 1.00 . A A . 36 SER C 1 1 39 24866 1 1 36 SER CA C -5.172 1.687 4.273 1.00 . A A . 36 SER CA 1 1 39 24867 1 1 36 SER CB C -5.437 3.149 3.911 1.00 . A A . 36 SER CB 1 1 39 24868 1 1 36 SER H H -3.291 1.851 5.232 1.00 . A A . 36 SER H 1 1 39 24869 1 1 36 SER HA H -6.097 1.230 4.591 1.00 . A A . 36 SER HA 1 1 39 24870 1 1 36 SER HB2 H -5.458 3.743 4.812 1.00 . A A . 36 SER HB2 1 1 39 24871 1 1 36 SER HB3 H -4.649 3.506 3.263 1.00 . A A . 36 SER HB3 1 1 39 24872 1 1 36 SER HG H -6.846 4.223 3.075 1.00 . A A . 36 SER HG 1 1 39 24873 1 1 36 SER N N -4.226 1.603 5.381 1.00 . A A . 36 SER N 1 1 39 24874 1 1 36 SER O O -3.504 0.479 3.040 1.00 . A A . 36 SER O 1 1 39 24875 1 1 36 SER OG O -6.678 3.292 3.242 1.00 . A A . 36 SER OG 1 1 39 24876 1 1 37 CYS C C -4.801 1.105 -0.312 1.00 . A A . 37 CYS C 1 1 39 24877 1 1 37 CYS CA C -5.103 0.117 0.811 1.00 . A A . 37 CYS CA 1 1 39 24878 1 1 37 CYS CB C -6.208 -0.847 0.382 1.00 . A A . 37 CYS CB 1 1 39 24879 1 1 37 CYS H H -6.387 1.198 2.101 1.00 . A A . 37 CYS H 1 1 39 24880 1 1 37 CYS HA H -4.209 -0.449 1.023 1.00 . A A . 37 CYS HA 1 1 39 24881 1 1 37 CYS HB2 H -7.145 -0.314 0.348 1.00 . A A . 37 CYS HB2 1 1 39 24882 1 1 37 CYS HB3 H -5.980 -1.229 -0.602 1.00 . A A . 37 CYS HB3 1 1 39 24883 1 1 37 CYS N N -5.488 0.812 2.033 1.00 . A A . 37 CYS N 1 1 39 24884 1 1 37 CYS O O -4.778 0.737 -1.486 1.00 . A A . 37 CYS O 1 1 39 24885 1 1 37 CYS SG S -6.420 -2.272 1.499 1.00 . A A . 37 CYS SG 1 1 39 24886 1 1 38 GLU C C -2.823 3.887 -0.760 1.00 . A A . 38 GLU C 1 1 39 24887 1 1 38 GLU CA C -4.260 3.401 -0.920 1.00 . A A . 38 GLU CA 1 1 39 24888 1 1 38 GLU CB C -5.229 4.576 -0.767 1.00 . A A . 38 GLU CB 1 1 39 24889 1 1 38 GLU CD C -7.549 5.219 -0.005 1.00 . A A . 38 GLU CD 1 1 39 24890 1 1 38 GLU CG C -6.684 4.153 -0.647 1.00 . A A . 38 GLU CG 1 1 39 24891 1 1 38 GLU H H -4.595 2.595 1.007 1.00 . A A . 38 GLU H 1 1 39 24892 1 1 38 GLU HA H -4.376 2.975 -1.906 1.00 . A A . 38 GLU HA 1 1 39 24893 1 1 38 GLU HB2 H -4.963 5.133 0.119 1.00 . A A . 38 GLU HB2 1 1 39 24894 1 1 38 GLU HB3 H -5.134 5.220 -1.629 1.00 . A A . 38 GLU HB3 1 1 39 24895 1 1 38 GLU HG2 H -7.068 3.946 -1.634 1.00 . A A . 38 GLU HG2 1 1 39 24896 1 1 38 GLU HG3 H -6.736 3.257 -0.046 1.00 . A A . 38 GLU HG3 1 1 39 24897 1 1 38 GLU N N -4.566 2.362 0.056 1.00 . A A . 38 GLU N 1 1 39 24898 1 1 38 GLU O O -2.529 4.709 0.108 1.00 . A A . 38 GLU O 1 1 39 24899 1 1 38 GLU OE1 O -8.286 5.908 -0.741 1.00 . A A . 38 GLU OE1 1 1 39 24900 1 1 38 GLU OE2 O -7.490 5.365 1.234 1.00 . A A . 38 GLU OE2 1 1 39 24901 1 1 39 CYS C C -0.355 5.257 -1.730 1.00 . A A . 39 CYS C 1 1 39 24902 1 1 39 CYS CA C -0.523 3.749 -1.549 1.00 . A A . 39 CYS CA 1 1 39 24903 1 1 39 CYS CB C 0.266 3.004 -2.628 1.00 . A A . 39 CYS CB 1 1 39 24904 1 1 39 CYS H H -2.227 2.718 -2.268 1.00 . A A . 39 CYS H 1 1 39 24905 1 1 39 CYS HA H -0.142 3.467 -0.579 1.00 . A A . 39 CYS HA 1 1 39 24906 1 1 39 CYS HB2 H -0.112 3.285 -3.599 1.00 . A A . 39 CYS HB2 1 1 39 24907 1 1 39 CYS HB3 H 1.308 3.283 -2.559 1.00 . A A . 39 CYS HB3 1 1 39 24908 1 1 39 CYS N N -1.931 3.370 -1.599 1.00 . A A . 39 CYS N 1 1 39 24909 1 1 39 CYS O O -1.010 5.863 -2.578 1.00 . A A . 39 CYS O 1 1 39 24910 1 1 39 CYS SG S 0.169 1.189 -2.501 1.00 . A A . 39 CYS SG 1 1 39 24911 1 1 40 PRO C C 1.124 7.771 -2.437 1.00 . A A . 40 PRO C 1 1 39 24912 1 1 40 PRO CA C 0.777 7.329 -1.020 1.00 . A A . 40 PRO CA 1 1 39 24913 1 1 40 PRO CB C 1.971 7.545 -0.086 1.00 . A A . 40 PRO CB 1 1 39 24914 1 1 40 PRO CD C 1.359 5.243 0.103 1.00 . A A . 40 PRO CD 1 1 39 24915 1 1 40 PRO CG C 1.913 6.408 0.875 1.00 . A A . 40 PRO CG 1 1 39 24916 1 1 40 PRO HA H -0.070 7.897 -0.664 1.00 . A A . 40 PRO HA 1 1 39 24917 1 1 40 PRO HB2 H 2.886 7.532 -0.659 1.00 . A A . 40 PRO HB2 1 1 39 24918 1 1 40 PRO HB3 H 1.868 8.493 0.420 1.00 . A A . 40 PRO HB3 1 1 39 24919 1 1 40 PRO HD2 H 2.159 4.670 -0.341 1.00 . A A . 40 PRO HD2 1 1 39 24920 1 1 40 PRO HD3 H 0.756 4.618 0.745 1.00 . A A . 40 PRO HD3 1 1 39 24921 1 1 40 PRO HG2 H 2.905 6.181 1.236 1.00 . A A . 40 PRO HG2 1 1 39 24922 1 1 40 PRO HG3 H 1.260 6.655 1.699 1.00 . A A . 40 PRO HG3 1 1 39 24923 1 1 40 PRO N N 0.530 5.885 -0.935 1.00 . A A . 40 PRO N 1 1 39 24924 1 1 40 PRO O O 1.212 6.951 -3.350 1.00 . A A . 40 PRO O 1 1 39 24925 1 1 41 SER C C 3.088 10.157 -3.933 1.00 . A A . 41 SER C 1 1 39 24926 1 1 41 SER CA C 1.658 9.625 -3.921 1.00 . A A . 41 SER CA 1 1 39 24927 1 1 41 SER CB C 0.682 10.741 -4.295 1.00 . A A . 41 SER CB 1 1 39 24928 1 1 41 SER H H 1.236 9.678 -1.847 1.00 . A A . 41 SER H 1 1 39 24929 1 1 41 SER HA H 1.577 8.829 -4.647 1.00 . A A . 41 SER HA 1 1 39 24930 1 1 41 SER HB2 H 0.461 11.332 -3.419 1.00 . A A . 41 SER HB2 1 1 39 24931 1 1 41 SER HB3 H 1.130 11.370 -5.050 1.00 . A A . 41 SER HB3 1 1 39 24932 1 1 41 SER HG H -0.494 10.189 -5.762 1.00 . A A . 41 SER HG 1 1 39 24933 1 1 41 SER N N 1.320 9.073 -2.613 1.00 . A A . 41 SER N 1 1 39 24934 1 1 41 SER O O 3.373 11.184 -4.549 1.00 . A A . 41 SER O 1 1 39 24935 1 1 41 SER OG O -0.530 10.210 -4.803 1.00 . A A . 41 SER OG 1 1 39 24936 1 1 42 TYR C C 6.260 8.690 -2.721 1.00 . A A . 42 TYR C 1 1 39 24937 1 1 42 TYR CA C 5.383 9.852 -3.182 1.00 . A A . 42 TYR CA 1 1 39 24938 1 1 42 TYR CB C 5.550 11.041 -2.234 1.00 . A A . 42 TYR CB 1 1 39 24939 1 1 42 TYR CD1 C 6.177 10.315 0.102 1.00 . A A . 42 TYR CD1 1 1 39 24940 1 1 42 TYR CD2 C 3.893 10.835 -0.339 1.00 . A A . 42 TYR CD2 1 1 39 24941 1 1 42 TYR CE1 C 5.862 10.025 1.416 1.00 . A A . 42 TYR CE1 1 1 39 24942 1 1 42 TYR CE2 C 3.570 10.547 0.973 1.00 . A A . 42 TYR CE2 1 1 39 24943 1 1 42 TYR CG C 5.200 10.725 -0.797 1.00 . A A . 42 TYR CG 1 1 39 24944 1 1 42 TYR CZ C 4.558 10.143 1.846 1.00 . A A . 42 TYR CZ 1 1 39 24945 1 1 42 TYR H H 3.694 8.641 -2.779 1.00 . A A . 42 TYR H 1 1 39 24946 1 1 42 TYR HA H 5.690 10.148 -4.173 1.00 . A A . 42 TYR HA 1 1 39 24947 1 1 42 TYR HB2 H 6.577 11.371 -2.259 1.00 . A A . 42 TYR HB2 1 1 39 24948 1 1 42 TYR HB3 H 4.909 11.847 -2.562 1.00 . A A . 42 TYR HB3 1 1 39 24949 1 1 42 TYR HD1 H 7.198 10.225 -0.238 1.00 . A A . 42 TYR HD1 1 1 39 24950 1 1 42 TYR HD2 H 3.121 11.152 -1.025 1.00 . A A . 42 TYR HD2 1 1 39 24951 1 1 42 TYR HE1 H 6.636 9.709 2.099 1.00 . A A . 42 TYR HE1 1 1 39 24952 1 1 42 TYR HE2 H 2.548 10.639 1.310 1.00 . A A . 42 TYR HE2 1 1 39 24953 1 1 42 TYR HH H 4.922 10.202 3.733 1.00 . A A . 42 TYR HH 1 1 39 24954 1 1 42 TYR N N 3.982 9.451 -3.249 1.00 . A A . 42 TYR N 1 1 39 24955 1 1 42 TYR O O 5.816 7.831 -1.960 1.00 . A A . 42 TYR O 1 1 39 24956 1 1 42 TYR OH O 4.240 9.855 3.154 1.00 . A A . 42 TYR OH 1 1 39 24957 1 1 43 PRO C C 8.901 7.682 -1.350 1.00 . A A . 43 PRO C 1 1 39 24958 1 1 43 PRO CA C 8.463 7.587 -2.808 1.00 . A A . 43 PRO CA 1 1 39 24959 1 1 43 PRO CB C 9.653 7.824 -3.740 1.00 . A A . 43 PRO CB 1 1 39 24960 1 1 43 PRO CD C 8.134 9.637 -4.089 1.00 . A A . 43 PRO CD 1 1 39 24961 1 1 43 PRO CG C 9.594 9.276 -4.065 1.00 . A A . 43 PRO CG 1 1 39 24962 1 1 43 PRO HA H 8.046 6.608 -2.994 1.00 . A A . 43 PRO HA 1 1 39 24963 1 1 43 PRO HB2 H 10.570 7.569 -3.229 1.00 . A A . 43 PRO HB2 1 1 39 24964 1 1 43 PRO HB3 H 9.546 7.217 -4.626 1.00 . A A . 43 PRO HB3 1 1 39 24965 1 1 43 PRO HD2 H 7.988 10.642 -3.723 1.00 . A A . 43 PRO HD2 1 1 39 24966 1 1 43 PRO HD3 H 7.736 9.535 -5.088 1.00 . A A . 43 PRO HD3 1 1 39 24967 1 1 43 PRO HG2 H 10.108 9.844 -3.304 1.00 . A A . 43 PRO HG2 1 1 39 24968 1 1 43 PRO HG3 H 10.039 9.454 -5.033 1.00 . A A . 43 PRO HG3 1 1 39 24969 1 1 43 PRO N N 7.523 8.650 -3.178 1.00 . A A . 43 PRO N 1 1 39 24970 1 1 43 PRO O O 8.813 8.744 -0.733 1.00 . A A . 43 PRO O 1 1 39 24971 1 1 44 GLY C C 8.661 6.530 1.557 1.00 . A A . 44 GLY C 1 1 39 24972 1 1 44 GLY CA C 9.817 6.545 0.576 1.00 . A A . 44 GLY CA 1 1 39 24973 1 1 44 GLY H H 9.419 5.749 -1.345 1.00 . A A . 44 GLY H 1 1 39 24974 1 1 44 GLY HA2 H 10.421 7.421 0.761 1.00 . A A . 44 GLY HA2 1 1 39 24975 1 1 44 GLY HA3 H 10.421 5.664 0.735 1.00 . A A . 44 GLY HA3 1 1 39 24976 1 1 44 GLY N N 9.372 6.566 -0.805 1.00 . A A . 44 GLY N 1 1 39 24977 1 1 44 GLY O O 7.550 6.943 1.225 1.00 . A A . 44 GLY O 1 1 39 24978 1 1 45 ASN C C 7.605 7.369 4.372 1.00 . A A . 45 ASN C 1 1 39 24979 1 1 45 ASN CA C 7.896 5.985 3.802 1.00 . A A . 45 ASN CA 1 1 39 24980 1 1 45 ASN CB C 8.333 5.041 4.924 1.00 . A A . 45 ASN CB 1 1 39 24981 1 1 45 ASN CG C 7.156 4.382 5.617 1.00 . A A . 45 ASN CG 1 1 39 24982 1 1 45 ASN H H 9.828 5.738 2.974 1.00 . A A . 45 ASN H 1 1 39 24983 1 1 45 ASN HA H 6.996 5.598 3.349 1.00 . A A . 45 ASN HA 1 1 39 24984 1 1 45 ASN HB2 H 8.962 4.267 4.511 1.00 . A A . 45 ASN HB2 1 1 39 24985 1 1 45 ASN HB3 H 8.893 5.600 5.659 1.00 . A A . 45 ASN HB3 1 1 39 24986 1 1 45 ASN HD21 H 7.248 5.712 7.092 1.00 . A A . 45 ASN HD21 1 1 39 24987 1 1 45 ASN HD22 H 6.005 4.521 7.232 1.00 . A A . 45 ASN HD22 1 1 39 24988 1 1 45 ASN N N 8.923 6.052 2.769 1.00 . A A . 45 ASN N 1 1 39 24989 1 1 45 ASN ND2 N 6.763 4.927 6.763 1.00 . A A . 45 ASN ND2 1 1 39 24990 1 1 45 ASN O O 6.478 7.664 4.769 1.00 . A A . 45 ASN O 1 1 39 24991 1 1 45 ASN OD1 O 6.606 3.396 5.128 1.00 . A A . 45 ASN OD1 1 1 39 24992 1 1 46 GLY C C 9.185 10.600 4.097 1.00 . A A . 46 GLY C 1 1 39 24993 1 1 46 GLY CA C 8.463 9.559 4.931 1.00 . A A . 46 GLY CA 1 1 39 24994 1 1 46 GLY H H 9.505 7.926 4.078 1.00 . A A . 46 GLY H 1 1 39 24995 1 1 46 GLY HA2 H 8.847 9.592 5.939 1.00 . A A . 46 GLY HA2 1 1 39 24996 1 1 46 GLY HA3 H 7.410 9.798 4.951 1.00 . A A . 46 GLY HA3 1 1 39 24997 1 1 46 GLY N N 8.629 8.216 4.408 1.00 . A A . 46 GLY N 1 1 39 24998 1 1 46 GLY O O 8.883 10.707 2.890 1.00 . A A . 46 GLY O 1 1 39 24999 1 1 46 GLY OXT O 10.052 11.307 4.652 1.00 . A A . 46 GLY OXT 1 1 40 25000 1 1 1 ALA C C -17.571 -8.561 5.971 1.00 . A A . 1 ALA C 1 1 40 25001 1 1 1 ALA CA C -18.717 -8.708 4.976 1.00 . A A . 1 ALA CA 1 1 40 25002 1 1 1 ALA CB C -18.204 -9.275 3.661 1.00 . A A . 1 ALA CB 1 1 40 25003 1 1 1 ALA H1 H -19.429 -6.901 5.654 1.00 . A A . 1 ALA H1 1 1 40 25004 1 1 1 ALA H2 H -18.836 -6.877 4.046 1.00 . A A . 1 ALA H2 1 1 40 25005 1 1 1 ALA H3 H -20.352 -7.605 4.390 1.00 . A A . 1 ALA H3 1 1 40 25006 1 1 1 ALA HA H -19.442 -9.401 5.379 1.00 . A A . 1 ALA HA 1 1 40 25007 1 1 1 ALA HB1 H -19.035 -9.437 2.990 1.00 . A A . 1 ALA HB1 1 1 40 25008 1 1 1 ALA HB2 H -17.511 -8.577 3.214 1.00 . A A . 1 ALA HB2 1 1 40 25009 1 1 1 ALA HB3 H -17.702 -10.213 3.845 1.00 . A A . 1 ALA HB3 1 1 40 25010 1 1 1 ALA N N -19.394 -7.405 4.745 1.00 . A A . 1 ALA N 1 1 40 25011 1 1 1 ALA O O -17.533 -9.243 6.995 1.00 . A A . 1 ALA O 1 1 40 25012 1 1 2 MET C C -14.674 -6.237 6.039 1.00 . A A . 2 MET C 1 1 40 25013 1 1 2 MET CA C -15.491 -7.428 6.530 1.00 . A A . 2 MET CA 1 1 40 25014 1 1 2 MET CB C -14.607 -8.676 6.595 1.00 . A A . 2 MET CB 1 1 40 25015 1 1 2 MET CE C -13.205 -11.173 8.955 1.00 . A A . 2 MET CE 1 1 40 25016 1 1 2 MET CG C -13.677 -8.700 7.796 1.00 . A A . 2 MET CG 1 1 40 25017 1 1 2 MET H H -16.724 -7.152 4.832 1.00 . A A . 2 MET H 1 1 40 25018 1 1 2 MET HA H -15.863 -7.210 7.520 1.00 . A A . 2 MET HA 1 1 40 25019 1 1 2 MET HB2 H -15.241 -9.549 6.639 1.00 . A A . 2 MET HB2 1 1 40 25020 1 1 2 MET HB3 H -14.006 -8.723 5.699 1.00 . A A . 2 MET HB3 1 1 40 25021 1 1 2 MET HE1 H -14.012 -10.675 9.470 1.00 . A A . 2 MET HE1 1 1 40 25022 1 1 2 MET HE2 H -13.583 -12.057 8.463 1.00 . A A . 2 MET HE2 1 1 40 25023 1 1 2 MET HE3 H -12.443 -11.456 9.667 1.00 . A A . 2 MET HE3 1 1 40 25024 1 1 2 MET HG2 H -13.126 -7.772 7.827 1.00 . A A . 2 MET HG2 1 1 40 25025 1 1 2 MET HG3 H -14.271 -8.795 8.693 1.00 . A A . 2 MET HG3 1 1 40 25026 1 1 2 MET N N -16.639 -7.665 5.663 1.00 . A A . 2 MET N 1 1 40 25027 1 1 2 MET O O -14.559 -6.005 4.836 1.00 . A A . 2 MET O 1 1 40 25028 1 1 2 MET SD S -12.501 -10.066 7.736 1.00 . A A . 2 MET SD 1 1 40 25029 1 1 3 ASP C C -12.036 -4.729 5.898 1.00 . A A . 3 ASP C 1 1 40 25030 1 1 3 ASP CA C -13.303 -4.319 6.641 1.00 . A A . 3 ASP CA 1 1 40 25031 1 1 3 ASP CB C -12.936 -3.543 7.907 1.00 . A A . 3 ASP CB 1 1 40 25032 1 1 3 ASP CG C -13.995 -2.527 8.290 1.00 . A A . 3 ASP CG 1 1 40 25033 1 1 3 ASP H H -14.238 -5.722 7.921 1.00 . A A . 3 ASP H 1 1 40 25034 1 1 3 ASP HA H -13.893 -3.683 5.998 1.00 . A A . 3 ASP HA 1 1 40 25035 1 1 3 ASP HB2 H -12.818 -4.237 8.726 1.00 . A A . 3 ASP HB2 1 1 40 25036 1 1 3 ASP HB3 H -12.005 -3.021 7.745 1.00 . A A . 3 ASP HB3 1 1 40 25037 1 1 3 ASP N N -14.109 -5.486 6.978 1.00 . A A . 3 ASP N 1 1 40 25038 1 1 3 ASP O O -10.977 -4.898 6.502 1.00 . A A . 3 ASP O 1 1 40 25039 1 1 3 ASP OD1 O -14.211 -1.573 7.513 1.00 . A A . 3 ASP OD1 1 1 40 25040 1 1 3 ASP OD2 O -14.609 -2.686 9.366 1.00 . A A . 3 ASP OD2 1 1 40 25041 1 1 4 CYS C C -10.419 -4.069 3.045 1.00 . A A . 4 CYS C 1 1 40 25042 1 1 4 CYS CA C -11.016 -5.279 3.757 1.00 . A A . 4 CYS CA 1 1 40 25043 1 1 4 CYS CB C -11.442 -6.341 2.737 1.00 . A A . 4 CYS CB 1 1 40 25044 1 1 4 CYS H H -13.023 -4.739 4.159 1.00 . A A . 4 CYS H 1 1 40 25045 1 1 4 CYS HA H -10.266 -5.699 4.405 1.00 . A A . 4 CYS HA 1 1 40 25046 1 1 4 CYS HB2 H -12.487 -6.566 2.880 1.00 . A A . 4 CYS HB2 1 1 40 25047 1 1 4 CYS HB3 H -11.298 -5.953 1.742 1.00 . A A . 4 CYS HB3 1 1 40 25048 1 1 4 CYS N N -12.152 -4.888 4.583 1.00 . A A . 4 CYS N 1 1 40 25049 1 1 4 CYS O O -9.212 -3.835 3.098 1.00 . A A . 4 CYS O 1 1 40 25050 1 1 4 CYS SG S -10.519 -7.908 2.863 1.00 . A A . 4 CYS SG 1 1 40 25051 1 1 5 THR C C -9.993 -2.511 0.444 1.00 . A A . 5 THR C 1 1 40 25052 1 1 5 THR CA C -10.829 -2.114 1.656 1.00 . A A . 5 THR CA 1 1 40 25053 1 1 5 THR CB C -10.019 -1.194 2.574 1.00 . A A . 5 THR CB 1 1 40 25054 1 1 5 THR CG2 C -9.811 0.191 2.002 1.00 . A A . 5 THR CG2 1 1 40 25055 1 1 5 THR H H -12.222 -3.538 2.379 1.00 . A A . 5 THR H 1 1 40 25056 1 1 5 THR HA H -11.705 -1.584 1.315 1.00 . A A . 5 THR HA 1 1 40 25057 1 1 5 THR HB H -9.046 -1.634 2.740 1.00 . A A . 5 THR HB 1 1 40 25058 1 1 5 THR HG1 H -10.036 -1.242 4.532 1.00 . A A . 5 THR HG1 1 1 40 25059 1 1 5 THR HG21 H -9.663 0.121 0.934 1.00 . A A . 5 THR HG21 1 1 40 25060 1 1 5 THR HG22 H -10.681 0.799 2.205 1.00 . A A . 5 THR HG22 1 1 40 25061 1 1 5 THR HG23 H -8.942 0.642 2.457 1.00 . A A . 5 THR HG23 1 1 40 25062 1 1 5 THR N N -11.273 -3.301 2.382 1.00 . A A . 5 THR N 1 1 40 25063 1 1 5 THR O O -9.191 -3.442 0.512 1.00 . A A . 5 THR O 1 1 40 25064 1 1 5 THR OG1 O -10.660 -1.049 3.829 1.00 . A A . 5 THR OG1 1 1 40 25065 1 1 6 THR C C -8.482 -0.963 -2.227 1.00 . A A . 6 THR C 1 1 40 25066 1 1 6 THR CA C -9.451 -2.093 -1.891 1.00 . A A . 6 THR CA 1 1 40 25067 1 1 6 THR CB C -10.421 -2.312 -3.054 1.00 . A A . 6 THR CB 1 1 40 25068 1 1 6 THR CG2 C -10.010 -3.444 -3.970 1.00 . A A . 6 THR CG2 1 1 40 25069 1 1 6 THR H H -10.843 -1.077 -0.660 1.00 . A A . 6 THR H 1 1 40 25070 1 1 6 THR HA H -8.886 -2.999 -1.732 1.00 . A A . 6 THR HA 1 1 40 25071 1 1 6 THR HB H -10.469 -1.409 -3.645 1.00 . A A . 6 THR HB 1 1 40 25072 1 1 6 THR HG1 H -12.368 -2.393 -3.256 1.00 . A A . 6 THR HG1 1 1 40 25073 1 1 6 THR HG21 H -9.002 -3.276 -4.319 1.00 . A A . 6 THR HG21 1 1 40 25074 1 1 6 THR HG22 H -10.053 -4.378 -3.429 1.00 . A A . 6 THR HG22 1 1 40 25075 1 1 6 THR HG23 H -10.682 -3.486 -4.815 1.00 . A A . 6 THR HG23 1 1 40 25076 1 1 6 THR N N -10.187 -1.805 -0.665 1.00 . A A . 6 THR N 1 1 40 25077 1 1 6 THR O O -8.736 0.200 -1.914 1.00 . A A . 6 THR O 1 1 40 25078 1 1 6 THR OG1 O -11.723 -2.599 -2.575 1.00 . A A . 6 THR OG1 1 1 40 25079 1 1 7 GLY C C -4.987 -0.906 -3.364 1.00 . A A . 7 GLY C 1 1 40 25080 1 1 7 GLY CA C -6.383 -0.322 -3.240 1.00 . A A . 7 GLY CA 1 1 40 25081 1 1 7 GLY H H -7.226 -2.258 -3.093 1.00 . A A . 7 GLY H 1 1 40 25082 1 1 7 GLY HA2 H -6.370 0.456 -2.491 1.00 . A A . 7 GLY HA2 1 1 40 25083 1 1 7 GLY HA3 H -6.664 0.112 -4.188 1.00 . A A . 7 GLY HA3 1 1 40 25084 1 1 7 GLY N N -7.373 -1.316 -2.869 1.00 . A A . 7 GLY N 1 1 40 25085 1 1 7 GLY O O -4.743 -2.033 -2.931 1.00 . A A . 7 GLY O 1 1 40 25086 1 1 8 PRO C C -1.894 -0.730 -2.821 1.00 . A A . 8 PRO C 1 1 40 25087 1 1 8 PRO CA C -2.661 -0.615 -4.140 1.00 . A A . 8 PRO CA 1 1 40 25088 1 1 8 PRO CB C -2.040 0.470 -5.025 1.00 . A A . 8 PRO CB 1 1 40 25089 1 1 8 PRO CD C -4.255 1.196 -4.507 1.00 . A A . 8 PRO CD 1 1 40 25090 1 1 8 PRO CG C -2.860 1.686 -4.768 1.00 . A A . 8 PRO CG 1 1 40 25091 1 1 8 PRO HA H -2.627 -1.564 -4.655 1.00 . A A . 8 PRO HA 1 1 40 25092 1 1 8 PRO HB2 H -1.008 0.621 -4.744 1.00 . A A . 8 PRO HB2 1 1 40 25093 1 1 8 PRO HB3 H -2.095 0.170 -6.062 1.00 . A A . 8 PRO HB3 1 1 40 25094 1 1 8 PRO HD2 H -4.750 1.831 -3.788 1.00 . A A . 8 PRO HD2 1 1 40 25095 1 1 8 PRO HD3 H -4.819 1.155 -5.428 1.00 . A A . 8 PRO HD3 1 1 40 25096 1 1 8 PRO HG2 H -2.480 2.209 -3.903 1.00 . A A . 8 PRO HG2 1 1 40 25097 1 1 8 PRO HG3 H -2.844 2.330 -5.634 1.00 . A A . 8 PRO HG3 1 1 40 25098 1 1 8 PRO N N -4.044 -0.156 -3.959 1.00 . A A . 8 PRO N 1 1 40 25099 1 1 8 PRO O O -0.781 -1.254 -2.790 1.00 . A A . 8 PRO O 1 1 40 25100 1 1 9 CYS C C -2.429 -1.415 0.429 1.00 . A A . 9 CYS C 1 1 40 25101 1 1 9 CYS CA C -1.847 -0.290 -0.425 1.00 . A A . 9 CYS CA 1 1 40 25102 1 1 9 CYS CB C -2.005 1.052 0.296 1.00 . A A . 9 CYS CB 1 1 40 25103 1 1 9 CYS H H -3.375 0.171 -1.818 1.00 . A A . 9 CYS H 1 1 40 25104 1 1 9 CYS HA H -0.797 -0.483 -0.580 1.00 . A A . 9 CYS HA 1 1 40 25105 1 1 9 CYS HB2 H -2.428 1.771 -0.389 1.00 . A A . 9 CYS HB2 1 1 40 25106 1 1 9 CYS HB3 H -2.674 0.927 1.135 1.00 . A A . 9 CYS HB3 1 1 40 25107 1 1 9 CYS N N -2.489 -0.238 -1.736 1.00 . A A . 9 CYS N 1 1 40 25108 1 1 9 CYS O O -2.671 -1.239 1.623 1.00 . A A . 9 CYS O 1 1 40 25109 1 1 9 CYS SG S -0.444 1.748 0.929 1.00 . A A . 9 CYS SG 1 1 40 25110 1 1 10 CYS C C -3.288 -4.941 -0.384 1.00 . A A . 10 CYS C 1 1 40 25111 1 1 10 CYS CA C -3.202 -3.719 0.524 1.00 . A A . 10 CYS CA 1 1 40 25112 1 1 10 CYS CB C -4.590 -3.385 1.070 1.00 . A A . 10 CYS CB 1 1 40 25113 1 1 10 CYS H H -2.437 -2.655 -1.141 1.00 . A A . 10 CYS H 1 1 40 25114 1 1 10 CYS HA H -2.546 -3.945 1.351 1.00 . A A . 10 CYS HA 1 1 40 25115 1 1 10 CYS HB2 H -5.068 -4.296 1.397 1.00 . A A . 10 CYS HB2 1 1 40 25116 1 1 10 CYS HB3 H -4.487 -2.716 1.911 1.00 . A A . 10 CYS HB3 1 1 40 25117 1 1 10 CYS N N -2.650 -2.571 -0.188 1.00 . A A . 10 CYS N 1 1 40 25118 1 1 10 CYS O O -3.795 -4.861 -1.503 1.00 . A A . 10 CYS O 1 1 40 25119 1 1 10 CYS SG S -5.693 -2.590 -0.141 1.00 . A A . 10 CYS SG 1 1 40 25120 1 1 11 ARG C C -4.279 -7.769 -0.846 1.00 . A A . 11 ARG C 1 1 40 25121 1 1 11 ARG CA C -2.837 -7.316 -0.653 1.00 . A A . 11 ARG CA 1 1 40 25122 1 1 11 ARG CB C -2.034 -8.406 0.059 1.00 . A A . 11 ARG CB 1 1 40 25123 1 1 11 ARG CD C -0.037 -9.867 -0.390 1.00 . A A . 11 ARG CD 1 1 40 25124 1 1 11 ARG CG C -0.568 -8.443 -0.343 1.00 . A A . 