NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | in_dress | stage | program | type | subtype | item_count |
369769 | 1bgk | cing | recoord | dress | 4-filtered-FRED | STAR | entry | full | 547 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1bgk # This FRED archive file contains, for PDB entry <1bgk>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1bgk _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1bgk _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4280.92 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 $BGK A . 1 1 stop_ save_ save_BGK _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name BGK _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code VCRDWFKETACRHAKSLGNCRTSQKYRANCAKTCELC _Entity.Number_of_monomers 37 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 VAL . 1 1 2 CYS . 1 1 3 ARG . 1 1 4 ASP . 1 1 5 TRP . 1 1 6 PHE . 1 1 7 LYS . 1 1 8 GLU . 1 1 9 THR . 1 1 10 ALA . 1 1 11 CYS . 1 1 12 ARG . 1 1 13 HIS . 1 1 14 ALA . 1 1 15 LYS . 1 1 16 SER . 1 1 17 LEU . 1 1 18 GLY . 1 1 19 ASN . 1 1 20 CYS . 1 1 21 ARG . 1 1 22 THR . 1 1 23 SER . 1 1 24 GLN . 1 1 25 LYS . 1 1 26 TYR . 1 1 27 ARG . 1 1 28 ALA . 1 1 29 ASN . 1 1 30 CYS . 1 1 31 ALA . 1 1 32 LYS . 1 1 33 THR . 1 1 34 CYS . 1 1 35 GLU . 1 1 36 LEU . 1 1 37 CYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID VAL 1 1 1 1 CYS 2 2 1 1 ARG 3 3 1 1 ASP 4 4 1 1 TRP 5 5 1 1 PHE 6 6 1 1 LYS 7 7 1 1 GLU 8 8 1 1 THR 9 9 1 1 ALA 10 10 1 1 CYS 11 11 1 1 ARG 12 12 1 1 HIS 13 13 1 1 ALA 14 14 1 1 LYS 15 15 1 1 SER 16 16 1 1 LEU 17 17 1 1 GLY 18 18 1 1 ASN 19 19 1 1 CYS 20 20 1 1 ARG 21 21 1 1 THR 22 22 1 1 SER 23 23 1 1 GLN 24 24 1 1 LYS 25 25 1 1 TYR 26 26 1 1 ARG 27 27 1 1 ALA 28 28 1 1 ASN 29 29 1 1 CYS 30 30 1 1 ALA 31 31 1 1 LYS 32 32 1 1 THR 33 33 1 1 CYS 34 34 1 1 GLU 35 35 1 1 LEU 36 36 1 1 CYS 37 37 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 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 VAL HA . 1 . HA 1 1 1 1 2 1 1 1 VAL HB . 1 . HB 1 1 2 1 1 1 1 1 VAL HA . 1 . HA 1 1 2 1 2 1 1 2 CYS H . 2 . HN 1 1 3 1 1 1 1 1 VAL HB . 1 . HB 1 1 3 1 2 1 1 2 CYS H . 2 . HN 1 1 4 1 1 1 1 1 VAL QG . 1 . HG* 1 1 4 1 2 1 1 2 CYS H . 2 . HN 1 1 5 1 1 1 1 1 VAL QG . 1 . HG* 1 1 5 1 2 1 1 3 ARG H . 3 . HN 1 1 6 1 1 1 1 1 VAL QG . 1 . HG* 1 1 6 1 2 1 1 3 ARG QD . 3 . HD* 1 1 7 1 1 1 1 1 VAL QG . 1 . HG* 1 1 7 1 2 1 1 5 TRP HZ2 . 5 . HZ2 1 1 8 1 1 1 1 1 VAL QG . 1 . HG* 1 1 8 1 2 1 1 37 CYS QB . 37 . HB* 1 1 9 1 1 1 1 2 CYS CB . 2 . CB 1 1 9 1 2 1 1 37 CYS SG . 37 . SG 1 1 10 1 1 1 1 2 CYS H . 2 . HN 1 1 10 1 2 1 1 2 CYS QB . 2 . HB* 1 1 11 1 1 1 1 2 CYS H . 2 . HN 1 1 11 1 2 1 1 3 ARG H . 3 . HN 1 1 12 1 1 1 1 2 CYS HA . 2 . HA 1 1 12 1 2 1 1 3 ARG H . 3 . HN 1 1 13 1 1 1 1 2 CYS QB . 2 . HB* 1 1 13 1 2 1 1 3 ARG H . 3 . HN 1 1 14 1 1 1 1 2 CYS QB . 2 . HB* 1 1 14 1 2 1 1 37 CYS QB . 37 . HB* 1 1 15 1 1 1 1 2 CYS SG . 2 . SG 1 1 15 1 2 1 1 37 CYS CB . 37 . CB 1 1 16 1 1 1 1 2 CYS SG . 2 . SG 1 1 16 1 2 1 1 37 CYS SG . 37 . SG 1 1 17 1 1 1 1 3 ARG H . 3 . HN 1 1 17 1 2 1 1 3 ARG HA . 3 . HA 1 1 18 1 1 1 1 3 ARG H . 3 . HN 1 1 18 1 2 1 1 3 ARG QB . 3 . HB* 1 1 19 1 1 1 1 3 ARG H . 3 . HN 1 1 19 1 2 1 1 3 ARG QD . 3 . HD* 1 1 20 1 1 1 1 3 ARG H . 3 . HN 1 1 20 1 2 1 1 3 ARG QG . 3 . HG* 1 1 21 1 1 1 1 3 ARG H . 3 . HN 1 1 21 1 2 1 1 4 ASP H . 4 . HN 1 1 22 1 1 1 1 3 ARG H . 3 . HN 1 1 22 1 2 1 1 31 ALA MB . 31 . HB* 1 1 23 1 1 1 1 3 ARG H . 3 . HN 1 1 23 1 2 1 1 32 LYS H . 32 . HN 1 1 24 1 1 1 1 3 ARG HA . 3 . HA 1 1 24 1 2 1 1 3 ARG QB . 3 . HB* 1 1 25 1 1 1 1 3 ARG HA . 3 . HA 1 1 25 1 2 1 1 3 ARG QG . 3 . HG* 1 1 26 1 1 1 1 3 ARG HA . 3 . HA 1 1 26 1 2 1 1 4 ASP H . 4 . HN 1 1 27 1 1 1 1 3 ARG HA . 3 . HA 1 1 27 1 2 1 1 32 LYS H . 32 . HN 1 1 28 1 1 1 1 3 ARG QB . 3 . HB* 1 1 28 1 2 1 1 3 ARG QD . 3 . HD* 1 1 29 1 1 1 1 3 ARG QB . 3 . HB* 1 1 29 1 2 1 1 3 ARG HE . 3 . HE 1 1 30 1 1 1 1 3 ARG QB . 3 . HB* 1 1 30 1 2 1 1 4 ASP H . 4 . HN 1 1 31 1 1 1 1 3 ARG QB . 3 . HB* 1 1 31 1 2 1 1 32 LYS HA . 32 . HA 1 1 32 1 1 1 1 3 ARG QD . 3 . HD* 1 1 32 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 33 1 1 1 1 3 ARG QD . 3 . HD* 1 1 33 1 2 1 1 5 TRP HE1 . 5 . HE1 1 1 34 1 1 1 1 3 ARG QD . 3 . HD* 1 1 34 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 35 1 1 1 1 3 ARG QD . 3 . HD* 1 1 35 1 2 1 1 5 TRP HH2 . 5 . HH2 1 1 36 1 1 1 1 3 ARG QD . 3 . HD* 1 1 36 1 2 1 1 5 TRP HZ2 . 5 . HZ2 1 1 37 1 1 1 1 3 ARG QD . 3 . HD* 1 1 37 1 2 1 1 5 TRP HZ3 . 5 . HZ3 1 1 38 1 1 1 1 3 ARG HE . 3 . HE 1 1 38 1 2 1 1 4 ASP H . 4 . HN 1 1 39 1 1 1 1 3 ARG QG . 3 . HG* 1 1 39 1 2 1 1 4 ASP H . 4 . HN 1 1 40 1 1 1 1 3 ARG QG . 3 . HG* 1 1 40 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 41 1 1 1 1 3 ARG QG . 3 . HG* 1 1 41 1 2 1 1 5 TRP HE1 . 5 . HE1 1 1 42 1 1 1 1 3 ARG QG . 3 . HG* 1 1 42 1 2 1 1 5 TRP HZ2 . 5 . HZ2 1 1 43 1 1 1 1 4 ASP H . 4 . HN 1 1 43 1 2 1 1 4 ASP QB . 4 . HB* 1 1 44 1 1 1 1 4 ASP H . 4 . HN 1 1 44 1 2 1 1 32 LYS H . 32 . HN 1 1 45 1 1 1 1 4 ASP H . 4 . HN 1 1 45 1 2 1 1 32 LYS QB . 32 . HB* 1 1 46 1 1 1 1 4 ASP HA . 4 . HA 1 1 46 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 47 1 1 1 1 4 ASP QB . 4 . HB* 1 1 47 1 2 1 1 30 CYS HA . 30 . HA 1 1 48 1 1 1 1 4 ASP QB . 4 . HB* 1 1 48 1 2 1 1 32 LYS H . 32 . HN 1 1 49 1 1 1 1 4 ASP QB . 4 . HB* 1 1 49 1 2 1 1 32 LYS QG . 32 . HG* 1 1 50 1 1 1 1 4 ASP QB . 4 . HB* 1 1 50 1 2 1 1 33 THR H . 33 . HN 1 1 51 1 1 1 1 5 TRP H . 5 . HN 1 1 51 1 2 1 1 5 TRP HA . 5 . HA 1 1 52 1 1 1 1 5 TRP H . 5 . HN 1 1 52 1 2 1 1 5 TRP HB2 . 5 . HB2 1 1 53 1 1 1 1 5 TRP H . 5 . HN 1 1 53 1 2 1 1 5 TRP HB3 . 5 . HB3 1 1 54 1 1 1 1 5 TRP H . 5 . HN 1 1 54 1 2 1 1 6 PHE H . 6 . HN 1 1 55 1 1 1 1 5 TRP H . 5 . HN 1 1 55 1 2 1 1 10 ALA MB . 10 . HB* 1 1 56 1 1 1 1 5 TRP H . 5 . HN 1 1 56 1 2 1 1 29 ASN QB . 29 . HB* 1 1 57 1 1 1 1 5 TRP H . 5 . HN 1 1 57 1 2 1 1 30 CYS HA . 30 . HA 1 1 58 1 1 1 1 5 TRP HA . 5 . HA 1 1 58 1 2 1 1 5 TRP HB2 . 5 . HB2 1 1 59 1 1 1 1 5 TRP HA . 5 . HA 1 1 59 1 2 1 1 5 TRP HB3 . 5 . HB3 1 1 60 1 1 1 1 5 TRP HA . 5 . HA 1 1 60 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 61 1 1 1 1 5 TRP HA . 5 . HA 1 1 61 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 62 1 1 1 1 5 TRP HA . 5 . HA 1 1 62 1 2 1 1 5 TRP HZ3 . 5 . HZ3 1 1 63 1 1 1 1 5 TRP HA . 5 . HA 1 1 63 1 2 1 1 6 PHE H . 6 . HN 1 1 64 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 64 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 65 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 65 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 66 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 66 1 2 1 1 6 PHE H . 6 . HN 1 1 67 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 67 1 2 1 1 25 LYS QG . 25 . HG* 1 1 68 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 68 1 2 1 1 29 ASN QB . 29 . HB* 1 1 69 1 1 1 1 5 TRP HB3 . 5 . HB3 1 1 69 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 70 1 1 1 1 5 TRP HB3 . 5 . HB3 1 1 70 1 2 1 1 5 TRP HE1 . 5 . HE1 1 1 71 1 1 1 1 5 TRP HB3 . 5 . HB3 1 1 71 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 72 1 1 1 1 5 TRP HB3 . 5 . HB3 1 1 72 1 2 1 1 25 LYS QG . 25 . HG* 1 1 73 1 1 1 1 5 TRP HD1 . 5 . HD1 1 1 73 1 2 1 1 25 LYS QG . 25 . HG* 1 1 74 1 1 1 1 5 TRP HD1 . 5 . HD1 1 1 74 1 2 1 1 28 ALA HA . 28 . HA 1 1 75 1 1 1 1 5 TRP HD1 . 5 . HD1 1 1 75 1 2 1 1 28 ALA MB . 28 . HB* 1 1 76 1 1 1 1 5 TRP HD1 . 5 . HD1 1 1 76 1 2 1 1 31 ALA MB . 31 . HB* 1 1 77 1 1 1 1 6 PHE H . 6 . HN 1 1 77 1 2 1 1 6 PHE HA . 6 . HA 1 1 78 1 1 1 1 6 PHE H . 6 . HN 1 1 78 1 2 1 1 6 PHE HB2 . 6 . HB2 1 1 79 1 1 1 1 6 PHE H . 6 . HN 1 1 79 1 2 1 1 6 PHE HB3 . 6 . HB3 1 1 80 1 1 1 1 6 PHE H . 6 . HN 1 1 80 1 2 1 1 6 PHE QD . 6 . HD* 1 1 81 1 1 1 1 6 PHE H . 6 . HN 1 1 81 1 2 1 1 7 LYS H . 7 . HN 1 1 82 1 1 1 1 6 PHE H . 6 . HN 1 1 82 1 2 1 1 29 ASN QB . 29 . HB* 1 1 83 1 1 1 1 6 PHE HA . 6 . HA 1 1 83 1 2 1 1 6 PHE HB2 . 6 . HB2 1 1 84 1 1 1 1 6 PHE HA . 6 . HA 1 1 84 1 2 1 1 6 PHE HB3 . 6 . HB3 1 1 85 1 1 1 1 6 PHE HA . 6 . HA 1 1 85 1 2 1 1 6 PHE QD . 6 . HD* 1 1 86 1 1 1 1 6 PHE HA . 6 . HA 1 1 86 1 2 1 1 6 PHE QE . 6 . HE* 1 1 87 1 1 1 1 6 PHE HA . 6 . HA 1 1 87 1 2 1 1 7 LYS H . 7 . HN 1 1 88 1 1 1 1 6 PHE HA . 6 . HA 1 1 88 1 2 1 1 10 ALA MB . 10 . HB* 1 1 89 1 1 1 1 6 PHE HA . 6 . HA 1 1 89 1 2 1 1 29 ASN QB . 29 . HB* 1 1 90 1 1 1 1 6 PHE HB2 . 6 . HB2 1 1 90 1 2 1 1 6 PHE QD . 6 . HD* 1 1 91 1 1 1 1 6 PHE HB2 . 6 . HB2 1 1 91 1 2 1 1 7 LYS H . 7 . HN 1 1 92 1 1 1 1 6 PHE HB2 . 6 . HB2 1 1 92 1 2 1 1 10 ALA MB . 10 . HB* 1 1 93 1 1 1 1 6 PHE HB3 . 6 . HB3 1 1 93 1 2 1 1 6 PHE QD . 6 . HD* 1 1 94 1 1 1 1 6 PHE HB3 . 6 . HB3 1 1 94 1 2 1 1 7 LYS H . 7 . HN 1 1 95 1 1 1 1 6 PHE HB3 . 6 . HB3 1 1 95 1 2 1 1 10 ALA MB . 10 . HB* 1 1 96 1 1 1 1 6 PHE QD . 6 . HD* 1 1 96 1 2 1 1 7 LYS H . 7 . HN 1 1 97 1 1 1 1 6 PHE QD . 6 . HD* 1 1 97 1 2 1 1 10 ALA MB . 10 . HB* 1 1 98 1 1 1 1 6 PHE QD . 6 . HD* 1 1 98 1 2 1 1 14 ALA MB . 14 . HB* 1 1 99 1 1 1 1 6 PHE QD . 6 . HD* 1 1 99 1 2 1 1 25 LYS QD . 25 . HD* 1 1 100 1 1 1 1 6 PHE QD . 6 . HD* 1 1 100 1 2 1 1 25 LYS QG . 25 . HG* 1 1 101 1 1 1 1 6 PHE QD . 6 . HD* 1 1 101 1 2 1 1 26 TYR HA . 26 . HA 1 1 102 1 1 1 1 6 PHE QD . 6 . HD* 1 1 102 1 2 1 1 29 ASN QB . 29 . HB* 1 1 103 1 1 1 1 6 PHE QE . 6 . HE* 1 1 103 1 2 1 1 10 ALA MB . 10 . HB* 1 1 104 1 1 1 1 6 PHE QE . 6 . HE* 1 1 104 1 2 1 1 25 LYS HA . 25 . HA 1 1 105 1 1 1 1 6 PHE QE . 6 . HE* 1 1 105 1 2 1 1 25 LYS QB . 25 . HB* 1 1 106 1 1 1 1 6 PHE QE . 6 . HE* 1 1 106 1 2 1 1 25 LYS QG . 25 . HG* 1 1 107 1 1 1 1 6 PHE QE . 6 . HE* 1 1 107 1 2 1 1 29 ASN HA . 29 . HA 1 1 108 1 1 1 1 6 PHE QE . 6 . HE* 1 1 108 1 2 1 1 29 ASN QB . 29 . HB* 1 1 109 1 1 1 1 6 PHE HZ . 6 . HZ 1 1 109 1 2 1 1 25 LYS QB . 25 . HB* 1 1 110 1 1 1 1 6 PHE HZ . 6 . HZ 1 1 110 1 2 1 1 25 LYS QD . 25 . HD* 1 1 111 1 1 1 1 6 PHE HZ . 6 . HZ 1 1 111 1 2 1 1 25 LYS QG . 25 . HG* 1 1 112 1 1 1 1 6 PHE HZ . 6 . HZ 1 1 112 1 2 1 1 26 TYR HA . 26 . HA 1 1 113 1 1 1 1 6 PHE HZ . 6 . HZ 1 1 113 1 2 1 1 29 ASN QB . 29 . HB* 1 1 114 1 1 1 1 7 LYS H . 7 . HN 1 1 114 1 2 1 1 7 LYS HA . 7 . HA 1 1 115 1 1 1 1 7 LYS H . 7 . HN 1 1 115 1 2 1 1 7 LYS QB . 7 . HB* 1 1 116 1 1 1 1 7 LYS H . 7 . HN 1 1 116 1 2 1 1 8 GLU H . 8 . HN 1 1 117 1 1 1 1 7 LYS HA . 7 . HA 1 1 117 1 2 1 1 7 LYS QB . 7 . HB* 1 1 118 1 1 1 1 7 LYS HA . 7 . HA 1 1 118 1 2 1 1 7 LYS QD . 7 . HD* 1 1 119 1 1 1 1 7 LYS HA . 7 . HA 1 1 119 1 2 1 1 7 LYS QG . 7 . HG* 1 1 120 1 1 1 1 7 LYS HA . 7 . HA 1 1 120 1 2 1 1 8 GLU H . 8 . HN 1 1 121 1 1 1 1 7 LYS HA . 7 . HA 1 1 121 1 2 1 1 9 THR H . 9 . HN 1 1 122 1 1 1 1 7 LYS QB . 7 . HB* 1 1 122 1 2 1 1 8 GLU H . 8 . HN 1 1 123 1 1 1 1 7 LYS QB . 7 . HB* 1 1 123 1 2 1 1 10 ALA H . 10 . HN 1 1 124 1 1 1 1 8 GLU H . 8 . HN 1 1 124 1 2 1 1 8 GLU HA . 8 . HA 1 1 125 1 1 1 1 8 GLU H . 8 . HN 1 1 125 1 2 1 1 8 GLU QB . 8 . HB* 1 1 126 1 1 1 1 8 GLU H . 8 . HN 1 1 126 1 2 1 1 8 GLU QG . 8 . HG* 1 1 127 1 1 1 1 8 GLU H . 8 . HN 1 1 127 1 2 1 1 9 THR H . 9 . HN 1 1 128 1 1 1 1 8 GLU H . 8 . HN 1 1 128 1 2 1 1 9 THR MG . 9 . HG2* 1 1 129 1 1 1 1 8 GLU H . 8 . HN 1 1 129 1 2 1 1 10 ALA H . 10 . HN 1 1 130 1 1 1 1 8 GLU HA . 8 . HA 1 1 130 1 2 1 1 8 GLU QB . 8 . HB* 1 1 131 1 1 1 1 8 GLU HA . 8 . HA 1 1 131 1 2 1 1 8 GLU QG . 8 . HG* 1 1 132 1 1 1 1 8 GLU HA . 8 . HA 1 1 132 1 2 1 1 9 THR H . 9 . HN 1 1 133 1 1 1 1 8 GLU HA . 8 . HA 1 1 133 1 2 1 1 11 CYS H . 11 . HN 1 1 134 1 1 1 1 8 GLU HA . 8 . HA 1 1 134 1 2 1 1 11 CYS QB . 11 . HB* 1 1 135 1 1 1 1 8 GLU HA . 8 . HA 1 1 135 1 2 1 1 12 ARG H . 12 . HN 1 1 136 1 1 1 1 8 GLU QB . 8 . HB* 1 1 136 1 2 1 1 9 THR H . 9 . HN 1 1 137 1 1 1 1 8 GLU QG . 8 . HG* 1 1 137 1 2 1 1 9 THR H . 9 . HN 1 1 138 1 1 1 1 9 THR H . 9 . HN 1 1 138 1 2 1 1 9 THR HA . 9 . HA 1 1 139 1 1 1 1 9 THR H . 9 . HN 1 1 139 1 2 1 1 9 THR HB . 9 . HB 1 1 140 1 1 1 1 9 THR H . 9 . HN 1 1 140 1 2 1 1 9 THR MG . 9 . HG2* 1 1 141 1 1 1 1 9 THR H . 9 . HN 1 1 141 1 2 1 1 10 ALA H . 10 . HN 1 1 142 1 1 1 1 9 THR H . 9 . HN 1 1 142 1 2 1 1 10 ALA HA . 10 . HA 1 1 143 1 1 1 1 9 THR HA . 9 . HA 1 1 143 1 2 1 1 9 THR HB . 9 . HB 1 1 144 1 1 1 1 9 THR HA . 9 . HA 1 1 144 1 2 1 1 9 THR MG . 9 . HG2* 1 1 145 1 1 1 1 9 THR HA . 9 . HA 1 1 145 1 2 1 1 10 ALA H . 10 . HN 1 1 146 1 1 1 1 9 THR HA . 9 . HA 1 1 146 1 2 1 1 11 CYS H . 11 . HN 1 1 147 1 1 1 1 9 THR HB . 9 . HB 1 1 147 1 2 1 1 10 ALA H . 10 . HN 1 1 148 1 1 1 1 9 THR MG . 9 . HG2* 1 1 148 1 2 1 1 12 ARG H . 12 . HN 1 1 149 1 1 1 1 9 THR MG . 9 . HG2* 1 1 149 1 2 1 1 32 LYS QE . 32 . HE* 1 1 150 1 1 1 1 10 ALA H . 10 . HN 1 1 150 1 2 1 1 10 ALA HA . 10 . HA 1 1 151 1 1 1 1 10 ALA H . 10 . HN 1 1 151 1 2 1 1 10 ALA MB . 10 . HB* 1 1 152 1 1 1 1 10 ALA H . 10 . HN 1 1 152 1 2 1 1 11 CYS H . 11 . HN 1 1 153 1 1 1 1 10 ALA H . 10 . HN 1 1 153 1 2 1 1 11 CYS QB . 11 . HB* 1 1 154 1 1 1 1 10 ALA H . 10 . HN 1 1 154 1 2 1 1 12 ARG H . 12 . HN 1 1 155 1 1 1 1 10 ALA HA . 10 . HA 1 1 155 1 2 1 1 11 CYS H . 11 . HN 1 1 156 1 1 1 1 10 ALA HA . 10 . HA 1 1 156 1 2 1 1 12 ARG H . 12 . HN 1 1 157 1 1 1 1 10 ALA HA . 10 . HA 1 1 157 1 2 1 1 13 HIS H . 13 . HN 1 1 158 1 1 1 1 10 ALA HA . 10 . HA 1 1 158 1 2 1 1 13 HIS QB . 13 . HB* 1 1 159 1 1 1 1 10 ALA HA . 10 . HA 1 1 159 1 2 1 1 14 ALA H . 14 . HN 1 1 160 1 1 1 1 10 ALA MB . 10 . HB* 1 1 160 1 2 1 1 11 CYS H . 11 . HN 1 1 161 1 1 1 1 10 ALA MB . 10 . HB* 1 1 161 1 2 1 1 14 ALA H . 14 . HN 1 1 162 1 1 1 1 11 CYS CB . 11 . CB 1 1 162 1 2 1 1 30 CYS SG . 30 . SG 1 1 163 1 1 1 1 11 CYS H . 11 . HN 1 1 163 1 2 1 1 11 CYS QB . 11 . HB* 1 1 164 1 1 1 1 11 CYS H . 11 . HN 1 1 164 1 2 1 1 12 ARG H . 12 . HN 1 1 165 1 1 1 1 11 CYS H . 11 . HN 1 1 165 1 2 1 1 13 HIS H . 13 . HN 1 1 166 1 1 1 1 11 CYS H . 11 . HN 1 1 166 1 2 1 1 33 THR MG . 33 . HG2* 1 1 167 1 1 1 1 11 CYS HA . 11 . HA 1 1 167 1 2 1 1 14 ALA MB . 14 . HB* 1 1 168 1 1 1 1 11 CYS QB . 11 . HB* 1 1 168 1 2 1 1 12 ARG H . 12 . HN 1 1 169 1 1 1 1 11 CYS QB . 11 . HB* 1 1 169 1 2 1 1 14 ALA MB . 14 . HB* 1 1 170 1 1 1 1 11 CYS QB . 11 . HB* 1 1 170 1 2 1 1 30 CYS HA . 30 . HA 1 1 171 1 1 1 1 11 CYS QB . 11 . HB* 1 1 171 1 2 1 1 30 CYS QB . 30 . HB* 1 1 172 1 1 1 1 11 CYS QB . 11 . HB* 1 1 172 1 2 1 1 33 THR H . 33 . HN 1 1 173 1 1 1 1 11 CYS QB . 11 . HB* 1 1 173 1 2 1 1 33 THR HB . 33 . HB 1 1 174 1 1 1 1 11 CYS QB . 11 . HB* 1 1 174 1 2 1 1 33 THR MG . 33 . HG2* 1 1 175 1 1 1 1 11 CYS SG . 11 . SG 1 1 175 1 2 1 1 30 CYS CB . 30 . CB 1 1 176 1 1 1 1 11 CYS SG . 11 . SG 1 1 176 1 2 1 1 30 CYS SG . 30 . SG 1 1 177 1 1 1 1 12 ARG H . 12 . HN 1 1 177 1 2 1 1 12 ARG HA . 12 . HA 1 1 178 1 1 1 1 12 ARG H . 12 . HN 1 1 178 1 2 1 1 12 ARG QB . 12 . HB* 1 1 179 1 1 1 1 12 ARG H . 12 . HN 1 1 179 1 2 1 1 12 ARG QD . 12 . HD* 1 1 180 1 1 1 1 12 ARG H . 12 . HN 1 1 180 1 2 1 1 12 ARG QG . 12 . HG* 1 1 181 1 1 1 1 12 ARG H . 12 . HN 1 1 181 1 2 1 1 13 HIS H . 13 . HN 1 1 182 1 1 1 1 12 ARG H . 12 . HN 1 1 182 1 2 1 1 13 HIS QB . 13 . HB* 1 1 183 1 1 1 1 12 ARG H . 12 . HN 1 1 183 1 2 1 1 14 ALA H . 14 . HN 1 1 184 1 1 1 1 12 ARG H . 12 . HN 1 1 184 1 2 1 1 14 ALA MB . 14 . HB* 1 1 185 1 1 1 1 12 ARG H . 12 . HN 1 1 185 1 2 1 1 33 THR MG . 33 . HG2* 1 1 186 1 1 1 1 12 ARG HA . 12 . HA 1 1 186 1 2 1 1 12 ARG QB . 12 . HB* 1 1 187 1 1 1 1 12 ARG HA . 12 . HA 1 1 187 1 2 1 1 12 ARG QG . 12 . HG* 1 1 188 1 1 1 1 12 ARG HA . 12 . HA 1 1 188 1 2 1 1 13 HIS H . 13 . HN 1 1 189 1 1 1 1 12 ARG HA . 12 . HA 1 1 189 1 2 1 1 14 ALA H . 14 . HN 1 1 190 1 1 1 1 12 ARG HA . 12 . HA 1 1 190 1 2 1 1 15 LYS H . 15 . HN 1 1 191 1 1 1 1 12 ARG QB . 12 . HB* 1 1 191 1 2 1 1 12 ARG QG . 12 . HG* 1 1 192 1 1 1 1 12 ARG QB . 12 . HB* 1 1 192 1 2 1 1 13 HIS H . 13 . HN 1 1 193 1 1 1 1 12 ARG QB . 12 . HB* 1 1 193 1 2 1 1 33 THR MG . 33 . HG2* 1 1 194 1 1 1 1 12 ARG QG . 12 . HG* 1 1 194 1 2 1 1 16 SER H . 16 . HN 1 1 195 1 1 1 1 13 HIS H . 13 . HN 1 1 195 1 2 1 1 13 HIS HA . 13 . HA 1 1 196 1 1 1 1 13 HIS H . 13 . HN 1 1 196 1 2 1 1 13 HIS QB . 13 . HB* 1 1 197 1 1 1 1 13 HIS H . 13 . HN 1 1 197 1 2 1 1 14 ALA H . 14 . HN 1 1 198 1 1 1 1 13 HIS H . 13 . HN 1 1 198 1 2 1 1 14 ALA HA . 14 . HA 1 1 199 1 1 1 1 13 HIS H . 13 . HN 1 1 199 1 2 1 1 14 ALA MB . 14 . HB* 1 1 200 1 1 1 1 13 HIS HA . 13 . HA 1 1 200 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 201 1 1 1 1 13 HIS HA . 13 . HA 1 1 201 1 2 1 1 14 ALA H . 14 . HN 1 1 202 1 1 1 1 13 HIS QB . 13 . HB* 1 1 202 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 203 1 1 1 1 13 HIS QB . 13 . HB* 1 1 203 1 2 1 1 14 ALA H . 14 . HN 1 1 204 1 1 1 1 13 HIS QB . 13 . HB* 1 1 204 1 2 1 1 14 ALA MB . 14 . HB* 1 1 205 1 1 1 1 13 HIS QB . 13 . HB* 1 1 205 1 2 1 1 17 LEU QD . 17 . HD* 1 1 206 1 1 1 1 13 HIS HD2 . 13 . HD2 1 1 206 1 2 1 1 14 ALA H . 14 . HN 1 1 207 1 1 1 1 13 HIS HD2 . 13 . HD2 1 1 207 1 2 1 1 17 LEU QD . 17 . HD* 1 1 208 1 1 1 1 13 HIS HE1 . 13 . HE1 1 1 208 1 2 1 1 17 LEU QD . 17 . HD* 1 1 209 1 1 1 1 13 HIS HE1 . 13 . HE1 1 1 209 1 2 1 1 17 LEU HG . 17 . HG 1 1 210 1 1 1 1 14 ALA H . 14 . HN 1 1 210 1 2 1 1 14 ALA HA . 14 . HA 1 1 211 1 1 1 1 14 ALA H . 14 . HN 1 1 211 1 2 1 1 14 ALA MB . 14 . HB* 1 1 212 1 1 1 1 14 ALA H . 14 . HN 1 1 212 1 2 1 1 15 LYS H . 15 . HN 1 1 213 1 1 1 1 14 ALA H . 14 . HN 1 1 213 1 2 1 1 17 LEU QD . 17 . HD* 1 1 214 1 1 1 1 14 ALA H . 14 . HN 1 1 214 1 2 1 1 26 TYR QE . 26 . HE* 1 1 215 1 1 1 1 14 ALA HA . 14 . HA 1 1 215 1 2 1 1 15 LYS H . 15 . HN 1 1 216 1 1 1 1 14 ALA HA . 14 . HA 1 1 216 1 2 1 1 17 LEU H . 17 . HN 1 1 217 1 1 1 1 14 ALA HA . 14 . HA 1 1 217 1 2 1 1 17 LEU QB . 17 . HB* 1 1 218 1 1 1 1 14 ALA HA . 14 . HA 1 1 218 1 2 1 1 17 LEU QD . 17 . HD* 1 1 219 1 1 1 1 14 ALA HA . 14 . HA 1 1 219 1 2 1 1 19 ASN H . 19 . HN 1 1 220 1 1 1 1 14 ALA HA . 14 . HA 1 1 220 1 2 1 1 19 ASN HB2 . 19 . HB2 1 1 221 1 1 1 1 14 ALA HA . 14 . HA 1 1 221 1 2 1 1 19 ASN HB3 . 19 . HB3 1 1 222 1 1 1 1 14 ALA HA . 14 . HA 1 1 222 1 2 1 1 19 ASN QD . 19 . HD2* 1 1 223 1 1 1 1 14 ALA MB . 14 . HB* 1 1 223 1 2 1 1 15 LYS H . 15 . HN 1 1 224 1 1 1 1 14 ALA MB . 14 . HB* 1 1 224 1 2 1 1 15 LYS HA . 15 . HA 1 1 225 1 1 1 1 14 ALA MB . 14 . HB* 1 1 225 1 2 1 1 15 LYS QB . 15 . HB* 1 1 226 1 1 1 1 14 ALA MB . 14 . HB* 1 1 226 1 2 1 1 17 LEU H . 17 . HN 1 1 227 1 1 1 1 14 ALA MB . 14 . HB* 1 1 227 1 2 1 1 19 ASN H . 19 . HN 1 1 228 1 1 1 1 14 ALA MB . 14 . HB* 1 1 228 1 2 1 1 19 ASN HB2 . 19 . HB2 1 1 229 1 1 1 1 14 ALA MB . 14 . HB* 1 1 229 1 2 1 1 19 ASN HB3 . 19 . HB3 1 1 230 1 1 1 1 14 ALA MB . 14 . HB* 1 1 230 1 2 1 1 19 ASN QD . 19 . HD2* 1 1 231 1 1 1 1 14 ALA MB . 14 . HB* 1 1 231 1 2 1 1 20 CYS H . 20 . HN 1 1 232 1 1 1 1 14 ALA MB . 14 . HB* 1 1 232 1 2 1 1 26 TYR H . 26 . HN 1 1 233 1 1 1 1 14 ALA MB . 14 . HB* 1 1 233 1 2 1 1 26 TYR HA . 26 . HA 1 1 234 1 1 1 1 14 ALA MB . 14 . HB* 1 1 234 1 2 1 1 26 TYR QD . 26 . HD* 1 1 235 1 1 1 1 14 ALA MB . 14 . HB* 1 1 235 1 2 1 1 26 TYR QE . 26 . HE* 1 1 236 1 1 1 1 14 ALA MB . 14 . HB* 1 1 236 1 2 1 1 30 CYS QB . 30 . HB* 1 1 237 1 1 1 1 15 LYS H . 15 . HN 1 1 237 1 2 1 1 15 LYS HA . 15 . HA 1 1 238 1 1 1 1 15 LYS H . 15 . HN 1 1 238 1 2 1 1 15 LYS QB . 15 . HB* 1 1 239 1 1 1 1 15 LYS H . 15 . HN 1 1 239 1 2 1 1 15 LYS QG . 15 . HG* 1 1 240 1 1 1 1 15 LYS H . 15 . HN 1 1 240 1 2 1 1 16 SER H . 16 . HN 1 1 241 1 1 1 1 15 LYS H . 15 . HN 1 1 241 1 2 1 1 16 SER QB . 16 . HB* 1 1 242 1 1 1 1 15 LYS H . 15 . HN 1 1 242 1 2 1 1 33 THR MG . 33 . HG2* 1 1 243 1 1 1 1 15 LYS HA . 15 . HA 1 1 243 1 2 1 1 15 LYS QB . 15 . HB* 1 1 244 1 1 1 1 15 LYS HA . 15 . HA 1 1 244 1 2 1 1 15 LYS QG . 15 . HG* 1 1 245 1 1 1 1 15 LYS HA . 15 . HA 1 1 245 1 2 1 1 16 SER H . 16 . HN 1 1 246 1 1 1 1 15 LYS HA . 15 . HA 1 1 246 1 2 1 1 18 GLY H . 18 . HN 1 1 247 1 1 1 1 15 LYS HA . 15 . HA 1 1 247 1 2 1 1 20 CYS H . 20 . HN 1 1 248 1 1 1 1 15 LYS HA . 15 . HA 1 1 248 1 2 1 1 33 THR MG . 33 . HG2* 1 1 249 1 1 1 1 15 LYS QB . 15 . HB* 1 1 249 1 2 1 1 16 SER H . 16 . HN 1 1 250 1 1 1 1 15 LYS QB . 15 . HB* 1 1 250 1 2 1 1 33 THR HA . 33 . HA 1 1 251 1 1 1 1 15 LYS QB . 15 . HB* 1 1 251 1 2 1 1 33 THR MG . 33 . HG2* 1 1 252 1 1 1 1 15 LYS QB . 15 . HB* 1 1 252 1 2 1 1 34 CYS H . 34 . HN 1 1 253 1 1 1 1 15 LYS QB . 15 . HB* 1 1 253 1 2 1 1 34 CYS HA . 34 . HA 1 1 254 1 1 1 1 15 LYS QB . 15 . HB* 1 1 254 1 2 1 1 34 CYS HB2 . 34 . HB2 1 1 255 1 1 1 1 15 LYS QE . 15 . HE* 1 1 255 1 2 1 1 15 LYS QG . 15 . HG* 1 1 256 1 1 1 1 15 LYS QG . 15 . HG* 1 1 256 1 2 1 1 16 SER H . 16 . HN 1 1 257 1 1 1 1 15 LYS QG . 15 . HG* 1 1 257 1 2 1 1 33 THR MG . 33 . HG2* 1 1 258 1 1 1 1 15 LYS QG . 15 . HG* 1 1 258 1 2 1 1 34 CYS HA . 34 . HA 1 1 259 1 1 1 1 16 SER H . 16 . HN 1 1 259 1 2 1 1 16 SER HA . 16 . HA 1 1 260 1 1 1 1 16 SER H . 16 . HN 1 1 260 1 2 1 1 16 SER QB . 16 . HB* 1 1 261 1 1 1 1 16 SER H . 16 . HN 1 1 261 1 2 1 1 17 LEU H . 17 . HN 1 1 262 1 1 1 1 16 SER H . 16 . HN 1 1 262 1 2 1 1 17 LEU QD . 17 . HD* 1 1 263 1 1 1 1 16 SER H . 16 . HN 1 1 263 1 2 1 1 33 THR MG . 33 . HG2* 1 1 264 1 1 1 1 16 SER HA . 16 . HA 1 1 264 1 2 1 1 16 SER QB . 16 . HB* 1 1 265 1 1 1 1 16 SER HA . 16 . HA 1 1 265 1 2 1 1 17 LEU H . 17 . HN 1 1 266 1 1 1 1 16 SER HA . 16 . HA 1 1 266 1 2 1 1 18 GLY H . 18 . HN 1 1 267 1 1 1 1 16 SER QB . 16 . HB* 1 1 267 1 2 1 1 17 LEU H . 17 . HN 1 1 268 1 1 1 1 16 SER QB . 16 . HB* 1 1 268 1 2 1 1 17 LEU QD . 17 . HD* 1 1 269 1 1 1 1 17 LEU H . 17 . HN 1 1 269 1 2 1 1 17 LEU HA . 17 . HA 1 1 270 1 1 1 1 17 LEU H . 17 . HN 1 1 270 1 2 1 1 17 LEU QB . 17 . HB* 1 1 271 1 1 1 1 17 LEU H . 17 . HN 1 1 271 1 2 1 1 17 LEU QD . 17 . HD* 1 1 272 1 1 1 1 17 LEU H . 17 . HN 1 1 272 1 2 1 1 17 LEU HG . 17 . HG 1 1 273 1 1 1 1 17 LEU H . 17 . HN 1 1 273 1 2 1 1 18 GLY H . 18 . HN 1 1 274 1 1 1 1 17 LEU H . 17 . HN 1 1 274 1 2 1 1 19 ASN H . 19 . HN 1 1 275 1 1 1 1 17 LEU HA . 17 . HA 1 1 275 1 2 1 1 17 LEU QD . 17 . HD* 1 1 276 1 1 1 1 17 LEU HA . 17 . HA 1 1 276 1 2 1 1 17 LEU HG . 17 . HG 1 1 277 1 1 1 1 17 LEU HA . 17 . HA 1 1 277 1 2 1 1 18 GLY H . 18 . HN 1 1 278 1 1 1 1 17 LEU QB . 17 . HB* 1 1 278 1 2 1 1 18 GLY H . 18 . HN 1 1 279 1 1 1 1 17 LEU QB . 17 . HB* 1 1 279 1 2 1 1 19 ASN H . 19 . HN 1 1 280 1 1 1 1 17 LEU QB . 17 . HB* 1 1 280 1 2 1 1 19 ASN QD . 19 . HD2* 1 1 281 1 1 1 1 17 LEU QD . 17 . HD* 1 1 281 1 2 1 1 18 GLY H . 18 . HN 1 1 282 1 1 1 1 17 LEU QD . 17 . HD* 1 1 282 1 2 1 1 18 GLY QA . 18 . HA* 1 1 283 1 1 1 1 17 LEU QD . 17 . HD* 1 1 283 1 2 1 1 19 ASN H . 19 . HN 1 1 284 1 1 1 1 17 LEU QD . 17 . HD* 1 1 284 1 2 1 1 19 ASN QD . 19 . HD2* 1 1 285 1 1 1 1 17 LEU QD . 17 . HD* 1 1 285 1 2 1 1 20 CYS H . 20 . HN 1 1 286 1 1 1 1 17 LEU QD . 17 . HD* 1 1 286 1 2 1 1 26 TYR QD . 26 . HD* 1 1 287 1 1 1 1 17 LEU QD . 17 . HD* 1 1 287 1 2 1 1 26 TYR QE . 26 . HE* 1 1 288 1 1 1 1 18 GLY H . 18 . HN 1 1 288 1 2 1 1 18 GLY QA . 18 . HA* 1 1 289 1 1 1 1 18 GLY H . 18 . HN 1 1 289 1 2 1 1 19 ASN H . 19 . HN 1 1 290 1 1 1 1 18 GLY H . 18 . HN 1 1 290 1 2 1 1 19 ASN HB3 . 19 . HB3 1 1 291 1 1 1 1 18 GLY QA . 18 . HA* 1 1 291 1 2 1 1 19 ASN H . 19 . HN 1 1 292 1 1 1 1 19 ASN H . 19 . HN 1 1 292 1 2 1 1 19 ASN HA . 19 . HA 1 1 293 1 1 1 1 19 ASN H . 19 . HN 1 1 293 1 2 1 1 19 ASN HB2 . 19 . HB2 1 1 294 1 1 1 1 19 ASN H . 19 . HN 1 1 294 1 2 1 1 19 ASN HB3 . 19 . HB3 1 1 295 1 1 1 1 19 ASN H . 19 . HN 1 1 295 1 2 1 1 19 ASN QD . 19 . HD2* 1 1 296 1 1 1 1 19 ASN H . 19 . HN 1 1 296 1 2 1 1 20 CYS H . 20 . HN 1 1 297 1 1 1 1 19 ASN H . 19 . HN 1 1 297 1 2 1 1 23 SER QB . 23 . HB* 1 1 298 1 1 1 1 19 ASN HA . 19 . HA 1 1 298 1 2 1 1 19 ASN HB2 . 19 . HB2 1 1 299 1 1 1 1 19 ASN HA . 19 . HA 1 1 299 1 2 1 1 19 ASN HB3 . 19 . HB3 1 1 300 1 1 1 1 19 ASN HA . 19 . HA 1 1 300 1 2 1 1 20 CYS H . 20 . HN 1 1 301 1 1 1 1 19 ASN HA . 19 . HA 1 1 301 1 2 1 1 21 ARG H . 21 . HN 1 1 302 1 1 1 1 19 ASN HA . 19 . HA 1 1 302 1 2 1 1 22 THR H . 22 . HN 1 1 303 1 1 1 1 19 ASN HA . 19 . HA 1 1 303 1 2 1 1 22 THR MG . 22 . HG2* 1 1 304 1 1 1 1 19 ASN HA . 19 . HA 1 1 304 1 2 1 1 23 SER H . 23 . HN 1 1 305 1 1 1 1 19 ASN HB2 . 19 . HB2 1 1 305 1 2 1 1 20 CYS H . 20 . HN 1 1 306 1 1 1 1 19 ASN HB2 . 19 . HB2 1 1 306 1 2 1 1 23 SER H . 23 . HN 1 1 307 1 1 1 1 19 ASN HB2 . 19 . HB2 1 1 307 1 2 1 1 23 SER QB . 23 . HB* 1 1 308 1 1 1 1 19 ASN HB3 . 19 . HB3 1 1 308 1 2 1 1 20 CYS H . 20 . HN 1 1 309 1 1 1 1 19 ASN HB3 . 19 . HB3 1 1 309 1 2 1 1 23 SER QB . 23 . HB* 1 1 310 1 1 1 1 19 ASN HB3 . 19 . HB3 1 1 310 1 2 1 1 26 TYR QD . 26 . HD* 1 1 311 1 1 1 1 19 ASN HB3 . 19 . HB3 1 1 311 1 2 1 1 26 TYR QE . 26 . HE* 1 1 312 1 1 1 1 19 ASN QD . 19 . HD2* 1 1 312 1 2 1 1 26 TYR HA . 26 . HA 1 1 313 1 1 1 1 19 ASN QD . 19 . HD2* 1 1 313 1 2 1 1 26 TYR QD . 26 . HD* 1 1 314 1 1 1 1 20 CYS CB . 20 . CB 1 1 314 1 2 1 1 34 CYS SG . 34 . SG 1 1 315 1 1 1 1 20 CYS H . 20 . HN 1 1 315 1 2 1 1 20 CYS HA . 20 . HA 1 1 316 1 1 1 1 20 CYS H . 20 . HN 1 1 316 1 2 1 1 20 CYS QB . 20 . HB* 1 1 317 1 1 1 1 20 CYS H . 20 . HN 1 1 317 1 2 1 1 21 ARG H . 21 . HN 1 1 318 1 1 1 1 20 CYS H . 20 . HN 1 1 318 1 2 1 1 22 THR H . 22 . HN 1 1 319 1 1 1 1 20 CYS HA . 20 . HA 1 1 319 1 2 1 1 20 CYS QB . 20 . HB* 1 1 320 1 1 1 1 20 CYS QB . 20 . HB* 1 1 320 1 2 1 1 21 ARG H . 21 . HN 1 1 321 1 1 1 1 20 CYS QB . 20 . HB* 1 1 321 1 2 1 1 34 CYS HA . 34 . HA 1 1 322 1 1 1 1 20 CYS QB . 20 . HB* 1 1 322 1 2 1 1 36 LEU QD . 36 . HD* 1 1 323 1 1 1 1 20 CYS SG . 20 . SG 1 1 323 1 2 1 1 34 CYS CB . 34 . CB 1 1 324 1 1 1 1 20 CYS SG . 20 . SG 1 1 324 1 2 1 1 34 CYS SG . 34 . SG 1 1 325 1 1 1 1 21 ARG H . 21 . HN 1 1 325 1 2 1 1 21 ARG QB . 21 . HB* 1 1 326 1 1 1 1 21 ARG H . 21 . HN 1 1 326 1 2 1 1 21 ARG QG . 21 . HG* 1 1 327 1 1 1 1 21 ARG H . 21 . HN 1 1 327 1 2 1 1 22 THR H . 22 . HN 1 1 328 1 1 1 1 21 ARG H . 21 . HN 1 1 328 1 2 1 1 22 THR MG . 22 . HG2* 1 1 329 1 1 1 1 21 ARG H . 21 . HN 1 1 329 1 2 1 1 36 LEU QD . 36 . HD* 1 1 330 1 1 1 1 21 ARG HA . 21 . HA 1 1 330 1 2 1 1 21 ARG QB . 21 . HB* 1 1 331 1 1 1 1 21 ARG HA . 21 . HA 1 1 331 1 2 1 1 21 ARG QG . 21 . HG* 1 1 332 1 1 1 1 21 ARG HA . 21 . HA 1 1 332 1 2 1 1 22 THR H . 22 . HN 1 1 333 1 1 1 1 21 ARG HA . 21 . HA 1 1 333 1 2 1 1 27 ARG QH2 . 27 . HH2* 1 1 334 1 1 1 1 21 ARG QB . 21 . HB* 1 1 334 1 2 1 1 22 THR H . 22 . HN 1 1 335 1 1 1 1 21 ARG QB . 21 . HB* 1 1 335 1 2 1 1 22 THR MG . 22 . HG2* 1 1 336 1 1 1 1 21 ARG QG . 21 . HG* 1 1 336 1 2 1 1 27 ARG QB . 27 . HB* 1 1 337 1 1 1 1 22 THR H . 22 . HN 1 1 337 1 2 1 1 22 THR MG . 22 . HG2* 1 1 338 1 1 1 1 22 THR H . 22 . HN 1 1 338 1 2 1 1 23 SER H . 23 . HN 1 1 339 1 1 1 1 22 THR H . 22 . HN 1 1 339 1 2 1 1 23 SER QB . 23 . HB* 1 1 340 1 1 1 1 22 THR H . 22 . HN 1 1 340 1 2 1 1 27 ARG QB . 27 . HB* 1 1 341 1 1 1 1 22 THR MG . 22 . HG2* 1 1 341 1 2 1 1 23 SER H . 23 . HN 1 1 342 1 1 1 1 23 SER H . 23 . HN 1 1 342 1 2 1 1 23 SER HA . 23 . HA 1 1 343 1 1 1 1 23 SER H . 23 . HN 1 1 343 1 2 1 1 23 SER QB . 23 . HB* 1 1 344 1 1 1 1 23 SER H . 23 . HN 1 1 344 1 2 1 1 24 GLN H . 24 . HN 1 1 345 1 1 1 1 23 SER H . 23 . HN 1 1 345 1 2 1 1 27 ARG QG . 27 . HG* 1 1 346 1 1 1 1 23 SER HA . 23 . HA 1 1 346 1 2 1 1 23 SER QB . 23 . HB* 1 1 347 1 1 1 1 23 SER HA . 23 . HA 1 1 347 1 2 1 1 24 GLN H . 24 . HN 1 1 348 1 1 1 1 23 SER HA . 23 . HA 1 1 348 1 2 1 1 25 LYS H . 25 . HN 1 1 349 1 1 1 1 23 SER HA . 23 . HA 1 1 349 1 2 1 1 26 TYR QB . 26 . HB* 1 1 350 1 1 1 1 23 SER HA . 23 . HA 1 1 350 1 2 1 1 26 TYR QD . 26 . HD* 1 1 351 1 1 1 1 23 SER QB . 23 . HB* 1 1 351 1 2 1 1 24 GLN H . 24 . HN 1 1 352 1 1 1 1 23 SER QB . 23 . HB* 1 1 352 1 2 1 1 26 TYR H . 26 . HN 1 1 353 1 1 1 1 23 SER QB . 23 . HB* 1 1 353 1 2 1 1 26 TYR QD . 26 . HD* 1 1 354 1 1 1 1 23 SER QB . 23 . HB* 1 1 354 1 2 1 1 26 TYR QE . 26 . HE* 1 1 355 1 1 1 1 23 SER QB . 23 . HB* 1 1 355 1 2 1 1 27 ARG H . 27 . HN 1 1 356 1 1 1 1 24 GLN H . 24 . HN 1 1 356 1 2 1 1 24 GLN HA . 24 . HA 1 1 357 1 1 1 1 24 GLN H . 24 . HN 1 1 357 1 2 1 1 24 GLN QB . 24 . HB* 1 1 358 1 1 1 1 24 GLN H . 24 . HN 1 1 358 1 2 1 1 24 GLN QG . 24 . HG* 1 1 359 1 1 1 1 24 GLN H . 24 . HN 1 1 359 1 2 1 1 25 LYS H . 25 . HN 1 1 360 1 1 1 1 24 GLN H . 24 . HN 1 1 360 1 2 1 1 25 LYS QB . 25 . HB* 1 1 361 1 1 1 1 24 GLN H . 24 . HN 1 1 361 1 2 1 1 26 TYR H . 26 . HN 1 1 362 1 1 1 1 24 GLN HA . 24 . HA 1 1 362 1 2 1 1 24 GLN QG . 24 . HG* 1 1 363 1 1 1 1 24 GLN HA . 24 . HA 1 1 363 1 2 1 1 27 ARG H . 27 . HN 1 1 364 1 1 1 1 24 GLN HA . 24 . HA 1 1 364 1 2 1 1 27 ARG QB . 27 . HB* 1 1 365 1 1 1 1 24 GLN HA . 24 . HA 1 1 365 1 2 1 1 27 ARG QD . 27 . HD* 1 1 366 1 1 1 1 24 GLN HA . 24 . HA 1 1 366 1 2 1 1 27 ARG QG . 27 . HG* 1 1 367 1 1 1 1 24 GLN QB . 24 . HB* 1 1 367 1 2 1 1 25 LYS H . 25 . HN 1 1 368 1 1 1 1 24 GLN QB . 24 . HB* 1 1 368 1 2 1 1 26 TYR H . 26 . HN 1 1 369 1 1 1 1 24 GLN QG . 24 . HG* 1 1 369 1 2 1 1 25 LYS H . 25 . HN 1 1 370 1 1 1 1 25 LYS H . 25 . HN 1 1 370 1 2 1 1 25 LYS HA . 25 . HA 1 1 371 1 1 1 1 25 LYS H . 25 . HN 1 1 371 1 2 1 1 25 LYS QB . 25 . HB* 1 1 372 1 1 1 1 25 LYS H . 25 . HN 1 1 372 1 2 1 1 25 LYS QD . 25 . HD* 1 1 373 1 1 1 1 25 LYS H . 25 . HN 1 1 373 1 2 1 1 25 LYS QG . 25 . HG* 1 1 374 1 1 1 1 25 LYS H . 25 . HN 1 1 374 1 2 1 1 26 TYR H . 26 . HN 1 1 375 1 1 1 1 25 LYS H . 25 . HN 1 1 375 1 2 1 1 26 TYR QB . 26 . HB* 1 1 376 1 1 1 1 25 LYS H . 25 . HN 1 1 376 1 2 1 1 26 TYR QD . 26 . HD* 1 1 377 1 1 1 1 25 LYS HA . 25 . HA 1 1 377 1 2 1 1 25 LYS QG . 25 . HG* 1 1 378 1 1 1 1 25 LYS HA . 25 . HA 1 1 378 1 2 1 1 26 TYR H . 26 . HN 1 1 379 1 1 1 1 25 LYS HA . 25 . HA 1 1 379 1 2 1 1 28 ALA H . 28 . HN 1 1 380 1 1 1 1 25 LYS HA . 25 . HA 1 1 380 1 2 1 1 28 ALA MB . 28 . HB* 1 1 381 1 1 1 1 25 LYS HA . 25 . HA 1 1 381 1 2 1 1 29 ASN QD . 29 . HD2* 1 1 382 1 1 1 1 25 LYS QB . 25 . HB* 1 1 382 1 2 1 1 26 TYR H . 26 . HN 1 1 383 1 1 1 1 25 LYS QB . 25 . HB* 1 1 383 1 2 1 1 26 TYR QD . 26 . HD* 1 1 384 1 1 1 1 25 LYS QD . 25 . HD* 1 1 384 1 2 1 1 26 TYR QD . 26 . HD* 1 1 385 1 1 1 1 25 LYS QD . 25 . HD* 1 1 385 1 2 1 1 29 ASN QD . 29 . HD2* 1 1 386 1 1 1 1 25 LYS QG . 25 . HG* 1 1 386 1 2 1 1 26 TYR H . 26 . HN 1 1 387 1 1 1 1 25 LYS QG . 25 . HG* 1 1 387 1 2 1 1 26 TYR QD . 26 . HD* 1 1 388 1 1 1 1 25 LYS QG . 25 . HG* 1 1 388 1 2 1 1 29 ASN QD . 29 . HD2* 1 1 389 1 1 1 1 26 TYR H . 26 . HN 1 1 389 1 2 1 1 26 TYR HA . 26 . HA 1 1 390 1 1 1 1 26 TYR H . 26 . HN 1 1 390 1 2 1 1 26 TYR QB . 26 . HB* 1 1 391 1 1 1 1 26 TYR H . 26 . HN 1 1 391 1 2 1 1 26 TYR QD . 26 . HD* 1 1 392 1 1 1 1 26 TYR H . 26 . HN 1 1 392 1 2 1 1 27 ARG H . 27 . HN 1 1 393 1 1 1 1 26 TYR HA . 26 . HA 1 1 393 1 2 1 1 26 TYR QD . 26 . HD* 1 1 394 1 1 1 1 26 TYR HA . 26 . HA 1 1 394 1 2 1 1 26 TYR QE . 26 . HE* 1 1 395 1 1 1 1 26 TYR HA . 26 . HA 1 1 395 1 2 1 1 29 ASN QB . 29 . HB* 1 1 396 1 1 1 1 26 TYR QB . 26 . HB* 1 1 396 1 2 1 1 26 TYR QD . 26 . HD* 1 1 397 1 1 1 1 26 TYR QB . 26 . HB* 1 1 397 1 2 1 1 27 ARG H . 27 . HN 1 1 398 1 1 1 1 26 TYR QB . 26 . HB* 1 1 398 1 2 1 1 30 CYS H . 30 . HN 1 1 399 1 1 1 1 26 TYR QD . 26 . HD* 1 1 399 1 2 1 1 27 ARG H . 27 . HN 1 1 400 1 1 1 1 26 TYR QD . 26 . HD* 1 1 400 1 2 1 1 29 ASN QB . 29 . HB* 1 1 401 1 1 1 1 26 TYR QD . 26 . HD* 1 1 401 1 2 1 1 30 CYS QB . 30 . HB* 1 1 402 1 1 1 1 27 ARG H . 27 . HN 1 1 402 1 2 1 1 27 ARG HA . 27 . HA 1 1 403 1 1 1 1 27 ARG H . 27 . HN 1 1 403 1 2 1 1 27 ARG QB . 27 . HB* 1 1 404 1 1 1 1 27 ARG H . 27 . HN 1 1 404 1 2 1 1 27 ARG QD . 27 . HD* 1 1 405 1 1 1 1 27 ARG H . 27 . HN 1 1 405 1 2 1 1 27 ARG QG . 27 . HG* 1 1 406 1 1 1 1 27 ARG H . 27 . HN 1 1 406 1 2 1 1 28 ALA H . 28 . HN 1 1 407 1 1 1 1 27 ARG H . 27 . HN 1 1 407 1 2 1 1 29 ASN H . 29 . HN 1 1 408 1 1 1 1 27 ARG H . 27 . HN 1 1 408 1 2 1 1 36 LEU QD . 36 . HD* 1 1 409 1 1 1 1 27 ARG HA . 27 . HA 1 1 409 1 2 1 1 27 ARG QG . 27 . HG* 1 1 410 1 1 1 1 27 ARG HA . 27 . HA 1 1 410 1 2 1 1 28 ALA H . 28 . HN 1 1 411 1 1 1 1 27 ARG HA . 27 . HA 1 1 411 1 2 1 1 36 LEU QD . 36 . HD* 1 1 412 1 1 1 1 27 ARG QB . 27 . HB* 1 1 412 1 2 1 1 27 ARG HE . 27 . HE 1 1 413 1 1 1 1 27 ARG QB . 27 . HB* 1 1 413 1 2 1 1 27 ARG QH2 . 27 . HH2* 1 1 414 1 1 1 1 27 ARG QB . 27 . HB* 1 1 414 1 2 1 1 28 ALA H . 28 . HN 1 1 415 1 1 1 1 27 ARG QD . 27 . HD* 1 1 415 1 2 1 1 27 ARG HE . 27 . HE 1 1 416 1 1 1 1 27 ARG QD . 27 . HD* 1 1 416 1 2 1 1 27 ARG QH2 . 27 . HH2* 1 1 417 1 1 1 1 27 ARG HE . 27 . HE 1 1 417 1 2 1 1 27 ARG QG . 27 . HG* 1 1 418 1 1 1 1 27 ARG HE . 27 . HE 1 1 418 1 2 1 1 27 ARG QH2 . 27 . HH2* 1 1 419 1 1 1 1 27 ARG HE . 27 . HE 1 1 419 1 2 1 1 36 LEU QD . 36 . HD* 1 1 420 1 1 1 1 27 ARG QG . 27 . HG* 1 1 420 1 2 1 1 27 ARG QH2 . 27 . HH2* 1 1 421 1 1 1 1 27 ARG QG . 27 . HG* 1 1 421 1 2 1 1 36 LEU HB3 . 36 . HB3 1 1 422 1 1 1 1 27 ARG QG . 27 . HG* 1 1 422 1 2 1 1 36 LEU QD . 36 . HD* 1 1 423 1 1 1 1 27 ARG QH2 . 27 . HH2* 1 1 423 1 2 1 1 36 LEU QD . 36 . HD* 1 1 424 1 1 1 1 28 ALA H . 28 . HN 1 1 424 1 2 1 1 28 ALA HA . 28 . HA 1 1 425 1 1 1 1 28 ALA H . 28 . HN 1 1 425 1 2 1 1 28 ALA MB . 28 . HB* 1 1 426 1 1 1 1 28 ALA H . 28 . HN 1 1 426 1 2 1 1 29 ASN H . 29 . HN 1 1 427 1 1 1 1 28 ALA H . 28 . HN 1 1 427 1 2 1 1 29 ASN QD . 29 . HD2* 1 1 428 1 1 1 1 28 ALA H . 28 . HN 1 1 428 1 2 1 1 30 CYS H . 30 . HN 1 1 429 1 1 1 1 28 ALA HA . 28 . HA 1 1 429 1 2 1 1 29 ASN H . 29 . HN 1 1 430 1 1 1 1 28 ALA HA . 28 . HA 1 1 430 1 2 1 1 31 ALA MB . 31 . HB* 1 1 431 1 1 1 1 28 ALA MB . 28 . HB* 1 1 431 1 2 1 1 29 ASN H . 29 . HN 1 1 432 1 1 1 1 28 ALA MB . 28 . HB* 1 1 432 1 2 1 1 29 ASN QD . 29 . HD2* 1 1 433 1 1 1 1 29 ASN H . 29 . HN 1 1 433 1 2 1 1 29 ASN QB . 29 . HB* 1 1 434 1 1 1 1 29 ASN H . 29 . HN 1 1 434 1 2 1 1 30 CYS H . 30 . HN 1 1 435 1 1 1 1 29 ASN H . 29 . HN 1 1 435 1 2 1 1 31 ALA H . 31 . HN 1 1 436 1 1 1 1 29 ASN QB . 29 . HB* 1 1 436 1 2 1 1 29 ASN QD . 29 . HD2* 1 1 437 1 1 1 1 29 ASN QB . 29 . HB* 1 1 437 1 2 1 1 30 CYS HA . 30 . HA 1 1 438 1 1 1 1 29 ASN QD . 29 . HD2* 1 1 438 1 2 1 1 30 CYS H . 30 . HN 1 1 439 1 1 1 1 30 CYS H . 30 . HN 1 1 439 1 2 1 1 30 CYS HA . 30 . HA 1 1 440 1 1 1 1 30 CYS H . 30 . HN 1 1 440 1 2 1 1 30 CYS QB . 30 . HB* 1 1 441 1 1 1 1 30 CYS H . 30 . HN 1 1 441 1 2 1 1 31 ALA H . 31 . HN 1 1 442 1 1 1 1 30 CYS HA . 30 . HA 1 1 442 1 2 1 1 30 CYS QB . 30 . HB* 1 1 443 1 1 1 1 30 CYS HA . 30 . HA 1 1 443 1 2 1 1 31 ALA H . 31 . HN 1 1 444 1 1 1 1 30 CYS HA . 30 . HA 1 1 444 1 2 1 1 31 ALA MB . 31 . HB* 1 1 445 1 1 1 1 30 CYS HA . 30 . HA 1 1 445 1 2 1 1 32 LYS H . 32 . HN 1 1 446 1 1 1 1 30 CYS HA . 30 . HA 1 1 446 1 2 1 1 33 THR H . 33 . HN 1 1 447 1 1 1 1 30 CYS HA . 30 . HA 1 1 447 1 2 1 1 33 THR HB . 33 . HB 1 1 448 1 1 1 1 30 CYS HA . 30 . HA 1 1 448 1 2 1 1 33 THR MG . 33 . HG2* 1 1 449 1 1 1 1 30 CYS HA . 30 . HA 1 1 449 1 2 1 1 34 CYS H . 34 . HN 1 1 450 1 1 1 1 30 CYS QB . 30 . HB* 1 1 450 1 2 1 1 31 ALA H . 31 . HN 1 1 451 1 1 1 1 30 CYS QB . 30 . HB* 1 1 451 1 2 1 1 33 THR H . 33 . HN 1 1 452 1 1 1 1 30 CYS QB . 30 . HB* 1 1 452 1 2 1 1 33 THR HB . 33 . HB 1 1 453 1 1 1 1 30 CYS QB . 30 . HB* 1 1 453 1 2 1 1 33 THR MG . 33 . HG2* 1 1 454 1 1 1 1 30 CYS QB . 30 . HB* 1 1 454 1 2 1 1 34 CYS H . 34 . HN 1 1 455 1 1 1 1 31 ALA H . 31 . HN 1 1 455 1 2 1 1 31 ALA HA . 31 . HA 1 1 456 1 1 1 1 31 ALA H . 31 . HN 1 1 456 1 2 1 1 31 ALA MB . 31 . HB* 1 1 457 1 1 1 1 31 ALA H . 31 . HN 1 1 457 1 2 1 1 32 LYS H . 32 . HN 1 1 458 1 1 1 1 31 ALA H . 31 . HN 1 1 458 1 2 1 1 32 LYS QB . 32 . HB* 1 1 459 1 1 1 1 31 ALA H . 31 . HN 1 1 459 1 2 1 1 34 CYS HB3 . 34 . HB3 1 1 460 1 1 1 1 31 ALA H . 31 . HN 1 1 460 1 2 1 1 36 LEU QD . 36 . HD* 1 1 461 1 1 1 1 31 ALA HA . 31 . HA 1 1 461 1 2 1 1 32 LYS H . 32 . HN 1 1 462 1 1 1 1 31 ALA HA . 31 . HA 1 1 462 1 2 1 1 34 CYS HB2 . 34 . HB2 1 1 463 1 1 1 1 31 ALA HA . 31 . HA 1 1 463 1 2 1 1 34 CYS HB3 . 34 . HB3 1 1 464 1 1 1 1 31 ALA HA . 31 . HA 1 1 464 1 2 1 1 36 LEU H . 36 . HN 1 1 465 1 1 1 1 31 ALA HA . 31 . HA 1 1 465 1 2 1 1 36 LEU HB2 . 36 . HB2 1 1 466 1 1 1 1 31 ALA HA . 31 . HA 1 1 466 1 2 1 1 36 LEU HB3 . 36 . HB3 1 1 467 1 1 1 1 31 ALA HA . 31 . HA 1 1 467 1 2 1 1 36 LEU QD . 36 . HD* 1 1 468 1 1 1 1 31 ALA MB . 31 . HB* 1 1 468 1 2 1 1 32 LYS H . 32 . HN 1 1 469 1 1 1 1 32 LYS H . 32 . HN 1 1 469 1 2 1 1 32 LYS HA . 32 . HA 1 1 470 1 1 1 1 32 LYS H . 32 . HN 1 1 470 1 2 1 1 32 LYS QB . 32 . HB* 1 1 471 1 1 1 1 32 LYS H . 32 . HN 1 1 471 1 2 1 1 33 THR H . 33 . HN 1 1 472 1 1 1 1 32 LYS H . 32 . HN 1 1 472 1 2 1 1 33 THR HB . 33 . HB 1 1 473 1 1 1 1 32 LYS H . 32 . HN 1 1 473 1 2 1 1 34 CYS H . 34 . HN 1 1 474 1 1 1 1 32 LYS HA . 32 . HA 1 1 474 1 2 1 1 32 LYS QB . 32 . HB* 1 1 475 1 1 1 1 32 LYS HA . 32 . HA 1 1 475 1 2 1 1 33 THR H . 33 . HN 1 1 476 1 1 1 1 32 LYS QB . 32 . HB* 1 1 476 1 2 1 1 32 LYS QE . 32 . HE* 1 1 477 1 1 1 1 32 LYS QB . 32 . HB* 1 1 477 1 2 1 1 33 THR H . 33 . HN 1 1 478 1 1 1 1 32 LYS QB . 32 . HB* 1 1 478 1 2 1 1 34 CYS H . 34 . HN 1 1 479 1 1 1 1 32 LYS QB . 32 . HB* 1 1 479 1 2 1 1 37 CYS H . 37 . HN 1 1 480 1 1 1 1 33 THR H . 33 . HN 1 1 480 1 2 1 1 33 THR HA . 33 . HA 1 1 481 1 1 1 1 33 THR H . 33 . HN 1 1 481 1 2 1 1 33 THR HB . 33 . HB 1 1 482 1 1 1 1 33 THR H . 33 . HN 1 1 482 1 2 1 1 33 THR MG . 33 . HG2* 1 1 483 1 1 1 1 33 THR H . 33 . HN 1 1 483 1 2 1 1 34 CYS H . 34 . HN 1 1 484 1 1 1 1 33 THR H . 33 . HN 1 1 484 1 2 1 1 35 GLU H . 35 . HN 1 1 485 1 1 1 1 33 THR HA . 33 . HA 1 1 485 1 2 1 1 33 THR HB . 33 . HB 1 1 486 1 1 1 1 33 THR HA . 33 . HA 1 1 486 1 2 1 1 33 THR MG . 33 . HG2* 1 1 487 1 1 1 1 33 THR HA . 33 . HA 1 1 487 1 2 1 1 34 CYS H . 34 . HN 1 1 488 1 1 1 1 33 THR HA . 33 . HA 1 1 488 1 2 1 1 35 GLU H . 35 . HN 1 1 489 1 1 1 1 33 THR HB . 33 . HB 1 1 489 1 2 1 1 34 CYS H . 34 . HN 1 1 490 1 1 1 1 33 THR MG . 33 . HG2* 1 1 490 1 2 1 1 34 CYS H . 34 . HN 1 1 491 1 1 1 1 33 THR MG . 33 . HG2* 1 1 491 1 2 1 1 34 CYS HA . 34 . HA 1 1 492 1 1 1 1 33 THR MG . 33 . HG2* 1 1 492 1 2 1 1 35 GLU H . 35 . HN 1 1 493 1 1 1 1 34 CYS H . 34 . HN 1 1 493 1 2 1 1 34 CYS HA . 34 . HA 1 1 494 1 1 1 1 34 CYS H . 34 . HN 1 1 494 1 2 1 1 34 CYS HB2 . 34 . HB2 1 1 495 1 1 1 1 34 CYS H . 34 . HN 1 1 495 1 2 1 1 34 CYS HB3 . 34 . HB3 1 1 496 1 1 1 1 34 CYS H . 34 . HN 1 1 496 1 2 1 1 35 GLU H . 35 . HN 1 1 497 1 1 1 1 34 CYS H . 34 . HN 1 1 497 1 2 1 1 35 GLU HA . 35 . HA 1 1 498 1 1 1 1 34 CYS H . 34 . HN 1 1 498 1 2 1 1 35 GLU QB . 35 . HB* 1 1 499 1 1 1 1 34 CYS H . 34 . HN 1 1 499 1 2 1 1 35 GLU QG . 35 . HG* 1 1 500 1 1 1 1 34 CYS H . 34 . HN 1 1 500 1 2 1 1 36 LEU QD . 36 . HD* 1 1 501 1 1 1 1 34 CYS H . 34 . HN 1 1 501 1 2 1 1 36 LEU HG . 36 . HG 1 1 502 1 1 1 1 34 CYS HA . 34 . HA 1 1 502 1 2 1 1 34 CYS HB2 . 34 . HB2 1 1 503 1 1 1 1 34 CYS HA . 34 . HA 1 1 503 1 2 1 1 34 CYS HB3 . 34 . HB3 1 1 504 1 1 1 1 34 CYS HA . 34 . HA 1 1 504 1 2 1 1 35 GLU H . 35 . HN 1 1 505 1 1 1 1 34 CYS HB2 . 34 . HB2 1 1 505 1 2 1 1 36 LEU H . 36 . HN 1 1 506 1 1 1 1 34 CYS HB2 . 34 . HB2 1 1 506 1 2 1 1 36 LEU QD . 36 . HD* 1 1 507 1 1 1 1 34 CYS HB2 . 34 . HB2 1 1 507 1 2 1 1 36 LEU HG . 36 . HG 1 1 508 1 1 1 1 34 CYS HB3 . 34 . HB3 1 1 508 1 2 1 1 35 GLU H . 35 . HN 1 1 509 1 1 1 1 34 CYS HB3 . 34 . HB3 1 1 509 1 2 1 1 36 LEU H . 36 . HN 1 1 510 1 1 1 1 34 CYS HB3 . 34 . HB3 1 1 510 1 2 1 1 36 LEU QD . 36 . HD* 1 1 511 1 1 1 1 34 CYS HB3 . 34 . HB3 1 1 511 1 2 1 1 36 LEU HG . 36 . HG 1 1 512 1 1 1 1 35 GLU H . 35 . HN 1 1 512 1 2 1 1 35 GLU HA . 35 . HA 1 1 513 1 1 1 1 35 GLU H . 35 . HN 1 1 513 1 2 1 1 35 GLU QB . 35 . HB* 1 1 514 1 1 1 1 35 GLU H . 35 . HN 1 1 514 1 2 1 1 35 GLU QG . 35 . HG* 1 1 515 1 1 1 1 35 GLU H . 35 . HN 1 1 515 1 2 1 1 36 LEU H . 36 . HN 1 1 516 1 1 1 1 35 GLU H . 35 . HN 1 1 516 1 2 1 1 36 LEU HB2 . 36 . HB2 1 1 517 1 1 1 1 35 GLU H . 35 . HN 1 1 517 1 2 1 1 36 LEU HB3 . 36 . HB3 1 1 518 1 1 1 1 35 GLU H . 35 . HN 1 1 518 1 2 1 1 36 LEU QD . 36 . HD* 1 1 519 1 1 1 1 35 GLU H . 35 . HN 1 1 519 1 2 1 1 37 CYS H . 37 . HN 1 1 520 1 1 1 1 35 GLU HA . 35 . HA 1 1 520 1 2 1 1 35 GLU QB . 35 . HB* 1 1 521 1 1 1 1 35 GLU HA . 35 . HA 1 1 521 1 2 1 1 35 GLU QG . 35 . HG* 1 1 522 1 1 1 1 35 GLU HA . 35 . HA 1 1 522 1 2 1 1 36 LEU H . 36 . HN 1 1 523 1 1 1 1 35 GLU HA . 35 . HA 1 1 523 1 2 1 1 37 CYS H . 37 . HN 1 1 524 1 1 1 1 35 GLU QB . 35 . HB* 1 1 524 1 2 1 1 36 LEU H . 36 . HN 1 1 525 1 1 1 1 35 GLU QB . 35 . HB* 1 1 525 1 2 1 1 37 CYS H . 37 . HN 1 1 526 1 1 1 1 35 GLU QG . 35 . HG* 1 1 526 1 2 1 1 36 LEU H . 36 . HN 1 1 527 1 1 1 1 35 GLU QG . 35 . HG* 1 1 527 1 2 1 1 37 CYS H . 37 . HN 1 1 528 1 1 1 1 36 LEU H . 36 . HN 1 1 528 1 2 1 1 36 LEU HA . 36 . HA 1 1 529 1 1 1 1 36 LEU H . 36 . HN 1 1 529 1 2 1 1 36 LEU HB2 . 36 . HB2 1 1 530 1 1 1 1 36 LEU H . 36 . HN 1 1 530 1 2 1 1 36 LEU HB3 . 36 . HB3 1 1 531 1 1 1 1 36 LEU H . 36 . HN 1 1 531 1 2 1 1 36 LEU QD . 36 . HD* 1 1 532 1 1 1 1 36 LEU H . 36 . HN 1 1 532 1 2 1 1 36 LEU HG . 36 . HG 1 1 533 1 1 1 1 36 LEU H . 36 . HN 1 1 533 1 2 1 1 37 CYS H . 37 . HN 1 1 534 1 1 1 1 36 LEU HA . 36 . HA 1 1 534 1 2 1 1 36 LEU HB2 . 36 . HB2 1 1 535 1 1 1 1 36 LEU HA . 36 . HA 1 1 535 1 2 1 1 36 LEU HB3 . 36 . HB3 1 1 536 1 1 1 1 36 LEU HA . 36 . HA 1 1 536 1 2 1 1 36 LEU QD . 36 . HD* 1 1 537 1 1 1 1 36 LEU HA . 36 . HA 1 1 537 1 2 1 1 36 LEU HG . 36 . HG 1 1 538 1 1 1 1 36 LEU HA . 36 . HA 1 1 538 1 2 1 1 37 CYS H . 37 . HN 1 1 539 1 1 1 1 36 LEU HB2 . 36 . HB2 1 1 539 1 2 1 1 36 LEU QD . 36 . HD* 1 1 540 1 1 1 1 36 LEU HB2 . 36 . HB2 1 1 540 1 2 1 1 37 CYS H . 37 . HN 1 1 541 1 1 1 1 36 LEU HB3 . 36 . HB3 1 1 541 1 2 1 1 36 LEU QD . 36 . HD* 1 1 542 1 1 1 1 36 LEU HB3 . 36 . HB3 1 1 542 1 2 1 1 37 CYS H . 37 . HN 1 1 543 1 1 1 1 36 LEU QD . 36 . HD* 1 1 543 1 2 1 1 37 CYS H . 37 . HN 1 1 544 1 1 1 1 36 LEU HG . 36 . HG 1 1 544 1 2 1 1 37 CYS H . 37 . HN 1 1 545 1 1 1 1 37 CYS H . 37 . HN 1 1 545 1 2 1 1 37 CYS HA . 37 . HA 1 1 546 1 1 1 1 37 CYS H . 37 . HN 1 1 546 1 2 1 1 37 CYS QB . 37 . HB* 1 1 547 1 1 1 1 37 CYS HA . 37 . HA 1 1 547 1 2 1 1 37 CYS QB . 37 . HB* 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.15 2.36 3.93 1 1 2 1 . . . . . 2.44 1.83 3.05 1 1 3 1 . . . . . 3.49 2.62 4.36 1 1 4 1 . . . . . 5.03 1.8 6.29 1 1 5 1 . . . . . 5.46 1.8 6.82 1 1 6 1 . . . . . 5.62 1.8 7.02 1 1 7 1 . . . . . 5.49 1.8 6.86 1 1 8 1 . . . . . 7.47 1.8 9.34 1 1 9 1 . . . . . 3.1 3.0 3.1 1 1 10 1 . . . . . 2.75 1.8 3.44 1 1 11 1 . . . . . 6.02 4.52 7.53 1 1 12 1 . . . . . 3.45 2.59 4.31 1 1 13 1 . . . . . 4.16 1.8 5.2 1 1 14 1 . . . . . 4.19 1.8 5.24 1 1 15 1 . . . . . 3.1 3.0 3.1 1 1 16 1 . . . . . 2.1 2.0 2.1 1 1 17 1 . . . . . 3.02 2.27 3.78 1 1 18 1 . . . . . 3.45 1.8 4.31 1 1 19 1 . . . . . 4.54 1.8 5.67 1 1 20 1 . . . . . 3.03 1.8 3.79 1 1 21 1 . . . . . 4.99 3.74 6.24 1 1 22 1 . . . . . 4.61 1.8 5.76 1 1 23 1 . . . . . 4.42 3.31 5.52 1 1 24 1 . . . . . 2.37 1.8 2.96 1 1 25 1 . . . . . 3.21 1.8 4.01 1 1 26 1 . . . . . 2.43 1.82 3.03 1 1 27 1 . . . . . 3.75 2.81 4.69 1 1 28 1 . . . . . 3.21 1.8 4.02 1 1 29 1 . . . . . 3.97 1.8 4.96 1 1 30 1 . . . . . 2.71 1.8 3.39 1 1 31 1 . . . . . 4.85 1.8 6.06 1 1 32 1 . . . . . 4.77 1.8 5.96 1 1 33 1 . . . . . 4.39 1.8 5.48 1 1 34 1 . . . . . 5.22 1.8 6.52 1 1 35 1 . . . . . 3.86 1.8 4.82 1 1 36 1 . . . . . 3.63 1.8 4.54 1 1 37 1 . . . . . 4.2 1.8 5.25 1 1 38 1 . . . . . 3.98 2.99 4.98 1 1 39 1 . . . . . 3.72 1.8 4.65 1 1 40 1 . . . . . 4.46 1.8 5.58 1 1 41 1 . . . . . 3.85 1.8 4.82 1 1 42 1 . . . . . 4.36 1.8 5.45 1 1 43 1 . . . . . 2.71 1.8 3.39 1 1 44 1 . . . . . 4.04 3.03 5.05 1 1 45 1 . . . . . 3.3 1.8 4.13 1 1 46 1 . . . . . 3.33 2.5 4.17 1 1 47 1 . . . . . 4.7 1.8 5.88 1 1 48 1 . . . . . 3.28 1.8 4.1 1 1 49 1 . . . . . 3.28 1.8 4.1 1 1 50 1 . . . . . 5.02 1.8 6.27 1 1 51 1 . . . . . 3.87 2.9 4.83 1 1 52 1 . . . . . 2.69 2.02 3.36 1 1 53 1 . . . . . 3.11 2.33 3.88 1 1 54 1 . . . . . 2.44 1.83 3.05 1 1 55 1 . . . . . 4.59 1.8 5.73 1 1 56 1 . . . . . 3.57 1.8 4.47 1 1 57 1 . . . . . 3.88 2.91 4.85 1 1 58 1 . . . . . 2.86 2.15 3.58 1 1 59 1 . . . . . 2.73 2.05 3.41 1 1 60 1 . . . . . 3.69 2.77 4.62 1 1 61 1 . . . . . 2.77 2.07 3.46 1 1 62 1 . . . . . 4.11 3.09 5.14 1 1 63 1 . . . . . 5.02 3.77 6.28 1 1 64 1 . . . . . 3.0 2.25 3.75 1 1 65 1 . . . . . 3.37 2.52 4.21 1 1 66 1 . . . . . 2.67 2.0 3.33 1 1 67 1 . . . . . 3.49 1.8 4.36 1 1 68 1 . . . . . 3.97 1.8 4.97 1 1 69 1 . . . . . 3.18 2.39 3.98 1 1 70 1 . . . . . 5.07 3.81 6.34 1 1 71 1 . . . . . 3.0 2.25 3.75 1 1 72 1 . . . . . 3.82 1.8 4.78 1 1 73 1 . . . . . 4.14 1.8 5.17 1 1 74 1 . . . . . 5.28 3.96 6.61 1 1 75 1 . . . . . 4.98 1.8 6.22 1 1 76 1 . . . . . 4.77 1.8 5.96 1 1 77 1 . . . . . 3.18 2.39 3.98 1 1 78 1 . . . . . 2.6 1.95 3.24 1 1 79 1 . . . . . 2.79 2.09 3.49 1 1 80 1 . . . . . 3.72 1.8 4.65 1 1 81 1 . . . . . 4.7 3.53 5.88 1 1 82 1 . . . . . 3.53 1.8 4.41 1 1 83 1 . . . . . 2.81 2.11 3.51 1 1 84 1 . . . . . 2.63 1.97 3.29 1 1 85 1 . . . . . 2.54 1.8 3.18 1 1 86 1 . . . . . 3.81 1.8 4.76 1 1 87 1 . . . . . 2.56 1.92 3.2 1 1 88 1 . . . . . 3.98 1.8 4.97 1 1 89 1 . . . . . 4.77 1.8 5.96 1 1 90 1 . . . . . 2.81 1.8 3.51 1 1 91 1 . . . . . 2.74 2.05 3.42 1 1 92 1 . . . . . 3.47 1.8 4.34 1 1 93 1 . . . . . 2.78 1.8 3.47 1 1 94 1 . . . . . 2.58 1.93 3.22 1 1 95 1 . . . . . 3.45 1.8 4.32 1 1 96 1 . . . . . 3.53 1.8 4.42 1 1 97 1 . . . . . 4.09 1.8 5.11 1 1 98 1 . . . . . 6.54 1.8 8.18 1 1 99 1 . . . . . 5.4 1.8 6.75 1 1 100 1 . . . . . 5.21 1.8 6.51 1 1 101 1 . . . . . 4.23 1.8 5.28 1 1 102 1 . . . . . 3.84 1.8 4.8 1 1 103 1 . . . . . 3.96 1.8 4.95 1 1 104 1 . . . . . 4.93 1.8 6.16 1 1 105 1 . . . . . 3.72 1.8 4.65 1 1 106 1 . . . . . 3.17 1.8 3.97 1 1 107 1 . . . . . 5.06 1.8 6.33 1 1 108 1 . . . . . 3.52 1.8 4.4 1 1 109 1 . . . . . 4.72 1.8 5.9 1 1 110 1 . . . . . 3.36 1.8 4.2 1 1 111 1 . . . . . 3.36 1.8 4.2 1 1 112 1 . . . . . 4.06 3.05 5.08 1 1 113 1 . . . . . 3.09 1.8 3.87 1 1 114 1 . . . . . 2.89 2.17 3.61 1 1 115 1 . . . . . 2.95 1.8 3.68 1 1 116 1 . . . . . 4.23 3.18 5.29 1 1 117 1 . . . . . 2.56 1.8 3.2 1 1 118 1 . . . . . 2.82 1.8 3.52 1 1 119 1 . . . . . 3.19 1.8 3.98 1 1 120 1 . . . . . 2.31 1.73 2.88 1 1 121 1 . . . . . 4.21 3.16 5.26 1 1 122 1 . . . . . 3.48 1.8 4.35 1 1 123 1 . . . . . 3.17 1.8 3.97 1 1 124 1 . . . . . 2.71 2.03 3.39 1 1 125 1 . . . . . 2.54 1.8 3.18 1 1 126 1 . . . . . 3.31 1.8 4.13 1 1 127 1 . . . . . 3.12 2.34 3.9 1 1 128 1 . . . . . 4.78 1.8 5.97 1 1 129 1 . . . . . 4.1 3.07 5.12 1 1 130 1 . . . . . 2.66 1.8 3.33 1 1 131 1 . . . . . 3.07 1.8 3.83 1 1 132 1 . . . . . 3.23 2.42 4.04 1 1 133 1 . . . . . 3.18 2.39 3.98 1 1 134 1 . . . . . 2.73 1.8 3.41 1 1 135 1 . . . . . 3.81 2.86 4.77 1 1 136 1 . . . . . 2.88 1.8 3.6 1 1 137 1 . . . . . 4.17 1.8 5.21 1 1 138 1 . . . . . 2.74 2.05 3.42 1 1 139 1 . . . . . 2.87 2.16 3.59 1 1 140 1 . . . . . 3.23 1.8 4.04 1 1 141 1 . . . . . 2.81 2.11 3.51 1 1 142 1 . . . . . 4.01 3.01 5.01 1 1 143 1 . . . . . 2.53 1.9 3.16 1 1 144 1 . . . . . 3.17 1.8 3.96 1 1 145 1 . . . . . 3.26 2.44 4.07 1 1 146 1 . . . . . 3.64 2.73 4.55 1 1 147 1 . . . . . 3.06 2.29 3.82 1 1 148 1 . . . . . 4.99 1.8 6.24 1 1 149 1 . . . . . 4.42 1.8 5.53 1 1 150 1 . . . . . 2.73 2.05 3.41 1 1 151 1 . . . . . 2.73 1.8 3.41 1 1 152 1 . . . . . 2.56 1.92 3.2 1 1 153 1 . . . . . 4.42 1.8 5.52 1 1 154 1 . . . . . 3.9 2.92 4.87 1 1 155 1 . . . . . 3.61 2.71 4.51 1 1 156 1 . . . . . 4.78 3.59 5.98 1 1 157 1 . . . . . 3.47 2.6 4.34 1 1 158 1 . . . . . 2.79 1.8 3.49 1 1 159 1 . . . . . 3.79 2.84 4.74 1 1 160 1 . . . . . 3.2 1.8 4.0 1 1 161 1 . . . . . 4.72 1.8 5.9 1 1 162 1 . . . . . 3.1 3.0 3.1 1 1 163 1 . . . . . 2.78 1.8 3.48 1 1 164 1 . . . . . 2.88 2.16 3.61 1 1 165 1 . . . . . 3.7 2.78 4.63 1 1 166 1 . . . . . 4.89 1.8 6.11 1 1 167 1 . . . . . 4.03 1.8 5.04 1 1 168 1 . . . . . 3.16 1.8 3.95 1 1 169 1 . . . . . 5.17 1.8 6.46 1 1 170 1 . . . . . 4.37 1.8 5.46 1 1 171 1 . . . . . 4.13 1.8 5.16 1 1 172 1 . . . . . 3.75 1.8 4.69 1 1 173 1 . . . . . 2.65 1.8 3.31 1 1 174 1 . . . . . 3.45 1.8 4.32 1 1 175 1 . . . . . 3.1 3.0 3.1 1 1 176 1 . . . . . 2.1 2.0 2.1 1 1 177 1 . . . . . 2.67 2.01 3.34 1 1 178 1 . . . . . 2.52 1.8 3.15 1 1 179 1 . . . . . 4.15 1.8 5.19 1 1 180 1 . . . . . 3.39 1.8 4.23 1 1 181 1 . . . . . 2.82 2.11 3.52 1 1 182 1 . . . . . 4.26 1.8 5.33 1 1 183 1 . . . . . 4.22 3.17 5.28 1 1 184 1 . . . . . 4.83 1.8 6.04 1 1 185 1 . . . . . 4.06 1.8 5.07 1 1 186 1 . . . . . 2.42 1.8 3.02 1 1 187 1 . . . . . 2.58 1.8 3.22 1 1 188 1 . . . . . 2.89 2.17 3.61 1 1 189 1 . . . . . 4.88 3.66 6.1 1 1 190 1 . . . . . 3.2 2.4 4.0 1 1 191 1 . . . . . 2.3 1.8 2.88 1 1 192 1 . . . . . 2.8 1.8 3.5 1 1 193 1 . . . . . 3.96 1.8 4.95 1 1 194 1 . . . . . 3.25 1.8 4.06 1 1 195 1 . . . . . 2.81 2.1 3.51 1 1 196 1 . . . . . 2.56 1.8 3.2 1 1 197 1 . . . . . 2.83 2.12 3.54 1 1 198 1 . . . . . 4.25 3.19 5.31 1 1 199 1 . . . . . 4.59 1.8 5.74 1 1 200 1 . . . . . 3.22 2.41 4.02 1 1 201 1 . . . . . 3.55 2.66 4.43 1 1 202 1 . . . . . 3.21 1.8 4.01 1 1 203 1 . . . . . 2.84 1.8 3.55 1 1 204 1 . . . . . 5.72 1.8 7.15 1 1 205 1 . . . . . 5.72 1.8 7.15 1 1 206 1 . . . . . 4.33 3.25 5.41 1 1 207 1 . . . . . 4.06 1.8 5.08 1 1 208 1 . . . . . 4.2 1.8 5.25 1 1 209 1 . . . . . 4.5 3.37 5.62 1 1 210 1 . . . . . 2.84 2.13 3.55 1 1 211 1 . . . . . 2.93 1.8 3.66 1 1 212 1 . . . . . 2.91 2.18 3.63 1 1 213 1 . . . . . 4.63 1.8 5.79 1 1 214 1 . . . . . 5.42 1.8 6.77 1 1 215 1 . . . . . 3.55 2.67 4.44 1 1 216 1 . . . . . 3.19 2.39 3.99 1 1 217 1 . . . . . 2.97 1.8 3.71 1 1 218 1 . . . . . 4.0 1.8 5.0 1 1 219 1 . . . . . 4.19 3.14 5.24 1 1 220 1 . . . . . 3.85 2.89 4.81 1 1 221 1 . . . . . 3.33 2.5 4.16 1 1 222 1 . . . . . 3.47 1.8 4.33 1 1 223 1 . . . . . 3.34 1.8 4.18 1 1 224 1 . . . . . 4.58 1.8 5.73 1 1 225 1 . . . . . 5.81 1.8 7.26 1 1 226 1 . . . . . 4.9 1.8 6.13 1 1 227 1 . . . . . 4.41 1.8 5.52 1 1 228 1 . . . . . 3.17 1.8 3.97 1 1 229 1 . . . . . 3.24 1.8 4.06 1 1 230 1 . . . . . 4.18 1.8 5.23 1 1 231 1 . . . . . 5.1 1.8 6.38 1 1 232 1 . . . . . 5.51 1.8 6.89 1 1 233 1 . . . . . 5.24 1.8 6.55 1 1 234 1 . . . . . 3.63 1.8 4.54 1 1 235 1 . . . . . 3.75 1.8 4.68 1 1 236 1 . . . . . 5.63 1.8 7.04 1 1 237 1 . . . . . 2.92 2.19 3.65 1 1 238 1 . . . . . 2.37 1.8 2.96 1 1 239 1 . . . . . 3.28 1.8 4.1 1 1 240 1 . . . . . 2.87 2.15 3.59 1 1 241 1 . . . . . 4.34 1.8 5.42 1 1 242 1 . . . . . 4.16 1.8 5.2 1 1 243 1 . . . . . 2.64 1.8 3.29 1 1 244 1 . . . . . 2.84 1.8 3.55 1 1 245 1 . . . . . 5.09 3.82 6.36 1 1 246 1 . . . . . 6.07 4.55 7.59 1 1 247 1 . . . . . 3.21 2.41 4.01 1 1 248 1 . . . . . 4.35 1.8 5.43 1 1 249 1 . . . . . 3.16 1.8 3.95 1 1 250 1 . . . . . 2.99 1.8 3.74 1 1 251 1 . . . . . 3.12 1.8 3.9 1 1 252 1 . . . . . 4.09 1.8 5.11 1 1 253 1 . . . . . 3.11 1.8 3.89 1 1 254 1 . . . . . 2.92 1.8 3.65 1 1 255 1 . . . . . 3.0 1.8 3.76 1 1 256 1 . . . . . 4.13 1.8 5.17 1 1 257 1 . . . . . 4.32 1.8 5.4 1 1 258 1 . . . . . 3.69 1.8 4.61 1 1 259 1 . . . . . 2.88 2.16 3.6 1 1 260 1 . . . . . 2.78 1.8 3.47 1 1 261 1 . . . . . 2.99 2.25 3.74 1 1 262 1 . . . . . 5.33 1.8 6.66 1 1 263 1 . . . . . 4.83 1.8 6.04 1 1 264 1 . . . . . 2.45 1.8 3.07 1 1 265 1 . . . . . 3.44 2.58 4.3 1 1 266 1 . . . . . 3.86 2.9 4.83 1 1 267 1 . . . . . 3.12 1.8 3.9 1 1 268 1 . . . . . 5.47 1.8 6.84 1 1 269 1 . . . . . 2.86 2.14 3.57 1 1 270 1 . . . . . 2.85 1.8 3.56 1 1 271 1 . . . . . 3.94 1.8 4.92 1 1 272 1 . . . . . 2.39 1.79 2.99 1 1 273 1 . . . . . 2.87 2.16 3.59 1 1 274 1 . . . . . 3.92 2.94 4.9 1 1 275 1 . . . . . 3.23 1.8 4.04 1 1 276 1 . . . . . 2.89 2.17 3.62 1 1 277 1 . . . . . 3.29 2.47 4.11 1 1 278 1 . . . . . 4.03 1.8 5.04 1 1 279 1 . . . . . 3.75 1.8 4.69 1 1 280 1 . . . . . 4.04 1.8 5.05 1 1 281 1 . . . . . 6.37 1.8 7.96 1 1 282 1 . . . . . 4.59 1.8 5.74 1 1 283 1 . . . . . 5.27 1.8 6.59 1 1 284 1 . . . . . 4.58 1.8 5.72 1 1 285 1 . . . . . 4.23 1.8 5.29 1 1 286 1 . . . . . 5.1 1.8 6.37 1 1 287 1 . . . . . 3.86 1.8 4.82 1 1 288 1 . . . . . 2.64 1.8 3.3 1 1 289 1 . . . . . 2.45 1.84 3.06 1 1 290 1 . . . . . 4.3 3.23 5.38 1 1 291 1 . . . . . 3.6 1.8 4.5 1 1 292 1 . . . . . 3.38 2.54 4.23 1 1 293 1 . . . . . 2.92 2.19 3.65 1 1 294 1 . . . . . 2.66 1.99 3.32 1 1 295 1 . . . . . 3.98 1.8 4.97 1 1 296 1 . . . . . 2.66 1.99 3.32 1 1 297 1 . . . . . 4.96 1.8 6.2 1 1 298 1 . . . . . 2.59 1.94 3.24 1 1 299 1 . . . . . 2.91 2.18 3.64 1 1 300 1 . . . . . 3.91 2.94 4.89 1 1 301 1 . . . . . 4.43 3.33 5.54 1 1 302 1 . . . . . 3.5 2.62 4.37 1 1 303 1 . . . . . 4.35 1.8 5.44 1 1 304 1 . . . . . 3.78 2.83 4.72 1 1 305 1 . . . . . 3.11 2.33 3.88 1 1 306 1 . . . . . 3.21 2.4 4.01 1 1 307 1 . . . . . 2.47 1.8 3.09 1 1 308 1 . . . . . 3.51 2.63 4.39 1 1 309 1 . . . . . 3.22 1.8 4.02 1 1 310 1 . . . . . 3.66 1.8 4.57 1 1 311 1 . . . . . 4.91 1.8 6.13 1 1 312 1 . . . . . 4.3 1.8 5.37 1 1 313 1 . . . . . 5.29 1.8 6.61 1 1 314 1 . . . . . 3.1 3.0 3.1 1 1 315 1 . . . . . 2.84 2.13 3.55 1 1 316 1 . . . . . 2.73 1.8 3.41 1 1 317 1 . . . . . 2.69 2.02 3.36 1 1 318 1 . . . . . 3.41 2.56 4.27 1 1 319 1 . . . . . 2.51 1.8 3.13 1 1 320 1 . . . . . 3.32 1.8 4.15 1 1 321 1 . . . . . 3.59 1.8 4.49 1 1 322 1 . . . . . 4.84 1.8 6.05 1 1 323 1 . . . . . 3.1 3.0 3.1 1 1 324 1 . . . . . 2.1 2.0 2.1 1 1 325 1 . . . . . 2.74 1.8 3.43 1 1 326 1 . . . . . 4.02 1.8 5.03 1 1 327 1 . . . . . 2.89 2.17 3.62 1 1 328 1 . . . . . 4.04 1.8 5.05 1 1 329 1 . . . . . 4.41 1.8 5.51 1 1 330 1 . . . . . 2.49 1.8 3.11 1 1 331 1 . . . . . 3.19 1.8 3.99 1 1 332 1 . . . . . 2.92 2.19 3.65 1 1 333 1 . . . . . 3.62 1.8 4.53 1 1 334 1 . . . . . 2.89 1.8 3.61 1 1 335 1 . . . . . 3.83 1.8 4.79 1 1 336 1 . . . . . 2.53 1.8 3.16 1 1 337 1 . . . . . 3.39 1.8 4.24 1 1 338 1 . . . . . 2.65 1.99 3.31 1 1 339 1 . . . . . 3.47 1.8 4.33 1 1 340 1 . . . . . 4.2 1.8 5.25 1 1 341 1 . . . . . 4.34 1.8 5.42 1 1 342 1 . . . . . 3.61 2.71 4.51 1 1 343 1 . . . . . 2.82 1.8 3.52 1 1 344 1 . . . . . 4.18 3.13 5.22 1 1 345 1 . . . . . 3.94 1.8 4.93 1 1 346 1 . . . . . 2.5 1.8 3.13 1 1 347 1 . . . . . 2.65 1.99 3.31 1 1 348 1 . . . . . 4.14 3.1 5.17 1 1 349 1 . . . . . 4.0 1.8 5.0 1 1 350 1 . . . . . 4.3 1.8 5.37 1 1 351 1 . . . . . 3.95 1.8 4.94 1 1 352 1 . . . . . 3.95 1.8 4.94 1 1 353 1 . . . . . 3.19 1.8 3.98 1 1 354 1 . . . . . 4.13 1.8 5.17 1 1 355 1 . . . . . 4.71 1.8 5.89 1 1 356 1 . . . . . 2.82 2.11 3.52 1 1 357 1 . . . . . 2.67 1.8 3.34 1 1 358 1 . . . . . 3.39 1.8 4.24 1 1 359 1 . . . . . 2.87 2.15 3.59 1 1 360 1 . . . . . 4.27 1.8 5.34 1 1 361 1 . . . . . 4.48 3.36 5.6 1 1 362 1 . . . . . 3.64 1.8 4.55 1 1 363 1 . . . . . 3.22 2.42 4.03 1 1 364 1 . . . . . 3.33 1.8 4.17 1 1 365 1 . . . . . 3.43 1.8 4.29 1 1 366 1 . . . . . 3.59 1.8 4.49 1 1 367 1 . . . . . 3.16 1.8 3.96 1 1 368 1 . . . . . 5.94 1.8 7.43 1 1 369 1 . . . . . 4.55 1.8 5.69 1 1 370 1 . . . . . 2.67 2.0 3.33 1 1 371 1 . . . . . 2.58 1.8 3.23 1 1 372 1 . . . . . 4.28 1.8 5.35 1 1 373 1 . . . . . 3.36 1.8 4.19 1 1 374 1 . . . . . 3.02 2.27 3.78 1 1 375 1 . . . . . 5.22 1.8 6.52 1 1 376 1 . . . . . 5.17 1.8 6.47 1 1 377 1 . . . . . 3.27 1.8 4.09 1 1 378 1 . . . . . 3.26 2.44 4.07 1 1 379 1 . . . . . 3.21 2.41 4.01 1 1 380 1 . . . . . 3.62 1.8 4.52 1 1 381 1 . . . . . 3.42 1.8 4.27 1 1 382 1 . . . . . 3.04 1.8 3.79 1 1 383 1 . . . . . 4.44 1.8 5.55 1 1 384 1 . . . . . 5.41 1.8 6.76 1 1 385 1 . . . . . 3.8 1.8 4.75 1 1 386 1 . . . . . 3.66 1.8 4.58 1 1 387 1 . . . . . 4.41 1.8 5.51 1 1 388 1 . . . . . 3.42 1.8 4.28 1 1 389 1 . . . . . 3.14 2.36 3.93 1 1 390 1 . . . . . 2.79 1.8 3.49 1 1 391 1 . . . . . 3.41 1.8 4.26 1 1 392 1 . . . . . 2.9 2.18 3.63 1 1 393 1 . . . . . 2.85 1.8 3.56 1 1 394 1 . . . . . 3.43 1.8 4.29 1 1 395 1 . . . . . 3.87 1.8 4.83 1 1 396 1 . . . . . 2.7 1.8 3.37 1 1 397 1 . . . . . 3.42 1.8 4.27 1 1 398 1 . . . . . 4.71 1.8 5.89 1 1 399 1 . . . . . 4.62 1.8 5.78 1 1 400 1 . . . . . 4.17 1.8 5.21 1 1 401 1 . . . . . 4.25 1.8 5.31 1 1 402 1 . . . . . 2.84 2.13 3.55 1 1 403 1 . . . . . 2.54 1.8 3.18 1 1 404 1 . . . . . 3.67 1.8 4.59 1 1 405 1 . . . . . 2.97 1.8 3.71 1 1 406 1 . . . . . 2.81 2.1 3.51 1 1 407 1 . . . . . 4.64 3.48 5.8 1 1 408 1 . . . . . 4.22 1.8 5.27 1 1 409 1 . . . . . 3.18 1.8 3.97 1 1 410 1 . . . . . 3.52 2.64 4.4 1 1 411 1 . . . . . 3.62 1.8 4.52 1 1 412 1 . . . . . 2.9 1.8 3.63 1 1 413 1 . . . . . 3.72 1.8 4.66 1 1 414 1 . . . . . 2.89 1.8 3.62 1 1 415 1 . . . . . 2.61 1.8 3.27 1 1 416 1 . . . . . 3.15 1.8 3.93 1 1 417 1 . . . . . 3.32 1.8 4.15 1 1 418 1 . . . . . 3.12 1.8 3.9 1 1 419 1 . . . . . 4.14 1.8 5.17 1 1 420 1 . . . . . 4.31 1.8 5.39 1 1 421 1 . . . . . 3.33 1.8 4.16 1 1 422 1 . . . . . 4.19 1.8 5.24 1 1 423 1 . . . . . 4.17 1.8 5.21 1 1 424 1 . . . . . 2.77 2.08 3.46 1 1 425 1 . . . . . 2.89 1.8 3.61 1 1 426 1 . . . . . 2.91 2.18 3.64 1 1 427 1 . . . . . 5.2 1.8 6.5 1 1 428 1 . . . . . 4.16 3.12 5.2 1 1 429 1 . . . . . 3.14 2.36 3.93 1 1 430 1 . . . . . 3.65 1.8 4.56 1 1 431 1 . . . . . 3.06 1.8 3.82 1 1 432 1 . . . . . 3.44 1.8 4.3 1 1 433 1 . . . . . 3.15 1.8 3.94 1 1 434 1 . . . . . 2.46 1.84 3.07 1 1 435 1 . . . . . 4.13 3.1 5.16 1 1 436 1 . . . . . 2.89 1.8 3.61 1 1 437 1 . . . . . 4.8 1.8 6.0 1 1 438 1 . . . . . 4.69 1.8 5.86 1 1 439 1 . . . . . 3.21 2.41 4.02 1 1 440 1 . . . . . 2.5 1.8 3.12 1 1 441 1 . . . . . 2.97 2.23 3.71 1 1 442 1 . . . . . 2.66 1.8 3.32 1 1 443 1 . . . . . 3.02 2.26 3.77 1 1 444 1 . . . . . 4.65 1.8 5.81 1 1 445 1 . . . . . 3.99 2.99 4.99 1 1 446 1 . . . . . 4.21 3.15 5.26 1 1 447 1 . . . . . 3.49 2.62 4.37 1 1 448 1 . . . . . 4.7 1.8 5.87 1 1 449 1 . . . . . 4.41 3.31 5.51 1 1 450 1 . . . . . 3.84 1.8 4.8 1 1 451 1 . . . . . 3.74 1.8 4.67 1 1 452 1 . . . . . 2.7 1.8 3.37 1 1 453 1 . . . . . 3.92 1.8 4.9 1 1 454 1 . . . . . 4.68 1.8 5.85 1 1 455 1 . . . . . 2.87 2.15 3.58 1 1 456 1 . . . . . 2.97 1.8 3.71 1 1 457 1 . . . . . 3.04 2.28 3.8 1 1 458 1 . . . . . 3.94 1.8 4.93 1 1 459 1 . . . . . 4.76 3.57 5.95 1 1 460 1 . . . . . 4.81 1.8 6.01 1 1 461 1 . . . . . 3.3 2.48 4.13 1 1 462 1 . . . . . 3.05 2.29 3.82 1 1 463 1 . . . . . 2.79 2.09 3.48 1 1 464 1 . . . . . 3.25 2.43 4.06 1 1 465 1 . . . . . 2.67 2.0 3.34 1 1 466 1 . . . . . 2.75 2.06 3.43 1 1 467 1 . . . . . 3.6 1.8 4.51 1 1 468 1 . . . . . 3.68 1.8 4.6 1 1 469 1 . . . . . 2.92 2.19 3.65 1 1 470 1 . . . . . 2.55 1.8 3.18 1 1 471 1 . . . . . 2.71 2.04 3.39 1 1 472 1 . . . . . 3.97 2.97 4.96 1 1 473 1 . . . . . 3.82 2.86 4.77 1 1 474 1 . . . . . 2.36 1.8 2.95 1 1 475 1 . . . . . 3.56 2.67 4.45 1 1 476 1 . . . . . 3.39 1.8 4.24 1 1 477 1 . . . . . 2.74 1.8 3.42 1 1 478 1 . . . . . 5.59 1.8 6.98 1 1 479 1 . . . . . 4.87 1.8 6.09 1 1 480 1 . . . . . 2.92 2.19 3.65 1 1 481 1 . . . . . 2.71 2.04 3.39 1 1 482 1 . . . . . 3.8 1.8 4.75 1 1 483 1 . . . . . 2.97 2.23 3.71 1 1 484 1 . . . . . 4.05 3.04 5.07 1 1 485 1 . . . . . 2.6 1.95 3.25 1 1 486 1 . . . . . 2.85 1.8 3.56 1 1 487 1 . . . . . 2.98 2.24 3.73 1 1 488 1 . . . . . 3.34 2.5 4.17 1 1 489 1 . . . . . 3.04 2.28 3.8 1 1 490 1 . . . . . 4.07 1.8 5.08 1 1 491 1 . . . . . 4.38 1.8 5.47 1 1 492 1 . . . . . 5.18 1.8 6.47 1 1 493 1 . . . . . 3.08 2.31 3.84 1 1 494 1 . . . . . 2.74 2.06 3.43 1 1 495 1 . . . . . 2.53 1.9 3.16 1 1 496 1 . . . . . 2.87 2.15 3.59 1 1 497 1 . . . . . 3.68 2.76 4.59 1 1 498 1 . . . . . 4.68 1.8 5.85 1 1 499 1 . . . . . 3.56 1.8 4.45 1 1 500 1 . . . . . 5.13 1.8 6.42 1 1 501 1 . . . . . 3.75 2.81 4.68 1 1 502 1 . . . . . 2.63 1.97 3.28 1 1 503 1 . . . . . 2.81 2.11 3.51 1 1 504 1 . . . . . 3.57 2.68 4.46 1 1 505 1 . . . . . 3.96 2.97 4.95 1 1 506 1 . . . . . 3.67 1.8 4.58 1 1 507 1 . . . . . 2.68 2.01 3.35 1 1 508 1 . . . . . 3.6 2.7 4.5 1 1 509 1 . . . . . 3.62 2.71 4.52 1 1 510 1 . . . . . 3.61 1.8 4.52 1 1 511 1 . . . . . 2.62 1.96 3.27 1 1 512 1 . . . . . 2.26 1.69 2.82 1 1 513 1 . . . . . 3.3 1.8 4.13 1 1 514 1 . . . . . 2.97 1.8 3.71 1 1 515 1 . . . . . 2.83 2.12 3.53 1 1 516 1 . . . . . 7.0 1.8 8.75 1 1 517 1 . . . . . 4.77 3.58 5.97 1 1 518 1 . . . . . 6.53 1.8 8.17 1 1 519 1 . . . . . 3.8 2.85 4.75 1 1 520 1 . . . . . 2.61 1.8 3.27 1 1 521 1 . . . . . 2.62 1.8 3.28 1 1 522 1 . . . . . 2.67 2.01 3.34 1 1 523 1 . . . . . 3.05 2.28 3.81 1 1 524 1 . . . . . 3.97 1.8 4.96 1 1 525 1 . . . . . 4.62 1.8 5.77 1 1 526 1 . . . . . 4.14 1.8 5.18 1 1 527 1 . . . . . 4.02 1.8 5.03 1 1 528 1 . . . . . 3.06 2.29 3.82 1 1 529 1 . . . . . 2.6 1.95 3.25 1 1 530 1 . . . . . 3.03 2.27 3.78 1 1 531 1 . . . . . 4.03 1.8 5.04 1 1 532 1 . . . . . 2.65 1.99 3.32 1 1 533 1 . . . . . 2.56 1.92 3.19 1 1 534 1 . . . . . 2.3 1.73 2.88 1 1 535 1 . . . . . 2.32 1.74 2.9 1 1 536 1 . . . . . 3.11 1.8 3.89 1 1 537 1 . . . . . 2.68 2.01 3.36 1 1 538 1 . . . . . 3.03 2.27 3.79 1 1 539 1 . . . . . 3.11 1.8 3.88 1 1 540 1 . . . . . 3.91 2.93 4.89 1 1 541 1 . . . . . 3.02 1.8 3.78 1 1 542 1 . . . . . 3.89 2.92 4.86 1 1 543 1 . . . . . 5.2 1.8 6.5 1 1 544 1 . . . . . 3.51 2.63 4.39 1 1 545 1 . . . . . 3.16 2.37 3.95 1 1 546 1 . . . . . 3.19 1.8 3.98 1 1 547 1 . . . . . 2.6 1.8 3.25 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 VAL C C -12.346 0.661 3.176 1.00 . A A . 1 VAL C 1 1 1 2 1 1 1 VAL CA C -13.670 0.830 3.924 1.00 . A A . 1 VAL CA 1 1 1 3 1 1 1 VAL CB C -13.730 -0.157 5.090 1.00 . A A . 1 VAL CB 1 1 1 4 1 1 1 VAL CG1 C -13.434 -1.569 4.581 1.00 . A A . 1 VAL CG1 1 1 1 5 1 1 1 VAL CG2 C -12.686 0.232 6.138 1.00 . A A . 1 VAL CG2 1 1 1 6 1 1 1 VAL H1 H -14.578 -0.260 2.401 1.00 . A A . 1 VAL H1 1 1 1 7 1 1 1 VAL H2 H -15.668 0.378 3.539 1.00 . A A . 1 VAL H2 1 1 1 8 1 1 1 VAL H3 H -14.958 1.397 2.387 1.00 . A A . 1 VAL H3 1 1 1 9 1 1 1 VAL HA H -13.744 1.840 4.303 1.00 . A A . 1 VAL HA 1 1 1 10 1 1 1 VAL HB H -14.717 -0.134 5.529 1.00 . A A . 1 VAL HB 1 1 1 11 1 1 1 VAL HG11 H -14.037 -1.770 3.707 1.00 . A A . 1 VAL HG11 1 1 1 12 1 1 1 VAL HG12 H -12.388 -1.646 4.322 1.00 . A A . 1 VAL HG12 1 1 1 13 1 1 1 VAL HG13 H -13.668 -2.287 5.353 1.00 . A A . 1 VAL HG13 1 1 1 14 1 1 1 VAL HG21 H -12.215 1.159 5.850 1.00 . A A . 1 VAL HG21 1 1 1 15 1 1 1 VAL HG22 H -13.167 0.355 7.097 1.00 . A A . 1 VAL HG22 1 1 1 16 1 1 1 VAL HG23 H -11.939 -0.545 6.207 1.00 . A A . 1 VAL HG23 1 1 1 17 1 1 1 VAL N N -14.803 0.566 2.992 1.00 . A A . 1 VAL N 1 1 1 18 1 1 1 VAL O O -12.160 -0.280 2.430 1.00 . A A . 1 VAL O 1 1 1 19 1 1 2 CYS C C -9.241 0.409 3.370 1.00 . A A . 2 CYS C 1 1 1 20 1 1 2 CYS CA C -10.115 1.452 2.668 1.00 . A A . 2 CYS CA 1 1 1 21 1 1 2 CYS CB C -9.408 2.809 2.686 1.00 . A A . 2 CYS CB 1 1 1 22 1 1 2 CYS H H -11.594 2.316 3.975 1.00 . A A . 2 CYS H 1 1 1 23 1 1 2 CYS HA H -10.288 1.151 1.645 1.00 . A A . 2 CYS HA 1 1 1 24 1 1 2 CYS HB2 H -8.425 2.708 2.250 1.00 . A A . 2 CYS HB2 1 1 1 25 1 1 2 CYS HB3 H -9.983 3.522 2.114 1.00 . A A . 2 CYS HB3 1 1 1 26 1 1 2 CYS N N -11.424 1.564 3.370 1.00 . A A . 2 CYS N 1 1 1 27 1 1 2 CYS O O -9.627 -0.147 4.379 1.00 . A A . 2 CYS O 1 1 1 28 1 1 2 CYS SG S -9.254 3.386 4.394 1.00 . A A . 2 CYS SG 1 1 1 29 1 1 3 ARG C C -6.212 -1.360 2.350 1.00 . A A . 3 ARG C 1 1 1 30 1 1 3 ARG CA C -7.150 -0.851 3.445 1.00 . A A . 3 ARG CA 1 1 1 31 1 1 3 ARG CB C -7.935 -2.043 4.001 1.00 . A A . 3 ARG CB 1 1 1 32 1 1 3 ARG CD C -8.872 -3.912 2.621 1.00 . A A . 3 ARG CD 1 1 1 33 1 1 3 ARG CG C -9.032 -2.441 3.011 1.00 . A A . 3 ARG CG 1 1 1 34 1 1 3 ARG CZ C -8.502 -6.022 3.759 1.00 . A A . 3 ARG CZ 1 1 1 35 1 1 3 ARG H H -7.799 0.618 2.025 1.00 . A A . 3 ARG H 1 1 1 36 1 1 3 ARG HA H -6.575 -0.388 4.233 1.00 . A A . 3 ARG HA 1 1 1 37 1 1 3 ARG HB2 H -7.261 -2.872 4.153 1.00 . A A . 3 ARG HB2 1 1 1 38 1 1 3 ARG HB3 H -8.387 -1.767 4.941 1.00 . A A . 3 ARG HB3 1 1 1 39 1 1 3 ARG HD2 H -9.762 -4.252 2.114 1.00 . A A . 3 ARG HD2 1 1 1 40 1 1 3 ARG HD3 H -8.022 -4.022 1.964 1.00 . A A . 3 ARG HD3 1 1 1 41 1 1 3 ARG HE H -8.630 -4.294 4.727 1.00 . A A . 3 ARG HE 1 1 1 42 1 1 3 ARG HG2 H -9.998 -2.291 3.470 1.00 . A A . 3 ARG HG2 1 1 1 43 1 1 3 ARG HG3 H -8.956 -1.829 2.125 1.00 . A A . 3 ARG HG3 1 1 1 44 1 1 3 ARG HH11 H -8.295 -6.017 1.767 1.00 . A A . 3 ARG HH11 1 1 1 45 1 1 3 ARG HH12 H -8.201 -7.570 2.526 1.00 . A A . 3 ARG HH12 1 1 1 46 1 1 3 ARG HH21 H -8.672 -6.332 5.730 1.00 . A A . 3 ARG HH21 1 1 1 47 1 1 3 ARG HH22 H -8.414 -7.749 4.768 1.00 . A A . 3 ARG HH22 1 1 1 48 1 1 3 ARG N N -8.075 0.148 2.839 1.00 . A A . 3 ARG N 1 1 1 49 1 1 3 ARG NE N -8.656 -4.729 3.849 1.00 . A A . 3 ARG NE 1 1 1 50 1 1 3 ARG NH1 N -8.319 -6.579 2.594 1.00 . A A . 3 ARG NH1 1 1 1 51 1 1 3 ARG NH2 N -8.532 -6.757 4.836 1.00 . A A . 3 ARG NH2 1 1 1 52 1 1 3 ARG O O -6.351 -1.004 1.197 1.00 . A A . 3 ARG O 1 1 1 53 1 1 4 ASP C C -5.177 -3.510 0.643 1.00 . A A . 4 ASP C 1 1 1 54 1 1 4 ASP CA C -4.343 -2.689 1.626 1.00 . A A . 4 ASP CA 1 1 1 55 1 1 4 ASP CB C -3.251 -3.574 2.233 1.00 . A A . 4 ASP CB 1 1 1 56 1 1 4 ASP CG C -3.899 -4.710 3.028 1.00 . A A . 4 ASP CG 1 1 1 57 1 1 4 ASP H H -5.151 -2.472 3.617 1.00 . A A . 4 ASP H 1 1 1 58 1 1 4 ASP HA H -3.905 -1.847 1.111 1.00 . A A . 4 ASP HA 1 1 1 59 1 1 4 ASP HB2 H -2.646 -3.990 1.440 1.00 . A A . 4 ASP HB2 1 1 1 60 1 1 4 ASP HB3 H -2.627 -2.992 2.894 1.00 . A A . 4 ASP HB3 1 1 1 61 1 1 4 ASP N N -5.260 -2.187 2.685 1.00 . A A . 4 ASP N 1 1 1 62 1 1 4 ASP O O -6.387 -3.530 0.732 1.00 . A A . 4 ASP O 1 1 1 63 1 1 4 ASP OD1 O -4.518 -5.560 2.410 1.00 . A A . 4 ASP OD1 1 1 1 64 1 1 4 ASP OD2 O -3.766 -4.709 4.240 1.00 . A A . 4 ASP OD2 1 1 1 65 1 1 5 TRP C C -4.592 -6.158 -1.752 1.00 . A A . 5 TRP C 1 1 1 66 1 1 5 TRP CA C -5.415 -4.980 -1.229 1.00 . A A . 5 TRP CA 1 1 1 67 1 1 5 TRP CB C -5.897 -4.075 -2.364 1.00 . A A . 5 TRP CB 1 1 1 68 1 1 5 TRP CD1 C -7.632 -2.333 -1.745 1.00 . A A . 5 TRP CD1 1 1 1 69 1 1 5 TRP CD2 C -8.481 -4.412 -1.855 1.00 . A A . 5 TRP CD2 1 1 1 70 1 1 5 TRP CE2 C -9.553 -3.552 -1.503 1.00 . A A . 5 TRP CE2 1 1 1 71 1 1 5 TRP CE3 C -8.748 -5.783 -1.990 1.00 . A A . 5 TRP CE3 1 1 1 72 1 1 5 TRP CG C -7.272 -3.611 -2.004 1.00 . A A . 5 TRP CG 1 1 1 73 1 1 5 TRP CH2 C -11.088 -5.414 -1.434 1.00 . A A . 5 TRP CH2 1 1 1 74 1 1 5 TRP CZ2 C -10.845 -4.043 -1.294 1.00 . A A . 5 TRP CZ2 1 1 1 75 1 1 5 TRP CZ3 C -10.041 -6.278 -1.780 1.00 . A A . 5 TRP CZ3 1 1 1 76 1 1 5 TRP H H -3.591 -4.188 -0.379 1.00 . A A . 5 TRP H 1 1 1 77 1 1 5 TRP HA H -6.274 -5.362 -0.681 1.00 . A A . 5 TRP HA 1 1 1 78 1 1 5 TRP HB2 H -5.233 -3.229 -2.465 1.00 . A A . 5 TRP HB2 1 1 1 79 1 1 5 TRP HB3 H -5.937 -4.629 -3.290 1.00 . A A . 5 TRP HB3 1 1 1 80 1 1 5 TRP HD1 H -6.974 -1.480 -1.766 1.00 . A A . 5 TRP HD1 1 1 1 81 1 1 5 TRP HE1 H -9.489 -1.489 -1.227 1.00 . A A . 5 TRP HE1 1 1 1 82 1 1 5 TRP HE3 H -7.947 -6.457 -2.256 1.00 . A A . 5 TRP HE3 1 1 1 83 1 1 5 TRP HH2 H -12.082 -5.806 -1.274 1.00 . A A . 5 TRP HH2 1 1 1 84 1 1 5 TRP HZ2 H -11.648 -3.372 -1.027 1.00 . A A . 5 TRP HZ2 1 1 1 85 1 1 5 TRP HZ3 H -10.234 -7.335 -1.886 1.00 . A A . 5 TRP HZ3 1 1 1 86 1 1 5 TRP N N -4.572 -4.190 -0.292 1.00 . A A . 5 TRP N 1 1 1 87 1 1 5 TRP NE1 N -8.982 -2.296 -1.450 1.00 . A A . 5 TRP NE1 1 1 1 88 1 1 5 TRP O O -5.128 -7.225 -1.982 1.00 . A A . 5 TRP O 1 1 1 89 1 1 6 PHE C C -2.186 -7.920 -1.152 1.00 . A A . 6 PHE C 1 1 1 90 1 1 6 PHE CA C -2.527 -7.172 -2.441 1.00 . A A . 6 PHE CA 1 1 1 91 1 1 6 PHE CB C -1.198 -6.657 -2.975 1.00 . A A . 6 PHE CB 1 1 1 92 1 1 6 PHE CD1 C -2.627 -5.580 -4.738 1.00 . A A . 6 PHE CD1 1 1 1 93 1 1 6 PHE CD2 C -0.366 -4.784 -4.366 1.00 . A A . 6 PHE CD2 1 1 1 94 1 1 6 PHE CE1 C -2.793 -4.630 -5.739 1.00 . A A . 6 PHE CE1 1 1 1 95 1 1 6 PHE CE2 C -0.525 -3.835 -5.364 1.00 . A A . 6 PHE CE2 1 1 1 96 1 1 6 PHE CG C -1.413 -5.649 -4.059 1.00 . A A . 6 PHE CG 1 1 1 97 1 1 6 PHE CZ C -1.741 -3.762 -6.048 1.00 . A A . 6 PHE CZ 1 1 1 98 1 1 6 PHE H H -2.820 -5.176 -1.768 1.00 . A A . 6 PHE H 1 1 1 99 1 1 6 PHE HA H -3.075 -7.727 -3.186 1.00 . A A . 6 PHE HA 1 1 1 100 1 1 6 PHE HB2 H -0.676 -6.167 -2.171 1.00 . A A . 6 PHE HB2 1 1 1 101 1 1 6 PHE HB3 H -0.611 -7.474 -3.355 1.00 . A A . 6 PHE HB3 1 1 1 102 1 1 6 PHE HD1 H -3.435 -6.248 -4.500 1.00 . A A . 6 PHE HD1 1 1 1 103 1 1 6 PHE HD2 H 0.569 -4.841 -3.840 1.00 . A A . 6 PHE HD2 1 1 1 104 1 1 6 PHE HE1 H -3.736 -4.587 -6.257 1.00 . A A . 6 PHE HE1 1 1 1 105 1 1 6 PHE HE2 H 0.298 -3.177 -5.585 1.00 . A A . 6 PHE HE2 1 1 1 106 1 1 6 PHE HZ H -1.865 -3.030 -6.818 1.00 . A A . 6 PHE HZ 1 1 1 107 1 1 6 PHE N N -3.304 -6.013 -1.942 1.00 . A A . 6 PHE N 1 1 1 108 1 1 6 PHE O O -2.999 -7.986 -0.251 1.00 . A A . 6 PHE O 1 1 1 109 1 1 7 LYS C C -0.331 -8.032 1.188 1.00 . A A . 7 LYS C 1 1 1 110 1 1 7 LYS CA C -0.716 -9.177 0.251 1.00 . A A . 7 LYS CA 1 1 1 111 1 1 7 LYS CB C 0.472 -10.125 0.063 1.00 . A A . 7 LYS CB 1 1 1 112 1 1 7 LYS CD C 0.867 -11.073 2.342 1.00 . A A . 7 LYS CD 1 1 1 113 1 1 7 LYS CE C 1.033 -12.389 3.106 1.00 . A A . 7 LYS CE 1 1 1 114 1 1 7 LYS CG C 0.289 -11.355 0.954 1.00 . A A . 7 LYS CG 1 1 1 115 1 1 7 LYS H H -0.337 -8.427 -1.728 1.00 . A A . 7 LYS H 1 1 1 116 1 1 7 LYS HA H -1.597 -9.687 0.617 1.00 . A A . 7 LYS HA 1 1 1 117 1 1 7 LYS HB2 H 0.529 -10.430 -0.971 1.00 . A A . 7 LYS HB2 1 1 1 118 1 1 7 LYS HB3 H 1.385 -9.619 0.341 1.00 . A A . 7 LYS HB3 1 1 1 119 1 1 7 LYS HD2 H 1.828 -10.590 2.239 1.00 . A A . 7 LYS HD2 1 1 1 120 1 1 7 LYS HD3 H 0.195 -10.429 2.889 1.00 . A A . 7 LYS HD3 1 1 1 121 1 1 7 LYS HE2 H 0.964 -13.217 2.416 1.00 . A A . 7 LYS HE2 1 1 1 122 1 1 7 LYS HE3 H 1.999 -12.405 3.589 1.00 . A A . 7 LYS HE3 1 1 1 123 1 1 7 LYS HG2 H -0.763 -11.583 1.038 1.00 . A A . 7 LYS HG2 1 1 1 124 1 1 7 LYS HG3 H 0.807 -12.197 0.518 1.00 . A A . 7 LYS HG3 1 1 1 125 1 1 7 LYS HZ1 H -0.406 -11.558 4.357 1.00 . A A . 7 LYS HZ1 1 1 1 126 1 1 7 LYS HZ2 H -0.809 -13.100 3.767 1.00 . A A . 7 LYS HZ2 1 1 1 127 1 1 7 LYS HZ3 H 0.349 -12.943 4.993 1.00 . A A . 7 LYS HZ3 1 1 1 128 1 1 7 LYS N N -1.014 -8.474 -1.021 1.00 . A A . 7 LYS N 1 1 1 129 1 1 7 LYS NZ N -0.039 -12.506 4.133 1.00 . A A . 7 LYS NZ 1 1 1 130 1 1 7 LYS O O 0.269 -7.069 0.755 1.00 . A A . 7 LYS O 1 1 1 131 1 1 8 GLU C C 1.223 -6.611 3.166 1.00 . A A . 8 GLU C 1 1 1 132 1 1 8 GLU CA C -0.259 -6.946 3.336 1.00 . A A . 8 GLU CA 1 1 1 133 1 1 8 GLU CB C -0.546 -7.312 4.794 1.00 . A A . 8 GLU CB 1 1 1 134 1 1 8 GLU CD C -2.353 -7.811 6.449 1.00 . A A . 8 GLU CD 1 1 1 135 1 1 8 GLU CG C -2.041 -7.589 4.968 1.00 . A A . 8 GLU CG 1 1 1 136 1 1 8 GLU H H -1.135 -8.853 2.813 1.00 . A A . 8 GLU H 1 1 1 137 1 1 8 GLU HA H -0.829 -6.066 3.073 1.00 . A A . 8 GLU HA 1 1 1 138 1 1 8 GLU HB2 H 0.019 -8.194 5.058 1.00 . A A . 8 GLU HB2 1 1 1 139 1 1 8 GLU HB3 H -0.261 -6.493 5.436 1.00 . A A . 8 GLU HB3 1 1 1 140 1 1 8 GLU HG2 H -2.608 -6.746 4.599 1.00 . A A . 8 GLU HG2 1 1 1 141 1 1 8 GLU HG3 H -2.310 -8.475 4.413 1.00 . A A . 8 GLU HG3 1 1 1 142 1 1 8 GLU N N -0.649 -8.083 2.451 1.00 . A A . 8 GLU N 1 1 1 143 1 1 8 GLU O O 1.662 -5.539 3.537 1.00 . A A . 8 GLU O 1 1 1 144 1 1 8 GLU OE1 O -1.539 -7.423 7.270 1.00 . A A . 8 GLU OE1 1 1 1 145 1 1 8 GLU OE2 O -3.401 -8.366 6.736 1.00 . A A . 8 GLU OE2 1 1 1 146 1 1 9 THR C C 3.698 -6.488 1.104 1.00 . A A . 9 THR C 1 1 1 147 1 1 9 THR CA C 3.455 -7.159 2.457 1.00 . A A . 9 THR CA 1 1 1 148 1 1 9 THR CB C 4.242 -8.450 2.654 1.00 . A A . 9 THR CB 1 1 1 149 1 1 9 THR CG2 C 4.093 -8.804 4.134 1.00 . A A . 9 THR CG2 1 1 1 150 1 1 9 THR H H 1.683 -8.359 2.314 1.00 . A A . 9 THR H 1 1 1 151 1 1 9 THR HA H 3.726 -6.457 3.231 1.00 . A A . 9 THR HA 1 1 1 152 1 1 9 THR HB H 5.286 -8.294 2.440 1.00 . A A . 9 THR HB 1 1 1 153 1 1 9 THR HG1 H 4.432 -9.990 1.482 1.00 . A A . 9 THR HG1 1 1 1 154 1 1 9 THR HG21 H 3.403 -8.103 4.589 1.00 . A A . 9 THR HG21 1 1 1 155 1 1 9 THR HG22 H 3.700 -9.806 4.230 1.00 . A A . 9 THR HG22 1 1 1 156 1 1 9 THR HG23 H 5.053 -8.737 4.623 1.00 . A A . 9 THR HG23 1 1 1 157 1 1 9 THR N N 2.016 -7.489 2.618 1.00 . A A . 9 THR N 1 1 1 158 1 1 9 THR O O 4.569 -5.652 0.995 1.00 . A A . 9 THR O 1 1 1 159 1 1 9 THR OG1 O 3.703 -9.466 1.820 1.00 . A A . 9 THR OG1 1 1 1 160 1 1 10 ALA C C 3.182 -4.683 -0.934 1.00 . A A . 10 ALA C 1 1 1 161 1 1 10 ALA CA C 3.166 -6.178 -1.238 1.00 . A A . 10 ALA CA 1 1 1 162 1 1 10 ALA CB C 1.957 -6.416 -2.149 1.00 . A A . 10 ALA CB 1 1 1 163 1 1 10 ALA H H 2.251 -7.504 0.204 1.00 . A A . 10 ALA H 1 1 1 164 1 1 10 ALA HA H 4.088 -6.487 -1.703 1.00 . A A . 10 ALA HA 1 1 1 165 1 1 10 ALA HB1 H 1.060 -6.254 -1.569 1.00 . A A . 10 ALA HB1 1 1 1 166 1 1 10 ALA HB2 H 1.970 -5.717 -2.975 1.00 . A A . 10 ALA HB2 1 1 1 167 1 1 10 ALA HB3 H 1.964 -7.427 -2.528 1.00 . A A . 10 ALA HB3 1 1 1 168 1 1 10 ALA N N 2.951 -6.829 0.089 1.00 . A A . 10 ALA N 1 1 1 169 1 1 10 ALA O O 3.943 -3.895 -1.459 1.00 . A A . 10 ALA O 1 1 1 170 1 1 11 CYS C C 3.355 -2.483 1.167 1.00 . A A . 11 CYS C 1 1 1 171 1 1 11 CYS CA C 2.103 -2.953 0.419 1.00 . A A . 11 CYS CA 1 1 1 172 1 1 11 CYS CB C 0.828 -3.023 1.265 1.00 . A A . 11 CYS CB 1 1 1 173 1 1 11 CYS H H 1.712 -5.039 0.330 1.00 . A A . 11 CYS H 1 1 1 174 1 1 11 CYS HA H 1.936 -2.303 -0.426 1.00 . A A . 11 CYS HA 1 1 1 175 1 1 11 CYS HB2 H 0.971 -3.646 2.138 1.00 . A A . 11 CYS HB2 1 1 1 176 1 1 11 CYS HB3 H 0.507 -2.035 1.547 1.00 . A A . 11 CYS HB3 1 1 1 177 1 1 11 CYS N N 2.291 -4.346 -0.049 1.00 . A A . 11 CYS N 1 1 1 178 1 1 11 CYS O O 3.985 -1.527 0.762 1.00 . A A . 11 CYS O 1 1 1 179 1 1 11 CYS SG S -0.445 -3.756 0.208 1.00 . A A . 11 CYS SG 1 1 1 180 1 1 12 ARG C C 6.109 -2.499 2.049 1.00 . A A . 12 ARG C 1 1 1 181 1 1 12 ARG CA C 4.937 -2.718 3.004 1.00 . A A . 12 ARG CA 1 1 1 182 1 1 12 ARG CB C 5.261 -3.805 4.029 1.00 . A A . 12 ARG CB 1 1 1 183 1 1 12 ARG CD C 7.068 -4.352 5.661 1.00 . A A . 12 ARG CD 1 1 1 184 1 1 12 ARG CG C 6.773 -3.901 4.229 1.00 . A A . 12 ARG CG 1 1 1 185 1 1 12 ARG CZ C 7.320 -6.618 6.478 1.00 . A A . 12 ARG CZ 1 1 1 186 1 1 12 ARG H H 3.203 -3.900 2.542 1.00 . A A . 12 ARG H 1 1 1 187 1 1 12 ARG HA H 4.759 -1.786 3.515 1.00 . A A . 12 ARG HA 1 1 1 188 1 1 12 ARG HB2 H 4.787 -3.557 4.968 1.00 . A A . 12 ARG HB2 1 1 1 189 1 1 12 ARG HB3 H 4.887 -4.754 3.676 1.00 . A A . 12 ARG HB3 1 1 1 190 1 1 12 ARG HD2 H 7.731 -3.642 6.133 1.00 . A A . 12 ARG HD2 1 1 1 191 1 1 12 ARG HD3 H 6.144 -4.404 6.218 1.00 . A A . 12 ARG HD3 1 1 1 192 1 1 12 ARG HE H 8.431 -5.886 5.004 1.00 . A A . 12 ARG HE 1 1 1 193 1 1 12 ARG HG2 H 7.177 -4.615 3.528 1.00 . A A . 12 ARG HG2 1 1 1 194 1 1 12 ARG HG3 H 7.221 -2.932 4.062 1.00 . A A . 12 ARG HG3 1 1 1 195 1 1 12 ARG HH11 H 7.604 -5.485 8.103 1.00 . A A . 12 ARG HH11 1 1 1 196 1 1 12 ARG HH12 H 7.009 -7.084 8.399 1.00 . A A . 12 ARG HH12 1 1 1 197 1 1 12 ARG HH21 H 6.944 -7.967 5.047 1.00 . A A . 12 ARG HH21 1 1 1 198 1 1 12 ARG HH22 H 6.635 -8.489 6.670 1.00 . A A . 12 ARG HH22 1 1 1 199 1 1 12 ARG N N 3.725 -3.131 2.237 1.00 . A A . 12 ARG N 1 1 1 200 1 1 12 ARG NE N 7.713 -5.695 5.642 1.00 . A A . 12 ARG NE 1 1 1 201 1 1 12 ARG NH1 N 7.310 -6.377 7.760 1.00 . A A . 12 ARG NH1 1 1 1 202 1 1 12 ARG NH2 N 6.936 -7.782 6.030 1.00 . A A . 12 ARG NH2 1 1 1 203 1 1 12 ARG O O 7.014 -1.740 2.335 1.00 . A A . 12 ARG O 1 1 1 204 1 1 13 HIS C C 7.095 -1.482 -0.471 1.00 . A A . 13 HIS C 1 1 1 205 1 1 13 HIS CA C 7.242 -2.932 -0.019 1.00 . A A . 13 HIS CA 1 1 1 206 1 1 13 HIS CB C 7.099 -3.872 -1.219 1.00 . A A . 13 HIS CB 1 1 1 207 1 1 13 HIS CD2 C 9.648 -3.705 -1.842 1.00 . A A . 13 HIS CD2 1 1 1 208 1 1 13 HIS CE1 C 9.430 -3.497 -3.988 1.00 . A A . 13 HIS CE1 1 1 1 209 1 1 13 HIS CG C 8.301 -3.733 -2.112 1.00 . A A . 13 HIS CG 1 1 1 210 1 1 13 HIS H H 5.379 -3.750 0.687 1.00 . A A . 13 HIS H 1 1 1 211 1 1 13 HIS HA H 8.185 -3.075 0.490 1.00 . A A . 13 HIS HA 1 1 1 212 1 1 13 HIS HB2 H 7.023 -4.892 -0.872 1.00 . A A . 13 HIS HB2 1 1 1 213 1 1 13 HIS HB3 H 6.209 -3.615 -1.774 1.00 . A A . 13 HIS HB3 1 1 1 214 1 1 13 HIS HD1 H 7.353 -3.581 -4.000 1.00 . A A . 13 HIS HD1 1 1 1 215 1 1 13 HIS HD2 H 10.088 -3.786 -0.859 1.00 . A A . 13 HIS HD2 1 1 1 216 1 1 13 HIS HE1 H 9.651 -3.383 -5.039 1.00 . A A . 13 HIS HE1 1 1 1 217 1 1 13 HIS N N 6.110 -3.143 0.918 1.00 . A A . 13 HIS N 1 1 1 218 1 1 13 HIS ND1 N 8.189 -3.599 -3.487 1.00 . A A . 13 HIS ND1 1 1 1 219 1 1 13 HIS NE2 N 10.359 -3.556 -3.031 1.00 . A A . 13 HIS NE2 1 1 1 220 1 1 13 HIS O O 7.983 -0.664 -0.335 1.00 . A A . 13 HIS O 1 1 1 221 1 1 14 ALA C C 5.767 1.217 -0.340 1.00 . A A . 14 ALA C 1 1 1 222 1 1 14 ALA CA C 5.677 0.206 -1.492 1.00 . A A . 14 ALA CA 1 1 1 223 1 1 14 ALA CB C 4.282 0.215 -2.122 1.00 . A A . 14 ALA CB 1 1 1 224 1 1 14 ALA H H 5.260 -1.874 -1.098 1.00 . A A . 14 ALA H 1 1 1 225 1 1 14 ALA HA H 6.403 0.475 -2.248 1.00 . A A . 14 ALA HA 1 1 1 226 1 1 14 ALA HB1 H 3.642 -0.464 -1.576 1.00 . A A . 14 ALA HB1 1 1 1 227 1 1 14 ALA HB2 H 3.871 1.212 -2.080 1.00 . A A . 14 ALA HB2 1 1 1 228 1 1 14 ALA HB3 H 4.351 -0.107 -3.152 1.00 . A A . 14 ALA HB3 1 1 1 229 1 1 14 ALA N N 5.950 -1.178 -1.011 1.00 . A A . 14 ALA N 1 1 1 230 1 1 14 ALA O O 5.944 2.394 -0.581 1.00 . A A . 14 ALA O 1 1 1 231 1 1 15 LYS C C 7.241 2.134 2.204 1.00 . A A . 15 LYS C 1 1 1 232 1 1 15 LYS CA C 5.753 1.816 2.004 1.00 . A A . 15 LYS CA 1 1 1 233 1 1 15 LYS CB C 5.237 1.246 3.335 1.00 . A A . 15 LYS CB 1 1 1 234 1 1 15 LYS CD C 5.521 1.437 5.826 1.00 . A A . 15 LYS CD 1 1 1 235 1 1 15 LYS CE C 6.617 0.905 6.750 1.00 . A A . 15 LYS CE 1 1 1 236 1 1 15 LYS CG C 6.124 1.780 4.463 1.00 . A A . 15 LYS CG 1 1 1 237 1 1 15 LYS H H 5.518 -0.132 1.112 1.00 . A A . 15 LYS H 1 1 1 238 1 1 15 LYS HA H 5.197 2.713 1.740 1.00 . A A . 15 LYS HA 1 1 1 239 1 1 15 LYS HB2 H 4.207 1.536 3.511 1.00 . A A . 15 LYS HB2 1 1 1 240 1 1 15 LYS HB3 H 5.312 0.170 3.328 1.00 . A A . 15 LYS HB3 1 1 1 241 1 1 15 LYS HD2 H 5.082 2.325 6.258 1.00 . A A . 15 LYS HD2 1 1 1 242 1 1 15 LYS HD3 H 4.762 0.679 5.705 1.00 . A A . 15 LYS HD3 1 1 1 243 1 1 15 LYS HE2 H 6.175 0.284 7.515 1.00 . A A . 15 LYS HE2 1 1 1 244 1 1 15 LYS HE3 H 7.321 0.321 6.174 1.00 . A A . 15 LYS HE3 1 1 1 245 1 1 15 LYS HG2 H 7.099 1.321 4.388 1.00 . A A . 15 LYS HG2 1 1 1 246 1 1 15 LYS HG3 H 6.218 2.851 4.373 1.00 . A A . 15 LYS HG3 1 1 1 247 1 1 15 LYS HZ1 H 7.421 2.825 6.701 1.00 . A A . 15 LYS HZ1 1 1 1 248 1 1 15 LYS HZ2 H 6.785 2.376 8.212 1.00 . A A . 15 LYS HZ2 1 1 1 249 1 1 15 LYS HZ3 H 8.276 1.748 7.689 1.00 . A A . 15 LYS HZ3 1 1 1 250 1 1 15 LYS N N 5.658 0.814 0.901 1.00 . A A . 15 LYS N 1 1 1 251 1 1 15 LYS NZ N 7.328 2.050 7.387 1.00 . A A . 15 LYS NZ 1 1 1 252 1 1 15 LYS O O 7.619 3.283 2.318 1.00 . A A . 15 LYS O 1 1 1 253 1 1 16 SER C C 10.298 1.479 1.119 1.00 . A A . 16 SER C 1 1 1 254 1 1 16 SER CA C 9.550 1.397 2.450 1.00 . A A . 16 SER CA 1 1 1 255 1 1 16 SER CB C 10.136 0.205 3.200 1.00 . A A . 16 SER CB 1 1 1 256 1 1 16 SER H H 7.807 0.202 2.166 1.00 . A A . 16 SER H 1 1 1 257 1 1 16 SER HA H 9.713 2.282 3.042 1.00 . A A . 16 SER HA 1 1 1 258 1 1 16 SER HB2 H 9.402 -0.196 3.881 1.00 . A A . 16 SER HB2 1 1 1 259 1 1 16 SER HB3 H 10.388 -0.551 2.468 1.00 . A A . 16 SER HB3 1 1 1 260 1 1 16 SER HG H 11.704 1.329 3.442 1.00 . A A . 16 SER HG 1 1 1 261 1 1 16 SER N N 8.095 1.139 2.253 1.00 . A A . 16 SER N 1 1 1 262 1 1 16 SER O O 11.513 1.475 1.101 1.00 . A A . 16 SER O 1 1 1 263 1 1 16 SER OG O 11.279 0.622 3.933 1.00 . A A . 16 SER OG 1 1 1 264 1 1 17 LEU C C 10.262 2.967 -1.970 1.00 . A A . 17 LEU C 1 1 1 265 1 1 17 LEU CA C 10.401 1.620 -1.257 1.00 . A A . 17 LEU CA 1 1 1 266 1 1 17 LEU CB C 10.018 0.394 -2.084 1.00 . A A . 17 LEU CB 1 1 1 267 1 1 17 LEU CD1 C 9.355 1.395 -4.219 1.00 . A A . 17 LEU CD1 1 1 1 268 1 1 17 LEU CD2 C 8.294 -0.742 -3.323 1.00 . A A . 17 LEU CD2 1 1 1 269 1 1 17 LEU CG C 8.828 0.654 -2.992 1.00 . A A . 17 LEU CG 1 1 1 270 1 1 17 LEU H H 8.645 1.548 0.007 1.00 . A A . 17 LEU H 1 1 1 271 1 1 17 LEU HA H 11.443 1.530 -1.001 1.00 . A A . 17 LEU HA 1 1 1 272 1 1 17 LEU HB2 H 10.848 0.083 -2.695 1.00 . A A . 17 LEU HB2 1 1 1 273 1 1 17 LEU HB3 H 9.760 -0.408 -1.409 1.00 . A A . 17 LEU HB3 1 1 1 274 1 1 17 LEU HD11 H 10.435 1.405 -4.176 1.00 . A A . 17 LEU HD11 1 1 1 275 1 1 17 LEU HD12 H 9.029 0.897 -5.119 1.00 . A A . 17 LEU HD12 1 1 1 276 1 1 17 LEU HD13 H 8.986 2.410 -4.202 1.00 . A A . 17 LEU HD13 1 1 1 277 1 1 17 LEU HD21 H 8.608 -1.419 -2.541 1.00 . A A . 17 LEU HD21 1 1 1 278 1 1 17 LEU HD22 H 7.217 -0.745 -3.374 1.00 . A A . 17 LEU HD22 1 1 1 279 1 1 17 LEU HD23 H 8.708 -1.069 -4.265 1.00 . A A . 17 LEU HD23 1 1 1 280 1 1 17 LEU HG H 8.091 1.239 -2.470 1.00 . A A . 17 LEU HG 1 1 1 281 1 1 17 LEU N N 9.625 1.548 0.009 1.00 . A A . 17 LEU N 1 1 1 282 1 1 17 LEU O O 11.220 3.449 -2.541 1.00 . A A . 17 LEU O 1 1 1 283 1 1 18 GLY C C 7.660 5.096 -3.276 1.00 . A A . 18 GLY C 1 1 1 284 1 1 18 GLY CA C 9.048 4.917 -2.668 1.00 . A A . 18 GLY CA 1 1 1 285 1 1 18 GLY H H 8.338 3.238 -1.506 1.00 . A A . 18 GLY H 1 1 1 286 1 1 18 GLY HA2 H 9.242 5.712 -1.963 1.00 . A A . 18 GLY HA2 1 1 1 287 1 1 18 GLY HA3 H 9.783 4.945 -3.459 1.00 . A A . 18 GLY HA3 1 1 1 288 1 1 18 GLY N N 9.124 3.605 -1.963 1.00 . A A . 18 GLY N 1 1 1 289 1 1 18 GLY O O 7.169 6.194 -3.455 1.00 . A A . 18 GLY O 1 1 1 290 1 1 19 ASN C C 4.593 4.253 -3.149 1.00 . A A . 19 ASN C 1 1 1 291 1 1 19 ASN CA C 5.682 4.021 -4.189 1.00 . A A . 19 ASN CA 1 1 1 292 1 1 19 ASN CB C 5.360 2.639 -4.717 1.00 . A A . 19 ASN CB 1 1 1 293 1 1 19 ASN CG C 6.577 1.847 -5.187 1.00 . A A . 19 ASN CG 1 1 1 294 1 1 19 ASN H H 7.448 3.131 -3.439 1.00 . A A . 19 ASN H 1 1 1 295 1 1 19 ASN HA H 5.614 4.712 -5.014 1.00 . A A . 19 ASN HA 1 1 1 296 1 1 19 ASN HB2 H 4.821 2.089 -3.968 1.00 . A A . 19 ASN HB2 1 1 1 297 1 1 19 ASN HB3 H 4.692 2.763 -5.531 1.00 . A A . 19 ASN HB3 1 1 1 298 1 1 19 ASN HD21 H 5.790 0.132 -4.579 1.00 . A A . 19 ASN HD21 1 1 1 299 1 1 19 ASN HD22 H 7.325 0.016 -5.302 1.00 . A A . 19 ASN HD22 1 1 1 300 1 1 19 ASN N N 7.036 4.000 -3.590 1.00 . A A . 19 ASN N 1 1 1 301 1 1 19 ASN ND2 N 6.565 0.558 -5.007 1.00 . A A . 19 ASN ND2 1 1 1 302 1 1 19 ASN O O 3.453 4.363 -3.551 1.00 . A A . 19 ASN O 1 1 1 303 1 1 19 ASN OD1 O 7.523 2.401 -5.714 1.00 . A A . 19 ASN OD1 1 1 1 304 1 1 20 CYS C C 2.829 5.465 -1.358 1.00 . A A . 20 CYS C 1 1 1 305 1 1 20 CYS CA C 3.913 4.532 -0.824 1.00 . A A . 20 CYS CA 1 1 1 306 1 1 20 CYS CB C 4.520 5.179 0.418 1.00 . A A . 20 CYS CB 1 1 1 307 1 1 20 CYS H H 5.885 4.207 -1.648 1.00 . A A . 20 CYS H 1 1 1 308 1 1 20 CYS HA H 3.467 3.583 -0.560 1.00 . A A . 20 CYS HA 1 1 1 309 1 1 20 CYS HB2 H 4.695 4.426 1.176 1.00 . A A . 20 CYS HB2 1 1 1 310 1 1 20 CYS HB3 H 5.441 5.682 0.168 1.00 . A A . 20 CYS HB3 1 1 1 311 1 1 20 CYS N N 4.940 4.313 -1.888 1.00 . A A . 20 CYS N 1 1 1 312 1 1 20 CYS O O 1.651 5.193 -1.263 1.00 . A A . 20 CYS O 1 1 1 313 1 1 20 CYS SG S 3.326 6.388 1.033 1.00 . A A . 20 CYS SG 1 1 1 314 1 1 21 ARG C C 2.548 7.893 -3.931 1.00 . A A . 21 ARG C 1 1 1 315 1 1 21 ARG CA C 2.242 7.533 -2.474 1.00 . A A . 21 ARG CA 1 1 1 316 1 1 21 ARG CB C 2.336 8.812 -1.660 1.00 . A A . 21 ARG CB 1 1 1 317 1 1 21 ARG CD C 1.014 10.146 0.030 1.00 . A A . 21 ARG CD 1 1 1 318 1 1 21 ARG CG C 1.298 8.750 -0.536 1.00 . A A . 21 ARG CG 1 1 1 319 1 1 21 ARG CZ C 2.499 11.985 -0.505 1.00 . A A . 21 ARG CZ 1 1 1 320 1 1 21 ARG H H 4.195 6.752 -1.980 1.00 . A A . 21 ARG H 1 1 1 321 1 1 21 ARG HA H 1.241 7.145 -2.383 1.00 . A A . 21 ARG HA 1 1 1 322 1 1 21 ARG HB2 H 3.344 8.870 -1.274 1.00 . A A . 21 ARG HB2 1 1 1 323 1 1 21 ARG HB3 H 2.140 9.646 -2.313 1.00 . A A . 21 ARG HB3 1 1 1 324 1 1 21 ARG HD2 H -0.051 10.277 0.151 1.00 . A A . 21 ARG HD2 1 1 1 325 1 1 21 ARG HD3 H 1.492 10.245 0.994 1.00 . A A . 21 ARG HD3 1 1 1 326 1 1 21 ARG HE H 1.142 11.302 -1.783 1.00 . A A . 21 ARG HE 1 1 1 327 1 1 21 ARG HG2 H 0.388 8.319 -0.928 1.00 . A A . 21 ARG HG2 1 1 1 328 1 1 21 ARG HG3 H 1.673 8.111 0.250 1.00 . A A . 21 ARG HG3 1 1 1 329 1 1 21 ARG HH11 H 3.930 10.613 -0.782 1.00 . A A . 21 ARG HH11 1 1 1 330 1 1 21 ARG HH12 H 4.471 12.152 -0.201 1.00 . A A . 21 ARG HH12 1 1 1 331 1 1 21 ARG HH21 H 1.295 13.541 -0.137 1.00 . A A . 21 ARG HH21 1 1 1 332 1 1 21 ARG HH22 H 2.979 13.810 0.165 1.00 . A A . 21 ARG HH22 1 1 1 333 1 1 21 ARG N N 3.234 6.567 -1.923 1.00 . A A . 21 ARG N 1 1 1 334 1 1 21 ARG NE N 1.530 11.199 -0.889 1.00 . A A . 21 ARG NE 1 1 1 335 1 1 21 ARG NH1 N 3.729 11.549 -0.495 1.00 . A A . 21 ARG NH1 1 1 1 336 1 1 21 ARG NH2 N 2.237 13.207 -0.129 1.00 . A A . 21 ARG NH2 1 1 1 337 1 1 21 ARG O O 1.898 8.735 -4.517 1.00 . A A . 21 ARG O 1 1 1 338 1 1 22 THR C C 3.244 6.534 -6.854 1.00 . A A . 22 THR C 1 1 1 339 1 1 22 THR CA C 3.869 7.584 -5.936 1.00 . A A . 22 THR CA 1 1 1 340 1 1 22 THR CB C 5.389 7.584 -6.114 1.00 . A A . 22 THR CB 1 1 1 341 1 1 22 THR CG2 C 6.061 8.076 -4.832 1.00 . A A . 22 THR CG2 1 1 1 342 1 1 22 THR H H 4.036 6.598 -4.031 1.00 . A A . 22 THR H 1 1 1 343 1 1 22 THR HA H 3.477 8.557 -6.190 1.00 . A A . 22 THR HA 1 1 1 344 1 1 22 THR HB H 5.658 8.246 -6.922 1.00 . A A . 22 THR HB 1 1 1 345 1 1 22 THR HG1 H 5.500 6.035 -7.287 1.00 . A A . 22 THR HG1 1 1 1 346 1 1 22 THR HG21 H 5.650 7.547 -3.984 1.00 . A A . 22 THR HG21 1 1 1 347 1 1 22 THR HG22 H 7.124 7.894 -4.889 1.00 . A A . 22 THR HG22 1 1 1 348 1 1 22 THR HG23 H 5.883 9.135 -4.716 1.00 . A A . 22 THR HG23 1 1 1 349 1 1 22 THR N N 3.527 7.270 -4.521 1.00 . A A . 22 THR N 1 1 1 350 1 1 22 THR O O 3.244 6.681 -8.060 1.00 . A A . 