NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
370025 | 1bk8 | 4163 | cing | 4-filtered-FRED | STAR | entry | full | 672 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1bk8 # This FRED archive file contains, for PDB entry <1bk8>: # # - 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_1bk8 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1bk8 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5850.34 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 $ANTIMICROBIAL_PROTEIN_1 A . 1 1 stop_ save_ save_ANTIMICROBIAL_PROTEIN_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "ANTIMICROBIAL PROTEIN 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code LCNERPSQTWSGNCGNTAHCDKQCQDWEKASHGACHKRENHWKCFCYFNC _Entity.Number_of_monomers 50 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 LEU . 1 1 2 CYS . 1 1 3 ASN . 1 1 4 GLU . 1 1 5 ARG . 1 1 6 PRO . 1 1 7 SER . 1 1 8 GLN . 1 1 9 THR . 1 1 10 TRP . 1 1 11 SER . 1 1 12 GLY . 1 1 13 ASN . 1 1 14 CYS . 1 1 15 GLY . 1 1 16 ASN . 1 1 17 THR . 1 1 18 ALA . 1 1 19 HIS . 1 1 20 CYS . 1 1 21 ASP . 1 1 22 LYS . 1 1 23 GLN . 1 1 24 CYS . 1 1 25 GLN . 1 1 26 ASP . 1 1 27 TRP . 1 1 28 GLU . 1 1 29 LYS . 1 1 30 ALA . 1 1 31 SER . 1 1 32 HIS . 1 1 33 GLY . 1 1 34 ALA . 1 1 35 CYS . 1 1 36 HIS . 1 1 37 LYS . 1 1 38 ARG . 1 1 39 GLU . 1 1 40 ASN . 1 1 41 HIS . 1 1 42 TRP . 1 1 43 LYS . 1 1 44 CYS . 1 1 45 PHE . 1 1 46 CYS . 1 1 47 TYR . 1 1 48 PHE . 1 1 49 ASN . 1 1 50 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 LEU 1 1 1 1 CYS 2 2 1 1 ASN 3 3 1 1 GLU 4 4 1 1 ARG 5 5 1 1 PRO 6 6 1 1 SER 7 7 1 1 GLN 8 8 1 1 THR 9 9 1 1 TRP 10 10 1 1 SER 11 11 1 1 GLY 12 12 1 1 ASN 13 13 1 1 CYS 14 14 1 1 GLY 15 15 1 1 ASN 16 16 1 1 THR 17 17 1 1 ALA 18 18 1 1 HIS 19 19 1 1 CYS 20 20 1 1 ASP 21 21 1 1 LYS 22 22 1 1 GLN 23 23 1 1 CYS 24 24 1 1 GLN 25 25 1 1 ASP 26 26 1 1 TRP 27 27 1 1 GLU 28 28 1 1 LYS 29 29 1 1 ALA 30 30 1 1 SER 31 31 1 1 HIS 32 32 1 1 GLY 33 33 1 1 ALA 34 34 1 1 CYS 35 35 1 1 HIS 36 36 1 1 LYS 37 37 1 1 ARG 38 38 1 1 GLU 39 39 1 1 ASN 40 40 1 1 HIS 41 41 1 1 TRP 42 42 1 1 LYS 43 43 1 1 CYS 44 44 1 1 PHE 45 45 1 1 CYS 46 46 1 1 TYR 47 47 1 1 PHE 48 48 1 1 ASN 49 49 1 1 CYS 50 50 1 1 stop_ save_ save_Discover_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 . . . 1 1 557 1 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 565 1 . . . 1 1 566 1 . . . 1 1 567 1 . . . 1 1 568 1 . . . 1 1 569 1 . . . 1 1 570 1 . . . 1 1 571 1 . . . 1 1 572 1 . . . 1 1 573 1 . . . 1 1 574 1 . . . 1 1 575 1 . . . 1 1 576 1 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 . . . 1 1 581 1 . . . 1 1 582 1 . . . 1 1 583 1 . . . 1 1 584 1 . . . 1 1 585 1 . . . 1 1 586 1 . . . 1 1 587 1 . . . 1 1 588 1 . . . 1 1 589 1 . . . 1 1 590 1 . . . 1 1 591 1 . . . 1 1 592 1 . . . 1 1 593 1 . . . 1 1 594 1 . . . 1 1 595 1 . . . 1 1 596 1 . . . 1 1 597 1 . . . 1 1 598 1 . . . 1 1 599 1 . . . 1 1 600 1 . . . 1 1 601 1 . . . 1 1 602 1 . . . 1 1 603 1 . . . 1 1 604 1 . . . 1 1 605 1 . . . 1 1 606 1 . . . 1 1 607 1 . . . 1 1 608 1 . . . 1 1 609 1 . . . 1 1 610 1 . . . 1 1 611 1 . . . 1 1 612 1 . . . 1 1 613 1 . . . 1 1 614 1 . . . 1 1 615 1 . . . 1 1 616 1 . . . 1 1 617 1 . . . 1 1 618 1 . . . 1 1 619 1 . . . 1 1 620 1 . . . 1 1 621 1 . . . 1 1 622 1 . . . 1 1 623 1 . . . 1 1 624 1 . . . 1 1 625 1 . . . 1 1 626 1 . . . 1 1 627 1 . . . 1 1 628 1 . . . 1 1 629 1 . . . 1 1 630 1 . . . 1 1 631 1 . . . 1 1 632 1 . . . 1 1 633 1 . . . 1 1 634 1 . . . 1 1 635 1 . . . 1 1 636 1 . . . 1 1 637 1 . . . 1 1 638 1 . . . 1 1 639 1 . . . 1 1 640 1 . . . 1 1 641 1 . . . 1 1 642 1 . . . 1 1 643 1 . . . 1 1 644 1 . . . 1 1 645 1 . . . 1 1 646 1 . . . 1 1 647 1 . . . 1 1 648 1 . . . 1 1 649 1 . . . 1 1 650 1 . . . 1 1 651 1 . . . 1 1 652 1 . . . 1 1 653 1 . . . 1 1 654 1 . . . 1 1 655 1 . . . 1 1 656 1 . . . 1 1 657 1 . . . 1 1 658 1 . . . 1 1 659 1 . . . 1 1 660 1 . . . 1 1 661 1 . . . 1 1 662 1 . . . 1 1 663 1 . . . 1 1 664 1 . . . 1 1 665 1 . . . 1 1 666 1 . . . 1 1 667 1 . . . 1 1 668 1 . . . 1 1 669 1 . . . 1 1 670 1 . . . 1 1 671 1 . . . 1 1 672 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 LEU HA 1 1 LEU HA 1 1 1 1 2 1 1 2 CYS H 1 2 CYS HN 1 1 2 1 1 1 1 1 LEU QB 1 1 LEU HB* 1 1 2 1 2 1 1 2 CYS H 1 2 CYS HN 1 1 3 1 1 1 1 1 LEU QD 1 1 LEU HD* 1 1 3 1 2 1 1 2 CYS H 1 2 CYS HN 1 1 4 1 1 1 1 1 LEU QD 1 1 LEU HD* 1 1 4 1 2 1 1 2 CYS HA 1 2 CYS HA 1 1 5 1 1 1 1 1 LEU QD 1 1 LEU HD* 1 1 5 1 2 1 1 3 ASN HA 1 3 ASN HA 1 1 6 1 1 1 1 1 LEU QD 1 1 LEU HD* 1 1 6 1 2 1 1 49 ASN QB 1 49 ASN HB* 1 1 7 1 1 1 1 1 LEU QD 1 1 LEU HD* 1 1 7 1 2 1 1 50 CYS HA 1 50 CYS HA 1 1 8 1 1 1 1 2 CYS H 1 2 CYS HN 1 1 8 1 2 1 1 2 CYS HB2 1 2 CYS HB2 1 1 9 1 1 1 1 2 CYS H 1 2 CYS HN 1 1 9 1 2 1 1 2 CYS HB3 1 2 CYS HB1 1 1 10 1 1 1 1 2 CYS H 1 2 CYS HN 1 1 10 1 2 1 1 3 ASN H 1 3 ASN HN 1 1 11 1 1 1 1 2 CYS H 1 2 CYS HN 1 1 11 1 2 1 1 50 CYS HA 1 50 CYS HA 1 1 12 1 1 1 1 2 CYS H 1 2 CYS HN 1 1 12 1 2 1 1 50 CYS HB2 1 50 CYS HB1 1 1 13 1 1 1 1 2 CYS HA 1 2 CYS HA 1 1 13 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 14 1 1 1 1 2 CYS HA 1 2 CYS HA 1 1 14 1 2 1 1 50 CYS HA 1 50 CYS HA 1 1 15 1 1 1 1 2 CYS HA 1 2 CYS HA 1 1 15 1 2 1 1 50 CYS HB2 1 50 CYS HB1 1 1 16 1 1 1 1 2 CYS QB 1 2 CYS HB* 1 1 16 1 2 1 1 3 ASN H 1 3 ASN HN 1 1 17 1 1 1 1 2 CYS QB 1 2 CYS HB* 1 1 17 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 18 1 1 1 1 2 CYS QB 1 2 CYS HB* 1 1 18 1 2 1 1 47 TYR QB 1 47 TYR HB* 1 1 19 1 1 1 1 2 CYS QB 1 2 CYS HB* 1 1 19 1 2 1 1 50 CYS HA 1 50 CYS HA 1 1 20 1 1 1 1 2 CYS HB2 1 2 CYS HB2 1 1 20 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 21 1 1 1 1 2 CYS HB3 1 2 CYS HB1 1 1 21 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 22 1 1 1 1 3 ASN H 1 3 ASN HN 1 1 22 1 2 1 1 4 GLU H 1 4 GLU HN 1 1 23 1 1 1 1 3 ASN H 1 3 ASN HN 1 1 23 1 2 1 1 48 PHE H 1 48 PHE HN 1 1 24 1 1 1 1 3 ASN HA 1 3 ASN HA 1 1 24 1 2 1 1 4 GLU H 1 4 GLU HN 1 1 25 1 1 1 1 3 ASN QB 1 3 ASN HB* 1 1 25 1 2 1 1 5 ARG QG 1 5 ARG HG* 1 1 26 1 1 1 1 3 ASN HB2 1 3 ASN HB2 1 1 26 1 2 1 1 4 GLU H 1 4 GLU HN 1 1 27 1 1 1 1 3 ASN HB2 1 3 ASN HB2 1 1 27 1 2 1 1 49 ASN HD21 1 49 ASN HD21 1 1 28 1 1 1 1 3 ASN HB2 1 3 ASN HB2 1 1 28 1 2 1 1 49 ASN HD22 1 49 ASN HD22 1 1 29 1 1 1 1 3 ASN HB3 1 3 ASN HB1 1 1 29 1 2 1 1 4 GLU H 1 4 GLU HN 1 1 30 1 1 1 1 3 ASN HB3 1 3 ASN HB1 1 1 30 1 2 1 1 49 ASN HD21 1 49 ASN HD21 1 1 31 1 1 1 1 3 ASN HB3 1 3 ASN HB1 1 1 31 1 2 1 1 49 ASN HD22 1 49 ASN HD22 1 1 32 1 1 1 1 3 ASN QD 1 3 ASN HD2* 1 1 32 1 2 1 1 49 ASN QB 1 49 ASN HB* 1 1 33 1 1 1 1 4 GLU H 1 4 GLU HN 1 1 33 1 2 1 1 4 GLU QB 1 4 GLU HB* 1 1 34 1 1 1 1 4 GLU H 1 4 GLU HN 1 1 34 1 2 1 1 4 GLU HG2 1 4 GLU HG1 1 1 35 1 1 1 1 4 GLU HA 1 4 GLU HA 1 1 35 1 2 1 1 4 GLU HG3 1 4 GLU HG2 1 1 36 1 1 1 1 4 GLU HA 1 4 GLU HA 1 1 36 1 2 1 1 5 ARG H 1 5 ARG HN 1 1 37 1 1 1 1 4 GLU HA 1 4 GLU HA 1 1 37 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 38 1 1 1 1 4 GLU HA 1 4 GLU HA 1 1 38 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 39 1 1 1 1 4 GLU HA 1 4 GLU HA 1 1 39 1 2 1 1 47 TYR HA 1 47 TYR HA 1 1 40 1 1 1 1 4 GLU QB 1 4 GLU HB* 1 1 40 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 41 1 1 1 1 4 GLU QB 1 4 GLU HB* 1 1 41 1 2 1 1 45 PHE HB3 1 45 PHE HB2 1 1 42 1 1 1 1 4 GLU QB 1 4 GLU HB* 1 1 42 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 43 1 1 1 1 4 GLU QB 1 4 GLU HB* 1 1 43 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 44 1 1 1 1 4 GLU HG2 1 4 GLU HG1 1 1 44 1 2 1 1 5 ARG H 1 5 ARG HN 1 1 45 1 1 1 1 4 GLU HG2 1 4 GLU HG1 1 1 45 1 2 1 1 36 HIS HD2 1 36 HIS HD2 1 1 46 1 1 1 1 4 GLU HG2 1 4 GLU HG1 1 1 46 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 47 1 1 1 1 4 GLU HG3 1 4 GLU HG2 1 1 47 1 2 1 1 36 HIS HD2 1 36 HIS HD2 1 1 48 1 1 1 1 4 GLU HG3 1 4 GLU HG2 1 1 48 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 49 1 1 1 1 4 GLU HG3 1 4 GLU HG2 1 1 49 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 50 1 1 1 1 4 GLU HG3 1 4 GLU HG2 1 1 50 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 51 1 1 1 1 5 ARG H 1 5 ARG HN 1 1 51 1 2 1 1 5 ARG QB 1 5 ARG HB* 1 1 52 1 1 1 1 5 ARG H 1 5 ARG HN 1 1 52 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 53 1 1 1 1 5 ARG H 1 5 ARG HN 1 1 53 1 2 1 1 45 PHE HB3 1 45 PHE HB2 1 1 54 1 1 1 1 5 ARG H 1 5 ARG HN 1 1 54 1 2 1 1 46 CYS H 1 46 CYS HN 1 1 55 1 1 1 1 5 ARG H 1 5 ARG HN 1 1 55 1 2 1 1 46 CYS O 1 46 CYS O 1 1 56 1 1 1 1 5 ARG H 1 5 ARG HN 1 1 56 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 57 1 1 1 1 5 ARG H 1 5 ARG HN 1 1 57 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 58 1 1 1 1 5 ARG H 1 5 ARG HN 1 1 58 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 59 1 1 1 1 5 ARG HA 1 5 ARG HA 1 1 59 1 2 1 1 5 ARG QG 1 5 ARG HG* 1 1 60 1 1 1 1 5 ARG HA 1 5 ARG HA 1 1 60 1 2 1 1 6 PRO HD2 1 6 PRO HD2 1 1 61 1 1 1 1 5 ARG HA 1 5 ARG HA 1 1 61 1 2 1 1 6 PRO QD 1 6 PRO HD* 1 1 62 1 1 1 1 5 ARG HA 1 5 ARG HA 1 1 62 1 2 1 1 6 PRO HD3 1 6 PRO HD1 1 1 63 1 1 1 1 5 ARG HA 1 5 ARG HA 1 1 63 1 2 1 1 6 PRO HG3 1 6 PRO HG1 1 1 64 1 1 1 1 5 ARG HA 1 5 ARG HA 1 1 64 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 65 1 1 1 1 5 ARG QB 1 5 ARG HB* 1 1 65 1 2 1 1 6 PRO QD 1 6 PRO HD* 1 1 66 1 1 1 1 5 ARG QB 1 5 ARG HB* 1 1 66 1 2 1 1 48 PHE CG 1 48 PHE CG 1 1 67 1 1 1 1 5 ARG QB 1 5 ARG HB* 1 1 67 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 68 1 1 1 1 5 ARG HB2 1 5 ARG HB2 1 1 68 1 2 1 1 6 PRO HD2 1 6 PRO HD2 1 1 69 1 1 1 1 5 ARG HB2 1 5 ARG HB2 1 1 69 1 2 1 1 6 PRO HD3 1 6 PRO HD1 1 1 70 1 1 1 1 5 ARG HB3 1 5 ARG HB1 1 1 70 1 2 1 1 6 PRO HD2 1 6 PRO HD2 1 1 71 1 1 1 1 5 ARG HB3 1 5 ARG HB1 1 1 71 1 2 1 1 6 PRO HD3 1 6 PRO HD1 1 1 72 1 1 1 1 5 ARG QD 1 5 ARG HD* 1 1 72 1 2 1 1 6 PRO QD 1 6 PRO HD* 1 1 73 1 1 1 1 5 ARG QD 1 5 ARG HD* 1 1 73 1 2 1 1 48 PHE CG 1 48 PHE CG 1 1 74 1 1 1 1 5 ARG QD 1 5 ARG HD* 1 1 74 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 75 1 1 1 1 5 ARG HD2 1 5 ARG HD2 1 1 75 1 2 1 1 6 PRO HD2 1 6 PRO HD2 1 1 76 1 1 1 1 5 ARG HD2 1 5 ARG HD2 1 1 76 1 2 1 1 6 PRO HD3 1 6 PRO HD1 1 1 77 1 1 1 1 5 ARG HD3 1 5 ARG HD1 1 1 77 1 2 1 1 6 PRO HD2 1 6 PRO HD2 1 1 78 1 1 1 1 5 ARG HD3 1 5 ARG HD1 1 1 78 1 2 1 1 6 PRO HD3 1 6 PRO HD1 1 1 79 1 1 1 1 5 ARG QG 1 5 ARG HG* 1 1 79 1 2 1 1 6 PRO HA 1 6 PRO HA 1 1 80 1 1 1 1 5 ARG QG 1 5 ARG HG* 1 1 80 1 2 1 1 6 PRO QD 1 6 PRO HD* 1 1 81 1 1 1 1 5 ARG QG 1 5 ARG HG* 1 1 81 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 82 1 1 1 1 5 ARG N 1 5 ARG N 1 1 82 1 2 1 1 46 CYS O 1 46 CYS O 1 1 83 1 1 1 1 6 PRO HA 1 6 PRO HA 1 1 83 1 2 1 1 7 SER H 1 7 SER HN 1 1 84 1 1 1 1 6 PRO HA 1 6 PRO HA 1 1 84 1 2 1 1 36 HIS HD2 1 36 HIS HD2 1 1 85 1 1 1 1 6 PRO HA 1 6 PRO HA 1 1 85 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 86 1 1 1 1 6 PRO HA 1 6 PRO HA 1 1 86 1 2 1 1 45 PHE HA 1 45 PHE HA 1 1 87 1 1 1 1 6 PRO HA 1 6 PRO HA 1 1 87 1 2 1 1 46 CYS H 1 46 CYS HN 1 1 88 1 1 1 1 6 PRO HB2 1 6 PRO HB1 1 1 88 1 2 1 1 7 SER QB 1 7 SER HB1 1 1 89 1 1 1 1 6 PRO HB3 1 6 PRO HB2 1 1 89 1 2 1 1 7 SER H 1 7 SER HN 1 1 90 1 1 1 1 6 PRO HB3 1 6 PRO HB2 1 1 90 1 2 1 1 45 PHE CZ 1 45 PHE CZ 1 1 91 1 1 1 1 6 PRO HD2 1 6 PRO HD2 1 1 91 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 92 1 1 1 1 6 PRO HD3 1 6 PRO HD1 1 1 92 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 93 1 1 1 1 7 SER H 1 7 SER HN 1 1 93 1 2 1 1 7 SER QB 1 7 SER HB2 1 1 94 1 1 1 1 7 SER H 1 7 SER HN 1 1 94 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 95 1 1 1 1 7 SER H 1 7 SER HN 1 1 95 1 2 1 1 45 PHE HA 1 45 PHE HA 1 1 96 1 1 1 1 7 SER H 1 7 SER HN 1 1 96 1 2 1 1 46 CYS H 1 46 CYS HN 1 1 97 1 1 1 1 7 SER HA 1 7 SER HA 1 1 97 1 2 1 1 7 SER QB 1 7 SER HB1 1 1 98 1 1 1 1 7 SER HA 1 7 SER HA 1 1 98 1 2 1 1 10 TRP H 1 10 TRP HN 1 1 99 1 1 1 1 7 SER HA 1 7 SER HA 1 1 99 1 2 1 1 10 TRP HD1 1 10 TRP HD1 1 1 100 1 1 1 1 7 SER HA 1 7 SER HA 1 1 100 1 2 1 1 45 PHE HA 1 45 PHE HA 1 1 101 1 1 1 1 7 SER QB 1 7 SER HB1 1 1 101 1 2 1 1 8 GLN H 1 8 GLN HN 1 1 102 1 1 1 1 7 SER QB 1 7 SER HB2 1 1 102 1 2 1 1 10 TRP HB3 1 10 TRP HB2 1 1 103 1 1 1 1 7 SER QB 1 7 SER HB1 1 1 103 1 2 1 1 10 TRP HD1 1 10 TRP HD1 1 1 104 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 104 1 2 1 1 8 GLN HB2 1 8 GLN HB2 1 1 105 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 105 1 2 1 1 8 GLN QB 1 8 GLN HB* 1 1 106 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 106 1 2 1 1 8 GLN HB3 1 8 GLN HB1 1 1 107 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 107 1 2 1 1 8 GLN HG2 1 8 GLN HG2 1 1 108 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 108 1 2 1 1 8 GLN QG 1 8 GLN HG* 1 1 109 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 109 1 2 1 1 8 GLN HG3 1 8 GLN HG1 1 1 110 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 110 1 2 1 1 9 THR H 1 9 THR HN 1 1 111 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 111 1 2 1 1 9 THR MG 1 9 THR HG2* 1 1 112 1 1 1 1 8 GLN H 1 8 GLN HN 1 1 112 1 2 1 1 10 TRP H 1 10 TRP HN 1 1 113 1 1 1 1 8 GLN HA 1 8 GLN HA 1 1 113 1 2 1 1 8 GLN QG 1 8 GLN HG* 1 1 114 1 1 1 1 8 GLN HB2 1 8 GLN HB2 1 1 114 1 2 1 1 9 THR MG 1 9 THR HG2* 1 1 115 1 1 1 1 8 GLN HB3 1 8 GLN HB1 1 1 115 1 2 1 1 9 THR MG 1 9 THR HG2* 1 1 116 1 1 1 1 9 THR H 1 9 THR HN 1 1 116 1 2 1 1 10 TRP H 1 10 TRP HN 1 1 117 1 1 1 1 9 THR HA 1 9 THR HA 1 1 117 1 2 1 1 9 THR HB 1 9 THR HB 1 1 118 1 1 1 1 9 THR HA 1 9 THR HA 1 1 118 1 2 1 1 9 THR MG 1 9 THR HG2* 1 1 119 1 1 1 1 9 THR HA 1 9 THR HA 1 1 119 1 2 1 1 27 TRP HE3 1 27 TRP HE3 1 1 120 1 1 1 1 9 THR HB 1 9 THR HB 1 1 120 1 2 1 1 23 GLN HE21 1 23 GLN HE22 1 1 121 1 1 1 1 9 THR HB 1 9 THR HB 1 1 121 1 2 1 1 27 TRP HE3 1 27 TRP HE3 1 1 122 1 1 1 1 9 THR HB 1 9 THR HB 1 1 122 1 2 1 1 27 TRP HZ3 1 27 TRP HZ3 1 1 123 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 123 1 2 1 1 10 TRP H 1 10 TRP HN 1 1 124 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 124 1 2 1 1 27 TRP HA 1 27 TRP HA 1 1 125 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 125 1 2 1 1 27 TRP HB2 1 27 TRP HB2 1 1 126 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 126 1 2 1 1 27 TRP HB3 1 27 TRP HB1 1 1 127 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 127 1 2 1 1 27 TRP HD1 1 27 TRP HD1 1 1 128 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 128 1 2 1 1 27 TRP HE3 1 27 TRP HE3 1 1 129 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 129 1 2 1 1 27 TRP HH2 1 27 TRP HH2 1 1 130 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 130 1 2 1 1 27 TRP HZ3 1 27 TRP HZ3 1 1 131 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 131 1 2 1 1 28 GLU HG2 1 28 GLU HG2 1 1 132 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 132 1 2 1 1 28 GLU QG 1 28 GLU HG* 1 1 133 1 1 1 1 9 THR MG 1 9 THR HG2* 1 1 133 1 2 1 1 28 GLU HG3 1 28 GLU HG1 1 1 134 1 1 1 1 10 TRP H 1 10 TRP HN 1 1 134 1 2 1 1 10 TRP HB2 1 10 TRP HB1 1 1 135 1 1 1 1 10 TRP H 1 10 TRP HN 1 1 135 1 2 1 1 10 TRP HB3 1 10 TRP HB2 1 1 136 1 1 1 1 10 TRP H 1 10 TRP HN 1 1 136 1 2 1 1 10 TRP HE3 1 10 TRP HE3 1 1 137 1 1 1 1 10 TRP HA 1 10 TRP HA 1 1 137 1 2 1 1 10 TRP HB2 1 10 TRP HB1 1 1 138 1 1 1 1 10 TRP HA 1 10 TRP HA 1 1 138 1 2 1 1 10 TRP HE3 1 10 TRP HE3 1 1 139 1 1 1 1 10 TRP HA 1 10 TRP HA 1 1 139 1 2 1 1 23 GLN HE21 1 23 GLN HE22 1 1 140 1 1 1 1 10 TRP HB2 1 10 TRP HB1 1 1 140 1 2 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 141 1 1 1 1 10 TRP HB2 1 10 TRP HB1 1 1 141 1 2 1 1 44 CYS H 1 44 CYS HN 1 1 142 1 1 1 1 10 TRP HB2 1 10 TRP HB1 1 1 142 1 2 1 1 44 CYS HB3 1 44 CYS HB2 1 1 143 1 1 1 1 10 TRP HB3 1 10 TRP HB2 1 1 143 1 2 1 1 44 CYS HB3 1 44 CYS HB2 1 1 144 1 1 1 1 10 TRP HD1 1 10 TRP HD1 1 1 144 1 2 1 1 11 SER HA 1 11 SER HA 1 1 145 1 1 1 1 10 TRP HD1 1 10 TRP HD1 1 1 145 1 2 1 1 43 LYS HA 1 43 LYS HA 1 1 146 1 1 1 1 10 TRP HD1 1 10 TRP HD1 1 1 146 1 2 1 1 44 CYS H 1 44 CYS HN 1 1 147 1 1 1 1 10 TRP HD1 1 10 TRP HD1 1 1 147 1 2 1 1 44 CYS HB2 1 44 CYS HB1 1 1 148 1 1 1 1 10 TRP HD1 1 10 TRP HD1 1 1 148 1 2 1 1 44 CYS HB3 1 44 CYS HB2 1 1 149 1 1 1 1 10 TRP HE1 1 10 TRP HE1 1 1 149 1 2 1 1 14 CYS QB 1 14 CYS HB* 1 1 150 1 1 1 1 10 TRP HE3 1 10 TRP HE3 1 1 150 1 2 1 1 23 GLN HB2 1 23 GLN HB2 1 1 151 1 1 1 1 10 TRP HE3 1 10 TRP HE3 1 1 151 1 2 1 1 23 GLN QB 1 23 GLN HB* 1 1 152 1 1 1 1 10 TRP HE3 1 10 TRP HE3 1 1 152 1 2 1 1 23 GLN HB3 1 23 GLN HB1 1 1 153 1 1 1 1 10 TRP HE3 1 10 TRP HE3 1 1 153 1 2 1 1 23 GLN HE22 1 23 GLN HE21 1 1 154 1 1 1 1 10 TRP HH2 1 10 TRP HH2 1 1 154 1 2 1 1 19 HIS QB 1 19 HIS HB* 1 1 155 1 1 1 1 10 TRP HH2 1 10 TRP HH2 1 1 155 1 2 1 1 20 CYS HA 1 20 CYS HA 1 1 156 1 1 1 1 10 TRP HH2 1 10 TRP HH2 1 1 156 1 2 1 1 23 GLN QG 1 23 GLN HG* 1 1 157 1 1 1 1 10 TRP HZ2 1 10 TRP HZ2 1 1 157 1 2 1 1 14 CYS HA 1 14 CYS HA 1 1 158 1 1 1 1 10 TRP HZ2 1 10 TRP HZ2 1 1 158 1 2 1 1 14 CYS QB 1 14 CYS HB* 1 1 159 1 1 1 1 10 TRP HZ2 1 10 TRP HZ2 1 1 159 1 2 1 1 15 GLY H 1 15 GLY HN 1 1 160 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 160 1 2 1 1 19 HIS HA 1 19 HIS HA 1 1 161 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 161 1 2 1 1 19 HIS HB2 1 19 HIS HB2 1 1 162 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 162 1 2 1 1 19 HIS QB 1 19 HIS HB* 1 1 163 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 163 1 2 1 1 19 HIS HB3 1 19 HIS HB1 1 1 164 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 164 1 2 1 1 19 HIS HD2 1 19 HIS HD2 1 1 165 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 165 1 2 1 1 20 CYS H 1 20 CYS HN 1 1 166 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 166 1 2 1 1 20 CYS HA 1 20 CYS HA 1 1 167 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 167 1 2 1 1 20 CYS HB2 1 20 CYS HB2 1 1 168 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 168 1 2 1 1 20 CYS HB3 1 20 CYS HB1 1 1 169 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 169 1 2 1 1 23 GLN HA 1 23 GLN HA 1 1 170 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 170 1 2 1 1 23 GLN HB2 1 23 GLN HB2 1 1 171 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 171 1 2 1 1 23 GLN QB 1 23 GLN HB* 1 1 172 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 172 1 2 1 1 23 GLN HB3 1 23 GLN HB1 1 1 173 1 1 1 1 10 TRP HZ3 1 10 TRP HZ3 1 1 173 1 2 1 1 23 GLN QG 1 23 GLN HG* 1 1 174 1 1 1 1 11 SER H 1 11 SER HN 1 1 174 1 2 1 1 11 SER QB 1 11 SER HB* 1 1 175 1 1 1 1 11 SER H 1 11 SER HN 1 1 175 1 2 1 1 12 GLY H 1 12 GLY HN 1 1 176 1 1 1 1 11 SER HA 1 11 SER HA 1 1 176 1 2 1 1 12 GLY H 1 12 GLY HN 1 1 177 1 1 1 1 12 GLY H 1 12 GLY HN 1 1 177 1 2 1 1 13 ASN H 1 13 ASN HN 1 1 178 1 1 1 1 12 GLY QA 1 12 GLY HA* 1 1 178 1 2 1 1 13 ASN H 1 13 ASN HN 1 1 179 1 1 1 1 12 GLY HA2 1 12 GLY HA2 1 1 179 1 2 1 1 13 ASN H 1 13 ASN HN 1 1 180 1 1 1 1 12 GLY HA3 1 12 GLY HA1 1 1 180 1 2 1 1 13 ASN H 1 13 ASN HN 1 1 181 1 1 1 1 13 ASN H 1 13 ASN HN 1 1 181 1 2 1 1 13 ASN HB2 1 13 ASN HB2 1 1 182 1 1 1 1 13 ASN H 1 13 ASN HN 1 1 182 1 2 1 1 13 ASN HB3 1 13 ASN HB1 1 1 183 1 1 1 1 13 ASN HA 1 13 ASN HA 1 1 183 1 2 1 1 13 ASN HB3 1 13 ASN HB1 1 1 184 1 1 1 1 13 ASN HA 1 13 ASN HA 1 1 184 1 2 1 1 14 CYS H 1 14 CYS HN 1 1 185 1 1 1 1 13 ASN HB2 1 13 ASN HB2 1 1 185 1 2 1 1 14 CYS H 1 14 CYS HN 1 1 186 1 1 1 1 13 ASN HB3 1 13 ASN HB1 1 1 186 1 2 1 1 14 CYS H 1 14 CYS HN 1 1 187 1 1 1 1 14 CYS H 1 14 CYS HN 1 1 187 1 2 1 1 14 CYS HB2 1 14 CYS HB2 1 1 188 1 1 1 1 14 CYS H 1 14 CYS HN 1 1 188 1 2 1 1 14 CYS QB 1 14 CYS HB* 1 1 189 1 1 1 1 14 CYS H 1 14 CYS HN 1 1 189 1 2 1 1 14 CYS HB3 1 14 CYS HB1 1 1 190 1 1 1 1 14 CYS H 1 14 CYS HN 1 1 190 1 2 1 1 42 TRP HB2 1 42 TRP HB1 1 1 191 1 1 1 1 14 CYS H 1 14 CYS HN 1 1 191 1 2 1 1 42 TRP HB3 1 42 TRP HB2 1 1 192 1 1 1 1 15 GLY H 1 15 GLY HN 1 1 192 1 2 1 1 15 GLY HA2 1 15 GLY HA2 1 1 193 1 1 1 1 15 GLY H 1 15 GLY HN 1 1 193 1 2 1 1 16 ASN H 1 16 ASN HN 1 1 194 1 1 1 1 15 GLY HA2 1 15 GLY HA2 1 1 194 1 2 1 1 16 ASN H 1 16 ASN HN 1 1 195 1 1 1 1 15 GLY HA3 1 15 GLY HA1 1 1 195 1 2 1 1 16 ASN H 1 16 ASN HN 1 1 196 1 1 1 1 16 ASN H 1 16 ASN HN 1 1 196 1 2 1 1 16 ASN HB2 1 16 ASN HB2 1 1 197 1 1 1 1 16 ASN H 1 16 ASN HN 1 1 197 1 2 1 1 16 ASN QB 1 16 ASN HB* 1 1 198 1 1 1 1 16 ASN H 1 16 ASN HN 1 1 198 1 2 1 1 16 ASN HB3 1 16 ASN HB1 1 1 199 1 1 1 1 16 ASN QB 1 16 ASN HB* 1 1 199 1 2 1 1 16 ASN HD22 1 16 ASN HD22 1 1 200 1 1 1 1 16 ASN QB 1 16 ASN HB* 1 1 200 1 2 1 1 19 HIS H 1 19 HIS HN 1 1 201 1 1 1 1 16 ASN QB 1 16 ASN HB* 1 1 201 1 2 1 1 19 HIS QB 1 19 HIS HB* 1 1 202 1 1 1 1 16 ASN HB2 1 16 ASN HB2 1 1 202 1 2 1 1 16 ASN HD22 1 16 ASN HD22 1 1 203 1 1 1 1 16 ASN HB2 1 16 ASN HB2 1 1 203 1 2 1 1 19 HIS H 1 19 HIS HN 1 1 204 1 1 1 1 16 ASN HB2 1 16 ASN HB2 1 1 204 1 2 1 1 19 HIS HB2 1 19 HIS HB2 1 1 205 1 1 1 1 16 ASN HB2 1 16 ASN HB2 1 1 205 1 2 1 1 19 HIS HB3 1 19 HIS HB1 1 1 206 1 1 1 1 16 ASN HB3 1 16 ASN HB1 1 1 206 1 2 1 1 16 ASN HD22 1 16 ASN HD22 1 1 207 1 1 1 1 16 ASN HB3 1 16 ASN HB1 1 1 207 1 2 1 1 19 HIS H 1 19 HIS HN 1 1 208 1 1 1 1 16 ASN HB3 1 16 ASN HB1 1 1 208 1 2 1 1 19 HIS HB2 1 19 HIS HB2 1 1 209 1 1 1 1 16 ASN HB3 1 16 ASN HB1 1 1 209 1 2 1 1 19 HIS HB3 1 19 HIS HB1 1 1 210 1 1 1 1 16 ASN HD22 1 16 ASN HD22 1 1 210 1 2 1 1 18 ALA MB 1 18 ALA HB* 1 1 211 1 1 1 1 17 THR H 1 17 THR HN 1 1 211 1 2 1 1 17 THR HB 1 17 THR HB 1 1 212 1 1 1 1 17 THR H 1 17 THR HN 1 1 212 1 2 1 1 18 ALA H 1 18 ALA HN 1 1 213 1 1 1 1 17 THR H 1 17 THR HN 1 1 213 1 2 1 1 18 ALA MB 1 18 ALA HB* 1 1 214 1 1 1 1 17 THR HA 1 17 THR HA 1 1 214 1 2 1 1 18 ALA MB 1 18 ALA HB* 1 1 215 1 1 1 1 17 THR HA 1 17 THR HA 1 1 215 1 2 1 1 19 HIS H 1 19 HIS HN 1 1 216 1 1 1 1 17 THR HA 1 17 THR HA 1 1 216 1 2 1 1 20 CYS HB2 1 20 CYS HB2 1 1 217 1 1 1 1 17 THR HA 1 17 THR HA 1 1 217 1 2 1 1 20 CYS HB3 1 20 CYS HB1 1 1 218 1 1 1 1 17 THR HA 1 17 THR HA 1 1 218 1 2 1 1 34 ALA MB 1 34 ALA HB* 1 1 219 1 1 1 1 17 THR HA 1 17 THR HA 1 1 219 1 2 1 1 35 CYS H 1 35 CYS HN 1 1 220 1 1 1 1 17 THR HA 1 17 THR HA 1 1 220 1 2 1 1 35 CYS QB 1 35 CYS HB* 1 1 221 1 1 1 1 17 THR HB 1 17 THR HB 1 1 221 1 2 1 1 18 ALA H 1 18 ALA HN 1 1 222 1 1 1 1 17 THR HB 1 17 THR HB 1 1 222 1 2 1 1 20 CYS HB3 1 20 CYS HB1 1 1 223 1 1 1 1 17 THR HB 1 17 THR HB 1 1 223 1 2 1 1 34 ALA HA 1 34 ALA HA 1 1 224 1 1 1 1 17 THR HB 1 17 THR HB 1 1 224 1 2 1 1 35 CYS H 1 35 CYS HN 1 1 225 1 1 1 1 17 THR MG 1 17 THR HG2* 1 1 225 1 2 1 1 18 ALA H 1 18 ALA HN 1 1 226 1 1 1 1 17 THR MG 1 17 THR HG2* 1 1 226 1 2 1 1 18 ALA HA 1 18 ALA HA 1 1 227 1 1 1 1 17 THR MG 1 17 THR HG2* 1 1 227 1 2 1 1 19 HIS H 1 19 HIS HN 1 1 228 1 1 1 1 17 THR MG 1 17 THR HG2* 1 1 228 1 2 1 1 21 ASP H 1 21 ASP HN 1 1 229 1 1 1 1 17 THR MG 1 17 THR HG2* 1 1 229 1 2 1 1 34 ALA HA 1 34 ALA HA 1 1 230 1 1 1 1 17 THR MG 1 17 THR HG2* 1 1 230 1 2 1 1 35 CYS H 1 35 CYS HN 1 1 231 1 1 1 1 17 THR O 1 17 THR O 1 1 231 1 2 1 1 21 ASP H 1 21 ASP HN 1 1 232 1 1 1 1 17 THR O 1 17 THR O 1 1 232 1 2 1 1 21 ASP N 1 21 ASP N 1 1 233 1 1 1 1 18 ALA H 1 18 ALA HN 1 1 233 1 2 1 1 19 HIS H 1 19 HIS HN 1 1 234 1 1 1 1 18 ALA H 1 18 ALA HN 1 1 234 1 2 1 1 20 CYS H 1 20 CYS HN 1 1 235 1 1 1 1 18 ALA HA 1 18 ALA HA 1 1 235 1 2 1 1 21 ASP H 1 21 ASP HN 1 1 236 1 1 1 1 18 ALA HA 1 18 ALA HA 1 1 236 1 2 1 1 21 ASP QB 1 21 ASP HB* 1 1 237 1 1 1 1 18 ALA HA 1 18 ALA HA 1 1 237 1 2 1 1 22 LYS H 1 22 LYS HN 1 1 238 1 1 1 1 18 ALA MB 1 18 ALA HB* 1 1 238 1 2 1 1 19 HIS HA 1 19 HIS HA 1 1 239 1 1 1 1 19 HIS H 1 19 HIS HN 1 1 239 1 2 1 1 19 HIS HB2 1 19 HIS HB2 1 1 240 1 1 1 1 19 HIS H 1 19 HIS HN 1 1 240 1 2 1 1 19 HIS QB 1 19 HIS HB* 1 1 241 1 1 1 1 19 HIS H 1 19 HIS HN 1 1 241 1 2 1 1 19 HIS HB3 1 19 HIS HB1 1 1 242 1 1 1 1 19 HIS H 1 19 HIS HN 1 1 242 1 2 1 1 20 CYS H 1 20 CYS HN 1 1 243 1 1 1 1 19 HIS H 1 19 HIS HN 1 1 243 1 2 1 1 20 CYS HB2 1 20 CYS HB2 1 1 244 1 1 1 1 19 HIS H 1 19 HIS HN 1 1 244 1 2 1 1 22 LYS H 1 22 LYS HN 1 1 245 1 1 1 1 19 HIS HA 1 19 HIS HA 1 1 245 1 2 1 1 19 HIS HD2 1 19 HIS HD2 1 1 246 1 1 1 1 19 HIS HA 1 19 HIS HA 1 1 246 1 2 1 1 22 LYS H 1 22 LYS HN 1 1 247 1 1 1 1 19 HIS HA 1 19 HIS HA 1 1 247 1 2 1 1 22 LYS QB 1 22 LYS HB* 1 1 248 1 1 1 1 19 HIS HA 1 19 HIS HA 1 1 248 1 2 1 1 22 LYS QD 1 22 LYS HD* 1 1 249 1 1 1 1 19 HIS HA 1 19 HIS HA 1 1 249 1 2 1 1 23 GLN H 1 23 GLN HN 1 1 250 1 1 1 1 19 HIS QB 1 19 HIS HB* 1 1 250 1 2 1 1 20 CYS H 1 20 CYS HN 1 1 251 1 1 1 1 19 HIS HD2 1 19 HIS HD2 1 1 251 1 2 1 1 22 LYS QB 1 22 LYS HB* 1 1 252 1 1 1 1 19 HIS HD2 1 19 HIS HD2 1 1 252 1 2 1 1 22 LYS HG2 1 22 LYS HG1 1 1 253 1 1 1 1 19 HIS HD2 1 19 HIS HD2 1 1 253 1 2 1 1 22 LYS HG3 1 22 LYS HG2 1 1 254 1 1 1 1 19 HIS HD2 1 19 HIS HD2 1 1 254 1 2 1 1 23 GLN HB2 1 23 GLN HB2 1 1 255 1 1 1 1 19 HIS HD2 1 19 HIS HD2 1 1 255 1 2 1 1 23 GLN QB 1 23 GLN HB* 1 1 256 1 1 1 1 19 HIS HD2 1 19 HIS HD2 1 1 256 1 2 1 1 23 GLN HB3 1 23 GLN HB1 1 1 257 1 1 1 1 19 HIS HD2 1 19 HIS HD2 1 1 257 1 2 1 1 23 GLN QG 1 23 GLN HG* 1 1 258 1 1 1 1 19 HIS O 1 19 HIS O 1 1 258 1 2 1 1 23 GLN H 1 23 GLN HN 1 1 259 1 1 1 1 19 HIS O 1 19 HIS O 1 1 259 1 2 1 1 23 GLN N 1 23 GLN N 1 1 260 1 1 1 1 20 CYS H 1 20 CYS HN 1 1 260 1 2 1 1 20 CYS HB2 1 20 CYS HB2 1 1 261 1 1 1 1 20 CYS H 1 20 CYS HN 1 1 261 1 2 1 1 20 CYS HB3 1 20 CYS HB1 1 1 262 1 1 1 1 20 CYS H 1 20 CYS HN 1 1 262 1 2 1 1 21 ASP H 1 21 ASP HN 1 1 263 1 1 1 1 20 CYS HA 1 20 CYS HA 1 1 263 1 2 1 1 23 GLN QB 1 23 GLN HB* 1 1 264 1 1 1 1 20 CYS HB2 1 20 CYS HB2 1 1 264 1 2 1 1 21 ASP H 1 21 ASP HN 1 1 265 1 1 1 1 20 CYS HB2 1 20 CYS HB2 1 1 265 1 2 1 1 35 CYS H 1 35 CYS HN 1 1 266 1 1 1 1 20 CYS HB3 1 20 CYS HB1 1 1 266 1 2 1 1 21 ASP H 1 21 ASP HN 1 1 267 1 1 1 1 21 ASP H 1 21 ASP HN 1 1 267 1 2 1 1 22 LYS H 1 22 LYS HN 1 1 268 1 1 1 1 21 ASP H 1 21 ASP HN 1 1 268 1 2 1 1 22 LYS HG3 1 22 LYS HG2 1 1 269 1 1 1 1 21 ASP HA 1 21 ASP HA 1 1 269 1 2 1 1 24 CYS H 1 24 CYS HN 1 1 270 1 1 1 1 21 ASP HA 1 21 ASP HA 1 1 270 1 2 1 1 24 CYS HB2 1 24 CYS HB1 1 1 271 1 1 1 1 21 ASP HA 1 21 ASP HA 1 1 271 1 2 1 1 24 CYS HB3 1 24 CYS HB2 1 1 272 1 1 1 1 21 ASP HA 1 21 ASP HA 1 1 272 1 2 1 1 33 GLY H 1 33 GLY HN 1 1 273 1 1 1 1 21 ASP HA 1 21 ASP HA 1 1 273 1 2 1 1 33 GLY HA2 1 33 GLY HA1 1 1 274 1 1 1 1 21 ASP HA 1 21 ASP HA 1 1 274 1 2 1 1 34 ALA H 1 34 ALA HN 1 1 275 1 1 1 1 21 ASP HA 1 21 ASP HA 1 1 275 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 276 1 1 1 1 21 ASP QB 1 21 ASP HB* 1 1 276 1 2 1 1 22 LYS H 1 22 LYS HN 1 1 277 1 1 1 1 21 ASP QB 1 21 ASP HB* 1 1 277 1 2 1 1 33 GLY H 1 33 GLY HN 1 1 278 1 1 1 1 22 LYS H 1 22 LYS HN 1 1 278 1 2 1 1 22 LYS QB 1 22 LYS HB* 1 1 279 1 1 1 1 22 LYS H 1 22 LYS HN 1 1 279 1 2 1 1 22 LYS HG2 1 22 LYS HG1 1 1 280 1 1 1 1 22 LYS H 1 22 LYS HN 1 1 280 1 2 1 1 22 LYS HG3 1 22 LYS HG2 1 1 281 1 1 1 1 22 LYS H 1 22 LYS HN 1 1 281 1 2 1 1 23 GLN H 1 23 GLN HN 1 1 282 1 1 1 1 22 LYS HA 1 22 LYS HA 1 1 282 1 2 1 1 22 LYS QD 1 22 LYS HD* 1 1 283 1 1 1 1 22 LYS HA 1 22 LYS HA 1 1 283 1 2 1 1 22 LYS HG2 1 22 LYS HG1 1 1 284 1 1 1 1 22 LYS HA 1 22 LYS HA 1 1 284 1 2 1 1 22 LYS HG3 1 22 LYS HG2 1 1 285 1 1 1 1 22 LYS HA 1 22 LYS HA 1 1 285 1 2 1 1 25 GLN H 1 25 GLN HN 1 1 286 1 1 1 1 22 LYS HA 1 22 LYS HA 1 1 286 1 2 1 1 25 GLN HB2 1 25 GLN HB1 1 1 287 1 1 1 1 22 LYS HA 1 22 LYS HA 1 1 287 1 2 1 1 25 GLN QG 1 25 GLN HG* 1 1 288 1 1 1 1 22 LYS HA 1 22 LYS HA 1 1 288 1 2 1 1 26 ASP H 1 26 ASP HN 1 1 289 1 1 1 1 22 LYS QB 1 22 LYS HB* 1 1 289 1 2 1 1 23 GLN H 1 23 GLN HN 1 1 290 1 1 1 1 22 LYS QB 1 22 LYS HB* 1 1 290 1 2 1 1 27 TRP HD1 1 27 TRP HD1 1 1 291 1 1 1 1 22 LYS HG2 1 22 LYS HG1 1 1 291 1 2 1 1 23 GLN H 1 23 GLN HN 1 1 292 1 1 1 1 22 LYS HG3 1 22 LYS HG2 1 1 292 1 2 1 1 23 GLN H 1 23 GLN HN 1 1 293 1 1 1 1 22 LYS O 1 22 LYS O 1 1 293 1 2 1 1 26 ASP H 1 26 ASP HN 1 1 294 1 1 1 1 22 LYS O 1 22 LYS O 1 1 294 1 2 1 1 26 ASP N 1 26 ASP N 1 1 295 1 1 1 1 23 GLN H 1 23 GLN HN 1 1 295 1 2 1 1 23 GLN HG2 1 23 GLN HG2 1 1 296 1 1 1 1 23 GLN H 1 23 GLN HN 1 1 296 1 2 1 1 23 GLN HG3 1 23 GLN HG1 1 1 297 1 1 1 1 23 GLN HA 1 23 GLN HA 1 1 297 1 2 1 1 23 GLN HE21 1 23 GLN HE22 1 1 298 1 1 1 1 23 GLN HA 1 23 GLN HA 1 1 298 1 2 1 1 26 ASP H 1 26 ASP HN 1 1 299 1 1 1 1 23 GLN HA 1 23 GLN HA 1 1 299 1 2 1 1 26 ASP HB2 1 26 ASP HB1 1 1 300 1 1 1 1 23 GLN HA 1 23 GLN HA 1 1 300 1 2 1 1 27 TRP H 1 27 TRP HN 1 1 301 1 1 1 1 23 GLN HA 1 23 GLN HA 1 1 301 1 2 1 1 27 TRP HD1 1 27 TRP HD1 1 1 302 1 1 1 1 23 GLN HA 1 23 GLN HA 1 1 302 1 2 1 1 27 TRP HE1 1 27 TRP HE1 1 1 303 1 1 1 1 23 GLN HE22 1 23 GLN HE21 1 1 303 1 2 1 1 27 TRP HZ3 1 27 TRP HZ3 1 1 304 1 1 1 1 24 CYS H 1 24 CYS HN 1 1 304 1 2 1 1 25 GLN H 1 25 GLN HN 1 1 305 1 1 1 1 24 CYS H 1 24 CYS HN 1 1 305 1 2 1 1 26 ASP H 1 26 ASP HN 1 1 306 1 1 1 1 24 CYS HA 1 24 CYS HA 1 1 306 1 2 1 1 24 CYS HB3 1 24 CYS HB2 1 1 307 1 1 1 1 24 CYS HA 1 24 CYS HA 1 1 307 1 2 1 1 27 TRP HB2 1 27 TRP HB2 1 1 308 1 1 1 1 24 CYS HA 1 24 CYS HA 1 1 308 1 2 1 1 28 GLU H 1 28 GLU HN 1 1 309 1 1 1 1 24 CYS HA 1 24 CYS HA 1 1 309 1 2 1 1 28 GLU HB2 1 28 GLU HB1 1 1 310 1 1 1 1 24 CYS HA 1 24 CYS HA 1 1 310 1 2 1 1 28 GLU HB3 1 28 GLU HB2 1 1 311 1 1 1 1 24 CYS HA 1 24 CYS HA 1 1 311 1 2 1 1 30 ALA MB 1 30 ALA HB* 1 1 312 1 1 1 1 24 CYS HB2 1 24 CYS HB1 1 1 312 1 2 1 1 25 GLN H 1 25 GLN HN 1 1 313 1 1 1 1 24 CYS HB2 1 24 CYS HB1 1 1 313 1 2 1 1 30 ALA MB 1 30 ALA HB* 1 1 314 1 1 1 1 24 CYS HB2 1 24 CYS HB1 1 1 314 1 2 1 1 33 GLY HA3 1 33 GLY HA2 1 1 315 1 1 1 1 24 CYS HB3 1 24 CYS HB2 1 1 315 1 2 1 1 25 GLN H 1 25 GLN HN 1 1 316 1 1 1 1 24 CYS HB3 1 24 CYS HB2 1 1 316 1 2 1 1 30 ALA MB 1 30 ALA HB* 1 1 317 1 1 1 1 24 CYS HB3 1 24 CYS HB2 1 1 317 1 2 1 1 33 GLY HA2 1 33 GLY HA1 1 1 318 1 1 1 1 24 CYS HB3 1 24 CYS HB2 1 1 318 1 2 1 1 33 GLY HA3 1 33 GLY HA2 1 1 319 1 1 1 1 24 CYS HB3 1 24 CYS HB2 1 1 319 1 2 1 1 46 CYS HA 1 46 CYS HA 1 1 320 1 1 1 1 24 CYS HB3 1 24 CYS HB2 1 1 320 1 2 1 1 47 TYR H 1 47 TYR HN 1 1 321 1 1 1 1 24 CYS HB3 1 24 CYS HB2 1 1 321 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 322 1 1 1 1 25 GLN H 1 25 GLN HN 1 1 322 1 2 1 1 25 GLN QG 1 25 GLN HG* 1 1 323 1 1 1 1 25 GLN H 1 25 GLN HN 1 1 323 1 2 1 1 26 ASP H 1 26 ASP HN 1 1 324 1 1 1 1 25 GLN H 1 25 GLN HN 1 1 324 1 2 1 1 30 ALA MB 1 30 ALA HB* 1 1 325 1 1 1 1 25 GLN HA 1 25 GLN HA 1 1 325 1 2 1 1 32 HIS HA 1 32 HIS HA 1 1 326 1 1 1 1 25 GLN HB2 1 25 GLN HB1 1 1 326 1 2 1 1 25 GLN HE21 1 25 GLN HE21 1 1 327 1 1 1 1 25 GLN HB2 1 25 GLN HB1 1 1 327 1 2 1 1 26 ASP H 1 26 ASP HN 1 1 328 1 1 1 1 25 GLN HB2 1 25 GLN HB1 1 1 328 1 2 1 1 32 HIS HA 1 32 HIS HA 1 1 329 1 1 1 1 25 GLN HB3 1 25 GLN HB2 1 1 329 1 2 1 1 25 GLN HE21 1 25 GLN HE21 1 1 330 1 1 1 1 25 GLN HB3 1 25 GLN HB2 1 1 330 1 2 1 1 26 ASP H 1 26 ASP HN 1 1 331 1 1 1 1 25 GLN HB3 1 25 GLN HB2 1 1 331 1 2 1 1 32 HIS HA 1 32 HIS HA 1 1 332 1 1 1 1 25 GLN QG 1 25 GLN HG* 1 1 332 1 2 1 1 32 HIS HA 1 32 HIS HA 1 1 333 1 1 1 1 26 ASP H 1 26 ASP HN 1 1 333 1 2 1 1 26 ASP HB2 1 26 ASP HB1 1 1 334 1 1 1 1 26 ASP H 1 26 ASP HN 1 1 334 1 2 1 1 27 TRP H 1 27 TRP HN 1 1 335 1 1 1 1 26 ASP HA 1 26 ASP HA 1 1 335 1 2 1 1 26 ASP HB2 1 26 ASP HB1 1 1 336 1 1 1 1 26 ASP HA 1 26 ASP HA 1 1 336 1 2 1 1 27 TRP HD1 1 27 TRP HD1 1 1 337 1 1 1 1 26 ASP HB2 1 26 ASP HB1 1 1 337 1 2 1 1 27 TRP H 1 27 TRP HN 1 1 338 1 1 1 1 26 ASP HB2 1 26 ASP HB1 1 1 338 1 2 1 1 27 TRP HD1 1 27 TRP HD1 1 1 339 1 1 1 1 26 ASP HB2 1 26 ASP HB1 1 1 339 1 2 1 1 27 TRP HE1 1 27 TRP HE1 1 1 340 1 1 1 1 26 ASP HB3 1 26 ASP HB2 1 1 340 1 2 1 1 27 TRP H 1 27 TRP HN 1 1 341 1 1 1 1 26 ASP HB3 1 26 ASP HB2 1 1 341 1 2 1 1 27 TRP HE1 1 27 TRP HE1 1 1 342 1 1 1 1 27 TRP H 1 27 TRP HN 1 1 342 1 2 1 1 27 TRP HB2 1 27 TRP HB2 1 1 343 1 1 1 1 27 TRP H 1 27 TRP HN 1 1 343 1 2 1 1 28 GLU H 1 28 GLU HN 1 1 344 1 1 1 1 27 TRP HA 1 27 TRP HA 1 1 344 1 2 1 1 27 TRP HB2 1 27 TRP HB2 1 1 345 1 1 1 1 27 TRP HA 1 27 TRP HA 1 1 345 1 2 1 1 27 TRP HD1 1 27 TRP HD1 1 1 346 1 1 1 1 27 TRP HA 1 27 TRP HA 1 1 346 1 2 1 1 27 TRP HE3 1 27 TRP HE3 1 1 347 1 1 1 1 27 TRP HB2 1 27 TRP HB2 1 1 347 1 2 1 1 27 TRP HE3 1 27 TRP HE3 1 1 348 1 1 1 1 27 TRP HB2 1 27 TRP HB2 1 1 348 1 2 1 1 28 GLU QG 1 28 GLU HG* 1 1 349 1 1 1 1 27 TRP HB3 1 27 TRP HB1 1 1 349 1 2 1 1 27 TRP HE3 1 27 TRP HE3 1 1 350 1 1 1 1 27 TRP HB3 1 27 TRP HB1 1 1 350 1 2 1 1 28 GLU QG 1 28 GLU HG* 1 1 351 1 1 1 1 28 GLU H 1 28 GLU HN 1 1 351 1 2 1 1 29 LYS H 1 29 LYS HN 1 1 352 1 1 1 1 28 GLU QG 1 28 GLU HG* 1 1 352 1 2 1 1 29 LYS H 1 29 LYS HN 1 1 353 1 1 1 1 28 GLU QG 1 28 GLU HG* 1 1 353 1 2 1 1 48 PHE CG 1 48 PHE CG 1 1 354 1 1 1 1 29 LYS H 1 29 LYS HN 1 1 354 1 2 1 1 29 LYS HA 1 29 LYS HA 1 1 355 1 1 1 1 29 LYS H 1 29 LYS HN 1 1 355 1 2 1 1 29 LYS HB2 1 29 LYS HB1 1 1 356 1 1 1 1 29 LYS H 1 29 LYS HN 1 1 356 1 2 1 1 29 LYS HB3 1 29 LYS HB2 1 1 357 1 1 1 1 29 LYS H 1 29 LYS HN 1 1 357 1 2 1 1 29 LYS QD 1 29 LYS HD* 1 1 358 1 1 1 1 29 LYS H 1 29 LYS HN 1 1 358 1 2 1 1 29 LYS HG2 1 29 LYS HG2 1 1 359 1 1 1 1 29 LYS H 1 29 LYS HN 1 1 359 1 2 1 1 29 LYS HG3 1 29 LYS HG1 1 1 360 1 1 1 1 29 LYS H 1 29 LYS HN 1 1 360 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 361 1 1 1 1 29 LYS H 1 29 LYS HN 1 1 361 1 2 1 1 30 ALA MB 1 30 ALA HB* 1 1 362 1 1 1 1 29 LYS HA 1 29 LYS HA 1 1 362 1 2 1 1 29 LYS HB3 1 29 LYS HB2 1 1 363 1 1 1 1 29 LYS HA 1 29 LYS HA 1 1 363 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 364 1 1 1 1 29 LYS HA 1 29 LYS HA 1 1 364 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 365 1 1 1 1 29 LYS HB2 1 29 LYS HB1 1 1 365 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 366 1 1 1 1 29 LYS HB2 1 29 LYS HB1 1 1 366 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 367 1 1 1 1 29 LYS HB3 1 29 LYS HB2 1 1 367 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 368 1 1 1 1 29 LYS HB3 1 29 LYS HB2 1 1 368 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 369 1 1 1 1 30 ALA HA 1 30 ALA HA 1 1 369 1 2 1 1 31 SER H 1 31 SER HN 1 1 370 1 1 1 1 30 ALA HA 1 30 ALA HA 1 1 370 1 2 1 1 48 PHE CG 1 48 PHE CG 1 1 371 1 1 1 1 30 ALA HA 1 30 ALA HA 1 1 371 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 372 1 1 1 1 30 ALA HA 1 30 ALA HA 1 1 372 1 2 1 1 48 PHE HA 1 48 PHE HA 1 1 373 1 1 1 1 30 ALA HA 1 30 ALA HA 1 1 373 1 2 1 1 48 PHE QB 1 48 PHE HB2 1 1 374 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 374 1 2 1 1 32 HIS HA 1 32 HIS HA 1 1 375 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 375 1 2 1 1 46 CYS HA 1 46 CYS HA 1 1 376 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 376 1 2 1 1 46 CYS HB2 1 46 CYS HB1 1 1 377 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 377 1 2 1 1 46 CYS HB3 1 46 CYS HB2 1 1 378 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 378 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 379 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 379 1 2 1 1 47 TYR H 1 47 TYR HN 1 1 380 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 380 1 2 1 1 47 TYR HA 1 47 TYR HA 1 1 381 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 381 1 2 1 1 48 PHE CG 1 48 PHE CG 1 1 382 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 382 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 383 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 383 1 2 1 1 48 PHE HA 1 48 PHE HA 1 1 384 1 1 1 1 31 SER H 1 31 SER HN 1 1 384 1 2 1 1 31 SER HB2 1 31 SER HB2 1 1 385 1 1 1 1 31 SER H 1 31 SER HN 1 1 385 1 2 1 1 31 SER QB 1 31 SER HB* 1 1 386 1 1 1 1 31 SER H 1 31 SER HN 1 1 386 1 2 1 1 31 SER HB3 1 31 SER HB1 1 1 387 1 1 1 1 31 SER H 1 31 SER HN 1 1 387 1 2 1 1 32 HIS H 1 32 HIS HN 1 1 388 1 1 1 1 31 SER HA 1 31 SER HA 1 1 388 1 2 1 1 31 SER HB2 1 31 SER HB2 1 1 389 1 1 1 1 31 SER HA 1 31 SER HA 1 1 389 1 2 1 1 31 SER QB 1 31 SER HB* 1 1 390 1 1 1 1 31 SER HA 1 31 SER HA 1 1 390 1 2 1 1 31 SER HB3 1 31 SER HB1 1 1 391 1 1 1 1 31 SER HA 1 31 SER HA 1 1 391 1 2 1 1 32 HIS HD2 1 32 HIS HD2 1 1 392 1 1 1 1 31 SER QB 1 31 SER HB* 1 1 392 1 2 1 1 32 HIS H 1 32 HIS HN 1 1 393 1 1 1 1 31 SER QB 1 31 SER HB* 1 1 393 1 2 1 1 50 CYS H 1 50 CYS HN 1 1 394 1 1 1 1 31 SER QB 1 31 SER HB* 1 1 394 1 2 1 1 50 CYS HB2 1 50 CYS HB1 1 1 395 1 1 1 1 31 SER QB 1 31 SER HB* 1 1 395 1 2 1 1 50 CYS HB3 1 50 CYS HB2 1 1 396 1 1 1 1 31 SER HB2 1 31 SER HB2 1 1 396 1 2 1 1 32 HIS H 1 32 HIS HN 1 1 397 1 1 1 1 31 SER HB2 1 31 SER HB2 1 1 397 1 2 1 1 32 HIS HD2 1 32 HIS HD2 1 1 398 1 1 1 1 31 SER HB3 1 31 SER HB1 1 1 398 1 2 1 1 32 HIS H 1 32 HIS HN 1 1 399 1 1 1 1 31 SER HB3 1 31 SER HB1 1 1 399 1 2 1 1 32 HIS HD2 1 32 HIS HD2 1 1 400 1 1 1 1 32 HIS H 1 32 HIS HN 1 1 400 1 2 1 1 47 TYR H 1 47 TYR HN 1 1 401 1 1 1 1 32 HIS HA 1 32 HIS HA 1 1 401 1 2 1 1 32 HIS HB2 1 32 HIS HB2 1 1 402 1 1 1 1 32 HIS HA 1 32 HIS HA 1 1 402 1 2 1 1 32 HIS HB3 1 32 HIS HB1 1 1 403 1 1 1 1 32 HIS HA 1 32 HIS HA 1 1 403 1 2 1 1 32 HIS HD2 1 32 HIS HD2 1 1 404 1 1 1 1 32 HIS HA 1 32 HIS HA 1 1 404 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 405 1 1 1 1 32 HIS QB 1 32 HIS HB* 1 1 405 1 2 1 1 33 GLY H 1 33 GLY HN 1 1 406 1 1 1 1 32 HIS QB 1 32 HIS HB* 1 1 406 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 407 1 1 1 1 32 HIS HB2 1 32 HIS HB2 1 1 407 1 2 1 1 32 HIS HD2 1 32 HIS HD2 1 1 408 1 1 1 1 32 HIS HB3 1 32 HIS HB1 1 1 408 1 2 1 1 32 HIS HD2 1 32 HIS HD2 1 1 409 1 1 1 1 32 HIS HD2 1 32 HIS HD2 1 1 409 1 2 1 1 33 GLY H 1 33 GLY HN 1 1 410 1 1 1 1 32 HIS HD2 1 32 HIS HD2 1 1 410 1 2 1 1 33 GLY HA2 1 33 GLY HA1 1 1 411 1 1 1 1 32 HIS HD2 1 32 HIS HD2 1 1 411 1 2 1 1 34 ALA MB 1 34 ALA HB* 1 1 412 1 1 1 1 32 HIS HD2 1 32 HIS HD2 1 1 412 1 2 1 1 46 CYS HA 1 46 CYS HA 1 1 413 1 1 1 1 32 HIS HD2 1 32 HIS HD2 1 1 413 1 2 1 1 47 TYR HB2 1 47 TYR HB2 1 1 414 1 1 1 1 32 HIS HD2 1 32 HIS HD2 1 1 414 1 2 1 1 47 TYR QB 1 47 TYR HB* 1 1 415 1 1 1 1 32 HIS HD2 1 32 HIS HD2 1 1 415 1 2 1 1 47 TYR HB3 1 47 TYR HB1 1 1 416 1 1 1 1 32 HIS HD2 1 32 HIS HD2 1 1 416 1 2 1 1 50 CYS HB2 1 50 CYS HB1 1 1 417 1 1 1 1 32 HIS HE1 1 32 HIS HE1 1 1 417 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 418 1 1 1 1 32 HIS HE1 1 32 HIS HE1 1 1 418 1 2 1 1 47 TYR HB2 1 47 TYR HB2 1 1 419 1 1 1 1 32 HIS HE1 1 32 HIS HE1 1 1 419 1 2 1 1 47 TYR QB 1 47 TYR HB* 1 1 420 1 1 1 1 32 HIS HE1 1 32 HIS HE1 1 1 420 1 2 1 1 47 TYR HB3 1 47 TYR HB1 1 1 421 1 1 1 1 33 GLY H 1 33 GLY HN 1 1 421 1 2 1 1 34 ALA H 1 34 ALA HN 1 1 422 1 1 1 1 33 GLY H 1 33 GLY HN 1 1 422 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 423 1 1 1 1 33 GLY HA2 1 33 GLY HA1 1 1 423 1 2 1 1 34 ALA H 1 34 ALA HN 1 1 424 1 1 1 1 33 GLY HA2 1 33 GLY HA1 1 1 424 1 2 1 1 34 ALA MB 1 34 ALA HB* 1 1 425 1 1 1 1 33 GLY HA2 1 33 GLY HA1 1 1 425 1 2 1 1 46 CYS HA 1 46 CYS HA 1 1 426 1 1 1 1 33 GLY HA2 1 33 GLY HA1 1 1 426 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 427 1 1 1 1 33 GLY HA2 1 33 GLY HA1 1 1 427 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 428 1 1 1 1 33 GLY HA2 1 33 GLY HA1 1 1 428 1 2 1 1 47 TYR H 1 47 TYR HN 1 1 429 1 1 1 1 33 GLY HA3 1 33 GLY HA2 1 1 429 1 2 1 1 34 ALA H 1 34 ALA HN 1 1 430 1 1 1 1 33 GLY HA3 1 33 GLY HA2 1 1 430 1 2 1 1 46 CYS HA 1 46 CYS HA 1 1 431 1 1 1 1 33 GLY HA3 1 33 GLY HA2 1 1 431 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 432 1 1 1 1 33 GLY HA3 1 33 GLY HA2 1 1 432 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 433 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 433 1 2 1 1 35 CYS H 1 35 CYS HN 1 1 434 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 434 1 2 1 1 45 PHE H 1 45 PHE HN 1 1 435 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 435 1 2 1 1 45 PHE HB2 1 45 PHE HB1 1 1 436 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 436 1 2 1 1 46 CYS HA 1 46 CYS HA 1 1 437 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 437 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 438 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 438 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 439 1 1 1 1 34 ALA HA 1 34 ALA HA 1 1 439 1 2 1 1 35 CYS H 1 35 CYS HN 1 1 440 1 1 1 1 34 ALA HA 1 34 ALA HA 1 1 440 1 2 1 1 35 CYS QB 1 35 CYS HB* 1 1 441 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 441 1 2 1 1 35 CYS H 1 35 CYS HN 1 1 442 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 442 1 2 1 1 35 CYS HA 1 35 CYS HA 1 1 443 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 443 1 2 1 1 36 HIS HD2 1 36 HIS HD2 1 1 444 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 444 1 2 1 1 36 HIS HE1 1 36 HIS HE1 1 1 445 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 445 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 446 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 446 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 447 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 447 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 448 1 1 1 1 34 ALA O 1 34 ALA O 1 1 448 1 2 1 1 45 PHE H 1 45 PHE HN 1 1 449 1 1 1 1 34 ALA O 1 34 ALA O 1 1 449 1 2 1 1 45 PHE N 1 45 PHE N 1 1 450 1 1 1 1 35 CYS H 1 35 CYS HN 1 1 450 1 2 1 1 35 CYS HB2 1 35 CYS HB2 1 1 451 1 1 1 1 35 CYS H 1 35 CYS HN 1 1 451 1 2 1 1 35 CYS QB 1 35 CYS HB* 1 1 452 1 1 1 1 35 CYS H 1 35 CYS HN 1 1 452 1 2 1 1 35 CYS HB3 1 35 CYS HB1 1 1 453 1 1 1 1 35 CYS H 1 35 CYS HN 1 1 453 1 2 1 1 36 HIS H 1 36 HIS HN 1 1 454 1 1 1 1 35 CYS HA 1 35 CYS HA 1 1 454 1 2 1 1 36 HIS H 1 36 HIS HN 1 1 455 1 1 1 1 35 CYS HA 1 35 CYS HA 1 1 455 1 2 1 1 44 CYS HA 1 44 CYS HA 1 1 456 1 1 1 1 35 CYS HA 1 35 CYS HA 1 1 456 1 2 1 1 44 CYS HB2 1 44 CYS HB1 1 1 457 1 1 1 1 35 CYS HA 1 35 CYS HA 1 1 457 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 458 1 1 1 1 35 CYS HA 1 35 CYS HA 1 1 458 1 2 1 1 45 PHE H 1 45 PHE HN 1 1 459 1 1 1 1 35 CYS QB 1 35 CYS HB* 1 1 459 1 2 1 1 36 HIS H 1 36 HIS HN 1 1 460 1 1 1 1 35 CYS QB 1 35 CYS HB* 1 1 460 1 2 1 1 42 TRP HE3 1 42 TRP HE3 1 1 461 1 1 1 1 35 CYS QB 1 35 CYS HB* 1 1 461 1 2 1 1 42 TRP HZ3 1 42 TRP HZ3 1 1 462 1 1 1 1 35 CYS HB2 1 35 CYS HB2 1 1 462 1 2 1 1 42 TRP HZ3 1 42 TRP HZ3 1 1 463 1 1 1 1 35 CYS HB3 1 35 CYS HB1 1 1 463 1 2 1 1 42 TRP HZ3 1 42 TRP HZ3 1 1 464 1 1 1 1 36 HIS H 1 36 HIS HN 1 1 464 1 2 1 1 36 HIS HB2 1 36 HIS HB2 1 1 465 1 1 1 1 36 HIS H 1 36 HIS HN 1 1 465 1 2 1 1 36 HIS HD2 1 36 HIS HD2 1 1 466 1 1 1 1 36 HIS H 1 36 HIS HN 1 1 466 1 2 1 1 37 LYS H 1 37 LYS HN 1 1 467 1 1 1 1 36 HIS H 1 36 HIS HN 1 1 467 1 2 1 1 42 TRP HE3 1 42 TRP HE3 1 1 468 1 1 1 1 36 HIS H 1 36 HIS HN 1 1 468 1 2 1 1 42 TRP HZ3 1 42 TRP HZ3 1 1 469 1 1 1 1 36 HIS H 1 36 HIS HN 1 1 469 1 2 1 1 43 LYS H 1 43 LYS HN 1 1 470 1 1 1 1 36 HIS H 1 36 HIS HN 1 1 470 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 471 1 1 1 1 36 HIS HA 1 36 HIS HA 1 1 471 1 2 1 1 36 HIS HB3 1 36 HIS HB1 1 1 472 1 1 1 1 36 HIS HA 1 36 HIS HA 1 1 472 1 2 1 1 36 HIS HD2 1 36 HIS HD2 1 1 473 1 1 1 1 36 HIS HA 1 36 HIS HA 1 1 473 1 2 1 1 37 LYS H 1 37 LYS HN 1 1 474 1 1 1 1 36 HIS HA 1 36 HIS HA 1 1 474 1 2 1 1 42 TRP HE3 1 42 TRP HE3 1 1 475 1 1 1 1 36 HIS HA 1 36 HIS HA 1 1 475 1 2 1 1 42 TRP HH2 1 42 TRP HH2 1 1 476 1 1 1 1 36 HIS HA 1 36 HIS HA 1 1 476 1 2 1 1 42 TRP HZ3 1 42 TRP HZ3 1 1 477 1 1 1 1 36 HIS HB2 1 36 HIS HB2 1 1 477 1 2 1 1 36 HIS HD2 1 36 HIS HD2 1 1 478 1 1 1 1 36 HIS HB2 1 36 HIS HB2 1 1 478 1 2 1 1 37 LYS H 1 37 LYS HN 1 1 479 1 1 1 1 36 HIS HB2 1 36 HIS HB2 1 1 479 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 480 1 1 1 1 36 HIS HB3 1 36 HIS HB1 1 1 480 1 2 1 1 37 LYS H 1 37 LYS HN 1 1 481 1 1 1 1 36 HIS HD2 1 36 HIS HD2 1 1 481 1 2 1 1 43 LYS HG2 1 43 LYS HG1 1 1 482 1 1 1 1 36 HIS HD2 1 36 HIS HD2 1 1 482 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 483 1 1 1 1 36 HIS HD2 1 36 HIS HD2 1 1 483 1 2 1 1 45 PHE H 1 45 PHE HN 1 1 484 1 1 1 1 36 HIS HD2 1 36 HIS HD2 1 1 484 1 2 1 1 45 PHE HA 1 45 PHE HA 1 1 485 1 1 1 1 36 HIS HD2 1 36 HIS HD2 1 1 485 1 2 1 1 45 PHE HB3 1 45 PHE HB2 1 1 486 1 1 1 1 36 HIS HE1 1 36 HIS HE1 1 1 486 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 487 1 1 1 1 36 HIS O 1 36 HIS O 1 1 487 1 2 1 1 43 LYS H 1 43 LYS HN 1 1 488 1 1 1 1 36 HIS O 1 36 HIS O 1 1 488 1 2 1 1 43 LYS N 1 43 LYS N 1 1 489 1 1 1 1 37 LYS H 1 37 LYS HN 1 1 489 1 2 1 1 37 LYS HB2 1 37 LYS HB1 1 1 490 1 1 1 1 37 LYS H 1 37 LYS HN 1 1 490 1 2 1 1 37 LYS HB3 1 37 LYS HB2 1 1 491 1 1 1 1 37 LYS H 1 37 LYS HN 1 1 491 1 2 1 1 37 LYS HG2 1 37 LYS HG1 1 1 492 1 1 1 1 37 LYS H 1 37 LYS HN 1 1 492 1 2 1 1 42 TRP HE3 1 42 TRP HE3 1 1 493 1 1 1 1 37 LYS H 1 37 LYS HN 1 1 493 1 2 1 1 42 TRP HH2 1 42 TRP HH2 1 1 494 1 1 1 1 37 LYS H 1 37 LYS HN 1 1 494 1 2 1 1 42 TRP HZ3 1 42 TRP HZ3 1 1 495 1 1 1 1 37 LYS HA 1 37 LYS HA 1 1 495 1 2 1 1 37 LYS HB3 1 37 LYS HB2 1 1 496 1 1 1 1 37 LYS HA 1 37 LYS HA 1 1 496 1 2 1 1 37 LYS HG2 1 37 LYS HG1 1 1 497 1 1 1 1 37 LYS HA 1 37 LYS HA 1 1 497 1 2 1 1 37 LYS HG3 1 37 LYS HG2 1 1 498 1 1 1 1 37 LYS HA 1 37 LYS HA 1 1 498 1 2 1 1 38 ARG H 1 38 ARG HN 1 1 499 1 1 1 1 37 LYS HA 1 37 LYS HA 1 1 499 1 2 1 1 42 TRP HA 1 42 TRP HA 1 1 500 1 1 1 1 37 LYS HA 1 37 LYS HA 1 1 500 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 501 1 1 1 1 37 LYS HA 1 37 LYS HA 1 1 501 1 2 1 1 42 TRP HZ3 1 42 TRP HZ3 1 1 502 1 1 1 1 37 LYS HA 1 37 LYS HA 1 1 502 1 2 1 1 43 LYS H 1 43 LYS HN 1 1 503 1 1 1 1 37 LYS HB2 1 37 LYS HB1 1 1 503 1 2 1 1 37 LYS HE3 1 37 LYS HE2 1 1 504 1 1 1 1 37 LYS HB2 1 37 LYS HB1 1 1 504 1 2 1 1 37 LYS HG2 1 37 LYS HG1 1 1 505 1 1 1 1 37 LYS HB2 1 37 LYS HB1 1 1 505 1 2 1 1 38 ARG H 1 38 ARG HN 1 1 506 1 1 1 1 37 LYS HB2 1 37 LYS HB1 1 1 506 1 2 1 1 42 TRP HE3 1 42 TRP HE3 1 1 507 1 1 1 1 37 LYS HB2 1 37 LYS HB1 1 1 507 1 2 1 1 42 TRP HH2 1 42 TRP HH2 1 1 508 1 1 1 1 37 LYS HB2 1 37 LYS HB1 1 1 508 1 2 1 1 42 TRP HZ2 1 42 TRP HZ2 1 1 509 1 1 1 1 37 LYS HB2 1 37 LYS HB1 1 1 509 1 2 1 1 42 TRP HZ3 1 42 TRP HZ3 1 1 510 1 1 1 1 37 LYS HB3 1 37 LYS HB2 1 1 510 1 2 1 1 37 LYS HE3 1 37 LYS HE2 1 1 511 1 1 1 1 37 LYS HB3 1 37 LYS HB2 1 1 511 1 2 1 1 38 ARG H 1 38 ARG HN 1 1 512 1 1 1 1 37 LYS HB3 1 37 LYS HB2 1 1 512 1 2 1 1 42 TRP HA 1 42 TRP HA 1 1 513 1 1 1 1 37 LYS HB3 1 37 LYS HB2 1 1 513 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 514 1 1 1 1 37 LYS HB3 1 37 LYS HB2 1 1 514 1 2 1 1 42 TRP HE1 1 42 TRP HE1 1 1 515 1 1 1 1 37 LYS HB3 1 37 LYS HB2 1 1 515 1 2 1 1 42 TRP HE3 1 42 TRP HE3 1 1 516 1 1 1 1 37 LYS HB3 1 37 LYS HB2 1 1 516 1 2 1 1 42 TRP HH2 1 42 TRP HH2 1 1 517 1 1 1 1 37 LYS HB3 1 37 LYS HB2 1 1 517 1 2 1 1 42 TRP HZ2 1 42 TRP HZ2 1 1 518 1 1 1 1 37 LYS QD 1 37 LYS HD* 1 1 518 1 2 1 1 38 ARG H 1 38 ARG HN 1 1 519 1 1 1 1 37 LYS QD 1 37 LYS HD* 1 1 519 1 2 1 1 40 ASN H 1 40 ASN HN 1 1 520 1 1 1 1 37 LYS QD 1 37 LYS HD* 1 1 520 1 2 1 1 40 ASN HA 1 40 ASN HA 1 1 521 1 1 1 1 37 LYS QD 1 37 LYS HD* 1 1 521 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 522 1 1 1 1 37 LYS QD 1 37 LYS HD* 1 1 522 1 2 1 1 42 TRP HE1 1 42 TRP HE1 1 1 523 1 1 1 1 37 LYS QD 1 37 LYS HD* 1 1 523 1 2 1 1 42 TRP HH2 1 42 TRP HH2 1 1 524 1 1 1 1 37 LYS QD 1 37 LYS HD* 1 1 524 1 2 1 1 42 TRP HZ2 1 42 TRP HZ2 1 1 525 1 1 1 1 37 LYS HE2 1 37 LYS HE1 1 1 525 1 2 1 1 37 LYS HG2 1 37 LYS HG1 1 1 526 1 1 1 1 37 LYS HE2 1 37 LYS HE1 1 1 526 1 2 1 1 37 LYS HG3 1 37 LYS HG2 1 1 527 1 1 1 1 37 LYS HE2 1 37 LYS HE1 1 1 527 1 2 1 1 40 ASN HA 1 40 ASN HA 1 1 528 1 1 1 1 37 LYS HE2 1 37 LYS HE1 1 1 528 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 529 1 1 1 1 37 LYS HE2 1 37 LYS HE1 1 1 529 1 2 1 1 42 TRP HE1 1 42 TRP HE1 1 1 530 1 1 1 1 37 LYS HE2 1 37 LYS HE1 1 1 530 1 2 1 1 42 TRP HZ2 1 42 TRP HZ2 1 1 531 1 1 1 1 37 LYS HE3 1 37 LYS HE2 1 1 531 1 2 1 1 37 LYS HG2 1 37 LYS HG1 1 1 532 1 1 1 1 37 LYS HE3 1 37 LYS HE2 1 1 532 1 2 1 1 37 LYS HG3 1 37 LYS HG2 1 1 533 1 1 1 1 37 LYS HE3 1 37 LYS HE2 1 1 533 1 2 1 1 40 ASN HA 1 40 ASN HA 1 1 534 1 1 1 1 37 LYS HE3 1 37 LYS HE2 1 1 534 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 535 1 1 1 1 37 LYS HE3 1 37 LYS HE2 1 1 535 1 2 1 1 42 TRP HE1 1 42 TRP HE1 1 1 536 1 1 1 1 37 LYS HE3 1 37 LYS HE2 1 1 536 1 2 1 1 42 TRP HZ2 1 42 TRP HZ2 1 1 537 1 1 1 1 37 LYS HG2 1 37 LYS HG1 1 1 537 1 2 1 1 38 ARG H 1 38 ARG HN 1 1 538 1 1 1 1 37 LYS HG2 1 37 LYS HG1 1 1 538 1 2 1 1 38 ARG QB 1 38 ARG HB* 1 1 539 1 1 1 1 37 LYS HG2 1 37 LYS HG1 1 1 539 1 2 1 1 40 ASN H 1 40 ASN HN 1 1 540 1 1 1 1 37 LYS HG2 1 37 LYS HG1 1 1 540 1 2 1 1 40 ASN HA 1 40 ASN HA 1 1 541 1 1 1 1 37 LYS HG2 1 37 LYS HG1 1 1 541 1 2 1 1 41 HIS H 1 41 HIS HN 1 1 542 1 1 1 1 37 LYS HG2 1 37 LYS HG1 1 1 542 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 543 1 1 1 1 37 LYS HG2 1 37 LYS HG1 1 1 543 1 2 1 1 42 TRP HZ2 1 42 TRP HZ2 1 1 544 1 1 1 1 37 LYS HG3 1 37 LYS HG2 1 1 544 1 2 1 1 38 ARG H 1 38 ARG HN 1 1 545 1 1 1 1 37 LYS HG3 1 37 LYS HG2 1 1 545 1 2 1 1 40 ASN H 1 40 ASN HN 1 1 546 1 1 1 1 37 LYS HG3 1 37 LYS HG2 1 1 546 1 2 1 1 40 ASN HA 1 40 ASN HA 1 1 547 1 1 1 1 37 LYS HG3 1 37 LYS HG2 1 1 547 1 2 1 1 41 HIS H 1 41 HIS HN 1 1 548 1 1 1 1 37 LYS HG3 1 37 LYS HG2 1 1 548 1 2 1 1 42 TRP H 1 42 TRP HN 1 1 549 1 1 1 1 37 LYS HG3 1 37 LYS HG2 1 1 549 1 2 1 1 42 TRP HA 1 42 TRP HA 1 1 550 1 1 1 1 37 LYS HG3 1 37 LYS HG2 1 1 550 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 551 1 1 1 1 37 LYS HG3 1 37 LYS HG2 1 1 551 1 2 1 1 42 TRP HE1 1 42 TRP HE1 1 1 552 1 1 1 1 38 ARG H 1 38 ARG HN 1 1 552 1 2 1 1 38 ARG QB 1 38 ARG HB* 1 1 553 1 1 1 1 38 ARG H 1 38 ARG HN 1 1 553 1 2 1 1 38 ARG QG 1 38 ARG HG* 1 1 554 1 1 1 1 38 ARG H 1 38 ARG HN 1 1 554 1 2 1 1 39 GLU H 1 39 GLU HN 1 1 555 1 1 1 1 38 ARG H 1 38 ARG HN 1 1 555 1 2 1 1 41 HIS H 1 41 HIS HN 1 1 556 1 1 1 1 38 ARG H 1 38 ARG HN 1 1 556 1 2 1 1 41 HIS O 1 41 HIS O 1 1 557 1 1 1 1 38 ARG HA 1 38 ARG HA 1 1 557 1 2 1 1 38 ARG QD 1 38 ARG HD* 1 1 558 1 1 1 1 38 ARG HA 1 38 ARG HA 1 1 558 1 2 1 1 38 ARG QG 1 38 ARG HG* 1 1 559 1 1 1 1 38 ARG HA 1 38 ARG HA 1 1 559 1 2 1 1 39 GLU H 1 39 GLU HN 1 1 560 1 1 1 1 38 ARG HA 1 38 ARG HA 1 1 560 1 2 1 1 39 GLU HA 1 39 GLU HA 1 1 561 1 1 1 1 38 ARG QD 1 38 ARG HD* 1 1 561 1 2 1 1 39 GLU H 1 39 GLU HN 1 1 562 1 1 1 1 38 ARG QD 1 38 ARG HD* 1 1 562 1 2 1 1 45 PHE CZ 1 45 PHE CZ 1 1 563 1 1 1 1 38 ARG QG 1 38 ARG HG* 1 1 563 1 2 1 1 45 PHE CZ 1 45 PHE CZ 1 1 564 1 1 1 1 38 ARG QG 1 38 ARG HG* 1 1 564 1 2 1 1 45 PHE HZ 1 45 PHE HZ 1 1 565 1 1 1 1 38 ARG N 1 38 ARG N 1 1 565 1 2 1 1 41 HIS O 1 41 HIS O 1 1 566 1 1 1 1 39 GLU H 1 39 GLU HN 1 1 566 1 2 1 1 39 GLU HA 1 39 GLU HA 1 1 567 1 1 1 1 39 GLU H 1 39 GLU HN 1 1 567 1 2 1 1 39 GLU HG2 1 39 GLU HG2 1 1 568 1 1 1 1 39 GLU H 1 39 GLU HN 1 1 568 1 2 1 1 39 GLU HG3 1 39 GLU HG1 1 1 569 1 1 1 1 39 GLU H 1 39 GLU HN 1 1 569 1 2 1 1 40 ASN H 1 40 ASN HN 1 1 570 1 1 1 1 39 GLU H 1 39 GLU HN 1 1 570 1 2 1 1 40 ASN HA 1 40 ASN HA 1 1 571 1 1 1 1 39 GLU HA 1 39 GLU HA 1 1 571 1 2 1 1 40 ASN H 1 40 ASN HN 1 1 572 1 1 1 1 39 GLU HA 1 39 GLU HA 1 1 572 1 2 1 1 40 ASN QB 1 40 ASN HB* 1 1 573 1 1 1 1 39 GLU HA 1 39 GLU HA 1 1 573 1 2 1 1 41 HIS H 1 41 HIS HN 1 1 574 1 1 1 1 39 GLU QB 1 39 GLU HB* 1 1 574 1 2 1 1 40 ASN H 1 40 ASN HN 1 1 575 1 1 1 1 39 GLU QB 1 39 GLU HB* 1 1 575 1 2 1 1 41 HIS HD2 1 41 HIS HD2 1 1 576 1 1 1 1 39 GLU QB 1 39 GLU HB* 1 1 576 1 2 1 1 43 LYS QE 1 43 LYS HE* 1 1 577 1 1 1 1 39 GLU QG 1 39 GLU HG* 1 1 577 1 2 1 1 40 ASN H 1 40 ASN HN 1 1 578 1 1 1 1 40 ASN H 1 40 ASN HN 1 1 578 1 2 1 1 40 ASN HA 1 40 ASN HA 1 1 579 1 1 1 1 40 ASN H 1 40 ASN HN 1 1 579 1 2 1 1 40 ASN HB2 1 40 ASN HB2 1 1 580 1 1 1 1 40 ASN H 1 40 ASN HN 1 1 580 1 2 1 1 40 ASN QB 1 40 ASN HB* 1 1 581 1 1 1 1 40 ASN H 1 40 ASN HN 1 1 581 1 2 1 1 40 ASN HB3 1 40 ASN HB1 1 1 582 1 1 1 1 40 ASN H 1 40 ASN HN 1 1 582 1 2 1 1 41 HIS H 1 41 HIS HN 1 1 583 1 1 1 1 40 ASN HA 1 40 ASN HA 1 1 583 1 2 1 1 41 HIS H 1 41 HIS HN 1 1 584 1 1 1 1 40 ASN HA 1 40 ASN HA 1 1 584 1 2 1 1 41 HIS HA 1 41 HIS HA 1 1 585 1 1 1 1 40 ASN QB 1 40 ASN HB* 1 1 585 1 2 1 1 41 HIS HA 1 41 HIS HA 1 1 586 1 1 1 1 40 ASN QB 1 40 ASN HB* 1 1 586 1 2 1 1 41 HIS HD2 1 41 HIS HD2 1 1 587 1 1 1 1 40 ASN QB 1 40 ASN HB* 1 1 587 1 2 1 1 41 HIS HE1 1 41 HIS HE1 1 1 588 1 1 1 1 40 ASN HB2 1 40 ASN HB2 1 1 588 1 2 1 1 41 HIS HD2 1 41 HIS HD2 1 1 589 1 1 1 1 40 ASN HB3 1 40 ASN HB1 1 1 589 1 2 1 1 41 HIS HD2 1 41 HIS HD2 1 1 590 1 1 1 1 41 HIS H 1 41 HIS HN 1 1 590 1 2 1 1 41 HIS HB2 1 41 HIS HB2 1 1 591 1 1 1 1 41 HIS H 1 41 HIS HN 1 1 591 1 2 1 1 41 HIS QB 1 41 HIS HB* 1 1 592 1 1 1 1 41 HIS H 1 41 HIS HN 1 1 592 1 2 1 1 41 HIS HB3 1 41 HIS HB1 1 1 593 1 1 1 1 41 HIS H 1 41 HIS HN 1 1 593 1 2 1 1 41 HIS HD2 1 41 HIS HD2 1 1 594 1 1 1 1 41 HIS HA 1 41 HIS HA 1 1 594 1 2 1 1 41 HIS HB2 1 41 HIS HB2 1 1 595 1 1 1 1 41 HIS HA 1 41 HIS HA 1 1 595 1 2 1 1 41 HIS HB3 1 41 HIS HB1 1 1 596 1 1 1 1 41 HIS HA 1 41 HIS HA 1 1 596 1 2 1 1 41 HIS HD2 1 41 HIS HD2 1 1 597 1 1 1 1 41 HIS HA 1 41 HIS HA 1 1 597 1 2 1 1 42 TRP H 1 42 TRP HN 1 1 598 1 1 1 1 41 HIS HA 1 41 HIS HA 1 1 598 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 599 1 1 1 1 41 HIS QB 1 41 HIS HB* 1 1 599 1 2 1 1 42 TRP H 1 42 TRP HN 1 1 600 1 1 1 1 41 HIS QB 1 41 HIS HB* 1 1 600 1 2 1 1 43 LYS HG2 1 43 LYS HG1 1 1 601 1 1 1 1 41 HIS QB 1 41 HIS HB* 1 1 601 1 2 1 1 43 LYS HG3 1 43 LYS HG2 1 1 602 1 1 1 1 42 TRP H 1 42 TRP HN 1 1 602 1 2 1 1 42 TRP HB2 1 42 TRP HB1 1 1 603 1 1 1 1 42 TRP H 1 42 TRP HN 1 1 603 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 604 1 1 1 1 42 TRP HA 1 42 TRP HA 1 1 604 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 605 1 1 1 1 42 TRP HA 1 42 TRP HA 1 1 605 1 2 1 1 42 TRP HE3 1 42 TRP HE3 1 1 606 1 1 1 1 42 TRP HB2 1 42 TRP HB1 1 1 606 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 607 1 1 1 1 42 TRP HB3 1 42 TRP HB2 1 1 607 1 2 1 1 42 TRP HD1 1 42 TRP HD1 1 1 608 1 1 1 1 42 TRP HB3 1 42 TRP HB2 1 1 608 1 2 1 1 42 TRP HE3 1 42 TRP HE3 1 1 609 1 1 1 1 42 TRP HB3 1 42 TRP HB2 1 1 609 1 2 1 1 43 LYS H 1 43 LYS HN 1 1 610 1 1 1 1 42 TRP HE3 1 42 TRP HE3 1 1 610 1 2 1 1 43 LYS H 1 43 LYS HN 1 1 611 1 1 1 1 43 LYS H 1 43 LYS HN 1 1 611 1 2 1 1 43 LYS QD 1 43 LYS HD* 1 1 612 1 1 1 1 43 LYS H 1 43 LYS HN 1 1 612 1 2 1 1 43 LYS HG2 1 43 LYS HG1 1 1 613 1 1 1 1 43 LYS H 1 43 LYS HN 1 1 613 1 2 1 1 43 LYS HG3 1 43 LYS HG2 1 1 614 1 1 1 1 43 LYS HA 1 43 LYS HA 1 1 614 1 2 1 1 43 LYS QD 1 43 LYS HD* 1 1 615 1 1 1 1 43 LYS HA 1 43 LYS HA 1 1 615 1 2 1 1 43 LYS HG2 1 43 LYS HG1 1 1 616 1 1 1 1 43 LYS HA 1 43 LYS HA 1 1 616 1 2 1 1 44 CYS H 1 44 CYS HN 1 1 617 1 1 1 1 43 LYS HA 1 43 LYS HA 1 1 617 1 2 1 1 44 CYS HB2 1 44 CYS HB1 1 1 618 1 1 1 1 43 LYS QB 1 43 LYS HB* 1 1 618 1 2 1 1 44 CYS H 1 44 CYS HN 1 1 619 1 1 1 1 43 LYS QB 1 43 LYS HB* 1 1 619 1 2 1 1 45 PHE CZ 1 45 PHE CZ 1 1 620 1 1 1 1 43 LYS QB 1 43 LYS HB* 1 1 620 1 2 1 1 45 PHE HZ 1 45 PHE HZ 1 1 621 1 1 1 1 43 LYS QD 1 43 LYS HD* 1 1 621 1 2 1 1 44 CYS H 1 44 CYS HN 1 1 622 1 1 1 1 43 LYS QE 1 43 LYS HE* 1 1 622 1 2 1 1 45 PHE CZ 1 45 PHE CZ 1 1 623 1 1 1 1 43 LYS HG2 1 43 LYS HG1 1 1 623 1 2 1 1 44 CYS H 1 44 CYS HN 1 1 624 1 1 1 1 43 LYS HG3 1 43 LYS HG2 1 1 624 1 2 1 1 44 CYS H 1 44 CYS HN 1 1 625 1 1 1 1 43 LYS HG3 1 43 LYS HG2 1 1 625 1 2 1 1 45 PHE CG 1 45 PHE CG 1 1 626 1 1 1 1 43 LYS HG3 1 43 LYS HG2 1 1 626 1 2 1 1 45 PHE CZ 1 45 PHE CZ 1 1 627 1 1 1 1 43 LYS HG3 1 43 LYS HG2 1 1 627 1 2 1 1 45 PHE HZ 1 45 PHE HZ 1 1 628 1 1 1 1 44 CYS H 1 44 CYS HN 1 1 628 1 2 1 1 44 CYS HB3 1 44 CYS HB2 1 1 629 1 1 1 1 45 PHE CG 1 45 PHE CG 1 1 629 1 2 1 1 46 CYS H 1 46 CYS HN 1 1 630 1 1 1 1 45 PHE CG 1 45 PHE CG 1 1 630 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 631 1 1 1 1 45 PHE CZ 1 45 PHE CZ 1 1 631 1 2 1 1 45 PHE H 1 45 PHE HN 1 1 632 1 1 1 1 45 PHE CZ 1 45 PHE CZ 1 1 632 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 633 1 1 1 1 45 PHE H 1 45 PHE HN 1 1 633 1 2 1 1 45 PHE HB3 1 45 PHE HB2 1 1 634 1 1 1 1 45 PHE H 1 45 PHE HN 1 1 634 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 635 1 1 1 1 45 PHE HA 1 45 PHE HA 1 1 635 1 2 1 1 46 CYS H 1 46 CYS HN 1 1 636 1 1 1 1 45 PHE HA 1 45 PHE HA 1 1 636 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 637 1 1 1 1 45 PHE HB2 1 45 PHE HB1 1 1 637 1 2 1 1 46 CYS H 1 46 CYS HN 1 1 638 1 1 1 1 45 PHE HB2 1 45 PHE HB1 1 1 638 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 639 1 1 1 1 45 PHE HB3 1 45 PHE HB2 1 1 639 1 2 1 1 46 CYS H 1 46 CYS HN 1 1 640 1 1 1 1 46 CYS H 1 46 CYS HN 1 1 640 1 2 1 1 46 CYS HB2 1 46 CYS HB1 1 1 641 1 1 1 1 46 CYS H 1 46 CYS HN 1 1 641 1 2 1 1 46 CYS HB3 1 46 CYS HB2 1 1 642 1 1 1 1 46 CYS H 1 46 CYS HN 1 1 642 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 643 1 1 1 1 46 CYS H 1 46 CYS HN 1 1 643 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 644 1 1 1 1 46 CYS H 1 46 CYS HN 1 1 644 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 645 1 1 1 1 46 CYS HA 1 46 CYS HA 1 1 645 1 2 1 1 47 TYR CG 1 47 TYR CG 1 1 646 1 1 1 1 46 CYS HA 1 46 CYS HA 1 1 646 1 2 1 1 47 TYR CZ 1 47 TYR CZ 1 1 647 1 1 1 1 46 CYS HA 1 46 CYS HA 1 1 647 1 2 1 1 47 TYR H 1 47 TYR HN 1 1 648 1 1 1 1 46 CYS HA 1 46 CYS HA 1 1 648 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 649 1 1 1 1 46 CYS HB2 1 46 CYS HB1 1 1 649 1 2 1 1 47 TYR H 1 47 TYR HN 1 1 650 1 1 1 1 46 CYS HB2 1 46 CYS HB1 1 1 650 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 651 1 1 1 1 46 CYS HB3 1 46 CYS HB2 1 1 651 1 2 1 1 47 TYR H 1 47 TYR HN 1 1 652 1 1 1 1 46 CYS HB3 1 46 CYS HB2 1 1 652 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 653 1 1 1 1 47 TYR CG 1 47 TYR CG 1 1 653 1 2 1 1 48 PHE H 1 48 PHE HN 1 1 654 1 1 1 1 47 TYR CZ 1 47 TYR CZ 1 1 654 1 2 1 1 47 TYR HA 1 47 TYR HA 1 1 655 1 1 1 1 47 TYR H 1 47 TYR HN 1 1 655 1 2 1 1 47 TYR QB 1 47 TYR HB* 1 1 656 1 1 1 1 47 TYR HA 1 47 TYR HA 1 1 656 1 2 1 1 48 PHE CG 1 48 PHE CG 1 1 657 1 1 1 1 47 TYR HA 1 47 TYR HA 1 1 657 1 2 1 1 48 PHE CZ 1 48 PHE CZ 1 1 658 1 1 1 1 47 TYR HA 1 47 TYR HA 1 1 658 1 2 1 1 48 PHE H 1 48 PHE HN 1 1 659 1 1 1 1 48 PHE CG 1 48 PHE CG 1 1 659 1 2 1 1 49 ASN H 1 49 ASN HN 1 1 660 1 1 1 1 48 PHE CZ 1 48 PHE CZ 1 1 660 1 2 1 1 48 PHE H 1 48 PHE HN 1 1 661 1 1 1 1 48 PHE CZ 1 48 PHE CZ 1 1 661 1 2 1 1 48 PHE HA 1 48 PHE HA 1 1 662 1 1 1 1 48 PHE H 1 48 PHE HN 1 1 662 1 2 1 1 48 PHE QB 1 48 PHE HB1 1 1 663 1 1 1 1 48 PHE QB 1 48 PHE HB1 1 1 663 1 2 1 1 49 ASN H 1 49 ASN HN 1 1 664 1 1 1 1 48 PHE QB 1 48 PHE HB2 1 1 664 1 2 1 1 49 ASN HD21 1 49 ASN HD21 1 1 665 1 1 1 1 48 PHE QB 1 48 PHE HB2 1 1 665 1 2 1 1 49 ASN HD22 1 49 ASN HD22 1 1 666 1 1 1 1 49 ASN H 1 49 ASN HN 1 1 666 1 2 1 1 50 CYS H 1 50 CYS HN 1 1 667 1 1 1 1 49 ASN HA 1 49 ASN HA 1 1 667 1 2 1 1 49 ASN HD21 1 49 ASN HD21 1 1 668 1 1 1 1 49 ASN HA 1 49 ASN HA 1 1 668 1 2 1 1 50 CYS H 1 50 CYS HN 1 1 669 1 1 1 1 50 CYS H 1 50 CYS HN 1 1 669 1 2 1 1 50 CYS HB2 1 50 CYS HB1 1 1 670 1 1 1 1 50 CYS H 1 50 CYS HN 1 1 670 1 2 1 1 50 CYS HB3 1 50 CYS HB2 1 1 671 1 1 1 1 50 CYS HA 1 50 CYS HA 1 1 671 1 2 1 1 50 CYS HB2 1 50 CYS HB1 1 1 672 1 1 1 1 50 CYS HA 1 50 CYS HA 1 1 672 1 2 1 1 50 CYS HB3 1 50 CYS HB2 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 1.8 2.64 1 1 2 1 . . . . . . 1.8 4.29 1 1 3 1 . . . . . . 1.8 8.14 1 1 4 1 . . . . . . 1.8 8.14 1 1 5 1 . . . . . . 1.8 8.14 1 1 6 1 . . . . . . 1.8 9.24 1 1 7 1 . . . . . . 1.8 8.14 1 1 8 1 . . . . . . 1.8 3.52 1 1 9 1 . . . . . . 1.8 3.52 1 1 10 1 . . . . . . 1.8 5.5 1 1 11 1 . . . . . . 1.8 4.07 1 1 12 1 . . . . . . 1.8 4.4 1 1 13 1 . . . . . . 1.8 7.7 1 1 14 1 . . . . . . 1.8 3.3 1 1 15 1 . . . . . . 1.8 5.5 1 1 16 1 . . . . . . 1.8 6.38 1 1 17 1 . . . . . . 1.8 8.58 1 1 18 1 . . . . . . 1.8 7.25 1 1 19 1 . . . . . . 1.8 4.62 1 1 20 1 . . . . . . 1.8 5.5 1 1 21 1 . . . . . . 1.8 5.5 1 1 22 1 . . . . . . 1.8 5.5 1 1 23 1 . . . . . . 1.8 3.41 1 1 24 1 . . . . . . 1.8 3.08 1 1 25 1 . . . . . . 1.8 6.15 1 1 26 1 . . . . . . 1.8 5.5 1 1 27 1 . . . . . . 1.8 5.5 1 1 28 1 . . . . . . 1.8 5.5 1 1 29 1 . . . . . . 1.8 5.5 1 1 30 1 . . . . . . 1.8 5.5 1 1 31 1 . . . . . . 1.8 5.5 1 1 32 1 . . . . . . 1.8 6.26 1 1 33 1 . . . . . . 1.8 3.52 1 1 34 1 . . . . . . 1.8 4.07 1 1 35 1 . . . . . . 1.8 3.19 1 1 36 1 . . . . . . 1.8 2.64 1 1 37 1 . . . . . . 1.8 6.16 1 1 38 1 . . . . . . 1.8 6.05 1 1 39 1 . . . . . . 1.8 2.97 1 1 40 1 . . . . . . 1.8 7.48 1 1 41 1 . . . . . . 1.8 6.6 1 1 42 1 . . . . . . 1.8 7.48 1 1 43 1 . . . . . . 1.8 6.6 1 1 44 1 . . . . . . 1.8 3.41 1 1 45 1 . . . . . . 1.8 5.5 1 1 46 1 . . . . . . 1.8 7.7 1 1 47 1 . . . . . . 1.8 4.73 1 1 48 1 . . . . . . 1.8 5.94 1 1 49 1 . . . . . . 1.8 6.71 1 1 50 1 . . . . . . 1.8 5.83 1 1 51 1 . . . . . . 1.8 3.73 1 1 52 1 . . . . . . 1.8 7.7 1 1 53 1 . . . . . . 1.8 5.5 1 1 54 1 . . . . . . 1.8 3.41 1 1 55 1 . . . . . . 1.8 2.0 1 1 56 1 . . . . . . 1.8 7.7 1 1 57 1 . . . . . . 1.8 7.7 1 1 58 1 . . . . . . 1.8 7.48 1 1 59 1 . . . . . . 1.8 3.68 1 1 60 1 . . . . . . 1.8 2.75 1 1 61 1 . . . . . . 1.8 2.55 1 1 62 1 . . . . . . 1.8 2.75 1 1 63 1 . . . . . . 1.8 4.73 1 1 64 1 . . . . . . 1.8 7.15 1 1 65 1 . . . . . . 1.8 4.09 1 1 66 1 . . . . . . 1.8 6.93 1 1 67 1 . . . . . . 1.8 6.82 1 1 68 1 . . . . . . 1.8 5.27 1 1 69 1 . . . . . . 1.8 5.27 1 1 70 1 . . . . . . 1.8 5.27 1 1 71 1 . . . . . . 1.8 5.27 1 1 72 1 . . . . . . 1.8 6.1 1 1 73 1 . . . . . . 1.8 8.58 1 1 74 1 . . . . . . 1.8 7.15 1 1 75 1 . . . . . . 1.8 7.25 1 1 76 1 . . . . . . 1.8 7.25 1 1 77 1 . . . . . . 1.8 7.25 1 1 78 1 . . . . . . 1.8 7.25 1 1 79 1 . . . . . . 1.8 5.72 1 1 80 1 . . . . . . 1.8 6.15 1 1 81 1 . . . . . . 1.8 6.71 1 1 82 1 . . . . . . 1.8 3.0 1 1 83 1 . . . . . . 1.8 3.19 1 1 84 1 . . . . . . 1.8 5.5 1 1 85 1 . . . . . . 1.8 5.61 1 1 86 1 . . . . . . 1.8 3.08 1 1 87 1 . . . . . . 1.8 4.4 1 1 88 1 . . . . . . 1.8 5.5 1 1 89 1 . . . . . . 1.8 3.63 1 1 90 1 . . . . . . 1.8 5.94 1 1 91 1 . . . . . . 1.8 7.7 1 1 92 1 . . . . . . 1.8 7.7 1 1 93 1 . . . . . . 1.8 3.08 1 1 94 1 . . . . . . 1.8 6.93 1 1 95 1 . . . . . . 1.8 3.52 1 1 96 1 . . . . . . 1.8 5.5 1 1 97 1 . . . . . . 1.8 2.64 1 1 98 1 . . . . . . 1.8 5.5 1 1 99 1 . . . . . . 1.8 5.5 1 1 100 1 . . . . . . 1.8 5.39 1 1 101 1 . . . . . . 1.8 3.74 1 1 102 1 . . . . . . 1.8 5.5 1 1 103 1 . . . . . . 1.8 5.5 1 1 104 1 . . . . . . 1.8 3.52 1 1 105 1 . . . . . . 1.8 3.14 1 1 106 1 . . . . . . 1.8 3.52 1 1 107 1 . . . . . . 1.8 3.74 1 1 108 1 . . . . . . 1.8 3.58 1 1 109 1 . . . . . . 1.8 3.74 1 1 110 1 . . . . . . 1.8 3.08 1 1 111 1 . . . . . . 1.8 6.6 1 1 112 1 . . . . . . 1.8 5.5 1 1 113 1 . . . . . . 1.8 3.67 1 1 114 1 . . . . . . 1.8 6.6 1 1 115 1 . . . . . . 1.8 6.6 1 1 116 1 . . . . . . 1.8 2.86 1 1 117 1 . . . . . . 1.8 2.64 1 1 118 1 . . . . . . 1.8 3.74 1 1 119 1 . . . . . . 1.8 5.5 1 1 120 1 . . . . . . 1.8 3.74 1 1 121 1 . . . . . . 1.8 3.74 1 1 122 1 . . . . . . 1.8 3.63 1 1 123 1 . . . . . . 1.8 6.6 1 1 124 1 . . . . . . 1.8 6.6 1 1 125 1 . . . . . . 1.8 6.6 1 1 126 1 . . . . . . 1.8 6.6 1 1 127 1 . . . . . . 1.8 6.6 1 1 128 1 . . . . . . 1.8 6.6 1 1 129 1 . . . . . . 1.8 6.6 1 1 130 1 . . . . . . 1.8 6.6 1 1 131 1 . . . . . . 1.8 6.6 1 1 132 1 . . . . . . 1.8 6.38 1 1 133 1 . . . . . . 1.8 6.6 1 1 134 1 . . . . . . 1.8 2.86 1 1 135 1 . . . . . . 1.8 2.86 1 1 136 1 . . . . . . 1.8 5.5 1 1 137 1 . . . . . . 1.8 2.86 1 1 138 1 . . . . . . 1.8 5.5 1 1 139 1 . . . . . . 1.8 3.3 1 1 140 1 . . . . . . 1.8 4.95 1 1 141 1 . . . . . . 1.8 5.5 1 1 142 1 . . . . . . 1.8 4.07 1 1 143 1 . . . . . . 1.8 5.5 1 1 144 1 . . . . . . 1.8 4.4 1 1 145 1 . . . . . . 1.8 5.06 1 1 146 1 . . . . . . 1.8 4.07 1 1 147 1 . . . . . . 1.8 5.5 1 1 148 1 . . . . . . 1.8 5.5 1 1 149 1 . . . . . . 1.8 4.95 1 1 150 1 . . . . . . 1.8 4.07 1 1 151 1 . . . . . . 1.8 3.45 1 1 152 1 . . . . . . 1.8 4.07 1 1 153 1 . . . . . . 1.8 5.5 1 1 154 1 . . . . . . 1.8 3.96 1 1 155 1 . . . . . . 1.8 5.5 1 1 156 1 . . . . . . 1.8 6.38 1 1 157 1 . . . . . . 1.8 3.41 1 1 158 1 . . . . . . 1.8 6.38 1 1 159 1 . . . . . . 1.8 3.74 1 1 160 1 . . . . . . 1.8 4.62 1 1 161 1 . . . . . . 1.8 3.85 1 1 162 1 . . . . . . 1.8 3.53 1 1 163 1 . . . . . . 1.8 3.85 1 1 164 1 . . . . . . 1.8 4.18 1 1 165 1 . . . . . . 1.8 4.18 1 1 166 1 . . . . . . 1.8 3.19 1 1 167 1 . . . . . . 1.8 5.5 1 1 168 1 . . . . . . 1.8 5.5 1 1 169 1 . . . . . . 1.8 5.5 1 1 170 1 . . . . . . 1.8 5.5 1 1 171 1 . . . . . . 1.8 4.67 1 1 172 1 . . . . . . 1.8 5.5 1 1 173 1 . . . . . . 1.8 6.38 1 1 174 1 . . . . . . 1.8 3.85 1 1 175 1 . . . . . . 1.8 5.5 1 1 176 1 . . . . . . 1.8 3.3 1 1 177 1 . . . . . . 1.8 5.5 1 1 178 1 . . . . . . 1.8 2.9 1 1 179 1 . . . . . . 1.8 3.19 1 1 180 1 . . . . . . 1.8 3.19 1 1 181 1 . . . . . . 1.8 2.75 1 1 182 1 . . . . . . 1.8 2.86 1 1 183 1 . . . . . . 1.8 2.97 1 1 184 1 . . . . . . 1.8 3.08 1 1 185 1 . . . . . . 1.8 3.85 1 1 186 1 . . . . . . 1.8 4.07 1 1 187 1 . . . . . . 1.8 3.19 1 1 188 1 . . . . . . 1.8 3.01 1 1 189 1 . . . . . . 1.8 3.19 1 1 190 1 . . . . . . 1.8 3.3 1 1 191 1 . . . . . . 1.8 3.3 1 1 192 1 . . . . . . 1.8 2.75 1 1 193 1 . . . . . . 1.8 2.97 1 1 194 1 . . . . . . 1.8 3.41 1 1 195 1 . . . . . . 1.8 3.52 1 1 196 1 . . . . . . 1.8 3.74 1 1 197 1 . . . . . . 1.8 3.36 1 1 198 1 . . . . . . 1.8 3.74 1 1 199 1 . . . . . . 1.8 3.53 1 1 200 1 . . . . . . 1.8 4.81 1 1 201 1 . . . . . . 1.8 4.14 1 1 202 1 . . . . . . 1.8 3.85 1 1 203 1 . . . . . . 1.8 5.5 1 1 204 1 . . . . . . 1.8 5.38 1 1 205 1 . . . . . . 1.8 5.38 1 1 206 1 . . . . . . 1.8 3.85 1 1 207 1 . . . . . . 1.8 5.5 1 1 208 1 . . . . . . 1.8 5.38 1 1 209 1 . . . . . . 1.8 5.38 1 1 210 1 . . . . . . 1.8 6.6 1 1 211 1 . . . . . . 1.8 2.75 1 1 212 1 . . . . . . 1.8 3.08 1 1 213 1 . . . . . . 1.8 6.6 1 1 214 1 . . . . . . 1.8 6.6 1 1 215 1 . . . . . . 1.8 5.5 1 1 216 1 . . . . . . 1.8 5.5 1 1 217 1 . . . . . . 1.8 5.5 1 1 218 1 . . . . . . 1.8 6.6 1 1 219 1 . . . . . . 1.8 3.41 1 1 220 1 . . . . . . 1.8 4.84 1 1 221 1 . . . . . . 1.8 5.5 1 1 222 1 . . . . . . 1.8 4.84 1 1 223 1 . . . . . . 1.8 5.5 1 1 224 1 . . . . . . 1.8 3.74 1 1 225 1 . . . . . . 1.8 6.16 1 1 226 1 . . . . . . 1.8 6.6 1 1 227 1 . . . . . . 1.8 6.6 1 1 228 1 . . . . . . 1.8 6.6 1 1 229 1 . . . . . . 1.8 6.6 1 1 230 1 . . . . . . 1.8 6.6 1 1 231 1 . . . . . . 1.8 2.0 1 1 232 1 . . . . . . 1.8 3.0 1 1 233 1 . . . . . . 1.8 5.5 1 1 234 1 . . . . . . 1.8 5.5 1 1 235 1 . . . . . . 1.8 4.07 1 1 236 1 . . . . . . 1.8 4.07 1 1 237 1 . . . . . . 1.8 4.73 1 1 238 1 . . . . . . 1.8 6.6 1 1 239 1 . . . . . . 1.8 3.08 1 1 240 1 . . . . . . 1.8 2.79 1 1 241 1 . . . . . . 1.8 3.08 1 1 242 1 . . . . . . 1.8 2.97 1 1 243 1 . . . . . . 1.8 4.84 1 1 244 1 . . . . . . 1.8 5.5 1 1 245 1 . . . . . . 1.8 3.08 1 1 246 1 . . . . . . 1.8 5.5 1 1 247 1 . . . . . . 1.8 4.51 1 1 248 1 . . . . . . 1.8 6.6 1 1 249 1 . . . . . . 1.8 5.5 1 1 250 1 . . . . . . 1.8 4.51 1 1 251 1 . . . . . . 1.8 5.83 1 1 252 1 . . . . . . 1.8 5.5 1 1 253 1 . . . . . . 1.8 3.74 1 1 254 1 . . . . . . 1.8 5.5 1 1 255 1 . . . . . . 1.8 5.27 1 1 256 1 . . . . . . 1.8 5.5 1 1 257 1 . . . . . . 1.8 6.38 1 1 258 1 . . . . . . 1.8 2.0 1 1 259 1 . . . . . . 1.8 3.0 1 1 260 1 . . . . . . 1.8 2.75 1 1 261 1 . . . . . . 1.8 3.08 1 1 262 1 . . . . . . 1.8 5.5 1 1 263 1 . . . . . . 1.8 6.38 1 1 264 1 . . . . . . 1.8 5.5 1 1 265 1 . . . . . . 1.8 5.5 1 1 266 1 . . . . . . 1.8 5.5 1 1 267 1 . . . . . . 1.8 3.08 1 1 268 1 . . . . . . 1.8 4.73 1 1 269 1 . . . . . . 1.8 5.5 1 1 270 1 . . . . . . 1.8 5.5 1 1 271 1 . . . . . . 1.8 5.5 1 1 272 1 . . . . . . 1.8 2.86 1 1 273 1 . . . . . . 1.8 3.41 1 1 274 1 . . . . . . 1.8 5.5 1 1 275 1 . . . . . . 1.8 7.7 1 1 276 1 . . . . . . 1.8 4.29 1 1 277 1 . . . . . . 1.8 6.38 1 1 278 1 . . . . . . 1.8 3.41 1 1 279 1 . . . . . . 1.8 3.74 1 1 280 1 . . . . . . 1.8 3.85 1 1 281 1 . . . . . . 1.8 2.97 1 1 282 1 . . . . . . 1.8 4.73 1 1 283 1 . . . . . . 1.8 3.41 1 1 284 1 . . . . . . 1.8 3.08 1 1 285 1 . . . . . . 1.8 5.5 1 1 286 1 . . . . . . 1.8 3.52 1 1 287 1 . . . . . . 1.8 6.6 1 1 288 1 . . . . . . 1.8 4.51 1 1 289 1 . . . . . . 1.8 4.51 1 1 290 1 . . . . . . 1.8 6.6 1 1 291 1 . . . . . . 1.8 4.73 1 1 292 1 . . . . . . 1.8 4.07 1 1 293 1 . . . . . . 1.8 2.0 1 1 294 1 . . . . . . 1.8 3.0 1 1 295 1 . . . . . . 1.8 5.5 1 1 296 1 . . . . . . 1.8 5.5 1 1 297 1 . . . . . . 1.8 5.5 1 1 298 1 . . . . . . 1.8 3.85 1 1 299 1 . . . . . . 1.8 3.85 1 1 300 1 . . . . . . 1.8 3.63 1 1 301 1 . . . . . . 1.8 3.19 1 1 302 1 . . . . . . 1.8 4.95 1 1 303 1 . . . . . . 1.8 5.5 1 1 304 1 . . . . . . 1.8 3.08 1 1 305 1 . . . . . . 1.8 5.5 1 1 306 1 . . . . . . 1.8 2.75 1 1 307 1 . . . . . . 1.8 5.5 1 1 308 1 . . . . . . 1.8 3.85 1 1 309 1 . . . . . . 1.8 3.08 1 1 310 1 . . . . . . 1.8 3.52 1 1 311 1 . . . . . . 1.8 6.6 1 1 312 1 . . . . . . 1.8 3.3 1 1 313 1 . . . . . . 1.8 6.6 1 1 314 1 . . . . . . 1.8 3.19 1 1 315 1 . . . . . . 1.8 5.5 1 1 316 1 . . . . . . 1.8 5.06 1 1 317 1 . . . . . . 1.8 5.5 1 1 318 1 . . . . . . 1.8 5.5 1 1 319 1 . . . . . . 1.8 3.74 1 1 320 1 . . . . . . 1.8 5.5 1 1 321 1 . . . . . . 1.8 7.7 1 1 322 1 . . . . . . 1.8 4.62 1 1 323 1 . . . . . . 1.8 3.08 1 1 324 1 . . . . . . 1.8 6.6 1 1 325 1 . . . . . . 1.8 4.51 1 1 326 1 . . . . . . 1.8 4.29 1 1 327 1 . . . . . . 1.8 5.5 1 1 328 1 . . . . . . 1.8 5.5 1 1 329 1 . . . . . . 1.8 3.63 1 1 330 1 . . . . . . 1.8 5.5 1 1 331 1 . . . . . . 1.8 5.5 1 1 332 1 . . . . . . 1.8 4.51 1 1 333 1 . . . . . . 1.8 2.75 1 1 334 1 . . . . . . 1.8 3.08 1 1 335 1 . . . . . . 1.8 2.97 1 1 336 1 . . . . . . 1.8 4.95 1 1 337 1 . . . . . . 1.8 3.19 1 1 338 1 . . . . . . 1.8 3.19 1 1 339 1 . . . . . . 1.8 4.18 1 1 340 1 . . . . . . 1.8 3.3 1 1 341 1 . . . . . . 1.8 4.95 1 1 342 1 . . . . . . 1.8 3.63 1 1 343 1 . . . . . . 1.8 3.08 1 1 344 1 . . . . . . 1.8 2.86 1 1 345 1 . . . . . . 1.8 3.41 1 1 346 1 . . . . . . 1.8 4.62 1 1 347 1 . . . . . . 1.8 3.63 1 1 348 1 . . . . . . 1.8 6.38 1 1 349 1 . . . . . . 1.8 3.63 1 1 350 1 . . . . . . 1.8 6.38 1 1 351 1 . . . . . . 1.8 5.5 1 1 352 1 . . . . . . 1.8 6.38 1 1 353 1 . . . . . . 1.8 7.81 1 1 354 1 . . . . . . 1.8 2.64 1 1 355 1 . . . . . . 1.8 3.74 1 1 356 1 . . . . . . 1.8 3.85 1 1 357 1 . . . . . . 1.8 5.28 1 1 358 1 . . . . . . 1.8 5.5 1 1 359 1 . . . . . . 1.8 5.5 1 1 360 1 . . . . . . 1.8 3.08 1 1 361 1 . . . . . . 1.8 6.6 1 1 362 1 . . . . . . 1.8 2.75 1 1 363 1 . . . . . . 1.8 2.86 1 1 364 1 . . . . . . 1.8 7.26 1 1 365 1 . . . . . . 1.8 5.5 1 1 366 1 . . . . . . 1.8 7.7 1 1 367 1 . . . . . . 1.8 5.5 1 1 368 1 . . . . . . 1.8 7.7 1 1 369 1 . . . . . . 1.8 2.75 1 1 370 1 . . . . . . 1.8 5.5 1 1 371 1 . . . . . . 1.8 5.94 1 1 372 1 . . . . . . 1.8 5.39 1 1 373 1 . . . . . . 1.8 4.95 1 1 374 1 . . . . . . 1.8 6.6 1 1 375 1 . . . . . . 1.8 6.6 1 1 376 1 . . . . . . 1.8 6.6 1 1 377 1 . . . . . . 1.8 4.07 1 1 378 1 . . . . . . 1.8 8.8 1 1 379 1 . . . . . . 1.8 6.16 1 1 380 1 . . . . . . 1.8 6.6 1 1 381 1 . . . . . . 1.8 8.8 1 1 382 1 . . . . . . 1.8 8.8 1 1 383 1 . . . . . . 1.8 6.6 1 1 384 1 . . . . . . 1.8 3.3 1 1 385 1 . . . . . . 1.8 3.01 1 1 386 1 . . . . . . 1.8 3.3 1 1 387 1 . . . . . . 1.8 2.86 1 1 388 1 . . . . . . 1.8 2.97 1 1 389 1 . . . . . . 1.8 2.72 1 1 390 1 . . . . . . 1.8 2.97 1 1 391 1 . . . . . . 1.8 5.5 1 1 392 1 . . . . . . 1.8 3.58 1 1 393 1 . . . . . . 1.8 4.73 1 1 394 1 . . . . . . 1.8 6.38 1 1 395 1 . . . . . . 1.8 4.73 1 1 396 1 . . . . . . 1.8 3.85 1 1 397 1 . . . . . . 1.8 3.96 1 1 398 1 . . . . . . 1.8 3.85 1 1 399 1 . . . . . . 1.8 3.96 1 1 400 1 . . . . . . 1.8 3.52 1 1 401 1 . . . . . . 1.8 2.97 1 1 402 1 . . . . . . 1.8 2.97 1 1 403 1 . . . . . . 1.8 4.73 1 1 404 1 . . . . . . 1.8 7.7 1 1 405 1 . . . . . . 1.8 3.85 1 1 406 1 . . . . . . 1.8 7.81 1 1 407 1 . . . . . . 1.8 3.63 1 1 408 1 . . . . . . 1.8 3.63 1 1 409 1 . . . . . . 1.8 5.5 1 1 410 1 . . . . . . 1.8 5.5 1 1 411 1 . . . . . . 1.8 6.6 1 1 412 1 . . . . . . 1.8 5.5 1 1 413 1 . . . . . . 1.8 4.4 1 1 414 1 . . . . . . 1.8 4.26 1 1 415 1 . . . . . . 1.8 4.4 1 1 416 1 . . . . . . 1.8 5.39 1 1 417 1 . . . . . . 1.8 7.7 1 1 418 1 . . . . . . 1.8 5.5 1 1 419 1 . . . . . . 1.8 5.16 1 1 420 1 . . . . . . 1.8 5.5 1 1 421 1 . . . . . . 1.8 5.5 1 1 422 1 . . . . . . 1.8 7.7 1 1 423 1 . . . . . . 1.8 2.75 1 1 424 1 . . . . . . 1.8 6.6 1 1 425 1 . . . . . . 1.8 2.97 1 1 426 1 . . . . . . 1.8 5.5 1 1 427 1 . . . . . . 1.8 6.05 1 1 428 1 . . . . . . 1.8 3.74 1 1 429 1 . . . . . . 1.8 2.97 1 1 430 1 . . . . . . 1.8 3.41 1 1 431 1 . . . . . . 1.8 6.05 1 1 432 1 . . . . . . 1.8 6.82 1 1 433 1 . . . . . . 1.8 5.5 1 1 434 1 . . . . . . 1.8 3.63 1 1 435 1 . . . . . . 1.8 5.5 1 1 436 1 . . . . . . 1.8 4.29 1 1 437 1 . . . . . . 1.8 6.16 1 1 438 1 . . . . . . 1.8 5.61 1 1 439 1 . . . . . . 1.8 2.75 1 1 440 1 . . . . . . 1.8 6.38 1 1 441 1 . . . . . . 1.8 4.4 1 1 442 1 . . . . . . 1.8 6.6 1 1 443 1 . . . . . . 1.8 6.6 1 1 444 1 . . . . . . 1.8 6.6 1 1 445 1 . . . . . . 1.8 8.8 1 1 446 1 . . . . . . 1.8 8.8 1 1 447 1 . . . . . . 1.8 8.8 1 1 448 1 . . . . . . 1.8 2.0 1 1 449 1 . . . . . . 1.8 3.0 1 1 450 1 . . . . . . 1.8 3.41 1 1 451 1 . . . . . . 1.8 3.08 1 1 452 1 . . . . . . 1.8 3.41 1 1 453 1 . . . . . . 1.8 5.5 1 1 454 1 . . . . . . 1.8 2.64 1 1 455 1 . . . . . . 1.8 5.5 1 1 456 1 . . . . . . 1.8 3.96 1 1 457 1 . . . . . . 1.8 7.26 1 1 458 1 . . . . . . 1.8 4.07 1 1 459 1 . . . . . . 1.8 5.06 1 1 460 1 . . . . . . 1.8 4.29 1 1 461 1 . . . . . . 1.8 3.75 1 1 462 1 . . . . . . 1.8 3.96 1 1 463 1 . . . . . . 1.8 3.96 1 1 464 1 . . . . . . 1.8 3.41 1 1 465 1 . . . . . . 1.8 5.5 1 1 466 1 . . . . . . 1.8 5.5 1 1 467 1 . . . . . . 1.8 4.18 1 1 468 1 . . . . . . 1.8 5.5 1 1 469 1 . . . . . . 1.8 3.96 1 1 470 1 . . . . . . 1.8 5.83 1 1 471 1 . . . . . . 1.8 2.86 1 1 472 1 . . . . . . 1.8 4.73 1 1 473 1 . . . . . . 1.8 2.86 1 1 474 1 . . . . . . 1.8 3.85 1 1 475 1 . . . . . . 1.8 4.18 1 1 476 1 . . . . . . 1.8 3.08 1 1 477 1 . . . . . . 1.8 3.3 1 1 478 1 . . . . . . 1.8 3.63 1 1 479 1 . . . . . . 1.8 5.83 1 1 480 1 . . . . . . 1.8 3.3 1 1 481 1 . . . . . . 1.8 5.5 1 1 482 1 . . . . . . 1.8 5.94 1 1 483 1 . . . . . . 1.8 5.5 1 1 484 1 . . . . . . 1.8 5.5 1 1 485 1 . . . . . . 1.8 3.74 1 1 486 1 . . . . . . 1.8 7.7 1 1 487 1 . . . . . . 1.8 2.0 1 1 488 1 . . . . . . 1.8 3.0 1 1 489 1 . . . . . . 1.8 2.97 1 1 490 1 . . . . . . 1.8 2.97 1 1 491 1 . . . . . . 1.8 5.5 1 1 492 1 . . . . . . 1.8 4.29 1 1 493 1 . . . . . . 1.8 4.29 1 1 494 1 . . . . . . 1.8 3.74 1 1 495 1 . . . . . . 1.8 2.97 1 1 496 1 . . . . . . 1.8 3.19 1 1 497 1 . . . . . . 1.8 2.97 1 1 498 1 . . . . . . 1.8 2.64 1 1 499 1 . . . . . . 1.8 2.64 1 1 500 1 . . . . . . 1.8 4.73 1 1 501 1 . . . . . . 1.8 5.5 1 1 502 1 . . . . . . 1.8 3.85 1 1 503 1 . . . . . . 1.8 5.5 1 1 504 1 . . . . . . 1.8 2.97 1 1 505 1 . . . . . . 1.8 4.18 1 1 506 1 . . . . . . 1.8 4.62 1 1 507 1 . . . . . . 1.8 4.95 1 1 508 1 . . . . . . 1.8 4.07 1 1 509 1 . . . . . . 1.8 5.5 1 1 510 1 . . . . . . 1.8 5.5 1 1 511 1 . . . . . . 1.8 4.29 1 1 512 1 . . . . . . 1.8 5.5 1 1 513 1 . . . . . . 1.8 5.5 1 1 514 1 . . . . . . 1.8 4.4 1 1 515 1 . . . . . . 1.8 5.28 1 1 516 1 . . . . . . 1.8 5.5 1 1 517 1 . . . . . . 1.8 4.07 1 1 518 1 . . . . . . 1.8 6.6 1 1 519 1 . . . . . . 1.8 6.05 1 1 520 1 . . . . . . 1.8 4.95 1 1 521 1 . . . . . . 1.8 6.05 1 1 522 1 . . . . . . 1.8 4.73 1 1 523 1 . . . . . . 1.8 6.6 1 1 524 1 . . . . . . 1.8 4.95 1 1 525 1 . . . . . . 1.8 3.74 1 1 526 1 . . . . . . 1.8 3.96 1 1 527 1 . . . . . . 1.8 3.52 1 1 528 1 . . . . . . 1.8 4.51 1 1 529 1 . . . . . . 1.8 5.5 1 1 530 1 . . . . . . 1.8 4.4 1 1 531 1 . . . . . . 1.8 3.96 1 1 532 1 . . . . . . 1.8 3.85 1 1 533 1 . . . . . . 1.8 5.5 1 1 534 1 . . . . . . 1.8 4.29 1 1 535 1 . . . . . . 1.8 3.96 1 1 536 1 . . . . . . 1.8 4.18 1 1 537 1 . . . . . . 1.8 3.41 1 1 538 1 . . . . . . 1.8 5.28 1 1 539 1 . . . . . . 1.8 3.74 1 1 540 1 . . . . . . 1.8 3.52 1 1 541 1 . . . . . . 1.8 3.74 1 1 542 1 . . . . . . 1.8 4.73 1 1 543 1 . . . . . . 1.8 5.5 1 1 544 1 . . . . . . 1.8 3.63 1 1 545 1 . . . . . . 1.8 4.95 1 1 546 1 . . . . . . 1.8 3.63 1 1 547 1 . . . . . . 1.8 3.74 1 1 548 1 . . . . . . 1.8 5.5 1 1 549 1 . . . . . . 1.8 5.5 1 1 550 1 . . . . . . 1.8 4.51 1 1 551 1 . . . . . . 1.8 4.62 1 1 552 1 . . . . . . 1.8 3.58 1 1 553 1 . . . . . . 1.8 4.51 1 1 554 1 . . . . . . 1.8 5.5 1 1 555 1 . . . . . . 1.8 3.41 1 1 556 1 . . . . . . 1.8 2.0 1 1 557 1 . . . . . . 1.8 3.74 1 1 558 1 . . . . . . 1.8 3.68 1 1 559 1 . . . . . . 1.8 2.75 1 1 560 1 . . . . . . 1.8 5.5 1 1 561 1 . . . . . . 1.8 5.61 1 1 562 1 . . . . . . 1.8 8.58 1 1 563 1 . . . . . . 1.8 6.82 1 1 564 1 . . . . . . 1.8 6.38 1 1 565 1 . . . . . . 1.8 3.0 1 1 566 1 . . . . . . 1.8 2.64 1 1 567 1 . . . . . . 1.8 5.5 1 1 568 1 . . . . . . 1.8 5.5 1 1 569 1 . . . . . . 1.8 3.08 1 1 570 1 . . . . . . 1.8 5.5 1 1 571 1 . . . . . . 1.8 2.86 1 1 572 1 . . . . . . 1.8 5.39 1 1 573 1 . . . . . . 1.8 4.51 1 1 574 1 . . . . . . 1.8 4.29 1 1 575 1 . . . . . . 1.8 5.39 1 1 576 1 . . . . . . 1.8 7.48 1 1 577 1 . . . . . . 1.8 6.38 1 1 578 1 . . . . . . 1.8 2.64 1 1 579 1 . . . . . . 1.8 3.52 1 1 580 1 . . . . . . 1.8 3.3 1 1 581 1 . . . . . . 1.8 3.52 1 1 582 1 . . . . . . 1.8 3.08 1 1 583 1 . . . . . . 1.8 3.52 1 1 584 1 . . . . . . 1.8 5.5 1 1 585 1 . . . . . . 1.8 5.28 1 1 586 1 . . . . . . 1.8 5.05 1 1 587 1 . . . . . . 1.8 5.83 1 1 588 1 . . . . . . 1.8 5.5 1 1 589 1 . . . . . . 1.8 5.5 1 1 590 1 . . . . . . 1.8 3.63 1 1 591 1 . . . . . . 1.8 3.2 1 1 592 1 . . . . . . 1.8 3.63 1 1 593 1 . . . . . . 1.8 5.5 1 1 594 1 . . . . . . 1.8 2.97 1 1 595 1 . . . . . . 1.8 2.97 1 1 596 1 . . . . . . 1.8 4.4 1 1 597 1 . . . . . . 1.8 3.52 1 1 598 1 . . . . . . 1.8 4.4 1 1 599 1 . . . . . . 1.8 4.95 1 1 600 1 . . . . . . 1.8 4.62 1 1 601 1 . . . . . . 1.8 4.4 1 1 602 1 . . . . . . 1.8 2.86 1 1 603 1 . . . . . . 1.8 3.3 1 1 604 1 . . . . . . 1.8 4.62 1 1 605 1 . . . . . . 1.8 3.63 1 1 606 1 . . . . . . 1.8 3.19 1 1 607 1 . . . . . . 1.8 3.74 1 1 608 1 . . . . . . 1.8 3.96 1 1 609 1 . . . . . . 1.8 5.5 1 1 610 1 . . . . . . 1.8 4.4 1 1 611 1 . . . . . . 1.8 5.06 1 1 612 1 . . . . . . 1.8 3.63 1 1 613 1 . . . . . . 1.8 3.52 1 1 614 1 . . . . . . 1.8 4.73 1 1 615 1 . . . . . . 1.8 3.41 1 1 616 1 . . . . . . 1.8 3.52 1 1 617 1 . . . . . . 1.8 5.5 1 1 618 1 . . . . . . 1.8 4.73 1 1 619 1 . . . . . . 1.8 7.7 1 1 620 1 . . . . . . 1.8 6.6 1 1 621 1 . . . . . . 1.8 6.6 1 1 622 1 . . . . . . 1.8 8.58 1 1 623 1 . . . . . . 1.8 5.5 1 1 624 1 . . . . . . 1.8 5.5 1 1 625 1 . . . . . . 1.8 7.7 1 1 626 1 . . . . . . 1.8 7.48 1 1 627 1 . . . . . . 1.8 4.4 1 1 628 1 . . . . . . 1.8 2.97 1 1 629 1 . . . . . . 1.8 6.6 1 1 630 1 . . . . . . 1.8 9.9 1 1 631 1 . . . . . . 1.8 6.6 1 1 632 1 . . . . . . 1.8 9.9 1 1 633 1 . . . . . . 1.8 3.52 1 1 634 1 . . . . . . 1.8 7.7 1 1 635 1 . . . . . . 1.8 2.86 1 1 636 1 . . . . . . 1.8 7.7 1 1 637 1 . . . . . . 1.8 4.07 1 1 638 1 . . . . . . 1.8 7.7 1 1 639 1 . . . . . . 1.8 3.3 1 1 640 1 . . . . . . 1.8 3.08 1 1 641 1 . . . . . . 1.8 3.63 1 1 642 1 . . . . . . 1.8 6.93 1 1 643 1 . . . . . . 1.8 6.93 1 1 644 1 . . . . . . 1.8 7.7 1 1 645 1 . . . . . . 1.8 5.94 1 1 646 1 . . . . . . 1.8 6.93 1 1 647 1 . . . . . . 1.8 2.75 1 1 648 1 . . . . . . 1.8 7.7 1 1 649 1 . . . . . . 1.8 3.74 1 1 650 1 . . . . . . 1.8 5.28 1 1 651 1 . . . . . . 1.8 3.41 1 1 652 1 . . . . . . 1.8 5.61 1 1 653 1 . . . . . . 1.8 6.82 1 1 654 1 . . . . . . 1.8 5.61 1 1 655 1 . . . . . . 1.8 3.71 1 1 656 1 . . . . . . 1.8 6.16 1 1 657 1 . . . . . . 1.8 6.82 1 1 658 1 . . . . . . 1.8 2.97 1 1 659 1 . . . . . . 1.8 6.6 1 1 660 1 . . . . . . 1.8 6.6 1 1 661 1 . . . . . . 1.8 6.16 1 1 662 1 . . . . . . 1.8 2.75 1 1 663 1 . . . . . . 1.8 3.3 1 1 664 1 . . . . . . 1.8 5.5 1 1 665 1 . . . . . . 1.8 4.29 1 1 666 1 . . . . . . 1.8 3.19 1 1 667 1 . . . . . . 1.8 4.51 1 1 668 1 . . . . . . 1.8 3.08 1 1 669 1 . . . . . . 1.8 3.3 1 1 670 1 . . . . . . 1.8 2.97 1 1 671 1 . . . . . . 1.8 2.75 1 1 672 1 . . . . . . 1.8 2.86 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 LEU C C -9.141 -4.674 9.437 1.00 . A A . 1 LEU C 1 1 1 2 1 1 1 LEU CA C -10.061 -5.183 10.552 1.00 . A A . 1 LEU CA 1 1 1 3 1 1 1 LEU CB C -10.706 -6.526 10.167 1.00 . A A . 1 LEU CB 1 1 1 4 1 1 1 LEU CD1 C -10.596 -9.022 10.108 1.00 . A A . 1 LEU CD1 1 1 1 5 1 1 1 LEU CD2 C -8.445 -7.755 10.106 1.00 . A A . 1 LEU CD2 1 1 1 6 1 1 1 LEU CG C -9.893 -7.757 10.610 1.00 . A A . 1 LEU CG 1 1 1 7 1 1 1 LEU H1 H -11.640 -3.982 9.987 1.00 . A A . 1 LEU H1 1 1 1 8 1 1 1 LEU H2 H -11.709 -4.498 11.586 1.00 . A A . 1 LEU H2 1 1 1 9 1 1 1 LEU H3 H -10.629 -3.289 11.138 1.00 . A A . 1 LEU H3 1 1 1 10 1 1 1 LEU HA H -9.495 -5.328 11.475 1.00 . A A . 1 LEU HA 1 1 1 11 1 1 1 LEU HB2 H -11.676 -6.603 10.659 1.00 . A A . 1 LEU HB2 1 1 1 12 1 1 1 LEU HB3 H -10.874 -6.563 9.091 1.00 . A A . 1 LEU HB3 1 1 1 13 1 1 1 LEU HD11 H -11.622 -9.051 10.479 1.00 . A A . 1 LEU HD11 1 1 1 14 1 1 1 LEU HD12 H -10.612 -9.034 9.017 1.00 . A A . 1 LEU HD12 1 1 1 15 1 1 1 LEU HD13 H -10.070 -9.908 10.465 1.00 . A A . 1 LEU HD13 1 1 1 16 1 1 1 LEU HD21 H -8.414 -7.606 9.028 1.00 . A A . 1 LEU HD21 1 1 1 17 1 1 1 LEU HD22 H -7.868 -6.976 10.602 1.00 . A A . 1 LEU HD22 1 1 1 18 1 1 1 LEU HD23 H -7.976 -8.713 10.339 1.00 . A A . 1 LEU HD23 1 1 1 19 1 1 1 LEU HG H -9.873 -7.792 11.700 1.00 . A A . 1 LEU HG 1 1 1 20 1 1 1 LEU N N -11.087 -4.162 10.838 1.00 . A A . 1 LEU N 1 1 1 21 1 1 1 LEU O O -9.611 -4.409 8.338 1.00 . A A . 1 LEU O 1 1 1 22 1 1 2 CYS C C -6.446 -4.704 7.739 1.00 . A A . 2 CYS C 1 1 1 23 1 1 2 CYS CA C -6.933 -3.762 8.843 1.00 . A A . 2 CYS CA 1 1 1 24 1 1 2 CYS CB C -5.810 -3.111 9.673 1.00 . A A . 2 CYS CB 1 1 1 25 1 1 2 CYS H H -7.529 -4.635 10.658 1.00 . A A . 2 CYS H 1 1 1 26 1 1 2 CYS HA H -7.454 -2.946 8.349 1.00 . A A . 2 CYS HA 1 1 1 27 1 1 2 CYS HB2 H -5.063 -3.870 9.912 1.00 . A A . 2 CYS HB2 1 1 1 28 1 1 2 CYS HB3 H -5.331 -2.330 9.091 1.00 . A A . 2 CYS HB3 1 1 1 29 1 1 2 CYS N N -7.864 -4.442 9.730 1.00 . A A . 2 CYS N 1 1 1 30 1 1 2 CYS O O -5.340 -5.234 7.808 1.00 . A A . 2 CYS O 1 1 1 31 1 1 2 CYS SG S -6.324 -2.413 11.272 1.00 . A A . 2 CYS SG 1 1 1 32 1 1 3 ASN C C -5.828 -5.342 4.758 1.00 . A A . 3 ASN C 1 1 1 33 1 1 3 ASN CA C -6.950 -5.865 5.646 1.00 . A A . 3 ASN CA 1 1 1 34 1 1 3 ASN CB C -8.153 -6.279 4.778 1.00 . A A . 3 ASN CB 1 1 1 35 1 1 3 ASN CG C -9.408 -6.663 5.560 1.00 . A A . 3 ASN CG 1 1 1 36 1 1 3 ASN H H -8.177 -4.452 6.726 1.00 . A A . 3 ASN H 1 1 1 37 1 1 3 ASN HA H -6.620 -6.781 6.140 1.00 . A A . 3 ASN HA 1 1 1 38 1 1 3 ASN HB2 H -8.408 -5.442 4.123 1.00 . A A . 3 ASN HB2 1 1 1 39 1 1 3 ASN HB3 H -7.857 -7.114 4.137 1.00 . A A . 3 ASN HB3 1 1 1 40 1 1 3 ASN HD21 H -10.586 -6.497 3.899 1.00 . A A . 3 ASN HD21 1 1 1 41 1 1 3 ASN HD22 H -11.387 -6.997 5.376 1.00 . A A . 3 ASN HD22 1 1 1 42 1 1 3 ASN N N -7.264 -4.897 6.697 1.00 . A A . 3 ASN N 1 1 1 43 1 1 3 ASN ND2 N -10.556 -6.687 4.890 1.00 . A A . 3 ASN ND2 1 1 1 44 1 1 3 ASN O O -6.033 -4.425 3.963 1.00 . A A . 3 ASN O 1 1 1 45 1 1 3 ASN OD1 O -9.363 -6.939 6.751 1.00 . A A . 3 ASN OD1 1 1 1 46 1 1 4 GLU C C -3.553 -6.140 2.758 1.00 . A A . 4 GLU C 1 1 1 47 1 1 4 GLU CA C -3.431 -5.662 4.210 1.00 . A A . 4 GLU CA 1 1 1 48 1 1 4 GLU CB C -2.312 -6.392 4.978 1.00 . A A . 4 GLU CB 1 1 1 49 1 1 4 GLU CD C -0.114 -7.242 3.922 1.00 . A A . 4 GLU CD 1 1 1 50 1 1 4 GLU CG C -0.945 -6.044 4.390 1.00 . A A . 4 GLU CG 1 1 1 51 1 1 4 GLU H H -4.566 -6.669 5.612 1.00 . A A . 4 GLU H 1 1 1 52 1 1 4 GLU HA H -3.257 -4.585 4.249 1.00 . A A . 4 GLU HA 1 1 1 53 1 1 4 GLU HB2 H -2.331 -6.062 6.018 1.00 . A A . 4 GLU HB2 1 1 1 54 1 1 4 GLU HB3 H -2.486 -7.470 4.970 1.00 . A A . 4 GLU HB3 1 1 1 55 1 1 4 GLU HG2 H -1.146 -5.359 3.576 1.00 . A A . 4 GLU HG2 1 1 1 56 1 1 4 GLU HG3 H -0.370 -5.521 5.149 1.00 . A A . 4 GLU HG3 1 1 1 57 1 1 4 GLU N N -4.658 -5.968 4.897 1.00 . A A . 4 GLU N 1 1 1 58 1 1 4 GLU O O -3.188 -7.272 2.443 1.00 . A A . 4 GLU O 1 1 1 59 1 1 4 GLU OE1 O -0.759 -8.236 3.249 1.00 . A A . 4 GLU OE1 1 1 1 60 1 1 4 GLU OE2 O 1.096 -7.256 4.165 1.00 . A A . 4 GLU OE2 1 1 1 61 1 1 5 ARG C C -3.109 -4.996 -0.346 1.00 . A A . 5 ARG C 1 1 1 62 1 1 5 ARG CA C -4.294 -5.527 0.472 1.00 . A A . 5 ARG CA 1 1 1 63 1 1 5 ARG CB C -5.602 -4.829 0.079 1.00 . A A . 5 ARG CB 1 1 1 64 1 1 5 ARG CD C -7.266 -4.322 -1.790 1.00 . A A . 5 ARG CD 1 1 1 65 1 1 5 ARG CG C -6.138 -5.234 -1.298 1.00 . A A . 5 ARG CG 1 1 1 66 1 1 5 ARG CZ C -9.479 -3.524 -0.977 1.00 . A A . 5 ARG CZ 1 1 1 67 1 1 5 ARG H H -4.162 -4.315 2.217 1.00 . A A . 5 ARG H 1 1 1 68 1 1 5 ARG HA H -4.428 -6.602 0.346 1.00 . A A . 5 ARG HA 1 1 1 69 1 1 5 ARG HB2 H -6.354 -5.089 0.822 1.00 . A A . 5 ARG HB2 1 1 1 70 1 1 5 ARG HB3 H -5.414 -3.759 0.090 1.00 . A A . 5 ARG HB3 1 1 1 71 1 1 5 ARG HD2 H -6.875 -3.304 -1.784 1.00 . A A . 5 ARG HD2 1 1 1 72 1 1 5 ARG HD3 H -7.517 -4.597 -2.816 1.00 . A A . 5 ARG HD3 1 1 1 73 1 1 5 ARG HG2 H -5.338 -5.125 -2.026 1.00 . A A . 5 ARG HG2 1 1 1 74 1 1 5 ARG HG3 H -6.478 -6.271 -1.263 1.00 . A A . 5 ARG HG3 1 1 1 75 1 1 5 ARG HH11 H -8.714 -2.449 -2.537 1.00 . A A . 5 ARG HH11 1 1 1 76 1 1 5 ARG HH12 H -10.180 -1.815 -1.862 1.00 . A A . 5 ARG HH12 1 1 1 77 1 1 5 ARG HH21 H -10.464 -4.326 0.628 1.00 . A A . 5 ARG HH21 1 1 1 78 1 1 5 ARG HH22 H -11.188 -2.903 -0.040 1.00 . A A . 5 ARG HH22 1 1 1 79 1 1 5 ARG N N -4.040 -5.266 1.883 1.00 . A A . 5 ARG N 1 1 1 80 1 1 5 ARG NE N -8.470 -4.413 -0.954 1.00 . A A . 5 ARG NE 1 1 1 81 1 1 5 ARG NH1 N -9.498 -2.555 -1.898 1.00 . A A . 5 ARG NH1 1 1 1 82 1 1 5 ARG NH2 N -10.464 -3.603 -0.075 1.00 . A A . 5 ARG NH2 1 1 1 83 1 1 5 ARG O O -2.571 -3.943 -0.007 1.00 . A A . 5 ARG O 1 1 1 84 1 1 6 PRO C C -1.677 -4.060 -2.973 1.00 . A A . 6 PRO C 1 1 1 85 1 1 6 PRO CA C -1.481 -5.344 -2.160 1.00 . A A . 6 PRO CA 1 1 1 86 1 1 6 PRO CB C -1.174 -6.562 -3.040 1.00 . A A . 6 PRO CB 1 1 1 87 1 1 6 PRO CD C -3.185 -6.994 -1.813 1.00 . A A . 6 PRO CD 1 1 1 88 1 1 6 PRO CG C -2.521 -7.274 -3.160 1.00 . A A . 6 PRO CG 1 1 1 89 1 1 6 PRO HA H -0.636 -5.174 -1.495 1.00 . A A . 6 PRO HA 1 1 1 90 1 1 6 PRO HB2 H -0.765 -6.297 -4.015 1.00 . A A . 6 PRO HB2 1 1 1 91 1 1 6 PRO HB3 H -0.477 -7.217 -2.513 1.00 . A A . 6 PRO HB3 1 1 1 92 1 1 6 PRO HD2 H -4.269 -6.989 -1.922 1.00 . A A . 6 PRO HD2 1 1 1 93 1 1 6 PRO HD3 H -2.906 -7.741 -1.070 1.00 . A A . 6 PRO HD3 1 1 1 94 1 1 6 PRO HG2 H -3.105 -6.802 -3.954 1.00 . A A . 6 PRO HG2 1 1 1 95 1 1 6 PRO HG3 H -2.414 -8.341 -3.358 1.00 . A A . 6 PRO HG3 1 1 1 96 1 1 6 PRO N N -2.660 -5.712 -1.386 1.00 . A A . 6 PRO N 1 1 1 97 1 1 6 PRO O O -2.775 -3.512 -3.058 1.00 . A A . 6 PRO O 1 1 1 98 1 1 7 SER C C -1.503 -2.403 -5.522 1.00 . A A . 7 SER C 1 1 1 99 1 1 7 SER CA C -0.492 -2.386 -4.373 1.00 . A A . 7 SER CA 1 1 1 100 1 1 7 SER CB C 0.934 -2.267 -4.911 1.00 . A A . 7 SER CB 1 1 1 101 1 1 7 SER H H 0.285 -4.107 -3.469 1.00 . A A . 7 SER H 1 1 1 102 1 1 7 SER HA H -0.661 -1.498 -3.763 1.00 . A A . 7 SER HA 1 1 1 103 1 1 7 SER HB2 H 0.898 -1.541 -5.719 1.00 . A A . 7 SER HB2 1 1 1 104 1 1 7 SER HB3 H 1.596 -1.896 -4.129 1.00 . A A . 7 SER HB3 1 1 1 105 1 1 7 SER HG H 0.724 -3.840 -5.995 1.00 . A A . 7 SER HG 1 1 1 106 1 1 7 SER N N -0.575 -3.590 -3.566 1.00 . A A . 7 SER N 1 1 1 107 1 1 7 SER O O -1.279 -3.094 -6.513 1.00 . A A . 7 SER O 1 1 1 108 1 1 7 SER OG O 1.408 -3.518 -5.384 1.00 . A A . 7 SER OG 1 1 1 109 1 1 8 GLN C C -3.024 -0.173 -7.304 1.00 . A A . 8 GLN C 1 1 1 110 1 1 8 GLN CA C -3.536 -1.332 -6.445 1.00 . A A . 8 GLN CA 1 1 1 111 1 1 8 GLN CB C -4.882 -0.935 -5.821 1.00 . A A . 8 GLN CB 1 1 1 112 1 1 8 GLN CD C -7.050 -1.665 -4.756 1.00 . A A . 8 GLN CD 1 1 1 113 1 1 8 GLN CG C -5.638 -2.095 -5.160 1.00 . A A . 8 GLN CG 1 1 1 114 1 1 8 GLN H H -2.686 -1.136 -4.513 1.00 . A A . 8 GLN H 1 1 1 115 1 1 8 GLN HA H -3.674 -2.208 -7.080 1.00 . A A . 8 GLN HA 1 1 1 116 1 1 8 GLN HB2 H -4.743 -0.146 -5.078 1.00 . A A . 8 GLN HB2 1 1 1 117 1 1 8 GLN HB3 H -5.488 -0.532 -6.630 1.00 . A A . 8 GLN HB3 1 1 1 118 1 1 8 GLN HE21 H -7.529 -1.160 -6.666 1.00 . A A . 8 GLN HE21 1 1 1 119 1 1 8 GLN HE22 H -8.752 -0.814 -5.459 1.00 . A A . 8 GLN HE22 1 1 1 120 1 1 8 GLN HG2 H -5.703 -2.928 -5.858 1.00 . A A . 8 GLN HG2 1 1 1 121 1 1 8 GLN HG3 H -5.091 -2.425 -4.275 1.00 . A A . 8 GLN HG3 1 1 1 122 1 1 8 GLN N N -2.575 -1.615 -5.390 1.00 . A A . 8 GLN N 1 1 1 123 1 1 8 GLN NE2 N -7.846 -1.192 -5.710 1.00 . A A . 8 GLN NE2 1 1 1 124 1 1 8 GLN O O -2.827 -0.304 -8.506 1.00 . A A . 8 GLN O 1 1 1 125 1 1 8 GLN OE1 O -7.434 -1.736 -3.590 1.00 . A A . 8 GLN OE1 1 1 1 126 1 1 9 THR C C -0.953 2.196 -7.555 1.00 . A A . 9 THR C 1 1 1 127 1 1 9 THR CA C -2.442 2.244 -7.250 1.00 . A A . 9 THR CA 1 1 1 128 1 1 9 THR CB C -2.684 3.311 -6.174 1.00 . A A . 9 THR CB 1 1 1 129 1 1 9 THR CG2 C -4.149 3.732 -6.154 1.00 . A A . 9 THR CG2 1 1 1 130 1 1 9 THR H H -2.998 1.031 -5.660 1.00 . A A . 9 THR H 1 1 1 131 1 1 9 THR HA H -3.000 2.464 -8.160 1.00 . A A . 9 THR HA 1 1 1 132 1 1 9 THR HB H -2.070 4.189 -6.383 1.00 . A A . 9 THR HB 1 1 1 133 1 1 9 THR HG1 H -2.363 3.419 -4.218 1.00 . A A . 9 THR HG1 1 1 1 134 1 1 9 THR HG21 H -4.433 4.119 -7.133 1.00 . A A . 9 THR HG21 1 1 1 135 1 1 9 THR HG22 H -4.782 2.882 -5.908 1.00 . A A . 9 THR HG22 1 1 1 136 1 1 9 THR HG23 H -4.275 4.510 -5.406 1.00 . A A . 9 THR HG23 1 1 1 137 1 1 9 THR N N -2.857 0.984 -6.660 1.00 . A A . 9 THR N 1 1 1 138 1 1 9 THR O O -0.500 2.523 -8.649 1.00 . A A . 9 THR O 1 1 1 139 1 1 9 THR OG1 O -2.343 2.744 -4.912 1.00 . A A . 9 THR OG1 1 1 1 140 1 1 10 TRP C C 1.707 0.727 -7.537 1.00 . A A . 10 TRP C 1 1 1 141 1 1 10 TRP CA C 1.250 1.816 -6.561 1.00 . A A . 10 TRP CA 1 1 1 142 1 1 10 TRP CB C 1.758 1.569 -5.140 1.00 . A A . 10 TRP CB 1 1 1 143 1 1 10 TRP CD1 C 4.270 1.284 -5.239 1.00 . A A . 10 TRP CD1 1 1 1 144 1 1 10 TRP CD2 C 3.651 3.220 -4.289 1.00 . A A . 10 TRP CD2 1 1 1 145 1 1 10 TRP CE2 C 5.070 3.255 -4.409 1.00 . A A . 10 TRP CE2 1 1 1 146 1 1 10 TRP CE3 C 3.029 4.311 -3.644 1.00 . A A . 10 TRP CE3 1 1 1 147 1 1 10 TRP CG C 3.171 1.990 -4.901 1.00 . A A . 10 TRP CG 1 1 1 148 1 1 10 TRP CH2 C 5.151 5.472 -3.440 1.00 . A A . 10 TRP CH2 1 1 1 149 1 1 10 TRP CZ2 C 5.821 4.361 -3.983 1.00 . A A . 10 TRP CZ2 1 1 1 150 1 1 10 TRP CZ3 C 3.765 5.438 -3.235 1.00 . A A . 10 TRP CZ3 1 1 1 151 1 1 10 TRP H H -0.676 1.688 -5.643 1.00 . A A . 10 TRP H 1 1 1 152 1 1 10 TRP HA H 1.604 2.791 -6.901 1.00 . A A . 10 TRP HA 1 1 1 153 1 1 10 TRP HB2 H 1.141 2.139 -4.444 1.00 . A A . 10 TRP HB2 1 1 1 154 1 1 10 TRP HB3 H 1.644 0.512 -4.913 1.00 . A A . 10 TRP HB3 1 1 1 155 1 1 10 TRP HD1 H 4.240 0.307 -5.700 1.00 . A A . 10 TRP HD1 1 1 1 156 1 1 10 TRP HE1 H 6.346 1.776 -5.235 1.00 . A A . 10 TRP HE1 1 1 1 157 1 1 10 TRP HE3 H 1.975 4.268 -3.454 1.00 . A A . 10 TRP HE3 1 1 1 158 1 1 10 TRP HH2 H 5.671 6.375 -3.195 1.00 . A A . 10 TRP HH2 1 1 1 159 1 1 10 TRP HZ2 H 6.894 4.374 -4.108 1.00 . A A . 10 TRP HZ2 1 1 1 160 1 1 10 TRP HZ3 H 3.280 6.291 -2.776 1.00 . A A . 10 TRP HZ3 1 1 1 161 1 1 10 TRP N N -0.194 1.859 -6.517 1.00 . A A . 10 TRP N 1 1 1 162 1 1 10 TRP NE1 N 5.396 2.043 -4.993 1.00 . A A . 10 TRP NE1 1 1 1 163 1 1 10 TRP O O 1.016 -0.269 -7.731 1.00 . A A . 10 TRP O 1 1 1 164 1 1 11 SER C C 4.300 -1.032 -8.555 1.00 . A A . 11 SER C 1 1 1 165 1 1 11 SER CA C 3.413 0.057 -9.180 1.00 . A A . 11 SER CA 1 1 1 166 1 1 11 SER CB C 4.097 0.924 -10.245 1.00 . A A . 11 SER CB 1 1 1 167 1 1 11 SER H H 3.408 1.754 -7.935 1.00 . A A . 11 SER H 1 1 1 168 1 1 11 SER HA H 2.589 -0.455 -9.681 1.00 . A A . 11 SER HA 1 1 1 169 1 1 11 SER HB2 H 4.386 0.313 -11.102 1.00 . A A . 11 SER HB2 1 1 1 170 1 1 11 SER HB3 H 3.386 1.676 -10.597 1.00 . A A . 11 SER HB3 1 1 1 171 1 1 11 SER HG H 5.546 2.237 -10.299 1.00 . A A . 11 SER HG 1 1 1 172 1 1 11 SER N N 2.870 0.926 -8.152 1.00 . A A . 11 SER N 1 1 1 173 1 1 11 SER O O 3.888 -1.754 -7.640 1.00 . A A . 11 SER O 1 1 1 174 1 1 11 SER OG O 5.226 1.567 -9.685 1.00 . A A . 11 SER OG 1 1 1 175 1 1 12 GLY C C 6.928 -2.022 -7.290 1.00 . A A . 12 GLY C 1 1 1 176 1 1 12 GLY CA C 6.462 -2.218 -8.724 1.00 . A A . 12 GLY CA 1 1 1 177 1 1 12 GLY H H 5.800 -0.494 -9.764 1.00 . A A . 12 GLY H 1 1 1 178 1 1 12 GLY HA2 H 6.053 -3.210 -8.802 1.00 . A A . 12 GLY HA2 1 1 1 179 1 1 12 GLY HA3 H 7.314 -2.162 -9.404 1.00 . A A . 12 GLY HA3 1 1 1 180 1 1 12 GLY N N 5.495 -1.214 -9.121 1.00 . A A . 12 GLY N 1 1 1 181 1 1 12 GLY O O 6.325 -2.531 -6.343 1.00 . A A . 12 GLY O 1 1 1 182 1 1 13 ASN C C 8.385 0.061 -5.149 1.00 . A A . 13 ASN C 1 1 1 183 1 1 13 ASN CA C 8.795 -1.200 -5.925 1.00 . A A . 13 ASN CA 1 1 1 184 1 1 13 ASN CB C 10.303 -1.260 -6.188 1.00 . A A . 13 ASN CB 1 1 1 185 1 1 13 ASN CG C 11.031 -1.675 -4.913 1.00 . A A . 13 ASN CG 1 1 1 186 1 1 13 ASN H H 8.433 -0.980 -8.031 1.00 . A A . 13 ASN H 1 1 1 187 1 1 13 ASN HA H 8.570 -2.084 -5.335 1.00 . A A . 13 ASN HA 1 1 1 188 1 1 13 ASN HB2 H 10.507 -2.019 -6.942 1.00 . A A . 13 ASN HB2 1 1 1 189 1 1 13 ASN HB3 H 10.662 -0.299 -6.557 1.00 . A A . 13 ASN HB3 1 1 1 190 1 1 13 ASN HD21 H 11.546 0.249 -4.467 1.00 . A A . 13 ASN HD21 1 1 1 191 1 1 13 ASN HD22 H 12.013 -0.954 -3.295 1.00 . A A . 13 ASN HD22 1 1 1 192 1 1 13 ASN N N 8.055 -1.335 -7.170 1.00 . A A . 13 ASN N 1 1 1 193 1 1 13 ASN ND2 N 11.595 -0.717 -4.184 1.00 . A A . 13 ASN ND2 1 1 1 194 1 1 13 ASN O O 7.926 1.037 -5.740 1.00 . A A . 13 ASN O 1 1 1 195 1 1 13 ASN OD1 O 11.043 -2.854 -4.562 1.00 . A A . 13 ASN OD1 1 1 1 196 1 1 14 CYS C C 9.261 1.429 -1.986 1.00 . A A . 14 CYS C 1 1 1 197 1 1 14 CYS CA C 8.079 1.030 -2.862 1.00 . A A . 14 CYS CA 1 1 1 198 1 1 14 CYS CB C 6.955 0.425 -2.012 1.00 . A A . 14 CYS CB 1 1 1 199 1 1 14 CYS H H 8.817 -0.853 -3.423 1.00 . A A . 14 CYS H 1 1 1 200 1 1 14 CYS HA H 7.702 1.910 -3.381 1.00 . A A . 14 CYS HA 1 1 1 201 1 1 14 CYS HB2 H 6.229 -0.006 -2.701 1.00 . A A . 14 CYS HB2 1 1 1 202 1 1 14 CYS HB3 H 7.347 -0.372 -1.383 1.00 . A A . 14 CYS HB3 1 1 1 203 1 1 14 CYS N N 8.529 0.029 -3.824 1.00 . A A . 14 CYS N 1 1 1 204 1 1 14 CYS O O 10.174 0.633 -1.778 1.00 . A A . 14 CYS O 1 1 1 205 1 1 14 CYS SG S 6.003 1.538 -0.953 1.00 . A A . 14 CYS SG 1 1 1 206 1 1 15 GLY C C 9.727 4.336 0.205 1.00 . A A . 15 GLY C 1 1 1 207 1 1 15 GLY CA C 10.294 3.189 -0.619 1.00 . A A . 15 GLY CA 1 1 1 208 1 1 15 GLY H H 8.432 3.232 -1.656 1.00 . A A . 15 GLY H 1 1 1 209 1 1 15 GLY HA2 H 10.643 2.413 0.061 1.00 . A A . 15 GLY HA2 1 1 1 210 1 1 15 GLY HA3 H 11.130 3.545 -1.219 1.00 . A A . 15 GLY HA3 1 1 1 211 1 1 15 GLY N N 9.250 2.665 -1.488 1.00 . A A . 15 GLY N 1 1 1 212 1 1 15 GLY O O 9.785 4.337 1.433 1.00 . A A . 15 GLY O 1 1 1 213 1 1 16 ASN C C 7.108 5.920 0.780 1.00 . A A . 16 ASN C 1 1 1 214 1 1 16 ASN CA C 8.413 6.402 0.147 1.00 . A A . 16 ASN CA 1 1 1 215 1 1 16 ASN CB C 8.193 7.532 -0.866 1.00 . A A . 16 ASN CB 1 1 1 216 1 1 16 ASN CG C 7.782 8.824 -0.170 1.00 . A A . 16 ASN CG 1 1 1 217 1 1 16 ASN H H 9.104 5.220 -1.492 1.00 . A A . 16 ASN H 1 1 1 218 1 1 16 ASN HA H 9.058 6.795 0.935 1.00 . A A . 16 ASN HA 1 1 1 219 1 1 16 ASN HB2 H 9.135 7.721 -1.382 1.00 . A A . 16 ASN HB2 1 1 1 220 1 1 16 ASN HB3 H 7.438 7.259 -1.601 1.00 . A A . 16 ASN HB3 1 1 1 221 1 1 16 ASN HD21 H 8.573 9.970 -1.660 1.00 . A A . 16 ASN HD21 1 1 1 222 1 1 16 ASN HD22 H 7.821 10.828 -0.332 1.00 . A A . 16 ASN HD22 1 1 1 223 1 1 16 ASN N N 9.097 5.285 -0.487 1.00 . A A . 16 ASN N 1 1 1 224 1 1 16 ASN ND2 N 8.065 9.963 -0.789 1.00 . A A . 16 ASN ND2 1 1 1 225 1 1 16 ASN O O 6.015 6.151 0.262 1.00 . A A . 16 ASN O 1 1 1 226 1 1 16 ASN OD1 O 7.190 8.801 0.903 1.00 . A A . 16 ASN OD1 1 1 1 227 1 1 17 THR C C 5.145 5.766 3.106 1.00 . A A . 17 THR C 1 1 1 228 1 1 17 THR CA C 6.105 4.670 2.631 1.00 . A A . 17 THR CA 1 1 1 229 1 1 17 THR CB C 6.578 3.725 3.747 1.00 . A A . 17 THR CB 1 1 1 230 1 1 17 THR CG2 C 7.186 4.453 4.947 1.00 . A A . 17 THR CG2 1 1 1 231 1 1 17 THR H H 8.180 5.002 2.218 1.00 . A A . 17 THR H 1 1 1 232 1 1 17 THR HA H 5.587 4.048 1.908 1.00 . A A . 17 THR HA 1 1 1 233 1 1 17 THR HB H 7.344 3.073 3.326 1.00 . A A . 17 THR HB 1 1 1 234 1 1 17 THR HG1 H 4.828 3.448 4.549 1.00 . A A . 17 THR HG1 1 1 1 235 1 1 17 THR HG21 H 8.015 5.083 4.624 1.00 . A A . 17 THR HG21 1 1 1 236 1 1 17 THR HG22 H 6.438 5.068 5.449 1.00 . A A . 17 THR HG22 1 1 1 237 1 1 17 THR HG23 H 7.565 3.718 5.658 1.00 . A A . 17 THR HG23 1 1 1 238 1 1 17 THR N N 7.237 5.239 1.919 1.00 . A A . 17 THR N 1 1 1 239 1 1 17 THR O O 3.942 5.534 3.210 1.00 . A A . 17 THR O 1 1 1 240 1 1 17 THR OG1 O 5.515 2.890 4.167 1.00 . A A . 17 THR OG1 1 1 1 241 1 1 18 ALA C C 3.880 8.388 2.467 1.00 . A A . 18 ALA C 1 1 1 242 1 1 18 ALA CA C 4.803 8.120 3.657 1.00 . A A . 18 ALA CA 1 1 1 243 1 1 18 ALA CB C 5.655 9.342 4.004 1.00 . A A . 18 ALA CB 1 1 1 244 1 1 18 ALA H H 6.646 7.126 3.262 1.00 . A A . 18 ALA H 1 1 1 245 1 1 18 ALA HA H 4.177 7.884 4.519 1.00 . A A . 18 ALA HA 1 1 1 246 1 1 18 ALA HB1 H 6.281 9.121 4.871 1.00 . A A . 18 ALA HB1 1 1 1 247 1 1 18 ALA HB2 H 6.292 9.621 3.166 1.00 . A A . 18 ALA HB2 1 1 1 248 1 1 18 ALA HB3 H 5.003 10.183 4.246 1.00 . A A . 18 ALA HB3 1 1 1 249 1 1 18 ALA N N 5.652 6.975 3.369 1.00 . A A . 18 ALA N 1 1 1 250 1 1 18 ALA O O 2.674 8.562 2.644 1.00 . A A . 18 ALA O 1 1 1 251 1 1 19 HIS C C 2.619 7.336 -0.017 1.00 . A A . 19 HIS C 1 1 1 252 1 1 19 HIS CA C 3.576 8.519 0.070 1.00 . A A . 19 HIS CA 1 1 1 253 1 1 19 HIS CB C 4.364 8.643 -1.237 1.00 . A A . 19 HIS CB 1 1 1 254 1 1 19 HIS CD2 C 2.240 9.628 -2.398 1.00 . A A . 19 HIS CD2 1 1 1 255 1 1 19 HIS CE1 C 2.949 9.529 -4.463 1.00 . A A . 19 HIS CE1 1 1 1 256 1 1 19 HIS CG C 3.510 9.103 -2.396 1.00 . A A . 19 HIS CG 1 1 1 257 1 1 19 HIS H H 5.419 8.227 1.136 1.00 . A A . 19 HIS H 1 1 1 258 1 1 19 HIS HA H 3.003 9.436 0.213 1.00 . A A . 19 HIS HA 1 1 1 259 1 1 19 HIS HB2 H 5.159 9.366 -1.119 1.00 . A A . 19 HIS HB2 1 1 1 260 1 1 19 HIS HB3 H 4.822 7.684 -1.470 1.00 . A A . 19 HIS HB3 1 1 1 261 1 1 19 HIS HD1 H 4.837 8.695 -4.048 1.00 . A A . 19 HIS HD1 1 1 1 262 1 1 19 HIS HD2 H 1.610 9.800 -1.528 1.00 . A A . 19 HIS HD2 1 1 1 263 1 1 19 HIS HE1 H 2.977 9.602 -5.543 1.00 . A A . 19 HIS HE1 1 1 1 264 1 1 19 HIS N N 4.420 8.383 1.244 1.00 . A A . 19 HIS N 1 1 1 265 1 1 19 HIS ND1 N 3.950 9.046 -3.711 1.00 . A A . 19 HIS ND1 1 1 1 266 1 1 19 HIS NE2 N 1.894 9.885 -3.710 1.00 . A A . 19 HIS NE2 1 1 1 267 1 1 19 HIS O O 1.419 7.556 -0.145 1.00 . A A . 19 HIS O 1 1 1 268 1 1 20 CYS C C 1.106 5.004 0.899 1.00 . A A . 20 CYS C 1 1 1 269 1 1 20 CYS CA C 2.337 4.880 0.011 1.00 . A A . 20 CYS CA 1 1 1 270 1 1 20 CYS CB C 3.142 3.683 0.513 1.00 . A A . 20 CYS CB 1 1 1 271 1 1 20 CYS H H 4.150 6.021 0.155 1.00 . A A . 20 CYS H 1 1 1 272 1 1 20 CYS HA H 2.014 4.691 -1.008 1.00 . A A . 20 CYS HA 1 1 1 273 1 1 20 CYS HB2 H 3.957 3.443 -0.165 1.00 . A A . 20 CYS HB2 1 1 1 274 1 1 20 CYS HB3 H 3.546 3.921 1.485 1.00 . A A . 20 CYS HB3 1 1 1 275 1 1 20 CYS N N 3.142 6.105 0.051 1.00 . A A . 20 CYS N 1 1 1 276 1 1 20 CYS O O -0.013 4.707 0.490 1.00 . A A . 20 CYS O 1 1 1 277 1 1 20 CYS SG S 2.124 2.233 0.832 1.00 . A A . 20 CYS SG 1 1 1 278 1 1 21 ASP C C -0.819 6.513 2.679 1.00 . A A . 21 ASP C 1 1 1 279 1 1 21 ASP CA C 0.308 5.585 3.131 1.00 . A A . 21 ASP CA 1 1 1 280 1 1 21 ASP CB C 0.984 6.087 4.415 1.00 . A A . 21 ASP CB 1 1 1 281 1 1 21 ASP CG C 0.019 6.317 5.565 1.00 . A A . 21 ASP CG 1 1 1 282 1 1 21 ASP H H 2.289 5.701 2.386 1.00 . A A . 21 ASP H 1 1 1 283 1 1 21 ASP HA H -0.102 4.584 3.263 1.00 . A A . 21 ASP HA 1 1 1 284 1 1 21 ASP HB2 H 1.731 5.358 4.732 1.00 . A A . 21 ASP HB2 1 1 1 285 1 1 21 ASP HB3 H 1.490 7.030 4.222 1.00 . A A . 21 ASP HB3 1 1 1 286 1 1 21 ASP N N 1.330 5.501 2.115 1.00 . A A . 21 ASP N 1 1 1 287 1 1 21 ASP O O -1.974 6.285 3.037 1.00 . A A . 21 ASP O 1 1 1 288 1 1 21 ASP OD1 O -0.672 7.491 5.553 1.00 . A A . 21 ASP OD1 1 1 1 289 1 1 21 ASP OD2 O -0.075 5.468 6.449 1.00 . A A . 21 ASP OD2 1 1 1 290 1 1 22 LYS C C -2.076 7.815 -0.003 1.00 . A A . 22 LYS C 1 1 1 291 1 1 22 LYS CA C -1.514 8.400 1.290 1.00 . A A . 22 LYS CA 1 1 1 292 1 1 22 LYS CB C -1.008 9.814 1.063 1.00 . A A . 22 LYS CB 1 1 1 293 1 1 22 LYS CD C -0.582 11.774 2.647 1.00 . A A . 22 LYS CD 1 1 1 294 1 1 22 LYS CE C -1.765 11.989 3.609 1.00 . A A . 22 LYS CE 1 1 1 295 1 1 22 LYS CG C -0.361 10.281 2.361 1.00 . A A . 22 LYS CG 1 1 1 296 1 1 22 LYS H H 0.463 7.643 1.574 1.00 . A A . 22 LYS H 1 1 1 297 1 1 22 LYS HA H -2.281 8.541 2.034 1.00 . A A . 22 LYS HA 1 1 1 298 1 1 22 LYS HB2 H -0.280 9.835 0.251 1.00 . A A . 22 LYS HB2 1 1 1 299 1 1 22 LYS HB3 H -1.847 10.450 0.788 1.00 . A A . 22 LYS HB3 1 1 1 300 1 1 22 LYS HD2 H 0.316 12.171 3.129 1.00 . A A . 22 LYS HD2 1 1 1 301 1 1 22 LYS HD3 H -0.727 12.323 1.714 1.00 . A A . 22 LYS HD3 1 1 1 302 1 1 22 LYS HE2 H -1.478 11.627 4.600 1.00 . A A . 22 LYS HE2 1 1 1 303 1 1 22 LYS HE3 H -1.980 13.057 3.688 1.00 . A A . 22 LYS HE3 1 1 1 304 1 1 22 LYS HG2 H -0.662 9.700 3.235 1.00 . A A . 22 LYS HG2 1 1 1 305 1 1 22 LYS HG3 H 0.671 10.029 2.169 1.00 . A A . 22 LYS HG3 1 1 1 306 1 1 22 LYS HZ1 H -2.907 10.273 3.449 1.00 . A A . 22 LYS HZ1 1 1 1 307 1 1 22 LYS HZ2 H -3.807 11.676 3.669 1.00 . A A . 22 LYS HZ2 1 1 1 308 1 1 22 LYS N N -0.501 7.534 1.875 1.00 . A A . 22 LYS N 1 1 1 309 1 1 22 LYS NZ N -2.990 11.268 3.194 1.00 . A A . 22 LYS NZ 1 1 1 310 1 1 22 LYS O O -3.265 7.950 -0.281 1.00 . A A . 22 LYS O 1 1 1 311 1 1 23 GLN C C -2.305 5.299 -2.002 1.00 . A A . 23 GLN C 1 1 1 312 1 1 23 GLN CA C -1.534 6.631 -2.132 1.00 . A A . 23 GLN CA 1 1 1 313 1 1 23 GLN CB C -0.201 6.577 -2.890 1.00 . A A . 23 GLN CB 1 1 1 314 1 1 23 GLN CD C 0.661 6.279 -5.266 1.00 . A A . 23 GLN CD 1 1 1 315 1 1 23 GLN CG C -0.263 5.767 -4.184 1.00 . A A . 23 GLN CG 1 1 1 316 1 1 23 GLN H H -0.284 7.054 -0.468 1.00 . A A . 23 GLN H 1 1 1 317 1 1 23 GLN HA H -2.154 7.322 -2.705 1.00 . A A . 23 GLN HA 1 1 1 318 1 1 23 GLN HB2 H 0.076 7.611 -3.092 1.00 . A A . 23 GLN HB2 1 1 1 319 1 1 23 GLN HB3 H 0.570 6.130 -2.263 1.00 . A A . 23 GLN HB3 1 1 1 320 1 1 23 GLN HE21 H 0.119 4.753 -6.510 1.00 . A A . 23 GLN HE21 1 1 1 321 1 1 23 GLN HE22 H 1.091 6.046 -7.175 1.00 . A A . 23 GLN HE22 1 1 1 322 1 1 23 GLN HG2 H -0.025 4.722 -3.988 1.00 . A A . 23 GLN HG2 1 1 1 323 1 1 23 GLN HG3 H -1.262 5.846 -4.598 1.00 . A A . 23 GLN HG3 1 1 1 324 1 1 23 GLN N N -1.234 7.161 -0.804 1.00 . A A . 23 GLN N 1 1 1 325 1 1 23 GLN NE2 N 0.653 5.599 -6.397 1.00 . A A . 23 GLN NE2 1 1 1 326 1 1 23 GLN O O -2.035 4.309 -2.676 1.00 . A A . 23 GLN O 1 1 1 327 1 1 23 GLN OE1 O 1.339 7.295 -5.126 1.00 . A A . 23 GLN OE1 1 1 1 328 1 1 24 CYS C C -5.348 4.809 0.005 1.00 . A A . 24 CYS C 1 1 1 329 1 1 24 CYS CA C -4.120 4.198 -0.662 1.00 . A A . 24 CYS CA 1 1 1 330 1 1 24 CYS CB C -3.333 3.391 0.383 1.00 . A A . 24 CYS CB 1 1 1 331 1 1 24 CYS H H -3.527 6.217 -0.743 1.00 . A A . 24 CYS H 1 1 1 332 1 1 24 CYS HA H -4.430 3.554 -1.487 1.00 . A A . 24 CYS HA 1 1 1 333 1 1 24 CYS HB2 H -2.774 4.067 1.032 1.00 . A A . 24 CYS HB2 1 1 1 334 1 1 24 CYS HB3 H -4.040 2.840 1.000 1.00 . A A . 24 CYS HB3 1 1 1 335 1 1 24 CYS N N -3.325 5.316 -1.147 1.00 . A A . 24 CYS N 1 1 1 336 1 1 24 CYS O O -6.485 4.433 -0.267 1.00 . A A . 24 CYS O 1 1 1 337 1 1 24 CYS SG S -2.186 2.144 -0.241 1.00 . A A . 24 CYS SG 1 1 1 338 1 1 25 GLN C C -6.795 7.556 0.663 1.00 . A A . 25 GLN C 1 1 1 339 1 1 25 GLN CA C -6.090 6.561 1.588 1.00 . A A . 25 GLN CA 1 1 1 340 1 1 25 GLN CB C -5.345 7.265 2.729 1.00 . A A . 25 GLN CB 1 1 1 341 1 1 25 GLN CD C -5.325 8.762 4.698 1.00 . A A . 25 GLN CD 1 1 1 342 1 1 25 GLN CG C -6.216 8.133 3.636 1.00 . A A . 25 GLN CG 1 1 1 343 1 1 25 GLN H H -4.125 6.006 1.068 1.00 . A A . 25 GLN H 1 1 1 344 1 1 25 GLN HA H -6.830 5.883 2.009 1.00 . A A . 25 GLN HA 1 1 1 345 1 1 25 GLN HB2 H -4.864 6.506 3.343 1.00 . A A . 25 GLN HB2 1 1 1 346 1 1 25 GLN HB3 H -4.563 7.903 2.327 1.00 . A A . 25 GLN HB3 1 1 1 347 1 1 25 GLN HE21 H -5.426 7.070 5.813 1.00 . A A . 25 GLN HE21 1 1 1 348 1 1 25 GLN HE22 H -4.485 8.389 6.506 1.00 . A A . 25 GLN HE22 1 1 1 349 1 1 25 GLN HG2 H -6.692 8.925 3.057 1.00 . A A . 25 GLN HG2 1 1 1 350 1 1 25 GLN HG3 H -6.987 7.520 4.105 1.00 . A A . 25 GLN HG3 1 1 1 351 1 1 25 GLN N N -5.092 5.797 0.864 1.00 . A A . 25 GLN N 1 1 1 352 1 1 25 GLN NE2 N -5.036 8.011 5.752 1.00 . A A . 25 GLN NE2 1 1 1 353 1 1 25 GLN O O -8.020 7.652 0.666 1.00 . A A . 25 GLN O 1 1 1 354 1 1 25 GLN OE1 O -4.845 9.888 4.540 1.00 . A A . 25 GLN OE1 1 1 1 355 1 1 26 ASP C C -7.049 8.895 -2.260 1.00 . A A . 26 ASP C 1 1 1 356 1 1 26 ASP CA C -6.558 9.421 -0.918 1.00 . A A . 26 ASP CA 1 1 1 357 1 1 26 ASP CB C -5.493 10.506 -1.115 1.00 . A A . 26 ASP CB 1 1 1 358 1 1 26 ASP CG C -5.288 11.332 0.150 1.00 . A A . 26 ASP CG 1 1 1 359 1 1 26 ASP H H -5.026 8.156 -0.135 1.00 . A A . 26 ASP H 1 1 1 360 1 1 26 ASP HA H -7.401 9.879 -0.409 1.00 . A A . 26 ASP HA 1 1 1 361 1 1 26 ASP HB2 H -4.551 10.047 -1.410 1.00 . A A . 26 ASP HB2 1 1 1 362 1 1 26 ASP HB3 H -5.809 11.169 -1.921 1.00 . A A . 26 ASP HB3 1 1 1 363 1 1 26 ASP N N -6.025 8.329 -0.109 1.00 . A A . 26 ASP N 1 1 1 364 1 1 26 ASP O O -8.162 9.204 -2.686 1.00 . A A . 26 ASP O 1 1 1 365 1 1 26 ASP OD1 O -6.233 12.275 0.419 1.00 . A A . 26 ASP OD1 1 1 1 366 1 1 26 ASP OD2 O -4.307 11.119 0.862 1.00 . A A . 26 ASP OD2 1 1 1 367 1 1 27 TRP C C -7.478 6.628 -4.329 1.00 . A A . 27 TRP C 1 1 1 368 1 1 27 TRP CA C -6.392 7.702 -4.307 1.00 . A A . 27 TRP CA 1 1 1 369 1 1 27 TRP CB C -5.079 7.111 -4.825 1.00 . A A . 27 TRP CB 1 1 1 370 1 1 27 TRP CD1 C -3.625 9.185 -4.512 1.00 . A A . 27 TRP CD1 1 1 1 371 1 1 27 TRP CD2 C -2.976 7.879 -6.206 1.00 . A A . 27 TRP CD2 1 1 1 372 1 1 27 TRP CE2 C -2.020 8.930 -6.109 1.00 . A A . 27 TRP CE2 1 1 1 373 1 1 27 TRP CE3 C -2.803 6.936 -7.240 1.00 . A A . 27 TRP CE3 1 1 1 374 1 1 27 TRP CG C -3.959 8.042 -5.150 1.00 . A A . 27 TRP CG 1 1 1 375 1 1 27 TRP CH2 C -0.754 8.025 -7.961 1.00 . A A . 27 TRP CH2 1 1 1 376 1 1 27 TRP CZ2 C -0.921 9.014 -6.976 1.00 . A A . 27 TRP CZ2 1 1 1 377 1 1 27 TRP CZ3 C -1.703 7.002 -8.107 1.00 . A A . 27 TRP CZ3 1 1 1 378 1 1 27 TRP H H -5.305 7.934 -2.492 1.00 . A A . 27 TRP H 1 1 1 379 1 1 27 TRP HA H -6.690 8.542 -4.938 1.00 . A A . 27 TRP HA 1 1 1 380 1 1 27 TRP HB2 H -4.688 6.390 -4.107 1.00 . A A . 27 TRP HB2 1 1 1 381 1 1 27 TRP HB3 H -5.320 6.582 -5.748 1.00 . A A . 27 TRP HB3 1 1 1 382 1 1 27 TRP HD1 H -4.148 9.616 -3.676 1.00 . A A . 27 TRP HD1 1 1 1 383 1 1 27 TRP HE1 H -2.030 10.562 -4.752 1.00 . A A . 27 TRP HE1 1 1 1 384 1 1 27 TRP HE3 H -3.544 6.167 -7.378 1.00 . A A . 27 TRP HE3 1 1 1 385 1 1 27 TRP HH2 H 0.099 8.025 -8.615 1.00 . A A . 27 TRP HH2 1 1 1 386 1 1 27 TRP HZ2 H -0.207 9.820 -6.886 1.00 . A A . 27 TRP HZ2 1 1 1 387 1 1 27 TRP HZ3 H -1.584 6.260 -8.884 1.00 . A A . 