11 ARG CG 1 1 40 25125 1 1 11 ARG CZ C 1.073 -9.963 -2.588 1.00 . A A . 11 ARG CZ 1 1 40 25126 1 1 11 ARG H H -2.418 -6.078 1.014 1.00 . A A . 11 ARG H 1 1 40 25127 1 1 11 ARG HA H -2.397 -7.126 -1.621 1.00 . A A . 11 ARG HA 1 1 40 25128 1 1 11 ARG HB2 H -2.089 -8.239 1.125 1.00 . A A . 11 ARG HB2 1 1 40 25129 1 1 11 ARG HB3 H -2.472 -9.367 -0.168 1.00 . A A . 11 ARG HB3 1 1 40 25130 1 1 11 ARG HD2 H 0.928 -9.894 0.093 1.00 . A A . 11 ARG HD2 1 1 40 25131 1 1 11 ARG HD3 H -0.722 -10.511 0.141 1.00 . A A . 11 ARG HD3 1 1 40 25132 1 1 11 ARG HE H -0.554 -11.002 -2.082 1.00 . A A . 11 ARG HE 1 1 40 25133 1 1 11 ARG HG2 H -0.462 -7.997 -1.320 1.00 . A A . 11 ARG HG2 1 1 40 25134 1 1 11 ARG HG3 H 0.006 -7.878 0.377 1.00 . A A . 11 ARG HG3 1 1 40 25135 1 1 11 ARG HH11 H 1.946 -8.710 -1.262 1.00 . A A . 11 ARG HH11 1 1 40 25136 1 1 11 ARG HH12 H 2.708 -8.796 -2.814 1.00 . A A . 11 ARG HH12 1 1 40 25137 1 1 11 ARG HH21 H 0.447 -11.116 -4.125 1.00 . A A . 11 ARG HH21 1 1 40 25138 1 1 11 ARG HH22 H 1.857 -10.161 -4.440 1.00 . A A . 11 ARG HH22 1 1 40 25139 1 1 11 ARG N N -2.801 -6.075 0.111 1.00 . A A . 11 ARG N 1 1 40 25140 1 1 11 ARG NE N 0.105 -10.352 -1.761 1.00 . A A . 11 ARG NE 1 1 40 25141 1 1 11 ARG NH1 N 1.984 -9.084 -2.188 1.00 . A A . 11 ARG NH1 1 1 40 25142 1 1 11 ARG NH2 N 1.130 -10.454 -3.819 1.00 . A A . 11 ARG NH2 1 1 40 25143 1 1 11 ARG O O -4.925 -8.230 0.095 1.00 . A A . 11 ARG O 1 1 40 25144 1 1 12 GLN C C -7.126 -7.023 -1.701 1.00 . A A . 12 GLN C 1 1 40 25145 1 1 12 GLN CA C -6.164 -7.993 -2.373 1.00 . A A . 12 GLN CA 1 1 40 25146 1 1 12 GLN CB C -6.452 -9.427 -1.919 1.00 . A A . 12 GLN CB 1 1 40 25147 1 1 12 GLN CD C -4.482 -10.794 -1.124 1.00 . A A . 12 GLN CD 1 1 40 25148 1 1 12 GLN CG C -5.362 -10.416 -2.299 1.00 . A A . 12 GLN CG 1 1 40 25149 1 1 12 GLN H H -4.228 -7.232 -2.772 1.00 . A A . 12 GLN H 1 1 40 25150 1 1 12 GLN HA H -6.295 -7.927 -3.440 1.00 . A A . 12 GLN HA 1 1 40 25151 1 1 12 GLN HB2 H -6.560 -9.439 -0.845 1.00 . A A . 12 GLN HB2 1 1 40 25152 1 1 12 GLN HB3 H -7.378 -9.755 -2.368 1.00 . A A . 12 GLN HB3 1 1 40 25153 1 1 12 GLN HE21 H -2.984 -11.235 -2.355 1.00 . A A . 12 GLN HE21 1 1 40 25154 1 1 12 GLN HE22 H -2.661 -11.453 -0.672 1.00 . A A . 12 GLN HE22 1 1 40 25155 1 1 12 GLN HG2 H -5.825 -11.312 -2.685 1.00 . A A . 12 GLN HG2 1 1 40 25156 1 1 12 GLN HG3 H -4.743 -9.973 -3.066 1.00 . A A . 12 GLN HG3 1 1 40 25157 1 1 12 GLN N N -4.787 -7.618 -2.066 1.00 . A A . 12 GLN N 1 1 40 25158 1 1 12 GLN NE2 N -3.252 -11.202 -1.413 1.00 . A A . 12 GLN NE2 1 1 40 25159 1 1 12 GLN O O -7.796 -6.232 -2.365 1.00 . A A . 12 GLN O 1 1 40 25160 1 1 12 GLN OE1 O -4.903 -10.721 0.031 1.00 . A A . 12 GLN OE1 1 1 40 25161 1 1 13 CYS C C -7.601 -6.206 1.866 1.00 . A A . 13 CYS C 1 1 40 25162 1 1 13 CYS CA C -8.029 -6.206 0.402 1.00 . A A . 13 CYS CA 1 1 40 25163 1 1 13 CYS CB C -9.491 -6.633 0.269 1.00 . A A . 13 CYS CB 1 1 40 25164 1 1 13 CYS H H -6.609 -7.725 0.089 1.00 . A A . 13 CYS H 1 1 40 25165 1 1 13 CYS HA H -7.920 -5.205 0.011 1.00 . A A . 13 CYS HA 1 1 40 25166 1 1 13 CYS HB2 H -10.110 -5.909 0.767 1.00 . A A . 13 CYS HB2 1 1 40 25167 1 1 13 CYS HB3 H -9.753 -6.657 -0.779 1.00 . A A . 13 CYS HB3 1 1 40 25168 1 1 13 CYS N N -7.173 -7.081 -0.377 1.00 . A A . 13 CYS N 1 1 40 25169 1 1 13 CYS O O -8.421 -6.048 2.766 1.00 . A A . 13 CYS O 1 1 40 25170 1 1 13 CYS SG S -9.867 -8.276 0.971 1.00 . A A . 13 CYS SG 1 1 40 25171 1 1 14 LYS C C -4.761 -5.265 3.639 1.00 . A A . 14 LYS C 1 1 40 25172 1 1 14 LYS CA C -5.762 -6.397 3.450 1.00 . A A . 14 LYS CA 1 1 40 25173 1 1 14 LYS CB C -5.093 -7.742 3.740 1.00 . A A . 14 LYS CB 1 1 40 25174 1 1 14 LYS CD C -6.655 -9.613 3.128 1.00 . A A . 14 LYS CD 1 1 40 25175 1 1 14 LYS CE C -7.891 -10.371 3.583 1.00 . A A . 14 LYS CE 1 1 40 25176 1 1 14 LYS CG C -6.052 -8.799 4.262 1.00 . A A . 14 LYS CG 1 1 40 25177 1 1 14 LYS H H -5.692 -6.497 1.339 1.00 . A A . 14 LYS H 1 1 40 25178 1 1 14 LYS HA H -6.583 -6.256 4.137 1.00 . A A . 14 LYS HA 1 1 40 25179 1 1 14 LYS HB2 H -4.645 -8.111 2.829 1.00 . A A . 14 LYS HB2 1 1 40 25180 1 1 14 LYS HB3 H -4.318 -7.593 4.478 1.00 . A A . 14 LYS HB3 1 1 40 25181 1 1 14 LYS HD2 H -6.930 -8.945 2.325 1.00 . A A . 14 LYS HD2 1 1 40 25182 1 1 14 LYS HD3 H -5.918 -10.320 2.775 1.00 . A A . 14 LYS HD3 1 1 40 25183 1 1 14 LYS HE2 H -8.653 -9.659 3.861 1.00 . A A . 14 LYS HE2 1 1 40 25184 1 1 14 LYS HE3 H -8.248 -10.977 2.763 1.00 . A A . 14 LYS HE3 1 1 40 25185 1 1 14 LYS HG2 H -5.516 -9.463 4.922 1.00 . A A . 14 LYS HG2 1 1 40 25186 1 1 14 LYS HG3 H -6.848 -8.311 4.806 1.00 . A A . 14 LYS HG3 1 1 40 25187 1 1 14 LYS HZ1 H -6.684 -11.720 4.625 1.00 . A A . 14 LYS HZ1 1 1 40 25188 1 1 14 LYS HZ2 H -7.582 -10.692 5.624 1.00 . A A . 14 LYS HZ2 1 1 40 25189 1 1 14 LYS HZ3 H -8.341 -11.982 4.835 1.00 . A A . 14 LYS HZ3 1 1 40 25190 1 1 14 LYS N N -6.303 -6.381 2.097 1.00 . A A . 14 LYS N 1 1 40 25191 1 1 14 LYS NZ N -7.604 -11.253 4.748 1.00 . A A . 14 LYS NZ 1 1 40 25192 1 1 14 LYS O O -3.720 -5.230 2.983 1.00 . A A . 14 LYS O 1 1 40 25193 1 1 15 LEU C C -2.762 -3.627 4.940 1.00 . A A . 15 LEU C 1 1 40 25194 1 1 15 LEU CA C -4.218 -3.195 4.812 1.00 . A A . 15 LEU CA 1 1 40 25195 1 1 15 LEU CB C -4.666 -2.488 6.093 1.00 . A A . 15 LEU CB 1 1 40 25196 1 1 15 LEU CD1 C -6.285 -0.964 7.250 1.00 . A A . 15 LEU CD1 1 1 40 25197 1 1 15 LEU CD2 C -5.229 -0.261 5.095 1.00 . A A . 15 LEU CD2 1 1 40 25198 1 1 15 LEU CG C -5.759 -1.435 5.903 1.00 . A A . 15 LEU CG 1 1 40 25199 1 1 15 LEU H H -5.931 -4.421 5.021 1.00 . A A . 15 LEU H 1 1 40 25200 1 1 15 LEU HA H -4.304 -2.508 3.984 1.00 . A A . 15 LEU HA 1 1 40 25201 1 1 15 LEU HB2 H -5.031 -3.236 6.782 1.00 . A A . 15 LEU HB2 1 1 40 25202 1 1 15 LEU HB3 H -3.806 -2.006 6.532 1.00 . A A . 15 LEU HB3 1 1 40 25203 1 1 15 LEU HD11 H -5.456 -0.801 7.923 1.00 . A A . 15 LEU HD11 1 1 40 25204 1 1 15 LEU HD12 H -6.831 -0.041 7.120 1.00 . A A . 15 LEU HD12 1 1 40 25205 1 1 15 LEU HD13 H -6.942 -1.716 7.662 1.00 . A A . 15 LEU HD13 1 1 40 25206 1 1 15 LEU HD21 H -4.387 -0.583 4.500 1.00 . A A . 15 LEU HD21 1 1 40 25207 1 1 15 LEU HD22 H -6.008 0.109 4.445 1.00 . A A . 15 LEU HD22 1 1 40 25208 1 1 15 LEU HD23 H -4.916 0.526 5.766 1.00 . A A . 15 LEU HD23 1 1 40 25209 1 1 15 LEU HG H -6.582 -1.874 5.358 1.00 . A A . 15 LEU HG 1 1 40 25210 1 1 15 LEU N N -5.085 -4.337 4.535 1.00 . A A . 15 LEU N 1 1 40 25211 1 1 15 LEU O O -2.344 -4.141 5.978 1.00 . A A . 15 LEU O 1 1 40 25212 1 1 16 LYS C C 0.155 -3.124 5.030 1.00 . A A . 16 LYS C 1 1 40 25213 1 1 16 LYS CA C -0.584 -3.786 3.868 1.00 . A A . 16 LYS CA 1 1 40 25214 1 1 16 LYS CB C 0.061 -3.388 2.537 1.00 . A A . 16 LYS CB 1 1 40 25215 1 1 16 LYS CD C 0.169 -4.867 0.504 1.00 . A A . 16 LYS CD 1 1 40 25216 1 1 16 LYS CE C 0.667 -3.935 -0.589 1.00 . A A . 16 LYS CE 1 1 40 25217 1 1 16 LYS CG C 0.792 -4.532 1.850 1.00 . A A . 16 LYS CG 1 1 40 25218 1 1 16 LYS H H -2.385 -3.004 3.078 1.00 . A A . 16 LYS H 1 1 40 25219 1 1 16 LYS HA H -0.527 -4.859 3.979 1.00 . A A . 16 LYS HA 1 1 40 25220 1 1 16 LYS HB2 H -0.709 -3.028 1.871 1.00 . A A . 16 LYS HB2 1 1 40 25221 1 1 16 LYS HB3 H 0.770 -2.593 2.716 1.00 . A A . 16 LYS HB3 1 1 40 25222 1 1 16 LYS HD2 H 0.427 -5.882 0.241 1.00 . A A . 16 LYS HD2 1 1 40 25223 1 1 16 LYS HD3 H -0.904 -4.775 0.582 1.00 . A A . 16 LYS HD3 1 1 40 25224 1 1 16 LYS HE2 H -0.071 -3.163 -0.750 1.00 . A A . 16 LYS HE2 1 1 40 25225 1 1 16 LYS HE3 H 1.594 -3.483 -0.264 1.00 . A A . 16 LYS HE3 1 1 40 25226 1 1 16 LYS HG2 H 1.822 -4.247 1.697 1.00 . A A . 16 LYS HG2 1 1 40 25227 1 1 16 LYS HG3 H 0.748 -5.406 2.484 1.00 . A A . 16 LYS HG3 1 1 40 25228 1 1 16 LYS HZ1 H 1.457 -5.519 -1.698 1.00 . A A . 16 LYS HZ1 1 1 40 25229 1 1 16 LYS HZ2 H -0.006 -4.921 -2.302 1.00 . A A . 16 LYS HZ2 1 1 40 25230 1 1 16 LYS HZ3 H 1.424 -4.047 -2.533 1.00 . A A . 16 LYS HZ3 1 1 40 25231 1 1 16 LYS N N -1.994 -3.417 3.876 1.00 . A A . 16 LYS N 1 1 40 25232 1 1 16 LYS NZ N 0.902 -4.656 -1.870 1.00 . A A . 16 LYS NZ 1 1 40 25233 1 1 16 LYS O O -0.097 -1.964 5.353 1.00 . A A . 16 LYS O 1 1 40 25234 1 1 17 PRO C C 2.704 -2.123 6.418 1.00 . A A . 17 PRO C 1 1 40 25235 1 1 17 PRO CA C 1.851 -3.324 6.809 1.00 . A A . 17 PRO CA 1 1 40 25236 1 1 17 PRO CB C 2.745 -4.497 7.226 1.00 . A A . 17 PRO CB 1 1 40 25237 1 1 17 PRO CD C 1.449 -5.244 5.364 1.00 . A A . 17 PRO CD 1 1 40 25238 1 1 17 PRO CG C 2.778 -5.403 6.042 1.00 . A A . 17 PRO CG 1 1 40 25239 1 1 17 PRO HA H 1.205 -3.050 7.631 1.00 . A A . 17 PRO HA 1 1 40 25240 1 1 17 PRO HB2 H 3.732 -4.130 7.469 1.00 . A A . 17 PRO HB2 1 1 40 25241 1 1 17 PRO HB3 H 2.318 -4.990 8.086 1.00 . A A . 17 PRO HB3 1 1 40 25242 1 1 17 PRO HD2 H 1.548 -5.387 4.299 1.00 . A A . 17 PRO HD2 1 1 40 25243 1 1 17 PRO HD3 H 0.729 -5.936 5.775 1.00 . A A . 17 PRO HD3 1 1 40 25244 1 1 17 PRO HG2 H 3.576 -5.108 5.377 1.00 . A A . 17 PRO HG2 1 1 40 25245 1 1 17 PRO HG3 H 2.915 -6.424 6.365 1.00 . A A . 17 PRO HG3 1 1 40 25246 1 1 17 PRO N N 1.080 -3.853 5.678 1.00 . A A . 17 PRO N 1 1 40 25247 1 1 17 PRO O O 3.365 -2.131 5.379 1.00 . A A . 17 PRO O 1 1 40 25248 1 1 18 ALA C C 4.912 -0.230 6.652 1.00 . A A . 18 ALA C 1 1 40 25249 1 1 18 ALA CA C 3.469 0.115 7.006 1.00 . A A . 18 ALA CA 1 1 40 25250 1 1 18 ALA CB C 3.426 1.035 8.216 1.00 . A A . 18 ALA CB 1 1 40 25251 1 1 18 ALA H H 2.147 -1.147 8.073 1.00 . A A . 18 ALA H 1 1 40 25252 1 1 18 ALA HA H 3.018 0.633 6.172 1.00 . A A . 18 ALA HA 1 1 40 25253 1 1 18 ALA HB1 H 3.691 0.477 9.102 1.00 . A A . 18 ALA HB1 1 1 40 25254 1 1 18 ALA HB2 H 4.127 1.845 8.078 1.00 . A A . 18 ALA HB2 1 1 40 25255 1 1 18 ALA HB3 H 2.430 1.437 8.328 1.00 . A A . 18 ALA HB3 1 1 40 25256 1 1 18 ALA N N 2.691 -1.093 7.260 1.00 . A A . 18 ALA N 1 1 40 25257 1 1 18 ALA O O 5.360 -1.357 6.866 1.00 . A A . 18 ALA O 1 1 40 25258 1 1 19 GLY C C 7.148 -0.558 4.654 1.00 . A A . 19 GLY C 1 1 40 25259 1 1 19 GLY CA C 7.014 0.508 5.725 1.00 . A A . 19 GLY CA 1 1 40 25260 1 1 19 GLY H H 5.225 1.618 5.952 1.00 . A A . 19 GLY H 1 1 40 25261 1 1 19 GLY HA2 H 7.569 0.198 6.598 1.00 . A A . 19 GLY HA2 1 1 40 25262 1 1 19 GLY HA3 H 7.435 1.432 5.354 1.00 . A A . 19 GLY HA3 1 1 40 25263 1 1 19 GLY N N 5.634 0.740 6.104 1.00 . A A . 19 GLY N 1 1 40 25264 1 1 19 GLY O O 8.234 -1.097 4.438 1.00 . A A . 19 GLY O 1 1 40 25265 1 1 20 THR C C 5.591 -1.249 1.604 1.00 . A A . 20 THR C 1 1 40 25266 1 1 20 THR CA C 6.038 -1.866 2.923 1.00 . A A . 20 THR CA 1 1 40 25267 1 1 20 THR CB C 5.116 -3.028 3.297 1.00 . A A . 20 THR CB 1 1 40 25268 1 1 20 THR CG2 C 5.196 -4.190 2.331 1.00 . A A . 20 THR CG2 1 1 40 25269 1 1 20 THR H H 5.208 -0.396 4.193 1.00 . A A . 20 THR H 1 1 40 25270 1 1 20 THR HA H 7.046 -2.237 2.812 1.00 . A A . 20 THR HA 1 1 40 25271 1 1 20 THR HB H 4.094 -2.675 3.306 1.00 . A A . 20 THR HB 1 1 40 25272 1 1 20 THR HG1 H 4.663 -3.424 5.161 1.00 . A A . 20 THR HG1 1 1 40 25273 1 1 20 THR HG21 H 6.228 -4.483 2.206 1.00 . A A . 20 THR HG21 1 1 40 25274 1 1 20 THR HG22 H 4.630 -5.022 2.722 1.00 . A A . 20 THR HG22 1 1 40 25275 1 1 20 THR HG23 H 4.787 -3.893 1.376 1.00 . A A . 20 THR HG23 1 1 40 25276 1 1 20 THR N N 6.042 -0.862 3.979 1.00 . A A . 20 THR N 1 1 40 25277 1 1 20 THR O O 4.633 -0.478 1.561 1.00 . A A . 20 THR O 1 1 40 25278 1 1 20 THR OG1 O 5.427 -3.520 4.588 1.00 . A A . 20 THR OG1 1 1 40 25279 1 1 21 THR C C 4.531 -1.369 -1.178 1.00 . A A . 21 THR C 1 1 40 25280 1 1 21 THR CA C 5.973 -1.057 -0.790 1.00 . A A . 21 THR CA 1 1 40 25281 1 1 21 THR CB C 6.933 -1.622 -1.839 1.00 . A A . 21 THR CB 1 1 40 25282 1 1 21 THR CG2 C 7.813 -0.564 -2.463 1.00 . A A . 21 THR CG2 1 1 40 25283 1 1 21 THR H H 7.051 -2.202 0.628 1.00 . A A . 21 THR H 1 1 40 25284 1 1 21 THR HA H 6.094 0.014 -0.750 1.00 . A A . 21 THR HA 1 1 40 25285 1 1 21 THR HB H 6.359 -2.083 -2.630 1.00 . A A . 21 THR HB 1 1 40 25286 1 1 21 THR HG1 H 7.609 -3.455 -1.688 1.00 . A A . 21 THR HG1 1 1 40 25287 1 1 21 THR HG21 H 8.165 0.108 -1.694 1.00 . A A . 21 THR HG21 1 1 40 25288 1 1 21 THR HG22 H 8.656 -1.035 -2.945 1.00 . A A . 21 THR HG22 1 1 40 25289 1 1 21 THR HG23 H 7.243 -0.009 -3.193 1.00 . A A . 21 THR HG23 1 1 40 25290 1 1 21 THR N N 6.294 -1.587 0.530 1.00 . A A . 21 THR N 1 1 40 25291 1 1 21 THR O O 4.098 -2.520 -1.126 1.00 . A A . 21 THR O 1 1 40 25292 1 1 21 THR OG1 O 7.779 -2.607 -1.272 1.00 . A A . 21 THR OG1 1 1 40 25293 1 1 22 CYS C C 2.246 -0.289 -3.482 1.00 . A A . 22 CYS C 1 1 40 25294 1 1 22 CYS CA C 2.405 -0.498 -1.981 1.00 . A A . 22 CYS CA 1 1 40 25295 1 1 22 CYS CB C 1.501 0.479 -1.226 1.00 . A A . 22 CYS CB 1 1 40 25296 1 1 22 CYS H H 4.199 0.559 -1.601 1.00 . A A . 22 CYS H 1 1 40 25297 1 1 22 CYS HA H 2.110 -1.508 -1.739 1.00 . A A . 22 CYS HA 1 1 40 25298 1 1 22 CYS HB2 H 0.518 0.463 -1.672 1.00 . A A . 22 CYS HB2 1 1 40 25299 1 1 22 CYS HB3 H 1.426 0.164 -0.195 1.00 . A A . 22 CYS HB3 1 1 40 25300 1 1 22 CYS N N 3.796 -0.334 -1.576 1.00 . A A . 22 CYS N 1 1 40 25301 1 1 22 CYS O O 1.162 0.051 -3.956 1.00 . A A . 22 CYS O 1 1 40 25302 1 1 22 CYS SG S 2.082 2.207 -1.238 1.00 . A A . 22 CYS SG 1 1 40 25303 1 1 23 TRP C C 4.501 -0.955 -6.343 1.00 . A A . 23 TRP C 1 1 40 25304 1 1 23 TRP CA C 3.287 -0.326 -5.673 1.00 . A A . 23 TRP CA 1 1 40 25305 1 1 23 TRP CB C 3.197 1.159 -6.034 1.00 . A A . 23 TRP CB 1 1 40 25306 1 1 23 TRP CD1 C 1.614 0.523 -7.942 1.00 . A A . 23 TRP CD1 1 1 40 25307 1 1 23 TRP CD2 C 1.766 2.724 -7.571 1.00 . A A . 23 TRP CD2 1 1 40 25308 1 1 23 TRP CE2 C 0.869 2.508 -8.634 1.00 . A A . 23 TRP CE2 1 1 40 25309 1 1 23 TRP CE3 C 2.021 4.034 -7.160 1.00 . A A . 23 TRP CE3 1 1 40 25310 1 1 23 TRP CG C 2.229 1.440 -7.141 1.00 . A A . 23 TRP CG 1 1 40 25311 1 1 23 TRP CH2 C 0.494 4.825 -8.867 1.00 . A A . 23 TRP CH2 1 1 40 25312 1 1 23 TRP CZ2 C 0.226 3.552 -9.289 1.00 . A A . 23 TRP CZ2 1 1 40 25313 1 1 23 TRP CZ3 C 1.383 5.072 -7.813 1.00 . A A . 23 TRP CZ3 1 1 40 25314 1 1 23 TRP H H 4.164 -0.767 -3.799 1.00 . A A . 23 TRP H 1 1 40 25315 1 1 23 TRP HA H 2.403 -0.823 -6.034 1.00 . A A . 23 TRP HA 1 1 40 25316 1 1 23 TRP HB2 H 2.881 1.716 -5.165 1.00 . A A . 23 TRP HB2 1 1 40 25317 1 1 23 TRP HB3 H 4.170 1.509 -6.346 1.00 . A A . 23 TRP HB3 1 1 40 25318 1 1 23 TRP HD1 H 1.763 -0.542 -7.865 1.00 . A A . 23 TRP HD1 1 1 40 25319 1 1 23 TRP HE1 H 0.242 0.713 -9.519 1.00 . A A . 23 TRP HE1 1 1 40 25320 1 1 23 TRP HE3 H 2.704 4.242 -6.350 1.00 . A A . 23 TRP HE3 1 1 40 25321 1 1 23 TRP HH2 H 0.021 5.665 -9.350 1.00 . A A . 23 TRP HH2 1 1 40 25322 1 1 23 TRP HZ2 H -0.463 3.378 -10.101 1.00 . A A . 23 TRP HZ2 1 1 40 25323 1 1 23 TRP HZ3 H 1.568 6.092 -7.511 1.00 . A A . 23 TRP HZ3 1 1 40 25324 1 1 23 TRP N N 3.326 -0.495 -4.228 1.00 . A A . 23 TRP N 1 1 40 25325 1 1 23 TRP NE1 N 0.792 1.156 -8.841 1.00 . A A . 23 TRP NE1 1 1 40 25326 1 1 23 TRP O O 4.400 -2.011 -6.968 1.00 . A A . 23 TRP O 1 1 40 25327 1 1 24 LYS C C 6.698 -1.010 -8.319 1.00 . A A . 24 LYS C 1 1 40 25328 1 1 24 LYS CA C 6.879 -0.791 -6.819 1.00 . A A . 24 LYS CA 1 1 40 25329 1 1 24 LYS CB C 7.312 -2.095 -6.148 1.00 . A A . 24 LYS CB 1 1 40 25330 1 1 24 LYS CD C 9.336 -3.467 -5.570 1.00 . A A . 24 LYS CD 1 1 40 25331 1 1 24 LYS CE C 10.088 -4.630 -6.197 1.00 . A A . 24 LYS CE 1 1 40 25332 1 1 24 LYS CG C 8.662 -2.606 -6.625 1.00 . A A . 24 LYS CG 1 1 40 25333 1 1 24 LYS H H 5.661 0.539 -5.711 1.00 . A A . 24 LYS H 1 1 40 25334 1 1 24 LYS HA H 7.644 -0.045 -6.666 1.00 . A A . 24 LYS HA 1 1 40 25335 1 1 24 LYS HB2 H 7.369 -1.935 -5.081 1.00 . A A . 24 LYS HB2 1 1 40 25336 1 1 24 LYS HB3 H 6.572 -2.854 -6.351 1.00 . A A . 24 LYS HB3 1 1 40 25337 1 1 24 LYS HD2 H 10.034 -2.859 -5.014 1.00 . A A . 24 LYS HD2 1 1 40 25338 1 1 24 LYS HD3 H 8.582 -3.856 -4.902 1.00 . A A . 24 LYS HD3 1 1 40 25339 1 1 24 LYS HE2 H 10.493 -4.310 -7.146 1.00 . A A . 24 LYS HE2 1 1 40 25340 1 1 24 LYS HE3 H 10.896 -4.916 -5.540 1.00 . A A . 24 LYS HE3 1 1 40 25341 1 1 24 LYS HG2 H 8.518 -3.195 -7.518 1.00 . A A . 24 LYS HG2 1 1 40 25342 1 1 24 LYS HG3 H 9.298 -1.761 -6.847 1.00 . A A . 24 LYS HG3 1 1 40 25343 1 1 24 LYS HZ1 H 8.238 -5.492 -6.643 1.00 . A A . 24 LYS HZ1 1 1 40 25344 1 1 24 LYS HZ2 H 9.562 -6.378 -7.214 1.00 . A A . 24 LYS HZ2 1 1 40 25345 1 1 24 LYS HZ3 H 9.176 -6.401 -5.568 1.00 . A A . 24 LYS HZ3 1 1 40 25346 1 1 24 LYS N N 5.646 -0.298 -6.217 1.00 . A A . 24 LYS N 1 1 40 25347 1 1 24 LYS NZ N 9.204 -5.807 -6.421 1.00 . A A . 24 LYS NZ 1 1 40 25348 1 1 24 LYS O O 7.288 -1.921 -8.899 1.00 . A A . 24 LYS O 1 1 40 25349 1 1 25 THR C C 6.909 -0.291 -11.172 1.00 . A A . 25 THR C 1 1 40 25350 1 1 25 THR CA C 5.608 -0.272 -10.373 1.00 . A A . 25 THR CA 1 1 40 25351 1 1 25 THR CB C 4.718 0.884 -10.839 1.00 . A A . 25 THR CB 1 1 40 25352 1 1 25 THR CG2 C 5.392 2.232 -10.745 1.00 . A A . 25 THR CG2 1 1 40 25353 1 1 25 THR H H 5.429 0.535 -8.423 1.00 . A A . 25 THR H 1 1 40 25354 1 1 25 THR HA H 5.089 -1.201 -10.547 1.00 . A A . 25 THR HA 1 1 40 25355 1 1 25 THR HB H 3.830 0.915 -10.222 1.00 . A A . 25 THR HB 1 1 40 25356 1 1 25 THR HG1 H 3.780 -0.094 -12.253 1.00 . A A . 25 THR HG1 1 1 40 25357 1 1 25 THR HG21 H 6.316 2.129 -10.201 1.00 . A A . 25 THR HG21 1 1 40 25358 1 1 25 THR HG22 H 5.597 2.604 -11.738 1.00 . A A . 25 THR HG22 1 1 40 25359 1 1 25 THR HG23 H 4.744 2.924 -10.227 1.00 . A A . 25 THR HG23 1 1 40 25360 1 1 25 THR N N 5.873 -0.169 -8.941 1.00 . A A . 25 THR N 1 1 40 25361 1 1 25 THR O O 8.000 -0.191 -10.610 1.00 . A A . 25 THR O 1 1 40 25362 1 1 25 THR OG1 O 4.318 0.698 -12.185 1.00 . A A . 25 THR OG1 1 1 40 25363 1 1 26 SER C C 8.759 0.792 -13.333 1.00 . A A . 26 SER C 1 1 40 25364 1 1 26 SER CA C 7.934 -0.494 -13.374 1.00 . A A . 26 SER CA 1 1 40 25365 1 1 26 SER CB C 7.478 -0.768 -14.808 1.00 . A A . 26 SER CB 1 1 40 25366 1 1 26 SER H H 5.879 -0.527 -12.862 1.00 . A A . 26 SER H 1 1 40 25367 1 1 26 SER HA H 8.558 -1.313 -13.049 1.00 . A A . 26 SER HA 1 1 40 25368 1 1 26 SER HB2 H 6.795 0.007 -15.121 1.00 . A A . 26 SER HB2 1 1 40 25369 1 1 26 SER HB3 H 8.338 -0.776 -15.462 1.00 . A A . 26 SER HB3 1 1 40 25370 1 1 26 SER HG H 7.249 -2.556 -15.575 1.00 . A A . 26 SER HG 1 1 40 25371 1 1 26 SER N N 6.779 -0.439 -12.483 1.00 . A A . 26 SER N 1 1 40 25372 1 1 26 SER O O 9.941 0.784 -13.677 1.00 . A A . 26 SER O 1 1 40 25373 1 1 26 SER OG O 6.820 -2.020 -14.904 1.00 . A A . 26 SER OG 1 1 40 25374 1 1 27 VAL C C 8.219 4.113 -11.831 1.00 . A A . 27 VAL C 1 1 40 25375 1 1 27 VAL CA C 8.845 3.177 -12.862 1.00 . A A . 27 VAL CA 1 1 40 25376 1 1 27 VAL CB C 8.858 3.880 -14.235 1.00 . A A . 27 VAL CB 1 1 40 25377 1 1 27 VAL CG1 C 9.743 5.116 -14.195 1.00 . A A . 27 VAL CG1 1 1 40 25378 1 1 27 VAL CG2 C 9.317 2.923 -15.325 1.00 . A A . 27 VAL CG2 1 1 40 25379 1 1 27 VAL H H 7.198 1.856 -12.664 1.00 . A A . 