22 THR O 1 1 1 351 1 1 22 THR OG1 O 5.828 6.266 -6.414 1.00 . A A . 22 THR OG1 1 1 1 352 1 1 23 SER C C 0.617 4.421 -6.781 1.00 . A A . 23 SER C 1 1 1 353 1 1 23 SER CA C 2.094 4.447 -7.177 1.00 . A A . 23 SER CA 1 1 1 354 1 1 23 SER CB C 2.843 3.143 -6.913 1.00 . A A . 23 SER CB 1 1 1 355 1 1 23 SER H H 2.699 5.346 -5.331 1.00 . A A . 23 SER H 1 1 1 356 1 1 23 SER HA H 2.185 4.745 -8.212 1.00 . A A . 23 SER HA 1 1 1 357 1 1 23 SER HB2 H 3.861 3.236 -7.260 1.00 . A A . 23 SER HB2 1 1 1 358 1 1 23 SER HB3 H 2.862 2.973 -5.847 1.00 . A A . 23 SER HB3 1 1 1 359 1 1 23 SER HG H 2.569 2.054 -8.499 1.00 . A A . 23 SER HG 1 1 1 360 1 1 23 SER N N 2.709 5.478 -6.306 1.00 . A A . 23 SER N 1 1 1 361 1 1 23 SER O O 0.286 4.668 -5.638 1.00 . A A . 23 SER O 1 1 1 362 1 1 23 SER OG O 2.212 2.077 -7.609 1.00 . A A . 23 SER OG 1 1 1 363 1 1 24 GLN C C -2.126 2.935 -6.417 1.00 . A A . 24 GLN C 1 1 1 364 1 1 24 GLN CA C -1.722 4.133 -7.278 1.00 . A A . 24 GLN CA 1 1 1 365 1 1 24 GLN CB C -2.615 4.212 -8.518 1.00 . A A . 24 GLN CB 1 1 1 366 1 1 24 GLN CD C -3.852 6.371 -8.756 1.00 . A A . 24 GLN CD 1 1 1 367 1 1 24 GLN CG C -2.561 5.625 -9.100 1.00 . A A . 24 GLN CG 1 1 1 368 1 1 24 GLN H H -0.027 3.949 -8.605 1.00 . A A . 24 GLN H 1 1 1 369 1 1 24 GLN HA H -1.896 5.023 -6.692 1.00 . A A . 24 GLN HA 1 1 1 370 1 1 24 GLN HB2 H -2.271 3.501 -9.254 1.00 . A A . 24 GLN HB2 1 1 1 371 1 1 24 GLN HB3 H -3.634 3.980 -8.243 1.00 . A A . 24 GLN HB3 1 1 1 372 1 1 24 GLN HE21 H -4.988 5.233 -9.922 1.00 . A A . 24 GLN HE21 1 1 1 373 1 1 24 GLN HE22 H -5.807 6.462 -9.086 1.00 . A A . 24 GLN HE22 1 1 1 374 1 1 24 GLN HG2 H -1.715 6.152 -8.683 1.00 . A A . 24 GLN HG2 1 1 1 375 1 1 24 GLN HG3 H -2.459 5.570 -10.173 1.00 . A A . 24 GLN HG3 1 1 1 376 1 1 24 GLN N N -0.286 4.142 -7.680 1.00 . A A . 24 GLN N 1 1 1 377 1 1 24 GLN NE2 N -4.975 5.991 -9.299 1.00 . A A . 24 GLN NE2 1 1 1 378 1 1 24 GLN O O -2.441 3.107 -5.261 1.00 . A A . 24 GLN O 1 1 1 379 1 1 24 GLN OE1 O -3.838 7.310 -7.985 1.00 . A A . 24 GLN OE1 1 1 1 380 1 1 25 LYS C C -1.644 0.624 -4.770 1.00 . A A . 25 LYS C 1 1 1 381 1 1 25 LYS CA C -2.550 0.616 -6.006 1.00 . A A . 25 LYS CA 1 1 1 382 1 1 25 LYS CB C -2.402 -0.709 -6.753 1.00 . A A . 25 LYS CB 1 1 1 383 1 1 25 LYS CD C -4.021 -2.293 -7.830 1.00 . A A . 25 LYS CD 1 1 1 384 1 1 25 LYS CE C -4.392 -1.287 -8.921 1.00 . A A . 25 LYS CE 1 1 1 385 1 1 25 LYS CG C -3.665 -1.545 -6.543 1.00 . A A . 25 LYS CG 1 1 1 386 1 1 25 LYS H H -1.893 1.565 -7.842 1.00 . A A . 25 LYS H 1 1 1 387 1 1 25 LYS HA H -3.577 0.753 -5.702 1.00 . A A . 25 LYS HA 1 1 1 388 1 1 25 LYS HB2 H -2.259 -0.510 -7.806 1.00 . A A . 25 LYS HB2 1 1 1 389 1 1 25 LYS HB3 H -1.550 -1.246 -6.364 1.00 . A A . 25 LYS HB3 1 1 1 390 1 1 25 LYS HD2 H -3.174 -2.880 -8.151 1.00 . A A . 25 LYS HD2 1 1 1 391 1 1 25 LYS HD3 H -4.864 -2.943 -7.647 1.00 . A A . 25 LYS HD3 1 1 1 392 1 1 25 LYS HE2 H -5.056 -0.540 -8.512 1.00 . A A . 25 LYS HE2 1 1 1 393 1 1 25 LYS HE3 H -3.497 -0.809 -9.288 1.00 . A A . 25 LYS HE3 1 1 1 394 1 1 25 LYS HG2 H -3.498 -2.246 -5.739 1.00 . A A . 25 LYS HG2 1 1 1 395 1 1 25 LYS HG3 H -4.480 -0.889 -6.274 1.00 . A A . 25 LYS HG3 1 1 1 396 1 1 25 LYS HZ1 H -4.749 -2.985 -10.069 1.00 . A A . 25 LYS HZ1 1 1 1 397 1 1 25 LYS HZ2 H -6.102 -1.969 -9.898 1.00 . A A . 25 LYS HZ2 1 1 1 398 1 1 25 LYS HZ3 H -4.842 -1.529 -10.940 1.00 . A A . 25 LYS HZ3 1 1 1 399 1 1 25 LYS N N -2.142 1.731 -6.908 1.00 . A A . 25 LYS N 1 1 1 400 1 1 25 LYS NZ N -5.072 -1.997 -10.041 1.00 . A A . 25 LYS NZ 1 1 1 401 1 1 25 LYS O O -2.048 0.559 -3.627 1.00 . A A . 25 LYS O 1 1 1 402 1 1 26 TYR C C 0.433 1.794 -2.912 1.00 . A A . 26 TYR C 1 1 1 403 1 1 26 TYR CA C 0.685 0.740 -3.998 1.00 . A A . 26 TYR CA 1 1 1 404 1 1 26 TYR CB C 1.892 1.113 -4.837 1.00 . A A . 26 TYR CB 1 1 1 405 1 1 26 TYR CD1 C 1.962 -1.397 -5.249 1.00 . A A . 26 TYR CD1 1 1 1 406 1 1 26 TYR CD2 C 3.853 -0.021 -5.857 1.00 . A A . 26 TYR CD2 1 1 1 407 1 1 26 TYR CE1 C 2.641 -2.523 -5.707 1.00 . A A . 26 TYR CE1 1 1 1 408 1 1 26 TYR CE2 C 4.537 -1.148 -6.315 1.00 . A A . 26 TYR CE2 1 1 1 409 1 1 26 TYR CG C 2.572 -0.138 -5.325 1.00 . A A . 26 TYR CG 1 1 1 410 1 1 26 TYR CZ C 3.931 -2.409 -6.241 1.00 . A A . 26 TYR CZ 1 1 1 411 1 1 26 TYR H H -0.113 0.763 -5.980 1.00 . A A . 26 TYR H 1 1 1 412 1 1 26 TYR HA H 0.889 -0.226 -3.560 1.00 . A A . 26 TYR HA 1 1 1 413 1 1 26 TYR HB2 H 1.524 1.678 -5.676 1.00 . A A . 26 TYR HB2 1 1 1 414 1 1 26 TYR HB3 H 2.579 1.710 -4.256 1.00 . A A . 26 TYR HB3 1 1 1 415 1 1 26 TYR HD1 H 0.966 -1.522 -4.845 1.00 . A A . 26 TYR HD1 1 1 1 416 1 1 26 TYR HD2 H 4.315 0.951 -5.917 1.00 . A A . 26 TYR HD2 1 1 1 417 1 1 26 TYR HE1 H 2.143 -3.473 -5.631 1.00 . A A . 26 TYR HE1 1 1 1 418 1 1 26 TYR HE2 H 5.528 -1.028 -6.721 1.00 . A A . 26 TYR HE2 1 1 1 419 1 1 26 TYR HH H 4.546 -4.201 -6.007 1.00 . A A . 26 TYR HH 1 1 1 420 1 1 26 TYR N N -0.380 0.712 -5.039 1.00 . A A . 26 TYR N 1 1 1 421 1 1 26 TYR O O 0.929 1.679 -1.809 1.00 . A A . 26 TYR O 1 1 1 422 1 1 26 TYR OH O 4.599 -3.530 -6.691 1.00 . A A . 26 TYR OH 1 1 1 423 1 1 27 ARG C C -1.956 3.580 -1.529 1.00 . A A . 27 ARG C 1 1 1 424 1 1 27 ARG CA C -0.574 3.851 -2.132 1.00 . A A . 27 ARG CA 1 1 1 425 1 1 27 ARG CB C -0.433 5.246 -2.760 1.00 . A A . 27 ARG CB 1 1 1 426 1 1 27 ARG CD C -1.555 7.171 -3.867 1.00 . A A . 27 ARG CD 1 1 1 427 1 1 27 ARG CG C -1.719 5.711 -3.440 1.00 . A A . 27 ARG CG 1 1 1 428 1 1 27 ARG CZ C -1.919 9.340 -2.851 1.00 . A A . 27 ARG CZ 1 1 1 429 1 1 27 ARG H H -0.728 2.932 -4.062 1.00 . A A . 27 ARG H 1 1 1 430 1 1 27 ARG HA H 0.161 3.715 -1.352 1.00 . A A . 27 ARG HA 1 1 1 431 1 1 27 ARG HB2 H -0.167 5.970 -2.005 1.00 . A A . 27 ARG HB2 1 1 1 432 1 1 27 ARG HB3 H 0.351 5.206 -3.502 1.00 . A A . 27 ARG HB3 1 1 1 433 1 1 27 ARG HD2 H -0.569 7.317 -4.281 1.00 . A A . 27 ARG HD2 1 1 1 434 1 1 27 ARG HD3 H -2.298 7.412 -4.613 1.00 . A A . 27 ARG HD3 1 1 1 435 1 1 27 ARG HE H -1.711 7.681 -1.779 1.00 . A A . 27 ARG HE 1 1 1 436 1 1 27 ARG HG2 H -1.867 5.103 -4.320 1.00 . A A . 27 ARG HG2 1 1 1 437 1 1 27 ARG HG3 H -2.549 5.628 -2.755 1.00 . A A . 27 ARG HG3 1 1 1 438 1 1 27 ARG HH11 H 0.033 9.763 -2.971 1.00 . A A . 27 ARG HH11 1 1 1 439 1 1 27 ARG HH12 H -1.036 11.117 -3.121 1.00 . A A . 27 ARG HH12 1 1 1 440 1 1 27 ARG HH21 H -3.916 9.216 -2.772 1.00 . A A . 27 ARG HH21 1 1 1 441 1 1 27 ARG HH22 H -3.272 10.807 -3.009 1.00 . A A . 27 ARG HH22 1 1 1 442 1 1 27 ARG N N -0.323 2.826 -3.180 1.00 . A A . 27 ARG N 1 1 1 443 1 1 27 ARG NE N -1.734 8.059 -2.683 1.00 . A A . 27 ARG NE 1 1 1 444 1 1 27 ARG NH1 N -0.894 10.135 -2.992 1.00 . A A . 27 ARG NH1 1 1 1 445 1 1 27 ARG NH2 N -3.130 9.825 -2.880 1.00 . A A . 27 ARG NH2 1 1 1 446 1 1 27 ARG O O -2.102 3.419 -0.335 1.00 . A A . 27 ARG O 1 1 1 447 1 1 28 ALA C C -4.475 1.752 -1.586 1.00 . A A . 28 ALA C 1 1 1 448 1 1 28 ALA CA C -4.349 3.257 -1.830 1.00 . A A . 28 ALA CA 1 1 1 449 1 1 28 ALA CB C -5.380 3.695 -2.873 1.00 . A A . 28 ALA CB 1 1 1 450 1 1 28 ALA H H -2.831 3.653 -3.297 1.00 . A A . 28 ALA H 1 1 1 451 1 1 28 ALA HA H -4.504 3.791 -0.904 1.00 . A A . 28 ALA HA 1 1 1 452 1 1 28 ALA HB1 H -5.052 4.612 -3.342 1.00 . A A . 28 ALA HB1 1 1 1 453 1 1 28 ALA HB2 H -5.483 2.924 -3.622 1.00 . A A . 28 ALA HB2 1 1 1 454 1 1 28 ALA HB3 H -6.332 3.860 -2.392 1.00 . A A . 28 ALA HB3 1 1 1 455 1 1 28 ALA N N -2.975 3.522 -2.341 1.00 . A A . 28 ALA N 1 1 1 456 1 1 28 ALA O O -4.787 1.317 -0.495 1.00 . A A . 28 ALA O 1 1 1 457 1 1 29 ASN C C -3.346 -1.018 -1.347 1.00 . A A . 29 ASN C 1 1 1 458 1 1 29 ASN CA C -4.346 -0.530 -2.393 1.00 . A A . 29 ASN CA 1 1 1 459 1 1 29 ASN CB C -4.117 -1.319 -3.682 1.00 . A A . 29 ASN CB 1 1 1 460 1 1 29 ASN CG C -5.470 -1.668 -4.305 1.00 . A A . 29 ASN CG 1 1 1 461 1 1 29 ASN H H -3.987 1.315 -3.462 1.00 . A A . 29 ASN H 1 1 1 462 1 1 29 ASN HA H -5.333 -0.734 -2.025 1.00 . A A . 29 ASN HA 1 1 1 463 1 1 29 ASN HB2 H -3.534 -0.722 -4.365 1.00 . A A . 29 ASN HB2 1 1 1 464 1 1 29 ASN HB3 H -3.583 -2.232 -3.460 1.00 . A A . 29 ASN HB3 1 1 1 465 1 1 29 ASN HD21 H -6.129 0.205 -4.280 1.00 . A A . 29 ASN HD21 1 1 1 466 1 1 29 ASN HD22 H -7.212 -0.936 -4.918 1.00 . A A . 29 ASN HD22 1 1 1 467 1 1 29 ASN N N -4.235 0.946 -2.589 1.00 . A A . 29 ASN N 1 1 1 468 1 1 29 ASN ND2 N -6.343 -0.722 -4.520 1.00 . A A . 29 ASN ND2 1 1 1 469 1 1 29 ASN O O -3.408 -2.145 -0.901 1.00 . A A . 29 ASN O 1 1 1 470 1 1 29 ASN OD1 O -5.736 -2.816 -4.603 1.00 . A A . 29 ASN OD1 1 1 1 471 1 1 30 CYS C C -1.306 0.586 1.024 1.00 . A A . 30 CYS C 1 1 1 472 1 1 30 CYS CA C -1.429 -0.593 0.061 1.00 . A A . 30 CYS CA 1 1 1 473 1 1 30 CYS CB C -0.127 -0.926 -0.666 1.00 . A A . 30 CYS CB 1 1 1 474 1 1 30 CYS H H -2.395 0.723 -1.328 1.00 . A A . 30 CYS H 1 1 1 475 1 1 30 CYS HA H -1.807 -1.455 0.595 1.00 . A A . 30 CYS HA 1 1 1 476 1 1 30 CYS HB2 H 0.061 -0.188 -1.431 1.00 . A A . 30 CYS HB2 1 1 1 477 1 1 30 CYS HB3 H 0.695 -0.964 0.035 1.00 . A A . 30 CYS HB3 1 1 1 478 1 1 30 CYS N N -2.430 -0.182 -0.956 1.00 . A A . 30 CYS N 1 1 1 479 1 1 30 CYS O O -0.255 0.959 1.504 1.00 . A A . 30 CYS O 1 1 1 480 1 1 30 CYS SG S -0.352 -2.558 -1.416 1.00 . A A . 30 CYS SG 1 1 1 481 1 1 31 ALA C C -2.511 1.882 3.637 1.00 . A A . 31 ALA C 1 1 1 482 1 1 31 ALA CA C -2.642 2.322 2.174 1.00 . A A . 31 ALA CA 1 1 1 483 1 1 31 ALA CB C -4.047 2.855 1.890 1.00 . A A . 31 ALA CB 1 1 1 484 1 1 31 ALA H H -3.253 0.783 0.841 1.00 . A A . 31 ALA H 1 1 1 485 1 1 31 ALA HA H -1.910 3.086 1.941 1.00 . A A . 31 ALA HA 1 1 1 486 1 1 31 ALA HB1 H -4.684 2.027 1.603 1.00 . A A . 31 ALA HB1 1 1 1 487 1 1 31 ALA HB2 H -4.447 3.323 2.775 1.00 . A A . 31 ALA HB2 1 1 1 488 1 1 31 ALA HB3 H -4.012 3.570 1.082 1.00 . A A . 31 ALA HB3 1 1 1 489 1 1 31 ALA N N -2.456 1.151 1.273 1.00 . A A . 31 ALA N 1 1 1 490 1 1 31 ALA O O -2.496 2.680 4.551 1.00 . A A . 31 ALA O 1 1 1 491 1 1 32 LYS C C -0.778 0.124 5.596 1.00 . A A . 32 LYS C 1 1 1 492 1 1 32 LYS CA C -2.274 0.103 5.268 1.00 . A A . 32 LYS CA 1 1 1 493 1 1 32 LYS CB C -2.787 -1.336 5.300 1.00 . A A . 32 LYS CB 1 1 1 494 1 1 32 LYS CD C -0.672 -2.684 5.054 1.00 . A A . 32 LYS CD 1 1 1 495 1 1 32 LYS CE C -0.313 -4.156 5.291 1.00 . A A . 32 LYS CE 1 1 1 496 1 1 32 LYS CG C -1.796 -2.264 6.008 1.00 . A A . 32 LYS CG 1 1 1 497 1 1 32 LYS H H -2.420 -0.030 3.129 1.00 . A A . 32 LYS H 1 1 1 498 1 1 32 LYS HA H -2.831 0.723 5.956 1.00 . A A . 32 LYS HA 1 1 1 499 1 1 32 LYS HB2 H -3.736 -1.357 5.813 1.00 . A A . 32 LYS HB2 1 1 1 500 1 1 32 LYS HB3 H -2.922 -1.666 4.281 1.00 . A A . 32 LYS HB3 1 1 1 501 1 1 32 LYS HD2 H -1.002 -2.553 4.033 1.00 . A A . 32 LYS HD2 1 1 1 502 1 1 32 LYS HD3 H 0.200 -2.073 5.232 1.00 . A A . 32 LYS HD3 1 1 1 503 1 1 32 LYS HE2 H -0.979 -4.780 4.714 1.00 . A A . 32 LYS HE2 1 1 1 504 1 1 32 LYS HE3 H 0.707 -4.354 4.986 1.00 . A A . 32 LYS HE3 1 1 1 505 1 1 32 LYS HG2 H -1.372 -1.757 6.861 1.00 . A A . 32 LYS HG2 1 1 1 506 1 1 32 LYS HG3 H -2.322 -3.146 6.340 1.00 . A A . 32 LYS HG3 1 1 1 507 1 1 32 LYS HZ1 H -0.229 -3.632 7.302 1.00 . A A . 32 LYS HZ1 1 1 1 508 1 1 32 LYS HZ2 H -1.452 -4.752 6.930 1.00 . A A . 32 LYS HZ2 1 1 1 509 1 1 32 LYS HZ3 H 0.163 -5.257 6.993 1.00 . A A . 32 LYS HZ3 1 1 1 510 1 1 32 LYS N N -2.411 0.606 3.873 1.00 . A A . 32 LYS N 1 1 1 511 1 1 32 LYS NZ N -0.469 -4.473 6.737 1.00 . A A . 32 LYS NZ 1 1 1 512 1 1 32 LYS O O -0.366 0.181 6.738 1.00 . A A . 32 LYS O 1 1 1 513 1 1 33 THR C C 1.991 1.539 4.737 1.00 . A A . 33 THR C 1 1 1 514 1 1 33 THR CA C 1.504 0.093 4.692 1.00 . A A . 33 THR CA 1 1 1 515 1 1 33 THR CB C 1.960 -0.776 3.520 1.00 . A A . 33 THR CB 1 1 1 516 1 1 33 THR CG2 C 2.736 -0.027 2.439 1.00 . A A . 33 THR CG2 1 1 1 517 1 1 33 THR H H -0.343 0.036 3.665 1.00 . A A . 33 THR H 1 1 1 518 1 1 33 THR HA H 1.827 -0.347 5.615 1.00 . A A . 33 THR HA 1 1 1 519 1 1 33 THR HB H 1.080 -1.221 3.085 1.00 . A A . 33 THR HB 1 1 1 520 1 1 33 THR HG1 H 3.112 -1.544 4.880 1.00 . A A . 33 THR HG1 1 1 1 521 1 1 33 THR HG21 H 2.668 1.037 2.581 1.00 . A A . 33 THR HG21 1 1 1 522 1 1 33 THR HG22 H 3.760 -0.351 2.482 1.00 . A A . 33 THR HG22 1 1 1 523 1 1 33 THR HG23 H 2.329 -0.285 1.473 1.00 . A A . 33 THR HG23 1 1 1 524 1 1 33 THR N N 0.026 0.080 4.569 1.00 . A A . 33 THR N 1 1 1 525 1 1 33 THR O O 3.052 1.838 5.245 1.00 . A A . 33 THR O 1 1 1 526 1 1 33 THR OG1 O 2.746 -1.832 4.042 1.00 . A A . 33 THR OG1 1 1 1 527 1 1 34 CYS C C 0.629 4.713 5.012 1.00 . A A . 34 CYS C 1 1 1 528 1 1 34 CYS CA C 1.647 3.869 4.241 1.00 . A A . 34 CYS CA 1 1 1 529 1 1 34 CYS CB C 1.743 4.442 2.833 1.00 . A A . 34 CYS CB 1 1 1 530 1 1 34 CYS H H 0.362 2.187 3.812 1.00 . A A . 34 CYS H 1 1 1 531 1 1 34 CYS HA H 2.615 3.941 4.717 1.00 . A A . 34 CYS HA 1 1 1 532 1 1 34 CYS HB2 H 1.982 3.664 2.131 1.00 . A A . 34 CYS HB2 1 1 1 533 1 1 34 CYS HB3 H 0.796 4.849 2.547 1.00 . A A . 34 CYS HB3 1 1 1 534 1 1 34 CYS N N 1.216 2.446 4.213 1.00 . A A . 34 CYS N 1 1 1 535 1 1 34 CYS O O 0.791 5.908 5.158 1.00 . A A . 34 CYS O 1 1 1 536 1 1 34 CYS SG S 2.985 5.760 2.919 1.00 . A A . 34 CYS SG 1 1 1 537 1 1 35 GLU C C -2.213 5.821 5.364 1.00 . A A . 35 GLU C 1 1 1 538 1 1 35 GLU CA C -1.445 4.859 6.264 1.00 . A A . 35 GLU CA 1 1 1 539 1 1 35 GLU CB C -0.776 5.538 7.451 1.00 . A A . 35 GLU CB 1 1 1 540 1 1 35 GLU CD C 0.624 4.801 9.407 1.00 . A A . 35 GLU CD 1 1 1 541 1 1 35 GLU CG C -0.367 4.359 8.328 1.00 . A A . 35 GLU CG 1 1 1 542 1 1 35 GLU H H -0.534 3.142 5.379 1.00 . A A . 35 GLU H 1 1 1 543 1 1 35 GLU HA H -2.158 4.137 6.637 1.00 . A A . 35 GLU HA 1 1 1 544 1 1 35 GLU HB2 H 0.081 6.112 7.127 1.00 . A A . 35 GLU HB2 1 1 1 545 1 1 35 GLU HB3 H -1.475 6.152 7.997 1.00 . A A . 35 GLU HB3 1 1 1 546 1 1 35 GLU HG2 H -1.262 3.947 8.772 1.00 . A A . 35 GLU HG2 1 1 1 547 1 1 35 GLU HG3 H 0.086 3.614 7.689 1.00 . A A . 35 GLU HG3 1 1 1 548 1 1 35 GLU N N -0.415 4.105 5.504 1.00 . A A . 35 GLU N 1 1 1 549 1 1 35 GLU O O -2.681 6.867 5.769 1.00 . A A . 35 GLU O 1 1 1 550 1 1 35 GLU OE1 O 1.765 5.060 9.064 1.00 . A A . 35 GLU OE1 1 1 1 551 1 1 35 GLU OE2 O 0.224 4.871 10.557 1.00 . A A . 35 GLU OE2 1 1 1 552 1 1 36 LEU C C -4.542 5.871 3.280 1.00 . A A . 36 LEU C 1 1 1 553 1 1 36 LEU CA C -3.064 6.242 3.129 1.00 . A A . 36 LEU CA 1 1 1 554 1 1 36 LEU CB C -2.571 5.819 1.749 1.00 . A A . 36 LEU CB 1 1 1 555 1 1 36 LEU CD1 C -0.439 5.212 0.593 1.00 . A A . 36 LEU CD1 1 1 1 556 1 1 36 LEU CD2 C -0.928 7.599 1.142 1.00 . A A . 36 LEU CD2 1 1 1 557 1 1 36 LEU CG C -1.088 6.152 1.610 1.00 . A A . 36 LEU CG 1 1 1 558 1 1 36 LEU H H -1.944 4.572 3.855 1.00 . A A . 36 LEU H 1 1 1 559 1 1 36 LEU HA H -2.902 7.293 3.286 1.00 . A A . 36 LEU HA 1 1 1 560 1 1 36 LEU HB2 H -2.710 4.762 1.682 1.00 . A A . 36 LEU HB2 1 1 1 561 1 1 36 LEU HB3 H -3.125 6.282 0.955 1.00 . A A . 36 LEU HB3 1 1 1 562 1 1 36 LEU HD11 H -0.586 4.186 0.900 1.00 . A A . 36 LEU HD11 1 1 1 563 1 1 36 LEU HD12 H -0.880 5.367 -0.381 1.00 . A A . 36 LEU HD12 1 1 1 564 1 1 36 LEU HD13 H 0.618 5.421 0.545 1.00 . A A . 36 LEU HD13 1 1 1 565 1 1 36 LEU HD21 H -1.592 8.237 1.706 1.00 . A A . 36 LEU HD21 1 1 1 566 1 1 36 LEU HD22 H 0.094 7.917 1.295 1.00 . A A . 36 LEU HD22 1 1 1 567 1 1 36 LEU HD23 H -1.171 7.665 0.091 1.00 . A A . 36 LEU HD23 1 1 1 568 1 1 36 LEU HG H -0.624 6.023 2.576 1.00 . A A . 36 LEU HG 1 1 1 569 1 1 36 LEU N N -2.334 5.426 4.130 1.00 . A A . 36 LEU N 1 1 1 570 1 1 36 LEU O O -5.389 6.403 2.589 1.00 . A A . 36 LEU O 1 1 1 571 1 1 37 CYS C C -7.137 5.857 4.577 1.00 . A A . 37 CYS C 1 1 1 572 1 1 37 CYS CA C -6.309 4.595 4.329 1.00 . A A . 37 CYS CA 1 1 1 573 1 1 37 CYS CB C -6.458 3.642 5.517 1.00 . A A . 37 CYS CB 1 1 1 574 1 1 37 CYS H H -4.203 4.523 4.740 1.00 . A A . 37 CYS H 1 1 1 575 1 1 37 CYS HA H -6.657 4.107 3.430 1.00 . A A . 37 CYS HA 1 1 1 576 1 1 37 CYS HB2 H -5.506 3.181 5.729 1.00 . A A . 37 CYS HB2 1 1 1 577 1 1 37 CYS HB3 H -6.791 4.196 6.382 1.00 . A A . 37 CYS HB3 1 1 1 578 1 1 37 CYS N N -4.875 4.966 4.171 1.00 . A A . 37 CYS N 1 1 1 579 1 1 37 CYS O O -8.224 5.946 4.028 1.00 . A A . 37 CYS O 1 1 1 580 1 1 37 CYS OXT O -6.674 6.712 5.313 1.00 . A A . 37 CYS OXT 1 1 1 581 1 1 37 CYS SG S -7.672 2.360 5.118 1.00 . A A . 37 CYS SG 1 1 2 582 1 1 1 VAL C C -12.258 1.364 0.826 1.00 . A A . 1 VAL C 1 1 2 583 1 1 1 VAL CA C -13.639 1.733 1.373 1.00 . A A . 1 VAL CA 1 1 2 584 1 1 1 VAL CB C -14.426 0.459 1.680 1.00 . A A . 1 VAL CB 1 1 2 585 1 1 1 VAL CG1 C -13.603 -0.448 2.597 1.00 . A A . 1 VAL CG1 1 1 2 586 1 1 1 VAL CG2 C -15.735 0.831 2.381 1.00 . A A . 1 VAL CG2 1 1 2 587 1 1 1 VAL H1 H -13.736 2.783 -0.423 1.00 . A A . 1 VAL H1 1 1 2 588 1 1 1 VAL H2 H -15.172 1.985 -0.015 1.00 . A A . 1 VAL H2 1 1 2 589 1 1 1 VAL H3 H -14.732 3.408 0.804 1.00 . A A . 1 VAL H3 1 1 2 590 1 1 1 VAL HA H -13.523 2.312 2.277 1.00 . A A . 1 VAL HA 1 1 2 591 1 1 1 VAL HB H -14.640 -0.063 0.758 1.00 . A A . 1 VAL HB 1 1 2 592 1 1 1 VAL HG11 H -12.840 0.137 3.091 1.00 . A A . 1 VAL HG11 1 1 2 593 1 1 1 VAL HG12 H -14.250 -0.894 3.337 1.00 . A A . 1 VAL HG12 1 1 2 594 1 1 1 VAL HG13 H -13.137 -1.225 2.010 1.00 . A A . 1 VAL HG13 1 1 2 595 1 1 1 VAL HG21 H -15.583 1.717 2.979 1.00 . A A . 1 VAL HG21 1 1 2 596 1 1 1 VAL HG22 H -16.498 1.022 1.642 1.00 . A A . 1 VAL HG22 1 1 2 597 1 1 1 VAL HG23 H -16.047 0.015 3.018 1.00 . A A . 1 VAL HG23 1 1 2 598 1 1 1 VAL N N -14.375 2.538 0.359 1.00 . A A . 1 VAL N 1 1 2 599 1 1 1 VAL O O -12.135 0.740 -0.208 1.00 . A A . 1 VAL O 1 1 2 600 1 1 2 CYS C C -9.100 0.618 2.109 1.00 . A A . 2 CYS C 1 1 2 601 1 1 2 CYS CA C -9.844 1.422 1.039 1.00 . A A . 2 CYS CA 1 1 2 602 1 1 2 CYS CB C -9.100 2.725 0.747 1.00 . A A . 2 CYS CB 1 1 2 603 1 1 2 CYS H H -11.340 2.251 2.345 1.00 . A A . 2 CYS H 1 1 2 604 1 1 2 CYS HA H -9.918 0.842 0.131 1.00 . A A . 2 CYS HA 1 1 2 605 1 1 2 CYS HB2 H -8.036 2.558 0.821 1.00 . A A . 2 CYS HB2 1 1 2 606 1 1 2 CYS HB3 H -9.347 3.053 -0.251 1.00 . A A . 2 CYS HB3 1 1 2 607 1 1 2 CYS N N -11.218 1.748 1.515 1.00 . A A . 2 CYS N 1 1 2 608 1 1 2 CYS O O -9.602 0.444 3.202 1.00 . A A . 2 CYS O 1 1 2 609 1 1 2 CYS SG S -9.589 3.999 1.936 1.00 . A A . 2 CYS SG 1 1 2 610 1 1 3 ARG C C -6.201 -1.588 1.986 1.00 . A A . 3 ARG C 1 1 2 611 1 1 3 ARG CA C -7.122 -0.662 2.782 1.00 . A A . 3 ARG CA 1 1 2 612 1 1 3 ARG CB C -8.029 -1.530 3.656 1.00 . A A . 3 ARG CB 1 1 2 613 1 1 3 ARG CD C -9.083 -3.654 2.842 1.00 . A A . 3 ARG CD 1 1 2 614 1 1 3 ARG CG C -9.150 -2.125 2.800 1.00 . A A . 3 ARG CG 1 1 2 615 1 1 3 ARG CZ C -9.753 -5.412 4.371 1.00 . A A . 3 ARG CZ 1 1 2 616 1 1 3 ARG H H -7.542 0.291 0.916 1.00 . A A . 3 ARG H 1 1 2 617 1 1 3 ARG HA H -6.531 0.001 3.397 1.00 . A A . 3 ARG HA 1 1 2 618 1 1 3 ARG HB2 H -7.445 -2.326 4.096 1.00 . A A . 3 ARG HB2 1 1 2 619 1 1 3 ARG HB3 H -8.463 -0.926 4.438 1.00 . A A . 3 ARG HB3 1 1 2 620 1 1 3 ARG HD2 H -9.680 -4.065 2.040 1.00 . A A . 3 ARG HD2 1 1 2 621 1 1 3 ARG HD3 H -8.058 -3.974 2.727 1.00 . A A . 3 ARG HD3 1 1 2 622 1 1 3 ARG HE H -9.848 -3.488 4.848 1.00 . A A . 3 ARG HE 1 1 2 623 1 1 3 ARG HG2 H -10.105 -1.795 3.183 1.00 . A A . 3 ARG HG2 1 1 2 624 1 1 3 ARG HG3 H -9.038 -1.794 1.779 1.00 . A A . 3 ARG HG3 1 1 2 625 1 1 3 ARG HH11 H -11.223 -5.633 3.030 1.00 . A A . 3 ARG HH11 1 1 2 626 1 1 3 ARG HH12 H -10.757 -7.071 3.876 1.00 . A A . 3 ARG HH12 1 1 2 627 1 1 3 ARG HH21 H -8.317 -5.489 5.764 1.00 . A A . 3 ARG HH21 1 1 2 628 1 1 3 ARG HH22 H -9.111 -6.989 5.424 1.00 . A A . 3 ARG HH22 1 1 2 629 1 1 3 ARG N N -7.921 0.134 1.806 1.00 . A A . 3 ARG N 1 1 2 630 1 1 3 ARG NE N -9.610 -4.133 4.151 1.00 . A A . 3 ARG NE 1 1 2 631 1 1 3 ARG NH1 N -10.648 -6.092 3.707 1.00 . A A . 3 ARG NH1 1 1 2 632 1 1 3 ARG NH2 N -9.002 -6.011 5.255 1.00 . A A . 3 ARG NH2 1 1 2 633 1 1 3 ARG O O -6.303 -1.671 0.778 1.00 . A A . 3 ARG O 1 1 2 634 1 1 4 ASP C C -5.238 -4.008 0.905 1.00 . A A . 4 ASP C 1 1 2 635 1 1 4 ASP CA C -4.400 -3.195 1.894 1.00 . A A . 4 ASP CA 1 1 2 636 1 1 4 ASP CB C -3.709 -4.144 2.877 1.00 . A A . 4 ASP CB 1 1 2 637 1 1 4 ASP CG C -4.745 -4.729 3.837 1.00 . A A . 4 ASP CG 1 1 2 638 1 1 4 ASP H H -5.242 -2.205 3.614 1.00 . A A . 4 ASP H 1 1 2 639 1 1 4 ASP HA H -3.662 -2.617 1.358 1.00 . A A . 4 ASP HA 1 1 2 640 1 1 4 ASP HB2 H -3.230 -4.941 2.329 1.00 . A A . 4 ASP HB2 1 1 2 641 1 1 4 ASP HB3 H -2.969 -3.600 3.445 1.00 . A A . 4 ASP HB3 1 1 2 642 1 1 4 ASP N N -5.310 -2.283 2.640 1.00 . A A . 4 ASP N 1 1 2 643 1 1 4 ASP O O -6.437 -4.125 1.058 1.00 . A A . 4 ASP O 1 1 2 644 1 1 4 ASP OD1 O -5.805 -5.115 3.371 1.00 . A A . 4 ASP OD1 1 1 2 645 1 1 4 ASP OD2 O -4.462 -4.784 5.023 1.00 . A A . 4 ASP OD2 1 1 2 646 1 1 5 TRP C C -4.566 -6.458 -1.665 1.00 . A A . 5 TRP C 1 1 2 647 1 1 5 TRP CA C -5.453 -5.366 -1.069 1.00 . A A . 5 TRP CA 1 1 2 648 1 1 5 TRP CB C -5.992 -4.462 -2.178 1.00 . A A . 5 TRP CB 1 1 2 649 1 1 5 TRP CD1 C -7.471 -2.598 -1.357 1.00 . A A . 5 TRP CD1 1 1 2 650 1 1 5 TRP CD2 C -8.569 -4.549 -1.510 1.00 . A A . 5 TRP CD2 1 1 2 651 1 1 5 TRP CE2 C -9.505 -3.591 -1.043 1.00 . A A . 5 TRP CE2 1 1 2 652 1 1 5 TRP CE3 C -9.006 -5.870 -1.696 1.00 . A A . 5 TRP CE3 1 1 2 653 1 1 5 TRP CG C -7.286 -3.888 -1.703 1.00 . A A . 5 TRP CG 1 1 2 654 1 1 5 TRP CH2 C -11.245 -5.263 -0.959 1.00 . A A . 5 TRP CH2 1 1 2 655 1 1 5 TRP CZ2 C -10.830 -3.940 -0.768 1.00 . A A . 5 TRP CZ2 1 1 2 656 1 1 5 TRP CZ3 C -10.334 -6.222 -1.422 1.00 . A A . 5 TRP CZ3 1 1 2 657 1 1 5 TRP H H -3.665 -4.482 -0.231 1.00 . A A . 5 TRP H 1 1 2 658 1 1 5 TRP HA H -6.282 -5.824 -0.536 1.00 . A A . 5 TRP HA 1 1 2 659 1 1 5 TRP HB2 H -5.286 -3.670 -2.378 1.00 . A A . 5 TRP HB2 1 1 2 660 1 1 5 TRP HB3 H -6.163 -5.039 -3.074 1.00 . A A . 5 TRP HB3 1 1 2 661 1 1 5 TRP HD1 H -6.707 -1.840 -1.387 1.00 . A A . 5 TRP HD1 1 1 2 662 1 1 5 TRP HE1 H -9.174 -1.568 -0.668 1.00 . A A . 5 TRP HE1 1 1 2 663 1 1 5 TRP HE3 H -8.310 -6.614 -2.051 1.00 . A A . 5 TRP HE3 1 1 2 664 1 1 5 TRP HH2 H -12.266 -5.545 -0.751 1.00 . A A . 5 TRP HH2 1 1 2 665 1 1 5 TRP HZ2 H -11.527 -3.196 -0.413 1.00 . A A . 5 TRP HZ2 1 1 2 666 1 1 5 TRP HZ3 H -10.659 -7.241 -1.566 1.00 . A A . 5 TRP HZ3 1 1 2 667 1 1 5 TRP N N -4.637 -4.574 -0.106 1.00 . A A . 5 TRP N 1 1 2 668 1 1 5 TRP NE1 N -8.784 -2.416 -0.966 1.00 . A A . 5 TRP NE1 1 1 2 669 1 1 5 TRP O O -5.036 -7.542 -1.946 1.00 . A A . 5 TRP O 1 1 2 670 1 1 6 PHE C C -2.081 -8.076 -1.174 1.00 . A A . 6 PHE C 1 1 2 671 1 1 6 PHE CA C -2.469 -7.305 -2.434 1.00 . A A . 6 PHE CA 1 1 2 672 1 1 6 PHE CB C -1.180 -6.696 -2.966 1.00 . A A . 6 PHE CB 1 1 2 673 1 1 6 PHE CD1 C -2.737 -5.631 -4.634 1.00 . A A . 6 PHE CD1 1 1 2 674 1 1 6 PHE CD2 C -0.429 -4.899 -4.500 1.00 . A A . 6 PHE CD2 1 1 2 675 1 1 6 PHE CE1 C -2.965 -4.711 -5.651 1.00 . A A . 6 PHE CE1 1 1 2 676 1 1 6 PHE CE2 C -0.649 -3.980 -5.514 1.00 . A A . 6 PHE CE2 1 1 2 677 1 1 6 PHE CG C -1.467 -5.719 -4.064 1.00 . A A . 6 PHE CG 1 1 2 678 1 1 6 PHE CZ C -1.921 -3.889 -6.087 1.00 . A A . 6 PHE CZ 1 1 2 679 1 1 6 PHE H H -2.856 -5.366 -1.654 1.00 . A A . 6 PHE H 1 1 2 680 1 1 6 PHE HA H -3.015 -7.847 -3.188 1.00 . A A . 6 PHE HA 1 1 2 681 1 1 6 PHE HB2 H -0.700 -6.159 -2.166 1.00 . A A . 6 PHE HB2 1 1 2 682 1 1 6 PHE HB3 H -0.530 -7.471 -3.336 1.00 . A A . 6 PHE HB3 1 1 2 683 1 1 6 PHE HD1 H -3.540 -6.263 -4.300 1.00 . A A . 6 PHE HD1 1 1 2 684 1 1 6 PHE HD2 H 0.548 -4.968 -4.061 1.00 . A A . 6 PHE HD2 1 1 2 685 1 1 6 PHE HE1 H -3.948 -4.648 -6.088 1.00 . A A . 6 PHE HE1 1 1 2 686 1 1 6 PHE HE2 H 0.174 -3.360 -5.828 1.00 . A A . 6 PHE HE2 1 1 2 687 1 1 6 PHE HZ H -2.102 -3.183 -6.869 1.00 . A A . 6 PHE HZ 1 1 2 688 1 1 6 PHE N N -3.294 -6.219 -1.863 1.00 . A A . 6 PHE N 1 1 2 689 1 1 6 PHE O O -2.889 -8.227 -0.279 1.00 . A A . 6 PHE O 1 1 2 690 1 1 7 LYS C C -0.272 -8.140 1.171 1.00 . A A . 7 LYS C 1 1 2 691 1 1 7 LYS CA C -0.559 -9.285 0.198 1.00 . A A . 7 LYS CA 1 1 2 692 1 1 7 LYS CB C 0.692 -10.148 0.012 1.00 . A A . 7 LYS CB 1 1 2 693 1 1 7 LYS CD C 0.552 -12.648 0.013 1.00 . A A . 7 LYS CD 1 1 2 694 1 1 7 LYS CE C 1.012 -13.859 0.827 1.00 . A A . 7 LYS CE 1 1 2 695 1 1 7 LYS CG C 0.589 -11.396 0.893 1.00 . A A . 7 LYS CG 1 1 2 696 1 1 7 LYS H H -0.204 -8.445 -1.756 1.00 . A A . 7 LYS H 1 1 2 697 1 1 7 LYS HA H -1.415 -9.857 0.531 1.00 . A A . 7 LYS HA 1 1 2 698 1 1 7 LYS HB2 H 0.774 -10.442 -1.025 1.00 . A A . 7 LYS HB2 1 1 2 699 1 1 7 LYS HB3 H 1.566 -9.584 0.299 1.00 . A A . 7 LYS HB3 1 1 2 700 1 1 7 LYS HD2 H -0.456 -12.809 -0.339 1.00 . A A . 7 LYS HD2 1 1 2 701 1 1 7 LYS HD3 H 1.214 -12.516 -0.830 1.00 . A A . 7 LYS HD3 1 1 2 702 1 1 7 LYS HE2 H 0.762 -14.766 0.295 1.00 . A A . 7 LYS HE2 1 1 2 703 1 1 7 LYS HE3 H 2.080 -13.811 0.973 1.00 . A A . 7 LYS HE3 1 1 2 704 1 1 7 LYS HG2 H 1.444 -11.440 1.551 1.00 . A A . 7 LYS HG2 1 1 2 705 1 1 7 LYS HG3 H -0.317 -11.349 1.479 1.00 . A A . 7 LYS HG3 1 1 2 706 1 1 7 LYS HZ1 H -0.524 -13.263 2.102 1.00 . A A . 7 LYS HZ1 1 1 2 707 1 1 7 LYS HZ2 H 0.059 -14.832 2.401 1.00 . A A . 7 LYS HZ2 1 1 2 708 1 1 7 LYS HZ3 H 0.968 -13.476 2.874 1.00 . A A . 7 LYS HZ3 1 1 2 709 1 1 7 LYS N N -0.879 -8.560 -1.056 1.00 . A A . 7 LYS N 1 1 2 710 1 1 7 LYS NZ N 0.327 -13.858 2.151 1.00 . A A . 7 LYS NZ 1 1 2 711 1 1 7 LYS O O 0.223 -7.111 0.759 1.00 . A A . 7 LYS O 1 1 2 712 1 1 8 GLU C C 1.203 -6.677 3.179 1.00 . A A . 8 GLU C 1 1 2 713 1 1 8 GLU CA C -0.256 -7.103 3.337 1.00 . A A . 8 GLU CA 1 1 2 714 1 1 8 GLU CB C -0.536 -7.489 4.791 1.00 . A A . 8 GLU CB 1 1 2 715 1 1 8 GLU CD C -2.472 -8.503 6.007 1.00 . A A . 8 GLU CD 1 1 2 716 1 1 8 GLU CG C -2.035 -7.372 5.074 1.00 . A A . 8 GLU CG 1 1 2 717 1 1 8 GLU H H -0.958 -9.076 2.789 1.00 . A A . 8 GLU H 1 1 2 718 1 1 8 GLU HA H -0.867 -6.254 3.067 1.00 . A A . 8 GLU HA 1 1 2 719 1 1 8 GLU HB2 H -0.215 -8.507 4.961 1.00 . A A . 8 GLU HB2 1 1 2 720 1 1 8 GLU HB3 H 0.001 -6.826 5.453 1.00 . A A . 8 GLU HB3 1 1 2 721 1 1 8 GLU HG2 H -2.239 -6.418 5.538 1.00 . A A . 8 GLU HG2 1 1 2 722 1 1 8 GLU HG3 H -2.584 -7.447 4.146 1.00 . A A . 8 GLU HG3 1 1 2 723 1 1 8 GLU N N -0.556 -8.255 2.438 1.00 . A A . 8 GLU N 1 1 2 724 1 1 8 GLU O O 1.576 -5.593 3.583 1.00 . A A . 8 GLU O 1 1 2 725 1 1 8 GLU OE1 O -2.166 -9.644 5.706 1.00 . A A . 8 GLU OE1 1 1 2 726 1 1 8 GLU OE2 O -3.104 -8.208 7.008 1.00 . A A . 8 GLU OE2 1 1 2 727 1 1 9 THR C C 3.678 -6.378 1.110 1.00 . A A . 9 THR C 1 1 2 728 1 1 9 THR CA C 3.456 -7.054 2.462 1.00 . A A . 9 THR CA 1 1 2 729 1 1 9 THR CB C 4.362 -8.251 2.724 1.00 . A A . 9 THR CB 1 1 2 730 1 1 9 THR CG2 C 4.428 -8.387 4.245 1.00 . A A . 9 THR CG2 1 1 2 731 1 1 9 THR H H 1.768 -8.369 2.271 1.00 . A A . 9 THR H 1 1 2 732 1 1 9 THR HA H 3.635 -6.306 3.223 1.00 . A A . 9 THR HA 1 1 2 733 1 1 9 THR HB H 5.355 -8.066 2.349 1.00 . A A . 9 THR HB 1 1 2 734 1 1 9 THR HG1 H 3.511 -9.174 1.236 1.00 . A A . 9 THR HG1 1 1 2 735 1 1 9 THR HG21 H 3.755 -7.660 4.686 1.00 . A A . 9 THR HG21 1 1 2 736 1 1 9 THR HG22 H 4.122 -9.380 4.534 1.00 . A A . 9 THR HG22 1 1 2 737 1 1 9 THR HG23 H 5.435 -8.197 4.585 1.00 . A A . 9 THR HG23 1 1 2 738 1 1 9 THR N N 2.045 -7.491 2.604 1.00 . A A . 9 THR N 1 1 2 739 1 1 9 THR O O 4.542 -5.535 1.007 1.00 . A A . 9 THR O 1 1 2 740 1 1 9 THR OG1 O 3.801 -9.410 2.120 1.00 . A A . 9 THR OG1 1 1 2 741 1 1 10 ALA C C 3.059 -4.567 -0.848 1.00 . A A . 10 ALA C 1 1 2 742 1 1 10 ALA CA C 3.136 -6.040 -1.227 1.00 . A A . 10 ALA CA 1 1 2 743 1 1 10 ALA CB C 1.959 -6.311 -2.169 1.00 . A A . 10 ALA CB 1 1 2 744 1 1 10 ALA H H 2.229 -7.391 0.200 1.00 . A A . 10 ALA H 1 1 2 745 1 1 10 ALA HA H 4.092 -6.270 -1.668 1.00 . A A . 10 ALA HA 1 1 2 746 1 1 10 ALA HB1 H 1.046 -6.276 -1.592 1.00 . A A . 10 ALA HB1 1 1 2 747 1 1 10 ALA HB2 H 1.916 -5.550 -2.938 1.00 . A A . 10 ALA HB2 1 1 2 748 1 1 10 ALA HB3 H 2.057 -7.285 -2.624 1.00 . A A . 10 ALA HB3 1 1 2 749 1 1 10 ALA N N 2.927 -6.713 0.092 1.00 . A A . 10 ALA N 1 1 2 750 1 1 10 ALA O O 3.822 -3.719 -1.267 1.00 . A A . 10 ALA O 1 1 2 751 1 1 11 CYS C C 3.137 -2.470 1.100 1.00 . A A . 11 CYS C 1 1 2 752 1 1 11 CYS CA C 1.817 -2.959 0.497 1.00 . A A . 11 CYS CA 1 1 2 753 1 1 11 CYS CB C 0.697 -3.152 1.529 1.00 . A A . 11 CYS CB 1 1 2 754 1 1 11 CYS H H 1.512 -5.055 0.281 1.00 . A A . 11 CYS H 1 1 2 755 1 1 11 CYS HA H 1.501 -2.306 -0.301 1.00 . A A . 11 CYS HA 1 1 2 756 1 1 11 CYS HB2 H 1.025 -3.794 2.335 1.00 . A A . 11 CYS HB2 1 1 2 757 1 1 11 CYS HB3 H 0.372 -2.201 1.915 1.00 . A A . 11 CYS HB3 1 1 2 758 1 1 11 CYS N N 2.086 -4.320 -0.019 1.00 . A A . 11 CYS N 1 1 2 759 1 1 11 CYS O O 3.795 -1.597 0.567 1.00 . A A . 11 CYS O 1 1 2 760 1 1 11 CYS SG S -0.702 -3.948 0.701 1.00 . A A . 11 CYS SG 1 1 2 761 1 1 12 ARG C C 5.908 -2.462 1.944 1.00 . A A . 12 ARG C 1 1 2 762 1 1 12 ARG CA C 4.770 -2.697 2.928 1.00 . A A . 12 ARG CA 1 1 2 763 1 1 12 ARG CB C 5.165 -3.831 3.876 1.00 . A A . 12 ARG CB 1 1 2 764 1 1 12 ARG CD C 6.973 -4.327 5.536 1.00 . A A . 12 ARG CD 1 1 2 765 1 1 12 ARG CG C 6.049 -3.244 4.977 1.00 . A A . 12 ARG CG 1 1 2 766 1 1 12 ARG CZ C 7.255 -3.755 7.873 1.00 . A A . 12 ARG CZ 1 1 2 767 1 1 12 ARG H H 2.933 -3.740 2.571 1.00 . A A . 12 ARG H 1 1 2 768 1 1 12 ARG HA H 4.646 -1.793 3.501 1.00 . A A . 12 ARG HA 1 1 2 769 1 1 12 ARG HB2 H 4.276 -4.270 4.307 1.00 . A A . 12 ARG HB2 1 1 2 770 1 1 12 ARG HB3 H 5.723 -4.582 3.338 1.00 . A A . 12 ARG HB3 1 1 2 771 1 1 12 ARG HD2 H 6.804 -5.253 5.008 1.00 . A A . 12 ARG HD2 1 1 2 772 1 1 12 ARG HD3 H 8.002 -4.023 5.411 1.00 . A A . 12 ARG HD3 1 1 2 773 1 1 12 ARG HE H 6.071 -5.230 7.272 1.00 . A A . 12 ARG HE 1 1 2 774 1 1 12 ARG HG2 H 6.638 -2.437 4.562 1.00 . A A . 12 ARG HG2 1 1 2 775 1 1 12 ARG HG3 H 5.421 -2.864 5.769 1.00 . A A . 12 ARG HG3 1 1 2 776 1 1 12 ARG HH11 H 5.960 -2.249 7.621 1.00 . A A . 12 ARG HH11 1 1 2 777 1 1 12 ARG HH12 H 7.203 -1.979 8.797 1.00 . A A . 12 ARG HH12 1 1 2 778 1 1 12 ARG HH21 H 8.682 -5.081 8.333 1.00 . A A . 12 ARG HH21 1 1 2 779 1 1 12 ARG HH22 H 8.746 -3.583 9.200 1.00 . A A . 12 ARG HH22 1 1 2 780 1 1 12 ARG N N 3.511 -3.046 2.207 1.00 . A A . 12 ARG N 1 1 2 781 1 1 12 ARG NE N 6.687 -4.524 6.986 1.00 . A A . 12 ARG NE 1 1 2 782 1 1 12 ARG NH1 N 6.768 -2.568 8.116 1.00 . A A . 12 ARG NH1 1 1 2 783 1 1 12 ARG NH2 N 8.310 -4.172 8.519 1.00 . A A . 12 ARG NH2 1 1 2 784 1 1 12 ARG O O 6.849 -1.757 2.247 1.00 . A A . 12 ARG O 1 1 2 785 1 1 13 HIS C C 6.833 -1.263 -0.394 1.00 . A A . 13 HIS C 1 1 2 786 1 1 13 HIS CA C 6.974 -2.762 -0.157 1.00 . A A . 13 HIS CA 1 1 2 787 1 1 13 HIS CB C 6.758 -3.545 -1.456 1.00 . A A . 13 HIS CB 1 1 2 788 1 1 13 HIS CD2 C 9.133 -4.679 -1.409 1.00 . A A . 13 HIS CD2 1 1 2 789 1 1 13 HIS CE1 C 9.651 -4.391 -3.494 1.00 . A A . 13 HIS CE1 1 1 2 790 1 1 13 HIS CG C 8.075 -4.028 -1.998 1.00 . A A . 13 HIS CG 1 1 2 791 1 1 13 HIS H H 5.102 -3.589 0.505 1.00 . A A . 13 HIS H 1 1 2 792 1 1 13 HIS HA H 7.920 -2.986 0.318 1.00 . A A . 13 HIS HA 1 1 2 793 1 1 13 HIS HB2 H 6.124 -4.395 -1.257 1.00 . A A . 13 HIS HB2 1 1 2 794 1 1 13 HIS HB3 H 6.281 -2.912 -2.189 1.00 . A A . 13 HIS HB3 1 1 2 795 1 1 13 HIS HD1 H 7.888 -3.421 -4.019 1.00 . A A . 13 HIS HD1 1 1 2 796 1 1 13 HIS HD2 H 9.184 -4.969 -0.370 1.00 . A A . 13 HIS HD2 1 1 2 797 1 1 13 HIS HE1 H 10.183 -4.402 -4.434 1.00 . A A . 13 HIS HE1 1 1 2 798 1 1 13 HIS N N 5.851 -3.023 0.771 1.00 . A A . 13 HIS N 1 1 2 799 1 1 13 HIS ND1 N 8.431 -3.856 -3.326 1.00 . A A . 13 HIS ND1 1 1 2 800 1 1 13 HIS NE2 N 10.127 -4.907 -2.359 1.00 . A A . 13 HIS NE2 1 1 2 801 1 1 13 HIS O O 7.614 -0.459 0.064 1.00 . A A . 13 HIS O 1 1 2 802 1 1 14 ALA C C 5.817 1.461 -0.218 1.00 . A A . 14 ALA C 1 1 2 803 1 1 14 ALA CA C 5.562 0.540 -1.416 1.00 . A A . 14 ALA CA 1 1 2 804 1 1 14 ALA CB C 4.118 0.668 -1.899 1.00 . A A . 14 ALA CB 1 1 2 805 1 1 14 ALA H H 5.200 -1.584 -1.461 1.00 . A A . 14 ALA H 1 1 2 806 1 1 14 ALA HA H 6.212 0.860 -2.214 1.00 . A A . 14 ALA HA 1 1 2 807 1 1 14 ALA HB1 H 3.968 0.007 -2.740 1.00 . A A . 14 ALA HB1 1 1 2 808 1 1 14 ALA HB2 H 3.456 0.377 -1.092 1.00 . A A . 14 ALA HB2 1 1 2 809 1 1 14 ALA HB3 H 3.925 1.687 -2.208 1.00 . A A . 14 ALA HB3 1 1 2 810 1 1 14 ALA N N 5.813 -0.898 -1.115 1.00 . A A . 14 ALA N 1 1 2 811 1 1 14 ALA O O 6.231 2.588 -0.404 1.00 . A A . 14 ALA O 1 1 2 812 1 1 15 LYS C C 7.368 2.074 2.402 1.00 . A A . 15 LYS C 1 1 2 813 1 1 15 LYS CA C 5.861 1.993 2.120 1.00 . A A . 15 LYS CA 1 1 2 814 1 1 15 LYS CB C 5.118 1.544 3.385 1.00 . A A . 15 LYS CB 1 1 2 815 1 1 15 LYS CD C 5.272 1.331 5.885 1.00 . A A . 15 LYS CD 1 1 2 816 1 1 15 LYS CE C 6.216 0.487 6.744 1.00 . A A . 15 LYS CE 1 1 2 817 1 1 15 LYS CG C 5.999 1.783 4.616 1.00 . A A . 15 LYS CG 1 1 2 818 1 1 15 LYS H H 5.259 0.144 1.176 1.00 . A A . 15 LYS H 1 1 2 819 1 1 15 LYS HA H 5.497 2.978 1.834 1.00 . A A . 15 LYS HA 1 1 2 820 1 1 15 LYS HB2 H 4.198 2.107 3.477 1.00 . A A . 15 LYS HB2 1 1 2 821 1 1 15 LYS HB3 H 4.876 0.494 3.325 1.00 . A A . 15 LYS HB3 1 1 2 822 1 1 15 LYS HD2 H 4.951 2.198 6.444 1.00 . A A . 15 LYS HD2 1 1 2 823 1 1 15 LYS HD3 H 4.413 0.735 5.615 1.00 . A A . 15 LYS HD3 1 1 2 824 1 1 15 LYS HE2 H 5.639 -0.089 7.453 1.00 . A A . 15 LYS HE2 1 1 2 825 1 1 15 LYS HE3 H 6.777 -0.182 6.110 1.00 . A A . 15 LYS HE3 1 1 2 826 1 1 15 LYS HG2 H 6.910 1.209 4.520 1.00 . A A . 15 LYS HG2 1 1 2 827 1 1 15 LYS HG3 H 6.232 2.832 4.697 1.00 . A A . 15 LYS HG3 1 1 2 828 1 1 15 LYS HZ1 H 7.238 2.285 6.980 1.00 . A A . 15 LYS HZ1 1 1 2 829 1 1 15 LYS HZ2 H 6.799 1.542 8.444 1.00 . A A . 15 LYS HZ2 1 1 2 830 1 1 15 LYS HZ3 H 8.090 0.926 7.539 1.00 . A A . 15 LYS HZ3 1 1 2 831 1 1 15 LYS N N 5.593 1.047 1.000 1.00 . A A . 15 LYS N 1 1 2 832 1 1 15 LYS NZ N 7.156 1.378 7.482 1.00 . A A . 15 LYS NZ 1 1 2 833 1 1 15 LYS O O 7.865 3.145 2.691 1.00 . A A . 15 LYS O 1 1 2 834 1 1 16 SER C C 10.462 1.335 1.388 1.00 . A A . 16 SER C 1 1 2 835 1 1 16 SER CA C 9.587 1.156 2.634 1.00 . A A . 16 SER CA 1 1 2 836 1 1 16 SER CB C 10.073 -0.053 3.433 1.00 . A A . 16 SER CB 1 1 2 837 1 1 16 SER H H 7.780 0.117 2.119 1.00 . A A . 16 SER H 1 1 2 838 1 1 16 SER HA H 9.716 2.029 3.253 1.00 . A A . 16 SER HA 1 1 2 839 1 1 16 SER HB2 H 9.815 -0.964 2.917 1.00 . A A . 16 SER HB2 1 1 2 840 1 1 16 SER HB3 H 11.148 -0.001 3.536 1.00 . A A . 16 SER HB3 1 1 2 841 1 1 16 SER HG H 9.844 -0.734 5.241 1.00 . A A . 16 SER HG 1 1 2 842 1 1 16 SER N N 8.132 1.006 2.342 1.00 . A A . 16 SER N 1 1 2 843 1 1 16 SER O O 11.652 1.541 1.516 1.00 . A A . 16 SER O 1 1 2 844 1 1 16 SER OG O 9.435 -0.052 4.703 1.00 . A A . 16 SER OG 1 1 2 845 1 1 17 LEU C C 10.824 2.944 -1.302 1.00 . A A . 17 LEU C 1 1 2 846 1 1 17 LEU CA C 10.853 1.462 -0.972 1.00 . A A . 17 LEU CA 1 1 2 847 1 1 17 LEU CB C 10.358 0.866 -2.289 1.00 . A A . 17 LEU CB 1 1 2 848 1 1 17 LEU CD1 C 8.246 -0.057 -2.882 1.00 . A A . 17 LEU CD1 1 1 2 849 1 1 17 LEU CD2 C 10.259 -1.546 -2.819 1.00 . A A . 17 LEU CD2 1 1 2 850 1 1 17 LEU CG C 9.529 -0.394 -2.127 1.00 . A A . 17 LEU CG 1 1 2 851 1 1 17 LEU H H 8.987 1.113 0.064 1.00 . A A . 17 LEU H 1 1 2 852 1 1 17 LEU HA H 11.855 1.125 -0.753 1.00 . A A . 17 LEU HA 1 1 2 853 1 1 17 LEU HB2 H 9.701 1.589 -2.754 1.00 . A A . 17 LEU HB2 1 1 2 854 1 1 17 LEU HB3 H 11.195 0.666 -2.940 1.00 . A A . 17 LEU HB3 1 1 2 855 1 1 17 LEU HD11 H 7.984 0.976 -2.678 1.00 . A A . 17 LEU HD11 1 1 2 856 1 1 17 LEU HD12 H 8.429 -0.164 -3.941 1.00 . A A . 17 LEU HD12 1 1 2 857 1 1 17 LEU HD13 H 7.443 -0.711 -2.582 1.00 . A A . 17 LEU HD13 1 1 2 858 1 1 17 LEU HD21 H 11.314 -1.319 -2.861 1.00 . A A . 17 LEU HD21 1 1 2 859 1 1 17 LEU HD22 H 10.105 -2.456 -2.259 1.00 . A A . 17 LEU HD22 1 1 2 860 1 1 17 LEU HD23 H 9.874 -1.664 -3.821 1.00 . A A . 17 LEU HD23 1 1 2 861 1 1 17 LEU HG H 9.346 -0.587 -1.082 1.00 . A A . 17 LEU HG 1 1 2 862 1 1 17 LEU N N 9.943 1.273 0.194 1.00 . A A . 17 LEU N 1 1 2 863 1 1 17 LEU O O 11.825 3.631 -1.355 1.00 . A A . 17 LEU O 1 1 2 864 1 1 18 GLY C C 8.120 5.165 -2.457 1.00 . A A . 18 GLY C 1 1 2 865 1 1 18 GLY CA C 9.490 4.846 -1.865 1.00 . A A . 18 GLY CA 1 1 2 866 1 1 18 GLY H H 8.845 2.826 -1.480 1.00 . A A . 18 GLY H 1 1 2 867 1 1 18 GLY HA2 H 9.655 5.437 -0.981 1.00 . A A . 18 GLY HA2 1 1 2 868 1 1 18 GLY HA3 H 10.247 5.050 -2.605 1.00 . A A . 18 GLY HA3 1 1 2 869 1 1 18 GLY N N 9.629 3.411 -1.528 1.00 . A A . 18 GLY N 1 1 2 870 1 1 18 GLY O O 7.653 6.284 -2.364 1.00 . A A . 18 GLY O 1 1 2 871 1 1 19 ASN C C 5.281 5.265 -2.587 1.00 . A A . 19 ASN C 1 1 2 872 1 1 19 ASN CA C 6.134 4.551 -3.636 1.00 . A A . 19 ASN CA 1 1 2 873 1 1 19 ASN CB C 5.449 3.313 -4.240 1.00 . A A . 19 ASN CB 1 1 2 874 1 1 19 ASN CG C 6.432 2.224 -4.674 1.00 . A A . 19 ASN CG 1 1 2 875 1 1 19 ASN H H 7.811 3.319 -3.156 1.00 . A A . 19 ASN H 1 1 2 876 1 1 19 ASN HA H 6.316 5.275 -4.420 1.00 . A A . 19 ASN HA 1 1 2 877 1 1 19 ASN HB2 H 4.685 2.881 -3.618 1.00 . A A . 19 ASN HB2 1 1 2 878 1 1 19 ASN HB3 H 4.947 3.651 -5.119 1.00 . A A . 19 ASN HB3 1 1 2 879 1 1 19 ASN HD21 H 5.335 0.759 -3.910 1.00 . A A . 19 ASN HD21 1 1 2 880 1 1 19 ASN HD22 H 6.770 0.266 -4.669 1.00 . A A . 19 ASN HD22 1 1 2 881 1 1 19 ASN N N 7.458 4.221 -3.066 1.00 . A A . 19 ASN N 1 1 2 882 1 1 19 ASN ND2 N 6.159 0.980 -4.395 1.00 . A A . 19 ASN ND2 1 1 2 883 1 1 19 ASN O O 5.168 6.472 -2.656 1.00 . A A . 19 ASN O 1 1 2 884 1 1 19 ASN OD1 O 7.452 2.508 -5.271 1.00 . A A . 19 ASN OD1 1 1 2 885 1 1 20 CYS C C 3.084 6.454 -1.168 1.00 . A A . 20 CYS C 1 1 2 886 1 1 20 CYS CA C 3.853 5.252 -0.600 1.00 . A A . 20 CYS CA 1 1 2 887 1 1 20 CYS CB C 4.743 5.723 0.550 1.00 . A A . 20 CYS CB 1 1 2 888 1 1 20 CYS H H 4.808 3.608 -1.598 1.00 . A A . 20 CYS H 1 1 2 889 1 1 20 CYS HA H 3.144 4.538 -0.211 1.00 . A A . 20 CYS HA 1 1 2 890 1 1 20 CYS HB2 H 5.567 5.035 0.662 1.00 . A A . 20 CYS HB2 1 1 2 891 1 1 20 CYS HB3 H 5.117 6.707 0.316 1.00 . A A . 20 CYS HB3 1 1 2 892 1 1 20 CYS N N 4.694 4.581 -1.638 1.00 . A A . 20 CYS N 1 1 2 893 1 1 20 CYS O O 2.801 7.379 -0.434 1.00 . A A . 20 CYS O 1 1 2 894 1 1 20 CYS SG S 3.818 5.777 2.107 1.00 . A A . 20 CYS SG 1 1 2 895 1 1 21 ARG C C 2.400 7.703 -4.598 1.00 . A A . 21 ARG C 1 1 2 896 1 1 21 ARG CA C 2.010 7.539 -3.122 1.00 . A A . 21 ARG CA 1 1 2 897 1 1 21 ARG CB C 2.269 8.879 -2.445 1.00 . A A . 21 ARG CB 1 1 2 898 1 1 21 ARG CD C 0.771 10.681 -1.490 1.00 . A A . 21 ARG CD 1 1 2 899 1 1 21 ARG CG C 1.083 9.181 -1.524 1.00 . A A . 21 ARG CG 1 1 2 900 1 1 21 ARG CZ C 1.411 12.526 -2.917 1.00 . A A . 21 ARG CZ 1 1 2 901 1 1 21 ARG H H 3.017 5.666 -2.965 1.00 . A A . 21 ARG H 1 1 2 902 1 1 21 ARG HA H 0.952 7.340 -3.067 1.00 . A A . 21 ARG HA 1 1 2 903 1 1 21 ARG HB2 H 3.196 8.803 -1.899 1.00 . A A . 21 ARG HB2 1 1 2 904 1 1 21 ARG HB3 H 2.356 9.643 -3.200 1.00 . A A . 21 ARG HB3 1 1 2 905 1 1 21 ARG HD2 H -0.256 10.822 -1.188 1.00 . A A . 21 ARG HD2 1 1 2 906 1 1 21 ARG HD3 H 1.418 11.159 -0.770 1.00 . A A . 21 ARG HD3 1 1 2 907 1 1 21 ARG HE H 0.772 10.792 -3.643 1.00 . A A . 21 ARG HE 1 1 2 908 1 1 21 ARG HG2 H 0.217 8.642 -1.883 1.00 . A A . 21 ARG HG2 1 1 2 909 1 1 21 ARG HG3 H 1.306 8.842 -0.524 1.00 . A A . 21 ARG HG3 1 1 2 910 1 1 21 ARG HH11 H 2.791 12.291 -1.486 1.00 . A A . 21 ARG HH11 1 1 2 911 1 1 21 ARG HH12 H 2.723 13.864 -2.210 1.00 . A A . 21 ARG HH12 1 1 2 912 1 1 21 ARG HH21 H 0.133 13.046 -4.368 1.00 . A A . 21 ARG HH21 1 1 2 913 1 1 21 ARG HH22 H 1.217 14.290 -3.841 1.00 . A A . 21 ARG HH22 1 1 2 914 1 1 21 ARG N N 2.757 6.440 -2.438 1.00 . A A . 21 ARG N 1 1 2 915 1 1 21 ARG NE N 0.970 11.301 -2.830 1.00 . A A . 21 ARG NE 1 1 2 916 1 1 21 ARG NH1 N 2.384 12.924 -2.144 1.00 . A A . 21 ARG NH1 1 1 2 917 1 1 21 ARG NH2 N 0.879 13.352 -3.775 1.00 . A A . 21 ARG NH2 1 1 2 918 1 1 21 ARG O O 1.661 8.299 -5.356 1.00 . A A . 21 ARG O 1 1 2 919 1 1 22 THR C C 3.365 6.174 -7.265 1.00 . A A . 22 THR C 1 1 2 920 1 1 22 THR CA C 3.888 7.372 -6.475 1.00 . A A . 22 THR CA 1 1 2 921 1 1 22 THR CB C 5.410 7.449 -6.607 1.00 . A A . 22 THR CB 1 1 2 922 1 1 22 THR CG2 C 5.986 8.294 -5.470 1.00 . A A . 22 THR CG2 1 1 2 923 1 1 22 THR H H 4.129 6.722 -4.446 1.00 . A A . 22 THR H 1 1 2 924 1 1 22 THR HA H 3.444 8.279 -6.858 1.00 . A A . 22 THR HA 1 1 2 925 1 1 22 THR HB H 5.671 7.910 -7.548 1.00 . A A . 22 THR HB 1 1 2 926 1 1 22 THR HG1 H 5.728 5.689 -7.372 1.00 . A A . 22 THR HG1 1 1 2 927 1 1 22 THR HG21 H 5.345 9.146 -5.295 1.00 . A A . 22 THR HG21 1 1 2 928 1 1 22 THR HG22 H 6.045 7.697 -4.571 1.00 . A A . 22 THR HG22 1 1 2 929 1 1 22 THR HG23 H 6.974 8.637 -5.739 1.00 . A A . 22 THR HG23 1 1 2 930 1 1 22 THR N N 3.522 7.205 -5.041 1.00 . A A . 22 THR N 1 1 2 931 1 1 22 THR O O 3.665 6.005 -8.431 1.00 . A A . 22 THR O 1 1 2 932 1 1 22 THR OG1 O 5.951 6.136 -6.553 1.00 . A A . 22 THR OG1 1 1 2 933 1 1 23 SER C C 0.539 4.182 -7.029 1.00 . A A . 23 SER C 1 1 2 934 1 1 23 SER CA C 2.035 4.153 -7.339 1.00 . A A . 23 SER CA 1 1 2 935 1 1 23 SER CB C 2.794 2.947 -6.784 1.00 . A A . 23 SER CB 1 1 2 936 1 1 23 SER H H 2.341 5.477 -5.696 1.00 . A A . 23 SER H 1 1 2 937 1 1 23 SER HA H 2.170 4.251 -8.407 1.00 . A A . 23 SER HA 1 1 2 938 1 1 23 SER HB2 H 3.846 3.068 -6.986 1.00 . A A . 23 SER HB2 1 1 2 939 1 1 23 SER HB3 H 2.655 2.902 -5.713 1.00 . A A . 23 SER HB3 1 1 2 940 1 1 23 SER HG H 1.516 1.969 -7.878 1.00 . A A . 23 SER HG 1 1 2 941 1 1 23 SER N N 2.582 5.339 -6.639 1.00 . A A . 23 SER N 1 1 2 942 1 1 23 SER O O 0.142 4.535 -5.936 1.00 . A A . 23 SER O 1 1 2 943 1 1 23 SER OG O 2.337 1.764 -7.425 1.00 . A A . 23 SER OG 1 1 2 944 1 1 24 GLN C C -2.225 2.758 -6.727 1.00 . A A . 24 GLN C 1 1 2 945 1 1 24 GLN CA C -1.765 3.880 -7.656 1.00 . A A . 24 GLN CA 1 1 2 946 1 1 24 GLN CB C -2.571 3.856 -8.957 1.00 . A A . 24 GLN CB 1 1 2 947 1 1 24 GLN CD C -2.946 5.466 -10.832 1.00 . A A . 24 GLN CD 1 1 2 948 1 1 24 GLN CG C -1.886 4.743 -9.999 1.00 . A A . 24 GLN CG 1 1 2 949 1 1 24 GLN H H 0.007 3.558 -8.845 1.00 . A A . 24 GLN H 1 1 2 950 1 1 24 GLN HA H -1.962 4.817 -7.157 1.00 . A A . 24 GLN HA 1 1 2 951 1 1 24 GLN HB2 H -2.627 2.841 -9.324 1.00 . A A . 24 GLN HB2 1 1 2 952 1 1 24 GLN HB3 H -3.566 4.230 -8.772 1.00 . A A . 24 GLN HB3 1 1 2 953 1 1 24 GLN HE21 H -2.026 7.223 -10.737 1.00 . A A . 24 GLN HE21 1 1 2 954 1 1 24 GLN HE22 H -3.479 7.211 -11.615 1.00 . A A . 24 GLN HE22 1 1 2 955 1 1 24 GLN HG2 H -1.262 5.468 -9.497 1.00 . A A . 24 GLN HG2 1 1 2 956 1 1 24 GLN HG3 H -1.280 4.132 -10.650 1.00 . A A . 24 GLN HG3 1 1 2 957 1 1 24 GLN N N -0.307 3.836 -7.959 1.00 . A A . 24 GLN N 1 1 2 958 1 1 24 GLN NE2 N -2.806 6.739 -11.082 1.00 . A A . 24 GLN NE2 1 1 2 959 1 1 24 GLN O O -2.472 3.006 -5.567 1.00 . A A . 24 GLN O 1 1 2 960 1 1 24 GLN OE1 O -3.913 4.866 -11.260 1.00 . A A . 24 GLN OE1 1 1 2 961 1 1 25 LYS C C -1.933 0.565 -4.976 1.00 . A A . 25 LYS C 1 1 2 962 1 1 25 LYS CA C -2.806 0.490 -6.228 1.00 . A A . 25 LYS CA 1 1 2 963 1 1 25 LYS CB C -2.671 -0.888 -6.875 1.00 . A A . 25 LYS CB 1 1 2 964 1 1 25 LYS CD C -4.342 -2.536 -7.764 1.00 . A A . 25 LYS CD 1 1 2 965 1 1 25 LYS CE C -5.758 -3.071 -7.552 1.00 . A A . 25 LYS CE 1 1 2 966 1 1 25 LYS CG C -3.924 -1.705 -6.550 1.00 . A A . 25 LYS CG 1 1 2 967 1 1 25 LYS H H -2.154 1.336 -8.116 1.00 . A A . 25 LYS H 1 1 2 968 1 1 25 LYS HA H -3.836 0.672 -5.957 1.00 . A A . 25 LYS HA 1 1 2 969 1 1 25 LYS HB2 H -2.563 -0.768 -7.944 1.00 . A A . 25 LYS HB2 1 1 2 970 1 1 25 LYS HB3 H -1.802 -1.385 -6.472 1.00 . A A . 25 LYS HB3 1 1 2 971 1 1 25 LYS HD2 H -4.316 -1.916 -8.649 1.00 . A A . 25 LYS HD2 1 1 2 972 1 1 25 LYS HD3 H -3.664 -3.368 -7.885 1.00 . A A . 25 LYS HD3 1 1 2 973 1 1 25 LYS HE2 H -5.722 -4.140 -7.407 1.00 . A A . 25 LYS HE2 1 1 2 974 1 1 25 LYS HE3 H -6.192 -2.605 -6.678 1.00 . A A . 25 LYS HE3 1 1 2 975 1 1 25 LYS HG2 H -3.731 -2.353 -5.705 1.00 . A A . 25 LYS HG2 1 1 2 976 1 1 25 LYS HG3 H -4.726 -1.028 -6.291 1.00 . A A . 25 LYS HG3 1 1 2 977 1 1 25 LYS HZ1 H -6.499 -1.749 -8.978 1.00 . A A . 25 LYS HZ1 1 1 2 978 1 1 25 LYS HZ2 H -6.277 -3.334 -9.552 1.00 . A A . 25 LYS HZ2 1 1 2 979 1 1 25 LYS HZ3 H -7.589 -2.979 -8.543 1.00 . A A . 25 LYS HZ3 1 1 2 980 1 1 25 LYS N N -2.352 1.544 -7.179 1.00 . A A . 25 LYS N 1 1 2 981 1 1 25 LYS NZ N -6.594 -2.759 -8.746 1.00 . A A . 25 LYS NZ 1 1 2 982 1 1 25 LYS O O -2.389 0.627 -3.856 1.00 . A A . 25 LYS O 1 1 2 983 1 1 26 TYR C C -0.110 1.699 -3.015 1.00 . A A . 26 TYR C 1 1 2 984 1 1 26 TYR CA C 0.310 0.639 -4.040 1.00 . A A . 26 TYR CA 1 1 2 985 1 1 26 TYR CB C 1.599 1.066 -4.721 1.00 . A A . 26 TYR CB 1 1 2 986 1 1 26 TYR CD1 C 1.773 -1.416 -5.158 1.00 . A A . 26 TYR CD1 1 1 2 987 1 1 26 TYR CD2 C 3.739 -0.027 -5.418 1.00 . A A . 26 TYR CD2 1 1 2 988 1 1 26 TYR CE1 C 2.520 -2.536 -5.513 1.00 . A A . 26 TYR CE1 1 1 2 989 1 1 26 TYR CE2 C 4.490 -1.151 -5.776 1.00 . A A . 26 TYR CE2 1 1 2 990 1 1 26 TYR CG C 2.384 -0.159 -5.110 1.00 . A A . 26 TYR CG 1 1 2 991 1 1 26 TYR CZ C 3.880 -2.412 -5.823 1.00 . A A . 26 TYR CZ 1 1 2 992 1 1 26 TYR H H -0.309 0.517 -6.090 1.00 . A A . 26 TYR H 1 1 2 993 1 1 26 TYR HA H 0.480 -0.318 -3.568 1.00 . A A . 26 TYR HA 1 1 2 994 1 1 26 TYR HB2 H 1.311 1.610 -5.603 1.00 . A A . 26 TYR HB2 1 1 2 995 1 1 26 TYR HB3 H 2.182 1.695 -4.065 1.00 . A A . 26 TYR HB3 1 1 2 996 1 1 26 TYR HD1 H 0.725 -1.537 -4.925 1.00 . A A . 26 TYR HD1 1 1 2 997 1 1 26 TYR HD2 H 4.197 0.951 -5.379 1.00 . A A . 26 TYR HD2 1 1 2 998 1 1 26 TYR HE1 H 2.020 -3.489 -5.538 1.00 . A A . 26 TYR HE1 1 1 2 999 1 1 26 TYR HE2 H 5.539 -1.042 -6.011 1.00 . A A . 26 TYR HE2 1 1 2 1000 1 1 26 TYR HH H 4.101 -4.037 -6.801 1.00 . A A . 26 TYR HH 1 1 2 1001 1 1 26 TYR N N -0.652 0.564 -5.172 1.00 . A A . 26 TYR N 1 1 2 1002 1 1 26 TYR O O -0.293 1.415 -1.849 1.00 . A A . 26 TYR O 1 1 2 1003 1 1 26 TYR OH O 4.617 -3.525 -6.174 1.00 . A A . 26 TYR OH 1 1 2 1004 1 1 27 ARG C C -2.072 3.689 -1.879 1.00 . A A . 27 ARG C 1 1 2 1005 1 1 27 ARG CA C -0.671 3.973 -2.436 1.00 . A A . 27 ARG CA 1 1 2 1006 1 1 27 ARG CB C -0.571 5.353 -3.100 1.00 . A A . 27 ARG CB 1 1 2 1007 1 1 27 ARG CD C -1.793 7.281 -4.085 1.00 . A A . 27 ARG CD 1 1 2 1008 1 1 27 ARG CG C -1.917 5.822 -3.645 1.00 . A A . 27 ARG CG 1 1 2 1009 1 1 27 ARG CZ C -2.500 9.442 -3.249 1.00 . A A . 27 ARG CZ 1 1 2 1010 1 1 27 ARG H H -0.118 3.166 -4.359 1.00 . A A . 27 ARG H 1 1 2 1011 1 1 27 ARG HA H 0.024 3.931 -1.609 1.00 . A A . 27 ARG HA 1 1 2 1012 1 1 27 ARG HB2 H -0.230 6.080 -2.379 1.00 . A A . 27 ARG HB2 1 1 2 1013 1 1 27 ARG HB3 H 0.133 5.296 -3.919 1.00 . A A . 27 ARG HB3 1 1 2 1014 1 1 27 ARG HD2 H -0.754 7.576 -4.064 1.00 . A A . 27 ARG HD2 1 1 2 1015 1 1 27 ARG HD3 H -2.180 7.392 -5.087 1.00 . A A . 27 ARG HD3 1 1 2 1016 1 1 27 ARG HE H -3.142 7.732 -2.468 1.00 . A A . 27 ARG HE 1 1 2 1017 1 1 27 ARG HG2 H -2.169 5.212 -4.499 1.00 . A A . 27 ARG HG2 1 1 2 1018 1 1 27 ARG HG3 H -2.671 5.743 -2.875 1.00 . A A . 27 ARG HG3 1 1 2 1019 1 1 27 ARG HH11 H -0.530 9.446 -3.591 1.00 . A A . 27 ARG HH11 1 1 2 1020 1 1 27 ARG HH12 H -1.286 11.005 -3.559 1.00 . A A . 27 ARG HH12 1 1 2 1021 1 1 27 ARG HH21 H -4.454 9.737 -2.927 1.00 . A A . 27 ARG HH21 1 1 2 1022 1 1 27 ARG HH22 H -3.511 11.168 -3.182 1.00 . A A . 27 ARG HH22 1 1 2 1023 1 1 27 ARG N N -0.267 2.929 -3.420 1.00 . A A . 27 ARG N 1 1 2 1024 1 1 27 ARG NE N -2.574 8.143 -3.153 1.00 . A A . 27 ARG NE 1 1 2 1025 1 1 27 ARG NH1 N -1.349 10.009 -3.484 1.00 . A A . 27 ARG NH1 1 1 2 1026 1 1 27 ARG NH2 N -3.572 10.173 -3.109 1.00 . A A . 27 ARG NH2 1 1 2 1027 1 1 27 ARG O O -2.247 3.554 -0.685 1.00 . A A . 27 ARG O 1 1 2 1028 1 1 28 ALA C C -4.625 1.839 -1.872 1.00 . A A . 28 ALA C 1 1 2 1029 1 1 28 ALA CA C -4.448 3.323 -2.205 1.00 . A A . 28 ALA CA 1 1 2 1030 1 1 28 ALA CB C -5.468 3.728 -3.270 1.00 . A A . 28 ALA CB 1 1 2 1031 1 1 28 ALA H H -2.923 3.708 -3.665 1.00 . A A . 28 ALA H 1 1 2 1032 1 1 28 ALA HA H -4.624 3.909 -1.315 1.00 . A A . 28 ALA HA 1 1 2 1033 1 1 28 ALA HB1 H -4.988 3.754 -4.237 1.00 . A A . 28 ALA HB1 1 1 2 1034 1 1 28 ALA HB2 H -6.275 3.011 -3.288 1.00 . A A . 28 ALA HB2 1 1 2 1035 1 1 28 ALA HB3 H -5.862 4.706 -3.037 1.00 . A A . 28 ALA HB3 1 1 2 1036 1 1 28 ALA N N -3.073 3.596 -2.708 1.00 . A A . 28 ALA N 1 1 2 1037 1 1 28 ALA O O -4.830 1.481 -0.729 1.00 . A A . 28 ALA O 1 1 2 1038 1 1 29 ASN C C -3.916 -0.874 -1.281 1.00 . A A . 29 ASN C 1 1 2 1039 1 1 29 ASN CA C -4.732 -0.478 -2.511 1.00 . A A . 29 ASN CA 1 1 2 1040 1 1 29 ASN CB C -4.348 -1.430 -3.648 1.00 . A A . 29 ASN CB 1 1 2 1041 1 1 29 ASN CG C -5.634 -1.906 -4.327 1.00 . A A . 29 ASN CG 1 1 2 1042 1 1 29 ASN H H -4.393 1.252 -3.762 1.00 . A A . 29 ASN H 1 1 2 1043 1 1 29 ASN HA H -5.780 -0.588 -2.301 1.00 . A A . 29 ASN HA 1 1 2 1044 1 1 29 ASN HB2 H -3.712 -0.925 -4.359 1.00 . A A . 29 ASN HB2 1 1 2 1045 1 1 29 ASN HB3 H -3.825 -2.294 -3.254 1.00 . A A . 29 ASN HB3 1 1 2 1046 1 1 29 ASN HD21 H -6.203 -0.076 -4.849 1.00 . A A . 29 ASN HD21 1 1 2 1047 1 1 29 ASN HD22 H -7.256 -1.324 -5.313 1.00 . A A . 29 ASN HD22 1 1 2 1048 1 1 29 ASN N N -4.555 0.964 -2.840 1.00 . A A . 29 ASN N 1 1 2 1049 1 1 29 ASN ND2 N -6.431 -1.030 -4.875 1.00 . A A . 29 ASN ND2 1 1 2 1050 1 1 29 ASN O O -4.337 -1.682 -0.479 1.00 . A A . 29 ASN O 1 1 2 1051 1 1 29 ASN OD1 O -5.915 -3.087 -4.361 1.00 . A A . 29 ASN OD1 1 1 2 1052 1 1 30 CYS C C -1.732 0.586 0.915 1.00 . A A . 30 CYS C 1 1 2 1053 1 1 30 CYS CA C -1.911 -0.663 0.054 1.00 . A A . 30 CYS CA 1 1 2 1054 1 1 30 CYS CB C -0.573 -1.201 -0.451 1.00 . A A . 30 CYS CB 1 1 2 1055 1 1 30 CYS H H -2.422 0.336 -1.779 1.00 . A A . 30 CYS H 1 1 2 1056 1 1 30 CYS HA H -2.415 -1.422 0.635 1.00 . A A . 30 CYS HA 1 1 2 1057 1 1 30 CYS HB2 H -0.215 -0.594 -1.269 1.00 . A A . 30 CYS HB2 1 1 2 1058 1 1 30 CYS HB3 H 0.146 -1.198 0.354 1.00 . A A . 30 CYS HB3 1 1 2 1059 1 1 30 CYS N N -2.750 -0.314 -1.124 1.00 . A A . 30 CYS N 1 1 2 1060 1 1 30 CYS O O -0.641 1.035 1.204 1.00 . A A . 30 CYS O 1 1 2 1061 1 1 30 CYS SG S -0.832 -2.899 -1.018 1.00 . A A . 30 CYS SG 1 1 2 1062 1 1 31 ALA C C -2.654 1.993 3.631 1.00 . A A . 31 ALA C 1 1 2 1063 1 1 31 ALA CA C -2.884 2.355 2.158 1.00 . A A . 31 ALA CA 1 1 2 1064 1 1 31 ALA CB C -4.277 2.957 1.971 1.00 . A A . 31 ALA CB 1 1 2 1065 1 1 31 ALA H H -3.695 0.719 1.043 1.00 . A A . 31 ALA H 1 1 2 1066 1 1 31 ALA HA H -2.143 3.067 1.818 1.00 . A A . 31 ALA HA 1 1 2 1067 1 1 31 ALA HB1 H -4.960 2.175 1.667 1.00 . A A . 31 ALA HB1 1 1 2 1068 1 1 31 ALA HB2 H -4.616 3.387 2.902 1.00 . A A . 31 ALA HB2 1 1 2 1069 1 1 31 ALA HB3 H -4.251 3.717 1.205 1.00 . A A . 31 ALA HB3 1 1 2 1070 1 1 31 ALA N N -2.848 1.130 1.312 1.00 . A A . 31 ALA N 1 1 2 1071 1 1 31 ALA O O -2.635 2.852 4.490 1.00 . A A . 31 ALA O 1 1 2 1072 1 1 32 LYS C C -0.756 0.391 5.662 1.00 . A A . 32 LYS C 1 1 2 1073 1 1 32 LYS CA C -2.251 0.308 5.350 1.00 . A A . 32 LYS CA 1 1 2 1074 1 1 32 LYS CB C -2.713 -1.144 5.501 1.00 . A A . 32 LYS CB 1 1 2 1075 1 1 32 LYS CD C -0.564 -2.453 5.266 1.00 . A A . 32 LYS CD 1 1 2 1076 1 1 32 LYS CE C -0.162 -3.902 5.565 1.00 . A A . 32 LYS CE 1 1 2 1077 1 1 32 LYS CG C -1.668 -2.000 6.230 1.00 . A A . 32 LYS CG 1 1 2 1078 1 1 32 LYS H H -2.500 0.061 3.223 1.00 . A A . 32 LYS H 1 1 2 1079 1 1 32 LYS HA H -2.811 0.938 6.024 1.00 . A A . 32 LYS HA 1 1 2 1080 1 1 32 LYS HB2 H -3.635 -1.155 6.061 1.00 . A A . 32 LYS HB2 1 1 2 1081 1 1 32 LYS HB3 H -2.892 -1.556 4.519 1.00 . A A . 32 LYS HB3 1 1 2 1082 1 1 32 LYS HD2 H -0.927 -2.383 4.251 1.00 . A A . 32 LYS HD2 1 1 2 1083 1 1 32 LYS HD3 H 0.298 -1.814 5.383 1.00 . A A . 32 LYS HD3 1 1 2 1084 1 1 32 LYS HE2 H -0.852 -4.572 5.075 1.00 . A A . 32 LYS HE2 1 1 2 1085 1 1 32 LYS HE3 H 0.840 -4.106 5.208 1.00 . A A . 32 LYS HE3 1 1 2 1086 1 1 32 LYS HG2 H -1.230 -1.435 7.040 1.00 . A A . 32 LYS HG2 1 1 2 1087 1 1 32 LYS HG3 H -2.156 -2.873 6.638 1.00 . A A . 32 LYS HG3 1 1 2 1088 1 1 32 LYS HZ1 H 0.118 -3.274 7.528 1.00 . A A . 32 LYS HZ1 1 1 2 1089 1 1 32 LYS HZ2 H -1.195 -4.335 7.321 1.00 . A A . 32 LYS HZ2 1 1 2 1090 1 1 32 LYS HZ3 H 0.388 -4.935 7.289 1.00 . A A . 32 LYS HZ3 1 1 2 1091 1 1 32 LYS N N -2.479 0.735 3.935 1.00 . A A . 32 LYS N 1 1 2 1092 1 1 32 LYS NZ N -0.216 -4.128 7.037 1.00 . A A . 32 LYS NZ 1 1 2 1093 1 1 32 LYS O O -0.332 0.571 6.786 1.00 . A A . 32 LYS O 1 1 2 1094 1 1 33 THR C C 1.983 1.746 4.579 1.00 . A A . 33 THR C 1 1 2 1095 1 1 33 THR CA C 1.512 0.304 4.734 1.00 . A A . 33 THR CA 1 1 2 1096 1 1 33 THR CB C 1.963 -0.680 3.653 1.00 . A A . 33 THR CB 1 1 2 1097 1 1 33 THR CG2 C 2.763 -0.070 2.502 1.00 . A A . 33 THR CG2 1 1 2 1098 1 1 33 THR H H -0.382 0.111 3.755 1.00 . A A . 33 THR H 1 1 2 1099 1 1 33 THR HA H 1.863 -0.034 5.692 1.00 . A A . 33 THR HA 1 1 2 1100 1 1 33 THR HB H 1.075 -1.151 3.261 1.00 . A A . 33 THR HB 1 1 2 1101 1 1 33 THR HG1 H 2.152 -2.147 4.909 1.00 . A A . 33 THR HG1 1 1 2 1102 1 1 33 THR HG21 H 2.968 0.974 2.654 1.00 . A A . 33 THR HG21 1 1 2 1103 1 1 33 THR HG22 H 3.691 -0.611 2.415 1.00 . A A . 33 THR HG22 1 1 2 1104 1 1 33 THR HG23 H 2.203 -0.185 1.587 1.00 . A A . 33 THR HG23 1 1 2 1105 1 1 33 THR N N 0.028 0.254 4.633 1.00 . A A . 33 THR N 1 1 2 1106 1 1 33 THR O O 2.955 2.181 5.165 1.00 . A A . 33 THR O 1 1 2 1107 1 1 33 THR OG1 O 2.720 -1.703 4.277 1.00 . A A . 33 THR OG1 1 1 2 1108 1 1 34 CYS C C 0.739 4.780 4.439 1.00 . A A . 34 CYS C 1 1 2 1109 1 1 34 CYS CA C 1.605 3.906 3.529 1.00 . A A . 34 CYS CA 1 1 2 1110 1 1 34 CYS CB C 1.259 4.162 2.066 1.00 . A A . 34 CYS CB 1 1 2 1111 1 1 34 CYS H H 0.496 2.091 3.333 1.00 . A A . 34 CYS H 1 1 2 1112 1 1 34 CYS HA H 2.656 4.096 3.688 1.00 . A A . 34 CYS HA 1 1 2 1113 1 1 34 CYS HB2 H 1.730 3.393 1.476 1.00 . A A . 34 CYS HB2 1 1 2 1114 1 1 34 CYS HB3 H 0.192 4.102 1.925 1.00 . A A . 34 CYS HB3 1 1 2 1115 1 1 34 CYS N N 1.272 2.482 3.779 1.00 . A A . 34 CYS N 1 1 2 1116 1 1 34 CYS O O 0.962 5.966 4.576 1.00 . A A . 34 CYS O 1 1 2 1117 1 1 34 CYS SG S 1.866 5.795 1.585 1.00 . A A . 34 CYS SG 1 1 2 1118 1 1 35 GLU C C -1.951 5.958 5.149 1.00 . A A . 35 GLU C 1 1 2 1119 1 1 35 GLU CA C -1.139 4.963 5.964 1.00 . A A . 35 GLU CA 1 1 2 1120 1 1 35 GLU CB C -0.289 5.599 7.058 1.00 . A A . 35 GLU CB 1 1 2 1121 1 1 35 GLU CD C 1.195 4.810 8.927 1.00 . A A . 35 GLU CD 1 1 2 1122 1 1 35 GLU CG C 0.200 4.390 7.845 1.00 . A A . 35 GLU CG 1 1 2 1123 1 1 35 GLU H H -0.416 3.235 4.941 1.00 . A A . 35 GLU H 1 1 2 1124 1 1 35 GLU HA H -1.834 4.263 6.410 1.00 . A A . 35 GLU HA 1 1 2 1125 1 1 35 GLU HB2 H 0.531 6.156 6.626 1.00 . A A . 35 GLU HB2 1 1 2 1126 1 1 35 GLU HB3 H -0.887 6.219 7.707 1.00 . A A . 35 GLU HB3 1 1 2 1127 1 1 35 GLU HG2 H -0.665 3.909 8.282 1.00 . A A . 35 GLU HG2 1 1 2 1128 1 1 35 GLU HG3 H 0.668 3.703 7.153 1.00 . A A . 35 GLU HG3 1 1 2 1129 1 1 35 GLU N N -0.247 4.192 5.061 1.00 . A A . 35 GLU N 1 1 2 1130 1 1 35 GLU O O -2.326 7.031 5.579 1.00 . A A . 35 GLU O 1 1 2 1131 1 1 35 GLU OE1 O 0.833 5.635 9.750 1.00 . A A . 35 GLU OE1 1 1 2 1132 1 1 35 GLU OE2 O 2.303 4.298 8.916 1.00 . A A . 35 GLU OE2 1 1 2 1133 1 1 36 LEU C C -4.469 6.049 3.299 1.00 . A A . 36 LEU C 1 1 2 1134 1 1 36 LEU CA C -3.000 6.351 2.995 1.00 . A A . 36 LEU CA 1 1 2 1135 1 1 36 LEU CB C -2.630 5.874 1.593 1.00 . A A . 36 LEU CB 1 1 2 1136 1 1 36 LEU CD1 C -0.712 5.487 0.046 1.00 . A A . 36 LEU CD1 1 1 2 1137 1 1 36 LEU CD2 C -0.969 7.694 1.182 1.00 . A A . 36 LEU CD2 1 1 2 1138 1 1 36 LEU CG C -1.156 6.183 1.334 1.00 . A A . 36 LEU CG 1 1 2 1139 1 1 36 LEU H H -1.884 4.655 3.664 1.00 . A A . 36 LEU H 1 1 2 1140 1 1 36 LEU HA H -2.782 7.398 3.111 1.00 . A A . 36 LEU HA 1 1 2 1141 1 1 36 LEU HB2 H -2.790 4.817 1.574 1.00 . A A . 36 LEU HB2 1 1 2 1142 1 1 36 LEU HB3 H -3.240 6.325 0.833 1.00 . A A . 36 LEU HB3 1 1 2 1143 1 1 36 LEU HD11 H -1.475 5.621 -0.706 1.00 . A A . 36 LEU HD11 1 1 2 1144 1 1 36 LEU HD12 H 0.215 5.919 -0.302 1.00 . A A . 36 LEU HD12 1 1 2 1145 1 1 36 LEU HD13 H -0.572 4.433 0.234 1.00 . A A . 36 LEU HD13 1 1 2 1146 1 1 36 LEU HD21 H -1.674 8.209 1.817 1.00 . A A . 36 LEU HD21 1 1 2 1147 1 1 36 LEU HD22 H 0.037 7.962 1.467 1.00 . A A . 36 LEU HD22 1 1 2 1148 1 1 36 LEU HD23 H -1.138 7.976 0.153 1.00 . A A . 36 LEU HD23 1 1 2 1149 1 1 36 LEU HG H -0.576 5.820 2.170 1.00 . A A . 36 LEU HG 1 1 2 1150 1 1 36 LEU N N -2.210 5.535 3.946 1.00 . A A . 36 LEU N 1 1 2 1151 1 1 36 LEU O O -5.358 6.629 2.710 1.00 . A A . 36 LEU O 1 1 2 1152 1 1 37 CYS C C -6.257 3.584 5.381 1.00 . A A . 37 CYS C 1 1 2 1153 1 1 37 CYS CA C -6.170 4.846 4.520 1.00 . A A . 37 CYS CA 1 1 2 1154 1 1 37 CYS CB C -6.934 4.626 3.212 1.00 . A A . 37 CYS CB 1 1 2 1155 1 1 37 CYS H H -4.038 4.665 4.704 1.00 . A A . 37 CYS H 1 1 2 1156 1 1 37 CYS HA H -6.607 5.675 5.054 1.00 . A A . 37 CYS HA 1 1 2 1157 1 1 37 CYS HB2 H -7.218 5.581 2.797 1.00 . A A . 37 CYS HB2 1 1 2 1158 1 1 37 CYS HB3 H -6.305 4.099 2.510 1.00 . A A . 37 CYS HB3 1 1 2 1159 1 1 37 CYS N N -4.745 5.147 4.214 1.00 . A A . 37 CYS N 1 1 2 1160 1 1 37 CYS O O -5.808 2.545 4.925 1.00 . A A . 37 CYS O 1 1 2 1161 1 1 37 CYS OXT O -6.770 3.678 6.484 1.00 . A A . 37 CYS OXT 1 1 2 1162 1 1 37 CYS SG S -8.418 3.646 3.545 1.00 . A A . 37 CYS SG 1 1 3 1163 1 1 1 VAL C C -11.093 0.315 3.218 1.00 . A A . 1 VAL C 1 1 3 1164 1 1 1 VAL CA C -12.490 -0.162 2.816 1.00 . A A . 1 VAL CA 1 1 3 1165 1 1 1 VAL CB C -12.611 -0.156 1.292 1.00 . A A . 1 VAL CB 1 1 3 1166 1 1 1 VAL CG1 C -12.122 -1.492 0.731 1.00 . A A . 1 VAL CG1 1 1 3 1167 1 1 1 VAL CG2 C -14.076 0.053 0.902 1.00 . A A . 1 VAL CG2 1 1 3 1168 1 1 1 VAL H1 H -13.270 0.988 4.373 1.00 . A A . 1 VAL H1 1 1 3 1169 1 1 1 VAL H2 H -13.572 1.616 2.821 1.00 . A A . 1 VAL H2 1 1 3 1170 1 1 1 VAL H3 H -14.446 0.273 3.386 1.00 . A A . 1 VAL H3 1 1 3 1171 1 1 1 VAL HA H -12.648 -1.166 3.183 1.00 . A A . 1 VAL HA 1 1 3 1172 1 1 1 VAL HB H -12.006 0.644 0.889 1.00 . A A . 1 VAL HB 1 1 3 1173 1 1 1 VAL HG11 H -11.110 -1.672 1.060 1.00 . A A . 1 VAL HG11 1 1 3 1174 1 1 1 VAL HG12 H -12.762 -2.287 1.084 1.00 . A A . 1 VAL HG12 1 1 3 1175 1 1 1 VAL HG13 H -12.150 -1.461 -0.348 1.00 . A A . 1 VAL HG13 1 1 3 1176 1 1 1 VAL HG21 H -14.714 -0.397 1.647 1.00 . A A . 1 VAL HG21 1 1 3 1177 1 1 1 VAL HG22 H -14.284 1.111 0.842 1.00 . A A . 1 VAL HG22 1 1 3 1178 1 1 1 VAL HG23 H -14.262 -0.406 -0.057 1.00 . A A . 1 VAL HG23 1 1 3 1179 1 1 1 VAL N N -13.521 0.748 3.393 1.00 . A A . 1 VAL N 1 1 3 1180 1 1 1 VAL O O -10.203 0.412 2.395 1.00 . A A . 1 VAL O 1 1 3 1181 1 1 2 CYS C C -8.558 -0.100 4.941 1.00 . A A . 2 CYS C 1 1 3 1182 1 1 2 CYS CA C -9.538 1.083 4.907 1.00 . A A . 2 CYS CA 1 1 3 1183 1 1 2 CYS CB C -9.662 1.638 6.327 1.00 . A A . 2 CYS CB 1 1 3 1184 1 1 2 CYS H H -11.616 0.530 5.123 1.00 . A A . 2 CYS H 1 1 3 1185 1 1 2 CYS HA H -9.199 1.871 4.253 1.00 . A A . 2 CYS HA 1 1 3 1186 1 1 2 CYS HB2 H -10.530 1.209 6.806 1.00 . A A . 2 CYS HB2 1 1 3 1187 1 1 2 CYS HB3 H -8.777 1.385 6.891 1.00 . A A . 2 CYS HB3 1 1 3 1188 1 1 2 CYS N N -10.886 0.613 4.471 1.00 . A A . 2 CYS N 1 1 3 1189 1 1 2 CYS O O -8.602 -0.869 5.881 1.00 . A A . 2 CYS O 1 1 3 1190 1 1 2 CYS SG S -9.841 3.438 6.259 1.00 . A A . 2 CYS SG 1 1 3 1191 1 1 3 ARG C C -5.829 -1.530 2.895 1.00 . A A . 3 ARG C 1 1 3 1192 1 1 3 ARG CA C -6.764 -1.478 4.106 1.00 . A A . 3 ARG CA 1 1 3 1193 1 1 3 ARG CB C -7.590 -2.765 4.163 1.00 . A A . 3 ARG CB 1 1 3 1194 1 1 3 ARG CD C -8.446 -4.269 2.352 1.00 . A A . 3 ARG CD 1 1 3 1195 1 1 3 ARG CG C -8.492 -2.852 2.929 1.00 . A A . 3 ARG CG 1 1 3 1196 1 1 3 ARG CZ C -7.636 -6.305 3.382 1.00 . A A . 3 ARG CZ 1 1 3 1197 1 1 3 ARG H H -7.592 0.282 3.208 1.00 . A A . 3 ARG H 1 1 3 1198 1 1 3 ARG HA H -6.177 -1.390 5.008 1.00 . A A . 3 ARG HA 1 1 3 1199 1 1 3 ARG HB2 H -6.924 -3.613 4.195 1.00 . A A . 3 ARG HB2 1 1 3 1200 1 1 3 ARG HB3 H -8.203 -2.759 5.053 1.00 . A A . 3 ARG HB3 1 1 3 1201 1 1 3 ARG HD2 H -9.324 -4.441 1.744 1.00 . A A . 3 ARG HD2 1 1 3 1202 1 1 3 ARG HD3 H -7.562 -4.379 1.742 1.00 . A A . 3 ARG HD3 1 1 3 1203 1 1 3 ARG HE H -8.964 -5.121 4.262 1.00 . A A . 3 ARG HE 1 1 3 1204 1 1 3 ARG HG2 H -9.506 -2.607 3.208 1.00 . A A . 3 ARG HG2 1 1 3 1205 1 1 3 ARG HG3 H -8.146 -2.154 2.182 1.00 . A A . 3 ARG HG3 1 1 3 1206 1 1 3 ARG HH11 H -8.078 -6.666 1.463 1.00 . A A . 3 ARG HH11 1 1 3 1207 1 1 3 ARG HH12 H -6.958 -7.768 2.194 1.00 . A A . 3 ARG HH12 1 1 3 1208 1 1 3 ARG HH21 H -7.014 -6.189 5.281 1.00 . A A . 3 ARG HH21 1 1 3 1209 1 1 3 ARG HH22 H -6.356 -7.498 4.356 1.00 . A A . 3 ARG HH22 1 1 3 1210 1 1 3 ARG N N -7.676 -0.304 3.991 1.00 . A A . 3 ARG N 1 1 3 1211 1 1 3 ARG NE N -8.409 -5.258 3.466 1.00 . A A . 3 ARG NE 1 1 3 1212 1 1 3 ARG NH1 N -7.551 -6.965 2.258 1.00 . A A . 3 ARG NH1 1 1 3 1213 1 1 3 ARG NH2 N -6.948 -6.695 4.421 1.00 . A A . 3 ARG NH2 1 1 3 1214 1 1 3 ARG O O -5.696 -0.572 2.160 1.00 . A A . 3 ARG O 1 1 3 1215 1 1 4 ASP C C -4.945 -3.527 0.389 1.00 . A A . 4 ASP C 1 1 3 1216 1 1 4 ASP CA C -4.255 -2.763 1.521 1.00 . A A . 4 ASP CA 1 1 3 1217 1 1 4 ASP CB C -2.985 -3.490 1.969 1.00 . A A . 4 ASP CB 1 1 3 1218 1 1 4 ASP CG C -3.249 -4.995 2.049 1.00 . A A . 4 ASP CG 1 1 3 1219 1 1 4 ASP H H -5.303 -3.405 3.287 1.00 . A A . 4 ASP H 1 1 3 1220 1 1 4 ASP HA H -4.005 -1.775 1.164 1.00 . A A . 4 ASP HA 1 1 3 1221 1 1 4 ASP HB2 H -2.192 -3.301 1.261 1.00 . A A . 4 ASP HB2 1 1 3 1222 1 1 4 ASP HB3 H -2.691 -3.132 2.945 1.00 . A A . 4 ASP HB3 1 1 3 1223 1 1 4 ASP N N -5.182 -2.644 2.682 1.00 . A A . 4 ASP N 1 1 3 1224 1 1 4 ASP O O -6.157 -3.526 0.299 1.00 . A A . 4 ASP O 1 1 3 1225 1 1 4 ASP OD1 O -3.659 -5.447 3.106 1.00 . A A . 4 ASP OD1 1 1 3 1226 1 1 4 ASP OD2 O -3.038 -5.672 1.056 1.00 . A A . 4 ASP OD2 1 1 3 1227 1 1 5 TRP C C -4.058 -6.082 -2.016 1.00 . A A . 5 TRP C 1 1 3 1228 1 1 5 TRP CA C -4.927 -4.908 -1.565 1.00 . A A . 5 TRP CA 1 1 3 1229 1 1 5 TRP CB C -5.201 -3.910 -2.691 1.00 . A A . 5 TRP CB 1 1 3 1230 1 1 5 TRP CD1 C -6.992 -2.145 -2.326 1.00 . A A . 5 TRP CD1 1 1 3 1231 1 1 5 TRP CD2 C -7.813 -4.235 -2.388 1.00 . A A . 5 TRP CD2 1 1 3 1232 1 1 5 TRP CE2 C -8.916 -3.370 -2.180 1.00 . A A . 5 TRP CE2 1 1 3 1233 1 1 5 TRP CE3 C -8.059 -5.616 -2.465 1.00 . A A . 5 TRP CE3 1 1 3 1234 1 1 5 TRP CG C -6.601 -3.431 -2.479 1.00 . A A . 5 TRP CG 1 1 3 1235 1 1 5 TRP CH2 C -10.439 -5.243 -2.134 1.00 . A A . 5 TRP CH2 1 1 3 1236 1 1 5 TRP CZ2 C -10.218 -3.864 -2.054 1.00 . A A . 5 TRP CZ2 1 1 3 1237 1 1 5 TRP CZ3 C -9.362 -6.115 -2.339 1.00 . A A . 5 TRP CZ3 1 1 3 1238 1 1 5 TRP H H -3.234 -4.196 -0.431 1.00 . A A . 5 TRP H 1 1 3 1239 1 1 5 TRP HA H -5.872 -5.284 -1.178 1.00 . A A . 5 TRP HA 1 1 3 1240 1 1 5 TRP HB2 H -4.500 -3.092 -2.612 1.00 . A A . 5 TRP HB2 1 1 3 1241 1 1 5 TRP HB3 H -5.118 -4.380 -3.659 1.00 . A A . 5 TRP HB3 1 1 3 1242 1 1 5 TRP HD1 H -6.342 -1.284 -2.339 1.00 . A A . 5 TRP HD1 1 1 3 1243 1 1 5 TRP HE1 H -8.893 -1.293 -2.019 1.00 . A A . 5 TRP HE1 1 1 3 1244 1 1 5 TRP HE3 H -7.236 -6.297 -2.624 1.00 . A A . 5 TRP HE3 1 1 3 1245 1 1 5 TRP HH2 H -11.440 -5.635 -2.037 1.00 . A A . 5 TRP HH2 1 1 3 1246 1 1 5 TRP HZ2 H -11.046 -3.187 -1.895 1.00 . A A . 5 TRP HZ2 1 1 3 1247 1 1 5 TRP HZ3 H -9.537 -7.179 -2.400 1.00 . A A . 5 TRP HZ3 1 1 3 1248 1 1 5 TRP N N -4.218 -4.179 -0.479 1.00 . A A . 5 TRP N 1 1 3 1249 1 1 5 TRP NE1 N -8.362 -2.107 -2.150 1.00 . A A . 5 TRP NE1 1 1 3 1250 1 1 5 TRP O O -4.570 -7.135 -2.341 1.00 . A A . 5 TRP O 1 1 3 1251 1 1 6 PHE C C -1.749 -7.871 -1.170 1.00 . A A . 6 PHE C 1 1 3 1252 1 1 6 PHE CA C -1.922 -7.090 -2.468 1.00 . A A . 6 PHE CA 1 1 3 1253 1 1 6 PHE CB C -0.527 -6.569 -2.785 1.00 . A A . 6 PHE CB 1 1 3 1254 1 1 6 PHE CD1 C -1.438 -5.696 -4.937 1.00 . A A . 6 PHE CD1 1 1 3 1255 1 1 6 PHE CD2 C 0.177 -4.363 -3.711 1.00 . A A . 6 PHE CD2 1 1 3 1256 1 1 6 PHE CE1 C -1.502 -4.713 -5.918 1.00 . A A . 6 PHE CE1 1 1 3 1257 1 1 6 PHE CE2 C 0.118 -3.381 -4.688 1.00 . A A . 6 PHE CE2 1 1 3 1258 1 1 6 PHE CG C -0.599 -5.512 -3.841 1.00 . A A . 6 PHE CG 1 1 3 1259 1 1 6 PHE CZ C -0.722 -3.559 -5.790 1.00 . A A . 6 PHE CZ 1 1 3 1260 1 1 6 PHE H H -2.299 -5.113 -1.780 1.00 . A A . 6 PHE H 1 1 3 1261 1 1 6 PHE HA H -2.352 -7.633 -3.297 1.00 . A A . 6 PHE HA 1 1 3 1262 1 1 6 PHE HB2 H -0.105 -6.132 -1.894 1.00 . A A . 6 PHE HB2 1 1 3 1263 1 1 6 PHE HB3 H 0.096 -7.375 -3.132 1.00 . A A . 6 PHE HB3 1 1 3 1264 1 1 6 PHE HD1 H -2.033 -6.586 -5.028 1.00 . A A . 6 PHE HD1 1 1 3 1265 1 1 6 PHE HD2 H 0.825 -4.218 -2.866 1.00 . A A . 6 PHE HD2 1 1 3 1266 1 1 6 PHE HE1 H -2.154 -4.865 -6.761 1.00 . A A . 6 PHE HE1 1 1 3 1267 1 1 6 PHE HE2 H 0.726 -2.502 -4.569 1.00 . A A . 6 PHE HE2 1 1 3 1268 1 1 6 PHE HZ H -0.765 -2.800 -6.542 1.00 . A A . 6 PHE HZ 1 1 3 1269 1 1 6 PHE N N -2.757 -5.943 -2.040 1.00 . A A . 6 PHE N 1 1 3 1270 1 1 6 PHE O O -2.622 -7.873 -0.325 1.00 . A A . 6 PHE O 1 1 3 1271 1 1 7 LYS C C -0.207 -8.124 1.277 1.00 . A A . 7 LYS C 1 1 3 1272 1 1 7 LYS CA C -0.489 -9.262 0.296 1.00 . A A . 7 LYS CA 1 1 3 1273 1 1 7 LYS CB C 0.717 -10.205 0.225 1.00 . A A . 7 LYS CB 1 1 3 1274 1 1 7 LYS CD C -0.575 -12.343 0.191 1.00 . A A . 7 LYS CD 1 1 3 1275 1 1 7 LYS CE C -0.475 -13.775 -0.340 1.00 . A A . 7 LYS CE 1 1 3 1276 1 1 7 LYS CG C 0.360 -11.435 -0.611 1.00 . A A . 7 LYS CG 1 1 3 1277 1 1 7 LYS H H 0.075 -8.523 -1.649 1.00 . A A . 7 LYS H 1 1 3 1278 1 1 7 LYS HA H -1.407 -9.772 0.555 1.00 . A A . 7 LYS HA 1 1 3 1279 1 1 7 LYS HB2 H 1.550 -9.686 -0.230 1.00 . A A . 7 LYS HB2 1 1 3 1280 1 1 7 LYS HB3 H 0.989 -10.519 1.222 1.00 . A A . 7 LYS HB3 1 1 3 1281 1 1 7 LYS HD2 H -0.291 -12.320 1.233 1.00 . A A . 7 LYS HD2 1 1 3 1282 1 1 7 LYS HD3 H -1.593 -11.997 0.085 1.00 . A A . 7 LYS HD3 1 1 3 1283 1 1 7 LYS HE2 H 0.526 -13.954 -0.702 1.00 . A A . 7 LYS HE2 1 1 3 1284 1 1 7 LYS HE3 H -0.700 -14.470 0.456 1.00 . A A . 7 LYS HE3 1 1 3 1285 1 1 7 LYS HG2 H -0.128 -11.121 -1.521 1.00 . A A . 7 LYS HG2 1 1 3 1286 1 1 7 LYS HG3 H 1.261 -11.980 -0.852 1.00 . A A . 7 LYS HG3 1 1 3 1287 1 1 7 LYS HZ1 H -1.492 -13.092 -2.025 1.00 . A A . 7 LYS HZ1 1 1 3 1288 1 1 7 LYS HZ2 H -1.141 -14.755 -2.050 1.00 . A A . 7 LYS HZ2 1 1 3 1289 1 1 7 LYS HZ3 H -2.391 -14.157 -1.063 1.00 . A A . 7 LYS HZ3 1 1 3 1290 1 1 7 LYS N N -0.639 -8.525 -0.981 1.00 . A A . 7 LYS N 1 1 3 1291 1 1 7 LYS NZ N -1.448 -13.959 -1.454 1.00 . A A . 7 LYS NZ 1 1 3 1292 1 1 7 LYS O O 0.320 -7.104 0.881 1.00 . A A . 7 LYS O 1 1 3 1293 1 1 8 GLU C C 1.249 -6.717 3.326 1.00 . A A . 8 GLU C 1 1 3 1294 1 1 8 GLU CA C -0.229 -7.093 3.443 1.00 . A A . 8 GLU CA 1 1 3 1295 1 1 8 GLU CB C -0.566 -7.498 4.879 1.00 . A A . 8 GLU CB 1 1 3 1296 1 1 8 GLU CD C -1.614 -9.765 5.031 1.00 . A A . 8 GLU CD 1 1 3 1297 1 1 8 GLU CG C -1.889 -8.266 4.899 1.00 . A A . 8 GLU CG 1 1 3 1298 1 1 8 GLU H H -0.954 -9.050 2.872 1.00 . A A . 8 GLU H 1 1 3 1299 1 1 8 GLU HA H -0.811 -6.226 3.161 1.00 . A A . 8 GLU HA 1 1 3 1300 1 1 8 GLU HB2 H 0.222 -8.129 5.266 1.00 . A A . 8 GLU HB2 1 1 3 1301 1 1 8 GLU HB3 H -0.658 -6.620 5.497 1.00 . A A . 8 GLU HB3 1 1 3 1302 1 1 8 GLU HG2 H -2.485 -7.931 5.736 1.00 . A A . 8 GLU HG2 1 1 3 1303 1 1 8 GLU HG3 H -2.425 -8.084 3.979 1.00 . A A . 8 GLU HG3 1 1 3 1304 1 1 8 GLU N N -0.527 -8.237 2.533 1.00 . A A . 8 GLU N 1 1 3 1305 1 1 8 GLU O O 1.648 -5.635 3.708 1.00 . A A . 8 GLU O 1 1 3 1306 1 1 8 GLU OE1 O -0.551 -10.113 5.519 1.00 . A A . 8 GLU OE1 1 1 3 1307 1 1 8 GLU OE2 O -2.471 -10.541 4.642 1.00 . A A . 8 GLU OE2 1 1 3 1308 1 1 9 THR C C 3.811 -6.640 1.309 1.00 . A A . 9 THR C 1 1 3 1309 1 1 9 THR CA C 3.511 -7.243 2.682 1.00 . A A . 9 THR CA 1 1 3 1310 1 1 9 THR CB C 4.297 -8.507 3.006 1.00 . A A . 9 THR CB 1 1 3 1311 1 1 9 THR CG2 C 4.163 -8.683 4.519 1.00 . A A . 9 THR CG2 1 1 3 1312 1 1 9 THR H H 1.752 -8.459 2.498 1.00 . A A . 9 THR H 1 1 3 1313 1 1 9 THR HA H 3.735 -6.491 3.427 1.00 . A A . 9 THR HA 1 1 3 1314 1 1 9 THR HB H 5.336 -8.382 2.760 1.00 . A A . 9 THR HB 1 1 3 1315 1 1 9 THR HG1 H 4.452 -10.158 1.989 1.00 . A A . 9 THR HG1 1 1 3 1316 1 1 9 THR HG21 H 3.432 -7.971 4.887 1.00 . A A . 9 THR HG21 1 1 3 1317 1 1 9 THR HG22 H 3.828 -9.685 4.741 1.00 . A A . 9 THR HG22 1 1 3 1318 1 1 9 THR HG23 H 5.116 -8.500 4.992 1.00 . A A . 9 THR HG23 1 1 3 1319 1 1 9 THR N N 2.071 -7.586 2.805 1.00 . A A . 9 THR N 1 1 3 1320 1 1 9 THR O O 4.727 -5.856 1.163 1.00 . A A . 9 THR O 1 1 3 1321 1 1 9 THR OG1 O 3.733 -9.604 2.299 1.00 . A A . 9 THR OG1 1 1 3 1322 1 1 10 ALA C C 3.299 -4.895 -0.744 1.00 . A A . 10 ALA C 1 1 3 1323 1 1 10 ALA CA C 3.319 -6.388 -1.037 1.00 . A A . 10 ALA CA 1 1 3 1324 1 1 10 ALA CB C 2.171 -6.672 -2.011 1.00 . A A . 10 ALA CB 1 1 3 1325 1 1 10 ALA H H 2.313 -7.608 0.445 1.00 . A A . 10 ALA H 1 1 3 1326 1 1 10 ALA HA H 4.284 -6.657 -1.434 1.00 . A A . 10 ALA HA 1 1 3 1327 1 1 10 ALA HB1 H 1.377 -7.182 -1.486 1.00 . A A . 10 ALA HB1 1 1 3 1328 1 1 10 ALA HB2 H 1.785 -5.737 -2.402 1.00 . A A . 10 ALA HB2 1 1 3 1329 1 1 10 ALA HB3 H 2.518 -7.286 -2.827 1.00 . A A . 10 ALA HB3 1 1 3 1330 1 1 10 ALA N N 3.050 -6.980 0.305 1.00 . A A . 10 ALA N 1 1 3 1331 1 1 10 ALA O O 4.045 -4.106 -1.290 1.00 . A A . 10 ALA O 1 1 3 1332 1 1 11 CYS C C 3.530 -2.761 1.360 1.00 . A A . 11 CYS C 1 1 3 1333 1 1 11 CYS CA C 2.303 -3.106 0.521 1.00 . A A . 11 CYS CA 1 1 3 1334 1 1 11 CYS CB C 0.933 -2.931 1.175 1.00 . A A . 11 CYS CB 1 1 3 1335 1 1 11 CYS H H 1.830 -5.188 0.572 1.00 . A A . 11 CYS H 1 1 3 1336 1 1 11 CYS HA H 2.374 -2.531 -0.389 1.00 . A A . 11 CYS HA 1 1 3 1337 1 1 11 CYS HB2 H 0.695 -3.789 1.798 1.00 . A A . 11 CYS HB2 1 1 3 1338 1 1 11 CYS HB3 H 0.891 -2.016 1.744 1.00 . A A . 11 CYS HB3 1 1 3 1339 1 1 11 CYS N N 2.419 -4.532 0.145 1.00 . A A . 11 CYS N 1 1 3 1340 1 1 11 CYS O O 4.056 -1.675 1.231 1.00 . A A . 11 CYS O 1 1 3 1341 1 1 11 CYS SG S -0.221 -2.816 -0.216 1.00 . A A . 11 CYS SG 1 1 3 1342 1 1 12 ARG C C 6.221 -2.812 1.997 1.00 . A A . 12 ARG C 1 1 3 1343 1 1 12 ARG CA C 5.198 -3.330 3.005 1.00 . A A . 12 ARG CA 1 1 3 1344 1 1 12 ARG CB C 5.811 -4.576 3.639 1.00 . A A . 12 ARG CB 1 1 3 1345 1 1 12 ARG CD C 8.006 -5.293 4.613 1.00 . A A . 12 ARG CD 1 1 3 1346 1 1 12 ARG CG C 7.322 -4.352 3.620 1.00 . A A . 12 ARG CG 1 1 3 1347 1 1 12 ARG CZ C 10.388 -5.552 4.268 1.00 . A A . 12 ARG CZ 1 1 3 1348 1 1 12 ARG H H 3.563 -4.528 2.280 1.00 . A A . 12 ARG H 1 1 3 1349 1 1 12 ARG HA H 4.998 -2.574 3.745 1.00 . A A . 12 ARG HA 1 1 3 1350 1 1 12 ARG HB2 H 5.450 -4.689 4.652 1.00 . A A . 12 ARG HB2 1 1 3 1351 1 1 12 ARG HB3 H 5.578 -5.451 3.053 1.00 . A A . 12 ARG HB3 1 1 3 1352 1 1 12 ARG HD2 H 8.336 -4.729 5.473 1.00 . A A . 12 ARG HD2 1 1 3 1353 1 1 12 ARG HD3 H 7.307 -6.054 4.928 1.00 . A A . 12 ARG HD3 1 1 3 1354 1 1 12 ARG HE H 9.045 -6.648 3.301 1.00 . A A . 12 ARG HE 1 1 3 1355 1 1 12 ARG HG2 H 7.686 -4.530 2.619 1.00 . A A . 12 ARG HG2 1 1 3 1356 1 1 12 ARG HG3 H 7.530 -3.325 3.891 1.00 . A A . 12 ARG HG3 1 1 3 1357 1 1 12 ARG HH11 H 10.345 -3.944 3.075 1.00 . A A . 12 ARG HH11 1 1 3 1358 1 1 12 ARG HH12 H 11.814 -4.179 3.962 1.00 . A A . 12 ARG HH12 1 1 3 1359 1 1 12 ARG HH21 H 10.715 -7.069 5.533 1.00 . A A . 12 ARG HH21 1 1 3 1360 1 1 12 ARG HH22 H 12.023 -5.949 5.353 1.00 . A A . 12 ARG HH22 1 1 3 1361 1 1 12 ARG N N 3.993 -3.655 2.194 1.00 . A A . 12 ARG N 1 1 3 1362 1 1 12 ARG NE N 9.180 -5.937 3.961 1.00 . A A . 12 ARG NE 1 1 3 1363 1 1 12 ARG NH1 N 10.888 -4.474 3.726 1.00 . A A . 12 ARG NH1 1 1 3 1364 1 1 12 ARG NH2 N 11.097 -6.243 5.117 1.00 . A A . 12 ARG NH2 1 1 3 1365 1 1 12 ARG O O 7.087 -2.025 2.315 1.00 . A A . 12 ARG O 1 1 3 1366 1 1 13 HIS C C 6.677 -1.351 -0.594 1.00 . A A . 13 HIS C 1 1 3 1367 1 1 13 HIS CA C 7.066 -2.793 -0.268 1.00 . A A . 13 HIS CA 1 1 3 1368 1 1 13 HIS CB C 6.935 -3.659 -1.522 1.00 . A A . 13 HIS CB 1 1 3 1369 1 1 13 HIS CD2 C 9.343 -3.103 -2.420 1.00 . A A . 13 HIS CD2 1 1 3 1370 1 1 13 HIS CE1 C 8.810 -2.614 -4.463 1.00 . A A . 13 HIS CE1 1 1 3 1371 1 1 13 HIS CG C 7.980 -3.251 -2.524 1.00 . A A . 13 HIS CG 1 1 3 1372 1 1 13 HIS H H 5.405 -3.888 0.532 1.00 . A A . 13 HIS H 1 1 3 1373 1 1 13 HIS HA H 8.075 -2.823 0.117 1.00 . A A . 13 HIS HA 1 1 3 1374 1 1 13 HIS HB2 H 7.070 -4.698 -1.260 1.00 . A A . 13 HIS HB2 1 1 3 1375 1 1 13 HIS HB3 H 5.953 -3.522 -1.954 1.00 . A A . 13 HIS HB3 1 1 3 1376 1 1 13 HIS HD1 H 6.769 -2.940 -4.232 1.00 . A A . 13 HIS HD1 1 1 3 1377 1 1 13 HIS HD2 H 9.920 -3.273 -1.523 1.00 . A A . 13 HIS HD2 1 1 3 1378 1 1 13 HIS HE1 H 8.869 -2.323 -5.500 1.00 . A A . 13 HIS HE1 1 1 3 1379 1 1 13 HIS N N 6.112 -3.255 0.773 1.00 . A A . 13 HIS N 1 1 3 1380 1 1 13 HIS ND1 N 7.665 -2.934 -3.835 1.00 . A A . 13 HIS ND1 1 1 3 1381 1 1 13 HIS NE2 N 9.864 -2.700 -3.648 1.00 . A A . 13 HIS NE2 1 1 3 1382 1 1 13 HIS O O 7.486 -0.455 -0.512 1.00 . A A . 13 HIS O 1 1 3 1383 1 1 14 ALA C C 5.538 1.267 -0.188 1.00 . A A . 14 ALA C 1 1 3 1384 1 1 14 ALA CA C 5.065 0.305 -1.280 1.00 . A A . 14 ALA CA 1 1 3 1385 1 1 14 ALA CB C 3.552 0.451 -1.429 1.00 . A A . 14 ALA CB 1 1 3 1386 1 1 14 ALA H H 4.800 -1.844 -1.025 1.00 . A A . 14 ALA H 1 1 3 1387 1 1 14 ALA HA H 5.535 0.606 -2.203 1.00 . A A . 14 ALA HA 1 1 3 1388 1 1 14 ALA HB1 H 3.059 0.103 -0.534 1.00 . A A . 14 ALA HB1 1 1 3 1389 1 1 14 ALA HB2 H 3.321 1.495 -1.590 1.00 . A A . 14 ALA HB2 1 1 3 1390 1 1 14 ALA HB3 H 3.223 -0.134 -2.275 1.00 . A A . 14 ALA HB3 1 1 3 1391 1 1 14 ALA N N 5.448 -1.105 -0.962 1.00 . A A . 14 ALA N 1 1 3 1392 1 1 14 ALA O O 6.312 2.165 -0.449 1.00 . A A . 14 ALA O 1 1 3 1393 1 1 15 LYS C C 7.081 1.936 2.193 1.00 . A A . 15 LYS C 1 1 3 1394 1 1 15 LYS CA C 5.549 2.035 2.099 1.00 . A A . 15 LYS CA 1 1 3 1395 1 1 15 LYS CB C 4.905 1.602 3.420 1.00 . A A . 15 LYS CB 1 1 3 1396 1 1 15 LYS CD C 5.279 1.158 5.847 1.00 . A A . 15 LYS CD 1 1 3 1397 1 1 15 LYS CE C 6.157 1.550 7.037 1.00 . A A . 15 LYS CE 1 1 3 1398 1 1 15 LYS CG C 5.938 1.623 4.547 1.00 . A A . 15 LYS CG 1 1 3 1399 1 1 15 LYS H H 4.470 0.382 1.237 1.00 . A A . 15 LYS H 1 1 3 1400 1 1 15 LYS HA H 5.237 3.052 1.861 1.00 . A A . 15 LYS HA 1 1 3 1401 1 1 15 LYS HB2 H 4.105 2.289 3.660 1.00 . A A . 15 LYS HB2 1 1 3 1402 1 1 15 LYS HB3 H 4.499 0.607 3.324 1.00 . A A . 15 LYS HB3 1 1 3 1403 1 1 15 LYS HD2 H 4.309 1.623 5.943 1.00 . A A . 15 LYS HD2 1 1 3 1404 1 1 15 LYS HD3 H 5.164 0.083 5.831 1.00 . A A . 15 LYS HD3 1 1 3 1405 1 1 15 LYS HE2 H 6.076 0.797 7.808 1.00 . A A . 15 LYS HE2 1 1 3 1406 1 1 15 LYS HE3 H 7.185 1.627 6.716 1.00 . A A . 15 LYS HE3 1 1 3 1407 1 1 15 LYS HG2 H 6.758 0.965 4.298 1.00 . A A . 15 LYS HG2 1 1 3 1408 1 1 15 LYS HG3 H 6.303 2.629 4.678 1.00 . A A . 15 LYS HG3 1 1 3 1409 1 1 15 LYS HZ1 H 4.718 3.031 7.291 1.00 . A A . 15 LYS HZ1 1 1 3 1410 1 1 15 LYS HZ2 H 5.771 2.855 8.614 1.00 . A A . 15 LYS HZ2 1 1 3 1411 1 1 15 LYS HZ3 H 6.311 3.620 7.203 1.00 . A A . 15 LYS HZ3 1 1 3 1412 1 1 15 LYS N N 5.095 1.106 1.027 1.00 . A A . 15 LYS N 1 1 3 1413 1 1 15 LYS NZ N 5.705 2.863 7.576 1.00 . A A . 15 LYS NZ 1 1 3 1414 1 1 15 LYS O O 7.738 2.918 2.476 1.00 . A A . 15 LYS O 1 1 3 1415 1 1 16 SER C C 9.870 0.773 0.699 1.00 . A A . 16 SER C 1 1 3 1416 1 1 16 SER CA C 9.168 0.659 2.058 1.00 . A A . 16 SER CA 1 1 3 1417 1 1 16 SER CB C 9.471 -0.751 2.549 1.00 . A A . 16 SER CB 1 1 3 1418 1 1 16 SER H H 7.179 -0.031 1.741 1.00 . A A . 16 SER H 1 1 3 1419 1 1 16 SER HA H 9.583 1.347 2.775 1.00 . A A . 16 SER HA 1 1 3 1420 1 1 16 SER HB2 H 9.054 -1.450 1.838 1.00 . A A . 16 SER HB2 1 1 3 1421 1 1 16 SER HB3 H 10.541 -0.891 2.588 1.00 . A A . 16 SER HB3 1 1 3 1422 1 1 16 SER HG H 8.893 -0.121 4.297 1.00 . A A . 16 SER HG 1 1 3 1423 1 1 16 SER N N 7.681 0.785 1.969 1.00 . A A . 16 SER N 1 1 3 1424 1 1 16 SER O O 11.034 0.442 0.587 1.00 . A A . 16 SER O 1 1 3 1425 1 1 16 SER OG O 8.859 -0.952 3.816 1.00 . A A . 16 SER OG 1 1 3 1426 1 1 17 LEU C C 10.032 2.762 -2.128 1.00 . A A . 17 LEU C 1 1 3 1427 1 1 17 LEU CA C 9.912 1.315 -1.649 1.00 . A A . 17 LEU CA 1 1 3 1428 1 1 17 LEU CB C 9.178 0.403 -2.637 1.00 . A A . 17 LEU CB 1 1 3 1429 1 1 17 LEU CD1 C 8.446 2.048 -4.333 1.00 . A A . 17 LEU CD1 1 1 3 1430 1 1 17 LEU CD2 C 7.081 -0.014 -3.833 1.00 . A A . 17 LEU CD2 1 1 3 1431 1 1 17 LEU CG C 7.963 1.091 -3.246 1.00 . A A . 17 LEU CG 1 1 3 1432 1 1 17 LEU H H 8.280 1.478 -0.247 1.00 . A A . 17 LEU H 1 1 3 1433 1 1 17 LEU HA H 10.916 0.944 -1.532 1.00 . A A . 17 LEU HA 1 1 3 1434 1 1 17 LEU HB2 H 9.843 0.114 -3.434 1.00 . A A . 17 LEU HB2 1 1 3 1435 1 1 17 LEU HB3 H 8.846 -0.482 -2.116 1.00 . A A . 17 LEU HB3 1 1 3 1436 1 1 17 LEU HD11 H 9.525 2.075 -4.306 1.00 . A A . 17 LEU HD11 1 1 3 1437 1 1 17 LEU HD12 H 8.107 1.699 -5.298 1.00 . A A . 17 LEU HD12 1 1 3 1438 1 1 17 LEU HD13 H 8.053 3.035 -4.139 1.00 . A A . 17 LEU HD13 1 1 3 1439 1 1 17 LEU HD21 H 7.077 -0.845 -3.142 1.00 . A A . 17 LEU HD21 1 1 3 1440 1 1 17 LEU HD22 H 6.072 0.344 -3.967 1.00 . A A . 17 LEU HD22 1 1 3 1441 1 1 17 LEU HD23 H 7.478 -0.333 -4.785 1.00 . A A . 17 LEU HD23 1 1 3 1442 1 1 17 LEU HG H 7.432 1.629 -2.476 1.00 . A A . 17 LEU HG 1 1 3 1443 1 1 17 LEU N N 9.217 1.217 -0.336 1.00 . A A . 17 LEU N 1 1 3 1444 1 1 17 LEU O O 11.040 3.151 -2.683 1.00 . A A . 17 LEU O 1 1 3 1445 1 1 18 GLY C C 7.773 5.474 -2.892 1.00 . A A . 18 GLY C 1 1 3 1446 1 1 18 GLY CA C 9.125 4.983 -2.377 1.00 . A A . 18 GLY CA 1 1 3 1447 1 1 18 GLY H H 8.225 3.245 -1.474 1.00 . A A . 18 GLY H 1 1 3 1448 1 1 18 GLY HA2 H 9.439 5.600 -1.549 1.00 . A A . 18 GLY HA2 1 1 3 1449 1 1 18 GLY HA3 H 9.851 5.056 -3.173 1.00 . A A . 18 GLY HA3 1 1 3 1450 1 1 18 GLY N N 9.030 3.568 -1.923 1.00 . A A . 18 GLY N 1 1 3 1451 1 1 18 GLY O O 7.615 6.637 -3.208 1.00 . A A . 18 GLY O 1 1 3 1452 1 1 19 ASN C C 4.637 5.645 -2.341 1.00 . A A . 19 ASN C 1 1 3 1453 1 1 19 ASN CA C 5.474 5.075 -3.490 1.00 . A A . 19 ASN CA 1 1 3 1454 1 1 19 ASN CB C 4.853 3.862 -4.183 1.00 . A A . 19 ASN CB 1 1 3 1455 1 1 19 ASN CG C 5.532 3.654 -5.533 1.00 . A A . 19 ASN CG 1 1 3 1456 1 1 19 ASN H H 6.893 3.677 -2.745 1.00 . A A . 19 ASN H 1 1 3 1457 1 1 19 ASN HA H 5.646 5.848 -4.224 1.00 . A A . 19 ASN HA 1 1 3 1458 1 1 19 ASN HB2 H 4.981 2.986 -3.588 1.00 . A A . 19 ASN HB2 1 1 3 1459 1 1 19 ASN HB3 H 3.803 3.940 -4.317 1.00 . A A . 19 ASN HB3 1 1 3 1460 1 1 19 ASN HD21 H 5.753 1.725 -5.175 1.00 . A A . 19 ASN HD21 1 1 3 1461 1 1 19 ASN HD22 H 6.358 2.252 -6.676 1.00 . A A . 19 ASN HD22 1 1 3 1462 1 1 19 ASN N N 6.792 4.619 -2.990 1.00 . A A . 19 ASN N 1 1 3 1463 1 1 19 ASN ND2 N 5.916 2.444 -5.824 1.00 . A A . 19 ASN ND2 1 1 3 1464 1 1 19 ASN O O 4.623 6.845 -2.154 1.00 . A A . 19 ASN O 1 1 3 1465 1 1 19 ASN OD1 O 5.712 4.571 -6.310 1.00 . A A . 19 ASN OD1 1 1 3 1466 1 1 20 CYS C C 2.423 6.670 -0.849 1.00 . A A . 20 CYS C 1 1 3 1467 1 1 20 CYS CA C 3.129 5.369 -0.449 1.00 . A A . 20 CYS CA 1 1 3 1468 1 1 20 CYS CB C 4.075 5.658 0.719 1.00 . A A . 20 CYS CB 1 1 3 1469 1 1 20 CYS H H 3.973 3.869 -1.736 1.00 . A A . 20 CYS H 1 1 3 1470 1 1 20 CYS HA H 2.410 4.628 -0.138 1.00 . A A . 20 CYS HA 1 1 3 1471 1 1 20 CYS HB2 H 4.817 4.878 0.773 1.00 . A A . 20 CYS HB2 1 1 3 1472 1 1 20 CYS HB3 H 4.570 6.600 0.532 1.00 . A A . 20 CYS HB3 1 1 3 1473 1 1 20 CYS N N 3.951 4.835 -1.576 1.00 . A A . 20 CYS N 1 1 3 1474 1 1 20 CYS O O 2.142 7.487 0.006 1.00 . A A . 20 CYS O 1 1 3 1475 1 1 20 CYS SG S 3.202 5.736 2.305 1.00 . A A . 20 CYS SG 1 1 3 1476 1 1 21 ARG C C 1.836 8.384 -4.077 1.00 . A A . 21 ARG C 1 1 3 1477 1 1 21 ARG CA C 1.464 8.086 -2.620 1.00 . A A . 21 ARG CA 1 1 3 1478 1 1 21 ARG CB C 1.900 9.291 -1.791 1.00 . A A . 21 ARG CB 1 1 3 1479 1 1 21 ARG CD C 1.421 10.260 0.466 1.00 . A A . 21 ARG CD 1 1 3 1480 1 1 21 ARG CG C 0.799 9.651 -0.793 1.00 . A A . 21 ARG CG 1 1 3 1481 1 1 21 ARG CZ C 1.371 12.682 0.425 1.00 . A A . 21 ARG CZ 1 1 3 1482 1 1 21 ARG H H 2.398 6.160 -2.753 1.00 . A A . 21 ARG H 1 1 3 1483 1 1 21 ARG HA H 0.392 7.988 -2.542 1.00 . A A . 21 ARG HA 1 1 3 1484 1 1 21 ARG HB2 H 2.805 9.026 -1.264 1.00 . A A . 21 ARG HB2 1 1 3 1485 1 1 21 ARG HB3 H 2.089 10.131 -2.442 1.00 . A A . 21 ARG HB3 1 1 3 1486 1 1 21 ARG HD2 H 1.273 9.592 1.302 1.00 . A A . 21 ARG HD2 1 1 3 1487 1 1 21 ARG HD3 H 2.478 10.409 0.308 1.00 . A A . 21 ARG HD3 1 1 3 1488 1 1 21 ARG HE H -0.100 11.596 1.200 1.00 . A A . 21 ARG HE 1 1 3 1489 1 1 21 ARG HG2 H 0.124 10.363 -1.245 1.00 . A A . 21 ARG HG2 1 1 3 1490 1 1 21 ARG HG3 H 0.253 8.758 -0.524 1.00 . A A . 21 ARG HG3 1 1 3 1491 1 1 21 ARG HH11 H 1.320 12.300 -1.539 1.00 . A A . 21 ARG HH11 1 1 3 1492 1 1 21 ARG HH12 H 2.058 13.800 -1.086 1.00 . A A . 21 ARG HH12 1 1 3 1493 1 1 21 ARG HH21 H 1.561 13.323 2.313 1.00 . A A . 21 ARG HH21 1 1 3 1494 1 1 21 ARG HH22 H 2.195 14.379 1.094 1.00 . A A . 21 ARG HH22 1 1 3 1495 1 1 21 ARG N N 2.147 6.854 -2.117 1.00 . A A . 21 ARG N 1 1 3 1496 1 1 21 ARG NE N 0.774 11.569 0.758 1.00 . A A . 21 ARG NE 1 1 3 1497 1 1 21 ARG NH1 N 1.601 12.948 -0.832 1.00 . A A . 21 ARG NH1 1 1 3 1498 1 1 21 ARG NH2 N 1.738 13.527 1.349 1.00 . A A . 21 ARG NH2 1 1 3 1499 1 1 21 ARG O O 1.111 9.083 -4.758 1.00 . A A . 21 ARG O 1 1 3 1500 1 1 22 THR C C 2.648 7.112 -6.883 1.00 . A A . 22 THR C 1 1 3 1501 1 1 22 THR CA C 3.278 8.189 -6.004 1.00 . A A . 22 THR CA 1 1 3 1502 1 1 22 THR CB C 4.798 8.178 -6.180 1.00 . A A . 22 THR CB 1 1 3 1503 1 1 22 THR CG2 C 5.450 9.076 -5.128 1.00 . A A . 22 THR CG2 1 1 3 1504 1 1 22 THR H H 3.532 7.323 -4.061 1.00 . A A . 22 THR H 1 1 3 1505 1 1 22 THR HA H 2.880 9.156 -6.276 1.00 . A A . 22 THR HA 1 1 3 1506 1 1 22 THR HB H 5.052 8.550 -7.161 1.00 . A A . 22 THR HB 1 1 3 1507 1 1 22 THR HG1 H 6.218 6.887 -5.865 1.00 . A A . 22 THR HG1 1 1 3 1508 1 1 22 THR HG21 H 4.708 9.388 -4.409 1.00 . A A . 22 THR HG21 1 1 3 1509 1 1 22 THR HG22 H 6.233 8.530 -4.624 1.00 . A A . 22 THR HG22 1 1 3 1510 1 1 22 THR HG23 H 5.872 9.946 -5.609 1.00 . A A . 22 THR HG23 1 1 3 1511 1 1 22 THR N N 2.933 7.888 -4.588 1.00 . A A . 22 THR N 1 1 3 1512 1 1 22 THR O O 2.413 7.308 -8.059 1.00 . A A . 22 THR O 1 1 3 1513 1 1 22 THR OG1 O 5.274 6.847 -6.038 1.00 . A A . 22 THR OG1 1 1 3 1514 1 1 23 SER C C 0.337 4.729 -6.573 1.00 . A A . 23 SER C 1 1 3 1515 1 1 23 SER CA C 1.759 4.883 -7.112 1.00 . A A . 23 SER CA 1 1 3 1516 1 1 23 SER CB C 2.607 3.634 -6.881 1.00 . A A . 23 SER CB 1 1 3 1517 1 1 23 SER H H 2.566 5.818 -5.360 1.00 . A A . 23 SER H 1 1 3 1518 1 1 23 SER HA H 1.739 5.152 -8.159 1.00 . A A . 23 SER HA 1 1 3 1519 1 1 23 SER HB2 H 3.283 3.812 -6.055 1.00 . A A . 23 SER HB2 1 1 3 1520 1 1 23 SER HB3 H 1.967 2.803 -6.620 1.00 . A A . 23 SER HB3 1 1 3 1521 1 1 23 SER HG H 3.269 2.429 -8.257 1.00 . A A . 23 SER HG 1 1 3 1522 1 1 23 SER N N 2.374 5.972 -6.312 1.00 . A A . 23 SER N 1 1 3 1523 1 1 23 SER O O 0.142 4.281 -5.464 1.00 . A A . 23 SER O 1 1 3 1524 1 1 23 SER OG O 3.367 3.360 -8.050 1.00 . A A . 23 SER OG 1 1 3 1525 1 1 24 GLN C C -2.280 3.629 -6.138 1.00 . A A . 24 GLN C 1 1 3 1526 1 1 24 GLN CA C -2.057 4.972 -6.835 1.00 . A A . 24 GLN CA 1 1 3 1527 1 1 24 GLN CB C -3.054 5.141 -7.983 1.00 . A A . 24 GLN CB 1 1 3 1528 1 1 24 GLN CD C -3.740 6.706 -9.807 1.00 . A A . 24 GLN CD 1 1 3 1529 1 1 24 GLN CG C -2.578 6.255 -8.919 1.00 . A A . 24 GLN CG 1 1 3 1530 1 1 24 GLN H H -0.485 5.464 -8.224 1.00 . A A . 24 GLN H 1 1 3 1531 1 1 24 GLN HA H -2.220 5.754 -6.107 1.00 . A A . 24 GLN HA 1 1 3 1532 1 1 24 GLN HB2 H -3.130 4.215 -8.533 1.00 . A A . 24 GLN HB2 1 1 3 1533 1 1 24 GLN HB3 H -4.022 5.405 -7.583 1.00 . A A . 24 GLN HB3 1 1 3 1534 1 1 24 GLN HE21 H -3.314 8.637 -9.626 1.00 . A A . 24 GLN HE21 1 1 3 1535 1 1 24 GLN HE22 H -4.661 8.279 -10.595 1.00 . A A . 24 GLN HE22 1 1 3 1536 1 1 24 GLN HG2 H -2.224 7.090 -8.332 1.00 . A A . 24 GLN HG2 1 1 3 1537 1 1 24 GLN HG3 H -1.778 5.885 -9.543 1.00 . A A . 24 GLN HG3 1 1 3 1538 1 1 24 GLN N N -0.657 5.099 -7.332 1.00 . A A . 24 GLN N 1 1 3 1539 1 1 24 GLN NE2 N -3.920 7.980 -10.027 1.00 . A A . 24 GLN NE2 1 1 3 1540 1 1 24 GLN O O -3.096 3.529 -5.245 1.00 . A A . 24 GLN O 1 1 3 1541 1 1 24 GLN OE1 O -4.491 5.892 -10.305 1.00 . A A . 24 GLN OE1 1 1 3 1542 1 1 25 LYS C C -0.873 1.242 -4.620 1.00 . A A . 25 LYS C 1 1 3 1543 1 1 25 LYS CA C -1.790 1.290 -5.840 1.00 . A A . 25 LYS CA 1 1 3 1544 1 1 25 LYS CB C -1.407 0.172 -6.806 1.00 . A A . 25 LYS CB 1 1 3 1545 1 1 25 LYS CD C -2.532 -1.863 -7.754 1.00 . A A . 25 LYS CD 1 1 3 1546 1 1 25 LYS CE C -3.285 -1.081 -8.830 1.00 . A A . 25 LYS CE 1 1 3 1547 1 1 25 LYS CG C -2.349 -0.988 -6.512 1.00 . A A . 25 LYS CG 1 1 3 1548 1 1 25 LYS H H -0.922 2.657 -7.231 1.00 . A A . 25 LYS H 1 1 3 1549 1 1 25 LYS HA H -2.822 1.183 -5.539 1.00 . A A . 25 LYS HA 1 1 3 1550 1 1 25 LYS HB2 H -1.524 0.517 -7.824 1.00 . A A . 25 LYS HB2 1 1 3 1551 1 1 25 LYS HB3 H -0.389 -0.142 -6.630 1.00 . A A . 25 LYS HB3 1 1 3 1552 1 1 25 LYS HD2 H -1.563 -2.159 -8.131 1.00 . A A . 25 LYS HD2 1 1 3 1553 1 1 25 LYS HD3 H -3.101 -2.743 -7.493 1.00 . A A . 25 LYS HD3 1 1 3 1554 1 1 25 LYS HE2 H -4.173 -0.642 -8.402 1.00 . A A . 25 LYS HE2 1 1 3 1555 1 1 25 LYS HE3 H -2.648 -0.299 -9.219 1.00 . A A . 25 LYS HE3 1 1 3 1556 1 1 25 LYS HG2 H -1.950 -1.568 -5.690 1.00 . A A . 25 LYS HG2 1 1 3 1557 1 1 25 LYS HG3 H -3.295 -0.556 -6.230 1.00 . A A . 25 LYS HG3 1 1 3 1558 1 1 25 LYS HZ1 H -2.832 -2.543 -10.239 1.00 . A A . 25 LYS HZ1 1 1 3 1559 1 1 25 LYS HZ2 H -4.404 -2.659 -9.603 1.00 . A A . 25 LYS HZ2 1 1 3 1560 1 1 25 LYS HZ3 H -4.041 -1.454 -10.736 1.00 . A A . 