27 TRP HZ3 1 1 1 388 1 1 27 TRP N N -6.192 8.125 -2.929 1.00 . A A . 27 TRP N 1 1 1 389 1 1 27 TRP NE1 N -2.474 9.712 -5.061 1.00 . A A . 27 TRP NE1 1 1 1 390 1 1 27 TRP O O -8.594 6.857 -4.802 1.00 . A A . 27 TRP O 1 1 1 391 1 1 28 GLU C C -8.908 4.990 -2.194 1.00 . A A . 28 GLU C 1 1 1 392 1 1 28 GLU CA C -8.121 4.442 -3.396 1.00 . A A . 28 GLU CA 1 1 1 393 1 1 28 GLU CB C -7.354 3.118 -3.160 1.00 . A A . 28 GLU CB 1 1 1 394 1 1 28 GLU CD C -9.263 1.530 -3.792 1.00 . A A . 28 GLU CD 1 1 1 395 1 1 28 GLU CG C -7.836 1.985 -4.080 1.00 . A A . 28 GLU CG 1 1 1 396 1 1 28 GLU H H -6.252 5.418 -3.290 1.00 . A A . 28 GLU H 1 1 1 397 1 1 28 GLU HA H -8.814 4.324 -4.230 1.00 . A A . 28 GLU HA 1 1 1 398 1 1 28 GLU HB2 H -6.298 3.263 -3.393 1.00 . A A . 28 GLU HB2 1 1 1 399 1 1 28 GLU HB3 H -7.395 2.789 -2.122 1.00 . A A . 28 GLU HB3 1 1 1 400 1 1 28 GLU HG2 H -7.769 2.310 -5.118 1.00 . A A . 28 GLU HG2 1 1 1 401 1 1 28 GLU HG3 H -7.175 1.129 -3.946 1.00 . A A . 28 GLU HG3 1 1 1 402 1 1 28 GLU N N -7.157 5.479 -3.726 1.00 . A A . 28 GLU N 1 1 1 403 1 1 28 GLU O O -9.139 6.194 -2.137 1.00 . A A . 28 GLU O 1 1 1 404 1 1 28 GLU OE1 O -9.851 1.969 -2.810 1.00 . A A . 28 GLU OE1 1 1 1 405 1 1 28 GLU OE2 O -9.801 0.631 -4.663 1.00 . A A . 28 GLU OE2 1 1 1 406 1 1 29 LYS C C -9.933 3.600 1.003 1.00 . A A . 29 LYS C 1 1 1 407 1 1 29 LYS CA C -10.149 4.607 -0.124 1.00 . A A . 29 LYS CA 1 1 1 408 1 1 29 LYS CB C -11.627 4.637 -0.574 1.00 . A A . 29 LYS CB 1 1 1 409 1 1 29 LYS CD C -11.825 7.121 -1.319 1.00 . A A . 29 LYS CD 1 1 1 410 1 1 29 LYS CE C -11.855 8.011 -2.577 1.00 . A A . 29 LYS CE 1 1 1 411 1 1 29 LYS CG C -12.011 5.636 -1.684 1.00 . A A . 29 LYS CG 1 1 1 412 1 1 29 LYS H H -9.127 3.209 -1.262 1.00 . A A . 29 LYS H 1 1 1 413 1 1 29 LYS HA H -9.787 5.560 0.216 1.00 . A A . 29 LYS HA 1 1 1 414 1 1 29 LYS HB2 H -11.899 3.636 -0.914 1.00 . A A . 29 LYS HB2 1 1 1 415 1 1 29 LYS HB3 H -12.238 4.870 0.300 1.00 . A A . 29 LYS HB3 1 1 1 416 1 1 29 LYS HD2 H -12.650 7.403 -0.660 1.00 . A A . 29 LYS HD2 1 1 1 417 1 1 29 LYS HD3 H -10.898 7.287 -0.768 1.00 . A A . 29 LYS HD3 1 1 1 418 1 1 29 LYS HE2 H -12.619 7.641 -3.265 1.00 . A A . 29 LYS HE2 1 1 1 419 1 1 29 LYS HE3 H -12.127 9.026 -2.283 1.00 . A A . 29 LYS HE3 1 1 1 420 1 1 29 LYS HG2 H -11.466 5.380 -2.590 1.00 . A A . 29 LYS HG2 1 1 1 421 1 1 29 LYS HG3 H -13.066 5.478 -1.905 1.00 . A A . 29 LYS HG3 1 1 1 422 1 1 29 LYS HZ1 H -10.291 7.140 -3.612 1.00 . A A . 29 LYS HZ1 1 1 1 423 1 1 29 LYS HZ2 H -10.608 8.729 -4.062 1.00 . A A . 29 LYS HZ2 1 1 1 424 1 1 29 LYS N N -9.287 4.192 -1.204 1.00 . A A . 29 LYS N 1 1 1 425 1 1 29 LYS NZ N -10.545 8.077 -3.268 1.00 . A A . 29 LYS NZ 1 1 1 426 1 1 29 LYS O O -10.861 3.002 1.545 1.00 . A A . 29 LYS O 1 1 1 427 1 1 30 ALA C C -8.131 3.460 3.707 1.00 . A A . 30 ALA C 1 1 1 428 1 1 30 ALA CA C -8.179 2.612 2.436 1.00 . A A . 30 ALA CA 1 1 1 429 1 1 30 ALA CB C -6.790 2.084 2.077 1.00 . A A . 30 ALA CB 1 1 1 430 1 1 30 ALA H H -7.955 3.942 0.803 1.00 . A A . 30 ALA H 1 1 1 431 1 1 30 ALA HA H -8.858 1.775 2.585 1.00 . A A . 30 ALA HA 1 1 1 432 1 1 30 ALA HB1 H -6.803 1.669 1.070 1.00 . A A . 30 ALA HB1 1 1 1 433 1 1 30 ALA HB2 H -6.068 2.898 2.122 1.00 . A A . 30 ALA HB2 1 1 1 434 1 1 30 ALA HB3 H -6.489 1.306 2.770 1.00 . A A . 30 ALA HB3 1 1 1 435 1 1 30 ALA N N -8.650 3.418 1.326 1.00 . A A . 30 ALA N 1 1 1 436 1 1 30 ALA O O -8.250 4.683 3.653 1.00 . A A . 30 ALA O 1 1 1 437 1 1 31 SER C C -6.204 4.180 5.923 1.00 . A A . 31 SER C 1 1 1 438 1 1 31 SER CA C -7.582 3.528 6.080 1.00 . A A . 31 SER CA 1 1 1 439 1 1 31 SER CB C -7.627 2.504 7.212 1.00 . A A . 31 SER CB 1 1 1 440 1 1 31 SER H H -7.750 1.835 4.925 1.00 . A A . 31 SER H 1 1 1 441 1 1 31 SER HA H -8.328 4.290 6.284 1.00 . A A . 31 SER HA 1 1 1 442 1 1 31 SER HB2 H -6.802 1.808 7.119 1.00 . A A . 31 SER HB2 1 1 1 443 1 1 31 SER HB3 H -7.495 3.035 8.140 1.00 . A A . 31 SER HB3 1 1 1 444 1 1 31 SER HG H -9.569 2.430 7.081 1.00 . A A . 31 SER HG 1 1 1 445 1 1 31 SER N N -7.904 2.833 4.863 1.00 . A A . 31 SER N 1 1 1 446 1 1 31 SER O O -6.035 5.370 6.189 1.00 . A A . 31 SER O 1 1 1 447 1 1 31 SER OG O -8.859 1.792 7.202 1.00 . A A . 31 SER OG 1 1 1 448 1 1 32 HIS C C -3.142 2.945 4.242 1.00 . A A . 32 HIS C 1 1 1 449 1 1 32 HIS CA C -3.884 3.922 5.159 1.00 . A A . 32 HIS CA 1 1 1 450 1 1 32 HIS CB C -3.111 4.238 6.456 1.00 . A A . 32 HIS CB 1 1 1 451 1 1 32 HIS CD2 C -2.856 1.869 7.381 1.00 . A A . 32 HIS CD2 1 1 1 452 1 1 32 HIS CE1 C -0.713 1.800 7.697 1.00 . A A . 32 HIS CE1 1 1 1 453 1 1 32 HIS CG C -2.351 3.082 7.047 1.00 . A A . 32 HIS CG 1 1 1 454 1 1 32 HIS H H -5.423 2.455 5.168 1.00 . A A . 32 HIS H 1 1 1 455 1 1 32 HIS HA H -4.005 4.855 4.607 1.00 . A A . 32 HIS HA 1 1 1 456 1 1 32 HIS HB2 H -2.395 4.993 6.214 1.00 . A A . 32 HIS HB2 1 1 1 457 1 1 32 HIS HB3 H -3.773 4.657 7.215 1.00 . A A . 32 HIS HB3 1 1 1 458 1 1 32 HIS HD1 H -0.316 3.790 7.071 1.00 . A A . 32 HIS HD1 1 1 1 459 1 1 32 HIS HD2 H -3.876 1.630 7.185 1.00 . A A . 32 HIS HD2 1 1 1 460 1 1 32 HIS HE1 H 0.275 1.430 7.920 1.00 . A A . 32 HIS HE1 1 1 1 461 1 1 32 HIS N N -5.214 3.405 5.462 1.00 . A A . 32 HIS N 1 1 1 462 1 1 32 HIS ND1 N -0.985 3.052 7.280 1.00 . A A . 32 HIS ND1 1 1 1 463 1 1 32 HIS NE2 N -1.822 1.051 7.780 1.00 . A A . 32 HIS NE2 1 1 1 464 1 1 32 HIS O O -3.760 2.035 3.688 1.00 . A A . 32 HIS O 1 1 1 465 1 1 33 GLY C C 0.441 2.113 4.106 1.00 . A A . 33 GLY C 1 1 1 466 1 1 33 GLY CA C -0.924 2.200 3.429 1.00 . A A . 33 GLY CA 1 1 1 467 1 1 33 GLY H H -1.371 3.848 4.647 1.00 . A A . 33 GLY H 1 1 1 468 1 1 33 GLY HA2 H -1.358 1.227 3.450 1.00 . A A . 33 GLY HA2 1 1 1 469 1 1 33 GLY HA3 H -0.800 2.489 2.389 1.00 . A A . 33 GLY HA3 1 1 1 470 1 1 33 GLY N N -1.820 3.103 4.134 1.00 . A A . 33 GLY N 1 1 1 471 1 1 33 GLY O O 0.706 2.878 5.034 1.00 . A A . 33 GLY O 1 1 1 472 1 1 34 ALA C C 3.451 0.096 3.183 1.00 . A A . 34 ALA C 1 1 1 473 1 1 34 ALA CA C 2.653 0.996 4.147 1.00 . A A . 34 ALA CA 1 1 1 474 1 1 34 ALA CB C 2.586 0.410 5.562 1.00 . A A . 34 ALA CB 1 1 1 475 1 1 34 ALA H H 0.972 0.551 2.926 1.00 . A A . 34 ALA H 1 1 1 476 1 1 34 ALA HA H 3.130 1.974 4.193 1.00 . A A . 34 ALA HA 1 1 1 477 1 1 34 ALA HB1 H 1.985 -0.499 5.559 1.00 . A A . 34 ALA HB1 1 1 1 478 1 1 34 ALA HB2 H 3.585 0.191 5.930 1.00 . A A . 34 ALA HB2 1 1 1 479 1 1 34 ALA HB3 H 2.114 1.123 6.242 1.00 . A A . 34 ALA HB3 1 1 1 480 1 1 34 ALA N N 1.289 1.178 3.663 1.00 . A A . 34 ALA N 1 1 1 481 1 1 34 ALA O O 2.897 -0.871 2.656 1.00 . A A . 34 ALA O 1 1 1 482 1 1 35 CYS C C 5.963 -1.726 2.755 1.00 . A A . 35 CYS C 1 1 1 483 1 1 35 CYS CA C 5.601 -0.399 2.066 1.00 . A A . 35 CYS CA 1 1 1 484 1 1 35 CYS CB C 6.932 0.333 1.824 1.00 . A A . 35 CYS CB 1 1 1 485 1 1 35 CYS H H 5.181 1.189 3.390 1.00 . A A . 35 CYS H 1 1 1 486 1 1 35 CYS HA H 5.109 -0.552 1.108 1.00 . A A . 35 CYS HA 1 1 1 487 1 1 35 CYS HB2 H 7.382 0.562 2.790 1.00 . A A . 35 CYS HB2 1 1 1 488 1 1 35 CYS HB3 H 7.576 -0.382 1.336 1.00 . A A . 35 CYS HB3 1 1 1 489 1 1 35 CYS N N 4.744 0.385 2.952 1.00 . A A . 35 CYS N 1 1 1 490 1 1 35 CYS O O 6.234 -1.728 3.958 1.00 . A A . 35 CYS O 1 1 1 491 1 1 35 CYS SG S 7.073 1.827 0.806 1.00 . A A . 35 CYS SG 1 1 1 492 1 1 36 HIS C C 7.261 -4.895 1.425 1.00 . A A . 36 HIS C 1 1 1 493 1 1 36 HIS CA C 6.579 -4.115 2.536 1.00 . A A . 36 HIS CA 1 1 1 494 1 1 36 HIS CB C 5.520 -5.080 3.058 1.00 . A A . 36 HIS CB 1 1 1 495 1 1 36 HIS CD2 C 3.069 -4.763 3.630 1.00 . A A . 36 HIS CD2 1 1 1 496 1 1 36 HIS CE1 C 3.272 -3.326 5.264 1.00 . A A . 36 HIS CE1 1 1 1 497 1 1 36 HIS CG C 4.384 -4.477 3.807 1.00 . A A . 36 HIS CG 1 1 1 498 1 1 36 HIS H H 5.707 -2.835 1.063 1.00 . A A . 36 HIS H 1 1 1 499 1 1 36 HIS HA H 7.276 -3.920 3.348 1.00 . A A . 36 HIS HA 1 1 1 500 1 1 36 HIS HB2 H 5.082 -5.611 2.212 1.00 . A A . 36 HIS HB2 1 1 1 501 1 1 36 HIS HB3 H 6.011 -5.815 3.695 1.00 . A A . 36 HIS HB3 1 1 1 502 1 1 36 HIS HD1 H 5.353 -2.998 5.024 1.00 . A A . 36 HIS HD1 1 1 1 503 1 1 36 HIS HD2 H 2.737 -5.438 2.846 1.00 . A A . 36 HIS HD2 1 1 1 504 1 1 36 HIS HE1 H 3.029 -2.642 6.066 1.00 . A A . 36 HIS HE1 1 1 1 505 1 1 36 HIS N N 6.007 -2.857 2.035 1.00 . A A . 36 HIS N 1 1 1 506 1 1 36 HIS ND1 N 4.511 -3.524 4.797 1.00 . A A . 36 HIS ND1 1 1 1 507 1 1 36 HIS NE2 N 2.375 -4.086 4.612 1.00 . A A . 36 HIS NE2 1 1 1 508 1 1 36 HIS O O 6.738 -4.925 0.314 1.00 . A A . 36 HIS O 1 1 1 509 1 1 37 LYS C C 8.145 -7.863 0.739 1.00 . A A . 37 LYS C 1 1 1 510 1 1 37 LYS CA C 8.933 -6.558 0.803 1.00 . A A . 37 LYS CA 1 1 1 511 1 1 37 LYS CB C 10.395 -6.805 1.181 1.00 . A A . 37 LYS CB 1 1 1 512 1 1 37 LYS CD C 12.501 -8.125 0.495 1.00 . A A . 37 LYS CD 1 1 1 513 1 1 37 LYS CE C 13.725 -7.223 0.252 1.00 . A A . 37 LYS CE 1 1 1 514 1 1 37 LYS CG C 11.180 -7.469 0.043 1.00 . A A . 37 LYS CG 1 1 1 515 1 1 37 LYS H H 8.668 -5.631 2.696 1.00 . A A . 37 LYS H 1 1 1 516 1 1 37 LYS HA H 8.958 -6.099 -0.176 1.00 . A A . 37 LYS HA 1 1 1 517 1 1 37 LYS HB2 H 10.848 -5.856 1.371 1.00 . A A . 37 LYS HB2 1 1 1 518 1 1 37 LYS HB3 H 10.439 -7.368 2.102 1.00 . A A . 37 LYS HB3 1 1 1 519 1 1 37 LYS HD2 H 12.442 -8.397 1.552 1.00 . A A . 37 LYS HD2 1 1 1 520 1 1 37 LYS HD3 H 12.624 -9.055 -0.060 1.00 . A A . 37 LYS HD3 1 1 1 521 1 1 37 LYS HE2 H 13.591 -6.648 -0.666 1.00 . A A . 37 LYS HE2 1 1 1 522 1 1 37 LYS HE3 H 13.819 -6.536 1.093 1.00 . A A . 37 LYS HE3 1 1 1 523 1 1 37 LYS HG2 H 10.546 -8.238 -0.374 1.00 . A A . 37 LYS HG2 1 1 1 524 1 1 37 LYS HG3 H 11.348 -6.740 -0.751 1.00 . A A . 37 LYS HG3 1 1 1 525 1 1 37 LYS HZ1 H 14.755 -8.995 -0.011 1.00 . A A . 37 LYS HZ1 1 1 1 526 1 1 37 LYS HZ2 H 15.477 -7.667 -0.748 1.00 . A A . 37 LYS HZ2 1 1 1 527 1 1 37 LYS N N 8.302 -5.661 1.756 1.00 . A A . 37 LYS N 1 1 1 528 1 1 37 LYS NZ N 14.978 -7.995 0.092 1.00 . A A . 37 LYS NZ 1 1 1 529 1 1 37 LYS O O 7.791 -8.447 1.765 1.00 . A A . 37 LYS O 1 1 1 530 1 1 38 ARG C C 7.951 -10.055 -2.097 1.00 . A A . 38 ARG C 1 1 1 531 1 1 38 ARG CA C 7.263 -9.576 -0.820 1.00 . A A . 38 ARG CA 1 1 1 532 1 1 38 ARG CB C 5.770 -9.391 -1.094 1.00 . A A . 38 ARG CB 1 1 1 533 1 1 38 ARG CD C 4.784 -9.776 1.247 1.00 . A A . 38 ARG CD 1 1 1 534 1 1 38 ARG CG C 4.957 -8.812 0.068 1.00 . A A . 38 ARG CG 1 1 1 535 1 1 38 ARG CZ C 4.502 -8.674 3.488 1.00 . A A . 38 ARG CZ 1 1 1 536 1 1 38 ARG H H 8.105 -7.691 -1.270 1.00 . A A . 38 ARG H 1 1 1 537 1 1 38 ARG HA H 7.421 -10.301 -0.019 1.00 . A A . 38 ARG HA 1 1 1 538 1 1 38 ARG HB2 H 5.680 -8.703 -1.937 1.00 . A A . 38 ARG HB2 1 1 1 539 1 1 38 ARG HB3 H 5.353 -10.354 -1.385 1.00 . A A . 38 ARG HB3 1 1 1 540 1 1 38 ARG HD2 H 4.228 -10.648 0.895 1.00 . A A . 38 ARG HD2 1 1 1 541 1 1 38 ARG HD3 H 5.749 -10.139 1.594 1.00 . A A . 38 ARG HD3 1 1 1 542 1 1 38 ARG HG2 H 5.392 -7.870 0.404 1.00 . A A . 38 ARG HG2 1 1 1 543 1 1 38 ARG HG3 H 3.967 -8.611 -0.328 1.00 . A A . 38 ARG HG3 1 1 1 544 1 1 38 ARG HH11 H 6.469 -8.817 2.932 1.00 . A A . 38 ARG HH11 1 1 1 545 1 1 38 ARG HH12 H 6.215 -8.399 4.597 1.00 . A A . 38 ARG HH12 1 1 1 546 1 1 38 ARG HH21 H 2.669 -8.135 4.262 1.00 . A A . 38 ARG HH21 1 1 1 547 1 1 38 ARG HH22 H 4.007 -7.949 5.345 1.00 . A A . 38 ARG HH22 1 1 1 548 1 1 38 ARG N N 7.863 -8.296 -0.489 1.00 . A A . 38 ARG N 1 1 1 549 1 1 38 ARG NE N 4.006 -9.144 2.331 1.00 . A A . 38 ARG NE 1 1 1 550 1 1 38 ARG NH1 N 5.823 -8.634 3.700 1.00 . A A . 38 ARG NH1 1 1 1 551 1 1 38 ARG NH2 N 3.671 -8.225 4.436 1.00 . A A . 38 ARG NH2 1 1 1 552 1 1 38 ARG O O 8.037 -9.284 -3.049 1.00 . A A . 38 ARG O 1 1 1 553 1 1 39 GLU C C 10.206 -10.890 -3.837 1.00 . A A . 39 GLU C 1 1 1 554 1 1 39 GLU CA C 9.152 -11.860 -3.279 1.00 . A A . 39 GLU CA 1 1 1 555 1 1 39 GLU CB C 8.121 -12.305 -4.333 1.00 . A A . 39 GLU CB 1 1 1 556 1 1 39 GLU CD C 6.134 -12.912 -2.833 1.00 . A A . 39 GLU CD 1 1 1 557 1 1 39 GLU CG C 7.188 -13.416 -3.817 1.00 . A A . 39 GLU CG 1 1 1 558 1 1 39 GLU H H 8.216 -11.919 -1.371 1.00 . A A . 39 GLU H 1 1 1 559 1 1 39 GLU HA H 9.693 -12.749 -2.945 1.00 . A A . 39 GLU HA 1 1 1 560 1 1 39 GLU HB2 H 7.535 -11.448 -4.670 1.00 . A A . 39 GLU HB2 1 1 1 561 1 1 39 GLU HB3 H 8.666 -12.701 -5.191 1.00 . A A . 39 GLU HB3 1 1 1 562 1 1 39 GLU HG2 H 6.678 -13.867 -4.669 1.00 . A A . 39 GLU HG2 1 1 1 563 1 1 39 GLU HG3 H 7.781 -14.193 -3.336 1.00 . A A . 39 GLU HG3 1 1 1 564 1 1 39 GLU N N 8.467 -11.286 -2.123 1.00 . A A . 39 GLU N 1 1 1 565 1 1 39 GLU O O 10.351 -10.721 -5.045 1.00 . A A . 39 GLU O 1 1 1 566 1 1 39 GLU OE1 O 4.994 -12.408 -3.379 1.00 . A A . 39 GLU OE1 1 1 1 567 1 1 39 GLU OE2 O 6.371 -12.946 -1.625 1.00 . A A . 39 GLU OE2 1 1 1 568 1 1 40 ASN C C 11.483 -7.984 -3.889 1.00 . A A . 40 ASN C 1 1 1 569 1 1 40 ASN CA C 11.967 -9.250 -3.179 1.00 . A A . 40 ASN CA 1 1 1 570 1 1 40 ASN CB C 13.131 -9.900 -3.913 1.00 . A A . 40 ASN CB 1 1 1 571 1 1 40 ASN CG C 14.436 -9.135 -3.691 1.00 . A A . 40 ASN CG 1 1 1 572 1 1 40 ASN H H 10.814 -10.525 -1.976 1.00 . A A . 40 ASN H 1 1 1 573 1 1 40 ASN HA H 12.315 -8.930 -2.203 1.00 . A A . 40 ASN HA 1 1 1 574 1 1 40 ASN HB2 H 13.249 -10.921 -3.559 1.00 . A A . 40 ASN HB2 1 1 1 575 1 1 40 ASN HB3 H 12.841 -9.939 -4.957 1.00 . A A . 40 ASN HB3 1 1 1 576 1 1 40 ASN HD21 H 14.919 -9.204 -5.667 1.00 . A A . 40 ASN HD21 1 1 1 577 1 1 40 ASN HD22 H 16.072 -8.399 -4.624 1.00 . A A . 40 ASN HD22 1 1 1 578 1 1 40 ASN N N 10.933 -10.239 -2.926 1.00 . A A . 40 ASN N 1 1 1 579 1 1 40 ASN ND2 N 15.205 -8.900 -4.749 1.00 . A A . 40 ASN ND2 1 1 1 580 1 1 40 ASN O O 12.287 -7.255 -4.460 1.00 . A A . 40 ASN O 1 1 1 581 1 1 40 ASN OD1 O 14.761 -8.772 -2.558 1.00 . A A . 40 ASN OD1 1 1 1 582 1 1 41 HIS C C 8.918 -5.755 -3.206 1.00 . A A . 41 HIS C 1 1 1 583 1 1 41 HIS CA C 9.575 -6.498 -4.363 1.00 . A A . 41 HIS CA 1 1 1 584 1 1 41 HIS CB C 8.549 -6.880 -5.427 1.00 . A A . 41 HIS CB 1 1 1 585 1 1 41 HIS CD2 C 9.158 -8.895 -6.947 1.00 . A A . 41 HIS CD2 1 1 1 586 1 1 41 HIS CE1 C 10.533 -7.884 -8.306 1.00 . A A . 41 HIS CE1 1 1 1 587 1 1 41 HIS CG C 9.209 -7.573 -6.595 1.00 . A A . 41 HIS CG 1 1 1 588 1 1 41 HIS H H 9.543 -8.356 -3.403 1.00 . A A . 41 HIS H 1 1 1 589 1 1 41 HIS HA H 10.329 -5.879 -4.838 1.00 . A A . 41 HIS HA 1 1 1 590 1 1 41 HIS HB2 H 7.819 -7.547 -4.966 1.00 . A A . 41 HIS HB2 1 1 1 591 1 1 41 HIS HB3 H 8.013 -5.990 -5.752 1.00 . A A . 41 HIS HB3 1 1 1 592 1 1 41 HIS HD1 H 10.320 -5.954 -7.480 1.00 . A A . 41 HIS HD1 1 1 1 593 1 1 41 HIS HD2 H 8.643 -9.666 -6.394 1.00 . A A . 41 HIS HD2 1 1 1 594 1 1 41 HIS HE1 H 11.250 -7.708 -9.096 1.00 . A A . 41 HIS HE1 1 1 1 595 1 1 41 HIS N N 10.180 -7.704 -3.837 1.00 . A A . 41 HIS N 1 1 1 596 1 1 41 HIS ND1 N 10.059 -6.931 -7.484 1.00 . A A . 41 HIS ND1 1 1 1 597 1 1 41 HIS NE2 N 10.013 -9.088 -8.014 1.00 . A A . 41 HIS NE2 1 1 1 598 1 1 41 HIS O O 8.039 -6.311 -2.549 1.00 . A A . 41 HIS O 1 1 1 599 1 1 42 TRP C C 7.383 -3.162 -2.486 1.00 . A A . 42 TRP C 1 1 1 600 1 1 42 TRP CA C 8.698 -3.693 -1.937 1.00 . A A . 42 TRP CA 1 1 1 601 1 1 42 TRP CB C 9.643 -2.594 -1.456 1.00 . A A . 42 TRP CB 1 1 1 602 1 1 42 TRP CD1 C 11.827 -3.702 -0.847 1.00 . A A . 42 TRP CD1 1 1 1 603 1 1 42 TRP CD2 C 10.658 -3.056 0.948 1.00 . A A . 42 TRP CD2 1 1 1 604 1 1 42 TRP CE2 C 11.849 -3.669 1.428 1.00 . A A . 42 TRP CE2 1 1 1 605 1 1 42 TRP CE3 C 9.698 -2.687 1.912 1.00 . A A . 42 TRP CE3 1 1 1 606 1 1 42 TRP CG C 10.681 -3.081 -0.506 1.00 . A A . 42 TRP CG 1 1 1 607 1 1 42 TRP CH2 C 11.105 -3.507 3.724 1.00 . A A . 42 TRP CH2 1 1 1 608 1 1 42 TRP CZ2 C 12.064 -3.926 2.788 1.00 . A A . 42 TRP CZ2 1 1 1 609 1 1 42 TRP CZ3 C 9.936 -2.862 3.286 1.00 . A A . 42 TRP CZ3 1 1 1 610 1 1 42 TRP H H 10.059 -4.086 -3.518 1.00 . A A . 42 TRP H 1 1 1 611 1 1 42 TRP HA H 8.484 -4.281 -1.063 1.00 . A A . 42 TRP HA 1 1 1 612 1 1 42 TRP HB2 H 10.116 -2.097 -2.298 1.00 . A A . 42 TRP HB2 1 1 1 613 1 1 42 TRP HB3 H 9.071 -1.848 -0.915 1.00 . A A . 42 TRP HB3 1 1 1 614 1 1 42 TRP HD1 H 12.099 -3.944 -1.861 1.00 . A A . 42 TRP HD1 1 1 1 615 1 1 42 TRP HE1 H 13.401 -4.543 0.322 1.00 . A A . 42 TRP HE1 1 1 1 616 1 1 42 TRP HE3 H 8.745 -2.327 1.575 1.00 . A A . 42 TRP HE3 1 1 1 617 1 1 42 TRP HH2 H 11.233 -3.712 4.776 1.00 . A A . 42 TRP HH2 1 1 1 618 1 1 42 TRP HZ2 H 12.904 -4.536 3.082 1.00 . A A . 42 TRP HZ2 1 1 1 619 1 1 42 TRP HZ3 H 9.200 -2.537 4.007 1.00 . A A . 42 TRP HZ3 1 1 1 620 1 1 42 TRP N N 9.347 -4.521 -2.938 1.00 . A A . 42 TRP N 1 1 1 621 1 1 42 TRP NE1 N 12.533 -4.038 0.289 1.00 . A A . 42 TRP NE1 1 1 1 622 1 1 42 TRP O O 7.405 -2.273 -3.320 1.00 . A A . 42 TRP O 1 1 1 623 1 1 43 LYS C C 4.423 -2.220 -1.484 1.00 . A A . 43 LYS C 1 1 1 624 1 1 43 LYS CA C 4.944 -3.192 -2.525 1.00 . A A . 43 LYS CA 1 1 1 625 1 1 43 LYS CB C 3.931 -4.323 -2.720 1.00 . A A . 43 LYS CB 1 1 1 626 1 1 43 LYS CD C 5.373 -5.482 -4.504 1.00 . A A . 43 LYS CD 1 1 1 627 1 1 43 LYS CE C 4.518 -5.224 -5.767 1.00 . A A . 43 LYS CE 1 1 1 628 1 1 43 LYS CG C 4.605 -5.613 -3.173 1.00 . A A . 43 LYS CG 1 1 1 629 1 1 43 LYS H H 6.240 -4.438 -1.385 1.00 . A A . 43 LYS H 1 1 1 630 1 1 43 LYS HA H 5.053 -2.694 -3.486 1.00 . A A . 43 LYS HA 1 1 1 631 1 1 43 LYS HB2 H 3.453 -4.522 -1.768 1.00 . A A . 43 LYS HB2 1 1 1 632 1 1 43 LYS HB3 H 3.145 -4.017 -3.407 1.00 . A A . 43 LYS HB3 1 1 1 633 1 1 43 LYS HD2 H 6.163 -4.736 -4.439 1.00 . A A . 43 LYS HD2 1 1 1 634 1 1 43 LYS HD3 H 5.851 -6.450 -4.645 1.00 . A A . 43 LYS HD3 1 1 1 635 1 1 43 LYS HE2 H 5.159 -5.419 -6.630 1.00 . A A . 43 LYS HE2 1 1 1 636 1 1 43 LYS HE3 H 3.681 -5.924 -5.808 1.00 . A A . 43 LYS HE3 1 1 1 637 1 1 43 LYS HG2 H 5.202 -5.932 -2.306 1.00 . A A . 43 LYS HG2 1 1 1 638 1 1 43 LYS HG3 H 3.890 -6.406 -3.315 1.00 . A A . 43 LYS HG3 1 1 1 639 1 1 43 LYS HZ1 H 4.435 -3.400 -6.745 1.00 . A A . 43 LYS HZ1 1 1 1 640 1 1 43 LYS HZ2 H 2.994 -3.840 -5.997 1.00 . A A . 43 LYS HZ2 1 1 1 641 1 1 43 LYS N N 6.234 -3.696 -2.078 1.00 . A A . 43 LYS N 1 1 1 642 1 1 43 LYS NZ N 4.020 -3.831 -5.906 1.00 . A A . 43 LYS NZ 1 1 1 643 1 1 43 LYS O O 4.514 -2.491 -0.288 1.00 . A A . 43 LYS O 1 1 1 644 1 1 44 CYS C C 1.670 -1.184 -0.880 1.00 . A A . 44 CYS C 1 1 1 645 1 1 44 CYS CA C 2.926 -0.357 -1.100 1.00 . A A . 44 CYS CA 1 1 1 646 1 1 44 CYS CB C 2.558 0.935 -1.808 1.00 . A A . 44 CYS CB 1 1 1 647 1 1 44 CYS H H 3.798 -0.951 -2.930 1.00 . A A . 44 CYS H 1 1 1 648 1 1 44 CYS HA H 3.391 -0.121 -0.148 1.00 . A A . 44 CYS HA 1 1 1 649 1 1 44 CYS HB2 H 3.437 1.568 -1.870 1.00 . A A . 44 CYS HB2 1 1 1 650 1 1 44 CYS HB3 H 2.202 0.688 -2.799 1.00 . A A . 44 CYS HB3 1 1 1 651 1 1 44 CYS N N 3.823 -1.126 -1.939 1.00 . A A . 44 CYS N 1 1 1 652 1 1 44 CYS O O 0.891 -1.350 -1.815 1.00 . A A . 44 CYS O 1 1 1 653 1 1 44 CYS SG S 1.243 1.847 -0.994 1.00 . A A . 44 CYS SG 1 1 1 654 1 1 45 PHE C C -0.693 -1.292 1.224 1.00 . A A . 45 PHE C 1 1 1 655 1 1 45 PHE CA C 0.220 -2.363 0.652 1.00 . A A . 45 PHE CA 1 1 1 656 1 1 45 PHE CB C 0.428 -3.483 1.667 1.00 . A A . 45 PHE CB 1 1 1 657 1 1 45 PHE CD1 C 2.068 -5.007 0.479 1.00 . A A . 45 PHE CD1 1 1 1 658 1 1 45 PHE CD2 C -0.139 -5.865 1.018 1.00 . A A . 45 PHE CD2 1 1 1 659 1 1 45 PHE CE1 C 2.418 -6.259 -0.053 1.00 . A A . 45 PHE CE1 1 1 1 660 1 1 45 PHE CE2 C 0.197 -7.105 0.453 1.00 . A A . 45 PHE CE2 1 1 1 661 1 1 45 PHE CG C 0.796 -4.816 1.045 1.00 . A A . 45 PHE CG 1 1 1 662 1 1 45 PHE CZ C 1.476 -7.303 -0.088 1.00 . A A . 45 PHE CZ 1 1 1 663 1 1 45 PHE H H 2.125 -1.521 1.075 1.00 . A A . 45 PHE H 1 1 1 664 1 1 45 PHE HA H -0.244 -2.796 -0.236 1.00 . A A . 45 PHE HA 1 1 1 665 1 1 45 PHE HB2 H 1.182 -3.158 2.376 1.00 . A A . 45 PHE HB2 1 1 1 666 1 1 45 PHE HB3 H -0.500 -3.605 2.220 1.00 . A A . 45 PHE HB3 1 1 1 667 1 1 45 PHE HD1 H 2.784 -4.197 0.482 1.00 . A A . 45 PHE HD1 1 1 1 668 1 1 45 PHE HD2 H -1.141 -5.715 1.379 1.00 . A A . 45 PHE HD2 1 1 1 669 1 1 45 PHE HE1 H 3.405 -6.403 -0.462 1.00 . A A . 45 PHE HE1 1 1 1 670 1 1 45 PHE HE2 H -0.535 -7.900 0.416 1.00 . A A . 45 PHE HE2 1 1 1 671 1 1 45 PHE HZ H 1.714 -8.248 -0.552 1.00 . A A . 45 PHE HZ 1 1 1 672 1 1 45 PHE N N 1.484 -1.734 0.317 1.00 . A A . 45 PHE N 1 1 1 673 1 1 45 PHE O O -0.245 -0.432 1.981 1.00 . A A . 45 PHE O 1 1 1 674 1 1 46 CYS C C -3.719 -1.391 2.521 1.00 . A A . 46 CYS C 1 1 1 675 1 1 46 CYS CA C -3.044 -0.581 1.426 1.00 . A A . 46 CYS CA 1 1 1 676 1 1 46 CYS CB C -4.042 -0.246 0.318 1.00 . A A . 46 CYS CB 1 1 1 677 1 1 46 CYS H H -2.246 -2.197 0.345 1.00 . A A . 46 CYS H 1 1 1 678 1 1 46 CYS HA H -2.675 0.336 1.888 1.00 . A A . 46 CYS HA 1 1 1 679 1 1 46 CYS HB2 H -4.425 -1.186 -0.077 1.00 . A A . 46 CYS HB2 1 1 1 680 1 1 46 CYS HB3 H -4.866 0.307 0.760 1.00 . A A . 46 CYS HB3 1 1 1 681 1 1 46 CYS N N -1.970 -1.384 0.882 1.00 . A A . 46 CYS N 1 1 1 682 1 1 46 CYS O O -3.627 -2.617 2.552 1.00 . A A . 46 CYS O 1 1 1 683 1 1 46 CYS SG S -3.440 0.720 -1.092 1.00 . A A . 46 CYS SG 1 1 1 684 1 1 47 TYR C C -6.342 -0.651 4.753 1.00 . A A . 47 TYR C 1 1 1 685 1 1 47 TYR CA C -4.959 -1.263 4.639 1.00 . A A . 47 TYR CA 1 1 1 686 1 1 47 TYR CB C -4.084 -0.852 5.823 1.00 . A A . 47 TYR CB 1 1 1 687 1 1 47 TYR CD1 C -1.706 -1.418 5.194 1.00 . A A . 47 TYR CD1 1 1 1 688 1 1 47 TYR CD2 C -2.790 -2.689 6.965 1.00 . A A . 47 TYR CD2 1 1 1 689 1 1 47 TYR CE1 C -0.519 -2.134 5.402 1.00 . A A . 47 TYR CE1 1 1 1 690 1 1 47 TYR CE2 C -1.591 -3.371 7.206 1.00 . A A . 47 TYR CE2 1 1 1 691 1 1 47 TYR CG C -2.833 -1.675 5.993 1.00 . A A . 47 TYR CG 1 1 1 692 1 1 47 TYR CZ C -0.458 -3.085 6.429 1.00 . A A . 47 TYR CZ 1 1 1 693 1 1 47 TYR H H -4.371 0.318 3.366 1.00 . A A . 47 TYR H 1 1 1 694 1 1 47 TYR HA H -5.026 -2.346 4.603 1.00 . A A . 47 TYR HA 1 1 1 695 1 1 47 TYR HB2 H -3.784 0.173 5.637 1.00 . A A . 47 TYR HB2 1 1 1 696 1 1 47 TYR HB3 H -4.646 -0.874 6.757 1.00 . A A . 47 TYR HB3 1 1 1 697 1 1 47 TYR HD1 H -1.748 -0.674 4.418 1.00 . A A . 47 TYR HD1 1 1 1 698 1 1 47 TYR HD2 H -3.671 -2.941 7.537 1.00 . A A . 47 TYR HD2 1 1 1 699 1 1 47 TYR HE1 H 0.332 -1.937 4.769 1.00 . A A . 47 TYR HE1 1 1 1 700 1 1 47 TYR HE2 H -1.559 -4.130 7.973 1.00 . A A . 47 TYR HE2 1 1 1 701 1 1 47 TYR HH H 0.645 -4.302 7.455 1.00 . A A . 47 TYR HH 1 1 1 702 1 1 47 TYR N N -4.364 -0.695 3.445 1.00 . A A . 47 TYR N 1 1 1 703 1 1 47 TYR O O -6.438 0.523 5.117 1.00 . A A . 47 TYR O 1 1 1 704 1 1 47 TYR OH O 0.702 -3.757 6.662 1.00 . A A . 47 TYR OH 1 1 1 705 1 1 48 PHE C C -9.394 -1.099 5.772 1.00 . A A . 48 PHE C 1 1 1 706 1 1 48 PHE CA C -8.729 -0.831 4.427 1.00 . A A . 48 PHE CA 1 1 1 707 1 1 48 PHE CB C -9.492 -1.556 3.312 1.00 . A A . 48 PHE CB 1 1 1 708 1 1 48 PHE CD1 C -7.921 -1.548 1.315 1.00 . A A . 48 PHE CD1 1 1 1 709 1 1 48 PHE CD2 C -9.970 -0.238 1.210 1.00 . A A . 48 PHE CD2 1 1 1 710 1 1 48 PHE CE1 C -7.530 -1.028 0.070 1.00 . A A . 48 PHE CE1 1 1 1 711 1 1 48 PHE CE2 C -9.575 0.282 -0.033 1.00 . A A . 48 PHE CE2 1 1 1 712 1 1 48 PHE CG C -9.121 -1.115 1.910 1.00 . A A . 48 PHE CG 1 1 1 713 1 1 48 PHE CZ C -8.337 -0.087 -0.587 1.00 . A A . 48 PHE CZ 1 1 1 714 1 1 48 PHE H H -7.314 -2.367 4.157 1.00 . A A . 48 PHE H 1 1 1 715 1 1 48 PHE HA H -8.732 0.237 4.227 1.00 . A A . 48 PHE HA 1 1 1 716 1 1 48 PHE HB2 H -9.353 -2.632 3.417 1.00 . A A . 48 PHE HB2 1 1 1 717 1 1 48 PHE HB3 H -10.545 -1.390 3.459 1.00 . A A . 48 PHE HB3 1 1 1 718 1 1 48 PHE HD1 H -7.275 -2.254 1.822 1.00 . A A . 48 PHE HD1 1 1 1 719 1 1 48 PHE HD2 H -10.896 0.108 1.648 1.00 . A A . 48 PHE HD2 1 1 1 720 1 1 48 PHE HE1 H -6.610 -1.349 -0.390 1.00 . A A . 48 PHE HE1 1 1 1 721 1 1 48 PHE HE2 H -10.210 0.998 -0.533 1.00 . A A . 48 PHE HE2 1 1 1 722 1 1 48 PHE HZ H -8.004 0.343 -1.520 1.00 . A A . 48 PHE HZ 1 1 1 723 1 1 48 PHE N N -7.397 -1.397 4.420 1.00 . A A . 48 PHE N 1 1 1 724 1 1 48 PHE O O -8.852 -1.848 6.582 1.00 . A A . 48 PHE O 1 1 1 725 1 1 49 ASN C C -11.006 -1.324 8.277 1.00 . A A . 49 ASN C 1 1 1 726 1 1 49 ASN CA C -11.626 -0.945 6.929 1.00 . A A . 49 ASN CA 1 1 1 727 1 1 49 ASN CB C -12.652 -1.953 6.379 1.00 . A A . 49 ASN CB 1 1 1 728 1 1 49 ASN CG C -12.041 -3.122 5.617 1.00 . A A . 49 ASN CG 1 1 1 729 1 1 49 ASN H H -10.944 0.013 5.179 1.00 . A A . 49 ASN H 1 1 1 730 1 1 49 ASN HA H -12.190 -0.034 7.130 1.00 . A A . 49 ASN HA 1 1 1 731 1 1 49 ASN HB2 H -13.284 -2.331 7.183 1.00 . A A . 49 ASN HB2 1 1 1 732 1 1 49 ASN HB3 H -13.299 -1.418 5.681 1.00 . A A . 49 ASN HB3 1 1 1 733 1 1 49 ASN HD21 H -10.958 -3.791 7.234 1.00 . A A . 49 ASN HD21 1 1 1 734 1 1 49 ASN HD22 H -10.891 -4.755 5.781 1.00 . A A . 49 ASN HD22 1 1 1 735 1 1 49 ASN N N -10.631 -0.601 5.914 1.00 . A A . 49 ASN N 1 1 1 736 1 1 49 ASN ND2 N -11.250 -3.955 6.273 1.00 . A A . 49 ASN ND2 1 1 1 737 1 1 49 ASN O O -11.378 -2.333 8.879 1.00 . A A . 49 ASN O 1 1 1 738 1 1 49 ASN OD1 O -12.263 -3.275 4.418 1.00 . A A . 49 ASN OD1 1 1 1 739 1 1 50 CYS C C -9.738 -0.732 11.181 1.00 . A A . 50 CYS C 1 1 1 740 1 1 50 CYS CA C -9.127 -0.925 9.802 1.00 . A A . 50 CYS CA 1 1 1 741 1 1 50 CYS CB C -7.786 -0.224 9.625 1.00 . A A . 50 CYS CB 1 1 1 742 1 1 50 CYS H H -9.760 0.264 8.154 1.00 . A A . 50 CYS H 1 1 1 743 1 1 50 CYS HA H -8.910 -1.974 9.695 1.00 . A A . 50 CYS HA 1 1 1 744 1 1 50 CYS HB2 H -7.328 -0.619 8.720 1.00 . A A . 50 CYS HB2 1 1 1 745 1 1 50 CYS HB3 H -7.990 0.831 9.499 1.00 . A A . 50 CYS HB3 1 1 1 746 1 1 50 CYS N N -10.036 -0.523 8.735 1.00 . A A . 50 CYS N 1 1 1 747 1 1 50 CYS O O -10.143 -1.758 11.812 1.00 . A A . 50 CYS O 1 1 1 748 1 1 50 CYS OXT O -9.842 0.426 11.691 1.00 . A A . 50 CYS OXT 1 1 1 749 1 1 50 CYS SG S -6.558 -0.373 10.940 1.00 . A A . 50 CYS SG 1 1 2 750 1 1 1 LEU C C -9.908 -4.905 9.303 1.00 . A A . 1 LEU C 1 1 2 751 1 1 1 LEU CA C -10.915 -5.295 10.380 1.00 . A A . 1 LEU CA 1 1 2 752 1 1 1 LEU CB C -10.845 -6.812 10.633 1.00 . A A . 1 LEU CB 1 1 2 753 1 1 1 LEU CD1 C -10.472 -6.846 13.150 1.00 . A A . 1 LEU CD1 1 1 2 754 1 1 1 LEU CD2 C -12.827 -6.890 12.266 1.00 . A A . 1 LEU CD2 1 1 2 755 1 1 1 LEU CG C -11.375 -7.295 11.994 1.00 . A A . 1 LEU CG 1 1 2 756 1 1 1 LEU H1 H -12.480 -5.340 9.040 1.00 . A A . 1 LEU H1 1 1 2 757 1 1 1 LEU H2 H -12.952 -5.123 10.640 1.00 . A A . 1 LEU H2 1 1 2 758 1 1 1 LEU H3 H -12.258 -3.850 9.788 1.00 . A A . 1 LEU H3 1 1 2 759 1 1 1 LEU HA H -10.665 -4.747 11.289 1.00 . A A . 1 LEU HA 1 1 2 760 1 1 1 LEU HB2 H -11.387 -7.328 9.838 1.00 . A A . 1 LEU HB2 1 1 2 761 1 1 1 LEU HB3 H -9.803 -7.127 10.571 1.00 . A A . 1 LEU HB3 1 1 2 762 1 1 1 LEU HD11 H -9.441 -7.141 12.953 1.00 . A A . 1 LEU HD11 1 1 2 763 1 1 1 LEU HD12 H -10.516 -5.767 13.288 1.00 . A A . 1 LEU HD12 1 1 2 764 1 1 1 LEU HD13 H -10.800 -7.327 14.072 1.00 . A A . 1 LEU HD13 1 1 2 765 1 1 1 LEU HD21 H -13.455 -7.155 11.413 1.00 . A A . 1 LEU HD21 1 1 2 766 1 1 1 LEU HD22 H -13.188 -7.428 13.143 1.00 . A A . 1 LEU HD22 1 1 2 767 1 1 1 LEU HD23 H -12.898 -5.823 12.467 1.00 . A A . 1 LEU HD23 1 1 2 768 1 1 1 LEU HG H -11.342 -8.386 11.971 1.00 . A A . 1 LEU HG 1 1 2 769 1 1 1 LEU N N -12.252 -4.870 9.928 1.00 . A A . 1 LEU N 1 1 2 770 1 1 1 LEU O O -10.288 -4.842 8.139 1.00 . A A . 1 LEU O 1 1 2 771 1 1 2 CYS C C -7.304 -4.966 7.640 1.00 . A A . 2 CYS C 1 1 2 772 1 1 2 CYS CA C -7.648 -4.045 8.805 1.00 . A A . 2 CYS CA 1 1 2 773 1 1 2 CYS CB C -6.432 -3.543 9.601 1.00 . A A . 2 CYS CB 1 1 2 774 1 1 2 CYS H H -8.410 -4.712 10.654 1.00 . A A . 2 CYS H 1 1 2 775 1 1 2 CYS HA H -8.093 -3.158 8.362 1.00 . A A . 2 CYS HA 1 1 2 776 1 1 2 CYS HB2 H -5.807 -4.399 9.848 1.00 . A A . 2 CYS HB2 1 1 2 777 1 1 2 CYS HB3 H -5.851 -2.861 8.991 1.00 . A A . 2 CYS HB3 1 1 2 778 1 1 2 CYS N N -8.664 -4.608 9.684 1.00 . A A . 2 CYS N 1 1 2 779 1 1 2 CYS O O -6.367 -5.758 7.695 1.00 . A A . 2 CYS O 1 1 2 780 1 1 2 CYS SG S -6.824 -2.740 11.181 1.00 . A A . 2 CYS SG 1 1 2 781 1 1 3 ASN C C -6.758 -5.206 4.636 1.00 . A A . 3 ASN C 1 1 2 782 1 1 3 ASN CA C -8.001 -5.673 5.388 1.00 . A A . 3 ASN CA 1 1 2 783 1 1 3 ASN CB C -9.276 -5.503 4.550 1.00 . A A . 3 ASN CB 1 1 2 784 1 1 3 ASN CG C -9.168 -6.097 3.153 1.00 . A A . 3 ASN CG 1 1 2 785 1 1 3 ASN H H -8.882 -4.215 6.643 1.00 . A A . 3 ASN H 1 1 2 786 1 1 3 ASN HA H -7.901 -6.722 5.679 1.00 . A A . 3 ASN HA 1 1 2 787 1 1 3 ASN HB2 H -10.132 -5.935 5.065 1.00 . A A . 3 ASN HB2 1 1 2 788 1 1 3 ASN HB3 H -9.449 -4.441 4.421 1.00 . A A . 3 ASN HB3 1 1 2 789 1 1 3 ASN HD21 H -9.153 -7.972 3.925 1.00 . A A . 3 ASN HD21 1 1 2 790 1 1 3 ASN HD22 H -9.075 -7.862 2.177 1.00 . A A . 3 ASN HD22 1 1 2 791 1 1 3 ASN N N -8.089 -4.838 6.565 1.00 . A A . 3 ASN N 1 1 2 792 1 1 3 ASN ND2 N -9.109 -7.419 3.080 1.00 . A A . 3 ASN ND2 1 1 2 793 1 1 3 ASN O O -6.842 -4.330 3.773 1.00 . A A . 3 ASN O 1 1 2 794 1 1 3 ASN OD1 O -9.187 -5.391 2.147 1.00 . A A . 3 ASN OD1 1 1 2 795 1 1 4 GLU C C -4.296 -6.209 3.097 1.00 . A A . 4 GLU C 1 1 2 796 1 1 4 GLU CA C -4.322 -5.483 4.438 1.00 . A A . 4 GLU CA 1 1 2 797 1 1 4 GLU CB C -3.247 -6.009 5.405 1.00 . A A . 4 GLU CB 1 1 2 798 1 1 4 GLU CD C -0.744 -6.388 5.708 1.00 . A A . 4 GLU CD 1 1 2 799 1 1 4 GLU CG C -1.863 -5.978 4.757 1.00 . A A . 4 GLU CG 1 1 2 800 1 1 4 GLU H H -5.612 -6.387 5.815 1.00 . A A . 4 GLU H 1 1 2 801 1 1 4 GLU HA H -4.180 -4.413 4.304 1.00 . A A . 4 GLU HA 1 1 2 802 1 1 4 GLU HB2 H -3.250 -5.409 6.314 1.00 . A A . 4 GLU HB2 1 1 2 803 1 1 4 GLU HB3 H -3.476 -7.043 5.671 1.00 . A A . 4 GLU HB3 1 1 2 804 1 1 4 GLU HG2 H -1.900 -6.705 3.951 1.00 . A A . 4 GLU HG2 1 1 2 805 1 1 4 GLU HG3 H -1.660 -4.986 4.357 1.00 . A A . 4 GLU HG3 1 1 2 806 1 1 4 GLU N N -5.607 -5.750 5.029 1.00 . A A . 4 GLU N 1 1 2 807 1 1 4 GLU O O -4.575 -7.404 3.046 1.00 . A A . 4 GLU O 1 1 2 808 1 1 4 GLU OE1 O -0.932 -7.545 6.396 1.00 . A A . 4 GLU OE1 1 1 2 809 1 1 4 GLU OE2 O 0.253 -5.672 5.809 1.00 . A A . 4 GLU OE2 1 1 2 810 1 1 5 ARG C C -2.744 -5.330 -0.081 1.00 . A A . 5 ARG C 1 1 2 811 1 1 5 ARG CA C -3.839 -6.073 0.697 1.00 . A A . 5 ARG CA 1 1 2 812 1 1 5 ARG CB C -5.195 -6.059 -0.021 1.00 . A A . 5 ARG CB 1 1 2 813 1 1 5 ARG CD C -6.979 -4.618 -1.074 1.00 . A A . 5 ARG CD 1 1 2 814 1 1 5 ARG CG C -5.818 -4.658 -0.074 1.00 . A A . 5 ARG CG 1 1 2 815 1 1 5 ARG CZ C -9.447 -4.336 -0.855 1.00 . A A . 5 ARG CZ 1 1 2 816 1 1 5 ARG H H -3.764 -4.502 2.115 1.00 . A A . 5 ARG H 1 1 2 817 1 1 5 ARG HA H -3.550 -7.113 0.813 1.00 . A A . 5 ARG HA 1 1 2 818 1 1 5 ARG HB2 H -5.046 -6.432 -1.033 1.00 . A A . 5 ARG HB2 1 1 2 819 1 1 5 ARG HB3 H -5.886 -6.729 0.496 1.00 . A A . 5 ARG HB3 1 1 2 820 1 1 5 ARG HD2 H -6.949 -3.642 -1.550 1.00 . A A . 5 ARG HD2 1 1 2 821 1 1 5 ARG HD3 H -6.858 -5.369 -1.858 1.00 . A A . 5 ARG HD3 1 1 2 822 1 1 5 ARG HG2 H -6.152 -4.361 0.923 1.00 . A A . 5 ARG HG2 1 1 2 823 1 1 5 ARG HG3 H -5.062 -3.945 -0.402 1.00 . A A . 5 ARG HG3 1 1 2 824 1 1 5 ARG HH11 H -8.745 -3.880 -2.716 1.00 . A A . 5 ARG HH11 1 1 2 825 1 1 5 ARG HH12 H -10.427 -3.516 -2.464 1.00 . A A . 5 ARG HH12 1 1 2 826 1 1 5 ARG HH21 H -10.360 -4.684 0.915 1.00 . A A . 5 ARG HH21 1 1 2 827 1 1 5 ARG HH22 H -11.407 -4.002 -0.310 1.00 . A A . 5 ARG HH22 1 1 2 828 1 1 5 ARG N N -3.965 -5.495 2.023 1.00 . A A . 5 ARG N 1 1 2 829 1 1 5 ARG NE N -8.272 -4.791 -0.398 1.00 . A A . 5 ARG NE 1 1 2 830 1 1 5 ARG NH1 N -9.560 -3.881 -2.106 1.00 . A A . 5 ARG NH1 1 1 2 831 1 1 5 ARG NH2 N -10.504 -4.355 -0.037 1.00 . A A . 5 ARG NH2 1 1 2 832 1 1 5 ARG O O -2.445 -4.179 0.254 1.00 . A A . 5 ARG O 1 1 2 833 1 1 6 PRO C C -1.434 -4.100 -2.594 1.00 . A A . 6 PRO C 1 1 2 834 1 1 6 PRO CA C -1.064 -5.409 -1.893 1.00 . A A . 6 PRO CA 1 1 2 835 1 1 6 PRO CB C -0.726 -6.469 -2.946 1.00 . A A . 6 PRO CB 1 1 2 836 1 1 6 PRO CD C -2.256 -7.410 -1.374 1.00 . A A . 6 PRO CD 1 1 2 837 1 1 6 PRO CG C -1.064 -7.782 -2.252 1.00 . A A . 6 PRO CG 1 1 2 838 1 1 6 PRO HA H -0.195 -5.242 -1.260 1.00 . A A . 6 PRO HA 1 1 2 839 1 1 6 PRO HB2 H -1.382 -6.355 -3.811 1.00 . A A . 6 PRO HB2 1 1 2 840 1 1 6 PRO HB3 H 0.317 -6.425 -3.259 1.00 . A A . 6 PRO HB3 1 1 2 841 1 1 6 PRO HD2 H -3.192 -7.581 -1.904 1.00 . A A . 6 PRO HD2 1 1 2 842 1 1 6 PRO HD3 H -2.208 -8.043 -0.488 1.00 . A A . 6 PRO HD3 1 1 2 843 1 1 6 PRO HG2 H -1.301 -8.577 -2.960 1.00 . A A . 6 PRO HG2 1 1 2 844 1 1 6 PRO HG3 H -0.225 -8.080 -1.623 1.00 . A A . 6 PRO HG3 1 1 2 845 1 1 6 PRO N N -2.114 -5.989 -1.072 1.00 . A A . 6 PRO N 1 1 2 846 1 1 6 PRO O O -2.581 -3.654 -2.607 1.00 . A A . 6 PRO O 1 1 2 847 1 1 7 SER C C -1.585 -2.573 -5.197 1.00 . A A . 7 SER C 1 1 2 848 1 1 7 SER CA C -0.479 -2.410 -4.152 1.00 . A A . 7 SER CA 1 1 2 849 1 1 7 SER CB C 0.875 -2.334 -4.858 1.00 . A A . 7 SER CB 1 1 2 850 1 1 7 SER H H 0.488 -3.983 -3.201 1.00 . A A . 7 SER H 1 1 2 851 1 1 7 SER HA H -0.624 -1.474 -3.609 1.00 . A A . 7 SER HA 1 1 2 852 1 1 7 SER HB2 H 0.688 -1.870 -5.823 1.00 . A A . 7 SER HB2 1 1 2 853 1 1 7 SER HB3 H 1.565 -1.717 -4.279 1.00 . A A . 7 SER HB3 1 1 2 854 1 1 7 SER HG H 0.711 -4.146 -5.484 1.00 . A A . 7 SER HG 1 1 2 855 1 1 7 SER N N -0.417 -3.541 -3.249 1.00 . A A . 7 SER N 1 1 2 856 1 1 7 SER O O -1.440 -3.400 -6.094 1.00 . A A . 7 SER O 1 1 2 857 1 1 7 SER OG O 1.417 -3.635 -5.059 1.00 . A A . 7 SER OG 1 1 2 858 1 1 8 GLN C C -3.118 -0.308 -7.019 1.00 . A A . 8 GLN C 1 1 2 859 1 1 8 GLN CA C -3.573 -1.520 -6.197 1.00 . A A . 8 GLN CA 1 1 2 860 1 1 8 GLN CB C -4.973 -1.319 -5.604 1.00 . A A . 8 GLN CB 1 1 2 861 1 1 8 GLN CD C -6.982 -2.564 -4.557 1.00 . A A . 8 GLN CD 1 1 2 862 1 1 8 GLN CG C -5.496 -2.599 -4.930 1.00 . A A . 8 GLN CG 1 1 2 863 1 1 8 GLN H H -2.699 -1.125 -4.327 1.00 . A A . 8 GLN H 1 1 2 864 1 1 8 GLN HA H -3.602 -2.385 -6.861 1.00 . A A . 8 GLN HA 1 1 2 865 1 1 8 GLN HB2 H -4.973 -0.501 -4.881 1.00 . A A . 8 GLN HB2 1 1 2 866 1 1 8 GLN HB3 H -5.614 -1.052 -6.437 1.00 . A A . 8 GLN HB3 1 1 2 867 1 1 8 GLN HE21 H -7.286 -0.689 -5.328 1.00 . A A . 8 GLN HE21 1 1 2 868 1 1 8 GLN HE22 H -8.698 -1.508 -4.700 1.00 . A A . 8 GLN HE22 1 1 2 869 1 1 8 GLN HG2 H -5.351 -3.439 -5.611 1.00 . A A . 8 GLN HG2 1 1 2 870 1 1 8 GLN HG3 H -4.917 -2.793 -4.025 1.00 . A A . 8 GLN HG3 1 1 2 871 1 1 8 GLN N N -2.622 -1.733 -5.122 1.00 . A A . 8 GLN N 1 1 2 872 1 1 8 GLN NE2 N -7.706 -1.497 -4.874 1.00 . A A . 8 GLN NE2 1 1 2 873 1 1 8 GLN O O -2.730 -0.449 -8.178 1.00 . A A . 8 GLN O 1 1 2 874 1 1 8 GLN OE1 O -7.501 -3.510 -3.967 1.00 . A A . 8 GLN OE1 1 1 2 875 1 1 9 THR C C -1.312 2.229 -7.328 1.00 . A A . 9 THR C 1 1 2 876 1 1 9 THR CA C -2.798 2.151 -7.029 1.00 . A A . 9 THR CA 1 1 2 877 1 1 9 THR CB C -3.118 3.252 -6.008 1.00 . A A . 9 THR CB 1 1 2 878 1 1 9 THR CG2 C -4.581 3.672 -6.105 1.00 . A A . 9 THR CG2 1 1 2 879 1 1 9 THR H H -3.362 0.951 -5.422 1.00 . A A . 9 THR H 1 1 2 880 1 1 9 THR HA H -3.366 2.296 -7.948 1.00 . A A . 9 THR HA 1 1 2 881 1 1 9 THR HB H -2.487 4.122 -6.214 1.00 . A A . 9 THR HB 1 1 2 882 1 1 9 THR HG1 H -2.933 3.455 -4.046 1.00 . A A . 9 THR HG1 1 1 2 883 1 1 9 THR HG21 H -4.797 4.034 -7.111 1.00 . A A . 9 THR HG21 1 1 2 884 1 1 9 THR HG22 H -5.224 2.823 -5.888 1.00 . A A . 9 THR HG22 1 1 2 885 1 1 9 THR HG23 H -4.768 4.469 -5.390 1.00 . A A . 9 THR HG23 1 1 2 886 1 1 9 THR N N -3.101 0.874 -6.397 1.00 . A A . 9 THR N 1 1 2 887 1 1 9 THR O O -0.886 2.586 -8.424 1.00 . A A . 9 THR O 1 1 2 888 1 1 9 THR OG1 O -2.852 2.748 -4.704 1.00 . A A . 9 THR OG1 1 1 2 889 1 1 10 TRP C C 1.403 0.727 -7.183 1.00 . A A . 10 TRP C 1 1 2 890 1 1 10 TRP CA C 0.925 1.950 -6.397 1.00 . A A . 10 TRP CA 1 1 2 891 1 1 10 TRP CB C 1.487 1.990 -4.977 1.00 . A A . 10 TRP CB 1 1 2 892 1 1 10 TRP CD1 C 3.981 1.738 -5.368 1.00 . A A . 10 TRP CD1 1 1 2 893 1 1 10 TRP CD2 C 3.438 3.682 -4.391 1.00 . A A . 10 TRP CD2 1 1 2 894 1 1 10 TRP CE2 C 4.836 3.721 -4.645 1.00 . A A . 10 TRP CE2 1 1 2 895 1 1 10 TRP CE3 C 2.865 4.807 -3.765 1.00 . A A . 10 TRP CE3 1 1 2 896 1 1 10 TRP CG C 2.912 2.428 -4.908 1.00 . A A . 10 TRP CG 1 1 2 897 1 1 10 TRP CH2 C 5.025 5.929 -3.687 1.00 . A A . 10 TRP CH2 1 1 2 898 1 1 10 TRP CZ2 C 5.626 4.827 -4.309 1.00 . A A . 10 TRP CZ2 1 1 2 899 1 1 10 TRP CZ3 C 3.643 5.923 -3.416 1.00 . A A . 10 TRP CZ3 1 1 2 900 1 1 10 TRP H H -0.961 1.708 -5.426 1.00 . A A . 10 TRP H 1 1 2 901 1 1 10 TRP HA H 1.236 2.857 -6.919 1.00 . A A . 10 TRP HA 1 1 2 902 1 1 10 TRP HB2 H 0.903 2.705 -4.394 1.00 . A A . 10 TRP HB2 1 1 2 903 1 1 10 TRP HB3 H 1.354 1.011 -4.518 1.00 . A A . 10 TRP HB3 1 1 2 904 1 1 10 TRP HD1 H 3.943 0.759 -5.829 1.00 . A A . 10 TRP HD1 1 1 2 905 1 1 10 TRP HE1 H 6.037 2.267 -5.584 1.00 . A A . 10 TRP HE1 1 1 2 906 1 1 10 TRP HE3 H 1.810 4.805 -3.553 1.00 . A A . 10 TRP HE3 1 1 2 907 1 1 10 TRP HH2 H 5.645 6.772 -3.439 1.00 . A A . 10 TRP HH2 1 1 2 908 1 1 10 TRP HZ2 H 6.676 4.838 -4.557 1.00 . A A . 10 TRP HZ2 1 1 2 909 1 1 10 TRP HZ3 H 3.146 6.766 -2.944 1.00 . A A . 10 TRP HZ3 1 1 2 910 1 1 10 TRP N N -0.516 1.924 -6.308 1.00 . A A . 10 TRP N 1 1 2 911 1 1 10 TRP NE1 N 5.113 2.515 -5.251 1.00 . A A . 10 TRP NE1 1 1 2 912 1 1 10 TRP O O 2.016 -0.177 -6.620 1.00 . A A . 10 TRP O 1 1 2 913 1 1 11 SER C C 2.814 -0.709 -9.646 1.00 . A A . 11 SER C 1 1 2 914 1 1 11 SER CA C 1.338 -0.558 -9.244 1.00 . A A . 11 SER CA 1 1 2 915 1 1 11 SER CB C 0.388 -0.563 -10.452 1.00 . A A . 11 SER CB 1 1 2 916 1 1 11 SER H H 0.490 1.353 -8.886 1.00 . A A . 11 SER H 1 1 2 917 1 1 11 SER HA H 1.102 -1.397 -8.588 1.00 . A A . 11 SER HA 1 1 2 918 1 1 11 SER HB2 H 0.829 0.009 -11.269 1.00 . A A . 11 SER HB2 1 1 2 919 1 1 11 SER HB3 H 0.227 -1.586 -10.797 1.00 . A A . 11 SER HB3 1 1 2 920 1 1 11 SER HG H -1.308 -0.394 -9.414 1.00 . A A . 11 SER HG 1 1 2 921 1 1 11 SER N N 1.105 0.652 -8.476 1.00 . A A . 11 SER N 1 1 2 922 1 1 11 SER O O 3.148 -0.715 -10.827 1.00 . A A . 11 SER O 1 1 2 923 1 1 11 SER OG O -0.846 0.061 -10.134 1.00 . A A . 11 SER OG 1 1 2 924 1 1 12 GLY C C 5.835 -1.280 -7.547 1.00 . A A . 12 GLY C 1 1 2 925 1 1 12 GLY CA C 5.131 -0.976 -8.868 1.00 . A A . 12 GLY CA 1 1 2 926 1 1 12 GLY H H 3.358 -0.835 -7.701 1.00 . A A . 12 GLY H 1 1 2 927 1 1 12 GLY HA2 H 5.336 -1.785 -9.571 1.00 . A A . 12 GLY HA2 1 1 2 928 1 1 12 GLY HA3 H 5.506 -0.040 -9.283 1.00 . A A . 12 GLY HA3 1 1 2 929 1 1 12 GLY N N 3.700 -0.854 -8.658 1.00 . A A . 12 GLY N 1 1 2 930 1 1 12 GLY O O 5.260 -1.943 -6.675 1.00 . A A . 12 GLY O 1 1 2 931 1 1 13 ASN C C 7.744 0.393 -5.385 1.00 . A A . 13 ASN C 1 1 2 932 1 1 13 ASN CA C 7.864 -0.905 -6.183 1.00 . A A . 13 ASN CA 1 1 2 933 1 1 13 ASN CB C 9.331 -1.193 -6.523 1.00 . A A . 13 ASN CB 1 1 2 934 1 1 13 ASN CG C 10.147 -1.556 -5.281 1.00 . A A . 13 ASN CG 1 1 2 935 1 1 13 ASN H H 7.447 -0.209 -8.135 1.00 . A A . 13 ASN H 1 1 2 936 1 1 13 ASN HA H 7.489 -1.744 -5.599 1.00 . A A . 13 ASN HA 1 1 2 937 1 1 13 ASN HB2 H 9.371 -2.040 -7.210 1.00 . A A . 13 ASN HB2 1 1 2 938 1 1 13 ASN HB3 H 9.777 -0.329 -7.018 1.00 . A A . 13 ASN HB3 1 1 2 939 1 1 13 ASN HD21 H 10.443 0.418 -4.722 1.00 . A A . 13 ASN HD21 1 1 2 940 1 1 13 ASN HD22 H 11.228 -0.798 -3.754 1.00 . A A . 13 ASN HD22 1 1 2 941 1 1 13 ASN N N 7.072 -0.795 -7.403 1.00 . A A . 13 ASN N 1 1 2 942 1 1 13 ASN ND2 N 10.648 -0.566 -4.544 1.00 . A A . 13 ASN ND2 1 1 2 943 1 1 13 ASN O O 7.580 1.461 -5.970 1.00 . A A . 13 ASN O 1 1 2 944 1 1 13 ASN OD1 O 10.328 -2.735 -4.978 1.00 . A A . 13 ASN OD1 1 1 2 945 1 1 14 CYS C C 8.854 2.440 -3.444 1.00 . A A . 14 CYS C 1 1 2 946 1 1 14 CYS CA C 7.773 1.412 -3.123 1.00 . A A . 14 CYS CA 1 1 2 947 1 1 14 CYS CB C 7.990 0.875 -1.706 1.00 . A A . 14 CYS CB 1 1 2 948 1 1 14 CYS H H 7.949 -0.622 -3.668 1.00 . A A . 14 CYS H 1 1 2 949 1 1 14 CYS HA H 6.787 1.876 -3.171 1.00 . A A . 14 CYS HA 1 1 2 950 1 1 14 CYS HB2 H 7.285 0.066 -1.510 1.00 . A A . 14 CYS HB2 1 1 2 951 1 1 14 CYS HB3 H 9.005 0.486 -1.641 1.00 . A A . 14 CYS HB3 1 1 2 952 1 1 14 CYS N N 7.811 0.301 -4.059 1.00 . A A . 14 CYS N 1 1 2 953 1 1 14 CYS O O 9.892 2.094 -4.012 1.00 . A A . 14 CYS O 1 1 2 954 1 1 14 CYS SG S 7.808 2.102 -0.392 1.00 . A A . 14 CYS SG 1 1 2 955 1 1 15 GLY C C 9.697 5.392 -1.696 1.00 . A A . 15 GLY C 1 1 2 956 1 1 15 GLY CA C 9.547 4.795 -3.092 1.00 . A A . 15 GLY CA 1 1 2 957 1 1 15 GLY H H 7.729 3.838 -2.564 1.00 . A A . 15 GLY H 1 1 2 958 1 1 15 GLY HA2 H 10.524 4.463 -3.434 1.00 . A A . 15 GLY HA2 1 1 2 959 1 1 15 GLY HA3 H 9.176 5.558 -3.776 1.00 . A A . 15 GLY HA3 1 1 2 960 1 1 15 GLY N N 8.602 3.687 -3.044 1.00 . A A . 15 GLY N 1 1 2 961 1 1 15 GLY O O 10.797 5.504 -1.168 1.00 . A A . 15 GLY O 1 1 2 962 1 1 16 ASN C C 7.152 5.738 0.887 1.00 . A A . 16 ASN C 1 1 2 963 1 1 16 ASN CA C 8.467 6.216 0.285 1.00 . A A . 16 ASN CA 1 1 2 964 1 1 16 ASN CB C 8.588 7.743 0.348 1.00 . A A . 16 ASN CB 1 1 2 965 1 1 16 ASN CG C 8.813 8.228 1.773 1.00 . A A . 16 ASN CG 1 1 2 966 1 1 16 ASN H H 7.697 5.623 -1.593 1.00 . A A . 16 ASN H 1 1 2 967 1 1 16 ASN HA H 9.294 5.785 0.853 1.00 . A A . 16 ASN HA 1 1 2 968 1 1 16 ASN HB2 H 9.445 8.052 -0.251 1.00 . A A . 16 ASN HB2 1 1 2 969 1 1 16 ASN HB3 H 7.693 8.225 -0.042 1.00 . A A . 16 ASN HB3 1 1 2 970 1 1 16 ASN HD21 H 10.238 9.564 1.185 1.00 . A A . 16 ASN HD21 1 1 2 971 1 1 16 ASN HD22 H 9.846 9.535 2.889 1.00 . A A . 16 ASN HD22 1 1 2 972 1 1 16 ASN N N 8.561 5.753 -1.093 1.00 . A A . 16 ASN N 1 1 2 973 1 1 16 ASN ND2 N 9.705 9.194 1.955 1.00 . A A . 16 ASN ND2 1 1 2 974 1 1 16 ASN O O 6.097 5.931 0.285 1.00 . A A . 16 ASN O 1 1 2 975 1 1 16 ASN OD1 O 8.165 7.759 2.705 1.00 . A A . 16 ASN OD1 1 1 2 976 1 1 17 THR C C 5.040 5.683 3.127 1.00 . A A . 17 THR C 1 1 2 977 1 1 17 THR CA C 6.024 4.575 2.719 1.00 . A A . 17 THR CA 1 1 2 978 1 1 17 THR CB C 6.428 3.635 3.864 1.00 . A A . 17 THR CB 1 1 2 979 1 1 17 THR CG2 C 6.971 4.375 5.091 1.00 . A A . 17 THR CG2 1 1 2 980 1 1 17 THR H H 8.097 5.030 2.535 1.00 . A A . 17 THR H 1 1 2 981 1 1 17 THR HA H 5.532 3.953 1.978 1.00 . A A . 17 THR HA 1 1 2 982 1 1 17 THR HB H 7.207 2.972 3.490 1.00 . A A . 17 THR HB 1 1 2 983 1 1 17 THR HG1 H 4.621 3.391 4.539 1.00 . A A . 17 THR HG1 1 1 2 984 1 1 17 THR HG21 H 7.818 5.003 4.810 1.00 . A A . 17 THR HG21 1 1 2 985 1 1 17 THR HG22 H 6.199 4.997 5.544 1.00 . A A . 17 THR HG22 1 1 2 986 1 1 17 THR HG23 H 7.309 3.646 5.829 1.00 . A A . 17 THR HG23 1 1 2 987 1 1 17 THR N N 7.206 5.116 2.068 1.00 . A A . 17 THR N 1 1 2 988 1 1 17 THR O O 3.833 5.451 3.193 1.00 . A A . 17 THR O 1 1 2 989 1 1 17 THR OG1 O 5.336 2.819 4.237 1.00 . A A . 17 THR OG1 1 1 2 990 1 1 18 ALA C C 3.802 8.232 2.283 1.00 . A A . 18 ALA C 1 1 2 991 1 1 18 ALA CA C 4.648 8.048 3.545 1.00 . A A . 18 ALA CA 1 1 2 992 1 1 18 ALA CB C 5.470 9.300 3.854 1.00 . A A . 18 ALA CB 1 1 2 993 1 1 18 ALA H H 6.530 7.069 3.301 1.00 . A A . 18 ALA H 1 1 2 994 1 1 18 ALA HA H 3.984 7.856 4.390 1.00 . A A . 18 ALA HA 1 1 2 995 1 1 18 ALA HB1 H 6.066 9.138 4.752 1.00 . A A . 18 ALA HB1 1 1 2 996 1 1 18 ALA HB2 H 6.134 9.539 3.023 1.00 . A A . 18 ALA HB2 1 1 2 997 1 1 18 ALA HB3 H 4.799 10.143 4.024 1.00 . A A . 18 ALA HB3 1 1 2 998 1 1 18 ALA N N 5.529 6.904 3.362 1.00 . A A . 18 ALA N 1 1 2 999 1 1 18 ALA O O 2.576 8.308 2.339 1.00 . A A . 18 ALA O 1 1 2 1000 1 1 19 HIS C C 2.831 7.206 -0.364 1.00 . A A . 19 HIS C 1 1 2 1001 1 1 19 HIS CA C 3.762 8.403 -0.151 1.00 . A A . 19 HIS CA 1 1 2 1002 1 1 19 HIS CB C 4.768 8.599 -1.293 1.00 . A A . 19 HIS CB 1 1 2 1003 1 1 19 HIS CD2 C 2.917 9.448 -2.937 1.00 . A A . 19 HIS CD2 1 1 2 1004 1 1 19 HIS CE1 C 4.144 9.535 -4.745 1.00 . A A . 19 HIS CE1 1 1 2 1005 1 1 19 HIS CG C 4.205 9.108 -2.601 1.00 . A A . 19 HIS CG 1 1 2 1006 1 1 19 HIS H H 5.451 8.085 1.122 1.00 . A A . 19 HIS H 1 1 2 1007 1 1 19 HIS HA H 3.156 9.307 -0.087 1.00 . A A . 19 HIS HA 1 1 2 1008 1 1 19 HIS HB2 H 5.501 9.327 -0.989 1.00 . A A . 19 HIS HB2 1 1 2 1009 1 1 19 HIS HB3 H 5.288 7.655 -1.451 1.00 . A A . 19 HIS HB3 1 1 2 1010 1 1 19 HIS HD1 H 5.993 9.168 -3.806 1.00 . A A . 19 HIS HD1 1 1 2 1011 1 1 19 HIS HD2 H 2.065 9.420 -2.273 1.00 . A A . 19 HIS HD2 1 1 2 1012 1 1 19 HIS HE1 H 4.438 9.634 -5.781 1.00 . A A . 19 HIS HE1 1 1 2 1013 1 1 19 HIS N N 4.457 8.265 1.119 1.00 . A A . 19 HIS N 1 1 2 1014 1 1 19 HIS ND1 N 4.991 9.285 -3.733 1.00 . A A . 19 HIS ND1 1 1 2 1015 1 1 19 HIS NE2 N 2.878 9.615 -4.309 1.00 . A A . 19 HIS NE2 1 1 2 1016 1 1 19 HIS O O 1.702 7.399 -0.804 1.00 . A A . 19 HIS O 1 1 2 1017 1 1 20 CYS C C 1.102 5.071 0.682 1.00 . A A . 20 CYS C 1 1 2 1018 1 1 20 CYS CA C 2.403 4.807 -0.068 1.00 . A A . 20 CYS CA 1 1 2 1019 1 1 20 CYS CB C 3.082 3.591 0.556 1.00 . A A . 20 CYS CB 1 1 2 1020 1 1 20 CYS H H 4.239 5.879 0.257 1.00 . A A . 20 CYS H 1 1 2 1021 1 1 20 CYS HA H 2.155 4.575 -1.104 1.00 . A A . 20 CYS HA 1 1 2 1022 1 1 20 CYS HB2 H 3.913 3.275 -0.070 1.00 . A A . 20 CYS HB2 1 1 2 1023 1 1 20 CYS HB3 H 3.451 3.841 1.537 1.00 . A A . 20 CYS HB3 1 1 2 1024 1 1 20 CYS N N 3.273 5.984 -0.041 1.00 . A A . 20 CYS N 1 1 2 1025 1 1 20 CYS O O 0.017 4.859 0.148 1.00 . A A . 20 CYS O 1 1 2 1026 1 1 20 CYS SG S 1.962 2.208 0.857 1.00 . A A . 20 CYS SG 1 1 2 1027 1 1 21 ASP C C -0.830 6.917 2.060 1.00 . A A . 21 ASP C 1 1 2 1028 1 1 21 ASP CA C 0.054 5.856 2.730 1.00 . A A . 21 ASP CA 1 1 2 1029 1 1 21 ASP CB C 0.525 6.321 4.112 1.00 . A A . 21 ASP CB 1 1 2 1030 1 1 21 ASP CG C -0.631 6.918 4.893 1.00 . A A . 21 ASP CG 1 1 2 1031 1 1 21 ASP H H 2.144 5.733 2.299 1.00 . A A . 21 ASP H 1 1 2 1032 1 1 21 ASP HA H -0.528 4.934 2.845 1.00 . A A . 21 ASP HA 1 1 2 1033 1 1 21 ASP HB2 H 0.947 5.482 4.664 1.00 . A A . 21 ASP HB2 1 1 2 1034 1 1 21 ASP HB3 H 1.288 7.090 4.019 1.00 . A A . 21 ASP HB3 1 1 2 1035 1 1 21 ASP N N 1.217 5.588 1.907 1.00 . A A . 21 ASP N 1 1 2 1036 1 1 21 ASP O O -2.055 6.756 2.024 1.00 . A A . 21 ASP O 1 1 2 1037 1 1 21 ASP OD1 O -1.604 6.039 5.242 1.00 . A A . 21 ASP OD1 1 1 2 1038 1 1 21 ASP OD2 O -0.648 8.119 5.135 1.00 . A A . 21 ASP OD2 1 1 2 1039 1 1 22 LYS C C -1.774 8.169 -0.375 1.00 . A A . 22 LYS C 1 1 2 1040 1 1 22 LYS CA C -0.984 8.924 0.684 1.00 . A A . 22 LYS CA 1 1 2 1041 1 1 22 LYS CB C -0.137 10.012 0.010 1.00 . A A . 22 LYS CB 1 1 2 1042 1 1 22 LYS CD C 1.357 12.056 0.520 1.00 . A A . 22 LYS CD 1 1 2 1043 1 1 22 LYS CE C 0.445 13.115 -0.119 1.00 . A A . 22 LYS CE 1 1 2 1044 1 1 22 LYS CG C 0.639 10.803 1.053 1.00 . A A . 22 LYS CG 1 1 2 1045 1 1 22 LYS H H 0.787 8.055 1.575 1.00 . A A . 22 LYS H 1 1 2 1046 1 1 22 LYS HA H -1.674 9.434 1.355 1.00 . A A . 22 LYS HA 1 1 2 1047 1 1 22 LYS HB2 H 0.550 9.573 -0.704 1.00 . A A . 22 LYS HB2 1 1 2 1048 1 1 22 LYS HB3 H -0.814 10.672 -0.529 1.00 . A A . 22 LYS HB3 1 1 2 1049 1 1 22 LYS HD2 H 1.900 12.507 1.355 1.00 . A A . 22 LYS HD2 1 1 2 1050 1 1 22 LYS HD3 H 2.098 11.749 -0.219 1.00 . A A . 22 LYS HD3 1 1 2 1051 1 1 22 LYS HE2 H 1.032 14.021 -0.287 1.00 . A A . 22 LYS HE2 1 1 2 1052 1 1 22 LYS HE3 H 0.095 12.758 -1.087 1.00 . A A . 22 LYS HE3 1 1 2 1053 1 1 22 LYS HG2 H -0.021 11.032 1.885 1.00 . A A . 22 LYS HG2 1 1 2 1054 1 1 22 LYS HG3 H 1.396 10.122 1.414 1.00 . A A . 22 LYS HG3 1 1 2 1055 1 1 22 LYS HZ1 H -0.927 14.451 0.651 1.00 . A A . 22 LYS HZ1 1 1 2 1056 1 1 22 LYS HZ2 H -1.541 12.906 0.398 1.00 . A A . 22 LYS HZ2 1 1 2 1057 1 1 22 LYS N N -0.223 7.972 1.492 1.00 . A A . 22 LYS N 1 1 2 1058 1 1 22 LYS NZ N -0.724 13.443 0.721 1.00 . A A . 22 LYS NZ 1 1 2 1059 1 1 22 LYS O O -2.997 8.294 -0.440 1.00 . A A . 22 LYS O 1 1 2 1060 1 1 23 GLN C C -2.597 5.398 -1.755 1.00 . A A . 23 GLN C 1 1 2 1061 1 1 23 GLN CA C -1.803 6.622 -2.239 1.00 . A A . 23 GLN CA 1 1 2 1062 1 1 23 GLN CB C -0.887 6.230 -3.399 1.00 . A A . 23 GLN CB 1 1 2 1063 1 1 23 GLN CD C 0.605 7.213 -5.235 1.00 . A A . 23 GLN CD 1 1 2 1064 1 1 23 GLN CG C 0.027 7.377 -3.841 1.00 . A A . 23 GLN CG 1 1 2 1065 1 1 23 GLN H H -0.108 7.215 -1.018 1.00 . A A . 23 GLN H 1 1 2 1066 1 1 23 GLN HA H -2.485 7.348 -2.654 1.00 . A A . 23 GLN HA 1 1 2 1067 1 1 23 GLN HB2 H -0.289 5.369 -3.108 1.00 . A A . 23 GLN HB2 1 1 2 1068 1 1 23 GLN HB3 H -1.541 5.950 -4.227 1.00 . A A . 23 GLN HB3 1 1 2 1069 1 1 23 GLN HE21 H 0.010 5.265 -5.383 1.00 . A A . 23 GLN HE21 1 1 2 1070 1 1 23 GLN HE22 H 0.761 5.967 -6.792 1.00 . A A . 23 GLN HE22 1 1 2 1071 1 1 23 GLN HG2 H -0.539 8.305 -3.850 1.00 . A A . 23 GLN HG2 1 1 2 1072 1 1 23 GLN HG3 H 0.862 7.451 -3.155 1.00 . A A . 23 GLN HG3 1 1 2 1073 1 1 23 GLN N N -1.103 7.337 -1.177 1.00 . A A . 23 GLN N 1 1 2 1074 1 1 23 GLN NE2 N 0.462 6.041 -5.839 1.00 . A A . 23 GLN NE2 1 1 2 1075 1 1 23 GLN O O -2.811 4.462 -2.525 1.00 . A A . 23 GLN O 1 1 2 1076 1 1 23 GLN OE1 O 1.182 8.163 -5.761 1.00 . A A . 23 GLN OE1 1 1 2 1077 1 1 24 CYS C C -5.227 5.259 0.624 1.00 . A A . 24 CYS C 1 1 2 1078 1 1 24 CYS CA C -4.057 4.482 0.027 1.00 . A A . 24 CYS CA 1 1 2 1079 1 1 24 CYS CB C -3.339 3.615 1.070 1.00 . A A . 24 CYS CB 1 1 2 1080 1 1 24 CYS H H -2.929 6.269 0.029 1.00 . A A . 24 CYS H 1 1 2 1081 1 1 24 CYS HA H -4.446 3.824 -0.751 1.00 . A A . 24 CYS HA 1 1 2 1082 1 1 24 CYS HB2 H -2.819 4.259 1.775 1.00 . A A . 24 CYS HB2 1 1 2 1083 1 1 24 CYS HB3 H -4.075 3.040 1.625 1.00 . A A . 24 CYS HB3 1 1 2 1084 1 1 24 CYS N N -3.145 5.462 -0.542 1.00 . A A . 24 CYS N 1 1 2 1085 1 1 24 CYS O O -6.385 4.998 0.287 1.00 . A A . 24 CYS O 1 1 2 1086 1 1 24 CYS SG S -2.138 2.417 0.430 1.00 . A A . 24 CYS SG 1 1 2 1087 1 1 25 GLN C C -6.449 8.117 0.887 1.00 . A A . 25 GLN C 1 1 2 1088 1 1 25 GLN CA C -5.960 7.159 1.975 1.00 . A A . 25 GLN CA 1 1 2 1089 1 1 25 GLN CB C -5.429 7.957 3.176 1.00 . A A . 25 GLN CB 1 1 2 1090 1 1 25 GLN CD C -4.869 7.808 5.640 1.00 . A A . 25 GLN CD 1 1 2 1091 1 1 25 GLN CG C -5.516 7.114 4.449 1.00 . A A . 25 GLN CG 1 1 2 1092 1 1 25 GLN H H -3.960 6.440 1.704 1.00 . A A . 25 GLN H 1 1 2 1093 1 1 25 GLN HA H -6.801 6.562 2.324 1.00 . A A . 25 GLN HA 1 1 2 1094 1 1 25 GLN HB2 H -4.400 8.271 2.997 1.00 . A A . 25 GLN HB2 1 1 2 1095 1 1 25 GLN HB3 H -6.045 8.847 3.321 1.00 . A A . 25 GLN HB3 1 1 2 1096 1 1 25 GLN HE21 H -6.397 9.143 5.799 1.00 . A A . 25 GLN HE21 1 1 2 1097 1 1 25 GLN HE22 H -5.093 9.315 6.960 1.00 . A A . 25 GLN HE22 1 1 2 1098 1 1 25 GLN HG2 H -6.560 6.914 4.690 1.00 . A A . 25 GLN HG2 1 1 2 1099 1 1 25 GLN HG3 H -5.017 6.169 4.261 1.00 . A A . 25 GLN HG3 1 1 2 1100 1 1 25 GLN N N -4.931 6.273 1.447 1.00 . A A . 25 GLN N 1 1 2 1101 1 1 25 GLN NE2 N -5.502 8.854 6.163 1.00 . A A . 25 GLN NE2 1 1 2 1102 1 1 25 GLN O O -7.642 8.153 0.566 1.00 . A A . 25 GLN O 1 1 2 1103 1 1 25 GLN OE1 O -3.790 7.421 6.079 1.00 . A A . 25 GLN OE1 1 1 2 1104 1 1 26 ASP C C -6.486 9.458 -1.810 1.00 . A A . 26 ASP C 1 1 2 1105 1 1 26 ASP CA C -5.895 10.027 -0.538 1.00 . A A . 26 ASP CA 1 1 2 1106 1 1 26 ASP CB C -4.702 10.939 -0.850 1.00 . A A . 26 ASP CB 1 1 2 1107 1 1 26 ASP CG C -4.157 11.661 0.382 1.00 . A A . 26 ASP CG 1 1 2 1108 1 1 26 ASP H H -4.548 8.678 0.424 1.00 . A A . 26 ASP H 1 1 2 1109 1 1 26 ASP HA H -6.657 10.631 -0.056 1.00 . A A . 26 ASP HA 1 1 2 1110 1 1 26 ASP HB2 H -3.908 10.387 -1.346 1.00 . A A . 26 ASP HB2 1 1 2 1111 1 1 26 ASP HB3 H -5.048 11.684 -1.561 1.00 . A A . 26 ASP HB3 1 1 2 1112 1 1 26 ASP N N -5.532 8.917 0.332 1.00 . A A . 26 ASP N 1 1 2 1113 1 1 26 ASP O O -7.599 9.804 -2.200 1.00 . A A . 26 ASP O 1 1 2 1114 1 1 26 ASP OD1 O -5.072 12.022 1.324 1.00 . A A . 26 ASP OD1 1 1 2 1115 1 1 26 ASP OD2 O -2.951 11.889 0.475 1.00 . A A . 26 ASP OD2 1 1 2 1116 1 1 27 TRP C C -7.230 6.880 -3.349 1.00 . A A . 27 TRP C 1 1 2 1117 1 1 27 TRP CA C -6.145 7.913 -3.659 1.00 . A A . 27 TRP CA 1 1 2 1118 1 1 27 TRP CB C -4.937 7.240 -4.318 1.00 . A A . 27 TRP CB 1 1 2 1119 1 1 27 TRP CD1 C -3.504 9.327 -4.501 1.00 . A A . 27 TRP CD1 1 1 2 1120 1 1 27 TRP CD2 C -3.142 7.876 -6.161 1.00 . A A . 27 TRP CD2 1 1 2 1121 1 1 27 TRP CE2 C -2.229 8.953 -6.348 1.00 . A A . 27 TRP CE2 1 1 2 1122 1 1 27 TRP CE3 C -3.119 6.836 -7.111 1.00 . A A . 27 TRP CE3 1 1 2 1123 1 1 27 TRP CG C -3.917 8.126 -4.957 1.00 . A A . 27 TRP CG 1 1 2 1124 1 1 27 TRP CH2 C -1.289 7.893 -8.311 1.00 . A A . 27 TRP CH2 1 1 2 1125 1 1 27 TRP CZ2 C -1.319 8.978 -7.415 1.00 . A A . 27 TRP CZ2 1 1 2 1126 1 1 27 TRP CZ3 C -2.192 6.832 -8.163 1.00 . A A . 27 TRP CZ3 1 1 2 1127 1 1 27 TRP H H -4.823 8.363 -2.030 1.00 . A A . 27 TRP H 1 1 2 1128 1 1 27 TRP HA H -6.551 8.654 -4.350 1.00 . A A . 27 TRP HA 1 1 2 1129 1 1 27 TRP HB2 H -4.430 6.584 -3.615 1.00 . A A . 27 TRP HB2 1 1 2 1130 1 1 27 TRP HB3 H -5.337 6.625 -5.124 1.00 . A A . 27 TRP HB3 1 1 2 1131 1 1 27 TRP HD1 H -3.869 9.822 -3.618 1.00 . A A . 27 TRP HD1 1 1 2 1132 1 1 27 TRP HE1 H -2.022 10.693 -5.141 1.00 . A A . 27 TRP HE1 1 1 2 1133 1 1 27 TRP HE3 H -3.838 6.042 -7.035 1.00 . A A . 27 TRP HE3 1 1 2 1134 1 1 27 TRP HH2 H -0.578 7.857 -9.118 1.00 . A A . 27 TRP HH2 1 1 2 1135 1 1 27 TRP HZ2 H -0.635 9.805 -7.538 1.00 . A A . 27 TRP HZ2 1 1 2 1136 1 1 27 TRP HZ3 H -2.179 6.012 -8.868 1.00 . A A . 27 TRP HZ3 1 1 2 1137 1 1 27 TRP N N -5.736 8.548 -2.424 1.00 . A A . 27 TRP N 1 1 2 1138 1 1 27 TRP NE1 N -2.496 9.817 -5.300 1.00 . A A . 27 TRP NE1 1 1 2 1139 1 1 27 TRP O O -8.420 7.144 -3.513 1.00 . A A . 27 TRP O 1 1 2 1140 1 1 28 GLU C C -8.887 4.416 -2.453 1.00 . A A . 28 GLU C 1 1 2 1141 1 1 28 GLU CA C -7.564 4.487 -3.201 1.00 . A A . 28 GLU CA 1 1 2 1142 1 1 28 GLU CB C -6.690 3.261 -2.901 1.00 . A A . 28 GLU CB 1 1 2 1143 1 1 28 GLU CD C -7.849 1.775 -4.641 1.00 . A A . 28 GLU CD 1 1 2 1144 1 1 28 GLU CG C -7.393 1.928 -3.191 1.00 . A A . 28 GLU CG 1 1 2 1145 1 1 28 GLU H H -5.859 5.587 -2.624 1.00 . A A . 28 GLU H 1 1 2 1146 1 1 28 GLU HA H -7.770 4.515 -4.272 1.00 . A A . 28 GLU HA 1 1 2 1147 1 1 28 GLU HB2 H -5.772 3.311 -3.488 1.00 . A A . 28 GLU HB2 1 1 2 1148 1 1 28 GLU HB3 H -6.418 3.263 -1.846 1.00 . A A . 28 GLU HB3 1 1 2 1149 1 1 28 GLU HG2 H -6.677 1.136 -2.976 1.00 . A A . 28 GLU HG2 1 1 2 1150 1 1 28 GLU HG3 H -8.248 1.803 -2.527 1.00 . A A . 28 GLU HG3 1 1 2 1151 1 1 28 GLU N N -6.830 5.699 -2.873 1.00 . A A . 28 GLU N 1 1 2 1152 1 1 28 GLU O O -9.906 4.188 -3.099 1.00 . A A . 28 GLU O 1 1 2 1153 1 1 28 GLU OE1 O -9.052 2.322 -4.975 1.00 . A A . 28 GLU OE1 1 1 2 1154 1 1 28 GLU OE2 O -7.135 1.144 -5.419 1.00 . A A . 28 GLU OE2 1 1 2 1155 1 1 29 LYS C C -9.694 3.684 0.962 1.00 . A A . 29 LYS C 1 1 2 1156 1 1 29 LYS CA C -9.884 4.726 -0.142 1.00 . A A . 29 LYS CA 1 1 2 1157 1 1 29 LYS CB C -11.304 4.746 -0.702 1.00 . A A . 29 LYS CB 1 1 2 1158 1 1 29 LYS CD C -11.789 7.261 -0.584 1.00 . A A . 29 LYS CD 1 1 2 1159 1 1 29 LYS CE C -11.086 8.481 -1.195 1.00 . A A . 29 LYS CE 1 1 2 1160 1 1 29 LYS CG C -11.693 6.014 -1.484 1.00 . A A . 29 LYS CG 1 1 2 1161 1 1 29 LYS H H -7.934 4.618 -0.702 1.00 . A A . 29 LYS H 1 1 2 1162 1 1 29 LYS HA H -9.686 5.689 0.326 1.00 . A A . 29 LYS HA 1 1 2 1163 1 1 29 LYS HB2 H -11.512 3.844 -1.278 1.00 . A A . 29 LYS HB2 1 1 2 1164 1 1 29 LYS HB3 H -11.907 4.715 0.187 1.00 . A A . 29 LYS HB3 1 1 2 1165 1 1 29 LYS HD2 H -12.847 7.503 -0.455 1.00 . A A . 29 LYS HD2 1 1 2 1166 1 1 29 LYS HD3 H -11.390 7.070 0.411 1.00 . A A . 29 LYS HD3 1 1 2 1167 1 1 29 LYS HE2 H -11.526 8.701 -2.171 1.00 . A A . 29 LYS HE2 1 1 2 1168 1 1 29 LYS HE3 H -11.250 9.341 -0.543 1.00 . A A . 29 LYS HE3 1 1 2 1169 1 1 29 LYS HG2 H -11.011 6.175 -2.316 1.00 . A A . 29 LYS HG2 1 1 2 1170 1 1 29 LYS HG3 H -12.677 5.834 -1.920 1.00 . A A . 29 LYS HG3 1 1 2 1171 1 1 29 LYS HZ1 H -9.442 7.303 -1.618 1.00 . A A . 29 LYS HZ1 1 1 2 1172 1 1 29 LYS HZ2 H -9.276 8.909 -2.092 1.00 . A A . 29 LYS HZ2 1 1 2 1173 1 1 29 LYS N N -8.839 4.513 -1.121 1.00 . A A . 29 LYS N 1 1 2 1174 1 1 29 LYS NZ N -9.629 8.282 -1.356 1.00 . A A . 29 LYS NZ 1 1 2 1175 1 1 29 LYS O O -10.578 2.867 1.217 1.00 . A A . 29 LYS O 1 1 2 1176 1 1 30 ALA C C -7.722 3.478 3.862 1.00 . A A . 30 ALA C 1 1 2 1177 1 1 30 ALA CA C -8.131 2.723 2.600 1.00 . A A . 30 ALA CA 1 1 2 1178 1 1 30 ALA CB C -6.996 1.869 2.032 1.00 . A A . 30 ALA CB 1 1 2 1179 1 1 30 ALA H H -7.824 4.385 1.339 1.00 . A A . 30 ALA H 1 1 2 1180 1 1 30 ALA HA H -8.974 2.083 2.855 1.00 . A A . 30 ALA HA 1 1 2 1181 1 1 30 ALA HB1 H -6.204 2.519 1.672 1.00 . A A . 30 ALA HB1 1 1 2 1182 1 1 30 ALA HB2 H -6.592 1.206 2.788 1.00 . A A . 30 ALA HB2 1 1 2 1183 1 1 30 ALA HB3 H -7.372 1.276 1.197 1.00 . A A . 30 ALA HB3 1 1 2 1184 1 1 30 ALA N N -8.516 3.685 1.585 1.00 . A A . 30 ALA N 1 1 2 1185 1 1 30 ALA O O -7.343 4.644 3.781 1.00 . A A . 30 ALA O 1 1 2 1186 1 1 31 SER C C -6.079 3.980 6.348 1.00 . A A . 31 SER C 1 1 2 1187 1 1 31 SER CA C -7.516 3.457 6.302 1.00 . A A . 31 SER CA 1 1 2 1188 1 1 31 SER CB C -7.755 2.422 7.392 1.00 . A A . 31 SER CB 1 1 2 1189 1 1 31 SER H H -7.983 1.843 5.078 1.00 . A A . 31 SER H 1 1 2 1190 1 1 31 SER HA H -8.202 4.285 6.467 1.00 . A A . 31 SER HA 1 1 2 1191 1 1 31 SER HB2 H -7.087 1.583 7.226 1.00 . A A . 31 SER HB2 1 1 2 1192 1 1 31 SER HB3 H -7.495 2.887 8.329 1.00 . A A . 31 SER HB3 1 1 2 1193 1 1 31 SER HG H -9.382 1.672 6.576 1.00 . A A . 31 SER HG 1 1 2 1194 1 1 31 SER N N -7.805 2.838 5.030 1.00 . A A . 31 SER N 1 1 2 1195 1 1 31 SER O O -5.842 5.073 6.852 1.00 . A A . 31 SER O 1 1 2 1196 1 1 31 SER OG O -9.106 1.984 7.451 1.00 . A A . 31 SER OG 1 1 2 1197 1 1 32 HIS C C -3.033 2.839 4.611 1.00 . A A . 32 HIS C 1 1 2 1198 1 1 32 HIS CA C -3.749 3.689 5.652 1.00 . A A . 32 HIS CA 1 1 2 1199 1 1 32 HIS CB C -2.969 3.723 6.985 1.00 . A A . 32 HIS CB 1 1 2 1200 1 1 32 HIS CD2 C -2.928 1.287 7.750 1.00 . A A . 32 HIS CD2 1 1 2 1201 1 1 32 HIS CE1 C -0.798 0.917 7.803 1.00 . A A . 32 HIS CE1 1 1 2 1202 1 1 32 HIS CG C -2.307 2.434 7.381 1.00 . A A . 32 HIS CG 1 1 2 1203 1 1 32 HIS H H -5.358 2.336 5.376 1.00 . A A . 32 HIS H 1 1 2 1204 1 1 32 HIS HA H -3.820 4.699 5.250 1.00 . A A . 32 HIS HA 1 1 2 1205 1 1 32 HIS HB2 H -2.165 4.431 6.931 1.00 . A A . 32 HIS HB2 1 1 2 1206 1 1 32 HIS HB3 H -3.624 4.055 7.792 1.00 . A A . 32 HIS HB3 1 1 2 1207 1 1 32 HIS HD1 H -0.200 2.786 7.018 1.00 . A A . 32 HIS HD1 1 1 2 1208 1 1 32 HIS HD2 H -3.983 1.188 7.671 1.00 . A A . 32 HIS HD2 1 1 2 1209 1 1 32 HIS HE1 H 0.138 0.391 7.885 1.00 . A A . 32 HIS HE1 1 1 2 1210 1 1 32 HIS N N -5.113 3.205 5.838 1.00 . A A . 32 HIS N 1 1 2 1211 1 1 32 HIS ND1 N -0.941 2.189 7.386 1.00 . A A . 32 HIS ND1 1 1 2 1212 1 1 32 HIS NE2 N -1.979 0.348 8.080 1.00 . A A . 32 HIS NE2 1 1 2 1213 1 1 32 HIS O O -3.600 1.858 4.119 1.00 . A A . 32 HIS O 1 1 2 1214 1 1 33 GLY C C 0.442 2.133 4.376 1.00 . A A . 33 GLY C 1 1 2 1215 1 1 33 GLY CA C -0.833 2.391 3.582 1.00 . A A . 33 GLY CA 1 1 2 1216 1 1 33 GLY H H -1.414 4.042 4.768 1.00 . A A . 33 GLY H 1 1 2 1217 1 1 33 GLY HA2 H -1.293 1.464 3.322 1.00 . A A . 33 GLY HA2 1 1 2 1218 1 1 33 GLY HA3 H -0.567 2.855 2.647 1.00 . A A . 33 GLY HA3 1 1 2 1219 1 1 33 GLY N N -1.776 3.200 4.338 1.00 . A A . 33 GLY N 1 1 2 1220 1 1 33 GLY O O 0.694 2.822 5.366 1.00 . A A . 33 GLY O 1 1 2 1221 1 1 34 ALA C C 3.312 -0.068 3.508 1.00 . A A . 34 ALA C 1 1 2 1222 1 1 34 ALA CA C 2.558 0.857 4.474 1.00 . A A . 34 ALA CA 1 1 2 1223 1 1 34 ALA CB C 2.462 0.253 5.881 1.00 . A A . 34 ALA CB 1 1 2 1224 1 1 34 ALA H H 0.910 0.572 3.165 1.00 . A A . 34 ALA H 1 1 2 1225 1 1 34 ALA HA H 3.089 1.804 4.548 1.00 . A A . 34 ALA HA 1 1 2 1226 1 1 34 ALA HB1 H 1.881 -0.666 5.866 1.00 . A A . 34 ALA HB1 1 1 2 1227 1 1 34 ALA HB2 H 3.460 0.036 6.258 1.00 . A A . 34 ALA HB2 1 1 2 1228 1 1 34 ALA HB3 H 1.988 0.962 6.560 1.00 . A A . 34 ALA HB3 1 1 2 1229 1 1 34 ALA N N 1.226 1.136 3.951 1.00 . A A . 34 ALA N 1 1 2 1230 1 1 34 ALA O O 2.735 -1.037 3.009 1.00 . A A . 34 ALA O 1 1 2 1231 1 1 35 CYS C C 5.932 -1.829 2.958 1.00 . A A . 35 CYS C 1 1 2 1232 1 1 35 CYS CA C 5.393 -0.558 2.293 1.00 . A A . 35 CYS CA 1 1 2 1233 1 1 35 CYS CB C 6.534 0.307 1.758 1.00 . A A . 35 CYS CB 1 1 2 1234 1 1 35 CYS H H 5.030 1.047 3.616 1.00 . A A . 35 CYS H 1 1 2 1235 1 1 35 CYS HA H 4.781 -0.826 1.442 1.00 . A A . 35 CYS HA 1 1 2 1236 1 1 35 CYS HB2 H 7.062 0.790 2.580 1.00 . A A . 35 CYS HB2 1 1 2 1237 1 1 35 CYS HB3 H 7.232 -0.350 1.263 1.00 . A A . 35 CYS HB3 1 1 2 1238 1 1 35 CYS N N 4.585 0.225 3.218 1.00 . A A . 35 CYS N 1 1 2 1239 1 1 35 CYS O O 6.242 -1.817 4.151 1.00 . A A . 35 CYS O 1 1 2 1240 1 1 35 CYS SG S 6.033 1.541 0.535 1.00 . A A . 35 CYS SG 1 1 2 1241 1 1 36 HIS C C 7.403 -4.886 1.555 1.00 . A A . 36 HIS C 1 1 2 1242 1 1 36 HIS CA C 6.659 -4.187 2.686 1.00 . A A . 36 HIS CA 1 1 2 1243 1 1 36 HIS CB C 5.630 -5.204 3.165 1.00 . A A . 36 HIS CB 1 1 2 1244 1 1 36 HIS CD2 C 3.164 -4.972 3.777 1.00 . A A . 36 HIS CD2 1 1 2 1245 1 1 36 HIS CE1 C 3.347 -3.570 5.440 1.00 . A A . 36 HIS CE1 1 1 2 1246 1 1 36 HIS CG C 4.478 -4.659 3.943 1.00 . A A . 36 HIS CG 1 1 2 1247 1 1 36 HIS H H 5.708 -2.924 1.254 1.00 . A A . 36 HIS H 1 1 2 1248 1 1 36 HIS HA H 7.328 -3.983 3.518 1.00 . A A . 36 HIS HA 1 1 2 1249 1 1 36 HIS HB2 H 5.217 -5.715 2.293 1.00 . A A . 36 HIS HB2 1 1 2 1250 1 1 36 HIS HB3 H 6.135 -5.958 3.771 1.00 . A A . 36 HIS HB3 1 1 2 1251 1 1 36 HIS HD1 H 5.416 -3.180 5.187 1.00 . A A . 36 HIS HD1 1 1 2 1252 1 1 36 HIS HD2 H 2.825 -5.626 2.985 1.00 . A A . 36 HIS HD2 1 1 2 1253 1 1 36 HIS HE1 H 3.104 -2.903 6.254 1.00 . A A . 36 HIS HE1 1 1 2 1254 1 1 36 HIS N N 6.039 -2.944 2.217 1.00 . A A . 36 HIS N 1 1 2 1255 1 1 36 HIS ND1 N 4.587 -3.725 4.955 1.00 . A A . 36 HIS ND1 1 1 2 1256 1 1 36 HIS NE2 N 2.460 -4.343 4.785 1.00 . A A . 36 HIS NE2 1 1 2 1257 1 1 36 HIS O O 6.897 -4.916 0.435 1.00 . A A . 36 HIS O 1 1 2 1258 1 1 37 LYS C C 8.612 -7.764 0.864 1.00 . A A . 37 LYS C 1 1 2 1259 1 1 37 LYS CA C 9.242 -6.375 0.915 1.00 . A A . 37 LYS CA 1 1 2 1260 1 1 37 LYS CB C 10.726 -6.426 1.275 1.00 . A A . 37 LYS CB 1 1 2 1261 1 1 37 LYS CD C 12.982 -7.499 0.602 1.00 . A A . 37 LYS CD 1 1 2 1262 1 1 37 LYS CE C 14.095 -6.487 0.287 1.00 . A A . 37 LYS CE 1 1 2 1263 1 1 37 LYS CG C 11.588 -7.019 0.153 1.00 . A A . 37 LYS CG 1 1 2 1264 1 1 37 LYS H H 8.832 -5.548 2.828 1.00 . A A . 37 LYS H 1 1 2 1265 1 1 37 LYS HA H 9.198 -5.925 -0.067 1.00 . A A . 37 LYS HA 1 1 2 1266 1 1 37 LYS HB2 H 11.034 -5.413 1.402 1.00 . A A . 37 LYS HB2 1 1 2 1267 1 1 37 LYS HB3 H 10.862 -6.935 2.220 1.00 . A A . 37 LYS HB3 1 1 2 1268 1 1 37 LYS HD2 H 12.975 -7.729 1.670 1.00 . A A . 37 LYS HD2 1 1 2 1269 1 1 37 LYS HD3 H 13.197 -8.430 0.080 1.00 . A A . 37 LYS HD3 1 1 2 1270 1 1 37 LYS HE2 H 13.862 -5.944 -0.631 1.00 . A A . 37 LYS HE2 1 1 2 1271 1 1 37 LYS HE3 H 14.162 -5.780 1.115 1.00 . A A . 37 LYS HE3 1 1 2 1272 1 1 37 LYS HG2 H 11.059 -7.883 -0.213 1.00 . A A . 37 LYS HG2 1 1 2 1273 1 1 37 LYS HG3 H 11.646 -6.314 -0.677 1.00 . A A . 37 LYS HG3 1 1 2 1274 1 1 37 LYS HZ1 H 15.266 -8.153 -0.059 1.00 . A A . 37 LYS HZ1 1 1 2 1275 1 1 37 LYS HZ2 H 15.857 -6.745 -0.762 1.00 . A A . 37 LYS HZ2 1 1 2 1276 1 1 37 LYS N N 8.518 -5.548 1.869 1.00 . A A . 37 LYS N 1 1 2 1277 1 1 37 LYS NZ N 15.405 -7.142 0.075 1.00 . A A . 37 LYS NZ 1 1 2 1278 1 1 37 LYS O O 8.479 -8.436 1.883 1.00 . A A . 37 LYS O 1 1 2 1279 1 1 38 ARG C C 8.150 -9.946 -1.948 1.00 . A A . 38 ARG C 1 1 2 1280 1 1 38 ARG CA C 7.562 -9.433 -0.632 1.00 . A A . 38 ARG CA 1 1 2 1281 1 1 38 ARG CB C 6.064 -9.141 -0.741 1.00 . A A . 38 ARG CB 1 1 2 1282 1 1 38 ARG CD C 5.105 -11.267 0.334 1.00 . A A . 38 ARG CD 1 1 2 1283 1 1 38 ARG CG C 5.177 -10.375 -0.918 1.00 . A A . 38 ARG CG 1 1 2 1284 1 1 38 ARG CZ C 6.465 -13.070 1.416 1.00 . A A . 38 ARG CZ 1 1 2 1285 1 1 38 ARG H H 8.307 -7.518 -1.110 1.00 . A A . 38 ARG H 1 1 2 1286 1 1 38 ARG HA H 7.748 -10.147 0.172 1.00 . A A . 38 ARG HA 1 1 2 1287 1 1 38 ARG HB2 H 5.744 -8.605 0.154 1.00 . A A . 38 ARG HB2 1 1 2 1288 1 1 38 ARG HB3 H 5.911 -8.483 -1.598 1.00 . A A . 38 ARG HB3 1 1 2 1289 1 1 38 ARG HD2 H 5.182 -10.629 1.217 1.00 . A A . 38 ARG HD2 1 1 2 1290 1 1 38 ARG HD3 H 4.126 -11.753 0.343 1.00 . A A . 38 ARG HD3 1 1 2 1291 1 1 38 ARG HG2 H 4.176 -9.989 -1.109 1.00 . A A . 38 ARG HG2 1 1 2 1292 1 1 38 ARG HG3 H 5.490 -10.940 -1.794 1.00 . A A . 38 ARG HG3 1 1 2 1293 1 1 38 ARG HH11 H 5.235 -12.089 2.710 1.00 . A A . 38 ARG HH11 1 1 2 1294 1 1 38 ARG HH12 H 6.166 -13.363 3.431 1.00 . A A . 38 ARG HH12 1 1 2 1295 1 1 38 ARG HH21 H 7.702 -14.258 0.341 1.00 . A A . 38 ARG HH21 1 1 2 1296 1 1 38 ARG HH22 H 7.633 -14.649 2.042 1.00 . A A . 38 ARG HH22 1 1 2 1297 1 1 38 ARG N N 8.222 -8.175 -0.341 1.00 . A A . 38 ARG N 1 1 2 1298 1 1 38 ARG NE N 6.125 -12.332 0.345 1.00 . A A . 38 ARG NE 1 1 2 1299 1 1 38 ARG NH1 N 5.922 -12.820 2.614 1.00 . A A . 38 ARG NH1 1 1 2 1300 1 1 38 ARG NH2 N 7.346 -14.062 1.273 1.00 . A A . 38 ARG NH2 1 1 2 1301 1 1 38 ARG O O 8.157 -9.212 -2.932 1.00 . A A . 38 ARG O 1 1 2 1302 1 1 39 GLU C C 10.478 -10.720 -3.635 1.00 . A A . 39 GLU C 1 1 2 1303 1 1 39 GLU CA C 9.446 -11.718 -3.092 1.00 . A A . 39 GLU CA 1 1 2 1304 1 1 39 GLU CB C 8.479 -12.210 -4.182 1.00 . A A . 39 GLU CB 1 1 2 1305 1 1 39 GLU CD C 7.753 -14.108 -2.644 1.00 . A A . 39 GLU CD 1 1 2 1306 1 1 39 GLU CG C 7.309 -13.045 -3.639 1.00 . A A . 39 GLU CG 1 1 2 1307 1 1 39 GLU H H 8.657 -11.728 -1.123 1.00 . A A . 39 GLU H 1 1 2 1308 1 1 39 GLU HA H 10.014 -12.577 -2.728 1.00 . A A . 39 GLU HA 1 1 2 1309 1 1 39 GLU HB2 H 8.065 -11.352 -4.712 1.00 . A A . 39 GLU HB2 1 1 2 1310 1 1 39 GLU HB3 H 9.047 -12.812 -4.892 1.00 . A A . 39 GLU HB3 1 1 2 1311 1 1 39 GLU HG2 H 6.591 -12.387 -3.155 1.00 . A A . 39 GLU HG2 1 1 2 1312 1 1 39 GLU HG3 H 6.804 -13.531 -4.475 1.00 . A A . 39 GLU HG3 1 1 2 1313 1 1 39 GLU N N 8.710 -11.161 -1.956 1.00 . A A . 39 GLU N 1 1 2 1314 1 1 39 GLU O O 10.640 -10.555 -4.840 1.00 . A A . 39 GLU O 1 1 2 1315 1 1 39 GLU OE1 O 8.237 -15.263 -3.173 1.00 . A A . 39 GLU OE1 1 1 2 1316 1 1 39 GLU OE2 O 7.664 -13.869 -1.436 1.00 . A A . 39 GLU OE2 1 1 2 1317 1 1 40 ASN C C 11.632 -7.781 -3.689 1.00 . A A . 40 ASN C 1 1 2 1318 1 1 40 ASN CA C 12.164 -9.015 -2.959 1.00 . A A . 40 ASN CA 1 1 2 1319 1 1 40 ASN CB C 13.358 -9.619 -3.685 1.00 . A A . 40 ASN CB 1 1 2 1320 1 1 40 ASN CG C 14.624 -8.783 -3.504 1.00 . A A . 40 ASN CG 1 1 2 1321 1 1 40 ASN H H 11.039 -10.318 -1.763 1.00 . A A . 40 ASN H 1 1 2 1322 1 1 40 ASN HA H 12.492 -8.682 -1.981 1.00 . A A . 40 ASN HA 1 1 2 1323 1 1 40 ASN HB2 H 13.533 -10.625 -3.313 1.00 . A A . 40 ASN HB2 1 1 2 1324 1 1 40 ASN HB3 H 13.068 -9.699 -4.728 1.00 . A A . 40 ASN HB3 1 1 2 1325 1 1 40 ASN HD21 H 15.163 -9.018 -5.450 1.00 . A A . 40 ASN HD21 1 1 2 1326 1 1 40 ASN HD22 H 16.252 -8.067 -4.469 1.00 . A A . 40 ASN HD22 1 1 2 1327 1 1 40 ASN N N 11.165 -10.042 -2.714 1.00 . A A . 40 ASN N 1 1 2 1328 1 1 40 ASN ND2 N 15.410 -8.613 -4.562 1.00 . A A . 40 ASN ND2 1 1 2 1329 1 1 40 ASN O O 12.412 -7.018 -4.250 1.00 . A A . 40 ASN O 1 1 2 1330 1 1 40 ASN OD1 O 14.910 -8.301 -2.403 1.00 . A A . 40 ASN OD1 1 1 2 1331 1 1 41 HIS C C 9.005 -5.636 -3.088 1.00 . A A . 41 HIS C 1 1 2 1332 1 1 41 HIS CA C 9.680 -6.383 -4.225 1.00 . A A . 41 HIS CA 1 1 2 1333 1 1 41 HIS CB C 8.683 -6.819 -5.295 1.00 . A A . 41 HIS CB 1 1 2 1334 1 1 41 HIS CD2 C 9.428 -8.791 -6.814 1.00 . A A . 41 HIS CD2 1 1 2 1335 1 1 41 HIS CE1 C 10.780 -7.699 -8.130 1.00 . A A . 41 HIS CE1 1 1 2 1336 1 1 41 HIS CG C 9.396 -7.471 -6.455 1.00 . A A . 41 HIS CG 1 1 2 1337 1 1 41 HIS H H 9.693 -8.229 -3.234 1.00 . A A . 41 HIS H 1 1 2 1338 1 1 41 HIS HA H 10.417 -5.743 -4.704 1.00 . A A . 41 HIS HA 1 1 2 1339 1 1 41 HIS HB2 H 7.985 -7.525 -4.844 1.00 . A A . 41 HIS HB2 1 1 2 1340 1 1 41 HIS HB3 H 8.104 -5.957 -5.626 1.00 . A A . 41 HIS HB3 1 1 2 1341 1 1 41 HIS HD1 H 10.434 -5.787 -7.309 1.00 . A A . 41 HIS HD1 1 1 2 1342 1 1 41 HIS HD2 H 8.946 -9.597 -6.279 1.00 . A A . 41 HIS HD2 1 1 2 1343 1 1 41 HIS HE1 H 11.514 -7.483 -8.895 1.00 . A A . 41 HIS HE1 1 1 2 1344 1 1 41 HIS N N 10.316 -7.560 -3.667 1.00 . A A . 41 HIS N 1 1 2 1345 1 1 41 HIS ND1 N 10.229 -6.779 -7.323 1.00 . A A . 41 HIS ND1 1 1 2 1346 1 1 41 HIS NE2 N 10.316 -8.932 -7.861 1.00 . A A . 41 HIS NE2 1 1 2 1347 1 1 41 HIS O O 8.159 -6.209 -2.401 1.00 . A A . 41 HIS O 1 1 2 1348 1 1 42 TRP C C 7.388 -3.109 -2.397 1.00 . A A . 42 TRP C 1 1 2 1349 1 1 42 TRP CA C 8.738 -3.556 -1.863 1.00 . A A . 42 TRP CA 1 1 2 1350 1 1 42 TRP CB C 9.630 -2.388 -1.457 1.00 . A A . 42 TRP CB 1 1 2 1351 1 1 42 TRP CD1 C 11.907 -3.263 -0.797 1.00 . A A . 42 TRP CD1 1 1 2 1352 1 1 42 TRP CD2 C 10.653 -2.690 0.967 1.00 . A A . 42 TRP CD2 1 1 2 1353 1 1 42 TRP CE2 C 11.894 -3.167 1.476 1.00 . A A . 42 TRP CE2 1 1 2 1354 1 1 42 TRP CE3 C 9.651 -2.385 1.910 1.00 . A A . 42 TRP CE3 1 1 2 1355 1 1 42 TRP CG C 10.699 -2.752 -0.486 1.00 . A A . 42 TRP CG 1 1 2 1356 1 1 42 TRP CH2 C 11.107 -3.017 3.760 1.00 . A A . 42 TRP CH2 1 1 2 1357 1 1 42 TRP CZ2 C 12.115 -3.367 2.845 1.00 . A A . 42 TRP CZ2 1 1 2 1358 1 1 42 TRP CZ3 C 9.886 -2.501 3.292 1.00 . A A . 42 TRP CZ3 1 1 2 1359 1 1 42 TRP H H 10.014 -3.918 -3.518 1.00 . A A . 42 TRP H 1 1 2 1360 1 1 42 TRP HA H 8.582 -4.125 -0.961 1.00 . A A . 42 TRP HA 1 1 2 1361 1 1 42 TRP HB2 H 10.063 -1.913 -2.335 1.00 . A A . 42 TRP HB2 1 1 2 1362 1 1 42 TRP HB3 H 9.013 -1.659 -0.945 1.00 . A A . 42 TRP HB3 1 1 2 1363 1 1 42 TRP HD1 H 12.220 -3.503 -1.800 1.00 . A A . 42 TRP HD1 1 1 2 1364 1 1 42 TRP HE1 H 13.552 -3.882 0.411 1.00 . A A . 42 TRP HE1 1 1 2 1365 1 1 42 TRP HE3 H 8.674 -2.114 1.558 1.00 . A A . 42 TRP HE3 1 1 2 1366 1 1 42 TRP HH2 H 11.245 -3.180 4.818 1.00 . A A . 42 TRP HH2 1 1 2 1367 1 1 42 TRP HZ2 H 13.007 -3.880 3.163 1.00 . A A . 42 TRP HZ2 1 1 2 1368 1 1 42 TRP HZ3 H 9.110 -2.227 3.991 1.00 . A A . 42 TRP HZ3 1 1 2 1369 1 1 42 TRP N N 9.387 -4.380 -2.864 1.00 . A A . 42 TRP N 1 1 2 1370 1 1 42 TRP NE1 N 12.630 -3.486 0.355 1.00 . A A . 42 TRP NE1 1 1 2 1371 1 1 42 TRP O O 7.338 -2.221 -3.234 1.00 . A A . 42 TRP O 1 1 2 1372 1 1 43 LYS C C 4.449 -2.339 -1.330 1.00 . A A . 43 LYS C 1 1 2 1373 1 1 43 LYS CA C 4.964 -3.312 -2.373 1.00 . A A . 43 LYS CA 1 1 2 1374 1 1 43 LYS CB C 4.008 -4.500 -2.498 1.00 . A A . 43 LYS CB 1 1 2 1375 1 1 43 LYS CD C 5.464 -5.595 -4.312 1.00 . A A . 43 LYS CD 1 1 2 1376 1 1 43 LYS CE C 4.552 -5.451 -5.551 1.00 . A A . 43 LYS CE 1 1 2 1377 1 1 43 LYS CG C 4.737 -5.755 -2.962 1.00 . A A . 43 LYS CG 1 1 2 1378 1 1 43 LYS H H 6.370 -4.469 -1.276 1.00 . A A . 43 LYS H 1 1 2 1379 1 1 43 LYS HA H 5.007 -2.837 -3.351 1.00 . A A . 43 LYS HA 1 1 2 1380 1 1 43 LYS HB2 H 3.601 -4.716 -1.520 1.00 . A A . 43 LYS HB2 1 1 2 1381 1 1 43 LYS HB3 H 3.172 -4.253 -3.147 1.00 . A A . 43 LYS HB3 1 1 2 1382 1 1 43 LYS HD2 H 6.196 -4.790 -4.292 1.00 . A A . 43 LYS HD2 1 1 2 1383 1 1 43 LYS HD3 H 6.010 -6.528 -4.438 1.00 . A A . 43 LYS HD3 1 1 2 1384 1 1 43 LYS HE2 H 5.170 -5.648 -6.429 1.00 . A A . 43 LYS HE2 1 1 2 1385 1 1 43 LYS HE3 H 3.765 -6.207 -5.521 1.00 . A A . 43 LYS HE3 1 1 2 1386 1 1 43 LYS HG2 H 5.375 -6.034 -2.114 1.00 . A A . 43 LYS HG2 1 1 2 1387 1 1 43 LYS HG3 H 4.060 -6.583 -3.079 1.00 . A A . 43 LYS HG3 1 1 2 1388 1 1 43 LYS HZ1 H 4.278 -3.702 -6.625 1.00 . A A . 43 LYS HZ1 1 1 2 1389 1 1 43 LYS HZ2 H 2.915 -4.204 -5.779 1.00 . A A . 43 LYS HZ2 1 1 2 1390 1 1 43 LYS N N 6.293 -3.731 -1.967 1.00 . A A . 43 LYS N 1 1 2 1391 1 1 43 LYS NZ N 3.940 -4.111 -5.742 1.00 . A A . 43 LYS NZ 1 1 2 1392 1 1 43 LYS O O 4.536 -2.612 -0.135 1.00 . A A . 43 LYS O 1 1 2 1393 1 1 44 CYS C C 1.717 -1.226 -0.734 1.00 . A A . 44 CYS C 1 1 2 1394 1 1 44 CYS CA C 2.993 -0.429 -0.973 1.00 . A A . 44 CYS CA 1 1 2 1395 1 1 44 CYS CB C 2.702 0.869 -1.707 1.00 . A A . 44 CYS CB 1 1 2 1396 1 1 44 CYS H H 3.858 -1.082 -2.786 1.00 . A A . 44 CYS H 1 1 2 1397 1 1 44 CYS HA H 3.449 -0.172 -0.025 1.00 . A A . 44 CYS HA 1 1 2 1398 1 1 44 CYS HB2 H 3.594 1.488 -1.632 1.00 . A A . 44 CYS HB2 1 1 2 1399 1 1 44 CYS HB3 H 2.502 0.648 -2.750 1.00 . A A . 44 CYS HB3 1 1 2 1400 1 1 44 CYS N N 3.878 -1.234 -1.790 1.00 . A A . 44 CYS N 1 1 2 1401 1 1 44 CYS O O 0.957 -1.433 -1.674 1.00 . A A . 44 CYS O 1 1 2 1402 1 1 44 CYS SG S 1.289 1.769 -1.047 1.00 . A A . 44 CYS SG 1 1 2 1403 1 1 45 PHE C C -0.686 -1.301 1.402 1.00 . A A . 45 PHE C 1 1 2 1404 1 1 45 PHE CA C 0.259 -2.369 0.864 1.00 . A A . 45 PHE CA 1 1 2 1405 1 1 45 PHE CB C 0.514 -3.447 1.923 1.00 . A A . 45 PHE CB 1 1 2 1406 1 1 45 PHE CD1 C 2.063 -5.024 0.681 1.00 . A A . 45 PHE CD1 1 1 2 1407 1 1 45 PHE CD2 C 0.002 -5.907 1.615 1.00 . A A . 45 PHE CD2 1 1 2 1408 1 1 45 PHE CE1 C 2.449 -6.328 0.313 1.00 . A A . 45 PHE CE1 1 1 2 1409 1 1 45 PHE CE2 C 0.370 -7.202 1.219 1.00 . A A . 45 PHE CE2 1 1 2 1410 1 1 45 PHE CG C 0.864 -4.820 1.383 1.00 . A A . 45 PHE CG 1 1 2 1411 1 1 45 PHE CZ C 1.601 -7.415 0.577 1.00 . A A . 45 PHE CZ 1 1 2 1412 1 1 45 PHE H H 2.143 -1.473 1.243 1.00 . A A . 45 PHE H 1 1 2 1413 1 1 45 PHE HA H -0.203 -2.841 -0.006 1.00 . A A . 45 PHE HA 1 1 2 1414 1 1 45 PHE HB2 H 1.302 -3.095 2.584 1.00 . A A . 45 PHE HB2 1 1 2 1415 1 1 45 PHE HB3 H -0.368 -3.565 2.544 1.00 . A A . 45 PHE HB3 1 1 2 1416 1 1 45 PHE HD1 H 2.724 -4.190 0.507 1.00 . A A . 45 PHE HD1 1 1 2 1417 1 1 45 PHE HD2 H -0.952 -5.750 2.093 1.00 . A A . 45 PHE HD2 1 1 2 1418 1 1 45 PHE HE1 H 3.409 -6.505 -0.149 1.00 . A A . 45 PHE HE1 1 1 2 1419 1 1 45 PHE HE2 H -0.292 -8.036 1.413 1.00 . A A . 45 PHE HE2 1 1 2 1420 1 1 45 PHE HZ H 1.891 -8.415 0.286 1.00 . A A . 45 PHE HZ 1 1 2 1421 1 1 45 PHE N N 1.506 -1.717 0.489 1.00 . A A . 45 PHE N 1 1 2 1422 1 1 45 PHE O O -0.237 -0.352 2.047 1.00 . A A . 45 PHE O 1 1 2 1423 1 1 46 CYS C C -3.909 -1.472 2.596 1.00 . A A . 46 CYS C 1 1 2 1424 1 1 46 CYS CA C -3.053 -0.632 1.666 1.00 . A A . 46 CYS CA 1 1 2 1425 1 1 46 CYS CB C -3.926 -0.123 0.518 1.00 . A A . 46 CYS CB 1 1 2 1426 1 1 46 CYS H H -2.274 -2.341 0.710 1.00 . A A . 46 CYS H 1 1 2 1427 1 1 46 CYS HA H -2.684 0.199 2.271 1.00 . A A . 46 CYS HA 1 1 2 1428 1 1 46 CYS HB2 H -4.277 -0.990 -0.035 1.00 . A A . 46 CYS HB2 1 1 2 1429 1 1 46 CYS HB3 H -4.790 0.358 0.960 1.00 . A A . 46 CYS HB3 1 1 2 1430 1 1 46 CYS N N -1.984 -1.479 1.163 1.00 . A A . 46 CYS N 1 1 2 1431 1 1 46 CYS O O -3.947 -2.698 2.495 1.00 . A A . 46 CYS O 1 1 2 1432 1 1 46 CYS SG S -3.238 1.046 -0.684 1.00 . A A . 46 CYS SG 1 1 2 1433 1 1 47 TYR C C -6.667 -0.823 4.668 1.00 . A A . 47 TYR C 1 1 2 1434 1 1 47 TYR CA C -5.259 -1.391 4.649 1.00 . A A . 47 TYR CA 1 1 2 1435 1 1 47 TYR CB C -4.488 -0.970 5.899 1.00 . A A . 47 TYR CB 1 1 2 1436 1 1 47 TYR CD1 C -2.028 -1.108 5.270 1.00 . A A . 47 TYR CD1 1 1 2 1437 1 1 47 TYR CD2 C -2.931 -2.655 6.917 1.00 . A A . 47 TYR CD2 1 1 2 1438 1 1 47 TYR CE1 C -0.761 -1.687 5.422 1.00 . A A . 47 TYR CE1 1 1 2 1439 1 1 47 TYR CE2 C -1.650 -3.186 7.123 1.00 . A A . 47 TYR CE2 1 1 2 1440 1 1 47 TYR CG C -3.115 -1.591 6.019 1.00 . A A . 47 TYR CG 1 1 2 1441 1 1 47 TYR CZ C -0.569 -2.701 6.373 1.00 . A A . 47 TYR CZ 1 1 2 1442 1 1 47 TYR H H -4.451 0.222 3.539 1.00 . A A . 47 TYR H 1 1 2 1443 1 1 47 TYR HA H -5.294 -2.476 4.586 1.00 . A A . 47 TYR HA 1 1 2 1444 1 1 47 TYR HB2 H -4.371 0.109 5.852 1.00 . A A . 47 TYR HB2 1 1 2 1445 1 1 47 TYR HB3 H -5.056 -1.204 6.797 1.00 . A A . 47 TYR HB3 1 1 2 1446 1 1 47 TYR HD1 H -2.153 -0.287 4.585 1.00 . A A . 47 TYR HD1 1 1 2 1447 1 1 47 TYR HD2 H -3.767 -3.058 7.472 1.00 . A A . 47 TYR HD2 1 1 2 1448 1 1 47 TYR HE1 H 0.051 -1.367 4.788 1.00 . A A . 47 TYR HE1 1 1 2 1449 1 1 47 TYR HE2 H -1.506 -3.973 7.848 1.00 . A A . 47 TYR HE2 1 1 2 1450 1 1 47 TYR HH H 0.594 -4.125 6.910 1.00 . A A . 47 TYR HH 1 1 2 1451 1 1 47 TYR N N -4.567 -0.788 3.527 1.00 . A A . 47 TYR N 1 1 2 1452 1 1 47 TYR O O -6.856 0.317 5.088 1.00 . A A . 47 TYR O 1 1 2 1453 1 1 47 TYR OH O 0.669 -3.220 6.575 1.00 . A A . 47 TYR OH 1 1 2 1454 1 1 48 PHE C C -9.809 -0.837 5.047 1.00 . A A . 48 PHE C 1 1 2 1455 1 1 48 PHE CA C -8.917 -1.004 3.826 1.00 . A A . 48 PHE CA 1 1 2 1456 1 1 48 PHE CB C -9.546 -1.853 2.719 1.00 . A A . 48 PHE CB 1 1 2 1457 1 1 48 PHE CD1 C -7.784 -1.691 0.907 1.00 . A A . 48 PHE CD1 1 1 2 1458 1 1 48 PHE CD2 C -10.030 -0.870 0.437 1.00 . A A . 48 PHE CD2 1 1 2 1459 1 1 48 PHE CE1 C -7.391 -1.347 -0.395 1.00 . A A . 48 PHE CE1 1 1 2 1460 1 1 48 PHE CE2 C -9.645 -0.569 -0.880 1.00 . A A . 48 PHE CE2 1 1 2 1461 1 1 48 PHE CG C -9.110 -1.467 1.322 1.00 . A A . 48 PHE CG 1 1 2 1462 1 1 48 PHE CZ C -8.332 -0.836 -1.303 1.00 . A A . 48 PHE CZ 1 1 2 1463 1 1 48 PHE H H -7.496 -2.557 3.944 1.00 . A A . 48 PHE H 1 1 2 1464 1 1 48 PHE HA H -8.751 -0.012 3.413 1.00 . A A . 48 PHE HA 1 1 2 1465 1 1 48 PHE HB2 H -9.318 -2.907 2.859 1.00 . A A . 48 PHE HB2 1 1 2 1466 1 1 48 PHE HB3 H -10.617 -1.752 2.797 1.00 . A A . 48 PHE HB3 1 1 2 1467 1 1 48 PHE HD1 H -7.064 -2.129 1.582 1.00 . A A . 48 PHE HD1 1 1 2 1468 1 1 48 PHE HD2 H -11.031 -0.624 0.763 1.00 . A A . 48 PHE HD2 1 1 2 1469 1 1 48 PHE HE1 H -6.373 -1.505 -0.715 1.00 . A A . 48 PHE HE1 1 1 2 1470 1 1 48 PHE HE2 H -10.353 -0.115 -1.557 1.00 . A A . 48 PHE HE2 1 1 2 1471 1 1 48 PHE HZ H -8.045 -0.646 -2.324 1.00 . A A . 48 PHE HZ 1 1 2 1472 1 1 48 PHE N N -7.654 -1.590 4.213 1.00 . A A . 48 PHE N 1 1 2 1473 1 1 48 PHE O O -9.957 0.258 5.583 1.00 . A A . 48 PHE O 1 1 2 1474 1 1 49 ASN C C -11.081 -1.859 7.877 1.00 . A A . 49 ASN C 1 1 2 1475 1 1 49 ASN CA C -11.526 -1.984 6.414 1.00 . A A . 49 ASN CA 1 1 2 1476 1 1 49 ASN CB C -12.286 -3.294 6.129 1.00 . A A . 49 ASN CB 1 1 2 1477 1 1 49 ASN CG C -12.758 -3.379 4.679 1.00 . A A . 49 ASN CG 1 1 2 1478 1 1 49 ASN H H -10.157 -2.797 5.035 1.00 . A A . 49 ASN H 1 1 2 1479 1 1 49 ASN HA H -12.190 -1.148 6.194 1.00 . A A . 49 ASN HA 1 1 2 1480 1 1 49 ASN HB2 H -11.622 -4.145 6.276 1.00 . A A . 49 ASN HB2 1 1 2 1481 1 1 49 ASN HB3 H -13.139 -3.403 6.797 1.00 . A A . 49 ASN HB3 1 1 2 1482 1 1 49 ASN HD21 H -14.634 -2.747 5.151 1.00 . A A . 49 ASN HD21 1 1 2 1483 1 1 49 ASN HD22 H -14.342 -3.092 3.460 1.00 . A A . 49 ASN HD22 1 1 2 1484 1 1 49 ASN N N -10.383 -1.944 5.510 1.00 . A A . 49 ASN N 1 1 2 1485 1 1 49 ASN ND2 N -14.015 -3.040 4.413 1.00 . A A . 49 ASN ND2 1 1 2 1486 1 1 49 ASN O O -11.672 -2.469 8.770 1.00 . A A . 49 ASN O 1 1 2 1487 1 1 49 ASN OD1 O -11.981 -3.744 3.799 1.00 . A A . 49 ASN OD1 1 1 2 1488 1 1 50 CYS C C -10.168 0.030 10.304 1.00 . A A . 50 CYS C 1 1 2 1489 1 1 50 CYS CA C -9.387 -0.948 9.434 1.00 . A A . 50 CYS CA 1 1 2 1490 1 1 50 CYS CB C -7.927 -0.522 9.287 1.00 . A A . 50 CYS CB 1 1 2 1491 1 1 50 CYS H H -9.642 -0.568 7.336 1.00 . A A . 50 CYS H 1 1 2 1492 1 1 50 CYS HA H -9.374 -1.907 9.934 1.00 . A A . 50 CYS HA 1 1 2 1493 1 1 50 CYS HB2 H -7.464 -1.028 8.442 1.00 . A A . 50 CYS HB2 1 1 2 1494 1 1 50 CYS HB3 H -7.933 0.533 9.088 1.00 . A A . 50 CYS HB3 1 1 2 1495 1 1 50 CYS N N -10.015 -1.086 8.123 1.00 . A A . 50 CYS N 1 1 2 1496 1 1 50 CYS O O -10.614 -0.366 11.426 1.00 . A A . 50 CYS O 1 1 2 1497 1 1 50 CYS OXT O -10.368 1.222 9.916 1.00 . A A . 50 CYS OXT 1 1 2 1498 1 1 50 CYS SG S -6.835 -0.708 10.716 1.00 . A A . 50 CYS SG 1 1 3 1499 1 1 1 LEU C C -10.138 -5.419 9.322 1.00 . A A . 1 LEU C 1 1 3 1500 1 1 1 LEU CA C -11.169 -5.735 10.398 1.00 . A A . 1 LEU CA 1 1 3 1501 1 1 1 LEU CB C -11.331 -7.258 10.531 1.00 . A A . 1 LEU CB 1 1 3 1502 1 1 1 LEU CD1 C -13.745 -7.912 11.005 1.00 . A A . 1 LEU CD1 1 1 3 1503 1 1 1 LEU CD2 C -11.885 -9.010 12.237 1.00 . A A . 1 LEU CD2 1 1 3 1504 1 1 1 LEU CG C -12.347 -7.693 11.601 1.00 . A A . 1 LEU CG 1 1 3 1505 1 1 1 LEU H1 H -12.275 -4.047 9.983 1.00 . A A . 1 LEU H1 1 1 3 1506 1 1 1 LEU H2 H -12.754 -5.410 9.123 1.00 . A A . 1 LEU H2 1 1 3 1507 1 1 1 LEU H3 H -13.143 -5.264 10.753 1.00 . A A . 1 LEU H3 1 1 3 1508 1 1 1 LEU HA H -10.831 -5.333 11.355 1.00 . A A . 1 LEU HA 1 1 3 1509 1 1 1 LEU HB2 H -11.604 -7.693 9.569 1.00 . A A . 1 LEU HB2 1 1 3 1510 1 1 1 LEU HB3 H -10.349 -7.648 10.804 1.00 . A A . 1 LEU HB3 1 1 3 1511 1 1 1 LEU HD11 H -14.136 -7.005 10.549 1.00 . A A . 1 LEU HD11 1 1 3 1512 1 1 1 LEU HD12 H -13.708 -8.696 10.247 1.00 . A A . 1 LEU HD12 1 1 3 1513 1 1 1 LEU HD13 H -14.433 -8.221 11.794 1.00 . A A . 1 LEU HD13 1 1 3 1514 1 1 1 LEU HD21 H -11.790 -9.782 11.473 1.00 . A A . 1 LEU HD21 1 1 3 1515 1 1 1 LEU HD22 H -10.922 -8.870 12.727 1.00 . A A . 1 LEU HD22 1 1 3 1516 1 1 1 LEU HD23 H -12.611 -9.334 12.985 1.00 . A A . 1 LEU HD23 1 1 3 1517 1 1 1 LEU HG H -12.401 -6.941 12.391 1.00 . A A . 1 LEU HG 1 1 3 1518 1 1 1 LEU N N -12.429 -5.063 10.037 1.00 . A A . 1 LEU N 1 1 3 1519 1 1 1 LEU O O -10.463 -5.591 8.153 1.00 . A A . 1 LEU O 1 1 3 1520 1 1 2 CYS C C -7.675 -5.207 7.576 1.00 . A A . 2 CYS C 1 1 3 1521 1 1 2 CYS CA C -7.978 -4.326 8.787 1.00 . A A . 2 CYS CA 1 1 3 1522 1 1 2 CYS CB C -6.704 -3.858 9.515 1.00 . A A . 2 CYS CB 1 1 3 1523 1 1 2 CYS H H -8.761 -4.833 10.682 1.00 . A A . 2 CYS H 1 1 3 1524 1 1 2 CYS HA H -8.450 -3.420 8.422 1.00 . A A . 2 CYS HA 1 1 3 1525 1 1 2 CYS HB2 H -6.043 -4.713 9.655 1.00 . A A . 2 CYS HB2 1 1 3 1526 1 1 2 CYS HB3 H -6.186 -3.144 8.883 1.00 . A A . 2 CYS HB3 1 1 3 1527 1 1 2 CYS N N -8.958 -4.916 9.699 1.00 . A A . 2 CYS N 1 1 3 1528 1 1 2 CYS O O -6.854 -6.122 7.643 1.00 . A A . 2 CYS O 1 1 3 1529 1 1 2 CYS SG S -6.933 -3.112 11.152 1.00 . A A . 2 CYS SG 1 1 3 1530 1 1 3 ASN C C -6.861 -5.109 4.567 1.00 . A A . 3 ASN C 1 1 3 1531 1 1 3 ASN CA C -8.134 -5.645 5.210 1.00 . A A . 3 ASN CA 1 1 3 1532 1 1 3 ASN CB C -9.355 -5.524 4.288 1.00 . A A . 3 ASN CB 1 1 3 1533 1 1 3 ASN CG C -9.052 -5.972 2.855 1.00 . A A . 3 ASN CG 1 1 3 1534 1 1 3 ASN H H -8.899 -4.077 6.436 1.00 . A A . 3 ASN H 1 1 3 1535 1 1 3 ASN HA H -8.004 -6.705 5.436 1.00 . A A . 3 ASN HA 1 1 3 1536 1 1 3 ASN HB2 H -10.157 -6.147 4.681 1.00 . A A . 3 ASN HB2 1 1 3 1537 1 1 3 ASN HB3 H -9.711 -4.493 4.268 1.00 . A A . 3 ASN HB3 1 1 3 1538 1 1 3 ASN HD21 H -8.090 -7.667 3.473 1.00 . A A . 3 ASN HD21 1 1 3 1539 1 1 3 ASN HD22 H -8.151 -7.417 1.753 1.00 . A A . 3 ASN HD22 1 1 3 1540 1 1 3 ASN N N -8.325 -4.913 6.447 1.00 . A A . 3 ASN N 1 1 3 1541 1 1 3 ASN ND2 N -8.379 -7.108 2.685 1.00 . A A . 3 ASN ND2 1 1 3 1542 1 1 3 ASN O O -6.910 -4.178 3.762 1.00 . A A . 3 ASN O 1 1 3 1543 1 1 3 ASN OD1 O -9.422 -5.303 1.891 1.00 . A A . 3 ASN OD1 1 1 3 1544 1 1 4 GLU C C -4.465 -6.161 2.984 1.00 . A A . 4 GLU C 1 1 3 1545 1 1 4 GLU CA C -4.444 -5.476 4.350 1.00 . A A . 4 GLU CA 1 1 3 1546 1 1 4 GLU CB C -3.376 -6.061 5.287 1.00 . A A . 4 GLU CB 1 1 3 1547 1 1 4 GLU CD C -0.879 -6.505 5.558 1.00 . A A . 4 GLU CD 1 1 3 1548 1 1 4 GLU CG C -1.997 -6.045 4.629 1.00 . A A . 4 GLU CG 1 1 3 1549 1 1 4 GLU H H -5.774 -6.441 5.645 1.00 . A A . 4 GLU H 1 1 3 1550 1 1 4 GLU HA H -4.267 -4.409 4.245 1.00 . A A . 4 GLU HA 1 1 3 1551 1 1 4 GLU HB2 H -3.354 -5.488 6.212 1.00 . A A . 4 GLU HB2 1 1 3 1552 1 1 4 GLU HB3 H -3.630 -7.098 5.524 1.00 . A A . 4 GLU HB3 1 1 3 1553 1 1 4 GLU HG2 H -2.055 -6.747 3.801 1.00 . A A . 4 GLU HG2 1 1 3 1554 1 1 4 GLU HG3 H -1.771 -5.044 4.259 1.00 . A A . 4 GLU HG3 1 1 3 1555 1 1 4 GLU N N -5.735 -5.713 4.947 1.00 . A A . 4 GLU N 1 1 3 1556 1 1 4 GLU O O -4.792 -7.342 2.892 1.00 . A A . 4 GLU O 1 1 3 1557 1 1 4 GLU OE1 O -1.084 -7.680 6.209 1.00 . A A . 4 GLU OE1 1 1 3 1558 1 1 4 GLU OE2 O 0.131 -5.810 5.677 1.00 . A A . 4 GLU OE2 1 1 3 1559 1 1 5 ARG C C -2.895 -5.200 -0.140 1.00 . A A . 5 ARG C 1 1 3 1560 1 1 5 ARG CA C -4.065 -5.903 0.564 1.00 . A A . 5 ARG CA 1 1 3 1561 1 1 5 ARG CB C -5.418 -5.686 -0.133 1.00 . A A . 5 ARG CB 1 1 3 1562 1 1 5 ARG CD C -7.064 -4.078 -1.100 1.00 . A A . 5 ARG CD 1 1 3 1563 1 1 5 ARG CG C -5.912 -4.237 -0.100 1.00 . A A . 5 ARG CG 1 1 3 1564 1 1 5 ARG CZ C -9.453 -4.789 -1.278 1.00 . A A . 5 ARG CZ 1 1 3 1565 1 1 5 ARG H H -3.885 -4.441 2.069 1.00 . A A . 5 ARG H 1 1 3 1566 1 1 5 ARG HA H -3.862 -6.973 0.587 1.00 . A A . 5 ARG HA 1 1 3 1567 1 1 5 ARG HB2 H -5.327 -5.995 -1.171 1.00 . A A . 5 ARG HB2 1 1 3 1568 1 1 5 ARG HB3 H -6.172 -6.311 0.347 1.00 . A A . 5 ARG HB3 1 1 3 1569 1 1 5 ARG HD2 H -7.226 -3.017 -1.284 1.00 . A A . 5 ARG HD2 1 1 3 1570 1 1 5 ARG HD3 H -6.785 -4.552 -2.039 1.00 . A A . 5 ARG HD3 1 1 3 1571 1 1 5 ARG HG2 H -6.230 -3.972 0.910 1.00 . A A . 5 ARG HG2 1 1 3 1572 1 1 5 ARG HG3 H -5.102 -3.571 -0.397 1.00 . A A . 5 ARG HG3 1 1 3 1573 1 1 5 ARG HH11 H -8.652 -4.273 -3.096 1.00 . A A . 5 ARG HH11 1 1 3 1574 1 1 5 ARG HH12 H -10.341 -4.655 -3.128 1.00 . A A . 5 ARG HH12 1 1 3 1575 1 1 5 ARG HH21 H -10.478 -5.319 0.381 1.00 . A A . 5 ARG HH21 1 1 3 1576 1 1 5 ARG HH22 H -11.439 -5.308 -1.082 1.00 . A A . 5 ARG HH22 1 1 3 1577 1 1 5 ARG N N -4.132 -5.417 1.930 1.00 . A A . 5 ARG N 1 1 3 1578 1 1 5 ARG NE N -8.316 -4.646 -0.585 1.00 . A A . 5 ARG NE 1 1 3 1579 1 1 5 ARG NH1 N -9.493 -4.548 -2.595 1.00 . A A . 5 ARG NH1 1 1 3 1580 1 1 5 ARG NH2 N -10.552 -5.178 -0.625 1.00 . A A . 5 ARG NH2 1 1 3 1581 1 1 5 ARG O O -2.508 -4.108 0.285 1.00 . A A . 5 ARG O 1 1 3 1582 1 1 6 PRO C C -1.403 -4.045 -2.628 1.00 . A A . 6 PRO C 1 1 3 1583 1 1 6 PRO CA C -1.098 -5.303 -1.813 1.00 . A A . 6 PRO CA 1 1 3 1584 1 1 6 PRO CB C -0.570 -6.450 -2.686 1.00 . A A . 6 PRO CB 1 1 3 1585 1 1 6 PRO CD C -2.618 -7.142 -1.693 1.00 . A A . 6 PRO CD 1 1 3 1586 1 1 6 PRO CG C -1.825 -7.262 -2.992 1.00 . A A . 6 PRO CG 1 1 3 1587 1 1 6 PRO HA H -0.342 -5.047 -1.075 1.00 . A A . 6 PRO HA 1 1 3 1588 1 1 6 PRO HB2 H -0.071 -6.116 -3.596 1.00 . A A . 6 PRO HB2 1 1 3 1589 1 1 6 PRO HB3 H 0.111 -7.063 -2.096 1.00 . A A . 6 PRO HB3 1 1 3 1590 1 1 6 PRO HD2 H -3.679 -7.259 -1.903 1.00 . A A . 6 PRO HD2 1 1 3 1591 1 1 6 PRO HD3 H -2.288 -7.913 -0.994 1.00 . A A . 6 PRO HD3 1 1 3 1592 1 1 6 PRO HG2 H -2.378 -6.783 -3.803 1.00 . A A . 6 PRO HG2 1 1 3 1593 1 1 6 PRO HG3 H -1.600 -8.298 -3.249 1.00 . A A . 6 PRO HG3 1 1 3 1594 1 1 6 PRO N N -2.284 -5.831 -1.156 1.00 . A A . 6 PRO N 1 1 3 1595 1 1 6 PRO O O -2.540 -3.587 -2.712 1.00 . A A . 6 PRO O 1 1 3 1596 1 1 7 SER C C -1.399 -2.494 -5.227 1.00 . A A . 7 SER C 1 1 3 1597 1 1 7 SER CA C -0.388 -2.331 -4.094 1.00 . A A . 7 SER CA 1 1 3 1598 1 1 7 SER CB C 1.011 -2.139 -4.670 1.00 . A A . 7 SER CB 1 1 3 1599 1 1 7 SER H H 0.549 -3.941 -3.141 1.00 . A A . 7 SER H 1 1 3 1600 1 1 7 SER HA H -0.617 -1.422 -3.537 1.00 . A A . 7 SER HA 1 1 3 1601 1 1 7 SER HB2 H 0.869 -1.428 -5.475 1.00 . A A . 7 SER HB2 1 1 3 1602 1 1 7 SER HB3 H 1.679 -1.714 -3.920 1.00 . A A . 7 SER HB3 1 1 3 1603 1 1 7 SER HG H 0.820 -3.734 -5.718 1.00 . A A . 7 SER HG 1 1 3 1604 1 1 7 SER N N -0.352 -3.500 -3.239 1.00 . A A . 7 SER N 1 1 3 1605 1 1 7 SER O O -1.101 -3.199 -6.190 1.00 . A A . 7 SER O 1 1 3 1606 1 1 7 SER OG O 1.527 -3.371 -5.160 1.00 . A A . 7 SER OG 1 1 3 1607 1 1 8 GLN C C -3.186 -0.619 -7.150 1.00 . A A . 8 GLN C 1 1 3 1608 1 1 8 GLN CA C -3.542 -1.752 -6.180 1.00 . A A . 8 GLN CA 1 1 3 1609 1 1 8 GLN CB C -4.937 -1.583 -5.564 1.00 . A A . 8 GLN CB 1 1 3 1610 1 1 8 GLN CD C -6.765 -2.691 -4.170 1.00 . A A . 8 GLN CD 1 1 3 1611 1 1 8 GLN CG C -5.295 -2.712 -4.586 1.00 . A A . 8 GLN CG 1 1 3 1612 1 1 8 GLN H H -2.732 -1.304 -4.282 1.00 . A A . 8 GLN H 1 1 3 1613 1 1 8 GLN HA H -3.539 -2.690 -6.738 1.00 . A A . 8 GLN HA 1 1 3 1614 1 1 8 GLN HB2 H -5.014 -0.627 -5.054 1.00 . A A . 8 GLN HB2 1 1 3 1615 1 1 8 GLN HB3 H -5.650 -1.587 -6.381 1.00 . A A . 8 GLN HB3 1 1 3 1616 1 1 8 GLN HE21 H -6.606 -0.839 -3.334 1.00 . A A . 8 GLN HE21 1 1 3 1617 1 1 8 GLN HE22 H -8.203 -1.555 -3.308 1.00 . A A . 8 GLN HE22 1 1 3 1618 1 1 8 GLN HG2 H -5.081 -3.673 -5.054 1.00 . A A . 8 GLN HG2 1 1 3 1619 1 1 8 GLN HG3 H -4.688 -2.622 -3.685 1.00 . A A . 8 GLN HG3 1 1 3 1620 1 1 8 GLN N N -2.544 -1.812 -5.128 1.00 . A A . 8 GLN N 1 1 3 1621 1 1 8 GLN NE2 N -7.231 -1.607 -3.561 1.00 . A A . 8 GLN NE2 1 1 3 1622 1 1 8 GLN O O -2.963 -0.867 -8.330 1.00 . A A . 8 GLN O 1 1 3 1623 1 1 8 GLN OE1 O -7.493 -3.666 -4.346 1.00 . A A . 8 GLN OE1 1 1 3 1624 1 1 9 THR C C -1.226 1.732 -7.784 1.00 . A A . 9 THR C 1 1 3 1625 1 1 9 THR CA C -2.723 1.759 -7.503 1.00 . A A . 9 THR CA 1 1 3 1626 1 1 9 THR CB C -3.075 3.086 -6.817 1.00 . A A . 9 THR CB 1 1 3 1627 1 1 9 THR CG2 C -4.562 3.391 -6.962 1.00 . A A . 9 THR CG2 1 1 3 1628 1 1 9 THR H H -3.285 0.804 -5.683 1.00 . A A . 9 THR H 1 1 3 1629 1 1 9 THR HA H -3.248 1.709 -8.459 1.00 . A A . 9 THR HA 1 1 3 1630 1 1 9 THR HB H -2.506 3.884 -7.297 1.00 . A A . 9 THR HB 1 1 3 1631 1 1 9 THR HG1 H -2.671 3.965 -5.137 1.00 . A A . 9 THR HG1 1 1 3 1632 1 1 9 THR HG21 H -5.161 2.554 -6.607 1.00 . A A . 9 THR HG21 1 1 3 1633 1 1 9 THR HG22 H -4.804 4.275 -6.376 1.00 . A A . 9 THR HG22 1 1 3 1634 1 1 9 THR HG23 H -4.793 3.589 -8.009 1.00 . A A . 9 THR HG23 1 1 3 1635 1 1 9 THR N N -3.107 0.626 -6.663 1.00 . A A . 9 THR N 1 1 3 1636 1 1 9 THR O O -0.795 1.899 -8.926 1.00 . A A . 9 THR O 1 1 3 1637 1 1 9 THR OG1 O -2.741 3.053 -5.440 1.00 . A A . 9 THR OG1 1 1 3 1638 1 1 10 TRP C C 1.636 0.589 -7.561 1.00 . A A . 10 TRP C 1 1 3 1639 1 1 10 TRP CA C 1.009 1.714 -6.723 1.00 . A A . 10 TRP CA 1 1 3 1640 1 1 10 TRP CB C 1.509 1.765 -5.269 1.00 . A A . 10 TRP CB 1 1 3 1641 1 1 10 TRP CD1 C 4.011 1.530 -5.535 1.00 . A A . 10 TRP CD1 1 1 3 1642 1 1 10 TRP CD2 C 3.444 3.444 -4.509 1.00 . A A . 10 TRP CD2 1 1 3 1643 1 1 10 TRP CE2 C 4.849 3.493 -4.746 1.00 . A A . 10 TRP CE2 1 1 3 1644 1 1 10 TRP CE3 C 2.880 4.532 -3.806 1.00 . A A . 10 TRP CE3 1 1 3 1645 1 1 10 TRP CG C 2.927 2.216 -5.109 1.00 . A A . 10 TRP CG 1 1 3 1646 1 1 10 TRP CH2 C 5.045 5.649 -3.674 1.00 . A A . 10 TRP CH2 1 1 3 1647 1 1 10 TRP CZ2 C 5.638 4.582 -4.362 1.00 . A A . 10 TRP CZ2 1 1 3 1648 1 1 10 TRP CZ3 C 3.667 5.622 -3.384 1.00 . A A . 10 TRP CZ3 1 1 3 1649 1 1 10 TRP H H -0.907 1.505 -5.820 1.00 . A A . 10 TRP H 1 1 3 1650 1 1 10 TRP HA H 1.261 2.669 -7.187 1.00 . A A . 10 TRP HA 1 1 3 1651 1 1 10 TRP HB2 H 0.892 2.477 -4.717 1.00 . A A . 10 TRP HB2 1 1 3 1652 1 1 10 TRP HB3 H 1.382 0.788 -4.809 1.00 . A A . 10 TRP HB3 1 1 3 1653 1 1 10 TRP HD1 H 3.981 0.557 -6.004 1.00 . A A . 10 TRP HD1 1 1 3 1654 1 1 10 TRP HE1 H 6.074 2.057 -5.679 1.00 . A A . 10 TRP HE1 1 1 3 1655 1 1 10 TRP HE3 H 1.826 4.511 -3.579 1.00 . A A . 10 TRP HE3 1 1 3 1656 1 1 10 TRP HH2 H 5.664 6.478 -3.380 1.00 . A A . 10 TRP HH2 1 1 3 1657 1 1 10 TRP HZ2 H 6.682 4.612 -4.628 1.00 . A A . 10 TRP HZ2 1 1 3 1658 1 1 10 TRP HZ3 H 3.211 6.444 -2.839 1.00 . A A . 10 TRP HZ3 1 1 3 1659 1 1 10 TRP N N -0.440 1.589 -6.712 1.00 . A A . 10 TRP N 1 1 3 1660 1 1 10 TRP NE1 N 5.140 2.302 -5.374 1.00 . A A . 10 TRP NE1 1 1 3 1661 1 1 10 TRP O O 2.170 -0.391 -7.041 1.00 . A A . 10 TRP O 1 1 3 1662 1 1 11 SER C C 3.401 -0.483 -10.007 1.00 . A A . 11 SER C 1 1 3 1663 1 1 11 SER CA C 1.894 -0.383 -9.779 1.00 . A A . 11 SER CA 1 1 3 1664 1 1 11 SER CB C 1.114 -0.205 -11.084 1.00 . A A . 11 SER CB 1 1 3 1665 1 1 11 SER H H 1.032 1.488 -9.248 1.00 . A A . 11 SER H 1 1 3 1666 1 1 11 SER HA H 1.582 -1.313 -9.300 1.00 . A A . 11 SER HA 1 1 3 1667 1 1 11 SER HB2 H 1.436 0.707 -11.592 1.00 . A A . 11 SER HB2 1 1 3 1668 1 1 11 SER HB3 H 1.310 -1.053 -11.744 1.00 . A A . 11 SER HB3 1 1 3 1669 1 1 11 SER HG H -0.468 0.586 -10.206 1.00 . A A . 11 SER HG 1 1 3 1670 1 1 11 SER N N 1.568 0.709 -8.882 1.00 . A A . 11 SER N 1 1 3 1671 1 1 11 SER O O 3.881 -0.279 -11.119 1.00 . A A . 11 SER O 1 1 3 1672 1 1 11 SER OG O -0.276 -0.139 -10.816 1.00 . A A . 11 SER OG 1 1 3 1673 1 1 12 GLY C C 6.172 -1.309 -7.665 1.00 . A A . 12 GLY C 1 1 3 1674 1 1 12 GLY CA C 5.582 -0.984 -9.032 1.00 . A A . 12 GLY CA 1 1 3 1675 1 1 12 GLY H H 3.686 -0.931 -8.052 1.00 . A A . 12 GLY H 1 1 3 1676 1 1 12 GLY HA2 H 5.816 -1.797 -9.721 1.00 . A A . 12 GLY HA2 1 1 3 1677 1 1 12 GLY HA3 H 6.024 -0.061 -9.414 1.00 . A A . 12 GLY HA3 1 1 3 1678 1 1 12 GLY N N 4.146 -0.814 -8.952 1.00 . A A . 12 GLY N 1 1 3 1679 1 1 12 GLY O O 5.517 -1.947 -6.831 1.00 . A A . 12 GLY O 1 1 3 1680 1 1 13 ASN C C 7.904 0.307 -5.383 1.00 . A A . 13 ASN C 1 1 3 1681 1 1 13 ASN CA C 8.125 -0.973 -6.188 1.00 . A A . 13 ASN CA 1 1 3 1682 1 1 13 ASN CB C 9.619 -1.198 -6.441 1.00 . A A . 13 ASN CB 1 1 3 1683 1 1 13 ASN CG C 10.366 -1.576 -5.163 1.00 . A A . 13 ASN CG 1 1 3 1684 1 1 13 ASN H H 7.848 -0.301 -8.168 1.00 . A A . 13 ASN H 1 1 3 1685 1 1 13 ASN HA H 7.742 -1.837 -5.650 1.00 . A A . 13 ASN HA 1 1 3 1686 1 1 13 ASN HB2 H 9.733 -2.019 -7.150 1.00 . A A . 13 ASN HB2 1 1 3 1687 1 1 13 ASN HB3 H 10.065 -0.302 -6.878 1.00 . A A . 13 ASN HB3 1 1 3 1688 1 1 13 ASN HD21 H 10.622 0.385 -4.556 1.00 . A A . 13 ASN HD21 1 1 3 1689 1 1 13 ASN HD22 H 11.358 -0.846 -3.564 1.00 . A A . 13 ASN HD22 1 1 3 1690 1 1 13 ASN N N 7.414 -0.865 -7.452 1.00 . A A . 13 ASN N 1 1 3 1691 1 1 13 ASN ND2 N 10.822 -0.603 -4.381 1.00 . A A . 13 ASN ND2 1 1 3 1692 1 1 13 ASN O O 7.702 1.373 -5.962 1.00 . A A . 13 ASN O 1 1 3 1693 1 1 13 ASN OD1 O 10.527 -2.760 -4.869 1.00 . A A . 13 ASN OD1 1 1 3 1694 1 1 14 CYS C C 8.901 2.371 -3.433 1.00 . A A . 14 CYS C 1 1 3 1695 1 1 14 CYS CA C 7.826 1.329 -3.136 1.00 . A A . 14 CYS CA 1 1 3 1696 1 1 14 CYS CB C 7.994 0.824 -1.704 1.00 . A A . 14 CYS CB 1 1 3 1697 1 1 14 CYS H H 8.078 -0.709 -3.662 1.00 . A A . 14 CYS H 1 1 3 1698 1 1 14 CYS HA H 6.834 1.771 -3.236 1.00 . A A . 14 CYS HA 1 1 3 1699 1 1 14 CYS HB2 H 7.277 0.025 -1.516 1.00 . A A . 14 CYS HB2 1 1 3 1700 1 1 14 CYS HB3 H 9.005 0.436 -1.598 1.00 . A A . 14 CYS HB3 1 1 3 1701 1 1 14 CYS N N 7.933 0.210 -4.057 1.00 . A A . 14 CYS N 1 1 3 1702 1 1 14 CYS O O 9.987 2.030 -3.900 1.00 . A A . 14 CYS O 1 1 3 1703 1 1 14 CYS SG S 7.779 2.084 -0.425 1.00 . A A . 14 CYS SG 1 1 3 1704 1 1 15 GLY C C 9.677 5.317 -1.789 1.00 . A A . 15 GLY C 1 1 3 1705 1 1 15 GLY CA C 9.491 4.765 -3.196 1.00 . A A . 15 GLY CA 1 1 3 1706 1 1 15 GLY H H 7.665 3.782 -2.742 1.00 . A A . 15 GLY H 1 1 3 1707 1 1 15 GLY HA2 H 10.461 4.477 -3.592 1.00 . A A . 15 GLY HA2 1 1 3 1708 1 1 15 GLY HA3 H 9.067 5.539 -3.835 1.00 . A A . 15 GLY HA3 1 1 3 1709 1 1 15 GLY N N 8.581 3.631 -3.138 1.00 . A A . 15 GLY N 1 1 3 1710 1 1 15 GLY O O 10.794 5.468 -1.305 1.00 . A A . 15 GLY O 1 1 3 1711 1 1 16 ASN C C 7.175 5.557 0.877 1.00 . A A . 16 ASN C 1 1 3 1712 1 1 16 ASN CA C 8.516 5.974 0.281 1.00 . A A . 16 ASN CA 1 1 3 1713 1 1 16 ASN CB C 8.755 7.482 0.439 1.00 . A A . 16 ASN CB 1 1 3 1714 1 1 16 ASN CG C 9.052 7.865 1.884 1.00 . A A . 16 ASN CG 1 1 3 1715 1 1 16 ASN H H 7.674 5.440 -1.584 1.00 . A A . 16 ASN H 1 1 3 1716 1 1 16 ASN HA H 9.317 5.443 0.801 1.00 . A A . 16 ASN HA 1 1 3 1717 1 1 16 ASN HB2 H 9.621 7.765 -0.161 1.00 . A A . 16 ASN HB2 1 1 3 1718 1 1 16 ASN HB3 H 7.888 8.046 0.092 1.00 . A A . 16 ASN HB3 1 1 3 1719 1 1 16 ASN HD21 H 10.207 9.442 1.310 1.00 . A A . 16 ASN HD21 1 1 3 1720 1 1 16 ASN HD22 H 10.029 9.196 3.034 1.00 . A A . 16 ASN HD22 1 1 3 1721 1 1 16 ASN N N 8.556 5.593 -1.120 1.00 . A A . 16 ASN N 1 1 3 1722 1 1 16 ASN ND2 N 9.813 8.934 2.085 1.00 . A A . 16 ASN ND2 1 1 3 1723 1 1 16 ASN O O 6.123 5.867 0.315 1.00 . A A . 16 ASN O 1 1 3 1724 1 1 16 ASN OD1 O 8.581 7.222 2.819 1.00 . A A . 16 ASN OD1 1 1 3 1725 1 1 17 THR C C 5.150 5.718 3.091 1.00 . A A . 17 THR C 1 1 3 1726 1 1 17 THR CA C 5.993 4.483 2.731 1.00 . A A . 17 THR CA 1 1 3 1727 1 1 17 THR CB C 6.362 3.589 3.925 1.00 . A A . 17 THR CB 1 1 3 1728 1 1 17 THR CG2 C 6.967 4.357 5.108 1.00 . A A . 17 THR CG2 1 1 3 1729 1 1 17 THR H H 8.094 4.703 2.461 1.00 . A A . 17 THR H 1 1 3 1730 1 1 17 THR HA H 5.422 3.866 2.045 1.00 . A A . 17 THR HA 1 1 3 1731 1 1 17 THR HB H 7.106 2.871 3.581 1.00 . A A . 17 THR HB 1 1 3 1732 1 1 17 THR HG1 H 4.612 3.446 4.760 1.00 . A A . 17 THR HG1 1 1 3 1733 1 1 17 THR HG21 H 7.835 4.931 4.782 1.00 . A A . 17 THR HG21 1 1 3 1734 1 1 17 THR HG22 H 6.233 5.034 5.547 1.00 . A A . 17 THR HG22 1 1 3 1735 1 1 17 THR HG23 H 7.284 3.646 5.870 1.00 . A A . 17 THR HG23 1 1 3 1736 1 1 17 THR N N 7.200 4.875 2.023 1.00 . A A . 17 THR N 1 1 3 1737 1 1 17 THR O O 3.918 5.683 3.063 1.00 . A A . 17 THR O 1 1 3 1738 1 1 17 THR OG1 O 5.242 2.843 4.352 1.00 . A A . 17 THR OG1 1 1 3 1739 1 1 18 ALA C C 4.377 8.614 2.406 1.00 . A A . 18 ALA C 1 1 3 1740 1 1 18 ALA CA C 5.180 8.120 3.612 1.00 . A A . 18 ALA CA 1 1 3 1741 1 1 18 ALA CB C 6.231 9.153 4.025 1.00 . A A . 18 ALA CB 1 1 3 1742 1 1 18 ALA H H 6.839 6.819 3.353 1.00 . A A . 18 ALA H 1 1 3 1743 1 1 18 ALA HA H 4.485 7.992 4.445 1.00 . A A . 18 ALA HA 1 1 3 1744 1 1 18 ALA HB1 H 6.808 8.781 4.871 1.00 . A A . 18 ALA HB1 1 1 3 1745 1 1 18 ALA HB2 H 6.903 9.361 3.192 1.00 . A A . 18 ALA HB2 1 1 3 1746 1 1 18 ALA HB3 H 5.736 10.080 4.316 1.00 . A A . 18 ALA HB3 1 1 3 1747 1 1 18 ALA N N 5.825 6.840 3.359 1.00 . A A . 18 ALA N 1 1 3 1748 1 1 18 ALA O O 3.494 9.449 2.592 1.00 . A A . 18 ALA O 1 1 3 1749 1 1 19 HIS C C 2.835 7.266 -0.150 1.00 . A A . 19 HIS C 1 1 3 1750 1 1 19 HIS CA C 3.883 8.374 -0.014 1.00 . A A . 19 HIS CA 1 1 3 1751 1 1 19 HIS CB C 4.796 8.419 -1.250 1.00 . A A . 19 HIS CB 1 1 3 1752 1 1 19 HIS CD2 C 2.874 9.248 -2.834 1.00 . A A . 19 HIS CD2 1 1 3 1753 1 1 19 HIS CE1 C 4.035 9.311 -4.688 1.00 . A A . 19 HIS CE1 1 1 3 1754 1 1 19 HIS CG C 4.171 8.905 -2.542 1.00 . A A . 19 HIS CG 1 1 3 1755 1 1 19 HIS H H 5.406 7.434 1.117 1.00 . A A . 19 HIS H 1 1 3 1756 1 1 19 HIS HA H 3.382 9.338 0.069 1.00 . A A . 19 HIS HA 1 1 3 1757 1 1 19 HIS HB2 H 5.630 9.071 -1.052 1.00 . A A . 19 HIS HB2 1 1 3 1758 1 1 19 HIS HB3 H 5.197 7.423 -1.413 1.00 . A A . 19 HIS HB3 1 1 3 1759 1 1 19 HIS HD1 H 5.910 8.910 -3.820 1.00 . A A . 19 HIS HD1 1 1 3 1760 1 1 19 HIS HD2 H 2.038 9.252 -2.148 1.00 . A A . 19 HIS HD2 1 1 3 1761 1 1 19 HIS HE1 H 4.291 9.404 -5.736 1.00 . A A . 19 HIS HE1 1 1 3 1762 1 1 19 HIS N N 4.676 8.132 1.189 1.00 . A A . 19 HIS N 1 1 3 1763 1 1 19 HIS ND1 N 4.913 9.046 -3.708 1.00 . A A . 19 HIS ND1 1 1 3 1764 1 1 19 HIS NE2 N 2.789 9.423 -4.205 1.00 . A A . 19 HIS NE2 1 1 3 1765 1 1 19 HIS O O 1.670 7.565 -0.409 1.00 . A A . 19 HIS O 1 1 3 1766 1 1 20 CYS C C 1.042 5.108 0.702 1.00 . A A . 20 CYS C 1 1 3 1767 1 1 20 CYS CA C 2.345 4.843 -0.036 1.00 . A A . 20 CYS CA 1 1 3 1768 1 1 20 CYS CB C 3.002 3.621 0.602 1.00 . A A . 20 CYS CB 1 1 3 1769 1 1 20 CYS H H 4.228 5.834 0.204 1.00 . A A . 20 CYS H 1 1 3 1770 1 1 20 CYS HA H 2.115 4.626 -1.078 1.00 . A A . 20 CYS HA 1 1 3 1771 1 1 20 CYS HB2 H 3.852 3.305 0.001 1.00 . A A . 20 CYS HB2 1 1 3 1772 1 1 20 CYS HB3 H 3.338 3.866 1.600 1.00 . A A . 20 CYS HB3 1 1 3 1773 1 1 20 CYS N N 3.242 6.002 0.021 1.00 . A A . 20 CYS N 1 1 3 1774 1 1 20 CYS O O -0.049 4.958 0.151 1.00 . A A . 20 CYS O 1 1 3 1775 1 1 20 CYS SG S 1.866 2.241 0.846 1.00 . A A . 20 CYS SG 1 1 3 1776 1 1 21 ASP C C -0.849 6.898 2.170 1.00 . A A . 21 ASP C 1 1 3 1777 1 1 21 ASP CA C 0.026 5.807 2.793 1.00 . A A . 21 ASP CA 1 1 3 1778 1 1 21 ASP CB C 0.517 6.253 4.172 1.00 . A A . 21 ASP CB 1 1 3 1779 1 1 21 ASP CG C -0.670 6.706 5.007 1.00 . A A . 21 ASP CG 1 1 3 1780 1 1 21 ASP H H 2.113 5.659 2.338 1.00 . A A . 21 ASP H 1 1 3 1781 1 1 21 ASP HA H -0.556 4.883 2.903 1.00 . A A . 21 ASP HA 1 1 3 1782 1 1 21 ASP HB2 H 1.020 5.429 4.676 1.00 . A A . 21 ASP HB2 1 1 3 1783 1 1 21 ASP HB3 H 1.215 7.085 4.070 1.00 . A A . 21 ASP HB3 1 1 3 1784 1 1 21 ASP N N 1.178 5.567 1.948 1.00 . A A . 21 ASP N 1 1 3 1785 1 1 21 ASP O O -2.072 6.771 2.166 1.00 . A A . 21 ASP O 1 1 3 1786 1 1 21 ASP OD1 O -1.518 5.873 5.313 1.00 . A A . 21 ASP OD1 1 1 3 1787 1 1 21 ASP OD2 O -0.721 8.031 5.304 1.00 . A A . 21 ASP OD2 1 1 3 1788 1 1 22 LYS C C -1.818 8.367 -0.172 1.00 . A A . 22 LYS C 1 1 3 1789 1 1 22 LYS CA C -1.003 8.992 0.942 1.00 . A A . 22 LYS CA 1 1 3 1790 1 1 22 LYS CB C -0.176 10.145 0.368 1.00 . A A . 22 LYS CB 1 1 3 1791 1 1 22 LYS CD C 1.374 12.034 0.982 1.00 . A A . 22 LYS CD 1 1 3 1792 1 1 22 LYS CE C 2.687 12.388 1.699 1.00 . A A . 22 LYS CE 1 1 3 1793 1 1 22 LYS CG C 0.759 10.698 1.427 1.00 . A A . 22 LYS CG 1 1 3 1794 1 1 22 LYS H H 0.771 7.927 1.497 1.00 . A A . 22 LYS H 1 1 3 1795 1 1 22 LYS HA H -1.649 9.436 1.695 1.00 . A A . 22 LYS HA 1 1 3 1796 1 1 22 LYS HB2 H 0.401 9.816 -0.495 1.00 . A A . 22 LYS HB2 1 1 3 1797 1 1 22 LYS HB3 H -0.863 10.931 0.047 1.00 . A A . 22 LYS HB3 1 1 3 1798 1 1 22 LYS HD2 H 1.578 12.004 -0.091 1.00 . A A . 22 LYS HD2 1 1 3 1799 1 1 22 LYS HD3 H 0.637 12.824 1.152 1.00 . A A . 22 LYS HD3 1 1 3 1800 1 1 22 LYS HE2 H 3.512 11.865 1.208 1.00 . A A . 22 LYS HE2 1 1 3 1801 1 1 22 LYS HE3 H 2.862 13.461 1.606 1.00 . A A . 22 LYS HE3 1 1 3 1802 1 1 22 LYS HG2 H 0.215 10.815 2.366 1.00 . A A . 22 LYS HG2 1 1 3 1803 1 1 22 LYS HG3 H 1.494 9.916 1.530 1.00 . A A . 22 LYS HG3 1 1 3 1804 1 1 22 LYS HZ1 H 3.229 11.132 3.245 1.00 . A A . 22 LYS HZ1 1 1 3 1805 1 1 22 LYS HZ2 H 3.109 12.750 3.686 1.00 . A A . 22 LYS HZ2 1 1 3 1806 1 1 22 LYS N N -0.234 7.951 1.611 1.00 . A A . 22 LYS N 1 1 3 1807 1 1 22 LYS NZ N 2.685 11.999 3.124 1.00 . A A . 22 LYS NZ 1 1 3 1808 1 1 22 LYS O O -3.018 8.609 -0.244 1.00 . A A . 22 LYS O 1 1 3 1809 1 1 23 GLN C C -3.083 6.140 -1.640 1.00 . A A . 23 GLN C 1 1 3 1810 1 1 23 GLN CA C -1.910 6.977 -2.150 1.00 . A A . 23 GLN CA 1 1 3 1811 1 1 23 GLN CB C -1.024 6.207 -3.130 1.00 . A A . 23 GLN CB 1 1 3 1812 1 1 23 GLN CD C 0.566 6.994 -4.972 1.00 . A A . 23 GLN CD 1 1 3 1813 1 1 23 GLN CG C 0.208 7.044 -3.495 1.00 . A A . 23 GLN CG 1 1 3 1814 1 1 23 GLN H H -0.195 7.380 -0.892 1.00 . A A . 23 GLN H 1 1 3 1815 1 1 23 GLN HA H -2.273 7.807 -2.742 1.00 . A A . 23 GLN HA 1 1 3 1816 1 1 23 GLN HB2 H -0.703 5.260 -2.694 1.00 . A A . 23 GLN HB2 1 1 3 1817 1 1 23 GLN HB3 H -1.629 6.003 -4.016 1.00 . A A . 23 GLN HB3 1 1 3 1818 1 1 23 GLN HE21 H 0.109 5.012 -5.134 1.00 . A A . 23 GLN HE21 1 1 3 1819 1 1 23 GLN HE22 H 0.627 5.830 -6.594 1.00 . A A . 23 GLN HE22 1 1 3 1820 1 1 23 GLN HG2 H 0.017 8.093 -3.287 1.00 . A A . 23 GLN HG2 1 1 3 1821 1 1 23 GLN HG3 H 1.050 6.705 -2.904 1.00 . A A . 23 GLN HG3 1 1 3 1822 1 1 23 GLN N N -1.181 7.578 -1.043 1.00 . A A . 23 GLN N 1 1 3 1823 1 1 23 GLN NE2 N 0.426 5.840 -5.610 1.00 . A A . 23 GLN NE2 1 1 3 1824 1 1 23 GLN O O -4.226 6.341 -2.049 1.00 . A A . 23 GLN O 1 1 3 1825 1 1 23 GLN OE1 O 0.974 8.010 -5.531 1.00 . A A . 23 GLN OE1 1 1 3 1826 1 1 24 CYS C C -5.017 5.107 0.419 1.00 . A A . 24 CYS C 1 1 3 1827 1 1 24 CYS CA C -3.833 4.336 -0.183 1.00 . A A . 24 CYS CA 1 1 3 1828 1 1 24 CYS CB C -3.212 3.415 0.872 1.00 . A A . 24 CYS CB 1 1 3 1829 1 1 24 CYS H H -1.851 5.117 -0.394 1.00 . A A . 24 CYS H 1 1 3 1830 1 1 24 CYS HA H -4.215 3.748 -1.026 1.00 . A A . 24 CYS HA 1 1 3 1831 1 1 24 CYS HB2 H -2.767 4.025 1.657 1.00 . A A . 24 CYS HB2 1 1 3 1832 1 1 24 CYS HB3 H -3.995 2.808 1.313 1.00 . A A . 24 CYS HB3 1 1 3 1833 1 1 24 CYS N N -2.812 5.229 -0.709 1.00 . A A . 24 CYS N 1 1 3 1834 1 1 24 CYS O O -6.164 4.683 0.286 1.00 . A A . 24 CYS O 1 1 3 1835 1 1 24 CYS SG S -1.965 2.242 0.299 1.00 . A A . 24 CYS SG 1 1 3 1836 1 1 25 GLN C C -6.529 7.928 0.613 1.00 . A A . 25 GLN C 1 1 3 1837 1 1 25 GLN CA C -5.859 7.025 1.667 1.00 . A A . 25 GLN CA 1 1 3 1838 1 1 25 GLN CB C -5.335 7.829 2.865 1.00 . A A . 25 GLN CB 1 1 3 1839 1 1 25 GLN CD C -4.250 7.688 5.135 1.00 . A A . 25 GLN CD 1 1 3 1840 1 1 25 GLN CG C -4.824 6.896 3.966 1.00 . A A . 25 GLN CG 1 1 3 1841 1 1 25 GLN H H -3.810 6.524 1.252 1.00 . A A . 25 GLN H 1 1 3 1842 1 1 25 GLN HA H -6.621 6.352 2.066 1.00 . A A . 25 GLN HA 1 1 3 1843 1 1 25 GLN HB2 H -4.527 8.489 2.566 1.00 . A A . 25 GLN HB2 1 1 3 1844 1 1 25 GLN HB3 H -6.147 8.429 3.282 1.00 . A A . 25 GLN HB3 1 1 3 1845 1 1 25 GLN HE21 H -5.457 6.715 6.431 1.00 . A A . 25 GLN HE21 1 1 3 1846 1 1 25 GLN HE22 H -4.424 7.952 7.137 1.00 . A A . 25 GLN HE22 1 1 3 1847 1 1 25 GLN HG2 H -5.652 6.274 4.307 1.00 . A A . 25 GLN HG2 1 1 3 1848 1 1 25 GLN HG3 H -4.041 6.246 3.585 1.00 . A A . 25 GLN HG3 1 1 3 1849 1 1 25 GLN N N -4.772 6.234 1.093 1.00 . A A . 25 GLN N 1 1 3 1850 1 1 25 GLN NE2 N -4.754 7.443 6.334 1.00 . A A . 25 GLN NE2 1 1 3 1851 1 1 25 GLN O O -7.748 8.110 0.620 1.00 . A A . 25 GLN O 1 1 3 1852 1 1 25 GLN OE1 O -3.352 8.509 4.969 1.00 . A A . 25 GLN OE1 1 1 3 1853 1 1 26 ASP C C -6.765 8.947 -2.482 1.00 . A A . 26 ASP C 1 1 3 1854 1 1 26 ASP CA C -6.180 9.562 -1.216 1.00 . A A . 26 ASP CA 1 1 3 1855 1 1 26 ASP CB C -5.054 10.536 -1.590 1.00 . A A . 26 ASP CB 1 1 3 1856 1 1 26 ASP CG C -4.707 11.501 -0.458 1.00 . A A . 26 ASP CG 1 1 3 1857 1 1 26 ASP H H -4.767 8.241 -0.298 1.00 . A A . 26 ASP H 1 1 3 1858 1 1 26 ASP HA H -6.952 10.166 -0.748 1.00 . A A . 26 ASP HA 1 1 3 1859 1 1 26 ASP HB2 H -4.171 10.005 -1.933 1.00 . A A . 26 ASP HB2 1 1 3 1860 1 1 26 ASP HB3 H -5.406 11.140 -2.427 1.00 . A A . 26 ASP HB3 1 1 3 1861 1 1 26 ASP N N -5.736 8.531 -0.277 1.00 . A A . 26 ASP N 1 1 3 1862 1 1 26 ASP O O -7.908 9.235 -2.833 1.00 . A A . 26 ASP O 1 1 3 1863 1 1 26 ASP OD1 O -4.032 10.979 0.603 1.00 . A A . 26 ASP OD1 1 1 3 1864 1 1 26 ASP OD2 O -5.042 12.675 -0.555 1.00 . A A . 26 ASP OD2 1 1 3 1865 1 1 27 TRP C C -7.298 6.471 -4.270 1.00 . A A . 27 TRP C 1 1 3 1866 1 1 27 TRP CA C -6.270 7.573 -4.475 1.00 . A A . 27 TRP CA 1 1 3 1867 1 1 27 TRP CB C -5.018 6.918 -5.072 1.00 . A A . 27 TRP CB 1 1 3 1868 1 1 27 TRP CD1 C -3.486 8.935 -5.043 1.00 . A A . 27 TRP CD1 1 1 3 1869 1 1 27 TRP CD2 C -3.087 7.568 -6.766 1.00 . A A . 27 TRP CD2 1 1 3 1870 1 1 27 TRP CE2 C -2.088 8.585 -6.804 1.00 . A A . 27 TRP CE2 1 1 3 1871 1 1 27 TRP CE3 C -3.063 6.599 -7.790 1.00 . A A . 27 TRP CE3 1 1 3 1872 1 1 27 TRP CG C -3.925 7.790 -5.599 1.00 . A A . 27 TRP CG 1 1 3 1873 1 1 27 TRP CH2 C -1.058 7.585 -8.753 1.00 . A A . 27 TRP CH2 1 1 3 1874 1 1 27 TRP CZ2 C -1.090 8.607 -7.790 1.00 . A A . 27 TRP CZ2 1 1 3 1875 1 1 27 TRP CZ3 C -2.053 6.595 -8.765 1.00 . A A . 27 TRP CZ3 1 1 3 1876 1 1 27 TRP H H -5.086 7.855 -2.736 1.00 . A A . 27 TRP H 1 1 3 1877 1 1 27 TRP HA H -6.664 8.336 -5.150 1.00 . A A . 27 TRP HA 1 1 3 1878 1 1 27 TRP HB2 H -4.555 6.230 -4.372 1.00 . A A . 27 TRP HB2 1 1 3 1879 1 1 27 TRP HB3 H -5.362 6.295 -5.889 1.00 . A A . 27 TRP HB3 1 1 3 1880 1 1 27 TRP HD1 H -3.889 9.381 -4.153 1.00 . A A . 27 TRP HD1 1 1 3 1881 1 1 27 TRP HE1 H -1.869 10.232 -5.481 1.00 . A A . 27 TRP HE1 1 1 3 1882 1 1 27 TRP HE3 H -3.843 5.858 -7.836 1.00 . A A . 27 TRP HE3 1 1 3 1883 1 1 27 TRP HH2 H -0.282 7.549 -9.498 1.00 . A A . 27 TRP HH2 1 1 3 1884 1 1 27 TRP HZ2 H -0.341 9.385 -7.795 1.00 . A A . 27 TRP HZ2 1 1 3 1885 1 1 27 TRP HZ3 H -2.044 5.831 -9.530 1.00 . A A . 27 TRP HZ3 1 1 3 1886 1 1 27 TRP N N -5.958 8.135 -3.168 1.00 . A A . 27 TRP N 1 1 3 1887 1 1 27 TRP NE1 N -2.386 9.402 -5.729 1.00 . A A . 27 TRP NE1 1 1 3 1888 1 1 27 TRP O O -8.385 6.484 -4.844 1.00 . A A . 27 TRP O 1 1 3 1889 1 1 28 GLU C C -8.632 5.086 -1.839 1.00 . A A . 28 GLU C 1 1 3 1890 1 1 28 GLU CA C -7.783 4.459 -2.953 1.00 . A A . 28 GLU CA 1 1 3 1891 1 1 28 GLU CB C -6.894 3.284 -2.517 1.00 . A A . 28 GLU CB 1 1 3 1892 1 1 28 GLU CD C -5.317 1.457 -3.311 1.00 . A A . 28 GLU CD 1 1 3 1893 1 1 28 GLU CG C -6.153 2.666 -3.713 1.00 . A A . 28 GLU CG 1 1 3 1894 1 1 28 GLU H H -6.022 5.644 -2.961 1.00 . A A . 28 GLU H 1 1 3 1895 1 1 28 GLU HA H -8.455 4.127 -3.745 1.00 . A A . 28 GLU HA 1 1 3 1896 1 1 28 GLU HB2 H -6.150 3.647 -1.826 1.00 . A A . 28 GLU HB2 1 1 3 1897 1 1 28 GLU HB3 H -7.457 2.514 -2.008 1.00 . A A . 