27 VAL H 1 1 40 25380 1 1 27 VAL HA H 9.868 2.978 -12.576 1.00 . A A . 27 VAL HA 1 1 40 25381 1 1 27 VAL HB H 7.850 4.195 -14.464 1.00 . A A . 27 VAL HB 1 1 40 25382 1 1 27 VAL HG11 H 10.506 4.988 -13.441 1.00 . A A . 27 VAL HG11 1 1 40 25383 1 1 27 VAL HG12 H 10.210 5.255 -15.159 1.00 . A A . 27 VAL HG12 1 1 40 25384 1 1 27 VAL HG13 H 9.143 5.981 -13.958 1.00 . A A . 27 VAL HG13 1 1 40 25385 1 1 27 VAL HG21 H 10.278 2.509 -15.059 1.00 . A A . 27 VAL HG21 1 1 40 25386 1 1 27 VAL HG22 H 8.597 2.126 -15.431 1.00 . A A . 27 VAL HG22 1 1 40 25387 1 1 27 VAL HG23 H 9.402 3.458 -16.260 1.00 . A A . 27 VAL HG23 1 1 40 25388 1 1 27 VAL N N 8.141 1.898 -12.924 1.00 . A A . 27 VAL N 1 1 40 25389 1 1 27 VAL O O 7.975 5.287 -12.111 1.00 . A A . 27 VAL O 1 1 40 25390 1 1 28 SER C C 7.070 3.518 -8.344 1.00 . A A . 28 SER C 1 1 40 25391 1 1 28 SER CA C 7.369 4.383 -9.565 1.00 . A A . 28 SER CA 1 1 40 25392 1 1 28 SER CB C 6.084 5.061 -10.050 1.00 . A A . 28 SER CB 1 1 40 25393 1 1 28 SER H H 8.181 2.647 -10.475 1.00 . A A . 28 SER H 1 1 40 25394 1 1 28 SER HA H 8.081 5.144 -9.284 1.00 . A A . 28 SER HA 1 1 40 25395 1 1 28 SER HB2 H 5.822 4.676 -11.025 1.00 . A A . 28 SER HB2 1 1 40 25396 1 1 28 SER HB3 H 5.283 4.854 -9.355 1.00 . A A . 28 SER HB3 1 1 40 25397 1 1 28 SER HG H 5.396 6.885 -10.250 1.00 . A A . 28 SER HG 1 1 40 25398 1 1 28 SER N N 7.964 3.589 -10.638 1.00 . A A . 28 SER N 1 1 40 25399 1 1 28 SER O O 5.957 3.016 -8.185 1.00 . A A . 28 SER O 1 1 40 25400 1 1 28 SER OG O 6.253 6.465 -10.147 1.00 . A A . 28 SER OG 1 1 40 25401 1 1 29 SER C C 7.529 3.426 -5.089 1.00 . A A . 29 SER C 1 1 40 25402 1 1 29 SER CA C 7.904 2.547 -6.276 1.00 . A A . 29 SER CA 1 1 40 25403 1 1 29 SER CB C 9.190 1.776 -5.971 1.00 . A A . 29 SER CB 1 1 40 25404 1 1 29 SER H H 8.931 3.776 -7.661 1.00 . A A . 29 SER H 1 1 40 25405 1 1 29 SER HA H 7.103 1.843 -6.453 1.00 . A A . 29 SER HA 1 1 40 25406 1 1 29 SER HB2 H 9.978 2.474 -5.732 1.00 . A A . 29 SER HB2 1 1 40 25407 1 1 29 SER HB3 H 9.022 1.120 -5.130 1.00 . A A . 29 SER HB3 1 1 40 25408 1 1 29 SER HG H 10.093 1.544 -7.695 1.00 . A A . 29 SER HG 1 1 40 25409 1 1 29 SER N N 8.067 3.349 -7.483 1.00 . A A . 29 SER N 1 1 40 25410 1 1 29 SER O O 8.169 4.446 -4.831 1.00 . A A . 29 SER O 1 1 40 25411 1 1 29 SER OG O 9.594 0.997 -7.084 1.00 . A A . 29 SER OG 1 1 40 25412 1 1 30 HIS C C 6.006 2.909 -1.965 1.00 . A A . 30 HIS C 1 1 40 25413 1 1 30 HIS CA C 6.016 3.781 -3.217 1.00 . A A . 30 HIS CA 1 1 40 25414 1 1 30 HIS CB C 4.617 4.334 -3.490 1.00 . A A . 30 HIS CB 1 1 40 25415 1 1 30 HIS CD2 C 5.010 5.038 -5.954 1.00 . A A . 30 HIS CD2 1 1 40 25416 1 1 30 HIS CE1 C 4.092 7.027 -5.872 1.00 . A A . 30 HIS CE1 1 1 40 25417 1 1 30 HIS CG C 4.559 5.226 -4.691 1.00 . A A . 30 HIS CG 1 1 40 25418 1 1 30 HIS H H 6.011 2.208 -4.633 1.00 . A A . 30 HIS H 1 1 40 25419 1 1 30 HIS HA H 6.695 4.606 -3.061 1.00 . A A . 30 HIS HA 1 1 40 25420 1 1 30 HIS HB2 H 3.939 3.510 -3.656 1.00 . A A . 30 HIS HB2 1 1 40 25421 1 1 30 HIS HB3 H 4.286 4.902 -2.633 1.00 . A A . 30 HIS HB3 1 1 40 25422 1 1 30 HIS HD1 H 3.571 6.909 -3.897 1.00 . A A . 30 HIS HD1 1 1 40 25423 1 1 30 HIS HD2 H 5.513 4.159 -6.330 1.00 . A A . 30 HIS HD2 1 1 40 25424 1 1 30 HIS HE1 H 3.735 8.006 -6.154 1.00 . A A . 30 HIS HE1 1 1 40 25425 1 1 30 HIS HE2 H 4.992 6.358 -7.586 1.00 . A A . 30 HIS HE2 1 1 40 25426 1 1 30 HIS N N 6.484 3.028 -4.374 1.00 . A A . 30 HIS N 1 1 40 25427 1 1 30 HIS ND1 N 3.989 6.482 -4.673 1.00 . A A . 30 HIS ND1 1 1 40 25428 1 1 30 HIS NE2 N 4.708 6.172 -6.667 1.00 . A A . 30 HIS NE2 1 1 40 25429 1 1 30 HIS O O 6.423 1.753 -2.003 1.00 . A A . 30 HIS O 1 1 40 25430 1 1 31 TYR C C 4.107 2.888 1.067 1.00 . A A . 31 TYR C 1 1 40 25431 1 1 31 TYR CA C 5.476 2.741 0.408 1.00 . A A . 31 TYR CA 1 1 40 25432 1 1 31 TYR CB C 6.569 3.238 1.356 1.00 . A A . 31 TYR CB 1 1 40 25433 1 1 31 TYR CD1 C 8.482 2.053 0.210 1.00 . A A . 31 TYR CD1 1 1 40 25434 1 1 31 TYR CD2 C 8.271 1.826 2.573 1.00 . A A . 31 TYR CD2 1 1 40 25435 1 1 31 TYR CE1 C 9.604 1.247 0.228 1.00 . A A . 31 TYR CE1 1 1 40 25436 1 1 31 TYR CE2 C 9.393 1.020 2.600 1.00 . A A . 31 TYR CE2 1 1 40 25437 1 1 31 TYR CG C 7.797 2.356 1.380 1.00 . A A . 31 TYR CG 1 1 40 25438 1 1 31 TYR CZ C 10.056 0.733 1.425 1.00 . A A . 31 TYR CZ 1 1 40 25439 1 1 31 TYR H H 5.217 4.399 -0.886 1.00 . A A . 31 TYR H 1 1 40 25440 1 1 31 TYR HA H 5.647 1.697 0.193 1.00 . A A . 31 TYR HA 1 1 40 25441 1 1 31 TYR HB2 H 6.878 4.227 1.051 1.00 . A A . 31 TYR HB2 1 1 40 25442 1 1 31 TYR HB3 H 6.173 3.284 2.360 1.00 . A A . 31 TYR HB3 1 1 40 25443 1 1 31 TYR HD1 H 8.126 2.457 -0.726 1.00 . A A . 31 TYR HD1 1 1 40 25444 1 1 31 TYR HD2 H 7.750 2.052 3.492 1.00 . A A . 31 TYR HD2 1 1 40 25445 1 1 31 TYR HE1 H 10.123 1.023 -0.692 1.00 . A A . 31 TYR HE1 1 1 40 25446 1 1 31 TYR HE2 H 9.746 0.617 3.538 1.00 . A A . 31 TYR HE2 1 1 40 25447 1 1 31 TYR HH H 11.072 -0.778 0.807 1.00 . A A . 31 TYR HH 1 1 40 25448 1 1 31 TYR N N 5.532 3.471 -0.856 1.00 . A A . 31 TYR N 1 1 40 25449 1 1 31 TYR O O 3.386 3.855 0.816 1.00 . A A . 31 TYR O 1 1 40 25450 1 1 31 TYR OH O 11.173 -0.070 1.448 1.00 . A A . 31 TYR OH 1 1 40 25451 1 1 32 CYS C C 2.655 2.373 4.057 1.00 . A A . 32 CYS C 1 1 40 25452 1 1 32 CYS CA C 2.474 1.941 2.607 1.00 . A A . 32 CYS CA 1 1 40 25453 1 1 32 CYS CB C 1.822 0.557 2.555 1.00 . A A . 32 CYS CB 1 1 40 25454 1 1 32 CYS H H 4.370 1.178 2.071 1.00 . A A . 32 CYS H 1 1 40 25455 1 1 32 CYS HA H 1.833 2.652 2.108 1.00 . A A . 32 CYS HA 1 1 40 25456 1 1 32 CYS HB2 H 2.150 0.047 1.662 1.00 . A A . 32 CYS HB2 1 1 40 25457 1 1 32 CYS HB3 H 2.131 -0.010 3.420 1.00 . A A . 32 CYS HB3 1 1 40 25458 1 1 32 CYS N N 3.754 1.922 1.911 1.00 . A A . 32 CYS N 1 1 40 25459 1 1 32 CYS O O 3.702 2.140 4.660 1.00 . A A . 32 CYS O 1 1 40 25460 1 1 32 CYS SG S -0.001 0.589 2.535 1.00 . A A . 32 CYS SG 1 1 40 25461 1 1 33 THR C C 0.747 2.615 6.875 1.00 . A A . 33 THR C 1 1 40 25462 1 1 33 THR CA C 1.667 3.459 5.996 1.00 . A A . 33 THR CA 1 1 40 25463 1 1 33 THR CB C 1.262 4.932 6.075 1.00 . A A . 33 THR CB 1 1 40 25464 1 1 33 THR CG2 C 0.009 5.252 5.288 1.00 . A A . 33 THR CG2 1 1 40 25465 1 1 33 THR H H 0.816 3.151 4.084 1.00 . A A . 33 THR H 1 1 40 25466 1 1 33 THR HA H 2.681 3.353 6.350 1.00 . A A . 33 THR HA 1 1 40 25467 1 1 33 THR HB H 2.065 5.536 5.677 1.00 . A A . 33 THR HB 1 1 40 25468 1 1 33 THR HG1 H 0.239 4.899 7.745 1.00 . A A . 33 THR HG1 1 1 40 25469 1 1 33 THR HG21 H -0.694 4.438 5.385 1.00 . A A . 33 THR HG21 1 1 40 25470 1 1 33 THR HG22 H -0.434 6.159 5.670 1.00 . A A . 33 THR HG22 1 1 40 25471 1 1 33 THR HG23 H 0.263 5.386 4.247 1.00 . A A . 33 THR HG23 1 1 40 25472 1 1 33 THR N N 1.625 2.999 4.614 1.00 . A A . 33 THR N 1 1 40 25473 1 1 33 THR O O 0.405 3.009 7.990 1.00 . A A . 33 THR O 1 1 40 25474 1 1 33 THR OG1 O 1.037 5.321 7.419 1.00 . A A . 33 THR OG1 1 1 40 25475 1 1 34 GLY C C -1.704 1.295 7.741 1.00 . A A . 34 GLY C 1 1 40 25476 1 1 34 GLY CA C -0.527 0.566 7.119 1.00 . A A . 34 GLY CA 1 1 40 25477 1 1 34 GLY H H 0.656 1.184 5.472 1.00 . A A . 34 GLY H 1 1 40 25478 1 1 34 GLY HA2 H 0.045 0.094 7.905 1.00 . A A . 34 GLY HA2 1 1 40 25479 1 1 34 GLY HA3 H -0.903 -0.199 6.456 1.00 . A A . 34 GLY HA3 1 1 40 25480 1 1 34 GLY N N 0.350 1.448 6.367 1.00 . A A . 34 GLY N 1 1 40 25481 1 1 34 GLY O O -2.117 0.981 8.857 1.00 . A A . 34 GLY O 1 1 40 25482 1 1 35 ARG C C -4.592 2.885 6.608 1.00 . A A . 35 ARG C 1 1 40 25483 1 1 35 ARG CA C -3.374 3.052 7.511 1.00 . A A . 35 ARG CA 1 1 40 25484 1 1 35 ARG CB C -2.998 4.531 7.609 1.00 . A A . 35 ARG CB 1 1 40 25485 1 1 35 ARG CD C -2.093 6.396 9.030 1.00 . A A . 35 ARG CD 1 1 40 25486 1 1 35 ARG CG C -2.291 4.894 8.905 1.00 . A A . 35 ARG CG 1 1 40 25487 1 1 35 ARG CZ C -1.531 8.050 10.768 1.00 . A A . 35 ARG CZ 1 1 40 25488 1 1 35 ARG H H -1.867 2.480 6.137 1.00 . A A . 35 ARG H 1 1 40 25489 1 1 35 ARG HA H -3.622 2.688 8.495 1.00 . A A . 35 ARG HA 1 1 40 25490 1 1 35 ARG HB2 H -2.345 4.780 6.786 1.00 . A A . 35 ARG HB2 1 1 40 25491 1 1 35 ARG HB3 H -3.897 5.125 7.537 1.00 . A A . 35 ARG HB3 1 1 40 25492 1 1 35 ARG HD2 H -1.288 6.696 8.375 1.00 . A A . 35 ARG HD2 1 1 40 25493 1 1 35 ARG HD3 H -3.004 6.892 8.729 1.00 . A A . 35 ARG HD3 1 1 40 25494 1 1 35 ARG HE H -1.716 6.086 11.074 1.00 . A A . 35 ARG HE 1 1 40 25495 1 1 35 ARG HG2 H -2.886 4.549 9.737 1.00 . A A . 35 ARG HG2 1 1 40 25496 1 1 35 ARG HG3 H -1.326 4.409 8.924 1.00 . A A . 35 ARG HG3 1 1 40 25497 1 1 35 ARG HH11 H -1.808 8.833 8.923 1.00 . A A . 35 ARG HH11 1 1 40 25498 1 1 35 ARG HH12 H -1.412 9.976 10.163 1.00 . A A . 35 ARG HH12 1 1 40 25499 1 1 35 ARG HH21 H -1.195 7.587 12.706 1.00 . A A . 35 ARG HH21 1 1 40 25500 1 1 35 ARG HH22 H -1.064 9.268 12.311 1.00 . A A . 35 ARG HH22 1 1 40 25501 1 1 35 ARG N N -2.242 2.274 7.019 1.00 . A A . 35 ARG N 1 1 40 25502 1 1 35 ARG NE N -1.765 6.793 10.397 1.00 . A A . 35 ARG NE 1 1 40 25503 1 1 35 ARG NH1 N -1.589 9.033 9.878 1.00 . A A . 35 ARG NH1 1 1 40 25504 1 1 35 ARG NH2 N -1.239 8.324 12.032 1.00 . A A . 35 ARG NH2 1 1 40 25505 1 1 35 ARG O O -5.723 2.798 7.085 1.00 . A A . 35 ARG O 1 1 40 25506 1 1 36 SER C C -4.956 1.942 3.094 1.00 . A A . 36 SER C 1 1 40 25507 1 1 36 SER CA C -5.434 2.689 4.334 1.00 . A A . 36 SER CA 1 1 40 25508 1 1 36 SER CB C -5.988 4.058 3.936 1.00 . A A . 36 SER CB 1 1 40 25509 1 1 36 SER H H -3.430 2.918 4.983 1.00 . A A . 36 SER H 1 1 40 25510 1 1 36 SER HA H -6.220 2.116 4.804 1.00 . A A . 36 SER HA 1 1 40 25511 1 1 36 SER HB2 H -5.480 4.406 3.049 1.00 . A A . 36 SER HB2 1 1 40 25512 1 1 36 SER HB3 H -7.046 3.971 3.735 1.00 . A A . 36 SER HB3 1 1 40 25513 1 1 36 SER HG H -6.443 4.858 5.666 1.00 . A A . 36 SER HG 1 1 40 25514 1 1 36 SER N N -4.353 2.843 5.302 1.00 . A A . 36 SER N 1 1 40 25515 1 1 36 SER O O -3.761 1.706 2.921 1.00 . A A . 36 SER O 1 1 40 25516 1 1 36 SER OG O -5.797 5.007 4.972 1.00 . A A . 36 SER OG 1 1 40 25517 1 1 37 CYS C C -4.997 1.787 -0.053 1.00 . A A . 37 CYS C 1 1 40 25518 1 1 37 CYS CA C -5.576 0.851 1.007 1.00 . A A . 37 CYS CA 1 1 40 25519 1 1 37 CYS CB C -6.823 0.156 0.460 1.00 . A A . 37 CYS CB 1 1 40 25520 1 1 37 CYS H H -6.836 1.788 2.425 1.00 . A A . 37 CYS H 1 1 40 25521 1 1 37 CYS HA H -4.837 0.102 1.249 1.00 . A A . 37 CYS HA 1 1 40 25522 1 1 37 CYS HB2 H -7.699 0.701 0.779 1.00 . A A . 37 CYS HB2 1 1 40 25523 1 1 37 CYS HB3 H -6.781 0.153 -0.619 1.00 . A A . 37 CYS HB3 1 1 40 25524 1 1 37 CYS N N -5.899 1.571 2.232 1.00 . A A . 37 CYS N 1 1 40 25525 1 1 37 CYS O O -4.495 1.336 -1.082 1.00 . A A . 37 CYS O 1 1 40 25526 1 1 37 CYS SG S -7.014 -1.569 1.012 1.00 . A A . 37 CYS SG 1 1 40 25527 1 1 38 GLU C C -3.036 4.180 -0.650 1.00 . A A . 38 GLU C 1 1 40 25528 1 1 38 GLU CA C -4.556 4.082 -0.737 1.00 . A A . 38 GLU CA 1 1 40 25529 1 1 38 GLU CB C -5.183 5.450 -0.461 1.00 . A A . 38 GLU CB 1 1 40 25530 1 1 38 GLU CD C -7.266 6.780 -0.985 1.00 . A A . 38 GLU CD 1 1 40 25531 1 1 38 GLU CG C -6.701 5.448 -0.530 1.00 . A A . 38 GLU CG 1 1 40 25532 1 1 38 GLU H H -5.486 3.394 1.036 1.00 . A A . 38 GLU H 1 1 40 25533 1 1 38 GLU HA H -4.827 3.766 -1.733 1.00 . A A . 38 GLU HA 1 1 40 25534 1 1 38 GLU HB2 H -4.889 5.775 0.526 1.00 . A A . 38 GLU HB2 1 1 40 25535 1 1 38 GLU HB3 H -4.812 6.156 -1.189 1.00 . A A . 38 GLU HB3 1 1 40 25536 1 1 38 GLU HG2 H -7.017 4.685 -1.227 1.00 . A A . 38 GLU HG2 1 1 40 25537 1 1 38 GLU HG3 H -7.093 5.223 0.451 1.00 . A A . 38 GLU HG3 1 1 40 25538 1 1 38 GLU N N -5.072 3.091 0.201 1.00 . A A . 38 GLU N 1 1 40 25539 1 1 38 GLU O O -2.484 4.511 0.399 1.00 . A A . 38 GLU O 1 1 40 25540 1 1 38 GLU OE1 O -7.708 6.871 -2.149 1.00 . A A . 38 GLU OE1 1 1 40 25541 1 1 38 GLU OE2 O -7.265 7.731 -0.176 1.00 . A A . 38 GLU OE2 1 1 40 25542 1 1 39 CYS C C -0.441 5.372 -2.144 1.00 . A A . 39 CYS C 1 1 40 25543 1 1 39 CYS CA C -0.909 3.954 -1.817 1.00 . A A . 39 CYS CA 1 1 40 25544 1 1 39 CYS CB C -0.379 2.969 -2.862 1.00 . A A . 39 CYS CB 1 1 40 25545 1 1 39 CYS H H -2.863 3.640 -2.567 1.00 . A A . 39 CYS H 1 1 40 25546 1 1 39 CYS HA H -0.530 3.674 -0.847 1.00 . A A . 39 CYS HA 1 1 40 25547 1 1 39 CYS HB2 H -0.700 1.972 -2.600 1.00 . A A . 39 CYS HB2 1 1 40 25548 1 1 39 CYS HB3 H -0.788 3.229 -3.828 1.00 . A A . 39 CYS HB3 1 1 40 25549 1 1 39 CYS N N -2.365 3.894 -1.762 1.00 . A A . 39 CYS N 1 1 40 25550 1 1 39 CYS O O -0.685 5.874 -3.240 1.00 . A A . 39 CYS O 1 1 40 25551 1 1 39 CYS SG S 1.437 2.939 -3.020 1.00 . A A . 39 CYS SG 1 1 40 25552 1 1 40 PRO C C 1.385 7.609 -2.751 1.00 . A A . 40 PRO C 1 1 40 25553 1 1 40 PRO CA C 0.732 7.409 -1.387 1.00 . A A . 40 PRO CA 1 1 40 25554 1 1 40 PRO CB C 1.762 7.564 -0.271 1.00 . A A . 40 PRO CB 1 1 40 25555 1 1 40 PRO CD C 0.574 5.525 0.150 1.00 . A A . 40 PRO CD 1 1 40 25556 1 1 40 PRO CG C 1.260 6.686 0.823 1.00 . A A . 40 PRO CG 1 1 40 25557 1 1 40 PRO HA H -0.056 8.136 -1.257 1.00 . A A . 40 PRO HA 1 1 40 25558 1 1 40 PRO HB2 H 2.731 7.244 -0.624 1.00 . A A . 40 PRO HB2 1 1 40 25559 1 1 40 PRO HB3 H 1.807 8.597 0.041 1.00 . A A . 40 PRO HB3 1 1 40 25560 1 1 40 PRO HD2 H 1.245 4.682 0.080 1.00 . A A . 40 PRO HD2 1 1 40 25561 1 1 40 PRO HD3 H -0.320 5.252 0.692 1.00 . A A . 40 PRO HD3 1 1 40 25562 1 1 40 PRO HG2 H 2.088 6.336 1.421 1.00 . A A . 40 PRO HG2 1 1 40 25563 1 1 40 PRO HG3 H 0.558 7.231 1.436 1.00 . A A . 40 PRO HG3 1 1 40 25564 1 1 40 PRO N N 0.238 6.043 -1.192 1.00 . A A . 40 PRO N 1 1 40 25565 1 1 40 PRO O O 1.727 6.644 -3.434 1.00 . A A . 40 PRO O 1 1 40 25566 1 1 41 SER C C 3.621 9.605 -4.247 1.00 . A A . 41 SER C 1 1 40 25567 1 1 41 SER CA C 2.162 9.197 -4.424 1.00 . A A . 41 SER CA 1 1 40 25568 1 1 41 SER CB C 1.385 10.323 -5.108 1.00 . A A . 41 SER CB 1 1 40 25569 1 1 41 SER H H 1.257 9.594 -2.553 1.00 . A A . 41 SER H 1 1 40 25570 1 1 41 SER HA H 2.121 8.315 -5.045 1.00 . A A . 41 SER HA 1 1 40 25571 1 1 41 SER HB2 H 0.927 10.949 -4.357 1.00 . A A . 41 SER HB2 1 1 40 25572 1 1 41 SER HB3 H 2.064 10.915 -5.704 1.00 . A A . 41 SER HB3 1 1 40 25573 1 1 41 SER HG H -0.458 10.254 -5.767 1.00 . A A . 41 SER HG 1 1 40 25574 1 1 41 SER N N 1.552 8.868 -3.141 1.00 . A A . 41 SER N 1 1 40 25575 1 1 41 SER O O 4.152 10.397 -5.025 1.00 . A A . 41 SER O 1 1 40 25576 1 1 41 SER OG O 0.370 9.804 -5.950 1.00 . A A . 41 SER OG 1 1 40 25577 1 1 42 TYR C C 6.456 8.096 -2.657 1.00 . A A . 42 TYR C 1 1 40 25578 1 1 42 TYR CA C 5.663 9.369 -2.944 1.00 . A A . 42 TYR CA 1 1 40 25579 1 1 42 TYR CB C 5.771 10.333 -1.760 1.00 . A A . 42 TYR CB 1 1 40 25580 1 1 42 TYR CD1 C 6.190 8.842 0.234 1.00 . A A . 42 TYR CD1 1 1 40 25581 1 1 42 TYR CD2 C 4.128 10.034 0.135 1.00 . A A . 42 TYR CD2 1 1 40 25582 1 1 42 TYR CE1 C 5.815 8.284 1.441 1.00 . A A . 42 TYR CE1 1 1 40 25583 1 1 42 TYR CE2 C 3.746 9.480 1.342 1.00 . A A . 42 TYR CE2 1 1 40 25584 1 1 42 TYR CG C 5.355 9.725 -0.439 1.00 . A A . 42 TYR CG 1 1 40 25585 1 1 42 TYR CZ C 4.592 8.606 1.991 1.00 . A A . 42 TYR CZ 1 1 40 25586 1 1 42 TYR H H 3.789 8.435 -2.634 1.00 . A A . 42 TYR H 1 1 40 25587 1 1 42 TYR HA H 6.074 9.845 -3.822 1.00 . A A . 42 TYR HA 1 1 40 25588 1 1 42 TYR HB2 H 6.795 10.661 -1.664 1.00 . A A . 42 TYR HB2 1 1 40 25589 1 1 42 TYR HB3 H 5.140 11.190 -1.944 1.00 . A A . 42 TYR HB3 1 1 40 25590 1 1 42 TYR HD1 H 7.147 8.592 -0.199 1.00 . A A . 42 TYR HD1 1 1 40 25591 1 1 42 TYR HD2 H 3.467 10.719 -0.376 1.00 . A A . 42 TYR HD2 1 1 40 25592 1 1 42 TYR HE1 H 6.478 7.600 1.949 1.00 . A A . 42 TYR HE1 1 1 40 25593 1 1 42 TYR HE2 H 2.788 9.733 1.773 1.00 . A A . 42 TYR HE2 1 1 40 25594 1 1 42 TYR HH H 4.702 8.472 3.906 1.00 . A A . 42 TYR HH 1 1 40 25595 1 1 42 TYR N N 4.265 9.060 -3.219 1.00 . A A . 42 TYR N 1 1 40 25596 1 1 42 TYR O O 5.927 7.139 -2.091 1.00 . A A . 42 TYR O 1 1 40 25597 1 1 42 TYR OH O 4.215 8.053 3.193 1.00 . A A . 42 TYR OH 1 1 40 25598 1 1 43 PRO C C 9.025 6.757 -1.369 1.00 . A A . 43 PRO C 1 1 40 25599 1 1 43 PRO CA C 8.607 6.903 -2.828 1.00 . A A . 43 PRO CA 1 1 40 25600 1 1 43 PRO CB C 9.822 7.200 -3.706 1.00 . A A . 43 PRO CB 1 1 40 25601 1 1 43 PRO CD C 8.456 9.164 -3.729 1.00 . A A . 43 PRO CD 1 1 40 25602 1 1 43 PRO CG C 9.883 8.687 -3.768 1.00 . A A . 43 PRO CG 1 1 40 25603 1 1 43 PRO HA H 8.134 5.990 -3.159 1.00 . A A . 43 PRO HA 1 1 40 25604 1 1 43 PRO HB2 H 10.710 6.785 -3.250 1.00 . A A . 43 PRO HB2 1 1 40 25605 1 1 43 PRO HB3 H 9.678 6.770 -4.685 1.00 . A A . 43 PRO HB3 1 1 40 25606 1 1 43 PRO HD2 H 8.381 10.081 -3.165 1.00 . A A . 43 PRO HD2 1 1 40 25607 1 1 43 PRO HD3 H 8.078 9.303 -4.731 1.00 . A A . 43 PRO HD3 1 1 40 25608 1 1 43 PRO HG2 H 10.429 9.067 -2.917 1.00 . A A . 43 PRO HG2 1 1 40 25609 1 1 43 PRO HG3 H 10.357 8.997 -4.688 1.00 . A A . 43 PRO HG3 1 1 40 25610 1 1 43 PRO N N 7.743 8.066 -3.047 1.00 . A A . 43 PRO N 1 1 40 25611 1 1 43 PRO O O 9.174 7.748 -0.654 1.00 . A A . 43 PRO O 1 1 40 25612 1 1 44 GLY C C 10.937 5.917 0.786 1.00 . A A . 44 GLY C 1 1 40 25613 1 1 44 GLY CA C 9.614 5.264 0.438 1.00 . A A . 44 GLY CA 1 1 40 25614 1 1 44 GLY H H 9.080 4.765 -1.549 1.00 . A A . 44 GLY H 1 1 40 25615 1 1 44 GLY HA2 H 9.701 4.198 0.586 1.00 . A A . 44 GLY HA2 1 1 40 25616 1 1 44 GLY HA3 H 8.851 5.647 1.100 1.00 . A A . 44 GLY HA3 1 1 40 25617 1 1 44 GLY N N 9.214 5.516 -0.934 1.00 . A A . 44 GLY N 1 1 40 25618 1 1 44 GLY O O 11.993 5.476 0.332 1.00 . A A . 44 GLY O 1 1 40 25619 1 1 45 ASN C C 12.640 7.118 3.302 1.00 . A A . 45 ASN C 1 1 40 25620 1 1 45 ASN CA C 12.083 7.687 2.001 1.00 . A A . 45 ASN CA 1 1 40 25621 1 1 45 ASN CB C 11.783 9.177 2.170 1.00 . A A . 45 ASN CB 1 1 40 25622 1 1 45 ASN CG C 13.029 10.035 2.056 1.00 . A A . 45 ASN CG 1 1 40 25623 1 1 45 ASN H H 10.009 7.276 1.921 1.00 . A A . 45 ASN H 1 1 40 25624 1 1 45 ASN HA H 12.822 7.564 1.223 1.00 . A A . 45 ASN HA 1 1 40 25625 1 1 45 ASN HB2 H 11.085 9.487 1.407 1.00 . A A . 45 ASN HB2 1 1 40 25626 1 1 45 ASN HB3 H 11.343 9.341 3.143 1.00 . A A . 45 ASN HB3 1 1 40 25627 1 1 45 ASN HD21 H 12.850 10.075 0.076 1.00 . A A . 45 ASN HD21 1 1 40 25628 1 1 45 ASN HD22 H 14.197 10.939 0.726 1.00 . A A . 45 ASN HD22 1 1 40 25629 1 1 45 ASN N N 10.880 6.972 1.593 1.00 . A A . 45 ASN N 1 1 40 25630 1 1 45 ASN ND2 N 13.395 10.385 0.829 1.00 . A A . 45 ASN ND2 1 1 40 25631 1 1 45 ASN O O 13.802 6.718 3.369 1.00 . A A . 45 ASN O 1 1 40 25632 1 1 45 ASN OD1 O 13.654 10.379 3.059 1.00 . A A . 45 ASN OD1 1 1 40 25633 1 1 46 GLY C C 11.682 7.365 6.781 1.00 . A A . 46 GLY C 1 1 40 25634 1 1 46 GLY CA C 12.229 6.561 5.618 1.00 . A A . 46 GLY CA 1 1 40 25635 1 1 46 GLY H H 10.887 7.416 4.221 1.00 . A A . 46 GLY H 1 1 40 25636 1 1 46 GLY HA2 H 13.308 6.577 5.660 1.00 . A A . 46 GLY HA2 1 1 40 25637 1 1 46 GLY HA3 H 11.890 5.540 5.709 1.00 . A A . 