25 LYS HZ3 1 1 3 1561 1 1 25 LYS N N -1.582 2.594 -6.514 1.00 . A A . 25 LYS N 1 1 3 1562 1 1 25 LYS NZ N -3.669 -2.003 -9.935 1.00 . A A . 25 LYS NZ 1 1 3 1563 1 1 25 LYS O O -1.260 0.972 -3.501 1.00 . A A . 25 LYS O 1 1 3 1564 1 1 26 TYR C C 0.934 2.506 -2.596 1.00 . A A . 26 TYR C 1 1 3 1565 1 1 26 TYR CA C 1.309 1.477 -3.665 1.00 . A A . 26 TYR CA 1 1 3 1566 1 1 26 TYR CB C 2.719 1.658 -4.199 1.00 . A A . 26 TYR CB 1 1 3 1567 1 1 26 TYR CD1 C 2.724 -0.871 -4.426 1.00 . A A . 26 TYR CD1 1 1 3 1568 1 1 26 TYR CD2 C 3.840 0.459 -6.101 1.00 . A A . 26 TYR CD2 1 1 3 1569 1 1 26 TYR CE1 C 3.090 -2.026 -5.102 1.00 . A A . 26 TYR CE1 1 1 3 1570 1 1 26 TYR CE2 C 4.206 -0.704 -6.780 1.00 . A A . 26 TYR CE2 1 1 3 1571 1 1 26 TYR CG C 3.097 0.387 -4.919 1.00 . A A . 26 TYR CG 1 1 3 1572 1 1 26 TYR CZ C 3.834 -1.960 -6.285 1.00 . A A . 26 TYR CZ 1 1 3 1573 1 1 26 TYR H H 0.708 1.733 -5.720 1.00 . A A . 26 TYR H 1 1 3 1574 1 1 26 TYR HA H 1.240 0.496 -3.228 1.00 . A A . 26 TYR HA 1 1 3 1575 1 1 26 TYR HB2 H 2.728 2.497 -4.866 1.00 . A A . 26 TYR HB2 1 1 3 1576 1 1 26 TYR HB3 H 3.411 1.835 -3.395 1.00 . A A . 26 TYR HB3 1 1 3 1577 1 1 26 TYR HD1 H 2.150 -1.009 -3.525 1.00 . A A . 26 TYR HD1 1 1 3 1578 1 1 26 TYR HD2 H 4.127 1.418 -6.494 1.00 . A A . 26 TYR HD2 1 1 3 1579 1 1 26 TYR HE1 H 2.770 -2.953 -4.665 1.00 . A A . 26 TYR HE1 1 1 3 1580 1 1 26 TYR HE2 H 4.781 -0.620 -7.687 1.00 . A A . 26 TYR HE2 1 1 3 1581 1 1 26 TYR HH H 5.153 -3.176 -6.937 1.00 . A A . 26 TYR HH 1 1 3 1582 1 1 26 TYR N N 0.382 1.511 -4.822 1.00 . A A . 26 TYR N 1 1 3 1583 1 1 26 TYR O O 1.503 2.538 -1.524 1.00 . A A . 26 TYR O 1 1 3 1584 1 1 26 TYR OH O 4.195 -3.113 -6.951 1.00 . A A . 26 TYR OH 1 1 3 1585 1 1 27 ARG C C -1.830 3.957 -1.407 1.00 . A A . 27 ARG C 1 1 3 1586 1 1 27 ARG CA C -0.417 4.359 -1.837 1.00 . A A . 27 ARG CA 1 1 3 1587 1 1 27 ARG CB C -0.380 5.766 -2.438 1.00 . A A . 27 ARG CB 1 1 3 1588 1 1 27 ARG CD C -1.684 7.576 -3.547 1.00 . A A . 27 ARG CD 1 1 3 1589 1 1 27 ARG CG C -1.713 6.116 -3.095 1.00 . A A . 27 ARG CG 1 1 3 1590 1 1 27 ARG CZ C -2.694 8.368 -1.490 1.00 . A A . 27 ARG CZ 1 1 3 1591 1 1 27 ARG H H -0.489 3.342 -3.707 1.00 . A A . 27 ARG H 1 1 3 1592 1 1 27 ARG HA H 0.247 4.274 -0.987 1.00 . A A . 27 ARG HA 1 1 3 1593 1 1 27 ARG HB2 H -0.184 6.474 -1.648 1.00 . A A . 27 ARG HB2 1 1 3 1594 1 1 27 ARG HB3 H 0.404 5.818 -3.181 1.00 . A A . 27 ARG HB3 1 1 3 1595 1 1 27 ARG HD2 H -0.771 7.752 -4.096 1.00 . A A . 27 ARG HD2 1 1 3 1596 1 1 27 ARG HD3 H -2.530 7.763 -4.193 1.00 . A A . 27 ARG HD3 1 1 3 1597 1 1 27 ARG HE H -1.052 9.177 -2.254 1.00 . A A . 27 ARG HE 1 1 3 1598 1 1 27 ARG HG2 H -1.833 5.484 -3.963 1.00 . A A . 27 ARG HG2 1 1 3 1599 1 1 27 ARG HG3 H -2.519 5.970 -2.389 1.00 . A A . 27 ARG HG3 1 1 3 1600 1 1 27 ARG HH11 H -3.839 7.260 -2.692 1.00 . A A . 27 ARG HH11 1 1 3 1601 1 1 27 ARG HH12 H -4.500 7.589 -1.124 1.00 . A A . 27 ARG HH12 1 1 3 1602 1 1 27 ARG HH21 H -1.761 9.451 -0.088 1.00 . A A . 27 ARG HH21 1 1 3 1603 1 1 27 ARG HH22 H -3.317 8.834 0.354 1.00 . A A . 27 ARG HH22 1 1 3 1604 1 1 27 ARG N N -0.021 3.355 -2.853 1.00 . A A . 27 ARG N 1 1 3 1605 1 1 27 ARG NE N -1.738 8.487 -2.368 1.00 . A A . 27 ARG NE 1 1 3 1606 1 1 27 ARG NH1 N -3.762 7.685 -1.791 1.00 . A A . 27 ARG NH1 1 1 3 1607 1 1 27 ARG NH2 N -2.581 8.928 -0.316 1.00 . A A . 27 ARG NH2 1 1 3 1608 1 1 27 ARG O O -2.133 3.828 -0.236 1.00 . A A . 27 ARG O 1 1 3 1609 1 1 28 ALA C C -4.088 1.849 -1.728 1.00 . A A . 28 ALA C 1 1 3 1610 1 1 28 ALA CA C -4.104 3.346 -2.047 1.00 . A A . 28 ALA CA 1 1 3 1611 1 1 28 ALA CB C -4.995 3.606 -3.263 1.00 . A A . 28 ALA CB 1 1 3 1612 1 1 28 ALA H H -2.435 3.853 -3.288 1.00 . A A . 28 ALA H 1 1 3 1613 1 1 28 ALA HA H -4.463 3.899 -1.190 1.00 . A A . 28 ALA HA 1 1 3 1614 1 1 28 ALA HB1 H -4.709 4.538 -3.727 1.00 . A A . 28 ALA HB1 1 1 3 1615 1 1 28 ALA HB2 H -4.880 2.800 -3.973 1.00 . A A . 28 ALA HB2 1 1 3 1616 1 1 28 ALA HB3 H -6.026 3.662 -2.948 1.00 . A A . 28 ALA HB3 1 1 3 1617 1 1 28 ALA N N -2.704 3.748 -2.357 1.00 . A A . 28 ALA N 1 1 3 1618 1 1 28 ALA O O -4.487 1.436 -0.659 1.00 . A A . 28 ALA O 1 1 3 1619 1 1 29 ASN C C -2.743 -0.698 -1.121 1.00 . A A . 29 ASN C 1 1 3 1620 1 1 29 ASN CA C -3.604 -0.435 -2.355 1.00 . A A . 29 ASN CA 1 1 3 1621 1 1 29 ASN CB C -3.087 -1.243 -3.551 1.00 . A A . 29 ASN CB 1 1 3 1622 1 1 29 ASN CG C -4.273 -1.653 -4.426 1.00 . A A . 29 ASN CG 1 1 3 1623 1 1 29 ASN H H -3.315 1.372 -3.498 1.00 . A A . 29 ASN H 1 1 3 1624 1 1 29 ASN HA H -4.604 -0.748 -2.112 1.00 . A A . 29 ASN HA 1 1 3 1625 1 1 29 ASN HB2 H -2.398 -0.649 -4.131 1.00 . A A . 29 ASN HB2 1 1 3 1626 1 1 29 ASN HB3 H -2.587 -2.133 -3.201 1.00 . A A . 29 ASN HB3 1 1 3 1627 1 1 29 ASN HD21 H -5.243 0.060 -4.162 1.00 . A A . 29 ASN HD21 1 1 3 1628 1 1 29 ASN HD22 H -6.027 -1.074 -5.153 1.00 . A A . 29 ASN HD22 1 1 3 1629 1 1 29 ASN N N -3.633 1.028 -2.639 1.00 . A A . 29 ASN N 1 1 3 1630 1 1 29 ASN ND2 N -5.264 -0.820 -4.594 1.00 . A A . 29 ASN ND2 1 1 3 1631 1 1 29 ASN O O -2.787 -1.766 -0.541 1.00 . A A . 29 ASN O 1 1 3 1632 1 1 29 ASN OD1 O -4.299 -2.743 -4.963 1.00 . A A . 29 ASN OD1 1 1 3 1633 1 1 30 CYS C C -1.431 1.151 1.508 1.00 . A A . 30 CYS C 1 1 3 1634 1 1 30 CYS CA C -1.104 0.064 0.489 1.00 . A A . 30 CYS CA 1 1 3 1635 1 1 30 CYS CB C 0.348 0.092 0.026 1.00 . A A . 30 CYS CB 1 1 3 1636 1 1 30 CYS H H -1.934 1.119 -1.186 1.00 . A A . 30 CYS H 1 1 3 1637 1 1 30 CYS HA H -1.324 -0.890 0.944 1.00 . A A . 30 CYS HA 1 1 3 1638 1 1 30 CYS HB2 H 0.579 1.062 -0.381 1.00 . A A . 30 CYS HB2 1 1 3 1639 1 1 30 CYS HB3 H 1.012 -0.153 0.841 1.00 . A A . 30 CYS HB3 1 1 3 1640 1 1 30 CYS N N -1.961 0.263 -0.710 1.00 . A A . 30 CYS N 1 1 3 1641 1 1 30 CYS O O -0.580 1.699 2.181 1.00 . A A . 30 CYS O 1 1 3 1642 1 1 30 CYS SG S 0.442 -1.198 -1.235 1.00 . A A . 30 CYS SG 1 1 3 1643 1 1 31 ALA C C -2.937 1.940 3.963 1.00 . A A . 31 ALA C 1 1 3 1644 1 1 31 ALA CA C -3.180 2.477 2.548 1.00 . A A . 31 ALA CA 1 1 3 1645 1 1 31 ALA CB C -4.673 2.714 2.311 1.00 . A A . 31 ALA CB 1 1 3 1646 1 1 31 ALA H H -3.343 0.968 1.035 1.00 . A A . 31 ALA H 1 1 3 1647 1 1 31 ALA HA H -2.615 3.383 2.372 1.00 . A A . 31 ALA HA 1 1 3 1648 1 1 31 ALA HB1 H -5.075 1.901 1.722 1.00 . A A . 31 ALA HB1 1 1 3 1649 1 1 31 ALA HB2 H -5.187 2.757 3.261 1.00 . A A . 31 ALA HB2 1 1 3 1650 1 1 31 ALA HB3 H -4.815 3.643 1.780 1.00 . A A . 31 ALA HB3 1 1 3 1651 1 1 31 ALA N N -2.699 1.442 1.598 1.00 . A A . 31 ALA N 1 1 3 1652 1 1 31 ALA O O -2.858 2.675 4.927 1.00 . A A . 31 ALA O 1 1 3 1653 1 1 32 LYS C C -1.050 -0.011 5.634 1.00 . A A . 32 LYS C 1 1 3 1654 1 1 32 LYS CA C -2.566 -0.002 5.407 1.00 . A A . 32 LYS CA 1 1 3 1655 1 1 32 LYS CB C -3.077 -1.441 5.324 1.00 . A A . 32 LYS CB 1 1 3 1656 1 1 32 LYS CD C -0.958 -2.808 5.393 1.00 . A A . 32 LYS CD 1 1 3 1657 1 1 32 LYS CE C -0.639 -4.288 5.636 1.00 . A A . 32 LYS CE 1 1 3 1658 1 1 32 LYS CG C -2.218 -2.395 6.161 1.00 . A A . 32 LYS CG 1 1 3 1659 1 1 32 LYS H H -2.876 0.073 3.297 1.00 . A A . 32 LYS H 1 1 3 1660 1 1 32 LYS HA H -3.077 0.532 6.196 1.00 . A A . 32 LYS HA 1 1 3 1661 1 1 32 LYS HB2 H -4.096 -1.465 5.681 1.00 . A A . 32 LYS HB2 1 1 3 1662 1 1 32 LYS HB3 H -3.058 -1.753 4.291 1.00 . A A . 32 LYS HB3 1 1 3 1663 1 1 32 LYS HD2 H -1.115 -2.647 4.337 1.00 . A A . 32 LYS HD2 1 1 3 1664 1 1 32 LYS HD3 H -0.125 -2.207 5.726 1.00 . A A . 32 LYS HD3 1 1 3 1665 1 1 32 LYS HE2 H -1.231 -4.892 4.966 1.00 . A A . 32 LYS HE2 1 1 3 1666 1 1 32 LYS HE3 H 0.410 -4.494 5.458 1.00 . A A . 32 LYS HE3 1 1 3 1667 1 1 32 LYS HG2 H -1.932 -1.909 7.082 1.00 . A A . 32 LYS HG2 1 1 3 1668 1 1 32 LYS HG3 H -2.798 -3.277 6.386 1.00 . A A . 32 LYS HG3 1 1 3 1669 1 1 32 LYS HZ1 H -0.737 -3.846 7.670 1.00 . A A . 32 LYS HZ1 1 1 3 1670 1 1 32 LYS HZ2 H -2.000 -4.831 7.119 1.00 . A A . 32 LYS HZ2 1 1 3 1671 1 1 32 LYS HZ3 H -0.444 -5.485 7.327 1.00 . A A . 32 LYS HZ3 1 1 3 1672 1 1 32 LYS N N -2.812 0.645 4.088 1.00 . A A . 32 LYS N 1 1 3 1673 1 1 32 LYS NZ N -0.980 -4.639 7.044 1.00 . A A . 32 LYS NZ 1 1 3 1674 1 1 32 LYS O O -0.566 -0.146 6.739 1.00 . A A . 32 LYS O 1 1 3 1675 1 1 33 THR C C 1.590 1.447 3.897 1.00 . A A . 33 THR C 1 1 3 1676 1 1 33 THR CA C 1.178 0.156 4.591 1.00 . A A . 33 THR CA 1 1 3 1677 1 1 33 THR CB C 1.747 -0.955 3.731 1.00 . A A . 33 THR CB 1 1 3 1678 1 1 33 THR CG2 C 3.199 -1.164 4.136 1.00 . A A . 33 THR CG2 1 1 3 1679 1 1 33 THR H H -0.727 0.245 3.696 1.00 . A A . 33 THR H 1 1 3 1680 1 1 33 THR HA H 1.572 0.123 5.591 1.00 . A A . 33 THR HA 1 1 3 1681 1 1 33 THR HB H 1.732 -0.582 2.724 1.00 . A A . 33 THR HB 1 1 3 1682 1 1 33 THR HG1 H 1.595 -2.882 3.936 1.00 . A A . 33 THR HG1 1 1 3 1683 1 1 33 THR HG21 H 3.494 -0.373 4.809 1.00 . A A . 33 THR HG21 1 1 3 1684 1 1 33 THR HG22 H 3.302 -2.119 4.627 1.00 . A A . 33 THR HG22 1 1 3 1685 1 1 33 THR HG23 H 3.817 -1.138 3.251 1.00 . A A . 33 THR HG23 1 1 3 1686 1 1 33 THR N N -0.308 0.137 4.567 1.00 . A A . 33 THR N 1 1 3 1687 1 1 33 THR O O 2.311 1.501 2.921 1.00 . A A . 33 THR O 1 1 3 1688 1 1 33 THR OG1 O 0.985 -2.146 3.852 1.00 . A A . 33 THR OG1 1 1 3 1689 1 1 34 CYS C C 0.490 4.850 4.877 1.00 . A A . 34 CYS C 1 1 3 1690 1 1 34 CYS CA C 1.292 3.863 4.021 1.00 . A A . 34 CYS CA 1 1 3 1691 1 1 34 CYS CB C 0.797 3.943 2.582 1.00 . A A . 34 CYS CB 1 1 3 1692 1 1 34 CYS H H 0.512 2.243 5.246 1.00 . A A . 34 CYS H 1 1 3 1693 1 1 34 CYS HA H 2.344 4.104 4.042 1.00 . A A . 34 CYS HA 1 1 3 1694 1 1 34 CYS HB2 H 1.242 3.144 2.011 1.00 . A A . 34 CYS HB2 1 1 3 1695 1 1 34 CYS HB3 H -0.272 3.815 2.575 1.00 . A A . 34 CYS HB3 1 1 3 1696 1 1 34 CYS N N 1.067 2.466 4.483 1.00 . A A . 34 CYS N 1 1 3 1697 1 1 34 CYS O O 0.908 5.971 5.087 1.00 . A A . 34 CYS O 1 1 3 1698 1 1 34 CYS SG S 1.237 5.550 1.877 1.00 . A A . 34 CYS SG 1 1 3 1699 1 1 35 GLU C C -2.285 6.268 5.310 1.00 . A A . 35 GLU C 1 1 3 1700 1 1 35 GLU CA C -1.523 5.295 6.203 1.00 . A A . 35 GLU CA 1 1 3 1701 1 1 35 GLU CB C -0.732 6.013 7.297 1.00 . A A . 35 GLU CB 1 1 3 1702 1 1 35 GLU CD C 0.084 5.455 9.598 1.00 . A A . 35 GLU CD 1 1 3 1703 1 1 35 GLU CG C -1.060 5.283 8.598 1.00 . A A . 35 GLU CG 1 1 3 1704 1 1 35 GLU H H -0.954 3.523 5.166 1.00 . A A . 35 GLU H 1 1 3 1705 1 1 35 GLU HA H -2.260 4.643 6.657 1.00 . A A . 35 GLU HA 1 1 3 1706 1 1 35 GLU HB2 H 0.328 5.960 7.097 1.00 . A A . 35 GLU HB2 1 1 3 1707 1 1 35 GLU HB3 H -1.053 7.039 7.386 1.00 . A A . 35 GLU HB3 1 1 3 1708 1 1 35 GLU HG2 H -1.979 5.680 9.005 1.00 . A A . 35 GLU HG2 1 1 3 1709 1 1 35 GLU HG3 H -1.190 4.234 8.376 1.00 . A A . 35 GLU HG3 1 1 3 1710 1 1 35 GLU N N -0.650 4.433 5.361 1.00 . A A . 35 GLU N 1 1 3 1711 1 1 35 GLU O O -2.288 7.472 5.468 1.00 . A A . 35 GLU O 1 1 3 1712 1 1 35 GLU OE1 O 1.149 5.883 9.182 1.00 . A A . 35 GLU OE1 1 1 3 1713 1 1 35 GLU OE2 O -0.122 5.156 10.763 1.00 . A A . 35 GLU OE2 1 1 3 1714 1 1 36 LEU C C -5.205 5.872 3.506 1.00 . A A . 36 LEU C 1 1 3 1715 1 1 36 LEU CA C -3.764 6.360 3.345 1.00 . A A . 36 LEU CA 1 1 3 1716 1 1 36 LEU CB C -3.250 5.986 1.956 1.00 . A A . 36 LEU CB 1 1 3 1717 1 1 36 LEU CD1 C -1.290 6.162 0.426 1.00 . A A . 36 LEU CD1 1 1 3 1718 1 1 36 LEU CD2 C -1.400 7.585 2.473 1.00 . A A . 36 LEU CD2 1 1 3 1719 1 1 36 LEU CG C -1.741 6.214 1.885 1.00 . A A . 36 LEU CG 1 1 3 1720 1 1 36 LEU H H -2.868 4.686 4.322 1.00 . A A . 36 LEU H 1 1 3 1721 1 1 36 LEU HA H -3.712 7.426 3.483 1.00 . A A . 36 LEU HA 1 1 3 1722 1 1 36 LEU HB2 H -3.483 4.955 1.789 1.00 . A A . 36 LEU HB2 1 1 3 1723 1 1 36 LEU HB3 H -3.737 6.557 1.185 1.00 . A A . 36 LEU HB3 1 1 3 1724 1 1 36 LEU HD11 H -2.153 6.110 -0.222 1.00 . A A . 36 LEU HD11 1 1 3 1725 1 1 36 LEU HD12 H -0.705 7.038 0.190 1.00 . A A . 36 LEU HD12 1 1 3 1726 1 1 36 LEU HD13 H -0.688 5.276 0.290 1.00 . A A . 36 LEU HD13 1 1 3 1727 1 1 36 LEU HD21 H -2.279 8.212 2.463 1.00 . A A . 36 LEU HD21 1 1 3 1728 1 1 36 LEU HD22 H -1.056 7.460 3.490 1.00 . A A . 36 LEU HD22 1 1 3 1729 1 1 36 LEU HD23 H -0.620 8.044 1.885 1.00 . A A . 36 LEU HD23 1 1 3 1730 1 1 36 LEU HG H -1.233 5.439 2.439 1.00 . A A . 36 LEU HG 1 1 3 1731 1 1 36 LEU N N -2.935 5.660 4.360 1.00 . A A . 36 LEU N 1 1 3 1732 1 1 36 LEU O O -6.116 6.416 2.913 1.00 . A A . 36 LEU O 1 1 3 1733 1 1 37 CYS C C -7.767 5.536 4.679 1.00 . A A . 37 CYS C 1 1 3 1734 1 1 37 CYS CA C -6.817 4.352 4.479 1.00 . A A . 37 CYS CA 1 1 3 1735 1 1 37 CYS CB C -6.872 3.444 5.708 1.00 . A A . 37 CYS CB 1 1 3 1736 1 1 37 CYS H H -4.690 4.411 4.780 1.00 . A A . 37 CYS H 1 1 3 1737 1 1 37 CYS HA H -7.116 3.792 3.605 1.00 . A A . 37 CYS HA 1 1 3 1738 1 1 37 CYS HB2 H -7.187 2.454 5.412 1.00 . A A . 37 CYS HB2 1 1 3 1739 1 1 37 CYS HB3 H -5.894 3.391 6.162 1.00 . A A . 37 CYS HB3 1 1 3 1740 1 1 37 CYS N N -5.426 4.853 4.299 1.00 . A A . 37 CYS N 1 1 3 1741 1 1 37 CYS O O -7.354 6.501 5.300 1.00 . A A . 37 CYS O 1 1 3 1742 1 1 37 CYS OXT O -8.889 5.458 4.207 1.00 . A A . 37 CYS OXT 1 1 3 1743 1 1 37 CYS SG S -8.053 4.126 6.899 1.00 . A A . 37 CYS SG 1 1 4 1744 1 1 1 VAL C C -12.186 0.935 3.149 1.00 . A A . 1 VAL C 1 1 4 1745 1 1 1 VAL CA C -13.600 0.814 3.720 1.00 . A A . 1 VAL CA 1 1 4 1746 1 1 1 VAL CB C -13.824 -0.608 4.237 1.00 . A A . 1 VAL CB 1 1 4 1747 1 1 1 VAL CG1 C -15.322 -0.858 4.420 1.00 . A A . 1 VAL CG1 1 1 4 1748 1 1 1 VAL CG2 C -13.265 -1.607 3.222 1.00 . A A . 1 VAL CG2 1 1 4 1749 1 1 1 VAL H1 H -14.102 1.514 1.824 1.00 . A A . 1 VAL H1 1 1 4 1750 1 1 1 VAL H2 H -15.073 0.236 2.363 1.00 . A A . 1 VAL H2 1 1 4 1751 1 1 1 VAL H3 H -15.291 1.795 3.007 1.00 . A A . 1 VAL H3 1 1 4 1752 1 1 1 VAL HA H -13.722 1.517 4.531 1.00 . A A . 1 VAL HA 1 1 4 1753 1 1 1 VAL HB H -13.321 -0.728 5.185 1.00 . A A . 1 VAL HB 1 1 4 1754 1 1 1 VAL HG11 H -15.835 0.087 4.518 1.00 . A A . 1 VAL HG11 1 1 4 1755 1 1 1 VAL HG12 H -15.705 -1.389 3.561 1.00 . A A . 1 VAL HG12 1 1 4 1756 1 1 1 VAL HG13 H -15.483 -1.448 5.310 1.00 . A A . 1 VAL HG13 1 1 4 1757 1 1 1 VAL HG21 H -13.743 -1.452 2.265 1.00 . A A . 1 VAL HG21 1 1 4 1758 1 1 1 VAL HG22 H -12.201 -1.460 3.120 1.00 . A A . 1 VAL HG22 1 1 4 1759 1 1 1 VAL HG23 H -13.460 -2.613 3.563 1.00 . A A . 1 VAL HG23 1 1 4 1760 1 1 1 VAL N N -14.592 1.113 2.649 1.00 . A A . 1 VAL N 1 1 4 1761 1 1 1 VAL O O -11.952 0.668 1.987 1.00 . A A . 1 VAL O 1 1 4 1762 1 1 2 CYS C C -9.013 0.284 3.947 1.00 . A A . 2 CYS C 1 1 4 1763 1 1 2 CYS CA C -9.845 1.470 3.449 1.00 . A A . 2 CYS CA 1 1 4 1764 1 1 2 CYS CB C -9.242 2.774 3.975 1.00 . A A . 2 CYS CB 1 1 4 1765 1 1 2 CYS H H -11.447 1.546 4.888 1.00 . A A . 2 CYS H 1 1 4 1766 1 1 2 CYS HA H -9.868 1.490 2.369 1.00 . A A . 2 CYS HA 1 1 4 1767 1 1 2 CYS HB2 H -8.194 2.817 3.719 1.00 . A A . 2 CYS HB2 1 1 4 1768 1 1 2 CYS HB3 H -9.758 3.612 3.534 1.00 . A A . 2 CYS HB3 1 1 4 1769 1 1 2 CYS N N -11.241 1.335 3.954 1.00 . A A . 2 CYS N 1 1 4 1770 1 1 2 CYS O O -9.466 -0.457 4.797 1.00 . A A . 2 CYS O 1 1 4 1771 1 1 2 CYS SG S -9.430 2.829 5.775 1.00 . A A . 2 CYS SG 1 1 4 1772 1 1 3 ARG C C -6.014 -1.385 2.698 1.00 . A A . 3 ARG C 1 1 4 1773 1 1 3 ARG CA C -6.940 -1.026 3.862 1.00 . A A . 3 ARG CA 1 1 4 1774 1 1 3 ARG CB C -7.756 -2.273 4.206 1.00 . A A . 3 ARG CB 1 1 4 1775 1 1 3 ARG CD C -8.998 -4.018 2.906 1.00 . A A . 3 ARG CD 1 1 4 1776 1 1 3 ARG CG C -8.804 -2.516 3.117 1.00 . A A . 3 ARG CG 1 1 4 1777 1 1 3 ARG CZ C -8.715 -6.006 4.261 1.00 . A A . 3 ARG CZ 1 1 4 1778 1 1 3 ARG H H -7.485 0.721 2.752 1.00 . A A . 3 ARG H 1 1 4 1779 1 1 3 ARG HA H -6.350 -0.724 4.715 1.00 . A A . 3 ARG HA 1 1 4 1780 1 1 3 ARG HB2 H -7.092 -3.124 4.267 1.00 . A A . 3 ARG HB2 1 1 4 1781 1 1 3 ARG HB3 H -8.251 -2.134 5.154 1.00 . A A . 3 ARG HB3 1 1 4 1782 1 1 3 ARG HD2 H -9.961 -4.198 2.449 1.00 . A A . 3 ARG HD2 1 1 4 1783 1 1 3 ARG HD3 H -8.220 -4.395 2.258 1.00 . A A . 3 ARG HD3 1 1 4 1784 1 1 3 ARG HE H -9.054 -4.216 5.050 1.00 . A A . 3 ARG HE 1 1 4 1785 1 1 3 ARG HG2 H -9.742 -2.069 3.417 1.00 . A A . 3 ARG HG2 1 1 4 1786 1 1 3 ARG HG3 H -8.472 -2.068 2.192 1.00 . A A . 3 ARG HG3 1 1 4 1787 1 1 3 ARG HH11 H -7.346 -5.975 2.800 1.00 . A A . 3 ARG HH11 1 1 4 1788 1 1 3 ARG HH12 H -7.677 -7.531 3.483 1.00 . A A . 3 ARG HH12 1 1 4 1789 1 1 3 ARG HH21 H -10.034 -6.338 5.728 1.00 . A A . 3 ARG HH21 1 1 4 1790 1 1 3 ARG HH22 H -9.200 -7.737 5.141 1.00 . A A . 3 ARG HH22 1 1 4 1791 1 1 3 ARG N N -7.820 0.102 3.436 1.00 . A A . 3 ARG N 1 1 4 1792 1 1 3 ARG NE N -8.933 -4.721 4.219 1.00 . A A . 3 ARG NE 1 1 4 1793 1 1 3 ARG NH1 N -7.845 -6.546 3.451 1.00 . A A . 3 ARG NH1 1 1 4 1794 1 1 3 ARG NH2 N -9.367 -6.752 5.109 1.00 . A A . 3 ARG NH2 1 1 4 1795 1 1 3 ARG O O -6.048 -0.763 1.655 1.00 . A A . 3 ARG O 1 1 4 1796 1 1 4 ASP C C -5.072 -3.614 0.760 1.00 . A A . 4 ASP C 1 1 4 1797 1 1 4 ASP CA C -4.274 -2.766 1.750 1.00 . A A . 4 ASP CA 1 1 4 1798 1 1 4 ASP CB C -3.098 -3.583 2.291 1.00 . A A . 4 ASP CB 1 1 4 1799 1 1 4 ASP CG C -3.631 -4.743 3.134 1.00 . A A . 4 ASP CG 1 1 4 1800 1 1 4 ASP H H -5.173 -2.878 3.708 1.00 . A A . 4 ASP H 1 1 4 1801 1 1 4 ASP HA H -3.920 -1.873 1.257 1.00 . A A . 4 ASP HA 1 1 4 1802 1 1 4 ASP HB2 H -2.522 -3.970 1.463 1.00 . A A . 4 ASP HB2 1 1 4 1803 1 1 4 ASP HB3 H -2.471 -2.957 2.906 1.00 . A A . 4 ASP HB3 1 1 4 1804 1 1 4 ASP N N -5.189 -2.383 2.862 1.00 . A A . 4 ASP N 1 1 4 1805 1 1 4 ASP O O -6.284 -3.667 0.836 1.00 . A A . 4 ASP O 1 1 4 1806 1 1 4 ASP OD1 O -4.636 -5.317 2.748 1.00 . A A . 4 ASP OD1 1 1 4 1807 1 1 4 ASP OD2 O -3.025 -5.039 4.150 1.00 . A A . 4 ASP OD2 1 1 4 1808 1 1 5 TRP C C -4.444 -6.271 -1.648 1.00 . A A . 5 TRP C 1 1 4 1809 1 1 5 TRP CA C -5.259 -5.093 -1.107 1.00 . A A . 5 TRP CA 1 1 4 1810 1 1 5 TRP CB C -5.742 -4.194 -2.244 1.00 . A A . 5 TRP CB 1 1 4 1811 1 1 5 TRP CD1 C -7.504 -2.453 -1.688 1.00 . A A . 5 TRP CD1 1 1 4 1812 1 1 5 TRP CD2 C -8.320 -4.546 -1.711 1.00 . A A . 5 TRP CD2 1 1 4 1813 1 1 5 TRP CE2 C -9.403 -3.690 -1.391 1.00 . A A . 5 TRP CE2 1 1 4 1814 1 1 5 TRP CE3 C -8.566 -5.925 -1.792 1.00 . A A . 5 TRP CE3 1 1 4 1815 1 1 5 TRP CG C -7.122 -3.735 -1.897 1.00 . A A . 5 TRP CG 1 1 4 1816 1 1 5 TRP CH2 C -10.909 -5.572 -1.242 1.00 . A A . 5 TRP CH2 1 1 4 1817 1 1 5 TRP CZ2 C -10.687 -4.193 -1.157 1.00 . A A . 5 TRP CZ2 1 1 4 1818 1 1 5 TRP CZ3 C -9.851 -6.432 -1.557 1.00 . A A . 5 TRP CZ3 1 1 4 1819 1 1 5 TRP H H -3.458 -4.252 -0.244 1.00 . A A . 5 TRP H 1 1 4 1820 1 1 5 TRP HA H -6.129 -5.473 -0.574 1.00 . A A . 5 TRP HA 1 1 4 1821 1 1 5 TRP HB2 H -5.077 -3.349 -2.342 1.00 . A A . 5 TRP HB2 1 1 4 1822 1 1 5 TRP HB3 H -5.770 -4.751 -3.169 1.00 . A A . 5 TRP HB3 1 1 4 1823 1 1 5 TRP HD1 H -6.859 -1.590 -1.745 1.00 . A A . 5 TRP HD1 1 1 4 1824 1 1 5 TRP HE1 H -9.371 -1.616 -1.196 1.00 . A A . 5 TRP HE1 1 1 4 1825 1 1 5 TRP HE3 H -7.757 -6.598 -2.034 1.00 . A A . 5 TRP HE3 1 1 4 1826 1 1 5 TRP HH2 H -11.896 -5.972 -1.063 1.00 . A A . 5 TRP HH2 1 1 4 1827 1 1 5 TRP HZ2 H -11.500 -3.524 -0.914 1.00 . A A . 5 TRP HZ2 1 1 4 1828 1 1 5 TRP HZ3 H -10.027 -7.496 -1.621 1.00 . A A . 5 TRP HZ3 1 1 4 1829 1 1 5 TRP N N -4.440 -4.281 -0.166 1.00 . A A . 5 TRP N 1 1 4 1830 1 1 5 TRP NE1 N -8.851 -2.425 -1.389 1.00 . A A . 5 TRP NE1 1 1 4 1831 1 1 5 TRP O O -5.014 -7.275 -2.026 1.00 . A A . 5 TRP O 1 1 4 1832 1 1 6 PHE C C -2.209 -8.297 -1.031 1.00 . A A . 6 PHE C 1 1 4 1833 1 1 6 PHE CA C -2.399 -7.378 -2.235 1.00 . A A . 6 PHE CA 1 1 4 1834 1 1 6 PHE CB C -1.024 -6.903 -2.695 1.00 . A A . 6 PHE CB 1 1 4 1835 1 1 6 PHE CD1 C -2.021 -6.146 -4.863 1.00 . A A . 6 PHE CD1 1 1 4 1836 1 1 6 PHE CD2 C -0.579 -4.635 -3.634 1.00 . A A . 6 PHE CD2 1 1 4 1837 1 1 6 PHE CE1 C -2.192 -5.179 -5.849 1.00 . A A . 6 PHE CE1 1 1 4 1838 1 1 6 PHE CE2 C -0.746 -3.664 -4.615 1.00 . A A . 6 PHE CE2 1 1 4 1839 1 1 6 PHE CG C -1.215 -5.867 -3.762 1.00 . A A . 6 PHE CG 1 1 4 1840 1 1 6 PHE CZ C -1.553 -3.942 -5.718 1.00 . A A . 6 PHE CZ 1 1 4 1841 1 1 6 PHE H H -2.613 -5.428 -1.417 1.00 . A A . 6 PHE H 1 1 4 1842 1 1 6 PHE HA H -2.943 -7.842 -3.045 1.00 . A A . 6 PHE HA 1 1 4 1843 1 1 6 PHE HB2 H -0.490 -6.455 -1.872 1.00 . A A . 6 PHE HB2 1 1 4 1844 1 1 6 PHE HB3 H -0.464 -7.725 -3.104 1.00 . A A . 6 PHE HB3 1 1 4 1845 1 1 6 PHE HD1 H -2.508 -7.100 -4.954 1.00 . A A . 6 PHE HD1 1 1 4 1846 1 1 6 PHE HD2 H 0.040 -4.431 -2.781 1.00 . A A . 6 PHE HD2 1 1 4 1847 1 1 6 PHE HE1 H -2.816 -5.399 -6.697 1.00 . A A . 6 PHE HE1 1 1 4 1848 1 1 6 PHE HE2 H -0.253 -2.712 -4.511 1.00 . A A . 6 PHE HE2 1 1 4 1849 1 1 6 PHE HZ H -1.679 -3.193 -6.471 1.00 . A A . 6 PHE HZ 1 1 4 1850 1 1 6 PHE N N -3.137 -6.207 -1.705 1.00 . A A . 6 PHE N 1 1 4 1851 1 1 6 PHE O O -3.081 -8.393 -0.190 1.00 . A A . 6 PHE O 1 1 4 1852 1 1 7 LYS C C -0.519 -9.090 1.537 1.00 . A A . 7 LYS C 1 1 4 1853 1 1 7 LYS CA C -0.981 -9.853 0.289 1.00 . A A . 7 LYS CA 1 1 4 1854 1 1 7 LYS CB C -0.023 -11.009 -0.006 1.00 . A A . 7 LYS CB 1 1 4 1855 1 1 7 LYS CD C -1.239 -13.183 0.206 1.00 . A A . 7 LYS CD 1 1 4 1856 1 1 7 LYS CE C -0.616 -14.579 0.266 1.00 . A A . 7 LYS CE 1 1 4 1857 1 1 7 LYS CG C -0.330 -12.184 0.925 1.00 . A A . 7 LYS CG 1 1 4 1858 1 1 7 LYS H H -0.392 -8.905 -1.588 1.00 . A A . 7 LYS H 1 1 4 1859 1 1 7 LYS HA H -1.954 -10.262 0.502 1.00 . A A . 7 LYS HA 1 1 4 1860 1 1 7 LYS HB2 H -0.143 -11.319 -1.034 1.00 . A A . 7 LYS HB2 1 1 4 1861 1 1 7 LYS HB3 H 0.994 -10.685 0.157 1.00 . A A . 7 LYS HB3 1 1 4 1862 1 1 7 LYS HD2 H -2.206 -13.197 0.687 1.00 . A A . 7 LYS HD2 1 1 4 1863 1 1 7 LYS HD3 H -1.352 -12.890 -0.827 1.00 . A A . 7 LYS HD3 1 1 4 1864 1 1 7 LYS HE2 H 0.443 -14.493 0.456 1.00 . A A . 7 LYS HE2 1 1 4 1865 1 1 7 LYS HE3 H -1.079 -15.146 1.060 1.00 . A A . 7 LYS HE3 1 1 4 1866 1 1 7 LYS HG2 H 0.593 -12.669 1.206 1.00 . A A . 7 LYS HG2 1 1 4 1867 1 1 7 LYS HG3 H -0.833 -11.821 1.809 1.00 . A A . 7 LYS HG3 1 1 4 1868 1 1 7 LYS HZ1 H -1.188 -14.594 -1.734 1.00 . A A . 7 LYS HZ1 1 1 4 1869 1 1 7 LYS HZ2 H 0.065 -15.682 -1.365 1.00 . A A . 7 LYS HZ2 1 1 4 1870 1 1 7 LYS HZ3 H -1.526 -16.040 -0.908 1.00 . A A . 7 LYS HZ3 1 1 4 1871 1 1 7 LYS N N -1.105 -8.975 -0.911 1.00 . A A . 7 LYS N 1 1 4 1872 1 1 7 LYS NZ N -0.833 -15.275 -1.033 1.00 . A A . 7 LYS NZ 1 1 4 1873 1 1 7 LYS O O 0.088 -9.686 2.404 1.00 . A A . 7 LYS O 1 1 4 1874 1 1 8 GLU C C 1.052 -6.554 2.761 1.00 . A A . 8 GLU C 1 1 4 1875 1 1 8 GLU CA C -0.429 -6.940 2.782 1.00 . A A . 8 GLU CA 1 1 4 1876 1 1 8 GLU CB C -0.781 -7.720 4.037 1.00 . A A . 8 GLU CB 1 1 4 1877 1 1 8 GLU CD C 0.252 -9.053 5.894 1.00 . A A . 8 GLU CD 1 1 4 1878 1 1 8 GLU CG C 0.527 -8.157 4.685 1.00 . A A . 8 GLU CG 1 1 4 1879 1 1 8 GLU H H -1.294 -7.395 0.921 1.00 . A A . 8 GLU H 1 1 4 1880 1 1 8 GLU HA H -1.012 -6.032 2.767 1.00 . A A . 8 GLU HA 1 1 4 1881 1 1 8 GLU HB2 H -1.369 -7.107 4.705 1.00 . A A . 8 GLU HB2 1 1 4 1882 1 1 8 GLU HB3 H -1.330 -8.592 3.724 1.00 . A A . 8 GLU HB3 1 1 4 1883 1 1 8 GLU HG2 H 1.095 -8.694 3.941 1.00 . A A . 8 GLU HG2 1 1 4 1884 1 1 8 GLU HG3 H 1.077 -7.281 4.991 1.00 . A A . 8 GLU HG3 1 1 4 1885 1 1 8 GLU N N -0.803 -7.814 1.635 1.00 . A A . 8 GLU N 1 1 4 1886 1 1 8 GLU O O 1.413 -5.453 3.128 1.00 . A A . 8 GLU O 1 1 4 1887 1 1 8 GLU OE1 O -0.475 -10.020 5.737 1.00 . A A . 8 GLU OE1 1 1 4 1888 1 1 8 GLU OE2 O 0.774 -8.756 6.956 1.00 . A A . 8 GLU OE2 1 1 4 1889 1 1 9 THR C C 3.664 -6.398 0.991 1.00 . A A . 9 THR C 1 1 4 1890 1 1 9 THR CA C 3.363 -7.107 2.306 1.00 . A A . 9 THR CA 1 1 4 1891 1 1 9 THR CB C 4.118 -8.420 2.479 1.00 . A A . 9 THR CB 1 1 4 1892 1 1 9 THR CG2 C 3.731 -8.938 3.865 1.00 . A A . 9 THR CG2 1 1 4 1893 1 1 9 THR H H 1.618 -8.315 2.053 1.00 . A A . 9 THR H 1 1 4 1894 1 1 9 THR HA H 3.593 -6.441 3.126 1.00 . A A . 9 THR HA 1 1 4 1895 1 1 9 THR HB H 5.181 -8.256 2.455 1.00 . A A . 9 THR HB 1 1 4 1896 1 1 9 THR HG1 H 3.083 -9.936 1.834 1.00 . A A . 9 THR HG1 1 1 4 1897 1 1 9 THR HG21 H 3.020 -8.247 4.302 1.00 . A A . 9 THR HG21 1 1 4 1898 1 1 9 THR HG22 H 3.275 -9.911 3.772 1.00 . A A . 9 THR HG22 1 1 4 1899 1 1 9 THR HG23 H 4.609 -8.998 4.490 1.00 . A A . 9 THR HG23 1 1 4 1900 1 1 9 THR N N 1.916 -7.433 2.344 1.00 . A A . 9 THR N 1 1 4 1901 1 1 9 THR O O 4.515 -5.537 0.937 1.00 . A A . 9 THR O 1 1 4 1902 1 1 9 THR OG1 O 3.722 -9.328 1.458 1.00 . A A . 9 THR OG1 1 1 4 1903 1 1 10 ALA C C 3.184 -4.589 -1.045 1.00 . A A . 10 ALA C 1 1 4 1904 1 1 10 ALA CA C 3.213 -6.080 -1.364 1.00 . A A . 10 ALA CA 1 1 4 1905 1 1 10 ALA CB C 2.036 -6.346 -2.305 1.00 . A A . 10 ALA CB 1 1 4 1906 1 1 10 ALA H H 2.284 -7.446 0.029 1.00 . A A . 10 ALA H 1 1 4 1907 1 1 10 ALA HA H 4.153 -6.365 -1.808 1.00 . A A . 10 ALA HA 1 1 4 1908 1 1 10 ALA HB1 H 1.726 -7.377 -2.223 1.00 . A A . 10 ALA HB1 1 1 4 1909 1 1 10 ALA HB2 H 1.211 -5.701 -2.026 1.00 . A A . 10 ALA HB2 1 1 4 1910 1 1 10 ALA HB3 H 2.330 -6.128 -3.320 1.00 . A A . 10 ALA HB3 1 1 4 1911 1 1 10 ALA N N 2.968 -6.750 -0.055 1.00 . A A . 10 ALA N 1 1 4 1912 1 1 10 ALA O O 3.911 -3.774 -1.578 1.00 . A A . 10 ALA O 1 1 4 1913 1 1 11 CYS C C 3.325 -2.397 1.096 1.00 . A A . 11 CYS C 1 1 4 1914 1 1 11 CYS CA C 2.096 -2.883 0.326 1.00 . A A . 11 CYS CA 1 1 4 1915 1 1 11 CYS CB C 0.793 -2.956 1.127 1.00 . A A . 11 CYS CB 1 1 4 1916 1 1 11 CYS H H 1.742 -4.973 0.254 1.00 . A A . 11 CYS H 1 1 4 1917 1 1 11 CYS HA H 1.961 -2.232 -0.522 1.00 . A A . 11 CYS HA 1 1 4 1918 1 1 11 CYS HB2 H 0.890 -3.640 1.962 1.00 . A A . 11 CYS HB2 1 1 4 1919 1 1 11 CYS HB3 H 0.496 -1.979 1.470 1.00 . A A . 11 CYS HB3 1 1 4 1920 1 1 11 CYS N N 2.301 -4.273 -0.141 1.00 . A A . 11 CYS N 1 1 4 1921 1 1 11 CYS O O 3.942 -1.432 0.695 1.00 . A A . 11 CYS O 1 1 4 1922 1 1 11 CYS SG S -0.470 -3.579 -0.010 1.00 . A A . 11 CYS SG 1 1 4 1923 1 1 12 ARG C C 6.106 -2.428 1.988 1.00 . A A . 12 ARG C 1 1 4 1924 1 1 12 ARG CA C 4.906 -2.552 2.925 1.00 . A A . 12 ARG CA 1 1 4 1925 1 1 12 ARG CB C 5.215 -3.536 4.050 1.00 . A A . 12 ARG CB 1 1 4 1926 1 1 12 ARG CD C 6.608 -3.774 6.115 1.00 . A A . 12 ARG CD 1 1 4 1927 1 1 12 ARG CG C 5.891 -2.783 5.196 1.00 . A A . 12 ARG CG 1 1 4 1928 1 1 12 ARG CZ C 6.864 -3.387 8.492 1.00 . A A . 12 ARG CZ 1 1 4 1929 1 1 12 ARG H H 3.203 -3.801 2.488 1.00 . A A . 12 ARG H 1 1 4 1930 1 1 12 ARG HA H 4.705 -1.581 3.350 1.00 . A A . 12 ARG HA 1 1 4 1931 1 1 12 ARG HB2 H 4.291 -3.975 4.394 1.00 . A A . 12 ARG HB2 1 1 4 1932 1 1 12 ARG HB3 H 5.878 -4.307 3.688 1.00 . A A . 12 ARG HB3 1 1 4 1933 1 1 12 ARG HD2 H 5.904 -4.511 6.470 1.00 . A A . 12 ARG HD2 1 1 4 1934 1 1 12 ARG HD3 H 7.400 -4.264 5.568 1.00 . A A . 12 ARG HD3 1 1 4 1935 1 1 12 ARG HE H 7.811 -2.301 7.127 1.00 . A A . 12 ARG HE 1 1 4 1936 1 1 12 ARG HG2 H 6.603 -2.080 4.788 1.00 . A A . 12 ARG HG2 1 1 4 1937 1 1 12 ARG HG3 H 5.141 -2.251 5.761 1.00 . A A . 12 ARG HG3 1 1 4 1938 1 1 12 ARG HH11 H 4.894 -3.384 8.133 1.00 . A A . 12 ARG HH11 1 1 4 1939 1 1 12 ARG HH12 H 5.361 -3.799 9.749 1.00 . A A . 12 ARG HH12 1 1 4 1940 1 1 12 ARG HH21 H 8.759 -3.470 9.135 1.00 . A A . 12 ARG HH21 1 1 4 1941 1 1 12 ARG HH22 H 7.548 -3.848 10.316 1.00 . A A . 12 ARG HH22 1 1 4 1942 1 1 12 ARG N N 3.705 -3.024 2.174 1.00 . A A . 12 ARG N 1 1 4 1943 1 1 12 ARG NE N 7.188 -3.041 7.276 1.00 . A A . 12 ARG NE 1 1 4 1944 1 1 12 ARG NH1 N 5.609 -3.535 8.817 1.00 . A A . 12 ARG NH1 1 1 4 1945 1 1 12 ARG NH2 N 7.796 -3.584 9.384 1.00 . A A . 12 ARG NH2 1 1 4 1946 1 1 12 ARG O O 7.067 -1.746 2.281 1.00 . A A . 12 ARG O 1 1 4 1947 1 1 13 HIS C C 7.117 -1.541 -0.575 1.00 . A A . 13 HIS C 1 1 4 1948 1 1 13 HIS CA C 7.192 -2.986 -0.088 1.00 . A A . 13 HIS CA 1 1 4 1949 1 1 13 HIS CB C 6.957 -4.027 -1.187 1.00 . A A . 13 HIS CB 1 1 4 1950 1 1 13 HIS CD2 C 8.577 -3.513 -3.195 1.00 . A A . 13 HIS CD2 1 1 4 1951 1 1 13 HIS CE1 C 7.115 -2.692 -4.569 1.00 . A A . 13 HIS CE1 1 1 4 1952 1 1 13 HIS CG C 7.363 -3.546 -2.553 1.00 . A A . 13 HIS CG 1 1 4 1953 1 1 13 HIS H H 5.272 -3.618 0.638 1.00 . A A . 13 HIS H 1 1 4 1954 1 1 13 HIS HA H 8.122 -3.149 0.441 1.00 . A A . 13 HIS HA 1 1 4 1955 1 1 13 HIS HB2 H 7.531 -4.912 -0.956 1.00 . A A . 13 HIS HB2 1 1 4 1956 1 1 13 HIS HB3 H 5.910 -4.293 -1.194 1.00 . A A . 13 HIS HB3 1 1 4 1957 1 1 13 HIS HD1 H 5.487 -2.899 -3.294 1.00 . A A . 13 HIS HD1 1 1 4 1958 1 1 13 HIS HD2 H 9.512 -3.855 -2.776 1.00 . A A . 13 HIS HD2 1 1 4 1959 1 1 13 HIS HE1 H 6.655 -2.257 -5.443 1.00 . A A . 13 HIS HE1 1 1 4 1960 1 1 13 HIS N N 6.055 -3.077 0.861 1.00 . A A . 13 HIS N 1 1 4 1961 1 1 13 HIS ND1 N 6.448 -3.016 -3.449 1.00 . A A . 13 HIS ND1 1 1 4 1962 1 1 13 HIS NE2 N 8.417 -2.974 -4.470 1.00 . A A . 13 HIS NE2 1 1 4 1963 1 1 13 HIS O O 8.083 -0.810 -0.578 1.00 . A A . 13 HIS O 1 1 4 1964 1 1 14 ALA C C 5.840 1.269 -0.318 1.00 . A A . 14 ALA C 1 1 4 1965 1 1 14 ALA CA C 5.753 0.259 -1.473 1.00 . A A . 14 ALA CA 1 1 4 1966 1 1 14 ALA CB C 4.373 0.332 -2.126 1.00 . A A . 14 ALA CB 1 1 4 1967 1 1 14 ALA H H 5.188 -1.763 -0.959 1.00 . A A . 14 ALA H 1 1 4 1968 1 1 14 ALA HA H 6.503 0.508 -2.214 1.00 . A A . 14 ALA HA 1 1 4 1969 1 1 14 ALA HB1 H 3.697 -0.323 -1.593 1.00 . A A . 14 ALA HB1 1 1 4 1970 1 1 14 ALA HB2 H 4.004 1.347 -2.083 1.00 . A A . 14 ALA HB2 1 1 4 1971 1 1 14 ALA HB3 H 4.443 0.013 -3.157 1.00 . A A . 14 ALA HB3 1 1 4 1972 1 1 14 ALA N N 5.946 -1.137 -0.982 1.00 . A A . 14 ALA N 1 1 4 1973 1 1 14 ALA O O 6.093 2.432 -0.555 1.00 . A A . 14 ALA O 1 1 4 1974 1 1 15 LYS C C 7.227 2.169 2.264 1.00 . A A . 15 LYS C 1 1 4 1975 1 1 15 LYS CA C 5.739 1.889 2.025 1.00 . A A . 15 LYS CA 1 1 4 1976 1 1 15 LYS CB C 5.133 1.307 3.310 1.00 . A A . 15 LYS CB 1 1 4 1977 1 1 15 LYS CD C 5.845 3.397 4.495 1.00 . A A . 15 LYS CD 1 1 4 1978 1 1 15 LYS CE C 7.075 3.949 5.217 1.00 . A A . 15 LYS CE 1 1 4 1979 1 1 15 LYS CG C 5.878 1.868 4.517 1.00 . A A . 15 LYS CG 1 1 4 1980 1 1 15 LYS H H 5.443 -0.040 1.145 1.00 . A A . 15 LYS H 1 1 4 1981 1 1 15 LYS HA H 5.218 2.805 1.757 1.00 . A A . 15 LYS HA 1 1 4 1982 1 1 15 LYS HB2 H 4.085 1.566 3.395 1.00 . A A . 15 LYS HB2 1 1 4 1983 1 1 15 LYS HB3 H 5.235 0.233 3.316 1.00 . A A . 15 LYS HB3 1 1 4 1984 1 1 15 LYS HD2 H 5.838 3.742 3.472 1.00 . A A . 15 LYS HD2 1 1 4 1985 1 1 15 LYS HD3 H 4.954 3.745 4.998 1.00 . A A . 15 LYS HD3 1 1 4 1986 1 1 15 LYS HE2 H 7.837 3.186 5.264 1.00 . A A . 15 LYS HE2 1 1 4 1987 1 1 15 LYS HE3 H 7.456 4.805 4.679 1.00 . A A . 15 LYS HE3 1 1 4 1988 1 1 15 LYS HG2 H 5.405 1.503 5.416 1.00 . A A . 15 LYS HG2 1 1 4 1989 1 1 15 LYS HG3 H 6.899 1.528 4.478 1.00 . A A . 15 LYS HG3 1 1 4 1990 1 1 15 LYS HZ1 H 5.874 3.804 6.910 1.00 . A A . 15 LYS HZ1 1 1 4 1991 1 1 15 LYS HZ2 H 7.495 4.192 7.244 1.00 . A A . 15 LYS HZ2 1 1 4 1992 1 1 15 LYS HZ3 H 6.459 5.372 6.610 1.00 . A A . 15 LYS HZ3 1 1 4 1993 1 1 15 LYS N N 5.646 0.891 0.922 1.00 . A A . 15 LYS N 1 1 4 1994 1 1 15 LYS NZ N 6.697 4.360 6.599 1.00 . A A . 15 LYS NZ 1 1 4 1995 1 1 15 LYS O O 7.621 3.304 2.443 1.00 . A A . 15 LYS O 1 1 4 1996 1 1 16 SER C C 10.304 1.549 1.206 1.00 . A A . 16 SER C 1 1 4 1997 1 1 16 SER CA C 9.523 1.407 2.512 1.00 . A A . 16 SER CA 1 1 4 1998 1 1 16 SER CB C 10.096 0.192 3.235 1.00 . A A . 16 SER CB 1 1 4 1999 1 1 16 SER H H 7.778 0.233 2.139 1.00 . A A . 16 SER H 1 1 4 2000 1 1 16 SER HA H 9.668 2.271 3.137 1.00 . A A . 16 SER HA 1 1 4 2001 1 1 16 SER HB2 H 9.952 -0.678 2.613 1.00 . A A . 16 SER HB2 1 1 4 2002 1 1 16 SER HB3 H 11.156 0.342 3.387 1.00 . A A . 16 SER HB3 1 1 4 2003 1 1 16 SER HG H 9.917 -0.601 5.003 1.00 . A A . 16 SER HG 1 1 4 2004 1 1 16 SER N N 8.070 1.162 2.277 1.00 . A A . 16 SER N 1 1 4 2005 1 1 16 SER O O 11.519 1.572 1.221 1.00 . A A . 16 SER O 1 1 4 2006 1 1 16 SER OG O 9.406 0.008 4.464 1.00 . A A . 16 SER OG 1 1 4 2007 1 1 17 LEU C C 10.324 3.139 -1.836 1.00 . A A . 17 LEU C 1 1 4 2008 1 1 17 LEU CA C 10.475 1.773 -1.163 1.00 . A A . 17 LEU CA 1 1 4 2009 1 1 17 LEU CB C 10.142 0.580 -2.055 1.00 . A A . 17 LEU CB 1 1 4 2010 1 1 17 LEU CD1 C 9.458 1.656 -4.146 1.00 . A A . 17 LEU CD1 1 1 4 2011 1 1 17 LEU CD2 C 8.470 -0.551 -3.355 1.00 . A A . 17 LEU CD2 1 1 4 2012 1 1 17 LEU CG C 8.950 0.845 -2.957 1.00 . A A . 17 LEU CG 1 1 4 2013 1 1 17 LEU H H 8.685 1.621 0.046 1.00 . A A . 17 LEU H 1 1 4 2014 1 1 17 LEU HA H 11.511 1.693 -0.881 1.00 . A A . 17 LEU HA 1 1 4 2015 1 1 17 LEU HB2 H 10.987 0.330 -2.675 1.00 . A A . 17 LEU HB2 1 1 4 2016 1 1 17 LEU HB3 H 9.910 -0.265 -1.424 1.00 . A A . 17 LEU HB3 1 1 4 2017 1 1 17 LEU HD11 H 10.534 1.722 -4.073 1.00 . A A . 17 LEU HD11 1 1 4 2018 1 1 17 LEU HD12 H 9.177 1.170 -5.068 1.00 . A A . 17 LEU HD12 1 1 4 2019 1 1 17 LEU HD13 H 9.037 2.650 -4.111 1.00 . A A . 17 LEU HD13 1 1 4 2020 1 1 17 LEU HD21 H 8.821 -1.257 -2.617 1.00 . A A . 17 LEU HD21 1 1 4 2021 1 1 17 LEU HD22 H 7.393 -0.600 -3.399 1.00 . A A . 17 LEU HD22 1 1 4 2022 1 1 17 LEU HD23 H 8.886 -0.807 -4.320 1.00 . A A . 17 LEU HD23 1 1 4 2023 1 1 17 LEU HG H 8.184 1.376 -2.413 1.00 . A A . 17 LEU HG 1 1 4 2024 1 1 17 LEU N N 9.664 1.641 0.076 1.00 . A A . 17 LEU N 1 1 4 2025 1 1 17 LEU O O 11.285 3.672 -2.354 1.00 . A A . 17 LEU O 1 1 4 2026 1 1 18 GLY C C 7.677 5.220 -3.151 1.00 . A A . 18 GLY C 1 1 4 2027 1 1 18 GLY CA C 9.051 5.064 -2.504 1.00 . A A . 18 GLY CA 1 1 4 2028 1 1 18 GLY H H 8.381 3.314 -1.429 1.00 . A A . 18 GLY H 1 1 4 2029 1 1 18 GLY HA2 H 9.194 5.839 -1.765 1.00 . A A . 18 GLY HA2 1 1 4 2030 1 1 18 GLY HA3 H 9.810 5.151 -3.268 1.00 . A A . 18 GLY HA3 1 1 4 2031 1 1 18 GLY N N 9.163 3.731 -1.846 1.00 . A A . 18 GLY N 1 1 4 2032 1 1 18 GLY O O 7.186 6.312 -3.350 1.00 . A A . 18 GLY O 1 1 4 2033 1 1 19 ASN C C 4.609 4.396 -3.099 1.00 . A A . 19 ASN C 1 1 4 2034 1 1 19 ASN CA C 5.721 4.145 -4.114 1.00 . A A . 19 ASN CA 1 1 4 2035 1 1 19 ASN CB C 5.431 2.754 -4.642 1.00 . A A . 19 ASN CB 1 1 4 2036 1 1 19 ASN CG C 6.673 2.018 -5.138 1.00 . A A . 19 ASN CG 1 1 4 2037 1 1 19 ASN H H 7.464 3.250 -3.314 1.00 . A A . 19 ASN H 1 1 4 2038 1 1 19 ASN HA H 5.678 4.830 -4.944 1.00 . A A . 19 ASN HA 1 1 4 2039 1 1 19 ASN HB2 H 4.922 2.183 -3.889 1.00 . A A . 19 ASN HB2 1 1 4 2040 1 1 19 ASN HB3 H 4.744 2.853 -5.444 1.00 . A A . 19 ASN HB3 1 1 4 2041 1 1 19 ASN HD21 H 5.952 0.256 -4.586 1.00 . A A . 19 ASN HD21 1 1 4 2042 1 1 19 ASN HD22 H 7.487 0.222 -5.319 1.00 . A A . 19 ASN HD22 1 1 4 2043 1 1 19 ASN N N 7.060 4.122 -3.478 1.00 . A A . 19 ASN N 1 1 4 2044 1 1 19 ASN ND2 N 6.709 0.724 -5.001 1.00 . A A . 19 ASN ND2 1 1 4 2045 1 1 19 ASN O O 3.480 4.564 -3.517 1.00 . A A . 19 ASN O 1 1 4 2046 1 1 19 ASN OD1 O 7.601 2.617 -5.648 1.00 . A A . 19 ASN OD1 1 1 4 2047 1 1 20 CYS C C 2.822 5.595 -1.292 1.00 . A A . 20 CYS C 1 1 4 2048 1 1 20 CYS CA C 3.896 4.640 -0.777 1.00 . A A . 20 CYS CA 1 1 4 2049 1 1 20 CYS CB C 4.516 5.273 0.466 1.00 . A A . 20 CYS CB 1 1 4 2050 1 1 20 CYS H H 5.862 4.257 -1.575 1.00 . A A . 20 CYS H 1 1 4 2051 1 1 20 CYS HA H 3.441 3.698 -0.506 1.00 . A A . 20 CYS HA 1 1 4 2052 1 1 20 CYS HB2 H 4.687 4.515 1.218 1.00 . A A . 20 CYS HB2 1 1 4 2053 1 1 20 CYS HB3 H 5.441 5.769 0.214 1.00 . A A . 20 CYS HB3 1 1 4 2054 1 1 20 CYS N N 4.927 4.408 -1.832 1.00 . A A . 20 CYS N 1 1 4 2055 1 1 20 CYS O O 1.641 5.367 -1.135 1.00 . A A . 20 CYS O 1 1 4 2056 1 1 20 CYS SG S 3.334 6.493 1.085 1.00 . A A . 20 CYS SG 1 1 4 2057 1 1 21 ARG C C 2.518 8.004 -3.910 1.00 . A A . 21 ARG C 1 1 4 2058 1 1 21 ARG CA C 2.261 7.652 -2.442 1.00 . A A . 21 ARG CA 1 1 4 2059 1 1 21 ARG CB C 2.412 8.940 -1.649 1.00 . A A . 21 ARG CB 1 1 4 2060 1 1 21 ARG CD C 1.393 9.659 0.522 1.00 . A A . 21 ARG CD 1 1 4 2061 1 1 21 ARG CG C 1.100 9.223 -0.915 1.00 . A A . 21 ARG CG 1 1 4 2062 1 1 21 ARG CZ C 1.235 12.061 0.241 1.00 . A A . 21 ARG CZ 1 1 4 2063 1 1 21 ARG H H 4.206 6.811 -2.009 1.00 . A A . 21 ARG H 1 1 4 2064 1 1 21 ARG HA H 1.253 7.298 -2.309 1.00 . A A . 21 ARG HA 1 1 4 2065 1 1 21 ARG HB2 H 3.234 8.817 -0.961 1.00 . A A . 21 ARG HB2 1 1 4 2066 1 1 21 ARG HB3 H 2.629 9.737 -2.343 1.00 . A A . 21 ARG HB3 1 1 4 2067 1 1 21 ARG HD2 H 0.476 9.667 1.092 1.00 . A A . 21 ARG HD2 1 1 4 2068 1 1 21 ARG HD3 H 2.091 8.968 0.972 1.00 . A A . 21 ARG HD3 1 1 4 2069 1 1 21 ARG HE H 2.935 11.150 0.713 1.00 . A A . 21 ARG HE 1 1 4 2070 1 1 21 ARG HG2 H 0.562 10.004 -1.433 1.00 . A A . 21 ARG HG2 1 1 4 2071 1 1 21 ARG HG3 H 0.503 8.321 -0.900 1.00 . A A . 21 ARG HG3 1 1 4 2072 1 1 21 ARG HH11 H 0.312 12.053 2.018 1.00 . A A . 21 ARG HH11 1 1 4 2073 1 1 21 ARG HH12 H -0.186 13.297 0.920 1.00 . A A . 21 ARG HH12 1 1 4 2074 1 1 21 ARG HH21 H 1.982 12.311 -1.598 1.00 . A A . 21 ARG HH21 1 1 4 2075 1 1 21 ARG HH22 H 0.760 13.444 -1.126 1.00 . A A . 21 ARG HH22 1 1 4 2076 1 1 21 ARG N N 3.242 6.664 -1.906 1.00 . A A . 21 ARG N 1 1 4 2077 1 1 21 ARG NE N 1.984 11.026 0.513 1.00 . A A . 21 ARG NE 1 1 4 2078 1 1 21 ARG NH1 N 0.388 12.505 1.129 1.00 . A A . 21 ARG NH1 1 1 4 2079 1 1 21 ARG NH2 N 1.334 12.651 -0.918 1.00 . A A . 21 ARG NH2 1 1 4 2080 1 1 21 ARG O O 1.826 8.826 -4.477 1.00 . A A . 21 ARG O 1 1 4 2081 1 1 22 THR C C 3.189 6.657 -6.869 1.00 . A A . 22 THR C 1 1 4 2082 1 1 22 THR CA C 3.758 7.746 -5.961 1.00 . A A . 22 THR CA 1 1 4 2083 1 1 22 THR CB C 5.264 7.886 -6.186 1.00 . A A . 22 THR CB 1 1 4 2084 1 1 22 THR CG2 C 5.651 9.363 -6.107 1.00 . A A . 22 THR CG2 1 1 4 2085 1 1 22 THR H H 4.044 6.754 -4.072 1.00 . A A . 22 THR H 1 1 4 2086 1 1 22 THR HA H 3.274 8.683 -6.197 1.00 . A A . 22 THR HA 1 1 4 2087 1 1 22 THR HB H 5.528 7.510 -7.162 1.00 . A A . 22 THR HB 1 1 4 2088 1 1 22 THR HG1 H 6.416 7.794 -4.628 1.00 . A A . 22 THR HG1 1 1 4 2089 1 1 22 THR HG21 H 5.230 9.797 -5.211 1.00 . A A . 22 THR HG21 1 1 4 2090 1 1 22 THR HG22 H 6.727 9.453 -6.079 1.00 . A A . 22 THR HG22 1 1 4 2091 1 1 22 THR HG23 H 5.268 9.883 -6.973 1.00 . A A . 22 THR HG23 1 1 4 2092 1 1 22 THR N N 3.492 7.412 -4.535 1.00 . A A . 22 THR N 1 1 4 2093 1 1 22 THR O O 3.130 6.819 -8.071 1.00 . A A . 22 THR O 1 1 4 2094 1 1 22 THR OG1 O 5.956 7.159 -5.181 1.00 . A A . 22 THR OG1 1 1 4 2095 1 1 23 SER C C 0.707 4.509 -6.922 1.00 . A A . 23 SER C 1 1 4 2096 1 1 23 SER CA C 2.210 4.498 -7.210 1.00 . A A . 23 SER CA 1 1 4 2097 1 1 23 SER CB C 2.915 3.190 -6.854 1.00 . A A . 23 SER CB 1 1 4 2098 1 1 23 SER H H 2.798 5.394 -5.354 1.00 . A A . 23 SER H 1 1 4 2099 1 1 23 SER HA H 2.385 4.773 -8.241 1.00 . A A . 23 SER HA 1 1 4 2100 1 1 23 SER HB2 H 3.941 3.236 -7.189 1.00 . A A . 23 SER HB2 1 1 4 2101 1 1 23 SER HB3 H 2.917 3.076 -5.780 1.00 . A A . 23 SER HB3 1 1 4 2102 1 1 23 SER HG H 2.224 2.306 -8.442 1.00 . A A . 23 SER HG 1 1 4 2103 1 1 23 SER N N 2.764 5.549 -6.325 1.00 . A A . 23 SER N 1 1 4 2104 1 1 23 SER O O 0.291 5.156 -5.981 1.00 . A A . 23 SER O 1 1 4 2105 1 1 23 SER OG O 2.267 2.106 -7.505 1.00 . A A . 23 SER OG 1 1 4 2106 1 1 24 GLN C C -2.060 2.798 -6.400 1.00 . A A . 24 GLN C 1 1 4 2107 1 1 24 GLN CA C -1.581 3.947 -7.290 1.00 . A A . 24 GLN CA 1 1 4 2108 1 1 24 GLN CB C -2.452 4.039 -8.544 1.00 . A A . 24 GLN CB 1 1 4 2109 1 1 24 GLN CD C -2.885 6.456 -9.023 1.00 . A A . 24 GLN CD 1 1 4 2110 1 1 24 GLN CG C -2.019 5.246 -9.380 1.00 . A A . 24 GLN CG 1 1 4 2111 1 1 24 GLN H H 0.154 3.324 -8.434 1.00 . A A . 24 GLN H 1 1 4 2112 1 1 24 GLN HA H -1.708 4.863 -6.728 1.00 . A A . 24 GLN HA 1 1 4 2113 1 1 24 GLN HB2 H -2.339 3.135 -9.126 1.00 . A A . 24 GLN HB2 1 1 4 2114 1 1 24 GLN HB3 H -3.485 4.159 -8.258 1.00 . A A . 24 GLN HB3 1 1 4 2115 1 1 24 GLN HE21 H -2.531 7.396 -10.735 1.00 . A A . 24 GLN HE21 1 1 4 2116 1 1 24 GLN HE22 H -3.551 8.216 -9.655 1.00 . A A . 24 GLN HE22 1 1 4 2117 1 1 24 GLN HG2 H -0.982 5.470 -9.175 1.00 . A A . 24 GLN HG2 1 1 4 2118 1 1 24 GLN HG3 H -2.140 5.021 -10.429 1.00 . A A . 24 GLN HG3 1 1 4 2119 1 1 24 GLN N N -0.141 3.851 -7.663 1.00 . A A . 24 GLN N 1 1 4 2120 1 1 24 GLN NE2 N -2.998 7.436 -9.875 1.00 . A A . 24 GLN NE2 1 1 4 2121 1 1 24 GLN O O -2.618 3.042 -5.353 1.00 . A A . 24 GLN O 1 1 4 2122 1 1 24 GLN OE1 O -3.465 6.508 -7.957 1.00 . A A . 24 GLN OE1 1 1 4 2123 1 1 25 LYS C C -1.496 0.533 -4.588 1.00 . A A . 25 LYS C 1 1 4 2124 1 1 25 LYS CA C -2.362 0.483 -5.848 1.00 . A A . 25 LYS CA 1 1 4 2125 1 1 25 LYS CB C -2.168 -0.863 -6.545 1.00 . A A . 25 LYS CB 1 1 4 2126 1 1 25 LYS CD C -3.715 -2.433 -7.742 1.00 . A A . 25 LYS CD 1 1 4 2127 1 1 25 LYS CE C -4.757 -3.527 -7.500 1.00 . A A . 25 LYS CE 1 1 4 2128 1 1 25 LYS CG C -3.460 -1.672 -6.439 1.00 . A A . 25 LYS CG 1 1 4 2129 1 1 25 LYS H H -1.426 1.342 -7.601 1.00 . A A . 25 LYS H 1 1 4 2130 1 1 25 LYS HA H -3.402 0.636 -5.601 1.00 . A A . 25 LYS HA 1 1 4 2131 1 1 25 LYS HB2 H -1.920 -0.698 -7.584 1.00 . A A . 25 LYS HB2 1 1 4 2132 1 1 25 LYS HB3 H -1.369 -1.401 -6.060 1.00 . A A . 25 LYS HB3 1 1 4 2133 1 1 25 LYS HD2 H -4.080 -1.745 -8.490 1.00 . A A . 25 LYS HD2 1 1 4 2134 1 1 25 LYS HD3 H -2.797 -2.887 -8.082 1.00 . A A . 25 LYS HD3 1 1 4 2135 1 1 25 LYS HE2 H -4.584 -3.984 -6.537 1.00 . A A . 25 LYS HE2 1 1 4 2136 1 1 25 LYS HE3 H -5.746 -3.090 -7.518 1.00 . A A . 25 LYS HE3 1 1 4 2137 1 1 25 LYS HG2 H -3.371 -2.367 -5.616 1.00 . A A . 25 LYS HG2 1 1 4 2138 1 1 25 LYS HG3 H -4.277 -0.992 -6.252 1.00 . A A . 25 LYS HG3 1 1 4 2139 1 1 25 LYS HZ1 H -4.127 -4.172 -9.378 1.00 . A A . 25 LYS HZ1 1 1 4 2140 1 1 25 LYS HZ2 H -4.145 -5.391 -8.201 1.00 . A A . 25 LYS HZ2 1 1 4 2141 1 1 25 LYS HZ3 H -5.607 -4.840 -8.872 1.00 . A A . 25 LYS HZ3 1 1 4 2142 1 1 25 LYS N N -1.874 1.561 -6.758 1.00 . A A . 25 LYS N 1 1 4 2143 1 1 25 LYS NZ N -4.652 -4.560 -8.569 1.00 . A A . 25 LYS NZ 1 1 4 2144 1 1 25 LYS O O -1.912 0.420 -3.454 1.00 . A A . 25 LYS O 1 1 4 2145 1 1 26 TYR C C 0.597 1.897 -2.802 1.00 . A A . 26 TYR C 1 1 4 2146 1 1 26 TYR CA C 0.846 0.804 -3.852 1.00 . A A . 26 TYR CA 1 1 4 2147 1 1 26 TYR CB C 2.021 1.196 -4.727 1.00 . A A . 26 TYR CB 1 1 4 2148 1 1 26 TYR CD1 C 2.061 -1.301 -5.162 1.00 . A A . 26 TYR CD1 1 1 4 2149 1 1 26 TYR CD2 C 3.971 0.050 -5.776 1.00 . A A . 26 TYR CD2 1 1 4 2150 1 1 26 TYR CE1 C 2.716 -2.437 -5.631 1.00 . A A . 26 TYR CE1 1 1 4 2151 1 1 26 TYR CE2 C 4.630 -1.087 -6.249 1.00 . A A . 26 TYR CE2 1 1 4 2152 1 1 26 TYR CG C 2.691 -0.054 -5.235 1.00 . A A . 26 TYR CG 1 1 4 2153 1 1 26 TYR CZ C 4.003 -2.338 -6.176 1.00 . A A . 26 TYR CZ 1 1 4 2154 1 1 26 TYR H H -0.003 0.791 -5.809 1.00 . A A . 26 TYR H 1 1 4 2155 1 1 26 TYR HA H 1.091 -0.147 -3.401 1.00 . A A . 26 TYR HA 1 1 4 2156 1 1 26 TYR HB2 H 1.619 1.758 -5.552 1.00 . A A . 26 TYR HB2 1 1 4 2157 1 1 26 TYR HB3 H 2.723 1.797 -4.169 1.00 . A A . 26 TYR HB3 1 1 4 2158 1 1 26 TYR HD1 H 1.069 -1.403 -4.747 1.00 . A A . 26 TYR HD1 1 1 4 2159 1 1 26 TYR HD2 H 4.449 1.014 -5.833 1.00 . A A . 26 TYR HD2 1 1 4 2160 1 1 26 TYR HE1 H 2.201 -3.380 -5.558 1.00 . A A . 26 TYR HE1 1 1 4 2161 1 1 26 TYR HE2 H 5.622 -0.982 -6.662 1.00 . A A . 26 TYR HE2 1 1 4 2162 1 1 26 TYR HH H 4.624 -3.449 -7.599 1.00 . A A . 26 TYR HH 1 1 4 2163 1 1 26 TYR N N -0.242 0.711 -4.863 1.00 . A A . 26 TYR N 1 1 4 2164 1 1 26 TYR O O 1.172 1.874 -1.731 1.00 . A A . 26 TYR O 1 1 4 2165 1 1 26 TYR OH O 4.647 -3.467 -6.640 1.00 . A A . 26 TYR OH 1 1 4 2166 1 1 27 ARG C C -1.902 3.705 -1.501 1.00 . A A . 27 ARG C 1 1 4 2167 1 1 27 ARG CA C -0.499 3.928 -2.070 1.00 . A A . 27 ARG CA 1 1 4 2168 1 1 27 ARG CB C -0.355 5.292 -2.758 1.00 . A A . 27 ARG CB 1 1 4 2169 1 1 27 ARG CD C -1.527 7.127 -3.968 1.00 . A A . 27 ARG CD 1 1 4 2170 1 1 27 ARG CG C -1.643 5.683 -3.477 1.00 . A A . 27 ARG CG 1 1 4 2171 1 1 27 ARG CZ C -2.251 8.526 -2.131 1.00 . A A . 27 ARG CZ 1 1 4 2172 1 1 27 ARG H H -0.707 2.882 -3.935 1.00 . A A . 27 ARG H 1 1 4 2173 1 1 27 ARG HA H 0.220 3.832 -1.269 1.00 . A A . 27 ARG HA 1 1 4 2174 1 1 27 ARG HB2 H -0.121 6.062 -2.038 1.00 . A A . 27 ARG HB2 1 1 4 2175 1 1 27 ARG HB3 H 0.434 5.228 -3.492 1.00 . A A . 27 ARG HB3 1 1 4 2176 1 1 27 ARG HD2 H -0.717 7.200 -4.679 1.00 . A A . 27 ARG HD2 1 1 4 2177 1 1 27 ARG HD3 H -2.451 7.418 -4.447 1.00 . A A . 27 ARG HD3 1 1 4 2178 1 1 27 ARG HE H -0.334 8.254 -2.574 1.00 . A A . 27 ARG HE 1 1 4 2179 1 1 27 ARG HG2 H -1.757 5.030 -4.329 1.00 . A A . 27 ARG HG2 1 1 4 2180 1 1 27 ARG HG3 H -2.479 5.598 -2.796 1.00 . A A . 27 ARG HG3 1 1 4 2181 1 1 27 ARG HH11 H -2.796 6.763 -1.357 1.00 . A A . 27 ARG HH11 1 1 4 2182 1 1 27 ARG HH12 H -3.752 8.123 -0.870 1.00 . A A . 27 ARG HH12 1 1 4 2183 1 1 27 ARG HH21 H -1.937 10.406 -2.745 1.00 . A A . 27 ARG HH21 1 1 4 2184 1 1 27 ARG HH22 H -3.266 10.186 -1.657 1.00 . A A . 27 ARG HH22 1 1 4 2185 1 1 27 ARG N N -0.243 2.858 -3.074 1.00 . A A . 27 ARG N 1 1 4 2186 1 1 27 ARG NE N -1.257 8.032 -2.817 1.00 . A A . 27 ARG NE 1 1 4 2187 1 1 27 ARG NH1 N -2.991 7.743 -1.396 1.00 . A A . 27 ARG NH1 1 1 4 2188 1 1 27 ARG NH2 N -2.504 9.805 -2.181 1.00 . A A . 27 ARG NH2 1 1 4 2189 1 1 27 ARG O O -2.121 3.733 -0.306 1.00 . A A . 27 ARG O 1 1 4 2190 1 1 28 ALA C C -4.405 1.745 -1.642 1.00 . A A . 28 ALA C 1 1 4 2191 1 1 28 ALA CA C -4.256 3.238 -1.943 1.00 . A A . 28 ALA CA 1 1 4 2192 1 1 28 ALA CB C -5.211 3.634 -3.071 1.00 . A A . 28 ALA CB 1 1 4 2193 1 1 28 ALA H H -2.618 3.462 -3.315 1.00 . A A . 28 ALA H 1 1 4 2194 1 1 28 ALA HA H -4.471 3.812 -1.053 1.00 . A A . 28 ALA HA 1 1 4 2195 1 1 28 ALA HB1 H -4.911 3.144 -3.986 1.00 . A A . 28 ALA HB1 1 1 4 2196 1 1 28 ALA HB2 H -6.216 3.332 -2.815 1.00 . A A . 28 ALA HB2 1 1 4 2197 1 1 28 ALA HB3 H -5.181 4.705 -3.209 1.00 . A A . 28 ALA HB3 1 1 4 2198 1 1 28 ALA N N -2.848 3.477 -2.367 1.00 . A A . 28 ALA N 1 1 4 2199 1 1 28 ALA O O -4.758 1.360 -0.546 1.00 . A A . 28 ALA O 1 1 4 2200 1 1 29 ASN C C -3.269 -0.997 -1.267 1.00 . A A . 29 ASN C 1 1 4 2201 1 1 29 ASN CA C -4.269 -0.567 -2.336 1.00 . A A . 29 ASN CA 1 1 4 2202 1 1 29 ASN CB C -4.028 -1.416 -3.584 1.00 . A A . 29 ASN CB 1 1 4 2203 1 1 29 ASN CG C -5.362 -1.656 -4.296 1.00 . A A . 29 ASN CG 1 1 4 2204 1 1 29 ASN H H -3.851 1.218 -3.480 1.00 . A A . 29 ASN H 1 1 4 2205 1 1 29 ASN HA H -5.260 -0.747 -1.963 1.00 . A A . 29 ASN HA 1 1 4 2206 1 1 29 ASN HB2 H -3.343 -0.900 -4.238 1.00 . A A . 29 ASN HB2 1 1 4 2207 1 1 29 ASN HB3 H -3.598 -2.369 -3.301 1.00 . A A . 29 ASN HB3 1 1 4 2208 1 1 29 ASN HD21 H -5.629 0.260 -4.740 1.00 . A A . 29 ASN HD21 1 1 4 2209 1 1 29 ASN HD22 H -6.856 -0.786 -5.269 1.00 . A A . 29 ASN HD22 1 1 4 2210 1 1 29 ASN N N -4.136 0.895 -2.599 1.00 . A A . 29 ASN N 1 1 4 2211 1 1 29 ASN ND2 N -6.002 -0.644 -4.812 1.00 . A A . 29 ASN ND2 1 1 4 2212 1 1 29 ASN O O -3.334 -2.091 -0.743 1.00 . A A . 29 ASN O 1 1 4 2213 1 1 29 ASN OD1 O -5.826 -2.774 -4.387 1.00 . A A . 29 ASN OD1 1 1 4 2214 1 1 30 CYS C C -1.284 0.720 1.033 1.00 . A A . 30 CYS C 1 1 4 2215 1 1 30 CYS CA C -1.334 -0.472 0.083 1.00 . A A . 30 CYS CA 1 1 4 2216 1 1 30 CYS CB C -0.031 -0.725 -0.667 1.00 . A A . 30 CYS CB 1 1 4 2217 1 1 30 CYS H H -2.313 0.739 -1.383 1.00 . A A . 30 CYS H 1 1 4 2218 1 1 30 CYS HA H -1.648 -1.358 0.618 1.00 . A A . 30 CYS HA 1 1 4 2219 1 1 30 CYS HB2 H 0.156 0.082 -1.359 1.00 . A A . 30 CYS HB2 1 1 4 2220 1 1 30 CYS HB3 H 0.792 -0.849 0.020 1.00 . A A . 30 CYS HB3 1 1 4 2221 1 1 30 CYS N N -2.347 -0.137 -0.947 1.00 . A A . 30 CYS N 1 1 4 2222 1 1 30 CYS O O -0.260 1.143 1.531 1.00 . A A . 30 CYS O 1 1 4 2223 1 1 30 CYS SG S -0.314 -2.279 -1.549 1.00 . A A . 30 CYS SG 1 1 4 2224 1 1 31 ALA C C -2.564 1.964 3.602 1.00 . A A . 31 ALA C 1 1 4 2225 1 1 31 ALA CA C -2.686 2.406 2.139 1.00 . A A . 31 ALA CA 1 1 4 2226 1 1 31 ALA CB C -4.091 2.926 1.830 1.00 . A A . 31 ALA CB 1 1 4 2227 1 1 31 ALA H H -3.238 0.835 0.811 1.00 . A A . 31 ALA H 1 1 4 2228 1 1 31 ALA HA H -1.952 3.167 1.910 1.00 . A A . 31 ALA HA 1 1 4 2229 1 1 31 ALA HB1 H -4.705 2.105 1.487 1.00 . A A . 31 ALA HB1 1 1 4 2230 1 1 31 ALA HB2 H -4.528 3.349 2.722 1.00 . A A . 31 ALA HB2 1 1 4 2231 1 1 31 ALA HB3 H -4.043 3.675 1.054 1.00 . A A . 31 ALA HB3 1 1 4 2232 1 1 31 ALA N N -2.461 1.235 1.252 1.00 . A A . 31 ALA N 1 1 4 2233 1 1 31 ALA O O -2.553 2.766 4.515 1.00 . A A . 31 ALA O 1 1 4 2234 1 1 32 LYS C C -0.834 0.208 5.547 1.00 . A A . 32 LYS C 1 1 4 2235 1 1 32 LYS CA C -2.331 0.180 5.234 1.00 . A A . 32 LYS CA 1 1 4 2236 1 1 32 LYS CB C -2.833 -1.266 5.282 1.00 . A A . 32 LYS CB 1 1 4 2237 1 1 32 LYS CD C -0.707 -2.605 5.044 1.00 . A A . 32 LYS CD 1 1 4 2238 1 1 32 LYS CE C -0.348 -4.078 5.276 1.00 . A A . 32 LYS CE 1 1 4 2239 1 1 32 LYS CG C -1.828 -2.178 5.998 1.00 . A A . 32 LYS CG 1 1 4 2240 1 1 32 LYS H H -2.467 0.047 3.099 1.00 . A A . 32 LYS H 1 1 4 2241 1 1 32 LYS HA H -2.884 0.804 5.921 1.00 . A A . 32 LYS HA 1 1 4 2242 1 1 32 LYS HB2 H -3.777 -1.290 5.803 1.00 . A A . 32 LYS HB2 1 1 4 2243 1 1 32 LYS HB3 H -2.975 -1.617 4.271 1.00 . A A . 32 LYS HB3 1 1 4 2244 1 1 32 LYS HD2 H -1.034 -2.471 4.024 1.00 . A A . 32 LYS HD2 1 1 4 2245 1 1 32 LYS HD3 H 0.167 -1.997 5.223 1.00 . A A . 32 LYS HD3 1 1 4 2246 1 1 32 LYS HE2 H -1.026 -4.705 4.717 1.00 . A A . 32 LYS HE2 1 1 4 2247 1 1 32 LYS HE3 H 0.664 -4.280 4.949 1.00 . A A . 32 LYS HE3 1 1 4 2248 1 1 32 LYS HG2 H -1.403 -1.655 6.842 1.00 . A A . 32 LYS HG2 1 1 4 2249 1 1 32 LYS HG3 H -2.344 -3.058 6.353 1.00 . A A . 32 LYS HG3 1 1 4 2250 1 1 32 LYS HZ1 H -0.198 -3.561 7.289 1.00 . A A . 32 LYS HZ1 1 1 4 2251 1 1 32 LYS HZ2 H -1.456 -4.643 6.948 1.00 . A A . 32 LYS HZ2 1 1 4 2252 1 1 32 LYS HZ3 H 0.154 -5.192 6.960 1.00 . A A . 32 LYS HZ3 1 1 4 2253 1 1 32 LYS N N -2.462 0.686 3.840 1.00 . A A . 32 LYS N 1 1 4 2254 1 1 32 LYS NZ N -0.471 -4.392 6.727 1.00 . A A . 32 LYS NZ 1 1 4 2255 1 1 32 LYS O O -0.414 0.303 6.683 1.00 . A A . 32 LYS O 1 1 4 2256 1 1 33 THR C C 1.933 1.588 4.685 1.00 . A A . 33 THR C 1 1 4 2257 1 1 33 THR CA C 1.440 0.144 4.640 1.00 . A A . 33 THR CA 1 1 4 2258 1 1 33 THR CB C 1.902 -0.748 3.489 1.00 . A A . 33 THR CB 1 1 4 2259 1 1 33 THR CG2 C 2.645 0.000 2.389 1.00 . A A . 33 THR CG2 1 1 4 2260 1 1 33 THR H H -0.407 0.053 3.614 1.00 . A A . 33 THR H 1 1 4 2261 1 1 33 THR HA H 1.748 -0.283 5.575 1.00 . A A . 33 THR HA 1 1 4 2262 1 1 33 THR HB H 1.031 -1.226 3.069 1.00 . A A . 33 THR HB 1 1 4 2263 1 1 33 THR HG1 H 2.284 -2.137 4.792 1.00 . A A . 33 THR HG1 1 1 4 2264 1 1 33 THR HG21 H 2.532 1.065 2.506 1.00 . A A . 33 THR HG21 1 1 4 2265 1 1 33 THR HG22 H 3.681 -0.289 2.437 1.00 . A A . 33 THR HG22 1 1 4 2266 1 1 33 THR HG23 H 2.244 -0.298 1.433 1.00 . A A . 33 THR HG23 1 1 4 2267 1 1 33 THR N N -0.037 0.128 4.517 1.00 . A A . 33 THR N 1 1 4 2268 1 1 33 THR O O 3.005 1.877 5.175 1.00 . A A . 33 THR O 1 1 4 2269 1 1 33 THR OG1 O 2.728 -1.766 4.026 1.00 . A A . 33 THR OG1 1 1 4 2270 1 1 34 CYS C C 0.558 4.773 4.966 1.00 . A A . 34 CYS C 1 1 4 2271 1 1 34 CYS CA C 1.580 3.923 4.207 1.00 . A A . 34 CYS CA 1 1 4 2272 1 1 34 CYS CB C 1.695 4.520 2.809 1.00 . A A . 34 CYS CB 1 1 4 2273 1 1 34 CYS H H 0.287 2.240 3.794 1.00 . A A . 34 CYS H 1 1 4 2274 1 1 34 CYS HA H 2.540 3.992 4.698 1.00 . A A . 34 CYS HA 1 1 4 2275 1 1 34 CYS HB2 H 1.931 3.759 2.086 1.00 . A A . 34 CYS HB2 1 1 4 2276 1 1 34 CYS HB3 H 0.754 4.948 2.531 1.00 . A A . 34 CYS HB3 1 1 4 2277 1 1 34 CYS N N 1.149 2.498 4.180 1.00 . A A . 34 CYS N 1 1 4 2278 1 1 34 CYS O O 0.733 5.966 5.119 1.00 . A A . 34 CYS O 1 1 4 2279 1 1 34 CYS SG S 2.944 5.824 2.947 1.00 . A A . 34 CYS SG 1 1 4 2280 1 1 35 GLU C C -2.304 5.914 5.296 1.00 . A A . 35 GLU C 1 1 4 2281 1 1 35 GLU CA C -1.533 4.947 6.191 1.00 . A A . 35 GLU CA 1 1 4 2282 1 1 35 GLU CB C -0.873 5.622 7.388 1.00 . A A . 35 GLU CB 1 1 4 2283 1 1 35 GLU CD C 0.812 4.719 9.022 1.00 . A A . 35 GLU CD 1 1 4 2284 1 1 35 GLU CG C -0.488 4.437 8.266 1.00 . A A . 35 GLU CG 1 1 4 2285 1 1 35 GLU H H -0.632 3.219 5.315 1.00 . A A . 35 GLU H 1 1 4 2286 1 1 35 GLU HA H -2.249 4.228 6.563 1.00 . A A . 35 GLU HA 1 1 4 2287 1 1 35 GLU HB2 H -0.006 6.189 7.074 1.00 . A A . 35 GLU HB2 1 1 4 2288 1 1 35 GLU HB3 H -1.575 6.241 7.925 1.00 . A A . 35 GLU HB3 1 1 4 2289 1 1 35 GLU HG2 H -1.298 4.238 8.952 1.00 . A A . 35 GLU HG2 1 1 4 2290 1 1 35 GLU HG3 H -0.356 3.584 7.613 1.00 . A A . 35 GLU HG3 1 1 4 2291 1 1 35 GLU N N -0.502 4.180 5.443 1.00 . A A . 35 GLU N 1 1 4 2292 1 1 35 GLU O O -2.765 6.960 5.706 1.00 . A A . 35 GLU O 1 1 4 2293 1 1 35 GLU OE1 O 0.778 5.521 9.942 1.00 . A A . 35 GLU OE1 1 1 4 2294 1 1 35 GLU OE2 O 1.819 4.129 8.669 1.00 . A A . 35 GLU OE2 1 1 4 2295 1 1 36 LEU C C -4.650 5.976 3.223 1.00 . A A . 36 LEU C 1 1 4 2296 1 1 36 LEU CA C -3.173 6.341 3.064 1.00 . A A . 36 LEU CA 1 1 4 2297 1 1 36 LEU CB C -2.691 5.917 1.680 1.00 . A A . 36 LEU CB 1 1 4 2298 1 1 36 LEU CD1 C -0.659 5.813 0.224 1.00 . A A . 36 LEU CD1 1 1 4 2299 1 1 36 LEU CD2 C -1.231 7.926 1.433 1.00 . A A . 36 LEU CD2 1 1 4 2300 1 1 36 LEU CG C -1.257 6.399 1.505 1.00 . A A . 36 LEU CG 1 1 4 2301 1 1 36 LEU H H -2.051 4.667 3.788 1.00 . A A . 36 LEU H 1 1 4 2302 1 1 36 LEU HA H -3.004 7.392 3.221 1.00 . A A . 36 LEU HA 1 1 4 2303 1 1 36 LEU HB2 H -2.724 4.850 1.657 1.00 . A A . 36 LEU HB2 1 1 4 2304 1 1 36 LEU HB3 H -3.306 6.292 0.883 1.00 . A A . 36 LEU HB3 1 1 4 2305 1 1 36 LEU HD11 H -1.410 5.786 -0.552 1.00 . A A . 36 LEU HD11 1 1 4 2306 1 1 36 LEU HD12 H 0.161 6.438 -0.099 1.00 . A A . 36 LEU HD12 1 1 4 2307 1 1 36 LEU HD13 H -0.298 4.812 0.408 1.00 . A A . 36 LEU HD13 1 1 4 2308 1 1 36 LEU HD21 H -2.242 8.300 1.362 1.00 . A A . 36 LEU HD21 1 1 4 2309 1 1 36 LEU HD22 H -0.764 8.321 2.323 1.00 . A A . 36 LEU HD22 1 1 4 2310 1 1 36 LEU HD23 H -0.671 8.237 0.563 1.00 . A A . 36 LEU HD23 1 1 4 2311 1 1 36 LEU HG H -0.704 6.065 2.367 1.00 . A A . 36 LEU HG 1 1 4 2312 1 1 36 LEU N N -2.437 5.523 4.062 1.00 . A A . 36 LEU N 1 1 4 2313 1 1 36 LEU O O -5.507 6.549 2.581 1.00 . A A . 36 LEU O 1 1 4 2314 1 1 37 CYS C C -7.195 5.896 4.661 1.00 . A A . 37 CYS C 1 1 4 2315 1 1 37 CYS CA C -6.401 4.658 4.238 1.00 . A A . 37 CYS CA 1 1 4 2316 1 1 37 CYS CB C -6.529 3.579 5.315 1.00 . A A . 37 CYS CB 1 1 4 2317 1 1 37 CYS H H -4.284 4.552 4.600 1.00 . A A . 37 CYS H 1 1 4 2318 1 1 37 CYS HA H -6.789 4.284 3.302 1.00 . A A . 37 CYS HA 1 1 4 2319 1 1 37 CYS HB2 H -6.711 2.623 4.847 1.00 . A A . 37 CYS HB2 1 1 4 2320 1 1 37 CYS HB3 H -5.613 3.531 5.886 1.00 . A A . 37 CYS HB3 1 1 4 2321 1 1 37 CYS N N -4.967 5.027 4.072 1.00 . A A . 37 CYS N 1 1 4 2322 1 1 37 CYS O O -6.724 6.607 5.534 1.00 . A A . 37 CYS O 1 1 4 2323 1 1 37 CYS OXT O -8.258 6.113 4.105 1.00 . A A . 37 CYS OXT 1 1 4 2324 1 1 37 CYS SG S -7.905 3.989 6.416 1.00 . A A . 37 CYS SG 1 1 5 2325 1 1 1 VAL C C -12.126 1.333 2.481 1.00 . A A . 1 VAL C 1 1 5 2326 1 1 1 VAL CA C -13.526 1.448 3.089 1.00 . A A . 1 VAL CA 1 1 5 2327 1 1 1 VAL CB C -14.005 0.062 3.524 1.00 . A A . 1 VAL CB 1 1 5 2328 1 1 1 VAL CG1 C -13.081 -0.482 4.615 1.00 . A A . 1 VAL CG1 1 1 5 2329 1 1 1 VAL CG2 C -15.429 0.168 4.074 1.00 . A A . 1 VAL CG2 1 1 5 2330 1 1 1 VAL H1 H -13.923 2.540 1.362 1.00 . A A . 1 VAL H1 1 1 5 2331 1 1 1 VAL H2 H -14.969 1.222 1.604 1.00 . A A . 1 VAL H2 1 1 5 2332 1 1 1 VAL H3 H -15.153 2.626 2.533 1.00 . A A . 1 VAL H3 1 1 5 2333 1 1 1 VAL HA H -13.495 2.105 3.945 1.00 . A A . 1 VAL HA 1 1 5 2334 1 1 1 VAL HB H -13.988 -0.606 2.675 1.00 . A A . 1 VAL HB 1 1 5 2335 1 1 1 VAL HG11 H -12.064 -0.182 4.407 1.00 . A A . 1 VAL HG11 1 1 5 2336 1 1 1 VAL HG12 H -13.384 -0.086 5.573 1.00 . A A . 1 VAL HG12 1 1 5 2337 1 1 1 VAL HG13 H -13.142 -1.560 4.634 1.00 . A A . 1 VAL HG13 1 1 5 2338 1 1 1 VAL HG21 H -15.457 0.905 4.862 1.00 . A A . 1 VAL HG21 1 1 5 2339 1 1 1 VAL HG22 H -16.101 0.462 3.280 1.00 . A A . 1 VAL HG22 1 1 5 2340 1 1 1 VAL HG23 H -15.735 -0.791 4.467 1.00 . A A . 1 VAL HG23 1 1 5 2341 1 1 1 VAL N N -14.463 2.001 2.069 1.00 . A A . 1 VAL N 1 1 5 2342 1 1 1 VAL O O -11.892 0.552 1.581 1.00 . A A . 1 VAL O 1 1 5 2343 1 1 2 CYS C C -9.040 0.915 3.119 1.00 . A A . 2 CYS C 1 1 5 2344 1 1 2 CYS CA C -9.811 2.032 2.408 1.00 . A A . 2 CYS CA 1 1 5 2345 1 1 2 CYS CB C -9.097 3.366 2.634 1.00 . A A . 2 CYS CB 1 1 5 2346 1 1 2 CYS H H -11.396 2.730 3.692 1.00 . A A . 2 CYS H 1 1 5 2347 1 1 2 CYS HA H -9.871 1.827 1.350 1.00 . A A . 2 CYS HA 1 1 5 2348 1 1 2 CYS HB2 H -8.058 3.271 2.355 1.00 . A A . 2 CYS HB2 1 1 5 2349 1 1 2 CYS HB3 H -9.563 4.131 2.029 1.00 . A A . 2 CYS HB3 1 1 5 2350 1 1 2 CYS N N -11.191 2.105 2.965 1.00 . A A . 2 CYS N 1 1 5 2351 1 1 2 CYS O O -9.527 0.359 4.085 1.00 . A A . 2 CYS O 1 1 5 2352 1 1 2 CYS SG S -9.215 3.825 4.380 1.00 . A A . 2 CYS SG 1 1 5 2353 1 1 3 ARG C C -6.086 -1.045 2.236 1.00 . A A . 3 ARG C 1 1 5 2354 1 1 3 ARG CA C -7.042 -0.486 3.289 1.00 . A A . 3 ARG CA 1 1 5 2355 1 1 3 ARG CB C -7.932 -1.627 3.786 1.00 . A A . 3 ARG CB 1 1 5 2356 1 1 3 ARG CD C -8.971 -3.458 2.430 1.00 . A A . 3 ARG CD 1 1 5 2357 1 1 3 ARG CG C -8.986 -1.956 2.725 1.00 . A A . 3 ARG CG 1 1 5 2358 1 1 3 ARG CZ C -10.683 -3.853 4.098 1.00 . A A . 3 ARG CZ 1 1 5 2359 1 1 3 ARG H H -7.495 1.060 1.878 1.00 . A A . 3 ARG H 1 1 5 2360 1 1 3 ARG HA H -6.476 -0.074 4.112 1.00 . A A . 3 ARG HA 1 1 5 2361 1 1 3 ARG HB2 H -7.322 -2.497 3.978 1.00 . A A . 3 ARG HB2 1 1 5 2362 1 1 3 ARG HB3 H -8.427 -1.328 4.698 1.00 . A A . 3 ARG HB3 1 1 5 2363 1 1 3 ARG HD2 H -9.571 -3.660 1.554 1.00 . A A . 3 ARG HD2 1 1 5 2364 1 1 3 ARG HD3 H -7.956 -3.780 2.251 1.00 . A A . 3 ARG HD3 1 1 5 2365 1 1 3 ARG HE H -9.029 -4.947 3.985 1.00 . A A . 3 ARG HE 1 1 5 2366 1 1 3 ARG HG2 H -9.962 -1.669 3.090 1.00 . A A . 3 ARG HG2 1 1 5 2367 1 1 3 ARG HG3 H -8.765 -1.414 1.819 1.00 . A A . 3 ARG HG3 1 1 5 2368 1 1 3 ARG HH11 H -11.752 -4.804 2.697 1.00 . A A . 3 ARG HH11 1 1 5 2369 1 1 3 ARG HH12 H -12.672 -3.976 3.909 1.00 . A A . 3 ARG HH12 1 1 5 2370 1 1 3 ARG HH21 H -9.885 -2.820 5.617 1.00 . A A . 3 ARG HH21 1 1 5 2371 1 1 3 ARG HH22 H -11.615 -2.852 5.561 1.00 . A A . 3 ARG HH22 1 1 5 2372 1 1 3 ARG N N -7.861 0.590 2.657 1.00 . A A . 3 ARG N 1 1 5 2373 1 1 3 ARG NE N -9.529 -4.198 3.596 1.00 . A A . 3 ARG NE 1 1 5 2374 1 1 3 ARG NH1 N -11.788 -4.241 3.523 1.00 . A A . 3 ARG NH1 1 1 5 2375 1 1 3 ARG NH2 N -10.731 -3.118 5.175 1.00 . A A . 3 ARG NH2 1 1 5 2376 1 1 3 ARG O O -5.949 -0.497 1.160 1.00 . A A . 3 ARG O 1 1 5 2377 1 1 4 ASP C C -5.288 -3.550 0.536 1.00 . A A . 4 ASP C 1 1 5 2378 1 1 4 ASP CA C -4.485 -2.705 1.524 1.00 . A A . 4 ASP CA 1 1 5 2379 1 1 4 ASP CB C -3.432 -3.565 2.224 1.00 . A A . 4 ASP CB 1 1 5 2380 1 1 4 ASP CG C -4.052 -4.905 2.626 1.00 . A A . 4 ASP CG 1 1 5 2381 1 1 4 ASP H H -5.543 -2.565 3.398 1.00 . A A . 4 ASP H 1 1 5 2382 1 1 4 ASP HA H -4.010 -1.898 0.984 1.00 . A A . 4 ASP HA 1 1 5 2383 1 1 4 ASP HB2 H -2.604 -3.736 1.551 1.00 . A A . 4 ASP HB2 1 1 5 2384 1 1 4 ASP HB3 H -3.081 -3.059 3.110 1.00 . A A . 4 ASP HB3 1 1 5 2385 1 1 4 ASP N N -5.424 -2.130 2.528 1.00 . A A . 4 ASP N 1 1 5 2386 1 1 4 ASP O O -6.502 -3.589 0.602 1.00 . A A . 4 ASP O 1 1 5 2387 1 1 4 ASP OD1 O -4.866 -4.910 3.535 1.00 . A A . 4 ASP OD1 1 1 5 2388 1 1 4 ASP OD2 O -3.704 -5.903 2.016 1.00 . A A . 4 ASP OD2 1 1 5 2389 1 1 5 TRP C C -4.592 -6.209 -1.821 1.00 . A A . 5 TRP C 1 1 5 2390 1 1 5 TRP CA C -5.455 -5.042 -1.329 1.00 . A A . 5 TRP CA 1 1 5 2391 1 1 5 TRP CB C -5.928 -4.118 -2.454 1.00 . A A . 5 TRP CB 1 1 5 2392 1 1 5 TRP CD1 C -7.650 -2.324 -1.892 1.00 . A A . 5 TRP CD1 1 1 5 2393 1 1 5 TRP CD2 C -8.500 -4.404 -1.873 1.00 . A A . 5 TRP CD2 1 1 5 2394 1 1 5 TRP CE2 C -9.564 -3.527 -1.546 1.00 . A A . 5 TRP CE2 1 1 5 2395 1 1 5 TRP CE3 C -8.773 -5.781 -1.929 1.00 . A A . 5 TRP CE3 1 1 5 2396 1 1 5 TRP CG C -7.292 -3.617 -2.091 1.00 . A A . 5 TRP CG 1 1 5 2397 1 1 5 TRP CH2 C -11.102 -5.378 -1.344 1.00 . A A . 5 TRP CH2 1 1 5 2398 1 1 5 TRP CZ2 C -10.853 -4.003 -1.283 1.00 . A A . 5 TRP CZ2 1 1 5 2399 1 1 5 TRP CZ3 C -10.063 -6.261 -1.666 1.00 . A A . 5 TRP CZ3 1 1 5 2400 1 1 5 TRP H H -3.671 -4.211 -0.450 1.00 . A A . 5 TRP H 1 1 5 2401 1 1 5 TRP HA H -6.318 -5.439 -0.798 1.00 . A A . 5 TRP HA 1 1 5 2402 1 1 5 TRP HB2 H -5.240 -3.291 -2.543 1.00 . A A . 5 TRP HB2 1 1 5 2403 1 1 5 TRP HB3 H -5.977 -4.663 -3.386 1.00 . A A . 5 TRP HB3 1 1 5 2404 1 1 5 TRP HD1 H -7.007 -1.460 -1.967 1.00 . A A . 5 TRP HD1 1 1 5 2405 1 1 5 TRP HE1 H -9.497 -1.453 -1.381 1.00 . A A . 5 TRP HE1 1 1 5 2406 1 1 5 TRP HE3 H -7.981 -6.473 -2.175 1.00 . A A . 5 TRP HE3 1 1 5 2407 1 1 5 TRP HH2 H -12.092 -5.759 -1.144 1.00 . A A . 5 TRP HH2 1 1 5 2408 1 1 5 TRP HZ2 H -11.648 -3.315 -1.036 1.00 . A A . 5 TRP HZ2 1 1 5 2409 1 1 5 TRP HZ3 H -10.258 -7.322 -1.711 1.00 . A A . 5 TRP HZ3 1 1 5 2410 1 1 5 TRP N N -4.652 -4.229 -0.379 1.00 . A A . 5 TRP N 1 1 5 2411 1 1 5 TRP NE1 N -8.993 -2.273 -1.571 1.00 . A A . 5 TRP NE1 1 1 5 2412 1 1 5 TRP O O -5.102 -7.288 -2.048 1.00 . A A . 5 TRP O 1 1 5 2413 1 1 6 PHE C C -2.144 -7.923 -1.161 1.00 . A A . 6 PHE C 1 1 5 2414 1 1 6 PHE CA C -2.482 -7.191 -2.458 1.00 . A A . 6 PHE CA 1 1 5 2415 1 1 6 PHE CB C -1.139 -6.678 -2.963 1.00 . A A . 6 PHE CB 1 1 5 2416 1 1 6 PHE CD1 C -2.436 -5.701 -4.861 1.00 . A A . 6 PHE CD1 1 1 5 2417 1 1 6 PHE CD2 C -0.383 -4.626 -4.132 1.00 . A A . 6 PHE CD2 1 1 5 2418 1 1 6 PHE CE1 C -2.596 -4.727 -5.837 1.00 . A A . 6 PHE CE1 1 1 5 2419 1 1 6 PHE CE2 C -0.541 -3.651 -5.105 1.00 . A A . 6 PHE CE2 1 1 5 2420 1 1 6 PHE CG C -1.330 -5.639 -4.019 1.00 . A A . 6 PHE CG 1 1 5 2421 1 1 6 PHE CZ C -1.647 -3.705 -5.956 1.00 . A A . 6 PHE CZ 1 1 5 2422 1 1 6 PHE H H -2.838 -5.196 -1.816 1.00 . A A . 6 PHE H 1 1 5 2423 1 1 6 PHE HA H -2.997 -7.775 -3.207 1.00 . A A . 6 PHE HA 1 1 5 2424 1 1 6 PHE HB2 H -0.591 -6.226 -2.153 1.00 . A A . 6 PHE HB2 1 1 5 2425 1 1 6 PHE HB3 H -0.573 -7.492 -3.376 1.00 . A A . 6 PHE HB3 1 1 5 2426 1 1 6 PHE HD1 H -3.162 -6.487 -4.766 1.00 . A A . 6 PHE HD1 1 1 5 2427 1 1 6 PHE HD2 H 0.467 -4.590 -3.473 1.00 . A A . 6 PHE HD2 1 1 5 2428 1 1 6 PHE HE1 H -3.455 -4.789 -6.479 1.00 . A A . 6 PHE HE1 1 1 5 2429 1 1 6 PHE HE2 H 0.197 -2.873 -5.185 1.00 . A A . 6 PHE HE2 1 1 5 2430 1 1 6 PHE HZ H -1.764 -2.950 -6.706 1.00 . A A . 6 PHE HZ 1 1 5 2431 1 1 6 PHE N N -3.301 -6.045 -1.989 1.00 . A A . 6 PHE N 1 1 5 2432 1 1 6 PHE O O -2.934 -7.937 -0.238 1.00 . A A . 6 PHE O 1 1 5 2433 1 1 7 LYS C C -0.298 -8.062 1.154 1.00 . A A . 7 LYS C 1 1 5 2434 1 1 7 LYS CA C -0.690 -9.212 0.224 1.00 . A A . 7 LYS CA 1 1 5 2435 1 1 7 LYS CB C 0.492 -10.168 0.040 1.00 . A A . 7 LYS CB 1 1 5 2436 1 1 7 LYS CD C -0.941 -12.191 -0.284 1.00 . A A . 7 LYS CD 1 1 5 2437 1 1 7 LYS CE C -0.526 -13.654 -0.457 1.00 . A A . 7 LYS CE 1 1 5 2438 1 1 7 LYS CG C 0.104 -11.282 -0.934 1.00 . A A . 7 LYS CG 1 1 5 2439 1 1 7 LYS H H -0.336 -8.516 -1.782 1.00 . A A . 7 LYS H 1 1 5 2440 1 1 7 LYS HA H -1.571 -9.716 0.599 1.00 . A A . 7 LYS HA 1 1 5 2441 1 1 7 LYS HB2 H 1.337 -9.620 -0.353 1.00 . A A . 7 LYS HB2 1 1 5 2442 1 1 7 LYS HB3 H 0.757 -10.604 0.991 1.00 . A A . 7 LYS HB3 1 1 5 2443 1 1 7 LYS HD2 H -1.015 -11.958 0.769 1.00 . A A . 7 LYS HD2 1 1 5 2444 1 1 7 LYS HD3 H -1.899 -12.036 -0.757 1.00 . A A . 7 LYS HD3 1 1 5 2445 1 1 7 LYS HE2 H 0.239 -13.723 -1.215 1.00 . A A . 7 LYS HE2 1 1 5 2446 1 1 7 LYS HE3 H -0.142 -14.032 0.479 1.00 . A A . 7 LYS HE3 1 1 5 2447 1 1 7 LYS HG2 H -0.304 -10.846 -1.834 1.00 . A A . 7 LYS HG2 1 1 5 2448 1 1 7 LYS HG3 H 0.978 -11.866 -1.180 1.00 . A A . 7 LYS HG3 1 1 5 2449 1 1 7 LYS HZ1 H -2.577 -13.907 -0.724 1.00 . A A . 7 LYS HZ1 1 1 5 2450 1 1 7 LYS HZ2 H -1.620 -14.711 -1.876 1.00 . A A . 7 LYS HZ2 1 1 5 2451 1 1 7 LYS HZ3 H -1.758 -15.326 -0.298 1.00 . A A . 7 LYS HZ3 1 1 5 2452 1 1 7 LYS N N -0.992 -8.523 -1.054 1.00 . A A . 7 LYS N 1 1 5 2453 1 1 7 LYS NZ N -1.709 -14.460 -0.870 1.00 . A A . 7 LYS NZ 1 1 5 2454 1 1 7 LYS O O 0.277 -7.087 0.711 1.00 . A A . 7 LYS O 1 1 5 2455 1 1 8 GLU C C 1.273 -6.640 3.153 1.00 . A A . 8 GLU C 1 1 5 2456 1 1 8 GLU CA C -0.204 -7.005 3.327 1.00 . A A . 8 GLU CA 1 1 5 2457 1 1 8 GLU CB C -0.481 -7.432 4.770 1.00 . A A . 8 GLU CB 1 1 5 2458 1 1 8 GLU CD C -2.281 -8.572 6.075 1.00 . A A . 8 GLU CD 1 1 5 2459 1 1 8 GLU CG C -1.992 -7.534 4.989 1.00 . A A . 8 GLU CG 1 1 5 2460 1 1 8 GLU H H -1.051 -8.913 2.781 1.00 . A A . 8 GLU H 1 1 5 2461 1 1 8 GLU HA H -0.786 -6.123 3.100 1.00 . A A . 8 GLU HA 1 1 5 2462 1 1 8 GLU HB2 H -0.027 -8.396 4.948 1.00 . A A . 8 GLU HB2 1 1 5 2463 1 1 8 GLU HB3 H -0.070 -6.710 5.459 1.00 . A A . 8 GLU HB3 1 1 5 2464 1 1 8 GLU HG2 H -2.377 -6.571 5.295 1.00 . A A . 8 GLU HG2 1 1 5 2465 1 1 8 GLU HG3 H -2.470 -7.839 4.071 1.00 . A A . 8 GLU HG3 1 1 5 2466 1 1 8 GLU N N -0.586 -8.129 2.422 1.00 . A A . 8 GLU N 1 1 5 2467 1 1 8 GLU O O 1.694 -5.578 3.565 1.00 . A A . 8 GLU O 1 1 5 2468 1 1 8 GLU OE1 O -2.094 -9.748 5.808 1.00 . A A . 8 GLU OE1 1 1 5 2469 1 1 8 GLU OE2 O -2.685 -8.174 7.155 1.00 . A A . 8 GLU OE2 1 1 5 2470 1 1 9 THR C C 3.728 -6.410 1.059 1.00 . A A . 9 THR C 1 1 5 2471 1 1 9 THR CA C 3.503 -7.117 2.395 1.00 . A A . 9 THR CA 1 1 5 2472 1 1 9 THR CB C 4.316 -8.397 2.565 1.00 . A A . 9 THR CB 1 1 5 2473 1 1 9 THR CG2 C 4.204 -8.763 4.044 1.00 . A A . 9 THR CG2 1 1 5 2474 1 1 9 THR H H 1.752 -8.342 2.221 1.00 . A A . 9 THR H 1 1 5 2475 1 1 9 THR HA H 3.764 -6.428 3.185 1.00 . A A . 9 THR HA 1 1 5 2476 1 1 9 THR HB H 5.352 -8.223 2.328 1.00 . A A . 9 THR HB 1 1 5 2477 1 1 9 THR HG1 H 3.553 -9.023 0.887 1.00 . A A . 9 THR HG1 1 1 5 2478 1 1 9 THR HG21 H 3.458 -8.123 4.503 1.00 . A A . 9 THR HG21 1 1 5 2479 1 1 9 THR HG22 H 3.900 -9.794 4.144 1.00 . A A . 9 THR HG22 1 1 5 2480 1 1 9 THR HG23 H 5.157 -8.611 4.530 1.00 . A A . 9 THR HG23 1 1 5 2481 1 1 9 THR N N 2.073 -7.481 2.558 1.00 . A A . 9 THR N 1 1 5 2482 1 1 9 THR O O 4.594 -5.566 0.968 1.00 . A A . 9 THR O 1 1 5 2483 1 1 9 THR OG1 O 3.771 -9.416 1.736 1.00 . A A . 9 THR OG1 1 1 5 2484 1 1 10 ALA C C 3.176 -4.557 -0.914 1.00 . A A . 10 ALA C 1 1 5 2485 1 1 10 ALA CA C 3.167 -6.039 -1.271 1.00 . A A . 10 ALA CA 1 1 5 2486 1 1 10 ALA CB C 1.958 -6.252 -2.188 1.00 . A A . 10 ALA CB 1 1 5 2487 1 1 10 ALA H H 2.276 -7.409 0.145 1.00 . A A . 10 ALA H 1 1 5 2488 1 1 10 ALA HA H 4.094 -6.312 -1.749 1.00 . A A . 10 ALA HA 1 1 5 2489 1 1 10 ALA HB1 H 1.652 -7.286 -2.168 1.00 . A A . 10 ALA HB1 1 1 5 2490 1 1 10 ALA HB2 H 1.142 -5.632 -1.839 1.00 . A A . 10 ALA HB2 1 1 5 2491 1 1 10 ALA HB3 H 2.209 -5.964 -3.199 1.00 . A A . 10 ALA HB3 1 1 5 2492 1 1 10 ALA N N 2.971 -6.727 0.040 1.00 . A A . 10 ALA N 1 1 5 2493 1 1 10 ALA O O 3.934 -3.746 -1.409 1.00 . A A . 10 ALA O 1 1 5 2494 1 1 11 CYS C C 3.382 -2.485 1.234 1.00 . A A . 11 CYS C 1 1 5 2495 1 1 11 CYS CA C 2.104 -2.881 0.490 1.00 . A A . 11 CYS CA 1 1 5 2496 1 1 11 CYS CB C 0.831 -2.971 1.337 1.00 . A A . 11 CYS CB 1 1 5 2497 1 1 11 CYS H H 1.706 -4.964 0.339 1.00 . A A . 11 CYS H 1 1 5 2498 1 1 11 CYS HA H 1.958 -2.203 -0.337 1.00 . A A . 11 CYS HA 1 1 5 2499 1 1 11 CYS HB2 H 0.970 -3.624 2.191 1.00 . A A . 11 CYS HB2 1 1 5 2500 1 1 11 CYS HB3 H 0.512 -1.990 1.648 1.00 . A A . 11 CYS HB3 1 1 5 2501 1 1 11 CYS N N 2.283 -4.259 -0.018 1.00 . A A . 11 CYS N 1 1 5 2502 1 1 11 CYS O O 4.080 -1.586 0.809 1.00 . A A . 11 CYS O 1 1 5 2503 1 1 11 CYS SG S -0.447 -3.673 0.265 1.00 . A A . 11 CYS SG 1 1 5 2504 1 1 12 ARG C C 6.075 -2.498 2.144 1.00 . A A . 12 ARG C 1 1 5 2505 1 1 12 ARG CA C 4.930 -2.822 3.098 1.00 . A A . 12 ARG CA 1 1 5 2506 1 1 12 ARG CB C 5.323 -4.015 3.969 1.00 . A A . 12 ARG CB 1 1 5 2507 1 1 12 ARG CD C 7.309 -4.989 5.144 1.00 . A A . 12 ARG CD 1 1 5 2508 1 1 12 ARG CG C 6.848 -4.136 3.960 1.00 . A A . 12 ARG CG 1 1 5 2509 1 1 12 ARG CZ C 9.005 -4.123 6.642 1.00 . A A . 12 ARG CZ 1 1 5 2510 1 1 12 ARG H H 3.113 -3.862 2.621 1.00 . A A . 12 ARG H 1 1 5 2511 1 1 12 ARG HA H 4.774 -1.958 3.725 1.00 . A A . 12 ARG HA 1 1 5 2512 1 1 12 ARG HB2 H 4.971 -3.854 4.978 1.00 . A A . 12 ARG HB2 1 1 5 2513 1 1 12 ARG HB3 H 4.893 -4.919 3.567 1.00 . A A . 12 ARG HB3 1 1 5 2514 1 1 12 ARG HD2 H 6.490 -5.602 5.488 1.00 . A A . 12 ARG HD2 1 1 5 2515 1 1 12 ARG HD3 H 8.128 -5.621 4.834 1.00 . A A . 12 ARG HD3 1 1 5 2516 1 1 12 ARG HE H 7.123 -3.491 6.680 1.00 . A A . 12 ARG HE 1 1 5 2517 1 1 12 ARG HG2 H 7.155 -4.598 3.033 1.00 . A A . 12 ARG HG2 1 1 5 2518 1 1 12 ARG HG3 H 7.285 -3.151 4.036 1.00 . A A . 12 ARG HG3 1 1 5 2519 1 1 12 ARG HH11 H 9.748 -3.722 4.827 1.00 . A A . 12 ARG HH11 1 1 5 2520 1 1 12 ARG HH12 H 10.918 -3.927 6.087 1.00 . A A . 12 ARG HH12 1 1 5 2521 1 1 12 ARG HH21 H 8.553 -4.530 8.549 1.00 . A A . 12 ARG HH21 1 1 5 2522 1 1 12 ARG HH22 H 10.241 -4.384 8.195 1.00 . A A . 12 ARG HH22 1 1 5 2523 1 1 12 ARG N N 3.698 -3.142 2.318 1.00 . A A . 12 ARG N 1 1 5 2524 1 1 12 ARG NE N 7.760 -4.097 6.248 1.00 . A A . 12 ARG NE 1 1 5 2525 1 1 12 ARG NH1 N 9.965 -3.907 5.785 1.00 . A A . 12 ARG NH1 1 1 5 2526 1 1 12 ARG NH2 N 9.288 -4.365 7.893 1.00 . A A . 12 ARG NH2 1 1 5 2527 1 1 12 ARG O O 6.973 -1.755 2.481 1.00 . A A . 12 ARG O 1 1 5 2528 1 1 13 HIS C C 6.966 -1.240 -0.316 1.00 . A A . 13 HIS C 1 1 5 2529 1 1 13 HIS CA C 7.177 -2.710 0.038 1.00 . A A . 13 HIS CA 1 1 5 2530 1 1 13 HIS CB C 7.081 -3.584 -1.216 1.00 . A A . 13 HIS CB 1 1 5 2531 1 1 13 HIS CD2 C 9.669 -4.017 -1.350 1.00 . A A . 13 HIS CD2 1 1 5 2532 1 1 13 HIS CE1 C 9.958 -3.542 -3.443 1.00 . A A . 13 HIS CE1 1 1 5 2533 1 1 13 HIS CG C 8.439 -3.671 -1.855 1.00 . A A . 13 HIS CG 1 1 5 2534 1 1 13 HIS H H 5.341 -3.633 0.678 1.00 . A A . 13 HIS H 1 1 5 2535 1 1 13 HIS HA H 8.126 -2.838 0.540 1.00 . A A . 13 HIS HA 1 1 5 2536 1 1 13 HIS HB2 H 6.740 -4.572 -0.941 1.00 . A A . 13 HIS HB2 1 1 5 2537 1 1 13 HIS HB3 H 6.384 -3.142 -1.913 1.00 . A A . 13 HIS HB3 1 1 5 2538 1 1 13 HIS HD1 H 7.968 -3.089 -3.835 1.00 . A A . 13 HIS HD1 1 1 5 2539 1 1 13 HIS HD2 H 9.861 -4.307 -0.327 1.00 . A A . 13 HIS HD2 1 1 5 2540 1 1 13 HIS HE1 H 10.411 -3.376 -4.409 1.00 . A A . 13 HIS HE1 1 1 5 2541 1 1 13 HIS N N 6.062 -3.035 0.959 1.00 . A A . 13 HIS N 1 1 5 2542 1 1 13 HIS ND1 N 8.650 -3.373 -3.191 1.00 . A A . 13 HIS ND1 1 1 5 2543 1 1 13 HIS NE2 N 10.628 -3.934 -2.358 1.00 . A A . 13 HIS NE2 1 1 5 2544 1 1 13 HIS O O 7.790 -0.390 -0.047 1.00 . A A . 13 HIS O 1 1 5 2545 1 1 14 ALA C C 5.876 1.453 -0.156 1.00 . A A . 14 ALA C 1 1 5 2546 1 1 14 ALA CA C 5.565 0.473 -1.297 1.00 . A A . 14 ALA CA 1 1 5 2547 1 1 14 ALA CB C 4.112 0.586 -1.766 1.00 . A A . 14 ALA CB 1 1 5 2548 1 1 14 ALA H H 5.203 -1.656 -1.121 1.00 . A A . 14 ALA H 1 1 5 2549 1 1 14 ALA HA H 6.207 0.746 -2.121 1.00 . A A . 14 ALA HA 1 1 5 2550 1 1 14 ALA HB1 H 3.455 0.185 -1.005 1.00 . A A . 14 ALA HB1 1 1 5 2551 1 1 14 ALA HB2 H 3.878 1.623 -1.965 1.00 . A A . 14 ALA HB2 1 1 5 2552 1 1 14 ALA HB3 H 3.993 0.021 -2.681 1.00 . A A . 14 ALA HB3 1 1 5 2553 1 1 14 ALA N N 5.849 -0.942 -0.920 1.00 . A A . 14 ALA N 1 1 5 2554 1 1 14 ALA O O 6.455 2.491 -0.407 1.00 . A A . 14 ALA O 1 1 5 2555 1 1 15 LYS C C 7.401 2.236 2.297 1.00 . A A . 15 LYS C 1 1 5 2556 1 1 15 LYS CA C 5.875 2.195 2.136 1.00 . A A . 15 LYS CA 1 1 5 2557 1 1 15 LYS CB C 5.214 1.780 3.457 1.00 . A A . 15 LYS CB 1 1 5 2558 1 1 15 LYS CD C 6.284 3.702 4.674 1.00 . A A . 15 LYS CD 1 1 5 2559 1 1 15 LYS CE C 6.447 4.160 6.124 1.00 . A A . 15 LYS CE 1 1 5 2560 1 1 15 LYS CG C 6.092 2.185 4.636 1.00 . A A . 15 LYS CG 1 1 5 2561 1 1 15 LYS H H 5.072 0.373 1.330 1.00 . A A . 15 LYS H 1 1 5 2562 1 1 15 LYS HA H 5.508 3.176 1.846 1.00 . A A . 15 LYS HA 1 1 5 2563 1 1 15 LYS HB2 H 4.253 2.268 3.549 1.00 . A A . 15 LYS HB2 1 1 5 2564 1 1 15 LYS HB3 H 5.059 0.713 3.488 1.00 . A A . 15 LYS HB3 1 1 5 2565 1 1 15 LYS HD2 H 7.166 3.967 4.109 1.00 . A A . 15 LYS HD2 1 1 5 2566 1 1 15 LYS HD3 H 5.419 4.186 4.246 1.00 . A A . 15 LYS HD3 1 1 5 2567 1 1 15 LYS HE2 H 7.001 3.415 6.676 1.00 . A A . 15 LYS HE2 1 1 5 2568 1 1 15 LYS HE3 H 6.984 5.097 6.147 1.00 . A A . 15 LYS HE3 1 1 5 2569 1 1 15 LYS HG2 H 5.616 1.854 5.546 1.00 . A A . 15 LYS HG2 1 1 5 2570 1 1 15 LYS HG3 H 7.049 1.699 4.533 1.00 . A A . 15 LYS HG3 1 1 5 2571 1 1 15 LYS HZ1 H 4.385 4.431 5.998 1.00 . A A . 15 LYS HZ1 1 1 5 2572 1 1 15 LYS HZ2 H 4.879 3.512 7.332 1.00 . A A . 15 LYS HZ2 1 1 5 2573 1 1 15 LYS HZ3 H 5.109 5.196 7.333 1.00 . A A . 15 LYS HZ3 1 1 5 2574 1 1 15 LYS N N 5.537 1.198 1.082 1.00 . A A . 15 LYS N 1 1 5 2575 1 1 15 LYS NZ N 5.104 4.339 6.744 1.00 . A A . 15 LYS NZ 1 1 5 2576 1 1 15 LYS O O 7.992 3.297 2.296 1.00 . A A . 15 LYS O 1 1 5 2577 1 1 16 SER C C 10.283 1.048 1.265 1.00 . A A . 16 SER C 1 1 5 2578 1 1 16 SER CA C 9.545 1.106 2.604 1.00 . A A . 16 SER CA 1 1 5 2579 1 1 16 SER CB C 9.918 -0.175 3.340 1.00 . A A . 16 SER CB 1 1 5 2580 1 1 16 SER H H 7.603 0.240 2.447 1.00 . A A . 16 SER H 1 1 5 2581 1 1 16 SER HA H 9.878 1.939 3.201 1.00 . A A . 16 SER HA 1 1 5 2582 1 1 16 SER HB2 H 9.513 -1.010 2.790 1.00 . A A . 16 SER HB2 1 1 5 2583 1 1 16 SER HB3 H 10.995 -0.263 3.367 1.00 . A A . 16 SER HB3 1 1 5 2584 1 1 16 SER HG H 8.415 -0.340 4.564 1.00 . A A . 16 SER HG 1 1 5 2585 1 1 16 SER N N 8.061 1.110 2.441 1.00 . A A . 16 SER N 1 1 5 2586 1 1 16 SER O O 11.467 0.778 1.235 1.00 . A A . 16 SER O 1 1 5 2587 1 1 16 SER OG O 9.353 -0.155 4.644 1.00 . A A . 16 SER OG 1 1 5 2588 1 1 17 LEU C C 10.533 2.545 -1.844 1.00 . A A . 17 LEU C 1 1 5 2589 1 1 17 LEU CA C 10.412 1.207 -1.114 1.00 . A A . 17 LEU CA 1 1 5 2590 1 1 17 LEU CB C 9.796 0.097 -1.962 1.00 . A A . 17 LEU CB 1 1 5 2591 1 1 17 LEU CD1 C 9.149 1.347 -3.999 1.00 . A A . 17 LEU CD1 1 1 5 2592 1 1 17 LEU CD2 C 7.883 -0.705 -3.158 1.00 . A A . 17 LEU CD2 1 1 5 2593 1 1 17 LEU CG C 8.618 0.583 -2.788 1.00 . A A . 17 LEU CG 1 1 5 2594 1 1 17 LEU H H 8.686 1.498 0.169 1.00 . A A . 17 LEU H 1 1 5 2595 1 1 17 LEU HA H 11.415 0.906 -0.868 1.00 . A A . 17 LEU HA 1 1 5 2596 1 1 17 LEU HB2 H 10.524 -0.318 -2.637 1.00 . A A . 17 LEU HB2 1 1 5 2597 1 1 17 LEU HB3 H 9.438 -0.681 -1.306 1.00 . A A . 17 LEU HB3 1 1 5 2598 1 1 17 LEU HD11 H 10.219 1.460 -3.893 1.00 . A A . 17 LEU HD11 1 1 5 2599 1 1 17 LEU HD12 H 8.926 0.800 -4.902 1.00 . A A . 17 LEU HD12 1 1 5 2600 1 1 17 LEU HD13 H 8.680 2.319 -4.032 1.00 . A A . 17 LEU HD13 1 1 5 2601 1 1 17 LEU HD21 H 8.065 -1.420 -2.372 1.00 . A A . 17 LEU HD21 1 1 5 2602 1 1 17 LEU HD22 H 6.820 -0.556 -3.244 1.00 . A A . 17 LEU HD22 1 1 5 2603 1 1 17 LEU HD23 H 8.282 -1.088 -4.086 1.00 . A A . 17 LEU HD23 1 1 5 2604 1 1 17 LEU HG H 7.995 1.211 -2.179 1.00 . A A . 17 LEU HG 1 1 5 2605 1 1 17 LEU N N 9.642 1.284 0.158 1.00 . A A . 17 LEU N 1 1 5 2606 1 1 17 LEU O O 11.551 2.823 -2.446 1.00 . A A . 17 LEU O 1 1 5 2607 1 1 18 GLY C C 8.285 5.183 -2.922 1.00 . A A . 18 GLY C 1 1 5 2608 1 1 18 GLY CA C 9.672 4.687 -2.525 1.00 . A A . 18 GLY CA 1 1 5 2609 1 1 18 GLY H H 8.717 3.168 -1.328 1.00 . A A . 18 GLY H 1 1 5 2610 1 1 18 GLY HA2 H 10.148 5.406 -1.873 1.00 . A A . 18 GLY HA2 1 1 5 2611 1 1 18 GLY HA3 H 10.265 4.555 -3.417 1.00 . A A . 18 GLY HA3 1 1 5 2612 1 1 18 GLY N N 9.540 3.386 -1.813 1.00 . A A . 18 GLY N 1 1 5 2613 1 1 18 GLY O O 8.049 6.365 -3.083 1.00 . A A . 18 GLY O 1 1 5 2614 1 1 19 ASN C C 5.256 5.314 -2.297 1.00 . A A . 19 ASN C 1 1 5 2615 1 1 19 ASN CA C 5.991 4.656 -3.466 1.00 . A A . 19 ASN CA 1 1 5 2616 1 1 19 ASN CB C 5.259 3.434 -4.036 1.00 . A A . 19 ASN CB 1 1 5 2617 1 1 19 ASN CG C 6.237 2.431 -4.644 1.00 . A A . 19 ASN CG 1 1 5 2618 1 1 19 ASN H H 7.567 3.332 -2.949 1.00 . A A . 19 ASN H 1 1 5 2619 1 1 19 ASN HA H 6.081 5.400 -4.245 1.00 . A A . 19 ASN HA 1 1 5 2620 1 1 19 ASN HB2 H 4.580 2.945 -3.362 1.00 . A A . 19 ASN HB2 1 1 5 2621 1 1 19 ASN HB3 H 4.645 3.779 -4.829 1.00 . A A . 19 ASN HB3 1 1 5 2622 1 1 19 ASN HD21 H 5.368 0.867 -3.787 1.00 . A A . 19 ASN HD21 1 1 5 2623 1 1 19 ASN HD22 H 6.713 0.518 -4.767 1.00 . A A . 19 ASN HD22 1 1 5 2624 1 1 19 ASN N N 7.366 4.274 -3.080 1.00 . A A . 19 ASN N 1 1 5 2625 1 1 19 ASN ND2 N 6.095 1.167 -4.375 1.00 . A A . 19 ASN ND2 1 1 5 2626 1 1 19 ASN O O 5.125 6.520 -2.326 1.00 . A A . 19 ASN O 1 1 5 2627 1 1 19 ASN OD1 O 7.136 2.805 -5.372 1.00 . A A . 19 ASN OD1 1 1 5 2628 1 1 20 CYS C C 3.330 6.446 -0.524 1.00 . A A . 20 CYS C 1 1 5 2629 1 1 20 CYS CA C 4.069 5.162 -0.144 1.00 . A A . 20 CYS CA 1 1 5 2630 1 1 20 CYS CB C 5.001 5.553 0.992 1.00 . A A . 20 CYS CB 1 1 5 2631 1 1 20 CYS H H 4.941 3.603 -1.343 1.00 . A A . 20 CYS H 1 1 5 2632 1 1 20 CYS HA H 3.365 4.433 0.229 1.00 . A A . 20 CYS HA 1 1 5 2633 1 1 20 CYS HB2 H 5.806 4.843 1.051 1.00 . A A . 20 CYS HB2 1 1 5 2634 1 1 20 CYS HB3 H 5.369 6.537 0.760 1.00 . A A . 20 CYS HB3 1 1 5 2635 1 1 20 CYS N N 4.799 4.574 -1.314 1.00 . A A . 20 CYS N 1 1 5 2636 1 1 20 CYS O O 3.733 7.525 -0.138 1.00 . A A . 20 CYS O 1 1 5 2637 1 1 20 CYS SG S 4.131 5.587 2.582 1.00 . A A . 20 CYS SG 1 1 5 2638 1 1 21 ARG C C 1.780 7.929 -3.131 1.00 . A A . 21 ARG C 1 1 5 2639 1 1 21 ARG CA C 1.405 7.404 -1.745 1.00 . A A . 21 ARG CA 1 1 5 2640 1 1 21 ARG CB C 1.496 8.574 -0.779 1.00 . A A . 21 ARG CB 1 1 5 2641 1 1 21 ARG CD C 0.255 10.559 -1.664 1.00 . A A . 21 ARG CD 1 1 5 2642 1 1 21 ARG CG C 0.161 9.322 -0.769 1.00 . A A . 21 ARG CG 1 1 5 2643 1 1 21 ARG CZ C -0.312 12.456 -0.265 1.00 . A A . 21 ARG CZ 1 1 5 2644 1 1 21 ARG H H 2.061 5.365 -1.503 1.00 . A A . 21 ARG H 1 1 5 2645 1 1 21 ARG HA H 0.380 7.081 -1.759 1.00 . A A . 21 ARG HA 1 1 5 2646 1 1 21 ARG HB2 H 1.730 8.177 0.197 1.00 . A A . 21 ARG HB2 1 1 5 2647 1 1 21 ARG HB3 H 2.286 9.225 -1.119 1.00 . A A . 21 ARG HB3 1 1 5 2648 1 1 21 ARG HD2 H 1.262 10.949 -1.635 1.00 . A A . 21 ARG HD2 1 1 5 2649 1 1 21 ARG HD3 H 0.001 10.291 -2.679 1.00 . A A . 21 ARG HD3 1 1 5 2650 1 1 21 ARG HE H -1.607 11.635 -1.528 1.00 . A A . 21 ARG HE 1 1 5 2651 1 1 21 ARG HG2 H -0.613 8.665 -1.141 1.00 . A A . 21 ARG HG2 1 1 5 2652 1 1 21 ARG HG3 H -0.073 9.629 0.239 1.00 . A A . 21 ARG HG3 1 1 5 2653 1 1 21 ARG HH11 H 1.461 12.808 -1.124 1.00 . A A . 21 ARG HH11 1 1 5 2654 1 1 21 ARG HH12 H 1.148 13.685 0.337 1.00 . A A . 21 ARG HH12 1 1 5 2655 1 1 21 ARG HH21 H -1.996 12.304 0.807 1.00 . A A . 21 ARG HH21 1 1 5 2656 1 1 21 ARG HH22 H -0.808 13.400 1.429 1.00 . A A . 21 ARG HH22 1 1 5 2657 1 1 21 ARG N N 2.272 6.284 -1.266 1.00 . A A . 21 ARG N 1 1 5 2658 1 1 21 ARG NE N -0.694 11.597 -1.171 1.00 . A A . 21 ARG NE 1 1 5 2659 1 1 21 ARG NH1 N 0.856 13.027 -0.358 1.00 . A A . 21 ARG NH1 1 1 5 2660 1 1 21 ARG NH2 N -1.101 12.742 0.735 1.00 . A A . 21 ARG NH2 1 1 5 2661 1 1 21 ARG O O 1.148 8.823 -3.656 1.00 . A A . 21 ARG O 1 1 5 2662 1 1 22 THR C C 2.783 6.863 -6.154 1.00 . A A . 22 THR C 1 1 5 2663 1 1 22 THR CA C 3.189 7.876 -5.084 1.00 . A A . 22 THR CA 1 1 5 2664 1 1 22 THR CB C 4.698 8.119 -5.177 1.00 . A A . 22 THR CB 1 1 5 2665 1 1 22 THR CG2 C 5.261 8.666 -3.862 1.00 . A A . 22 THR CG2 1 1 5 2666 1 1 22 THR H H 3.284 6.671 -3.285 1.00 . A A . 22 THR H 1 1 5 2667 1 1 22 THR HA H 2.669 8.804 -5.276 1.00 . A A . 22 THR HA 1 1 5 2668 1 1 22 THR HB H 4.886 8.840 -5.959 1.00 . A A . 22 THR HB 1 1 5 2669 1 1 22 THR HG1 H 6.273 7.101 -5.686 1.00 . A A . 22 THR HG1 1 1 5 2670 1 1 22 THR HG21 H 4.599 8.429 -3.043 1.00 . A A . 22 THR HG21 1 1 5 2671 1 1 22 THR HG22 H 6.229 8.226 -3.676 1.00 . A A . 22 THR HG22 1 1 5 2672 1 1 22 THR HG23 H 5.366 9.738 -3.939 1.00 . A A . 22 THR HG23 1 1 5 2673 1 1 22 THR N N 2.795 7.388 -3.732 1.00 . A A . 22 THR N 1 1 5 2674 1 1 22 THR O O 3.068 7.051 -7.320 1.00 . A A . 22 THR O 1 1 5 2675 1 1 22 THR OG1 O 5.351 6.904 -5.510 1.00 . A A . 22 THR OG1 1 1 5 2676 1 1 23 SER C C 0.211 4.696 -6.734 1.00 . A A . 23 SER C 1 1 5 2677 1 1 23 SER CA C 1.730 4.820 -6.847 1.00 . A A . 23 SER CA 1 1 5 2678 1 1 23 SER CB C 2.476 3.504 -6.613 1.00 . A A . 23 SER CB 1 1 5 2679 1 1 23 SER H H 1.877 5.624 -4.860 1.00 . A A . 23 SER H 1 1 5 2680 1 1 23 SER HA H 1.967 5.237 -7.816 1.00 . A A . 23 SER HA 1 1 5 2681 1 1 23 SER HB2 H 2.955 3.510 -5.642 1.00 . A A . 23 SER HB2 1 1 5 2682 1 1 23 SER HB3 H 1.770 2.686 -6.653 1.00 . A A . 23 SER HB3 1 1 5 2683 1 1 23 SER HG H 4.239 3.883 -7.342 1.00 . A A . 23 SER HG 1 1 5 2684 1 1 23 SER N N 2.123 5.795 -5.798 1.00 . A A . 23 SER N 1 1 5 2685 1 1 23 SER O O -0.342 4.929 -5.679 1.00 . A A . 23 SER O 1 1 5 2686 1 1 23 SER OG O 3.478 3.364 -7.611 1.00 . A A . 23 SER OG 1 1 5 2687 1 1 24 GLN C C -2.373 3.100 -6.696 1.00 . A A . 24 GLN C 1 1 5 2688 1 1 24 GLN CA C -1.972 4.248 -7.621 1.00 . A A . 24 GLN CA 1 1 5 2689 1 1 24 GLN CB C -2.632 4.075 -8.989 1.00 . A A . 24 GLN CB 1 1 5 2690 1 1 24 GLN CD C -3.078 6.023 -10.491 1.00 . A A . 24 GLN CD 1 1 5 2691 1 1 24 GLN CG C -2.007 5.052 -9.987 1.00 . A A . 24 GLN CG 1 1 5 2692 1 1 24 GLN H H -0.065 4.160 -8.634 1.00 . A A . 24 GLN H 1 1 5 2693 1 1 24 GLN HA H -2.323 5.170 -7.180 1.00 . A A . 24 GLN HA 1 1 5 2694 1 1 24 GLN HB2 H -2.486 3.061 -9.334 1.00 . A A . 24 GLN HB2 1 1 5 2695 1 1 24 GLN HB3 H -3.690 4.280 -8.908 1.00 . A A . 24 GLN HB3 1 1 5 2696 1 1 24 GLN HE21 H -2.133 6.404 -12.195 1.00 . A A . 24 GLN HE21 1 1 5 2697 1 1 24 GLN HE22 H -3.607 7.219 -11.986 1.00 . A A . 24 GLN HE22 1 1 5 2698 1 1 24 GLN HG2 H -1.217 5.605 -9.500 1.00 . A A . 24 GLN HG2 1 1 5 2699 1 1 24 GLN HG3 H -1.604 4.504 -10.825 1.00 . A A . 24 GLN HG3 1 1 5 2700 1 1 24 GLN N N -0.493 4.347 -7.774 1.00 . A A . 24 GLN N 1 1 5 2701 1 1 24 GLN NE2 N -2.927 6.596 -11.654 1.00 . A A . 24 GLN NE2 1 1 5 2702 1 1 24 GLN O O -2.846 3.315 -5.599 1.00 . A A . 24 GLN O 1 1 5 2703 1 1 24 GLN OE1 O -4.063 6.261 -9.820 1.00 . A A . 24 GLN OE1 1 1 5 2704 1 1 25 LYS C C -1.807 0.916 -4.884 1.00 . A A . 25 LYS C 1 1 5 2705 1 1 25 LYS CA C -2.603 0.781 -6.181 1.00 . A A . 25 LYS CA 1 1 5 2706 1 1 25 LYS CB C -2.336 -0.569 -6.842 1.00 . A A . 25 LYS CB 1 1 5 2707 1 1 25 LYS CD C -3.990 -1.999 -8.072 1.00 . A A . 25 LYS CD 1 1 5 2708 1 1 25 LYS CE C -4.928 -3.191 -7.869 1.00 . A A . 25 LYS CE 1 1 5 2709 1 1 25 LYS CG C -3.606 -1.412 -6.712 1.00 . A A . 25 LYS CG 1 1 5 2710 1 1 25 LYS H H -1.821 1.685 -7.986 1.00 . A A . 25 LYS H 1 1 5 2711 1 1 25 LYS HA H -3.656 0.879 -5.959 1.00 . A A . 25 LYS HA 1 1 5 2712 1 1 25 LYS HB2 H -2.090 -0.414 -7.882 1.00 . A A . 25 LYS HB2 1 1 5 2713 1 1 25 LYS HB3 H -1.523 -1.071 -6.340 1.00 . A A . 25 LYS HB3 1 1 5 2714 1 1 25 LYS HD2 H -4.487 -1.242 -8.661 1.00 . A A . 25 LYS HD2 1 1 5 2715 1 1 25 LYS HD3 H -3.100 -2.332 -8.585 1.00 . A A . 25 LYS HD3 1 1 5 2716 1 1 25 LYS HE2 H -4.874 -3.522 -6.842 1.00 . A A . 25 LYS HE2 1 1 5 2717 1 1 25 LYS HE3 H -5.941 -2.895 -8.098 1.00 . A A . 25 LYS HE3 1 1 5 2718 1 1 25 LYS HG2 H -3.435 -2.205 -6.000 1.00 . A A . 25 LYS HG2 1 1 5 2719 1 1 25 LYS HG3 H -4.413 -0.793 -6.348 1.00 . A A . 25 LYS HG3 1 1 5 2720 1 1 25 LYS HZ1 H -3.498 -4.236 -8.960 1.00 . A A . 25 LYS HZ1 1 1 5 2721 1 1 25 LYS HZ2 H -4.731 -5.216 -8.318 1.00 . A A . 25 LYS HZ2 1 1 5 2722 1 1 25 LYS HZ3 H -5.045 -4.239 -9.665 1.00 . A A . 25 LYS HZ3 1 1 5 2723 1 1 25 LYS N N -2.202 1.876 -7.104 1.00 . A A . 25 LYS N 1 1 5 2724 1 1 25 LYS NZ N -4.519 -4.305 -8.771 1.00 . A A . 25 LYS NZ 1 1 5 2725 1 1 25 LYS O O -2.348 1.011 -3.806 1.00 . A A . 25 LYS O 1 1 5 2726 1 1 26 TYR C C -0.271 2.101 -2.764 1.00 . A A . 26 TYR C 1 1 5 2727 1 1 26 TYR CA C 0.309 1.062 -3.729 1.00 . A A . 26 TYR CA 1 1 5 2728 1 1 26 TYR CB C 1.673 1.570 -4.158 1.00 . A A . 26 TYR CB 1 1 5 2729 1 1 26 TYR CD1 C 1.809 -0.828 -4.957 1.00 . A A . 26 TYR CD1 1 1 5 2730 1 1 26 TYR CD2 C 3.669 0.664 -5.364 1.00 . A A . 26 TYR CD2 1 1 5 2731 1 1 26 TYR CE1 C 2.498 -1.857 -5.587 1.00 . A A . 26 TYR CE1 1 1 5 2732 1 1 26 TYR CE2 C 4.359 -0.374 -5.997 1.00 . A A . 26 TYR CE2 1 1 5 2733 1 1 26 TYR CG C 2.394 0.440 -4.844 1.00 . A A . 26 TYR CG 1 1 5 2734 1 1 26 TYR CZ C 3.777 -1.642 -6.112 1.00 . A A . 26 TYR CZ 1 1 5 2735 1 1 26 TYR H H -0.077 0.854 -5.840 1.00 . A A . 26 TYR H 1 1 5 2736 1 1 26 TYR HA H 0.453 0.102 -3.255 1.00 . A A . 26 TYR HA 1 1 5 2737 1 1 26 TYR HB2 H 1.527 2.402 -4.819 1.00 . A A . 26 TYR HB2 1 1 5 2738 1 1 26 TYR HB3 H 2.233 1.887 -3.290 1.00 . A A . 26 TYR HB3 1 1 5 2739 1 1 26 TYR HD1 H 0.827 -1.057 -4.578 1.00 . A A . 26 TYR HD1 1 1 5 2740 1 1 26 TYR HD2 H 4.119 1.643 -5.277 1.00 . A A . 26 TYR HD2 1 1 5 2741 1 1 26 TYR HE1 H 2.006 -2.811 -5.647 1.00 . A A . 26 TYR HE1 1 1 5 2742 1 1 26 TYR HE2 H 5.344 -0.190 -6.394 1.00 . A A . 26 TYR HE2 1 1 5 2743 1 1 26 TYR HH H 4.214 -2.663 -7.664 1.00 . A A . 26 TYR HH 1 1 5 2744 1 1 26 TYR N N -0.511 0.930 -4.965 1.00 . A A . 26 TYR N 1 1 5 2745 1 1 26 TYR O O -0.368 1.875 -1.574 1.00 . A A . 26 TYR O 1 1 5 2746 1 1 26 TYR OH O 4.456 -2.668 -6.735 1.00 . A A . 26 TYR OH 1 1 5 2747 1 1 27 ARG C C -2.560 3.772 -1.736 1.00 . A A . 27 ARG C 1 1 5 2748 1 1 27 ARG CA C -1.222 4.255 -2.300 1.00 . A A . 27 ARG CA 1 1 5 2749 1 1 27 ARG CB C -1.358 5.621 -2.982 1.00 . A A . 27 ARG CB 1 1 5 2750 1 1 27 ARG CD C -2.874 7.169 -4.210 1.00 . A A . 27 ARG CD 1 1 5 2751 1 1 27 ARG CG C -2.730 5.766 -3.621 1.00 . A A . 27 ARG CG 1 1 5 2752 1 1 27 ARG CZ C -2.589 9.195 -2.910 1.00 . A A . 27 ARG CZ 1 1 5 2753 1 1 27 ARG H H -0.592 3.456 -4.198 1.00 . A A . 27 ARG H 1 1 5 2754 1 1 27 ARG HA H -0.514 4.327 -1.493 1.00 . A A . 27 ARG HA 1 1 5 2755 1 1 27 ARG HB2 H -1.257 6.411 -2.256 1.00 . A A . 27 ARG HB2 1 1 5 2756 1 1 27 ARG HB3 H -0.609 5.721 -3.753 1.00 . A A . 27 ARG HB3 1 1 5 2757 1 1 27 ARG HD2 H -2.535 7.156 -5.235 1.00 . A A . 27 ARG HD2 1 1 5 2758 1 1 27 ARG HD3 H -3.909 7.472 -4.174 1.00 . A A . 27 ARG HD3 1 1 5 2759 1 1 27 ARG HE H -1.086 7.957 -3.300 1.00 . A A . 27 ARG HE 1 1 5 2760 1 1 27 ARG HG2 H -2.795 5.041 -4.415 1.00 . A A . 27 ARG HG2 1 1 5 2761 1 1 27 ARG HG3 H -3.484 5.608 -2.863 1.00 . A A . 