28 GLU HB3 1 1 3 1898 1 1 28 GLU HG2 H -6.887 2.337 -4.451 1.00 . A A . 28 GLU HG2 1 1 3 1899 1 1 28 GLU HG3 H -5.510 3.417 -4.163 1.00 . A A . 28 GLU HG3 1 1 3 1900 1 1 28 GLU N N -6.907 5.507 -3.438 1.00 . A A . 28 GLU N 1 1 3 1901 1 1 28 GLU O O -8.859 6.292 -1.852 1.00 . A A . 28 GLU O 1 1 3 1902 1 1 28 GLU OE1 O -5.820 0.591 -2.599 1.00 . A A . 28 GLU OE1 1 1 3 1903 1 1 28 GLU OE2 O -4.053 1.380 -3.816 1.00 . A A . 28 GLU OE2 1 1 3 1904 1 1 29 LYS C C -9.646 3.712 1.374 1.00 . A A . 29 LYS C 1 1 3 1905 1 1 29 LYS CA C -9.850 4.766 0.292 1.00 . A A . 29 LYS CA 1 1 3 1906 1 1 29 LYS CB C -11.344 4.911 -0.082 1.00 . A A . 29 LYS CB 1 1 3 1907 1 1 29 LYS CD C -11.634 7.449 0.082 1.00 . A A . 29 LYS CD 1 1 3 1908 1 1 29 LYS CE C -11.238 8.709 -0.701 1.00 . A A . 29 LYS CE 1 1 3 1909 1 1 29 LYS CG C -11.753 6.200 -0.815 1.00 . A A . 29 LYS CG 1 1 3 1910 1 1 29 LYS H H -8.736 3.378 -0.759 1.00 . A A . 29 LYS H 1 1 3 1911 1 1 29 LYS HA H -9.415 5.685 0.653 1.00 . A A . 29 LYS HA 1 1 3 1912 1 1 29 LYS HB2 H -11.635 4.051 -0.685 1.00 . A A . 29 LYS HB2 1 1 3 1913 1 1 29 LYS HB3 H -11.931 4.884 0.835 1.00 . A A . 29 LYS HB3 1 1 3 1914 1 1 29 LYS HD2 H -12.604 7.615 0.555 1.00 . A A . 29 LYS HD2 1 1 3 1915 1 1 29 LYS HD3 H -10.912 7.288 0.884 1.00 . A A . 29 LYS HD3 1 1 3 1916 1 1 29 LYS HE2 H -11.882 8.819 -1.575 1.00 . A A . 29 LYS HE2 1 1 3 1917 1 1 29 LYS HE3 H -11.372 9.581 -0.058 1.00 . A A . 29 LYS HE3 1 1 3 1918 1 1 29 LYS HG2 H -11.200 6.293 -1.744 1.00 . A A . 29 LYS HG2 1 1 3 1919 1 1 29 LYS HG3 H -12.802 6.096 -1.097 1.00 . A A . 29 LYS HG3 1 1 3 1920 1 1 29 LYS HZ1 H -9.593 7.698 -1.425 1.00 . A A . 29 LYS HZ1 1 1 3 1921 1 1 29 LYS HZ2 H -9.674 9.309 -1.904 1.00 . A A . 29 LYS HZ2 1 1 3 1922 1 1 29 LYS N N -9.037 4.329 -0.824 1.00 . A A . 29 LYS N 1 1 3 1923 1 1 29 LYS NZ N -9.825 8.656 -1.123 1.00 . A A . 29 LYS NZ 1 1 3 1924 1 1 29 LYS O O -10.577 3.123 1.920 1.00 . A A . 29 LYS O 1 1 3 1925 1 1 30 ALA C C -7.876 3.434 4.013 1.00 . A A . 30 ALA C 1 1 3 1926 1 1 30 ALA CA C -7.903 2.629 2.717 1.00 . A A . 30 ALA CA 1 1 3 1927 1 1 30 ALA CB C -6.498 2.165 2.348 1.00 . A A . 30 ALA CB 1 1 3 1928 1 1 30 ALA H H -7.662 4.034 1.167 1.00 . A A . 30 ALA H 1 1 3 1929 1 1 30 ALA HA H -8.560 1.766 2.803 1.00 . A A . 30 ALA HA 1 1 3 1930 1 1 30 ALA HB1 H -6.493 1.789 1.324 1.00 . A A . 30 ALA HB1 1 1 3 1931 1 1 30 ALA HB2 H -5.824 3.014 2.438 1.00 . A A . 30 ALA HB2 1 1 3 1932 1 1 30 ALA HB3 H -6.165 1.381 3.015 1.00 . A A . 30 ALA HB3 1 1 3 1933 1 1 30 ALA N N -8.365 3.484 1.652 1.00 . A A . 30 ALA N 1 1 3 1934 1 1 30 ALA O O -7.744 4.658 3.985 1.00 . A A . 30 ALA O 1 1 3 1935 1 1 31 SER C C -6.235 3.908 6.446 1.00 . A A . 31 SER C 1 1 3 1936 1 1 31 SER CA C -7.645 3.308 6.446 1.00 . A A . 31 SER CA 1 1 3 1937 1 1 31 SER CB C -7.792 2.172 7.456 1.00 . A A . 31 SER CB 1 1 3 1938 1 1 31 SER H H -7.985 1.739 5.160 1.00 . A A . 31 SER H 1 1 3 1939 1 1 31 SER HA H -8.373 4.078 6.684 1.00 . A A . 31 SER HA 1 1 3 1940 1 1 31 SER HB2 H -6.961 1.484 7.346 1.00 . A A . 31 SER HB2 1 1 3 1941 1 1 31 SER HB3 H -7.741 2.593 8.450 1.00 . A A . 31 SER HB3 1 1 3 1942 1 1 31 SER HG H -9.739 2.102 7.363 1.00 . A A . 31 SER HG 1 1 3 1943 1 1 31 SER N N -7.940 2.752 5.152 1.00 . A A . 31 SER N 1 1 3 1944 1 1 31 SER O O -6.044 5.036 6.896 1.00 . A A . 31 SER O 1 1 3 1945 1 1 31 SER OG O -9.016 1.474 7.257 1.00 . A A . 31 SER OG 1 1 3 1946 1 1 32 HIS C C -3.151 2.849 4.691 1.00 . A A . 32 HIS C 1 1 3 1947 1 1 32 HIS CA C -3.889 3.684 5.737 1.00 . A A . 32 HIS CA 1 1 3 1948 1 1 32 HIS CB C -3.118 3.725 7.071 1.00 . A A . 32 HIS CB 1 1 3 1949 1 1 32 HIS CD2 C -3.024 1.279 7.797 1.00 . A A . 32 HIS CD2 1 1 3 1950 1 1 32 HIS CE1 C -0.880 0.969 7.874 1.00 . A A . 32 HIS CE1 1 1 3 1951 1 1 32 HIS CG C -2.429 2.446 7.454 1.00 . A A . 32 HIS CG 1 1 3 1952 1 1 32 HIS H H -5.464 2.271 5.501 1.00 . A A . 32 HIS H 1 1 3 1953 1 1 32 HIS HA H -3.970 4.699 5.350 1.00 . A A . 32 HIS HA 1 1 3 1954 1 1 32 HIS HB2 H -2.339 4.461 7.028 1.00 . A A . 32 HIS HB2 1 1 3 1955 1 1 32 HIS HB3 H -3.786 4.029 7.877 1.00 . A A . 32 HIS HB3 1 1 3 1956 1 1 32 HIS HD1 H -0.331 2.861 7.108 1.00 . A A . 32 HIS HD1 1 1 3 1957 1 1 32 HIS HD2 H -4.080 1.161 7.700 1.00 . A A . 32 HIS HD2 1 1 3 1958 1 1 32 HIS HE1 H 0.075 0.481 7.978 1.00 . A A . 32 HIS HE1 1 1 3 1959 1 1 32 HIS N N -5.243 3.168 5.928 1.00 . A A . 32 HIS N 1 1 3 1960 1 1 32 HIS ND1 N -1.057 2.239 7.466 1.00 . A A . 32 HIS ND1 1 1 3 1961 1 1 32 HIS NE2 N -2.051 0.357 8.114 1.00 . A A . 32 HIS NE2 1 1 3 1962 1 1 32 HIS O O -3.700 1.869 4.183 1.00 . A A . 32 HIS O 1 1 3 1963 1 1 33 GLY C C 0.355 2.166 4.451 1.00 . A A . 33 GLY C 1 1 3 1964 1 1 33 GLY CA C -0.941 2.392 3.682 1.00 . A A . 33 GLY CA 1 1 3 1965 1 1 33 GLY H H -1.537 4.056 4.860 1.00 . A A . 33 GLY H 1 1 3 1966 1 1 33 GLY HA2 H -1.384 1.444 3.469 1.00 . A A . 33 GLY HA2 1 1 3 1967 1 1 33 GLY HA3 H -0.709 2.820 2.720 1.00 . A A . 33 GLY HA3 1 1 3 1968 1 1 33 GLY N N -1.889 3.207 4.431 1.00 . A A . 33 GLY N 1 1 3 1969 1 1 33 GLY O O 0.603 2.849 5.449 1.00 . A A . 33 GLY O 1 1 3 1970 1 1 34 ALA C C 3.240 -0.011 3.542 1.00 . A A . 34 ALA C 1 1 3 1971 1 1 34 ALA CA C 2.487 0.902 4.523 1.00 . A A . 34 ALA CA 1 1 3 1972 1 1 34 ALA CB C 2.380 0.264 5.912 1.00 . A A . 34 ALA CB 1 1 3 1973 1 1 34 ALA H H 0.845 0.640 3.208 1.00 . A A . 34 ALA H 1 1 3 1974 1 1 34 ALA HA H 3.020 1.845 4.622 1.00 . A A . 34 ALA HA 1 1 3 1975 1 1 34 ALA HB1 H 1.787 -0.648 5.870 1.00 . A A . 34 ALA HB1 1 1 3 1976 1 1 34 ALA HB2 H 3.374 0.019 6.285 1.00 . A A . 34 ALA HB2 1 1 3 1977 1 1 34 ALA HB3 H 1.911 0.958 6.607 1.00 . A A . 34 ALA HB3 1 1 3 1978 1 1 34 ALA N N 1.159 1.196 4.002 1.00 . A A . 34 ALA N 1 1 3 1979 1 1 34 ALA O O 2.676 -0.999 3.068 1.00 . A A . 34 ALA O 1 1 3 1980 1 1 35 CYS C C 5.814 -1.771 2.969 1.00 . A A . 35 CYS C 1 1 3 1981 1 1 35 CYS CA C 5.295 -0.496 2.291 1.00 . A A . 35 CYS CA 1 1 3 1982 1 1 35 CYS CB C 6.454 0.338 1.749 1.00 . A A . 35 CYS CB 1 1 3 1983 1 1 35 CYS H H 4.948 1.125 3.602 1.00 . A A . 35 CYS H 1 1 3 1984 1 1 35 CYS HA H 4.678 -0.756 1.439 1.00 . A A . 35 CYS HA 1 1 3 1985 1 1 35 CYS HB2 H 6.985 0.829 2.565 1.00 . A A . 35 CYS HB2 1 1 3 1986 1 1 35 CYS HB3 H 7.148 -0.344 1.281 1.00 . A A . 35 CYS HB3 1 1 3 1987 1 1 35 CYS N N 4.499 0.302 3.213 1.00 . A A . 35 CYS N 1 1 3 1988 1 1 35 CYS O O 6.113 -1.755 4.164 1.00 . A A . 35 CYS O 1 1 3 1989 1 1 35 CYS SG S 5.986 1.542 0.483 1.00 . A A . 35 CYS SG 1 1 3 1990 1 1 36 HIS C C 7.298 -4.826 1.581 1.00 . A A . 36 HIS C 1 1 3 1991 1 1 36 HIS CA C 6.559 -4.121 2.710 1.00 . A A . 36 HIS CA 1 1 3 1992 1 1 36 HIS CB C 5.544 -5.147 3.200 1.00 . A A . 36 HIS CB 1 1 3 1993 1 1 36 HIS CD2 C 3.081 -4.980 3.812 1.00 . A A . 36 HIS CD2 1 1 3 1994 1 1 36 HIS CE1 C 3.219 -3.550 5.457 1.00 . A A . 36 HIS CE1 1 1 3 1995 1 1 36 HIS CG C 4.382 -4.620 3.971 1.00 . A A . 36 HIS CG 1 1 3 1996 1 1 36 HIS H H 5.606 -2.871 1.265 1.00 . A A . 36 HIS H 1 1 3 1997 1 1 36 HIS HA H 7.231 -3.905 3.537 1.00 . A A . 36 HIS HA 1 1 3 1998 1 1 36 HIS HB2 H 5.137 -5.671 2.335 1.00 . A A . 36 HIS HB2 1 1 3 1999 1 1 36 HIS HB3 H 6.062 -5.887 3.815 1.00 . A A . 36 HIS HB3 1 1 3 2000 1 1 36 HIS HD1 H 5.273 -3.097 5.195 1.00 . A A . 36 HIS HD1 1 1 3 2001 1 1 36 HIS HD2 H 2.767 -5.653 3.027 1.00 . A A . 36 HIS HD2 1 1 3 2002 1 1 36 HIS HE1 H 2.954 -2.881 6.262 1.00 . A A . 36 HIS HE1 1 1 3 2003 1 1 36 HIS N N 5.925 -2.888 2.231 1.00 . A A . 36 HIS N 1 1 3 2004 1 1 36 HIS ND1 N 4.461 -3.669 4.970 1.00 . A A . 36 HIS ND1 1 1 3 2005 1 1 36 HIS NE2 N 2.357 -4.365 4.816 1.00 . A A . 36 HIS NE2 1 1 3 2006 1 1 36 HIS O O 6.785 -4.863 0.466 1.00 . A A . 36 HIS O 1 1 3 2007 1 1 37 LYS C C 8.454 -7.722 0.887 1.00 . A A . 37 LYS C 1 1 3 2008 1 1 37 LYS CA C 9.100 -6.344 0.937 1.00 . A A . 37 LYS CA 1 1 3 2009 1 1 37 LYS CB C 10.584 -6.439 1.270 1.00 . A A . 37 LYS CB 1 1 3 2010 1 1 37 LYS CD C 12.788 -7.554 0.573 1.00 . A A . 37 LYS CD 1 1 3 2011 1 1 37 LYS CE C 13.861 -6.521 0.190 1.00 . A A . 37 LYS CE 1 1 3 2012 1 1 37 LYS CG C 11.374 -7.111 0.143 1.00 . A A . 37 LYS CG 1 1 3 2013 1 1 37 LYS H H 8.745 -5.474 2.845 1.00 . A A . 37 LYS H 1 1 3 2014 1 1 37 LYS HA H 9.058 -5.890 -0.044 1.00 . A A . 37 LYS HA 1 1 3 2015 1 1 37 LYS HB2 H 10.952 -5.439 1.364 1.00 . A A . 37 LYS HB2 1 1 3 2016 1 1 37 LYS HB3 H 10.711 -6.931 2.227 1.00 . A A . 37 LYS HB3 1 1 3 2017 1 1 37 LYS HD2 H 12.811 -7.723 1.653 1.00 . A A . 37 LYS HD2 1 1 3 2018 1 1 37 LYS HD3 H 13.008 -8.514 0.111 1.00 . A A . 37 LYS HD3 1 1 3 2019 1 1 37 LYS HE2 H 13.558 -5.966 -0.701 1.00 . A A . 37 LYS HE2 1 1 3 2020 1 1 37 LYS HE3 H 13.960 -5.828 1.024 1.00 . A A . 37 LYS HE3 1 1 3 2021 1 1 37 LYS HG2 H 10.820 -7.988 -0.153 1.00 . A A . 37 LYS HG2 1 1 3 2022 1 1 37 LYS HG3 H 11.391 -6.465 -0.738 1.00 . A A . 37 LYS HG3 1 1 3 2023 1 1 37 LYS HZ1 H 15.059 -8.147 -0.247 1.00 . A A . 37 LYS HZ1 1 1 3 2024 1 1 37 LYS HZ2 H 15.563 -6.713 -0.966 1.00 . A A . 37 LYS HZ2 1 1 3 2025 1 1 37 LYS N N 8.404 -5.502 1.897 1.00 . A A . 37 LYS N 1 1 3 2026 1 1 37 LYS NZ N 15.175 -7.133 -0.109 1.00 . A A . 37 LYS NZ 1 1 3 2027 1 1 37 LYS O O 8.388 -8.429 1.894 1.00 . A A . 37 LYS O 1 1 3 2028 1 1 38 ARG C C 8.332 -9.849 -1.915 1.00 . A A . 38 ARG C 1 1 3 2029 1 1 38 ARG CA C 7.535 -9.424 -0.685 1.00 . A A . 38 ARG CA 1 1 3 2030 1 1 38 ARG CB C 6.053 -9.359 -1.070 1.00 . A A . 38 ARG CB 1 1 3 2031 1 1 38 ARG CD C 4.952 -10.027 1.161 1.00 . A A . 38 ARG CD 1 1 3 2032 1 1 38 ARG CG C 5.046 -8.994 0.030 1.00 . A A . 38 ARG CG 1 1 3 2033 1 1 38 ARG CZ C 6.535 -10.778 2.972 1.00 . A A . 38 ARG CZ 1 1 3 2034 1 1 38 ARG H H 8.112 -7.432 -1.070 1.00 . A A . 38 ARG H 1 1 3 2035 1 1 38 ARG HA H 7.703 -10.152 0.107 1.00 . A A . 38 ARG HA 1 1 3 2036 1 1 38 ARG HB2 H 5.971 -8.614 -1.862 1.00 . A A . 38 ARG HB2 1 1 3 2037 1 1 38 ARG HB3 H 5.785 -10.329 -1.484 1.00 . A A . 38 ARG HB3 1 1 3 2038 1 1 38 ARG HD2 H 4.039 -9.835 1.733 1.00 . A A . 38 ARG HD2 1 1 3 2039 1 1 38 ARG HD3 H 4.899 -11.028 0.731 1.00 . A A . 38 ARG HD3 1 1 3 2040 1 1 38 ARG HG2 H 5.277 -8.006 0.435 1.00 . A A . 38 ARG HG2 1 1 3 2041 1 1 38 ARG HG3 H 4.066 -8.939 -0.448 1.00 . A A . 38 ARG HG3 1 1 3 2042 1 1 38 ARG HH11 H 4.904 -11.981 2.842 1.00 . A A . 38 ARG HH11 1 1 3 2043 1 1 38 ARG HH12 H 6.110 -12.527 3.966 1.00 . A A . 38 ARG HH12 1 1 3 2044 1 1 38 ARG HH21 H 8.262 -9.756 3.214 1.00 . A A . 38 ARG HH21 1 1 3 2045 1 1 38 ARG HH22 H 8.107 -11.163 4.252 1.00 . A A . 38 ARG HH22 1 1 3 2046 1 1 38 ARG N N 8.002 -8.099 -0.310 1.00 . A A . 38 ARG N 1 1 3 2047 1 1 38 ARG NE N 6.102 -9.899 2.059 1.00 . A A . 38 ARG NE 1 1 3 2048 1 1 38 ARG NH1 N 5.798 -11.847 3.287 1.00 . A A . 38 ARG NH1 1 1 3 2049 1 1 38 ARG NH2 N 7.720 -10.555 3.545 1.00 . A A . 38 ARG NH2 1 1 3 2050 1 1 38 ARG O O 8.401 -9.087 -2.875 1.00 . A A . 38 ARG O 1 1 3 2051 1 1 39 GLU C C 10.638 -10.540 -3.606 1.00 . A A . 39 GLU C 1 1 3 2052 1 1 39 GLU CA C 9.684 -11.594 -3.028 1.00 . A A . 39 GLU CA 1 1 3 2053 1 1 39 GLU CB C 8.710 -12.164 -4.075 1.00 . A A . 39 GLU CB 1 1 3 2054 1 1 39 GLU CD C 6.766 -12.981 -2.607 1.00 . A A . 39 GLU CD 1 1 3 2055 1 1 39 GLU CG C 7.910 -13.367 -3.541 1.00 . A A . 39 GLU CG 1 1 3 2056 1 1 39 GLU H H 8.686 -11.687 -1.158 1.00 . A A . 39 GLU H 1 1 3 2057 1 1 39 GLU HA H 10.302 -12.412 -2.659 1.00 . A A . 39 GLU HA 1 1 3 2058 1 1 39 GLU HB2 H 8.030 -11.385 -4.423 1.00 . A A . 39 GLU HB2 1 1 3 2059 1 1 39 GLU HB3 H 9.299 -12.508 -4.925 1.00 . A A . 39 GLU HB3 1 1 3 2060 1 1 39 GLU HG2 H 7.479 -13.895 -4.392 1.00 . A A . 39 GLU HG2 1 1 3 2061 1 1 39 GLU HG3 H 8.580 -14.056 -3.025 1.00 . A A . 39 GLU HG3 1 1 3 2062 1 1 39 GLU N N 8.930 -11.045 -1.903 1.00 . A A . 39 GLU N 1 1 3 2063 1 1 39 GLU O O 10.666 -10.285 -4.806 1.00 . A A . 39 GLU O 1 1 3 2064 1 1 39 GLU OE1 O 6.974 -12.857 -1.400 1.00 . A A . 39 GLU OE1 1 1 3 2065 1 1 39 GLU OE2 O 5.559 -12.780 -3.196 1.00 . A A . 39 GLU OE2 1 1 3 2066 1 1 40 ASN C C 11.678 -7.464 -3.366 1.00 . A A . 40 ASN C 1 1 3 2067 1 1 40 ASN CA C 12.314 -8.796 -2.943 1.00 . A A . 40 ASN CA 1 1 3 2068 1 1 40 ASN CB C 13.402 -9.237 -3.914 1.00 . A A . 40 ASN CB 1 1 3 2069 1 1 40 ASN CG C 14.610 -8.303 -3.841 1.00 . A A . 40 ASN CG 1 1 3 2070 1 1 40 ASN H H 11.328 -10.225 -1.769 1.00 . A A . 40 ASN H 1 1 3 2071 1 1 40 ASN HA H 12.795 -8.616 -1.991 1.00 . A A . 40 ASN HA 1 1 3 2072 1 1 40 ASN HB2 H 13.723 -10.250 -3.673 1.00 . A A . 40 ASN HB2 1 1 3 2073 1 1 40 ASN HB3 H 12.952 -9.254 -4.898 1.00 . A A . 40 ASN HB3 1 1 3 2074 1 1 40 ASN HD21 H 14.784 -8.221 -5.870 1.00 . A A . 40 ASN HD21 1 1 3 2075 1 1 40 ASN HD22 H 15.951 -7.289 -4.959 1.00 . A A . 40 ASN HD22 1 1 3 2076 1 1 40 ASN N N 11.379 -9.885 -2.708 1.00 . A A . 40 ASN N 1 1 3 2077 1 1 40 ASN ND2 N 15.151 -7.902 -4.987 1.00 . A A . 40 ASN ND2 1 1 3 2078 1 1 40 ASN O O 12.329 -6.426 -3.278 1.00 . A A . 40 ASN O 1 1 3 2079 1 1 40 ASN OD1 O 15.058 -7.949 -2.751 1.00 . A A . 40 ASN OD1 1 1 3 2080 1 1 41 HIS C C 9.019 -5.603 -3.085 1.00 . A A . 41 HIS C 1 1 3 2081 1 1 41 HIS CA C 9.693 -6.296 -4.261 1.00 . A A . 41 HIS CA 1 1 3 2082 1 1 41 HIS CB C 8.657 -6.723 -5.303 1.00 . A A . 41 HIS CB 1 1 3 2083 1 1 41 HIS CD2 C 9.342 -8.676 -6.871 1.00 . A A . 41 HIS CD2 1 1 3 2084 1 1 41 HIS CE1 C 10.536 -7.548 -8.304 1.00 . A A . 41 HIS CE1 1 1 3 2085 1 1 41 HIS CG C 9.306 -7.358 -6.509 1.00 . A A . 41 HIS CG 1 1 3 2086 1 1 41 HIS H H 9.873 -8.314 -3.673 1.00 . A A . 41 HIS H 1 1 3 2087 1 1 41 HIS HA H 10.381 -5.616 -4.755 1.00 . A A . 41 HIS HA 1 1 3 2088 1 1 41 HIS HB2 H 7.980 -7.438 -4.834 1.00 . A A . 41 HIS HB2 1 1 3 2089 1 1 41 HIS HB3 H 8.059 -5.859 -5.602 1.00 . A A . 41 HIS HB3 1 1 3 2090 1 1 41 HIS HD1 H 10.217 -5.645 -7.449 1.00 . A A . 41 HIS HD1 1 1 3 2091 1 1 41 HIS HD2 H 8.911 -9.492 -6.308 1.00 . A A . 41 HIS HD2 1 1 3 2092 1 1 41 HIS HE1 H 11.186 -7.309 -9.137 1.00 . A A . 41 HIS HE1 1 1 3 2093 1 1 41 HIS N N 10.413 -7.466 -3.784 1.00 . A A . 41 HIS N 1 1 3 2094 1 1 41 HIS ND1 N 10.044 -6.642 -7.442 1.00 . A A . 41 HIS ND1 1 1 3 2095 1 1 41 HIS NE2 N 10.132 -8.793 -7.998 1.00 . A A . 41 HIS NE2 1 1 3 2096 1 1 41 HIS O O 8.165 -6.195 -2.425 1.00 . A A . 41 HIS O 1 1 3 2097 1 1 42 TRP C C 7.338 -3.108 -2.424 1.00 . A A . 42 TRP C 1 1 3 2098 1 1 42 TRP CA C 8.673 -3.547 -1.847 1.00 . A A . 42 TRP CA 1 1 3 2099 1 1 42 TRP CB C 9.533 -2.378 -1.397 1.00 . A A . 42 TRP CB 1 1 3 2100 1 1 42 TRP CD1 C 11.786 -3.318 -0.756 1.00 . A A . 42 TRP CD1 1 1 3 2101 1 1 42 TRP CD2 C 10.573 -2.684 1.015 1.00 . A A . 42 TRP CD2 1 1 3 2102 1 1 42 TRP CE2 C 11.799 -3.199 1.515 1.00 . A A . 42 TRP CE2 1 1 3 2103 1 1 42 TRP CE3 C 9.582 -2.356 1.960 1.00 . A A . 42 TRP CE3 1 1 3 2104 1 1 42 TRP CG C 10.603 -2.759 -0.436 1.00 . A A . 42 TRP CG 1 1 3 2105 1 1 42 TRP CH2 C 11.021 -3.043 3.801 1.00 . A A . 42 TRP CH2 1 1 3 2106 1 1 42 TRP CZ2 C 12.015 -3.421 2.881 1.00 . A A . 42 TRP CZ2 1 1 3 2107 1 1 42 TRP CZ3 C 9.817 -2.484 3.340 1.00 . A A . 42 TRP CZ3 1 1 3 2108 1 1 42 TRP H H 10.031 -3.876 -3.447 1.00 . A A . 42 TRP H 1 1 3 2109 1 1 42 TRP HA H 8.484 -4.127 -0.959 1.00 . A A . 42 TRP HA 1 1 3 2110 1 1 42 TRP HB2 H 9.960 -1.862 -2.254 1.00 . A A . 42 TRP HB2 1 1 3 2111 1 1 42 TRP HB3 H 8.898 -1.686 -0.860 1.00 . A A . 42 TRP HB3 1 1 3 2112 1 1 42 TRP HD1 H 12.066 -3.606 -1.754 1.00 . A A . 42 TRP HD1 1 1 3 2113 1 1 42 TRP HE1 H 13.445 -3.929 0.434 1.00 . A A . 42 TRP HE1 1 1 3 2114 1 1 42 TRP HE3 H 8.610 -2.064 1.613 1.00 . A A . 42 TRP HE3 1 1 3 2115 1 1 42 TRP HH2 H 11.158 -3.216 4.859 1.00 . A A . 42 TRP HH2 1 1 3 2116 1 1 42 TRP HZ2 H 12.881 -3.988 3.183 1.00 . A A . 42 TRP HZ2 1 1 3 2117 1 1 42 TRP HZ3 H 9.046 -2.185 4.035 1.00 . A A . 42 TRP HZ3 1 1 3 2118 1 1 42 TRP N N 9.375 -4.348 -2.829 1.00 . A A . 42 TRP N 1 1 3 2119 1 1 42 TRP NE1 N 12.524 -3.528 0.389 1.00 . A A . 42 TRP NE1 1 1 3 2120 1 1 42 TRP O O 7.318 -2.294 -3.336 1.00 . A A . 42 TRP O 1 1 3 2121 1 1 43 LYS C C 4.370 -2.265 -1.338 1.00 . A A . 43 LYS C 1 1 3 2122 1 1 43 LYS CA C 4.903 -3.233 -2.376 1.00 . A A . 43 LYS CA 1 1 3 2123 1 1 43 LYS CB C 3.948 -4.421 -2.526 1.00 . A A . 43 LYS CB 1 1 3 2124 1 1 43 LYS CD C 5.452 -5.526 -4.292 1.00 . A A . 43 LYS CD 1 1 3 2125 1 1 43 LYS CE C 4.572 -5.372 -5.551 1.00 . A A . 43 LYS CE 1 1 3 2126 1 1 43 LYS CG C 4.697 -5.677 -2.956 1.00 . A A . 43 LYS CG 1 1 3 2127 1 1 43 LYS H H 6.274 -4.360 -1.220 1.00 . A A . 43 LYS H 1 1 3 2128 1 1 43 LYS HA H 4.962 -2.753 -3.350 1.00 . A A . 43 LYS HA 1 1 3 2129 1 1 43 LYS HB2 H 3.498 -4.631 -1.561 1.00 . A A . 43 LYS HB2 1 1 3 2130 1 1 43 LYS HB3 H 3.140 -4.180 -3.213 1.00 . A A . 43 LYS HB3 1 1 3 2131 1 1 43 LYS HD2 H 6.195 -4.731 -4.262 1.00 . A A . 43 LYS HD2 1 1 3 2132 1 1 43 LYS HD3 H 5.989 -6.467 -4.402 1.00 . A A . 43 LYS HD3 1 1 3 2133 1 1 43 LYS HE2 H 5.196 -5.632 -6.410 1.00 . A A . 43 LYS HE2 1 1 3 2134 1 1 43 LYS HE3 H 3.749 -6.090 -5.515 1.00 . A A . 43 LYS HE3 1 1 3 2135 1 1 43 LYS HG2 H 5.312 -5.948 -2.089 1.00 . A A . 43 LYS HG2 1 1 3 2136 1 1 43 LYS HG3 H 4.024 -6.505 -3.084 1.00 . A A . 43 LYS HG3 1 1 3 2137 1 1 43 LYS HZ1 H 4.411 -3.651 -6.692 1.00 . A A . 43 LYS HZ1 1 1 3 2138 1 1 43 LYS HZ2 H 3.008 -4.049 -5.854 1.00 . A A . 43 LYS HZ2 1 1 3 2139 1 1 43 LYS N N 6.223 -3.655 -1.948 1.00 . A A . 43 LYS N 1 1 3 2140 1 1 43 LYS NZ N 4.036 -4.010 -5.802 1.00 . A A . 43 LYS NZ 1 1 3 2141 1 1 43 LYS O O 4.453 -2.537 -0.141 1.00 . A A . 43 LYS O 1 1 3 2142 1 1 44 CYS C C 1.656 -1.124 -0.690 1.00 . A A . 44 CYS C 1 1 3 2143 1 1 44 CYS CA C 2.928 -0.338 -0.987 1.00 . A A . 44 CYS CA 1 1 3 2144 1 1 44 CYS CB C 2.634 0.947 -1.742 1.00 . A A . 44 CYS CB 1 1 3 2145 1 1 44 CYS H H 3.793 -1.005 -2.797 1.00 . A A . 44 CYS H 1 1 3 2146 1 1 44 CYS HA H 3.408 -0.063 -0.056 1.00 . A A . 44 CYS HA 1 1 3 2147 1 1 44 CYS HB2 H 3.531 1.560 -1.671 1.00 . A A . 44 CYS HB2 1 1 3 2148 1 1 44 CYS HB3 H 2.416 0.724 -2.783 1.00 . A A . 44 CYS HB3 1 1 3 2149 1 1 44 CYS N N 3.796 -1.163 -1.802 1.00 . A A . 44 CYS N 1 1 3 2150 1 1 44 CYS O O 0.826 -1.270 -1.580 1.00 . A A . 44 CYS O 1 1 3 2151 1 1 44 CYS SG S 1.233 1.867 -1.082 1.00 . A A . 44 CYS SG 1 1 3 2152 1 1 45 PHE C C -0.669 -1.262 1.451 1.00 . A A . 45 PHE C 1 1 3 2153 1 1 45 PHE CA C 0.280 -2.325 0.915 1.00 . A A . 45 PHE CA 1 1 3 2154 1 1 45 PHE CB C 0.540 -3.401 1.972 1.00 . A A . 45 PHE CB 1 1 3 2155 1 1 45 PHE CD1 C 2.033 -5.012 0.709 1.00 . A A . 45 PHE CD1 1 1 3 2156 1 1 45 PHE CD2 C -0.082 -5.824 1.590 1.00 . A A . 45 PHE CD2 1 1 3 2157 1 1 45 PHE CE1 C 2.345 -6.310 0.268 1.00 . A A . 45 PHE CE1 1 1 3 2158 1 1 45 PHE CE2 C 0.218 -7.117 1.132 1.00 . A A . 45 PHE CE2 1 1 3 2159 1 1 45 PHE CG C 0.838 -4.774 1.407 1.00 . A A . 45 PHE CG 1 1 3 2160 1 1 45 PHE CZ C 1.437 -7.363 0.478 1.00 . A A . 45 PHE CZ 1 1 3 2161 1 1 45 PHE H H 2.196 -1.468 1.246 1.00 . A A . 45 PHE H 1 1 3 2162 1 1 45 PHE HA H -0.188 -2.802 0.053 1.00 . A A . 45 PHE HA 1 1 3 2163 1 1 45 PHE HB2 H 1.354 -3.071 2.608 1.00 . A A . 45 PHE HB2 1 1 3 2164 1 1 45 PHE HB3 H -0.333 -3.497 2.612 1.00 . A A . 45 PHE HB3 1 1 3 2165 1 1 45 PHE HD1 H 2.735 -4.203 0.566 1.00 . A A . 45 PHE HD1 1 1 3 2166 1 1 45 PHE HD2 H -1.037 -5.634 2.051 1.00 . A A . 45 PHE HD2 1 1 3 2167 1 1 45 PHE HE1 H 3.285 -6.504 -0.227 1.00 . A A . 45 PHE HE1 1 1 3 2168 1 1 45 PHE HE2 H -0.492 -7.919 1.274 1.00 . A A . 45 PHE HE2 1 1 3 2169 1 1 45 PHE HZ H 1.665 -8.360 0.127 1.00 . A A . 45 PHE HZ 1 1 3 2170 1 1 45 PHE N N 1.519 -1.670 0.518 1.00 . A A . 45 PHE N 1 1 3 2171 1 1 45 PHE O O -0.234 -0.286 2.063 1.00 . A A . 45 PHE O 1 1 3 2172 1 1 46 CYS C C -3.913 -1.459 2.606 1.00 . A A . 46 CYS C 1 1 3 2173 1 1 46 CYS CA C -3.043 -0.630 1.689 1.00 . A A . 46 CYS CA 1 1 3 2174 1 1 46 CYS CB C -3.874 -0.164 0.496 1.00 . A A . 46 CYS CB 1 1 3 2175 1 1 46 CYS H H -2.244 -2.346 0.787 1.00 . A A . 46 CYS H 1 1 3 2176 1 1 46 CYS HA H -2.698 0.214 2.290 1.00 . A A . 46 CYS HA 1 1 3 2177 1 1 46 CYS HB2 H -4.297 -1.038 0.011 1.00 . A A . 46 CYS HB2 1 1 3 2178 1 1 46 CYS HB3 H -4.695 0.421 0.888 1.00 . A A . 46 CYS HB3 1 1 3 2179 1 1 46 CYS N N -1.963 -1.478 1.235 1.00 . A A . 46 CYS N 1 1 3 2180 1 1 46 CYS O O -3.997 -2.678 2.477 1.00 . A A . 46 CYS O 1 1 3 2181 1 1 46 CYS SG S -3.053 0.837 -0.770 1.00 . A A . 46 CYS SG 1 1 3 2182 1 1 47 TYR C C -6.593 -0.741 4.714 1.00 . A A . 47 TYR C 1 1 3 2183 1 1 47 TYR CA C -5.224 -1.378 4.673 1.00 . A A . 47 TYR CA 1 1 3 2184 1 1 47 TYR CB C -4.456 -1.009 5.936 1.00 . A A . 47 TYR CB 1 1 3 2185 1 1 47 TYR CD1 C -2.004 -1.249 5.338 1.00 . A A . 47 TYR CD1 1 1 3 2186 1 1 47 TYR CD2 C -2.988 -2.749 6.987 1.00 . A A . 47 TYR CD2 1 1 3 2187 1 1 47 TYR CE1 C -0.763 -1.877 5.508 1.00 . A A . 47 TYR CE1 1 1 3 2188 1 1 47 TYR CE2 C -1.732 -3.331 7.205 1.00 . A A . 47 TYR CE2 1 1 3 2189 1 1 47 TYR CG C -3.118 -1.685 6.081 1.00 . A A . 47 TYR CG 1 1 3 2190 1 1 47 TYR CZ C -0.623 -2.891 6.469 1.00 . A A . 47 TYR CZ 1 1 3 2191 1 1 47 TYR H H -4.395 0.230 3.582 1.00 . A A . 47 TYR H 1 1 3 2192 1 1 47 TYR HA H -5.306 -2.459 4.595 1.00 . A A . 47 TYR HA 1 1 3 2193 1 1 47 TYR HB2 H -4.291 0.062 5.889 1.00 . A A . 47 TYR HB2 1 1 3 2194 1 1 47 TYR HB3 H -5.061 -1.221 6.819 1.00 . A A . 47 TYR HB3 1 1 3 2195 1 1 47 TYR HD1 H -2.094 -0.430 4.642 1.00 . A A . 47 TYR HD1 1 1 3 2196 1 1 47 TYR HD2 H -3.845 -3.111 7.536 1.00 . A A . 47 TYR HD2 1 1 3 2197 1 1 47 TYR HE1 H 0.066 -1.596 4.878 1.00 . A A . 47 TYR HE1 1 1 3 2198 1 1 47 TYR HE2 H -1.629 -4.122 7.935 1.00 . A A . 47 TYR HE2 1 1 3 2199 1 1 47 TYR HH H 0.480 -4.368 6.992 1.00 . A A . 47 TYR HH 1 1 3 2200 1 1 47 TYR N N -4.524 -0.777 3.564 1.00 . A A . 47 TYR N 1 1 3 2201 1 1 47 TYR O O -6.712 0.386 5.184 1.00 . A A . 47 TYR O 1 1 3 2202 1 1 47 TYR OH O 0.590 -3.457 6.692 1.00 . A A . 47 TYR OH 1 1 3 2203 1 1 48 PHE C C -9.557 -1.421 5.643 1.00 . A A . 48 PHE C 1 1 3 2204 1 1 48 PHE CA C -8.966 -0.943 4.324 1.00 . A A . 48 PHE CA 1 1 3 2205 1 1 48 PHE CB C -9.704 -1.548 3.123 1.00 . A A . 48 PHE CB 1 1 3 2206 1 1 48 PHE CD1 C -8.063 -1.266 1.202 1.00 . A A . 48 PHE CD1 1 1 3 2207 1 1 48 PHE CD2 C -10.187 -0.081 1.107 1.00 . A A . 48 PHE CD2 1 1 3 2208 1 1 48 PHE CE1 C -7.697 -0.710 -0.035 1.00 . A A . 48 PHE CE1 1 1 3 2209 1 1 48 PHE CE2 C -9.849 0.415 -0.165 1.00 . A A . 48 PHE CE2 1 1 3 2210 1 1 48 PHE CG C -9.309 -0.952 1.779 1.00 . A A . 48 PHE CG 1 1 3 2211 1 1 48 PHE CZ C -8.615 0.076 -0.747 1.00 . A A . 48 PHE CZ 1 1 3 2212 1 1 48 PHE H H -7.507 -2.393 3.915 1.00 . A A . 48 PHE H 1 1 3 2213 1 1 48 PHE HA H -9.019 0.142 4.278 1.00 . A A . 48 PHE HA 1 1 3 2214 1 1 48 PHE HB2 H -9.499 -2.615 3.082 1.00 . A A . 48 PHE HB2 1 1 3 2215 1 1 48 PHE HB3 H -10.771 -1.472 3.288 1.00 . A A . 48 PHE HB3 1 1 3 2216 1 1 48 PHE HD1 H -7.371 -1.929 1.701 1.00 . A A . 48 PHE HD1 1 1 3 2217 1 1 48 PHE HD2 H -11.122 0.219 1.558 1.00 . A A . 48 PHE HD2 1 1 3 2218 1 1 48 PHE HE1 H -6.720 -0.895 -0.454 1.00 . A A . 48 PHE HE1 1 1 3 2219 1 1 48 PHE HE2 H -10.541 1.058 -0.690 1.00 . A A . 48 PHE HE2 1 1 3 2220 1 1 48 PHE HZ H -8.363 0.438 -1.731 1.00 . A A . 48 PHE HZ 1 1 3 2221 1 1 48 PHE N N -7.620 -1.444 4.251 1.00 . A A . 48 PHE N 1 1 3 2222 1 1 48 PHE O O -8.938 -2.208 6.357 1.00 . A A . 48 PHE O 1 1 3 2223 1 1 49 ASN C C -11.130 -1.835 8.256 1.00 . A A . 49 ASN C 1 1 3 2224 1 1 49 ASN CA C -11.671 -1.810 6.813 1.00 . A A . 49 ASN CA 1 1 3 2225 1 1 49 ASN CB C -11.826 -3.229 6.243 1.00 . A A . 49 ASN CB 1 1 3 2226 1 1 49 ASN CG C -13.166 -3.861 6.569 1.00 . A A . 49 ASN CG 1 1 3 2227 1 1 49 ASN H H -11.264 -0.429 5.252 1.00 . A A . 49 ASN H 1 1 3 2228 1 1 49 ASN HA H -12.638 -1.308 6.828 1.00 . A A . 49 ASN HA 1 1 3 2229 1 1 49 ASN HB2 H -11.753 -3.199 5.155 1.00 . A A . 49 ASN HB2 1 1 3 2230 1 1 49 ASN HB3 H -11.020 -3.863 6.598 1.00 . A A . 49 ASN HB3 1 1 3 2231 1 1 49 ASN HD21 H -13.972 -3.019 4.899 1.00 . A A . 49 ASN HD21 1 1 3 2232 1 1 49 ASN HD22 H -15.018 -4.072 5.805 1.00 . A A . 49 ASN HD22 1 1 3 2233 1 1 49 ASN N N -10.823 -1.083 5.879 1.00 . A A . 49 ASN N 1 1 3 2234 1 1 49 ASN ND2 N -14.135 -3.613 5.695 1.00 . A A . 49 ASN ND2 1 1 3 2235 1 1 49 ASN O O -11.512 -2.705 9.040 1.00 . A A . 49 ASN O 1 1 3 2236 1 1 49 ASN OD1 O -13.324 -4.581 7.553 1.00 . A A . 49 ASN OD1 1 1 3 2237 1 1 50 CYS C C -9.951 -0.034 10.889 1.00 . A A . 50 CYS C 1 1 3 2238 1 1 50 CYS CA C -9.430 -1.000 9.832 1.00 . A A . 50 CYS CA 1 1 3 2239 1 1 50 CYS CB C -7.972 -0.704 9.508 1.00 . A A . 50 CYS CB 1 1 3 2240 1 1 50 CYS H H -9.971 -0.188 7.947 1.00 . A A . 50 CYS H 1 1 3 2241 1 1 50 CYS HA H -9.451 -2.005 10.230 1.00 . A A . 50 CYS HA 1 1 3 2242 1 1 50 CYS HB2 H -7.674 -1.231 8.606 1.00 . A A . 50 CYS HB2 1 1 3 2243 1 1 50 CYS HB3 H -7.908 0.354 9.323 1.00 . A A . 50 CYS HB3 1 1 3 2244 1 1 50 CYS N N -10.223 -0.916 8.608 1.00 . A A . 50 CYS N 1 1 3 2245 1 1 50 CYS O O -10.110 1.190 10.591 1.00 . A A . 50 CYS O 1 1 3 2246 1 1 50 CYS OXT O -10.223 -0.449 12.058 1.00 . A A . 50 CYS OXT 1 1 3 2247 1 1 50 CYS SG S -6.759 -1.065 10.796 1.00 . A A . 50 CYS SG 1 1 4 2248 1 1 1 LEU C C -10.057 -5.101 9.390 1.00 . A A . 1 LEU C 1 1 4 2249 1 1 1 LEU CA C -11.067 -5.280 10.519 1.00 . A A . 1 LEU CA 1 1 4 2250 1 1 1 LEU CB C -11.294 -6.753 10.913 1.00 . A A . 1 LEU CB 1 1 4 2251 1 1 1 LEU CD1 C -12.844 -7.377 8.938 1.00 . A A . 1 LEU CD1 1 1 4 2252 1 1 1 LEU CD2 C -10.482 -8.260 8.982 1.00 . A A . 1 LEU CD2 1 1 4 2253 1 1 1 LEU CG C -11.672 -7.791 9.833 1.00 . A A . 1 LEU CG 1 1 4 2254 1 1 1 LEU H1 H -12.712 -4.963 9.318 1.00 . A A . 1 LEU H1 1 1 4 2255 1 1 1 LEU H2 H -12.997 -4.702 10.956 1.00 . A A . 1 LEU H2 1 1 4 2256 1 1 1 LEU H3 H -12.127 -3.573 10.064 1.00 . A A . 1 LEU H3 1 1 4 2257 1 1 1 LEU HA H -10.672 -4.778 11.403 1.00 . A A . 1 LEU HA 1 1 4 2258 1 1 1 LEU HB2 H -10.385 -7.108 11.400 1.00 . A A . 1 LEU HB2 1 1 4 2259 1 1 1 LEU HB3 H -12.082 -6.766 11.667 1.00 . A A . 1 LEU HB3 1 1 4 2260 1 1 1 LEU HD11 H -13.673 -7.019 9.545 1.00 . A A . 1 LEU HD11 1 1 4 2261 1 1 1 LEU HD12 H -12.540 -6.608 8.229 1.00 . A A . 1 LEU HD12 1 1 4 2262 1 1 1 LEU HD13 H -13.181 -8.245 8.370 1.00 . A A . 1 LEU HD13 1 1 4 2263 1 1 1 LEU HD21 H -9.637 -8.510 9.622 1.00 . A A . 1 LEU HD21 1 1 4 2264 1 1 1 LEU HD22 H -10.774 -9.154 8.430 1.00 . A A . 1 LEU HD22 1 1 4 2265 1 1 1 LEU HD23 H -10.176 -7.506 8.261 1.00 . A A . 1 LEU HD23 1 1 4 2266 1 1 1 LEU HG H -12.001 -8.671 10.386 1.00 . A A . 1 LEU HG 1 1 4 2267 1 1 1 LEU N N -12.320 -4.577 10.189 1.00 . A A . 1 LEU N 1 1 4 2268 1 1 1 LEU O O -10.457 -5.001 8.234 1.00 . A A . 1 LEU O 1 1 4 2269 1 1 2 CYS C C -7.450 -5.438 7.663 1.00 . A A . 2 CYS C 1 1 4 2270 1 1 2 CYS CA C -7.770 -4.467 8.798 1.00 . A A . 2 CYS CA 1 1 4 2271 1 1 2 CYS CB C -6.522 -3.969 9.555 1.00 . A A . 2 CYS CB 1 1 4 2272 1 1 2 CYS H H -8.481 -5.128 10.672 1.00 . A A . 2 CYS H 1 1 4 2273 1 1 2 CYS HA H -8.203 -3.580 8.349 1.00 . A A . 2 CYS HA 1 1 4 2274 1 1 2 CYS HB2 H -5.855 -4.805 9.753 1.00 . A A . 2 CYS HB2 1 1 4 2275 1 1 2 CYS HB3 H -5.987 -3.276 8.914 1.00 . A A . 2 CYS HB3 1 1 4 2276 1 1 2 CYS N N -8.769 -4.994 9.714 1.00 . A A . 2 CYS N 1 1 4 2277 1 1 2 CYS O O -6.443 -6.142 7.719 1.00 . A A . 2 CYS O 1 1 4 2278 1 1 2 CYS SG S -6.826 -3.158 11.152 1.00 . A A . 2 CYS SG 1 1 4 2279 1 1 3 ASN C C -6.831 -5.518 4.693 1.00 . A A . 3 ASN C 1 1 4 2280 1 1 3 ASN CA C -7.948 -6.249 5.426 1.00 . A A . 3 ASN CA 1 1 4 2281 1 1 3 ASN CB C -9.154 -6.630 4.540 1.00 . A A . 3 ASN CB 1 1 4 2282 1 1 3 ASN CG C -9.619 -5.621 3.486 1.00 . A A . 3 ASN CG 1 1 4 2283 1 1 3 ASN H H -9.076 -4.839 6.614 1.00 . A A . 3 ASN H 1 1 4 2284 1 1 3 ASN HA H -7.568 -7.210 5.783 1.00 . A A . 3 ASN HA 1 1 4 2285 1 1 3 ASN HB2 H -8.851 -7.515 3.974 1.00 . A A . 3 ASN HB2 1 1 4 2286 1 1 3 ASN HB3 H -9.988 -6.924 5.175 1.00 . A A . 3 ASN HB3 1 1 4 2287 1 1 3 ASN HD21 H -11.285 -5.165 4.559 1.00 . A A . 3 ASN HD21 1 1 4 2288 1 1 3 ASN HD22 H -11.174 -4.393 3.007 1.00 . A A . 3 ASN HD22 1 1 4 2289 1 1 3 ASN N N -8.274 -5.454 6.605 1.00 . A A . 3 ASN N 1 1 4 2290 1 1 3 ASN ND2 N -10.760 -4.976 3.716 1.00 . A A . 3 ASN ND2 1 1 4 2291 1 1 3 ASN O O -7.019 -4.393 4.225 1.00 . A A . 3 ASN O 1 1 4 2292 1 1 3 ASN OD1 O -9.030 -5.472 2.414 1.00 . A A . 3 ASN OD1 1 1 4 2293 1 1 4 GLU C C -4.512 -6.193 2.602 1.00 . A A . 4 GLU C 1 1 4 2294 1 1 4 GLU CA C -4.457 -5.673 4.036 1.00 . A A . 4 GLU CA 1 1 4 2295 1 1 4 GLU CB C -3.247 -6.198 4.821 1.00 . A A . 4 GLU CB 1 1 4 2296 1 1 4 GLU CD C -0.721 -6.354 4.901 1.00 . A A . 4 GLU CD 1 1 4 2297 1 1 4 GLU CG C -1.937 -6.005 4.057 1.00 . A A . 4 GLU CG 1 1 4 2298 1 1 4 GLU H H -5.586 -7.048 5.125 1.00 . A A . 4 GLU H 1 1 4 2299 1 1 4 GLU HA H -4.432 -4.587 4.048 1.00 . A A . 4 GLU HA 1 1 4 2300 1 1 4 GLU HB2 H -3.194 -5.675 5.777 1.00 . A A . 4 GLU HB2 1 1 4 2301 1 1 4 GLU HB3 H -3.371 -7.266 5.013 1.00 . A A . 4 GLU HB3 1 1 4 2302 1 1 4 GLU HG2 H -1.960 -6.680 3.203 1.00 . A A . 4 GLU HG2 1 1 4 2303 1 1 4 GLU HG3 H -1.844 -4.974 3.714 1.00 . A A . 4 GLU HG3 1 1 4 2304 1 1 4 GLU N N -5.653 -6.137 4.699 1.00 . A A . 4 GLU N 1 1 4 2305 1 1 4 GLU O O -4.848 -7.355 2.387 1.00 . A A . 4 GLU O 1 1 4 2306 1 1 4 GLU OE1 O -0.708 -7.597 5.453 1.00 . A A . 4 GLU OE1 1 1 4 2307 1 1 4 GLU OE2 O 0.174 -5.523 5.045 1.00 . A A . 4 GLU OE2 1 1 4 2308 1 1 5 ARG C C -2.929 -5.002 -0.414 1.00 . A A . 5 ARG C 1 1 4 2309 1 1 5 ARG CA C -4.123 -5.691 0.222 1.00 . A A . 5 ARG CA 1 1 4 2310 1 1 5 ARG CB C -5.429 -5.309 -0.474 1.00 . A A . 5 ARG CB 1 1 4 2311 1 1 5 ARG CD C -7.594 -6.295 -1.318 1.00 . A A . 5 ARG CD 1 1 4 2312 1 1 5 ARG CG C -6.224 -6.591 -0.699 1.00 . A A . 5 ARG CG 1 1 4 2313 1 1 5 ARG CZ C -8.965 -4.289 -0.615 1.00 . A A . 5 ARG CZ 1 1 4 2314 1 1 5 ARG H H -3.891 -4.400 1.878 1.00 . A A . 5 ARG H 1 1 4 2315 1 1 5 ARG HA H -3.947 -6.764 0.135 1.00 . A A . 5 ARG HA 1 1 4 2316 1 1 5 ARG HB2 H -5.988 -4.601 0.136 1.00 . A A . 5 ARG HB2 1 1 4 2317 1 1 5 ARG HB3 H -5.231 -4.861 -1.445 1.00 . A A . 5 ARG HB3 1 1 4 2318 1 1 5 ARG HD2 H -7.454 -5.815 -2.288 1.00 . A A . 5 ARG HD2 1 1 4 2319 1 1 5 ARG HD3 H -8.102 -7.245 -1.493 1.00 . A A . 5 ARG HD3 1 1 4 2320 1 1 5 ARG HG2 H -5.646 -7.235 -1.363 1.00 . A A . 5 ARG HG2 1 1 4 2321 1 1 5 ARG HG3 H -6.325 -7.094 0.262 1.00 . A A . 5 ARG HG3 1 1 4 2322 1 1 5 ARG HH11 H -8.072 -3.894 -2.433 1.00 . A A . 5 ARG HH11 1 1 4 2323 1 1 5 ARG HH12 H -9.186 -2.696 -1.881 1.00 . A A . 5 ARG HH12 1 1 4 2324 1 1 5 ARG HH21 H -9.733 -4.256 1.236 1.00 . A A . 5 ARG HH21 1 1 4 2325 1 1 5 ARG HH22 H -10.006 -2.795 0.323 1.00 . A A . 5 ARG HH22 1 1 4 2326 1 1 5 ARG N N -4.183 -5.341 1.632 1.00 . A A . 5 ARG N 1 1 4 2327 1 1 5 ARG NE N -8.422 -5.498 -0.400 1.00 . A A . 5 ARG NE 1 1 4 2328 1 1 5 ARG NH1 N -8.754 -3.596 -1.740 1.00 . A A . 5 ARG NH1 1 1 4 2329 1 1 5 ARG NH2 N -9.722 -3.763 0.349 1.00 . A A . 5 ARG NH2 1 1 4 2330 1 1 5 ARG O O -2.422 -4.028 0.143 1.00 . A A . 5 ARG O 1 1 4 2331 1 1 6 PRO C C -1.200 -3.818 -2.782 1.00 . A A . 6 PRO C 1 1 4 2332 1 1 6 PRO CA C -1.145 -5.161 -2.052 1.00 . A A . 6 PRO CA 1 1 4 2333 1 1 6 PRO CB C -0.717 -6.320 -2.962 1.00 . A A . 6 PRO CB 1 1 4 2334 1 1 6 PRO CD C -2.968 -6.669 -2.287 1.00 . A A . 6 PRO CD 1 1 4 2335 1 1 6 PRO CG C -2.053 -6.827 -3.499 1.00 . A A . 6 PRO CG 1 1 4 2336 1 1 6 PRO HA H -0.491 -5.103 -1.194 1.00 . A A . 6 PRO HA 1 1 4 2337 1 1 6 PRO HB2 H -0.036 -6.035 -3.764 1.00 . A A . 6 PRO HB2 1 1 4 2338 1 1 6 PRO HB3 H -0.260 -7.101 -2.353 1.00 . A A . 6 PRO HB3 1 1 4 2339 1 1 6 PRO HD2 H -3.987 -6.488 -2.622 1.00 . A A . 6 PRO HD2 1 1 4 2340 1 1 6 PRO HD3 H -2.915 -7.578 -1.685 1.00 . A A . 6 PRO HD3 1 1 4 2341 1 1 6 PRO HG2 H -2.395 -6.173 -4.302 1.00 . A A . 6 PRO HG2 1 1 4 2342 1 1 6 PRO HG3 H -1.999 -7.858 -3.850 1.00 . A A . 6 PRO HG3 1 1 4 2343 1 1 6 PRO N N -2.437 -5.538 -1.540 1.00 . A A . 6 PRO N 1 1 4 2344 1 1 6 PRO O O -2.221 -3.127 -2.789 1.00 . A A . 6 PRO O 1 1 4 2345 1 1 7 SER C C -1.038 -2.585 -5.512 1.00 . A A . 7 SER C 1 1 4 2346 1 1 7 SER CA C -0.067 -2.343 -4.359 1.00 . A A . 7 SER CA 1 1 4 2347 1 1 7 SER CB C 1.348 -2.189 -4.911 1.00 . A A . 7 SER CB 1 1 4 2348 1 1 7 SER H H 0.749 -3.989 -3.307 1.00 . A A . 7 SER H 1 1 4 2349 1 1 7 SER HA H -0.335 -1.420 -3.844 1.00 . A A . 7 SER HA 1 1 4 2350 1 1 7 SER HB2 H 1.263 -1.504 -5.757 1.00 . A A . 7 SER HB2 1 1 4 2351 1 1 7 SER HB3 H 2.000 -1.762 -4.151 1.00 . A A . 7 SER HB3 1 1 4 2352 1 1 7 SER HG H 1.132 -3.817 -5.905 1.00 . A A . 7 SER HG 1 1 4 2353 1 1 7 SER N N -0.100 -3.466 -3.445 1.00 . A A . 7 SER N 1 1 4 2354 1 1 7 SER O O -0.723 -3.325 -6.441 1.00 . A A . 7 SER O 1 1 4 2355 1 1 7 SER OG O 1.832 -3.455 -5.337 1.00 . A A . 7 SER OG 1 1 4 2356 1 1 8 GLN C C -3.048 -0.574 -7.252 1.00 . A A . 8 GLN C 1 1 4 2357 1 1 8 GLN CA C -3.234 -1.847 -6.426 1.00 . A A . 8 GLN CA 1 1 4 2358 1 1 8 GLN CB C -4.561 -1.846 -5.655 1.00 . A A . 8 GLN CB 1 1 4 2359 1 1 8 GLN CD C -5.555 -3.012 -3.622 1.00 . A A . 8 GLN CD 1 1 4 2360 1 1 8 GLN CG C -4.745 -3.174 -4.906 1.00 . A A . 8 GLN CG 1 1 4 2361 1 1 8 GLN H H -2.371 -1.493 -4.542 1.00 . A A . 8 GLN H 1 1 4 2362 1 1 8 GLN HA H -3.196 -2.716 -7.088 1.00 . A A . 8 GLN HA 1 1 4 2363 1 1 8 GLN HB2 H -4.559 -1.018 -4.941 1.00 . A A . 8 GLN HB2 1 1 4 2364 1 1 8 GLN HB3 H -5.394 -1.702 -6.344 1.00 . A A . 8 GLN HB3 1 1 4 2365 1 1 8 GLN HE21 H -3.897 -2.430 -2.609 1.00 . A A . 8 GLN HE21 1 1 4 2366 1 1 8 GLN HE22 H -5.403 -2.381 -1.701 1.00 . A A . 8 GLN HE22 1 1 4 2367 1 1 8 GLN HG2 H -5.229 -3.864 -5.579 1.00 . A A . 8 GLN HG2 1 1 4 2368 1 1 8 GLN HG3 H -3.793 -3.628 -4.639 1.00 . A A . 8 GLN HG3 1 1 4 2369 1 1 8 GLN N N -2.177 -1.907 -5.437 1.00 . A A . 8 GLN N 1 1 4 2370 1 1 8 GLN NE2 N -4.910 -2.532 -2.563 1.00 . A A . 8 GLN NE2 1 1 4 2371 1 1 8 GLN O O -3.005 -0.610 -8.477 1.00 . A A . 8 GLN O 1 1 4 2372 1 1 8 GLN OE1 O -6.740 -3.334 -3.562 1.00 . A A . 8 GLN OE1 1 1 4 2373 1 1 9 THR C C -1.138 1.937 -7.511 1.00 . A A . 9 THR C 1 1 4 2374 1 1 9 THR CA C -2.609 1.863 -7.113 1.00 . A A . 9 THR CA 1 1 4 2375 1 1 9 THR CB C -2.849 2.881 -5.991 1.00 . A A . 9 THR CB 1 1 4 2376 1 1 9 THR CG2 C -4.338 3.201 -5.860 1.00 . A A . 9 THR CG2 1 1 4 2377 1 1 9 THR H H -2.948 0.544 -5.547 1.00 . A A . 9 THR H 1 1 4 2378 1 1 9 THR HA H -3.232 2.080 -7.982 1.00 . A A . 9 THR HA 1 1 4 2379 1 1 9 THR HB H -2.299 3.803 -6.208 1.00 . A A . 9 THR HB 1 1 4 2380 1 1 9 THR HG1 H -2.564 2.923 -4.045 1.00 . A A . 9 THR HG1 1 1 4 2381 1 1 9 THR HG21 H -4.729 3.540 -6.819 1.00 . A A . 9 THR HG21 1 1 4 2382 1 1 9 THR HG22 H -4.882 2.313 -5.549 1.00 . A A . 9 THR HG22 1 1 4 2383 1 1 9 THR HG23 H -4.469 3.991 -5.120 1.00 . A A . 9 THR HG23 1 1 4 2384 1 1 9 THR N N -2.914 0.558 -6.557 1.00 . A A . 9 THR N 1 1 4 2385 1 1 9 THR O O -0.785 2.394 -8.594 1.00 . A A . 9 THR O 1 1 4 2386 1 1 9 THR OG1 O -2.390 2.309 -4.774 1.00 . A A . 9 THR OG1 1 1 4 2387 1 1 10 TRP C C 1.906 1.488 -7.728 1.00 . A A . 10 TRP C 1 1 4 2388 1 1 10 TRP CA C 1.095 2.038 -6.551 1.00 . A A . 10 TRP CA 1 1 4 2389 1 1 10 TRP CB C 1.749 1.699 -5.212 1.00 . A A . 10 TRP CB 1 1 4 2390 1 1 10 TRP CD1 C 4.249 1.614 -5.567 1.00 . A A . 10 TRP CD1 1 1 4 2391 1 1 10 TRP CD2 C 3.575 3.501 -4.561 1.00 . A A . 10 TRP CD2 1 1 4 2392 1 1 10 TRP CE2 C 4.963 3.648 -4.838 1.00 . A A . 10 TRP CE2 1 1 4 2393 1 1 10 TRP CE3 C 2.931 4.562 -3.898 1.00 . A A . 10 TRP CE3 1 1 4 2394 1 1 10 TRP CG C 3.138 2.226 -5.106 1.00 . A A . 10 TRP CG 1 1 4 2395 1 1 10 TRP CH2 C 5.000 5.846 -3.842 1.00 . A A . 10 TRP CH2 1 1 4 2396 1 1 10 TRP CZ2 C 5.673 4.801 -4.489 1.00 . A A . 10 TRP CZ2 1 1 4 2397 1 1 10 TRP CZ3 C 3.628 5.730 -3.539 1.00 . A A . 10 TRP CZ3 1 1 4 2398 1 1 10 TRP H H -0.700 1.324 -5.666 1.00 . A A . 10 TRP H 1 1 4 2399 1 1 10 TRP HA H 1.076 3.124 -6.637 1.00 . A A . 10 TRP HA 1 1 4 2400 1 1 10 TRP HB2 H 1.157 2.145 -4.408 1.00 . A A . 10 TRP HB2 1 1 4 2401 1 1 10 TRP HB3 H 1.762 0.619 -5.082 1.00 . A A . 10 TRP HB3 1 1 4 2402 1 1 10 TRP HD1 H 4.266 0.649 -6.054 1.00 . A A . 10 TRP HD1 1 1 4 2403 1 1 10 TRP HE1 H 6.255 2.288 -5.812 1.00 . A A . 10 TRP HE1 1 1 4 2404 1 1 10 TRP HE3 H 1.881 4.474 -3.669 1.00 . A A . 10 TRP HE3 1 1 4 2405 1 1 10 TRP HH2 H 5.561 6.730 -3.598 1.00 . A A . 10 TRP HH2 1 1 4 2406 1 1 10 TRP HZ2 H 6.719 4.897 -4.740 1.00 . A A . 10 TRP HZ2 1 1 4 2407 1 1 10 TRP HZ3 H 3.081 6.524 -3.041 1.00 . A A . 10 TRP HZ3 1 1 4 2408 1 1 10 TRP N N -0.282 1.594 -6.549 1.00 . A A . 10 TRP N 1 1 4 2409 1 1 10 TRP NE1 N 5.318 2.474 -5.469 1.00 . A A . 10 TRP NE1 1 1 4 2410 1 1 10 TRP O O 1.789 0.323 -8.111 1.00 . A A . 10 TRP O 1 1 4 2411 1 1 11 SER C C 4.777 1.101 -8.976 1.00 . A A . 11 SER C 1 1 4 2412 1 1 11 SER CA C 3.655 2.057 -9.380 1.00 . A A . 11 SER CA 1 1 4 2413 1 1 11 SER CB C 4.208 3.405 -9.853 1.00 . A A . 11 SER CB 1 1 4 2414 1 1 11 SER H H 2.924 3.249 -7.836 1.00 . A A . 11 SER H 1 1 4 2415 1 1 11 SER HA H 3.075 1.608 -10.188 1.00 . A A . 11 SER HA 1 1 4 2416 1 1 11 SER HB2 H 4.999 3.252 -10.591 1.00 . A A . 11 SER HB2 1 1 4 2417 1 1 11 SER HB3 H 3.409 3.990 -10.311 1.00 . A A . 11 SER HB3 1 1 4 2418 1 1 11 SER HG H 5.452 3.590 -8.382 1.00 . A A . 11 SER HG 1 1 4 2419 1 1 11 SER N N 2.800 2.332 -8.246 1.00 . A A . 11 SER N 1 1 4 2420 1 1 11 SER O O 5.925 1.510 -8.794 1.00 . A A . 11 SER O 1 1 4 2421 1 1 11 SER OG O 4.708 4.102 -8.727 1.00 . A A . 11 SER OG 1 1 4 2422 1 1 12 GLY C C 6.082 -1.324 -7.382 1.00 . A A . 12 GLY C 1 1 4 2423 1 1 12 GLY CA C 5.450 -1.230 -8.760 1.00 . A A . 12 GLY CA 1 1 4 2424 1 1 12 GLY H H 3.461 -0.423 -8.876 1.00 . A A . 12 GLY H 1 1 4 2425 1 1 12 GLY HA2 H 5.011 -2.188 -8.972 1.00 . A A . 12 GLY HA2 1 1 4 2426 1 1 12 GLY HA3 H 6.220 -1.058 -9.514 1.00 . A A . 12 GLY HA3 1 1 4 2427 1 1 12 GLY N N 4.449 -0.182 -8.843 1.00 . A A . 12 GLY N 1 1 4 2428 1 1 12 GLY O O 5.579 -2.027 -6.500 1.00 . A A . 12 GLY O 1 1 4 2429 1 1 13 ASN C C 8.022 0.509 -5.220 1.00 . A A . 13 ASN C 1 1 4 2430 1 1 13 ASN CA C 8.111 -0.746 -6.094 1.00 . A A . 13 ASN CA 1 1 4 2431 1 1 13 ASN CB C 9.549 -1.052 -6.511 1.00 . A A . 13 ASN CB 1 1 4 2432 1 1 13 ASN CG C 10.374 -1.504 -5.307 1.00 . A A . 13 ASN CG 1 1 4 2433 1 1 13 ASN H H 7.453 -0.077 -8.040 1.00 . A A . 13 ASN H 1 1 4 2434 1 1 13 ASN HA H 7.786 -1.607 -5.520 1.00 . A A . 13 ASN HA 1 1 4 2435 1 1 13 ASN HB2 H 9.539 -1.864 -7.237 1.00 . A A . 13 ASN HB2 1 1 4 2436 1 1 13 ASN HB3 H 9.993 -0.170 -6.972 1.00 . A A . 13 ASN HB3 1 1 4 2437 1 1 13 ASN HD21 H 11.020 0.396 -4.937 1.00 . A A . 13 ASN HD21 1 1 4 2438 1 1 13 ASN HD22 H 11.600 -0.838 -3.843 1.00 . A A . 13 ASN HD22 1 1 4 2439 1 1 13 ASN N N 7.227 -0.663 -7.251 1.00 . A A . 13 ASN N 1 1 4 2440 1 1 13 ASN ND2 N 11.042 -0.568 -4.639 1.00 . A A . 13 ASN ND2 1 1 4 2441 1 1 13 ASN O O 7.921 1.627 -5.720 1.00 . A A . 13 ASN O 1 1 4 2442 1 1 13 ASN OD1 O 10.397 -2.689 -4.965 1.00 . A A . 13 ASN OD1 1 1 4 2443 1 1 14 CYS C C 8.584 2.331 -2.585 1.00 . A A . 14 CYS C 1 1 4 2444 1 1 14 CYS CA C 7.534 1.280 -2.924 1.00 . A A . 14 CYS CA 1 1 4 2445 1 1 14 CYS CB C 7.049 0.543 -1.677 1.00 . A A . 14 CYS CB 1 1 4 2446 1 1 14 CYS H H 8.166 -0.632 -3.588 1.00 . A A . 14 CYS H 1 1 4 2447 1 1 14 CYS HA H 6.663 1.787 -3.333 1.00 . A A . 14 CYS HA 1 1 4 2448 1 1 14 CYS HB2 H 6.431 -0.292 -1.992 1.00 . A A . 14 CYS HB2 1 1 4 2449 1 1 14 CYS HB3 H 7.885 0.164 -1.096 1.00 . A A . 14 CYS HB3 1 1 4 2450 1 1 14 CYS N N 8.015 0.316 -3.903 1.00 . A A . 14 CYS N 1 1 4 2451 1 1 14 CYS O O 9.290 2.221 -1.589 1.00 . A A . 14 CYS O 1 1 4 2452 1 1 14 CYS SG S 6.018 1.575 -0.624 1.00 . A A . 14 CYS SG 1 1 4 2453 1 1 15 GLY C C 9.664 5.105 -1.934 1.00 . A A . 15 GLY C 1 1 4 2454 1 1 15 GLY CA C 9.658 4.430 -3.307 1.00 . A A . 15 GLY CA 1 1 4 2455 1 1 15 GLY H H 8.119 3.316 -4.271 1.00 . A A . 15 GLY H 1 1 4 2456 1 1 15 GLY HA2 H 10.646 4.016 -3.491 1.00 . A A . 15 GLY HA2 1 1 4 2457 1 1 15 GLY HA3 H 9.450 5.183 -4.066 1.00 . A A . 15 GLY HA3 1 1 4 2458 1 1 15 GLY N N 8.678 3.358 -3.430 1.00 . A A . 15 GLY N 1 1 4 2459 1 1 15 GLY O O 10.724 5.472 -1.434 1.00 . A A . 15 GLY O 1 1 4 2460 1 1 16 ASN C C 7.040 5.629 0.652 1.00 . A A . 16 ASN C 1 1 4 2461 1 1 16 ASN CA C 8.363 5.962 -0.034 1.00 . A A . 16 ASN CA 1 1 4 2462 1 1 16 ASN CB C 8.530 7.484 -0.170 1.00 . A A . 16 ASN CB 1 1 4 2463 1 1 16 ASN CG C 8.743 8.155 1.185 1.00 . A A . 16 ASN CG 1 1 4 2464 1 1 16 ASN H H 7.662 4.944 -1.795 1.00 . A A . 16 ASN H 1 1 4 2465 1 1 16 ASN HA H 9.178 5.596 0.594 1.00 . A A . 16 ASN HA 1 1 4 2466 1 1 16 ASN HB2 H 9.407 7.694 -0.781 1.00 . A A . 16 ASN HB2 1 1 4 2467 1 1 16 ASN HB3 H 7.656 7.925 -0.647 1.00 . A A . 16 ASN HB3 1 1 4 2468 1 1 16 ASN HD21 H 9.993 9.549 0.381 1.00 . A A . 16 ASN HD21 1 1 4 2469 1 1 16 ASN HD22 H 9.688 9.676 2.100 1.00 . A A . 16 ASN HD22 1 1 4 2470 1 1 16 ASN N N 8.484 5.308 -1.337 1.00 . A A . 16 ASN N 1 1 4 2471 1 1 16 ASN ND2 N 9.527 9.225 1.215 1.00 . A A . 16 ASN ND2 1 1 4 2472 1 1 16 ASN O O 5.970 5.920 0.119 1.00 . A A . 16 ASN O 1 1 4 2473 1 1 16 ASN OD1 O 8.190 7.733 2.198 1.00 . A A . 16 ASN OD1 1 1 4 2474 1 1 17 THR C C 5.028 5.874 2.933 1.00 . A A . 17 THR C 1 1 4 2475 1 1 17 THR CA C 5.944 4.671 2.648 1.00 . A A . 17 THR CA 1 1 4 2476 1 1 17 THR CB C 6.423 3.916 3.902 1.00 . A A . 17 THR CB 1 1 4 2477 1 1 17 THR CG2 C 6.961 4.841 5.001 1.00 . A A . 17 THR CG2 1 1 4 2478 1 1 17 THR H H 8.021 4.906 2.258 1.00 . A A . 17 THR H 1 1 4 2479 1 1 17 THR HA H 5.389 3.960 2.046 1.00 . A A . 17 THR HA 1 1 4 2480 1 1 17 THR HB H 7.230 3.253 3.597 1.00 . A A . 17 THR HB 1 1 4 2481 1 1 17 THR HG1 H 5.659 2.824 5.318 1.00 . A A . 17 THR HG1 1 1 4 2482 1 1 17 THR HG21 H 7.727 5.500 4.595 1.00 . A A . 17 THR HG21 1 1 4 2483 1 1 17 THR HG22 H 6.155 5.440 5.425 1.00 . A A . 17 THR HG22 1 1 4 2484 1 1 17 THR HG23 H 7.406 4.242 5.796 1.00 . A A . 17 THR HG23 1 1 4 2485 1 1 17 THR N N 7.107 5.068 1.862 1.00 . A A . 17 THR N 1 1 4 2486 1 1 17 THR O O 3.799 5.774 2.888 1.00 . A A . 17 THR O 1 1 4 2487 1 1 17 THR OG1 O 5.410 3.078 4.423 1.00 . A A . 17 THR OG1 1 1 4 2488 1 1 18 ALA C C 4.093 8.707 2.144 1.00 . A A . 18 ALA C 1 1 4 2489 1 1 18 ALA CA C 4.880 8.279 3.384 1.00 . A A . 18 ALA CA 1 1 4 2490 1 1 18 ALA CB C 5.837 9.386 3.834 1.00 . A A . 18 ALA CB 1 1 4 2491 1 1 18 ALA H H 6.637 7.112 3.093 1.00 . A A . 18 ALA H 1 1 4 2492 1 1 18 ALA HA H 4.159 8.103 4.185 1.00 . A A . 18 ALA HA 1 1 4 2493 1 1 18 ALA HB1 H 6.398 9.058 4.709 1.00 . A A . 18 ALA HB1 1 1 4 2494 1 1 18 ALA HB2 H 6.532 9.634 3.032 1.00 . A A . 18 ALA HB2 1 1 4 2495 1 1 18 ALA HB3 H 5.267 10.278 4.096 1.00 . A A . 18 ALA HB3 1 1 4 2496 1 1 18 ALA N N 5.625 7.050 3.153 1.00 . A A . 18 ALA N 1 1 4 2497 1 1 18 ALA O O 3.168 9.512 2.263 1.00 . A A . 18 ALA O 1 1 4 2498 1 1 19 HIS C C 2.705 7.192 -0.395 1.00 . A A . 19 HIS C 1 1 4 2499 1 1 19 HIS CA C 3.677 8.370 -0.263 1.00 . A A . 19 HIS CA 1 1 4 2500 1 1 19 HIS CB C 4.620 8.493 -1.464 1.00 . A A . 19 HIS CB 1 1 4 2501 1 1 19 HIS CD2 C 2.704 9.316 -3.043 1.00 . A A . 19 HIS CD2 1 1 4 2502 1 1 19 HIS CE1 C 3.885 9.477 -4.877 1.00 . A A . 19 HIS CE1 1 1 4 2503 1 1 19 HIS CG C 4.006 9.001 -2.748 1.00 . A A . 19 HIS CG 1 1 4 2504 1 1 19 HIS H H 5.218 7.539 0.925 1.00 . A A . 19 HIS H 1 1 4 2505 1 1 19 HIS HA H 3.103 9.295 -0.200 1.00 . A A . 19 HIS HA 1 1 4 2506 1 1 19 HIS HB2 H 5.415 9.179 -1.217 1.00 . A A . 19 HIS HB2 1 1 4 2507 1 1 19 HIS HB3 H 5.076 7.519 -1.631 1.00 . A A . 19 HIS HB3 1 1 4 2508 1 1 19 HIS HD1 H 5.761 9.106 -3.998 1.00 . A A . 19 HIS HD1 1 1 4 2509 1 1 19 HIS HD2 H 1.865 9.258 -2.361 1.00 . A A . 19 HIS HD2 1 1 4 2510 1 1 19 HIS HE1 H 4.149 9.604 -5.919 1.00 . A A . 19 HIS HE1 1 1 4 2511 1 1 19 HIS N N 4.458 8.209 0.955 1.00 . A A . 19 HIS N 1 1 4 2512 1 1 19 HIS ND1 N 4.759 9.211 -3.896 1.00 . A A . 19 HIS ND1 1 1 4 2513 1 1 19 HIS NE2 N 2.631 9.534 -4.406 1.00 . A A . 19 HIS NE2 1 1 4 2514 1 1 19 HIS O O 1.536 7.407 -0.708 1.00 . A A . 19 HIS O 1 1 4 2515 1 1 20 CYS C C 1.022 4.969 0.535 1.00 . A A . 20 CYS C 1 1 4 2516 1 1 20 CYS CA C 2.346 4.752 -0.181 1.00 . A A . 20 CYS CA 1 1 4 2517 1 1 20 CYS CB C 3.044 3.588 0.519 1.00 . A A . 20 CYS CB 1 1 4 2518 1 1 20 CYS H H 4.156 5.852 0.068 1.00 . A A . 20 CYS H 1 1 4 2519 1 1 20 CYS HA H 2.146 4.490 -1.217 1.00 . A A . 20 CYS HA 1 1 4 2520 1 1 20 CYS HB2 H 3.945 3.302 -0.016 1.00 . A A . 20 CYS HB2 1 1 4 2521 1 1 20 CYS HB3 H 3.312 3.877 1.526 1.00 . A A . 20 CYS HB3 1 1 4 2522 1 1 20 CYS N N 3.172 5.961 -0.153 1.00 . A A . 20 CYS N 1 1 4 2523 1 1 20 CYS O O -0.047 4.718 -0.014 1.00 . A A . 20 CYS O 1 1 4 2524 1 1 20 CYS SG S 1.962 2.165 0.760 1.00 . A A . 20 CYS SG 1 1 4 2525 1 1 21 ASP C C -1.006 6.694 1.922 1.00 . A A . 21 ASP C 1 1 4 2526 1 1 21 ASP CA C -0.050 5.696 2.595 1.00 . A A . 21 ASP CA 1 1 4 2527 1 1 21 ASP CB C 0.449 6.255 3.930 1.00 . A A . 21 ASP CB 1 1 4 2528 1 1 21 ASP CG C -0.718 6.690 4.796 1.00 . A A . 21 ASP CG 1 1 4 2529 1 1 21 ASP H H 2.039 5.657 2.145 1.00 . A A . 21 ASP H 1 1 4 2530 1 1 21 ASP HA H -0.555 4.732 2.766 1.00 . A A . 21 ASP HA 1 1 4 2531 1 1 21 ASP HB2 H 1.027 5.497 4.460 1.00 . A A . 21 ASP HB2 1 1 4 2532 1 1 21 ASP HB3 H 1.090 7.120 3.751 1.00 . A A . 21 ASP HB3 1 1 4 2533 1 1 21 ASP N N 1.111 5.497 1.754 1.00 . A A . 21 ASP N 1 1 4 2534 1 1 21 ASP O O -2.224 6.516 1.968 1.00 . A A . 21 ASP O 1 1 4 2535 1 1 21 ASP OD1 O -1.569 5.858 5.097 1.00 . A A . 21 ASP OD1 1 1 4 2536 1 1 21 ASP OD2 O -0.735 8.003 5.150 1.00 . A A . 21 ASP OD2 1 1 4 2537 1 1 22 LYS C C -1.999 7.863 -0.618 1.00 . A A . 22 LYS C 1 1 4 2538 1 1 22 LYS CA C -1.292 8.642 0.480 1.00 . A A . 22 LYS CA 1 1 4 2539 1 1 22 LYS CB C -0.511 9.810 -0.130 1.00 . A A . 22 LYS CB 1 1 4 2540 1 1 22 LYS CD C 0.749 11.916 0.482 1.00 . A A . 22 LYS CD 1 1 4 2541 1 1 22 LYS CE C 1.347 12.743 1.630 1.00 . A A . 22 LYS CE 1 1 4 2542 1 1 22 LYS CG C 0.217 10.562 0.972 1.00 . A A . 22 LYS CG 1 1 4 2543 1 1 22 LYS H H 0.539 7.753 1.133 1.00 . A A . 22 LYS H 1 1 4 2544 1 1 22 LYS HA H -2.025 9.072 1.156 1.00 . A A . 22 LYS HA 1 1 4 2545 1 1 22 LYS HB2 H 0.197 9.463 -0.879 1.00 . A A . 22 LYS HB2 1 1 4 2546 1 1 22 LYS HB3 H -1.220 10.476 -0.622 1.00 . A A . 22 LYS HB3 1 1 4 2547 1 1 22 LYS HD2 H 1.483 11.766 -0.313 1.00 . A A . 22 LYS HD2 1 1 4 2548 1 1 22 LYS HD3 H -0.089 12.481 0.066 1.00 . A A . 22 LYS HD3 1 1 4 2549 1 1 22 LYS HE2 H 1.598 13.740 1.260 1.00 . A A . 22 LYS HE2 1 1 4 2550 1 1 22 LYS HE3 H 0.594 12.852 2.416 1.00 . A A . 22 LYS HE3 1 1 4 2551 1 1 22 LYS HG2 H -0.487 10.708 1.794 1.00 . A A . 22 LYS HG2 1 1 4 2552 1 1 22 LYS HG3 H 1.011 9.902 1.289 1.00 . A A . 22 LYS HG3 1 1 4 2553 1 1 22 LYS HZ1 H 2.560 11.114 2.007 1.00 . A A . 22 LYS HZ1 1 1 4 2554 1 1 22 LYS HZ2 H 3.398 12.555 1.786 1.00 . A A . 22 LYS HZ2 1 1 4 2555 1 1 22 LYS N N -0.464 7.728 1.259 1.00 . A A . 22 LYS N 1 1 4 2556 1 1 22 LYS NZ N 2.561 12.124 2.205 1.00 . A A . 22 LYS NZ 1 1 4 2557 1 1 22 LYS O O -3.219 7.942 -0.747 1.00 . A A . 22 LYS O 1 1 4 2558 1 1 23 GLN C C -2.679 5.059 -1.969 1.00 . A A . 23 GLN C 1 1 4 2559 1 1 23 GLN CA C -1.872 6.275 -2.454 1.00 . A A . 23 GLN CA 1 1 4 2560 1 1 23 GLN CB C -0.873 5.871 -3.538 1.00 . A A . 23 GLN CB 1 1 4 2561 1 1 23 GLN CD C 0.642 6.900 -5.326 1.00 . A A . 23 GLN CD 1 1 4 2562 1 1 23 GLN CG C 0.021 7.044 -3.951 1.00 . A A . 23 GLN CG 1 1 4 2563 1 1 23 GLN H H -0.271 6.965 -1.167 1.00 . A A . 23 GLN H 1 1 4 2564 1 1 23 GLN HA H -2.557 6.960 -2.938 1.00 . A A . 23 GLN HA 1 1 4 2565 1 1 23 GLN HB2 H -0.260 5.044 -3.180 1.00 . A A . 23 GLN HB2 1 1 4 2566 1 1 23 GLN HB3 H -1.465 5.538 -4.393 1.00 . A A . 23 GLN HB3 1 1 4 2567 1 1 23 GLN HE21 H 0.156 4.925 -5.473 1.00 . A A . 23 GLN HE21 1 1 4 2568 1 1 23 GLN HE22 H 0.915 5.663 -6.866 1.00 . A A . 23 GLN HE22 1 1 4 2569 1 1 23 GLN HG2 H -0.575 7.954 -3.984 1.00 . A A . 23 GLN HG2 1 1 4 2570 1 1 23 GLN HG3 H 0.825 7.148 -3.231 1.00 . A A . 23 GLN HG3 1 1 4 2571 1 1 23 GLN N N -1.260 7.052 -1.380 1.00 . A A . 23 GLN N 1 1 4 2572 1 1 23 GLN NE2 N 0.586 5.717 -5.922 1.00 . A A . 23 GLN NE2 1 1 4 2573 1 1 23 GLN O O -2.755 4.046 -2.662 1.00 . A A . 23 GLN O 1 1 4 2574 1 1 23 GLN OE1 O 1.172 7.875 -5.858 1.00 . A A . 23 GLN OE1 1 1 4 2575 1 1 24 CYS C C -5.323 4.952 0.487 1.00 . A A . 24 CYS C 1 1 4 2576 1 1 24 CYS CA C -4.182 4.193 -0.186 1.00 . A A . 24 CYS CA 1 1 4 2577 1 1 24 CYS CB C -3.378 3.373 0.833 1.00 . A A . 24 CYS CB 1 1 4 2578 1 1 24 CYS H H -3.273 6.082 -0.355 1.00 . A A . 24 CYS H 1 1 4 2579 1 1 24 CYS HA H -4.610 3.524 -0.939 1.00 . A A . 24 CYS HA 1 1 4 2580 1 1 24 CYS HB2 H -2.856 4.045 1.511 1.00 . A A . 24 CYS HB2 1 1 4 2581 1 1 24 CYS HB3 H -4.062 2.767 1.416 1.00 . A A . 24 CYS HB3 1 1 4 2582 1 1 24 CYS N N -3.334 5.186 -0.816 1.00 . A A . 24 CYS N 1 1 4 2583 1 1 24 CYS O O -6.492 4.641 0.268 1.00 . A A . 24 CYS O 1 1 4 2584 1 1 24 CYS SG S -2.162 2.210 0.171 1.00 . A A . 24 CYS SG 1 1 4 2585 1 1 25 GLN C C -6.629 7.795 0.838 1.00 . A A . 25 GLN C 1 1 4 2586 1 1 25 GLN CA C -6.005 6.853 1.875 1.00 . A A . 25 GLN CA 1 1 4 2587 1 1 25 GLN CB C -5.385 7.682 3.007 1.00 . A A . 25 GLN CB 1 1 4 2588 1 1 25 GLN CD C -4.199 7.692 5.209 1.00 . A A . 25 GLN CD 1 1 4 2589 1 1 25 GLN CG C -4.797 6.816 4.116 1.00 . A A . 25 GLN CG 1 1 4 2590 1 1 25 GLN H H -4.019 6.184 1.462 1.00 . A A . 25 GLN H 1 1 4 2591 1 1 25 GLN HA H -6.789 6.233 2.312 1.00 . A A . 25 GLN HA 1 1 4 2592 1 1 25 GLN HB2 H -4.591 8.319 2.624 1.00 . A A . 25 GLN HB2 1 1 4 2593 1 1 25 GLN HB3 H -6.158 8.313 3.448 1.00 . A A . 25 GLN HB3 1 1 4 2594 1 1 25 GLN HE21 H -5.286 6.748 6.620 1.00 . A A . 25 GLN HE21 1 1 4 2595 1 1 25 GLN HE22 H -4.275 8.067 7.201 1.00 . A A . 25 GLN HE22 1 1 4 2596 1 1 25 GLN HG2 H -5.589 6.183 4.520 1.00 . A A . 25 GLN HG2 1 1 4 2597 1 1 25 GLN HG3 H -4.010 6.182 3.715 1.00 . A A . 25 GLN HG3 1 1 4 2598 1 1 25 GLN N N -4.997 5.991 1.265 1.00 . A A . 25 GLN N 1 1 4 2599 1 1 25 GLN NE2 N -4.624 7.498 6.448 1.00 . A A . 25 GLN NE2 1 1 4 2600 1 1 25 GLN O O -7.851 7.942 0.777 1.00 . A A . 25 GLN O 1 1 4 2601 1 1 25 GLN OE1 O -3.355 8.544 4.948 1.00 . A A . 25 GLN OE1 1 1 4 2602 1 1 26 ASP C C -6.874 8.972 -2.078 1.00 . A A . 26 ASP C 1 1 4 2603 1 1 26 ASP CA C -6.255 9.558 -0.822 1.00 . A A . 26 ASP CA 1 1 4 2604 1 1 26 ASP CB C -5.116 10.520 -1.179 1.00 . A A . 26 ASP CB 1 1 4 2605 1 1 26 ASP CG C -4.624 11.307 0.030 1.00 . A A . 26 ASP CG 1 1 4 2606 1 1 26 ASP H H -4.811 8.234 0.026 1.00 . A A . 26 ASP H 1 1 4 2607 1 1 26 ASP HA H -7.011 10.145 -0.309 1.00 . A A . 26 ASP HA 1 1 4 2608 1 1 26 ASP HB2 H -4.289 9.982 -1.630 1.00 . A A . 26 ASP HB2 1 1 4 2609 1 1 26 ASP HB3 H -5.489 11.226 -1.919 1.00 . A A . 26 ASP HB3 1 1 4 2610 1 1 26 ASP N N -5.797 8.481 0.050 1.00 . A A . 26 ASP N 1 1 4 2611 1 1 26 ASP O O -8.015 9.289 -2.414 1.00 . A A . 26 ASP O 1 1 4 2612 1 1 26 ASP OD1 O -5.527 12.143 0.610 1.00 . A A . 26 ASP OD1 1 1 4 2613 1 1 26 ASP OD2 O -3.470 11.162 0.422 1.00 . A A . 26 ASP OD2 1 1 4 2614 1 1 27 TRP C C -7.571 6.545 -3.926 1.00 . A A . 27 TRP C 1 1 4 2615 1 1 27 TRP CA C -6.445 7.567 -4.053 1.00 . A A . 27 TRP CA 1 1 4 2616 1 1 27 TRP CB C -5.214 6.877 -4.640 1.00 . A A . 27 TRP CB 1 1 4 2617 1 1 27 TRP CD1 C -3.732 8.955 -4.708 1.00 . A A . 27 TRP CD1 1 1 4 2618 1 1 27 TRP CD2 C -3.244 7.450 -6.289 1.00 . A A . 27 TRP CD2 1 1 4 2619 1 1 27 TRP CE2 C -2.317 8.519 -6.440 1.00 . A A . 27 TRP CE2 1 1 4 2620 1 1 27 TRP CE3 C -3.160 6.382 -7.199 1.00 . A A . 27 TRP CE3 1 1 4 2621 1 1 27 TRP CG C -4.119 7.745 -5.168 1.00 . A A . 27 TRP CG 1 1 4 2622 1 1 27 TRP CH2 C -1.235 7.389 -8.289 1.00 . A A . 27 TRP CH2 1 1 4 2623 1 1 27 TRP CZ2 C -1.334 8.507 -7.441 1.00 . A A . 27 TRP CZ2 1 1 4 2624 1 1 27 TRP CZ3 C -2.153 6.334 -8.175 1.00 . A A . 27 TRP CZ3 1 1 4 2625 1 1 27 TRP H H -5.187 7.933 -2.369 1.00 . A A . 27 TRP H 1 1 4 2626 1 1 27 TRP HA H -6.755 8.360 -4.733 1.00 . A A . 27 TRP HA 1 1 4 2627 1 1 27 TRP HB2 H -4.780 6.205 -3.901 1.00 . A A . 27 TRP HB2 1 1 4 2628 1 1 27 TRP HB3 H -5.561 6.265 -5.476 1.00 . A A . 27 TRP HB3 1 1 4 2629 1 1 27 TRP HD1 H -4.179 9.491 -3.887 1.00 . A A . 27 TRP HD1 1 1 4 2630 1 1 27 TRP HE1 H -2.194 10.296 -5.287 1.00 . A A . 27 TRP HE1 1 1 4 2631 1 1 27 TRP HE3 H -3.900 5.602 -7.150 1.00 . A A . 27 TRP HE3 1 1 4 2632 1 1 27 TRP HH2 H -0.457 7.320 -9.029 1.00 . A A . 27 TRP HH2 1 1 4 2633 1 1 27 TRP HZ2 H -0.641 9.331 -7.542 1.00 . A A . 27 TRP HZ2 1 1 4 2634 1 1 27 TRP HZ3 H -2.089 5.489 -8.845 1.00 . A A . 27 TRP HZ3 1 1 4 2635 1 1 27 TRP N N -6.110 8.104 -2.742 1.00 . A A . 27 TRP N 1 1 4 2636 1 1 27 TRP NE1 N -2.659 9.415 -5.444 1.00 . A A . 27 TRP NE1 1 1 4 2637 1 1 27 TRP O O -8.641 6.723 -4.500 1.00 . A A . 27 TRP O 1 1 4 2638 1 1 28 GLU C C -9.113 5.054 -1.665 1.00 . A A . 28 GLU C 1 1 4 2639 1 1 28 GLU CA C -8.315 4.483 -2.844 1.00 . A A . 28 GLU CA 1 1 4 2640 1 1 28 GLU CB C -7.616 3.131 -2.592 1.00 . A A . 28 GLU CB 1 1 4 2641 1 1 28 GLU CD C -8.743 1.896 -4.514 1.00 . A A . 28 GLU CD 1 1 4 2642 1 1 28 GLU CG C -8.503 1.949 -3.007 1.00 . A A . 28 GLU CG 1 1 4 2643 1 1 28 GLU H H -6.420 5.427 -2.699 1.00 . A A . 28 GLU H 1 1 4 2644 1 1 28 GLU HA H -9.001 4.387 -3.687 1.00 . A A . 28 GLU HA 1 1 4 2645 1 1 28 GLU HB2 H -6.700 3.078 -3.185 1.00 . A A . 28 GLU HB2 1 1 4 2646 1 1 28 GLU HB3 H -7.319 3.029 -1.550 1.00 . A A . 28 GLU HB3 1 1 4 2647 1 1 28 GLU HG2 H -8.006 1.024 -2.728 1.00 . A A . 28 GLU HG2 1 1 4 2648 1 1 28 GLU HG3 H -9.464 2.010 -2.496 1.00 . A A . 28 GLU HG3 1 1 4 2649 1 1 28 GLU N N -7.307 5.471 -3.177 1.00 . A A . 28 GLU N 1 1 4 2650 1 1 28 GLU O O -9.370 6.252 -1.649 1.00 . A A . 28 GLU O 1 1 4 2651 1 1 28 GLU OE1 O -7.648 1.678 -5.291 1.00 . A A . 28 GLU OE1 1 1 4 2652 1 1 28 GLU OE2 O -9.880 2.045 -4.948 1.00 . A A . 28 GLU OE2 1 1 4 2653 1 1 29 LYS C C -9.797 3.604 1.616 1.00 . A A . 29 LYS C 1 1 4 2654 1 1 29 LYS CA C -10.070 4.700 0.587 1.00 . A A . 29 LYS CA 1 1 4 2655 1 1 29 LYS CB C -11.587 4.941 0.406 1.00 . A A . 29 LYS CB 1 1 4 2656 1 1 29 LYS CD C -11.688 7.499 0.658 1.00 . A A . 29 LYS CD 1 1 4 2657 1 1 29 LYS CE C -11.350 8.761 -0.158 1.00 . A A . 29 LYS CE 1 1 4 2658 1 1 29 LYS CG C -12.030 6.277 -0.219 1.00 . A A . 29 LYS CG 1 1 4 2659 1 1 29 LYS H H -9.111 3.321 -0.623 1.00 . A A . 29 LYS H 1 1 4 2660 1 1 29 LYS HA H -9.549 5.585 0.921 1.00 . A A . 29 LYS HA 1 1 4 2661 1 1 29 LYS HB2 H -12.000 4.121 -0.184 1.00 . A A . 29 LYS HB2 1 1 4 2662 1 1 29 LYS HB3 H -12.046 4.899 1.390 1.00 . A A . 29 LYS HB3 1 1 4 2663 1 1 29 LYS HD2 H -12.554 7.712 1.287 1.00 . A A . 29 LYS HD2 1 1 4 2664 1 1 29 LYS HD3 H -10.857 7.283 1.330 1.00 . A A . 29 LYS HD3 1 1 4 2665 1 1 29 LYS HE2 H -12.119 8.932 -0.913 1.00 . A A . 29 LYS HE2 1 1 4 2666 1 1 29 LYS HE3 H -11.328 9.618 0.518 1.00 . A A . 29 LYS HE3 1 1 4 2667 1 1 29 LYS HG2 H -11.646 6.364 -1.231 1.00 . A A . 29 LYS HG2 1 1 4 2668 1 1 29 LYS HG3 H -13.117 6.242 -0.318 1.00 . A A . 29 LYS HG3 1 1 4 2669 1 1 29 LYS HZ1 H -9.865 7.672 -1.088 1.00 . A A . 29 LYS HZ1 1 1 4 2670 1 1 29 LYS HZ2 H -9.996 9.257 -1.633 1.00 . A A . 29 LYS HZ2 1 1 4 2671 1 1 29 LYS N N -9.419 4.271 -0.633 1.00 . A A . 29 LYS N 1 1 4 2672 1 1 29 LYS NZ N -10.027 8.648 -0.804 1.00 . A A . 29 LYS NZ 1 1 4 2673 1 1 29 LYS O O -10.694 2.964 2.162 1.00 . A A . 29 LYS O 1 1 4 2674 1 1 30 ALA C C -7.903 3.387 4.201 1.00 . A A . 30 ALA C 1 1 4 2675 1 1 30 ALA CA C -8.001 2.556 2.920 1.00 . A A . 30 ALA CA 1 1 4 2676 1 1 30 ALA CB C -6.628 2.038 2.502 1.00 . A A . 30 ALA CB 1 1 4 2677 1 1 30 ALA H H -7.831 3.965 1.352 1.00 . A A . 30 ALA H 1 1 4 2678 1 1 30 ALA HA H -8.672 1.713 3.066 1.00 . A A . 30 ALA HA 1 1 4 2679 1 1 30 ALA HB1 H -6.687 1.603 1.505 1.00 . A A . 30 ALA HB1 1 1 4 2680 1 1 30 ALA HB2 H -5.932 2.875 2.502 1.00 . A A . 30 ALA HB2 1 1 4 2681 1 1 30 ALA HB3 H -6.275 1.286 3.198 1.00 . A A . 30 ALA HB3 1 1 4 2682 1 1 30 ALA N N -8.504 3.394 1.853 1.00 . A A . 30 ALA N 1 1 4 2683 1 1 30 ALA O O -7.863 4.613 4.144 1.00 . A A . 30 ALA O 1 1 4 2684 1 1 31 SER C C -6.054 3.933 6.538 1.00 . A A . 31 SER C 1 1 4 2685 1 1 31 SER CA C -7.482 3.390 6.601 1.00 . A A . 31 SER CA 1 1 4 2686 1 1 31 SER CB C -7.630 2.372 7.720 1.00 . A A . 31 SER CB 1 1 4 2687 1 1 31 SER H H -7.743 1.726 5.398 1.00 . A A . 31 SER H 1 1 4 2688 1 1 31 SER HA H -8.170 4.211 6.786 1.00 . A A . 31 SER HA 1 1 4 2689 1 1 31 SER HB2 H -6.979 1.532 7.505 1.00 . A A . 31 SER HB2 1 1 4 2690 1 1 31 SER HB3 H -7.274 2.838 8.627 1.00 . A A . 31 SER HB3 1 1 4 2691 1 1 31 SER HG H -9.530 2.547 7.345 1.00 . A A . 31 SER HG 1 1 4 2692 1 1 31 SER N N -7.812 2.734 5.361 1.00 . A A . 31 SER N 1 1 4 2693 1 1 31 SER O O -5.811 5.053 6.981 1.00 . A A . 31 SER O 1 1 4 2694 1 1 31 SER OG O -8.979 1.943 7.860 1.00 . A A . 31 SER OG 1 1 4 2695 1 1 32 HIS C C -3.094 2.785 4.662 1.00 . A A . 32 HIS C 1 1 4 2696 1 1 32 HIS CA C -3.756 3.635 5.741 1.00 . A A . 32 HIS CA 1 1 4 2697 1 1 32 HIS CB C -2.912 3.669 7.032 1.00 . A A . 32 HIS CB 1 1 4 2698 1 1 32 HIS CD2 C -2.743 1.223 7.753 1.00 . A A . 32 HIS CD2 1 1 4 2699 1 1 32 HIS CE1 C -0.596 0.936 7.671 1.00 . A A . 32 HIS CE1 1 1 4 2700 1 1 32 HIS CG C -2.187 2.395 7.365 1.00 . A A . 32 HIS CG 1 1 4 2701 1 1 32 HIS H H -5.360 2.253 5.601 1.00 . A A . 32 HIS H 1 1 4 2702 1 1 32 HIS HA H -3.837 4.651 5.360 1.00 . A A . 32 HIS HA 1 1 4 2703 1 1 32 HIS HB2 H -2.141 4.411 6.942 1.00 . A A . 32 HIS HB2 1 1 4 2704 1 1 32 HIS HB3 H -3.535 3.965 7.877 1.00 . A A . 32 HIS HB3 1 1 4 2705 1 1 32 HIS HD1 H -0.125 2.847 6.895 1.00 . A A . 32 HIS HD1 1 1 4 2706 1 1 32 HIS HD2 H -3.800 1.096 7.744 1.00 . A A . 32 HIS HD2 1 1 4 2707 1 1 32 HIS HE1 H 0.371 0.460 7.704 1.00 . A A . 32 HIS HE1 1 1 4 2708 1 1 32 HIS N N -5.108 3.154 6.001 1.00 . A A . 32 HIS N 1 1 4 2709 1 1 32 HIS ND1 N -0.816 2.206 7.286 1.00 . A A . 32 HIS ND1 1 1 4 2710 1 1 32 HIS NE2 N -1.740 0.309 7.986 1.00 . A A . 32 HIS NE2 1 1 4 2711 1 1 32 HIS O O -3.670 1.792 4.214 1.00 . A A . 32 HIS O 1 1 4 2712 1 1 33 GLY C C 0.433 2.237 4.251 1.00 . A A . 33 GLY C 1 1 4 2713 1 1 33 GLY CA C -0.931 2.301 3.576 1.00 . A A . 33 GLY CA 1 1 4 2714 1 1 33 GLY H H -1.489 4.014 4.699 1.00 . A A . 33 GLY H 1 1 4 2715 1 1 33 GLY HA2 H -1.328 1.313 3.547 1.00 . A A . 33 GLY HA2 1 1 4 2716 1 1 33 GLY HA3 H -0.810 2.617 2.550 1.00 . A A . 33 GLY HA3 1 1 4 2717 1 1 33 GLY N N -1.855 3.147 4.314 1.00 . A A . 33 GLY N 1 1 4 2718 1 1 33 GLY O O 0.681 2.981 5.204 1.00 . A A . 33 GLY O 1 1 4 2719 1 1 34 ALA C C 3.463 0.268 3.304 1.00 . A A . 34 ALA C 1 1 4 2720 1 1 34 ALA CA C 2.659 1.156 4.267 1.00 . A A . 34 ALA CA 1 1 4 2721 1 1 34 ALA CB C 2.631 0.561 5.680 1.00 . A A . 34 ALA CB 1 1 4 2722 1 1 34 ALA H H 0.981 0.701 3.042 1.00 . A A . 34 ALA H 1 1 4 2723 1 1 34 ALA HA H 3.118 2.143 4.308 1.00 . A A . 34 ALA HA 1 1 4 2724 1 1 34 ALA HB1 H 2.052 -0.363 5.685 1.00 . A A . 34 ALA HB1 1 1 4 2725 1 1 34 ALA HB2 H 3.643 0.350 6.018 1.00 . A A . 34 ALA HB2 1 1 4 2726 1 1 34 ALA HB3 H 2.173 1.265 6.374 1.00 . A A . 34 ALA HB3 1 1 4 2727 1 1 34 ALA N N 1.292 1.318 3.790 1.00 . A A . 34 ALA N 1 1 4 2728 1 1 34 ALA O O 2.917 -0.688 2.751 1.00 . A A . 34 ALA O 1 1 4 2729 1 1 35 CYS C C 5.994 -1.560 2.981 1.00 . A A . 35 CYS C 1 1 4 2730 1 1 35 CYS CA C 5.654 -0.238 2.279 1.00 . A A . 35 CYS CA 1 1 4 2731 1 1 35 CYS CB C 6.992 0.499 2.119 1.00 . A A . 35 CYS CB 1 1 4 2732 1 1 35 CYS H H 5.170 1.367 3.565 1.00 . A A . 35 CYS H 1 1 4 2733 1 1 35 CYS HA H 5.201 -0.396 1.298 1.00 . A A . 35 CYS HA 1 1 4 2734 1 1 35 CYS HB2 H 7.379 0.761 3.104 1.00 . A A . 35 CYS HB2 1 1 4 2735 1 1 35 CYS HB3 H 7.677 -0.211 1.687 1.00 . A A . 35 CYS HB3 1 1 4 2736 1 1 35 CYS N N 4.762 0.550 3.122 1.00 . A A . 35 CYS N 1 1 4 2737 1 1 35 CYS O O 6.224 -1.555 4.193 1.00 . A A . 35 CYS O 1 1 4 2738 1 1 35 CYS SG S 7.156 1.953 1.062 1.00 . A A . 35 CYS SG 1 1 4 2739 1 1 36 HIS C C 7.456 -4.641 1.668 1.00 . A A . 36 HIS C 1 1 4 2740 1 1 36 HIS CA C 6.674 -3.937 2.764 1.00 . A A . 36 HIS CA 1 1 4 2741 1 1 36 HIS CB C 5.627 -4.956 3.194 1.00 . A A . 36 HIS CB 1 1 4 2742 1 1 36 HIS CD2 C 3.184 -4.815 3.896 1.00 . A A . 36 HIS CD2 1 1 4 2743 1 1 36 HIS CE1 C 3.351 -3.298 5.460 1.00 . A A . 36 HIS CE1 1 1 4 2744 1 1 36 HIS CG C 4.483 -4.432 3.995 1.00 . A A . 36 HIS CG 1 1 4 2745 1 1 36 HIS H H 5.829 -2.662 1.275 1.00 . A A . 36 HIS H 1 1 4 2746 1 1 36 HIS HA H 7.306 -3.741 3.626 1.00 . A A . 36 HIS HA 1 1 4 2747 1 1 36 HIS HB2 H 5.210 -5.419 2.299 1.00 . A A . 36 HIS HB2 1 1 4 2748 1 1 36 HIS HB3 H 6.118 -5.744 3.768 1.00 . A A . 36 HIS HB3 1 1 4 2749 1 1 36 HIS HD1 H 5.407 -2.889 5.172 1.00 . A A . 36 HIS HD1 1 1 4 2750 1 1 36 HIS HD2 H 2.847 -5.533 3.162 1.00 . A A . 36 HIS HD2 1 1 4 2751 1 1 36 HIS HE1 H 3.099 -2.595 6.238 1.00 . A A . 36 HIS HE1 1 1 4 2752 1 1 36 HIS N N 6.083 -2.688 2.261 1.00 . A A . 36 HIS N 1 1 4 2753 1 1 36 HIS ND1 N 4.585 -3.456 4.967 1.00 . A A . 36 HIS ND1 1 1 4 2754 1 1 36 HIS NE2 N 2.476 -4.130 4.862 1.00 . A A . 36 HIS NE2 1 1 4 2755 1 1 36 HIS O O 7.000 -4.654 0.528 1.00 . A A . 36 HIS O 1 1 4 2756 1 1 37 LYS C C 8.509 -7.587 1.115 1.00 . A A . 37 LYS C 1 1 4 2757 1 1 37 LYS CA C 9.219 -6.238 1.109 1.00 . A A . 37 LYS CA 1 1 4 2758 1 1 37 LYS CB C 10.697 -6.372 1.477 1.00 . A A . 37 LYS CB 1 1 4 2759 1 1 37 LYS CD C 12.871 -7.600 0.841 1.00 . A A . 37 LYS CD 1 1 4 2760 1 1 37 LYS CE C 14.042 -6.664 0.504 1.00 . A A . 37 LYS CE 1 1 4 2761 1 1 37 LYS CG C 11.511 -7.050 0.369 1.00 . A A . 37 LYS CG 1 1 4 2762 1 1 37 LYS H H 8.802 -5.360 2.999 1.00 . A A . 37 LYS H 1 1 4 2763 1 1 37 LYS HA H 9.203 -5.826 0.109 1.00 . A A . 37 LYS HA 1 1 4 2764 1 1 37 LYS HB2 H 11.086 -5.386 1.605 1.00 . A A . 37 LYS HB2 1 1 4 2765 1 1 37 LYS HB3 H 10.794 -6.883 2.425 1.00 . A A . 37 LYS HB3 1 1 4 2766 1 1 37 LYS HD2 H 12.846 -7.795 1.916 1.00 . A A . 37 LYS HD2 1 1 4 2767 1 1 37 LYS HD3 H 13.034 -8.562 0.354 1.00 . A A . 37 LYS HD3 1 1 4 2768 1 1 37 LYS HE2 H 13.852 -6.145 -0.439 1.00 . A A . 37 LYS HE2 1 1 4 2769 1 1 37 LYS HE3 H 14.135 -5.929 1.305 1.00 . A A . 37 LYS HE3 1 1 4 2770 1 1 37 LYS HG2 H 10.922 -7.883 0.016 1.00 . A A . 37 LYS HG2 1 1 4 2771 1 1 37 LYS HG3 H 11.621 -6.366 -0.475 1.00 . A A . 37 LYS HG3 1 1 4 2772 1 1 37 LYS HZ1 H 15.124 -8.401 0.228 1.00 . A A . 37 LYS HZ1 1 1 4 2773 1 1 37 LYS HZ2 H 15.813 -7.045 -0.490 1.00 . A A . 37 LYS HZ2 1 1 4 2774 1 1 37 LYS N N 8.535 -5.341 2.026 1.00 . A A . 37 LYS N 1 1 4 2775 1 1 37 LYS NZ N 15.318 -7.396 0.342 1.00 . A A . 37 LYS NZ 1 1 4 2776 1 1 37 LYS O O 8.221 -8.139 2.173 1.00 . A A . 37 LYS O 1 1 4 2777 1 1 38 ARG C C 8.076 -9.963 -1.608 1.00 . A A . 38 ARG C 1 1 4 2778 1 1 38 ARG CA C 7.563 -9.381 -0.289 1.00 . A A . 38 ARG CA 1 1 4 2779 1 1 38 ARG CB C 6.042 -9.155 -0.305 1.00 . A A . 38 ARG CB 1 1 4 2780 1 1 38 ARG CD C 5.249 -11.273 0.799 1.00 . A A . 38 ARG CD 1 1 4 2781 1 1 38 ARG CG C 5.346 -9.749 0.928 1.00 . A A . 38 ARG CG 1 1 4 2782 1 1 38 ARG CZ C 4.415 -13.230 2.077 1.00 . A A . 38 ARG CZ 1 1 4 2783 1 1 38 ARG H H 8.427 -7.537 -0.900 1.00 . A A . 38 ARG H 1 1 4 2784 1 1 38 ARG HA H 7.839 -10.058 0.521 1.00 . A A . 38 ARG HA 1 1 4 2785 1 1 38 ARG HB2 H 5.849 -8.080 -0.328 1.00 . A A . 38 ARG HB2 1 1 4 2786 1 1 38 ARG HB3 H 5.617 -9.585 -1.210 1.00 . A A . 38 ARG HB3 1 1 4 2787 1 1 38 ARG HD2 H 4.665 -11.501 -0.095 1.00 . A A . 38 ARG HD2 1 1 4 2788 1 1 38 ARG HD3 H 6.252 -11.689 0.699 1.00 . A A . 38 ARG HD3 1 1 4 2789 1 1 38 ARG HG2 H 5.891 -9.471 1.831 1.00 . A A . 38 ARG HG2 1 1 4 2790 1 1 38 ARG HG3 H 4.337 -9.338 0.992 1.00 . A A . 38 ARG HG3 1 1 4 2791 1 1 38 ARG HH11 H 5.289 -13.682 0.278 1.00 . A A . 38 ARG HH11 1 1 4 2792 1 1 38 ARG HH12 H 4.716 -15.054 1.171 1.00 . A A . 38 ARG HH12 1 1 4 2793 1 1 38 ARG HH21 H 3.501 -13.116 3.907 1.00 . A A . 38 ARG HH21 1 1 4 2794 1 1 38 ARG HH22 H 3.675 -14.721 3.279 1.00 . A A . 38 ARG HH22 1 1 4 2795 1 1 38 ARG N N 8.228 -8.106 -0.080 1.00 . A A . 38 ARG N 1 1 4 2796 1 1 38 ARG NE N 4.596 -11.902 1.955 1.00 . A A . 38 ARG NE 1 1 4 2797 1 1 38 ARG NH1 N 4.833 -14.055 1.109 1.00 . A A . 38 ARG NH1 1 1 4 2798 1 1 38 ARG NH2 N 3.820 -13.726 3.168 1.00 . A A . 38 ARG NH2 1 1 4 2799 1 1 38 ARG O O 8.110 -9.252 -2.608 1.00 . A A . 38 ARG O 1 1 4 2800 1 1 39 GLU C C 10.335 -10.895 -3.275 1.00 . A A . 39 GLU C 1 1 4 2801 1 1 39 GLU CA C 9.266 -11.842 -2.707 1.00 . A A . 39 GLU CA 1 1 4 2802 1 1 39 GLU CB C 8.298 -12.345 -3.790 1.00 . A A . 39 GLU CB 1 1 4 2803 1 1 39 GLU CD C 6.170 -12.914 -2.489 1.00 . A A . 39 GLU CD 1 1 4 2804 1 1 39 GLU CG C 7.350 -13.448 -3.293 1.00 . A A . 39 GLU CG 1 1 4 2805 1 1 39 GLU H H 8.460 -11.755 -0.745 1.00 . A A . 39 GLU H 1 1 4 2806 1 1 39 GLU HA H 9.799 -12.708 -2.314 1.00 . A A . 39 GLU HA 1 1 4 2807 1 1 39 GLU HB2 H 7.730 -11.511 -4.205 1.00 . A A . 39 GLU HB2 1 1 4 2808 1 1 39 GLU HB3 H 8.899 -12.779 -4.591 1.00 . A A . 39 GLU HB3 1 1 4 2809 1 1 39 GLU HG2 H 6.939 -13.962 -4.163 1.00 . A A . 39 GLU HG2 1 1 4 2810 1 1 39 GLU HG3 H 7.904 -14.177 -2.701 1.00 . A A . 39 GLU HG3 1 1 4 2811 1 1 39 GLU N N 8.539 -11.221 -1.597 1.00 . A A . 39 GLU N 1 1 4 2812 1 1 39 GLU O O 10.500 -10.765 -4.484 1.00 . A A . 39 GLU O 1 1 4 2813 1 1 39 GLU OE1 O 5.323 -12.085 -3.154 1.00 . A A . 39 GLU OE1 1 1 4 2814 1 1 39 GLU OE2 O 6.031 -13.244 -1.310 1.00 . A A . 39 GLU OE2 1 1 4 2815 1 1 40 ASN C C 11.633 -8.027 -3.447 1.00 . A A . 40 ASN C 1 1 4 2816 1 1 40 ASN CA C 12.101 -9.252 -2.659 1.00 . A A . 40 ASN CA 1 1 4 2817 1 1 40 ASN CB C 13.270 -9.944 -3.349 1.00 . A A . 40 ASN CB 1 1 4 2818 1 1 40 ASN CG C 14.576 -9.163 -3.186 1.00 . A A . 40 ASN CG 1 1 4 2819 1 1 40 ASN H H 10.927 -10.470 -1.417 1.00 . A A . 40 ASN H 1 1 4 2820 1 1 40 ASN HA H 12.433 -8.890 -1.694 1.00 . A A . 40 ASN HA 1 1 4 2821 1 1 40 ASN HB2 H 13.390 -10.941 -2.935 1.00 . A A . 40 ASN HB2 1 1 4 2822 1 1 40 ASN HB3 H 12.987 -10.050 -4.390 1.00 . A A . 40 ASN HB3 1 1 4 2823 1 1 40 ASN HD21 H 15.147 -9.556 -5.098 1.00 . A A . 40 ASN HD21 1 1 4 2824 1 1 40 ASN HD22 H 16.263 -8.600 -4.150 1.00 . A A . 40 ASN HD22 1 1 4 2825 1 1 40 ASN N N 11.054 -10.222 -2.376 1.00 . A A . 40 ASN N 1 1 4 2826 1 1 40 ASN ND2 N 15.395 -9.106 -4.230 1.00 . A A . 40 ASN ND2 1 1 4 2827 1 1 40 ASN O O 12.451 -7.330 -4.039 1.00 . A A . 40 ASN O 1 1 4 2828 1 1 40 ASN OD1 O 14.859 -8.627 -2.112 1.00 . A A . 40 ASN OD1 1 1 4 2829 1 1 41 HIS C C 9.103 -5.732 -2.973 1.00 . A A . 41 HIS C 1 1 4 2830 1 1 41 HIS CA C 9.753 -6.566 -4.068 1.00 . A A . 41 HIS CA 1 1 4 2831 1 1 41 HIS CB C 8.747 -7.015 -5.126 1.00 . A A . 41 HIS CB 1 1 4 2832 1 1 41 HIS CD2 C 9.413 -9.075 -6.564 1.00 . A A . 41 HIS CD2 1 1 4 2833 1 1 41 HIS CE1 C 10.831 -8.098 -7.903 1.00 . A A . 41 HIS CE1 1 1 4 2834 1 1 41 HIS CG C 9.443 -7.741 -6.252 1.00 . A A . 41 HIS CG 1 1 4 2835 1 1 41 HIS H H 9.676 -8.357 -2.980 1.00 . A A . 41 HIS H 1 1 4 2836 1 1 41 HIS HA H 10.519 -5.985 -4.569 1.00 . A A . 41 HIS HA 1 1 4 2837 1 1 41 HIS HB2 H 8.032 -7.684 -4.647 1.00 . A A . 41 HIS HB2 1 1 4 2838 1 1 41 HIS HB3 H 8.193 -6.152 -5.496 1.00 . A A . 41 HIS HB3 1 1 4 2839 1 1 41 HIS HD1 H 10.568 -6.141 -7.155 1.00 . A A . 41 HIS HD1 1 1 4 2840 1 1 41 HIS HD2 H 8.888 -9.834 -6.006 1.00 . A A . 41 HIS HD2 1 1 4 2841 1 1 41 HIS HE1 H 11.582 -7.943 -8.666 1.00 . A A . 41 HIS HE1 1 1 4 2842 1 1 41 HIS N N 10.331 -7.739 -3.444 1.00 . A A . 41 HIS N 1 1 4 2843 1 1 41 HIS ND1 N 10.316 -7.121 -7.134 1.00 . A A . 41 HIS ND1 1 1 4 2844 1 1 41 HIS NE2 N 10.306 -9.294 -7.593 1.00 . A A . 41 HIS NE2 1 1 4 2845 1 1 41 HIS O O 8.260 -6.246 -2.238 1.00 . A A . 41 HIS O 1 1 4 2846 1 1 42 TRP C C 7.553 -3.106 -2.417 1.00 . A A . 42 TRP C 1 1 4 2847 1 1 42 TRP CA C 8.896 -3.568 -1.877 1.00 . A A . 42 TRP CA 1 1 4 2848 1 1 42 TRP CB C 9.850 -2.425 -1.539 1.00 . A A . 42 TRP CB 1 1 4 2849 1 1 42 TRP CD1 C 12.067 -3.371 -0.779 1.00 . A A . 42 TRP CD1 1 1 4 2850 1 1 42 TRP CD2 C 10.796 -2.670 0.925 1.00 . A A . 42 TRP CD2 1 1 4 2851 1 1 42 TRP CE2 C 12.005 -3.168 1.487 1.00 . A A . 42 TRP CE2 1 1 4 2852 1 1 42 TRP CE3 C 9.778 -2.303 1.826 1.00 . A A . 42 TRP CE3 1 1 4 2853 1 1 42 TRP CG C 10.878 -2.793 -0.523 1.00 . A A . 42 TRP CG 1 1 4 2854 1 1 42 TRP CH2 C 11.166 -2.891 3.740 1.00 . A A . 42 TRP CH2 1 1 4 2855 1 1 42 TRP CZ2 C 12.184 -3.311 2.869 1.00 . A A . 42 TRP CZ2 1 1 4 2856 1 1 42 TRP CZ3 C 9.972 -2.368 3.217 1.00 . A A . 42 TRP CZ3 1 1 4 2857 1 1 42 TRP H H 10.132 -4.056 -3.522 1.00 . A A . 42 TRP H 1 1 4 2858 1 1 42 TRP HA H 8.722 -4.083 -0.945 1.00 . A A . 42 TRP HA 1 1 4 2859 1 1 42 TRP HB2 H 10.332 -2.047 -2.439 1.00 . A A . 42 TRP HB2 1 1 4 2860 1 1 42 TRP HB3 H 9.283 -1.609 -1.105 1.00 . A A . 42 TRP HB3 1 1 4 2861 1 1 42 TRP HD1 H 12.394 -3.674 -1.758 1.00 . A A . 42 TRP HD1 1 1 4 2862 1 1 42 TRP HE1 H 13.643 -4.024 0.506 1.00 . A A . 42 TRP HE1 1 1 4 2863 1 1 42 TRP HE3 H 8.816 -2.040 1.427 1.00 . A A . 42 TRP HE3 1 1 4 2864 1 1 42 TRP HH2 H 11.273 -3.008 4.808 1.00 . A A . 42 TRP HH2 1 1 4 2865 1 1 42 TRP HZ2 H 13.050 -3.843 3.232 1.00 . A A . 42 TRP HZ2 1 1 4 2866 1 1 42 TRP HZ3 H 9.184 -2.056 3.887 1.00 . A A . 42 TRP HZ3 1 1 4 2867 1 1 42 TRP N N 9.510 -4.471 -2.831 1.00 . A A . 42 TRP N 1 1 4 2868 1 1 42 TRP NE1 N 12.750 -3.576 0.402 1.00 . A A . 42 TRP NE1 1 1 4 2869 1 1 42 TRP O O 7.527 -2.273 -3.311 1.00 . A A . 42 TRP O 1 1 4 2870 1 1 43 LYS C C 4.579 -2.214 -1.384 1.00 . A A . 43 LYS C 1 1 4 2871 1 1 43 LYS CA C 5.111 -3.231 -2.379 1.00 . A A . 43 LYS CA 1 1 4 2872 1 1 43 LYS CB C 4.135 -4.408 -2.488 1.00 . A A . 43 LYS CB 1 1 4 2873 1 1 43 LYS CD C 5.645 -5.707 -4.114 1.00 . A A . 43 LYS CD 1 1 4 2874 1 1 43 LYS CE C 4.799 -5.625 -5.403 1.00 . A A . 43 LYS CE 1 1 4 2875 1 1 43 LYS CG C 4.854 -5.718 -2.795 1.00 . A A . 43 LYS CG 1 1 4 2876 1 1 43 LYS H H 6.489 -4.341 -1.200 1.00 . A A . 43 LYS H 1 1 4 2877 1 1 43 LYS HA H 5.179 -2.797 -3.372 1.00 . A A . 43 LYS HA 1 1 4 2878 1 1 43 LYS HB2 H 3.634 -4.528 -1.536 1.00 . A A . 43 LYS HB2 1 1 4 2879 1 1 43 LYS HB3 H 3.362 -4.194 -3.221 1.00 . A A . 43 LYS HB3 1 1 4 2880 1 1 43 LYS HD2 H 6.415 -4.938 -4.126 1.00 . A A . 43 LYS HD2 1 1 4 2881 1 1 43 LYS HD3 H 6.145 -6.674 -4.133 1.00 . A A . 43 LYS HD3 1 1 4 2882 1 1 43 LYS HE2 H 5.437 -5.941 -6.229 1.00 . A A . 43 LYS HE2 1 1 4 2883 1 1 43 LYS HE3 H 3.959 -6.318 -5.345 1.00 . A A . 43 LYS HE3 1 1 4 2884 1 1 43 LYS HG2 H 5.450 -5.933 -1.901 1.00 . A A . 43 LYS HG2 1 1 4 2885 1 1 43 LYS HG3 H 4.164 -6.542 -2.874 1.00 . A A . 43 LYS HG3 1 1 4 2886 1 1 43 LYS HZ1 H 4.682 -3.980 -6.651 1.00 . A A . 43 LYS HZ1 1 1 4 2887 1 1 43 LYS HZ2 H 3.272 -4.284 -5.786 1.00 . A A . 43 LYS HZ2 1 1 4 2888 1 1 43 LYS N N 6.432 -3.653 -1.943 1.00 . A A . 43 LYS N 1 1 4 2889 1 1 43 LYS NZ N 4.301 -4.270 -5.739 1.00 . A A . 43 LYS NZ 1 1 4 2890 1 1 43 LYS O O 4.743 -2.380 -0.176 1.00 . A A . 43 LYS O 1 1 4 2891 1 1 44 CYS C C 1.765 -1.183 -0.811 1.00 . A A . 44 CYS C 1 1 4 2892 1 1 44 CYS CA C 3.026 -0.376 -1.078 1.00 . A A . 44 CYS CA 1 1 4 2893 1 1 44 CYS CB C 2.675 0.893 -1.846 1.00 . A A . 44 CYS CB 1 1 4 2894 1 1 44 CYS H H 3.831 -1.101 -2.892 1.00 . A A . 44 CYS H 1 1 4 2895 1 1 44 CYS HA H 3.501 -0.105 -0.138 1.00 . A A . 44 CYS HA 1 1 4 2896 1 1 44 CYS HB2 H 3.543 1.545 -1.830 1.00 . A A . 44 CYS HB2 1 1 4 2897 1 1 44 CYS HB3 H 2.422 0.636 -2.869 1.00 . A A . 44 CYS HB3 1 1 4 2898 1 1 44 CYS N N 3.905 -1.189 -1.891 1.00 . A A . 44 CYS N 1 1 4 2899 1 1 44 CYS O O 1.030 -1.460 -1.752 1.00 . A A . 44 CYS O 1 1 4 2900 1 1 44 CYS SG S 1.269 1.773 -1.149 1.00 . A A . 44 CYS SG 1 1 4 2901 1 1 45 PHE C C -0.662 -1.238 1.396 1.00 . A A . 45 PHE C 1 1 4 2902 1 1 45 PHE CA C 0.302 -2.271 0.814 1.00 . A A . 45 PHE CA 1 1 4 2903 1 1 45 PHE CB C 0.618 -3.345 1.857 1.00 . A A . 45 PHE CB 1 1 4 2904 1 1 45 PHE CD1 C 2.404 -4.808 0.807 1.00 . A A . 45 PHE CD1 1 1 4 2905 1 1 45 PHE CD2 C 0.215 -5.765 1.252 1.00 . A A . 45 PHE CD2 1 1 4 2906 1 1 45 PHE CE1 C 2.873 -6.074 0.413 1.00 . A A . 45 PHE CE1 1 1 4 2907 1 1 45 PHE CE2 C 0.665 -7.018 0.801 1.00 . A A . 45 PHE CE2 1 1 4 2908 1 1 45 PHE CG C 1.090 -4.666 1.284 1.00 . A A . 45 PHE CG 1 1 4 2909 1 1 45 PHE CZ C 1.999 -7.174 0.391 1.00 . A A . 45 PHE CZ 1 1 4 2910 1 1 45 PHE H H 2.144 -1.288 1.183 1.00 . A A . 45 PHE H 1 1 4 2911 1 1 45 PHE HA H -0.146 -2.753 -0.063 1.00 . A A . 45 PHE HA 1 1 4 2912 1 1 45 PHE HB2 H 1.361 -2.948 2.549 1.00 . A A . 45 PHE HB2 1 1 4 2913 1 1 45 PHE HB3 H -0.280 -3.537 2.443 1.00 . A A . 45 PHE HB3 1 1 4 2914 1 1 45 PHE HD1 H 3.070 -3.959 0.808 1.00 . A A . 45 PHE HD1 1 1 4 2915 1 1 45 PHE HD2 H -0.819 -5.643 1.535 1.00 . A A . 45 PHE HD2 1 1 4 2916 1 1 45 PHE HE1 H 3.905 -6.201 0.120 1.00 . A A . 45 PHE HE1 1 1 4 2917 1 1 45 PHE HE2 H -0.015 -7.857 0.769 1.00 . A A . 45 PHE HE2 1 1 4 2918 1 1 45 PHE HZ H 2.344 -8.139 0.049 1.00 . A A . 45 PHE HZ 1 1 4 2919 1 1 45 PHE N N 1.529 -1.589 0.434 1.00 . A A . 45 PHE N 1 1 4 2920 1 1 45 PHE O O -0.223 -0.283 2.037 1.00 . A A . 45 PHE O 1 1 4 2921 1 1 46 CYS C C -3.861 -1.515 2.693 1.00 . A A . 46 CYS C 1 1 4 2922 1 1 46 CYS CA C -3.063 -0.659 1.721 1.00 . A A . 46 CYS CA 1 1 4 2923 1 1 46 CYS CB C -3.979 -0.245 0.568 1.00 . A A . 46 CYS CB 1 1 4 2924 1 1 46 CYS H H -2.233 -2.309 0.723 1.00 . A A . 46 CYS H 1 1 4 2925 1 1 46 CYS HA H -2.720 0.213 2.286 1.00 . A A . 46 CYS HA 1 1 4 2926 1 1 46 CYS HB2 H -4.366 -1.150 0.113 1.00 . A A . 46 CYS HB2 1 1 4 2927 1 1 46 CYS HB3 H -4.814 0.299 0.994 1.00 . A A . 46 CYS HB3 1 1 4 2928 1 1 46 CYS N N -1.964 -1.458 1.205 1.00 . A A . 46 CYS N 1 1 4 2929 1 1 46 CYS O O -3.849 -2.739 2.597 1.00 . A A . 46 CYS O 1 1 4 2930 1 1 46 CYS SG S -3.314 0.768 -0.778 1.00 . A A . 46 CYS SG 1 1 4 2931 1 1 47 TYR C C -6.510 -0.870 5.035 1.00 . A A . 47 TYR C 1 1 4 2932 1 1 47 TYR CA C -5.137 -1.487 4.814 1.00 . A A . 47 TYR CA 1 1 4 2933 1 1 47 TYR CB C -4.261 -1.142 6.013 1.00 . A A . 47 TYR CB 1 1 4 2934 1 1 47 TYR CD1 C -1.832 -1.419 5.331 1.00 . A A . 47 TYR CD1 1 1 4 2935 1 1 47 TYR CD2 C -2.801 -2.943 6.967 1.00 . A A . 47 TYR CD2 1 1 4 2936 1 1 47 TYR CE1 C -0.566 -1.979 5.560 1.00 . A A . 47 TYR CE1 1 1 4 2937 1 1 47 TYR CE2 C -1.531 -3.471 7.227 1.00 . A A . 47 TYR CE2 1 1 4 2938 1 1 47 TYR CG C -2.938 -1.858 6.086 1.00 . A A . 47 TYR CG 1 1 4 2939 1 1 47 TYR CZ C -0.411 -2.953 6.559 1.00 . A A . 47 TYR CZ 1 1 4 2940 1 1 47 TYR H H -4.456 0.148 3.654 1.00 . A A . 47 TYR H 1 1 4 2941 1 1 47 TYR HA H -5.224 -2.567 4.715 1.00 . A A . 47 TYR HA 1 1 4 2942 1 1 47 TYR HB2 H -4.068 -0.076 5.950 1.00 . A A . 47 TYR HB2 1 1 4 2943 1 1 47 TYR HB3 H -4.807 -1.328 6.939 1.00 . A A . 47 TYR HB3 1 1 4 2944 1 1 47 TYR HD1 H -1.941 -0.621 4.616 1.00 . A A . 47 TYR HD1 1 1 4 2945 1 1 47 TYR HD2 H -3.662 -3.339 7.487 1.00 . A A . 47 TYR HD2 1 1 4 2946 1 1 47 TYR HE1 H 0.279 -1.645 4.979 1.00 . A A . 47 TYR HE1 1 1 4 2947 1 1 47 TYR HE2 H -1.424 -4.269 7.949 1.00 . A A . 47 TYR HE2 1 1 4 2948 1 1 47 TYR HH H 0.796 -4.038 7.616 1.00 . A A . 47 TYR HH 1 1 4 2949 1 1 47 TYR N N -4.527 -0.866 3.646 1.00 . A A . 47 TYR N 1 1 4 2950 1 1 47 TYR O O -6.578 0.295 5.429 1.00 . A A . 47 TYR O 1 1 4 2951 1 1 47 TYR OH O 0.829 -3.391 6.905 1.00 . A A . 47 TYR OH 1 1 4 2952 1 1 48 PHE C C -9.663 -1.244 6.035 1.00 . A A . 48 PHE C 1 1 4 2953 1 1 48 PHE CA C -8.899 -0.968 4.747 1.00 . A A . 48 PHE CA 1 1 4 2954 1 1 48 PHE CB C -9.603 -1.655 3.578 1.00 . A A . 48 PHE CB 1 1 4 2955 1 1 48 PHE CD1 C -7.827 -2.000 1.805 1.00 . A A . 48 PHE CD1 1 1 4 2956 1 1 48 PHE CD2 C -9.593 -0.384 1.378 1.00 . A A . 48 PHE CD2 1 1 4 2957 1 1 48 PHE CE1 C -7.240 -1.691 0.571 1.00 . A A . 48 PHE CE1 1 1 4 2958 1 1 48 PHE CE2 C -9.012 -0.083 0.136 1.00 . A A . 48 PHE CE2 1 1 4 2959 1 1 48 PHE CG C -9.000 -1.341 2.221 1.00 . A A . 48 PHE CG 1 1 4 2960 1 1 48 PHE CZ C -7.826 -0.728 -0.264 1.00 . A A . 48 PHE CZ 1 1 4 2961 1 1 48 PHE H H -7.549 -2.579 4.525 1.00 . A A . 48 PHE H 1 1 4 2962 1 1 48 PHE HA H -8.854 0.103 4.570 1.00 . A A . 48 PHE HA 1 1 4 2963 1 1 48 PHE HB2 H -9.537 -2.728 3.739 1.00 . A A . 48 PHE HB2 1 1 4 2964 1 1 48 PHE HB3 H -10.657 -1.427 3.610 1.00 . A A . 48 PHE HB3 1 1 4 2965 1 1 48 PHE HD1 H -7.366 -2.764 2.411 1.00 . A A . 48 PHE HD1 1 1 4 2966 1 1 48 PHE HD2 H -10.479 0.156 1.694 1.00 . A A . 48 PHE HD2 1 1 4 2967 1 1 48 PHE HE1 H -6.342 -2.208 0.272 1.00 . A A . 48 PHE HE1 1 1 4 2968 1 1 48 PHE HE2 H -9.466 0.663 -0.498 1.00 . A A . 48 PHE HE2 1 1 4 2969 1 1 48 PHE HZ H -7.351 -0.478 -1.202 1.00 . A A . 48 PHE HZ 1 1 4 2970 1 1 48 PHE N N -7.598 -1.600 4.782 1.00 . A A . 48 PHE N 1 1 4 2971 1 1 48 PHE O O -9.240 -2.082 6.821 1.00 . A A . 48 PHE O 1 1 4 2972 1 1 49 ASN C C -11.192 -1.151 8.598 1.00 . A A . 49 ASN C 1 1 4 2973 1 1 49 ASN CA C -11.848 -0.866 7.230 1.00 . A A . 49 ASN CA 1 1 4 2974 1 1 49 ASN CB C -12.993 -1.816 6.827 1.00 . A A . 49 ASN CB 1 1 4 2975 1 1 49 ASN CG C -12.644 -3.289 6.958 1.00 . A A . 49 ASN CG 1 1 4 2976 1 1 49 ASN H H -11.141 -0.040 5.411 1.00 . A A . 49 ASN H 1 1 4 2977 1 1 49 ASN HA H -12.327 0.107 7.353 1.00 . A A . 49 ASN HA 1 1 4 2978 1 1 49 ASN HB2 H -13.840 -1.618 7.486 1.00 . A A . 49 ASN HB2 1 1 4 2979 1 1 49 ASN HB3 H -13.306 -1.605 5.805 1.00 . A A . 49 ASN HB3 1 1 4 2980 1 1 49 ASN HD21 H -11.137 -3.106 5.623 1.00 . A A . 49 ASN HD21 1 1 4 2981 1 1 49 ASN HD22 H -11.200 -4.574 6.575 1.00 . A A . 49 ASN HD22 1 1 4 2982 1 1 49 ASN N N -10.870 -0.673 6.150 1.00 . A A . 49 ASN N 1 1 4 2983 1 1 49 ASN ND2 N -11.644 -3.737 6.217 1.00 . A A . 49 ASN ND2 1 1 4 2984 1 1 49 ASN O O -11.615 -2.046 9.333 1.00 . A A . 49 ASN O 1 1 4 2985 1 1 49 ASN OD1 O -13.235 -4.016 7.752 1.00 . A A . 49 ASN OD1 1 1 4 2986 1 1 50 CYS C C -9.385 0.436 11.085 1.00 . A A . 50 CYS C 1 1 4 2987 1 1 50 CYS CA C -9.233 -0.664 10.040 1.00 . A A . 50 CYS CA 1 1 4 2988 1 1 50 CYS CB C -7.794 -0.725 9.545 1.00 . A A . 50 CYS CB 1 1 4 2989 1 1 50 CYS H H -9.838 0.307 8.252 1.00 . A A . 50 CYS H 1 1 4 2990 1 1 50 CYS HA H -9.437 -1.626 10.493 1.00 . A A . 50 CYS HA 1 1 4 2991 1 1 50 CYS HB2 H -7.706 -1.419 8.715 1.00 . A A . 50 CYS HB2 1 1 4 2992 1 1 50 CYS HB3 H -7.546 0.257 9.195 1.00 . A A . 50 CYS HB3 1 1 4 2993 1 1 50 CYS N N -10.128 -0.403 8.915 1.00 . A A . 50 CYS N 1 1 4 2994 1 1 50 CYS O O -9.576 0.122 12.301 1.00 . A A . 50 CYS O 1 1 4 2995 1 1 50 CYS OXT O -9.317 1.656 10.741 1.00 . A A . 50 CYS OXT 1 1 4 2996 1 1 50 CYS SG S -6.522 -1.138 10.754 1.00 . A A . 50 CYS SG 1 1 5 2997 1 1 1 LEU C C -9.541 -4.749 9.832 1.00 . A A . 1 LEU C 1 1 5 2998 1 1 1 LEU CA C -10.368 -4.907 11.099 1.00 . A A . 1 LEU CA 1 1 5 2999 1 1 1 LEU CB C -10.461 -6.366 11.573 1.00 . A A . 1 LEU CB 1 1 5 3000 1 1 1 LEU CD1 C -9.903 -8.037 9.731 1.00 . A A . 1 LEU CD1 1 1 5 3001 1 1 1 LEU CD2 C -11.845 -8.438 11.234 1.00 . A A . 1 LEU CD2 1 1 5 3002 1 1 1 LEU CG C -11.025 -7.351 10.529 1.00 . A A . 1 LEU CG 1 1 5 3003 1 1 1 LEU H1 H -11.592 -3.320 10.613 1.00 . A A . 1 LEU H1 1 1 5 3004 1 1 1 LEU H2 H -12.149 -4.810 10.064 1.00 . A A . 1 LEU H2 1 1 5 3005 1 1 1 LEU H3 H -12.279 -4.410 11.693 1.00 . A A . 1 LEU H3 1 1 5 3006 1 1 1 LEU HA H -9.899 -4.328 11.899 1.00 . A A . 1 LEU HA 1 1 5 3007 1 1 1 LEU HB2 H -9.473 -6.705 11.887 1.00 . A A . 1 LEU HB2 1 1 5 3008 1 1 1 LEU HB3 H -11.104 -6.375 12.455 1.00 . A A . 1 LEU HB3 1 1 5 3009 1 1 1 LEU HD11 H -9.295 -7.311 9.195 1.00 . A A . 1 LEU HD11 1 1 5 3010 1 1 1 LEU HD12 H -9.260 -8.604 10.405 1.00 . A A . 1 LEU HD12 1 1 5 3011 1 1 1 LEU HD13 H -10.340 -8.723 9.006 1.00 . A A . 1 LEU HD13 1 1 5 3012 1 1 1 LEU HD21 H -11.221 -8.974 11.949 1.00 . A A . 1 LEU HD21 1 1 5 3013 1 1 1 LEU HD22 H -12.689 -7.990 11.759 1.00 . A A . 1 LEU HD22 1 1 5 3014 1 1 1 LEU HD23 H -12.231 -9.147 10.499 1.00 . A A . 1 LEU HD23 1 1 5 3015 1 1 1 LEU HG H -11.688 -6.833 9.835 1.00 . A A . 1 LEU HG 1 1 5 3016 1 1 1 LEU N N -11.697 -4.317 10.849 1.00 . A A . 1 LEU N 1 1 5 3017 1 1 1 LEU O O -10.140 -4.796 8.759 1.00 . A A . 1 LEU O 1 1 5 3018 1 1 2 CYS C C -7.365 -5.034 7.684 1.00 . A A . 2 CYS C 1 1 5 3019 1 1 2 CYS CA C -7.511 -3.961 8.765 1.00 . A A . 2 CYS CA 1 1 5 3020 1 1 2 CYS CB C -6.163 -3.305 9.107 1.00 . A A . 2 CYS CB 1 1 5 3021 1 1 2 CYS H H -7.774 -4.379 10.813 1.00 . A A . 2 CYS H 1 1 5 3022 1 1 2 CYS HA H -8.105 -3.151 8.357 1.00 . A A . 2 CYS HA 1 1 5 3023 1 1 2 CYS HB2 H -5.415 -4.095 9.183 1.00 . A A . 2 CYS HB2 1 1 5 3024 1 1 2 CYS HB3 H -5.912 -2.698 8.247 1.00 . A A . 2 CYS HB3 1 1 5 3025 1 1 2 CYS N N -8.240 -4.443 9.923 1.00 . A A . 2 CYS N 1 1 5 3026 1 1 2 CYS O O -6.512 -5.912 7.792 1.00 . A A . 2 CYS O 1 1 5 3027 1 1 2 CYS SG S -5.870 -2.259 10.566 1.00 . A A . 2 CYS SG 1 1 5 3028 1 1 3 ASN C C -6.836 -5.286 4.627 1.00 . A A . 3 ASN C 1 1 5 3029 1 1 3 ASN CA C -7.997 -5.820 5.456 1.00 . A A . 3 ASN CA 1 1 5 3030 1 1 3 ASN CB C -9.273 -5.981 4.611 1.00 . A A . 3 ASN CB 1 1 5 3031 1 1 3 ASN CG C -10.544 -6.290 5.403 1.00 . A A . 3 ASN CG 1 1 5 3032 1 1 3 ASN H H -8.822 -4.177 6.572 1.00 . A A . 3 ASN H 1 1 5 3033 1 1 3 ASN HA H -7.740 -6.823 5.800 1.00 . A A . 3 ASN HA 1 1 5 3034 1 1 3 ASN HB2 H -9.449 -5.058 4.058 1.00 . A A . 3 ASN HB2 1 1 5 3035 1 1 3 ASN HB3 H -9.111 -6.778 3.882 1.00 . A A . 3 ASN HB3 1 1 5 3036 1 1 3 ASN HD21 H -9.555 -7.442 6.761 1.00 . A A . 3 ASN HD21 1 1 5 3037 1 1 3 ASN HD22 H -11.286 -7.291 6.984 1.00 . A A . 3 ASN HD22 1 1 5 3038 1 1 3 ASN N N -8.172 -4.959 6.621 1.00 . A A . 3 ASN N 1 1 5 3039 1 1 3 ASN ND2 N -10.449 -7.090 6.460 1.00 . A A . 3 ASN ND2 1 1 5 3040 1 1 3 ASN O O -6.987 -4.299 3.907 1.00 . A A . 3 ASN O 1 1 5 3041 1 1 3 ASN OD1 O -11.624 -5.828 5.047 1.00 . A A . 3 ASN OD1 1 1 5 3042 1 1 4 GLU C C -4.665 -6.083 2.561 1.00 . A A . 4 GLU C 1 1 5 3043 1 1 4 GLU CA C -4.485 -5.585 3.999 1.00 . A A . 4 GLU CA 1 1 5 3044 1 1 4 GLU CB C -3.280 -6.198 4.723 1.00 . A A . 4 GLU CB 1 1 5 3045 1 1 4 GLU CD C -0.765 -6.473 4.690 1.00 . A A . 4 GLU CD 1 1 5 3046 1 1 4 GLU CG C -2.001 -6.065 3.900 1.00 . A A . 4 GLU CG 1 1 5 3047 1 1 4 GLU H H -5.597 -6.735 5.346 1.00 . A A . 4 GLU H 1 1 5 3048 1 1 4 GLU HA H -4.363 -4.507 4.011 1.00 . A A . 4 GLU HA 1 1 5 3049 1 1 4 GLU HB2 H -3.150 -5.695 5.682 1.00 . A A . 4 GLU HB2 1 1 5 3050 1 1 4 GLU HB3 H -3.461 -7.261 4.905 1.00 . A A . 4 GLU HB3 1 1 5 3051 1 1 4 GLU HG2 H -2.120 -6.736 3.054 1.00 . A A . 4 GLU HG2 1 1 5 3052 1 1 4 GLU HG3 H -1.868 -5.039 3.553 1.00 . A A . 4 GLU HG3 1 1 5 3053 1 1 4 GLU N N -5.671 -5.925 4.752 1.00 . A A . 4 GLU N 1 1 5 3054 1 1 4 GLU O O -5.076 -7.220 2.349 1.00 . A A . 4 GLU O 1 1 5 3055 1 1 4 GLU OE1 O -0.756 -7.743 5.173 1.00 . A A . 4 GLU OE1 1 1 5 3056 1 1 4 GLU OE2 O 0.144 -5.660 4.852 1.00 . A A . 4 GLU OE2 1 1 5 3057 1 1 5 ARG C C -3.018 -5.031 -0.397 1.00 . A A . 5 ARG C 1 1 5 3058 1 1 5 ARG CA C -4.357 -5.520 0.158 1.00 . A A . 5 ARG CA 1 1 5 3059 1 1 5 ARG CB C -5.514 -4.773 -0.529 1.00 . A A . 5 ARG CB 1 1 5 3060 1 1 5 ARG CD C -7.399 -5.001 -2.251 1.00 . A A . 5 ARG CD 1 1 5 3061 1 1 5 ARG CG C -6.357 -5.719 -1.380 1.00 . A A . 5 ARG CG 1 1 5 3062 1 1 5 ARG CZ C -8.904 -3.039 -1.746 1.00 . A A . 5 ARG CZ 1 1 5 3063 1 1 5 ARG H H -3.990 -4.318 1.842 1.00 . A A . 5 ARG H 1 1 5 3064 1 1 5 ARG HA H -4.462 -6.595 0.016 1.00 . A A . 5 ARG HA 1 1 5 3065 1 1 5 ARG HB2 H -6.158 -4.327 0.227 1.00 . A A . 5 ARG HB2 1 1 5 3066 1 1 5 ARG HB3 H -5.107 -3.992 -1.170 1.00 . A A . 5 ARG HB3 1 1 5 3067 1 1 5 ARG HD2 H -6.847 -4.348 -2.918 1.00 . A A . 5 ARG HD2 1 1 5 3068 1 1 5 ARG HD3 H -7.918 -5.745 -2.859 1.00 . A A . 5 ARG HD3 1 1 5 3069 1 1 5 ARG HG2 H -5.685 -6.225 -2.064 1.00 . A A . 5 ARG HG2 1 1 5 3070 1 1 5 ARG HG3 H -6.804 -6.462 -0.721 1.00 . A A . 5 ARG HG3 1 1 5 3071 1 1 5 ARG HH11 H -7.922 -2.767 -3.536 1.00 . A A . 5 ARG HH11 1 1 5 3072 1 1 5 ARG HH12 H -8.748 -1.363 -2.955 1.00 . A A . 5 ARG HH12 1 1 5 3073 1 1 5 ARG HH21 H -10.056 -2.958 -0.058 1.00 . A A . 5 ARG HH21 1 1 5 3074 1 1 5 ARG HH22 H -10.092 -1.537 -1.041 1.00 . A A . 5 ARG HH22 1 1 5 3075 1 1 5 ARG N N -4.354 -5.229 1.584 1.00 . A A . 5 ARG N 1 1 5 3076 1 1 5 ARG NE N -8.400 -4.259 -1.466 1.00 . A A . 5 ARG NE 1 1 5 3077 1 1 5 ARG NH1 N -8.516 -2.349 -2.827 1.00 . A A . 5 ARG NH1 1 1 5 3078 1 1 5 ARG NH2 N -9.803 -2.497 -0.920 1.00 . A A . 5 ARG NH2 1 1 5 3079 1 1 5 ARG O O -2.522 -4.005 0.077 1.00 . A A . 5 ARG O 1 1 5 3080 1 1 6 PRO C C -1.330 -4.112 -2.872 1.00 . A A . 6 PRO C 1 1 5 3081 1 1 6 PRO CA C -1.151 -5.305 -1.931 1.00 . A A . 6 PRO CA 1 1 5 3082 1 1 6 PRO CB C -0.569 -6.544 -2.619 1.00 . A A . 6 PRO CB 1 1 5 3083 1 1 6 PRO CD C -2.817 -7.008 -1.924 1.00 . A A . 6 PRO CD 1 1 5 3084 1 1 6 PRO CG C -1.815 -7.320 -3.036 1.00 . A A . 6 PRO CG 1 1 5 3085 1 1 6 PRO HA H -0.528 -5.001 -1.107 1.00 . A A . 6 PRO HA 1 1 5 3086 1 1 6 PRO HB2 H 0.074 -6.314 -3.468 1.00 . A A . 6 PRO HB2 1 1 5 3087 1 1 6 PRO HB3 H -0.016 -7.134 -1.887 1.00 . A A . 6 PRO HB3 1 1 5 3088 1 1 6 PRO HD2 H -3.809 -6.967 -2.357 1.00 . A A . 6 PRO HD2 1 1 5 3089 1 1 6 PRO HD3 H -2.780 -7.764 -1.139 1.00 . A A . 6 PRO HD3 1 1 5 3090 1 1 6 PRO HG2 H -2.188 -6.915 -3.979 1.00 . A A . 6 PRO HG2 1 1 5 3091 1 1 6 PRO HG3 H -1.627 -8.390 -3.137 1.00 . A A . 6 PRO HG3 1 1 5 3092 1 1 6 PRO N N -2.415 -5.728 -1.370 1.00 . A A . 6 PRO N 1 1 5 3093 1 1 6 PRO O O -2.444 -3.631 -3.068 1.00 . A A . 6 PRO O 1 1 5 3094 1 1 7 SER C C -1.345 -2.432 -5.323 1.00 . A A . 7 SER C 1 1 5 3095 1 1 7 SER CA C -0.136 -2.534 -4.392 1.00 . A A . 7 SER CA 1 1 5 3096 1 1 7 SER CB C 1.162 -2.667 -5.197 1.00 . A A . 7 SER CB 1 1 5 3097 1 1 7 SER H H 0.658 -4.093 -3.230 1.00 . A A . 7 SER H 1 1 5 3098 1 1 7 SER HA H -0.081 -1.601 -3.836 1.00 . A A . 7 SER HA 1 1 5 3099 1 1 7 SER HB2 H 0.965 -2.295 -6.204 1.00 . A A . 7 SER HB2 1 1 5 3100 1 1 7 SER HB3 H 1.935 -2.049 -4.737 1.00 . A A . 7 SER HB3 1 1 5 3101 1 1 7 SER HG H 0.829 -4.533 -5.564 1.00 . A A . 7 SER HG 1 1 5 3102 1 1 7 SER N N -0.220 -3.648 -3.453 1.00 . A A . 7 SER N 1 1 5 3103 1 1 7 SER O O -1.518 -3.276 -6.197 1.00 . A A . 7 SER O 1 1 5 3104 1 1 7 SER OG O 1.593 -4.020 -5.266 1.00 . A A . 7 SER OG 1 1 5 3105 1 1 8 GLN C C -2.822 -0.085 -7.049 1.00 . A A . 8 GLN C 1 1 5 3106 1 1 8 GLN CA C -3.289 -1.050 -5.957 1.00 . A A . 8 GLN CA 1 1 5 3107 1 1 8 GLN CB C -4.376 -0.456 -5.045 1.00 . A A . 8 GLN CB 1 1 5 3108 1 1 8 GLN CD C -5.469 -2.687 -4.525 1.00 . A A . 8 GLN CD 1 1 5 3109 1 1 8 GLN CG C -4.837 -1.424 -3.950 1.00 . A A . 8 GLN CG 1 1 5 3110 1 1 8 GLN H H -1.958 -0.755 -4.366 1.00 . A A . 8 GLN H 1 1 5 3111 1 1 8 GLN HA H -3.677 -1.941 -6.449 1.00 . A A . 8 GLN HA 1 1 5 3112 1 1 8 GLN HB2 H -4.000 0.431 -4.529 1.00 . A A . 8 GLN HB2 1 1 5 3113 1 1 8 GLN HB3 H -5.231 -0.172 -5.654 1.00 . A A . 8 GLN HB3 1 1 5 3114 1 1 8 GLN HE21 H -3.745 -3.736 -4.316 1.00 . A A . 8 GLN HE21 1 1 5 3115 1 1 8 GLN HE22 H -5.082 -4.601 -5.069 1.00 . A A . 8 GLN HE22 1 1 5 3116 1 1 8 GLN HG2 H -4.009 -1.679 -3.292 1.00 . A A . 8 GLN HG2 1 1 5 3117 1 1 8 GLN HG3 H -5.583 -0.914 -3.344 1.00 . A A . 8 GLN HG3 1 1 5 3118 1 1 8 GLN N N -2.148 -1.380 -5.132 1.00 . A A . 8 GLN N 1 1 5 3119 1 1 8 GLN NE2 N -4.709 -3.766 -4.646 1.00 . A A . 8 GLN NE2 1 1 5 3120 1 1 8 GLN O O -2.295 -0.513 -8.075 1.00 . A A . 8 GLN O 1 1 5 3121 1 1 8 GLN OE1 O -6.659 -2.703 -4.823 1.00 . A A . 8 GLN OE1 1 1 5 3122 1 1 9 THR C C -1.047 2.391 -7.790 1.00 . A A . 9 THR C 1 1 5 3123 1 1 9 THR CA C -2.563 2.258 -7.754 1.00 . A A . 9 THR CA 1 1 5 3124 1 1 9 THR CB C -3.192 3.583 -7.317 1.00 . A A . 9 THR CB 1 1 5 3125 1 1 9 THR CG2 C -4.707 3.534 -7.514 1.00 . A A . 9 THR CG2 1 1 5 3126 1 1 9 THR H H -3.328 1.552 -5.934 1.00 . A A . 9 THR H 1 1 5 3127 1 1 9 THR HA H -2.913 2.005 -8.758 1.00 . A A . 9 THR HA 1 1 5 3128 1 1 9 THR HB H -2.774 4.386 -7.927 1.00 . A A . 9 THR HB 1 1 5 3129 1 1 9 THR HG1 H -3.270 4.671 -5.705 1.00 . A A . 9 THR HG1 1 1 5 3130 1 1 9 THR HG21 H -5.140 2.692 -6.978 1.00 . A A . 9 THR HG21 1 1 5 3131 1 1 9 THR HG22 H -5.167 4.444 -7.143 1.00 . A A . 9 THR HG22 1 1 5 3132 1 1 9 THR HG23 H -4.929 3.445 -8.577 1.00 . A A . 9 THR HG23 1 1 5 3133 1 1 9 THR N N -2.954 1.223 -6.812 1.00 . A A . 9 THR N 1 1 5 3134 1 1 9 THR O O -0.478 2.791 -8.801 1.00 . A A . 9 THR O 1 1 5 3135 1 1 9 THR OG1 O -2.900 3.816 -5.950 1.00 . A A . 9 THR OG1 1 1 5 3136 1 1 10 TRP C C 1.491 0.692 -7.406 1.00 . A A . 10 TRP C 1 1 5 3137 1 1 10 TRP CA C 1.064 1.960 -6.658 1.00 . A A . 10 TRP CA 1 1 5 3138 1 1 10 TRP CB C 1.576 1.966 -5.212 1.00 . A A . 10 TRP CB 1 1 5 3139 1 1 10 TRP CD1 C 4.058 1.817 -5.767 1.00 . A A . 10 TRP CD1 1 1 5 3140 1 1 10 TRP CD2 C 3.585 3.449 -4.310 1.00 . A A . 10 TRP CD2 1 1 5 3141 1 1 10 TRP CE2 C 4.947 3.611 -4.687 1.00 . A A . 10 TRP CE2 1 1 5 3142 1 1 10 TRP CE3 C 3.081 4.337 -3.339 1.00 . A A . 10 TRP CE3 1 1 5 3143 1 1 10 TRP CG C 3.016 2.364 -5.097 1.00 . A A . 10 TRP CG 1 1 5 3144 1 1 10 TRP CH2 C 5.180 5.560 -3.289 1.00 . A A . 10 TRP CH2 1 1 5 3145 1 1 10 TRP CZ2 C 5.741 4.653 -4.197 1.00 . A A . 10 TRP CZ2 1 1 5 3146 1 1 10 TRP CZ3 C 3.859 5.402 -2.859 1.00 . A A . 10 TRP CZ3 1 1 5 3147 1 1 10 TRP H H -0.904 1.754 -5.873 1.00 . A A . 10 TRP H 1 1 5 3148 1 1 10 TRP HA H 1.452 2.856 -7.149 1.00 . A A . 10 TRP HA 1 1 5 3149 1 1 10 TRP HB2 H 0.996 2.701 -4.655 1.00 . A A . 10 TRP HB2 1 1 5 3150 1 1 10 TRP HB3 H 1.407 0.994 -4.749 1.00 . A A . 10 TRP HB3 1 1 5 3151 1 1 10 TRP HD1 H 4.005 0.988 -6.458 1.00 . A A . 10 TRP HD1 1 1 5 3152 1 1 10 TRP HE1 H 6.114 2.365 -5.927 1.00 . A A . 10 TRP HE1 1 1 5 3153 1 1 10 TRP HE3 H 2.090 4.184 -2.954 1.00 . A A . 10 TRP HE3 1 1 5 3154 1 1 10 TRP HH2 H 5.735 6.401 -2.936 1.00 . A A . 10 TRP HH2 1 1 5 3155 1 1 10 TRP HZ2 H 6.749 4.786 -4.560 1.00 . A A . 10 TRP HZ2 1 1 5 3156 1 1 10 TRP HZ3 H 3.439 6.131 -2.186 1.00 . A A . 10 TRP HZ3 1 1 5 3157 1 1 10 TRP N N -0.381 2.048 -6.682 1.00 . A A . 10 TRP N 1 1 5 3158 1 1 10 TRP NE1 N 5.195 2.557 -5.536 1.00 . A A . 10 TRP NE1 1 1 5 3159 1 1 10 TRP O O 2.018 -0.246 -6.807 1.00 . A A . 10 TRP O 1 1 5 3160 1 1 11 SER C C 2.827 -0.886 -9.851 1.00 . A A . 11 SER C 1 1 5 3161 1 1 11 SER CA C 1.371 -0.613 -9.462 1.00 . A A . 11 SER CA 1 1 5 3162 1 1 11 SER CB C 0.433 -0.548 -10.674 1.00 . A A . 11 SER CB 1 1 5 3163 1 1 11 SER H H 0.730 1.385 -9.153 1.00 . A A . 11 SER H 1 1 5 3164 1 1 11 SER HA H 1.052 -1.425 -8.810 1.00 . A A . 11 SER HA 1 1 5 3165 1 1 11 SER HB2 H 0.885 0.065 -11.458 1.00 . A A . 11 SER HB2 1 1 5 3166 1 1 11 SER HB3 H 0.269 -1.551 -11.068 1.00 . A A . 11 SER HB3 1 1 5 3167 1 1 11 SER HG H -1.191 -0.395 -9.550 1.00 . A A . 11 SER HG 1 1 5 3168 1 1 11 SER N N 1.240 0.623 -8.711 1.00 . A A . 11 SER N 1 1 5 3169 1 1 11 SER O O 3.159 -0.958 -11.030 1.00 . A A . 11 SER O 1 1 5 3170 1 1 11 SER OG O -0.800 0.054 -10.313 1.00 . A A . 11 SER OG 1 1 5 3171 1 1 12 GLY C C 5.821 -1.545 -7.742 1.00 . A A . 12 GLY C 1 1 5 3172 1 1 12 GLY CA C 5.116 -1.287 -9.071 1.00 . A A . 12 GLY CA 1 1 5 3173 1 1 12 GLY H H 3.356 -0.973 -7.901 1.00 . A A . 12 GLY H 1 1 5 3174 1 1 12 GLY HA2 H 5.248 -2.158 -9.713 1.00 . A A . 12 GLY HA2 1 1 5 3175 1 1 12 GLY HA3 H 5.547 -0.415 -9.564 1.00 . A A . 12 GLY HA3 1 1 5 3176 1 1 12 GLY N N 3.699 -1.049 -8.853 1.00 . A A . 12 GLY N 1 1 5 3177 1 1 12 GLY O O 5.298 -2.277 -6.895 1.00 . A A . 12 GLY O 1 1 5 3178 1 1 13 ASN C C 7.678 0.308 -5.589 1.00 . A A . 13 ASN C 1 1 5 3179 1 1 13 ASN CA C 7.791 -1.017 -6.341 1.00 . A A . 13 ASN CA 1 1 5 3180 1 1 13 ASN CB C 9.256 -1.335 -6.662 1.00 . A A . 13 ASN CB 1 1 5 3181 1 1 13 ASN CG C 10.058 -1.677 -5.406 1.00 . A A . 13 ASN CG 1 1 5 3182 1 1 13 ASN H H 7.341 -0.315 -8.279 1.00 . A A . 13 ASN H 1 1 5 3183 1 1 13 ASN HA H 7.404 -1.830 -5.729 1.00 . A A . 13 ASN HA 1 1 5 3184 1 1 13 ASN HB2 H 9.286 -2.197 -7.330 1.00 . A A . 13 ASN HB2 1 1 5 3185 1 1 13 ASN HB3 H 9.716 -0.488 -7.175 1.00 . A A . 13 ASN HB3 1 1 5 3186 1 1 13 ASN HD21 H 10.335 0.306 -4.866 1.00 . A A . 13 ASN HD21 1 1 5 3187 1 1 13 ASN HD22 H 11.116 -0.895 -3.876 1.00 . A A . 13 ASN HD22 1 1 5 3188 1 1 13 ASN N N 7.004 -0.945 -7.567 1.00 . A A . 13 ASN N 1 1 5 3189 1 1 13 ASN ND2 N 10.540 -0.676 -4.673 1.00 . A A . 13 ASN ND2 1 1 5 3190 1 1 13 ASN O O 7.576 1.365 -6.209 1.00 . A A . 13 ASN O 1 1 5 3191 1 1 13 ASN OD1 O 10.253 -2.850 -5.091 1.00 . A A . 13 ASN OD1 1 1 5 3192 1 1 14 CYS C C 8.785 2.353 -3.611 1.00 . A A . 14 CYS C 1 1 5 3193 1 1 14 CYS CA C 7.662 1.357 -3.332 1.00 . A A . 14 CYS CA 1 1 5 3194 1 1 14 CYS CB C 7.823 0.798 -1.919 1.00 . A A . 14 CYS CB 1 1 5 3195 1 1 14 CYS H H 7.807 -0.676 -3.856 1.00 . A A . 14 CYS H 1 1 5 3196 1 1 14 CYS HA H 6.695 1.852 -3.396 1.00 . A A . 14 CYS HA 1 1 5 3197 1 1 14 CYS HB2 H 7.039 0.063 -1.739 1.00 . A A . 14 CYS HB2 1 1 5 3198 1 1 14 CYS HB3 H 8.794 0.313 -1.876 1.00 . A A . 14 CYS HB3 1 1 5 3199 1 1 14 CYS N N 7.688 0.241 -4.262 1.00 . A A . 14 CYS N 1 1 5 3200 1 1 14 CYS O O 9.812 1.992 -4.189 1.00 . A A . 14 CYS O 1 1 5 3201 1 1 14 CYS SG S 7.785 2.016 -0.583 1.00 . A A . 14 CYS SG 1 1 5 3202 1 1 15 GLY C C 9.675 5.270 -1.774 1.00 . A A . 15 GLY C 1 1 5 3203 1 1 15 GLY CA C 9.545 4.679 -3.173 1.00 . A A . 15 GLY CA 1 1 5 3204 1 1 15 GLY H H 7.706 3.750 -2.679 1.00 . A A . 15 GLY H 1 1 5 3205 1 1 15 GLY HA2 H 10.522 4.326 -3.491 1.00 . A A . 15 GLY HA2 1 1 5 3206 1 1 15 GLY HA3 H 9.208 5.455 -3.864 1.00 . A A . 15 GLY HA3 1 1 5 3207 1 1 15 GLY N N 8.577 3.591 -3.160 1.00 . A A . 15 GLY N 1 1 5 3208 1 1 15 GLY O O 10.777 5.418 -1.252 1.00 . A A . 15 GLY O 1 1 5 3209 1 1 16 ASN C C 7.175 5.589 0.880 1.00 . A A . 16 ASN C 1 1 5 3210 1 1 16 ASN CA C 8.460 6.081 0.217 1.00 . A A . 16 ASN CA 1 1 5 3211 1 1 16 ASN CB C 8.552 7.612 0.251 1.00 . A A . 16 ASN CB 1 1 5 3212 1 1 16 ASN CG C 8.807 8.133 1.661 1.00 . A A . 16 ASN CG 1 1 5 3213 1 1 16 ASN H H 7.670 5.438 -1.645 1.00 . A A . 16 ASN H 1 1 5 3214 1 1 16 ASN HA H 9.311 5.681 0.770 1.00 . A A . 16 ASN HA 1 1 5 3215 1 1 16 ASN HB2 H 9.393 7.922 -0.372 1.00 . A A . 16 ASN HB2 1 1 5 3216 1 1 16 ASN HB3 H 7.641 8.064 -0.137 1.00 . A A . 16 ASN HB3 1 1 5 3217 1 1 16 ASN HD21 H 9.830 9.753 0.963 1.00 . A A . 16 ASN HD21 1 1 5 3218 1 1 16 ASN HD22 H 9.654 9.632 2.700 1.00 . A A . 16 ASN HD22 1 1 5 3219 1 1 16 ASN N N 8.535 5.594 -1.155 1.00 . A A . 16 ASN N 1 1 5 3220 1 1 16 ASN ND2 N 9.475 9.274 1.776 1.00 . A A . 16 ASN ND2 1 1 5 3221 1 1 16 ASN O O 6.083 5.820 0.360 1.00 . A A . 16 ASN O 1 1 5 3222 1 1 16 ASN OD1 O 8.379 7.533 2.645 1.00 . A A . 16 ASN OD1 1 1 5 3223 1 1 17 THR C C 5.256 5.547 3.273 1.00 . A A . 17 THR C 1 1 5 3224 1 1 17 THR CA C 6.177 4.414 2.797 1.00 . A A . 17 THR CA 1 1 5 3225 1 1 17 THR CB C 6.695 3.501 3.921 1.00 . A A . 17 THR CB 1 1 5 3226 1 1 17 THR CG2 C 7.332 4.280 5.078 1.00 . A A . 17 THR CG2 1 1 5 3227 1 1 17 THR H H 8.228 4.827 2.423 1.00 . A A . 17 THR H 1 1 5 3228 1 1 17 THR HA H 5.605 3.784 2.123 1.00 . A A . 17 THR HA 1 1 5 3229 1 1 17 THR HB H 7.455 2.854 3.483 1.00 . A A . 17 THR HB 1 1 5 3230 1 1 17 THR HG1 H 5.969 2.283 5.250 1.00 . A A . 17 THR HG1 1 1 5 3231 1 1 17 THR HG21 H 8.102 4.956 4.704 1.00 . A A . 17 THR HG21 1 1 5 3232 1 1 17 THR HG22 H 6.575 4.861 5.610 1.00 . A A . 17 THR HG22 1 1 5 3233 1 1 17 THR HG23 H 7.795 3.585 5.779 1.00 . A A . 17 THR HG23 1 1 5 3234 1 1 17 THR N N 7.303 4.931 2.034 1.00 . A A . 17 THR N 1 1 5 3235 1 1 17 THR O O 4.040 5.377 3.344 1.00 . A A . 17 THR O 1 1 5 3236 1 1 17 THR OG1 O 5.676 2.653 4.412 1.00 . A A . 17 THR OG1 1 1 5 3237 1 1 18 ALA C C 4.043 8.179 2.663 1.00 . A A . 18 ALA C 1 1 5 3238 1 1 18 ALA CA C 4.993 7.908 3.830 1.00 . A A . 18 ALA CA 1 1 5 3239 1 1 18 ALA CB C 5.892 9.116 4.111 1.00 . A A . 18 ALA CB 1 1 5 3240 1 1 18 ALA H H 6.812 6.860 3.429 1.00 . A A . 18 ALA H 1 1 5 3241 1 1 18 ALA HA H 4.403 7.707 4.727 1.00 . A A . 18 ALA HA 1 1 5 3242 1 1 18 ALA HB1 H 6.567 8.892 4.937 1.00 . A A . 18 ALA HB1 1 1 5 3243 1 1 18 ALA HB2 H 6.477 9.372 3.228 1.00 . A A . 18 ALA HB2 1 1 5 3244 1 1 18 ALA HB3 H 5.273 9.972 4.384 1.00 . A A . 18 ALA HB3 1 1 5 3245 1 1 18 ALA N N 5.809 6.738 3.533 1.00 . A A . 18 ALA N 1 1 5 3246 1 1 18 ALA O O 2.831 8.320 2.849 1.00 . A A . 18 ALA O 1 1 5 3247 1 1 19 HIS C C 2.794 7.172 0.167 1.00 . A A . 19 HIS C 1 1 5 3248 1 1 19 HIS CA C 3.739 8.365 0.267 1.00 . A A . 19 HIS CA 1 1 5 3249 1 1 19 HIS CB C 4.535 8.569 -1.031 1.00 . A A . 19 HIS CB 1 1 5 3250 1 1 19 HIS CD2 C 2.350 9.178 -2.348 1.00 . A A . 19 HIS CD2 1 1 5 3251 1 1 19 HIS CE1 C 3.035 8.626 -4.347 1.00 . A A . 19 HIS CE1 1 1 5 3252 1 1 19 HIS CG C 3.664 8.784 -2.256 1.00 . A A . 19 HIS CG 1 1 5 3253 1 1 19 HIS H H 5.558 7.976 1.327 1.00 . A A . 19 HIS H 1 1 5 3254 1 1 19 HIS HA H 3.140 9.263 0.421 1.00 . A A . 19 HIS HA 1 1 5 3255 1 1 19 HIS HB2 H 5.181 9.432 -0.926 1.00 . A A . 19 HIS HB2 1 1 5 3256 1 1 19 HIS HB3 H 5.165 7.695 -1.183 1.00 . A A . 19 HIS HB3 1 1 5 3257 1 1 19 HIS HD1 H 5.052 8.309 -3.837 1.00 . A A . 19 HIS HD1 1 1 5 3258 1 1 19 HIS HD2 H 1.710 9.434 -1.510 1.00 . A A . 19 HIS HD2 1 1 5 3259 1 1 19 HIS HE1 H 3.041 8.412 -5.406 1.00 . A A . 19 HIS HE1 1 1 5 3260 1 1 19 HIS N N 4.583 8.211 1.438 1.00 . A A . 19 HIS N 1 1 5 3261 1 1 19 HIS ND1 N 4.115 8.558 -3.551 1.00 . A A . 19 HIS ND1 1 1 5 3262 1 1 19 HIS NE2 N 1.939 8.969 -3.654 1.00 . A A . 19 HIS NE2 1 1 5 3263 1 1 19 HIS O O 1.629 7.385 -0.125 1.00 . A A . 19 HIS O 1 1 5 3264 1 1 20 CYS C C 1.128 4.986 1.200 1.00 . A A . 20 CYS C 1 1 5 3265 1 1 20 CYS CA C 2.368 4.772 0.339 1.00 . A A . 20 CYS CA 1 1 5 3266 1 1 20 CYS CB C 3.081 3.508 0.809 1.00 . A A . 20 CYS CB 1 1 5 3267 1 1 20 CYS H H 4.243 5.804 0.580 1.00 . A A . 20 CYS H 1 1 5 3268 1 1 20 CYS HA H 2.041 4.626 -0.688 1.00 . A A . 20 CYS HA 1 1 5 3269 1 1 20 CYS HB2 H 3.920 3.293 0.151 1.00 . A A . 20 CYS HB2 1 1 5 3270 1 1 20 CYS HB3 H 3.447 3.643 1.819 1.00 . A A . 20 CYS HB3 1 1 5 3271 1 1 20 CYS N N 3.253 5.937 0.391 1.00 . A A . 20 CYS N 1 1 5 3272 1 1 20 CYS O O -0.007 4.780 0.762 1.00 . A A . 20 CYS O 1 1 5 3273 1 1 20 CYS SG S 1.983 2.081 0.905 1.00 . A A . 20 CYS SG 1 1 5 3274 1 1 21 ASP C C -0.667 6.738 2.857 1.00 . A A . 21 ASP C 1 1 5 3275 1 1 21 ASP CA C 0.296 5.668 3.377 1.00 . A A . 21 ASP CA 1 1 5 3276 1 1 21 ASP CB C 0.897 6.055 4.727 1.00 . A A . 21 ASP CB 1 1 5 3277 1 1 21 ASP CG C -0.205 6.124 5.766 1.00 . A A . 21 ASP CG 1 1 5 3278 1 1 21 ASP H H 2.321 5.614 2.716 1.00 . A A . 21 ASP H 1 1 5 3279 1 1 21 ASP HA H -0.244 4.724 3.486 1.00 . A A . 21 ASP HA 1 1 5 3280 1 1 21 ASP HB2 H 1.624 5.302 5.036 1.00 . A A . 21 ASP HB2 1 1 5 3281 1 1 21 ASP HB3 H 1.399 7.021 4.664 1.00 . A A . 21 ASP HB3 1 1 5 3282 1 1 21 ASP N N 1.359 5.459 2.422 1.00 . A A . 21 ASP N 1 1 5 3283 1 1 21 ASP O O -1.878 6.531 2.903 1.00 . A A . 21 ASP O 1 1 5 3284 1 1 21 ASP OD1 O -0.567 5.082 6.314 1.00 . A A . 21 ASP OD1 1 1 5 3285 1 1 21 ASP OD2 O -0.744 7.351 5.980 1.00 . A A . 21 ASP OD2 1 1 5 3286 1 1 22 LYS C C -1.819 8.163 0.533 1.00 . A A . 22 LYS C 1 1 5 3287 1 1 22 LYS CA C -1.021 8.823 1.654 1.00 . A A . 22 LYS CA 1 1 5 3288 1 1 22 LYS CB C -0.260 9.982 1.013 1.00 . A A . 22 LYS CB 1 1 5 3289 1 1 22 LYS CD C 0.889 12.188 1.425 1.00 . A A . 22 LYS CD 1 1 5 3290 1 1 22 LYS CE C -0.136 13.317 1.650 1.00 . A A . 22 LYS CE 1 1 5 3291 1 1 22 LYS CG C 0.486 10.830 2.028 1.00 . A A . 22 LYS CG 1 1 5 3292 1 1 22 LYS H H 0.859 7.972 2.304 1.00 . A A . 22 LYS H 1 1 5 3293 1 1 22 LYS HA H -1.672 9.257 2.406 1.00 . A A . 22 LYS HA 1 1 5 3294 1 1 22 LYS HB2 H 0.453 9.603 0.287 1.00 . A A . 22 LYS HB2 1 1 5 3295 1 1 22 LYS HB3 H -0.981 10.590 0.475 1.00 . A A . 22 LYS HB3 1 1 5 3296 1 1 22 LYS HD2 H 1.821 12.501 1.900 1.00 . A A . 22 LYS HD2 1 1 5 3297 1 1 22 LYS HD3 H 1.094 12.070 0.359 1.00 . A A . 22 LYS HD3 1 1 5 3298 1 1 22 LYS HE2 H -0.118 13.596 2.707 1.00 . A A . 22 LYS HE2 1 1 5 3299 1 1 22 LYS HE3 H 0.171 14.189 1.067 1.00 . A A . 22 LYS HE3 1 1 5 3300 1 1 22 LYS HG2 H -0.073 10.951 2.956 1.00 . A A . 22 LYS HG2 1 1 5 3301 1 1 22 LYS HG3 H 1.366 10.230 2.231 1.00 . A A . 22 LYS HG3 1 1 5 3302 1 1 22 LYS HZ1 H -1.551 11.992 0.935 1.00 . A A . 22 LYS HZ1 1 1 5 3303 1 1 22 LYS HZ2 H -2.126 13.030 2.126 1.00 . A A . 22 LYS HZ2 1 1 5 3304 1 1 22 LYS N N -0.149 7.850 2.313 1.00 . A A . 22 LYS N 1 1 5 3305 1 1 22 LYS NZ N -1.526 12.958 1.292 1.00 . A A . 22 LYS NZ 1 1 5 3306 1 1 22 LYS O O -3.027 8.335 0.429 1.00 . A A . 22 LYS O 1 1 5 3307 1 1 23 GLN C C -2.759 6.206 -1.520 1.00 . A A . 23 GLN C 1 1 5 3308 1 1 23 GLN CA C -1.513 7.079 -1.689 1.00 . A A . 23 GLN CA 1 1 5 3309 1 1 23 GLN CB C -0.311 6.348 -2.323 1.00 . A A . 23 GLN CB 1 1 5 3310 1 1 23 GLN CD C -0.519 6.480 -4.858 1.00 . A A . 23 GLN CD 1 1 5 3311 1 1 23 GLN CG C -0.537 5.578 -3.626 1.00 . A A . 23 GLN CG 1 1 5 3312 1 1 23 GLN H H -0.136 7.333 -0.112 1.00 . A A . 23 GLN H 1 1 5 3313 1 1 23 GLN HA H -1.757 7.957 -2.286 1.00 . A A . 23 GLN HA 1 1 5 3314 1 1 23 GLN HB2 H 0.521 7.037 -2.442 1.00 . A A . 23 GLN HB2 1 1 5 3315 1 1 23 GLN HB3 H 0.008 5.588 -1.612 1.00 . A A . 23 GLN HB3 1 1 5 3316 1 1 23 GLN HE21 H -0.991 4.909 -6.079 1.00 . A A . 23 GLN HE21 1 1 5 3317 1 1 23 GLN HE22 H -0.783 6.467 -6.863 1.00 . A A . 23 GLN HE22 1 1 5 3318 1 1 23 GLN HG2 H 0.305 4.905 -3.763 1.00 . A A . 23 GLN HG2 1 1 5 3319 1 1 23 GLN HG3 H -1.443 4.984 -3.581 1.00 . A A . 23 GLN HG3 1 1 5 3320 1 1 23 GLN N N -1.102 7.484 -0.357 1.00 . A A . 23 GLN N 1 1 5 3321 1 1 23 GLN NE2 N -0.798 5.905 -6.024 1.00 . A A . 23 GLN NE2 1 1 5 3322 1 1 23 GLN O O -3.792 6.451 -2.141 1.00 . A A . 23 GLN O 1 1 5 3323 1 1 23 GLN OE1 O -0.205 7.668 -4.763 1.00 . A A . 23 GLN OE1 1 1 5 3324 1 1 24 CYS C C -4.989 5.066 0.309 1.00 . A A . 24 CYS C 1 1 5 3325 1 1 24 CYS CA C -3.766 4.336 -0.258 1.00 . A A . 24 CYS CA 1 1 5 3326 1 1 24 CYS CB C -3.255 3.336 0.782 1.00 . A A . 24 CYS CB 1 1 5 3327 1 1 24 CYS H H -1.785 5.109 -0.130 1.00 . A A . 24 CYS H 1 1 5 3328 1 1 24 CYS HA H -4.097 3.810 -1.161 1.00 . A A . 24 CYS HA 1 1 5 3329 1 1 24 CYS HB2 H -2.859 3.882 1.638 1.00 . A A . 24 CYS HB2 1 1 5 3330 1 1 24 CYS HB3 H -4.086 2.726 1.124 1.00 . A A . 24 CYS HB3 1 1 5 3331 1 1 24 CYS N N -2.674 5.236 -0.609 1.00 . A A . 24 CYS N 1 1 5 3332 1 1 24 CYS O O -6.113 4.590 0.146 1.00 . A A . 24 CYS O 1 1 5 3333 1 1 24 CYS SG S -1.985 2.188 0.214 1.00 . A A . 24 CYS SG 1 1 5 3334 1 1 25 GLN C C -6.460 7.949 0.512 1.00 . A A . 25 GLN C 1 1 5 3335 1 1 25 GLN CA C -5.894 6.978 1.559 1.00 . A A . 25 GLN CA 1 1 5 3336 1 1 25 GLN CB C -5.406 7.743 2.796 1.00 . A A . 25 GLN CB 1 1 5 3337 1 1 25 GLN CD C -4.466 7.476 5.153 1.00 . A A . 25 GLN CD 1 1 5 3338 1 1 25 GLN CG C -5.038 6.770 3.927 1.00 . A A . 25 GLN CG 1 1 5 3339 1 1 25 GLN H H -3.855 6.557 1.101 1.00 . A A . 25 GLN H 1 1 5 3340 1 1 25 GLN HA H -6.686 6.307 1.901 1.00 . A A . 25 GLN HA 1 1 5 3341 1 1 25 GLN HB2 H -4.540 8.354 2.546 1.00 . A A . 25 GLN HB2 1 1 5 3342 1 1 25 GLN HB3 H -6.210 8.396 3.137 1.00 . A A . 25 GLN HB3 1 1 5 3343 1 1 25 GLN HE21 H -6.070 8.719 5.281 1.00 . A A . 25 GLN HE21 1 1 5 3344 1 1 25 GLN HE22 H -4.827 8.937 6.498 1.00 . A A . 25 GLN HE22 1 1 5 3345 1 1 25 GLN HG2 H -5.925 6.216 4.231 1.00 . A A . 25 GLN HG2 1 1 5 3346 1 1 25 GLN HG3 H -4.299 6.064 3.556 1.00 . A A . 25 GLN HG3 1 1 5 3347 1 1 25 GLN N N -4.796 6.192 0.998 1.00 . A A . 25 GLN N 1 1 5 3348 1 1 25 GLN NE2 N -5.170 8.479 5.668 1.00 . A A . 25 GLN NE2 1 1 5 3349 1 1 25 GLN O O -7.635 8.300 0.543 1.00 . A A . 25 GLN O 1 1 5 3350 1 1 25 GLN OE1 O -3.395 7.128 5.644 1.00 . A A . 25 GLN OE1 1 1 5 3351 1 1 26 ASP C C -6.489 8.996 -2.581 1.00 . A A . 26 ASP C 1 1 5 3352 1 1 26 ASP CA C -5.859 9.541 -1.302 1.00 . A A . 26 ASP CA 1 1 5 3353 1 1 26 ASP CB C -4.565 10.310 -1.620 1.00 . A A . 26 ASP CB 1 1 5 3354 1 1 26 ASP CG C -3.959 11.101 -0.455 1.00 . A A . 26 ASP CG 1 1 5 3355 1 1 26 ASP H H -4.643 8.097 -0.322 1.00 . A A . 26 ASP H 1 1 5 3356 1 1 26 ASP HA H -6.562 10.246 -0.869 1.00 . A A . 26 ASP HA 1 1 5 3357 1 1 26 ASP HB2 H -3.815 9.616 -1.984 1.00 . A A . 26 ASP HB2 1 1 5 3358 1 1 26 ASP HB3 H -4.782 11.014 -2.425 1.00 . A A . 26 ASP HB3 1 1 5 3359 1 1 26 ASP N N -5.588 8.460 -0.364 1.00 . A A . 26 ASP N 1 1 5 3360 1 1 26 ASP O O -7.570 9.429 -2.977 1.00 . A A . 26 ASP O 1 1 5 3361 1 1 26 ASP OD1 O -4.568 11.033 0.760 1.00 . A A . 26 ASP OD1 1 1 5 3362 1 1 26 ASP OD2 O -2.934 11.761 -0.648 1.00 . A A . 26 ASP OD2 1 1 5 3363 1 1 27 TRP C C -7.294 6.490 -4.271 1.00 . A A . 27 TRP C 1 1 5 3364 1 1 27 TRP CA C -6.195 7.513 -4.528 1.00 . A A . 27 TRP CA 1 1 5 3365 1 1 27 TRP CB C -4.998 6.830 -5.194 1.00 . A A . 27 TRP CB 1 1 5 3366 1 1 27 TRP CD1 C -3.300 8.704 -5.111 1.00 . A A . 27 TRP CD1 1 1 5 3367 1 1 27 TRP CD2 C -3.401 7.726 -7.112 1.00 . A A . 27 TRP CD2 1 1 5 3368 1 1 27 TRP CE2 C -2.374 8.710 -7.185 1.00 . A A . 27 TRP CE2 1 1 5 3369 1 1 27 TRP CE3 C -3.649 6.962 -8.267 1.00 . A A . 27 TRP CE3 1 1 5 3370 1 1 27 TRP CG C -3.954 7.728 -5.770 1.00 . A A . 27 TRP CG 1 1 5 3371 1 1 27 TRP CH2 C -1.850 8.086 -9.465 1.00 . A A . 27 TRP CH2 1 1 5 3372 1 1 27 TRP CZ2 C -1.608 8.901 -8.345 1.00 . A A . 27 TRP CZ2 1 1 5 3373 1 1 27 TRP CZ3 C -2.881 7.130 -9.430 1.00 . A A . 27 TRP CZ3 1 1 5 3374 1 1 27 TRP H H -4.942 7.717 -2.818 1.00 . A A . 27 TRP H 1 1 5 3375 1 1 27 TRP HA H -6.576 8.298 -5.183 1.00 . A A . 27 TRP HA 1 1 5 3376 1 1 27 TRP HB2 H -4.499 6.127 -4.534 1.00 . A A . 27 TRP HB2 1 1 5 3377 1 1 27 TRP HB3 H -5.405 6.236 -6.001 1.00 . A A . 27 TRP HB3 1 1 5 3378 1 1 27 TRP HD1 H -3.454 8.947 -4.079 1.00 . A A . 27 TRP HD1 1 1 5 3379 1 1 27 TRP HE1 H -1.761 10.051 -5.659 1.00 . A A . 27 TRP HE1 1 1 5 3380 1 1 27 TRP HE3 H -4.444 6.234 -8.233 1.00 . A A . 27 TRP HE3 1 1 5 3381 1 1 27 TRP HH2 H -1.256 8.186 -10.358 1.00 . A A . 27 TRP HH2 1 1 5 3382 1 1 27 TRP HZ2 H -0.832 9.650 -8.375 1.00 . A A . 27 TRP HZ2 1 1 5 3383 1 1 27 TRP HZ3 H -3.078 6.520 -10.301 1.00 . A A . 27 TRP HZ3 1 1 5 3384 1 1 27 TRP N N -5.791 8.071 -3.243 1.00 . A A . 27 TRP N 1 1 5 3385 1 1 27 TRP NE1 N -2.378 9.304 -5.938 1.00 . A A . 27 TRP NE1 1 1 5 3386 1 1 27 TRP O O -8.447 6.673 -4.661 1.00 . A A . 27 TRP O 1 1 5 3387 1 1 28 GLU C C -8.473 5.312 -1.695 1.00 . A A . 28 GLU C 1 1 5 3388 1 1 28 GLU CA C -7.862 4.545 -2.880 1.00 . A A . 28 GLU CA 1 1 5 3389 1 1 28 GLU CB C -7.080 3.264 -2.501 1.00 . A A . 28 GLU CB 1 1 5 3390 1 1 28 GLU CD C -8.270 1.490 -3.917 1.00 . A A . 28 GLU CD 1 1 5 3391 1 1 28 GLU CG C -6.973 2.260 -3.660 1.00 . A A . 28 GLU CG 1 1 5 3392 1 1 28 GLU H H -5.974 5.456 -3.177 1.00 . A A . 28 GLU H 1 1 5 3393 1 1 28 GLU HA H -8.677 4.301 -3.562 1.00 . A A . 28 GLU HA 1 1 5 3394 1 1 28 GLU HB2 H -6.067 3.551 -2.229 1.00 . A A . 28 GLU HB2 1 1 5 3395 1 1 28 GLU HB3 H -7.485 2.748 -1.637 1.00 . A A . 28 GLU HB3 1 1 5 3396 1 1 28 GLU HG2 H -6.671 2.779 -4.571 1.00 . A A . 28 GLU HG2 1 1 5 3397 1 1 28 GLU HG3 H -6.197 1.535 -3.411 1.00 . A A . 28 GLU HG3 1 1 5 3398 1 1 28 GLU N N -6.926 5.452 -3.518 1.00 . A A . 28 GLU N 1 1 5 3399 1 1 28 GLU O O -8.470 6.542 -1.690 1.00 . A A . 