46 GLY HA3 1 1 40 25638 1 1 46 GLY N N 11.802 7.084 4.333 1.00 . A A . 46 GLY N 1 1 40 25639 1 1 46 GLY O O 12.428 7.576 7.760 1.00 . A A . 46 GLY O 1 1 40 25640 1 1 46 GLY OXT O 10.507 7.784 6.713 1.00 . A A . 46 GLY OXT 1 1 41 25641 1 1 1 ALA C C -15.250 -7.278 9.119 1.00 . A A . 1 ALA C 1 1 41 25642 1 1 1 ALA CA C -15.686 -8.717 9.370 1.00 . A A . 1 ALA CA 1 1 41 25643 1 1 1 ALA CB C -17.066 -8.960 8.777 1.00 . A A . 1 ALA CB 1 1 41 25644 1 1 1 ALA H1 H -14.849 -8.583 11.244 1.00 . A A . 1 ALA H1 1 1 41 25645 1 1 1 ALA H2 H -16.564 -8.642 11.228 1.00 . A A . 1 ALA H2 1 1 41 25646 1 1 1 ALA H3 H -15.651 -10.063 10.925 1.00 . A A . 1 ALA H3 1 1 41 25647 1 1 1 ALA HA H -14.990 -9.383 8.880 1.00 . A A . 1 ALA HA 1 1 41 25648 1 1 1 ALA HB1 H -17.172 -10.006 8.528 1.00 . A A . 1 ALA HB1 1 1 41 25649 1 1 1 ALA HB2 H -17.821 -8.684 9.498 1.00 . A A . 1 ALA HB2 1 1 41 25650 1 1 1 ALA HB3 H -17.185 -8.364 7.884 1.00 . A A . 1 ALA HB3 1 1 41 25651 1 1 1 ALA N N -15.688 -9.029 10.822 1.00 . A A . 1 ALA N 1 1 41 25652 1 1 1 ALA O O -15.734 -6.350 9.767 1.00 . A A . 1 ALA O 1 1 41 25653 1 1 2 MET C C -13.766 -5.581 6.328 1.00 . A A . 2 MET C 1 1 41 25654 1 1 2 MET CA C -13.829 -5.772 7.840 1.00 . A A . 2 MET CA 1 1 41 25655 1 1 2 MET CB C -12.443 -5.558 8.451 1.00 . A A . 2 MET CB 1 1 41 25656 1 1 2 MET CE C -9.727 -4.923 10.153 1.00 . A A . 2 MET CE 1 1 41 25657 1 1 2 MET CG C -12.482 -5.045 9.881 1.00 . A A . 2 MET CG 1 1 41 25658 1 1 2 MET H H -13.983 -7.878 7.694 1.00 . A A . 2 MET H 1 1 41 25659 1 1 2 MET HA H -14.512 -5.045 8.254 1.00 . A A . 2 MET HA 1 1 41 25660 1 1 2 MET HB2 H -11.910 -6.497 8.443 1.00 . A A . 2 MET HB2 1 1 41 25661 1 1 2 MET HB3 H -11.904 -4.842 7.849 1.00 . A A . 2 MET HB3 1 1 41 25662 1 1 2 MET HE1 H -10.045 -4.333 9.306 1.00 . A A . 2 MET HE1 1 1 41 25663 1 1 2 MET HE2 H -9.251 -4.282 10.881 1.00 . A A . 2 MET HE2 1 1 41 25664 1 1 2 MET HE3 H -9.026 -5.676 9.824 1.00 . A A . 2 MET HE3 1 1 41 25665 1 1 2 MET HG2 H -12.396 -3.969 9.866 1.00 . A A . 2 MET HG2 1 1 41 25666 1 1 2 MET HG3 H -13.428 -5.322 10.323 1.00 . A A . 2 MET HG3 1 1 41 25667 1 1 2 MET N N -14.331 -7.099 8.176 1.00 . A A . 2 MET N 1 1 41 25668 1 1 2 MET O O -13.437 -6.508 5.588 1.00 . A A . 2 MET O 1 1 41 25669 1 1 2 MET SD S -11.151 -5.715 10.896 1.00 . A A . 2 MET SD 1 1 41 25670 1 1 3 ASP C C -12.635 -3.818 3.968 1.00 . A A . 3 ASP C 1 1 41 25671 1 1 3 ASP CA C -14.062 -4.060 4.451 1.00 . A A . 3 ASP CA 1 1 41 25672 1 1 3 ASP CB C -14.925 -2.830 4.165 1.00 . A A . 3 ASP CB 1 1 41 25673 1 1 3 ASP CG C -14.462 -1.607 4.933 1.00 . A A . 3 ASP CG 1 1 41 25674 1 1 3 ASP H H -14.337 -3.674 6.514 1.00 . A A . 3 ASP H 1 1 41 25675 1 1 3 ASP HA H -14.470 -4.906 3.920 1.00 . A A . 3 ASP HA 1 1 41 25676 1 1 3 ASP HB2 H -14.883 -2.605 3.109 1.00 . A A . 3 ASP HB2 1 1 41 25677 1 1 3 ASP HB3 H -15.947 -3.042 4.443 1.00 . A A . 3 ASP HB3 1 1 41 25678 1 1 3 ASP N N -14.083 -4.372 5.875 1.00 . A A . 3 ASP N 1 1 41 25679 1 1 3 ASP O O -11.699 -3.771 4.766 1.00 . A A . 3 ASP O 1 1 41 25680 1 1 3 ASP OD1 O -13.370 -1.088 4.621 1.00 . A A . 3 ASP OD1 1 1 41 25681 1 1 3 ASP OD2 O -15.193 -1.169 5.847 1.00 . A A . 3 ASP OD2 1 1 41 25682 1 1 4 CYS C C -11.249 -2.417 0.930 1.00 . A A . 4 CYS C 1 1 41 25683 1 1 4 CYS CA C -11.165 -3.427 2.068 1.00 . A A . 4 CYS CA 1 1 41 25684 1 1 4 CYS CB C -10.562 -4.733 1.555 1.00 . A A . 4 CYS CB 1 1 41 25685 1 1 4 CYS H H -13.263 -3.712 2.073 1.00 . A A . 4 CYS H 1 1 41 25686 1 1 4 CYS HA H -10.522 -3.029 2.839 1.00 . A A . 4 CYS HA 1 1 41 25687 1 1 4 CYS HB2 H -9.793 -4.504 0.832 1.00 . A A . 4 CYS HB2 1 1 41 25688 1 1 4 CYS HB3 H -10.119 -5.264 2.384 1.00 . A A . 4 CYS HB3 1 1 41 25689 1 1 4 CYS N N -12.478 -3.664 2.658 1.00 . A A . 4 CYS N 1 1 41 25690 1 1 4 CYS O O -12.193 -2.431 0.140 1.00 . A A . 4 CYS O 1 1 41 25691 1 1 4 CYS SG S -11.754 -5.854 0.752 1.00 . A A . 4 CYS SG 1 1 41 25692 1 1 5 THR C C -9.265 -0.958 -1.314 1.00 . A A . 5 THR C 1 1 41 25693 1 1 5 THR CA C -10.204 -0.527 -0.191 1.00 . A A . 5 THR CA 1 1 41 25694 1 1 5 THR CB C -9.752 0.810 0.399 1.00 . A A . 5 THR CB 1 1 41 25695 1 1 5 THR CG2 C -9.609 1.908 -0.634 1.00 . A A . 5 THR CG2 1 1 41 25696 1 1 5 THR H H -9.526 -1.587 1.510 1.00 . A A . 5 THR H 1 1 41 25697 1 1 5 THR HA H -11.197 -0.417 -0.592 1.00 . A A . 5 THR HA 1 1 41 25698 1 1 5 THR HB H -8.792 0.674 0.875 1.00 . A A . 5 THR HB 1 1 41 25699 1 1 5 THR HG1 H -10.420 0.914 2.237 1.00 . A A . 5 THR HG1 1 1 41 25700 1 1 5 THR HG21 H -10.373 1.793 -1.389 1.00 . A A . 5 THR HG21 1 1 41 25701 1 1 5 THR HG22 H -9.719 2.870 -0.155 1.00 . A A . 5 THR HG22 1 1 41 25702 1 1 5 THR HG23 H -8.635 1.845 -1.095 1.00 . A A . 5 THR HG23 1 1 41 25703 1 1 5 THR N N -10.251 -1.544 0.852 1.00 . A A . 5 THR N 1 1 41 25704 1 1 5 THR O O -8.259 -0.302 -1.581 1.00 . A A . 5 THR O 1 1 41 25705 1 1 5 THR OG1 O -10.672 1.260 1.378 1.00 . A A . 5 THR OG1 1 1 41 25706 1 1 6 THR C C -8.042 -1.546 -3.817 1.00 . A A . 6 THR C 1 1 41 25707 1 1 6 THR CA C -8.809 -2.629 -3.060 1.00 . A A . 6 THR CA 1 1 41 25708 1 1 6 THR CB C -9.709 -3.401 -4.027 1.00 . A A . 6 THR CB 1 1 41 25709 1 1 6 THR CG2 C -9.766 -4.885 -3.734 1.00 . A A . 6 THR CG2 1 1 41 25710 1 1 6 THR H H -10.423 -2.544 -1.688 1.00 . A A . 6 THR H 1 1 41 25711 1 1 6 THR HA H -8.096 -3.316 -2.630 1.00 . A A . 6 THR HA 1 1 41 25712 1 1 6 THR HB H -9.332 -3.276 -5.032 1.00 . A A . 6 THR HB 1 1 41 25713 1 1 6 THR HG1 H -11.547 -3.294 -4.695 1.00 . A A . 6 THR HG1 1 1 41 25714 1 1 6 THR HG21 H -8.927 -5.162 -3.114 1.00 . A A . 6 THR HG21 1 1 41 25715 1 1 6 THR HG22 H -10.687 -5.115 -3.219 1.00 . A A . 6 THR HG22 1 1 41 25716 1 1 6 THR HG23 H -9.726 -5.436 -4.662 1.00 . A A . 6 THR HG23 1 1 41 25717 1 1 6 THR N N -9.607 -2.074 -1.961 1.00 . A A . 6 THR N 1 1 41 25718 1 1 6 THR O O -8.637 -0.649 -4.415 1.00 . A A . 6 THR O 1 1 41 25719 1 1 6 THR OG1 O -11.034 -2.902 -3.984 1.00 . A A . 6 THR OG1 1 1 41 25720 1 1 7 GLY C C -4.417 -1.058 -4.462 1.00 . A A . 7 GLY C 1 1 41 25721 1 1 7 GLY CA C -5.883 -0.664 -4.456 1.00 . A A . 7 GLY CA 1 1 41 25722 1 1 7 GLY H H -6.301 -2.373 -3.284 1.00 . A A . 7 GLY H 1 1 41 25723 1 1 7 GLY HA2 H -5.986 0.289 -3.959 1.00 . A A . 7 GLY HA2 1 1 41 25724 1 1 7 GLY HA3 H -6.222 -0.564 -5.477 1.00 . A A . 7 GLY HA3 1 1 41 25725 1 1 7 GLY N N -6.716 -1.637 -3.779 1.00 . A A . 7 GLY N 1 1 41 25726 1 1 7 GLY O O -4.092 -2.245 -4.509 1.00 . A A . 7 GLY O 1 1 41 25727 1 1 8 PRO C C -1.500 -0.682 -3.054 1.00 . A A . 8 PRO C 1 1 41 25728 1 1 8 PRO CA C -2.060 -0.336 -4.433 1.00 . A A . 8 PRO CA 1 1 41 25729 1 1 8 PRO CB C -1.486 0.990 -4.923 1.00 . A A . 8 PRO CB 1 1 41 25730 1 1 8 PRO CD C -3.795 1.370 -4.378 1.00 . A A . 8 PRO CD 1 1 41 25731 1 1 8 PRO CG C -2.434 2.019 -4.409 1.00 . A A . 8 PRO CG 1 1 41 25732 1 1 8 PRO HA H -1.804 -1.120 -5.131 1.00 . A A . 8 PRO HA 1 1 41 25733 1 1 8 PRO HB2 H -0.493 1.128 -4.519 1.00 . A A . 8 PRO HB2 1 1 41 25734 1 1 8 PRO HB3 H -1.447 0.994 -6.002 1.00 . A A . 8 PRO HB3 1 1 41 25735 1 1 8 PRO HD2 H -4.314 1.628 -3.467 1.00 . A A . 8 PRO HD2 1 1 41 25736 1 1 8 PRO HD3 H -4.374 1.670 -5.239 1.00 . A A . 8 PRO HD3 1 1 41 25737 1 1 8 PRO HG2 H -2.141 2.321 -3.414 1.00 . A A . 8 PRO HG2 1 1 41 25738 1 1 8 PRO HG3 H -2.442 2.872 -5.072 1.00 . A A . 8 PRO HG3 1 1 41 25739 1 1 8 PRO N N -3.500 -0.076 -4.422 1.00 . A A . 8 PRO N 1 1 41 25740 1 1 8 PRO O O -0.426 -1.272 -2.944 1.00 . A A . 8 PRO O 1 1 41 25741 1 1 9 CYS C C -2.590 -1.699 0.006 1.00 . A A . 9 CYS C 1 1 41 25742 1 1 9 CYS CA C -1.777 -0.575 -0.637 1.00 . A A . 9 CYS CA 1 1 41 25743 1 1 9 CYS CB C -1.869 0.696 0.212 1.00 . A A . 9 CYS CB 1 1 41 25744 1 1 9 CYS H H -3.070 0.168 -2.145 1.00 . A A . 9 CYS H 1 1 41 25745 1 1 9 CYS HA H -0.744 -0.885 -0.687 1.00 . A A . 9 CYS HA 1 1 41 25746 1 1 9 CYS HB2 H -2.285 1.492 -0.387 1.00 . A A . 9 CYS HB2 1 1 41 25747 1 1 9 CYS HB3 H -2.516 0.513 1.056 1.00 . A A . 9 CYS HB3 1 1 41 25748 1 1 9 CYS N N -2.224 -0.305 -2.002 1.00 . A A . 9 CYS N 1 1 41 25749 1 1 9 CYS O O -2.947 -1.626 1.182 1.00 . A A . 9 CYS O 1 1 41 25750 1 1 9 CYS SG S -0.268 1.273 0.860 1.00 . A A . 9 CYS SG 1 1 41 25751 1 1 10 CYS C C -3.882 -4.896 -1.385 1.00 . A A . 10 CYS C 1 1 41 25752 1 1 10 CYS CA C -3.633 -3.886 -0.271 1.00 . A A . 10 CYS CA 1 1 41 25753 1 1 10 CYS CB C -4.965 -3.432 0.330 1.00 . A A . 10 CYS CB 1 1 41 25754 1 1 10 CYS H H -2.554 -2.747 -1.696 1.00 . A A . 10 CYS H 1 1 41 25755 1 1 10 CYS HA H -3.046 -4.360 0.502 1.00 . A A . 10 CYS HA 1 1 41 25756 1 1 10 CYS HB2 H -5.607 -4.291 0.452 1.00 . A A . 10 CYS HB2 1 1 41 25757 1 1 10 CYS HB3 H -4.781 -2.987 1.298 1.00 . A A . 10 CYS HB3 1 1 41 25758 1 1 10 CYS N N -2.872 -2.742 -0.769 1.00 . A A . 10 CYS N 1 1 41 25759 1 1 10 CYS O O -3.495 -4.678 -2.533 1.00 . A A . 10 CYS O 1 1 41 25760 1 1 10 CYS SG S -5.863 -2.211 -0.678 1.00 . A A . 10 CYS SG 1 1 41 25761 1 1 11 ARG C C -5.577 -8.207 -1.348 1.00 . A A . 11 ARG C 1 1 41 25762 1 1 11 ARG CA C -4.831 -7.051 -2.007 1.00 . A A . 11 ARG CA 1 1 41 25763 1 1 11 ARG CB C -3.543 -7.565 -2.654 1.00 . A A . 11 ARG CB 1 1 41 25764 1 1 11 ARG CD C -1.312 -8.664 -2.294 1.00 . A A . 11 ARG CD 1 1 41 25765 1 1 11 ARG CG C -2.441 -7.873 -1.653 1.00 . A A . 11 ARG CG 1 1 41 25766 1 1 11 ARG CZ C 0.076 -8.573 -4.328 1.00 . A A . 11 ARG CZ 1 1 41 25767 1 1 11 ARG H H -4.812 -6.118 -0.106 1.00 . A A . 11 ARG H 1 1 41 25768 1 1 11 ARG HA H -5.461 -6.622 -2.773 1.00 . A A . 11 ARG HA 1 1 41 25769 1 1 11 ARG HB2 H -3.764 -8.468 -3.202 1.00 . A A . 11 ARG HB2 1 1 41 25770 1 1 11 ARG HB3 H -3.176 -6.817 -3.342 1.00 . A A . 11 ARG HB3 1 1 41 25771 1 1 11 ARG HD2 H -0.505 -8.755 -1.582 1.00 . A A . 11 ARG HD2 1 1 41 25772 1 1 11 ARG HD3 H -1.678 -9.647 -2.549 1.00 . A A . 11 ARG HD3 1 1 41 25773 1 1 11 ARG HE H -1.143 -7.119 -3.709 1.00 . A A . 11 ARG HE 1 1 41 25774 1 1 11 ARG HG2 H -2.045 -6.944 -1.271 1.00 . A A . 11 ARG HG2 1 1 41 25775 1 1 11 ARG HG3 H -2.858 -8.450 -0.841 1.00 . A A . 11 ARG HG3 1 1 41 25776 1 1 11 ARG HH11 H 0.252 -10.288 -3.269 1.00 . A A . 11 ARG HH11 1 1 41 25777 1 1 11 ARG HH12 H 1.217 -10.200 -4.704 1.00 . A A . 11 ARG HH12 1 1 41 25778 1 1 11 ARG HH21 H 0.125 -7.002 -5.597 1.00 . A A . 11 ARG HH21 1 1 41 25779 1 1 11 ARG HH22 H 1.146 -8.334 -6.026 1.00 . A A . 11 ARG HH22 1 1 41 25780 1 1 11 ARG N N -4.530 -6.003 -1.037 1.00 . A A . 11 ARG N 1 1 41 25781 1 1 11 ARG NE N -0.807 -8.016 -3.502 1.00 . A A . 11 ARG NE 1 1 41 25782 1 1 11 ARG NH1 N 0.554 -9.787 -4.079 1.00 . A A . 11 ARG NH1 1 1 41 25783 1 1 11 ARG NH2 N 0.482 -7.916 -5.405 1.00 . A A . 11 ARG NH2 1 1 41 25784 1 1 11 ARG O O -6.455 -8.818 -1.956 1.00 . A A . 11 ARG O 1 1 41 25785 1 1 12 GLN C C -7.151 -9.124 1.307 1.00 . A A . 12 GLN C 1 1 41 25786 1 1 12 GLN CA C -5.855 -9.586 0.639 1.00 . A A . 12 GLN CA 1 1 41 25787 1 1 12 GLN CB C -4.896 -10.139 1.694 1.00 . A A . 12 GLN CB 1 1 41 25788 1 1 12 GLN CD C -3.316 -12.079 2.035 1.00 . A A . 12 GLN CD 1 1 41 25789 1 1 12 GLN CG C -3.759 -10.962 1.111 1.00 . A A . 12 GLN CG 1 1 41 25790 1 1 12 GLN H H -4.511 -7.980 0.330 1.00 . A A . 12 GLN H 1 1 41 25791 1 1 12 GLN HA H -6.090 -10.371 -0.064 1.00 . A A . 12 GLN HA 1 1 41 25792 1 1 12 GLN HB2 H -4.469 -9.312 2.243 1.00 . A A . 12 GLN HB2 1 1 41 25793 1 1 12 GLN HB3 H -5.452 -10.764 2.377 1.00 . A A . 12 GLN HB3 1 1 41 25794 1 1 12 GLN HE21 H -1.505 -11.272 2.183 1.00 . A A . 12 GLN HE21 1 1 41 25795 1 1 12 GLN HE22 H -1.751 -12.731 3.074 1.00 . A A . 12 GLN HE22 1 1 41 25796 1 1 12 GLN HG2 H -4.088 -11.396 0.179 1.00 . A A . 12 GLN HG2 1 1 41 25797 1 1 12 GLN HG3 H -2.917 -10.311 0.927 1.00 . A A . 12 GLN HG3 1 1 41 25798 1 1 12 GLN N N -5.220 -8.502 -0.102 1.00 . A A . 12 GLN N 1 1 41 25799 1 1 12 GLN NE2 N -2.064 -12.022 2.475 1.00 . A A . 12 GLN NE2 1 1 41 25800 1 1 12 GLN O O -7.764 -9.875 2.066 1.00 . A A . 12 GLN O 1 1 41 25801 1 1 12 GLN OE1 O -4.089 -12.984 2.351 1.00 . A A . 12 GLN OE1 1 1 41 25802 1 1 13 CYS C C -8.637 -7.117 3.097 1.00 . A A . 13 CYS C 1 1 41 25803 1 1 13 CYS CA C -8.787 -7.339 1.595 1.00 . A A . 13 CYS CA 1 1 41 25804 1 1 13 CYS CB C -9.979 -8.259 1.313 1.00 . A A . 13 CYS CB 1 1 41 25805 1 1 13 CYS H H -7.040 -7.334 0.413 1.00 . A A . 13 CYS H 1 1 41 25806 1 1 13 CYS HA H -8.963 -6.387 1.123 1.00 . A A . 13 CYS HA 1 1 41 25807 1 1 13 CYS HB2 H -10.028 -8.457 0.253 1.00 . A A . 13 CYS HB2 1 1 41 25808 1 1 13 CYS HB3 H -9.839 -9.191 1.841 1.00 . A A . 13 CYS HB3 1 1 41 25809 1 1 13 CYS N N -7.566 -7.890 1.022 1.00 . A A . 13 CYS N 1 1 41 25810 1 1 13 CYS O O -9.533 -7.444 3.876 1.00 . A A . 13 CYS O 1 1 41 25811 1 1 13 CYS SG S -11.591 -7.574 1.820 1.00 . A A . 13 CYS SG 1 1 41 25812 1 1 14 LYS C C -6.040 -5.370 5.084 1.00 . A A . 14 LYS C 1 1 41 25813 1 1 14 LYS CA C -7.246 -6.281 4.909 1.00 . A A . 14 LYS CA 1 1 41 25814 1 1 14 LYS CB C -7.042 -7.587 5.679 1.00 . A A . 14 LYS CB 1 1 41 25815 1 1 14 LYS CD C -8.702 -9.472 5.527 1.00 . A A . 14 LYS CD 1 1 41 25816 1 1 14 LYS CE C -7.980 -10.663 6.137 1.00 . A A . 14 LYS CE 1 1 41 25817 1 1 14 LYS CG C -8.332 -8.176 6.231 1.00 . A A . 14 LYS CG 1 1 41 25818 1 1 14 LYS H H -6.826 -6.307 2.833 1.00 . A A . 14 LYS H 1 1 41 25819 1 1 14 LYS HA H -8.111 -5.771 5.300 1.00 . A A . 14 LYS HA 1 1 41 25820 1 1 14 LYS HB2 H -6.591 -8.314 5.020 1.00 . A A . 14 LYS HB2 1 1 41 25821 1 1 14 LYS HB3 H -6.374 -7.403 6.507 1.00 . A A . 14 LYS HB3 1 1 41 25822 1 1 14 LYS HD2 H -9.767 -9.627 5.614 1.00 . A A . 14 LYS HD2 1 1 41 25823 1 1 14 LYS HD3 H -8.431 -9.394 4.484 1.00 . A A . 14 LYS HD3 1 1 41 25824 1 1 14 LYS HE2 H -7.747 -10.437 7.167 1.00 . A A . 14 LYS HE2 1 1 41 25825 1 1 14 LYS HE3 H -8.634 -11.522 6.098 1.00 . A A . 14 LYS HE3 1 1 41 25826 1 1 14 LYS HG2 H -8.203 -8.375 7.284 1.00 . A A . 14 LYS HG2 1 1 41 25827 1 1 14 LYS HG3 H -9.130 -7.461 6.093 1.00 . A A . 14 LYS HG3 1 1 41 25828 1 1 14 LYS HZ1 H -6.779 -10.650 4.428 1.00 . A A . 14 LYS HZ1 1 1 41 25829 1 1 14 LYS HZ2 H -5.914 -10.509 5.876 1.00 . A A . 14 LYS HZ2 1 1 41 25830 1 1 14 LYS HZ3 H -6.553 -12.006 5.414 1.00 . A A . 14 LYS HZ3 1 1 41 25831 1 1 14 LYS N N -7.502 -6.552 3.499 1.00 . A A . 14 LYS N 1 1 41 25832 1 1 14 LYS NZ N -6.718 -10.979 5.413 1.00 . A A . 14 LYS NZ 1 1 41 25833 1 1 14 LYS O O -5.130 -5.663 5.859 1.00 . A A . 14 LYS O 1 1 41 25834 1 1 15 LEU C C -3.605 -3.887 4.499 1.00 . A A . 15 LEU C 1 1 41 25835 1 1 15 LEU CA C -4.994 -3.252 4.417 1.00 . A A . 15 LEU CA 1 1 41 25836 1 1 15 LEU CB C -5.208 -2.317 5.610 1.00 . A A . 15 LEU CB 1 1 41 25837 1 1 15 LEU CD1 C -3.823 -0.505 4.563 1.00 . A A . 15 LEU CD1 1 1 41 25838 1 1 15 LEU CD2 C -6.325 -0.394 4.449 1.00 . A A . 15 LEU CD2 1 1 41 25839 1 1 15 LEU CG C -5.126 -0.824 5.284 1.00 . A A . 15 LEU CG 1 1 41 25840 1 1 15 LEU H H -6.834 -4.093 3.783 1.00 . A A . 15 LEU H 1 1 41 25841 1 1 15 LEU HA H -5.050 -2.670 3.509 1.00 . A A . 15 LEU HA 1 1 41 25842 1 1 15 LEU HB2 H -6.184 -2.520 6.028 1.00 . A A . 15 LEU HB2 1 1 41 25843 1 1 15 LEU HB3 H -4.462 -2.540 6.357 1.00 . A A . 15 LEU HB3 1 1 41 25844 1 1 15 LEU HD11 H -3.167 -1.362 4.606 1.00 . A A . 15 LEU HD11 1 1 41 25845 1 1 15 LEU HD12 H -4.032 -0.263 3.531 1.00 . A A . 15 LEU HD12 1 1 41 25846 1 1 15 LEU HD13 H -3.345 0.338 5.040 1.00 . A A . 15 LEU HD13 1 1 41 25847 1 1 15 LEU HD21 H -6.932 -1.257 4.216 1.00 . A A . 15 LEU HD21 1 1 41 25848 1 1 15 LEU HD22 H -6.914 0.320 5.006 1.00 . A A . 15 LEU HD22 1 1 41 25849 1 1 15 LEU HD23 H -5.982 0.062 3.531 1.00 . A A . 15 LEU HD23 1 1 41 25850 1 1 15 LEU HG H -5.142 -0.261 6.206 1.00 . A A . 15 LEU HG 1 1 41 25851 1 1 15 LEU N N -6.062 -4.254 4.364 1.00 . A A . 15 LEU N 1 1 41 25852 1 1 15 LEU O O -3.201 -4.391 5.547 1.00 . A A . 15 LEU O 1 1 41 25853 1 1 16 LYS C C -0.699 -3.956 4.551 1.00 . A A . 16 LYS C 1 1 41 25854 1 1 16 LYS CA C -1.522 -4.404 3.342 1.00 . A A . 16 LYS CA 1 1 41 25855 1 1 16 LYS CB C -0.820 -3.986 2.047 1.00 . A A . 16 LYS CB 1 1 41 25856 1 1 16 LYS CD C -0.357 -4.910 -0.244 1.00 . A A . 16 LYS CD 1 1 41 25857 1 1 16 LYS CE C 0.601 -5.801 -1.017 1.00 . A A . 16 LYS CE 1 1 41 25858 1 1 16 LYS CG C -0.261 -5.155 1.253 1.00 . A A . 16 LYS CG 1 1 41 25859 1 1 16 LYS H H -3.240 -3.418 2.588 1.00 . A A . 16 LYS H 1 1 41 25860 1 1 16 LYS HA H -1.610 -5.480 3.360 1.00 . A A . 16 LYS HA 1 1 41 25861 1 1 16 LYS HB2 H -1.527 -3.461 1.422 1.00 . A A . 16 LYS HB2 1 1 41 25862 1 1 16 LYS HB3 H -0.005 -3.320 2.289 1.00 . A A . 16 LYS HB3 1 1 41 25863 1 1 16 LYS HD2 H -1.366 -5.116 -0.568 1.00 . A A . 16 LYS HD2 1 1 41 25864 1 1 16 LYS HD3 H -0.116 -3.876 -0.445 1.00 . A A . 16 LYS HD3 1 1 41 25865 1 1 16 LYS HE2 H 1.593 -5.681 -0.609 1.00 . A A . 16 LYS HE2 1 1 41 25866 1 1 16 LYS HE3 H 0.287 -6.829 -0.904 1.00 . A A . 16 LYS HE3 1 1 41 25867 1 1 16 LYS HG2 H 0.777 -5.295 1.518 1.00 . A A . 16 LYS HG2 1 1 41 25868 1 1 16 LYS HG3 H -0.820 -6.046 1.500 1.00 . A A . 16 LYS HG3 1 1 41 25869 1 1 16 LYS HZ1 H -0.270 -5.022 -2.749 1.00 . A A . 16 LYS HZ1 1 1 41 25870 1 1 16 LYS HZ2 H 1.403 -4.794 -2.662 1.00 . A A . 16 LYS HZ2 1 1 41 25871 1 1 16 LYS HZ3 H 0.775 -6.321 -3.033 1.00 . A A . 16 LYS HZ3 1 1 41 25872 1 1 16 LYS N N -2.870 -3.844 3.390 1.00 . A A . 16 LYS N 1 1 41 25873 1 1 16 LYS NZ N 0.629 -5.461 -2.467 1.00 . A A . 16 LYS NZ 1 1 41 25874 1 1 16 LYS O O -0.866 -2.841 5.045 1.00 . A A . 16 LYS O 1 1 41 25875 1 1 17 PRO C C 1.967 -3.324 5.951 1.00 . A A . 17 PRO C 1 1 41 25876 1 1 17 PRO CA C 1.044 -4.511 6.205 1.00 . A A . 17 PRO CA 1 1 41 25877 1 1 17 PRO CB C 1.867 -5.788 6.415 1.00 . A A . 17 PRO CB 1 1 41 25878 1 1 17 PRO CD C 0.464 -6.174 4.522 1.00 . A A . 17 PRO CD 1 1 41 25879 1 1 17 PRO CG C 1.801 -6.511 5.113 1.00 . A A . 17 PRO CG 1 1 41 25880 1 1 17 PRO HA H 0.449 -4.317 7.085 1.00 . A A . 17 PRO HA 1 1 41 25881 1 1 17 PRO HB2 H 2.884 -5.525 6.669 1.00 . A A . 17 PRO HB2 1 1 41 25882 1 1 17 PRO HB3 H 1.432 -6.372 7.212 1.00 . A A . 17 PRO HB3 1 1 41 25883 1 1 17 PRO HD2 H 0.518 -6.166 3.443 1.00 . A A . 17 PRO HD2 1 1 41 25884 1 1 17 PRO HD3 H -0.287 -6.872 4.860 1.00 . A A . 17 PRO HD3 1 1 41 25885 1 1 17 PRO HG2 H 2.595 -6.172 4.464 1.00 . A A . 17 PRO HG2 1 1 41 25886 1 1 17 PRO HG3 H 1.880 -7.575 5.280 1.00 . A A . 17 PRO HG3 1 1 41 25887 1 1 17 PRO N N 0.200 -4.824 5.047 1.00 . A A . 17 PRO N 1 1 41 25888 1 1 17 PRO O O 2.541 -3.192 4.871 1.00 . A A . 17 PRO O 1 1 41 25889 1 1 18 ALA C C 4.388 -1.691 6.468 1.00 . A A . 18 ALA C 1 1 41 25890 1 1 18 ALA CA C 2.965 -1.291 6.843 1.00 . A A . 18 ALA CA 1 1 41 25891 1 1 18 ALA CB C 2.961 -0.506 8.147 1.00 . A A . 18 ALA CB 1 1 41 25892 1 1 18 ALA H H 1.626 -2.625 7.793 1.00 . A A . 18 ALA H 1 1 41 25893 1 1 18 ALA HA H 2.563 -0.657 6.066 1.00 . A A . 18 ALA HA 1 1 41 25894 1 1 18 ALA HB1 H 3.699 -0.919 8.818 1.00 . A A . 