27 ARG HG3 1 1 5 2762 1 1 27 ARG HH11 H -2.421 10.277 -4.585 1.00 . A A . 27 ARG HH11 1 1 5 2763 1 1 27 ARG HH12 H -3.148 11.088 -3.240 1.00 . A A . 27 ARG HH12 1 1 5 2764 1 1 27 ARG HH21 H -2.884 8.361 -1.114 1.00 . A A . 27 ARG HH21 1 1 5 2765 1 1 27 ARG HH22 H -3.412 10.002 -1.273 1.00 . A A . 27 ARG HH22 1 1 5 2766 1 1 27 ARG N N -0.663 3.251 -3.244 1.00 . A A . 27 ARG N 1 1 5 2767 1 1 27 ARG NE N -2.043 8.128 -3.427 1.00 . A A . 27 ARG NE 1 1 5 2768 1 1 27 ARG NH1 N -2.730 10.271 -3.634 1.00 . A A . 27 ARG NH1 1 1 5 2769 1 1 27 ARG NH2 N -2.993 9.185 -1.670 1.00 . A A . 27 ARG NH2 1 1 5 2770 1 1 27 ARG O O -2.746 3.710 -0.537 1.00 . A A . 27 ARG O 1 1 5 2771 1 1 28 ALA C C -4.660 1.466 -1.716 1.00 . A A . 28 ALA C 1 1 5 2772 1 1 28 ALA CA C -4.812 2.946 -2.068 1.00 . A A . 28 ALA CA 1 1 5 2773 1 1 28 ALA CB C -5.877 3.112 -3.155 1.00 . A A . 28 ALA CB 1 1 5 2774 1 1 28 ALA H H -3.328 3.480 -3.541 1.00 . A A . 28 ALA H 1 1 5 2775 1 1 28 ALA HA H -5.087 3.504 -1.184 1.00 . A A . 28 ALA HA 1 1 5 2776 1 1 28 ALA HB1 H -5.454 3.642 -3.995 1.00 . A A . 28 ALA HB1 1 1 5 2777 1 1 28 ALA HB2 H -6.216 2.139 -3.477 1.00 . A A . 28 ALA HB2 1 1 5 2778 1 1 28 ALA HB3 H -6.712 3.671 -2.759 1.00 . A A . 28 ALA HB3 1 1 5 2779 1 1 28 ALA N N -3.495 3.426 -2.577 1.00 . A A . 28 ALA N 1 1 5 2780 1 1 28 ALA O O -4.710 1.072 -0.569 1.00 . A A . 28 ALA O 1 1 5 2781 1 1 29 ASN C C -3.262 -1.128 -1.432 1.00 . A A . 29 ASN C 1 1 5 2782 1 1 29 ASN CA C -4.302 -0.816 -2.506 1.00 . A A . 29 ASN CA 1 1 5 2783 1 1 29 ASN CB C -3.932 -1.487 -3.828 1.00 . A A . 29 ASN CB 1 1 5 2784 1 1 29 ASN CG C -5.213 -1.998 -4.490 1.00 . A A . 29 ASN CG 1 1 5 2785 1 1 29 ASN H H -4.435 1.010 -3.626 1.00 . A A . 29 ASN H 1 1 5 2786 1 1 29 ASN HA H -5.231 -1.229 -2.165 1.00 . A A . 29 ASN HA 1 1 5 2787 1 1 29 ASN HB2 H -3.443 -0.766 -4.469 1.00 . A A . 29 ASN HB2 1 1 5 2788 1 1 29 ASN HB3 H -3.270 -2.320 -3.643 1.00 . A A . 29 ASN HB3 1 1 5 2789 1 1 29 ASN HD21 H -6.089 -0.216 -4.503 1.00 . A A . 29 ASN HD21 1 1 5 2790 1 1 29 ASN HD22 H -7.009 -1.482 -5.162 1.00 . A A . 29 ASN HD22 1 1 5 2791 1 1 29 ASN N N -4.470 0.649 -2.715 1.00 . A A . 29 ASN N 1 1 5 2792 1 1 29 ASN ND2 N -6.184 -1.163 -4.739 1.00 . A A . 29 ASN ND2 1 1 5 2793 1 1 29 ASN O O -3.209 -2.229 -0.928 1.00 . A A . 29 ASN O 1 1 5 2794 1 1 29 ASN OD1 O -5.333 -3.172 -4.784 1.00 . A A . 29 ASN OD1 1 1 5 2795 1 1 30 CYS C C -1.342 0.712 0.896 1.00 . A A . 30 CYS C 1 1 5 2796 1 1 30 CYS CA C -1.429 -0.514 -0.008 1.00 . A A . 30 CYS CA 1 1 5 2797 1 1 30 CYS CB C -0.096 -0.868 -0.666 1.00 . A A . 30 CYS CB 1 1 5 2798 1 1 30 CYS H H -2.468 0.696 -1.458 1.00 . A A . 30 CYS H 1 1 5 2799 1 1 30 CYS HA H -1.802 -1.345 0.574 1.00 . A A . 30 CYS HA 1 1 5 2800 1 1 30 CYS HB2 H 0.149 -0.150 -1.432 1.00 . A A . 30 CYS HB2 1 1 5 2801 1 1 30 CYS HB3 H 0.683 -0.900 0.080 1.00 . A A . 30 CYS HB3 1 1 5 2802 1 1 30 CYS N N -2.433 -0.198 -1.059 1.00 . A A . 30 CYS N 1 1 5 2803 1 1 30 CYS O O -0.296 1.227 1.234 1.00 . A A . 30 CYS O 1 1 5 2804 1 1 30 CYS SG S -0.296 -2.518 -1.385 1.00 . A A . 30 CYS SG 1 1 5 2805 1 1 31 ALA C C -2.545 1.950 3.618 1.00 . A A . 31 ALA C 1 1 5 2806 1 1 31 ALA CA C -2.717 2.331 2.142 1.00 . A A . 31 ALA CA 1 1 5 2807 1 1 31 ALA CB C -4.138 2.832 1.875 1.00 . A A . 31 ALA CB 1 1 5 2808 1 1 31 ALA H H -3.307 0.674 0.941 1.00 . A A . 31 ALA H 1 1 5 2809 1 1 31 ALA HA H -2.015 3.103 1.863 1.00 . A A . 31 ALA HA 1 1 5 2810 1 1 31 ALA HB1 H -4.690 2.068 1.340 1.00 . A A . 31 ALA HB1 1 1 5 2811 1 1 31 ALA HB2 H -4.631 3.039 2.812 1.00 . A A . 31 ALA HB2 1 1 5 2812 1 1 31 ALA HB3 H -4.101 3.730 1.277 1.00 . A A . 31 ALA HB3 1 1 5 2813 1 1 31 ALA N N -2.516 1.149 1.263 1.00 . A A . 31 ALA N 1 1 5 2814 1 1 31 ALA O O -2.644 2.782 4.496 1.00 . A A . 31 ALA O 1 1 5 2815 1 1 32 LYS C C -0.632 0.448 5.668 1.00 . A A . 32 LYS C 1 1 5 2816 1 1 32 LYS CA C -2.104 0.244 5.307 1.00 . A A . 32 LYS CA 1 1 5 2817 1 1 32 LYS CB C -2.426 -1.254 5.371 1.00 . A A . 32 LYS CB 1 1 5 2818 1 1 32 LYS CD C -1.539 -3.607 5.058 1.00 . A A . 32 LYS CD 1 1 5 2819 1 1 32 LYS CE C -0.277 -4.296 5.589 1.00 . A A . 32 LYS CE 1 1 5 2820 1 1 32 LYS CG C -1.250 -2.113 4.888 1.00 . A A . 32 LYS CG 1 1 5 2821 1 1 32 LYS H H -2.212 0.052 3.168 1.00 . A A . 32 LYS H 1 1 5 2822 1 1 32 LYS HA H -2.750 0.794 5.975 1.00 . A A . 32 LYS HA 1 1 5 2823 1 1 32 LYS HB2 H -2.659 -1.525 6.389 1.00 . A A . 32 LYS HB2 1 1 5 2824 1 1 32 LYS HB3 H -3.280 -1.437 4.739 1.00 . A A . 32 LYS HB3 1 1 5 2825 1 1 32 LYS HD2 H -2.353 -3.741 5.756 1.00 . A A . 32 LYS HD2 1 1 5 2826 1 1 32 LYS HD3 H -1.801 -4.038 4.104 1.00 . A A . 32 LYS HD3 1 1 5 2827 1 1 32 LYS HE2 H 0.138 -4.963 4.843 1.00 . A A . 32 LYS HE2 1 1 5 2828 1 1 32 LYS HE3 H 0.456 -3.543 5.834 1.00 . A A . 32 LYS HE3 1 1 5 2829 1 1 32 LYS HG2 H -1.065 -1.912 3.844 1.00 . A A . 32 LYS HG2 1 1 5 2830 1 1 32 LYS HG3 H -0.366 -1.863 5.456 1.00 . A A . 32 LYS HG3 1 1 5 2831 1 1 32 LYS HZ1 H -1.453 -5.654 6.641 1.00 . A A . 32 LYS HZ1 1 1 5 2832 1 1 32 LYS HZ2 H 0.190 -5.674 7.079 1.00 . A A . 32 LYS HZ2 1 1 5 2833 1 1 32 LYS HZ3 H -0.806 -4.409 7.600 1.00 . A A . 32 LYS HZ3 1 1 5 2834 1 1 32 LYS N N -2.287 0.701 3.898 1.00 . A A . 32 LYS N 1 1 5 2835 1 1 32 LYS NZ N -0.613 -5.066 6.819 1.00 . A A . 32 LYS NZ 1 1 5 2836 1 1 32 LYS O O -0.247 0.859 6.745 1.00 . A A . 32 LYS O 1 1 5 2837 1 1 33 THR C C 2.077 1.679 4.668 1.00 . A A . 33 THR C 1 1 5 2838 1 1 33 THR CA C 1.644 0.216 4.732 1.00 . A A . 33 THR CA 1 1 5 2839 1 1 33 THR CB C 2.102 -0.690 3.584 1.00 . A A . 33 THR CB 1 1 5 2840 1 1 33 THR CG2 C 3.032 -0.036 2.561 1.00 . A A . 33 THR CG2 1 1 5 2841 1 1 33 THR H H -0.284 -0.190 3.875 1.00 . A A . 33 THR H 1 1 5 2842 1 1 33 THR HA H 2.026 -0.168 5.663 1.00 . A A . 33 THR HA 1 1 5 2843 1 1 33 THR HB H 1.229 -1.065 3.075 1.00 . A A . 33 THR HB 1 1 5 2844 1 1 33 THR HG1 H 2.065 -2.412 4.480 1.00 . A A . 33 THR HG1 1 1 5 2845 1 1 33 THR HG21 H 3.135 1.021 2.722 1.00 . A A . 33 THR HG21 1 1 5 2846 1 1 33 THR HG22 H 3.995 -0.518 2.619 1.00 . A A . 33 THR HG22 1 1 5 2847 1 1 33 THR HG23 H 2.621 -0.199 1.577 1.00 . A A . 33 THR HG23 1 1 5 2848 1 1 33 THR N N 0.158 0.129 4.687 1.00 . A A . 33 THR N 1 1 5 2849 1 1 33 THR O O 3.059 2.080 5.263 1.00 . A A . 33 THR O 1 1 5 2850 1 1 33 THR OG1 O 2.743 -1.822 4.143 1.00 . A A . 33 THR OG1 1 1 5 2851 1 1 34 CYS C C 0.727 4.718 4.722 1.00 . A A . 34 CYS C 1 1 5 2852 1 1 34 CYS CA C 1.671 3.912 3.825 1.00 . A A . 34 CYS CA 1 1 5 2853 1 1 34 CYS CB C 1.408 4.356 2.391 1.00 . A A . 34 CYS CB 1 1 5 2854 1 1 34 CYS H H 0.554 2.107 3.490 1.00 . A A . 34 CYS H 1 1 5 2855 1 1 34 CYS HA H 2.709 4.098 4.069 1.00 . A A . 34 CYS HA 1 1 5 2856 1 1 34 CYS HB2 H 1.811 3.630 1.706 1.00 . A A . 34 CYS HB2 1 1 5 2857 1 1 34 CYS HB3 H 0.350 4.435 2.227 1.00 . A A . 34 CYS HB3 1 1 5 2858 1 1 34 CYS N N 1.338 2.469 3.950 1.00 . A A . 34 CYS N 1 1 5 2859 1 1 34 CYS O O 0.934 5.892 4.957 1.00 . A A . 34 CYS O 1 1 5 2860 1 1 34 CYS SG S 2.189 5.970 2.176 1.00 . A A . 34 CYS SG 1 1 5 2861 1 1 35 GLU C C -2.116 5.776 5.300 1.00 . A A . 35 GLU C 1 1 5 2862 1 1 35 GLU CA C -1.288 4.777 6.100 1.00 . A A . 35 GLU CA 1 1 5 2863 1 1 35 GLU CB C -0.554 5.392 7.286 1.00 . A A . 35 GLU CB 1 1 5 2864 1 1 35 GLU CD C 0.777 4.573 9.256 1.00 . A A . 35 GLU CD 1 1 5 2865 1 1 35 GLU CG C -0.104 4.167 8.073 1.00 . A A . 35 GLU CG 1 1 5 2866 1 1 35 GLU H H -0.453 3.144 5.015 1.00 . A A . 35 GLU H 1 1 5 2867 1 1 35 GLU HA H -1.972 4.020 6.462 1.00 . A A . 35 GLU HA 1 1 5 2868 1 1 35 GLU HB2 H 0.286 5.986 6.951 1.00 . A A . 35 GLU HB2 1 1 5 2869 1 1 35 GLU HB3 H -1.223 5.973 7.901 1.00 . A A . 35 GLU HB3 1 1 5 2870 1 1 35 GLU HG2 H -0.991 3.650 8.412 1.00 . A A . 35 GLU HG2 1 1 5 2871 1 1 35 GLU HG3 H 0.445 3.519 7.403 1.00 . A A . 35 GLU HG3 1 1 5 2872 1 1 35 GLU N N -0.307 4.091 5.219 1.00 . A A . 35 GLU N 1 1 5 2873 1 1 35 GLU O O -2.586 6.789 5.777 1.00 . A A . 35 GLU O 1 1 5 2874 1 1 35 GLU OE1 O 1.830 5.140 9.018 1.00 . A A . 35 GLU OE1 1 1 5 2875 1 1 35 GLU OE2 O 0.382 4.311 10.380 1.00 . A A . 35 GLU OE2 1 1 5 2876 1 1 36 LEU C C -4.522 5.848 3.265 1.00 . A A . 36 LEU C 1 1 5 2877 1 1 36 LEU CA C -3.056 6.252 3.099 1.00 . A A . 36 LEU CA 1 1 5 2878 1 1 36 LEU CB C -2.549 5.907 1.701 1.00 . A A . 36 LEU CB 1 1 5 2879 1 1 36 LEU CD1 C -0.440 5.664 0.397 1.00 . A A . 36 LEU CD1 1 1 5 2880 1 1 36 LEU CD2 C -1.010 7.856 1.443 1.00 . A A . 36 LEU CD2 1 1 5 2881 1 1 36 LEU CG C -1.086 6.337 1.605 1.00 . A A . 36 LEU CG 1 1 5 2882 1 1 36 LEU H H -1.870 4.592 3.747 1.00 . A A . 36 LEU H 1 1 5 2883 1 1 36 LEU HA H -2.919 7.299 3.299 1.00 . A A . 36 LEU HA 1 1 5 2884 1 1 36 LEU HB2 H -2.632 4.847 1.595 1.00 . A A . 36 LEU HB2 1 1 5 2885 1 1 36 LEU HB3 H -3.119 6.364 0.909 1.00 . A A . 36 LEU HB3 1 1 5 2886 1 1 36 LEU HD11 H -1.021 5.888 -0.484 1.00 . A A . 36 LEU HD11 1 1 5 2887 1 1 36 LEU HD12 H 0.569 6.023 0.262 1.00 . A A . 36 LEU HD12 1 1 5 2888 1 1 36 LEU HD13 H -0.431 4.592 0.538 1.00 . A A . 36 LEU HD13 1 1 5 2889 1 1 36 LEU HD21 H -1.572 8.332 2.234 1.00 . A A . 36 LEU HD21 1 1 5 2890 1 1 36 LEU HD22 H 0.022 8.170 1.494 1.00 . A A . 36 LEU HD22 1 1 5 2891 1 1 36 LEU HD23 H -1.425 8.135 0.486 1.00 . A A . 36 LEU HD23 1 1 5 2892 1 1 36 LEU HG H -0.569 6.035 2.506 1.00 . A A . 36 LEU HG 1 1 5 2893 1 1 36 LEU N N -2.275 5.428 4.055 1.00 . A A . 36 LEU N 1 1 5 2894 1 1 36 LEU O O -5.396 6.395 2.622 1.00 . A A . 36 LEU O 1 1 5 2895 1 1 37 CYS C C -6.837 5.252 5.476 1.00 . A A . 37 CYS C 1 1 5 2896 1 1 37 CYS CA C -6.235 4.491 4.293 1.00 . A A . 37 CYS CA 1 1 5 2897 1 1 37 CYS CB C -6.314 2.987 4.559 1.00 . A A . 37 CYS CB 1 1 5 2898 1 1 37 CYS H H -4.114 4.443 4.647 1.00 . A A . 37 CYS H 1 1 5 2899 1 1 37 CYS HA H -6.787 4.729 3.395 1.00 . A A . 37 CYS HA 1 1 5 2900 1 1 37 CYS HB2 H -6.213 2.450 3.628 1.00 . A A . 37 CYS HB2 1 1 5 2901 1 1 37 CYS HB3 H -5.519 2.697 5.231 1.00 . A A . 37 CYS HB3 1 1 5 2902 1 1 37 CYS N N -4.811 4.896 4.118 1.00 . A A . 37 CYS N 1 1 5 2903 1 1 37 CYS O O -7.752 6.026 5.252 1.00 . A A . 37 CYS O 1 1 5 2904 1 1 37 CYS OXT O -6.373 5.045 6.585 1.00 . A A . 37 CYS OXT 1 1 5 2905 1 1 37 CYS SG S -7.912 2.593 5.312 1.00 . A A . 37 CYS SG 1 1 6 2906 1 1 1 VAL C C -12.240 0.499 2.212 1.00 . A A . 1 VAL C 1 1 6 2907 1 1 1 VAL CA C -13.596 0.579 2.915 1.00 . A A . 1 VAL CA 1 1 6 2908 1 1 1 VAL CB C -13.684 -0.511 3.985 1.00 . A A . 1 VAL CB 1 1 6 2909 1 1 1 VAL CG1 C -12.894 -1.741 3.532 1.00 . A A . 1 VAL CG1 1 1 6 2910 1 1 1 VAL CG2 C -13.093 0.016 5.294 1.00 . A A . 1 VAL CG2 1 1 6 2911 1 1 1 VAL H1 H -14.376 -0.324 1.211 1.00 . A A . 1 VAL H1 1 1 6 2912 1 1 1 VAL H2 H -15.540 0.036 2.397 1.00 . A A . 1 VAL H2 1 1 6 2913 1 1 1 VAL H3 H -14.895 1.279 1.444 1.00 . A A . 1 VAL H3 1 1 6 2914 1 1 1 VAL HA H -13.707 1.548 3.378 1.00 . A A . 1 VAL HA 1 1 6 2915 1 1 1 VAL HB H -14.718 -0.786 4.134 1.00 . A A . 1 VAL HB 1 1 6 2916 1 1 1 VAL HG11 H -13.040 -1.892 2.473 1.00 . A A . 1 VAL HG11 1 1 6 2917 1 1 1 VAL HG12 H -11.843 -1.588 3.732 1.00 . A A . 1 VAL HG12 1 1 6 2918 1 1 1 VAL HG13 H -13.240 -2.610 4.071 1.00 . A A . 1 VAL HG13 1 1 6 2919 1 1 1 VAL HG21 H -13.592 0.932 5.572 1.00 . A A . 1 VAL HG21 1 1 6 2920 1 1 1 VAL HG22 H -13.231 -0.719 6.074 1.00 . A A . 1 VAL HG22 1 1 6 2921 1 1 1 VAL HG23 H -12.038 0.206 5.163 1.00 . A A . 1 VAL HG23 1 1 6 2922 1 1 1 VAL N N -14.683 0.377 1.916 1.00 . A A . 1 VAL N 1 1 6 2923 1 1 1 VAL O O -12.129 -0.017 1.118 1.00 . A A . 1 VAL O 1 1 6 2924 1 1 2 CYS C C -8.941 0.056 3.016 1.00 . A A . 2 CYS C 1 1 6 2925 1 1 2 CYS CA C -9.865 0.951 2.183 1.00 . A A . 2 CYS CA 1 1 6 2926 1 1 2 CYS CB C -9.274 2.360 2.102 1.00 . A A . 2 CYS CB 1 1 6 2927 1 1 2 CYS H H -11.315 1.417 3.711 1.00 . A A . 2 CYS H 1 1 6 2928 1 1 2 CYS HA H -9.979 0.547 1.188 1.00 . A A . 2 CYS HA 1 1 6 2929 1 1 2 CYS HB2 H -8.208 2.294 1.942 1.00 . A A . 2 CYS HB2 1 1 6 2930 1 1 2 CYS HB3 H -9.728 2.893 1.279 1.00 . A A . 2 CYS HB3 1 1 6 2931 1 1 2 CYS N N -11.207 1.005 2.829 1.00 . A A . 2 CYS N 1 1 6 2932 1 1 2 CYS O O -9.282 -0.307 4.124 1.00 . A A . 2 CYS O 1 1 6 2933 1 1 2 CYS SG S -9.596 3.248 3.646 1.00 . A A . 2 CYS SG 1 1 6 2934 1 1 3 ARG C C -5.903 -1.860 2.277 1.00 . A A . 3 ARG C 1 1 6 2935 1 1 3 ARG CA C -6.846 -1.170 3.264 1.00 . A A . 3 ARG CA 1 1 6 2936 1 1 3 ARG CB C -7.608 -2.250 4.034 1.00 . A A . 3 ARG CB 1 1 6 2937 1 1 3 ARG CD C -8.560 -4.264 2.884 1.00 . A A . 3 ARG CD 1 1 6 2938 1 1 3 ARG CG C -8.767 -2.778 3.183 1.00 . A A . 3 ARG CG 1 1 6 2939 1 1 3 ARG CZ C -7.837 -6.183 4.171 1.00 . A A . 3 ARG CZ 1 1 6 2940 1 1 3 ARG H H -7.534 0.005 1.608 1.00 . A A . 3 ARG H 1 1 6 2941 1 1 3 ARG HA H -6.272 -0.567 3.952 1.00 . A A . 3 ARG HA 1 1 6 2942 1 1 3 ARG HB2 H -6.935 -3.060 4.274 1.00 . A A . 3 ARG HB2 1 1 6 2943 1 1 3 ARG HB3 H -8.002 -1.828 4.947 1.00 . A A . 3 ARG HB3 1 1 6 2944 1 1 3 ARG HD2 H -9.412 -4.646 2.340 1.00 . A A . 3 ARG HD2 1 1 6 2945 1 1 3 ARG HD3 H -7.669 -4.391 2.288 1.00 . A A . 3 ARG HD3 1 1 6 2946 1 1 3 ARG HE H -8.743 -4.624 5.001 1.00 . A A . 3 ARG HE 1 1 6 2947 1 1 3 ARG HG2 H -9.695 -2.644 3.719 1.00 . A A . 3 ARG HG2 1 1 6 2948 1 1 3 ARG HG3 H -8.810 -2.233 2.252 1.00 . A A . 3 ARG HG3 1 1 6 2949 1 1 3 ARG HH11 H -8.585 -6.729 2.396 1.00 . A A . 3 ARG HH11 1 1 6 2950 1 1 3 ARG HH12 H -7.571 -7.898 3.173 1.00 . A A . 3 ARG HH12 1 1 6 2951 1 1 3 ARG HH21 H -6.954 -5.911 5.947 1.00 . A A . 3 ARG HH21 1 1 6 2952 1 1 3 ARG HH22 H -6.647 -7.435 5.185 1.00 . A A . 3 ARG HH22 1 1 6 2953 1 1 3 ARG N N -7.790 -0.300 2.504 1.00 . A A . 3 ARG N 1 1 6 2954 1 1 3 ARG NE N -8.410 -5.012 4.164 1.00 . A A . 3 ARG NE 1 1 6 2955 1 1 3 ARG NH1 N -8.011 -7.000 3.169 1.00 . A A . 3 ARG NH1 1 1 6 2956 1 1 3 ARG NH2 N -7.087 -6.537 5.180 1.00 . A A . 3 ARG NH2 1 1 6 2957 1 1 3 ARG O O -6.090 -1.793 1.079 1.00 . A A . 3 ARG O 1 1 6 2958 1 1 4 ASP C C -4.779 -4.053 0.859 1.00 . A A . 4 ASP C 1 1 6 2959 1 1 4 ASP CA C -3.953 -3.213 1.834 1.00 . A A . 4 ASP CA 1 1 6 2960 1 1 4 ASP CB C -3.017 -4.124 2.631 1.00 . A A . 4 ASP CB 1 1 6 2961 1 1 4 ASP CG C -3.816 -5.283 3.229 1.00 . A A . 4 ASP CG 1 1 6 2962 1 1 4 ASP H H -4.752 -2.574 3.733 1.00 . A A . 4 ASP H 1 1 6 2963 1 1 4 ASP HA H -3.380 -2.477 1.290 1.00 . A A . 4 ASP HA 1 1 6 2964 1 1 4 ASP HB2 H -2.250 -4.512 1.975 1.00 . A A . 4 ASP HB2 1 1 6 2965 1 1 4 ASP HB3 H -2.558 -3.560 3.428 1.00 . A A . 4 ASP HB3 1 1 6 2966 1 1 4 ASP N N -4.892 -2.526 2.765 1.00 . A A . 4 ASP N 1 1 6 2967 1 1 4 ASP O O -5.952 -4.279 1.077 1.00 . A A . 4 ASP O 1 1 6 2968 1 1 4 ASP OD1 O -4.615 -5.030 4.115 1.00 . A A . 4 ASP OD1 1 1 6 2969 1 1 4 ASP OD2 O -3.614 -6.404 2.792 1.00 . A A . 4 ASP OD2 1 1 6 2970 1 1 5 TRP C C -4.162 -6.449 -1.778 1.00 . A A . 5 TRP C 1 1 6 2971 1 1 5 TRP CA C -5.015 -5.341 -1.158 1.00 . A A . 5 TRP CA 1 1 6 2972 1 1 5 TRP CB C -5.547 -4.453 -2.277 1.00 . A A . 5 TRP CB 1 1 6 2973 1 1 5 TRP CD1 C -7.137 -2.655 -1.509 1.00 . A A . 5 TRP CD1 1 1 6 2974 1 1 5 TRP CD2 C -8.135 -4.657 -1.679 1.00 . A A . 5 TRP CD2 1 1 6 2975 1 1 5 TRP CE2 C -9.128 -3.743 -1.244 1.00 . A A . 5 TRP CE2 1 1 6 2976 1 1 5 TRP CE3 C -8.502 -5.998 -1.867 1.00 . A A . 5 TRP CE3 1 1 6 2977 1 1 5 TRP CG C -6.879 -3.936 -1.841 1.00 . A A . 5 TRP CG 1 1 6 2978 1 1 5 TRP CH2 C -10.788 -5.496 -1.197 1.00 . A A . 5 TRP CH2 1 1 6 2979 1 1 5 TRP CZ2 C -10.443 -4.154 -1.004 1.00 . A A . 5 TRP CZ2 1 1 6 2980 1 1 5 TRP CZ3 C -9.819 -6.413 -1.627 1.00 . A A . 5 TRP CZ3 1 1 6 2981 1 1 5 TRP H H -3.252 -4.341 -0.390 1.00 . A A . 5 TRP H 1 1 6 2982 1 1 5 TRP HA H -5.863 -5.772 -0.628 1.00 . A A . 5 TRP HA 1 1 6 2983 1 1 5 TRP HB2 H -4.855 -3.641 -2.439 1.00 . A A . 5 TRP HB2 1 1 6 2984 1 1 5 TRP HB3 H -5.660 -5.030 -3.183 1.00 . A A . 5 TRP HB3 1 1 6 2985 1 1 5 TRP HD1 H -6.410 -1.861 -1.523 1.00 . A A . 5 TRP HD1 1 1 6 2986 1 1 5 TRP HE1 H -8.906 -1.705 -0.875 1.00 . A A . 5 TRP HE1 1 1 6 2987 1 1 5 TRP HE3 H -7.762 -6.711 -2.199 1.00 . A A . 5 TRP HE3 1 1 6 2988 1 1 5 TRP HH2 H -11.800 -5.826 -1.015 1.00 . A A . 5 TRP HH2 1 1 6 2989 1 1 5 TRP HZ2 H -11.185 -3.442 -0.672 1.00 . A A . 5 TRP HZ2 1 1 6 2990 1 1 5 TRP HZ3 H -10.091 -7.447 -1.774 1.00 . A A . 5 TRP HZ3 1 1 6 2991 1 1 5 TRP N N -4.202 -4.523 -0.213 1.00 . A A . 5 TRP N 1 1 6 2992 1 1 5 TRP NE1 N -8.467 -2.534 -1.156 1.00 . A A . 5 TRP NE1 1 1 6 2993 1 1 5 TRP O O -4.703 -7.406 -2.296 1.00 . A A . 5 TRP O 1 1 6 2994 1 1 6 PHE C C -1.995 -8.490 -1.228 1.00 . A A . 6 PHE C 1 1 6 2995 1 1 6 PHE CA C -2.089 -7.482 -2.369 1.00 . A A . 6 PHE CA 1 1 6 2996 1 1 6 PHE CB C -0.685 -6.958 -2.656 1.00 . A A . 6 PHE CB 1 1 6 2997 1 1 6 PHE CD1 C -1.247 -6.202 -4.966 1.00 . A A . 6 PHE CD1 1 1 6 2998 1 1 6 PHE CD2 C -0.484 -4.560 -3.355 1.00 . A A . 6 PHE CD2 1 1 6 2999 1 1 6 PHE CE1 C -1.365 -5.204 -5.928 1.00 . A A . 6 PHE CE1 1 1 6 3000 1 1 6 PHE CE2 C -0.600 -3.559 -4.312 1.00 . A A . 6 PHE CE2 1 1 6 3001 1 1 6 PHE CG C -0.807 -5.876 -3.686 1.00 . A A . 6 PHE CG 1 1 6 3002 1 1 6 PHE CZ C -1.040 -3.887 -5.595 1.00 . A A . 6 PHE CZ 1 1 6 3003 1 1 6 PHE H H -2.350 -5.634 -1.354 1.00 . A A . 6 PHE H 1 1 6 3004 1 1 6 PHE HA H -2.580 -7.838 -3.263 1.00 . A A . 6 PHE HA 1 1 6 3005 1 1 6 PHE HB2 H -0.255 -6.541 -1.758 1.00 . A A . 6 PHE HB2 1 1 6 3006 1 1 6 PHE HB3 H -0.062 -7.745 -3.047 1.00 . A A . 6 PHE HB3 1 1 6 3007 1 1 6 PHE HD1 H -1.496 -7.219 -5.216 1.00 . A A . 6 PHE HD1 1 1 6 3008 1 1 6 PHE HD2 H -0.145 -4.304 -2.367 1.00 . A A . 6 PHE HD2 1 1 6 3009 1 1 6 PHE HE1 H -1.707 -5.464 -6.916 1.00 . A A . 6 PHE HE1 1 1 6 3010 1 1 6 PHE HE2 H -0.348 -2.546 -4.051 1.00 . A A . 6 PHE HE2 1 1 6 3011 1 1 6 PHE HZ H -1.128 -3.115 -6.329 1.00 . A A . 6 PHE HZ 1 1 6 3012 1 1 6 PHE N N -2.855 -6.375 -1.754 1.00 . A A . 6 PHE N 1 1 6 3013 1 1 6 PHE O O -2.957 -8.688 -0.514 1.00 . A A . 6 PHE O 1 1 6 3014 1 1 7 LYS C C -0.485 -9.342 1.407 1.00 . A A . 7 LYS C 1 1 6 3015 1 1 7 LYS CA C -0.878 -10.091 0.126 1.00 . A A . 7 LYS CA 1 1 6 3016 1 1 7 LYS CB C 0.121 -11.217 -0.145 1.00 . A A . 7 LYS CB 1 1 6 3017 1 1 7 LYS CD C -1.661 -12.720 -1.047 1.00 . A A . 7 LYS CD 1 1 6 3018 1 1 7 LYS CE C -2.024 -13.676 -2.184 1.00 . A A . 7 LYS CE 1 1 6 3019 1 1 7 LYS CG C -0.335 -12.026 -1.361 1.00 . A A . 7 LYS CG 1 1 6 3020 1 1 7 LYS H H -0.094 -8.982 -1.578 1.00 . A A . 7 LYS H 1 1 6 3021 1 1 7 LYS HA H -1.869 -10.501 0.250 1.00 . A A . 7 LYS HA 1 1 6 3022 1 1 7 LYS HB2 H 1.096 -10.793 -0.337 1.00 . A A . 7 LYS HB2 1 1 6 3023 1 1 7 LYS HB3 H 0.174 -11.870 0.714 1.00 . A A . 7 LYS HB3 1 1 6 3024 1 1 7 LYS HD2 H -1.566 -13.274 -0.124 1.00 . A A . 7 LYS HD2 1 1 6 3025 1 1 7 LYS HD3 H -2.441 -11.979 -0.945 1.00 . A A . 7 LYS HD3 1 1 6 3026 1 1 7 LYS HE2 H -2.756 -14.389 -1.837 1.00 . A A . 7 LYS HE2 1 1 6 3027 1 1 7 LYS HE3 H -2.434 -13.113 -3.011 1.00 . A A . 7 LYS HE3 1 1 6 3028 1 1 7 LYS HG2 H -0.463 -11.363 -2.205 1.00 . A A . 7 LYS HG2 1 1 6 3029 1 1 7 LYS HG3 H 0.408 -12.773 -1.599 1.00 . A A . 7 LYS HG3 1 1 6 3030 1 1 7 LYS HZ1 H -0.326 -14.819 -1.810 1.00 . A A . 7 LYS HZ1 1 1 6 3031 1 1 7 LYS HZ2 H -1.066 -15.149 -3.304 1.00 . A A . 7 LYS HZ2 1 1 6 3032 1 1 7 LYS HZ3 H -0.157 -13.734 -3.108 1.00 . A A . 7 LYS HZ3 1 1 6 3033 1 1 7 LYS N N -0.885 -9.132 -1.014 1.00 . A A . 7 LYS N 1 1 6 3034 1 1 7 LYS NZ N -0.801 -14.399 -2.635 1.00 . A A . 7 LYS NZ 1 1 6 3035 1 1 7 LYS O O 0.205 -9.881 2.249 1.00 . A A . 7 LYS O 1 1 6 3036 1 1 8 GLU C C 0.897 -6.904 2.877 1.00 . A A . 8 GLU C 1 1 6 3037 1 1 8 GLU CA C -0.583 -7.293 2.779 1.00 . A A . 8 GLU CA 1 1 6 3038 1 1 8 GLU CB C -1.056 -8.072 4.002 1.00 . A A . 8 GLU CB 1 1 6 3039 1 1 8 GLU CD C -1.317 -7.256 6.351 1.00 . A A . 8 GLU CD 1 1 6 3040 1 1 8 GLU CG C -1.863 -7.158 4.926 1.00 . A A . 8 GLU CG 1 1 6 3041 1 1 8 GLU H H -1.461 -7.693 0.894 1.00 . A A . 8 GLU H 1 1 6 3042 1 1 8 GLU HA H -1.140 -6.369 2.733 1.00 . A A . 8 GLU HA 1 1 6 3043 1 1 8 GLU HB2 H -1.684 -8.875 3.646 1.00 . A A . 8 GLU HB2 1 1 6 3044 1 1 8 GLU HB3 H -0.206 -8.475 4.532 1.00 . A A . 8 GLU HB3 1 1 6 3045 1 1 8 GLU HG2 H -1.787 -6.138 4.576 1.00 . A A . 8 GLU HG2 1 1 6 3046 1 1 8 GLU HG3 H -2.898 -7.464 4.922 1.00 . A A . 8 GLU HG3 1 1 6 3047 1 1 8 GLU N N -0.907 -8.111 1.574 1.00 . A A . 8 GLU N 1 1 6 3048 1 1 8 GLU O O 1.224 -5.935 3.533 1.00 . A A . 8 GLU O 1 1 6 3049 1 1 8 GLU OE1 O -0.574 -8.187 6.617 1.00 . A A . 8 GLU OE1 1 1 6 3050 1 1 8 GLU OE2 O -1.650 -6.399 7.153 1.00 . A A . 8 GLU OE2 1 1 6 3051 1 1 9 THR C C 3.619 -6.475 1.080 1.00 . A A . 9 THR C 1 1 6 3052 1 1 9 THR CA C 3.235 -7.212 2.361 1.00 . A A . 9 THR CA 1 1 6 3053 1 1 9 THR CB C 4.019 -8.497 2.599 1.00 . A A . 9 THR CB 1 1 6 3054 1 1 9 THR CG2 C 3.577 -9.007 3.970 1.00 . A A . 9 THR CG2 1 1 6 3055 1 1 9 THR H H 1.585 -8.385 1.723 1.00 . A A . 9 THR H 1 1 6 3056 1 1 9 THR HA H 3.357 -6.543 3.202 1.00 . A A . 9 THR HA 1 1 6 3057 1 1 9 THR HB H 5.075 -8.297 2.625 1.00 . A A . 9 THR HB 1 1 6 3058 1 1 9 THR HG1 H 3.281 -10.188 1.980 1.00 . A A . 9 THR HG1 1 1 6 3059 1 1 9 THR HG21 H 2.779 -8.372 4.337 1.00 . A A . 9 THR HG21 1 1 6 3060 1 1 9 THR HG22 H 3.214 -10.020 3.881 1.00 . A A . 9 THR HG22 1 1 6 3061 1 1 9 THR HG23 H 4.409 -8.975 4.657 1.00 . A A . 9 THR HG23 1 1 6 3062 1 1 9 THR N N 1.808 -7.603 2.259 1.00 . A A . 9 THR N 1 1 6 3063 1 1 9 THR O O 4.449 -5.593 1.111 1.00 . A A . 9 THR O 1 1 6 3064 1 1 9 THR OG1 O 3.708 -9.432 1.572 1.00 . A A . 9 THR OG1 1 1 6 3065 1 1 10 ALA C C 3.218 -4.655 -0.936 1.00 . A A . 10 ALA C 1 1 6 3066 1 1 10 ALA CA C 3.348 -6.125 -1.305 1.00 . A A . 10 ALA CA 1 1 6 3067 1 1 10 ALA CB C 2.273 -6.402 -2.358 1.00 . A A . 10 ALA CB 1 1 6 3068 1 1 10 ALA H H 2.348 -7.534 -0.016 1.00 . A A . 10 ALA H 1 1 6 3069 1 1 10 ALA HA H 4.343 -6.337 -1.665 1.00 . A A . 10 ALA HA 1 1 6 3070 1 1 10 ALA HB1 H 1.982 -7.441 -2.323 1.00 . A A . 10 ALA HB1 1 1 6 3071 1 1 10 ALA HB2 H 1.408 -5.781 -2.155 1.00 . A A . 10 ALA HB2 1 1 6 3072 1 1 10 ALA HB3 H 2.656 -6.163 -3.339 1.00 . A A . 10 ALA HB3 1 1 6 3073 1 1 10 ALA N N 3.019 -6.822 -0.029 1.00 . A A . 10 ALA N 1 1 6 3074 1 1 10 ALA O O 3.989 -3.795 -1.315 1.00 . A A . 10 ALA O 1 1 6 3075 1 1 11 CYS C C 3.132 -2.545 1.058 1.00 . A A . 11 CYS C 1 1 6 3076 1 1 11 CYS CA C 1.904 -3.044 0.300 1.00 . A A . 11 CYS CA 1 1 6 3077 1 1 11 CYS CB C 0.630 -3.129 1.147 1.00 . A A . 11 CYS CB 1 1 6 3078 1 1 11 CYS H H 1.605 -5.150 0.108 1.00 . A A . 11 CYS H 1 1 6 3079 1 1 11 CYS HA H 1.754 -2.401 -0.551 1.00 . A A . 11 CYS HA 1 1 6 3080 1 1 11 CYS HB2 H 0.706 -3.943 1.859 1.00 . A A . 11 CYS HB2 1 1 6 3081 1 1 11 CYS HB3 H 0.459 -2.196 1.661 1.00 . A A . 11 CYS HB3 1 1 6 3082 1 1 11 CYS N N 2.195 -4.417 -0.169 1.00 . A A . 11 CYS N 1 1 6 3083 1 1 11 CYS O O 3.852 -1.721 0.531 1.00 . A A . 11 CYS O 1 1 6 3084 1 1 11 CYS SG S -0.762 -3.457 0.035 1.00 . A A . 11 CYS SG 1 1 6 3085 1 1 12 ARG C C 5.726 -2.308 2.189 1.00 . A A . 12 ARG C 1 1 6 3086 1 1 12 ARG CA C 4.524 -2.622 3.077 1.00 . A A . 12 ARG CA 1 1 6 3087 1 1 12 ARG CB C 4.930 -3.744 4.030 1.00 . A A . 12 ARG CB 1 1 6 3088 1 1 12 ARG CD C 6.932 -4.595 5.275 1.00 . A A . 12 ARG CD 1 1 6 3089 1 1 12 ARG CG C 6.456 -3.742 4.097 1.00 . A A . 12 ARG CG 1 1 6 3090 1 1 12 ARG CZ C 6.553 -2.786 6.840 1.00 . A A . 12 ARG CZ 1 1 6 3091 1 1 12 ARG H H 2.739 -3.698 2.609 1.00 . A A . 12 ARG H 1 1 6 3092 1 1 12 ARG HA H 4.268 -1.748 3.657 1.00 . A A . 12 ARG HA 1 1 6 3093 1 1 12 ARG HB2 H 4.507 -3.564 5.008 1.00 . A A . 12 ARG HB2 1 1 6 3094 1 1 12 ARG HB3 H 4.595 -4.697 3.648 1.00 . A A . 12 ARG HB3 1 1 6 3095 1 1 12 ARG HD2 H 6.125 -5.229 5.609 1.00 . A A . 12 ARG HD2 1 1 6 3096 1 1 12 ARG HD3 H 7.765 -5.207 4.961 1.00 . A A . 12 ARG HD3 1 1 6 3097 1 1 12 ARG HE H 8.251 -3.813 6.789 1.00 . A A . 12 ARG HE 1 1 6 3098 1 1 12 ARG HG2 H 6.836 -4.143 3.170 1.00 . A A . 12 ARG HG2 1 1 6 3099 1 1 12 ARG HG3 H 6.805 -2.725 4.220 1.00 . A A . 12 ARG HG3 1 1 6 3100 1 1 12 ARG HH11 H 5.134 -4.085 7.393 1.00 . A A . 12 ARG HH11 1 1 6 3101 1 1 12 ARG HH12 H 4.778 -2.417 7.691 1.00 . A A . 12 ARG HH12 1 1 6 3102 1 1 12 ARG HH21 H 7.782 -1.271 6.391 1.00 . A A . 12 ARG HH21 1 1 6 3103 1 1 12 ARG HH22 H 6.278 -0.823 7.124 1.00 . A A . 12 ARG HH22 1 1 6 3104 1 1 12 ARG N N 3.357 -3.035 2.248 1.00 . A A . 12 ARG N 1 1 6 3105 1 1 12 ARG NE N 7.361 -3.706 6.391 1.00 . A A . 12 ARG NE 1 1 6 3106 1 1 12 ARG NH1 N 5.399 -3.122 7.347 1.00 . A A . 12 ARG NH1 1 1 6 3107 1 1 12 ARG NH2 N 6.898 -1.528 6.781 1.00 . A A . 12 ARG NH2 1 1 6 3108 1 1 12 ARG O O 6.536 -1.458 2.501 1.00 . A A . 12 ARG O 1 1 6 3109 1 1 13 HIS C C 6.912 -1.234 -0.191 1.00 . A A . 13 HIS C 1 1 6 3110 1 1 13 HIS CA C 6.998 -2.705 0.191 1.00 . A A . 13 HIS CA 1 1 6 3111 1 1 13 HIS CB C 6.860 -3.533 -1.079 1.00 . A A . 13 HIS CB 1 1 6 3112 1 1 13 HIS CD2 C 8.816 -4.923 -2.117 1.00 . A A . 13 HIS CD2 1 1 6 3113 1 1 13 HIS CE1 C 10.467 -3.691 -1.470 1.00 . A A . 13 HIS CE1 1 1 6 3114 1 1 13 HIS CG C 8.277 -3.888 -1.415 1.00 . A A . 13 HIS CG 1 1 6 3115 1 1 13 HIS H H 5.193 -3.662 0.835 1.00 . A A . 13 HIS H 1 1 6 3116 1 1 13 HIS HA H 7.937 -2.944 0.672 1.00 . A A . 13 HIS HA 1 1 6 3117 1 1 13 HIS HB2 H 6.265 -4.415 -0.889 1.00 . A A . 13 HIS HB2 1 1 6 3118 1 1 13 HIS HB3 H 6.441 -2.946 -1.881 1.00 . A A . 13 HIS HB3 1 1 6 3119 1 1 13 HIS HD1 H 9.292 -2.301 -0.472 1.00 . A A . 13 HIS HD1 1 1 6 3120 1 1 13 HIS HD2 H 8.219 -5.699 -2.551 1.00 . A A . 13 HIS HD2 1 1 6 3121 1 1 13 HIS HE1 H 11.456 -3.291 -1.303 1.00 . A A . 13 HIS HE1 1 1 6 3122 1 1 13 HIS N N 5.849 -2.983 1.082 1.00 . A A . 13 HIS N 1 1 6 3123 1 1 13 HIS ND1 N 9.347 -3.115 -1.009 1.00 . A A . 13 HIS ND1 1 1 6 3124 1 1 13 HIS NE2 N 10.204 -4.806 -2.157 1.00 . A A . 13 HIS NE2 1 1 6 3125 1 1 13 HIS O O 7.763 -0.421 0.111 1.00 . A A . 13 HIS O 1 1 6 3126 1 1 14 ALA C C 5.915 1.539 -0.251 1.00 . A A . 14 ALA C 1 1 6 3127 1 1 14 ALA CA C 5.609 0.479 -1.320 1.00 . A A . 14 ALA CA 1 1 6 3128 1 1 14 ALA CB C 4.180 0.580 -1.852 1.00 . A A . 14 ALA CB 1 1 6 3129 1 1 14 ALA H H 5.192 -1.626 -1.082 1.00 . A A . 14 ALA H 1 1 6 3130 1 1 14 ALA HA H 6.276 0.665 -2.145 1.00 . A A . 14 ALA HA 1 1 6 3131 1 1 14 ALA HB1 H 3.606 -0.269 -1.503 1.00 . A A . 14 ALA HB1 1 1 6 3132 1 1 14 ALA HB2 H 3.724 1.497 -1.508 1.00 . A A . 14 ALA HB2 1 1 6 3133 1 1 14 ALA HB3 H 4.220 0.577 -2.934 1.00 . A A . 14 ALA HB3 1 1 6 3134 1 1 14 ALA N N 5.845 -0.921 -0.869 1.00 . A A . 14 ALA N 1 1 6 3135 1 1 14 ALA O O 6.750 2.387 -0.496 1.00 . A A . 14 ALA O 1 1 6 3136 1 1 15 LYS C C 7.183 2.587 2.166 1.00 . A A . 15 LYS C 1 1 6 3137 1 1 15 LYS CA C 5.676 2.631 1.880 1.00 . A A . 15 LYS CA 1 1 6 3138 1 1 15 LYS CB C 4.934 2.398 3.197 1.00 . A A . 15 LYS CB 1 1 6 3139 1 1 15 LYS CD C 5.404 3.205 5.526 1.00 . A A . 15 LYS CD 1 1 6 3140 1 1 15 LYS CE C 6.884 3.271 5.908 1.00 . A A . 15 LYS CE 1 1 6 3141 1 1 15 LYS CG C 5.233 3.611 4.062 1.00 . A A . 15 LYS CG 1 1 6 3142 1 1 15 LYS H H 4.633 0.923 1.178 1.00 . A A . 15 LYS H 1 1 6 3143 1 1 15 LYS HA H 5.381 3.600 1.488 1.00 . A A . 15 LYS HA 1 1 6 3144 1 1 15 LYS HB2 H 3.869 2.333 3.023 1.00 . A A . 15 LYS HB2 1 1 6 3145 1 1 15 LYS HB3 H 5.285 1.513 3.707 1.00 . A A . 15 LYS HB3 1 1 6 3146 1 1 15 LYS HD2 H 4.837 3.879 6.152 1.00 . A A . 15 LYS HD2 1 1 6 3147 1 1 15 LYS HD3 H 5.046 2.196 5.665 1.00 . A A . 15 LYS HD3 1 1 6 3148 1 1 15 LYS HE2 H 7.074 2.589 6.724 1.00 . A A . 15 LYS HE2 1 1 6 3149 1 1 15 LYS HE3 H 7.486 2.991 5.057 1.00 . A A . 15 LYS HE3 1 1 6 3150 1 1 15 LYS HG2 H 6.141 4.049 3.680 1.00 . A A . 15 LYS HG2 1 1 6 3151 1 1 15 LYS HG3 H 4.415 4.303 3.955 1.00 . A A . 15 LYS HG3 1 1 6 3152 1 1 15 LYS HZ1 H 6.358 5.211 6.455 1.00 . A A . 15 LYS HZ1 1 1 6 3153 1 1 15 LYS HZ2 H 7.749 4.631 7.228 1.00 . A A . 15 LYS HZ2 1 1 6 3154 1 1 15 LYS HZ3 H 7.820 5.102 5.596 1.00 . A A . 15 LYS HZ3 1 1 6 3155 1 1 15 LYS N N 5.313 1.567 0.911 1.00 . A A . 15 LYS N 1 1 6 3156 1 1 15 LYS NZ N 7.229 4.658 6.328 1.00 . A A . 15 LYS NZ 1 1 6 3157 1 1 15 LYS O O 7.824 3.619 2.200 1.00 . A A . 15 LYS O 1 1 6 3158 1 1 16 SER C C 10.106 1.283 1.397 1.00 . A A . 16 SER C 1 1 6 3159 1 1 16 SER CA C 9.249 1.415 2.660 1.00 . A A . 16 SER CA 1 1 6 3160 1 1 16 SER CB C 9.541 0.192 3.522 1.00 . A A . 16 SER CB 1 1 6 3161 1 1 16 SER H H 7.299 0.578 2.364 1.00 . A A . 16 SER H 1 1 6 3162 1 1 16 SER HA H 9.540 2.288 3.221 1.00 . A A . 16 SER HA 1 1 6 3163 1 1 16 SER HB2 H 8.660 -0.076 4.083 1.00 . A A . 16 SER HB2 1 1 6 3164 1 1 16 SER HB3 H 9.798 -0.622 2.858 1.00 . A A . 16 SER HB3 1 1 6 3165 1 1 16 SER HG H 10.326 0.218 5.302 1.00 . A A . 16 SER HG 1 1 6 3166 1 1 16 SER N N 7.783 1.437 2.379 1.00 . A A . 16 SER N 1 1 6 3167 1 1 16 SER O O 11.286 1.010 1.486 1.00 . A A . 16 SER O 1 1 6 3168 1 1 16 SER OG O 10.601 0.485 4.421 1.00 . A A . 16 SER OG 1 1 6 3169 1 1 17 LEU C C 10.569 2.603 -1.799 1.00 . A A . 17 LEU C 1 1 6 3170 1 1 17 LEU CA C 10.419 1.318 -0.984 1.00 . A A . 17 LEU CA 1 1 6 3171 1 1 17 LEU CB C 9.871 0.136 -1.778 1.00 . A A . 17 LEU CB 1 1 6 3172 1 1 17 LEU CD1 C 9.291 1.199 -3.939 1.00 . A A . 17 LEU CD1 1 1 6 3173 1 1 17 LEU CD2 C 8.029 -0.815 -3.014 1.00 . A A . 17 LEU CD2 1 1 6 3174 1 1 17 LEU CG C 8.723 0.514 -2.698 1.00 . A A . 17 LEU CG 1 1 6 3175 1 1 17 LEU H H 8.611 1.674 0.156 1.00 . A A . 17 LEU H 1 1 6 3176 1 1 17 LEU HA H 11.409 1.052 -0.660 1.00 . A A . 17 LEU HA 1 1 6 3177 1 1 17 LEU HB2 H 10.638 -0.330 -2.371 1.00 . A A . 17 LEU HB2 1 1 6 3178 1 1 17 LEU HB3 H 9.495 -0.574 -1.063 1.00 . A A . 17 LEU HB3 1 1 6 3179 1 1 17 LEU HD11 H 10.343 1.382 -3.780 1.00 . A A . 17 LEU HD11 1 1 6 3180 1 1 17 LEU HD12 H 9.154 0.561 -4.799 1.00 . A A . 17 LEU HD12 1 1 6 3181 1 1 17 LEU HD13 H 8.775 2.136 -4.090 1.00 . A A . 17 LEU HD13 1 1 6 3182 1 1 17 LEU HD21 H 8.180 -1.482 -2.177 1.00 . A A . 17 LEU HD21 1 1 6 3183 1 1 17 LEU HD22 H 6.972 -0.681 -3.176 1.00 . A A . 17 LEU HD22 1 1 6 3184 1 1 17 LEU HD23 H 8.471 -1.250 -3.897 1.00 . A A . 17 LEU HD23 1 1 6 3185 1 1 17 LEU HG H 8.059 1.167 -2.164 1.00 . A A . 17 LEU HG 1 1 6 3186 1 1 17 LEU N N 9.562 1.459 0.228 1.00 . A A . 17 LEU N 1 1 6 3187 1 1 17 LEU O O 11.625 2.867 -2.341 1.00 . A A . 17 LEU O 1 1 6 3188 1 1 18 GLY C C 8.335 5.081 -3.246 1.00 . A A . 18 GLY C 1 1 6 3189 1 1 18 GLY CA C 9.700 4.667 -2.696 1.00 . A A . 18 GLY CA 1 1 6 3190 1 1 18 GLY H H 8.711 3.198 -1.468 1.00 . A A . 18 GLY H 1 1 6 3191 1 1 18 GLY HA2 H 10.090 5.449 -2.061 1.00 . A A . 18 GLY HA2 1 1 6 3192 1 1 18 GLY HA3 H 10.373 4.500 -3.523 1.00 . A A . 18 GLY HA3 1 1 6 3193 1 1 18 GLY N N 9.557 3.413 -1.905 1.00 . A A . 18 GLY N 1 1 6 3194 1 1 18 GLY O O 8.097 6.229 -3.563 1.00 . A A . 18 GLY O 1 1 6 3195 1 1 19 ASN C C 5.239 5.157 -2.830 1.00 . A A . 19 ASN C 1 1 6 3196 1 1 19 ASN CA C 6.089 4.440 -3.884 1.00 . A A . 19 ASN CA 1 1 6 3197 1 1 19 ASN CB C 5.486 3.131 -4.413 1.00 . A A . 19 ASN CB 1 1 6 3198 1 1 19 ASN CG C 6.588 2.207 -4.928 1.00 . A A . 19 ASN CG 1 1 6 3199 1 1 19 ASN H H 7.640 3.224 -3.106 1.00 . A A . 19 ASN H 1 1 6 3200 1 1 19 ASN HA H 6.212 5.124 -4.713 1.00 . A A . 19 ASN HA 1 1 6 3201 1 1 19 ASN HB2 H 4.849 2.606 -3.725 1.00 . A A . 19 ASN HB2 1 1 6 3202 1 1 19 ASN HB3 H 4.868 3.361 -5.243 1.00 . A A . 19 ASN HB3 1 1 6 3203 1 1 19 ASN HD21 H 5.869 0.623 -3.973 1.00 . A A . 19 ASN HD21 1 1 6 3204 1 1 19 ASN HD22 H 7.273 0.351 -4.892 1.00 . A A . 19 ASN HD22 1 1 6 3205 1 1 19 ASN N N 7.439 4.141 -3.360 1.00 . A A . 19 ASN N 1 1 6 3206 1 1 19 ASN ND2 N 6.577 0.957 -4.567 1.00 . A A . 19 ASN ND2 1 1 6 3207 1 1 19 ASN O O 5.116 6.360 -2.935 1.00 . A A . 19 ASN O 1 1 6 3208 1 1 19 ASN OD1 O 7.461 2.625 -5.661 1.00 . A A . 19 ASN OD1 1 1 6 3209 1 1 20 CYS C C 3.074 6.363 -1.390 1.00 . A A . 20 CYS C 1 1 6 3210 1 1 20 CYS CA C 3.835 5.163 -0.811 1.00 . A A . 20 CYS CA 1 1 6 3211 1 1 20 CYS CB C 4.707 5.701 0.320 1.00 . A A . 20 CYS CB 1 1 6 3212 1 1 20 CYS H H 4.802 3.514 -1.798 1.00 . A A . 20 CYS H 1 1 6 3213 1 1 20 CYS HA H 3.133 4.455 -0.398 1.00 . A A . 20 CYS HA 1 1 6 3214 1 1 20 CYS HB2 H 5.600 5.106 0.402 1.00 . A A . 20 CYS HB2 1 1 6 3215 1 1 20 CYS HB3 H 4.963 6.722 0.084 1.00 . A A . 20 CYS HB3 1 1 6 3216 1 1 20 CYS N N 4.673 4.485 -1.854 1.00 . A A . 20 CYS N 1 1 6 3217 1 1 20 CYS O O 2.822 7.309 -0.673 1.00 . A A . 20 CYS O 1 1 6 3218 1 1 20 CYS SG S 3.850 5.652 1.912 1.00 . A A . 20 CYS SG 1 1 6 3219 1 1 21 ARG C C 2.267 7.525 -4.808 1.00 . A A . 21 ARG C 1 1 6 3220 1 1 21 ARG CA C 1.981 7.449 -3.302 1.00 . A A . 21 ARG CA 1 1 6 3221 1 1 21 ARG CB C 2.443 8.782 -2.720 1.00 . A A . 21 ARG CB 1 1 6 3222 1 1 21 ARG CD C 2.148 9.899 -0.503 1.00 . A A . 21 ARG CD 1 1 6 3223 1 1 21 ARG CG C 1.419 9.293 -1.704 1.00 . A A . 21 ARG CG 1 1 6 3224 1 1 21 ARG CZ C 1.645 12.238 -0.120 1.00 . A A . 21 ARG CZ 1 1 6 3225 1 1 21 ARG H H 2.956 5.538 -3.175 1.00 . A A . 21 ARG H 1 1 6 3226 1 1 21 ARG HA H 0.924 7.350 -3.123 1.00 . A A . 21 ARG HA 1 1 6 3227 1 1 21 ARG HB2 H 3.393 8.620 -2.233 1.00 . A A . 21 ARG HB2 1 1 6 3228 1 1 21 ARG HB3 H 2.560 9.504 -3.515 1.00 . A A . 21 ARG HB3 1 1 6 3229 1 1 21 ARG HD2 H 2.315 9.135 0.242 1.00 . A A . 21 ARG HD2 1 1 6 3230 1 1 21 ARG HD3 H 3.097 10.301 -0.825 1.00 . A A . 21 ARG HD3 1 1 6 3231 1 1 21 ARG HE H 0.533 10.772 0.624 1.00 . A A . 21 ARG HE 1 1 6 3232 1 1 21 ARG HG2 H 0.800 10.045 -2.170 1.00 . A A . 21 ARG HG2 1 1 6 3233 1 1 21 ARG HG3 H 0.804 8.471 -1.369 1.00 . A A . 21 ARG HG3 1 1 6 3234 1 1 21 ARG HH11 H 3.521 12.022 0.546 1.00 . A A . 21 ARG HH11 1 1 6 3235 1 1 21 ARG HH12 H 3.095 13.613 0.010 1.00 . A A . 21 ARG HH12 1 1 6 3236 1 1 21 ARG HH21 H -0.155 12.744 -0.835 1.00 . A A . 21 ARG HH21 1 1 6 3237 1 1 21 ARG HH22 H 1.014 14.022 -0.772 1.00 . A A . 21 ARG HH22 1 1 6 3238 1 1 21 ARG N N 2.721 6.326 -2.650 1.00 . A A . 21 ARG N 1 1 6 3239 1 1 21 ARG NE N 1.321 10.990 0.084 1.00 . A A . 21 ARG NE 1 1 6 3240 1 1 21 ARG NH1 N 2.847 12.657 0.168 1.00 . A A . 21 ARG NH1 1 1 6 3241 1 1 21 ARG NH2 N 0.767 13.066 -0.614 1.00 . A A . 21 ARG NH2 1 1 6 3242 1 1 21 ARG O O 1.480 8.075 -5.551 1.00 . A A . 21 ARG O 1 1 6 3243 1 1 22 THR C C 3.037 5.865 -7.455 1.00 . A A . 22 THR C 1 1 6 3244 1 1 22 THR CA C 3.643 7.075 -6.749 1.00 . A A . 22 THR CA 1 1 6 3245 1 1 22 THR CB C 5.156 7.095 -6.977 1.00 . A A . 22 THR CB 1 1 6 3246 1 1 22 THR CG2 C 5.822 8.021 -5.956 1.00 . A A . 22 THR CG2 1 1 6 3247 1 1 22 THR H H 4.009 6.553 -4.703 1.00 . A A . 22 THR H 1 1 6 3248 1 1 22 THR HA H 3.211 7.979 -7.150 1.00 . A A . 22 THR HA 1 1 6 3249 1 1 22 THR HB H 5.369 7.462 -7.969 1.00 . A A . 22 THR HB 1 1 6 3250 1 1 22 THR HG1 H 6.587 5.843 -6.564 1.00 . A A . 22 THR HG1 1 1 6 3251 1 1 22 THR HG21 H 5.066 8.608 -5.457 1.00 . A A . 22 THR HG21 1 1 6 3252 1 1 22 THR HG22 H 6.358 7.429 -5.229 1.00 . A A . 22 THR HG22 1 1 6 3253 1 1 22 THR HG23 H 6.512 8.679 -6.464 1.00 . A A . 22 THR HG23 1 1 6 3254 1 1 22 THR N N 3.364 6.998 -5.288 1.00 . A A . 22 THR N 1 1 6 3255 1 1 22 THR O O 3.133 5.723 -8.658 1.00 . A A . 22 THR O 1 1 6 3256 1 1 22 THR OG1 O 5.668 5.777 -6.836 1.00 . A A . 22 THR OG1 1 1 6 3257 1 1 23 SER C C 0.378 3.766 -6.804 1.00 . A A . 23 SER C 1 1 6 3258 1 1 23 SER CA C 1.803 3.797 -7.355 1.00 . A A . 23 SER CA 1 1 6 3259 1 1 23 SER CB C 2.656 2.593 -6.951 1.00 . A A . 23 SER CB 1 1 6 3260 1 1 23 SER H H 2.333 5.106 -5.744 1.00 . A A . 23 SER H 1 1 6 3261 1 1 23 SER HA H 1.783 3.929 -8.427 1.00 . A A . 23 SER HA 1 1 6 3262 1 1 23 SER HB2 H 3.393 2.395 -7.712 1.00 . A A . 23 SER HB2 1 1 6 3263 1 1 23 SER HB3 H 3.166 2.822 -6.021 1.00 . A A . 23 SER HB3 1 1 6 3264 1 1 23 SER HG H 1.493 1.216 -7.684 1.00 . A A . 23 SER HG 1 1 6 3265 1 1 23 SER N N 2.413 4.991 -6.718 1.00 . A A . 23 SER N 1 1 6 3266 1 1 23 SER O O 0.173 3.544 -5.629 1.00 . A A . 23 SER O 1 1 6 3267 1 1 23 SER OG O 1.819 1.453 -6.812 1.00 . A A . 23 SER OG 1 1 6 3268 1 1 24 GLN C C -2.401 2.792 -6.307 1.00 . A A . 24 GLN C 1 1 6 3269 1 1 24 GLN CA C -2.025 3.995 -7.176 1.00 . A A . 24 GLN CA 1 1 6 3270 1 1 24 GLN CB C -2.958 4.070 -8.386 1.00 . A A . 24 GLN CB 1 1 6 3271 1 1 24 GLN CD C -3.090 6.565 -8.288 1.00 . A A . 24 GLN CD 1 1 6 3272 1 1 24 GLN CG C -2.698 5.367 -9.154 1.00 . A A . 24 GLN CG 1 1 6 3273 1 1 24 GLN H H -0.402 4.177 -8.573 1.00 . A A . 24 GLN H 1 1 6 3274 1 1 24 GLN HA H -2.179 4.887 -6.588 1.00 . A A . 24 GLN HA 1 1 6 3275 1 1 24 GLN HB2 H -2.777 3.223 -9.031 1.00 . A A . 24 GLN HB2 1 1 6 3276 1 1 24 GLN HB3 H -3.984 4.057 -8.051 1.00 . A A . 24 GLN HB3 1 1 6 3277 1 1 24 GLN HE21 H -1.473 7.617 -8.758 1.00 . A A . 24 GLN HE21 1 1 6 3278 1 1 24 GLN HE22 H -2.548 8.379 -7.689 1.00 . A A . 24 GLN HE22 1 1 6 3279 1 1 24 GLN HG2 H -1.650 5.430 -9.407 1.00 . A A . 24 GLN HG2 1 1 6 3280 1 1 24 GLN HG3 H -3.288 5.375 -10.059 1.00 . A A . 24 GLN HG3 1 1 6 3281 1 1 24 GLN N N -0.603 3.994 -7.632 1.00 . A A . 24 GLN N 1 1 6 3282 1 1 24 GLN NE2 N -2.306 7.606 -8.241 1.00 . A A . 24 GLN NE2 1 1 6 3283 1 1 24 GLN O O -3.244 2.904 -5.441 1.00 . A A . 24 GLN O 1 1 6 3284 1 1 24 GLN OE1 O -4.123 6.553 -7.648 1.00 . A A . 24 GLN OE1 1 1 6 3285 1 1 25 LYS C C -1.379 0.542 -4.355 1.00 . A A . 25 LYS C 1 1 6 3286 1 1 25 LYS CA C -2.193 0.488 -5.649 1.00 . A A . 25 LYS CA 1 1 6 3287 1 1 25 LYS CB C -1.871 -0.792 -6.416 1.00 . A A . 25 LYS CB 1 1 6 3288 1 1 25 LYS CD C -3.175 -2.569 -7.621 1.00 . A A . 25 LYS CD 1 1 6 3289 1 1 25 LYS CE C -3.700 -1.737 -8.792 1.00 . A A . 25 LYS CE 1 1 6 3290 1 1 25 LYS CG C -3.099 -1.698 -6.365 1.00 . A A . 25 LYS CG 1 1 6 3291 1 1 25 LYS H H -1.133 1.547 -7.201 1.00 . A A . 25 LYS H 1 1 6 3292 1 1 25 LYS HA H -3.248 0.524 -5.424 1.00 . A A . 25 LYS HA 1 1 6 3293 1 1 25 LYS HB2 H -1.629 -0.539 -7.439 1.00 . A A . 25 LYS HB2 1 1 6 3294 1 1 25 LYS HB3 H -1.036 -1.291 -5.950 1.00 . A A . 25 LYS HB3 1 1 6 3295 1 1 25 LYS HD2 H -2.191 -2.946 -7.859 1.00 . A A . 25 LYS HD2 1 1 6 3296 1 1 25 LYS HD3 H -3.847 -3.396 -7.447 1.00 . A A . 25 LYS HD3 1 1 6 3297 1 1 25 LYS HE2 H -4.599 -1.219 -8.492 1.00 . A A . 25 LYS HE2 1 1 6 3298 1 1 25 LYS HE3 H -2.951 -1.016 -9.086 1.00 . A A . 25 LYS HE3 1 1 6 3299 1 1 25 LYS HG2 H -3.048 -2.313 -5.478 1.00 . A A . 25 LYS HG2 1 1 6 3300 1 1 25 LYS HG3 H -3.977 -1.073 -6.305 1.00 . A A . 25 LYS HG3 1 1 6 3301 1 1 25 LYS HZ1 H -3.845 -3.623 -9.663 1.00 . A A . 25 LYS HZ1 1 1 6 3302 1 1 25 LYS HZ2 H -4.996 -2.505 -10.227 1.00 . A A . 25 LYS HZ2 1 1 6 3303 1 1 25 LYS HZ3 H -3.378 -2.404 -10.740 1.00 . A A . 25 LYS HZ3 1 1 6 3304 1 1 25 LYS N N -1.813 1.647 -6.503 1.00 . A A . 25 LYS N 1 1 6 3305 1 1 25 LYS NZ N -4.003 -2.634 -9.942 1.00 . A A . 25 LYS NZ 1 1 6 3306 1 1 25 LYS O O -1.856 0.342 -3.256 1.00 . A A . 25 LYS O 1 1 6 3307 1 1 26 TYR C C 0.500 2.069 -2.461 1.00 . A A . 26 TYR C 1 1 6 3308 1 1 26 TYR CA C 0.862 0.933 -3.417 1.00 . A A . 26 TYR CA 1 1 6 3309 1 1 26 TYR CB C 2.161 1.347 -4.083 1.00 . A A . 26 TYR CB 1 1 6 3310 1 1 26 TYR CD1 C 2.117 -1.110 -4.679 1.00 . A A . 26 TYR CD1 1 1 6 3311 1 1 26 TYR CD2 C 4.020 0.233 -5.333 1.00 . A A . 26 TYR CD2 1 1 6 3312 1 1 26 TYR CE1 C 2.705 -2.227 -5.261 1.00 . A A . 26 TYR CE1 1 1 6 3313 1 1 26 TYR CE2 C 4.609 -0.892 -5.916 1.00 . A A . 26 TYR CE2 1 1 6 3314 1 1 26 TYR CG C 2.774 0.126 -4.713 1.00 . A A . 26 TYR CG 1 1 6 3315 1 1 26 TYR CZ C 3.954 -2.130 -5.882 1.00 . A A . 26 TYR CZ 1 1 6 3316 1 1 26 TYR H H 0.180 0.972 -5.450 1.00 . A A . 26 TYR H 1 1 6 3317 1 1 26 TYR HA H 1.038 -0.004 -2.910 1.00 . A A . 26 TYR HA 1 1 6 3318 1 1 26 TYR HB2 H 1.928 2.099 -4.814 1.00 . A A . 26 TYR HB2 1 1 6 3319 1 1 26 TYR HB3 H 2.832 1.764 -3.348 1.00 . A A . 26 TYR HB3 1 1 6 3320 1 1 26 TYR HD1 H 1.153 -1.244 -4.218 1.00 . A A . 26 TYR HD1 1 1 6 3321 1 1 26 TYR HD2 H 4.525 1.188 -5.359 1.00 . A A . 26 TYR HD2 1 1 6 3322 1 1 26 TYR HE1 H 2.161 -3.154 -5.207 1.00 . A A . 26 TYR HE1 1 1 6 3323 1 1 26 TYR HE2 H 5.571 -0.795 -6.390 1.00 . A A . 26 TYR HE2 1 1 6 3324 1 1 26 TYR HH H 5.440 -3.014 -6.692 1.00 . A A . 26 TYR HH 1 1 6 3325 1 1 26 TYR N N -0.124 0.824 -4.531 1.00 . A A . 26 TYR N 1 1 6 3326 1 1 26 TYR O O 0.946 2.126 -1.332 1.00 . A A . 26 TYR O 1 1 6 3327 1 1 26 TYR OH O 4.536 -3.241 -6.458 1.00 . A A . 26 TYR OH 1 1 6 3328 1 1 27 ARG C C -2.166 3.922 -1.651 1.00 . A A . 27 ARG C 1 1 6 3329 1 1 27 ARG CA C -0.701 4.115 -2.041 1.00 . A A . 27 ARG CA 1 1 6 3330 1 1 27 ARG CB C -0.495 5.429 -2.803 1.00 . A A . 27 ARG CB 1 1 6 3331 1 1 27 ARG CD C -1.614 7.232 -4.143 1.00 . A A . 27 ARG CD 1 1 6 3332 1 1 27 ARG CG C -1.804 5.881 -3.449 1.00 . A A . 27 ARG CG 1 1 6 3333 1 1 27 ARG CZ C -1.995 9.557 -3.593 1.00 . A A . 27 ARG CZ 1 1 6 3334 1 1 27 ARG H H -0.659 2.920 -3.827 1.00 . A A . 27 ARG H 1 1 6 3335 1 1 27 ARG HA H -0.071 4.088 -1.167 1.00 . A A . 27 ARG HA 1 1 6 3336 1 1 27 ARG HB2 H -0.152 6.194 -2.123 1.00 . A A . 27 ARG HB2 1 1 6 3337 1 1 27 ARG HB3 H 0.242 5.277 -3.579 1.00 . A A . 27 ARG HB3 1 1 6 3338 1 1 27 ARG HD2 H -0.561 7.440 -4.251 1.00 . A A . 27 ARG HD2 1 1 6 3339 1 1 27 ARG HD3 H -2.071 7.195 -5.121 1.00 . A A . 27 ARG HD3 1 1 6 3340 1 1 27 ARG HE H -2.875 8.072 -2.612 1.00 . A A . 27 ARG HE 1 1 6 3341 1 1 27 ARG HG2 H -2.073 5.152 -4.198 1.00 . A A . 27 ARG HG2 1 1 6 3342 1 1 27 ARG HG3 H -2.574 5.969 -2.695 1.00 . A A . 27 ARG HG3 1 1 6 3343 1 1 27 ARG HH11 H -2.890 9.537 -5.384 1.00 . A A . 27 ARG HH11 1 1 6 3344 1 1 27 ARG HH12 H -2.186 11.049 -4.915 1.00 . A A . 27 ARG HH12 1 1 6 3345 1 1 27 ARG HH21 H -1.039 9.866 -1.862 1.00 . A A . 27 ARG HH21 1 1 6 3346 1 1 27 ARG HH22 H -1.138 11.236 -2.918 1.00 . A A . 27 ARG HH22 1 1 6 3347 1 1 27 ARG N N -0.311 2.980 -2.916 1.00 . A A . 27 ARG N 1 1 6 3348 1 1 27 ARG NE N -2.257 8.305 -3.335 1.00 . A A . 27 ARG NE 1 1 6 3349 1 1 27 ARG NH1 N -2.387 10.089 -4.718 1.00 . A A . 27 ARG NH1 1 1 6 3350 1 1 27 ARG NH2 N -1.339 10.276 -2.723 1.00 . A A . 27 ARG NH2 1 1 6 3351 1 1 27 ARG O O -2.557 4.055 -0.508 1.00 . A A . 27 ARG O 1 1 6 3352 1 1 28 ALA C C -4.630 1.920 -1.982 1.00 . A A . 28 ALA C 1 1 6 3353 1 1 28 ALA CA C -4.427 3.388 -2.354 1.00 . A A . 28 ALA CA 1 1 6 3354 1 1 28 ALA CB C -5.231 3.712 -3.615 1.00 . A A . 28 ALA CB 1 1 6 3355 1 1 28 ALA H H -2.633 3.501 -3.527 1.00 . A A . 28 ALA H 1 1 6 3356 1 1 28 ALA HA H -4.748 4.020 -1.538 1.00 . A A . 28 ALA HA 1 1 6 3357 1 1 28 ALA HB1 H -4.917 4.668 -4.006 1.00 . A A . 28 ALA HB1 1 1 6 3358 1 1 28 ALA HB2 H -5.061 2.946 -4.357 1.00 . A A . 28 ALA HB2 1 1 6 3359 1 1 28 ALA HB3 H -6.283 3.751 -3.372 1.00 . A A . 28 ALA HB3 1 1 6 3360 1 1 28 ALA N N -2.979 3.602 -2.618 1.00 . A A . 28 ALA N 1 1 6 3361 1 1 28 ALA O O -5.206 1.608 -0.958 1.00 . A A . 28 ALA O 1 1 6 3362 1 1 29 ASN C C -3.466 -0.811 -1.263 1.00 . A A . 29 ASN C 1 1 6 3363 1 1 29 ASN CA C -4.365 -0.423 -2.433 1.00 . A A . 29 ASN CA 1 1 6 3364 1 1 29 ASN CB C -4.039 -1.391 -3.572 1.00 . A A . 29 ASN CB 1 1 6 3365 1 1 29 ASN CG C -5.284 -1.596 -4.438 1.00 . A A . 29 ASN CG 1 1 6 3366 1 1 29 ASN H H -3.703 1.263 -3.621 1.00 . A A . 29 ASN H 1 1 6 3367 1 1 29 ASN HA H -5.399 -0.519 -2.164 1.00 . A A . 29 ASN HA 1 1 6 3368 1 1 29 ASN HB2 H -3.233 -0.978 -4.156 1.00 . A A . 29 ASN HB2 1 1 6 3369 1 1 29 ASN HB3 H -3.720 -2.346 -3.171 1.00 . A A . 29 ASN HB3 1 1 6 3370 1 1 29 ASN HD21 H -5.362 0.299 -5.028 1.00 . A A . 29 ASN HD21 1 1 6 3371 1 1 29 ASN HD22 H -6.580 -0.706 -5.651 1.00 . A A . 29 ASN HD22 1 1 6 3372 1 1 29 ASN N N -4.166 1.008 -2.796 1.00 . A A . 29 ASN N 1 1 6 3373 1 1 29 ASN ND2 N -5.784 -0.584 -5.092 1.00 . A A . 29 ASN ND2 1 1 6 3374 1 1 29 ASN O O -3.573 -1.889 -0.716 1.00 . A A . 29 ASN O 1 1 6 3375 1 1 29 ASN OD1 O -5.807 -2.689 -4.520 1.00 . A A . 29 ASN OD1 1 1 6 3376 1 1 30 CYS C C -1.657 0.942 1.194 1.00 . A A . 30 CYS C 1 1 6 3377 1 1 30 CYS CA C -1.666 -0.251 0.246 1.00 . A A . 30 CYS CA 1 1 6 3378 1 1 30 CYS CB C -0.308 -0.547 -0.383 1.00 . A A . 30 CYS CB 1 1 6 3379 1 1 30 CYS H H -2.510 0.924 -1.345 1.00 . A A . 30 CYS H 1 1 6 3380 1 1 30 CYS HA H -2.025 -1.124 0.772 1.00 . A A . 30 CYS HA 1 1 6 3381 1 1 30 CYS HB2 H 0.002 0.282 -1.001 1.00 . A A . 30 CYS HB2 1 1 6 3382 1 1 30 CYS HB3 H 0.428 -0.756 0.378 1.00 . A A . 30 CYS HB3 1 1 6 3383 1 1 30 CYS N N -2.579 0.062 -0.885 1.00 . A A . 30 CYS N 1 1 6 3384 1 1 30 CYS O O -0.637 1.448 1.619 1.00 . A A . 30 CYS O 1 1 6 3385 1 1 30 CYS SG S -0.568 -2.031 -1.384 1.00 . A A . 30 CYS SG 1 1 6 3386 1 1 31 ALA C C -2.766 2.119 3.859 1.00 . A A . 31 ALA C 1 1 6 3387 1 1 31 ALA CA C -3.072 2.519 2.410 1.00 . A A . 31 ALA CA 1 1 6 3388 1 1 31 ALA CB C -4.541 2.924 2.267 1.00 . A A . 31 ALA CB 1 1 6 3389 1 1 31 ALA H H -3.625 0.911 1.118 1.00 . A A . 31 ALA H 1 1 6 3390 1 1 31 ALA HA H -2.447 3.340 2.092 1.00 . A A . 31 ALA HA 1 1 6 3391 1 1 31 ALA HB1 H -5.046 2.202 1.637 1.00 . A A . 31 ALA HB1 1 1 6 3392 1 1 31 ALA HB2 H -5.007 2.941 3.240 1.00 . A A . 31 ALA HB2 1 1 6 3393 1 1 31 ALA HB3 H -4.605 3.903 1.815 1.00 . A A . 31 ALA HB3 1 1 6 3394 1 1 31 ALA N N -2.849 1.366 1.501 1.00 . A A . 31 ALA N 1 1 6 3395 1 1 31 ALA O O -2.751 2.944 4.750 1.00 . A A . 31 ALA O 1 1 6 3396 1 1 32 LYS C C -0.714 0.552 5.719 1.00 . A A . 32 LYS C 1 1 6 3397 1 1 32 LYS CA C -2.218 0.398 5.495 1.00 . A A . 32 LYS CA 1 1 6 3398 1 1 32 LYS CB C -2.563 -1.091 5.603 1.00 . A A . 32 LYS CB 1 1 6 3399 1 1 32 LYS CD C -1.591 -3.409 5.947 1.00 . A A . 32 LYS CD 1 1 6 3400 1 1 32 LYS CE C -0.351 -4.153 5.438 1.00 . A A . 32 LYS CE 1 1 6 3401 1 1 32 LYS CG C -1.305 -1.905 5.933 1.00 . A A . 32 LYS CG 1 1 6 3402 1 1 32 LYS H H -2.540 0.209 3.377 1.00 . A A . 32 LYS H 1 1 6 3403 1 1 32 LYS HA H -2.782 0.963 6.221 1.00 . A A . 32 LYS HA 1 1 6 3404 1 1 32 LYS HB2 H -3.302 -1.227 6.378 1.00 . A A . 32 LYS HB2 1 1 6 3405 1 1 32 LYS HB3 H -2.965 -1.426 4.658 1.00 . A A . 32 LYS HB3 1 1 6 3406 1 1 32 LYS HD2 H -1.819 -3.723 6.954 1.00 . A A . 32 LYS HD2 1 1 6 3407 1 1 32 LYS HD3 H -2.426 -3.627 5.297 1.00 . A A . 32 LYS HD3 1 1 6 3408 1 1 32 LYS HE2 H -0.473 -5.223 5.548 1.00 . A A . 32 LYS HE2 1 1 6 3409 1 1 32 LYS HE3 H -0.199 -3.918 4.395 1.00 . A A . 32 LYS HE3 1 1 6 3410 1 1 32 LYS HG2 H -0.550 -1.718 5.185 1.00 . A A . 32 LYS HG2 1 1 6 3411 1 1 32 LYS HG3 H -0.931 -1.610 6.904 1.00 . A A . 32 LYS HG3 1 1 6 3412 1 1 32 LYS HZ1 H 0.576 -2.947 6.864 1.00 . A A . 32 LYS HZ1 1 1 6 3413 1 1 32 LYS HZ2 H 1.212 -4.513 6.767 1.00 . A A . 32 LYS HZ2 1 1 6 3414 1 1 32 LYS HZ3 H 1.576 -3.375 5.558 1.00 . A A . 32 LYS HZ3 1 1 6 3415 1 1 32 LYS N N -2.523 0.860 4.108 1.00 . A A . 32 LYS N 1 1 6 3416 1 1 32 LYS NZ N 0.843 -3.714 6.215 1.00 . A A . 32 LYS NZ 1 1 6 3417 1 1 32 LYS O O -0.228 0.843 6.794 1.00 . A A . 32 LYS O 1 1 6 3418 1 1 33 THR C C 1.933 1.868 4.406 1.00 . A A . 33 THR C 1 1 6 3419 1 1 33 THR CA C 1.480 0.426 4.615 1.00 . A A . 33 THR CA 1 1 6 3420 1 1 33 THR CB C 1.887 -0.474 3.451 1.00 . A A . 33 THR CB 1 1 6 3421 1 1 33 THR CG2 C 3.140 0.129 2.843 1.00 . A A . 33 THR CG2 1 1 6 3422 1 1 33 THR H H -0.473 0.106 3.823 1.00 . A A . 33 THR H 1 1 6 3423 1 1 33 THR HA H 1.957 0.070 5.511 1.00 . A A . 33 THR HA 1 1 6 3424 1 1 33 THR HB H 1.112 -0.495 2.701 1.00 . A A . 33 THR HB 1 1 6 3425 1 1 33 THR HG1 H 1.293 -2.197 4.126 1.00 . A A . 33 THR HG1 1 1 6 3426 1 1 33 THR HG21 H 3.759 0.454 3.659 1.00 . A A . 33 THR HG21 1 1 6 3427 1 1 33 THR HG22 H 3.660 -0.614 2.267 1.00 . A A . 33 THR HG22 1 1 6 3428 1 1 33 THR HG23 H 2.879 0.973 2.225 1.00 . A A . 33 THR HG23 1 1 6 3429 1 1 33 THR N N -0.005 0.339 4.650 1.00 . A A . 33 THR N 1 1 6 3430 1 1 33 THR O O 2.960 2.286 4.905 1.00 . A A . 33 THR O 1 1 6 3431 1 1 33 THR OG1 O 2.139 -1.784 3.940 1.00 . A A . 33 THR OG1 1 1 6 3432 1 1 34 CYS C C 0.768 4.939 4.396 1.00 . A A . 34 CYS C 1 1 6 3433 1 1 34 CYS CA C 1.535 4.044 3.420 1.00 . A A . 34 CYS CA 1 1 6 3434 1 1 34 CYS CB C 1.088 4.411 2.009 1.00 . A A . 34 CYS CB 1 1 6 3435 1 1 34 CYS H H 0.349 2.258 3.292 1.00 . A A . 34 CYS H 1 1 6 3436 1 1 34 CYS HA H 2.602 4.187 3.507 1.00 . A A . 34 CYS HA 1 1 6 3437 1 1 34 CYS HB2 H 1.337 3.616 1.327 1.00 . A A . 34 CYS HB2 1 1 6 3438 1 1 34 CYS HB3 H 0.021 4.541 2.007 1.00 . A A . 34 CYS HB3 1 1 6 3439 1 1 34 CYS N N 1.171 2.625 3.675 1.00 . A A . 34 CYS N 1 1 6 3440 1 1 34 CYS O O 1.067 6.107 4.548 1.00 . A A . 34 CYS O 1 1 6 3441 1 1 34 CYS SG S 1.893 5.955 1.517 1.00 . A A . 34 CYS SG 1 1 6 3442 1 1 35 GLU C C -1.871 6.210 5.275 1.00 . A A . 35 GLU C 1 1 6 3443 1 1 35 GLU CA C -1.029 5.180 6.016 1.00 . A A . 35 GLU CA 1 1 6 3444 1 1 35 GLU CB C -0.104 5.767 7.075 1.00 . A A . 35 GLU CB 1 1 6 3445 1 1 35 GLU CD C 1.780 4.686 8.340 1.00 . A A . 35 GLU CD 1 1 6 3446 1 1 35 GLU CG C 0.350 4.521 7.823 1.00 . A A . 35 GLU CG 1 1 6 3447 1 1 35 GLU H H -0.442 3.448 4.905 1.00 . A A . 35 GLU H 1 1 6 3448 1 1 35 GLU HA H -1.717 4.489 6.486 1.00 . A A . 35 GLU HA 1 1 6 3449 1 1 35 GLU HB2 H 0.725 6.288 6.614 1.00 . A A . 35 GLU HB2 1 1 6 3450 1 1 35 GLU HB3 H -0.641 6.407 7.758 1.00 . A A . 35 GLU HB3 1 1 6 3451 1 1 35 GLU HG2 H -0.337 4.336 8.636 1.00 . A A . 35 GLU HG2 1 1 6 3452 1 1 35 GLU HG3 H 0.304 3.696 7.124 1.00 . A A . 35 GLU HG3 1 1 6 3453 1 1 35 GLU N N -0.221 4.391 5.049 1.00 . A A . 35 GLU N 1 1 6 3454 1 1 35 GLU O O -2.181 7.290 5.739 1.00 . A A . 35 GLU O 1 1 6 3455 1 1 35 GLU OE1 O 2.331 5.760 8.166 1.00 . A A . 35 GLU OE1 1 1 6 3456 1 1 35 GLU OE2 O 2.300 3.736 8.902 1.00 . A A . 35 GLU OE2 1 1 6 3457 1 1 36 LEU C C -4.510 6.199 3.484 1.00 . A A . 36 LEU C 1 1 6 3458 1 1 36 LEU CA C -3.067 6.605 3.172 1.00 . A A . 36 LEU CA 1 1 6 3459 1 1 36 LEU CB C -2.709 6.201 1.743 1.00 . A A . 36 LEU CB 1 1 6 3460 1 1 36 LEU CD1 C -0.858 5.874 0.144 1.00 . A A . 36 LEU CD1 1 1 6 3461 1 1 36 LEU CD2 C -1.168 8.110 1.206 1.00 . A A . 36 LEU CD2 1 1 6 3462 1 1 36 LEU CG C -1.270 6.599 1.424 1.00 . A A . 36 LEU CG 1 1 6 3463 1 1 36 LEU H H -1.946 4.912 3.804 1.00 . A A . 36 LEU H 1 1 6 3464 1 1 36 LEU HA H -2.913 7.658 3.328 1.00 . A A . 36 LEU HA 1 1 6 3465 1 1 36 LEU HB2 H -2.799 5.136 1.692 1.00 . A A . 36 LEU HB2 1 1 6 3466 1 1 36 LEU HB3 H -3.375 6.618 1.008 1.00 . A A . 36 LEU HB3 1 1 6 3467 1 1 36 LEU HD11 H -1.605 6.037 -0.619 1.00 . A A . 36 LEU HD11 1 1 6 3468 1 1 36 LEU HD12 H 0.098 6.237 -0.206 1.00 . A A . 36 LEU HD12 1 1 6 3469 1 1 36 LEU HD13 H -0.801 4.820 0.361 1.00 . A A . 36 LEU HD13 1 1 6 3470 1 1 36 LEU HD21 H -1.811 8.402 0.389 1.00 . A A . 36 LEU HD21 1 1 6 3471 1 1 36 LEU HD22 H -1.470 8.625 2.107 1.00 . A A . 36 LEU HD22 1 1 6 3472 1 1 36 LEU HD23 H -0.146 8.369 0.969 1.00 . A A . 36 LEU HD23 1 1 6 3473 1 1 36 LEU HG H -0.632 6.285 2.238 1.00 . A A . 36 LEU HG 1 1 6 3474 1 1 36 LEU N N -2.232 5.800 4.094 1.00 . A A . 36 LEU N 1 1 6 3475 1 1 36 LEU O O -5.445 6.813 3.012 1.00 . A A . 36 LEU O 1 1 6 3476 1 1 37 CYS C C -6.107 3.525 5.473 1.00 . A A . 37 CYS C 1 1 6 3477 1 1 37 CYS CA C -6.114 4.770 4.585 1.00 . A A . 37 CYS CA 1 1 6 3478 1 1 37 CYS CB C -6.856 4.467 3.282 1.00 . A A . 37 CYS CB 1 1 6 3479 1 1 37 CYS H H -3.970 4.655 4.674 1.00 . A A . 37 CYS H 1 1 6 3480 1 1 37 CYS HA H -6.612 5.577 5.103 1.00 . A A . 37 CYS HA 1 1 6 3481 1 1 37 CYS HB2 H -6.392 5.005 2.469 1.00 . A A . 37 CYS HB2 1 1 6 3482 1 1 37 CYS HB3 H -6.815 3.406 3.083 1.00 . A A . 37 CYS HB3 1 1 6 3483 1 1 37 CYS N N -4.712 5.171 4.277 1.00 . A A . 37 CYS N 1 1 6 3484 1 1 37 CYS O O -5.166 2.755 5.374 1.00 . A A . 37 CYS O 1 1 6 3485 1 1 37 CYS OXT O -7.045 3.362 6.238 1.00 . A A . 37 CYS OXT 1 1 6 3486 1 1 37 CYS SG S -8.583 4.984 3.438 1.00 . A A . 37 CYS SG 1 1 7 3487 1 1 1 VAL C C -12.463 0.117 2.665 1.00 . A A . 1 VAL C 1 1 7 3488 1 1 1 VAL CA C -13.854 -0.206 3.212 1.00 . A A . 1 VAL CA 1 1 7 3489 1 1 1 VAL CB C -14.058 -1.722 3.214 1.00 . A A . 1 VAL CB 1 1 7 3490 1 1 1 VAL CG1 C -12.917 -2.394 3.982 1.00 . A A . 1 VAL CG1 1 1 7 3491 1 1 1 VAL CG2 C -15.389 -2.053 3.894 1.00 . A A . 1 VAL CG2 1 1 7 3492 1 1 1 VAL H1 H -14.416 0.984 1.601 1.00 . A A . 1 VAL H1 1 1 7 3493 1 1 1 VAL H2 H -15.482 -0.303 1.916 1.00 . A A . 1 VAL H2 1 1 7 3494 1 1 1 VAL H3 H -15.483 1.060 2.922 1.00 . A A . 1 VAL H3 1 1 7 3495 1 1 1 VAL HA H -13.943 0.171 4.221 1.00 . A A . 1 VAL HA 1 1 7 3496 1 1 1 VAL HB H -14.066 -2.084 2.196 1.00 . A A . 1 VAL HB 1 1 7 3497 1 1 1 VAL HG11 H -12.583 -1.740 4.774 1.00 . A A . 1 VAL HG11 1 1 7 3498 1 1 1 VAL HG12 H -13.268 -3.323 4.407 1.00 . A A . 1 VAL HG12 1 1 7 3499 1 1 1 VAL HG13 H -12.098 -2.593 3.308 1.00 . A A . 1 VAL HG13 1 1 7 3500 1 1 1 VAL HG21 H -15.553 -1.372 4.716 1.00 . A A . 1 VAL HG21 1 1 7 3501 1 1 1 VAL HG22 H -16.192 -1.955 3.178 1.00 . A A . 1 VAL HG22 1 1 7 3502 1 1 1 VAL HG23 H -15.361 -3.066 4.267 1.00 . A A . 1 VAL HG23 1 1 7 3503 1 1 1 VAL N N -14.886 0.432 2.347 1.00 . A A . 1 VAL N 1 1 7 3504 1 1 1 VAL O O -12.242 0.124 1.470 1.00 . A A . 1 VAL O 1 1 7 3505 1 1 2 CYS C C -9.146 -0.213 3.753 1.00 . A A . 2 CYS C 1 1 7 3506 1 1 2 CYS CA C -10.148 0.706 3.042 1.00 . A A . 2 CYS CA 1 1 7 3507 1 1 2 CYS CB C -9.832 2.166 3.375 1.00 . A A . 2 CYS CB 1 1 7 3508 1 1 2 CYS H H -11.713 0.376 4.488 1.00 . A A . 2 CYS H 1 1 7 3509 1 1 2 CYS HA H -10.129 0.562 1.971 1.00 . A A . 2 CYS HA 1 1 7 3510 1 1 2 CYS HB2 H -10.630 2.797 3.015 1.00 . A A . 2 CYS HB2 1 1 7 3511 1 1 2 CYS HB3 H -9.740 2.277 4.446 1.00 . A A . 2 CYS HB3 1 1 7 3512 1 1 2 CYS N N -11.520 0.385 3.527 1.00 . A A . 2 CYS N 1 1 7 3513 1 1 2 CYS O O -9.447 -0.688 4.831 1.00 . A A . 2 CYS O 1 1 7 3514 1 1 2 CYS SG S -8.279 2.651 2.582 1.00 . A A . 2 CYS SG 1 1 7 3515 1 1 3 ARG C C -6.075 -1.959 2.787 1.00 . A A . 3 ARG C 1 1 7 3516 1 1 3 ARG CA C -6.988 -1.363 3.860 1.00 . A A . 3 ARG CA 1 1 7 3517 1 1 3 ARG CB C -7.676 -2.523 4.582 1.00 . A A . 3 ARG CB 1 1 7 3518 1 1 3 ARG CD C -8.664 -4.490 3.388 1.00 . A A . 3 ARG CD 1 1 7 3519 1 1 3 ARG CG C -8.861 -3.016 3.748 1.00 . A A . 3 ARG CG 1 1 7 3520 1 1 3 ARG CZ C -9.566 -6.011 5.045 1.00 . A A . 3 ARG CZ 1 1 7 3521 1 1 3 ARG H H -7.752 -0.086 2.327 1.00 . A A . 3 ARG H 1 1 7 3522 1 1 3 ARG HA H -6.401 -0.790 4.561 1.00 . A A . 3 ARG HA 1 1 7 3523 1 1 3 ARG HB2 H -6.969 -3.327 4.721 1.00 . A A . 3 ARG HB2 1 1 7 3524 1 1 3 ARG HB3 H -8.035 -2.186 5.543 1.00 . A A . 3 ARG HB3 1 1 7 3525 1 1 3 ARG HD2 H -9.507 -4.836 2.808 1.00 . A A . 3 ARG HD2 1 1 7 3526 1 1 3 ARG HD3 H -7.760 -4.601 2.807 1.00 . A A . 3 ARG HD3 1 1 7 3527 1 1 3 ARG HE H -7.721 -5.285 5.153 1.00 . A A . 3 ARG HE 1 1 7 3528 1 1 3 ARG HG2 H -9.772 -2.900 4.317 1.00 . A A . 3 ARG HG2 1 1 7 3529 1 1 3 ARG HG3 H -8.927 -2.434 2.840 1.00 . A A . 3 ARG HG3 1 1 7 3530 1 1 3 ARG HH11 H -10.945 -4.792 4.258 1.00 . A A . 3 ARG HH11 1 1 7 3531 1 1 3 ARG HH12 H -11.560 -6.182 5.089 1.00 . A A . 3 ARG HH12 1 1 7 3532 1 1 3 ARG HH21 H -8.422 -7.397 5.928 1.00 . A A . 3 ARG HH21 1 1 7 3533 1 1 3 ARG HH22 H -10.132 -7.657 6.035 1.00 . A A . 3 ARG HH22 1 1 7 3534 1 1 3 ARG N N -7.987 -0.474 3.196 1.00 . A A . 3 ARG N 1 1 7 3535 1 1 3 ARG NE N -8.553 -5.294 4.637 1.00 . A A . 3 ARG NE 1 1 7 3536 1 1 3 ARG NH1 N -10.786 -5.632 4.776 1.00 . A A . 3 ARG NH1 1 1 7 3537 1 1 3 ARG NH2 N -9.357 -7.106 5.722 1.00 . A A . 3 ARG NH2 1 1 7 3538 1 1 3 ARG O O -6.317 -1.809 1.605 1.00 . A A . 3 ARG O 1 1 7 3539 1 1 4 ASP C C -4.982 -4.063 1.204 1.00 . A A . 4 ASP C 1 1 7 3540 1 1 4 ASP CA C -4.123 -3.231 2.158 1.00 . A A . 4 ASP CA 1 1 7 3541 1 1 4 ASP CB C -3.096 -4.134 2.845 1.00 . A A . 4 ASP CB 1 1 7 3542 1 1 4 ASP CG C -3.817 -5.148 3.736 1.00 . A A . 4 ASP CG 1 1 7 3543 1 1 4 ASP H H -4.846 -2.753 4.134 1.00 . A A . 4 ASP H 1 1 7 3544 1 1 4 ASP HA H -3.625 -2.445 1.611 1.00 . A A . 4 ASP HA 1 1 7 3545 1 1 4 ASP HB2 H -2.519 -4.656 2.095 1.00 . A A . 4 ASP HB2 1 1 7 3546 1 1 4 ASP HB3 H -2.438 -3.533 3.453 1.00 . A A . 4 ASP HB3 1 1 7 3547 1 1 4 ASP N N -5.030 -2.636 3.179 1.00 . A A . 4 ASP N 1 1 7 3548 1 1 4 ASP O O -6.150 -4.279 1.457 1.00 . A A . 4 ASP O 1 1 7 3549 1 1 4 ASP OD1 O -4.535 -5.974 3.197 1.00 . A A . 4 ASP OD1 1 1 7 3550 1 1 4 ASP OD2 O -3.639 -5.080 4.940 1.00 . A A . 4 ASP OD2 1 1 7 3551 1 1 5 TRP C C -4.477 -6.471 -1.427 1.00 . A A . 5 TRP C 1 1 7 3552 1 1 5 TRP CA C -5.300 -5.346 -0.799 1.00 . A A . 5 TRP CA 1 1 7 3553 1 1 5 TRP CB C -5.871 -4.462 -1.907 1.00 . A A . 5 TRP CB 1 1 7 3554 1 1 5 TRP CD1 C -7.458 -2.680 -1.109 1.00 . A A . 5 TRP CD1 1 1 7 3555 1 1 5 TRP CD2 C -8.444 -4.691 -1.264 1.00 . A A . 5 TRP CD2 1 1 7 3556 1 1 5 TRP CE2 C -9.436 -3.786 -0.809 1.00 . A A . 5 TRP CE2 1 1 7 3557 1 1 5 TRP CE3 C -8.804 -6.035 -1.446 1.00 . A A . 5 TRP CE3 1 1 7 3558 1 1 5 TRP CG C -7.199 -3.959 -1.447 1.00 . A A . 5 TRP CG 1 1 7 3559 1 1 5 TRP CH2 C -11.080 -5.552 -0.735 1.00 . A A . 5 TRP CH2 1 1 7 3560 1 1 5 TRP CZ2 C -10.743 -4.207 -0.546 1.00 . A A . 5 TRP CZ2 1 1 7 3561 1 1 5 TRP CZ3 C -10.113 -6.461 -1.183 1.00 . A A . 5 TRP CZ3 1 1 7 3562 1 1 5 TRP H H -3.499 -4.371 -0.100 1.00 . A A . 5 TRP H 1 1 7 3563 1 1 5 TRP HA H -6.125 -5.770 -0.229 1.00 . A A . 5 TRP HA 1 1 7 3564 1 1 5 TRP HB2 H -5.204 -3.634 -2.094 1.00 . A A . 5 TRP HB2 1 1 7 3565 1 1 5 TRP HB3 H -6.000 -5.042 -2.808 1.00 . A A . 5 TRP HB3 1 1 7 3566 1 1 5 TRP HD1 H -6.737 -1.880 -1.135 1.00 . A A . 5 TRP HD1 1 1 7 3567 1 1 5 TRP HE1 H -9.223 -1.745 -0.441 1.00 . A A . 5 TRP HE1 1 1 7 3568 1 1 5 TRP HE3 H -8.064 -6.741 -1.792 1.00 . A A . 5 TRP HE3 1 1 7 3569 1 1 5 TRP HH2 H -12.086 -5.890 -0.534 1.00 . A A . 5 TRP HH2 1 1 7 3570 1 1 5 TRP HZ2 H -11.484 -3.502 -0.200 1.00 . A A . 5 TRP HZ2 1 1 7 3571 1 1 5 TRP HZ3 H -10.378 -7.498 -1.326 1.00 . A A . 5 TRP HZ3 1 1 7 3572 1 1 5 TRP N N -4.444 -4.538 0.115 1.00 . A A . 5 TRP N 1 1 7 3573 1 1 5 TRP NE1 N -8.783 -2.571 -0.731 1.00 . A A . 5 TRP NE1 1 1 7 3574 1 1 5 TRP O O -5.037 -7.472 -1.829 1.00 . A A . 5 TRP O 1 1 7 3575 1 1 6 PHE C C -2.198 -8.473 -1.004 1.00 . A A . 6 PHE C 1 1 7 3576 1 1 6 PHE CA C -2.456 -7.503 -2.151 1.00 . A A . 6 PHE CA 1 1 7 3577 1 1 6 PHE CB C -1.134 -6.980 -2.702 1.00 . A A . 6 PHE CB 1 1 7 3578 1 1 6 PHE CD1 C -2.372 -6.252 -4.764 1.00 . A A . 6 PHE CD1 1 1 7 3579 1 1 6 PHE CD2 C -0.885 -4.686 -3.672 1.00 . A A . 6 PHE CD2 1 1 7 3580 1 1 6 PHE CE1 C -2.686 -5.289 -5.723 1.00 . A A . 6 PHE CE1 1 1 7 3581 1 1 6 PHE CE2 C -1.194 -3.722 -4.625 1.00 . A A . 6 PHE CE2 1 1 7 3582 1 1 6 PHE CG C -1.472 -5.948 -3.741 1.00 . A A . 6 PHE CG 1 1 7 3583 1 1 6 PHE CZ C -2.093 -4.028 -5.646 1.00 . A A . 6 PHE CZ 1 1 7 3584 1 1 6 PHE H H -2.653 -5.594 -1.232 1.00 . A A . 6 PHE H 1 1 7 3585 1 1 6 PHE HA H -3.062 -7.931 -2.932 1.00 . A A . 6 PHE HA 1 1 7 3586 1 1 6 PHE HB2 H -0.555 -6.530 -1.908 1.00 . A A . 6 PHE HB2 1 1 7 3587 1 1 6 PHE HB3 H -0.582 -7.779 -3.163 1.00 . A A . 6 PHE HB3 1 1 7 3588 1 1 6 PHE HD1 H -2.823 -7.227 -4.813 1.00 . A A . 6 PHE HD1 1 1 7 3589 1 1 6 PHE HD2 H -0.193 -4.456 -2.887 1.00 . A A . 6 PHE HD2 1 1 7 3590 1 1 6 PHE HE1 H -3.382 -5.518 -6.517 1.00 . A A . 6 PHE HE1 1 1 7 3591 1 1 6 PHE HE2 H -0.737 -2.748 -4.564 1.00 . A A . 6 PHE HE2 1 1 7 3592 1 1 6 PHE HZ H -2.329 -3.285 -6.379 1.00 . A A . 6 PHE HZ 1 1 7 3593 1 1 6 PHE N N -3.176 -6.368 -1.533 1.00 . A A . 6 PHE N 1 1 7 3594 1 1 6 PHE O O -3.053 -8.669 -0.162 1.00 . A A . 6 PHE O 1 1 7 3595 1 1 7 LYS C C -0.380 -9.269 1.458 1.00 . A A . 7 LYS C 1 1 7 3596 1 1 7 LYS CA C -0.866 -10.021 0.214 1.00 . A A . 7 LYS CA 1 1 7 3597 1 1 7 LYS CB C 0.146 -11.103 -0.164 1.00 . A A . 7 LYS CB 1 1 7 3598 1 1 7 LYS CD C -0.978 -12.835 -1.574 1.00 . A A . 7 LYS CD 1 1 7 3599 1 1 7 LYS CE C -0.986 -14.356 -1.738 1.00 . A A . 7 LYS CE 1 1 7 3600 1 1 7 LYS CG C -0.533 -12.474 -0.154 1.00 . A A . 7 LYS CG 1 1 7 3601 1 1 7 LYS H H -0.360 -8.932 -1.613 1.00 . A A . 7 LYS H 1 1 7 3602 1 1 7 LYS HA H -1.811 -10.484 0.444 1.00 . A A . 7 LYS HA 1 1 7 3603 1 1 7 LYS HB2 H 0.538 -10.895 -1.149 1.00 . A A . 7 LYS HB2 1 1 7 3604 1 1 7 LYS HB3 H 0.955 -11.102 0.551 1.00 . A A . 7 LYS HB3 1 1 7 3605 1 1 7 LYS HD2 H -1.971 -12.446 -1.747 1.00 . A A . 7 LYS HD2 1 1 7 3606 1 1 7 LYS HD3 H -0.291 -12.405 -2.287 1.00 . A A . 7 LYS HD3 1 1 7 3607 1 1 7 LYS HE2 H -1.297 -14.816 -0.812 1.00 . A A . 7 LYS HE2 1 1 7 3608 1 1 7 LYS HE3 H -1.673 -14.630 -2.524 1.00 . A A . 7 LYS HE3 1 1 7 3609 1 1 7 LYS HG2 H 0.163 -13.217 0.208 1.00 . A A . 7 LYS HG2 1 1 7 3610 1 1 7 LYS HG3 H -1.398 -12.444 0.491 1.00 . A A . 7 LYS HG3 1 1 7 3611 1 1 7 LYS HZ1 H 0.820 -14.151 -2.750 1.00 . A A . 7 LYS HZ1 1 1 7 3612 1 1 7 LYS HZ2 H 0.963 -14.890 -1.226 1.00 . A A . 7 LYS HZ2 1 1 7 3613 1 1 7 LYS HZ3 H 0.329 -15.764 -2.531 1.00 . A A . 7 LYS HZ3 1 1 7 3614 1 1 7 LYS N N -1.056 -9.087 -0.934 1.00 . A A . 7 LYS N 1 1 7 3615 1 1 7 LYS NZ N 0.385 -14.826 -2.088 1.00 . A A . 7 LYS NZ 1 1 7 3616 1 1 7 LYS O O 0.356 -9.817 2.254 1.00 . A A . 7 LYS O 1 1 7 3617 1 1 8 GLU C C 1.143 -6.859 2.809 1.00 . A A . 8 GLU C 1 1 7 3618 1 1 8 GLU CA C -0.344 -7.230 2.832 1.00 . A A . 8 GLU CA 1 1 7 3619 1 1 8 GLU CB C -0.718 -8.031 4.074 1.00 . A A . 8 GLU CB 1 1 7 3620 1 1 8 GLU CD C -2.401 -7.967 5.922 1.00 . A A . 8 GLU CD 1 1 7 3621 1 1 8 GLU CG C -1.431 -7.130 5.083 1.00 . A A . 8 GLU CG 1 1 7 3622 1 1 8 GLU H H -1.363 -7.616 1.002 1.00 . A A . 8 GLU H 1 1 7 3623 1 1 8 GLU HA H -0.893 -6.299 2.853 1.00 . A A . 8 GLU HA 1 1 7 3624 1 1 8 GLU HB2 H -1.382 -8.821 3.756 1.00 . A A . 8 GLU HB2 1 1 7 3625 1 1 8 GLU HB3 H 0.171 -8.453 4.519 1.00 . A A . 8 GLU HB3 1 1 7 3626 1 1 8 GLU HG2 H -0.702 -6.664 5.729 1.00 . A A . 8 GLU HG2 1 1 7 3627 1 1 8 GLU HG3 H -1.985 -6.370 4.554 1.00 . A A . 8 GLU HG3 1 1 7 3628 1 1 8 GLU N N -0.770 -8.035 1.648 1.00 . A A . 8 GLU N 1 1 7 3629 1 1 8 GLU O O 1.530 -5.888 3.428 1.00 . A A . 8 GLU O 1 1 7 3630 1 1 8 GLU OE1 O -2.741 -9.055 5.489 1.00 . A A . 8 GLU OE1 1 1 7 3631 1 1 8 GLU OE2 O -2.788 -7.503 6.981 1.00 . A A . 8 GLU OE2 1 1 7 3632 1 1 9 THR C C 3.677 -6.420 0.834 1.00 . A A . 9 THR C 1 1 7 3633 1 1 9 THR CA C 3.427 -7.204 2.117 1.00 . A A . 9 THR CA 1 1 7 3634 1 1 9 THR CB C 4.211 -8.505 2.240 1.00 . A A . 9 THR CB 1 1 7 3635 1 1 9 THR CG2 C 3.892 -9.013 3.646 1.00 . A A . 9 THR CG2 1 1 7 3636 1 1 9 THR H H 1.724 -8.360 1.622 1.00 . A A . 9 THR H 1 1 7 3637 1 1 9 THR HA H 3.628 -6.561 2.963 1.00 . A A . 9 THR HA 1 1 7 3638 1 1 9 THR HB H 5.268 -8.325 2.165 1.00 . A A . 9 THR HB 1 1 7 3639 1 1 9 THR HG1 H 4.549 -9.778 0.808 1.00 . A A . 9 THR HG1 1 1 7 3640 1 1 9 THR HG21 H 3.197 -8.321 4.109 1.00 . A A . 9 THR HG21 1 1 7 3641 1 1 9 THR HG22 H 3.436 -9.989 3.584 1.00 . A A . 9 THR HG22 1 1 7 3642 1 1 9 THR HG23 H 4.798 -9.061 4.232 1.00 . A A . 9 THR HG23 1 1 7 3643 1 1 9 THR N N 1.995 -7.576 2.131 1.00 . A A . 9 THR N 1 1 7 3644 1 1 9 THR O O 4.516 -5.548 0.817 1.00 . A A . 9 THR O 1 1 7 3645 1 1 9 THR OG1 O 3.772 -9.414 1.238 1.00 . A A . 9 THR OG1 1 1 7 3646 1 1 10 ALA C C 3.090 -4.508 -1.042 1.00 . A A . 10 ALA C 1 1 7 3647 1 1 10 ALA CA C 3.143 -5.968 -1.488 1.00 . A A . 10 ALA CA 1 1 7 3648 1 1 10 ALA CB C 1.950 -6.190 -2.424 1.00 . A A . 10 ALA CB 1 1 7 3649 1 1 10 ALA H H 2.278 -7.426 -0.149 1.00 . A A . 10 ALA H 1 1 7 3650 1 1 10 ALA HA H 4.088 -6.193 -1.962 1.00 . A A . 10 ALA HA 1 1 7 3651 1 1 10 ALA HB1 H 1.712 -7.242 -2.479 1.00 . A A . 10 ALA HB1 1 1 7 3652 1 1 10 ALA HB2 H 1.090 -5.649 -2.048 1.00 . A A . 10 ALA HB2 1 1 7 3653 1 1 10 ALA HB3 H 2.188 -5.819 -3.410 1.00 . A A . 10 ALA HB3 1 1 7 3654 1 1 10 ALA N N 2.951 -6.718 -0.212 1.00 . A A . 10 ALA N 1 1 7 3655 1 1 10 ALA O O 3.801 -3.641 -1.507 1.00 . A A . 10 ALA O 1 1 7 3656 1 1 11 CYS C C 3.259 -2.449 1.143 1.00 . A A . 11 CYS C 1 1 7 3657 1 1 11 CYS CA C 1.965 -2.952 0.490 1.00 . A A . 11 CYS CA 1 1 7 3658 1 1 11 CYS CB C 0.813 -3.179 1.477 1.00 . A A . 11 CYS CB 1 1 7 3659 1 1 11 CYS H H 1.660 -5.028 0.227 1.00 . A A . 11 CYS H 1 1 7 3660 1 1 11 CYS HA H 1.657 -2.259 -0.276 1.00 . A A . 11 CYS HA 1 1 7 3661 1 1 11 CYS HB2 H 1.105 -3.858 2.267 1.00 . A A . 11 CYS HB2 1 1 7 3662 1 1 11 CYS HB3 H 0.481 -2.241 1.890 1.00 . A A . 11 CYS HB3 1 1 7 3663 1 1 11 CYS N N 2.205 -4.288 -0.109 1.00 . A A . 11 CYS N 1 1 7 3664 1 1 11 CYS O O 3.838 -1.471 0.714 1.00 . A A . 11 CYS O 1 1 7 3665 1 1 11 CYS SG S -0.568 -3.929 0.579 1.00 . A A . 11 CYS SG 1 1 7 3666 1 1 12 ARG C C 6.076 -2.455 1.867 1.00 . A A . 12 ARG C 1 1 7 3667 1 1 12 ARG CA C 4.963 -2.710 2.880 1.00 . A A . 12 ARG CA 1 1 7 3668 1 1 12 ARG CB C 5.350 -3.828 3.849 1.00 . A A . 12 ARG CB 1 1 7 3669 1 1 12 ARG CD C 7.225 -4.364 5.406 1.00 . A A . 12 ARG CD 1 1 7 3670 1 1 12 ARG CG C 6.870 -3.877 4.000 1.00 . A A . 12 ARG CG 1 1 7 3671 1 1 12 ARG CZ C 8.981 -5.781 6.286 1.00 . A A . 12 ARG CZ 1 1 7 3672 1 1 12 ARG H H 3.219 -3.892 2.483 1.00 . A A . 12 ARG H 1 1 7 3673 1 1 12 ARG HA H 4.817 -1.795 3.430 1.00 . A A . 12 ARG HA 1 1 7 3674 1 1 12 ARG HB2 H 4.896 -3.641 4.810 1.00 . A A . 12 ARG HB2 1 1 7 3675 1 1 12 ARG HB3 H 5.002 -4.775 3.463 1.00 . A A . 12 ARG HB3 1 1 7 3676 1 1 12 ARG HD2 H 7.129 -3.546 6.105 1.00 . A A . 12 ARG HD2 1 1 7 3677 1 1 12 ARG HD3 H 6.553 -5.160 5.690 1.00 . A A . 12 ARG HD3 1 1 7 3678 1 1 12 ARG HE H 9.284 -4.511 4.788 1.00 . A A . 12 ARG HE 1 1 7 3679 1 1 12 ARG HG2 H 7.274 -4.553 3.261 1.00 . A A . 12 ARG HG2 1 1 7 3680 1 1 12 ARG HG3 H 7.276 -2.888 3.851 1.00 . A A . 12 ARG HG3 1 1 7 3681 1 1 12 ARG HH11 H 9.446 -4.466 7.722 1.00 . A A . 12 ARG HH11 1 1 7 3682 1 1 12 ARG HH12 H 9.667 -6.134 8.133 1.00 . A A . 12 ARG HH12 1 1 7 3683 1 1 12 ARG HH21 H 8.598 -7.310 5.052 1.00 . A A . 12 ARG HH21 1 1 7 3684 1 1 12 ARG HH22 H 9.187 -7.743 6.621 1.00 . A A . 12 ARG HH22 1 1 7 3685 1 1 12 ARG N N 3.712 -3.111 2.171 1.00 . A A . 12 ARG N 1 1 7 3686 1 1 12 ARG NE N 8.628 -4.866 5.423 1.00 . A A . 12 ARG NE 1 1 7 3687 1 1 12 ARG NH1 N 9.397 -5.433 7.472 1.00 . A A . 12 ARG NH1 1 1 7 3688 1 1 12 ARG NH2 N 8.917 -7.043 5.961 1.00 . A A . 12 ARG NH2 1 1 7 3689 1 1 12 ARG O O 7.004 -1.717 2.128 1.00 . A A . 12 ARG O 1 1 7 3690 1 1 13 HIS C C 6.953 -1.280 -0.490 1.00 . A A . 13 HIS C 1 1 7 3691 1 1 13 HIS CA C 7.086 -2.780 -0.265 1.00 . A A . 13 HIS CA 1 1 7 3692 1 1 13 HIS CB C 6.818 -3.536 -1.569 1.00 . A A . 13 HIS CB 1 1 7 3693 1 1 13 HIS CD2 C 9.136 -4.779 -1.597 1.00 . A A . 13 HIS CD2 1 1 7 3694 1 1 13 HIS CE1 C 9.702 -4.334 -3.642 1.00 . A A . 13 HIS CE1 1 1 7 3695 1 1 13 HIS CG C 8.119 -4.031 -2.141 1.00 . A A . 13 HIS CG 1 1 7 3696 1 1 13 HIS H H 5.256 -3.634 0.486 1.00 . A A . 13 HIS H 1 1 7 3697 1 1 13 HIS HA H 8.050 -3.018 0.164 1.00 . A A . 13 HIS HA 1 1 7 3698 1 1 13 HIS HB2 H 6.170 -4.377 -1.371 1.00 . A A . 13 HIS HB2 1 1 7 3699 1 1 13 HIS HB3 H 6.344 -2.874 -2.279 1.00 . A A . 13 HIS HB3 1 1 7 3700 1 1 13 HIS HD1 H 7.994 -3.242 -4.102 1.00 . A A . 13 HIS HD1 1 1 7 3701 1 1 13 HIS HD2 H 9.156 -5.161 -0.588 1.00 . A A . 13 HIS HD2 1 1 7 3702 1 1 13 HIS HE1 H 10.248 -4.288 -4.572 1.00 . A A . 13 HIS HE1 1 1 7 3703 1 1 13 HIS N N 6.001 -3.044 0.710 1.00 . A A . 13 HIS N 1 1 7 3704 1 1 13 HIS ND1 N 8.504 -3.759 -3.443 1.00 . A A . 13 HIS ND1 1 1 7 3705 1 1 13 HIS NE2 N 10.135 -4.969 -2.550 1.00 . A A . 13 HIS NE2 1 1 7 3706 1 1 13 HIS O O 7.818 -0.507 -0.142 1.00 . A A . 13 HIS O 1 1 7 3707 1 1 14 ALA C C 5.836 1.427 -0.129 1.00 . A A . 14 ALA C 1 1 7 3708 1 1 14 ALA CA C 5.575 0.540 -1.352 1.00 . A A . 14 ALA CA 1 1 7 3709 1 1 14 ALA CB C 4.112 0.668 -1.777 1.00 . A A . 14 ALA CB 1 1 7 3710 1 1 14 ALA H H 5.185 -1.579 -1.323 1.00 . A A . 14 ALA H 1 1 7 3711 1 1 14 ALA HA H 6.196 0.884 -2.165 1.00 . A A . 14 ALA HA 1 1 7 3712 1 1 14 ALA HB1 H 3.635 -0.299 -1.693 1.00 . A A . 14 ALA HB1 1 1 7 3713 1 1 14 ALA HB2 H 3.614 1.371 -1.125 1.00 . A A . 14 ALA HB2 1 1 7 3714 1 1 14 ALA HB3 H 4.058 1.013 -2.801 1.00 . A A . 14 ALA HB3 1 1 7 3715 1 1 14 ALA N N 5.850 -0.899 -1.070 1.00 . A A . 14 ALA N 1 1 7 3716 1 1 14 ALA O O 6.209 2.573 -0.282 1.00 . A A . 14 ALA O 1 1 7 3717 1 1 15 LYS C C 7.439 2.017 2.449 1.00 . A A . 15 LYS C 1 1 7 3718 1 1 15 LYS CA C 5.926 1.860 2.234 1.00 . A A . 15 LYS CA 1 1 7 3719 1 1 15 LYS CB C 5.264 1.264 3.482 1.00 . A A . 15 LYS CB 1 1 7 3720 1 1 15 LYS CD C 6.151 3.215 4.795 1.00 . A A . 15 LYS CD 1 1 7 3721 1 1 15 LYS CE C 5.460 3.709 6.068 1.00 . A A . 15 LYS CE 1 1 7 3722 1 1 15 LYS CG C 6.060 1.689 4.713 1.00 . A A . 15 LYS CG 1 1 7 3723 1 1 15 LYS H H 5.362 0.044 1.242 1.00 . A A . 15 LYS H 1 1 7 3724 1 1 15 LYS HA H 5.485 2.835 2.041 1.00 . A A . 15 LYS HA 1 1 7 3725 1 1 15 LYS HB2 H 4.242 1.610 3.573 1.00 . A A . 15 LYS HB2 1 1 7 3726 1 1 15 LYS HB3 H 5.274 0.187 3.425 1.00 . A A . 15 LYS HB3 1 1 7 3727 1 1 15 LYS HD2 H 7.190 3.511 4.816 1.00 . A A . 15 LYS HD2 1 1 7 3728 1 1 15 LYS HD3 H 5.666 3.653 3.937 1.00 . A A . 15 LYS HD3 1 1 7 3729 1 1 15 LYS HE2 H 5.281 4.771 5.991 1.00 . A A . 15 LYS HE2 1 1 7 3730 1 1 15 LYS HE3 H 4.519 3.194 6.192 1.00 . A A . 15 LYS HE3 1 1 7 3731 1 1 15 LYS HG2 H 5.575 1.300 5.595 1.00 . A A . 15 LYS HG2 1 1 7 3732 1 1 15 LYS HG3 H 7.051 1.273 4.629 1.00 . A A . 15 LYS HG3 1 1 7 3733 1 1 15 LYS HZ1 H 7.254 3.080 6.916 1.00 . A A . 15 LYS HZ1 1 1 7 3734 1 1 15 LYS HZ2 H 6.472 4.315 7.785 1.00 . A A . 15 LYS HZ2 1 1 7 3735 1 1 15 LYS HZ3 H 5.882 2.730 7.858 1.00 . A A . 15 LYS HZ3 1 1 7 3736 1 1 15 LYS N N 5.661 0.962 1.079 1.00 . A A . 15 LYS N 1 1 7 3737 1 1 15 LYS NZ N 6.334 3.438 7.245 1.00 . A A . 15 LYS NZ 1 1 7 3738 1 1 15 LYS O O 7.869 3.069 2.876 1.00 . A A . 15 LYS O 1 1 7 3739 1 1 16 SER C C 10.531 1.688 1.184 1.00 . A A . 16 SER C 1 1 7 3740 1 1 16 SER CA C 9.734 1.300 2.435 1.00 . A A . 16 SER CA 1 1 7 3741 1 1 16 SER CB C 10.369 0.077 3.096 1.00 . A A . 16 SER CB 1 1 7 3742 1 1 16 SER H H 8.001 0.168 1.841 1.00 . A A . 16 SER H 1 1 7 3743 1 1 16 SER HA H 9.808 2.121 3.127 1.00 . A A . 16 SER HA 1 1 7 3744 1 1 16 SER HB2 H 9.635 -0.704 3.210 1.00 . A A . 16 SER HB2 1 1 7 3745 1 1 16 SER HB3 H 11.174 -0.286 2.471 1.00 . A A . 16 SER HB3 1 1 7 3746 1 1 16 SER HG H 11.723 0.070 4.493 1.00 . A A . 16 SER HG 1 1 7 3747 1 1 16 SER N N 8.284 1.045 2.186 1.00 . A A . 16 SER N 1 1 7 3748 1 1 16 SER O O 11.635 2.182 1.302 1.00 . A A . 16 SER O 1 1 7 3749 1 1 16 SER OG O 10.847 0.445 4.383 1.00 . A A . 16 SER OG 1 1 7 3750 1 1 17 LEU C C 10.542 3.360 -1.464 1.00 . A A . 17 LEU C 1 1 7 3751 1 1 17 LEU CA C 10.839 1.893 -1.191 1.00 . A A . 17 LEU CA 1 1 7 3752 1 1 17 LEU CB C 10.364 1.226 -2.474 1.00 . A A . 17 LEU CB 1 1 7 3753 1 1 17 LEU CD1 C 8.353 0.081 -2.580 1.00 . A A . 17 LEU CD1 1 1 7 3754 1 1 17 LEU CD2 C 10.467 -1.122 -3.225 1.00 . A A . 17 LEU CD2 1 1 7 3755 1 1 17 LEU CG C 9.811 -0.164 -2.232 1.00 . A A . 17 LEU CG 1 1 7 3756 1 1 17 LEU H H 9.143 1.104 -0.115 1.00 . A A . 17 LEU H 1 1 7 3757 1 1 17 LEU HA H 11.891 1.704 -1.044 1.00 . A A . 17 LEU HA 1 1 7 3758 1 1 17 LEU HB2 H 9.537 1.813 -2.859 1.00 . A A . 17 LEU HB2 1 1 7 3759 1 1 17 LEU HB3 H 11.162 1.179 -3.199 1.00 . A A . 17 LEU HB3 1 1 7 3760 1 1 17 LEU HD11 H 8.316 0.592 -3.530 1.00 . A A . 17 LEU HD11 1 1 7 3761 1 1 17 LEU HD12 H 7.785 -0.838 -2.631 1.00 . A A . 17 LEU HD12 1 1 7 3762 1 1 17 LEU HD13 H 7.980 0.750 -1.821 1.00 . A A . 17 LEU HD13 1 1 7 3763 1 1 17 LEU HD21 H 11.478 -0.783 -3.402 1.00 . A A . 17 LEU HD21 1 1 7 3764 1 1 17 LEU HD22 H 10.486 -2.119 -2.808 1.00 . A A . 17 LEU HD22 1 1 7 3765 1 1 17 LEU HD23 H 9.911 -1.116 -4.150 1.00 . A A . 17 LEU HD23 1 1 7 3766 1 1 17 LEU HG H 9.924 -0.453 -1.195 1.00 . A A . 17 LEU HG 1 1 7 3767 1 1 17 LEU N N 10.031 1.497 -0.003 1.00 . A A . 17 LEU N 1 1 7 3768 1 1 17 LEU O O 11.405 4.213 -1.527 1.00 . A A . 17 LEU O 1 1 7 3769 1 1 18 GLY C C 7.488 5.038 -2.620 1.00 . A A . 18 GLY C 1 1 7 3770 1 1 18 GLY CA C 8.841 5.008 -1.906 1.00 . A A . 18 GLY CA 1 1 7 3771 1 1 18 GLY H H 8.614 2.894 -1.569 1.00 . A A . 18 GLY H 1 1 7 3772 1 1 18 GLY HA2 H 8.766 5.537 -0.971 1.00 . A A . 18 GLY HA2 1 1 7 3773 1 1 18 GLY HA3 H 9.584 5.465 -2.538 1.00 . A A . 18 GLY HA3 1 1 7 3774 1 1 18 GLY N N 9.274 3.618 -1.629 1.00 . A A . 18 GLY N 1 1 7 3775 1 1 18 GLY O O 6.753 5.998 -2.503 1.00 . A A . 18 GLY O 1 1 7 3776 1 1 19 ASN C C 4.628 4.369 -3.158 1.00 . A A . 19 ASN C 1 1 7 3777 1 1 19 ASN CA C 5.822 4.046 -4.058 1.00 . A A . 19 ASN CA 1 1 7 3778 1 1 19 ASN CB C 5.423 2.709 -4.666 1.00 . A A . 19 ASN CB 1 1 7 3779 1 1 19 ASN CG C 6.506 1.637 -4.809 1.00 . A A . 19 ASN CG 1 1 7 3780 1 1 19 ASN H H 7.710 3.240 -3.472 1.00 . A A . 19 ASN H 1 1 7 3781 1 1 19 ASN HA H 5.876 4.759 -4.866 1.00 . A A . 19 ASN HA 1 1 7 3782 1 1 19 ASN HB2 H 4.606 2.296 -4.102 1.00 . A A . 19 ASN HB2 1 1 7 3783 1 1 19 ASN HB3 H 5.027 2.936 -5.633 1.00 . A A . 19 ASN HB3 1 1 7 3784 1 1 19 ASN HD21 H 5.427 0.278 -3.843 1.00 . A A . 19 ASN HD21 1 1 7 3785 1 1 19 ASN HD22 H 6.929 -0.265 -4.390 1.00 . A A . 19 ASN HD22 1 1 7 3786 1 1 19 ASN N N 7.134 4.021 -3.360 1.00 . A A . 19 ASN N 1 1 7 3787 1 1 19 ASN ND2 N 6.272 0.455 -4.304 1.00 . A A . 19 ASN ND2 1 1 7 3788 1 1 19 ASN O O 3.560 4.584 -3.694 1.00 . A A . 19 ASN O 1 1 7 3789 1 1 19 ASN OD1 O 7.556 1.871 -5.375 1.00 . A A . 19 ASN OD1 1 1 7 3790 1 1 20 CYS C C 2.665 5.708 -1.590 1.00 . A A . 20 CYS C 1 1 7 3791 1 1 20 CYS CA C 3.628 4.704 -0.952 1.00 . A A . 20 CYS CA 1 1 7 3792 1 1 20 CYS CB C 4.157 5.293 0.353 1.00 . A A . 20 CYS CB 1 1 7 3793 1 1 20 CYS H H 5.647 4.213 -1.465 1.00 . A A . 20 CYS H 1 1 7 3794 1 1 20 CYS HA H 3.096 3.792 -0.729 1.00 . A A . 20 CYS HA 1 1 7 3795 1 1 20 CYS HB2 H 4.298 4.504 1.078 1.00 . A A . 20 CYS HB2 1 1 7 3796 1 1 20 CYS HB3 H 5.093 5.800 0.174 1.00 . A A . 20 CYS HB3 1 1 7 3797 1 1 20 CYS N N 4.773 4.399 -1.859 1.00 . A A . 20 CYS N 1 1 7 3798 1 1 20 CYS O O 1.469 5.654 -1.395 1.00 . A A . 20 CYS O 1 1 7 3799 1 1 20 CYS SG S 2.938 6.481 0.963 1.00 . A A . 20 CYS SG 1 1 7 3800 1 1 21 ARG C C 2.550 7.851 -4.483 1.00 . A A . 21 ARG C 1 1 7 3801 1 1 21 ARG CA C 2.276 7.630 -2.993 1.00 . A A . 21 ARG CA 1 1 7 3802 1 1 21 ARG CB C 2.487 8.961 -2.293 1.00 . A A . 21 ARG CB 1 1 7 3803 1 1 21 ARG CD C 0.631 10.545 -1.746 1.00 . A A . 21 ARG CD 1 1 7 3804 1 1 21 ARG CG C 1.301 9.224 -1.363 1.00 . A A . 21 ARG CG 1 1 7 3805 1 1 21 ARG CZ C 0.818 12.747 -0.754 1.00 . A A . 21 ARG CZ 1 1 7 3806 1 1 21 ARG H H 4.149 6.659 -2.494 1.00 . A A . 21 ARG H 1 1 7 3807 1 1 21 ARG HA H 1.247 7.349 -2.846 1.00 . A A . 21 ARG HA 1 1 7 3808 1 1 21 ARG HB2 H 3.416 8.896 -1.747 1.00 . A A . 21 ARG HB2 1 1 7 3809 1 1 21 ARG HB3 H 2.555 9.734 -3.041 1.00 . A A . 21 ARG HB3 1 1 7 3810 1 1 21 ARG HD2 H 0.579 10.624 -2.822 1.00 . A A . 21 ARG HD2 1 1 7 3811 1 1 21 ARG HD3 H -0.368 10.574 -1.334 1.00 . A A . 21 ARG HD3 1 1 7 3812 1 1 21 ARG HE H 2.403 11.630 -1.181 1.00 . A A . 21 ARG HE 1 1 7 3813 1 1 21 ARG HG2 H 0.590 8.414 -1.458 1.00 . A A . 21 ARG HG2 1 1 7 3814 1 1 21 ARG HG3 H 1.648 9.284 -0.342 1.00 . A A . 21 ARG HG3 1 1 7 3815 1 1 21 ARG HH11 H 0.530 11.997 1.080 1.00 . A A . 21 ARG HH11 1 1 7 3816 1 1 21 ARG HH12 H -0.075 13.600 0.822 1.00 . A A . 21 ARG HH12 1 1 7 3817 1 1 21 ARG HH21 H 0.962 13.744 -2.484 1.00 . A A . 21 ARG HH21 1 1 7 3818 1 1 21 ARG HH22 H 0.171 14.589 -1.195 1.00 . A A . 21 ARG HH22 1 1 7 3819 1 1 21 ARG N N 3.179 6.631 -2.353 1.00 . A A . 21 ARG N 1 1 7 3820 1 1 21 ARG NE N 1.425 11.682 -1.202 1.00 . A A . 21 ARG NE 1 1 7 3821 1 1 21 ARG NH1 N 0.391 12.784 0.480 1.00 . A A . 21 ARG NH1 1 1 7 3822 1 1 21 ARG NH2 N 0.636 13.774 -1.539 1.00 . A A . 21 ARG NH2 1 1 7 3823 1 1 21 ARG O O 1.928 8.684 -5.113 1.00 . A A . 21 ARG O 1 1 7 3824 1 1 22 THR C C 3.190 6.138 -7.297 1.00 . A A . 22 THR C 1 1 7 3825 1 1 22 THR CA C 3.761 7.313 -6.504 1.00 . A A . 22 THR CA 1 1 7 3826 1 1 22 THR CB C 5.275 7.397 -6.710 1.00 . A A . 22 THR CB 1 1 7 3827 1 1 22 THR CG2 C 5.710 8.863 -6.716 1.00 . A A . 22 THR CG2 1 1 7 3828 1 1 22 THR H H 3.950 6.467 -4.535 1.00 . A A . 22 THR H 1 1 7 3829 1 1 22 THR HA H 3.300 8.229 -6.846 1.00 . A A . 22 THR HA 1 1 7 3830 1 1 22 THR HB H 5.539 6.953 -7.658 1.00 . A A . 22 THR HB 1 1 7 3831 1 1 22 THR HG1 H 6.806 7.085 -5.553 1.00 . A A . 22 THR HG1 1 1 7 3832 1 1 22 THR HG21 H 5.272 9.371 -5.869 1.00 . A A . 22 THR HG21 1 1 7 3833 1 1 22 THR HG22 H 6.787 8.919 -6.652 1.00 . A A . 22 THR HG22 1 1 7 3834 1 1 22 THR HG23 H 5.379 9.334 -7.629 1.00 . A A . 22 THR HG23 1 1 7 3835 1 1 22 THR N N 3.463 7.128 -5.058 1.00 . A A . 22 THR N 1 1 7 3836 1 1 22 THR O O 3.373 6.042 -8.494 1.00 . A A . 22 THR O 1 1 7 3837 1 1 22 THR OG1 O 5.930 6.706 -5.656 1.00 . A A . 22 THR OG1 1 1 7 3838 1 1 23 SER C C 0.421 4.159 -7.120 1.00 . A A . 23 SER C 1 1 7 3839 1 1 23 SER CA C 1.924 4.091 -7.392 1.00 . A A . 23 SER CA 1 1 7 3840 1 1 23 SER CB C 2.608 2.827 -6.873 1.00 . A A . 23 SER CB 1 1 7 3841 1 1 23 SER H H 2.339 5.311 -5.681 1.00 . A A . 23 SER H 1 1 7 3842 1 1 23 SER HA H 2.097 4.227 -8.450 1.00 . A A . 23 SER HA 1 1 7 3843 1 1 23 SER HB2 H 2.685 2.861 -5.797 1.00 . A A . 23 SER HB2 1 1 7 3844 1 1 23 SER HB3 H 2.047 1.960 -7.189 1.00 . A A . 23 SER HB3 1 1 7 3845 1 1 23 SER HG H 3.967 2.084 -8.050 1.00 . A A . 23 SER HG 1 1 7 3846 1 1 23 SER N N 2.495 5.242 -6.650 1.00 . A A . 23 SER N 1 1 7 3847 1 1 23 SER O O 0.010 4.526 -6.037 1.00 . A A . 23 SER O 1 1 7 3848 1 1 23 SER OG O 3.923 2.801 -7.413 1.00 . A A . 23 SER OG 1 1 7 3849 1 1 24 GLN C C -2.349 2.865 -6.780 1.00 . A A . 24 GLN C 1 1 7 3850 1 1 24 GLN CA C -1.876 3.916 -7.781 1.00 . A A . 24 GLN CA 1 1 7 3851 1 1 24 GLN CB C -2.687 3.839 -9.075 1.00 . A A . 24 GLN CB 1 1 7 3852 1 1 24 GLN CD C -3.991 5.747 -10.028 1.00 . A A . 24 GLN CD 1 1 7 3853 1 1 24 GLN CG C -2.589 5.169 -9.823 1.00 . A A . 24 GLN CG 1 1 7 3854 1 1 24 GLN H H -0.094 3.540 -8.945 1.00 . A A . 24 GLN H 1 1 7 3855 1 1 24 GLN HA H -2.047 4.882 -7.325 1.00 . A A . 24 GLN HA 1 1 7 3856 1 1 24 GLN HB2 H -2.298 3.045 -9.695 1.00 . A A . 24 GLN HB2 1 1 7 3857 1 1 24 GLN HB3 H -3.722 3.640 -8.841 1.00 . A A . 24 GLN HB3 1 1 7 3858 1 1 24 GLN HE21 H -4.009 6.697 -8.284 1.00 . A A . 24 GLN HE21 1 1 7 3859 1 1 24 GLN HE22 H -5.411 6.878 -9.222 1.00 . A A . 24 GLN HE22 1 1 7 3860 1 1 24 GLN HG2 H -1.993 5.862 -9.246 1.00 . A A . 24 GLN HG2 1 1 7 3861 1 1 24 GLN HG3 H -2.129 5.010 -10.786 1.00 . A A . 24 GLN HG3 1 1 7 3862 1 1 24 GLN N N -0.415 3.829 -8.065 1.00 . A A . 24 GLN N 1 1 7 3863 1 1 24 GLN NE2 N -4.513 6.504 -9.100 1.00 . A A . 24 GLN NE2 1 1 7 3864 1 1 24 GLN O O -2.666 3.221 -5.670 1.00 . A A . 24 GLN O 1 1 7 3865 1 1 24 GLN OE1 O -4.617 5.508 -11.040 1.00 . A A . 24 GLN OE1 1 1 7 3866 1 1 25 LYS C C -2.014 0.878 -4.835 1.00 . A A . 25 LYS C 1 1 7 3867 1 1 25 LYS CA C -2.888 0.645 -6.067 1.00 . A A . 25 LYS CA 1 1 7 3868 1 1 25 LYS CB C -2.696 -0.778 -6.592 1.00 . A A . 25 LYS CB 1 1 7 3869 1 1 25 LYS CD C -4.399 -2.356 -7.543 1.00 . A A . 25 LYS CD 1 1 7 3870 1 1 25 LYS CE C -5.917 -2.242 -7.698 1.00 . A A . 25 LYS CE 1 1 7 3871 1 1 25 LYS CG C -3.952 -1.598 -6.292 1.00 . A A . 25 LYS CG 1 1 7 3872 1 1 25 LYS H H -2.165 1.297 -7.999 1.00 . A A . 25 LYS H 1 1 7 3873 1 1 25 LYS HA H -3.926 0.832 -5.830 1.00 . A A . 25 LYS HA 1 1 7 3874 1 1 25 LYS HB2 H -2.524 -0.740 -7.658 1.00 . A A . 25 LYS HB2 1 1 7 3875 1 1 25 LYS HB3 H -1.847 -1.232 -6.104 1.00 . A A . 25 LYS HB3 1 1 7 3876 1 1 25 LYS HD2 H -3.913 -1.933 -8.411 1.00 . A A . 25 LYS HD2 1 1 7 3877 1 1 25 LYS HD3 H -4.129 -3.397 -7.449 1.00 . A A . 25 LYS HD3 1 1 7 3878 1 1 25 LYS HE2 H -6.211 -2.639 -8.658 1.00 . A A . 25 LYS HE2 1 1 7 3879 1 1 25 LYS HE3 H -6.401 -2.804 -6.913 1.00 . A A . 25 LYS HE3 1 1 7 3880 1 1 25 LYS HG2 H -3.741 -2.291 -5.489 1.00 . A A . 25 LYS HG2 1 1 7 3881 1 1 25 LYS HG3 H -4.744 -0.936 -5.970 1.00 . A A . 25 LYS HG3 1 1 7 3882 1 1 25 LYS HZ1 H -5.477 -0.206 -7.656 1.00 . A A . 25 LYS HZ1 1 1 7 3883 1 1 25 LYS HZ2 H -6.960 -0.584 -8.396 1.00 . A A . 25 LYS HZ2 1 1 7 3884 1 1 25 LYS HZ3 H -6.808 -0.643 -6.705 1.00 . A A . 25 LYS HZ3 1 1 7 3885 1 1 25 LYS N N -2.416 1.605 -7.104 1.00 . A A . 25 LYS N 1 1 7 3886 1 1 25 LYS NZ N -6.321 -0.811 -7.607 1.00 . A A . 25 LYS NZ 1 1 7 3887 1 1 25 LYS O O -2.441 1.359 -3.805 1.00 . A A . 25 LYS O 1 1 7 3888 1 1 26 TYR C C -0.073 1.787 -2.914 1.00 . A A . 26 TYR C 1 1 7 3889 1 1 26 TYR CA C 0.262 0.672 -3.915 1.00 . A A . 26 TYR CA 1 1 7 3890 1 1 26 TYR CB C 1.495 1.045 -4.725 1.00 . A A . 26 TYR CB 1 1 7 3891 1 1 26 TYR CD1 C 1.777 -1.473 -4.884 1.00 . A A . 26 TYR CD1 1 1 7 3892 1 1 26 TYR CD2 C 3.669 -0.037 -5.296 1.00 . A A . 26 TYR CD2 1 1 7 3893 1 1 26 TYR CE1 C 2.578 -2.589 -5.114 1.00 . A A . 26 TYR CE1 1 1 7 3894 1 1 26 TYR CE2 C 4.484 -1.151 -5.525 1.00 . A A . 26 TYR CE2 1 1 7 3895 1 1 26 TYR CG C 2.323 -0.191 -4.976 1.00 . A A . 26 TYR CG 1 1 7 3896 1 1 26 TYR CZ C 3.935 -2.437 -5.434 1.00 . A A . 26 TYR CZ 1 1 7 3897 1 1 26 TYR H H -0.495 0.152 -5.842 1.00 . A A . 26 TYR H 1 1 7 3898 1 1 26 TYR HA H 0.476 -0.255 -3.405 1.00 . A A . 26 TYR HA 1 1 7 3899 1 1 26 TYR HB2 H 1.154 1.456 -5.660 1.00 . A A . 26 TYR HB2 1 1 7 3900 1 1 26 TYR HB3 H 2.079 1.780 -4.191 1.00 . A A . 26 TYR HB3 1 1 7 3901 1 1 26 TYR HD1 H 0.734 -1.608 -4.640 1.00 . A A . 26 TYR HD1 1 1 7 3902 1 1 26 TYR HD2 H 4.077 0.956 -5.366 1.00 . A A . 26 TYR HD2 1 1 7 3903 1 1 26 TYR HE1 H 2.124 -3.561 -5.032 1.00 . A A . 26 TYR HE1 1 1 7 3904 1 1 26 TYR HE2 H 5.529 -1.006 -5.770 1.00 . A A . 26 TYR HE2 1 1 7 3905 1 1 26 TYR HH H 4.277 -4.308 -5.280 1.00 . A A . 26 TYR HH 1 1 7 3906 1 1 26 TYR N N -0.770 0.528 -4.980 1.00 . A A . 26 TYR N 1 1 7 3907 1 1 26 TYR O O -0.111 1.573 -1.720 1.00 . A A . 26 TYR O 1 1 7 3908 1 1 26 TYR OH O 4.724 -3.547 -5.657 1.00 . A A . 26 TYR OH 1 1 7 3909 1 1 27 ARG C C -2.042 3.881 -1.845 1.00 . A A . 27 ARG C 1 1 7 3910 1 1 27 ARG CA C -0.647 4.097 -2.441 1.00 . A A . 27 ARG CA 1 1 7 3911 1 1 27 ARG CB C -0.564 5.415 -3.222 1.00 . A A . 27 ARG CB 1 1 7 3912 1 1 27 ARG CD C -1.865 7.175 -4.439 1.00 . A A . 27 ARG CD 1 1 7 3913 1 1 27 ARG CG C -1.939 5.806 -3.758 1.00 . A A . 27 ARG CG 1 1 7 3914 1 1 27 ARG CZ C -2.123 9.126 -3.029 1.00 . A A . 27 ARG CZ 1 1 7 3915 1 1 27 ARG H H -0.288 3.160 -4.334 1.00 . A A . 27 ARG H 1 1 7 3916 1 1 27 ARG HA H 0.080 4.103 -1.645 1.00 . A A . 27 ARG HA 1 1 7 3917 1 1 27 ARG HB2 H -0.200 6.208 -2.586 1.00 . A A . 27 ARG HB2 1 1 7 3918 1 1 27 ARG HB3 H 0.103 5.284 -4.066 1.00 . A A . 27 ARG HB3 1 1 7 3919 1 1 27 ARG HD2 H -1.212 7.117 -5.296 1.00 . A A . 27 ARG HD2 1 1 7 3920 1 1 27 ARG HD3 H -2.853 7.466 -4.762 1.00 . A A . 27 ARG HD3 1 1 7 3921 1 1 27 ARG HE H -0.401 8.155 -3.199 1.00 . A A . 27 ARG HE 1 1 7 3922 1 1 27 ARG HG2 H -2.222 5.069 -4.493 1.00 . A A . 27 ARG HG2 1 1 7 3923 1 1 27 ARG HG3 H -2.655 5.841 -2.950 1.00 . A A . 27 ARG HG3 1 1 7 3924 1 1 27 ARG HH11 H -1.826 10.350 -4.587 1.00 . A A . 27 ARG HH11 1 1 7 3925 1 1 27 ARG HH12 H -2.898 10.941 -3.363 1.00 . A A . 27 ARG HH12 1 1 7 3926 1 1 27 ARG HH21 H -2.600 8.116 -1.371 1.00 . A A . 27 ARG HH21 1 1 7 3927 1 1 27 ARG HH22 H -3.340 9.675 -1.538 1.00 . A A . 27 ARG HH22 1 1 7 3928 1 1 27 ARG N N -0.318 2.984 -3.374 1.00 . A A . 27 ARG N 1 1 7 3929 1 1 27 ARG NE N -1.337 8.190 -3.485 1.00 . A A . 27 ARG NE 1 1 7 3930 1 1 27 ARG NH1 N -2.296 10.225 -3.713 1.00 . A A . 27 ARG NH1 1 1 7 3931 1 1 27 ARG NH2 N -2.736 8.960 -1.890 1.00 . A A . 27 ARG NH2 1 1 7 3932 1 1 27 ARG O O -2.267 4.024 -0.660 1.00 . A A . 27 ARG O 1 1 7 3933 1 1 28 ALA C C -4.533 1.843 -1.763 1.00 . A A . 28 ALA C 1 1 7 3934 1 1 28 ALA CA C -4.381 3.297 -2.216 1.00 . A A . 28 ALA CA 1 1 7 3935 1 1 28 ALA CB C -5.349 3.577 -3.366 1.00 . A A . 28 ALA CB 1 1 7 3936 1 1 28 ALA H H -2.763 3.430 -3.616 1.00 . A A . 28 ALA H 1 1 7 3937 1 1 28 ALA HA H -4.605 3.956 -1.390 1.00 . A A . 28 ALA HA 1 1 7 3938 1 1 28 ALA HB1 H -4.793 3.699 -4.284 1.00 . A A . 28 ALA HB1 1 1 7 3939 1 1 28 ALA HB2 H -6.035 2.749 -3.469 1.00 . A A . 28 ALA HB2 1 1 7 3940 1 1 28 ALA HB3 H -5.903 4.480 -3.159 1.00 . A A . 28 ALA HB3 1 1 7 3941 1 1 28 ALA N N -2.984 3.534 -2.674 1.00 . A A . 28 ALA N 1 1 7 3942 1 1 28 ALA O O -4.618 1.585 -0.579 1.00 . A A . 28 ALA O 1 1 7 3943 1 1 29 ASN C C -3.876 -0.825 -1.036 1.00 . A A . 29 ASN C 1 1 7 3944 1 1 29 ASN CA C -4.724 -0.518 -2.266 1.00 . A A . 29 ASN CA 1 1 7 3945 1 1 29 ASN CB C -4.321 -1.517 -3.355 1.00 . A A . 29 ASN CB 1 1 7 3946 1 1 29 ASN CG C -5.598 -1.985 -4.058 1.00 . A A . 29 ASN CG 1 1 7 3947 1 1 29 ASN H H -4.507 1.139 -3.625 1.00 . A A . 29 ASN H 1 1 7 3948 1 1 29 ASN HA H -5.763 -0.651 -2.036 1.00 . A A . 29 ASN HA 1 1 7 3949 1 1 29 ASN HB2 H -3.653 -1.036 -4.051 1.00 . A A . 29 ASN HB2 1 1 7 3950 1 1 29 ASN HB3 H -3.825 -2.375 -2.917 1.00 . A A . 29 ASN HB3 1 1 7 3951 1 1 29 ASN HD21 H -6.237 -0.143 -4.435 1.00 . A A . 29 ASN HD21 1 1 7 3952 1 1 29 ASN HD22 H -7.251 -1.389 -4.981 1.00 . A A . 29 ASN HD22 1 1 7 3953 1 1 29 ASN N N -4.572 0.906 -2.676 1.00 . A A . 29 ASN N 1 1 7 3954 1 1 29 ASN ND2 N -6.432 -1.099 -4.530 1.00 . A A . 29 ASN ND2 1 1 7 3955 1 1 29 ASN O O -4.328 -1.440 -0.092 1.00 . A A . 29 ASN O 1 1 7 3956 1 1 29 ASN OD1 O -5.840 -3.170 -4.176 1.00 . A A . 29 ASN OD1 1 1 7 3957 1 1 30 CYS C C -1.611 0.617 0.937 1.00 . A A . 30 CYS C 1 1 7 3958 1 1 30 CYS CA C -1.755 -0.653 0.103 1.00 . A A . 30 CYS CA 1 1 7 3959 1 1 30 CYS CB C -0.406 -1.122 -0.429 1.00 . A A . 30 CYS CB 1 1 7 3960 1 1 30 CYS H H -2.312 0.099 -1.835 1.00 . A A . 30 CYS H 1 1 7 3961 1 1 30 CYS HA H -2.188 -1.431 0.716 1.00 . A A . 