28 GLU O 1 1 5 3400 1 1 28 GLU OE1 O -9.154 2.075 -4.769 1.00 . A A . 28 GLU OE1 1 1 5 3401 1 1 28 GLU OE2 O -8.462 0.404 -3.367 1.00 . A A . 28 GLU OE2 1 1 5 3402 1 1 29 LYS C C -9.530 4.016 1.525 1.00 . A A . 29 LYS C 1 1 5 3403 1 1 29 LYS CA C -9.594 5.153 0.511 1.00 . A A . 29 LYS CA 1 1 5 3404 1 1 29 LYS CB C -11.040 5.628 0.265 1.00 . A A . 29 LYS CB 1 1 5 3405 1 1 29 LYS CD C -11.603 6.894 -1.886 1.00 . A A . 29 LYS CD 1 1 5 3406 1 1 29 LYS CE C -11.328 8.200 -2.647 1.00 . A A . 29 LYS CE 1 1 5 3407 1 1 29 LYS CG C -11.155 7.001 -0.418 1.00 . A A . 29 LYS CG 1 1 5 3408 1 1 29 LYS H H -8.871 3.627 -0.661 1.00 . A A . 29 LYS H 1 1 5 3409 1 1 29 LYS HA H -8.969 5.952 0.879 1.00 . A A . 29 LYS HA 1 1 5 3410 1 1 29 LYS HB2 H -11.605 4.870 -0.280 1.00 . A A . 29 LYS HB2 1 1 5 3411 1 1 29 LYS HB3 H -11.500 5.738 1.246 1.00 . A A . 29 LYS HB3 1 1 5 3412 1 1 29 LYS HD2 H -11.103 6.060 -2.382 1.00 . A A . 29 LYS HD2 1 1 5 3413 1 1 29 LYS HD3 H -12.677 6.692 -1.895 1.00 . A A . 29 LYS HD3 1 1 5 3414 1 1 29 LYS HE2 H -11.936 8.226 -3.555 1.00 . A A . 29 LYS HE2 1 1 5 3415 1 1 29 LYS HE3 H -11.602 9.051 -2.021 1.00 . A A . 29 LYS HE3 1 1 5 3416 1 1 29 LYS HG2 H -11.912 7.580 0.115 1.00 . A A . 29 LYS HG2 1 1 5 3417 1 1 29 LYS HG3 H -10.212 7.538 -0.306 1.00 . A A . 29 LYS HG3 1 1 5 3418 1 1 29 LYS HZ1 H -9.581 7.385 -3.381 1.00 . A A . 29 LYS HZ1 1 1 5 3419 1 1 29 LYS HZ2 H -9.804 9.003 -3.780 1.00 . A A . 29 LYS HZ2 1 1 5 3420 1 1 29 LYS N N -8.964 4.619 -0.675 1.00 . A A . 29 LYS N 1 1 5 3421 1 1 29 LYS NZ N -9.908 8.299 -3.036 1.00 . A A . 29 LYS NZ 1 1 5 3422 1 1 29 LYS O O -10.524 3.536 2.063 1.00 . A A . 29 LYS O 1 1 5 3423 1 1 30 ALA C C -7.969 3.359 4.118 1.00 . A A . 30 ALA C 1 1 5 3424 1 1 30 ALA CA C -7.926 2.642 2.770 1.00 . A A . 30 ALA CA 1 1 5 3425 1 1 30 ALA CB C -6.519 2.141 2.451 1.00 . A A . 30 ALA CB 1 1 5 3426 1 1 30 ALA H H -7.536 4.029 1.229 1.00 . A A . 30 ALA H 1 1 5 3427 1 1 30 ALA HA H -8.626 1.810 2.785 1.00 . A A . 30 ALA HA 1 1 5 3428 1 1 30 ALA HB1 H -6.471 1.810 1.415 1.00 . A A . 30 ALA HB1 1 1 5 3429 1 1 30 ALA HB2 H -5.807 2.951 2.607 1.00 . A A . 30 ALA HB2 1 1 5 3430 1 1 30 ALA HB3 H -6.256 1.307 3.089 1.00 . A A . 30 ALA HB3 1 1 5 3431 1 1 30 ALA N N -8.292 3.573 1.732 1.00 . A A . 30 ALA N 1 1 5 3432 1 1 30 ALA O O -7.935 4.587 4.167 1.00 . A A . 30 ALA O 1 1 5 3433 1 1 31 SER C C -6.300 3.761 6.497 1.00 . A A . 31 SER C 1 1 5 3434 1 1 31 SER CA C -7.690 3.127 6.521 1.00 . A A . 31 SER CA 1 1 5 3435 1 1 31 SER CB C -7.787 1.976 7.521 1.00 . A A . 31 SER CB 1 1 5 3436 1 1 31 SER H H -7.927 1.597 5.179 1.00 . A A . 31 SER H 1 1 5 3437 1 1 31 SER HA H -8.428 3.877 6.796 1.00 . A A . 31 SER HA 1 1 5 3438 1 1 31 SER HB2 H -6.980 1.272 7.361 1.00 . A A . 31 SER HB2 1 1 5 3439 1 1 31 SER HB3 H -7.645 2.381 8.509 1.00 . A A . 31 SER HB3 1 1 5 3440 1 1 31 SER HG H -9.724 1.996 7.331 1.00 . A A . 31 SER HG 1 1 5 3441 1 1 31 SER N N -7.987 2.604 5.217 1.00 . A A . 31 SER N 1 1 5 3442 1 1 31 SER O O -6.119 4.862 7.009 1.00 . A A . 31 SER O 1 1 5 3443 1 1 31 SER OG O -9.041 1.320 7.396 1.00 . A A . 31 SER OG 1 1 5 3444 1 1 32 HIS C C -3.174 2.804 4.699 1.00 . A A . 32 HIS C 1 1 5 3445 1 1 32 HIS CA C -3.985 3.640 5.705 1.00 . A A . 32 HIS CA 1 1 5 3446 1 1 32 HIS CB C -3.295 3.781 7.076 1.00 . A A . 32 HIS CB 1 1 5 3447 1 1 32 HIS CD2 C -2.892 1.362 7.736 1.00 . A A . 32 HIS CD2 1 1 5 3448 1 1 32 HIS CE1 C -0.725 1.328 7.782 1.00 . A A . 32 HIS CE1 1 1 5 3449 1 1 32 HIS CG C -2.444 2.609 7.453 1.00 . A A . 32 HIS CG 1 1 5 3450 1 1 32 HIS H H -5.525 2.190 5.440 1.00 . A A . 32 HIS H 1 1 5 3451 1 1 32 HIS HA H -4.116 4.628 5.269 1.00 . A A . 32 HIS HA 1 1 5 3452 1 1 32 HIS HB2 H -2.692 4.663 7.084 1.00 . A A . 32 HIS HB2 1 1 5 3453 1 1 32 HIS HB3 H -4.020 3.925 7.874 1.00 . A A . 32 HIS HB3 1 1 5 3454 1 1 32 HIS HD1 H -0.441 3.355 7.188 1.00 . A A . 32 HIS HD1 1 1 5 3455 1 1 32 HIS HD2 H -3.925 1.117 7.623 1.00 . A A . 32 HIS HD2 1 1 5 3456 1 1 32 HIS HE1 H 0.282 0.955 7.845 1.00 . A A . 32 HIS HE1 1 1 5 3457 1 1 32 HIS N N -5.318 3.079 5.887 1.00 . A A . 32 HIS N 1 1 5 3458 1 1 32 HIS ND1 N -1.061 2.599 7.491 1.00 . A A . 32 HIS ND1 1 1 5 3459 1 1 32 HIS NE2 N -1.803 0.546 7.957 1.00 . A A . 32 HIS NE2 1 1 5 3460 1 1 32 HIS O O -3.724 1.889 4.084 1.00 . A A . 32 HIS O 1 1 5 3461 1 1 33 GLY C C 0.427 2.123 4.455 1.00 . A A . 33 GLY C 1 1 5 3462 1 1 33 GLY CA C -0.929 2.298 3.773 1.00 . A A . 33 GLY CA 1 1 5 3463 1 1 33 GLY H H -1.465 3.833 5.129 1.00 . A A . 33 GLY H 1 1 5 3464 1 1 33 GLY HA2 H -1.339 1.323 3.620 1.00 . A A . 33 GLY HA2 1 1 5 3465 1 1 33 GLY HA3 H -0.783 2.730 2.792 1.00 . A A . 33 GLY HA3 1 1 5 3466 1 1 33 GLY N N -1.868 3.085 4.572 1.00 . A A . 33 GLY N 1 1 5 3467 1 1 33 GLY O O 0.713 2.808 5.436 1.00 . A A . 33 GLY O 1 1 5 3468 1 1 34 ALA C C 3.339 0.018 3.470 1.00 . A A . 34 ALA C 1 1 5 3469 1 1 34 ALA CA C 2.604 0.948 4.444 1.00 . A A . 34 ALA CA 1 1 5 3470 1 1 34 ALA CB C 2.548 0.337 5.849 1.00 . A A . 34 ALA CB 1 1 5 3471 1 1 34 ALA H H 0.927 0.626 3.183 1.00 . A A . 34 ALA H 1 1 5 3472 1 1 34 ALA HA H 3.135 1.901 4.494 1.00 . A A . 34 ALA HA 1 1 5 3473 1 1 34 ALA HB1 H 1.873 -0.518 5.862 1.00 . A A . 34 ALA HB1 1 1 5 3474 1 1 34 ALA HB2 H 3.540 0.013 6.157 1.00 . A A . 34 ALA HB2 1 1 5 3475 1 1 34 ALA HB3 H 2.189 1.077 6.563 1.00 . A A . 34 ALA HB3 1 1 5 3476 1 1 34 ALA N N 1.250 1.194 3.962 1.00 . A A . 34 ALA N 1 1 5 3477 1 1 34 ALA O O 2.760 -0.964 3.002 1.00 . A A . 34 ALA O 1 1 5 3478 1 1 35 CYS C C 5.919 -1.770 2.924 1.00 . A A . 35 CYS C 1 1 5 3479 1 1 35 CYS CA C 5.390 -0.511 2.235 1.00 . A A . 35 CYS CA 1 1 5 3480 1 1 35 CYS CB C 6.540 0.313 1.662 1.00 . A A . 35 CYS CB 1 1 5 3481 1 1 35 CYS H H 5.066 1.128 3.520 1.00 . A A . 35 CYS H 1 1 5 3482 1 1 35 CYS HA H 4.754 -0.787 1.406 1.00 . A A . 35 CYS HA 1 1 5 3483 1 1 35 CYS HB2 H 7.105 0.789 2.463 1.00 . A A . 35 CYS HB2 1 1 5 3484 1 1 35 CYS HB3 H 7.204 -0.372 1.159 1.00 . A A . 35 CYS HB3 1 1 5 3485 1 1 35 CYS N N 4.606 0.303 3.149 1.00 . A A . 35 CYS N 1 1 5 3486 1 1 35 CYS O O 6.241 -1.729 4.113 1.00 . A A . 35 CYS O 1 1 5 3487 1 1 35 CYS SG S 6.038 1.545 0.439 1.00 . A A . 35 CYS SG 1 1 5 3488 1 1 36 HIS C C 7.375 -4.841 1.565 1.00 . A A . 36 HIS C 1 1 5 3489 1 1 36 HIS CA C 6.642 -4.129 2.696 1.00 . A A . 36 HIS CA 1 1 5 3490 1 1 36 HIS CB C 5.634 -5.143 3.227 1.00 . A A . 36 HIS CB 1 1 5 3491 1 1 36 HIS CD2 C 3.179 -4.960 3.879 1.00 . A A . 36 HIS CD2 1 1 5 3492 1 1 36 HIS CE1 C 3.325 -3.426 5.423 1.00 . A A . 36 HIS CE1 1 1 5 3493 1 1 36 HIS CG C 4.481 -4.593 4.000 1.00 . A A . 36 HIS CG 1 1 5 3494 1 1 36 HIS H H 5.706 -2.886 1.235 1.00 . A A . 36 HIS H 1 1 5 3495 1 1 36 HIS HA H 7.319 -3.903 3.511 1.00 . A A . 36 HIS HA 1 1 5 3496 1 1 36 HIS HB2 H 5.218 -5.689 2.380 1.00 . A A . 36 HIS HB2 1 1 5 3497 1 1 36 HIS HB3 H 6.161 -5.866 3.853 1.00 . A A . 36 HIS HB3 1 1 5 3498 1 1 36 HIS HD1 H 5.390 -3.028 5.161 1.00 . A A . 36 HIS HD1 1 1 5 3499 1 1 36 HIS HD2 H 2.842 -5.671 3.136 1.00 . A A . 36 HIS HD2 1 1 5 3500 1 1 36 HIS HE1 H 3.056 -2.710 6.185 1.00 . A A . 36 HIS HE1 1 1 5 3501 1 1 36 HIS N N 6.010 -2.899 2.207 1.00 . A A . 36 HIS N 1 1 5 3502 1 1 36 HIS ND1 N 4.569 -3.598 4.956 1.00 . A A . 36 HIS ND1 1 1 5 3503 1 1 36 HIS NE2 N 2.457 -4.260 4.821 1.00 . A A . 36 HIS NE2 1 1 5 3504 1 1 36 HIS O O 6.866 -4.874 0.446 1.00 . A A . 36 HIS O 1 1 5 3505 1 1 37 LYS C C 8.538 -7.757 0.935 1.00 . A A . 37 LYS C 1 1 5 3506 1 1 37 LYS CA C 9.179 -6.374 0.941 1.00 . A A . 37 LYS CA 1 1 5 3507 1 1 37 LYS CB C 10.671 -6.446 1.271 1.00 . A A . 37 LYS CB 1 1 5 3508 1 1 37 LYS CD C 12.875 -7.587 0.547 1.00 . A A . 37 LYS CD 1 1 5 3509 1 1 37 LYS CE C 14.000 -6.588 0.231 1.00 . A A . 37 LYS CE 1 1 5 3510 1 1 37 LYS CG C 11.483 -7.071 0.130 1.00 . A A . 37 LYS CG 1 1 5 3511 1 1 37 LYS H H 8.827 -5.472 2.831 1.00 . A A . 37 LYS H 1 1 5 3512 1 1 37 LYS HA H 9.120 -5.949 -0.050 1.00 . A A . 37 LYS HA 1 1 5 3513 1 1 37 LYS HB2 H 11.016 -5.443 1.396 1.00 . A A . 37 LYS HB2 1 1 5 3514 1 1 37 LYS HB3 H 10.812 -6.960 2.213 1.00 . A A . 37 LYS HB3 1 1 5 3515 1 1 37 LYS HD2 H 12.879 -7.831 1.612 1.00 . A A . 37 LYS HD2 1 1 5 3516 1 1 37 LYS HD3 H 13.060 -8.516 0.009 1.00 . A A . 37 LYS HD3 1 1 5 3517 1 1 37 LYS HE2 H 13.759 -6.017 -0.667 1.00 . A A . 37 LYS HE2 1 1 5 3518 1 1 37 LYS HE3 H 14.092 -5.905 1.076 1.00 . A A . 37 LYS HE3 1 1 5 3519 1 1 37 LYS HG2 H 10.919 -7.916 -0.232 1.00 . A A . 37 LYS HG2 1 1 5 3520 1 1 37 LYS HG3 H 11.546 -6.364 -0.701 1.00 . A A . 37 LYS HG3 1 1 5 3521 1 1 37 LYS HZ1 H 15.148 -8.266 -0.143 1.00 . A A . 37 LYS HZ1 1 1 5 3522 1 1 37 LYS HZ2 H 15.729 -6.863 -0.867 1.00 . A A . 37 LYS HZ2 1 1 5 3523 1 1 37 LYS N N 8.486 -5.509 1.883 1.00 . A A . 37 LYS N 1 1 5 3524 1 1 37 LYS NZ N 15.300 -7.254 -0.017 1.00 . A A . 37 LYS NZ 1 1 5 3525 1 1 37 LYS O O 8.335 -8.365 1.988 1.00 . A A . 37 LYS O 1 1 5 3526 1 1 38 ARG C C 8.440 -10.037 -1.872 1.00 . A A . 38 ARG C 1 1 5 3527 1 1 38 ARG CA C 7.847 -9.631 -0.524 1.00 . A A . 38 ARG CA 1 1 5 3528 1 1 38 ARG CB C 6.320 -9.739 -0.552 1.00 . A A . 38 ARG CB 1 1 5 3529 1 1 38 ARG CD C 5.995 -10.771 1.756 1.00 . A A . 38 ARG CD 1 1 5 3530 1 1 38 ARG CG C 5.638 -9.606 0.819 1.00 . A A . 38 ARG CG 1 1 5 3531 1 1 38 ARG CZ C 5.737 -10.090 4.151 1.00 . A A . 38 ARG CZ 1 1 5 3532 1 1 38 ARG H H 8.386 -7.655 -1.077 1.00 . A A . 38 ARG H 1 1 5 3533 1 1 38 ARG HA H 8.272 -10.288 0.234 1.00 . A A . 38 ARG HA 1 1 5 3534 1 1 38 ARG HB2 H 5.946 -8.955 -1.213 1.00 . A A . 38 ARG HB2 1 1 5 3535 1 1 38 ARG HB3 H 6.054 -10.704 -0.978 1.00 . A A . 38 ARG HB3 1 1 5 3536 1 1 38 ARG HD2 H 5.706 -11.705 1.268 1.00 . A A . 38 ARG HD2 1 1 5 3537 1 1 38 ARG HD3 H 7.066 -10.824 1.941 1.00 . A A . 38 ARG HD3 1 1 5 3538 1 1 38 ARG HG2 H 5.894 -8.648 1.275 1.00 . A A . 38 ARG HG2 1 1 5 3539 1 1 38 ARG HG3 H 4.559 -9.620 0.657 1.00 . A A . 38 ARG HG3 1 1 5 3540 1 1 38 ARG HH11 H 7.306 -9.156 3.221 1.00 . A A . 38 ARG HH11 1 1 5 3541 1 1 38 ARG HH12 H 7.238 -8.922 4.938 1.00 . A A . 38 ARG HH12 1 1 5 3542 1 1 38 ARG HH21 H 4.272 -10.849 5.363 1.00 . A A . 38 ARG HH21 1 1 5 3543 1 1 38 ARG HH22 H 5.423 -9.834 6.165 1.00 . A A . 38 ARG HH22 1 1 5 3544 1 1 38 ARG N N 8.246 -8.256 -0.265 1.00 . A A . 38 ARG N 1 1 5 3545 1 1 38 ARG NE N 5.277 -10.690 3.040 1.00 . A A . 38 ARG NE 1 1 5 3546 1 1 38 ARG NH1 N 6.836 -9.329 4.108 1.00 . A A . 38 ARG NH1 1 1 5 3547 1 1 38 ARG NH2 N 5.088 -10.255 5.311 1.00 . A A . 38 ARG NH2 1 1 5 3548 1 1 38 ARG O O 8.428 -9.237 -2.800 1.00 . A A . 38 ARG O 1 1 5 3549 1 1 39 GLU C C 10.660 -10.723 -3.723 1.00 . A A . 39 GLU C 1 1 5 3550 1 1 39 GLU CA C 9.696 -11.767 -3.140 1.00 . A A . 39 GLU CA 1 1 5 3551 1 1 39 GLU CB C 8.686 -12.305 -4.166 1.00 . A A . 39 GLU CB 1 1 5 3552 1 1 39 GLU CD C 6.834 -13.178 -2.615 1.00 . A A . 39 GLU CD 1 1 5 3553 1 1 39 GLU CG C 7.905 -13.524 -3.645 1.00 . A A . 39 GLU CG 1 1 5 3554 1 1 39 GLU H H 8.811 -11.913 -1.219 1.00 . A A . 39 GLU H 1 1 5 3555 1 1 39 GLU HA H 10.316 -12.607 -2.817 1.00 . A A . 39 GLU HA 1 1 5 3556 1 1 39 GLU HB2 H 7.996 -11.516 -4.465 1.00 . A A . 39 GLU HB2 1 1 5 3557 1 1 39 GLU HB3 H 9.245 -12.628 -5.046 1.00 . A A . 39 GLU HB3 1 1 5 3558 1 1 39 GLU HG2 H 7.409 -14.001 -4.493 1.00 . A A . 39 GLU HG2 1 1 5 3559 1 1 39 GLU HG3 H 8.597 -14.248 -3.213 1.00 . A A . 39 GLU HG3 1 1 5 3560 1 1 39 GLU N N 8.996 -11.249 -1.965 1.00 . A A . 39 GLU N 1 1 5 3561 1 1 39 GLU O O 10.743 -10.524 -4.931 1.00 . A A . 39 GLU O 1 1 5 3562 1 1 39 GLU OE1 O 7.124 -13.146 -1.418 1.00 . A A . 39 GLU OE1 1 1 5 3563 1 1 39 GLU OE2 O 5.596 -12.908 -3.106 1.00 . A A . 39 GLU OE2 1 1 5 3564 1 1 40 ASN C C 11.768 -7.768 -3.812 1.00 . A A . 40 ASN C 1 1 5 3565 1 1 40 ASN CA C 12.351 -8.995 -3.109 1.00 . A A . 40 ASN CA 1 1 5 3566 1 1 40 ASN CB C 13.528 -9.572 -3.884 1.00 . A A . 40 ASN CB 1 1 5 3567 1 1 40 ASN CG C 14.791 -8.725 -3.711 1.00 . A A . 40 ASN CG 1 1 5 3568 1 1 40 ASN H H 11.327 -10.358 -1.882 1.00 . A A . 40 ASN H 1 1 5 3569 1 1 40 ASN HA H 12.702 -8.657 -2.140 1.00 . A A . 40 ASN HA 1 1 5 3570 1 1 40 ASN HB2 H 13.719 -10.586 -3.543 1.00 . A A . 40 ASN HB2 1 1 5 3571 1 1 40 ASN HB3 H 13.210 -9.629 -4.919 1.00 . A A . 40 ASN HB3 1 1 5 3572 1 1 40 ASN HD21 H 15.319 -8.957 -5.663 1.00 . A A . 40 ASN HD21 1 1 5 3573 1 1 40 ASN HD22 H 16.408 -7.999 -4.682 1.00 . A A . 40 ASN HD22 1 1 5 3574 1 1 40 ASN N N 11.386 -10.047 -2.832 1.00 . A A . 40 ASN N 1 1 5 3575 1 1 40 ASN ND2 N 15.569 -8.551 -4.773 1.00 . A A . 40 ASN ND2 1 1 5 3576 1 1 40 ASN O O 12.509 -6.986 -4.400 1.00 . A A . 40 ASN O 1 1 5 3577 1 1 40 ASN OD1 O 15.077 -8.244 -2.611 1.00 . A A . 40 ASN OD1 1 1 5 3578 1 1 41 HIS C C 9.111 -5.699 -3.080 1.00 . A A . 41 HIS C 1 1 5 3579 1 1 41 HIS CA C 9.752 -6.422 -4.254 1.00 . A A . 41 HIS CA 1 1 5 3580 1 1 41 HIS CB C 8.715 -6.883 -5.275 1.00 . A A . 41 HIS CB 1 1 5 3581 1 1 41 HIS CD2 C 9.427 -8.818 -6.856 1.00 . A A . 41 HIS CD2 1 1 5 3582 1 1 41 HIS CE1 C 10.704 -7.681 -8.210 1.00 . A A . 41 HIS CE1 1 1 5 3583 1 1 41 HIS CG C 9.389 -7.504 -6.475 1.00 . A A . 41 HIS CG 1 1 5 3584 1 1 41 HIS H H 9.873 -8.265 -3.272 1.00 . A A . 41 HIS H 1 1 5 3585 1 1 41 HIS HA H 10.446 -5.761 -4.766 1.00 . A A . 41 HIS HA 1 1 5 3586 1 1 41 HIS HB2 H 8.066 -7.616 -4.792 1.00 . A A . 41 HIS HB2 1 1 5 3587 1 1 41 HIS HB3 H 8.090 -6.038 -5.568 1.00 . A A . 41 HIS HB3 1 1 5 3588 1 1 41 HIS HD1 H 10.361 -5.789 -7.341 1.00 . A A . 41 HIS HD1 1 1 5 3589 1 1 41 HIS HD2 H 8.986 -9.639 -6.311 1.00 . A A . 41 HIS HD2 1 1 5 3590 1 1 41 HIS HE1 H 11.402 -7.438 -9.001 1.00 . A A . 41 HIS HE1 1 1 5 3591 1 1 41 HIS N N 10.452 -7.578 -3.734 1.00 . A A . 41 HIS N 1 1 5 3592 1 1 41 HIS ND1 N 10.172 -6.783 -7.364 1.00 . A A . 41 HIS ND1 1 1 5 3593 1 1 41 HIS NE2 N 10.275 -8.926 -7.940 1.00 . A A . 41 HIS NE2 1 1 5 3594 1 1 41 HIS O O 8.295 -6.289 -2.374 1.00 . A A . 41 HIS O 1 1 5 3595 1 1 42 TRP C C 7.496 -3.158 -2.482 1.00 . A A . 42 TRP C 1 1 5 3596 1 1 42 TRP CA C 8.816 -3.604 -1.887 1.00 . A A . 42 TRP CA 1 1 5 3597 1 1 42 TRP CB C 9.703 -2.432 -1.482 1.00 . A A . 42 TRP CB 1 1 5 3598 1 1 42 TRP CD1 C 11.961 -3.326 -0.797 1.00 . A A . 42 TRP CD1 1 1 5 3599 1 1 42 TRP CD2 C 10.702 -2.717 0.954 1.00 . A A . 42 TRP CD2 1 1 5 3600 1 1 42 TRP CE2 C 11.925 -3.222 1.474 1.00 . A A . 42 TRP CE2 1 1 5 3601 1 1 42 TRP CE3 C 9.698 -2.386 1.884 1.00 . A A . 42 TRP CE3 1 1 5 3602 1 1 42 TRP CG C 10.760 -2.795 -0.498 1.00 . A A . 42 TRP CG 1 1 5 3603 1 1 42 TRP CH2 C 11.119 -3.045 3.749 1.00 . A A . 42 TRP CH2 1 1 5 3604 1 1 42 TRP CZ2 C 12.123 -3.430 2.846 1.00 . A A . 42 TRP CZ2 1 1 5 3605 1 1 42 TRP CZ3 C 9.919 -2.493 3.267 1.00 . A A . 42 TRP CZ3 1 1 5 3606 1 1 42 TRP H H 10.085 -3.977 -3.537 1.00 . A A . 42 TRP H 1 1 5 3607 1 1 42 TRP HA H 8.617 -4.153 -0.981 1.00 . A A . 42 TRP HA 1 1 5 3608 1 1 42 TRP HB2 H 10.150 -1.968 -2.360 1.00 . A A . 42 TRP HB2 1 1 5 3609 1 1 42 TRP HB3 H 9.082 -1.697 -0.984 1.00 . A A . 42 TRP HB3 1 1 5 3610 1 1 42 TRP HD1 H 12.276 -3.582 -1.794 1.00 . A A . 42 TRP HD1 1 1 5 3611 1 1 42 TRP HE1 H 13.586 -3.965 0.432 1.00 . A A . 42 TRP HE1 1 1 5 3612 1 1 42 TRP HE3 H 8.729 -2.093 1.521 1.00 . A A . 42 TRP HE3 1 1 5 3613 1 1 42 TRP HH2 H 11.248 -3.205 4.810 1.00 . A A . 42 TRP HH2 1 1 5 3614 1 1 42 TRP HZ2 H 12.992 -3.982 3.168 1.00 . A A . 42 TRP HZ2 1 1 5 3615 1 1 42 TRP HZ3 H 9.146 -2.177 3.953 1.00 . A A . 42 TRP HZ3 1 1 5 3616 1 1 42 TRP N N 9.491 -4.442 -2.857 1.00 . A A . 42 TRP N 1 1 5 3617 1 1 42 TRP NE1 N 12.670 -3.556 0.363 1.00 . A A . 42 TRP NE1 1 1 5 3618 1 1 42 TRP O O 7.497 -2.340 -3.390 1.00 . A A . 42 TRP O 1 1 5 3619 1 1 43 LYS C C 4.571 -2.240 -1.476 1.00 . A A . 43 LYS C 1 1 5 3620 1 1 43 LYS CA C 5.063 -3.262 -2.482 1.00 . A A . 43 LYS CA 1 1 5 3621 1 1 43 LYS CB C 4.072 -4.425 -2.594 1.00 . A A . 43 LYS CB 1 1 5 3622 1 1 43 LYS CD C 5.593 -5.743 -4.201 1.00 . A A . 43 LYS CD 1 1 5 3623 1 1 43 LYS CE C 4.765 -5.777 -5.502 1.00 . A A . 43 LYS CE 1 1 5 3624 1 1 43 LYS CG C 4.782 -5.743 -2.892 1.00 . A A . 43 LYS CG 1 1 5 3625 1 1 43 LYS H H 6.405 -4.383 -1.275 1.00 . A A . 43 LYS H 1 1 5 3626 1 1 43 LYS HA H 5.143 -2.827 -3.475 1.00 . A A . 43 LYS HA 1 1 5 3627 1 1 43 LYS HB2 H 3.552 -4.535 -1.648 1.00 . A A . 43 LYS HB2 1 1 5 3628 1 1 43 LYS HB3 H 3.313 -4.198 -3.337 1.00 . A A . 43 LYS HB3 1 1 5 3629 1 1 43 LYS HD2 H 6.312 -4.928 -4.240 1.00 . A A . 43 LYS HD2 1 1 5 3630 1 1 43 LYS HD3 H 6.155 -6.675 -4.164 1.00 . A A . 43 LYS HD3 1 1 5 3631 1 1 43 LYS HE2 H 5.443 -6.048 -6.314 1.00 . A A . 43 LYS HE2 1 1 5 3632 1 1 43 LYS HE3 H 3.999 -6.554 -5.434 1.00 . A A . 43 LYS HE3 1 1 5 3633 1 1 43 LYS HG2 H 5.359 -5.963 -1.987 1.00 . A A . 43 LYS HG2 1 1 5 3634 1 1 43 LYS HG3 H 4.093 -6.566 -2.985 1.00 . A A . 43 LYS HG3 1 1 5 3635 1 1 43 LYS HZ1 H 4.423 -4.227 -6.827 1.00 . A A . 43 LYS HZ1 1 1 5 3636 1 1 43 LYS HZ2 H 3.103 -4.599 -5.855 1.00 . A A . 43 LYS HZ2 1 1 5 3637 1 1 43 LYS N N 6.371 -3.705 -2.030 1.00 . A A . 43 LYS N 1 1 5 3638 1 1 43 LYS NZ N 4.127 -4.494 -5.877 1.00 . A A . 43 LYS NZ 1 1 5 3639 1 1 43 LYS O O 4.751 -2.437 -0.276 1.00 . A A . 43 LYS O 1 1 5 3640 1 1 44 CYS C C 1.808 -1.168 -0.810 1.00 . A A . 44 CYS C 1 1 5 3641 1 1 44 CYS CA C 3.076 -0.373 -1.092 1.00 . A A . 44 CYS CA 1 1 5 3642 1 1 44 CYS CB C 2.770 0.951 -1.776 1.00 . A A . 44 CYS CB 1 1 5 3643 1 1 44 CYS H H 3.819 -1.071 -2.946 1.00 . A A . 44 CYS H 1 1 5 3644 1 1 44 CYS HA H 3.573 -0.134 -0.161 1.00 . A A . 44 CYS HA 1 1 5 3645 1 1 44 CYS HB2 H 3.660 1.569 -1.681 1.00 . A A . 44 CYS HB2 1 1 5 3646 1 1 44 CYS HB3 H 2.548 0.779 -2.826 1.00 . A A . 44 CYS HB3 1 1 5 3647 1 1 44 CYS N N 3.925 -1.178 -1.949 1.00 . A A . 44 CYS N 1 1 5 3648 1 1 44 CYS O O 1.045 -1.418 -1.734 1.00 . A A . 44 CYS O 1 1 5 3649 1 1 44 CYS SG S 1.367 1.824 -1.055 1.00 . A A . 44 CYS SG 1 1 5 3650 1 1 45 PHE C C -0.575 -1.258 1.397 1.00 . A A . 45 PHE C 1 1 5 3651 1 1 45 PHE CA C 0.385 -2.295 0.823 1.00 . A A . 45 PHE CA 1 1 5 3652 1 1 45 PHE CB C 0.687 -3.382 1.855 1.00 . A A . 45 PHE CB 1 1 5 3653 1 1 45 PHE CD1 C 2.519 -4.785 0.806 1.00 . A A . 45 PHE CD1 1 1 5 3654 1 1 45 PHE CD2 C 0.364 -5.817 1.241 1.00 . A A . 45 PHE CD2 1 1 5 3655 1 1 45 PHE CE1 C 3.040 -6.034 0.418 1.00 . A A . 45 PHE CE1 1 1 5 3656 1 1 45 PHE CE2 C 0.872 -7.059 0.823 1.00 . A A . 45 PHE CE2 1 1 5 3657 1 1 45 PHE CG C 1.199 -4.686 1.277 1.00 . A A . 45 PHE CG 1 1 5 3658 1 1 45 PHE CZ C 2.212 -7.170 0.418 1.00 . A A . 45 PHE CZ 1 1 5 3659 1 1 45 PHE H H 2.232 -1.344 1.188 1.00 . A A . 45 PHE H 1 1 5 3660 1 1 45 PHE HA H -0.083 -2.771 -0.043 1.00 . A A . 45 PHE HA 1 1 5 3661 1 1 45 PHE HB2 H 1.402 -2.996 2.577 1.00 . A A . 45 PHE HB2 1 1 5 3662 1 1 45 PHE HB3 H -0.225 -3.596 2.407 1.00 . A A . 45 PHE HB3 1 1 5 3663 1 1 45 PHE HD1 H 3.158 -3.915 0.817 1.00 . A A . 45 PHE HD1 1 1 5 3664 1 1 45 PHE HD2 H -0.679 -5.731 1.505 1.00 . A A . 45 PHE HD2 1 1 5 3665 1 1 45 PHE HE1 H 4.073 -6.118 0.118 1.00 . A A . 45 PHE HE1 1 1 5 3666 1 1 45 PHE HE2 H 0.225 -7.927 0.802 1.00 . A A . 45 PHE HE2 1 1 5 3667 1 1 45 PHE HZ H 2.598 -8.125 0.091 1.00 . A A . 45 PHE HZ 1 1 5 3668 1 1 45 PHE N N 1.608 -1.614 0.434 1.00 . A A . 45 PHE N 1 1 5 3669 1 1 45 PHE O O -0.148 -0.310 2.054 1.00 . A A . 45 PHE O 1 1 5 3670 1 1 46 CYS C C -3.766 -1.480 2.615 1.00 . A A . 46 CYS C 1 1 5 3671 1 1 46 CYS CA C -2.957 -0.640 1.645 1.00 . A A . 46 CYS CA 1 1 5 3672 1 1 46 CYS CB C -3.831 -0.228 0.461 1.00 . A A . 46 CYS CB 1 1 5 3673 1 1 46 CYS H H -2.141 -2.313 0.678 1.00 . A A . 46 CYS H 1 1 5 3674 1 1 46 CYS HA H -2.616 0.230 2.214 1.00 . A A . 46 CYS HA 1 1 5 3675 1 1 46 CYS HB2 H -4.179 -1.138 -0.014 1.00 . A A . 46 CYS HB2 1 1 5 3676 1 1 46 CYS HB3 H -4.690 0.313 0.846 1.00 . A A . 46 CYS HB3 1 1 5 3677 1 1 46 CYS N N -1.865 -1.464 1.161 1.00 . A A . 46 CYS N 1 1 5 3678 1 1 46 CYS O O -3.718 -2.704 2.568 1.00 . A A . 46 CYS O 1 1 5 3679 1 1 46 CYS SG S -3.081 0.781 -0.839 1.00 . A A . 46 CYS SG 1 1 5 3680 1 1 47 TYR C C -6.474 -0.839 4.830 1.00 . A A . 47 TYR C 1 1 5 3681 1 1 47 TYR CA C -5.083 -1.432 4.688 1.00 . A A . 47 TYR CA 1 1 5 3682 1 1 47 TYR CB C -4.219 -1.057 5.893 1.00 . A A . 47 TYR CB 1 1 5 3683 1 1 47 TYR CD1 C -1.797 -1.451 5.270 1.00 . A A . 47 TYR CD1 1 1 5 3684 1 1 47 TYR CD2 C -2.846 -2.899 6.924 1.00 . A A . 47 TYR CD2 1 1 5 3685 1 1 47 TYR CE1 C -0.568 -2.091 5.488 1.00 . A A . 47 TYR CE1 1 1 5 3686 1 1 47 TYR CE2 C -1.607 -3.500 7.180 1.00 . A A . 47 TYR CE2 1 1 5 3687 1 1 47 TYR CG C -2.927 -1.827 6.021 1.00 . A A . 47 TYR CG 1 1 5 3688 1 1 47 TYR CZ C -0.465 -3.071 6.488 1.00 . A A . 47 TYR CZ 1 1 5 3689 1 1 47 TYR H H -4.422 0.199 3.510 1.00 . A A . 47 TYR H 1 1 5 3690 1 1 47 TYR HA H -5.157 -2.514 4.607 1.00 . A A . 47 TYR HA 1 1 5 3691 1 1 47 TYR HB2 H -3.973 -0.007 5.779 1.00 . A A . 47 TYR HB2 1 1 5 3692 1 1 47 TYR HB3 H -4.769 -1.162 6.826 1.00 . A A . 47 TYR HB3 1 1 5 3693 1 1 47 TYR HD1 H -1.862 -0.657 4.545 1.00 . A A . 47 TYR HD1 1 1 5 3694 1 1 47 TYR HD2 H -3.724 -3.243 7.449 1.00 . A A . 47 TYR HD2 1 1 5 3695 1 1 47 TYR HE1 H 0.288 -1.821 4.888 1.00 . A A . 47 TYR HE1 1 1 5 3696 1 1 47 TYR HE2 H -1.543 -4.292 7.914 1.00 . A A . 47 TYR HE2 1 1 5 3697 1 1 47 TYR HH H 0.678 -4.236 7.525 1.00 . A A . 47 TYR HH 1 1 5 3698 1 1 47 TYR N N -4.466 -0.816 3.528 1.00 . A A . 47 TYR N 1 1 5 3699 1 1 47 TYR O O -6.582 0.307 5.255 1.00 . A A . 47 TYR O 1 1 5 3700 1 1 47 TYR OH O 0.745 -3.603 6.804 1.00 . A A . 47 TYR OH 1 1 5 3701 1 1 48 PHE C C -9.665 -1.493 5.644 1.00 . A A . 48 PHE C 1 1 5 3702 1 1 48 PHE CA C -8.869 -1.048 4.420 1.00 . A A . 48 PHE CA 1 1 5 3703 1 1 48 PHE CB C -9.485 -1.655 3.154 1.00 . A A . 48 PHE CB 1 1 5 3704 1 1 48 PHE CD1 C -7.691 -1.847 1.375 1.00 . A A . 48 PHE CD1 1 1 5 3705 1 1 48 PHE CD2 C -9.371 -0.100 1.156 1.00 . A A . 48 PHE CD2 1 1 5 3706 1 1 48 PHE CE1 C -7.047 -1.370 0.224 1.00 . A A . 48 PHE CE1 1 1 5 3707 1 1 48 PHE CE2 C -8.707 0.395 0.020 1.00 . A A . 48 PHE CE2 1 1 5 3708 1 1 48 PHE CG C -8.839 -1.193 1.863 1.00 . A A . 48 PHE CG 1 1 5 3709 1 1 48 PHE CZ C -7.525 -0.221 -0.426 1.00 . A A . 48 PHE CZ 1 1 5 3710 1 1 48 PHE H H -7.418 -2.522 4.122 1.00 . A A . 48 PHE H 1 1 5 3711 1 1 48 PHE HA H -8.887 0.037 4.343 1.00 . A A . 48 PHE HA 1 1 5 3712 1 1 48 PHE HB2 H -9.428 -2.742 3.214 1.00 . A A . 48 PHE HB2 1 1 5 3713 1 1 48 PHE HB3 H -10.533 -1.408 3.130 1.00 . A A . 48 PHE HB3 1 1 5 3714 1 1 48 PHE HD1 H -7.286 -2.710 1.888 1.00 . A A . 48 PHE HD1 1 1 5 3715 1 1 48 PHE HD2 H -10.263 0.403 1.508 1.00 . A A . 48 PHE HD2 1 1 5 3716 1 1 48 PHE HE1 H -6.196 -1.902 -0.170 1.00 . A A . 48 PHE HE1 1 1 5 3717 1 1 48 PHE HE2 H -9.102 1.255 -0.499 1.00 . A A . 48 PHE HE2 1 1 5 3718 1 1 48 PHE HZ H -6.987 0.179 -1.274 1.00 . A A . 48 PHE HZ 1 1 5 3719 1 1 48 PHE N N -7.526 -1.577 4.467 1.00 . A A . 48 PHE N 1 1 5 3720 1 1 48 PHE O O -9.200 -2.323 6.423 1.00 . A A . 48 PHE O 1 1 5 3721 1 1 49 ASN C C -11.482 -1.685 8.075 1.00 . A A . 49 ASN C 1 1 5 3722 1 1 49 ASN CA C -11.969 -1.505 6.631 1.00 . A A . 49 ASN CA 1 1 5 3723 1 1 49 ASN CB C -12.605 -2.800 6.106 1.00 . A A . 49 ASN CB 1 1 5 3724 1 1 49 ASN CG C -13.115 -2.670 4.673 1.00 . A A . 49 ASN CG 1 1 5 3725 1 1 49 ASN H H -11.236 -0.411 4.994 1.00 . A A . 49 ASN H 1 1 5 3726 1 1 49 ASN HA H -12.745 -0.742 6.643 1.00 . A A . 49 ASN HA 1 1 5 3727 1 1 49 ASN HB2 H -11.858 -3.589 6.161 1.00 . A A . 49 ASN HB2 1 1 5 3728 1 1 49 ASN HB3 H -13.451 -3.075 6.737 1.00 . A A . 49 ASN HB3 1 1 5 3729 1 1 49 ASN HD21 H -12.811 -4.646 4.341 1.00 . A A . 49 ASN HD21 1 1 5 3730 1 1 49 ASN HD22 H -13.511 -3.738 2.999 1.00 . A A . 49 ASN HD22 1 1 5 3731 1 1 49 ASN N N -10.931 -1.067 5.700 1.00 . A A . 49 ASN N 1 1 5 3732 1 1 49 ASN ND2 N -13.153 -3.776 3.940 1.00 . A A . 49 ASN ND2 1 1 5 3733 1 1 49 ASN O O -11.969 -2.579 8.777 1.00 . A A . 49 ASN O 1 1 5 3734 1 1 49 ASN OD1 O -13.444 -1.581 4.211 1.00 . A A . 49 ASN OD1 1 1 5 3735 1 1 50 CYS C C -10.799 -0.820 11.002 1.00 . A A . 50 CYS C 1 1 5 3736 1 1 50 CYS CA C -9.910 -1.191 9.825 1.00 . A A . 50 CYS CA 1 1 5 3737 1 1 50 CYS CB C -8.486 -0.679 9.978 1.00 . A A . 50 CYS CB 1 1 5 3738 1 1 50 CYS H H -10.109 -0.153 7.965 1.00 . A A . 50 CYS H 1 1 5 3739 1 1 50 CYS HA H -9.784 -2.255 9.852 1.00 . A A . 50 CYS HA 1 1 5 3740 1 1 50 CYS HB2 H -7.923 -0.840 9.060 1.00 . A A . 50 CYS HB2 1 1 5 3741 1 1 50 CYS HB3 H -8.503 0.376 10.219 1.00 . A A . 50 CYS HB3 1 1 5 3742 1 1 50 CYS N N -10.526 -0.874 8.547 1.00 . A A . 50 CYS N 1 1 5 3743 1 1 50 CYS O O -11.295 -1.751 11.713 1.00 . A A . 50 CYS O 1 1 5 3744 1 1 50 CYS OXT O -11.043 0.397 11.271 1.00 . A A . 50 CYS OXT 1 1 5 3745 1 1 50 CYS SG S -7.707 -1.613 11.319 1.00 . A A . 50 CYS SG 1 1 6 3746 1 1 1 LEU C C -9.519 -5.159 8.671 1.00 . A A . 1 LEU C 1 1 6 3747 1 1 1 LEU CA C -10.457 -5.817 9.684 1.00 . A A . 1 LEU CA 1 1 6 3748 1 1 1 LEU CB C -10.214 -7.331 9.817 1.00 . A A . 1 LEU CB 1 1 6 3749 1 1 1 LEU CD1 C -8.905 -8.936 11.244 1.00 . A A . 1 LEU CD1 1 1 6 3750 1 1 1 LEU CD2 C -7.846 -8.027 9.188 1.00 . A A . 1 LEU CD2 1 1 6 3751 1 1 1 LEU CG C -8.811 -7.704 10.336 1.00 . A A . 1 LEU CG 1 1 6 3752 1 1 1 LEU H1 H -12.014 -4.545 9.243 1.00 . A A . 1 LEU H1 1 1 6 3753 1 1 1 LEU H2 H -12.003 -5.959 8.333 1.00 . A A . 1 LEU H2 1 1 6 3754 1 1 1 LEU H3 H -12.491 -5.998 9.942 1.00 . A A . 1 LEU H3 1 1 6 3755 1 1 1 LEU HA H -10.312 -5.352 10.661 1.00 . A A . 1 LEU HA 1 1 6 3756 1 1 1 LEU HB2 H -10.952 -7.707 10.527 1.00 . A A . 1 LEU HB2 1 1 6 3757 1 1 1 LEU HB3 H -10.391 -7.823 8.860 1.00 . A A . 1 LEU HB3 1 1 6 3758 1 1 1 LEU HD11 H -9.330 -9.776 10.696 1.00 . A A . 1 LEU HD11 1 1 6 3759 1 1 1 LEU HD12 H -7.908 -9.211 11.596 1.00 . A A . 1 LEU HD12 1 1 6 3760 1 1 1 LEU HD13 H -9.530 -8.718 12.111 1.00 . A A . 1 LEU HD13 1 1 6 3761 1 1 1 LEU HD21 H -7.754 -7.190 8.500 1.00 . A A . 1 LEU HD21 1 1 6 3762 1 1 1 LEU HD22 H -6.860 -8.249 9.592 1.00 . A A . 1 LEU HD22 1 1 6 3763 1 1 1 LEU HD23 H -8.201 -8.897 8.634 1.00 . A A . 1 LEU HD23 1 1 6 3764 1 1 1 LEU HG H -8.407 -6.886 10.934 1.00 . A A . 1 LEU HG 1 1 6 3765 1 1 1 LEU N N -11.846 -5.560 9.270 1.00 . A A . 1 LEU N 1 1 6 3766 1 1 1 LEU O O -9.882 -5.093 7.500 1.00 . A A . 1 LEU O 1 1 6 3767 1 1 2 CYS C C -6.814 -4.752 7.222 1.00 . A A . 2 CYS C 1 1 6 3768 1 1 2 CYS CA C -7.385 -3.898 8.359 1.00 . A A . 2 CYS CA 1 1 6 3769 1 1 2 CYS CB C -6.295 -3.326 9.290 1.00 . A A . 2 CYS CB 1 1 6 3770 1 1 2 CYS H H -8.168 -4.772 10.111 1.00 . A A . 2 CYS H 1 1 6 3771 1 1 2 CYS HA H -7.892 -3.043 7.922 1.00 . A A . 2 CYS HA 1 1 6 3772 1 1 2 CYS HB2 H -5.565 -4.107 9.495 1.00 . A A . 2 CYS HB2 1 1 6 3773 1 1 2 CYS HB3 H -5.783 -2.509 8.788 1.00 . A A . 2 CYS HB3 1 1 6 3774 1 1 2 CYS N N -8.368 -4.657 9.130 1.00 . A A . 2 CYS N 1 1 6 3775 1 1 2 CYS O O -5.743 -5.337 7.356 1.00 . A A . 2 CYS O 1 1 6 3776 1 1 2 CYS SG S -6.824 -2.752 10.930 1.00 . A A . 2 CYS SG 1 1 6 3777 1 1 3 ASN C C -6.209 -6.271 4.440 1.00 . A A . 3 ASN C 1 1 6 3778 1 1 3 ASN CA C -7.476 -6.075 5.275 1.00 . A A . 3 ASN CA 1 1 6 3779 1 1 3 ASN CB C -8.688 -6.107 4.319 1.00 . A A . 3 ASN CB 1 1 6 3780 1 1 3 ASN CG C -8.745 -4.951 3.326 1.00 . A A . 3 ASN CG 1 1 6 3781 1 1 3 ASN H H -8.382 -4.303 6.068 1.00 . A A . 3 ASN H 1 1 6 3782 1 1 3 ASN HA H -7.544 -6.935 5.942 1.00 . A A . 3 ASN HA 1 1 6 3783 1 1 3 ASN HB2 H -8.668 -7.019 3.716 1.00 . A A . 3 ASN HB2 1 1 6 3784 1 1 3 ASN HB3 H -9.612 -6.097 4.888 1.00 . A A . 3 ASN HB3 1 1 6 3785 1 1 3 ASN HD21 H -10.520 -5.631 2.595 1.00 . A A . 3 ASN HD21 1 1 6 3786 1 1 3 ASN HD22 H -9.879 -4.194 1.826 1.00 . A A . 3 ASN HD22 1 1 6 3787 1 1 3 ASN N N -7.531 -4.860 6.099 1.00 . A A . 3 ASN N 1 1 6 3788 1 1 3 ASN ND2 N -9.820 -4.904 2.541 1.00 . A A . 3 ASN ND2 1 1 6 3789 1 1 3 ASN O O -6.206 -7.150 3.577 1.00 . A A . 3 ASN O 1 1 6 3790 1 1 3 ASN OD1 O -7.854 -4.110 3.247 1.00 . A A . 3 ASN OD1 1 1 6 3791 1 1 4 GLU C C -3.879 -6.071 2.645 1.00 . A A . 4 GLU C 1 1 6 3792 1 1 4 GLU CA C -3.820 -5.680 4.124 1.00 . A A . 4 GLU CA 1 1 6 3793 1 1 4 GLU CB C -2.937 -6.609 4.970 1.00 . A A . 4 GLU CB 1 1 6 3794 1 1 4 GLU CD C -0.684 -7.514 4.002 1.00 . A A . 4 GLU CD 1 1 6 3795 1 1 4 GLU CG C -1.469 -6.332 4.585 1.00 . A A . 4 GLU CG 1 1 6 3796 1 1 4 GLU H H -5.208 -4.925 5.507 1.00 . A A . 4 GLU H 1 1 6 3797 1 1 4 GLU HA H -3.409 -4.667 4.181 1.00 . A A . 4 GLU HA 1 1 6 3798 1 1 4 GLU HB2 H -3.070 -6.352 6.022 1.00 . A A . 4 GLU HB2 1 1 6 3799 1 1 4 GLU HB3 H -3.222 -7.655 4.841 1.00 . A A . 4 GLU HB3 1 1 6 3800 1 1 4 GLU HG2 H -1.462 -5.505 3.874 1.00 . A A . 4 GLU HG2 1 1 6 3801 1 1 4 GLU HG3 H -0.934 -6.012 5.478 1.00 . A A . 4 GLU HG3 1 1 6 3802 1 1 4 GLU N N -5.148 -5.502 4.682 1.00 . A A . 4 GLU N 1 1 6 3803 1 1 4 GLU O O -3.617 -7.222 2.292 1.00 . A A . 4 GLU O 1 1 6 3804 1 1 4 GLU OE1 O -1.366 -8.416 3.245 1.00 . A A . 4 GLU OE1 1 1 6 3805 1 1 4 GLU OE2 O 0.528 -7.588 4.226 1.00 . A A . 4 GLU OE2 1 1 6 3806 1 1 5 ARG C C -3.303 -4.764 -0.384 1.00 . A A . 5 ARG C 1 1 6 3807 1 1 5 ARG CA C -4.506 -5.319 0.380 1.00 . A A . 5 ARG CA 1 1 6 3808 1 1 5 ARG CB C -5.811 -4.601 0.008 1.00 . A A . 5 ARG CB 1 1 6 3809 1 1 5 ARG CD C -7.738 -6.319 0.032 1.00 . A A . 5 ARG CD 1 1 6 3810 1 1 5 ARG CG C -6.753 -5.497 -0.803 1.00 . A A . 5 ARG CG 1 1 6 3811 1 1 5 ARG CZ C -6.529 -8.427 0.693 1.00 . A A . 5 ARG CZ 1 1 6 3812 1 1 5 ARG H H -4.238 -4.187 2.159 1.00 . A A . 5 ARG H 1 1 6 3813 1 1 5 ARG HA H -4.599 -6.384 0.181 1.00 . A A . 5 ARG HA 1 1 6 3814 1 1 5 ARG HB2 H -6.335 -4.249 0.897 1.00 . A A . 5 ARG HB2 1 1 6 3815 1 1 5 ARG HB3 H -5.563 -3.726 -0.598 1.00 . A A . 5 ARG HB3 1 1 6 3816 1 1 5 ARG HD2 H -8.345 -5.621 0.601 1.00 . A A . 5 ARG HD2 1 1 6 3817 1 1 5 ARG HD3 H -8.417 -6.868 -0.625 1.00 . A A . 5 ARG HD3 1 1 6 3818 1 1 5 ARG HG2 H -7.326 -4.837 -1.445 1.00 . A A . 5 ARG HG2 1 1 6 3819 1 1 5 ARG HG3 H -6.170 -6.178 -1.410 1.00 . A A . 5 ARG HG3 1 1 6 3820 1 1 5 ARG HH11 H -7.225 -8.494 -1.214 1.00 . A A . 5 ARG HH11 1 1 6 3821 1 1 5 ARG HH12 H -6.333 -9.902 -0.727 1.00 . A A . 5 ARG HH12 1 1 6 3822 1 1 5 ARG HH21 H -5.633 -8.532 2.499 1.00 . A A . 5 ARG HH21 1 1 6 3823 1 1 5 ARG HH22 H -5.391 -9.950 1.502 1.00 . A A . 5 ARG HH22 1 1 6 3824 1 1 5 ARG N N -4.257 -5.129 1.799 1.00 . A A . 5 ARG N 1 1 6 3825 1 1 5 ARG NE N -7.050 -7.222 0.964 1.00 . A A . 5 ARG NE 1 1 6 3826 1 1 5 ARG NH1 N -6.704 -8.989 -0.507 1.00 . A A . 5 ARG NH1 1 1 6 3827 1 1 5 ARG NH2 N -5.820 -9.048 1.638 1.00 . A A . 5 ARG NH2 1 1 6 3828 1 1 5 ARG O O -2.713 -3.785 0.075 1.00 . A A . 5 ARG O 1 1 6 3829 1 1 6 PRO C C -1.635 -3.781 -2.885 1.00 . A A . 6 PRO C 1 1 6 3830 1 1 6 PRO CA C -1.592 -5.070 -2.067 1.00 . A A . 6 PRO CA 1 1 6 3831 1 1 6 PRO CB C -1.199 -6.299 -2.896 1.00 . A A . 6 PRO CB 1 1 6 3832 1 1 6 PRO CD C -3.469 -6.527 -2.179 1.00 . A A . 6 PRO CD 1 1 6 3833 1 1 6 PRO CG C -2.551 -6.826 -3.365 1.00 . A A . 6 PRO CG 1 1 6 3834 1 1 6 PRO HA H -0.898 -4.931 -1.254 1.00 . A A . 6 PRO HA 1 1 6 3835 1 1 6 PRO HB2 H -0.533 -6.081 -3.730 1.00 . A A . 6 PRO HB2 1 1 6 3836 1 1 6 PRO HB3 H -0.741 -7.041 -2.240 1.00 . A A . 6 PRO HB3 1 1 6 3837 1 1 6 PRO HD2 H -4.451 -6.281 -2.573 1.00 . A A . 6 PRO HD2 1 1 6 3838 1 1 6 PRO HD3 H -3.510 -7.394 -1.519 1.00 . A A . 6 PRO HD3 1 1 6 3839 1 1 6 PRO HG2 H -2.880 -6.245 -4.230 1.00 . A A . 6 PRO HG2 1 1 6 3840 1 1 6 PRO HG3 H -2.523 -7.886 -3.615 1.00 . A A . 6 PRO HG3 1 1 6 3841 1 1 6 PRO N N -2.876 -5.391 -1.491 1.00 . A A . 6 PRO N 1 1 6 3842 1 1 6 PRO O O -2.655 -3.101 -2.958 1.00 . A A . 6 PRO O 1 1 6 3843 1 1 7 SER C C -1.453 -2.586 -5.608 1.00 . A A . 7 SER C 1 1 6 3844 1 1 7 SER CA C -0.389 -2.422 -4.517 1.00 . A A . 7 SER CA 1 1 6 3845 1 1 7 SER CB C 1.001 -2.523 -5.141 1.00 . A A . 7 SER CB 1 1 6 3846 1 1 7 SER H H 0.320 -4.023 -3.369 1.00 . A A . 7 SER H 1 1 6 3847 1 1 7 SER HA H -0.476 -1.433 -4.059 1.00 . A A . 7 SER HA 1 1 6 3848 1 1 7 SER HB2 H 0.894 -2.136 -6.152 1.00 . A A . 7 SER HB2 1 1 6 3849 1 1 7 SER HB3 H 1.704 -1.906 -4.579 1.00 . A A . 7 SER HB3 1 1 6 3850 1 1 7 SER HG H 0.727 -4.368 -5.619 1.00 . A A . 7 SER HG 1 1 6 3851 1 1 7 SER N N -0.507 -3.465 -3.518 1.00 . A A . 7 SER N 1 1 6 3852 1 1 7 SER O O -1.327 -3.485 -6.436 1.00 . A A . 7 SER O 1 1 6 3853 1 1 7 SER OG O 1.447 -3.871 -5.203 1.00 . A A . 7 SER OG 1 1 6 3854 1 1 8 GLN C C -3.069 -0.353 -7.535 1.00 . A A . 8 GLN C 1 1 6 3855 1 1 8 GLN CA C -3.443 -1.559 -6.666 1.00 . A A . 8 GLN CA 1 1 6 3856 1 1 8 GLN CB C -4.821 -1.385 -6.017 1.00 . A A . 8 GLN CB 1 1 6 3857 1 1 8 GLN CD C -6.672 -2.581 -4.712 1.00 . A A . 8 GLN CD 1 1 6 3858 1 1 8 GLN CG C -5.240 -2.643 -5.241 1.00 . A A . 8 GLN CG 1 1 6 3859 1 1 8 GLN H H -2.514 -1.060 -4.846 1.00 . A A . 8 GLN H 1 1 6 3860 1 1 8 GLN HA H -3.461 -2.448 -7.302 1.00 . A A . 8 GLN HA 1 1 6 3861 1 1 8 GLN HB2 H -4.809 -0.530 -5.344 1.00 . A A . 8 GLN HB2 1 1 6 3862 1 1 8 GLN HB3 H -5.539 -1.194 -6.805 1.00 . A A . 8 GLN HB3 1 1 6 3863 1 1 8 GLN HE21 H -6.347 -0.809 -3.734 1.00 . A A . 8 GLN HE21 1 1 6 3864 1 1 8 GLN HE22 H -7.956 -1.507 -3.594 1.00 . A A . 8 GLN HE22 1 1 6 3865 1 1 8 GLN HG2 H -5.150 -3.509 -5.895 1.00 . A A . 8 GLN HG2 1 1 6 3866 1 1 8 GLN HG3 H -4.581 -2.785 -4.389 1.00 . A A . 8 GLN HG3 1 1 6 3867 1 1 8 GLN N N -2.447 -1.698 -5.618 1.00 . A A . 8 GLN N 1 1 6 3868 1 1 8 GLN NE2 N -7.012 -1.550 -3.944 1.00 . A A . 8 GLN NE2 1 1 6 3869 1 1 8 GLN O O -2.760 -0.492 -8.715 1.00 . A A . 8 GLN O 1 1 6 3870 1 1 8 GLN OE1 O -7.473 -3.468 -4.975 1.00 . A A . 8 GLN OE1 1 1 6 3871 1 1 9 THR C C -1.190 2.076 -7.868 1.00 . A A . 9 THR C 1 1 6 3872 1 1 9 THR CA C -2.691 2.072 -7.616 1.00 . A A . 9 THR CA 1 1 6 3873 1 1 9 THR CB C -3.043 3.233 -6.681 1.00 . A A . 9 THR CB 1 1 6 3874 1 1 9 THR CG2 C -4.544 3.521 -6.708 1.00 . A A . 9 THR CG2 1 1 6 3875 1 1 9 THR H H -3.251 0.926 -5.951 1.00 . A A . 9 THR H 1 1 6 3876 1 1 9 THR HA H -3.224 2.164 -8.565 1.00 . A A . 9 THR HA 1 1 6 3877 1 1 9 THR HB H -2.506 4.131 -6.995 1.00 . A A . 9 THR HB 1 1 6 3878 1 1 9 THR HG1 H -3.083 3.500 -4.753 1.00 . A A . 9 THR HG1 1 1 6 3879 1 1 9 THR HG21 H -5.104 2.636 -6.414 1.00 . A A . 9 THR HG21 1 1 6 3880 1 1 9 THR HG22 H -4.767 4.339 -6.024 1.00 . A A . 9 THR HG22 1 1 6 3881 1 1 9 THR HG23 H -4.842 3.814 -7.714 1.00 . A A . 9 THR HG23 1 1 6 3882 1 1 9 THR N N -3.038 0.836 -6.933 1.00 . A A . 9 THR N 1 1 6 3883 1 1 9 THR O O -0.728 2.228 -8.997 1.00 . A A . 9 THR O 1 1 6 3884 1 1 9 THR OG1 O -2.656 2.885 -5.361 1.00 . A A . 9 THR OG1 1 1 6 3885 1 1 10 TRP C C 1.463 0.478 -7.415 1.00 . A A . 10 TRP C 1 1 6 3886 1 1 10 TRP CA C 1.014 1.812 -6.798 1.00 . A A . 10 TRP CA 1 1 6 3887 1 1 10 TRP CB C 1.517 2.000 -5.358 1.00 . A A . 10 TRP CB 1 1 6 3888 1 1 10 TRP CD1 C 4.028 1.838 -5.722 1.00 . A A . 10 TRP CD1 1 1 6 3889 1 1 10 TRP CD2 C 3.440 3.668 -4.570 1.00 . A A . 10 TRP CD2 1 1 6 3890 1 1 10 TRP CE2 C 4.838 3.761 -4.822 1.00 . A A . 10 TRP CE2 1 1 6 3891 1 1 10 TRP CE3 C 2.857 4.706 -3.810 1.00 . A A . 10 TRP CE3 1 1 6 3892 1 1 10 TRP CG C 2.938 2.463 -5.223 1.00 . A A . 10 TRP CG 1 1 6 3893 1 1 10 TRP CH2 C 4.988 5.886 -3.680 1.00 . A A . 10 TRP CH2 1 1 6 3894 1 1 10 TRP CZ2 C 5.605 4.852 -4.396 1.00 . A A . 10 TRP CZ2 1 1 6 3895 1 1 10 TRP CZ3 C 3.612 5.816 -3.382 1.00 . A A . 10 TRP CZ3 1 1 6 3896 1 1 10 TRP H H -0.928 1.845 -5.905 1.00 . A A . 10 TRP H 1 1 6 3897 1 1 10 TRP HA H 1.399 2.634 -7.404 1.00 . A A . 10 TRP HA 1 1 6 3898 1 1 10 TRP HB2 H 0.900 2.765 -4.885 1.00 . A A . 10 TRP HB2 1 1 6 3899 1 1 10 TRP HB3 H 1.367 1.075 -4.800 1.00 . A A . 10 TRP HB3 1 1 6 3900 1 1 10 TRP HD1 H 4.033 0.905 -6.266 1.00 . A A . 10 TRP HD1 1 1 6 3901 1 1 10 TRP HE1 H 6.088 2.371 -5.812 1.00 . A A . 10 TRP HE1 1 1 6 3902 1 1 10 TRP HE3 H 1.809 4.646 -3.560 1.00 . A A . 10 TRP HE3 1 1 6 3903 1 1 10 TRP HH2 H 5.587 6.728 -3.384 1.00 . A A . 10 TRP HH2 1 1 6 3904 1 1 10 TRP HZ2 H 6.646 4.915 -4.665 1.00 . A A . 10 TRP HZ2 1 1 6 3905 1 1 10 TRP HZ3 H 3.116 6.621 -2.846 1.00 . A A . 10 TRP HZ3 1 1 6 3906 1 1 10 TRP N N -0.434 1.887 -6.788 1.00 . A A . 10 TRP N 1 1 6 3907 1 1 10 TRP NE1 N 5.148 2.608 -5.508 1.00 . A A . 10 TRP NE1 1 1 6 3908 1 1 10 TRP O O 2.151 -0.314 -6.772 1.00 . A A . 10 TRP O 1 1 6 3909 1 1 11 SER C C 2.924 -0.934 -9.812 1.00 . A A . 11 SER C 1 1 6 3910 1 1 11 SER CA C 1.472 -1.025 -9.346 1.00 . A A . 11 SER CA 1 1 6 3911 1 1 11 SER CB C 0.507 -1.331 -10.498 1.00 . A A . 11 SER CB 1 1 6 3912 1 1 11 SER H H 0.515 0.879 -9.157 1.00 . A A . 11 SER H 1 1 6 3913 1 1 11 SER HA H 1.425 -1.848 -8.632 1.00 . A A . 11 SER HA 1 1 6 3914 1 1 11 SER HB2 H 0.365 -0.452 -11.131 1.00 . A A . 11 SER HB2 1 1 6 3915 1 1 11 SER HB3 H 0.931 -2.128 -11.111 1.00 . A A . 11 SER HB3 1 1 6 3916 1 1 11 SER HG H -1.243 -1.075 -9.602 1.00 . A A . 11 SER HG 1 1 6 3917 1 1 11 SER N N 1.083 0.200 -8.662 1.00 . A A . 11 SER N 1 1 6 3918 1 1 11 SER O O 3.206 -0.850 -11.003 1.00 . A A . 11 SER O 1 1 6 3919 1 1 11 SER OG O -0.728 -1.796 -9.989 1.00 . A A . 11 SER OG 1 1 6 3920 1 1 12 GLY C C 5.965 -1.363 -7.767 1.00 . A A . 12 GLY C 1 1 6 3921 1 1 12 GLY CA C 5.274 -0.984 -9.071 1.00 . A A . 12 GLY CA 1 1 6 3922 1 1 12 GLY H H 3.519 -1.005 -7.885 1.00 . A A . 12 GLY H 1 1 6 3923 1 1 12 GLY HA2 H 5.531 -1.713 -9.841 1.00 . A A . 12 GLY HA2 1 1 6 3924 1 1 12 GLY HA3 H 5.590 0.010 -9.391 1.00 . A A . 12 GLY HA3 1 1 6 3925 1 1 12 GLY N N 3.842 -0.976 -8.848 1.00 . A A . 12 GLY N 1 1 6 3926 1 1 12 GLY O O 5.359 -2.024 -6.913 1.00 . A A . 12 GLY O 1 1 6 3927 1 1 13 ASN C C 7.707 0.255 -5.547 1.00 . A A . 13 ASN C 1 1 6 3928 1 1 13 ASN CA C 7.937 -1.030 -6.347 1.00 . A A . 13 ASN CA 1 1 6 3929 1 1 13 ASN CB C 9.429 -1.278 -6.594 1.00 . A A . 13 ASN CB 1 1 6 3930 1 1 13 ASN CG C 10.170 -1.663 -5.310 1.00 . A A . 13 ASN CG 1 1 6 3931 1 1 13 ASN H H 7.622 -0.340 -8.322 1.00 . A A . 13 ASN H 1 1 6 3932 1 1 13 ASN HA H 7.548 -1.887 -5.807 1.00 . A A . 13 ASN HA 1 1 6 3933 1 1 13 ASN HB2 H 9.534 -2.102 -7.299 1.00 . A A . 13 ASN HB2 1 1 6 3934 1 1 13 ASN HB3 H 9.887 -0.390 -7.031 1.00 . A A . 13 ASN HB3 1 1 6 3935 1 1 13 ASN HD21 H 10.403 0.299 -4.697 1.00 . A A . 13 ASN HD21 1 1 6 3936 1 1 13 ASN HD22 H 11.151 -0.925 -3.709 1.00 . A A . 13 ASN HD22 1 1 6 3937 1 1 13 ASN N N 7.217 -0.927 -7.606 1.00 . A A . 13 ASN N 1 1 6 3938 1 1 13 ASN ND2 N 10.609 -0.685 -4.522 1.00 . A A . 13 ASN ND2 1 1 6 3939 1 1 13 ASN O O 7.517 1.320 -6.132 1.00 . A A . 13 ASN O 1 1 6 3940 1 1 13 ASN OD1 O 10.357 -2.847 -5.026 1.00 . A A . 13 ASN OD1 1 1 6 3941 1 1 14 CYS C C 8.713 2.304 -3.585 1.00 . A A . 14 CYS C 1 1 6 3942 1 1 14 CYS CA C 7.615 1.278 -3.299 1.00 . A A . 14 CYS CA 1 1 6 3943 1 1 14 CYS CB C 7.765 0.760 -1.869 1.00 . A A . 14 CYS CB 1 1 6 3944 1 1 14 CYS H H 7.893 -0.752 -3.826 1.00 . A A . 14 CYS H 1 1 6 3945 1 1 14 CYS HA H 6.635 1.744 -3.401 1.00 . A A . 14 CYS HA 1 1 6 3946 1 1 14 CYS HB2 H 6.984 0.027 -1.670 1.00 . A A . 14 CYS HB2 1 1 6 3947 1 1 14 CYS HB3 H 8.737 0.279 -1.787 1.00 . A A . 14 CYS HB3 1 1 6 3948 1 1 14 CYS N N 7.710 0.159 -4.221 1.00 . A A . 14 CYS N 1 1 6 3949 1 1 14 CYS O O 9.796 1.943 -4.045 1.00 . A A . 14 CYS O 1 1 6 3950 1 1 14 CYS SG S 7.699 2.040 -0.592 1.00 . A A . 14 CYS SG 1 1 6 3951 1 1 15 GLY C C 9.536 5.231 -1.919 1.00 . A A . 15 GLY C 1 1 6 3952 1 1 15 GLY CA C 9.354 4.682 -3.329 1.00 . A A . 15 GLY CA 1 1 6 3953 1 1 15 GLY H H 7.504 3.739 -2.896 1.00 . A A . 15 GLY H 1 1 6 3954 1 1 15 GLY HA2 H 10.322 4.371 -3.709 1.00 . A A . 15 GLY HA2 1 1 6 3955 1 1 15 GLY HA3 H 8.963 5.468 -3.974 1.00 . A A . 15 GLY HA3 1 1 6 3956 1 1 15 GLY N N 8.416 3.570 -3.289 1.00 . A A . 15 GLY N 1 1 6 3957 1 1 15 GLY O O 10.651 5.347 -1.423 1.00 . A A . 15 GLY O 1 1 6 3958 1 1 16 ASN C C 7.044 5.585 0.754 1.00 . A A . 16 ASN C 1 1 6 3959 1 1 16 ASN CA C 8.381 5.967 0.129 1.00 . A A . 16 ASN CA 1 1 6 3960 1 1 16 ASN CB C 8.638 7.476 0.241 1.00 . A A . 16 ASN CB 1 1 6 3961 1 1 16 ASN CG C 8.942 7.897 1.675 1.00 . A A . 16 ASN CG 1 1 6 3962 1 1 16 ASN H H 7.537 5.418 -1.738 1.00 . A A . 16 ASN H 1 1 6 3963 1 1 16 ASN HA H 9.182 5.446 0.659 1.00 . A A . 16 ASN HA 1 1 6 3964 1 1 16 ASN HB2 H 9.508 7.730 -0.367 1.00 . A A . 16 ASN HB2 1 1 6 3965 1 1 16 ASN HB3 H 7.779 8.040 -0.122 1.00 . A A . 16 ASN HB3 1 1 6 3966 1 1 16 ASN HD21 H 10.068 9.478 1.054 1.00 . A A . 16 ASN HD21 1 1 6 3967 1 1 16 ASN HD22 H 9.910 9.268 2.784 1.00 . A A . 16 ASN HD22 1 1 6 3968 1 1 16 ASN N N 8.416 5.545 -1.264 1.00 . A A . 16 ASN N 1 1 6 3969 1 1 16 ASN ND2 N 9.688 8.982 1.845 1.00 . A A . 16 ASN ND2 1 1 6 3970 1 1 16 ASN O O 5.986 5.933 0.225 1.00 . A A . 16 ASN O 1 1 6 3971 1 1 16 ASN OD1 O 8.488 7.269 2.628 1.00 . A A . 16 ASN OD1 1 1 6 3972 1 1 17 THR C C 5.074 5.771 3.021 1.00 . A A . 17 THR C 1 1 6 3973 1 1 17 THR CA C 5.896 4.528 2.653 1.00 . A A . 17 THR CA 1 1 6 3974 1 1 17 THR CB C 6.306 3.659 3.852 1.00 . A A . 17 THR CB 1 1 6 3975 1 1 17 THR CG2 C 6.968 4.443 4.991 1.00 . A A . 17 THR CG2 1 1 6 3976 1 1 17 THR H H 7.987 4.694 2.298 1.00 . A A . 17 THR H 1 1 6 3977 1 1 17 THR HA H 5.295 3.901 2.000 1.00 . A A . 17 THR HA 1 1 6 3978 1 1 17 THR HB H 7.027 2.926 3.493 1.00 . A A . 17 THR HB 1 1 6 3979 1 1 17 THR HG1 H 4.608 3.543 4.796 1.00 . A A . 17 THR HG1 1 1 6 3980 1 1 17 THR HG21 H 7.827 5.002 4.616 1.00 . A A . 17 THR HG21 1 1 6 3981 1 1 17 THR HG22 H 6.263 5.134 5.451 1.00 . A A . 17 THR HG22 1 1 6 3982 1 1 17 THR HG23 H 7.313 3.743 5.752 1.00 . A A . 17 THR HG23 1 1 6 3983 1 1 17 THR N N 7.084 4.898 1.897 1.00 . A A . 17 THR N 1 1 6 3984 1 1 17 THR O O 3.840 5.751 3.003 1.00 . A A . 17 THR O 1 1 6 3985 1 1 17 THR OG1 O 5.198 2.933 4.345 1.00 . A A . 17 THR OG1 1 1 6 3986 1 1 18 ALA C C 4.347 8.699 2.395 1.00 . A A . 18 ALA C 1 1 6 3987 1 1 18 ALA CA C 5.143 8.161 3.587 1.00 . A A . 18 ALA CA 1 1 6 3988 1 1 18 ALA CB C 6.211 9.169 4.024 1.00 . A A . 18 ALA CB 1 1 6 3989 1 1 18 ALA H H 6.780 6.850 3.264 1.00 . A A . 18 ALA H 1 1 6 3990 1 1 18 ALA HA H 4.449 8.023 4.417 1.00 . A A . 18 ALA HA 1 1 6 3991 1 1 18 ALA HB1 H 6.785 8.761 4.858 1.00 . A A . 18 ALA HB1 1 1 6 3992 1 1 18 ALA HB2 H 6.885 9.388 3.196 1.00 . A A . 18 ALA HB2 1 1 6 3993 1 1 18 ALA HB3 H 5.733 10.094 4.346 1.00 . A A . 18 ALA HB3 1 1 6 3994 1 1 18 ALA N N 5.765 6.882 3.295 1.00 . A A . 18 ALA N 1 1 6 3995 1 1 18 ALA O O 3.507 9.578 2.590 1.00 . A A . 18 ALA O 1 1 6 3996 1 1 19 HIS C C 2.712 7.368 -0.117 1.00 . A A . 19 HIS C 1 1 6 3997 1 1 19 HIS CA C 3.765 8.472 0.011 1.00 . A A . 19 HIS CA 1 1 6 3998 1 1 19 HIS CB C 4.613 8.595 -1.259 1.00 . A A . 19 HIS CB 1 1 6 3999 1 1 19 HIS CD2 C 2.611 9.659 -2.566 1.00 . A A . 19 HIS CD2 1 1 6 4000 1 1 19 HIS CE1 C 3.508 9.662 -4.559 1.00 . A A . 19 HIS CE1 1 1 6 4001 1 1 19 HIS CG C 3.881 9.142 -2.467 1.00 . A A . 19 HIS CG 1 1 6 4002 1 1 19 HIS H H 5.314 7.497 1.075 1.00 . A A . 19 HIS H 1 1 6 4003 1 1 19 HIS HA H 3.253 9.423 0.156 1.00 . A A . 19 HIS HA 1 1 6 4004 1 1 19 HIS HB2 H 5.444 9.264 -1.069 1.00 . A A . 19 HIS HB2 1 1 6 4005 1 1 19 HIS HB3 H 5.025 7.616 -1.481 1.00 . A A . 19 HIS HB3 1 1 6 4006 1 1 19 HIS HD1 H 5.383 8.893 -3.994 1.00 . A A . 19 HIS HD1 1 1 6 4007 1 1 19 HIS HD2 H 1.899 9.765 -1.760 1.00 . A A . 19 HIS HD2 1 1 6 4008 1 1 19 HIS HE1 H 3.631 9.774 -5.628 1.00 . A A . 19 HIS HE1 1 1 6 4009 1 1 19 HIS N N 4.612 8.220 1.171 1.00 . A A . 19 HIS N 1 1 6 4010 1 1 19 HIS ND1 N 4.452 9.188 -3.731 1.00 . A A . 19 HIS ND1 1 1 6 4011 1 1 19 HIS NE2 N 2.383 9.969 -3.894 1.00 . A A . 19 HIS NE2 1 1 6 4012 1 1 19 HIS O O 1.544 7.673 -0.342 1.00 . A A . 19 HIS O 1 1 6 4013 1 1 20 CYS C C 0.922 5.165 0.681 1.00 . A A . 20 CYS C 1 1 6 4014 1 1 20 CYS CA C 2.225 4.935 -0.076 1.00 . A A . 20 CYS CA 1 1 6 4015 1 1 20 CYS CB C 2.893 3.697 0.521 1.00 . A A . 20 CYS CB 1 1 6 4016 1 1 20 CYS H H 4.109 5.923 0.163 1.00 . A A . 20 CYS H 1 1 6 4017 1 1 20 CYS HA H 1.989 4.746 -1.120 1.00 . A A . 20 CYS HA 1 1 6 4018 1 1 20 CYS HB2 H 3.764 3.425 -0.072 1.00 . A A . 20 CYS HB2 1 1 6 4019 1 1 20 CYS HB3 H 3.202 3.909 1.536 1.00 . A A . 20 CYS HB3 1 1 6 4020 1 1 20 CYS N N 3.119 6.096 0.011 1.00 . A A . 20 CYS N 1 1 6 4021 1 1 20 CYS O O -0.171 5.010 0.135 1.00 . A A . 20 CYS O 1 1 6 4022 1 1 20 CYS SG S 1.784 2.281 0.677 1.00 . A A . 20 CYS SG 1 1 6 4023 1 1 21 ASP C C -0.984 6.896 2.199 1.00 . A A . 21 ASP C 1 1 6 4024 1 1 21 ASP CA C -0.086 5.805 2.796 1.00 . A A . 21 ASP CA 1 1 6 4025 1 1 21 ASP CB C 0.410 6.257 4.172 1.00 . A A . 21 ASP CB 1 1 6 4026 1 1 21 ASP CG C -0.773 6.711 5.012 1.00 . A A . 21 ASP CG 1 1 6 4027 1 1 21 ASP H H 1.999 5.701 2.315 1.00 . A A . 21 ASP H 1 1 6 4028 1 1 21 ASP HA H -0.648 4.865 2.902 1.00 . A A . 21 ASP HA 1 1 6 4029 1 1 21 ASP HB2 H 0.924 5.439 4.676 1.00 . A A . 21 ASP HB2 1 1 6 4030 1 1 21 ASP HB3 H 1.104 7.091 4.063 1.00 . A A . 21 ASP HB3 1 1 6 4031 1 1 21 ASP N N 1.061 5.599 1.933 1.00 . A A . 21 ASP N 1 1 6 4032 1 1 21 ASP O O -2.203 6.742 2.168 1.00 . A A . 21 ASP O 1 1 6 4033 1 1 21 ASP OD1 O -1.634 5.886 5.301 1.00 . A A . 21 ASP OD1 1 1 6 4034 1 1 21 ASP OD2 O -0.811 8.033 5.328 1.00 . A A . 21 ASP OD2 1 1 6 4035 1 1 22 LYS C C -1.935 8.489 -0.073 1.00 . A A . 22 LYS C 1 1 6 4036 1 1 22 LYS CA C -1.138 9.060 1.081 1.00 . A A . 22 LYS CA 1 1 6 4037 1 1 22 LYS CB C -0.264 10.211 0.574 1.00 . A A . 22 LYS CB 1 1 6 4038 1 1 22 LYS CD C 1.314 12.057 1.259 1.00 . A A . 22 LYS CD 1 1 6 4039 1 1 22 LYS CE C 1.914 12.845 2.434 1.00 . A A . 22 LYS CE 1 1 6 4040 1 1 22 LYS CG C 0.552 10.801 1.709 1.00 . A A . 22 LYS CG 1 1 6 4041 1 1 22 LYS H H 0.627 7.983 1.618 1.00 . A A . 22 LYS H 1 1 6 4042 1 1 22 LYS HA H -1.825 9.469 1.823 1.00 . A A . 22 LYS HA 1 1 6 4043 1 1 22 LYS HB2 H 0.393 9.870 -0.217 1.00 . A A . 22 LYS HB2 1 1 6 4044 1 1 22 LYS HB3 H -0.917 10.983 0.164 1.00 . A A . 22 LYS HB3 1 1 6 4045 1 1 22 LYS HD2 H 2.106 11.762 0.570 1.00 . A A . 22 LYS HD2 1 1 6 4046 1 1 22 LYS HD3 H 0.630 12.721 0.724 1.00 . A A . 22 LYS HD3 1 1 6 4047 1 1 22 LYS HE2 H 2.618 13.580 2.038 1.00 . A A . 22 LYS HE2 1 1 6 4048 1 1 22 LYS HE3 H 1.115 13.383 2.951 1.00 . A A . 22 LYS HE3 1 1 6 4049 1 1 22 LYS HG2 H -0.137 11.020 2.522 1.00 . A A . 22 LYS HG2 1 1 6 4050 1 1 22 LYS HG3 H 1.243 10.018 1.999 1.00 . A A . 22 LYS HG3 1 1 6 4051 1 1 22 LYS HZ1 H 2.408 10.986 3.182 1.00 . A A . 22 LYS HZ1 1 1 6 4052 1 1 22 LYS HZ2 H 3.617 12.141 3.361 1.00 . A A . 22 LYS HZ2 1 1 6 4053 1 1 22 LYS N N -0.379 7.988 1.712 1.00 . A A . 22 LYS N 1 1 6 4054 1 1 22 LYS NZ N 2.602 11.973 3.407 1.00 . A A . 22 LYS NZ 1 1 6 4055 1 1 22 LYS O O -3.142 8.681 -0.122 1.00 . A A . 22 LYS O 1 1 6 4056 1 1 23 GLN C C -3.186 6.354 -1.636 1.00 . A A . 23 GLN C 1 1 6 4057 1 1 23 GLN CA C -1.994 7.189 -2.116 1.00 . A A . 23 GLN CA 1 1 6 4058 1 1 23 GLN CB C -1.112 6.422 -3.104 1.00 . A A . 23 GLN CB 1 1 6 4059 1 1 23 GLN CD C 0.626 7.005 -4.895 1.00 . A A . 23 GLN CD 1 1 6 4060 1 1 23 GLN CG C 0.140 7.226 -3.470 1.00 . A A . 23 GLN CG 1 1 6 4061 1 1 23 GLN H H -0.280 7.621 -0.847 1.00 . A A . 23 GLN H 1 1 6 4062 1 1 23 GLN HA H -2.347 8.032 -2.698 1.00 . A A . 23 GLN HA 1 1 6 4063 1 1 23 GLN HB2 H -0.815 5.459 -2.687 1.00 . A A . 23 GLN HB2 1 1 6 4064 1 1 23 GLN HB3 H -1.721 6.254 -3.993 1.00 . A A . 23 GLN HB3 1 1 6 4065 1 1 23 GLN HE21 H -0.140 5.111 -4.996 1.00 . A A . 23 GLN HE21 1 1 6 4066 1 1 23 GLN HE22 H 0.700 5.713 -6.411 1.00 . A A . 23 GLN HE22 1 1 6 4067 1 1 23 GLN HG2 H -0.082 8.289 -3.400 1.00 . A A . 23 GLN HG2 1 1 6 4068 1 1 23 GLN HG3 H 0.937 6.969 -2.782 1.00 . A A . 23 GLN HG3 1 1 6 4069 1 1 23 GLN N N -1.274 7.775 -0.991 1.00 . A A . 23 GLN N 1 1 6 4070 1 1 23 GLN NE2 N 0.368 5.840 -5.474 1.00 . A A . 23 GLN NE2 1 1 6 4071 1 1 23 GLN O O -4.322 6.584 -2.045 1.00 . A A . 23 GLN O 1 1 6 4072 1 1 23 GLN OE1 O 1.242 7.895 -5.473 1.00 . A A . 23 GLN OE1 1 1 6 4073 1 1 24 CYS C C -5.157 5.263 0.390 1.00 . A A . 24 CYS C 1 1 6 4074 1 1 24 CYS CA C -3.971 4.512 -0.234 1.00 . A A . 24 CYS CA 1 1 6 4075 1 1 24 CYS CB C -3.358 3.539 0.774 1.00 . A A . 24 CYS CB 1 1 6 4076 1 1 24 CYS H H -1.978 5.277 -0.410 1.00 . A A . 24 CYS H 1 1 6 4077 1 1 24 CYS HA H -4.367 3.957 -1.088 1.00 . A A . 24 CYS HA 1 1 6 4078 1 1 24 CYS HB2 H -2.865 4.106 1.563 1.00 . A A . 24 CYS HB2 1 1 6 4079 1 1 24 CYS HB3 H -4.150 2.947 1.222 1.00 . A A . 24 CYS HB3 1 1 6 4080 1 1 24 CYS N N -2.936 5.410 -0.731 1.00 . A A . 24 CYS N 1 1 6 4081 1 1 24 CYS O O -6.302 4.838 0.238 1.00 . A A . 24 CYS O 1 1 6 4082 1 1 24 CYS SG S -2.177 2.343 0.110 1.00 . A A . 24 CYS SG 1 1 6 4083 1 1 25 GLN C C -6.665 8.081 0.675 1.00 . A A . 25 GLN C 1 1 6 4084 1 1 25 GLN CA C -6.000 7.144 1.701 1.00 . A A . 25 GLN CA 1 1 6 4085 1 1 25 GLN CB C -5.469 7.912 2.919 1.00 . A A . 25 GLN CB 1 1 6 4086 1 1 25 GLN CD C -4.355 7.707 5.170 1.00 . A A . 25 GLN CD 1 1 6 4087 1 1 25 GLN CG C -4.952 6.950 3.991 1.00 . A A . 25 GLN CG 1 1 6 4088 1 1 25 GLN H H -3.952 6.659 1.254 1.00 . A A . 25 GLN H 1 1 6 4089 1 1 25 GLN HA H -6.763 6.460 2.079 1.00 . A A . 25 GLN HA 1 1 6 4090 1 1 25 GLN HB2 H -4.660 8.578 2.630 1.00 . A A . 25 GLN HB2 1 1 6 4091 1 1 25 GLN HB3 H -6.276 8.502 3.356 1.00 . A A . 25 GLN HB3 1 1 6 4092 1 1 25 GLN HE21 H -5.560 6.718 6.461 1.00 . A A . 25 GLN HE21 1 1 6 4093 1 1 25 GLN HE22 H -4.499 7.924 7.180 1.00 . A A . 25 GLN HE22 1 1 6 4094 1 1 25 GLN HG2 H -5.782 6.327 4.327 1.00 . A A . 25 GLN HG2 1 1 6 4095 1 1 25 GLN HG3 H -4.181 6.301 3.584 1.00 . A A . 25 GLN HG3 1 1 6 4096 1 1 25 GLN N N -4.915 6.369 1.099 1.00 . A A . 25 GLN N 1 1 6 4097 1 1 25 GLN NE2 N -4.848 7.438 6.371 1.00 . A A . 25 GLN NE2 1 1 6 4098 1 1 25 GLN O O -7.877 8.300 0.703 1.00 . A A . 25 GLN O 1 1 6 4099 1 1 25 GLN OE1 O -3.448 8.520 5.014 1.00 . A A . 25 GLN OE1 1 1 6 4100 1 1 26 ASP C C -6.870 9.204 -2.410 1.00 . A A . 26 ASP C 1 1 6 4101 1 1 26 ASP CA C -6.259 9.749 -1.123 1.00 . A A . 26 ASP CA 1 1 6 4102 1 1 26 ASP CB C -5.067 10.653 -1.465 1.00 . A A . 26 ASP CB 1 1 6 4103 1 1 26 ASP CG C -4.510 11.431 -0.274 1.00 . A A . 26 ASP CG 1 1 6 4104 1 1 26 ASP H H -4.892 8.405 -0.202 1.00 . A A . 26 ASP H 1 1 6 4105 1 1 26 ASP HA H -7.006 10.377 -0.643 1.00 . A A . 26 ASP HA 1 1 6 4106 1 1 26 ASP HB2 H -4.271 10.057 -1.898 1.00 . A A . 26 ASP HB2 1 1 6 4107 1 1 26 ASP HB3 H -5.388 11.370 -2.219 1.00 . A A . 26 ASP HB3 1 1 6 4108 1 1 26 ASP N N -5.864 8.681 -0.210 1.00 . A A . 26 ASP N 1 1 6 4109 1 1 26 ASP O O -7.996 9.561 -2.754 1.00 . A A . 26 ASP O 1 1 6 4110 1 1 26 ASP OD1 O -5.386 11.748 0.719 1.00 . A A . 26 ASP OD1 1 1 6 4111 1 1 26 ASP OD2 O -3.324 11.743 -0.259 1.00 . A A . 26 ASP OD2 1 1 6 4112 1 1 27 TRP C C -7.524 6.801 -4.247 1.00 . A A . 27 TRP C 1 1 6 4113 1 1 27 TRP CA C -6.438 7.852 -4.440 1.00 . A A . 27 TRP CA 1 1 6 4114 1 1 27 TRP CB C -5.208 7.156 -5.044 1.00 . A A . 27 TRP CB 1 1 6 4115 1 1 27 TRP CD1 C -3.636 9.155 -4.996 1.00 . A A . 27 TRP CD1 1 1 6 4116 1 1 27 TRP CD2 C -3.183 7.729 -6.654 1.00 . A A . 27 TRP CD2 1 1 6 4117 1 1 27 TRP CE2 C -2.156 8.715 -6.665 1.00 . A A . 27 TRP CE2 1 1 6 4118 1 1 27 TRP CE3 C -3.138 6.739 -7.653 1.00 . A A . 27 TRP CE3 1 1 6 4119 1 1 27 TRP CG C -4.074 7.998 -5.537 1.00 . A A . 27 TRP CG 1 1 6 4120 1 1 27 TRP CH2 C -1.054 7.645 -8.537 1.00 . A A . 27 TRP CH2 1 1 6 4121 1 1 27 TRP CZ2 C -1.105 8.687 -7.596 1.00 . A A . 27 TRP CZ2 1 1 6 4122 1 1 27 TRP CZ3 C -2.080 6.685 -8.578 1.00 . A A . 27 TRP CZ3 1 1 6 4123 1 1 27 TRP H H -5.232 8.071 -2.701 1.00 . A A . 27 TRP H 1 1 6 4124 1 1 27 TRP HA H -6.783 8.639 -5.113 1.00 . A A . 27 TRP HA 1 1 6 4125 1 1 27 TRP HB2 H -4.786 6.436 -4.350 1.00 . A A . 27 TRP HB2 1 1 6 4126 1 1 27 TRP HB3 H -5.561 6.559 -5.880 1.00 . A A . 27 TRP HB3 1 1 6 4127 1 1 27 TRP HD1 H -4.073 9.644 -4.144 1.00 . A A . 27 TRP HD1 1 1 6 4128 1 1 27 TRP HE1 H -1.968 10.403 -5.403 1.00 . A A . 27 TRP HE1 1 1 6 4129 1 1 27 TRP HE3 H -3.946 6.029 -7.713 1.00 . A A . 27 TRP HE3 1 1 6 4130 1 1 27 TRP HH2 H -0.242 7.580 -9.242 1.00 . A A . 27 TRP HH2 1 1 6 4131 1 1 27 TRP HZ2 H -0.335 9.444 -7.580 1.00 . A A . 27 TRP HZ2 1 1 6 4132 1 1 27 TRP HZ3 H -2.056 5.905 -9.326 1.00 . A A . 27 TRP HZ3 1 1 6 4133 1 1 27 TRP N N -6.106 8.374 -3.120 1.00 . A A . 27 TRP N 1 1 6 4134 1 1 27 TRP NE1 N -2.492 9.575 -5.637 1.00 . A A . 27 TRP NE1 1 1 6 4135 1 1 27 TRP O O -8.611 6.877 -4.810 1.00 . A A . 27 TRP O 1 1 6 4136 1 1 28 GLU C C -8.852 5.486 -1.731 1.00 . A A . 28 GLU C 1 1 6 4137 1 1 28 GLU CA C -8.098 4.822 -2.889 1.00 . A A . 28 GLU CA 1 1 6 4138 1 1 28 GLU CB C -7.238 3.610 -2.500 1.00 . A A . 28 GLU CB 1 1 6 4139 1 1 28 GLU CD C -5.556 2.022 -3.475 1.00 . A A . 28 GLU CD 1 1 6 4140 1 1 28 GLU CG C -6.811 2.833 -3.749 1.00 . A A . 28 GLU CG 1 1 6 4141 1 1 28 GLU H H -6.282 5.908 -2.960 1.00 . A A . 28 GLU H 1 1 6 4142 1 1 28 GLU HA H -8.827 4.528 -3.646 1.00 . A A . 28 GLU HA 1 1 6 4143 1 1 28 GLU HB2 H -6.344 3.982 -2.011 1.00 . A A . 28 GLU HB2 1 1 6 4144 1 1 28 GLU HB3 H -7.719 2.924 -1.813 1.00 . A A . 28 GLU HB3 1 1 6 4145 1 1 28 GLU HG2 H -7.622 2.173 -4.065 1.00 . A A . 28 GLU HG2 1 1 6 4146 1 1 28 GLU HG3 H -6.593 3.522 -4.562 1.00 . A A . 28 GLU HG3 1 1 6 4147 1 1 28 GLU N N -7.183 5.818 -3.413 1.00 . A A . 28 GLU N 1 1 6 4148 1 1 28 GLU O O -9.015 6.702 -1.726 1.00 . A A . 28 GLU O 1 1 6 4149 1 1 28 GLU OE1 O -4.404 2.738 -3.392 1.00 . A A . 28 GLU OE1 1 1 6 4150 1 1 28 GLU OE2 O -5.627 0.803 -3.348 1.00 . A A . 28 GLU OE2 1 1 6 4151 1 1 29 LYS C C -9.787 4.063 1.492 1.00 . A A . 29 LYS C 1 1 6 4152 1 1 29 LYS CA C -9.989 5.167 0.458 1.00 . A A . 29 LYS CA 1 1 6 4153 1 1 29 LYS CB C -11.491 5.388 0.162 1.00 . A A . 29 LYS CB 1 1 6 4154 1 1 29 LYS CD C -11.666 7.933 0.317 1.00 . A A . 29 LYS CD 1 1 6 4155 1 1 29 LYS CE C -11.288 9.177 -0.500 1.00 . A A . 29 LYS CE 1 1 6 4156 1 1 29 LYS CG C -11.876 6.685 -0.564 1.00 . A A . 29 LYS CG 1 1 6 4157 1 1 29 LYS H H -9.007 3.766 -0.687 1.00 . A A . 29 LYS H 1 1 6 4158 1 1 29 LYS HA H -9.494 6.053 0.827 1.00 . A A . 29 LYS HA 1 1 6 4159 1 1 29 LYS HB2 H -11.856 4.537 -0.417 1.00 . A A . 29 LYS HB2 1 1 6 4160 1 1 29 LYS HB3 H -12.030 5.395 1.110 1.00 . A A . 29 LYS HB3 1 1 6 4161 1 1 29 LYS HD2 H -12.597 8.128 0.853 1.00 . A A . 29 LYS HD2 1 1 6 4162 1 1 29 LYS HD3 H -10.896 7.756 1.069 1.00 . A A . 29 LYS HD3 1 1 6 4163 1 1 29 LYS HE2 H -11.981 9.299 -1.334 1.00 . A A . 29 LYS HE2 1 1 6 4164 1 1 29 LYS HE3 H -11.360 10.055 0.143 1.00 . A A . 29 LYS HE3 1 1 6 4165 1 1 29 LYS HG2 H -11.357 6.747 -1.515 1.00 . A A . 29 LYS HG2 1 1 6 4166 1 1 29 LYS HG3 H -12.941 6.627 -0.802 1.00 . A A . 29 LYS HG3 1 1 6 4167 1 1 29 LYS HZ1 H -9.712 8.113 -1.295 1.00 . A A . 29 LYS HZ1 1 1 6 4168 1 1 29 LYS HZ2 H -9.790 9.712 -1.811 1.00 . A A . 29 LYS HZ2 1 1 6 4169 1 1 29 LYS N N -9.255 4.731 -0.712 1.00 . A A . 29 LYS N 1 1 6 4170 1 1 29 LYS NZ N -9.905 9.082 -1.004 1.00 . A A . 29 LYS NZ 1 1 6 4171 1 1 29 LYS O O -10.721 3.527 2.084 1.00 . A A . 29 LYS O 1 1 6 4172 1 1 30 ALA C C -8.013 3.547 4.024 1.00 . A A . 30 ALA C 1 1 6 4173 1 1 30 ALA CA C -8.074 2.801 2.698 1.00 . A A . 30 ALA CA 1 1 6 4174 1 1 30 ALA CB C -6.696 2.281 2.304 1.00 . A A . 30 ALA CB 1 1 6 4175 1 1 30 ALA H H -7.796 4.221 1.161 1.00 . A A . 30 ALA H 1 1 6 4176 1 1 30 ALA HA H -8.766 1.966 2.778 1.00 . A A . 30 ALA HA 1 1 6 4177 1 1 30 ALA HB1 H -6.724 1.910 1.279 1.00 . A A . 30 ALA HB1 1 1 6 4178 1 1 30 ALA HB2 H -5.981 3.097 2.387 1.00 . A A . 30 ALA HB2 1 1 6 4179 1 1 30 ALA HB3 H -6.394 1.478 2.967 1.00 . A A . 30 ALA HB3 1 1 6 4180 1 1 30 ALA N N -8.513 3.716 1.671 1.00 . A A . 30 ALA N 1 1 6 4181 1 1 30 ALA O O -7.886 4.770 4.051 1.00 . A A . 30 ALA O 1 1 6 4182 1 1 31 SER C C -6.364 3.933 6.464 1.00 . A A . 31 SER C 1 1 6 4183 1 1 31 SER CA C -7.773 3.333 6.442 1.00 . A A . 31 SER CA 1 1 6 4184 1 1 31 SER CB C -7.934 2.172 7.417 1.00 . A A . 31 SER CB 1 1 6 4185 1 1 31 SER H H -8.085 1.800 5.103 1.00 . A A . 31 SER H 1 1 6 4186 1 1 31 SER HA H -8.501 4.098 6.694 1.00 . A A . 31 SER HA 1 1 6 4187 1 1 31 SER HB2 H -7.102 1.484 7.303 1.00 . A A . 31 SER HB2 1 1 6 4188 1 1 31 SER HB3 H -7.894 2.573 8.419 1.00 . A A . 31 SER HB3 1 1 6 4189 1 1 31 SER HG H -9.858 2.146 7.105 1.00 . A A . 31 SER HG 1 1 6 4190 1 1 31 SER N N -8.050 2.811 5.131 1.00 . A A . 31 SER N 1 1 6 4191 1 1 31 SER O O -6.171 5.044 6.950 1.00 . A A . 31 SER O 1 1 6 4192 1 1 31 SER OG O -9.159 1.488 7.174 1.00 . A A . 31 SER OG 1 1 6 4193 1 1 32 HIS C C -3.331 2.902 4.629 1.00 . A A . 32 HIS C 1 1 6 4194 1 1 32 HIS CA C -4.036 3.727 5.704 1.00 . A A . 32 HIS CA 1 1 6 4195 1 1 32 HIS CB C -3.242 3.729 7.026 1.00 . A A . 32 HIS CB 1 1 6 4196 1 1 32 HIS CD2 C -3.182 1.262 7.671 1.00 . A A . 32 HIS CD2 1 1 6 4197 1 1 32 HIS CE1 C -1.040 0.916 7.702 1.00 . A A . 32 HIS CE1 1 1 6 4198 1 1 32 HIS CG C -2.570 2.430 7.361 1.00 . A A . 32 HIS CG 1 1 6 4199 1 1 32 HIS H H -5.608 2.327 5.458 1.00 . A A . 32 HIS H 1 1 6 4200 1 1 32 HIS HA H -4.121 4.751 5.342 1.00 . A A . 32 HIS HA 1 1 6 4201 1 1 32 HIS HB2 H -2.452 4.452 6.987 1.00 . A A . 32 HIS HB2 1 1 6 4202 1 1 32 HIS HB3 H -3.892 4.023 7.852 1.00 . A A . 32 HIS HB3 1 1 6 4203 1 1 32 HIS HD1 H -0.474 2.836 7.013 1.00 . A A . 32 HIS HD1 1 1 6 4204 1 1 32 HIS HD2 H -4.241 1.165 7.589 1.00 . A A . 32 HIS HD2 1 1 6 4205 1 1 32 HIS HE1 H -0.089 0.412 7.771 1.00 . A A . 32 HIS HE1 1 1 6 4206 1 1 32 HIS N N -5.382 3.207 5.911 1.00 . A A . 32 HIS N 1 1 6 4207 1 1 32 HIS ND1 N -1.202 2.204 7.350 1.00 . A A . 32 HIS ND1 1 1 6 4208 1 1 32 HIS NE2 N -2.217 0.313 7.934 1.00 . A A . 32 HIS NE2 1 1 6 4209 1 1 32 HIS O O -3.896 1.927 4.128 1.00 . A A . 32 HIS O 1 1 6 4210 1 1 33 GLY C C 0.193 2.298 4.340 1.00 . A A . 33 GLY C 1 1 6 4211 1 1 33 GLY CA C -1.136 2.431 3.608 1.00 . A A . 33 GLY CA 1 1 6 4212 1 1 33 GLY H H -1.709 4.099 4.784 1.00 . A A . 33 GLY H 1 1 6 4213 1 1 33 GLY HA2 H -1.540 1.449 3.510 1.00 . A A . 33 GLY HA2 1 1 6 4214 1 1 33 GLY HA3 H -0.968 2.789 2.604 1.00 . A A . 33 GLY HA3 1 1 6 4215 1 1 33 GLY N N -2.075 3.259 4.348 1.00 . A A . 33 GLY N 1 1 6 4216 1 1 33 GLY O O 0.414 2.974 5.349 1.00 . A A . 33 GLY O 1 1 6 4217 1 1 34 ALA C C 3.123 0.190 3.417 1.00 . A A . 34 ALA C 1 1 6 4218 1 1 34 ALA CA C 2.371 1.116 4.387 1.00 . A A . 34 ALA CA 1 1 6 4219 1 1 34 ALA CB C 2.244 0.483 5.780 1.00 . A A . 34 ALA CB 1 1 6 4220 1 1 34 ALA H H 0.752 0.838 3.052 1.00 . A A . 34 ALA H 1 1 6 4221 1 1 34 ALA HA H 2.901 2.061 4.477 1.00 . A A . 34 ALA HA 1 1 6 4222 1 1 34 ALA HB1 H 1.583 -0.381 5.739 1.00 . A A . 34 ALA HB1 1 1 6 4223 1 1 34 ALA HB2 H 3.224 0.175 6.140 1.00 . A A . 34 ALA HB2 1 1 6 4224 1 1 34 ALA HB3 H 1.831 1.205 6.484 1.00 . A A . 34 ALA HB3 1 1 6 4225 1 1 34 ALA N N 1.045 1.391 3.856 1.00 . A A . 34 ALA N 1 1 6 4226 1 1 34 ALA O O 2.533 -0.766 2.910 1.00 . A A . 34 ALA O 1 1 6 4227 1 1 35 CYS C C 5.745 -1.602 2.963 1.00 . A A . 35 CYS C 1 1 6 4228 1 1 35 CYS CA C 5.207 -0.365 2.245 1.00 . A A . 35 CYS CA 1 1 6 4229 1 1 35 CYS CB C 6.375 0.443 1.686 1.00 . A A . 35 CYS CB 1 1 6 4230 1 1 35 CYS H H 4.876 1.252 3.556 1.00 . A A . 35 CYS H 1 1 6 4231 1 1 35 CYS HA H 4.596 -0.663 1.400 1.00 . A A . 35 CYS HA 1 1 6 4232 1 1 35 CYS HB2 H 6.920 0.930 2.492 1.00 . A A . 35 CYS HB2 1 1 6 4233 1 1 35 CYS HB3 H 7.059 -0.260 1.233 1.00 . A A . 35 CYS HB3 1 1 6 4234 1 1 35 CYS N N 4.406 0.455 3.139 1.00 . A A . 35 CYS N 1 1 6 4235 1 1 35 CYS O O 6.048 -1.536 4.156 1.00 . A A . 35 CYS O 1 1 6 4236 1 1 35 CYS SG S 5.922 1.638 0.406 1.00 . A A . 35 CYS SG 1 1 6 4237 1 1 36 HIS C C 7.246 -4.673 1.633 1.00 . A A . 36 HIS C 1 1 6 4238 1 1 36 HIS CA C 6.585 -3.912 2.768 1.00 . A A . 36 HIS CA 1 1 6 4239 1 1 36 HIS CB C 5.656 -4.905 3.463 1.00 . A A . 36 HIS CB 1 1 6 4240 1 1 36 HIS CD2 C 3.135 -4.498 3.649 1.00 . A A . 36 HIS CD2 1 1 6 4241 1 1 36 HIS CE1 C 3.151 -3.145 5.369 1.00 . A A . 36 HIS CE1 1 1 6 4242 1 1 36 HIS CG C 4.423 -4.309 4.054 1.00 . A A . 36 HIS CG 1 1 6 4243 1 1 36 HIS H H 5.595 -2.748 1.279 1.00 . A A . 36 HIS H 1 1 6 4244 1 1 36 HIS HA H 7.336 -3.598 3.487 1.00 . A A . 36 HIS HA 1 1 6 4245 1 1 36 HIS HB2 H 5.322 -5.646 2.733 1.00 . A A . 36 HIS HB2 1 1 6 4246 1 1 36 HIS HB3 H 6.214 -5.433 4.239 1.00 . A A . 36 HIS HB3 1 1 6 4247 1 1 36 HIS HD1 H 5.253 -2.937 5.478 1.00 . A A . 36 HIS HD1 1 1 6 4248 1 1 36 HIS HD2 H 2.852 -5.086 2.779 1.00 . A A . 36 HIS HD2 1 1 6 4249 1 1 36 HIS HE1 H 2.815 -2.478 6.151 1.00 . A A . 36 HIS HE1 1 1 6 4250 1 1 36 HIS N N 5.886 -2.732 2.257 1.00 . A A . 36 HIS N 1 1 6 4251 1 1 36 HIS ND1 N 4.436 -3.415 5.106 1.00 . A A . 36 HIS ND1 1 1 6 4252 1 1 36 HIS NE2 N 2.334 -3.805 4.532 1.00 . A A . 36 HIS NE2 1 1 6 4253 1 1 36 HIS O O 6.766 -4.623 0.502 1.00 . A A . 36 HIS O 1 1 6 4254 1 1 37 LYS C C 8.030 -7.682 0.960 1.00 . A A . 37 LYS C 1 1 6 4255 1 1 37 LYS CA C 8.861 -6.399 1.027 1.00 . A A . 37 LYS CA 1 1 6 4256 1 1 37 LYS CB C 10.314 -6.648 1.436 1.00 . A A . 37 LYS CB 1 1 6 4257 1 1 37 LYS CD C 12.442 -7.981 0.896 1.00 . A A . 37 LYS CD 1 1 6 4258 1 1 37 LYS CE C 13.628 -7.078 0.520 1.00 . A A . 37 LYS CE 1 1 6 4259 1 1 37 LYS CG C 11.098 -7.431 0.378 1.00 . A A . 37 LYS CG 1 1 6 4260 1 1 37 LYS H H 8.576 -5.499 2.922 1.00 . A A . 37 LYS H 1 1 6 4261 1 1 37 LYS HA H 8.904 -5.948 0.049 1.00 . A A . 37 LYS HA 1 1 6 4262 1 1 37 LYS HB2 H 10.797 -5.697 1.553 1.00 . A A . 37 LYS HB2 1 1 6 4263 1 1 37 LYS HB3 H 10.327 -7.125 2.407 1.00 . A A . 37 LYS HB3 1 1 6 4264 1 1 37 LYS HD2 H 12.399 -8.099 1.981 1.00 . A A . 37 LYS HD2 1 1 6 4265 1 1 37 LYS HD3 H 12.586 -8.976 0.483 1.00 . A A . 37 LYS HD3 1 1 6 4266 1 1 37 LYS HE2 H 13.432 -6.559 -0.419 1.00 . A A . 37 LYS HE2 1 1 6 4267 1 1 37 LYS HE3 H 13.752 -6.348 1.318 1.00 . A A . 37 LYS HE3 1 1 6 4268 1 1 37 LYS HG2 H 10.486 -8.270 0.097 1.00 . A A . 37 LYS HG2 1 1 6 4269 1 1 37 LYS HG3 H 11.214 -6.828 -0.526 1.00 . A A . 37 LYS HG3 1 1 6 4270 1 1 37 LYS HZ1 H 14.684 -8.833 0.234 1.00 . A A . 37 LYS HZ1 1 1 6 4271 1 1 37 LYS HZ2 H 15.378 -7.490 -0.503 1.00 . A A . 37 LYS HZ2 1 1 6 4272 1 1 37 LYS N N 8.249 -5.482 1.968 1.00 . A A . 37 LYS N 1 1 6 4273 1 1 37 LYS NZ N 14.893 -7.830 0.340 1.00 . A A . 37 LYS NZ 1 1 6 4274 1 1 37 LYS O O 7.573 -8.198 1.983 1.00 . A A . 37 LYS O 1 1 6 4275 1 1 38 ARG C C 7.949 -9.999 -1.789 1.00 . A A . 38 ARG C 1 1 6 4276 1 1 38 ARG CA C 7.202 -9.450 -0.576 1.00 . A A . 38 ARG CA 1 1 6 4277 1 1 38 ARG CB C 5.731 -9.239 -0.951 1.00 . A A . 38 ARG CB 1 1 6 4278 1 1 38 ARG CD C 4.586 -9.598 1.318 1.00 . A A . 38 ARG CD 1 1 6 4279 1 1 38 ARG CG C 4.844 -8.639 0.150 1.00 . A A . 38 ARG CG 1 1 6 4280 1 1 38 ARG CZ C 4.149 -8.470 3.518 1.00 . A A . 38 ARG CZ 1 1 6 4281 1 1 38 ARG H H 8.139 -7.630 -1.060 1.00 . A A . 38 ARG H 1 1 6 4282 1 1 38 ARG HA H 7.294 -10.143 0.262 1.00 . A A . 38 ARG HA 1 1 6 4283 1 1 38 ARG HB2 H 5.711 -8.560 -1.804 1.00 . A A . 38 ARG HB2 1 1 6 4284 1 1 38 ARG HB3 H 5.320 -10.199 -1.261 1.00 . A A . 38 ARG HB3 1 1 6 4285 1 1 38 ARG HD2 H 4.062 -10.474 0.932 1.00 . A A . 38 ARG HD2 1 1 6 4286 1 1 38 ARG HD3 H 5.526 -9.953 1.741 1.00 . A A . 38 ARG HD3 1 1 6 4287 1 1 38 ARG HG2 H 5.270 -7.702 0.508 1.00 . A A . 38 ARG HG2 1 1 6 4288 1 1 38 ARG HG3 H 3.881 -8.426 -0.310 1.00 . A A . 38 ARG HG3 1 1 6 4289 1 1 38 ARG HH11 H 6.147 -8.520 3.045 1.00 . A A . 38 ARG HH11 1 1 6 4290 1 1 38 ARG HH12 H 5.800 -8.101 4.693 1.00 . A A . 38 ARG HH12 1 1 6 4291 1 1 38 ARG HH21 H 2.254 -8.095 4.240 1.00 . A A . 38 ARG HH21 1 1 6 4292 1 1 38 ARG HH22 H 3.539 -7.772 5.351 1.00 . A A . 38 ARG HH22 1 1 6 4293 1 1 38 ARG N N 7.818 -8.172 -0.261 1.00 . A A . 38 ARG N 1 1 6 4294 1 1 38 ARG NE N 3.729 -8.970 2.343 1.00 . A A . 38 ARG NE 1 1 6 4295 1 1 38 ARG NH1 N 5.457 -8.354 3.779 1.00 . A A . 38 ARG NH1 1 1 6 4296 1 1 38 ARG NH2 N 3.255 -8.075 4.434 1.00 . A A . 38 ARG NH2 1 1 6 4297 1 1 38 ARG O O 8.115 -9.275 -2.767 1.00 . A A . 38 ARG O 1 1 6 4298 1 1 39 GLU C C 10.272 -10.930 -3.354 1.00 . A A . 39 GLU C 1 1 6 4299 1 1 39 GLU CA C 9.190 -11.873 -2.813 1.00 . A A . 39 GLU CA 1 1 6 4300 1 1 39 GLU CB C 8.224 -12.372 -3.900 1.00 . A A . 39 GLU CB 1 1 6 4301 1 1 39 GLU CD C 7.321 -14.100 -2.243 1.00 . A A . 39 GLU CD 1 1 6 4302 1 1 39 GLU CG C 6.983 -13.086 -3.332 1.00 . A A . 39 GLU CG 1 1 6 4303 1 1 39 GLU H H 8.165 -11.851 -0.962 1.00 . A A . 39 GLU H 1 1 6 4304 1 1 39 GLU HA H 9.709 -12.738 -2.395 1.00 . A A . 39 GLU HA 1 1 6 4305 1 1 39 GLU HB2 H 7.881 -11.526 -4.495 1.00 . A A . 39 GLU HB2 1 1 6 4306 1 1 39 GLU HB3 H 8.767 -13.056 -4.554 1.00 . A A . 39 GLU HB3 1 1 6 4307 1 1 39 GLU HG2 H 6.301 -12.346 -2.912 1.00 . A A . 39 GLU HG2 1 1 6 4308 1 1 39 GLU HG3 H 6.463 -13.594 -4.145 1.00 . A A . 39 GLU HG3 1 1 6 4309 1 1 39 GLU N N 8.432 -11.244 -1.733 1.00 . A A . 39 GLU N 1 1 6 4310 1 1 39 GLU O O 10.411 -10.734 -4.557 1.00 . A A . 39 GLU O 1 1 6 4311 1 1 39 GLU OE1 O 7.404 -13.717 -1.076 1.00 . A A . 39 GLU OE1 1 1 6 4312 1 1 39 GLU OE2 O 7.525 -15.381 -2.649 1.00 . A A . 39 GLU OE2 1 1 6 4313 1 1 40 ASN C C 11.562 -7.943 -3.138 1.00 . A A . 40 ASN C 1 1 6 4314 1 1 40 ASN CA C 12.046 -9.311 -2.629 1.00 . A A . 40 ASN CA 1 1 6 4315 1 1 40 ASN CB C 13.153 -9.884 -3.505 1.00 . A A . 40 ASN CB 1 1 6 4316 1 1 40 ASN CG C 14.439 -9.066 -3.381 1.00 . A A . 40 ASN CG 1 1 6 4317 1 1 40 ASN H H 10.853 -10.594 -1.484 1.00 . A A . 40 ASN H 1 1 6 4318 1 1 40 ASN HA H 12.475 -9.137 -1.648 1.00 . A A . 40 ASN HA 1 1 6 4319 1 1 40 ASN HB2 H 13.360 -10.911 -3.212 1.00 . A A . 40 ASN HB2 1 1 6 4320 1 1 40 ASN HB3 H 12.770 -9.896 -4.519 1.00 . A A . 40 ASN HB3 1 1 6 4321 1 1 40 ASN HD21 H 14.761 -9.089 -5.393 1.00 . A A . 40 ASN HD21 1 1 6 4322 1 1 40 ASN HD22 H 15.949 -8.235 -4.434 1.00 . A A . 40 ASN HD22 1 1 6 4323 1 1 40 ASN N N 11.001 -10.301 -2.427 1.00 . A A . 40 ASN N 1 1 6 4324 1 1 40 ASN ND2 N 15.096 -8.770 -4.498 1.00 . A A . 40 ASN ND2 1 1 6 4325 1 1 40 ASN O O 12.310 -6.972 -3.071 1.00 . A A . 40 ASN O 1 1 6 4326 1 1 40 ASN OD1 O 14.845 -8.710 -2.274 1.00 . A A . 40 ASN OD1 1 1 6 4327 1 1 41 HIS C C 9.075 -5.831 -3.062 1.00 . A A . 41 HIS C 1 1 6 4328 1 1 41 HIS CA C 9.746 -6.627 -4.172 1.00 . A A . 41 HIS CA 1 1 6 4329 1 1 41 HIS CB C 8.743 -6.998 -5.263 1.00 . A A . 41 HIS CB 1 1 6 4330 1 1 41 HIS CD2 C 9.351 -9.054 -6.730 1.00 . A A . 41 HIS CD2 1 1 6 4331 1 1 41 HIS CE1 C 10.728 -8.080 -8.113 1.00 . A A . 41 HIS CE1 1 1 6 4332 1 1 41 HIS CG C 9.407 -7.726 -6.410 1.00 . A A . 41 HIS CG 1 1 6 4333 1 1 41 HIS H H 9.691 -8.624 -3.486 1.00 . A A . 41 HIS H 1 1 6 4334 1 1 41 HIS HA H 10.526 -6.032 -4.642 1.00 . A A . 41 HIS HA 1 1 6 4335 1 1 41 HIS HB2 H 7.982 -7.641 -4.816 1.00 . A A . 41 HIS HB2 1 1 6 4336 1 1 41 HIS HB3 H 8.240 -6.097 -5.623 1.00 . A A . 41 HIS HB3 1 1 6 4337 1 1 41 HIS HD1 H 10.510 -6.126 -7.341 1.00 . A A . 41 HIS HD1 1 1 6 4338 1 1 41 HIS HD2 H 8.817 -9.812 -6.175 1.00 . A A . 41 HIS HD2 1 1 6 4339 1 1 41 HIS HE1 H 11.448 -7.924 -8.904 1.00 . A A . 41 HIS HE1 1 1 6 4340 1 1 41 HIS N N 10.321 -7.840 -3.611 1.00 . A A . 41 HIS N 1 1 6 4341 1 1 41 HIS ND1 N 10.257 -7.106 -7.314 1.00 . A A . 41 HIS ND1 1 1 6 4342 1 1 41 HIS NE2 N 10.201 -9.275 -7.797 1.00 . A A . 41 HIS NE2 1 1 6 4343 1 1 41 HIS O O 8.185 -6.345 -2.389 1.00 . A A . 41 HIS O 1 1 6 4344 1 1 42 TRP C C 7.537 -3.189 -2.540 1.00 . A A . 42 TRP C 1 1 6 4345 1 1 42 TRP CA C 8.828 -3.700 -1.924 1.00 . A A . 42 TRP CA 1 1 6 4346 1 1 42 TRP CB C 9.773 -2.594 -1.481 1.00 . A A . 42 TRP CB 1 1 6 4347 1 1 42 TRP CD1 C 11.875 -3.748 -0.703 1.00 . A A . 42 TRP CD1 1 1 6 4348 1 1 42 TRP CD2 C 10.682 -2.896 0.987 1.00 . A A . 42 TRP CD2 1 1 6 4349 1 1 42 TRP CE2 C 11.831 -3.509 1.556 1.00 . A A . 42 TRP CE2 1 1 6 4350 1 1 42 TRP CE3 C 9.703 -2.418 1.879 1.00 . A A . 42 TRP CE3 1 1 6 4351 1 1 42 TRP CG C 10.754 -3.045 -0.458 1.00 . A A . 42 TRP CG 1 1 6 4352 1 1 42 TRP CH2 C 11.033 -3.101 3.804 1.00 . A A . 42 TRP CH2 1 1 6 4353 1 1 42 TRP CZ2 C 11.989 -3.660 2.939 1.00 . A A . 42 TRP CZ2 1 1 6 4354 1 1 42 TRP CZ3 C 9.902 -2.457 3.268 1.00 . A A . 42 TRP CZ3 1 1 6 4355 1 1 42 TRP H H 10.147 -4.158 -3.513 1.00 . A A . 42 TRP H 1 1 6 4356 1 1 42 TRP HA H 8.564 -4.234 -1.026 1.00 . A A . 42 TRP HA 1 1 6 4357 1 1 42 TRP HB2 H 10.296 -2.175 -2.337 1.00 . A A . 42 TRP HB2 1 1 6 4358 1 1 42 TRP HB3 H 9.194 -1.806 -1.014 1.00 . A A . 42 TRP HB3 1 1 6 4359 1 1 42 TRP HD1 H 12.158 -4.109 -1.678 1.00 . A A . 42 TRP HD1 1 1 6 4360 1 1 42 TRP HE1 H 13.408 -4.488 0.578 1.00 . A A . 42 TRP HE1 1 1 6 4361 1 1 42 TRP HE3 H 8.767 -2.071 1.484 1.00 . A A . 42 TRP HE3 1 1 6 4362 1 1 42 TRP HH2 H 11.153 -3.191 4.873 1.00 . A A . 42 TRP HH2 1 1 6 4363 1 1 42 TRP HZ2 H 12.783 -4.293 3.304 1.00 . A A . 42 TRP HZ2 1 1 6 4364 1 1 42 TRP HZ3 H 9.152 -2.017 3.912 1.00 . A A . 42 TRP HZ3 1 1 6 4365 1 1 42 TRP N N 9.496 -4.584 -2.857 1.00 . A A . 42 TRP N 1 1 6 4366 1 1 42 TRP NE1 N 12.544 -3.986 0.477 1.00 . A A . 42 TRP NE1 1 1 6 4367 1 1 42 TRP O O 7.592 -2.466 -3.522 1.00 . A A . 42 TRP O 1 1 6 4368 1 1 43 LYS C C 4.537 -2.141 -1.462 1.00 . A A . 43 LYS C 1 1 6 4369 1 1 43 LYS CA C 5.085 -3.121 -2.484 1.00 . A A . 43 LYS CA 1 1 6 4370 1 1 43 LYS CB C 4.115 -4.295 -2.632 1.00 . A A . 43 LYS CB 1 1 6 4371 1 1 43 LYS CD C 5.561 -5.488 -4.396 1.00 . A A . 43 LYS CD 1 1 6 4372 1 1 43 LYS CE C 4.659 -5.464 -5.648 1.00 . A A . 43 LYS CE 1 1 6 4373 1 1 43 LYS CG C 4.828 -5.578 -3.045 1.00 . A A . 43 LYS CG 1 1 6 4374 1 1 43 LYS H H 6.372 -4.230 -1.236 1.00 . A A . 43 LYS H 1 1 6 4375 1 1 43 LYS HA H 5.182 -2.646 -3.459 1.00 . A A . 43 LYS HA 1 1 6 4376 1 1 43 LYS HB2 H 3.666 -4.484 -1.663 1.00 . A A . 43 LYS HB2 1 1 6 4377 1 1 43 LYS HB3 H 3.308 -4.037 -3.313 1.00 . A A . 43 LYS HB3 1 1 6 4378 1 1 43 LYS HD2 H 6.262 -4.654 -4.427 1.00 . A A . 43 LYS HD2 1 1 6 4379 1 1 43 LYS HD3 H 6.141 -6.405 -4.453 1.00 . A A . 43 LYS HD3 1 1 6 4380 1 1 43 LYS HE2 H 5.295 -5.686 -6.508 1.00 . A A . 43 LYS HE2 1 1 6 4381 1 1 43 LYS HE3 H 3.907 -6.253 -5.577 1.00 . A A . 43 LYS HE3 1 1 6 4382 1 1 43 LYS HG2 H 5.475 -5.840 -2.200 1.00 . A A . 43 LYS HG2 1 1 6 4383 1 1 43 LYS HG3 H 4.141 -6.404 -3.116 1.00 . A A . 43 LYS HG3 1 1 6 4384 1 1 43 LYS HZ1 H 4.285 -3.817 -6.843 1.00 . A A . 43 LYS HZ1 1 1 6 4385 1 1 43 LYS HZ2 H 2.971 -4.297 -5.912 1.00 . A A . 43 LYS HZ2 1 1 6 4386 1 1 43 LYS N N 6.379 -3.582 -2.016 1.00 . A A . 43 LYS N 1 1 6 4387 1 1 43 LYS NZ N 3.992 -4.168 -5.921 1.00 . A A . 43 LYS NZ 1 1 6 4388 1 1 43 LYS O O 4.595 -2.401 -0.260 1.00 . A A . 43 LYS O 1 1 6 4389 1 1 44 CYS C C 1.755 -1.087 -0.956 1.00 . A A . 44 CYS C 1 1 6 4390 1 1 44 CYS CA C 3.021 -0.265 -1.160 1.00 . A A . 44 CYS CA 1 1 6 4391 1 1 44 CYS CB C 2.731 1.037 -1.892 1.00 . A A . 44 CYS CB 1 1 6 4392 1 1 44 CYS H H 3.948 -0.906 -2.945 1.00 . A A . 44 CYS H 1 1 6 4393 1 1 44 CYS HA H 3.447 -0.002 -0.201 1.00 . A A . 44 CYS HA 1 1 6 4394 1 1 44 CYS HB2 H 3.603 1.673 -1.747 1.00 . A A . 44 CYS HB2 1 1 6 4395 1 1 44 CYS HB3 H 2.588 0.839 -2.949 1.00 . A A . 44 CYS HB3 1 1 6 4396 1 1 44 CYS N N 3.954 -1.049 -1.947 1.00 . A A . 44 CYS N 1 1 6 4397 1 1 44 CYS O O 1.119 -1.461 -1.938 1.00 . A A . 44 CYS O 1 1 6 4398 1 1 44 CYS SG S 1.262 1.893 -1.288 1.00 . A A . 44 CYS SG 1 1 6 4399 1 1 45 PHE C C -0.772 -1.018 1.244 1.00 . A A . 45 PHE C 1 1 6 4400 1 1 45 PHE CA C 0.170 -2.061 0.653 1.00 . A A . 45 PHE CA 1 1 6 4401 1 1 45 PHE CB C 0.425 -3.166 1.685 1.00 . A A . 45 PHE CB 1 1 6 4402 1 1 45 PHE CD1 C 1.898 -4.805 0.444 1.00 . A A . 45 PHE CD1 1 1 6 4403 1 1 45 PHE CD2 C -0.282 -5.553 1.216 1.00 . A A . 45 PHE CD2 1 1 6 4404 1 1 45 PHE CE1 C 2.167 -6.100 -0.032 1.00 . A A . 45 PHE CE1 1 1 6 4405 1 1 45 PHE CE2 C -0.028 -6.835 0.704 1.00 . A A . 45 PHE CE2 1 1 6 4406 1 1 45 PHE CG C 0.688 -4.538 1.102 1.00 . A A . 45 PHE CG 1 1 6 4407 1 1 45 PHE CZ C 1.203 -7.114 0.090 1.00 . A A . 45 PHE CZ 1 1 6 4408 1 1 45 PHE H H 1.970 -1.039 1.071 1.00 . A A . 45 PHE H 1 1 6 4409 1 1 45 PHE HA H -0.299 -2.504 -0.229 1.00 . A A . 45 PHE HA 1 1 6 4410 1 1 45 PHE HB2 H 1.265 -2.862 2.302 1.00 . A A . 45 PHE HB2 1 1 6 4411 1 1 45 PHE HB3 H -0.436 -3.251 2.345 1.00 . A A . 45 PHE HB3 1 1 6 4412 1 1 45 PHE HD1 H 2.631 -4.018 0.334 1.00 . A A . 45 PHE HD1 1 1 6 4413 1 1 45 PHE HD2 H -1.251 -5.329 1.632 1.00 . A A . 45 PHE HD2 1 1 6 4414 1 1 45 PHE HE1 H 3.109 -6.309 -0.512 1.00 . A A . 45 PHE HE1 1 1 6 4415 1 1 45 PHE HE2 H -0.793 -7.599 0.751 1.00 . A A . 45 PHE HE2 1 1 6 4416 1 1 45 PHE HZ H 1.389 -8.097 -0.317 1.00 . A A . 45 PHE HZ 1 1 6 4417 1 1 45 PHE N N 1.419 -1.402 0.298 1.00 . A A . 45 PHE N 1 1 6 4418 1 1 45 PHE O O -0.327 -0.067 1.886 1.00 . A A . 45 PHE O 1 1 6 4419 1 1 46 CYS C C -3.911 -1.332 2.583 1.00 . A A . 46 CYS C 1 1 6 4420 1 1 46 CYS CA C -3.164 -0.458 1.594 1.00 . A A . 46 CYS CA 1 1 6 4421 1 1 46 CYS CB C -4.095 -0.050 0.453 1.00 . A A . 46 CYS CB 1 1 6 4422 1 1 46 CYS H H -2.342 -2.084 0.570 1.00 . A A . 46 CYS H 1 1 6 4423 1 1 46 CYS HA H -2.835 0.412 2.168 1.00 . A A . 46 CYS HA 1 1 6 4424 1 1 46 CYS HB2 H -4.491 -0.950 -0.017 1.00 . A A . 46 CYS HB2 1 1 6 4425 1 1 46 CYS HB3 H -4.925 0.505 0.873 1.00 . A A . 46 CYS HB3 1 1 6 4426 1 1 46 CYS N N -2.067 -1.237 1.053 1.00 . A A . 46 CYS N 1 1 6 4427 1 1 46 CYS O O -3.733 -2.546 2.616 1.00 . A A . 46 CYS O 1 1 6 4428 1 1 46 CYS SG S -3.376 0.959 -0.867 1.00 . A A . 46 CYS SG 1 1 6 4429 1 1 47 TYR C C -6.777 -0.737 4.603 1.00 . A A . 47 TYR C 1 1 6 4430 1 1 47 TYR CA C -5.406 -1.381 4.510 1.00 . A A . 47 TYR CA 1 1 6 4431 1 1 47 TYR CB C -4.625 -1.079 5.788 1.00 . A A . 47 TYR CB 1 1 6 4432 1 1 47 TYR CD1 C -2.160 -1.290 5.210 1.00 . A A . 47 TYR CD1 1 1 6 4433 1 1 47 TYR CD2 C -3.189 -2.923 6.695 1.00 . A A . 47 TYR CD2 1 1 6 4434 1 1 47 TYR CE1 C -0.943 -1.981 5.290 1.00 . A A . 47 TYR CE1 1 1 6 4435 1 1 47 TYR CE2 C -1.957 -3.574 6.830 1.00 . A A . 47 TYR CE2 1 1 6 4436 1 1 47 TYR CG C -3.290 -1.776 5.892 1.00 . A A . 47 TYR CG 1 1 6 4437 1 1 47 TYR CZ C -0.845 -3.116 6.111 1.00 . A A . 47 TYR CZ 1 1 6 4438 1 1 47 TYR H H -4.715 0.311 3.445 1.00 . A A . 47 TYR H 1 1 6 4439 1 1 47 TYR HA H -5.476 -2.463 4.361 1.00 . A A . 47 TYR HA 1 1 6 4440 1 1 47 TYR HB2 H -4.448 -0.009 5.797 1.00 . A A . 47 TYR HB2 1 1 6 4441 1 1 47 TYR HB3 H -5.224 -1.329 6.663 1.00 . A A . 47 TYR HB3 1 1 6 4442 1 1 47 TYR HD1 H -2.226 -0.391 4.619 1.00 . A A . 47 TYR HD1 1 1 6 4443 1 1 47 TYR HD2 H -4.050 -3.305 7.221 1.00 . A A . 47 TYR HD2 1 1 6 4444 1 1 47 TYR HE1 H -0.096 -1.638 4.714 1.00 . A A . 47 TYR HE1 1 1 6 4445 1 1 47 TYR HE2 H -1.885 -4.444 7.467 1.00 . A A . 47 TYR HE2 1 1 6 4446 1 1 47 TYR HH H 0.290 -4.469 6.889 1.00 . A A . 47 TYR HH 1 1 6 4447 1 1 47 TYR N N -4.709 -0.706 3.437 1.00 . A A . 47 TYR N 1 1 6 4448 1 1 47 TYR O O -6.879 0.368 5.134 1.00 . A A . 47 TYR O 1 1 6 4449 1 1 47 TYR OH O 0.333 -3.784 6.215 1.00 . A A . 47 TYR OH 1 1 6 4450 1 1 48 PHE C C -9.840 -1.544 5.413 1.00 . A A . 48 PHE C 1 1 6 4451 1 1 48 PHE CA C -9.166 -0.871 4.218 1.00 . A A . 48 PHE CA 1 1 6 4452 1 1 48 PHE CB C -9.867 -1.267 2.916 1.00 . A A . 48 PHE CB 1 1 6 4453 1 1 48 PHE CD1 C -8.156 -1.320 1.032 1.00 . A A . 48 PHE CD1 1 1 6 4454 1 1 48 PHE CD2 C -9.915 0.361 0.971 1.00 . A A . 48 PHE CD2 1 1 6 4455 1 1 48 PHE CE1 C -7.673 -0.861 -0.207 1.00 . A A . 48 PHE CE1 1 1 6 4456 1 1 48 PHE CE2 C -9.439 0.811 -0.274 1.00 . A A . 48 PHE CE2 1 1 6 4457 1 1 48 PHE CG C -9.288 -0.719 1.619 1.00 . A A . 48 PHE CG 1 1 6 4458 1 1 48 PHE CZ C -8.318 0.200 -0.863 1.00 . A A . 48 PHE CZ 1 1 6 4459 1 1 48 PHE H H -7.762 -2.304 3.687 1.00 . A A . 48 PHE H 1 1 6 4460 1 1 48 PHE HA H -9.193 0.211 4.333 1.00 . A A . 48 PHE HA 1 1 6 4461 1 1 48 PHE HB2 H -9.879 -2.349 2.846 1.00 . A A . 48 PHE HB2 1 1 6 4462 1 1 48 PHE HB3 H -10.896 -0.965 2.999 1.00 . A A . 48 PHE HB3 1 1 6 4463 1 1 48 PHE HD1 H -7.664 -2.155 1.506 1.00 . A A . 48 PHE HD1 1 1 6 4464 1 1 48 PHE HD2 H -10.775 0.845 1.409 1.00 . A A . 48 PHE HD2 1 1 6 4465 1 1 48 PHE HE1 H -6.825 -1.341 -0.672 1.00 . A A . 48 PHE HE1 1 1 6 4466 1 1 48 PHE HE2 H -9.958 1.605 -0.790 1.00 . A A . 48 PHE HE2 1 1 6 4467 1 1 48 PHE HZ H -7.962 0.526 -1.829 1.00 . A A . 48 PHE HZ 1 1 6 4468 1 1 48 PHE N N -7.828 -1.391 4.112 1.00 . A A . 48 PHE N 1 1 6 4469 1 1 48 PHE O O -9.278 -2.463 6.012 1.00 . A A . 48 PHE O 1 1 6 4470 1 1 49 ASN C C -11.324 -1.953 8.027 1.00 . A A . 49 ASN C 1 1 6 4471 1 1 49 ASN CA C -11.984 -1.809 6.648 1.00 . A A . 49 ASN CA 1 1 6 4472 1 1 49 ASN CB C -12.483 -3.174 6.139 1.00 . A A . 49 ASN CB 1 1 6 4473 1 1 49 ASN CG C -13.110 -3.092 4.751 1.00 . A A . 49 ASN CG 1 1 6 4474 1 1 49 ASN H H -11.500 -0.443 5.105 1.00 . A A . 49 ASN H 1 1 6 4475 1 1 49 ASN HA H -12.852 -1.159 6.768 1.00 . A A . 49 ASN HA 1 1 6 4476 1 1 49 ASN HB2 H -11.655 -3.881 6.115 1.00 . A A . 49 ASN HB2 1 1 6 4477 1 1 49 ASN HB3 H -13.240 -3.554 6.824 1.00 . A A . 49 ASN HB3 1 1 6 4478 1 1 49 ASN HD21 H -11.447 -3.872 3.862 1.00 . A A . 49 ASN HD21 1 1 6 4479 1 1 49 ASN HD22 H -12.793 -3.478 2.802 1.00 . A A . 49 ASN HD22 1 1 6 4480 1 1 49 ASN N N -11.107 -1.194 5.652 1.00 . A A . 49 ASN N 1 1 6 4481 1 1 49 ASN ND2 N -12.377 -3.508 3.720 1.00 . A A . 49 ASN ND2 1 1 6 4482 1 1 49 ASN O O -11.621 -2.908 8.748 1.00 . A A . 49 ASN O 1 1 6 4483 1 1 49 ASN OD1 O -14.244 -2.655 4.604 1.00 . A A . 49 ASN OD1 1 1 6 4484 1 1 50 CYS C C -10.333 -0.939 10.883 1.00 . A A . 50 CYS C 1 1 6 4485 1 1 50 CYS CA C -9.587 -1.248 9.590 1.00 . A A . 50 CYS CA 1 1 6 4486 1 1 50 CYS CB C -8.300 -0.450 9.463 1.00 . A A . 50 CYS CB 1 1 6 4487 1 1 50 CYS H H -10.195 -0.259 7.804 1.00 . A A . 50 CYS H 1 1 6 4488 1 1 50 CYS HA H -9.287 -2.281 9.628 1.00 . A A . 50 CYS HA 1 1 6 4489 1 1 50 CYS HB2 H -7.838 -0.676 8.501 1.00 . A A . 50 CYS HB2 1 1 6 4490 1 1 50 CYS HB3 H -8.583 0.591 9.495 1.00 . A A . 50 CYS HB3 1 1 6 4491 1 1 50 CYS N N -10.418 -1.043 8.409 1.00 . A A . 50 CYS N 1 1 6 4492 1 1 50 CYS O O -10.541 -1.868 11.721 1.00 . A A . 50 CYS O 1 1 6 4493 1 1 50 CYS OXT O -10.741 0.241 11.119 1.00 . A A . 50 CYS OXT 1 1 6 4494 1 1 50 CYS SG S -7.043 -0.689 10.736 1.00 . A A . 50 CYS SG 1 1 7 4495 1 1 1 LEU C C -9.853 -5.487 9.234 1.00 . A A . 1 LEU C 1 1 7 4496 1 1 1 LEU CA C -10.722 -5.899 10.420 1.00 . A A . 1 LEU CA 1 1 7 4497 1 1 1 LEU CB C -10.958 -7.420 10.480 1.00 . A A . 1 LEU CB 1 1 7 4498 1 1 1 LEU CD1 C -8.846 -8.524 9.496 1.00 . A A . 1 LEU CD1 1 1 7 4499 1 1 1 LEU CD2 C -8.896 -7.867 11.931 1.00 . A A . 1 LEU CD2 1 1 7 4500 1 1 1 LEU CG C -9.734 -8.322 10.730 1.00 . A A . 1 LEU CG 1 1 7 4501 1 1 1 LEU H1 H -11.848 -4.177 10.327 1.00 . A A . 1 LEU H1 1 1 7 4502 1 1 1 LEU H2 H -12.471 -5.454 9.427 1.00 . A A . 1 LEU H2 1 1 7 4503 1 1 1 LEU H3 H -12.614 -5.457 11.102 1.00 . A A . 1 LEU H3 1 1 7 4504 1 1 1 LEU HA H -10.255 -5.568 11.348 1.00 . A A . 1 LEU HA 1 1 7 4505 1 1 1 LEU HB2 H -11.654 -7.605 11.300 1.00 . A A . 1 LEU HB2 1 1 7 4506 1 1 1 LEU HB3 H -11.444 -7.744 9.558 1.00 . A A . 1 LEU HB3 1 1 7 4507 1 1 1 LEU HD11 H -9.460 -8.757 8.625 1.00 . A A . 1 LEU HD11 1 1 7 4508 1 1 1 LEU HD12 H -8.240 -7.646 9.288 1.00 . A A . 1 LEU HD12 1 1 7 4509 1 1 1 LEU HD13 H -8.171 -9.360 9.678 1.00 . A A . 1 LEU HD13 1 1 7 4510 1 1 1 LEU HD21 H -9.538 -7.732 12.804 1.00 . A A . 1 LEU HD21 1 1 7 4511 1 1 1 LEU HD22 H -8.153 -8.634 12.163 1.00 . A A . 1 LEU HD22 1 1 7 4512 1 1 1 LEU HD23 H -8.375 -6.937 11.714 1.00 . A A . 1 LEU HD23 1 1 7 4513 1 1 1 LEU HG H -10.135 -9.308 10.976 1.00 . A A . 1 LEU HG 1 1 7 4514 1 1 1 LEU N N -12.010 -5.194 10.311 1.00 . A A . 1 LEU N 1 1 7 4515 1 1 1 LEU O O -10.352 -5.480 8.112 1.00 . A A . 1 LEU O 1 1 7 4516 1 1 2 CYS C C -7.461 -5.329 7.306 1.00 . A A . 2 CYS C 1 1 7 4517 1 1 2 CYS CA C -7.702 -4.456 8.538 1.00 . A A . 2 CYS CA 1 1 7 4518 1 1 2 CYS CB C -6.409 -3.968 9.219 1.00 . A A . 2 CYS CB 1 1 7 4519 1 1 2 CYS H H -8.283 -5.128 10.447 1.00 . A A . 2 CYS H 1 1 7 4520 1 1 2 CYS HA H -8.199 -3.555 8.193 1.00 . A A . 2 CYS HA 1 1 7 4521 1 1 2 CYS HB2 H -5.742 -4.823 9.336 1.00 . A A . 2 CYS HB2 1 1 7 4522 1 1 2 CYS HB3 H -5.919 -3.241 8.580 1.00 . A A . 2 CYS HB3 1 1 7 4523 1 1 2 CYS N N -8.609 -5.077 9.496 1.00 . A A . 2 CYS N 1 1 7 4524 1 1 2 CYS O O -6.603 -6.208 7.299 1.00 . A A . 2 CYS O 1 1 7 4525 1 1 2 CYS SG S -6.605 -3.259 10.879 1.00 . A A . 2 CYS SG 1 1 7 4526 1 1 3 ASN C C -6.882 -5.174 4.276 1.00 . A A . 3 ASN C 1 1 7 4527 1 1 3 ASN CA C -8.122 -5.729 4.967 1.00 . A A . 3 ASN CA 1 1 7 4528 1 1 3 ASN CB C -9.397 -5.478 4.151 1.00 . A A . 3 ASN CB 1 1 7 4529 1 1 3 ASN CG C -9.266 -5.848 2.681 1.00 . A A . 3 ASN CG 1 1 7 4530 1 1 3 ASN H H -8.851 -4.263 6.317 1.00 . A A . 3 ASN H 1 1 7 4531 1 1 3 ASN HA H -8.009 -6.805 5.115 1.00 . A A . 3 ASN HA 1 1 7 4532 1 1 3 ASN HB2 H -10.221 -6.048 4.574 1.00 . A A . 3 ASN HB2 1 1 7 4533 1 1 3 ASN HB3 H -9.631 -4.419 4.196 1.00 . A A . 3 ASN HB3 1 1 7 4534 1 1 3 ASN HD21 H -8.809 -7.762 3.167 1.00 . A A . 3 ASN HD21 1 1 7 4535 1 1 3 ASN HD22 H -8.876 -7.416 1.456 1.00 . A A . 3 ASN HD22 1 1 7 4536 1 1 3 ASN N N -8.224 -5.057 6.247 1.00 . A A . 3 ASN N 1 1 7 4537 1 1 3 ASN ND2 N -8.937 -7.105 2.411 1.00 . A A . 3 ASN ND2 1 1 7 4538 1 1 3 ASN O O -6.965 -4.204 3.520 1.00 . A A . 3 ASN O 1 1 7 4539 1 1 3 ASN OD1 O -9.485 -5.026 1.791 1.00 . A A . 3 ASN OD1 1 1 7 4540 1 1 4 GLU C C -4.533 -6.017 2.523 1.00 . A A . 4 GLU C 1 1 7 4541 1 1 4 GLU CA C -4.473 -5.459 3.945 1.00 . A A . 4 GLU CA 1 1 7 4542 1 1 4 GLU CB C -3.346 -6.059 4.796 1.00 . A A . 4 GLU CB 1 1 7 4543 1 1 4 GLU CD C -0.811 -6.329 4.934 1.00 . A A . 4 GLU CD 1 1 7 4544 1 1 4 GLU CG C -2.003 -5.923 4.081 1.00 . A A . 4 GLU CG 1 1 7 4545 1 1 4 GLU H H -5.721 -6.541 5.235 1.00 . A A . 4 GLU H 1 1 7 4546 1 1 4 GLU HA H -4.340 -4.381 3.925 1.00 . A A . 4 GLU HA 1 1 7 4547 1 1 4 GLU HB2 H -3.309 -5.549 5.758 1.00 . A A . 4 GLU HB2 1 1 7 4548 1 1 4 GLU HB3 H -3.540 -7.120 4.969 1.00 . A A . 4 GLU HB3 1 1 7 4549 1 1 4 GLU HG2 H -2.068 -6.591 3.228 1.00 . A A . 4 GLU HG2 1 1 7 4550 1 1 4 GLU HG3 H -1.838 -4.896 3.750 1.00 . A A . 4 GLU HG3 1 1 7 4551 1 1 4 GLU N N -5.733 -5.787 4.565 1.00 . A A . 4 GLU N 1 1 7 4552 1 1 4 GLU O O -4.788 -7.204 2.334 1.00 . A A . 4 GLU O 1 1 7 4553 1 1 4 GLU OE1 O -0.918 -7.506 5.606 1.00 . A A . 4 GLU OE1 1 1 7 4554 1 1 4 GLU OE2 O 0.171 -5.591 4.972 1.00 . A A . 4 GLU OE2 1 1 7 4555 1 1 5 ARG C C -3.158 -4.869 -0.576 1.00 . A A . 5 ARG C 1 1 7 4556 1 1 5 ARG CA C -4.370 -5.469 0.115 1.00 . A A . 5 ARG CA 1 1 7 4557 1 1 5 ARG CB C -5.660 -4.932 -0.521 1.00 . A A . 5 ARG CB 1 1 7 4558 1 1 5 ARG CD C -7.785 -5.762 -1.636 1.00 . A A . 5 ARG CD 1 1 7 4559 1 1 5 ARG CG C -6.567 -6.126 -0.782 1.00 . A A . 5 ARG CG 1 1 7 4560 1 1 5 ARG CZ C -9.328 -3.799 -1.159 1.00 . A A . 5 ARG CZ 1 1 7 4561 1 1 5 ARG H H -4.053 -4.205 1.768 1.00 . A A . 5 ARG H 1 1 7 4562 1 1 5 ARG HA H -4.297 -6.550 0.013 1.00 . A A . 5 ARG HA 1 1 7 4563 1 1 5 ARG HB2 H -6.150 -4.211 0.135 1.00 . A A . 5 ARG HB2 1 1 7 4564 1 1 5 ARG HB3 H -5.436 -4.443 -1.470 1.00 . A A . 5 ARG HB3 1 1 7 4565 1 1 5 ARG HD2 H -7.453 -5.259 -2.544 1.00 . A A . 5 ARG HD2 1 1 7 4566 1 1 5 ARG HD3 H -8.285 -6.685 -1.933 1.00 . A A . 5 ARG HD3 1 1 7 4567 1 1 5 ARG HG2 H -5.984 -6.875 -1.315 1.00 . A A . 5 ARG HG2 1 1 7 4568 1 1 5 ARG HG3 H -6.838 -6.528 0.195 1.00 . A A . 5 ARG HG3 1 1 7 4569 1 1 5 ARG HH11 H -8.420 -3.517 -2.986 1.00 . A A . 5 ARG HH11 1 1 7 4570 1 1 5 ARG HH12 H -9.528 -2.275 -2.514 1.00 . A A . 5 ARG HH12 1 1 7 4571 1 1 5 ARG HH21 H -10.239 -3.746 0.643 1.00 . A A . 5 ARG HH21 1 1 7 4572 1 1 5 ARG HH22 H -10.491 -2.322 -0.335 1.00 . A A . 5 ARG HH22 1 1 7 4573 1 1 5 ARG N N -4.327 -5.151 1.531 1.00 . A A . 5 ARG N 1 1 7 4574 1 1 5 ARG NE N -8.741 -4.966 -0.856 1.00 . A A . 5 ARG NE 1 1 7 4575 1 1 5 ARG NH1 N -9.096 -3.165 -2.315 1.00 . A A . 5 ARG NH1 1 1 7 4576 1 1 5 ARG NH2 N -10.154 -3.270 -0.254 1.00 . A A . 5 ARG NH2 1 1 7 4577 1 1 5 ARG O O -2.612 -3.878 -0.086 1.00 . A A . 5 ARG O 1 1 7 4578 1 1 6 PRO C C -1.550 -3.759 -2.963 1.00 . A A . 6 PRO C 1 1 7 4579 1 1 6 PRO CA C -1.456 -5.121 -2.279 1.00 . A A . 6 PRO CA 1 1 7 4580 1 1 6 PRO CB C -1.109 -6.264 -3.239 1.00 . A A . 6 PRO CB 1 1 7 4581 1 1 6 PRO CD C -3.324 -6.586 -2.408 1.00 . A A . 6 PRO CD 1 1 7 4582 1 1 6 PRO CG C -2.484 -6.764 -3.673 1.00 . A A . 6 PRO CG 1 1 7 4583 1 1 6 PRO HA H -0.764 -5.093 -1.454 1.00 . A A . 6 PRO HA 1 1 7 4584 1 1 6 PRO HB2 H -0.498 -5.957 -4.088 1.00 . A A . 6 PRO HB2 1 1 7 4585 1 1 6 PRO HB3 H -0.602 -7.054 -2.684 1.00 . A A . 6 PRO HB3 1 1 7 4586 1 1 6 PRO HD2 H -4.351 -6.368 -2.694 1.00 . A A . 6 PRO HD2 1 1 7 4587 1 1 6 PRO HD3 H -3.273 -7.496 -1.809 1.00 . A A . 6 PRO HD3 1 1 7 4588 1 1 6 PRO HG2 H -2.869 -6.117 -4.465 1.00 . A A . 6 PRO HG2 1 1 7 4589 1 1 6 PRO HG3 H -2.462 -7.801 -4.015 1.00 . A A . 6 PRO HG3 1 1 7 4590 1 1 6 PRO N N -2.717 -5.477 -1.689 1.00 . A A . 6 PRO N 1 1 7 4591 1 1 6 PRO O O -2.591 -3.108 -2.915 1.00 . A A . 6 PRO O 1 1 7 4592 1 1 7 SER C C -1.646 -2.097 -5.399 1.00 . A A . 7 SER C 1 1 7 4593 1 1 7 SER CA C -0.484 -2.096 -4.401 1.00 . A A . 7 SER CA 1 1 7 4594 1 1 7 SER CB C 0.849 -1.983 -5.146 1.00 . A A . 7 SER CB 1 1 7 4595 1 1 7 SER H H 0.370 -3.865 -3.623 1.00 . A A . 7 SER H 1 1 7 4596 1 1 7 SER HA H -0.576 -1.243 -3.726 1.00 . A A . 7 SER HA 1 1 7 4597 1 1 7 SER HB2 H 0.693 -1.235 -5.920 1.00 . A A . 7 SER HB2 1 1 7 4598 1 1 7 SER HB3 H 1.628 -1.634 -4.471 1.00 . A A . 7 SER HB3 1 1 7 4599 1 1 7 SER HG H 0.438 -3.512 -6.243 1.00 . A A . 7 SER HG 1 1 7 4600 1 1 7 SER N N -0.483 -3.330 -3.634 1.00 . A A . 7 SER N 1 1 7 4601 1 1 7 SER O O -1.550 -2.761 -6.428 1.00 . A A . 7 SER O 1 1 7 4602 1 1 7 SER OG O 1.213 -3.224 -5.734 1.00 . A A . 7 SER OG 1 1 7 4603 1 1 8 GLN C C -3.643 -0.253 -7.041 1.00 . A A . 8 GLN C 1 1 7 4604 1 1 8 GLN CA C -3.907 -1.240 -5.904 1.00 . A A . 8 GLN CA 1 1 7 4605 1 1 8 GLN CB C -5.074 -0.745 -5.028 1.00 . A A . 8 GLN CB 1 1 7 4606 1 1 8 GLN CD C -5.833 -2.996 -4.070 1.00 . A A . 8 GLN CD 1 1 7 4607 1 1 8 GLN CG C -5.391 -1.567 -3.770 1.00 . A A . 8 GLN CG 1 1 7 4608 1 1 8 GLN H H -2.690 -0.855 -4.215 1.00 . A A . 8 GLN H 1 1 7 4609 1 1 8 GLN HA H -4.155 -2.214 -6.329 1.00 . A A . 8 GLN HA 1 1 7 4610 1 1 8 GLN HB2 H -4.873 0.272 -4.690 1.00 . A A . 8 GLN HB2 1 1 7 4611 1 1 8 GLN HB3 H -5.963 -0.718 -5.651 1.00 . A A . 8 GLN HB3 1 1 7 4612 1 1 8 GLN HE21 H -3.920 -3.641 -4.044 1.00 . A A . 8 GLN HE21 1 1 7 4613 1 1 8 GLN HE22 H -5.132 -4.856 -4.468 1.00 . A A . 8 GLN HE22 1 1 7 4614 1 1 8 GLN HG2 H -4.539 -1.569 -3.091 1.00 . A A . 8 GLN HG2 1 1 7 4615 1 1 8 GLN HG3 H -6.215 -1.070 -3.256 1.00 . A A . 8 GLN HG3 1 1 7 4616 1 1 8 GLN N N -2.703 -1.340 -5.095 1.00 . A A . 8 GLN N 1 1 7 4617 1 1 8 GLN NE2 N -4.887 -3.911 -4.218 1.00 . A A . 8 GLN NE2 1 1 7 4618 1 1 8 GLN O O -3.721 -0.583 -8.219 1.00 . A A . 8 GLN O 1 1 7 4619 1 1 8 GLN OE1 O -7.024 -3.288 -4.122 1.00 . A A . 8 GLN OE1 1 1 7 4620 1 1 9 THR C C -1.510 1.937 -7.937 1.00 . A A . 9 THR C 1 1 7 4621 1 1 9 THR CA C -2.954 2.101 -7.491 1.00 . A A . 9 THR CA 1 1 7 4622 1 1 9 THR CB C -3.056 3.337 -6.588 1.00 . A A . 9 THR CB 1 1 7 4623 1 1 9 THR CG2 C -4.517 3.759 -6.482 1.00 . A A . 9 THR CG2 1 1 7 4624 1 1 9 THR H H -3.261 1.186 -5.662 1.00 . A A . 9 THR H 1 1 7 4625 1 1 9 THR HA H -3.607 2.187 -8.361 1.00 . A A . 9 THR HA 1 1 7 4626 1 1 9 THR HB H -2.474 4.160 -7.004 1.00 . A A . 9 THR HB 1 1 7 4627 1 1 9 THR HG1 H -2.830 3.621 -4.630 1.00 . A A . 9 THR HG1 1 1 7 4628 1 1 9 THR HG21 H -5.120 2.919 -6.148 1.00 . A A . 9 THR HG21 1 1 7 4629 1 1 9 THR HG22 H -4.601 4.581 -5.776 1.00 . A A . 9 THR HG22 1 1 7 4630 1 1 9 THR HG23 H -4.878 4.080 -7.460 1.00 . A A . 9 THR HG23 1 1 7 4631 1 1 9 THR N N -3.320 0.978 -6.651 1.00 . A A . 9 THR N 1 1 7 4632 1 1 9 THR O O -1.180 1.984 -9.119 1.00 . A A . 9 THR O 1 1 7 4633 1 1 9 THR OG1 O -2.564 2.973 -5.300 1.00 . A A . 9 THR OG1 1 1 7 4634 1 1 10 TRP C C 1.467 1.171 -8.069 1.00 . A A . 10 TRP C 1 1 7 4635 1 1 10 TRP CA C 0.767 2.049 -7.026 1.00 . A A . 10 TRP CA 1 1 7 4636 1 1 10 TRP CB C 1.353 1.858 -5.623 1.00 . A A . 10 TRP CB 1 1 7 4637 1 1 10 TRP CD1 C 3.845 1.612 -5.938 1.00 . A A . 10 TRP CD1 1 1 7 4638 1 1 10 TRP CD2 C 3.285 3.504 -4.864 1.00 . A A . 10 TRP CD2 1 1 7 4639 1 1 10 TRP CE2 C 4.691 3.545 -5.077 1.00 . A A . 10 TRP CE2 1 1 7 4640 1 1 10 TRP CE3 C 2.700 4.593 -4.184 1.00 . A A . 10 TRP CE3 1 1 7 4641 1 1 10 TRP CG C 2.771 2.287 -5.478 1.00 . A A . 10 TRP CG 1 1 7 4642 1 1 10 TRP CH2 C 4.852 5.723 -4.038 1.00 . A A . 10 TRP CH2 1 1 7 4643 1 1 10 TRP CZ2 C 5.468 4.639 -4.679 1.00 . A A . 10 TRP CZ2 1 1 7 4644 1 1 10 TRP CZ3 C 3.467 5.700 -3.773 1.00 . A A . 10 TRP CZ3 1 1 7 4645 1 1 10 TRP H H -1.074 1.802 -6.016 1.00 . A A . 10 TRP H 1 1 7 4646 1 1 10 TRP HA H 0.890 3.092 -7.318 1.00 . A A . 10 TRP HA 1 1 7 4647 1 1 10 TRP HB2 H 0.761 2.442 -4.920 1.00 . A A . 10 TRP HB2 1 1 7 4648 1 1 10 TRP HB3 H 1.279 0.815 -5.328 1.00 . A A . 10 TRP HB3 1 1 7 4649 1 1 10 TRP HD1 H 3.793 0.669 -6.474 1.00 . A A . 10 TRP HD1 1 1 7 4650 1 1 10 TRP HE1 H 5.926 2.092 -5.984 1.00 . A A . 10 TRP HE1 1 1 7 4651 1 1 10 TRP HE3 H 1.643 4.576 -3.988 1.00 . A A . 10 TRP HE3 1 1 7 4652 1 1 10 TRP HH2 H 5.462 6.567 -3.776 1.00 . A A . 10 TRP HH2 1 1 7 4653 1 1 10 TRP HZ2 H 6.520 4.668 -4.920 1.00 . A A . 10 TRP HZ2 1 1 7 4654 1 1 10 TRP HZ3 H 2.964 6.525 -3.272 1.00 . A A . 10 TRP HZ3 1 1 7 4655 1 1 10 TRP N N -0.650 1.756 -6.936 1.00 . A A . 10 TRP N 1 1 7 4656 1 1 10 TRP NE1 N 4.985 2.354 -5.709 1.00 . A A . 10 TRP NE1 1 1 7 4657 1 1 10 TRP O O 2.424 1.609 -8.698 1.00 . A A . 10 TRP O 1 1 7 4658 1 1 11 SER C C 2.839 -0.992 -9.659 1.00 . A A . 11 SER C 1 1 7 4659 1 1 11 SER CA C 1.350 -0.985 -9.304 1.00 . A A . 11 SER CA 1 1 7 4660 1 1 11 SER CB C 0.482 -0.709 -10.537 1.00 . A A . 11 SER CB 1 1 7 4661 1 1 11 SER H H 0.117 -0.280 -7.765 1.00 . A A . 11 SER H 1 1 7 4662 1 1 11 SER HA H 1.127 -1.976 -8.917 1.00 . A A . 11 SER HA 1 1 7 4663 1 1 11 SER HB2 H 0.800 0.221 -11.012 1.00 . A A . 11 SER HB2 1 1 7 4664 1 1 11 SER HB3 H 0.600 -1.524 -11.251 1.00 . A A . 11 SER HB3 1 1 7 4665 1 1 11 SER HG H -1.045 0.308 -9.872 1.00 . A A . 11 SER HG 1 1 7 4666 1 1 11 SER N N 0.975 -0.060 -8.246 1.00 . A A . 11 SER N 1 1 7 4667 1 1 11 SER O O 3.208 -0.825 -10.817 1.00 . A A . 11 SER O 1 1 7 4668 1 1 11 SER OG O -0.874 -0.601 -10.155 1.00 . A A . 11 SER OG 1 1 7 4669 1 1 12 GLY C C 5.837 -1.504 -7.553 1.00 . A A . 12 GLY C 1 1 7 4670 1 1 12 GLY CA C 5.129 -1.271 -8.879 1.00 . A A . 12 GLY CA 1 1 7 4671 1 1 12 GLY H H 3.357 -1.361 -7.725 1.00 . A A . 12 GLY H 1 1 7 4672 1 1 12 GLY HA2 H 5.378 -2.078 -9.568 1.00 . A A . 12 GLY HA2 1 1 7 4673 1 1 12 GLY HA3 H 5.452 -0.319 -9.303 1.00 . A A . 12 GLY HA3 1 1 7 4674 1 1 12 GLY N N 3.695 -1.231 -8.665 1.00 . A A . 12 GLY N 1 1 7 4675 1 1 12 GLY O O 5.217 -1.977 -6.590 1.00 . A A . 12 GLY O 1 1 7 4676 1 1 13 ASN C C 7.711 0.219 -5.606 1.00 . A A . 13 ASN C 1 1 7 4677 1 1 13 ASN CA C 7.913 -1.134 -6.289 1.00 . A A . 13 ASN CA 1 1 7 4678 1 1 13 ASN CB C 9.396 -1.379 -6.596 1.00 . A A . 13 ASN CB 1 1 7 4679 1 1 13 ASN CG C 10.212 -1.628 -5.327 1.00 . A A . 13 ASN CG 1 1 7 4680 1 1 13 ASN H H 7.534 -0.732 -8.330 1.00 . A A . 13 ASN H 1 1 7 4681 1 1 13 ASN HA H 7.565 -1.939 -5.646 1.00 . A A . 13 ASN HA 1 1 7 4682 1 1 13 ASN HB2 H 9.479 -2.265 -7.227 1.00 . A A . 13 ASN HB2 1 1 7 4683 1 1 13 ASN HB3 H 9.809 -0.531 -7.141 1.00 . A A . 13 ASN HB3 1 1 7 4684 1 1 13 ASN HD21 H 10.412 0.388 -4.891 1.00 . A A . 13 ASN HD21 1 1 7 4685 1 1 13 ASN HD22 H 11.240 -0.728 -3.841 1.00 . A A . 13 ASN HD22 1 1 7 4686 1 1 13 ASN N N 7.126 -1.160 -7.511 1.00 . A A . 13 ASN N 1 1 7 4687 1 1 13 ASN ND2 N 10.655 -0.574 -4.647 1.00 . A A . 13 ASN ND2 1 1 7 4688 1 1 13 ASN O O 7.463 1.225 -6.268 1.00 . A A . 13 ASN O 1 1 7 4689 1 1 13 ASN OD1 O 10.448 -2.778 -4.954 1.00 . A A . 13 ASN OD1 1 1 7 4690 1 1 14 CYS C C 8.751 2.439 -3.790 1.00 . A A . 14 CYS C 1 1 7 4691 1 1 14 CYS CA C 7.697 1.399 -3.424 1.00 . A A . 14 CYS CA 1 1 7 4692 1 1 14 CYS CB C 7.915 0.939 -1.985 1.00 . A A . 14 CYS CB 1 1 7 4693 1 1 14 CYS H H 8.037 -0.636 -3.831 1.00 . A A . 14 CYS H 1 1 7 4694 1 1 14 CYS HA H 6.697 1.822 -3.516 1.00 . A A . 14 CYS HA 1 1 7 4695 1 1 14 CYS HB2 H 7.197 0.152 -1.751 1.00 . A A . 14 CYS HB2 1 1 7 4696 1 1 14 CYS HB3 H 8.922 0.536 -1.914 1.00 . A A . 14 CYS HB3 1 1 7 4697 1 1 14 CYS N N 7.799 0.234 -4.283 1.00 . A A . 14 CYS N 1 1 7 4698 1 1 14 CYS O O 9.807 2.095 -4.324 1.00 . A A . 14 CYS O 1 1 7 4699 1 1 14 CYS SG S 7.767 2.228 -0.729 1.00 . A A . 14 CYS SG 1 1 7 4700 1 1 15 GLY C C 9.514 5.422 -2.130 1.00 . A A . 15 GLY C 1 1 7 4701 1 1 15 GLY CA C 9.362 4.828 -3.527 1.00 . A A . 15 GLY CA 1 1 7 4702 1 1 15 GLY H H 7.562 3.838 -3.008 1.00 . A A . 15 GLY H 1 1 7 4703 1 1 15 GLY HA2 H 10.341 4.526 -3.887 1.00 . A A . 15 GLY HA2 1 1 7 4704 1 1 15 GLY HA3 H 8.955 5.583 -4.202 1.00 . A A . 15 GLY HA3 1 1 7 4705 1 1 15 GLY N N 8.451 3.695 -3.462 1.00 . A A . 15 GLY N 1 1 7 4706 1 1 15 GLY O O 10.620 5.595 -1.630 1.00 . A A . 15 GLY O 1 1 7 4707 1 1 16 ASN C C 6.980 5.691 0.503 1.00 . A A . 16 ASN C 1 1 7 4708 1 1 16 ASN CA C 8.306 6.141 -0.103 1.00 . A A . 16 ASN CA 1 1 7 4709 1 1 16 ASN CB C 8.478 7.662 -0.003 1.00 . A A . 16 ASN CB 1 1 7 4710 1 1 16 ASN CG C 8.741 8.117 1.428 1.00 . A A . 16 ASN CG 1 1 7 4711 1 1 16 ASN H H 7.507 5.538 -1.968 1.00 . A A . 16 ASN H 1 1 7 4712 1 1 16 ASN HA H 9.125 5.668 0.444 1.00 . A A . 16 ASN HA 1 1 7 4713 1 1 16 ASN HB2 H 9.338 7.957 -0.605 1.00 . A A . 16 ASN HB2 1 1 7 4714 1 1 16 ASN HB3 H 7.593 8.175 -0.379 1.00 . A A . 16 ASN HB3 1 1 7 4715 1 1 16 ASN HD21 H 9.900 9.674 0.805 1.00 . A A . 16 ASN HD21 1 1 7 4716 1 1 16 ASN HD22 H 9.683 9.510 2.532 1.00 . A A . 16 ASN HD22 1 1 7 4717 1 1 16 ASN N N 8.376 5.709 -1.492 1.00 . A A . 16 ASN N 1 1 7 4718 1 1 16 ASN ND2 N 9.492 9.200 1.595 1.00 . A A . 16 ASN ND2 1 1 7 4719 1 1 16 ASN O O 5.921 5.935 -0.074 1.00 . A A . 16 ASN O 1 1 7 4720 1 1 16 ASN OD1 O 8.253 7.517 2.383 1.00 . A A . 16 ASN OD1 1 1 7 4721 1 1 17 THR C C 4.931 5.835 2.715 1.00 . A A . 17 THR C 1 1 7 4722 1 1 17 THR CA C 5.848 4.637 2.418 1.00 . A A . 17 THR CA 1 1 7 4723 1 1 17 THR CB C 6.306 3.844 3.655 1.00 . A A . 17 THR CB 1 1 7 4724 1 1 17 THR CG2 C 6.892 4.728 4.760 1.00 . A A . 17 THR CG2 1 1 7 4725 1 1 17 THR H H 7.929 4.950 2.117 1.00 . A A . 17 THR H 1 1 7 4726 1 1 17 THR HA H 5.298 3.948 1.784 1.00 . A A . 17 THR HA 1 1 7 4727 1 1 17 THR HB H 7.083 3.158 3.316 1.00 . A A . 17 THR HB 1 1 7 4728 1 1 17 THR HG1 H 5.517 2.769 5.066 1.00 . A A . 17 THR HG1 1 1 7 4729 1 1 17 THR HG21 H 7.682 5.365 4.363 1.00 . A A . 17 THR HG21 1 1 7 4730 1 1 17 THR HG22 H 6.115 5.355 5.200 1.00 . A A . 17 THR HG22 1 1 7 4731 1 1 17 THR HG23 H 7.317 4.101 5.545 1.00 . A A . 17 THR HG23 1 1 7 4732 1 1 17 THR N N 7.028 5.060 1.677 1.00 . A A . 17 THR N 1 1 7 4733 1 1 17 THR O O 3.704 5.747 2.623 1.00 . A A . 17 THR O 1 1 7 4734 1 1 17 THR OG1 O 5.270 3.040 4.177 1.00 . A A . 17 THR OG1 1 1 7 4735 1 1 18 ALA C C 4.063 8.701 1.926 1.00 . A A . 18 ALA C 1 1 7 4736 1 1 18 ALA CA C 4.806 8.244 3.185 1.00 . A A . 18 ALA CA 1 1 7 4737 1 1 18 ALA CB C 5.772 9.327 3.673 1.00 . A A . 18 ALA CB 1 1 7 4738 1 1 18 ALA H H 6.548 7.038 2.995 1.00 . A A . 18 ALA H 1 1 7 4739 1 1 18 ALA HA H 4.057 8.080 3.964 1.00 . A A . 18 ALA HA 1 1 7 4740 1 1 18 ALA HB1 H 6.295 8.982 4.565 1.00 . A A . 18 ALA HB1 1 1 7 4741 1 1 18 ALA HB2 H 6.500 9.558 2.895 1.00 . A A . 18 ALA HB2 1 1 7 4742 1 1 18 ALA HB3 H 5.216 10.232 3.918 1.00 . A A . 18 ALA HB3 1 1 7 4743 1 1 18 ALA N N 5.532 7.000 2.979 1.00 . A A . 18 ALA N 1 1 7 4744 1 1 18 ALA O O 3.181 9.555 2.027 1.00 . A A . 18 ALA O 1 1 7 4745 1 1 19 HIS C C 2.646 7.199 -0.612 1.00 . A A . 19 HIS C 1 1 7 4746 1 1 19 HIS CA C 3.648 8.351 -0.480 1.00 . A A . 19 HIS CA 1 1 7 4747 1 1 19 HIS CB C 4.590 8.440 -1.686 1.00 . A A . 19 HIS CB 1 1 7 4748 1 1 19 HIS CD2 C 2.692 9.332 -3.249 1.00 . A A . 19 HIS CD2 1 1 7 4749 1 1 19 HIS CE1 C 3.851 9.417 -5.102 1.00 . A A . 19 HIS CE1 1 1 7 4750 1 1 19 HIS CG C 3.982 8.957 -2.968 1.00 . A A . 19 HIS CG 1 1 7 4751 1 1 19 HIS H H 5.151 7.482 0.725 1.00 . A A . 19 HIS H 1 1 7 4752 1 1 19 HIS HA H 3.095 9.291 -0.426 1.00 . A A . 19 HIS HA 1 1 7 4753 1 1 19 HIS HB2 H 5.403 9.108 -1.450 1.00 . A A . 19 HIS HB2 1 1 7 4754 1 1 19 HIS HB3 H 5.018 7.456 -1.850 1.00 . A A . 19 HIS HB3 1 1 7 4755 1 1 19 HIS HD1 H 5.718 8.954 -4.249 1.00 . A A . 19 HIS HD1 1 1 7 4756 1 1 19 HIS HD2 H 1.863 9.326 -2.553 1.00 . A A . 19 HIS HD2 1 1 7 4757 1 1 19 HIS HE1 H 4.107 9.524 -6.149 1.00 . A A . 19 HIS HE1 1 1 7 4758 1 1 19 HIS N N 4.420 8.183 0.745 1.00 . A A . 19 HIS N 1 1 7 4759 1 1 19 HIS ND1 N 4.726 9.111 -4.132 1.00 . A A . 19 HIS ND1 1 1 7 4760 1 1 19 HIS NE2 N 2.609 9.546 -4.611 1.00 . A A . 19 HIS NE2 1 1 7 4761 1 1 19 HIS O O 1.480 7.440 -0.914 1.00 . A A . 19 HIS O 1 1 7 4762 1 1 20 CYS C C 0.921 5.004 0.307 1.00 . A A . 20 CYS C 1 1 7 4763 1 1 20 CYS CA C 2.233 4.767 -0.425 1.00 . A A . 20 CYS CA 1 1 7 4764 1 1 20 CYS CB C 2.922 3.567 0.225 1.00 . A A . 20 CYS CB 1 1 7 4765 1 1 20 CYS H H 4.074 5.826 -0.170 1.00 . A A . 20 CYS H 1 1 7 4766 1 1 20 CYS HA H 2.011 4.527 -1.464 1.00 . A A . 20 CYS HA 1 1 7 4767 1 1 20 CYS HB2 H 3.823 3.309 -0.324 1.00 . A A . 20 CYS HB2 1 1 7 4768 1 1 20 CYS HB3 H 3.190 3.811 1.247 1.00 . A A . 20 CYS HB3 1 1 7 4769 1 1 20 CYS N N 3.090 5.954 -0.385 1.00 . A A . 20 CYS N 1 1 7 4770 1 1 20 CYS O O -0.158 4.774 -0.233 1.00 . A A . 20 CYS O 1 1 7 4771 1 1 20 CYS SG S 1.839 2.130 0.372 1.00 . A A . 20 CYS SG 1 1 7 4772 1 1 21 ASP C C -1.065 6.802 1.698 1.00 . A A . 21 ASP C 1 1 7 4773 1 1 21 ASP CA C -0.136 5.778 2.365 1.00 . A A . 21 ASP CA 1 1 7 4774 1 1 21 ASP CB C 0.361 6.317 3.709 1.00 . A A . 21 ASP CB 1 1 7 4775 1 1 21 ASP CG C -0.808 6.765 4.566 1.00 . A A . 21 ASP CG 1 1 7 4776 1 1 21 ASP H H 1.956 5.677 1.913 1.00 . A A . 21 ASP H 1 1 7 4777 1 1 21 ASP HA H -0.674 4.836 2.534 1.00 . A A . 21 ASP HA 1 1 7 4778 1 1 21 ASP HB2 H 0.918 5.542 4.237 1.00 . A A . 21 ASP HB2 1 1 7 4779 1 1 21 ASP HB3 H 1.022 7.169 3.544 1.00 . A A . 21 ASP HB3 1 1 7 4780 1 1 21 ASP N N 1.024 5.534 1.526 1.00 . A A . 21 ASP N 1 1 7 4781 1 1 21 ASP O O -2.286 6.673 1.777 1.00 . A A . 21 ASP O 1 1 7 4782 1 1 21 ASP OD1 O -1.622 5.925 4.942 1.00 . A A . 21 ASP OD1 1 1 7 4783 1 1 21 ASP OD2 O -0.873 8.097 4.829 1.00 . A A . 21 ASP OD2 1 1 7 4784 1 1 22 LYS C C -2.067 8.006 -0.823 1.00 . A A . 22 LYS C 1 1 7 4785 1 1 22 LYS CA C -1.322 8.756 0.263 1.00 . A A . 22 LYS CA 1 1 7 4786 1 1 22 LYS CB C -0.509 9.898 -0.357 1.00 . A A . 22 LYS CB 1 1 7 4787 1 1 22 LYS CD C 0.980 11.871 0.215 1.00 . A A . 22 LYS CD 1 1 7 4788 1 1 22 LYS CE C 1.503 12.767 1.348 1.00 . A A . 22 LYS CE 1 1 7 4789 1 1 22 LYS CG C 0.264 10.619 0.737 1.00 . A A . 22 LYS CG 1 1 7 4790 1 1 22 LYS H H 0.490 7.790 0.846 1.00 . A A . 22 LYS H 1 1 7 4791 1 1 22 LYS HA H -2.043 9.198 0.952 1.00 . A A . 22 LYS HA 1 1 7 4792 1 1 22 LYS HB2 H 0.173 9.523 -1.115 1.00 . A A . 22 LYS HB2 1 1 7 4793 1 1 22 LYS HB3 H -1.200 10.594 -0.833 1.00 . A A . 22 LYS HB3 1 1 7 4794 1 1 22 LYS HD2 H 1.807 11.562 -0.429 1.00 . A A . 22 LYS HD2 1 1 7 4795 1 1 22 LYS HD3 H 0.285 12.459 -0.390 1.00 . A A . 22 LYS HD3 1 1 7 4796 1 1 22 LYS HE2 H 2.220 13.479 0.929 1.00 . A A . 22 LYS HE2 1 1 7 4797 1 1 22 LYS HE3 H 0.670 13.331 1.771 1.00 . A A . 22 LYS HE3 1 1 7 4798 1 1 22 LYS HG2 H -0.455 10.870 1.515 1.00 . A A . 22 LYS HG2 1 1 7 4799 1 1 22 LYS HG3 H 0.986 9.901 1.108 1.00 . A A . 22 LYS HG3 1 1 7 4800 1 1 22 LYS HZ1 H 2.096 10.991 2.219 1.00 . A A . 22 LYS HZ1 1 1 7 4801 1 1 22 LYS HZ2 H 3.136 12.279 2.515 1.00 . A A . 22 LYS HZ2 1 1 7 4802 1 1 22 LYS N N -0.505 7.810 1.017 1.00 . A A . 22 LYS N 1 1 7 4803 1 1 22 LYS NZ N 2.149 11.998 2.433 1.00 . A A . 22 LYS NZ 1 1 7 4804 1 1 22 LYS O O -3.289 8.118 -0.931 1.00 . A A . 22 LYS O 1 1 7 4805 1 1 23 GLN C C -2.867 5.248 -2.196 1.00 . A A . 23 GLN C 1 1 7 4806 1 1 23 GLN CA C -2.020 6.443 -2.678 1.00 . A A . 23 GLN CA 1 1 7 4807 1 1 23 GLN CB C -1.046 6.030 -3.786 1.00 . A A . 23 GLN CB 1 1 7 4808 1 1 23 GLN CD C 0.488 7.074 -5.562 1.00 . A A . 23 GLN CD 1 1 7 4809 1 1 23 GLN CG C -0.128 7.193 -4.178 1.00 . A A . 23 GLN CG 1 1 7 4810 1 1 23 GLN H H -0.372 7.069 -1.403 1.00 . A A . 23 GLN H 1 1 7 4811 1 1 23 GLN HA H -2.675 7.165 -3.141 1.00 . A A . 23 GLN HA 1 1 7 4812 1 1 23 GLN HB2 H -0.454 5.179 -3.452 1.00 . A A . 23 GLN HB2 1 1 7 4813 1 1 23 GLN HB3 H -1.650 5.734 -4.646 1.00 . A A . 23 GLN HB3 1 1 7 4814 1 1 23 GLN HE21 H 0.051 5.087 -5.738 1.00 . A A . 23 GLN HE21 1 1 7 4815 1 1 23 GLN HE22 H 0.865 5.853 -7.087 1.00 . A A . 23 GLN HE22 1 1 7 4816 1 1 23 GLN HG2 H -0.700 8.117 -4.185 1.00 . A A . 23 GLN HG2 1 1 7 4817 1 1 23 GLN HG3 H 0.684 7.263 -3.462 1.00 . A A . 23 GLN HG3 1 1 7 4818 1 1 23 GLN N N -1.364 7.178 -1.599 1.00 . A A . 23 GLN N 1 1 7 4819 1 1 23 GLN NE2 N 0.467 5.897 -6.168 1.00 . A A . 23 GLN NE2 1 1 7 4820 1 1 23 GLN O O -3.008 4.261 -2.917 1.00 . A A . 23 GLN O 1 1 7 4821 1 1 23 GLN OE1 O 0.999 8.065 -6.080 1.00 . A A . 23 GLN OE1 1 1 7 4822 1 1 24 CYS C C -5.414 5.161 0.401 1.00 . A A . 24 CYS C 1 1 7 4823 1 1 24 CYS CA C -4.317 4.397 -0.347 1.00 . A A . 24 CYS CA 1 1 7 4824 1 1 24 CYS CB C -3.467 3.560 0.622 1.00 . A A . 24 CYS CB 1 1 7 4825 1 1 24 CYS H H -3.390 6.268 -0.556 1.00 . A A . 24 CYS H 1 1 7 4826 1 1 24 CYS HA H -4.789 3.729 -1.073 1.00 . A A . 24 CYS HA 1 1 7 4827 1 1 24 CYS HB2 H -2.896 4.224 1.269 1.00 . A A . 24 CYS HB2 1 1 7 4828 1 1 24 CYS HB3 H -4.126 2.967 1.247 1.00 . A A . 24 CYS HB3 1 1 7 4829 1 1 24 CYS N N -3.491 5.382 -1.023 1.00 . A A . 24 CYS N 1 1 7 4830 1 1 24 CYS O O -6.593 4.853 0.264 1.00 . A A . 24 CYS O 1 1 7 4831 1 1 24 CYS SG S -2.308 2.386 -0.119 1.00 . A A . 24 CYS SG 1 1 7 4832 1 1 25 GLN C C -6.672 8.029 0.786 1.00 . A A . 25 GLN C 1 1 7 4833 1 1 25 GLN CA C -6.060 7.053 1.795 1.00 . A A . 25 GLN CA 1 1 7 4834 1 1 25 GLN CB C -5.460 7.803 2.988 1.00 . A A . 25 GLN CB 1 1 7 4835 1 1 25 GLN CD C -4.433 7.676 5.209 1.00 . A A . 25 GLN CD 1 1 7 4836 1 1 25 GLN CG C -4.839 6.851 4.004 1.00 . A A . 25 GLN CG 1 1 7 4837 1 1 25 GLN H H -4.072 6.401 1.323 1.00 . A A . 25 GLN H 1 1 7 4838 1 1 25 GLN HA H -6.865 6.429 2.188 1.00 . A A . 25 GLN HA 1 1 7 4839 1 1 25 GLN HB2 H -4.696 8.515 2.678 1.00 . A A . 25 GLN HB2 1 1 7 4840 1 1 25 GLN HB3 H -6.245 8.352 3.515 1.00 . A A . 25 GLN HB3 1 1 7 4841 1 1 25 GLN HE21 H -5.788 6.748 6.431 1.00 . A A . 25 GLN HE21 1 1 7 4842 1 1 25 GLN HE22 H -5.028 8.229 7.016 1.00 . A A . 25 GLN HE22 1 1 7 4843 1 1 25 GLN HG2 H -5.582 6.105 4.283 1.00 . A A . 25 GLN HG2 1 1 7 4844 1 1 25 GLN HG3 H -3.964 6.357 3.590 1.00 . A A . 25 GLN HG3 1 1 7 4845 1 1 25 GLN N N -5.056 6.198 1.165 1.00 . A A . 25 GLN N 1 1 7 4846 1 1 25 GLN NE2 N -5.143 7.529 6.311 1.00 . A A . 25 GLN NE2 1 1 7 4847 1 1 25 GLN O O -7.887 8.232 0.767 1.00 . A A . 25 GLN O 1 1 7 4848 1 1 25 GLN OE1 O -3.526 8.499 5.132 1.00 . A A . 25 GLN OE1 1 1 7 4849 1 1 26 ASP C C -6.903 9.177 -2.177 1.00 . A A . 26 ASP C 1 1 7 4850 1 1 26 ASP CA C -6.289 9.753 -0.909 1.00 . A A . 26 ASP CA 1 1 7 4851 1 1 26 ASP CB C -5.147 10.720 -1.242 1.00 . A A . 26 ASP CB 1 1 7 4852 1 1 26 ASP CG C -4.636 11.467 -0.014 1.00 . A A . 26 ASP CG 1 1 7 4853 1 1 26 ASP H H -4.865 8.385 -0.104 1.00 . A A . 26 ASP H 1 1 7 4854 1 1 26 ASP HA H -7.048 10.341 -0.399 1.00 . A A . 26 ASP HA 1 1 7 4855 1 1 26 ASP HB2 H -4.325 10.191 -1.708 1.00 . A A . 26 ASP HB2 1 1 7 4856 1 1 26 ASP HB3 H -5.516 11.450 -1.960 1.00 . A A . 26 ASP HB3 1 1 7 4857 1 1 26 ASP N N -5.838 8.671 -0.042 1.00 . A A . 26 ASP N 1 1 7 4858 1 1 26 ASP O O -8.048 9.487 -2.503 1.00 . A A . 26 ASP O 1 1 7 4859 1 1 26 ASP OD1 O -5.536 12.270 0.616 1.00 . A A . 26 ASP OD1 1 1 7 4860 1 1 26 ASP OD2 O -3.472 11.319 0.346 1.00 . A A . 26 ASP OD2 1 1 7 4861 1 1 27 TRP C C -7.560 6.764 -4.075 1.00 . A A . 27 TRP C 1 1 7 4862 1 1 27 TRP CA C -6.471 7.832 -4.193 1.00 . A A . 27 TRP CA 1 1 7 4863 1 1 27 TRP CB C -5.224 7.219 -4.831 1.00 . A A . 27 TRP CB 1 1 7 4864 1 1 27 TRP CD1 C -3.800 9.340 -4.824 1.00 . A A . 27 TRP CD1 1 1 7 4865 1 1 27 TRP CD2 C -3.310 7.952 -6.505 1.00 . A A . 27 TRP CD2 1 1 7 4866 1 1 27 TRP CE2 C -2.405 9.045 -6.596 1.00 . A A . 27 TRP CE2 1 1 7 4867 1 1 27 TRP CE3 C -3.222 6.953 -7.495 1.00 . A A . 27 TRP CE3 1 1 7 4868 1 1 27 TRP CG C -4.167 8.149 -5.347 1.00 . A A . 27 TRP CG 1 1 7 4869 1 1 27 TRP CH2 C -1.332 8.074 -8.538 1.00 . A A . 27 TRP CH2 1 1 7 4870 1 1 27 TRP CZ2 C -1.434 9.122 -7.608 1.00 . A A . 27 TRP CZ2 1 1 7 4871 1 1 27 TRP CZ3 C -2.231 7.000 -8.489 1.00 . A A . 27 TRP CZ3 1 1 7 4872 1 1 27 TRP H H -5.199 8.177 -2.511 1.00 . A A . 27 TRP H 1 1 7 4873 1 1 27 TRP HA H -6.831 8.636 -4.837 1.00 . A A . 27 TRP HA 1 1 7 4874 1 1 27 TRP HB2 H -4.758 6.521 -4.137 1.00 . A A . 27 TRP HB2 1 1 7 4875 1 1 27 TRP HB3 H -5.570 6.646 -5.690 1.00 . A A . 27 TRP HB3 1 1 7 4876 1 1 27 TRP HD1 H -4.238 9.811 -3.959 1.00 . A A . 27 TRP HD1 1 1 7 4877 1 1 27 TRP HE1 H -2.298 10.750 -5.350 1.00 . A A . 27 TRP HE1 1 1 7 4878 1 1 27 TRP HE3 H -3.947 6.160 -7.498 1.00 . A A . 27 TRP HE3 1 1 7 4879 1 1 27 TRP HH2 H -0.570 8.080 -9.298 1.00 . A A . 27 TRP HH2 1 1 7 4880 1 1 27 TRP HZ2 H -0.758 9.963 -7.659 1.00 . A A . 27 TRP HZ2 1 1 7 4881 1 1 27 TRP HZ3 H -2.171 6.211 -9.226 1.00 . A A . 27 TRP HZ3 1 1 7 4882 1 1 27 TRP N N -6.126 8.346 -2.872 1.00 . A A . 27 TRP N 1 1 7 4883 1 1 27 TRP NE1 N -2.749 9.869 -5.546 1.00 . A A . 27 TRP NE1 1 1 7 4884 1 1 27 TRP O O -8.647 6.908 -4.629 1.00 . A A . 27 TRP O 1 1 7 4885 1 1 28 GLU C C -9.052 5.299 -1.797 1.00 . A A . 28 GLU C 1 1 7 4886 1 1 28 GLU CA C -8.220 4.682 -2.932 1.00 . A A . 28 GLU CA 1 1 7 4887 1 1 28 GLU CB C -7.451 3.413 -2.517 1.00 . A A . 28 GLU CB 1 1 7 4888 1 1 28 GLU CD C -7.543 2.056 -4.645 1.00 . A A . 28 GLU CD 1 1 7 4889 1 1 28 GLU CG C -6.643 2.777 -3.649 1.00 . A A . 28 GLU CG 1 1 7 4890 1 1 28 GLU H H -6.343 5.666 -2.907 1.00 . A A . 28 GLU H 1 1 7 4891 1 1 28 GLU HA H -8.893 4.449 -3.759 1.00 . A A . 28 GLU HA 1 1 7 4892 1 1 28 GLU HB2 H -6.755 3.685 -1.744 1.00 . A A . 28 GLU HB2 1 1 7 4893 1 1 28 GLU HB3 H -8.092 2.647 -2.098 1.00 . A A . 28 GLU HB3 1 1 7 4894 1 1 28 GLU HG2 H -6.044 3.533 -4.152 1.00 . A A . 28 GLU HG2 1 1 7 4895 1 1 28 GLU HG3 H -5.965 2.042 -3.215 1.00 . A A . 28 GLU HG3 1 1 7 4896 1 1 28 GLU N N -7.251 5.689 -3.343 1.00 . A A . 28 GLU N 1 1 7 4897 1 1 28 GLU O O -9.265 6.507 -1.783 1.00 . A A . 28 GLU O 1 1 7 4898 1 1 28 GLU OE1 O -7.950 0.929 -4.374 1.00 . A A . 28 GLU OE1 1 1 7 4899 1 1 28 GLU OE2 O -7.844 2.729 -5.787 1.00 . A A . 28 GLU OE2 1 1 7 4900 1 1 29 LYS C C -9.967 3.815 1.402 1.00 . A A . 29 LYS C 1 1 7 4901 1 1 29 LYS CA C -10.177 4.939 0.389 1.00 . A A . 29 LYS CA 1 1 7 4902 1 1 29 LYS CB C -11.679 5.171 0.106 1.00 . A A . 