18 ALA HB1 1 1 41 25895 1 1 18 ALA HB2 H 3.196 0.528 7.945 1.00 . A A . 18 ALA HB2 1 1 41 25896 1 1 18 ALA HB3 H 1.984 -0.571 8.602 1.00 . A A . 18 ALA HB3 1 1 41 25897 1 1 18 ALA N N 2.108 -2.464 6.956 1.00 . A A . 18 ALA N 1 1 41 25898 1 1 18 ALA O O 4.736 -2.871 6.490 1.00 . A A . 18 ALA O 1 1 41 25899 1 1 19 GLY C C 6.673 -1.922 4.555 1.00 . A A . 19 GLY C 1 1 41 25900 1 1 19 GLY CA C 6.579 -0.980 5.741 1.00 . A A . 19 GLY CA 1 1 41 25901 1 1 19 GLY H H 4.874 0.219 6.117 1.00 . A A . 19 GLY H 1 1 41 25902 1 1 19 GLY HA2 H 7.090 -1.424 6.582 1.00 . A A . 19 GLY HA2 1 1 41 25903 1 1 19 GLY HA3 H 7.065 -0.050 5.487 1.00 . A A . 19 GLY HA3 1 1 41 25904 1 1 19 GLY N N 5.206 -0.703 6.120 1.00 . A A . 19 GLY N 1 1 41 25905 1 1 19 GLY O O 7.712 -2.542 4.328 1.00 . A A . 19 GLY O 1 1 41 25906 1 1 20 THR C C 5.294 -2.084 1.365 1.00 . A A . 20 THR C 1 1 41 25907 1 1 20 THR CA C 5.546 -2.898 2.628 1.00 . A A . 20 THR CA 1 1 41 25908 1 1 20 THR CB C 4.457 -3.959 2.792 1.00 . A A . 20 THR CB 1 1 41 25909 1 1 20 THR CG2 C 4.384 -4.928 1.632 1.00 . A A . 20 THR CG2 1 1 41 25910 1 1 20 THR H H 4.789 -1.508 4.028 1.00 . A A . 20 THR H 1 1 41 25911 1 1 20 THR HA H 6.505 -3.386 2.544 1.00 . A A . 20 THR HA 1 1 41 25912 1 1 20 THR HB H 3.498 -3.467 2.872 1.00 . A A . 20 THR HB 1 1 41 25913 1 1 20 THR HG1 H 4.749 -4.124 4.722 1.00 . A A . 20 THR HG1 1 1 41 25914 1 1 20 THR HG21 H 4.648 -4.416 0.718 1.00 . A A . 20 THR HG21 1 1 41 25915 1 1 20 THR HG22 H 5.071 -5.744 1.799 1.00 . A A . 20 THR HG22 1 1 41 25916 1 1 20 THR HG23 H 3.379 -5.315 1.549 1.00 . A A . 20 THR HG23 1 1 41 25917 1 1 20 THR N N 5.585 -2.029 3.797 1.00 . A A . 20 THR N 1 1 41 25918 1 1 20 THR O O 4.412 -1.225 1.335 1.00 . A A . 20 THR O 1 1 41 25919 1 1 20 THR OG1 O 4.668 -4.716 3.971 1.00 . A A . 20 THR OG1 1 1 41 25920 1 1 21 THR C C 4.523 -1.775 -1.493 1.00 . A A . 21 THR C 1 1 41 25921 1 1 21 THR CA C 5.936 -1.640 -0.937 1.00 . A A . 21 THR CA 1 1 41 25922 1 1 21 THR CB C 6.954 -2.154 -1.957 1.00 . A A . 21 THR CB 1 1 41 25923 1 1 21 THR CG2 C 7.959 -1.102 -2.366 1.00 . A A . 21 THR CG2 1 1 41 25924 1 1 21 THR H H 6.763 -3.046 0.412 1.00 . A A . 21 THR H 1 1 41 25925 1 1 21 THR HA H 6.133 -0.596 -0.747 1.00 . A A . 21 THR HA 1 1 41 25926 1 1 21 THR HB H 6.431 -2.475 -2.846 1.00 . A A . 21 THR HB 1 1 41 25927 1 1 21 THR HG1 H 7.969 -3.817 -2.164 1.00 . A A . 21 THR HG1 1 1 41 25928 1 1 21 THR HG21 H 8.111 -0.414 -1.547 1.00 . A A . 21 THR HG21 1 1 41 25929 1 1 21 THR HG22 H 8.896 -1.576 -2.616 1.00 . A A . 21 THR HG22 1 1 41 25930 1 1 21 THR HG23 H 7.586 -0.564 -3.224 1.00 . A A . 21 THR HG23 1 1 41 25931 1 1 21 THR N N 6.075 -2.354 0.326 1.00 . A A . 21 THR N 1 1 41 25932 1 1 21 THR O O 4.002 -2.882 -1.632 1.00 . A A . 21 THR O 1 1 41 25933 1 1 21 THR OG1 O 7.674 -3.260 -1.440 1.00 . A A . 21 THR OG1 1 1 41 25934 1 1 22 CYS C C 2.560 -0.200 -3.820 1.00 . A A . 22 CYS C 1 1 41 25935 1 1 22 CYS CA C 2.557 -0.632 -2.358 1.00 . A A . 22 CYS CA 1 1 41 25936 1 1 22 CYS CB C 1.649 0.292 -1.542 1.00 . A A . 22 CYS CB 1 1 41 25937 1 1 22 CYS H H 4.378 0.210 -1.683 1.00 . A A . 22 CYS H 1 1 41 25938 1 1 22 CYS HA H 2.174 -1.640 -2.298 1.00 . A A . 22 CYS HA 1 1 41 25939 1 1 22 CYS HB2 H 0.763 0.513 -2.118 1.00 . A A . 22 CYS HB2 1 1 41 25940 1 1 22 CYS HB3 H 1.361 -0.214 -0.632 1.00 . A A . 22 CYS HB3 1 1 41 25941 1 1 22 CYS N N 3.909 -0.640 -1.813 1.00 . A A . 22 CYS N 1 1 41 25942 1 1 22 CYS O O 1.579 0.352 -4.315 1.00 . A A . 22 CYS O 1 1 41 25943 1 1 22 CYS SG S 2.413 1.881 -1.075 1.00 . A A . 22 CYS SG 1 1 41 25944 1 1 23 TRP C C 4.970 -0.803 -6.562 1.00 . A A . 23 TRP C 1 1 41 25945 1 1 23 TRP CA C 3.787 -0.100 -5.915 1.00 . A A . 23 TRP CA 1 1 41 25946 1 1 23 TRP CB C 3.927 1.421 -6.075 1.00 . A A . 23 TRP CB 1 1 41 25947 1 1 23 TRP CD1 C 1.616 1.483 -7.150 1.00 . A A . 23 TRP CD1 1 1 41 25948 1 1 23 TRP CD2 C 2.859 3.284 -7.593 1.00 . A A . 23 TRP CD2 1 1 41 25949 1 1 23 TRP CE2 C 1.616 3.429 -8.235 1.00 . A A . 23 TRP CE2 1 1 41 25950 1 1 23 TRP CE3 C 3.803 4.300 -7.731 1.00 . A A . 23 TRP CE3 1 1 41 25951 1 1 23 TRP CG C 2.836 2.027 -6.904 1.00 . A A . 23 TRP CG 1 1 41 25952 1 1 23 TRP CH2 C 2.238 5.526 -9.116 1.00 . A A . 23 TRP CH2 1 1 41 25953 1 1 23 TRP CZ2 C 1.295 4.545 -9.000 1.00 . A A . 23 TRP CZ2 1 1 41 25954 1 1 23 TRP CZ3 C 3.484 5.411 -8.492 1.00 . A A . 23 TRP CZ3 1 1 41 25955 1 1 23 TRP H H 4.416 -0.906 -4.063 1.00 . A A . 23 TRP H 1 1 41 25956 1 1 23 TRP HA H 2.889 -0.423 -6.412 1.00 . A A . 23 TRP HA 1 1 41 25957 1 1 23 TRP HB2 H 3.902 1.883 -5.100 1.00 . A A . 23 TRP HB2 1 1 41 25958 1 1 23 TRP HB3 H 4.872 1.644 -6.550 1.00 . A A . 23 TRP HB3 1 1 41 25959 1 1 23 TRP HD1 H 1.295 0.530 -6.764 1.00 . A A . 23 TRP HD1 1 1 41 25960 1 1 23 TRP HE1 H -0.028 2.145 -8.268 1.00 . A A . 23 TRP HE1 1 1 41 25961 1 1 23 TRP HE3 H 4.770 4.227 -7.264 1.00 . A A . 23 TRP HE3 1 1 41 25962 1 1 23 TRP HH2 H 2.032 6.410 -9.701 1.00 . A A . 23 TRP HH2 1 1 41 25963 1 1 23 TRP HZ2 H 0.338 4.646 -9.487 1.00 . A A . 23 TRP HZ2 1 1 41 25964 1 1 23 TRP HZ3 H 4.204 6.208 -8.607 1.00 . A A . 23 TRP HZ3 1 1 41 25965 1 1 23 TRP N N 3.667 -0.460 -4.509 1.00 . A A . 23 TRP N 1 1 41 25966 1 1 23 TRP NE1 N 0.878 2.317 -7.952 1.00 . A A . 23 TRP NE1 1 1 41 25967 1 1 23 TRP O O 4.802 -1.754 -7.326 1.00 . A A . 23 TRP O 1 1 41 25968 1 1 24 LYS C C 7.286 -0.990 -8.337 1.00 . A A . 24 LYS C 1 1 41 25969 1 1 24 LYS CA C 7.385 -0.890 -6.816 1.00 . A A . 24 LYS CA 1 1 41 25970 1 1 24 LYS CB C 7.647 -2.272 -6.216 1.00 . A A . 24 LYS CB 1 1 41 25971 1 1 24 LYS CD C 9.046 -4.303 -6.697 1.00 . A A . 24 LYS CD 1 1 41 25972 1 1 24 LYS CE C 10.445 -4.827 -6.977 1.00 . A A . 24 LYS CE 1 1 41 25973 1 1 24 LYS CG C 9.047 -2.798 -6.486 1.00 . A A . 24 LYS CG 1 1 41 25974 1 1 24 LYS H H 6.222 0.442 -5.649 1.00 . A A . 24 LYS H 1 1 41 25975 1 1 24 LYS HA H 8.204 -0.235 -6.562 1.00 . A A . 24 LYS HA 1 1 41 25976 1 1 24 LYS HB2 H 7.506 -2.219 -5.147 1.00 . A A . 24 LYS HB2 1 1 41 25977 1 1 24 LYS HB3 H 6.936 -2.972 -6.630 1.00 . A A . 24 LYS HB3 1 1 41 25978 1 1 24 LYS HD2 H 8.666 -4.782 -5.807 1.00 . A A . 24 LYS HD2 1 1 41 25979 1 1 24 LYS HD3 H 8.408 -4.539 -7.536 1.00 . A A . 24 LYS HD3 1 1 41 25980 1 1 24 LYS HE2 H 10.766 -4.462 -7.942 1.00 . A A . 24 LYS HE2 1 1 41 25981 1 1 24 LYS HE3 H 11.114 -4.459 -6.213 1.00 . A A . 24 LYS HE3 1 1 41 25982 1 1 24 LYS HG2 H 9.436 -2.321 -7.374 1.00 . A A . 24 LYS HG2 1 1 41 25983 1 1 24 LYS HG3 H 9.679 -2.562 -5.642 1.00 . A A . 24 LYS HG3 1 1 41 25984 1 1 24 LYS HZ1 H 9.567 -6.700 -7.268 1.00 . A A . 24 LYS HZ1 1 1 41 25985 1 1 24 LYS HZ2 H 11.213 -6.648 -7.655 1.00 . A A . 24 LYS HZ2 1 1 41 25986 1 1 24 LYS HZ3 H 10.724 -6.671 -6.035 1.00 . A A . 24 LYS HZ3 1 1 41 25987 1 1 24 LYS N N 6.163 -0.320 -6.258 1.00 . A A . 24 LYS N 1 1 41 25988 1 1 24 LYS NZ N 10.490 -6.316 -6.985 1.00 . A A . 24 LYS NZ 1 1 41 25989 1 1 24 LYS O O 7.922 -1.842 -8.959 1.00 . A A . 24 LYS O 1 1 41 25990 1 1 25 THR C C 7.581 0.240 -11.094 1.00 . A A . 25 THR C 1 1 41 25991 1 1 25 THR CA C 6.281 -0.094 -10.370 1.00 . A A . 25 THR CA 1 1 41 25992 1 1 25 THR CB C 5.199 0.924 -10.739 1.00 . A A . 25 THR CB 1 1 41 25993 1 1 25 THR CG2 C 4.348 0.498 -11.915 1.00 . A A . 25 THR CG2 1 1 41 25994 1 1 25 THR H H 5.997 0.538 -8.374 1.00 . A A . 25 THR H 1 1 41 25995 1 1 25 THR HA H 5.955 -1.078 -10.674 1.00 . A A . 25 THR HA 1 1 41 25996 1 1 25 THR HB H 5.671 1.861 -10.994 1.00 . A A . 25 THR HB 1 1 41 25997 1 1 25 THR HG1 H 3.993 2.048 -9.681 1.00 . A A . 25 THR HG1 1 1 41 25998 1 1 25 THR HG21 H 4.137 -0.559 -11.843 1.00 . A A . 25 THR HG21 1 1 41 25999 1 1 25 THR HG22 H 3.420 1.052 -11.907 1.00 . A A . 25 THR HG22 1 1 41 26000 1 1 25 THR HG23 H 4.878 0.698 -12.834 1.00 . A A . 25 THR HG23 1 1 41 26001 1 1 25 THR N N 6.477 -0.113 -8.926 1.00 . A A . 25 THR N 1 1 41 26002 1 1 25 THR O O 8.582 0.584 -10.468 1.00 . A A . 25 THR O 1 1 41 26003 1 1 25 THR OG1 O 4.331 1.150 -9.642 1.00 . A A . 25 THR OG1 1 1 41 26004 1 1 26 SER C C 8.969 1.939 -13.316 1.00 . A A . 26 SER C 1 1 41 26005 1 1 26 SER CA C 8.732 0.433 -13.228 1.00 . A A . 26 SER CA 1 1 41 26006 1 1 26 SER CB C 8.570 -0.152 -14.632 1.00 . A A . 26 SER CB 1 1 41 26007 1 1 26 SER H H 6.728 -0.140 -12.861 1.00 . A A . 26 SER H 1 1 41 26008 1 1 26 SER HA H 9.586 -0.026 -12.752 1.00 . A A . 26 SER HA 1 1 41 26009 1 1 26 SER HB2 H 7.873 -0.976 -14.598 1.00 . A A . 26 SER HB2 1 1 41 26010 1 1 26 SER HB3 H 8.193 0.611 -15.297 1.00 . A A . 26 SER HB3 1 1 41 26011 1 1 26 SER HG H 10.332 0.118 -15.446 1.00 . A A . 26 SER HG 1 1 41 26012 1 1 26 SER N N 7.556 0.138 -12.418 1.00 . A A . 26 SER N 1 1 41 26013 1 1 26 SER O O 10.074 2.385 -13.627 1.00 . A A . 26 SER O 1 1 41 26014 1 1 26 SER OG O 9.809 -0.624 -15.134 1.00 . A A . 26 SER OG 1 1 41 26015 1 1 27 VAL C C 8.218 4.765 -11.705 1.00 . A A . 27 VAL C 1 1 41 26016 1 1 27 VAL CA C 8.021 4.171 -13.096 1.00 . A A . 27 VAL CA 1 1 41 26017 1 1 27 VAL CB C 6.759 4.795 -13.725 1.00 . A A . 27 VAL CB 1 1 41 26018 1 1 27 VAL CG1 C 5.532 4.507 -12.870 1.00 . A A . 27 VAL CG1 1 1 41 26019 1 1 27 VAL CG2 C 6.942 6.294 -13.915 1.00 . A A . 27 VAL CG2 1 1 41 26020 1 1 27 VAL H H 7.070 2.305 -12.805 1.00 . A A . 27 VAL H 1 1 41 26021 1 1 27 VAL HA H 8.870 4.429 -13.711 1.00 . A A . 27 VAL HA 1 1 41 26022 1 1 27 VAL HB H 6.606 4.347 -14.696 1.00 . A A . 27 VAL HB 1 1 41 26023 1 1 27 VAL HG11 H 5.433 3.441 -12.729 1.00 . A A . 27 VAL HG11 1 1 41 26024 1 1 27 VAL HG12 H 5.642 4.989 -11.909 1.00 . A A . 27 VAL HG12 1 1 41 26025 1 1 27 VAL HG13 H 4.651 4.888 -13.365 1.00 . A A . 27 VAL HG13 1 1 41 26026 1 1 27 VAL HG21 H 7.960 6.498 -14.212 1.00 . A A . 27 VAL HG21 1 1 41 26027 1 1 27 VAL HG22 H 6.266 6.645 -14.681 1.00 . A A . 27 VAL HG22 1 1 41 26028 1 1 27 VAL HG23 H 6.728 6.803 -12.986 1.00 . A A . 27 VAL HG23 1 1 41 26029 1 1 27 VAL N N 7.925 2.718 -13.044 1.00 . A A . 27 VAL N 1 1 41 26030 1 1 27 VAL O O 8.789 5.845 -11.558 1.00 . A A . 27 VAL O 1 1 41 26031 1 1 28 SER C C 7.945 3.390 -8.324 1.00 . A A . 28 SER C 1 1 41 26032 1 1 28 SER CA C 7.837 4.543 -9.317 1.00 . A A . 28 SER CA 1 1 41 26033 1 1 28 SER CB C 6.622 5.402 -8.974 1.00 . A A . 28 SER CB 1 1 41 26034 1 1 28 SER H H 7.268 3.217 -10.866 1.00 . A A . 28 SER H 1 1 41 26035 1 1 28 SER HA H 8.726 5.151 -9.247 1.00 . A A . 28 SER HA 1 1 41 26036 1 1 28 SER HB2 H 6.456 6.121 -9.762 1.00 . A A . 28 SER HB2 1 1 41 26037 1 1 28 SER HB3 H 5.755 4.765 -8.882 1.00 . A A . 28 SER HB3 1 1 41 26038 1 1 28 SER HG H 7.093 6.996 -7.939 1.00 . A A . 28 SER HG 1 1 41 26039 1 1 28 SER N N 7.726 4.065 -10.689 1.00 . A A . 28 SER N 1 1 41 26040 1 1 28 SER O O 8.110 2.233 -8.709 1.00 . A A . 28 SER O 1 1 41 26041 1 1 28 SER OG O 6.814 6.096 -7.755 1.00 . A A . 28 SER OG 1 1 41 26042 1 1 29 SER C C 7.788 3.408 -4.611 1.00 . A A . 29 SER C 1 1 41 26043 1 1 29 SER CA C 7.924 2.732 -5.973 1.00 . A A . 29 SER CA 1 1 41 26044 1 1 29 SER CB C 9.246 1.965 -6.049 1.00 . A A . 29 SER CB 1 1 41 26045 1 1 29 SER H H 7.711 4.665 -6.804 1.00 . A A . 29 SER H 1 1 41 26046 1 1 29 SER HA H 7.103 2.040 -6.103 1.00 . A A . 29 SER HA 1 1 41 26047 1 1 29 SER HB2 H 9.314 1.286 -5.213 1.00 . A A . 29 SER HB2 1 1 41 26048 1 1 29 SER HB3 H 9.282 1.405 -6.972 1.00 . A A . 29 SER HB3 1 1 41 26049 1 1 29 SER HG H 10.342 3.412 -6.787 1.00 . A A . 29 SER HG 1 1 41 26050 1 1 29 SER N N 7.845 3.723 -7.040 1.00 . A A . 29 SER N 1 1 41 26051 1 1 29 SER O O 8.558 4.308 -4.276 1.00 . A A . 29 SER O 1 1 41 26052 1 1 29 SER OG O 10.352 2.850 -6.008 1.00 . A A . 29 SER OG 1 1 41 26053 1 1 30 HIS C C 6.380 2.471 -1.465 1.00 . A A . 30 HIS C 1 1 41 26054 1 1 30 HIS CA C 6.553 3.559 -2.519 1.00 . A A . 30 HIS CA 1 1 41 26055 1 1 30 HIS CB C 5.307 4.451 -2.556 1.00 . A A . 30 HIS CB 1 1 41 26056 1 1 30 HIS CD2 C 5.281 4.912 -5.105 1.00 . A A . 30 HIS CD2 1 1 41 26057 1 1 30 HIS CE1 C 4.899 7.066 -5.050 1.00 . A A . 30 HIS CE1 1 1 41 26058 1 1 30 HIS CG C 5.189 5.270 -3.805 1.00 . A A . 30 HIS CG 1 1 41 26059 1 1 30 HIS H H 6.208 2.267 -4.162 1.00 . A A . 30 HIS H 1 1 41 26060 1 1 30 HIS HA H 7.409 4.163 -2.259 1.00 . A A . 30 HIS HA 1 1 41 26061 1 1 30 HIS HB2 H 4.427 3.829 -2.486 1.00 . A A . 30 HIS HB2 1 1 41 26062 1 1 30 HIS HB3 H 5.331 5.127 -1.714 1.00 . A A . 30 HIS HB3 1 1 41 26063 1 1 30 HIS HD1 H 4.831 7.187 -3.006 1.00 . A A . 30 HIS HD1 1 1 41 26064 1 1 30 HIS HD2 H 5.468 3.916 -5.482 1.00 . A A . 30 HIS HD2 1 1 41 26065 1 1 30 HIS HE1 H 4.729 8.086 -5.358 1.00 . A A . 30 HIS HE1 1 1 41 26066 1 1 30 HIS HE2 H 5.242 6.112 -6.824 1.00 . A A . 30 HIS HE2 1 1 41 26067 1 1 30 HIS N N 6.796 2.980 -3.836 1.00 . A A . 30 HIS N 1 1 41 26068 1 1 30 HIS ND1 N 4.949 6.628 -3.802 1.00 . A A . 30 HIS ND1 1 1 41 26069 1 1 30 HIS NE2 N 5.098 6.044 -5.857 1.00 . A A . 30 HIS NE2 1 1 41 26070 1 1 30 HIS O O 6.671 1.301 -1.713 1.00 . A A . 30 HIS O 1 1 41 26071 1 1 31 TYR C C 4.326 2.152 1.453 1.00 . A A . 31 TYR C 1 1 41 26072 1 1 31 TYR CA C 5.689 1.927 0.807 1.00 . A A . 31 TYR CA 1 1 41 26073 1 1 31 TYR CB C 6.793 2.071 1.855 1.00 . A A . 31 TYR CB 1 1 41 26074 1 1 31 TYR CD1 C 8.778 1.359 0.466 1.00 . A A . 31 TYR CD1 1 1 41 26075 1 1 31 TYR CD2 C 8.339 0.178 2.489 1.00 . A A . 31 TYR CD2 1 1 41 26076 1 1 31 TYR CE1 C 9.874 0.553 0.228 1.00 . A A . 31 TYR CE1 1 1 41 26077 1 1 31 TYR CE2 C 9.434 -0.632 2.259 1.00 . A A . 31 TYR CE2 1 1 41 26078 1 1 31 TYR CG C 7.992 1.186 1.598 1.00 . A A . 31 TYR CG 1 1 41 26079 1 1 31 TYR CZ C 10.198 -0.441 1.127 1.00 . A A . 31 TYR CZ 1 1 41 26080 1 1 31 TYR H H 5.690 3.813 -0.154 1.00 . A A . 31 TYR H 1 1 41 26081 1 1 31 TYR HA H 5.720 0.929 0.398 1.00 . A A . 31 TYR HA 1 1 41 26082 1 1 31 TYR HB2 H 7.135 3.095 1.869 1.00 . A A . 31 TYR HB2 1 1 41 26083 1 1 31 TYR HB3 H 6.394 1.817 2.826 1.00 . A A . 31 TYR HB3 1 1 41 26084 1 1 31 TYR HD1 H 8.521 2.138 -0.237 1.00 . A A . 31 TYR HD1 1 1 41 26085 1 1 31 TYR HD2 H 7.738 0.030 3.374 1.00 . A A . 31 TYR HD2 1 1 41 26086 1 1 31 TYR HE1 H 10.473 0.703 -0.658 1.00 . A A . 31 TYR HE1 1 1 41 26087 1 1 31 TYR HE2 H 9.687 -1.411 2.963 1.00 . A A . 31 TYR HE2 1 1 41 26088 1 1 31 TYR HH H 12.076 -0.702 0.809 1.00 . A A . 31 TYR HH 1 1 41 26089 1 1 31 TYR N N 5.904 2.866 -0.289 1.00 . A A . 31 TYR N 1 1 41 26090 1 1 31 TYR O O 3.713 3.206 1.280 1.00 . A A . 31 TYR O 1 1 41 26091 1 1 31 TYR OH O 11.290 -1.246 0.894 1.00 . A A . 31 TYR OH 1 1 41 26092 1 1 32 CYS C C 2.746 1.526 4.354 1.00 . A A . 32 CYS C 1 1 41 26093 1 1 32 CYS CA C 2.566 1.248 2.867 1.00 . A A . 32 CYS CA 1 1 41 26094 1 1 32 CYS CB C 1.775 -0.046 2.672 1.00 . A A . 32 CYS CB 1 1 41 26095 1 1 32 CYS H H 4.390 0.341 2.298 1.00 . A A . 32 CYS H 1 1 41 26096 1 1 32 CYS HA H 2.018 2.065 2.423 1.00 . A A . 32 CYS HA 1 1 41 26097 1 1 32 CYS HB2 H 2.096 -0.522 1.758 1.00 . A A . 32 CYS HB2 1 1 41 26098 1 1 32 CYS HB3 H 1.969 -0.707 3.504 1.00 . A A . 32 CYS HB3 1 1 41 26099 1 1 32 CYS N N 3.856 1.156 2.197 1.00 . A A . 32 CYS N 1 1 41 26100 1 1 32 CYS O O 3.788 1.222 4.933 1.00 . A A . 32 CYS O 1 1 41 26101 1 1 32 CYS SG S -0.027 0.197 2.565 1.00 . A A . 32 CYS SG 1 1 41 26102 1 1 33 THR C C 0.772 1.556 7.168 1.00 . A A . 33 THR C 1 1 41 26103 1 1 33 THR CA C 1.759 2.422 6.390 1.00 . A A . 33 THR CA 1 1 41 26104 1 1 33 THR CB C 1.441 3.903 6.613 1.00 . A A . 33 THR CB 1 1 41 26105 1 1 33 THR CG2 C 2.098 4.818 5.601 1.00 . A A . 33 THR CG2 1 1 41 26106 1 1 33 THR H H 0.915 2.320 4.452 1.00 . A A . 33 THR H 1 1 41 26107 1 1 33 THR HA H 2.757 2.220 6.747 1.00 . A A . 33 THR HA 1 1 41 26108 1 1 33 THR HB H 1.789 4.191 7.594 1.00 . A A . 33 THR HB 1 1 41 26109 1 1 33 THR HG1 H -0.169 4.942 7.017 1.00 . A A . 33 THR HG1 1 1 41 26110 1 1 33 THR HG21 H 3.163 4.643 5.596 1.00 . A A . 33 THR HG21 1 1 41 26111 1 1 33 THR HG22 H 1.695 4.617 4.619 1.00 . A A . 33 THR HG22 1 1 41 26112 1 1 33 THR HG23 H 1.903 5.847 5.866 1.00 . A A . 33 THR HG23 1 1 41 26113 1 1 33 THR N N 1.720 2.104 4.968 1.00 . A A . 33 THR N 1 1 41 26114 1 1 33 THR O O 0.430 1.864 8.310 1.00 . A A . 33 THR O 1 1 41 26115 1 1 33 THR OG1 O 0.044 4.129 6.553 1.00 . A A . 33 THR OG1 1 1 41 26116 1 1 34 GLY C C -1.778 0.314 7.855 1.00 . A A . 34 GLY C 1 1 41 26117 1 1 34 GLY CA C -0.627 -0.424 7.194 1.00 . A A . 34 GLY CA 1 1 41 26118 1 1 34 GLY H H 0.625 0.273 5.633 1.00 . A A . 34 GLY H 1 1 41 26119 1 1 34 GLY HA2 H -0.103 -0.996 7.945 1.00 . A A . 34 GLY HA2 1 1 41 26120 1 1 34 GLY HA3 H -1.028 -1.103 6.456 1.00 . A A . 34 GLY HA3 1 1 41 26121 1 1 34 GLY N N 0.317 0.470 6.543 1.00 . A A . 34 GLY N 1 1 41 26122 1 1 34 GLY O O -2.097 0.063 9.017 1.00 . A A . 34 GLY O 1 1 41 26123 1 1 35 ARG C C -4.626 2.148 6.606 1.00 . A A . 35 ARG C 1 1 41 26124 1 1 35 ARG CA C -3.516 2.004 7.642 1.00 . A A . 35 ARG CA 1 1 41 26125 1 1 35 ARG CB C -3.038 3.387 8.089 1.00 . A A . 35 ARG CB 1 1 41 26126 1 1 35 ARG CD C -3.798 5.450 9.304 1.00 . A A . 35 ARG CD 1 1 41 26127 1 1 35 ARG CG C -3.788 3.930 9.293 1.00 . A A . 35 ARG CG 1 1 41 26128 1 1 35 ARG CZ C -2.211 7.313 9.010 1.00 . A A . 35 ARG CZ 1 1 41 26129 1 1 35 ARG H H -2.097 1.385 6.196 1.00 . A A . 35 ARG H 1 1 41 26130 1 1 35 ARG HA H -3.908 1.478 8.496 1.00 . A A . 35 ARG HA 1 1 41 26131 1 1 35 ARG HB2 H -1.989 3.328 8.341 1.00 . A A . 35 ARG HB2 1 1 41 26132 1 1 35 ARG HB3 H -3.164 4.080 7.270 1.00 . A A . 35 ARG HB3 1 1 41 26133 1 1 35 ARG HD2 H -4.459 5.799 8.524 1.00 . A A . 35 ARG HD2 1 1 41 26134 1 1 35 ARG HD3 H -4.164 5.788 10.262 1.00 . A A . 35 ARG HD3 1 1 41 26135 1 1 35 ARG HE H -1.723 5.378 8.978 1.00 . A A . 35 ARG HE 1 1 41 26136 1 1 35 ARG HG2 H -4.807 3.574 9.262 1.00 . A A . 35 ARG HG2 1 1 41 26137 1 1 35 ARG HG3 H -3.309 3.576 10.194 1.00 . A A . 35 ARG HG3 1 1 41 26138 1 1 35 ARG HH11 H -4.130 7.884 9.300 1.00 . A A . 35 ARG HH11 1 1 41 26139 1 1 35 ARG HH12 H -2.994 9.175 9.091 1.00 . A A . 35 ARG HH12 1 1 41 26140 1 1 35 ARG HH21 H -0.228 7.074 8.703 1.00 . A A . 35 ARG HH21 1 1 41 26141 1 1 35 ARG HH22 H -0.779 8.715 8.752 1.00 . A A . 35 ARG HH22 1 1 41 26142 1 1 35 ARG N N -2.399 1.228 7.115 1.00 . A A . 35 ARG N 1 1 41 26143 1 1 35 ARG NE N -2.466 6.008 9.081 1.00 . A A . 35 ARG NE 1 1 41 26144 1 1 35 ARG NH1 N -3.193 8.196 9.145 1.00 . A A . 35 ARG NH1 1 1 41 26145 1 1 35 ARG NH2 N -0.971 7.735 8.805 1.00 . A A . 35 ARG NH2 1 1 41 26146 1 1 35 ARG O O -5.805 1.973 6.915 1.00 . A A . 35 ARG O 1 1 41 26147 1 1 36 SER C C -4.646 2.097 2.983 1.00 . A A . 36 SER C 1 1 41 26148 1 1 36 SER CA C -5.203 2.639 4.294 1.00 . A A . 36 SER CA 1 1 41 26149 1 1 36 SER CB C -5.566 4.117 4.135 1.00 . A A . 36 SER CB 1 1 41 26150 1 1 36 SER H H -3.287 2.595 5.197 1.00 . A A . 36 SER H 1 1 41 26151 1 1 36 SER HA H -6.093 2.085 4.551 1.00 . A A . 