30 CYS HA 1 1 7 3962 1 1 30 CYS HB2 H -0.063 -0.459 -1.208 1.00 . A A . 30 CYS HB2 1 1 7 3963 1 1 30 CYS HB3 H 0.309 -1.158 0.378 1.00 . A A . 30 CYS HB3 1 1 7 3964 1 1 30 CYS N N -2.647 -0.394 -1.056 1.00 . A A . 30 CYS N 1 1 7 3965 1 1 30 CYS O O -0.560 1.217 1.041 1.00 . A A . 30 CYS O 1 1 7 3966 1 1 30 CYS SG S -0.658 -2.788 -1.083 1.00 . A A . 30 CYS SG 1 1 7 3967 1 1 31 ALA C C -2.525 1.827 3.840 1.00 . A A . 31 ALA C 1 1 7 3968 1 1 31 ALA CA C -2.733 2.227 2.374 1.00 . A A . 31 ALA CA 1 1 7 3969 1 1 31 ALA CB C -4.113 2.860 2.186 1.00 . A A . 31 ALA CB 1 1 7 3970 1 1 31 ALA H H -3.524 0.486 1.407 1.00 . A A . 31 ALA H 1 1 7 3971 1 1 31 ALA HA H -1.960 2.918 2.059 1.00 . A A . 31 ALA HA 1 1 7 3972 1 1 31 ALA HB1 H -4.696 2.237 1.521 1.00 . A A . 31 ALA HB1 1 1 7 3973 1 1 31 ALA HB2 H -4.611 2.907 3.141 1.00 . A A . 31 ALA HB2 1 1 7 3974 1 1 31 ALA HB3 H -4.030 3.850 1.765 1.00 . A A . 31 ALA HB3 1 1 7 3975 1 1 31 ALA N N -2.703 1.007 1.526 1.00 . A A . 31 ALA N 1 1 7 3976 1 1 31 ALA O O -2.504 2.662 4.722 1.00 . A A . 31 ALA O 1 1 7 3977 1 1 32 LYS C C -0.658 0.157 5.791 1.00 . A A . 32 LYS C 1 1 7 3978 1 1 32 LYS CA C -2.159 0.087 5.508 1.00 . A A . 32 LYS CA 1 1 7 3979 1 1 32 LYS CB C -2.641 -1.364 5.585 1.00 . A A . 32 LYS CB 1 1 7 3980 1 1 32 LYS CD C -0.553 -2.735 5.202 1.00 . A A . 32 LYS CD 1 1 7 3981 1 1 32 LYS CE C -0.169 -4.200 5.444 1.00 . A A . 32 LYS CE 1 1 7 3982 1 1 32 LYS CG C -1.596 -2.284 6.232 1.00 . A A . 32 LYS CG 1 1 7 3983 1 1 32 LYS H H -2.388 -0.102 3.387 1.00 . A A . 32 LYS H 1 1 7 3984 1 1 32 LYS HA H -2.710 0.703 6.202 1.00 . A A . 32 LYS HA 1 1 7 3985 1 1 32 LYS HB2 H -3.551 -1.391 6.162 1.00 . A A . 32 LYS HB2 1 1 7 3986 1 1 32 LYS HB3 H -2.849 -1.704 4.582 1.00 . A A . 32 LYS HB3 1 1 7 3987 1 1 32 LYS HD2 H -0.964 -2.631 4.208 1.00 . A A . 32 LYS HD2 1 1 7 3988 1 1 32 LYS HD3 H 0.330 -2.118 5.291 1.00 . A A . 32 LYS HD3 1 1 7 3989 1 1 32 LYS HE2 H -0.945 -4.841 5.053 1.00 . A A . 32 LYS HE2 1 1 7 3990 1 1 32 LYS HE3 H 0.765 -4.442 4.952 1.00 . A A . 32 LYS HE3 1 1 7 3991 1 1 32 LYS HG2 H -1.103 -1.767 7.042 1.00 . A A . 32 LYS HG2 1 1 7 3992 1 1 32 LYS HG3 H -2.095 -3.155 6.628 1.00 . A A . 32 LYS HG3 1 1 7 3993 1 1 32 LYS HZ1 H 0.216 -3.540 7.379 1.00 . A A . 32 LYS HZ1 1 1 7 3994 1 1 32 LYS HZ2 H -0.929 -4.794 7.291 1.00 . A A . 32 LYS HZ2 1 1 7 3995 1 1 32 LYS HZ3 H 0.717 -5.137 7.081 1.00 . A A . 32 LYS HZ3 1 1 7 3996 1 1 32 LYS N N -2.369 0.559 4.110 1.00 . A A . 32 LYS N 1 1 7 3997 1 1 32 LYS NZ N -0.030 -4.435 6.909 1.00 . A A . 32 LYS NZ 1 1 7 3998 1 1 32 LYS O O -0.214 0.290 6.915 1.00 . A A . 32 LYS O 1 1 7 3999 1 1 33 THR C C 2.038 1.574 4.833 1.00 . A A . 33 THR C 1 1 7 4000 1 1 33 THR CA C 1.591 0.116 4.834 1.00 . A A . 33 THR CA 1 1 7 4001 1 1 33 THR CB C 2.049 -0.773 3.679 1.00 . A A . 33 THR CB 1 1 7 4002 1 1 33 THR CG2 C 2.745 -0.029 2.540 1.00 . A A . 33 THR CG2 1 1 7 4003 1 1 33 THR H H -0.292 -0.040 3.859 1.00 . A A . 33 THR H 1 1 7 4004 1 1 33 THR HA H 1.937 -0.293 5.764 1.00 . A A . 33 THR HA 1 1 7 4005 1 1 33 THR HB H 1.173 -1.273 3.297 1.00 . A A . 33 THR HB 1 1 7 4006 1 1 33 THR HG1 H 2.505 -2.633 3.997 1.00 . A A . 33 THR HG1 1 1 7 4007 1 1 33 THR HG21 H 2.701 1.036 2.688 1.00 . A A . 33 THR HG21 1 1 7 4008 1 1 33 THR HG22 H 3.771 -0.350 2.492 1.00 . A A . 33 THR HG22 1 1 7 4009 1 1 33 THR HG23 H 2.255 -0.286 1.613 1.00 . A A . 33 THR HG23 1 1 7 4010 1 1 33 THR N N 0.111 0.066 4.745 1.00 . A A . 33 THR N 1 1 7 4011 1 1 33 THR O O 3.100 1.919 5.311 1.00 . A A . 33 THR O 1 1 7 4012 1 1 33 THR OG1 O 2.895 -1.780 4.204 1.00 . A A . 33 THR OG1 1 1 7 4013 1 1 34 CYS C C 0.518 4.691 5.000 1.00 . A A . 34 CYS C 1 1 7 4014 1 1 34 CYS CA C 1.573 3.870 4.261 1.00 . A A . 34 CYS CA 1 1 7 4015 1 1 34 CYS CB C 1.593 4.396 2.831 1.00 . A A . 34 CYS CB 1 1 7 4016 1 1 34 CYS H H 0.365 2.114 3.923 1.00 . A A . 34 CYS H 1 1 7 4017 1 1 34 CYS HA H 2.544 4.023 4.707 1.00 . A A . 34 CYS HA 1 1 7 4018 1 1 34 CYS HB2 H 1.950 3.637 2.158 1.00 . A A . 34 CYS HB2 1 1 7 4019 1 1 34 CYS HB3 H 0.589 4.642 2.540 1.00 . A A . 34 CYS HB3 1 1 7 4020 1 1 34 CYS N N 1.215 2.428 4.297 1.00 . A A . 34 CYS N 1 1 7 4021 1 1 34 CYS O O 0.616 5.899 5.090 1.00 . A A . 34 CYS O 1 1 7 4022 1 1 34 CYS SG S 2.613 5.894 2.867 1.00 . A A . 34 CYS SG 1 1 7 4023 1 1 35 GLU C C -2.167 5.850 5.314 1.00 . A A . 35 GLU C 1 1 7 4024 1 1 35 GLU CA C -1.532 4.829 6.250 1.00 . A A . 35 GLU CA 1 1 7 4025 1 1 35 GLU CB C -0.908 5.435 7.500 1.00 . A A . 35 GLU CB 1 1 7 4026 1 1 35 GLU CD C 0.191 4.525 9.572 1.00 . A A . 35 GLU CD 1 1 7 4027 1 1 35 GLU CG C -0.727 4.211 8.389 1.00 . A A . 35 GLU CG 1 1 7 4028 1 1 35 GLU H H -0.573 3.087 5.455 1.00 . A A . 35 GLU H 1 1 7 4029 1 1 35 GLU HA H -2.307 4.133 6.539 1.00 . A A . 35 GLU HA 1 1 7 4030 1 1 35 GLU HB2 H 0.036 5.903 7.259 1.00 . A A . 35 GLU HB2 1 1 7 4031 1 1 35 GLU HB3 H -1.581 6.124 7.985 1.00 . A A . 35 GLU HB3 1 1 7 4032 1 1 35 GLU HG2 H -1.704 3.896 8.727 1.00 . A A . 35 GLU HG2 1 1 7 4033 1 1 35 GLU HG3 H -0.298 3.424 7.783 1.00 . A A . 35 GLU HG3 1 1 7 4034 1 1 35 GLU N N -0.491 4.059 5.527 1.00 . A A . 35 GLU N 1 1 7 4035 1 1 35 GLU O O -2.559 6.941 5.681 1.00 . A A . 35 GLU O 1 1 7 4036 1 1 35 GLU OE1 O 0.168 5.655 10.030 1.00 . A A . 35 GLU OE1 1 1 7 4037 1 1 35 GLU OE2 O 0.900 3.630 10.000 1.00 . A A . 35 GLU OE2 1 1 7 4038 1 1 36 LEU C C -4.365 6.014 3.118 1.00 . A A . 36 LEU C 1 1 7 4039 1 1 36 LEU CA C -2.860 6.274 3.018 1.00 . A A . 36 LEU CA 1 1 7 4040 1 1 36 LEU CB C -2.365 5.769 1.664 1.00 . A A . 36 LEU CB 1 1 7 4041 1 1 36 LEU CD1 C -0.280 5.227 0.445 1.00 . A A . 36 LEU CD1 1 1 7 4042 1 1 36 LEU CD2 C -0.903 7.621 0.835 1.00 . A A . 36 LEU CD2 1 1 7 4043 1 1 36 LEU CG C -0.929 6.209 1.424 1.00 . A A . 36 LEU CG 1 1 7 4044 1 1 36 LEU H H -1.931 4.540 3.858 1.00 . A A . 36 LEU H 1 1 7 4045 1 1 36 LEU HA H -2.625 7.314 3.157 1.00 . A A . 36 LEU HA 1 1 7 4046 1 1 36 LEU HB2 H -2.386 4.702 1.710 1.00 . A A . 36 LEU HB2 1 1 7 4047 1 1 36 LEU HB3 H -2.988 6.089 0.849 1.00 . A A . 36 LEU HB3 1 1 7 4048 1 1 36 LEU HD11 H -0.637 4.228 0.649 1.00 . A A . 36 LEU HD11 1 1 7 4049 1 1 36 LEU HD12 H -0.540 5.498 -0.568 1.00 . A A . 36 LEU HD12 1 1 7 4050 1 1 36 LEU HD13 H 0.792 5.252 0.557 1.00 . A A . 36 LEU HD13 1 1 7 4051 1 1 36 LEU HD21 H -1.747 8.182 1.205 1.00 . A A . 36 LEU HD21 1 1 7 4052 1 1 36 LEU HD22 H 0.013 8.115 1.124 1.00 . A A . 36 LEU HD22 1 1 7 4053 1 1 36 LEU HD23 H -0.953 7.561 -0.242 1.00 . A A . 36 LEU HD23 1 1 7 4054 1 1 36 LEU HG H -0.427 6.185 2.380 1.00 . A A . 36 LEU HG 1 1 7 4055 1 1 36 LEU N N -2.260 5.435 4.084 1.00 . A A . 36 LEU N 1 1 7 4056 1 1 36 LEU O O -5.165 6.736 2.557 1.00 . A A . 36 LEU O 1 1 7 4057 1 1 37 CYS C C -6.923 5.937 4.535 1.00 . A A . 37 CYS C 1 1 7 4058 1 1 37 CYS CA C -6.224 4.711 3.944 1.00 . A A . 37 CYS CA 1 1 7 4059 1 1 37 CYS CB C -6.457 3.508 4.861 1.00 . A A . 37 CYS CB 1 1 7 4060 1 1 37 CYS H H -4.123 4.393 4.290 1.00 . A A . 37 CYS H 1 1 7 4061 1 1 37 CYS HA H -6.627 4.504 2.964 1.00 . A A . 37 CYS HA 1 1 7 4062 1 1 37 CYS HB2 H -5.565 3.320 5.438 1.00 . A A . 37 CYS HB2 1 1 7 4063 1 1 37 CYS HB3 H -7.277 3.723 5.530 1.00 . A A . 37 CYS HB3 1 1 7 4064 1 1 37 CYS N N -4.763 4.986 3.830 1.00 . A A . 37 CYS N 1 1 7 4065 1 1 37 CYS O O -6.270 6.960 4.666 1.00 . A A . 37 CYS O 1 1 7 4066 1 1 37 CYS OXT O -8.098 5.834 4.845 1.00 . A A . 37 CYS OXT 1 1 7 4067 1 1 37 CYS SG S -6.851 2.042 3.874 1.00 . A A . 37 CYS SG 1 1 8 4068 1 1 1 VAL C C -12.136 1.262 2.681 1.00 . A A . 1 VAL C 1 1 8 4069 1 1 1 VAL CA C -13.490 1.410 3.379 1.00 . A A . 1 VAL CA 1 1 8 4070 1 1 1 VAL CB C -13.481 0.592 4.672 1.00 . A A . 1 VAL CB 1 1 8 4071 1 1 1 VAL CG1 C -12.963 -0.818 4.380 1.00 . A A . 1 VAL CG1 1 1 8 4072 1 1 1 VAL CG2 C -12.562 1.267 5.693 1.00 . A A . 1 VAL CG2 1 1 8 4073 1 1 1 VAL H1 H -14.278 0.002 2.063 1.00 . A A . 1 VAL H1 1 1 8 4074 1 1 1 VAL H2 H -15.440 0.768 3.027 1.00 . A A . 1 VAL H2 1 1 8 4075 1 1 1 VAL H3 H -14.735 1.605 1.725 1.00 . A A . 1 VAL H3 1 1 8 4076 1 1 1 VAL HA H -13.665 2.449 3.611 1.00 . A A . 1 VAL HA 1 1 8 4077 1 1 1 VAL HB H -14.485 0.532 5.065 1.00 . A A . 1 VAL HB 1 1 8 4078 1 1 1 VAL HG11 H -13.365 -1.162 3.438 1.00 . A A . 1 VAL HG11 1 1 8 4079 1 1 1 VAL HG12 H -11.884 -0.799 4.324 1.00 . A A . 1 VAL HG12 1 1 8 4080 1 1 1 VAL HG13 H -13.271 -1.485 5.170 1.00 . A A . 1 VAL HG13 1 1 8 4081 1 1 1 VAL HG21 H -12.453 2.312 5.445 1.00 . A A . 1 VAL HG21 1 1 8 4082 1 1 1 VAL HG22 H -12.989 1.172 6.680 1.00 . A A . 1 VAL HG22 1 1 8 4083 1 1 1 VAL HG23 H -11.593 0.790 5.673 1.00 . A A . 1 VAL HG23 1 1 8 4084 1 1 1 VAL N N -14.567 0.909 2.480 1.00 . A A . 1 VAL N 1 1 8 4085 1 1 1 VAL O O -11.981 0.475 1.767 1.00 . A A . 1 VAL O 1 1 8 4086 1 1 2 CYS C C -9.024 0.777 3.117 1.00 . A A . 2 CYS C 1 1 8 4087 1 1 2 CYS CA C -9.816 1.912 2.463 1.00 . A A . 2 CYS CA 1 1 8 4088 1 1 2 CYS CB C -9.054 3.228 2.636 1.00 . A A . 2 CYS CB 1 1 8 4089 1 1 2 CYS H H -11.306 2.638 3.843 1.00 . A A . 2 CYS H 1 1 8 4090 1 1 2 CYS HA H -9.948 1.707 1.410 1.00 . A A . 2 CYS HA 1 1 8 4091 1 1 2 CYS HB2 H -8.023 3.084 2.347 1.00 . A A . 2 CYS HB2 1 1 8 4092 1 1 2 CYS HB3 H -9.500 3.985 2.008 1.00 . A A . 2 CYS HB3 1 1 8 4093 1 1 2 CYS N N -11.157 2.013 3.104 1.00 . A A . 2 CYS N 1 1 8 4094 1 1 2 CYS O O -9.469 0.193 4.085 1.00 . A A . 2 CYS O 1 1 8 4095 1 1 2 CYS SG S -9.121 3.759 4.366 1.00 . A A . 2 CYS SG 1 1 8 4096 1 1 3 ARG C C -6.073 -1.137 2.098 1.00 . A A . 3 ARG C 1 1 8 4097 1 1 3 ARG CA C -7.029 -0.625 3.176 1.00 . A A . 3 ARG CA 1 1 8 4098 1 1 3 ARG CB C -7.905 -1.794 3.633 1.00 . A A . 3 ARG CB 1 1 8 4099 1 1 3 ARG CD C -8.970 -3.572 2.229 1.00 . A A . 3 ARG CD 1 1 8 4100 1 1 3 ARG CG C -8.973 -2.081 2.577 1.00 . A A . 3 ARG CG 1 1 8 4101 1 1 3 ARG CZ C -10.579 -4.246 3.911 1.00 . A A . 3 ARG CZ 1 1 8 4102 1 1 3 ARG H H -7.532 0.959 1.819 1.00 . A A . 3 ARG H 1 1 8 4103 1 1 3 ARG HA H -6.461 -0.244 4.012 1.00 . A A . 3 ARG HA 1 1 8 4104 1 1 3 ARG HB2 H -7.285 -2.668 3.773 1.00 . A A . 3 ARG HB2 1 1 8 4105 1 1 3 ARG HB3 H -8.384 -1.543 4.567 1.00 . A A . 3 ARG HB3 1 1 8 4106 1 1 3 ARG HD2 H -9.668 -3.757 1.425 1.00 . A A . 3 ARG HD2 1 1 8 4107 1 1 3 ARG HD3 H -7.979 -3.868 1.919 1.00 . A A . 3 ARG HD3 1 1 8 4108 1 1 3 ARG HE H -8.731 -4.970 3.851 1.00 . A A . 3 ARG HE 1 1 8 4109 1 1 3 ARG HG2 H -9.942 -1.803 2.963 1.00 . A A . 3 ARG HG2 1 1 8 4110 1 1 3 ARG HG3 H -8.761 -1.510 1.685 1.00 . A A . 3 ARG HG3 1 1 8 4111 1 1 3 ARG HH11 H -11.432 -3.960 2.122 1.00 . A A . 3 ARG HH11 1 1 8 4112 1 1 3 ARG HH12 H -12.511 -3.943 3.477 1.00 . A A . 3 ARG HH12 1 1 8 4113 1 1 3 ARG HH21 H -10.007 -4.504 5.812 1.00 . A A . 3 ARG HH21 1 1 8 4114 1 1 3 ARG HH22 H -11.703 -4.251 5.567 1.00 . A A . 3 ARG HH22 1 1 8 4115 1 1 3 ARG N N -7.864 0.468 2.599 1.00 . A A . 3 ARG N 1 1 8 4116 1 1 3 ARG NE N -9.373 -4.363 3.426 1.00 . A A . 3 ARG NE 1 1 8 4117 1 1 3 ARG NH1 N -11.585 -4.033 3.107 1.00 . A A . 3 ARG NH1 1 1 8 4118 1 1 3 ARG NH2 N -10.778 -4.341 5.197 1.00 . A A . 3 ARG NH2 1 1 8 4119 1 1 3 ARG O O -5.958 -0.564 1.033 1.00 . A A . 3 ARG O 1 1 8 4120 1 1 4 ASP C C -5.242 -3.552 0.318 1.00 . A A . 4 ASP C 1 1 8 4121 1 1 4 ASP CA C -4.443 -2.753 1.347 1.00 . A A . 4 ASP CA 1 1 8 4122 1 1 4 ASP CB C -3.401 -3.657 2.010 1.00 . A A . 4 ASP CB 1 1 8 4123 1 1 4 ASP CG C -4.063 -4.511 3.094 1.00 . A A . 4 ASP CG 1 1 8 4124 1 1 4 ASP H H -5.493 -2.662 3.229 1.00 . A A . 4 ASP H 1 1 8 4125 1 1 4 ASP HA H -3.955 -1.934 0.839 1.00 . A A . 4 ASP HA 1 1 8 4126 1 1 4 ASP HB2 H -2.964 -4.304 1.263 1.00 . A A . 4 ASP HB2 1 1 8 4127 1 1 4 ASP HB3 H -2.629 -3.050 2.459 1.00 . A A . 4 ASP HB3 1 1 8 4128 1 1 4 ASP N N -5.386 -2.213 2.364 1.00 . A A . 4 ASP N 1 1 8 4129 1 1 4 ASP O O -6.456 -3.565 0.338 1.00 . A A . 4 ASP O 1 1 8 4130 1 1 4 ASP OD1 O -5.255 -4.749 2.987 1.00 . A A . 4 ASP OD1 1 1 8 4131 1 1 4 ASP OD2 O -3.368 -4.911 4.011 1.00 . A A . 4 ASP OD2 1 1 8 4132 1 1 5 TRP C C -4.460 -6.167 -2.064 1.00 . A A . 5 TRP C 1 1 8 4133 1 1 5 TRP CA C -5.336 -5.005 -1.594 1.00 . A A . 5 TRP CA 1 1 8 4134 1 1 5 TRP CB C -5.712 -4.068 -2.744 1.00 . A A . 5 TRP CB 1 1 8 4135 1 1 5 TRP CD1 C -7.394 -2.231 -2.269 1.00 . A A . 5 TRP CD1 1 1 8 4136 1 1 5 TRP CD2 C -8.319 -4.278 -2.288 1.00 . A A . 5 TRP CD2 1 1 8 4137 1 1 5 TRP CE2 C -9.365 -3.361 -2.013 1.00 . A A . 5 TRP CE2 1 1 8 4138 1 1 5 TRP CE3 C -8.636 -5.643 -2.354 1.00 . A A . 5 TRP CE3 1 1 8 4139 1 1 5 TRP CG C -7.076 -3.533 -2.447 1.00 . A A . 5 TRP CG 1 1 8 4140 1 1 5 TRP CH2 C -10.973 -5.157 -1.883 1.00 . A A . 5 TRP CH2 1 1 8 4141 1 1 5 TRP CZ2 C -10.681 -3.791 -1.812 1.00 . A A . 5 TRP CZ2 1 1 8 4142 1 1 5 TRP CZ3 C -9.953 -6.079 -2.154 1.00 . A A . 5 TRP CZ3 1 1 8 4143 1 1 5 TRP H H -3.595 -4.211 -0.597 1.00 . A A . 5 TRP H 1 1 8 4144 1 1 5 TRP HA H -6.241 -5.395 -1.134 1.00 . A A . 5 TRP HA 1 1 8 4145 1 1 5 TRP HB2 H -4.995 -3.262 -2.790 1.00 . A A . 5 TRP HB2 1 1 8 4146 1 1 5 TRP HB3 H -5.728 -4.606 -3.679 1.00 . A A . 5 TRP HB3 1 1 8 4147 1 1 5 TRP HD1 H -6.704 -1.403 -2.317 1.00 . A A . 5 TRP HD1 1 1 8 4148 1 1 5 TRP HE1 H -9.228 -1.289 -1.848 1.00 . A A . 5 TRP HE1 1 1 8 4149 1 1 5 TRP HE3 H -7.856 -6.361 -2.562 1.00 . A A . 5 TRP HE3 1 1 8 4150 1 1 5 TRP HH2 H -11.985 -5.502 -1.730 1.00 . A A . 5 TRP HH2 1 1 8 4151 1 1 5 TRP HZ2 H -11.463 -3.075 -1.604 1.00 . A A . 5 TRP HZ2 1 1 8 4152 1 1 5 TRP HZ3 H -10.183 -7.132 -2.207 1.00 . A A . 5 TRP HZ3 1 1 8 4153 1 1 5 TRP N N -4.579 -4.221 -0.583 1.00 . A A . 5 TRP N 1 1 8 4154 1 1 5 TRP NE1 N -8.747 -2.127 -2.012 1.00 . A A . 5 TRP NE1 1 1 8 4155 1 1 5 TRP O O -4.960 -7.238 -2.346 1.00 . A A . 5 TRP O 1 1 8 4156 1 1 6 PHE C C -2.067 -7.903 -1.307 1.00 . A A . 6 PHE C 1 1 8 4157 1 1 6 PHE CA C -2.329 -7.136 -2.604 1.00 . A A . 6 PHE CA 1 1 8 4158 1 1 6 PHE CB C -0.988 -6.582 -3.068 1.00 . A A . 6 PHE CB 1 1 8 4159 1 1 6 PHE CD1 C -2.326 -5.613 -4.976 1.00 . A A . 6 PHE CD1 1 1 8 4160 1 1 6 PHE CD2 C -0.071 -4.842 -4.523 1.00 . A A . 6 PHE CD2 1 1 8 4161 1 1 6 PHE CE1 C -2.404 -4.727 -6.043 1.00 . A A . 6 PHE CE1 1 1 8 4162 1 1 6 PHE CE2 C -0.146 -3.959 -5.582 1.00 . A A . 6 PHE CE2 1 1 8 4163 1 1 6 PHE CG C -1.153 -5.658 -4.227 1.00 . A A . 6 PHE CG 1 1 8 4164 1 1 6 PHE CZ C -1.316 -3.901 -6.346 1.00 . A A . 6 PHE CZ 1 1 8 4165 1 1 6 PHE H H -2.707 -5.156 -1.935 1.00 . A A . 6 PHE H 1 1 8 4166 1 1 6 PHE HA H -2.828 -7.690 -3.386 1.00 . A A . 6 PHE HA 1 1 8 4167 1 1 6 PHE HB2 H -0.537 -5.998 -2.284 1.00 . A A . 6 PHE HB2 1 1 8 4168 1 1 6 PHE HB3 H -0.328 -7.379 -3.362 1.00 . A A . 6 PHE HB3 1 1 8 4169 1 1 6 PHE HD1 H -3.163 -6.246 -4.746 1.00 . A A . 6 PHE HD1 1 1 8 4170 1 1 6 PHE HD2 H 0.830 -4.880 -3.941 1.00 . A A . 6 PHE HD2 1 1 8 4171 1 1 6 PHE HE1 H -3.313 -4.699 -6.615 1.00 . A A . 6 PHE HE1 1 1 8 4172 1 1 6 PHE HE2 H 0.717 -3.349 -5.770 1.00 . A A . 6 PHE HE2 1 1 8 4173 1 1 6 PHE HZ H -1.379 -3.218 -7.169 1.00 . A A . 6 PHE HZ 1 1 8 4174 1 1 6 PHE N N -3.163 -5.999 -2.153 1.00 . A A . 6 PHE N 1 1 8 4175 1 1 6 PHE O O -2.956 -8.043 -0.489 1.00 . A A . 6 PHE O 1 1 8 4176 1 1 7 LYS C C -0.297 -8.028 1.199 1.00 . A A . 7 LYS C 1 1 8 4177 1 1 7 LYS CA C -0.652 -9.127 0.195 1.00 . A A . 7 LYS CA 1 1 8 4178 1 1 7 LYS CB C 0.526 -10.091 0.035 1.00 . A A . 7 LYS CB 1 1 8 4179 1 1 7 LYS CD C 0.301 -12.335 1.112 1.00 . A A . 7 LYS CD 1 1 8 4180 1 1 7 LYS CE C 0.229 -13.056 2.459 1.00 . A A . 7 LYS CE 1 1 8 4181 1 1 7 LYS CG C 0.723 -10.881 1.330 1.00 . A A . 7 LYS CG 1 1 8 4182 1 1 7 LYS H H -0.151 -8.292 -1.718 1.00 . A A . 7 LYS H 1 1 8 4183 1 1 7 LYS HA H -1.552 -9.640 0.502 1.00 . A A . 7 LYS HA 1 1 8 4184 1 1 7 LYS HB2 H 0.325 -10.772 -0.778 1.00 . A A . 7 LYS HB2 1 1 8 4185 1 1 7 LYS HB3 H 1.425 -9.530 -0.177 1.00 . A A . 7 LYS HB3 1 1 8 4186 1 1 7 LYS HD2 H -0.668 -12.359 0.635 1.00 . A A . 7 LYS HD2 1 1 8 4187 1 1 7 LYS HD3 H 1.025 -12.831 0.483 1.00 . A A . 7 LYS HD3 1 1 8 4188 1 1 7 LYS HE2 H 0.519 -12.377 3.247 1.00 . A A . 7 LYS HE2 1 1 8 4189 1 1 7 LYS HE3 H -0.780 -13.397 2.631 1.00 . A A . 7 LYS HE3 1 1 8 4190 1 1 7 LYS HG2 H 1.764 -10.845 1.618 1.00 . A A . 7 LYS HG2 1 1 8 4191 1 1 7 LYS HG3 H 0.117 -10.450 2.113 1.00 . A A . 7 LYS HG3 1 1 8 4192 1 1 7 LYS HZ1 H 1.985 -14.006 1.861 1.00 . A A . 7 LYS HZ1 1 1 8 4193 1 1 7 LYS HZ2 H 1.467 -14.433 3.415 1.00 . A A . 7 LYS HZ2 1 1 8 4194 1 1 7 LYS HZ3 H 0.658 -15.052 2.054 1.00 . A A . 7 LYS HZ3 1 1 8 4195 1 1 7 LYS N N -0.883 -8.397 -1.078 1.00 . A A . 7 LYS N 1 1 8 4196 1 1 7 LYS NZ N 1.154 -14.225 2.446 1.00 . A A . 7 LYS NZ 1 1 8 4197 1 1 7 LYS O O 0.325 -7.049 0.838 1.00 . A A . 7 LYS O 1 1 8 4198 1 1 8 GLU C C 1.172 -6.719 3.298 1.00 . A A . 8 GLU C 1 1 8 4199 1 1 8 GLU CA C -0.314 -7.067 3.410 1.00 . A A . 8 GLU CA 1 1 8 4200 1 1 8 GLU CB C -0.632 -7.534 4.832 1.00 . A A . 8 GLU CB 1 1 8 4201 1 1 8 GLU CD C -2.424 -8.602 6.209 1.00 . A A . 8 GLU CD 1 1 8 4202 1 1 8 GLU CG C -2.142 -7.731 4.983 1.00 . A A . 8 GLU CG 1 1 8 4203 1 1 8 GLU H H -1.169 -8.934 2.739 1.00 . A A . 8 GLU H 1 1 8 4204 1 1 8 GLU HA H -0.883 -6.175 3.191 1.00 . A A . 8 GLU HA 1 1 8 4205 1 1 8 GLU HB2 H -0.124 -8.468 5.023 1.00 . A A . 8 GLU HB2 1 1 8 4206 1 1 8 GLU HB3 H -0.299 -6.791 5.540 1.00 . A A . 8 GLU HB3 1 1 8 4207 1 1 8 GLU HG2 H -2.620 -6.770 5.102 1.00 . A A . 8 GLU HG2 1 1 8 4208 1 1 8 GLU HG3 H -2.531 -8.222 4.104 1.00 . A A . 8 GLU HG3 1 1 8 4209 1 1 8 GLU N N -0.666 -8.147 2.443 1.00 . A A . 8 GLU N 1 1 8 4210 1 1 8 GLU O O 1.593 -5.657 3.711 1.00 . A A . 8 GLU O 1 1 8 4211 1 1 8 GLU OE1 O -1.475 -8.956 6.889 1.00 . A A . 8 GLU OE1 1 1 8 4212 1 1 8 GLU OE2 O -3.582 -8.900 6.445 1.00 . A A . 8 GLU OE2 1 1 8 4213 1 1 9 THR C C 3.678 -6.532 1.317 1.00 . A A . 9 THR C 1 1 8 4214 1 1 9 THR CA C 3.424 -7.267 2.633 1.00 . A A . 9 THR CA 1 1 8 4215 1 1 9 THR CB C 4.186 -8.580 2.773 1.00 . A A . 9 THR CB 1 1 8 4216 1 1 9 THR CG2 C 3.922 -9.066 4.198 1.00 . A A . 9 THR CG2 1 1 8 4217 1 1 9 THR H H 1.648 -8.445 2.415 1.00 . A A . 9 THR H 1 1 8 4218 1 1 9 THR HA H 3.691 -6.606 3.446 1.00 . A A . 9 THR HA 1 1 8 4219 1 1 9 THR HB H 5.244 -8.421 2.655 1.00 . A A . 9 THR HB 1 1 8 4220 1 1 9 THR HG1 H 3.446 -9.022 1.029 1.00 . A A . 9 THR HG1 1 1 8 4221 1 1 9 THR HG21 H 3.207 -8.398 4.665 1.00 . A A . 9 THR HG21 1 1 8 4222 1 1 9 THR HG22 H 3.516 -10.066 4.174 1.00 . A A . 9 THR HG22 1 1 8 4223 1 1 9 THR HG23 H 4.841 -9.057 4.764 1.00 . A A . 9 THR HG23 1 1 8 4224 1 1 9 THR N N 1.978 -7.587 2.751 1.00 . A A . 9 THR N 1 1 8 4225 1 1 9 THR O O 4.516 -5.654 1.274 1.00 . A A . 9 THR O 1 1 8 4226 1 1 9 THR OG1 O 3.706 -9.513 1.814 1.00 . A A . 9 THR OG1 1 1 8 4227 1 1 10 ALA C C 3.123 -4.686 -0.642 1.00 . A A . 10 ALA C 1 1 8 4228 1 1 10 ALA CA C 3.190 -6.160 -1.026 1.00 . A A . 10 ALA CA 1 1 8 4229 1 1 10 ALA CB C 2.036 -6.412 -2.003 1.00 . A A . 10 ALA CB 1 1 8 4230 1 1 10 ALA H H 2.298 -7.579 0.338 1.00 . A A . 10 ALA H 1 1 8 4231 1 1 10 ALA HA H 4.150 -6.400 -1.455 1.00 . A A . 10 ALA HA 1 1 8 4232 1 1 10 ALA HB1 H 1.101 -6.304 -1.472 1.00 . A A . 10 ALA HB1 1 1 8 4233 1 1 10 ALA HB2 H 2.067 -5.685 -2.806 1.00 . A A . 10 ALA HB2 1 1 8 4234 1 1 10 ALA HB3 H 2.108 -7.409 -2.411 1.00 . A A . 10 ALA HB3 1 1 8 4235 1 1 10 ALA N N 2.971 -6.871 0.268 1.00 . A A . 10 ALA N 1 1 8 4236 1 1 10 ALA O O 3.832 -3.834 -1.139 1.00 . A A . 10 ALA O 1 1 8 4237 1 1 11 CYS C C 3.315 -2.592 1.448 1.00 . A A . 11 CYS C 1 1 8 4238 1 1 11 CYS CA C 2.016 -3.057 0.787 1.00 . A A . 11 CYS CA 1 1 8 4239 1 1 11 CYS CB C 0.814 -3.149 1.732 1.00 . A A . 11 CYS CB 1 1 8 4240 1 1 11 CYS H H 1.686 -5.151 0.647 1.00 . A A . 11 CYS H 1 1 8 4241 1 1 11 CYS HA H 1.797 -2.404 -0.042 1.00 . A A . 11 CYS HA 1 1 8 4242 1 1 11 CYS HB2 H 1.052 -3.746 2.602 1.00 . A A . 11 CYS HB2 1 1 8 4243 1 1 11 CYS HB3 H 0.485 -2.166 2.024 1.00 . A A . 11 CYS HB3 1 1 8 4244 1 1 11 CYS N N 2.233 -4.429 0.276 1.00 . A A . 11 CYS N 1 1 8 4245 1 1 11 CYS O O 3.948 -1.695 0.927 1.00 . A A . 11 CYS O 1 1 8 4246 1 1 11 CYS SG S -0.518 -3.952 0.811 1.00 . A A . 11 CYS SG 1 1 8 4247 1 1 12 ARG C C 6.032 -2.431 2.204 1.00 . A A . 12 ARG C 1 1 8 4248 1 1 12 ARG CA C 4.969 -2.775 3.240 1.00 . A A . 12 ARG CA 1 1 8 4249 1 1 12 ARG CB C 5.461 -3.922 4.118 1.00 . A A . 12 ARG CB 1 1 8 4250 1 1 12 ARG CD C 7.589 -4.354 5.361 1.00 . A A . 12 ARG CD 1 1 8 4251 1 1 12 ARG CG C 6.462 -3.348 5.117 1.00 . A A . 12 ARG CG 1 1 8 4252 1 1 12 ARG CZ C 9.003 -3.802 7.249 1.00 . A A . 12 ARG CZ 1 1 8 4253 1 1 12 ARG H H 3.174 -3.900 2.936 1.00 . A A . 12 ARG H 1 1 8 4254 1 1 12 ARG HA H 4.805 -1.901 3.850 1.00 . A A . 12 ARG HA 1 1 8 4255 1 1 12 ARG HB2 H 4.618 -4.354 4.637 1.00 . A A . 12 ARG HB2 1 1 8 4256 1 1 12 ARG HB3 H 5.949 -4.667 3.509 1.00 . A A . 12 ARG HB3 1 1 8 4257 1 1 12 ARG HD2 H 7.271 -5.335 5.042 1.00 . A A . 12 ARG HD2 1 1 8 4258 1 1 12 ARG HD3 H 8.463 -4.058 4.799 1.00 . A A . 12 ARG HD3 1 1 8 4259 1 1 12 ARG HE H 7.327 -4.850 7.441 1.00 . A A . 12 ARG HE 1 1 8 4260 1 1 12 ARG HG2 H 6.866 -2.431 4.713 1.00 . A A . 12 ARG HG2 1 1 8 4261 1 1 12 ARG HG3 H 5.952 -3.144 6.046 1.00 . A A . 12 ARG HG3 1 1 8 4262 1 1 12 ARG HH11 H 8.641 -2.083 6.289 1.00 . A A . 12 ARG HH11 1 1 8 4263 1 1 12 ARG HH12 H 10.096 -2.125 7.227 1.00 . A A . 12 ARG HH12 1 1 8 4264 1 1 12 ARG HH21 H 9.619 -5.384 8.311 1.00 . A A . 12 ARG HH21 1 1 8 4265 1 1 12 ARG HH22 H 10.649 -3.993 8.372 1.00 . A A . 12 ARG HH22 1 1 8 4266 1 1 12 ARG N N 3.710 -3.179 2.551 1.00 . A A . 12 ARG N 1 1 8 4267 1 1 12 ARG NE N 7.921 -4.388 6.813 1.00 . A A . 12 ARG NE 1 1 8 4268 1 1 12 ARG NH1 N 9.267 -2.574 6.894 1.00 . A A . 12 ARG NH1 1 1 8 4269 1 1 12 ARG NH2 N 9.820 -4.443 8.039 1.00 . A A . 12 ARG NH2 1 1 8 4270 1 1 12 ARG O O 6.891 -1.606 2.433 1.00 . A A . 12 ARG O 1 1 8 4271 1 1 13 HIS C C 6.723 -1.247 -0.284 1.00 . A A . 13 HIS C 1 1 8 4272 1 1 13 HIS CA C 7.003 -2.712 0.045 1.00 . A A . 13 HIS CA 1 1 8 4273 1 1 13 HIS CB C 6.807 -3.578 -1.203 1.00 . A A . 13 HIS CB 1 1 8 4274 1 1 13 HIS CD2 C 9.381 -3.918 -1.621 1.00 . A A . 13 HIS CD2 1 1 8 4275 1 1 13 HIS CE1 C 9.411 -3.483 -3.744 1.00 . A A . 13 HIS CE1 1 1 8 4276 1 1 13 HIS CG C 8.089 -3.627 -1.988 1.00 . A A . 13 HIS CG 1 1 8 4277 1 1 13 HIS H H 5.283 -3.713 0.869 1.00 . A A . 13 HIS H 1 1 8 4278 1 1 13 HIS HA H 7.994 -2.822 0.460 1.00 . A A . 13 HIS HA 1 1 8 4279 1 1 13 HIS HB2 H 6.526 -4.578 -0.905 1.00 . A A . 13 HIS HB2 1 1 8 4280 1 1 13 HIS HB3 H 6.026 -3.153 -1.817 1.00 . A A . 13 HIS HB3 1 1 8 4281 1 1 13 HIS HD1 H 7.373 -3.112 -3.913 1.00 . A A . 13 HIS HD1 1 1 8 4282 1 1 13 HIS HD2 H 9.702 -4.176 -0.623 1.00 . A A . 13 HIS HD2 1 1 8 4283 1 1 13 HIS HE1 H 9.747 -3.328 -4.758 1.00 . A A . 13 HIS HE1 1 1 8 4284 1 1 13 HIS N N 5.978 -3.050 1.059 1.00 . A A . 13 HIS N 1 1 8 4285 1 1 13 HIS ND1 N 8.133 -3.355 -3.345 1.00 . A A . 13 HIS ND1 1 1 8 4286 1 1 13 HIS NE2 N 10.215 -3.825 -2.734 1.00 . A A . 13 HIS NE2 1 1 8 4287 1 1 13 HIS O O 7.545 -0.386 -0.058 1.00 . A A . 13 HIS O 1 1 8 4288 1 1 14 ALA C C 5.614 1.468 -0.122 1.00 . A A . 14 ALA C 1 1 8 4289 1 1 14 ALA CA C 5.192 0.433 -1.169 1.00 . A A . 14 ALA CA 1 1 8 4290 1 1 14 ALA CB C 3.681 0.563 -1.369 1.00 . A A . 14 ALA CB 1 1 8 4291 1 1 14 ALA H H 4.924 -1.698 -0.977 1.00 . A A . 14 ALA H 1 1 8 4292 1 1 14 ALA HA H 5.665 0.686 -2.103 1.00 . A A . 14 ALA HA 1 1 8 4293 1 1 14 ALA HB1 H 3.337 -0.212 -2.036 1.00 . A A . 14 ALA HB1 1 1 8 4294 1 1 14 ALA HB2 H 3.180 0.473 -0.417 1.00 . A A . 14 ALA HB2 1 1 8 4295 1 1 14 ALA HB3 H 3.475 1.532 -1.805 1.00 . A A . 14 ALA HB3 1 1 8 4296 1 1 14 ALA N N 5.562 -0.969 -0.812 1.00 . A A . 14 ALA N 1 1 8 4297 1 1 14 ALA O O 6.190 2.483 -0.463 1.00 . A A . 14 ALA O 1 1 8 4298 1 1 15 LYS C C 7.293 2.345 2.204 1.00 . A A . 15 LYS C 1 1 8 4299 1 1 15 LYS CA C 5.760 2.268 2.147 1.00 . A A . 15 LYS CA 1 1 8 4300 1 1 15 LYS CB C 5.136 1.872 3.488 1.00 . A A . 15 LYS CB 1 1 8 4301 1 1 15 LYS CD C 6.172 3.858 4.611 1.00 . A A . 15 LYS CD 1 1 8 4302 1 1 15 LYS CE C 7.038 4.310 5.788 1.00 . A A . 15 LYS CE 1 1 8 4303 1 1 15 LYS CG C 6.044 2.334 4.624 1.00 . A A . 15 LYS CG 1 1 8 4304 1 1 15 LYS H H 4.886 0.447 1.432 1.00 . A A . 15 LYS H 1 1 8 4305 1 1 15 LYS HA H 5.370 3.237 1.847 1.00 . A A . 15 LYS HA 1 1 8 4306 1 1 15 LYS HB2 H 4.161 2.333 3.574 1.00 . A A . 15 LYS HB2 1 1 8 4307 1 1 15 LYS HB3 H 5.009 0.801 3.547 1.00 . A A . 15 LYS HB3 1 1 8 4308 1 1 15 LYS HD2 H 6.627 4.172 3.683 1.00 . A A . 15 LYS HD2 1 1 8 4309 1 1 15 LYS HD3 H 5.192 4.303 4.702 1.00 . A A . 15 LYS HD3 1 1 8 4310 1 1 15 LYS HE2 H 7.990 3.800 5.751 1.00 . A A . 15 LYS HE2 1 1 8 4311 1 1 15 LYS HE3 H 7.199 5.377 5.728 1.00 . A A . 15 LYS HE3 1 1 8 4312 1 1 15 LYS HG2 H 5.626 2.005 5.563 1.00 . A A . 15 LYS HG2 1 1 8 4313 1 1 15 LYS HG3 H 7.016 1.891 4.481 1.00 . A A . 15 LYS HG3 1 1 8 4314 1 1 15 LYS HZ1 H 5.363 4.309 7.027 1.00 . A A . 15 LYS HZ1 1 1 8 4315 1 1 15 LYS HZ2 H 6.371 2.953 7.217 1.00 . A A . 15 LYS HZ2 1 1 8 4316 1 1 15 LYS HZ3 H 6.832 4.460 7.856 1.00 . A A . 15 LYS HZ3 1 1 8 4317 1 1 15 LYS N N 5.351 1.256 1.138 1.00 . A A . 15 LYS N 1 1 8 4318 1 1 15 LYS NZ N 6.349 3.983 7.068 1.00 . A A . 15 LYS NZ 1 1 8 4319 1 1 15 LYS O O 7.843 3.425 2.134 1.00 . A A . 15 LYS O 1 1 8 4320 1 1 16 SER C C 10.081 1.302 0.964 1.00 . A A . 16 SER C 1 1 8 4321 1 1 16 SER CA C 9.503 1.368 2.378 1.00 . A A . 16 SER CA 1 1 8 4322 1 1 16 SER CB C 10.072 0.191 3.163 1.00 . A A . 16 SER CB 1 1 8 4323 1 1 16 SER H H 7.607 0.363 2.387 1.00 . A A . 16 SER H 1 1 8 4324 1 1 16 SER HA H 9.793 2.291 2.851 1.00 . A A . 16 SER HA 1 1 8 4325 1 1 16 SER HB2 H 9.269 -0.358 3.627 1.00 . A A . 16 SER HB2 1 1 8 4326 1 1 16 SER HB3 H 10.584 -0.458 2.465 1.00 . A A . 16 SER HB3 1 1 8 4327 1 1 16 SER HG H 10.430 0.882 4.945 1.00 . A A . 16 SER HG 1 1 8 4328 1 1 16 SER N N 8.014 1.255 2.327 1.00 . A A . 16 SER N 1 1 8 4329 1 1 16 SER O O 11.269 1.139 0.768 1.00 . A A . 16 SER O 1 1 8 4330 1 1 16 SER OG O 10.954 0.674 4.168 1.00 . A A . 16 SER OG 1 1 8 4331 1 1 17 LEU C C 10.093 2.724 -1.990 1.00 . A A . 17 LEU C 1 1 8 4332 1 1 17 LEU CA C 9.659 1.372 -1.439 1.00 . A A . 17 LEU CA 1 1 8 4333 1 1 17 LEU CB C 8.392 1.089 -2.230 1.00 . A A . 17 LEU CB 1 1 8 4334 1 1 17 LEU CD1 C 7.105 -0.591 -3.441 1.00 . A A . 17 LEU CD1 1 1 8 4335 1 1 17 LEU CD2 C 9.636 -0.492 -3.606 1.00 . A A . 17 LEU CD2 1 1 8 4336 1 1 17 LEU CG C 8.418 -0.350 -2.695 1.00 . A A . 17 LEU CG 1 1 8 4337 1 1 17 LEU H H 8.287 1.546 0.166 1.00 . A A . 17 LEU H 1 1 8 4338 1 1 17 LEU HA H 10.348 0.574 -1.653 1.00 . A A . 17 LEU HA 1 1 8 4339 1 1 17 LEU HB2 H 7.530 1.254 -1.600 1.00 . A A . 17 LEU HB2 1 1 8 4340 1 1 17 LEU HB3 H 8.347 1.740 -3.090 1.00 . A A . 17 LEU HB3 1 1 8 4341 1 1 17 LEU HD11 H 6.647 0.366 -3.654 1.00 . A A . 17 LEU HD11 1 1 8 4342 1 1 17 LEU HD12 H 7.300 -1.115 -4.364 1.00 . A A . 17 LEU HD12 1 1 8 4343 1 1 17 LEU HD13 H 6.441 -1.174 -2.820 1.00 . A A . 17 LEU HD13 1 1 8 4344 1 1 17 LEU HD21 H 10.010 0.499 -3.830 1.00 . A A . 17 LEU HD21 1 1 8 4345 1 1 17 LEU HD22 H 10.400 -1.055 -3.090 1.00 . A A . 17 LEU HD22 1 1 8 4346 1 1 17 LEU HD23 H 9.357 -0.992 -4.521 1.00 . A A . 17 LEU HD23 1 1 8 4347 1 1 17 LEU HG H 8.513 -0.964 -1.814 1.00 . A A . 17 LEU HG 1 1 8 4348 1 1 17 LEU N N 9.237 1.423 -0.017 1.00 . A A . 17 LEU N 1 1 8 4349 1 1 17 LEU O O 11.216 2.957 -2.391 1.00 . A A . 17 LEU O 1 1 8 4350 1 1 18 GLY C C 8.023 5.429 -3.072 1.00 . A A . 18 GLY C 1 1 8 4351 1 1 18 GLY CA C 9.367 4.964 -2.511 1.00 . A A . 18 GLY CA 1 1 8 4352 1 1 18 GLY H H 8.246 3.349 -1.667 1.00 . A A . 18 GLY H 1 1 8 4353 1 1 18 GLY HA2 H 9.721 5.608 -1.719 1.00 . A A . 18 GLY HA2 1 1 8 4354 1 1 18 GLY HA3 H 10.076 4.905 -3.322 1.00 . A A . 18 GLY HA3 1 1 8 4355 1 1 18 GLY N N 9.133 3.597 -1.997 1.00 . A A . 18 GLY N 1 1 8 4356 1 1 18 GLY O O 7.769 6.609 -3.209 1.00 . A A . 18 GLY O 1 1 8 4357 1 1 19 ASN C C 5.025 5.514 -2.800 1.00 . A A . 19 ASN C 1 1 8 4358 1 1 19 ASN CA C 5.837 4.895 -3.942 1.00 . A A . 19 ASN CA 1 1 8 4359 1 1 19 ASN CB C 5.135 3.661 -4.518 1.00 . A A . 19 ASN CB 1 1 8 4360 1 1 19 ASN CG C 5.581 3.341 -5.943 1.00 . A A . 19 ASN CG 1 1 8 4361 1 1 19 ASN H H 7.340 3.549 -3.293 1.00 . A A . 19 ASN H 1 1 8 4362 1 1 19 ASN HA H 6.000 5.629 -4.719 1.00 . A A . 19 ASN HA 1 1 8 4363 1 1 19 ASN HB2 H 5.319 2.794 -3.920 1.00 . A A . 19 ASN HB2 1 1 8 4364 1 1 19 ASN HB3 H 4.079 3.810 -4.513 1.00 . A A . 19 ASN HB3 1 1 8 4365 1 1 19 ASN HD21 H 4.781 1.524 -5.859 1.00 . A A . 19 ASN HD21 1 1 8 4366 1 1 19 ASN HD22 H 5.545 1.914 -7.327 1.00 . A A . 19 ASN HD22 1 1 8 4367 1 1 19 ASN N N 7.155 4.504 -3.397 1.00 . A A . 19 ASN N 1 1 8 4368 1 1 19 ASN ND2 N 5.278 2.163 -6.417 1.00 . A A . 19 ASN ND2 1 1 8 4369 1 1 19 ASN O O 4.925 6.724 -2.751 1.00 . A A . 19 ASN O 1 1 8 4370 1 1 19 ASN OD1 O 6.195 4.144 -6.617 1.00 . A A . 19 ASN OD1 1 1 8 4371 1 1 20 CYS C C 2.913 6.532 -1.185 1.00 . A A . 20 CYS C 1 1 8 4372 1 1 20 CYS CA C 3.661 5.261 -0.766 1.00 . A A . 20 CYS CA 1 1 8 4373 1 1 20 CYS CB C 4.622 5.593 0.377 1.00 . A A . 20 CYS CB 1 1 8 4374 1 1 20 CYS H H 4.581 3.750 -1.988 1.00 . A A . 20 CYS H 1 1 8 4375 1 1 20 CYS HA H 2.958 4.516 -0.430 1.00 . A A . 20 CYS HA 1 1 8 4376 1 1 20 CYS HB2 H 5.368 4.818 0.438 1.00 . A A . 20 CYS HB2 1 1 8 4377 1 1 20 CYS HB3 H 5.099 6.533 0.149 1.00 . A A . 20 CYS HB3 1 1 8 4378 1 1 20 CYS N N 4.467 4.723 -1.909 1.00 . A A . 20 CYS N 1 1 8 4379 1 1 20 CYS O O 2.714 7.415 -0.376 1.00 . A A . 20 CYS O 1 1 8 4380 1 1 20 CYS SG S 3.825 5.693 2.001 1.00 . A A . 20 CYS SG 1 1 8 4381 1 1 21 ARG C C 2.102 7.983 -4.492 1.00 . A A . 21 ARG C 1 1 8 4382 1 1 21 ARG CA C 1.785 7.764 -3.007 1.00 . A A . 21 ARG CA 1 1 8 4383 1 1 21 ARG CB C 2.190 9.038 -2.277 1.00 . A A . 21 ARG CB 1 1 8 4384 1 1 21 ARG CD C 1.840 10.063 -0.020 1.00 . A A . 21 ARG CD 1 1 8 4385 1 1 21 ARG CG C 1.161 9.346 -1.188 1.00 . A A . 21 ARG CG 1 1 8 4386 1 1 21 ARG CZ C 1.142 11.737 1.589 1.00 . A A . 21 ARG CZ 1 1 8 4387 1 1 21 ARG H H 2.726 5.841 -3.012 1.00 . A A . 21 ARG H 1 1 8 4388 1 1 21 ARG HA H 0.723 7.628 -2.883 1.00 . A A . 21 ARG HA 1 1 8 4389 1 1 21 ARG HB2 H 3.160 8.865 -1.835 1.00 . A A . 21 ARG HB2 1 1 8 4390 1 1 21 ARG HB3 H 2.243 9.860 -2.974 1.00 . A A . 21 ARG HB3 1 1 8 4391 1 1 21 ARG HD2 H 2.372 9.345 0.586 1.00 . A A . 21 ARG HD2 1 1 8 4392 1 1 21 ARG HD3 H 2.535 10.795 -0.402 1.00 . A A . 21 ARG HD3 1 1 8 4393 1 1 21 ARG HE H -0.127 10.449 0.768 1.00 . A A . 21 ARG HE 1 1 8 4394 1 1 21 ARG HG2 H 0.383 9.973 -1.597 1.00 . A A . 21 ARG HG2 1 1 8 4395 1 1 21 ARG HG3 H 0.730 8.421 -0.832 1.00 . A A . 21 ARG HG3 1 1 8 4396 1 1 21 ARG HH11 H 2.792 10.838 2.279 1.00 . A A . 21 ARG HH11 1 1 8 4397 1 1 21 ARG HH12 H 2.478 12.418 2.915 1.00 . A A . 21 ARG HH12 1 1 8 4398 1 1 21 ARG HH21 H -0.431 12.866 1.081 1.00 . A A . 21 ARG HH21 1 1 8 4399 1 1 21 ARG HH22 H 0.653 13.567 2.236 1.00 . A A . 21 ARG HH22 1 1 8 4400 1 1 21 ARG N N 2.522 6.596 -2.434 1.00 . A A . 21 ARG N 1 1 8 4401 1 1 21 ARG NE N 0.806 10.745 0.809 1.00 . A A . 21 ARG NE 1 1 8 4402 1 1 21 ARG NH1 N 2.221 11.657 2.318 1.00 . A A . 21 ARG NH1 1 1 8 4403 1 1 21 ARG NH2 N 0.396 12.806 1.639 1.00 . A A . 21 ARG NH2 1 1 8 4404 1 1 21 ARG O O 1.371 8.675 -5.172 1.00 . A A . 21 ARG O 1 1 8 4405 1 1 22 THR C C 2.831 6.522 -7.284 1.00 . A A . 22 THR C 1 1 8 4406 1 1 22 THR CA C 3.454 7.656 -6.472 1.00 . A A . 22 THR CA 1 1 8 4407 1 1 22 THR CB C 4.968 7.683 -6.693 1.00 . A A . 22 THR CB 1 1 8 4408 1 1 22 THR CG2 C 5.649 8.411 -5.533 1.00 . A A . 22 THR CG2 1 1 8 4409 1 1 22 THR H H 3.760 6.870 -4.501 1.00 . A A . 22 THR H 1 1 8 4410 1 1 22 THR HA H 3.023 8.597 -6.782 1.00 . A A . 22 THR HA 1 1 8 4411 1 1 22 THR HB H 5.192 8.205 -7.610 1.00 . A A . 22 THR HB 1 1 8 4412 1 1 22 THR HG1 H 4.848 5.786 -6.283 1.00 . A A . 22 THR HG1 1 1 8 4413 1 1 22 THR HG21 H 4.900 8.764 -4.839 1.00 . A A . 22 THR HG21 1 1 8 4414 1 1 22 THR HG22 H 6.319 7.734 -5.026 1.00 . A A . 22 THR HG22 1 1 8 4415 1 1 22 THR HG23 H 6.208 9.252 -5.915 1.00 . A A . 22 THR HG23 1 1 8 4416 1 1 22 THR N N 3.159 7.429 -5.030 1.00 . A A . 22 THR N 1 1 8 4417 1 1 22 THR O O 2.624 6.630 -8.476 1.00 . A A . 22 THR O 1 1 8 4418 1 1 22 THR OG1 O 5.451 6.350 -6.774 1.00 . A A . 22 THR OG1 1 1 8 4419 1 1 23 SER C C 0.463 4.290 -6.866 1.00 . A A . 23 SER C 1 1 8 4420 1 1 23 SER CA C 1.913 4.286 -7.342 1.00 . A A . 23 SER CA 1 1 8 4421 1 1 23 SER CB C 2.679 3.021 -6.950 1.00 . A A . 23 SER CB 1 1 8 4422 1 1 23 SER H H 2.697 5.365 -5.667 1.00 . A A . 23 SER H 1 1 8 4423 1 1 23 SER HA H 1.928 4.444 -8.410 1.00 . A A . 23 SER HA 1 1 8 4424 1 1 23 SER HB2 H 3.260 3.185 -6.050 1.00 . A A . 23 SER HB2 1 1 8 4425 1 1 23 SER HB3 H 1.973 2.222 -6.777 1.00 . A A . 23 SER HB3 1 1 8 4426 1 1 23 SER HG H 3.049 2.205 -8.678 1.00 . A A . 23 SER HG 1 1 8 4427 1 1 23 SER N N 2.527 5.434 -6.632 1.00 . A A . 23 SER N 1 1 8 4428 1 1 23 SER O O 0.202 4.276 -5.684 1.00 . A A . 23 SER O 1 1 8 4429 1 1 23 SER OG O 3.550 2.702 -8.027 1.00 . A A . 23 SER OG 1 1 8 4430 1 1 24 GLN C C -2.243 2.993 -6.563 1.00 . A A . 24 GLN C 1 1 8 4431 1 1 24 GLN CA C -1.898 4.333 -7.213 1.00 . A A . 24 GLN CA 1 1 8 4432 1 1 24 GLN CB C -2.888 4.653 -8.336 1.00 . A A . 24 GLN CB 1 1 8 4433 1 1 24 GLN CD C -4.346 6.430 -9.322 1.00 . A A . 24 GLN CD 1 1 8 4434 1 1 24 GLN CG C -3.301 6.123 -8.247 1.00 . A A . 24 GLN CG 1 1 8 4435 1 1 24 GLN H H -0.322 4.340 -8.699 1.00 . A A . 24 GLN H 1 1 8 4436 1 1 24 GLN HA H -1.959 5.101 -6.454 1.00 . A A . 24 GLN HA 1 1 8 4437 1 1 24 GLN HB2 H -2.419 4.463 -9.291 1.00 . A A . 24 GLN HB2 1 1 8 4438 1 1 24 GLN HB3 H -3.764 4.031 -8.232 1.00 . A A . 24 GLN HB3 1 1 8 4439 1 1 24 GLN HE21 H -3.001 6.957 -10.683 1.00 . A A . 24 GLN HE21 1 1 8 4440 1 1 24 GLN HE22 H -4.617 7.044 -11.191 1.00 . A A . 24 GLN HE22 1 1 8 4441 1 1 24 GLN HG2 H -3.717 6.320 -7.270 1.00 . A A . 24 GLN HG2 1 1 8 4442 1 1 24 GLN HG3 H -2.436 6.751 -8.405 1.00 . A A . 24 GLN HG3 1 1 8 4443 1 1 24 GLN N N -0.504 4.320 -7.737 1.00 . A A . 24 GLN N 1 1 8 4444 1 1 24 GLN NE2 N -3.955 6.844 -10.496 1.00 . A A . 24 GLN NE2 1 1 8 4445 1 1 24 GLN O O -2.890 2.958 -5.535 1.00 . A A . 24 GLN O 1 1 8 4446 1 1 24 GLN OE1 O -5.531 6.289 -9.091 1.00 . A A . 24 GLN OE1 1 1 8 4447 1 1 25 LYS C C -1.217 0.237 -5.340 1.00 . A A . 25 LYS C 1 1 8 4448 1 1 25 LYS CA C -2.174 0.596 -6.479 1.00 . A A . 25 LYS CA 1 1 8 4449 1 1 25 LYS CB C -2.141 -0.528 -7.497 1.00 . A A . 25 LYS CB 1 1 8 4450 1 1 25 LYS CD C -3.691 -2.420 -8.112 1.00 . A A . 25 LYS CD 1 1 8 4451 1 1 25 LYS CE C -4.843 -1.737 -8.852 1.00 . A A . 25 LYS CE 1 1 8 4452 1 1 25 LYS CG C -3.194 -1.504 -6.992 1.00 . A A . 25 LYS CG 1 1 8 4453 1 1 25 LYS H H -1.312 1.891 -7.949 1.00 . A A . 25 LYS H 1 1 8 4454 1 1 25 LYS HA H -3.178 0.675 -6.093 1.00 . A A . 25 LYS HA 1 1 8 4455 1 1 25 LYS HB2 H -2.372 -0.139 -8.479 1.00 . A A . 25 LYS HB2 1 1 8 4456 1 1 25 LYS HB3 H -1.173 -1.000 -7.474 1.00 . A A . 25 LYS HB3 1 1 8 4457 1 1 25 LYS HD2 H -2.882 -2.618 -8.800 1.00 . A A . 25 LYS HD2 1 1 8 4458 1 1 25 LYS HD3 H -4.044 -3.349 -7.689 1.00 . A A . 25 LYS HD3 1 1 8 4459 1 1 25 LYS HE2 H -5.780 -2.015 -8.392 1.00 . A A . 25 LYS HE2 1 1 8 4460 1 1 25 LYS HE3 H -4.720 -0.665 -8.798 1.00 . A A . 25 LYS HE3 1 1 8 4461 1 1 25 LYS HG2 H -2.762 -2.066 -6.178 1.00 . A A . 25 LYS HG2 1 1 8 4462 1 1 25 LYS HG3 H -4.010 -0.917 -6.598 1.00 . A A . 25 LYS HG3 1 1 8 4463 1 1 25 LYS HZ1 H -4.730 -3.199 -10.327 1.00 . A A . 25 LYS HZ1 1 1 8 4464 1 1 25 LYS HZ2 H -5.740 -1.891 -10.726 1.00 . A A . 25 LYS HZ2 1 1 8 4465 1 1 25 LYS HZ3 H -4.057 -1.706 -10.781 1.00 . A A . 25 LYS HZ3 1 1 8 4466 1 1 25 LYS N N -1.832 1.889 -7.124 1.00 . A A . 25 LYS N 1 1 8 4467 1 1 25 LYS NZ N -4.842 -2.167 -10.278 1.00 . A A . 25 LYS NZ 1 1 8 4468 1 1 25 LYS O O -1.207 -0.854 -4.804 1.00 . A A . 25 LYS O 1 1 8 4469 1 1 26 TYR C C 0.049 1.779 -2.712 1.00 . A A . 26 TYR C 1 1 8 4470 1 1 26 TYR CA C 0.563 0.930 -3.866 1.00 . A A . 26 TYR CA 1 1 8 4471 1 1 26 TYR CB C 1.936 1.466 -4.249 1.00 . A A . 26 TYR CB 1 1 8 4472 1 1 26 TYR CD1 C 1.859 -0.368 -5.916 1.00 . A A . 26 TYR CD1 1 1 8 4473 1 1 26 TYR CD2 C 3.760 -0.277 -4.410 1.00 . A A . 26 TYR CD2 1 1 8 4474 1 1 26 TYR CE1 C 2.385 -1.511 -6.509 1.00 . A A . 26 TYR CE1 1 1 8 4475 1 1 26 TYR CE2 C 4.286 -1.426 -5.012 1.00 . A A . 26 TYR CE2 1 1 8 4476 1 1 26 TYR CG C 2.549 0.245 -4.869 1.00 . A A . 26 TYR CG 1 1 8 4477 1 1 26 TYR CZ C 3.600 -2.047 -6.063 1.00 . A A . 26 TYR CZ 1 1 8 4478 1 1 26 TYR H H -0.455 2.021 -5.428 1.00 . A A . 26 TYR H 1 1 8 4479 1 1 26 TYR HA H 0.614 -0.137 -3.667 1.00 . A A . 26 TYR HA 1 1 8 4480 1 1 26 TYR HB2 H 1.822 2.295 -4.925 1.00 . A A . 26 TYR HB2 1 1 8 4481 1 1 26 TYR HB3 H 2.500 1.753 -3.377 1.00 . A A . 26 TYR HB3 1 1 8 4482 1 1 26 TYR HD1 H 0.923 0.039 -6.270 1.00 . A A . 26 TYR HD1 1 1 8 4483 1 1 26 TYR HD2 H 4.283 0.205 -3.600 1.00 . A A . 26 TYR HD2 1 1 8 4484 1 1 26 TYR HE1 H 1.834 -1.965 -7.310 1.00 . A A . 26 TYR HE1 1 1 8 4485 1 1 26 TYR HE2 H 5.220 -1.831 -4.660 1.00 . A A . 26 TYR HE2 1 1 8 4486 1 1 26 TYR HH H 3.453 -3.873 -6.600 1.00 . A A . 26 TYR HH 1 1 8 4487 1 1 26 TYR N N -0.404 1.168 -4.966 1.00 . A A . 26 TYR N 1 1 8 4488 1 1 26 TYR O O -0.365 1.345 -1.657 1.00 . A A . 26 TYR O 1 1 8 4489 1 1 26 TYR OH O 4.117 -3.181 -6.655 1.00 . A A . 26 TYR OH 1 1 8 4490 1 1 27 ARG C C -1.806 3.739 -1.614 1.00 . A A . 27 ARG C 1 1 8 4491 1 1 27 ARG CA C -0.361 4.068 -2.005 1.00 . A A . 27 ARG CA 1 1 8 4492 1 1 27 ARG CB C -0.264 5.445 -2.675 1.00 . A A . 27 ARG CB 1 1 8 4493 1 1 27 ARG CD C -1.491 7.316 -3.776 1.00 . A A . 27 ARG CD 1 1 8 4494 1 1 27 ARG CG C -1.572 5.847 -3.358 1.00 . A A . 27 ARG CG 1 1 8 4495 1 1 27 ARG CZ C -2.073 9.249 -2.453 1.00 . A A . 27 ARG CZ 1 1 8 4496 1 1 27 ARG H H 0.435 3.338 -3.847 1.00 . A A . 27 ARG H 1 1 8 4497 1 1 27 ARG HA H 0.290 4.028 -1.147 1.00 . A A . 27 ARG HA 1 1 8 4498 1 1 27 ARG HB2 H -0.019 6.196 -1.941 1.00 . A A . 27 ARG HB2 1 1 8 4499 1 1 27 ARG HB3 H 0.516 5.410 -3.424 1.00 . A A . 27 ARG HB3 1 1 8 4500 1 1 27 ARG HD2 H -0.632 7.473 -4.410 1.00 . A A . 27 ARG HD2 1 1 8 4501 1 1 27 ARG HD3 H -2.392 7.586 -4.306 1.00 . A A . 27 ARG HD3 1 1 8 4502 1 1 27 ARG HE H -0.773 7.904 -1.826 1.00 . A A . 27 ARG HE 1 1 8 4503 1 1 27 ARG HG2 H -1.698 5.239 -4.241 1.00 . A A . 27 ARG HG2 1 1 8 4504 1 1 27 ARG HG3 H -2.406 5.718 -2.682 1.00 . A A . 27 ARG HG3 1 1 8 4505 1 1 27 ARG HH11 H -1.152 10.242 -3.926 1.00 . A A . 27 ARG HH11 1 1 8 4506 1 1 27 ARG HH12 H -2.424 11.102 -3.123 1.00 . A A . 27 ARG HH12 1 1 8 4507 1 1 27 ARG HH21 H -3.094 8.434 -0.977 1.00 . A A . 27 ARG HH21 1 1 8 4508 1 1 27 ARG HH22 H -3.569 10.056 -1.394 1.00 . A A . 27 ARG HH22 1 1 8 4509 1 1 27 ARG N N 0.093 3.050 -2.980 1.00 . A A . 27 ARG N 1 1 8 4510 1 1 27 ARG NE N -1.371 8.161 -2.557 1.00 . A A . 27 ARG NE 1 1 8 4511 1 1 27 ARG NH1 N -1.866 10.278 -3.227 1.00 . A A . 27 ARG NH1 1 1 8 4512 1 1 27 ARG NH2 N -2.990 9.255 -1.535 1.00 . A A . 27 ARG NH2 1 1 8 4513 1 1 27 ARG O O -2.163 3.675 -0.455 1.00 . A A . 27 ARG O 1 1 8 4514 1 1 28 ALA C C -4.290 1.700 -2.147 1.00 . A A . 28 ALA C 1 1 8 4515 1 1 28 ALA CA C -4.073 3.206 -2.303 1.00 . A A . 28 ALA CA 1 1 8 4516 1 1 28 ALA CB C -4.952 3.730 -3.440 1.00 . A A . 28 ALA CB 1 1 8 4517 1 1 28 ALA H H -2.339 3.587 -3.520 1.00 . A A . 28 ALA H 1 1 8 4518 1 1 28 ALA HA H -4.367 3.700 -1.388 1.00 . A A . 28 ALA HA 1 1 8 4519 1 1 28 ALA HB1 H -4.417 4.493 -3.986 1.00 . A A . 28 ALA HB1 1 1 8 4520 1 1 28 ALA HB2 H -5.202 2.917 -4.106 1.00 . A A . 28 ALA HB2 1 1 8 4521 1 1 28 ALA HB3 H -5.859 4.149 -3.029 1.00 . A A . 28 ALA HB3 1 1 8 4522 1 1 28 ALA N N -2.647 3.529 -2.591 1.00 . A A . 28 ALA N 1 1 8 4523 1 1 28 ALA O O -4.927 1.267 -1.207 1.00 . A A . 28 ALA O 1 1 8 4524 1 1 29 ASN C C -3.217 -1.102 -1.658 1.00 . A A . 29 ASN C 1 1 8 4525 1 1 29 ASN CA C -4.023 -0.576 -2.843 1.00 . A A . 29 ASN CA 1 1 8 4526 1 1 29 ASN CB C -3.709 -1.365 -4.114 1.00 . A A . 29 ASN CB 1 1 8 4527 1 1 29 ASN CG C -4.994 -1.938 -4.713 1.00 . A A . 29 ASN CG 1 1 8 4528 1 1 29 ASN H H -3.272 1.216 -3.796 1.00 . A A . 29 ASN H 1 1 8 4529 1 1 29 ASN HA H -5.064 -0.689 -2.605 1.00 . A A . 29 ASN HA 1 1 8 4530 1 1 29 ASN HB2 H -3.284 -0.678 -4.821 1.00 . A A . 29 ASN HB2 1 1 8 4531 1 1 29 ASN HB3 H -3.017 -2.170 -3.904 1.00 . A A . 29 ASN HB3 1 1 8 4532 1 1 29 ASN HD21 H -5.983 -0.219 -4.614 1.00 . A A . 29 ASN HD21 1 1 8 4533 1 1 29 ASN HD22 H -6.858 -1.522 -5.258 1.00 . A A . 29 ASN HD22 1 1 8 4534 1 1 29 ASN N N -3.786 0.882 -3.033 1.00 . A A . 29 ASN N 1 1 8 4535 1 1 29 ASN ND2 N -6.031 -1.162 -4.875 1.00 . A A . 29 ASN ND2 1 1 8 4536 1 1 29 ASN O O -3.330 -2.247 -1.275 1.00 . A A . 29 ASN O 1 1 8 4537 1 1 29 ASN OD1 O -5.056 -3.107 -5.038 1.00 . A A . 29 ASN OD1 1 1 8 4538 1 1 30 CYS C C -1.484 0.480 1.041 1.00 . A A . 30 CYS C 1 1 8 4539 1 1 30 CYS CA C -1.597 -0.711 0.091 1.00 . A A . 30 CYS CA 1 1 8 4540 1 1 30 CYS CB C -0.243 -1.227 -0.400 1.00 . A A . 30 CYS CB 1 1 8 4541 1 1 30 CYS H H -2.335 0.654 -1.395 1.00 . A A . 30 CYS H 1 1 8 4542 1 1 30 CYS HA H -2.137 -1.495 0.604 1.00 . A A . 30 CYS HA 1 1 8 4543 1 1 30 CYS HB2 H 0.126 -0.633 -1.226 1.00 . A A . 30 CYS HB2 1 1 8 4544 1 1 30 CYS HB3 H 0.459 -1.209 0.417 1.00 . A A . 30 CYS HB3 1 1 8 4545 1 1 30 CYS N N -2.408 -0.268 -1.072 1.00 . A A . 30 CYS N 1 1 8 4546 1 1 30 CYS O O -0.437 0.847 1.538 1.00 . A A . 30 CYS O 1 1 8 4547 1 1 30 CYS SG S -0.482 -2.940 -0.936 1.00 . A A . 30 CYS SG 1 1 8 4548 1 1 31 ALA C C -2.626 1.873 3.625 1.00 . A A . 31 ALA C 1 1 8 4549 1 1 31 ALA CA C -2.812 2.248 2.148 1.00 . A A . 31 ALA CA 1 1 8 4550 1 1 31 ALA CB C -4.244 2.731 1.909 1.00 . A A . 31 ALA CB 1 1 8 4551 1 1 31 ALA H H -3.424 0.700 0.819 1.00 . A A . 31 ALA H 1 1 8 4552 1 1 31 ALA HA H -2.133 3.039 1.862 1.00 . A A . 31 ALA HA 1 1 8 4553 1 1 31 ALA HB1 H -4.799 1.953 1.398 1.00 . A A . 31 ALA HB1 1 1 8 4554 1 1 31 ALA HB2 H -4.719 2.949 2.853 1.00 . A A . 31 ALA HB2 1 1 8 4555 1 1 31 ALA HB3 H -4.233 3.619 1.295 1.00 . A A . 31 ALA HB3 1 1 8 4556 1 1 31 ALA N N -2.630 1.063 1.263 1.00 . A A . 31 ALA N 1 1 8 4557 1 1 31 ALA O O -2.732 2.710 4.501 1.00 . A A . 31 ALA O 1 1 8 4558 1 1 32 LYS C C -0.693 0.374 5.720 1.00 . A A . 32 LYS C 1 1 8 4559 1 1 32 LYS CA C -2.154 0.172 5.322 1.00 . A A . 32 LYS CA 1 1 8 4560 1 1 32 LYS CB C -2.435 -1.332 5.364 1.00 . A A . 32 LYS CB 1 1 8 4561 1 1 32 LYS CD C -1.439 -3.631 5.148 1.00 . A A . 32 LYS CD 1 1 8 4562 1 1 32 LYS CE C -0.353 -4.395 5.909 1.00 . A A . 32 LYS CE 1 1 8 4563 1 1 32 LYS CG C -1.137 -2.132 5.205 1.00 . A A . 32 LYS CG 1 1 8 4564 1 1 32 LYS H H -2.272 -0.023 3.187 1.00 . A A . 32 LYS H 1 1 8 4565 1 1 32 LYS HA H -2.826 0.679 5.997 1.00 . A A . 32 LYS HA 1 1 8 4566 1 1 32 LYS HB2 H -2.895 -1.592 6.304 1.00 . A A . 32 LYS HB2 1 1 8 4567 1 1 32 LYS HB3 H -3.094 -1.574 4.547 1.00 . A A . 32 LYS HB3 1 1 8 4568 1 1 32 LYS HD2 H -2.402 -3.821 5.600 1.00 . A A . 32 LYS HD2 1 1 8 4569 1 1 32 LYS HD3 H -1.449 -3.961 4.120 1.00 . A A . 32 LYS HD3 1 1 8 4570 1 1 32 LYS HE2 H 0.220 -5.018 5.232 1.00 . A A . 32 LYS HE2 1 1 8 4571 1 1 32 LYS HE3 H 0.300 -3.678 6.383 1.00 . A A . 32 LYS HE3 1 1 8 4572 1 1 32 LYS HG2 H -0.643 -1.841 4.291 1.00 . A A . 32 LYS HG2 1 1 8 4573 1 1 32 LYS HG3 H -0.487 -1.937 6.046 1.00 . A A . 32 LYS HG3 1 1 8 4574 1 1 32 LYS HZ1 H -1.849 -5.684 6.573 1.00 . A A . 32 LYS HZ1 1 1 8 4575 1 1 32 LYS HZ2 H -0.326 -5.999 7.240 1.00 . A A . 32 LYS HZ2 1 1 8 4576 1 1 32 LYS HZ3 H -1.225 -4.661 7.779 1.00 . A A . 32 LYS HZ3 1 1 8 4577 1 1 32 LYS N N -2.351 0.630 3.914 1.00 . A A . 32 LYS N 1 1 8 4578 1 1 32 LYS NZ N -0.986 -5.249 6.955 1.00 . A A . 32 LYS NZ 1 1 8 4579 1 1 32 LYS O O -0.338 0.680 6.842 1.00 . A A . 32 LYS O 1 1 8 4580 1 1 33 THR C C 2.029 1.766 4.683 1.00 . A A . 33 THR C 1 1 8 4581 1 1 33 THR CA C 1.609 0.309 4.853 1.00 . A A . 33 THR CA 1 1 8 4582 1 1 33 THR CB C 2.128 -0.696 3.820 1.00 . A A . 33 THR CB 1 1 8 4583 1 1 33 THR CG2 C 3.019 -0.109 2.725 1.00 . A A . 33 THR CG2 1 1 8 4584 1 1 33 THR H H -0.266 -0.065 3.873 1.00 . A A . 33 THR H 1 1 8 4585 1 1 33 THR HA H 1.956 0.018 5.829 1.00 . A A . 33 THR HA 1 1 8 4586 1 1 33 THR HB H 1.274 -1.174 3.364 1.00 . A A . 33 THR HB 1 1 8 4587 1 1 33 THR HG1 H 2.353 -1.920 5.309 1.00 . A A . 33 THR HG1 1 1 8 4588 1 1 33 THR HG21 H 3.103 0.960 2.811 1.00 . A A . 33 THR HG21 1 1 8 4589 1 1 33 THR HG22 H 3.992 -0.572 2.785 1.00 . A A . 33 THR HG22 1 1 8 4590 1 1 33 THR HG23 H 2.584 -0.346 1.767 1.00 . A A . 33 THR HG23 1 1 8 4591 1 1 33 THR N N 0.130 0.180 4.736 1.00 . A A . 33 THR N 1 1 8 4592 1 1 33 THR O O 2.969 2.236 5.293 1.00 . A A . 33 THR O 1 1 8 4593 1 1 33 THR OG1 O 2.839 -1.708 4.510 1.00 . A A . 33 THR OG1 1 1 8 4594 1 1 34 CYS C C 0.751 4.743 4.542 1.00 . A A . 34 CYS C 1 1 8 4595 1 1 34 CYS CA C 1.617 3.905 3.599 1.00 . A A . 34 CYS CA 1 1 8 4596 1 1 34 CYS CB C 1.228 4.193 2.153 1.00 . A A . 34 CYS CB 1 1 8 4597 1 1 34 CYS H H 0.568 2.048 3.392 1.00 . A A . 34 CYS H 1 1 8 4598 1 1 34 CYS HA H 2.670 4.114 3.742 1.00 . A A . 34 CYS HA 1 1 8 4599 1 1 34 CYS HB2 H 1.677 3.439 1.530 1.00 . A A . 34 CYS HB2 1 1 8 4600 1 1 34 CYS HB3 H 0.156 4.150 2.046 1.00 . A A . 34 CYS HB3 1 1 8 4601 1 1 34 CYS N N 1.320 2.471 3.854 1.00 . A A . 34 CYS N 1 1 8 4602 1 1 34 CYS O O 1.001 5.913 4.756 1.00 . A A . 34 CYS O 1 1 8 4603 1 1 34 CYS SG S 1.838 5.827 1.677 1.00 . A A . 34 CYS SG 1 1 8 4604 1 1 35 GLU C C -2.060 5.825 5.276 1.00 . A A . 35 GLU C 1 1 8 4605 1 1 35 GLU CA C -1.184 4.840 6.036 1.00 . A A . 35 GLU CA 1 1 8 4606 1 1 35 GLU CB C -0.378 5.470 7.166 1.00 . A A . 35 GLU CB 1 1 8 4607 1 1 35 GLU CD C 1.083 4.670 9.049 1.00 . A A . 35 GLU CD 1 1 8 4608 1 1 35 GLU CG C 0.110 4.253 7.944 1.00 . A A . 35 GLU CG 1 1 8 4609 1 1 35 GLU H H -0.444 3.195 4.910 1.00 . A A . 35 GLU H 1 1 8 4610 1 1 35 GLU HA H -1.845 4.089 6.449 1.00 . A A . 35 GLU HA 1 1 8 4611 1 1 35 GLU HB2 H 0.444 6.052 6.775 1.00 . A A . 35 GLU HB2 1 1 8 4612 1 1 35 GLU HB3 H -1.007 6.063 7.810 1.00 . A A . 35 GLU HB3 1 1 8 4613 1 1 35 GLU HG2 H -0.758 3.758 8.359 1.00 . A A . 35 GLU HG2 1 1 8 4614 1 1 35 GLU HG3 H 0.598 3.583 7.250 1.00 . A A . 35 GLU HG3 1 1 8 4615 1 1 35 GLU N N -0.266 4.138 5.101 1.00 . A A . 35 GLU N 1 1 8 4616 1 1 35 GLU O O -2.467 6.869 5.744 1.00 . A A . 35 GLU O 1 1 8 4617 1 1 35 GLU OE1 O 2.210 5.005 8.723 1.00 . A A . 35 GLU OE1 1 1 8 4618 1 1 35 GLU OE2 O 0.684 4.648 10.201 1.00 . A A . 35 GLU OE2 1 1 8 4619 1 1 36 LEU C C -4.621 5.775 3.396 1.00 . A A . 36 LEU C 1 1 8 4620 1 1 36 LEU CA C -3.175 6.210 3.147 1.00 . A A . 36 LEU CA 1 1 8 4621 1 1 36 LEU CB C -2.722 5.844 1.740 1.00 . A A . 36 LEU CB 1 1 8 4622 1 1 36 LEU CD1 C -0.764 5.717 0.234 1.00 . A A . 36 LEU CD1 1 1 8 4623 1 1 36 LEU CD2 C -1.144 7.788 1.575 1.00 . A A . 36 LEU CD2 1 1 8 4624 1 1 36 LEU CG C -1.263 6.262 1.567 1.00 . A A . 36 LEU CG 1 1 8 4625 1 1 36 LEU H H -1.969 4.560 3.768 1.00 . A A . 36 LEU H 1 1 8 4626 1 1 36 LEU HA H -3.051 7.265 3.320 1.00 . A A . 36 LEU HA 1 1 8 4627 1 1 36 LEU HB2 H -2.812 4.782 1.652 1.00 . A A . 36 LEU HB2 1 1 8 4628 1 1 36 LEU HB3 H -3.326 6.296 0.973 1.00 . A A . 36 LEU HB3 1 1 8 4629 1 1 36 LEU HD11 H -1.542 5.799 -0.511 1.00 . A A . 36 LEU HD11 1 1 8 4630 1 1 36 LEU HD12 H 0.109 6.270 -0.082 1.00 . A A . 36 LEU HD12 1 1 8 4631 1 1 36 LEU HD13 H -0.512 4.679 0.380 1.00 . A A . 36 LEU HD13 1 1 8 4632 1 1 36 LEU HD21 H -2.012 8.220 1.100 1.00 . A A . 36 LEU HD21 1 1 8 4633 1 1 36 LEU HD22 H -1.079 8.139 2.594 1.00 . A A . 36 LEU HD22 1 1 8 4634 1 1 36 LEU HD23 H -0.255 8.080 1.037 1.00 . A A . 36 LEU HD23 1 1 8 4635 1 1 36 LEU HG H -0.671 5.831 2.364 1.00 . A A . 36 LEU HG 1 1 8 4636 1 1 36 LEU N N -2.330 5.418 4.071 1.00 . A A . 36 LEU N 1 1 8 4637 1 1 36 LEU O O -5.542 6.312 2.814 1.00 . A A . 36 LEU O 1 1 8 4638 1 1 37 CYS C C -6.855 5.253 5.600 1.00 . A A . 37 CYS C 1 1 8 4639 1 1 37 CYS CA C -6.248 4.378 4.502 1.00 . A A . 37 CYS CA 1 1 8 4640 1 1 37 CYS CB C -6.270 2.914 4.945 1.00 . A A . 37 CYS CB 1 1 8 4641 1 1 37 CYS H H -4.107 4.360 4.735 1.00 . A A . 37 CYS H 1 1 8 4642 1 1 37 CYS HA H -6.823 4.490 3.594 1.00 . A A . 37 CYS HA 1 1 8 4643 1 1 37 CYS HB2 H -5.905 2.288 4.145 1.00 . A A . 37 CYS HB2 1 1 8 4644 1 1 37 CYS HB3 H -5.639 2.791 5.814 1.00 . A A . 37 CYS HB3 1 1 8 4645 1 1 37 CYS N N -4.842 4.808 4.254 1.00 . A A . 37 CYS N 1 1 8 4646 1 1 37 CYS O O -6.680 4.919 6.761 1.00 . A A . 37 CYS O 1 1 8 4647 1 1 37 CYS OXT O -7.484 6.242 5.261 1.00 . A A . 37 CYS OXT 1 1 8 4648 1 1 37 CYS SG S -7.966 2.433 5.359 1.00 . A A . 37 CYS SG 1 1 9 4649 1 1 1 VAL C C -12.104 0.935 0.326 1.00 . A A . 1 VAL C 1 1 9 4650 1 1 1 VAL CA C -13.539 1.244 0.757 1.00 . A A . 1 VAL CA 1 1 9 4651 1 1 1 VAL CB C -14.133 0.020 1.456 1.00 . A A . 1 VAL CB 1 1 9 4652 1 1 1 VAL CG1 C -13.155 -0.496 2.513 1.00 . A A . 1 VAL CG1 1 1 9 4653 1 1 1 VAL CG2 C -15.449 0.411 2.131 1.00 . A A . 1 VAL CG2 1 1 9 4654 1 1 1 VAL H1 H -13.731 1.742 -1.257 1.00 . A A . 1 VAL H1 1 1 9 4655 1 1 1 VAL H2 H -14.997 0.789 -0.659 1.00 . A A . 1 VAL H2 1 1 9 4656 1 1 1 VAL H3 H -14.913 2.438 -0.251 1.00 . A A . 1 VAL H3 1 1 9 4657 1 1 1 VAL HA H -13.537 2.083 1.439 1.00 . A A . 1 VAL HA 1 1 9 4658 1 1 1 VAL HB H -14.312 -0.756 0.726 1.00 . A A . 1 VAL HB 1 1 9 4659 1 1 1 VAL HG11 H -12.776 0.336 3.088 1.00 . A A . 1 VAL HG11 1 1 9 4660 1 1 1 VAL HG12 H -13.664 -1.184 3.170 1.00 . A A . 1 VAL HG12 1 1 9 4661 1 1 1 VAL HG13 H -12.333 -1.001 2.027 1.00 . A A . 1 VAL HG13 1 1 9 4662 1 1 1 VAL HG21 H -16.043 1.000 1.449 1.00 . A A . 1 VAL HG21 1 1 9 4663 1 1 1 VAL HG22 H -15.993 -0.481 2.405 1.00 . A A . 1 VAL HG22 1 1 9 4664 1 1 1 VAL HG23 H -15.240 0.990 3.018 1.00 . A A . 1 VAL HG23 1 1 9 4665 1 1 1 VAL N N -14.356 1.579 -0.442 1.00 . A A . 1 VAL N 1 1 9 4666 1 1 1 VAL O O -11.863 0.048 -0.468 1.00 . A A . 1 VAL O 1 1 9 4667 1 1 2 CYS C C -9.012 0.710 1.616 1.00 . A A . 2 CYS C 1 1 9 4668 1 1 2 CYS CA C -9.734 1.400 0.454 1.00 . A A . 2 CYS CA 1 1 9 4669 1 1 2 CYS CB C -9.037 2.720 0.115 1.00 . A A . 2 CYS CB 1 1 9 4670 1 1 2 CYS H H -11.364 2.371 1.480 1.00 . A A . 2 CYS H 1 1 9 4671 1 1 2 CYS HA H -9.730 0.753 -0.412 1.00 . A A . 2 CYS HA 1 1 9 4672 1 1 2 CYS HB2 H -7.970 2.563 0.075 1.00 . A A . 2 CYS HB2 1 1 9 4673 1 1 2 CYS HB3 H -9.385 3.073 -0.845 1.00 . A A . 2 CYS HB3 1 1 9 4674 1 1 2 CYS N N -11.149 1.660 0.841 1.00 . A A . 2 CYS N 1 1 9 4675 1 1 2 CYS O O -9.563 0.591 2.691 1.00 . A A . 2 CYS O 1 1 9 4676 1 1 2 CYS SG S -9.416 3.953 1.385 1.00 . A A . 2 CYS SG 1 1 9 4677 1 1 3 ARG C C -6.032 -1.364 1.786 1.00 . A A . 3 ARG C 1 1 9 4678 1 1 3 ARG CA C -7.019 -0.423 2.477 1.00 . A A . 3 ARG CA 1 1 9 4679 1 1 3 ARG CB C -7.935 -1.276 3.359 1.00 . A A . 3 ARG CB 1 1 9 4680 1 1 3 ARG CD C -8.876 -3.481 2.633 1.00 . A A . 3 ARG CD 1 1 9 4681 1 1 3 ARG CG C -8.988 -1.963 2.487 1.00 . A A . 3 ARG CG 1 1 9 4682 1 1 3 ARG CZ C -10.123 -3.091 4.672 1.00 . A A . 3 ARG CZ 1 1 9 4683 1 1 3 ARG H H -7.385 0.376 0.527 1.00 . A A . 3 ARG H 1 1 9 4684 1 1 3 ARG HA H -6.486 0.303 3.075 1.00 . A A . 3 ARG HA 1 1 9 4685 1 1 3 ARG HB2 H -7.345 -2.021 3.872 1.00 . A A . 3 ARG HB2 1 1 9 4686 1 1 3 ARG HB3 H -8.431 -0.646 4.083 1.00 . A A . 3 ARG HB3 1 1 9 4687 1 1 3 ARG HD2 H -9.489 -3.963 1.884 1.00 . A A . 3 ARG HD2 1 1 9 4688 1 1 3 ARG HD3 H -7.848 -3.783 2.500 1.00 . A A . 3 ARG HD3 1 1 9 4689 1 1 3 ARG HE H -9.058 -4.740 4.372 1.00 . A A . 3 ARG HE 1 1 9 4690 1 1 3 ARG HG2 H -9.973 -1.642 2.795 1.00 . A A . 3 ARG HG2 1 1 9 4691 1 1 3 ARG HG3 H -8.829 -1.693 1.452 1.00 . A A . 3 ARG HG3 1 1 9 4692 1 1 3 ARG HH11 H -11.647 -3.233 3.382 1.00 . A A . 3 ARG HH11 1 1 9 4693 1 1 3 ARG HH12 H -11.924 -2.221 4.760 1.00 . A A . 3 ARG HH12 1 1 9 4694 1 1 3 ARG HH21 H -8.783 -2.763 6.123 1.00 . A A . 3 ARG HH21 1 1 9 4695 1 1 3 ARG HH22 H -10.304 -1.956 6.311 1.00 . A A . 3 ARG HH22 1 1 9 4696 1 1 3 ARG N N -7.800 0.263 1.408 1.00 . A A . 3 ARG N 1 1 9 4697 1 1 3 ARG NE N -9.340 -3.883 3.991 1.00 . A A . 3 ARG NE 1 1 9 4698 1 1 3 ARG NH1 N -11.325 -2.829 4.237 1.00 . A A . 3 ARG NH1 1 1 9 4699 1 1 3 ARG NH2 N -9.705 -2.562 5.789 1.00 . A A . 3 ARG NH2 1 1 9 4700 1 1 3 ARG O O -6.020 -1.468 0.577 1.00 . A A . 3 ARG O 1 1 9 4701 1 1 4 ASP C C -5.060 -3.835 0.884 1.00 . A A . 4 ASP C 1 1 9 4702 1 1 4 ASP CA C -4.247 -2.970 1.847 1.00 . A A . 4 ASP CA 1 1 9 4703 1 1 4 ASP CB C -3.564 -3.860 2.889 1.00 . A A . 4 ASP CB 1 1 9 4704 1 1 4 ASP CG C -4.094 -5.290 2.764 1.00 . A A . 4 ASP CG 1 1 9 4705 1 1 4 ASP H H -5.214 -1.970 3.499 1.00 . A A . 4 ASP H 1 1 9 4706 1 1 4 ASP HA H -3.515 -2.397 1.299 1.00 . A A . 4 ASP HA 1 1 9 4707 1 1 4 ASP HB2 H -2.497 -3.854 2.721 1.00 . A A . 4 ASP HB2 1 1 9 4708 1 1 4 ASP HB3 H -3.778 -3.488 3.879 1.00 . A A . 4 ASP HB3 1 1 9 4709 1 1 4 ASP N N -5.204 -2.052 2.523 1.00 . A A . 4 ASP N 1 1 9 4710 1 1 4 ASP O O -6.231 -4.067 1.110 1.00 . A A . 4 ASP O 1 1 9 4711 1 1 4 ASP OD1 O -5.275 -5.485 3.003 1.00 . A A . 4 ASP OD1 1 1 9 4712 1 1 4 ASP OD2 O -3.312 -6.165 2.431 1.00 . A A . 4 ASP OD2 1 1 9 4713 1 1 5 TRP C C -4.437 -6.285 -1.648 1.00 . A A . 5 TRP C 1 1 9 4714 1 1 5 TRP CA C -5.310 -5.162 -1.095 1.00 . A A . 5 TRP CA 1 1 9 4715 1 1 5 TRP CB C -5.870 -4.316 -2.239 1.00 . A A . 5 TRP CB 1 1 9 4716 1 1 5 TRP CD1 C -7.362 -2.459 -1.421 1.00 . A A . 5 TRP CD1 1 1 9 4717 1 1 5 TRP CD2 C -8.459 -4.408 -1.613 1.00 . A A . 5 TRP CD2 1 1 9 4718 1 1 5 TRP CE2 C -9.399 -3.453 -1.149 1.00 . A A . 5 TRP CE2 1 1 9 4719 1 1 5 TRP CE3 C -8.896 -5.725 -1.817 1.00 . A A . 5 TRP CE3 1 1 9 4720 1 1 5 TRP CG C -7.171 -3.745 -1.778 1.00 . A A . 5 TRP CG 1 1 9 4721 1 1 5 TRP CH2 C -11.145 -5.121 -1.109 1.00 . A A . 5 TRP CH2 1 1 9 4722 1 1 5 TRP CZ2 C -10.730 -3.802 -0.898 1.00 . A A . 5 TRP CZ2 1 1 9 4723 1 1 5 TRP CZ3 C -10.229 -6.077 -1.567 1.00 . A A . 5 TRP CZ3 1 1 9 4724 1 1 5 TRP H H -3.540 -4.148 -0.381 1.00 . A A . 5 TRP H 1 1 9 4725 1 1 5 TRP HA H -6.133 -5.593 -0.528 1.00 . A A . 5 TRP HA 1 1 9 4726 1 1 5 TRP HB2 H -5.179 -3.522 -2.479 1.00 . A A . 5 TRP HB2 1 1 9 4727 1 1 5 TRP HB3 H -6.039 -4.935 -3.107 1.00 . A A . 5 TRP HB3 1 1 9 4728 1 1 5 TRP HD1 H -6.599 -1.699 -1.430 1.00 . A A . 5 TRP HD1 1 1 9 4729 1 1 5 TRP HE1 H -9.073 -1.435 -0.748 1.00 . A A . 5 TRP HE1 1 1 9 4730 1 1 5 TRP HE3 H -8.197 -6.468 -2.171 1.00 . A A . 5 TRP HE3 1 1 9 4731 1 1 5 TRP HH2 H -12.170 -5.403 -0.919 1.00 . A A . 5 TRP HH2 1 1 9 4732 1 1 5 TRP HZ2 H -11.432 -3.059 -0.544 1.00 . A A . 5 TRP HZ2 1 1 9 4733 1 1 5 TRP HZ3 H -10.554 -7.094 -1.728 1.00 . A A . 5 TRP HZ3 1 1 9 4734 1 1 5 TRP N N -4.487 -4.323 -0.181 1.00 . A A . 5 TRP N 1 1 9 4735 1 1 5 TRP NE1 N -8.680 -2.280 -1.048 1.00 . A A . 5 TRP NE1 1 1 9 4736 1 1 5 TRP O O -4.931 -7.362 -1.916 1.00 . A A . 5 TRP O 1 1 9 4737 1 1 6 PHE C C -2.024 -7.992 -1.086 1.00 . A A . 6 PHE C 1 1 9 4738 1 1 6 PHE CA C -2.369 -7.223 -2.357 1.00 . A A . 6 PHE CA 1 1 9 4739 1 1 6 PHE CB C -1.040 -6.709 -2.899 1.00 . A A . 6 PHE CB 1 1 9 4740 1 1 6 PHE CD1 C -2.556 -5.576 -4.550 1.00 . A A . 6 PHE CD1 1 1 9 4741 1 1 6 PHE CD2 C -0.227 -4.915 -4.425 1.00 . A A . 6 PHE CD2 1 1 9 4742 1 1 6 PHE CE1 C -2.769 -4.645 -5.560 1.00 . A A . 6 PHE CE1 1 1 9 4743 1 1 6 PHE CE2 C -0.433 -3.983 -5.433 1.00 . A A . 6 PHE CE2 1 1 9 4744 1 1 6 PHE CG C -1.286 -5.707 -3.987 1.00 . A A . 6 PHE CG 1 1 9 4745 1 1 6 PHE CZ C -1.705 -3.851 -5.997 1.00 . A A . 6 PHE CZ 1 1 9 4746 1 1 6 PHE H H -2.687 -5.251 -1.629 1.00 . A A . 6 PHE H 1 1 9 4747 1 1 6 PHE HA H -2.939 -7.759 -3.101 1.00 . A A . 6 PHE HA 1 1 9 4748 1 1 6 PHE HB2 H -0.481 -6.242 -2.102 1.00 . A A . 6 PHE HB2 1 1 9 4749 1 1 6 PHE HB3 H -0.479 -7.535 -3.297 1.00 . A A . 6 PHE HB3 1 1 9 4750 1 1 6 PHE HD1 H -3.374 -6.187 -4.211 1.00 . A A . 6 PHE HD1 1 1 9 4751 1 1 6 PHE HD2 H 0.752 -5.017 -3.990 1.00 . A A . 6 PHE HD2 1 1 9 4752 1 1 6 PHE HE1 H -3.752 -4.547 -5.990 1.00 . A A . 6 PHE HE1 1 1 9 4753 1 1 6 PHE HE2 H 0.396 -3.379 -5.760 1.00 . A A . 6 PHE HE2 1 1 9 4754 1 1 6 PHE HZ H -1.869 -3.135 -6.774 1.00 . A A . 6 PHE HZ 1 1 9 4755 1 1 6 PHE N N -3.155 -6.090 -1.826 1.00 . A A . 6 PHE N 1 1 9 4756 1 1 6 PHE O O -2.815 -8.040 -0.165 1.00 . A A . 6 PHE O 1 1 9 4757 1 1 7 LYS C C -0.312 -8.143 1.231 1.00 . A A . 7 LYS C 1 1 9 4758 1 1 7 LYS CA C -0.586 -9.302 0.272 1.00 . A A . 7 LYS CA 1 1 9 4759 1 1 7 LYS CB C 0.669 -10.165 0.120 1.00 . A A . 7 LYS CB 1 1 9 4760 1 1 7 LYS CD C -0.719 -12.079 0.935 1.00 . A A . 7 LYS CD 1 1 9 4761 1 1 7 LYS CE C -1.575 -11.872 2.186 1.00 . A A . 7 LYS CE 1 1 9 4762 1 1 7 LYS CG C 0.612 -11.342 1.096 1.00 . A A . 7 LYS CG 1 1 9 4763 1 1 7 LYS H H -0.212 -8.550 -1.719 1.00 . A A . 7 LYS H 1 1 9 4764 1 1 7 LYS HA H -1.450 -9.867 0.593 1.00 . A A . 7 LYS HA 1 1 9 4765 1 1 7 LYS HB2 H 0.727 -10.539 -0.893 1.00 . A A . 7 LYS HB2 1 1 9 4766 1 1 7 LYS HB3 H 1.545 -9.570 0.334 1.00 . A A . 7 LYS HB3 1 1 9 4767 1 1 7 LYS HD2 H -1.240 -11.694 0.071 1.00 . A A . 7 LYS HD2 1 1 9 4768 1 1 7 LYS HD3 H -0.533 -13.135 0.804 1.00 . A A . 7 LYS HD3 1 1 9 4769 1 1 7 LYS HE2 H -0.965 -12.013 3.067 1.00 . A A . 7 LYS HE2 1 1 9 4770 1 1 7 LYS HE3 H -1.977 -10.870 2.185 1.00 . A A . 7 LYS HE3 1 1 9 4771 1 1 7 LYS HG2 H 1.428 -12.018 0.891 1.00 . A A . 7 LYS HG2 1 1 9 4772 1 1 7 LYS HG3 H 0.693 -10.975 2.108 1.00 . A A . 7 LYS HG3 1 1 9 4773 1 1 7 LYS HZ1 H -2.322 -13.807 1.990 1.00 . A A . 7 LYS HZ1 1 1 9 4774 1 1 7 LYS HZ2 H -3.148 -12.854 3.129 1.00 . A A . 7 LYS HZ2 1 1 9 4775 1 1 7 LYS HZ3 H -3.388 -12.601 1.465 1.00 . A A . 7 LYS HZ3 1 1 9 4776 1 1 7 LYS N N -0.870 -8.584 -0.994 1.00 . A A . 7 LYS N 1 1 9 4777 1 1 7 LYS NZ N -2.692 -12.858 2.194 1.00 . A A . 7 LYS NZ 1 1 9 4778 1 1 7 LYS O O 0.162 -7.110 0.803 1.00 . A A . 7 LYS O 1 1 9 4779 1 1 8 GLU C C 1.175 -6.654 3.177 1.00 . A A . 8 GLU C 1 1 9 4780 1 1 8 GLU CA C -0.284 -7.068 3.370 1.00 . A A . 8 GLU CA 1 1 9 4781 1 1 8 GLU CB C -0.538 -7.423 4.837 1.00 . A A . 8 GLU CB 1 1 9 4782 1 1 8 GLU CD C -2.166 -8.871 6.064 1.00 . A A . 8 GLU CD 1 1 9 4783 1 1 8 GLU CG C -2.020 -7.748 5.036 1.00 . A A . 8 GLU CG 1 1 9 4784 1 1 8 GLU H H -0.964 -9.065 2.875 1.00 . A A . 8 GLU H 1 1 9 4785 1 1 8 GLU HA H -0.902 -6.228 3.083 1.00 . A A . 8 GLU HA 1 1 9 4786 1 1 8 GLU HB2 H 0.061 -8.279 5.108 1.00 . A A . 8 GLU HB2 1 1 9 4787 1 1 8 GLU HB3 H -0.273 -6.584 5.463 1.00 . A A . 8 GLU HB3 1 1 9 4788 1 1 8 GLU HG2 H -2.537 -6.866 5.386 1.00 . A A . 8 GLU HG2 1 1 9 4789 1 1 8 GLU HG3 H -2.447 -8.069 4.098 1.00 . A A . 8 GLU HG3 1 1 9 4790 1 1 8 GLU N N -0.580 -8.244 2.502 1.00 . A A . 8 GLU N 1 1 9 4791 1 1 8 GLU O O 1.558 -5.551 3.514 1.00 . A A . 8 GLU O 1 1 9 4792 1 1 8 GLU OE1 O -1.391 -9.811 6.002 1.00 . A A . 8 GLU OE1 1 1 9 4793 1 1 8 GLU OE2 O -3.052 -8.773 6.898 1.00 . A A . 8 GLU OE2 1 1 9 4794 1 1 9 THR C C 3.617 -6.492 1.071 1.00 . A A . 9 THR C 1 1 9 4795 1 1 9 THR CA C 3.416 -7.127 2.446 1.00 . A A . 9 THR CA 1 1 9 4796 1 1 9 THR CB C 4.268 -8.366 2.692 1.00 . A A . 9 THR CB 1 1 9 4797 1 1 9 THR CG2 C 4.246 -8.576 4.206 1.00 . A A . 9 THR CG2 1 1 9 4798 1 1 9 THR H H 1.700 -8.404 2.366 1.00 . A A . 9 THR H 1 1 9 4799 1 1 9 THR HA H 3.658 -6.381 3.189 1.00 . A A . 9 THR HA 1 1 9 4800 1 1 9 THR HB H 5.284 -8.197 2.378 1.00 . A A . 9 THR HB 1 1 9 4801 1 1 9 THR HG1 H 3.645 -10.208 2.615 1.00 . A A . 9 THR HG1 1 1 9 4802 1 1 9 THR HG21 H 3.554 -7.864 4.643 1.00 . A A . 9 THR HG21 1 1 9 4803 1 1 9 THR HG22 H 3.920 -9.580 4.429 1.00 . A A . 9 THR HG22 1 1 9 4804 1 1 9 THR HG23 H 5.232 -8.411 4.612 1.00 . A A . 9 THR HG23 1 1 9 4805 1 1 9 THR N N 1.997 -7.513 2.640 1.00 . A A . 9 THR N 1 1 9 4806 1 1 9 THR O O 4.490 -5.663 0.929 1.00 . A A . 9 THR O 1 1 9 4807 1 1 9 THR OG1 O 3.701 -9.472 2.002 1.00 . A A . 9 THR OG1 1 1 9 4808 1 1 10 ALA C C 3.030 -4.715 -0.950 1.00 . A A . 10 ALA C 1 1 9 4809 1 1 10 ALA CA C 3.039 -6.207 -1.263 1.00 . A A . 10 ALA CA 1 1 9 4810 1 1 10 ALA CB C 1.851 -6.453 -2.202 1.00 . A A . 10 ALA CB 1 1 9 4811 1 1 10 ALA H H 2.141 -7.511 0.218 1.00 . A A . 10 ALA H 1 1 9 4812 1 1 10 ALA HA H 3.981 -6.489 -1.705 1.00 . A A . 10 ALA HA 1 1 9 4813 1 1 10 ALA HB1 H 1.235 -7.252 -1.817 1.00 . A A . 10 ALA HB1 1 1 9 4814 1 1 10 ALA HB2 H 1.251 -5.553 -2.270 1.00 . A A . 10 ALA HB2 1 1 9 4815 1 1 10 ALA HB3 H 2.209 -6.712 -3.188 1.00 . A A . 10 ALA HB3 1 1 9 4816 1 1 10 ALA N N 2.843 -6.843 0.076 1.00 . A A . 10 ALA N 1 1 9 4817 1 1 10 ALA O O 3.780 -3.912 -1.468 1.00 . A A . 10 ALA O 1 1 9 4818 1 1 11 CYS C C 3.193 -2.531 1.123 1.00 . A A . 11 CYS C 1 1 9 4819 1 1 11 CYS CA C 1.921 -3.012 0.416 1.00 . A A . 11 CYS CA 1 1 9 4820 1 1 11 CYS CB C 0.690 -3.130 1.319 1.00 . A A . 11 CYS CB 1 1 9 4821 1 1 11 CYS H H 1.560 -5.096 0.315 1.00 . A A . 11 CYS H 1 1 9 4822 1 1 11 CYS HA H 1.702 -2.360 -0.415 1.00 . A A . 11 CYS HA 1 1 9 4823 1 1 11 CYS HB2 H 0.887 -3.774 2.166 1.00 . A A . 11 CYS HB2 1 1 9 4824 1 1 11 CYS HB3 H 0.364 -2.159 1.650 1.00 . A A . 11 CYS HB3 1 1 9 4825 1 1 11 CYS N N 2.132 -4.397 -0.064 1.00 . A A . 11 CYS N 1 1 9 4826 1 1 11 CYS O O 3.827 -1.590 0.687 1.00 . A A . 11 CYS O 1 1 9 4827 1 1 11 CYS SG S -0.631 -3.866 0.323 1.00 . A A . 11 CYS SG 1 1 9 4828 1 1 12 ARG C C 5.958 -2.450 1.978 1.00 . A A . 12 ARG C 1 1 9 4829 1 1 12 ARG CA C 4.809 -2.736 2.940 1.00 . A A . 12 ARG CA 1 1 9 4830 1 1 12 ARG CB C 5.204 -3.838 3.920 1.00 . A A . 12 ARG CB 1 1 9 4831 1 1 12 ARG CD C 6.968 -4.274 5.642 1.00 . A A . 12 ARG CD 1 1 9 4832 1 1 12 ARG CG C 6.028 -3.222 5.050 1.00 . A A . 12 ARG CG 1 1 9 4833 1 1 12 ARG CZ C 9.354 -4.557 5.949 1.00 . A A . 12 ARG CZ 1 1 9 4834 1 1 12 ARG H H 3.052 -3.906 2.532 1.00 . A A . 12 ARG H 1 1 9 4835 1 1 12 ARG HA H 4.624 -1.828 3.493 1.00 . A A . 12 ARG HA 1 1 9 4836 1 1 12 ARG HB2 H 4.306 -4.284 4.321 1.00 . A A . 12 ARG HB2 1 1 9 4837 1 1 12 ARG HB3 H 5.794 -4.584 3.411 1.00 . A A . 12 ARG HB3 1 1 9 4838 1 1 12 ARG HD2 H 6.750 -4.401 6.692 1.00 . A A . 12 ARG HD2 1 1 9 4839 1 1 12 ARG HD3 H 6.824 -5.214 5.128 1.00 . A A . 12 ARG HD3 1 1 9 4840 1 1 12 ARG HE H 8.576 -2.987 5.014 1.00 . A A . 12 ARG HE 1 1 9 4841 1 1 12 ARG HG2 H 6.604 -2.396 4.657 1.00 . A A . 12 ARG HG2 1 1 9 4842 1 1 12 ARG HG3 H 5.361 -2.865 5.820 1.00 . A A . 12 ARG HG3 1 1 9 4843 1 1 12 ARG HH11 H 8.914 -4.176 7.865 1.00 . A A . 12 ARG HH11 1 1 9 4844 1 1 12 ARG HH12 H 10.273 -5.216 7.601 1.00 . A A . 12 ARG HH12 1 1 9 4845 1 1 12 ARG HH21 H 10.020 -5.108 4.143 1.00 . A A . 12 ARG HH21 1 1 9 4846 1 1 12 ARG HH22 H 10.901 -5.743 5.493 1.00 . A A . 12 ARG HH22 1 1 9 4847 1 1 12 ARG N N 3.580 -3.153 2.202 1.00 . A A . 12 ARG N 1 1 9 4848 1 1 12 ARG NE N 8.380 -3.828 5.477 1.00 . A A . 12 ARG NE 1 1 9 4849 1 1 12 ARG NH1 N 9.527 -4.657 7.239 1.00 . A A . 12 ARG NH1 1 1 9 4850 1 1 12 ARG NH2 N 10.154 -5.185 5.132 1.00 . A A . 12 ARG NH2 1 1 9 4851 1 1 12 ARG O O 6.798 -1.615 2.247 1.00 . A A . 12 ARG O 1 1 9 4852 1 1 13 HIS C C 6.875 -1.366 -0.453 1.00 . A A . 13 HIS C 1 1 9 4853 1 1 13 HIS CA C 7.133 -2.817 -0.065 1.00 . A A . 13 HIS CA 1 1 9 4854 1 1 13 HIS CB C 7.064 -3.751 -1.274 1.00 . A A . 13 HIS CB 1 1 9 4855 1 1 13 HIS CD2 C 9.226 -3.780 -2.755 1.00 . A A . 13 HIS CD2 1 1 9 4856 1 1 13 HIS CE1 C 10.503 -4.937 -1.456 1.00 . A A . 13 HIS CE1 1 1 9 4857 1 1 13 HIS CG C 8.482 -4.088 -1.646 1.00 . A A . 13 HIS CG 1 1 9 4858 1 1 13 HIS H H 5.341 -3.784 0.633 1.00 . A A . 13 HIS H 1 1 9 4859 1 1 13 HIS HA H 8.086 -2.883 0.445 1.00 . A A . 13 HIS HA 1 1 9 4860 1 1 13 HIS HB2 H 6.521 -4.647 -1.014 1.00 . A A . 13 HIS HB2 1 1 9 4861 1 1 13 HIS HB3 H 6.586 -3.253 -2.103 1.00 . A A . 13 HIS HB3 1 1 9 4862 1 1 13 HIS HD1 H 9.090 -5.206 0.047 1.00 . A A . 13 HIS HD1 1 1 9 4863 1 1 13 HIS HD2 H 8.860 -3.202 -3.586 1.00 . A A . 13 HIS HD2 1 1 9 4864 1 1 13 HIS HE1 H 11.357 -5.460 -1.054 1.00 . A A . 13 HIS HE1 1 1 9 4865 1 1 13 HIS N N 6.015 -3.115 0.860 1.00 . A A . 13 HIS N 1 1 9 4866 1 1 13 HIS ND1 N 9.318 -4.829 -0.828 1.00 . A A . 13 HIS ND1 1 1 9 4867 1 1 13 HIS NE2 N 10.504 -4.315 -2.637 1.00 . A A . 13 HIS NE2 1 1 9 4868 1 1 13 HIS O O 7.692 -0.495 -0.237 1.00 . A A . 13 HIS O 1 1 9 4869 1 1 14 ALA C C 5.475 1.221 -0.212 1.00 . A A . 14 ALA C 1 1 9 4870 1 1 14 ALA CA C 5.394 0.282 -1.423 1.00 . A A . 14 ALA CA 1 1 9 4871 1 1 14 ALA CB C 3.983 0.293 -2.016 1.00 . A A . 14 ALA CB 1 1 9 4872 1 1 14 ALA H H 5.089 -1.842 -1.173 1.00 . A A . 14 ALA H 1 1 9 4873 1 1 14 ALA HA H 6.089 0.631 -2.175 1.00 . A A . 14 ALA HA 1 1 9 4874 1 1 14 ALA HB1 H 3.558 -0.699 -1.935 1.00 . A A . 14 ALA HB1 1 1 9 4875 1 1 14 ALA HB2 H 3.367 0.993 -1.473 1.00 . A A . 14 ALA HB2 1 1 9 4876 1 1 14 ALA HB3 H 4.039 0.588 -3.058 1.00 . A A . 14 ALA HB3 1 1 9 4877 1 1 14 ALA N N 5.728 -1.112 -1.019 1.00 . A A . 14 ALA N 1 1 9 4878 1 1 14 ALA O O 5.413 2.420 -0.360 1.00 . A A . 14 ALA O 1 1 9 4879 1 1 15 LYS C C 7.133 2.222 2.308 1.00 . A A . 15 LYS C 1 1 9 4880 1 1 15 LYS CA C 5.686 1.744 2.121 1.00 . A A . 15 LYS CA 1 1 9 4881 1 1 15 LYS CB C 5.180 1.128 3.434 1.00 . A A . 15 LYS CB 1 1 9 4882 1 1 15 LYS CD C 5.510 1.037 5.922 1.00 . A A . 15 LYS CD 1 1 9 4883 1 1 15 LYS CE C 5.228 2.152 6.931 1.00 . A A . 15 LYS CE 1 1 9 4884 1 1 15 LYS CG C 6.012 1.644 4.610 1.00 . A A . 15 LYS CG 1 1 9 4885 1 1 15 LYS H H 5.671 -0.203 1.181 1.00 . A A . 15 LYS H 1 1 9 4886 1 1 15 LYS HA H 5.060 2.592 1.859 1.00 . A A . 15 LYS HA 1 1 9 4887 1 1 15 LYS HB2 H 4.142 1.393 3.590 1.00 . A A . 15 LYS HB2 1 1 9 4888 1 1 15 LYS HB3 H 5.274 0.053 3.388 1.00 . A A . 15 LYS HB3 1 1 9 4889 1 1 15 LYS HD2 H 4.610 0.469 5.740 1.00 . A A . 15 LYS HD2 1 1 9 4890 1 1 15 LYS HD3 H 6.268 0.381 6.324 1.00 . A A . 15 LYS HD3 1 1 9 4891 1 1 15 LYS HE2 H 6.092 2.799 7.001 1.00 . A A . 15 LYS HE2 1 1 9 4892 1 1 15 LYS HE3 H 4.374 2.728 6.609 1.00 . A A . 15 LYS HE3 1 1 9 4893 1 1 15 LYS HG2 H 7.043 1.351 4.473 1.00 . A A . 15 LYS HG2 1 1 9 4894 1 1 15 LYS HG3 H 5.939 2.718 4.667 1.00 . A A . 15 LYS HG3 1 1 9 4895 1 1 15 LYS HZ1 H 4.690 0.552 8.153 1.00 . A A . 15 LYS HZ1 1 1 9 4896 1 1 15 LYS HZ2 H 5.799 1.616 8.864 1.00 . A A . 15 LYS HZ2 1 1 9 4897 1 1 15 LYS HZ3 H 4.166 2.068 8.719 1.00 . A A . 15 LYS HZ3 1 1 9 4898 1 1 15 LYS N N 5.614 0.758 1.002 1.00 . A A . 15 LYS N 1 1 9 4899 1 1 15 LYS NZ N 4.950 1.553 8.268 1.00 . A A . 15 LYS NZ 1 1 9 4900 1 1 15 LYS O O 7.391 3.406 2.239 1.00 . A A . 15 LYS O 1 1 9 4901 1 1 16 SER C C 10.255 1.825 1.405 1.00 . A A . 16 SER C 1 1 9 4902 1 1 16 SER CA C 9.491 1.859 2.726 1.00 . A A . 16 SER CA 1 1 9 4903 1 1 16 SER CB C 10.225 0.965 3.720 1.00 . A A . 16 SER CB 1 1 9 4904 1 1 16 SER H H 7.925 0.393 2.611 1.00 . A A . 16 SER H 1 1 9 4905 1 1 16 SER HA H 9.474 2.869 3.103 1.00 . A A . 16 SER HA 1 1 9 4906 1 1 16 SER HB2 H 9.515 0.359 4.260 1.00 . A A . 16 SER HB2 1 1 9 4907 1 1 16 SER HB3 H 10.888 0.317 3.162 1.00 . A A . 16 SER HB3 1 1 9 4908 1 1 16 SER HG H 11.215 2.574 4.183 1.00 . A A . 16 SER HG 1 1 9 4909 1 1 16 SER N N 8.096 1.360 2.545 1.00 . A A . 16 SER N 1 1 9 4910 1 1 16 SER O O 11.460 1.976 1.358 1.00 . A A . 16 SER O 1 1 9 4911 1 1 16 SER OG O 10.945 1.774 4.640 1.00 . A A . 16 SER OG 1 1 9 4912 1 1 17 LEU C C 10.335 2.921 -1.674 1.00 . A A . 17 LEU C 1 1 9 4913 1 1 17 LEU CA C 10.186 1.561 -1.006 1.00 . A A . 17 LEU CA 1 1 9 4914 1 1 17 LEU CB C 9.177 0.921 -1.939 1.00 . A A . 17 LEU CB 1 1 9 4915 1 1 17 LEU CD1 C 8.276 -1.033 -2.930 1.00 . A A . 17 LEU CD1 1 1 9 4916 1 1 17 LEU CD2 C 10.786 -0.621 -2.865 1.00 . A A . 17 LEU CD2 1 1 9 4917 1 1 17 LEU CG C 9.464 -0.555 -2.103 1.00 . A A . 17 LEU CG 1 1 9 4918 1 1 17 LEU H H 8.581 1.495 0.403 1.00 . A A . 17 LEU H 1 1 9 4919 1 1 17 LEU HA H 11.071 0.949 -1.045 1.00 . A A . 17 LEU HA 1 1 9 4920 1 1 17 LEU HB2 H 8.180 1.062 -1.549 1.00 . A A . 17 LEU HB2 1 1 9 4921 1 1 17 LEU HB3 H 9.242 1.402 -2.904 1.00 . A A . 17 LEU HB3 1 1 9 4922 1 1 17 LEU HD11 H 7.550 -0.232 -2.909 1.00 . A A . 17 LEU HD11 1 1 9 4923 1 1 17 LEU HD12 H 8.580 -1.219 -3.950 1.00 . A A . 17 LEU HD12 1 1 9 4924 1 1 17 LEU HD13 H 7.838 -1.920 -2.506 1.00 . A A . 17 LEU HD13 1 1 9 4925 1 1 17 LEU HD21 H 11.070 0.392 -3.123 1.00 . A A . 17 LEU HD21 1 1 9 4926 1 1 17 LEU HD22 H 11.543 -1.057 -2.231 1.00 . A A . 17 LEU HD22 1 1 9 4927 1 1 17 LEU HD23 H 10.660 -1.212 -3.759 1.00 . A A . 17 LEU HD23 1 1 9 4928 1 1 17 LEU HG H 9.513 -1.023 -1.131 1.00 . A A . 17 LEU HG 1 1 9 4929 1 1 17 LEU N N 9.549 1.619 0.335 1.00 . A A . 17 LEU N 1 1 9 4930 1 1 17 LEU O O 11.410 3.403 -1.971 1.00 . A A . 17 LEU O 1 1 9 4931 1 1 18 GLY C C 7.835 4.967 -3.272 1.00 . A A . 18 GLY C 1 1 9 4932 1 1 18 GLY CA C 9.186 4.833 -2.566 1.00 . A A . 18 GLY CA 1 1 9 4933 1 1 18 GLY H H 8.356 3.081 -1.658 1.00 . A A . 18 GLY H 1 1 9 4934 1 1 18 GLY HA2 H 9.345 5.616 -1.840 1.00 . A A . 18 GLY HA2 1 1 9 4935 1 1 18 GLY HA3 H 9.966 4.817 -3.313 1.00 . A A . 18 GLY HA3 1 1 9 4936 1 1 18 GLY N N 9.201 3.510 -1.908 1.00 . A A . 18 GLY N 1 1 9 4937 1 1 18 GLY O O 7.273 6.039 -3.367 1.00 . A A . 18 GLY O 1 1 9 4938 1 1 19 ASN C C 4.858 4.241 -3.531 1.00 . A A . 19 ASN C 1 1 9 4939 1 1 19 ASN CA C 6.006 3.901 -4.471 1.00 . A A . 19 ASN CA 1 1 9 4940 1 1 19 ASN CB C 5.577 2.521 -4.929 1.00 . A A . 19 ASN CB 1 1 9 4941 1 1 19 ASN CG C 6.708 1.523 -5.163 1.00 . A A . 19 ASN CG 1 1 9 4942 1 1 19 ASN H H 7.763 3.011 -3.694 1.00 . A A . 19 ASN H 1 1 9 4943 1 1 19 ASN HA H 6.028 4.546 -5.334 1.00 . A A . 19 ASN HA 1 1 9 4944 1 1 19 ASN HB2 H 4.875 2.124 -4.218 1.00 . A A . 19 ASN HB2 1 1 9 4945 1 1 19 ASN HB3 H 5.019 2.636 -5.828 1.00 . A A . 19 ASN HB3 1 1 9 4946 1 1 19 ASN HD21 H 5.685 0.050 -4.305 1.00 . A A . 19 ASN HD21 1 1 9 4947 1 1 19 ASN HD22 H 7.220 -0.368 -4.896 1.00 . A A . 19 ASN HD22 1 1 9 4948 1 1 19 ASN N N 7.312 3.874 -3.768 1.00 . A A . 19 ASN N 1 1 9 4949 1 1 19 ASN ND2 N 6.522 0.302 -4.753 1.00 . A A . 19 ASN ND2 1 1 9 4950 1 1 19 ASN O O 3.843 4.671 -4.038 1.00 . A A . 19 ASN O 1 1 9 4951 1 1 19 ASN OD1 O 7.741 1.849 -5.711 1.00 . A A . 19 ASN OD1 1 1 9 4952 1 1 20 CYS C C 2.976 5.383 -1.771 1.00 . A A . 20 CYS C 1 1 9 4953 1 1 20 CYS CA C 3.956 4.332 -1.250 1.00 . A A . 20 CYS CA 1 1 9 4954 1 1 20 CYS CB C 4.513 4.858 0.072 1.00 . A A . 20 CYS CB 1 1 9 4955 1 1 20 CYS H H 5.900 3.669 -1.955 1.00 . A A . 20 CYS H 1 1 9 4956 1 1 20 CYS HA H 3.411 3.421 -1.055 1.00 . A A . 20 CYS HA 1 1 9 4957 1 1 20 CYS HB2 H 4.585 4.052 0.790 1.00 . A A . 20 CYS HB2 1 1 9 4958 1 1 20 CYS HB3 H 5.480 5.316 -0.079 1.00 . A A . 20 CYS HB3 1 1 9 4959 1 1 20 CYS N N 5.034 4.036 -2.249 1.00 . A A . 20 CYS N 1 1 9 4960 1 1 20 CYS O O 1.781 5.268 -1.611 1.00 . A A . 20 CYS O 1 1 9 4961 1 1 20 CYS SG S 3.351 6.105 0.674 1.00 . A A . 20 CYS SG 1 1 9 4962 1 1 21 ARG C C 2.723 7.709 -4.428 1.00 . A A . 21 ARG C 1 1 9 4963 1 1 21 ARG CA C 2.547 7.454 -2.924 1.00 . A A . 21 ARG CA 1 1 9 4964 1 1 21 ARG CB C 2.786 8.760 -2.177 1.00 . A A . 21 ARG CB 1 1 9 4965 1 1 21 ARG CD C 1.167 10.627 -2.483 1.00 . A A . 21 ARG CD 1 1 9 4966 1 1 21 ARG CG C 1.436 9.323 -1.731 1.00 . A A . 21 ARG CG 1 1 9 4967 1 1 21 ARG CZ C 2.652 12.245 -1.461 1.00 . A A . 21 ARG CZ 1 1 9 4968 1 1 21 ARG H H 4.442 6.488 -2.519 1.00 . A A . 21 ARG H 1 1 9 4969 1 1 21 ARG HA H 1.531 7.145 -2.738 1.00 . A A . 21 ARG HA 1 1 9 4970 1 1 21 ARG HB2 H 3.421 8.568 -1.323 1.00 . A A . 21 ARG HB2 1 1 9 4971 1 1 21 ARG HB3 H 3.266 9.460 -2.843 1.00 . A A . 21 ARG HB3 1 1 9 4972 1 1 21 ARG HD2 H 1.816 10.685 -3.345 1.00 . A A . 21 ARG HD2 1 1 9 4973 1 1 21 ARG HD3 H 0.138 10.654 -2.808 1.00 . A A . 21 ARG HD3 1 1 9 4974 1 1 21 ARG HE H 0.702 12.198 -1.085 1.00 . A A . 21 ARG HE 1 1 9 4975 1 1 21 ARG HG2 H 0.661 8.601 -1.951 1.00 . A A . 21 ARG HG2 1 1 9 4976 1 1 21 ARG HG3 H 1.457 9.521 -0.670 1.00 . A A . 21 ARG HG3 1 1 9 4977 1 1 21 ARG HH11 H 3.123 11.026 0.057 1.00 . A A . 21 ARG HH11 1 1 9 4978 1 1 21 ARG HH12 H 4.376 12.107 -0.454 1.00 . A A . 21 ARG HH12 1 1 9 4979 1 1 21 ARG HH21 H 2.464 13.571 -2.949 1.00 . A A . 21 ARG HH21 1 1 9 4980 1 1 21 ARG HH22 H 4.003 13.547 -2.155 1.00 . A A . 21 ARG HH22 1 1 9 4981 1 1 21 ARG N N 3.473 6.412 -2.399 1.00 . A A . 21 ARG N 1 1 9 4982 1 1 21 ARG NE N 1.437 11.784 -1.584 1.00 . A A . 21 ARG NE 1 1 9 4983 1 1 21 ARG NH1 N 3.445 11.754 -0.548 1.00 . A A . 21 ARG NH1 1 1 9 4984 1 1 21 ARG NH2 N 3.072 13.195 -2.250 1.00 . A A . 21 ARG NH2 1 1 9 4985 1 1 21 ARG O O 1.927 8.405 -5.025 1.00 . A A . 21 ARG O 1 1 9 4986 1 1 22 THR C C 3.290 6.273 -7.327 1.00 . A A . 22 THR C 1 1 9 4987 1 1 22 THR CA C 3.907 7.421 -6.525 1.00 . A A . 22 THR CA 1 1 9 4988 1 1 22 THR CB C 5.399 7.517 -6.850 1.00 . A A . 22 THR CB 1 1 9 4989 1 1 22 THR CG2 C 5.872 8.963 -6.697 1.00 . A A . 22 THR CG2 1 1 9 4990 1 1 22 THR H H 4.377 6.614 -4.597 1.00 . A A . 22 THR H 1 1 9 4991 1 1 22 THR HA H 3.424 8.348 -6.795 1.00 . A A . 22 THR HA 1 1 9 4992 1 1 22 THR HB H 5.569 7.201 -7.868 1.00 . A A . 22 THR HB 1 1 9 4993 1 1 22 THR HG1 H 6.707 7.229 -5.439 1.00 . A A . 22 THR HG1 1 1 9 4994 1 1 22 THR HG21 H 5.218 9.616 -7.256 1.00 . A A . 22 THR HG21 1 1 9 4995 1 1 22 THR HG22 H 5.851 9.241 -5.653 1.00 . A A . 22 THR HG22 1 1 9 4996 1 1 22 THR HG23 H 6.880 9.054 -7.073 1.00 . A A . 22 THR HG23 1 1 9 4997 1 1 22 THR N N 3.730 7.176 -5.066 1.00 . A A . 22 THR N 1 1 9 4998 1 1 22 THR O O 3.317 6.275 -8.542 1.00 . A A . 22 THR O 1 1 9 4999 1 1 22 THR OG1 O 6.124 6.676 -5.963 1.00 . A A . 22 THR OG1 1 1 9 5000 1 1 23 SER C C 0.649 4.180 -6.983 1.00 . A A . 23 SER C 1 1 9 5001 1 1 23 SER CA C 2.119 4.159 -7.402 1.00 . A A . 23 SER CA 1 1 9 5002 1 1 23 SER CB C 2.898 2.906 -7.004 1.00 . A A . 23 SER CB 1 1 9 5003 1 1 23 SER H H 2.708 5.291 -5.687 1.00 . A A . 23 SER H 1 1 9 5004 1 1 23 SER HA H 2.176 4.339 -8.466 1.00 . A A . 23 SER HA 1 1 9 5005 1 1 23 SER HB2 H 3.932 3.037 -7.290 1.00 . A A . 23 SER HB2 1 1 9 5006 1 1 23 SER HB3 H 2.859 2.786 -5.933 1.00 . A A . 23 SER HB3 1 1 9 5007 1 1 23 SER HG H 1.551 2.033 -8.103 1.00 . A A . 23 SER HG 1 1 9 5008 1 1 23 SER N N 2.733 5.294 -6.669 1.00 . A A . 23 SER N 1 1 9 5009 1 1 23 SER O O 0.338 4.420 -5.833 1.00 . A A . 23 SER O 1 1 9 5010 1 1 23 SER OG O 2.379 1.776 -7.692 1.00 . A A . 23 SER OG 1 1 9 5011 1 1 24 GLN C C -2.118 2.823 -6.591 1.00 . A A . 24 GLN C 1 1 9 5012 1 1 24 GLN CA C -1.701 3.978 -7.501 1.00 . A A . 24 GLN CA 1 1 9 5013 1 1 24 GLN CB C -2.558 4.022 -8.767 1.00 . A A . 24 GLN CB 1 1 9 5014 1 1 24 GLN CD C -4.988 4.235 -9.291 1.00 . A A . 24 GLN CD 1 1 9 5015 1 1 24 GLN CG C -3.951 3.464 -8.473 1.00 . A A . 24 GLN CG 1 1 9 5016 1 1 24 GLN H H -0.015 3.762 -8.814 1.00 . A A . 24 GLN H 1 1 9 5017 1 1 24 GLN HA H -1.868 4.895 -6.955 1.00 . A A . 24 GLN HA 1 1 9 5018 1 1 24 GLN HB2 H -2.642 5.044 -9.104 1.00 . A A . 24 GLN HB2 1 1 9 5019 1 1 24 GLN HB3 H -2.093 3.425 -9.538 1.00 . A A . 24 GLN HB3 1 1 9 5020 1 1 24 GLN HE21 H -6.120 2.637 -9.628 1.00 . A A . 24 GLN HE21 1 1 9 5021 1 1 24 GLN HE22 H -6.687 4.085 -10.309 1.00 . A A . 24 GLN HE22 1 1 9 5022 1 1 24 GLN HG2 H -3.975 2.419 -8.741 1.00 . A A . 24 GLN HG2 1 1 9 5023 1 1 24 GLN HG3 H -4.170 3.578 -7.423 1.00 . A A . 24 GLN HG3 1 1 9 5024 1 1 24 GLN N N -0.263 3.948 -7.885 1.00 . A A . 24 GLN N 1 1 9 5025 1 1 24 GLN NE2 N -6.017 3.599 -9.784 1.00 . A A . 24 GLN NE2 1 1 9 5026 1 1 24 GLN O O -2.296 3.034 -5.414 1.00 . A A . 24 GLN O 1 1 9 5027 1 1 24 GLN OE1 O -4.862 5.427 -9.486 1.00 . A A . 24 GLN OE1 1 1 9 5028 1 1 25 LYS C C -1.780 0.571 -4.916 1.00 . A A . 25 LYS C 1 1 9 5029 1 1 25 LYS CA C -2.695 0.532 -6.143 1.00 . A A . 25 LYS CA 1 1 9 5030 1 1 25 LYS CB C -2.544 -0.809 -6.861 1.00 . A A . 25 LYS CB 1 1 9 5031 1 1 25 LYS CD C -4.072 -2.575 -7.772 1.00 . A A . 25 LYS CD 1 1 9 5032 1 1 25 LYS CE C -4.846 -1.768 -8.817 1.00 . A A . 25 LYS CE 1 1 9 5033 1 1 25 LYS CG C -3.765 -1.687 -6.566 1.00 . A A . 25 LYS CG 1 1 9 5034 1 1 25 LYS H H -2.142 1.452 -8.028 1.00 . A A . 25 LYS H 1 1 9 5035 1 1 25 LYS HA H -3.721 0.676 -5.840 1.00 . A A . 25 LYS HA 1 1 9 5036 1 1 25 LYS HB2 H -2.463 -0.629 -7.923 1.00 . A A . 25 LYS HB2 1 1 9 5037 1 1 25 LYS HB3 H -1.652 -1.301 -6.508 1.00 . A A . 25 LYS HB3 1 1 9 5038 1 1 25 LYS HD2 H -3.146 -2.932 -8.200 1.00 . A A . 25 LYS HD2 1 1 9 5039 1 1 25 LYS HD3 H -4.672 -3.415 -7.459 1.00 . A A . 25 LYS HD3 1 1 9 5040 1 1 25 LYS HE2 H -4.571 -0.726 -8.743 1.00 . A A . 25 LYS HE2 1 1 9 5041 1 1 25 LYS HE3 H -4.605 -2.134 -9.805 1.00 . A A . 25 LYS HE3 1 1 9 5042 1 1 25 LYS HG2 H -3.568 -2.299 -5.696 1.00 . A A . 25 LYS HG2 1 1 9 5043 1 1 25 LYS HG3 H -4.616 -1.054 -6.364 1.00 . A A . 25 LYS HG3 1 1 9 5044 1 1 25 LYS HZ1 H -6.465 -2.393 -7.666 1.00 . A A . 25 LYS HZ1 1 1 9 5045 1 1 25 LYS HZ2 H -6.753 -0.975 -8.546 1.00 . A A . 25 LYS HZ2 1 1 9 5046 1 1 25 LYS HZ3 H -6.729 -2.477 -9.343 1.00 . A A . 25 LYS HZ3 1 1 9 5047 1 1 25 LYS N N -2.283 1.624 -7.074 1.00 . A A . 25 LYS N 1 1 9 5048 1 1 25 LYS NZ N -6.309 -1.915 -8.575 1.00 . A A . 25 LYS NZ 1 1 9 5049 1 1 25 LYS O O -2.174 0.546 -3.772 1.00 . A A . 25 LYS O 1 1 9 5050 1 1 26 TYR C C 0.266 1.782 -3.067 1.00 . A A . 26 TYR C 1 1 9 5051 1 1 26 TYR CA C 0.526 0.691 -4.115 1.00 . A A . 26 TYR CA 1 1 9 5052 1 1 26 TYR CB C 1.761 1.000 -4.938 1.00 . A A . 26 TYR CB 1 1 9 5053 1 1 26 TYR CD1 C 1.904 -1.547 -5.109 1.00 . A A . 26 TYR CD1 1 1 9 5054 1 1 26 TYR CD2 C 3.816 -0.173 -5.641 1.00 . A A . 26 TYR CD2 1 1 9 5055 1 1 26 TYR CE1 C 2.658 -2.684 -5.394 1.00 . A A . 26 TYR CE1 1 1 9 5056 1 1 26 TYR CE2 C 4.577 -1.308 -5.925 1.00 . A A . 26 TYR CE2 1 1 9 5057 1 1 26 TYR CG C 2.492 -0.282 -5.236 1.00 . A A . 26 TYR CG 1 1 9 5058 1 1 26 TYR CZ C 3.995 -2.575 -5.800 1.00 . A A . 26 TYR CZ 1 1 9 5059 1 1 26 TYR H H -0.231 0.662 -6.115 1.00 . A A . 26 TYR H 1 1 9 5060 1 1 26 TYR HA H 0.697 -0.256 -3.625 1.00 . A A . 26 TYR HA 1 1 9 5061 1 1 26 TYR HB2 H 1.446 1.470 -5.855 1.00 . A A . 26 TYR HB2 1 1 9 5062 1 1 26 TYR HB3 H 2.406 1.669 -4.389 1.00 . A A . 26 TYR HB3 1 1 9 5063 1 1 26 TYR HD1 H 0.873 -1.660 -4.799 1.00 . A A . 26 TYR HD1 1 1 9 5064 1 1 26 TYR HD2 H 4.250 0.808 -5.736 1.00 . A A . 26 TYR HD2 1 1 9 5065 1 1 26 TYR HE1 H 2.182 -3.642 -5.287 1.00 . A A . 26 TYR HE1 1 1 9 5066 1 1 26 TYR HE2 H 5.605 -1.187 -6.234 1.00 . A A . 26 TYR HE2 1 1 9 5067 1 1 26 TYR HH H 5.650 -3.449 -6.182 1.00 . A A . 26 TYR HH 1 1 9 5068 1 1 26 TYR N N -0.515 0.640 -5.178 1.00 . A A . 26 TYR N 1 1 9 5069 1 1 26 TYR O O 0.543 1.586 -1.900 1.00 . A A . 26 TYR O 1 1 9 5070 1 1 26 TYR OH O 4.731 -3.709 -6.077 1.00 . A A . 26 TYR OH 1 1 9 5071 1 1 27 ARG C C -1.867 3.733 -1.752 1.00 . A A . 27 ARG C 1 1 9 5072 1 1 27 ARG CA C -0.496 3.971 -2.390 1.00 . A A . 27 ARG CA 1 1 9 5073 1 1 27 ARG CB C -0.350 5.355 -3.043 1.00 . A A . 27 ARG CB 1 1 9 5074 1 1 27 ARG CD C -1.507 7.323 -4.026 1.00 . A A . 27 ARG CD 1 1 9 5075 1 1 27 ARG CG C -1.650 5.841 -3.677 1.00 . A A . 27 ARG CG 1 1 9 5076 1 1 27 ARG CZ C -2.364 9.414 -3.144 1.00 . A A . 27 ARG CZ 1 1 9 5077 1 1 27 ARG H H -0.483 3.107 -4.356 1.00 . A A . 27 ARG H 1 1 9 5078 1 1 27 ARG HA H 0.247 3.848 -1.617 1.00 . A A . 27 ARG HA 1 1 9 5079 1 1 27 ARG HB2 H -0.032 6.091 -2.319 1.00 . A A . 27 ARG HB2 1 1 9 5080 1 1 27 ARG HB3 H 0.398 5.279 -3.820 1.00 . A A . 27 ARG HB3 1 1 9 5081 1 1 27 ARG HD2 H -0.479 7.629 -3.891 1.00 . A A . 27 ARG HD2 1 1 9 5082 1 1 27 ARG HD3 H -1.804 7.487 -5.051 1.00 . A A . 27 ARG HD3 1 1 9 5083 1 1 27 ARG HE H -2.992 7.643 -2.504 1.00 . A A . 27 ARG HE 1 1 9 5084 1 1 27 ARG HG2 H -1.819 5.280 -4.584 1.00 . A A . 27 ARG HG2 1 1 9 5085 1 1 27 ARG HG3 H -2.467 5.720 -2.983 1.00 . A A . 27 ARG HG3 1 1 9 5086 1 1 27 ARG HH11 H -3.206 9.553 -4.955 1.00 . A A . 27 ARG HH11 1 1 9 5087 1 1 27 ARG HH12 H -2.808 11.058 -4.195 1.00 . A A . 27 ARG HH12 1 1 9 5088 1 1 27 ARG HH21 H -1.516 9.568 -1.339 1.00 . A A . 27 ARG HH21 1 1 9 5089 1 1 27 ARG HH22 H -1.849 11.067 -2.140 1.00 . A A . 27 ARG HH22 1 1 9 5090 1 1 27 ARG N N -0.253 2.927 -3.423 1.00 . A A . 27 ARG N 1 1 9 5091 1 1 27 ARG NE N -2.390 8.110 -3.120 1.00 . A A . 27 ARG NE 1 1 9 5092 1 1 27 ARG NH1 N -2.829 10.059 -4.178 1.00 . A A . 27 ARG NH1 1 1 9 5093 1 1 27 ARG NH2 N -1.872 10.067 -2.128 1.00 . A A . 27 ARG NH2 1 1 9 5094 1 1 27 ARG O O -1.998 3.644 -0.547 1.00 . A A . 27 ARG O 1 1 9 5095 1 1 28 ALA C C -4.472 1.892 -1.780 1.00 . A A . 28 ALA C 1 1 9 5096 1 1 28 ALA CA C -4.263 3.391 -2.011 1.00 . A A . 28 ALA CA 1 1 9 5097 1 1 28 ALA CB C -5.298 3.899 -3.017 1.00 . A A . 28 ALA CB 1 1 9 5098 1 1 28 ALA H H -2.756 3.702 -3.508 1.00 . A A . 28 ALA H 1 1 9 5099 1 1 28 ALA HA H -4.380 3.919 -1.077 1.00 . A A . 28 ALA HA 1 1 9 5100 1 1 28 ALA HB1 H -4.807 4.509 -3.762 1.00 . A A . 28 ALA HB1 1 1 9 5101 1 1 28 ALA HB2 H -5.776 3.058 -3.498 1.00 . A A . 28 ALA HB2 1 1 9 5102 1 1 28 ALA HB3 H -6.041 4.490 -2.502 1.00 . A A . 28 ALA HB3 1 1 9 5103 1 1 28 ALA N N -2.894 3.626 -2.547 1.00 . A A . 28 ALA N 1 1 9 5104 1 1 28 ALA O O -4.770 1.469 -0.682 1.00 . A A . 28 ALA O 1 1 9 5105 1 1 29 ASN C C -3.674 -0.863 -1.346 1.00 . A A . 29 ASN C 1 1 9 5106 1 1 29 ASN CA C -4.543 -0.386 -2.508 1.00 . A A . 29 ASN CA 1 1 9 5107 1 1 29 ASN CB C -4.257 -1.313 -3.693 1.00 . A A . 29 ASN CB 1 1 9 5108 1 1 29 ASN CG C -5.589 -1.696 -4.341 1.00 . A A . 29 ASN CG 1 1 9 5109 1 1 29 ASN H H -4.089 1.386 -3.673 1.00 . A A . 29 ASN H 1 1 9 5110 1 1 29 ASN HA H -5.580 -0.462 -2.241 1.00 . A A . 29 ASN HA 1 1 9 5111 1 1 29 ASN HB2 H -3.620 -0.817 -4.407 1.00 . A A . 29 ASN HB2 1 1 9 5112 1 1 29 ASN HB3 H -3.766 -2.218 -3.351 1.00 . A A . 29 ASN HB3 1 1 9 5113 1 1 29 ASN HD21 H -6.075 0.179 -4.779 1.00 . A A . 29 ASN HD21 1 1 9 5114 1 1 29 ASN HD22 H -7.211 -0.993 -5.248 1.00 . A A . 29 ASN HD22 1 1 9 5115 1 1 29 ASN N N -4.328 1.063 -2.780 1.00 . A A . 29 ASN N 1 1 9 5116 1 1 29 ASN ND2 N -6.355 -0.759 -4.829 1.00 . A A . 29 ASN ND2 1 1 9 5117 1 1 29 ASN O O -3.998 -1.816 -0.665 1.00 . A A . 29 ASN O 1 1 9 5118 1 1 29 ASN OD1 O -5.937 -2.859 -4.404 1.00 . A A . 29 ASN OD1 1 1 9 5119 1 1 30 CYS C C -1.498 0.597 0.912 1.00 . A A . 30 CYS C 1 1 9 5120 1 1 30 CYS CA C -1.668 -0.608 -0.010 1.00 . A A . 30 CYS CA 1 1 9 5121 1 1 30 CYS CB C -0.347 -1.053 -0.634 1.00 . A A . 30 CYS CB 1 1 9 5122 1 1 30 CYS H H -2.332 0.558 -1.683 1.00 . A A . 30 CYS H 1 1 9 5123 1 1 30 CYS HA H -2.114 -1.424 0.539 1.00 . A A . 30 CYS HA 1 1 9 5124 1 1 30 CYS HB2 H -0.064 -0.363 -1.415 1.00 . A A . 30 CYS HB2 1 1 9 5125 1 1 30 CYS HB3 H 0.425 -1.098 0.119 1.00 . A A . 30 CYS HB3 1 1 9 5126 1 1 30 CYS N N -2.571 -0.206 -1.120 1.00 . A A . 30 CYS N 1 1 9 5127 1 1 30 CYS O O -0.415 0.991 1.296 1.00 . A A . 30 CYS O 1 1 9 5128 1 1 30 CYS SG S -0.609 -2.704 -1.329 1.00 . A A . 30 CYS SG 1 1 9 5129 1 1 31 ALA C C -2.540 1.939 3.600 1.00 . A A . 31 ALA C 1 1 9 5130 1 1 31 ALA CA C -2.688 2.361 2.133 1.00 . A A . 31 ALA CA 1 1 9 5131 1 1 31 ALA CB C -4.062 2.993 1.903 1.00 . A A . 31 ALA CB 1 1 9 5132 1 1 31 ALA H H -3.457 0.798 0.895 1.00 . A A . 31 ALA H 1 1 9 5133 1 1 31 ALA HA H -1.917 3.066 1.855 1.00 . A A . 31 ALA HA 1 1 9 5134 1 1 31 ALA HB1 H -4.370 2.809 0.883 1.00 . A A . 31 ALA HB1 1 1 9 5135 1 1 31 ALA HB2 H -4.778 2.536 2.570 1.00 . A A . 31 ALA HB2 1 1 9 5136 1 1 31 ALA HB3 H -4.025 4.054 2.086 1.00 . A A . 31 ALA HB3 1 1 9 5137 1 1 31 ALA N N -2.621 1.168 1.245 1.00 . A A . 31 ALA N 1 1 9 5138 1 1 31 ALA O O -2.494 2.764 4.490 1.00 . A A . 31 ALA O 1 1 9 5139 1 1 32 LYS C C -0.824 0.144 5.599 1.00 . A A . 32 LYS C 1 1 9 5140 1 1 32 LYS CA C -2.315 0.169 5.257 1.00 . A A . 32 LYS CA 1 1 9 5141 1 1 32 LYS CB C -2.851 -1.261 5.317 1.00 . A A . 32 LYS CB 1 1 9 5142 1 1 32 LYS CD C -0.734 -2.634 5.169 1.00 . A A . 32 LYS CD 1 1 9 5143 1 1 32 LYS CE C -0.380 -4.100 5.447 1.00 . A A . 32 LYS CE 1 1 9 5144 1 1 32 LYS CG C -1.887 -2.183 6.077 1.00 . A A . 32 LYS CG 1 1 9 5145 1 1 32 LYS H H -2.501 0.020 3.119 1.00 . A A . 32 LYS H 1 1 9 5146 1 1 32 LYS HA H -2.858 0.797 5.947 1.00 . A A . 32 LYS HA 1 1 9 5147 1 1 32 LYS HB2 H -3.810 -1.253 5.812 1.00 . A A . 32 LYS HB2 1 1 9 5148 1 1 32 LYS HB3 H -2.973 -1.626 4.308 1.00 . A A . 32 LYS HB3 1 1 9 5149 1 1 32 LYS HD2 H -1.030 -2.525 4.136 1.00 . A A . 32 LYS HD2 1 1 9 5150 1 1 32 LYS HD3 H 0.133 -2.017 5.358 1.00 . A A . 32 LYS HD3 1 1 9 5151 1 1 32 LYS HE2 H -1.088 -4.738 4.940 1.00 . A A . 32 LYS HE2 1 1 9 5152 1 1 32 LYS HE3 H 0.617 -4.330 5.092 1.00 . A A . 32 LYS HE3 1 1 9 5153 1 1 32 LYS HG2 H -1.486 -1.661 6.933 1.00 . A A . 32 LYS HG2 1 1 9 5154 1 1 32 LYS HG3 H -2.427 -3.053 6.416 1.00 . A A . 32 LYS HG3 1 1 9 5155 1 1 32 LYS HZ1 H -0.145 -3.505 7.429 1.00 . A A . 32 LYS HZ1 1 1 9 5156 1 1 32 LYS HZ2 H -1.434 -4.576 7.181 1.00 . A A . 32 LYS HZ2 1 1 9 5157 1 1 32 LYS HZ3 H 0.164 -5.154 7.156 1.00 . A A . 32 LYS HZ3 1 1 9 5158 1 1 32 LYS N N -2.462 0.664 3.856 1.00 . A A . 32 LYS N 1 1 9 5159 1 1 32 LYS NZ N -0.454 -4.353 6.913 1.00 . A A . 32 LYS NZ 1 1 9 5160 1 1 32 LYS O O -0.421 0.189 6.744 1.00 . A A . 32 LYS O 1 1 9 5161 1 1 33 THR C C 1.994 1.469 4.740 1.00 . A A . 33 THR C 1 1 9 5162 1 1 33 THR CA C 1.459 0.040 4.725 1.00 . A A . 33 THR CA 1 1 9 5163 1 1 33 THR CB C 1.893 -0.855 3.565 1.00 . A A . 