29 LYS CB 1 1 7 4903 1 1 29 LYS CD C -11.825 7.716 0.398 1.00 . A A . 29 LYS CD 1 1 7 4904 1 1 29 LYS CE C -11.403 8.987 -0.355 1.00 . A A . 29 LYS CE 1 1 7 4905 1 1 29 LYS CG C -12.070 6.513 -0.537 1.00 . A A . 29 LYS CG 1 1 7 4906 1 1 29 LYS H H -9.148 3.572 -0.757 1.00 . A A . 29 LYS H 1 1 7 4907 1 1 29 LYS HA H -9.683 5.818 0.773 1.00 . A A . 29 LYS HA 1 1 7 4908 1 1 29 LYS HB2 H -12.044 4.359 -0.523 1.00 . A A . 29 LYS HB2 1 1 7 4909 1 1 29 LYS HB3 H -12.214 5.118 1.054 1.00 . A A . 29 LYS HB3 1 1 7 4910 1 1 29 LYS HD2 H -12.754 7.916 0.937 1.00 . A A . 29 LYS HD2 1 1 7 4911 1 1 29 LYS HD3 H -11.069 7.482 1.150 1.00 . A A . 29 LYS HD3 1 1 7 4912 1 1 29 LYS HE2 H -12.096 9.174 -1.179 1.00 . A A . 29 LYS HE2 1 1 7 4913 1 1 29 LYS HE3 H -11.447 9.834 0.333 1.00 . A A . 29 LYS HE3 1 1 7 4914 1 1 29 LYS HG2 H -11.580 6.622 -1.501 1.00 . A A . 29 LYS HG2 1 1 7 4915 1 1 29 LYS HG3 H -13.140 6.474 -0.748 1.00 . A A . 29 LYS HG3 1 1 7 4916 1 1 29 LYS HZ1 H -9.842 7.904 -1.156 1.00 . A A . 29 LYS HZ1 1 1 7 4917 1 1 29 LYS HZ2 H -9.909 9.500 -1.681 1.00 . A A . 29 LYS HZ2 1 1 7 4918 1 1 29 LYS N N -9.444 4.524 -0.790 1.00 . A A . 29 LYS N 1 1 7 4919 1 1 29 LYS NZ N -10.025 8.876 -0.870 1.00 . A A . 29 LYS NZ 1 1 7 4920 1 1 29 LYS O O -10.895 3.177 1.893 1.00 . A A . 29 LYS O 1 1 7 4921 1 1 30 ALA C C -7.985 3.402 3.967 1.00 . A A . 30 ALA C 1 1 7 4922 1 1 30 ALA CA C -8.201 2.640 2.659 1.00 . A A . 30 ALA CA 1 1 7 4923 1 1 30 ALA CB C -6.895 2.046 2.139 1.00 . A A . 30 ALA CB 1 1 7 4924 1 1 30 ALA H H -7.991 4.162 1.220 1.00 . A A . 30 ALA H 1 1 7 4925 1 1 30 ALA HA H -8.927 1.843 2.808 1.00 . A A . 30 ALA HA 1 1 7 4926 1 1 30 ALA HB1 H -7.045 1.639 1.139 1.00 . A A . 30 ALA HB1 1 1 7 4927 1 1 30 ALA HB2 H -6.141 2.828 2.104 1.00 . A A . 30 ALA HB2 1 1 7 4928 1 1 30 ALA HB3 H -6.548 1.254 2.790 1.00 . A A . 30 ALA HB3 1 1 7 4929 1 1 30 ALA N N -8.685 3.570 1.665 1.00 . A A . 30 ALA N 1 1 7 4930 1 1 30 ALA O O -7.801 4.616 3.959 1.00 . A A . 30 ALA O 1 1 7 4931 1 1 31 SER C C -6.255 3.846 6.372 1.00 . A A . 31 SER C 1 1 7 4932 1 1 31 SER CA C -7.653 3.217 6.391 1.00 . A A . 31 SER CA 1 1 7 4933 1 1 31 SER CB C -7.756 2.057 7.378 1.00 . A A . 31 SER CB 1 1 7 4934 1 1 31 SER H H -8.041 1.679 5.082 1.00 . A A . 31 SER H 1 1 7 4935 1 1 31 SER HA H -8.385 3.969 6.670 1.00 . A A . 31 SER HA 1 1 7 4936 1 1 31 SER HB2 H -6.911 1.389 7.247 1.00 . A A . 31 SER HB2 1 1 7 4937 1 1 31 SER HB3 H -7.700 2.459 8.379 1.00 . A A . 31 SER HB3 1 1 7 4938 1 1 31 SER HG H -9.694 1.969 7.177 1.00 . A A . 31 SER HG 1 1 7 4939 1 1 31 SER N N -7.979 2.689 5.092 1.00 . A A . 31 SER N 1 1 7 4940 1 1 31 SER O O -6.077 4.965 6.845 1.00 . A A . 31 SER O 1 1 7 4941 1 1 31 SER OG O -8.968 1.336 7.178 1.00 . A A . 31 SER OG 1 1 7 4942 1 1 32 HIS C C -3.265 2.885 4.438 1.00 . A A . 32 HIS C 1 1 7 4943 1 1 32 HIS CA C -3.940 3.683 5.551 1.00 . A A . 32 HIS CA 1 1 7 4944 1 1 32 HIS CB C -3.086 3.721 6.830 1.00 . A A . 32 HIS CB 1 1 7 4945 1 1 32 HIS CD2 C -2.975 1.263 7.504 1.00 . A A . 32 HIS CD2 1 1 7 4946 1 1 32 HIS CE1 C -0.825 0.958 7.511 1.00 . A A . 32 HIS CE1 1 1 7 4947 1 1 32 HIS CG C -2.388 2.437 7.167 1.00 . A A . 32 HIS CG 1 1 7 4948 1 1 32 HIS H H -5.493 2.250 5.363 1.00 . A A . 32 HIS H 1 1 7 4949 1 1 32 HIS HA H -4.050 4.706 5.206 1.00 . A A . 32 HIS HA 1 1 7 4950 1 1 32 HIS HB2 H -2.303 4.448 6.723 1.00 . A A . 32 HIS HB2 1 1 7 4951 1 1 32 HIS HB3 H -3.698 4.037 7.677 1.00 . A A . 32 HIS HB3 1 1 7 4952 1 1 32 HIS HD1 H -0.308 2.874 6.774 1.00 . A A . 32 HIS HD1 1 1 7 4953 1 1 32 HIS HD2 H -4.034 1.151 7.435 1.00 . A A . 32 HIS HD2 1 1 7 4954 1 1 32 HIS HE1 H 0.136 0.472 7.576 1.00 . A A . 32 HIS HE1 1 1 7 4955 1 1 32 HIS N N -5.269 3.137 5.807 1.00 . A A . 32 HIS N 1 1 7 4956 1 1 32 HIS ND1 N -1.017 2.235 7.136 1.00 . A A . 32 HIS ND1 1 1 7 4957 1 1 32 HIS NE2 N -1.989 0.337 7.770 1.00 . A A . 32 HIS NE2 1 1 7 4958 1 1 32 HIS O O -3.838 1.914 3.940 1.00 . A A . 32 HIS O 1 1 7 4959 1 1 33 GLY C C 0.250 2.333 4.082 1.00 . A A . 33 GLY C 1 1 7 4960 1 1 33 GLY CA C -1.093 2.425 3.369 1.00 . A A . 33 GLY CA 1 1 7 4961 1 1 33 GLY H H -1.651 4.103 4.534 1.00 . A A . 33 GLY H 1 1 7 4962 1 1 33 GLY HA2 H -1.488 1.434 3.308 1.00 . A A . 33 GLY HA2 1 1 7 4963 1 1 33 GLY HA3 H -0.948 2.756 2.350 1.00 . A A . 33 GLY HA3 1 1 7 4964 1 1 33 GLY N N -2.025 3.257 4.113 1.00 . A A . 33 GLY N 1 1 7 4965 1 1 33 GLY O O 0.477 3.047 5.062 1.00 . A A . 33 GLY O 1 1 7 4966 1 1 34 ALA C C 3.224 0.292 3.167 1.00 . A A . 34 ALA C 1 1 7 4967 1 1 34 ALA CA C 2.461 1.221 4.118 1.00 . A A . 34 ALA CA 1 1 7 4968 1 1 34 ALA CB C 2.414 0.627 5.531 1.00 . A A . 34 ALA CB 1 1 7 4969 1 1 34 ALA H H 0.815 0.836 2.839 1.00 . A A . 34 ALA H 1 1 7 4970 1 1 34 ALA HA H 2.952 2.192 4.154 1.00 . A A . 34 ALA HA 1 1 7 4971 1 1 34 ALA HB1 H 1.810 -0.279 5.536 1.00 . A A . 34 ALA HB1 1 1 7 4972 1 1 34 ALA HB2 H 3.422 0.382 5.864 1.00 . A A . 34 ALA HB2 1 1 7 4973 1 1 34 ALA HB3 H 1.983 1.343 6.229 1.00 . A A . 34 ALA HB3 1 1 7 4974 1 1 34 ALA N N 1.109 1.423 3.619 1.00 . A A . 34 ALA N 1 1 7 4975 1 1 34 ALA O O 2.636 -0.652 2.638 1.00 . A A . 34 ALA O 1 1 7 4976 1 1 35 CYS C C 5.894 -1.499 2.865 1.00 . A A . 35 CYS C 1 1 7 4977 1 1 35 CYS CA C 5.362 -0.283 2.095 1.00 . A A . 35 CYS CA 1 1 7 4978 1 1 35 CYS CB C 6.510 0.553 1.533 1.00 . A A . 35 CYS CB 1 1 7 4979 1 1 35 CYS H H 4.959 1.362 3.346 1.00 . A A . 35 CYS H 1 1 7 4980 1 1 35 CYS HA H 4.779 -0.614 1.245 1.00 . A A . 35 CYS HA 1 1 7 4981 1 1 35 CYS HB2 H 7.022 1.083 2.332 1.00 . A A . 35 CYS HB2 1 1 7 4982 1 1 35 CYS HB3 H 7.215 -0.129 1.086 1.00 . A A . 35 CYS HB3 1 1 7 4983 1 1 35 CYS N N 4.517 0.546 2.938 1.00 . A A . 35 CYS N 1 1 7 4984 1 1 35 CYS O O 6.085 -1.427 4.081 1.00 . A A . 35 CYS O 1 1 7 4985 1 1 35 CYS SG S 6.005 1.715 0.243 1.00 . A A . 35 CYS SG 1 1 7 4986 1 1 36 HIS C C 7.539 -4.565 1.726 1.00 . A A . 36 HIS C 1 1 7 4987 1 1 36 HIS CA C 6.676 -3.858 2.756 1.00 . A A . 36 HIS CA 1 1 7 4988 1 1 36 HIS CB C 5.597 -4.871 3.111 1.00 . A A . 36 HIS CB 1 1 7 4989 1 1 36 HIS CD2 C 3.071 -4.603 3.416 1.00 . A A . 36 HIS CD2 1 1 7 4990 1 1 36 HIS CE1 C 3.089 -3.185 5.077 1.00 . A A . 36 HIS CE1 1 1 7 4991 1 1 36 HIS CG C 4.363 -4.305 3.729 1.00 . A A . 36 HIS CG 1 1 7 4992 1 1 36 HIS H H 5.863 -2.664 1.198 1.00 . A A . 36 HIS H 1 1 7 4993 1 1 36 HIS HA H 7.234 -3.636 3.661 1.00 . A A . 36 HIS HA 1 1 7 4994 1 1 36 HIS HB2 H 5.295 -5.397 2.204 1.00 . A A . 36 HIS HB2 1 1 7 4995 1 1 36 HIS HB3 H 6.020 -5.616 3.790 1.00 . A A . 36 HIS HB3 1 1 7 4996 1 1 36 HIS HD1 H 5.171 -2.806 5.033 1.00 . A A . 36 HIS HD1 1 1 7 4997 1 1 36 HIS HD2 H 2.801 -5.259 2.599 1.00 . A A . 36 HIS HD2 1 1 7 4998 1 1 36 HIS HE1 H 2.774 -2.498 5.846 1.00 . A A . 36 HIS HE1 1 1 7 4999 1 1 36 HIS N N 6.109 -2.633 2.185 1.00 . A A . 36 HIS N 1 1 7 5000 1 1 36 HIS ND1 N 4.369 -3.352 4.727 1.00 . A A . 36 HIS ND1 1 1 7 5001 1 1 36 HIS NE2 N 2.275 -3.986 4.363 1.00 . A A . 36 HIS NE2 1 1 7 5002 1 1 36 HIS O O 7.144 -4.618 0.567 1.00 . A A . 36 HIS O 1 1 7 5003 1 1 37 LYS C C 8.644 -7.492 1.309 1.00 . A A . 37 LYS C 1 1 7 5004 1 1 37 LYS CA C 9.340 -6.134 1.278 1.00 . A A . 37 LYS CA 1 1 7 5005 1 1 37 LYS CB C 10.814 -6.214 1.672 1.00 . A A . 37 LYS CB 1 1 7 5006 1 1 37 LYS CD C 13.023 -7.434 1.096 1.00 . A A . 37 LYS CD 1 1 7 5007 1 1 37 LYS CE C 14.197 -6.490 0.780 1.00 . A A . 37 LYS CE 1 1 7 5008 1 1 37 LYS CG C 11.661 -6.911 0.599 1.00 . A A . 37 LYS CG 1 1 7 5009 1 1 37 LYS H H 8.835 -5.228 3.137 1.00 . A A . 37 LYS H 1 1 7 5010 1 1 37 LYS HA H 9.337 -5.749 0.267 1.00 . A A . 37 LYS HA 1 1 7 5011 1 1 37 LYS HB2 H 11.163 -5.210 1.743 1.00 . A A . 37 LYS HB2 1 1 7 5012 1 1 37 LYS HB3 H 10.907 -6.665 2.650 1.00 . A A . 37 LYS HB3 1 1 7 5013 1 1 37 LYS HD2 H 12.978 -7.629 2.170 1.00 . A A . 37 LYS HD2 1 1 7 5014 1 1 37 LYS HD3 H 13.205 -8.391 0.607 1.00 . A A . 37 LYS HD3 1 1 7 5015 1 1 37 LYS HE2 H 13.999 -5.948 -0.147 1.00 . A A . 37 LYS HE2 1 1 7 5016 1 1 37 LYS HE3 H 14.287 -5.774 1.595 1.00 . A A . 37 LYS HE3 1 1 7 5017 1 1 37 LYS HG2 H 11.090 -7.763 0.275 1.00 . A A . 37 LYS HG2 1 1 7 5018 1 1 37 LYS HG3 H 11.762 -6.267 -0.277 1.00 . A A . 37 LYS HG3 1 1 7 5019 1 1 37 LYS HZ1 H 15.269 -8.231 0.478 1.00 . A A . 37 LYS HZ1 1 1 7 5020 1 1 37 LYS HZ2 H 15.942 -6.875 -0.256 1.00 . A A . 37 LYS HZ2 1 1 7 5021 1 1 37 LYS N N 8.613 -5.228 2.153 1.00 . A A . 37 LYS N 1 1 7 5022 1 1 37 LYS NZ N 15.466 -7.226 0.587 1.00 . A A . 37 LYS NZ 1 1 7 5023 1 1 37 LYS O O 8.468 -8.090 2.366 1.00 . A A . 37 LYS O 1 1 7 5024 1 1 38 ARG C C 8.136 -9.812 -1.360 1.00 . A A . 38 ARG C 1 1 7 5025 1 1 38 ARG CA C 7.532 -9.207 -0.099 1.00 . A A . 38 ARG CA 1 1 7 5026 1 1 38 ARG CB C 6.038 -8.890 -0.267 1.00 . A A . 38 ARG CB 1 1 7 5027 1 1 38 ARG CD C 5.013 -11.178 0.334 1.00 . A A . 38 ARG CD 1 1 7 5028 1 1 38 ARG CG C 5.141 -10.059 -0.713 1.00 . A A . 38 ARG CG 1 1 7 5029 1 1 38 ARG CZ C 2.668 -12.073 0.129 1.00 . A A . 38 ARG CZ 1 1 7 5030 1 1 38 ARG H H 8.409 -7.364 -0.680 1.00 . A A . 38 ARG H 1 1 7 5031 1 1 38 ARG HA H 7.676 -9.883 0.745 1.00 . A A . 38 ARG HA 1 1 7 5032 1 1 38 ARG HB2 H 5.665 -8.481 0.674 1.00 . A A . 38 ARG HB2 1 1 7 5033 1 1 38 ARG HB3 H 5.962 -8.112 -1.026 1.00 . A A . 38 ARG HB3 1 1 7 5034 1 1 38 ARG HD2 H 5.418 -12.112 -0.064 1.00 . A A . 38 ARG HD2 1 1 7 5035 1 1 38 ARG HD3 H 5.601 -10.921 1.218 1.00 . A A . 38 ARG HD3 1 1 7 5036 1 1 38 ARG HG2 H 4.154 -9.641 -0.920 1.00 . A A . 38 ARG HG2 1 1 7 5037 1 1 38 ARG HG3 H 5.521 -10.471 -1.648 1.00 . A A . 38 ARG HG3 1 1 7 5038 1 1 38 ARG HH11 H 3.786 -12.412 -1.562 1.00 . A A . 38 ARG HH11 1 1 7 5039 1 1 38 ARG HH12 H 2.202 -13.101 -1.590 1.00 . A A . 38 ARG HH12 1 1 7 5040 1 1 38 ARG HH21 H 1.290 -11.922 1.639 1.00 . A A . 38 ARG HH21 1 1 7 5041 1 1 38 ARG HH22 H 0.748 -12.790 0.244 1.00 . A A . 38 ARG HH22 1 1 7 5042 1 1 38 ARG N N 8.238 -7.956 0.128 1.00 . A A . 38 ARG N 1 1 7 5043 1 1 38 ARG NE N 3.620 -11.381 0.781 1.00 . A A . 38 ARG NE 1 1 7 5044 1 1 38 ARG NH1 N 2.896 -12.564 -1.093 1.00 . A A . 38 ARG NH1 1 1 7 5045 1 1 38 ARG NH2 N 1.477 -12.267 0.710 1.00 . A A . 38 ARG NH2 1 1 7 5046 1 1 38 ARG O O 8.191 -9.138 -2.385 1.00 . A A . 38 ARG O 1 1 7 5047 1 1 39 GLU C C 10.404 -10.861 -3.001 1.00 . A A . 39 GLU C 1 1 7 5048 1 1 39 GLU CA C 9.274 -11.728 -2.419 1.00 . A A . 39 GLU CA 1 1 7 5049 1 1 39 GLU CB C 8.196 -12.097 -3.455 1.00 . A A . 39 GLU CB 1 1 7 5050 1 1 39 GLU CD C 5.877 -13.108 -3.582 1.00 . A A . 39 GLU CD 1 1 7 5051 1 1 39 GLU CG C 7.223 -13.134 -2.872 1.00 . A A . 39 GLU CG 1 1 7 5052 1 1 39 GLU H H 8.579 -11.551 -0.412 1.00 . A A . 39 GLU H 1 1 7 5053 1 1 39 GLU HA H 9.732 -12.651 -2.063 1.00 . A A . 39 GLU HA 1 1 7 5054 1 1 39 GLU HB2 H 7.647 -11.202 -3.752 1.00 . A A . 39 GLU HB2 1 1 7 5055 1 1 39 GLU HB3 H 8.660 -12.518 -4.347 1.00 . A A . 39 GLU HB3 1 1 7 5056 1 1 39 GLU HG2 H 7.656 -14.129 -2.959 1.00 . A A . 39 GLU HG2 1 1 7 5057 1 1 39 GLU HG3 H 7.037 -12.941 -1.816 1.00 . A A . 39 GLU HG3 1 1 7 5058 1 1 39 GLU N N 8.639 -11.051 -1.288 1.00 . A A . 39 GLU N 1 1 7 5059 1 1 39 GLU O O 10.616 -10.810 -4.208 1.00 . A A . 39 GLU O 1 1 7 5060 1 1 39 GLU OE1 O 5.871 -13.516 -4.879 1.00 . A A . 39 GLU OE1 1 1 7 5061 1 1 39 GLU OE2 O 4.885 -12.719 -2.965 1.00 . A A . 39 GLU OE2 1 1 7 5062 1 1 40 ASN C C 11.756 -8.017 -3.228 1.00 . A A . 40 ASN C 1 1 7 5063 1 1 40 ASN CA C 12.187 -9.222 -2.392 1.00 . A A . 40 ASN CA 1 1 7 5064 1 1 40 ASN CB C 13.366 -9.947 -3.026 1.00 . A A . 40 ASN CB 1 1 7 5065 1 1 40 ASN CG C 14.673 -9.168 -2.858 1.00 . A A . 40 ASN CG 1 1 7 5066 1 1 40 ASN H H 10.946 -10.359 -1.147 1.00 . A A . 40 ASN H 1 1 7 5067 1 1 40 ASN HA H 12.498 -8.839 -1.428 1.00 . A A . 40 ASN HA 1 1 7 5068 1 1 40 ASN HB2 H 13.463 -10.930 -2.577 1.00 . A A . 40 ASN HB2 1 1 7 5069 1 1 40 ASN HB3 H 13.105 -10.085 -4.070 1.00 . A A . 40 ASN HB3 1 1 7 5070 1 1 40 ASN HD21 H 15.272 -9.608 -4.752 1.00 . A A . 40 ASN HD21 1 1 7 5071 1 1 40 ASN HD22 H 16.379 -8.633 -3.810 1.00 . A A . 40 ASN HD22 1 1 7 5072 1 1 40 ASN N N 11.117 -10.166 -2.112 1.00 . A A . 40 ASN N 1 1 7 5073 1 1 40 ASN ND2 N 15.510 -9.141 -3.891 1.00 . A A . 40 ASN ND2 1 1 7 5074 1 1 40 ASN O O 12.597 -7.353 -3.827 1.00 . A A . 40 ASN O 1 1 7 5075 1 1 40 ASN OD1 O 14.941 -8.603 -1.794 1.00 . A A . 40 ASN OD1 1 1 7 5076 1 1 41 HIS C C 9.274 -5.682 -2.845 1.00 . A A . 41 HIS C 1 1 7 5077 1 1 41 HIS CA C 9.913 -6.543 -3.919 1.00 . A A . 41 HIS CA 1 1 7 5078 1 1 41 HIS CB C 8.898 -6.986 -4.968 1.00 . A A . 41 HIS CB 1 1 7 5079 1 1 41 HIS CD2 C 9.498 -9.148 -6.277 1.00 . A A . 41 HIS CD2 1 1 7 5080 1 1 41 HIS CE1 C 10.936 -8.293 -7.677 1.00 . A A . 41 HIS CE1 1 1 7 5081 1 1 41 HIS CG C 9.565 -7.799 -6.052 1.00 . A A . 41 HIS CG 1 1 7 5082 1 1 41 HIS H H 9.785 -8.284 -2.766 1.00 . A A . 41 HIS H 1 1 7 5083 1 1 41 HIS HA H 10.697 -5.990 -4.428 1.00 . A A . 41 HIS HA 1 1 7 5084 1 1 41 HIS HB2 H 8.133 -7.582 -4.472 1.00 . A A . 41 HIS HB2 1 1 7 5085 1 1 41 HIS HB3 H 8.408 -6.109 -5.387 1.00 . A A . 41 HIS HB3 1 1 7 5086 1 1 41 HIS HD1 H 10.722 -6.287 -7.059 1.00 . A A . 41 HIS HD1 1 1 7 5087 1 1 41 HIS HD2 H 8.961 -9.858 -5.667 1.00 . A A . 41 HIS HD2 1 1 7 5088 1 1 41 HIS HE1 H 11.688 -8.206 -8.450 1.00 . A A . 41 HIS HE1 1 1 7 5089 1 1 41 HIS N N 10.458 -7.712 -3.263 1.00 . A A . 41 HIS N 1 1 7 5090 1 1 41 HIS ND1 N 10.448 -7.257 -6.974 1.00 . A A . 41 HIS ND1 1 1 7 5091 1 1 41 HIS NE2 N 10.387 -9.456 -7.289 1.00 . A A . 41 HIS NE2 1 1 7 5092 1 1 41 HIS O O 8.437 -6.176 -2.089 1.00 . A A . 41 HIS O 1 1 7 5093 1 1 42 TRP C C 7.700 -3.092 -2.363 1.00 . A A . 42 TRP C 1 1 7 5094 1 1 42 TRP CA C 9.053 -3.508 -1.805 1.00 . A A . 42 TRP CA 1 1 7 5095 1 1 42 TRP CB C 9.979 -2.343 -1.477 1.00 . A A . 42 TRP CB 1 1 7 5096 1 1 42 TRP CD1 C 12.181 -3.230 -0.607 1.00 . A A . 42 TRP CD1 1 1 7 5097 1 1 42 TRP CD2 C 10.834 -2.504 1.027 1.00 . A A . 42 TRP CD2 1 1 7 5098 1 1 42 TRP CE2 C 12.026 -2.970 1.647 1.00 . A A . 42 TRP CE2 1 1 7 5099 1 1 42 TRP CE3 C 9.775 -2.131 1.879 1.00 . A A . 42 TRP CE3 1 1 7 5100 1 1 42 TRP CG C 10.974 -2.664 -0.413 1.00 . A A . 42 TRP CG 1 1 7 5101 1 1 42 TRP CH2 C 11.090 -2.671 3.859 1.00 . A A . 42 TRP CH2 1 1 7 5102 1 1 42 TRP CZ2 C 12.151 -3.083 3.038 1.00 . A A . 42 TRP CZ2 1 1 7 5103 1 1 42 TRP CZ3 C 9.912 -2.169 3.278 1.00 . A A . 42 TRP CZ3 1 1 7 5104 1 1 42 TRP H H 10.284 -4.013 -3.452 1.00 . A A . 42 TRP H 1 1 7 5105 1 1 42 TRP HA H 8.889 -4.011 -0.866 1.00 . A A . 42 TRP HA 1 1 7 5106 1 1 42 TRP HB2 H 10.489 -1.994 -2.370 1.00 . A A . 42 TRP HB2 1 1 7 5107 1 1 42 TRP HB3 H 9.382 -1.527 -1.086 1.00 . A A . 42 TRP HB3 1 1 7 5108 1 1 42 TRP HD1 H 12.548 -3.560 -1.564 1.00 . A A . 42 TRP HD1 1 1 7 5109 1 1 42 TRP HE1 H 13.730 -3.800 0.750 1.00 . A A . 42 TRP HE1 1 1 7 5110 1 1 42 TRP HE3 H 8.825 -1.881 1.446 1.00 . A A . 42 TRP HE3 1 1 7 5111 1 1 42 TRP HH2 H 11.150 -2.782 4.931 1.00 . A A . 42 TRP HH2 1 1 7 5112 1 1 42 TRP HZ2 H 13.011 -3.593 3.446 1.00 . A A . 42 TRP HZ2 1 1 7 5113 1 1 42 TRP HZ3 H 9.091 -1.849 3.906 1.00 . A A . 42 TRP HZ3 1 1 7 5114 1 1 42 TRP N N 9.679 -4.417 -2.744 1.00 . A A . 42 TRP N 1 1 7 5115 1 1 42 TRP NE1 N 12.826 -3.383 0.604 1.00 . A A . 42 TRP NE1 1 1 7 5116 1 1 42 TRP O O 7.634 -2.235 -3.230 1.00 . A A . 42 TRP O 1 1 7 5117 1 1 43 LYS C C 4.727 -2.295 -1.386 1.00 . A A . 43 LYS C 1 1 7 5118 1 1 43 LYS CA C 5.275 -3.357 -2.316 1.00 . A A . 43 LYS CA 1 1 7 5119 1 1 43 LYS CB C 4.376 -4.588 -2.209 1.00 . A A . 43 LYS CB 1 1 7 5120 1 1 43 LYS CD C 5.416 -5.614 -4.339 1.00 . A A . 43 LYS CD 1 1 7 5121 1 1 43 LYS CE C 4.222 -5.374 -5.293 1.00 . A A . 43 LYS CE 1 1 7 5122 1 1 43 LYS CG C 5.007 -5.805 -2.862 1.00 . A A . 43 LYS CG 1 1 7 5123 1 1 43 LYS H H 6.711 -4.435 -1.205 1.00 . A A . 43 LYS H 1 1 7 5124 1 1 43 LYS HA H 5.279 -2.985 -3.340 1.00 . A A . 43 LYS HA 1 1 7 5125 1 1 43 LYS HB2 H 4.296 -4.833 -1.152 1.00 . A A . 43 LYS HB2 1 1 7 5126 1 1 43 LYS HB3 H 3.376 -4.391 -2.591 1.00 . A A . 43 LYS HB3 1 1 7 5127 1 1 43 LYS HD2 H 6.168 -4.832 -4.445 1.00 . A A . 43 LYS HD2 1 1 7 5128 1 1 43 LYS HD3 H 5.881 -6.554 -4.643 1.00 . A A . 43 LYS HD3 1 1 7 5129 1 1 43 LYS HE2 H 4.533 -5.635 -6.309 1.00 . A A . 43 LYS HE2 1 1 7 5130 1 1 43 LYS HE3 H 3.406 -6.044 -5.013 1.00 . A A . 43 LYS HE3 1 1 7 5131 1 1 43 LYS HG2 H 5.820 -6.085 -2.189 1.00 . A A . 43 LYS HG2 1 1 7 5132 1 1 43 LYS HG3 H 4.323 -6.633 -2.811 1.00 . A A . 43 LYS HG3 1 1 7 5133 1 1 43 LYS HZ1 H 4.175 -3.465 -6.087 1.00 . A A . 43 LYS HZ1 1 1 7 5134 1 1 43 LYS HZ2 H 2.711 -3.968 -5.429 1.00 . A A . 43 LYS HZ2 1 1 7 5135 1 1 43 LYS N N 6.614 -3.708 -1.909 1.00 . A A . 43 LYS N 1 1 7 5136 1 1 43 LYS NZ N 3.735 -3.974 -5.309 1.00 . A A . 43 LYS NZ 1 1 7 5137 1 1 43 LYS O O 4.663 -2.511 -0.178 1.00 . A A . 43 LYS O 1 1 7 5138 1 1 44 CYS C C 1.990 -1.319 -1.096 1.00 . A A . 44 CYS C 1 1 7 5139 1 1 44 CYS CA C 3.209 -0.422 -1.301 1.00 . A A . 44 CYS CA 1 1 7 5140 1 1 44 CYS CB C 2.874 0.801 -2.141 1.00 . A A . 44 CYS CB 1 1 7 5141 1 1 44 CYS H H 4.346 -1.097 -2.955 1.00 . A A . 44 CYS H 1 1 7 5142 1 1 44 CYS HA H 3.562 -0.065 -0.340 1.00 . A A . 44 CYS HA 1 1 7 5143 1 1 44 CYS HB2 H 3.722 1.478 -2.048 1.00 . A A . 44 CYS HB2 1 1 7 5144 1 1 44 CYS HB3 H 2.736 0.518 -3.182 1.00 . A A . 44 CYS HB3 1 1 7 5145 1 1 44 CYS N N 4.242 -1.200 -1.959 1.00 . A A . 44 CYS N 1 1 7 5146 1 1 44 CYS O O 1.582 -1.996 -2.036 1.00 . A A . 44 CYS O 1 1 7 5147 1 1 44 CYS SG S 1.383 1.659 -1.597 1.00 . A A . 44 CYS SG 1 1 7 5148 1 1 45 PHE C C -0.740 -1.015 1.037 1.00 . A A . 45 PHE C 1 1 7 5149 1 1 45 PHE CA C 0.218 -2.052 0.461 1.00 . A A . 45 PHE CA 1 1 7 5150 1 1 45 PHE CB C 0.481 -3.150 1.499 1.00 . A A . 45 PHE CB 1 1 7 5151 1 1 45 PHE CD1 C 1.793 -4.897 0.209 1.00 . A A . 45 PHE CD1 1 1 7 5152 1 1 45 PHE CD2 C -0.356 -5.512 1.155 1.00 . A A . 45 PHE CD2 1 1 7 5153 1 1 45 PHE CE1 C 1.973 -6.224 -0.226 1.00 . A A . 45 PHE CE1 1 1 7 5154 1 1 45 PHE CE2 C -0.187 -6.832 0.707 1.00 . A A . 45 PHE CE2 1 1 7 5155 1 1 45 PHE CG C 0.645 -4.549 0.938 1.00 . A A . 45 PHE CG 1 1 7 5156 1 1 45 PHE CZ C 0.986 -7.191 0.023 1.00 . A A . 45 PHE CZ 1 1 7 5157 1 1 45 PHE H H 1.881 -0.831 0.879 1.00 . A A . 45 PHE H 1 1 7 5158 1 1 45 PHE HA H -0.239 -2.492 -0.430 1.00 . A A . 45 PHE HA 1 1 7 5159 1 1 45 PHE HB2 H 1.366 -2.872 2.064 1.00 . A A . 45 PHE HB2 1 1 7 5160 1 1 45 PHE HB3 H -0.343 -3.182 2.212 1.00 . A A . 45 PHE HB3 1 1 7 5161 1 1 45 PHE HD1 H 2.540 -4.140 0.019 1.00 . A A . 45 PHE HD1 1 1 7 5162 1 1 45 PHE HD2 H -1.288 -5.220 1.607 1.00 . A A . 45 PHE HD2 1 1 7 5163 1 1 45 PHE HE1 H 2.871 -6.515 -0.750 1.00 . A A . 45 PHE HE1 1 1 7 5164 1 1 45 PHE HE2 H -0.966 -7.563 0.873 1.00 . A A . 45 PHE HE2 1 1 7 5165 1 1 45 PHE HZ H 1.119 -8.205 -0.324 1.00 . A A . 45 PHE HZ 1 1 7 5166 1 1 45 PHE N N 1.461 -1.374 0.128 1.00 . A A . 45 PHE N 1 1 7 5167 1 1 45 PHE O O -0.303 -0.058 1.677 1.00 . A A . 45 PHE O 1 1 7 5168 1 1 46 CYS C C -3.849 -1.345 2.399 1.00 . A A . 46 CYS C 1 1 7 5169 1 1 46 CYS CA C -3.134 -0.468 1.389 1.00 . A A . 46 CYS CA 1 1 7 5170 1 1 46 CYS CB C -4.109 -0.089 0.269 1.00 . A A . 46 CYS CB 1 1 7 5171 1 1 46 CYS H H -2.298 -2.115 0.389 1.00 . A A . 46 CYS H 1 1 7 5172 1 1 46 CYS HA H -2.808 0.412 1.951 1.00 . A A . 46 CYS HA 1 1 7 5173 1 1 46 CYS HB2 H -4.460 -1.006 -0.201 1.00 . A A . 46 CYS HB2 1 1 7 5174 1 1 46 CYS HB3 H -4.960 0.401 0.728 1.00 . A A . 46 CYS HB3 1 1 7 5175 1 1 46 CYS N N -2.036 -1.242 0.837 1.00 . A A . 46 CYS N 1 1 7 5176 1 1 46 CYS O O -3.705 -2.564 2.382 1.00 . A A . 46 CYS O 1 1 7 5177 1 1 46 CYS SG S -3.528 0.992 -1.064 1.00 . A A . 46 CYS SG 1 1 7 5178 1 1 47 TYR C C -6.611 -0.782 4.564 1.00 . A A . 47 TYR C 1 1 7 5179 1 1 47 TYR CA C -5.228 -1.380 4.422 1.00 . A A . 47 TYR CA 1 1 7 5180 1 1 47 TYR CB C -4.416 -1.061 5.671 1.00 . A A . 47 TYR CB 1 1 7 5181 1 1 47 TYR CD1 C -1.966 -1.313 5.059 1.00 . A A . 47 TYR CD1 1 1 7 5182 1 1 47 TYR CD2 C -2.963 -2.849 6.666 1.00 . A A . 47 TYR CD2 1 1 7 5183 1 1 47 TYR CE1 C -0.708 -1.887 5.289 1.00 . A A . 47 TYR CE1 1 1 7 5184 1 1 47 TYR CE2 C -1.697 -3.382 6.940 1.00 . A A . 47 TYR CE2 1 1 7 5185 1 1 47 TYR CG C -3.087 -1.763 5.782 1.00 . A A . 47 TYR CG 1 1 7 5186 1 1 47 TYR CZ C -0.568 -2.873 6.280 1.00 . A A . 47 TYR CZ 1 1 7 5187 1 1 47 TYR H H -4.588 0.299 3.312 1.00 . A A . 47 TYR H 1 1 7 5188 1 1 47 TYR HA H -5.303 -2.455 4.293 1.00 . A A . 47 TYR HA 1 1 7 5189 1 1 47 TYR HB2 H -4.233 0.007 5.643 1.00 . A A . 47 TYR HB2 1 1 7 5190 1 1 47 TYR HB3 H -5.006 -1.281 6.563 1.00 . A A . 47 TYR HB3 1 1 7 5191 1 1 47 TYR HD1 H -2.059 -0.499 4.358 1.00 . A A . 47 TYR HD1 1 1 7 5192 1 1 47 TYR HD2 H -3.830 -3.246 7.171 1.00 . A A . 47 TYR HD2 1 1 7 5193 1 1 47 TYR HE1 H 0.142 -1.559 4.713 1.00 . A A . 47 TYR HE1 1 1 7 5194 1 1 47 TYR HE2 H -1.601 -4.178 7.664 1.00 . A A . 47 TYR HE2 1 1 7 5195 1 1 47 TYR HH H 0.619 -4.065 7.241 1.00 . A A . 47 TYR HH 1 1 7 5196 1 1 47 TYR N N -4.585 -0.718 3.308 1.00 . A A . 47 TYR N 1 1 7 5197 1 1 47 TYR O O -6.728 0.332 5.065 1.00 . A A . 47 TYR O 1 1 7 5198 1 1 47 TYR OH O 0.663 -3.330 6.623 1.00 . A A . 47 TYR OH 1 1 7 5199 1 1 48 PHE C C -9.624 -1.610 5.498 1.00 . A A . 48 PHE C 1 1 7 5200 1 1 48 PHE CA C -9.004 -1.023 4.228 1.00 . A A . 48 PHE CA 1 1 7 5201 1 1 48 PHE CB C -9.696 -1.547 2.966 1.00 . A A . 48 PHE CB 1 1 7 5202 1 1 48 PHE CD1 C -7.978 -1.593 1.090 1.00 . A A . 48 PHE CD1 1 1 7 5203 1 1 48 PHE CD2 C -9.847 -0.041 0.928 1.00 . A A . 48 PHE CD2 1 1 7 5204 1 1 48 PHE CE1 C -7.538 -1.195 -0.183 1.00 . A A . 48 PHE CE1 1 1 7 5205 1 1 48 PHE CE2 C -9.415 0.345 -0.351 1.00 . A A . 48 PHE CE2 1 1 7 5206 1 1 48 PHE CG C -9.152 -1.036 1.641 1.00 . A A . 48 PHE CG 1 1 7 5207 1 1 48 PHE CZ C -8.264 -0.236 -0.910 1.00 . A A . 48 PHE CZ 1 1 7 5208 1 1 48 PHE H H -7.538 -2.427 3.758 1.00 . A A . 48 PHE H 1 1 7 5209 1 1 48 PHE HA H -9.066 0.062 4.256 1.00 . A A . 48 PHE HA 1 1 7 5210 1 1 48 PHE HB2 H -9.632 -2.631 2.948 1.00 . A A . 48 PHE HB2 1 1 7 5211 1 1 48 PHE HB3 H -10.742 -1.310 3.045 1.00 . A A . 48 PHE HB3 1 1 7 5212 1 1 48 PHE HD1 H -7.433 -2.365 1.614 1.00 . A A . 48 PHE HD1 1 1 7 5213 1 1 48 PHE HD2 H -10.723 0.433 1.356 1.00 . A A . 48 PHE HD2 1 1 7 5214 1 1 48 PHE HE1 H -6.658 -1.646 -0.615 1.00 . A A . 48 PHE HE1 1 1 7 5215 1 1 48 PHE HE2 H -9.968 1.092 -0.903 1.00 . A A . 48 PHE HE2 1 1 7 5216 1 1 48 PHE HZ H -7.926 0.071 -1.891 1.00 . A A . 48 PHE HZ 1 1 7 5217 1 1 48 PHE N N -7.647 -1.495 4.137 1.00 . A A . 48 PHE N 1 1 7 5218 1 1 48 PHE O O -8.991 -2.411 6.182 1.00 . A A . 48 PHE O 1 1 7 5219 1 1 49 ASN C C -11.131 -2.082 8.145 1.00 . A A . 49 ASN C 1 1 7 5220 1 1 49 ASN CA C -11.735 -2.022 6.728 1.00 . A A . 49 ASN CA 1 1 7 5221 1 1 49 ASN CB C -12.053 -3.434 6.193 1.00 . A A . 49 ASN CB 1 1 7 5222 1 1 49 ASN CG C -12.738 -3.396 4.830 1.00 . A A . 49 ASN CG 1 1 7 5223 1 1 49 ASN H H -11.362 -0.644 5.155 1.00 . A A . 49 ASN H 1 1 7 5224 1 1 49 ASN HA H -12.670 -1.468 6.817 1.00 . A A . 49 ASN HA 1 1 7 5225 1 1 49 ASN HB2 H -11.129 -4.004 6.090 1.00 . A A . 49 ASN HB2 1 1 7 5226 1 1 49 ASN HB3 H -12.696 -3.973 6.888 1.00 . A A . 49 ASN HB3 1 1 7 5227 1 1 49 ASN HD21 H -14.576 -3.073 5.655 1.00 . A A . 49 ASN HD21 1 1 7 5228 1 1 49 ASN HD22 H -14.513 -3.164 3.906 1.00 . A A . 49 ASN HD22 1 1 7 5229 1 1 49 ASN N N -10.904 -1.320 5.748 1.00 . A A . 49 ASN N 1 1 7 5230 1 1 49 ASN ND2 N -14.050 -3.187 4.803 1.00 . A A . 49 ASN ND2 1 1 7 5231 1 1 49 ASN O O -11.530 -2.933 8.943 1.00 . A A . 49 ASN O 1 1 7 5232 1 1 49 ASN OD1 O -12.085 -3.540 3.800 1.00 . A A . 49 ASN OD1 1 1 7 5233 1 1 50 CYS C C -9.940 -0.803 10.911 1.00 . A A . 50 CYS C 1 1 7 5234 1 1 50 CYS CA C -9.325 -1.405 9.654 1.00 . A A . 50 CYS CA 1 1 7 5235 1 1 50 CYS CB C -7.929 -0.871 9.366 1.00 . A A . 50 CYS CB 1 1 7 5236 1 1 50 CYS H H -9.906 -0.489 7.821 1.00 . A A . 50 CYS H 1 1 7 5237 1 1 50 CYS HA H -9.201 -2.460 9.841 1.00 . A A . 50 CYS HA 1 1 7 5238 1 1 50 CYS HB2 H -7.585 -1.273 8.413 1.00 . A A . 50 CYS HB2 1 1 7 5239 1 1 50 CYS HB3 H -8.016 0.198 9.281 1.00 . A A . 50 CYS HB3 1 1 7 5240 1 1 50 CYS N N -10.175 -1.210 8.481 1.00 . A A . 50 CYS N 1 1 7 5241 1 1 50 CYS O O -10.393 -1.577 11.811 1.00 . A A . 50 CYS O 1 1 7 5242 1 1 50 CYS OXT O -10.000 0.457 11.056 1.00 . A A . 50 CYS OXT 1 1 7 5243 1 1 50 CYS SG S -6.631 -1.192 10.583 1.00 . A A . 50 CYS SG 1 1 8 5244 1 1 1 LEU C C -9.546 -4.992 9.518 1.00 . A A . 1 LEU C 1 1 8 5245 1 1 1 LEU CA C -10.505 -5.464 10.607 1.00 . A A . 1 LEU CA 1 1 8 5246 1 1 1 LEU CB C -10.430 -6.987 10.806 1.00 . A A . 1 LEU CB 1 1 8 5247 1 1 1 LEU CD1 C -8.636 -6.975 12.617 1.00 . A A . 1 LEU CD1 1 1 8 5248 1 1 1 LEU CD2 C -9.109 -9.048 11.311 1.00 . A A . 1 LEU CD2 1 1 8 5249 1 1 1 LEU CG C -9.053 -7.518 11.245 1.00 . A A . 1 LEU CG 1 1 8 5250 1 1 1 LEU H1 H -11.912 -4.043 10.118 1.00 . A A . 1 LEU H1 1 1 8 5251 1 1 1 LEU H2 H -12.107 -5.507 9.314 1.00 . A A . 1 LEU H2 1 1 8 5252 1 1 1 LEU H3 H -12.536 -5.375 10.935 1.00 . A A . 1 LEU H3 1 1 8 5253 1 1 1 LEU HA H -10.274 -4.957 11.544 1.00 . A A . 1 LEU HA 1 1 8 5254 1 1 1 LEU HB2 H -11.167 -7.280 11.554 1.00 . A A . 1 LEU HB2 1 1 8 5255 1 1 1 LEU HB3 H -10.693 -7.467 9.861 1.00 . A A . 1 LEU HB3 1 1 8 5256 1 1 1 LEU HD11 H -9.397 -7.207 13.361 1.00 . A A . 1 LEU HD11 1 1 8 5257 1 1 1 LEU HD12 H -7.695 -7.440 12.921 1.00 . A A . 1 LEU HD12 1 1 8 5258 1 1 1 LEU HD13 H -8.483 -5.897 12.584 1.00 . A A . 1 LEU HD13 1 1 8 5259 1 1 1 LEU HD21 H -9.376 -9.455 10.336 1.00 . A A . 1 LEU HD21 1 1 8 5260 1 1 1 LEU HD22 H -8.132 -9.442 11.596 1.00 . A A . 1 LEU HD22 1 1 8 5261 1 1 1 LEU HD23 H -9.848 -9.367 12.047 1.00 . A A . 1 LEU HD23 1 1 8 5262 1 1 1 LEU HG H -8.295 -7.253 10.507 1.00 . A A . 1 LEU HG 1 1 8 5263 1 1 1 LEU N N -11.867 -5.067 10.214 1.00 . A A . 1 LEU N 1 1 8 5264 1 1 1 LEU O O -9.971 -4.915 8.369 1.00 . A A . 1 LEU O 1 1 8 5265 1 1 2 CYS C C -6.923 -5.063 7.849 1.00 . A A . 2 CYS C 1 1 8 5266 1 1 2 CYS CA C -7.316 -4.087 8.960 1.00 . A A . 2 CYS CA 1 1 8 5267 1 1 2 CYS CB C -6.118 -3.500 9.729 1.00 . A A . 2 CYS CB 1 1 8 5268 1 1 2 CYS H H -8.020 -4.741 10.831 1.00 . A A . 2 CYS H 1 1 8 5269 1 1 2 CYS HA H -7.789 -3.234 8.487 1.00 . A A . 2 CYS HA 1 1 8 5270 1 1 2 CYS HB2 H -5.451 -4.316 10.004 1.00 . A A . 2 CYS HB2 1 1 8 5271 1 1 2 CYS HB3 H -5.576 -2.821 9.080 1.00 . A A . 2 CYS HB3 1 1 8 5272 1 1 2 CYS N N -8.304 -4.649 9.869 1.00 . A A . 2 CYS N 1 1 8 5273 1 1 2 CYS O O -5.889 -5.723 7.921 1.00 . A A . 2 CYS O 1 1 8 5274 1 1 2 CYS SG S -6.512 -2.642 11.278 1.00 . A A . 2 CYS SG 1 1 8 5275 1 1 3 ASN C C -6.414 -5.467 4.798 1.00 . A A . 3 ASN C 1 1 8 5276 1 1 3 ASN CA C -7.524 -6.030 5.675 1.00 . A A . 3 ASN CA 1 1 8 5277 1 1 3 ASN CB C -8.804 -6.323 4.875 1.00 . A A . 3 ASN CB 1 1 8 5278 1 1 3 ASN CG C -10.001 -6.706 5.742 1.00 . A A . 3 ASN CG 1 1 8 5279 1 1 3 ASN H H -8.574 -4.540 6.821 1.00 . A A . 3 ASN H 1 1 8 5280 1 1 3 ASN HA H -7.199 -6.993 6.072 1.00 . A A . 3 ASN HA 1 1 8 5281 1 1 3 ASN HB2 H -9.076 -5.430 4.312 1.00 . A A . 3 ASN HB2 1 1 8 5282 1 1 3 ASN HB3 H -8.617 -7.118 4.154 1.00 . A A . 3 ASN HB3 1 1 8 5283 1 1 3 ASN HD21 H -9.028 -8.314 6.530 1.00 . A A . 3 ASN HD21 1 1 8 5284 1 1 3 ASN HD22 H -10.681 -8.074 7.058 1.00 . A A . 3 ASN HD22 1 1 8 5285 1 1 3 ASN N N -7.753 -5.143 6.807 1.00 . A A . 3 ASN N 1 1 8 5286 1 1 3 ASN ND2 N -9.883 -7.782 6.517 1.00 . A A . 3 ASN ND2 1 1 8 5287 1 1 3 ASN O O -6.635 -4.539 4.018 1.00 . A A . 3 ASN O 1 1 8 5288 1 1 3 ASN OD1 O -11.044 -6.061 5.696 1.00 . A A . 3 ASN OD1 1 1 8 5289 1 1 4 GLU C C -4.213 -6.307 2.776 1.00 . A A . 4 GLU C 1 1 8 5290 1 1 4 GLU CA C -4.033 -5.730 4.183 1.00 . A A . 4 GLU CA 1 1 8 5291 1 1 4 GLU CB C -2.838 -6.347 4.936 1.00 . A A . 4 GLU CB 1 1 8 5292 1 1 4 GLU CD C -0.276 -6.737 4.794 1.00 . A A . 4 GLU CD 1 1 8 5293 1 1 4 GLU CG C -1.555 -6.259 4.107 1.00 . A A . 4 GLU CG 1 1 8 5294 1 1 4 GLU H H -5.127 -6.800 5.607 1.00 . A A . 4 GLU H 1 1 8 5295 1 1 4 GLU HA H -3.907 -4.648 4.142 1.00 . A A . 4 GLU HA 1 1 8 5296 1 1 4 GLU HB2 H -2.732 -5.809 5.875 1.00 . A A . 4 GLU HB2 1 1 8 5297 1 1 4 GLU HB3 H -3.039 -7.399 5.146 1.00 . A A . 4 GLU HB3 1 1 8 5298 1 1 4 GLU HG2 H -1.723 -6.908 3.251 1.00 . A A . 4 GLU HG2 1 1 8 5299 1 1 4 GLU HG3 H -1.409 -5.231 3.785 1.00 . A A . 4 GLU HG3 1 1 8 5300 1 1 4 GLU N N -5.222 -6.052 4.940 1.00 . A A . 4 GLU N 1 1 8 5301 1 1 4 GLU O O -4.519 -7.487 2.633 1.00 . A A . 4 GLU O 1 1 8 5302 1 1 4 GLU OE1 O -0.231 -6.641 6.154 1.00 . A A . 4 GLU OE1 1 1 8 5303 1 1 4 GLU OE2 O 0.656 -7.153 4.098 1.00 . A A . 4 GLU OE2 1 1 8 5304 1 1 5 ARG C C -3.198 -5.096 -0.487 1.00 . A A . 5 ARG C 1 1 8 5305 1 1 5 ARG CA C -4.275 -5.813 0.348 1.00 . A A . 5 ARG CA 1 1 8 5306 1 1 5 ARG CB C -5.714 -5.388 -0.002 1.00 . A A . 5 ARG CB 1 1 8 5307 1 1 5 ARG CD C -7.969 -6.209 -0.879 1.00 . A A . 5 ARG CD 1 1 8 5308 1 1 5 ARG CG C -6.440 -6.361 -0.942 1.00 . A A . 5 ARG CG 1 1 8 5309 1 1 5 ARG CZ C -8.383 -4.235 -2.361 1.00 . A A . 5 ARG CZ 1 1 8 5310 1 1 5 ARG H H -3.777 -4.510 1.932 1.00 . A A . 5 ARG H 1 1 8 5311 1 1 5 ARG HA H -4.172 -6.890 0.245 1.00 . A A . 5 ARG HA 1 1 8 5312 1 1 5 ARG HB2 H -6.292 -5.356 0.920 1.00 . A A . 5 ARG HB2 1 1 8 5313 1 1 5 ARG HB3 H -5.698 -4.391 -0.441 1.00 . A A . 5 ARG HB3 1 1 8 5314 1 1 5 ARG HD2 H -8.441 -6.916 -1.564 1.00 . A A . 5 ARG HD2 1 1 8 5315 1 1 5 ARG HD3 H -8.298 -6.472 0.128 1.00 . A A . 5 ARG HD3 1 1 8 5316 1 1 5 ARG HG2 H -6.095 -6.192 -1.958 1.00 . A A . 5 ARG HG2 1 1 8 5317 1 1 5 ARG HG3 H -6.205 -7.383 -0.645 1.00 . A A . 5 ARG HG3 1 1 8 5318 1 1 5 ARG HH11 H -7.697 -5.867 -3.377 1.00 . A A . 5 ARG HH11 1 1 8 5319 1 1 5 ARG HH12 H -7.785 -4.373 -4.296 1.00 . A A . 5 ARG HH12 1 1 8 5320 1 1 5 ARG HH21 H -9.122 -2.438 -1.701 1.00 . A A . 5 ARG HH21 1 1 8 5321 1 1 5 ARG HH22 H -8.527 -2.474 -3.353 1.00 . A A . 5 ARG HH22 1 1 8 5322 1 1 5 ARG N N -4.034 -5.474 1.746 1.00 . A A . 5 ARG N 1 1 8 5323 1 1 5 ARG NE N -8.422 -4.837 -1.164 1.00 . A A . 5 ARG NE 1 1 8 5324 1 1 5 ARG NH1 N -7.946 -4.892 -3.438 1.00 . A A . 5 ARG NH1 1 1 8 5325 1 1 5 ARG NH2 N -8.749 -2.958 -2.485 1.00 . A A . 5 ARG NH2 1 1 8 5326 1 1 5 ARG O O -2.784 -4.000 -0.106 1.00 . A A . 5 ARG O 1 1 8 5327 1 1 6 PRO C C -1.522 -3.982 -2.970 1.00 . A A . 6 PRO C 1 1 8 5328 1 1 6 PRO CA C -1.417 -5.292 -2.182 1.00 . A A . 6 PRO CA 1 1 8 5329 1 1 6 PRO CB C -0.985 -6.469 -3.068 1.00 . A A . 6 PRO CB 1 1 8 5330 1 1 6 PRO CD C -3.081 -7.003 -2.082 1.00 . A A . 6 PRO CD 1 1 8 5331 1 1 6 PRO CG C -2.298 -7.182 -3.380 1.00 . A A . 6 PRO CG 1 1 8 5332 1 1 6 PRO HA H -0.658 -5.137 -1.417 1.00 . A A . 6 PRO HA 1 1 8 5333 1 1 6 PRO HB2 H -0.465 -6.171 -3.981 1.00 . A A . 6 PRO HB2 1 1 8 5334 1 1 6 PRO HB3 H -0.350 -7.142 -2.490 1.00 . A A . 6 PRO HB3 1 1 8 5335 1 1 6 PRO HD2 H -4.147 -7.037 -2.291 1.00 . A A . 6 PRO HD2 1 1 8 5336 1 1 6 PRO HD3 H -2.813 -7.789 -1.377 1.00 . A A . 6 PRO HD3 1 1 8 5337 1 1 6 PRO HG2 H -2.809 -6.662 -4.192 1.00 . A A . 6 PRO HG2 1 1 8 5338 1 1 6 PRO HG3 H -2.152 -8.232 -3.637 1.00 . A A . 6 PRO HG3 1 1 8 5339 1 1 6 PRO N N -2.664 -5.716 -1.554 1.00 . A A . 6 PRO N 1 1 8 5340 1 1 6 PRO O O -2.579 -3.356 -3.066 1.00 . A A . 6 PRO O 1 1 8 5341 1 1 7 SER C C -1.061 -2.355 -5.559 1.00 . A A . 7 SER C 1 1 8 5342 1 1 7 SER CA C -0.211 -2.356 -4.297 1.00 . A A . 7 SER CA 1 1 8 5343 1 1 7 SER CB C 1.262 -2.211 -4.681 1.00 . A A . 7 SER CB 1 1 8 5344 1 1 7 SER H H 0.449 -4.142 -3.409 1.00 . A A . 7 SER H 1 1 8 5345 1 1 7 SER HA H -0.497 -1.496 -3.691 1.00 . A A . 7 SER HA 1 1 8 5346 1 1 7 SER HB2 H 1.311 -1.379 -5.383 1.00 . A A . 7 SER HB2 1 1 8 5347 1 1 7 SER HB3 H 1.865 -1.980 -3.804 1.00 . A A . 7 SER HB3 1 1 8 5348 1 1 7 SER HG H 1.033 -3.645 -5.940 1.00 . A A . 7 SER HG 1 1 8 5349 1 1 7 SER N N -0.379 -3.581 -3.538 1.00 . A A . 7 SER N 1 1 8 5350 1 1 7 SER O O -0.684 -2.966 -6.558 1.00 . A A . 7 SER O 1 1 8 5351 1 1 7 SER OG O 1.720 -3.405 -5.295 1.00 . A A . 7 SER OG 1 1 8 5352 1 1 8 GLN C C -2.587 -0.005 -7.252 1.00 . A A . 8 GLN C 1 1 8 5353 1 1 8 GLN CA C -3.044 -1.308 -6.598 1.00 . A A . 8 GLN CA 1 1 8 5354 1 1 8 GLN CB C -4.457 -1.249 -6.010 1.00 . A A . 8 GLN CB 1 1 8 5355 1 1 8 GLN CD C -5.822 -2.588 -4.352 1.00 . A A . 8 GLN CD 1 1 8 5356 1 1 8 GLN CG C -4.842 -2.649 -5.514 1.00 . A A . 8 GLN CG 1 1 8 5357 1 1 8 GLN H H -2.424 -1.273 -4.593 1.00 . A A . 8 GLN H 1 1 8 5358 1 1 8 GLN HA H -3.004 -2.102 -7.347 1.00 . A A . 8 GLN HA 1 1 8 5359 1 1 8 GLN HB2 H -4.479 -0.551 -5.172 1.00 . A A . 8 GLN HB2 1 1 8 5360 1 1 8 GLN HB3 H -5.175 -0.919 -6.765 1.00 . A A . 8 GLN HB3 1 1 8 5361 1 1 8 GLN HE21 H -4.297 -2.723 -3.014 1.00 . A A . 8 GLN HE21 1 1 8 5362 1 1 8 GLN HE22 H -5.901 -2.524 -2.323 1.00 . A A . 8 GLN HE22 1 1 8 5363 1 1 8 GLN HG2 H -5.271 -3.184 -6.351 1.00 . A A . 8 GLN HG2 1 1 8 5364 1 1 8 GLN HG3 H -3.979 -3.225 -5.189 1.00 . A A . 8 GLN HG3 1 1 8 5365 1 1 8 GLN N N -2.149 -1.598 -5.503 1.00 . A A . 8 GLN N 1 1 8 5366 1 1 8 GLN NE2 N -5.305 -2.606 -3.127 1.00 . A A . 8 GLN NE2 1 1 8 5367 1 1 8 GLN O O -1.736 -0.028 -8.137 1.00 . A A . 8 GLN O 1 1 8 5368 1 1 8 GLN OE1 O -7.038 -2.551 -4.544 1.00 . A A . 8 GLN OE1 1 1 8 5369 1 1 9 THR C C -1.441 2.971 -7.163 1.00 . A A . 9 THR C 1 1 8 5370 1 1 9 THR CA C -2.855 2.442 -7.390 1.00 . A A . 9 THR CA 1 1 8 5371 1 1 9 THR CB C -3.866 3.422 -6.793 1.00 . A A . 9 THR CB 1 1 8 5372 1 1 9 THR CG2 C -5.232 3.273 -7.460 1.00 . A A . 9 THR CG2 1 1 8 5373 1 1 9 THR H H -3.709 1.158 -5.984 1.00 . A A . 9 THR H 1 1 8 5374 1 1 9 THR HA H -3.009 2.374 -8.468 1.00 . A A . 9 THR HA 1 1 8 5375 1 1 9 THR HB H -3.496 4.438 -6.953 1.00 . A A . 9 THR HB 1 1 8 5376 1 1 9 THR HG1 H -4.649 3.767 -5.043 1.00 . A A . 9 THR HG1 1 1 8 5377 1 1 9 THR HG21 H -5.140 3.468 -8.529 1.00 . A A . 9 THR HG21 1 1 8 5378 1 1 9 THR HG22 H -5.613 2.266 -7.308 1.00 . A A . 9 THR HG22 1 1 8 5379 1 1 9 THR HG23 H -5.935 3.990 -7.032 1.00 . A A . 9 THR HG23 1 1 8 5380 1 1 9 THR N N -3.077 1.141 -6.775 1.00 . A A . 9 THR N 1 1 8 5381 1 1 9 THR O O -1.065 3.984 -7.746 1.00 . A A . 9 THR O 1 1 8 5382 1 1 9 THR OG1 O -4.015 3.147 -5.411 1.00 . A A . 9 THR OG1 1 1 8 5383 1 1 10 TRP C C 1.406 2.128 -7.603 1.00 . A A . 10 TRP C 1 1 8 5384 1 1 10 TRP CA C 0.780 2.614 -6.288 1.00 . A A . 10 TRP CA 1 1 8 5385 1 1 10 TRP CB C 1.441 1.951 -5.073 1.00 . A A . 10 TRP CB 1 1 8 5386 1 1 10 TRP CD1 C 3.884 1.638 -5.667 1.00 . A A . 10 TRP CD1 1 1 8 5387 1 1 10 TRP CD2 C 3.554 3.290 -4.193 1.00 . A A . 10 TRP CD2 1 1 8 5388 1 1 10 TRP CE2 C 4.925 3.343 -4.572 1.00 . A A . 10 TRP CE2 1 1 8 5389 1 1 10 TRP CE3 C 3.114 4.223 -3.231 1.00 . A A . 10 TRP CE3 1 1 8 5390 1 1 10 TRP CG C 2.902 2.252 -4.974 1.00 . A A . 10 TRP CG 1 1 8 5391 1 1 10 TRP CH2 C 5.295 5.292 -3.191 1.00 . A A . 10 TRP CH2 1 1 8 5392 1 1 10 TRP CZ2 C 5.798 4.320 -4.067 1.00 . A A . 10 TRP CZ2 1 1 8 5393 1 1 10 TRP CZ3 C 3.960 5.237 -2.765 1.00 . A A . 10 TRP CZ3 1 1 8 5394 1 1 10 TRP H H -1.006 1.550 -5.782 1.00 . A A . 10 TRP H 1 1 8 5395 1 1 10 TRP HA H 0.928 3.699 -6.215 1.00 . A A . 10 TRP HA 1 1 8 5396 1 1 10 TRP HB2 H 0.956 2.325 -4.169 1.00 . A A . 10 TRP HB2 1 1 8 5397 1 1 10 TRP HB3 H 1.297 0.873 -5.122 1.00 . A A . 10 TRP HB3 1 1 8 5398 1 1 10 TRP HD1 H 3.723 0.832 -6.370 1.00 . A A . 10 TRP HD1 1 1 8 5399 1 1 10 TRP HE1 H 5.964 2.080 -5.904 1.00 . A A . 10 TRP HE1 1 1 8 5400 1 1 10 TRP HE3 H 2.110 4.151 -2.855 1.00 . A A . 10 TRP HE3 1 1 8 5401 1 1 10 TRP HH2 H 5.906 6.104 -2.852 1.00 . A A . 10 TRP HH2 1 1 8 5402 1 1 10 TRP HZ2 H 6.829 4.350 -4.391 1.00 . A A . 10 TRP HZ2 1 1 8 5403 1 1 10 TRP HZ3 H 3.584 6.002 -2.107 1.00 . A A . 10 TRP HZ3 1 1 8 5404 1 1 10 TRP N N -0.645 2.335 -6.302 1.00 . A A . 10 TRP N 1 1 8 5405 1 1 10 TRP NE1 N 5.079 2.294 -5.453 1.00 . A A . 10 TRP NE1 1 1 8 5406 1 1 10 TRP O O 2.306 2.767 -8.136 1.00 . A A . 10 TRP O 1 1 8 5407 1 1 11 SER C C 2.762 0.365 -9.699 1.00 . A A . 11 SER C 1 1 8 5408 1 1 11 SER CA C 1.258 0.474 -9.431 1.00 . A A . 11 SER CA 1 1 8 5409 1 1 11 SER CB C 0.554 1.333 -10.491 1.00 . A A . 11 SER CB 1 1 8 5410 1 1 11 SER H H 0.113 0.573 -7.678 1.00 . A A . 11 SER H 1 1 8 5411 1 1 11 SER HA H 0.858 -0.536 -9.478 1.00 . A A . 11 SER HA 1 1 8 5412 1 1 11 SER HB2 H 1.056 2.300 -10.579 1.00 . A A . 11 SER HB2 1 1 8 5413 1 1 11 SER HB3 H 0.607 0.829 -11.457 1.00 . A A . 11 SER HB3 1 1 8 5414 1 1 11 SER HG H -1.132 0.802 -9.640 1.00 . A A . 11 SER HG 1 1 8 5415 1 1 11 SER N N 0.932 0.985 -8.109 1.00 . A A . 11 SER N 1 1 8 5416 1 1 11 SER O O 3.248 0.864 -10.712 1.00 . A A . 11 SER O 1 1 8 5417 1 1 11 SER OG O -0.800 1.560 -10.139 1.00 . A A . 11 SER OG 1 1 8 5418 1 1 12 GLY C C 5.620 -1.091 -7.803 1.00 . A A . 12 GLY C 1 1 8 5419 1 1 12 GLY CA C 4.924 -0.541 -9.045 1.00 . A A . 12 GLY CA 1 1 8 5420 1 1 12 GLY H H 3.076 -0.737 -8.009 1.00 . A A . 12 GLY H 1 1 8 5421 1 1 12 GLY HA2 H 5.061 -1.244 -9.867 1.00 . A A . 12 GLY HA2 1 1 8 5422 1 1 12 GLY HA3 H 5.388 0.410 -9.316 1.00 . A A . 12 GLY HA3 1 1 8 5423 1 1 12 GLY N N 3.502 -0.329 -8.827 1.00 . A A . 12 GLY N 1 1 8 5424 1 1 12 GLY O O 4.999 -1.778 -6.982 1.00 . A A . 12 GLY O 1 1 8 5425 1 1 13 ASN C C 7.738 0.208 -5.645 1.00 . A A . 13 ASN C 1 1 8 5426 1 1 13 ASN CA C 7.726 -1.054 -6.502 1.00 . A A . 13 ASN CA 1 1 8 5427 1 1 13 ASN CB C 9.144 -1.446 -6.939 1.00 . A A . 13 ASN CB 1 1 8 5428 1 1 13 ASN CG C 9.935 -2.209 -5.874 1.00 . A A . 13 ASN CG 1 1 8 5429 1 1 13 ASN H H 7.317 -0.162 -8.367 1.00 . A A . 13 ASN H 1 1 8 5430 1 1 13 ASN HA H 7.289 -1.887 -5.950 1.00 . A A . 13 ASN HA 1 1 8 5431 1 1 13 ASN HB2 H 9.052 -2.114 -7.794 1.00 . A A . 13 ASN HB2 1 1 8 5432 1 1 13 ASN HB3 H 9.700 -0.562 -7.254 1.00 . A A . 13 ASN HB3 1 1 8 5433 1 1 13 ASN HD21 H 10.308 -0.535 -4.696 1.00 . A A . 13 ASN HD21 1 1 8 5434 1 1 13 ASN HD22 H 11.045 -2.018 -4.203 1.00 . A A . 13 ASN HD22 1 1 8 5435 1 1 13 ASN N N 6.911 -0.779 -7.677 1.00 . A A . 13 ASN N 1 1 8 5436 1 1 13 ASN ND2 N 10.456 -1.529 -4.855 1.00 . A A . 13 ASN ND2 1 1 8 5437 1 1 13 ASN O O 7.588 1.313 -6.167 1.00 . A A . 13 ASN O 1 1 8 5438 1 1 13 ASN OD1 O 10.110 -3.423 -5.988 1.00 . A A . 13 ASN OD1 1 1 8 5439 1 1 14 CYS C C 9.275 1.538 -2.985 1.00 . A A . 14 CYS C 1 1 8 5440 1 1 14 CYS CA C 7.854 1.129 -3.355 1.00 . A A . 14 CYS CA 1 1 8 5441 1 1 14 CYS CB C 7.073 0.682 -2.111 1.00 . A A . 14 CYS CB 1 1 8 5442 1 1 14 CYS H H 8.068 -0.884 -3.999 1.00 . A A . 14 CYS H 1 1 8 5443 1 1 14 CYS HA H 7.346 1.997 -3.770 1.00 . A A . 14 CYS HA 1 1 8 5444 1 1 14 CYS HB2 H 6.012 0.662 -2.356 1.00 . A A . 14 CYS HB2 1 1 8 5445 1 1 14 CYS HB3 H 7.377 -0.319 -1.818 1.00 . A A . 14 CYS HB3 1 1 8 5446 1 1 14 CYS N N 7.879 0.052 -4.334 1.00 . A A . 14 CYS N 1 1 8 5447 1 1 14 CYS O O 10.202 0.739 -3.108 1.00 . A A . 14 CYS O 1 1 8 5448 1 1 14 CYS SG S 7.300 1.747 -0.663 1.00 . A A . 14 CYS SG 1 1 8 5449 1 1 15 GLY C C 9.842 4.055 -0.512 1.00 . A A . 15 GLY C 1 1 8 5450 1 1 15 GLY CA C 10.475 3.216 -1.623 1.00 . A A . 15 GLY CA 1 1 8 5451 1 1 15 GLY H H 8.579 3.353 -2.522 1.00 . A A . 15 GLY H 1 1 8 5452 1 1 15 GLY HA2 H 10.984 2.363 -1.178 1.00 . A A . 15 GLY HA2 1 1 8 5453 1 1 15 GLY HA3 H 11.197 3.816 -2.179 1.00 . A A . 15 GLY HA3 1 1 8 5454 1 1 15 GLY N N 9.409 2.779 -2.511 1.00 . A A . 15 GLY N 1 1 8 5455 1 1 15 GLY O O 9.890 3.717 0.670 1.00 . A A . 15 GLY O 1 1 8 5456 1 1 16 ASN C C 7.299 5.587 0.662 1.00 . A A . 16 ASN C 1 1 8 5457 1 1 16 ASN CA C 8.583 6.100 -0.003 1.00 . A A . 16 ASN CA 1 1 8 5458 1 1 16 ASN CB C 8.368 7.434 -0.729 1.00 . A A . 16 ASN CB 1 1 8 5459 1 1 16 ASN CG C 8.059 8.557 0.253 1.00 . A A . 16 ASN CG 1 1 8 5460 1 1 16 ASN H H 9.186 5.343 -1.903 1.00 . A A . 16 ASN H 1 1 8 5461 1 1 16 ASN HA H 9.314 6.291 0.787 1.00 . A A . 16 ASN HA 1 1 8 5462 1 1 16 ASN HB2 H 9.288 7.700 -1.251 1.00 . A A . 16 ASN HB2 1 1 8 5463 1 1 16 ASN HB3 H 7.563 7.352 -1.458 1.00 . A A . 16 ASN HB3 1 1 8 5464 1 1 16 ASN HD21 H 8.428 9.989 -1.150 1.00 . A A . 16 ASN HD21 1 1 8 5465 1 1 16 ASN HD22 H 7.957 10.558 0.436 1.00 . A A . 16 ASN HD22 1 1 8 5466 1 1 16 ASN N N 9.180 5.137 -0.917 1.00 . A A . 16 ASN N 1 1 8 5467 1 1 16 ASN ND2 N 8.132 9.801 -0.205 1.00 . A A . 16 ASN ND2 1 1 8 5468 1 1 16 ASN O O 6.190 5.966 0.279 1.00 . A A . 16 ASN O 1 1 8 5469 1 1 16 ASN OD1 O 7.738 8.310 1.411 1.00 . A A . 16 ASN OD1 1 1 8 5470 1 1 17 THR C C 5.506 5.531 3.095 1.00 . A A . 17 THR C 1 1 8 5471 1 1 17 THR CA C 6.323 4.342 2.549 1.00 . A A . 17 THR CA 1 1 8 5472 1 1 17 THR CB C 6.822 3.370 3.633 1.00 . A A . 17 THR CB 1 1 8 5473 1 1 17 THR CG2 C 7.551 4.076 4.782 1.00 . A A . 17 THR CG2 1 1 8 5474 1 1 17 THR H H 8.378 4.430 1.903 1.00 . A A . 17 THR H 1 1 8 5475 1 1 17 THR HA H 5.670 3.772 1.902 1.00 . A A . 17 THR HA 1 1 8 5476 1 1 17 THR HB H 7.534 2.690 3.162 1.00 . A A . 17 THR HB 1 1 8 5477 1 1 17 THR HG1 H 6.089 2.111 4.919 1.00 . A A . 17 THR HG1 1 1 8 5478 1 1 17 THR HG21 H 8.349 4.705 4.391 1.00 . A A . 17 THR HG21 1 1 8 5479 1 1 17 THR HG22 H 6.856 4.690 5.357 1.00 . A A . 17 THR HG22 1 1 8 5480 1 1 17 THR HG23 H 7.992 3.333 5.447 1.00 . A A . 17 THR HG23 1 1 8 5481 1 1 17 THR N N 7.444 4.786 1.719 1.00 . A A . 17 THR N 1 1 8 5482 1 1 17 THR O O 4.276 5.473 3.199 1.00 . A A . 17 THR O 1 1 8 5483 1 1 17 THR OG1 O 5.764 2.578 4.145 1.00 . A A . 17 THR OG1 1 1 8 5484 1 1 18 ALA C C 4.635 8.479 2.749 1.00 . A A . 18 ALA C 1 1 8 5485 1 1 18 ALA CA C 5.495 7.857 3.852 1.00 . A A . 18 ALA CA 1 1 8 5486 1 1 18 ALA CB C 6.500 8.855 4.434 1.00 . A A . 18 ALA CB 1 1 8 5487 1 1 18 ALA H H 7.170 6.698 3.232 1.00 . A A . 18 ALA H 1 1 8 5488 1 1 18 ALA HA H 4.809 7.577 4.656 1.00 . A A . 18 ALA HA 1 1 8 5489 1 1 18 ALA HB1 H 7.077 8.377 5.225 1.00 . A A . 18 ALA HB1 1 1 8 5490 1 1 18 ALA HB2 H 7.180 9.214 3.664 1.00 . A A . 18 ALA HB2 1 1 8 5491 1 1 18 ALA HB3 H 5.965 9.705 4.855 1.00 . A A . 18 ALA HB3 1 1 8 5492 1 1 18 ALA N N 6.173 6.652 3.397 1.00 . A A . 18 ALA N 1 1 8 5493 1 1 18 ALA O O 3.700 9.218 3.064 1.00 . A A . 18 ALA O 1 1 8 5494 1 1 19 HIS C C 2.894 7.307 0.441 1.00 . A A . 19 HIS C 1 1 8 5495 1 1 19 HIS CA C 3.938 8.420 0.410 1.00 . A A . 19 HIS CA 1 1 8 5496 1 1 19 HIS CB C 4.586 8.532 -0.976 1.00 . A A . 19 HIS CB 1 1 8 5497 1 1 19 HIS CD2 C 2.310 9.275 -2.045 1.00 . A A . 19 HIS CD2 1 1 8 5498 1 1 19 HIS CE1 C 2.741 8.691 -4.107 1.00 . A A . 19 HIS CE1 1 1 8 5499 1 1 19 HIS CG C 3.593 8.780 -2.096 1.00 . A A . 19 HIS CG 1 1 8 5500 1 1 19 HIS H H 5.715 7.603 1.268 1.00 . A A . 19 HIS H 1 1 8 5501 1 1 19 HIS HA H 3.439 9.371 0.604 1.00 . A A . 19 HIS HA 1 1 8 5502 1 1 19 HIS HB2 H 5.308 9.341 -0.976 1.00 . A A . 19 HIS HB2 1 1 8 5503 1 1 19 HIS HB3 H 5.118 7.608 -1.192 1.00 . A A . 19 HIS HB3 1 1 8 5504 1 1 19 HIS HD1 H 4.740 8.111 -3.796 1.00 . A A . 19 HIS HD1 1 1 8 5505 1 1 19 HIS HD2 H 1.781 9.580 -1.147 1.00 . A A . 19 HIS HD2 1 1 8 5506 1 1 19 HIS HE1 H 2.616 8.490 -5.164 1.00 . A A . 19 HIS HE1 1 1 8 5507 1 1 19 HIS N N 4.905 8.182 1.472 1.00 . A A . 19 HIS N 1 1 8 5508 1 1 19 HIS ND1 N 3.875 8.479 -3.422 1.00 . A A . 19 HIS ND1 1 1 8 5509 1 1 19 HIS NE2 N 1.766 9.158 -3.313 1.00 . A A . 19 HIS NE2 1 1 8 5510 1 1 19 HIS O O 1.710 7.622 0.434 1.00 . A A . 19 HIS O 1 1 8 5511 1 1 20 CYS C C 1.164 5.041 1.258 1.00 . A A . 20 CYS C 1 1 8 5512 1 1 20 CYS CA C 2.396 4.881 0.381 1.00 . A A . 20 CYS CA 1 1 8 5513 1 1 20 CYS CB C 3.098 3.592 0.790 1.00 . A A . 20 CYS CB 1 1 8 5514 1 1 20 CYS H H 4.307 5.859 0.465 1.00 . A A . 20 CYS H 1 1 8 5515 1 1 20 CYS HA H 2.056 4.773 -0.644 1.00 . A A . 20 CYS HA 1 1 8 5516 1 1 20 CYS HB2 H 3.868 3.364 0.057 1.00 . A A . 20 CYS HB2 1 1 8 5517 1 1 20 CYS HB3 H 3.541 3.710 1.769 1.00 . A A . 20 CYS HB3 1 1 8 5518 1 1 20 CYS N N 3.305 6.033 0.456 1.00 . A A . 20 CYS N 1 1 8 5519 1 1 20 CYS O O 0.036 4.828 0.809 1.00 . A A . 20 CYS O 1 1 8 5520 1 1 20 CYS SG S 1.977 2.191 0.987 1.00 . A A . 20 CYS SG 1 1 8 5521 1 1 21 ASP C C -0.714 6.625 2.910 1.00 . A A . 21 ASP C 1 1 8 5522 1 1 21 ASP CA C 0.292 5.607 3.436 1.00 . A A . 21 ASP CA 1 1 8 5523 1 1 21 ASP CB C 0.835 6.062 4.798 1.00 . A A . 21 ASP CB 1 1 8 5524 1 1 21 ASP CG C -0.303 6.325 5.780 1.00 . A A . 21 ASP CG 1 1 8 5525 1 1 21 ASP H H 2.351 5.597 2.808 1.00 . A A . 21 ASP H 1 1 8 5526 1 1 21 ASP HA H -0.202 4.637 3.521 1.00 . A A . 21 ASP HA 1 1 8 5527 1 1 21 ASP HB2 H 1.488 5.287 5.202 1.00 . A A . 21 ASP HB2 1 1 8 5528 1 1 21 ASP HB3 H 1.412 6.979 4.682 1.00 . A A . 21 ASP HB3 1 1 8 5529 1 1 21 ASP N N 1.388 5.481 2.496 1.00 . A A . 21 ASP N 1 1 8 5530 1 1 21 ASP O O -1.917 6.396 3.004 1.00 . A A . 21 ASP O 1 1 8 5531 1 1 21 ASP OD1 O -0.959 7.509 5.637 1.00 . A A . 21 ASP OD1 1 1 8 5532 1 1 21 ASP OD2 O -0.574 5.469 6.617 1.00 . A A . 21 ASP OD2 1 1 8 5533 1 1 22 LYS C C -1.741 8.174 0.492 1.00 . A A . 22 LYS C 1 1 8 5534 1 1 22 LYS CA C -1.084 8.739 1.744 1.00 . A A . 22 LYS CA 1 1 8 5535 1 1 22 LYS CB C -0.330 10.028 1.396 1.00 . A A . 22 LYS CB 1 1 8 5536 1 1 22 LYS CD C 1.237 11.806 2.268 1.00 . A A . 22 LYS CD 1 1 8 5537 1 1 22 LYS CE C 1.912 12.400 3.514 1.00 . A A . 22 LYS CE 1 1 8 5538 1 1 22 LYS CG C 0.542 10.472 2.563 1.00 . A A . 22 LYS CG 1 1 8 5539 1 1 22 LYS H H 0.769 7.764 2.145 1.00 . A A . 22 LYS H 1 1 8 5540 1 1 22 LYS HA H -1.826 9.015 2.488 1.00 . A A . 22 LYS HA 1 1 8 5541 1 1 22 LYS HB2 H 0.294 9.875 0.517 1.00 . A A . 22 LYS HB2 1 1 8 5542 1 1 22 LYS HB3 H -1.060 10.806 1.178 1.00 . A A . 22 LYS HB3 1 1 8 5543 1 1 22 LYS HD2 H 1.977 11.656 1.479 1.00 . A A . 22 LYS HD2 1 1 8 5544 1 1 22 LYS HD3 H 0.500 12.528 1.905 1.00 . A A . 22 LYS HD3 1 1 8 5545 1 1 22 LYS HE2 H 2.545 13.234 3.200 1.00 . A A . 22 LYS HE2 1 1 8 5546 1 1 22 LYS HE3 H 1.147 12.790 4.189 1.00 . A A . 22 LYS HE3 1 1 8 5547 1 1 22 LYS HG2 H -0.079 10.537 3.458 1.00 . A A . 22 LYS HG2 1 1 8 5548 1 1 22 LYS HG3 H 1.278 9.686 2.663 1.00 . A A . 22 LYS HG3 1 1 8 5549 1 1 22 LYS HZ1 H 2.377 10.464 4.054 1.00 . A A . 22 LYS HZ1 1 1 8 5550 1 1 22 LYS HZ2 H 3.710 11.481 3.937 1.00 . A A . 22 LYS HZ2 1 1 8 5551 1 1 22 LYS N N -0.224 7.730 2.341 1.00 . A A . 22 LYS N 1 1 8 5552 1 1 22 LYS NZ N 2.730 11.411 4.245 1.00 . A A . 22 LYS NZ 1 1 8 5553 1 1 22 LYS O O -2.931 8.354 0.286 1.00 . A A . 22 LYS O 1 1 8 5554 1 1 23 GLN C C -2.616 6.314 -1.667 1.00 . A A . 23 GLN C 1 1 8 5555 1 1 23 GLN CA C -1.317 7.135 -1.720 1.00 . A A . 23 GLN CA 1 1 8 5556 1 1 23 GLN CB C -0.138 6.342 -2.316 1.00 . A A . 23 GLN CB 1 1 8 5557 1 1 23 GLN CD C -0.396 6.616 -4.825 1.00 . A A . 23 GLN CD 1 1 8 5558 1 1 23 GLN CG C -0.393 5.637 -3.655 1.00 . A A . 23 GLN CG 1 1 8 5559 1 1 23 GLN H H 0.002 7.366 -0.068 1.00 . A A . 23 GLN H 1 1 8 5560 1 1 23 GLN HA H -1.489 8.035 -2.313 1.00 . A A . 23 GLN HA 1 1 8 5561 1 1 23 GLN HB2 H 0.751 6.963 -2.379 1.00 . A A . 23 GLN HB2 1 1 8 5562 1 1 23 GLN HB3 H 0.083 5.537 -1.620 1.00 . A A . 23 GLN HB3 1 1 8 5563 1 1 23 GLN HE21 H -0.667 5.112 -6.217 1.00 . A A . 23 GLN HE21 1 1 8 5564 1 1 23 GLN HE22 H -0.483 6.693 -6.852 1.00 . A A . 23 GLN HE22 1 1 8 5565 1 1 23 GLN HG2 H 0.441 4.963 -3.846 1.00 . A A . 23 GLN HG2 1 1 8 5566 1 1 23 GLN HG3 H -1.303 5.050 -3.632 1.00 . A A . 23 GLN HG3 1 1 8 5567 1 1 23 GLN N N -0.957 7.508 -0.358 1.00 . A A . 23 GLN N 1 1 8 5568 1 1 23 GLN NE2 N -0.525 6.101 -6.043 1.00 . A A . 23 GLN NE2 1 1 8 5569 1 1 23 GLN O O -3.563 6.584 -2.406 1.00 . A A . 23 GLN O 1 1 8 5570 1 1 23 GLN OE1 O -0.224 7.824 -4.639 1.00 . A A . 23 GLN OE1 1 1 8 5571 1 1 24 CYS C C -5.064 5.200 -0.014 1.00 . A A . 24 CYS C 1 1 8 5572 1 1 24 CYS CA C -3.808 4.465 -0.506 1.00 . A A . 24 CYS CA 1 1 8 5573 1 1 24 CYS CB C -3.420 3.402 0.528 1.00 . A A . 24 CYS CB 1 1 8 5574 1 1 24 CYS H H -1.829 5.199 -0.178 1.00 . A A . 24 CYS H 1 1 8 5575 1 1 24 CYS HA H -4.063 3.972 -1.447 1.00 . A A . 24 CYS HA 1 1 8 5576 1 1 24 CYS HB2 H -3.008 3.899 1.404 1.00 . A A . 24 CYS HB2 1 1 8 5577 1 1 24 CYS HB3 H -4.312 2.860 0.833 1.00 . A A . 24 CYS HB3 1 1 8 5578 1 1 24 CYS N N -2.663 5.347 -0.742 1.00 . A A . 24 CYS N 1 1 8 5579 1 1 24 CYS O O -6.153 4.627 -0.047 1.00 . A A . 24 CYS O 1 1 8 5580 1 1 24 CYS SG S -2.232 2.154 -0.022 1.00 . A A . 24 CYS SG 1 1 8 5581 1 1 25 GLN C C -6.337 8.328 -0.212 1.00 . A A . 25 GLN C 1 1 8 5582 1 1 25 GLN CA C -6.001 7.314 0.904 1.00 . A A . 25 GLN CA 1 1 8 5583 1 1 25 GLN CB C -5.593 8.030 2.205 1.00 . A A . 25 GLN CB 1 1 8 5584 1 1 25 GLN CD C -4.726 7.707 4.597 1.00 . A A . 25 GLN CD 1 1 8 5585 1 1 25 GLN CG C -5.241 7.033 3.324 1.00 . A A . 25 GLN CG 1 1 8 5586 1 1 25 GLN H H -3.983 6.830 0.507 1.00 . A A . 25 GLN H 1 1 8 5587 1 1 25 GLN HA H -6.877 6.710 1.144 1.00 . A A . 25 GLN HA 1 1 8 5588 1 1 25 GLN HB2 H -4.735 8.677 2.022 1.00 . A A . 25 GLN HB2 1 1 8 5589 1 1 25 GLN HB3 H -6.428 8.652 2.526 1.00 . A A . 25 GLN HB3 1 1 8 5590 1 1 25 GLN HE21 H -6.339 8.939 4.682 1.00 . A A . 25 GLN HE21 1 1 8 5591 1 1 25 GLN HE22 H -5.158 9.131 5.962 1.00 . A A . 25 GLN HE22 1 1 8 5592 1 1 25 GLN HG2 H -6.126 6.442 3.572 1.00 . A A . 25 GLN HG2 1 1 8 5593 1 1 25 GLN HG3 H -4.465 6.357 2.969 1.00 . A A . 25 GLN HG3 1 1 8 5594 1 1 25 GLN N N -4.915 6.439 0.469 1.00 . A A . 25 GLN N 1 1 8 5595 1 1 25 GLN NE2 N -5.461 8.688 5.108 1.00 . A A . 25 GLN NE2 1 1 8 5596 1 1 25 GLN O O -7.491 8.714 -0.412 1.00 . A A . 25 GLN O 1 1 8 5597 1 1 25 GLN OE1 O -3.670 7.358 5.129 1.00 . A A . 25 GLN OE1 1 1 8 5598 1 1 26 ASP C C -6.081 9.248 -3.193 1.00 . A A . 26 ASP C 1 1 8 5599 1 1 26 ASP CA C -5.373 9.806 -1.969 1.00 . A A . 26 ASP CA 1 1 8 5600 1 1 26 ASP CB C -3.974 10.293 -2.376 1.00 . A A . 26 ASP CB 1 1 8 5601 1 1 26 ASP CG C -3.181 10.972 -1.265 1.00 . A A . 26 ASP CG 1 1 8 5602 1 1 26 ASP H H -4.397 8.394 -0.724 1.00 . A A . 26 ASP H 1 1 8 5603 1 1 26 ASP HA H -5.929 10.660 -1.598 1.00 . A A . 26 ASP HA 1 1 8 5604 1 1 26 ASP HB2 H -3.388 9.460 -2.752 1.00 . A A . 26 ASP HB2 1 1 8 5605 1 1 26 ASP HB3 H -4.088 11.009 -3.188 1.00 . A A . 26 ASP HB3 1 1 8 5606 1 1 26 ASP N N -5.306 8.779 -0.937 1.00 . A A . 26 ASP N 1 1 8 5607 1 1 26 ASP O O -7.103 9.785 -3.618 1.00 . A A . 26 ASP O 1 1 8 5608 1 1 26 ASP OD1 O -3.892 11.708 -0.368 1.00 . A A . 26 ASP OD1 1 1 8 5609 1 1 26 ASP OD2 O -1.960 10.832 -1.236 1.00 . A A . 26 ASP OD2 1 1 8 5610 1 1 27 TRP C C -7.202 6.642 -4.515 1.00 . A A . 27 TRP C 1 1 8 5611 1 1 27 TRP CA C -6.059 7.545 -4.952 1.00 . A A . 27 TRP CA 1 1 8 5612 1 1 27 TRP CB C -4.963 6.717 -5.632 1.00 . A A . 27 TRP CB 1 1 8 5613 1 1 27 TRP CD1 C -3.160 8.474 -5.845 1.00 . A A . 27 TRP CD1 1 1 8 5614 1 1 27 TRP CD2 C -3.374 7.241 -7.686 1.00 . A A . 27 TRP CD2 1 1 8 5615 1 1 27 TRP CE2 C -2.264 8.108 -7.899 1.00 . A A . 27 TRP CE2 1 1 8 5616 1 1 27 TRP CE3 C -3.694 6.334 -8.709 1.00 . A A . 27 TRP CE3 1 1 8 5617 1 1 27 TRP CG C -3.894 7.467 -6.352 1.00 . A A . 27 TRP CG 1 1 8 5618 1 1 27 TRP CH2 C -1.777 7.059 -10.026 1.00 . A A . 27 TRP CH2 1 1 8 5619 1 1 27 TRP CZ2 C -1.490 8.047 -9.068 1.00 . A A . 27 TRP CZ2 1 1 8 5620 1 1 27 TRP CZ3 C -2.865 6.190 -9.831 1.00 . A A . 27 TRP CZ3 1 1 8 5621 1 1 27 TRP H H -4.724 7.752 -3.301 1.00 . A A . 27 TRP H 1 1 8 5622 1 1 27 TRP HA H -6.434 8.295 -5.653 1.00 . A A . 27 TRP HA 1 1 8 5623 1 1 27 TRP HB2 H -4.462 6.057 -4.928 1.00 . A A . 27 TRP HB2 1 1 8 5624 1 1 27 TRP HB3 H -5.459 6.085 -6.365 1.00 . A A . 27 TRP HB3 1 1 8 5625 1 1 27 TRP HD1 H -3.264 8.851 -4.848 1.00 . A A . 27 TRP HD1 1 1 8 5626 1 1 27 TRP HE1 H -1.509 9.579 -6.558 1.00 . A A . 27 TRP HE1 1 1 8 5627 1 1 27 TRP HE3 H -4.553 5.699 -8.584 1.00 . A A . 27 TRP HE3 1 1 8 5628 1 1 27 TRP HH2 H -1.153 6.942 -10.897 1.00 . A A . 27 TRP HH2 1 1 8 5629 1 1 27 TRP HZ2 H -0.654 8.719 -9.208 1.00 . A A . 27 TRP HZ2 1 1 8 5630 1 1 27 TRP HZ3 H -3.052 5.371 -10.506 1.00 . A A . 27 TRP HZ3 1 1 8 5631 1 1 27 TRP N N -5.531 8.172 -3.753 1.00 . A A . 27 TRP N 1 1 8 5632 1 1 27 TRP NE1 N -2.202 8.870 -6.748 1.00 . A A . 27 TRP NE1 1 1 8 5633 1 1 27 TRP O O -8.377 6.960 -4.694 1.00 . A A . 27 TRP O 1 1 8 5634 1 1 28 GLU C C -8.364 5.270 -2.008 1.00 . A A . 28 GLU C 1 1 8 5635 1 1 28 GLU CA C -7.763 4.606 -3.251 1.00 . A A . 28 GLU CA 1 1 8 5636 1 1 28 GLU CB C -6.994 3.297 -2.941 1.00 . A A . 28 GLU CB 1 1 8 5637 1 1 28 GLU CD C -8.862 1.654 -3.486 1.00 . A A . 28 GLU CD 1 1 8 5638 1 1 28 GLU CG C -7.455 2.133 -3.827 1.00 . A A . 28 GLU CG 1 1 8 5639 1 1 28 GLU H H -5.860 5.478 -3.586 1.00 . A A . 28 GLU H 1 1 8 5640 1 1 28 GLU HA H -8.576 4.414 -3.952 1.00 . A A . 28 GLU HA 1 1 8 5641 1 1 28 GLU HB2 H -5.926 3.439 -3.116 1.00 . A A . 28 GLU HB2 1 1 8 5642 1 1 28 GLU HB3 H -7.093 3.002 -1.896 1.00 . A A . 28 GLU HB3 1 1 8 5643 1 1 28 GLU HG2 H -7.418 2.434 -4.874 1.00 . A A . 28 GLU HG2 1 1 8 5644 1 1 28 GLU HG3 H -6.771 1.294 -3.686 1.00 . A A . 28 GLU HG3 1 1 8 5645 1 1 28 GLU N N -6.832 5.552 -3.840 1.00 . A A . 28 GLU N 1 1 8 5646 1 1 28 GLU O O -8.205 6.471 -1.810 1.00 . A A . 28 GLU O 1 1 8 5647 1 1 28 GLU OE1 O -9.425 2.091 -2.484 1.00 . A A . 28 GLU OE1 1 1 8 5648 1 1 28 GLU OE2 O -9.408 0.743 -4.332 1.00 . A A . 28 GLU OE2 1 1 8 5649 1 1 29 LYS C C -9.724 3.660 0.933 1.00 . A A . 29 LYS C 1 1 8 5650 1 1 29 LYS CA C -9.620 4.922 0.092 1.00 . A A . 29 LYS CA 1 1 8 5651 1 1 29 LYS CB C -10.989 5.599 -0.123 1.00 . A A . 29 LYS CB 1 1 8 5652 1 1 29 LYS CD C -11.220 7.307 -2.008 1.00 . A A . 29 LYS CD 1 1 8 5653 1 1 29 LYS CE C -10.708 8.676 -2.485 1.00 . A A . 29 LYS CE 1 1 8 5654 1 1 29 LYS CG C -10.898 7.080 -0.523 1.00 . A A . 29 LYS CG 1 1 8 5655 1 1 29 LYS H H -9.067 3.513 -1.323 1.00 . A A . 29 LYS H 1 1 8 5656 1 1 29 LYS HA H -8.925 5.577 0.589 1.00 . A A . 29 LYS HA 1 1 8 5657 1 1 29 LYS HB2 H -11.592 5.031 -0.833 1.00 . A A . 29 LYS HB2 1 1 8 5658 1 1 29 LYS HB3 H -11.505 5.581 0.838 1.00 . A A . 29 LYS HB3 1 1 8 5659 1 1 29 LYS HD2 H -10.782 6.519 -2.623 1.00 . A A . 29 LYS HD2 1 1 8 5660 1 1 29 LYS HD3 H -12.304 7.263 -2.136 1.00 . A A . 29 LYS HD3 1 1 8 5661 1 1 29 LYS HE2 H -11.140 8.892 -3.464 1.00 . A A . 29 LYS HE2 1 1 8 5662 1 1 29 LYS HE3 H -11.017 9.456 -1.786 1.00 . A A . 29 LYS HE3 1 1 8 5663 1 1 29 LYS HG2 H -11.630 7.638 0.062 1.00 . A A . 29 LYS HG2 1 1 8 5664 1 1 29 LYS HG3 H -9.915 7.461 -0.252 1.00 . A A . 29 LYS HG3 1 1 8 5665 1 1 29 LYS HZ1 H -8.923 7.743 -2.927 1.00 . A A . 29 LYS HZ1 1 1 8 5666 1 1 29 LYS HZ2 H -8.958 9.378 -3.317 1.00 . A A . 29 LYS HZ2 1 1 8 5667 1 1 29 LYS N N -8.988 4.495 -1.133 1.00 . A A . 29 LYS N 1 1 8 5668 1 1 29 LYS NZ N -9.240 8.674 -2.620 1.00 . A A . 29 LYS NZ 1 1 8 5669 1 1 29 LYS O O -10.785 3.222 1.371 1.00 . A A . 29 LYS O 1 1 8 5670 1 1 30 ALA C C -8.223 3.063 3.541 1.00 . A A . 30 ALA C 1 1 8 5671 1 1 30 ALA CA C -8.291 2.214 2.272 1.00 . A A . 30 ALA CA 1 1 8 5672 1 1 30 ALA CB C -6.972 1.497 2.005 1.00 . A A . 30 ALA CB 1 1 8 5673 1 1 30 ALA H H -7.727 3.579 0.769 1.00 . A A . 30 ALA H 1 1 8 5674 1 1 30 ALA HA H -9.100 1.490 2.354 1.00 . A A . 30 ALA HA 1 1 8 5675 1 1 30 ALA HB1 H -6.945 1.185 0.964 1.00 . A A . 30 ALA HB1 1 1 8 5676 1 1 30 ALA HB2 H -6.137 2.169 2.196 1.00 . A A . 30 ALA HB2 1 1 8 5677 1 1 30 ALA HB3 H -6.890 0.615 2.631 1.00 . A A . 30 ALA HB3 1 1 8 5678 1 1 30 ALA N N -8.535 3.107 1.164 1.00 . A A . 30 ALA N 1 1 8 5679 1 1 30 ALA O O -8.138 4.290 3.462 1.00 . A A . 30 ALA O 1 1 8 5680 1 1 31 SER C C -6.642 3.836 5.920 1.00 . A A . 31 SER C 1 1 8 5681 1 1 31 SER CA C -7.997 3.123 5.959 1.00 . A A . 31 SER CA 1 1 8 5682 1 1 31 SER CB C -8.081 2.085 7.072 1.00 . A A . 31 SER CB 1 1 8 5683 1 1 31 SER H H -8.199 1.426 4.803 1.00 . A A . 31 SER H 1 1 8 5684 1 1 31 SER HA H -8.787 3.852 6.114 1.00 . A A . 31 SER HA 1 1 8 5685 1 1 31 SER HB2 H -7.179 1.481 7.072 1.00 . A A . 31 SER HB2 1 1 8 5686 1 1 31 SER HB3 H -8.133 2.614 8.011 1.00 . A A . 31 SER HB3 1 1 8 5687 1 1 31 SER HG H -9.989 1.827 6.782 1.00 . A A . 31 SER HG 1 1 8 5688 1 1 31 SER N N -8.219 2.436 4.714 1.00 . A A . 31 SER N 1 1 8 5689 1 1 31 SER O O -6.540 4.984 6.345 1.00 . A A . 31 SER O 1 1 8 5690 1 1 31 SER OG O -9.222 1.255 6.896 1.00 . A A . 31 SER OG 1 1 8 5691 1 1 32 HIS C C -3.478 2.846 4.226 1.00 . A A . 32 HIS C 1 1 8 5692 1 1 32 HIS CA C -4.325 3.787 5.092 1.00 . A A . 32 HIS CA 1 1 8 5693 1 1 32 HIS CB C -3.588 4.175 6.390 1.00 . A A . 32 HIS CB 1 1 8 5694 1 1 32 HIS CD2 C -3.370 1.829 7.392 1.00 . A A . 32 HIS CD2 1 1 8 5695 1 1 32 HIS CE1 C -1.248 1.802 7.845 1.00 . A A . 32 HIS CE1 1 1 8 5696 1 1 32 HIS CG C -2.860 3.040 7.053 1.00 . A A . 32 HIS CG 1 1 8 5697 1 1 32 HIS H H -5.768 2.238 5.012 1.00 . A A . 32 HIS H 1 1 8 5698 1 1 32 HIS HA H -4.529 4.684 4.504 1.00 . A A . 32 HIS HA 1 1 8 5699 1 1 32 HIS HB2 H -2.852 4.902 6.122 1.00 . A A . 32 HIS HB2 1 1 8 5700 1 1 32 HIS HB3 H -4.253 4.648 7.111 1.00 . A A . 32 HIS HB3 1 1 8 5701 1 1 32 HIS HD1 H -0.841 3.777 7.178 1.00 . A A . 32 HIS HD1 1 1 8 5702 1 1 32 HIS HD2 H -4.377 1.572 7.151 1.00 . A A . 32 HIS HD2 1 1 8 5703 1 1 32 HIS HE1 H -0.272 1.456 8.143 1.00 . A A . 32 HIS HE1 1 1 8 5704 1 1 32 HIS N N -5.611 3.167 5.390 1.00 . A A . 32 HIS N 1 1 8 5705 1 1 32 HIS ND1 N -1.511 3.034 7.371 1.00 . A A . 32 HIS ND1 1 1 8 5706 1 1 32 HIS NE2 N -2.354 1.039 7.884 1.00 . A A . 32 HIS NE2 1 1 8 5707 1 1 32 HIS O O -3.988 1.834 3.745 1.00 . A A . 32 HIS O 1 1 8 5708 1 1 33 GLY C C 0.081 2.123 4.273 1.00 . A A . 33 GLY C 1 1 8 5709 1 1 33 GLY CA C -1.181 2.316 3.437 1.00 . A A . 33 GLY CA 1 1 8 5710 1 1 33 GLY H H -1.840 3.993 4.532 1.00 . A A . 33 GLY H 1 1 8 5711 1 1 33 GLY HA2 H -1.595 1.351 3.258 1.00 . A A . 33 GLY HA2 1 1 8 5712 1 1 33 GLY HA3 H -0.901 2.731 2.476 1.00 . A A . 33 GLY HA3 1 1 8 5713 1 1 33 GLY N N -2.181 3.151 4.094 1.00 . A A . 33 GLY N 1 1 8 5714 1 1 33 GLY O O 0.289 2.845 5.249 1.00 . A A . 33 GLY O 1 1 8 5715 1 1 34 ALA C C 3.005 -0.062 3.529 1.00 . A A . 34 ALA C 1 1 8 5716 1 1 34 ALA CA C 2.247 0.920 4.438 1.00 . A A . 34 ALA CA 1 1 8 5717 1 1 34 ALA CB C 2.122 0.375 5.865 1.00 . A A . 34 ALA CB 1 1 8 5718 1 1 34 ALA H H 0.639 0.565 3.103 1.00 . A A . 34 ALA H 1 1 8 5719 1 1 34 ALA HA H 2.787 1.867 4.469 1.00 . A A . 34 ALA HA 1 1 8 5720 1 1 34 ALA HB1 H 1.519 -0.532 5.869 1.00 . A A . 34 ALA HB1 1 1 8 5721 1 1 34 ALA HB2 H 3.113 0.153 6.260 1.00 . A A . 34 ALA HB2 1 1 8 5722 1 1 34 ALA HB3 H 1.648 1.114 6.510 1.00 . A A . 34 ALA HB3 1 1 8 5723 1 1 34 ALA N N 0.919 1.156 3.885 1.00 . A A . 34 ALA N 1 1 8 5724 1 1 34 ALA O O 2.428 -1.059 3.088 1.00 . A A . 34 ALA O 1 1 8 5725 1 1 35 CYS C C 5.624 -1.851 3.067 1.00 . A A . 35 CYS C 1 1 8 5726 1 1 35 CYS CA C 5.063 -0.637 2.341 1.00 . A A . 35 CYS CA 1 1 8 5727 1 1 35 CYS CB C 6.212 0.147 1.727 1.00 . A A . 35 CYS CB 1 1 8 5728 1 1 35 CYS H H 4.746 1.053 3.544 1.00 . A A . 35 CYS H 1 1 8 5729 1 1 35 CYS HA H 4.424 -0.951 1.524 1.00 . A A . 35 CYS HA 1 1 8 5730 1 1 35 CYS HB2 H 6.813 0.614 2.507 1.00 . A A . 35 CYS HB2 1 1 8 5731 1 1 35 CYS HB3 H 6.847 -0.554 1.210 1.00 . A A . 35 CYS HB3 1 1 8 5732 1 1 35 CYS N N 4.281 0.212 3.222 1.00 . A A . 35 CYS N 1 1 8 5733 1 1 35 CYS O O 5.885 -1.788 4.268 1.00 . A A . 35 CYS O 1 1 8 5734 1 1 35 CYS SG S 5.656 1.366 0.524 1.00 . A A . 35 CYS SG 1 1 8 5735 1 1 36 HIS C C 7.286 -4.781 1.650 1.00 . A A . 36 HIS C 1 1 8 5736 1 1 36 HIS CA C 6.627 -4.090 2.825 1.00 . A A . 36 HIS CA 1 1 8 5737 1 1 36 HIS CB C 5.761 -5.136 3.534 1.00 . A A . 36 HIS CB 1 1 8 5738 1 1 36 HIS CD2 C 3.339 -4.310 3.682 1.00 . A A . 36 HIS CD2 1 1 8 5739 1 1 36 HIS CE1 C 3.420 -3.476 5.709 1.00 . A A . 36 HIS CE1 1 1 8 5740 1 1 36 HIS CG C 4.577 -4.537 4.216 1.00 . A A . 36 HIS CG 1 1 8 5741 1 1 36 HIS H H 5.583 -2.954 1.353 1.00 . A A . 36 HIS H 1 1 8 5742 1 1 36 HIS HA H 7.388 -3.733 3.518 1.00 . A A . 36 HIS HA 1 1 8 5743 1 1 36 HIS HB2 H 5.381 -5.844 2.796 1.00 . A A . 36 HIS HB2 1 1 8 5744 1 1 36 HIS HB3 H 6.369 -5.692 4.249 1.00 . A A . 36 HIS HB3 1 1 8 5745 1 1 36 HIS HD1 H 5.418 -4.005 6.125 1.00 . A A . 36 HIS HD1 1 1 8 5746 1 1 36 HIS HD2 H 3.052 -4.541 2.655 1.00 . A A . 36 HIS HD2 1 1 8 5747 1 1 36 HIS HE1 H 3.129 -2.968 6.619 1.00 . A A . 36 HIS HE1 1 1 8 5748 1 1 36 HIS N N 5.852 -2.950 2.336 1.00 . A A . 36 HIS N 1 1 8 5749 1 1 36 HIS ND1 N 4.619 -4.033 5.504 1.00 . A A . 36 HIS ND1 1 1 8 5750 1 1 36 HIS NE2 N 2.622 -3.629 4.642 1.00 . A A . 36 HIS NE2 1 1 8 5751 1 1 36 HIS O O 6.751 -4.751 0.543 1.00 . A A . 36 HIS O 1 1 8 5752 1 1 37 LYS C C 8.292 -7.675 0.912 1.00 . A A . 37 LYS C 1 1 8 5753 1 1 37 LYS CA C 9.016 -6.337 0.944 1.00 . A A . 37 LYS CA 1 1 8 5754 1 1 37 LYS CB C 10.493 -6.479 1.284 1.00 . A A . 37 LYS CB 1 1 8 5755 1 1 37 LYS CD C 12.555 -7.860 0.778 1.00 . A A . 37 LYS CD 1 1 8 5756 1 1 37 LYS CE C 13.662 -6.833 1.036 1.00 . A A . 37 LYS CE 1 1 8 5757 1 1 37 LYS CG C 11.289 -7.209 0.197 1.00 . A A . 37 LYS CG 1 1 8 5758 1 1 37 LYS H H 8.735 -5.509 2.869 1.00 . A A . 37 LYS H 1 1 8 5759 1 1 37 LYS HA H 8.976 -5.874 -0.031 1.00 . A A . 37 LYS HA 1 1 8 5760 1 1 37 LYS HB2 H 10.890 -5.487 1.353 1.00 . A A . 37 LYS HB2 1 1 8 5761 1 1 37 LYS HB3 H 10.587 -6.940 2.259 1.00 . A A . 37 LYS HB3 1 1 8 5762 1 1 37 LYS HD2 H 12.289 -8.376 1.704 1.00 . A A . 37 LYS HD2 1 1 8 5763 1 1 37 LYS HD3 H 12.917 -8.601 0.064 1.00 . A A . 37 LYS HD3 1 1 8 5764 1 1 37 LYS HE2 H 13.953 -6.388 0.080 1.00 . A A . 37 LYS HE2 1 1 8 5765 1 1 37 LYS HE3 H 13.278 -6.052 1.692 1.00 . A A . 37 LYS HE3 1 1 8 5766 1 1 37 LYS HG2 H 10.656 -7.980 -0.215 1.00 . A A . 37 LYS HG2 1 1 8 5767 1 1 37 LYS HG3 H 11.515 -6.536 -0.632 1.00 . A A . 37 LYS HG3 1 1 8 5768 1 1 37 LYS HZ1 H 14.876 -8.449 1.469 1.00 . A A . 37 LYS HZ1 1 1 8 5769 1 1 37 LYS HZ2 H 15.707 -6.997 1.293 1.00 . A A . 37 LYS HZ2 1 1 8 5770 1 1 37 LYS N N 8.374 -5.494 1.927 1.00 . A A . 37 LYS N 1 1 8 5771 1 1 37 LYS NZ N 14.856 -7.438 1.670 1.00 . A A . 37 LYS NZ 1 1 8 5772 1 1 37 LYS O O 8.136 -8.337 1.936 1.00 . A A . 37 LYS O 1 1 8 5773 1 1 38 ARG C C 8.212 -9.849 -1.787 1.00 . A A . 38 ARG C 1 1 8 5774 1 1 38 ARG CA C 7.352 -9.368 -0.621 1.00 . A A . 38 ARG CA 1 1 8 5775 1 1 38 ARG CB C 5.889 -9.243 -1.064 1.00 . A A . 38 ARG CB 1 1 8 5776 1 1 38 ARG CD C 4.774 -9.680 1.221 1.00 . A A . 38 ARG CD 1 1 8 5777 1 1 38 ARG CG C 4.897 -8.748 0.003 1.00 . A A . 38 ARG CG 1 1 8 5778 1 1 38 ARG CZ C 2.582 -9.075 2.339 1.00 . A A . 38 ARG CZ 1 1 8 5779 1 1 38 ARG H H 8.024 -7.424 -1.065 1.00 . A A . 38 ARG H 1 1 8 5780 1 1 38 ARG HA H 7.432 -10.058 0.219 1.00 . A A . 38 ARG HA 1 1 8 5781 1 1 38 ARG HB2 H 5.859 -8.543 -1.901 1.00 . A A . 38 ARG HB2 1 1 8 5782 1 1 38 ARG HB3 H 5.561 -10.214 -1.427 1.00 . A A . 38 ARG HB3 1 1 8 5783 1 1 38 ARG HD2 H 5.173 -10.659 0.948 1.00 . A A . 38 ARG HD2 1 1 8 5784 1 1 38 ARG HD3 H 5.380 -9.306 2.050 1.00 . A A . 38 ARG HD3 1 1 8 5785 1 1 38 ARG HG2 H 5.175 -7.744 0.327 1.00 . A A . 38 ARG HG2 1 1 8 5786 1 1 38 ARG HG3 H 3.930 -8.699 -0.495 1.00 . A A . 38 ARG HG3 1 1 8 5787 1 1 38 ARG HH11 H 3.898 -7.531 2.377 1.00 . A A . 38 ARG HH11 1 1 8 5788 1 1 38 ARG HH12 H 2.354 -7.252 3.195 1.00 . A A . 38 ARG HH12 1 1 8 5789 1 1 38 ARG HH21 H 0.983 -10.366 2.490 1.00 . A A . 38 ARG HH21 1 1 8 5790 1 1 38 ARG HH22 H 0.788 -8.795 3.237 1.00 . A A . 38 ARG HH22 1 1 8 5791 1 1 38 ARG N N 7.862 -8.055 -0.285 1.00 . A A . 38 ARG N 1 1 8 5792 1 1 38 ARG NE N 3.369 -9.904 1.631 1.00 . A A . 38 ARG NE 1 1 8 5793 1 1 38 ARG NH1 N 2.998 -7.856 2.685 1.00 . A A . 38 ARG NH1 1 1 8 5794 1 1 38 ARG NH2 N 1.355 -9.454 2.709 1.00 . A A . 38 ARG NH2 1 1 8 5795 1 1 38 ARG O O 8.265 -9.162 -2.808 1.00 . A A . 38 ARG O 1 1 8 5796 1 1 39 GLU C C 10.545 -10.583 -3.424 1.00 . A A . 39 GLU C 1 1 8 5797 1 1 39 GLU CA C 9.670 -11.617 -2.710 1.00 . A A . 39 GLU CA 1 1 8 5798 1 1 39 GLU CB C 8.712 -12.337 -3.676 1.00 . A A . 39 GLU CB 1 1 8 5799 1 1 39 GLU CD C 7.209 -13.564 -1.951 1.00 . A A . 39 GLU CD 1 1 8 5800 1 1 39 GLU CG C 8.166 -13.671 -3.137 1.00 . A A . 39 GLU CG 1 1 8 5801 1 1 39 GLU H H 8.850 -11.468 -0.757 1.00 . A A . 39 GLU H 1 1 8 5802 1 1 39 GLU HA H 10.340 -12.364 -2.280 1.00 . A A . 39 GLU HA 1 1 8 5803 1 1 39 GLU HB2 H 7.889 -11.675 -3.957 1.00 . A A . 39 GLU HB2 1 1 8 5804 1 1 39 GLU HB3 H 9.267 -12.577 -4.584 1.00 . A A . 39 GLU HB3 1 1 8 5805 1 1 39 GLU HG2 H 7.625 -14.169 -3.942 1.00 . A A . 39 GLU HG2 1 1 8 5806 1 1 39 GLU HG3 H 9.005 -14.309 -2.856 1.00 . A A . 39 GLU HG3 1 1 8 5807 1 1 39 GLU N N 8.920 -10.977 -1.634 1.00 . A A . 39 GLU N 1 1 8 5808 1 1 39 GLU O O 10.297 -10.227 -4.574 1.00 . A A . 39 GLU O 1 1 8 5809 1 1 39 GLU OE1 O 6.556 -12.540 -1.765 1.00 . A A . 39 GLU OE1 1 1 8 5810 1 1 39 GLU OE2 O 7.149 -14.654 -1.143 1.00 . A A . 39 GLU OE2 1 1 8 5811 1 1 40 ASN C C 11.790 -7.609 -3.244 1.00 . A A . 40 ASN C 1 1 8 5812 1 1 40 ASN CA C 12.453 -8.985 -3.105 1.00 . A A . 40 ASN CA 1 1 8 5813 1 1 40 ASN CB C 13.223 -9.395 -4.373 1.00 . A A . 40 ASN CB 1 1 8 5814 1 1 40 ASN CG C 13.875 -8.204 -5.076 1.00 . A A . 40 ASN CG 1 1 8 5815 1 1 40 ASN H H 11.583 -10.366 -1.742 1.00 . A A . 40 ASN H 1 1 8 5816 1 1 40 ASN HA H 13.197 -8.875 -2.315 1.00 . A A . 40 ASN HA 1 1 8 5817 1 1 40 ASN HB2 H 13.976 -10.135 -4.102 1.00 . A A . 40 ASN HB2 1 1 8 5818 1 1 40 ASN HB3 H 12.561 -9.853 -5.101 1.00 . A A . 40 ASN HB3 1 1 8 5819 1 1 40 ASN HD21 H 15.595 -8.383 -3.991 1.00 . A A . 40 ASN HD21 1 1 8 5820 1 1 40 ASN HD22 H 15.542 -7.078 -5.159 1.00 . A A . 40 ASN HD22 1 1 8 5821 1 1 40 ASN N N 11.519 -10.034 -2.687 1.00 . A A . 40 ASN N 1 1 8 5822 1 1 40 ASN ND2 N 15.103 -7.862 -4.699 1.00 . A A . 40 ASN ND2 1 1 8 5823 1 1 40 ASN O O 12.446 -6.592 -3.022 1.00 . A A . 40 ASN O 1 1 8 5824 1 1 40 ASN OD1 O 13.276 -7.601 -5.963 1.00 . A A . 40 ASN OD1 1 1 8 5825 1 1 41 HIS C C 9.106 -5.649 -2.943 1.00 . A A . 41 HIS C 1 1 8 5826 1 1 41 HIS CA C 9.861 -6.344 -4.058 1.00 . A A . 41 HIS CA 1 1 8 5827 1 1 41 HIS CB C 8.957 -6.663 -5.247 1.00 . A A . 41 HIS CB 1 1 8 5828 1 1 41 HIS CD2 C 10.047 -8.153 -7.092 1.00 . A A . 41 HIS CD2 1 1 8 5829 1 1 41 HIS CE1 C 11.226 -6.589 -8.068 1.00 . A A . 41 HIS CE1 1 1 8 5830 1 1 41 HIS CG C 9.794 -6.961 -6.464 1.00 . A A . 41 HIS CG 1 1 8 5831 1 1 41 HIS H H 9.956 -8.405 -3.560 1.00 . A A . 41 HIS H 1 1 8 5832 1 1 41 HIS HA H 10.621 -5.658 -4.429 1.00 . A A . 41 HIS HA 1 1 8 5833 1 1 41 HIS HB2 H 8.310 -7.502 -4.989 1.00 . A A . 41 HIS HB2 1 1 8 5834 1 1 41 HIS HB3 H 8.326 -5.797 -5.453 1.00 . A A . 41 HIS HB3 1 1 8 5835 1 1 41 HIS HD1 H 10.538 -4.982 -6.859 1.00 . A A . 41 HIS HD1 1 1 8 5836 1 1 41 HIS HD2 H 9.662 -9.121 -6.800 1.00 . A A . 41 HIS HD2 1 1 8 5837 1 1 41 HIS HE1 H 11.929 -6.093 -8.723 1.00 . A A . 41 HIS HE1 1 1 8 5838 1 1 41 HIS N N 10.505 -7.552 -3.583 1.00 . A A . 41 HIS N 1 1 8 5839 1 1 41 HIS ND1 N 10.516 -5.970 -7.112 1.00 . A A . 41 HIS ND1 1 1 8 5840 1 1 41 HIS NE2 N 10.968 -7.909 -8.094 1.00 . A A . 41 HIS NE2 1 1 8 5841 1 1 41 HIS O O 8.141 -6.182 -2.400 1.00 . A A . 41 HIS O 1 1 8 5842 1 1 42 TRP C C 7.515 -3.124 -2.483 1.00 . A A . 42 TRP C 1 1 8 5843 1 1 42 TRP CA C 8.799 -3.528 -1.778 1.00 . A A . 42 TRP CA 1 1 8 5844 1 1 42 TRP CB C 9.702 -2.356 -1.406 1.00 . A A . 42 TRP CB 1 1 8 5845 1 1 42 TRP CD1 C 11.916 -3.366 -0.727 1.00 . A A . 42 TRP CD1 1 1 8 5846 1 1 42 TRP CD2 C 10.694 -2.694 1.023 1.00 . A A . 42 TRP CD2 1 1 8 5847 1 1 42 TRP CE2 C 11.877 -3.289 1.542 1.00 . A A . 42 TRP CE2 1 1 8 5848 1 1 42 TRP CE3 C 9.701 -2.321 1.950 1.00 . A A . 42 TRP CE3 1 1 8 5849 1 1 42 TRP CG C 10.749 -2.763 -0.427 1.00 . A A . 42 TRP CG 1 1 8 5850 1 1 42 TRP CH2 C 11.047 -3.135 3.809 1.00 . A A . 42 TRP CH2 1 1 8 5851 1 1 42 TRP CZ2 C 12.045 -3.544 2.908 1.00 . A A . 42 TRP CZ2 1 1 8 5852 1 1 42 TRP CZ3 C 9.897 -2.478 3.330 1.00 . A A . 42 TRP CZ3 1 1 8 5853 1 1 42 TRP H H 10.320 -4.056 -3.140 1.00 . A A . 42 TRP H 1 1 8 5854 1 1 42 TRP HA H 8.541 -4.013 -0.850 1.00 . A A . 42 TRP HA 1 1 8 5855 1 1 42 TRP HB2 H 10.166 -1.928 -2.290 1.00 . A A . 42 TRP HB2 1 1 8 5856 1 1 42 TRP HB3 H 9.111 -1.581 -0.935 1.00 . A A . 42 TRP HB3 1 1 8 5857 1 1 42 TRP HD1 H 12.203 -3.665 -1.719 1.00 . A A . 42 TRP HD1 1 1 8 5858 1 1 42 TRP HE1 H 13.501 -4.109 0.481 1.00 . A A . 42 TRP HE1 1 1 8 5859 1 1 42 TRP HE3 H 8.756 -1.963 1.585 1.00 . A A . 42 TRP HE3 1 1 8 5860 1 1 42 TRP HH2 H 11.153 -3.369 4.857 1.00 . A A . 42 TRP HH2 1 1 8 5861 1 1 42 TRP HZ2 H 12.873 -4.156 3.230 1.00 . A A . 42 TRP HZ2 1 1 8 5862 1 1 42 TRP HZ3 H 9.128 -2.125 4.002 1.00 . A A . 42 TRP HZ3 1 1 8 5863 1 1 42 TRP N N 9.534 -4.431 -2.634 1.00 . A A . 42 TRP N 1 1 8 5864 1 1 42 TRP NE1 N 12.610 -3.643 0.429 1.00 . A A . 42 TRP NE1 1 1 8 5865 1 1 42 TRP O O 7.569 -2.523 -3.549 1.00 . A A . 42 TRP O 1 1 8 5866 1 1 43 LYS C C 4.423 -2.232 -1.366 1.00 . A A . 43 LYS C 1 1 8 5867 1 1 43 LYS CA C 5.054 -3.115 -2.429 1.00 . A A . 43 LYS CA 1 1 8 5868 1 1 43 LYS CB C 4.163 -4.338 -2.654 1.00 . A A . 43 LYS CB 1 1 8 5869 1 1 43 LYS CD C 5.691 -5.445 -4.412 1.00 . A A . 43 LYS CD 1 1 8 5870 1 1 43 LYS CE C 4.794 -5.438 -5.668 1.00 . A A . 43 LYS CE 1 1 8 5871 1 1 43 LYS CG C 4.964 -5.569 -3.064 1.00 . A A . 43 LYS CG 1 1 8 5872 1 1 43 LYS H H 6.362 -4.134 -1.139 1.00 . A A . 43 LYS H 1 1 8 5873 1 1 43 LYS HA H 5.146 -2.580 -3.374 1.00 . A A . 43 LYS HA 1 1 8 5874 1 1 43 LYS HB2 H 3.680 -4.583 -1.713 1.00 . A A . 43 LYS HB2 1 1 8 5875 1 1 43 LYS HB3 H 3.374 -4.113 -3.368 1.00 . A A . 43 LYS HB3 1 1 8 5876 1 1 43 LYS HD2 H 6.366 -4.591 -4.430 1.00 . A A . 43 LYS HD2 1 1 8 5877 1 1 43 LYS HD3 H 6.299 -6.348 -4.473 1.00 . A A . 43 LYS HD3 1 1 8 5878 1 1 43 LYS HE2 H 5.429 -5.696 -6.518 1.00 . A A . 43 LYS HE2 1 1 8 5879 1 1 43 LYS HE3 H 4.029 -6.211 -5.579 1.00 . A A . 43 LYS HE3 1 1 8 5880 1 1 43 LYS HG2 H 5.628 -5.787 -2.223 1.00 . A A . 43 LYS HG2 1 1 8 5881 1 1 43 LYS HG3 H 4.329 -6.431 -3.123 1.00 . A A . 43 LYS HG3 1 1 8 5882 1 1 43 LYS HZ1 H 4.463 -3.818 -6.908 1.00 . A A . 43 LYS HZ1 1 1 8 5883 1 1 43 LYS HZ2 H 3.133 -4.246 -5.972 1.00 . A A . 43 LYS HZ2 1 1 8 5884 1 1 43 LYS N N 6.360 -3.507 -1.939 1.00 . A A . 43 LYS N 1 1 8 5885 1 1 43 LYS NZ N 4.157 -4.137 -5.978 1.00 . A A . 43 LYS NZ 1 1 8 5886 1 1 43 LYS O O 4.479 -2.561 -0.181 1.00 . A A . 43 LYS O 1 1 8 5887 1 1 44 CYS C C 1.602 -1.141 -0.779 1.00 . A A . 44 CYS C 1 1 8 5888 1 1 44 CYS CA C 2.891 -0.366 -0.983 1.00 . A A . 44 CYS CA 1 1 8 5889 1 1 44 CYS CB C 2.629 0.966 -1.665 1.00 . A A . 44 CYS CB 1 1 8 5890 1 1 44 CYS H H 3.812 -0.951 -2.794 1.00 . A A . 44 CYS H 1 1 8 5891 1 1 44 CYS HA H 3.329 -0.148 -0.019 1.00 . A A . 44 CYS HA 1 1 8 5892 1 1 44 CYS HB2 H 3.547 1.541 -1.562 1.00 . A A . 44 CYS HB2 1 1 8 5893 1 1 44 CYS HB3 H 2.396 0.806 -2.714 1.00 . A A . 44 CYS HB3 1 1 8 5894 1 1 44 CYS N N 3.793 -1.149 -1.806 1.00 . A A . 44 CYS N 1 1 8 5895 1 1 44 CYS O O 0.806 -1.230 -1.706 1.00 . A A . 44 CYS O 1 1 8 5896 1 1 44 CYS SG S 1.269 1.894 -0.931 1.00 . A A . 44 CYS SG 1 1 8 5897 1 1 45 PHE C C -0.816 -1.334 1.249 1.00 . A A . 45 PHE C 1 1 8 5898 1 1 45 PHE CA C 0.136 -2.384 0.691 1.00 . A A . 45 PHE CA 1 1 8 5899 1 1 45 PHE CB C 0.328 -3.526 1.688 1.00 . A A . 45 PHE CB 1 1 8 5900 1 1 45 PHE CD1 C 1.893 -5.074 0.414 1.00 . A A . 45 PHE CD1 1 1 8 5901 1 1 45 PHE CD2 C -0.290 -5.901 1.077 1.00 . A A . 45 PHE CD2 1 1 8 5902 1 1 45 PHE CE1 C 2.187 -6.324 -0.158 1.00 . A A . 45 PHE CE1 1 1 8 5903 1 1 45 PHE CE2 C 0.001 -7.151 0.509 1.00 . A A . 45 PHE CE2 1 1 8 5904 1 1 45 PHE CG C 0.660 -4.865 1.054 1.00 . A A . 45 PHE CG 1 1 8 5905 1 1 45 PHE CZ C 1.238 -7.361 -0.121 1.00 . A A . 45 PHE CZ 1 1 8 5906 1 1 45 PHE H H 2.028 -1.544 1.177 1.00 . A A . 45 PHE H 1 1 8 5907 1 1 45 PHE HA H -0.297 -2.806 -0.220 1.00 . A A . 45 PHE HA 1 1 8 5908 1 1 45 PHE HB2 H 1.092 -3.233 2.400 1.00 . A A . 45 PHE HB2 1 1 8 5909 1 1 45 PHE HB3 H -0.594 -3.639 2.251 1.00 . A A . 45 PHE HB3 1 1 8 5910 1 1 45 PHE HD1 H 2.605 -4.265 0.341 1.00 . A A . 45 PHE HD1 1 1 8 5911 1 1 45 PHE HD2 H -1.280 -5.713 1.458 1.00 . A A . 45 PHE HD2 1 1 8 5912 1 1 45 PHE HE1 H 3.133 -6.483 -0.651 1.00 . A A . 45 PHE HE1 1 1 8 5913 1 1 45 PHE HE2 H -0.746 -7.934 0.512 1.00 . A A . 45 PHE HE2 1 1 8 5914 1 1 45 PHE HZ H 1.442 -8.305 -0.604 1.00 . A A . 45 PHE HZ 1 1 8 5915 1 1 45 PHE N N 1.401 -1.733 0.399 1.00 . A A . 45 PHE N 1 1 8 5916 1 1 45 PHE O O -0.395 -0.431 1.971 1.00 . A A . 45 PHE O 1 1 8 5917 1 1 46 CYS C C -3.938 -1.550 2.464 1.00 . A A . 46 CYS C 1 1 8 5918 1 1 46 CYS CA C -3.194 -0.697 1.444 1.00 . A A . 46 CYS CA 1 1 8 5919 1 1 46 CYS CB C -4.108 -0.283 0.292 1.00 . A A . 46 CYS CB 1 1 8 5920 1 1 46 CYS H H -2.355 -2.310 0.397 1.00 . A A . 46 CYS H 1 1 8 5921 1 1 46 CYS HA H -2.846 0.192 1.967 1.00 . A A . 46 CYS HA 1 1 8 5922 1 1 46 CYS HB2 H -4.484 -1.186 -0.180 1.00 . A A . 46 CYS HB2 1 1 8 5923 1 1 46 CYS HB3 H -4.943 0.258 0.716 1.00 . A A . 46 CYS HB3 1 1 8 5924 1 1 46 CYS N N -2.095 -1.487 0.928 1.00 . A A . 46 CYS N 1 1 8 5925 1 1 46 CYS O O -3.858 -2.776 2.434 1.00 . A A . 46 CYS O 1 1 8 5926 1 1 46 CYS SG S -3.406 0.755 -1.020 1.00 . A A . 46 CYS SG 1 1 8 5927 1 1 47 TYR C C -6.627 -1.028 4.711 1.00 . A A . 47 TYR C 1 1 8 5928 1 1 47 TYR CA C -5.192 -1.502 4.590 1.00 . A A . 47 TYR CA 1 1 8 5929 1 1 47 TYR CB C -4.385 -1.024 5.797 1.00 . A A . 47 TYR CB 1 1 8 5930 1 1 47 TYR CD1 C -1.969 -1.320 5.142 1.00 . A A . 47 TYR CD1 1 1 8 5931 1 1 47 TYR CD2 C -2.925 -2.785 6.841 1.00 . A A . 47 TYR CD2 1 1 8 5932 1 1 47 TYR CE1 C -0.782 -2.061 5.165 1.00 . A A . 47 TYR CE1 1 1 8 5933 1 1 47 TYR CE2 C -1.715 -3.484 6.910 1.00 . A A . 47 TYR CE2 1 1 8 5934 1 1 47 TYR CG C -3.059 -1.718 5.937 1.00 . A A . 47 TYR CG 1 1 8 5935 1 1 47 TYR CZ C -0.671 -3.157 6.032 1.00 . A A . 47 TYR CZ 1 1 8 5936 1 1 47 TYR H H -4.616 0.122 3.355 1.00 . A A . 47 TYR H 1 1 8 5937 1 1 47 TYR HA H -5.162 -2.590 4.551 1.00 . A A . 47 TYR HA 1 1 8 5938 1 1 47 TYR HB2 H -4.205 0.036 5.657 1.00 . A A . 47 TYR HB2 1 1 8 5939 1 1 47 TYR HB3 H -4.949 -1.154 6.719 1.00 . A A . 47 TYR HB3 1 1 8 5940 1 1 47 TYR HD1 H -2.062 -0.477 4.477 1.00 . A A . 47 TYR HD1 1 1 8 5941 1 1 47 TYR HD2 H -3.754 -3.086 7.463 1.00 . A A . 47 TYR HD2 1 1 8 5942 1 1 47 TYR HE1 H 0.022 -1.794 4.497 1.00 . A A . 47 TYR HE1 1 1 8 5943 1 1 47 TYR HE2 H -1.609 -4.292 7.620 1.00 . A A . 47 TYR HE2 1 1 8 5944 1 1 47 TYR HH H 0.354 -4.723 6.551 1.00 . A A . 47 TYR HH 1 1 8 5945 1 1 47 TYR N N -4.616 -0.893 3.401 1.00 . A A . 47 TYR N 1 1 8 5946 1 1 47 TYR O O -6.835 0.127 5.080 1.00 . A A . 47 TYR O 1 1 8 5947 1 1 47 TYR OH O 0.447 -3.928 6.012 1.00 . A A . 47 TYR OH 1 1 8 5948 1 1 48 PHE C C -9.610 -1.830 5.756 1.00 . A A . 48 PHE C 1 1 8 5949 1 1 48 PHE CA C -8.987 -1.459 4.410 1.00 . A A . 48 PHE CA 1 1 8 5950 1 1 48 PHE CB C -9.643 -2.230 3.259 1.00 . A A . 48 PHE CB 1 1 8 5951 1 1 48 PHE CD1 C -7.958 -2.364 1.363 1.00 . A A . 48 PHE CD1 1 1 8 5952 1 1 48 PHE CD2 C -9.843 -0.840 1.148 1.00 . A A . 48 PHE CD2 1 1 8 5953 1 1 48 PHE CE1 C -7.397 -1.832 0.192 1.00 . A A . 48 PHE CE1 1 1 8 5954 1 1 48 PHE CE2 C -9.282 -0.313 -0.030 1.00 . A A . 48 PHE CE2 1 1 8 5955 1 1 48 PHE CG C -9.146 -1.816 1.884 1.00 . A A . 48 PHE CG 1 1 8 5956 1 1 48 PHE CZ C -8.037 -0.779 -0.485 1.00 . A A . 48 PHE CZ 1 1 8 5957 1 1 48 PHE H H -7.424 -2.828 4.106 1.00 . A A . 48 PHE H 1 1 8 5958 1 1 48 PHE HA H -9.101 -0.391 4.233 1.00 . A A . 48 PHE HA 1 1 8 5959 1 1 48 PHE HB2 H -9.475 -3.298 3.393 1.00 . A A . 48 PHE HB2 1 1 8 5960 1 1 48 PHE HB3 H -10.708 -2.083 3.316 1.00 . A A . 48 PHE HB3 1 1 8 5961 1 1 48 PHE HD1 H -7.431 -3.141 1.897 1.00 . A A . 48 PHE HD1 1 1 8 5962 1 1 48 PHE HD2 H -10.776 -0.435 1.514 1.00 . A A . 48 PHE HD2 1 1 8 5963 1 1 48 PHE HE1 H -6.447 -2.206 -0.154 1.00 . A A . 48 PHE HE1 1 1 8 5964 1 1 48 PHE HE2 H -9.789 0.494 -0.542 1.00 . A A . 48 PHE HE2 1 1 8 5965 1 1 48 PHE HZ H -7.566 -0.311 -1.339 1.00 . A A . 48 PHE HZ 1 1 8 5966 1 1 48 PHE N N -7.605 -1.873 4.390 1.00 . A A . 48 PHE N 1 1 8 5967 1 1 48 PHE O O -8.990 -2.528 6.556 1.00 . A A . 48 PHE O 1 1 8 5968 1 1 49 ASN C C -11.037 -1.763 8.438 1.00 . A A . 49 ASN C 1 1 8 5969 1 1 49 ASN CA C -11.752 -1.783 7.075 1.00 . A A . 49 ASN CA 1 1 8 5970 1 1 49 ASN CB C -12.489 -3.111 6.843 1.00 . A A . 49 ASN CB 1 1 8 5971 1 1 49 ASN CG C -13.165 -3.171 5.477 1.00 . A A . 49 ASN CG 1 1 8 5972 1 1 49 ASN H H -11.323 -0.947 5.190 1.00 . A A . 49 ASN H 1 1 8 5973 1 1 49 ASN HA H -12.506 -0.997 7.112 1.00 . A A . 49 ASN HA 1 1 8 5974 1 1 49 ASN HB2 H -11.770 -3.926 6.923 1.00 . A A . 49 ASN HB2 1 1 8 5975 1 1 49 ASN HB3 H -13.254 -3.245 7.608 1.00 . A A . 49 ASN HB3 1 1 8 5976 1 1 49 ASN HD21 H -12.320 -4.976 5.060 1.00 . A A . 49 ASN HD21 1 1 8 5977 1 1 49 ASN HD22 H -13.354 -4.303 3.807 1.00 . A A . 49 ASN HD22 1 1 8 5978 1 1 49 ASN N N -10.894 -1.495 5.923 1.00 . A A . 49 ASN N 1 1 8 5979 1 1 49 ASN ND2 N -12.927 -4.236 4.716 1.00 . A A . 49 ASN ND2 1 1 8 5980 1 1 49 ASN O O -11.392 -2.540 9.328 1.00 . A A . 49 ASN O 1 1 8 5981 1 1 49 ASN OD1 O -13.874 -2.249 5.088 1.00 . A A . 49 ASN OD1 1 1 8 5982 1 1 50 CYS C C -9.751 -0.058 10.931 1.00 . A A . 50 CYS C 1 1 8 5983 1 1 50 CYS CA C -9.183 -0.923 9.812 1.00 . A A . 50 CYS CA 1 1 8 5984 1 1 50 CYS CB C -7.777 -0.473 9.446 1.00 . A A . 50 CYS CB 1 1 8 5985 1 1 50 CYS H H -9.806 -0.228 7.899 1.00 . A A . 50 CYS H 1 1 8 5986 1 1 50 CYS HA H -9.087 -1.940 10.167 1.00 . A A . 50 CYS HA 1 1 8 5987 1 1 50 CYS HB2 H -7.430 -1.010 8.565 1.00 . A A . 50 CYS HB2 1 1 8 5988 1 1 50 CYS HB3 H -7.847 0.575 9.209 1.00 . A A . 50 CYS HB3 1 1 8 5989 1 1 50 CYS N N -10.043 -0.889 8.633 1.00 . A A . 50 CYS N 1 1 8 5990 1 1 50 CYS O O -9.980 1.173 10.716 1.00 . A A . 50 CYS O 1 1 8 5991 1 1 50 CYS OXT O -9.995 -0.565 12.070 1.00 . A A . 50 CYS OXT 1 1 8 5992 1 1 50 CYS SG S -6.522 -0.627 10.738 1.00 . A A . 50 CYS SG 1 1 9 5993 1 1 1 LEU C C -9.815 -5.020 9.032 1.00 . A A . 1 LEU C 1 1 9 5994 1 1 1 LEU CA C -10.862 -5.558 10.015 1.00 . A A . 1 LEU CA 1 1 9 5995 1 1 1 LEU CB C -11.103 -7.061 9.801 1.00 . A A . 1 LEU CB 1 1 9 5996 1 1 1 LEU CD1 C -9.260 -7.910 11.346 1.00 . A A . 1 LEU CD1 1 1 9 5997 1 1 1 LEU CD2 C -10.208 -9.385 9.568 1.00 . A A . 1 LEU CD2 1 1 9 5998 1 1 1 LEU CG C -9.844 -7.940 9.927 1.00 . A A . 1 LEU CG 1 1 9 5999 1 1 1 LEU H1 H -12.486 -4.927 8.917 1.00 . A A . 1 LEU H1 1 1 9 6000 1 1 1 LEU H2 H -12.818 -5.195 10.543 1.00 . A A . 1 LEU H2 1 1 9 6001 1 1 1 LEU H3 H -11.968 -3.822 10.074 1.00 . A A . 1 LEU H3 1 1 9 6002 1 1 1 LEU HA H -10.511 -5.391 11.032 1.00 . A A . 1 LEU HA 1 1 9 6003 1 1 1 LEU HB2 H -11.841 -7.407 10.527 1.00 . A A . 1 LEU HB2 1 1 9 6004 1 1 1 LEU HB3 H -11.517 -7.199 8.803 1.00 . A A . 1 LEU HB3 1 1 9 6005 1 1 1 LEU HD11 H -10.017 -8.211 12.070 1.00 . A A . 1 LEU HD11 1 1 9 6006 1 1 1 LEU HD12 H -8.419 -8.602 11.408 1.00 . A A . 1 LEU HD12 1 1 9 6007 1 1 1 LEU HD13 H -8.898 -6.915 11.597 1.00 . A A . 1 LEU HD13 1 1 9 6008 1 1 1 LEU HD21 H -10.597 -9.432 8.550 1.00 . A A . 1 LEU HD21 1 1 9 6009 1 1 1 LEU HD22 H -9.322 -10.018 9.631 1.00 . A A . 1 LEU HD22 1 1 9 6010 1 1 1 LEU HD23 H -10.964 -9.766 10.256 1.00 . A A . 1 LEU HD23 1 1 9 6011 1 1 1 LEU HG H -9.081 -7.613 9.221 1.00 . A A . 1 LEU HG 1 1 9 6012 1 1 1 LEU N N -12.128 -4.821 9.876 1.00 . A A . 1 LEU N 1 1 9 6013 1 1 1 LEU O O -10.131 -4.700 7.889 1.00 . A A . 1 LEU O 1 1 9 6014 1 1 2 CYS C C -7.103 -5.444 7.556 1.00 . A A . 2 CYS C 1 1 9 6015 1 1 2 CYS CA C -7.462 -4.438 8.646 1.00 . A A . 2 CYS CA 1 1 9 6016 1 1 2 CYS CB C -6.261 -4.012 9.509 1.00 . A A . 2 CYS CB 1 1 9 6017 1 1 2 CYS H H -8.328 -5.146 10.420 1.00 . A A . 2 CYS H 1 1 9 6018 1 1 2 CYS HA H -7.805 -3.537 8.138 1.00 . A A . 2 CYS HA 1 1 9 6019 1 1 2 CYS HB2 H -5.699 -4.901 9.793 1.00 . A A . 2 CYS HB2 1 1 9 6020 1 1 2 CYS HB3 H -5.609 -3.380 8.917 1.00 . A A . 2 CYS HB3 1 1 9 6021 1 1 2 CYS N N -8.560 -4.907 9.471 1.00 . A A . 2 CYS N 1 1 9 6022 1 1 2 CYS O O -6.106 -6.158 7.652 1.00 . A A . 2 CYS O 1 1 9 6023 1 1 2 CYS SG S -6.645 -3.166 11.065 1.00 . A A . 2 CYS SG 1 1 9 6024 1 1 3 ASN C C -6.399 -5.569 4.624 1.00 . A A . 3 ASN C 1 1 9 6025 1 1 3 ASN CA C -7.565 -6.273 5.312 1.00 . A A . 3 ASN CA 1 1 9 6026 1 1 3 ASN CB C -8.741 -6.487 4.338 1.00 . A A . 3 ASN CB 1 1 9 6027 1 1 3 ASN CG C -10.087 -6.866 4.957 1.00 . A A . 3 ASN CG 1 1 9 6028 1 1 3 ASN H H -8.755 -4.927 6.509 1.00 . A A . 3 ASN H 1 1 9 6029 1 1 3 ASN HA H -7.250 -7.265 5.643 1.00 . A A . 3 ASN HA 1 1 9 6030 1 1 3 ASN HB2 H -8.908 -5.581 3.760 1.00 . A A . 3 ASN HB2 1 1 9 6031 1 1 3 ASN HB3 H -8.455 -7.265 3.628 1.00 . A A . 3 ASN HB3 1 1 9 6032 1 1 3 ASN HD21 H -9.278 -7.458 6.728 1.00 . A A . 3 ASN HD21 1 1 9 6033 1 1 3 ASN HD22 H -11.027 -7.570 6.584 1.00 . A A . 3 ASN HD22 1 1 9 6034 1 1 3 ASN N N -7.892 -5.462 6.479 1.00 . A A . 3 ASN N 1 1 9 6035 1 1 3 ASN ND2 N -10.125 -7.351 6.192 1.00 . A A . 3 ASN ND2 1 1 9 6036 1 1 3 ASN O O -6.585 -4.626 3.850 1.00 . A A . 3 ASN O 1 1 9 6037 1 1 3 ASN OD1 O -11.122 -6.694 4.321 1.00 . A A . 3 ASN OD1 1 1 9 6038 1 1 4 GLU C C -3.691 -6.020 3.099 1.00 . A A . 4 GLU C 1 1 9 6039 1 1 4 GLU CA C -3.937 -5.483 4.510 1.00 . A A . 4 GLU CA 1 1 9 6040 1 1 4 GLU CB C -2.857 -5.922 5.501 1.00 . A A . 4 GLU CB 1 1 9 6041 1 1 4 GLU CD C -0.382 -6.238 5.008 1.00 . A A . 4 GLU CD 1 1 9 6042 1 1 4 GLU CG C -1.552 -5.271 5.064 1.00 . A A . 4 GLU CG 1 1 9 6043 1 1 4 GLU H H -5.117 -6.638 5.762 1.00 . A A . 4 GLU H 1 1 9 6044 1 1 4 GLU HA H -3.964 -4.398 4.490 1.00 . A A . 4 GLU HA 1 1 9 6045 1 1 4 GLU HB2 H -3.108 -5.574 6.506 1.00 . A A . 4 GLU HB2 1 1 9 6046 1 1 4 GLU HB3 H -2.785 -7.011 5.523 1.00 . A A . 4 GLU HB3 1 1 9 6047 1 1 4 GLU HG2 H -1.710 -4.836 4.086 1.00 . A A . 4 GLU HG2 1 1 9 6048 1 1 4 GLU HG3 H -1.319 -4.470 5.753 1.00 . A A . 4 GLU HG3 1 1 9 6049 1 1 4 GLU N N -5.191 -5.985 4.998 1.00 . A A . 4 GLU N 1 1 9 6050 1 1 4 GLU O O -2.979 -7.009 2.918 1.00 . A A . 4 GLU O 1 1 9 6051 1 1 4 GLU OE1 O -0.565 -7.370 4.273 1.00 . A A . 4 GLU OE1 1 1 9 6052 1 1 4 GLU OE2 O 0.650 -5.927 5.599 1.00 . A A . 4 GLU OE2 1 1 9 6053 1 1 5 ARG C C -2.895 -5.178 0.103 1.00 . A A . 5 ARG C 1 1 9 6054 1 1 5 ARG CA C -4.197 -5.715 0.716 1.00 . A A . 5 ARG CA 1 1 9 6055 1 1 5 ARG CB C -5.416 -5.122 0.008 1.00 . A A . 5 ARG CB 1 1 9 6056 1 1 5 ARG CD C -6.746 -4.941 -2.139 1.00 . A A . 5 ARG CD 1 1 9 6057 1 1 5 ARG CG C -5.716 -5.756 -1.352 1.00 . A A . 5 ARG CG 1 1 9 6058 1 1 5 ARG CZ C -9.058 -4.063 -1.859 1.00 . A A . 5 ARG CZ 1 1 9 6059 1 1 5 ARG H H -4.652 -4.429 2.347 1.00 . A A . 5 ARG H 1 1 9 6060 1 1 5 ARG HA H -4.286 -6.799 0.667 1.00 . A A . 5 ARG HA 1 1 9 6061 1 1 5 ARG HB2 H -6.281 -5.274 0.649 1.00 . A A . 5 ARG HB2 1 1 9 6062 1 1 5 ARG HB3 H -5.220 -4.060 -0.124 1.00 . A A . 5 ARG HB3 1 1 9 6063 1 1 5 ARG HD2 H -6.328 -3.947 -2.283 1.00 . A A . 5 ARG HD2 1 1 9 6064 1 1 5 ARG HD3 H -6.896 -5.418 -3.109 1.00 . A A . 5 ARG HD3 1 1 9 6065 1 1 5 ARG HG2 H -4.809 -5.758 -1.952 1.00 . A A . 5 ARG HG2 1 1 9 6066 1 1 5 ARG HG3 H -6.065 -6.780 -1.210 1.00 . A A . 5 ARG HG3 1 1 9 6067 1 1 5 ARG HH11 H -8.187 -3.572 -3.643 1.00 . A A . 5 ARG HH11 1 1 9 6068 1 1 5 ARG HH12 H -9.767 -2.897 -3.397 1.00 . A A . 5 ARG HH12 1 1 9 6069 1 1 5 ARG HH21 H -10.143 -4.290 -0.144 1.00 . A A . 5 ARG HH21 1 1 9 6070 1 1 5 ARG HH22 H -10.895 -3.311 -1.356 1.00 . A A . 5 ARG HH22 1 1 9 6071 1 1 5 ARG N N -4.258 -5.336 2.112 1.00 . A A . 5 ARG N 1 1 9 6072 1 1 5 ARG NE N -8.029 -4.815 -1.435 1.00 . A A . 5 ARG NE 1 1 9 6073 1 1 5 ARG NH1 N -9.009 -3.465 -3.054 1.00 . A A . 5 ARG NH1 1 1 9 6074 1 1 5 ARG NH2 N -10.134 -3.910 -1.078 1.00 . A A . 5 ARG NH2 1 1 9 6075 1 1 5 ARG O O -2.472 -4.078 0.462 1.00 . A A . 5 ARG O 1 1 9 6076 1 1 6 PRO C C -1.432 -4.176 -2.399 1.00 . A A . 6 PRO C 1 1 9 6077 1 1 6 PRO CA C -1.131 -5.454 -1.605 1.00 . A A . 6 PRO CA 1 1 9 6078 1 1 6 PRO CB C -0.798 -6.606 -2.559 1.00 . A A . 6 PRO CB 1 1 9 6079 1 1 6 PRO CD C -2.525 -7.327 -1.075 1.00 . A A . 6 PRO CD 1 1 9 6080 1 1 6 PRO CG C -1.294 -7.845 -1.817 1.00 . A A . 6 PRO CG 1 1 9 6081 1 1 6 PRO HA H -0.285 -5.276 -0.941 1.00 . A A . 6 PRO HA 1 1 9 6082 1 1 6 PRO HB2 H -1.374 -6.500 -3.481 1.00 . A A . 6 PRO HB2 1 1 9 6083 1 1 6 PRO HB3 H 0.267 -6.660 -2.786 1.00 . A A . 6 PRO HB3 1 1 9 6084 1 1 6 PRO HD2 H -3.415 -7.415 -1.699 1.00 . A A . 6 PRO HD2 1 1 9 6085 1 1 6 PRO HD3 H -2.658 -7.888 -0.151 1.00 . A A . 6 PRO HD3 1 1 9 6086 1 1 6 PRO HG2 H -1.534 -8.667 -2.492 1.00 . A A . 6 PRO HG2 1 1 9 6087 1 1 6 PRO HG3 H -0.538 -8.159 -1.096 1.00 . A A . 6 PRO HG3 1 1 9 6088 1 1 6 PRO N N -2.257 -5.925 -0.811 1.00 . A A . 6 PRO N 1 1 9 6089 1 1 6 PRO O O -2.569 -3.718 -2.476 1.00 . A A . 6 PRO O 1 1 9 6090 1 1 7 SER C C -1.600 -2.476 -4.872 1.00 . A A . 7 SER C 1 1 9 6091 1 1 7 SER CA C -0.386 -2.507 -3.944 1.00 . A A . 7 SER CA 1 1 9 6092 1 1 7 SER CB C 0.930 -2.533 -4.734 1.00 . A A . 7 SER CB 1 1 9 6093 1 1 7 SER H H 0.509 -4.105 -2.923 1.00 . A A . 7 SER H 1 1 9 6094 1 1 7 SER HA H -0.413 -1.581 -3.379 1.00 . A A . 7 SER HA 1 1 9 6095 1 1 7 SER HB2 H 0.813 -1.971 -5.666 1.00 . A A . 7 SER HB2 1 1 9 6096 1 1 7 SER HB3 H 1.705 -2.055 -4.137 1.00 . A A . 7 SER HB3 1 1 9 6097 1 1 7 SER HG H 0.523 -4.311 -5.371 1.00 . A A . 7 SER HG 1 1 9 6098 1 1 7 SER N N -0.382 -3.647 -3.034 1.00 . A A . 7 SER N 1 1 9 6099 1 1 7 SER O O -1.862 -3.446 -5.584 1.00 . A A . 7 SER O 1 1 9 6100 1 1 7 SER OG O 1.309 -3.876 -5.009 1.00 . A A . 7 SER OG 1 1 9 6101 1 1 8 GLN C C -2.963 0.088 -6.705 1.00 . A A . 8 GLN C 1 1 9 6102 1 1 8 GLN CA C -3.404 -1.051 -5.785 1.00 . A A . 8 GLN CA 1 1 9 6103 1 1 8 GLN CB C -4.637 -0.694 -4.950 1.00 . A A . 8 GLN CB 1 1 9 6104 1 1 8 GLN CD C -5.575 -3.057 -4.695 1.00 . A A . 8 GLN CD 1 1 9 6105 1 1 8 GLN CG C -5.042 -1.816 -3.987 1.00 . A A . 8 GLN CG 1 1 9 6106 1 1 8 GLN H H -2.189 -0.674 -4.140 1.00 . A A . 8 GLN H 1 1 9 6107 1 1 8 GLN HA H -3.633 -1.902 -6.427 1.00 . A A . 8 GLN HA 1 1 9 6108 1 1 8 GLN HB2 H -4.437 0.187 -4.339 1.00 . A A . 8 GLN HB2 1 1 9 6109 1 1 8 GLN HB3 H -5.460 -0.465 -5.619 1.00 . A A . 8 GLN HB3 1 1 9 6110 1 1 8 GLN HE21 H -3.702 -3.737 -5.195 1.00 . A A . 8 GLN HE21 1 1 9 6111 1 1 8 GLN HE22 H -5.053 -4.728 -5.704 1.00 . A A . 8 GLN HE22 1 1 9 6112 1 1 8 GLN HG2 H -4.216 -2.087 -3.333 1.00 . A A . 8 GLN HG2 1 1 9 6113 1 1 8 GLN HG3 H -5.824 -1.415 -3.349 1.00 . A A . 8 GLN HG3 1 1 9 6114 1 1 8 GLN N N -2.328 -1.356 -4.867 1.00 . A A . 8 GLN N 1 1 9 6115 1 1 8 GLN NE2 N -4.705 -3.911 -5.227 1.00 . A A . 8 GLN NE2 1 1 9 6116 1 1 8 GLN O O -2.571 -0.150 -7.843 1.00 . A A . 8 GLN O 1 1 9 6117 1 1 8 GLN OE1 O -6.786 -3.270 -4.727 1.00 . A A . 8 GLN OE1 1 1 9 6118 1 1 9 THR C C -1.249 2.965 -6.843 1.00 . A A . 9 THR C 1 1 9 6119 1 1 9 THR CA C -2.712 2.532 -6.976 1.00 . A A . 9 THR CA 1 1 9 6120 1 1 9 THR CB C -3.656 3.613 -6.438 1.00 . A A . 9 THR CB 1 1 9 6121 1 1 9 THR CG2 C -5.087 3.371 -6.925 1.00 . A A . 9 THR CG2 1 1 9 6122 1 1 9 THR H H -3.303 1.513 -5.267 1.00 . A A . 9 THR H 1 1 9 6123 1 1 9 THR HA H -2.916 2.374 -8.036 1.00 . A A . 9 THR HA 1 1 9 6124 1 1 9 THR HB H -3.333 4.596 -6.784 1.00 . A A . 9 THR HB 1 1 9 6125 1 1 9 THR HG1 H -4.105 4.324 -4.678 1.00 . A A . 9 THR HG1 1 1 9 6126 1 1 9 THR HG21 H -5.434 2.388 -6.609 1.00 . A A . 9 THR HG21 1 1 9 6127 1 1 9 THR HG22 H -5.753 4.127 -6.517 1.00 . A A . 9 THR HG22 1 1 9 6128 1 1 9 THR HG23 H -5.114 3.430 -8.015 1.00 . A A . 9 THR HG23 1 1 9 6129 1 1 9 THR N N -2.988 1.328 -6.210 1.00 . A A . 9 THR N 1 1 9 6130 1 1 9 THR O O -0.927 4.127 -7.085 1.00 . A A . 9 THR O 1 1 9 6131 1 1 9 THR OG1 O -3.652 3.549 -5.020 1.00 . A A . 9 THR OG1 1 1 9 6132 1 1 10 TRP C C 1.790 1.805 -7.572 1.00 . A A . 10 TRP C 1 1 9 6133 1 1 10 TRP CA C 1.063 2.332 -6.333 1.00 . A A . 10 TRP CA 1 1 9 6134 1 1 10 TRP CB C 1.615 1.721 -5.046 1.00 . A A . 10 TRP CB 1 1 9 6135 1 1 10 TRP CD1 C 4.104 1.369 -5.321 1.00 . A A . 10 TRP CD1 1 1 9 6136 1 1 10 TRP CD2 C 3.610 3.217 -4.157 1.00 . A A . 10 TRP CD2 1 1 9 6137 1 1 10 TRP CE2 C 5.010 3.249 -4.405 1.00 . A A . 10 TRP CE2 1 1 9 6138 1 1 10 TRP CE3 C 3.064 4.275 -3.405 1.00 . A A . 10 TRP CE3 1 1 9 6139 1 1 10 TRP CG C 3.053 2.059 -4.835 1.00 . A A . 10 TRP CG 1 1 9 6140 1 1 10 TRP CH2 C 5.238 5.363 -3.264 1.00 . A A . 10 TRP CH2 1 1 9 6141 1 1 10 TRP CZ2 C 5.826 4.298 -3.963 1.00 . A A . 10 TRP CZ2 1 1 9 6142 1 1 10 TRP CZ3 C 3.867 5.345 -2.972 1.00 . A A . 10 TRP CZ3 1 1 9 6143 1 1 10 TRP H H -0.660 1.106 -6.299 1.00 . A A . 10 TRP H 1 1 9 6144 1 1 10 TRP HA H 1.229 3.408 -6.271 1.00 . A A . 10 TRP HA 1 1 9 6145 1 1 10 TRP HB2 H 1.050 2.138 -4.210 1.00 . A A . 10 TRP HB2 1 1 9 6146 1 1 10 TRP HB3 H 1.486 0.638 -5.062 1.00 . A A . 10 TRP HB3 1 1 9 6147 1 1 10 TRP HD1 H 4.033 0.466 -5.910 1.00 . A A . 10 TRP HD1 1 1 9 6148 1 1 10 TRP HE1 H 6.166 1.864 -5.504 1.00 . A A . 10 TRP HE1 1 1 9 6149 1 1 10 TRP HE3 H 2.014 4.260 -3.167 1.00 . A A . 10 TRP HE3 1 1 9 6150 1 1 10 TRP HH2 H 5.828 6.209 -2.969 1.00 . A A . 10 TRP HH2 1 1 9 6151 1 1 10 TRP HZ2 H 6.881 4.308 -4.190 1.00 . A A . 10 TRP HZ2 1 1 9 6152 1 1 10 TRP HZ3 H 3.425 6.167 -2.431 1.00 . A A . 10 TRP HZ3 1 1 9 6153 1 1 10 TRP N N -0.358 2.056 -6.438 1.00 . A A . 10 TRP N 1 1 9 6154 1 1 10 TRP NE1 N 5.255 2.101 -5.129 1.00 . A A . 10 TRP NE1 1 1 9 6155 1 1 10 TRP O O 1.372 0.816 -8.173 1.00 . A A . 10 TRP O 1 1 9 6156 1 1 11 SER C C 4.538 0.832 -8.859 1.00 . A A . 11 SER C 1 1 9 6157 1 1 11 SER CA C 3.727 2.114 -9.083 1.00 . A A . 11 SER CA 1 1 9 6158 1 1 11 SER CB C 4.636 3.323 -9.334 1.00 . A A . 11 SER CB 1 1 9 6159 1 1 11 SER H H 3.263 3.199 -7.360 1.00 . A A . 11 SER H 1 1 9 6160 1 1 11 SER HA H 3.088 1.967 -9.955 1.00 . A A . 11 SER HA 1 1 9 6161 1 1 11 SER HB2 H 5.395 3.087 -10.082 1.00 . A A . 11 SER HB2 1 1 9 6162 1 1 11 SER HB3 H 4.034 4.158 -9.698 1.00 . A A . 11 SER HB3 1 1 9 6163 1 1 11 SER HG H 5.878 3.012 -7.873 1.00 . A A . 11 SER HG 1 1 9 6164 1 1 11 SER N N 2.914 2.435 -7.926 1.00 . A A . 11 SER N 1 1 9 6165 1 1 11 SER O O 5.769 0.853 -8.873 1.00 . A A . 11 SER O 1 1 9 6166 1 1 11 SER OG O 5.240 3.697 -8.106 1.00 . A A . 11 SER OG 1 1 9 6167 1 1 12 GLY C C 5.286 -1.832 -7.336 1.00 . A A . 12 GLY C 1 1 9 6168 1 1 12 GLY CA C 4.488 -1.605 -8.611 1.00 . A A . 12 GLY CA 1 1 9 6169 1 1 12 GLY H H 2.842 -0.235 -8.631 1.00 . A A . 12 GLY H 1 1 9 6170 1 1 12 GLY HA2 H 3.741 -2.370 -8.655 1.00 . A A . 12 GLY HA2 1 1 9 6171 1 1 12 GLY HA3 H 5.138 -1.728 -9.479 1.00 . A A . 12 GLY HA3 1 1 9 6172 1 1 12 GLY N N 3.856 -0.297 -8.661 1.00 . A A . 12 GLY N 1 1 9 6173 1 1 12 GLY O O 4.827 -2.487 -6.396 1.00 . A A . 12 GLY O 1 1 9 6174 1 1 13 ASN C C 7.669 -0.092 -5.613 1.00 . A A . 13 ASN C 1 1 9 6175 1 1 13 ASN CA C 7.516 -1.438 -6.320 1.00 . A A . 13 ASN CA 1 1 9 6176 1 1 13 ASN CB C 8.837 -1.920 -6.920 1.00 . A A . 13 ASN CB 1 1 9 6177 1 1 13 ASN CG C 9.760 -2.572 -5.890 1.00 . A A . 13 ASN CG 1 1 9 6178 1 1 13 ASN H H 6.661 -0.724 -8.160 1.00 . A A . 13 ASN H 1 1 9 6179 1 1 13 ASN HA H 7.185 -2.193 -5.611 1.00 . A A . 13 ASN HA 1 1 9 6180 1 1 13 ASN HB2 H 8.597 -2.688 -7.647 1.00 . A A . 13 ASN HB2 1 1 9 6181 1 1 13 ASN HB3 H 9.329 -1.096 -7.438 1.00 . A A . 13 ASN HB3 1 1 9 6182 1 1 13 ASN HD21 H 10.232 -0.795 -4.964 1.00 . A A . 13 ASN HD21 1 1 9 6183 1 1 13 ASN HD22 H 11.020 -2.212 -4.349 1.00 . A A . 13 ASN HD22 1 1 9 6184 1 1 13 ASN N N 6.512 -1.337 -7.369 1.00 . A A . 13 ASN N 1 1 9 6185 1 1 13 ASN ND2 N 10.373 -1.798 -5.000 1.00 . A A . 13 ASN ND2 1 1 9 6186 1 1 13 ASN O O 7.534 0.958 -6.235 1.00 . A A . 13 ASN O 1 1 9 6187 1 1 13 ASN OD1 O 9.921 -3.794 -5.899 1.00 . A A . 13 ASN OD1 1 1 9 6188 1 1 14 CYS C C 9.341 1.332 -2.896 1.00 . A A . 14 CYS C 1 1 9 6189 1 1 14 CYS CA C 7.938 1.030 -3.411 1.00 . A A . 14 CYS CA 1 1 9 6190 1 1 14 CYS CB C 6.980 0.771 -2.236 1.00 . A A . 14 CYS CB 1 1 9 6191 1 1 14 CYS H H 8.049 -1.040 -3.897 1.00 . A A . 14 CYS H 1 1 9 6192 1 1 14 CYS HA H 7.596 1.919 -3.936 1.00 . A A . 14 CYS HA 1 1 9 6193 1 1 14 CYS HB2 H 5.953 0.798 -2.600 1.00 . A A . 14 CYS HB2 1 1 9 6194 1 1 14 CYS HB3 H 7.166 -0.217 -1.822 1.00 . A A . 14 CYS HB3 1 1 9 6195 1 1 14 CYS N N 7.928 -0.122 -4.308 1.00 . A A . 14 CYS N 1 1 9 6196 1 1 14 CYS O O 10.193 0.448 -2.836 1.00 . A A . 14 CYS O 1 1 9 6197 1 1 14 CYS SG S 7.124 1.938 -0.858 1.00 . A A . 14 CYS SG 1 1 9 6198 1 1 15 GLY C C 9.942 3.958 -0.549 1.00 . A A . 15 GLY C 1 1 9 6199 1 1 15 GLY CA C 10.583 3.017 -1.571 1.00 . A A . 15 GLY CA 1 1 9 6200 1 1 15 GLY H H 8.795 3.242 -2.662 1.00 . A A . 15 GLY H 1 1 9 6201 1 1 15 GLY HA2 H 11.005 2.164 -1.048 1.00 . A A . 15 GLY HA2 1 1 9 6202 1 1 15 GLY HA3 H 11.375 3.539 -2.109 1.00 . A A . 15 GLY HA3 1 1 9 6203 1 1 15 GLY N N 9.550 2.594 -2.507 1.00 . A A . 15 GLY N 1 1 9 6204 1 1 15 GLY O O 9.967 3.724 0.658 1.00 . A A . 15 GLY O 1 1 9 6205 1 1 16 ASN C C 7.411 5.627 0.450 1.00 . A A . 16 ASN C 1 1 9 6206 1 1 16 ASN CA C 8.708 6.065 -0.240 1.00 . A A . 16 ASN CA 1 1 9 6207 1 1 16 ASN CB C 8.513 7.328 -1.087 1.00 . A A . 16 ASN CB 1 1 9 6208 1 1 16 ASN CG C 8.209 8.542 -0.217 1.00 . A A . 16 ASN CG 1 1 9 6209 1 1 16 ASN H H 9.337 5.141 -2.055 1.00 . A A . 16 ASN H 1 1 9 6210 1 1 16 ASN HA H 9.433 6.317 0.539 1.00 . A A . 16 ASN HA 1 1 9 6211 1 1 16 ASN HB2 H 9.440 7.537 -1.625 1.00 . A A . 16 ASN HB2 1 1 9 6212 1 1 16 ASN HB3 H 7.710 7.191 -1.811 1.00 . A A . 16 ASN HB3 1 1 9 6213 1 1 16 ASN HD21 H 8.622 9.832 -1.740 1.00 . A A . 16 ASN HD21 1 1 9 6214 1 1 16 ASN HD22 H 8.142 10.554 -0.220 1.00 . A A . 16 ASN HD22 1 1 9 6215 1 1 16 ASN N N 9.302 5.012 -1.057 1.00 . A A . 16 ASN N 1 1 9 6216 1 1 16 ASN ND2 N 8.310 9.739 -0.786 1.00 . A A . 16 ASN ND2 1 1 9 6217 1 1 16 ASN O O 6.310 6.028 0.062 1.00 . A A . 16 ASN O 1 1 9 6218 1 1 16 ASN OD1 O 7.866 8.410 0.952 1.00 . A A . 16 ASN OD1 1 1 9 6219 1 1 17 THR C C 5.646 5.692 2.899 1.00 . A A . 17 THR C 1 1 9 6220 1 1 17 THR CA C 6.411 4.469 2.365 1.00 . A A . 17 THR CA 1 1 9 6221 1 1 17 THR CB C 6.852 3.498 3.472 1.00 . A A . 17 THR CB 1 1 9 6222 1 1 17 THR CG2 C 7.652 4.170 4.593 1.00 . A A . 17 THR CG2 1 1 9 6223 1 1 17 THR H H 8.467 4.474 1.721 1.00 . A A . 17 THR H 1 1 9 6224 1 1 17 THR HA H 5.745 3.914 1.719 1.00 . A A . 17 THR HA 1 1 9 6225 1 1 17 THR HB H 7.496 2.747 3.017 1.00 . A A . 17 THR HB 1 1 9 6226 1 1 17 THR HG1 H 5.166 3.485 4.452 1.00 . A A . 17 THR HG1 1 1 9 6227 1 1 17 THR HG21 H 8.518 4.684 4.178 1.00 . A A . 17 THR HG21 1 1 9 6228 1 1 17 THR HG22 H 7.037 4.882 5.142 1.00 . A A . 17 THR HG22 1 1 9 6229 1 1 17 THR HG23 H 8.002 3.404 5.289 1.00 . A A . 17 THR HG23 1 1 9 6230 1 1 17 THR N N 7.544 4.854 1.530 1.00 . A A . 17 THR N 1 1 9 6231 1 1 17 THR O O 4.424 5.651 3.068 1.00 . A A . 17 THR O 1 1 9 6232 1 1 17 THR OG1 O 5.724 2.833 4.015 1.00 . A A . 17 THR OG1 1 1 9 6233 1 1 18 ALA C C 4.848 8.645 2.507 1.00 . A A . 18 ALA C 1 1 9 6234 1 1 18 ALA CA C 5.744 8.039 3.591 1.00 . A A . 18 ALA CA 1 1 9 6235 1 1 18 ALA CB C 6.815 9.024 4.069 1.00 . A A . 18 ALA CB 1 1 9 6236 1 1 18 ALA H H 7.349 6.802 2.951 1.00 . A A . 18 ALA H 1 1 9 6237 1 1 18 ALA HA H 5.102 7.813 4.445 1.00 . A A . 18 ALA HA 1 1 9 6238 1 1 18 ALA HB1 H 7.418 8.561 4.852 1.00 . A A . 18 ALA HB1 1 1 9 6239 1 1 18 ALA HB2 H 7.465 9.322 3.247 1.00 . A A . 18 ALA HB2 1 1 9 6240 1 1 18 ALA HB3 H 6.335 9.914 4.477 1.00 . A A . 18 ALA HB3 1 1 9 6241 1 1 18 ALA N N 6.357 6.797 3.144 1.00 . A A . 18 ALA N 1 1 9 6242 1 1 18 ALA O O 3.955 9.426 2.838 1.00 . A A . 18 ALA O 1 1 9 6243 1 1 19 HIS C C 2.983 7.440 0.284 1.00 . A A . 19 HIS C 1 1 9 6244 1 1 19 HIS CA C 4.047 8.530 0.204 1.00 . A A . 19 HIS CA 1 1 9 6245 1 1 19 HIS CB C 4.648 8.599 -1.204 1.00 . A A . 19 HIS CB 1 1 9 6246 1 1 19 HIS CD2 C 2.378 9.469 -2.179 1.00 . A A . 19 HIS CD2 1 1 9 6247 1 1 19 HIS CE1 C 2.726 8.938 -4.273 1.00 . A A . 19 HIS CE1 1 1 9 6248 1 1 19 HIS CG C 3.635 8.919 -2.284 1.00 . A A . 19 HIS CG 1 1 9 6249 1 1 19 HIS H H 5.840 7.695 1.006 1.00 . A A . 19 HIS H 1 1 9 6250 1 1 19 HIS HA H 3.577 9.496 0.398 1.00 . A A . 19 HIS HA 1 1 9 6251 1 1 19 HIS HB2 H 5.423 9.355 -1.239 1.00 . A A . 19 HIS HB2 1 1 9 6252 1 1 19 HIS HB3 H 5.110 7.643 -1.427 1.00 . A A . 19 HIS HB3 1 1 9 6253 1 1 19 HIS HD1 H 4.706 8.259 -4.035 1.00 . A A . 19 HIS HD1 1 1 9 6254 1 1 19 HIS HD2 H 1.888 9.766 -1.257 1.00 . A A . 19 HIS HD2 1 1 9 6255 1 1 19 HIS HE1 H 2.565 8.780 -5.331 1.00 . A A . 19 HIS HE1 1 1 9 6256 1 1 19 HIS N N 5.049 8.292 1.231 1.00 . A A . 19 HIS N 1 1 9 6257 1 1 19 HIS ND1 N 3.867 8.651 -3.626 1.00 . A A . 19 HIS ND1 1 1 9 6258 1 1 19 HIS NE2 N 1.796 9.423 -3.435 1.00 . A A . 19 HIS NE2 1 1 9 6259 1 1 19 HIS O O 1.808 7.777 0.341 1.00 . A A . 19 HIS O 1 1 9 6260 1 1 20 CYS C C 1.245 5.202 1.140 1.00 . A A . 20 CYS C 1 1 9 6261 1 1 20 CYS CA C 2.450 5.018 0.230 1.00 . A A . 20 CYS CA 1 1 9 6262 1 1 20 CYS CB C 3.153 3.731 0.643 1.00 . A A . 20 CYS CB 1 1 9 6263 1 1 20 CYS H H 4.376 5.971 0.220 1.00 . A A . 20 CYS H 1 1 9 6264 1 1 20 CYS HA H 2.080 4.892 -0.785 1.00 . A A . 20 CYS HA 1 1 9 6265 1 1 20 CYS HB2 H 3.875 3.469 -0.126 1.00 . A A . 20 CYS HB2 1 1 9 6266 1 1 20 CYS HB3 H 3.648 3.886 1.591 1.00 . A A . 20 CYS HB3 1 1 9 6267 1 1 20 CYS N N 3.378 6.160 0.262 1.00 . A A . 20 CYS N 1 1 9 6268 1 1 20 CYS O O 0.103 5.026 0.713 1.00 . A A . 20 CYS O 1 1 9 6269 1 1 20 CYS SG S 2.038 2.344 0.962 1.00 . A A . 20 CYS SG 1 1 9 6270 1 1 21 ASP C C -0.559 6.806 2.858 1.00 . A A . 21 ASP C 1 1 9 6271 1 1 21 ASP CA C 0.421 5.740 3.338 1.00 . A A . 21 ASP CA 1 1 9 6272 1 1 21 ASP CB C 0.948 6.144 4.717 1.00 . A A . 21 ASP CB 1 1 9 6273 1 1 21 ASP CG C -0.249 6.361 5.633 1.00 . A A . 21 ASP CG 1 1 9 6274 1 1 21 ASP H H 2.475 5.716 2.682 1.00 . A A . 21 ASP H 1 1 9 6275 1 1 21 ASP HA H -0.104 4.785 3.415 1.00 . A A . 21 ASP HA 1 1 9 6276 1 1 21 ASP HB2 H 1.590 5.362 5.122 1.00 . A A . 21 ASP HB2 1 1 9 6277 1 1 21 ASP HB3 H 1.522 7.067 4.649 1.00 . A A . 21 ASP HB3 1 1 9 6278 1 1 21 ASP N N 1.505 5.608 2.385 1.00 . A A . 21 ASP N 1 1 9 6279 1 1 21 ASP O O -1.764 6.593 2.941 1.00 . A A . 21 ASP O 1 1 9 6280 1 1 21 ASP OD1 O -0.788 5.379 6.143 1.00 . A A . 21 ASP OD1 1 1 9 6281 1 1 21 ASP OD2 O -0.679 7.649 5.753 1.00 . A A . 21 ASP OD2 1 1 9 6282 1 1 22 LYS C C -1.654 8.390 0.609 1.00 . A A . 22 LYS C 1 1 9 6283 1 1 22 LYS CA C -0.902 8.970 1.802 1.00 . A A . 22 LYS CA 1 1 9 6284 1 1 22 LYS CB C -0.128 10.214 1.348 1.00 . A A . 22 LYS CB 1 1 9 6285 1 1 22 LYS CD C 1.561 11.984 1.915 1.00 . A A . 22 LYS CD 1 1 9 6286 1 1 22 LYS CE C 2.349 12.713 3.014 1.00 . A A . 22 LYS CE 1 1 9 6287 1 1 22 LYS CG C 0.831 10.727 2.413 1.00 . A A . 22 LYS CG 1 1 9 6288 1 1 22 LYS H H 0.944 7.961 2.152 1.00 . A A . 22 LYS H 1 1 9 6289 1 1 22 LYS HA H -1.583 9.293 2.585 1.00 . A A . 22 LYS HA 1 1 9 6290 1 1 22 LYS HB2 H 0.430 10.001 0.440 1.00 . A A . 22 LYS HB2 1 1 9 6291 1 1 22 LYS HB3 H -0.851 11.002 1.133 1.00 . A A . 22 LYS HB3 1 1 9 6292 1 1 22 LYS HD2 H 2.237 11.701 1.106 1.00 . A A . 22 LYS HD2 1 1 9 6293 1 1 22 LYS HD3 H 0.830 12.688 1.505 1.00 . A A . 22 LYS HD3 1 1 9 6294 1 1 22 LYS HE2 H 3.002 13.452 2.544 1.00 . A A . 22 LYS HE2 1 1 9 6295 1 1 22 LYS HE3 H 1.651 13.240 3.669 1.00 . A A . 22 LYS HE3 1 1 9 6296 1 1 22 LYS HG2 H 0.266 10.926 3.326 1.00 . A A . 22 LYS HG2 1 1 9 6297 1 1 22 LYS HG3 H 1.531 9.915 2.562 1.00 . A A . 22 LYS HG3 1 1 9 6298 1 1 22 LYS HZ1 H 2.885 10.816 3.626 1.00 . A A . 22 LYS HZ1 1 1 9 6299 1 1 22 LYS HZ2 H 4.156 11.917 3.614 1.00 . A A . 22 LYS HZ2 1 1 9 6300 1 1 22 LYS N N -0.047 7.933 2.356 1.00 . A A . 22 LYS N 1 1 9 6301 1 1 22 LYS NZ N 3.158 11.787 3.833 1.00 . A A . 22 LYS NZ 1 1 9 6302 1 1 22 LYS O O -2.861 8.543 0.498 1.00 . A A . 22 LYS O 1 1 9 6303 1 1 23 GLN C C -2.599 6.532 -1.530 1.00 . A A . 23 GLN C 1 1 9 6304 1 1 23 GLN CA C -1.345 7.413 -1.641 1.00 . A A . 23 GLN CA 1 1 9 6305 1 1 23 GLN CB C -0.175 6.697 -2.339 1.00 . A A . 23 GLN CB 1 1 9 6306 1 1 23 GLN CD C -0.553 7.127 -4.792 1.00 . A A . 23 GLN CD 1 1 9 6307 1 1 23 GLN CG C -0.484 6.062 -3.699 1.00 . A A . 23 GLN CG 1 1 9 6308 1 1 23 GLN H H 0.061 7.610 -0.063 1.00 . A A . 23 GLN H 1 1 9 6309 1 1 23 GLN HA H -1.596 8.328 -2.179 1.00 . A A . 23 GLN HA 1 1 9 6310 1 1 23 GLN HB2 H 0.689 7.349 -2.408 1.00 . A A . 23 GLN HB2 1 1 9 6311 1 1 23 GLN HB3 H 0.113 5.863 -1.698 1.00 . A A . 23 GLN HB3 1 1 9 6312 1 1 23 GLN HE21 H -0.757 5.721 -6.277 1.00 . A A . 23 GLN HE21 1 1 9 6313 1 1 23 GLN HE22 H -0.720 7.390 -6.787 1.00 . A A . 23 GLN HE22 1 1 9 6314 1 1 23 GLN HG2 H 0.345 5.407 -3.963 1.00 . A A . 23 GLN HG2 1 1 9 6315 1 1 23 GLN HG3 H -1.393 5.468 -3.672 1.00 . A A . 23 GLN HG3 1 1 9 6316 1 1 23 GLN N N -0.918 7.737 -0.291 1.00 . A A . 23 GLN N 1 1 9 6317 1 1 23 GLN NE2 N -0.680 6.710 -6.044 1.00 . A A . 23 GLN NE2 1 1 9 6318 1 1 23 GLN O O -3.610 6.798 -2.185 1.00 . A A . 23 GLN O 1 1 9 6319 1 1 23 GLN OE1 O -0.429 8.324 -4.524 1.00 . A A . 23 GLN OE1 1 1 9 6320 1 1 24 CYS C C -4.911 5.378 0.099 1.00 . A A . 24 CYS C 1 1 9 6321 1 1 24 CYS CA C -3.655 4.621 -0.352 1.00 . A A . 24 CYS CA 1 1 9 6322 1 1 24 CYS CB C -3.262 3.630 0.756 1.00 . A A . 24 CYS CB 1 1 9 6323 1 1 24 CYS H H -1.663 5.371 -0.158 1.00 . A A . 24 CYS H 1 1 9 6324 1 1 24 CYS HA H -3.910 4.062 -1.254 1.00 . A A . 24 CYS HA 1 1 9 6325 1 1 24 CYS HB2 H -2.847 4.190 1.592 1.00 . A A . 24 CYS HB2 1 1 9 6326 1 1 24 CYS HB3 H -4.161 3.124 1.107 1.00 . A A . 24 CYS HB3 1 1 9 6327 1 1 24 CYS N N -2.539 5.517 -0.656 1.00 . A A . 24 CYS N 1 1 9 6328 1 1 24 CYS O O -6.017 4.905 -0.144 1.00 . A A . 24 CYS O 1 1 9 6329 1 1 24 CYS SG S -2.086 2.321 0.327 1.00 . A A . 24 CYS SG 1 1 9 6330 1 1 25 GLN C C -6.317 8.350 0.273 1.00 . A A . 25 GLN C 1 1 9 6331 1 1 25 GLN CA C -5.846 7.321 1.321 1.00 . A A . 25 GLN CA 1 1 9 6332 1 1 25 GLN CB C -5.377 8.012 2.617 1.00 . A A . 25 GLN CB 1 1 9 6333 1 1 25 GLN CD C -4.279 7.624 4.892 1.00 . A A . 25 GLN CD 1 1 9 6334 1 1 25 GLN CG C -4.935 6.982 3.667 1.00 . A A . 25 GLN CG 1 1 9 6335 1 1 25 GLN H H -3.812 6.875 0.920 1.00 . A A . 25 GLN H 1 1 9 6336 1 1 25 GLN HA H -6.669 6.659 1.603 1.00 . A A . 25 GLN HA 1 1 9 6337 1 1 25 GLN HB2 H -4.543 8.679 2.410 1.00 . A A . 25 GLN HB2 1 1 9 6338 1 1 25 GLN HB3 H -6.198 8.602 3.025 1.00 . A A . 25 GLN HB3 1 1 9 6339 1 1 25 GLN HE21 H -5.668 6.816 6.141 1.00 . A A . 25 GLN HE21 1 1 9 6340 1 1 25 GLN HE22 H -4.474 7.864 6.893 1.00 . A A . 25 GLN HE22 1 1 9 6341 1 1 25 GLN HG2 H -5.809 6.404 3.968 1.00 . A A . 25 GLN HG2 1 1 9 6342 1 1 25 GLN HG3 H -4.210 6.299 3.235 1.00 . A A . 25 GLN HG3 1 1 9 6343 1 1 25 GLN N N -4.749 6.517 0.782 1.00 . A A . 25 GLN N 1 1 9 6344 1 1 25 GLN NE2 N -4.859 7.430 6.068 1.00 . A A . 25 GLN NE2 1 1 9 6345 1 1 25 GLN O O -7.503 8.670 0.157 1.00 . A A . 25 GLN O 1 1 9 6346 1 1 25 GLN OE1 O -3.227 8.254 4.810 1.00 . A A . 25 GLN OE1 1 1 9 6347 1 1 26 ASP C C -6.322 9.399 -2.659 1.00 . A A . 26 ASP C 1 1 9 6348 1 1 26 ASP CA C -5.549 9.944 -1.473 1.00 . A A . 26 ASP CA 1 1 9 6349 1 1 26 ASP CB C -4.205 10.502 -1.963 1.00 . A A . 26 ASP CB 1 1 9 6350 1 1 26 ASP CG C -3.378 11.214 -0.900 1.00 . A A . 26 ASP CG 1 1 9 6351 1 1 26 ASP H H -4.422 8.545 -0.346 1.00 . A A . 26 ASP H 1 1 9 6352 1 1 26 ASP HA H -6.113 10.761 -1.032 1.00 . A A . 26 ASP HA 1 1 9 6353 1 1 26 ASP HB2 H -3.606 9.695 -2.371 1.00 . A A . 26 ASP HB2 1 1 9 6354 1 1 26 ASP HB3 H -4.401 11.211 -2.766 1.00 . A A . 26 ASP HB3 1 1 9 6355 1 1 26 ASP N N -5.360 8.889 -0.490 1.00 . A A . 26 ASP N 1 1 9 6356 1 1 26 ASP O O -7.376 9.925 -3.012 1.00 . A A . 26 ASP O 1 1 9 6357 1 1 26 ASP OD1 O -4.063 11.852 0.087 1.00 . A A . 26 ASP OD1 1 1 9 6358 1 1 26 ASP OD2 O -2.154 11.187 -0.987 1.00 . A A . 26 ASP OD2 1 1 9 6359 1 1 27 TRP C C -7.498 6.822 -3.991 1.00 . A A . 27 TRP C 1 1 9 6360 1 1 27 TRP CA C -6.371 7.737 -4.455 1.00 . A A . 27 TRP CA 1 1 9 6361 1 1 27 TRP CB C -5.297 6.943 -5.209 1.00 . A A . 27 TRP CB 1 1 9 6362 1 1 27 TRP CD1 C -3.574 8.778 -5.491 1.00 . A A . 27 TRP CD1 1 1 9 6363 1 1 27 TRP CD2 C -3.812 7.533 -7.327 1.00 . A A . 27 TRP CD2 1 1 9 6364 1 1 27 TRP CE2 C -2.791 8.489 -7.604 1.00 . A A . 27 TRP CE2 1 1 9 6365 1 1 27 TRP CE3 C -4.117 6.603 -8.339 1.00 . A A . 27 TRP CE3 1 1 9 6366 1 1 27 TRP CG C -4.281 7.734 -5.967 1.00 . A A . 27 TRP CG 1 1 9 6367 1 1 27 TRP CH2 C -2.385 7.524 -9.786 1.00 . A A . 27 TRP CH2 1 1 9 6368 1 1 27 TRP CZ2 C -2.096 8.506 -8.822 1.00 . A A . 27 TRP CZ2 1 1 9 6369 1 1 27 TRP CZ3 C -3.385 6.568 -9.537 1.00 . A A . 27 TRP CZ3 1 1 9 6370 1 1 27 TRP H H -4.941 7.935 -2.886 1.00 . A A . 27 TRP H 1 1 9 6371 1 1 27 TRP HA H -6.781 8.501 -5.122 1.00 . A A . 27 TRP HA 1 1 9 6372 1 1 27 TRP HB2 H -4.752 6.287 -4.533 1.00 . A A . 27 TRP HB2 1 1 9 6373 1 1 27 TRP HB3 H -5.815 6.313 -5.929 1.00 . A A . 27 TRP HB3 1 1 9 6374 1 1 27 TRP HD1 H -3.646 9.169 -4.495 1.00 . A A . 27 TRP HD1 1 1 9 6375 1 1 27 TRP HE1 H -2.053 10.000 -6.301 1.00 . A A . 27 TRP HE1 1 1 9 6376 1 1 27 TRP HE3 H -4.902 5.884 -8.168 1.00 . A A . 27 TRP HE3 1 1 9 6377 1 1 27 TRP HH2 H -1.834 7.489 -10.712 1.00 . A A . 27 TRP HH2 1 1 9 6378 1 1 27 TRP HZ2 H -1.329 9.243 -9.007 1.00 . A A . 27 TRP HZ2 1 1 9 6379 1 1 27 TRP HZ3 H -3.582 5.782 -10.249 1.00 . A A . 27 TRP HZ3 1 1 9 6380 1 1 27 TRP N N -5.787 8.342 -3.273 1.00 . A A . 27 TRP N 1 1 9 6381 1 1 27 TRP NE1 N -2.702 9.241 -6.448 1.00 . A A . 27 TRP NE1 1 1 9 6382 1 1 27 TRP O O -8.679 7.157 -4.098 1.00 . A A . 27 TRP O 1 1 9 6383 1 1 28 GLU C C -8.579 5.306 -1.511 1.00 . A A . 28 GLU C 1 1 9 6384 1 1 28 GLU CA C -8.015 4.721 -2.812 1.00 . A A . 28 GLU CA 1 1 9 6385 1 1 28 GLU CB C -7.226 3.405 -2.610 1.00 . A A . 28 GLU CB 1 1 9 6386 1 1 28 GLU CD C -9.077 1.738 -3.145 1.00 . A A . 28 GLU CD 1 1 9 6387 1 1 28 GLU CG C -7.713 2.293 -3.549 1.00 . A A . 28 GLU CG 1 1 9 6388 1 1 28 GLU H H -6.126 5.598 -3.192 1.00 . A A . 28 GLU H 1 1 9 6389 1 1 28 GLU HA H -8.853 4.561 -3.492 1.00 . A A . 28 GLU HA 1 1 9 6390 1 1 28 GLU HB2 H -6.169 3.566 -2.824 1.00 . A A . 28 GLU HB2 1 1 9 6391 1 1 28 GLU HB3 H -7.274 3.050 -1.580 1.00 . A A . 28 GLU HB3 1 1 9 6392 1 1 28 GLU HG2 H -7.756 2.675 -4.570 1.00 . A A . 28 GLU HG2 1 1 9 6393 1 1 28 GLU HG3 H -6.993 1.474 -3.512 1.00 . A A . 28 GLU HG3 1 1 9 6394 1 1 28 GLU N N -7.110 5.701 -3.386 1.00 . A A . 28 GLU N 1 1 9 6395 1 1 28 GLU O O -8.428 6.495 -1.255 1.00 . A A . 28 GLU O 1 1 9 6396 1 1 28 GLU OE1 O -9.601 2.122 -2.102 1.00 . A A . 28 GLU OE1 1 1 9 6397 1 1 28 GLU OE2 O -9.614 0.807 -3.982 1.00 . A A . 28 GLU OE2 1 1 9 6398 1 1 29 LYS C C -9.868 3.547 1.408 1.00 . A A . 29 LYS C 1 1 9 6399 1 1 29 LYS CA C -9.770 4.838 0.605 1.00 . A A . 29 LYS CA 1 1 9 6400 1 1 29 LYS CB C -11.135 5.545 0.459 1.00 . A A . 29 LYS CB 1 1 9 6401 1 1 29 LYS CD C -11.403 7.384 -1.295 1.00 . A A . 29 LYS CD 1 1 9 6402 1 1 29 LYS CE C -10.887 8.774 -1.699 1.00 . A A . 29 LYS CE 1 1 9 6403 1 1 29 LYS CG C -11.032 7.049 0.158 1.00 . A A . 29 LYS CG 1 1 9 6404 1 1 29 LYS H H -9.261 3.508 -0.904 1.00 . A A . 