36 SER HA 1 1 41 26152 1 1 36 SER HB2 H -4.725 4.726 4.428 1.00 . A A . 36 SER HB2 1 1 41 26153 1 1 36 SER HB3 H -5.812 4.315 3.102 1.00 . A A . 36 SER HB3 1 1 41 26154 1 1 36 SER HG H -6.376 4.696 5.822 1.00 . A A . 36 SER HG 1 1 41 26155 1 1 36 SER N N -4.241 2.469 5.378 1.00 . A A . 36 SER N 1 1 41 26156 1 1 36 SER O O -3.447 1.844 2.865 1.00 . A A . 36 SER O 1 1 41 26157 1 1 36 SER OG O -6.679 4.459 4.943 1.00 . A A . 36 SER OG 1 1 41 26158 1 1 37 CYS C C -4.575 2.521 -0.199 1.00 . A A . 37 CYS C 1 1 41 26159 1 1 37 CYS CA C -5.111 1.406 0.698 1.00 . A A . 37 CYS CA 1 1 41 26160 1 1 37 CYS CB C -6.282 0.706 0.015 1.00 . A A . 37 CYS CB 1 1 41 26161 1 1 37 CYS H H -6.466 2.138 2.149 1.00 . A A . 37 CYS H 1 1 41 26162 1 1 37 CYS HA H -4.326 0.686 0.863 1.00 . A A . 37 CYS HA 1 1 41 26163 1 1 37 CYS HB2 H -7.167 1.314 0.122 1.00 . A A . 37 CYS HB2 1 1 41 26164 1 1 37 CYS HB3 H -6.058 0.587 -1.035 1.00 . A A . 37 CYS HB3 1 1 41 26165 1 1 37 CYS N N -5.522 1.919 1.999 1.00 . A A . 37 CYS N 1 1 41 26166 1 1 37 CYS O O -4.160 2.270 -1.330 1.00 . A A . 37 CYS O 1 1 41 26167 1 1 37 CYS SG S -6.653 -0.943 0.694 1.00 . A A . 37 CYS SG 1 1 41 26168 1 1 38 GLU C C -2.575 4.980 -0.396 1.00 . A A . 38 GLU C 1 1 41 26169 1 1 38 GLU CA C -4.097 4.893 -0.454 1.00 . A A . 38 GLU CA 1 1 41 26170 1 1 38 GLU CB C -4.714 6.188 0.078 1.00 . A A . 38 GLU CB 1 1 41 26171 1 1 38 GLU CD C -5.435 8.439 -0.814 1.00 . A A . 38 GLU CD 1 1 41 26172 1 1 38 GLU CG C -4.315 7.422 -0.714 1.00 . A A . 38 GLU CG 1 1 41 26173 1 1 38 GLU H H -4.926 3.893 1.216 1.00 . A A . 38 GLU H 1 1 41 26174 1 1 38 GLU HA H -4.399 4.757 -1.482 1.00 . A A . 38 GLU HA 1 1 41 26175 1 1 38 GLU HB2 H -5.790 6.100 0.048 1.00 . A A . 38 GLU HB2 1 1 41 26176 1 1 38 GLU HB3 H -4.402 6.327 1.102 1.00 . A A . 38 GLU HB3 1 1 41 26177 1 1 38 GLU HG2 H -3.470 7.888 -0.230 1.00 . A A . 38 GLU HG2 1 1 41 26178 1 1 38 GLU HG3 H -4.034 7.118 -1.712 1.00 . A A . 38 GLU HG3 1 1 41 26179 1 1 38 GLU N N -4.584 3.750 0.309 1.00 . A A . 38 GLU N 1 1 41 26180 1 1 38 GLU O O -2.017 5.723 0.411 1.00 . A A . 38 GLU O 1 1 41 26181 1 1 38 GLU OE1 O -5.135 9.650 -0.865 1.00 . A A . 38 GLU OE1 1 1 41 26182 1 1 38 GLU OE2 O -6.613 8.023 -0.841 1.00 . A A . 38 GLU OE2 1 1 41 26183 1 1 39 CYS C C 0.084 5.621 -1.575 1.00 . A A . 39 CYS C 1 1 41 26184 1 1 39 CYS CA C -0.451 4.214 -1.309 1.00 . A A . 39 CYS CA 1 1 41 26185 1 1 39 CYS CB C 0.037 3.250 -2.395 1.00 . A A . 39 CYS CB 1 1 41 26186 1 1 39 CYS H H -2.410 3.650 -1.881 1.00 . A A . 39 CYS H 1 1 41 26187 1 1 39 CYS HA H -0.089 3.876 -0.350 1.00 . A A . 39 CYS HA 1 1 41 26188 1 1 39 CYS HB2 H -0.324 2.258 -2.173 1.00 . A A . 39 CYS HB2 1 1 41 26189 1 1 39 CYS HB3 H -0.360 3.566 -3.350 1.00 . A A . 39 CYS HB3 1 1 41 26190 1 1 39 CYS N N -1.909 4.219 -1.260 1.00 . A A . 39 CYS N 1 1 41 26191 1 1 39 CYS O O -0.441 6.340 -2.425 1.00 . A A . 39 CYS O 1 1 41 26192 1 1 39 CYS SG S 1.851 3.155 -2.554 1.00 . A A . 39 CYS SG 1 1 41 26193 1 1 40 PRO C C 1.970 7.730 -2.474 1.00 . A A . 40 PRO C 1 1 41 26194 1 1 40 PRO CA C 1.732 7.370 -1.011 1.00 . A A . 40 PRO CA 1 1 41 26195 1 1 40 PRO CB C 3.061 7.251 -0.266 1.00 . A A . 40 PRO CB 1 1 41 26196 1 1 40 PRO CD C 1.828 5.251 0.193 1.00 . A A . 40 PRO CD 1 1 41 26197 1 1 40 PRO CG C 2.808 6.229 0.787 1.00 . A A . 40 PRO CG 1 1 41 26198 1 1 40 PRO HA H 1.125 8.134 -0.549 1.00 . A A . 40 PRO HA 1 1 41 26199 1 1 40 PRO HB2 H 3.834 6.933 -0.950 1.00 . A A . 40 PRO HB2 1 1 41 26200 1 1 40 PRO HB3 H 3.322 8.205 0.166 1.00 . A A . 40 PRO HB3 1 1 41 26201 1 1 40 PRO HD2 H 2.351 4.413 -0.243 1.00 . A A . 40 PRO HD2 1 1 41 26202 1 1 40 PRO HD3 H 1.131 4.913 0.945 1.00 . A A . 40 PRO HD3 1 1 41 26203 1 1 40 PRO HG2 H 3.730 5.727 1.041 1.00 . A A . 40 PRO HG2 1 1 41 26204 1 1 40 PRO HG3 H 2.383 6.700 1.661 1.00 . A A . 40 PRO HG3 1 1 41 26205 1 1 40 PRO N N 1.137 6.039 -0.847 1.00 . A A . 40 PRO N 1 1 41 26206 1 1 40 PRO O O 2.257 6.862 -3.299 1.00 . A A . 40 PRO O 1 1 41 26207 1 1 41 SER C C 3.483 9.978 -4.363 1.00 . A A . 41 SER C 1 1 41 26208 1 1 41 SER CA C 2.050 9.492 -4.153 1.00 . A A . 41 SER CA 1 1 41 26209 1 1 41 SER CB C 1.067 10.620 -4.471 1.00 . A A . 41 SER CB 1 1 41 26210 1 1 41 SER H H 1.618 9.660 -2.087 1.00 . A A . 41 SER H 1 1 41 26211 1 1 41 SER HA H 1.862 8.666 -4.821 1.00 . A A . 41 SER HA 1 1 41 26212 1 1 41 SER HB2 H 1.535 11.325 -5.141 1.00 . A A . 41 SER HB2 1 1 41 26213 1 1 41 SER HB3 H 0.188 10.205 -4.942 1.00 . A A . 41 SER HB3 1 1 41 26214 1 1 41 SER HG H 1.381 11.889 -3.012 1.00 . A A . 41 SER HG 1 1 41 26215 1 1 41 SER N N 1.849 9.016 -2.788 1.00 . A A . 41 SER N 1 1 41 26216 1 1 41 SER O O 3.766 10.705 -5.316 1.00 . A A . 41 SER O 1 1 41 26217 1 1 41 SER OG O 0.674 11.303 -3.293 1.00 . A A . 41 SER OG 1 1 41 26218 1 1 42 TYR C C 6.698 8.824 -3.120 1.00 . A A . 42 TYR C 1 1 41 26219 1 1 42 TYR CA C 5.785 9.964 -3.571 1.00 . A A . 42 TYR CA 1 1 41 26220 1 1 42 TYR CB C 6.048 11.214 -2.728 1.00 . A A . 42 TYR CB 1 1 41 26221 1 1 42 TYR CD1 C 7.039 10.669 -0.471 1.00 . A A . 42 TYR CD1 1 1 41 26222 1 1 42 TYR CD2 C 4.693 11.071 -0.601 1.00 . A A . 42 TYR CD2 1 1 41 26223 1 1 42 TYR CE1 C 6.931 10.454 0.889 1.00 . A A . 42 TYR CE1 1 1 41 26224 1 1 42 TYR CE2 C 4.577 10.858 0.759 1.00 . A A . 42 TYR CE2 1 1 41 26225 1 1 42 TYR CG C 5.924 10.980 -1.239 1.00 . A A . 42 TYR CG 1 1 41 26226 1 1 42 TYR CZ C 5.698 10.550 1.500 1.00 . A A . 42 TYR CZ 1 1 41 26227 1 1 42 TYR H H 4.103 8.991 -2.737 1.00 . A A . 42 TYR H 1 1 41 26228 1 1 42 TYR HA H 5.993 10.188 -4.606 1.00 . A A . 42 TYR HA 1 1 41 26229 1 1 42 TYR HB2 H 7.048 11.568 -2.925 1.00 . A A . 42 TYR HB2 1 1 41 26230 1 1 42 TYR HB3 H 5.339 11.980 -3.004 1.00 . A A . 42 TYR HB3 1 1 41 26231 1 1 42 TYR HD1 H 8.003 10.595 -0.952 1.00 . A A . 42 TYR HD1 1 1 41 26232 1 1 42 TYR HD2 H 3.816 11.312 -1.185 1.00 . A A . 42 TYR HD2 1 1 41 26233 1 1 42 TYR HE1 H 7.810 10.213 1.469 1.00 . A A . 42 TYR HE1 1 1 41 26234 1 1 42 TYR HE2 H 3.611 10.933 1.236 1.00 . A A . 42 TYR HE2 1 1 41 26235 1 1 42 TYR HH H 5.957 9.480 3.076 1.00 . A A . 42 TYR HH 1 1 41 26236 1 1 42 TYR N N 4.384 9.571 -3.474 1.00 . A A . 42 TYR N 1 1 41 26237 1 1 42 TYR O O 6.364 8.080 -2.198 1.00 . A A . 42 TYR O 1 1 41 26238 1 1 42 TYR OH O 5.587 10.337 2.855 1.00 . A A . 42 TYR OH 1 1 41 26239 1 1 43 PRO C C 9.472 7.835 -2.061 1.00 . A A . 43 PRO C 1 1 41 26240 1 1 43 PRO CA C 8.824 7.614 -3.424 1.00 . A A . 43 PRO CA 1 1 41 26241 1 1 43 PRO CB C 9.872 7.708 -4.536 1.00 . A A . 43 PRO CB 1 1 41 26242 1 1 43 PRO CD C 8.348 9.514 -4.877 1.00 . A A . 43 PRO CD 1 1 41 26243 1 1 43 PRO CG C 9.792 9.117 -5.009 1.00 . A A . 43 PRO CG 1 1 41 26244 1 1 43 PRO HA H 8.360 6.639 -3.445 1.00 . A A . 43 PRO HA 1 1 41 26245 1 1 43 PRO HB2 H 10.848 7.479 -4.135 1.00 . A A . 43 PRO HB2 1 1 41 26246 1 1 43 PRO HB3 H 9.627 7.012 -5.325 1.00 . A A . 43 PRO HB3 1 1 41 26247 1 1 43 PRO HD2 H 8.265 10.562 -4.631 1.00 . A A . 43 PRO HD2 1 1 41 26248 1 1 43 PRO HD3 H 7.811 9.294 -5.787 1.00 . A A . 43 PRO HD3 1 1 41 26249 1 1 43 PRO HG2 H 10.413 9.749 -4.391 1.00 . A A . 43 PRO HG2 1 1 41 26250 1 1 43 PRO HG3 H 10.104 9.177 -6.042 1.00 . A A . 43 PRO HG3 1 1 41 26251 1 1 43 PRO N N 7.867 8.672 -3.766 1.00 . A A . 43 PRO N 1 1 41 26252 1 1 43 PRO O O 9.592 8.968 -1.596 1.00 . A A . 43 PRO O 1 1 41 26253 1 1 44 GLY C C 9.581 7.378 0.937 1.00 . A A . 44 GLY C 1 1 41 26254 1 1 44 GLY CA C 10.519 6.838 -0.124 1.00 . A A . 44 GLY CA 1 1 41 26255 1 1 44 GLY H H 9.766 5.868 -1.848 1.00 . A A . 44 GLY H 1 1 41 26256 1 1 44 GLY HA2 H 11.376 7.491 -0.197 1.00 . A A . 44 GLY HA2 1 1 41 26257 1 1 44 GLY HA3 H 10.854 5.855 0.173 1.00 . A A . 44 GLY HA3 1 1 41 26258 1 1 44 GLY N N 9.888 6.744 -1.427 1.00 . A A . 44 GLY N 1 1 41 26259 1 1 44 GLY O O 8.960 8.424 0.753 1.00 . A A . 44 GLY O 1 1 41 26260 1 1 45 ASN C C 9.031 8.432 3.697 1.00 . A A . 45 ASN C 1 1 41 26261 1 1 45 ASN CA C 8.607 7.074 3.147 1.00 . A A . 45 ASN CA 1 1 41 26262 1 1 45 ASN CB C 8.628 6.029 4.264 1.00 . A A . 45 ASN CB 1 1 41 26263 1 1 45 ASN CG C 7.280 5.880 4.942 1.00 . A A . 45 ASN CG 1 1 41 26264 1 1 45 ASN H H 9.997 5.835 2.140 1.00 . A A . 45 ASN H 1 1 41 26265 1 1 45 ASN HA H 7.602 7.154 2.760 1.00 . A A . 45 ASN HA 1 1 41 26266 1 1 45 ASN HB2 H 8.909 5.073 3.850 1.00 . A A . 45 ASN HB2 1 1 41 26267 1 1 45 ASN HB3 H 9.354 6.322 5.009 1.00 . A A . 45 ASN HB3 1 1 41 26268 1 1 45 ASN HD21 H 7.531 3.911 5.061 1.00 . A A . 45 ASN HD21 1 1 41 26269 1 1 45 ASN HD22 H 6.050 4.519 5.710 1.00 . A A . 45 ASN HD22 1 1 41 26270 1 1 45 ASN N N 9.477 6.661 2.052 1.00 . A A . 45 ASN N 1 1 41 26271 1 1 45 ASN ND2 N 6.917 4.645 5.271 1.00 . A A . 45 ASN ND2 1 1 41 26272 1 1 45 ASN O O 8.192 9.253 4.067 1.00 . A A . 45 ASN O 1 1 41 26273 1 1 45 ASN OD1 O 6.573 6.862 5.167 1.00 . A A . 45 ASN OD1 1 1 41 26274 1 1 46 GLY C C 10.807 10.000 5.767 1.00 . A A . 46 GLY C 1 1 41 26275 1 1 46 GLY CA C 10.852 9.921 4.253 1.00 . A A . 46 GLY CA 1 1 41 26276 1 1 46 GLY H H 10.961 7.970 3.439 1.00 . A A . 46 GLY H 1 1 41 26277 1 1 46 GLY HA2 H 10.261 10.728 3.844 1.00 . A A . 46 GLY HA2 1 1 41 26278 1 1 46 GLY HA3 H 11.875 10.037 3.928 1.00 . A A . 46 GLY HA3 1 1 41 26279 1 1 46 GLY N N 10.339 8.662 3.747 1.00 . A A . 46 GLY N 1 1 41 26280 1 1 46 GLY O O 10.912 11.122 6.306 1.00 . A A . 46 GLY O 1 1 41 26281 1 1 46 GLY OXT O 10.667 8.940 6.412 1.00 . A A . 46 GLY OXT 1 1 42 26282 1 1 1 ALA C C -19.308 -7.524 1.157 1.00 . A A . 1 ALA C 1 1 42 26283 1 1 1 ALA CA C -20.337 -6.885 0.232 1.00 . A A . 1 ALA CA 1 1 42 26284 1 1 1 ALA CB C -21.666 -7.618 0.336 1.00 . A A . 1 ALA CB 1 1 42 26285 1 1 1 ALA H1 H -19.643 -7.866 -1.438 1.00 . A A . 1 ALA H1 1 1 42 26286 1 1 1 ALA H2 H -20.621 -6.495 -1.768 1.00 . A A . 1 ALA H2 1 1 42 26287 1 1 1 ALA H3 H -19.010 -6.286 -1.221 1.00 . A A . 1 ALA H3 1 1 42 26288 1 1 1 ALA HA H -20.494 -5.861 0.539 1.00 . A A . 1 ALA HA 1 1 42 26289 1 1 1 ALA HB1 H -22.470 -6.944 0.076 1.00 . A A . 1 ALA HB1 1 1 42 26290 1 1 1 ALA HB2 H -21.805 -7.970 1.347 1.00 . A A . 1 ALA HB2 1 1 42 26291 1 1 1 ALA HB3 H -21.668 -8.459 -0.342 1.00 . A A . 1 ALA HB3 1 1 42 26292 1 1 1 ALA N N -19.860 -6.883 -1.176 1.00 . A A . 1 ALA N 1 1 42 26293 1 1 1 ALA O O -19.432 -8.691 1.529 1.00 . A A . 1 ALA O 1 1 42 26294 1 1 2 MET C C -16.600 -6.093 3.184 1.00 . A A . 2 MET C 1 1 42 26295 1 1 2 MET CA C -17.240 -7.241 2.410 1.00 . A A . 2 MET CA 1 1 42 26296 1 1 2 MET CB C -16.174 -7.986 1.604 1.00 . A A . 2 MET CB 1 1 42 26297 1 1 2 MET CE C -15.840 -11.760 0.529 1.00 . A A . 2 MET CE 1 1 42 26298 1 1 2 MET CG C -16.725 -9.148 0.794 1.00 . A A . 2 MET CG 1 1 42 26299 1 1 2 MET H H -18.248 -5.829 1.198 1.00 . A A . 2 MET H 1 1 42 26300 1 1 2 MET HA H -17.691 -7.926 3.113 1.00 . A A . 2 MET HA 1 1 42 26301 1 1 2 MET HB2 H -15.704 -7.291 0.924 1.00 . A A . 2 MET HB2 1 1 42 26302 1 1 2 MET HB3 H -15.429 -8.370 2.284 1.00 . A A . 2 MET HB3 1 1 42 26303 1 1 2 MET HE1 H -16.291 -11.715 1.509 1.00 . A A . 2 MET HE1 1 1 42 26304 1 1 2 MET HE2 H -16.534 -12.208 -0.167 1.00 . A A . 2 MET HE2 1 1 42 26305 1 1 2 MET HE3 H -14.941 -12.357 0.575 1.00 . A A . 2 MET HE3 1 1 42 26306 1 1 2 MET HG2 H -17.274 -9.801 1.455 1.00 . A A . 2 MET HG2 1 1 42 26307 1 1 2 MET HG3 H -17.393 -8.758 0.040 1.00 . A A . 2 MET HG3 1 1 42 26308 1 1 2 MET N N -18.292 -6.751 1.527 1.00 . A A . 2 MET N 1 1 42 26309 1 1 2 MET O O -16.618 -4.946 2.739 1.00 . A A . 2 MET O 1 1 42 26310 1 1 2 MET SD S -15.430 -10.104 -0.017 1.00 . A A . 2 MET SD 1 1 42 26311 1 1 3 ASP C C -13.876 -5.421 4.977 1.00 . A A . 3 ASP C 1 1 42 26312 1 1 3 ASP CA C -15.387 -5.406 5.179 1.00 . A A . 3 ASP CA 1 1 42 26313 1 1 3 ASP CB C -15.719 -5.648 6.653 1.00 . A A . 3 ASP CB 1 1 42 26314 1 1 3 ASP CG C -15.897 -4.355 7.425 1.00 . A A . 3 ASP CG 1 1 42 26315 1 1 3 ASP H H -16.051 -7.344 4.645 1.00 . A A . 3 ASP H 1 1 42 26316 1 1 3 ASP HA H -15.768 -4.439 4.888 1.00 . A A . 3 ASP HA 1 1 42 26317 1 1 3 ASP HB2 H -16.635 -6.215 6.721 1.00 . A A . 3 ASP HB2 1 1 42 26318 1 1 3 ASP HB3 H -14.917 -6.211 7.108 1.00 . A A . 3 ASP HB3 1 1 42 26319 1 1 3 ASP N N -16.034 -6.411 4.344 1.00 . A A . 3 ASP N 1 1 42 26320 1 1 3 ASP O O -13.112 -5.167 5.909 1.00 . A A . 3 ASP O 1 1 42 26321 1 1 3 ASP OD1 O -15.118 -4.117 8.372 1.00 . A A . 3 ASP OD1 1 1 42 26322 1 1 3 ASP OD2 O -16.815 -3.581 7.083 1.00 . A A . 3 ASP OD2 1 1 42 26323 1 1 4 CYS C C -11.528 -4.402 2.973 1.00 . A A . 4 CYS C 1 1 42 26324 1 1 4 CYS CA C -12.030 -5.768 3.429 1.00 . A A . 4 CYS CA 1 1 42 26325 1 1 4 CYS CB C -11.768 -6.810 2.340 1.00 . A A . 4 CYS CB 1 1 42 26326 1 1 4 CYS H H -14.108 -5.913 3.053 1.00 . A A . 4 CYS H 1 1 42 26327 1 1 4 CYS HA H -11.495 -6.054 4.323 1.00 . A A . 4 CYS HA 1 1 42 26328 1 1 4 CYS HB2 H -12.530 -6.723 1.580 1.00 . A A . 4 CYS HB2 1 1 42 26329 1 1 4 CYS HB3 H -10.802 -6.620 1.896 1.00 . A A . 4 CYS HB3 1 1 42 26330 1 1 4 CYS N N -13.450 -5.720 3.754 1.00 . A A . 4 CYS N 1 1 42 26331 1 1 4 CYS O O -12.318 -3.511 2.661 1.00 . A A . 4 CYS O 1 1 42 26332 1 1 4 CYS SG S -11.777 -8.532 2.936 1.00 . A A . 4 CYS SG 1 1 42 26333 1 1 5 THR C C -9.018 -3.122 1.108 1.00 . A A . 5 THR C 1 1 42 26334 1 1 5 THR CA C -9.594 -2.994 2.515 1.00 . A A . 5 THR CA 1 1 42 26335 1 1 5 THR CB C -8.494 -2.587 3.499 1.00 . A A . 5 THR CB 1 1 42 26336 1 1 5 THR CG2 C -8.567 -1.132 3.908 1.00 . A A . 5 THR CG2 1 1 42 26337 1 1 5 THR H H -9.634 -4.997 3.194 1.00 . A A . 5 THR H 1 1 42 26338 1 1 5 THR HA H -10.359 -2.232 2.510 1.00 . A A . 5 THR HA 1 1 42 26339 1 1 5 THR HB H -7.531 -2.754 3.038 1.00 . A A . 5 THR HB 1 1 42 26340 1 1 5 THR HG1 H -8.247 -4.255 4.495 1.00 . A A . 5 THR HG1 1 1 42 26341 1 1 5 THR HG21 H -9.249 -0.608 3.255 1.00 . A A . 5 THR HG21 1 1 42 26342 1 1 5 THR HG22 H -8.919 -1.061 4.927 1.00 . A A . 5 THR HG22 1 1 42 26343 1 1 5 THR HG23 H -7.586 -0.688 3.834 1.00 . A A . 5 THR HG23 1 1 42 26344 1 1 5 THR N N -10.210 -4.248 2.934 1.00 . A A . 5 THR N 1 1 42 26345 1 1 5 THR O O -7.913 -3.632 0.924 1.00 . A A . 5 THR O 1 1 42 26346 1 1 5 THR OG1 O -8.562 -3.367 4.680 1.00 . A A . 5 THR OG1 1 1 42 26347 1 1 6 THR C C -8.480 -1.510 -1.629 1.00 . A A . 6 THR C 1 1 42 26348 1 1 6 THR CA C -9.337 -2.720 -1.271 1.00 . A A . 6 THR CA 1 1 42 26349 1 1 6 THR CB C -10.547 -2.797 -2.204 1.00 . A A . 6 THR CB 1 1 42 26350 1 1 6 THR CG2 C -11.411 -4.016 -1.964 1.00 . A A . 6 THR CG2 1 1 42 26351 1 1 6 THR H H -10.646 -2.261 0.329 1.00 . A A . 6 THR H 1 1 42 26352 1 1 6 THR HA H -8.744 -3.614 -1.391 1.00 . A A . 6 THR HA 1 1 42 26353 1 1 6 THR HB H -10.198 -2.835 -3.226 1.00 . A A . 6 THR HB 1 1 42 26354 1 1 6 THR HG1 H -11.792 -1.670 -1.196 1.00 . A A . 6 THR HG1 1 1 42 26355 1 1 6 THR HG21 H -10.864 -4.734 -1.371 1.00 . A A . 6 THR HG21 1 1 42 26356 1 1 6 THR HG22 H -12.308 -3.723 -1.438 1.00 . A A . 6 THR HG22 1 1 42 26357 1 1 6 THR HG23 H -11.678 -4.460 -2.911 1.00 . A A . 6 THR HG23 1 1 42 26358 1 1 6 THR N N -9.774 -2.656 0.119 1.00 . A A . 6 THR N 1 1 42 26359 1 1 6 THR O O -8.693 -0.412 -1.114 1.00 . A A . 6 THR O 1 1 42 26360 1 1 6 THR OG1 O -11.368 -1.652 -2.057 1.00 . A A . 6 THR OG1 1 1 42 26361 1 1 7 GLY C C -5.203 -1.092 -3.129 1.00 . A A . 7 GLY C 1 1 42 26362 1 1 7 GLY CA C -6.636 -0.636 -2.925 1.00 . A A . 7 GLY CA 1 1 42 26363 1 1 7 GLY H H -7.388 -2.615 -2.891 1.00 . A A . 7 GLY H 1 1 42 26364 1 1 7 GLY HA2 H -6.653 0.133 -2.167 1.00 . A A . 7 GLY HA2 1 1 42 26365 1 1 7 GLY HA3 H -7.006 -0.222 -3.851 1.00 . A A . 7 GLY HA3 1 1 42 26366 1 1 7 GLY N N -7.511 -1.719 -2.514 1.00 . A A . 7 GLY N 1 1 42 26367 1 1 7 GLY O O -4.892 -2.269 -2.945 1.00 . A A . 7 GLY O 1 1 42 26368 1 1 8 PRO C C -2.122 -0.726 -2.443 1.00 . A A . 8 PRO C 1 1 42 26369 1 1 8 PRO CA C -2.889 -0.502 -3.743 1.00 . A A . 8 PRO CA 1 1 42 26370 1 1 8 PRO CB C -2.358 0.734 -4.471 1.00 . A A . 8 PRO CB 1 1 42 26371 1 1 8 PRO CD C -4.584 1.253 -3.760 1.00 . A A . 8 PRO CD 1 1 42 26372 1 1 8 PRO CG C -3.221 1.850 -3.992 1.00 . A A . 8 PRO CG 1 1 42 26373 1 1 8 PRO HA H -2.782 -1.369 -4.377 1.00 . A A . 8 PRO HA 1 1 42 26374 1 1 8 PRO HB2 H -1.322 0.893 -4.208 1.00 . A A . 8 PRO HB2 1 1 42 26375 1 1 8 PRO HB3 H -2.449 0.596 -5.538 1.00 . A A . 8 PRO HB3 1 1 42 26376 1 1 8 PRO HD2 H -5.051 1.706 -2.898 1.00 . A A . 8 PRO HD2 1 1 42 26377 1 1 8 PRO HD3 H -5.204 1.377 -4.635 1.00 . A A . 8 PRO HD3 1 1 42 26378 1 1 8 PRO HG2 H -2.826 2.251 -3.071 1.00 . A A . 8 PRO HG2 1 1 42 26379 1 1 8 PRO HG3 H -3.275 2.621 -4.746 1.00 . A A . 8 PRO HG3 1 1 42 26380 1 1 8 PRO N N -4.299 -0.175 -3.515 1.00 . A A . 8 PRO N 1 1 42 26381 1 1 8 PRO O O -1.094 -1.403 -2.427 1.00 . A A . 8 PRO O 1 1 42 26382 1 1 9 CYS C C -2.693 -1.337 0.803 1.00 . A A . 9 CYS C 1 1 42 26383 1 1 9 CYS CA C -1.982 -0.290 -0.051 1.00 . A A . 9 CYS CA 1 1 42 26384 1 1 9 CYS CB C -1.960 1.060 0.672 1.00 . A A . 9 CYS CB 1 1 42 26385 1 1 9 CYS H H -3.446 0.378 -1.427 1.00 . A A . 9 CYS H 1 1 42 26386 1 1 9 CYS HA H -0.967 -0.613 -0.218 1.00 . A A . 9 CYS HA 1 1 42 26387 1 1 9 CYS HB2 H -2.279 1.831 -0.012 1.00 . A A . 9 CYS HB2 1 1 42 26388 1 1 9 CYS HB3 H -2.642 1.025 1.509 1.00 . A A . 9 CYS HB3 1 1 42 26389 1 1 9 CYS N N -2.625 -0.152 -1.354 1.00 . A A . 9 CYS N 1 1 42 26390 1 1 9 CYS O O -2.988 -1.105 1.976 1.00 . A A . 9 CYS O 1 1 42 26391 1 1 9 CYS SG S -0.322 1.535 1.311 1.00 . A A . 9 CYS SG 1 1 42 26392 1 1 10 CYS C C -3.267 -4.928 0.301 1.00 . A A . 10 CYS C 1 1 42 26393 1 1 10 CYS CA C -3.638 -3.580 0.910 1.00 . A A . 10 CYS CA 1 1 42 26394 1 1 10 CYS CB C -5.163 -3.394 0.878 1.00 . A A . 10 CYS CB 1 1 42 26395 1 1 10 CYS H H -2.702 -2.621 -0.729 1.00 . A A . 10 CYS H 1 1 42 26396 1 1 10 CYS HA H -3.306 -3.564 1.938 1.00 . A A . 10 CYS HA 1 1 42 26397 1 1 10 CYS HB2 H -5.616 -4.271 0.440 1.00 . A A . 10 CYS HB2 1 1 42 26398 1 1 10 CYS HB3 H -5.522 -3.283 1.891 1.00 . A A . 10 CYS HB3 1 1 42 26399 1 1 10 CYS N N -2.963 -2.494 0.207 1.00 . A A . 10 CYS N 1 1 42 26400 1 1 10 CYS O O -3.327 -5.109 -0.915 1.00 . A A . 10 CYS O 1 1 42 26401 1 1 10 CYS SG S -5.740 -1.948 -0.074 1.00 . A A . 10 CYS SG 1 1 42 26402 1 1 11 ARG C C -3.648 -7.862 -0.069 1.00 . A A . 11 ARG C 1 1 42 26403 1 1 11 ARG CA C -2.503 -7.204 0.698 1.00 . A A . 11 ARG CA 1 1 42 26404 1 1 11 ARG CB C -2.089 -8.076 1.887 1.00 . A A . 11 ARG CB 1 1 42 26405 1 1 11 ARG CD C -0.788 -10.137 2.502 1.00 . A A . 11 ARG CD 1 1 42 26406 1 1 11 ARG CG C -1.750 -9.509 1.507 1.00 . A A . 11 ARG CG 1 1 42 26407 1 1 11 ARG CZ C 1.245 -10.590 1.186 1.00 . A A . 11 ARG CZ 1 1 42 26408 1 1 11 ARG H H -2.856 -5.670 2.113 1.00 . A A . 11 ARG H 1 1 42 26409 1 1 11 ARG HA H -1.659 -7.096 0.033 1.00 . A A . 11 ARG HA 1 1 42 26410 1 1 11 ARG HB2 H -1.219 -7.637 2.353 1.00 . A A . 