33 THR CB 1 1 9 5164 1 1 33 THR CG2 C 2.695 -0.135 2.484 1.00 . A A . 33 THR CG2 1 1 9 5165 1 1 33 THR H H -0.390 0.039 3.676 1.00 . A A . 33 THR H 1 1 9 5166 1 1 33 THR HA H 1.754 -0.410 5.654 1.00 . A A . 33 THR HA 1 1 9 5167 1 1 33 THR HB H 1.000 -1.269 3.127 1.00 . A A . 33 THR HB 1 1 9 5168 1 1 33 THR HG1 H 2.257 -2.179 4.939 1.00 . A A . 33 THR HG1 1 1 9 5169 1 1 33 THR HG21 H 2.643 0.933 2.590 1.00 . A A . 33 THR HG21 1 1 9 5170 1 1 33 THR HG22 H 3.717 -0.469 2.545 1.00 . A A . 33 THR HG22 1 1 9 5171 1 1 33 THR HG23 H 2.288 -0.410 1.523 1.00 . A A . 33 THR HG23 1 1 9 5172 1 1 33 THR N N -0.017 0.073 4.580 1.00 . A A . 33 THR N 1 1 9 5173 1 1 33 THR O O 3.015 1.767 5.324 1.00 . A A . 33 THR O 1 1 9 5174 1 1 33 THR OG1 O 2.637 -1.942 4.090 1.00 . A A . 33 THR OG1 1 1 9 5175 1 1 34 CYS C C 0.764 4.648 4.844 1.00 . A A . 34 CYS C 1 1 9 5176 1 1 34 CYS CA C 1.753 3.772 4.073 1.00 . A A . 34 CYS CA 1 1 9 5177 1 1 34 CYS CB C 1.801 4.283 2.638 1.00 . A A . 34 CYS CB 1 1 9 5178 1 1 34 CYS H H 0.472 2.094 3.638 1.00 . A A . 34 CYS H 1 1 9 5179 1 1 34 CYS HA H 2.739 3.847 4.507 1.00 . A A . 34 CYS HA 1 1 9 5180 1 1 34 CYS HB2 H 2.009 3.468 1.968 1.00 . A A . 34 CYS HB2 1 1 9 5181 1 1 34 CYS HB3 H 0.844 4.682 2.367 1.00 . A A . 34 CYS HB3 1 1 9 5182 1 1 34 CYS N N 1.295 2.358 4.098 1.00 . A A . 34 CYS N 1 1 9 5183 1 1 34 CYS O O 0.967 5.835 5.009 1.00 . A A . 34 CYS O 1 1 9 5184 1 1 34 CYS SG S 3.057 5.589 2.603 1.00 . A A . 34 CYS SG 1 1 9 5185 1 1 35 GLU C C -1.967 5.901 5.178 1.00 . A A . 35 GLU C 1 1 9 5186 1 1 35 GLU CA C -1.310 4.860 6.075 1.00 . A A . 35 GLU CA 1 1 9 5187 1 1 35 GLU CB C -0.632 5.441 7.310 1.00 . A A . 35 GLU CB 1 1 9 5188 1 1 35 GLU CD C 0.494 4.525 9.365 1.00 . A A . 35 GLU CD 1 1 9 5189 1 1 35 GLU CG C -0.395 4.200 8.163 1.00 . A A . 35 GLU CG 1 1 9 5190 1 1 35 GLU H H -0.462 3.115 5.180 1.00 . A A . 35 GLU H 1 1 9 5191 1 1 35 GLU HA H -2.084 4.174 6.392 1.00 . A A . 35 GLU HA 1 1 9 5192 1 1 35 GLU HB2 H 0.297 5.924 7.035 1.00 . A A . 35 GLU HB2 1 1 9 5193 1 1 35 GLU HB3 H -1.287 6.113 7.841 1.00 . A A . 35 GLU HB3 1 1 9 5194 1 1 35 GLU HG2 H -1.359 3.831 8.484 1.00 . A A . 35 GLU HG2 1 1 9 5195 1 1 35 GLU HG3 H 0.077 3.452 7.540 1.00 . A A . 35 GLU HG3 1 1 9 5196 1 1 35 GLU N N -0.306 4.072 5.318 1.00 . A A . 35 GLU N 1 1 9 5197 1 1 35 GLU O O -2.316 6.996 5.573 1.00 . A A . 35 GLU O 1 1 9 5198 1 1 35 GLU OE1 O 1.118 5.574 9.348 1.00 . A A . 35 GLU OE1 1 1 9 5199 1 1 35 GLU OE2 O 0.537 3.720 10.280 1.00 . A A . 35 GLU OE2 1 1 9 5200 1 1 36 LEU C C -4.269 6.154 3.086 1.00 . A A . 36 LEU C 1 1 9 5201 1 1 36 LEU CA C -2.763 6.367 2.928 1.00 . A A . 36 LEU CA 1 1 9 5202 1 1 36 LEU CB C -2.303 5.893 1.550 1.00 . A A . 36 LEU CB 1 1 9 5203 1 1 36 LEU CD1 C -0.199 5.328 0.315 1.00 . A A . 36 LEU CD1 1 1 9 5204 1 1 36 LEU CD2 C -0.690 7.700 0.932 1.00 . A A . 36 LEU CD2 1 1 9 5205 1 1 36 LEU CG C -0.829 6.241 1.370 1.00 . A A . 36 LEU CG 1 1 9 5206 1 1 36 LEU H H -1.832 4.601 3.703 1.00 . A A . 36 LEU H 1 1 9 5207 1 1 36 LEU HA H -2.498 7.398 3.087 1.00 . A A . 36 LEU HA 1 1 9 5208 1 1 36 LEU HB2 H -2.431 4.833 1.521 1.00 . A A . 36 LEU HB2 1 1 9 5209 1 1 36 LEU HB3 H -2.880 6.325 0.753 1.00 . A A . 36 LEU HB3 1 1 9 5210 1 1 36 LEU HD11 H -0.351 4.295 0.587 1.00 . A A . 36 LEU HD11 1 1 9 5211 1 1 36 LEU HD12 H -0.652 5.518 -0.648 1.00 . A A . 36 LEU HD12 1 1 9 5212 1 1 36 LEU HD13 H 0.860 5.531 0.257 1.00 . A A . 36 LEU HD13 1 1 9 5213 1 1 36 LEU HD21 H -1.573 8.249 1.226 1.00 . A A . 36 LEU HD21 1 1 9 5214 1 1 36 LEU HD22 H 0.179 8.137 1.403 1.00 . A A . 36 LEU HD22 1 1 9 5215 1 1 36 LEU HD23 H -0.580 7.745 -0.141 1.00 . A A . 36 LEU HD23 1 1 9 5216 1 1 36 LEU HG H -0.341 6.095 2.321 1.00 . A A . 36 LEU HG 1 1 9 5217 1 1 36 LEU N N -2.128 5.500 3.951 1.00 . A A . 36 LEU N 1 1 9 5218 1 1 36 LEU O O -5.066 6.868 2.510 1.00 . A A . 36 LEU O 1 1 9 5219 1 1 37 CYS C C -6.366 3.755 4.961 1.00 . A A . 37 CYS C 1 1 9 5220 1 1 37 CYS CA C -6.140 4.950 4.033 1.00 . A A . 37 CYS CA 1 1 9 5221 1 1 37 CYS CB C -6.780 4.665 2.673 1.00 . A A . 37 CYS CB 1 1 9 5222 1 1 37 CYS H H -4.044 4.589 4.337 1.00 . A A . 37 CYS H 1 1 9 5223 1 1 37 CYS HA H -6.592 5.830 4.466 1.00 . A A . 37 CYS HA 1 1 9 5224 1 1 37 CYS HB2 H -7.154 5.587 2.251 1.00 . A A . 37 CYS HB2 1 1 9 5225 1 1 37 CYS HB3 H -6.046 4.236 2.009 1.00 . A A . 37 CYS HB3 1 1 9 5226 1 1 37 CYS N N -4.678 5.177 3.862 1.00 . A A . 37 CYS N 1 1 9 5227 1 1 37 CYS O O -5.711 2.745 4.764 1.00 . A A . 37 CYS O 1 1 9 5228 1 1 37 CYS OXT O -7.190 3.870 5.853 1.00 . A A . 37 CYS OXT 1 1 9 5229 1 1 37 CYS SG S -8.149 3.503 2.892 1.00 . A A . 37 CYS SG 1 1 10 5230 1 1 1 VAL C C -12.008 0.765 2.462 1.00 . A A . 1 VAL C 1 1 10 5231 1 1 1 VAL CA C -13.315 1.061 3.200 1.00 . A A . 1 VAL CA 1 1 10 5232 1 1 1 VAL CB C -13.347 0.283 4.517 1.00 . A A . 1 VAL CB 1 1 10 5233 1 1 1 VAL CG1 C -12.559 -1.019 4.362 1.00 . A A . 1 VAL CG1 1 1 10 5234 1 1 1 VAL CG2 C -12.711 1.133 5.619 1.00 . A A . 1 VAL CG2 1 1 10 5235 1 1 1 VAL H1 H -14.130 0.424 1.393 1.00 . A A . 1 VAL H1 1 1 10 5236 1 1 1 VAL H2 H -14.917 -0.193 2.767 1.00 . A A . 1 VAL H2 1 1 10 5237 1 1 1 VAL H3 H -15.156 1.423 2.296 1.00 . A A . 1 VAL H3 1 1 10 5238 1 1 1 VAL HA H -13.380 2.120 3.404 1.00 . A A . 1 VAL HA 1 1 10 5239 1 1 1 VAL HB H -14.370 0.054 4.774 1.00 . A A . 1 VAL HB 1 1 10 5240 1 1 1 VAL HG11 H -12.710 -1.415 3.370 1.00 . A A . 1 VAL HG11 1 1 10 5241 1 1 1 VAL HG12 H -11.506 -0.823 4.514 1.00 . A A . 1 VAL HG12 1 1 10 5242 1 1 1 VAL HG13 H -12.900 -1.736 5.094 1.00 . A A . 1 VAL HG13 1 1 10 5243 1 1 1 VAL HG21 H -12.668 2.163 5.300 1.00 . A A . 1 VAL HG21 1 1 10 5244 1 1 1 VAL HG22 H -13.305 1.059 6.519 1.00 . A A . 1 VAL HG22 1 1 10 5245 1 1 1 VAL HG23 H -11.712 0.775 5.819 1.00 . A A . 1 VAL HG23 1 1 10 5246 1 1 1 VAL N N -14.467 0.647 2.350 1.00 . A A . 1 VAL N 1 1 10 5247 1 1 1 VAL O O -11.912 -0.185 1.709 1.00 . A A . 1 VAL O 1 1 10 5248 1 1 2 CYS C C -8.840 0.396 2.841 1.00 . A A . 2 CYS C 1 1 10 5249 1 1 2 CYS CA C -9.702 1.324 1.977 1.00 . A A . 2 CYS CA 1 1 10 5250 1 1 2 CYS CB C -8.993 2.666 1.771 1.00 . A A . 2 CYS CB 1 1 10 5251 1 1 2 CYS H H -11.095 2.327 3.281 1.00 . A A . 2 CYS H 1 1 10 5252 1 1 2 CYS HA H -9.906 0.869 1.018 1.00 . A A . 2 CYS HA 1 1 10 5253 1 1 2 CYS HB2 H -8.900 2.876 0.717 1.00 . A A . 2 CYS HB2 1 1 10 5254 1 1 2 CYS HB3 H -9.567 3.448 2.246 1.00 . A A . 2 CYS HB3 1 1 10 5255 1 1 2 CYS N N -11.000 1.567 2.670 1.00 . A A . 2 CYS N 1 1 10 5256 1 1 2 CYS O O -9.125 0.197 4.005 1.00 . A A . 2 CYS O 1 1 10 5257 1 1 2 CYS SG S -7.344 2.614 2.509 1.00 . A A . 2 CYS SG 1 1 10 5258 1 1 3 ARG C C -5.968 -1.809 2.196 1.00 . A A . 3 ARG C 1 1 10 5259 1 1 3 ARG CA C -6.938 -1.081 3.128 1.00 . A A . 3 ARG CA 1 1 10 5260 1 1 3 ARG CB C -7.813 -2.106 3.851 1.00 . A A . 3 ARG CB 1 1 10 5261 1 1 3 ARG CD C -8.931 -4.084 2.803 1.00 . A A . 3 ARG CD 1 1 10 5262 1 1 3 ARG CG C -8.948 -2.560 2.930 1.00 . A A . 3 ARG CG 1 1 10 5263 1 1 3 ARG CZ C -9.790 -5.569 4.516 1.00 . A A . 3 ARG CZ 1 1 10 5264 1 1 3 ARG H H -7.557 -0.018 1.370 1.00 . A A . 3 ARG H 1 1 10 5265 1 1 3 ARG HA H -6.382 -0.499 3.848 1.00 . A A . 3 ARG HA 1 1 10 5266 1 1 3 ARG HB2 H -7.209 -2.957 4.131 1.00 . A A . 3 ARG HB2 1 1 10 5267 1 1 3 ARG HB3 H -8.234 -1.656 4.738 1.00 . A A . 3 ARG HB3 1 1 10 5268 1 1 3 ARG HD2 H -9.822 -4.413 2.288 1.00 . A A . 3 ARG HD2 1 1 10 5269 1 1 3 ARG HD3 H -8.059 -4.392 2.244 1.00 . A A . 3 ARG HD3 1 1 10 5270 1 1 3 ARG HE H -8.185 -4.434 4.794 1.00 . A A . 3 ARG HE 1 1 10 5271 1 1 3 ARG HG2 H -9.893 -2.240 3.342 1.00 . A A . 3 ARG HG2 1 1 10 5272 1 1 3 ARG HG3 H -8.814 -2.122 1.951 1.00 . A A . 3 ARG HG3 1 1 10 5273 1 1 3 ARG HH11 H -11.332 -4.489 3.834 1.00 . A A . 3 ARG HH11 1 1 10 5274 1 1 3 ARG HH12 H -11.742 -6.009 4.554 1.00 . A A . 3 ARG HH12 1 1 10 5275 1 1 3 ARG HH21 H -8.460 -6.854 5.281 1.00 . A A . 3 ARG HH21 1 1 10 5276 1 1 3 ARG HH22 H -10.118 -7.349 5.373 1.00 . A A . 3 ARG HH22 1 1 10 5277 1 1 3 ARG N N -7.792 -0.177 2.308 1.00 . A A . 3 ARG N 1 1 10 5278 1 1 3 ARG NE N -8.890 -4.692 4.163 1.00 . A A . 3 ARG NE 1 1 10 5279 1 1 3 ARG NH1 N -11.053 -5.337 4.283 1.00 . A A . 3 ARG NH1 1 1 10 5280 1 1 3 ARG NH2 N -9.427 -6.677 5.103 1.00 . A A . 3 ARG NH2 1 1 10 5281 1 1 3 ARG O O -6.133 -1.785 0.993 1.00 . A A . 3 ARG O 1 1 10 5282 1 1 4 ASP C C -4.839 -4.002 0.855 1.00 . A A . 4 ASP C 1 1 10 5283 1 1 4 ASP CA C -4.014 -3.171 1.836 1.00 . A A . 4 ASP CA 1 1 10 5284 1 1 4 ASP CB C -3.111 -4.086 2.665 1.00 . A A . 4 ASP CB 1 1 10 5285 1 1 4 ASP CG C -3.948 -4.857 3.686 1.00 . A A . 4 ASP CG 1 1 10 5286 1 1 4 ASP H H -4.845 -2.469 3.701 1.00 . A A . 4 ASP H 1 1 10 5287 1 1 4 ASP HA H -3.422 -2.452 1.288 1.00 . A A . 4 ASP HA 1 1 10 5288 1 1 4 ASP HB2 H -2.609 -4.783 2.009 1.00 . A A . 4 ASP HB2 1 1 10 5289 1 1 4 ASP HB3 H -2.375 -3.490 3.186 1.00 . A A . 4 ASP HB3 1 1 10 5290 1 1 4 ASP N N -4.967 -2.455 2.729 1.00 . A A . 4 ASP N 1 1 10 5291 1 1 4 ASP O O -6.009 -4.240 1.081 1.00 . A A . 4 ASP O 1 1 10 5292 1 1 4 ASP OD1 O -4.161 -4.331 4.767 1.00 . A A . 4 ASP OD1 1 1 10 5293 1 1 4 ASP OD2 O -4.364 -5.959 3.371 1.00 . A A . 4 ASP OD2 1 1 10 5294 1 1 5 TRP C C -4.267 -6.409 -1.733 1.00 . A A . 5 TRP C 1 1 10 5295 1 1 5 TRP CA C -5.099 -5.258 -1.168 1.00 . A A . 5 TRP CA 1 1 10 5296 1 1 5 TRP CB C -5.601 -4.362 -2.300 1.00 . A A . 5 TRP CB 1 1 10 5297 1 1 5 TRP CD1 C -7.163 -2.524 -1.538 1.00 . A A . 5 TRP CD1 1 1 10 5298 1 1 5 TRP CD2 C -8.199 -4.507 -1.752 1.00 . A A . 5 TRP CD2 1 1 10 5299 1 1 5 TRP CE2 C -9.180 -3.577 -1.324 1.00 . A A . 5 TRP CE2 1 1 10 5300 1 1 5 TRP CE3 C -8.592 -5.837 -1.962 1.00 . A A . 5 TRP CE3 1 1 10 5301 1 1 5 TRP CG C -6.924 -3.810 -1.881 1.00 . A A . 5 TRP CG 1 1 10 5302 1 1 5 TRP CH2 C -10.878 -5.293 -1.328 1.00 . A A . 5 TRP CH2 1 1 10 5303 1 1 5 TRP CZ2 C -10.508 -3.962 -1.112 1.00 . A A . 5 TRP CZ2 1 1 10 5304 1 1 5 TRP CZ3 C -9.921 -6.226 -1.751 1.00 . A A . 5 TRP CZ3 1 1 10 5305 1 1 5 TRP H H -3.325 -4.265 -0.423 1.00 . A A . 5 TRP H 1 1 10 5306 1 1 5 TRP HA H -5.958 -5.657 -0.631 1.00 . A A . 5 TRP HA 1 1 10 5307 1 1 5 TRP HB2 H -4.897 -3.560 -2.471 1.00 . A A . 5 TRP HB2 1 1 10 5308 1 1 5 TRP HB3 H -5.722 -4.943 -3.202 1.00 . A A . 5 TRP HB3 1 1 10 5309 1 1 5 TRP HD1 H -6.427 -1.736 -1.525 1.00 . A A . 5 TRP HD1 1 1 10 5310 1 1 5 TRP HE1 H -8.924 -1.548 -0.926 1.00 . A A . 5 TRP HE1 1 1 10 5311 1 1 5 TRP HE3 H -7.863 -6.564 -2.288 1.00 . A A . 5 TRP HE3 1 1 10 5312 1 1 5 TRP HH2 H -11.900 -5.603 -1.169 1.00 . A A . 5 TRP HH2 1 1 10 5313 1 1 5 TRP HZ2 H -11.240 -3.238 -0.788 1.00 . A A . 5 TRP HZ2 1 1 10 5314 1 1 5 TRP HZ3 H -10.213 -7.253 -1.916 1.00 . A A . 5 TRP HZ3 1 1 10 5315 1 1 5 TRP N N -4.271 -4.451 -0.230 1.00 . A A . 5 TRP N 1 1 10 5316 1 1 5 TRP NE1 N -8.497 -2.383 -1.209 1.00 . A A . 5 TRP NE1 1 1 10 5317 1 1 5 TRP O O -4.822 -7.402 -2.162 1.00 . A A . 5 TRP O 1 1 10 5318 1 1 6 PHE C C -2.046 -8.442 -1.133 1.00 . A A . 6 PHE C 1 1 10 5319 1 1 6 PHE CA C -2.207 -7.483 -2.309 1.00 . A A . 6 PHE CA 1 1 10 5320 1 1 6 PHE CB C -0.835 -6.975 -2.743 1.00 . A A . 6 PHE CB 1 1 10 5321 1 1 6 PHE CD1 C -1.838 -6.213 -4.904 1.00 . A A . 6 PHE CD1 1 1 10 5322 1 1 6 PHE CD2 C -0.384 -4.715 -3.671 1.00 . A A . 6 PHE CD2 1 1 10 5323 1 1 6 PHE CE1 C -2.007 -5.242 -5.884 1.00 . A A . 6 PHE CE1 1 1 10 5324 1 1 6 PHE CE2 C -0.551 -3.744 -4.647 1.00 . A A . 6 PHE CE2 1 1 10 5325 1 1 6 PHE CG C -1.028 -5.941 -3.806 1.00 . A A . 6 PHE CG 1 1 10 5326 1 1 6 PHE CZ C -1.363 -4.010 -5.752 1.00 . A A . 6 PHE CZ 1 1 10 5327 1 1 6 PHE H H -2.443 -5.568 -1.423 1.00 . A A . 6 PHE H 1 1 10 5328 1 1 6 PHE HA H -2.743 -7.923 -3.137 1.00 . A A . 6 PHE HA 1 1 10 5329 1 1 6 PHE HB2 H -0.324 -6.503 -1.919 1.00 . A A . 6 PHE HB2 1 1 10 5330 1 1 6 PHE HB3 H -0.247 -7.775 -3.152 1.00 . A A . 6 PHE HB3 1 1 10 5331 1 1 6 PHE HD1 H -2.330 -7.165 -4.996 1.00 . A A . 6 PHE HD1 1 1 10 5332 1 1 6 PHE HD2 H 0.239 -4.513 -2.821 1.00 . A A . 6 PHE HD2 1 1 10 5333 1 1 6 PHE HE1 H -2.634 -5.454 -6.732 1.00 . A A . 6 PHE HE1 1 1 10 5334 1 1 6 PHE HE2 H -0.046 -2.805 -4.525 1.00 . A A . 6 PHE HE2 1 1 10 5335 1 1 6 PHE HZ H -1.491 -3.261 -6.506 1.00 . A A . 6 PHE HZ 1 1 10 5336 1 1 6 PHE N N -2.959 -6.335 -1.753 1.00 . A A . 6 PHE N 1 1 10 5337 1 1 6 PHE O O -2.963 -8.616 -0.355 1.00 . A A . 6 PHE O 1 1 10 5338 1 1 7 LYS C C -0.431 -9.238 1.476 1.00 . A A . 7 LYS C 1 1 10 5339 1 1 7 LYS CA C -0.831 -9.992 0.202 1.00 . A A . 7 LYS CA 1 1 10 5340 1 1 7 LYS CB C 0.179 -11.105 -0.083 1.00 . A A . 7 LYS CB 1 1 10 5341 1 1 7 LYS CD C -0.998 -12.999 -1.210 1.00 . A A . 7 LYS CD 1 1 10 5342 1 1 7 LYS CE C -0.138 -14.186 -1.651 1.00 . A A . 7 LYS CE 1 1 10 5343 1 1 7 LYS CG C -0.486 -12.466 0.130 1.00 . A A . 7 LYS CG 1 1 10 5344 1 1 7 LYS H H -0.173 -8.939 -1.595 1.00 . A A . 7 LYS H 1 1 10 5345 1 1 7 LYS HA H -1.802 -10.432 0.364 1.00 . A A . 7 LYS HA 1 1 10 5346 1 1 7 LYS HB2 H 0.523 -11.024 -1.103 1.00 . A A . 7 LYS HB2 1 1 10 5347 1 1 7 LYS HB3 H 1.017 -11.012 0.591 1.00 . A A . 7 LYS HB3 1 1 10 5348 1 1 7 LYS HD2 H -2.025 -13.314 -1.102 1.00 . A A . 7 LYS HD2 1 1 10 5349 1 1 7 LYS HD3 H -0.935 -12.220 -1.955 1.00 . A A . 7 LYS HD3 1 1 10 5350 1 1 7 LYS HE2 H 0.787 -14.186 -1.094 1.00 . A A . 7 LYS HE2 1 1 10 5351 1 1 7 LYS HE3 H -0.672 -15.106 -1.464 1.00 . A A . 7 LYS HE3 1 1 10 5352 1 1 7 LYS HG2 H 0.234 -13.157 0.544 1.00 . A A . 7 LYS HG2 1 1 10 5353 1 1 7 LYS HG3 H -1.318 -12.360 0.809 1.00 . A A . 7 LYS HG3 1 1 10 5354 1 1 7 LYS HZ1 H 0.421 -13.090 -3.333 1.00 . A A . 7 LYS HZ1 1 1 10 5355 1 1 7 LYS HZ2 H 0.948 -14.699 -3.352 1.00 . A A . 7 LYS HZ2 1 1 10 5356 1 1 7 LYS HZ3 H -0.686 -14.341 -3.653 1.00 . A A . 7 LYS HZ3 1 1 10 5357 1 1 7 LYS N N -0.921 -9.073 -0.969 1.00 . A A . 7 LYS N 1 1 10 5358 1 1 7 LYS NZ N 0.158 -14.070 -3.106 1.00 . A A . 7 LYS NZ 1 1 10 5359 1 1 7 LYS O O 0.227 -9.793 2.334 1.00 . A A . 7 LYS O 1 1 10 5360 1 1 8 GLU C C 1.006 -6.808 2.917 1.00 . A A . 8 GLU C 1 1 10 5361 1 1 8 GLU CA C -0.479 -7.179 2.823 1.00 . A A . 8 GLU CA 1 1 10 5362 1 1 8 GLU CB C -0.947 -7.966 4.042 1.00 . A A . 8 GLU CB 1 1 10 5363 1 1 8 GLU CD C -2.697 -7.850 5.824 1.00 . A A . 8 GLU CD 1 1 10 5364 1 1 8 GLU CG C -1.702 -7.037 4.993 1.00 . A A . 8 GLU CG 1 1 10 5365 1 1 8 GLU H H -1.347 -7.576 0.922 1.00 . A A . 8 GLU H 1 1 10 5366 1 1 8 GLU HA H -1.031 -6.251 2.791 1.00 . A A . 8 GLU HA 1 1 10 5367 1 1 8 GLU HB2 H -1.608 -8.742 3.685 1.00 . A A . 8 GLU HB2 1 1 10 5368 1 1 8 GLU HB3 H -0.100 -8.403 4.547 1.00 . A A . 8 GLU HB3 1 1 10 5369 1 1 8 GLU HG2 H -0.998 -6.544 5.648 1.00 . A A . 8 GLU HG2 1 1 10 5370 1 1 8 GLU HG3 H -2.241 -6.299 4.419 1.00 . A A . 8 GLU HG3 1 1 10 5371 1 1 8 GLU N N -0.816 -7.995 1.620 1.00 . A A . 8 GLU N 1 1 10 5372 1 1 8 GLU O O 1.342 -5.809 3.522 1.00 . A A . 8 GLU O 1 1 10 5373 1 1 8 GLU OE1 O -2.673 -9.065 5.718 1.00 . A A . 8 GLU OE1 1 1 10 5374 1 1 8 GLU OE2 O -3.465 -7.244 6.552 1.00 . A A . 8 GLU OE2 1 1 10 5375 1 1 9 THR C C 3.698 -6.428 1.168 1.00 . A A . 9 THR C 1 1 10 5376 1 1 9 THR CA C 3.343 -7.186 2.443 1.00 . A A . 9 THR CA 1 1 10 5377 1 1 9 THR CB C 4.116 -8.485 2.632 1.00 . A A . 9 THR CB 1 1 10 5378 1 1 9 THR CG2 C 3.657 -9.036 3.982 1.00 . A A . 9 THR CG2 1 1 10 5379 1 1 9 THR H H 1.674 -8.361 1.854 1.00 . A A . 9 THR H 1 1 10 5380 1 1 9 THR HA H 3.485 -6.534 3.294 1.00 . A A . 9 THR HA 1 1 10 5381 1 1 9 THR HB H 5.175 -8.297 2.675 1.00 . A A . 9 THR HB 1 1 10 5382 1 1 9 THR HG1 H 4.470 -9.275 0.890 1.00 . A A . 9 THR HG1 1 1 10 5383 1 1 9 THR HG21 H 2.932 -8.350 4.404 1.00 . A A . 9 THR HG21 1 1 10 5384 1 1 9 THR HG22 H 3.196 -10.003 3.839 1.00 . A A . 9 THR HG22 1 1 10 5385 1 1 9 THR HG23 H 4.500 -9.125 4.649 1.00 . A A . 9 THR HG23 1 1 10 5386 1 1 9 THR N N 1.909 -7.555 2.348 1.00 . A A . 9 THR N 1 1 10 5387 1 1 9 THR O O 4.527 -5.544 1.191 1.00 . A A . 9 THR O 1 1 10 5388 1 1 9 THR OG1 O 3.802 -9.379 1.571 1.00 . A A . 9 THR OG1 1 1 10 5389 1 1 10 ALA C C 3.243 -4.593 -0.817 1.00 . A A . 10 ALA C 1 1 10 5390 1 1 10 ALA CA C 3.348 -6.065 -1.206 1.00 . A A . 10 ALA CA 1 1 10 5391 1 1 10 ALA CB C 2.231 -6.371 -2.209 1.00 . A A . 10 ALA CB 1 1 10 5392 1 1 10 ALA H H 2.398 -7.486 0.107 1.00 . A A . 10 ALA H 1 1 10 5393 1 1 10 ALA HA H 4.328 -6.294 -1.597 1.00 . A A . 10 ALA HA 1 1 10 5394 1 1 10 ALA HB1 H 1.939 -7.407 -2.126 1.00 . A A . 10 ALA HB1 1 1 10 5395 1 1 10 ALA HB2 H 1.377 -5.742 -1.990 1.00 . A A . 10 ALA HB2 1 1 10 5396 1 1 10 ALA HB3 H 2.574 -6.171 -3.213 1.00 . A A . 10 ALA HB3 1 1 10 5397 1 1 10 ALA N N 3.065 -6.770 0.076 1.00 . A A . 10 ALA N 1 1 10 5398 1 1 10 ALA O O 3.994 -3.736 -1.235 1.00 . A A . 10 ALA O 1 1 10 5399 1 1 11 CYS C C 3.249 -2.500 1.242 1.00 . A A . 11 CYS C 1 1 10 5400 1 1 11 CYS CA C 1.981 -2.991 0.535 1.00 . A A . 11 CYS CA 1 1 10 5401 1 1 11 CYS CB C 0.773 -3.181 1.459 1.00 . A A . 11 CYS CB 1 1 10 5402 1 1 11 CYS H H 1.696 -5.085 0.319 1.00 . A A . 11 CYS H 1 1 10 5403 1 1 11 CYS HA H 1.734 -2.328 -0.280 1.00 . A A . 11 CYS HA 1 1 10 5404 1 1 11 CYS HB2 H 1.011 -3.851 2.275 1.00 . A A . 11 CYS HB2 1 1 10 5405 1 1 11 CYS HB3 H 0.433 -2.233 1.838 1.00 . A A . 11 CYS HB3 1 1 10 5406 1 1 11 CYS N N 2.268 -4.350 0.016 1.00 . A A . 11 CYS N 1 1 10 5407 1 1 11 CYS O O 3.878 -1.551 0.819 1.00 . A A . 11 CYS O 1 1 10 5408 1 1 11 CYS SG S -0.559 -3.922 0.484 1.00 . A A . 11 CYS SG 1 1 10 5409 1 1 12 ARG C C 5.972 -2.444 2.069 1.00 . A A . 12 ARG C 1 1 10 5410 1 1 12 ARG CA C 4.855 -2.738 3.064 1.00 . A A . 12 ARG CA 1 1 10 5411 1 1 12 ARG CB C 5.290 -3.878 3.986 1.00 . A A . 12 ARG CB 1 1 10 5412 1 1 12 ARG CD C 7.296 -4.716 5.220 1.00 . A A . 12 ARG CD 1 1 10 5413 1 1 12 ARG CG C 6.817 -3.969 3.973 1.00 . A A . 12 ARG CG 1 1 10 5414 1 1 12 ARG CZ C 9.714 -4.791 5.337 1.00 . A A . 12 ARG CZ 1 1 10 5415 1 1 12 ARG H H 3.102 -3.902 2.619 1.00 . A A . 12 ARG H 1 1 10 5416 1 1 12 ARG HA H 4.692 -1.843 3.642 1.00 . A A . 12 ARG HA 1 1 10 5417 1 1 12 ARG HB2 H 4.942 -3.682 4.989 1.00 . A A . 12 ARG HB2 1 1 10 5418 1 1 12 ARG HB3 H 4.877 -4.809 3.629 1.00 . A A . 12 ARG HB3 1 1 10 5419 1 1 12 ARG HD2 H 7.407 -4.018 6.037 1.00 . A A . 12 ARG HD2 1 1 10 5420 1 1 12 ARG HD3 H 6.574 -5.472 5.486 1.00 . A A . 12 ARG HD3 1 1 10 5421 1 1 12 ARG HE H 8.644 -6.212 4.453 1.00 . A A . 12 ARG HE 1 1 10 5422 1 1 12 ARG HG2 H 7.131 -4.498 3.085 1.00 . A A . 12 ARG HG2 1 1 10 5423 1 1 12 ARG HG3 H 7.237 -2.974 3.968 1.00 . A A . 12 ARG HG3 1 1 10 5424 1 1 12 ARG HH11 H 9.277 -3.022 4.509 1.00 . A A . 12 ARG HH11 1 1 10 5425 1 1 12 ARG HH12 H 10.791 -3.104 5.346 1.00 . A A . 12 ARG HH12 1 1 10 5426 1 1 12 ARG HH21 H 10.407 -6.429 6.258 1.00 . A A . 12 ARG HH21 1 1 10 5427 1 1 12 ARG HH22 H 11.431 -5.034 6.338 1.00 . A A . 12 ARG HH22 1 1 10 5428 1 1 12 ARG N N 3.631 -3.141 2.312 1.00 . A A . 12 ARG N 1 1 10 5429 1 1 12 ARG NE N 8.610 -5.361 4.938 1.00 . A A . 12 ARG NE 1 1 10 5430 1 1 12 ARG NH1 N 9.946 -3.542 5.041 1.00 . A A . 12 ARG NH1 1 1 10 5431 1 1 12 ARG NH2 N 10.585 -5.471 6.032 1.00 . A A . 12 ARG NH2 1 1 10 5432 1 1 12 ARG O O 6.875 -1.680 2.347 1.00 . A A . 12 ARG O 1 1 10 5433 1 1 13 HIS C C 6.812 -1.238 -0.275 1.00 . A A . 13 HIS C 1 1 10 5434 1 1 13 HIS CA C 7.010 -2.731 -0.053 1.00 . A A . 13 HIS CA 1 1 10 5435 1 1 13 HIS CB C 6.785 -3.508 -1.354 1.00 . A A . 13 HIS CB 1 1 10 5436 1 1 13 HIS CD2 C 9.060 -4.807 -1.139 1.00 . A A . 13 HIS CD2 1 1 10 5437 1 1 13 HIS CE1 C 9.700 -4.660 -3.203 1.00 . A A . 13 HIS CE1 1 1 10 5438 1 1 13 HIS CG C 8.084 -4.110 -1.811 1.00 . A A . 13 HIS CG 1 1 10 5439 1 1 13 HIS H H 5.204 -3.640 0.663 1.00 . A A . 13 HIS H 1 1 10 5440 1 1 13 HIS HA H 7.976 -2.925 0.392 1.00 . A A . 13 HIS HA 1 1 10 5441 1 1 13 HIS HB2 H 6.064 -4.294 -1.181 1.00 . A A . 13 HIS HB2 1 1 10 5442 1 1 13 HIS HB3 H 6.410 -2.840 -2.116 1.00 . A A . 13 HIS HB3 1 1 10 5443 1 1 13 HIS HD1 H 8.043 -3.593 -3.863 1.00 . A A . 13 HIS HD1 1 1 10 5444 1 1 13 HIS HD2 H 9.038 -5.048 -0.086 1.00 . A A . 13 HIS HD2 1 1 10 5445 1 1 13 HIS HE1 H 10.275 -4.756 -4.112 1.00 . A A . 13 HIS HE1 1 1 10 5446 1 1 13 HIS N N 5.925 -3.029 0.907 1.00 . A A . 13 HIS N 1 1 10 5447 1 1 13 HIS ND1 N 8.516 -4.029 -3.125 1.00 . A A . 13 HIS ND1 1 1 10 5448 1 1 13 HIS NE2 N 10.080 -5.153 -2.022 1.00 . A A . 13 HIS NE2 1 1 10 5449 1 1 13 HIS O O 7.558 -0.426 0.215 1.00 . A A . 13 HIS O 1 1 10 5450 1 1 14 ALA C C 5.847 1.458 -0.118 1.00 . A A . 14 ALA C 1 1 10 5451 1 1 14 ALA CA C 5.499 0.539 -1.295 1.00 . A A . 14 ALA CA 1 1 10 5452 1 1 14 ALA CB C 4.002 0.692 -1.552 1.00 . A A . 14 ALA CB 1 1 10 5453 1 1 14 ALA H H 5.216 -1.596 -1.381 1.00 . A A . 14 ALA H 1 1 10 5454 1 1 14 ALA HA H 6.027 0.844 -2.187 1.00 . A A . 14 ALA HA 1 1 10 5455 1 1 14 ALA HB1 H 3.572 -0.280 -1.743 1.00 . A A . 14 ALA HB1 1 1 10 5456 1 1 14 ALA HB2 H 3.535 1.122 -0.679 1.00 . A A . 14 ALA HB2 1 1 10 5457 1 1 14 ALA HB3 H 3.847 1.334 -2.410 1.00 . A A . 14 ALA HB3 1 1 10 5458 1 1 14 ALA N N 5.795 -0.895 -1.011 1.00 . A A . 14 ALA N 1 1 10 5459 1 1 14 ALA O O 6.433 2.506 -0.306 1.00 . A A . 14 ALA O 1 1 10 5460 1 1 15 LYS C C 7.332 2.195 2.301 1.00 . A A . 15 LYS C 1 1 10 5461 1 1 15 LYS CA C 5.815 1.966 2.249 1.00 . A A . 15 LYS CA 1 1 10 5462 1 1 15 LYS CB C 5.279 1.213 3.473 1.00 . A A . 15 LYS CB 1 1 10 5463 1 1 15 LYS CD C 7.018 0.594 5.161 1.00 . A A . 15 LYS CD 1 1 10 5464 1 1 15 LYS CE C 6.852 0.336 6.660 1.00 . A A . 15 LYS CE 1 1 10 5465 1 1 15 LYS CG C 6.028 1.671 4.713 1.00 . A A . 15 LYS CG 1 1 10 5466 1 1 15 LYS H H 5.028 0.272 1.284 1.00 . A A . 15 LYS H 1 1 10 5467 1 1 15 LYS HA H 5.292 2.912 2.152 1.00 . A A . 15 LYS HA 1 1 10 5468 1 1 15 LYS HB2 H 4.222 1.410 3.605 1.00 . A A . 15 LYS HB2 1 1 10 5469 1 1 15 LYS HB3 H 5.427 0.150 3.350 1.00 . A A . 15 LYS HB3 1 1 10 5470 1 1 15 LYS HD2 H 6.828 -0.317 4.612 1.00 . A A . 15 LYS HD2 1 1 10 5471 1 1 15 LYS HD3 H 8.027 0.928 4.969 1.00 . A A . 15 LYS HD3 1 1 10 5472 1 1 15 LYS HE2 H 6.799 1.279 7.184 1.00 . A A . 15 LYS HE2 1 1 10 5473 1 1 15 LYS HE3 H 5.942 -0.222 6.830 1.00 . A A . 15 LYS HE3 1 1 10 5474 1 1 15 LYS HG2 H 6.549 2.579 4.462 1.00 . A A . 15 LYS HG2 1 1 10 5475 1 1 15 LYS HG3 H 5.307 1.857 5.491 1.00 . A A . 15 LYS HG3 1 1 10 5476 1 1 15 LYS HZ1 H 8.551 -0.830 6.356 1.00 . A A . 15 LYS HZ1 1 1 10 5477 1 1 15 LYS HZ2 H 8.630 0.174 7.726 1.00 . A A . 15 LYS HZ2 1 1 10 5478 1 1 15 LYS HZ3 H 7.678 -1.235 7.750 1.00 . A A . 15 LYS HZ3 1 1 10 5479 1 1 15 LYS N N 5.500 1.103 1.090 1.00 . A A . 15 LYS N 1 1 10 5480 1 1 15 LYS NZ N 8.016 -0.447 7.161 1.00 . A A . 15 LYS NZ 1 1 10 5481 1 1 15 LYS O O 7.765 3.326 2.402 1.00 . A A . 15 LYS O 1 1 10 5482 1 1 16 SER C C 10.336 1.596 0.945 1.00 . A A . 16 SER C 1 1 10 5483 1 1 16 SER CA C 9.630 1.476 2.300 1.00 . A A . 16 SER CA 1 1 10 5484 1 1 16 SER CB C 10.310 0.407 3.150 1.00 . A A . 16 SER CB 1 1 10 5485 1 1 16 SER H H 7.864 0.254 2.163 1.00 . A A . 16 SER H 1 1 10 5486 1 1 16 SER HA H 9.758 2.415 2.803 1.00 . A A . 16 SER HA 1 1 10 5487 1 1 16 SER HB2 H 9.560 -0.241 3.576 1.00 . A A . 16 SER HB2 1 1 10 5488 1 1 16 SER HB3 H 10.961 -0.178 2.516 1.00 . A A . 16 SER HB3 1 1 10 5489 1 1 16 SER HG H 11.154 0.390 4.902 1.00 . A A . 16 SER HG 1 1 10 5490 1 1 16 SER N N 8.167 1.185 2.240 1.00 . A A . 16 SER N 1 1 10 5491 1 1 16 SER O O 11.525 1.849 0.917 1.00 . A A . 16 SER O 1 1 10 5492 1 1 16 SER OG O 11.032 1.035 4.201 1.00 . A A . 16 SER OG 1 1 10 5493 1 1 17 LEU C C 10.150 2.962 -1.997 1.00 . A A . 17 LEU C 1 1 10 5494 1 1 17 LEU CA C 10.471 1.583 -1.439 1.00 . A A . 17 LEU CA 1 1 10 5495 1 1 17 LEU CB C 10.044 0.677 -2.592 1.00 . A A . 17 LEU CB 1 1 10 5496 1 1 17 LEU CD1 C 8.049 -0.586 -2.966 1.00 . A A . 17 LEU CD1 1 1 10 5497 1 1 17 LEU CD2 C 10.203 -1.791 -2.571 1.00 . A A . 17 LEU CD2 1 1 10 5498 1 1 17 LEU CG C 9.341 -0.597 -2.155 1.00 . A A . 17 LEU CG 1 1 10 5499 1 1 17 LEU H H 8.738 1.241 -0.189 1.00 . A A . 17 LEU H 1 1 10 5500 1 1 17 LEU HA H 11.530 1.484 -1.251 1.00 . A A . 17 LEU HA 1 1 10 5501 1 1 17 LEU HB2 H 9.330 1.226 -3.191 1.00 . A A . 17 LEU HB2 1 1 10 5502 1 1 17 LEU HB3 H 10.904 0.430 -3.196 1.00 . A A . 17 LEU HB3 1 1 10 5503 1 1 17 LEU HD11 H 7.659 0.424 -2.996 1.00 . A A . 17 LEU HD11 1 1 10 5504 1 1 17 LEU HD12 H 8.307 -0.891 -3.968 1.00 . A A . 17 LEU HD12 1 1 10 5505 1 1 17 LEU HD13 H 7.308 -1.260 -2.561 1.00 . A A . 17 LEU HD13 1 1 10 5506 1 1 17 LEU HD21 H 11.242 -1.496 -2.557 1.00 . A A . 17 LEU HD21 1 1 10 5507 1 1 17 LEU HD22 H 10.048 -2.606 -1.880 1.00 . A A . 17 LEU HD22 1 1 10 5508 1 1 17 LEU HD23 H 9.927 -2.101 -3.567 1.00 . A A . 17 LEU HD23 1 1 10 5509 1 1 17 LEU HG H 9.160 -0.574 -1.093 1.00 . A A . 17 LEU HG 1 1 10 5510 1 1 17 LEU N N 9.693 1.440 -0.177 1.00 . A A . 17 LEU N 1 1 10 5511 1 1 17 LEU O O 11.014 3.762 -2.295 1.00 . A A . 17 LEU O 1 1 10 5512 1 1 18 GLY C C 7.049 4.560 -3.142 1.00 . A A . 18 GLY C 1 1 10 5513 1 1 18 GLY CA C 8.505 4.546 -2.682 1.00 . A A . 18 GLY CA 1 1 10 5514 1 1 18 GLY H H 8.193 2.563 -1.895 1.00 . A A . 18 GLY H 1 1 10 5515 1 1 18 GLY HA2 H 8.666 5.306 -1.936 1.00 . A A . 18 GLY HA2 1 1 10 5516 1 1 18 GLY HA3 H 9.140 4.711 -3.536 1.00 . A A . 18 GLY HA3 1 1 10 5517 1 1 18 GLY N N 8.880 3.221 -2.137 1.00 . A A . 18 GLY N 1 1 10 5518 1 1 18 GLY O O 6.283 5.442 -2.807 1.00 . A A . 18 GLY O 1 1 10 5519 1 1 19 ASN C C 4.222 3.903 -3.370 1.00 . A A . 19 ASN C 1 1 10 5520 1 1 19 ASN CA C 5.272 3.523 -4.414 1.00 . A A . 19 ASN CA 1 1 10 5521 1 1 19 ASN CB C 4.877 2.134 -4.899 1.00 . A A . 19 ASN CB 1 1 10 5522 1 1 19 ASN CG C 6.049 1.191 -5.178 1.00 . A A . 19 ASN CG 1 1 10 5523 1 1 19 ASN H H 7.301 2.884 -4.179 1.00 . A A . 19 ASN H 1 1 10 5524 1 1 19 ASN HA H 5.191 4.193 -5.256 1.00 . A A . 19 ASN HA 1 1 10 5525 1 1 19 ASN HB2 H 4.179 1.685 -4.217 1.00 . A A . 19 ASN HB2 1 1 10 5526 1 1 19 ASN HB3 H 4.342 2.291 -5.807 1.00 . A A . 19 ASN HB3 1 1 10 5527 1 1 19 ASN HD21 H 5.236 -0.324 -4.192 1.00 . A A . 19 ASN HD21 1 1 10 5528 1 1 19 ASN HD22 H 6.740 -0.642 -4.898 1.00 . A A . 19 ASN HD22 1 1 10 5529 1 1 19 ASN N N 6.670 3.583 -3.916 1.00 . A A . 19 ASN N 1 1 10 5530 1 1 19 ASN ND2 N 6.006 -0.025 -4.714 1.00 . A A . 19 ASN ND2 1 1 10 5531 1 1 19 ASN O O 3.129 4.243 -3.775 1.00 . A A . 19 ASN O 1 1 10 5532 1 1 19 ASN OD1 O 7.009 1.566 -5.822 1.00 . A A . 19 ASN OD1 1 1 10 5533 1 1 20 CYS C C 2.611 5.342 -1.540 1.00 . A A . 20 CYS C 1 1 10 5534 1 1 20 CYS CA C 3.513 4.209 -1.052 1.00 . A A . 20 CYS CA 1 1 10 5535 1 1 20 CYS CB C 4.191 4.691 0.229 1.00 . A A . 20 CYS CB 1 1 10 5536 1 1 20 CYS H H 5.412 3.563 -1.812 1.00 . A A . 20 CYS H 1 1 10 5537 1 1 20 CYS HA H 2.909 3.344 -0.824 1.00 . A A . 20 CYS HA 1 1 10 5538 1 1 20 CYS HB2 H 4.193 3.898 0.964 1.00 . A A . 20 CYS HB2 1 1 10 5539 1 1 20 CYS HB3 H 5.201 5.005 0.019 1.00 . A A . 20 CYS HB3 1 1 10 5540 1 1 20 CYS N N 4.519 3.849 -2.095 1.00 . A A . 20 CYS N 1 1 10 5541 1 1 20 CYS O O 1.428 5.355 -1.283 1.00 . A A . 20 CYS O 1 1 10 5542 1 1 20 CYS SG S 3.238 6.105 0.837 1.00 . A A . 20 CYS SG 1 1 10 5543 1 1 21 ARG C C 2.536 7.716 -4.224 1.00 . A A . 21 ARG C 1 1 10 5544 1 1 21 ARG CA C 2.321 7.423 -2.737 1.00 . A A . 21 ARG CA 1 1 10 5545 1 1 21 ARG CB C 2.735 8.662 -1.962 1.00 . A A . 21 ARG CB 1 1 10 5546 1 1 21 ARG CD C 1.323 10.244 -0.638 1.00 . A A . 21 ARG CD 1 1 10 5547 1 1 21 ARG CG C 1.826 8.804 -0.740 1.00 . A A . 21 ARG CG 1 1 10 5548 1 1 21 ARG CZ C 2.792 12.057 -1.292 1.00 . A A . 21 ARG CZ 1 1 10 5549 1 1 21 ARG H H 4.122 6.259 -2.427 1.00 . A A . 21 ARG H 1 1 10 5550 1 1 21 ARG HA H 1.278 7.240 -2.533 1.00 . A A . 21 ARG HA 1 1 10 5551 1 1 21 ARG HB2 H 3.767 8.529 -1.674 1.00 . A A . 21 ARG HB2 1 1 10 5552 1 1 21 ARG HB3 H 2.640 9.525 -2.602 1.00 . A A . 21 ARG HB3 1 1 10 5553 1 1 21 ARG HD2 H 0.831 10.519 -1.559 1.00 . A A . 21 ARG HD2 1 1 10 5554 1 1 21 ARG HD3 H 0.625 10.325 0.181 1.00 . A A . 21 ARG HD3 1 1 10 5555 1 1 21 ARG HE H 3.000 11.080 0.424 1.00 . A A . 21 ARG HE 1 1 10 5556 1 1 21 ARG HG2 H 0.987 8.129 -0.848 1.00 . A A . 21 ARG HG2 1 1 10 5557 1 1 21 ARG HG3 H 2.379 8.553 0.154 1.00 . A A . 21 ARG HG3 1 1 10 5558 1 1 21 ARG HH11 H 1.360 13.336 -0.725 1.00 . A A . 21 ARG HH11 1 1 10 5559 1 1 21 ARG HH12 H 2.359 13.862 -2.040 1.00 . A A . 21 ARG HH12 1 1 10 5560 1 1 21 ARG HH21 H 4.297 10.987 -2.065 1.00 . A A . 21 ARG HH21 1 1 10 5561 1 1 21 ARG HH22 H 4.021 12.531 -2.798 1.00 . A A . 21 ARG HH22 1 1 10 5562 1 1 21 ARG N N 3.161 6.293 -2.240 1.00 . A A . 21 ARG N 1 1 10 5563 1 1 21 ARG NE N 2.477 11.156 -0.401 1.00 . A A . 21 ARG NE 1 1 10 5564 1 1 21 ARG NH1 N 2.118 13.172 -1.357 1.00 . A A . 21 ARG NH1 1 1 10 5565 1 1 21 ARG NH2 N 3.781 11.842 -2.116 1.00 . A A . 21 ARG NH2 1 1 10 5566 1 1 21 ARG O O 1.988 8.659 -4.760 1.00 . A A . 21 ARG O 1 1 10 5567 1 1 22 THR C C 2.785 6.171 -7.198 1.00 . A A . 22 THR C 1 1 10 5568 1 1 22 THR CA C 3.571 7.169 -6.347 1.00 . A A . 22 THR CA 1 1 10 5569 1 1 22 THR CB C 5.065 7.012 -6.637 1.00 . A A . 22 THR CB 1 1 10 5570 1 1 22 THR CG2 C 5.855 7.078 -5.329 1.00 . A A . 22 THR CG2 1 1 10 5571 1 1 22 THR H H 3.751 6.181 -4.444 1.00 . A A . 22 THR H 1 1 10 5572 1 1 22 THR HA H 3.269 8.173 -6.602 1.00 . A A . 22 THR HA 1 1 10 5573 1 1 22 THR HB H 5.396 7.810 -7.283 1.00 . A A . 22 THR HB 1 1 10 5574 1 1 22 THR HG1 H 5.852 5.909 -8.032 1.00 . A A . 22 THR HG1 1 1 10 5575 1 1 22 THR HG21 H 5.470 7.879 -4.716 1.00 . A A . 22 THR HG21 1 1 10 5576 1 1 22 THR HG22 H 5.758 6.141 -4.801 1.00 . A A . 22 THR HG22 1 1 10 5577 1 1 22 THR HG23 H 6.898 7.261 -5.547 1.00 . A A . 22 THR HG23 1 1 10 5578 1 1 22 THR N N 3.323 6.930 -4.899 1.00 . A A . 22 THR N 1 1 10 5579 1 1 22 THR O O 2.703 6.315 -8.402 1.00 . A A . 22 THR O 1 1 10 5580 1 1 22 THR OG1 O 5.289 5.760 -7.271 1.00 . A A . 22 THR OG1 1 1 10 5581 1 1 23 SER C C -0.011 4.243 -6.948 1.00 . A A . 23 SER C 1 1 10 5582 1 1 23 SER CA C 1.439 4.193 -7.435 1.00 . A A . 23 SER CA 1 1 10 5583 1 1 23 SER CB C 2.090 2.825 -7.237 1.00 . A A . 23 SER CB 1 1 10 5584 1 1 23 SER H H 2.258 5.031 -5.636 1.00 . A A . 23 SER H 1 1 10 5585 1 1 23 SER HA H 1.475 4.483 -8.475 1.00 . A A . 23 SER HA 1 1 10 5586 1 1 23 SER HB2 H 2.624 2.822 -6.298 1.00 . A A . 23 SER HB2 1 1 10 5587 1 1 23 SER HB3 H 1.322 2.065 -7.210 1.00 . A A . 23 SER HB3 1 1 10 5588 1 1 23 SER HG H 3.112 3.412 -8.785 1.00 . A A . 23 SER HG 1 1 10 5589 1 1 23 SER N N 2.203 5.163 -6.608 1.00 . A A . 23 SER N 1 1 10 5590 1 1 23 SER O O -0.259 4.491 -5.787 1.00 . A A . 23 SER O 1 1 10 5591 1 1 23 SER OG O 3.016 2.595 -8.290 1.00 . A A . 23 SER OG 1 1 10 5592 1 1 24 GLN C C -2.754 2.796 -6.564 1.00 . A A . 24 GLN C 1 1 10 5593 1 1 24 GLN CA C -2.383 4.087 -7.295 1.00 . A A . 24 GLN CA 1 1 10 5594 1 1 24 GLN CB C -3.353 4.350 -8.447 1.00 . A A . 24 GLN CB 1 1 10 5595 1 1 24 GLN CD C -3.489 5.580 -10.620 1.00 . A A . 24 GLN CD 1 1 10 5596 1 1 24 GLN CG C -2.925 5.613 -9.197 1.00 . A A . 24 GLN CG 1 1 10 5597 1 1 24 GLN H H -0.790 3.829 -8.736 1.00 . A A . 24 GLN H 1 1 10 5598 1 1 24 GLN HA H -2.438 4.901 -6.584 1.00 . A A . 24 GLN HA 1 1 10 5599 1 1 24 GLN HB2 H -3.347 3.508 -9.122 1.00 . A A . 24 GLN HB2 1 1 10 5600 1 1 24 GLN HB3 H -4.349 4.492 -8.055 1.00 . A A . 24 GLN HB3 1 1 10 5601 1 1 24 GLN HE21 H -4.023 7.492 -10.602 1.00 . A A . 24 GLN HE21 1 1 10 5602 1 1 24 GLN HE22 H -4.365 6.656 -12.039 1.00 . A A . 24 GLN HE22 1 1 10 5603 1 1 24 GLN HG2 H -3.302 6.483 -8.679 1.00 . A A . 24 GLN HG2 1 1 10 5604 1 1 24 GLN HG3 H -1.848 5.658 -9.245 1.00 . A A . 24 GLN HG3 1 1 10 5605 1 1 24 GLN N N -0.979 4.025 -7.795 1.00 . A A . 24 GLN N 1 1 10 5606 1 1 24 GLN NE2 N -4.002 6.667 -11.129 1.00 . A A . 24 GLN NE2 1 1 10 5607 1 1 24 GLN O O -3.437 2.834 -5.562 1.00 . A A . 24 GLN O 1 1 10 5608 1 1 24 GLN OE1 O -3.462 4.556 -11.273 1.00 . A A . 24 GLN OE1 1 1 10 5609 1 1 25 LYS C C -1.507 -0.056 -5.441 1.00 . A A . 25 LYS C 1 1 10 5610 1 1 25 LYS CA C -2.678 0.382 -6.322 1.00 . A A . 25 LYS CA 1 1 10 5611 1 1 25 LYS CB C -2.879 -0.711 -7.347 1.00 . A A . 25 LYS CB 1 1 10 5612 1 1 25 LYS CD C -4.856 -2.077 -8.096 1.00 . A A . 25 LYS CD 1 1 10 5613 1 1 25 LYS CE C -5.388 -0.923 -8.950 1.00 . A A . 25 LYS CE 1 1 10 5614 1 1 25 LYS CG C -4.088 -1.522 -6.894 1.00 . A A . 25 LYS CG 1 1 10 5615 1 1 25 LYS H H -1.778 1.598 -7.825 1.00 . A A . 25 LYS H 1 1 10 5616 1 1 25 LYS HA H -3.578 0.499 -5.739 1.00 . A A . 25 LYS HA 1 1 10 5617 1 1 25 LYS HB2 H -3.024 -0.250 -8.312 1.00 . A A . 25 LYS HB2 1 1 10 5618 1 1 25 LYS HB3 H -1.994 -1.321 -7.327 1.00 . A A . 25 LYS HB3 1 1 10 5619 1 1 25 LYS HD2 H -4.197 -2.692 -8.689 1.00 . A A . 25 LYS HD2 1 1 10 5620 1 1 25 LYS HD3 H -5.688 -2.672 -7.748 1.00 . A A . 25 LYS HD3 1 1 10 5621 1 1 25 LYS HE2 H -6.436 -0.775 -8.741 1.00 . A A . 25 LYS HE2 1 1 10 5622 1 1 25 LYS HE3 H -4.842 -0.020 -8.717 1.00 . A A . 25 LYS HE3 1 1 10 5623 1 1 25 LYS HG2 H -3.745 -2.325 -6.259 1.00 . A A . 25 LYS HG2 1 1 10 5624 1 1 25 LYS HG3 H -4.725 -0.865 -6.320 1.00 . A A . 25 LYS HG3 1 1 10 5625 1 1 25 LYS HZ1 H -4.761 -2.189 -10.477 1.00 . A A . 25 LYS HZ1 1 1 10 5626 1 1 25 LYS HZ2 H -6.136 -1.267 -10.863 1.00 . A A . 25 LYS HZ2 1 1 10 5627 1 1 25 LYS HZ3 H -4.610 -0.535 -10.843 1.00 . A A . 25 LYS HZ3 1 1 10 5628 1 1 25 LYS N N -2.330 1.649 -7.021 1.00 . A A . 25 LYS N 1 1 10 5629 1 1 25 LYS NZ N -5.210 -1.254 -10.392 1.00 . A A . 25 LYS NZ 1 1 10 5630 1 1 25 LYS O O -1.095 -1.197 -5.374 1.00 . A A . 25 LYS O 1 1 10 5631 1 1 26 TYR C C -0.266 1.852 -2.717 1.00 . A A . 26 TYR C 1 1 10 5632 1 1 26 TYR CA C 0.122 0.885 -3.833 1.00 . A A . 26 TYR CA 1 1 10 5633 1 1 26 TYR CB C 1.293 1.436 -4.630 1.00 . A A . 26 TYR CB 1 1 10 5634 1 1 26 TYR CD1 C 1.252 -0.473 -6.280 1.00 . A A . 26 TYR CD1 1 1 10 5635 1 1 26 TYR CD2 C 2.938 -0.420 -4.549 1.00 . A A . 26 TYR CD2 1 1 10 5636 1 1 26 TYR CE1 C 1.790 -1.677 -6.743 1.00 . A A . 26 TYR CE1 1 1 10 5637 1 1 26 TYR CE2 C 3.475 -1.620 -5.007 1.00 . A A . 26 TYR CE2 1 1 10 5638 1 1 26 TYR CG C 1.838 0.151 -5.176 1.00 . A A . 26 TYR CG 1 1 10 5639 1 1 26 TYR CZ C 2.901 -2.257 -6.113 1.00 . A A . 26 TYR CZ 1 1 10 5640 1 1 26 TYR H H -1.461 1.776 -4.952 1.00 . A A . 26 TYR H 1 1 10 5641 1 1 26 TYR HA H 0.336 -0.135 -3.519 1.00 . A A . 26 TYR HA 1 1 10 5642 1 1 26 TYR HB2 H 0.906 2.101 -5.385 1.00 . A A . 26 TYR HB2 1 1 10 5643 1 1 26 TYR HB3 H 2.027 1.912 -3.999 1.00 . A A . 26 TYR HB3 1 1 10 5644 1 1 26 TYR HD1 H 0.397 -0.031 -6.770 1.00 . A A . 26 TYR HD1 1 1 10 5645 1 1 26 TYR HD2 H 3.379 0.070 -3.701 1.00 . A A . 26 TYR HD2 1 1 10 5646 1 1 26 TYR HE1 H 1.336 -2.154 -7.591 1.00 . A A . 26 TYR HE1 1 1 10 5647 1 1 26 TYR HE2 H 4.330 -2.026 -4.488 1.00 . A A . 26 TYR HE2 1 1 10 5648 1 1 26 TYR HH H 3.303 -3.470 -7.532 1.00 . A A . 26 TYR HH 1 1 10 5649 1 1 26 TYR N N -1.016 0.934 -4.782 1.00 . A A . 26 TYR N 1 1 10 5650 1 1 26 TYR O O -0.425 1.513 -1.562 1.00 . A A . 26 TYR O 1 1 10 5651 1 1 26 TYR OH O 3.422 -3.446 -6.579 1.00 . A A . 26 TYR OH 1 1 10 5652 1 1 27 ARG C C -2.287 3.898 -1.833 1.00 . A A . 27 ARG C 1 1 10 5653 1 1 27 ARG CA C -0.815 4.156 -2.149 1.00 . A A . 27 ARG CA 1 1 10 5654 1 1 27 ARG CB C -0.618 5.515 -2.834 1.00 . A A . 27 ARG CB 1 1 10 5655 1 1 27 ARG CD C -1.716 7.458 -3.941 1.00 . A A . 27 ARG CD 1 1 10 5656 1 1 27 ARG CG C -1.924 6.027 -3.439 1.00 . A A . 27 ARG CG 1 1 10 5657 1 1 27 ARG CZ C -2.321 9.693 -3.226 1.00 . A A . 27 ARG CZ 1 1 10 5658 1 1 27 ARG H H -0.297 3.325 -4.043 1.00 . A A . 27 ARG H 1 1 10 5659 1 1 27 ARG HA H -0.221 4.069 -1.255 1.00 . A A . 27 ARG HA 1 1 10 5660 1 1 27 ARG HB2 H -0.260 6.252 -2.132 1.00 . A A . 27 ARG HB2 1 1 10 5661 1 1 27 ARG HB3 H 0.098 5.394 -3.635 1.00 . A A . 27 ARG HB3 1 1 10 5662 1 1 27 ARG HD2 H -0.663 7.697 -3.924 1.00 . A A . 27 ARG HD2 1 1 10 5663 1 1 27 ARG HD3 H -2.088 7.542 -4.952 1.00 . A A . 27 ARG HD3 1 1 10 5664 1 1 27 ARG HE H -3.041 8.061 -2.354 1.00 . A A . 27 ARG HE 1 1 10 5665 1 1 27 ARG HG2 H -2.178 5.394 -4.276 1.00 . A A . 27 ARG HG2 1 1 10 5666 1 1 27 ARG HG3 H -2.709 6.020 -2.696 1.00 . A A . 27 ARG HG3 1 1 10 5667 1 1 27 ARG HH11 H -0.320 9.646 -3.198 1.00 . A A . 27 ARG HH11 1 1 10 5668 1 1 27 ARG HH12 H -1.030 11.211 -3.409 1.00 . A A . 27 ARG HH12 1 1 10 5669 1 1 27 ARG HH21 H -4.291 10.043 -3.293 1.00 . A A . 27 ARG HH21 1 1 10 5670 1 1 27 ARG HH22 H -3.276 11.436 -3.464 1.00 . A A . 27 ARG HH22 1 1 10 5671 1 1 27 ARG N N -0.427 3.088 -3.104 1.00 . A A . 27 ARG N 1 1 10 5672 1 1 27 ARG NE N -2.455 8.406 -3.060 1.00 . A A . 27 ARG NE 1 1 10 5673 1 1 27 ARG NH1 N -1.131 10.224 -3.282 1.00 . A A . 27 ARG NH1 1 1 10 5674 1 1 27 ARG NH2 N -3.378 10.450 -3.336 1.00 . A A . 27 ARG NH2 1 1 10 5675 1 1 27 ARG O O -2.757 4.097 -0.730 1.00 . A A . 27 ARG O 1 1 10 5676 1 1 28 ALA C C -4.647 1.664 -2.365 1.00 . A A . 28 ALA C 1 1 10 5677 1 1 28 ALA CA C -4.454 3.157 -2.637 1.00 . A A . 28 ALA CA 1 1 10 5678 1 1 28 ALA CB C -5.244 3.556 -3.886 1.00 . A A . 28 ALA CB 1 1 10 5679 1 1 28 ALA H H -2.585 3.301 -3.697 1.00 . A A . 28 ALA H 1 1 10 5680 1 1 28 ALA HA H -4.816 3.718 -1.788 1.00 . A A . 28 ALA HA 1 1 10 5681 1 1 28 ALA HB1 H -4.640 4.201 -4.506 1.00 . A A . 28 ALA HB1 1 1 10 5682 1 1 28 ALA HB2 H -5.510 2.668 -4.441 1.00 . A A . 28 ALA HB2 1 1 10 5683 1 1 28 ALA HB3 H -6.143 4.078 -3.591 1.00 . A A . 28 ALA HB3 1 1 10 5684 1 1 28 ALA N N -3.006 3.447 -2.825 1.00 . A A . 28 ALA N 1 1 10 5685 1 1 28 ALA O O -5.345 1.302 -1.438 1.00 . A A . 28 ALA O 1 1 10 5686 1 1 29 ASN C C -3.513 -1.014 -1.536 1.00 . A A . 29 ASN C 1 1 10 5687 1 1 29 ASN CA C -4.303 -0.652 -2.791 1.00 . A A . 29 ASN CA 1 1 10 5688 1 1 29 ASN CB C -3.919 -1.638 -3.898 1.00 . A A . 29 ASN CB 1 1 10 5689 1 1 29 ASN CG C -5.197 -2.295 -4.427 1.00 . A A . 29 ASN CG 1 1 10 5690 1 1 29 ASN H H -3.492 1.040 -3.882 1.00 . A A . 29 ASN H 1 1 10 5691 1 1 29 ASN HA H -5.356 -0.726 -2.586 1.00 . A A . 29 ASN HA 1 1 10 5692 1 1 29 ASN HB2 H -3.419 -1.118 -4.695 1.00 . A A . 29 ASN HB2 1 1 10 5693 1 1 29 ASN HB3 H -3.269 -2.409 -3.508 1.00 . A A . 29 ASN HB3 1 1 10 5694 1 1 29 ASN HD21 H -6.244 -0.608 -4.383 1.00 . A A . 29 ASN HD21 1 1 10 5695 1 1 29 ASN HD22 H -7.090 -1.973 -4.932 1.00 . A A . 29 ASN HD22 1 1 10 5696 1 1 29 ASN N N -4.061 0.778 -3.129 1.00 . A A . 29 ASN N 1 1 10 5697 1 1 29 ASN ND2 N -6.266 -1.565 -4.595 1.00 . A A . 29 ASN ND2 1 1 10 5698 1 1 29 ASN O O -3.845 -1.935 -0.816 1.00 . A A . 29 ASN O 1 1 10 5699 1 1 29 ASN OD1 O -5.222 -3.481 -4.689 1.00 . A A . 29 ASN OD1 1 1 10 5700 1 1 30 CYS C C -1.495 0.701 0.760 1.00 . A A . 30 CYS C 1 1 10 5701 1 1 30 CYS CA C -1.641 -0.573 -0.073 1.00 . A A . 30 CYS CA 1 1 10 5702 1 1 30 CYS CB C -0.290 -1.119 -0.534 1.00 . A A . 30 CYS CB 1 1 10 5703 1 1 30 CYS H H -2.219 0.452 -1.875 1.00 . A A . 30 CYS H 1 1 10 5704 1 1 30 CYS HA H -2.147 -1.319 0.522 1.00 . A A . 30 CYS HA 1 1 10 5705 1 1 30 CYS HB2 H 0.126 -0.488 -1.305 1.00 . A A . 30 CYS HB2 1 1 10 5706 1 1 30 CYS HB3 H 0.389 -1.170 0.304 1.00 . A A . 30 CYS HB3 1 1 10 5707 1 1 30 CYS N N -2.465 -0.285 -1.277 1.00 . A A . 30 CYS N 1 1 10 5708 1 1 30 CYS O O -0.445 1.304 0.855 1.00 . A A . 30 CYS O 1 1 10 5709 1 1 30 CYS SG S -0.561 -2.785 -1.184 1.00 . A A . 30 CYS SG 1 1 10 5710 1 1 31 ALA C C -2.508 1.902 3.690 1.00 . A A . 31 ALA C 1 1 10 5711 1 1 31 ALA CA C -2.638 2.309 2.216 1.00 . A A . 31 ALA CA 1 1 10 5712 1 1 31 ALA CB C -3.991 2.975 1.964 1.00 . A A . 31 ALA CB 1 1 10 5713 1 1 31 ALA H H -3.401 0.563 1.247 1.00 . A A . 31 ALA H 1 1 10 5714 1 1 31 ALA HA H -1.841 2.989 1.942 1.00 . A A . 31 ALA HA 1 1 10 5715 1 1 31 ALA HB1 H -4.673 2.244 1.552 1.00 . A A . 31 ALA HB1 1 1 10 5716 1 1 31 ALA HB2 H -4.390 3.353 2.893 1.00 . A A . 31 ALA HB2 1 1 10 5717 1 1 31 ALA HB3 H -3.871 3.786 1.261 1.00 . A A . 31 ALA HB3 1 1 10 5718 1 1 31 ALA N N -2.586 1.091 1.362 1.00 . A A . 31 ALA N 1 1 10 5719 1 1 31 ALA O O -2.496 2.726 4.582 1.00 . A A . 31 ALA O 1 1 10 5720 1 1 32 LYS C C -0.782 0.178 5.735 1.00 . A A . 32 LYS C 1 1 10 5721 1 1 32 LYS CA C -2.270 0.160 5.374 1.00 . A A . 32 LYS CA 1 1 10 5722 1 1 32 LYS CB C -2.799 -1.274 5.440 1.00 . A A . 32 LYS CB 1 1 10 5723 1 1 32 LYS CD C -0.711 -2.669 5.209 1.00 . A A . 32 LYS CD 1 1 10 5724 1 1 32 LYS CE C -0.371 -4.143 5.467 1.00 . A A . 32 LYS CE 1 1 10 5725 1 1 32 LYS CG C -1.818 -2.206 6.163 1.00 . A A . 32 LYS CG 1 1 10 5726 1 1 32 LYS H H -2.412 -0.029 3.242 1.00 . A A . 32 LYS H 1 1 10 5727 1 1 32 LYS HA H -2.834 0.795 6.041 1.00 . A A . 32 LYS HA 1 1 10 5728 1 1 32 LYS HB2 H -3.745 -1.270 5.960 1.00 . A A . 32 LYS HB2 1 1 10 5729 1 1 32 LYS HB3 H -2.950 -1.626 4.430 1.00 . A A . 32 LYS HB3 1 1 10 5730 1 1 32 LYS HD2 H -1.046 -2.551 4.189 1.00 . A A . 32 LYS HD2 1 1 10 5731 1 1 32 LYS HD3 H 0.173 -2.069 5.368 1.00 . A A . 32 LYS HD3 1 1 10 5732 1 1 32 LYS HE2 H -1.114 -4.770 4.997 1.00 . A A . 32 LYS HE2 1 1 10 5733 1 1 32 LYS HE3 H 0.602 -4.386 5.059 1.00 . A A . 32 LYS HE3 1 1 10 5734 1 1 32 LYS HG2 H -1.379 -1.693 7.006 1.00 . A A . 32 LYS HG2 1 1 10 5735 1 1 32 LYS HG3 H -2.356 -3.071 6.522 1.00 . A A . 32 LYS HG3 1 1 10 5736 1 1 32 LYS HZ1 H -0.216 -3.501 7.442 1.00 . A A . 32 LYS HZ1 1 1 10 5737 1 1 32 LYS HZ2 H -1.283 -4.797 7.222 1.00 . A A . 32 LYS HZ2 1 1 10 5738 1 1 32 LYS HZ3 H 0.395 -5.064 7.167 1.00 . A A . 32 LYS HZ3 1 1 10 5739 1 1 32 LYS N N -2.405 0.631 3.965 1.00 . A A . 32 LYS N 1 1 10 5740 1 1 32 LYS NZ N -0.368 -4.396 6.935 1.00 . A A . 32 LYS NZ 1 1 10 5741 1 1 32 LYS O O -0.392 0.272 6.881 1.00 . A A . 32 LYS O 1 1 10 5742 1 1 33 THR C C 2.034 1.518 4.863 1.00 . A A . 33 THR C 1 1 10 5743 1 1 33 THR CA C 1.516 0.083 4.855 1.00 . A A . 33 THR CA 1 1 10 5744 1 1 33 THR CB C 1.952 -0.815 3.696 1.00 . A A . 33 THR CB 1 1 10 5745 1 1 33 THR CG2 C 2.737 -0.092 2.603 1.00 . A A . 33 THR CG2 1 1 10 5746 1 1 33 THR H H -0.334 0.011 3.823 1.00 . A A . 33 THR H 1 1 10 5747 1 1 33 THR HA H 1.844 -0.349 5.781 1.00 . A A . 33 THR HA 1 1 10 5748 1 1 33 THR HB H 1.065 -1.252 3.270 1.00 . A A . 33 THR HB 1 1 10 5749 1 1 33 THR HG1 H 3.311 -1.530 4.884 1.00 . A A . 33 THR HG1 1 1 10 5750 1 1 33 THR HG21 H 2.649 0.976 2.700 1.00 . A A . 33 THR HG21 1 1 10 5751 1 1 33 THR HG22 H 3.772 -0.384 2.671 1.00 . A A . 33 THR HG22 1 1 10 5752 1 1 33 THR HG23 H 2.338 -0.382 1.643 1.00 . A A . 33 THR HG23 1 1 10 5753 1 1 33 THR N N 0.036 0.084 4.724 1.00 . A A . 33 THR N 1 1 10 5754 1 1 33 THR O O 3.114 1.806 5.338 1.00 . A A . 33 THR O 1 1 10 5755 1 1 33 THR OG1 O 2.707 -1.889 4.229 1.00 . A A . 33 THR OG1 1 1 10 5756 1 1 34 CYS C C 0.706 4.716 5.085 1.00 . A A . 34 CYS C 1 1 10 5757 1 1 34 CYS CA C 1.694 3.843 4.310 1.00 . A A . 34 CYS CA 1 1 10 5758 1 1 34 CYS CB C 1.745 4.334 2.867 1.00 . A A . 34 CYS CB 1 1 10 5759 1 1 34 CYS H H 0.392 2.162 3.963 1.00 . A A . 34 CYS H 1 1 10 5760 1 1 34 CYS HA H 2.678 3.931 4.747 1.00 . A A . 34 CYS HA 1 1 10 5761 1 1 34 CYS HB2 H 2.021 3.525 2.215 1.00 . A A . 34 CYS HB2 1 1 10 5762 1 1 34 CYS HB3 H 0.768 4.655 2.567 1.00 . A A . 34 CYS HB3 1 1 10 5763 1 1 34 CYS N N 1.259 2.422 4.337 1.00 . A A . 34 CYS N 1 1 10 5764 1 1 34 CYS O O 0.863 5.918 5.173 1.00 . A A . 34 CYS O 1 1 10 5765 1 1 34 CYS SG S 2.909 5.719 2.790 1.00 . A A . 34 CYS SG 1 1 10 5766 1 1 35 GLU C C -2.012 5.935 5.525 1.00 . A A . 35 GLU C 1 1 10 5767 1 1 35 GLU CA C -1.307 4.919 6.416 1.00 . A A . 35 GLU CA 1 1 10 5768 1 1 35 GLU CB C -0.603 5.539 7.617 1.00 . A A . 35 GLU CB 1 1 10 5769 1 1 35 GLU CD C 0.567 4.702 9.680 1.00 . A A . 35 GLU CD 1 1 10 5770 1 1 35 GLU CG C -0.301 4.320 8.480 1.00 . A A . 35 GLU CG 1 1 10 5771 1 1 35 GLU H H -0.431 3.159 5.575 1.00 . A A . 35 GLU H 1 1 10 5772 1 1 35 GLU HA H -2.059 4.231 6.774 1.00 . A A . 35 GLU HA 1 1 10 5773 1 1 35 GLU HB2 H 0.299 6.046 7.303 1.00 . A A . 35 GLU HB2 1 1 10 5774 1 1 35 GLU HB3 H -1.260 6.199 8.161 1.00 . A A . 35 GLU HB3 1 1 10 5775 1 1 35 GLU HG2 H -1.244 3.901 8.802 1.00 . A A . 35 GLU HG2 1 1 10 5776 1 1 35 GLU HG3 H 0.212 3.593 7.863 1.00 . A A . 35 GLU HG3 1 1 10 5777 1 1 35 GLU N N -0.312 4.128 5.649 1.00 . A A . 35 GLU N 1 1 10 5778 1 1 35 GLU O O -2.394 7.016 5.922 1.00 . A A . 35 GLU O 1 1 10 5779 1 1 35 GLU OE1 O 1.542 5.407 9.480 1.00 . A A . 35 GLU OE1 1 1 10 5780 1 1 35 GLU OE2 O 0.242 4.283 10.779 1.00 . A A . 35 GLU OE2 1 1 10 5781 1 1 36 LEU C C -4.350 6.104 3.450 1.00 . A A . 36 LEU C 1 1 10 5782 1 1 36 LEU CA C -2.851 6.366 3.281 1.00 . A A . 36 LEU CA 1 1 10 5783 1 1 36 LEU CB C -2.375 5.863 1.923 1.00 . A A . 36 LEU CB 1 1 10 5784 1 1 36 LEU CD1 C -0.286 5.436 0.629 1.00 . A A . 36 LEU CD1 1 1 10 5785 1 1 36 LEU CD2 C -0.824 7.754 1.393 1.00 . A A . 36 LEU CD2 1 1 10 5786 1 1 36 LEU CG C -0.915 6.269 1.747 1.00 . A A . 36 LEU CG 1 1 10 5787 1 1 36 LEU H H -1.851 4.642 4.043 1.00 . A A . 36 LEU H 1 1 10 5788 1 1 36 LEU HA H -2.611 7.407 3.409 1.00 . A A . 36 LEU HA 1 1 10 5789 1 1 36 LEU HB2 H -2.454 4.796 1.949 1.00 . A A . 36 LEU HB2 1 1 10 5790 1 1 36 LEU HB3 H -2.965 6.240 1.105 1.00 . A A . 36 LEU HB3 1 1 10 5791 1 1 36 LEU HD11 H -0.623 4.413 0.707 1.00 . A A . 36 LEU HD11 1 1 10 5792 1 1 36 LEU HD12 H -0.578 5.834 -0.332 1.00 . A A . 36 LEU HD12 1 1 10 5793 1 1 36 LEU HD13 H 0.789 5.466 0.720 1.00 . A A . 36 LEU HD13 1 1 10 5794 1 1 36 LEU HD21 H -1.703 8.267 1.759 1.00 . A A . 36 LEU HD21 1 1 10 5795 1 1 36 LEU HD22 H 0.056 8.180 1.851 1.00 . A A . 36 LEU HD22 1 1 10 5796 1 1 36 LEU HD23 H -0.762 7.865 0.321 1.00 . A A . 36 LEU HD23 1 1 10 5797 1 1 36 LEU HG H -0.403 6.077 2.678 1.00 . A A . 36 LEU HG 1 1 10 5798 1 1 36 LEU N N -2.176 5.528 4.300 1.00 . A A . 36 LEU N 1 1 10 5799 1 1 36 LEU O O -5.171 6.766 2.845 1.00 . A A . 36 LEU O 1 1 10 5800 1 1 37 CYS C C -6.802 6.014 5.260 1.00 . A A . 37 CYS C 1 1 10 5801 1 1 37 CYS CA C -6.178 4.879 4.445 1.00 . A A . 37 CYS CA 1 1 10 5802 1 1 37 CYS CB C -6.361 3.556 5.190 1.00 . A A . 37 CYS CB 1 1 10 5803 1 1 37 CYS H H -4.071 4.603 4.764 1.00 . A A . 37 CYS H 1 1 10 5804 1 1 37 CYS HA H -6.659 4.824 3.480 1.00 . A A . 37 CYS HA 1 1 10 5805 1 1 37 CYS HB2 H -5.464 2.964 5.091 1.00 . A A . 37 CYS HB2 1 1 10 5806 1 1 37 CYS HB3 H -6.554 3.755 6.232 1.00 . A A . 37 CYS HB3 1 1 10 5807 1 1 37 CYS N N -4.724 5.149 4.267 1.00 . A A . 37 CYS N 1 1 10 5808 1 1 37 CYS O O -6.145 7.029 5.426 1.00 . A A . 37 CYS O 1 1 10 5809 1 1 37 CYS OXT O -7.926 5.851 5.705 1.00 . A A . 37 CYS OXT 1 1 10 5810 1 1 37 CYS SG S -7.747 2.634 4.487 1.00 . A A . 37 CYS SG 1 1 11 5811 1 1 1 VAL C C -12.141 1.515 3.007 1.00 . A A . 1 VAL C 1 1 11 5812 1 1 1 VAL CA C -13.559 1.256 3.521 1.00 . A A . 1 VAL CA 1 1 11 5813 1 1 1 VAL CB C -14.107 -0.013 2.865 1.00 . A A . 1 VAL CB 1 1 11 5814 1 1 1 VAL CG1 C -14.107 0.154 1.345 1.00 . A A . 1 VAL CG1 1 1 11 5815 1 1 1 VAL CG2 C -13.218 -1.199 3.244 1.00 . A A . 1 VAL CG2 1 1 11 5816 1 1 1 VAL H1 H -13.861 3.283 3.153 1.00 . A A . 1 VAL H1 1 1 11 5817 1 1 1 VAL H2 H -14.861 2.254 2.240 1.00 . A A . 1 VAL H2 1 1 11 5818 1 1 1 VAL H3 H -15.178 2.515 3.890 1.00 . A A . 1 VAL H3 1 1 11 5819 1 1 1 VAL HA H -13.537 1.127 4.593 1.00 . A A . 1 VAL HA 1 1 11 5820 1 1 1 VAL HB H -15.117 -0.186 3.208 1.00 . A A . 1 VAL HB 1 1 11 5821 1 1 1 VAL HG11 H -13.848 1.173 1.094 1.00 . A A . 1 VAL HG11 1 1 11 5822 1 1 1 VAL HG12 H -13.382 -0.517 0.909 1.00 . A A . 1 VAL HG12 1 1 11 5823 1 1 1 VAL HG13 H -15.088 -0.075 0.956 1.00 . A A . 1 VAL HG13 1 1 11 5824 1 1 1 VAL HG21 H -13.041 -1.190 4.309 1.00 . A A . 1 VAL HG21 1 1 11 5825 1 1 1 VAL HG22 H -13.708 -2.121 2.968 1.00 . A A . 1 VAL HG22 1 1 11 5826 1 1 1 VAL HG23 H -12.276 -1.122 2.722 1.00 . A A . 1 VAL HG23 1 1 11 5827 1 1 1 VAL N N -14.431 2.414 3.174 1.00 . A A . 1 VAL N 1 1 11 5828 1 1 1 VAL O O -11.937 1.786 1.840 1.00 . A A . 1 VAL O 1 1 11 5829 1 1 2 CYS C C -8.902 0.467 3.778 1.00 . A A . 2 CYS C 1 1 11 5830 1 1 2 CYS CA C -9.764 1.680 3.411 1.00 . A A . 2 CYS CA 1 1 11 5831 1 1 2 CYS CB C -9.217 2.924 4.112 1.00 . A A . 2 CYS CB 1 1 11 5832 1 1 2 CYS H H -11.343 1.216 4.802 1.00 . A A . 2 CYS H 1 1 11 5833 1 1 2 CYS HA H -9.776 1.839 2.342 1.00 . A A . 2 CYS HA 1 1 11 5834 1 1 2 CYS HB2 H -8.272 3.197 3.669 1.00 . A A . 2 CYS HB2 1 1 11 5835 1 1 2 CYS HB3 H -9.917 3.739 3.998 1.00 . A A . 2 CYS HB3 1 1 11 5836 1 1 2 CYS N N -11.162 1.436 3.865 1.00 . A A . 2 CYS N 1 1 11 5837 1 1 2 CYS O O -9.307 -0.317 4.614 1.00 . A A . 2 CYS O 1 1 11 5838 1 1 2 CYS SG S -8.981 2.570 5.871 1.00 . A A . 2 CYS SG 1 1 11 5839 1 1 3 ARG C C -5.949 -1.143 2.314 1.00 . A A . 3 ARG C 1 1 11 5840 1 1 3 ARG CA C -6.867 -0.865 3.506 1.00 . A A . 3 ARG CA 1 1 11 5841 1 1 3 ARG CB C -7.700 -2.124 3.759 1.00 . A A . 3 ARG CB 1 1 11 5842 1 1 3 ARG CD C -8.964 -3.669 2.236 1.00 . A A . 3 ARG CD 1 1 11 5843 1 1 3 ARG CG C -8.800 -2.219 2.698 1.00 . A A . 3 ARG CG 1 1 11 5844 1 1 3 ARG CZ C -11.156 -4.651 2.547 1.00 . A A . 3 ARG CZ 1 1 11 5845 1 1 3 ARG H H -7.436 0.943 2.513 1.00 . A A . 3 ARG H 1 1 11 5846 1 1 3 ARG HA H -6.272 -0.642 4.379 1.00 . A A . 3 ARG HA 1 1 11 5847 1 1 3 ARG HB2 H -7.058 -2.991 3.712 1.00 . A A . 3 ARG HB2 1 1 11 5848 1 1 3 ARG HB3 H -8.151 -2.066 4.738 1.00 . A A . 3 ARG HB3 1 1 11 5849 1 1 3 ARG HD2 H -9.272 -3.684 1.201 1.00 . A A . 3 ARG HD2 1 1 11 5850 1 1 3 ARG HD3 H -8.022 -4.189 2.339 1.00 . A A . 3 ARG HD3 1 1 11 5851 1 1 3 ARG HE H -9.812 -4.560 4.006 1.00 . A A . 3 ARG HE 1 1 11 5852 1 1 3 ARG HG2 H -9.732 -1.866 3.113 1.00 . A A . 3 ARG HG2 1 1 11 5853 1 1 3 ARG HG3 H -8.529 -1.608 1.849 1.00 . A A . 3 ARG HG3 1 1 11 5854 1 1 3 ARG HH11 H -11.391 -2.877 1.648 1.00 . A A . 3 ARG HH11 1 1 11 5855 1 1 3 ARG HH12 H -12.677 -4.013 1.412 1.00 . A A . 3 ARG HH12 1 1 11 5856 1 1 3 ARG HH21 H -11.191 -6.497 3.322 1.00 . A A . 3 ARG HH21 1 1 11 5857 1 1 3 ARG HH22 H -12.564 -6.061 2.359 1.00 . A A . 3 ARG HH22 1 1 11 5858 1 1 3 ARG N N -7.745 0.299 3.184 1.00 . A A . 3 ARG N 1 1 11 5859 1 1 3 ARG NE N -9.999 -4.345 3.068 1.00 . A A . 3 ARG NE 1 1 11 5860 1 1 3 ARG NH1 N -11.791 -3.779 1.812 1.00 . A A . 3 ARG NH1 1 1 11 5861 1 1 3 ARG NH2 N -11.677 -5.828 2.760 1.00 . A A . 3 ARG NH2 1 1 11 5862 1 1 3 ARG O O -5.887 -0.378 1.372 1.00 . A A . 3 ARG O 1 1 11 5863 1 1 4 ASP C C -5.115 -3.280 0.124 1.00 . A A . 4 ASP C 1 1 11 5864 1 1 4 ASP CA C -4.319 -2.568 1.222 1.00 . A A . 4 ASP CA 1 1 11 5865 1 1 4 ASP CB C -3.206 -3.481 1.739 1.00 . A A . 4 ASP CB 1 1 11 5866 1 1 4 ASP CG C -3.634 -4.942 1.593 1.00 . A A . 4 ASP CG 1 1 11 5867 1 1 4 ASP H H -5.296 -2.840 3.117 1.00 . A A . 4 ASP H 1 1 11 5868 1 1 4 ASP HA H -3.895 -1.657 0.830 1.00 . A A . 4 ASP HA 1 1 11 5869 1 1 4 ASP HB2 H -2.302 -3.309 1.175 1.00 . A A . 4 ASP HB2 1 1 11 5870 1 1 4 ASP HB3 H -3.025 -3.270 2.782 1.00 . A A . 4 ASP HB3 1 1 11 5871 1 1 4 ASP N N -5.234 -2.235 2.348 1.00 . A A . 4 ASP N 1 1 11 5872 1 1 4 ASP O O -6.325 -3.189 0.079 1.00 . A A . 4 ASP O 1 1 11 5873 1 1 4 ASP OD1 O -4.742 -5.257 1.996 1.00 . A A . 4 ASP OD1 1 1 11 5874 1 1 4 ASP OD2 O -2.848 -5.721 1.081 1.00 . A A . 4 ASP OD2 1 1 11 5875 1 1 5 TRP C C -4.430 -5.931 -2.228 1.00 . A A . 5 TRP C 1 1 11 5876 1 1 5 TRP CA C -5.230 -4.687 -1.829 1.00 . A A . 5 TRP CA 1 1 11 5877 1 1 5 TRP CB C -5.457 -3.737 -3.011 1.00 . A A . 5 TRP CB 1 1 11 5878 1 1 5 TRP CD1 C -6.927 -1.696 -2.620 1.00 . A A . 5 TRP CD1 1 1 11 5879 1 1 5 TRP CD2 C -8.082 -3.628 -2.672 1.00 . A A . 5 TRP CD2 1 1 11 5880 1 1 5 TRP CE2 C -9.025 -2.593 -2.449 1.00 . A A . 5 TRP CE2 1 1 11 5881 1 1 5 TRP CE3 C -8.553 -4.948 -2.746 1.00 . A A . 5 TRP CE3 1 1 11 5882 1 1 5 TRP CG C -6.755 -3.031 -2.779 1.00 . A A . 5 TRP CG 1 1 11 5883 1 1 5 TRP CH2 C -10.836 -4.191 -2.383 1.00 . A A . 5 TRP CH2 1 1 11 5884 1 1 5 TRP CZ2 C -10.389 -2.867 -2.304 1.00 . A A . 5 TRP CZ2 1 1 11 5885 1 1 5 TRP CZ3 C -9.919 -5.227 -2.603 1.00 . A A . 5 TRP CZ3 1 1 11 5886 1 1 5 TRP H H -3.484 -4.069 -0.728 1.00 . A A . 5 TRP H 1 1 11 5887 1 1 5 TRP HA H -6.186 -5.001 -1.415 1.00 . A A . 5 TRP HA 1 1 11 5888 1 1 5 TRP HB2 H -4.653 -3.021 -3.076 1.00 . A A . 5 TRP HB2 1 1 11 5889 1 1 5 TRP HB3 H -5.519 -4.297 -3.933 1.00 . A A . 5 TRP HB3 1 1 11 5890 1 1 5 TRP HD1 H -6.151 -0.943 -2.640 1.00 . A A . 5 TRP HD1 1 1 11 5891 1 1 5 TRP HE1 H -8.660 -0.550 -2.286 1.00 . A A . 5 TRP HE1 1 1 11 5892 1 1 5 TRP HE3 H -7.856 -5.756 -2.916 1.00 . A A . 5 TRP HE3 1 1 11 5893 1 1 5 TRP HH2 H -11.887 -4.413 -2.272 1.00 . A A . 5 TRP HH2 1 1 11 5894 1 1 5 TRP HZ2 H -11.091 -2.064 -2.135 1.00 . A A . 5 TRP HZ2 1 1 11 5895 1 1 5 TRP HZ3 H -10.268 -6.247 -2.662 1.00 . A A . 5 TRP HZ3 1 1 11 5896 1 1 5 TRP N N -4.465 -3.989 -0.760 1.00 . A A . 5 TRP N 1 1 11 5897 1 1 5 TRP NE1 N -8.271 -1.438 -2.426 1.00 . A A . 5 TRP NE1 1 1 11 5898 1 1 5 TRP O O -5.002 -6.977 -2.461 1.00 . A A . 5 TRP O 1 1 11 5899 1 1 6 PHE C C -2.133 -7.812 -1.367 1.00 . A A . 6 PHE C 1 1 11 5900 1 1 6 PHE CA C -2.352 -7.071 -2.689 1.00 . A A . 6 PHE CA 1 1 11 5901 1 1 6 PHE CB C -0.980 -6.613 -3.168 1.00 . A A . 6 PHE CB 1 1 11 5902 1 1 6 PHE CD1 C -2.235 -5.544 -5.054 1.00 . A A . 6 PHE CD1 1 1 11 5903 1 1 6 PHE CD2 C -0.100 -4.640 -4.338 1.00 . A A . 6 PHE CD2 1 1 11 5904 1 1 6 PHE CE1 C -2.321 -4.555 -6.022 1.00 . A A . 6 PHE CE1 1 1 11 5905 1 1 6 PHE CE2 C -0.183 -3.653 -5.303 1.00 . A A . 6 PHE CE2 1 1 11 5906 1 1 6 PHE CG C -1.121 -5.572 -4.223 1.00 . A A . 6 PHE CG 1 1 11 5907 1 1 6 PHE CZ C -1.296 -3.611 -6.148 1.00 . A A . 6 PHE CZ 1 1 11 5908 1 1 6 PHE H H -2.622 -5.037 -2.126 1.00 . A A . 6 PHE H 1 1 11 5909 1 1 6 PHE HA H -2.866 -7.636 -3.454 1.00 . A A . 6 PHE HA 1 1 11 5910 1 1 6 PHE HB2 H -0.443 -6.153 -2.358 1.00 . A A . 6 PHE HB2 1 1 11 5911 1 1 6 PHE HB3 H -0.424 -7.437 -3.573 1.00 . A A . 6 PHE HB3 1 1 11 5912 1 1 6 PHE HD1 H -3.023 -6.270 -4.960 1.00 . A A . 6 PHE HD1 1 1 11 5913 1 1 6 PHE HD2 H 0.757 -4.670 -3.690 1.00 . A A . 6 PHE HD2 1 1 11 5914 1 1 6 PHE HE1 H -3.189 -4.551 -6.655 1.00 . A A . 6 PHE HE1 1 1 11 5915 1 1 6 PHE HE2 H 0.627 -2.952 -5.360 1.00 . A A . 6 PHE HE2 1 1 11 5916 1 1 6 PHE HZ H -1.361 -2.847 -6.894 1.00 . A A . 6 PHE HZ 1 1 11 5917 1 1 6 PHE N N -3.124 -5.860 -2.310 1.00 . A A . 6 PHE N 1 1 11 5918 1 1 6 PHE O O -3.025 -7.877 -0.545 1.00 . A A . 6 PHE O 1 1 11 5919 1 1 7 LYS C C -0.345 -7.974 1.144 1.00 . A A . 7 LYS C 1 1 11 5920 1 1 7 LYS CA C -0.763 -9.071 0.163 1.00 . A A . 7 LYS CA 1 1 11 5921 1 1 7 LYS CB C 0.368 -10.094 0.021 1.00 . A A . 7 LYS CB 1 1 11 5922 1 1 7 LYS CD C -1.172 -12.062 -0.082 1.00 . A A . 7 LYS CD 1 1 11 5923 1 1 7 LYS CE C -2.554 -11.712 -0.639 1.00 . A A . 7 LYS CE 1 1 11 5924 1 1 7 LYS CG C -0.102 -11.270 -0.837 1.00 . A A . 7 LYS CG 1 1 11 5925 1 1 7 LYS H H -0.239 -8.316 -1.774 1.00 . A A . 7 LYS H 1 1 11 5926 1 1 7 LYS HA H -1.683 -9.536 0.489 1.00 . A A . 7 LYS HA 1 1 11 5927 1 1 7 LYS HB2 H 1.220 -9.623 -0.445 1.00 . A A . 7 LYS HB2 1 1 11 5928 1 1 7 LYS HB3 H 0.647 -10.459 1.000 1.00 . A A . 7 LYS HB3 1 1 11 5929 1 1 7 LYS HD2 H -0.989 -13.119 -0.203 1.00 . A A . 7 LYS HD2 1 1 11 5930 1 1 7 LYS HD3 H -1.137 -11.806 0.966 1.00 . A A . 7 LYS HD3 1 1 11 5931 1 1 7 LYS HE2 H -3.271 -11.681 0.170 1.00 . A A . 7 LYS HE2 1 1 11 5932 1 1 7 LYS HE3 H -2.514 -10.746 -1.120 1.00 . A A . 7 LYS HE3 1 1 11 5933 1 1 7 LYS HG2 H -0.513 -10.896 -1.763 1.00 . A A . 7 LYS HG2 1 1 11 5934 1 1 7 LYS HG3 H 0.734 -11.919 -1.049 1.00 . A A . 7 LYS HG3 1 1 11 5935 1 1 7 LYS HZ1 H -2.637 -13.680 -1.315 1.00 . A A . 7 LYS HZ1 1 1 11 5936 1 1 7 LYS HZ2 H -4.002 -12.759 -1.708 1.00 . A A . 7 LYS HZ2 1 1 11 5937 1 1 7 LYS HZ3 H -2.547 -12.521 -2.556 1.00 . A A . 7 LYS HZ3 1 1 11 5938 1 1 7 LYS N N -0.973 -8.364 -1.127 1.00 . A A . 7 LYS N 1 1 11 5939 1 1 7 LYS NZ N -2.965 -12.745 -1.629 1.00 . A A . 7 LYS NZ 1 1 11 5940 1 1 7 LYS O O 0.225 -6.978 0.743 1.00 . A A . 7 LYS O 1 1 11 5941 1 1 8 GLU C C 1.294 -6.749 3.255 1.00 . A A . 8 GLU C 1 1 11 5942 1 1 8 GLU CA C -0.202 -7.043 3.370 1.00 . A A . 8 GLU CA 1 1 11 5943 1 1 8 GLU CB C -0.536 -7.486 4.795 1.00 . A A . 8 GLU CB 1 1 11 5944 1 1 8 GLU CD C -2.963 -8.090 4.709 1.00 . A A . 8 GLU CD 1 1 11 5945 1 1 8 GLU CG C -1.952 -7.024 5.135 1.00 . A A . 8 GLU CG 1 1 11 5946 1 1 8 GLU H H -1.068 -8.916 2.736 1.00 . A A . 8 GLU H 1 1 11 5947 1 1 8 GLU HA H -0.739 -6.133 3.149 1.00 . A A . 8 GLU HA 1 1 11 5948 1 1 8 GLU HB2 H -0.476 -8.563 4.858 1.00 . A A . 8 GLU HB2 1 1 11 5949 1 1 8 GLU HB3 H 0.159 -7.039 5.488 1.00 . A A . 8 GLU HB3 1 1 11 5950 1 1 8 GLU HG2 H -2.027 -6.853 6.199 1.00 . A A . 8 GLU HG2 1 1 11 5951 1 1 8 GLU HG3 H -2.158 -6.108 4.603 1.00 . A A . 8 GLU HG3 1 1 11 5952 1 1 8 GLU N N -0.607 -8.114 2.413 1.00 . A A . 8 GLU N 1 1 11 5953 1 1 8 GLU O O 1.773 -5.728 3.707 1.00 . A A . 8 GLU O 1 1 11 5954 1 1 8 GLU OE1 O -3.234 -8.181 3.522 1.00 . A A . 8 GLU OE1 1 1 11 5955 1 1 8 GLU OE2 O -3.451 -8.799 5.573 1.00 . A A . 8 GLU OE2 1 1 11 5956 1 1 9 THR C C 3.787 -6.687 1.193 1.00 . A A . 9 THR C 1 1 11 5957 1 1 9 THR CA C 3.496 -7.401 2.513 1.00 . A A . 9 THR CA 1 1 11 5958 1 1 9 THR CB C 4.158 -8.767 2.660 1.00 . A A . 9 THR CB 1 1 11 5959 1 1 9 THR CG2 C 3.869 -9.195 4.098 1.00 . A A . 9 THR CG2 1 1 11 5960 1 1 9 THR H H 1.633 -8.450 2.295 1.00 . A A . 9 THR H 1 1 11 5961 1 1 9 THR HA H 3.817 -6.761 3.321 1.00 . A A . 9 THR HA 1 1 11 5962 1 1 9 THR HB H 5.223 -8.690 2.528 1.00 . A A . 9 THR HB 1 1 11 5963 1 1 9 THR HG1 H 3.730 -9.303 0.840 1.00 . A A . 9 THR HG1 1 1 11 5964 1 1 9 THR HG21 H 3.177 -8.485 4.539 1.00 . A A . 9 THR HG21 1 1 11 5965 1 1 9 THR HG22 H 3.426 -10.181 4.104 1.00 . A A . 9 THR HG22 1 1 11 5966 1 1 9 THR HG23 H 4.785 -9.201 4.669 1.00 . A A . 9 THR HG23 1 1 11 5967 1 1 9 THR N N 2.035 -7.633 2.654 1.00 . A A . 9 THR N 1 1 11 5968 1 1 9 THR O O 4.700 -5.891 1.103 1.00 . A A . 9 THR O 1 1 11 5969 1 1 9 THR OG1 O 3.591 -9.667 1.718 1.00 . A A . 9 THR OG1 1 1 11 5970 1 1 10 ALA C C 3.305 -4.777 -0.744 1.00 . A A . 10 ALA C 1 1 11 5971 1 1 10 ALA CA C 3.272 -6.256 -1.123 1.00 . A A . 10 ALA CA 1 1 11 5972 1 1 10 ALA CB C 2.083 -6.441 -2.071 1.00 . A A . 10 ALA CB 1 1 11 5973 1 1 10 ALA H H 2.283 -7.592 0.265 1.00 . A A . 10 ALA H 1 1 11 5974 1 1 10 ALA HA H 4.205 -6.551 -1.577 1.00 . A A . 10 ALA HA 1 1 11 5975 1 1 10 ALA HB1 H 1.174 -6.376 -1.490 1.00 . A A . 10 ALA HB1 1 1 11 5976 1 1 10 ALA HB2 H 2.080 -5.657 -2.819 1.00 . A A . 10 ALA HB2 1 1 11 5977 1 1 10 ALA HB3 H 2.137 -7.405 -2.554 1.00 . A A . 10 ALA HB3 1 1 11 5978 1 1 10 ALA N N 3.019 -6.952 0.172 1.00 . A A . 10 ALA N 1 1 11 5979 1 1 10 ALA O O 3.999 -3.967 -1.324 1.00 . A A . 10 ALA O 1 1 11 5980 1 1 11 CYS C C 3.656 -2.737 1.598 1.00 . A A . 11 CYS C 1 1 11 5981 1 1 11 CYS CA C 2.433 -3.059 0.750 1.00 . A A . 11 CYS CA 1 1 11 5982 1 1 11 CYS CB C 1.059 -3.003 1.409 1.00 . A A . 11 CYS CB 1 1 11 5983 1 1 11 CYS H H 1.977 -5.125 0.697 1.00 . A A . 11 CYS H 1 1 11 5984 1 1 11 CYS HA H 2.472 -2.388 -0.089 1.00 . A A . 11 CYS HA 1 1 11 5985 1 1 11 CYS HB2 H 0.979 -3.772 2.165 1.00 . A A . 11 CYS HB2 1 1 11 5986 1 1 11 CYS HB3 H 0.839 -2.036 1.826 1.00 . A A . 11 CYS HB3 1 1 11 5987 1 1 11 CYS N N 2.527 -4.450 0.251 1.00 . A A . 11 CYS N 1 1 11 5988 1 1 11 CYS O O 4.136 -1.624 1.520 1.00 . A A . 11 CYS O 1 1 11 5989 1 1 11 CYS SG S -0.066 -3.324 0.030 1.00 . A A . 11 CYS SG 1 1 11 5990 1 1 12 ARG C C 6.339 -2.753 2.129 1.00 . A A . 12 ARG C 1 1 11 5991 1 1 12 ARG CA C 5.364 -3.311 3.168 1.00 . A A . 12 ARG CA 1 1 11 5992 1 1 12 ARG CB C 6.036 -4.538 3.782 1.00 . A A . 12 ARG CB 1 1 11 5993 1 1 12 ARG CD C 8.284 -5.148 4.716 1.00 . A A . 12 ARG CD 1 1 11 5994 1 1 12 ARG CG C 7.535 -4.244 3.735 1.00 . A A . 12 ARG CG 1 1 11 5995 1 1 12 ARG CZ C 8.740 -4.499 7.005 1.00 . A A . 12 ARG CZ 1 1 11 5996 1 1 12 ARG H H 3.759 -4.553 2.408 1.00 . A A . 12 ARG H 1 1 11 5997 1 1 12 ARG HA H 5.145 -2.560 3.909 1.00 . A A . 12 ARG HA 1 1 11 5998 1 1 12 ARG HB2 H 5.699 -4.671 4.800 1.00 . A A . 12 ARG HB2 1 1 11 5999 1 1 12 ARG HB3 H 5.832 -5.417 3.192 1.00 . A A . 12 ARG HB3 1 1 11 6000 1 1 12 ARG HD2 H 7.581 -5.806 5.206 1.00 . A A . 12 ARG HD2 1 1 11 6001 1 1 12 ARG HD3 H 9.014 -5.736 4.179 1.00 . A A . 12 ARG HD3 1 1 11 6002 1 1 12 ARG HE H 9.602 -3.612 5.452 1.00 . A A . 12 ARG HE 1 1 11 6003 1 1 12 ARG HG2 H 7.887 -4.409 2.727 1.00 . A A . 12 ARG HG2 1 1 11 6004 1 1 12 ARG HG3 H 7.697 -3.208 3.999 1.00 . A A . 12 ARG HG3 1 1 11 6005 1 1 12 ARG HH11 H 7.012 -3.490 7.000 1.00 . A A . 12 ARG HH11 1 1 11 6006 1 1 12 ARG HH12 H 7.485 -4.159 8.526 1.00 . A A . 12 ARG HH12 1 1 11 6007 1 1 12 ARG HH21 H 10.414 -5.554 7.309 1.00 . A A . 12 ARG HH21 1 1 11 6008 1 1 12 ARG HH22 H 9.409 -5.326 8.701 1.00 . A A . 12 ARG HH22 1 1 11 6009 1 1 12 ARG N N 4.160 -3.661 2.369 1.00 . A A . 12 ARG N 1 1 11 6010 1 1 12 ARG NE N 8.973 -4.308 5.736 1.00 . A A . 12 ARG NE 1 1 11 6011 1 1 12 ARG NH1 N 7.661 -4.011 7.553 1.00 . A A . 12 ARG NH1 1 1 11 6012 1 1 12 ARG NH2 N 9.587 -5.180 7.728 1.00 . A A . 12 ARG NH2 1 1 11 6013 1 1 12 ARG O O 7.191 -1.938 2.417 1.00 . A A . 12 ARG O 1 1 11 6014 1 1 13 HIS C C 6.615 -1.305 -0.547 1.00 . A A . 13 HIS C 1 1 11 6015 1 1 13 HIS CA C 7.095 -2.710 -0.178 1.00 . A A . 13 HIS CA 1 1 11 6016 1 1 13 HIS CB C 6.985 -3.633 -1.394 1.00 . A A . 13 HIS CB 1 1 11 6017 1 1 13 HIS CD2 C 9.343 -2.936 -2.324 1.00 . A A . 13 HIS CD2 1 1 11 6018 1 1 13 HIS CE1 C 8.804 -2.720 -4.411 1.00 . A A . 13 HIS CE1 1 1 11 6019 1 1 13 HIS CG C 8.005 -3.230 -2.423 1.00 . A A . 13 HIS CG 1 1 11 6020 1 1 13 HIS H H 5.512 -3.850 0.678 1.00 . A A . 13 HIS H 1 1 11 6021 1 1 13 HIS HA H 8.115 -2.668 0.177 1.00 . A A . 13 HIS HA 1 1 11 6022 1 1 13 HIS HB2 H 7.159 -4.655 -1.091 1.00 . A A . 13 HIS HB2 1 1 11 6023 1 1 13 HIS HB3 H 5.997 -3.552 -1.821 1.00 . A A . 13 HIS HB3 1 1 11 6024 1 1 13 HIS HD1 H 6.802 -3.223 -4.164 1.00 . A A . 13 HIS HD1 1 1 11 6025 1 1 13 HIS HD2 H 9.919 -2.953 -1.409 1.00 . A A . 13 HIS HD2 1 1 11 6026 1 1 13 HIS HE1 H 8.853 -2.535 -5.474 1.00 . A A . 13 HIS HE1 1 1 11 6027 1 1 13 HIS N N 6.202 -3.196 0.905 1.00 . A A . 13 HIS N 1 1 11 6028 1 1 13 HIS ND1 N 7.685 -3.085 -3.763 1.00 . A A . 13 HIS ND1 1 1 11 6029 1 1 13 HIS NE2 N 9.846 -2.614 -3.583 1.00 . A A . 13 HIS NE2 1 1 11 6030 1 1 13 HIS O O 7.393 -0.381 -0.572 1.00 . A A . 13 HIS O 1 1 11 6031 1 1 14 ALA C C 5.393 1.285 -0.144 1.00 . A A . 14 ALA C 1 1 11 6032 1 1 14 ALA CA C 4.917 0.276 -1.191 1.00 . A A . 14 ALA CA 1 1 11 6033 1 1 14 ALA CB C 3.396 0.365 -1.329 1.00 . A A . 14 ALA CB 1 1 11 6034 1 1 14 ALA H H 4.718 -1.852 -0.816 1.00 . A A . 14 ALA H 1 1 11 6035 1 1 14 ALA HA H 5.371 0.553 -2.130 1.00 . A A . 14 ALA HA 1 1 11 6036 1 1 14 ALA HB1 H 3.001 -0.600 -1.612 1.00 . A A . 14 ALA HB1 1 1 11 6037 1 1 14 ALA HB2 H 2.967 0.665 -0.384 1.00 . A A . 14 ALA HB2 1 1 11 6038 1 1 14 ALA HB3 H 3.153 1.096 -2.093 1.00 . A A . 14 ALA HB3 1 1 11 6039 1 1 14 ALA N N 5.356 -1.107 -0.834 1.00 . A A . 14 ALA N 1 1 11 6040 1 1 14 ALA O O 6.146 2.184 -0.460 1.00 . A A . 14 ALA O 1 1 11 6041 1 1 15 LYS C C 7.003 2.103 2.102 1.00 . A A . 15 LYS C 1 1 11 6042 1 1 15 LYS CA C 5.466 2.167 2.086 1.00 . A A . 15 LYS CA 1 1 11 6043 1 1 15 LYS CB C 4.936 1.808 3.481 1.00 . A A . 15 LYS CB 1 1 11 6044 1 1 15 LYS CD C 5.524 1.810 5.917 1.00 . A A . 15 LYS CD 1 1 11 6045 1 1 15 LYS CE C 6.611 1.222 6.819 1.00 . A A . 15 LYS CE 1 1 11 6046 1 1 15 LYS CG C 6.069 1.966 4.496 1.00 . A A . 15 LYS CG 1 1 11 6047 1 1 15 LYS H H 4.378 0.453 1.361 1.00 . A A . 15 LYS H 1 1 11 6048 1 1 15 LYS HA H 5.111 3.156 1.799 1.00 . A A . 15 LYS HA 1 1 11 6049 1 1 15 LYS HB2 H 4.111 2.453 3.748 1.00 . A A . 15 LYS HB2 1 1 11 6050 1 1 15 LYS HB3 H 4.595 0.787 3.498 1.00 . A A . 15 LYS HB3 1 1 11 6051 1 1 15 LYS HD2 H 5.225 2.778 6.293 1.00 . A A . 15 LYS HD2 1 1 11 6052 1 1 15 LYS HD3 H 4.674 1.146 5.909 1.00 . A A . 15 LYS HD3 1 1 11 6053 1 1 15 LYS HE2 H 6.152 0.728 7.662 1.00 . A A . 15 LYS HE2 1 1 11 6054 1 1 15 LYS HE3 H 7.196 0.507 6.258 1.00 . A A . 15 LYS HE3 1 1 11 6055 1 1 15 LYS HG2 H 6.818 1.210 4.309 1.00 . A A . 15 LYS HG2 1 1 11 6056 1 1 15 LYS HG3 H 6.511 2.945 4.388 1.00 . A A . 15 LYS HG3 1 1 11 6057 1 1 15 LYS HZ1 H 6.923 3.059 7.749 1.00 . A A . 15 LYS HZ1 1 1 11 6058 1 1 15 LYS HZ2 H 8.169 1.931 8.001 1.00 . A A . 15 LYS HZ2 1 1 11 6059 1 1 15 LYS HZ3 H 8.021 2.724 6.504 1.00 . A A . 15 LYS HZ3 1 1 11 6060 1 1 15 LYS N N 4.985 1.173 1.090 1.00 . A A . 15 LYS N 1 1 11 6061 1 1 15 LYS NZ N 7.499 2.316 7.306 1.00 . A A . 15 LYS NZ 1 1 11 6062 1 1 15 LYS O O 7.653 3.125 2.200 1.00 . A A . 15 LYS O 1 1 11 6063 1 1 16 SER C C 9.771 0.936 0.647 1.00 . A A . 16 SER C 1 1 11 6064 1 1 16 SER CA C 9.107 0.845 2.027 1.00 . A A . 16 SER CA 1 1 11 6065 1 1 16 SER CB C 9.461 -0.540 2.554 1.00 . A A . 16 SER CB 1 1 11 6066 1 1 16 SER H H 7.117 0.093 1.934 1.00 . A A . 16 SER H 1 1 11 6067 1 1 16 SER HA H 9.535 1.558 2.712 1.00 . A A . 16 SER HA 1 1 11 6068 1 1 16 SER HB2 H 8.750 -0.840 3.306 1.00 . A A . 16 SER HB2 1 1 11 6069 1 1 16 SER HB3 H 9.402 -1.225 1.716 1.00 . A A . 16 SER HB3 1 1 11 6070 1 1 16 SER HG H 10.952 -1.392 3.465 1.00 . A A . 16 SER HG 1 1 11 6071 1 1 16 SER N N 7.615 0.939 2.011 1.00 . A A . 16 SER N 1 1 11 6072 1 1 16 SER O O 10.942 0.637 0.524 1.00 . A A . 16 SER O 1 1 11 6073 1 1 16 SER OG O 10.766 -0.518 3.116 1.00 . A A . 16 SER OG 1 1 11 6074 1 1 17 LEU C C 9.877 2.822 -2.236 1.00 . A A . 17 LEU C 1 1 11 6075 1 1 17 LEU CA C 9.781 1.388 -1.716 1.00 . A A . 17 LEU CA 1 1 11 6076 1 1 17 LEU CB C 9.045 0.484 -2.707 1.00 . A A . 17 LEU CB 1 1 11 6077 1 1 17 LEU CD1 C 8.327 2.056 -4.454 1.00 . A A . 17 LEU CD1 1 1 11 6078 1 1 17 LEU CD2 C 6.935 0.044 -3.782 1.00 . A A . 17 LEU CD2 1 1 11 6079 1 1 17 LEU CG C 7.833 1.182 -3.302 1.00 . A A . 17 LEU CG 1 1 11 6080 1 1 17 LEU H H 8.148 1.562 -0.304 1.00 . A A . 17 LEU H 1 1 11 6081 1 1 17 LEU HA H 10.787 1.020 -1.607 1.00 . A A . 17 LEU HA 1 1 11 6082 1 1 17 LEU HB2 H 9.693 0.213 -3.525 1.00 . A A . 17 LEU HB2 1 1 11 6083 1 1 17 LEU HB3 H 8.704 -0.411 -2.209 1.00 . A A . 17 LEU HB3 1 1 11 6084 1 1 17 LEU HD11 H 9.407 2.090 -4.410 1.00 . A A . 17 LEU HD11 1 1 11 6085 1 1 17 LEU HD12 H 8.010 1.631 -5.394 1.00 . A A . 17 LEU HD12 1 1 11 6086 1 1 17 LEU HD13 H 7.931 3.053 -4.346 1.00 . A A . 17 LEU HD13 1 1 11 6087 1 1 17 LEU HD21 H 6.964 -0.743 -3.040 1.00 . A A . 17 LEU HD21 1 1 11 6088 1 1 17 LEU HD22 H 5.923 0.395 -3.896 1.00 . A A . 17 LEU HD22 1 1 11 6089 1 1 17 LEU HD23 H 7.302 -0.340 -4.721 1.00 . A A . 17 LEU HD23 1 1 11 6090 1 1 17 LEU HG H 7.335 1.772 -2.550 1.00 . A A . 17 LEU HG 1 1 11 6091 1 1 17 LEU N N 9.093 1.324 -0.395 1.00 . A A . 17 LEU N 1 1 11 6092 1 1 17 LEU O O 10.871 3.219 -2.808 1.00 . A A . 17 LEU O 1 1 11 6093 1 1 18 GLY C C 7.513 5.376 -3.081 1.00 . A A . 18 GLY C 1 1 11 6094 1 1 18 GLY CA C 8.885 5.005 -2.523 1.00 . A A . 18 GLY CA 1 1 11 6095 1 1 18 GLY H H 8.062 3.260 -1.579 1.00 . A A . 18 GLY H 1 1 11 6096 1 1 18 GLY HA2 H 9.139 5.660 -1.703 1.00 . A A . 18 GLY HA2 1 1 11 6097 1 1 18 GLY HA3 H 9.619 5.103 -3.310 1.00 . A A . 18 GLY HA3 1 1 11 6098 1 1 18 GLY N N 8.852 3.600 -2.042 1.00 . A A . 18 GLY N 1 1 11 6099 1 1 18 GLY O O 7.291 6.507 -3.467 1.00 . A A . 18 GLY O 1 1 11 6100 1 1 19 ASN C C 4.364 5.439 -2.595 1.00 . A A . 19 ASN C 1 1 11 6101 1 1 19 ASN CA C 5.262 4.837 -3.684 1.00 . A A . 19 ASN CA 1 1 11 6102 1 1 19 ASN CB C 4.656 3.595 -4.339 1.00 . A A . 19 ASN CB 1 1 11 6103 1 1 19 ASN CG C 5.343 3.270 -5.663 1.00 . A A . 19 ASN CG 1 1 11 6104 1 1 19 ASN H H 6.713 3.539 -2.845 1.00 . A A . 19 ASN H 1 1 11 6105 1 1 19 ASN HA H 5.447 5.573 -4.451 1.00 . A A . 19 ASN HA 1 1 11 6106 1 1 19 ASN HB2 H 4.723 2.751 -3.694 1.00 . A A . 19 ASN HB2 1 1 11 6107 1 1 19 ASN HB3 H 3.619 3.724 -4.502 1.00 . A A . 19 ASN HB3 1 1 11 6108 1 1 19 ASN HD21 H 5.208 1.320 -5.335 1.00 . A A . 19 ASN HD21 1 1 11 6109 1 1 19 ASN HD22 H 5.956 1.751 -6.795 1.00 . A A . 19 ASN HD22 1 1 11 6110 1 1 19 ASN N N 6.582 4.461 -3.140 1.00 . A A . 19 ASN N 1 1 11 6111 1 1 19 ASN ND2 N 5.518 2.011 -5.959 1.00 . A A . 19 ASN ND2 1 1 11 6112 1 1 19 ASN O O 4.350 6.644 -2.439 1.00 . A A . 19 ASN O 1 1 11 6113 1 1 19 ASN OD1 O 5.715 4.144 -6.419 1.00 . A A . 19 ASN OD1 1 1 11 6114 1 1 20 CYS C C 2.051 6.541 -1.295 1.00 . A A . 20 CYS C 1 1 11 6115 1 1 20 CYS CA C 2.744 5.268 -0.777 1.00 . A A . 20 CYS CA 1 1 11 6116 1 1 20 CYS CB C 3.708 5.465 0.397 1.00 . A A . 20 CYS CB 1 1 11 6117 1 1 20 CYS H H 3.613 3.701 -1.940 1.00 . A A . 20 CYS H 1 1 11 6118 1 1 20 CYS HA H 1.990 4.548 -0.496 1.00 . A A . 20 CYS HA 1 1 11 6119 1 1 20 CYS HB2 H 3.697 4.574 1.008 1.00 . A A . 20 CYS HB2 1 1 11 6120 1 1 20 CYS HB3 H 4.694 5.590 -0.022 1.00 . A A . 20 CYS HB3 1 1 11 6121 1 1 20 CYS N N 3.616 4.674 -1.834 1.00 . A A . 20 CYS N 1 1 11 6122 1 1 20 CYS O O 1.674 7.427 -0.557 1.00 . A A . 20 CYS O 1 1 11 6123 1 1 20 CYS SG S 3.331 6.847 1.501 1.00 . A A . 20 CYS SG 1 1 11 6124 1 1 21 ARG C C 1.690 8.054 -4.661 1.00 . A A . 21 ARG C 1 1 11 6125 1 1 21 ARG CA C 1.207 7.819 -3.224 1.00 . A A . 21 ARG CA 1 1 11 6126 1 1 21 ARG CB C 1.568 9.098 -2.472 1.00 . A A . 21 ARG CB 1 1 11 6127 1 1 21 ARG CD C 0.140 10.992 -1.695 1.00 . A A . 21 ARG CD 1 1 11 6128 1 1 21 ARG CG C 0.421 9.495 -1.543 1.00 . A A . 21 ARG CG 1 1 11 6129 1 1 21 ARG CZ C -0.288 12.722 -0.054 1.00 . A A . 21 ARG CZ 1 1 11 6130 1 1 21 ARG H H 2.174 5.903 -3.146 1.00 . A A . 21 ARG H 1 1 11 6131 1 1 21 ARG HA H 0.136 7.706 -3.196 1.00 . A A . 21 ARG HA 1 1 11 6132 1 1 21 ARG HB2 H 2.455 8.899 -1.891 1.00 . A A . 21 ARG HB2 1 1 11 6133 1 1 21 ARG HB3 H 1.760 9.892 -3.177 1.00 . A A . 21 ARG HB3 1 1 11 6134 1 1 21 ARG HD2 H 1.070 11.517 -1.850 1.00 . A A . 21 ARG HD2 1 1 11 6135 1 1 21 ARG HD3 H -0.512 11.157 -2.540 1.00 . A A . 21 ARG HD3 1 1 11 6136 1 1 21 ARG HE H -1.113 10.919 0.057 1.00 . A A . 21 ARG HE 1 1 11 6137 1 1 21 ARG HG2 H -0.460 8.924 -1.797 1.00 . A A . 21 ARG HG2 1 1 11 6138 1 1 21 ARG HG3 H 0.698 9.288 -0.520 1.00 . A A . 21 ARG HG3 1 1 11 6139 1 1 21 ARG HH11 H 1.647 12.393 0.341 1.00 . A A . 21 ARG HH11 1 1 11 6140 1 1 21 ARG HH12 H 1.081 14.001 0.653 1.00 . A A . 21 ARG HH12 1 1 11 6141 1 1 21 ARG HH21 H -2.168 13.337 -0.356 1.00 . A A . 21 ARG HH21 1 1 11 6142 1 1 21 ARG HH22 H -1.078 14.534 0.258 1.00 . A A . 21 ARG HH22 1 1 11 6143 1 1 21 ARG N N 1.868 6.637 -2.587 1.00 . A A . 21 ARG N 1 1 11 6144 1 1 21 ARG NE N -0.514 11.501 -0.455 1.00 . A A . 21 ARG NE 1 1 11 6145 1 1 21 ARG NH1 N 0.907 13.065 0.344 1.00 . A A . 21 ARG NH1 1 1 11 6146 1 1 21 ARG NH2 N -1.254 13.599 -0.050 1.00 . A A . 21 ARG NH2 1 1 11 6147 1 1 21 ARG O O 1.038 8.744 -5.419 1.00 . A A . 21 ARG O 1 1 11 6148 1 1 22 THR C C 2.821 6.589 -7.343 1.00 . A A . 22 THR C 1 1 11 6149 1 1 22 THR CA C 3.295 7.734 -6.453 1.00 . A A . 22 THR CA 1 1 11 6150 1 1 22 THR CB C 4.825 7.786 -6.454 1.00 . A A . 22 THR CB 1 1 11 6151 1 1 22 THR CG2 C 5.320 8.438 -5.162 1.00 . A A . 22 THR CG2 1 1 11 6152 1 1 22 THR H H 3.341 6.958 -4.462 1.00 . A A . 22 THR H 1 1 11 6153 1 1 22 THR HA H 2.903 8.668 -6.827 1.00 . A A . 22 THR HA 1 1 11 6154 1 1 22 THR HB H 5.167 8.375 -7.292 1.00 . A A . 22 THR HB 1 1 11 6155 1 1 22 THR HG1 H 6.275 6.496 -6.346 1.00 . A A . 22 THR HG1 1 1 11 6156 1 1 22 THR HG21 H 4.853 9.404 -5.044 1.00 . A A . 22 THR HG21 1 1 11 6157 1 1 22 THR HG22 H 5.062 7.810 -4.322 1.00 . A A . 22 THR HG22 1 1 11 6158 1 1 22 THR HG23 H 6.392 8.558 -5.206 1.00 . A A . 22 THR HG23 1 1 11 6159 1 1 22 THR N N 2.809 7.512 -5.064 1.00 . A A . 22 THR N 1 1 11 6160 1 1 22 THR O O 2.857 6.681 -8.554 1.00 . A A . 22 THR O 1 1 11 6161 1 1 22 THR OG1 O 5.339 6.466 -6.556 1.00 . A A . 22 THR OG1 1 1 11 6162 1 1 23 SER C C 0.418 4.345 -7.262 1.00 . A A . 23 SER C 1 1 11 6163 1 1 23 SER CA C 1.903 4.390 -7.609 1.00 . A A . 23 SER CA 1 1 11 6164 1 1 23 SER CB C 2.684 3.146 -7.182 1.00 . A A . 23 SER CB 1 1 11 6165 1 1 23 SER H H 2.332 5.420 -5.781 1.00 . A A . 23 SER H 1 1 11 6166 1 1 23 SER HA H 2.030 4.625 -8.656 1.00 . A A . 23 SER HA 1 1 11 6167 1 1 23 SER HB2 H 3.083 3.296 -6.187 1.00 . A A . 23 SER HB2 1 1 11 6168 1 1 23 SER HB3 H 2.019 2.295 -7.160 1.00 . A A . 23 SER HB3 1 1 11 6169 1 1 23 SER HG H 3.633 3.519 -8.839 1.00 . A A . 23 SER HG 1 1 11 6170 1 1 23 SER N N 2.373 5.512 -6.762 1.00 . A A . 23 SER N 1 1 11 6171 1 1 23 SER O O 0.067 4.158 -6.120 1.00 . A A . 23 SER O 1 1 11 6172 1 1 23 SER OG O 3.764 2.942 -8.083 1.00 . A A . 23 SER OG 1 1 11 6173 1 1 24 GLN C C -2.266 3.131 -7.150 1.00 . A A . 24 GLN C 1 1 11 6174 1 1 24 GLN CA C -1.908 4.478 -7.776 1.00 . A A . 24 GLN CA 1 1 11 6175 1 1 24 GLN CB C -2.817 4.773 -8.970 1.00 . A A . 24 GLN CB 1 1 11 6176 1 1 24 GLN CD C -3.514 6.740 -10.345 1.00 . A A . 24 GLN CD 1 1 11 6177 1 1 24 GLN CG C -3.282 6.230 -8.921 1.00 . A A . 24 GLN CG 1 1 11 6178 1 1 24 GLN H H -0.223 4.685 -9.119 1.00 . A A . 24 GLN H 1 1 11 6179 1 1 24 GLN HA H -2.054 5.242 -7.022 1.00 . A A . 24 GLN HA 1 1 11 6180 1 1 24 GLN HB2 H -2.274 4.597 -9.886 1.00 . A A . 24 GLN HB2 1 1 11 6181 1 1 24 GLN HB3 H -3.681 4.125 -8.933 1.00 . A A . 24 GLN HB3 1 1 11 6182 1 1 24 GLN HE21 H -4.697 5.227 -10.847 1.00 . A A . 24 GLN HE21 1 1 11 6183 1 1 24 GLN HE22 H -4.433 6.377 -12.067 1.00 . A A . 24 GLN HE22 1 1 11 6184 1 1 24 GLN HG2 H -4.201 6.295 -8.358 1.00 . A A . 24 GLN HG2 1 1 11 6185 1 1 24 GLN HG3 H -2.523 6.835 -8.447 1.00 . A A . 24 GLN HG3 1 1 11 6186 1 1 24 GLN N N -0.477 4.522 -8.188 1.00 . A A . 24 GLN N 1 1 11 6187 1 1 24 GLN NE2 N -4.278 6.058 -11.153 1.00 . A A . 24 GLN NE2 1 1 11 6188 1 1 24 GLN O O -3.017 3.080 -6.196 1.00 . A A . 24 GLN O 1 1 11 6189 1 1 24 GLN OE1 O -2.994 7.770 -10.725 1.00 . A A . 24 GLN OE1 1 1 11 6190 1 1 25 LYS C C -1.225 0.372 -5.842 1.00 . A A . 25 LYS C 1 1 11 6191 1 1 25 LYS CA C -2.128 0.744 -7.015 1.00 . A A . 25 LYS CA 1 1 11 6192 1 1 25 LYS CB C -2.027 -0.395 -8.009 1.00 . A A . 25 LYS CB 1 1 11 6193 1 1 25 LYS CD C -3.203 -2.568 -8.483 1.00 . A A . 25 LYS CD 1 1 11 6194 1 1 25 LYS CE C -4.678 -2.912 -8.690 1.00 . A A . 25 LYS CE 1 1 11 6195 1 1 25 LYS CG C -3.080 -1.383 -7.523 1.00 . A A . 25 LYS CG 1 1 11 6196 1 1 25 LYS H H -1.155 2.043 -8.412 1.00 . A A . 25 LYS H 1 1 11 6197 1 1 25 LYS HA H -3.152 0.808 -6.688 1.00 . A A . 25 LYS HA 1 1 11 6198 1 1 25 LYS HB2 H -2.219 -0.022 -9.005 1.00 . A A . 25 LYS HB2 1 1 11 6199 1 1 25 LYS HB3 H -1.049 -0.838 -7.925 1.00 . A A . 25 LYS HB3 1 1 11 6200 1 1 25 LYS HD2 H -2.756 -2.309 -9.431 1.00 . A A . 25 LYS HD2 1 1 11 6201 1 1 25 LYS HD3 H -2.695 -3.427 -8.070 1.00 . A A . 25 LYS HD3 1 1 11 6202 1 1 25 LYS HE2 H -5.260 -2.510 -7.875 1.00 . A A . 25 LYS HE2 1 1 11 6203 1 1 25 LYS HE3 H -5.020 -2.485 -9.622 1.00 . A A . 25 LYS HE3 1 1 11 6204 1 1 25 LYS HG2 H -2.809 -1.705 -6.526 1.00 . A A . 25 LYS HG2 1 1 11 6205 1 1 25 LYS HG3 H -4.015 -0.849 -7.467 1.00 . A A . 25 LYS HG3 1 1 11 6206 1 1 25 LYS HZ1 H -3.963 -4.829 -9.083 1.00 . A A . 25 LYS HZ1 1 1 11 6207 1 1 25 LYS HZ2 H -5.050 -4.745 -7.779 1.00 . A A . 25 LYS HZ2 1 1 11 6208 1 1 25 LYS HZ3 H -5.620 -4.639 -9.377 1.00 . A A . 25 LYS HZ3 1 1 11 6209 1 1 25 LYS N N -1.760 2.036 -7.646 1.00 . A A . 25 LYS N 1 1 11 6210 1 1 25 LYS NZ N -4.841 -4.393 -8.735 1.00 . A A . 25 LYS NZ 1 1 11 6211 1 1 25 LYS O O -1.182 -0.762 -5.410 1.00 . A A . 25 LYS O 1 1 11 6212 1 1 26 TYR C C -0.115 1.957 -3.019 1.00 . A A . 26 TYR C 1 1 11 6213 1 1 26 TYR CA C 0.406 1.140 -4.198 1.00 . A A . 26 TYR CA 1 1 11 6214 1 1 26 TYR CB C 1.795 1.683 -4.496 1.00 . A A . 26 TYR CB 1 1 11 6215 1 1 26 TYR CD1 C 1.865 -0.160 -6.141 1.00 . A A . 26 TYR CD1 1 1 11 6216 1 1 26 TYR CD2 C 3.592 -0.106 -4.438 1.00 . A A . 26 TYR CD2 1 1 11 6217 1 1 26 TYR CE1 C 2.422 -1.320 -6.672 1.00 . A A . 26 TYR CE1 1 1 11 6218 1 1 26 TYR CE2 C 4.147 -1.273 -4.972 1.00 . A A . 26 TYR CE2 1 1 11 6219 1 1 26 TYR CG C 2.451 0.442 -5.030 1.00 . A A . 26 TYR CG 1 1 11 6220 1 1 26 TYR CZ C 3.565 -1.884 -6.091 1.00 . A A . 26 TYR CZ 1 1 11 6221 1 1 26 TYR H H -0.627 2.208 -5.767 1.00 . A A . 26 TYR H 1 1 11 6222 1 1 26 TYR HA H 0.484 0.077 -3.992 1.00 . A A . 26 TYR HA 1 1 11 6223 1 1 26 TYR HB2 H 1.712 2.487 -5.203 1.00 . A A . 26 TYR HB2 1 1 11 6224 1 1 26 TYR HB3 H 2.293 2.001 -3.593 1.00 . A A . 26 TYR HB3 1 1 11 6225 1 1 26 TYR HD1 H 0.985 0.277 -6.589 1.00 . A A . 26 TYR HD1 1 1 11 6226 1 1 26 TYR HD2 H 4.040 0.367 -3.578 1.00 . A A . 26 TYR HD2 1 1 11 6227 1 1 26 TYR HE1 H 1.954 -1.771 -7.528 1.00 . A A . 26 TYR HE1 1 1 11 6228 1 1 26 TYR HE2 H 5.027 -1.700 -4.519 1.00 . A A . 26 TYR HE2 1 1 11 6229 1 1 26 TYR HH H 4.417 -2.839 -7.506 1.00 . A A . 26 TYR HH 1 1 11 6230 1 1 26 TYR N N -0.520 1.339 -5.348 1.00 . A A . 26 TYR N 1 1 11 6231 1 1 26 TYR O O -0.330 1.472 -1.937 1.00 . A A . 26 TYR O 1 1 11 6232 1 1 26 TYR OH O 4.115 -3.035 -6.616 1.00 . A A . 26 TYR OH 1 1 11 6233 1 1 27 ARG C C -2.213 3.788 -1.756 1.00 . A A . 27 ARG C 1 1 11 6234 1 1 27 ARG CA C -0.815 4.186 -2.242 1.00 . A A . 27 ARG CA 1 1 11 6235 1 1 27 ARG CB C -0.828 5.556 -2.930 1.00 . A A . 27 ARG CB 1 1 11 6236 1 1 27 ARG CD C -2.218 7.170 -4.268 1.00 . A A . 27 ARG CD 1 1 11 6237 1 1 27 ARG CG C -2.150 5.765 -3.662 1.00 . A A . 27 ARG CG 1 1 11 6238 1 1 27 ARG CZ C -3.085 9.340 -3.646 1.00 . A A . 27 ARG CZ 1 1 11 6239 1 1 27 ARG H H -0.123 3.567 -4.145 1.00 . A A . 27 ARG H 1 1 11 6240 1 1 27 ARG HA H -0.125 4.221 -1.413 1.00 . A A . 27 ARG HA 1 1 11 6241 1 1 27 ARG HB2 H -0.694 6.350 -2.213 1.00 . A A . 27 ARG HB2 1 1 11 6242 1 1 27 ARG HB3 H -0.033 5.583 -3.662 1.00 . A A . 27 ARG HB3 1 1 11 6243 1 1 27 ARG HD2 H -1.223 7.539 -4.459 1.00 . A A . 27 ARG HD2 1 1 11 6244 1 1 27 ARG HD3 H -2.767 7.130 -5.198 1.00 . A A . 27 ARG HD3 1 1 11 6245 1 1 27 ARG HE H -3.251 7.750 -2.468 1.00 . A A . 27 ARG HE 1 1 11 6246 1 1 27 ARG HG2 H -2.180 5.047 -4.468 1.00 . A A . 27 ARG HG2 1 1 11 6247 1 1 27 ARG HG3 H -2.971 5.627 -2.971 1.00 . A A . 27 ARG HG3 1 1 11 6248 1 1 27 ARG HH11 H -4.269 8.949 -5.214 1.00 . A A . 27 ARG HH11 1 1 11 6249 1 1 27 ARG HH12 H -3.953 10.624 -4.914 1.00 . A A . 27 ARG HH12 1 1 11 6250 1 1 27 ARG HH21 H -1.941 10.012 -2.153 1.00 . A A . 27 ARG HH21 1 1 11 6251 1 1 27 ARG HH22 H -2.628 11.231 -3.175 1.00 . A A . 27 ARG HH22 1 1 11 6252 1 1 27 ARG N N -0.312 3.223 -3.257 1.00 . A A . 27 ARG N 1 1 11 6253 1 1 27 ARG NE N -2.918 8.086 -3.326 1.00 . A A . 27 ARG NE 1 1 11 6254 1 1 27 ARG NH1 N -3.826 9.663 -4.671 1.00 . A A . 27 ARG NH1 1 1 11 6255 1 1 27 ARG NH2 N -2.507 10.268 -2.937 1.00 . A A . 27 ARG NH2 1 1 11 6256 1 1 27 ARG O O -2.494 3.785 -0.574 1.00 . A A . 27 ARG O 1 1 11 6257 1 1 28 ALA C C -4.607 1.543 -2.070 1.00 . A A . 28 ALA C 1 1 11 6258 1 1 28 ALA CA C -4.484 3.059 -2.247 1.00 . A A . 28 ALA CA 1 1 11 6259 1 1 28 ALA CB C -5.441 3.457 -3.367 1.00 . A A . 28 ALA CB 1 1 11 6260 1 1 28 ALA H H -2.854 3.464 -3.606 1.00 . A A . 28 ALA H 1 1 11 6261 1 1 28 ALA HA H -4.779 3.575 -1.346 1.00 . A A . 28 ALA HA 1 1 11 6262 1 1 28 ALA HB1 H -5.151 4.418 -3.765 1.00 . A A . 28 ALA HB1 1 1 11 6263 1 1 28 ALA HB2 H -5.387 2.708 -4.145 1.00 . A A . 28 ALA HB2 1 1 11 6264 1 1 28 ALA HB3 H -6.450 3.506 -2.985 1.00 . A A . 28 ALA HB3 1 1 11 6265 1 1 28 ALA N N -3.100 3.454 -2.655 1.00 . A A . 28 ALA N 1 1 11 6266 1 1 28 ALA O O -5.669 1.014 -1.811 1.00 . A A . 28 ALA O 1 1 11 6267 1 1 29 ASN C C -2.529 -1.068 -0.973 1.00 . A A . 29 ASN C 1 1 11 6268 1 1 29 ASN CA C -3.477 -0.633 -2.087 1.00 . A A . 29 ASN CA 1 1 11 6269 1 1 29 ASN CB C -2.944 -1.085 -3.439 1.00 . A A . 29 ASN CB 1 1 11 6270 1 1 29 ASN CG C -3.686 -0.235 -4.471 1.00 . A A . 29 ASN CG 1 1 11 6271 1 1 29 ASN H H -2.686 1.319 -2.434 1.00 . A A . 29 ASN H 1 1 11 6272 1 1 29 ASN HA H -4.451 -1.062 -1.943 1.00 . A A . 29 ASN HA 1 1 11 6273 1 1 29 ASN HB2 H -1.882 -0.886 -3.457 1.00 . A A . 29 ASN HB2 1 1 11 6274 1 1 29 ASN HB3 H -3.128 -2.130 -3.623 1.00 . A A . 29 ASN HB3 1 1 11 6275 1 1 29 ASN HD21 H -4.853 -1.722 -5.056 1.00 . A A . 29 ASN HD21 1 1 11 6276 1 1 29 ASN HD22 H -5.110 -0.238 -5.845 1.00 . A A . 29 ASN HD22 1 1 11 6277 1 1 29 ASN N N -3.517 0.851 -2.219 1.00 . A A . 29 ASN N 1 1 11 6278 1 1 29 ASN ND2 N -4.629 -0.778 -5.185 1.00 . A A . 29 ASN ND2 1 1 11 6279 1 1 29 ASN O O -2.480 -2.225 -0.617 1.00 . A A . 29 ASN O 1 1 11 6280 1 1 29 ASN OD1 O -3.413 0.939 -4.629 1.00 . A A . 29 ASN OD1 1 1 11 6281 1 1 30 CYS C C -0.993 0.813 1.592 1.00 . A A . 30 CYS C 1 1 11 6282 1 1 30 CYS CA C -0.821 -0.375 0.651 1.00 . A A . 30 CYS CA 1 1 11 6283 1 1 30 CYS CB C 0.550 -0.440 -0.025 1.00 . A A . 30 CYS CB 1 1 11 6284 1 1 30 CYS H H -1.893 0.778 -0.779 1.00 . A A . 30 CYS H 1 1 11 6285 1 1 30 CYS HA H -1.050 -1.301 1.162 1.00 . A A . 30 CYS HA 1 1 11 6286 1 1 30 CYS HB2 H 0.796 0.498 -0.497 1.00 . A A . 30 CYS HB2 1 1 11 6287 1 1 30 CYS HB3 H 1.333 -0.698 0.670 1.00 . A A . 30 CYS HB3 1 1 11 6288 1 1 30 CYS N N -1.797 -0.133 -0.443 1.00 . A A . 30 CYS N 1 1 11 6289 1 1 30 CYS O O -0.073 1.312 2.208 1.00 . A A . 30 CYS O 1 1 11 6290 1 1 30 CYS SG S 0.349 -1.786 -1.219 1.00 . A A . 30 CYS SG 1 1 11 6291 1 1 31 ALA C C -2.546 1.974 4.005 1.00 . A A . 31 ALA C 1 1 11 6292 1 1 31 ALA CA C -2.605 2.391 2.530 1.00 . A A . 31 ALA CA 1 1 11 6293 1 1 31 ALA CB C -4.010 2.833 2.114 1.00 . A A . 31 ALA CB 1 1 11 6294 1 1 31 ALA H H -2.933 0.815 1.160 1.00 . A A . 31 ALA H 1 1 11 6295 1 1 31 ALA HA H -1.899 3.177 2.320 1.00 . A A . 31 ALA HA 1 1 11 6296 1 1 31 ALA HB1 H -4.340 2.233 1.275 1.00 . A A . 31 ALA HB1 1 1 11 6297 1 1 31 ALA HB2 H -4.690 2.690 2.941 1.00 . A A . 31 ALA HB2 1 1 11 6298 1 1 31 ALA HB3 H -3.997 3.874 1.829 1.00 . A A . 31 ALA HB3 1 1 11 6299 1 1 31 ALA N N -2.224 1.245 1.672 1.00 . A A . 31 ALA N 1 1 11 6300 1 1 31 ALA O O -2.736 2.773 4.901 1.00 . A A . 31 ALA O 1 1 11 6301 1 1 32 LYS C C -0.728 0.430 6.049 1.00 . A A . 32 LYS C 1 1 11 6302 1 1 32 LYS CA C -2.179 0.180 5.641 1.00 . A A . 32 LYS CA 1 1 11 6303 1 1 32 LYS CB C -2.409 -1.332 5.557 1.00 . A A . 32 LYS CB 1 1 11 6304 1 1 32 LYS CD C -1.386 -3.604 5.207 1.00 . A A . 32 LYS CD 1 1 11 6305 1 1 32 LYS CE C -0.227 -4.344 5.884 1.00 . A A . 32 LYS CE 1 1 11 6306 1 1 32 LYS CG C -1.120 -2.095 5.231 1.00 . A A . 32 LYS CG 1 1 11 6307 1 1 32 LYS H H -2.123 0.099 3.520 1.00 . A A . 32 LYS H 1 1 11 6308 1 1 32 LYS HA H -2.892 0.651 6.302 1.00 . A A . 32 LYS HA 1 1 11 6309 1 1 32 LYS HB2 H -2.793 -1.697 6.496 1.00 . A A . 32 LYS HB2 1 1 11 6310 1 1 32 LYS HB3 H -3.126 -1.509 4.771 1.00 . A A . 32 LYS HB3 1 1 11 6311 1 1 32 LYS HD2 H -2.305 -3.815 5.734 1.00 . A A . 32 LYS HD2 1 1 11 6312 1 1 32 LYS HD3 H -1.470 -3.941 4.184 1.00 . A A . 32 LYS HD3 1 1 11 6313 1 1 32 LYS HE2 H 0.236 -5.045 5.200 1.00 . A A . 32 LYS HE2 1 1 11 6314 1 1 32 LYS HE3 H 0.500 -3.614 6.204 1.00 . A A . 32 LYS HE3 1 1 11 6315 1 1 32 LYS HG2 H -0.761 -1.789 4.260 1.00 . A A . 32 LYS HG2 1 1 11 6316 1 1 32 LYS HG3 H -0.372 -1.882 5.979 1.00 . A A . 32 LYS HG3 1 1 11 6317 1 1 32 LYS HZ1 H -1.770 -5.180 7.006 1.00 . A A . 32 LYS HZ1 1 1 11 6318 1 1 32 LYS HZ2 H -0.295 -6.017 7.116 1.00 . A A . 32 LYS HZ2 1 1 11 6319 1 1 32 LYS HZ3 H -0.507 -4.544 7.938 1.00 . A A . 32 LYS HZ3 1 1 11 6320 1 1 32 LYS N N -2.276 0.722 4.258 1.00 . A A . 32 LYS N 1 1 11 6321 1 1 32 LYS NZ N -0.738 -5.077 7.075 1.00 . A A . 32 LYS NZ 1 1 11 6322 1 1 32 LYS O O -0.396 0.755 7.172 1.00 . A A . 32 LYS O 1 1 11 6323 1 1 33 THR C C 1.954 1.923 5.154 1.00 . A A . 33 THR C 1 1 11 6324 1 1 33 THR CA C 1.587 0.441 5.197 1.00 . A A . 33 THR CA 1 1 11 6325 1 1 33 THR CB C 2.170 -0.377 4.048 1.00 . A A . 33 THR CB 1 1 11 6326 1 1 33 THR CG2 C 3.488 -1.017 4.457 1.00 . A A . 33 THR CG2 1 1 11 6327 1 1 33 THR H H -0.230 -0.001 4.196 1.00 . A A . 33 THR H 1 1 11 6328 1 1 33 THR HA H 1.952 0.053 6.128 1.00 . A A . 33 THR HA 1 1 11 6329 1 1 33 THR HB H 2.319 0.233 3.171 1.00 . A A . 33 THR HB 1 1 11 6330 1 1 33 THR HG1 H 1.755 -2.204 3.530 1.00 . A A . 33 THR HG1 1 1 11 6331 1 1 33 THR HG21 H 3.937 -0.447 5.257 1.00 . A A . 33 THR HG21 1 1 11 6332 1 1 33 THR HG22 H 3.308 -2.032 4.779 1.00 . A A . 33 THR HG22 1 1 11 6333 1 1 33 THR HG23 H 4.138 -1.024 3.596 1.00 . A A . 33 THR HG23 1 1 11 6334 1 1 33 THR N N 0.118 0.261 5.072 1.00 . A A . 33 THR N 1 1 11 6335 1 1 33 THR O O 2.947 2.333 5.722 1.00 . A A . 33 THR O 1 1 11 6336 1 1 33 THR OG1 O 1.252 -1.423 3.773 1.00 . A A . 33 THR OG1 1 1 11 6337 1 1 34 CYS C C 0.487 5.021 5.170 1.00 . A A . 34 CYS C 1 1 11 6338 1 1 34 CYS CA C 1.559 4.177 4.485 1.00 . A A . 34 CYS CA 1 1 11 6339 1 1 34 CYS CB C 1.725 4.738 3.079 1.00 . A A . 34 CYS CB 1 1 11 6340 1 1 34 CYS H H 0.376 2.418 4.045 1.00 . A A . 34 CYS H 1 1 11 6341 1 1 34 CYS HA H 2.497 4.284 5.011 1.00 . A A . 34 CYS HA 1 1 11 6342 1 1 34 CYS HB2 H 1.914 3.955 2.365 1.00 . A A . 34 CYS HB2 1 1 11 6343 1 1 34 CYS HB3 H 0.833 5.253 2.787 1.00 . A A . 34 CYS HB3 1 1 11 6344 1 1 34 CYS N N 1.180 2.740 4.502 1.00 . A A . 34 CYS N 1 1 11 6345 1 1 34 CYS O O 0.599 6.228 5.266 1.00 . A A . 34 CYS O 1 1 11 6346 1 1 34 CYS SG S 3.080 5.924 3.275 1.00 . A A . 34 CYS SG 1 1 11 6347 1 1 35 GLU C C -2.418 6.045 5.370 1.00 . A A . 35 GLU C 1 1 11 6348 1 1 35 GLU CA C -1.637 5.153 6.331 1.00 . A A . 