29 LYS H 1 1 9 6405 1 1 29 LYS HA H -9.053 5.464 1.112 1.00 . A A . 29 LYS HA 1 1 9 6406 1 1 29 LYS HB2 H -11.755 5.032 -0.276 1.00 . A A . 29 LYS HB2 1 1 9 6407 1 1 29 LYS HB3 H -11.638 5.470 1.423 1.00 . A A . 29 LYS HB3 1 1 9 6408 1 1 29 LYS HD2 H -10.999 6.632 -1.975 1.00 . A A . 29 LYS HD2 1 1 9 6409 1 1 29 LYS HD3 H -12.491 7.363 -1.385 1.00 . A A . 29 LYS HD3 1 1 9 6410 1 1 29 LYS HE2 H -11.353 9.060 -2.642 1.00 . A A . 29 LYS HE2 1 1 9 6411 1 1 29 LYS HE3 H -11.156 9.510 -0.939 1.00 . A A . 29 LYS HE3 1 1 9 6412 1 1 29 LYS HG2 H -11.734 7.577 0.807 1.00 . A A . 29 LYS HG2 1 1 9 6413 1 1 29 LYS HG3 H -10.034 7.400 0.419 1.00 . A A . 29 LYS HG3 1 1 9 6414 1 1 29 LYS HZ1 H -9.127 7.824 -2.202 1.00 . A A . 29 LYS HZ1 1 1 9 6415 1 1 29 LYS HZ2 H -9.169 9.455 -2.612 1.00 . A A . 29 LYS HZ2 1 1 9 6416 1 1 29 LYS N N -9.173 4.478 -0.660 1.00 . A A . 29 LYS N 1 1 9 6417 1 1 29 LYS NZ N -9.426 8.761 -1.895 1.00 . A A . 29 LYS NZ 1 1 9 6418 1 1 29 LYS O O -10.898 3.163 1.957 1.00 . A A . 29 LYS O 1 1 9 6419 1 1 30 ALA C C -8.136 3.030 3.840 1.00 . A A . 30 ALA C 1 1 9 6420 1 1 30 ALA CA C -8.335 2.102 2.638 1.00 . A A . 30 ALA CA 1 1 9 6421 1 1 30 ALA CB C -7.035 1.388 2.270 1.00 . A A . 30 ALA CB 1 1 9 6422 1 1 30 ALA H H -7.925 3.359 1.020 1.00 . A A . 30 ALA H 1 1 9 6423 1 1 30 ALA HA H -9.140 1.396 2.840 1.00 . A A . 30 ALA HA 1 1 9 6424 1 1 30 ALA HB1 H -6.280 2.128 2.002 1.00 . A A . 30 ALA HB1 1 1 9 6425 1 1 30 ALA HB2 H -6.660 0.806 3.102 1.00 . A A . 30 ALA HB2 1 1 9 6426 1 1 30 ALA HB3 H -7.211 0.726 1.422 1.00 . A A . 30 ALA HB3 1 1 9 6427 1 1 30 ALA N N -8.696 2.923 1.508 1.00 . A A . 30 ALA N 1 1 9 6428 1 1 30 ALA O O -7.956 4.235 3.657 1.00 . A A . 30 ALA O 1 1 9 6429 1 1 31 SER C C -6.522 4.009 6.125 1.00 . A A . 31 SER C 1 1 9 6430 1 1 31 SER CA C -7.870 3.293 6.244 1.00 . A A . 31 SER CA 1 1 9 6431 1 1 31 SER CB C -7.880 2.369 7.455 1.00 . A A . 31 SER CB 1 1 9 6432 1 1 31 SER H H -8.205 1.501 5.232 1.00 . A A . 31 SER H 1 1 9 6433 1 1 31 SER HA H -8.660 4.029 6.373 1.00 . A A . 31 SER HA 1 1 9 6434 1 1 31 SER HB2 H -7.088 1.637 7.333 1.00 . A A . 31 SER HB2 1 1 9 6435 1 1 31 SER HB3 H -7.658 2.970 8.321 1.00 . A A . 31 SER HB3 1 1 9 6436 1 1 31 SER HG H -9.470 1.466 6.775 1.00 . A A . 31 SER HG 1 1 9 6437 1 1 31 SER N N -8.131 2.499 5.066 1.00 . A A . 31 SER N 1 1 9 6438 1 1 31 SER O O -6.416 5.184 6.471 1.00 . A A . 31 SER O 1 1 9 6439 1 1 31 SER OG O -9.130 1.729 7.642 1.00 . A A . 31 SER OG 1 1 9 6440 1 1 32 HIS C C -3.288 2.955 4.633 1.00 . A A . 32 HIS C 1 1 9 6441 1 1 32 HIS CA C -4.143 3.859 5.528 1.00 . A A . 32 HIS CA 1 1 9 6442 1 1 32 HIS CB C -3.527 4.066 6.926 1.00 . A A . 32 HIS CB 1 1 9 6443 1 1 32 HIS CD2 C -3.043 1.729 7.848 1.00 . A A . 32 HIS CD2 1 1 9 6444 1 1 32 HIS CE1 C -0.883 1.743 7.824 1.00 . A A . 32 HIS CE1 1 1 9 6445 1 1 32 HIS CG C -2.644 2.947 7.402 1.00 . A A . 32 HIS CG 1 1 9 6446 1 1 32 HIS H H -5.626 2.357 5.322 1.00 . A A . 32 HIS H 1 1 9 6447 1 1 32 HIS HA H -4.244 4.818 5.019 1.00 . A A . 32 HIS HA 1 1 9 6448 1 1 32 HIS HB2 H -2.948 4.965 6.942 1.00 . A A . 32 HIS HB2 1 1 9 6449 1 1 32 HIS HB3 H -4.310 4.217 7.669 1.00 . A A . 32 HIS HB3 1 1 9 6450 1 1 32 HIS HD1 H -0.659 3.693 7.008 1.00 . A A . 32 HIS HD1 1 1 9 6451 1 1 32 HIS HD2 H -4.061 1.437 7.808 1.00 . A A . 32 HIS HD2 1 1 9 6452 1 1 32 HIS HE1 H 0.126 1.382 7.877 1.00 . A A . 32 HIS HE1 1 1 9 6453 1 1 32 HIS N N -5.482 3.299 5.667 1.00 . A A . 32 HIS N 1 1 9 6454 1 1 32 HIS ND1 N -1.259 2.965 7.404 1.00 . A A . 32 HIS ND1 1 1 9 6455 1 1 32 HIS NE2 N -1.932 0.977 8.150 1.00 . A A . 32 HIS NE2 1 1 9 6456 1 1 32 HIS O O -3.794 1.944 4.140 1.00 . A A . 32 HIS O 1 1 9 6457 1 1 33 GLY C C 0.308 2.317 4.462 1.00 . A A . 33 GLY C 1 1 9 6458 1 1 33 GLY CA C -1.033 2.462 3.746 1.00 . A A . 33 GLY CA 1 1 9 6459 1 1 33 GLY H H -1.635 4.109 4.939 1.00 . A A . 33 GLY H 1 1 9 6460 1 1 33 GLY HA2 H -1.428 1.476 3.626 1.00 . A A . 33 GLY HA2 1 1 9 6461 1 1 33 GLY HA3 H -0.863 2.863 2.753 1.00 . A A . 33 GLY HA3 1 1 9 6462 1 1 33 GLY N N -1.997 3.283 4.472 1.00 . A A . 33 GLY N 1 1 9 6463 1 1 33 GLY O O 0.577 3.053 5.411 1.00 . A A . 33 GLY O 1 1 9 6464 1 1 34 ALA C C 3.199 0.122 3.625 1.00 . A A . 34 ALA C 1 1 9 6465 1 1 34 ALA CA C 2.490 1.142 4.525 1.00 . A A . 34 ALA CA 1 1 9 6466 1 1 34 ALA CB C 2.431 0.655 5.979 1.00 . A A . 34 ALA CB 1 1 9 6467 1 1 34 ALA H H 0.810 0.742 3.288 1.00 . A A . 34 ALA H 1 1 9 6468 1 1 34 ALA HA H 3.036 2.086 4.491 1.00 . A A . 34 ALA HA 1 1 9 6469 1 1 34 ALA HB1 H 1.761 -0.200 6.064 1.00 . A A . 34 ALA HB1 1 1 9 6470 1 1 34 ALA HB2 H 3.425 0.366 6.315 1.00 . A A . 34 ALA HB2 1 1 9 6471 1 1 34 ALA HB3 H 2.069 1.451 6.627 1.00 . A A . 34 ALA HB3 1 1 9 6472 1 1 34 ALA N N 1.137 1.363 4.026 1.00 . A A . 34 ALA N 1 1 9 6473 1 1 34 ALA O O 2.588 -0.878 3.240 1.00 . A A . 34 ALA O 1 1 9 6474 1 1 35 CYS C C 5.781 -1.716 3.075 1.00 . A A . 35 CYS C 1 1 9 6475 1 1 35 CYS CA C 5.174 -0.519 2.344 1.00 . A A . 35 CYS CA 1 1 9 6476 1 1 35 CYS CB C 6.251 0.252 1.595 1.00 . A A . 35 CYS CB 1 1 9 6477 1 1 35 CYS H H 4.972 1.185 3.551 1.00 . A A . 35 CYS H 1 1 9 6478 1 1 35 CYS HA H 4.461 -0.848 1.601 1.00 . A A . 35 CYS HA 1 1 9 6479 1 1 35 CYS HB2 H 6.923 0.743 2.294 1.00 . A A . 35 CYS HB2 1 1 9 6480 1 1 35 CYS HB3 H 6.827 -0.465 1.032 1.00 . A A . 35 CYS HB3 1 1 9 6481 1 1 35 CYS N N 4.464 0.356 3.257 1.00 . A A . 35 CYS N 1 1 9 6482 1 1 35 CYS O O 6.181 -1.593 4.235 1.00 . A A . 35 CYS O 1 1 9 6483 1 1 35 CYS SG S 5.574 1.434 0.415 1.00 . A A . 35 CYS SG 1 1 9 6484 1 1 36 HIS C C 7.239 -4.812 1.813 1.00 . A A . 36 HIS C 1 1 9 6485 1 1 36 HIS CA C 6.555 -4.055 2.940 1.00 . A A . 36 HIS CA 1 1 9 6486 1 1 36 HIS CB C 5.615 -5.046 3.615 1.00 . A A . 36 HIS CB 1 1 9 6487 1 1 36 HIS CD2 C 3.184 -4.763 4.337 1.00 . A A . 36 HIS CD2 1 1 9 6488 1 1 36 HIS CE1 C 3.448 -3.234 5.872 1.00 . A A . 36 HIS CE1 1 1 9 6489 1 1 36 HIS CG C 4.502 -4.444 4.409 1.00 . A A . 36 HIS CG 1 1 9 6490 1 1 36 HIS H H 5.501 -2.927 1.465 1.00 . A A . 36 HIS H 1 1 9 6491 1 1 36 HIS HA H 7.282 -3.750 3.688 1.00 . A A . 36 HIS HA 1 1 9 6492 1 1 36 HIS HB2 H 5.162 -5.677 2.849 1.00 . A A . 36 HIS HB2 1 1 9 6493 1 1 36 HIS HB3 H 6.199 -5.700 4.266 1.00 . A A . 36 HIS HB3 1 1 9 6494 1 1 36 HIS HD1 H 5.498 -2.871 5.479 1.00 . A A . 36 HIS HD1 1 1 9 6495 1 1 36 HIS HD2 H 2.790 -5.479 3.626 1.00 . A A . 36 HIS HD2 1 1 9 6496 1 1 36 HIS HE1 H 3.240 -2.501 6.639 1.00 . A A . 36 HIS HE1 1 1 9 6497 1 1 36 HIS N N 5.858 -2.880 2.416 1.00 . A A . 36 HIS N 1 1 9 6498 1 1 36 HIS ND1 N 4.660 -3.435 5.340 1.00 . A A . 36 HIS ND1 1 1 9 6499 1 1 36 HIS NE2 N 2.535 -4.055 5.328 1.00 . A A . 36 HIS NE2 1 1 9 6500 1 1 36 HIS O O 6.665 -4.931 0.731 1.00 . A A . 36 HIS O 1 1 9 6501 1 1 37 LYS C C 8.556 -7.657 1.213 1.00 . A A . 37 LYS C 1 1 9 6502 1 1 37 LYS CA C 9.117 -6.239 1.158 1.00 . A A . 37 LYS CA 1 1 9 6503 1 1 37 LYS CB C 10.617 -6.192 1.439 1.00 . A A . 37 LYS CB 1 1 9 6504 1 1 37 LYS CD C 12.888 -7.197 0.742 1.00 . A A . 37 LYS CD 1 1 9 6505 1 1 37 LYS CE C 13.911 -6.157 0.260 1.00 . A A . 37 LYS CE 1 1 9 6506 1 1 37 LYS CG C 11.446 -6.850 0.330 1.00 . A A . 37 LYS CG 1 1 9 6507 1 1 37 LYS H H 8.781 -5.307 3.031 1.00 . A A . 37 LYS H 1 1 9 6508 1 1 37 LYS HA H 8.997 -5.832 0.164 1.00 . A A . 37 LYS HA 1 1 9 6509 1 1 37 LYS HB2 H 10.882 -5.156 1.458 1.00 . A A . 37 LYS HB2 1 1 9 6510 1 1 37 LYS HB3 H 10.822 -6.614 2.415 1.00 . A A . 37 LYS HB3 1 1 9 6511 1 1 37 LYS HD2 H 12.953 -7.308 1.827 1.00 . A A . 37 LYS HD2 1 1 9 6512 1 1 37 LYS HD3 H 13.138 -8.167 0.315 1.00 . A A . 37 LYS HD3 1 1 9 6513 1 1 37 LYS HE2 H 13.539 -5.646 -0.630 1.00 . A A . 37 LYS HE2 1 1 9 6514 1 1 37 LYS HE3 H 14.046 -5.433 1.062 1.00 . A A . 37 LYS HE3 1 1 9 6515 1 1 37 LYS HG2 H 10.961 -7.778 0.102 1.00 . A A . 37 LYS HG2 1 1 9 6516 1 1 37 LYS HG3 H 11.394 -6.253 -0.582 1.00 . A A . 37 LYS HG3 1 1 9 6517 1 1 37 LYS HZ1 H 15.094 -7.778 -0.227 1.00 . A A . 37 LYS HZ1 1 1 9 6518 1 1 37 LYS HZ2 H 15.564 -6.342 -0.965 1.00 . A A . 37 LYS HZ2 1 1 9 6519 1 1 37 LYS N N 8.401 -5.400 2.102 1.00 . A A . 37 LYS N 1 1 9 6520 1 1 37 LYS NZ N 15.212 -6.764 -0.093 1.00 . A A . 37 LYS NZ 1 1 9 6521 1 1 37 LYS O O 8.522 -8.285 2.267 1.00 . A A . 37 LYS O 1 1 9 6522 1 1 38 ARG C C 8.017 -9.976 -1.473 1.00 . A A . 38 ARG C 1 1 9 6523 1 1 38 ARG CA C 7.497 -9.443 -0.138 1.00 . A A . 38 ARG CA 1 1 9 6524 1 1 38 ARG CB C 5.982 -9.211 -0.157 1.00 . A A . 38 ARG CB 1 1 9 6525 1 1 38 ARG CD C 5.191 -11.341 1.034 1.00 . A A . 38 ARG CD 1 1 9 6526 1 1 38 ARG CG C 5.135 -10.484 -0.240 1.00 . A A . 38 ARG CG 1 1 9 6527 1 1 38 ARG CZ C 6.663 -13.104 2.028 1.00 . A A . 38 ARG CZ 1 1 9 6528 1 1 38 ARG H H 8.124 -7.529 -0.749 1.00 . A A . 38 ARG H 1 1 9 6529 1 1 38 ARG HA H 7.766 -10.116 0.677 1.00 . A A . 38 ARG HA 1 1 9 6530 1 1 38 ARG HB2 H 5.704 -8.661 0.741 1.00 . A A . 38 ARG HB2 1 1 9 6531 1 1 38 ARG HB3 H 5.750 -8.586 -1.020 1.00 . A A . 38 ARG HB3 1 1 9 6532 1 1 38 ARG HD2 H 5.332 -10.680 1.892 1.00 . A A . 38 ARG HD2 1 1 9 6533 1 1 38 ARG HD3 H 4.226 -11.844 1.143 1.00 . A A . 38 ARG HD3 1 1 9 6534 1 1 38 ARG HG2 H 4.106 -10.144 -0.367 1.00 . A A . 38 ARG HG2 1 1 9 6535 1 1 38 ARG HG3 H 5.405 -11.060 -1.123 1.00 . A A . 38 ARG HG3 1 1 9 6536 1 1 38 ARG HH11 H 5.529 -12.121 3.403 1.00 . A A . 38 ARG HH11 1 1 9 6537 1 1 38 ARG HH12 H 6.530 -13.374 4.063 1.00 . A A . 38 ARG HH12 1 1 9 6538 1 1 38 ARG HH21 H 7.827 -14.290 0.869 1.00 . A A . 38 ARG HH21 1 1 9 6539 1 1 38 ARG HH22 H 7.899 -14.661 2.577 1.00 . A A . 38 ARG HH22 1 1 9 6540 1 1 38 ARG N N 8.116 -8.146 0.055 1.00 . A A . 38 ARG N 1 1 9 6541 1 1 38 ARG NE N 6.228 -12.386 0.977 1.00 . A A . 38 ARG NE 1 1 9 6542 1 1 38 ARG NH1 N 6.214 -12.844 3.262 1.00 . A A . 38 ARG NH1 1 1 9 6543 1 1 38 ARG NH2 N 7.545 -14.086 1.826 1.00 . A A . 38 ARG NH2 1 1 9 6544 1 1 38 ARG O O 7.950 -9.264 -2.473 1.00 . A A . 38 ARG O 1 1 9 6545 1 1 39 GLU C C 10.275 -10.693 -3.229 1.00 . A A . 39 GLU C 1 1 9 6546 1 1 39 GLU CA C 9.301 -11.729 -2.649 1.00 . A A . 39 GLU CA 1 1 9 6547 1 1 39 GLU CB C 8.302 -12.252 -3.693 1.00 . A A . 39 GLU CB 1 1 9 6548 1 1 39 GLU CD C 7.685 -14.157 -2.114 1.00 . A A . 39 GLU CD 1 1 9 6549 1 1 39 GLU CG C 7.176 -13.106 -3.094 1.00 . A A . 39 GLU CG 1 1 9 6550 1 1 39 GLU H H 8.613 -11.727 -0.642 1.00 . A A . 39 GLU H 1 1 9 6551 1 1 39 GLU HA H 9.909 -12.570 -2.309 1.00 . A A . 39 GLU HA 1 1 9 6552 1 1 39 GLU HB2 H 7.846 -11.409 -4.216 1.00 . A A . 39 GLU HB2 1 1 9 6553 1 1 39 GLU HB3 H 8.855 -12.848 -4.421 1.00 . A A . 39 GLU HB3 1 1 9 6554 1 1 39 GLU HG2 H 6.468 -12.460 -2.579 1.00 . A A . 39 GLU HG2 1 1 9 6555 1 1 39 GLU HG3 H 6.642 -13.607 -3.901 1.00 . A A . 39 GLU HG3 1 1 9 6556 1 1 39 GLU N N 8.602 -11.178 -1.487 1.00 . A A . 39 GLU N 1 1 9 6557 1 1 39 GLU O O 10.253 -10.383 -4.417 1.00 . A A . 39 GLU O 1 1 9 6558 1 1 39 GLU OE1 O 8.169 -15.302 -2.662 1.00 . A A . 39 GLU OE1 1 1 9 6559 1 1 39 GLU OE2 O 7.650 -13.913 -0.903 1.00 . A A . 39 GLU OE2 1 1 9 6560 1 1 40 ASN C C 11.426 -7.707 -3.002 1.00 . A A . 40 ASN C 1 1 9 6561 1 1 40 ASN CA C 12.046 -9.046 -2.579 1.00 . A A . 40 ASN CA 1 1 9 6562 1 1 40 ASN CB C 13.113 -9.505 -3.569 1.00 . A A . 40 ASN CB 1 1 9 6563 1 1 40 ASN CG C 14.341 -8.592 -3.545 1.00 . A A . 40 ASN CG 1 1 9 6564 1 1 40 ASN H H 11.072 -10.491 -1.415 1.00 . A A . 40 ASN H 1 1 9 6565 1 1 40 ASN HA H 12.537 -8.880 -1.624 1.00 . A A . 40 ASN HA 1 1 9 6566 1 1 40 ASN HB2 H 13.427 -10.520 -3.328 1.00 . A A . 40 ASN HB2 1 1 9 6567 1 1 40 ASN HB3 H 12.645 -9.523 -4.546 1.00 . A A . 40 ASN HB3 1 1 9 6568 1 1 40 ASN HD21 H 14.613 -8.770 -5.557 1.00 . A A . 40 ASN HD21 1 1 9 6569 1 1 40 ASN HD22 H 15.765 -7.760 -4.713 1.00 . A A . 40 ASN HD22 1 1 9 6570 1 1 40 ASN N N 11.086 -10.113 -2.341 1.00 . A A . 40 ASN N 1 1 9 6571 1 1 40 ASN ND2 N 14.947 -8.350 -4.702 1.00 . A A . 40 ASN ND2 1 1 9 6572 1 1 40 ASN O O 12.137 -6.709 -3.094 1.00 . A A . 40 ASN O 1 1 9 6573 1 1 40 ASN OD1 O 14.756 -8.117 -2.487 1.00 . A A . 40 ASN OD1 1 1 9 6574 1 1 41 HIS C C 8.752 -5.726 -2.656 1.00 . A A . 41 HIS C 1 1 9 6575 1 1 41 HIS CA C 9.434 -6.487 -3.772 1.00 . A A . 41 HIS CA 1 1 9 6576 1 1 41 HIS CB C 8.440 -6.908 -4.853 1.00 . A A . 41 HIS CB 1 1 9 6577 1 1 41 HIS CD2 C 9.302 -8.578 -6.664 1.00 . A A . 41 HIS CD2 1 1 9 6578 1 1 41 HIS CE1 C 10.556 -7.182 -7.782 1.00 . A A . 41 HIS CE1 1 1 9 6579 1 1 41 HIS CG C 9.179 -7.335 -6.097 1.00 . A A . 41 HIS CG 1 1 9 6580 1 1 41 HIS H H 9.535 -8.456 -3.035 1.00 . A A . 41 HIS H 1 1 9 6581 1 1 41 HIS HA H 10.155 -5.824 -4.247 1.00 . A A . 41 HIS HA 1 1 9 6582 1 1 41 HIS HB2 H 7.812 -7.713 -4.468 1.00 . A A . 41 HIS HB2 1 1 9 6583 1 1 41 HIS HB3 H 7.779 -6.069 -5.086 1.00 . A A . 41 HIS HB3 1 1 9 6584 1 1 41 HIS HD1 H 10.063 -5.453 -6.651 1.00 . A A . 41 HIS HD1 1 1 9 6585 1 1 41 HIS HD2 H 8.870 -9.495 -6.287 1.00 . A A . 41 HIS HD2 1 1 9 6586 1 1 41 HIS HE1 H 11.271 -6.790 -8.490 1.00 . A A . 41 HIS HE1 1 1 9 6587 1 1 41 HIS N N 10.114 -7.651 -3.237 1.00 . A A . 41 HIS N 1 1 9 6588 1 1 41 HIS ND1 N 9.944 -6.447 -6.838 1.00 . A A . 41 HIS ND1 1 1 9 6589 1 1 41 HIS NE2 N 10.178 -8.471 -7.726 1.00 . A A . 41 HIS NE2 1 1 9 6590 1 1 41 HIS O O 7.830 -6.236 -2.022 1.00 . A A . 41 HIS O 1 1 9 6591 1 1 42 TRP C C 7.177 -3.194 -2.240 1.00 . A A . 42 TRP C 1 1 9 6592 1 1 42 TRP CA C 8.510 -3.541 -1.594 1.00 . A A . 42 TRP CA 1 1 9 6593 1 1 42 TRP CB C 9.412 -2.331 -1.389 1.00 . A A . 42 TRP CB 1 1 9 6594 1 1 42 TRP CD1 C 11.725 -3.111 -0.735 1.00 . A A . 42 TRP CD1 1 1 9 6595 1 1 42 TRP CD2 C 10.499 -2.457 1.020 1.00 . A A . 42 TRP CD2 1 1 9 6596 1 1 42 TRP CE2 C 11.753 -2.896 1.527 1.00 . A A . 42 TRP CE2 1 1 9 6597 1 1 42 TRP CE3 C 9.507 -2.131 1.965 1.00 . A A . 42 TRP CE3 1 1 9 6598 1 1 42 TRP CG C 10.517 -2.601 -0.426 1.00 . A A . 42 TRP CG 1 1 9 6599 1 1 42 TRP CH2 C 11.003 -2.663 3.814 1.00 . A A . 42 TRP CH2 1 1 9 6600 1 1 42 TRP CZ2 C 11.999 -3.043 2.897 1.00 . A A . 42 TRP CZ2 1 1 9 6601 1 1 42 TRP CZ3 C 9.765 -2.190 3.343 1.00 . A A . 42 TRP CZ3 1 1 9 6602 1 1 42 TRP H H 9.951 -4.143 -3.011 1.00 . A A . 42 TRP H 1 1 9 6603 1 1 42 TRP HA H 8.332 -3.957 -0.613 1.00 . A A . 42 TRP HA 1 1 9 6604 1 1 42 TRP HB2 H 9.820 -2.003 -2.341 1.00 . A A . 42 TRP HB2 1 1 9 6605 1 1 42 TRP HB3 H 8.834 -1.513 -0.967 1.00 . A A . 42 TRP HB3 1 1 9 6606 1 1 42 TRP HD1 H 12.018 -3.431 -1.721 1.00 . A A . 42 TRP HD1 1 1 9 6607 1 1 42 TRP HE1 H 13.422 -3.589 0.462 1.00 . A A . 42 TRP HE1 1 1 9 6608 1 1 42 TRP HE3 H 8.520 -1.881 1.619 1.00 . A A . 42 TRP HE3 1 1 9 6609 1 1 42 TRP HH2 H 11.175 -2.764 4.875 1.00 . A A . 42 TRP HH2 1 1 9 6610 1 1 42 TRP HZ2 H 12.898 -3.550 3.208 1.00 . A A . 42 TRP HZ2 1 1 9 6611 1 1 42 TRP HZ3 H 8.986 -1.901 4.033 1.00 . A A . 42 TRP HZ3 1 1 9 6612 1 1 42 TRP N N 9.196 -4.492 -2.441 1.00 . A A . 42 TRP N 1 1 9 6613 1 1 42 TRP NE1 N 12.482 -3.237 0.408 1.00 . A A . 42 TRP NE1 1 1 9 6614 1 1 42 TRP O O 7.152 -2.446 -3.208 1.00 . A A . 42 TRP O 1 1 9 6615 1 1 43 LYS C C 4.250 -2.328 -1.222 1.00 . A A . 43 LYS C 1 1 9 6616 1 1 43 LYS CA C 4.742 -3.378 -2.199 1.00 . A A . 43 LYS CA 1 1 9 6617 1 1 43 LYS CB C 3.775 -4.569 -2.227 1.00 . A A . 43 LYS CB 1 1 9 6618 1 1 43 LYS CD C 5.270 -5.945 -3.794 1.00 . A A . 43 LYS CD 1 1 9 6619 1 1 43 LYS CE C 4.381 -6.054 -5.051 1.00 . A A . 43 LYS CE 1 1 9 6620 1 1 43 LYS CG C 4.512 -5.886 -2.459 1.00 . A A . 43 LYS CG 1 1 9 6621 1 1 43 LYS H H 6.145 -4.400 -0.969 1.00 . A A . 43 LYS H 1 1 9 6622 1 1 43 LYS HA H 4.791 -2.985 -3.211 1.00 . A A . 43 LYS HA 1 1 9 6623 1 1 43 LYS HB2 H 3.271 -4.637 -1.269 1.00 . A A . 43 LYS HB2 1 1 9 6624 1 1 43 LYS HB3 H 2.998 -4.407 -2.970 1.00 . A A . 43 LYS HB3 1 1 9 6625 1 1 43 LYS HD2 H 5.967 -5.116 -3.899 1.00 . A A . 43 LYS HD2 1 1 9 6626 1 1 43 LYS HD3 H 5.851 -6.865 -3.738 1.00 . A A . 43 LYS HD3 1 1 9 6627 1 1 43 LYS HE2 H 5.022 -6.388 -5.869 1.00 . A A . 43 LYS HE2 1 1 9 6628 1 1 43 LYS HE3 H 3.610 -6.811 -4.902 1.00 . A A . 43 LYS HE3 1 1 9 6629 1 1 43 LYS HG2 H 5.126 -6.031 -1.561 1.00 . A A . 43 LYS HG2 1 1 9 6630 1 1 43 LYS HG3 H 3.848 -6.734 -2.476 1.00 . A A . 43 LYS HG3 1 1 9 6631 1 1 43 LYS HZ1 H 4.045 -4.566 -6.449 1.00 . A A . 43 LYS HZ1 1 1 9 6632 1 1 43 LYS HZ2 H 2.726 -4.877 -5.453 1.00 . A A . 43 LYS HZ2 1 1 9 6633 1 1 43 LYS N N 6.073 -3.759 -1.755 1.00 . A A . 43 LYS N 1 1 9 6634 1 1 43 LYS NZ N 3.752 -4.783 -5.486 1.00 . A A . 43 LYS NZ 1 1 9 6635 1 1 43 LYS O O 4.494 -2.465 -0.026 1.00 . A A . 43 LYS O 1 1 9 6636 1 1 44 CYS C C 1.475 -1.108 -0.502 1.00 . A A . 44 CYS C 1 1 9 6637 1 1 44 CYS CA C 2.771 -0.416 -0.879 1.00 . A A . 44 CYS CA 1 1 9 6638 1 1 44 CYS CB C 2.525 0.880 -1.631 1.00 . A A . 44 CYS CB 1 1 9 6639 1 1 44 CYS H H 3.411 -1.255 -2.713 1.00 . A A . 44 CYS H 1 1 9 6640 1 1 44 CYS HA H 3.303 -0.160 0.027 1.00 . A A . 44 CYS HA 1 1 9 6641 1 1 44 CYS HB2 H 3.471 1.417 -1.625 1.00 . A A . 44 CYS HB2 1 1 9 6642 1 1 44 CYS HB3 H 2.220 0.654 -2.649 1.00 . A A . 44 CYS HB3 1 1 9 6643 1 1 44 CYS N N 3.546 -1.315 -1.717 1.00 . A A . 44 CYS N 1 1 9 6644 1 1 44 CYS O O 0.573 -1.188 -1.328 1.00 . A A . 44 CYS O 1 1 9 6645 1 1 44 CYS SG S 1.252 1.934 -0.906 1.00 . A A . 44 CYS SG 1 1 9 6646 1 1 45 PHE C C -0.788 -1.279 1.678 1.00 . A A . 45 PHE C 1 1 9 6647 1 1 45 PHE CA C 0.173 -2.332 1.134 1.00 . A A . 45 PHE CA 1 1 9 6648 1 1 45 PHE CB C 0.501 -3.373 2.205 1.00 . A A . 45 PHE CB 1 1 9 6649 1 1 45 PHE CD1 C 2.431 -4.721 1.269 1.00 . A A . 45 PHE CD1 1 1 9 6650 1 1 45 PHE CD2 C 0.307 -5.837 1.648 1.00 . A A . 45 PHE CD2 1 1 9 6651 1 1 45 PHE CE1 C 3.017 -5.954 0.927 1.00 . A A . 45 PHE CE1 1 1 9 6652 1 1 45 PHE CE2 C 0.885 -7.065 1.287 1.00 . A A . 45 PHE CE2 1 1 9 6653 1 1 45 PHE CG C 1.089 -4.669 1.683 1.00 . A A . 45 PHE CG 1 1 9 6654 1 1 45 PHE CZ C 2.243 -7.126 0.932 1.00 . A A . 45 PHE CZ 1 1 9 6655 1 1 45 PHE H H 2.094 -1.484 1.415 1.00 . A A . 45 PHE H 1 1 9 6656 1 1 45 PHE HA H -0.282 -2.844 0.286 1.00 . A A . 45 PHE HA 1 1 9 6657 1 1 45 PHE HB2 H 1.167 -2.925 2.938 1.00 . A A . 45 PHE HB2 1 1 9 6658 1 1 45 PHE HB3 H -0.409 -3.617 2.736 1.00 . A A . 45 PHE HB3 1 1 9 6659 1 1 45 PHE HD1 H 3.033 -3.828 1.297 1.00 . A A . 45 PHE HD1 1 1 9 6660 1 1 45 PHE HD2 H -0.741 -5.802 1.905 1.00 . A A . 45 PHE HD2 1 1 9 6661 1 1 45 PHE HE1 H 4.065 -5.996 0.663 1.00 . A A . 45 PHE HE1 1 1 9 6662 1 1 45 PHE HE2 H 0.286 -7.965 1.299 1.00 . A A . 45 PHE HE2 1 1 9 6663 1 1 45 PHE HZ H 2.689 -8.075 0.670 1.00 . A A . 45 PHE HZ 1 1 9 6664 1 1 45 PHE N N 1.384 -1.657 0.710 1.00 . A A . 45 PHE N 1 1 9 6665 1 1 45 PHE O O -0.353 -0.330 2.332 1.00 . A A . 45 PHE O 1 1 9 6666 1 1 46 CYS C C -4.029 -1.438 2.818 1.00 . A A . 46 CYS C 1 1 9 6667 1 1 46 CYS CA C -3.156 -0.607 1.891 1.00 . A A . 46 CYS CA 1 1 9 6668 1 1 46 CYS CB C -3.998 -0.102 0.720 1.00 . A A . 46 CYS CB 1 1 9 6669 1 1 46 CYS H H -2.370 -2.306 0.945 1.00 . A A . 46 CYS H 1 1 9 6670 1 1 46 CYS HA H -2.781 0.241 2.469 1.00 . A A . 46 CYS HA 1 1 9 6671 1 1 46 CYS HB2 H -4.488 -0.962 0.283 1.00 . A A . 46 CYS HB2 1 1 9 6672 1 1 46 CYS HB3 H -4.764 0.527 1.147 1.00 . A A . 46 CYS HB3 1 1 9 6673 1 1 46 CYS N N -2.082 -1.457 1.419 1.00 . A A . 46 CYS N 1 1 9 6674 1 1 46 CYS O O -4.251 -2.628 2.600 1.00 . A A . 46 CYS O 1 1 9 6675 1 1 46 CYS SG S -3.217 0.848 -0.616 1.00 . A A . 46 CYS SG 1 1 9 6676 1 1 47 TYR C C -6.551 -1.035 5.055 1.00 . A A . 47 TYR C 1 1 9 6677 1 1 47 TYR CA C -5.085 -1.441 5.041 1.00 . A A . 47 TYR CA 1 1 9 6678 1 1 47 TYR CB C -4.329 -0.879 6.253 1.00 . A A . 47 TYR CB 1 1 9 6679 1 1 47 TYR CD1 C -1.885 -1.178 5.608 1.00 . A A . 47 TYR CD1 1 1 9 6680 1 1 47 TYR CD2 C -2.716 -2.233 7.638 1.00 . A A . 47 TYR CD2 1 1 9 6681 1 1 47 TYR CE1 C -0.609 -1.704 5.860 1.00 . A A . 47 TYR CE1 1 1 9 6682 1 1 47 TYR CE2 C -1.425 -2.696 7.925 1.00 . A A . 47 TYR CE2 1 1 9 6683 1 1 47 TYR CG C -2.948 -1.452 6.491 1.00 . A A . 47 TYR CG 1 1 9 6684 1 1 47 TYR CZ C -0.379 -2.461 7.019 1.00 . A A . 47 TYR CZ 1 1 9 6685 1 1 47 TYR H H -4.341 0.203 3.909 1.00 . A A . 47 TYR H 1 1 9 6686 1 1 47 TYR HA H -5.003 -2.525 5.016 1.00 . A A . 47 TYR HA 1 1 9 6687 1 1 47 TYR HB2 H -4.223 0.188 6.075 1.00 . A A . 47 TYR HB2 1 1 9 6688 1 1 47 TYR HB3 H -4.898 -0.990 7.173 1.00 . A A . 47 TYR HB3 1 1 9 6689 1 1 47 TYR HD1 H -2.034 -0.556 4.740 1.00 . A A . 47 TYR HD1 1 1 9 6690 1 1 47 TYR HD2 H -3.521 -2.457 8.324 1.00 . A A . 47 TYR HD2 1 1 9 6691 1 1 47 TYR HE1 H 0.181 -1.547 5.139 1.00 . A A . 47 TYR HE1 1 1 9 6692 1 1 47 TYR HE2 H -1.256 -3.278 8.821 1.00 . A A . 47 TYR HE2 1 1 9 6693 1 1 47 TYR HH H 0.866 -3.510 8.071 1.00 . A A . 47 TYR HH 1 1 9 6694 1 1 47 TYR N N -4.492 -0.801 3.883 1.00 . A A . 47 TYR N 1 1 9 6695 1 1 47 TYR O O -6.857 0.094 5.437 1.00 . A A . 47 TYR O 1 1 9 6696 1 1 47 TYR OH O 0.848 -3.002 7.253 1.00 . A A . 47 TYR OH 1 1 9 6697 1 1 48 PHE C C -9.708 -1.035 5.191 1.00 . A A . 48 PHE C 1 1 9 6698 1 1 48 PHE CA C -8.726 -1.460 4.101 1.00 . A A . 48 PHE CA 1 1 9 6699 1 1 48 PHE CB C -9.265 -2.460 3.077 1.00 . A A . 48 PHE CB 1 1 9 6700 1 1 48 PHE CD1 C -7.661 -2.376 1.115 1.00 . A A . 48 PHE CD1 1 1 9 6701 1 1 48 PHE CD2 C -9.816 -1.255 0.923 1.00 . A A . 48 PHE CD2 1 1 9 6702 1 1 48 PHE CE1 C -7.286 -1.858 -0.138 1.00 . A A . 48 PHE CE1 1 1 9 6703 1 1 48 PHE CE2 C -9.438 -0.737 -0.325 1.00 . A A . 48 PHE CE2 1 1 9 6704 1 1 48 PHE CG C -8.916 -2.048 1.660 1.00 . A A . 48 PHE CG 1 1 9 6705 1 1 48 PHE CZ C -8.167 -1.026 -0.850 1.00 . A A . 48 PHE CZ 1 1 9 6706 1 1 48 PHE H H -7.159 -2.846 4.324 1.00 . A A . 48 PHE H 1 1 9 6707 1 1 48 PHE HA H -8.524 -0.548 3.546 1.00 . A A . 48 PHE HA 1 1 9 6708 1 1 48 PHE HB2 H -8.877 -3.456 3.269 1.00 . A A . 48 PHE HB2 1 1 9 6709 1 1 48 PHE HB3 H -10.341 -2.516 3.166 1.00 . A A . 48 PHE HB3 1 1 9 6710 1 1 48 PHE HD1 H -6.956 -2.967 1.683 1.00 . A A . 48 PHE HD1 1 1 9 6711 1 1 48 PHE HD2 H -10.774 -0.976 1.340 1.00 . A A . 48 PHE HD2 1 1 9 6712 1 1 48 PHE HE1 H -6.312 -2.074 -0.546 1.00 . A A . 48 PHE HE1 1 1 9 6713 1 1 48 PHE HE2 H -10.112 -0.080 -0.859 1.00 . A A . 48 PHE HE2 1 1 9 6714 1 1 48 PHE HZ H -7.862 -0.600 -1.793 1.00 . A A . 48 PHE HZ 1 1 9 6715 1 1 48 PHE N N -7.455 -1.924 4.628 1.00 . A A . 48 PHE N 1 1 9 6716 1 1 48 PHE O O -9.701 0.127 5.591 1.00 . A A . 48 PHE O 1 1 9 6717 1 1 49 ASN C C -10.967 -1.733 8.092 1.00 . A A . 49 ASN C 1 1 9 6718 1 1 49 ASN CA C -11.569 -1.601 6.694 1.00 . A A . 49 ASN CA 1 1 9 6719 1 1 49 ASN CB C -12.867 -2.411 6.490 1.00 . A A . 49 ASN CB 1 1 9 6720 1 1 49 ASN CG C -12.670 -3.912 6.315 1.00 . A A . 49 ASN CG 1 1 9 6721 1 1 49 ASN H H -10.425 -2.908 5.459 1.00 . A A . 49 ASN H 1 1 9 6722 1 1 49 ASN HA H -11.859 -0.555 6.584 1.00 . A A . 49 ASN HA 1 1 9 6723 1 1 49 ASN HB2 H -13.534 -2.245 7.336 1.00 . A A . 49 ASN HB2 1 1 9 6724 1 1 49 ASN HB3 H -13.364 -2.040 5.594 1.00 . A A . 49 ASN HB3 1 1 9 6725 1 1 49 ASN HD21 H -12.261 -3.671 4.341 1.00 . A A . 49 ASN HD21 1 1 9 6726 1 1 49 ASN HD22 H -12.157 -5.314 4.933 1.00 . A A . 49 ASN HD22 1 1 9 6727 1 1 49 ASN N N -10.550 -1.939 5.697 1.00 . A A . 49 ASN N 1 1 9 6728 1 1 49 ASN ND2 N -12.298 -4.322 5.107 1.00 . A A . 49 ASN ND2 1 1 9 6729 1 1 49 ASN O O -11.526 -2.372 8.981 1.00 . A A . 49 ASN O 1 1 9 6730 1 1 49 ASN OD1 O -12.877 -4.695 7.240 1.00 . A A . 49 ASN OD1 1 1 9 6731 1 1 50 CYS C C -9.616 -0.272 10.567 1.00 . A A . 50 CYS C 1 1 9 6732 1 1 50 CYS CA C -9.024 -1.191 9.504 1.00 . A A . 50 CYS CA 1 1 9 6733 1 1 50 CYS CB C -7.563 -0.855 9.232 1.00 . A A . 50 CYS CB 1 1 9 6734 1 1 50 CYS H H -9.433 -0.583 7.491 1.00 . A A . 50 CYS H 1 1 9 6735 1 1 50 CYS HA H -9.040 -2.203 9.876 1.00 . A A . 50 CYS HA 1 1 9 6736 1 1 50 CYS HB2 H -7.210 -1.406 8.363 1.00 . A A . 50 CYS HB2 1 1 9 6737 1 1 50 CYS HB3 H -7.516 0.197 9.016 1.00 . A A . 50 CYS HB3 1 1 9 6738 1 1 50 CYS N N -9.794 -1.122 8.271 1.00 . A A . 50 CYS N 1 1 9 6739 1 1 50 CYS O O -9.883 -0.748 11.713 1.00 . A A . 50 CYS O 1 1 9 6740 1 1 50 CYS OXT O -9.836 0.952 10.310 1.00 . A A . 50 CYS OXT 1 1 9 6741 1 1 50 CYS SG S -6.403 -1.151 10.584 1.00 . A A . 50 CYS SG 1 1 10 6742 1 1 1 LEU C C -8.914 -5.385 9.454 1.00 . A A . 1 LEU C 1 1 10 6743 1 1 1 LEU CA C -9.794 -5.859 10.612 1.00 . A A . 1 LEU CA 1 1 10 6744 1 1 1 LEU CB C -9.567 -7.346 10.935 1.00 . A A . 1 LEU CB 1 1 10 6745 1 1 1 LEU CD1 C -7.757 -7.003 12.701 1.00 . A A . 1 LEU CD1 1 1 10 6746 1 1 1 LEU CD2 C -8.049 -9.219 11.592 1.00 . A A . 1 LEU CD2 1 1 10 6747 1 1 1 LEU CG C -8.140 -7.703 11.391 1.00 . A A . 1 LEU CG 1 1 10 6748 1 1 1 LEU H1 H -11.430 -6.145 9.394 1.00 . A A . 1 LEU H1 1 1 10 6749 1 1 1 LEU H2 H -11.812 -5.934 11.019 1.00 . A A . 1 LEU H2 1 1 10 6750 1 1 1 LEU H3 H -11.348 -4.614 10.085 1.00 . A A . 1 LEU H3 1 1 10 6751 1 1 1 LEU HA H -9.583 -5.252 11.493 1.00 . A A . 1 LEU HA 1 1 10 6752 1 1 1 LEU HB2 H -10.262 -7.641 11.724 1.00 . A A . 1 LEU HB2 1 1 10 6753 1 1 1 LEU HB3 H -9.798 -7.928 10.042 1.00 . A A . 1 LEU HB3 1 1 10 6754 1 1 1 LEU HD11 H -8.486 -7.237 13.479 1.00 . A A . 1 LEU HD11 1 1 10 6755 1 1 1 LEU HD12 H -6.775 -7.351 13.025 1.00 . A A . 1 LEU HD12 1 1 10 6756 1 1 1 LEU HD13 H -7.706 -5.923 12.571 1.00 . A A . 1 LEU HD13 1 1 10 6757 1 1 1 LEU HD21 H -8.290 -9.734 10.662 1.00 . A A . 1 LEU HD21 1 1 10 6758 1 1 1 LEU HD22 H -7.034 -9.493 11.888 1.00 . A A . 1 LEU HD22 1 1 10 6759 1 1 1 LEU HD23 H -8.745 -9.540 12.369 1.00 . A A . 1 LEU HD23 1 1 10 6760 1 1 1 LEU HG H -7.420 -7.434 10.618 1.00 . A A . 1 LEU HG 1 1 10 6761 1 1 1 LEU N N -11.201 -5.621 10.250 1.00 . A A . 1 LEU N 1 1 10 6762 1 1 1 LEU O O -9.389 -5.396 8.321 1.00 . A A . 1 LEU O 1 1 10 6763 1 1 2 CYS C C -6.450 -5.115 7.578 1.00 . A A . 2 CYS C 1 1 10 6764 1 1 2 CYS CA C -6.803 -4.253 8.789 1.00 . A A . 2 CYS CA 1 1 10 6765 1 1 2 CYS CB C -5.587 -3.635 9.506 1.00 . A A . 2 CYS CB 1 1 10 6766 1 1 2 CYS H H -7.365 -4.979 10.685 1.00 . A A . 2 CYS H 1 1 10 6767 1 1 2 CYS HA H -7.372 -3.416 8.396 1.00 . A A . 2 CYS HA 1 1 10 6768 1 1 2 CYS HB2 H -4.866 -4.432 9.692 1.00 . A A . 2 CYS HB2 1 1 10 6769 1 1 2 CYS HB3 H -5.116 -2.898 8.868 1.00 . A A . 2 CYS HB3 1 1 10 6770 1 1 2 CYS N N -7.693 -4.924 9.734 1.00 . A A . 2 CYS N 1 1 10 6771 1 1 2 CYS O O -5.401 -5.750 7.511 1.00 . A A . 2 CYS O 1 1 10 6772 1 1 2 CYS SG S -5.925 -2.885 11.123 1.00 . A A . 2 CYS SG 1 1 10 6773 1 1 3 ASN C C -6.341 -5.356 4.465 1.00 . A A . 3 ASN C 1 1 10 6774 1 1 3 ASN CA C -7.342 -5.964 5.437 1.00 . A A . 3 ASN CA 1 1 10 6775 1 1 3 ASN CB C -8.766 -6.021 4.866 1.00 . A A . 3 ASN CB 1 1 10 6776 1 1 3 ASN CG C -8.853 -6.610 3.469 1.00 . A A . 3 ASN CG 1 1 10 6777 1 1 3 ASN H H -8.206 -4.581 6.770 1.00 . A A . 3 ASN H 1 1 10 6778 1 1 3 ASN HA H -7.030 -6.974 5.717 1.00 . A A . 3 ASN HA 1 1 10 6779 1 1 3 ASN HB2 H -9.412 -6.595 5.531 1.00 . A A . 3 ASN HB2 1 1 10 6780 1 1 3 ASN HB3 H -9.145 -5.007 4.788 1.00 . A A . 3 ASN HB3 1 1 10 6781 1 1 3 ASN HD21 H -7.844 -8.279 4.040 1.00 . A A . 3 ASN HD21 1 1 10 6782 1 1 3 ASN HD22 H -8.361 -8.230 2.370 1.00 . A A . 3 ASN HD22 1 1 10 6783 1 1 3 ASN N N -7.361 -5.110 6.604 1.00 . A A . 3 ASN N 1 1 10 6784 1 1 3 ASN ND2 N -8.280 -7.791 3.272 1.00 . A A . 3 ASN ND2 1 1 10 6785 1 1 3 ASN O O -6.680 -4.427 3.730 1.00 . A A . 3 ASN O 1 1 10 6786 1 1 3 ASN OD1 O -9.466 -6.025 2.580 1.00 . A A . 3 ASN OD1 1 1 10 6787 1 1 4 GLU C C -4.227 -5.958 2.305 1.00 . A A . 4 GLU C 1 1 10 6788 1 1 4 GLU CA C -4.002 -5.401 3.712 1.00 . A A . 4 GLU CA 1 1 10 6789 1 1 4 GLU CB C -2.712 -5.914 4.370 1.00 . A A . 4 GLU CB 1 1 10 6790 1 1 4 GLU CD C -0.192 -5.996 4.120 1.00 . A A . 4 GLU CD 1 1 10 6791 1 1 4 GLU CG C -1.496 -5.372 3.627 1.00 . A A . 4 GLU CG 1 1 10 6792 1 1 4 GLU H H -4.868 -6.568 5.182 1.00 . A A . 4 GLU H 1 1 10 6793 1 1 4 GLU HA H -3.967 -4.316 3.712 1.00 . A A . 4 GLU HA 1 1 10 6794 1 1 4 GLU HB2 H -2.672 -5.590 5.410 1.00 . A A . 4 GLU HB2 1 1 10 6795 1 1 4 GLU HB3 H -2.695 -7.006 4.341 1.00 . A A . 4 GLU HB3 1 1 10 6796 1 1 4 GLU HG2 H -1.679 -5.636 2.594 1.00 . A A . 4 GLU HG2 1 1 10 6797 1 1 4 GLU HG3 H -1.440 -4.286 3.719 1.00 . A A . 4 GLU HG3 1 1 10 6798 1 1 4 GLU N N -5.102 -5.847 4.523 1.00 . A A . 4 GLU N 1 1 10 6799 1 1 4 GLU O O -4.085 -7.160 2.092 1.00 . A A . 4 GLU O 1 1 10 6800 1 1 4 GLU OE1 O 0.188 -5.679 5.386 1.00 . A A . 4 GLU OE1 1 1 10 6801 1 1 4 GLU OE2 O 0.451 -6.738 3.378 1.00 . A A . 4 GLU OE2 1 1 10 6802 1 1 5 ARG C C -3.784 -4.714 -0.910 1.00 . A A . 5 ARG C 1 1 10 6803 1 1 5 ARG CA C -4.817 -5.426 -0.040 1.00 . A A . 5 ARG CA 1 1 10 6804 1 1 5 ARG CB C -6.264 -5.118 -0.449 1.00 . A A . 5 ARG CB 1 1 10 6805 1 1 5 ARG CD C -8.451 -6.258 -1.092 1.00 . A A . 5 ARG CD 1 1 10 6806 1 1 5 ARG CG C -7.033 -6.439 -0.542 1.00 . A A . 5 ARG CG 1 1 10 6807 1 1 5 ARG CZ C -9.859 -4.424 -0.046 1.00 . A A . 5 ARG CZ 1 1 10 6808 1 1 5 ARG H H -4.600 -4.106 1.609 1.00 . A A . 5 ARG H 1 1 10 6809 1 1 5 ARG HA H -4.632 -6.491 -0.176 1.00 . A A . 5 ARG HA 1 1 10 6810 1 1 5 ARG HB2 H -6.737 -4.472 0.289 1.00 . A A . 5 ARG HB2 1 1 10 6811 1 1 5 ARG HB3 H -6.286 -4.614 -1.417 1.00 . A A . 5 ARG HB3 1 1 10 6812 1 1 5 ARG HD2 H -8.427 -5.706 -2.031 1.00 . A A . 5 ARG HD2 1 1 10 6813 1 1 5 ARG HD3 H -8.848 -7.251 -1.313 1.00 . A A . 5 ARG HD3 1 1 10 6814 1 1 5 ARG HG2 H -6.495 -7.114 -1.209 1.00 . A A . 5 ARG HG2 1 1 10 6815 1 1 5 ARG HG3 H -7.047 -6.891 0.452 1.00 . A A . 5 ARG HG3 1 1 10 6816 1 1 5 ARG HH11 H -9.079 -3.813 -1.826 1.00 . A A . 5 ARG HH11 1 1 10 6817 1 1 5 ARG HH12 H -9.871 -2.572 -0.914 1.00 . A A . 5 ARG HH12 1 1 10 6818 1 1 5 ARG HH21 H -10.615 -4.699 1.824 1.00 . A A . 5 ARG HH21 1 1 10 6819 1 1 5 ARG HH22 H -11.030 -3.171 1.080 1.00 . A A . 5 ARG HH22 1 1 10 6820 1 1 5 ARG N N -4.592 -5.090 1.360 1.00 . A A . 5 ARG N 1 1 10 6821 1 1 5 ARG NE N -9.333 -5.658 -0.081 1.00 . A A . 5 ARG NE 1 1 10 6822 1 1 5 ARG NH1 N -9.643 -3.551 -1.034 1.00 . A A . 5 ARG NH1 1 1 10 6823 1 1 5 ARG NH2 N -10.594 -4.078 1.013 1.00 . A A . 5 ARG NH2 1 1 10 6824 1 1 5 ARG O O -3.186 -3.728 -0.470 1.00 . A A . 5 ARG O 1 1 10 6825 1 1 6 PRO C C -2.131 -3.625 -3.361 1.00 . A A . 6 PRO C 1 1 10 6826 1 1 6 PRO CA C -2.251 -5.030 -2.776 1.00 . A A . 6 PRO CA 1 1 10 6827 1 1 6 PRO CB C -2.135 -6.121 -3.848 1.00 . A A . 6 PRO CB 1 1 10 6828 1 1 6 PRO CD C -4.226 -6.346 -2.757 1.00 . A A . 6 PRO CD 1 1 10 6829 1 1 6 PRO CG C -3.592 -6.474 -4.139 1.00 . A A . 6 PRO CG 1 1 10 6830 1 1 6 PRO HA H -1.496 -5.186 -2.019 1.00 . A A . 6 PRO HA 1 1 10 6831 1 1 6 PRO HB2 H -1.608 -5.795 -4.747 1.00 . A A . 6 PRO HB2 1 1 10 6832 1 1 6 PRO HB3 H -1.638 -6.994 -3.421 1.00 . A A . 6 PRO HB3 1 1 10 6833 1 1 6 PRO HD2 H -5.289 -6.132 -2.854 1.00 . A A . 6 PRO HD2 1 1 10 6834 1 1 6 PRO HD3 H -4.072 -7.279 -2.213 1.00 . A A . 6 PRO HD3 1 1 10 6835 1 1 6 PRO HG2 H -4.020 -5.725 -4.809 1.00 . A A . 6 PRO HG2 1 1 10 6836 1 1 6 PRO HG3 H -3.705 -7.470 -4.562 1.00 . A A . 6 PRO HG3 1 1 10 6837 1 1 6 PRO N N -3.508 -5.262 -2.105 1.00 . A A . 6 PRO N 1 1 10 6838 1 1 6 PRO O O -3.084 -2.848 -3.362 1.00 . A A . 6 PRO O 1 1 10 6839 1 1 7 SER C C -1.652 -2.273 -5.972 1.00 . A A . 7 SER C 1 1 10 6840 1 1 7 SER CA C -0.762 -2.146 -4.738 1.00 . A A . 7 SER CA 1 1 10 6841 1 1 7 SER CB C 0.702 -2.069 -5.169 1.00 . A A . 7 SER CB 1 1 10 6842 1 1 7 SER H H -0.204 -3.995 -3.905 1.00 . A A . 7 SER H 1 1 10 6843 1 1 7 SER HA H -0.993 -1.226 -4.199 1.00 . A A . 7 SER HA 1 1 10 6844 1 1 7 SER HB2 H 0.706 -1.370 -6.002 1.00 . A A . 7 SER HB2 1 1 10 6845 1 1 7 SER HB3 H 1.325 -1.679 -4.369 1.00 . A A . 7 SER HB3 1 1 10 6846 1 1 7 SER HG H 0.508 -3.682 -6.199 1.00 . A A . 7 SER HG 1 1 10 6847 1 1 7 SER N N -0.953 -3.320 -3.912 1.00 . A A . 7 SER N 1 1 10 6848 1 1 7 SER O O -1.299 -3.022 -6.883 1.00 . A A . 7 SER O 1 1 10 6849 1 1 7 SER OG O 1.179 -3.342 -5.582 1.00 . A A . 7 SER OG 1 1 10 6850 1 1 8 GLN C C -3.129 -0.377 -8.092 1.00 . A A . 8 GLN C 1 1 10 6851 1 1 8 GLN CA C -3.649 -1.463 -7.152 1.00 . A A . 8 GLN CA 1 1 10 6852 1 1 8 GLN CB C -5.074 -1.147 -6.691 1.00 . A A . 8 GLN CB 1 1 10 6853 1 1 8 GLN CD C -7.066 -1.791 -5.293 1.00 . A A . 8 GLN CD 1 1 10 6854 1 1 8 GLN CG C -5.643 -2.166 -5.697 1.00 . A A . 8 GLN CG 1 1 10 6855 1 1 8 GLN H H -2.998 -0.989 -5.195 1.00 . A A . 8 GLN H 1 1 10 6856 1 1 8 GLN HA H -3.658 -2.419 -7.679 1.00 . A A . 8 GLN HA 1 1 10 6857 1 1 8 GLN HB2 H -5.109 -0.158 -6.240 1.00 . A A . 8 GLN HB2 1 1 10 6858 1 1 8 GLN HB3 H -5.700 -1.129 -7.575 1.00 . A A . 8 GLN HB3 1 1 10 6859 1 1 8 GLN HE21 H -7.843 -2.604 -6.989 1.00 . A A . 8 GLN HE21 1 1 10 6860 1 1 8 GLN HE22 H -8.995 -1.867 -5.892 1.00 . A A . 8 GLN HE22 1 1 10 6861 1 1 8 GLN HG2 H -5.633 -3.162 -6.139 1.00 . A A . 8 GLN HG2 1 1 10 6862 1 1 8 GLN HG3 H -5.034 -2.179 -4.796 1.00 . A A . 8 GLN HG3 1 1 10 6863 1 1 8 GLN N N -2.761 -1.534 -6.005 1.00 . A A . 8 GLN N 1 1 10 6864 1 1 8 GLN NE2 N -8.048 -2.122 -6.125 1.00 . A A . 8 GLN NE2 1 1 10 6865 1 1 8 GLN O O -2.857 -0.631 -9.259 1.00 . A A . 8 GLN O 1 1 10 6866 1 1 8 GLN OE1 O -7.283 -1.186 -4.244 1.00 . A A . 8 GLN OE1 1 1 10 6867 1 1 9 THR C C -0.980 1.822 -8.546 1.00 . A A . 9 THR C 1 1 10 6868 1 1 9 THR CA C -2.484 1.970 -8.335 1.00 . A A . 9 THR CA 1 1 10 6869 1 1 9 THR CB C -2.757 3.263 -7.557 1.00 . A A . 9 THR CB 1 1 10 6870 1 1 9 THR CG2 C -4.247 3.590 -7.534 1.00 . A A . 9 THR CG2 1 1 10 6871 1 1 9 THR H H -3.225 0.997 -6.594 1.00 . A A . 9 THR H 1 1 10 6872 1 1 9 THR HA H -2.982 2.018 -9.307 1.00 . A A . 9 THR HA 1 1 10 6873 1 1 9 THR HB H -2.237 4.079 -8.063 1.00 . A A . 9 THR HB 1 1 10 6874 1 1 9 THR HG1 H -2.957 2.763 -5.667 1.00 . A A . 9 THR HG1 1 1 10 6875 1 1 9 THR HG21 H -4.832 2.735 -7.207 1.00 . A A . 9 THR HG21 1 1 10 6876 1 1 9 THR HG22 H -4.408 4.411 -6.842 1.00 . A A . 9 THR HG22 1 1 10 6877 1 1 9 THR HG23 H -4.571 3.890 -8.532 1.00 . A A . 9 THR HG23 1 1 10 6878 1 1 9 THR N N -2.980 0.842 -7.565 1.00 . A A . 9 THR N 1 1 10 6879 1 1 9 THR O O -0.477 1.895 -9.668 1.00 . A A . 9 THR O 1 1 10 6880 1 1 9 THR OG1 O -2.271 3.159 -6.225 1.00 . A A . 9 THR OG1 1 1 10 6881 1 1 10 TRP C C 1.827 0.580 -8.065 1.00 . A A . 10 TRP C 1 1 10 6882 1 1 10 TRP CA C 1.164 1.732 -7.295 1.00 . A A . 10 TRP CA 1 1 10 6883 1 1 10 TRP CB C 1.500 1.733 -5.800 1.00 . A A . 10 TRP CB 1 1 10 6884 1 1 10 TRP CD1 C 3.996 1.300 -5.635 1.00 . A A . 10 TRP CD1 1 1 10 6885 1 1 10 TRP CD2 C 3.392 3.255 -4.719 1.00 . A A . 10 TRP CD2 1 1 10 6886 1 1 10 TRP CE2 C 4.788 3.097 -4.482 1.00 . A A . 10 TRP CE2 1 1 10 6887 1 1 10 TRP CE3 C 2.793 4.443 -4.255 1.00 . A A . 10 TRP CE3 1 1 10 6888 1 1 10 TRP CG C 2.908 2.072 -5.421 1.00 . A A . 10 TRP CG 1 1 10 6889 1 1 10 TRP CH2 C 4.862 5.145 -3.206 1.00 . A A . 10 TRP CH2 1 1 10 6890 1 1 10 TRP CZ2 C 5.530 4.047 -3.764 1.00 . A A . 10 TRP CZ2 1 1 10 6891 1 1 10 TRP CZ3 C 3.506 5.364 -3.470 1.00 . A A . 10 TRP CZ3 1 1 10 6892 1 1 10 TRP H H -0.829 1.722 -6.573 1.00 . A A . 10 TRP H 1 1 10 6893 1 1 10 TRP HA H 1.478 2.697 -7.698 1.00 . A A . 10 TRP HA 1 1 10 6894 1 1 10 TRP HB2 H 0.861 2.472 -5.315 1.00 . A A . 10 TRP HB2 1 1 10 6895 1 1 10 TRP HB3 H 1.250 0.765 -5.372 1.00 . A A . 10 TRP HB3 1 1 10 6896 1 1 10 TRP HD1 H 3.985 0.335 -6.120 1.00 . A A . 10 TRP HD1 1 1 10 6897 1 1 10 TRP HE1 H 6.066 1.577 -5.208 1.00 . A A . 10 TRP HE1 1 1 10 6898 1 1 10 TRP HE3 H 1.775 4.642 -4.524 1.00 . A A . 10 TRP HE3 1 1 10 6899 1 1 10 TRP HH2 H 5.362 5.832 -2.563 1.00 . A A . 10 TRP HH2 1 1 10 6900 1 1 10 TRP HZ2 H 6.591 3.922 -3.611 1.00 . A A . 10 TRP HZ2 1 1 10 6901 1 1 10 TRP HZ3 H 3.035 6.240 -3.044 1.00 . A A . 10 TRP HZ3 1 1 10 6902 1 1 10 TRP N N -0.278 1.670 -7.423 1.00 . A A . 10 TRP N 1 1 10 6903 1 1 10 TRP NE1 N 5.114 1.916 -5.117 1.00 . A A . 10 TRP NE1 1 1 10 6904 1 1 10 TRP O O 2.291 -0.410 -7.496 1.00 . A A . 10 TRP O 1 1 10 6905 1 1 11 SER C C 3.812 -0.412 -10.380 1.00 . A A . 11 SER C 1 1 10 6906 1 1 11 SER CA C 2.292 -0.393 -10.252 1.00 . A A . 11 SER CA 1 1 10 6907 1 1 11 SER CB C 1.587 -0.258 -11.605 1.00 . A A . 11 SER CB 1 1 10 6908 1 1 11 SER H H 1.371 1.473 -9.804 1.00 . A A . 11 SER H 1 1 10 6909 1 1 11 SER HA H 2.000 -1.334 -9.783 1.00 . A A . 11 SER HA 1 1 10 6910 1 1 11 SER HB2 H 1.907 0.658 -12.105 1.00 . A A . 11 SER HB2 1 1 10 6911 1 1 11 SER HB3 H 1.852 -1.107 -12.237 1.00 . A A . 11 SER HB3 1 1 10 6912 1 1 11 SER HG H -0.070 0.511 -10.854 1.00 . A A . 11 SER HG 1 1 10 6913 1 1 11 SER N N 1.867 0.692 -9.389 1.00 . A A . 11 SER N 1 1 10 6914 1 1 11 SER O O 4.356 -0.256 -11.469 1.00 . A A . 11 SER O 1 1 10 6915 1 1 11 SER OG O 0.184 -0.236 -11.414 1.00 . A A . 11 SER OG 1 1 10 6916 1 1 12 GLY C C 6.425 -1.113 -7.834 1.00 . A A . 12 GLY C 1 1 10 6917 1 1 12 GLY CA C 5.947 -0.668 -9.211 1.00 . A A . 12 GLY CA 1 1 10 6918 1 1 12 GLY H H 3.986 -0.707 -8.382 1.00 . A A . 12 GLY H 1 1 10 6919 1 1 12 GLY HA2 H 6.313 -1.374 -9.958 1.00 . A A . 12 GLY HA2 1 1 10 6920 1 1 12 GLY HA3 H 6.345 0.324 -9.430 1.00 . A A . 12 GLY HA3 1 1 10 6921 1 1 12 GLY N N 4.498 -0.614 -9.254 1.00 . A A . 12 GLY N 1 1 10 6922 1 1 12 GLY O O 5.628 -1.572 -7.006 1.00 . A A . 12 GLY O 1 1 10 6923 1 1 13 ASN C C 8.047 0.019 -5.416 1.00 . A A . 13 ASN C 1 1 10 6924 1 1 13 ASN CA C 8.352 -1.190 -6.303 1.00 . A A . 13 ASN CA 1 1 10 6925 1 1 13 ASN CB C 9.864 -1.402 -6.476 1.00 . A A . 13 ASN CB 1 1 10 6926 1 1 13 ASN CG C 10.497 -2.212 -5.345 1.00 . A A . 13 ASN CG 1 1 10 6927 1 1 13 ASN H H 8.299 -0.548 -8.322 1.00 . A A . 13 ASN H 1 1 10 6928 1 1 13 ASN HA H 7.921 -2.096 -5.881 1.00 . A A . 13 ASN HA 1 1 10 6929 1 1 13 ASN HB2 H 10.029 -1.966 -7.394 1.00 . A A . 13 ASN HB2 1 1 10 6930 1 1 13 ASN HB3 H 10.370 -0.441 -6.577 1.00 . A A . 13 ASN HB3 1 1 10 6931 1 1 13 ASN HD21 H 10.620 -0.603 -4.037 1.00 . A A . 13 ASN HD21 1 1 10 6932 1 1 13 ASN HD22 H 11.328 -2.093 -3.508 1.00 . A A . 13 ASN HD22 1 1 10 6933 1 1 13 ASN N N 7.735 -0.974 -7.603 1.00 . A A . 13 ASN N 1 1 10 6934 1 1 13 ASN ND2 N 10.818 -1.588 -4.212 1.00 . A A . 13 ASN ND2 1 1 10 6935 1 1 13 ASN O O 7.671 1.078 -5.917 1.00 . A A . 13 ASN O 1 1 10 6936 1 1 13 ASN OD1 O 10.728 -3.415 -5.497 1.00 . A A . 13 ASN OD1 1 1 10 6937 1 1 14 CYS C C 9.138 1.338 -2.439 1.00 . A A . 14 CYS C 1 1 10 6938 1 1 14 CYS CA C 7.849 0.884 -3.108 1.00 . A A . 14 CYS CA 1 1 10 6939 1 1 14 CYS CB C 6.841 0.306 -2.108 1.00 . A A . 14 CYS CB 1 1 10 6940 1 1 14 CYS H H 8.456 -1.035 -3.746 1.00 . A A . 14 CYS H 1 1 10 6941 1 1 14 CYS HA H 7.393 1.750 -3.584 1.00 . A A . 14 CYS HA 1 1 10 6942 1 1 14 CYS HB2 H 6.073 -0.195 -2.692 1.00 . A A . 14 CYS HB2 1 1 10 6943 1 1 14 CYS HB3 H 7.324 -0.429 -1.469 1.00 . A A . 14 CYS HB3 1 1 10 6944 1 1 14 CYS N N 8.164 -0.128 -4.100 1.00 . A A . 14 CYS N 1 1 10 6945 1 1 14 CYS O O 10.169 0.677 -2.567 1.00 . A A . 14 CYS O 1 1 10 6946 1 1 14 CYS SG S 5.958 1.486 -1.060 1.00 . A A . 14 CYS SG 1 1 10 6947 1 1 15 GLY C C 9.580 4.224 -0.192 1.00 . A A . 15 GLY C 1 1 10 6948 1 1 15 GLY CA C 10.152 3.064 -0.994 1.00 . A A . 15 GLY CA 1 1 10 6949 1 1 15 GLY H H 8.178 2.951 -1.719 1.00 . A A . 15 GLY H 1 1 10 6950 1 1 15 GLY HA2 H 10.581 2.325 -0.321 1.00 . A A . 15 GLY HA2 1 1 10 6951 1 1 15 GLY HA3 H 10.917 3.430 -1.676 1.00 . A A . 15 GLY HA3 1 1 10 6952 1 1 15 GLY N N 9.068 2.480 -1.760 1.00 . A A . 15 GLY N 1 1 10 6953 1 1 15 GLY O O 9.628 4.244 1.038 1.00 . A A . 15 GLY O 1 1 10 6954 1 1 16 ASN C C 6.951 5.881 0.352 1.00 . A A . 16 ASN C 1 1 10 6955 1 1 16 ASN CA C 8.266 6.298 -0.311 1.00 . A A . 16 ASN CA 1 1 10 6956 1 1 16 ASN CB C 8.073 7.398 -1.362 1.00 . A A . 16 ASN CB 1 1 10 6957 1 1 16 ASN CG C 7.675 8.722 -0.718 1.00 . A A . 16 ASN CG 1 1 10 6958 1 1 16 ASN H H 8.951 5.056 -1.909 1.00 . A A . 16 ASN H 1 1 10 6959 1 1 16 ASN HA H 8.920 6.706 0.462 1.00 . A A . 16 ASN HA 1 1 10 6960 1 1 16 ASN HB2 H 9.022 7.558 -1.875 1.00 . A A . 16 ASN HB2 1 1 10 6961 1 1 16 ASN HB3 H 7.323 7.111 -2.097 1.00 . A A . 16 ASN HB3 1 1 10 6962 1 1 16 ASN HD21 H 8.197 9.774 -2.385 1.00 . A A . 16 ASN HD21 1 1 10 6963 1 1 16 ASN HD22 H 7.579 10.708 -1.039 1.00 . A A . 16 ASN HD22 1 1 10 6964 1 1 16 ASN N N 8.942 5.153 -0.904 1.00 . A A . 16 ASN N 1 1 10 6965 1 1 16 ASN ND2 N 7.804 9.818 -1.456 1.00 . A A . 16 ASN ND2 1 1 10 6966 1 1 16 ASN O O 5.858 6.225 -0.105 1.00 . A A . 16 ASN O 1 1 10 6967 1 1 16 ASN OD1 O 7.232 8.762 0.425 1.00 . A A . 16 ASN OD1 1 1 10 6968 1 1 17 THR C C 5.069 5.942 2.687 1.00 . A A . 17 THR C 1 1 10 6969 1 1 17 THR CA C 5.913 4.728 2.257 1.00 . A A . 17 THR CA 1 1 10 6970 1 1 17 THR CB C 6.392 3.837 3.419 1.00 . A A . 17 THR CB 1 1 10 6971 1 1 17 THR CG2 C 7.017 4.617 4.579 1.00 . A A . 17 THR CG2 1 1 10 6972 1 1 17 THR H H 7.992 4.860 1.742 1.00 . A A . 17 THR H 1 1 10 6973 1 1 17 THR HA H 5.321 4.097 1.601 1.00 . A A . 17 THR HA 1 1 10 6974 1 1 17 THR HB H 7.153 3.162 3.032 1.00 . A A . 17 THR HB 1 1 10 6975 1 1 17 THR HG1 H 4.718 3.569 4.380 1.00 . A A . 17 THR HG1 1 1 10 6976 1 1 17 THR HG21 H 7.843 5.230 4.216 1.00 . A A . 17 THR HG21 1 1 10 6977 1 1 17 THR HG22 H 6.281 5.255 5.068 1.00 . A A . 17 THR HG22 1 1 10 6978 1 1 17 THR HG23 H 7.408 3.912 5.314 1.00 . A A . 17 THR HG23 1 1 10 6979 1 1 17 THR N N 7.060 5.160 1.468 1.00 . A A . 17 THR N 1 1 10 6980 1 1 17 THR O O 3.839 5.874 2.765 1.00 . A A . 17 THR O 1 1 10 6981 1 1 17 THR OG1 O 5.340 3.019 3.894 1.00 . A A . 17 THR OG1 1 1 10 6982 1 1 18 ALA C C 4.191 8.841 2.107 1.00 . A A . 18 ALA C 1 1 10 6983 1 1 18 ALA CA C 5.086 8.340 3.245 1.00 . A A . 18 ALA CA 1 1 10 6984 1 1 18 ALA CB C 6.135 9.383 3.636 1.00 . A A . 18 ALA CB 1 1 10 6985 1 1 18 ALA H H 6.738 7.082 2.816 1.00 . A A . 18 ALA H 1 1 10 6986 1 1 18 ALA HA H 4.442 8.175 4.111 1.00 . A A . 18 ALA HA 1 1 10 6987 1 1 18 ALA HB1 H 6.730 9.012 4.472 1.00 . A A . 18 ALA HB1 1 1 10 6988 1 1 18 ALA HB2 H 6.796 9.597 2.797 1.00 . A A . 18 ALA HB2 1 1 10 6989 1 1 18 ALA HB3 H 5.641 10.306 3.940 1.00 . A A . 18 ALA HB3 1 1 10 6990 1 1 18 ALA N N 5.733 7.081 2.916 1.00 . A A . 18 ALA N 1 1 10 6991 1 1 18 ALA O O 3.229 9.560 2.381 1.00 . A A . 18 ALA O 1 1 10 6992 1 1 19 HIS C C 2.488 7.517 -0.160 1.00 . A A . 19 HIS C 1 1 10 6993 1 1 19 HIS CA C 3.503 8.650 -0.230 1.00 . A A . 19 HIS CA 1 1 10 6994 1 1 19 HIS CB C 4.150 8.692 -1.621 1.00 . A A . 19 HIS CB 1 1 10 6995 1 1 19 HIS CD2 C 1.876 9.395 -2.713 1.00 . A A . 19 HIS CD2 1 1 10 6996 1 1 19 HIS CE1 C 2.330 8.794 -4.767 1.00 . A A . 19 HIS CE1 1 1 10 6997 1 1 19 HIS CG C 3.165 8.918 -2.748 1.00 . A A . 19 HIS CG 1 1 10 6998 1 1 19 HIS H H 5.316 7.949 0.664 1.00 . A A . 19 HIS H 1 1 10 6999 1 1 19 HIS HA H 2.986 9.600 -0.087 1.00 . A A . 19 HIS HA 1 1 10 7000 1 1 19 HIS HB2 H 4.890 9.478 -1.671 1.00 . A A . 19 HIS HB2 1 1 10 7001 1 1 19 HIS HB3 H 4.666 7.753 -1.790 1.00 . A A . 19 HIS HB3 1 1 10 7002 1 1 19 HIS HD1 H 4.342 8.266 -4.434 1.00 . A A . 19 HIS HD1 1 1 10 7003 1 1 19 HIS HD2 H 1.339 9.705 -1.820 1.00 . A A . 19 HIS HD2 1 1 10 7004 1 1 19 HIS HE1 H 2.215 8.575 -5.821 1.00 . A A . 19 HIS HE1 1 1 10 7005 1 1 19 HIS N N 4.470 8.484 0.847 1.00 . A A . 19 HIS N 1 1 10 7006 1 1 19 HIS ND1 N 3.466 8.618 -4.071 1.00 . A A . 19 HIS ND1 1 1 10 7007 1 1 19 HIS NE2 N 1.342 9.251 -3.983 1.00 . A A . 19 HIS NE2 1 1 10 7008 1 1 19 HIS O O 1.294 7.794 -0.195 1.00 . A A . 19 HIS O 1 1 10 7009 1 1 20 CYS C C 0.840 5.239 0.758 1.00 . A A . 20 CYS C 1 1 10 7010 1 1 20 CYS CA C 2.081 5.077 -0.117 1.00 . A A . 20 CYS CA 1 1 10 7011 1 1 20 CYS CB C 2.821 3.827 0.347 1.00 . A A . 20 CYS CB 1 1 10 7012 1 1 20 CYS H H 3.955 6.121 -0.057 1.00 . A A . 20 CYS H 1 1 10 7013 1 1 20 CYS HA H 1.759 4.917 -1.146 1.00 . A A . 20 CYS HA 1 1 10 7014 1 1 20 CYS HB2 H 3.651 3.590 -0.315 1.00 . A A . 20 CYS HB2 1 1 10 7015 1 1 20 CYS HB3 H 3.193 3.987 1.353 1.00 . A A . 20 CYS HB3 1 1 10 7016 1 1 20 CYS N N 2.949 6.260 -0.091 1.00 . A A . 20 CYS N 1 1 10 7017 1 1 20 CYS O O -0.277 4.946 0.335 1.00 . A A . 20 CYS O 1 1 10 7018 1 1 20 CYS SG S 1.717 2.412 0.494 1.00 . A A . 20 CYS SG 1 1 10 7019 1 1 21 ASP C C -1.106 6.924 2.247 1.00 . A A . 21 ASP C 1 1 10 7020 1 1 21 ASP CA C -0.105 5.938 2.867 1.00 . A A . 21 ASP CA 1 1 10 7021 1 1 21 ASP CB C 0.387 6.535 4.191 1.00 . A A . 21 ASP CB 1 1 10 7022 1 1 21 ASP CG C -0.821 6.928 5.028 1.00 . A A . 21 ASP CG 1 1 10 7023 1 1 21 ASP H H 1.972 5.935 2.297 1.00 . A A . 21 ASP H 1 1 10 7024 1 1 21 ASP HA H -0.585 4.962 3.045 1.00 . A A . 21 ASP HA 1 1 10 7025 1 1 21 ASP HB2 H 0.996 5.819 4.740 1.00 . A A . 21 ASP HB2 1 1 10 7026 1 1 21 ASP HB3 H 0.989 7.424 4.001 1.00 . A A . 21 ASP HB3 1 1 10 7027 1 1 21 ASP N N 1.023 5.761 1.971 1.00 . A A . 21 ASP N 1 1 10 7028 1 1 21 ASP O O -2.300 6.642 2.203 1.00 . A A . 21 ASP O 1 1 10 7029 1 1 21 ASP OD1 O -1.582 6.044 5.409 1.00 . A A . 21 ASP OD1 1 1 10 7030 1 1 21 ASP OD2 O -1.008 8.261 5.219 1.00 . A A . 21 ASP OD2 1 1 10 7031 1 1 22 LYS C C -2.218 8.494 0.002 1.00 . A A . 22 LYS C 1 1 10 7032 1 1 22 LYS CA C -1.488 9.102 1.189 1.00 . A A . 22 LYS CA 1 1 10 7033 1 1 22 LYS CB C -0.716 10.337 0.705 1.00 . A A . 22 LYS CB 1 1 10 7034 1 1 22 LYS CD C 0.915 12.160 1.293 1.00 . A A . 22 LYS CD 1 1 10 7035 1 1 22 LYS CE C 1.671 12.891 2.411 1.00 . A A . 22 LYS CE 1 1 10 7036 1 1 22 LYS CG C 0.181 10.906 1.792 1.00 . A A . 22 LYS CG 1 1 10 7037 1 1 22 LYS H H 0.378 8.160 1.666 1.00 . A A . 22 LYS H 1 1 10 7038 1 1 22 LYS HA H -2.189 9.431 1.952 1.00 . A A . 22 LYS HA 1 1 10 7039 1 1 22 LYS HB2 H -0.102 10.083 -0.155 1.00 . A A . 22 LYS HB2 1 1 10 7040 1 1 22 LYS HB3 H -1.435 11.097 0.400 1.00 . A A . 22 LYS HB3 1 1 10 7041 1 1 22 LYS HD2 H 1.615 11.868 0.507 1.00 . A A . 22 LYS HD2 1 1 10 7042 1 1 22 LYS HD3 H 0.192 12.853 0.859 1.00 . A A . 22 LYS HD3 1 1 10 7043 1 1 22 LYS HE2 H 2.352 13.614 1.958 1.00 . A A . 22 LYS HE2 1 1 10 7044 1 1 22 LYS HE3 H 0.955 13.441 3.029 1.00 . A A . 22 LYS HE3 1 1 10 7045 1 1 22 LYS HG2 H -0.421 11.122 2.676 1.00 . A A . 22 LYS HG2 1 1 10 7046 1 1 22 LYS HG3 H 0.892 10.112 1.987 1.00 . A A . 22 LYS HG3 1 1 10 7047 1 1 22 LYS HZ1 H 2.167 10.997 3.064 1.00 . A A . 22 LYS HZ1 1 1 10 7048 1 1 22 LYS HZ2 H 3.441 12.094 3.113 1.00 . A A . 22 LYS HZ2 1 1 10 7049 1 1 22 LYS N N -0.624 8.079 1.776 1.00 . A A . 22 LYS N 1 1 10 7050 1 1 22 LYS NZ N 2.432 11.969 3.280 1.00 . A A . 22 LYS NZ 1 1 10 7051 1 1 22 LYS O O -3.436 8.553 -0.090 1.00 . A A . 22 LYS O 1 1 10 7052 1 1 23 GLN C C -3.047 6.367 -1.821 1.00 . A A . 23 GLN C 1 1 10 7053 1 1 23 GLN CA C -1.853 7.277 -2.137 1.00 . A A . 23 GLN CA 1 1 10 7054 1 1 23 GLN CB C -0.631 6.504 -2.659 1.00 . A A . 23 GLN CB 1 1 10 7055 1 1 23 GLN CD C -0.656 6.226 -5.167 1.00 . A A . 23 GLN CD 1 1 10 7056 1 1 23 GLN CG C -0.860 5.534 -3.820 1.00 . A A . 23 GLN CG 1 1 10 7057 1 1 23 GLN H H -0.450 7.845 -0.663 1.00 . A A . 23 GLN H 1 1 10 7058 1 1 23 GLN HA H -2.150 8.041 -2.857 1.00 . A A . 23 GLN HA 1 1 10 7059 1 1 23 GLN HB2 H 0.193 7.180 -2.869 1.00 . A A . 23 GLN HB2 1 1 10 7060 1 1 23 GLN HB3 H -0.292 5.870 -1.849 1.00 . A A . 23 GLN HB3 1 1 10 7061 1 1 23 GLN HE21 H -0.948 4.482 -6.203 1.00 . A A . 23 GLN HE21 1 1 10 7062 1 1 23 GLN HE22 H -0.588 5.920 -7.155 1.00 . A A . 23 GLN HE22 1 1 10 7063 1 1 23 GLN HG2 H -0.123 4.740 -3.712 1.00 . A A . 23 GLN HG2 1 1 10 7064 1 1 23 GLN HG3 H -1.839 5.074 -3.772 1.00 . A A . 23 GLN HG3 1 1 10 7065 1 1 23 GLN N N -1.435 7.893 -0.894 1.00 . A A . 23 GLN N 1 1 10 7066 1 1 23 GLN NE2 N -0.697 5.469 -6.258 1.00 . A A . 23 GLN NE2 1 1 10 7067 1 1 23 GLN O O -4.128 6.513 -2.388 1.00 . A A . 23 GLN O 1 1 10 7068 1 1 23 GLN OE1 O -0.417 7.431 -5.229 1.00 . A A . 23 GLN OE1 1 1 10 7069 1 1 24 CYS C C -5.143 5.131 0.088 1.00 . A A . 24 CYS C 1 1 10 7070 1 1 24 CYS CA C -3.867 4.486 -0.463 1.00 . A A . 24 CYS CA 1 1 10 7071 1 1 24 CYS CB C -3.265 3.579 0.611 1.00 . A A . 24 CYS CB 1 1 10 7072 1 1 24 CYS H H -1.943 5.388 -0.431 1.00 . A A . 24 CYS H 1 1 10 7073 1 1 24 CYS HA H -4.148 3.905 -1.348 1.00 . A A . 24 CYS HA 1 1 10 7074 1 1 24 CYS HB2 H -2.748 4.191 1.351 1.00 . A A . 24 CYS HB2 1 1 10 7075 1 1 24 CYS HB3 H -4.070 3.061 1.125 1.00 . A A . 24 CYS HB3 1 1 10 7076 1 1 24 CYS N N -2.859 5.451 -0.870 1.00 . A A . 24 CYS N 1 1 10 7077 1 1 24 CYS O O -6.222 4.550 -0.034 1.00 . A A . 24 CYS O 1 1 10 7078 1 1 24 CYS SG S -2.128 2.312 0.016 1.00 . A A . 24 CYS SG 1 1 10 7079 1 1 25 GLN C C -6.899 7.831 0.237 1.00 . A A . 25 GLN C 1 1 10 7080 1 1 25 GLN CA C -6.189 6.985 1.305 1.00 . A A . 25 GLN CA 1 1 10 7081 1 1 25 GLN CB C -5.731 7.849 2.489 1.00 . A A . 25 GLN CB 1 1 10 7082 1 1 25 GLN CD C -4.545 7.790 4.722 1.00 . A A . 25 GLN CD 1 1 10 7083 1 1 25 GLN CG C -5.199 6.966 3.619 1.00 . A A . 25 GLN CG 1 1 10 7084 1 1 25 GLN H H -4.119 6.719 0.835 1.00 . A A . 25 GLN H 1 1 10 7085 1 1 25 GLN HA H -6.889 6.252 1.711 1.00 . A A . 25 GLN HA 1 1 10 7086 1 1 25 GLN HB2 H -4.951 8.540 2.174 1.00 . A A . 25 GLN HB2 1 1 10 7087 1 1 25 GLN HB3 H -6.575 8.423 2.876 1.00 . A A . 25 GLN HB3 1 1 10 7088 1 1 25 GLN HE21 H -5.763 6.967 6.122 1.00 . A A . 25 GLN HE21 1 1 10 7089 1 1 25 GLN HE22 H -4.650 8.201 6.703 1.00 . A A . 25 GLN HE22 1 1 10 7090 1 1 25 GLN HG2 H -6.029 6.386 4.025 1.00 . A A . 25 GLN HG2 1 1 10 7091 1 1 25 GLN HG3 H -4.462 6.272 3.232 1.00 . A A . 25 GLN HG3 1 1 10 7092 1 1 25 GLN N N -5.036 6.293 0.736 1.00 . A A . 25 GLN N 1 1 10 7093 1 1 25 GLN NE2 N -5.025 7.649 5.951 1.00 . A A . 25 GLN NE2 1 1 10 7094 1 1 25 GLN O O -8.121 7.952 0.240 1.00 . A A . 25 GLN O 1 1 10 7095 1 1 25 GLN OE1 O -3.601 8.542 4.492 1.00 . A A . 25 GLN OE1 1 1 10 7096 1 1 26 ASP C C -7.019 8.766 -2.908 1.00 . A A . 26 ASP C 1 1 10 7097 1 1 26 ASP CA C -6.548 9.443 -1.624 1.00 . A A . 26 ASP CA 1 1 10 7098 1 1 26 ASP CB C -5.415 10.432 -1.934 1.00 . A A . 26 ASP CB 1 1 10 7099 1 1 26 ASP CG C -4.996 11.284 -0.740 1.00 . A A . 26 ASP CG 1 1 10 7100 1 1 26 ASP H H -5.122 8.273 -0.573 1.00 . A A . 26 ASP H 1 1 10 7101 1 1 26 ASP HA H -7.382 10.013 -1.225 1.00 . A A . 26 ASP HA 1 1 10 7102 1 1 26 ASP HB2 H -4.543 9.886 -2.287 1.00 . A A . 26 ASP HB2 1 1 10 7103 1 1 26 ASP HB3 H -5.745 11.099 -2.729 1.00 . A A . 26 ASP HB3 1 1 10 7104 1 1 26 ASP N N -6.113 8.464 -0.638 1.00 . A A . 26 ASP N 1 1 10 7105 1 1 26 ASP O O -8.162 8.937 -3.330 1.00 . A A . 26 ASP O 1 1 10 7106 1 1 26 ASP OD1 O -5.991 11.715 0.084 1.00 . A A . 26 ASP OD1 1 1 10 7107 1 1 26 ASP OD2 O -3.808 11.553 -0.579 1.00 . A A . 26 ASP OD2 1 1 10 7108 1 1 27 TRP C C -7.272 6.283 -4.728 1.00 . A A . 27 TRP C 1 1 10 7109 1 1 27 TRP CA C -6.323 7.462 -4.880 1.00 . A A . 27 TRP CA 1 1 10 7110 1 1 27 TRP CB C -4.992 6.958 -5.450 1.00 . A A . 27 TRP CB 1 1 10 7111 1 1 27 TRP CD1 C -3.709 9.147 -5.359 1.00 . A A . 27 TRP CD1 1 1 10 7112 1 1 27 TRP CD2 C -3.135 7.875 -7.105 1.00 . A A . 27 TRP CD2 1 1 10 7113 1 1 27 TRP CE2 C -2.274 9.011 -7.117 1.00 . A A . 27 TRP CE2 1 1 10 7114 1 1 27 TRP CE3 C -2.983 6.938 -8.148 1.00 . A A . 27 TRP CE3 1 1 10 7115 1 1 27 TRP CG C -4.003 7.966 -5.941 1.00 . A A . 27 TRP CG 1 1 10 7116 1 1 27 TRP CH2 C -1.114 8.188 -9.076 1.00 . A A . 27 TRP CH2 1 1 10 7117 1 1 27 TRP CZ2 C -1.276 9.176 -8.091 1.00 . A A . 27 TRP CZ2 1 1 10 7118 1 1 27 TRP CZ3 C -1.980 7.084 -9.116 1.00 . A A . 27 TRP CZ3 1 1 10 7119 1 1 27 TRP H H -5.233 7.836 -3.091 1.00 . A A . 27 TRP H 1 1 10 7120 1 1 27 TRP HA H -6.758 8.203 -5.554 1.00 . A A . 27 TRP HA 1 1 10 7121 1 1 27 TRP HB2 H -4.473 6.324 -4.739 1.00 . A A . 27 TRP HB2 1 1 10 7122 1 1 27 TRP HB3 H -5.247 6.311 -6.282 1.00 . A A . 27 TRP HB3 1 1 10 7123 1 1 27 TRP HD1 H -4.173 9.533 -4.468 1.00 . A A . 27 TRP HD1 1 1 10 7124 1 1 27 TRP HE1 H -2.284 10.657 -5.777 1.00 . A A . 27 TRP HE1 1 1 10 7125 1 1 27 TRP HE3 H -3.658 6.104 -8.211 1.00 . A A . 27 TRP HE3 1 1 10 7126 1 1 27 TRP HH2 H -0.339 8.264 -9.820 1.00 . A A . 27 TRP HH2 1 1 10 7127 1 1 27 TRP HZ2 H -0.636 10.046 -8.079 1.00 . A A . 27 TRP HZ2 1 1 10 7128 1 1 27 TRP HZ3 H -1.873 6.345 -9.898 1.00 . A A . 27 TRP HZ3 1 1 10 7129 1 1 27 TRP N N -6.113 8.032 -3.557 1.00 . A A . 27 TRP N 1 1 10 7130 1 1 27 TRP NE1 N -2.685 9.768 -6.036 1.00 . A A . 27 TRP NE1 1 1 10 7131 1 1 27 TRP O O -8.400 6.299 -5.224 1.00 . A A . 27 TRP O 1 1 10 7132 1 1 28 GLU C C -8.399 4.962 -2.198 1.00 . A A . 28 GLU C 1 1 10 7133 1 1 28 GLU CA C -7.667 4.280 -3.368 1.00 . A A . 28 GLU CA 1 1 10 7134 1 1 28 GLU CB C -6.763 3.085 -3.001 1.00 . A A . 28 GLU CB 1 1 10 7135 1 1 28 GLU CD C -5.126 1.445 -4.112 1.00 . A A . 28 GLU CD 1 1 10 7136 1 1 28 GLU CG C -6.354 2.338 -4.286 1.00 . A A . 28 GLU CG 1 1 10 7137 1 1 28 GLU H H -5.913 5.446 -3.530 1.00 . A A . 28 GLU H 1 1 10 7138 1 1 28 GLU HA H -8.420 3.948 -4.085 1.00 . A A . 28 GLU HA 1 1 10 7139 1 1 28 GLU HB2 H -5.872 3.466 -2.515 1.00 . A A . 28 GLU HB2 1 1 10 7140 1 1 28 GLU HB3 H -7.240 2.395 -2.310 1.00 . A A . 28 GLU HB3 1 1 10 7141 1 1 28 GLU HG2 H -7.192 1.729 -4.629 1.00 . A A . 28 GLU HG2 1 1 10 7142 1 1 28 GLU HG3 H -6.120 3.060 -5.066 1.00 . A A . 28 GLU HG3 1 1 10 7143 1 1 28 GLU N N -6.815 5.296 -3.959 1.00 . A A . 28 GLU N 1 1 10 7144 1 1 28 GLU O O -8.494 6.187 -2.171 1.00 . A A . 28 GLU O 1 1 10 7145 1 1 28 GLU OE1 O -5.277 0.350 -3.322 1.00 . A A . 28 GLU OE1 1 1 10 7146 1 1 28 GLU OE2 O -4.088 1.721 -4.719 1.00 . A A . 28 GLU OE2 1 1 10 7147 1 1 29 LYS C C -9.641 3.575 0.935 1.00 . A A . 29 LYS C 1 1 10 7148 1 1 29 LYS CA C -9.678 4.687 -0.102 1.00 . A A . 29 LYS CA 1 1 10 7149 1 1 29 LYS CB C -11.113 5.049 -0.519 1.00 . A A . 29 LYS CB 1 1 10 7150 1 1 29 LYS CD C -12.129 6.693 -2.148 1.00 . A A . 29 LYS CD 1 1 10 7151 1 1 29 LYS CE C -11.371 6.445 -3.459 1.00 . A A . 29 LYS CE 1 1 10 7152 1 1 29 LYS CG C -11.288 6.533 -0.878 1.00 . A A . 29 LYS CG 1 1 10 7153 1 1 29 LYS H H -8.840 3.223 -1.271 1.00 . A A . 29 LYS H 1 1 10 7154 1 1 29 LYS HA H -9.150 5.532 0.309 1.00 . A A . 29 LYS HA 1 1 10 7155 1 1 29 LYS HB2 H -11.417 4.398 -1.341 1.00 . A A . 29 LYS HB2 1 1 10 7156 1 1 29 LYS HB3 H -11.795 4.860 0.313 1.00 . A A . 29 LYS HB3 1 1 10 7157 1 1 29 LYS HD2 H -12.957 5.982 -2.088 1.00 . A A . 29 LYS HD2 1 1 10 7158 1 1 29 LYS HD3 H -12.538 7.702 -2.159 1.00 . A A . 29 LYS HD3 1 1 10 7159 1 1 29 LYS HE2 H -10.937 5.445 -3.450 1.00 . A A . 29 LYS HE2 1 1 10 7160 1 1 29 LYS HE3 H -12.081 6.497 -4.288 1.00 . A A . 29 LYS HE3 1 1 10 7161 1 1 29 LYS HG2 H -11.828 7.001 -0.052 1.00 . A A . 29 LYS HG2 1 1 10 7162 1 1 29 LYS HG3 H -10.338 7.059 -0.954 1.00 . A A . 29 LYS HG3 1 1 10 7163 1 1 29 LYS HZ1 H -9.550 7.000 -4.254 1.00 . A A . 29 LYS HZ1 1 1 10 7164 1 1 29 LYS HZ2 H -10.690 8.237 -4.223 1.00 . A A . 29 LYS HZ2 1 1 10 7165 1 1 29 LYS N N -8.911 4.212 -1.229 1.00 . A A . 29 LYS N 1 1 10 7166 1 1 29 LYS NZ N -10.304 7.436 -3.703 1.00 . A A . 29 LYS NZ 1 1 10 7167 1 1 29 LYS O O -10.623 2.893 1.219 1.00 . A A . 29 LYS O 1 1 10 7168 1 1 30 ALA C C -8.032 3.335 3.867 1.00 . A A . 30 ALA C 1 1 10 7169 1 1 30 ALA CA C -8.145 2.511 2.579 1.00 . A A . 30 ALA CA 1 1 10 7170 1 1 30 ALA CB C -6.837 1.799 2.242 1.00 . A A . 30 ALA CB 1 1 10 7171 1 1 30 ALA H H -7.674 3.966 1.113 1.00 . A A . 30 ALA H 1 1 10 7172 1 1 30 ALA HA H -8.943 1.779 2.690 1.00 . A A . 30 ALA HA 1 1 10 7173 1 1 30 ALA HB1 H -6.947 1.295 1.281 1.00 . A A . 30 ALA HB1 1 1 10 7174 1 1 30 ALA HB2 H -6.037 2.536 2.182 1.00 . A A . 30 ALA HB2 1 1 10 7175 1 1 30 ALA HB3 H -6.582 1.065 2.994 1.00 . A A . 30 ALA HB3 1 1 10 7176 1 1 30 ALA N N -8.435 3.390 1.468 1.00 . A A . 30 ALA N 1 1 10 7177 1 1 30 ALA O O -8.017 4.564 3.813 1.00 . A A . 30 ALA O 1 1 10 7178 1 1 31 SER C C -6.384 4.181 6.208 1.00 . A A . 31 SER C 1 1 10 7179 1 1 31 SER CA C -7.658 3.350 6.287 1.00 . A A . 31 SER CA 1 1 10 7180 1 1 31 SER CB C -7.536 2.291 7.378 1.00 . A A . 31 SER CB 1 1 10 7181 1 1 31 SER H H -7.830 1.674 5.065 1.00 . A A . 31 SER H 1 1 10 7182 1 1 31 SER HA H -8.476 4.003 6.551 1.00 . A A . 31 SER HA 1 1 10 7183 1 1 31 SER HB2 H -6.788 1.562 7.098 1.00 . A A . 31 SER HB2 1 1 10 7184 1 1 31 SER HB3 H -7.152 2.777 8.257 1.00 . A A . 31 SER HB3 1 1 10 7185 1 1 31 SER HG H -9.148 1.325 6.809 1.00 . A A . 31 SER HG 1 1 10 7186 1 1 31 SER N N -7.913 2.682 5.028 1.00 . A A . 31 SER N 1 1 10 7187 1 1 31 SER O O -6.324 5.305 6.701 1.00 . A A . 31 SER O 1 1 10 7188 1 1 31 SER OG O -8.781 1.659 7.643 1.00 . A A . 31 SER OG 1 1 10 7189 1 1 32 HIS C C -3.167 3.046 4.823 1.00 . A A . 32 HIS C 1 1 10 7190 1 1 32 HIS CA C -3.985 4.091 5.591 1.00 . A A . 32 HIS CA 1 1 10 7191 1 1 32 HIS CB C -3.464 4.403 7.015 1.00 . A A . 32 HIS CB 1 1 10 7192 1 1 32 HIS CD2 C -3.804 2.077 7.987 1.00 . A A . 32 HIS CD2 1 1 10 7193 1 1 32 HIS CE1 C -4.745 2.550 9.874 1.00 . A A . 32 HIS CE1 1 1 10 7194 1 1 32 HIS CG C -3.890 3.426 8.072 1.00 . A A . 32 HIS CG 1 1 10 7195 1 1 32 HIS H H -5.466 2.662 5.221 1.00 . A A . 32 HIS H 1 1 10 7196 1 1 32 HIS HA H -3.988 5.003 4.997 1.00 . A A . 32 HIS HA 1 1 10 7197 1 1 32 HIS HB2 H -2.376 4.444 7.021 1.00 . A A . 32 HIS HB2 1 1 10 7198 1 1 32 HIS HB3 H -3.839 5.370 7.310 1.00 . A A . 32 HIS HB3 1 1 10 7199 1 1 32 HIS HD1 H -4.697 4.660 9.642 1.00 . A A . 32 HIS HD1 1 1 10 7200 1 1 32 HIS HD2 H -3.444 1.626 7.097 1.00 . A A . 32 HIS HD2 1 1 10 7201 1 1 32 HIS HE1 H -5.234 2.412 10.822 1.00 . A A . 32 HIS HE1 1 1 10 7202 1 1 32 HIS N N -5.340 3.576 5.643 1.00 . A A . 32 HIS N 1 1 10 7203 1 1 32 HIS ND1 N -4.481 3.736 9.287 1.00 . A A . 32 HIS ND1 1 1 10 7204 1 1 32 HIS NE2 N -4.328 1.515 9.127 1.00 . A A . 32 HIS NE2 1 1 10 7205 1 1 32 HIS O O -3.698 1.977 4.502 1.00 . A A . 32 HIS O 1 1 10 7206 1 1 33 GLY C C 0.377 2.498 4.010 1.00 . A A . 33 GLY C 1 1 10 7207 1 1 33 GLY CA C -1.094 2.508 3.631 1.00 . A A . 33 GLY CA 1 1 10 7208 1 1 33 GLY H H -1.512 4.222 4.833 1.00 . A A . 33 GLY H 1 1 10 7209 1 1 33 GLY HA2 H -1.442 1.498 3.659 1.00 . A A . 33 GLY HA2 1 1 10 7210 1 1 33 GLY HA3 H -1.191 2.842 2.608 1.00 . A A . 33 GLY HA3 1 1 10 7211 1 1 33 GLY N N -1.906 3.343 4.510 1.00 . A A . 33 GLY N 1 1 10 7212 1 1 33 GLY O O 0.820 3.375 4.744 1.00 . A A . 33 GLY O 1 1 10 7213 1 1 34 ALA C C 3.226 0.486 2.698 1.00 . A A . 34 ALA C 1 1 10 7214 1 1 34 ALA CA C 2.578 1.473 3.679 1.00 . A A . 34 ALA CA 1 1 10 7215 1 1 34 ALA CB C 2.914 1.138 5.141 1.00 . A A . 34 ALA CB 1 1 10 7216 1 1 34 ALA H H 0.722 0.812 2.897 1.00 . A A . 34 ALA H 1 1 10 7217 1 1 34 ALA HA H 2.963 2.466 3.449 1.00 . A A . 34 ALA HA 1 1 10 7218 1 1 34 ALA HB1 H 2.404 0.228 5.442 1.00 . A A . 34 ALA HB1 1 1 10 7219 1 1 34 ALA HB2 H 3.986 1.004 5.265 1.00 . A A . 34 ALA HB2 1 1 10 7220 1 1 34 ALA HB3 H 2.591 1.943 5.800 1.00 . A A . 34 ALA HB3 1 1 10 7221 1 1 34 ALA N N 1.133 1.514 3.505 1.00 . A A . 34 ALA N 1 1 10 7222 1 1 34 ALA O O 2.527 -0.311 2.060 1.00 . A A . 34 ALA O 1 1 10 7223 1 1 35 CYS C C 5.478 -1.724 2.591 1.00 . A A . 35 CYS C 1 1 10 7224 1 1 35 CYS CA C 5.365 -0.396 1.824 1.00 . A A . 35 CYS CA 1 1 10 7225 1 1 35 CYS CB C 6.781 0.168 1.664 1.00 . A A . 35 CYS CB 1 1 10 7226 1 1 35 CYS H H 5.071 1.258 3.094 1.00 . A A . 35 CYS H 1 1 10 7227 1 1 35 CYS HA H 4.926 -0.537 0.839 1.00 . A A . 35 CYS HA 1 1 10 7228 1 1 35 CYS HB2 H 7.208 0.339 2.653 1.00 . A A . 35 CYS HB2 1 1 10 7229 1 1 35 CYS HB3 H 7.365 -0.604 1.190 1.00 . A A . 35 CYS HB3 1 1 10 7230 1 1 35 CYS N N 4.557 0.545 2.583 1.00 . A A . 35 CYS N 1 1 10 7231 1 1 35 CYS O O 5.501 -1.715 3.821 1.00 . A A . 35 CYS O 1 1 10 7232 1 1 35 CYS SG S 7.080 1.661 0.681 1.00 . A A . 35 CYS SG 1 1 10 7233 1 1 36 HIS C C 6.612 -5.035 1.463 1.00 . A A . 36 HIS C 1 1 10 7234 1 1 36 HIS CA C 5.918 -4.168 2.505 1.00 . A A . 36 HIS CA 1 1 10 7235 1 1 36 HIS CB C 4.675 -4.930 2.996 1.00 . A A . 36 HIS CB 1 1 10 7236 1 1 36 HIS CD2 C 2.617 -3.507 2.413 1.00 . A A . 36 HIS CD2 1 1 10 7237 1 1 36 HIS CE1 C 2.308 -2.584 4.365 1.00 . A A . 36 HIS CE1 1 1 10 7238 1 1 36 HIS CG C 3.525 -4.024 3.296 1.00 . A A . 36 HIS CG 1 1 10 7239 1 1 36 HIS H H 5.424 -2.850 0.895 1.00 . A A . 36 HIS H 1 1 10 7240 1 1 36 HIS HA H 6.591 -4.008 3.350 1.00 . A A . 36 HIS HA 1 1 10 7241 1 1 36 HIS HB2 H 4.337 -5.616 2.218 1.00 . A A . 36 HIS HB2 1 1 10 7242 1 1 36 HIS HB3 H 4.936 -5.523 3.875 1.00 . A A . 36 HIS HB3 1 1 10 7243 1 1 36 HIS HD1 H 3.838 -3.605 5.385 1.00 . A A . 36 HIS HD1 1 1 10 7244 1 1 36 HIS HD2 H 2.621 -3.703 1.338 1.00 . A A . 36 HIS HD2 1 1 10 7245 1 1 36 HIS HE1 H 1.965 -1.909 5.128 1.00 . A A . 36 HIS HE1 1 1 10 7246 1 1 36 HIS N N 5.582 -2.869 1.900 1.00 . A A . 36 HIS N 1 1 10 7247 1 1 36 HIS ND1 N 3.287 -3.479 4.545 1.00 . A A . 36 HIS ND1 1 1 10 7248 1 1 36 HIS NE2 N 1.832 -2.605 3.113 1.00 . A A . 36 HIS NE2 1 1 10 7249 1 1 36 HIS O O 6.222 -4.984 0.298 1.00 . A A . 36 HIS O 1 1 10 7250 1 1 37 LYS C C 7.530 -7.974 0.635 1.00 . A A . 37 LYS C 1 1 10 7251 1 1 37 LYS CA C 8.311 -6.694 0.929 1.00 . A A . 37 LYS CA 1 1 10 7252 1 1 37 LYS CB C 9.728 -6.969 1.438 1.00 . A A . 37 LYS CB 1 1 10 7253 1 1 37 LYS CD C 11.888 -8.253 0.879 1.00 . A A . 37 LYS CD 1 1 10 7254 1 1 37 LYS CE C 13.142 -7.381 0.693 1.00 . A A . 37 LYS CE 1 1 10 7255 1 1 37 LYS CG C 10.609 -7.583 0.339 1.00 . A A . 37 LYS CG 1 1 10 7256 1 1 37 LYS H H 7.833 -5.900 2.845 1.00 . A A . 37 LYS H 1 1 10 7257 1 1 37 LYS HA H 8.449 -6.147 0.009 1.00 . A A . 37 LYS HA 1 1 10 7258 1 1 37 LYS HB2 H 10.169 -6.035 1.726 1.00 . A A . 37 LYS HB2 1 1 10 7259 1 1 37 LYS HB3 H 9.682 -7.585 2.324 1.00 . A A . 37 LYS HB3 1 1 10 7260 1 1 37 LYS HD2 H 11.764 -8.499 1.936 1.00 . A A . 37 LYS HD2 1 1 10 7261 1 1 37 LYS HD3 H 12.016 -9.200 0.357 1.00 . A A . 37 LYS HD3 1 1 10 7262 1 1 37 LYS HE2 H 13.032 -6.730 -0.174 1.00 . A A . 37 LYS HE2 1 1 10 7263 1 1 37 LYS HE3 H 13.251 -6.767 1.586 1.00 . A A . 37 LYS HE3 1 1 10 7264 1 1 37 LYS HG2 H 10.022 -8.345 -0.146 1.00 . A A . 37 LYS HG2 1 1 10 7265 1 1 37 LYS HG3 H 10.819 -6.842 -0.435 1.00 . A A . 37 LYS HG3 1 1 10 7266 1 1 37 LYS HZ1 H 14.127 -9.175 0.396 1.00 . A A . 37 LYS HZ1 1 1 10 7267 1 1 37 LYS HZ2 H 14.840 -7.865 -0.382 1.00 . A A . 37 LYS HZ2 1 1 10 7268 1 1 37 LYS N N 7.576 -5.863 1.869 1.00 . A A . 37 LYS N 1 1 10 7269 1 1 37 LYS NZ N 14.373 -8.178 0.481 1.00 . A A . 37 LYS NZ 1 1 10 7270 1 1 37 LYS O O 7.075 -8.667 1.543 1.00 . A A . 37 LYS O 1 1 10 7271 1 1 38 ARG C C 7.536 -9.836 -2.439 1.00 . A A . 38 ARG C 1 1 10 7272 1 1 38 ARG CA C 6.699 -9.405 -1.232 1.00 . A A . 38 ARG CA 1 1 10 7273 1 1 38 ARG CB C 5.318 -8.952 -1.716 1.00 . A A . 38 ARG CB 1 1 10 7274 1 1 38 ARG CD C 3.943 -9.534 0.353 1.00 . A A . 38 ARG CD 1 1 10 7275 1 1 38 ARG CG C 4.368 -8.433 -0.624 1.00 . A A . 38 ARG CG 1 1 10 7276 1 1 38 ARG CZ C 2.221 -9.847 2.131 1.00 . A A . 38 ARG CZ 1 1 10 7277 1 1 38 ARG H H 7.757 -7.606 -1.334 1.00 . A A . 38 ARG H 1 1 10 7278 1 1 38 ARG HA H 6.617 -10.222 -0.515 1.00 . A A . 38 ARG HA 1 1 10 7279 1 1 38 ARG HB2 H 5.479 -8.142 -2.429 1.00 . A A . 38 ARG HB2 1 1 10 7280 1 1 38 ARG HB3 H 4.852 -9.785 -2.237 1.00 . A A . 38 ARG HB3 1 1 10 7281 1 1 38 ARG HD2 H 3.596 -10.391 -0.226 1.00 . A A . 38 ARG HD2 1 1 10 7282 1 1 38 ARG HD3 H 4.806 -9.825 0.955 1.00 . A A . 38 ARG HD3 1 1 10 7283 1 1 38 ARG HG2 H 4.831 -7.606 -0.083 1.00 . A A . 38 ARG HG2 1 1 10 7284 1 1 38 ARG HG3 H 3.481 -8.049 -1.128 1.00 . A A . 38 ARG HG3 1 1 10 7285 1 1 38 ARG HH11 H 3.329 -11.496 1.704 1.00 . A A . 38 ARG HH11 1 1 10 7286 1 1 38 ARG HH12 H 2.111 -11.749 2.913 1.00 . A A . 38 ARG HH12 1 1 10 7287 1 1 38 ARG HH21 H 0.987 -8.360 2.837 1.00 . A A . 38 ARG HH21 1 1 10 7288 1 1 38 ARG HH22 H 0.723 -9.924 3.529 1.00 . A A . 38 ARG HH22 1 1 10 7289 1 1 38 ARG N N 7.382 -8.263 -0.657 1.00 . A A . 38 ARG N 1 1 10 7290 1 1 38 ARG NE N 2.862 -9.068 1.242 1.00 . A A . 38 ARG NE 1 1 10 7291 1 1 38 ARG NH1 N 2.572 -11.132 2.261 1.00 . A A . 38 ARG NH1 1 1 10 7292 1 1 38 ARG NH2 N 1.236 -9.346 2.881 1.00 . A A . 38 ARG NH2 1 1 10 7293 1 1 38 ARG O O 7.852 -8.992 -3.275 1.00 . A A . 38 ARG O 1 1 10 7294 1 1 39 GLU C C 9.928 -10.696 -3.907 1.00 . A A . 39 GLU C 1 1 10 7295 1 1 39 GLU CA C 8.747 -11.635 -3.623 1.00 . A A . 39 GLU CA 1 1 10 7296 1 1 39 GLU CB C 7.882 -11.904 -4.866 1.00 . A A . 39 GLU CB 1 1 10 7297 1 1 39 GLU CD C 5.576 -12.389 -3.860 1.00 . A A . 39 GLU CD 1 1 10 7298 1 1 39 GLU CG C 6.781 -12.948 -4.611 1.00 . A A . 39 GLU CG 1 1 10 7299 1 1 39 GLU H H 7.508 -11.780 -1.897 1.00 . A A . 39 GLU H 1 1 10 7300 1 1 39 GLU HA H 9.168 -12.590 -3.301 1.00 . A A . 39 GLU HA 1 1 10 7301 1 1 39 GLU HB2 H 7.438 -10.973 -5.227 1.00 . A A . 39 GLU HB2 1 1 10 7302 1 1 39 GLU HB3 H 8.538 -12.293 -5.648 1.00 . A A . 39 GLU HB3 1 1 10 7303 1 1 39 GLU HG2 H 6.427 -13.316 -5.574 1.00 . A A . 39 GLU HG2 1 1 10 7304 1 1 39 GLU HG3 H 7.194 -13.793 -4.060 1.00 . A A . 39 GLU HG3 1 1 10 7305 1 1 39 GLU N N 7.921 -11.111 -2.535 1.00 . A A . 39 GLU N 1 1 10 7306 1 1 39 GLU O O 10.119 -10.214 -5.021 1.00 . A A . 39 GLU O 1 1 10 7307 1 1 39 GLU OE1 O 4.615 -11.804 -4.622 1.00 . A A . 39 GLU OE1 1 1 10 7308 1 1 39 GLU OE2 O 5.526 -12.473 -2.633 1.00 . A A . 39 GLU OE2 1 1 10 7309 1 1 40 ASN C C 11.452 -7.988 -3.011 1.00 . A A . 40 ASN C 1 1 10 7310 1 1 40 ASN CA C 11.798 -9.464 -2.764 1.00 . A A . 40 ASN CA 1 1 10 7311 1 1 40 ASN CB C 12.938 -9.930 -3.667 1.00 . A A . 40 ASN CB 1 1 10 7312 1 1 40 ASN CG C 14.237 -9.192 -3.345 1.00 . A A . 40 ASN CG 1 1 10 7313 1 1 40 ASN H H 10.447 -10.871 -1.997 1.00 . A A . 40 ASN H 1 1 10 7314 1 1 40 ASN HA H 12.159 -9.538 -1.745 1.00 . A A . 40 ASN HA 1 1 10 7315 1 1 40 ASN HB2 H 13.109 -10.996 -3.532 1.00 . A A . 40 ASN HB2 1 1 10 7316 1 1 40 ASN HB3 H 12.619 -9.760 -4.692 1.00 . A A . 40 ASN HB3 1 1 10 7317 1 1 40 ASN HD21 H 14.742 -9.036 -5.312 1.00 . A A . 40 ASN HD21 1 1 10 7318 1 1 40 ASN HD22 H 15.869 -8.335 -4.171 1.00 . A A . 40 ASN HD22 1 1 10 7319 1 1 40 ASN N N 10.671 -10.385 -2.841 1.00 . A A . 40 ASN N 1 1 10 7320 1 1 40 ASN ND2 N 15.002 -8.814 -4.364 1.00 . A A . 40 ASN ND2 1 1 10 7321 1 1 40 ASN O O 12.251 -7.114 -2.684 1.00 . A A . 40 ASN O 1 1 10 7322 1 1 40 ASN OD1 O 14.557 -8.968 -2.176 1.00 . A A . 40 ASN OD1 1 1 10 7323 1 1 41 HIS C C 9.027 -5.693 -2.917 1.00 . A A . 41 HIS C 1 1 10 7324 1 1 41 HIS CA C 9.881 -6.352 -3.980 1.00 . A A . 41 HIS CA 1 1 10 7325 1 1 41 HIS CB C 9.123 -6.421 -5.304 1.00 . A A . 41 HIS CB 1 1 10 7326 1 1 41 HIS CD2 C 10.167 -7.895 -7.183 1.00 . A A . 41 HIS CD2 1 1 10 7327 1 1 41 HIS CE1 C 11.796 -6.544 -7.733 1.00 . A A . 41 HIS CE1 1 1 10 7328 1 1 41 HIS CG C 10.065 -6.754 -6.429 1.00 . A A . 41 HIS CG 1 1 10 7329 1 1 41 HIS H H 9.578 -8.414 -3.656 1.00 . A A . 41 HIS H 1 1 10 7330 1 1 41 HIS HA H 10.767 -5.744 -4.142 1.00 . A A . 41 HIS HA 1 1 10 7331 1 1 41 HIS HB2 H 8.334 -7.166 -5.218 1.00 . A A . 41 HIS HB2 1 1 10 7332 1 1 41 HIS HB3 H 8.656 -5.454 -5.501 1.00 . A A . 41 HIS HB3 1 1 10 7333 1 1 41 HIS HD1 H 11.219 -4.943 -6.447 1.00 . A A . 41 HIS HD1 1 1 10 7334 1 1 41 HIS HD2 H 9.550 -8.778 -7.089 1.00 . A A . 41 HIS HD2 1 1 10 7335 1 1 41 HIS HE1 H 12.698 -6.160 -8.187 1.00 . A A . 41 HIS HE1 1 1 10 7336 1 1 41 HIS N N 10.274 -7.684 -3.559 1.00 . A A . 41 HIS N 1 1 10 7337 1 1 41 HIS ND1 N 11.062 -5.878 -6.825 1.00 . A A . 41 HIS ND1 1 1 10 7338 1 1 41 HIS NE2 N 11.273 -7.755 -8.000 1.00 . A A . 41 HIS NE2 1 1 10 7339 1 1 41 HIS O O 8.022 -6.247 -2.484 1.00 . A A . 41 HIS O 1 1 10 7340 1 1 42 TRP C C 7.405 -3.167 -2.454 1.00 . A A . 42 TRP C 1 1 10 7341 1 1 42 TRP CA C 8.587 -3.680 -1.647 1.00 . A A . 42 TRP CA 1 1 10 7342 1 1 42 TRP CB C 9.454 -2.598 -1.014 1.00 . A A . 42 TRP CB 1 1 10 7343 1 1 42 TRP CD1 C 11.520 -3.813 -0.220 1.00 . A A . 42 TRP CD1 1 1 10 7344 1 1 42 TRP CD2 C 10.188 -3.208 1.469 1.00 . A A . 42 TRP CD2 1 1 10 7345 1 1 42 TRP CE2 C 11.290 -3.904 2.038 1.00 . A A . 42 TRP CE2 1 1 10 7346 1 1 42 TRP CE3 C 9.143 -2.855 2.340 1.00 . A A . 42 TRP CE3 1 1 10 7347 1 1 42 TRP CG C 10.369 -3.161 0.026 1.00 . A A . 42 TRP CG 1 1 10 7348 1 1 42 TRP CH2 C 10.309 -3.821 4.248 1.00 . A A . 42 TRP CH2 1 1 10 7349 1 1 42 TRP CZ2 C 11.341 -4.247 3.396 1.00 . A A . 42 TRP CZ2 1 1 10 7350 1 1 42 TRP CZ3 C 9.224 -3.099 3.721 1.00 . A A . 42 TRP CZ3 1 1 10 7351 1 1 42 TRP H H 10.203 -4.054 -2.962 1.00 . A A . 42 TRP H 1 1 10 7352 1 1 42 TRP HA H 8.205 -4.273 -0.832 1.00 . A A . 42 TRP HA 1 1 10 7353 1 1 42 TRP HB2 H 10.035 -2.079 -1.772 1.00 . A A . 42 TRP HB2 1 1 10 7354 1 1 42 TRP HB3 H 8.820 -1.866 -0.533 1.00 . A A . 42 TRP HB3 1 1 10 7355 1 1 42 TRP HD1 H 11.885 -4.036 -1.207 1.00 . A A . 42 TRP HD1 1 1 10 7356 1 1 42 TRP HE1 H 12.921 -4.784 1.063 1.00 . A A . 42 TRP HE1 1 1 10 7357 1 1 42 TRP HE3 H 8.243 -2.453 1.928 1.00 . A A . 42 TRP HE3 1 1 10 7358 1 1 42 TRP HH2 H 10.317 -4.079 5.296 1.00 . A A . 42 TRP HH2 1 1 10 7359 1 1 42 TRP HZ2 H 12.113 -4.917 3.738 1.00 . A A . 42 TRP HZ2 1 1 10 7360 1 1 42 TRP HZ3 H 8.421 -2.764 4.361 1.00 . A A . 42 TRP HZ3 1 1 10 7361 1 1 42 TRP N N 9.410 -4.489 -2.516 1.00 . A A . 42 TRP N 1 1 10 7362 1 1 42 TRP NE1 N 12.082 -4.239 0.963 1.00 . A A . 42 TRP NE1 1 1 10 7363 1 1 42 TRP O O 7.612 -2.624 -3.531 1.00 . A A . 42 TRP O 1 1 10 7364 1 1 43 LYS C C 4.174 -2.099 -1.620 1.00 . A A . 43 LYS C 1 1 10 7365 1 1 43 LYS CA C 4.954 -2.930 -2.625 1.00 . A A . 43 LYS CA 1 1 10 7366 1 1 43 LYS CB C 4.101 -4.133 -3.020 1.00 . A A . 43 LYS CB 1 1 10 7367 1 1 43 LYS CD C 5.473 -4.843 -5.095 1.00 . A A . 43 LYS CD 1 1 10 7368 1 1 43 LYS CE C 4.440 -4.745 -6.238 1.00 . A A . 43 LYS CE 1 1 10 7369 1 1 43 LYS CG C 4.915 -5.222 -3.710 1.00 . A A . 43 LYS CG 1 1 10 7370 1 1 43 LYS H H 6.042 -4.076 -1.253 1.00 . A A . 43 LYS H 1 1 10 7371 1 1 43 LYS HA H 5.174 -2.335 -3.512 1.00 . A A . 43 LYS HA 1 1 10 7372 1 1 43 LYS HB2 H 3.714 -4.575 -2.102 1.00 . A A . 43 LYS HB2 1 1 10 7373 1 1 43 LYS HB3 H 3.265 -3.808 -3.637 1.00 . A A . 43 LYS HB3 1 1 10 7374 1 1 43 LYS HD2 H 6.069 -3.933 -5.040 1.00 . A A . 43 LYS HD2 1 1 10 7375 1 1 43 LYS HD3 H 6.153 -5.653 -5.363 1.00 . A A . 43 LYS HD3 1 1 10 7376 1 1 43 LYS HE2 H 4.990 -4.863 -7.174 1.00 . A A . 43 LYS HE2 1 1 10 7377 1 1 43 LYS HE3 H 3.717 -5.559 -6.169 1.00 . A A . 43 LYS HE3 1 1 10 7378 1 1 43 LYS HG2 H 5.705 -5.504 -3.015 1.00 . A A . 43 LYS HG2 1 1 10 7379 1 1 43 LYS HG3 H 4.323 -6.119 -3.778 1.00 . A A . 43 LYS HG3 1 1 10 7380 1 1 43 LYS HZ1 H 4.022 -2.952 -7.182 1.00 . A A . 43 LYS HZ1 1 1 10 7381 1 1 43 LYS HZ2 H 2.716 -3.608 -6.351 1.00 . A A . 43 LYS HZ2 1 1 10 7382 1 1 43 LYS N N 6.175 -3.396 -1.995 1.00 . A A . 43 LYS N 1 1 10 7383 1 1 43 LYS NZ N 3.733 -3.445 -6.325 1.00 . A A . 43 LYS NZ 1 1 10 7384 1 1 43 LYS O O 4.109 -2.447 -0.440 1.00 . A A . 43 LYS O 1 1 10 7385 1 1 44 CYS C C 1.306 -1.007 -1.233 1.00 . A A . 44 CYS C 1 1 10 7386 1 1 44 CYS CA C 2.614 -0.230 -1.349 1.00 . A A . 44 CYS CA 1 1 10 7387 1 1 44 CYS CB C 2.389 1.080 -2.101 1.00 . A A . 44 CYS CB 1 1 10 7388 1 1 44 CYS H H 3.667 -0.803 -3.083 1.00 . A A . 44 CYS H 1 1 10 7389 1 1 44 CYS HA H 3.017 -0.008 -0.364 1.00 . A A . 44 CYS HA 1 1 10 7390 1 1 44 CYS HB2 H 3.305 1.667 -2.070 1.00 . A A . 44 CYS HB2 1 1 10 7391 1 1 44 CYS HB3 H 2.134 0.864 -3.135 1.00 . A A . 44 CYS HB3 1 1 10 7392 1 1 44 CYS N N 3.560 -1.025 -2.107 1.00 . A A . 44 CYS N 1 1 10 7393 1 1 44 CYS O O 0.540 -1.009 -2.190 1.00 . A A . 44 CYS O 1 1 10 7394 1 1 44 CYS SG S 1.055 2.083 -1.433 1.00 . A A . 44 CYS SG 1 1 10 7395 1 1 45 PHE C C -0.982 -1.559 1.119 1.00 . A A . 45 PHE C 1 1 10 7396 1 1 45 PHE CA C -0.220 -2.377 0.087 1.00 . A A . 45 PHE CA 1 1 10 7397 1 1 45 PHE CB C -0.086 -3.818 0.586 1.00 . A A . 45 PHE CB 1 1 10 7398 1 1 45 PHE CD1 C 1.008 -4.634 -1.587 1.00 . A A . 45 PHE CD1 1 1 10 7399 1 1 45 PHE CD2 C 0.243 -6.251 0.056 1.00 . A A . 45 PHE CD2 1 1 10 7400 1 1 45 PHE CE1 C 1.279 -5.684 -2.483 1.00 . A A . 45 PHE CE1 1 1 10 7401 1 1 45 PHE CE2 C 0.556 -7.301 -0.818 1.00 . A A . 45 PHE CE2 1 1 10 7402 1 1 45 PHE CG C 0.429 -4.912 -0.335 1.00 . A A . 45 PHE CG 1 1 10 7403 1 1 45 PHE CZ C 1.065 -7.017 -2.094 1.00 . A A . 45 PHE CZ 1 1 10 7404 1 1 45 PHE H H 1.644 -1.592 0.692 1.00 . A A . 45 PHE H 1 1 10 7405 1 1 45 PHE HA H -0.807 -2.414 -0.832 1.00 . A A . 45 PHE HA 1 1 10 7406 1 1 45 PHE HB2 H 0.379 -3.888 1.553 1.00 . A A . 45 PHE HB2 1 1 10 7407 1 1 45 PHE HB3 H -1.104 -4.071 0.800 1.00 . A A . 45 PHE HB3 1 1 10 7408 1 1 45 PHE HD1 H 1.171 -3.620 -1.912 1.00 . A A . 45 PHE HD1 1 1 10 7409 1 1 45 PHE HD2 H -0.226 -6.484 0.999 1.00 . A A . 45 PHE HD2 1 1 10 7410 1 1 45 PHE HE1 H 1.632 -5.475 -3.482 1.00 . A A . 45 PHE HE1 1 1 10 7411 1 1 45 PHE HE2 H 0.352 -8.325 -0.537 1.00 . A A . 45 PHE HE2 1 1 10 7412 1 1 45 PHE HZ H 1.266 -7.821 -2.787 1.00 . A A . 45 PHE HZ 1 1 10 7413 1 1 45 PHE N N 1.059 -1.714 -0.123 1.00 . A A . 45 PHE N 1 1 10 7414 1 1 45 PHE O O -0.374 -1.074 2.081 1.00 . A A . 45 PHE O 1 1 10 7415 1 1 46 CYS C C -4.012 -1.337 2.620 1.00 . A A . 46 CYS C 1 1 10 7416 1 1 46 CYS CA C -3.176 -0.543 1.628 1.00 . A A . 46 CYS CA 1 1 10 7417 1 1 46 CYS CB C -4.127 0.126 0.639 1.00 . A A . 46 CYS CB 1 1 10 7418 1 1 46 CYS H H -2.710 -2.013 0.183 1.00 . A A . 46 CYS H 1 1 10 7419 1 1 46 CYS HA H -2.599 0.226 2.142 1.00 . A A . 46 CYS HA 1 1 10 7420 1 1 46 CYS HB2 H -4.838 -0.620 0.304 1.00 . A A . 46 CYS HB2 1 1 10 7421 1 1 46 CYS HB3 H -4.675 0.884 1.183 1.00 . A A . 46 CYS HB3 1 1 10 7422 1 1 46 CYS N N -2.291 -1.443 0.913 1.00 . A A . 46 CYS N 1 1 10 7423 1 1 46 CYS O O -4.435 -2.447 2.307 1.00 . A A . 46 CYS O 1 1 10 7424 1 1 46 CYS SG S -3.412 0.922 -0.817 1.00 . A A . 46 CYS SG 1 1 10 7425 1 1 47 TYR C C -6.466 -0.917 4.813 1.00 . A A . 47 TYR C 1 1 10 7426 1 1 47 TYR CA C -5.039 -1.428 4.850 1.00 . A A . 47 TYR CA 1 1 10 7427 1 1 47 TYR CB C -4.411 -1.095 6.201 1.00 . A A . 47 TYR CB 1 1 10 7428 1 1 47 TYR CD1 C -2.802 -2.936 6.769 1.00 . A A . 47 TYR CD1 1 1 10 7429 1 1 47 TYR CD2 C -1.895 -0.799 6.031 1.00 . A A . 47 TYR CD2 1 1 10 7430 1 1 47 TYR CE1 C -1.500 -3.425 6.959 1.00 . A A . 47 TYR CE1 1 1 10 7431 1 1 47 TYR CE2 C -0.595 -1.294 6.212 1.00 . A A . 47 TYR CE2 1 1 10 7432 1 1 47 TYR CG C -3.000 -1.612 6.337 1.00 . A A . 47 TYR CG 1 1 10 7433 1 1 47 TYR CZ C -0.398 -2.599 6.692 1.00 . A A . 47 TYR CZ 1 1 10 7434 1 1 47 TYR H H -4.010 0.201 3.925 1.00 . A A . 47 TYR H 1 1 10 7435 1 1 47 TYR HA H -5.040 -2.509 4.718 1.00 . A A . 47 TYR HA 1 1 10 7436 1 1 47 TYR HB2 H -4.429 -0.019 6.329 1.00 . A A . 47 TYR HB2 1 1 10 7437 1 1 47 TYR HB3 H -5.024 -1.507 7.004 1.00 . A A . 47 TYR HB3 1 1 10 7438 1 1 47 TYR HD1 H -3.647 -3.580 6.965 1.00 . A A . 47 TYR HD1 1 1 10 7439 1 1 47 TYR HD2 H -2.038 0.206 5.671 1.00 . A A . 47 TYR HD2 1 1 10 7440 1 1 47 TYR HE1 H -1.360 -4.432 7.325 1.00 . A A . 47 TYR HE1 1 1 10 7441 1 1 47 TYR HE2 H 0.246 -0.640 6.034 1.00 . A A . 47 TYR HE2 1 1 10 7442 1 1 47 TYR HH H 0.850 -3.899 7.402 1.00 . A A . 47 TYR HH 1 1 10 7443 1 1 47 TYR N N -4.282 -0.768 3.793 1.00 . A A . 47 TYR N 1 1 10 7444 1 1 47 TYR O O -6.716 0.207 5.235 1.00 . A A . 47 TYR O 1 1 10 7445 1 1 47 TYR OH O 0.863 -3.066 6.923 1.00 . A A . 47 TYR OH 1 1 10 7446 1 1 48 PHE C C -9.555 -1.170 5.312 1.00 . A A . 48 PHE C 1 1 10 7447 1 1 48 PHE CA C -8.724 -1.173 4.041 1.00 . A A . 48 PHE CA 1 1 10 7448 1 1 48 PHE CB C -9.346 -1.987 2.914 1.00 . A A . 48 PHE CB 1 1 10 7449 1 1 48 PHE CD1 C -7.737 -1.891 0.961 1.00 . A A . 48 PHE CD1 1 1 10 7450 1 1 48 PHE CD2 C -9.784 -0.572 0.864 1.00 . A A . 48 PHE CD2 1 1 10 7451 1 1 48 PHE CE1 C -7.398 -1.458 -0.331 1.00 . A A . 48 PHE CE1 1 1 10 7452 1 1 48 PHE CE2 C -9.426 -0.110 -0.412 1.00 . A A . 48 PHE CE2 1 1 10 7453 1 1 48 PHE CG C -8.951 -1.480 1.545 1.00 . A A . 48 PHE CG 1 1 10 7454 1 1 48 PHE CZ C -8.238 -0.560 -1.012 1.00 . A A . 48 PHE CZ 1 1 10 7455 1 1 48 PHE H H -7.229 -2.664 4.035 1.00 . A A . 48 PHE H 1 1 10 7456 1 1 48 PHE HA H -8.656 -0.142 3.701 1.00 . A A . 48 PHE HA 1 1 10 7457 1 1 48 PHE HB2 H -9.074 -3.041 3.011 1.00 . A A . 48 PHE HB2 1 1 10 7458 1 1 48 PHE HB3 H -10.419 -1.925 3.028 1.00 . A A . 48 PHE HB3 1 1 10 7459 1 1 48 PHE HD1 H -7.060 -2.529 1.511 1.00 . A A . 48 PHE HD1 1 1 10 7460 1 1 48 PHE HD2 H -10.679 -0.182 1.333 1.00 . A A . 48 PHE HD2 1 1 10 7461 1 1 48 PHE HE1 H -6.488 -1.807 -0.801 1.00 . A A . 48 PHE HE1 1 1 10 7462 1 1 48 PHE HE2 H -10.056 0.608 -0.918 1.00 . A A . 48 PHE HE2 1 1 10 7463 1 1 48 PHE HZ H -7.971 -0.208 -1.998 1.00 . A A . 48 PHE HZ 1 1 10 7464 1 1 48 PHE N N -7.411 -1.704 4.310 1.00 . A A . 48 PHE N 1 1 10 7465 1 1 48 PHE O O -9.813 -0.126 5.902 1.00 . A A . 48 PHE O 1 1 10 7466 1 1 49 ASN C C -10.476 -2.443 8.162 1.00 . A A . 49 ASN C 1 1 10 7467 1 1 49 ASN CA C -11.010 -2.575 6.726 1.00 . A A . 49 ASN CA 1 1 10 7468 1 1 49 ASN CB C -11.636 -3.950 6.426 1.00 . A A . 49 ASN CB 1 1 10 7469 1 1 49 ASN CG C -12.238 -4.005 5.020 1.00 . A A . 49 ASN CG 1 1 10 7470 1 1 49 ASN H H -9.632 -3.162 5.236 1.00 . A A . 49 ASN H 1 1 10 7471 1 1 49 ASN HA H -11.783 -1.815 6.591 1.00 . A A . 49 ASN HA 1 1 10 7472 1 1 49 ASN HB2 H -10.869 -4.722 6.476 1.00 . A A . 49 ASN HB2 1 1 10 7473 1 1 49 ASN HB3 H -12.406 -4.189 7.159 1.00 . A A . 49 ASN HB3 1 1 10 7474 1 1 49 ASN HD21 H -14.137 -3.775 5.721 1.00 . A A . 49 ASN HD21 1 1 10 7475 1 1 49 ASN HD22 H -13.969 -3.928 3.987 1.00 . A A . 49 ASN HD22 1 1 10 7476 1 1 49 ASN N N -9.946 -2.361 5.756 1.00 . A A . 49 ASN N 1 1 10 7477 1 1 49 ASN ND2 N -13.556 -3.888 4.906 1.00 . A A . 49 ASN ND2 1 1 10 7478 1 1 49 ASN O O -10.906 -3.159 9.067 1.00 . A A . 49 ASN O 1 1 10 7479 1 1 49 ASN OD1 O -11.511 -4.142 4.035 1.00 . A A . 49 ASN OD1 1 1 10 7480 1 1 50 CYS C C -9.577 -0.385 10.532 1.00 . A A . 50 CYS C 1 1 10 7481 1 1 50 CYS CA C -8.800 -1.323 9.615 1.00 . A A . 50 CYS CA 1 1 10 7482 1 1 50 CYS CB C -7.395 -0.790 9.347 1.00 . A A . 50 CYS CB 1 1 10 7483 1 1 50 CYS H H -9.288 -0.939 7.569 1.00 . A A . 50 CYS H 1 1 10 7484 1 1 50 CYS HA H -8.670 -2.271 10.120 1.00 . A A . 50 CYS HA 1 1 10 7485 1 1 50 CYS HB2 H -6.952 -1.283 8.486 1.00 . A A . 50 CYS HB2 1 1 10 7486 1 1 50 CYS HB3 H -7.488 0.253 9.115 1.00 . A A . 50 CYS HB3 1 1 10 7487 1 1 50 CYS N N -9.516 -1.528 8.358 1.00 . A A . 50 CYS N 1 1 10 7488 1 1 50 CYS O O -9.911 -0.794 11.687 1.00 . A A . 50 CYS O 1 1 10 7489 1 1 50 CYS OXT O -9.887 0.785 10.146 1.00 . A A . 50 CYS OXT 1 1 10 7490 1 1 50 CYS SG S -6.211 -0.857 10.711 1.00 . A A . 50 CYS SG 1 1 11 7491 1 1 1 LEU C C -9.448 -4.139 9.266 1.00 . A A . 1 LEU C 1 1 11 7492 1 1 1 LEU CA C -10.263 -4.618 10.471 1.00 . A A . 1 LEU CA 1 1 11 7493 1 1 1 LEU CB C -11.127 -5.830 10.095 1.00 . A A . 1 LEU CB 1 1 11 7494 1 1 1 LEU CD1 C -9.287 -7.556 10.482 1.00 . A A . 1 LEU CD1 1 1 11 7495 1 1 1 LEU CD2 C -11.311 -8.132 9.135 1.00 . A A . 1 LEU CD2 1 1 11 7496 1 1 1 LEU CG C -10.333 -7.011 9.504 1.00 . A A . 1 LEU CG 1 1 11 7497 1 1 1 LEU H1 H -10.492 -2.739 11.284 1.00 . A A . 1 LEU H1 1 1 11 7498 1 1 1 LEU H2 H -11.741 -3.199 10.256 1.00 . A A . 1 LEU H2 1 1 11 7499 1 1 1 LEU H3 H -11.638 -3.855 11.802 1.00 . A A . 1 LEU H3 1 1 11 7500 1 1 1 LEU HA H -9.592 -4.917 11.277 1.00 . A A . 1 LEU HA 1 1 11 7501 1 1 1 LEU HB2 H -11.651 -6.173 10.988 1.00 . A A . 1 LEU HB2 1 1 11 7502 1 1 1 LEU HB3 H -11.863 -5.510 9.358 1.00 . A A . 1 LEU HB3 1 1 11 7503 1 1 1 LEU HD11 H -9.757 -7.811 11.433 1.00 . A A . 1 LEU HD11 1 1 11 7504 1 1 1 LEU HD12 H -8.827 -8.452 10.064 1.00 . A A . 1 LEU HD12 1 1 11 7505 1 1 1 LEU HD13 H -8.499 -6.823 10.653 1.00 . A A . 1 LEU HD13 1 1 11 7506 1 1 1 LEU HD21 H -12.052 -7.764 8.424 1.00 . A A . 1 LEU HD21 1 1 11 7507 1 1 1 LEU HD22 H -10.769 -8.961 8.676 1.00 . A A . 1 LEU HD22 1 1 11 7508 1 1 1 LEU HD23 H -11.823 -8.495 10.028 1.00 . A A . 1 LEU HD23 1 1 11 7509 1 1 1 LEU HG H -9.826 -6.701 8.590 1.00 . A A . 1 LEU HG 1 1 11 7510 1 1 1 LEU N N -11.096 -3.520 10.993 1.00 . A A . 1 LEU N 1 1 11 7511 1 1 1 LEU O O -10.010 -3.864 8.216 1.00 . A A . 1 LEU O 1 1 11 7512 1 1 2 CYS C C -6.914 -4.389 7.354 1.00 . A A . 2 CYS C 1 1 11 7513 1 1 2 CYS CA C -7.214 -3.404 8.486 1.00 . A A . 2 CYS CA 1 1 11 7514 1 1 2 CYS CB C -5.973 -2.879 9.237 1.00 . A A . 2 CYS CB 1 1 11 7515 1 1 2 CYS H H -7.749 -4.238 10.337 1.00 . A A . 2 CYS H 1 1 11 7516 1 1 2 CYS HA H -7.686 -2.533 8.044 1.00 . A A . 2 CYS HA 1 1 11 7517 1 1 2 CYS HB2 H -5.293 -3.712 9.413 1.00 . A A . 2 CYS HB2 1 1 11 7518 1 1 2 CYS HB3 H -5.460 -2.137 8.636 1.00 . A A . 2 CYS HB3 1 1 11 7519 1 1 2 CYS N N -8.136 -4.002 9.441 1.00 . A A . 2 CYS N 1 1 11 7520 1 1 2 CYS O O -5.934 -5.127 7.409 1.00 . A A . 2 CYS O 1 1 11 7521 1 1 2 CYS SG S -6.289 -2.155 10.874 1.00 . A A . 2 CYS SG 1 1 11 7522 1 1 3 ASN C C -6.777 -5.967 4.543 1.00 . A A . 3 ASN C 1 1 11 7523 1 1 3 ASN CA C -7.919 -5.658 5.513 1.00 . A A . 3 ASN CA 1 1 11 7524 1 1 3 ASN CB C -9.203 -5.575 4.663 1.00 . A A . 3 ASN CB 1 1 11 7525 1 1 3 ASN CG C -10.411 -5.091 5.434 1.00 . A A . 3 ASN CG 1 1 11 7526 1 1 3 ASN H H -8.528 -3.762 6.338 1.00 . A A . 3 ASN H 1 1 11 7527 1 1 3 ASN HA H -8.006 -6.503 6.195 1.00 . A A . 3 ASN HA 1 1 11 7528 1 1 3 ASN HB2 H -9.023 -4.862 3.852 1.00 . A A . 3 ASN HB2 1 1 11 7529 1 1 3 ASN HB3 H -9.455 -6.525 4.195 1.00 . A A . 3 ASN HB3 1 1 11 7530 1 1 3 ASN HD21 H -10.823 -6.946 6.175 1.00 . A A . 3 ASN HD21 1 1 11 7531 1 1 3 ASN HD22 H -11.890 -5.648 6.679 1.00 . A A . 3 ASN HD22 1 1 11 7532 1 1 3 ASN N N -7.764 -4.435 6.322 1.00 . A A . 3 ASN N 1 1 11 7533 1 1 3 ASN ND2 N -11.095 -5.976 6.151 1.00 . A A . 3 ASN ND2 1 1 11 7534 1 1 3 ASN O O -6.971 -6.814 3.669 1.00 . A A . 3 ASN O 1 1 11 7535 1 1 3 ASN OD1 O -10.731 -3.913 5.366 1.00 . A A . 3 ASN OD1 1 1 11 7536 1 1 4 GLU C C -4.478 -6.197 2.636 1.00 . A A . 4 GLU C 1 1 11 7537 1 1 4 GLU CA C -4.358 -5.669 4.072 1.00 . A A . 4 GLU CA 1 1 11 7538 1 1 4 GLU CB C -3.568 -6.550 5.038 1.00 . A A . 4 GLU CB 1 1 11 7539 1 1 4 GLU CD C -1.175 -7.294 5.416 1.00 . A A . 4 GLU CD 1 1 11 7540 1 1 4 GLU CG C -2.125 -6.471 4.561 1.00 . A A . 4 GLU CG 1 1 11 7541 1 1 4 GLU H H -5.473 -4.826 5.522 1.00 . A A . 4 GLU H 1 1 11 7542 1 1 4 GLU HA H -3.826 -4.717 4.011 1.00 . A A . 4 GLU HA 1 1 11 7543 1 1 4 GLU HB2 H -3.637 -6.168 6.058 1.00 . A A . 4 GLU HB2 1 1 11 7544 1 1 4 GLU HB3 H -3.936 -7.576 5.008 1.00 . A A . 4 GLU HB3 1 1 11 7545 1 1 4 GLU HG2 H -2.194 -6.819 3.546 1.00 . A A . 4 GLU HG2 1 1 11 7546 1 1 4 GLU HG3 H -1.749 -5.449 4.523 1.00 . A A . 4 GLU HG3 1 1 11 7547 1 1 4 GLU N N -5.622 -5.308 4.655 1.00 . A A . 4 GLU N 1 1 11 7548 1 1 4 GLU O O -4.647 -7.398 2.427 1.00 . A A . 4 GLU O 1 1 11 7549 1 1 4 GLU OE1 O -1.316 -8.645 5.355 1.00 . A A . 4 GLU OE1 1 1 11 7550 1 1 4 GLU OE2 O -0.345 -6.707 6.109 1.00 . A A . 4 GLU OE2 1 1 11 7551 1 1 5 ARG C C -3.299 -5.007 -0.465 1.00 . A A . 5 ARG C 1 1 11 7552 1 1 5 ARG CA C -4.536 -5.570 0.237 1.00 . A A . 5 ARG CA 1 1 11 7553 1 1 5 ARG CB C -5.824 -4.895 -0.265 1.00 . A A . 5 ARG CB 1 1 11 7554 1 1 5 ARG CD C -7.939 -6.333 -0.135 1.00 . A A . 5 ARG CD 1 1 11 7555 1 1 5 ARG CG C -6.766 -5.859 -1.000 1.00 . A A . 5 ARG CG 1 1 11 7556 1 1 5 ARG CZ C -7.270 -8.495 0.981 1.00 . A A . 5 ARG CZ 1 1 11 7557 1 1 5 ARG H H -4.079 -4.377 1.913 1.00 . A A . 5 ARG H 1 1 11 7558 1 1 5 ARG HA H -4.570 -6.644 0.063 1.00 . A A . 5 ARG HA 1 1 11 7559 1 1 5 ARG HB2 H -6.353 -4.418 0.560 1.00 . A A . 5 ARG HB2 1 1 11 7560 1 1 5 ARG HB3 H -5.543 -4.105 -0.963 1.00 . A A . 5 ARG HB3 1 1 11 7561 1 1 5 ARG HD2 H -8.456 -5.464 0.273 1.00 . A A . 5 ARG HD2 1 1 11 7562 1 1 5 ARG HD3 H -8.662 -6.866 -0.754 1.00 . A A . 5 ARG HD3 1 1 11 7563 1 1 5 ARG HG2 H -7.155 -5.318 -1.863 1.00 . A A . 5 ARG HG2 1 1 11 7564 1 1 5 ARG HG3 H -6.218 -6.727 -1.360 1.00 . A A . 5 ARG HG3 1 1 11 7565 1 1 5 ARG HH11 H -7.940 -8.786 -0.915 1.00 . A A . 5 ARG HH11 1 1 11 7566 1 1 5 ARG HH12 H -7.432 -10.234 -0.098 1.00 . A A . 5 ARG HH12 1 1 11 7567 1 1 5 ARG HH21 H -6.367 -8.418 2.771 1.00 . A A . 5 ARG HH21 1 1 11 7568 1 1 5 ARG HH22 H -6.558 -10.047 2.148 1.00 . A A . 5 ARG HH22 1 1 11 7569 1 1 5 ARG N N -4.385 -5.306 1.658 1.00 . A A . 5 ARG N 1 1 11 7570 1 1 5 ARG NE N -7.473 -7.169 0.982 1.00 . A A . 5 ARG NE 1 1 11 7571 1 1 5 ARG NH1 N -7.574 -9.235 -0.089 1.00 . A A . 5 ARG NH1 1 1 11 7572 1 1 5 ARG NH2 N -6.749 -9.062 2.070 1.00 . A A . 5 ARG NH2 1 1 11 7573 1 1 5 ARG O O -2.663 -4.102 0.078 1.00 . A A . 5 ARG O 1 1 11 7574 1 1 6 PRO C C -1.586 -3.865 -2.860 1.00 . A A . 6 PRO C 1 1 11 7575 1 1 6 PRO CA C -1.627 -5.253 -2.219 1.00 . A A . 6 PRO CA 1 1 11 7576 1 1 6 PRO CB C -1.379 -6.380 -3.227 1.00 . A A . 6 PRO CB 1 1 11 7577 1 1 6 PRO CD C -3.612 -6.558 -2.404 1.00 . A A . 6 PRO CD 1 1 11 7578 1 1 6 PRO CG C -2.792 -6.739 -3.679 1.00 . A A . 6 PRO CG 1 1 11 7579 1 1 6 PRO HA H -0.891 -5.300 -1.427 1.00 . A A . 6 PRO HA 1 1 11 7580 1 1 6 PRO HB2 H -0.741 -6.096 -4.063 1.00 . A A . 6 PRO HB2 1 1 11 7581 1 1 6 PRO HB3 H -0.945 -7.236 -2.704 1.00 . A A . 6 PRO HB3 1 1 11 7582 1 1 6 PRO HD2 H -4.611 -6.225 -2.675 1.00 . A A . 6 PRO HD2 1 1 11 7583 1 1 6 PRO HD3 H -3.644 -7.500 -1.855 1.00 . A A . 6 PRO HD3 1 1 11 7584 1 1 6 PRO HG2 H -3.130 -6.014 -4.421 1.00 . A A . 6 PRO HG2 1 1 11 7585 1 1 6 PRO HG3 H -2.861 -7.750 -4.082 1.00 . A A . 6 PRO HG3 1 1 11 7586 1 1 6 PRO N N -2.917 -5.544 -1.633 1.00 . A A . 6 PRO N 1 1 11 7587 1 1 6 PRO O O -2.565 -3.115 -2.843 1.00 . A A . 6 PRO O 1 1 11 7588 1 1 7 SER C C -1.133 -2.301 -5.443 1.00 . A A . 7 SER C 1 1 11 7589 1 1 7 SER CA C -0.255 -2.306 -4.202 1.00 . A A . 7 SER CA 1 1 11 7590 1 1 7 SER CB C 1.212 -2.179 -4.609 1.00 . A A . 7 SER CB 1 1 11 7591 1 1 7 SER H H 0.345 -4.169 -3.415 1.00 . A A . 7 SER H 1 1 11 7592 1 1 7 SER HA H -0.532 -1.446 -3.593 1.00 . A A . 7 SER HA 1 1 11 7593 1 1 7 SER HB2 H 1.262 -1.346 -5.310 1.00 . A A . 7 SER HB2 1 1 11 7594 1 1 7 SER HB3 H 1.829 -1.961 -3.740 1.00 . A A . 7 SER HB3 1 1 11 7595 1 1 7 SER HG H 0.947 -3.610 -5.865 1.00 . A A . 7 SER HG 1 1 11 7596 1 1 7 SER N N -0.436 -3.533 -3.454 1.00 . A A . 7 SER N 1 1 11 7597 1 1 7 SER O O -0.790 -2.928 -6.444 1.00 . A A . 7 SER O 1 1 11 7598 1 1 7 SER OG O 1.645 -3.380 -5.229 1.00 . A A . 7 SER OG 1 1 11 7599 1 1 8 GLN C C -2.670 -0.010 -7.156 1.00 . A A . 8 GLN C 1 1 11 7600 1 1 8 GLN CA C -3.150 -1.271 -6.436 1.00 . A A . 8 GLN CA 1 1 11 7601 1 1 8 GLN CB C -4.528 -1.118 -5.783 1.00 . A A . 8 GLN CB 1 1 11 7602 1 1 8 GLN CD C -5.826 -2.145 -3.888 1.00 . A A . 8 GLN CD 1 1 11 7603 1 1 8 GLN CG C -4.975 -2.426 -5.119 1.00 . A A . 8 GLN CG 1 1 11 7604 1 1 8 GLN H H -2.455 -1.158 -4.466 1.00 . A A . 8 GLN H 1 1 11 7605 1 1 8 GLN HA H -3.174 -2.102 -7.144 1.00 . A A . 8 GLN HA 1 1 11 7606 1 1 8 GLN HB2 H -4.465 -0.357 -5.003 1.00 . A A . 8 GLN HB2 1 1 11 7607 1 1 8 GLN HB3 H -5.269 -0.814 -6.524 1.00 . A A . 8 GLN HB3 1 1 11 7608 1 1 8 GLN HE21 H -4.213 -2.360 -2.663 1.00 . A A . 8 GLN HE21 1 1 11 7609 1 1 8 GLN HE22 H -5.735 -1.900 -1.887 1.00 . A A . 8 GLN HE22 1 1 11 7610 1 1 8 GLN HG2 H -5.536 -2.994 -5.849 1.00 . A A . 8 GLN HG2 1 1 11 7611 1 1 8 GLN HG3 H -4.130 -3.044 -4.822 1.00 . A A . 8 GLN HG3 1 1 11 7612 1 1 8 GLN N N -2.217 -1.536 -5.368 1.00 . A A . 8 GLN N 1 1 11 7613 1 1 8 GLN NE2 N -5.206 -2.128 -2.713 1.00 . A A . 8 GLN NE2 1 1 11 7614 1 1 8 GLN O O -1.795 -0.085 -8.016 1.00 . A A . 8 GLN O 1 1 11 7615 1 1 8 GLN OE1 O -7.026 -1.913 -3.986 1.00 . A A . 8 GLN OE1 1 1 11 7616 1 1 9 THR C C -1.495 2.956 -7.179 1.00 . A A . 9 THR C 1 1 11 7617 1 1 9 THR CA C -2.907 2.428 -7.422 1.00 . A A . 9 THR CA 1 1 11 7618 1 1 9 THR CB C -3.928 3.471 -6.950 1.00 . A A . 9 THR CB 1 1 11 7619 1 1 9 THR CG2 C -5.222 3.375 -7.758 1.00 . A A . 9 THR CG2 1 1 11 7620 1 1 9 THR H H -3.821 1.195 -5.982 1.00 . A A . 9 THR H 1 1 11 7621 1 1 9 THR HA H -3.013 2.296 -8.501 1.00 . A A . 9 THR HA 1 1 11 7622 1 1 9 THR HB H -3.496 4.464 -7.100 1.00 . A A . 9 THR HB 1 1 11 7623 1 1 9 THR HG1 H -5.004 2.706 -5.510 1.00 . A A . 9 THR HG1 1 1 11 7624 1 1 9 THR HG21 H -5.617 2.362 -7.719 1.00 . A A . 9 THR HG21 1 1 11 7625 1 1 9 THR HG22 H -5.964 4.064 -7.356 1.00 . A A . 9 THR HG22 1 1 11 7626 1 1 9 THR HG23 H -5.019 3.638 -8.796 1.00 . A A . 9 THR HG23 1 1 11 7627 1 1 9 THR N N -3.164 1.162 -6.750 1.00 . A A . 9 THR N 1 1 11 7628 1 1 9 THR O O -1.102 3.948 -7.787 1.00 . A A . 9 THR O 1 1 11 7629 1 1 9 THR OG1 O -4.225 3.272 -5.577 1.00 . A A . 9 THR OG1 1 1 11 7630 1 1 10 TRP C C 1.350 2.094 -7.554 1.00 . A A . 10 TRP C 1 1 11 7631 1 1 10 TRP CA C 0.712 2.626 -6.262 1.00 . A A . 10 TRP CA 1 1 11 7632 1 1 10 TRP CB C 1.365 2.011 -5.020 1.00 . A A . 10 TRP CB 1 1 11 7633 1 1 10 TRP CD1 C 3.816 1.705 -5.591 1.00 . A A . 10 TRP CD1 1 1 11 7634 1 1 10 TRP CD2 C 3.458 3.410 -4.183 1.00 . A A . 10 TRP CD2 1 1 11 7635 1 1 10 TRP CE2 C 4.821 3.484 -4.582 1.00 . A A . 10 TRP CE2 1 1 11 7636 1 1 10 TRP CE3 C 3.014 4.364 -3.249 1.00 . A A . 10 TRP CE3 1 1 11 7637 1 1 10 TRP CG C 2.822 2.333 -4.924 1.00 . A A . 10 TRP CG 1 1 11 7638 1 1 10 TRP CH2 C 5.172 5.484 -3.273 1.00 . A A . 10 TRP CH2 1 1 11 7639 1 1 10 TRP CZ2 C 5.676 4.504 -4.143 1.00 . A A . 10 TRP CZ2 1 1 11 7640 1 1 10 TRP CZ3 C 3.852 5.402 -2.815 1.00 . A A . 10 TRP CZ3 1 1 11 7641 1 1 10 TRP H H -1.084 1.575 -5.747 1.00 . A A . 10 TRP H 1 1 11 7642 1 1 10 TRP HA H 0.856 3.712 -6.230 1.00 . A A . 10 TRP HA 1 1 11 7643 1 1 10 TRP HB2 H 0.875 2.410 -4.131 1.00 . A A . 10 TRP HB2 1 1 11 7644 1 1 10 TRP HB3 H 1.234 0.931 -5.031 1.00 . A A . 10 TRP HB3 1 1 11 7645 1 1 10 TRP HD1 H 3.677 0.874 -6.268 1.00 . A A . 10 TRP HD1 1 1 11 7646 1 1 10 TRP HE1 H 5.897 2.160 -5.811 1.00 . A A . 10 TRP HE1 1 1 11 7647 1 1 10 TRP HE3 H 2.015 4.283 -2.859 1.00 . A A . 10 TRP HE3 1 1 11 7648 1 1 10 TRP HH2 H 5.776 6.318 -2.974 1.00 . A A . 10 TRP HH2 1 1 11 7649 1 1 10 TRP HZ2 H 6.687 4.563 -4.517 1.00 . A A . 10 TRP HZ2 1 1 11 7650 1 1 10 TRP HZ3 H 3.471 6.160 -2.149 1.00 . A A . 10 TRP HZ3 1 1 11 7651 1 1 10 TRP N N -0.716 2.345 -6.284 1.00 . A A . 10 TRP N 1 1 11 7652 1 1 10 TRP NE1 N 4.999 2.390 -5.400 1.00 . A A . 10 TRP NE1 1 1 11 7653 1 1 10 TRP O O 2.252 2.719 -8.104 1.00 . A A . 10 TRP O 1 1 11 7654 1 1 11 SER C C 2.733 0.277 -9.585 1.00 . A A . 11 SER C 1 1 11 7655 1 1 11 SER CA C 1.226 0.375 -9.323 1.00 . A A . 11 SER CA 1 1 11 7656 1 1 11 SER CB C 0.514 1.183 -10.417 1.00 . A A . 11 SER CB 1 1 11 7657 1 1 11 SER H H 0.064 0.530 -7.583 1.00 . A A . 11 SER H 1 1 11 7658 1 1 11 SER HA H 0.840 -0.643 -9.334 1.00 . A A . 11 SER HA 1 1 11 7659 1 1 11 SER HB2 H 1.004 2.151 -10.540 1.00 . A A . 11 SER HB2 1 1 11 7660 1 1 11 SER HB3 H 0.580 0.643 -11.364 1.00 . A A . 11 SER HB3 1 1 11 7661 1 1 11 SER HG H -1.168 0.665 -9.550 1.00 . A A . 11 SER HG 1 1 11 7662 1 1 11 SER N N 0.885 0.931 -8.022 1.00 . A A . 11 SER N 1 1 11 7663 1 1 11 SER O O 3.214 0.746 -10.615 1.00 . A A . 11 SER O 1 1 11 7664 1 1 11 SER OG O -0.843 1.403 -10.080 1.00 . A A . 11 SER OG 1 1 11 7665 1 1 12 GLY C C 5.597 -1.088 -7.635 1.00 . A A . 12 GLY C 1 1 11 7666 1 1 12 GLY CA C 4.908 -0.574 -8.897 1.00 . A A . 12 GLY CA 1 1 11 7667 1 1 12 GLY H H 3.060 -0.759 -7.858 1.00 . A A . 12 GLY H 1 1 11 7668 1 1 12 GLY HA2 H 5.060 -1.295 -9.701 1.00 . A A . 12 GLY HA2 1 1 11 7669 1 1 12 GLY HA3 H 5.361 0.376 -9.187 1.00 . A A . 12 GLY HA3 1 1 11 7670 1 1 12 GLY N N 3.484 -0.376 -8.691 1.00 . A A . 12 GLY N 1 1 11 7671 1 1 12 GLY O O 4.977 -1.784 -6.820 1.00 . A A . 12 GLY O 1 1 11 7672 1 1 13 ASN C C 7.594 0.340 -5.445 1.00 . A A . 13 ASN C 1 1 11 7673 1 1 13 ASN CA C 7.651 -0.944 -6.269 1.00 . A A . 13 ASN CA 1 1 11 7674 1 1 13 ASN CB C 9.100 -1.303 -6.614 1.00 . A A . 13 ASN CB 1 1 11 7675 1 1 13 ASN CG C 9.908 -1.729 -5.387 1.00 . A A . 13 ASN CG 1 1 11 7676 1 1 13 ASN H H 7.283 -0.117 -8.172 1.00 . A A . 13 ASN H 1 1 11 7677 1 1 13 ASN HA H 7.216 -1.774 -5.714 1.00 . A A . 13 ASN HA 1 1 11 7678 1 1 13 ASN HB2 H 9.092 -2.136 -7.314 1.00 . A A . 13 ASN HB2 1 1 11 7679 1 1 13 ASN HB3 H 9.590 -0.454 -7.095 1.00 . A A . 13 ASN HB3 1 1 11 7680 1 1 13 ASN HD21 H 10.235 0.214 -4.737 1.00 . A A . 13 ASN HD21 1 1 11 7681 1 1 13 ASN HD22 H 11.004 -1.059 -3.830 1.00 . A A . 13 ASN HD22 1 1 11 7682 1 1 13 ASN N N 6.876 -0.733 -7.483 1.00 . A A . 13 ASN N 1 1 11 7683 1 1 13 ASN ND2 N 10.419 -0.782 -4.601 1.00 . A A . 13 ASN ND2 1 1 11 7684 1 1 13 ASN O O 7.520 1.429 -6.008 1.00 . A A . 13 ASN O 1 1 11 7685 1 1 13 ASN OD1 O 10.088 -2.922 -5.142 1.00 . A A . 13 ASN OD1 1 1 11 7686 1 1 14 CYS C C 8.754 2.271 -3.421 1.00 . A A . 14 CYS C 1 1 11 7687 1 1 14 CYS CA C 7.592 1.311 -3.170 1.00 . A A . 14 CYS CA 1 1 11 7688 1 1 14 CYS CB C 7.700 0.733 -1.762 1.00 . A A . 14 CYS CB 1 1 11 7689 1 1 14 CYS H H 7.703 -0.720 -3.750 1.00 . A A . 14 CYS H 1 1 11 7690 1 1 14 CYS HA H 6.646 1.841 -3.253 1.00 . A A . 14 CYS HA 1 1 11 7691 1 1 14 CYS HB2 H 6.903 0.004 -1.619 1.00 . A A . 14 CYS HB2 1 1 11 7692 1 1 14 CYS HB3 H 8.666 0.238 -1.694 1.00 . A A . 14 CYS HB3 1 1 11 7693 1 1 14 CYS N N 7.601 0.212 -4.120 1.00 . A A . 14 CYS N 1 1 11 7694 1 1 14 CYS O O 9.787 1.868 -3.958 1.00 . A A . 14 CYS O 1 1 11 7695 1 1 14 CYS SG S 7.627 1.940 -0.418 1.00 . A A . 14 CYS SG 1 1 11 7696 1 1 15 GLY C C 9.758 5.123 -1.612 1.00 . A A . 15 GLY C 1 1 11 7697 1 1 15 GLY CA C 9.579 4.576 -3.022 1.00 . A A . 15 GLY CA 1 1 11 7698 1 1 15 GLY H H 7.692 3.726 -2.556 1.00 . A A . 15 GLY H 1 1 11 7699 1 1 15 GLY HA2 H 10.536 4.199 -3.375 1.00 . A A . 15 GLY HA2 1 1 11 7700 1 1 15 GLY HA3 H 9.250 5.377 -3.685 1.00 . A A . 15 GLY HA3 1 1 11 7701 1 1 15 GLY N N 8.573 3.522 -3.002 1.00 . A A . 15 GLY N 1 1 11 7702 1 1 15 GLY O O 10.862 5.150 -1.078 1.00 . A A . 15 GLY O 1 1 11 7703 1 1 16 ASN C C 7.266 5.558 1.017 1.00 . A A . 16 ASN C 1 1 11 7704 1 1 16 ASN CA C 8.589 5.981 0.386 1.00 . A A . 16 ASN CA 1 1 11 7705 1 1 16 ASN CB C 8.787 7.499 0.479 1.00 . A A . 16 ASN CB 1 1 11 7706 1 1 16 ASN CG C 9.058 7.944 1.911 1.00 . A A . 16 ASN CG 1 1 11 7707 1 1 16 ASN H H 7.779 5.484 -1.510 1.00 . A A . 16 ASN H 1 1 11 7708 1 1 16 ASN HA H 9.404 5.503 0.934 1.00 . A A . 16 ASN HA 1 1 11 7709 1 1 16 ASN HB2 H 9.655 7.774 -0.123 1.00 . A A . 16 ASN HB2 1 1 11 7710 1 1 16 ASN HB3 H 7.912 8.028 0.100 1.00 . A A . 16 ASN HB3 1 1 11 7711 1 1 16 ASN HD21 H 10.128 9.563 1.288 1.00 . A A . 16 ASN HD21 1 1 11 7712 1 1 16 ASN HD22 H 9.959 9.362 3.019 1.00 . A A . 16 ASN HD22 1 1 11 7713 1 1 16 ASN N N 8.646 5.537 -1.000 1.00 . A A . 16 ASN N 1 1 11 7714 1 1 16 ASN ND2 N 9.763 9.055 2.081 1.00 . A A . 16 ASN ND2 1 1 11 7715 1 1 16 ASN O O 6.196 5.928 0.524 1.00 . A A . 16 ASN O 1 1 11 7716 1 1 16 ASN OD1 O 8.615 7.309 2.866 1.00 . A A . 16 ASN OD1 1 1 11 7717 1 1 17 THR C C 5.297 5.556 3.300 1.00 . A A . 17 THR C 1 1 11 7718 1 1 17 THR CA C 6.135 4.363 2.821 1.00 . A A . 17 THR CA 1 1 11 7719 1 1 17 THR CB C 6.495 3.363 3.936 1.00 . A A . 17 THR CB 1 1 11 7720 1 1 17 THR CG2 C 7.093 4.028 5.181 1.00 . A A . 17 THR CG2 1 1 11 7721 1 1 17 THR H H 8.233 4.577 2.503 1.00 . A A . 17 THR H 1 1 11 7722 1 1 17 THR HA H 5.560 3.811 2.087 1.00 . A A . 17 THR HA 1 1 11 7723 1 1 17 THR HB H 7.240 2.672 3.542 1.00 . A A . 17 THR HB 1 1 11 7724 1 1 17 THR HG1 H 4.706 3.189 4.685 1.00 . A A . 17 THR HG1 1 1 11 7725 1 1 17 THR HG21 H 7.965 4.624 4.906 1.00 . A A . 17 THR HG21 1 1 11 7726 1 1 17 THR HG22 H 6.361 4.668 5.672 1.00 . A A . 17 THR HG22 1 1 11 7727 1 1 17 THR HG23 H 7.406 3.256 5.882 1.00 . A A . 17 THR HG23 1 1 11 7728 1 1 17 THR N N 7.328 4.809 2.120 1.00 . A A . 17 THR N 1 1 11 7729 1 1 17 THR O O 4.068 5.481 3.356 1.00 . A A . 17 THR O 1 1 11 7730 1 1 17 THR OG1 O 5.356 2.600 4.290 1.00 . A A . 17 THR OG1 1 1 11 7731 1 1 18 ALA C C 4.419 8.462 2.825 1.00 . A A . 18 ALA C 1 1 11 7732 1 1 18 ALA CA C 5.262 7.910 3.973 1.00 . A A . 18 ALA CA 1 1 11 7733 1 1 18 ALA CB C 6.272 8.949 4.467 1.00 . A A . 18 ALA CB 1 1 11 7734 1 1 18 ALA H H 6.960 6.713 3.519 1.00 . A A . 18 ALA H 1 1 11 7735 1 1 18 ALA HA H 4.563 7.684 4.781 1.00 . A A . 18 ALA HA 1 1 11 7736 1 1 18 ALA HB1 H 6.867 8.534 5.281 1.00 . A A . 18 ALA HB1 1 1 11 7737 1 1 18 ALA HB2 H 6.933 9.248 3.653 1.00 . A A . 18 ALA HB2 1 1 11 7738 1 1 18 ALA HB3 H 5.742 9.830 4.831 1.00 . A A . 18 ALA HB3 1 1 11 7739 1 1 18 ALA N N 5.949 6.684 3.601 1.00 . A A . 18 ALA N 1 1 11 7740 1 1 18 ALA O O 3.434 9.149 3.097 1.00 . A A . 18 ALA O 1 1 11 7741 1 1 19 HIS C C 2.834 7.259 0.421 1.00 . A A . 19 HIS C 1 1 11 7742 1 1 19 HIS CA C 3.846 8.399 0.465 1.00 . A A . 19 HIS CA 1 1 11 7743 1 1 19 HIS CB C 4.552 8.568 -0.887 1.00 . A A . 19 HIS CB 1 1 11 7744 1 1 19 HIS CD2 C 2.289 9.287 -2.005 1.00 . A A . 19 HIS CD2 1 1 11 7745 1 1 19 HIS CE1 C 2.827 8.845 -4.079 1.00 . A A . 19 HIS CE1 1 1 11 7746 1 1 19 HIS CG C 3.595 8.851 -2.031 1.00 . A A . 19 HIS CG 1 1 11 7747 1 1 19 HIS H H 5.551 7.542 1.400 1.00 . A A . 19 HIS H 1 1 11 7748 1 1 19 HIS HA H 3.311 9.330 0.654 1.00 . A A . 19 HIS HA 1 1 11 7749 1 1 19 HIS HB2 H 5.260 9.387 -0.826 1.00 . A A . 19 HIS HB2 1 1 11 7750 1 1 19 HIS HB3 H 5.112 7.659 -1.107 1.00 . A A . 19 HIS HB3 1 1 11 7751 1 1 19 HIS HD1 H 4.847 8.373 -3.722 1.00 . A A . 19 HIS HD1 1 1 11 7752 1 1 19 HIS HD2 H 1.710 9.515 -1.111 1.00 . A A . 19 HIS HD2 1 1 11 7753 1 1 19 HIS HE1 H 2.752 8.703 -5.149 1.00 . A A . 19 HIS HE1 1 1 11 7754 1 1 19 HIS N N 4.766 8.159 1.566 1.00 . A A . 19 HIS N 1 1 11 7755 1 1 19 HIS ND1 N 3.946 8.661 -3.362 1.00 . A A . 19 HIS ND1 1 1 11 7756 1 1 19 HIS NE2 N 1.798 9.209 -3.298 1.00 . A A . 19 HIS NE2 1 1 11 7757 1 1 19 HIS O O 1.644 7.540 0.356 1.00 . A A . 19 HIS O 1 1 11 7758 1 1 20 CYS C C 1.149 4.970 1.199 1.00 . A A . 20 CYS C 1 1 11 7759 1 1 20 CYS CA C 2.400 4.824 0.351 1.00 . A A . 20 CYS CA 1 1 11 7760 1 1 20 CYS CB C 3.115 3.554 0.792 1.00 . A A . 20 CYS CB 1 1 11 7761 1 1 20 CYS H H 4.288 5.842 0.500 1.00 . A A . 20 CYS H 1 1 11 7762 1 1 20 CYS HA H 2.081 4.708 -0.679 1.00 . A A . 20 CYS HA 1 1 11 7763 1 1 20 CYS HB2 H 3.918 3.332 0.094 1.00 . A A . 20 CYS HB2 1 1 11 7764 1 1 20 CYS HB3 H 3.503 3.692 1.792 1.00 . A A . 20 CYS HB3 1 1 11 7765 1 1 20 CYS N N 3.284 5.996 0.449 1.00 . A A . 20 CYS N 1 1 11 7766 1 1 20 CYS O O 0.031 4.719 0.741 1.00 . A A . 20 CYS O 1 1 11 7767 1 1 20 CYS SG S 2.017 2.133 0.947 1.00 . A A . 20 CYS SG 1 1 11 7768 1 1 21 ASP C C -0.787 6.517 2.817 1.00 . A A . 21 ASP C 1 1 11 7769 1 1 21 ASP CA C 0.279 5.579 3.383 1.00 . A A . 21 ASP CA 1 1 11 7770 1 1 21 ASP CB C 0.853 6.118 4.714 1.00 . A A . 21 ASP CB 1 1 11 7771 1 1 21 ASP CG C 0.007 7.238 5.322 1.00 . A A . 21 ASP CG 1 1 11 7772 1 1 21 ASP H H 2.313 5.608 2.724 1.00 . A A . 21 ASP H 1 1 11 7773 1 1 21 ASP HA H -0.140 4.582 3.507 1.00 . A A . 21 ASP HA 1 1 11 7774 1 1 21 ASP HB2 H 0.934 5.304 5.433 1.00 . A A . 21 ASP HB2 1 1 11 7775 1 1 21 ASP HB3 H 1.850 6.527 4.557 1.00 . A A . 21 ASP HB3 1 1 11 7776 1 1 21 ASP N N 1.351 5.465 2.420 1.00 . A A . 21 ASP N 1 1 11 7777 1 1 21 ASP O O -1.974 6.227 2.923 1.00 . A A . 21 ASP O 1 1 11 7778 1 1 21 ASP OD1 O -1.186 6.849 5.848 1.00 . A A . 21 ASP OD1 1 1 11 7779 1 1 21 ASP OD2 O 0.424 8.399 5.278 1.00 . A A . 21 ASP OD2 1 1 11 7780 1 1 22 LYS C C -1.850 8.108 0.357 1.00 . A A . 22 LYS C 1 1 11 7781 1 1 22 LYS CA C -1.249 8.624 1.652 1.00 . A A . 22 LYS CA 1 1 11 7782 1 1 22 LYS CB C -0.539 9.970 1.435 1.00 . A A . 22 LYS CB 1 1 11 7783 1 1 22 LYS CD C 0.865 11.658 2.803 1.00 . A A . 22 LYS CD 1 1 11 7784 1 1 22 LYS CE C 1.353 11.902 4.244 1.00 . A A . 22 LYS CE 1 1 11 7785 1 1 22 LYS CG C 0.236 10.269 2.707 1.00 . A A . 22 LYS CG 1 1 11 7786 1 1 22 LYS H H 0.641 7.701 2.032 1.00 . A A . 22 LYS H 1 1 11 7787 1 1 22 LYS HA H -2.032 8.810 2.383 1.00 . A A . 22 LYS HA 1 1 11 7788 1 1 22 LYS HB2 H 0.142 9.921 0.586 1.00 . A A . 22 LYS HB2 1 1 11 7789 1 1 22 LYS HB3 H -1.286 10.745 1.255 1.00 . A A . 22 LYS HB3 1 1 11 7790 1 1 22 LYS HD2 H 1.697 11.726 2.100 1.00 . A A . 22 LYS HD2 1 1 11 7791 1 1 22 LYS HD3 H 0.127 12.423 2.543 1.00 . A A . 22 LYS HD3 1 1 11 7792 1 1 22 LYS HE2 H 2.057 12.736 4.239 1.00 . A A . 22 LYS HE2 1 1 11 7793 1 1 22 LYS HE3 H 0.500 12.179 4.866 1.00 . A A . 22 LYS HE3 1 1 11 7794 1 1 22 LYS HG2 H -0.434 10.111 3.556 1.00 . A A . 22 LYS HG2 1 1 11 7795 1 1 22 LYS HG3 H 1.035 9.538 2.691 1.00 . A A . 22 LYS HG3 1 1 11 7796 1 1 22 LYS HZ1 H 1.386 9.887 4.707 1.00 . A A . 22 LYS HZ1 1 1 11 7797 1 1 22 LYS HZ2 H 2.902 10.539 4.384 1.00 . A A . 22 LYS HZ2 1 1 11 7798 1 1 22 LYS N N -0.355 7.621 2.210 1.00 . A A . 22 LYS N 1 1 11 7799 1 1 22 LYS NZ N 1.995 10.707 4.841 1.00 . A A . 22 LYS NZ 1 1 11 7800 1 1 22 LYS O O -3.049 8.241 0.141 1.00 . A A . 22 LYS O 1 1 11 7801 1 1 23 GLN C C -2.619 6.236 -1.764 1.00 . A A . 23 GLN C 1 1 11 7802 1 1 23 GLN CA C -1.365 7.117 -1.855 1.00 . A A . 23 GLN CA 1 1 11 7803 1 1 23 GLN CB C -0.165 6.354 -2.452 1.00 . A A . 23 GLN CB 1 1 11 7804 1 1 23 GLN CD C -0.371 6.635 -4.957 1.00 . A A . 23 GLN CD 1 1 11 7805 1 1 23 GLN CG C -0.430 5.651 -3.791 1.00 . A A . 23 GLN CG 1 1 11 7806 1 1 23 GLN H H -0.060 7.387 -0.198 1.00 . A A . 23 GLN H 1 1 11 7807 1 1 23 GLN HA H -1.584 8.004 -2.450 1.00 . A A . 23 GLN HA 1 1 11 7808 1 1 23 GLN HB2 H 0.711 6.994 -2.517 1.00 . A A . 23 GLN HB2 1 1 11 7809 1 1 23 GLN HB3 H 0.079 5.556 -1.750 1.00 . A A . 23 GLN HB3 1 1 11 7810 1 1 23 GLN HE21 H -0.748 5.156 -6.348 1.00 . A A . 23 GLN HE21 1 1 11 7811 1 1 23 GLN HE22 H -0.477 6.723 -6.986 1.00 . A A . 23 GLN HE22 1 1 11 7812 1 1 23 GLN HG2 H 0.367 4.938 -3.977 1.00 . A A . 23 GLN HG2 1 1 11 7813 1 1 23 GLN HG3 H -1.371 5.112 -3.788 1.00 . A A . 23 GLN HG3 1 1 11 7814 1 1 23 GLN N N -1.019 7.509 -0.497 1.00 . A A . 23 GLN N 1 1 11 7815 1 1 23 GLN NE2 N -0.547 6.134 -6.176 1.00 . A A . 23 GLN NE2 1 1 11 7816 1 1 23 GLN O O -3.606 6.470 -2.457 1.00 . A A . 23 GLN O 1 1 11 7817 1 1 23 GLN OE1 O -0.116 7.828 -4.767 1.00 . A A . 23 GLN OE1 1 1 11 7818 1 1 24 CYS C C -4.962 5.058 -0.151 1.00 . A A . 24 CYS C 1 1 11 7819 1 1 24 CYS CA C -3.683 4.334 -0.598 1.00 . A A . 24 CYS CA 1 1 11 7820 1 1 24 CYS CB C -3.241 3.322 0.464 1.00 . A A . 24 CYS CB 1 1 11 7821 1 1 24 CYS H H -1.722 5.124 -0.330 1.00 . A A . 24 CYS H 1 1 11 7822 1 1 24 CYS HA H -3.910 3.786 -1.513 1.00 . A A . 24 CYS HA 1 1 11 7823 1 1 24 CYS HB2 H -2.818 3.850 1.317 1.00 . A A . 24 CYS HB2 1 1 11 7824 1 1 24 CYS HB3 H -4.109 2.764 0.799 1.00 . A A . 24 CYS HB3 1 1 11 7825 1 1 24 CYS N N -2.579 5.250 -0.862 1.00 . A A . 24 CYS N 1 1 11 7826 1 1 24 CYS O O -6.072 4.635 -0.488 1.00 . A A . 24 CYS O 1 1 11 7827 1 1 24 CYS SG S -2.069 2.065 -0.087 1.00 . A A . 24 CYS SG 1 1 11 7828 1 1 25 GLN C C -6.538 7.700 -0.134 1.00 . A A . 25 GLN C 1 1 11 7829 1 1 25 GLN CA C -6.001 6.907 1.063 1.00 . A A . 25 GLN CA 1 1 11 7830 1 1 25 GLN CB C -5.617 7.851 2.217 1.00 . A A . 25 GLN CB 1 1 11 7831 1 1 25 GLN CD C -4.605 8.028 4.537 1.00 . A A . 25 GLN CD 1 1 11 7832 1 1 25 GLN CG C -5.154 7.088 3.465 1.00 . A A . 25 GLN CG 1 1 11 7833 1 1 25 GLN H H -3.916 6.527 0.790 1.00 . A A . 25 GLN H 1 1 11 7834 1 1 25 GLN HA H -6.755 6.220 1.445 1.00 . A A . 25 GLN HA 1 1 11 7835 1 1 25 GLN HB2 H -4.820 8.527 1.909 1.00 . A A . 25 GLN HB2 1 1 11 7836 1 1 25 GLN HB3 H -6.488 8.450 2.479 1.00 . A A . 25 GLN HB3 1 1 11 7837 1 1 25 GLN HE21 H -6.444 8.832 4.855 1.00 . A A . 25 GLN HE21 1 1 11 7838 1 1 25 GLN HE22 H -5.141 9.487 5.827 1.00 . A A . 25 GLN HE22 1 1 11 7839 1 1 25 GLN HG2 H -5.989 6.531 3.884 1.00 . A A . 25 GLN HG2 1 1 11 7840 1 1 25 GLN HG3 H -4.378 6.382 3.185 1.00 . A A . 25 GLN HG3 1 1 11 7841 1 1 25 GLN N N -4.838 6.146 0.613 1.00 . A A . 25 GLN N 1 1 11 7842 1 1 25 GLN NE2 N -5.468 8.864 5.106 1.00 . A A . 25 GLN NE2 1 1 11 7843 1 1 25 GLN O O -7.683 7.527 -0.561 1.00 . A A . 25 GLN O 1 1 11 7844 1 1 25 GLN OE1 O -3.417 8.021 4.853 1.00 . A A . 25 GLN OE1 1 1 11 7845 1 1 26 ASP C C -6.554 8.772 -2.952 1.00 . A A . 26 ASP C 1 1 11 7846 1 1 26 ASP CA C -5.962 9.499 -1.754 1.00 . A A . 26 ASP CA 1 1 11 7847 1 1 26 ASP CB C -4.694 10.259 -2.166 1.00 . A A . 26 ASP CB 1 1 11 7848 1 1 26 ASP CG C -4.129 11.159 -1.072 1.00 . A A . 26 ASP CG 1 1 11 7849 1 1 26 ASP H H -4.738 8.556 -0.303 1.00 . A A . 26 ASP H 1 1 11 7850 1 1 26 ASP HA H -6.688 10.226 -1.404 1.00 . A A . 26 ASP HA 1 1 11 7851 1 1 26 ASP HB2 H -3.926 9.549 -2.458 1.00 . A A . 26 ASP HB2 1 1 11 7852 1 1 26 ASP HB3 H -4.925 10.885 -3.028 1.00 . A A . 26 ASP HB3 1 1 11 7853 1 1 26 ASP N N -5.675 8.561 -0.680 1.00 . A A . 26 ASP N 1 1 11 7854 1 1 26 ASP O O -7.688 9.042 -3.345 1.00 . A A . 26 ASP O 1 1 11 7855 1 1 26 ASP OD1 O -5.016 11.971 -0.437 1.00 . A A . 26 ASP OD1 1 1 11 7856 1 1 26 ASP OD2 O -2.928 11.121 -0.820 1.00 . A A . 26 ASP OD2 1 1 11 7857 1 1 27 TRP C C -7.288 6.193 -4.451 1.00 . A A . 27 TRP C 1 1 11 7858 1 1 27 TRP CA C -6.202 7.206 -4.775 1.00 . A A . 27 TRP CA 1 1 11 7859 1 1 27 TRP CB C -5.016 6.519 -5.453 1.00 . A A . 27 TRP CB 1 1 11 7860 1 1 27 TRP CD1 C -3.315 8.386 -5.465 1.00 . A A . 27 TRP CD1 1 1 11 7861 1 1 27 TRP CD2 C -3.494 7.384 -7.443 1.00 . A A . 27 TRP CD2 1 1 11 7862 1 1 27 TRP CE2 C -2.452 8.348 -7.568 1.00 . A A . 27 TRP CE2 1 1 11 7863 1 1 27 TRP CE3 C -3.776 6.590 -8.567 1.00 . A A . 27 TRP CE3 1 1 11 7864 1 1 27 TRP CG C -3.999 7.408 -6.086 1.00 . A A . 27 TRP CG 1 1 11 7865 1 1 27 TRP CH2 C -1.959 7.618 -9.821 1.00 . A A . 27 TRP CH2 1 1 11 7866 1 1 27 TRP CZ2 C -1.710 8.492 -8.748 1.00 . A A . 27 TRP CZ2 1 1 11 7867 1 1 27 TRP CZ3 C -2.976 6.652 -9.716 1.00 . A A . 27 TRP CZ3 1 1 11 7868 1 1 27 TRP H H -4.911 7.577 -3.117 1.00 . A A . 27 TRP H 1 1 11 7869 1 1 27 TRP HA H -6.606 7.953 -5.463 1.00 . A A . 27 TRP HA 1 1 11 7870 1 1 27 TRP HB2 H -4.504 5.824 -4.794 1.00 . A A . 27 TRP HB2 1 1 11 7871 1 1 27 TRP HB3 H -5.443 5.930 -6.260 1.00 . A A . 27 TRP HB3 1 1 11 7872 1 1 27 TRP HD1 H -3.426 8.622 -4.427 1.00 . A A . 27 TRP HD1 1 1 11 7873 1 1 27 TRP HE1 H -1.765 9.696 -6.081 1.00 . A A . 27 TRP HE1 1 1 11 7874 1 1 27 TRP HE3 H -4.587 5.887 -8.495 1.00 . A A . 27 TRP HE3 1 1 11 7875 1 1 27 TRP HH2 H -1.362 7.672 -10.719 1.00 . A A . 27 TRP HH2 1 1 11 7876 1 1 27 TRP HZ2 H -0.930 9.236 -8.819 1.00 . A A . 27 TRP HZ2 1 1 11 7877 1 1 27 TRP HZ3 H -3.129 5.915 -10.487 1.00 . A A . 27 TRP HZ3 1 1 11 7878 1 1 27 TRP N N -5.801 7.838 -3.532 1.00 . A A . 27 TRP N 1 1 11 7879 1 1 27 TRP NE1 N -2.413 8.965 -6.331 1.00 . A A . 27 TRP NE1 1 1 11 7880 1 1 27 TRP O O -8.439 6.374 -4.841 1.00 . A A . 27 TRP O 1 1 11 7881 1 1 28 GLU C C -9.021 4.333 -2.727 1.00 . A A . 28 GLU C 1 1 11 7882 1 1 28 GLU CA C -7.788 3.978 -3.565 1.00 . A A . 28 GLU CA 1 1 11 7883 1 1 28 GLU CB C -6.969 2.800 -2.999 1.00 . A A . 28 GLU CB 1 1 11 7884 1 1 28 GLU CD C -7.344 1.135 -4.888 1.00 . A A . 28 GLU CD 1 1 11 7885 1 1 28 GLU CG C -7.538 1.436 -3.406 1.00 . A A . 28 GLU CG 1 1 11 7886 1 1 28 GLU H H -6.005 5.124 -3.309 1.00 . A A . 28 GLU H 1 1 11 7887 1 1 28 GLU HA H -8.122 3.722 -4.570 1.00 . A A . 28 GLU HA 1 1 11 7888 1 1 28 GLU HB2 H -5.939 2.862 -3.354 1.00 . A A . 28 GLU HB2 1 1 11 7889 1 1 28 GLU HB3 H -6.939 2.829 -1.912 1.00 . A A . 