11 ARG HB2 1 1 42 26411 1 1 11 ARG HB3 H -2.896 -8.097 2.603 1.00 . A A . 11 ARG HB3 1 1 42 26412 1 1 11 ARG HD2 H -0.252 -9.349 3.011 1.00 . A A . 11 ARG HD2 1 1 42 26413 1 1 11 ARG HD3 H -1.356 -10.707 3.222 1.00 . A A . 11 ARG HD3 1 1 42 26414 1 1 11 ARG HE H 0.016 -11.986 1.910 1.00 . A A . 11 ARG HE 1 1 42 26415 1 1 11 ARG HG2 H -2.660 -10.090 1.486 1.00 . A A . 11 ARG HG2 1 1 42 26416 1 1 11 ARG HG3 H -1.295 -9.513 0.527 1.00 . A A . 11 ARG HG3 1 1 42 26417 1 1 11 ARG HH11 H 0.875 -8.627 1.507 1.00 . A A . 11 ARG HH11 1 1 42 26418 1 1 11 ARG HH12 H 2.299 -8.973 0.584 1.00 . A A . 11 ARG HH12 1 1 42 26419 1 1 11 ARG HH21 H 1.889 -12.442 0.696 1.00 . A A . 11 ARG HH21 1 1 42 26420 1 1 11 ARG HH22 H 2.874 -11.138 0.123 1.00 . A A . 11 ARG HH22 1 1 42 26421 1 1 11 ARG N N -2.883 -5.873 1.154 1.00 . A A . 11 ARG N 1 1 42 26422 1 1 11 ARG NE N 0.175 -11.021 1.850 1.00 . A A . 11 ARG NE 1 1 42 26423 1 1 11 ARG NH1 N 1.493 -9.290 1.084 1.00 . A A . 11 ARG NH1 1 1 42 26424 1 1 11 ARG NH2 N 2.070 -11.462 0.622 1.00 . A A . 11 ARG NH2 1 1 42 26425 1 1 11 ARG O O -3.655 -7.873 -1.300 1.00 . A A . 11 ARG O 1 1 42 26426 1 1 12 GLN C C -7.050 -8.811 0.820 1.00 . A A . 12 GLN C 1 1 42 26427 1 1 12 GLN CA C -5.759 -9.068 0.042 1.00 . A A . 12 GLN CA 1 1 42 26428 1 1 12 GLN CB C -5.508 -10.573 -0.058 1.00 . A A . 12 GLN CB 1 1 42 26429 1 1 12 GLN CD C -7.580 -11.520 -1.151 1.00 . A A . 12 GLN CD 1 1 42 26430 1 1 12 GLN CG C -6.104 -11.208 -1.304 1.00 . A A . 12 GLN CG 1 1 42 26431 1 1 12 GLN H H -4.554 -8.374 1.639 1.00 . A A . 12 GLN H 1 1 42 26432 1 1 12 GLN HA H -5.869 -8.667 -0.954 1.00 . A A . 12 GLN HA 1 1 42 26433 1 1 12 GLN HB2 H -4.443 -10.749 -0.064 1.00 . A A . 12 GLN HB2 1 1 42 26434 1 1 12 GLN HB3 H -5.939 -11.055 0.807 1.00 . A A . 12 GLN HB3 1 1 42 26435 1 1 12 GLN HE21 H -8.029 -10.220 -2.587 1.00 . A A . 12 GLN HE21 1 1 42 26436 1 1 12 GLN HE22 H -9.370 -11.044 -1.873 1.00 . A A . 12 GLN HE22 1 1 42 26437 1 1 12 GLN HG2 H -5.980 -10.528 -2.134 1.00 . A A . 12 GLN HG2 1 1 42 26438 1 1 12 GLN HG3 H -5.576 -12.127 -1.512 1.00 . A A . 12 GLN HG3 1 1 42 26439 1 1 12 GLN N N -4.614 -8.410 0.663 1.00 . A A . 12 GLN N 1 1 42 26440 1 1 12 GLN NE2 N -8.410 -10.861 -1.951 1.00 . A A . 12 GLN NE2 1 1 42 26441 1 1 12 GLN O O -8.090 -9.392 0.508 1.00 . A A . 12 GLN O 1 1 42 26442 1 1 12 GLN OE1 O -7.969 -12.344 -0.323 1.00 . A A . 12 GLN OE1 1 1 42 26443 1 1 13 CYS C C -7.807 -6.651 3.766 1.00 . A A . 13 CYS C 1 1 42 26444 1 1 13 CYS CA C -8.159 -7.617 2.637 1.00 . A A . 13 CYS CA 1 1 42 26445 1 1 13 CYS CB C -8.776 -8.891 3.225 1.00 . A A . 13 CYS CB 1 1 42 26446 1 1 13 CYS H H -6.135 -7.503 2.028 1.00 . A A . 13 CYS H 1 1 42 26447 1 1 13 CYS HA H -8.884 -7.145 1.991 1.00 . A A . 13 CYS HA 1 1 42 26448 1 1 13 CYS HB2 H -9.073 -9.544 2.420 1.00 . A A . 13 CYS HB2 1 1 42 26449 1 1 13 CYS HB3 H -8.037 -9.391 3.833 1.00 . A A . 13 CYS HB3 1 1 42 26450 1 1 13 CYS N N -6.986 -7.940 1.827 1.00 . A A . 13 CYS N 1 1 42 26451 1 1 13 CYS O O -8.646 -5.862 4.200 1.00 . A A . 13 CYS O 1 1 42 26452 1 1 13 CYS SG S -10.243 -8.595 4.265 1.00 . A A . 13 CYS SG 1 1 42 26453 1 1 14 LYS C C -5.035 -4.895 4.854 1.00 . A A . 14 LYS C 1 1 42 26454 1 1 14 LYS CA C -6.126 -5.846 5.329 1.00 . A A . 14 LYS CA 1 1 42 26455 1 1 14 LYS CB C -5.614 -6.680 6.505 1.00 . A A . 14 LYS CB 1 1 42 26456 1 1 14 LYS CD C -5.881 -8.911 7.630 1.00 . A A . 14 LYS CD 1 1 42 26457 1 1 14 LYS CE C -6.548 -10.235 7.295 1.00 . A A . 14 LYS CE 1 1 42 26458 1 1 14 LYS CG C -6.596 -7.744 6.968 1.00 . A A . 14 LYS CG 1 1 42 26459 1 1 14 LYS H H -5.938 -7.366 3.869 1.00 . A A . 14 LYS H 1 1 42 26460 1 1 14 LYS HA H -6.975 -5.265 5.655 1.00 . A A . 14 LYS HA 1 1 42 26461 1 1 14 LYS HB2 H -4.697 -7.170 6.212 1.00 . A A . 14 LYS HB2 1 1 42 26462 1 1 14 LYS HB3 H -5.410 -6.022 7.336 1.00 . A A . 14 LYS HB3 1 1 42 26463 1 1 14 LYS HD2 H -4.858 -8.937 7.285 1.00 . A A . 14 LYS HD2 1 1 42 26464 1 1 14 LYS HD3 H -5.898 -8.770 8.701 1.00 . A A . 14 LYS HD3 1 1 42 26465 1 1 14 LYS HE2 H -6.302 -10.952 8.064 1.00 . A A . 14 LYS HE2 1 1 42 26466 1 1 14 LYS HE3 H -7.618 -10.088 7.270 1.00 . A A . 14 LYS HE3 1 1 42 26467 1 1 14 LYS HG2 H -7.279 -7.304 7.679 1.00 . A A . 14 LYS HG2 1 1 42 26468 1 1 14 LYS HG3 H -7.147 -8.109 6.114 1.00 . A A . 14 LYS HG3 1 1 42 26469 1 1 14 LYS HZ1 H -5.155 -10.395 5.746 1.00 . A A . 14 LYS HZ1 1 1 42 26470 1 1 14 LYS HZ2 H -6.054 -11.804 6.007 1.00 . A A . 14 LYS HZ2 1 1 42 26471 1 1 14 LYS HZ3 H -6.766 -10.479 5.232 1.00 . A A . 14 LYS HZ3 1 1 42 26472 1 1 14 LYS N N -6.567 -6.717 4.246 1.00 . A A . 14 LYS N 1 1 42 26473 1 1 14 LYS NZ N -6.099 -10.765 5.978 1.00 . A A . 14 LYS NZ 1 1 42 26474 1 1 14 LYS O O -4.341 -5.168 3.874 1.00 . A A . 14 LYS O 1 1 42 26475 1 1 15 LEU C C -2.485 -3.408 5.224 1.00 . A A . 15 LEU C 1 1 42 26476 1 1 15 LEU CA C -3.876 -2.786 5.211 1.00 . A A . 15 LEU CA 1 1 42 26477 1 1 15 LEU CB C -3.927 -1.610 6.188 1.00 . A A . 15 LEU CB 1 1 42 26478 1 1 15 LEU CD1 C -5.497 -0.570 7.842 1.00 . A A . 15 LEU CD1 1 1 42 26479 1 1 15 LEU CD2 C -5.512 0.186 5.459 1.00 . A A . 15 LEU CD2 1 1 42 26480 1 1 15 LEU CG C -5.312 -0.996 6.394 1.00 . A A . 15 LEU CG 1 1 42 26481 1 1 15 LEU H H -5.468 -3.618 6.330 1.00 . A A . 15 LEU H 1 1 42 26482 1 1 15 LEU HA H -4.089 -2.427 4.215 1.00 . A A . 15 LEU HA 1 1 42 26483 1 1 15 LEU HB2 H -3.560 -1.951 7.146 1.00 . A A . 15 LEU HB2 1 1 42 26484 1 1 15 LEU HB3 H -3.266 -0.838 5.823 1.00 . A A . 15 LEU HB3 1 1 42 26485 1 1 15 LEU HD11 H -4.531 -0.383 8.288 1.00 . A A . 15 LEU HD11 1 1 42 26486 1 1 15 LEU HD12 H -6.092 0.331 7.880 1.00 . A A . 15 LEU HD12 1 1 42 26487 1 1 15 LEU HD13 H -5.999 -1.356 8.387 1.00 . A A . 15 LEU HD13 1 1 42 26488 1 1 15 LEU HD21 H -4.597 0.757 5.401 1.00 . A A . 15 LEU HD21 1 1 42 26489 1 1 15 LEU HD22 H -5.774 -0.174 4.475 1.00 . A A . 15 LEU HD22 1 1 42 26490 1 1 15 LEU HD23 H -6.306 0.813 5.836 1.00 . A A . 15 LEU HD23 1 1 42 26491 1 1 15 LEU HG H -6.065 -1.736 6.165 1.00 . A A . 15 LEU HG 1 1 42 26492 1 1 15 LEU N N -4.886 -3.778 5.557 1.00 . A A . 15 LEU N 1 1 42 26493 1 1 15 LEU O O -2.092 -4.049 6.199 1.00 . A A . 15 LEU O 1 1 42 26494 1 1 16 LYS C C 0.448 -3.352 5.247 1.00 . A A . 16 LYS C 1 1 42 26495 1 1 16 LYS CA C -0.392 -3.759 4.036 1.00 . A A . 16 LYS CA 1 1 42 26496 1 1 16 LYS CB C 0.278 -3.280 2.747 1.00 . A A . 16 LYS CB 1 1 42 26497 1 1 16 LYS CD C 0.590 -3.648 0.281 1.00 . A A . 16 LYS CD 1 1 42 26498 1 1 16 LYS CE C 0.067 -4.445 -0.903 1.00 . A A . 16 LYS CE 1 1 42 26499 1 1 16 LYS CG C 0.174 -4.274 1.602 1.00 . A A . 16 LYS CG 1 1 42 26500 1 1 16 LYS H H -2.107 -2.694 3.394 1.00 . A A . 16 LYS H 1 1 42 26501 1 1 16 LYS HA H -0.473 -4.837 4.012 1.00 . A A . 16 LYS HA 1 1 42 26502 1 1 16 LYS HB2 H -0.187 -2.356 2.436 1.00 . A A . 16 LYS HB2 1 1 42 26503 1 1 16 LYS HB3 H 1.324 -3.098 2.943 1.00 . A A . 16 LYS HB3 1 1 42 26504 1 1 16 LYS HD2 H 0.195 -2.644 0.229 1.00 . A A . 16 LYS HD2 1 1 42 26505 1 1 16 LYS HD3 H 1.669 -3.615 0.234 1.00 . A A . 16 LYS HD3 1 1 42 26506 1 1 16 LYS HE2 H -0.107 -5.463 -0.587 1.00 . A A . 16 LYS HE2 1 1 42 26507 1 1 16 LYS HE3 H -0.864 -4.007 -1.232 1.00 . A A . 16 LYS HE3 1 1 42 26508 1 1 16 LYS HG2 H 0.818 -5.115 1.809 1.00 . A A . 16 LYS HG2 1 1 42 26509 1 1 16 LYS HG3 H -0.849 -4.612 1.523 1.00 . A A . 16 LYS HG3 1 1 42 26510 1 1 16 LYS HZ1 H 1.996 -4.604 -1.688 1.00 . A A . 16 LYS HZ1 1 1 42 26511 1 1 16 LYS HZ2 H 0.790 -5.208 -2.708 1.00 . A A . 16 LYS HZ2 1 1 42 26512 1 1 16 LYS HZ3 H 0.996 -3.538 -2.539 1.00 . A A . 16 LYS HZ3 1 1 42 26513 1 1 16 LYS N N -1.741 -3.215 4.140 1.00 . A A . 16 LYS N 1 1 42 26514 1 1 16 LYS NZ N 1.030 -4.449 -2.039 1.00 . A A . 16 LYS NZ 1 1 42 26515 1 1 16 LYS O O 0.283 -2.258 5.785 1.00 . A A . 16 LYS O 1 1 42 26516 1 1 17 PRO C C 3.079 -2.709 6.645 1.00 . A A . 17 PRO C 1 1 42 26517 1 1 17 PRO CA C 2.222 -3.954 6.848 1.00 . A A . 17 PRO CA 1 1 42 26518 1 1 17 PRO CB C 3.108 -5.202 6.956 1.00 . A A . 17 PRO CB 1 1 42 26519 1 1 17 PRO CD C 1.626 -5.558 5.117 1.00 . A A . 17 PRO CD 1 1 42 26520 1 1 17 PRO CG C 3.000 -5.875 5.629 1.00 . A A . 17 PRO CG 1 1 42 26521 1 1 17 PRO HA H 1.643 -3.843 7.753 1.00 . A A . 17 PRO HA 1 1 42 26522 1 1 17 PRO HB2 H 4.126 -4.907 7.166 1.00 . A A . 17 PRO HB2 1 1 42 26523 1 1 17 PRO HB3 H 2.743 -5.837 7.749 1.00 . A A . 17 PRO HB3 1 1 42 26524 1 1 17 PRO HD2 H 1.624 -5.518 4.037 1.00 . A A . 17 PRO HD2 1 1 42 26525 1 1 17 PRO HD3 H 0.911 -6.284 5.473 1.00 . A A . 17 PRO HD3 1 1 42 26526 1 1 17 PRO HG2 H 3.751 -5.486 4.957 1.00 . A A . 17 PRO HG2 1 1 42 26527 1 1 17 PRO HG3 H 3.119 -6.942 5.748 1.00 . A A . 17 PRO HG3 1 1 42 26528 1 1 17 PRO N N 1.361 -4.231 5.694 1.00 . A A . 17 PRO N 1 1 42 26529 1 1 17 PRO O O 3.853 -2.625 5.692 1.00 . A A . 17 PRO O 1 1 42 26530 1 1 18 ALA C C 5.170 -0.765 7.183 1.00 . A A . 18 ALA C 1 1 42 26531 1 1 18 ALA CA C 3.696 -0.497 7.475 1.00 . A A . 18 ALA CA 1 1 42 26532 1 1 18 ALA CB C 3.548 0.289 8.769 1.00 . A A . 18 ALA CB 1 1 42 26533 1 1 18 ALA H H 2.301 -1.868 8.286 1.00 . A A . 18 ALA H 1 1 42 26534 1 1 18 ALA HA H 3.283 0.097 6.672 1.00 . A A . 18 ALA HA 1 1 42 26535 1 1 18 ALA HB1 H 4.381 0.070 9.420 1.00 . A A . 18 ALA HB1 1 1 42 26536 1 1 18 ALA HB2 H 3.531 1.346 8.548 1.00 . A A . 18 ALA HB2 1 1 42 26537 1 1 18 ALA HB3 H 2.626 0.008 9.257 1.00 . A A . 18 ALA HB3 1 1 42 26538 1 1 18 ALA N N 2.935 -1.742 7.550 1.00 . A A . 18 ALA N 1 1 42 26539 1 1 18 ALA O O 5.736 -1.751 7.654 1.00 . A A . 18 ALA O 1 1 42 26540 1 1 19 GLY C C 7.389 -1.125 5.001 1.00 . A A . 19 GLY C 1 1 42 26541 1 1 19 GLY CA C 7.182 -0.052 6.053 1.00 . A A . 19 GLY CA 1 1 42 26542 1 1 19 GLY H H 5.280 0.878 6.047 1.00 . A A . 19 GLY H 1 1 42 26543 1 1 19 GLY HA2 H 7.732 -0.323 6.941 1.00 . A A . 19 GLY HA2 1 1 42 26544 1 1 19 GLY HA3 H 7.563 0.885 5.676 1.00 . A A . 19 GLY HA3 1 1 42 26545 1 1 19 GLY N N 5.783 0.114 6.398 1.00 . A A . 19 GLY N 1 1 42 26546 1 1 19 GLY O O 8.458 -1.731 4.923 1.00 . A A . 19 GLY O 1 1 42 26547 1 1 20 THR C C 5.938 -1.788 1.813 1.00 . A A . 20 THR C 1 1 42 26548 1 1 20 THR CA C 6.426 -2.365 3.138 1.00 . A A . 20 THR CA 1 1 42 26549 1 1 20 THR CB C 5.585 -3.585 3.520 1.00 . A A . 20 THR CB 1 1 42 26550 1 1 20 THR CG2 C 5.577 -4.668 2.461 1.00 . A A . 20 THR CG2 1 1 42 26551 1 1 20 THR H H 5.536 -0.843 4.305 1.00 . A A . 20 THR H 1 1 42 26552 1 1 20 THR HA H 7.457 -2.667 3.029 1.00 . A A . 20 THR HA 1 1 42 26553 1 1 20 THR HB H 4.563 -3.269 3.676 1.00 . A A . 20 THR HB 1 1 42 26554 1 1 20 THR HG1 H 7.001 -4.334 4.646 1.00 . A A . 20 THR HG1 1 1 42 26555 1 1 20 THR HG21 H 5.959 -4.267 1.534 1.00 . A A . 20 THR HG21 1 1 42 26556 1 1 20 THR HG22 H 6.200 -5.489 2.783 1.00 . A A . 20 THR HG22 1 1 42 26557 1 1 20 THR HG23 H 4.566 -5.019 2.313 1.00 . A A . 20 THR HG23 1 1 42 26558 1 1 20 THR N N 6.361 -1.360 4.191 1.00 . A A . 20 THR N 1 1 42 26559 1 1 20 THR O O 4.933 -1.079 1.768 1.00 . A A . 20 THR O 1 1 42 26560 1 1 20 THR OG1 O 6.059 -4.164 4.722 1.00 . A A . 20 THR OG1 1 1 42 26561 1 1 21 THR C C 4.888 -2.062 -0.968 1.00 . A A . 21 THR C 1 1 42 26562 1 1 21 THR CA C 6.291 -1.602 -0.586 1.00 . A A . 21 THR CA 1 1 42 26563 1 1 21 THR CB C 7.304 -2.073 -1.632 1.00 . A A . 21 THR CB 1 1 42 26564 1 1 21 THR CG2 C 7.968 -0.930 -2.367 1.00 . A A . 21 THR CG2 1 1 42 26565 1 1 21 THR H H 7.447 -2.663 0.836 1.00 . A A . 21 THR H 1 1 42 26566 1 1 21 THR HA H 6.303 -0.523 -0.550 1.00 . A A . 21 THR HA 1 1 42 26567 1 1 21 THR HB H 6.796 -2.686 -2.363 1.00 . A A . 21 THR HB 1 1 42 26568 1 1 21 THR HG1 H 8.883 -2.287 -0.492 1.00 . A A . 21 THR HG1 1 1 42 26569 1 1 21 THR HG21 H 7.678 0.005 -1.911 1.00 . A A . 21 THR HG21 1 1 42 26570 1 1 21 THR HG22 H 9.041 -1.041 -2.311 1.00 . A A . 21 THR HG22 1 1 42 26571 1 1 21 THR HG23 H 7.658 -0.939 -3.401 1.00 . A A . 21 THR HG23 1 1 42 26572 1 1 21 THR N N 6.655 -2.094 0.738 1.00 . A A . 21 THR N 1 1 42 26573 1 1 21 THR O O 4.588 -3.255 -0.950 1.00 . A A . 21 THR O 1 1 42 26574 1 1 21 THR OG1 O 8.326 -2.851 -1.032 1.00 . A A . 21 THR OG1 1 1 42 26575 1 1 22 CYS C C 2.468 -1.306 -3.200 1.00 . A A . 22 CYS C 1 1 42 26576 1 1 22 CYS CA C 2.659 -1.413 -1.692 1.00 . A A . 22 CYS CA 1 1 42 26577 1 1 22 CYS CB C 1.685 -0.476 -0.977 1.00 . A A . 22 CYS CB 1 1 42 26578 1 1 22 CYS H H 4.328 -0.172 -1.303 1.00 . A A . 22 CYS H 1 1 42 26579 1 1 22 CYS HA H 2.452 -2.426 -1.388 1.00 . A A . 22 CYS HA 1 1 42 26580 1 1 22 CYS HB2 H 0.676 -0.789 -1.191 1.00 . A A . 22 CYS HB2 1 1 42 26581 1 1 22 CYS HB3 H 1.857 -0.535 0.088 1.00 . A A . 22 CYS HB3 1 1 42 26582 1 1 22 CYS N N 4.031 -1.105 -1.310 1.00 . A A . 22 CYS N 1 1 42 26583 1 1 22 CYS O O 1.788 -2.133 -3.808 1.00 . A A . 22 CYS O 1 1 42 26584 1 1 22 CYS SG S 1.835 1.272 -1.468 1.00 . A A . 22 CYS SG 1 1 42 26585 1 1 23 TRP C C 4.119 -0.711 -5.981 1.00 . A A . 23 TRP C 1 1 42 26586 1 1 23 TRP CA C 2.952 -0.076 -5.237 1.00 . A A . 23 TRP CA 1 1 42 26587 1 1 23 TRP CB C 2.873 1.420 -5.558 1.00 . A A . 23 TRP CB 1 1 42 26588 1 1 23 TRP CD1 C 1.168 0.856 -7.383 1.00 . A A . 23 TRP CD1 1 1 42 26589 1 1 23 TRP CD2 C 1.487 3.047 -7.074 1.00 . A A . 23 TRP CD2 1 1 42 26590 1 1 23 TRP CE2 C 0.534 2.872 -8.095 1.00 . A A . 23 TRP CE2 1 1 42 26591 1 1 23 TRP CE3 C 1.848 4.343 -6.706 1.00 . A A . 23 TRP CE3 1 1 42 26592 1 1 23 TRP CG C 1.878 1.744 -6.631 1.00 . A A . 23 TRP CG 1 1 42 26593 1 1 23 TRP CH2 C 0.313 5.206 -8.368 1.00 . A A . 23 TRP CH2 1 1 42 26594 1 1 23 TRP CZ2 C -0.061 3.947 -8.749 1.00 . A A . 23 TRP CZ2 1 1 42 26595 1 1 23 TRP CZ3 C 1.259 5.410 -7.357 1.00 . A A . 23 TRP CZ3 1 1 42 26596 1 1 23 TRP H H 3.594 0.346 -3.264 1.00 . A A . 23 TRP H 1 1 42 26597 1 1 23 TRP HA H 2.042 -0.549 -5.561 1.00 . A A . 23 TRP HA 1 1 42 26598 1 1 23 TRP HB2 H 2.589 1.958 -4.667 1.00 . A A . 23 TRP HB2 1 1 42 26599 1 1 23 TRP HB3 H 3.843 1.764 -5.887 1.00 . A A . 23 TRP HB3 1 1 42 26600 1 1 23 TRP HD1 H 1.245 -0.214 -7.285 1.00 . A A . 23 TRP HD1 1 1 42 26601 1 1 23 TRP HE1 H -0.252 1.107 -8.910 1.00 . A A . 23 TRP HE1 1 1 42 26602 1 1 23 TRP HE3 H 2.574 4.518 -5.928 1.00 . A A . 23 TRP HE3 1 1 42 26603 1 1 23 TRP HH2 H -0.121 6.068 -8.852 1.00 . A A . 23 TRP HH2 1 1 42 26604 1 1 23 TRP HZ2 H -0.793 3.805 -9.529 1.00 . A A . 23 TRP HZ2 1 1 42 26605 1 1 23 TRP HZ3 H 1.527 6.421 -7.085 1.00 . A A . 23 TRP HZ3 1 1 42 26606 1 1 23 TRP N N 3.067 -0.283 -3.800 1.00 . A A . 23 TRP N 1 1 42 26607 1 1 23 TRP NE1 N 0.355 1.525 -8.265 1.00 . A A . 23 TRP NE1 1 1 42 26608 1 1 23 TRP O O 3.961 -1.731 -6.652 1.00 . A A . 23 TRP O 1 1 42 26609 1 1 24 LYS C C 6.334 -0.583 -8.030 1.00 . A A . 24 LYS C 1 1 42 26610 1 1 24 LYS CA C 6.489 -0.609 -6.513 1.00 . A A . 24 LYS CA 1 1 42 26611 1 1 24 LYS CB C 6.784 -2.027 -6.035 1.00 . A A . 24 LYS CB 1 1 42 26612 1 1 24 LYS CD C 9.080 -2.880 -5.459 1.00 . A A . 24 LYS CD 1 1 42 26613 1 1 24 LYS CE C 9.872 -4.149 -5.727 1.00 . A A . 24 LYS CE 1 1 42 26614 1 1 24 LYS CG C 8.087 -2.596 -6.575 1.00 . A A . 24 LYS CG 1 1 42 26615 1 1 24 LYS H H 5.350 0.701 -5.306 1.00 . A A . 24 LYS H 1 1 42 26616 1 1 24 LYS HA H 7.314 0.030 -6.237 1.00 . A A . 24 LYS HA 1 1 42 26617 1 1 24 LYS HB2 H 6.835 -2.020 -4.957 1.00 . A A . 24 LYS HB2 1 1 42 26618 1 1 24 LYS HB3 H 5.977 -2.671 -6.345 1.00 . A A . 24 LYS HB3 1 1 42 26619 1 1 24 LYS HD2 H 9.766 -2.050 -5.380 1.00 . A A . 24 LYS HD2 1 1 42 26620 1 1 24 LYS HD3 H 8.540 -2.992 -4.530 1.00 . A A . 24 LYS HD3 1 1 42 26621 1 1 24 LYS HE2 H 9.864 -4.346 -6.789 1.00 . A A . 24 LYS HE2 1 1 42 26622 1 1 24 LYS HE3 H 10.890 -3.999 -5.397 1.00 . A A . 24 LYS HE3 1 1 42 26623 1 1 24 LYS HG2 H 7.877 -3.517 -7.098 1.00 . A A . 24 LYS HG2 1 1 42 26624 1 1 24 LYS HG3 H 8.523 -1.883 -7.260 1.00 . A A . 24 LYS HG3 1 1 42 26625 1 1 24 LYS HZ1 H 8.270 -5.366 -5.164 1.00 . A A . 24 LYS HZ1 1 1 42 26626 1 1 24 LYS HZ2 H 9.726 -6.202 -5.369 1.00 . A A . 24 LYS HZ2 1 1 42 26627 1 1 24 LYS HZ3 H 9.487 -5.248 -3.993 1.00 . A A . 24 LYS HZ3 1 1 42 26628 1 1 24 LYS N N 5.291 -0.104 -5.856 1.00 . A A . 24 LYS N 1 1 42 26629 1 1 24 LYS NZ N 9.299 -5.323 -5.014 1.00 . A A . 24 LYS NZ 1 1 42 26630 1 1 24 LYS O O 6.902 -1.415 -8.738 1.00 . A A . 24 LYS O 1 1 42 26631 1 1 25 THR C C 6.640 0.857 -10.675 1.00 . A A . 25 THR C 1 1 42 26632 1 1 25 THR CA C 5.337 0.523 -9.956 1.00 . A A . 25 THR CA 1 1 42 26633 1 1 25 THR CB C 4.293 1.611 -10.221 1.00 . A A . 25 THR CB 1 1 42 26634 1 1 25 THR CG2 C 3.595 1.461 -11.555 1.00 . A A . 25 THR CG2 1 1 42 26635 1 1 25 THR H H 5.141 1.017 -7.908 1.00 . A A . 25 THR H 1 1 42 26636 1 1 25 THR HA H 4.965 -0.420 -10.329 1.00 . A A . 25 THR HA 1 1 42 26637 1 1 25 THR HB H 4.780 2.576 -10.210 1.00 . A A . 25 THR HB 1 1 42 26638 1 1 25 THR HG1 H 3.292 2.453 -8.764 1.00 . A A . 25 THR HG1 1 1 42 26639 1 1 25 THR HG21 H 3.451 0.412 -11.770 1.00 . A A . 25 THR HG21 1 1 42 26640 1 1 25 THR HG22 H 2.635 1.955 -11.517 1.00 . A A . 25 THR HG22 1 1 42 26641 1 1 25 THR HG23 H 4.199 1.907 -12.331 1.00 . A A . 25 THR HG23 1 1 42 26642 1 1 25 THR N N 5.564 0.382 -8.523 1.00 . A A . 25 THR N 1 1 42 26643 1 1 25 THR O O 7.664 1.104 -10.038 1.00 . A A . 25 THR O 1 1 42 26644 1 1 25 THR OG1 O 3.298 1.605 -9.214 1.00 . A A . 25 THR OG1 1 1 42 26645 1 1 26 SER C C 7.924 2.672 -13.022 1.00 . A A . 26 SER C 1 1 42 26646 1 1 26 SER CA C 7.781 1.166 -12.805 1.00 . A A . 26 SER CA 1 1 42 26647 1 1 26 SER CB C 7.705 0.448 -14.154 1.00 . A A . 26 SER CB 1 1 42 26648 1 1 26 SER H H 5.754 0.656 -12.456 1.00 . A A . 26 SER H 1 1 42 26649 1 1 26 SER HA H 8.645 0.809 -12.266 1.00 . A A . 26 SER HA 1 1 42 26650 1 1 26 SER HB2 H 7.244 1.099 -14.881 1.00 . A A . 26 SER HB2 1 1 42 26651 1 1 26 SER HB3 H 8.703 0.193 -14.480 1.00 . A A . 26 SER HB3 1 1 42 26652 1 1 26 SER HG H 7.457 -1.482 -14.378 1.00 . A A . 26 SER HG 1 1 42 26653 1 1 26 SER N N 6.598 0.862 -12.004 1.00 . A A . 26 SER N 1 1 42 26654 1 1 26 SER O O 8.167 3.127 -14.140 1.00 . A A . 26 SER O 1 1 42 26655 1 1 26 SER OG O 6.939 -0.741 -14.057 1.00 . A A . 26 SER OG 1 1 42 26656 1 1 27 VAL C C 7.513 5.508 -10.657 1.00 . A A . 27 VAL C 1 1 42 26657 1 1 27 VAL CA C 7.887 4.891 -12.000 1.00 . A A . 27 VAL CA 1 1 42 26658 1 1 27 VAL CB C 6.981 5.492 -13.096 1.00 . A A . 27 VAL CB 1 1 42 26659 1 1 27 VAL CG1 C 5.525 5.131 -12.844 1.00 . A A . 27 VAL CG1 1 1 42 26660 1 1 27 VAL CG2 C 7.157 7.002 -13.169 1.00 . A A . 27 VAL CG2 1 1 42 26661 1 1 27 VAL H H 7.588 3.011 -11.083 1.00 . A A . 27 VAL H 1 1 42 26662 1 1 27 VAL HA H 8.913 5.140 -12.229 1.00 . A A . 27 VAL HA 1 1 42 26663 1 1 27 VAL HB H 7.272 5.072 -14.047 1.00 . A A . 27 VAL HB 1 1 42 26664 1 1 27 VAL HG11 H 5.225 5.500 -11.874 1.00 . A A . 27 VAL HG11 1 1 42 26665 1 1 27 VAL HG12 H 4.906 5.578 -13.607 1.00 . A A . 