35 GLU CA 1 1 11 6349 1 1 35 GLU CB C -1.027 5.890 7.517 1.00 . A A . 35 GLU CB 1 1 11 6350 1 1 35 GLU CD C 0.804 4.993 8.987 1.00 . A A . 35 GLU CD 1 1 11 6351 1 1 35 GLU CG C -0.585 4.732 8.403 1.00 . A A . 35 GLU CG 1 1 11 6352 1 1 35 GLU H H -0.622 3.421 5.563 1.00 . A A . 35 GLU H 1 1 11 6353 1 1 35 GLU HA H -2.335 4.422 6.711 1.00 . A A . 35 GLU HA 1 1 11 6354 1 1 35 GLU HB2 H -0.192 6.498 7.197 1.00 . A A . 35 GLU HB2 1 1 11 6355 1 1 35 GLU HB3 H -1.765 6.472 8.045 1.00 . A A . 35 GLU HB3 1 1 11 6356 1 1 35 GLU HG2 H -1.313 4.593 9.189 1.00 . A A . 35 GLU HG2 1 1 11 6357 1 1 35 GLU HG3 H -0.559 3.848 7.777 1.00 . A A . 35 GLU HG3 1 1 11 6358 1 1 35 GLU N N -0.551 4.396 5.649 1.00 . A A . 35 GLU N 1 1 11 6359 1 1 35 GLU O O -3.012 7.045 5.722 1.00 . A A . 35 GLU O 1 1 11 6360 1 1 35 GLU OE1 O 1.492 5.854 8.463 1.00 . A A . 35 GLU OE1 1 1 11 6361 1 1 35 GLU OE2 O 1.159 4.327 9.945 1.00 . A A . 35 GLU OE2 1 1 11 6362 1 1 36 LEU C C -4.540 5.794 3.091 1.00 . A A . 36 LEU C 1 1 11 6363 1 1 36 LEU CA C -3.107 6.325 3.040 1.00 . A A . 36 LEU CA 1 1 11 6364 1 1 36 LEU CB C -2.497 5.924 1.697 1.00 . A A . 36 LEU CB 1 1 11 6365 1 1 36 LEU CD1 C -0.375 5.912 0.388 1.00 . A A . 36 LEU CD1 1 1 11 6366 1 1 36 LEU CD2 C -1.267 8.066 1.306 1.00 . A A . 36 LEU CD2 1 1 11 6367 1 1 36 LEU CG C -1.121 6.563 1.554 1.00 . A A . 36 LEU CG 1 1 11 6368 1 1 36 LEU H H -1.902 4.803 3.953 1.00 . A A . 36 LEU H 1 1 11 6369 1 1 36 LEU HA H -3.078 7.392 3.178 1.00 . A A . 36 LEU HA 1 1 11 6370 1 1 36 LEU HB2 H -2.397 4.861 1.702 1.00 . A A . 36 LEU HB2 1 1 11 6371 1 1 36 LEU HB3 H -3.112 6.192 0.854 1.00 . A A . 36 LEU HB3 1 1 11 6372 1 1 36 LEU HD11 H -0.941 5.064 0.034 1.00 . A A . 36 LEU HD11 1 1 11 6373 1 1 36 LEU HD12 H -0.263 6.625 -0.414 1.00 . A A . 36 LEU HD12 1 1 11 6374 1 1 36 LEU HD13 H 0.600 5.581 0.716 1.00 . A A . 36 LEU HD13 1 1 11 6375 1 1 36 LEU HD21 H -1.914 8.492 2.058 1.00 . A A . 36 LEU HD21 1 1 11 6376 1 1 36 LEU HD22 H -0.296 8.536 1.358 1.00 . A A . 36 LEU HD22 1 1 11 6377 1 1 36 LEU HD23 H -1.695 8.229 0.328 1.00 . A A . 36 LEU HD23 1 1 11 6378 1 1 36 LEU HG H -0.595 6.387 2.479 1.00 . A A . 36 LEU HG 1 1 11 6379 1 1 36 LEU N N -2.398 5.621 4.141 1.00 . A A . 36 LEU N 1 1 11 6380 1 1 36 LEU O O -5.427 6.327 2.455 1.00 . A A . 36 LEU O 1 1 11 6381 1 1 37 CYS C C -7.093 5.263 4.546 1.00 . A A . 37 CYS C 1 1 11 6382 1 1 37 CYS CA C -6.178 4.218 3.904 1.00 . A A . 37 CYS CA 1 1 11 6383 1 1 37 CYS CB C -6.200 2.936 4.739 1.00 . A A . 37 CYS CB 1 1 11 6384 1 1 37 CYS H H -4.081 4.300 4.367 1.00 . A A . 37 CYS H 1 1 11 6385 1 1 37 CYS HA H -6.524 4.002 2.904 1.00 . A A . 37 CYS HA 1 1 11 6386 1 1 37 CYS HB2 H -6.682 2.148 4.179 1.00 . A A . 37 CYS HB2 1 1 11 6387 1 1 37 CYS HB3 H -5.188 2.642 4.975 1.00 . A A . 37 CYS HB3 1 1 11 6388 1 1 37 CYS N N -4.788 4.746 3.843 1.00 . A A . 37 CYS N 1 1 11 6389 1 1 37 CYS O O -6.620 5.988 5.404 1.00 . A A . 37 CYS O 1 1 11 6390 1 1 37 CYS OXT O -8.251 5.318 4.167 1.00 . A A . 37 CYS OXT 1 1 11 6391 1 1 37 CYS SG S -7.115 3.232 6.272 1.00 . A A . 37 CYS SG 1 1 12 6392 1 1 1 VAL C C -11.251 1.929 -0.584 1.00 . A A . 1 VAL C 1 1 12 6393 1 1 1 VAL CA C -12.396 1.403 -1.450 1.00 . A A . 1 VAL CA 1 1 12 6394 1 1 1 VAL CB C -11.906 1.213 -2.887 1.00 . A A . 1 VAL CB 1 1 12 6395 1 1 1 VAL CG1 C -11.902 2.560 -3.612 1.00 . A A . 1 VAL CG1 1 1 12 6396 1 1 1 VAL CG2 C -10.485 0.647 -2.866 1.00 . A A . 1 VAL CG2 1 1 12 6397 1 1 1 VAL H1 H -13.135 3.348 -1.396 1.00 . A A . 1 VAL H1 1 1 12 6398 1 1 1 VAL H2 H -14.094 2.268 -2.293 1.00 . A A . 1 VAL H2 1 1 12 6399 1 1 1 VAL H3 H -14.119 2.212 -0.601 1.00 . A A . 1 VAL H3 1 1 12 6400 1 1 1 VAL HA H -12.738 0.457 -1.058 1.00 . A A . 1 VAL HA 1 1 12 6401 1 1 1 VAL HB H -12.565 0.530 -3.403 1.00 . A A . 1 VAL HB 1 1 12 6402 1 1 1 VAL HG11 H -12.841 3.066 -3.437 1.00 . A A . 1 VAL HG11 1 1 12 6403 1 1 1 VAL HG12 H -11.092 3.168 -3.238 1.00 . A A . 1 VAL HG12 1 1 12 6404 1 1 1 VAL HG13 H -11.772 2.398 -4.672 1.00 . A A . 1 VAL HG13 1 1 12 6405 1 1 1 VAL HG21 H -10.340 0.072 -1.964 1.00 . A A . 1 VAL HG21 1 1 12 6406 1 1 1 VAL HG22 H -10.338 0.011 -3.726 1.00 . A A . 1 VAL HG22 1 1 12 6407 1 1 1 VAL HG23 H -9.774 1.459 -2.894 1.00 . A A . 1 VAL HG23 1 1 12 6408 1 1 1 VAL N N -13.520 2.382 -1.434 1.00 . A A . 1 VAL N 1 1 12 6409 1 1 1 VAL O O -10.527 2.825 -0.970 1.00 . A A . 1 VAL O 1 1 12 6410 1 1 2 CYS C C -9.275 0.620 2.076 1.00 . A A . 2 CYS C 1 1 12 6411 1 1 2 CYS CA C -9.980 1.845 1.477 1.00 . A A . 2 CYS CA 1 1 12 6412 1 1 2 CYS CB C -10.598 2.682 2.599 1.00 . A A . 2 CYS CB 1 1 12 6413 1 1 2 CYS H H -11.679 0.654 0.873 1.00 . A A . 2 CYS H 1 1 12 6414 1 1 2 CYS HA H -9.309 2.456 0.893 1.00 . A A . 2 CYS HA 1 1 12 6415 1 1 2 CYS HB2 H -11.423 3.256 2.206 1.00 . A A . 2 CYS HB2 1 1 12 6416 1 1 2 CYS HB3 H -10.957 2.026 3.379 1.00 . A A . 2 CYS HB3 1 1 12 6417 1 1 2 CYS N N -11.081 1.376 0.586 1.00 . A A . 2 CYS N 1 1 12 6418 1 1 2 CYS O O -9.933 -0.391 2.198 1.00 . A A . 2 CYS O 1 1 12 6419 1 1 2 CYS SG S -9.357 3.808 3.281 1.00 . A A . 2 CYS SG 1 1 12 6420 1 1 3 ARG C C -6.258 -0.951 1.962 1.00 . A A . 3 ARG C 1 1 12 6421 1 1 3 ARG CA C -7.231 -0.445 3.026 1.00 . A A . 3 ARG CA 1 1 12 6422 1 1 3 ARG CB C -8.090 -1.636 3.454 1.00 . A A . 3 ARG CB 1 1 12 6423 1 1 3 ARG CD C -9.792 -3.083 2.265 1.00 . A A . 3 ARG CD 1 1 12 6424 1 1 3 ARG CG C -8.400 -2.450 2.196 1.00 . A A . 3 ARG CG 1 1 12 6425 1 1 3 ARG CZ C -10.869 -4.862 3.507 1.00 . A A . 3 ARG CZ 1 1 12 6426 1 1 3 ARG H H -7.511 1.519 2.321 1.00 . A A . 3 ARG H 1 1 12 6427 1 1 3 ARG HA H -6.661 -0.072 3.867 1.00 . A A . 3 ARG HA 1 1 12 6428 1 1 3 ARG HB2 H -7.529 -2.227 4.166 1.00 . A A . 3 ARG HB2 1 1 12 6429 1 1 3 ARG HB3 H -9.010 -1.289 3.899 1.00 . A A . 3 ARG HB3 1 1 12 6430 1 1 3 ARG HD2 H -10.509 -2.363 2.625 1.00 . A A . 3 ARG HD2 1 1 12 6431 1 1 3 ARG HD3 H -10.075 -3.412 1.274 1.00 . A A . 3 ARG HD3 1 1 12 6432 1 1 3 ARG HE H -8.905 -4.573 3.544 1.00 . A A . 3 ARG HE 1 1 12 6433 1 1 3 ARG HG2 H -8.361 -1.778 1.350 1.00 . A A . 3 ARG HG2 1 1 12 6434 1 1 3 ARG HG3 H -7.657 -3.223 2.073 1.00 . A A . 3 ARG HG3 1 1 12 6435 1 1 3 ARG HH11 H -11.236 -5.511 1.649 1.00 . A A . 3 ARG HH11 1 1 12 6436 1 1 3 ARG HH12 H -12.408 -5.958 2.844 1.00 . A A . 3 ARG HH12 1 1 12 6437 1 1 3 ARG HH21 H -10.762 -4.355 5.440 1.00 . A A . 3 ARG HH21 1 1 12 6438 1 1 3 ARG HH22 H -12.140 -5.303 4.990 1.00 . A A . 3 ARG HH22 1 1 12 6439 1 1 3 ARG N N -8.009 0.686 2.436 1.00 . A A . 3 ARG N 1 1 12 6440 1 1 3 ARG NE N -9.760 -4.256 3.183 1.00 . A A . 3 ARG NE 1 1 12 6441 1 1 3 ARG NH1 N -11.558 -5.493 2.596 1.00 . A A . 3 ARG NH1 1 1 12 6442 1 1 3 ARG NH2 N -11.289 -4.838 4.742 1.00 . A A . 3 ARG NH2 1 1 12 6443 1 1 3 ARG O O -5.967 -0.267 1.002 1.00 . A A . 3 ARG O 1 1 12 6444 1 1 4 ASP C C -5.564 -3.543 0.100 1.00 . A A . 4 ASP C 1 1 12 6445 1 1 4 ASP CA C -4.803 -2.663 1.098 1.00 . A A . 4 ASP CA 1 1 12 6446 1 1 4 ASP CB C -3.693 -3.468 1.775 1.00 . A A . 4 ASP CB 1 1 12 6447 1 1 4 ASP CG C -4.311 -4.542 2.673 1.00 . A A . 4 ASP CG 1 1 12 6448 1 1 4 ASP H H -5.993 -2.688 2.896 1.00 . A A . 4 ASP H 1 1 12 6449 1 1 4 ASP HA H -4.383 -1.816 0.584 1.00 . A A . 4 ASP HA 1 1 12 6450 1 1 4 ASP HB2 H -3.078 -3.937 1.021 1.00 . A A . 4 ASP HB2 1 1 12 6451 1 1 4 ASP HB3 H -3.086 -2.810 2.378 1.00 . A A . 4 ASP HB3 1 1 12 6452 1 1 4 ASP N N -5.752 -2.143 2.119 1.00 . A A . 4 ASP N 1 1 12 6453 1 1 4 ASP O O -6.773 -3.648 0.169 1.00 . A A . 4 ASP O 1 1 12 6454 1 1 4 ASP OD1 O -4.682 -4.213 3.787 1.00 . A A . 4 ASP OD1 1 1 12 6455 1 1 4 ASP OD2 O -4.404 -5.675 2.230 1.00 . A A . 4 ASP OD2 1 1 12 6456 1 1 5 TRP C C -4.784 -6.255 -2.137 1.00 . A A . 5 TRP C 1 1 12 6457 1 1 5 TRP CA C -5.641 -5.033 -1.791 1.00 . A A . 5 TRP CA 1 1 12 6458 1 1 5 TRP CB C -6.006 -4.200 -3.024 1.00 . A A . 5 TRP CB 1 1 12 6459 1 1 5 TRP CD1 C -7.121 -2.031 -2.351 1.00 . A A . 5 TRP CD1 1 1 12 6460 1 1 5 TRP CD2 C -8.582 -3.728 -2.542 1.00 . A A . 5 TRP CD2 1 1 12 6461 1 1 5 TRP CE2 C -9.330 -2.584 -2.164 1.00 . A A . 5 TRP CE2 1 1 12 6462 1 1 5 TRP CE3 C -9.273 -4.937 -2.728 1.00 . A A . 5 TRP CE3 1 1 12 6463 1 1 5 TRP CG C -7.179 -3.348 -2.655 1.00 . A A . 5 TRP CG 1 1 12 6464 1 1 5 TRP CH2 C -11.381 -3.857 -2.169 1.00 . A A . 5 TRP CH2 1 1 12 6465 1 1 5 TRP CZ2 C -10.715 -2.642 -1.978 1.00 . A A . 5 TRP CZ2 1 1 12 6466 1 1 5 TRP CZ3 C -10.661 -4.998 -2.543 1.00 . A A . 5 TRP CZ3 1 1 12 6467 1 1 5 TRP H H -3.913 -4.098 -0.883 1.00 . A A . 5 TRP H 1 1 12 6468 1 1 5 TRP HA H -6.550 -5.376 -1.303 1.00 . A A . 5 TRP HA 1 1 12 6469 1 1 5 TRP HB2 H -5.170 -3.582 -3.291 1.00 . A A . 5 TRP HB2 1 1 12 6470 1 1 5 TRP HB3 H -6.257 -4.808 -3.880 1.00 . A A . 5 TRP HB3 1 1 12 6471 1 1 5 TRP HD1 H -6.227 -1.427 -2.335 1.00 . A A . 5 TRP HD1 1 1 12 6472 1 1 5 TRP HE1 H -8.622 -0.658 -1.811 1.00 . A A . 5 TRP HE1 1 1 12 6473 1 1 5 TRP HE3 H -8.730 -5.824 -3.016 1.00 . A A . 5 TRP HE3 1 1 12 6474 1 1 5 TRP HH2 H -12.451 -3.915 -2.028 1.00 . A A . 5 TRP HH2 1 1 12 6475 1 1 5 TRP HZ2 H -11.264 -1.758 -1.690 1.00 . A A . 5 TRP HZ2 1 1 12 6476 1 1 5 TRP HZ3 H -11.180 -5.933 -2.687 1.00 . A A . 5 TRP HZ3 1 1 12 6477 1 1 5 TRP N N -4.893 -4.179 -0.824 1.00 . A A . 5 TRP N 1 1 12 6478 1 1 5 TRP NE1 N -8.393 -1.578 -2.061 1.00 . A A . 5 TRP NE1 1 1 12 6479 1 1 5 TRP O O -5.307 -7.344 -2.259 1.00 . A A . 5 TRP O 1 1 12 6480 1 1 6 PHE C C -2.384 -7.966 -1.264 1.00 . A A . 6 PHE C 1 1 12 6481 1 1 6 PHE CA C -2.698 -7.346 -2.624 1.00 . A A . 6 PHE CA 1 1 12 6482 1 1 6 PHE CB C -1.360 -6.925 -3.220 1.00 . A A . 6 PHE CB 1 1 12 6483 1 1 6 PHE CD1 C -2.824 -5.771 -4.855 1.00 . A A . 6 PHE CD1 1 1 12 6484 1 1 6 PHE CD2 C -0.624 -4.845 -4.419 1.00 . A A . 6 PHE CD2 1 1 12 6485 1 1 6 PHE CE1 C -3.081 -4.754 -5.760 1.00 . A A . 6 PHE CE1 1 1 12 6486 1 1 6 PHE CE2 C -0.876 -3.825 -5.326 1.00 . A A . 6 PHE CE2 1 1 12 6487 1 1 6 PHE CG C -1.601 -5.812 -4.190 1.00 . A A . 6 PHE CG 1 1 12 6488 1 1 6 PHE CZ C -2.104 -3.782 -5.993 1.00 . A A . 6 PHE CZ 1 1 12 6489 1 1 6 PHE H H -3.011 -5.282 -2.207 1.00 . A A . 6 PHE H 1 1 12 6490 1 1 6 PHE HA H -3.243 -7.985 -3.299 1.00 . A A . 6 PHE HA 1 1 12 6491 1 1 6 PHE HB2 H -0.712 -6.588 -2.428 1.00 . A A . 6 PHE HB2 1 1 12 6492 1 1 6 PHE HB3 H -0.917 -7.760 -3.731 1.00 . A A . 6 PHE HB3 1 1 12 6493 1 1 6 PHE HD1 H -3.573 -6.521 -4.671 1.00 . A A . 6 PHE HD1 1 1 12 6494 1 1 6 PHE HD2 H 0.323 -4.869 -3.911 1.00 . A A . 6 PHE HD2 1 1 12 6495 1 1 6 PHE HE1 H -4.034 -4.741 -6.261 1.00 . A A . 6 PHE HE1 1 1 12 6496 1 1 6 PHE HE2 H -0.110 -3.086 -5.492 1.00 . A A . 6 PHE HE2 1 1 12 6497 1 1 6 PHE HZ H -2.300 -2.995 -6.690 1.00 . A A . 6 PHE HZ 1 1 12 6498 1 1 6 PHE N N -3.488 -6.133 -2.297 1.00 . A A . 6 PHE N 1 1 12 6499 1 1 6 PHE O O -3.210 -7.947 -0.373 1.00 . A A . 6 PHE O 1 1 12 6500 1 1 7 LYS C C -0.478 -7.895 1.106 1.00 . A A . 7 LYS C 1 1 12 6501 1 1 7 LYS CA C -0.931 -9.090 0.266 1.00 . A A . 7 LYS CA 1 1 12 6502 1 1 7 LYS CB C 0.202 -10.115 0.158 1.00 . A A . 7 LYS CB 1 1 12 6503 1 1 7 LYS CD C -0.382 -12.532 0.414 1.00 . A A . 7 LYS CD 1 1 12 6504 1 1 7 LYS CE C -1.036 -13.524 1.378 1.00 . A A . 7 LYS CE 1 1 12 6505 1 1 7 LYS CG C -0.030 -11.245 1.163 1.00 . A A . 7 LYS CG 1 1 12 6506 1 1 7 LYS H H -0.529 -8.528 -1.768 1.00 . A A . 7 LYS H 1 1 12 6507 1 1 7 LYS HA H -1.829 -9.525 0.683 1.00 . A A . 7 LYS HA 1 1 12 6508 1 1 7 LYS HB2 H 0.226 -10.519 -0.843 1.00 . A A . 7 LYS HB2 1 1 12 6509 1 1 7 LYS HB3 H 1.144 -9.635 0.377 1.00 . A A . 7 LYS HB3 1 1 12 6510 1 1 7 LYS HD2 H -1.065 -12.303 -0.391 1.00 . A A . 7 LYS HD2 1 1 12 6511 1 1 7 LYS HD3 H 0.517 -12.971 0.010 1.00 . A A . 7 LYS HD3 1 1 12 6512 1 1 7 LYS HE2 H -1.548 -12.982 2.160 1.00 . A A . 7 LYS HE2 1 1 12 6513 1 1 7 LYS HE3 H -1.745 -14.135 0.840 1.00 . A A . 7 LYS HE3 1 1 12 6514 1 1 7 LYS HG2 H 0.866 -11.397 1.746 1.00 . A A . 7 LYS HG2 1 1 12 6515 1 1 7 LYS HG3 H -0.848 -10.982 1.818 1.00 . A A . 7 LYS HG3 1 1 12 6516 1 1 7 LYS HZ1 H 0.943 -13.937 1.882 1.00 . A A . 7 LYS HZ1 1 1 12 6517 1 1 7 LYS HZ2 H -0.188 -14.534 2.992 1.00 . A A . 7 LYS HZ2 1 1 12 6518 1 1 7 LYS HZ3 H 0.021 -15.313 1.494 1.00 . A A . 7 LYS HZ3 1 1 12 6519 1 1 7 LYS N N -1.214 -8.507 -1.068 1.00 . A A . 7 LYS N 1 1 12 6520 1 1 7 LYS NZ N 0.014 -14.393 1.982 1.00 . A A . 7 LYS NZ 1 1 12 6521 1 1 7 LYS O O 0.097 -6.959 0.587 1.00 . A A . 7 LYS O 1 1 12 6522 1 1 8 GLU C C 1.213 -6.498 3.043 1.00 . A A . 8 GLU C 1 1 12 6523 1 1 8 GLU CA C -0.287 -6.736 3.223 1.00 . A A . 8 GLU CA 1 1 12 6524 1 1 8 GLU CB C -0.607 -7.070 4.682 1.00 . A A . 8 GLU CB 1 1 12 6525 1 1 8 GLU CD C -2.421 -7.213 6.395 1.00 . A A . 8 GLU CD 1 1 12 6526 1 1 8 GLU CG C -2.081 -6.778 4.969 1.00 . A A . 8 GLU CG 1 1 12 6527 1 1 8 GLU H H -1.185 -8.650 2.798 1.00 . A A . 8 GLU H 1 1 12 6528 1 1 8 GLU HA H -0.805 -5.832 2.935 1.00 . A A . 8 GLU HA 1 1 12 6529 1 1 8 GLU HB2 H -0.409 -8.119 4.851 1.00 . A A . 8 GLU HB2 1 1 12 6530 1 1 8 GLU HB3 H 0.012 -6.482 5.341 1.00 . A A . 8 GLU HB3 1 1 12 6531 1 1 8 GLU HG2 H -2.266 -5.720 4.858 1.00 . A A . 8 GLU HG2 1 1 12 6532 1 1 8 GLU HG3 H -2.698 -7.327 4.274 1.00 . A A . 8 GLU HG3 1 1 12 6533 1 1 8 GLU N N -0.720 -7.893 2.385 1.00 . A A . 8 GLU N 1 1 12 6534 1 1 8 GLU O O 1.727 -5.449 3.375 1.00 . A A . 8 GLU O 1 1 12 6535 1 1 8 GLU OE1 O -1.629 -6.941 7.282 1.00 . A A . 8 GLU OE1 1 1 12 6536 1 1 8 GLU OE2 O -3.470 -7.811 6.575 1.00 . A A . 8 GLU OE2 1 1 12 6537 1 1 9 THR C C 3.618 -6.603 0.975 1.00 . A A . 9 THR C 1 1 12 6538 1 1 9 THR CA C 3.383 -7.285 2.321 1.00 . A A . 9 THR CA 1 1 12 6539 1 1 9 THR CB C 3.974 -8.682 2.452 1.00 . A A . 9 THR CB 1 1 12 6540 1 1 9 THR CG2 C 3.579 -9.141 3.856 1.00 . A A . 9 THR CG2 1 1 12 6541 1 1 9 THR H H 1.504 -8.303 2.255 1.00 . A A . 9 THR H 1 1 12 6542 1 1 9 THR HA H 3.768 -6.651 3.105 1.00 . A A . 9 THR HA 1 1 12 6543 1 1 9 THR HB H 5.046 -8.654 2.383 1.00 . A A . 9 THR HB 1 1 12 6544 1 1 9 THR HG1 H 3.120 -10.332 1.870 1.00 . A A . 9 THR HG1 1 1 12 6545 1 1 9 THR HG21 H 2.898 -8.412 4.282 1.00 . A A . 9 THR HG21 1 1 12 6546 1 1 9 THR HG22 H 3.089 -10.102 3.801 1.00 . A A . 9 THR HG22 1 1 12 6547 1 1 9 THR HG23 H 4.459 -9.213 4.477 1.00 . A A . 9 THR HG23 1 1 12 6548 1 1 9 THR N N 1.921 -7.459 2.521 1.00 . A A . 9 THR N 1 1 12 6549 1 1 9 THR O O 4.531 -5.814 0.840 1.00 . A A . 9 THR O 1 1 12 6550 1 1 9 THR OG1 O 3.419 -9.524 1.448 1.00 . A A . 9 THR OG1 1 1 12 6551 1 1 10 ALA C C 3.117 -4.752 -1.015 1.00 . A A . 10 ALA C 1 1 12 6552 1 1 10 ALA CA C 2.980 -6.236 -1.337 1.00 . A A . 10 ALA CA 1 1 12 6553 1 1 10 ALA CB C 1.717 -6.373 -2.197 1.00 . A A . 10 ALA CB 1 1 12 6554 1 1 10 ALA H H 2.074 -7.526 0.148 1.00 . A A . 10 ALA H 1 1 12 6555 1 1 10 ALA HA H 3.864 -6.575 -1.854 1.00 . A A . 10 ALA HA 1 1 12 6556 1 1 10 ALA HB1 H 0.862 -6.090 -1.596 1.00 . A A . 10 ALA HB1 1 1 12 6557 1 1 10 ALA HB2 H 1.767 -5.713 -3.056 1.00 . A A . 10 ALA HB2 1 1 12 6558 1 1 10 ALA HB3 H 1.589 -7.390 -2.533 1.00 . A A . 10 ALA HB3 1 1 12 6559 1 1 10 ALA N N 2.802 -6.890 -0.005 1.00 . A A . 10 ALA N 1 1 12 6560 1 1 10 ALA O O 3.761 -3.990 -1.710 1.00 . A A . 10 ALA O 1 1 12 6561 1 1 11 CYS C C 3.710 -2.678 1.415 1.00 . A A . 11 CYS C 1 1 12 6562 1 1 11 CYS CA C 2.539 -2.942 0.473 1.00 . A A . 11 CYS CA 1 1 12 6563 1 1 11 CYS CB C 1.127 -2.659 0.973 1.00 . A A . 11 CYS CB 1 1 12 6564 1 1 11 CYS H H 1.970 -4.981 0.604 1.00 . A A . 11 CYS H 1 1 12 6565 1 1 11 CYS HA H 2.720 -2.354 -0.412 1.00 . A A . 11 CYS HA 1 1 12 6566 1 1 11 CYS HB2 H 0.810 -3.421 1.680 1.00 . A A . 11 CYS HB2 1 1 12 6567 1 1 11 CYS HB3 H 1.038 -1.666 1.384 1.00 . A A . 11 CYS HB3 1 1 12 6568 1 1 11 CYS N N 2.488 -4.359 0.056 1.00 . A A . 11 CYS N 1 1 12 6569 1 1 11 CYS O O 4.243 -1.589 1.385 1.00 . A A . 11 CYS O 1 1 12 6570 1 1 11 CYS SG S 0.178 -2.747 -0.564 1.00 . A A . 11 CYS SG 1 1 12 6571 1 1 12 ARG C C 6.379 -2.809 2.095 1.00 . A A . 12 ARG C 1 1 12 6572 1 1 12 ARG CA C 5.299 -3.239 3.089 1.00 . A A . 12 ARG CA 1 1 12 6573 1 1 12 ARG CB C 5.842 -4.435 3.866 1.00 . A A . 12 ARG CB 1 1 12 6574 1 1 12 ARG CD C 7.882 -4.936 5.232 1.00 . A A . 12 ARG CD 1 1 12 6575 1 1 12 ARG CG C 7.346 -4.204 4.000 1.00 . A A . 12 ARG CG 1 1 12 6576 1 1 12 ARG CZ C 7.743 -3.199 6.915 1.00 . A A . 12 ARG CZ 1 1 12 6577 1 1 12 ARG H H 3.739 -4.492 2.267 1.00 . A A . 12 ARG H 1 1 12 6578 1 1 12 ARG HA H 5.054 -2.415 3.740 1.00 . A A . 12 ARG HA 1 1 12 6579 1 1 12 ARG HB2 H 5.374 -4.485 4.839 1.00 . A A . 12 ARG HB2 1 1 12 6580 1 1 12 ARG HB3 H 5.674 -5.350 3.317 1.00 . A A . 12 ARG HB3 1 1 12 6581 1 1 12 ARG HD2 H 7.070 -5.444 5.730 1.00 . A A . 12 ARG HD2 1 1 12 6582 1 1 12 ARG HD3 H 8.625 -5.659 4.926 1.00 . A A . 12 ARG HD3 1 1 12 6583 1 1 12 ARG HE H 9.475 -3.869 6.214 1.00 . A A . 12 ARG HE 1 1 12 6584 1 1 12 ARG HG2 H 7.831 -4.570 3.107 1.00 . A A . 12 ARG HG2 1 1 12 6585 1 1 12 ARG HG3 H 7.534 -3.143 4.099 1.00 . A A . 12 ARG HG3 1 1 12 6586 1 1 12 ARG HH11 H 7.000 -4.731 7.968 1.00 . A A . 12 ARG HH11 1 1 12 6587 1 1 12 ARG HH12 H 6.414 -3.164 8.411 1.00 . A A . 12 ARG HH12 1 1 12 6588 1 1 12 ARG HH21 H 8.308 -1.491 6.036 1.00 . A A . 12 ARG HH21 1 1 12 6589 1 1 12 ARG HH22 H 7.153 -1.329 7.317 1.00 . A A . 12 ARG HH22 1 1 12 6590 1 1 12 ARG N N 4.143 -3.602 2.228 1.00 . A A . 12 ARG N 1 1 12 6591 1 1 12 ARG NE N 8.500 -3.952 6.164 1.00 . A A . 12 ARG NE 1 1 12 6592 1 1 12 ARG NH1 N 6.994 -3.740 7.837 1.00 . A A . 12 ARG NH1 1 1 12 6593 1 1 12 ARG NH2 N 7.734 -1.905 6.743 1.00 . A A . 12 ARG NH2 1 1 12 6594 1 1 12 ARG O O 7.225 -1.983 2.374 1.00 . A A . 12 ARG O 1 1 12 6595 1 1 13 HIS C C 7.047 -1.599 -0.526 1.00 . A A . 13 HIS C 1 1 12 6596 1 1 13 HIS CA C 7.319 -3.054 -0.142 1.00 . A A . 13 HIS CA 1 1 12 6597 1 1 13 HIS CB C 7.055 -4.003 -1.316 1.00 . A A . 13 HIS CB 1 1 12 6598 1 1 13 HIS CD2 C 9.214 -3.534 -2.740 1.00 . A A . 13 HIS CD2 1 1 12 6599 1 1 13 HIS CE1 C 8.248 -2.879 -4.566 1.00 . A A . 13 HIS CE1 1 1 12 6600 1 1 13 HIS CG C 7.860 -3.591 -2.519 1.00 . A A . 13 HIS CG 1 1 12 6601 1 1 13 HIS H H 5.646 -4.043 0.715 1.00 . A A . 13 HIS H 1 1 12 6602 1 1 13 HIS HA H 8.328 -3.168 0.228 1.00 . A A . 13 HIS HA 1 1 12 6603 1 1 13 HIS HB2 H 7.334 -5.006 -1.031 1.00 . A A . 13 HIS HB2 1 1 12 6604 1 1 13 HIS HB3 H 6.002 -3.996 -1.566 1.00 . A A . 13 HIS HB3 1 1 12 6605 1 1 13 HIS HD1 H 6.302 -3.095 -3.865 1.00 . A A . 13 HIS HD1 1 1 12 6606 1 1 13 HIS HD2 H 9.975 -3.797 -2.021 1.00 . A A . 13 HIS HD2 1 1 12 6607 1 1 13 HIS HE1 H 8.080 -2.524 -5.572 1.00 . A A . 13 HIS HE1 1 1 12 6608 1 1 13 HIS N N 6.336 -3.382 0.920 1.00 . A A . 13 HIS N 1 1 12 6609 1 1 13 HIS ND1 N 7.265 -3.169 -3.696 1.00 . A A . 13 HIS ND1 1 1 12 6610 1 1 13 HIS NE2 N 9.456 -3.083 -4.037 1.00 . A A . 13 HIS NE2 1 1 12 6611 1 1 13 HIS O O 7.902 -0.746 -0.421 1.00 . A A . 13 HIS O 1 1 12 6612 1 1 14 ALA C C 5.844 1.068 -0.222 1.00 . A A . 14 ALA C 1 1 12 6613 1 1 14 ALA CA C 5.523 0.093 -1.360 1.00 . A A . 14 ALA CA 1 1 12 6614 1 1 14 ALA CB C 4.048 0.173 -1.764 1.00 . A A . 14 ALA CB 1 1 12 6615 1 1 14 ALA H H 5.177 -2.020 -1.042 1.00 . A A . 14 ALA H 1 1 12 6616 1 1 14 ALA HA H 6.140 0.377 -2.203 1.00 . A A . 14 ALA HA 1 1 12 6617 1 1 14 ALA HB1 H 3.827 -0.626 -2.460 1.00 . A A . 14 ALA HB1 1 1 12 6618 1 1 14 ALA HB2 H 3.424 0.074 -0.889 1.00 . A A . 14 ALA HB2 1 1 12 6619 1 1 14 ALA HB3 H 3.860 1.124 -2.243 1.00 . A A . 14 ALA HB3 1 1 12 6620 1 1 14 ALA N N 5.853 -1.311 -0.969 1.00 . A A . 14 ALA N 1 1 12 6621 1 1 14 ALA O O 6.755 1.853 -0.375 1.00 . A A . 14 ALA O 1 1 12 6622 1 1 15 LYS C C 7.039 2.066 2.171 1.00 . A A . 15 LYS C 1 1 12 6623 1 1 15 LYS CA C 5.517 2.037 1.971 1.00 . A A . 15 LYS CA 1 1 12 6624 1 1 15 LYS CB C 4.867 1.570 3.275 1.00 . A A . 15 LYS CB 1 1 12 6625 1 1 15 LYS CD C 5.620 2.078 5.612 1.00 . A A . 15 LYS CD 1 1 12 6626 1 1 15 LYS CE C 5.093 2.915 6.778 1.00 . A A . 15 LYS CE 1 1 12 6627 1 1 15 LYS CG C 5.134 2.670 4.289 1.00 . A A . 15 LYS CG 1 1 12 6628 1 1 15 LYS H H 4.424 0.466 1.066 1.00 . A A . 15 LYS H 1 1 12 6629 1 1 15 LYS HA H 5.130 3.022 1.731 1.00 . A A . 15 LYS HA 1 1 12 6630 1 1 15 LYS HB2 H 3.797 1.452 3.154 1.00 . A A . 15 LYS HB2 1 1 12 6631 1 1 15 LYS HB3 H 5.323 0.660 3.629 1.00 . A A . 15 LYS HB3 1 1 12 6632 1 1 15 LYS HD2 H 5.261 1.063 5.704 1.00 . A A . 15 LYS HD2 1 1 12 6633 1 1 15 LYS HD3 H 6.700 2.082 5.633 1.00 . A A . 15 LYS HD3 1 1 12 6634 1 1 15 LYS HE2 H 5.910 3.457 7.231 1.00 . A A . 15 LYS HE2 1 1 12 6635 1 1 15 LYS HE3 H 4.354 3.614 6.415 1.00 . A A . 15 LYS HE3 1 1 12 6636 1 1 15 LYS HG2 H 5.886 3.315 3.861 1.00 . A A . 15 LYS HG2 1 1 12 6637 1 1 15 LYS HG3 H 4.219 3.220 4.434 1.00 . A A . 15 LYS HG3 1 1 12 6638 1 1 15 LYS HZ1 H 3.796 1.381 7.318 1.00 . A A . 15 LYS HZ1 1 1 12 6639 1 1 15 LYS HZ2 H 5.210 1.455 8.260 1.00 . A A . 15 LYS HZ2 1 1 12 6640 1 1 15 LYS HZ3 H 3.973 2.586 8.504 1.00 . A A . 15 LYS HZ3 1 1 12 6641 1 1 15 LYS N N 5.166 1.074 0.898 1.00 . A A . 15 LYS N 1 1 12 6642 1 1 15 LYS NZ N 4.470 2.016 7.791 1.00 . A A . 15 LYS NZ 1 1 12 6643 1 1 15 LYS O O 7.601 3.124 2.377 1.00 . A A . 15 LYS O 1 1 12 6644 1 1 16 SER C C 10.042 1.096 1.047 1.00 . A A . 16 SER C 1 1 12 6645 1 1 16 SER CA C 9.220 1.003 2.333 1.00 . A A . 16 SER CA 1 1 12 6646 1 1 16 SER CB C 9.659 -0.297 2.975 1.00 . A A . 16 SER CB 1 1 12 6647 1 1 16 SER H H 7.325 0.073 1.970 1.00 . A A . 16 SER H 1 1 12 6648 1 1 16 SER HA H 9.486 1.800 3.000 1.00 . A A . 16 SER HA 1 1 12 6649 1 1 16 SER HB2 H 8.790 -0.823 3.331 1.00 . A A . 16 SER HB2 1 1 12 6650 1 1 16 SER HB3 H 10.119 -0.861 2.176 1.00 . A A . 16 SER HB3 1 1 12 6651 1 1 16 SER HG H 11.228 -0.737 4.037 1.00 . A A . 16 SER HG 1 1 12 6652 1 1 16 SER N N 7.739 0.954 2.128 1.00 . A A . 16 SER N 1 1 12 6653 1 1 16 SER O O 11.106 0.522 0.933 1.00 . A A . 16 SER O 1 1 12 6654 1 1 16 SER OG O 10.561 -0.046 4.042 1.00 . A A . 16 SER OG 1 1 12 6655 1 1 17 LEU C C 10.071 3.295 -1.841 1.00 . A A . 17 LEU C 1 1 12 6656 1 1 17 LEU CA C 10.322 1.938 -1.185 1.00 . A A . 17 LEU CA 1 1 12 6657 1 1 17 LEU CB C 9.958 0.759 -2.089 1.00 . A A . 17 LEU CB 1 1 12 6658 1 1 17 LEU CD1 C 9.469 1.986 -4.246 1.00 . A A . 17 LEU CD1 1 1 12 6659 1 1 17 LEU CD2 C 8.400 -0.221 -3.661 1.00 . A A . 17 LEU CD2 1 1 12 6660 1 1 17 LEU CG C 8.897 1.118 -3.123 1.00 . A A . 17 LEU CG 1 1 12 6661 1 1 17 LEU H H 8.705 2.247 0.240 1.00 . A A . 17 LEU H 1 1 12 6662 1 1 17 LEU HA H 11.371 1.884 -0.951 1.00 . A A . 17 LEU HA 1 1 12 6663 1 1 17 LEU HB2 H 10.831 0.400 -2.608 1.00 . A A . 17 LEU HB2 1 1 12 6664 1 1 17 LEU HB3 H 9.568 -0.036 -1.470 1.00 . A A . 17 LEU HB3 1 1 12 6665 1 1 17 LEU HD11 H 10.516 2.170 -4.058 1.00 . A A . 17 LEU HD11 1 1 12 6666 1 1 17 LEU HD12 H 9.350 1.478 -5.191 1.00 . A A . 17 LEU HD12 1 1 12 6667 1 1 17 LEU HD13 H 8.933 2.923 -4.268 1.00 . A A . 17 LEU HD13 1 1 12 6668 1 1 17 LEU HD21 H 9.213 -0.931 -3.644 1.00 . A A . 17 LEU HD21 1 1 12 6669 1 1 17 LEU HD22 H 7.603 -0.577 -3.025 1.00 . A A . 17 LEU HD22 1 1 12 6670 1 1 17 LEU HD23 H 8.027 -0.118 -4.672 1.00 . A A . 17 LEU HD23 1 1 12 6671 1 1 17 LEU HG H 8.083 1.620 -2.630 1.00 . A A . 17 LEU HG 1 1 12 6672 1 1 17 LEU N N 9.561 1.812 0.087 1.00 . A A . 17 LEU N 1 1 12 6673 1 1 17 LEU O O 10.989 3.965 -2.269 1.00 . A A . 17 LEU O 1 1 12 6674 1 1 18 GLY C C 7.138 5.027 -3.140 1.00 . A A . 18 GLY C 1 1 12 6675 1 1 18 GLY CA C 8.550 5.029 -2.555 1.00 . A A . 18 GLY CA 1 1 12 6676 1 1 18 GLY H H 8.113 3.159 -1.574 1.00 . A A . 18 GLY H 1 1 12 6677 1 1 18 GLY HA2 H 8.634 5.807 -1.811 1.00 . A A . 18 GLY HA2 1 1 12 6678 1 1 18 GLY HA3 H 9.257 5.211 -3.350 1.00 . A A . 18 GLY HA3 1 1 12 6679 1 1 18 GLY N N 8.840 3.711 -1.925 1.00 . A A . 18 GLY N 1 1 12 6680 1 1 18 GLY O O 6.506 6.060 -3.245 1.00 . A A . 18 GLY O 1 1 12 6681 1 1 19 ASN C C 4.212 4.240 -3.059 1.00 . A A . 19 ASN C 1 1 12 6682 1 1 19 ASN CA C 5.263 3.859 -4.097 1.00 . A A . 19 ASN CA 1 1 12 6683 1 1 19 ASN CB C 4.821 2.468 -4.528 1.00 . A A . 19 ASN CB 1 1 12 6684 1 1 19 ASN CG C 5.923 1.415 -4.646 1.00 . A A . 19 ASN CG 1 1 12 6685 1 1 19 ASN H H 7.129 3.052 -3.447 1.00 . A A . 19 ASN H 1 1 12 6686 1 1 19 ASN HA H 5.202 4.517 -4.951 1.00 . A A . 19 ASN HA 1 1 12 6687 1 1 19 ASN HB2 H 4.045 2.119 -3.872 1.00 . A A . 19 ASN HB2 1 1 12 6688 1 1 19 ASN HB3 H 4.363 2.593 -5.482 1.00 . A A . 19 ASN HB3 1 1 12 6689 1 1 19 ASN HD21 H 4.693 0.013 -3.995 1.00 . A A . 19 ASN HD21 1 1 12 6690 1 1 19 ASN HD22 H 6.232 -0.542 -4.363 1.00 . A A . 19 ASN HD22 1 1 12 6691 1 1 19 ASN N N 6.630 3.889 -3.524 1.00 . A A . 19 ASN N 1 1 12 6692 1 1 19 ASN ND2 N 5.600 0.198 -4.307 1.00 . A A . 19 ASN ND2 1 1 12 6693 1 1 19 ASN O O 3.094 4.499 -3.457 1.00 . A A . 19 ASN O 1 1 12 6694 1 1 19 ASN OD1 O 7.037 1.694 -5.039 1.00 . A A . 19 ASN OD1 1 1 12 6695 1 1 20 CYS C C 2.490 5.491 -1.205 1.00 . A A . 20 CYS C 1 1 12 6696 1 1 20 CYS CA C 3.625 4.606 -0.696 1.00 . A A . 20 CYS CA 1 1 12 6697 1 1 20 CYS CB C 4.325 5.385 0.413 1.00 . A A . 20 CYS CB 1 1 12 6698 1 1 20 CYS H H 5.502 4.022 -1.580 1.00 . A A . 20 CYS H 1 1 12 6699 1 1 20 CYS HA H 3.212 3.700 -0.277 1.00 . A A . 20 CYS HA 1 1 12 6700 1 1 20 CYS HB2 H 4.560 4.719 1.231 1.00 . A A . 20 CYS HB2 1 1 12 6701 1 1 20 CYS HB3 H 5.218 5.858 0.037 1.00 . A A . 20 CYS HB3 1 1 12 6702 1 1 20 CYS N N 4.574 4.256 -1.799 1.00 . A A . 20 CYS N 1 1 12 6703 1 1 20 CYS O O 1.327 5.202 -1.029 1.00 . A A . 20 CYS O 1 1 12 6704 1 1 20 CYS SG S 3.188 6.654 1.014 1.00 . A A . 20 CYS SG 1 1 12 6705 1 1 21 ARG C C 2.178 7.948 -3.796 1.00 . A A . 21 ARG C 1 1 12 6706 1 1 21 ARG CA C 1.816 7.506 -2.377 1.00 . A A . 21 ARG CA 1 1 12 6707 1 1 21 ARG CB C 1.864 8.773 -1.545 1.00 . A A . 21 ARG CB 1 1 12 6708 1 1 21 ARG CD C 0.357 10.280 -0.238 1.00 . A A . 21 ARG CD 1 1 12 6709 1 1 21 ARG CG C 0.477 9.414 -1.493 1.00 . A A . 21 ARG CG 1 1 12 6710 1 1 21 ARG CZ C 1.500 12.201 0.699 1.00 . A A . 21 ARG CZ 1 1 12 6711 1 1 21 ARG H H 3.799 6.765 -1.953 1.00 . A A . 21 ARG H 1 1 12 6712 1 1 21 ARG HA H 0.822 7.093 -2.322 1.00 . A A . 21 ARG HA 1 1 12 6713 1 1 21 ARG HB2 H 2.227 8.527 -0.558 1.00 . A A . 21 ARG HB2 1 1 12 6714 1 1 21 ARG HB3 H 2.558 9.428 -2.047 1.00 . A A . 21 ARG HB3 1 1 12 6715 1 1 21 ARG HD2 H -0.640 10.690 -0.177 1.00 . A A . 21 ARG HD2 1 1 12 6716 1 1 21 ARG HD3 H 0.555 9.679 0.637 1.00 . A A . 21 ARG HD3 1 1 12 6717 1 1 21 ARG HE H 1.888 11.511 -1.122 1.00 . A A . 21 ARG HE 1 1 12 6718 1 1 21 ARG HG2 H 0.335 10.025 -2.374 1.00 . A A . 21 ARG HG2 1 1 12 6719 1 1 21 ARG HG3 H -0.274 8.638 -1.464 1.00 . A A . 21 ARG HG3 1 1 12 6720 1 1 21 ARG HH11 H 1.928 10.744 2.002 1.00 . A A . 21 ARG HH11 1 1 12 6721 1 1 21 ARG HH12 H 1.924 12.350 2.649 1.00 . A A . 21 ARG HH12 1 1 12 6722 1 1 21 ARG HH21 H 1.107 13.848 -0.371 1.00 . A A . 21 ARG HH21 1 1 12 6723 1 1 21 ARG HH22 H 1.460 14.109 1.306 1.00 . A A . 21 ARG HH22 1 1 12 6724 1 1 21 ARG N N 2.845 6.571 -1.838 1.00 . A A . 21 ARG N 1 1 12 6725 1 1 21 ARG NE N 1.349 11.390 -0.312 1.00 . A A . 21 ARG NE 1 1 12 6726 1 1 21 ARG NH1 N 1.808 11.729 1.875 1.00 . A A . 21 ARG NH1 1 1 12 6727 1 1 21 ARG NH2 N 1.344 13.486 0.532 1.00 . A A . 21 ARG NH2 1 1 12 6728 1 1 21 ARG O O 1.641 8.907 -4.316 1.00 . A A . 21 ARG O 1 1 12 6729 1 1 22 THR C C 2.954 6.614 -6.801 1.00 . A A . 22 THR C 1 1 12 6730 1 1 22 THR CA C 3.490 7.637 -5.804 1.00 . A A . 22 THR CA 1 1 12 6731 1 1 22 THR CB C 5.017 7.688 -5.893 1.00 . A A . 22 THR CB 1 1 12 6732 1 1 22 THR CG2 C 5.582 8.449 -4.693 1.00 . A A . 22 THR CG2 1 1 12 6733 1 1 22 THR H H 3.496 6.498 -3.975 1.00 . A A . 22 THR H 1 1 12 6734 1 1 22 THR HA H 3.089 8.612 -6.040 1.00 . A A . 22 THR HA 1 1 12 6735 1 1 22 THR HB H 5.311 8.199 -6.798 1.00 . A A . 22 THR HB 1 1 12 6736 1 1 22 THR HG1 H 5.832 6.172 -6.798 1.00 . A A . 22 THR HG1 1 1 12 6737 1 1 22 THR HG21 H 5.030 8.182 -3.805 1.00 . A A . 22 THR HG21 1 1 12 6738 1 1 22 THR HG22 H 6.623 8.192 -4.561 1.00 . A A . 22 THR HG22 1 1 12 6739 1 1 22 THR HG23 H 5.493 9.512 -4.867 1.00 . A A . 22 THR HG23 1 1 12 6740 1 1 22 THR N N 3.085 7.261 -4.422 1.00 . A A . 22 THR N 1 1 12 6741 1 1 22 THR O O 3.151 6.750 -7.993 1.00 . A A . 22 THR O 1 1 12 6742 1 1 22 THR OG1 O 5.529 6.363 -5.908 1.00 . A A . 22 THR OG1 1 1 12 6743 1 1 23 SER C C 0.246 4.709 -7.161 1.00 . A A . 23 SER C 1 1 12 6744 1 1 23 SER CA C 1.760 4.611 -7.331 1.00 . A A . 23 SER CA 1 1 12 6745 1 1 23 SER CB C 2.420 3.277 -6.968 1.00 . A A . 23 SER CB 1 1 12 6746 1 1 23 SER H H 2.095 5.453 -5.392 1.00 . A A . 23 SER H 1 1 12 6747 1 1 23 SER HA H 2.009 4.929 -8.335 1.00 . A A . 23 SER HA 1 1 12 6748 1 1 23 SER HB2 H 2.396 3.121 -5.899 1.00 . A A . 23 SER HB2 1 1 12 6749 1 1 23 SER HB3 H 1.931 2.458 -7.476 1.00 . A A . 23 SER HB3 1 1 12 6750 1 1 23 SER HG H 3.901 2.829 -8.148 1.00 . A A . 23 SER HG 1 1 12 6751 1 1 23 SER N N 2.278 5.594 -6.352 1.00 . A A . 23 SER N 1 1 12 6752 1 1 23 SER O O -0.224 5.000 -6.082 1.00 . A A . 23 SER O 1 1 12 6753 1 1 23 SER OG O 3.785 3.359 -7.355 1.00 . A A . 23 SER OG 1 1 12 6754 1 1 24 GLN C C -2.532 3.465 -7.094 1.00 . A A . 24 GLN C 1 1 12 6755 1 1 24 GLN CA C -2.012 4.619 -7.948 1.00 . A A . 24 GLN CA 1 1 12 6756 1 1 24 GLN CB C -2.758 4.679 -9.282 1.00 . A A . 24 GLN CB 1 1 12 6757 1 1 24 GLN CD C -3.472 6.214 -11.121 1.00 . A A . 24 GLN CD 1 1 12 6758 1 1 24 GLN CG C -3.005 6.138 -9.666 1.00 . A A . 24 GLN CG 1 1 12 6759 1 1 24 GLN H H -0.185 4.270 -9.059 1.00 . A A . 24 GLN H 1 1 12 6760 1 1 24 GLN HA H -2.185 5.536 -7.402 1.00 . A A . 24 GLN HA 1 1 12 6761 1 1 24 GLN HB2 H -2.166 4.197 -10.047 1.00 . A A . 24 GLN HB2 1 1 12 6762 1 1 24 GLN HB3 H -3.707 4.171 -9.188 1.00 . A A . 24 GLN HB3 1 1 12 6763 1 1 24 GLN HE21 H -1.645 6.000 -11.867 1.00 . A A . 24 GLN HE21 1 1 12 6764 1 1 24 GLN HE22 H -2.883 6.165 -13.017 1.00 . A A . 24 GLN HE22 1 1 12 6765 1 1 24 GLN HG2 H -3.763 6.556 -9.019 1.00 . A A . 24 GLN HG2 1 1 12 6766 1 1 24 GLN HG3 H -2.088 6.699 -9.560 1.00 . A A . 24 GLN HG3 1 1 12 6767 1 1 24 GLN N N -0.544 4.496 -8.175 1.00 . A A . 24 GLN N 1 1 12 6768 1 1 24 GLN NE2 N -2.594 6.117 -12.081 1.00 . A A . 24 GLN NE2 1 1 12 6769 1 1 24 GLN O O -2.835 3.662 -5.934 1.00 . A A . 24 GLN O 1 1 12 6770 1 1 24 GLN OE1 O -4.649 6.361 -11.386 1.00 . A A . 24 GLN OE1 1 1 12 6771 1 1 25 LYS C C -2.318 1.184 -5.521 1.00 . A A . 25 LYS C 1 1 12 6772 1 1 25 LYS CA C -3.146 1.160 -6.801 1.00 . A A . 25 LYS CA 1 1 12 6773 1 1 25 LYS CB C -2.888 -0.173 -7.510 1.00 . A A . 25 LYS CB 1 1 12 6774 1 1 25 LYS CD C -4.302 -2.026 -8.402 1.00 . A A . 25 LYS CD 1 1 12 6775 1 1 25 LYS CE C -5.758 -1.829 -8.826 1.00 . A A . 25 LYS CE 1 1 12 6776 1 1 25 LYS CG C -4.000 -1.168 -7.172 1.00 . A A . 25 LYS CG 1 1 12 6777 1 1 25 LYS H H -2.396 2.124 -8.567 1.00 . A A . 25 LYS H 1 1 12 6778 1 1 25 LYS HA H -4.196 1.285 -6.582 1.00 . A A . 25 LYS HA 1 1 12 6779 1 1 25 LYS HB2 H -2.862 -0.010 -8.578 1.00 . A A . 25 LYS HB2 1 1 12 6780 1 1 25 LYS HB3 H -1.941 -0.576 -7.184 1.00 . A A . 25 LYS HB3 1 1 12 6781 1 1 25 LYS HD2 H -3.643 -1.736 -9.207 1.00 . A A . 25 LYS HD2 1 1 12 6782 1 1 25 LYS HD3 H -4.138 -3.066 -8.160 1.00 . A A . 25 LYS HD3 1 1 12 6783 1 1 25 LYS HE2 H -6.407 -2.347 -8.136 1.00 . A A . 25 LYS HE2 1 1 12 6784 1 1 25 LYS HE3 H -5.995 -0.776 -8.821 1.00 . A A . 25 LYS HE3 1 1 12 6785 1 1 25 LYS HG2 H -3.703 -1.808 -6.352 1.00 . A A . 25 LYS HG2 1 1 12 6786 1 1 25 LYS HG3 H -4.887 -0.615 -6.907 1.00 . A A . 25 LYS HG3 1 1 12 6787 1 1 25 LYS HZ1 H -5.063 -2.298 -10.730 1.00 . A A . 25 LYS HZ1 1 1 12 6788 1 1 25 LYS HZ2 H -6.240 -3.373 -10.138 1.00 . A A . 25 LYS HZ2 1 1 12 6789 1 1 25 LYS HZ3 H -6.700 -1.838 -10.684 1.00 . A A . 25 LYS HZ3 1 1 12 6790 1 1 25 LYS N N -2.641 2.281 -7.633 1.00 . A A . 25 LYS N 1 1 12 6791 1 1 25 LYS NZ N -5.955 -2.376 -10.198 1.00 . A A . 25 LYS NZ 1 1 12 6792 1 1 25 LYS O O -2.787 1.427 -4.436 1.00 . A A . 25 LYS O 1 1 12 6793 1 1 26 TYR C C -0.428 1.966 -3.458 1.00 . A A . 26 TYR C 1 1 12 6794 1 1 26 TYR CA C -0.122 0.904 -4.515 1.00 . A A . 26 TYR CA 1 1 12 6795 1 1 26 TYR CB C 1.247 1.135 -5.119 1.00 . A A . 26 TYR CB 1 1 12 6796 1 1 26 TYR CD1 C 1.525 -1.427 -4.972 1.00 . A A . 26 TYR CD1 1 1 12 6797 1 1 26 TYR CD2 C 3.288 -0.008 -5.837 1.00 . A A . 26 TYR CD2 1 1 12 6798 1 1 26 TYR CE1 C 2.336 -2.535 -5.188 1.00 . A A . 26 TYR CE1 1 1 12 6799 1 1 26 TYR CE2 C 4.096 -1.124 -6.050 1.00 . A A . 26 TYR CE2 1 1 12 6800 1 1 26 TYR CG C 2.010 -0.150 -5.302 1.00 . A A . 26 TYR CG 1 1 12 6801 1 1 26 TYR CZ C 3.623 -2.401 -5.725 1.00 . A A . 26 TYR CZ 1 1 12 6802 1 1 26 TYR H H -0.714 0.727 -6.567 1.00 . A A . 26 TYR H 1 1 12 6803 1 1 26 TYR HA H -0.113 -0.062 -4.038 1.00 . A A . 26 TYR HA 1 1 12 6804 1 1 26 TYR HB2 H 1.090 1.574 -6.088 1.00 . A A . 26 TYR HB2 1 1 12 6805 1 1 26 TYR HB3 H 1.812 1.815 -4.497 1.00 . A A . 26 TYR HB3 1 1 12 6806 1 1 26 TYR HD1 H 0.544 -1.615 -4.556 1.00 . A A . 26 TYR HD1 1 1 12 6807 1 1 26 TYR HD2 H 3.655 0.975 -6.089 1.00 . A A . 26 TYR HD2 1 1 12 6808 1 1 26 TYR HE1 H 1.925 -3.488 -4.919 1.00 . A A . 26 TYR HE1 1 1 12 6809 1 1 26 TYR HE2 H 5.080 -0.968 -6.463 1.00 . A A . 26 TYR HE2 1 1 12 6810 1 1 26 TYR HH H 4.639 -3.548 -6.862 1.00 . A A . 26 TYR HH 1 1 12 6811 1 1 26 TYR N N -1.058 0.921 -5.671 1.00 . A A . 26 TYR N 1 1 12 6812 1 1 26 TYR O O -0.441 1.651 -2.293 1.00 . A A . 26 TYR O 1 1 12 6813 1 1 26 TYR OH O 4.413 -3.513 -5.931 1.00 . A A . 26 TYR OH 1 1 12 6814 1 1 27 ARG C C -2.214 3.491 -1.979 1.00 . A A . 27 ARG C 1 1 12 6815 1 1 27 ARG CA C -0.956 4.102 -2.598 1.00 . A A . 27 ARG CA 1 1 12 6816 1 1 27 ARG CB C -1.098 5.538 -3.117 1.00 . A A . 27 ARG CB 1 1 12 6817 1 1 27 ARG CD C -2.734 7.283 -3.816 1.00 . A A . 27 ARG CD 1 1 12 6818 1 1 27 ARG CG C -2.512 5.781 -3.626 1.00 . A A . 27 ARG CG 1 1 12 6819 1 1 27 ARG CZ C -3.592 9.132 -2.508 1.00 . A A . 27 ARG CZ 1 1 12 6820 1 1 27 ARG H H -0.686 3.542 -4.663 1.00 . A A . 27 ARG H 1 1 12 6821 1 1 27 ARG HA H -0.146 3.995 -1.891 1.00 . A A . 27 ARG HA 1 1 12 6822 1 1 27 ARG HB2 H -0.871 6.253 -2.340 1.00 . A A . 27 ARG HB2 1 1 12 6823 1 1 27 ARG HB3 H -0.413 5.673 -3.943 1.00 . A A . 27 ARG HB3 1 1 12 6824 1 1 27 ARG HD2 H -1.796 7.758 -4.063 1.00 . A A . 27 ARG HD2 1 1 12 6825 1 1 27 ARG HD3 H -3.441 7.444 -4.617 1.00 . A A . 27 ARG HD3 1 1 12 6826 1 1 27 ARG HE H -3.379 7.305 -1.761 1.00 . A A . 27 ARG HE 1 1 12 6827 1 1 27 ARG HG2 H -2.584 5.282 -4.581 1.00 . A A . 27 ARG HG2 1 1 12 6828 1 1 27 ARG HG3 H -3.223 5.388 -2.913 1.00 . A A . 27 ARG HG3 1 1 12 6829 1 1 27 ARG HH11 H -1.787 9.772 -3.092 1.00 . A A . 27 ARG HH11 1 1 12 6830 1 1 27 ARG HH12 H -2.957 11.011 -2.782 1.00 . A A . 27 ARG HH12 1 1 12 6831 1 1 27 ARG HH21 H -5.472 8.787 -1.913 1.00 . A A . 27 ARG HH21 1 1 12 6832 1 1 27 ARG HH22 H -5.044 10.454 -2.114 1.00 . A A . 27 ARG HH22 1 1 12 6833 1 1 27 ARG N N -0.677 3.208 -3.749 1.00 . A A . 27 ARG N 1 1 12 6834 1 1 27 ARG NE N -3.269 7.868 -2.555 1.00 . A A . 27 ARG NE 1 1 12 6835 1 1 27 ARG NH1 N -2.710 10.042 -2.818 1.00 . A A . 27 ARG NH1 1 1 12 6836 1 1 27 ARG NH2 N -4.797 9.485 -2.151 1.00 . A A . 27 ARG NH2 1 1 12 6837 1 1 27 ARG O O -2.311 3.288 -0.786 1.00 . A A . 27 ARG O 1 1 12 6838 1 1 28 ALA C C -4.152 1.249 -1.634 1.00 . A A . 28 ALA C 1 1 12 6839 1 1 28 ALA CA C -4.452 2.582 -2.339 1.00 . A A . 28 ALA CA 1 1 12 6840 1 1 28 ALA CB C -5.359 2.321 -3.543 1.00 . A A . 28 ALA CB 1 1 12 6841 1 1 28 ALA H H -3.039 3.375 -3.763 1.00 . A A . 28 ALA H 1 1 12 6842 1 1 28 ALA HA H -4.945 3.254 -1.653 1.00 . A A . 28 ALA HA 1 1 12 6843 1 1 28 ALA HB1 H -5.560 3.252 -4.051 1.00 . A A . 28 ALA HB1 1 1 12 6844 1 1 28 ALA HB2 H -4.870 1.638 -4.223 1.00 . A A . 28 ALA HB2 1 1 12 6845 1 1 28 ALA HB3 H -6.289 1.887 -3.205 1.00 . A A . 28 ALA HB3 1 1 12 6846 1 1 28 ALA N N -3.174 3.192 -2.810 1.00 . A A . 28 ALA N 1 1 12 6847 1 1 28 ALA O O -4.083 1.211 -0.425 1.00 . A A . 28 ALA O 1 1 12 6848 1 1 29 ASN C C -2.552 -1.147 -0.715 1.00 . A A . 29 ASN C 1 1 12 6849 1 1 29 ASN CA C -3.687 -1.168 -1.744 1.00 . A A . 29 ASN CA 1 1 12 6850 1 1 29 ASN CB C -3.378 -2.185 -2.847 1.00 . A A . 29 ASN CB 1 1 12 6851 1 1 29 ASN CG C -2.013 -2.020 -3.501 1.00 . A A . 29 ASN CG 1 1 12 6852 1 1 29 ASN H H -4.046 0.218 -3.326 1.00 . A A . 29 ASN H 1 1 12 6853 1 1 29 ASN HA H -4.586 -1.498 -1.244 1.00 . A A . 29 ASN HA 1 1 12 6854 1 1 29 ASN HB2 H -3.412 -3.187 -2.460 1.00 . A A . 29 ASN HB2 1 1 12 6855 1 1 29 ASN HB3 H -4.127 -2.086 -3.620 1.00 . A A . 29 ASN HB3 1 1 12 6856 1 1 29 ASN HD21 H -2.852 -0.987 -4.932 1.00 . A A . 29 ASN HD21 1 1 12 6857 1 1 29 ASN HD22 H -1.172 -1.187 -5.099 1.00 . A A . 29 ASN HD22 1 1 12 6858 1 1 29 ASN N N -3.980 0.166 -2.353 1.00 . A A . 29 ASN N 1 1 12 6859 1 1 29 ASN ND2 N -2.001 -1.340 -4.605 1.00 . A A . 29 ASN ND2 1 1 12 6860 1 1 29 ASN O O -2.392 -2.075 0.051 1.00 . A A . 29 ASN O 1 1 12 6861 1 1 29 ASN OD1 O -1.007 -2.503 -3.028 1.00 . A A . 29 ASN OD1 1 1 12 6862 1 1 30 CYS C C -0.953 1.193 1.152 1.00 . A A . 30 CYS C 1 1 12 6863 1 1 30 CYS CA C -0.651 -0.040 0.317 1.00 . A A . 30 CYS CA 1 1 12 6864 1 1 30 CYS CB C 0.727 0.129 -0.328 1.00 . A A . 30 CYS CB 1 1 12 6865 1 1 30 CYS H H -1.924 0.623 -1.296 1.00 . A A . 30 CYS H 1 1 12 6866 1 1 30 CYS HA H -0.693 -0.919 0.947 1.00 . A A . 30 CYS HA 1 1 12 6867 1 1 30 CYS HB2 H 0.844 1.111 -0.756 1.00 . A A . 30 CYS HB2 1 1 12 6868 1 1 30 CYS HB3 H 1.493 -0.029 0.418 1.00 . A A . 30 CYS HB3 1 1 12 6869 1 1 30 CYS N N -1.767 -0.110 -0.672 1.00 . A A . 30 CYS N 1 1 12 6870 1 1 30 CYS O O -0.104 1.990 1.499 1.00 . A A . 30 CYS O 1 1 12 6871 1 1 30 CYS SG S 0.874 -1.150 -1.592 1.00 . A A . 30 CYS SG 1 1 12 6872 1 1 31 ALA C C -2.621 2.054 3.744 1.00 . A A . 31 ALA C 1 1 12 6873 1 1 31 ALA CA C -2.684 2.454 2.265 1.00 . A A . 31 ALA CA 1 1 12 6874 1 1 31 ALA CB C -4.118 2.792 1.850 1.00 . A A . 31 ALA CB 1 1 12 6875 1 1 31 ALA H H -2.843 0.632 1.145 1.00 . A A . 31 ALA H 1 1 12 6876 1 1 31 ALA HA H -2.020 3.278 2.045 1.00 . A A . 31 ALA HA 1 1 12 6877 1 1 31 ALA HB1 H -4.636 1.882 1.584 1.00 . A A . 31 ALA HB1 1 1 12 6878 1 1 31 ALA HB2 H -4.629 3.268 2.672 1.00 . A A . 31 ALA HB2 1 1 12 6879 1 1 31 ALA HB3 H -4.105 3.456 0.999 1.00 . A A . 31 ALA HB3 1 1 12 6880 1 1 31 ALA N N -2.210 1.308 1.455 1.00 . A A . 31 ALA N 1 1 12 6881 1 1 31 ALA O O -2.804 2.864 4.630 1.00 . A A . 31 ALA O 1 1 12 6882 1 1 32 LYS C C -0.813 0.546 5.813 1.00 . A A . 32 LYS C 1 1 12 6883 1 1 32 LYS CA C -2.266 0.297 5.407 1.00 . A A . 32 LYS CA 1 1 12 6884 1 1 32 LYS CB C -2.512 -1.213 5.349 1.00 . A A . 32 LYS CB 1 1 12 6885 1 1 32 LYS CD C -1.563 -3.482 4.833 1.00 . A A . 32 LYS CD 1 1 12 6886 1 1 32 LYS CE C -0.541 -4.240 5.691 1.00 . A A . 32 LYS CE 1 1 12 6887 1 1 32 LYS CG C -1.300 -1.973 4.796 1.00 . A A . 32 LYS CG 1 1 12 6888 1 1 32 LYS H H -2.212 0.159 3.290 1.00 . A A . 32 LYS H 1 1 12 6889 1 1 32 LYS HA H -2.981 0.785 6.053 1.00 . A A . 32 LYS HA 1 1 12 6890 1 1 32 LYS HB2 H -2.732 -1.592 6.333 1.00 . A A . 32 LYS HB2 1 1 12 6891 1 1 32 LYS HB3 H -3.352 -1.373 4.692 1.00 . A A . 32 LYS HB3 1 1 12 6892 1 1 32 LYS HD2 H -2.549 -3.656 5.235 1.00 . A A . 32 LYS HD2 1 1 12 6893 1 1 32 LYS HD3 H -1.529 -3.863 3.822 1.00 . A A . 32 LYS HD3 1 1 12 6894 1 1 32 LYS HE2 H -1.051 -5.057 6.173 1.00 . A A . 32 LYS HE2 1 1 12 6895 1 1 32 LYS HE3 H 0.247 -4.644 5.067 1.00 . A A . 32 LYS HE3 1 1 12 6896 1 1 32 LYS HG2 H -1.128 -1.663 3.776 1.00 . A A . 32 LYS HG2 1 1 12 6897 1 1 32 LYS HG3 H -0.430 -1.746 5.389 1.00 . A A . 32 LYS HG3 1 1 12 6898 1 1 32 LYS HZ1 H -0.689 -2.761 7.153 1.00 . A A . 32 LYS HZ1 1 1 12 6899 1 1 32 LYS HZ2 H 0.439 -3.973 7.511 1.00 . A A . 32 LYS HZ2 1 1 12 6900 1 1 32 LYS HZ3 H 0.806 -2.793 6.342 1.00 . A A . 32 LYS HZ3 1 1 12 6901 1 1 32 LYS N N -2.358 0.802 4.012 1.00 . A A . 32 LYS N 1 1 12 6902 1 1 32 LYS NZ N 0.049 -3.377 6.755 1.00 . A A . 32 LYS NZ 1 1 12 6903 1 1 32 LYS O O -0.485 0.915 6.923 1.00 . A A . 32 LYS O 1 1 12 6904 1 1 33 THR C C 1.893 1.969 5.034 1.00 . A A . 33 THR C 1 1 12 6905 1 1 33 THR CA C 1.505 0.494 4.994 1.00 . A A . 33 THR CA 1 1 12 6906 1 1 33 THR CB C 2.142 -0.221 3.804 1.00 . A A . 33 THR CB 1 1 12 6907 1 1 33 THR CG2 C 3.527 -0.720 4.201 1.00 . A A . 33 THR CG2 1 1 12 6908 1 1 33 THR H H -0.319 0.025 3.989 1.00 . A A . 33 THR H 1 1 12 6909 1 1 33 THR HA H 1.856 0.035 5.899 1.00 . A A . 33 THR HA 1 1 12 6910 1 1 33 THR HB H 2.235 0.454 2.969 1.00 . A A . 33 THR HB 1 1 12 6911 1 1 33 THR HG1 H 1.784 -2.127 3.676 1.00 . A A . 33 THR HG1 1 1 12 6912 1 1 33 THR HG21 H 3.966 -0.039 4.915 1.00 . A A . 33 THR HG21 1 1 12 6913 1 1 33 THR HG22 H 3.443 -1.702 4.641 1.00 . A A . 33 THR HG22 1 1 12 6914 1 1 33 THR HG23 H 4.152 -0.770 3.321 1.00 . A A . 33 THR HG23 1 1 12 6915 1 1 33 THR N N 0.036 0.324 4.851 1.00 . A A . 33 THR N 1 1 12 6916 1 1 33 THR O O 2.807 2.358 5.733 1.00 . A A . 33 THR O 1 1 12 6917 1 1 33 THR OG1 O 1.321 -1.321 3.441 1.00 . A A . 33 THR OG1 1 1 12 6918 1 1 34 CYS C C 0.475 5.027 5.051 1.00 . A A . 34 CYS C 1 1 12 6919 1 1 34 CYS CA C 1.562 4.239 4.319 1.00 . A A . 34 CYS CA 1 1 12 6920 1 1 34 CYS CB C 1.643 4.790 2.901 1.00 . A A . 34 CYS CB 1 1 12 6921 1 1 34 CYS H H 0.473 2.470 3.743 1.00 . A A . 34 CYS H 1 1 12 6922 1 1 34 CYS HA H 2.520 4.367 4.803 1.00 . A A . 34 CYS HA 1 1 12 6923 1 1 34 CYS HB2 H 1.855 3.998 2.200 1.00 . A A . 34 CYS HB2 1 1 12 6924 1 1 34 CYS HB3 H 0.691 5.217 2.648 1.00 . A A . 34 CYS HB3 1 1 12 6925 1 1 34 CYS N N 1.209 2.795 4.299 1.00 . A A . 34 CYS N 1 1 12 6926 1 1 34 CYS O O 0.599 6.215 5.270 1.00 . A A . 34 CYS O 1 1 12 6927 1 1 34 CYS SG S 2.905 6.088 2.931 1.00 . A A . 34 CYS SG 1 1 12 6928 1 1 35 GLU C C -2.450 6.044 5.247 1.00 . A A . 35 GLU C 1 1 12 6929 1 1 35 GLU CA C -1.692 5.065 6.140 1.00 . A A . 35 GLU CA 1 1 12 6930 1 1 35 GLU CB C -1.132 5.694 7.410 1.00 . A A . 35 GLU CB 1 1 12 6931 1 1 35 GLU CD C 0.060 4.876 9.468 1.00 . A A . 35 GLU CD 1 1 12 6932 1 1 35 GLU CG C -0.762 4.472 8.243 1.00 . A A . 35 GLU CG 1 1 12 6933 1 1 35 GLU H H -0.670 3.412 5.238 1.00 . A A . 35 GLU H 1 1 12 6934 1 1 35 GLU HA H -2.401 4.301 6.430 1.00 . A A . 35 GLU HA 1 1 12 6935 1 1 35 GLU HB2 H -0.268 6.304 7.184 1.00 . A A . 35 GLU HB2 1 1 12 6936 1 1 35 GLU HB3 H -1.886 6.258 7.935 1.00 . A A . 35 GLU HB3 1 1 12 6937 1 1 35 GLU HG2 H -1.679 3.981 8.538 1.00 . A A . 35 GLU HG2 1 1 12 6938 1 1 35 GLU HG3 H -0.192 3.800 7.615 1.00 . A A . 35 GLU HG3 1 1 12 6939 1 1 35 GLU N N -0.589 4.371 5.425 1.00 . A A . 35 GLU N 1 1 12 6940 1 1 35 GLU O O -2.866 7.118 5.633 1.00 . A A . 35 GLU O 1 1 12 6941 1 1 35 GLU OE1 O -0.506 5.480 10.365 1.00 . A A . 35 GLU OE1 1 1 12 6942 1 1 35 GLU OE2 O 1.242 4.575 9.490 1.00 . A A . 35 GLU OE2 1 1 12 6943 1 1 36 LEU C C -4.812 6.031 3.211 1.00 . A A . 36 LEU C 1 1 12 6944 1 1 36 LEU CA C -3.339 6.376 2.987 1.00 . A A . 36 LEU CA 1 1 12 6945 1 1 36 LEU CB C -2.928 5.886 1.596 1.00 . A A . 36 LEU CB 1 1 12 6946 1 1 36 LEU CD1 C -0.983 5.644 0.014 1.00 . A A . 36 LEU CD1 1 1 12 6947 1 1 36 LEU CD2 C -1.437 7.838 1.118 1.00 . A A . 36 LEU CD2 1 1 12 6948 1 1 36 LEU CG C -1.498 6.319 1.290 1.00 . A A . 36 LEU CG 1 1 12 6949 1 1 36 LEU H H -2.256 4.726 3.820 1.00 . A A . 36 LEU H 1 1 12 6950 1 1 36 LEU HA H -3.167 7.432 3.100 1.00 . A A . 36 LEU HA 1 1 12 6951 1 1 36 LEU HB2 H -2.985 4.821 1.615 1.00 . A A . 36 LEU HB2 1 1 12 6952 1 1 36 LEU HB3 H -3.588 6.234 0.820 1.00 . A A . 36 LEU HB3 1 1 12 6953 1 1 36 LEU HD11 H -1.811 5.341 -0.609 1.00 . A A . 36 LEU HD11 1 1 12 6954 1 1 36 LEU HD12 H -0.369 6.342 -0.537 1.00 . A A . 36 LEU HD12 1 1 12 6955 1 1 36 LEU HD13 H -0.388 4.779 0.268 1.00 . A A . 36 LEU HD13 1 1 12 6956 1 1 36 LEU HD21 H -2.440 8.237 1.071 1.00 . A A . 36 LEU HD21 1 1 12 6957 1 1 36 LEU HD22 H -0.912 8.274 1.954 1.00 . A A . 36 LEU HD22 1 1 12 6958 1 1 36 LEU HD23 H -0.914 8.072 0.203 1.00 . A A . 36 LEU HD23 1 1 12 6959 1 1 36 LEU HG H -0.896 6.029 2.133 1.00 . A A . 36 LEU HG 1 1 12 6960 1 1 36 LEU N N -2.617 5.606 4.033 1.00 . A A . 36 LEU N 1 1 12 6961 1 1 36 LEU O O -5.694 6.701 2.711 1.00 . A A . 36 LEU O 1 1 12 6962 1 1 37 CYS C C -7.032 5.365 5.432 1.00 . A A . 37 CYS C 1 1 12 6963 1 1 37 CYS CA C -6.523 4.634 4.189 1.00 . A A . 37 CYS CA 1 1 12 6964 1 1 37 CYS CB C -6.643 3.122 4.397 1.00 . A A . 37 CYS CB 1 1 12 6965 1 1 37 CYS H H -4.396 4.430 4.371 1.00 . A A . 37 CYS H 1 1 12 6966 1 1 37 CYS HA H -7.108 4.927 3.330 1.00 . A A . 37 CYS HA 1 1 12 6967 1 1 37 CYS HB2 H -6.264 2.608 3.526 1.00 . A A . 37 CYS HB2 1 1 12 6968 1 1 37 CYS HB3 H -6.069 2.832 5.265 1.00 . A A . 37 CYS HB3 1 1 12 6969 1 1 37 CYS N N -5.096 4.988 3.957 1.00 . A A . 37 CYS N 1 1 12 6970 1 1 37 CYS O O -6.314 5.388 6.417 1.00 . A A . 37 CYS O 1 1 12 6971 1 1 37 CYS OXT O -8.133 5.890 5.378 1.00 . A A . 37 CYS OXT 1 1 12 6972 1 1 37 CYS SG S -8.381 2.688 4.648 1.00 . A A . 37 CYS SG 1 1 13 6973 1 1 1 VAL C C -12.599 0.252 2.365 1.00 . A A . 1 VAL C 1 1 13 6974 1 1 1 VAL CA C -13.992 0.233 2.998 1.00 . A A . 1 VAL CA 1 1 13 6975 1 1 1 VAL CB C -14.160 -1.043 3.824 1.00 . A A . 1 VAL CB 1 1 13 6976 1 1 1 VAL CG1 C -12.960 -1.213 4.758 1.00 . A A . 1 VAL CG1 1 1 13 6977 1 1 1 VAL CG2 C -15.438 -0.941 4.659 1.00 . A A . 1 VAL CG2 1 1 13 6978 1 1 1 VAL H1 H -14.687 0.859 1.136 1.00 . A A . 1 VAL H1 1 1 13 6979 1 1 1 VAL H2 H -15.204 -0.692 1.578 1.00 . A A . 1 VAL H2 1 1 13 6980 1 1 1 VAL H3 H -15.905 0.675 2.308 1.00 . A A . 1 VAL H3 1 1 13 6981 1 1 1 VAL HA H -14.107 1.094 3.639 1.00 . A A . 1 VAL HA 1 1 13 6982 1 1 1 VAL HB H -14.222 -1.895 3.161 1.00 . A A . 1 VAL HB 1 1 13 6983 1 1 1 VAL HG11 H -12.628 -0.243 5.095 1.00 . A A . 1 VAL HG11 1 1 13 6984 1 1 1 VAL HG12 H -13.250 -1.810 5.610 1.00 . A A . 1 VAL HG12 1 1 13 6985 1 1 1 VAL HG13 H -12.158 -1.706 4.228 1.00 . A A . 1 VAL HG13 1 1 13 6986 1 1 1 VAL HG21 H -15.543 0.066 5.034 1.00 . A A . 1 VAL HG21 1 1 13 6987 1 1 1 VAL HG22 H -16.292 -1.187 4.044 1.00 . A A . 1 VAL HG22 1 1 13 6988 1 1 1 VAL HG23 H -15.382 -1.630 5.489 1.00 . A A . 1 VAL HG23 1 1 13 6989 1 1 1 VAL N N -15.025 0.271 1.925 1.00 . A A . 1 VAL N 1 1 13 6990 1 1 1 VAL O O -12.297 -0.523 1.480 1.00 . A A . 1 VAL O 1 1 13 6991 1 1 2 CYS C C -9.442 0.296 3.049 1.00 . A A . 2 CYS C 1 1 13 6992 1 1 2 CYS CA C -10.373 1.204 2.238 1.00 . A A . 2 CYS CA 1 1 13 6993 1 1 2 CYS CB C -9.891 2.655 2.290 1.00 . A A . 2 CYS CB 1 1 13 6994 1 1 2 CYS H H -12.010 1.750 3.528 1.00 . A A . 2 CYS H 1 1 13 6995 1 1 2 CYS HA H -10.405 0.867 1.212 1.00 . A A . 2 CYS HA 1 1 13 6996 1 1 2 CYS HB2 H -10.706 3.310 2.020 1.00 . A A . 2 CYS HB2 1 1 13 6997 1 1 2 CYS HB3 H -9.564 2.887 3.291 1.00 . A A . 2 CYS HB3 1 1 13 6998 1 1 2 CYS N N -11.746 1.133 2.813 1.00 . A A . 2 CYS N 1 1 13 6999 1 1 2 CYS O O -9.836 -0.232 4.069 1.00 . A A . 2 CYS O 1 1 13 7000 1 1 2 CYS SG S -8.521 2.891 1.131 1.00 . A A . 2 CYS SG 1 1 13 7001 1 1 3 ARG C C -6.221 -1.221 2.315 1.00 . A A . 3 ARG C 1 1 13 7002 1 1 3 ARG CA C -7.256 -0.758 3.340 1.00 . A A . 3 ARG CA 1 1 13 7003 1 1 3 ARG CB C -7.968 -1.988 3.909 1.00 . A A . 3 ARG CB 1 1 13 7004 1 1 3 ARG CD C -8.870 -4.033 2.777 1.00 . A A . 3 ARG CD 1 1 13 7005 1 1 3 ARG CG C -8.981 -2.510 2.887 1.00 . A A . 3 ARG CG 1 1 13 7006 1 1 3 ARG CZ C -9.419 -4.711 5.037 1.00 . A A . 3 ARG CZ 1 1 13 7007 1 1 3 ARG H H -7.921 0.544 1.787 1.00 . A A . 3 ARG H 1 1 13 7008 1 1 3 ARG HA H -6.775 -0.197 4.128 1.00 . A A . 3 ARG HA 1 1 13 7009 1 1 3 ARG HB2 H -7.241 -2.756 4.125 1.00 . A A . 3 ARG HB2 1 1 13 7010 1 1 3 ARG HB3 H -8.489 -1.718 4.816 1.00 . A A . 3 ARG HB3 1 1 13 7011 1 1 3 ARG HD2 H -9.816 -4.441 2.455 1.00 . A A . 3 ARG HD2 1 1 13 7012 1 1 3 ARG HD3 H -8.106 -4.289 2.058 1.00 . A A . 3 ARG HD3 1 1 13 7013 1 1 3 ARG HE H -7.592 -4.896 4.282 1.00 . A A . 3 ARG HE 1 1 13 7014 1 1 3 ARG HG2 H -9.979 -2.243 3.204 1.00 . A A . 3 ARG HG2 1 1 13 7015 1 1 3 ARG HG3 H -8.779 -2.070 1.923 1.00 . A A . 3 ARG HG3 1 1 13 7016 1 1 3 ARG HH11 H -10.338 -6.267 4.174 1.00 . A A . 3 ARG HH11 1 1 13 7017 1 1 3 ARG HH12 H -11.029 -5.722 5.665 1.00 . A A . 3 ARG HH12 1 1 13 7018 1 1 3 ARG HH21 H -8.713 -3.182 6.119 1.00 . A A . 3 ARG HH21 1 1 13 7019 1 1 3 ARG HH22 H -10.110 -3.975 6.767 1.00 . A A . 3 ARG HH22 1 1 13 7020 1 1 3 ARG N N -8.223 0.111 2.612 1.00 . A A . 3 ARG N 1 1 13 7021 1 1 3 ARG NE N -8.511 -4.602 4.107 1.00 . A A . 3 ARG NE 1 1 13 7022 1 1 3 ARG NH1 N -10.334 -5.638 4.952 1.00 . A A . 3 ARG NH1 1 1 13 7023 1 1 3 ARG NH2 N -9.414 -3.892 6.054 1.00 . A A . 3 ARG NH2 1 1 13 7024 1 1 3 ARG O O -6.154 -0.699 1.221 1.00 . A A . 3 ARG O 1 1 13 7025 1 1 4 ASP C C -5.130 -3.534 0.634 1.00 . A A . 4 ASP C 1 1 13 7026 1 1 4 ASP CA C -4.404 -2.650 1.650 1.00 . A A . 4 ASP CA 1 1 13 7027 1 1 4 ASP CB C -3.316 -3.455 2.360 1.00 . A A . 4 ASP CB 1 1 13 7028 1 1 4 ASP CG C -3.914 -4.782 2.831 1.00 . A A . 4 ASP CG 1 1 13 7029 1 1 4 ASP H H -5.471 -2.611 3.526 1.00 . A A . 4 ASP H 1 1 13 7030 1 1 4 ASP HA H -3.982 -1.792 1.150 1.00 . A A . 4 ASP HA 1 1 13 7031 1 1 4 ASP HB2 H -2.502 -3.643 1.674 1.00 . A A . 4 ASP HB2 1 1 13 7032 1 1 4 ASP HB3 H -2.949 -2.908 3.218 1.00 . A A . 4 ASP HB3 1 1 13 7033 1 1 4 ASP N N -5.413 -2.191 2.642 1.00 . A A . 4 ASP N 1 1 13 7034 1 1 4 ASP O O -6.342 -3.622 0.665 1.00 . A A . 4 ASP O 1 1 13 7035 1 1 4 ASP OD1 O -4.136 -5.641 1.994 1.00 . A A . 4 ASP OD1 1 1 13 7036 1 1 4 ASP OD2 O -4.140 -4.918 4.023 1.00 . A A . 4 ASP OD2 1 1 13 7037 1 1 5 TRP C C -4.375 -6.197 -1.714 1.00 . A A . 5 TRP C 1 1 13 7038 1 1 5 TRP CA C -5.235 -5.035 -1.216 1.00 . A A . 5 TRP CA 1 1 13 7039 1 1 5 TRP CB C -5.731 -4.178 -2.380 1.00 . A A . 5 TRP CB 1 1 13 7040 1 1 5 TRP CD1 C -7.510 -2.453 -1.871 1.00 . A A . 5 TRP CD1 1 1 13 7041 1 1 5 TRP CD2 C -8.313 -4.551 -1.866 1.00 . A A . 5 TRP CD2 1 1 13 7042 1 1 5 TRP CE2 C -9.405 -3.696 -1.570 1.00 . A A . 5 TRP CE2 1 1 13 7043 1 1 5 TRP CE3 C -8.548 -5.933 -1.925 1.00 . A A . 5 TRP CE3 1 1 13 7044 1 1 5 TRP CG C -7.121 -3.733 -2.054 1.00 . A A . 5 TRP CG 1 1 13 7045 1 1 5 TRP CH2 C -10.900 -5.586 -1.403 1.00 . A A . 5 TRP CH2 1 1 13 7046 1 1 5 TRP CZ2 C -10.688 -4.203 -1.340 1.00 . A A . 5 TRP CZ2 1 1 13 7047 1 1 5 TRP CZ3 C -9.833 -6.445 -1.695 1.00 . A A . 5 TRP CZ3 1 1 13 7048 1 1 5 TRP H H -3.471 -4.153 -0.324 1.00 . A A . 5 TRP H 1 1 13 7049 1 1 5 TRP HA H -6.093 -5.440 -0.685 1.00 . A A . 5 TRP HA 1 1 13 7050 1 1 5 TRP HB2 H -5.088 -3.320 -2.498 1.00 . A A . 5 TRP HB2 1 1 13 7051 1 1 5 TRP HB3 H -5.745 -4.760 -3.289 1.00 . A A . 5 TRP HB3 1 1 13 7052 1 1 5 TRP HD1 H -6.867 -1.590 -1.937 1.00 . A A . 5 TRP HD1 1 1 13 7053 1 1 5 TRP HE1 H -9.388 -1.619 -1.411 1.00 . A A . 5 TRP HE1 1 1 13 7054 1 1 5 TRP HE3 H -7.732 -6.602 -2.148 1.00 . A A . 5 TRP HE3 1 1 13 7055 1 1 5 TRP HH2 H -11.886 -5.989 -1.227 1.00 . A A . 5 TRP HH2 1 1 13 7056 1 1 5 TRP HZ2 H -11.506 -3.536 -1.115 1.00 . A A . 5 TRP HZ2 1 1 13 7057 1 1 5 TRP HZ3 H -10.001 -7.510 -1.742 1.00 . A A . 5 TRP HZ3 1 1 13 7058 1 1 5 TRP N N -4.454 -4.197 -0.266 1.00 . A A . 5 TRP N 1 1 13 7059 1 1 5 TRP NE1 N -8.862 -2.427 -1.585 1.00 . A A . 5 TRP NE1 1 1 13 7060 1 1 5 TRP O O -4.886 -7.277 -1.932 1.00 . A A . 5 TRP O 1 1 13 7061 1 1 6 PHE C C -1.979 -7.936 -1.081 1.00 . A A . 6 PHE C 1 1 13 7062 1 1 6 PHE CA C -2.320 -7.209 -2.378 1.00 . A A . 6 PHE CA 1 1 13 7063 1 1 6 PHE CB C -0.976 -6.746 -2.926 1.00 . A A . 6 PHE CB 1 1 13 7064 1 1 6 PHE CD1 C -2.384 -5.506 -4.566 1.00 . A A . 6 PHE CD1 1 1 13 7065 1 1 6 PHE CD2 C -0.172 -4.674 -4.016 1.00 . A A . 6 PHE CD2 1 1 13 7066 1 1 6 PHE CE1 C -2.566 -4.443 -5.437 1.00 . A A . 6 PHE CE1 1 1 13 7067 1 1 6 PHE CE2 C -0.350 -3.611 -4.884 1.00 . A A . 6 PHE CE2 1 1 13 7068 1 1 6 PHE CG C -1.188 -5.609 -3.865 1.00 . A A . 6 PHE CG 1 1 13 7069 1 1 6 PHE CZ C -1.548 -3.495 -5.596 1.00 . A A . 6 PHE CZ 1 1 13 7070 1 1 6 PHE H H -2.609 -5.196 -1.743 1.00 . A A . 6 PHE H 1 1 13 7071 1 1 6 PHE HA H -2.888 -7.763 -3.111 1.00 . A A . 6 PHE HA 1 1 13 7072 1 1 6 PHE HB2 H -0.346 -6.400 -2.123 1.00 . A A . 6 PHE HB2 1 1 13 7073 1 1 6 PHE HB3 H -0.500 -7.550 -3.455 1.00 . A A . 6 PHE HB3 1 1 13 7074 1 1 6 PHE HD1 H -3.165 -6.235 -4.443 1.00 . A A . 6 PHE HD1 1 1 13 7075 1 1 6 PHE HD2 H 0.751 -4.759 -3.471 1.00 . A A . 6 PHE HD2 1 1 13 7076 1 1 6 PHE HE1 H -3.498 -4.382 -5.968 1.00 . A A . 6 PHE HE1 1 1 13 7077 1 1 6 PHE HE2 H 0.455 -2.907 -4.976 1.00 . A A . 6 PHE HE2 1 1 13 7078 1 1 6 PHE HZ H -1.689 -2.675 -6.268 1.00 . A A . 6 PHE HZ 1 1 13 7079 1 1 6 PHE N N -3.089 -6.037 -1.900 1.00 . A A . 6 PHE N 1 1 13 7080 1 1 6 PHE O O -2.753 -7.920 -0.145 1.00 . A A . 6 PHE O 1 1 13 7081 1 1 7 LYS C C -0.255 -8.056 1.224 1.00 . A A . 7 LYS C 1 1 13 7082 1 1 7 LYS CA C -0.559 -9.238 0.303 1.00 . A A . 7 LYS CA 1 1 13 7083 1 1 7 LYS CB C 0.676 -10.133 0.173 1.00 . A A . 7 LYS CB 1 1 13 7084 1 1 7 LYS CD C -0.206 -11.901 1.706 1.00 . A A . 7 LYS CD 1 1 13 7085 1 1 7 LYS CE C 0.737 -12.919 2.351 1.00 . A A . 7 LYS CE 1 1 13 7086 1 1 7 LYS CG C 0.260 -11.601 0.280 1.00 . A A . 7 LYS CG 1 1 13 7087 1 1 7 LYS H H -0.197 -8.582 -1.723 1.00 . A A . 7 LYS H 1 1 13 7088 1 1 7 LYS HA H -1.431 -9.775 0.651 1.00 . A A . 7 LYS HA 1 1 13 7089 1 1 7 LYS HB2 H 1.146 -9.958 -0.783 1.00 . A A . 7 LYS HB2 1 1 13 7090 1 1 7 LYS HB3 H 1.373 -9.904 0.966 1.00 . A A . 7 LYS HB3 1 1 13 7091 1 1 7 LYS HD2 H -0.204 -10.987 2.283 1.00 . A A . 7 LYS HD2 1 1 13 7092 1 1 7 LYS HD3 H -1.205 -12.310 1.681 1.00 . A A . 7 LYS HD3 1 1 13 7093 1 1 7 LYS HE2 H 0.916 -13.730 1.660 1.00 . A A . 7 LYS HE2 1 1 13 7094 1 1 7 LYS HE3 H 1.673 -12.438 2.592 1.00 . A A . 7 LYS HE3 1 1 13 7095 1 1 7 LYS HG2 H -0.545 -11.797 -0.413 1.00 . A A . 7 LYS HG2 1 1 13 7096 1 1 7 LYS HG3 H 1.102 -12.233 0.043 1.00 . A A . 7 LYS HG3 1 1 13 7097 1 1 7 LYS HZ1 H -0.872 -13.133 3.657 1.00 . A A . 7 LYS HZ1 1 1 13 7098 1 1 7 LYS HZ2 H 0.146 -14.493 3.576 1.00 . A A . 7 LYS HZ2 1 1 13 7099 1 1 7 LYS HZ3 H 0.638 -13.104 4.423 1.00 . A A . 7 LYS HZ3 1 1 13 7100 1 1 7 LYS N N -0.842 -8.563 -0.986 1.00 . A A . 7 LYS N 1 1 13 7101 1 1 7 LYS NZ N 0.115 -13.453 3.595 1.00 . A A . 7 LYS NZ 1 1 13 7102 1 1 7 LYS O O 0.288 -7.064 0.779 1.00 . A A . 7 LYS O 1 1 13 7103 1 1 8 GLU C C 1.218 -6.587 3.229 1.00 . A A . 8 GLU C 1 1 13 7104 1 1 8 GLU CA C -0.265 -6.931 3.352 1.00 . A A . 8 GLU CA 1 1 13 7105 1 1 8 GLU CB C -0.627 -7.271 4.799 1.00 . A A . 8 GLU CB 1 1 13 7106 1 1 8 GLU CD C -2.941 -7.877 5.525 1.00 . A A . 8 GLU CD 1 1 13 7107 1 1 8 GLU CG C -2.015 -6.723 5.135 1.00 . A A . 8 GLU CG 1 1 13 7108 1 1 8 GLU H H -1.016 -8.897 2.857 1.00 . A A . 8 GLU H 1 1 13 7109 1 1 8 GLU HA H -0.815 -6.059 3.029 1.00 . A A . 8 GLU HA 1 1 13 7110 1 1 8 GLU HB2 H -0.628 -8.346 4.916 1.00 . A A . 8 GLU HB2 1 1 13 7111 1 1 8 GLU HB3 H 0.101 -6.841 5.471 1.00 . A A . 8 GLU HB3 1 1 13 7112 1 1 8 GLU HG2 H -1.941 -6.028 5.958 1.00 . A A . 8 GLU HG2 1 1 13 7113 1 1 8 GLU HG3 H -2.424 -6.220 4.271 1.00 . A A . 8 GLU HG3 1 1 13 7114 1 1 8 GLU N N -0.577 -8.104 2.485 1.00 . A A . 8 GLU N 1 1 13 7115 1 1 8 GLU O O 1.641 -5.500 3.570 1.00 . A A . 8 GLU O 1 1 13 7116 1 1 8 GLU OE1 O -3.402 -8.568 4.632 1.00 . A A . 8 GLU OE1 1 1 13 7117 1 1 8 GLU OE2 O -3.173 -8.049 6.710 1.00 . A A . 8 GLU OE2 1 1 13 7118 1 1 9 THR C C 3.743 -6.572 1.243 1.00 . A A . 9 THR C 1 1 13 7119 1 1 9 THR CA C 3.461 -7.180 2.617 1.00 . A A . 9 THR CA 1 1 13 7120 1 1 9 THR CB C 4.198 -8.473 2.937 1.00 . A A . 9 THR CB 1 1 13 7121 1 1 9 THR CG2 C 3.930 -8.708 4.424 1.00 . A A . 9 THR CG2 1 1 13 7122 1 1 9 THR H H 1.684 -8.371 2.470 1.00 . A A . 9 THR H 1 1 13 7123 1 1 9 THR HA H 3.705 -6.436 3.364 1.00 . A A . 9 THR HA 1 1 13 7124 1 1 9 THR HB H 5.256 -8.357 2.787 1.00 . A A . 9 THR HB 1 1 13 7125 1 1 9 THR HG1 H 3.573 -10.298 2.687 1.00 . A A . 9 THR HG1 1 1 13 7126 1 1 9 THR HG21 H 3.161 -8.017 4.756 1.00 . A A . 9 THR HG21 1 1 13 7127 1 1 9 THR HG22 H 3.591 -9.722 4.578 1.00 . A A . 9 THR HG22 1 1 13 7128 1 1 9 THR HG23 H 4.833 -8.534 4.990 1.00 . A A . 9 THR HG23 1 1 13 7129 1 1 9 THR N N 2.018 -7.493 2.746 1.00 . A A . 9 THR N 1 1 13 7130 1 1 9 THR O O 4.640 -5.762 1.129 1.00 . A A . 9 THR O 1 1 13 7131 1 1 9 THR OG1 O 3.676 -9.522 2.131 1.00 . A A . 9 THR OG1 1 1 13 7132 1 1 10 ALA C C 3.310 -4.872 -0.863 1.00 . A A . 10 ALA C 1 1 13 7133 1 1 10 ALA CA C 3.220 -6.367 -1.131 1.00 . A A . 10 ALA CA 1 1 13 7134 1 1 10 ALA CB C 1.989 -6.541 -2.030 1.00 . A A . 10 ALA CB 1 1 13 7135 1 1 10 ALA H H 2.283 -7.594 0.388 1.00 . A A . 10 ALA H 1 1 13 7136 1 1 10 ALA HA H 4.126 -6.720 -1.597 1.00 . A A . 10 ALA HA 1 1 13 7137 1 1 10 ALA HB1 H 1.420 -7.404 -1.720 1.00 . A A . 10 ALA HB1 1 1 13 7138 1 1 10 ALA HB2 H 1.360 -5.660 -1.951 1.00 . A A . 10 ALA HB2 1 1 13 7139 1 1 10 ALA HB3 H 2.294 -6.656 -3.059 1.00 . A A . 10 ALA HB3 1 1 13 7140 1 1 10 ALA N N 2.996 -6.942 0.233 1.00 . A A . 10 ALA N 1 1 13 7141 1 1 10 ALA O O 4.123 -4.134 -1.385 1.00 . A A . 10 ALA O 1 1 13 7142 1 1 11 CYS C C 3.636 -2.666 1.062 1.00 . A A . 11 CYS C 1 1 13 7143 1 1 11 CYS CA C 2.307 -3.068 0.420 1.00 . A A . 11 CYS CA 1 1 13 7144 1 1 11 CYS CB C 1.102 -3.057 1.365 1.00 . A A . 11 CYS CB 1 1 13 7145 1 1 11 CYS H H 1.791 -5.125 0.380 1.00 . A A . 11 CYS H 1 1 13 7146 1 1 11 CYS HA H 2.117 -2.437 -0.434 1.00 . A A . 11 CYS HA 1 1 13 7147 1 1 11 CYS HB2 H 1.249 -3.744 2.191 1.00 . A A . 11 CYS HB2 1 1 13 7148 1 1 11 CYS HB3 H 0.924 -2.055 1.718 1.00 . A A . 11 CYS HB3 1 1 13 7149 1 1 11 CYS N N 2.416 -4.478 -0.006 1.00 . A A . 11 CYS N 1 1 13 7150 1 1 11 CYS O O 4.336 -1.821 0.547 1.00 . A A . 11 CYS O 1 1 13 7151 1 1 11 CYS SG S -0.332 -3.599 0.406 1.00 . A A . 11 CYS SG 1 1 13 7152 1 1 12 ARG C C 6.420 -2.695 1.780 1.00 . A A . 12 ARG C 1 1 13 7153 1 1 12 ARG CA C 5.303 -2.873 2.807 1.00 . A A . 12 ARG CA 1 1 13 7154 1 1 12 ARG CB C 5.729 -3.942 3.808 1.00 . A A . 12 ARG CB 1 1 13 7155 1 1 12 ARG CD C 7.941 -4.260 4.935 1.00 . A A . 12 ARG CD 1 1 13 7156 1 1 12 ARG CG C 6.780 -3.291 4.702 1.00 . A A . 12 ARG CG 1 1 13 7157 1 1 12 ARG CZ C 9.670 -4.376 6.626 1.00 . A A . 12 ARG CZ 1 1 13 7158 1 1 12 ARG H H 3.449 -3.931 2.581 1.00 . A A . 12 ARG H 1 1 13 7159 1 1 12 ARG HA H 5.186 -1.940 3.337 1.00 . A A . 12 ARG HA 1 1 13 7160 1 1 12 ARG HB2 H 4.875 -4.261 4.392 1.00 . A A . 12 ARG HB2 1 1 13 7161 1 1 12 ARG HB3 H 6.173 -4.783 3.297 1.00 . A A . 12 ARG HB3 1 1 13 7162 1 1 12 ARG HD2 H 7.605 -5.272 4.757 1.00 . A A . 12 ARG HD2 1 1 13 7163 1 1 12 ARG HD3 H 8.747 -4.025 4.257 1.00 . A A . 12 ARG HD3 1 1 13 7164 1 1 12 ARG HE H 7.796 -3.875 7.050 1.00 . A A . 12 ARG HE 1 1 13 7165 1 1 12 ARG HG2 H 7.135 -2.397 4.204 1.00 . A A . 12 ARG HG2 1 1 13 7166 1 1 12 ARG HG3 H 6.326 -3.028 5.644 1.00 . A A . 12 ARG HG3 1 1 13 7167 1 1 12 ARG HH11 H 9.430 -6.362 6.708 1.00 . A A . 12 ARG HH11 1 1 13 7168 1 1 12 ARG HH12 H 11.035 -5.788 7.015 1.00 . A A . 12 ARG HH12 1 1 13 7169 1 1 12 ARG HH21 H 10.202 -2.447 6.612 1.00 . A A . 12 ARG HH21 1 1 13 7170 1 1 12 ARG HH22 H 11.472 -3.571 6.960 1.00 . A A . 12 ARG HH22 1 1 13 7171 1 1 12 ARG N N 4.011 -3.248 2.168 1.00 . A A . 12 ARG N 1 1 13 7172 1 1 12 ARG NE N 8.419 -4.137 6.341 1.00 . A A . 12 ARG NE 1 1 13 7173 1 1 12 ARG NH1 N 10.077 -5.605 6.796 1.00 . A A . 12 ARG NH1 1 1 13 7174 1 1 12 ARG NH2 N 10.513 -3.388 6.742 1.00 . A A . 12 ARG NH2 1 1 13 7175 1 1 12 ARG O O 7.322 -1.908 1.977 1.00 . A A . 12 ARG O 1 1 13 7176 1 1 13 HIS C C 7.356 -1.776 -0.790 1.00 . A A . 13 HIS C 1 1 13 7177 1 1 13 HIS CA C 7.476 -3.221 -0.309 1.00 . A A . 13 HIS CA 1 1 13 7178 1 1 13 HIS CB C 7.261 -4.194 -1.471 1.00 . A A . 13 HIS CB 1 1 13 7179 1 1 13 HIS CD2 C 9.132 -3.502 -3.184 1.00 . A A . 13 HIS CD2 1 1 13 7180 1 1 13 HIS CE1 C 7.851 -2.689 -4.731 1.00 . A A . 13 HIS CE1 1 1 13 7181 1 1 13 HIS CG C 7.838 -3.629 -2.740 1.00 . A A . 13 HIS CG 1 1 13 7182 1 1 13 HIS H H 5.661 -4.037 0.519 1.00 . A A . 13 HIS H 1 1 13 7183 1 1 13 HIS HA H 8.437 -3.378 0.160 1.00 . A A . 13 HIS HA 1 1 13 7184 1 1 13 HIS HB2 H 7.746 -5.132 -1.245 1.00 . A A . 13 HIS HB2 1 1 13 7185 1 1 13 HIS HB3 H 6.203 -4.364 -1.601 1.00 . A A . 13 HIS HB3 1 1 13 7186 1 1 13 HIS HD1 H 6.063 -3.044 -3.734 1.00 . A A . 13 HIS HD1 1 1 13 7187 1 1 13 HIS HD2 H 10.011 -3.816 -2.640 1.00 . A A . 13 HIS HD2 1 1 13 7188 1 1 13 HIS HE1 H 7.505 -2.232 -5.647 1.00 . A A . 13 HIS HE1 1 1 13 7189 1 1 13 HIS N N 6.386 -3.403 0.686 1.00 . A A . 13 HIS N 1 1 13 7190 1 1 13 HIS ND1 N 7.040 -3.103 -3.743 1.00 . A A . 13 HIS ND1 1 1 13 7191 1 1 13 HIS NE2 N 9.136 -2.908 -4.444 1.00 . A A . 13 HIS NE2 1 1 13 7192 1 1 13 HIS O O 8.294 -1.010 -0.767 1.00 . A A . 13 HIS O 1 1 13 7193 1 1 14 ALA C C 6.034 1.013 -0.621 1.00 . A A . 14 ALA C 1 1 13 7194 1 1 14 ALA CA C 5.896 -0.047 -1.723 1.00 . A A . 14 ALA CA 1 1 13 7195 1 1 14 ALA CB C 4.453 -0.083 -2.226 1.00 . A A . 14 ALA CB 1 1 13 7196 1 1 14 ALA H H 5.459 -2.095 -1.212 1.00 . A A . 14 ALA H 1 1 13 7197 1 1 14 ALA HA H 6.538 0.219 -2.552 1.00 . A A . 14 ALA HA 1 1 13 7198 1 1 14 ALA HB1 H 4.285 -1.009 -2.756 1.00 . A A . 14 ALA HB1 1 1 13 7199 1 1 14 ALA HB2 H 3.781 -0.033 -1.380 1.00 . A A . 14 ALA HB2 1 1 13 7200 1 1 14 ALA HB3 H 4.270 0.751 -2.884 1.00 . A A . 14 ALA HB3 1 1 13 7201 1 1 14 ALA N N 6.180 -1.426 -1.221 1.00 . A A . 14 ALA N 1 1 13 7202 1 1 14 ALA O O 6.884 1.879 -0.684 1.00 . A A . 14 ALA O 1 1 13 7203 1 1 15 LYS C C 6.678 1.970 2.081 1.00 . A A . 15 LYS C 1 1 13 7204 1 1 15 LYS CA C 5.260 1.947 1.500 1.00 . A A . 15 LYS CA 1 1 13 7205 1 1 15 LYS CB C 4.143 1.538 2.467 1.00 . A A . 15 LYS CB 1 1 13 7206 1 1 15 LYS CD C 2.834 2.411 0.462 1.00 . A A . 15 LYS CD 1 1 13 7207 1 1 15 LYS CE C 1.654 2.049 -0.436 1.00 . A A . 15 LYS CE 1 1 13 7208 1 1 15 LYS CG C 2.884 1.384 1.606 1.00 . A A . 15 LYS CG 1 1 13 7209 1 1 15 LYS H H 4.532 0.250 0.400 1.00 . A A . 15 LYS H 1 1 13 7210 1 1 15 LYS HA H 5.016 2.941 1.110 1.00 . A A . 15 LYS HA 1 1 13 7211 1 1 15 LYS HB2 H 4.363 0.623 2.996 1.00 . A A . 15 LYS HB2 1 1 13 7212 1 1 15 LYS HB3 H 3.955 2.329 3.176 1.00 . A A . 15 LYS HB3 1 1 13 7213 1 1 15 LYS HD2 H 2.690 3.399 0.866 1.00 . A A . 15 LYS HD2 1 1 13 7214 1 1 15 LYS HD3 H 3.722 2.442 -0.146 1.00 . A A . 15 LYS HD3 1 1 13 7215 1 1 15 LYS HE2 H 1.231 1.114 -0.103 1.00 . A A . 15 LYS HE2 1 1 13 7216 1 1 15 LYS HE3 H 0.907 2.826 -0.391 1.00 . A A . 15 LYS HE3 1 1 13 7217 1 1 15 LYS HG2 H 2.845 0.391 1.187 1.00 . A A . 15 LYS HG2 1 1 13 7218 1 1 15 LYS HG3 H 2.019 1.527 2.235 1.00 . A A . 15 LYS HG3 1 1 13 7219 1 1 15 LYS HZ1 H 3.197 1.846 -1.820 1.00 . A A . 15 LYS HZ1 1 1 13 7220 1 1 15 LYS HZ2 H 1.771 1.056 -2.267 1.00 . A A . 15 LYS HZ2 1 1 13 7221 1 1 15 LYS HZ3 H 1.891 2.754 -2.382 1.00 . A A . 15 LYS HZ3 1 1 13 7222 1 1 15 LYS N N 5.205 0.957 0.386 1.00 . A A . 15 LYS N 1 1 13 7223 1 1 15 LYS NZ N 2.161 1.916 -1.831 1.00 . A A . 15 LYS NZ 1 1 13 7224 1 1 15 LYS O O 7.065 2.949 2.688 1.00 . A A . 15 LYS O 1 1 13 7225 1 1 16 SER C C 9.891 1.355 1.419 1.00 . A A . 16 SER C 1 1 13 7226 1 1 16 SER CA C 8.858 0.986 2.493 1.00 . A A . 16 SER CA 1 1 13 7227 1 1 16 SER CB C 9.218 -0.402 3.015 1.00 . A A . 16 SER CB 1 1 13 7228 1 1 16 SER H H 7.221 0.121 1.440 1.00 . A A . 16 SER H 1 1 13 7229 1 1 16 SER HA H 8.905 1.689 3.307 1.00 . A A . 16 SER HA 1 1 13 7230 1 1 16 SER HB2 H 8.356 -0.856 3.478 1.00 . A A . 16 SER HB2 1 1 13 7231 1 1 16 SER HB3 H 9.526 -1.007 2.172 1.00 . A A . 16 SER HB3 1 1 13 7232 1 1 16 SER HG H 10.731 0.530 3.805 1.00 . A A . 16 SER HG 1 1 13 7233 1 1 16 SER N N 7.482 0.938 1.924 1.00 . A A . 16 SER N 1 1 13 7234 1 1 16 SER O O 11.002 1.733 1.731 1.00 . A A . 16 SER O 1 1 13 7235 1 1 16 SER OG O 10.259 -0.288 3.976 1.00 . A A . 16 SER OG 1 1 13 7236 1 1 17 LEU C C 10.479 3.053 -1.346 1.00 . A A . 17 LEU C 1 1 13 7237 1 1 17 LEU CA C 10.522 1.588 -0.918 1.00 . A A . 17 LEU CA 1 1 13 7238 1 1 17 LEU CB C 10.264 0.633 -2.084 1.00 . A A . 17 LEU CB 1 1 13 7239 1 1 17 LEU CD1 C 9.453 2.234 -3.836 1.00 . A A . 17 LEU CD1 1 1 13 7240 1 1 17 LEU CD2 C 8.825 -0.220 -3.777 1.00 . A A . 17 LEU CD2 1 1 13 7241 1 1 17 LEU CG C 9.084 1.039 -2.954 1.00 . A A . 17 LEU CG 1 1 13 7242 1 1 17 LEU H H 8.656 0.937 -0.072 1.00 . A A . 17 LEU H 1 1 13 7243 1 1 17 LEU HA H 11.517 1.398 -0.569 1.00 . A A . 17 LEU HA 1 1 13 7244 1 1 17 LEU HB2 H 11.126 0.559 -2.721 1.00 . A A . 17 LEU HB2 1 1 13 7245 1 1 17 LEU HB3 H 10.047 -0.346 -1.680 1.00 . A A . 17 LEU HB3 1 1 13 7246 1 1 17 LEU HD11 H 10.473 2.511 -3.614 1.00 . A A . 17 LEU HD11 1 1 13 7247 1 1 17 LEU HD12 H 9.365 1.963 -4.877 1.00 . A A . 17 LEU HD12 1 1 13 7248 1 1 17 LEU HD13 H 8.789 3.062 -3.615 1.00 . A A . 17 LEU HD13 1 1 13 7249 1 1 17 LEU HD21 H 9.541 -0.971 -3.480 1.00 . A A . 17 LEU HD21 1 1 13 7250 1 1 17 LEU HD22 H 7.824 -0.587 -3.604 1.00 . A A . 17 LEU HD22 1 1 13 7251 1 1 17 LEU HD23 H 8.950 -0.007 -4.826 1.00 . A A . 17 LEU HD23 1 1 13 7252 1 1 17 LEU HG H 8.231 1.245 -2.333 1.00 . A A . 17 LEU HG 1 1 13 7253 1 1 17 LEU N N 9.553 1.248 0.163 1.00 . A A . 17 LEU N 1 1 13 7254 1 1 17 LEU O O 11.488 3.712 -1.496 1.00 . A A . 17 LEU O 1 1 13 7255 1 1 18 GLY C C 7.777 5.147 -2.717 1.00 . A A . 18 GLY C 1 1 13 7256 1 1 18 GLY CA C 9.103 4.964 -1.967 1.00 . A A . 18 GLY CA 1 1 13 7257 1 1 18 GLY H H 8.542 2.956 -1.404 1.00 . A A . 18 GLY H 1 1 13 7258 1 1 18 GLY HA2 H 9.106 5.598 -1.093 1.00 . A A . 18 GLY HA2 1 1 13 7259 1 1 18 GLY HA3 H 9.915 5.253 -2.618 1.00 . A A . 18 GLY HA3 1 1 13 7260 1 1 18 GLY N N 9.298 3.550 -1.542 1.00 . A A . 18 GLY N 1 1 13 7261 1 1 18 GLY O O 7.451 6.251 -3.102 1.00 . A A . 18 GLY O 1 1 13 7262 1 1 19 ASN C C 4.590 4.547 -2.659 1.00 . A A . 19 ASN C 1 1 13 7263 1 1 19 ASN CA C 5.707 4.275 -3.662 1.00 . A A . 19 ASN CA 1 1 13 7264 1 1 19 ASN CB C 5.272 2.970 -4.300 1.00 . A A . 19 ASN CB 1 1 13 7265 1 1 19 ASN CG C 6.394 2.089 -4.849 1.00 . A A . 19 ASN CG 1 1 13 7266 1 1 19 ASN H H 7.206 3.219 -2.654 1.00 . A A . 19 ASN H 1 1 13 7267 1 1 19 ASN HA H 5.761 5.040 -4.419 1.00 . A A . 19 ASN HA 1 1 13 7268 1 1 19 ASN HB2 H 4.654 2.428 -3.615 1.00 . A A . 19 ASN HB2 1 1 13 7269 1 1 19 ASN HB3 H 4.624 3.239 -5.095 1.00 . A A . 19 ASN HB3 1 1 13 7270 1 1 19 ASN HD21 H 5.500 0.421 -4.253 1.00 . A A . 19 ASN HD21 1 1 13 7271 1 1 19 ASN HD22 H 6.966 0.204 -5.065 1.00 . A A . 19 ASN HD22 1 1 13 7272 1 1 19 ASN N N 6.991 4.121 -2.943 1.00 . A A . 19 ASN N 1 1 13 7273 1 1 19 ASN ND2 N 6.281 0.799 -4.706 1.00 . A A . 19 ASN ND2 1 1 13 7274 1 1 19 ASN O O 3.457 4.164 -2.875 1.00 . A A . 19 ASN O 1 1 13 7275 1 1 19 ASN OD1 O 7.362 2.570 -5.402 1.00 . A A . 19 ASN OD1 1 1 13 7276 1 1 20 CYS C C 3.070 6.758 -0.910 1.00 . A A . 20 CYS C 1 1 13 7277 1 1 20 CYS CA C 3.875 5.506 -0.536 1.00 . A A . 20 CYS CA 1 1 13 7278 1 1 20 CYS CB C 4.571 5.816 0.784 1.00 . A A . 20 CYS CB 1 1 13 7279 1 1 20 CYS H H 5.843 5.463 -1.475 1.00 . A A . 20 CYS H 1 1 13 7280 1 1 20 CYS HA H 3.217 4.664 -0.393 1.00 . A A . 20 CYS HA 1 1 13 7281 1 1 20 CYS HB2 H 5.448 5.205 0.890 1.00 . A A . 20 CYS HB2 1 1 13 7282 1 1 20 CYS HB3 H 4.831 6.862 0.765 1.00 . A A . 20 CYS HB3 1 1 13 7283 1 1 20 CYS N N 4.906 5.194 -1.578 1.00 . A A . 20 CYS N 1 1 13 7284 1 1 20 CYS O O 2.804 7.585 -0.062 1.00 . A A . 20 CYS O 1 1 13 7285 1 1 20 CYS SG S 3.521 5.496 2.214 1.00 . A A . 20 CYS SG 1 1 13 7286 1 1 21 ARG C C 2.268 8.272 -4.173 1.00 . A A . 21 ARG C 1 1 13 7287 1 1 21 ARG CA C 1.913 8.021 -2.702 1.00 . A A . 21 ARG CA 1 1 13 7288 1 1 21 ARG CB C 2.202 9.279 -1.894 1.00 . A A . 21 ARG CB 1 1 13 7289 1 1 21 ARG CD C 1.648 9.814 0.493 1.00 . A A . 21 ARG CD 1 1 13 7290 1 1 21 ARG CG C 1.074 9.431 -0.872 1.00 . A A . 21 ARG CG 1 1 13 7291 1 1 21 ARG CZ C 1.121 12.173 0.671 1.00 . A A . 21 ARG CZ 1 1 13 7292 1 1 21 ARG H H 2.947 6.176 -2.765 1.00 . A A . 21 ARG H 1 1 13 7293 1 1 21 ARG HA H 0.861 7.796 -2.634 1.00 . A A . 21 ARG HA 1 1 13 7294 1 1 21 ARG HB2 H 3.157 9.155 -1.406 1.00 . A A . 21 ARG HB2 1 1 13 7295 1 1 21 ARG HB3 H 2.222 10.139 -2.544 1.00 . A A . 21 ARG HB3 1 1 13 7296 1 1 21 ARG HD2 H 1.586 8.969 1.163 1.00 . A A . 21 ARG HD2 1 1 13 7297 1 1 21 ARG HD3 H 2.680 10.109 0.380 1.00 . A A . 21 ARG HD3 1 1 13 7298 1 1 21 ARG HE H 0.162 10.784 1.717 1.00 . A A . 21 ARG HE 1 1 13 7299 1 1 21 ARG HG2 H 0.389 10.194 -1.208 1.00 . A A . 21 ARG HG2 1 1 13 7300 1 1 21 ARG HG3 H 0.551 8.487 -0.788 1.00 . A A . 21 ARG HG3 1 1 13 7301 1 1 21 ARG HH11 H 2.827 12.308 1.710 1.00 . A A . 21 ARG HH11 1 1 13 7302 1 1 21 ARG HH12 H 2.393 13.713 0.797 1.00 . A A . 21 ARG HH12 1 1 13 7303 1 1 21 ARG HH21 H -0.525 12.322 -0.458 1.00 . A A . 21 ARG HH21 1 1 13 7304 1 1 21 ARG HH22 H 0.495 13.722 -0.430 1.00 . A A . 21 ARG HH22 1 1 13 7305 1 1 21 ARG N N 2.698 6.880 -2.154 1.00 . A A . 21 ARG N 1 1 13 7306 1 1 21 ARG NE N 0.867 10.952 1.057 1.00 . A A . 21 ARG NE 1 1 13 7307 1 1 21 ARG NH1 N 2.198 12.779 1.092 1.00 . A A . 21 ARG NH1 1 1 13 7308 1 1 21 ARG NH2 N 0.299 12.786 -0.135 1.00 . A A . 21 ARG NH2 1 1 13 7309 1 1 21 ARG O O 1.525 8.937 -4.869 1.00 . A A . 21 ARG O 1 1 13 7310 1 1 22 THR C C 3.122 6.882 -6.948 1.00 . A A . 22 THR C 1 1 13 7311 1 1 22 THR CA C 3.684 8.031 -6.111 1.00 . A A . 22 THR CA 1 1 13 7312 1 1 22 THR CB C 5.201 8.108 -6.295 1.00 . A A . 22 THR CB 1 1 13 7313 1 1 22 THR CG2 C 5.758 9.298 -5.512 1.00 . A A . 22 THR CG2 1 1 13 7314 1 1 22 THR H H 3.988 7.233 -4.157 1.00 . A A . 22 THR H 1 1 13 7315 1 1 22 THR HA H 3.229 8.961 -6.421 1.00 . A A . 22 THR HA 1 1 13 7316 1 1 22 THR HB H 5.433 8.241 -7.340 1.00 . A A . 22 THR HB 1 1 13 7317 1 1 22 THR HG1 H 6.338 6.547 -6.528 1.00 . A A . 22 THR HG1 1 1 13 7318 1 1 22 THR HG21 H 5.479 9.207 -4.473 1.00 . A A . 22 THR HG21 1 1 13 7319 1 1 22 THR HG22 H 6.835 9.312 -5.596 1.00 . A A . 22 THR HG22 1 1 13 7320 1 1 22 THR HG23 H 5.353 10.214 -5.915 1.00 . A A . 22 THR HG23 1 1 13 7321 1 1 22 THR N N 3.365 7.773 -4.683 1.00 . A A . 22 THR N 1 1 13 7322 1 1 22 THR O O 3.085 6.960 -8.161 1.00 . A A . 22 THR O 1 1 13 7323 1 1 22 THR OG1 O 5.791 6.904 -5.824 1.00 . A A . 22 THR OG1 1 1 13 7324 1 1 23 SER C C 0.638 4.685 -6.840 1.00 . A A . 23 SER C 1 1 13 7325 1 1 23 SER CA C 2.135 4.703 -7.149 1.00 . A A . 23 SER CA 1 1 13 7326 1 1 23 SER CB C 2.941 3.478 -6.718 1.00 . A A . 23 SER CB 1 1 13 7327 1 1 23 SER H H 2.695 5.717 -5.354 1.00 . A A . 23 SER H 1 1 13 7328 1 1 23 SER HA H 2.262 4.911 -8.203 1.00 . A A . 23 SER HA 1 1 13 7329 1 1 23 SER HB2 H 3.983 3.643 -6.941 1.00 . A A . 23 SER HB2 1 1 13 7330 1 1 23 SER HB3 H 2.838 3.356 -5.648 1.00 . A A . 23 SER HB3 1 1 13 7331 1 1 23 SER HG H 1.544 2.429 -7.574 1.00 . A A . 23 SER HG 1 1 13 7332 1 1 23 SER N N 2.681 5.816 -6.335 1.00 . A A . 23 SER N 1 1 13 7333 1 1 23 SER O O 0.234 4.974 -5.731 1.00 . A A . 23 SER O 1 1 13 7334 1 1 23 SER OG O 2.488 2.333 -7.427 1.00 . A A . 23 SER OG 1 1 13 7335 1 1 24 GLN C C -2.140 3.143 -6.706 1.00 . A A . 24 GLN C 1 1 13 7336 1 1 24 GLN CA C -1.662 4.365 -7.489 1.00 . A A . 24 GLN CA 1 1 13 7337 1 1 24 GLN CB C -2.469 4.515 -8.779 1.00 . A A . 24 GLN CB 1 1 13 7338 1 1 24 GLN CD C -4.443 5.691 -9.763 1.00 . A A . 24 GLN CD 1 1 13 7339 1 1 24 GLN CG C -3.363 5.754 -8.682 1.00 . A A . 24 GLN CG 1 1 13 7340 1 1 24 GLN H H 0.118 4.142 -8.686 1.00 . A A . 24 GLN H 1 1 13 7341 1 1 24 GLN HA H -1.858 5.233 -6.876 1.00 . A A . 24 GLN HA 1 1 13 7342 1 1 24 GLN HB2 H -1.791 4.621 -9.614 1.00 . A A . 24 GLN HB2 1 1 13 7343 1 1 24 GLN HB3 H -3.087 3.642 -8.922 1.00 . A A . 24 GLN HB3 1 1 13 7344 1 1 24 GLN HE21 H -5.686 6.897 -8.791 1.00 . A A . 24 GLN HE21 1 1 13 7345 1 1 24 GLN HE22 H -6.250 6.327 -10.287 1.00 . A A . 24 GLN HE22 1 1 13 7346 1 1 24 GLN HG2 H -3.826 5.786 -7.706 1.00 . A A . 24 GLN HG2 1 1 13 7347 1 1 24 GLN HG3 H -2.766 6.642 -8.828 1.00 . A A . 24 GLN HG3 1 1 13 7348 1 1 24 GLN N N -0.202 4.367 -7.788 1.00 . A A . 24 GLN N 1 1 13 7349 1 1 24 GLN NE2 N -5.552 6.360 -9.601 1.00 . A A . 24 GLN NE2 1 1 13 7350 1 1 24 GLN O O -2.458 3.277 -5.548 1.00 . A A . 24 GLN O 1 1 13 7351 1 1 24 GLN OE1 O -4.277 5.026 -10.766 1.00 . A A . 24 GLN OE1 1 1 13 7352 1 1 25 LYS C C -1.823 0.823 -5.167 1.00 . A A . 25 LYS C 1 1 13 7353 1 1 25 LYS CA C -2.695 0.837 -6.418 1.00 . A A . 25 LYS CA 1 1 13 7354 1 1 25 LYS CB C -2.528 -0.474 -7.181 1.00 . A A . 25 LYS CB 1 1 13 7355 1 1 25 LYS CD C -3.982 -2.373 -7.912 1.00 . A A . 25 LYS CD 1 1 13 7356 1 1 25 LYS CE C -2.707 -3.077 -8.380 1.00 . A A . 25 LYS CE 1 1 13 7357 1 1 25 LYS CG C -3.665 -1.409 -6.770 1.00 . A A . 25 LYS CG 1 1 13 7358 1 1 25 LYS H H -1.968 1.826 -8.197 1.00 . A A . 25 LYS H 1 1 13 7359 1 1 25 LYS HA H -3.728 0.994 -6.143 1.00 . A A . 25 LYS HA 1 1 13 7360 1 1 25 LYS HB2 H -2.568 -0.272 -8.243 1.00 . A A . 25 LYS HB2 1 1 13 7361 1 1 25 LYS HB3 H -1.582 -0.926 -6.928 1.00 . A A . 25 LYS HB3 1 1 13 7362 1 1 25 LYS HD2 H -4.692 -3.109 -7.567 1.00 . A A . 25 LYS HD2 1 1 13 7363 1 1 25 LYS HD3 H -4.405 -1.819 -8.737 1.00 . A A . 25 LYS HD3 1 1 13 7364 1 1 25 LYS HE2 H -1.884 -2.377 -8.384 1.00 . A A . 25 LYS HE2 1 1 13 7365 1 1 25 LYS HE3 H -2.480 -3.895 -7.713 1.00 . A A . 25 LYS HE3 1 1 13 7366 1 1 25 LYS HG2 H -3.379 -1.962 -5.888 1.00 . A A . 25 LYS HG2 1 1 13 7367 1 1 25 LYS HG3 H -4.539 -0.814 -6.553 1.00 . A A . 25 LYS HG3 1 1 13 7368 1 1 25 LYS HZ1 H -3.924 -3.582 -9.994 1.00 . A A . 25 LYS HZ1 1 1 13 7369 1 1 25 LYS HZ2 H -2.391 -3.017 -10.439 1.00 . A A . 25 LYS HZ2 1 1 13 7370 1 1 25 LYS HZ3 H -2.565 -4.586 -9.806 1.00 . A A . 25 LYS HZ3 1 1 13 7371 1 1 25 LYS N N -2.216 1.967 -7.261 1.00 . A A . 25 LYS N 1 1 13 7372 1 1 25 LYS NZ N -2.912 -3.607 -9.758 1.00 . A A . 25 LYS NZ 1 1 13 7373 1 1 25 LYS O O -2.231 0.673 -4.035 1.00 . A A . 25 LYS O 1 1 13 7374 1 1 26 TYR C C -0.167 1.981 -3.179 1.00 . A A . 26 TYR C 1 1 13 7375 1 1 26 TYR CA C 0.371 1.005 -4.233 1.00 . A A . 26 TYR CA 1 1 13 7376 1 1 26 TYR CB C 1.658 1.495 -4.870 1.00 . A A . 26 TYR CB 1 1 13 7377 1 1 26 TYR CD1 C 1.686 -0.915 -5.627 1.00 . A A . 26 TYR CD1 1 1 13 7378 1 1 26 TYR CD2 C 3.732 0.366 -5.729 1.00 . A A . 26 TYR CD2 1 1 13 7379 1 1 26 TYR CE1 C 2.362 -2.024 -6.133 1.00 . A A . 26 TYR CE1 1 1 13 7380 1 1 26 TYR CE2 C 4.416 -0.744 -6.236 1.00 . A A . 26 TYR CE2 1 1 13 7381 1 1 26 TYR CG C 2.373 0.288 -5.424 1.00 . A A . 26 TYR CG 1 1 13 7382 1 1 26 TYR CZ C 3.727 -1.947 -6.439 1.00 . A A . 26 TYR CZ 1 1 13 7383 1 1 26 TYR H H -0.226 1.121 -6.295 1.00 . A A . 26 TYR H 1 1 13 7384 1 1 26 TYR HA H 0.529 0.009 -3.836 1.00 . A A . 26 TYR HA 1 1 13 7385 1 1 26 TYR HB2 H 1.364 2.161 -5.663 1.00 . A A . 26 TYR HB2 1 1 13 7386 1 1 26 TYR HB3 H 2.277 2.004 -4.145 1.00 . A A . 26 TYR HB3 1 1 13 7387 1 1 26 TYR HD1 H 0.633 -1.001 -5.401 1.00 . A A . 26 TYR HD1 1 1 13 7388 1 1 26 TYR HD2 H 4.262 1.293 -5.573 1.00 . A A . 26 TYR HD2 1 1 13 7389 1 1 26 TYR HE1 H 1.804 -2.935 -6.276 1.00 . A A . 26 TYR HE1 1 1 13 7390 1 1 26 TYR HE2 H 5.471 -0.662 -6.463 1.00 . A A . 26 TYR HE2 1 1 13 7391 1 1 26 TYR HH H 4.890 -2.772 -7.709 1.00 . A A . 26 TYR HH 1 1 13 7392 1 1 26 TYR N N -0.561 0.994 -5.383 1.00 . A A . 26 TYR N 1 1 13 7393 1 1 26 TYR O O -0.739 1.577 -2.190 1.00 . A A . 26 TYR O 1 1 13 7394 1 1 26 TYR OH O 4.390 -3.050 -6.937 1.00 . A A . 26 TYR OH 1 1 13 7395 1 1 27 ARG C C -1.939 3.821 -1.840 1.00 . A A . 27 ARG C 1 1 13 7396 1 1 27 ARG CA C -0.531 4.210 -2.313 1.00 . A A . 27 ARG CA 1 1 13 7397 1 1 27 ARG CB C -0.430 5.635 -2.868 1.00 . A A . 27 ARG CB 1 1 13 7398 1 1 27 ARG CD C -1.660 7.589 -3.790 1.00 . A A . 27 ARG CD 1 1 13 7399 1 1 27 ARG CG C -1.759 6.103 -3.449 1.00 . A A . 27 ARG CG 1 1 13 7400 1 1 27 ARG CZ C -2.513 9.681 -2.914 1.00 . A A . 27 ARG CZ 1 1 13 7401 1 1 27 ARG H H 0.450 3.615 -4.138 1.00 . A A . 27 ARG H 1 1 13 7402 1 1 27 ARG HA H 0.120 4.134 -1.454 1.00 . A A . 27 ARG HA 1 1 13 7403 1 1 27 ARG HB2 H -0.135 6.318 -2.086 1.00 . A A . 27 ARG HB2 1 1 13 7404 1 1 27 ARG HB3 H 0.311 5.645 -3.657 1.00 . A A . 27 ARG HB3 1 1 13 7405 1 1 27 ARG HD2 H -0.622 7.887 -3.776 1.00 . A A . 27 ARG HD2 1 1 13 7406 1 1 27 ARG HD3 H -2.069 7.759 -4.775 1.00 . A A . 27 ARG HD3 1 1 13 7407 1 1 27 ARG HE H -2.855 7.934 -2.031 1.00 . A A . 27 ARG HE 1 1 13 7408 1 1 27 ARG HG2 H -1.922 5.543 -4.358 1.00 . A A . 27 ARG HG2 1 1 13 7409 1 1 27 ARG HG3 H -2.550 5.942 -2.728 1.00 . A A . 27 ARG HG3 1 1 13 7410 1 1 27 ARG HH11 H -0.541 9.950 -3.129 1.00 . A A . 27 ARG HH11 1 1 13 7411 1 1 27 ARG HH12 H -1.505 11.389 -3.188 1.00 . A A . 27 ARG HH12 1 1 13 7412 1 1 27 ARG HH21 H -4.506 9.712 -2.727 1.00 . A A . 27 ARG HH21 1 1 13 7413 1 1 27 ARG HH22 H -3.751 11.253 -2.961 1.00 . A A . 27 ARG HH22 1 1 13 7414 1 1 27 ARG N N -0.008 3.267 -3.344 1.00 . A A . 27 ARG N 1 1 13 7415 1 1 27 ARG NE N -2.423 8.385 -2.786 1.00 . A A . 27 ARG NE 1 1 13 7416 1 1 27 ARG NH1 N -1.437 10.395 -3.091 1.00 . A A . 27 ARG NH1 1 1 13 7417 1 1 27 ARG NH2 N -3.681 10.260 -2.863 1.00 . A A . 27 ARG NH2 1 1 13 7418 1 1 27 ARG O O -2.145 3.553 -0.673 1.00 . A A . 27 ARG O 1 1 13 7419 1 1 28 ALA C C -4.370 1.931 -1.845 1.00 . A A . 28 ALA C 1 1 13 7420 1 1 28 ALA CA C -4.302 3.403 -2.265 1.00 . A A . 28 ALA CA 1 1 13 7421 1 1 28 ALA CB C -5.275 3.644 -3.421 1.00 . A A . 28 ALA CB 1 1 13 7422 1 1 28 ALA H H -2.754 3.994 -3.632 1.00 . A A . 28 ALA H 1 1 13 7423 1 1 28 ALA HA H -4.593 4.024 -1.431 1.00 . A A . 28 ALA HA 1 1 13 7424 1 1 28 ALA HB1 H -5.143 4.647 -3.800 1.00 . A A . 28 ALA HB1 1 1 13 7425 1 1 28 ALA HB2 H -5.079 2.933 -4.210 1.00 . A A . 28 ALA HB2 1 1 13 7426 1 1 28 ALA HB3 H -6.289 3.523 -3.070 1.00 . A A . 28 ALA HB3 1 1 13 7427 1 1 28 ALA N N -2.922 3.778 -2.696 1.00 . A A . 28 ALA N 1 1 13 7428 1 1 28 ALA O O -4.502 1.624 -0.677 1.00 . A A . 28 ALA O 1 1 13 7429 1 1 29 ASN C C -3.395 -0.902 -1.310 1.00 . A A . 29 ASN C 1 1 13 7430 1 1 29 ASN CA C -4.354 -0.444 -2.418 1.00 . A A . 29 ASN CA 1 1 13 7431 1 1 29 ASN CB C -4.209 -1.351 -3.646 1.00 . A A . 29 ASN CB 1 1 13 7432 1 1 29 ASN CG C -5.584 -1.609 -4.263 1.00 . A A . 29 ASN CG 1 1 13 7433 1 1 29 ASN H H -4.188 1.282 -3.704 1.00 . A A . 29 ASN H 1 1 13 7434 1 1 29 ASN HA H -5.344 -0.591 -2.028 1.00 . A A . 29 ASN HA 1 1 13 7435 1 1 29 ASN HB2 H -3.576 -0.880 -4.381 1.00 . A A . 29 ASN HB2 1 1 13 7436 1 1 29 ASN HB3 H -3.776 -2.298 -3.355 1.00 . A A . 29 ASN HB3 1 1 13 7437 1 1 29 ASN HD21 H -6.066 0.315 -4.342 1.00 . A A . 29 ASN HD21 1 1 13 7438 1 1 29 ASN HD22 H -7.246 -0.754 -4.931 1.00 . A A . 29 ASN HD22 1 1 13 7439 1 1 29 ASN N N -4.288 1.009 -2.771 1.00 . A A . 29 ASN N 1 1 13 7440 1 1 29 ASN ND2 N -6.363 -0.599 -4.534 1.00 . A A . 29 ASN ND2 1 1 13 7441 1 1 29 ASN O O -3.484 -2.029 -0.867 1.00 . A A . 29 ASN O 1 1 13 7442 1 1 29 ASN OD1 O -5.954 -2.742 -4.503 1.00 . A A . 29 ASN OD1 1 1 13 7443 1 1 30 CYS C C -1.561 0.719 1.184 1.00 . A A . 30 CYS C 1 1 13 7444 1 1 30 CYS CA C -1.545 -0.471 0.229 1.00 . A A . 30 CYS CA 1 1 13 7445 1 1 30 CYS CB C -0.169 -0.741 -0.384 1.00 . A A . 30 CYS CB 1 1 13 7446 1 1 30 CYS H H -2.433 0.825 -1.212 1.00 . A A . 30 CYS H 1 1 13 7447 1 1 30 CYS HA H -1.917 -1.333 0.769 1.00 . A A . 30 CYS HA 1 1 13 7448 1 1 30 CYS HB2 H 0.094 0.017 -1.103 1.00 . A A . 30 CYS HB2 1 1 13 7449 1 1 30 CYS HB3 H 0.580 -0.785 0.391 1.00 . A A . 30 CYS HB3 1 1 13 7450 1 1 30 CYS N N -2.495 -0.080 -0.849 1.00 . A A . 30 CYS N 1 1 13 7451 1 1 30 CYS O O -0.564 1.199 1.686 1.00 . A A . 30 CYS O 1 1 13 7452 1 1 30 CYS SG S -0.274 -2.358 -1.187 1.00 . A A . 30 CYS SG 1 1 13 7453 1 1 31 ALA C C -2.894 1.981 3.756 1.00 . A A . 31 ALA C 1 1 13 7454 1 1 31 ALA CA C -3.096 2.319 2.275 1.00 . A A . 31 ALA CA 1 1 13 7455 1 1 31 ALA CB C -4.554 2.698 2.009 1.00 . A A . 31 ALA CB 1 1 13 7456 1 1 31 ALA H H -3.511 0.711 0.938 1.00 . A A . 31 ALA H 1 1 13 7457 1 1 31 ALA HA H -2.473 3.156 1.998 1.00 . A A . 31 ALA HA 1 1 13 7458 1 1 31 ALA HB1 H -4.678 2.931 0.961 1.00 . A A . 31 ALA HB1 1 1 13 7459 1 1 31 ALA HB2 H -5.193 1.865 2.267 1.00 . A A . 31 ALA HB2 1 1 13 7460 1 1 31 ALA HB3 H -4.821 3.558 2.603 1.00 . A A . 31 ALA HB3 1 1 13 7461 1 1 31 ALA N N -2.771 1.164 1.392 1.00 . A A . 31 ALA N 1 1 13 7462 1 1 31 ALA O O -2.961 2.844 4.609 1.00 . A A . 31 ALA O 1 1 13 7463 1 1 32 LYS C C -0.951 0.552 5.793 1.00 . A A . 32 LYS C 1 1 13 7464 1 1 32 LYS CA C -2.436 0.343 5.497 1.00 . A A . 32 LYS CA 1 1 13 7465 1 1 32 LYS CB C -2.764 -1.150 5.632 1.00 . A A . 32 LYS CB 1 1 13 7466 1 1 32 LYS CD C -1.801 -3.461 6.100 1.00 . A A . 32 LYS CD 1 1 13 7467 1 1 32 LYS CE C -0.608 -4.031 5.325 1.00 . A A . 32 LYS CE 1 1 13 7468 1 1 32 LYS CG C -1.580 -1.951 6.194 1.00 . A A . 32 LYS CG 1 1 13 7469 1 1 32 LYS H H -2.597 0.065 3.364 1.00 . A A . 32 LYS H 1 1 13 7470 1 1 32 LYS HA H -3.052 0.932 6.160 1.00 . A A . 32 LYS HA 1 1 13 7471 1 1 32 LYS HB2 H -3.613 -1.266 6.287 1.00 . A A . 32 LYS HB2 1 1 13 7472 1 1 32 LYS HB3 H -3.016 -1.534 4.655 1.00 . A A . 32 LYS HB3 1 1 13 7473 1 1 32 LYS HD2 H -1.847 -3.887 7.093 1.00 . A A . 32 LYS HD2 1 1 13 7474 1 1 32 LYS HD3 H -2.707 -3.675 5.556 1.00 . A A . 32 LYS HD3 1 1 13 7475 1 1 32 LYS HE2 H 0.252 -3.410 5.519 1.00 . A A . 32 LYS HE2 1 1 13 7476 1 1 32 LYS HE3 H -0.383 -5.047 5.621 1.00 . A A . 32 LYS HE3 1 1 13 7477 1 1 32 LYS HG2 H -0.696 -1.750 5.610 1.00 . A A . 32 LYS HG2 1 1 13 7478 1 1 32 LYS HG3 H -1.413 -1.689 7.227 1.00 . A A . 32 LYS HG3 1 1 13 7479 1 1 32 LYS HZ1 H -1.111 -3.006 3.588 1.00 . A A . 32 LYS HZ1 1 1 13 7480 1 1 32 LYS HZ2 H -0.106 -4.353 3.329 1.00 . A A . 32 LYS HZ2 1 1 13 7481 1 1 32 LYS HZ3 H -1.745 -4.580 3.680 1.00 . A A . 32 LYS HZ3 1 1 13 7482 1 1 32 LYS N N -2.646 0.742 4.073 1.00 . A A . 32 LYS N 1 1 13 7483 1 1 32 LYS NZ N -0.914 -3.988 3.870 1.00 . A A . 32 LYS NZ 1 1 13 7484 1 1 32 LYS O O -0.526 0.985 6.846 1.00 . A A . 32 LYS O 1 1 13 7485 1 1 33 THR C C 1.712 1.742 4.540 1.00 . A A . 33 THR C 1 1 13 7486 1 1 33 THR CA C 1.289 0.294 4.767 1.00 . A A . 33 THR CA 1 1 13 7487 1 1 33 THR CB C 1.574 -0.651 3.605 1.00 . A A . 33 THR CB 1 1 13 7488 1 1 33 THR CG2 C 3.006 -1.167 3.632 1.00 . A A . 33 THR CG2 1 1 13 7489 1 1 33 THR H H -0.633 -0.128 3.986 1.00 . A A . 33 THR H 1 1 13 7490 1 1 33 THR HA H 1.765 -0.077 5.655 1.00 . A A . 33 THR HA 1 1 13 7491 1 1 33 THR HB H 1.371 -0.166 2.663 1.00 . A A . 33 THR HB 1 1 13 7492 1 1 33 THR HG1 H 1.175 -2.463 4.194 1.00 . A A . 33 THR HG1 1 1 13 7493 1 1 33 THR HG21 H 3.564 -0.655 4.400 1.00 . A A . 33 THR HG21 1 1 13 7494 1 1 33 THR HG22 H 2.993 -2.229 3.829 1.00 . A A . 33 THR HG22 1 1 13 7495 1 1 33 THR HG23 H 3.454 -0.980 2.669 1.00 . A A . 33 THR HG23 1 1 13 7496 1 1 33 THR N N -0.194 0.213 4.793 1.00 . A A . 33 THR N 1 1 13 7497 1 1 33 THR O O 2.790 2.164 4.908 1.00 . A A . 33 THR O 1 1 13 7498 1 1 33 THR OG1 O 0.692 -1.753 3.766 1.00 . A A . 33 THR OG1 1 1 13 7499 1 1 34 CYS C C 0.254 4.810 4.532 1.00 . A A . 34 CYS C 1 1 13 7500 1 1 34 CYS CA C 1.132 3.923 3.647 1.00 . A A . 34 CYS CA 1 1 13 7501 1 1 34 CYS CB C 0.772 4.147 2.184 1.00 . A A . 34 CYS CB 1 1 13 7502 1 1 34 CYS H H -0.013 2.102 3.655 1.00 . A A . 34 CYS H 1 1 13 7503 1 1 34 CYS HA H 2.181 4.130 3.792 1.00 . A A . 34 CYS HA 1 1 13 7504 1 1 34 CYS HB2 H 1.030 3.256 1.647 1.00 . A A . 34 CYS HB2 1 1 13 7505 1 1 34 CYS HB3 H -0.293 4.263 2.086 1.00 . A A . 34 CYS HB3 1 1 13 7506 1 1 34 CYS N N 0.843 2.491 3.930 1.00 . A A . 34 CYS N 1 1 13 7507 1 1 34 CYS O O 0.401 6.016 4.561 1.00 . A A . 34 CYS O 1 1 13 7508 1 1 34 CYS SG S 1.635 5.589 1.506 1.00 . A A . 34 CYS SG 1 1 13 7509 1 1 35 GLU C C -2.338 6.020 5.302 1.00 . A A . 35 GLU C 1 1 13 7510 1 1 35 GLU CA C -1.551 5.017 6.133 1.00 . A A . 35 GLU CA 1 1 13 7511 1 1 35 GLU CB C -0.711 5.653 7.233 1.00 . A A . 35 GLU CB 1 1 13 7512 1 1 35 GLU CD C 0.774 4.805 9.077 1.00 . A A . 35 GLU CD 1 1 13 7513 1 1 35 GLU CG C -0.369 4.462 8.120 1.00 . A A . 35 GLU CG 1 1 13 7514 1 1 35 GLU H H -0.769 3.248 5.220 1.00 . A A . 35 GLU H 1 1 13 7515 1 1 35 GLU HA H -2.262 4.334 6.578 1.00 . A A . 35 GLU HA 1 1 13 7516 1 1 35 GLU HB2 H 0.177 6.109 6.813 1.00 . A A . 35 GLU HB2 1 1 13 7517 1 1 35 GLU HB3 H -1.286 6.363 7.807 1.00 . A A . 35 GLU HB3 1 1 13 7518 1 1 35 GLU HG2 H -1.259 4.182 8.665 1.00 . A A . 35 GLU HG2 1 1 13 7519 1 1 35 GLU HG3 H -0.081 3.642 7.475 1.00 . A A . 35 GLU HG3 1 1 13 7520 1 1 35 GLU N N -0.659 4.220 5.253 1.00 . A A . 35 GLU N 1 1 13 7521 1 1 35 GLU O O -2.711 7.096 5.726 1.00 . A A . 35 GLU O 1 1 13 7522 1 1 35 GLU OE1 O 1.909 4.827 8.630 1.00 . A A . 35 GLU OE1 1 1 13 7523 1 1 35 GLU OE2 O 0.496 5.040 10.243 1.00 . A A . 35 GLU OE2 1 1 13 7524 1 1 36 LEU C C -4.815 6.111 3.422 1.00 . A A . 36 LEU C 1 1 13 7525 1 1 36 LEU CA C -3.346 6.421 3.123 1.00 . A A . 36 LEU CA 1 1 13 7526 1 1 36 LEU CB C -2.947 5.974 1.717 1.00 . A A . 36 LEU CB 1 1 13 7527 1 1 36 LEU CD1 C -1.001 5.756 0.151 1.00 . A A . 36 LEU CD1 1 1 13 7528 1 1 36 LEU CD2 C -1.367 7.894 1.358 1.00 . A A . 36 LEU CD2 1 1 13 7529 1 1 36 LEU CG C -1.493 6.373 1.461 1.00 . A A . 36 LEU CG 1 1 13 7530 1 1 36 LEU H H -2.257 4.720 3.825 1.00 . A A . 36 LEU H 1 1 13 7531 1 1 36 LEU HA H -3.139 7.466 3.275 1.00 . A A . 36 LEU HA 1 1 13 7532 1 1 36 LEU HB2 H -3.043 4.910 1.690 1.00 . A A . 