28 GLU HB3 1 1 11 7890 1 1 28 GLU HG2 H -7.007 0.667 -2.847 1.00 . A A . 28 GLU HG2 1 1 11 7891 1 1 28 GLU HG3 H -8.598 1.389 -3.157 1.00 . A A . 28 GLU HG3 1 1 11 7892 1 1 28 GLU N N -6.949 5.160 -3.671 1.00 . A A . 28 GLU N 1 1 11 7893 1 1 28 GLU O O -10.086 4.547 -3.292 1.00 . A A . 28 GLU O 1 1 11 7894 1 1 28 GLU OE1 O -6.276 1.421 -5.427 1.00 . A A . 28 GLU OE1 1 1 11 7895 1 1 28 GLU OE2 O -8.401 0.575 -5.531 1.00 . A A . 28 GLU OE2 1 1 11 7896 1 1 29 LYS C C -9.504 3.945 0.825 1.00 . A A . 29 LYS C 1 1 11 7897 1 1 29 LYS CA C -9.792 4.877 -0.366 1.00 . A A . 29 LYS CA 1 1 11 7898 1 1 29 LYS CB C -11.279 4.806 -0.763 1.00 . A A . 29 LYS CB 1 1 11 7899 1 1 29 LYS CD C -11.650 7.371 -1.097 1.00 . A A . 29 LYS CD 1 1 11 7900 1 1 29 LYS CE C -10.814 8.114 -2.148 1.00 . A A . 29 LYS CE 1 1 11 7901 1 1 29 LYS CG C -11.994 5.936 -1.535 1.00 . A A . 29 LYS CG 1 1 11 7902 1 1 29 LYS H H -7.916 4.409 -1.068 1.00 . A A . 29 LYS H 1 1 11 7903 1 1 29 LYS HA H -9.561 5.878 -0.013 1.00 . A A . 29 LYS HA 1 1 11 7904 1 1 29 LYS HB2 H -11.507 3.840 -1.217 1.00 . A A . 29 LYS HB2 1 1 11 7905 1 1 29 LYS HB3 H -11.753 4.829 0.202 1.00 . A A . 29 LYS HB3 1 1 11 7906 1 1 29 LYS HD2 H -12.584 7.928 -0.983 1.00 . A A . 29 LYS HD2 1 1 11 7907 1 1 29 LYS HD3 H -11.160 7.379 -0.122 1.00 . A A . 29 LYS HD3 1 1 11 7908 1 1 29 LYS HE2 H -11.426 8.295 -3.032 1.00 . A A . 29 LYS HE2 1 1 11 7909 1 1 29 LYS HE3 H -10.499 9.078 -1.742 1.00 . A A . 29 LYS HE3 1 1 11 7910 1 1 29 LYS HG2 H -11.909 5.826 -2.612 1.00 . A A . 29 LYS HG2 1 1 11 7911 1 1 29 LYS HG3 H -13.056 5.791 -1.324 1.00 . A A . 29 LYS HG3 1 1 11 7912 1 1 29 LYS HZ1 H -9.855 6.354 -2.624 1.00 . A A . 29 LYS HZ1 1 1 11 7913 1 1 29 LYS HZ2 H -9.296 7.692 -3.475 1.00 . A A . 29 LYS HZ2 1 1 11 7914 1 1 29 LYS N N -8.848 4.525 -1.419 1.00 . A A . 29 LYS N 1 1 11 7915 1 1 29 LYS NZ N -9.620 7.355 -2.557 1.00 . A A . 29 LYS NZ 1 1 11 7916 1 1 29 LYS O O -10.408 3.373 1.431 1.00 . A A . 29 LYS O 1 1 11 7917 1 1 30 ALA C C -7.942 3.753 3.571 1.00 . A A . 30 ALA C 1 1 11 7918 1 1 30 ALA CA C -7.850 2.933 2.290 1.00 . A A . 30 ALA CA 1 1 11 7919 1 1 30 ALA CB C -6.429 2.441 2.068 1.00 . A A . 30 ALA CB 1 1 11 7920 1 1 30 ALA H H -7.489 4.250 0.670 1.00 . A A . 30 ALA H 1 1 11 7921 1 1 30 ALA HA H -8.503 2.064 2.360 1.00 . A A . 30 ALA HA 1 1 11 7922 1 1 30 ALA HB1 H -6.346 2.021 1.067 1.00 . A A . 30 ALA HB1 1 1 11 7923 1 1 30 ALA HB2 H -5.742 3.279 2.186 1.00 . A A . 30 ALA HB2 1 1 11 7924 1 1 30 ALA HB3 H -6.190 1.675 2.799 1.00 . A A . 30 ALA HB3 1 1 11 7925 1 1 30 ALA N N -8.228 3.755 1.157 1.00 . A A . 30 ALA N 1 1 11 7926 1 1 30 ALA O O -7.937 4.981 3.526 1.00 . A A . 30 ALA O 1 1 11 7927 1 1 31 SER C C -6.230 4.217 5.993 1.00 . A A . 31 SER C 1 1 11 7928 1 1 31 SER CA C -7.674 3.713 5.989 1.00 . A A . 31 SER CA 1 1 11 7929 1 1 31 SER CB C -7.907 2.669 7.069 1.00 . A A . 31 SER CB 1 1 11 7930 1 1 31 SER H H -7.935 2.075 4.769 1.00 . A A . 31 SER H 1 1 11 7931 1 1 31 SER HA H -8.358 4.543 6.153 1.00 . A A . 31 SER HA 1 1 11 7932 1 1 31 SER HB2 H -7.118 1.927 7.031 1.00 . A A . 31 SER HB2 1 1 11 7933 1 1 31 SER HB3 H -7.849 3.176 8.020 1.00 . A A . 31 SER HB3 1 1 11 7934 1 1 31 SER HG H -9.821 2.723 6.716 1.00 . A A . 31 SER HG 1 1 11 7935 1 1 31 SER N N -7.950 3.085 4.725 1.00 . A A . 31 SER N 1 1 11 7936 1 1 31 SER O O -5.960 5.334 6.425 1.00 . A A . 31 SER O 1 1 11 7937 1 1 31 SER OG O -9.168 2.041 6.899 1.00 . A A . 31 SER OG 1 1 11 7938 1 1 32 HIS C C -3.239 2.856 4.294 1.00 . A A . 32 HIS C 1 1 11 7939 1 1 32 HIS CA C -3.925 3.824 5.253 1.00 . A A . 32 HIS CA 1 1 11 7940 1 1 32 HIS CB C -3.125 3.939 6.568 1.00 . A A . 32 HIS CB 1 1 11 7941 1 1 32 HIS CD2 C -3.267 1.530 7.419 1.00 . A A . 32 HIS CD2 1 1 11 7942 1 1 32 HIS CE1 C -1.161 1.074 7.672 1.00 . A A . 32 HIS CE1 1 1 11 7943 1 1 32 HIS CG C -2.565 2.639 7.081 1.00 . A A . 32 HIS CG 1 1 11 7944 1 1 32 HIS H H -5.575 2.500 5.106 1.00 . A A . 32 HIS H 1 1 11 7945 1 1 32 HIS HA H -3.969 4.800 4.764 1.00 . A A . 32 HIS HA 1 1 11 7946 1 1 32 HIS HB2 H -2.276 4.572 6.400 1.00 . A A . 32 HIS HB2 1 1 11 7947 1 1 32 HIS HB3 H -3.730 4.409 7.344 1.00 . A A . 32 HIS HB3 1 1 11 7948 1 1 32 HIS HD1 H -0.424 2.892 6.897 1.00 . A A . 32 HIS HD1 1 1 11 7949 1 1 32 HIS HD2 H -4.317 1.481 7.250 1.00 . A A . 32 HIS HD2 1 1 11 7950 1 1 32 HIS HE1 H -0.247 0.535 7.870 1.00 . A A . 32 HIS HE1 1 1 11 7951 1 1 32 HIS N N -5.296 3.395 5.498 1.00 . A A . 32 HIS N 1 1 11 7952 1 1 32 HIS ND1 N -1.217 2.340 7.219 1.00 . A A . 32 HIS ND1 1 1 11 7953 1 1 32 HIS NE2 N -2.386 0.545 7.816 1.00 . A A . 32 HIS NE2 1 1 11 7954 1 1 32 HIS O O -3.849 1.896 3.820 1.00 . A A . 32 HIS O 1 1 11 7955 1 1 33 GLY C C 0.267 2.002 4.232 1.00 . A A . 33 GLY C 1 1 11 7956 1 1 33 GLY CA C -1.009 2.206 3.424 1.00 . A A . 33 GLY CA 1 1 11 7957 1 1 33 GLY H H -1.546 3.893 4.560 1.00 . A A . 33 GLY H 1 1 11 7958 1 1 33 GLY HA2 H -1.476 1.257 3.305 1.00 . A A . 33 GLY HA2 1 1 11 7959 1 1 33 GLY HA3 H -0.769 2.588 2.439 1.00 . A A . 33 GLY HA3 1 1 11 7960 1 1 33 GLY N N -1.942 3.086 4.106 1.00 . A A . 33 GLY N 1 1 11 7961 1 1 33 GLY O O 0.496 2.719 5.211 1.00 . A A . 33 GLY O 1 1 11 7962 1 1 34 ALA C C 3.153 -0.234 3.502 1.00 . A A . 34 ALA C 1 1 11 7963 1 1 34 ALA CA C 2.371 0.705 4.437 1.00 . A A . 34 ALA CA 1 1 11 7964 1 1 34 ALA CB C 2.153 0.088 5.825 1.00 . A A . 34 ALA CB 1 1 11 7965 1 1 34 ALA H H 0.780 0.436 3.057 1.00 . A A . 34 ALA H 1 1 11 7966 1 1 34 ALA HA H 2.926 1.635 4.555 1.00 . A A . 34 ALA HA 1 1 11 7967 1 1 34 ALA HB1 H 1.508 -0.787 5.753 1.00 . A A . 34 ALA HB1 1 1 11 7968 1 1 34 ALA HB2 H 3.108 -0.202 6.258 1.00 . A A . 34 ALA HB2 1 1 11 7969 1 1 34 ALA HB3 H 1.680 0.816 6.482 1.00 . A A . 34 ALA HB3 1 1 11 7970 1 1 34 ALA N N 1.078 1.012 3.841 1.00 . A A . 34 ALA N 1 1 11 7971 1 1 34 ALA O O 2.592 -1.216 3.010 1.00 . A A . 34 ALA O 1 1 11 7972 1 1 35 CYS C C 5.801 -1.975 2.967 1.00 . A A . 35 CYS C 1 1 11 7973 1 1 35 CYS CA C 5.248 -0.710 2.307 1.00 . A A . 35 CYS CA 1 1 11 7974 1 1 35 CYS CB C 6.391 0.155 1.778 1.00 . A A . 35 CYS CB 1 1 11 7975 1 1 35 CYS H H 4.873 0.886 3.628 1.00 . A A . 35 CYS H 1 1 11 7976 1 1 35 CYS HA H 4.643 -0.979 1.451 1.00 . A A . 35 CYS HA 1 1 11 7977 1 1 35 CYS HB2 H 6.935 0.609 2.605 1.00 . A A . 35 CYS HB2 1 1 11 7978 1 1 35 CYS HB3 H 7.077 -0.500 1.263 1.00 . A A . 35 CYS HB3 1 1 11 7979 1 1 35 CYS N N 4.429 0.065 3.230 1.00 . A A . 35 CYS N 1 1 11 7980 1 1 35 CYS O O 6.126 -1.958 4.155 1.00 . A A . 35 CYS O 1 1 11 7981 1 1 35 CYS SG S 5.884 1.418 0.588 1.00 . A A . 35 CYS SG 1 1 11 7982 1 1 36 HIS C C 7.278 -5.018 1.554 1.00 . A A . 36 HIS C 1 1 11 7983 1 1 36 HIS CA C 6.552 -4.315 2.692 1.00 . A A . 36 HIS CA 1 1 11 7984 1 1 36 HIS CB C 5.539 -5.317 3.242 1.00 . A A . 36 HIS CB 1 1 11 7985 1 1 36 HIS CD2 C 3.048 -4.858 3.611 1.00 . A A . 36 HIS CD2 1 1 11 7986 1 1 36 HIS CE1 C 3.202 -3.554 5.364 1.00 . A A . 36 HIS CE1 1 1 11 7987 1 1 36 HIS CG C 4.364 -4.710 3.935 1.00 . A A . 36 HIS CG 1 1 11 7988 1 1 36 HIS H H 5.566 -3.067 1.260 1.00 . A A . 36 HIS H 1 1 11 7989 1 1 36 HIS HA H 7.248 -4.080 3.492 1.00 . A A . 36 HIS HA 1 1 11 7990 1 1 36 HIS HB2 H 5.146 -5.910 2.414 1.00 . A A . 36 HIS HB2 1 1 11 7991 1 1 36 HIS HB3 H 6.046 -6.002 3.925 1.00 . A A . 36 HIS HB3 1 1 11 7992 1 1 36 HIS HD1 H 5.312 -3.406 5.354 1.00 . A A . 36 HIS HD1 1 1 11 7993 1 1 36 HIS HD2 H 2.696 -5.419 2.754 1.00 . A A . 36 HIS HD2 1 1 11 7994 1 1 36 HIS HE1 H 2.928 -2.902 6.181 1.00 . A A . 36 HIS HE1 1 1 11 7995 1 1 36 HIS N N 5.910 -3.083 2.218 1.00 . A A . 36 HIS N 1 1 11 7996 1 1 36 HIS ND1 N 4.461 -3.849 5.014 1.00 . A A . 36 HIS ND1 1 1 11 7997 1 1 36 HIS NE2 N 2.320 -4.162 4.554 1.00 . A A . 36 HIS NE2 1 1 11 7998 1 1 36 HIS O O 6.768 -5.044 0.437 1.00 . A A . 36 HIS O 1 1 11 7999 1 1 37 LYS C C 8.492 -7.871 0.786 1.00 . A A . 37 LYS C 1 1 11 8000 1 1 37 LYS CA C 9.116 -6.485 0.883 1.00 . A A . 37 LYS CA 1 1 11 8001 1 1 37 LYS CB C 10.596 -6.566 1.239 1.00 . A A . 37 LYS CB 1 1 11 8002 1 1 37 LYS CD C 12.819 -7.653 0.573 1.00 . A A . 37 LYS CD 1 1 11 8003 1 1 37 LYS CE C 13.898 -6.616 0.221 1.00 . A A . 37 LYS CE 1 1 11 8004 1 1 37 LYS CG C 11.414 -7.210 0.115 1.00 . A A . 37 LYS CG 1 1 11 8005 1 1 37 LYS H H 8.752 -5.651 2.803 1.00 . A A . 37 LYS H 1 1 11 8006 1 1 37 LYS HA H 9.079 -6.001 -0.084 1.00 . A A . 37 LYS HA 1 1 11 8007 1 1 37 LYS HB2 H 10.948 -5.564 1.358 1.00 . A A . 37 LYS HB2 1 1 11 8008 1 1 37 LYS HB3 H 10.712 -7.073 2.188 1.00 . A A . 37 LYS HB3 1 1 11 8009 1 1 37 LYS HD2 H 12.820 -7.830 1.651 1.00 . A A . 37 LYS HD2 1 1 11 8010 1 1 37 LYS HD3 H 13.052 -8.611 0.109 1.00 . A A . 37 LYS HD3 1 1 11 8011 1 1 37 LYS HE2 H 13.627 -6.071 -0.686 1.00 . A A . 37 LYS HE2 1 1 11 8012 1 1 37 LYS HE3 H 13.964 -5.916 1.052 1.00 . A A . 37 LYS HE3 1 1 11 8013 1 1 37 LYS HG2 H 10.869 -8.080 -0.219 1.00 . A A . 37 LYS HG2 1 1 11 8014 1 1 37 LYS HG3 H 11.451 -6.541 -0.746 1.00 . A A . 37 LYS HG3 1 1 11 8015 1 1 37 LYS HZ1 H 15.123 -8.235 -0.170 1.00 . A A . 37 LYS HZ1 1 1 11 8016 1 1 37 LYS HZ2 H 15.651 -6.796 -0.861 1.00 . A A . 37 LYS HZ2 1 1 11 8017 1 1 37 LYS N N 8.395 -5.685 1.859 1.00 . A A . 37 LYS N 1 1 11 8018 1 1 37 LYS NZ N 15.228 -7.221 -0.023 1.00 . A A . 37 LYS NZ 1 1 11 8019 1 1 37 LYS O O 8.408 -8.600 1.776 1.00 . A A . 37 LYS O 1 1 11 8020 1 1 38 ARG C C 8.400 -9.960 -2.055 1.00 . A A . 38 ARG C 1 1 11 8021 1 1 38 ARG CA C 7.580 -9.532 -0.836 1.00 . A A . 38 ARG CA 1 1 11 8022 1 1 38 ARG CB C 6.113 -9.421 -1.269 1.00 . A A . 38 ARG CB 1 1 11 8023 1 1 38 ARG CD C 4.875 -9.959 0.934 1.00 . A A . 38 ARG CD 1 1 11 8024 1 1 38 ARG CG C 5.077 -8.971 -0.223 1.00 . A A . 38 ARG CG 1 1 11 8025 1 1 38 ARG CZ C 6.286 -10.703 2.885 1.00 . A A . 38 ARG CZ 1 1 11 8026 1 1 38 ARG H H 8.180 -7.539 -1.168 1.00 . A A . 38 ARG H 1 1 11 8027 1 1 38 ARG HA H 7.697 -10.273 -0.048 1.00 . A A . 38 ARG HA 1 1 11 8028 1 1 38 ARG HB2 H 6.088 -8.692 -2.083 1.00 . A A . 38 ARG HB2 1 1 11 8029 1 1 38 ARG HB3 H 5.822 -10.390 -1.666 1.00 . A A . 38 ARG HB3 1 1 11 8030 1 1 38 ARG HD2 H 3.962 -9.682 1.467 1.00 . A A . 38 ARG HD2 1 1 11 8031 1 1 38 ARG HD3 H 4.759 -10.969 0.532 1.00 . A A . 38 ARG HD3 1 1 11 8032 1 1 38 ARG HG2 H 5.340 -7.984 0.161 1.00 . A A . 38 ARG HG2 1 1 11 8033 1 1 38 ARG HG3 H 4.124 -8.882 -0.746 1.00 . A A . 38 ARG HG3 1 1 11 8034 1 1 38 ARG HH11 H 4.546 -11.747 2.758 1.00 . A A . 38 ARG HH11 1 1 11 8035 1 1 38 ARG HH12 H 5.615 -12.284 4.019 1.00 . A A . 38 ARG HH12 1 1 11 8036 1 1 38 ARG HH21 H 8.088 -9.828 3.158 1.00 . A A . 38 ARG HH21 1 1 11 8037 1 1 38 ARG HH22 H 7.730 -11.106 4.305 1.00 . A A . 38 ARG HH22 1 1 11 8038 1 1 38 ARG N N 8.067 -8.225 -0.426 1.00 . A A . 38 ARG N 1 1 11 8039 1 1 38 ARG NE N 6.004 -9.888 1.861 1.00 . A A . 38 ARG NE 1 1 11 8040 1 1 38 ARG NH1 N 5.421 -11.655 3.253 1.00 . A A . 38 ARG NH1 1 1 11 8041 1 1 38 ARG NH2 N 7.452 -10.539 3.518 1.00 . A A . 38 ARG NH2 1 1 11 8042 1 1 38 ARG O O 8.457 -9.212 -3.028 1.00 . A A . 38 ARG O 1 1 11 8043 1 1 39 GLU C C 10.788 -10.584 -3.673 1.00 . A A . 39 GLU C 1 1 11 8044 1 1 39 GLU CA C 9.825 -11.656 -3.140 1.00 . A A . 39 GLU CA 1 1 11 8045 1 1 39 GLU CB C 8.889 -12.185 -4.236 1.00 . A A . 39 GLU CB 1 1 11 8046 1 1 39 GLU CD C 7.102 -13.866 -4.829 1.00 . A A . 39 GLU CD 1 1 11 8047 1 1 39 GLU CG C 7.949 -13.277 -3.707 1.00 . A A . 39 GLU CG 1 1 11 8048 1 1 39 GLU H H 8.942 -11.722 -1.205 1.00 . A A . 39 GLU H 1 1 11 8049 1 1 39 GLU HA H 10.430 -12.489 -2.780 1.00 . A A . 39 GLU HA 1 1 11 8050 1 1 39 GLU HB2 H 8.295 -11.364 -4.644 1.00 . A A . 39 GLU HB2 1 1 11 8051 1 1 39 GLU HB3 H 9.495 -12.606 -5.040 1.00 . A A . 39 GLU HB3 1 1 11 8052 1 1 39 GLU HG2 H 8.538 -14.077 -3.258 1.00 . A A . 39 GLU HG2 1 1 11 8053 1 1 39 GLU HG3 H 7.275 -12.869 -2.952 1.00 . A A . 39 GLU HG3 1 1 11 8054 1 1 39 GLU N N 9.038 -11.135 -2.020 1.00 . A A . 39 GLU N 1 1 11 8055 1 1 39 GLU O O 10.848 -10.317 -4.870 1.00 . A A . 39 GLU O 1 1 11 8056 1 1 39 GLU OE1 O 6.132 -13.059 -5.336 1.00 . A A . 39 GLU OE1 1 1 11 8057 1 1 39 GLU OE2 O 7.325 -15.007 -5.220 1.00 . A A . 39 GLU OE2 1 1 11 8058 1 1 40 ASN C C 11.761 -7.497 -3.391 1.00 . A A . 40 ASN C 1 1 11 8059 1 1 40 ASN CA C 12.410 -8.818 -2.957 1.00 . A A . 40 ASN CA 1 1 11 8060 1 1 40 ASN CB C 13.532 -9.239 -3.899 1.00 . A A . 40 ASN CB 1 1 11 8061 1 1 40 ASN CG C 14.724 -8.290 -3.786 1.00 . A A . 40 ASN CG 1 1 11 8062 1 1 40 ASN H H 11.424 -10.272 -1.815 1.00 . A A . 40 ASN H 1 1 11 8063 1 1 40 ASN HA H 12.863 -8.631 -1.993 1.00 . A A . 40 ASN HA 1 1 11 8064 1 1 40 ASN HB2 H 13.860 -10.248 -3.655 1.00 . A A . 40 ASN HB2 1 1 11 8065 1 1 40 ASN HB3 H 13.112 -9.256 -4.896 1.00 . A A . 40 ASN HB3 1 1 11 8066 1 1 40 ASN HD21 H 14.925 -8.147 -5.810 1.00 . A A . 40 ASN HD21 1 1 11 8067 1 1 40 ASN HD22 H 16.065 -7.225 -4.856 1.00 . A A . 40 ASN HD22 1 1 11 8068 1 1 40 ASN N N 11.488 -9.924 -2.749 1.00 . A A . 40 ASN N 1 1 11 8069 1 1 40 ASN ND2 N 15.275 -7.849 -4.912 1.00 . A A . 40 ASN ND2 1 1 11 8070 1 1 40 ASN O O 12.401 -6.454 -3.311 1.00 . A A . 40 ASN O 1 1 11 8071 1 1 40 ASN OD1 O 15.153 -7.961 -2.679 1.00 . A A . 40 ASN OD1 1 1 11 8072 1 1 41 HIS C C 9.064 -5.674 -3.130 1.00 . A A . 41 HIS C 1 1 11 8073 1 1 41 HIS CA C 9.771 -6.348 -4.297 1.00 . A A . 41 HIS CA 1 1 11 8074 1 1 41 HIS CB C 8.771 -6.775 -5.371 1.00 . A A . 41 HIS CB 1 1 11 8075 1 1 41 HIS CD2 C 9.544 -8.691 -6.950 1.00 . A A . 41 HIS CD2 1 1 11 8076 1 1 41 HIS CE1 C 10.758 -7.510 -8.327 1.00 . A A . 41 HIS CE1 1 1 11 8077 1 1 41 HIS CG C 9.469 -7.377 -6.568 1.00 . A A . 41 HIS CG 1 1 11 8078 1 1 41 HIS H H 9.959 -8.366 -3.706 1.00 . A A . 41 HIS H 1 1 11 8079 1 1 41 HIS HA H 10.464 -5.653 -4.765 1.00 . A A . 41 HIS HA 1 1 11 8080 1 1 41 HIS HB2 H 8.094 -7.509 -4.931 1.00 . A A . 41 HIS HB2 1 1 11 8081 1 1 41 HIS HB3 H 8.172 -5.916 -5.674 1.00 . A A . 41 HIS HB3 1 1 11 8082 1 1 41 HIS HD1 H 10.367 -5.630 -7.447 1.00 . A A . 41 HIS HD1 1 1 11 8083 1 1 41 HIS HD2 H 9.114 -9.525 -6.415 1.00 . A A . 41 HIS HD2 1 1 11 8084 1 1 41 HIS HE1 H 11.425 -7.243 -9.134 1.00 . A A . 41 HIS HE1 1 1 11 8085 1 1 41 HIS N N 10.494 -7.513 -3.810 1.00 . A A . 41 HIS N 1 1 11 8086 1 1 41 HIS ND1 N 10.217 -6.631 -7.465 1.00 . A A . 41 HIS ND1 1 1 11 8087 1 1 41 HIS NE2 N 10.370 -8.768 -8.054 1.00 . A A . 41 HIS NE2 1 1 11 8088 1 1 41 HIS O O 8.211 -6.284 -2.488 1.00 . A A . 41 HIS O 1 1 11 8089 1 1 42 TRP C C 7.359 -3.193 -2.451 1.00 . A A . 42 TRP C 1 1 11 8090 1 1 42 TRP CA C 8.689 -3.634 -1.867 1.00 . A A . 42 TRP CA 1 1 11 8091 1 1 42 TRP CB C 9.543 -2.466 -1.394 1.00 . A A . 42 TRP CB 1 1 11 8092 1 1 42 TRP CD1 C 11.793 -3.407 -0.750 1.00 . A A . 42 TRP CD1 1 1 11 8093 1 1 42 TRP CD2 C 10.563 -2.806 1.022 1.00 . A A . 42 TRP CD2 1 1 11 8094 1 1 42 TRP CE2 C 11.792 -3.320 1.523 1.00 . A A . 42 TRP CE2 1 1 11 8095 1 1 42 TRP CE3 C 9.566 -2.499 1.967 1.00 . A A . 42 TRP CE3 1 1 11 8096 1 1 42 TRP CG C 10.606 -2.860 -0.430 1.00 . A A . 42 TRP CG 1 1 11 8097 1 1 42 TRP CH2 C 11.007 -3.185 3.808 1.00 . A A . 42 TRP CH2 1 1 11 8098 1 1 42 TRP CZ2 C 12.003 -3.551 2.887 1.00 . A A . 42 TRP CZ2 1 1 11 8099 1 1 42 TRP CZ3 C 9.798 -2.635 3.347 1.00 . A A . 42 TRP CZ3 1 1 11 8100 1 1 42 TRP H H 10.014 -3.922 -3.498 1.00 . A A . 42 TRP H 1 1 11 8101 1 1 42 TRP HA H 8.490 -4.225 -0.989 1.00 . A A . 42 TRP HA 1 1 11 8102 1 1 42 TRP HB2 H 9.978 -1.940 -2.241 1.00 . A A . 42 TRP HB2 1 1 11 8103 1 1 42 TRP HB3 H 8.902 -1.781 -0.856 1.00 . A A . 42 TRP HB3 1 1 11 8104 1 1 42 TRP HD1 H 12.085 -3.671 -1.751 1.00 . A A . 42 TRP HD1 1 1 11 8105 1 1 42 TRP HE1 H 13.444 -4.034 0.442 1.00 . A A . 42 TRP HE1 1 1 11 8106 1 1 42 TRP HE3 H 8.592 -2.207 1.619 1.00 . A A . 42 TRP HE3 1 1 11 8107 1 1 42 TRP HH2 H 11.146 -3.357 4.865 1.00 . A A . 42 TRP HH2 1 1 11 8108 1 1 42 TRP HZ2 H 12.874 -4.113 3.189 1.00 . A A . 42 TRP HZ2 1 1 11 8109 1 1 42 TRP HZ3 H 9.023 -2.346 4.041 1.00 . A A . 42 TRP HZ3 1 1 11 8110 1 1 42 TRP N N 9.404 -4.418 -2.854 1.00 . A A . 42 TRP N 1 1 11 8111 1 1 42 TRP NE1 N 12.523 -3.634 0.397 1.00 . A A . 42 TRP NE1 1 1 11 8112 1 1 42 TRP O O 7.343 -2.409 -3.391 1.00 . A A . 42 TRP O 1 1 11 8113 1 1 43 LYS C C 4.331 -2.402 -1.329 1.00 . A A . 43 LYS C 1 1 11 8114 1 1 43 LYS CA C 4.917 -3.321 -2.385 1.00 . A A . 43 LYS CA 1 1 11 8115 1 1 43 LYS CB C 4.014 -4.541 -2.575 1.00 . A A . 43 LYS CB 1 1 11 8116 1 1 43 LYS CD C 5.555 -5.586 -4.362 1.00 . A A . 43 LYS CD 1 1 11 8117 1 1 43 LYS CE C 4.675 -5.481 -5.625 1.00 . A A . 43 LYS CE 1 1 11 8118 1 1 43 LYS CG C 4.804 -5.762 -3.030 1.00 . A A . 43 LYS CG 1 1 11 8119 1 1 43 LYS H H 6.295 -4.414 -1.214 1.00 . A A . 43 LYS H 1 1 11 8120 1 1 43 LYS HA H 4.972 -2.814 -3.346 1.00 . A A . 43 LYS HA 1 1 11 8121 1 1 43 LYS HB2 H 3.581 -4.792 -1.613 1.00 . A A . 43 LYS HB2 1 1 11 8122 1 1 43 LYS HB3 H 3.196 -4.314 -3.254 1.00 . A A . 43 LYS HB3 1 1 11 8123 1 1 43 LYS HD2 H 6.260 -4.757 -4.332 1.00 . A A . 43 LYS HD2 1 1 11 8124 1 1 43 LYS HD3 H 6.135 -6.501 -4.466 1.00 . A A . 43 LYS HD3 1 1 11 8125 1 1 43 LYS HE2 H 5.311 -5.710 -6.483 1.00 . A A . 43 LYS HE2 1 1 11 8126 1 1 43 LYS HE3 H 3.884 -6.233 -5.586 1.00 . A A . 43 LYS HE3 1 1 11 8127 1 1 43 LYS HG2 H 5.446 -6.023 -2.181 1.00 . A A . 43 LYS HG2 1 1 11 8128 1 1 43 LYS HG3 H 4.152 -6.609 -3.149 1.00 . A A . 43 LYS HG3 1 1 11 8129 1 1 43 LYS HZ1 H 4.418 -3.775 -6.770 1.00 . A A . 43 LYS HZ1 1 1 11 8130 1 1 43 LYS HZ2 H 3.051 -4.226 -5.899 1.00 . A A . 43 LYS HZ2 1 1 11 8131 1 1 43 LYS N N 6.242 -3.714 -1.946 1.00 . A A . 43 LYS N 1 1 11 8132 1 1 43 LYS NZ N 4.078 -4.144 -5.870 1.00 . A A . 43 LYS NZ 1 1 11 8133 1 1 43 LYS O O 4.363 -2.724 -0.142 1.00 . A A . 43 LYS O 1 1 11 8134 1 1 44 CYS C C 1.591 -1.165 -0.744 1.00 . A A . 44 CYS C 1 1 11 8135 1 1 44 CYS CA C 2.914 -0.443 -0.967 1.00 . A A . 44 CYS CA 1 1 11 8136 1 1 44 CYS CB C 2.701 0.881 -1.688 1.00 . A A . 44 CYS CB 1 1 11 8137 1 1 44 CYS H H 3.815 -1.100 -2.767 1.00 . A A . 44 CYS H 1 1 11 8138 1 1 44 CYS HA H 3.369 -0.222 -0.010 1.00 . A A . 44 CYS HA 1 1 11 8139 1 1 44 CYS HB2 H 3.631 1.442 -1.607 1.00 . A A . 44 CYS HB2 1 1 11 8140 1 1 44 CYS HB3 H 2.464 0.700 -2.734 1.00 . A A . 44 CYS HB3 1 1 11 8141 1 1 44 CYS N N 3.776 -1.282 -1.778 1.00 . A A . 44 CYS N 1 1 11 8142 1 1 44 CYS O O 0.766 -1.190 -1.646 1.00 . A A . 44 CYS O 1 1 11 8143 1 1 44 CYS SG S 1.358 1.862 -0.991 1.00 . A A . 44 CYS SG 1 1 11 8144 1 1 45 PHE C C -0.830 -1.351 1.264 1.00 . A A . 45 PHE C 1 1 11 8145 1 1 45 PHE CA C 0.111 -2.417 0.714 1.00 . A A . 45 PHE CA 1 1 11 8146 1 1 45 PHE CB C 0.285 -3.549 1.730 1.00 . A A . 45 PHE CB 1 1 11 8147 1 1 45 PHE CD1 C 1.732 -5.164 0.419 1.00 . A A . 45 PHE CD1 1 1 11 8148 1 1 45 PHE CD2 C -0.421 -5.934 1.246 1.00 . A A . 45 PHE CD2 1 1 11 8149 1 1 45 PHE CE1 C 1.989 -6.449 -0.095 1.00 . A A . 45 PHE CE1 1 1 11 8150 1 1 45 PHE CE2 C -0.183 -7.205 0.696 1.00 . A A . 45 PHE CE2 1 1 11 8151 1 1 45 PHE CG C 0.540 -4.913 1.119 1.00 . A A . 45 PHE CG 1 1 11 8152 1 1 45 PHE CZ C 1.025 -7.462 0.024 1.00 . A A . 45 PHE CZ 1 1 11 8153 1 1 45 PHE H H 2.057 -1.669 1.178 1.00 . A A . 45 PHE H 1 1 11 8154 1 1 45 PHE HA H -0.321 -2.838 -0.197 1.00 . A A . 45 PHE HA 1 1 11 8155 1 1 45 PHE HB2 H 1.093 -3.277 2.400 1.00 . A A . 45 PHE HB2 1 1 11 8156 1 1 45 PHE HB3 H -0.615 -3.624 2.338 1.00 . A A . 45 PHE HB3 1 1 11 8157 1 1 45 PHE HD1 H 2.465 -4.378 0.321 1.00 . A A . 45 PHE HD1 1 1 11 8158 1 1 45 PHE HD2 H -1.365 -5.732 1.728 1.00 . A A . 45 PHE HD2 1 1 11 8159 1 1 45 PHE HE1 H 2.925 -6.665 -0.585 1.00 . A A . 45 PHE HE1 1 1 11 8160 1 1 45 PHE HE2 H -0.931 -7.980 0.782 1.00 . A A . 45 PHE HE2 1 1 11 8161 1 1 45 PHE HZ H 1.210 -8.436 -0.409 1.00 . A A . 45 PHE HZ 1 1 11 8162 1 1 45 PHE N N 1.389 -1.784 0.421 1.00 . A A . 45 PHE N 1 1 11 8163 1 1 45 PHE O O -0.385 -0.422 1.938 1.00 . A A . 45 PHE O 1 1 11 8164 1 1 46 CYS C C -4.058 -1.440 2.427 1.00 . A A . 46 CYS C 1 1 11 8165 1 1 46 CYS CA C -3.210 -0.658 1.438 1.00 . A A . 46 CYS CA 1 1 11 8166 1 1 46 CYS CB C -4.067 -0.256 0.235 1.00 . A A . 46 CYS CB 1 1 11 8167 1 1 46 CYS H H -2.400 -2.354 0.497 1.00 . A A . 46 CYS H 1 1 11 8168 1 1 46 CYS HA H -2.854 0.225 1.972 1.00 . A A . 46 CYS HA 1 1 11 8169 1 1 46 CYS HB2 H -4.483 -1.159 -0.206 1.00 . A A . 46 CYS HB2 1 1 11 8170 1 1 46 CYS HB3 H -4.893 0.336 0.607 1.00 . A A . 46 CYS HB3 1 1 11 8171 1 1 46 CYS N N -2.123 -1.513 0.992 1.00 . A A . 46 CYS N 1 1 11 8172 1 1 46 CYS O O -4.042 -2.667 2.442 1.00 . A A . 46 CYS O 1 1 11 8173 1 1 46 CYS SG S -3.273 0.695 -1.088 1.00 . A A . 46 CYS SG 1 1 11 8174 1 1 47 TYR C C -6.838 -0.555 4.509 1.00 . A A . 47 TYR C 1 1 11 8175 1 1 47 TYR CA C -5.508 -1.289 4.399 1.00 . A A . 47 TYR CA 1 1 11 8176 1 1 47 TYR CB C -4.682 -1.029 5.658 1.00 . A A . 47 TYR CB 1 1 11 8177 1 1 47 TYR CD1 C -2.229 -1.367 5.087 1.00 . A A . 47 TYR CD1 1 1 11 8178 1 1 47 TYR CD2 C -3.338 -2.967 6.546 1.00 . A A . 47 TYR CD2 1 1 11 8179 1 1 47 TYR CE1 C -1.049 -2.121 5.161 1.00 . A A . 47 TYR CE1 1 1 11 8180 1 1 47 TYR CE2 C -2.142 -3.685 6.669 1.00 . A A . 47 TYR CE2 1 1 11 8181 1 1 47 TYR CG C -3.386 -1.804 5.759 1.00 . A A . 47 TYR CG 1 1 11 8182 1 1 47 TYR CZ C -1.011 -3.284 5.947 1.00 . A A . 47 TYR CZ 1 1 11 8183 1 1 47 TYR H H -4.681 0.291 3.257 1.00 . A A . 47 TYR H 1 1 11 8184 1 1 47 TYR HA H -5.670 -2.363 4.282 1.00 . A A . 47 TYR HA 1 1 11 8185 1 1 47 TYR HB2 H -4.437 0.026 5.654 1.00 . A A . 47 TYR HB2 1 1 11 8186 1 1 47 TYR HB3 H -5.295 -1.233 6.535 1.00 . A A . 47 TYR HB3 1 1 11 8187 1 1 47 TYR HD1 H -2.255 -0.465 4.499 1.00 . A A . 47 TYR HD1 1 1 11 8188 1 1 47 TYR HD2 H -4.217 -3.313 7.063 1.00 . A A . 47 TYR HD2 1 1 11 8189 1 1 47 TYR HE1 H -0.189 -1.820 4.582 1.00 . A A . 47 TYR HE1 1 1 11 8190 1 1 47 TYR HE2 H -2.111 -4.565 7.297 1.00 . A A . 47 TYR HE2 1 1 11 8191 1 1 47 TYR HH H -0.047 -4.915 6.381 1.00 . A A . 47 TYR HH 1 1 11 8192 1 1 47 TYR N N -4.777 -0.720 3.282 1.00 . A A . 47 TYR N 1 1 11 8193 1 1 47 TYR O O -6.857 0.580 4.982 1.00 . A A . 47 TYR O 1 1 11 8194 1 1 47 TYR OH O 0.116 -4.043 5.989 1.00 . A A . 47 TYR OH 1 1 11 8195 1 1 48 PHE C C -9.795 -0.866 5.637 1.00 . A A . 48 PHE C 1 1 11 8196 1 1 48 PHE CA C -9.250 -0.586 4.231 1.00 . A A . 48 PHE CA 1 1 11 8197 1 1 48 PHE CB C -10.123 -1.271 3.174 1.00 . A A . 48 PHE CB 1 1 11 8198 1 1 48 PHE CD1 C -9.876 0.010 1.005 1.00 . A A . 48 PHE CD1 1 1 11 8199 1 1 48 PHE CD2 C -8.917 -2.224 1.150 1.00 . A A . 48 PHE CD2 1 1 11 8200 1 1 48 PHE CE1 C -9.445 0.108 -0.330 1.00 . A A . 48 PHE CE1 1 1 11 8201 1 1 48 PHE CE2 C -8.502 -2.132 -0.191 1.00 . A A . 48 PHE CE2 1 1 11 8202 1 1 48 PHE CG C -9.619 -1.158 1.746 1.00 . A A . 48 PHE CG 1 1 11 8203 1 1 48 PHE CZ C -8.777 -0.972 -0.934 1.00 . A A . 48 PHE CZ 1 1 11 8204 1 1 48 PHE H H -7.922 -2.076 3.643 1.00 . A A . 48 PHE H 1 1 11 8205 1 1 48 PHE HA H -9.226 0.488 4.044 1.00 . A A . 48 PHE HA 1 1 11 8206 1 1 48 PHE HB2 H -10.232 -2.324 3.428 1.00 . A A . 48 PHE HB2 1 1 11 8207 1 1 48 PHE HB3 H -11.108 -0.836 3.220 1.00 . A A . 48 PHE HB3 1 1 11 8208 1 1 48 PHE HD1 H -10.432 0.824 1.444 1.00 . A A . 48 PHE HD1 1 1 11 8209 1 1 48 PHE HD2 H -8.724 -3.132 1.701 1.00 . A A . 48 PHE HD2 1 1 11 8210 1 1 48 PHE HE1 H -9.665 1.001 -0.900 1.00 . A A . 48 PHE HE1 1 1 11 8211 1 1 48 PHE HE2 H -8.012 -2.965 -0.671 1.00 . A A . 48 PHE HE2 1 1 11 8212 1 1 48 PHE HZ H -8.513 -0.931 -1.981 1.00 . A A . 48 PHE HZ 1 1 11 8213 1 1 48 PHE N N -7.940 -1.175 4.087 1.00 . A A . 48 PHE N 1 1 11 8214 1 1 48 PHE O O -9.154 -1.575 6.409 1.00 . A A . 48 PHE O 1 1 11 8215 1 1 49 ASN C C -11.136 -0.798 8.392 1.00 . A A . 49 ASN C 1 1 11 8216 1 1 49 ASN CA C -11.880 -0.627 7.061 1.00 . A A . 49 ASN CA 1 1 11 8217 1 1 49 ASN CB C -12.827 -1.818 6.815 1.00 . A A . 49 ASN CB 1 1 11 8218 1 1 49 ASN CG C -13.500 -1.790 5.445 1.00 . A A . 49 ASN CG 1 1 11 8219 1 1 49 ASN H H -11.416 0.212 5.189 1.00 . A A . 49 ASN H 1 1 11 8220 1 1 49 ASN HA H -12.507 0.259 7.167 1.00 . A A . 49 ASN HA 1 1 11 8221 1 1 49 ASN HB2 H -12.279 -2.749 6.935 1.00 . A A . 49 ASN HB2 1 1 11 8222 1 1 49 ASN HB3 H -13.613 -1.796 7.571 1.00 . A A . 49 ASN HB3 1 1 11 8223 1 1 49 ASN HD21 H -12.220 -3.186 4.756 1.00 . A A . 49 ASN HD21 1 1 11 8224 1 1 49 ASN HD22 H -13.428 -2.666 3.602 1.00 . A A . 49 ASN HD22 1 1 11 8225 1 1 49 ASN N N -11.019 -0.386 5.897 1.00 . A A . 49 ASN N 1 1 11 8226 1 1 49 ASN ND2 N -13.010 -2.602 4.514 1.00 . A A . 49 ASN ND2 1 1 11 8227 1 1 49 ASN O O -11.558 -1.597 9.229 1.00 . A A . 49 ASN O 1 1 11 8228 1 1 49 ASN OD1 O -14.445 -1.041 5.224 1.00 . A A . 49 ASN OD1 1 1 11 8229 1 1 50 CYS C C -9.575 -0.178 11.056 1.00 . A A . 50 CYS C 1 1 11 8230 1 1 50 CYS CA C -9.072 -0.459 9.646 1.00 . A A . 50 CYS CA 1 1 11 8231 1 1 50 CYS CB C -7.715 0.161 9.358 1.00 . A A . 50 CYS CB 1 1 11 8232 1 1 50 CYS H H -9.739 0.581 7.898 1.00 . A A . 50 CYS H 1 1 11 8233 1 1 50 CYS HA H -8.912 -1.518 9.582 1.00 . A A . 50 CYS HA 1 1 11 8234 1 1 50 CYS HB2 H -7.366 -0.236 8.405 1.00 . A A . 50 CYS HB2 1 1 11 8235 1 1 50 CYS HB3 H -7.867 1.225 9.286 1.00 . A A . 50 CYS HB3 1 1 11 8236 1 1 50 CYS N N -10.031 -0.079 8.612 1.00 . A A . 50 CYS N 1 1 11 8237 1 1 50 CYS O O -9.914 -1.160 11.787 1.00 . A A . 50 CYS O 1 1 11 8238 1 1 50 CYS OXT O -9.655 1.013 11.491 1.00 . A A . 50 CYS OXT 1 1 11 8239 1 1 50 CYS SG S -6.383 -0.100 10.552 1.00 . A A . 50 CYS SG 1 1 12 8240 1 1 1 LEU C C -9.735 -4.583 9.403 1.00 . A A . 1 LEU C 1 1 12 8241 1 1 1 LEU CA C -10.794 -5.065 10.402 1.00 . A A . 1 LEU CA 1 1 12 8242 1 1 1 LEU CB C -10.998 -6.588 10.325 1.00 . A A . 1 LEU CB 1 1 12 8243 1 1 1 LEU CD1 C -9.191 -7.266 11.988 1.00 . A A . 1 LEU CD1 1 1 12 8244 1 1 1 LEU CD2 C -10.060 -8.904 10.317 1.00 . A A . 1 LEU CD2 1 1 12 8245 1 1 1 LEU CG C -9.731 -7.428 10.562 1.00 . A A . 1 LEU CG 1 1 12 8246 1 1 1 LEU H1 H -12.402 -4.571 9.214 1.00 . A A . 1 LEU H1 1 1 12 8247 1 1 1 LEU H2 H -12.772 -4.710 10.848 1.00 . A A . 1 LEU H2 1 1 12 8248 1 1 1 LEU H3 H -11.943 -3.360 10.287 1.00 . A A . 1 LEU H3 1 1 12 8249 1 1 1 LEU HA H -10.473 -4.798 11.409 1.00 . A A . 1 LEU HA 1 1 12 8250 1 1 1 LEU HB2 H -11.748 -6.877 11.063 1.00 . A A . 1 LEU HB2 1 1 12 8251 1 1 1 LEU HB3 H -11.391 -6.825 9.337 1.00 . A A . 1 LEU HB3 1 1 12 8252 1 1 1 LEU HD11 H -9.962 -7.529 12.712 1.00 . A A . 1 LEU HD11 1 1 12 8253 1 1 1 LEU HD12 H -8.336 -7.928 12.131 1.00 . A A . 1 LEU HD12 1 1 12 8254 1 1 1 LEU HD13 H -8.864 -6.243 12.169 1.00 . A A . 1 LEU HD13 1 1 12 8255 1 1 1 LEU HD21 H -10.414 -9.045 9.296 1.00 . A A . 1 LEU HD21 1 1 12 8256 1 1 1 LEU HD22 H -9.166 -9.512 10.462 1.00 . A A . 1 LEU HD22 1 1 12 8257 1 1 1 LEU HD23 H -10.831 -9.238 11.012 1.00 . A A . 1 LEU HD23 1 1 12 8258 1 1 1 LEU HG H -8.952 -7.148 9.850 1.00 . A A . 1 LEU HG 1 1 12 8259 1 1 1 LEU N N -12.073 -4.375 10.171 1.00 . A A . 1 LEU N 1 1 12 8260 1 1 1 LEU O O -10.044 -4.291 8.251 1.00 . A A . 1 LEU O 1 1 12 8261 1 1 2 CYS C C -6.964 -5.033 7.975 1.00 . A A . 2 CYS C 1 1 12 8262 1 1 2 CYS CA C -7.363 -4.011 9.035 1.00 . A A . 2 CYS CA 1 1 12 8263 1 1 2 CYS CB C -6.196 -3.562 9.934 1.00 . A A . 2 CYS CB 1 1 12 8264 1 1 2 CYS H H -8.264 -4.709 10.798 1.00 . A A . 2 CYS H 1 1 12 8265 1 1 2 CYS HA H -7.703 -3.125 8.500 1.00 . A A . 2 CYS HA 1 1 12 8266 1 1 2 CYS HB2 H -5.647 -4.448 10.256 1.00 . A A . 2 CYS HB2 1 1 12 8267 1 1 2 CYS HB3 H -5.520 -2.935 9.365 1.00 . A A . 2 CYS HB3 1 1 12 8268 1 1 2 CYS N N -8.479 -4.480 9.842 1.00 . A A . 2 CYS N 1 1 12 8269 1 1 2 CYS O O -5.927 -5.682 8.079 1.00 . A A . 2 CYS O 1 1 12 8270 1 1 2 CYS SG S -6.650 -2.706 11.466 1.00 . A A . 2 CYS SG 1 1 12 8271 1 1 3 ASN C C -6.338 -5.453 5.014 1.00 . A A . 3 ASN C 1 1 12 8272 1 1 3 ASN CA C -7.482 -6.060 5.824 1.00 . A A . 3 ASN CA 1 1 12 8273 1 1 3 ASN CB C -8.692 -6.324 4.906 1.00 . A A . 3 ASN CB 1 1 12 8274 1 1 3 ASN CG C -10.030 -6.635 5.576 1.00 . A A . 3 ASN CG 1 1 12 8275 1 1 3 ASN H H -8.653 -4.634 6.938 1.00 . A A . 3 ASN H 1 1 12 8276 1 1 3 ASN HA H -7.178 -7.022 6.240 1.00 . A A . 3 ASN HA 1 1 12 8277 1 1 3 ASN HB2 H -8.859 -5.446 4.283 1.00 . A A . 3 ASN HB2 1 1 12 8278 1 1 3 ASN HB3 H -8.445 -7.155 4.243 1.00 . A A . 3 ASN HB3 1 1 12 8279 1 1 3 ASN HD21 H -9.197 -7.078 7.379 1.00 . A A . 3 ASN HD21 1 1 12 8280 1 1 3 ASN HD22 H -10.950 -7.195 7.264 1.00 . A A . 3 ASN HD22 1 1 12 8281 1 1 3 ASN N N -7.778 -5.148 6.922 1.00 . A A . 3 ASN N 1 1 12 8282 1 1 3 ASN ND2 N -10.051 -7.014 6.849 1.00 . A A . 3 ASN ND2 1 1 12 8283 1 1 3 ASN O O -6.502 -4.394 4.409 1.00 . A A . 3 ASN O 1 1 12 8284 1 1 3 ASN OD1 O -11.073 -6.522 4.942 1.00 . A A . 3 ASN OD1 1 1 12 8285 1 1 4 GLU C C -4.200 -6.155 2.845 1.00 . A A . 4 GLU C 1 1 12 8286 1 1 4 GLU CA C -3.984 -5.764 4.311 1.00 . A A . 4 GLU CA 1 1 12 8287 1 1 4 GLU CB C -2.820 -6.541 4.957 1.00 . A A . 4 GLU CB 1 1 12 8288 1 1 4 GLU CD C -0.375 -7.225 4.785 1.00 . A A . 4 GLU CD 1 1 12 8289 1 1 4 GLU CG C -1.522 -6.442 4.160 1.00 . A A . 4 GLU CG 1 1 12 8290 1 1 4 GLU H H -5.127 -6.976 5.568 1.00 . A A . 4 GLU H 1 1 12 8291 1 1 4 GLU HA H -3.794 -4.693 4.402 1.00 . A A . 4 GLU HA 1 1 12 8292 1 1 4 GLU HB2 H -2.665 -6.169 5.971 1.00 . A A . 4 GLU HB2 1 1 12 8293 1 1 4 GLU HB3 H -3.088 -7.598 5.015 1.00 . A A . 4 GLU HB3 1 1 12 8294 1 1 4 GLU HG2 H -1.735 -6.882 3.191 1.00 . A A . 4 GLU HG2 1 1 12 8295 1 1 4 GLU HG3 H -1.209 -5.403 4.046 1.00 . A A . 4 GLU HG3 1 1 12 8296 1 1 4 GLU N N -5.179 -6.115 5.047 1.00 . A A . 4 GLU N 1 1 12 8297 1 1 4 GLU O O -4.556 -7.300 2.572 1.00 . A A . 4 GLU O 1 1 12 8298 1 1 4 GLU OE1 O -0.020 -6.859 6.049 1.00 . A A . 4 GLU OE1 1 1 12 8299 1 1 4 GLU OE2 O 0.192 -8.103 4.130 1.00 . A A . 4 GLU OE2 1 1 12 8300 1 1 5 ARG C C -3.077 -4.621 -0.283 1.00 . A A . 5 ARG C 1 1 12 8301 1 1 5 ARG CA C -4.073 -5.500 0.472 1.00 . A A . 5 ARG CA 1 1 12 8302 1 1 5 ARG CB C -5.512 -5.252 0.013 1.00 . A A . 5 ARG CB 1 1 12 8303 1 1 5 ARG CD C -7.691 -6.381 -0.572 1.00 . A A . 5 ARG CD 1 1 12 8304 1 1 5 ARG CG C -6.166 -6.541 -0.477 1.00 . A A . 5 ARG CG 1 1 12 8305 1 1 5 ARG CZ C -7.893 -4.637 -2.362 1.00 . A A . 5 ARG CZ 1 1 12 8306 1 1 5 ARG H H -3.720 -4.287 2.183 1.00 . A A . 5 ARG H 1 1 12 8307 1 1 5 ARG HA H -3.798 -6.539 0.291 1.00 . A A . 5 ARG HA 1 1 12 8308 1 1 5 ARG HB2 H -6.097 -4.868 0.847 1.00 . A A . 5 ARG HB2 1 1 12 8309 1 1 5 ARG HB3 H -5.513 -4.526 -0.802 1.00 . A A . 5 ARG HB3 1 1 12 8310 1 1 5 ARG HD2 H -8.127 -7.193 -1.155 1.00 . A A . 5 ARG HD2 1 1 12 8311 1 1 5 ARG HD3 H -8.095 -6.455 0.441 1.00 . A A . 5 ARG HD3 1 1 12 8312 1 1 5 ARG HG2 H -5.741 -6.794 -1.444 1.00 . A A . 5 ARG HG2 1 1 12 8313 1 1 5 ARG HG3 H -5.922 -7.339 0.224 1.00 . A A . 5 ARG HG3 1 1 12 8314 1 1 5 ARG HH11 H -7.215 -6.431 -3.061 1.00 . A A . 5 ARG HH11 1 1 12 8315 1 1 5 ARG HH12 H -7.199 -5.102 -4.211 1.00 . A A . 5 ARG HH12 1 1 12 8316 1 1 5 ARG HH21 H -8.532 -2.716 -2.023 1.00 . A A . 5 ARG HH21 1 1 12 8317 1 1 5 ARG HH22 H -7.925 -3.060 -3.634 1.00 . A A . 5 ARG HH22 1 1 12 8318 1 1 5 ARG N N -3.968 -5.234 1.906 1.00 . A A . 5 ARG N 1 1 12 8319 1 1 5 ARG NE N -8.083 -5.064 -1.104 1.00 . A A . 5 ARG NE 1 1 12 8320 1 1 5 ARG NH1 N -7.406 -5.467 -3.286 1.00 . A A . 5 ARG NH1 1 1 12 8321 1 1 5 ARG NH2 N -8.165 -3.377 -2.696 1.00 . A A . 5 ARG NH2 1 1 12 8322 1 1 5 ARG O O -2.724 -3.557 0.219 1.00 . A A . 5 ARG O 1 1 12 8323 1 1 6 PRO C C -1.551 -3.216 -2.762 1.00 . A A . 6 PRO C 1 1 12 8324 1 1 6 PRO CA C -1.340 -4.515 -1.980 1.00 . A A . 6 PRO CA 1 1 12 8325 1 1 6 PRO CB C -0.768 -5.610 -2.890 1.00 . A A . 6 PRO CB 1 1 12 8326 1 1 6 PRO CD C -2.920 -6.283 -2.151 1.00 . A A . 6 PRO CD 1 1 12 8327 1 1 6 PRO CG C -2.023 -6.318 -3.387 1.00 . A A . 6 PRO CG 1 1 12 8328 1 1 6 PRO HA H -0.662 -4.355 -1.148 1.00 . A A . 6 PRO HA 1 1 12 8329 1 1 6 PRO HB2 H -0.163 -5.226 -3.712 1.00 . A A . 6 PRO HB2 1 1 12 8330 1 1 6 PRO HB3 H -0.179 -6.309 -2.295 1.00 . A A . 6 PRO HB3 1 1 12 8331 1 1 6 PRO HD2 H -3.960 -6.261 -2.463 1.00 . A A . 6 PRO HD2 1 1 12 8332 1 1 6 PRO HD3 H -2.715 -7.164 -1.542 1.00 . A A . 6 PRO HD3 1 1 12 8333 1 1 6 PRO HG2 H -2.481 -5.731 -4.186 1.00 . A A . 6 PRO HG2 1 1 12 8334 1 1 6 PRO HG3 H -1.825 -7.334 -3.731 1.00 . A A . 6 PRO HG3 1 1 12 8335 1 1 6 PRO N N -2.560 -5.071 -1.438 1.00 . A A . 6 PRO N 1 1 12 8336 1 1 6 PRO O O -2.676 -2.781 -3.031 1.00 . A A . 6 PRO O 1 1 12 8337 1 1 7 SER C C -1.095 -2.129 -5.487 1.00 . A A . 7 SER C 1 1 12 8338 1 1 7 SER CA C -0.313 -1.668 -4.255 1.00 . A A . 7 SER CA 1 1 12 8339 1 1 7 SER CB C 1.170 -1.553 -4.626 1.00 . A A . 7 SER CB 1 1 12 8340 1 1 7 SER H H 0.451 -2.926 -2.772 1.00 . A A . 7 SER H 1 1 12 8341 1 1 7 SER HA H -0.655 -0.686 -3.928 1.00 . A A . 7 SER HA 1 1 12 8342 1 1 7 SER HB2 H 1.196 -1.008 -5.565 1.00 . A A . 7 SER HB2 1 1 12 8343 1 1 7 SER HB3 H 1.708 -0.991 -3.864 1.00 . A A . 7 SER HB3 1 1 12 8344 1 1 7 SER HG H 1.106 -3.344 -5.315 1.00 . A A . 7 SER HG 1 1 12 8345 1 1 7 SER N N -0.429 -2.636 -3.184 1.00 . A A . 7 SER N 1 1 12 8346 1 1 7 SER O O -0.634 -3.039 -6.177 1.00 . A A . 7 SER O 1 1 12 8347 1 1 7 SER OG O 1.757 -2.836 -4.804 1.00 . A A . 7 SER OG 1 1 12 8348 1 1 8 GLN C C -2.658 -0.300 -7.846 1.00 . A A . 8 GLN C 1 1 12 8349 1 1 8 GLN CA C -2.927 -1.570 -7.038 1.00 . A A . 8 GLN CA 1 1 12 8350 1 1 8 GLN CB C -4.424 -1.729 -6.767 1.00 . A A . 8 GLN CB 1 1 12 8351 1 1 8 GLN CD C -6.213 -3.407 -6.138 1.00 . A A . 8 GLN CD 1 1 12 8352 1 1 8 GLN CG C -4.727 -3.067 -6.082 1.00 . A A . 8 GLN CG 1 1 12 8353 1 1 8 GLN H H -2.563 -0.782 -5.133 1.00 . A A . 8 GLN H 1 1 12 8354 1 1 8 GLN HA H -2.581 -2.424 -7.622 1.00 . A A . 8 GLN HA 1 1 12 8355 1 1 8 GLN HB2 H -4.804 -0.909 -6.159 1.00 . A A . 8 GLN HB2 1 1 12 8356 1 1 8 GLN HB3 H -4.913 -1.684 -7.732 1.00 . A A . 8 GLN HB3 1 1 12 8357 1 1 8 GLN HE21 H -6.181 -3.533 -8.168 1.00 . A A . 8 GLN HE21 1 1 12 8358 1 1 8 GLN HE22 H -7.731 -3.828 -7.410 1.00 . A A . 8 GLN HE22 1 1 12 8359 1 1 8 GLN HG2 H -4.167 -3.861 -6.573 1.00 . A A . 8 GLN HG2 1 1 12 8360 1 1 8 GLN HG3 H -4.409 -3.019 -5.040 1.00 . A A . 8 GLN HG3 1 1 12 8361 1 1 8 GLN N N -2.222 -1.479 -5.776 1.00 . A A . 8 GLN N 1 1 12 8362 1 1 8 GLN NE2 N -6.750 -3.611 -7.335 1.00 . A A . 8 GLN NE2 1 1 12 8363 1 1 8 GLN O O -2.371 -0.363 -9.035 1.00 . A A . 8 GLN O 1 1 12 8364 1 1 8 GLN OE1 O -6.880 -3.504 -5.110 1.00 . A A . 8 GLN OE1 1 1 12 8365 1 1 9 THR C C -0.983 2.304 -8.055 1.00 . A A . 9 THR C 1 1 12 8366 1 1 9 THR CA C -2.478 2.146 -7.806 1.00 . A A . 9 THR CA 1 1 12 8367 1 1 9 THR CB C -2.946 3.248 -6.849 1.00 . A A . 9 THR CB 1 1 12 8368 1 1 9 THR CG2 C -4.468 3.351 -6.840 1.00 . A A . 9 THR CG2 1 1 12 8369 1 1 9 THR H H -2.977 0.839 -6.202 1.00 . A A . 9 THR H 1 1 12 8370 1 1 9 THR HA H -3.011 2.224 -8.755 1.00 . A A . 9 THR HA 1 1 12 8371 1 1 9 THR HB H -2.547 4.196 -7.211 1.00 . A A . 9 THR HB 1 1 12 8372 1 1 9 THR HG1 H -3.002 2.333 -5.103 1.00 . A A . 9 THR HG1 1 1 12 8373 1 1 9 THR HG21 H -4.918 2.383 -6.642 1.00 . A A . 9 THR HG21 1 1 12 8374 1 1 9 THR HG22 H -4.771 4.051 -6.066 1.00 . A A . 9 THR HG22 1 1 12 8375 1 1 9 THR HG23 H -4.812 3.718 -7.808 1.00 . A A . 9 THR HG23 1 1 12 8376 1 1 9 THR N N -2.727 0.855 -7.181 1.00 . A A . 9 THR N 1 1 12 8377 1 1 9 THR O O -0.537 2.574 -9.172 1.00 . A A . 9 THR O 1 1 12 8378 1 1 9 THR OG1 O -2.464 3.017 -5.529 1.00 . A A . 9 THR OG1 1 1 12 8379 1 1 10 TRP C C 1.846 1.175 -7.800 1.00 . A A . 10 TRP C 1 1 12 8380 1 1 10 TRP CA C 1.223 2.273 -6.931 1.00 . A A . 10 TRP CA 1 1 12 8381 1 1 10 TRP CB C 1.656 2.181 -5.463 1.00 . A A . 10 TRP CB 1 1 12 8382 1 1 10 TRP CD1 C 4.178 1.786 -5.528 1.00 . A A . 10 TRP CD1 1 1 12 8383 1 1 10 TRP CD2 C 3.588 3.564 -4.307 1.00 . A A . 10 TRP CD2 1 1 12 8384 1 1 10 TRP CE2 C 4.995 3.411 -4.159 1.00 . A A . 10 TRP CE2 1 1 12 8385 1 1 10 TRP CE3 C 2.988 4.663 -3.659 1.00 . A A . 10 TRP CE3 1 1 12 8386 1 1 10 TRP CG C 3.087 2.485 -5.139 1.00 . A A . 10 TRP CG 1 1 12 8387 1 1 10 TRP CH2 C 5.080 5.248 -2.596 1.00 . A A . 10 TRP CH2 1 1 12 8388 1 1 10 TRP CZ2 C 5.749 4.267 -3.342 1.00 . A A . 10 TRP CZ2 1 1 12 8389 1 1 10 TRP CZ3 C 3.713 5.471 -2.774 1.00 . A A . 10 TRP CZ3 1 1 12 8390 1 1 10 TRP H H -0.719 2.000 -6.105 1.00 . A A . 10 TRP H 1 1 12 8391 1 1 10 TRP HA H 1.483 3.266 -7.306 1.00 . A A . 10 TRP HA 1 1 12 8392 1 1 10 TRP HB2 H 1.049 2.892 -4.902 1.00 . A A . 10 TRP HB2 1 1 12 8393 1 1 10 TRP HB3 H 1.423 1.193 -5.075 1.00 . A A . 10 TRP HB3 1 1 12 8394 1 1 10 TRP HD1 H 4.163 0.904 -6.152 1.00 . A A . 10 TRP HD1 1 1 12 8395 1 1 10 TRP HE1 H 6.267 2.035 -5.145 1.00 . A A . 10 TRP HE1 1 1 12 8396 1 1 10 TRP HE3 H 1.960 4.884 -3.859 1.00 . A A . 10 TRP HE3 1 1 12 8397 1 1 10 TRP HH2 H 5.586 5.837 -1.870 1.00 . A A . 10 TRP HH2 1 1 12 8398 1 1 10 TRP HZ2 H 6.816 4.158 -3.252 1.00 . A A . 10 TRP HZ2 1 1 12 8399 1 1 10 TRP HZ3 H 3.240 6.266 -2.217 1.00 . A A . 10 TRP HZ3 1 1 12 8400 1 1 10 TRP N N -0.220 2.142 -6.974 1.00 . A A . 10 TRP N 1 1 12 8401 1 1 10 TRP NE1 N 5.314 2.343 -4.975 1.00 . A A . 10 TRP NE1 1 1 12 8402 1 1 10 TRP O O 2.290 0.137 -7.310 1.00 . A A . 10 TRP O 1 1 12 8403 1 1 11 SER C C 3.730 0.250 -10.192 1.00 . A A . 11 SER C 1 1 12 8404 1 1 11 SER CA C 2.212 0.349 -10.063 1.00 . A A . 11 SER CA 1 1 12 8405 1 1 11 SER CB C 1.525 0.645 -11.400 1.00 . A A . 11 SER CB 1 1 12 8406 1 1 11 SER H H 1.352 2.198 -9.451 1.00 . A A . 11 SER H 1 1 12 8407 1 1 11 SER HA H 1.859 -0.609 -9.680 1.00 . A A . 11 SER HA 1 1 12 8408 1 1 11 SER HB2 H 1.895 1.587 -11.810 1.00 . A A . 11 SER HB2 1 1 12 8409 1 1 11 SER HB3 H 1.756 -0.154 -12.109 1.00 . A A . 11 SER HB3 1 1 12 8410 1 1 11 SER HG H -0.103 1.367 -10.542 1.00 . A A . 11 SER HG 1 1 12 8411 1 1 11 SER N N 1.846 1.380 -9.111 1.00 . A A . 11 SER N 1 1 12 8412 1 1 11 SER O O 4.288 0.526 -11.251 1.00 . A A . 11 SER O 1 1 12 8413 1 1 11 SER OG O 0.122 0.716 -11.221 1.00 . A A . 11 SER OG 1 1 12 8414 1 1 12 GLY C C 6.338 -0.737 -7.720 1.00 . A A . 12 GLY C 1 1 12 8415 1 1 12 GLY CA C 5.842 -0.276 -9.087 1.00 . A A . 12 GLY CA 1 1 12 8416 1 1 12 GLY H H 3.879 -0.336 -8.256 1.00 . A A . 12 GLY H 1 1 12 8417 1 1 12 GLY HA2 H 6.155 -1.002 -9.839 1.00 . A A . 12 GLY HA2 1 1 12 8418 1 1 12 GLY HA3 H 6.284 0.693 -9.323 1.00 . A A . 12 GLY HA3 1 1 12 8419 1 1 12 GLY N N 4.399 -0.147 -9.108 1.00 . A A . 12 GLY N 1 1 12 8420 1 1 12 GLY O O 5.576 -1.288 -6.917 1.00 . A A . 12 GLY O 1 1 12 8421 1 1 13 ASN C C 8.213 0.438 -5.313 1.00 . A A . 13 ASN C 1 1 12 8422 1 1 13 ASN CA C 8.317 -0.793 -6.226 1.00 . A A . 13 ASN CA 1 1 12 8423 1 1 13 ASN CB C 9.772 -1.155 -6.557 1.00 . A A . 13 ASN CB 1 1 12 8424 1 1 13 ASN CG C 10.541 -1.641 -5.336 1.00 . A A . 13 ASN CG 1 1 12 8425 1 1 13 ASN H H 8.152 -0.003 -8.176 1.00 . A A . 13 ASN H 1 1 12 8426 1 1 13 ASN HA H 7.846 -1.652 -5.751 1.00 . A A . 13 ASN HA 1 1 12 8427 1 1 13 ASN HB2 H 9.772 -1.962 -7.291 1.00 . A A . 13 ASN HB2 1 1 12 8428 1 1 13 ASN HB3 H 10.276 -0.294 -6.994 1.00 . A A . 13 ASN HB3 1 1 12 8429 1 1 13 ASN HD21 H 11.296 0.222 -4.977 1.00 . A A . 13 ASN HD21 1 1 12 8430 1 1 13 ASN HD22 H 11.743 -1.008 -3.829 1.00 . A A . 13 ASN HD22 1 1 12 8431 1 1 13 ASN N N 7.630 -0.511 -7.478 1.00 . A A . 13 ASN N 1 1 12 8432 1 1 13 ASN ND2 N 11.264 -0.740 -4.677 1.00 . A A . 13 ASN ND2 1 1 12 8433 1 1 13 ASN O O 7.919 1.531 -5.796 1.00 . A A . 13 ASN O 1 1 12 8434 1 1 13 ASN OD1 O 10.483 -2.819 -4.987 1.00 . A A . 13 ASN OD1 1 1 12 8435 1 1 14 CYS C C 9.646 1.661 -2.352 1.00 . A A . 14 CYS C 1 1 12 8436 1 1 14 CYS CA C 8.306 1.357 -3.019 1.00 . A A . 14 CYS CA 1 1 12 8437 1 1 14 CYS CB C 7.279 1.011 -1.933 1.00 . A A . 14 CYS CB 1 1 12 8438 1 1 14 CYS H H 8.556 -0.655 -3.648 1.00 . A A . 14 CYS H 1 1 12 8439 1 1 14 CYS HA H 7.967 2.268 -3.506 1.00 . A A . 14 CYS HA 1 1 12 8440 1 1 14 CYS HB2 H 6.278 1.011 -2.364 1.00 . A A . 14 CYS HB2 1 1 12 8441 1 1 14 CYS HB3 H 7.487 0.023 -1.526 1.00 . A A . 14 CYS HB3 1 1 12 8442 1 1 14 CYS N N 8.407 0.283 -4.001 1.00 . A A . 14 CYS N 1 1 12 8443 1 1 14 CYS O O 10.427 0.755 -2.068 1.00 . A A . 14 CYS O 1 1 12 8444 1 1 14 CYS SG S 7.317 2.184 -0.552 1.00 . A A . 14 CYS SG 1 1 12 8445 1 1 15 GLY C C 9.967 4.292 -0.032 1.00 . A A . 15 GLY C 1 1 12 8446 1 1 15 GLY CA C 10.758 3.412 -1.003 1.00 . A A . 15 GLY CA 1 1 12 8447 1 1 15 GLY H H 9.174 3.603 -2.381 1.00 . A A . 15 GLY H 1 1 12 8448 1 1 15 GLY HA2 H 11.182 2.577 -0.449 1.00 . A A . 15 GLY HA2 1 1 12 8449 1 1 15 GLY HA3 H 11.567 3.993 -1.447 1.00 . A A . 15 GLY HA3 1 1 12 8450 1 1 15 GLY N N 9.862 2.945 -2.052 1.00 . A A . 15 GLY N 1 1 12 8451 1 1 15 GLY O O 9.936 4.066 1.176 1.00 . A A . 15 GLY O 1 1 12 8452 1 1 16 ASN C C 7.305 5.844 0.851 1.00 . A A . 16 ASN C 1 1 12 8453 1 1 16 ASN CA C 8.598 6.332 0.183 1.00 . A A . 16 ASN CA 1 1 12 8454 1 1 16 ASN CB C 8.357 7.551 -0.716 1.00 . A A . 16 ASN CB 1 1 12 8455 1 1 16 ASN CG C 7.956 8.780 0.091 1.00 . A A . 16 ASN CG 1 1 12 8456 1 1 16 ASN H H 9.372 5.423 -1.578 1.00 . A A . 16 ASN H 1 1 12 8457 1 1 16 ASN HA H 9.280 6.652 0.977 1.00 . A A . 16 ASN HA 1 1 12 8458 1 1 16 ASN HB2 H 9.288 7.792 -1.234 1.00 . A A . 16 ASN HB2 1 1 12 8459 1 1 16 ASN HB3 H 7.589 7.338 -1.460 1.00 . A A . 16 ASN HB3 1 1 12 8460 1 1 16 ASN HD21 H 8.372 10.028 -1.467 1.00 . A A . 16 ASN HD21 1 1 12 8461 1 1 16 ASN HD22 H 7.800 10.786 0.006 1.00 . A A . 16 ASN HD22 1 1 12 8462 1 1 16 ASN N N 9.279 5.296 -0.584 1.00 . A A . 16 ASN N 1 1 12 8463 1 1 16 ASN ND2 N 8.021 9.957 -0.522 1.00 . A A . 16 ASN ND2 1 1 12 8464 1 1 16 ASN O O 6.198 6.218 0.457 1.00 . A A . 16 ASN O 1 1 12 8465 1 1 16 ASN OD1 O 7.572 8.678 1.251 1.00 . A A . 16 ASN OD1 1 1 12 8466 1 1 17 THR C C 5.471 5.833 3.234 1.00 . A A . 17 THR C 1 1 12 8467 1 1 17 THR CA C 6.298 4.637 2.729 1.00 . A A . 17 THR CA 1 1 12 8468 1 1 17 THR CB C 6.750 3.682 3.846 1.00 . A A . 17 THR CB 1 1 12 8469 1 1 17 THR CG2 C 7.479 4.390 4.995 1.00 . A A . 17 THR CG2 1 1 12 8470 1 1 17 THR H H 8.369 4.710 2.134 1.00 . A A . 17 THR H 1 1 12 8471 1 1 17 THR HA H 5.660 4.054 2.074 1.00 . A A . 17 THR HA 1 1 12 8472 1 1 17 THR HB H 7.445 2.966 3.408 1.00 . A A . 17 THR HB 1 1 12 8473 1 1 17 THR HG1 H 5.041 3.570 4.774 1.00 . A A . 17 THR HG1 1 1 12 8474 1 1 17 THR HG21 H 8.332 4.947 4.610 1.00 . A A . 17 THR HG21 1 1 12 8475 1 1 17 THR HG22 H 6.811 5.069 5.523 1.00 . A A . 17 THR HG22 1 1 12 8476 1 1 17 THR HG23 H 7.843 3.641 5.700 1.00 . A A . 17 THR HG23 1 1 12 8477 1 1 17 THR N N 7.439 5.062 1.922 1.00 . A A . 17 THR N 1 1 12 8478 1 1 17 THR O O 4.250 5.738 3.380 1.00 . A A . 17 THR O 1 1 12 8479 1 1 17 THR OG1 O 5.645 2.953 4.347 1.00 . A A . 17 THR OG1 1 1 12 8480 1 1 18 ALA C C 4.518 8.735 2.775 1.00 . A A . 18 ALA C 1 1 12 8481 1 1 18 ALA CA C 5.434 8.196 3.879 1.00 . A A . 18 ALA CA 1 1 12 8482 1 1 18 ALA CB C 6.444 9.247 4.348 1.00 . A A . 18 ALA CB 1 1 12 8483 1 1 18 ALA H H 7.114 7.027 3.300 1.00 . A A . 18 ALA H 1 1 12 8484 1 1 18 ALA HA H 4.801 7.953 4.735 1.00 . A A . 18 ALA HA 1 1 12 8485 1 1 18 ALA HB1 H 7.064 8.833 5.144 1.00 . A A . 18 ALA HB1 1 1 12 8486 1 1 18 ALA HB2 H 7.085 9.566 3.527 1.00 . A A . 18 ALA HB2 1 1 12 8487 1 1 18 ALA HB3 H 5.912 10.116 4.735 1.00 . A A . 18 ALA HB3 1 1 12 8488 1 1 18 ALA N N 6.119 6.979 3.467 1.00 . A A . 18 ALA N 1 1 12 8489 1 1 18 ALA O O 3.562 9.448 3.084 1.00 . A A . 18 ALA O 1 1 12 8490 1 1 19 HIS C C 2.783 7.450 0.495 1.00 . A A . 19 HIS C 1 1 12 8491 1 1 19 HIS CA C 3.792 8.594 0.436 1.00 . A A . 19 HIS CA 1 1 12 8492 1 1 19 HIS CB C 4.445 8.696 -0.952 1.00 . A A . 19 HIS CB 1 1 12 8493 1 1 19 HIS CD2 C 2.150 9.196 -2.127 1.00 . A A . 19 HIS CD2 1 1 12 8494 1 1 19 HIS CE1 C 2.730 8.599 -4.152 1.00 . A A . 19 HIS CE1 1 1 12 8495 1 1 19 HIS CG C 3.479 8.839 -2.110 1.00 . A A . 19 HIS CG 1 1 12 8496 1 1 19 HIS H H 5.610 7.869 1.298 1.00 . A A . 19 HIS H 1 1 12 8497 1 1 19 HIS HA H 3.259 9.531 0.604 1.00 . A A . 19 HIS HA 1 1 12 8498 1 1 19 HIS HB2 H 5.114 9.542 -0.981 1.00 . A A . 19 HIS HB2 1 1 12 8499 1 1 19 HIS HB3 H 5.043 7.806 -1.115 1.00 . A A . 19 HIS HB3 1 1 12 8500 1 1 19 HIS HD1 H 4.773 8.300 -3.749 1.00 . A A . 19 HIS HD1 1 1 12 8501 1 1 19 HIS HD2 H 1.556 9.463 -1.258 1.00 . A A . 19 HIS HD2 1 1 12 8502 1 1 19 HIS HE1 H 2.673 8.348 -5.202 1.00 . A A . 19 HIS HE1 1 1 12 8503 1 1 19 HIS N N 4.773 8.412 1.501 1.00 . A A . 19 HIS N 1 1 12 8504 1 1 19 HIS ND1 N 3.855 8.566 -3.418 1.00 . A A . 19 HIS ND1 1 1 12 8505 1 1 19 HIS NE2 N 1.673 8.952 -3.405 1.00 . A A . 19 HIS NE2 1 1 12 8506 1 1 19 HIS O O 1.590 7.728 0.486 1.00 . A A . 19 HIS O 1 1 12 8507 1 1 20 CYS C C 1.153 5.196 1.492 1.00 . A A . 20 CYS C 1 1 12 8508 1 1 20 CYS CA C 2.339 5.020 0.546 1.00 . A A . 20 CYS CA 1 1 12 8509 1 1 20 CYS CB C 3.083 3.752 0.945 1.00 . A A . 20 CYS CB 1 1 12 8510 1 1 20 CYS H H 4.239 6.039 0.556 1.00 . A A . 20 CYS H 1 1 12 8511 1 1 20 CYS HA H 1.958 4.876 -0.465 1.00 . A A . 20 CYS HA 1 1 12 8512 1 1 20 CYS HB2 H 3.850 3.548 0.202 1.00 . A A . 20 CYS HB2 1 1 12 8513 1 1 20 CYS HB3 H 3.537 3.896 1.918 1.00 . A A . 20 CYS HB3 1 1 12 8514 1 1 20 CYS N N 3.233 6.189 0.543 1.00 . A A . 20 CYS N 1 1 12 8515 1 1 20 CYS O O 0.005 4.937 1.129 1.00 . A A . 20 CYS O 1 1 12 8516 1 1 20 CYS SG S 2.018 2.307 1.152 1.00 . A A . 20 CYS SG 1 1 12 8517 1 1 21 ASP C C -0.668 6.889 3.182 1.00 . A A . 21 ASP C 1 1 12 8518 1 1 21 ASP CA C 0.358 5.860 3.669 1.00 . A A . 21 ASP CA 1 1 12 8519 1 1 21 ASP CB C 0.925 6.270 5.029 1.00 . A A . 21 ASP CB 1 1 12 8520 1 1 21 ASP CG C -0.220 6.344 6.029 1.00 . A A . 21 ASP CG 1 1 12 8521 1 1 21 ASP H H 2.395 5.840 2.972 1.00 . A A . 21 ASP H 1 1 12 8522 1 1 21 ASP HA H -0.146 4.898 3.783 1.00 . A A . 21 ASP HA 1 1 12 8523 1 1 21 ASP HB2 H 1.648 5.527 5.367 1.00 . A A . 21 ASP HB2 1 1 12 8524 1 1 21 ASP HB3 H 1.417 7.241 4.960 1.00 . A A . 21 ASP HB3 1 1 12 8525 1 1 21 ASP N N 1.426 5.685 2.703 1.00 . A A . 21 ASP N 1 1 12 8526 1 1 21 ASP O O -1.864 6.681 3.371 1.00 . A A . 21 ASP O 1 1 12 8527 1 1 21 ASP OD1 O -0.597 5.306 6.575 1.00 . A A . 21 ASP OD1 1 1 12 8528 1 1 21 ASP OD2 O -0.787 7.569 6.197 1.00 . A A . 21 ASP OD2 1 1 12 8529 1 1 22 LYS C C -1.913 8.278 0.837 1.00 . A A . 22 LYS C 1 1 12 8530 1 1 22 LYS CA C -1.134 8.953 1.959 1.00 . A A . 22 LYS CA 1 1 12 8531 1 1 22 LYS CB C -0.420 10.189 1.394 1.00 . A A . 22 LYS CB 1 1 12 8532 1 1 22 LYS CD C 1.081 12.140 1.886 1.00 . A A . 22 LYS CD 1 1 12 8533 1 1 22 LYS CE C 1.967 12.852 2.919 1.00 . A A . 22 LYS CE 1 1 12 8534 1 1 22 LYS CG C 0.525 10.806 2.411 1.00 . A A . 22 LYS CG 1 1 12 8535 1 1 22 LYS H H 0.755 8.004 2.268 1.00 . A A . 22 LYS H 1 1 12 8536 1 1 22 LYS HA H -1.789 9.309 2.750 1.00 . A A . 22 LYS HA 1 1 12 8537 1 1 22 LYS HB2 H 0.144 9.934 0.500 1.00 . A A . 22 LYS HB2 1 1 12 8538 1 1 22 LYS HB3 H -1.175 10.925 1.123 1.00 . A A . 22 LYS HB3 1 1 12 8539 1 1 22 LYS HD2 H 1.627 11.979 0.958 1.00 . A A . 22 LYS HD2 1 1 12 8540 1 1 22 LYS HD3 H 0.234 12.797 1.667 1.00 . A A . 22 LYS HD3 1 1 12 8541 1 1 22 LYS HE2 H 2.228 13.843 2.543 1.00 . A A . 22 LYS HE2 1 1 12 8542 1 1 22 LYS HE3 H 1.398 12.978 3.843 1.00 . A A . 22 LYS HE3 1 1 12 8543 1 1 22 LYS HG2 H -0.001 10.951 3.356 1.00 . A A . 22 LYS HG2 1 1 12 8544 1 1 22 LYS HG3 H 1.301 10.061 2.522 1.00 . A A . 22 LYS HG3 1 1 12 8545 1 1 22 LYS HZ1 H 3.049 11.099 3.048 1.00 . A A . 22 LYS HZ1 1 1 12 8546 1 1 22 LYS HZ2 H 3.961 12.437 2.594 1.00 . A A . 22 LYS HZ2 1 1 12 8547 1 1 22 LYS N N -0.220 7.974 2.541 1.00 . A A . 22 LYS N 1 1 12 8548 1 1 22 LYS NZ N 3.207 12.104 3.210 1.00 . A A . 22 LYS NZ 1 1 12 8549 1 1 22 LYS O O -3.138 8.263 0.826 1.00 . A A . 22 LYS O 1 1 12 8550 1 1 23 GLN C C -2.793 6.192 -1.064 1.00 . A A . 23 GLN C 1 1 12 8551 1 1 23 GLN CA C -1.613 7.121 -1.355 1.00 . A A . 23 GLN CA 1 1 12 8552 1 1 23 GLN CB C -0.406 6.358 -1.923 1.00 . A A . 23 GLN CB 1 1 12 8553 1 1 23 GLN CD C -0.544 6.073 -4.446 1.00 . A A . 23 GLN CD 1 1 12 8554 1 1 23 GLN CG C -0.665 5.392 -3.082 1.00 . A A . 23 GLN CG 1 1 12 8555 1 1 23 GLN H H -0.163 7.720 0.061 1.00 . A A . 23 GLN H 1 1 12 8556 1 1 23 GLN HA H -1.934 7.904 -2.041 1.00 . A A . 23 GLN HA 1 1 12 8557 1 1 23 GLN HB2 H 0.407 7.039 -2.153 1.00 . A A . 23 GLN HB2 1 1 12 8558 1 1 23 GLN HB3 H -0.046 5.718 -1.127 1.00 . A A . 23 GLN HB3 1 1 12 8559 1 1 23 GLN HE21 H -1.225 4.400 -5.393 1.00 . A A . 23 GLN HE21 1 1 12 8560 1 1 23 GLN HE22 H -0.655 5.697 -6.434 1.00 . A A . 23 GLN HE22 1 1 12 8561 1 1 23 GLN HG2 H 0.098 4.617 -3.012 1.00 . A A . 23 GLN HG2 1 1 12 8562 1 1 23 GLN HG3 H -1.624 4.899 -2.983 1.00 . A A . 23 GLN HG3 1 1 12 8563 1 1 23 GLN N N -1.161 7.719 -0.111 1.00 . A A . 23 GLN N 1 1 12 8564 1 1 23 GLN NE2 N -0.815 5.326 -5.509 1.00 . A A . 23 GLN NE2 1 1 12 8565 1 1 23 GLN O O -3.853 6.293 -1.678 1.00 . A A . 23 GLN O 1 1 12 8566 1 1 23 GLN OE1 O -0.161 7.240 -4.542 1.00 . A A . 23 GLN OE1 1 1 12 8567 1 1 24 CYS C C -4.962 4.991 0.679 1.00 . A A . 24 CYS C 1 1 12 8568 1 1 24 CYS CA C -3.648 4.322 0.256 1.00 . A A . 24 CYS CA 1 1 12 8569 1 1 24 CYS CB C -3.091 3.432 1.361 1.00 . A A . 24 CYS CB 1 1 12 8570 1 1 24 CYS H H -1.718 5.230 0.360 1.00 . A A . 24 CYS H 1 1 12 8571 1 1 24 CYS HA H -3.863 3.710 -0.620 1.00 . A A . 24 CYS HA 1 1 12 8572 1 1 24 CYS HB2 H -2.641 4.054 2.135 1.00 . A A . 24 CYS HB2 1 1 12 8573 1 1 24 CYS HB3 H -3.896 2.859 1.810 1.00 . A A . 24 CYS HB3 1 1 12 8574 1 1 24 CYS N N -2.621 5.286 -0.108 1.00 . A A . 24 CYS N 1 1 12 8575 1 1 24 CYS O O -6.045 4.474 0.389 1.00 . A A . 24 CYS O 1 1 12 8576 1 1 24 CYS SG S -1.873 2.243 0.768 1.00 . A A . 24 CYS SG 1 1 12 8577 1 1 25 GLN C C -6.594 7.684 0.590 1.00 . A A . 25 GLN C 1 1 12 8578 1 1 25 GLN CA C -6.036 6.899 1.786 1.00 . A A . 25 GLN CA 1 1 12 8579 1 1 25 GLN CB C -5.644 7.824 2.954 1.00 . A A . 25 GLN CB 1 1 12 8580 1 1 25 GLN CD C -4.541 7.854 5.272 1.00 . A A . 25 GLN CD 1 1 12 8581 1 1 25 GLN CG C -5.154 7.005 4.158 1.00 . A A . 25 GLN CG 1 1 12 8582 1 1 25 GLN H H -3.963 6.566 1.476 1.00 . A A . 25 GLN H 1 1 12 8583 1 1 25 GLN HA H -6.790 6.210 2.163 1.00 . A A . 25 GLN HA 1 1 12 8584 1 1 25 GLN HB2 H -4.856 8.514 2.653 1.00 . A A . 25 GLN HB2 1 1 12 8585 1 1 25 GLN HB3 H -6.519 8.405 3.246 1.00 . A A . 25 GLN HB3 1 1 12 8586 1 1 25 GLN HE21 H -6.064 9.199 5.197 1.00 . A A . 25 GLN HE21 1 1 12 8587 1 1 25 GLN HE22 H -4.808 9.521 6.377 1.00 . A A . 25 GLN HE22 1 1 12 8588 1 1 25 GLN HG2 H -5.991 6.443 4.567 1.00 . A A . 25 GLN HG2 1 1 12 8589 1 1 25 GLN HG3 H -4.393 6.302 3.824 1.00 . A A . 25 GLN HG3 1 1 12 8590 1 1 25 GLN N N -4.875 6.139 1.351 1.00 . A A . 25 GLN N 1 1 12 8591 1 1 25 GLN NE2 N -5.187 8.960 5.629 1.00 . A A . 25 GLN NE2 1 1 12 8592 1 1 25 GLN O O -7.728 7.470 0.153 1.00 . A A . 25 GLN O 1 1 12 8593 1 1 25 GLN OE1 O -3.487 7.525 5.816 1.00 . A A . 25 GLN OE1 1 1 12 8594 1 1 26 ASP C C -6.605 8.798 -2.231 1.00 . A A . 26 ASP C 1 1 12 8595 1 1 26 ASP CA C -6.121 9.537 -0.995 1.00 . A A . 26 ASP CA 1 1 12 8596 1 1 26 ASP CB C -4.928 10.427 -1.363 1.00 . A A . 26 ASP CB 1 1 12 8597 1 1 26 ASP CG C -4.578 11.419 -0.263 1.00 . A A . 26 ASP CG 1 1 12 8598 1 1 26 ASP H H -4.830 8.631 0.429 1.00 . A A . 26 ASP H 1 1 12 8599 1 1 26 ASP HA H -6.921 10.182 -0.647 1.00 . A A . 26 ASP HA 1 1 12 8600 1 1 26 ASP HB2 H -4.060 9.816 -1.598 1.00 . A A . 26 ASP HB2 1 1 12 8601 1 1 26 ASP HB3 H -5.185 10.992 -2.257 1.00 . A A . 26 ASP HB3 1 1 12 8602 1 1 26 ASP N N -5.772 8.597 0.060 1.00 . A A . 26 ASP N 1 1 12 8603 1 1 26 ASP O O -7.708 9.046 -2.712 1.00 . A A . 26 ASP O 1 1 12 8604 1 1 26 ASP OD1 O -5.535 12.334 0.051 1.00 . A A . 26 ASP OD1 1 1 12 8605 1 1 26 ASP OD2 O -3.479 11.359 0.278 1.00 . A A . 26 ASP OD2 1 1 12 8606 1 1 27 TRP C C -6.913 5.960 -3.595 1.00 . A A . 27 TRP C 1 1 12 8607 1 1 27 TRP CA C -6.066 7.173 -3.964 1.00 . A A . 27 TRP CA 1 1 12 8608 1 1 27 TRP CB C -4.778 6.683 -4.635 1.00 . A A . 27 TRP CB 1 1 12 8609 1 1 27 TRP CD1 C -3.415 8.803 -4.703 1.00 . A A . 27 TRP CD1 1 1 12 8610 1 1 27 TRP CD2 C -3.283 7.633 -6.602 1.00 . A A . 27 TRP CD2 1 1 12 8611 1 1 27 TRP CE2 C -2.372 8.723 -6.722 1.00 . A A . 27 TRP CE2 1 1 12 8612 1 1 27 TRP CE3 C -3.394 6.751 -7.693 1.00 . A A . 27 TRP CE3 1 1 12 8613 1 1 27 TRP CG C -3.886 7.684 -5.282 1.00 . A A . 27 TRP CG 1 1 12 8614 1 1 27 TRP CH2 C -1.665 7.955 -8.907 1.00 . A A . 27 TRP CH2 1 1 12 8615 1 1 27 TRP CZ2 C -1.576 8.895 -7.865 1.00 . A A . 27 TRP CZ2 1 1 12 8616 1 1 27 TRP CZ3 C -2.587 6.899 -8.830 1.00 . A A . 27 TRP CZ3 1 1 12 8617 1 1 27 TRP H H -4.920 7.671 -2.247 1.00 . A A . 27 TRP H 1 1 12 8618 1 1 27 TRP HA H -6.615 7.806 -4.668 1.00 . A A . 27 TRP HA 1 1 12 8619 1 1 27 TRP HB2 H -4.162 6.053 -4.003 1.00 . A A . 27 TRP HB2 1 1 12 8620 1 1 27 TRP HB3 H -5.126 6.056 -5.450 1.00 . A A . 27 TRP HB3 1 1 12 8621 1 1 27 TRP HD1 H -3.649 9.120 -3.704 1.00 . A A . 27 TRP HD1 1 1 12 8622 1 1 27 TRP HE1 H -2.030 10.278 -5.309 1.00 . A A . 27 TRP HE1 1 1 12 8623 1 1 27 TRP HE3 H -4.114 5.951 -7.647 1.00 . A A . 27 TRP HE3 1 1 12 8624 1 1 27 TRP HH2 H -1.037 8.023 -9.775 1.00 . A A . 27 TRP HH2 1 1 12 8625 1 1 27 TRP HZ2 H -0.891 9.726 -7.937 1.00 . A A . 27 TRP HZ2 1 1 12 8626 1 1 27 TRP HZ3 H -2.673 6.197 -9.648 1.00 . A A . 27 TRP HZ3 1 1 12 8627 1 1 27 TRP N N -5.781 7.885 -2.738 1.00 . A A . 27 TRP N 1 1 12 8628 1 1 27 TRP NE1 N -2.520 9.431 -5.542 1.00 . A A . 27 TRP NE1 1 1 12 8629 1 1 27 TRP O O -8.114 5.936 -3.857 1.00 . A A . 27 TRP O 1 1 12 8630 1 1 28 GLU C C -8.030 3.248 -2.591 1.00 . A A . 28 GLU C 1 1 12 8631 1 1 28 GLU CA C -6.691 3.574 -3.258 1.00 . A A . 28 GLU CA 1 1 12 8632 1 1 28 GLU CB C -5.550 2.594 -2.911 1.00 . A A . 28 GLU CB 1 1 12 8633 1 1 28 GLU CD C -4.460 0.386 -3.638 1.00 . A A . 28 GLU CD 1 1 12 8634 1 1 28 GLU CG C -5.720 1.254 -3.648 1.00 . A A . 28 GLU CG 1 1 12 8635 1 1 28 GLU H H -5.353 5.124 -2.630 1.00 . A A . 28 GLU H 1 1 12 8636 1 1 28 GLU HA H -6.850 3.511 -4.337 1.00 . A A . 28 GLU HA 1 1 12 8637 1 1 28 GLU HB2 H -4.604 3.033 -3.235 1.00 . A A . 28 GLU HB2 1 1 12 8638 1 1 28 GLU HB3 H -5.506 2.422 -1.835 1.00 . A A . 28 GLU HB3 1 1 12 8639 1 1 28 GLU HG2 H -6.550 0.702 -3.205 1.00 . A A . 28 GLU HG2 1 1 12 8640 1 1 28 GLU HG3 H -5.968 1.443 -4.692 1.00 . A A . 28 GLU HG3 1 1 12 8641 1 1 28 GLU N N -6.289 4.949 -2.981 1.00 . A A . 28 GLU N 1 1 12 8642 1 1 28 GLU O O -8.932 2.787 -3.284 1.00 . A A . 28 GLU O 1 1 12 8643 1 1 28 GLU OE1 O -3.529 0.671 -4.401 1.00 . A A . 28 GLU OE1 1 1 12 8644 1 1 28 GLU OE2 O -4.480 -0.691 -2.805 1.00 . A A . 28 GLU OE2 1 1 12 8645 1 1 29 LYS C C -9.229 2.865 0.792 1.00 . A A . 29 LYS C 1 1 12 8646 1 1 29 LYS CA C -9.335 3.716 -0.472 1.00 . A A . 29 LYS CA 1 1 12 8647 1 1 29 LYS CB C -10.670 3.504 -1.188 1.00 . A A . 29 LYS CB 1 1 12 8648 1 1 29 LYS CD C -11.529 5.897 -1.329 1.00 . A A . 29 LYS CD 1 1 12 8649 1 1 29 LYS CE C -11.005 7.209 -1.927 1.00 . A A . 29 LYS CE 1 1 12 8650 1 1 29 LYS CG C -11.085 4.650 -2.124 1.00 . A A . 29 LYS CG 1 1 12 8651 1 1 29 LYS H H -7.333 3.818 -0.790 1.00 . A A . 29 LYS H 1 1 12 8652 1 1 29 LYS HA H -9.296 4.751 -0.136 1.00 . A A . 29 LYS HA 1 1 12 8653 1 1 29 LYS HB2 H -10.709 2.536 -1.686 1.00 . A A . 29 LYS HB2 1 1 12 8654 1 1 29 LYS HB3 H -11.374 3.479 -0.377 1.00 . A A . 29 LYS HB3 1 1 12 8655 1 1 29 LYS HD2 H -12.621 5.927 -1.327 1.00 . A A . 29 LYS HD2 1 1 12 8656 1 1 29 LYS HD3 H -11.216 5.837 -0.286 1.00 . A A . 29 LYS HD3 1 1 12 8657 1 1 29 LYS HE2 H -11.360 7.305 -2.955 1.00 . A A . 29 LYS HE2 1 1 12 8658 1 1 29 LYS HE3 H -11.398 8.045 -1.348 1.00 . A A . 29 LYS HE3 1 1 12 8659 1 1 29 LYS HG2 H -10.282 4.862 -2.824 1.00 . A A . 29 LYS HG2 1 1 12 8660 1 1 29 LYS HG3 H -11.935 4.303 -2.715 1.00 . A A . 29 LYS HG3 1 1 12 8661 1 1 29 LYS HZ1 H -9.144 6.372 -2.230 1.00 . A A . 29 LYS HZ1 1 1 12 8662 1 1 29 LYS HZ2 H -9.216 8.020 -2.556 1.00 . A A . 29 LYS HZ2 1 1 12 8663 1 1 29 LYS N N -8.150 3.503 -1.282 1.00 . A A . 29 LYS N 1 1 12 8664 1 1 29 LYS NZ N -9.531 7.275 -1.918 1.00 . A A . 29 LYS NZ 1 1 12 8665 1 1 29 LYS O O -9.976 1.904 0.960 1.00 . A A . 29 LYS O 1 1 12 8666 1 1 30 ALA C C -7.844 3.354 4.074 1.00 . A A . 30 ALA C 1 1 12 8667 1 1 30 ALA CA C -8.011 2.435 2.869 1.00 . A A . 30 ALA CA 1 1 12 8668 1 1 30 ALA CB C -6.743 1.636 2.594 1.00 . A A . 30 ALA CB 1 1 12 8669 1 1 30 ALA H H -7.668 3.983 1.466 1.00 . A A . 30 ALA H 1 1 12 8670 1 1 30 ALA HA H -8.838 1.762 3.091 1.00 . A A . 30 ALA HA 1 1 12 8671 1 1 30 ALA HB1 H -5.968 2.320 2.259 1.00 . A A . 30 ALA HB1 1 1 12 8672 1 1 30 ALA HB2 H -6.394 1.133 3.485 1.00 . A A . 30 ALA HB2 1 1 12 8673 1 1 30 ALA HB3 H -6.941 0.899 1.815 1.00 . A A . 30 ALA HB3 1 1 12 8674 1 1 30 ALA N N -8.289 3.208 1.673 1.00 . A A . 30 ALA N 1 1 12 8675 1 1 30 ALA O O -7.650 4.555 3.905 1.00 . A A . 30 ALA O 1 1 12 8676 1 1 31 SER C C -6.284 4.188 6.480 1.00 . A A . 31 SER C 1 1 12 8677 1 1 31 SER CA C -7.667 3.545 6.505 1.00 . A A . 31 SER CA 1 1 12 8678 1 1 31 SER CB C -7.770 2.584 7.681 1.00 . A A . 31 SER CB 1 1 12 8679 1 1 31 SER H H -8.008 1.798 5.423 1.00 . A A . 31 SER H 1 1 12 8680 1 1 31 SER HA H -8.420 4.317 6.627 1.00 . A A . 31 SER HA 1 1 12 8681 1 1 31 SER HB2 H -7.033 1.802 7.540 1.00 . A A . 31 SER HB2 1 1 12 8682 1 1 31 SER HB3 H -7.508 3.130 8.571 1.00 . A A . 31 SER HB3 1 1 12 8683 1 1 31 SER HG H -9.388 1.785 6.939 1.00 . A A . 31 SER HG 1 1 12 8684 1 1 31 SER N N -7.901 2.801 5.291 1.00 . A A . 31 SER N 1 1 12 8685 1 1 31 SER O O -6.117 5.322 6.917 1.00 . A A . 31 SER O 1 1 12 8686 1 1 31 SER OG O -9.068 2.035 7.819 1.00 . A A . 31 SER OG 1 1 12 8687 1 1 32 HIS C C -3.103 3.007 5.020 1.00 . A A . 32 HIS C 1 1 12 8688 1 1 32 HIS CA C -3.911 3.927 5.938 1.00 . A A . 32 HIS CA 1 1 12 8689 1 1 32 HIS CB C -3.325 4.035 7.359 1.00 . A A . 32 HIS CB 1 1 12 8690 1 1 32 HIS CD2 C -2.922 1.644 8.148 1.00 . A A . 32 HIS CD2 1 1 12 8691 1 1 32 HIS CE1 C -0.757 1.591 8.132 1.00 . A A . 32 HIS CE1 1 1 12 8692 1 1 32 HIS CG C -2.478 2.871 7.776 1.00 . A A . 32 HIS CG 1 1 12 8693 1 1 32 HIS H H -5.464 2.529 5.611 1.00 . A A . 32 HIS H 1 1 12 8694 1 1 32 HIS HA H -3.938 4.915 5.479 1.00 . A A . 32 HIS HA 1 1 12 8695 1 1 32 HIS HB2 H -2.733 4.925 7.449 1.00 . A A . 32 HIS HB2 1 1 12 8696 1 1 32 HIS HB3 H -4.122 4.149 8.095 1.00 . A A . 32 HIS HB3 1 1 12 8697 1 1 32 HIS HD1 H -0.471 3.579 7.424 1.00 . A A . 32 HIS HD1 1 1 12 8698 1 1 32 HIS HD2 H -3.958 1.402 8.101 1.00 . A A . 32 HIS HD2 1 1 12 8699 1 1 32 HIS HE1 H 0.246 1.210 8.190 1.00 . A A . 32 HIS HE1 1 1 12 8700 1 1 32 HIS N N -5.278 3.443 6.010 1.00 . A A . 32 HIS N 1 1 12 8701 1 1 32 HIS ND1 N -1.094 2.844 7.774 1.00 . A A . 32 HIS ND1 1 1 12 8702 1 1 32 HIS NE2 N -1.836 0.834 8.388 1.00 . A A . 32 HIS NE2 1 1 12 8703 1 1 32 HIS O O -3.645 2.019 4.514 1.00 . A A . 32 HIS O 1 1 12 8704 1 1 33 GLY C C 0.477 2.335 4.784 1.00 . A A . 33 GLY C 1 1 12 8705 1 1 33 GLY CA C -0.870 2.497 4.095 1.00 . A A . 33 GLY CA 1 1 12 8706 1 1 33 GLY H H -1.426 4.103 5.358 1.00 . A A . 33 GLY H 1 1 12 8707 1 1 33 GLY HA2 H -1.280 1.522 3.951 1.00 . A A . 33 GLY HA2 1 1 12 8708 1 1 33 GLY HA3 H -0.703 2.919 3.115 1.00 . A A . 33 GLY HA3 1 1 12 8709 1 1 33 GLY N N -1.808 3.305 4.859 1.00 . A A . 33 GLY N 1 1 12 8710 1 1 33 GLY O O 0.756 3.014 5.774 1.00 . A A . 33 GLY O 1 1 12 8711 1 1 34 ALA C C 3.321 0.174 3.786 1.00 . A A . 34 ALA C 1 1 12 8712 1 1 34 ALA CA C 2.627 1.110 4.782 1.00 . A A . 34 ALA CA 1 1 12 8713 1 1 34 ALA CB C 2.496 0.464 6.165 1.00 . A A . 34 ALA CB 1 1 12 8714 1 1 34 ALA H H 0.967 0.857 3.494 1.00 . A A . 34 ALA H 1 1 12 8715 1 1 34 ALA HA H 3.198 2.035 4.871 1.00 . A A . 34 ALA HA 1 1 12 8716 1 1 34 ALA HB1 H 1.779 -0.358 6.131 1.00 . A A . 34 ALA HB1 1 1 12 8717 1 1 34 ALA HB2 H 3.462 0.091 6.497 1.00 . A A . 34 ALA HB2 1 1 12 8718 1 1 34 ALA HB3 H 2.145 1.204 6.884 1.00 . A A . 34 ALA HB3 1 1 12 8719 1 1 34 ALA N N 1.299 1.418 4.275 1.00 . A A . 34 ALA N 1 1 12 8720 1 1 34 ALA O O 2.692 -0.769 3.301 1.00 . A A . 34 ALA O 1 1 12 8721 1 1 35 CYS C C 5.957 -1.598 3.195 1.00 . A A . 35 CYS C 1 1 12 8722 1 1 35 CYS CA C 5.333 -0.390 2.506 1.00 . A A . 35 CYS CA 1 1 12 8723 1 1 35 CYS CB C 6.423 0.436 1.837 1.00 . A A . 35 CYS CB 1 1 12 8724 1 1 35 CYS H H 5.091 1.230 3.819 1.00 . A A . 35 CYS H 1 1 12 8725 1 1 35 CYS HA H 4.659 -0.715 1.721 1.00 . A A . 35 CYS HA 1 1 12 8726 1 1 35 CYS HB2 H 7.043 0.928 2.586 1.00 . A A . 35 CYS HB2 1 1 12 8727 1 1 35 CYS HB3 H 7.062 -0.242 1.289 1.00 . A A . 35 CYS HB3 1 1 12 8728 1 1 35 CYS N N 4.590 0.429 3.449 1.00 . A A . 35 CYS N 1 1 12 8729 1 1 35 CYS O O 6.249 -1.552 4.391 1.00 . A A . 35 CYS O 1 1 12 8730 1 1 35 CYS SG S 5.749 1.630 0.668 1.00 . A A . 35 CYS SG 1 1 12 8731 1 1 36 HIS C C 7.617 -4.502 1.716 1.00 . A A . 36 HIS C 1 1 12 8732 1 1 36 HIS CA C 6.972 -3.819 2.907 1.00 . A A . 36 HIS CA 1 1 12 8733 1 1 36 HIS CB C 6.118 -4.874 3.624 1.00 . A A . 36 HIS CB 1 1 12 8734 1 1 36 HIS CD2 C 3.571 -4.455 3.632 1.00 . A A . 36 HIS CD2 1 1 12 8735 1 1 36 HIS CE1 C 3.452 -3.360 5.531 1.00 . A A . 36 HIS CE1 1 1 12 8736 1 1 36 HIS CG C 4.824 -4.360 4.177 1.00 . A A . 36 HIS CG 1 1 12 8737 1 1 36 HIS H H 5.882 -2.686 1.470 1.00 . A A . 36 HIS H 1 1 12 8738 1 1 36 HIS HA H 7.750 -3.462 3.585 1.00 . A A . 36 HIS HA 1 1 12 8739 1 1 36 HIS HB2 H 5.863 -5.672 2.925 1.00 . A A . 36 HIS HB2 1 1 12 8740 1 1 36 HIS HB3 H 6.707 -5.322 4.426 1.00 . A A . 36 HIS HB3 1 1 12 8741 1 1 36 HIS HD1 H 5.529 -3.301 5.904 1.00 . A A . 36 HIS HD1 1 1 12 8742 1 1 36 HIS HD2 H 3.332 -4.898 2.662 1.00 . A A . 36 HIS HD2 1 1 12 8743 1 1 36 HIS HE1 H 3.055 -2.798 6.366 1.00 . A A . 36 HIS HE1 1 1 12 8744 1 1 36 HIS N N 6.185 -2.679 2.444 1.00 . A A . 36 HIS N 1 1 12 8745 1 1 36 HIS ND1 N 4.747 -3.643 5.355 1.00 . A A . 36 HIS ND1 1 1 12 8746 1 1 36 HIS NE2 N 2.707 -3.864 4.535 1.00 . A A . 36 HIS NE2 1 1 12 8747 1 1 36 HIS O O 7.060 -4.472 0.619 1.00 . A A . 36 HIS O 1 1 12 8748 1 1 37 LYS C C 8.513 -7.445 1.106 1.00 . A A . 37 LYS C 1 1 12 8749 1 1 37 LYS CA C 9.278 -6.131 1.005 1.00 . A A . 37 LYS CA 1 1 12 8750 1 1 37 LYS CB C 10.770 -6.297 1.259 1.00 . A A . 37 LYS CB 1 1 12 8751 1 1 37 LYS CD C 12.816 -7.677 0.528 1.00 . A A . 37 LYS CD 1 1 12 8752 1 1 37 LYS CE C 14.013 -6.843 0.055 1.00 . A A . 37 LYS CE 1 1 12 8753 1 1 37 LYS CG C 11.465 -7.057 0.126 1.00 . A A . 37 LYS CG 1 1 12 8754 1 1 37 LYS H H 9.086 -5.236 2.909 1.00 . A A . 37 LYS H 1 1 12 8755 1 1 37 LYS HA H 9.188 -5.719 0.010 1.00 . A A . 37 LYS HA 1 1 12 8756 1 1 37 LYS HB2 H 11.180 -5.311 1.275 1.00 . A A . 37 LYS HB2 1 1 12 8757 1 1 37 LYS HB3 H 10.924 -6.738 2.234 1.00 . A A . 37 LYS HB3 1 1 12 8758 1 1 37 LYS HD2 H 12.859 -7.819 1.612 1.00 . A A . 37 LYS HD2 1 1 12 8759 1 1 37 LYS HD3 H 12.874 -8.668 0.080 1.00 . A A . 37 LYS HD3 1 1 12 8760 1 1 37 LYS HE2 H 13.754 -6.333 -0.873 1.00 . A A . 37 LYS HE2 1 1 12 8761 1 1 37 LYS HE3 H 14.239 -6.096 0.816 1.00 . A A . 37 LYS HE3 1 1 12 8762 1 1 37 LYS HG2 H 10.803 -7.856 -0.159 1.00 . A A . 37 LYS HG2 1 1 12 8763 1 1 37 LYS HG3 H 11.550 -6.409 -0.748 1.00 . A A . 37 LYS HG3 1 1 12 8764 1 1 37 LYS HZ1 H 14.918 -8.670 -0.278 1.00 . A A . 37 LYS HZ1 1 1 12 8765 1 1 37 LYS HZ2 H 15.626 -7.393 -1.112 1.00 . A A . 37 LYS HZ2 1 1 12 8766 1 1 37 LYS N N 8.706 -5.222 1.974 1.00 . A A . 37 LYS N 1 1 12 8767 1 1 37 LYS NZ N 15.201 -7.681 -0.219 1.00 . A A . 37 LYS NZ 1 1 12 8768 1 1 37 LYS O O 8.421 -8.049 2.170 1.00 . A A . 37 LYS O 1 1 12 8769 1 1 38 ARG C C 7.385 -9.592 -1.508 1.00 . A A . 38 ARG C 1 1 12 8770 1 1 38 ARG CA C 7.027 -8.966 -0.163 1.00 . A A . 38 ARG CA 1 1 12 8771 1 1 38 ARG CB C 5.604 -8.397 -0.131 1.00 . A A . 38 ARG CB 1 1 12 8772 1 1 38 ARG CD C 4.506 -10.115 1.401 1.00 . A A . 38 ARG CD 1 1 12 8773 1 1 38 ARG CG C 4.496 -9.441 0.019 1.00 . A A . 38 ARG CG 1 1 12 8774 1 1 38 ARG CZ C 2.227 -9.858 2.407 1.00 . A A . 38 ARG CZ 1 1 12 8775 1 1 38 ARG H H 8.016 -7.242 -0.831 1.00 . A A . 38 ARG H 1 1 12 8776 1 1 38 ARG HA H 7.178 -9.678 0.651 1.00 . A A . 38 ARG HA 1 1 12 8777 1 1 38 ARG HB2 H 5.528 -7.689 0.696 1.00 . A A . 38 ARG HB2 1 1 12 8778 1 1 38 ARG HB3 H 5.447 -7.843 -1.058 1.00 . A A . 38 ARG HB3 1 1 12 8779 1 1 38 ARG HD2 H 5.186 -10.971 1.362 1.00 . A A . 38 ARG HD2 1 1 12 8780 1 1 38 ARG HD3 H 4.895 -9.436 2.164 1.00 . A A . 38 ARG HD3 1 1 12 8781 1 1 38 ARG HG2 H 3.556 -8.913 -0.129 1.00 . A A . 38 ARG HG2 1 1 12 8782 1 1 38 ARG HG3 H 4.599 -10.191 -0.765 1.00 . A A . 38 ARG HG3 1 1 12 8783 1 1 38 ARG HH11 H 3.176 -8.082 2.094 1.00 . A A . 38 ARG HH11 1 1 12 8784 1 1 38 ARG HH12 H 1.657 -7.995 2.976 1.00 . A A . 38 ARG HH12 1 1 12 8785 1 1 38 ARG HH21 H 0.938 -11.403 2.845 1.00 . A A . 38 ARG HH21 1 1 12 8786 1 1 38 ARG HH22 H 0.458 -9.813 3.398 1.00 . A A . 38 ARG HH22 1 1 12 8787 1 1 38 ARG N N 7.923 -7.839 -0.017 1.00 . A A . 38 ARG N 1 1 12 8788 1 1 38 ARG NE N 3.171 -10.605 1.802 1.00 . A A . 38 ARG NE 1 1 12 8789 1 1 38 ARG NH1 N 2.387 -8.538 2.522 1.00 . A A . 38 ARG NH1 1 1 12 8790 1 1 38 ARG NH2 N 1.118 -10.411 2.904 1.00 . A A . 38 ARG NH2 1 1 12 8791 1 1 38 ARG O O 7.492 -8.873 -2.501 1.00 . A A . 38 ARG O 1 1 12 8792 1 1 39 GLU C C 9.412 -10.850 -3.304 1.00 . A A . 39 GLU C 1 1 12 8793 1 1 39 GLU CA C 8.191 -11.582 -2.720 1.00 . A A . 39 GLU CA 1 1 12 8794 1 1 39 GLU CB C 7.074 -11.774 -3.760 1.00 . A A . 39 GLU CB 1 1 12 8795 1 1 39 GLU CD C 5.903 -13.343 -2.108 1.00 . A A . 39 GLU CD 1 1 12 8796 1 1 39 GLU CG C 5.738 -12.244 -3.154 1.00 . A A . 39 GLU CG 1 1 12 8797 1 1 39 GLU H H 7.440 -11.471 -0.739 1.00 . A A . 39 GLU H 1 1 12 8798 1 1 39 GLU HA H 8.538 -12.567 -2.406 1.00 . A A . 39 GLU HA 1 1 12 8799 1 1 39 GLU HB2 H 6.892 -10.829 -4.274 1.00 . A A . 39 GLU HB2 1 1 12 8800 1 1 39 GLU HB3 H 7.414 -12.503 -4.496 1.00 . A A . 39 GLU HB3 1 1 12 8801 1 1 39 GLU HG2 H 5.242 -11.394 -2.689 1.00 . A A . 39 GLU HG2 1 1 12 8802 1 1 39 GLU HG3 H 5.094 -12.608 -3.955 1.00 . A A . 39 GLU HG3 1 1 12 8803 1 1 39 GLU N N 7.665 -10.896 -1.543 1.00 . A A . 39 GLU N 1 1 12 8804 1 1 39 GLU O O 9.577 -10.758 -4.517 1.00 . A A . 39 GLU O 1 1 12 8805 1 1 39 GLU OE1 O 5.975 -14.617 -2.577 1.00 . A A . 39 GLU OE1 1 1 12 8806 1 1 39 GLU OE2 O 5.978 -13.030 -0.920 1.00 . A A . 39 GLU OE2 1 1 12 8807 1 1 40 ASN C C 11.138 -8.233 -3.511 1.00 . A A . 40 ASN C 1 1 12 8808 1 1 40 ASN CA C 11.440 -9.513 -2.731 1.00 . A A . 40 ASN CA 1 1 12 8809 1 1 40 ASN CB C 12.468 -10.371 -3.457 1.00 . A A . 40 ASN CB 1 1 12 8810 1 1 40 ASN CG C 13.879 -9.780 -3.391 1.00 . A A . 40 ASN CG 1 1 12 8811 1 1 40 ASN H H 10.098 -10.521 -1.458 1.00 . A A . 40 ASN H 1 1 12 8812 1 1 40 ASN HA H 11.860 -9.205 -1.779 1.00 . A A . 40 ASN HA 1 1 12 8813 1 1 40 ASN HB2 H 12.472 -11.368 -3.027 1.00 . A A . 40 ASN HB2 1 1 12 8814 1 1 40 ASN HB3 H 12.121 -10.454 -4.482 1.00 . A A . 40 ASN HB3 1 1 12 8815 1 1 40 ASN HD21 H 14.350 -10.502 -5.233 1.00 . A A . 40 ASN HD21 1 1 12 8816 1 1 40 ASN HD22 H 15.614 -9.609 -4.418 1.00 . A A . 40 ASN HD22 1 1 12 8817 1 1 40 ASN N N 10.259 -10.311 -2.424 1.00 . A A . 40 ASN N 1 1 12 8818 1 1 40 ASN ND2 N 14.678 -9.982 -4.433 1.00 . A A . 40 ASN ND2 1 1 12 8819 1 1 40 ASN O O 12.032 -7.669 -4.137 1.00 . A A . 40 ASN O 1 1 12 8820 1 1 40 ASN OD1 O 14.265 -9.160 -2.394 1.00 . A A . 40 ASN OD1 1 1 12 8821 1 1 41 HIS C C 8.932 -5.615 -2.992 1.00 . A A . 41 HIS C 1 1 12 8822 1 1 41 HIS CA C 9.482 -6.511 -4.089 1.00 . A A . 41 HIS CA 1 1 12 8823 1 1 41 HIS CB C 8.434 -6.807 -5.156 1.00 . A A . 41 HIS CB 1 1 12 8824 1 1 41 HIS CD2 C 8.826 -8.907 -6.636 1.00 . A A . 41 HIS CD2 1 1 12 8825 1 1 41 HIS CE1 C 10.374 -8.101 -7.946 1.00 . A A . 41 HIS CE1 1 1 12 8826 1 1 41 HIS CG C 9.033 -7.598 -6.294 1.00 . A A . 41 HIS CG 1 1 12 8827 1 1 41 HIS H H 9.166 -8.253 -2.974 1.00 . A A . 41 HIS H 1 1 12 8828 1 1 41 HIS HA H 10.326 -6.031 -4.574 1.00 . A A . 41 HIS HA 1 1 12 8829 1 1 41 HIS HB2 H 7.625 -7.371 -4.689 1.00 . A A . 41 HIS HB2 1 1 12 8830 1 1 41 HIS HB3 H 8.014 -5.871 -5.514 1.00 . A A . 41 HIS HB3 1 1 12 8831 1 1 41 HIS HD1 H 10.376 -6.147 -7.150 1.00 . A A . 41 HIS HD1 1 1 12 8832 1 1 41 HIS HD2 H 8.194 -9.598 -6.102 1.00 . A A . 41 HIS HD2 1 1 12 8833 1 1 41 HIS HE1 H 11.142 -8.031 -8.703 1.00 . A A . 41 HIS HE1 1 1 12 8834 1 1 41 HIS N N 9.894 -7.755 -3.474 1.00 . A A . 41 HIS N 1 1 12 8835 1 1 41 HIS ND1 N 9.991 -7.083 -7.156 1.00 . A A . 41 HIS ND1 1 1 12 8836 1 1 41 HIS NE2 N 9.687 -9.222 -7.669 1.00 . A A . 41 HIS NE2 1 1 12 8837 1 1 41 HIS O O 8.090 -6.058 -2.214 1.00 . A A . 41 HIS O 1 1 12 8838 1 1 42 TRP C C 7.507 -2.953 -2.461 1.00 . A A . 42 TRP C 1 1 12 8839 1 1 42 TRP CA C 8.852 -3.432 -1.950 1.00 . A A . 42 TRP CA 1 1 12 8840 1 1 42 TRP CB C 9.836 -2.305 -1.674 1.00 . A A . 42 TRP CB 1 1 12 8841 1 1 42 TRP CD1 C 12.058 -3.360 -1.102 1.00 . A A . 42 TRP CD1 1 1 12 8842 1 1 42 TRP CD2 C 10.983 -2.558 0.692 1.00 . A A . 42 TRP CD2 1 1 12 8843 1 1 42 TRP CE2 C 12.201 -3.129 1.154 1.00 . A A . 42 TRP CE2 1 1 12 8844 1 1 42 TRP CE3 C 10.071 -2.111 1.667 1.00 . A A . 42 TRP CE3 1 1 12 8845 1 1 42 TRP CG C 10.931 -2.709 -0.754 1.00 . A A . 42 TRP CG 1 1 12 8846 1 1 42 TRP CH2 C 11.582 -2.760 3.464 1.00 . A A . 42 TRP CH2 1 1 12 8847 1 1 42 TRP CZ2 C 12.486 -3.273 2.516 1.00 . A A . 42 TRP CZ2 1 1 12 8848 1 1 42 TRP CZ3 C 10.386 -2.155 3.035 1.00 . A A . 42 TRP CZ3 1 1 12 8849 1 1 42 TRP H H 10.037 -4.011 -3.610 1.00 . A A . 42 TRP H 1 1 12 8850 1 1 42 TRP HA H 8.698 -3.918 -0.996 1.00 . A A . 42 TRP HA 1 1 12 8851 1 1 42 TRP HB2 H 10.249 -1.920 -2.596 1.00 . A A . 42 TRP HB2 1 1 12 8852 1 1 42 TRP HB3 H 9.310 -1.495 -1.181 1.00 . A A . 42 TRP HB3 1 1 12 8853 1 1 42 TRP HD1 H 12.268 -3.702 -2.101 1.00 . A A . 42 TRP HD1 1 1 12 8854 1 1 42 TRP HE1 H 13.714 -4.068 0.041 1.00 . A A . 42 TRP HE1 1 1 12 8855 1 1 42 TRP HE3 H 9.097 -1.781 1.356 1.00 . A A . 42 TRP HE3 1 1 12 8856 1 1 42 TRP HH2 H 11.788 -2.861 4.520 1.00 . A A . 42 TRP HH2 1 1 12 8857 1 1 42 TRP HZ2 H 13.339 -3.870 2.801 1.00 . A A . 42 TRP HZ2 1 1 12 8858 1 1 42 TRP HZ3 H 9.677 -1.741 3.741 1.00 . A A . 42 TRP HZ3 1 1 12 8859 1 1 42 TRP N N 9.403 -4.374 -2.903 1.00 . A A . 42 TRP N 1 1 12 8860 1 1 42 TRP NE1 N 12.833 -3.584 0.015 1.00 . A A . 42 TRP NE1 1 1 12 8861 1 1 42 TRP O O 7.454 -2.130 -3.366 1.00 . A A . 42 TRP O 1 1 12 8862 1 1 43 LYS C C 4.631 -2.099 -1.188 1.00 . A A . 43 LYS C 1 1 12 8863 1 1 43 LYS CA C 5.080 -3.071 -2.261 1.00 . A A . 43 LYS CA 1 1 12 8864 1 1 43 LYS CB C 4.119 -4.263 -2.307 1.00 . A A . 43 LYS CB 1 1 12 8865 1 1 43 LYS CD C 4.657 -5.581 -4.500 1.00 . A A . 43 LYS CD 1 1 12 8866 1 1 43 LYS CE C 5.243 -4.382 -5.265 1.00 . A A . 43 LYS CE 1 1 12 8867 1 1 43 LYS CG C 4.687 -5.521 -2.960 1.00 . A A . 43 LYS CG 1 1 12 8868 1 1 43 LYS H H 6.521 -4.167 -1.165 1.00 . A A . 43 LYS H 1 1 12 8869 1 1 43 LYS HA H 5.061 -2.563 -3.223 1.00 . A A . 43 LYS HA 1 1 12 8870 1 1 43 LYS HB2 H 3.944 -4.543 -1.275 1.00 . A A . 43 LYS HB2 1 1 12 8871 1 1 43 LYS HB3 H 3.165 -3.981 -2.754 1.00 . A A . 43 LYS HB3 1 1 12 8872 1 1 43 LYS HD2 H 5.228 -6.469 -4.779 1.00 . A A . 43 LYS HD2 1 1 12 8873 1 1 43 LYS HD3 H 3.628 -5.752 -4.826 1.00 . A A . 43 LYS HD3 1 1 12 8874 1 1 43 LYS HE2 H 6.053 -3.939 -4.690 1.00 . A A . 43 LYS HE2 1 1 12 8875 1 1 43 LYS HE3 H 5.681 -4.756 -6.193 1.00 . A A . 43 LYS HE3 1 1 12 8876 1 1 43 LYS HG2 H 5.644 -5.729 -2.485 1.00 . A A . 43 LYS HG2 1 1 12 8877 1 1 43 LYS HG3 H 4.081 -6.353 -2.637 1.00 . A A . 43 LYS HG3 1 1 12 8878 1 1 43 LYS HZ1 H 4.283 -3.198 -6.668 1.00 . A A . 43 LYS HZ1 1 1 12 8879 1 1 43 LYS HZ2 H 3.287 -3.715 -5.416 1.00 . A A . 43 LYS HZ2 1 1 12 8880 1 1 43 LYS N N 6.418 -3.496 -1.924 1.00 . A A . 43 LYS N 1 1 12 8881 1 1 43 LYS NZ N 4.227 -3.368 -5.654 1.00 . A A . 43 LYS NZ 1 1 12 8882 1 1 43 LYS O O 4.730 -2.396 0.004 1.00 . A A . 43 LYS O 1 1 12 8883 1 1 44 CYS C C 1.941 -1.165 -0.558 1.00 . A A . 44 CYS C 1 1 12 8884 1 1 44 CYS CA C 3.129 -0.248 -0.809 1.00 . A A . 44 CYS CA 1 1 12 8885 1 1 44 CYS CB C 2.752 1.052 -1.501 1.00 . A A . 44 CYS CB 1 1 12 8886 1 1 44 CYS H H 4.042 -0.824 -2.620 1.00 . A A . 44 CYS H 1 1 12 8887 1 1 44 CYS HA H 3.566 0.016 0.143 1.00 . A A . 44 CYS HA 1 1 12 8888 1 1 44 CYS HB2 H 3.627 1.691 -1.401 1.00 . A A . 44 CYS HB2 1 1 12 8889 1 1 44 CYS HB3 H 2.529 0.882 -2.552 1.00 . A A . 44 CYS HB3 1 1 12 8890 1 1 44 CYS N N 4.081 -0.970 -1.624 1.00 . A A . 44 CYS N 1 1 12 8891 1 1 44 CYS O O 1.490 -1.834 -1.485 1.00 . A A . 44 CYS O 1 1 12 8892 1 1 44 CYS SG S 1.342 1.903 -0.766 1.00 . A A . 44 CYS SG 1 1 12 8893 1 1 45 PHE C C -0.623 -1.042 1.788 1.00 . A A . 45 PHE C 1 1 12 8894 1 1 45 PHE CA C 0.300 -2.004 1.061 1.00 . A A . 45 PHE CA 1 1 12 8895 1 1 45 PHE CB C 0.665 -3.180 1.967 1.00 . A A . 45 PHE CB 1 1 12 8896 1 1 45 PHE CD1 C 1.909 -4.876 0.555 1.00 . A A . 45 PHE CD1 1 1 12 8897 1 1 45 PHE CD2 C -0.324 -5.417 1.331 1.00 . A A . 45 PHE CD2 1 1 12 8898 1 1 45 PHE CE1 C 2.027 -6.164 0.003 1.00 . A A . 45 PHE CE1 1 1 12 8899 1 1 45 PHE CE2 C -0.221 -6.695 0.757 1.00 . A A . 45 PHE CE2 1 1 12 8900 1 1 45 PHE CG C 0.754 -4.522 1.270 1.00 . A A . 45 PHE CG 1 1 12 8901 1 1 45 PHE CZ C 0.961 -7.074 0.101 1.00 . A A . 45 PHE CZ 1 1 12 8902 1 1 45 PHE H H 1.936 -0.738 1.440 1.00 . A A . 45 PHE H 1 1 12 8903 1 1 45 PHE HA H -0.224 -2.370 0.178 1.00 . A A . 45 PHE HA 1 1 12 8904 1 1 45 PHE HB2 H 1.615 -2.940 2.427 1.00 . A A . 45 PHE HB2 1 1 12 8905 1 1 45 PHE HB3 H -0.070 -3.268 2.765 1.00 . A A . 45 PHE HB3 1 1 12 8906 1 1 45 PHE HD1 H 2.703 -4.150 0.455 1.00 . A A . 45 PHE HD1 1 1 12 8907 1 1 45 PHE HD2 H -1.249 -5.104 1.785 1.00 . A A . 45 PHE HD2 1 1 12 8908 1 1 45 PHE HE1 H 2.928 -6.451 -0.516 1.00 . A A . 45 PHE HE1 1 1 12 8909 1 1 45 PHE HE2 H -1.059 -7.379 0.797 1.00 . A A . 45 PHE HE2 1 1 12 8910 1 1 45 PHE HZ H 1.031 -8.048 -0.361 1.00 . A A . 45 PHE HZ 1 1 12 8911 1 1 45 PHE N N 1.495 -1.265 0.691 1.00 . A A . 45 PHE N 1 1 12 8912 1 1 45 PHE O O -0.163 -0.099 2.428 1.00 . A A . 45 PHE O 1 1 12 8913 1 1 46 CYS C C -3.832 -1.384 3.106 1.00 . A A . 46 CYS C 1 1 12 8914 1 1 46 CYS CA C -3.007 -0.513 2.178 1.00 . A A . 46 CYS CA 1 1 12 8915 1 1 46 CYS CB C -3.854 -0.045 0.996 1.00 . A A . 46 CYS CB 1 1 12 8916 1 1 46 CYS H H -2.192 -2.141 1.167 1.00 . A A . 46 CYS H 1 1 12 8917 1 1 46 CYS HA H -2.656 0.339 2.762 1.00 . A A . 46 CYS HA 1 1 12 8918 1 1 46 CYS HB2 H -4.278 -0.922 0.524 1.00 . A A . 46 CYS HB2 1 1 12 8919 1 1 46 CYS HB3 H -4.665 0.557 1.378 1.00 . A A . 46 CYS HB3 1 1 12 8920 1 1 46 CYS N N -1.915 -1.312 1.679 1.00 . A A . 46 CYS N 1 1 12 8921 1 1 46 CYS O O -3.871 -2.605 2.956 1.00 . A A . 46 CYS O 1 1 12 8922 1 1 46 CYS SG S -3.029 0.901 -0.303 1.00 . A A . 46 CYS SG 1 1 12 8923 1 1 47 TYR C C -6.495 -0.875 5.301 1.00 . A A . 47 TYR C 1 1 12 8924 1 1 47 TYR CA C -5.063 -1.380 5.236 1.00 . A A . 47 TYR CA 1 1 12 8925 1 1 47 TYR CB C -4.224 -0.969 6.448 1.00 . A A . 47 TYR CB 1 1 12 8926 1 1 47 TYR CD1 C -1.802 -1.175 5.722 1.00 . A A . 47 TYR CD1 1 1 12 8927 1 1 47 TYR CD2 C -2.772 -2.901 7.139 1.00 . A A . 47 TYR CD2 1 1 12 8928 1 1 47 TYR CE1 C -0.672 -1.981 5.507 1.00 . A A . 47 TYR CE1 1 1 12 8929 1 1 47 TYR CE2 C -1.626 -3.686 6.964 1.00 . A A . 47 TYR CE2 1 1 12 8930 1 1 47 TYR CG C -2.891 -1.678 6.458 1.00 . A A . 47 TYR CG 1 1 12 8931 1 1 47 TYR CZ C -0.620 -3.261 6.081 1.00 . A A . 47 TYR CZ 1 1 12 8932 1 1 47 TYR H H -4.349 0.275 4.115 1.00 . A A . 47 TYR H 1 1 12 8933 1 1 47 TYR HA H -5.054 -2.468 5.152 1.00 . A A . 47 TYR HA 1 1 12 8934 1 1 47 TYR HB2 H -4.062 0.103 6.371 1.00 . A A . 47 TYR HB2 1 1 12 8935 1 1 47 TYR HB3 H -4.733 -1.165 7.391 1.00 . A A . 47 TYR HB3 1 1 12 8936 1 1 47 TYR HD1 H -1.868 -0.207 5.252 1.00 . A A . 47 TYR HD1 1 1 12 8937 1 1 47 TYR HD2 H -3.585 -3.273 7.745 1.00 . A A . 47 TYR HD2 1 1 12 8938 1 1 47 TYR HE1 H 0.121 -1.632 4.865 1.00 . A A . 47 TYR HE1 1 1 12 8939 1 1 47 TYR HE2 H -1.548 -4.634 7.475 1.00 . A A . 47 TYR HE2 1 1 12 8940 1 1 47 TYR HH H 0.260 -4.971 6.191 1.00 . A A . 47 TYR HH 1 1 12 8941 1 1 47 TYR N N -4.442 -0.737 4.094 1.00 . A A . 47 TYR N 1 1 12 8942 1 1 47 TYR O O -6.730 0.263 5.706 1.00 . A A . 47 TYR O 1 1 12 8943 1 1 47 TYR OH O 0.400 -4.109 5.776 1.00 . A A . 47 TYR OH 1 1 12 8944 1 1 48 PHE C C -9.648 -0.700 5.360 1.00 . A A . 48 PHE C 1 1 12 8945 1 1 48 PHE CA C -8.666 -1.168 4.289 1.00 . A A . 48 PHE CA 1 1 12 8946 1 1 48 PHE CB C -9.221 -2.162 3.268 1.00 . A A . 48 PHE CB 1 1 12 8947 1 1 48 PHE CD1 C -7.344 -2.482 1.591 1.00 . A A . 48 PHE CD1 1 1 12 8948 1 1 48 PHE CD2 C -9.271 -1.148 0.943 1.00 . A A . 48 PHE CD2 1 1 12 8949 1 1 48 PHE CE1 C -6.708 -2.140 0.387 1.00 . A A . 48 PHE CE1 1 1 12 8950 1 1 48 PHE CE2 C -8.622 -0.786 -0.249 1.00 . A A . 48 PHE CE2 1 1 12 8951 1 1 48 PHE CG C -8.610 -1.953 1.893 1.00 . A A . 48 PHE CG 1 1 12 8952 1 1 48 PHE CZ C -7.327 -1.260 -0.515 1.00 . A A . 48 PHE CZ 1 1 12 8953 1 1 48 PHE H H -7.210 -2.642 4.568 1.00 . A A . 48 PHE H 1 1 12 8954 1 1 48 PHE HA H -8.405 -0.274 3.726 1.00 . A A . 48 PHE HA 1 1 12 8955 1 1 48 PHE HB2 H -9.062 -3.189 3.597 1.00 . A A . 48 PHE HB2 1 1 12 8956 1 1 48 PHE HB3 H -10.288 -2.010 3.201 1.00 . A A . 48 PHE HB3 1 1 12 8957 1 1 48 PHE HD1 H -6.821 -3.099 2.308 1.00 . A A . 48 PHE HD1 1 1 12 8958 1 1 48 PHE HD2 H -10.243 -0.727 1.159 1.00 . A A . 48 PHE HD2 1 1 12 8959 1 1 48 PHE HE1 H -5.716 -2.510 0.183 1.00 . A A . 48 PHE HE1 1 1 12 8960 1 1 48 PHE HE2 H -9.099 -0.084 -0.925 1.00 . A A . 48 PHE HE2 1 1 12 8961 1 1 48 PHE HZ H -6.796 -0.930 -1.398 1.00 . A A . 48 PHE HZ 1 1 12 8962 1 1 48 PHE N N -7.448 -1.701 4.859 1.00 . A A . 48 PHE N 1 1 12 8963 1 1 48 PHE O O -9.634 0.475 5.723 1.00 . A A . 48 PHE O 1 1 12 8964 1 1 49 ASN C C -10.913 -1.354 8.292 1.00 . A A . 49 ASN C 1 1 12 8965 1 1 49 ASN CA C -11.501 -1.242 6.884 1.00 . A A . 49 ASN CA 1 1 12 8966 1 1 49 ASN CB C -12.792 -2.063 6.684 1.00 . A A . 49 ASN CB 1 1 12 8967 1 1 49 ASN CG C -12.582 -3.569 6.579 1.00 . A A . 49 ASN CG 1 1 12 8968 1 1 49 ASN H H -10.355 -2.566 5.671 1.00 . A A . 49 ASN H 1 1 12 8969 1 1 49 ASN HA H -11.793 -0.198 6.756 1.00 . A A . 49 ASN HA 1 1 12 8970 1 1 49 ASN HB2 H -13.475 -1.868 7.509 1.00 . A A . 49 ASN HB2 1 1 12 8971 1 1 49 ASN HB3 H -13.272 -1.732 5.765 1.00 . A A . 49 ASN HB3 1 1 12 8972 1 1 49 ASN HD21 H -12.147 -3.419 4.596 1.00 . A A . 49 ASN HD21 1 1 12 8973 1 1 49 ASN HD22 H -12.055 -5.033 5.275 1.00 . A A . 49 ASN HD22 1 1 12 8974 1 1 49 ASN N N -10.482 -1.592 5.894 1.00 . A A . 49 ASN N 1 1 12 8975 1 1 49 ASN ND2 N -12.194 -4.032 5.394 1.00 . A A . 49 ASN ND2 1 1 12 8976 1 1 49 ASN O O -11.508 -1.945 9.191 1.00 . A A . 49 ASN O 1 1 12 8977 1 1 49 ASN OD1 O -12.792 -4.311 7.534 1.00 . A A . 49 ASN OD1 1 1 12 8978 1 1 50 CYS C C -9.680 0.119 10.764 1.00 . A A . 50 CYS C 1 1 12 8979 1 1 50 CYS CA C -9.013 -0.806 9.753 1.00 . A A . 50 CYS CA 1 1 12 8980 1 1 50 CYS CB C -7.548 -0.443 9.558 1.00 . A A . 50 CYS CB 1 1 12 8981 1 1 50 CYS H H -9.326 -0.265 7.698 1.00 . A A . 50 CYS H 1 1 12 8982 1 1 50 CYS HA H -9.030 -1.810 10.145 1.00 . A A . 50 CYS HA 1 1 12 8983 1 1 50 CYS HB2 H -7.134 -0.987 8.712 1.00 . A A . 50 CYS HB2 1 1 12 8984 1 1 50 CYS HB3 H -7.514 0.609 9.348 1.00 . A A . 50 CYS HB3 1 1 12 8985 1 1 50 CYS N N -9.725 -0.775 8.480 1.00 . A A . 50 CYS N 1 1 12 8986 1 1 50 CYS O O -10.003 -0.341 11.903 1.00 . A A . 50 CYS O 1 1 12 8987 1 1 50 CYS OXT O -9.911 1.333 10.472 1.00 . A A . 50 CYS OXT 1 1 12 8988 1 1 50 CYS SG S -6.449 -0.691 10.970 1.00 . A A . 50 CYS SG 1 1 13 8989 1 1 1 LEU C C -9.836 -5.102 9.572 1.00 . A A . 1 LEU C 1 1 13 8990 1 1 1 LEU CA C -10.781 -5.386 10.732 1.00 . A A . 1 LEU CA 1 1 13 8991 1 1 1 LEU CB C -10.598 -6.790 11.341 1.00 . A A . 1 LEU CB 1 1 13 8992 1 1 1 LEU CD1 C -11.835 -8.124 9.503 1.00 . A A . 1 LEU CD1 1 1 13 8993 1 1 1 LEU CD2 C -9.323 -8.219 9.609 1.00 . A A . 1 LEU CD2 1 1 13 8994 1 1 1 LEU CG C -10.613 -8.029 10.421 1.00 . A A . 1 LEU CG 1 1 13 8995 1 1 1 LEU H1 H -12.396 -5.736 9.504 1.00 . A A . 1 LEU H1 1 1 13 8996 1 1 1 LEU H2 H -12.809 -5.314 11.078 1.00 . A A . 1 LEU H2 1 1 13 8997 1 1 1 LEU H3 H -12.253 -4.139 10.012 1.00 . A A . 1 LEU H3 1 1 13 8998 1 1 1 LEU HA H -10.566 -4.662 11.520 1.00 . A A . 1 LEU HA 1 1 13 8999 1 1 1 LEU HB2 H -9.646 -6.796 11.877 1.00 . A A . 1 LEU HB2 1 1 13 9000 1 1 1 LEU HB3 H -11.380 -6.925 12.089 1.00 . A A . 1 LEU HB3 1 1 13 9001 1 1 1 LEU HD11 H -12.749 -7.950 10.073 1.00 . A A . 1 LEU HD11 1 1 13 9002 1 1 1 LEU HD12 H -11.762 -7.411 8.681 1.00 . A A . 1 LEU HD12 1 1 13 9003 1 1 1 LEU HD13 H -11.881 -9.127 9.074 1.00 . A A . 1 LEU HD13 1 1 13 9004 1 1 1 LEU HD21 H -8.450 -8.077 10.247 1.00 . A A . 1 LEU HD21 1 1 13 9005 1 1 1 LEU HD22 H -9.298 -9.235 9.214 1.00 . A A . 1 LEU HD22 1 1 13 9006 1 1 1 LEU HD23 H -9.270 -7.534 8.766 1.00 . A A . 1 LEU HD23 1 1 13 9007 1 1 1 LEU HG H -10.664 -8.887 11.096 1.00 . A A . 1 LEU HG 1 1 13 9008 1 1 1 LEU N N -12.163 -5.124 10.299 1.00 . A A . 1 LEU N 1 1 13 9009 1 1 1 LEU O O -10.287 -5.146 8.430 1.00 . A A . 1 LEU O 1 1 13 9010 1 1 2 CYS C C -7.357 -5.133 7.727 1.00 . A A . 2 CYS C 1 1 13 9011 1 1 2 CYS CA C -7.649 -4.194 8.896 1.00 . A A . 2 CYS CA 1 1 13 9012 1 1 2 CYS CB C -6.397 -3.620 9.578 1.00 . A A . 2 CYS CB 1 1 13 9013 1 1 2 CYS H H -8.272 -4.786 10.819 1.00 . A A . 2 CYS H 1 1 13 9014 1 1 2 CYS HA H -8.159 -3.327 8.483 1.00 . A A . 2 CYS HA 1 1 13 9015 1 1 2 CYS HB2 H -5.716 -4.445 9.793 1.00 . A A . 2 CYS HB2 1 1 13 9016 1 1 2 CYS HB3 H -5.900 -2.936 8.899 1.00 . A A . 2 CYS HB3 1 1 13 9017 1 1 2 CYS N N -8.580 -4.760 9.861 1.00 . A A . 2 CYS N 1 1 13 9018 1 1 2 CYS O O -6.474 -5.986 7.790 1.00 . A A . 2 CYS O 1 1 13 9019 1 1 2 CYS SG S -6.683 -2.773 11.157 1.00 . A A . 2 CYS SG 1 1 13 9020 1 1 3 ASN C C -6.744 -5.194 4.695 1.00 . A A . 3 ASN C 1 1 13 9021 1 1 3 ASN CA C -7.986 -5.710 5.413 1.00 . A A . 3 ASN CA 1 1 13 9022 1 1 3 ASN CB C -9.260 -5.541 4.571 1.00 . A A . 3 ASN CB 1 1 13 9023 1 1 3 ASN CG C -9.092 -6.025 3.133 1.00 . A A . 3 ASN CG 1 1 13 9024 1 1 3 ASN H H -8.771 -4.181 6.663 1.00 . A A . 3 ASN H 1 1 13 9025 1 1 3 ASN HA H -7.860 -6.770 5.641 1.00 . A A . 3 ASN HA 1 1 13 9026 1 1 3 ASN HB2 H -10.076 -6.091 5.036 1.00 . A A . 3 ASN HB2 1 1 13 9027 1 1 3 ASN HB3 H -9.525 -4.489 4.546 1.00 . A A . 3 ASN HB3 1 1 13 9028 1 1 3 ASN HD21 H -8.628 -7.898 3.770 1.00 . A A . 3 ASN HD21 1 1 13 9029 1 1 3 ASN HD22 H -8.645 -7.662 2.037 1.00 . A A . 3 ASN HD22 1 1 13 9030 1 1 3 ASN N N -8.109 -4.952 6.642 1.00 . A A . 3 ASN N 1 1 13 9031 1 1 3 ASN ND2 N -8.751 -7.295 2.970 1.00 . A A . 3 ASN ND2 1 1 13 9032 1 1 3 ASN O O -6.831 -4.308 3.842 1.00 . A A . 3 ASN O 1 1 13 9033 1 1 3 ASN OD1 O -9.292 -5.279 2.173 1.00 . A A . 3 ASN OD1 1 1 13 9034 1 1 4 GLU C C -4.286 -6.193 3.127 1.00 . A A . 4 GLU C 1 1 13 9035 1 1 4 GLU CA C -4.308 -5.472 4.475 1.00 . A A . 4 GLU CA 1 1 13 9036 1 1 4 GLU CB C -3.228 -5.995 5.435 1.00 . A A . 4 GLU CB 1 1 13 9037 1 1 4 GLU CD C -0.748 -6.418 5.754 1.00 . A A . 4 GLU CD 1 1 13 9038 1 1 4 GLU CG C -1.845 -5.988 4.787 1.00 . A A . 4 GLU CG 1 1 13 9039 1 1 4 GLU H H -5.596 -6.413 5.836 1.00 . A A . 4 GLU H 1 1 13 9040 1 1 4 GLU HA H -4.171 -4.401 4.340 1.00 . A A . 4 GLU HA 1 1 13 9041 1 1 4 GLU HB2 H -3.219 -5.378 6.336 1.00 . A A . 4 GLU HB2 1 1 13 9042 1 1 4 GLU HB3 H -3.466 -7.022 5.717 1.00 . A A . 4 GLU HB3 1 1 13 9043 1 1 4 GLU HG2 H -1.880 -6.710 3.976 1.00 . A A . 4 GLU HG2 1 1 13 9044 1 1 4 GLU HG3 H -1.623 -4.995 4.393 1.00 . A A . 4 GLU HG3 1 1 13 9045 1 1 4 GLU N N -5.591 -5.740 5.080 1.00 . A A . 4 GLU N 1 1 13 9046 1 1 4 GLU O O -4.640 -7.365 3.048 1.00 . A A . 4 GLU O 1 1 13 9047 1 1 4 GLU OE1 O -0.908 -7.633 6.341 1.00 . A A . 4 GLU OE1 1 1 13 9048 1 1 4 GLU OE2 O 0.208 -5.670 5.955 1.00 . A A . 4 GLU OE2 1 1 13 9049 1 1 5 ARG C C -2.677 -5.281 -0.024 1.00 . A A . 5 ARG C 1 1 13 9050 1 1 5 ARG CA C -3.809 -6.007 0.718 1.00 . A A . 5 ARG CA 1 1 13 9051 1 1 5 ARG CB C -5.176 -5.829 0.039 1.00 . A A . 5 ARG CB 1 1 13 9052 1 1 5 ARG CD C -6.856 -4.179 -0.829 1.00 . A A . 5 ARG CD 1 1 13 9053 1 1 5 ARG CG C -5.715 -4.402 0.168 1.00 . A A . 5 ARG CG 1 1 13 9054 1 1 5 ARG CZ C -9.315 -3.957 -0.757 1.00 . A A . 5 ARG CZ 1 1 13 9055 1 1 5 ARG H H -3.638 -4.505 2.188 1.00 . A A . 5 ARG H 1 1 13 9056 1 1 5 ARG HA H -3.575 -7.072 0.762 1.00 . A A . 5 ARG HA 1 1 13 9057 1 1 5 ARG HB2 H -5.072 -6.073 -1.017 1.00 . A A . 5 ARG HB2 1 1 13 9058 1 1 5 ARG HB3 H -5.905 -6.506 0.486 1.00 . A A . 5 ARG HB3 1 1 13 9059 1 1 5 ARG HD2 H -6.813 -3.130 -1.109 1.00 . A A . 5 ARG HD2 1 1 13 9060 1 1 5 ARG HD3 H -6.718 -4.786 -1.724 1.00 . A A . 5 ARG HD3 1 1 13 9061 1 1 5 ARG HG2 H -6.049 -4.206 1.189 1.00 . A A . 5 ARG HG2 1 1 13 9062 1 1 5 ARG HG3 H -4.917 -3.699 -0.073 1.00 . A A . 5 ARG HG3 1 1 13 9063 1 1 5 ARG HH11 H -8.472 -3.320 -2.518 1.00 . A A . 5 ARG HH11 1 1 13 9064 1 1 5 ARG HH12 H -10.165 -2.962 -2.343 1.00 . A A . 5 ARG HH12 1 1 13 9065 1 1 5 ARG HH21 H -10.359 -4.494 0.885 1.00 . A A . 5 ARG HH21 1 1 13 9066 1 1 5 ARG HH22 H -11.314 -3.680 -0.339 1.00 . A A . 5 ARG HH22 1 1 13 9067 1 1 5 ARG N N -3.877 -5.486 2.073 1.00 . A A . 5 ARG N 1 1 13 9068 1 1 5 ARG NE N -8.174 -4.447 -0.251 1.00 . A A . 5 ARG NE 1 1 13 9069 1 1 5 ARG NH1 N -9.327 -3.373 -1.963 1.00 . A A . 5 ARG NH1 1 1 13 9070 1 1 5 ARG NH2 N -10.432 -4.062 -0.034 1.00 . A A . 5 ARG NH2 1 1 13 9071 1 1 5 ARG O O -2.337 -4.160 0.357 1.00 . A A . 5 ARG O 1 1 13 9072 1 1 6 PRO C C -1.291 -4.151 -2.603 1.00 . A A . 6 PRO C 1 1 13 9073 1 1 6 PRO CA C -0.905 -5.346 -1.728 1.00 . A A . 6 PRO CA 1 1 13 9074 1 1 6 PRO CB C -0.321 -6.504 -2.547 1.00 . A A . 6 PRO CB 1 1 13 9075 1 1 6 PRO CD C -2.341 -7.247 -1.527 1.00 . A A . 6 PRO CD 1 1 13 9076 1 1 6 PRO CG C -1.540 -7.382 -2.821 1.00 . A A . 6 PRO CG 1 1 13 9077 1 1 6 PRO HA H -0.153 -5.011 -1.013 1.00 . A A . 6 PRO HA 1 1 13 9078 1 1 6 PRO HB2 H 0.168 -6.187 -3.470 1.00 . A A . 6 PRO HB2 1 1 13 9079 1 1 6 PRO HB3 H 0.384 -7.059 -1.927 1.00 . A A . 6 PRO HB3 1 1 13 9080 1 1 6 PRO HD2 H -3.399 -7.405 -1.730 1.00 . A A . 6 PRO HD2 1 1 13 9081 1 1 6 PRO HD3 H -1.987 -7.983 -0.803 1.00 . A A . 6 PRO HD3 1 1 13 9082 1 1 6 PRO HG2 H -2.113 -6.961 -3.649 1.00 . A A . 6 PRO HG2 1 1 13 9083 1 1 6 PRO HG3 H -1.270 -8.418 -3.037 1.00 . A A . 6 PRO HG3 1 1 13 9084 1 1 6 PRO N N -2.052 -5.910 -1.032 1.00 . A A . 6 PRO N 1 1 13 9085 1 1 6 PRO O O -2.463 -3.789 -2.708 1.00 . A A . 6 PRO O 1 1 13 9086 1 1 7 SER C C -1.614 -2.463 -5.025 1.00 . A A . 7 SER C 1 1 13 9087 1 1 7 SER CA C -0.351 -2.439 -4.168 1.00 . A A . 7 SER CA 1 1 13 9088 1 1 7 SER CB C 0.914 -2.433 -5.030 1.00 . A A . 7 SER CB 1 1 13 9089 1 1 7 SER H H 0.647 -3.949 -3.115 1.00 . A A . 7 SER H 1 1 13 9090 1 1 7 SER HA H -0.356 -1.497 -3.624 1.00 . A A . 7 SER HA 1 1 13 9091 1 1 7 SER HB2 H 0.674 -1.912 -5.958 1.00 . A A . 7 SER HB2 1 1 13 9092 1 1 7 SER HB3 H 1.700 -1.885 -4.510 1.00 . A A . 7 SER HB3 1 1 13 9093 1 1 7 SER HG H 0.582 -4.225 -5.653 1.00 . A A . 7 SER HG 1 1 13 9094 1 1 7 SER N N -0.274 -3.563 -3.243 1.00 . A A . 7 SER N 1 1 13 9095 1 1 7 SER O O -1.713 -3.261 -5.953 1.00 . A A . 7 SER O 1 1 13 9096 1 1 7 SER OG O 1.350 -3.762 -5.289 1.00 . A A . 7 SER OG 1 1 13 9097 1 1 8 GLN C C -3.483 -0.454 -6.631 1.00 . A A . 8 GLN C 1 1 13 9098 1 1 8 GLN CA C -3.782 -1.361 -5.434 1.00 . A A . 8 GLN CA 1 1 13 9099 1 1 8 GLN CB C -4.827 -0.738 -4.491 1.00 . A A . 8 GLN CB 1 1 13 9100 1 1 8 GLN CD C -5.823 -2.917 -3.615 1.00 . A A . 8 GLN CD 1 1 13 9101 1 1 8 GLN CG C -5.158 -1.593 -3.261 1.00 . A A . 8 GLN CG 1 1 13 9102 1 1 8 GLN H H -2.378 -0.972 -3.910 1.00 . A A . 8 GLN H 1 1 13 9103 1 1 8 GLN HA H -4.157 -2.313 -5.813 1.00 . A A . 8 GLN HA 1 1 13 9104 1 1 8 GLN HB2 H -4.474 0.224 -4.118 1.00 . A A . 8 GLN HB2 1 1 13 9105 1 1 8 GLN HB3 H -5.739 -0.568 -5.057 1.00 . A A . 8 GLN HB3 1 1 13 9106 1 1 8 GLN HE21 H -4.029 -3.875 -3.651 1.00 . A A . 8 GLN HE21 1 1 13 9107 1 1 8 GLN HE22 H -5.429 -4.852 -4.079 1.00 . A A . 8 GLN HE22 1 1 13 9108 1 1 8 GLN HG2 H -4.259 -1.776 -2.670 1.00 . A A . 8 GLN HG2 1 1 13 9109 1 1 8 GLN HG3 H -5.852 -1.023 -2.646 1.00 . A A . 8 GLN HG3 1 1 13 9110 1 1 8 GLN N N -2.549 -1.565 -4.704 1.00 . A A . 8 GLN N 1 1 13 9111 1 1 8 GLN NE2 N -5.032 -3.966 -3.806 1.00 . A A . 8 GLN NE2 1 1 13 9112 1 1 8 GLN O O -3.426 -0.911 -7.766 1.00 . A A . 8 GLN O 1 1 13 9113 1 1 8 GLN OE1 O -7.052 -3.010 -3.653 1.00 . A A . 8 GLN OE1 1 1 13 9114 1 1 9 THR C C -1.456 1.904 -7.626 1.00 . A A . 9 THR C 1 1 13 9115 1 1 9 THR CA C -2.957 1.830 -7.378 1.00 . A A . 9 THR CA 1 1 13 9116 1 1 9 THR CB C -3.460 3.186 -6.885 1.00 . A A . 9 THR CB 1 1 13 9117 1 1 9 THR CG2 C -4.987 3.229 -6.967 1.00 . A A . 9 THR CG2 1 1 13 9118 1 1 9 THR H H -3.340 1.193 -5.424 1.00 . A A . 9 THR H 1 1 13 9119 1 1 9 THR HA H -3.449 1.589 -8.322 1.00 . A A . 9 THR HA 1 1 13 9120 1 1 9 THR HB H -3.044 3.963 -7.525 1.00 . A A . 9 THR HB 1 1 13 9121 1 1 9 THR HG1 H -3.500 4.174 -5.207 1.00 . A A . 9 THR HG1 1 1 13 9122 1 1 9 THR HG21 H -5.425 2.421 -6.385 1.00 . A A . 9 THR HG21 1 1 13 9123 1 1 9 THR HG22 H -5.353 4.178 -6.586 1.00 . A A . 9 THR HG22 1 1 13 9124 1 1 9 THR HG23 H -5.293 3.131 -8.008 1.00 . A A . 9 THR HG23 1 1 13 9125 1 1 9 THR N N -3.269 0.838 -6.366 1.00 . A A . 9 THR N 1 1 13 9126 1 1 9 THR O O -1.031 2.223 -8.736 1.00 . A A . 9 THR O 1 1 13 9127 1 1 9 THR OG1 O -3.042 3.397 -5.544 1.00 . A A . 9 THR OG1 1 1 13 9128 1 1 10 TRP C C 1.392 0.999 -7.692 1.00 . A A . 10 TRP C 1 1 13 9129 1 1 10 TRP CA C 0.772 1.912 -6.632 1.00 . A A . 10 TRP CA 1 1 13 9130 1 1 10 TRP CB C 1.416 1.683 -5.256 1.00 . A A . 10 TRP CB 1 1 13 9131 1 1 10 TRP CD1 C 3.854 1.565 -5.929 1.00 . A A . 10 TRP CD1 1 1 13 9132 1 1 10 TRP CD2 C 3.459 3.207 -4.461 1.00 . A A . 10 TRP CD2 1 1 13 9133 1 1 10 TRP CE2 C 4.789 3.385 -4.938 1.00 . A A . 10 TRP CE2 1 1 13 9134 1 1 10 TRP CE3 C 3.031 4.063 -3.426 1.00 . A A . 10 TRP CE3 1 1 13 9135 1 1 10 TRP CG C 2.851 2.115 -5.213 1.00 . A A . 10 TRP CG 1 1 13 9136 1 1 10 TRP CH2 C 5.135 5.281 -3.485 1.00 . A A . 10 TRP CH2 1 1 13 9137 1 1 10 TRP CZ2 C 5.624 4.408 -4.468 1.00 . A A . 10 TRP CZ2 1 1 13 9138 1 1 10 TRP CZ3 C 3.848 5.105 -2.961 1.00 . A A . 10 TRP CZ3 1 1 13 9139 1 1 10 TRP H H -1.074 1.408 -5.703 1.00 . A A . 10 TRP H 1 1 13 9140 1 1 10 TRP HA H 0.906 2.966 -6.901 1.00 . A A . 10 TRP HA 1 1 13 9141 1 1 10 TRP HB2 H 0.867 2.266 -4.515 1.00 . A A . 10 TRP HB2 1 1 13 9142 1 1 10 TRP HB3 H 1.346 0.630 -4.983 1.00 . A A . 10 TRP HB3 1 1 13 9143 1 1 10 TRP HD1 H 3.762 0.706 -6.578 1.00 . A A . 10 TRP HD1 1 1 13 9144 1 1 10 TRP HE1 H 5.864 2.177 -6.297 1.00 . A A . 10 TRP HE1 1 1 13 9145 1 1 10 TRP HE3 H 2.080 3.891 -2.960 1.00 . A A . 10 TRP HE3 1 1 13 9146 1 1 10 TRP HH2 H 5.732 6.097 -3.133 1.00 . A A . 10 TRP HH2 1 1 13 9147 1 1 10 TRP HZ2 H 6.618 4.528 -4.872 1.00 . A A . 10 TRP HZ2 1 1 13 9148 1 1 10 TRP HZ3 H 3.486 5.790 -2.212 1.00 . A A . 10 TRP HZ3 1 1 13 9149 1 1 10 TRP N N -0.654 1.657 -6.584 1.00 . A A . 10 TRP N 1 1 13 9150 1 1 10 TRP NE1 N 4.979 2.350 -5.825 1.00 . A A . 10 TRP NE1 1 1 13 9151 1 1 10 TRP O O 1.540 -0.205 -7.479 1.00 . A A . 10 TRP O 1 1 13 9152 1 1 11 SER C C 3.298 0.171 -10.179 1.00 . A A . 11 SER C 1 1 13 9153 1 1 11 SER CA C 1.920 0.832 -10.073 1.00 . A A . 11 SER CA 1 1 13 9154 1 1 11 SER CB C 1.633 1.804 -11.227 1.00 . A A . 11 SER CB 1 1 13 9155 1 1 11 SER H H 1.527 2.551 -8.975 1.00 . A A . 11 SER H 1 1 13 9156 1 1 11 SER HA H 1.167 0.042 -10.102 1.00 . A A . 11 SER HA 1 1 13 9157 1 1 11 SER HB2 H 2.539 2.350 -11.498 1.00 . A A . 11 SER HB2 1 1 13 9158 1 1 11 SER HB3 H 1.289 1.249 -12.101 1.00 . A A . 11 SER HB3 1 1 13 9159 1 1 11 SER HG H -0.047 2.339 -10.323 1.00 . A A . 11 SER HG 1 1 13 9160 1 1 11 SER N N 1.743 1.570 -8.841 1.00 . A A . 11 SER N 1 1 13 9161 1 1 11 SER O O 4.032 0.418 -11.132 1.00 . A A . 11 SER O 1 1 13 9162 1 1 11 SER OG O 0.665 2.765 -10.825 1.00 . A A . 11 SER OG 1 1 13 9163 1 1 12 GLY C C 5.487 -1.624 -7.859 1.00 . A A . 12 GLY C 1 1 13 9164 1 1 12 GLY CA C 4.877 -1.465 -9.248 1.00 . A A . 12 GLY CA 1 1 13 9165 1 1 12 GLY H H 2.993 -0.837 -8.451 1.00 . A A . 12 GLY H 1 1 13 9166 1 1 12 GLY HA2 H 4.673 -2.458 -9.636 1.00 . A A . 12 GLY HA2 1 1 13 9167 1 1 12 GLY HA3 H 5.608 -1.000 -9.909 1.00 . A A . 12 GLY HA3 1 1 13 9168 1 1 12 GLY N N 3.647 -0.688 -9.214 1.00 . A A . 12 GLY N 1 1 13 9169 1 1 12 GLY O O 4.891 -2.238 -6.969 1.00 . A A . 12 GLY O 1 1 13 9170 1 1 13 ASN C C 7.445 0.093 -5.724 1.00 . A A . 13 ASN C 1 1 13 9171 1 1 13 ASN CA C 7.522 -1.212 -6.506 1.00 . A A . 13 ASN CA 1 1 13 9172 1 1 13 ASN CB C 8.966 -1.528 -6.906 1.00 . A A . 13 ASN CB 1 1 13 9173 1 1 13 ASN CG C 9.800 -2.111 -5.769 1.00 . A A . 13 ASN CG 1 1 13 9174 1 1 13 ASN H H 7.079 -0.591 -8.490 1.00 . A A . 13 ASN H 1 1 13 9175 1 1 13 ASN HA H 7.147 -2.038 -5.903 1.00 . A A . 13 ASN HA 1 1 13 9176 1 1 13 ASN HB2 H 8.926 -2.288 -7.679 1.00 . A A . 13 ASN HB2 1 1 13 9177 1 1 13 ASN HB3 H 9.452 -0.640 -7.314 1.00 . A A . 13 ASN HB3 1 1 13 9178 1 1 13 ASN HD21 H 10.028 -0.294 -4.782 1.00 . A A . 13 ASN HD21 1 1 13 9179 1 1 13 ASN HD22 H 10.866 -1.661 -4.119 1.00 . A A . 13 ASN HD22 1 1 13 9180 1 1 13 ASN N N 6.704 -1.106 -7.707 1.00 . A A . 13 ASN N 1 1 13 9181 1 1 13 ASN ND2 N 10.252 -1.290 -4.823 1.00 . A A . 13 ASN ND2 1 1 13 9182 1 1 13 ASN O O 7.379 1.169 -6.318 1.00 . A A . 13 ASN O 1 1 13 9183 1 1 13 ASN OD1 O 10.068 -3.317 -5.764 1.00 . A A . 13 ASN OD1 1 1 13 9184 1 1 14 CYS C C 8.685 1.883 -3.485 1.00 . A A . 14 CYS C 1 1 13 9185 1 1 14 CYS CA C 7.356 1.138 -3.499 1.00 . A A . 14 CYS CA 1 1 13 9186 1 1 14 CYS CB C 6.920 0.686 -2.101 1.00 . A A . 14 CYS CB 1 1 13 9187 1 1 14 CYS H H 7.639 -0.906 -4.001 1.00 . A A . 14 CYS H 1 1 13 9188 1 1 14 CYS HA H 6.593 1.819 -3.858 1.00 . A A . 14 CYS HA 1 1 13 9189 1 1 14 CYS HB2 H 5.839 0.560 -2.114 1.00 . A A . 14 CYS HB2 1 1 13 9190 1 1 14 CYS HB3 H 7.364 -0.272 -1.865 1.00 . A A . 14 CYS HB3 1 1 13 9191 1 1 14 CYS N N 7.438 0.002 -4.398 1.00 . A A . 14 CYS N 1 1 13 9192 1 1 14 CYS O O 9.735 1.277 -3.699 1.00 . A A . 14 CYS O 1 1 13 9193 1 1 14 CYS SG S 7.330 1.823 -0.753 1.00 . A A . 14 CYS SG 1 1 13 9194 1 1 15 GLY C C 9.835 4.659 -1.722 1.00 . A A . 15 GLY C 1 1 13 9195 1 1 15 GLY CA C 9.730 4.109 -3.142 1.00 . A A . 15 GLY CA 1 1 13 9196 1 1 15 GLY H H 7.679 3.580 -3.135 1.00 . A A . 15 GLY H 1 1 13 9197 1 1 15 GLY HA2 H 10.661 3.605 -3.386 1.00 . A A . 15 GLY HA2 1 1 13 9198 1 1 15 GLY HA3 H 9.592 4.941 -3.833 1.00 . A A . 15 GLY HA3 1 1 13 9199 1 1 15 GLY N N 8.602 3.199 -3.265 1.00 . A A . 15 GLY N 1 1 13 9200 1 1 15 GLY O O 10.931 4.777 -1.178 1.00 . A A . 15 GLY O 1 1 13 9201 1 1 16 ASN C C 7.274 5.301 0.881 1.00 . A A . 16 ASN C 1 1 13 9202 1 1 16 ASN CA C 8.637 5.554 0.234 1.00 . A A . 16 ASN CA 1 1 13 9203 1 1 16 ASN CB C 8.968 7.054 0.215 1.00 . A A . 16 ASN CB 1 1 13 9204 1 1 16 ASN CG C 9.253 7.591 1.613 1.00 . A A . 16 ASN CG 1 1 13 9205 1 1 16 ASN H H 7.827 4.849 -1.601 1.00 . A A . 16 ASN H 1 1 13 9206 1 1 16 ASN HA H 9.403 5.052 0.830 1.00 . A A . 16 ASN HA 1 1 13 9207 1 1 16 ASN HB2 H 9.866 7.211 -0.384 1.00 . A A . 16 ASN HB2 1 1 13 9208 1 1 16 ASN HB3 H 8.147 7.619 -0.225 1.00 . A A . 16 ASN HB3 1 1 13 9209 1 1 16 ASN HD21 H 10.310 9.166 0.871 1.00 . A A . 16 ASN HD21 1 1 13 9210 1 1 16 ASN HD22 H 10.170 9.078 2.614 1.00 . A A . 16 ASN HD22 1 1 13 9211 1 1 16 ASN N N 8.692 5.003 -1.115 1.00 . A A . 16 ASN N 1 1 13 9212 1 1 16 ASN ND2 N 9.954 8.715 1.701 1.00 . A A . 16 ASN ND2 1 1 13 9213 1 1 16 ASN O O 6.236 5.718 0.358 1.00 . A A . 16 ASN O 1 1 13 9214 1 1 16 ASN OD1 O 8.828 7.017 2.613 1.00 . A A . 16 ASN OD1 1 1 13 9215 1 1 17 THR C C 5.353 5.696 3.191 1.00 . A A . 17 THR C 1 1 13 9216 1 1 17 THR CA C 6.070 4.393 2.818 1.00 . A A . 17 THR CA 1 1 13 9217 1 1 17 THR CB C 6.389 3.483 4.016 1.00 . A A . 17 THR CB 1 1 13 9218 1 1 17 THR CG2 C 7.061 4.215 5.180 1.00 . A A . 17 THR CG2 1 1 13 9219 1 1 17 THR H H 8.167 4.392 2.451 1.00 . A A . 17 THR H 1 1 13 9220 1 1 17 THR HA H 5.418 3.831 2.161 1.00 . A A . 17 THR HA 1 1 13 9221 1 1 17 THR HB H 7.073 2.707 3.676 1.00 . A A . 17 THR HB 1 1 13 9222 1 1 17 THR HG1 H 4.635 3.485 4.861 1.00 . A A . 17 THR HG1 1 1 13 9223 1 1 17 THR HG21 H 7.964 4.721 4.836 1.00 . A A . 17 THR HG21 1 1 13 9224 1 1 17 THR HG22 H 6.388 4.947 5.626 1.00 . A A . 17 THR HG22 1 1 13 9225 1 1 17 THR HG23 H 7.340 3.489 5.947 1.00 . A A . 17 THR HG23 1 1 13 9226 1 1 17 THR N N 7.279 4.656 2.050 1.00 . A A . 17 THR N 1 1 13 9227 1 1 17 THR O O 4.121 5.742 3.259 1.00 . A A . 17 THR O 1 1 13 9228 1 1 17 THR OG1 O 5.215 2.831 4.460 1.00 . A A . 17 THR OG1 1 1 13 9229 1 1 18 ALA C C 4.773 8.632 2.481 1.00 . A A . 18 ALA C 1 1 13 9230 1 1 18 ALA CA C 5.588 8.095 3.657 1.00 . A A . 18 ALA CA 1 1 13 9231 1 1 18 ALA CB C 6.723 9.055 4.021 1.00 . A A . 18 ALA CB 1 1 13 9232 1 1 18 ALA H H 7.131 6.680 3.301 1.00 . A A . 18 ALA H 1 1 13 9233 1 1 18 ALA HA H 4.912 8.021 4.511 1.00 . A A . 18 ALA HA 1 1 13 9234 1 1 18 ALA HB1 H 7.312 8.641 4.841 1.00 . A A . 18 ALA HB1 1 1 13 9235 1 1 18 ALA HB2 H 7.369 9.219 3.159 1.00 . A A . 18 ALA HB2 1 1 13 9236 1 1 18 ALA HB3 H 6.305 10.012 4.335 1.00 . A A . 18 ALA HB3 1 1 13 9237 1 1 18 ALA N N 6.122 6.771 3.386 1.00 . A A . 18 ALA N 1 1 13 9238 1 1 18 ALA O O 3.935 9.510 2.695 1.00 . A A . 18 ALA O 1 1 13 9239 1 1 19 HIS C C 2.914 7.289 0.320 1.00 . A A . 19 HIS C 1 1 13 9240 1 1 19 HIS CA C 4.013 8.337 0.192 1.00 . A A . 19 HIS CA 1 1 13 9241 1 1 19 HIS CB C 4.633 8.312 -1.211 1.00 . A A . 19 HIS CB 1 1 13 9242 1 1 19 HIS CD2 C 2.387 9.189 -2.232 1.00 . A A . 19 HIS CD2 1 1 13 9243 1 1 19 HIS CE1 C 2.686 8.522 -4.290 1.00 . A A . 19 HIS CE1 1 1 13 9244 1 1 19 HIS CG C 3.623 8.589 -2.310 1.00 . A A . 19 HIS CG 1 1 13 9245 1 1 19 HIS H H 5.667 7.389 1.131 1.00 . A A . 19 HIS H 1 1 13 9246 1 1 19 HIS HA H 3.567 9.326 0.314 1.00 . A A . 19 HIS HA 1 1 13 9247 1 1 19 HIS HB2 H 5.419 9.060 -1.273 1.00 . A A . 19 HIS HB2 1 1 13 9248 1 1 19 HIS HB3 H 5.091 7.338 -1.365 1.00 . A A . 19 HIS HB3 1 1 13 9249 1 1 19 HIS HD1 H 4.642 7.786 -4.035 1.00 . A A . 19 HIS HD1 1 1 13 9250 1 1 19 HIS HD2 H 1.923 9.576 -1.332 1.00 . A A . 19 HIS HD2 1 1 13 9251 1 1 19 HIS HE1 H 2.506 8.310 -5.336 1.00 . A A . 19 HIS HE1 1 1 13 9252 1 1 19 HIS N N 4.982 8.127 1.256 1.00 . A A . 19 HIS N 1 1 13 9253 1 1 19 HIS ND1 N 3.823 8.230 -3.637 1.00 . A A . 19 HIS ND1 1 1 13 9254 1 1 19 HIS NE2 N 1.792 9.106 -3.477 1.00 . A A . 19 HIS NE2 1 1 13 9255 1 1 19 HIS O O 1.747 7.662 0.324 1.00 . A A . 19 HIS O 1 1 13 9256 1 1 20 CYS C C 1.075 5.141 1.251 1.00 . A A . 20 CYS C 1 1 13 9257 1 1 20 CYS CA C 2.303 4.891 0.383 1.00 . A A . 20 CYS CA 1 1 13 9258 1 1 20 CYS CB C 2.955 3.610 0.874 1.00 . A A . 20 CYS CB 1 1 13 9259 1 1 20 CYS H H 4.258 5.775 0.403 1.00 . A A . 20 CYS H 1 1 13 9260 1 1 20 CYS HA H 1.973 4.738 -0.641 1.00 . A A . 20 CYS HA 1 1 13 9261 1 1 20 CYS HB2 H 3.761 3.354 0.195 1.00 . A A . 20 CYS HB2 1 1 13 9262 1 1 20 CYS HB3 H 3.336 3.762 1.879 1.00 . A A . 20 CYS HB3 1 1 13 9263 1 1 20 CYS N N 3.266 6.000 0.398 1.00 . A A . 20 CYS N 1 1 13 9264 1 1 20 CYS O O -0.063 4.958 0.813 1.00 . A A . 20 CYS O 1 1 13 9265 1 1 20 CYS SG S 1.816 2.220 1.022 1.00 . A A . 20 CYS SG 1 1 13 9266 1 1 21 ASP C C -0.711 6.891 2.873 1.00 . A A . 21 ASP C 1 1 13 9267 1 1 21 ASP CA C 0.226 5.806 3.412 1.00 . A A . 21 ASP CA 1 1 13 9268 1 1 21 ASP CB C 0.779 6.206 4.784 1.00 . A A . 21 ASP CB 1 1 13 9269 1 1 21 ASP CG C -0.361 6.384 5.777 1.00 . A A . 21 ASP CG 1 1 13 9270 1 1 21 ASP H H 2.279 5.714 2.788 1.00 . A A . 21 ASP H 1 1 13 9271 1 1 21 ASP HA H -0.332 4.869 3.505 1.00 . A A . 21 ASP HA 1 1 13 9272 1 1 21 ASP HB2 H 1.450 5.427 5.149 1.00 . A A . 21 ASP HB2 1 1 13 9273 1 1 21 ASP HB3 H 1.337 7.139 4.708 1.00 . A A . 21 ASP HB3 1 1 13 9274 1 1 21 ASP N N 1.316 5.595 2.482 1.00 . A A . 21 ASP N 1 1 13 9275 1 1 21 ASP O O -1.924 6.757 2.991 1.00 . A A . 21 ASP O 1 1 13 9276 1 1 21 ASP OD1 O -1.006 7.581 5.739 1.00 . A A . 21 ASP OD1 1 1 13 9277 1 1 21 ASP OD2 O -0.652 5.450 6.523 1.00 . A A . 21 ASP OD2 1 1 13 9278 1 1 22 LYS C C -1.690 8.336 0.419 1.00 . A A . 22 LYS C 1 1 13 9279 1 1 22 LYS CA C -0.965 8.959 1.611 1.00 . A A . 22 LYS CA 1 1 13 9280 1 1 22 LYS CB C -0.152 10.175 1.148 1.00 . A A . 22 LYS CB 1 1 13 9281 1 1 22 LYS CD C 1.540 11.939 1.688 1.00 . A A . 22 LYS CD 1 1 13 9282 1 1 22 LYS CE C 2.278 12.736 2.775 1.00 . A A . 22 LYS CE 1 1 13 9283 1 1 22 LYS CG C 0.773 10.720 2.228 1.00 . A A . 22 LYS CG 1 1 13 9284 1 1 22 LYS H H 0.839 7.908 2.050 1.00 . A A . 22 LYS H 1 1 13 9285 1 1 22 LYS HA H -1.670 9.330 2.350 1.00 . A A . 22 LYS HA 1 1 13 9286 1 1 22 LYS HB2 H 0.434 9.925 0.269 1.00 . A A . 22 LYS HB2 1 1 13 9287 1 1 22 LYS HB3 H -0.854 10.966 0.886 1.00 . A A . 22 LYS HB3 1 1 13 9288 1 1 22 LYS HD2 H 2.255 11.598 0.934 1.00 . A A . 22 LYS HD2 1 1 13 9289 1 1 22 LYS HD3 H 0.840 12.617 1.198 1.00 . A A . 22 LYS HD3 1 1 13 9290 1 1 22 LYS HE2 H 2.932 13.463 2.290 1.00 . A A . 22 LYS HE2 1 1 13 9291 1 1 22 LYS HE3 H 1.551 13.280 3.379 1.00 . A A . 22 LYS HE3 1 1 13 9292 1 1 22 LYS HG2 H 0.176 10.980 3.104 1.00 . A A . 22 LYS HG2 1 1 13 9293 1 1 22 LYS HG3 H 1.451 9.907 2.455 1.00 . A A . 22 LYS HG3 1 1 13 9294 1 1 22 LYS HZ1 H 2.880 10.880 3.447 1.00 . A A . 22 LYS HZ1 1 1 13 9295 1 1 22 LYS HZ2 H 4.081 12.056 3.512 1.00 . A A . 22 LYS HZ2 1 1 13 9296 1 1 22 LYS N N -0.153 7.939 2.259 1.00 . A A . 22 LYS N 1 1 13 9297 1 1 22 LYS NZ N 3.080 11.868 3.660 1.00 . A A . 22 LYS NZ 1 1 13 9298 1 1 22 LYS O O -2.908 8.418 0.324 1.00 . A A . 22 LYS O 1 1 13 9299 1 1 23 GLN C C -2.675 6.408 -1.620 1.00 . A A . 23 GLN C 1 1 13 9300 1 1 23 GLN CA C -1.363 7.183 -1.782 1.00 . A A . 23 GLN CA 1 1 13 9301 1 1 23 GLN CB C -0.222 6.302 -2.326 1.00 . A A . 23 GLN CB 1 1 13 9302 1 1 23 GLN CD C -0.558 6.098 -4.865 1.00 . A A . 23 GLN CD 1 1 13 9303 1 1 23 GLN CG C -0.549 5.389 -3.516 1.00 . A A . 23 GLN CG 1 1 13 9304 1 1 23 GLN H H 0.053 7.650 -0.266 1.00 . A A . 23 GLN H 1 1 13 9305 1 1 23 GLN HA H -1.528 8.011 -2.474 1.00 . A A . 23 GLN HA 1 1 13 9306 1 1 23 GLN HB2 H 0.655 6.905 -2.546 1.00 . A A . 23 GLN HB2 1 1 13 9307 1 1 23 GLN HB3 H 0.056 5.618 -1.531 1.00 . A A . 23 GLN HB3 1 1 13 9308 1 1 23 GLN HE21 H -1.433 4.475 -5.746 1.00 . A A . 23 GLN HE21 1 1 13 9309 1 1 23 GLN HE22 H -0.937 5.764 -6.829 1.00 . A A . 23 GLN HE22 1 1 13 9310 1 1 23 GLN HG2 H 0.250 4.659 -3.593 1.00 . A A . 23 GLN HG2 1 1 13 9311 1 1 23 GLN HG3 H -1.472 4.844 -3.356 1.00 . A A . 23 GLN HG3 1 1 13 9312 1 1 23 GLN N N -0.931 7.718 -0.493 1.00 . A A . 23 GLN N 1 1 13 9313 1 1 23 GLN NE2 N -1.020 5.392 -5.895 1.00 . A A . 23 GLN NE2 1 1 13 9314 1 1 23 GLN O O -3.659 6.696 -2.304 1.00 . A A . 23 GLN O 1 1 13 9315 1 1 23 GLN OE1 O -0.109 7.238 -4.983 1.00 . A A . 23 GLN OE1 1 1 13 9316 1 1 24 CYS C C -5.079 5.291 0.024 1.00 . A A . 24 CYS C 1 1 13 9317 1 1 24 CYS CA C -3.825 4.548 -0.460 1.00 . A A . 24 CYS CA 1 1 13 9318 1 1 24 CYS CB C -3.445 3.487 0.580 1.00 . A A . 24 CYS CB 1 1 13 9319 1 1 24 CYS H H -1.831 5.274 -0.169 1.00 . A A . 24 CYS H 1 1 13 9320 1 1 24 CYS HA H -4.080 4.057 -1.403 1.00 . A A . 24 CYS HA 1 1 13 9321 1 1 24 CYS HB2 H -3.086 3.990 1.478 1.00 . A A . 24 CYS HB2 1 1 13 9322 1 1 24 CYS HB3 H -4.335 2.920 0.842 1.00 . A A . 24 CYS HB3 1 1 13 9323 1 1 24 CYS N N -2.683 5.437 -0.698 1.00 . A A . 24 CYS N 1 1 13 9324 1 1 24 CYS O O -6.182 4.756 -0.086 1.00 . A A . 24 CYS O 1 1 13 9325 1 1 24 CYS SG S -2.200 2.268 0.095 1.00 . A A . 24 CYS SG 1 1 13 9326 1 1 25 GLN C C -6.363 8.371 -0.042 1.00 . A A . 25 GLN C 1 1 13 9327 1 1 25 GLN CA C -5.995 7.351 1.054 1.00 . A A . 25 GLN CA 1 1 13 9328 1 1 25 GLN CB C -5.565 8.061 2.348 1.00 . A A . 25 GLN CB 1 1 13 9329 1 1 25 GLN CD C -4.705 7.719 4.738 1.00 . A A . 25 GLN CD 1 1 13 9330 1 1 25 GLN CG C -5.241 7.057 3.466 1.00 . A A . 25 GLN CG 1 1 13 9331 1 1 25 GLN H H -3.972 6.871 0.660 1.00 . A A . 25 GLN H 1 1 13 9332 1 1 25 GLN HA H -6.862 6.738 1.308 1.00 . A A . 25 GLN HA 1 1 13 9333 1 1 25 GLN HB2 H -4.688 8.682 2.160 1.00 . A A . 25 GLN HB2 1 1 13 9334 1 1 25 GLN HB3 H -6.382 8.709 2.668 1.00 . A A . 25 GLN HB3 1 1 13 9335 1 1 25 GLN HE21 H -6.216 9.080 4.760 1.00 . A A . 25 GLN HE21 1 1 13 9336 1 1 25 GLN HE22 H -5.050 9.201 6.063 1.00 . A A . 25 GLN HE22 1 1 13 9337 1 1 25 GLN HG2 H -6.142 6.494 3.719 1.00 . A A . 25 GLN HG2 1 1 13 9338 1 1 25 GLN HG3 H -4.486 6.360 3.111 1.00 . A A . 25 GLN HG3 1 1 13 9339 1 1 25 GLN N N -4.911 6.492 0.590 1.00 . A A . 25 GLN N 1 1 13 9340 1 1 25 GLN NE2 N -5.372 8.767 5.213 1.00 . A A . 25 GLN NE2 1 1 13 9341 1 1 25 GLN O O -7.528 8.732 -0.223 1.00 . A A . 25 GLN O 1 1 13 9342 1 1 25 GLN OE1 O -3.695 7.297 5.302 1.00 . A A . 25 GLN OE1 1 1 13 9343 1 1 26 ASP C C -6.204 9.388 -2.984 1.00 . A A . 26 ASP C 1 1 13 9344 1 1 26 ASP CA C -5.463 9.916 -1.768 1.00 . A A . 26 ASP CA 1 1 13 9345 1 1 26 ASP CB C -4.084 10.417 -2.216 1.00 . A A . 26 ASP CB 1 1 13 9346 1 1 26 ASP CG C -3.269 11.120 -1.142 1.00 . A A . 26 ASP CG 1 1 13 9347 1 1 26 ASP H H -4.435 8.490 -0.579 1.00 . A A . 26 ASP H 1 1 13 9348 1 1 26 ASP HA H -6.015 10.757 -1.359 1.00 . A A . 26 ASP HA 1 1 13 9349 1 1 26 ASP HB2 H -3.497 9.585 -2.590 1.00 . A A . 26 ASP HB2 1 1 13 9350 1 1 26 ASP HB3 H -4.227 11.126 -3.032 1.00 . A A . 26 ASP HB3 1 1 13 9351 1 1 26 ASP N N -5.353 8.863 -0.767 1.00 . A A . 26 ASP N 1 1 13 9352 1 1 26 ASP O O -7.232 9.938 -3.375 1.00 . A A . 26 ASP O 1 1 13 9353 1 1 26 ASP OD1 O -3.957 11.739 -0.145 1.00 . A A . 26 ASP OD1 1 1 13 9354 1 1 26 ASP OD2 O -2.043 11.102 -1.230 1.00 . A A . 26 ASP OD2 1 1 13 9355 1 1 27 TRP C C -7.379 6.887 -4.422 1.00 . A A . 27 TRP C 1 1 13 9356 1 1 27 TRP CA C -6.189 7.759 -4.810 1.00 . A A . 27 TRP CA 1 1 13 9357 1 1 27 TRP CB C -5.101 6.912 -5.479 1.00 . A A . 27 TRP CB 1 1 13 9358 1 1 27 TRP CD1 C -3.273 8.661 -5.681 1.00 . A A . 27 TRP CD1 1 1 13 9359 1 1 27 TRP CD2 C -3.359 7.283 -7.438 1.00 . A A . 27 TRP CD2 1 1 13 9360 1 1 27 TRP CE2 C -2.207 8.107 -7.613 1.00 . A A . 27 TRP CE2 1 1 13 9361 1 1 27 TRP CE3 C -3.637 6.338 -8.446 1.00 . A A . 27 TRP CE3 1 1 13 9362 1 1 27 TRP CG C -3.973 7.613 -6.162 1.00 . A A . 27 TRP CG 1 1 13 9363 1 1 27 TRP CH2 C -1.616 6.958 -9.658 1.00 . A A . 27 TRP CH2 1 1 13 9364 1 1 27 TRP CZ2 C -1.347 7.960 -8.708 1.00 . A A . 27 TRP CZ2 1 1 13 9365 1 1 27 TRP CZ3 C -2.771 6.168 -9.540 1.00 . A A . 27 TRP CZ3 1 1 13 9366 1 1 27 TRP H H -4.861 7.879 -3.148 1.00 . A A . 27 TRP H 1 1 13 9367 1 1 27 TRP HA H -6.519 8.542 -5.496 1.00 . A A . 27 TRP HA 1 1 13 9368 1 1 27 TRP HB2 H -4.641 6.232 -4.766 1.00 . A A . 27 TRP HB2 1 1 13 9369 1 1 27 TRP HB3 H -5.603 6.310 -6.233 1.00 . A A . 27 TRP HB3 1 1 13 9370 1 1 27 TRP HD1 H -3.455 9.156 -4.744 1.00 . A A . 27 TRP HD1 1 1 13 9371 1 1 27 TRP HE1 H -1.529 9.661 -6.339 1.00 . A A . 