27 VAL HG12 1 1 42 26666 1 1 27 VAL HG13 H 5.410 4.057 -12.871 1.00 . A A . 27 VAL HG13 1 1 42 26667 1 1 27 VAL HG21 H 8.198 7.235 -13.336 1.00 . A A . 27 VAL HG21 1 1 42 26668 1 1 27 VAL HG22 H 6.565 7.394 -13.983 1.00 . A A . 27 VAL HG22 1 1 42 26669 1 1 27 VAL HG23 H 6.833 7.448 -12.240 1.00 . A A . 27 VAL HG23 1 1 42 26670 1 1 27 VAL N N 7.776 3.436 -11.943 1.00 . A A . 27 VAL N 1 1 42 26671 1 1 27 VAL O O 8.091 6.511 -10.237 1.00 . A A . 27 VAL O 1 1 42 26672 1 1 28 SER C C 6.866 4.757 -7.559 1.00 . A A . 28 SER C 1 1 42 26673 1 1 28 SER CA C 6.069 5.383 -8.700 1.00 . A A . 28 SER CA 1 1 42 26674 1 1 28 SER CB C 4.578 5.074 -8.535 1.00 . A A . 28 SER CB 1 1 42 26675 1 1 28 SER H H 6.114 4.109 -10.386 1.00 . A A . 28 SER H 1 1 42 26676 1 1 28 SER HA H 6.209 6.451 -8.674 1.00 . A A . 28 SER HA 1 1 42 26677 1 1 28 SER HB2 H 4.215 4.579 -9.423 1.00 . A A . 28 SER HB2 1 1 42 26678 1 1 28 SER HB3 H 4.436 4.428 -7.681 1.00 . A A . 28 SER HB3 1 1 42 26679 1 1 28 SER HG H 3.984 6.862 -9.071 1.00 . A A . 28 SER HG 1 1 42 26680 1 1 28 SER N N 6.536 4.901 -9.993 1.00 . A A . 28 SER N 1 1 42 26681 1 1 28 SER O O 7.730 5.400 -6.963 1.00 . A A . 28 SER O 1 1 42 26682 1 1 28 SER OG O 3.830 6.261 -8.338 1.00 . A A . 28 SER OG 1 1 42 26683 1 1 29 SER C C 7.056 3.483 -4.851 1.00 . A A . 29 SER C 1 1 42 26684 1 1 29 SER CA C 7.241 2.777 -6.189 1.00 . A A . 29 SER CA 1 1 42 26685 1 1 29 SER CB C 8.731 2.627 -6.503 1.00 . A A . 29 SER CB 1 1 42 26686 1 1 29 SER H H 5.862 3.048 -7.772 1.00 . A A . 29 SER H 1 1 42 26687 1 1 29 SER HA H 6.793 1.799 -6.125 1.00 . A A . 29 SER HA 1 1 42 26688 1 1 29 SER HB2 H 9.151 3.598 -6.717 1.00 . A A . 29 SER HB2 1 1 42 26689 1 1 29 SER HB3 H 9.235 2.197 -5.650 1.00 . A A . 29 SER HB3 1 1 42 26690 1 1 29 SER HG H 9.121 2.323 -8.399 1.00 . A A . 29 SER HG 1 1 42 26691 1 1 29 SER N N 6.563 3.501 -7.260 1.00 . A A . 29 SER N 1 1 42 26692 1 1 29 SER O O 7.762 4.441 -4.536 1.00 . A A . 29 SER O 1 1 42 26693 1 1 29 SER OG O 8.934 1.786 -7.625 1.00 . A A . 29 SER OG 1 1 42 26694 1 1 30 HIS C C 5.682 2.525 -1.693 1.00 . A A . 30 HIS C 1 1 42 26695 1 1 30 HIS CA C 5.785 3.596 -2.775 1.00 . A A . 30 HIS CA 1 1 42 26696 1 1 30 HIS CB C 4.476 4.378 -2.860 1.00 . A A . 30 HIS CB 1 1 42 26697 1 1 30 HIS CD2 C 4.731 5.234 -5.288 1.00 . A A . 30 HIS CD2 1 1 42 26698 1 1 30 HIS CE1 C 4.259 7.345 -4.940 1.00 . A A . 30 HIS CE1 1 1 42 26699 1 1 30 HIS CG C 4.466 5.380 -3.970 1.00 . A A . 30 HIS CG 1 1 42 26700 1 1 30 HIS H H 5.553 2.252 -4.387 1.00 . A A . 30 HIS H 1 1 42 26701 1 1 30 HIS HA H 6.585 4.275 -2.521 1.00 . A A . 30 HIS HA 1 1 42 26702 1 1 30 HIS HB2 H 3.661 3.687 -3.030 1.00 . A A . 30 HIS HB2 1 1 42 26703 1 1 30 HIS HB3 H 4.313 4.904 -1.931 1.00 . A A . 30 HIS HB3 1 1 42 26704 1 1 30 HIS HD1 H 3.937 7.133 -2.931 1.00 . A A . 30 HIS HD1 1 1 42 26705 1 1 30 HIS HD2 H 4.988 4.309 -5.791 1.00 . A A . 30 HIS HD2 1 1 42 26706 1 1 30 HIS HE1 H 4.083 8.398 -5.099 1.00 . A A . 30 HIS HE1 1 1 42 26707 1 1 30 HIS HE2 H 4.894 6.706 -6.773 1.00 . A A . 30 HIS HE2 1 1 42 26708 1 1 30 HIS N N 6.087 3.009 -4.073 1.00 . A A . 30 HIS N 1 1 42 26709 1 1 30 HIS ND1 N 4.173 6.713 -3.783 1.00 . A A . 30 HIS ND1 1 1 42 26710 1 1 30 HIS NE2 N 4.597 6.472 -5.870 1.00 . A A . 30 HIS NE2 1 1 42 26711 1 1 30 HIS O O 5.659 1.330 -1.987 1.00 . A A . 30 HIS O 1 1 42 26712 1 1 31 TYR C C 4.211 2.287 1.450 1.00 . A A . 31 TYR C 1 1 42 26713 1 1 31 TYR CA C 5.511 2.053 0.690 1.00 . A A . 31 TYR CA 1 1 42 26714 1 1 31 TYR CB C 6.705 2.230 1.630 1.00 . A A . 31 TYR CB 1 1 42 26715 1 1 31 TYR CD1 C 8.469 0.513 2.192 1.00 . A A . 31 TYR CD1 1 1 42 26716 1 1 31 TYR CD2 C 8.451 1.429 -0.009 1.00 . A A . 31 TYR CD2 1 1 42 26717 1 1 31 TYR CE1 C 9.558 -0.270 1.862 1.00 . A A . 31 TYR CE1 1 1 42 26718 1 1 31 TYR CE2 C 9.540 0.649 -0.347 1.00 . A A . 31 TYR CE2 1 1 42 26719 1 1 31 TYR CG C 7.897 1.375 1.264 1.00 . A A . 31 TYR CG 1 1 42 26720 1 1 31 TYR CZ C 10.090 -0.199 0.592 1.00 . A A . 31 TYR CZ 1 1 42 26721 1 1 31 TYR H H 5.637 3.932 -0.274 1.00 . A A . 31 TYR H 1 1 42 26722 1 1 31 TYR HA H 5.513 1.045 0.305 1.00 . A A . 31 TYR HA 1 1 42 26723 1 1 31 TYR HB2 H 7.020 3.263 1.610 1.00 . A A . 31 TYR HB2 1 1 42 26724 1 1 31 TYR HB3 H 6.405 1.970 2.635 1.00 . A A . 31 TYR HB3 1 1 42 26725 1 1 31 TYR HD1 H 8.050 0.460 3.186 1.00 . A A . 31 TYR HD1 1 1 42 26726 1 1 31 TYR HD2 H 8.018 2.094 -0.741 1.00 . A A . 31 TYR HD2 1 1 42 26727 1 1 31 TYR HE1 H 9.989 -0.934 2.597 1.00 . A A . 31 TYR HE1 1 1 42 26728 1 1 31 TYR HE2 H 9.956 0.705 -1.342 1.00 . A A . 31 TYR HE2 1 1 42 26729 1 1 31 TYR HH H 11.036 -1.872 0.577 1.00 . A A . 31 TYR HH 1 1 42 26730 1 1 31 TYR N N 5.617 2.966 -0.441 1.00 . A A . 31 TYR N 1 1 42 26731 1 1 31 TYR O O 3.604 3.353 1.346 1.00 . A A . 31 TYR O 1 1 42 26732 1 1 31 TYR OH O 11.175 -0.977 0.259 1.00 . A A . 31 TYR OH 1 1 42 26733 1 1 32 CYS C C 2.853 1.755 4.435 1.00 . A A . 32 CYS C 1 1 42 26734 1 1 32 CYS CA C 2.556 1.390 2.987 1.00 . A A . 32 CYS CA 1 1 42 26735 1 1 32 CYS CB C 1.780 0.073 2.933 1.00 . A A . 32 CYS CB 1 1 42 26736 1 1 32 CYS H H 4.309 0.459 2.258 1.00 . A A . 32 CYS H 1 1 42 26737 1 1 32 CYS HA H 1.953 2.170 2.548 1.00 . A A . 32 CYS HA 1 1 42 26738 1 1 32 CYS HB2 H 2.075 -0.476 2.052 1.00 . A A . 32 CYS HB2 1 1 42 26739 1 1 32 CYS HB3 H 2.017 -0.512 3.811 1.00 . A A . 32 CYS HB3 1 1 42 26740 1 1 32 CYS N N 3.785 1.286 2.214 1.00 . A A . 32 CYS N 1 1 42 26741 1 1 32 CYS O O 3.900 1.399 4.975 1.00 . A A . 32 CYS O 1 1 42 26742 1 1 32 CYS SG S -0.029 0.278 2.877 1.00 . A A . 32 CYS SG 1 1 42 26743 1 1 33 THR C C 1.107 2.090 7.343 1.00 . A A . 33 THR C 1 1 42 26744 1 1 33 THR CA C 2.069 2.867 6.449 1.00 . A A . 33 THR CA 1 1 42 26745 1 1 33 THR CB C 1.818 4.369 6.594 1.00 . A A . 33 THR CB 1 1 42 26746 1 1 33 THR CG2 C 2.489 5.196 5.518 1.00 . A A . 33 THR CG2 1 1 42 26747 1 1 33 THR H H 1.103 2.706 4.576 1.00 . A A . 33 THR H 1 1 42 26748 1 1 33 THR HA H 3.082 2.648 6.753 1.00 . A A . 33 THR HA 1 1 42 26749 1 1 33 THR HB H 2.200 4.697 7.550 1.00 . A A . 33 THR HB 1 1 42 26750 1 1 33 THR HG1 H 0.285 5.578 6.753 1.00 . A A . 33 THR HG1 1 1 42 26751 1 1 33 THR HG21 H 3.540 4.951 5.479 1.00 . A A . 33 THR HG21 1 1 42 26752 1 1 33 THR HG22 H 2.034 4.981 4.562 1.00 . A A . 33 THR HG22 1 1 42 26753 1 1 33 THR HG23 H 2.372 6.245 5.745 1.00 . A A . 33 THR HG23 1 1 42 26754 1 1 33 THR N N 1.919 2.460 5.059 1.00 . A A . 33 THR N 1 1 42 26755 1 1 33 THR O O 0.834 2.492 8.474 1.00 . A A . 33 THR O 1 1 42 26756 1 1 33 THR OG1 O 0.430 4.652 6.549 1.00 . A A . 33 THR OG1 1 1 42 26757 1 1 34 GLY C C -1.429 0.973 8.252 1.00 . A A . 34 GLY C 1 1 42 26758 1 1 34 GLY CA C -0.336 0.156 7.587 1.00 . A A . 34 GLY CA 1 1 42 26759 1 1 34 GLY H H 0.849 0.702 5.917 1.00 . A A . 34 GLY H 1 1 42 26760 1 1 34 GLY HA2 H 0.214 -0.377 8.350 1.00 . A A . 34 GLY HA2 1 1 42 26761 1 1 34 GLY HA3 H -0.793 -0.562 6.923 1.00 . A A . 34 GLY HA3 1 1 42 26762 1 1 34 GLY N N 0.593 0.974 6.825 1.00 . A A . 34 GLY N 1 1 42 26763 1 1 34 GLY O O -1.681 0.826 9.448 1.00 . A A . 34 GLY O 1 1 42 26764 1 1 35 ARG C C -4.316 2.772 7.036 1.00 . A A . 35 ARG C 1 1 42 26765 1 1 35 ARG CA C -3.144 2.682 8.007 1.00 . A A . 35 ARG CA 1 1 42 26766 1 1 35 ARG CB C -2.610 4.083 8.310 1.00 . A A . 35 ARG CB 1 1 42 26767 1 1 35 ARG CD C -2.284 5.649 10.248 1.00 . A A . 35 ARG CD 1 1 42 26768 1 1 35 ARG CG C -3.255 4.731 9.524 1.00 . A A . 35 ARG CG 1 1 42 26769 1 1 35 ARG CZ C -2.330 7.912 11.223 1.00 . A A . 35 ARG CZ 1 1 42 26770 1 1 35 ARG H H -1.830 1.915 6.533 1.00 . A A . 35 ARG H 1 1 42 26771 1 1 35 ARG HA H -3.490 2.236 8.923 1.00 . A A . 35 ARG HA 1 1 42 26772 1 1 35 ARG HB2 H -1.546 4.021 8.485 1.00 . A A . 35 ARG HB2 1 1 42 26773 1 1 35 ARG HB3 H -2.788 4.717 7.454 1.00 . A A . 35 ARG HB3 1 1 42 26774 1 1 35 ARG HD2 H -1.795 5.090 11.032 1.00 . A A . 35 ARG HD2 1 1 42 26775 1 1 35 ARG HD3 H -1.545 5.999 9.542 1.00 . A A . 35 ARG HD3 1 1 42 26776 1 1 35 ARG HE H -3.929 6.748 10.957 1.00 . A A . 35 ARG HE 1 1 42 26777 1 1 35 ARG HG2 H -4.108 5.308 9.202 1.00 . A A . 35 ARG HG2 1 1 42 26778 1 1 35 ARG HG3 H -3.579 3.956 10.204 1.00 . A A . 35 ARG HG3 1 1 42 26779 1 1 35 ARG HH11 H -0.490 7.270 10.682 1.00 . A A . 35 ARG HH11 1 1 42 26780 1 1 35 ARG HH12 H -0.549 8.858 11.370 1.00 . A A . 35 ARG HH12 1 1 42 26781 1 1 35 ARG HH21 H -4.010 8.836 11.862 1.00 . A A . 35 ARG HH21 1 1 42 26782 1 1 35 ARG HH22 H -2.548 9.747 12.041 1.00 . A A . 35 ARG HH22 1 1 42 26783 1 1 35 ARG N N -2.077 1.839 7.478 1.00 . A A . 35 ARG N 1 1 42 26784 1 1 35 ARG NE N -2.958 6.802 10.839 1.00 . A A . 35 ARG NE 1 1 42 26785 1 1 35 ARG NH1 N -1.015 8.022 11.080 1.00 . A A . 35 ARG NH1 1 1 42 26786 1 1 35 ARG NH2 N -3.019 8.914 11.752 1.00 . A A . 35 ARG NH2 1 1 42 26787 1 1 35 ARG O O -5.474 2.645 7.432 1.00 . A A . 35 ARG O 1 1 42 26788 1 1 36 SER C C -4.609 2.422 3.447 1.00 . A A . 36 SER C 1 1 42 26789 1 1 36 SER CA C -5.040 3.110 4.739 1.00 . A A . 36 SER CA 1 1 42 26790 1 1 36 SER CB C -5.355 4.582 4.464 1.00 . A A . 36 SER CB 1 1 42 26791 1 1 36 SER H H -3.067 3.093 5.512 1.00 . A A . 36 SER H 1 1 42 26792 1 1 36 SER HA H -5.930 2.626 5.110 1.00 . A A . 36 SER HA 1 1 42 26793 1 1 36 SER HB2 H -5.069 5.175 5.320 1.00 . A A . 36 SER HB2 1 1 42 26794 1 1 36 SER HB3 H -4.801 4.911 3.597 1.00 . A A . 36 SER HB3 1 1 42 26795 1 1 36 SER HG H -7.017 4.205 3.497 1.00 . A A . 36 SER HG 1 1 42 26796 1 1 36 SER N N -4.008 2.997 5.765 1.00 . A A . 36 SER N 1 1 42 26797 1 1 36 SER O O -3.427 2.151 3.242 1.00 . A A . 36 SER O 1 1 42 26798 1 1 36 SER OG O -6.738 4.771 4.221 1.00 . A A . 36 SER OG 1 1 42 26799 1 1 37 CYS C C -4.738 2.475 0.283 1.00 . A A . 37 CYS C 1 1 42 26800 1 1 37 CYS CA C -5.303 1.490 1.305 1.00 . A A . 37 CYS CA 1 1 42 26801 1 1 37 CYS CB C -6.576 0.848 0.756 1.00 . A A . 37 CYS CB 1 1 42 26802 1 1 37 CYS H H -6.502 2.388 2.800 1.00 . A A . 37 CYS H 1 1 42 26803 1 1 37 CYS HA H -4.571 0.717 1.483 1.00 . A A . 37 CYS HA 1 1 42 26804 1 1 37 CYS HB2 H -7.431 1.414 1.094 1.00 . A A . 37 CYS HB2 1 1 42 26805 1 1 37 CYS HB3 H -6.543 0.866 -0.324 1.00 . A A . 37 CYS HB3 1 1 42 26806 1 1 37 CYS N N -5.578 2.145 2.579 1.00 . A A . 37 CYS N 1 1 42 26807 1 1 37 CYS O O -4.323 2.079 -0.806 1.00 . A A . 37 CYS O 1 1 42 26808 1 1 37 CYS SG S -6.816 -0.880 1.276 1.00 . A A . 37 CYS SG 1 1 42 26809 1 1 38 GLU C C -2.699 4.913 -0.136 1.00 . A A . 38 GLU C 1 1 42 26810 1 1 38 GLU CA C -4.214 4.789 -0.260 1.00 . A A . 38 GLU CA 1 1 42 26811 1 1 38 GLU CB C -4.875 6.134 0.046 1.00 . A A . 38 GLU CB 1 1 42 26812 1 1 38 GLU CD C -6.985 5.620 1.335 1.00 . A A . 38 GLU CD 1 1 42 26813 1 1 38 GLU CG C -6.394 6.086 0.020 1.00 . A A . 38 GLU CG 1 1 42 26814 1 1 38 GLU H H -5.074 4.018 1.514 1.00 . A A . 38 GLU H 1 1 42 26815 1 1 38 GLU HA H -4.458 4.501 -1.272 1.00 . A A . 38 GLU HA 1 1 42 26816 1 1 38 GLU HB2 H -4.563 6.460 1.028 1.00 . A A . 38 GLU HB2 1 1 42 26817 1 1 38 GLU HB3 H -4.546 6.858 -0.685 1.00 . A A . 38 GLU HB3 1 1 42 26818 1 1 38 GLU HG2 H -6.769 7.076 -0.195 1.00 . A A . 38 GLU HG2 1 1 42 26819 1 1 38 GLU HG3 H -6.706 5.407 -0.760 1.00 . A A . 38 GLU HG3 1 1 42 26820 1 1 38 GLU N N -4.728 3.758 0.634 1.00 . A A . 38 GLU N 1 1 42 26821 1 1 38 GLU O O -2.191 5.511 0.813 1.00 . A A . 38 GLU O 1 1 42 26822 1 1 38 GLU OE1 O -7.269 6.479 2.196 1.00 . A A . 38 GLU OE1 1 1 42 26823 1 1 38 GLU OE2 O -7.165 4.395 1.504 1.00 . A A . 38 GLU OE2 1 1 42 26824 1 1 39 CYS C C -0.030 5.841 -1.185 1.00 . A A . 39 CYS C 1 1 42 26825 1 1 39 CYS CA C -0.523 4.397 -1.099 1.00 . A A . 39 CYS CA 1 1 42 26826 1 1 39 CYS CB C 0.041 3.581 -2.265 1.00 . A A . 39 CYS CB 1 1 42 26827 1 1 39 CYS H H -2.442 3.885 -1.833 1.00 . A A . 39 CYS H 1 1 42 26828 1 1 39 CYS HA H -0.180 3.966 -0.170 1.00 . A A . 39 CYS HA 1 1 42 26829 1 1 39 CYS HB2 H -0.510 3.819 -3.163 1.00 . A A . 39 CYS HB2 1 1 42 26830 1 1 39 CYS HB3 H 1.080 3.841 -2.407 1.00 . A A . 39 CYS HB3 1 1 42 26831 1 1 39 CYS N N -1.981 4.347 -1.102 1.00 . A A . 39 CYS N 1 1 42 26832 1 1 39 CYS O O -0.646 6.675 -1.848 1.00 . A A . 39 CYS O 1 1 42 26833 1 1 39 CYS SG S -0.050 1.778 -2.024 1.00 . A A . 39 CYS SG 1 1 42 26834 1 1 40 PRO C C 1.846 8.052 -1.929 1.00 . A A . 40 PRO C 1 1 42 26835 1 1 40 PRO CA C 1.661 7.507 -0.517 1.00 . A A . 40 PRO CA 1 1 42 26836 1 1 40 PRO CB C 3.018 7.324 0.167 1.00 . A A . 40 PRO CB 1 1 42 26837 1 1 40 PRO CD C 1.889 5.222 0.305 1.00 . A A . 40 PRO CD 1 1 42 26838 1 1 40 PRO CG C 2.846 6.125 1.033 1.00 . A A . 40 PRO CG 1 1 42 26839 1 1 40 PRO HA H 1.055 8.194 0.055 1.00 . A A . 40 PRO HA 1 1 42 26840 1 1 40 PRO HB2 H 3.782 7.167 -0.580 1.00 . A A . 40 PRO HB2 1 1 42 26841 1 1 40 PRO HB3 H 3.251 8.202 0.750 1.00 . A A . 40 PRO HB3 1 1 42 26842 1 1 40 PRO HD2 H 2.429 4.527 -0.321 1.00 . A A . 40 PRO HD2 1 1 42 26843 1 1 40 PRO HD3 H 1.262 4.692 1.007 1.00 . A A . 40 PRO HD3 1 1 42 26844 1 1 40 PRO HG2 H 3.797 5.632 1.170 1.00 . A A . 40 PRO HG2 1 1 42 26845 1 1 40 PRO HG3 H 2.432 6.418 1.987 1.00 . A A . 40 PRO HG3 1 1 42 26846 1 1 40 PRO N N 1.091 6.155 -0.512 1.00 . A A . 40 PRO N 1 1 42 26847 1 1 40 PRO O O 1.684 7.328 -2.911 1.00 . A A . 40 PRO O 1 1 42 26848 1 1 41 SER C C 3.864 10.322 -3.529 1.00 . A A . 41 SER C 1 1 42 26849 1 1 41 SER CA C 2.393 9.976 -3.317 1.00 . A A . 41 SER CA 1 1 42 26850 1 1 41 SER CB C 1.540 11.241 -3.424 1.00 . A A . 41 SER CB 1 1 42 26851 1 1 41 SER H H 2.300 9.860 -1.205 1.00 . A A . 41 SER H 1 1 42 26852 1 1 41 SER HA H 2.086 9.281 -4.085 1.00 . A A . 41 SER HA 1 1 42 26853 1 1 41 SER HB2 H 1.947 12.003 -2.776 1.00 . A A . 41 SER HB2 1 1 42 26854 1 1 41 SER HB3 H 1.549 11.594 -4.445 1.00 . A A . 41 SER HB3 1 1 42 26855 1 1 41 SER HG H -0.239 10.478 -3.727 1.00 . A A . 41 SER HG 1 1 42 26856 1 1 41 SER N N 2.186 9.334 -2.024 1.00 . A A . 41 SER N 1 1 42 26857 1 1 41 SER O O 4.195 11.217 -4.308 1.00 . A A . 41 SER O 1 1 42 26858 1 1 41 SER OG O 0.199 10.987 -3.041 1.00 . A A . 41 SER OG 1 1 42 26859 1 1 42 TYR C C 6.959 8.547 -2.716 1.00 . A A . 42 TYR C 1 1 42 26860 1 1 42 TYR CA C 6.179 9.840 -2.952 1.00 . A A . 42 TYR CA 1 1 42 26861 1 1 42 TYR CB C 6.628 10.912 -1.956 1.00 . A A . 42 TYR CB 1 1 42 26862 1 1 42 TYR CD1 C 5.459 10.890 0.283 1.00 . A A . 42 TYR CD1 1 1 42 26863 1 1 42 TYR CD2 C 7.493 9.667 0.063 1.00 . A A . 42 TYR CD2 1 1 42 26864 1 1 42 TYR CE1 C 5.362 10.499 1.605 1.00 . A A . 42 TYR CE1 1 1 42 26865 1 1 42 TYR CE2 C 7.403 9.271 1.383 1.00 . A A . 42 TYR CE2 1 1 42 26866 1 1 42 TYR CG C 6.524 10.482 -0.510 1.00 . A A . 42 TYR CG 1 1 42 26867 1 1 42 TYR CZ C 6.336 9.690 2.150 1.00 . A A . 42 TYR CZ 1 1 42 26868 1 1 42 TYR H H 4.423 8.906 -2.231 1.00 . A A . 42 TYR H 1 1 42 26869 1 1 42 TYR HA H 6.377 10.187 -3.955 1.00 . A A . 42 TYR HA 1 1 42 26870 1 1 42 TYR HB2 H 7.658 11.167 -2.152 1.00 . A A . 42 TYR HB2 1 1 42 26871 1 1 42 TYR HB3 H 6.014 11.792 -2.086 1.00 . A A . 42 TYR HB3 1 1 42 26872 1 1 42 TYR HD1 H 4.697 11.524 -0.148 1.00 . A A . 42 TYR HD1 1 1 42 26873 1 1 42 TYR HD2 H 8.328 9.342 -0.540 1.00 . A A . 42 TYR HD2 1 1 42 26874 1 1 42 TYR HE1 H 4.525 10.827 2.204 1.00 . A A . 42 TYR HE1 1 1 42 26875 1 1 42 TYR HE2 H 8.166 8.638 1.810 1.00 . A A . 42 TYR HE2 1 1 42 26876 1 1 42 TYR HH H 6.696 9.935 4.023 1.00 . A A . 42 TYR HH 1 1 42 26877 1 1 42 TYR N N 4.745 9.607 -2.835 1.00 . A A . 42 TYR N 1 1 42 26878 1 1 42 TYR O O 6.551 7.705 -1.917 1.00 . A A . 42 TYR O 1 1 42 26879 1 1 42 TYR OH O 6.243 9.298 3.465 1.00 . A A . 42 TYR OH 1 1 42 26880 1 1 43 PRO C C 9.679 7.142 -1.944 1.00 . A A . 43 PRO C 1 1 42 26881 1 1 43 PRO CA C 8.930 7.175 -3.272 1.00 . A A . 43 PRO CA 1 1 42 26882 1 1 43 PRO CB C 9.912 7.292 -4.438 1.00 . A A . 43 PRO CB 1 1 42 26883 1 1 43 PRO CD C 8.658 9.327 -4.387 1.00 . A A . 43 PRO CD 1 1 42 26884 1 1 43 PRO CG C 10.015 8.755 -4.697 1.00 . A A . 43 PRO CG 1 1 42 26885 1 1 43 PRO HA H 8.346 6.273 -3.377 1.00 . A A . 43 PRO HA 1 1 42 26886 1 1 43 PRO HB2 H 10.865 6.871 -4.154 1.00 . A A . 43 PRO HB2 1 1 42 26887 1 1 43 PRO HB3 H 9.520 6.767 -5.297 1.00 . A A . 43 PRO HB3 1 1 42 26888 1 1 43 PRO HD2 H 8.754 10.311 -3.952 1.00 . A A . 43 PRO HD2 1 1 42 26889 1 1 43 PRO HD3 H 8.052 9.366 -5.280 1.00 . A A . 43 PRO HD3 1 1 42 26890 1 1 43 PRO HG2 H 10.762 9.190 -4.049 1.00 . A A . 43 PRO HG2 1 1 42 26891 1 1 43 PRO HG3 H 10.267 8.928 -5.732 1.00 . A A . 43 PRO HG3 1 1 42 26892 1 1 43 PRO N N 8.096 8.373 -3.412 1.00 . A A . 43 PRO N 1 1 42 26893 1 1 43 PRO O O 10.622 7.905 -1.733 1.00 . A A . 43 PRO O 1 1 42 26894 1 1 44 GLY C C 11.367 5.790 0.133 1.00 . A A . 44 GLY C 1 1 42 26895 1 1 44 GLY CA C 9.896 6.138 0.244 1.00 . A A . 44 GLY CA 1 1 42 26896 1 1 44 GLY H H 8.498 5.672 -1.276 1.00 . A A . 44 GLY H 1 1 42 26897 1 1 44 GLY HA2 H 9.397 5.369 0.813 1.00 . A A . 44 GLY HA2 1 1 42 26898 1 1 44 GLY HA3 H 9.799 7.079 0.766 1.00 . A A . 44 GLY HA3 1 1 42 26899 1 1 44 GLY N N 9.254 6.254 -1.052 1.00 . A A . 44 GLY N 1 1 42 26900 1 1 44 GLY O O 12.163 6.145 1.002 1.00 . A A . 44 GLY O 1 1 42 26901 1 1 45 ASN C C 14.022 5.916 -1.256 1.00 . A A . 45 ASN C 1 1 42 26902 1 1 45 ASN CA C 13.114 4.695 -1.160 1.00 . A A . 45 ASN CA 1 1 42 26903 1 1 45 ASN CB C 13.229 3.857 -2.435 1.00 . A A . 45 ASN CB 1 1 42 26904 1 1 45 ASN CG C 14.249 2.743 -2.306 1.00 . A A . 45 ASN CG 1 1 42 26905 1 1 45 ASN H H 11.048 4.839 -1.596 1.00 . A A . 45 ASN H 1 1 42 26906 1 1 45 ASN HA H 13.426 4.095 -0.318 1.00 . A A . 45 ASN HA 1 1 42 26907 1 1 45 ASN HB2 H 12.269 3.416 -2.657 1.00 . A A . 45 ASN HB2 1 1 42 26908 1 1 45 ASN HB3 H 13.524 4.498 -3.253 1.00 . A A . 45 ASN HB3 1 1 42 26909 1 1 45 ASN HD21 H 12.808 1.439 -1.889 1.00 . A A . 45 ASN HD21 1 1 42 26910 1 1 45 ASN HD22 H 14.413 0.800 -1.917 1.00 . A A . 45 ASN HD22 1 1 42 26911 1 1 45 ASN N N 11.729 5.092 -0.939 1.00 . A A . 45 ASN N 1 1 42 26912 1 1 45 ASN ND2 N 13.776 1.539 -2.007 1.00 . A A . 45 ASN ND2 1 1 42 26913 1 1 45 ASN O O 15.193 5.863 -0.881 1.00 . A A . 45 ASN O 1 1 42 26914 1 1 45 ASN OD1 O 15.449 2.962 -2.472 1.00 . A A . 45 ASN OD1 1 1 42 26915 1 1 46 GLY C C 13.374 9.465 -2.048 1.00 . A A . 46 GLY C 1 1 42 26916 1 1 46 GLY CA C 14.249 8.235 -1.899 1.00 . A A . 46 GLY CA 1 1 42 26917 1 1 46 GLY H H 12.536 7.000 -2.045 1.00 . A A . 46 GLY H 1 1 42 26918 1 1 46 GLY HA2 H 14.883 8.151 -2.769 1.00 . A A . 46 GLY HA2 1 1 42 26919 1 1 46 GLY HA3 H 14.871 8.353 -1.024 1.00 . A A . 46 GLY HA3 1 1 42 26920 1 1 46 GLY N N 13.474 7.016 -1.762 1.00 . A A . 46 GLY N 1 1 42 26921 1 1 46 GLY O O 12.661 9.807 -1.081 1.00 . A A . 46 GLY O 1 1 42 26922 1 1 46 GLY OXT O 13.403 10.086 -3.131 1.00 . A A . 46 GLY OXT 1 1 stop_ save_
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