36 LEU HB2 1 1 13 7533 1 1 36 LEU HB3 H -3.577 6.383 0.948 1.00 . A A . 36 LEU HB3 1 1 13 7534 1 1 36 LEU HD11 H -1.782 5.799 -0.593 1.00 . A A . 36 LEU HD11 1 1 13 7535 1 1 36 LEU HD12 H -0.134 6.303 -0.195 1.00 . A A . 36 LEU HD12 1 1 13 7536 1 1 36 LEU HD13 H -0.717 4.728 0.323 1.00 . A A . 36 LEU HD13 1 1 13 7537 1 1 36 LEU HD21 H -1.750 8.351 2.259 1.00 . A A . 36 LEU HD21 1 1 13 7538 1 1 36 LEU HD22 H -0.326 8.155 1.237 1.00 . A A . 36 LEU HD22 1 1 13 7539 1 1 36 LEU HD23 H -1.929 8.246 0.505 1.00 . A A . 36 LEU HD23 1 1 13 7540 1 1 36 LEU HG H -0.898 6.016 2.289 1.00 . A A . 36 LEU HG 1 1 13 7541 1 1 36 LEU N N -2.581 5.603 4.094 1.00 . A A . 36 LEU N 1 1 13 7542 1 1 36 LEU O O -5.704 6.771 2.922 1.00 . A A . 36 LEU O 1 1 13 7543 1 1 37 CYS C C -6.651 4.399 6.005 1.00 . A A . 37 CYS C 1 1 13 7544 1 1 37 CYS CA C -6.518 4.806 4.537 1.00 . A A . 37 CYS CA 1 1 13 7545 1 1 37 CYS CB C -7.009 3.660 3.652 1.00 . A A . 37 CYS CB 1 1 13 7546 1 1 37 CYS H H -4.387 4.565 4.656 1.00 . A A . 37 CYS H 1 1 13 7547 1 1 37 CYS HA H -7.118 5.686 4.355 1.00 . A A . 37 CYS HA 1 1 13 7548 1 1 37 CYS HB2 H -6.253 2.890 3.605 1.00 . A A . 37 CYS HB2 1 1 13 7549 1 1 37 CYS HB3 H -7.912 3.249 4.076 1.00 . A A . 37 CYS HB3 1 1 13 7550 1 1 37 CYS N N -5.092 5.116 4.236 1.00 . A A . 37 CYS N 1 1 13 7551 1 1 37 CYS O O -6.858 5.275 6.827 1.00 . A A . 37 CYS O 1 1 13 7552 1 1 37 CYS OXT O -6.542 3.215 6.282 1.00 . A A . 37 CYS OXT 1 1 13 7553 1 1 37 CYS SG S -7.351 4.295 1.992 1.00 . A A . 37 CYS SG 1 1 14 7554 1 1 1 VAL C C -11.737 0.752 0.623 1.00 . A A . 1 VAL C 1 1 14 7555 1 1 1 VAL CA C -13.230 0.958 0.887 1.00 . A A . 1 VAL CA 1 1 14 7556 1 1 1 VAL CB C -13.489 0.932 2.395 1.00 . A A . 1 VAL CB 1 1 14 7557 1 1 1 VAL CG1 C -12.900 -0.347 2.994 1.00 . A A . 1 VAL CG1 1 1 14 7558 1 1 1 VAL CG2 C -12.822 2.148 3.042 1.00 . A A . 1 VAL CG2 1 1 14 7559 1 1 1 VAL H1 H -13.353 -0.875 -0.096 1.00 . A A . 1 VAL H1 1 1 14 7560 1 1 1 VAL H2 H -14.678 -0.535 0.914 1.00 . A A . 1 VAL H2 1 1 14 7561 1 1 1 VAL H3 H -14.520 0.249 -0.587 1.00 . A A . 1 VAL H3 1 1 14 7562 1 1 1 VAL HA H -13.539 1.911 0.484 1.00 . A A . 1 VAL HA 1 1 14 7563 1 1 1 VAL HB H -14.553 0.956 2.576 1.00 . A A . 1 VAL HB 1 1 14 7564 1 1 1 VAL HG11 H -12.805 -1.096 2.221 1.00 . A A . 1 VAL HG11 1 1 14 7565 1 1 1 VAL HG12 H -11.926 -0.133 3.410 1.00 . A A . 1 VAL HG12 1 1 14 7566 1 1 1 VAL HG13 H -13.552 -0.713 3.772 1.00 . A A . 1 VAL HG13 1 1 14 7567 1 1 1 VAL HG21 H -12.620 2.892 2.286 1.00 . A A . 1 VAL HG21 1 1 14 7568 1 1 1 VAL HG22 H -13.482 2.564 3.789 1.00 . A A . 1 VAL HG22 1 1 14 7569 1 1 1 VAL HG23 H -11.896 1.845 3.507 1.00 . A A . 1 VAL HG23 1 1 14 7570 1 1 1 VAL N N -14.004 -0.133 0.231 1.00 . A A . 1 VAL N 1 1 14 7571 1 1 1 VAL O O -11.255 -0.363 0.581 1.00 . A A . 1 VAL O 1 1 14 7572 1 1 2 CYS C C -8.890 0.927 1.362 1.00 . A A . 2 CYS C 1 1 14 7573 1 1 2 CYS CA C -9.541 1.661 0.185 1.00 . A A . 2 CYS CA 1 1 14 7574 1 1 2 CYS CB C -8.895 3.037 0.010 1.00 . A A . 2 CYS CB 1 1 14 7575 1 1 2 CYS H H -11.406 2.705 0.482 1.00 . A A . 2 CYS H 1 1 14 7576 1 1 2 CYS HA H -9.418 1.084 -0.721 1.00 . A A . 2 CYS HA 1 1 14 7577 1 1 2 CYS HB2 H -7.825 2.946 0.116 1.00 . A A . 2 CYS HB2 1 1 14 7578 1 1 2 CYS HB3 H -9.127 3.420 -0.972 1.00 . A A . 2 CYS HB3 1 1 14 7579 1 1 2 CYS N N -11.001 1.814 0.445 1.00 . A A . 2 CYS N 1 1 14 7580 1 1 2 CYS O O -9.537 0.696 2.364 1.00 . A A . 2 CYS O 1 1 14 7581 1 1 2 CYS SG S -9.526 4.176 1.268 1.00 . A A . 2 CYS SG 1 1 14 7582 1 1 3 ARG C C -5.885 -1.072 1.610 1.00 . A A . 3 ARG C 1 1 14 7583 1 1 3 ARG CA C -6.886 -0.151 2.308 1.00 . A A . 3 ARG CA 1 1 14 7584 1 1 3 ARG CB C -7.816 -1.027 3.152 1.00 . A A . 3 ARG CB 1 1 14 7585 1 1 3 ARG CD C -8.593 -3.277 2.382 1.00 . A A . 3 ARG CD 1 1 14 7586 1 1 3 ARG CG C -8.792 -1.767 2.234 1.00 . A A . 3 ARG CG 1 1 14 7587 1 1 3 ARG CZ C -9.850 -2.893 4.418 1.00 . A A . 3 ARG CZ 1 1 14 7588 1 1 3 ARG H H -7.158 0.780 0.408 1.00 . A A . 3 ARG H 1 1 14 7589 1 1 3 ARG HA H -6.362 0.558 2.931 1.00 . A A . 3 ARG HA 1 1 14 7590 1 1 3 ARG HB2 H -7.229 -1.742 3.709 1.00 . A A . 3 ARG HB2 1 1 14 7591 1 1 3 ARG HB3 H -8.376 -0.407 3.836 1.00 . A A . 3 ARG HB3 1 1 14 7592 1 1 3 ARG HD2 H -9.112 -3.790 1.586 1.00 . A A . 3 ARG HD2 1 1 14 7593 1 1 3 ARG HD3 H -7.540 -3.507 2.333 1.00 . A A . 3 ARG HD3 1 1 14 7594 1 1 3 ARG HE H -8.962 -4.625 4.021 1.00 . A A . 3 ARG HE 1 1 14 7595 1 1 3 ARG HG2 H -9.805 -1.505 2.503 1.00 . A A . 3 ARG HG2 1 1 14 7596 1 1 3 ARG HG3 H -8.606 -1.485 1.208 1.00 . A A . 3 ARG HG3 1 1 14 7597 1 1 3 ARG HH11 H -11.437 -2.957 3.198 1.00 . A A . 3 ARG HH11 1 1 14 7598 1 1 3 ARG HH12 H -11.601 -1.940 4.591 1.00 . A A . 3 ARG HH12 1 1 14 7599 1 1 3 ARG HH21 H -8.431 -2.635 5.806 1.00 . A A . 3 ARG HH21 1 1 14 7600 1 1 3 ARG HH22 H -9.903 -1.758 6.065 1.00 . A A . 3 ARG HH22 1 1 14 7601 1 1 3 ARG N N -7.636 0.570 1.237 1.00 . A A . 3 ARG N 1 1 14 7602 1 1 3 ARG NE N -9.139 -3.717 3.698 1.00 . A A . 3 ARG NE 1 1 14 7603 1 1 3 ARG NH1 N -11.057 -2.572 4.039 1.00 . A A . 3 ARG NH1 1 1 14 7604 1 1 3 ARG NH2 N -9.356 -2.390 5.516 1.00 . A A . 3 ARG NH2 1 1 14 7605 1 1 3 ARG O O -5.875 -1.162 0.398 1.00 . A A . 3 ARG O 1 1 14 7606 1 1 4 ASP C C -4.898 -3.525 0.685 1.00 . A A . 4 ASP C 1 1 14 7607 1 1 4 ASP CA C -4.080 -2.654 1.637 1.00 . A A . 4 ASP CA 1 1 14 7608 1 1 4 ASP CB C -3.343 -3.528 2.656 1.00 . A A . 4 ASP CB 1 1 14 7609 1 1 4 ASP CG C -4.348 -4.109 3.654 1.00 . A A . 4 ASP CG 1 1 14 7610 1 1 4 ASP H H -5.052 -1.692 3.313 1.00 . A A . 4 ASP H 1 1 14 7611 1 1 4 ASP HA H -3.385 -2.054 1.069 1.00 . A A . 4 ASP HA 1 1 14 7612 1 1 4 ASP HB2 H -2.839 -4.332 2.140 1.00 . A A . 4 ASP HB2 1 1 14 7613 1 1 4 ASP HB3 H -2.620 -2.931 3.190 1.00 . A A . 4 ASP HB3 1 1 14 7614 1 1 4 ASP N N -5.045 -1.760 2.335 1.00 . A A . 4 ASP N 1 1 14 7615 1 1 4 ASP O O -6.109 -3.564 0.789 1.00 . A A . 4 ASP O 1 1 14 7616 1 1 4 ASP OD1 O -5.495 -4.279 3.277 1.00 . A A . 4 ASP OD1 1 1 14 7617 1 1 4 ASP OD2 O -3.951 -4.372 4.777 1.00 . A A . 4 ASP OD2 1 1 14 7618 1 1 5 TRP C C -4.386 -6.247 -1.650 1.00 . A A . 5 TRP C 1 1 14 7619 1 1 5 TRP CA C -5.176 -5.048 -1.128 1.00 . A A . 5 TRP CA 1 1 14 7620 1 1 5 TRP CB C -5.665 -4.178 -2.285 1.00 . A A . 5 TRP CB 1 1 14 7621 1 1 5 TRP CD1 C -7.260 -2.319 -1.648 1.00 . A A . 5 TRP CD1 1 1 14 7622 1 1 5 TRP CD2 C -8.268 -4.323 -1.765 1.00 . A A . 5 TRP CD2 1 1 14 7623 1 1 5 TRP CE2 C -9.267 -3.385 -1.403 1.00 . A A . 5 TRP CE2 1 1 14 7624 1 1 5 TRP CE3 C -8.641 -5.669 -1.905 1.00 . A A . 5 TRP CE3 1 1 14 7625 1 1 5 TRP CG C -7.000 -3.618 -1.916 1.00 . A A . 5 TRP CG 1 1 14 7626 1 1 5 TRP CH2 C -10.942 -5.121 -1.334 1.00 . A A . 5 TRP CH2 1 1 14 7627 1 1 5 TRP CZ2 C -10.592 -3.775 -1.189 1.00 . A A . 5 TRP CZ2 1 1 14 7628 1 1 5 TRP CZ3 C -9.969 -6.063 -1.691 1.00 . A A . 5 TRP CZ3 1 1 14 7629 1 1 5 TRP H H -3.325 -4.221 -0.357 1.00 . A A . 5 TRP H 1 1 14 7630 1 1 5 TRP HA H -6.035 -5.396 -0.559 1.00 . A A . 5 TRP HA 1 1 14 7631 1 1 5 TRP HB2 H -4.961 -3.376 -2.449 1.00 . A A . 5 TRP HB2 1 1 14 7632 1 1 5 TRP HB3 H -5.758 -4.773 -3.182 1.00 . A A . 5 TRP HB3 1 1 14 7633 1 1 5 TRP HD1 H -6.536 -1.519 -1.669 1.00 . A A . 5 TRP HD1 1 1 14 7634 1 1 5 TRP HE1 H -9.042 -1.334 -1.116 1.00 . A A . 5 TRP HE1 1 1 14 7635 1 1 5 TRP HE3 H -7.897 -6.402 -2.180 1.00 . A A . 5 TRP HE3 1 1 14 7636 1 1 5 TRP HH2 H -11.963 -5.435 -1.171 1.00 . A A . 5 TRP HH2 1 1 14 7637 1 1 5 TRP HZ2 H -11.338 -3.043 -0.914 1.00 . A A . 5 TRP HZ2 1 1 14 7638 1 1 5 TRP HZ3 H -10.243 -7.101 -1.802 1.00 . A A . 5 TRP HZ3 1 1 14 7639 1 1 5 TRP N N -4.304 -4.227 -0.242 1.00 . A A . 5 TRP N 1 1 14 7640 1 1 5 TRP NE1 N -8.600 -2.177 -1.346 1.00 . A A . 5 TRP NE1 1 1 14 7641 1 1 5 TRP O O -4.946 -7.303 -1.867 1.00 . A A . 5 TRP O 1 1 14 7642 1 1 6 PHE C C -2.003 -8.058 -1.079 1.00 . A A . 6 PHE C 1 1 14 7643 1 1 6 PHE CA C -2.351 -7.302 -2.357 1.00 . A A . 6 PHE CA 1 1 14 7644 1 1 6 PHE CB C -1.018 -6.806 -2.903 1.00 . A A . 6 PHE CB 1 1 14 7645 1 1 6 PHE CD1 C -2.356 -5.814 -4.771 1.00 . A A . 6 PHE CD1 1 1 14 7646 1 1 6 PHE CD2 C -0.341 -4.697 -4.017 1.00 . A A . 6 PHE CD2 1 1 14 7647 1 1 6 PHE CE1 C -2.552 -4.818 -5.718 1.00 . A A . 6 PHE CE1 1 1 14 7648 1 1 6 PHE CE2 C -0.530 -3.700 -4.960 1.00 . A A . 6 PHE CE2 1 1 14 7649 1 1 6 PHE CG C -1.251 -5.744 -3.929 1.00 . A A . 6 PHE CG 1 1 14 7650 1 1 6 PHE CZ C -1.638 -3.763 -5.810 1.00 . A A . 6 PHE CZ 1 1 14 7651 1 1 6 PHE H H -2.596 -5.299 -1.695 1.00 . A A . 6 PHE H 1 1 14 7652 1 1 6 PHE HA H -2.912 -7.848 -3.102 1.00 . A A . 6 PHE HA 1 1 14 7653 1 1 6 PHE HB2 H -0.450 -6.371 -2.098 1.00 . A A . 6 PHE HB2 1 1 14 7654 1 1 6 PHE HB3 H -0.473 -7.619 -3.349 1.00 . A A . 6 PHE HB3 1 1 14 7655 1 1 6 PHE HD1 H -3.056 -6.625 -4.698 1.00 . A A . 6 PHE HD1 1 1 14 7656 1 1 6 PHE HD2 H 0.510 -4.646 -3.364 1.00 . A A . 6 PHE HD2 1 1 14 7657 1 1 6 PHE HE1 H -3.410 -4.882 -6.364 1.00 . A A . 6 PHE HE1 1 1 14 7658 1 1 6 PHE HE2 H 0.190 -2.903 -5.005 1.00 . A A . 6 PHE HE2 1 1 14 7659 1 1 6 PHE HZ H -1.788 -2.995 -6.540 1.00 . A A . 6 PHE HZ 1 1 14 7660 1 1 6 PHE N N -3.099 -6.126 -1.856 1.00 . A A . 6 PHE N 1 1 14 7661 1 1 6 PHE O O -2.778 -8.077 -0.143 1.00 . A A . 6 PHE O 1 1 14 7662 1 1 7 LYS C C -0.281 -8.222 1.229 1.00 . A A . 7 LYS C 1 1 14 7663 1 1 7 LYS CA C -0.558 -9.378 0.269 1.00 . A A . 7 LYS CA 1 1 14 7664 1 1 7 LYS CB C 0.695 -10.245 0.107 1.00 . A A . 7 LYS CB 1 1 14 7665 1 1 7 LYS CD C -0.141 -12.565 0.519 1.00 . A A . 7 LYS CD 1 1 14 7666 1 1 7 LYS CE C -0.595 -13.498 1.643 1.00 . A A . 7 LYS CE 1 1 14 7667 1 1 7 LYS CG C 0.652 -11.397 1.111 1.00 . A A . 7 LYS CG 1 1 14 7668 1 1 7 LYS H H -0.215 -8.659 -1.741 1.00 . A A . 7 LYS H 1 1 14 7669 1 1 7 LYS HA H -1.418 -9.946 0.597 1.00 . A A . 7 LYS HA 1 1 14 7670 1 1 7 LYS HB2 H 0.730 -10.639 -0.898 1.00 . A A . 7 LYS HB2 1 1 14 7671 1 1 7 LYS HB3 H 1.574 -9.647 0.293 1.00 . A A . 7 LYS HB3 1 1 14 7672 1 1 7 LYS HD2 H -1.004 -12.182 -0.006 1.00 . A A . 7 LYS HD2 1 1 14 7673 1 1 7 LYS HD3 H 0.486 -13.116 -0.167 1.00 . A A . 7 LYS HD3 1 1 14 7674 1 1 7 LYS HE2 H 0.230 -14.128 1.943 1.00 . A A . 7 LYS HE2 1 1 14 7675 1 1 7 LYS HE3 H -0.925 -12.911 2.487 1.00 . A A . 7 LYS HE3 1 1 14 7676 1 1 7 LYS HG2 H 1.660 -11.719 1.332 1.00 . A A . 7 LYS HG2 1 1 14 7677 1 1 7 LYS HG3 H 0.170 -11.068 2.020 1.00 . A A . 7 LYS HG3 1 1 14 7678 1 1 7 LYS HZ1 H -1.654 -14.449 0.126 1.00 . A A . 7 LYS HZ1 1 1 14 7679 1 1 7 LYS HZ2 H -1.663 -15.287 1.605 1.00 . A A . 7 LYS HZ2 1 1 14 7680 1 1 7 LYS HZ3 H -2.625 -13.906 1.412 1.00 . A A . 7 LYS HZ3 1 1 14 7681 1 1 7 LYS N N -0.857 -8.671 -1.000 1.00 . A A . 7 LYS N 1 1 14 7682 1 1 7 LYS NZ N -1.719 -14.348 1.159 1.00 . A A . 7 LYS NZ 1 1 14 7683 1 1 7 LYS O O 0.210 -7.193 0.807 1.00 . A A . 7 LYS O 1 1 14 7684 1 1 8 GLU C C 1.196 -6.764 3.250 1.00 . A A . 8 GLU C 1 1 14 7685 1 1 8 GLU CA C -0.274 -7.157 3.379 1.00 . A A . 8 GLU CA 1 1 14 7686 1 1 8 GLU CB C -0.605 -7.499 4.831 1.00 . A A . 8 GLU CB 1 1 14 7687 1 1 8 GLU CD C -2.822 -8.519 5.382 1.00 . A A . 8 GLU CD 1 1 14 7688 1 1 8 GLU CG C -2.084 -7.210 5.098 1.00 . A A . 8 GLU CG 1 1 14 7689 1 1 8 GLU H H -0.966 -9.143 2.858 1.00 . A A . 8 GLU H 1 1 14 7690 1 1 8 GLU HA H -0.855 -6.303 3.065 1.00 . A A . 8 GLU HA 1 1 14 7691 1 1 8 GLU HB2 H -0.401 -8.545 5.010 1.00 . A A . 8 GLU HB2 1 1 14 7692 1 1 8 GLU HB3 H -0.002 -6.895 5.493 1.00 . A A . 8 GLU HB3 1 1 14 7693 1 1 8 GLU HG2 H -2.172 -6.550 5.948 1.00 . A A . 8 GLU HG2 1 1 14 7694 1 1 8 GLU HG3 H -2.518 -6.740 4.228 1.00 . A A . 8 GLU HG3 1 1 14 7695 1 1 8 GLU N N -0.567 -8.323 2.495 1.00 . A A . 8 GLU N 1 1 14 7696 1 1 8 GLU O O 1.583 -5.684 3.652 1.00 . A A . 8 GLU O 1 1 14 7697 1 1 8 GLU OE1 O -2.645 -9.454 4.619 1.00 . A A . 8 GLU OE1 1 1 14 7698 1 1 8 GLU OE2 O -3.551 -8.565 6.359 1.00 . A A . 8 GLU OE2 1 1 14 7699 1 1 9 THR C C 3.754 -6.609 1.215 1.00 . A A . 9 THR C 1 1 14 7700 1 1 9 THR CA C 3.448 -7.194 2.593 1.00 . A A . 9 THR CA 1 1 14 7701 1 1 9 THR CB C 4.332 -8.370 2.991 1.00 . A A . 9 THR CB 1 1 14 7702 1 1 9 THR CG2 C 4.438 -8.285 4.514 1.00 . A A . 9 THR CG2 1 1 14 7703 1 1 9 THR H H 1.733 -8.478 2.375 1.00 . A A . 9 THR H 1 1 14 7704 1 1 9 THR HA H 3.596 -6.395 3.307 1.00 . A A . 9 THR HA 1 1 14 7705 1 1 9 THR HB H 5.315 -8.265 2.568 1.00 . A A . 9 THR HB 1 1 14 7706 1 1 9 THR HG1 H 4.393 -10.124 2.151 1.00 . A A . 9 THR HG1 1 1 14 7707 1 1 9 THR HG21 H 3.746 -7.526 4.867 1.00 . A A . 9 THR HG21 1 1 14 7708 1 1 9 THR HG22 H 4.177 -9.236 4.953 1.00 . A A . 9 THR HG22 1 1 14 7709 1 1 9 THR HG23 H 5.444 -8.013 4.794 1.00 . A A . 9 THR HG23 1 1 14 7710 1 1 9 THR N N 2.027 -7.604 2.704 1.00 . A A . 9 THR N 1 1 14 7711 1 1 9 THR O O 4.693 -5.856 1.078 1.00 . A A . 9 THR O 1 1 14 7712 1 1 9 THR OG1 O 3.721 -9.583 2.571 1.00 . A A . 9 THR OG1 1 1 14 7713 1 1 10 ALA C C 3.276 -4.846 -0.815 1.00 . A A . 10 ALA C 1 1 14 7714 1 1 10 ALA CA C 3.284 -6.330 -1.138 1.00 . A A . 10 ALA CA 1 1 14 7715 1 1 10 ALA CB C 2.123 -6.569 -2.109 1.00 . A A . 10 ALA CB 1 1 14 7716 1 1 10 ALA H H 2.231 -7.522 0.335 1.00 . A A . 10 ALA H 1 1 14 7717 1 1 10 ALA HA H 4.246 -6.601 -1.539 1.00 . A A . 10 ALA HA 1 1 14 7718 1 1 10 ALA HB1 H 1.249 -6.850 -1.538 1.00 . A A . 10 ALA HB1 1 1 14 7719 1 1 10 ALA HB2 H 1.904 -5.658 -2.655 1.00 . A A . 10 ALA HB2 1 1 14 7720 1 1 10 ALA HB3 H 2.370 -7.355 -2.805 1.00 . A A . 10 ALA HB3 1 1 14 7721 1 1 10 ALA N N 2.990 -6.919 0.204 1.00 . A A . 10 ALA N 1 1 14 7722 1 1 10 ALA O O 4.113 -4.060 -1.213 1.00 . A A . 10 ALA O 1 1 14 7723 1 1 11 CYS C C 3.340 -2.718 1.134 1.00 . A A . 11 CYS C 1 1 14 7724 1 1 11 CYS CA C 2.079 -3.120 0.374 1.00 . A A . 11 CYS CA 1 1 14 7725 1 1 11 CYS CB C 0.770 -3.124 1.164 1.00 . A A . 11 CYS CB 1 1 14 7726 1 1 11 CYS H H 1.631 -5.199 0.229 1.00 . A A . 11 CYS H 1 1 14 7727 1 1 11 CYS HA H 2.011 -2.485 -0.493 1.00 . A A . 11 CYS HA 1 1 14 7728 1 1 11 CYS HB2 H 0.787 -3.905 1.913 1.00 . A A . 11 CYS HB2 1 1 14 7729 1 1 11 CYS HB3 H 0.599 -2.167 1.626 1.00 . A A . 11 CYS HB3 1 1 14 7730 1 1 11 CYS N N 2.272 -4.516 -0.060 1.00 . A A . 11 CYS N 1 1 14 7731 1 1 11 CYS O O 3.816 -1.623 0.963 1.00 . A A . 11 CYS O 1 1 14 7732 1 1 11 CYS SG S -0.552 -3.449 -0.031 1.00 . A A . 11 CYS SG 1 1 14 7733 1 1 12 ARG C C 6.235 -2.824 1.692 1.00 . A A . 12 ARG C 1 1 14 7734 1 1 12 ARG CA C 5.131 -3.181 2.691 1.00 . A A . 12 ARG CA 1 1 14 7735 1 1 12 ARG CB C 5.649 -4.357 3.513 1.00 . A A . 12 ARG CB 1 1 14 7736 1 1 12 ARG CD C 7.671 -4.860 4.904 1.00 . A A . 12 ARG CD 1 1 14 7737 1 1 12 ARG CG C 7.155 -4.149 3.652 1.00 . A A . 12 ARG CG 1 1 14 7738 1 1 12 ARG CZ C 10.060 -5.075 5.235 1.00 . A A . 12 ARG CZ 1 1 14 7739 1 1 12 ARG H H 3.498 -4.448 2.074 1.00 . A A . 12 ARG H 1 1 14 7740 1 1 12 ARG HA H 4.964 -2.343 3.346 1.00 . A A . 12 ARG HA 1 1 14 7741 1 1 12 ARG HB2 H 5.171 -4.365 4.484 1.00 . A A . 12 ARG HB2 1 1 14 7742 1 1 12 ARG HB3 H 5.467 -5.288 2.996 1.00 . A A . 12 ARG HB3 1 1 14 7743 1 1 12 ARG HD2 H 7.782 -4.145 5.705 1.00 . A A . 12 ARG HD2 1 1 14 7744 1 1 12 ARG HD3 H 6.968 -5.625 5.199 1.00 . A A . 12 ARG HD3 1 1 14 7745 1 1 12 ARG HE H 9.056 -6.208 3.951 1.00 . A A . 12 ARG HE 1 1 14 7746 1 1 12 ARG HG2 H 7.637 -4.544 2.771 1.00 . A A . 12 ARG HG2 1 1 14 7747 1 1 12 ARG HG3 H 7.357 -3.089 3.726 1.00 . A A . 12 ARG HG3 1 1 14 7748 1 1 12 ARG HH11 H 9.270 -5.300 7.060 1.00 . A A . 12 ARG HH11 1 1 14 7749 1 1 12 ARG HH12 H 10.896 -4.707 7.017 1.00 . A A . 12 ARG HH12 1 1 14 7750 1 1 12 ARG HH21 H 11.102 -4.752 3.556 1.00 . A A . 12 ARG HH21 1 1 14 7751 1 1 12 ARG HH22 H 11.934 -4.397 5.033 1.00 . A A . 12 ARG HH22 1 1 14 7752 1 1 12 ARG N N 3.895 -3.564 1.953 1.00 . A A . 12 ARG N 1 1 14 7753 1 1 12 ARG NE N 8.991 -5.487 4.612 1.00 . A A . 12 ARG NE 1 1 14 7754 1 1 12 ARG NH1 N 10.076 -5.023 6.539 1.00 . A A . 12 ARG NH1 1 1 14 7755 1 1 12 ARG NH2 N 11.114 -4.712 4.555 1.00 . A A . 12 ARG NH2 1 1 14 7756 1 1 12 ARG O O 7.084 -1.996 1.955 1.00 . A A . 12 ARG O 1 1 14 7757 1 1 13 HIS C C 6.996 -1.806 -1.144 1.00 . A A . 13 HIS C 1 1 14 7758 1 1 13 HIS CA C 7.278 -3.146 -0.473 1.00 . A A . 13 HIS CA 1 1 14 7759 1 1 13 HIS CB C 7.326 -4.277 -1.502 1.00 . A A . 13 HIS CB 1 1 14 7760 1 1 13 HIS CD2 C 7.312 -2.897 -3.710 1.00 . A A . 13 HIS CD2 1 1 14 7761 1 1 13 HIS CE1 C 9.307 -3.339 -4.412 1.00 . A A . 13 HIS CE1 1 1 14 7762 1 1 13 HIS CG C 7.882 -3.726 -2.783 1.00 . A A . 13 HIS CG 1 1 14 7763 1 1 13 HIS H H 5.546 -4.107 0.344 1.00 . A A . 13 HIS H 1 1 14 7764 1 1 13 HIS HA H 8.238 -3.067 0.006 1.00 . A A . 13 HIS HA 1 1 14 7765 1 1 13 HIS HB2 H 7.960 -5.072 -1.138 1.00 . A A . 13 HIS HB2 1 1 14 7766 1 1 13 HIS HB3 H 6.330 -4.654 -1.677 1.00 . A A . 13 HIS HB3 1 1 14 7767 1 1 13 HIS HD1 H 9.827 -4.565 -2.813 1.00 . A A . 13 HIS HD1 1 1 14 7768 1 1 13 HIS HD2 H 6.314 -2.500 -3.624 1.00 . A A . 13 HIS HD2 1 1 14 7769 1 1 13 HIS HE1 H 10.205 -3.355 -5.009 1.00 . A A . 13 HIS HE1 1 1 14 7770 1 1 13 HIS N N 6.234 -3.443 0.543 1.00 . A A . 13 HIS N 1 1 14 7771 1 1 13 HIS ND1 N 9.158 -3.998 -3.249 1.00 . A A . 13 HIS ND1 1 1 14 7772 1 1 13 HIS NE2 N 8.211 -2.651 -4.744 1.00 . A A . 13 HIS NE2 1 1 14 7773 1 1 13 HIS O O 7.883 -1.184 -1.677 1.00 . A A . 13 HIS O 1 1 14 7774 1 1 14 ALA C C 5.585 1.161 -0.828 1.00 . A A . 14 ALA C 1 1 14 7775 1 1 14 ALA CA C 5.552 -0.014 -1.818 1.00 . A A . 14 ALA CA 1 1 14 7776 1 1 14 ALA CB C 4.177 -0.100 -2.479 1.00 . A A . 14 ALA CB 1 1 14 7777 1 1 14 ALA H H 5.062 -1.839 -0.717 1.00 . A A . 14 ALA H 1 1 14 7778 1 1 14 ALA HA H 6.298 0.166 -2.586 1.00 . A A . 14 ALA HA 1 1 14 7779 1 1 14 ALA HB1 H 3.508 -0.631 -1.813 1.00 . A A . 14 ALA HB1 1 1 14 7780 1 1 14 ALA HB2 H 3.794 0.892 -2.661 1.00 . A A . 14 ALA HB2 1 1 14 7781 1 1 14 ALA HB3 H 4.260 -0.641 -3.410 1.00 . A A . 14 ALA HB3 1 1 14 7782 1 1 14 ALA N N 5.788 -1.330 -1.146 1.00 . A A . 14 ALA N 1 1 14 7783 1 1 14 ALA O O 5.917 2.271 -1.193 1.00 . A A . 14 ALA O 1 1 14 7784 1 1 15 LYS C C 6.689 2.074 1.983 1.00 . A A . 15 LYS C 1 1 14 7785 1 1 15 LYS CA C 5.258 2.019 1.438 1.00 . A A . 15 LYS CA 1 1 14 7786 1 1 15 LYS CB C 4.209 1.628 2.486 1.00 . A A . 15 LYS CB 1 1 14 7787 1 1 15 LYS CD C 2.479 1.189 0.721 1.00 . A A . 15 LYS CD 1 1 14 7788 1 1 15 LYS CE C 2.501 1.919 -0.622 1.00 . A A . 15 LYS CE 1 1 14 7789 1 1 15 LYS CG C 2.919 2.127 1.844 1.00 . A A . 15 LYS CG 1 1 14 7790 1 1 15 LYS H H 4.993 0.042 0.679 1.00 . A A . 15 LYS H 1 1 14 7791 1 1 15 LYS HA H 4.970 2.972 0.980 1.00 . A A . 15 LYS HA 1 1 14 7792 1 1 15 LYS HB2 H 4.176 0.562 2.640 1.00 . A A . 15 LYS HB2 1 1 14 7793 1 1 15 LYS HB3 H 4.328 2.135 3.433 1.00 . A A . 15 LYS HB3 1 1 14 7794 1 1 15 LYS HD2 H 3.148 0.344 0.679 1.00 . A A . 15 LYS HD2 1 1 14 7795 1 1 15 LYS HD3 H 1.477 0.840 0.917 1.00 . A A . 15 LYS HD3 1 1 14 7796 1 1 15 LYS HE2 H 3.507 2.238 -0.845 1.00 . A A . 15 LYS HE2 1 1 14 7797 1 1 15 LYS HE3 H 2.165 1.244 -1.396 1.00 . A A . 15 LYS HE3 1 1 14 7798 1 1 15 LYS HG2 H 2.141 2.190 2.586 1.00 . A A . 15 LYS HG2 1 1 14 7799 1 1 15 LYS HG3 H 3.116 3.103 1.429 1.00 . A A . 15 LYS HG3 1 1 14 7800 1 1 15 LYS HZ1 H 1.821 3.709 0.240 1.00 . A A . 15 LYS HZ1 1 1 14 7801 1 1 15 LYS HZ2 H 1.733 3.658 -1.449 1.00 . A A . 15 LYS HZ2 1 1 14 7802 1 1 15 LYS HZ3 H 0.616 2.790 -0.501 1.00 . A A . 15 LYS HZ3 1 1 14 7803 1 1 15 LYS N N 5.252 0.941 0.413 1.00 . A A . 15 LYS N 1 1 14 7804 1 1 15 LYS NZ N 1.602 3.107 -0.578 1.00 . A A . 15 LYS NZ 1 1 14 7805 1 1 15 LYS O O 7.137 3.111 2.429 1.00 . A A . 15 LYS O 1 1 14 7806 1 1 16 SER C C 9.851 1.333 1.392 1.00 . A A . 16 SER C 1 1 14 7807 1 1 16 SER CA C 8.823 1.018 2.484 1.00 . A A . 16 SER CA 1 1 14 7808 1 1 16 SER CB C 9.169 -0.374 2.997 1.00 . A A . 16 SER CB 1 1 14 7809 1 1 16 SER H H 7.105 0.120 1.608 1.00 . A A . 16 SER H 1 1 14 7810 1 1 16 SER HA H 8.915 1.713 3.298 1.00 . A A . 16 SER HA 1 1 14 7811 1 1 16 SER HB2 H 8.276 -0.874 3.334 1.00 . A A . 16 SER HB2 1 1 14 7812 1 1 16 SER HB3 H 9.590 -0.929 2.166 1.00 . A A . 16 SER HB3 1 1 14 7813 1 1 16 SER HG H 10.372 -1.159 4.310 1.00 . A A . 16 SER HG 1 1 14 7814 1 1 16 SER N N 7.428 0.984 1.960 1.00 . A A . 16 SER N 1 1 14 7815 1 1 16 SER O O 10.965 1.722 1.684 1.00 . A A . 16 SER O 1 1 14 7816 1 1 16 SER OG O 10.090 -0.272 4.074 1.00 . A A . 16 SER OG 1 1 14 7817 1 1 17 LEU C C 10.507 2.925 -1.361 1.00 . A A . 17 LEU C 1 1 14 7818 1 1 17 LEU CA C 10.507 1.460 -0.925 1.00 . A A . 17 LEU CA 1 1 14 7819 1 1 17 LEU CB C 10.202 0.483 -2.062 1.00 . A A . 17 LEU CB 1 1 14 7820 1 1 17 LEU CD1 C 9.780 2.112 -3.932 1.00 . A A . 17 LEU CD1 1 1 14 7821 1 1 17 LEU CD2 C 8.763 -0.193 -3.876 1.00 . A A . 17 LEU CD2 1 1 14 7822 1 1 17 LEU CG C 9.177 1.018 -3.051 1.00 . A A . 17 LEU CG 1 1 14 7823 1 1 17 LEU H H 8.617 0.847 -0.085 1.00 . A A . 17 LEU H 1 1 14 7824 1 1 17 LEU HA H 11.490 1.236 -0.561 1.00 . A A . 17 LEU HA 1 1 14 7825 1 1 17 LEU HB2 H 11.093 0.229 -2.606 1.00 . A A . 17 LEU HB2 1 1 14 7826 1 1 17 LEU HB3 H 9.794 -0.413 -1.620 1.00 . A A . 17 LEU HB3 1 1 14 7827 1 1 17 LEU HD11 H 10.814 2.239 -3.650 1.00 . A A . 17 LEU HD11 1 1 14 7828 1 1 17 LEU HD12 H 9.713 1.828 -4.971 1.00 . A A . 17 LEU HD12 1 1 14 7829 1 1 17 LEU HD13 H 9.242 3.034 -3.760 1.00 . A A . 17 LEU HD13 1 1 14 7830 1 1 17 LEU HD21 H 9.400 -1.026 -3.616 1.00 . A A . 17 LEU HD21 1 1 14 7831 1 1 17 LEU HD22 H 7.739 -0.447 -3.641 1.00 . A A . 17 LEU HD22 1 1 14 7832 1 1 17 LEU HD23 H 8.839 0.026 -4.931 1.00 . A A . 17 LEU HD23 1 1 14 7833 1 1 17 LEU HG H 8.324 1.376 -2.507 1.00 . A A . 17 LEU HG 1 1 14 7834 1 1 17 LEU N N 9.515 1.167 0.145 1.00 . A A . 17 LEU N 1 1 14 7835 1 1 17 LEU O O 11.536 3.558 -1.485 1.00 . A A . 17 LEU O 1 1 14 7836 1 1 18 GLY C C 7.841 5.074 -2.702 1.00 . A A . 18 GLY C 1 1 14 7837 1 1 18 GLY CA C 9.200 4.868 -2.025 1.00 . A A . 18 GLY CA 1 1 14 7838 1 1 18 GLY H H 8.558 2.892 -1.477 1.00 . A A . 18 GLY H 1 1 14 7839 1 1 18 GLY HA2 H 9.277 5.513 -1.162 1.00 . A A . 18 GLY HA2 1 1 14 7840 1 1 18 GLY HA3 H 9.981 5.111 -2.729 1.00 . A A . 18 GLY HA3 1 1 14 7841 1 1 18 GLY N N 9.344 3.452 -1.593 1.00 . A A . 18 GLY N 1 1 14 7842 1 1 18 GLY O O 7.382 6.193 -2.821 1.00 . A A . 18 GLY O 1 1 14 7843 1 1 19 ASN C C 4.774 4.520 -2.788 1.00 . A A . 19 ASN C 1 1 14 7844 1 1 19 ASN CA C 5.868 4.232 -3.810 1.00 . A A . 19 ASN CA 1 1 14 7845 1 1 19 ASN CB C 5.374 2.945 -4.452 1.00 . A A . 19 ASN CB 1 1 14 7846 1 1 19 ASN CG C 6.431 2.013 -5.041 1.00 . A A . 19 ASN CG 1 1 14 7847 1 1 19 ASN H H 7.512 3.123 -3.082 1.00 . A A . 19 ASN H 1 1 14 7848 1 1 19 ASN HA H 5.914 4.994 -4.571 1.00 . A A . 19 ASN HA 1 1 14 7849 1 1 19 ASN HB2 H 4.753 2.400 -3.766 1.00 . A A . 19 ASN HB2 1 1 14 7850 1 1 19 ASN HB3 H 4.716 3.243 -5.231 1.00 . A A . 19 ASN HB3 1 1 14 7851 1 1 19 ASN HD21 H 5.517 0.404 -4.324 1.00 . A A . 19 ASN HD21 1 1 14 7852 1 1 19 ASN HD22 H 6.917 0.098 -5.223 1.00 . A A . 19 ASN HD22 1 1 14 7853 1 1 19 ASN N N 7.181 4.038 -3.154 1.00 . A A . 19 ASN N 1 1 14 7854 1 1 19 ASN ND2 N 6.280 0.733 -4.842 1.00 . A A . 19 ASN ND2 1 1 14 7855 1 1 19 ASN O O 3.628 4.600 -3.182 1.00 . A A . 19 ASN O 1 1 14 7856 1 1 19 ASN OD1 O 7.376 2.440 -5.673 1.00 . A A . 19 ASN OD1 1 1 14 7857 1 1 20 CYS C C 2.972 5.869 -1.076 1.00 . A A . 20 CYS C 1 1 14 7858 1 1 20 CYS CA C 4.047 4.935 -0.516 1.00 . A A . 20 CYS CA 1 1 14 7859 1 1 20 CYS CB C 4.585 5.622 0.737 1.00 . A A . 20 CYS CB 1 1 14 7860 1 1 20 CYS H H 6.051 4.578 -1.274 1.00 . A A . 20 CYS H 1 1 14 7861 1 1 20 CYS HA H 3.595 3.999 -0.232 1.00 . A A . 20 CYS HA 1 1 14 7862 1 1 20 CYS HB2 H 4.759 4.888 1.513 1.00 . A A . 20 CYS HB2 1 1 14 7863 1 1 20 CYS HB3 H 5.492 6.162 0.515 1.00 . A A . 20 CYS HB3 1 1 14 7864 1 1 20 CYS N N 5.108 4.661 -1.533 1.00 . A A . 20 CYS N 1 1 14 7865 1 1 20 CYS O O 1.789 5.680 -0.872 1.00 . A A . 20 CYS O 1 1 14 7866 1 1 20 CYS SG S 3.303 6.790 1.249 1.00 . A A . 20 CYS SG 1 1 14 7867 1 1 21 ARG C C 2.664 8.133 -3.843 1.00 . A A . 21 ARG C 1 1 14 7868 1 1 21 ARG CA C 2.409 7.846 -2.362 1.00 . A A . 21 ARG CA 1 1 14 7869 1 1 21 ARG CB C 2.592 9.167 -1.638 1.00 . A A . 21 ARG CB 1 1 14 7870 1 1 21 ARG CD C 0.881 10.942 -1.205 1.00 . A A . 21 ARG CD 1 1 14 7871 1 1 21 ARG CG C 1.311 9.512 -0.875 1.00 . A A . 21 ARG CG 1 1 14 7872 1 1 21 ARG CZ C 2.460 12.532 -0.288 1.00 . A A . 21 ARG CZ 1 1 14 7873 1 1 21 ARG H H 4.348 7.008 -1.922 1.00 . A A . 21 ARG H 1 1 14 7874 1 1 21 ARG HA H 1.398 7.520 -2.196 1.00 . A A . 21 ARG HA 1 1 14 7875 1 1 21 ARG HB2 H 3.437 9.061 -0.975 1.00 . A A . 21 ARG HB2 1 1 14 7876 1 1 21 ARG HB3 H 2.800 9.919 -2.381 1.00 . A A . 21 ARG HB3 1 1 14 7877 1 1 21 ARG HD2 H 1.313 11.239 -2.150 1.00 . A A . 21 ARG HD2 1 1 14 7878 1 1 21 ARG HD3 H -0.196 10.987 -1.271 1.00 . A A . 21 ARG HD3 1 1 14 7879 1 1 21 ARG HE H 0.830 11.962 0.691 1.00 . A A . 21 ARG HE 1 1 14 7880 1 1 21 ARG HG2 H 0.531 8.820 -1.165 1.00 . A A . 21 ARG HG2 1 1 14 7881 1 1 21 ARG HG3 H 1.490 9.429 0.187 1.00 . A A . 21 ARG HG3 1 1 14 7882 1 1 21 ARG HH11 H 1.649 13.879 -1.528 1.00 . A A . 21 ARG HH11 1 1 14 7883 1 1 21 ARG HH12 H 3.330 14.101 -1.177 1.00 . A A . 21 ARG HH12 1 1 14 7884 1 1 21 ARG HH21 H 3.531 11.344 0.916 1.00 . A A . 21 ARG HH21 1 1 14 7885 1 1 21 ARG HH22 H 4.396 12.667 0.207 1.00 . A A . 21 ARG HH22 1 1 14 7886 1 1 21 ARG N N 3.388 6.883 -1.781 1.00 . A A . 21 ARG N 1 1 14 7887 1 1 21 ARG NE N 1.352 11.861 -0.131 1.00 . A A . 21 ARG NE 1 1 14 7888 1 1 21 ARG NH1 N 2.482 13.586 -1.058 1.00 . A A . 21 ARG NH1 1 1 14 7889 1 1 21 ARG NH2 N 3.547 12.152 0.326 1.00 . A A . 21 ARG NH2 1 1 14 7890 1 1 21 ARG O O 2.072 9.024 -4.420 1.00 . A A . 21 ARG O 1 1 14 7891 1 1 22 THR C C 3.139 6.597 -6.782 1.00 . A A . 22 THR C 1 1 14 7892 1 1 22 THR CA C 3.815 7.648 -5.904 1.00 . A A . 22 THR CA 1 1 14 7893 1 1 22 THR CB C 5.327 7.617 -6.144 1.00 . A A . 22 THR CB 1 1 14 7894 1 1 22 THR CG2 C 6.051 8.310 -4.989 1.00 . A A . 22 THR CG2 1 1 14 7895 1 1 22 THR H H 3.997 6.690 -3.973 1.00 . A A . 22 THR H 1 1 14 7896 1 1 22 THR HA H 3.441 8.625 -6.172 1.00 . A A . 22 THR HA 1 1 14 7897 1 1 22 THR HB H 5.559 8.137 -7.061 1.00 . A A . 22 THR HB 1 1 14 7898 1 1 22 THR HG1 H 5.938 6.079 -7.165 1.00 . A A . 22 THR HG1 1 1 14 7899 1 1 22 THR HG21 H 5.381 9.012 -4.514 1.00 . A A . 22 THR HG21 1 1 14 7900 1 1 22 THR HG22 H 6.369 7.572 -4.267 1.00 . A A . 22 THR HG22 1 1 14 7901 1 1 22 THR HG23 H 6.914 8.836 -5.369 1.00 . A A . 22 THR HG23 1 1 14 7902 1 1 22 THR N N 3.535 7.397 -4.463 1.00 . A A . 22 THR N 1 1 14 7903 1 1 22 THR O O 3.176 6.687 -7.992 1.00 . A A . 22 THR O 1 1 14 7904 1 1 22 THR OG1 O 5.756 6.266 -6.241 1.00 . A A . 22 THR OG1 1 1 14 7905 1 1 23 SER C C 0.376 4.533 -6.744 1.00 . A A . 23 SER C 1 1 14 7906 1 1 23 SER CA C 1.871 4.585 -7.085 1.00 . A A . 23 SER CA 1 1 14 7907 1 1 23 SER CB C 2.631 3.287 -6.822 1.00 . A A . 23 SER CB 1 1 14 7908 1 1 23 SER H H 2.478 5.503 -5.235 1.00 . A A . 23 SER H 1 1 14 7909 1 1 23 SER HA H 1.990 4.878 -8.117 1.00 . A A . 23 SER HA 1 1 14 7910 1 1 23 SER HB2 H 2.934 3.256 -5.783 1.00 . A A . 23 SER HB2 1 1 14 7911 1 1 23 SER HB3 H 1.994 2.443 -7.046 1.00 . A A . 23 SER HB3 1 1 14 7912 1 1 23 SER HG H 4.255 4.118 -7.498 1.00 . A A . 23 SER HG 1 1 14 7913 1 1 23 SER N N 2.521 5.599 -6.212 1.00 . A A . 23 SER N 1 1 14 7914 1 1 23 SER O O -0.013 4.810 -5.626 1.00 . A A . 23 SER O 1 1 14 7915 1 1 23 SER OG O 3.803 3.282 -7.626 1.00 . A A . 23 SER OG 1 1 14 7916 1 1 24 GLN C C -2.356 2.881 -6.611 1.00 . A A . 24 GLN C 1 1 14 7917 1 1 24 GLN CA C -1.941 4.149 -7.364 1.00 . A A . 24 GLN CA 1 1 14 7918 1 1 24 GLN CB C -2.770 4.291 -8.641 1.00 . A A . 24 GLN CB 1 1 14 7919 1 1 24 GLN CD C -2.921 5.405 -10.871 1.00 . A A . 24 GLN CD 1 1 14 7920 1 1 24 GLN CG C -2.143 5.345 -9.555 1.00 . A A . 24 GLN CG 1 1 14 7921 1 1 24 GLN H H -0.161 3.981 -8.579 1.00 . A A . 24 GLN H 1 1 14 7922 1 1 24 GLN HA H -2.154 4.993 -6.723 1.00 . A A . 24 GLN HA 1 1 14 7923 1 1 24 GLN HB2 H -2.800 3.341 -9.154 1.00 . A A . 24 GLN HB2 1 1 14 7924 1 1 24 GLN HB3 H -3.774 4.594 -8.386 1.00 . A A . 24 GLN HB3 1 1 14 7925 1 1 24 GLN HE21 H -2.508 7.322 -11.189 1.00 . A A . 24 GLN HE21 1 1 14 7926 1 1 24 GLN HE22 H -3.464 6.578 -12.379 1.00 . A A . 24 GLN HE22 1 1 14 7927 1 1 24 GLN HG2 H -2.178 6.309 -9.067 1.00 . A A . 24 GLN HG2 1 1 14 7928 1 1 24 GLN HG3 H -1.117 5.080 -9.762 1.00 . A A . 24 GLN HG3 1 1 14 7929 1 1 24 GLN N N -0.478 4.196 -7.676 1.00 . A A . 24 GLN N 1 1 14 7930 1 1 24 GLN NE2 N -2.969 6.528 -11.535 1.00 . A A . 24 GLN NE2 1 1 14 7931 1 1 24 GLN O O -3.029 2.974 -5.604 1.00 . A A . 24 GLN O 1 1 14 7932 1 1 24 GLN OE1 O -3.491 4.421 -11.300 1.00 . A A . 24 GLN OE1 1 1 14 7933 1 1 25 LYS C C -1.403 0.084 -5.185 1.00 . A A . 25 LYS C 1 1 14 7934 1 1 25 LYS CA C -2.400 0.478 -6.284 1.00 . A A . 25 LYS CA 1 1 14 7935 1 1 25 LYS CB C -2.492 -0.694 -7.238 1.00 . A A . 25 LYS CB 1 1 14 7936 1 1 25 LYS CD C -4.193 -2.472 -7.760 1.00 . A A . 25 LYS CD 1 1 14 7937 1 1 25 LYS CE C -4.998 -1.670 -8.784 1.00 . A A . 25 LYS CE 1 1 14 7938 1 1 25 LYS CG C -3.636 -1.534 -6.690 1.00 . A A . 25 LYS CG 1 1 14 7939 1 1 25 LYS H H -1.445 1.597 -7.842 1.00 . A A . 25 LYS H 1 1 14 7940 1 1 25 LYS HA H -3.376 0.631 -5.851 1.00 . A A . 25 LYS HA 1 1 14 7941 1 1 25 LYS HB2 H -2.680 -0.328 -8.238 1.00 . A A . 25 LYS HB2 1 1 14 7942 1 1 25 LYS HB3 H -1.572 -1.252 -7.184 1.00 . A A . 25 LYS HB3 1 1 14 7943 1 1 25 LYS HD2 H -3.373 -2.974 -8.251 1.00 . A A . 25 LYS HD2 1 1 14 7944 1 1 25 LYS HD3 H -4.838 -3.203 -7.292 1.00 . A A . 25 LYS HD3 1 1 14 7945 1 1 25 LYS HE2 H -4.899 -0.615 -8.574 1.00 . A A . 25 LYS HE2 1 1 14 7946 1 1 25 LYS HE3 H -4.625 -1.875 -9.777 1.00 . A A . 25 LYS HE3 1 1 14 7947 1 1 25 LYS HG2 H -3.274 -2.092 -5.841 1.00 . A A . 25 LYS HG2 1 1 14 7948 1 1 25 LYS HG3 H -4.403 -0.851 -6.361 1.00 . A A . 25 LYS HG3 1 1 14 7949 1 1 25 LYS HZ1 H -6.537 -2.886 -8.082 1.00 . A A . 25 LYS HZ1 1 1 14 7950 1 1 25 LYS HZ2 H -6.988 -1.271 -8.314 1.00 . A A . 25 LYS HZ2 1 1 14 7951 1 1 25 LYS HZ3 H -6.781 -2.293 -9.656 1.00 . A A . 25 LYS HZ3 1 1 14 7952 1 1 25 LYS N N -1.988 1.699 -7.038 1.00 . A A . 25 LYS N 1 1 14 7953 1 1 25 LYS NZ N -6.434 -2.059 -8.703 1.00 . A A . 25 LYS NZ 1 1 14 7954 1 1 25 LYS O O -1.318 -1.036 -4.723 1.00 . A A . 25 LYS O 1 1 14 7955 1 1 26 TYR C C -0.141 2.141 -2.813 1.00 . A A . 26 TYR C 1 1 14 7956 1 1 26 TYR CA C 0.400 1.071 -3.765 1.00 . A A . 26 TYR CA 1 1 14 7957 1 1 26 TYR CB C 1.596 1.556 -4.572 1.00 . A A . 26 TYR CB 1 1 14 7958 1 1 26 TYR CD1 C 1.766 -0.937 -5.026 1.00 . A A . 26 TYR CD1 1 1 14 7959 1 1 26 TYR CD2 C 3.615 0.492 -5.617 1.00 . A A . 26 TYR CD2 1 1 14 7960 1 1 26 TYR CE1 C 2.477 -2.039 -5.496 1.00 . A A . 26 TYR CE1 1 1 14 7961 1 1 26 TYR CE2 C 4.337 -0.611 -6.089 1.00 . A A . 26 TYR CE2 1 1 14 7962 1 1 26 TYR CG C 2.334 0.342 -5.084 1.00 . A A . 26 TYR CG 1 1 14 7963 1 1 26 TYR CZ C 3.763 -1.888 -6.028 1.00 . A A . 26 TYR CZ 1 1 14 7964 1 1 26 TYR H H -0.813 1.910 -5.229 1.00 . A A . 26 TYR H 1 1 14 7965 1 1 26 TYR HA H 0.584 0.110 -3.296 1.00 . A A . 26 TYR HA 1 1 14 7966 1 1 26 TYR HB2 H 1.207 2.138 -5.391 1.00 . A A . 26 TYR HB2 1 1 14 7967 1 1 26 TYR HB3 H 2.247 2.159 -3.957 1.00 . A A . 26 TYR HB3 1 1 14 7968 1 1 26 TYR HD1 H 0.779 -1.107 -4.630 1.00 . A A . 26 TYR HD1 1 1 14 7969 1 1 26 TYR HD2 H 4.056 1.473 -5.665 1.00 . A A . 26 TYR HD2 1 1 14 7970 1 1 26 TYR HE1 H 2.006 -3.005 -5.433 1.00 . A A . 26 TYR HE1 1 1 14 7971 1 1 26 TYR HE2 H 5.330 -0.473 -6.494 1.00 . A A . 26 TYR HE2 1 1 14 7972 1 1 26 TYR HH H 5.106 -2.679 -7.131 1.00 . A A . 26 TYR HH 1 1 14 7973 1 1 26 TYR N N -0.660 1.064 -4.795 1.00 . A A . 26 TYR N 1 1 14 7974 1 1 26 TYR O O -0.729 1.852 -1.795 1.00 . A A . 26 TYR O 1 1 14 7975 1 1 26 TYR OH O 4.461 -2.985 -6.489 1.00 . A A . 26 TYR OH 1 1 14 7976 1 1 27 ARG C C -1.952 4.132 -1.851 1.00 . A A . 27 ARG C 1 1 14 7977 1 1 27 ARG CA C -0.503 4.458 -2.219 1.00 . A A . 27 ARG CA 1 1 14 7978 1 1 27 ARG CB C -0.466 5.800 -2.954 1.00 . A A . 27 ARG CB 1 1 14 7979 1 1 27 ARG CD C -1.761 7.469 -4.278 1.00 . A A . 27 ARG CD 1 1 14 7980 1 1 27 ARG CG C -1.835 6.127 -3.547 1.00 . A A . 27 ARG CG 1 1 14 7981 1 1 27 ARG CZ C -2.563 9.010 -2.589 1.00 . A A . 27 ARG CZ 1 1 14 7982 1 1 27 ARG H H 0.489 3.649 -3.948 1.00 . A A . 27 ARG H 1 1 14 7983 1 1 27 ARG HA H 0.089 4.524 -1.320 1.00 . A A . 27 ARG HA 1 1 14 7984 1 1 27 ARG HB2 H -0.198 6.586 -2.264 1.00 . A A . 27 ARG HB2 1 1 14 7985 1 1 27 ARG HB3 H 0.253 5.744 -3.758 1.00 . A A . 27 ARG HB3 1 1 14 7986 1 1 27 ARG HD2 H -0.936 7.455 -4.974 1.00 . A A . 27 ARG HD2 1 1 14 7987 1 1 27 ARG HD3 H -2.683 7.639 -4.815 1.00 . A A . 27 ARG HD3 1 1 14 7988 1 1 27 ARG HE H -0.662 8.947 -3.160 1.00 . A A . 27 ARG HE 1 1 14 7989 1 1 27 ARG HG2 H -2.095 5.352 -4.252 1.00 . A A . 27 ARG HG2 1 1 14 7990 1 1 27 ARG HG3 H -2.573 6.189 -2.759 1.00 . A A . 27 ARG HG3 1 1 14 7991 1 1 27 ARG HH11 H -2.601 7.435 -1.354 1.00 . A A . 27 ARG HH11 1 1 14 7992 1 1 27 ARG HH12 H -3.795 8.654 -1.052 1.00 . A A . 27 ARG HH12 1 1 14 7993 1 1 27 ARG HH21 H -2.759 10.689 -3.663 1.00 . A A . 27 ARG HH21 1 1 14 7994 1 1 27 ARG HH22 H -3.884 10.496 -2.359 1.00 . A A . 27 ARG HH22 1 1 14 7995 1 1 27 ARG N N 0.026 3.397 -3.122 1.00 . A A . 27 ARG N 1 1 14 7996 1 1 27 ARG NE N -1.554 8.564 -3.287 1.00 . A A . 27 ARG NE 1 1 14 7997 1 1 27 ARG NH1 N -3.022 8.312 -1.587 1.00 . A A . 27 ARG NH1 1 1 14 7998 1 1 27 ARG NH2 N -3.111 10.154 -2.895 1.00 . A A . 27 ARG NH2 1 1 14 7999 1 1 27 ARG O O -2.382 4.331 -0.732 1.00 . A A . 27 ARG O 1 1 14 8000 1 1 28 ALA C C -4.336 1.834 -2.114 1.00 . A A . 28 ALA C 1 1 14 8001 1 1 28 ALA CA C -4.132 3.299 -2.511 1.00 . A A . 28 ALA CA 1 1 14 8002 1 1 28 ALA CB C -4.971 3.599 -3.755 1.00 . A A . 28 ALA CB 1 1 14 8003 1 1 28 ALA H H -2.332 3.491 -3.686 1.00 . A A . 28 ALA H 1 1 14 8004 1 1 28 ALA HA H -4.489 3.930 -1.712 1.00 . A A . 28 ALA HA 1 1 14 8005 1 1 28 ALA HB1 H -4.641 4.527 -4.197 1.00 . A A . 28 ALA HB1 1 1 14 8006 1 1 28 ALA HB2 H -4.855 2.797 -4.470 1.00 . A A . 28 ALA HB2 1 1 14 8007 1 1 28 ALA HB3 H -6.011 3.683 -3.476 1.00 . A A . 28 ALA HB3 1 1 14 8008 1 1 28 ALA N N -2.707 3.636 -2.792 1.00 . A A . 28 ALA N 1 1 14 8009 1 1 28 ALA O O -5.005 1.551 -1.139 1.00 . A A . 28 ALA O 1 1 14 8010 1 1 29 ASN C C -3.041 -0.963 -1.324 1.00 . A A . 29 ASN C 1 1 14 8011 1 1 29 ASN CA C -4.009 -0.529 -2.427 1.00 . A A . 29 ASN CA 1 1 14 8012 1 1 29 ASN CB C -3.892 -1.445 -3.647 1.00 . A A . 29 ASN CB 1 1 14 8013 1 1 29 ASN CG C -5.282 -1.821 -4.168 1.00 . A A . 29 ASN CG 1 1 14 8014 1 1 29 ASN H H -3.253 1.107 -3.622 1.00 . A A . 29 ASN H 1 1 14 8015 1 1 29 ASN HA H -5.007 -0.596 -2.040 1.00 . A A . 29 ASN HA 1 1 14 8016 1 1 29 ASN HB2 H -3.380 -0.900 -4.421 1.00 . A A . 29 ASN HB2 1 1 14 8017 1 1 29 ASN HB3 H -3.346 -2.346 -3.399 1.00 . A A . 29 ASN HB3 1 1 14 8018 1 1 29 ASN HD21 H -6.032 0.000 -3.910 1.00 . A A . 29 ASN HD21 1 1 14 8019 1 1 29 ASN HD22 H -7.110 -1.148 -4.543 1.00 . A A . 29 ASN HD22 1 1 14 8020 1 1 29 ASN N N -3.791 0.889 -2.832 1.00 . A A . 29 ASN N 1 1 14 8021 1 1 29 ASN ND2 N -6.219 -0.914 -4.210 1.00 . A A . 29 ASN ND2 1 1 14 8022 1 1 29 ASN O O -2.953 -2.127 -0.985 1.00 . A A . 29 ASN O 1 1 14 8023 1 1 29 ASN OD1 O -5.517 -2.952 -4.542 1.00 . A A . 29 ASN OD1 1 1 14 8024 1 1 30 CYS C C -1.350 0.878 1.275 1.00 . A A . 30 CYS C 1 1 14 8025 1 1 30 CYS CA C -1.345 -0.310 0.313 1.00 . A A . 30 CYS CA 1 1 14 8026 1 1 30 CYS CB C 0.008 -0.559 -0.357 1.00 . A A . 30 CYS CB 1 1 14 8027 1 1 30 CYS H H -2.442 0.895 -1.087 1.00 . A A . 30 CYS H 1 1 14 8028 1 1 30 CYS HA H -1.652 -1.190 0.862 1.00 . A A . 30 CYS HA 1 1 14 8029 1 1 30 CYS HB2 H 0.331 0.291 -0.934 1.00 . A A . 30 CYS HB2 1 1 14 8030 1 1 30 CYS HB3 H 0.757 -0.800 0.380 1.00 . A A . 30 CYS HB3 1 1 14 8031 1 1 30 CYS N N -2.326 -0.024 -0.774 1.00 . A A . 30 CYS N 1 1 14 8032 1 1 30 CYS O O -0.355 1.280 1.842 1.00 . A A . 30 CYS O 1 1 14 8033 1 1 30 CYS SG S -0.250 -2.005 -1.415 1.00 . A A . 30 CYS SG 1 1 14 8034 1 1 31 ALA C C -2.637 2.185 3.798 1.00 . A A . 31 ALA C 1 1 14 8035 1 1 31 ALA CA C -2.754 2.599 2.328 1.00 . A A . 31 ALA CA 1 1 14 8036 1 1 31 ALA CB C -4.155 3.131 2.020 1.00 . A A . 31 ALA CB 1 1 14 8037 1 1 31 ALA H H -3.285 1.063 0.952 1.00 . A A . 31 ALA H 1 1 14 8038 1 1 31 ALA HA H -2.023 3.362 2.102 1.00 . A A . 31 ALA HA 1 1 14 8039 1 1 31 ALA HB1 H -4.705 2.377 1.472 1.00 . A A . 31 ALA HB1 1 1 14 8040 1 1 31 ALA HB2 H -4.670 3.349 2.943 1.00 . A A . 31 ALA HB2 1 1 14 8041 1 1 31 ALA HB3 H -4.086 4.025 1.420 1.00 . A A . 31 ALA HB3 1 1 14 8042 1 1 31 ALA N N -2.522 1.429 1.437 1.00 . A A . 31 ALA N 1 1 14 8043 1 1 31 ALA O O -2.666 3.009 4.691 1.00 . A A . 31 ALA O 1 1 14 8044 1 1 32 LYS C C -0.878 0.488 5.800 1.00 . A A . 32 LYS C 1 1 14 8045 1 1 32 LYS CA C -2.367 0.415 5.452 1.00 . A A . 32 LYS CA 1 1 14 8046 1 1 32 LYS CB C -2.814 -1.049 5.492 1.00 . A A . 32 LYS CB 1 1 14 8047 1 1 32 LYS CD C -0.651 -2.355 5.370 1.00 . A A . 32 LYS CD 1 1 14 8048 1 1 32 LYS CE C -0.241 -3.797 5.689 1.00 . A A . 32 LYS CE 1 1 14 8049 1 1 32 LYS CG C -1.816 -1.920 6.269 1.00 . A A . 32 LYS CG 1 1 14 8050 1 1 32 LYS H H -2.472 0.276 3.311 1.00 . A A . 32 LYS H 1 1 14 8051 1 1 32 LYS HA H -2.953 1.015 6.132 1.00 . A A . 32 LYS HA 1 1 14 8052 1 1 32 LYS HB2 H -3.781 -1.105 5.968 1.00 . A A . 32 LYS HB2 1 1 14 8053 1 1 32 LYS HB3 H -2.895 -1.418 4.480 1.00 . A A . 32 LYS HB3 1 1 14 8054 1 1 32 LYS HD2 H -0.954 -2.289 4.335 1.00 . A A . 32 LYS HD2 1 1 14 8055 1 1 32 LYS HD3 H 0.192 -1.701 5.538 1.00 . A A . 32 LYS HD3 1 1 14 8056 1 1 32 LYS HE2 H -0.937 -4.477 5.220 1.00 . A A . 32 LYS HE2 1 1 14 8057 1 1 32 LYS HE3 H 0.757 -4.009 5.322 1.00 . A A . 32 LYS HE3 1 1 14 8058 1 1 32 LYS HG2 H -1.432 -1.367 7.113 1.00 . A A . 32 LYS HG2 1 1 14 8059 1 1 32 LYS HG3 H -2.328 -2.800 6.629 1.00 . A A . 32 LYS HG3 1 1 14 8060 1 1 32 LYS HZ1 H -0.305 -3.075 7.639 1.00 . A A . 32 LYS HZ1 1 1 14 8061 1 1 32 LYS HZ2 H -1.123 -4.550 7.421 1.00 . A A . 32 LYS HZ2 1 1 14 8062 1 1 32 LYS HZ3 H 0.570 -4.522 7.466 1.00 . A A . 32 LYS HZ3 1 1 14 8063 1 1 32 LYS N N -2.496 0.914 4.053 1.00 . A A . 32 LYS N 1 1 14 8064 1 1 32 LYS NZ N -0.277 -4.001 7.165 1.00 . A A . 32 LYS NZ 1 1 14 8065 1 1 32 LYS O O -0.481 0.579 6.944 1.00 . A A . 32 LYS O 1 1 14 8066 1 1 33 THR C C 1.871 1.956 4.903 1.00 . A A . 33 THR C 1 1 14 8067 1 1 33 THR CA C 1.411 0.503 4.888 1.00 . A A . 33 THR CA 1 1 14 8068 1 1 33 THR CB C 1.807 -0.328 3.679 1.00 . A A . 33 THR CB 1 1 14 8069 1 1 33 THR CG2 C 3.121 -1.040 3.948 1.00 . A A . 33 THR CG2 1 1 14 8070 1 1 33 THR H H -0.420 0.371 3.873 1.00 . A A . 33 THR H 1 1 14 8071 1 1 33 THR HA H 1.793 0.043 5.779 1.00 . A A . 33 THR HA 1 1 14 8072 1 1 33 THR HB H 1.886 0.274 2.792 1.00 . A A . 33 THR HB 1 1 14 8073 1 1 33 THR HG1 H 1.199 -2.172 3.577 1.00 . A A . 33 THR HG1 1 1 14 8074 1 1 33 THR HG21 H 3.741 -0.424 4.582 1.00 . A A . 33 THR HG21 1 1 14 8075 1 1 33 THR HG22 H 2.924 -1.995 4.410 1.00 . A A . 33 THR HG22 1 1 14 8076 1 1 33 THR HG23 H 3.596 -1.175 2.993 1.00 . A A . 33 THR HG23 1 1 14 8077 1 1 33 THR N N -0.065 0.446 4.781 1.00 . A A . 33 THR N 1 1 14 8078 1 1 33 THR O O 2.938 2.277 5.388 1.00 . A A . 33 THR O 1 1 14 8079 1 1 33 THR OG1 O 0.791 -1.306 3.513 1.00 . A A . 33 THR OG1 1 1 14 8080 1 1 34 CYS C C 0.449 5.090 5.142 1.00 . A A . 34 CYS C 1 1 14 8081 1 1 34 CYS CA C 1.492 4.265 4.390 1.00 . A A . 34 CYS CA 1 1 14 8082 1 1 34 CYS CB C 1.573 4.880 2.996 1.00 . A A . 34 CYS CB 1 1 14 8083 1 1 34 CYS H H 0.214 2.565 3.998 1.00 . A A . 34 CYS H 1 1 14 8084 1 1 34 CYS HA H 2.455 4.339 4.876 1.00 . A A . 34 CYS HA 1 1 14 8085 1 1 34 CYS HB2 H 1.809 4.137 2.259 1.00 . A A . 34 CYS HB2 1 1 14 8086 1 1 34 CYS HB3 H 0.615 5.283 2.742 1.00 . A A . 34 CYS HB3 1 1 14 8087 1 1 34 CYS N N 1.071 2.840 4.381 1.00 . A A . 34 CYS N 1 1 14 8088 1 1 34 CYS O O 0.570 6.292 5.265 1.00 . A A . 34 CYS O 1 1 14 8089 1 1 34 CYS SG S 2.792 6.217 3.116 1.00 . A A . 34 CYS SG 1 1 14 8090 1 1 35 GLU C C -2.336 6.186 5.441 1.00 . A A . 35 GLU C 1 1 14 8091 1 1 35 GLU CA C -1.616 5.225 6.382 1.00 . A A . 35 GLU CA 1 1 14 8092 1 1 35 GLU CB C -0.951 5.897 7.576 1.00 . A A . 35 GLU CB 1 1 14 8093 1 1 35 GLU CD C -0.058 5.150 9.809 1.00 . A A . 35 GLU CD 1 1 14 8094 1 1 35 GLU CG C -0.575 4.699 8.442 1.00 . A A . 35 GLU CG 1 1 14 8095 1 1 35 GLU H H -0.678 3.494 5.547 1.00 . A A . 35 GLU H 1 1 14 8096 1 1 35 GLU HA H -2.349 4.514 6.739 1.00 . A A . 35 GLU HA 1 1 14 8097 1 1 35 GLU HB2 H -0.081 6.457 7.260 1.00 . A A . 35 GLU HB2 1 1 14 8098 1 1 35 GLU HB3 H -1.646 6.516 8.120 1.00 . A A . 35 GLU HB3 1 1 14 8099 1 1 35 GLU HG2 H -1.463 4.090 8.547 1.00 . A A . 35 GLU HG2 1 1 14 8100 1 1 35 GLU HG3 H 0.180 4.126 7.922 1.00 . A A . 35 GLU HG3 1 1 14 8101 1 1 35 GLU N N -0.578 4.462 5.646 1.00 . A A . 35 GLU N 1 1 14 8102 1 1 35 GLU O O -2.810 7.240 5.813 1.00 . A A . 35 GLU O 1 1 14 8103 1 1 35 GLU OE1 O -0.103 6.341 10.073 1.00 . A A . 35 GLU OE1 1 1 14 8104 1 1 35 GLU OE2 O 0.374 4.298 10.567 1.00 . A A . 35 GLU OE2 1 1 14 8105 1 1 36 LEU C C -4.572 6.221 3.269 1.00 . A A . 36 LEU C 1 1 14 8106 1 1 36 LEU CA C -3.088 6.584 3.167 1.00 . A A . 36 LEU CA 1 1 14 8107 1 1 36 LEU CB C -2.560 6.166 1.796 1.00 . A A . 36 LEU CB 1 1 14 8108 1 1 36 LEU CD1 C -0.367 5.733 0.664 1.00 . A A . 36 LEU CD1 1 1 14 8109 1 1 36 LEU CD2 C -1.101 8.081 1.111 1.00 . A A . 36 LEU CD2 1 1 14 8110 1 1 36 LEU CG C -1.121 6.645 1.637 1.00 . A A . 36 LEU CG 1 1 14 8111 1 1 36 LEU H H -2.014 4.909 3.966 1.00 . A A . 36 LEU H 1 1 14 8112 1 1 36 LEU HA H -2.932 7.634 3.336 1.00 . A A . 36 LEU HA 1 1 14 8113 1 1 36 LEU HB2 H -2.596 5.100 1.761 1.00 . A A . 36 LEU HB2 1 1 14 8114 1 1 36 LEU HB3 H -3.164 6.547 0.995 1.00 . A A . 36 LEU HB3 1 1 14 8115 1 1 36 LEU HD11 H -0.759 4.728 0.731 1.00 . A A . 36 LEU HD11 1 1 14 8116 1 1 36 LEU HD12 H -0.486 6.099 -0.346 1.00 . A A . 36 LEU HD12 1 1 14 8117 1 1 36 LEU HD13 H 0.683 5.725 0.917 1.00 . A A . 36 LEU HD13 1 1 14 8118 1 1 36 LEU HD21 H -2.111 8.462 1.067 1.00 . A A . 36 LEU HD21 1 1 14 8119 1 1 36 LEU HD22 H -0.510 8.699 1.772 1.00 . A A . 36 LEU HD22 1 1 14 8120 1 1 36 LEU HD23 H -0.668 8.095 0.122 1.00 . A A . 36 LEU HD23 1 1 14 8121 1 1 36 LEU HG H -0.666 6.606 2.616 1.00 . A A . 36 LEU HG 1 1 14 8122 1 1 36 LEU N N -2.408 5.773 4.208 1.00 . A A . 36 LEU N 1 1 14 8123 1 1 36 LEU O O -5.409 6.832 2.637 1.00 . A A . 36 LEU O 1 1 14 8124 1 1 37 CYS C C -6.473 3.547 4.964 1.00 . A A . 37 CYS C 1 1 14 8125 1 1 37 CYS CA C -6.352 4.856 4.180 1.00 . A A . 37 CYS CA 1 1 14 8126 1 1 37 CYS CB C -6.960 4.671 2.788 1.00 . A A . 37 CYS CB 1 1 14 8127 1 1 37 CYS H H -4.247 4.726 4.579 1.00 . A A . 37 CYS H 1 1 14 8128 1 1 37 CYS HA H -6.882 5.637 4.705 1.00 . A A . 37 CYS HA 1 1 14 8129 1 1 37 CYS HB2 H -7.185 5.638 2.363 1.00 . A A . 37 CYS HB2 1 1 14 8130 1 1 37 CYS HB3 H -6.259 4.150 2.153 1.00 . A A . 37 CYS HB3 1 1 14 8131 1 1 37 CYS N N -4.915 5.231 4.060 1.00 . A A . 37 CYS N 1 1 14 8132 1 1 37 CYS O O -7.289 3.496 5.869 1.00 . A A . 37 CYS O 1 1 14 8133 1 1 37 CYS OXT O -5.748 2.619 4.646 1.00 . A A . 37 CYS OXT 1 1 14 8134 1 1 37 CYS SG S -8.482 3.701 2.929 1.00 . A A . 37 CYS SG 1 1 15 8135 1 1 1 VAL C C -12.308 1.051 3.584 1.00 . A A . 1 VAL C 1 1 15 8136 1 1 1 VAL CA C -13.728 0.907 4.137 1.00 . A A . 1 VAL CA 1 1 15 8137 1 1 1 VAL CB C -13.845 -0.402 4.920 1.00 . A A . 1 VAL CB 1 1 15 8138 1 1 1 VAL CG1 C -15.309 -0.649 5.287 1.00 . A A . 1 VAL CG1 1 1 15 8139 1 1 1 VAL CG2 C -13.341 -1.557 4.052 1.00 . A A . 1 VAL CG2 1 1 15 8140 1 1 1 VAL H1 H -14.240 1.259 2.148 1.00 . A A . 1 VAL H1 1 1 15 8141 1 1 1 VAL H2 H -15.018 -0.081 2.832 1.00 . A A . 1 VAL H2 1 1 15 8142 1 1 1 VAL H3 H -15.517 1.490 3.247 1.00 . A A . 1 VAL H3 1 1 15 8143 1 1 1 VAL HA H -13.947 1.740 4.789 1.00 . A A . 1 VAL HA 1 1 15 8144 1 1 1 VAL HB H -13.256 -0.335 5.822 1.00 . A A . 1 VAL HB 1 1 15 8145 1 1 1 VAL HG11 H -15.933 -0.466 4.423 1.00 . A A . 1 VAL HG11 1 1 15 8146 1 1 1 VAL HG12 H -15.433 -1.673 5.608 1.00 . A A . 1 VAL HG12 1 1 15 8147 1 1 1 VAL HG13 H -15.598 0.017 6.086 1.00 . A A . 1 VAL HG13 1 1 15 8148 1 1 1 VAL HG21 H -13.220 -1.217 3.035 1.00 . A A . 1 VAL HG21 1 1 15 8149 1 1 1 VAL HG22 H -12.390 -1.903 4.431 1.00 . A A . 1 VAL HG22 1 1 15 8150 1 1 1 VAL HG23 H -14.054 -2.366 4.079 1.00 . A A . 1 VAL HG23 1 1 15 8151 1 1 1 VAL N N -14.700 0.894 3.006 1.00 . A A . 1 VAL N 1 1 15 8152 1 1 1 VAL O O -12.059 0.798 2.422 1.00 . A A . 1 VAL O 1 1 15 8153 1 1 2 CYS C C -9.173 0.352 4.257 1.00 . A A . 2 CYS C 1 1 15 8154 1 1 2 CYS CA C -9.977 1.609 3.905 1.00 . A A . 2 CYS CA 1 1 15 8155 1 1 2 CYS CB C -9.331 2.828 4.566 1.00 . A A . 2 CYS CB 1 1 15 8156 1 1 2 CYS H H -11.589 1.655 5.336 1.00 . A A . 2 CYS H 1 1 15 8157 1 1 2 CYS HA H -10.008 1.751 2.834 1.00 . A A . 2 CYS HA 1 1 15 8158 1 1 2 CYS HB2 H -8.353 2.993 4.141 1.00 . A A . 2 CYS HB2 1 1 15 8159 1 1 2 CYS HB3 H -9.949 3.698 4.398 1.00 . A A . 2 CYS HB3 1 1 15 8160 1 1 2 CYS N N -11.374 1.454 4.401 1.00 . A A . 2 CYS N 1 1 15 8161 1 1 2 CYS O O -9.641 -0.473 5.015 1.00 . A A . 2 CYS O 1 1 15 8162 1 1 2 CYS SG S -9.176 2.534 6.346 1.00 . A A . 2 CYS SG 1 1 15 8163 1 1 3 ARG C C -6.197 -1.198 2.809 1.00 . A A . 3 ARG C 1 1 15 8164 1 1 3 ARG CA C -7.129 -0.982 4.003 1.00 . A A . 3 ARG CA 1 1 15 8165 1 1 3 ARG CB C -7.973 -2.243 4.198 1.00 . A A . 3 ARG CB 1 1 15 8166 1 1 3 ARG CD C -8.982 -3.717 2.446 1.00 . A A . 3 ARG CD 1 1 15 8167 1 1 3 ARG CG C -9.033 -2.333 3.098 1.00 . A A . 3 ARG CG 1 1 15 8168 1 1 3 ARG CZ C -10.382 -4.646 4.190 1.00 . A A . 3 ARG CZ 1 1 15 8169 1 1 3 ARG H H -7.641 0.895 3.114 1.00 . A A . 3 ARG H 1 1 15 8170 1 1 3 ARG HA H -6.537 -0.792 4.887 1.00 . A A . 3 ARG HA 1 1 15 8171 1 1 3 ARG HB2 H -7.331 -3.111 4.159 1.00 . A A . 3 ARG HB2 1 1 15 8172 1 1 3 ARG HB3 H -8.460 -2.204 5.160 1.00 . A A . 3 ARG HB3 1 1 15 8173 1 1 3 ARG HD2 H -9.701 -3.764 1.640 1.00 . A A . 3 ARG HD2 1 1 15 8174 1 1 3 ARG HD3 H -7.992 -3.892 2.054 1.00 . A A . 3 ARG HD3 1 1 15 8175 1 1 3 ARG HE H -8.710 -5.526 3.583 1.00 . A A . 3 ARG HE 1 1 15 8176 1 1 3 ARG HG2 H -10.011 -2.172 3.528 1.00 . A A . 3 ARG HG2 1 1 15 8177 1 1 3 ARG HG3 H -8.839 -1.581 2.347 1.00 . A A . 3 ARG HG3 1 1 15 8178 1 1 3 ARG HH11 H -11.440 -3.728 2.760 1.00 . A A . 3 ARG HH11 1 1 15 8179 1 1 3 ARG HH12 H -12.274 -3.992 4.254 1.00 . A A . 3 ARG HH12 1 1 15 8180 1 1 3 ARG HH21 H -9.577 -5.539 5.791 1.00 . A A . 3 ARG HH21 1 1 15 8181 1 1 3 ARG HH22 H -11.219 -5.018 5.970 1.00 . A A . 3 ARG HH22 1 1 15 8182 1 1 3 ARG N N -7.987 0.207 3.721 1.00 . A A . 3 ARG N 1 1 15 8183 1 1 3 ARG NE N -9.306 -4.757 3.461 1.00 . A A . 3 ARG NE 1 1 15 8184 1 1 3 ARG NH1 N -11.448 -4.077 3.696 1.00 . A A . 3 ARG NH1 1 1 15 8185 1 1 3 ARG NH2 N -10.394 -5.104 5.412 1.00 . A A . 3 ARG NH2 1 1 15 8186 1 1 3 ARG O O -6.086 -0.349 1.946 1.00 . A A . 3 ARG O 1 1 15 8187 1 1 4 ASP C C -5.323 -3.381 0.521 1.00 . A A . 4 ASP C 1 1 15 8188 1 1 4 ASP CA C -4.611 -2.541 1.584 1.00 . A A . 4 ASP CA 1 1 15 8189 1 1 4 ASP CB C -3.338 -3.245 2.057 1.00 . A A . 4 ASP CB 1 1 15 8190 1 1 4 ASP CG C -3.570 -4.757 2.048 1.00 . A A . 4 ASP CG 1 1 15 8191 1 1 4 ASP H H -5.613 -2.996 3.435 1.00 . A A . 4 ASP H 1 1 15 8192 1 1 4 ASP HA H -4.361 -1.581 1.157 1.00 . A A . 4 ASP HA 1 1 15 8193 1 1 4 ASP HB2 H -2.521 -2.995 1.397 1.00 . A A . 4 ASP HB2 1 1 15 8194 1 1 4 ASP HB3 H -3.100 -2.929 3.063 1.00 . A A . 4 ASP HB3 1 1 15 8195 1 1 4 ASP N N -5.524 -2.313 2.739 1.00 . A A . 4 ASP N 1 1 15 8196 1 1 4 ASP O O -6.537 -3.428 0.491 1.00 . A A . 4 ASP O 1 1 15 8197 1 1 4 ASP OD1 O -4.239 -5.238 2.947 1.00 . A A . 4 ASP OD1 1 1 15 8198 1 1 4 ASP OD2 O -3.073 -5.407 1.143 1.00 . A A . 4 ASP OD2 1 1 15 8199 1 1 5 TRP C C -4.448 -6.009 -1.818 1.00 . A A . 5 TRP C 1 1 15 8200 1 1 5 TRP CA C -5.346 -4.851 -1.375 1.00 . A A . 5 TRP CA 1 1 15 8201 1 1 5 TRP CB C -5.681 -3.937 -2.554 1.00 . A A . 5 TRP CB 1 1 15 8202 1 1 5 TRP CD1 C -7.417 -2.108 -2.262 1.00 . A A . 5 TRP CD1 1 1 15 8203 1 1 5 TRP CD2 C -8.305 -4.174 -2.222 1.00 . A A . 5 TRP CD2 1 1 15 8204 1 1 5 TRP CE2 C -9.378 -3.265 -2.049 1.00 . A A . 5 TRP CE2 1 1 15 8205 1 1 5 TRP CE3 C -8.594 -5.548 -2.234 1.00 . A A . 5 TRP CE3 1 1 15 8206 1 1 5 TRP CG C -7.068 -3.413 -2.355 1.00 . A A . 5 TRP CG 1 1 15 8207 1 1 5 TRP CH2 C -10.960 -5.085 -1.908 1.00 . A A . 5 TRP CH2 1 1 15 8208 1 1 5 TRP CZ2 C -10.695 -3.711 -1.893 1.00 . A A . 5 TRP CZ2 1 1 15 8209 1 1 5 TRP CZ3 C -9.911 -5.999 -2.078 1.00 . A A . 5 TRP CZ3 1 1 15 8210 1 1 5 TRP H H -3.630 -4.026 -0.355 1.00 . A A . 5 TRP H 1 1 15 8211 1 1 5 TRP HA H -6.265 -5.237 -0.942 1.00 . A A . 5 TRP HA 1 1 15 8212 1 1 5 TRP HB2 H -4.975 -3.122 -2.571 1.00 . A A . 5 TRP HB2 1 1 15 8213 1 1 5 TRP HB3 H -5.628 -4.490 -3.481 1.00 . A A . 5 TRP HB3 1 1 15 8214 1 1 5 TRP HD1 H -6.741 -1.268 -2.319 1.00 . A A . 5 TRP HD1 1 1 15 8215 1 1 5 TRP HE1 H -9.288 -1.185 -1.984 1.00 . A A . 5 TRP HE1 1 1 15 8216 1 1 5 TRP HE3 H -7.792 -6.259 -2.364 1.00 . A A . 5 TRP HE3 1 1 15 8217 1 1 5 TRP HH2 H -11.972 -5.441 -1.789 1.00 . A A . 5 TRP HH2 1 1 15 8218 1 1 5 TRP HZ2 H -11.499 -3.002 -1.762 1.00 . A A . 5 TRP HZ2 1 1 15 8219 1 1 5 TRP HZ3 H -10.120 -7.058 -2.089 1.00 . A A . 5 TRP HZ3 1 1 15 8220 1 1 5 TRP N N -4.616 -4.046 -0.355 1.00 . A A . 5 TRP N 1 1 15 8221 1 1 5 TRP NE1 N -8.784 -2.020 -2.081 1.00 . A A . 5 TRP NE1 1 1 15 8222 1 1 5 TRP O O -4.920 -7.099 -2.069 1.00 . A A . 5 TRP O 1 1 15 8223 1 1 6 PHE C C -1.927 -7.648 -1.058 1.00 . A A . 6 PHE C 1 1 15 8224 1 1 6 PHE CA C -2.256 -6.897 -2.341 1.00 . A A . 6 PHE CA 1 1 15 8225 1 1 6 PHE CB C -0.914 -6.285 -2.717 1.00 . A A . 6 PHE CB 1 1 15 8226 1 1 6 PHE CD1 C -2.068 -5.535 -4.819 1.00 . A A . 6 PHE CD1 1 1 15 8227 1 1 6 PHE CD2 C -0.097 -4.357 -4.030 1.00 . A A . 6 PHE CD2 1 1 15 8228 1 1 6 PHE CE1 C -2.150 -4.663 -5.900 1.00 . A A . 6 PHE CE1 1 1 15 8229 1 1 6 PHE CE2 C -0.174 -3.485 -5.105 1.00 . A A . 6 PHE CE2 1 1 15 8230 1 1 6 PHE CG C -1.040 -5.372 -3.894 1.00 . A A . 6 PHE CG 1 1 15 8231 1 1 6 PHE CZ C -1.203 -3.643 -6.038 1.00 . A A . 6 PHE CZ 1 1 15 8232 1 1 6 PHE H H -2.744 -4.930 -1.722 1.00 . A A . 6 PHE H 1 1 15 8233 1 1 6 PHE HA H -2.648 -7.495 -3.151 1.00 . A A . 6 PHE HA 1 1 15 8234 1 1 6 PHE HB2 H -0.574 -5.687 -1.887 1.00 . A A . 6 PHE HB2 1 1 15 8235 1 1 6 PHE HB3 H -0.191 -7.054 -2.935 1.00 . A A . 6 PHE HB3 1 1 15 8236 1 1 6 PHE HD1 H -2.788 -6.325 -4.700 1.00 . A A . 6 PHE HD1 1 1 15 8237 1 1 6 PHE HD2 H 0.692 -4.237 -3.313 1.00 . A A . 6 PHE HD2 1 1 15 8238 1 1 6 PHE HE1 H -2.945 -4.790 -6.616 1.00 . A A . 6 PHE HE1 1 1 15 8239 1 1 6 PHE HE2 H 0.567 -2.711 -5.190 1.00 . A A . 6 PHE HE2 1 1 15 8240 1 1 6 PHE HZ H -1.262 -2.970 -6.866 1.00 . A A . 6 PHE HZ 1 1 15 8241 1 1 6 PHE N N -3.159 -5.798 -1.918 1.00 . A A . 6 PHE N 1 1 15 8242 1 1 6 PHE O O -2.566 -7.470 -0.041 1.00 . A A . 6 PHE O 1 1 15 8243 1 1 7 LYS C C -0.335 -8.032 1.134 1.00 . A A . 7 LYS C 1 1 15 8244 1 1 7 LYS CA C -0.613 -9.189 0.175 1.00 . A A . 7 LYS CA 1 1 15 8245 1 1 7 LYS CB C 0.647 -10.041 -0.006 1.00 . A A . 7 LYS CB 1 1 15 8246 1 1 7 LYS CD C -0.420 -11.645 -1.601 1.00 . A A . 7 LYS CD 1 1 15 8247 1 1 7 LYS CE C 0.628 -11.989 -2.662 1.00 . A A . 7 LYS CE 1 1 15 8248 1 1 7 LYS CG C 0.256 -11.501 -0.236 1.00 . A A . 7 LYS CG 1 1 15 8249 1 1 7 LYS H H -0.406 -8.616 -1.906 1.00 . A A . 7 LYS H 1 1 15 8250 1 1 7 LYS HA H -1.464 -9.768 0.509 1.00 . A A . 7 LYS HA 1 1 15 8251 1 1 7 LYS HB2 H 1.204 -9.677 -0.858 1.00 . A A . 7 LYS HB2 1 1 15 8252 1 1 7 LYS HB3 H 1.258 -9.973 0.881 1.00 . A A . 7 LYS HB3 1 1 15 8253 1 1 7 LYS HD2 H -1.160 -12.433 -1.554 1.00 . A A . 7 LYS HD2 1 1 15 8254 1 1 7 LYS HD3 H -0.900 -10.715 -1.867 1.00 . A A . 7 LYS HD3 1 1 15 8255 1 1 7 LYS HE2 H 1.139 -11.089 -2.967 1.00 . A A . 7 LYS HE2 1 1 15 8256 1 1 7 LYS HE3 H 1.342 -12.687 -2.248 1.00 . A A . 7 LYS HE3 1 1 15 8257 1 1 7 LYS HG2 H 1.142 -12.118 -0.205 1.00 . A A . 7 LYS HG2 1 1 15 8258 1 1 7 LYS HG3 H -0.431 -11.818 0.534 1.00 . A A . 7 LYS HG3 1 1 15 8259 1 1 7 LYS HZ1 H -0.998 -12.920 -3.576 1.00 . A A . 7 LYS HZ1 1 1 15 8260 1 1 7 LYS HZ2 H -0.105 -11.903 -4.607 1.00 . A A . 7 LYS HZ2 1 1 15 8261 1 1 7 LYS HZ3 H 0.507 -13.427 -4.165 1.00 . A A . 7 LYS HZ3 1 1 15 8262 1 1 7 LYS N N -0.927 -8.479 -1.088 1.00 . A A . 7 LYS N 1 1 15 8263 1 1 7 LYS NZ N -0.042 -12.606 -3.842 1.00 . A A . 7 LYS NZ 1 1 15 8264 1 1 7 LYS O O 0.140 -6.993 0.720 1.00 . A A . 7 LYS O 1 1 15 8265 1 1 8 GLU C C 1.140 -6.631 3.214 1.00 . A A . 8 GLU C 1 1 15 8266 1 1 8 GLU CA C -0.332 -7.019 3.321 1.00 . A A . 8 GLU CA 1 1 15 8267 1 1 8 GLU CB C -0.643 -7.478 4.744 1.00 . A A . 8 GLU CB 1 1 15 8268 1 1 8 GLU CD C 0.224 -7.575 7.085 1.00 . A A . 8 GLU CD 1 1 15 8269 1 1 8 GLU CG C 0.596 -7.309 5.626 1.00 . A A . 8 GLU CG 1 1 15 8270 1 1 8 GLU H H -0.993 -8.993 2.743 1.00 . A A . 8 GLU H 1 1 15 8271 1 1 8 GLU HA H -0.930 -6.157 3.071 1.00 . A A . 8 GLU HA 1 1 15 8272 1 1 8 GLU HB2 H -1.466 -6.906 5.145 1.00 . A A . 8 GLU HB2 1 1 15 8273 1 1 8 GLU HB3 H -0.905 -8.526 4.707 1.00 . A A . 8 GLU HB3 1 1 15 8274 1 1 8 GLU HG2 H 1.354 -8.011 5.311 1.00 . A A . 8 GLU HG2 1 1 15 8275 1 1 8 GLU HG3 H 0.973 -6.301 5.533 1.00 . A A . 8 GLU HG3 1 1 15 8276 1 1 8 GLU N N -0.609 -8.159 2.400 1.00 . A A . 8 GLU N 1 1 15 8277 1 1 8 GLU O O 1.545 -5.545 3.579 1.00 . A A . 8 GLU O 1 1 15 8278 1 1 8 GLU OE1 O -0.580 -8.463 7.319 1.00 . A A . 8 GLU OE1 1 1 15 8279 1 1 8 GLU OE2 O 0.750 -6.887 7.945 1.00 . A A . 8 GLU OE2 1 1 15 8280 1 1 9 THR C C 3.674 -6.580 1.221 1.00 . A A . 9 THR C 1 1 15 8281 1 1 9 THR CA C 3.383 -7.227 2.575 1.00 . A A . 9 THR CA 1 1 15 8282 1 1 9 THR CB C 4.106 -8.542 2.836 1.00 . A A . 9 THR CB 1 1 15 8283 1 1 9 THR CG2 C 3.870 -8.822 4.321 1.00 . A A . 9 THR CG2 1 1 15 8284 1 1 9 THR H H 1.580 -8.392 2.428 1.00 . A A . 9 THR H 1 1 15 8285 1 1 9 THR HA H 3.652 -6.519 3.346 1.00 . A A . 9 THR HA 1 1 15 8286 1 1 9 THR HB H 5.161 -8.437 2.662 1.00 . A A . 9 THR HB 1 1 15 8287 1 1 9 THR HG1 H 3.454 -10.352 2.539 1.00 . A A . 9 THR HG1 1 1 15 8288 1 1 9 THR HG21 H 3.117 -8.134 4.691 1.00 . A A . 9 THR HG21 1 1 15 8289 1 1 9 THR HG22 H 3.523 -9.835 4.452 1.00 . A A . 9 THR HG22 1 1 15 8290 1 1 9 THR HG23 H 4.789 -8.673 4.871 1.00 . A A . 9 THR HG23 1 1 15 8291 1 1 9 THR N N 1.936 -7.525 2.711 1.00 . A A . 9 THR N 1 1 15 8292 1 1 9 THR O O 4.603 -5.811 1.094 1.00 . A A . 9 THR O 1 1 15 8293 1 1 9 THR OG1 O 3.545 -9.554 2.011 1.00 . A A . 9 THR OG1 1 1 15 8294 1 1 10 ALA C C 3.196 -4.776 -0.786 1.00 . A A . 10 ALA C 1 1 15 8295 1 1 10 ALA CA C 3.116 -6.259 -1.117 1.00 . A A . 10 ALA CA 1 1 15 8296 1 1 10 ALA CB C 1.891 -6.451 -2.018 1.00 . A A . 10 ALA CB 1 1 15 8297 1 1 10 ALA H H 2.145 -7.495 0.373 1.00 . A A . 10 ALA H 1 1 15 8298 1 1 10 ALA HA H 4.036 -6.570 -1.582 1.00 . A A . 10 ALA HA 1 1 15 8299 1 1 10 ALA HB1 H 1.008 -6.505 -1.395 1.00 . A A . 10 ALA HB1 1 1 15 8300 1 1 10 ALA HB2 H 1.786 -5.607 -2.690 1.00 . A A . 10 ALA HB2 1 1 15 8301 1 1 10 ALA HB3 H 1.986 -7.362 -2.588 1.00 . A A . 10 ALA HB3 1 1 15 8302 1 1 10 ALA N N 2.886 -6.875 0.224 1.00 . A A . 10 ALA N 1 1 15 8303 1 1 10 ALA O O 4.012 -4.020 -1.274 1.00 . A A . 10 ALA O 1 1 15 8304 1 1 11 CYS C C 3.484 -2.724 1.320 1.00 . A A . 11 CYS C 1 1 15 8305 1 1 11 CYS CA C 2.207 -3.008 0.535 1.00 . A A . 11 CYS CA 1 1 15 8306 1 1 11 CYS CB C 0.882 -2.932 1.295 1.00 . A A . 11 CYS CB 1 1 15 8307 1 1 11 CYS H H 1.665 -5.067 0.437 1.00 . A A . 11 CYS H 1 1 15 8308 1 1 11 CYS HA H 2.209 -2.354 -0.321 1.00 . A A . 11 CYS HA 1 1 15 8309 1 1 11 CYS HB2 H 0.833 -3.720 2.038 1.00 . A A . 11 CYS HB2 1 1 15 8310 1 1 11 CYS HB3 H 0.749 -1.962 1.749 1.00 . A A . 11 CYS HB3 1 1 15 8311 1 1 11 CYS N N 2.296 -4.410 0.077 1.00 . A A . 11 CYS N 1 1 15 8312 1 1 11 CYS O O 4.073 -1.677 1.178 1.00 . A A . 11 CYS O 1 1 15 8313 1 1 11 CYS SG S -0.409 -3.188 0.051 1.00 . A A . 11 CYS SG 1 1 15 8314 1 1 12 ARG C C 6.246 -2.889 1.836 1.00 . A A . 12 ARG C 1 1 15 8315 1 1 12 ARG CA C 5.198 -3.303 2.871 1.00 . A A . 12 ARG CA 1 1 15 8316 1 1 12 ARG CB C 5.709 -4.532 3.614 1.00 . A A . 12 ARG CB 1 1 15 8317 1 1 12 ARG CD C 8.015 -5.044 4.461 1.00 . A A . 12 ARG CD 1 1 15 8318 1 1 12 ARG CG C 6.881 -4.018 4.440 1.00 . A A . 12 ARG CG 1 1 15 8319 1 1 12 ARG CZ C 9.904 -4.313 5.793 1.00 . A A . 12 ARG CZ 1 1 15 8320 1 1 12 ARG H H 3.500 -4.474 2.270 1.00 . A A . 12 ARG H 1 1 15 8321 1 1 12 ARG HA H 5.031 -2.491 3.563 1.00 . A A . 12 ARG HA 1 1 15 8322 1 1 12 ARG HB2 H 4.929 -4.933 4.249 1.00 . A A . 12 ARG HB2 1 1 15 8323 1 1 12 ARG HB3 H 6.066 -5.279 2.923 1.00 . A A . 12 ARG HB3 1 1 15 8324 1 1 12 ARG HD2 H 7.867 -5.727 5.286 1.00 . A A . 12 ARG HD2 1 1 15 8325 1 1 12 ARG HD3 H 8.019 -5.596 3.534 1.00 . A A . 12 ARG HD3 1 1 15 8326 1 1 12 ARG HE H 9.738 -3.900 3.859 1.00 . A A . 12 ARG HE 1 1 15 8327 1 1 12 ARG HG2 H 7.214 -3.096 3.982 1.00 . A A . 12 ARG HG2 1 1 15 8328 1 1 12 ARG HG3 H 6.532 -3.823 5.442 1.00 . A A . 12 ARG HG3 1 1 15 8329 1 1 12 ARG HH11 H 8.203 -4.030 6.812 1.00 . A A . 12 ARG HH11 1 1 15 8330 1 1 12 ARG HH12 H 9.644 -4.118 7.769 1.00 . A A . 12 ARG HH12 1 1 15 8331 1 1 12 ARG HH21 H 11.741 -4.590 5.049 1.00 . A A . 12 ARG HH21 1 1 15 8332 1 1 12 ARG HH22 H 11.646 -4.436 6.772 1.00 . A A . 12 ARG HH22 1 1 15 8333 1 1 12 ARG N N 3.949 -3.620 2.139 1.00 . A A . 12 ARG N 1 1 15 8334 1 1 12 ARG NE N 9.319 -4.341 4.627 1.00 . A A . 12 ARG NE 1 1 15 8335 1 1 12 ARG NH1 N 9.194 -4.140 6.875 1.00 . A A . 12 ARG NH1 1 1 15 8336 1 1 12 ARG NH2 N 11.198 -4.458 5.878 1.00 . A A . 12 ARG NH2 1 1 15 8337 1 1 12 ARG O O 7.135 -2.112 2.123 1.00 . A A . 12 ARG O 1 1 15 8338 1 1 13 HIS C C 6.883 -1.552 -0.746 1.00 . A A . 13 HIS C 1 1 15 8339 1 1 13 HIS CA C 7.156 -3.009 -0.395 1.00 . A A . 13 HIS CA 1 1 15 8340 1 1 13 HIS CB C 7.058 -3.869 -1.656 1.00 . A A . 13 HIS CB 1 1 15 8341 1 1 13 HIS CD2 C 7.449 -2.087 -3.514 1.00 . A A . 13 HIS CD2 1 1 15 8342 1 1 13 HIS CE1 C 9.512 -2.509 -3.984 1.00 . A A . 13 HIS CE1 1 1 15 8343 1 1 13 HIS CG C 7.832 -3.121 -2.702 1.00 . A A . 13 HIS CG 1 1 15 8344 1 1 13 HIS H H 5.435 -4.018 0.409 1.00 . A A . 13 HIS H 1 1 15 8345 1 1 13 HIS HA H 8.151 -3.055 0.018 1.00 . A A . 13 HIS HA 1 1 15 8346 1 1 13 HIS HB2 H 7.495 -4.842 -1.474 1.00 . A A . 13 HIS HB2 1 1 15 8347 1 1 13 HIS HB3 H 6.031 -3.967 -1.973 1.00 . A A . 13 HIS HB3 1 1 15 8348 1 1 13 HIS HD1 H 9.727 -4.063 -2.615 1.00 . A A . 13 HIS HD1 1 1 15 8349 1 1 13 HIS HD2 H 6.470 -1.645 -3.509 1.00 . A A . 13 HIS HD2 1 1 15 8350 1 1 13 HIS HE1 H 10.492 -2.462 -4.431 1.00 . A A . 13 HIS HE1 1 1 15 8351 1 1 13 HIS N N 6.155 -3.395 0.635 1.00 . A A . 13 HIS N 1 1 15 8352 1 1 13 HIS ND1 N 9.156 -3.377 -3.019 1.00 . A A . 13 HIS ND1 1 1 15 8353 1 1 13 HIS NE2 N 8.510 -1.698 -4.327 1.00 . A A . 13 HIS NE2 1 1 15 8354 1 1 13 HIS O O 7.794 -0.765 -0.902 1.00 . A A . 13 HIS O 1 1 15 8355 1 1 14 ALA C C 5.730 1.115 -0.002 1.00 . A A . 14 ALA C 1 1 15 8356 1 1 14 ALA CA C 5.351 0.239 -1.202 1.00 . A A . 14 ALA CA 1 1 15 8357 1 1 14 ALA CB C 3.872 0.425 -1.552 1.00 . A A . 14 ALA CB 1 1 15 8358 1 1 14 ALA H H 4.916 -1.846 -0.732 1.00 . A A . 14 ALA H 1 1 15 8359 1 1 14 ALA HA H 5.966 0.580 -2.033 1.00 . A A . 14 ALA HA 1 1 15 8360 1 1 14 ALA HB1 H 3.447 -0.531 -1.822 1.00 . A A . 14 ALA HB1 1 1 15 8361 1 1 14 ALA HB2 H 3.350 0.818 -0.692 1.00 . A A . 14 ALA HB2 1 1 15 8362 1 1 14 ALA HB3 H 3.780 1.115 -2.387 1.00 . A A . 14 ALA HB3 1 1 15 8363 1 1 14 ALA N N 5.638 -1.186 -0.867 1.00 . A A . 14 ALA N 1 1 15 8364 1 1 14 ALA O O 6.633 1.918 -0.112 1.00 . A A . 14 ALA O 1 1 15 8365 1 1 15 LYS C C 7.001 1.875 2.421 1.00 . A A . 15 LYS C 1 1 15 8366 1 1 15 LYS CA C 5.468 1.862 2.288 1.00 . A A . 15 LYS CA 1 1 15 8367 1 1 15 LYS CB C 4.835 1.167 3.491 1.00 . A A . 15 LYS CB 1 1 15 8368 1 1 15 LYS CD C 5.895 2.795 5.083 1.00 . A A . 15 LYS CD 1 1 15 8369 1 1 15 LYS CE C 7.083 2.947 6.036 1.00 . A A . 15 LYS CE 1 1 15 8370 1 1 15 LYS CG C 5.721 1.319 4.722 1.00 . A A . 15 LYS CG 1 1 15 8371 1 1 15 LYS H H 4.363 0.374 1.242 1.00 . A A . 15 LYS H 1 1 15 8372 1 1 15 LYS HA H 5.041 2.860 2.199 1.00 . A A . 15 LYS HA 1 1 15 8373 1 1 15 LYS HB2 H 3.868 1.601 3.681 1.00 . A A . 15 LYS HB2 1 1 15 8374 1 1 15 LYS HB3 H 4.708 0.118 3.273 1.00 . A A . 15 LYS HB3 1 1 15 8375 1 1 15 LYS HD2 H 6.072 3.369 4.184 1.00 . A A . 15 LYS HD2 1 1 15 8376 1 1 15 LYS HD3 H 5.002 3.156 5.571 1.00 . A A . 15 LYS HD3 1 1 15 8377 1 1 15 LYS HE2 H 7.835 2.212 5.793 1.00 . A A . 15 LYS HE2 1 1 15 8378 1 1 15 LYS HE3 H 7.502 3.938 5.935 1.00 . A A . 15 LYS HE3 1 1 15 8379 1 1 15 LYS HG2 H 5.261 0.793 5.543 1.00 . A A . 15 LYS HG2 1 1 15 8380 1 1 15 LYS HG3 H 6.680 0.883 4.502 1.00 . A A . 15 LYS HG3 1 1 15 8381 1 1 15 LYS HZ1 H 5.938 1.960 7.471 1.00 . A A . 15 LYS HZ1 1 1 15 8382 1 1 15 LYS HZ2 H 7.443 2.513 8.039 1.00 . A A . 15 LYS HZ2 1 1 15 8383 1 1 15 LYS HZ3 H 6.167 3.608 7.787 1.00 . A A . 15 LYS HZ3 1 1 15 8384 1 1 15 LYS N N 5.094 1.009 1.130 1.00 . A A . 15 LYS N 1 1 15 8385 1 1 15 LYS NZ N 6.624 2.742 7.439 1.00 . A A . 15 LYS NZ 1 1 15 8386 1 1 15 LYS O O 7.579 2.873 2.803 1.00 . A A . 15 LYS O 1 1 15 8387 1 1 16 SER C C 9.960 1.366 1.079 1.00 . A A . 16 SER C 1 1 15 8388 1 1 16 SER CA C 9.170 0.736 2.233 1.00 . A A . 16 SER CA 1 1 15 8389 1 1 16 SER CB C 9.574 -0.735 2.267 1.00 . A A . 16 SER CB 1 1 15 8390 1 1 16 SER H H 7.230 -0.034 1.813 1.00 . A A . 16 SER H 1 1 15 8391 1 1 16 SER HA H 9.488 1.161 3.167 1.00 . A A . 16 SER HA 1 1 15 8392 1 1 16 SER HB2 H 9.089 -1.245 1.448 1.00 . A A . 16 SER HB2 1 1 15 8393 1 1 16 SER HB3 H 10.644 -0.807 2.133 1.00 . A A . 16 SER HB3 1 1 15 8394 1 1 16 SER HG H 8.512 -0.722 3.896 1.00 . A A . 16 SER HG 1 1 15 8395 1 1 16 SER N N 7.680 0.788 2.119 1.00 . A A . 16 SER N 1 1 15 8396 1 1 16 SER O O 11.080 1.793 1.271 1.00 . A A . 16 SER O 1 1 15 8397 1 1 16 SER OG O 9.154 -1.313 3.495 1.00 . A A . 16 SER OG 1 1 15 8398 1 1 17 LEU C C 10.024 3.559 -1.288 1.00 . A A . 17 LEU C 1 1 15 8399 1 1 17 LEU CA C 10.209 2.040 -1.224 1.00 . A A . 17 LEU CA 1 1 15 8400 1 1 17 LEU CB C 9.790 1.290 -2.493 1.00 . A A . 17 LEU CB 1 1 15 8401 1 1 17 LEU CD1 C 9.143 3.259 -3.931 1.00 . A A . 17 LEU CD1 1 1 15 8402 1 1 17 LEU CD2 C 8.113 1.000 -4.265 1.00 . A A . 17 LEU CD2 1 1 15 8403 1 1 17 LEU CG C 8.658 1.988 -3.238 1.00 . A A . 17 LEU CG 1 1 15 8404 1 1 17 LEU H H 8.534 1.087 -0.268 1.00 . A A . 17 LEU H 1 1 15 8405 1 1 17 LEU HA H 11.255 1.850 -1.048 1.00 . A A . 17 LEU HA 1 1 15 8406 1 1 17 LEU HB2 H 10.627 1.179 -3.162 1.00 . A A . 17 LEU HB2 1 1 15 8407 1 1 17 LEU HB3 H 9.442 0.308 -2.196 1.00 . A A . 17 LEU HB3 1 1 15 8408 1 1 17 LEU HD11 H 10.157 3.467 -3.623 1.00 . A A . 17 LEU HD11 1 1 15 8409 1 1 17 LEU HD12 H 9.100 3.126 -5.002 1.00 . A A . 17 LEU HD12 1 1 15 8410 1 1 17 LEU HD13 H 8.501 4.077 -3.642 1.00 . A A . 17 LEU HD13 1 1 15 8411 1 1 17 LEU HD21 H 8.934 0.548 -4.800 1.00 . A A . 17 LEU HD21 1 1 15 8412 1 1 17 LEU HD22 H 7.566 0.234 -3.736 1.00 . A A . 17 LEU HD22 1 1 15 8413 1 1 17 LEU HD23 H 7.452 1.497 -4.962 1.00 . A A . 17 LEU HD23 1 1 15 8414 1 1 17 LEU HG H 7.886 2.216 -2.525 1.00 . A A . 17 LEU HG 1 1 15 8415 1 1 17 LEU N N 9.431 1.436 -0.109 1.00 . A A . 17 LEU N 1 1 15 8416 1 1 17 LEU O O 10.971 4.291 -1.498 1.00 . A A . 17 LEU O 1 1 15 8417 1 1 18 GLY C C 7.458 5.898 -2.088 1.00 . A A . 18 GLY C 1 1 15 8418 1 1 18 GLY CA C 8.614 5.524 -1.158 1.00 . A A . 18 GLY CA 1 1 15 8419 1 1 18 GLY H H 8.093 3.434 -0.940 1.00 . A A . 18 GLY H 1 1 15 8420 1 1 18 GLY HA2 H 8.393 5.880 -0.162 1.00 . A A . 18 GLY HA2 1 1 15 8421 1 1 18 GLY HA3 H 9.516 6.001 -1.510 1.00 . A A . 18 GLY HA3 1 1 15 8422 1 1 18 GLY N N 8.831 4.048 -1.109 1.00 . A A . 18 GLY N 1 1 15 8423 1 1 18 GLY O O 7.188 7.061 -2.310 1.00 . A A . 18 GLY O 1 1 15 8424 1 1 19 ASN C C 4.815 6.201 -2.780 1.00 . A A . 19 ASN C 1 1 15 8425 1 1 19 ASN CA C 5.648 5.185 -3.553 1.00 . A A . 19 ASN CA 1 1 15 8426 1 1 19 ASN CB C 4.684 4.000 -3.714 1.00 . A A . 19 ASN CB 1 1 15 8427 1 1 19 ASN CG C 5.275 2.713 -3.193 1.00 . A A . 19 ASN CG 1 1 15 8428 1 1 19 ASN H H 7.045 4.003 -2.426 1.00 . A A . 19 ASN H 1 1 15 8429 1 1 19 ASN HA H 5.969 5.584 -4.505 1.00 . A A . 19 ASN HA 1 1 15 8430 1 1 19 ASN HB2 H 3.706 4.126 -3.293 1.00 . A A . 19 ASN HB2 1 1 15 8431 1 1 19 ASN HB3 H 4.523 3.816 -4.755 1.00 . A A . 19 ASN HB3 1 1 15 8432 1 1 19 ASN HD21 H 5.229 1.955 -4.997 1.00 . A A . 19 ASN HD21 1 1 15 8433 1 1 19 ASN HD22 H 5.830 0.899 -3.830 1.00 . A A . 19 ASN HD22 1 1 15 8434 1 1 19 ASN N N 6.785 4.920 -2.630 1.00 . A A . 19 ASN N 1 1 15 8435 1 1 19 ASN ND2 N 5.469 1.771 -4.069 1.00 . A A . 19 ASN ND2 1 1 15 8436 1 1 19 ASN O O 4.603 7.326 -3.183 1.00 . A A . 19 ASN O 1 1 15 8437 1 1 19 ASN OD1 O 5.530 2.638 -2.022 1.00 . A A . 19 ASN OD1 1 1 15 8438 1 1 20 CYS C C 2.872 7.765 -1.331 1.00 . A A . 20 CYS C 1 1 15 8439 1 1 20 CYS CA C 3.517 6.525 -0.718 1.00 . A A . 20 CYS CA 1 1 15 8440 1 1 20 CYS CB C 4.177 6.855 0.619 1.00 . A A . 20 CYS CB 1 1 15 8441 1 1 20 CYS H H 4.584 4.811 -1.403 1.00 . A A . 20 CYS H 1 1 15 8442 1 1 20 CYS HA H 2.691 5.862 -0.504 1.00 . A A . 20 CYS HA 1 1 15 8443 1 1 20 CYS HB2 H 5.077 6.270 0.745 1.00 . A A . 20 CYS HB2 1 1 15 8444 1 1 20 CYS HB3 H 4.329 7.911 0.728 1.00 . A A . 20 CYS HB3 1 1 15 8445 1 1 20 CYS N N 4.360 5.733 -1.650 1.00 . A A . 20 CYS N 1 1 15 8446 1 1 20 CYS O O 3.342 8.878 -1.199 1.00 . A A . 20 CYS O 1 1 15 8447 1 1 20 CYS SG S 3.023 6.304 1.893 1.00 . A A . 20 CYS SG 1 1 15 8448 1 1 21 ARG C C 1.458 8.934 -4.063 1.00 . A A . 21 ARG C 1 1 15 8449 1 1 21 ARG CA C 0.932 8.513 -2.691 1.00 . A A . 21 ARG CA 1 1 15 8450 1 1 21 ARG CB C 0.863 9.747 -1.811 1.00 . A A . 21 ARG CB 1 1 15 8451 1 1 21 ARG CD C -1.058 11.259 -2.368 1.00 . A A . 21 ARG CD 1 1 15 8452 1 1 21 ARG CG C -0.600 10.075 -1.515 1.00 . A A . 21 ARG CG 1 1 15 8453 1 1 21 ARG CZ C -2.505 13.136 -1.859 1.00 . A A . 21 ARG CZ 1 1 15 8454 1 1 21 ARG H H 1.525 6.546 -2.011 1.00 . A A . 21 ARG H 1 1 15 8455 1 1 21 ARG HA H -0.079 8.151 -2.808 1.00 . A A . 21 ARG HA 1 1 15 8456 1 1 21 ARG HB2 H 1.393 9.531 -0.896 1.00 . A A . 21 ARG HB2 1 1 15 8457 1 1 21 ARG HB3 H 1.328 10.559 -2.344 1.00 . A A . 21 ARG HB3 1 1 15 8458 1 1 21 ARG HD2 H -0.229 11.617 -2.963 1.00 . A A . 21 ARG HD2 1 1 15 8459 1 1 21 ARG HD3 H -1.860 10.947 -3.020 1.00 . A A . 21 ARG HD3 1 1 15 8460 1 1 21 ARG HE H -1.127 12.474 -0.592 1.00 . A A . 21 ARG HE 1 1 15 8461 1 1 21 ARG HG2 H -1.201 9.204 -1.739 1.00 . A A . 21 ARG HG2 1 1 15 8462 1 1 21 ARG HG3 H -0.706 10.323 -0.470 1.00 . A A . 21 ARG HG3 1 1 15 8463 1 1 21 ARG HH11 H -1.422 14.017 -3.293 1.00 . A A . 21 ARG HH11 1 1 15 8464 1 1 21 ARG HH12 H -3.053 14.580 -3.133 1.00 . A A . 21 ARG HH12 1 1 15 8465 1 1 21 ARG HH21 H -3.815 12.438 -0.515 1.00 . A A . 21 ARG HH21 1 1 15 8466 1 1 21 ARG HH22 H -4.407 13.686 -1.560 1.00 . A A . 21 ARG HH22 1 1 15 8467 1 1 21 ARG N N 1.779 7.491 -1.992 1.00 . A A . 21 ARG N 1 1 15 8468 1 1 21 ARG NE N -1.538 12.348 -1.473 1.00 . A A . 21 ARG NE 1 1 15 8469 1 1 21 ARG NH1 N -2.311 13.976 -2.838 1.00 . A A . 21 ARG NH1 1 1 15 8470 1 1 21 ARG NH2 N -3.666 13.082 -1.265 1.00 . A A . 21 ARG NH2 1 1 15 8471 1 1 21 ARG O O 1.012 9.890 -4.666 1.00 . A A . 21 ARG O 1 1 15 8472 1 1 22 THR C C 2.696 7.321 -6.810 1.00 . A A . 22 THR C 1 1 15 8473 1 1 22 THR CA C 3.037 8.468 -5.858 1.00 . A A . 22 THR CA 1 1 15 8474 1 1 22 THR CB C 4.556 8.570 -5.703 1.00 . A A . 22 THR CB 1 1 15 8475 1 1 22 THR CG2 C 4.898 9.496 -4.535 1.00 . A A . 22 THR CG2 1 1 15 8476 1 1 22 THR H H 2.698 7.455 -3.977 1.00 . A A . 22 THR H 1 1 15 8477 1 1 22 THR HA H 2.648 9.394 -6.256 1.00 . A A . 22 THR HA 1 1 15 8478 1 1 22 THR HB H 4.984 8.978 -6.606 1.00 . A A . 22 THR HB 1 1 15 8479 1 1 22 THR HG1 H 5.533 6.986 -6.267 1.00 . A A . 22 THR HG1 1 1 15 8480 1 1 22 THR HG21 H 4.067 9.527 -3.845 1.00 . A A . 22 THR HG21 1 1 15 8481 1 1 22 THR HG22 H 5.775 9.124 -4.026 1.00 . A A . 22 THR HG22 1 1 15 8482 1 1 22 THR HG23 H 5.093 10.490 -4.909 1.00 . A A . 22 THR HG23 1 1 15 8483 1 1 22 THR N N 2.411 8.198 -4.534 1.00 . A A . 22 THR N 1 1 15 8484 1 1 22 THR O O 3.207 7.245 -7.910 1.00 . A A . 22 THR O 1 1 15 8485 1 1 22 THR OG1 O 5.089 7.275 -5.467 1.00 . A A . 22 THR OG1 1 1 15 8486 1 1 23 SER C C -0.043 5.097 -7.084 1.00 . A A . 23 SER C 1 1 15 8487 1 1 23 SER CA C 1.460 5.290 -7.282 1.00 . A A . 23 SER CA 1 1 15 8488 1 1 23 SER CB C 2.253 4.045 -6.867 1.00 . A A . 23 SER CB 1 1 15 8489 1 1 23 SER H H 1.423 6.495 -5.512 1.00 . A A . 23 SER H 1 1 15 8490 1 1 23 SER HA H 1.652 5.550 -8.313 1.00 . A A . 23 SER HA 1 1 15 8491 1 1 23 SER HB2 H 2.451 4.059 -5.807 1.00 . A A . 23 SER HB2 1 1 15 8492 1 1 23 SER HB3 H 1.688 3.153 -7.106 1.00 . A A . 23 SER HB3 1 1 15 8493 1 1 23 SER HG H 3.315 4.077 -8.497 1.00 . A A . 23 SER HG 1 1 15 8494 1 1 23 SER N N 1.835 6.428 -6.402 1.00 . A A . 23 SER N 1 1 15 8495 1 1 23 SER O O -0.541 5.238 -5.987 1.00 . A A . 23 SER O 1 1 15 8496 1 1 23 SER OG O 3.497 4.053 -7.554 1.00 . A A . 23 SER OG 1 1 15 8497 1 1 24 GLN C C -2.501 3.425 -6.942 1.00 . A A . 24 GLN C 1 1 15 8498 1 1 24 GLN CA C -2.251 4.617 -7.865 1.00 . A A . 24 GLN CA 1 1 15 8499 1 1 24 GLN CB C -2.987 4.427 -9.193 1.00 . A A . 24 GLN CB 1 1 15 8500 1 1 24 GLN CD C -3.074 5.440 -11.476 1.00 . A A . 24 GLN CD 1 1 15 8501 1 1 24 GLN CG C -2.970 5.739 -9.980 1.00 . A A . 24 GLN CG 1 1 15 8502 1 1 24 GLN H H -0.407 4.675 -8.997 1.00 . A A . 24 GLN H 1 1 15 8503 1 1 24 GLN HA H -2.618 5.505 -7.371 1.00 . A A . 24 GLN HA 1 1 15 8504 1 1 24 GLN HB2 H -2.498 3.654 -9.766 1.00 . A A . 24 GLN HB2 1 1 15 8505 1 1 24 GLN HB3 H -4.010 4.144 -9.002 1.00 . A A . 24 GLN HB3 1 1 15 8506 1 1 24 GLN HE21 H -3.809 7.229 -11.928 1.00 . A A . 24 GLN HE21 1 1 15 8507 1 1 24 GLN HE22 H -3.605 6.175 -13.243 1.00 . A A . 24 GLN HE22 1 1 15 8508 1 1 24 GLN HG2 H -3.804 6.353 -9.673 1.00 . A A . 24 GLN HG2 1 1 15 8509 1 1 24 GLN HG3 H -2.046 6.263 -9.788 1.00 . A A . 24 GLN HG3 1 1 15 8510 1 1 24 GLN N N -0.790 4.788 -8.103 1.00 . A A . 24 GLN N 1 1 15 8511 1 1 24 GLN NE2 N -3.534 6.357 -12.283 1.00 . A A . 24 GLN NE2 1 1 15 8512 1 1 24 GLN O O -2.772 3.596 -5.771 1.00 . A A . 24 GLN O 1 1 15 8513 1 1 24 GLN OE1 O -2.734 4.361 -11.917 1.00 . A A . 24 GLN OE1 1 1 15 8514 1 1 25 LYS C C -1.894 1.238 -5.247 1.00 . A A . 25 LYS C 1 1 15 8515 1 1 25 LYS CA C -2.660 1.054 -6.558 1.00 . A A . 25 LYS CA 1 1 15 8516 1 1 25 LYS CB C -2.182 -0.221 -7.252 1.00 . A A . 25 LYS CB 1 1 15 8517 1 1 25 LYS CD C -3.259 -2.385 -7.940 1.00 . A A . 25 LYS CD 1 1 15 8518 1 1 25 LYS CE C -4.208 -1.840 -9.009 1.00 . A A . 25 LYS CE 1 1 15 8519 1 1 25 LYS CG C -3.104 -1.359 -6.817 1.00 . A A . 25 LYS CG 1 1 15 8520 1 1 25 LYS H H -2.201 2.087 -8.387 1.00 . A A . 25 LYS H 1 1 15 8521 1 1 25 LYS HA H -3.716 0.975 -6.349 1.00 . A A . 25 LYS HA 1 1 15 8522 1 1 25 LYS HB2 H -2.231 -0.091 -8.324 1.00 . A A . 25 LYS HB2 1 1 15 8523 1 1 25 LYS HB3 H -1.172 -0.451 -6.952 1.00 . A A . 25 LYS HB3 1 1 15 8524 1 1 25 LYS HD2 H -2.292 -2.586 -8.380 1.00 . A A . 25 LYS HD2 1 1 15 8525 1 1 25 LYS HD3 H -3.671 -3.295 -7.532 1.00 . A A . 25 LYS HD3 1 1 15 8526 1 1 25 LYS HE2 H -4.775 -2.654 -9.435 1.00 . A A . 25 LYS HE2 1 1 15 8527 1 1 25 LYS HE3 H -4.884 -1.127 -8.560 1.00 . A A . 25 LYS HE3 1 1 15 8528 1 1 25 LYS HG2 H -2.701 -1.834 -5.932 1.00 . A A . 25 LYS HG2 1 1 15 8529 1 1 25 LYS HG3 H -4.073 -0.945 -6.578 1.00 . A A . 25 LYS HG3 1 1 15 8530 1 1 25 LYS HZ1 H -2.440 -1.516 -10.063 1.00 . A A . 25 LYS HZ1 1 1 15 8531 1 1 25 LYS HZ2 H -3.839 -1.386 -11.008 1.00 . A A . 25 LYS HZ2 1 1 15 8532 1 1 25 LYS HZ3 H -3.431 -0.141 -9.926 1.00 . A A . 25 LYS HZ3 1 1 15 8533 1 1 25 LYS N N -2.418 2.224 -7.442 1.00 . A A . 25 LYS N 1 1 15 8534 1 1 25 LYS NZ N -3.420 -1.170 -10.082 1.00 . A A . 25 LYS NZ 1 1 15 8535 1 1 25 LYS O O -2.472 1.447 -4.203 1.00 . A A . 25 LYS O 1 1 15 8536 1 1 26 TYR C C -0.350 2.364 -3.093 1.00 . A A . 26 TYR C 1 1 15 8537 1 1 26 TYR CA C 0.226 1.329 -4.064 1.00 . A A . 26 TYR CA 1 1 15 8538 1 1 26 TYR CB C 1.625 1.763 -4.478 1.00 . A A . 26 TYR CB 1 1 15 8539 1 1 26 TYR CD1 C 2.119 -0.744 -4.615 1.00 . A A . 26 TYR CD1 1 1 15 8540 1 1 26 TYR CD2 C 3.440 0.816 -5.891 1.00 . A A . 26 TYR CD2 1 1 15 8541 1 1 26 TYR CE1 C 2.873 -1.792 -5.125 1.00 . A A . 26 TYR CE1 1 1 15 8542 1 1 26 TYR CE2 C 4.201 -0.236 -6.407 1.00 . A A . 26 TYR CE2 1 1 15 8543 1 1 26 TYR CG C 2.398 0.575 -4.995 1.00 . A A . 26 TYR CG 1 1 15 8544 1 1 26 TYR CZ C 3.919 -1.553 -6.024 1.00 . A A . 26 TYR CZ 1 1 15 8545 1 1 26 TYR H H -0.153 0.993 -6.154 1.00 . A A . 26 TYR H 1 1 15 8546 1 1 26 TYR HA H 0.316 0.382 -3.563 1.00 . A A . 26 TYR HA 1 1 15 8547 1 1 26 TYR HB2 H 1.548 2.510 -5.253 1.00 . A A . 26 TYR HB2 1 1 15 8548 1 1 26 TYR HB3 H 2.139 2.183 -3.626 1.00 . A A . 26 TYR HB3 1 1 15 8549 1 1 26 TYR HD1 H 1.335 -1.018 -3.930 1.00 . A A . 26 TYR HD1 1 1 15 8550 1 1 26 TYR HD2 H 3.661 1.830 -6.190 1.00 . A A . 26 TYR HD2 1 1 15 8551 1 1 26 TYR HE1 H 2.607 -2.778 -4.794 1.00 . A A . 26 TYR HE1 1 1 15 8552 1 1 26 TYR HE2 H 5.002 -0.013 -7.095 1.00 . A A . 26 TYR HE2 1 1 15 8553 1 1 26 TYR HH H 4.581 -2.592 -7.483 1.00 . A A . 26 TYR HH 1 1 15 8554 1 1 26 TYR N N -0.596 1.163 -5.297 1.00 . A A . 26 TYR N 1 1 15 8555 1 1 26 TYR O O -0.602 2.062 -1.945 1.00 . A A . 26 TYR O 1 1 15 8556 1 1 26 TYR OH O 4.663 -2.602 -6.526 1.00 . A A . 26 TYR OH 1 1 15 8557 1 1 27 ARG C C -2.401 3.991 -1.889 1.00 . A A . 27 ARG C 1 1 15 8558 1 1 27 ARG CA C -1.128 4.558 -2.527 1.00 . A A . 27 ARG CA 1 1 15 8559 1 1 27 ARG CB C -1.397 5.906 -3.203 1.00 . A A . 27 ARG CB 1 1 15 8560 1 1 27 ARG CD C -3.110 7.354 -4.291 1.00 . A A . 27 ARG CD 1 1 15 8561 1 1 27 ARG CG C -2.841 5.974 -3.690 1.00 . A A . 27 ARG CG 1 1 15 8562 1 1 27 ARG CZ C -3.417 8.696 -2.299 1.00 . A A . 27 ARG CZ 1 1 15 8563 1 1 27 ARG H H -0.378 3.855 -4.420 1.00 . A A . 27 ARG H 1 1 15 8564 1 1 27 ARG HA H -0.374 4.682 -1.767 1.00 . A A . 27 ARG HA 1 1 15 8565 1 1 27 ARG HB2 H -1.227 6.710 -2.500 1.00 . A A . 27 ARG HB2 1 1 15 8566 1 1 27 ARG HB3 H -0.738 6.018 -4.049 1.00 . A A . 27 ARG HB3 1 1 15 8567 1 1 27 ARG HD2 H -2.558 7.455 -5.213 1.00 . A A . 27 ARG HD2 1 1 15 8568 1 1 27 ARG HD3 H -4.167 7.463 -4.487 1.00 . A A . 27 ARG HD3 1 1 15 8569 1 1 27 ARG HE H -1.821 8.867 -3.469 1.00 . A A . 27 ARG HE 1 1 15 8570 1 1 27 ARG HG2 H -2.974 5.223 -4.455 1.00 . A A . 27 ARG HG2 1 1 15 8571 1 1 27 ARG HG3 H -3.512 5.804 -2.861 1.00 . A A . 27 ARG HG3 1 1 15 8572 1 1 27 ARG HH11 H -3.148 6.925 -1.404 1.00 . A A . 27 ARG HH11 1 1 15 8573 1 1 27 ARG HH12 H -4.160 8.046 -0.557 1.00 . A A . 27 ARG HH12 1 1 15 8574 1 1 27 ARG HH21 H -3.859 10.535 -2.952 1.00 . A A . 27 ARG HH21 1 1 15 8575 1 1 27 ARG HH22 H -4.562 10.090 -1.433 1.00 . A A . 27 ARG HH22 1 1 15 8576 1 1 27 ARG N N -0.572 3.583 -3.502 1.00 . A A . 27 ARG N 1 1 15 8577 1 1 27 ARG NE N -2.671 8.401 -3.329 1.00 . A A . 27 ARG NE 1 1 15 8578 1 1 27 ARG NH1 N -3.588 7.821 -1.346 1.00 . A A . 27 ARG NH1 1 1 15 8579 1 1 27 ARG NH2 N -3.991 9.865 -2.222 1.00 . A A . 27 ARG NH2 1 1 15 8580 1 1 27 ARG O O -2.548 3.978 -0.683 1.00 . A A . 27 ARG O 1 1 15 8581 1 1 28 ALA C C -4.326 1.515 -1.675 1.00 . A A . 28 ALA C 1 1 15 8582 1 1 28 ALA CA C -4.589 2.953 -2.131 1.00 . A A . 28 ALA CA 1 1 15 8583 1 1 28 ALA CB C -5.669 2.956 -3.214 1.00 . A A . 28 ALA CB 1 1 15 8584 1 1 28 ALA H H -3.178 3.543 -3.655 1.00 . A A . 28 ALA H 1 1 15 8585 1 1 28 ALA HA H -4.912 3.545 -1.289 1.00 . A A . 28 ALA HA 1 1 15 8586 1 1 28 ALA HB1 H -5.309 3.490 -4.081 1.00 . A A . 28 ALA HB1 1 1 15 8587 1 1 28 ALA HB2 H -5.906 1.939 -3.490 1.00 . A A . 28 ALA HB2 1 1 15 8588 1 1 28 ALA HB3 H -6.557 3.442 -2.836 1.00 . A A . 28 ALA HB3 1 1 15 8589 1 1 28 ALA N N -3.324 3.522 -2.686 1.00 . A A . 28 ALA N 1 1 15 8590 1 1 28 ALA O O -4.199 1.245 -0.497 1.00 . A A . 28 ALA O 1 1 15 8591 1 1 29 ASN C C -3.032 -1.005 -1.108 1.00 . A A . 29 ASN C 1 1 15 8592 1 1 29 ASN CA C -3.989 -0.839 -2.292 1.00 . A A . 29 ASN CA 1 1 15 8593 1 1 29 ASN CB C -3.418 -1.523 -3.538 1.00 . A A . 29 ASN CB 1 1 15 8594 1 1 29 ASN CG C -4.562 -1.882 -4.490 1.00 . A A . 29 ASN CG 1 1 15 8595 1 1 29 ASN H H -4.355 0.865 -3.539 1.00 . A A . 29 ASN H 1 1 15 8596 1 1 29 ASN HA H -4.917 -1.320 -2.035 1.00 . A A . 29 ASN HA 1 1 15 8597 1 1 29 ASN HB2 H -2.731 -0.855 -4.038 1.00 . A A . 29 ASN HB2 1 1 15 8598 1 1 29 ASN HB3 H -2.900 -2.426 -3.256 1.00 . A A . 29 ASN HB3 1 1 15 8599 1 1 29 ASN HD21 H -5.714 -0.356 -3.951 1.00 . A A . 29 ASN HD21 1 1 15 8600 1 1 29 ASN HD22 H -6.365 -1.377 -5.142 1.00 . A A . 29 ASN HD22 1 1 15 8601 1 1 29 ASN N N -4.245 0.599 -2.605 1.00 . A A . 29 ASN N 1 1 15 8602 1 1 29 ASN ND2 N -5.636 -1.142 -4.529 1.00 . A A . 29 ASN ND2 1 1 15 8603 1 1 29 ASN O O -3.064 -2.006 -0.424 1.00 . A A . 29 ASN O 1 1 15 8604 1 1 29 ASN OD1 O -4.475 -2.856 -5.211 1.00 . A A . 29 ASN OD1 1 1 15 8605 1 1 30 CYS C C -1.443 1.027 1.202 1.00 . A A . 30 CYS C 1 1 15 8606 1 1 30 CYS CA C -1.241 -0.188 0.304 1.00 . A A . 30 CYS CA 1 1 15 8607 1 1 30 CYS CB C 0.156 -0.309 -0.302 1.00 . A A . 30 CYS CB 1 1 15 8608 1 1 30 CYS H H -2.150 0.752 -1.393 1.00 . A A . 30 CYS H 1 1 15 8609 1 1 30 CYS HA H -1.477 -1.073 0.880 1.00 . A A . 30 CYS HA 1 1 15 8610 1 1 30 CYS HB2 H 0.407 0.568 -0.879 1.00 . A A . 30 CYS HB2 1 1 15 8611 1 1 30 CYS HB3 H 0.893 -0.493 0.465 1.00 . A A . 30 CYS HB3 1 1 15 8612 1 1 30 CYS N N -2.180 -0.056 -0.842 1.00 . A A . 30 CYS N 1 1 15 8613 1 1 30 CYS O O -0.547 1.782 1.514 1.00 . A A . 30 CYS O 1 1 15 8614 1 1 30 CYS SG S 0.014 -1.783 -1.341 1.00 . A A . 30 CYS SG 1 1 15 8615 1 1 31 ALA C C -2.918 1.886 3.955 1.00 . A A . 31 ALA C 1 1 15 8616 1 1 31 ALA CA C -3.074 2.312 2.488 1.00 . A A . 31 ALA CA 1 1 15 8617 1 1 31 ALA CB C -4.547 2.625 2.214 1.00 . A A . 31 ALA CB 1 1 15 8618 1 1 31 ALA H H -3.354 0.540 1.318 1.00 . A A . 31 ALA H 1 1 15 8619 1 1 31 ALA HA H -2.469 3.175 2.248 1.00 . A A . 31 ALA HA 1 1 15 8620 1 1 31 ALA HB1 H -4.893 2.017 1.392 1.00 . A A . 31 ALA HB1 1 1 15 8621 1 1 31 ALA HB2 H -5.131 2.397 3.093 1.00 . A A . 31 ALA HB2 1 1 15 8622 1 1 31 ALA HB3 H -4.666 3.667 1.964 1.00 . A A . 31 ALA HB3 1 1 15 8623 1 1 31 ALA N N -2.674 1.183 1.605 1.00 . A A . 31 ALA N 1 1 15 8624 1 1 31 ALA O O -3.036 2.673 4.871 1.00 . A A . 31 ALA O 1 1 15 8625 1 1 32 LYS C C -1.022 0.305 6.013 1.00 . A A . 32 LYS C 1 1 15 8626 1 1 32 LYS CA C -2.489 0.157 5.606 1.00 . A A . 32 LYS CA 1 1 15 8627 1 1 32 LYS CB C -2.809 -1.340 5.666 1.00 . A A . 32 LYS CB 1 1 15 8628 1 1 32 LYS CD C -1.823 -3.610 6.220 1.00 . A A . 32 LYS CD 1 1 15 8629 1 1 32 LYS CE C -0.738 -4.261 5.360 1.00 . A A . 32 LYS CE 1 1 15 8630 1 1 32 LYS CG C -1.575 -2.104 6.157 1.00 . A A . 32 LYS CG 1 1 15 8631 1 1 32 LYS H H -2.558 -0.001 3.459 1.00 . A A . 32 LYS H 1 1 15 8632 1 1 32 LYS HA H -3.146 0.692 6.275 1.00 . A A . 32 LYS HA 1 1 15 8633 1 1 32 LYS HB2 H -3.634 -1.510 6.338 1.00 . A A . 32 LYS HB2 1 1 15 8634 1 1 32 LYS HB3 H -3.063 -1.690 4.678 1.00 . A A . 32 LYS HB3 1 1 15 8635 1 1 32 LYS HD2 H -1.753 -3.950 7.243 1.00 . A A . 32 LYS HD2 1 1 15 8636 1 1 32 LYS HD3 H -2.791 -3.849 5.807 1.00 . A A . 32 LYS HD3 1 1 15 8637 1 1 32 LYS HE2 H 0.190 -3.739 5.524 1.00 . A A . 32 LYS HE2 1 1 15 8638 1 1 32 LYS HE3 H -0.612 -5.305 5.608 1.00 . A A . 32 LYS HE3 1 1 15 8639 1 1 32 LYS HG2 H -0.770 -1.951 5.454 1.00 . A A . 32 LYS HG2 1 1 15 8640 1 1 32 LYS HG3 H -1.286 -1.751 7.135 1.00 . A A . 32 LYS HG3 1 1 15 8641 1 1 32 LYS HZ1 H -1.362 -3.140 3.723 1.00 . A A . 32 LYS HZ1 1 1 15 8642 1 1 32 LYS HZ2 H -0.315 -4.418 3.333 1.00 . A A . 32 LYS HZ2 1 1 15 8643 1 1 32 LYS HZ3 H -1.942 -4.730 3.729 1.00 . A A . 32 LYS HZ3 1 1 15 8644 1 1 32 LYS N N -2.651 0.633 4.201 1.00 . A A . 32 LYS N 1 1 15 8645 1 1 32 LYS NZ N -1.118 -4.130 3.927 1.00 . A A . 32 LYS NZ 1 1 15 8646 1 1 32 LYS O O -0.662 0.562 7.144 1.00 . A A . 32 LYS O 1 1 15 8647 1 1 33 THR C C 1.873 1.568 4.861 1.00 . A A . 33 THR C 1 1 15 8648 1 1 33 THR CA C 1.284 0.183 5.122 1.00 . A A . 33 THR CA 1 1 15 8649 1 1 33 THR CB C 1.703 -0.758 3.995 1.00 . A A . 33 THR CB 1 1 15 8650 1 1 33 THR CG2 C 3.109 -1.313 4.199 1.00 . A A . 33 THR CG2 1 1 15 8651 1 1 33 THR H H -0.581 -0.095 4.145 1.00 . A A . 33 THR H 1 1 15 8652 1 1 33 THR HA H 1.683 -0.230 6.029 1.00 . A A . 33 THR HA 1 1 15 8653 1 1 33 THR HB H 1.672 -0.220 3.059 1.00 . A A . 33 THR HB 1 1 15 8654 1 1 33 THR HG1 H 1.191 -2.594 4.372 1.00 . A A . 33 THR HG1 1 1 15 8655 1 1 33 THR HG21 H 3.676 -0.656 4.839 1.00 . A A . 33 THR HG21 1 1 15 8656 1 1 33 THR HG22 H 3.042 -2.298 4.635 1.00 . A A . 33 THR HG22 1 1 15 8657 1 1 33 THR HG23 H 3.579 -1.373 3.229 1.00 . A A . 33 THR HG23 1 1 15 8658 1 1 33 THR N N -0.199 0.116 5.023 1.00 . A A . 33 THR N 1 1 15 8659 1 1 33 THR O O 2.844 1.970 5.473 1.00 . A A . 33 THR O 1 1 15 8660 1 1 33 THR OG1 O 0.787 -1.841 3.936 1.00 . A A . 33 THR OG1 1 1 15 8661 1 1 34 CYS C C 0.964 4.700 4.336 1.00 . A A . 34 CYS C 1 1 15 8662 1 1 34 CYS CA C 1.788 3.642 3.598 1.00 . A A . 34 CYS CA 1 1 15 8663 1 1 34 CYS CB C 1.524 3.659 2.101 1.00 . A A . 34 CYS CB 1 1 15 8664 1 1 34 CYS H H 0.521 1.920 3.476 1.00 . A A . 34 CYS H 1 1 15 8665 1 1 34 CYS HA H 2.853 3.804 3.751 1.00 . A A . 34 CYS HA 1 1 15 8666 1 1 34 CYS HB2 H 1.342 2.658 1.742 1.00 . A A . 34 CYS HB2 1 1 15 8667 1 1 34 CYS HB3 H 0.703 4.313 1.857 1.00 . A A . 34 CYS HB3 1 1 15 8668 1 1 34 CYS N N 1.295 2.285 3.948 1.00 . A A . 34 CYS N 1 1 15 8669 1 1 34 CYS O O 1.267 5.876 4.306 1.00 . A A . 34 CYS O 1 1 15 8670 1 1 34 CYS SG S 3.043 4.341 1.424 1.00 . A A . 34 CYS SG 1 1 15 8671 1 1 35 GLU C C -1.711 6.179 4.860 1.00 . A A . 35 GLU C 1 1 15 8672 1 1 35 GLU CA C -0.947 5.218 5.762 1.00 . A A . 35 GLU CA 1 1 15 8673 1 1 35 GLU CB C -0.084 5.892 6.820 1.00 . A A . 35 GLU CB 1 1 15 8674 1 1 35 GLU CD C 1.192 5.176 8.866 1.00 . A A . 35 GLU CD 1 1 15 8675 1 1 35 GLU CG C 0.287 4.718 7.721 1.00 . A A . 35 GLU CG 1 1 15 8676 1 1 35 GLU H H -0.301 3.324 5.017 1.00 . A A . 35 GLU H 1 1 15 8677 1 1 35 GLU HA H -1.688 4.616 6.271 1.00 . A A . 35 GLU HA 1 1 15 8678 1 1 35 GLU HB2 H 0.787 6.342 6.363 1.00 . A A . 35 GLU HB2 1 1 15 8679 1 1 35 GLU HB3 H -0.649 6.609 7.394 1.00 . A A . 35 GLU HB3 1 1 15 8680 1 1 35 GLU HG2 H -0.633 4.295 8.103 1.00 . A A . 35 GLU HG2 1 1 15 8681 1 1 35 GLU HG3 H 0.790 3.972 7.121 1.00 . A A . 35 GLU HG3 1 1 15 8682 1 1 35 GLU N N -0.077 4.278 5.004 1.00 . A A . 35 GLU N 1 1 15 8683 1 1 35 GLU O O -1.598 7.389 4.882 1.00 . A A . 35 GLU O 1 1 15 8684 1 1 35 GLU OE1 O 2.379 5.336 8.629 1.00 . A A . 35 GLU OE1 1 1 15 8685 1 1 35 GLU OE2 O 0.684 5.358 9.960 1.00 . A A . 35 GLU OE2 1 1 15 8686 1 1 36 LEU C C -4.804 5.589 3.293 1.00 . A A . 36 LEU C 1 1 15 8687 1 1 36 LEU CA C -3.397 6.145 3.055 1.00 . A A . 36 LEU CA 1 1 15 8688 1 1 36 LEU CB C -2.869 5.731 1.684 1.00 . A A . 36 LEU CB 1 1 15 8689 1 1 36 LEU CD1 C -0.756 5.503 0.366 1.00 . A A . 36 LEU CD1 1 1 15 8690 1 1 36 LEU CD2 C -0.849 7.073 2.291 1.00 . A A . 36 LEU CD2 1 1 15 8691 1 1 36 LEU CG C -1.343 5.726 1.758 1.00 . A A . 36 LEU CG 1 1 15 8692 1 1 36 LEU H H -2.500 4.556 4.148 1.00 . A A . 36 LEU H 1 1 15 8693 1 1 36 LEU HA H -3.396 7.216 3.146 1.00 . A A . 36 LEU HA 1 1 15 8694 1 1 36 LEU HB2 H -3.243 4.752 1.456 1.00 . A A . 36 LEU HB2 1 1 15 8695 1 1 36 LEU HB3 H -3.188 6.403 0.908 1.00 . A A . 36 LEU HB3 1 1 15 8696 1 1 36 LEU HD11 H -1.393 5.961 -0.378 1.00 . A A . 36 LEU HD11 1 1 15 8697 1 1 36 LEU HD12 H 0.227 5.948 0.310 1.00 . A A . 36 LEU HD12 1 1 15 8698 1 1 36 LEU HD13 H -0.680 4.444 0.166 1.00 . A A . 36 LEU HD13 1 1 15 8699 1 1 36 LEU HD21 H -1.694 7.699 2.532 1.00 . A A . 36 LEU HD21 1 1 15 8700 1 1 36 LEU HD22 H -0.253 6.912 3.178 1.00 . A A . 36 LEU HD22 1 1 15 8701 1 1 36 LEU HD23 H -0.246 7.557 1.537 1.00 . A A . 36 LEU HD23 1 1 15 8702 1 1 36 LEU HG H -1.029 4.935 2.421 1.00 . A A . 36 LEU HG 1 1 15 8703 1 1 36 LEU N N -2.502 5.526 4.064 1.00 . A A . 36 LEU N 1 1 15 8704 1 1 36 LEU O O -5.738 5.956 2.607 1.00 . A A . 36 LEU O 1 1 15 8705 1 1 37 CYS C C -7.280 5.305 4.910 1.00 . A A . 37 CYS C 1 1 15 8706 1 1 37 CYS CA C -6.348 4.167 4.484 1.00 . A A . 37 CYS CA 1 1 15 8707 1 1 37 CYS CB C -6.301 3.110 5.589 1.00 . A A . 37 CYS CB 1 1 15 8708 1 1 37 CYS H H -4.237 4.400 4.816 1.00 . A A . 37 CYS H 1 1 15 8709 1 1 37 CYS HA H -6.719 3.721 3.573 1.00 . A A . 37 CYS HA 1 1 15 8710 1 1 37 CYS HB2 H -6.544 2.143 5.173 1.00 . A A . 37 CYS HB2 1 1 15 8711 1 1 37 CYS HB3 H -5.311 3.080 6.018 1.00 . A A . 37 CYS HB3 1 1 15 8712 1 1 37 CYS N N -4.980 4.710 4.250 1.00 . A A . 37 CYS N 1 1 15 8713 1 1 37 CYS O O -6.843 6.143 5.681 1.00 . A A . 37 CYS O 1 1 15 8714 1 1 37 CYS OXT O -8.412 5.319 4.457 1.00 . A A . 37 CYS OXT 1 1 15 8715 1 1 37 CYS SG S -7.503 3.533 6.875 1.00 . A A . 37 CYS SG 1 1 stop_ save_
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