27 TRP HE1 1 1 13 9372 1 1 27 TRP HE3 H -4.521 5.726 -8.370 1.00 . A A . 27 TRP HE3 1 1 13 9373 1 1 27 TRP HH2 H -0.945 6.783 -10.483 1.00 . A A . 27 TRP HH2 1 1 13 9374 1 1 27 TRP HZ2 H -0.478 8.592 -8.814 1.00 . A A . 27 TRP HZ2 1 1 13 9375 1 1 27 TRP HZ3 H -2.987 5.419 -10.288 1.00 . A A . 27 TRP HZ3 1 1 13 9376 1 1 27 TRP N N -5.662 8.329 -3.583 1.00 . A A . 27 TRP N 1 1 13 9377 1 1 27 TRP NE1 N -2.222 8.950 -6.519 1.00 . A A . 27 TRP NE1 1 1 13 9378 1 1 27 TRP O O -8.541 7.293 -4.517 1.00 . A A . 27 TRP O 1 1 13 9379 1 1 28 GLU C C -8.496 5.359 -2.003 1.00 . A A . 28 GLU C 1 1 13 9380 1 1 28 GLU CA C -8.018 4.774 -3.333 1.00 . A A . 28 GLU CA 1 1 13 9381 1 1 28 GLU CB C -7.336 3.391 -3.199 1.00 . A A . 28 GLU CB 1 1 13 9382 1 1 28 GLU CD C -9.427 2.030 -3.733 1.00 . A A . 28 GLU CD 1 1 13 9383 1 1 28 GLU CG C -7.986 2.348 -4.122 1.00 . A A . 28 GLU CG 1 1 13 9384 1 1 28 GLU H H -6.083 5.533 -3.696 1.00 . A A . 28 GLU H 1 1 13 9385 1 1 28 GLU HA H -8.878 4.714 -4.003 1.00 . A A . 28 GLU HA 1 1 13 9386 1 1 28 GLU HB2 H -6.284 3.460 -3.478 1.00 . A A . 28 GLU HB2 1 1 13 9387 1 1 28 GLU HB3 H -7.357 3.023 -2.172 1.00 . A A . 28 GLU HB3 1 1 13 9388 1 1 28 GLU HG2 H -7.964 2.715 -5.148 1.00 . A A . 28 GLU HG2 1 1 13 9389 1 1 28 GLU HG3 H -7.410 1.424 -4.073 1.00 . A A . 28 GLU HG3 1 1 13 9390 1 1 28 GLU N N -7.057 5.709 -3.879 1.00 . A A . 28 GLU N 1 1 13 9391 1 1 28 GLU O O -8.307 6.544 -1.741 1.00 . A A . 28 GLU O 1 1 13 9392 1 1 28 GLU OE1 O -9.835 2.332 -2.615 1.00 . A A . 28 GLU OE1 1 1 13 9393 1 1 28 GLU OE2 O -10.182 1.418 -4.683 1.00 . A A . 28 GLU OE2 1 1 13 9394 1 1 29 LYS C C -9.836 3.786 0.955 1.00 . A A . 29 LYS C 1 1 13 9395 1 1 29 LYS CA C -9.828 4.987 0.020 1.00 . A A . 29 LYS CA 1 1 13 9396 1 1 29 LYS CB C -11.261 5.421 -0.365 1.00 . A A . 29 LYS CB 1 1 13 9397 1 1 29 LYS CD C -10.929 7.952 -0.597 1.00 . A A . 29 LYS CD 1 1 13 9398 1 1 29 LYS CE C -10.608 9.073 -1.598 1.00 . A A . 29 LYS CE 1 1 13 9399 1 1 29 LYS CG C -11.382 6.652 -1.282 1.00 . A A . 29 LYS CG 1 1 13 9400 1 1 29 LYS H H -9.202 3.585 -1.355 1.00 . A A . 29 LYS H 1 1 13 9401 1 1 29 LYS HA H -9.257 5.765 0.489 1.00 . A A . 29 LYS HA 1 1 13 9402 1 1 29 LYS HB2 H -11.748 4.580 -0.861 1.00 . A A . 29 LYS HB2 1 1 13 9403 1 1 29 LYS HB3 H -11.813 5.633 0.552 1.00 . A A . 29 LYS HB3 1 1 13 9404 1 1 29 LYS HD2 H -11.729 8.283 0.070 1.00 . A A . 29 LYS HD2 1 1 13 9405 1 1 29 LYS HD3 H -10.046 7.776 0.019 1.00 . A A . 29 LYS HD3 1 1 13 9406 1 1 29 LYS HE2 H -11.432 9.214 -2.299 1.00 . A A . 29 LYS HE2 1 1 13 9407 1 1 29 LYS HE3 H -10.469 9.996 -1.031 1.00 . A A . 29 LYS HE3 1 1 13 9408 1 1 29 LYS HG2 H -10.838 6.471 -2.205 1.00 . A A . 29 LYS HG2 1 1 13 9409 1 1 29 LYS HG3 H -12.433 6.763 -1.553 1.00 . A A . 29 LYS HG3 1 1 13 9410 1 1 29 LYS HZ1 H -9.296 7.801 -2.553 1.00 . A A . 29 LYS HZ1 1 1 13 9411 1 1 29 LYS HZ2 H -9.340 9.352 -3.200 1.00 . A A . 29 LYS HZ2 1 1 13 9412 1 1 29 LYS N N -9.079 4.553 -1.129 1.00 . A A . 29 LYS N 1 1 13 9413 1 1 29 LYS NZ N -9.354 8.804 -2.329 1.00 . A A . 29 LYS NZ 1 1 13 9414 1 1 29 LYS O O -10.860 3.318 1.443 1.00 . A A . 29 LYS O 1 1 13 9415 1 1 30 ALA C C -8.283 3.244 3.578 1.00 . A A . 30 ALA C 1 1 13 9416 1 1 30 ALA CA C -8.280 2.431 2.283 1.00 . A A . 30 ALA CA 1 1 13 9417 1 1 30 ALA CB C -6.895 1.856 1.993 1.00 . A A . 30 ALA CB 1 1 13 9418 1 1 30 ALA H H -7.834 3.814 0.755 1.00 . A A . 30 ALA H 1 1 13 9419 1 1 30 ALA HA H -9.015 1.628 2.333 1.00 . A A . 30 ALA HA 1 1 13 9420 1 1 30 ALA HB1 H -6.829 1.567 0.946 1.00 . A A . 30 ALA HB1 1 1 13 9421 1 1 30 ALA HB2 H -6.137 2.610 2.204 1.00 . A A . 30 ALA HB2 1 1 13 9422 1 1 30 ALA HB3 H -6.712 0.980 2.607 1.00 . A A . 30 ALA HB3 1 1 13 9423 1 1 30 ALA N N -8.609 3.324 1.198 1.00 . A A . 30 ALA N 1 1 13 9424 1 1 30 ALA O O -8.228 4.472 3.541 1.00 . A A . 30 ALA O 1 1 13 9425 1 1 31 SER C C -6.680 3.884 5.977 1.00 . A A . 31 SER C 1 1 13 9426 1 1 31 SER CA C -8.047 3.196 6.003 1.00 . A A . 31 SER CA 1 1 13 9427 1 1 31 SER CB C -8.127 2.109 7.072 1.00 . A A . 31 SER CB 1 1 13 9428 1 1 31 SER H H -8.245 1.566 4.772 1.00 . A A . 31 SER H 1 1 13 9429 1 1 31 SER HA H -8.824 3.930 6.206 1.00 . A A . 31 SER HA 1 1 13 9430 1 1 31 SER HB2 H -7.229 1.502 7.043 1.00 . A A . 31 SER HB2 1 1 13 9431 1 1 31 SER HB3 H -8.153 2.598 8.035 1.00 . A A . 31 SER HB3 1 1 13 9432 1 1 31 SER HG H -10.045 1.859 6.850 1.00 . A A . 31 SER HG 1 1 13 9433 1 1 31 SER N N -8.296 2.575 4.730 1.00 . A A . 31 SER N 1 1 13 9434 1 1 31 SER O O -6.565 5.033 6.396 1.00 . A A . 31 SER O 1 1 13 9435 1 1 31 SER OG O -9.272 1.285 6.887 1.00 . A A . 31 SER OG 1 1 13 9436 1 1 32 HIS C C -3.461 2.923 4.342 1.00 . A A . 32 HIS C 1 1 13 9437 1 1 32 HIS CA C -4.341 3.808 5.239 1.00 . A A . 32 HIS CA 1 1 13 9438 1 1 32 HIS CB C -3.650 4.141 6.578 1.00 . A A . 32 HIS CB 1 1 13 9439 1 1 32 HIS CD2 C -3.351 1.785 7.521 1.00 . A A . 32 HIS CD2 1 1 13 9440 1 1 32 HIS CE1 C -1.210 1.778 7.862 1.00 . A A . 32 HIS CE1 1 1 13 9441 1 1 32 HIS CG C -2.873 3.007 7.183 1.00 . A A . 32 HIS CG 1 1 13 9442 1 1 32 HIS H H -5.810 2.265 5.089 1.00 . A A . 32 HIS H 1 1 13 9443 1 1 32 HIS HA H -4.525 4.733 4.691 1.00 . A A . 32 HIS HA 1 1 13 9444 1 1 32 HIS HB2 H -2.960 4.935 6.393 1.00 . A A . 32 HIS HB2 1 1 13 9445 1 1 32 HIS HB3 H -4.358 4.514 7.316 1.00 . A A . 32 HIS HB3 1 1 13 9446 1 1 32 HIS HD1 H -0.858 3.768 7.195 1.00 . A A . 32 HIS HD1 1 1 13 9447 1 1 32 HIS HD2 H -4.362 1.519 7.307 1.00 . A A . 32 HIS HD2 1 1 13 9448 1 1 32 HIS HE1 H -0.218 1.433 8.101 1.00 . A A . 32 HIS HE1 1 1 13 9449 1 1 32 HIS N N -5.646 3.192 5.471 1.00 . A A . 32 HIS N 1 1 13 9450 1 1 32 HIS ND1 N -1.510 3.015 7.423 1.00 . A A . 32 HIS ND1 1 1 13 9451 1 1 32 HIS NE2 N -2.302 1.000 7.949 1.00 . A A . 32 HIS NE2 1 1 13 9452 1 1 32 HIS O O -3.959 1.953 3.766 1.00 . A A . 32 HIS O 1 1 13 9453 1 1 33 GLY C C 0.128 2.258 4.362 1.00 . A A . 33 GLY C 1 1 13 9454 1 1 33 GLY CA C -1.149 2.465 3.548 1.00 . A A . 33 GLY CA 1 1 13 9455 1 1 33 GLY H H -1.819 4.025 4.797 1.00 . A A . 33 GLY H 1 1 13 9456 1 1 33 GLY HA2 H -1.546 1.505 3.303 1.00 . A A . 33 GLY HA2 1 1 13 9457 1 1 33 GLY HA3 H -0.896 2.952 2.611 1.00 . A A . 33 GLY HA3 1 1 13 9458 1 1 33 GLY N N -2.159 3.233 4.270 1.00 . A A . 33 GLY N 1 1 13 9459 1 1 33 GLY O O 0.358 2.983 5.330 1.00 . A A . 33 GLY O 1 1 13 9460 1 1 34 ALA C C 3.062 0.089 3.589 1.00 . A A . 34 ALA C 1 1 13 9461 1 1 34 ALA CA C 2.287 1.032 4.526 1.00 . A A . 34 ALA CA 1 1 13 9462 1 1 34 ALA CB C 2.166 0.436 5.933 1.00 . A A . 34 ALA CB 1 1 13 9463 1 1 34 ALA H H 0.664 0.678 3.207 1.00 . A A . 34 ALA H 1 1 13 9464 1 1 34 ALA HA H 2.808 1.986 4.592 1.00 . A A . 34 ALA HA 1 1 13 9465 1 1 34 ALA HB1 H 1.593 1.101 6.579 1.00 . A A . 34 ALA HB1 1 1 13 9466 1 1 34 ALA HB2 H 1.663 -0.528 5.899 1.00 . A A . 34 ALA HB2 1 1 13 9467 1 1 34 ALA HB3 H 3.156 0.296 6.364 1.00 . A A . 34 ALA HB3 1 1 13 9468 1 1 34 ALA N N 0.954 1.276 3.978 1.00 . A A . 34 ALA N 1 1 13 9469 1 1 34 ALA O O 2.488 -0.885 3.103 1.00 . A A . 34 ALA O 1 1 13 9470 1 1 35 CYS C C 5.669 -1.720 3.052 1.00 . A A . 35 CYS C 1 1 13 9471 1 1 35 CYS CA C 5.111 -0.465 2.370 1.00 . A A . 35 CYS CA 1 1 13 9472 1 1 35 CYS CB C 6.254 0.338 1.756 1.00 . A A . 35 CYS CB 1 1 13 9473 1 1 35 CYS H H 4.825 1.160 3.682 1.00 . A A . 35 CYS H 1 1 13 9474 1 1 35 CYS HA H 4.455 -0.738 1.554 1.00 . A A . 35 CYS HA 1 1 13 9475 1 1 35 CYS HB2 H 6.873 0.781 2.533 1.00 . A A . 35 CYS HB2 1 1 13 9476 1 1 35 CYS HB3 H 6.865 -0.360 1.211 1.00 . A A . 35 CYS HB3 1 1 13 9477 1 1 35 CYS N N 4.342 0.354 3.297 1.00 . A A . 35 CYS N 1 1 13 9478 1 1 35 CYS O O 6.004 -1.676 4.239 1.00 . A A . 35 CYS O 1 1 13 9479 1 1 35 CYS SG S 5.742 1.596 0.568 1.00 . A A . 35 CYS SG 1 1 13 9480 1 1 36 HIS C C 7.214 -4.740 1.655 1.00 . A A . 36 HIS C 1 1 13 9481 1 1 36 HIS CA C 6.489 -4.042 2.798 1.00 . A A . 36 HIS CA 1 1 13 9482 1 1 36 HIS CB C 5.537 -5.090 3.364 1.00 . A A . 36 HIS CB 1 1 13 9483 1 1 36 HIS CD2 C 3.083 -4.906 4.023 1.00 . A A . 36 HIS CD2 1 1 13 9484 1 1 36 HIS CE1 C 3.263 -3.468 5.656 1.00 . A A . 36 HIS CE1 1 1 13 9485 1 1 36 HIS CG C 4.391 -4.568 4.164 1.00 . A A . 36 HIS CG 1 1 13 9486 1 1 36 HIS H H 5.493 -2.824 1.352 1.00 . A A . 36 HIS H 1 1 13 9487 1 1 36 HIS HA H 7.190 -3.780 3.588 1.00 . A A . 36 HIS HA 1 1 13 9488 1 1 36 HIS HB2 H 5.109 -5.657 2.535 1.00 . A A . 36 HIS HB2 1 1 13 9489 1 1 36 HIS HB3 H 6.104 -5.791 3.978 1.00 . A A . 36 HIS HB3 1 1 13 9490 1 1 36 HIS HD1 H 5.320 -3.056 5.374 1.00 . A A . 36 HIS HD1 1 1 13 9491 1 1 36 HIS HD2 H 2.744 -5.567 3.236 1.00 . A A . 36 HIS HD2 1 1 13 9492 1 1 36 HIS HE1 H 3.014 -2.785 6.456 1.00 . A A . 36 HIS HE1 1 1 13 9493 1 1 36 HIS N N 5.797 -2.839 2.323 1.00 . A A . 36 HIS N 1 1 13 9494 1 1 36 HIS ND1 N 4.499 -3.624 5.168 1.00 . A A . 36 HIS ND1 1 1 13 9495 1 1 36 HIS NE2 N 2.380 -4.261 5.019 1.00 . A A . 36 HIS NE2 1 1 13 9496 1 1 36 HIS O O 6.673 -4.792 0.552 1.00 . A A . 36 HIS O 1 1 13 9497 1 1 37 LYS C C 8.504 -7.592 0.956 1.00 . A A . 37 LYS C 1 1 13 9498 1 1 37 LYS CA C 9.084 -6.179 0.988 1.00 . A A . 37 LYS CA 1 1 13 9499 1 1 37 LYS CB C 10.579 -6.168 1.307 1.00 . A A . 37 LYS CB 1 1 13 9500 1 1 37 LYS CD C 12.864 -7.150 0.612 1.00 . A A . 37 LYS CD 1 1 13 9501 1 1 37 LYS CE C 13.903 -6.103 0.190 1.00 . A A . 37 LYS CE 1 1 13 9502 1 1 37 LYS CG C 11.432 -6.775 0.187 1.00 . A A . 37 LYS CG 1 1 13 9503 1 1 37 LYS H H 8.712 -5.326 2.891 1.00 . A A . 37 LYS H 1 1 13 9504 1 1 37 LYS HA H 8.996 -5.735 0.008 1.00 . A A . 37 LYS HA 1 1 13 9505 1 1 37 LYS HB2 H 10.859 -5.138 1.388 1.00 . A A . 37 LYS HB2 1 1 13 9506 1 1 37 LYS HB3 H 10.757 -6.646 2.263 1.00 . A A . 37 LYS HB3 1 1 13 9507 1 1 37 LYS HD2 H 12.907 -7.304 1.693 1.00 . A A . 37 LYS HD2 1 1 13 9508 1 1 37 LYS HD3 H 13.111 -8.106 0.152 1.00 . A A . 37 LYS HD3 1 1 13 9509 1 1 37 LYS HE2 H 13.540 -5.536 -0.668 1.00 . A A . 37 LYS HE2 1 1 13 9510 1 1 37 LYS HE3 H 14.046 -5.427 1.032 1.00 . A A . 37 LYS HE3 1 1 13 9511 1 1 37 LYS HG2 H 10.957 -7.693 -0.099 1.00 . A A . 37 LYS HG2 1 1 13 9512 1 1 37 LYS HG3 H 11.400 -6.136 -0.697 1.00 . A A . 37 LYS HG3 1 1 13 9513 1 1 37 LYS HZ1 H 15.082 -7.719 -0.329 1.00 . A A . 37 LYS HZ1 1 1 13 9514 1 1 37 LYS HZ2 H 15.527 -6.280 -1.076 1.00 . A A . 37 LYS HZ2 1 1 13 9515 1 1 37 LYS N N 8.357 -5.366 1.949 1.00 . A A . 37 LYS N 1 1 13 9516 1 1 37 LYS NZ N 15.200 -6.704 -0.197 1.00 . A A . 37 LYS NZ 1 1 13 9517 1 1 37 LYS O O 8.393 -8.254 1.985 1.00 . A A . 37 LYS O 1 1 13 9518 1 1 38 ARG C C 8.124 -9.789 -1.866 1.00 . A A . 38 ARG C 1 1 13 9519 1 1 38 ARG CA C 7.539 -9.329 -0.529 1.00 . A A . 38 ARG CA 1 1 13 9520 1 1 38 ARG CB C 6.025 -9.116 -0.600 1.00 . A A . 38 ARG CB 1 1 13 9521 1 1 38 ARG CD C 5.215 -11.308 0.460 1.00 . A A . 38 ARG CD 1 1 13 9522 1 1 38 ARG CG C 5.198 -10.390 -0.776 1.00 . A A . 38 ARG CG 1 1 13 9523 1 1 38 ARG CZ C 6.670 -13.102 1.424 1.00 . A A . 38 ARG CZ 1 1 13 9524 1 1 38 ARG H H 8.194 -7.397 -1.027 1.00 . A A . 38 ARG H 1 1 13 9525 1 1 38 ARG HA H 7.785 -10.039 0.262 1.00 . A A . 38 ARG HA 1 1 13 9526 1 1 38 ARG HB2 H 5.696 -8.610 0.310 1.00 . A A . 38 ARG HB2 1 1 13 9527 1 1 38 ARG HB3 H 5.814 -8.452 -1.441 1.00 . A A . 38 ARG HB3 1 1 13 9528 1 1 38 ARG HD2 H 5.318 -10.686 1.351 1.00 . A A . 38 ARG HD2 1 1 13 9529 1 1 38 ARG HD3 H 4.251 -11.821 0.507 1.00 . A A . 38 ARG HD3 1 1 13 9530 1 1 38 ARG HG2 H 4.173 -10.056 -0.929 1.00 . A A . 38 ARG HG2 1 1 13 9531 1 1 38 ARG HG3 H 5.514 -10.920 -1.674 1.00 . A A . 38 ARG HG3 1 1 13 9532 1 1 38 ARG HH11 H 5.480 -12.190 2.801 1.00 . A A . 38 ARG HH11 1 1 13 9533 1 1 38 ARG HH12 H 6.470 -13.463 3.439 1.00 . A A . 38 ARG HH12 1 1 13 9534 1 1 38 ARG HH21 H 7.884 -14.225 0.255 1.00 . A A . 38 ARG HH21 1 1 13 9535 1 1 38 ARG HH22 H 7.900 -14.671 1.945 1.00 . A A . 38 ARG HH22 1 1 13 9536 1 1 38 ARG N N 8.137 -8.039 -0.244 1.00 . A A . 38 ARG N 1 1 13 9537 1 1 38 ARG NE N 6.263 -12.340 0.393 1.00 . A A . 38 ARG NE 1 1 13 9538 1 1 38 ARG NH1 N 6.177 -12.901 2.652 1.00 . A A . 38 ARG NH1 1 1 13 9539 1 1 38 ARG NH2 N 7.566 -14.067 1.209 1.00 . A A . 38 ARG NH2 1 1 13 9540 1 1 38 ARG O O 8.107 -9.021 -2.825 1.00 . A A . 38 ARG O 1 1 13 9541 1 1 39 GLU C C 10.426 -10.433 -3.598 1.00 . A A . 39 GLU C 1 1 13 9542 1 1 39 GLU CA C 9.438 -11.492 -3.092 1.00 . A A . 39 GLU CA 1 1 13 9543 1 1 39 GLU CB C 8.471 -11.969 -4.189 1.00 . A A . 39 GLU CB 1 1 13 9544 1 1 39 GLU CD C 7.831 -13.955 -2.722 1.00 . A A . 39 GLU CD 1 1 13 9545 1 1 39 GLU CG C 7.338 -12.865 -3.664 1.00 . A A . 39 GLU CG 1 1 13 9546 1 1 39 GLU H H 8.670 -11.591 -1.114 1.00 . A A . 39 GLU H 1 1 13 9547 1 1 39 GLU HA H 10.035 -12.345 -2.770 1.00 . A A . 39 GLU HA 1 1 13 9548 1 1 39 GLU HB2 H 8.022 -11.105 -4.680 1.00 . A A . 39 GLU HB2 1 1 13 9549 1 1 39 GLU HB3 H 9.050 -12.522 -4.930 1.00 . A A . 39 GLU HB3 1 1 13 9550 1 1 39 GLU HG2 H 6.607 -12.251 -3.142 1.00 . A A . 39 GLU HG2 1 1 13 9551 1 1 39 GLU HG3 H 6.836 -13.330 -4.513 1.00 . A A . 39 GLU HG3 1 1 13 9552 1 1 39 GLU N N 8.701 -10.994 -1.927 1.00 . A A . 39 GLU N 1 1 13 9553 1 1 39 GLU O O 10.403 -10.034 -4.759 1.00 . A A . 39 GLU O 1 1 13 9554 1 1 39 GLU OE1 O 8.336 -15.073 -3.310 1.00 . A A . 39 GLU OE1 1 1 13 9555 1 1 39 GLU OE2 O 7.765 -13.766 -1.504 1.00 . A A . 39 GLU OE2 1 1 13 9556 1 1 40 ASN C C 11.604 -7.483 -3.161 1.00 . A A . 40 ASN C 1 1 13 9557 1 1 40 ASN CA C 12.214 -8.852 -2.833 1.00 . A A . 40 ASN CA 1 1 13 9558 1 1 40 ASN CB C 13.279 -9.242 -3.856 1.00 . A A . 40 ASN CB 1 1 13 9559 1 1 40 ASN CG C 14.499 -8.323 -3.780 1.00 . A A . 40 ASN CG 1 1 13 9560 1 1 40 ASN H H 11.230 -10.372 -1.775 1.00 . A A . 40 ASN H 1 1 13 9561 1 1 40 ASN HA H 12.708 -8.756 -1.871 1.00 . A A . 40 ASN HA 1 1 13 9562 1 1 40 ASN HB2 H 13.605 -10.266 -3.683 1.00 . A A . 40 ASN HB2 1 1 13 9563 1 1 40 ASN HB3 H 12.807 -9.199 -4.832 1.00 . A A . 40 ASN HB3 1 1 13 9564 1 1 40 ASN HD21 H 14.770 -8.375 -5.798 1.00 . A A . 40 ASN HD21 1 1 13 9565 1 1 40 ASN HD22 H 15.914 -7.407 -4.893 1.00 . A A . 40 ASN HD22 1 1 13 9566 1 1 40 ASN N N 11.246 -9.930 -2.673 1.00 . A A . 40 ASN N 1 1 13 9567 1 1 40 ASN ND2 N 15.100 -8.002 -4.921 1.00 . A A . 40 ASN ND2 1 1 13 9568 1 1 40 ASN O O 12.306 -6.475 -3.109 1.00 . A A . 40 ASN O 1 1 13 9569 1 1 40 ASN OD1 O 14.911 -7.910 -2.694 1.00 . A A . 40 ASN OD1 1 1 13 9570 1 1 41 HIS C C 8.944 -5.535 -2.787 1.00 . A A . 41 HIS C 1 1 13 9571 1 1 41 HIS CA C 9.652 -6.209 -3.939 1.00 . A A . 41 HIS CA 1 1 13 9572 1 1 41 HIS CB C 8.679 -6.532 -5.070 1.00 . A A . 41 HIS CB 1 1 13 9573 1 1 41 HIS CD2 C 9.607 -8.030 -6.994 1.00 . A A . 41 HIS CD2 1 1 13 9574 1 1 41 HIS CE1 C 10.892 -6.531 -7.930 1.00 . A A . 41 HIS CE1 1 1 13 9575 1 1 41 HIS CG C 9.452 -6.843 -6.325 1.00 . A A . 41 HIS CG 1 1 13 9576 1 1 41 HIS H H 9.725 -8.234 -3.376 1.00 . A A . 41 HIS H 1 1 13 9577 1 1 41 HIS HA H 10.391 -5.520 -4.339 1.00 . A A . 41 HIS HA 1 1 13 9578 1 1 41 HIS HB2 H 8.041 -7.366 -4.770 1.00 . A A . 41 HIS HB2 1 1 13 9579 1 1 41 HIS HB3 H 8.027 -5.671 -5.242 1.00 . A A . 41 HIS HB3 1 1 13 9580 1 1 41 HIS HD1 H 10.325 -4.908 -6.676 1.00 . A A . 41 HIS HD1 1 1 13 9581 1 1 41 HIS HD2 H 9.174 -8.981 -6.712 1.00 . A A . 41 HIS HD2 1 1 13 9582 1 1 41 HIS HE1 H 11.638 -6.075 -8.567 1.00 . A A . 41 HIS HE1 1 1 13 9583 1 1 41 HIS N N 10.309 -7.415 -3.474 1.00 . A A . 41 HIS N 1 1 13 9584 1 1 41 HIS ND1 N 10.228 -5.884 -6.958 1.00 . A A . 41 HIS ND1 1 1 13 9585 1 1 41 HIS NE2 N 10.523 -7.821 -8.007 1.00 . A A . 41 HIS NE2 1 1 13 9586 1 1 41 HIS O O 7.965 -6.055 -2.261 1.00 . A A . 41 HIS O 1 1 13 9587 1 1 42 TRP C C 7.376 -3.113 -2.418 1.00 . A A . 42 TRP C 1 1 13 9588 1 1 42 TRP CA C 8.655 -3.417 -1.652 1.00 . A A . 42 TRP CA 1 1 13 9589 1 1 42 TRP CB C 9.512 -2.191 -1.356 1.00 . A A . 42 TRP CB 1 1 13 9590 1 1 42 TRP CD1 C 11.804 -2.984 -0.660 1.00 . A A . 42 TRP CD1 1 1 13 9591 1 1 42 TRP CD2 C 10.520 -2.417 1.087 1.00 . A A . 42 TRP CD2 1 1 13 9592 1 1 42 TRP CE2 C 11.757 -2.894 1.608 1.00 . A A . 42 TRP CE2 1 1 13 9593 1 1 42 TRP CE3 C 9.502 -2.134 2.020 1.00 . A A . 42 TRP CE3 1 1 13 9594 1 1 42 TRP CG C 10.584 -2.491 -0.365 1.00 . A A . 42 TRP CG 1 1 13 9595 1 1 42 TRP CH2 C 10.937 -2.793 3.880 1.00 . A A . 42 TRP CH2 1 1 13 9596 1 1 42 TRP CZ2 C 11.956 -3.124 2.973 1.00 . A A . 42 TRP CZ2 1 1 13 9597 1 1 42 TRP CZ3 C 9.718 -2.278 3.400 1.00 . A A . 42 TRP CZ3 1 1 13 9598 1 1 42 TRP H H 10.231 -3.990 -2.925 1.00 . A A . 42 TRP H 1 1 13 9599 1 1 42 TRP HA H 8.404 -3.839 -0.691 1.00 . A A . 42 TRP HA 1 1 13 9600 1 1 42 TRP HB2 H 9.949 -1.799 -2.270 1.00 . A A . 42 TRP HB2 1 1 13 9601 1 1 42 TRP HB3 H 8.891 -1.414 -0.930 1.00 . A A . 42 TRP HB3 1 1 13 9602 1 1 42 TRP HD1 H 12.124 -3.264 -1.648 1.00 . A A . 42 TRP HD1 1 1 13 9603 1 1 42 TRP HE1 H 13.454 -3.545 0.568 1.00 . A A . 42 TRP HE1 1 1 13 9604 1 1 42 TRP HE3 H 8.529 -1.855 1.659 1.00 . A A . 42 TRP HE3 1 1 13 9605 1 1 42 TRP HH2 H 11.071 -2.963 4.938 1.00 . A A . 42 TRP HH2 1 1 13 9606 1 1 42 TRP HZ2 H 12.843 -3.659 3.280 1.00 . A A . 42 TRP HZ2 1 1 13 9607 1 1 42 TRP HZ3 H 8.924 -2.030 4.091 1.00 . A A . 42 TRP HZ3 1 1 13 9608 1 1 42 TRP N N 9.429 -4.350 -2.433 1.00 . A A . 42 TRP N 1 1 13 9609 1 1 42 TRP NE1 N 12.520 -3.178 0.499 1.00 . A A . 42 TRP NE1 1 1 13 9610 1 1 42 TRP O O 7.449 -2.579 -3.517 1.00 . A A . 42 TRP O 1 1 13 9611 1 1 43 LYS C C 4.388 -2.093 -1.385 1.00 . A A . 43 LYS C 1 1 13 9612 1 1 43 LYS CA C 4.919 -3.088 -2.397 1.00 . A A . 43 LYS CA 1 1 13 9613 1 1 43 LYS CB C 3.943 -4.265 -2.512 1.00 . A A . 43 LYS CB 1 1 13 9614 1 1 43 LYS CD C 5.431 -5.575 -4.130 1.00 . A A . 43 LYS CD 1 1 13 9615 1 1 43 LYS CE C 4.543 -5.686 -5.392 1.00 . A A . 43 LYS CE 1 1 13 9616 1 1 43 LYS CG C 4.679 -5.571 -2.788 1.00 . A A . 43 LYS CG 1 1 13 9617 1 1 43 LYS H H 6.208 -4.093 -1.068 1.00 . A A . 43 LYS H 1 1 13 9618 1 1 43 LYS HA H 5.019 -2.635 -3.380 1.00 . A A . 43 LYS HA 1 1 13 9619 1 1 43 LYS HB2 H 3.416 -4.382 -1.571 1.00 . A A . 43 LYS HB2 1 1 13 9620 1 1 43 LYS HB3 H 3.189 -4.055 -3.266 1.00 . A A . 43 LYS HB3 1 1 13 9621 1 1 43 LYS HD2 H 6.100 -4.724 -4.220 1.00 . A A . 43 LYS HD2 1 1 13 9622 1 1 43 LYS HD3 H 6.041 -6.477 -4.099 1.00 . A A . 43 LYS HD3 1 1 13 9623 1 1 43 LYS HE2 H 5.195 -5.978 -6.216 1.00 . A A . 43 LYS HE2 1 1 13 9624 1 1 43 LYS HE3 H 3.801 -6.476 -5.258 1.00 . A A . 43 LYS HE3 1 1 13 9625 1 1 43 LYS HG2 H 5.288 -5.758 -1.894 1.00 . A A . 43 LYS HG2 1 1 13 9626 1 1 43 LYS HG3 H 4.019 -6.416 -2.827 1.00 . A A . 43 LYS HG3 1 1 13 9627 1 1 43 LYS HZ1 H 4.126 -4.201 -6.771 1.00 . A A . 43 LYS HZ1 1 1 13 9628 1 1 43 LYS HZ2 H 2.840 -4.567 -5.750 1.00 . A A . 43 LYS HZ2 1 1 13 9629 1 1 43 LYS N N 6.216 -3.509 -1.899 1.00 . A A . 43 LYS N 1 1 13 9630 1 1 43 LYS NZ N 3.860 -4.435 -5.803 1.00 . A A . 43 LYS NZ 1 1 13 9631 1 1 43 LYS O O 4.592 -2.286 -0.187 1.00 . A A . 43 LYS O 1 1 13 9632 1 1 44 CYS C C 1.588 -1.060 -0.684 1.00 . A A . 44 CYS C 1 1 13 9633 1 1 44 CYS CA C 2.849 -0.265 -0.984 1.00 . A A . 44 CYS CA 1 1 13 9634 1 1 44 CYS CB C 2.539 1.059 -1.660 1.00 . A A . 44 CYS CB 1 1 13 9635 1 1 44 CYS H H 3.566 -0.959 -2.850 1.00 . A A . 44 CYS H 1 1 13 9636 1 1 44 CYS HA H 3.356 -0.031 -0.056 1.00 . A A . 44 CYS HA 1 1 13 9637 1 1 44 CYS HB2 H 3.441 1.660 -1.559 1.00 . A A . 44 CYS HB2 1 1 13 9638 1 1 44 CYS HB3 H 2.305 0.901 -2.709 1.00 . A A . 44 CYS HB3 1 1 13 9639 1 1 44 CYS N N 3.688 -1.066 -1.853 1.00 . A A . 44 CYS N 1 1 13 9640 1 1 44 CYS O O 0.759 -1.217 -1.574 1.00 . A A . 44 CYS O 1 1 13 9641 1 1 44 CYS SG S 1.157 1.948 -0.919 1.00 . A A . 44 CYS SG 1 1 13 9642 1 1 45 PHE C C -0.750 -1.264 1.400 1.00 . A A . 45 PHE C 1 1 13 9643 1 1 45 PHE CA C 0.241 -2.306 0.902 1.00 . A A . 45 PHE CA 1 1 13 9644 1 1 45 PHE CB C 0.523 -3.359 1.978 1.00 . A A . 45 PHE CB 1 1 13 9645 1 1 45 PHE CD1 C 2.358 -4.725 0.887 1.00 . A A . 45 PHE CD1 1 1 13 9646 1 1 45 PHE CD2 C 0.320 -5.853 1.586 1.00 . A A . 45 PHE CD2 1 1 13 9647 1 1 45 PHE CE1 C 2.913 -5.961 0.512 1.00 . A A . 45 PHE CE1 1 1 13 9648 1 1 45 PHE CE2 C 0.855 -7.082 1.166 1.00 . A A . 45 PHE CE2 1 1 13 9649 1 1 45 PHE CG C 1.076 -4.671 1.461 1.00 . A A . 45 PHE CG 1 1 13 9650 1 1 45 PHE CZ C 2.156 -7.139 0.638 1.00 . A A . 45 PHE CZ 1 1 13 9651 1 1 45 PHE H H 2.105 -1.386 1.273 1.00 . A A . 45 PHE H 1 1 13 9652 1 1 45 PHE HA H -0.183 -2.814 0.034 1.00 . A A . 45 PHE HA 1 1 13 9653 1 1 45 PHE HB2 H 1.200 -2.938 2.717 1.00 . A A . 45 PHE HB2 1 1 13 9654 1 1 45 PHE HB3 H -0.404 -3.573 2.501 1.00 . A A . 45 PHE HB3 1 1 13 9655 1 1 45 PHE HD1 H 2.947 -3.825 0.804 1.00 . A A . 45 PHE HD1 1 1 13 9656 1 1 45 PHE HD2 H -0.677 -5.824 2.002 1.00 . A A . 45 PHE HD2 1 1 13 9657 1 1 45 PHE HE1 H 3.927 -6.009 0.144 1.00 . A A . 45 PHE HE1 1 1 13 9658 1 1 45 PHE HE2 H 0.268 -7.986 1.259 1.00 . A A . 45 PHE HE2 1 1 13 9659 1 1 45 PHE HZ H 2.573 -8.088 0.335 1.00 . A A . 45 PHE HZ 1 1 13 9660 1 1 45 PHE N N 1.456 -1.608 0.525 1.00 . A A . 45 PHE N 1 1 13 9661 1 1 45 PHE O O -0.363 -0.306 2.068 1.00 . A A . 45 PHE O 1 1 13 9662 1 1 46 CYS C C -3.937 -1.479 2.513 1.00 . A A . 46 CYS C 1 1 13 9663 1 1 46 CYS CA C -3.132 -0.651 1.529 1.00 . A A . 46 CYS CA 1 1 13 9664 1 1 46 CYS CB C -4.002 -0.242 0.342 1.00 . A A . 46 CYS CB 1 1 13 9665 1 1 46 CYS H H -2.268 -2.335 0.619 1.00 . A A . 46 CYS H 1 1 13 9666 1 1 46 CYS HA H -2.802 0.239 2.072 1.00 . A A . 46 CYS HA 1 1 13 9667 1 1 46 CYS HB2 H -4.366 -1.146 -0.136 1.00 . A A . 46 CYS HB2 1 1 13 9668 1 1 46 CYS HB3 H -4.852 0.294 0.745 1.00 . A A . 46 CYS HB3 1 1 13 9669 1 1 46 CYS N N -2.024 -1.465 1.078 1.00 . A A . 46 CYS N 1 1 13 9670 1 1 46 CYS O O -3.920 -2.709 2.475 1.00 . A A . 46 CYS O 1 1 13 9671 1 1 46 CYS SG S -3.271 0.813 -0.941 1.00 . A A . 46 CYS SG 1 1 13 9672 1 1 47 TYR C C -6.646 -0.795 4.635 1.00 . A A . 47 TYR C 1 1 13 9673 1 1 47 TYR CA C -5.239 -1.348 4.597 1.00 . A A . 47 TYR CA 1 1 13 9674 1 1 47 TYR CB C -4.460 -0.853 5.815 1.00 . A A . 47 TYR CB 1 1 13 9675 1 1 47 TYR CD1 C -2.020 -1.151 5.243 1.00 . A A . 47 TYR CD1 1 1 13 9676 1 1 47 TYR CD2 C -2.997 -2.511 7.014 1.00 . A A . 47 TYR CD2 1 1 13 9677 1 1 47 TYR CE1 C -0.779 -1.764 5.456 1.00 . A A . 47 TYR CE1 1 1 13 9678 1 1 47 TYR CE2 C -1.740 -3.074 7.271 1.00 . A A . 47 TYR CE2 1 1 13 9679 1 1 47 TYR CG C -3.129 -1.524 6.025 1.00 . A A . 47 TYR CG 1 1 13 9680 1 1 47 TYR CZ C -0.634 -2.690 6.500 1.00 . A A . 47 TYR CZ 1 1 13 9681 1 1 47 TYR H H -4.556 0.231 3.372 1.00 . A A . 47 TYR H 1 1 13 9682 1 1 47 TYR HA H -5.260 -2.436 4.589 1.00 . A A . 47 TYR HA 1 1 13 9683 1 1 47 TYR HB2 H -4.277 0.202 5.648 1.00 . A A . 47 TYR HB2 1 1 13 9684 1 1 47 TYR HB3 H -5.046 -0.953 6.729 1.00 . A A . 47 TYR HB3 1 1 13 9685 1 1 47 TYR HD1 H -2.118 -0.397 4.478 1.00 . A A . 47 TYR HD1 1 1 13 9686 1 1 47 TYR HD2 H -3.853 -2.826 7.591 1.00 . A A . 47 TYR HD2 1 1 13 9687 1 1 47 TYR HE1 H 0.046 -1.536 4.798 1.00 . A A . 47 TYR HE1 1 1 13 9688 1 1 47 TYR HE2 H -1.633 -3.803 8.063 1.00 . A A . 47 TYR HE2 1 1 13 9689 1 1 47 TYR HH H 0.473 -4.116 7.140 1.00 . A A . 47 TYR HH 1 1 13 9690 1 1 47 TYR N N -4.602 -0.784 3.426 1.00 . A A . 47 TYR N 1 1 13 9691 1 1 47 TYR O O -6.811 0.371 4.986 1.00 . A A . 47 TYR O 1 1 13 9692 1 1 47 TYR OH O 0.579 -3.231 6.766 1.00 . A A . 47 TYR OH 1 1 13 9693 1 1 48 PHE C C -9.634 -1.656 5.612 1.00 . A A . 48 PHE C 1 1 13 9694 1 1 48 PHE CA C -9.024 -1.181 4.292 1.00 . A A . 48 PHE CA 1 1 13 9695 1 1 48 PHE CB C -9.684 -1.861 3.088 1.00 . A A . 48 PHE CB 1 1 13 9696 1 1 48 PHE CD1 C -8.022 -1.478 1.212 1.00 . A A . 48 PHE CD1 1 1 13 9697 1 1 48 PHE CD2 C -10.256 -0.533 1.005 1.00 . A A . 48 PHE CD2 1 1 13 9698 1 1 48 PHE CE1 C -7.666 -0.898 -0.015 1.00 . A A . 48 PHE CE1 1 1 13 9699 1 1 48 PHE CE2 C -9.909 0.001 -0.248 1.00 . A A . 48 PHE CE2 1 1 13 9700 1 1 48 PHE CG C -9.313 -1.278 1.739 1.00 . A A . 48 PHE CG 1 1 13 9701 1 1 48 PHE CZ C -8.617 -0.196 -0.764 1.00 . A A . 48 PHE CZ 1 1 13 9702 1 1 48 PHE H H -7.476 -2.555 3.998 1.00 . A A . 48 PHE H 1 1 13 9703 1 1 48 PHE HA H -9.145 -0.103 4.203 1.00 . A A . 48 PHE HA 1 1 13 9704 1 1 48 PHE HB2 H -9.411 -2.911 3.069 1.00 . A A . 48 PHE HB2 1 1 13 9705 1 1 48 PHE HB3 H -10.754 -1.829 3.218 1.00 . A A . 48 PHE HB3 1 1 13 9706 1 1 48 PHE HD1 H -7.289 -2.063 1.747 1.00 . A A . 48 PHE HD1 1 1 13 9707 1 1 48 PHE HD2 H -11.240 -0.339 1.407 1.00 . A A . 48 PHE HD2 1 1 13 9708 1 1 48 PHE HE1 H -6.655 -0.980 -0.377 1.00 . A A . 48 PHE HE1 1 1 13 9709 1 1 48 PHE HE2 H -10.627 0.598 -0.793 1.00 . A A . 48 PHE HE2 1 1 13 9710 1 1 48 PHE HZ H -8.340 0.243 -1.712 1.00 . A A . 48 PHE HZ 1 1 13 9711 1 1 48 PHE N N -7.642 -1.594 4.266 1.00 . A A . 48 PHE N 1 1 13 9712 1 1 48 PHE O O -8.976 -2.354 6.382 1.00 . A A . 48 PHE O 1 1 13 9713 1 1 49 ASN C C -11.168 -1.924 8.268 1.00 . A A . 49 ASN C 1 1 13 9714 1 1 49 ASN CA C -11.756 -2.020 6.846 1.00 . A A . 49 ASN CA 1 1 13 9715 1 1 49 ASN CB C -12.047 -3.480 6.440 1.00 . A A . 49 ASN CB 1 1 13 9716 1 1 49 ASN CG C -12.786 -3.616 5.108 1.00 . A A . 49 ASN CG 1 1 13 9717 1 1 49 ASN H H -11.417 -0.857 5.118 1.00 . A A . 49 ASN H 1 1 13 9718 1 1 49 ASN HA H -12.705 -1.481 6.871 1.00 . A A . 49 ASN HA 1 1 13 9719 1 1 49 ASN HB2 H -11.107 -4.024 6.347 1.00 . A A . 49 ASN HB2 1 1 13 9720 1 1 49 ASN HB3 H -12.651 -3.967 7.204 1.00 . A A . 49 ASN HB3 1 1 13 9721 1 1 49 ASN HD21 H -12.944 -5.640 5.319 1.00 . A A . 49 ASN HD21 1 1 13 9722 1 1 49 ASN HD22 H -13.638 -4.948 3.862 1.00 . A A . 49 ASN HD22 1 1 13 9723 1 1 49 ASN N N -10.928 -1.401 5.813 1.00 . A A . 49 ASN N 1 1 13 9724 1 1 49 ASN ND2 N -13.139 -4.842 4.734 1.00 . A A . 49 ASN ND2 1 1 13 9725 1 1 49 ASN O O -11.564 -2.695 9.148 1.00 . A A . 49 ASN O 1 1 13 9726 1 1 49 ASN OD1 O -13.022 -2.641 4.400 1.00 . A A . 49 ASN OD1 1 1 13 9727 1 1 50 CYS C C -9.984 -0.071 10.787 1.00 . A A . 50 CYS C 1 1 13 9728 1 1 50 CYS CA C -9.406 -0.998 9.724 1.00 . A A . 50 CYS CA 1 1 13 9729 1 1 50 CYS CB C -7.986 -0.582 9.363 1.00 . A A . 50 CYS CB 1 1 13 9730 1 1 50 CYS H H -9.985 -0.334 7.791 1.00 . A A . 50 CYS H 1 1 13 9731 1 1 50 CYS HA H -9.332 -1.997 10.129 1.00 . A A . 50 CYS HA 1 1 13 9732 1 1 50 CYS HB2 H -7.644 -1.122 8.482 1.00 . A A . 50 CYS HB2 1 1 13 9733 1 1 50 CYS HB3 H -8.032 0.467 9.122 1.00 . A A . 50 CYS HB3 1 1 13 9734 1 1 50 CYS N N -10.232 -1.000 8.518 1.00 . A A . 50 CYS N 1 1 13 9735 1 1 50 CYS O O -10.193 1.149 10.508 1.00 . A A . 50 CYS O 1 1 13 9736 1 1 50 CYS OXT O -10.256 -0.519 11.945 1.00 . A A . 50 CYS OXT 1 1 13 9737 1 1 50 CYS SG S -6.723 -0.749 10.646 1.00 . A A . 50 CYS SG 1 1 14 9738 1 1 1 LEU C C -9.829 -4.933 9.490 1.00 . A A . 1 LEU C 1 1 14 9739 1 1 1 LEU CA C -10.752 -5.363 10.635 1.00 . A A . 1 LEU CA 1 1 14 9740 1 1 1 LEU CB C -11.622 -6.564 10.234 1.00 . A A . 1 LEU CB 1 1 14 9741 1 1 1 LEU CD1 C -11.910 -9.026 9.937 1.00 . A A . 1 LEU CD1 1 1 14 9742 1 1 1 LEU CD2 C -9.676 -8.041 9.426 1.00 . A A . 1 LEU CD2 1 1 14 9743 1 1 1 LEU CG C -10.913 -7.928 10.324 1.00 . A A . 1 LEU CG 1 1 14 9744 1 1 1 LEU H1 H -12.160 -3.904 10.266 1.00 . A A . 1 LEU H1 1 1 14 9745 1 1 1 LEU H2 H -12.206 -4.521 11.828 1.00 . A A . 1 LEU H2 1 1 14 9746 1 1 1 LEU H3 H -10.984 -3.456 11.381 1.00 . A A . 1 LEU H3 1 1 14 9747 1 1 1 LEU HA H -10.158 -5.663 11.501 1.00 . A A . 1 LEU HA 1 1 14 9748 1 1 1 LEU HB2 H -12.468 -6.605 10.920 1.00 . A A . 1 LEU HB2 1 1 14 9749 1 1 1 LEU HB3 H -12.007 -6.415 9.225 1.00 . A A . 1 LEU HB3 1 1 14 9750 1 1 1 LEU HD11 H -12.786 -8.980 10.584 1.00 . A A . 1 LEU HD11 1 1 14 9751 1 1 1 LEU HD12 H -12.224 -8.898 8.900 1.00 . A A . 1 LEU HD12 1 1 14 9752 1 1 1 LEU HD13 H -11.446 -10.007 10.050 1.00 . A A . 1 LEU HD13 1 1 14 9753 1 1 1 LEU HD21 H -9.913 -7.712 8.414 1.00 . A A . 1 LEU HD21 1 1 14 9754 1 1 1 LEU HD22 H -8.857 -7.441 9.824 1.00 . A A . 1 LEU HD22 1 1 14 9755 1 1 1 LEU HD23 H -9.340 -9.077 9.391 1.00 . A A . 1 LEU HD23 1 1 14 9756 1 1 1 LEU HG H -10.606 -8.102 11.357 1.00 . A A . 1 LEU HG 1 1 14 9757 1 1 1 LEU N N -11.589 -4.225 11.059 1.00 . A A . 1 LEU N 1 1 14 9758 1 1 1 LEU O O -10.287 -4.705 8.376 1.00 . A A . 1 LEU O 1 1 14 9759 1 1 2 CYS C C -7.233 -5.135 7.738 1.00 . A A . 2 CYS C 1 1 14 9760 1 1 2 CYS CA C -7.544 -4.194 8.899 1.00 . A A . 2 CYS CA 1 1 14 9761 1 1 2 CYS CB C -6.311 -3.729 9.698 1.00 . A A . 2 CYS CB 1 1 14 9762 1 1 2 CYS H H -8.243 -4.967 10.727 1.00 . A A . 2 CYS H 1 1 14 9763 1 1 2 CYS HA H -7.955 -3.292 8.467 1.00 . A A . 2 CYS HA 1 1 14 9764 1 1 2 CYS HB2 H -5.662 -4.585 9.875 1.00 . A A . 2 CYS HB2 1 1 14 9765 1 1 2 CYS HB3 H -5.755 -3.002 9.111 1.00 . A A . 2 CYS HB3 1 1 14 9766 1 1 2 CYS N N -8.542 -4.770 9.789 1.00 . A A . 2 CYS N 1 1 14 9767 1 1 2 CYS O O -6.319 -5.954 7.815 1.00 . A A . 2 CYS O 1 1 14 9768 1 1 2 CYS SG S -6.671 -3.014 11.331 1.00 . A A . 2 CYS SG 1 1 14 9769 1 1 3 ASN C C -6.492 -5.208 4.754 1.00 . A A . 3 ASN C 1 1 14 9770 1 1 3 ASN CA C -7.727 -5.773 5.434 1.00 . A A . 3 ASN CA 1 1 14 9771 1 1 3 ASN CB C -8.925 -5.829 4.471 1.00 . A A . 3 ASN CB 1 1 14 9772 1 1 3 ASN CG C -10.241 -6.164 5.161 1.00 . A A . 3 ASN CG 1 1 14 9773 1 1 3 ASN H H -8.698 -4.273 6.641 1.00 . A A . 3 ASN H 1 1 14 9774 1 1 3 ASN HA H -7.528 -6.808 5.723 1.00 . A A . 3 ASN HA 1 1 14 9775 1 1 3 ASN HB2 H -9.039 -4.857 3.996 1.00 . A A . 3 ASN HB2 1 1 14 9776 1 1 3 ASN HB3 H -8.744 -6.547 3.670 1.00 . A A . 3 ASN HB3 1 1 14 9777 1 1 3 ASN HD21 H -9.586 -8.008 5.732 1.00 . A A . 3 ASN HD21 1 1 14 9778 1 1 3 ASN HD22 H -11.226 -7.588 6.186 1.00 . A A . 3 ASN HD22 1 1 14 9779 1 1 3 ASN N N -7.984 -5.001 6.641 1.00 . A A . 3 ASN N 1 1 14 9780 1 1 3 ASN ND2 N -10.353 -7.356 5.738 1.00 . A A . 3 ASN ND2 1 1 14 9781 1 1 3 ASN O O -6.590 -4.283 3.946 1.00 . A A . 3 ASN O 1 1 14 9782 1 1 3 ASN OD1 O -11.167 -5.362 5.147 1.00 . A A . 3 ASN OD1 1 1 14 9783 1 1 4 GLU C C -4.118 -6.156 3.094 1.00 . A A . 4 GLU C 1 1 14 9784 1 1 4 GLU CA C -4.072 -5.505 4.475 1.00 . A A . 4 GLU CA 1 1 14 9785 1 1 4 GLU CB C -2.971 -6.083 5.375 1.00 . A A . 4 GLU CB 1 1 14 9786 1 1 4 GLU CD C -0.466 -6.426 5.594 1.00 . A A . 4 GLU CD 1 1 14 9787 1 1 4 GLU CG C -1.611 -5.982 4.691 1.00 . A A . 4 GLU CG 1 1 14 9788 1 1 4 GLU H H -5.337 -6.515 5.793 1.00 . A A . 4 GLU H 1 1 14 9789 1 1 4 GLU HA H -3.928 -4.429 4.398 1.00 . A A . 4 GLU HA 1 1 14 9790 1 1 4 GLU HB2 H -2.953 -5.537 6.318 1.00 . A A . 4 GLU HB2 1 1 14 9791 1 1 4 GLU HB3 H -3.180 -7.134 5.581 1.00 . A A . 4 GLU HB3 1 1 14 9792 1 1 4 GLU HG2 H -1.659 -6.652 3.838 1.00 . A A . 4 GLU HG2 1 1 14 9793 1 1 4 GLU HG3 H -1.439 -4.959 4.356 1.00 . A A . 4 GLU HG3 1 1 14 9794 1 1 4 GLU N N -5.340 -5.789 5.091 1.00 . A A . 4 GLU N 1 1 14 9795 1 1 4 GLU O O -4.382 -7.350 2.973 1.00 . A A . 4 GLU O 1 1 14 9796 1 1 4 GLU OE1 O -0.556 -7.680 6.107 1.00 . A A . 4 GLU OE1 1 1 14 9797 1 1 4 GLU OE2 O 0.465 -5.649 5.810 1.00 . A A . 4 GLU OE2 1 1 14 9798 1 1 5 ARG C C -2.951 -5.065 -0.111 1.00 . A A . 5 ARG C 1 1 14 9799 1 1 5 ARG CA C -4.126 -5.672 0.661 1.00 . A A . 5 ARG CA 1 1 14 9800 1 1 5 ARG CB C -5.461 -5.046 0.238 1.00 . A A . 5 ARG CB 1 1 14 9801 1 1 5 ARG CD C -7.086 -4.549 -1.652 1.00 . A A . 5 ARG CD 1 1 14 9802 1 1 5 ARG CG C -5.951 -5.449 -1.158 1.00 . A A . 5 ARG CG 1 1 14 9803 1 1 5 ARG CZ C -9.288 -3.745 -0.821 1.00 . A A . 5 ARG CZ 1 1 14 9804 1 1 5 ARG H H -3.671 -4.380 2.246 1.00 . A A . 5 ARG H 1 1 14 9805 1 1 5 ARG HA H -4.176 -6.754 0.550 1.00 . A A . 5 ARG HA 1 1 14 9806 1 1 5 ARG HB2 H -6.215 -5.356 0.960 1.00 . A A . 5 ARG HB2 1 1 14 9807 1 1 5 ARG HB3 H -5.336 -3.966 0.272 1.00 . A A . 5 ARG HB3 1 1 14 9808 1 1 5 ARG HD2 H -6.703 -3.529 -1.652 1.00 . A A . 5 ARG HD2 1 1 14 9809 1 1 5 ARG HD3 H -7.338 -4.835 -2.677 1.00 . A A . 5 ARG HD3 1 1 14 9810 1 1 5 ARG HG2 H -5.140 -5.316 -1.868 1.00 . A A . 5 ARG HG2 1 1 14 9811 1 1 5 ARG HG3 H -6.273 -6.492 -1.140 1.00 . A A . 5 ARG HG3 1 1 14 9812 1 1 5 ARG HH11 H -8.552 -2.696 -2.412 1.00 . A A . 5 ARG HH11 1 1 14 9813 1 1 5 ARG HH12 H -9.984 -2.026 -1.700 1.00 . A A . 5 ARG HH12 1 1 14 9814 1 1 5 ARG HH21 H -10.268 -4.557 0.780 1.00 . A A . 5 ARG HH21 1 1 14 9815 1 1 5 ARG HH22 H -10.990 -3.121 0.126 1.00 . A A . 5 ARG HH22 1 1 14 9816 1 1 5 ARG N N -3.914 -5.347 2.058 1.00 . A A . 5 ARG N 1 1 14 9817 1 1 5 ARG NE N -8.286 -4.641 -0.811 1.00 . A A . 5 ARG NE 1 1 14 9818 1 1 5 ARG NH1 N -9.310 -2.773 -1.739 1.00 . A A . 5 ARG NH1 1 1 14 9819 1 1 5 ARG NH2 N -10.263 -3.821 0.090 1.00 . A A . 5 ARG NH2 1 1 14 9820 1 1 5 ARG O O -2.490 -3.981 0.253 1.00 . A A . 5 ARG O 1 1 14 9821 1 1 6 PRO C C -1.562 -4.067 -2.719 1.00 . A A . 6 PRO C 1 1 14 9822 1 1 6 PRO CA C -1.264 -5.310 -1.874 1.00 . A A . 6 PRO CA 1 1 14 9823 1 1 6 PRO CB C -0.838 -6.514 -2.722 1.00 . A A . 6 PRO CB 1 1 14 9824 1 1 6 PRO CD C -2.870 -7.061 -1.582 1.00 . A A . 6 PRO CD 1 1 14 9825 1 1 6 PRO CG C -2.135 -7.304 -2.899 1.00 . A A . 6 PRO CG 1 1 14 9826 1 1 6 PRO HA H -0.457 -5.059 -1.184 1.00 . A A . 6 PRO HA 1 1 14 9827 1 1 6 PRO HB2 H -0.396 -6.235 -3.679 1.00 . A A . 6 PRO HB2 1 1 14 9828 1 1 6 PRO HB3 H -0.132 -7.118 -2.150 1.00 . A A . 6 PRO HB3 1 1 14 9829 1 1 6 PRO HD2 H -3.946 -7.111 -1.734 1.00 . A A . 6 PRO HD2 1 1 14 9830 1 1 6 PRO HD3 H -2.579 -7.795 -0.829 1.00 . A A . 6 PRO HD3 1 1 14 9831 1 1 6 PRO HG2 H -2.710 -6.869 -3.718 1.00 . A A . 6 PRO HG2 1 1 14 9832 1 1 6 PRO HG3 H -1.956 -8.364 -3.087 1.00 . A A . 6 PRO HG3 1 1 14 9833 1 1 6 PRO N N -2.430 -5.755 -1.132 1.00 . A A . 6 PRO N 1 1 14 9834 1 1 6 PRO O O -2.702 -3.619 -2.836 1.00 . A A . 6 PRO O 1 1 14 9835 1 1 7 SER C C -1.494 -2.487 -5.315 1.00 . A A . 7 SER C 1 1 14 9836 1 1 7 SER CA C -0.514 -2.337 -4.151 1.00 . A A . 7 SER CA 1 1 14 9837 1 1 7 SER CB C 0.909 -2.141 -4.689 1.00 . A A . 7 SER CB 1 1 14 9838 1 1 7 SER H H 0.403 -3.949 -3.183 1.00 . A A . 7 SER H 1 1 14 9839 1 1 7 SER HA H -0.782 -1.458 -3.563 1.00 . A A . 7 SER HA 1 1 14 9840 1 1 7 SER HB2 H 0.847 -1.457 -5.529 1.00 . A A . 7 SER HB2 1 1 14 9841 1 1 7 SER HB3 H 1.544 -1.708 -3.918 1.00 . A A . 7 SER HB3 1 1 14 9842 1 1 7 SER HG H 0.779 -3.766 -5.703 1.00 . A A . 7 SER HG 1 1 14 9843 1 1 7 SER N N -0.499 -3.518 -3.310 1.00 . A A . 7 SER N 1 1 14 9844 1 1 7 SER O O -1.219 -3.270 -6.223 1.00 . A A . 7 SER O 1 1 14 9845 1 1 7 SER OG O 1.450 -3.381 -5.116 1.00 . A A . 7 SER OG 1 1 14 9846 1 1 8 GLN C C -3.045 -0.422 -7.321 1.00 . A A . 8 GLN C 1 1 14 9847 1 1 8 GLN CA C -3.496 -1.583 -6.429 1.00 . A A . 8 GLN CA 1 1 14 9848 1 1 8 GLN CB C -4.923 -1.354 -5.921 1.00 . A A . 8 GLN CB 1 1 14 9849 1 1 8 GLN CD C -6.958 -2.323 -4.788 1.00 . A A . 8 GLN CD 1 1 14 9850 1 1 8 GLN CG C -5.487 -2.543 -5.133 1.00 . A A . 8 GLN CG 1 1 14 9851 1 1 8 GLN H H -2.762 -1.128 -4.508 1.00 . A A . 8 GLN H 1 1 14 9852 1 1 8 GLN HA H -3.491 -2.496 -7.027 1.00 . A A . 8 GLN HA 1 1 14 9853 1 1 8 GLN HB2 H -4.962 -0.470 -5.296 1.00 . A A . 8 GLN HB2 1 1 14 9854 1 1 8 GLN HB3 H -5.541 -1.174 -6.793 1.00 . A A . 8 GLN HB3 1 1 14 9855 1 1 8 GLN HE21 H -7.501 -2.403 -6.744 1.00 . A A . 8 GLN HE21 1 1 14 9856 1 1 8 GLN HE22 H -8.802 -2.128 -5.606 1.00 . A A . 8 GLN HE22 1 1 14 9857 1 1 8 GLN HG2 H -5.396 -3.453 -5.729 1.00 . A A . 8 GLN HG2 1 1 14 9858 1 1 8 GLN HG3 H -4.919 -2.675 -4.213 1.00 . A A . 8 GLN HG3 1 1 14 9859 1 1 8 GLN N N -2.585 -1.712 -5.306 1.00 . A A . 8 GLN N 1 1 14 9860 1 1 8 GLN NE2 N -7.824 -2.284 -5.796 1.00 . A A . 8 GLN NE2 1 1 14 9861 1 1 8 GLN O O -2.774 -0.622 -8.500 1.00 . A A . 8 GLN O 1 1 14 9862 1 1 8 GLN OE1 O -7.326 -2.186 -3.623 1.00 . A A . 8 GLN OE1 1 1 14 9863 1 1 9 THR C C -1.021 1.890 -7.771 1.00 . A A . 9 THR C 1 1 14 9864 1 1 9 THR CA C -2.525 1.957 -7.535 1.00 . A A . 9 THR CA 1 1 14 9865 1 1 9 THR CB C -2.843 3.249 -6.764 1.00 . A A . 9 THR CB 1 1 14 9866 1 1 9 THR CG2 C -4.342 3.537 -6.776 1.00 . A A . 9 THR CG2 1 1 14 9867 1 1 9 THR H H -3.229 0.930 -5.797 1.00 . A A . 9 THR H 1 1 14 9868 1 1 9 THR HA H -3.032 1.984 -8.501 1.00 . A A . 9 THR HA 1 1 14 9869 1 1 9 THR HB H -2.338 4.073 -7.272 1.00 . A A . 9 THR HB 1 1 14 9870 1 1 9 THR HG1 H -3.017 2.721 -4.885 1.00 . A A . 9 THR HG1 1 1 14 9871 1 1 9 THR HG21 H -4.905 2.673 -6.435 1.00 . A A . 9 THR HG21 1 1 14 9872 1 1 9 THR HG22 H -4.541 4.382 -6.121 1.00 . A A . 9 THR HG22 1 1 14 9873 1 1 9 THR HG23 H -4.657 3.788 -7.791 1.00 . A A . 9 THR HG23 1 1 14 9874 1 1 9 THR N N -2.961 0.793 -6.764 1.00 . A A . 9 THR N 1 1 14 9875 1 1 9 THR O O -0.527 2.090 -8.878 1.00 . A A . 9 THR O 1 1 14 9876 1 1 9 THR OG1 O -2.369 3.193 -5.426 1.00 . A A . 9 THR OG1 1 1 14 9877 1 1 10 TRP C C 1.764 0.647 -7.506 1.00 . A A . 10 TRP C 1 1 14 9878 1 1 10 TRP CA C 1.140 1.742 -6.636 1.00 . A A . 10 TRP CA 1 1 14 9879 1 1 10 TRP CB C 1.564 1.626 -5.174 1.00 . A A . 10 TRP CB 1 1 14 9880 1 1 10 TRP CD1 C 4.069 1.290 -5.107 1.00 . A A . 10 TRP CD1 1 1 14 9881 1 1 10 TRP CD2 C 3.433 3.288 -4.305 1.00 . A A . 10 TRP CD2 1 1 14 9882 1 1 10 TRP CE2 C 4.853 3.243 -4.232 1.00 . A A . 10 TRP CE2 1 1 14 9883 1 1 10 TRP CE3 C 2.795 4.455 -3.834 1.00 . A A . 10 TRP CE3 1 1 14 9884 1 1 10 TRP CG C 2.966 2.036 -4.883 1.00 . A A . 10 TRP CG 1 1 14 9885 1 1 10 TRP CH2 C 4.940 5.461 -3.274 1.00 . A A . 10 TRP CH2 1 1 14 9886 1 1 10 TRP CZ2 C 5.604 4.312 -3.728 1.00 . A A . 10 TRP CZ2 1 1 14 9887 1 1 10 TRP CZ3 C 3.534 5.543 -3.332 1.00 . A A . 10 TRP CZ3 1 1 14 9888 1 1 10 TRP H H -0.810 1.608 -5.807 1.00 . A A . 10 TRP H 1 1 14 9889 1 1 10 TRP HA H 1.438 2.722 -7.010 1.00 . A A . 10 TRP HA 1 1 14 9890 1 1 10 TRP HB2 H 0.914 2.265 -4.572 1.00 . A A . 10 TRP HB2 1 1 14 9891 1 1 10 TRP HB3 H 1.411 0.601 -4.851 1.00 . A A . 10 TRP HB3 1 1 14 9892 1 1 10 TRP HD1 H 4.070 0.296 -5.530 1.00 . A A . 10 TRP HD1 1 1 14 9893 1 1 10 TRP HE1 H 6.142 1.684 -4.866 1.00 . A A . 10 TRP HE1 1 1 14 9894 1 1 10 TRP HE3 H 1.718 4.496 -3.852 1.00 . A A . 10 TRP HE3 1 1 14 9895 1 1 10 TRP HH2 H 5.535 6.268 -2.887 1.00 . A A . 10 TRP HH2 1 1 14 9896 1 1 10 TRP HZ2 H 6.682 4.254 -3.692 1.00 . A A . 10 TRP HZ2 1 1 14 9897 1 1 10 TRP HZ3 H 3.005 6.427 -2.975 1.00 . A A . 10 TRP HZ3 1 1 14 9898 1 1 10 TRP N N -0.301 1.673 -6.676 1.00 . A A . 10 TRP N 1 1 14 9899 1 1 10 TRP NE1 N 5.189 2.006 -4.745 1.00 . A A . 10 TRP NE1 1 1 14 9900 1 1 10 TRP O O 1.209 -0.440 -7.648 1.00 . A A . 10 TRP O 1 1 14 9901 1 1 11 SER C C 4.418 -1.008 -8.462 1.00 . A A . 11 SER C 1 1 14 9902 1 1 11 SER CA C 3.567 0.115 -9.091 1.00 . A A . 11 SER CA 1 1 14 9903 1 1 11 SER CB C 4.356 1.065 -10.008 1.00 . A A . 11 SER CB 1 1 14 9904 1 1 11 SER H H 3.286 1.882 -7.991 1.00 . A A . 11 SER H 1 1 14 9905 1 1 11 SER HA H 2.792 -0.360 -9.698 1.00 . A A . 11 SER HA 1 1 14 9906 1 1 11 SER HB2 H 5.284 1.379 -9.526 1.00 . A A . 11 SER HB2 1 1 14 9907 1 1 11 SER HB3 H 4.583 0.576 -10.958 1.00 . A A . 11 SER HB3 1 1 14 9908 1 1 11 SER HG H 2.723 1.986 -10.573 1.00 . A A . 11 SER HG 1 1 14 9909 1 1 11 SER N N 2.923 0.944 -8.090 1.00 . A A . 11 SER N 1 1 14 9910 1 1 11 SER O O 3.979 -1.708 -7.546 1.00 . A A . 11 SER O 1 1 14 9911 1 1 11 SER OG O 3.594 2.234 -10.245 1.00 . A A . 11 SER OG 1 1 14 9912 1 1 12 GLY C C 7.023 -2.036 -7.102 1.00 . A A . 12 GLY C 1 1 14 9913 1 1 12 GLY CA C 6.548 -2.249 -8.531 1.00 . A A . 12 GLY CA 1 1 14 9914 1 1 12 GLY H H 5.956 -0.630 -9.735 1.00 . A A . 12 GLY H 1 1 14 9915 1 1 12 GLY HA2 H 6.085 -3.221 -8.580 1.00 . A A . 12 GLY HA2 1 1 14 9916 1 1 12 GLY HA3 H 7.403 -2.269 -9.208 1.00 . A A . 12 GLY HA3 1 1 14 9917 1 1 12 GLY N N 5.637 -1.207 -8.974 1.00 . A A . 12 GLY N 1 1 14 9918 1 1 12 GLY O O 6.397 -2.489 -6.143 1.00 . A A . 12 GLY O 1 1 14 9919 1 1 13 ASN C C 8.349 0.037 -5.003 1.00 . A A . 13 ASN C 1 1 14 9920 1 1 13 ASN CA C 8.902 -1.186 -5.756 1.00 . A A . 13 ASN CA 1 1 14 9921 1 1 13 ASN CB C 10.407 -1.097 -6.038 1.00 . A A . 13 ASN CB 1 1 14 9922 1 1 13 ASN CG C 11.195 -1.512 -4.799 1.00 . A A . 13 ASN CG 1 1 14 9923 1 1 13 ASN H H 8.578 -1.098 -7.877 1.00 . A A . 13 ASN H 1 1 14 9924 1 1 13 ASN HA H 8.754 -2.082 -5.156 1.00 . A A . 13 ASN HA 1 1 14 9925 1 1 13 ASN HB2 H 10.667 -1.800 -6.829 1.00 . A A . 13 ASN HB2 1 1 14 9926 1 1 13 ASN HB3 H 10.667 -0.091 -6.368 1.00 . A A . 13 ASN HB3 1 1 14 9927 1 1 13 ASN HD21 H 11.708 0.417 -4.361 1.00 . A A . 13 ASN HD21 1 1 14 9928 1 1 13 ASN HD22 H 12.249 -0.793 -3.228 1.00 . A A . 13 ASN HD22 1 1 14 9929 1 1 13 ASN N N 8.182 -1.399 -7.004 1.00 . A A . 13 ASN N 1 1 14 9930 1 1 13 ASN ND2 N 11.767 -0.550 -4.082 1.00 . A A . 13 ASN ND2 1 1 14 9931 1 1 13 ASN O O 7.526 0.770 -5.548 1.00 . A A . 13 ASN O 1 1 14 9932 1 1 13 ASN OD1 O 11.241 -2.694 -4.461 1.00 . A A . 13 ASN OD1 1 1 14 9933 1 1 14 CYS C C 9.348 1.654 -1.887 1.00 . A A . 14 CYS C 1 1 14 9934 1 1 14 CYS CA C 8.218 1.246 -2.822 1.00 . A A . 14 CYS CA 1 1 14 9935 1 1 14 CYS CB C 7.054 0.620 -2.035 1.00 . A A . 14 CYS CB 1 1 14 9936 1 1 14 CYS H H 9.489 -0.321 -3.355 1.00 . A A . 14 CYS H 1 1 14 9937 1 1 14 CYS HA H 7.865 2.117 -3.373 1.00 . A A . 14 CYS HA 1 1 14 9938 1 1 14 CYS HB2 H 6.380 0.175 -2.764 1.00 . A A . 14 CYS HB2 1 1 14 9939 1 1 14 CYS HB3 H 7.423 -0.166 -1.382 1.00 . A A . 14 CYS HB3 1 1 14 9940 1 1 14 CYS N N 8.772 0.265 -3.754 1.00 . A A . 14 CYS N 1 1 14 9941 1 1 14 CYS O O 10.296 0.894 -1.703 1.00 . A A . 14 CYS O 1 1 14 9942 1 1 14 CYS SG S 5.995 1.693 -1.030 1.00 . A A . 14 CYS SG 1 1 14 9943 1 1 15 GLY C C 9.655 4.569 0.345 1.00 . A A . 15 GLY C 1 1 14 9944 1 1 15 GLY CA C 10.258 3.390 -0.406 1.00 . A A . 15 GLY CA 1 1 14 9945 1 1 15 GLY H H 8.427 3.398 -1.485 1.00 . A A . 15 GLY H 1 1 14 9946 1 1 15 GLY HA2 H 10.557 2.627 0.310 1.00 . A A . 15 GLY HA2 1 1 14 9947 1 1 15 GLY HA3 H 11.128 3.723 -0.971 1.00 . A A . 15 GLY HA3 1 1 14 9948 1 1 15 GLY N N 9.262 2.858 -1.326 1.00 . A A . 15 GLY N 1 1 14 9949 1 1 15 GLY O O 9.658 4.621 1.574 1.00 . A A . 15 GLY O 1 1 14 9950 1 1 16 ASN C C 6.995 6.129 0.722 1.00 . A A . 16 ASN C 1 1 14 9951 1 1 16 ASN CA C 8.322 6.612 0.137 1.00 . A A . 16 ASN CA 1 1 14 9952 1 1 16 ASN CB C 8.144 7.691 -0.938 1.00 . A A . 16 ASN CB 1 1 14 9953 1 1 16 ASN CG C 7.680 9.011 -0.328 1.00 . A A . 16 ASN CG 1 1 14 9954 1 1 16 ASN H H 9.107 5.375 -1.414 1.00 . A A . 16 ASN H 1 1 14 9955 1 1 16 ASN HA H 8.920 7.051 0.940 1.00 . A A . 16 ASN HA 1 1 14 9956 1 1 16 ASN HB2 H 9.112 7.862 -1.411 1.00 . A A . 16 ASN HB2 1 1 14 9957 1 1 16 ASN HB3 H 7.441 7.364 -1.702 1.00 . A A . 16 ASN HB3 1 1 14 9958 1 1 16 ASN HD21 H 8.669 10.116 -1.727 1.00 . A A . 16 ASN HD21 1 1 14 9959 1 1 16 ASN HD22 H 7.782 11.016 -0.516 1.00 . A A . 16 ASN HD22 1 1 14 9960 1 1 16 ASN N N 9.050 5.483 -0.413 1.00 . A A . 16 ASN N 1 1 14 9961 1 1 16 ASN ND2 N 8.058 10.137 -0.925 1.00 . A A . 16 ASN ND2 1 1 14 9962 1 1 16 ASN O O 5.925 6.290 0.133 1.00 . A A . 16 ASN O 1 1 14 9963 1 1 16 ASN OD1 O 6.961 9.024 0.668 1.00 . A A . 16 ASN OD1 1 1 14 9964 1 1 17 THR C C 4.908 6.000 2.973 1.00 . A A . 17 THR C 1 1 14 9965 1 1 17 THR CA C 5.935 4.928 2.578 1.00 . A A . 17 THR CA 1 1 14 9966 1 1 17 THR CB C 6.413 4.044 3.741 1.00 . A A . 17 THR CB 1 1 14 9967 1 1 17 THR CG2 C 6.949 4.845 4.933 1.00 . A A . 17 THR CG2 1 1 14 9968 1 1 17 THR H H 8.013 5.321 2.255 1.00 . A A . 17 THR H 1 1 14 9969 1 1 17 THR HA H 5.463 4.264 1.861 1.00 . A A . 17 THR HA 1 1 14 9970 1 1 17 THR HB H 7.216 3.408 3.370 1.00 . A A . 17 THR HB 1 1 14 9971 1 1 17 THR HG1 H 4.651 3.724 4.496 1.00 . A A . 17 THR HG1 1 1 14 9972 1 1 17 THR HG21 H 7.765 5.495 4.613 1.00 . A A . 17 THR HG21 1 1 14 9973 1 1 17 THR HG22 H 6.161 5.450 5.381 1.00 . A A . 17 THR HG22 1 1 14 9974 1 1 17 THR HG23 H 7.329 4.153 5.686 1.00 . A A . 17 THR HG23 1 1 14 9975 1 1 17 THR N N 7.079 5.510 1.899 1.00 . A A . 17 THR N 1 1 14 9976 1 1 17 THR O O 3.713 5.715 3.073 1.00 . A A . 17 THR O 1 1 14 9977 1 1 17 THR OG1 O 5.376 3.183 4.164 1.00 . A A . 17 THR OG1 1 1 14 9978 1 1 18 ALA C C 3.559 8.466 2.050 1.00 . A A . 18 ALA C 1 1 14 9979 1 1 18 ALA CA C 4.427 8.363 3.306 1.00 . A A . 18 ALA CA 1 1 14 9980 1 1 18 ALA CB C 5.190 9.660 3.590 1.00 . A A . 18 ALA CB 1 1 14 9981 1 1 18 ALA H H 6.335 7.448 3.057 1.00 . A A . 18 ALA H 1 1 14 9982 1 1 18 ALA HA H 3.778 8.166 4.160 1.00 . A A . 18 ALA HA 1 1 14 9983 1 1 18 ALA HB1 H 5.777 9.547 4.503 1.00 . A A . 18 ALA HB1 1 1 14 9984 1 1 18 ALA HB2 H 5.856 9.910 2.767 1.00 . A A . 18 ALA HB2 1 1 14 9985 1 1 18 ALA HB3 H 4.479 10.475 3.728 1.00 . A A . 18 ALA HB3 1 1 14 9986 1 1 18 ALA N N 5.349 7.249 3.152 1.00 . A A . 18 ALA N 1 1 14 9987 1 1 18 ALA O O 2.335 8.433 2.139 1.00 . A A . 18 ALA O 1 1 14 9988 1 1 19 HIS C C 2.570 7.322 -0.531 1.00 . A A . 19 HIS C 1 1 14 9989 1 1 19 HIS CA C 3.449 8.567 -0.398 1.00 . A A . 19 HIS CA 1 1 14 9990 1 1 19 HIS CB C 4.408 8.714 -1.585 1.00 . A A . 19 HIS CB 1 1 14 9991 1 1 19 HIS CD2 C 2.474 9.171 -3.281 1.00 . A A . 19 HIS CD2 1 1 14 9992 1 1 19 HIS CE1 C 3.558 8.650 -5.110 1.00 . A A . 19 HIS CE1 1 1 14 9993 1 1 19 HIS CG C 3.766 8.849 -2.945 1.00 . A A . 19 HIS CG 1 1 14 9994 1 1 19 HIS H H 5.191 8.518 0.850 1.00 . A A . 19 HIS H 1 1 14 9995 1 1 19 HIS HA H 2.806 9.446 -0.390 1.00 . A A . 19 HIS HA 1 1 14 9996 1 1 19 HIS HB2 H 4.994 9.604 -1.456 1.00 . A A . 19 HIS HB2 1 1 14 9997 1 1 19 HIS HB3 H 5.083 7.870 -1.578 1.00 . A A . 19 HIS HB3 1 1 14 9998 1 1 19 HIS HD1 H 5.444 8.383 -4.216 1.00 . A A . 19 HIS HD1 1 1 14 9999 1 1 19 HIS HD2 H 1.683 9.398 -2.576 1.00 . A A . 19 HIS HD2 1 1 14 10000 1 1 19 HIS HE1 H 3.770 8.429 -6.148 1.00 . A A . 19 HIS HE1 1 1 14 10001 1 1 19 HIS N N 4.177 8.546 0.866 1.00 . A A . 19 HIS N 1 1 14 10002 1 1 19 HIS ND1 N 4.464 8.614 -4.122 1.00 . A A . 19 HIS ND1 1 1 14 10003 1 1 19 HIS NE2 N 2.341 8.968 -4.642 1.00 . A A . 19 HIS NE2 1 1 14 10004 1 1 19 HIS O O 1.431 7.443 -0.969 1.00 . A A . 19 HIS O 1 1 14 10005 1 1 20 CYS C C 0.961 5.152 0.593 1.00 . A A . 20 CYS C 1 1 14 10006 1 1 20 CYS CA C 2.264 4.922 -0.167 1.00 . A A . 20 CYS CA 1 1 14 10007 1 1 20 CYS CB C 3.009 3.755 0.477 1.00 . A A . 20 CYS CB 1 1 14 10008 1 1 20 CYS H H 4.052 6.093 0.115 1.00 . A A . 20 CYS H 1 1 14 10009 1 1 20 CYS HA H 2.011 4.657 -1.190 1.00 . A A . 20 CYS HA 1 1 14 10010 1 1 20 CYS HB2 H 3.848 3.447 -0.145 1.00 . A A . 20 CYS HB2 1 1 14 10011 1 1 20 CYS HB3 H 3.383 4.056 1.443 1.00 . A A . 20 CYS HB3 1 1 14 10012 1 1 20 CYS N N 3.078 6.139 -0.171 1.00 . A A . 20 CYS N 1 1 14 10013 1 1 20 CYS O O -0.132 4.920 0.073 1.00 . A A . 20 CYS O 1 1 14 10014 1 1 20 CYS SG S 1.943 2.347 0.834 1.00 . A A . 20 CYS SG 1 1 14 10015 1 1 21 ASP C C -0.954 6.984 1.968 1.00 . A A . 21 ASP C 1 1 14 10016 1 1 21 ASP CA C -0.070 5.931 2.646 1.00 . A A . 21 ASP CA 1 1 14 10017 1 1 21 ASP CB C 0.396 6.416 4.022 1.00 . A A . 21 ASP CB 1 1 14 10018 1 1 21 ASP CG C -0.804 6.858 4.835 1.00 . A A . 21 ASP CG 1 1 14 10019 1 1 21 ASP H H 2.017 5.851 2.190 1.00 . A A . 21 ASP H 1 1 14 10020 1 1 21 ASP HA H -0.636 4.999 2.779 1.00 . A A . 21 ASP HA 1 1 14 10021 1 1 21 ASP HB2 H 0.913 5.611 4.546 1.00 . A A . 21 ASP HB2 1 1 14 10022 1 1 21 ASP HB3 H 1.076 7.261 3.923 1.00 . A A . 21 ASP HB3 1 1 14 10023 1 1 21 ASP N N 1.087 5.671 1.816 1.00 . A A . 21 ASP N 1 1 14 10024 1 1 21 ASP O O -2.171 6.810 1.931 1.00 . A A . 21 ASP O 1 1 14 10025 1 1 21 ASP OD1 O -1.642 6.014 5.140 1.00 . A A . 21 ASP OD1 1 1 14 10026 1 1 21 ASP OD2 O -0.877 8.182 5.132 1.00 . A A . 21 ASP OD2 1 1 14 10027 1 1 22 LYS C C -1.986 8.324 -0.395 1.00 . A A . 22 LYS C 1 1 14 10028 1 1 22 LYS CA C -1.134 9.030 0.642 1.00 . A A . 22 LYS CA 1 1 14 10029 1 1 22 LYS CB C -0.319 10.115 -0.068 1.00 . A A . 22 LYS CB 1 1 14 10030 1 1 22 LYS CD C 0.962 12.288 0.404 1.00 . A A . 22 LYS CD 1 1 14 10031 1 1 22 LYS CE C -0.013 13.449 0.670 1.00 . A A . 22 LYS CE 1 1 14 10032 1 1 22 LYS CG C 0.469 10.934 0.939 1.00 . A A . 22 LYS CG 1 1 14 10033 1 1 22 LYS H H 0.647 8.143 1.475 1.00 . A A . 22 LYS H 1 1 14 10034 1 1 22 LYS HA H -1.767 9.551 1.354 1.00 . A A . 22 LYS HA 1 1 14 10035 1 1 22 LYS HB2 H 0.357 9.677 -0.794 1.00 . A A . 22 LYS HB2 1 1 14 10036 1 1 22 LYS HB3 H -1.013 10.754 -0.607 1.00 . A A . 22 LYS HB3 1 1 14 10037 1 1 22 LYS HD2 H 1.884 12.525 0.939 1.00 . A A . 22 LYS HD2 1 1 14 10038 1 1 22 LYS HD3 H 1.209 12.212 -0.656 1.00 . A A . 22 LYS HD3 1 1 14 10039 1 1 22 LYS HE2 H -0.230 13.499 1.740 1.00 . A A . 22 LYS HE2 1 1 14 10040 1 1 22 LYS HE3 H 0.478 14.381 0.384 1.00 . A A . 22 LYS HE3 1 1 14 10041 1 1 22 LYS HG2 H -0.088 11.048 1.867 1.00 . A A . 22 LYS HG2 1 1 14 10042 1 1 22 LYS HG3 H 1.319 10.300 1.133 1.00 . A A . 22 LYS HG3 1 1 14 10043 1 1 22 LYS HZ1 H -1.307 12.453 -0.594 1.00 . A A . 22 LYS HZ1 1 1 14 10044 1 1 22 LYS HZ2 H -2.076 13.378 0.581 1.00 . A A . 22 LYS HZ2 1 1 14 10045 1 1 22 LYS N N -0.360 8.050 1.400 1.00 . A A . 22 LYS N 1 1 14 10046 1 1 22 LYS NZ N -1.285 13.343 -0.078 1.00 . A A . 22 LYS NZ 1 1 14 10047 1 1 22 LYS O O -3.196 8.513 -0.395 1.00 . A A . 22 LYS O 1 1 14 10048 1 1 23 GLN C C -3.296 6.039 -1.634 1.00 . A A . 23 GLN C 1 1 14 10049 1 1 23 GLN CA C -2.163 6.828 -2.285 1.00 . A A . 23 GLN CA 1 1 14 10050 1 1 23 GLN CB C -1.364 5.960 -3.259 1.00 . A A . 23 GLN CB 1 1 14 10051 1 1 23 GLN CD C 0.162 6.404 -5.272 1.00 . A A . 23 GLN CD 1 1 14 10052 1 1 23 GLN CG C -0.160 6.718 -3.818 1.00 . A A . 23 GLN CG 1 1 14 10053 1 1 23 GLN H H -0.375 7.386 -1.185 1.00 . A A . 23 GLN H 1 1 14 10054 1 1 23 GLN HA H -2.553 7.611 -2.921 1.00 . A A . 23 GLN HA 1 1 14 10055 1 1 23 GLN HB2 H -1.015 5.048 -2.769 1.00 . A A . 23 GLN HB2 1 1 14 10056 1 1 23 GLN HB3 H -2.054 5.690 -4.059 1.00 . A A . 23 GLN HB3 1 1 14 10057 1 1 23 GLN HE21 H -0.819 4.578 -5.297 1.00 . A A . 23 GLN HE21 1 1 14 10058 1 1 23 GLN HE22 H 0.008 5.092 -6.753 1.00 . A A . 23 GLN HE22 1 1 14 10059 1 1 23 GLN HG2 H -0.362 7.786 -3.794 1.00 . A A . 23 GLN HG2 1 1 14 10060 1 1 23 GLN HG3 H 0.714 6.496 -3.215 1.00 . A A . 23 GLN HG3 1 1 14 10061 1 1 23 GLN N N -1.375 7.531 -1.279 1.00 . A A . 23 GLN N 1 1 14 10062 1 1 23 GLN NE2 N -0.231 5.246 -5.791 1.00 . A A . 23 GLN NE2 1 1 14 10063 1 1 23 GLN O O -4.469 6.219 -1.963 1.00 . A A . 23 GLN O 1 1 14 10064 1 1 23 GLN OE1 O 0.786 7.230 -5.933 1.00 . A A . 23 GLN OE1 1 1 14 10065 1 1 24 CYS C C -5.125 4.995 0.506 1.00 . A A . 24 CYS C 1 1 14 10066 1 1 24 CYS CA C -3.917 4.268 -0.102 1.00 . A A . 24 CYS CA 1 1 14 10067 1 1 24 CYS CB C -3.230 3.393 0.946 1.00 . A A . 24 CYS CB 1 1 14 10068 1 1 24 CYS H H -1.968 5.091 -0.424 1.00 . A A . 24 CYS H 1 1 14 10069 1 1 24 CYS HA H -4.277 3.654 -0.933 1.00 . A A . 24 CYS HA 1 1 14 10070 1 1 24 CYS HB2 H -2.752 4.035 1.685 1.00 . A A . 24 CYS HB2 1 1 14 10071 1 1 24 CYS HB3 H -3.975 2.787 1.451 1.00 . A A . 24 CYS HB3 1 1 14 10072 1 1 24 CYS N N -2.950 5.182 -0.679 1.00 . A A . 24 CYS N 1 1 14 10073 1 1 24 CYS O O -6.252 4.520 0.382 1.00 . A A . 24 CYS O 1 1 14 10074 1 1 24 CYS SG S -2.001 2.231 0.320 1.00 . A A . 24 CYS SG 1 1 14 10075 1 1 25 GLN C C -6.704 7.806 0.729 1.00 . A A . 25 GLN C 1 1 14 10076 1 1 25 GLN CA C -6.015 6.896 1.764 1.00 . A A . 25 GLN CA 1 1 14 10077 1 1 25 GLN CB C -5.490 7.715 2.948 1.00 . A A . 25 GLN CB 1 1 14 10078 1 1 25 GLN CD C -4.424 7.731 5.158 1.00 . A A . 25 GLN CD 1 1 14 10079 1 1 25 GLN CG C -4.809 6.838 3.995 1.00 . A A . 25 GLN CG 1 1 14 10080 1 1 25 GLN H H -3.959 6.470 1.283 1.00 . A A . 25 GLN H 1 1 14 10081 1 1 25 GLN HA H -6.754 6.203 2.168 1.00 . A A . 25 GLN HA 1 1 14 10082 1 1 25 GLN HB2 H -4.778 8.470 2.617 1.00 . A A . 25 GLN HB2 1 1 14 10083 1 1 25 GLN HB3 H -6.314 8.219 3.461 1.00 . A A . 25 GLN HB3 1 1 14 10084 1 1 25 GLN HE21 H -5.731 6.809 6.434 1.00 . A A . 25 GLN HE21 1 1 14 10085 1 1 25 GLN HE22 H -5.030 8.343 6.949 1.00 . A A . 25 GLN HE22 1 1 14 10086 1 1 25 GLN HG2 H -5.507 6.066 4.323 1.00 . A A . 25 GLN HG2 1 1 14 10087 1 1 25 GLN HG3 H -3.916 6.365 3.597 1.00 . A A . 25 GLN HG3 1 1 14 10088 1 1 25 GLN N N -4.916 6.137 1.167 1.00 . A A . 25 GLN N 1 1 14 10089 1 1 25 GLN NE2 N -5.125 7.613 6.271 1.00 . A A . 25 GLN NE2 1 1 14 10090 1 1 25 GLN O O -7.926 7.966 0.721 1.00 . A A . 25 GLN O 1 1 14 10091 1 1 25 GLN OE1 O -3.546 8.581 5.037 1.00 . A A . 25 GLN OE1 1 1 14 10092 1 1 26 ASP C C -6.900 8.958 -2.303 1.00 . A A . 26 ASP C 1 1 14 10093 1 1 26 ASP CA C -6.329 9.535 -1.011 1.00 . A A . 26 ASP CA 1 1 14 10094 1 1 26 ASP CB C -5.169 10.489 -1.345 1.00 . A A . 26 ASP CB 1 1 14 10095 1 1 26 ASP CG C -4.496 11.176 -0.151 1.00 . A A . 26 ASP CG 1 1 14 10096 1 1 26 ASP H H -4.924 8.217 -0.096 1.00 . A A . 26 ASP H 1 1 14 10097 1 1 26 ASP HA H -7.108 10.131 -0.541 1.00 . A A . 26 ASP HA 1 1 14 10098 1 1 26 ASP HB2 H -4.407 9.954 -1.901 1.00 . A A . 26 ASP HB2 1 1 14 10099 1 1 26 ASP HB3 H -5.558 11.248 -2.018 1.00 . A A . 26 ASP HB3 1 1 14 10100 1 1 26 ASP N N -5.905 8.468 -0.109 1.00 . A A . 26 ASP N 1 1 14 10101 1 1 26 ASP O O -8.049 9.234 -2.646 1.00 . A A . 26 ASP O 1 1 14 10102 1 1 26 ASP OD1 O -5.128 11.123 1.054 1.00 . A A . 26 ASP OD1 1 1 14 10103 1 1 26 ASP OD2 O -3.415 11.747 -0.325 1.00 . A A . 26 ASP OD2 1 1 14 10104 1 1 27 TRP C C -7.360 6.465 -4.121 1.00 . A A . 27 TRP C 1 1 14 10105 1 1 27 TRP CA C -6.373 7.612 -4.315 1.00 . A A . 27 TRP CA 1 1 14 10106 1 1 27 TRP CB C -5.093 7.046 -4.943 1.00 . A A . 27 TRP CB 1 1 14 10107 1 1 27 TRP CD1 C -3.766 9.213 -4.986 1.00 . A A . 27 TRP CD1 1 1 14 10108 1 1 27 TRP CD2 C -3.201 7.814 -6.632 1.00 . A A . 27 TRP CD2 1 1 14 10109 1 1 27 TRP CE2 C -2.303 8.919 -6.703 1.00 . A A . 27 TRP CE2 1 1 14 10110 1 1 27 TRP CE3 C -3.073 6.815 -7.616 1.00 . A A . 27 TRP CE3 1 1 14 10111 1 1 27 TRP CG C -4.080 8.001 -5.490 1.00 . A A . 27 TRP CG 1 1 14 10112 1 1 27 TRP CH2 C -1.155 7.948 -8.599 1.00 . A A . 27 TRP CH2 1 1 14 10113 1 1 27 TRP CZ2 C -1.295 8.997 -7.675 1.00 . A A . 27 TRP CZ2 1 1 14 10114 1 1 27 TRP CZ3 C -2.053 6.868 -8.580 1.00 . A A . 27 TRP CZ3 1 1 14 10115 1 1 27 TRP H H -5.191 7.942 -2.577 1.00 . A A . 27 TRP H 1 1 14 10116 1 1 27 TRP HA H -6.803 8.357 -4.986 1.00 . A A . 27 TRP HA 1 1 14 10117 1 1 27 TRP HB2 H -4.560 6.404 -4.254 1.00 . A A . 27 TRP HB2 1 1 14 10118 1 1 27 TRP HB3 H -5.403 6.374 -5.736 1.00 . A A . 27 TRP HB3 1 1 14 10119 1 1 27 TRP HD1 H -4.235 9.669 -4.133 1.00 . A A . 27 TRP HD1 1 1 14 10120 1 1 27 TRP HE1 H -2.273 10.642 -5.470 1.00 . A A . 27 TRP HE1 1 1 14 10121 1 1 27 TRP HE3 H -3.791 6.015 -7.636 1.00 . A A . 27 TRP HE3 1 1 14 10122 1 1 27 TRP HH2 H -0.370 7.961 -9.336 1.00 . A A . 27 TRP HH2 1 1 14 10123 1 1 27 TRP HZ2 H -0.628 9.846 -7.710 1.00 . A A . 27 TRP HZ2 1 1 14 10124 1 1 27 TRP HZ3 H -1.963 6.080 -9.314 1.00 . A A . 27 TRP HZ3 1 1 14 10125 1 1 27 TRP N N -6.074 8.182 -3.007 1.00 . A A . 27 TRP N 1 1 14 10126 1 1 27 TRP NE1 N -2.702 9.751 -5.676 1.00 . A A . 27 TRP NE1 1 1 14 10127 1 1 27 TRP O O -8.461 6.472 -4.667 1.00 . A A . 27 TRP O 1 1 14 10128 1 1 28 GLU C C -8.637 4.994 -1.702 1.00 . A A . 28 GLU C 1 1 14 10129 1 1 28 GLU CA C -7.809 4.413 -2.855 1.00 . A A . 28 GLU CA 1 1 14 10130 1 1 28 GLU CB C -6.929 3.201 -2.504 1.00 . A A . 28 GLU CB 1 1 14 10131 1 1 28 GLU CD C -5.283 1.514 -3.507 1.00 . A A . 28 GLU CD 1 1 14 10132 1 1 28 GLU CG C -6.338 2.584 -3.778 1.00 . A A . 28 GLU CG 1 1 14 10133 1 1 28 GLU H H -6.048 5.616 -2.855 1.00 . A A . 28 GLU H 1 1 14 10134 1 1 28 GLU HA H -8.504 4.121 -3.643 1.00 . A A . 28 GLU HA 1 1 14 10135 1 1 28 GLU HB2 H -6.121 3.538 -1.871 1.00 . A A . 28 GLU HB2 1 1 14 10136 1 1 28 GLU HB3 H -7.479 2.438 -1.963 1.00 . A A . 28 GLU HB3 1 1 14 10137 1 1 28 GLU HG2 H -7.144 2.131 -4.356 1.00 . A A . 28 GLU HG2 1 1 14 10138 1 1 28 GLU HG3 H -5.876 3.370 -4.372 1.00 . A A . 28 GLU HG3 1 1 14 10139 1 1 28 GLU N N -6.940 5.482 -3.321 1.00 . A A . 28 GLU N 1 1 14 10140 1 1 28 GLU O O -8.878 6.196 -1.679 1.00 . A A . 28 GLU O 1 1 14 10141 1 1 28 GLU OE1 O -5.667 0.497 -2.691 1.00 . A A . 28 GLU OE1 1 1 14 10142 1 1 28 GLU OE2 O -4.180 1.589 -4.053 1.00 . A A . 28 GLU OE2 1 1 14 10143 1 1 29 LYS C C -9.692 3.549 1.476 1.00 . A A . 29 LYS C 1 1 14 10144 1 1 29 LYS CA C -9.897 4.599 0.389 1.00 . A A . 29 LYS CA 1 1 14 10145 1 1 29 LYS CB C -11.381 4.682 -0.033 1.00 . A A . 29 LYS CB 1 1 14 10146 1 1 29 LYS CD C -11.798 7.198 0.097 1.00 . A A . 29 LYS CD 1 1 14 10147 1 1 29 LYS CE C -11.436 8.475 -0.678 1.00 . A A . 29 LYS CE 1 1 14 10148 1 1 29 LYS CG C -11.817 5.943 -0.796 1.00 . A A . 29 LYS CG 1 1 14 10149 1 1 29 LYS H H -8.702 3.266 -0.650 1.00 . A A . 29 LYS H 1 1 14 10150 1 1 29 LYS HA H -9.512 5.532 0.768 1.00 . A A . 29 LYS HA 1 1 14 10151 1 1 29 LYS HB2 H -11.619 3.804 -0.638 1.00 . A A . 29 LYS HB2 1 1 14 10152 1 1 29 LYS HB3 H -11.998 4.639 0.863 1.00 . A A . 29 LYS HB3 1 1 14 10153 1 1 29 LYS HD2 H -12.793 7.319 0.533 1.00 . A A . 29 LYS HD2 1 1 14 10154 1 1 29 LYS HD3 H -11.100 7.079 0.926 1.00 . A A . 29 LYS HD3 1 1 14 10155 1 1 29 LYS HE2 H -12.053 8.551 -1.575 1.00 . A A . 29 LYS HE2 1 1 14 10156 1 1 29 LYS HE3 H -11.637 9.340 -0.043 1.00 . A A . 29 LYS HE3 1 1 14 10157 1 1 29 LYS HG2 H -11.228 6.057 -1.701 1.00 . A A . 29 LYS HG2 1 1 14 10158 1 1 29 LYS HG3 H -12.848 5.788 -1.124 1.00 . A A . 29 LYS HG3 1 1 14 10159 1 1 29 LYS HZ1 H -9.724 7.551 -1.367 1.00 . A A . 29 LYS HZ1 1 1 14 10160 1 1 29 LYS HZ2 H -9.853 9.171 -1.804 1.00 . A A . 29 LYS HZ2 1 1 14 10161 1 1 29 LYS N N -9.035 4.205 -0.708 1.00 . A A . 29 LYS N 1 1 14 10162 1 1 29 LYS NZ N -10.006 8.489 -1.046 1.00 . A A . 29 LYS NZ 1 1 14 10163 1 1 29 LYS O O -10.620 2.908 1.965 1.00 . A A . 29 LYS O 1 1 14 10164 1 1 30 ALA C C -7.804 3.348 4.161 1.00 . A A . 30 ALA C 1 1 14 10165 1 1 30 ALA CA C -7.959 2.521 2.888 1.00 . A A . 30 ALA CA 1 1 14 10166 1 1 30 ALA CB C -6.621 1.934 2.458 1.00 . A A . 30 ALA CB 1 1 14 10167 1 1 30 ALA H H -7.718 3.956 1.365 1.00 . A A . 30 ALA H 1 1 14 10168 1 1 30 ALA HA H -8.673 1.714 3.049 1.00 . A A . 30 ALA HA 1 1 14 10169 1 1 30 ALA HB1 H -6.716 1.496 1.463 1.00 . A A . 30 ALA HB1 1 1 14 10170 1 1 30 ALA HB2 H -5.885 2.731 2.443 1.00 . A A . 30 ALA HB2 1 1 14 10171 1 1 30 ALA HB3 H -6.300 1.167 3.152 1.00 . A A . 30 ALA HB3 1 1 14 10172 1 1 30 ALA N N -8.419 3.380 1.822 1.00 . A A . 30 ALA N 1 1 14 10173 1 1 30 ALA O O -7.659 4.568 4.103 1.00 . A A . 30 ALA O 1 1 14 10174 1 1 31 SER C C -6.067 3.906 6.547 1.00 . A A . 31 SER C 1 1 14 10175 1 1 31 SER CA C -7.462 3.272 6.589 1.00 . A A . 31 SER CA 1 1 14 10176 1 1 31 SER CB C -7.571 2.158 7.627 1.00 . A A . 31 SER CB 1 1 14 10177 1 1 31 SER H H -7.853 1.676 5.349 1.00 . A A . 31 SER H 1 1 14 10178 1 1 31 SER HA H -8.197 4.033 6.833 1.00 . A A . 31 SER HA 1 1 14 10179 1 1 31 SER HB2 H -6.747 1.464 7.503 1.00 . A A . 31 SER HB2 1 1 14 10180 1 1 31 SER HB3 H -7.481 2.599 8.609 1.00 . A A . 31 SER HB3 1 1 14 10181 1 1 31 SER HG H -9.511 2.124 7.432 1.00 . A A . 31 SER HG 1 1 14 10182 1 1 31 SER N N -7.789 2.685 5.316 1.00 . A A . 31 SER N 1 1 14 10183 1 1 31 SER O O -5.900 5.044 6.978 1.00 . A A . 31 SER O 1 1 14 10184 1 1 31 SER OG O -8.808 1.468 7.476 1.00 . A A . 31 SER OG 1 1 14 10185 1 1 32 HIS C C -3.031 2.905 4.691 1.00 . A A . 32 HIS C 1 1 14 10186 1 1 32 HIS CA C -3.744 3.740 5.755 1.00 . A A . 32 HIS CA 1 1 14 10187 1 1 32 HIS CB C -2.909 3.825 7.050 1.00 . A A . 32 HIS CB 1 1 14 10188 1 1 32 HIS CD2 C -2.735 1.399 7.815 1.00 . A A . 32 HIS CD2 1 1 14 10189 1 1 32 HIS CE1 C -0.590 1.112 7.759 1.00 . A A . 32 HIS CE1 1 1 14 10190 1 1 32 HIS CG C -2.175 2.568 7.417 1.00 . A A . 32 HIS CG 1 1 14 10191 1 1 32 HIS H H -5.279 2.285 5.597 1.00 . A A . 32 HIS H 1 1 14 10192 1 1 32 HIS HA H -3.874 4.743 5.357 1.00 . A A . 32 HIS HA 1 1 14 10193 1 1 32 HIS HB2 H -2.148 4.574 6.957 1.00 . A A . 32 HIS HB2 1 1 14 10194 1 1 32 HIS HB3 H -3.547 4.130 7.881 1.00 . A A . 32 HIS HB3 1 1 14 10195 1 1 32 HIS HD1 H -0.105 3.005 6.954 1.00 . A A . 32 HIS HD1 1 1 14 10196 1 1 32 HIS HD2 H -3.789 1.264 7.788 1.00 . A A . 32 HIS HD2 1 1 14 10197 1 1 32 HIS HE1 H 0.369 0.623 7.798 1.00 . A A . 32 HIS HE1 1 1 14 10198 1 1 32 HIS N N -5.071 3.188 6.012 1.00 . A A . 32 HIS N 1 1 14 10199 1 1 32 HIS ND1 N -0.802 2.377 7.357 1.00 . A A . 32 HIS ND1 1 1 14 10200 1 1 32 HIS NE2 N -1.734 0.495 8.087 1.00 . A A . 32 HIS NE2 1 1 14 10201 1 1 32 HIS O O -3.582 1.906 4.221 1.00 . A A . 32 HIS O 1 1 14 10202 1 1 33 GLY C C 0.497 2.330 4.308 1.00 . A A . 33 GLY C 1 1 14 10203 1 1 33 GLY CA C -0.846 2.490 3.605 1.00 . A A . 33 GLY CA 1 1 14 10204 1 1 33 GLY H H -1.450 4.162 4.772 1.00 . A A . 33 GLY H 1 1 14 10205 1 1 33 GLY HA2 H -1.267 1.526 3.435 1.00 . A A . 33 GLY HA2 1 1 14 10206 1 1 33 GLY HA3 H -0.675 2.910 2.629 1.00 . A A . 33 GLY HA3 1 1 14 10207 1 1 33 GLY N N -1.787 3.288 4.380 1.00 . A A . 33 GLY N 1 1 14 10208 1 1 33 GLY O O 0.762 3.038 5.285 1.00 . A A . 33 GLY O 1 1 14 10209 1 1 34 ALA C C 3.471 0.291 3.298 1.00 . A A . 34 ALA C 1 1 14 10210 1 1 34 ALA CA C 2.691 1.169 4.298 1.00 . A A . 34 ALA CA 1 1 14 10211 1 1 34 ALA CB C 2.646 0.539 5.696 1.00 . A A . 34 ALA CB 1 1 14 10212 1 1 34 ALA H H 0.996 0.798 3.074 1.00 . A A . 34 ALA H 1 1 14 10213 1 1 34 ALA HA H 3.173 2.140 4.374 1.00 . A A . 34 ALA HA 1 1 14 10214 1 1 34 ALA HB1 H 2.080 -0.391 5.673 1.00 . A A . 34 ALA HB1 1 1 14 10215 1 1 34 ALA HB2 H 3.654 0.337 6.050 1.00 . A A . 34 ALA HB2 1 1 14 10216 1 1 34 ALA HB3 H 2.163 1.220 6.398 1.00 . A A . 34 ALA HB3 1 1 14 10217 1 1 34 ALA N N 1.326 1.390 3.833 1.00 . A A . 34 ALA N 1 1 14 10218 1 1 34 ALA O O 2.918 -0.687 2.791 1.00 . A A . 34 ALA O 1 1 14 10219 1 1 35 CYS C C 6.000 -1.494 2.814 1.00 . A A . 35 CYS C 1 1 14 10220 1 1 35 CYS CA C 5.587 -0.184 2.114 1.00 . A A . 35 CYS CA 1 1 14 10221 1 1 35 CYS CB C 6.888 0.574 1.806 1.00 . A A . 35 CYS CB 1 1 14 10222 1 1 35 CYS H H 5.184 1.419 3.431 1.00 . A A . 35 CYS H 1 1 14 10223 1 1 35 CYS HA H 5.063 -0.362 1.177 1.00 . A A . 35 CYS HA 1 1 14 10224 1 1 35 CYS HB2 H 7.378 0.817 2.750 1.00 . A A . 35 CYS HB2 1 1 14 10225 1 1 35 CYS HB3 H 7.523 -0.127 1.290 1.00 . A A . 35 CYS HB3 1 1 14 10226 1 1 35 CYS N N 4.747 0.601 3.018 1.00 . A A . 35 CYS N 1 1 14 10227 1 1 35 CYS O O 6.264 -1.477 4.018 1.00 . A A . 35 CYS O 1 1 14 10228 1 1 35 CYS SG S 6.947 2.072 0.785 1.00 . A A . 35 CYS SG 1 1 14 10229 1 1 36 HIS C C 7.431 -4.617 1.499 1.00 . A A . 36 HIS C 1 1 14 10230 1 1 36 HIS CA C 6.706 -3.868 2.606 1.00 . A A . 36 HIS CA 1 1 14 10231 1 1 36 HIS CB C 5.676 -4.883 3.079 1.00 . A A . 36 HIS CB 1 1 14 10232 1 1 36 HIS CD2 C 3.251 -4.775 3.795 1.00 . A A . 36 HIS CD2 1 1 14 10233 1 1 36 HIS CE1 C 3.416 -3.296 5.395 1.00 . A A . 36 HIS CE1 1 1 14 10234 1 1 36 HIS CG C 4.542 -4.364 3.885 1.00 . A A . 36 HIS CG 1 1 14 10235 1 1 36 HIS H H 5.794 -2.621 1.129 1.00 . A A . 36 HIS H 1 1 14 10236 1 1 36 HIS HA H 7.376 -3.659 3.438 1.00 . A A . 36 HIS HA 1 1 14 10237 1 1 36 HIS HB2 H 5.236 -5.370 2.205 1.00 . A A . 36 HIS HB2 1 1 14 10238 1 1 36 HIS HB3 H 6.185 -5.655 3.659 1.00 . A A . 36 HIS HB3 1 1 14 10239 1 1 36 HIS HD1 H 5.446 -2.795 5.039 1.00 . A A . 36 HIS HD1 1 1 14 10240 1 1 36 HIS HD2 H 2.939 -5.494 3.049 1.00 . A A . 36 HIS HD2 1 1 14 10241 1 1 36 HIS HE1 H 3.169 -2.620 6.200 1.00 . A A . 36 HIS HE1 1 1 14 10242 1 1 36 HIS N N 6.096 -2.628 2.100 1.00 . A A . 36 HIS N 1 1 14 10243 1 1 36 HIS ND1 N 4.638 -3.388 4.855 1.00 . A A . 36 HIS ND1 1 1 14 10244 1 1 36 HIS NE2 N 2.554 -4.150 4.812 1.00 . A A . 36 HIS NE2 1 1 14 10245 1 1 36 HIS O O 6.914 -4.676 0.388 1.00 . A A . 36 HIS O 1 1 14 10246 1 1 37 LYS C C 8.461 -7.563 0.880 1.00 . A A . 37 LYS C 1 1 14 10247 1 1 37 LYS CA C 9.182 -6.218 0.903 1.00 . A A . 37 LYS CA 1 1 14 10248 1 1 37 LYS CB C 10.655 -6.371 1.280 1.00 . A A . 37 LYS CB 1 1 14 10249 1 1 37 LYS CD C 12.835 -7.596 0.631 1.00 . A A . 37 LYS CD 1 1 14 10250 1 1 37 LYS CE C 14.012 -6.646 0.340 1.00 . A A . 37 LYS CE 1 1 14 10251 1 1 37 LYS CG C 11.478 -7.032 0.169 1.00 . A A . 37 LYS CG 1 1 14 10252 1 1 37 LYS H H 8.835 -5.308 2.790 1.00 . A A . 37 LYS H 1 1 14 10253 1 1 37 LYS HA H 9.179 -5.785 -0.089 1.00 . A A . 37 LYS HA 1 1 14 10254 1 1 37 LYS HB2 H 11.040 -5.387 1.416 1.00 . A A . 37 LYS HB2 1 1 14 10255 1 1 37 LYS HB3 H 10.740 -6.890 2.225 1.00 . A A . 37 LYS HB3 1 1 14 10256 1 1 37 LYS HD2 H 12.799 -7.832 1.696 1.00 . A A . 37 LYS HD2 1 1 14 10257 1 1 37 LYS HD3 H 13.004 -8.536 0.105 1.00 . A A . 37 LYS HD3 1 1 14 10258 1 1 37 LYS HE2 H 13.831 -6.104 -0.590 1.00 . A A . 37 LYS HE2 1 1 14 10259 1 1 37 LYS HE3 H 14.090 -5.933 1.160 1.00 . A A . 37 LYS HE3 1 1 14 10260 1 1 37 LYS HG2 H 10.886 -7.856 -0.200 1.00 . A A . 37 LYS HG2 1 1 14 10261 1 1 37 LYS HG3 H 11.593 -6.333 -0.662 1.00 . A A . 37 LYS HG3 1 1 14 10262 1 1 37 LYS HZ1 H 15.098 -8.378 0.053 1.00 . A A . 37 LYS HZ1 1 1 14 10263 1 1 37 LYS HZ2 H 15.775 -7.018 -0.668 1.00 . A A . 37 LYS HZ2 1 1 14 10264 1 1 37 LYS N N 8.509 -5.331 1.838 1.00 . A A . 37 LYS N 1 1 14 10265 1 1 37 LYS NZ N 15.288 -7.372 0.168 1.00 . A A . 37 LYS NZ 1 1 14 10266 1 1 37 LYS O O 8.301 -8.214 1.910 1.00 . A A . 37 LYS O 1 1 14 10267 1 1 38 ARG C C 8.012 -9.781 -1.876 1.00 . A A . 38 ARG C 1 1 14 10268 1 1 38 ARG CA C 7.374 -9.227 -0.604 1.00 . A A . 38 ARG CA 1 1 14 10269 1 1 38 ARG CB C 5.874 -8.956 -0.798 1.00 . A A . 38 ARG CB 1 1 14 10270 1 1 38 ARG CD C 4.948 -11.341 -0.477 1.00 . A A . 38 ARG CD 1 1 14 10271 1 1 38 ARG CG C 5.075 -10.122 -1.403 1.00 . A A . 38 ARG CG 1 1 14 10272 1 1 38 ARG CZ C 3.944 -13.640 -0.727 1.00 . A A . 38 ARG CZ 1 1 14 10273 1 1 38 ARG H H 8.190 -7.323 -1.091 1.00 . A A . 38 ARG H 1 1 14 10274 1 1 38 ARG HA H 7.518 -9.927 0.218 1.00 . A A . 38 ARG HA 1 1 14 10275 1 1 38 ARG HB2 H 5.446 -8.667 0.163 1.00 . A A . 38 ARG HB2 1 1 14 10276 1 1 38 ARG HB3 H 5.784 -8.112 -1.482 1.00 . A A . 38 ARG HB3 1 1 14 10277 1 1 38 ARG HD2 H 5.919 -11.598 -0.055 1.00 . A A . 38 ARG HD2 1 1 14 10278 1 1 38 ARG HD3 H 4.266 -11.077 0.333 1.00 . A A . 38 ARG HD3 1 1 14 10279 1 1 38 ARG HG2 H 4.067 -9.762 -1.624 1.00 . A A . 38 ARG HG2 1 1 14 10280 1 1 38 ARG HG3 H 5.526 -10.420 -2.351 1.00 . A A . 38 ARG HG3 1 1 14 10281 1 1 38 ARG HH11 H 3.994 -13.021 1.211 1.00 . A A . 38 ARG HH11 1 1 14 10282 1 1 38 ARG HH12 H 3.366 -14.623 0.983 1.00 . A A . 38 ARG HH12 1 1 14 10283 1 1 38 ARG HH21 H 3.886 -14.515 -2.552 1.00 . A A . 38 ARG HH21 1 1 14 10284 1 1 38 ARG HH22 H 3.246 -15.509 -1.260 1.00 . A A . 38 ARG HH22 1 1 14 10285 1 1 38 ARG N N 8.040 -7.966 -0.316 1.00 . A A . 38 ARG N 1 1 14 10286 1 1 38 ARG NE N 4.451 -12.506 -1.231 1.00 . A A . 38 ARG NE 1 1 14 10287 1 1 38 ARG NH1 N 3.749 -13.776 0.590 1.00 . A A . 38 ARG NH1 1 1 14 10288 1 1 38 ARG NH2 N 3.648 -14.636 -1.568 1.00 . A A . 38 ARG NH2 1 1 14 10289 1 1 38 ARG O O 8.034 -9.089 -2.890 1.00 . A A . 38 ARG O 1 1 14 10290 1 1 39 GLU C C 10.283 -10.686 -3.559 1.00 . A A . 39 GLU C 1 1 14 10291 1 1 39 GLU CA C 9.229 -11.632 -2.966 1.00 . A A . 39 GLU CA 1 1 14 10292 1 1 39 GLU CB C 8.179 -12.096 -3.989 1.00 . A A . 39 GLU CB 1 1 14 10293 1 1 39 GLU CD C 6.091 -13.531 -4.261 1.00 . A A . 39 GLU CD 1 1 14 10294 1 1 39 GLU CG C 7.307 -13.217 -3.398 1.00 . A A . 39 GLU CG 1 1 14 10295 1 1 39 GLU H H 8.521 -11.518 -0.959 1.00 . A A . 39 GLU H 1 1 14 10296 1 1 39 GLU HA H 9.764 -12.513 -2.607 1.00 . A A . 39 GLU HA 1 1 14 10297 1 1 39 GLU HB2 H 7.553 -11.254 -4.285 1.00 . A A . 39 GLU HB2 1 1 14 10298 1 1 39 GLU HB3 H 8.682 -12.480 -4.879 1.00 . A A . 39 GLU HB3 1 1 14 10299 1 1 39 GLU HG2 H 7.907 -14.122 -3.301 1.00 . A A . 39 GLU HG2 1 1 14 10300 1 1 39 GLU HG3 H 6.955 -12.933 -2.407 1.00 . A A . 39 GLU HG3 1 1 14 10301 1 1 39 GLU N N 8.560 -11.001 -1.825 1.00 . A A . 39 GLU N 1 1 14 10302 1 1 39 GLU O O 10.443 -10.577 -4.771 1.00 . A A . 39 GLU O 1 1 14 10303 1 1 39 GLU OE1 O 6.324 -13.744 -5.583 1.00 . A A . 39 GLU OE1 1 1 14 10304 1 1 39 GLU OE2 O 4.979 -13.573 -3.730 1.00 . A A . 39 GLU OE2 1 1 14 10305 1 1 40 ASN C C 11.519 -7.768 -3.706 1.00 . A A . 40 ASN C 1 1 14 10306 1 1 40 ASN CA C 12.017 -8.997 -2.946 1.00 . A A . 40 ASN CA 1 1 14 10307 1 1 40 ASN CB C 13.194 -9.659 -3.649 1.00 . A A . 40 ASN CB 1 1 14 10308 1 1 40 ASN CG C 14.485 -8.858 -3.468 1.00 . A A . 40 ASN CG 1 1 14 10309 1 1 40 ASN H H 10.863 -10.228 -1.706 1.00 . A A . 40 ASN H 1 1 14 10310 1 1 40 ASN HA H 12.355 -8.642 -1.979 1.00 . A A . 40 ASN HA 1 1 14 10311 1 1 40 ASN HB2 H 13.332 -10.658 -3.247 1.00 . A A . 40 ASN HB2 1 1 14 10312 1 1 40 ASN HB3 H 12.908 -9.755 -4.690 1.00 . A A . 40 ASN HB3 1 1 14 10313 1 1 40 ASN HD21 H 14.966 -9.031 -5.437 1.00 . A A . 40 ASN HD21 1 1 14 10314 1 1 40 ASN HD22 H 16.105 -8.145 -4.448 1.00 . A A . 40 ASN HD22 1 1 14 10315 1 1 40 ASN N N 10.993 -9.988 -2.669 1.00 . A A . 40 ASN N 1 1 14 10316 1 1 40 ASN ND2 N 15.247 -8.668 -4.540 1.00 . A A . 40 ASN ND2 1 1 14 10317 1 1 40 ASN O O 12.319 -7.048 -4.297 1.00 . A A . 40 ASN O 1 1 14 10318 1 1 40 ASN OD1 O 14.804 -8.423 -2.359 1.00 . A A . 40 ASN OD1 1 1 14 10319 1 1 41 HIS C C 8.954 -5.528 -3.132 1.00 . A A . 41 HIS C 1 1 14 10320 1 1 41 HIS CA C 9.608 -6.318 -4.255 1.00 . A A . 41 HIS CA 1 1 14 10321 1 1 41 HIS CB C 8.585 -6.748 -5.305 1.00 . A A . 41 HIS CB 1 1 14 10322 1 1 41 HIS CD2 C 9.203 -8.839 -6.713 1.00 . A A . 41 HIS CD2 1 1 14 10323 1 1 41 HIS CE1 C 10.565 -7.893 -8.132 1.00 . A A . 41 HIS CE1 1 1 14 10324 1 1 41 HIS CG C 9.244 -7.499 -6.436 1.00 . A A . 41 HIS CG 1 1 14 10325 1 1 41 HIS H H 9.570 -8.144 -3.228 1.00 . A A . 41 HIS H 1 1 14 10326 1 1 41 HIS HA H 10.360 -5.717 -4.755 1.00 . A A . 41 HIS HA 1 1 14 10327 1 1 41 HIS HB2 H 7.853 -7.392 -4.816 1.00 . A A . 41 HIS HB2 1 1 14 10328 1 1 41 HIS HB3 H 8.051 -5.873 -5.672 1.00 . A A . 41 HIS HB3 1 1 14 10329 1 1 41 HIS HD1 H 10.339 -5.922 -7.413 1.00 . A A . 41 HIS HD1 1 1 14 10330 1 1 41 HIS HD2 H 8.697 -9.583 -6.117 1.00 . A A . 41 HIS HD2 1 1 14 10331 1 1 41 HIS HE1 H 11.278 -7.755 -8.932 1.00 . A A . 41 HIS HE1 1 1 14 10332 1 1 41 HIS N N 10.211 -7.502 -3.680 1.00 . A A . 41 HIS N 1 1 14 10333 1 1 41 HIS ND1 N 10.086 -6.900 -7.361 1.00 . A A . 41 HIS ND1 1 1 14 10334 1 1 41 HIS NE2 N 10.056 -9.085 -7.770 1.00 . A A . 41 HIS NE2 1 1 14 10335 1 1 41 HIS O O 8.079 -6.063 -2.449 1.00 . A A . 41 HIS O 1 1 14 10336 1 1 42 TRP C C 7.383 -2.949 -2.433 1.00 . A A . 42 TRP C 1 1 14 10337 1 1 42 TRP CA C 8.735 -3.437 -1.918 1.00 . A A . 42 TRP CA 1 1 14 10338 1 1 42 TRP CB C 9.669 -2.310 -1.487 1.00 . A A . 42 TRP CB 1 1 14 10339 1 1 42 TRP CD1 C 11.910 -3.289 -0.858 1.00 . A A . 42 TRP CD1 1 1 14 10340 1 1 42 TRP CD2 C 10.718 -2.640 0.924 1.00 . A A . 42 TRP CD2 1 1 14 10341 1 1 42 TRP CE2 C 11.945 -3.166 1.416 1.00 . A A . 42 TRP CE2 1 1 14 10342 1 1 42 TRP CE3 C 9.748 -2.283 1.879 1.00 . A A . 42 TRP CE3 1 1 14 10343 1 1 42 TRP CG C 10.735 -2.720 -0.529 1.00 . A A . 42 TRP CG 1 1 14 10344 1 1 42 TRP CH2 C 11.202 -2.966 3.710 1.00 . A A . 42 TRP CH2 1 1 14 10345 1 1 42 TRP CZ2 C 12.182 -3.358 2.783 1.00 . A A . 42 TRP CZ2 1 1 14 10346 1 1 42 TRP CZ3 C 9.999 -2.400 3.258 1.00 . A A . 42 TRP CZ3 1 1 14 10347 1 1 42 TRP H H 10.095 -3.866 -3.499 1.00 . A A . 42 TRP H 1 1 14 10348 1 1 42 TRP HA H 8.574 -4.013 -1.025 1.00 . A A . 42 TRP HA 1 1 14 10349 1 1 42 TRP HB2 H 10.123 -1.843 -2.350 1.00 . A A . 42 TRP HB2 1 1 14 10350 1 1 42 TRP HB3 H 9.091 -1.555 -0.967 1.00 . A A . 42 TRP HB3 1 1 14 10351 1 1 42 TRP HD1 H 12.194 -3.551 -1.863 1.00 . A A . 42 TRP HD1 1 1 14 10352 1 1 42 TRP HE1 H 13.542 -3.985 0.331 1.00 . A A . 42 TRP HE1 1 1 14 10353 1 1 42 TRP HE3 H 8.779 -1.976 1.538 1.00 . A A . 42 TRP HE3 1 1 14 10354 1 1 42 TRP HH2 H 11.342 -3.136 4.767 1.00 . A A . 42 TRP HH2 1 1 14 10355 1 1 42 TRP HZ2 H 13.059 -3.906 3.095 1.00 . A A . 42 TRP HZ2 1 1 14 10356 1 1 42 TRP HZ3 H 9.247 -2.096 3.971 1.00 . A A . 42 TRP HZ3 1 1 14 10357 1 1 42 TRP N N 9.370 -4.279 -2.917 1.00 . A A . 42 TRP N 1 1 14 10358 1 1 42 TRP NE1 N 12.644 -3.536 0.285 1.00 . A A . 42 TRP NE1 1 1 14 10359 1 1 42 TRP O O 7.342 -2.058 -3.266 1.00 . A A . 42 TRP O 1 1 14 10360 1 1 43 LYS C C 4.415 -2.103 -1.380 1.00 . A A . 43 LYS C 1 1 14 10361 1 1 43 LYS CA C 4.947 -3.086 -2.407 1.00 . A A . 43 LYS CA 1 1 14 10362 1 1 43 LYS CB C 3.969 -4.257 -2.542 1.00 . A A . 43 LYS CB 1 1 14 10363 1 1 43 LYS CD C 5.392 -5.381 -4.367 1.00 . A A . 43 LYS CD 1 1 14 10364 1 1 43 LYS CE C 4.500 -5.100 -5.601 1.00 . A A . 43 LYS CE 1 1 14 10365 1 1 43 LYS CG C 4.669 -5.526 -3.013 1.00 . A A . 43 LYS CG 1 1 14 10366 1 1 43 LYS H H 6.327 -4.276 -1.309 1.00 . A A . 43 LYS H 1 1 14 10367 1 1 43 LYS HA H 5.009 -2.608 -3.381 1.00 . A A . 43 LYS HA 1 1 14 10368 1 1 43 LYS HB2 H 3.549 -4.470 -1.565 1.00 . A A . 43 LYS HB2 1 1 14 10369 1 1 43 LYS HB3 H 3.142 -3.992 -3.194 1.00 . A A . 43 LYS HB3 1 1 14 10370 1 1 43 LYS HD2 H 6.190 -4.641 -4.316 1.00 . A A . 43 LYS HD2 1 1 14 10371 1 1 43 LYS HD3 H 5.860 -6.349 -4.538 1.00 . A A . 43 LYS HD3 1 1 14 10372 1 1 43 LYS HE2 H 5.107 -5.308 -6.485 1.00 . A A . 43 LYS HE2 1 1 14 10373 1 1 43 LYS HE3 H 3.644 -5.776 -5.614 1.00 . A A . 43 LYS HE3 1 1 14 10374 1 1 43 LYS HG2 H 5.302 -5.819 -2.163 1.00 . A A . 43 LYS HG2 1 1 14 10375 1 1 43 LYS HG3 H 3.970 -6.338 -3.125 1.00 . A A . 43 LYS HG3 1 1 14 10376 1 1 43 LYS HZ1 H 4.475 -3.257 -6.541 1.00 . A A . 43 LYS HZ1 1 1 14 10377 1 1 43 LYS HZ2 H 3.014 -3.680 -5.825 1.00 . A A . 43 LYS HZ2 1 1 14 10378 1 1 43 LYS N N 6.269 -3.530 -1.994 1.00 . A A . 43 LYS N 1 1 14 10379 1 1 43 LYS NZ N 4.037 -3.696 -5.718 1.00 . A A . 43 LYS NZ 1 1 14 10380 1 1 43 LYS O O 4.541 -2.335 -0.179 1.00 . A A . 43 LYS O 1 1 14 10381 1 1 44 CYS C C 1.642 -1.097 -0.720 1.00 . A A . 44 CYS C 1 1 14 10382 1 1 44 CYS CA C 2.877 -0.260 -1.024 1.00 . A A . 44 CYS CA 1 1 14 10383 1 1 44 CYS CB C 2.476 0.994 -1.780 1.00 . A A . 44 CYS CB 1 1 14 10384 1 1 44 CYS H H 3.734 -0.893 -2.848 1.00 . A A . 44 CYS H 1 1 14 10385 1 1 44 CYS HA H 3.366 0.034 -0.098 1.00 . A A . 44 CYS HA 1 1 14 10386 1 1 44 CYS HB2 H 3.343 1.643 -1.853 1.00 . A A . 44 CYS HB2 1 1 14 10387 1 1 44 CYS HB3 H 2.135 0.705 -2.767 1.00 . A A . 44 CYS HB3 1 1 14 10388 1 1 44 CYS N N 3.770 -1.043 -1.852 1.00 . A A . 44 CYS N 1 1 14 10389 1 1 44 CYS O O 0.813 -1.294 -1.602 1.00 . A A . 44 CYS O 1 1 14 10390 1 1 44 CYS SG S 1.132 1.903 -1.013 1.00 . A A . 44 CYS SG 1 1 14 10391 1 1 45 PHE C C -0.625 -1.216 1.507 1.00 . A A . 45 PHE C 1 1 14 10392 1 1 45 PHE CA C 0.309 -2.274 0.933 1.00 . A A . 45 PHE CA 1 1 14 10393 1 1 45 PHE CB C 0.621 -3.350 1.972 1.00 . A A . 45 PHE CB 1 1 14 10394 1 1 45 PHE CD1 C 2.195 -4.901 0.729 1.00 . A A . 45 PHE CD1 1 1 14 10395 1 1 45 PHE CD2 C 0.046 -5.763 1.475 1.00 . A A . 45 PHE CD2 1 1 14 10396 1 1 45 PHE CE1 C 2.551 -6.185 0.278 1.00 . A A . 45 PHE CE1 1 1 14 10397 1 1 45 PHE CE2 C 0.385 -7.037 0.989 1.00 . A A . 45 PHE CE2 1 1 14 10398 1 1 45 PHE CG C 0.963 -4.700 1.377 1.00 . A A . 45 PHE CG 1 1 14 10399 1 1 45 PHE CZ C 1.643 -7.252 0.401 1.00 . A A . 45 PHE CZ 1 1 14 10400 1 1 45 PHE H H 2.210 -1.370 1.211 1.00 . A A . 45 PHE H 1 1 14 10401 1 1 45 PHE HA H -0.182 -2.755 0.084 1.00 . A A . 45 PHE HA 1 1 14 10402 1 1 45 PHE HB2 H 1.432 -2.987 2.601 1.00 . A A . 45 PHE HB2 1 1 14 10403 1 1 45 PHE HB3 H -0.242 -3.481 2.621 1.00 . A A . 45 PHE HB3 1 1 14 10404 1 1 45 PHE HD1 H 2.891 -4.081 0.639 1.00 . A A . 45 PHE HD1 1 1 14 10405 1 1 45 PHE HD2 H -0.932 -5.601 1.902 1.00 . A A . 45 PHE HD2 1 1 14 10406 1 1 45 PHE HE1 H 3.526 -6.358 -0.153 1.00 . A A . 45 PHE HE1 1 1 14 10407 1 1 45 PHE HE2 H -0.322 -7.851 1.068 1.00 . A A . 45 PHE HE2 1 1 14 10408 1 1 45 PHE HZ H 1.909 -8.236 0.045 1.00 . A A . 45 PHE HZ 1 1 14 10409 1 1 45 PHE N N 1.527 -1.616 0.500 1.00 . A A . 45 PHE N 1 1 14 10410 1 1 45 PHE O O -0.173 -0.259 2.133 1.00 . A A . 45 PHE O 1 1 14 10411 1 1 46 CYS C C -3.824 -1.425 2.746 1.00 . A A . 46 CYS C 1 1 14 10412 1 1 46 CYS CA C -3.005 -0.589 1.788 1.00 . A A . 46 CYS CA 1 1 14 10413 1 1 46 CYS CB C -3.883 -0.166 0.613 1.00 . A A . 46 CYS CB 1 1 14 10414 1 1 46 CYS H H -2.202 -2.278 0.842 1.00 . A A . 46 CYS H 1 1 14 10415 1 1 46 CYS HA H -2.653 0.274 2.358 1.00 . A A . 46 CYS HA 1 1 14 10416 1 1 46 CYS HB2 H -4.291 -1.066 0.160 1.00 . A A . 46 CYS HB2 1 1 14 10417 1 1 46 CYS HB3 H -4.708 0.413 1.011 1.00 . A A . 46 CYS HB3 1 1 14 10418 1 1 46 CYS N N -1.922 -1.420 1.303 1.00 . A A . 46 CYS N 1 1 14 10419 1 1 46 CYS O O -3.839 -2.647 2.656 1.00 . A A . 46 CYS O 1 1 14 10420 1 1 46 CYS SG S -3.118 0.816 -0.700 1.00 . A A . 46 CYS SG 1 1 14 10421 1 1 47 TYR C C -6.509 -0.868 4.940 1.00 . A A . 47 TYR C 1 1 14 10422 1 1 47 TYR CA C -5.092 -1.392 4.836 1.00 . A A . 47 TYR CA 1 1 14 10423 1 1 47 TYR CB C -4.285 -0.943 6.051 1.00 . A A . 47 TYR CB 1 1 14 10424 1 1 47 TYR CD1 C -1.836 -1.109 5.391 1.00 . A A . 47 TYR CD1 1 1 14 10425 1 1 47 TYR CD2 C -2.752 -2.655 7.038 1.00 . A A . 47 TYR CD2 1 1 14 10426 1 1 47 TYR CE1 C -0.571 -1.694 5.551 1.00 . A A . 47 TYR CE1 1 1 14 10427 1 1 47 TYR CE2 C -1.477 -3.201 7.235 1.00 . A A . 47 TYR CE2 1 1 14 10428 1 1 47 TYR CG C -2.922 -1.579 6.151 1.00 . A A . 47 TYR CG 1 1 14 10429 1 1 47 TYR CZ C -0.390 -2.712 6.501 1.00 . A A . 47 TYR CZ 1 1 14 10430 1 1 47 TYR H H -4.383 0.254 3.702 1.00 . A A . 47 TYR H 1 1 14 10431 1 1 47 TYR HA H -5.093 -2.478 4.781 1.00 . A A . 47 TYR HA 1 1 14 10432 1 1 47 TYR HB2 H -4.162 0.134 5.977 1.00 . A A . 47 TYR HB2 1 1 14 10433 1 1 47 TYR HB3 H -4.828 -1.150 6.973 1.00 . A A . 47 TYR HB3 1 1 14 10434 1 1 47 TYR HD1 H -1.963 -0.294 4.697 1.00 . A A . 47 TYR HD1 1 1 14 10435 1 1 47 TYR HD2 H -3.592 -3.053 7.589 1.00 . A A . 47 TYR HD2 1 1 14 10436 1 1 47 TYR HE1 H 0.244 -1.375 4.920 1.00 . A A . 47 TYR HE1 1 1 14 10437 1 1 47 TYR HE2 H -1.345 -4.000 7.951 1.00 . A A . 47 TYR HE2 1 1 14 10438 1 1 47 TYR HH H 0.766 -4.144 7.037 1.00 . A A . 47 TYR HH 1 1 14 10439 1 1 47 TYR N N -4.472 -0.758 3.692 1.00 . A A . 47 TYR N 1 1 14 10440 1 1 47 TYR O O -6.678 0.256 5.401 1.00 . A A . 47 TYR O 1 1 14 10441 1 1 47 TYR OH O 0.842 -3.234 6.720 1.00 . A A . 47 TYR OH 1 1 14 10442 1 1 48 PHE C C -9.597 -1.545 5.814 1.00 . A A . 48 PHE C 1 1 14 10443 1 1 48 PHE CA C -8.869 -1.112 4.538 1.00 . A A . 48 PHE CA 1 1 14 10444 1 1 48 PHE CB C -9.533 -1.703 3.288 1.00 . A A . 48 PHE CB 1 1 14 10445 1 1 48 PHE CD1 C -7.847 -1.572 1.386 1.00 . A A . 48 PHE CD1 1 1 14 10446 1 1 48 PHE CD2 C -9.844 -0.181 1.286 1.00 . A A . 48 PHE CD2 1 1 14 10447 1 1 48 PHE CE1 C -7.439 -1.071 0.139 1.00 . A A . 48 PHE CE1 1 1 14 10448 1 1 48 PHE CE2 C -9.441 0.307 0.030 1.00 . A A . 48 PHE CE2 1 1 14 10449 1 1 48 PHE CG C -9.059 -1.135 1.959 1.00 . A A . 48 PHE CG 1 1 14 10450 1 1 48 PHE CZ C -8.242 -0.144 -0.546 1.00 . A A . 48 PHE CZ 1 1 14 10451 1 1 48 PHE H H -7.387 -2.571 4.177 1.00 . A A . 48 PHE H 1 1 14 10452 1 1 48 PHE HA H -8.899 -0.026 4.472 1.00 . A A . 48 PHE HA 1 1 14 10453 1 1 48 PHE HB2 H -9.384 -2.781 3.276 1.00 . A A . 48 PHE HB2 1 1 14 10454 1 1 48 PHE HB3 H -10.596 -1.556 3.376 1.00 . A A . 48 PHE HB3 1 1 14 10455 1 1 48 PHE HD1 H -7.226 -2.297 1.896 1.00 . A A . 48 PHE HD1 1 1 14 10456 1 1 48 PHE HD2 H -10.752 0.204 1.732 1.00 . A A . 48 PHE HD2 1 1 14 10457 1 1 48 PHE HE1 H -6.520 -1.416 -0.310 1.00 . A A . 48 PHE HE1 1 1 14 10458 1 1 48 PHE HE2 H -10.056 1.034 -0.483 1.00 . A A . 48 PHE HE2 1 1 14 10459 1 1 48 PHE HZ H -7.946 0.204 -1.524 1.00 . A A . 48 PHE HZ 1 1 14 10460 1 1 48 PHE N N -7.523 -1.634 4.539 1.00 . A A . 48 PHE N 1 1 14 10461 1 1 48 PHE O O -9.082 -2.357 6.580 1.00 . A A . 48 PHE O 1 1 14 10462 1 1 49 ASN C C -11.226 -1.558 8.404 1.00 . A A . 49 ASN C 1 1 14 10463 1 1 49 ASN CA C -11.824 -1.400 6.996 1.00 . A A . 49 ASN CA 1 1 14 10464 1 1 49 ASN CB C -12.667 -2.626 6.621 1.00 . A A . 49 ASN CB 1 1 14 10465 1 1 49 ASN CG C -13.258 -2.474 5.225 1.00 . A A . 49 ASN CG 1 1 14 10466 1 1 49 ASN H H -11.172 -0.459 5.234 1.00 . A A . 49 ASN H 1 1 14 10467 1 1 49 ASN HA H -12.513 -0.559 7.020 1.00 . A A . 49 ASN HA 1 1 14 10468 1 1 49 ASN HB2 H -12.048 -3.521 6.677 1.00 . A A . 49 ASN HB2 1 1 14 10469 1 1 49 ASN HB3 H -13.492 -2.731 7.326 1.00 . A A . 49 ASN HB3 1 1 14 10470 1 1 49 ASN HD21 H -12.163 -4.032 4.533 1.00 . A A . 49 ASN HD21 1 1 14 10471 1 1 49 ASN HD22 H -13.158 -3.195 3.347 1.00 . A A . 49 ASN HD22 1 1 14 10472 1 1 49 ASN N N -10.855 -1.109 5.936 1.00 . A A . 49 ASN N 1 1 14 10473 1 1 49 ASN ND2 N -12.799 -3.283 4.279 1.00 . A A . 49 ASN ND2 1 1 14 10474 1 1 49 ASN O O -11.740 -2.349 9.195 1.00 . A A . 49 ASN O 1 1 14 10475 1 1 49 ASN OD1 O -14.083 -1.602 4.983 1.00 . A A . 49 ASN OD1 1 1 14 10476 1 1 50 CYS C C -9.986 -0.897 11.230 1.00 . A A . 50 CYS C 1 1 14 10477 1 1 50 CYS CA C -9.325 -1.213 9.895 1.00 . A A . 50 CYS CA 1 1 14 10478 1 1 50 CYS CB C -7.931 -0.628 9.752 1.00 . A A . 50 CYS CB 1 1 14 10479 1 1 50 CYS H H -9.769 -0.159 8.093 1.00 . A A . 50 CYS H 1 1 14 10480 1 1 50 CYS HA H -9.190 -2.275 9.880 1.00 . A A . 50 CYS HA 1 1 14 10481 1 1 50 CYS HB2 H -7.504 -1.006 8.825 1.00 . A A . 50 CYS HB2 1 1 14 10482 1 1 50 CYS HB3 H -8.045 0.443 9.691 1.00 . A A . 50 CYS HB3 1 1 14 10483 1 1 50 CYS N N -10.150 -0.839 8.748 1.00 . A A . 50 CYS N 1 1 14 10484 1 1 50 CYS O O -10.447 -1.860 11.919 1.00 . A A . 50 CYS O 1 1 14 10485 1 1 50 CYS OXT O -10.076 0.300 11.645 1.00 . A A . 50 CYS OXT 1 1 14 10486 1 1 50 CYS SG S -6.717 -0.948 11.053 1.00 . A A . 50 CYS SG 1 1 15 10487 1 1 1 LEU C C -9.212 -4.849 9.095 1.00 . A A . 1 LEU C 1 1 15 10488 1 1 1 LEU CA C -10.129 -5.374 10.202 1.00 . A A . 1 LEU CA 1 1 15 10489 1 1 1 LEU CB C -9.987 -6.896 10.361 1.00 . A A . 1 LEU CB 1 1 15 10490 1 1 1 LEU CD1 C -10.599 -9.014 11.536 1.00 . A A . 1 LEU CD1 1 1 15 10491 1 1 1 LEU CD2 C -10.302 -6.941 12.895 1.00 . A A . 1 LEU CD2 1 1 15 10492 1 1 1 LEU CG C -10.774 -7.491 11.543 1.00 . A A . 1 LEU CG 1 1 15 10493 1 1 1 LEU H1 H -11.815 -5.390 9.019 1.00 . A A . 1 LEU H1 1 1 15 10494 1 1 1 LEU H2 H -12.134 -5.345 10.670 1.00 . A A . 1 LEU H2 1 1 15 10495 1 1 1 LEU H3 H -11.593 -3.963 9.881 1.00 . A A . 1 LEU H3 1 1 15 10496 1 1 1 LEU HA H -9.829 -4.886 11.130 1.00 . A A . 1 LEU HA 1 1 15 10497 1 1 1 LEU HB2 H -10.346 -7.370 9.448 1.00 . A A . 1 LEU HB2 1 1 15 10498 1 1 1 LEU HB3 H -8.931 -7.141 10.482 1.00 . A A . 1 LEU HB3 1 1 15 10499 1 1 1 LEU HD11 H -10.954 -9.425 10.590 1.00 . A A . 1 LEU HD11 1 1 15 10500 1 1 1 LEU HD12 H -9.549 -9.272 11.666 1.00 . A A . 1 LEU HD12 1 1 15 10501 1 1 1 LEU HD13 H -11.178 -9.458 12.347 1.00 . A A . 1 LEU HD13 1 1 15 10502 1 1 1 LEU HD21 H -9.223 -7.071 12.999 1.00 . A A . 1 LEU HD21 1 1 15 10503 1 1 1 LEU HD22 H -10.551 -5.885 12.992 1.00 . A A . 1 LEU HD22 1 1 15 10504 1 1 1 LEU HD23 H -10.799 -7.480 13.703 1.00 . A A . 1 LEU HD23 1 1 15 10505 1 1 1 LEU HG H -11.837 -7.280 11.428 1.00 . A A . 1 LEU HG 1 1 15 10506 1 1 1 LEU N N -11.522 -4.989 9.922 1.00 . A A . 1 LEU N 1 1 15 10507 1 1 1 LEU O O -9.668 -4.651 7.974 1.00 . A A . 1 LEU O 1 1 15 10508 1 1 2 CYS C C -6.486 -4.697 7.418 1.00 . A A . 2 CYS C 1 1 15 10509 1 1 2 CYS CA C -7.005 -3.838 8.575 1.00 . A A . 2 CYS CA 1 1 15 10510 1 1 2 CYS CB C -5.899 -3.212 9.449 1.00 . A A . 2 CYS CB 1 1 15 10511 1 1 2 CYS H H -7.640 -4.764 10.357 1.00 . A A . 2 CYS H 1 1 15 10512 1 1 2 CYS HA H -7.538 -3.003 8.137 1.00 . A A . 2 CYS HA 1 1 15 10513 1 1 2 CYS HB2 H -5.146 -3.972 9.658 1.00 . A A . 2 CYS HB2 1 1 15 10514 1 1 2 CYS HB3 H -5.431 -2.396 8.907 1.00 . A A . 2 CYS HB3 1 1 15 10515 1 1 2 CYS N N -7.946 -4.572 9.417 1.00 . A A . 2 CYS N 1 1 15 10516 1 1 2 CYS O O -5.298 -5.006 7.330 1.00 . A A . 2 CYS O 1 1 15 10517 1 1 2 CYS SG S -6.421 -2.578 11.070 1.00 . A A . 2 CYS SG 1 1 15 10518 1 1 3 ASN C C -6.324 -5.699 4.322 1.00 . A A . 3 ASN C 1 1 15 10519 1 1 3 ASN CA C -7.126 -6.153 5.539 1.00 . A A . 3 ASN CA 1 1 15 10520 1 1 3 ASN CB C -8.426 -6.851 5.094 1.00 . A A . 3 ASN CB 1 1 15 10521 1 1 3 ASN CG C -9.362 -7.242 6.232 1.00 . A A . 3 ASN CG 1 1 15 10522 1 1 3 ASN H H -8.325 -4.734 6.624 1.00 . A A . 3 ASN H 1 1 15 10523 1 1 3 ASN HA H -6.531 -6.919 6.039 1.00 . A A . 3 ASN HA 1 1 15 10524 1 1 3 ASN HB2 H -8.967 -6.159 4.447 1.00 . A A . 3 ASN HB2 1 1 15 10525 1 1 3 ASN HB3 H -8.175 -7.737 4.508 1.00 . A A . 3 ASN HB3 1 1 15 10526 1 1 3 ASN HD21 H -10.974 -7.309 4.981 1.00 . A A . 3 ASN HD21 1 1 15 10527 1 1 3 ASN HD22 H -11.289 -7.650 6.671 1.00 . A A . 3 ASN HD22 1 1 15 10528 1 1 3 ASN N N -7.377 -5.083 6.504 1.00 . A A . 3 ASN N 1 1 15 10529 1 1 3 ASN ND2 N -10.654 -7.371 5.937 1.00 . A A . 3 ASN ND2 1 1 15 10530 1 1 3 ASN O O -6.796 -5.833 3.195 1.00 . A A . 3 ASN O 1 1 15 10531 1 1 3 ASN OD1 O -8.942 -7.428 7.371 1.00 . A A . 3 ASN OD1 1 1 15 10532 1 1 4 GLU C C -4.098 -6.072 2.453 1.00 . A A . 4 GLU C 1 1 15 10533 1 1 4 GLU CA C -3.920 -5.607 3.907 1.00 . A A . 4 GLU CA 1 1 15 10534 1 1 4 GLU CB C -3.232 -6.652 4.804 1.00 . A A . 4 GLU CB 1 1 15 10535 1 1 4 GLU CD C -0.978 -7.914 4.887 1.00 . A A . 4 GLU CD 1 1 15 10536 1 1 4 GLU CG C -1.763 -6.710 4.373 1.00 . A A . 4 GLU CG 1 1 15 10537 1 1 4 GLU H H -4.927 -4.941 5.493 1.00 . A A . 4 GLU H 1 1 15 10538 1 1 4 GLU HA H -3.279 -4.724 3.890 1.00 . A A . 4 GLU HA 1 1 15 10539 1 1 4 GLU HB2 H -3.282 -6.364 5.855 1.00 . A A . 4 GLU HB2 1 1 15 10540 1 1 4 GLU HB3 H -3.720 -7.620 4.674 1.00 . A A . 4 GLU HB3 1 1 15 10541 1 1 4 GLU HG2 H -1.793 -6.737 3.294 1.00 . A A . 4 GLU HG2 1 1 15 10542 1 1 4 GLU HG3 H -1.246 -5.800 4.670 1.00 . A A . 4 GLU HG3 1 1 15 10543 1 1 4 GLU N N -5.134 -5.123 4.521 1.00 . A A . 4 GLU N 1 1 15 10544 1 1 4 GLU O O -4.377 -7.248 2.228 1.00 . A A . 4 GLU O 1 1 15 10545 1 1 4 GLU OE1 O -1.647 -8.786 5.687 1.00 . A A . 4 GLU OE1 1 1 15 10546 1 1 4 GLU OE2 O 0.210 -8.033 4.574 1.00 . A A . 4 GLU OE2 1 1 15 10547 1 1 5 ARG C C -2.785 -4.755 -0.658 1.00 . A A . 5 ARG C 1 1 15 10548 1 1 5 ARG CA C -3.847 -5.586 0.064 1.00 . A A . 5 ARG CA 1 1 15 10549 1 1 5 ARG CB C -5.250 -5.447 -0.547 1.00 . A A . 5 ARG CB 1 1 15 10550 1 1 5 ARG CD C -7.147 -3.897 -1.151 1.00 . A A . 5 ARG CD 1 1 15 10551 1 1 5 ARG CG C -5.898 -4.082 -0.279 1.00 . A A . 5 ARG CG 1 1 15 10552 1 1 5 ARG CZ C -9.525 -4.453 -0.523 1.00 . A A . 5 ARG CZ 1 1 15 10553 1 1 5 ARG H H -3.607 -4.255 1.706 1.00 . A A . 5 ARG H 1 1 15 10554 1 1 5 ARG HA H -3.557 -6.634 -0.007 1.00 . A A . 5 ARG HA 1 1 15 10555 1 1 5 ARG HB2 H -5.178 -5.608 -1.622 1.00 . A A . 5 ARG HB2 1 1 15 10556 1 1 5 ARG HB3 H -5.885 -6.225 -0.122 1.00 . A A . 5 ARG HB3 1 1 15 10557 1 1 5 ARG HD2 H -7.428 -2.851 -1.114 1.00 . A A . 5 ARG HD2 1 1 15 10558 1 1 5 ARG HD3 H -6.893 -4.116 -2.191 1.00 . A A . 5 ARG HD3 1 1 15 10559 1 1 5 ARG HG2 H -6.163 -3.998 0.778 1.00 . A A . 5 ARG HG2 1 1 15 10560 1 1 5 ARG HG3 H -5.186 -3.294 -0.523 1.00 . A A . 5 ARG HG3 1 1 15 10561 1 1 5 ARG HH11 H -9.240 -2.421 -0.532 1.00 . A A . 5 ARG HH11 1 1 15 10562 1 1 5 ARG HH12 H -10.882 -2.911 -0.391 1.00 . A A . 5 ARG HH12 1 1 15 10563 1 1 5 ARG HH21 H -10.156 -6.390 -0.341 1.00 . A A . 5 ARG HH21 1 1 15 10564 1 1 5 ARG HH22 H -11.406 -5.202 -0.181 1.00 . A A . 5 ARG HH22 1 1 15 10565 1 1 5 ARG N N -3.864 -5.207 1.471 1.00 . A A . 5 ARG N 1 1 15 10566 1 1 5 ARG NE N -8.240 -4.793 -0.732 1.00 . A A . 5 ARG NE 1 1 15 10567 1 1 5 ARG NH1 N -9.916 -3.174 -0.510 1.00 . A A . 5 ARG NH1 1 1 15 10568 1 1 5 ARG NH2 N -10.430 -5.418 -0.323 1.00 . A A . 5 ARG NH2 1 1 15 10569 1 1 5 ARG O O -2.525 -3.625 -0.242 1.00 . A A . 5 ARG O 1 1 15 10570 1 1 6 PRO C C -1.417 -3.436 -3.141 1.00 . A A . 6 PRO C 1 1 15 10571 1 1 6 PRO CA C -0.988 -4.648 -2.318 1.00 . A A . 6 PRO CA 1 1 15 10572 1 1 6 PRO CB C -0.337 -5.716 -3.205 1.00 . A A . 6 PRO CB 1 1 15 10573 1 1 6 PRO CD C -2.335 -6.623 -2.260 1.00 . A A . 6 PRO CD 1 1 15 10574 1 1 6 PRO CG C -1.496 -6.656 -3.537 1.00 . A A . 6 PRO CG 1 1 15 10575 1 1 6 PRO HA H -0.270 -4.329 -1.563 1.00 . A A . 6 PRO HA 1 1 15 10576 1 1 6 PRO HB2 H 0.124 -5.304 -4.103 1.00 . A A . 6 PRO HB2 1 1 15 10577 1 1 6 PRO HB3 H 0.406 -6.265 -2.628 1.00 . A A . 6 PRO HB3 1 1 15 10578 1 1 6 PRO HD2 H -3.383 -6.806 -2.499 1.00 . A A . 6 PRO HD2 1 1 15 10579 1 1 6 PRO HD3 H -1.968 -7.384 -1.570 1.00 . A A . 6 PRO HD3 1 1 15 10580 1 1 6 PRO HG2 H -2.072 -6.240 -4.362 1.00 . A A . 6 PRO HG2 1 1 15 10581 1 1 6 PRO HG3 H -1.158 -7.663 -3.785 1.00 . A A . 6 PRO HG3 1 1 15 10582 1 1 6 PRO N N -2.120 -5.302 -1.688 1.00 . A A . 6 PRO N 1 1 15 10583 1 1 6 PRO O O -2.591 -3.258 -3.464 1.00 . A A . 6 PRO O 1 1 15 10584 1 1 7 SER C C -1.370 -1.959 -5.709 1.00 . A A . 7 SER C 1 1 15 10585 1 1 7 SER CA C -0.481 -1.587 -4.520 1.00 . A A . 7 SER CA 1 1 15 10586 1 1 7 SER CB C 0.946 -1.374 -5.040 1.00 . A A . 7 SER CB 1 1 15 10587 1 1 7 SER H H 0.490 -2.764 -3.088 1.00 . A A . 7 SER H 1 1 15 10588 1 1 7 SER HA H -0.828 -0.657 -4.068 1.00 . A A . 7 SER HA 1 1 15 10589 1 1 7 SER HB2 H 0.849 -0.756 -5.932 1.00 . A A . 7 SER HB2 1 1 15 10590 1 1 7 SER HB3 H 1.549 -0.860 -4.292 1.00 . A A . 7 SER HB3 1 1 15 10591 1 1 7 SER HG H 0.867 -3.092 -5.891 1.00 . A A . 7 SER HG 1 1 15 10592 1 1 7 SER N N -0.422 -2.631 -3.517 1.00 . A A . 7 SER N 1 1 15 10593 1 1 7 SER O O -0.937 -2.752 -6.545 1.00 . A A . 7 SER O 1 1 15 10594 1 1 7 SER OG O 1.546 -2.618 -5.382 1.00 . A A . 7 SER OG 1 1 15 10595 1 1 8 GLN C C -3.016 -0.032 -7.786 1.00 . A A . 8 GLN C 1 1 15 10596 1 1 8 GLN CA C -3.340 -1.323 -7.033 1.00 . A A . 8 GLN CA 1 1 15 10597 1 1 8 GLN CB C -4.826 -1.372 -6.664 1.00 . A A . 8 GLN CB 1 1 15 10598 1 1 8 GLN CD C -4.861 -3.868 -6.200 1.00 . A A . 8 GLN CD 1 1 15 10599 1 1 8 GLN CG C -5.179 -2.477 -5.663 1.00 . A A . 8 GLN CG 1 1 15 10600 1 1 8 GLN H H -2.877 -0.738 -5.083 1.00 . A A . 8 GLN H 1 1 15 10601 1 1 8 GLN HA H -3.102 -2.180 -7.666 1.00 . A A . 8 GLN HA 1 1 15 10602 1 1 8 GLN HB2 H -5.152 -0.418 -6.258 1.00 . A A . 8 GLN HB2 1 1 15 10603 1 1 8 GLN HB3 H -5.376 -1.536 -7.582 1.00 . A A . 8 GLN HB3 1 1 15 10604 1 1 8 GLN HE21 H -3.353 -4.116 -4.857 1.00 . A A . 8 GLN HE21 1 1 15 10605 1 1 8 GLN HE22 H -3.631 -5.446 -5.983 1.00 . A A . 8 GLN HE22 1 1 15 10606 1 1 8 GLN HG2 H -4.667 -2.316 -4.717 1.00 . A A . 8 GLN HG2 1 1 15 10607 1 1 8 GLN HG3 H -6.247 -2.419 -5.466 1.00 . A A . 8 GLN HG3 1 1 15 10608 1 1 8 GLN N N -2.546 -1.339 -5.821 1.00 . A A . 8 GLN N 1 1 15 10609 1 1 8 GLN NE2 N -3.873 -4.539 -5.621 1.00 . A A . 8 GLN NE2 1 1 15 10610 1 1 8 GLN O O -2.741 -0.045 -8.979 1.00 . A A . 8 GLN O 1 1 15 10611 1 1 8 GLN OE1 O -5.507 -4.342 -7.127 1.00 . A A . 8 GLN OE1 1 1 15 10612 1 1 9 THR C C -1.297 2.608 -7.883 1.00 . A A . 9 THR C 1 1 15 10613 1 1 9 THR CA C -2.778 2.418 -7.592 1.00 . A A . 9 THR CA 1 1 15 10614 1 1 9 THR CB C -3.220 3.442 -6.542 1.00 . A A . 9 THR CB 1 1 15 10615 1 1 9 THR CG2 C -4.742 3.525 -6.563 1.00 . A A . 9 THR CG2 1 1 15 10616 1 1 9 THR H H -3.275 1.020 -6.079 1.00 . A A . 9 THR H 1 1 15 10617 1 1 9 THR HA H -3.337 2.569 -8.519 1.00 . A A . 9 THR HA 1 1 15 10618 1 1 9 THR HB H -2.787 4.421 -6.774 1.00 . A A . 9 THR HB 1 1 15 10619 1 1 9 THR HG1 H -3.387 2.404 -4.875 1.00 . A A . 9 THR HG1 1 1 15 10620 1 1 9 THR HG21 H -5.172 2.531 -6.510 1.00 . A A . 9 THR HG21 1 1 15 10621 1 1 9 THR HG22 H -5.084 4.114 -5.718 1.00 . A A . 9 THR HG22 1 1 15 10622 1 1 9 THR HG23 H -5.073 3.986 -7.494 1.00 . A A . 9 THR HG23 1 1 15 10623 1 1 9 THR N N -3.028 1.087 -7.060 1.00 . A A . 9 THR N 1 1 15 10624 1 1 9 THR O O -0.903 2.997 -8.978 1.00 . A A . 9 THR O 1 1 15 10625 1 1 9 THR OG1 O -2.772 3.047 -5.253 1.00 . A A . 9 THR OG1 1 1 15 10626 1 1 10 TRP C C 1.711 2.067 -7.985 1.00 . A A . 10 TRP C 1 1 15 10627 1 1 10 TRP CA C 0.918 2.720 -6.844 1.00 . A A . 10 TRP CA 1 1 15 10628 1 1 10 TRP CB C 1.473 2.345 -5.466 1.00 . A A . 10 TRP CB 1 1 15 10629 1 1 10 TRP CD1 C 3.964 1.992 -5.712 1.00 . A A . 10 TRP CD1 1 1 15 10630 1 1 10 TRP CD2 C 3.455 3.808 -4.495 1.00 . A A . 10 TRP CD2 1 1 15 10631 1 1 10 TRP CE2 C 4.871 3.785 -4.634 1.00 . A A . 10 TRP CE2 1 1 15 10632 1 1 10 TRP CE3 C 2.895 4.864 -3.748 1.00 . A A . 10 TRP CE3 1 1 15 10633 1 1 10 TRP CG C 2.905 2.683 -5.234 1.00 . A A . 10 TRP CG 1 1 15 10634 1 1 10 TRP CH2 C 5.097 5.840 -3.374 1.00 . A A . 10 TRP CH2 1 1 15 10635 1 1 10 TRP CZ2 C 5.686 4.791 -4.096 1.00 . A A . 10 TRP CZ2 1 1 15 10636 1 1 10 TRP CZ3 C 3.701 5.876 -3.190 1.00 . A A . 10 TRP CZ3 1 1 15 10637 1 1 10 TRP H H -0.933 2.092 -5.998 1.00 . A A . 10 TRP H 1 1 15 10638 1 1 10 TRP HA H 0.977 3.805 -6.960 1.00 . A A . 10 TRP HA 1 1 15 10639 1 1 10 TRP HB2 H 0.879 2.855 -4.706 1.00 . A A . 10 TRP HB2 1 1 15 10640 1 1 10 TRP HB3 H 1.356 1.278 -5.310 1.00 . A A . 10 TRP HB3 1 1 15 10641 1 1 10 TRP HD1 H 3.887 1.103 -6.327 1.00 . A A . 10 TRP HD1 1 1 15 10642 1 1 10 TRP HE1 H 6.071 2.340 -5.605 1.00 . A A . 10 TRP HE1 1 1 15 10643 1 1 10 TRP HE3 H 1.826 4.880 -3.612 1.00 . A A . 10 TRP HE3 1 1 15 10644 1 1 10 TRP HH2 H 5.733 6.618 -2.986 1.00 . A A . 10 TRP HH2 1 1 15 10645 1 1 10 TRP HZ2 H 6.746 4.782 -4.285 1.00 . A A . 10 TRP HZ2 1 1 15 10646 1 1 10 TRP HZ3 H 3.226 6.683 -2.639 1.00 . A A . 10 TRP HZ3 1 1 15 10647 1 1 10 TRP N N -0.478 2.320 -6.874 1.00 . A A . 10 TRP N 1 1 15 10648 1 1 10 TRP NE1 N 5.131 2.638 -5.358 1.00 . A A . 10 TRP NE1 1 1 15 10649 1 1 10 TRP O O 2.667 2.654 -8.483 1.00 . A A . 10 TRP O 1 1 15 10650 1 1 11 SER C C 3.274 0.227 -9.824 1.00 . A A . 11 SER C 1 1 15 10651 1 1 11 SER CA C 1.757 0.220 -9.631 1.00 . A A . 11 SER CA 1 1 15 10652 1 1 11 SER CB C 1.057 0.848 -10.842 1.00 . A A . 11 SER CB 1 1 15 10653 1 1 11 SER H H 0.461 0.494 -7.996 1.00 . A A . 11 SER H 1 1 15 10654 1 1 11 SER HA H 1.462 -0.824 -9.550 1.00 . A A . 11 SER HA 1 1 15 10655 1 1 11 SER HB2 H 1.403 1.874 -10.984 1.00 . A A . 11 SER HB2 1 1 15 10656 1 1 11 SER HB3 H 1.303 0.272 -11.737 1.00 . A A . 11 SER HB3 1 1 15 10657 1 1 11 SER HG H -0.595 1.594 -10.115 1.00 . A A . 11 SER HG 1 1 15 10658 1 1 11 SER N N 1.301 0.868 -8.408 1.00 . A A . 11 SER N 1 1 15 10659 1 1 11 SER O O 3.770 0.644 -10.867 1.00 . A A . 11 SER O 1 1 15 10660 1 1 11 SER OG O -0.344 0.837 -10.659 1.00 . A A . 11 SER OG 1 1 15 10661 1 1 12 GLY C C 6.052 -0.920 -7.668 1.00 . A A . 12 GLY C 1 1 15 10662 1 1 12 GLY CA C 5.455 -0.393 -8.962 1.00 . A A . 12 GLY CA 1 1 15 10663 1 1 12 GLY H H 3.585 -0.614 -7.992 1.00 . A A . 12 GLY H 1 1 15 10664 1 1 12 GLY HA2 H 5.709 -1.072 -9.777 1.00 . A A . 12 GLY HA2 1 1 15 10665 1 1 12 GLY HA3 H 5.870 0.595 -9.175 1.00 . A A . 12 GLY HA3 1 1 15 10666 1 1 12 GLY N N 4.015 -0.287 -8.844 1.00 . A A . 12 GLY N 1 1 15 10667 1 1 12 GLY O O 5.339 -1.495 -6.833 1.00 . A A . 12 GLY O 1 1 15 10668 1 1 13 ASN C C 7.816 0.340 -5.384 1.00 . A A . 13 ASN C 1 1 15 10669 1 1 13 ASN CA C 8.040 -0.908 -6.242 1.00 . A A . 13 ASN CA 1 1 15 10670 1 1 13 ASN CB C 9.533 -1.167 -6.484 1.00 . A A . 13 ASN CB 1 1 15 10671 1 1 13 ASN CG C 10.259 -1.638 -5.222 1.00 . A A . 13 ASN CG 1 1 15 10672 1 1 13 ASN H H 7.851 -0.192 -8.220 1.00 . A A . 13 ASN H 1 1 15 10673 1 1 13 ASN HA H 7.613 -1.786 -5.765 1.00 . A A . 13 ASN HA 1 1 15 10674 1 1 13 ASN HB2 H 9.632 -1.951 -7.237 1.00 . A A . 13 ASN HB2 1 1 15 10675 1 1 13 ASN HB3 H 10.010 -0.263 -6.866 1.00 . A A . 13 ASN HB3 1 1 15 10676 1 1 13 ASN HD21 H 10.534 0.287 -4.519 1.00 . A A . 13 ASN HD21 1 1 15 10677 1 1 13 ASN HD22 H 11.245 -1.001 -3.579 1.00 . A A . 13 ASN HD22 1 1 15 10678 1 1 13 ASN N N 7.358 -0.709 -7.507 1.00 . A A . 13 ASN N 1 1 15 10679 1 1 13 ASN ND2 N 10.713 -0.709 -4.384 1.00 . A A . 13 ASN ND2 1 1 15 10680 1 1 13 ASN O O 7.580 1.424 -5.916 1.00 . A A . 13 ASN O 1 1 15 10681 1 1 13 ASN OD1 O 10.426 -2.839 -5.009 1.00 . A A . 13 ASN OD1 1 1 15 10682 1 1 14 CYS C C 8.908 2.311 -3.395 1.00 . A A . 14 CYS C 1 1 15 10683 1 1 14 CYS CA C 7.797 1.299 -3.117 1.00 . A A . 14 CYS CA 1 1 15 10684 1 1 14 CYS CB C 7.940 0.745 -1.700 1.00 . A A . 14 CYS CB 1 1 15 10685 1 1 14 CYS H H 8.082 -0.719 -3.700 1.00 . A A . 14 CYS H 1 1 15 10686 1 1 14 CYS HA H 6.823 1.784 -3.207 1.00 . A A . 14 CYS HA 1 1 15 10687 1 1 14 CYS HB2 H 7.128 0.044 -1.512 1.00 . A A . 14 CYS HB2 1 1 15 10688 1 1 14 CYS HB3 H 8.889 0.218 -1.640 1.00 . A A . 14 CYS HB3 1 1 15 10689 1 1 14 CYS N N 7.864 0.197 -4.062 1.00 . A A . 14 CYS N 1 1 15 10690 1 1 14 CYS O O 9.963 1.948 -3.917 1.00 . A A . 14 CYS O 1 1 15 10691 1 1 14 CYS SG S 7.941 2.000 -0.399 1.00 . A A . 14 CYS SG 1 1 15 10692 1 1 15 GLY C C 9.701 5.322 -1.720 1.00 . A A . 15 GLY C 1 1 15 10693 1 1 15 GLY CA C 9.597 4.674 -3.096 1.00 . A A . 15 GLY CA 1 1 15 10694 1 1 15 GLY H H 7.773 3.730 -2.569 1.00 . A A . 15 GLY H 1 1 15 10695 1 1 15 GLY HA2 H 10.584 4.332 -3.394 1.00 . A A . 15 GLY HA2 1 1 15 10696 1 1 15 GLY HA3 H 9.245 5.411 -3.819 1.00 . A A . 15 GLY HA3 1 1 15 10697 1 1 15 GLY N N 8.654 3.568 -3.030 1.00 . A A . 15 GLY N 1 1 15 10698 1 1 15 GLY O O 10.788 5.465 -1.170 1.00 . A A . 15 GLY O 1 1 15 10699 1 1 16 ASN C C 7.117 5.762 0.829 1.00 . A A . 16 ASN C 1 1 15 10700 1 1 16 ASN CA C 8.436 6.203 0.202 1.00 . A A . 16 ASN CA 1 1 15 10701 1 1 16 ASN CB C 8.579 7.730 0.221 1.00 . A A . 16 ASN CB 1 1 15 10702 1 1 16 ASN CG C 8.797 8.255 1.637 1.00 . A A . 16 ASN CG 1 1 15 10703 1 1 16 ASN H H 7.698 5.545 -1.678 1.00 . A A . 16 ASN H 1 1 15 10704 1 1 16 ASN HA H 9.256 5.787 0.790 1.00 . A A . 16 ASN HA 1 1 15 10705 1 1 16 ASN HB2 H 9.452 8.006 -0.370 1.00 . A A . 16 ASN HB2 1 1 15 10706 1 1 16 ASN HB3 H 7.697 8.207 -0.205 1.00 . A A . 16 ASN HB3 1 1 15 10707 1 1 16 ASN HD21 H 9.753 9.920 0.955 1.00 . A A . 16 ASN HD21 1 1 15 10708 1 1 16 ASN HD22 H 9.580 9.778 2.691 1.00 . A A . 16 ASN HD22 1 1 15 10709 1 1 16 ASN N N 8.547 5.692 -1.157 1.00 . A A . 16 ASN N 1 1 15 10710 1 1 16 ASN ND2 N 9.411 9.423 1.765 1.00 . A A . 16 ASN ND2 1 1 15 10711 1 1 16 ASN O O 6.041 6.086 0.321 1.00 . A A . 16 ASN O 1 1 15 10712 1 1 16 ASN OD1 O 8.396 7.626 2.614 1.00 . A A . 16 ASN OD1 1 1 15 10713 1 1 17 THR C C 5.152 5.796 3.127 1.00 . A A . 17 THR C 1 1 15 10714 1 1 17 THR CA C 6.018 4.605 2.689 1.00 . A A . 17 THR CA 1 1 15 10715 1 1 17 THR CB C 6.446 3.676 3.837 1.00 . A A . 17 THR CB 1 1 15 10716 1 1 17 THR CG2 C 7.127 4.407 4.999 1.00 . A A . 17 THR CG2 1 1 15 10717 1 1 17 THR H H 8.103 4.855 2.343 1.00 . A A . 17 THR H 1 1 15 10718 1 1 17 THR HA H 5.435 4.004 2.001 1.00 . A A . 17 THR HA 1 1 15 10719 1 1 17 THR HB H 7.155 2.960 3.424 1.00 . A A . 17 THR HB 1 1 15 10720 1 1 17 THR HG1 H 4.741 3.532 4.765 1.00 . A A . 17 THR HG1 1 1 15 10721 1 1 17 THR HG21 H 7.984 4.977 4.638 1.00 . A A . 17 THR HG21 1 1 15 10722 1 1 17 THR HG22 H 6.431 5.082 5.497 1.00 . A A . 17 THR HG22 1 1 15 10723 1 1 17 THR HG23 H 7.479 3.672 5.725 1.00 . A A . 17 THR HG23 1 1 15 10724 1 1 17 THR N N 7.191 5.053 1.956 1.00 . A A . 17 THR N 1 1 15 10725 1 1 17 THR O O 3.923 5.711 3.141 1.00 . A A . 17 THR O 1 1 15 10726 1 1 17 THR OG1 O 5.342 2.934 4.312 1.00 . A A . 17 THR OG1 1 1 15 10727 1 1 18 ALA C C 4.288 8.724 2.588 1.00 . A A . 18 ALA C 1 1 15 10728 1 1 18 ALA CA C 5.078 8.161 3.773 1.00 . A A . 18 ALA CA 1 1 15 10729 1 1 18 ALA CB C 6.069 9.196 4.311 1.00 . A A . 18 ALA CB 1 1 15 10730 1 1 18 ALA H H 6.796 6.979 3.357 1.00 . A A . 18 ALA H 1 1 15 10731 1 1 18 ALA HA H 4.360 7.934 4.564 1.00 . A A . 18 ALA HA 1 1 15 10732 1 1 18 ALA HB1 H 6.638 8.771 5.138 1.00 . A A . 18 ALA HB1 1 1 15 10733 1 1 18 ALA HB2 H 6.753 9.509 3.523 1.00 . A A . 18 ALA HB2 1 1 15 10734 1 1 18 ALA HB3 H 5.526 10.070 4.672 1.00 . A A . 18 ALA HB3 1 1 15 10735 1 1 18 ALA N N 5.783 6.936 3.426 1.00 . A A . 18 ALA N 1 1 15 10736 1 1 18 ALA O O 3.420 9.572 2.795 1.00 . A A . 18 ALA O 1 1 15 10737 1 1 19 HIS C C 2.716 7.432 0.032 1.00 . A A . 19 HIS C 1 1 15 10738 1 1 19 HIS CA C 3.742 8.557 0.197 1.00 . A A . 19 HIS CA 1 1 15 10739 1 1 19 HIS CB C 4.601 8.742 -1.059 1.00 . A A . 19 HIS CB 1 1 15 10740 1 1 19 HIS CD2 C 2.575 9.728 -2.382 1.00 . A A . 19 HIS CD2 1 1 15 10741 1 1 19 HIS CE1 C 3.444 9.618 -4.388 1.00 . A A . 19 HIS CE1 1 1 15 10742 1 1 19 HIS CG C 3.850 9.231 -2.275 1.00 . A A . 19 HIS CG 1 1 15 10743 1 1 19 HIS H H 5.305 7.589 1.243 1.00 . A A . 19 HIS H 1 1 15 10744 1 1 19 HIS HA H 3.204 9.492 0.360 1.00 . A A . 19 HIS HA 1 1 15 10745 1 1 19 HIS HB2 H 5.380 9.464 -0.855 1.00 . A A . 19 HIS HB2 1 1 15 10746 1 1 19 HIS HB3 H 5.082 7.794 -1.281 1.00 . A A . 19 HIS HB3 1 1 15 10747 1 1 19 HIS HD1 H 5.344 8.926 -3.801 1.00 . A A . 19 HIS HD1 1 1 15 10748 1 1 19 HIS HD2 H 1.867 9.852 -1.566 1.00 . A A . 19 HIS HD2 1 1 15 10749 1 1 19 HIS HE1 H 3.549 9.666 -5.464 1.00 . A A . 19 HIS HE1 1 1 15 10750 1 1 19 HIS N N 4.581 8.287 1.356 1.00 . A A . 19 HIS N 1 1 15 10751 1 1 19 HIS ND1 N 4.410 9.218 -3.546 1.00 . A A . 19 HIS ND1 1 1 15 10752 1 1 19 HIS NE2 N 2.318 9.929 -3.728 1.00 . A A . 19 HIS NE2 1 1 15 10753 1 1 19 HIS O O 1.535 7.717 -0.154 1.00 . A A . 19 HIS O 1 1 15 10754 1 1 20 CYS C C 1.024 5.173 0.869 1.00 . A A . 20 CYS C 1 1 15 10755 1 1 20 CYS CA C 2.280 4.990 0.023 1.00 . A A . 20 CYS CA 1 1 15 10756 1 1 20 CYS CB C 3.007 3.743 0.529 1.00 . A A . 20 CYS CB 1 1 15 10757 1 1 20 CYS H H 4.152 6.013 0.234 1.00 . A A . 20 CYS H 1 1 15 10758 1 1 20 CYS HA H 1.982 4.835 -1.014 1.00 . A A . 20 CYS HA 1 1 15 10759 1 1 20 CYS HB2 H 3.859 3.512 -0.108 1.00 . A A . 20 CYS HB2 1 1 15 10760 1 1 20 CYS HB3 H 3.356 3.924 1.538 1.00 . A A . 20 CYS HB3 1 1 15 10761 1 1 20 CYS N N 3.157 6.167 0.107 1.00 . A A . 20 CYS N 1 1 15 10762 1 1 20 CYS O O -0.099 5.006 0.395 1.00 . A A . 20 CYS O 1 1 15 10763 1 1 20 CYS SG S 1.940 2.293 0.685 1.00 . A A . 20 CYS SG 1 1 15 10764 1 1 21 ASP C C -0.821 6.803 2.641 1.00 . A A . 21 ASP C 1 1 15 10765 1 1 21 ASP CA C 0.172 5.726 3.090 1.00 . A A . 21 ASP CA 1 1 15 10766 1 1 21 ASP CB C 0.792 6.094 4.443 1.00 . A A . 21 ASP CB 1 1 15 10767 1 1 21 ASP CG C -0.276 6.253 5.516 1.00 . A A . 21 ASP CG 1 1 15 10768 1 1 21 ASP H H 2.200 5.688 2.438 1.00 . A A . 21 ASP H 1 1 15 10769 1 1 21 ASP HA H -0.350 4.770 3.181 1.00 . A A . 21 ASP HA 1 1 15 10770 1 1 21 ASP HB2 H 1.486 5.311 4.752 1.00 . A A . 21 ASP HB2 1 1 15 10771 1 1 21 ASP HB3 H 1.346 7.029 4.354 1.00 . A A . 21 ASP HB3 1 1 15 10772 1 1 21 ASP N N 1.239 5.581 2.121 1.00 . A A . 21 ASP N 1 1 15 10773 1 1 21 ASP O O -2.011 6.674 2.911 1.00 . A A . 21 ASP O 1 1 15 10774 1 1 21 ASP OD1 O -0.689 5.255 6.104 1.00 . A A . 21 ASP OD1 1 1 15 10775 1 1 21 ASP OD2 O -0.709 7.522 5.749 1.00 . A A . 21 ASP OD2 1 1 15 10776 1 1 22 LYS C C -1.989 8.208 0.203 1.00 . A A . 22 LYS C 1 1 15 10777 1 1 22 LYS CA C -1.235 8.837 1.359 1.00 . A A . 22 LYS CA 1 1 15 10778 1 1 22 LYS CB C -0.503 10.086 0.849 1.00 . A A . 22 LYS CB 1 1 15 10779 1 1 22 LYS CD C 1.038 11.992 1.443 1.00 . A A . 22 LYS CD 1 1 15 10780 1 1 22 LYS CE C 1.687 12.811 2.571 1.00 . A A . 22 LYS CE 1 1 15 10781 1 1 22 LYS CG C 0.351 10.709 1.941 1.00 . A A . 22 LYS CG 1 1 15 10782 1 1 22 LYS H H 0.622 7.827 1.638 1.00 . A A . 22 LYS H 1 1 15 10783 1 1 22 LYS HA H -1.950 9.140 2.128 1.00 . A A . 22 LYS HA 1 1 15 10784 1 1 22 LYS HB2 H 0.131 9.838 -0.001 1.00 . A A . 22 LYS HB2 1 1 15 10785 1 1 22 LYS HB3 H -1.251 10.808 0.518 1.00 . A A . 22 LYS HB3 1 1 15 10786 1 1 22 LYS HD2 H 1.795 11.721 0.706 1.00 . A A . 22 LYS HD2 1 1 15 10787 1 1 22 LYS HD3 H 0.301 12.629 0.949 1.00 . A A . 22 LYS HD3 1 1 15 10788 1 1 22 LYS HE2 H 2.342 13.561 2.124 1.00 . A A . 22 LYS HE2 1 1 15 10789 1 1 22 LYS HE3 H 0.907 13.332 3.132 1.00 . A A . 22 LYS HE3 1 1 15 10790 1 1 22 LYS HG2 H -0.292 10.903 2.798 1.00 . A A . 22 LYS HG2 1 1 15 10791 1 1 22 LYS HG3 H 1.091 9.954 2.182 1.00 . A A . 22 LYS HG3 1 1 15 10792 1 1 22 LYS HZ1 H 2.304 10.977 3.292 1.00 . A A . 22 LYS HZ1 1 1 15 10793 1 1 22 LYS HZ2 H 3.466 12.186 3.413 1.00 . A A . 22 LYS HZ2 1 1 15 10794 1 1 22 LYS N N -0.344 7.843 1.943 1.00 . A A . 22 LYS N 1 1 15 10795 1 1 22 LYS NZ N 2.462 11.972 3.509 1.00 . A A . 22 LYS NZ 1 1 15 10796 1 1 22 LYS O O -3.212 8.233 0.202 1.00 . A A . 22 LYS O 1 1 15 10797 1 1 23 GLN C C -3.047 6.139 -1.600 1.00 . A A . 23 GLN C 1 1 15 10798 1 1 23 GLN CA C -1.914 7.089 -1.963 1.00 . A A . 23 GLN CA 1 1 15 10799 1 1 23 GLN CB C -0.957 6.454 -2.969 1.00 . A A . 23 GLN CB 1 1 15 10800 1 1 23 GLN CD C 0.201 7.744 -4.804 1.00 . A A . 23 GLN CD 1 1 15 10801 1 1 23 GLN CG C 0.201 7.390 -3.325 1.00 . A A . 23 GLN CG 1 1 15 10802 1 1 23 GLN H H -0.261 7.634 -0.675 1.00 . A A . 23 GLN H 1 1 15 10803 1 1 23 GLN HA H -2.304 7.932 -2.519 1.00 . A A . 23 GLN HA 1 1 15 10804 1 1 23 GLN HB2 H -0.546 5.544 -2.531 1.00 . A A . 23 GLN HB2 1 1 15 10805 1 1 23 GLN HB3 H -1.544 6.175 -3.845 1.00 . A A . 23 GLN HB3 1 1 15 10806 1 1 23 GLN HE21 H 0.013 5.790 -5.347 1.00 . A A . 23 GLN HE21 1 1 15 10807 1 1 23 GLN HE22 H 0.014 6.954 -6.647 1.00 . A A . 23 GLN HE22 1 1 15 10808 1 1 23 GLN HG2 H 0.123 8.326 -2.782 1.00 . A A . 23 GLN HG2 1 1 15 10809 1 1 23 GLN HG3 H 1.140 6.916 -3.081 1.00 . A A . 23 GLN HG3 1 1 15 10810 1 1 23 GLN N N -1.269 7.672 -0.789 1.00 . A A . 23 GLN N 1 1 15 10811 1 1 23 GLN NE2 N 0.097 6.743 -5.669 1.00 . A A . 23 GLN NE2 1 1 15 10812 1 1 23 GLN O O -4.168 6.274 -2.089 1.00 . A A . 23 GLN O 1 1 15 10813 1 1 23 GLN OE1 O 0.299 8.920 -5.152 1.00 . A A . 23 GLN OE1 1 1 15 10814 1 1 24 CYS C C -5.042 4.911 0.199 1.00 . A A . 24 CYS C 1 1 15 10815 1 1 24 CYS CA C -3.759 4.228 -0.282 1.00 . A A . 24 CYS CA 1 1 15 10816 1 1 24 CYS CB C -3.149 3.354 0.810 1.00 . A A . 24 CYS CB 1 1 15 10817 1 1 24 CYS H H -1.820 5.126 -0.343 1.00 . A A . 24 CYS H 1 1 15 10818 1 1 24 CYS HA H -4.020 3.615 -1.148 1.00 . A A . 24 CYS HA 1 1 15 10819 1 1 24 CYS HB2 H -2.712 3.985 1.583 1.00 . A A . 24 CYS HB2 1 1 15 10820 1 1 24 CYS HB3 H -3.929 2.747 1.260 1.00 . A A . 24 CYS HB3 1 1 15 10821 1 1 24 CYS N N -2.766 5.193 -0.712 1.00 . A A . 24 CYS N 1 1 15 10822 1 1 24 CYS O O -6.140 4.462 -0.125 1.00 . A A . 24 CYS O 1 1 15 10823 1 1 24 CYS SG S -1.899 2.204 0.211 1.00 . A A . 24 CYS SG 1 1 15 10824 1 1 25 GLN C C -6.672 7.553 0.263 1.00 . A A . 25 GLN C 1 1 15 10825 1 1 25 GLN CA C -6.048 6.777 1.434 1.00 . A A . 25 GLN CA 1 1 15 10826 1 1 25 GLN CB C -5.534 7.716 2.549 1.00 . A A . 25 GLN CB 1 1 15 10827 1 1 25 GLN CD C -7.696 9.074 2.789 1.00 . A A . 25 GLN CD 1 1 15 10828 1 1 25 GLN CG C -6.648 8.207 3.484 1.00 . A A . 25 GLN CG 1 1 15 10829 1 1 25 GLN H H -3.987 6.396 1.090 1.00 . A A . 25 GLN H 1 1 15 10830 1 1 25 GLN HA H -6.784 6.089 1.852 1.00 . A A . 25 GLN HA 1 1 15 10831 1 1 25 GLN HB2 H -4.792 7.189 3.153 1.00 . A A . 25 GLN HB2 1 1 15 10832 1 1 25 GLN HB3 H -5.012 8.578 2.141 1.00 . A A . 25 GLN HB3 1 1 15 10833 1 1 25 GLN HE21 H -6.297 10.335 1.935 1.00 . A A . 25 GLN HE21 1 1 15 10834 1 1 25 GLN HE22 H -7.988 10.703 1.656 1.00 . A A . 25 GLN HE22 1 1 15 10835 1 1 25 GLN HG2 H -7.144 7.344 3.933 1.00 . A A . 25 GLN HG2 1 1 15 10836 1 1 25 GLN HG3 H -6.201 8.794 4.285 1.00 . A A . 25 GLN HG3 1 1 15 10837 1 1 25 GLN N N -4.914 6.017 0.933 1.00 . A A . 25 GLN N 1 1 15 10838 1 1 25 GLN NE2 N -7.283 10.121 2.080 1.00 . A A . 25 GLN NE2 1 1 15 10839 1 1 25 GLN O O -7.810 7.318 -0.153 1.00 . A A . 25 GLN O 1 1 15 10840 1 1 25 GLN OE1 O -8.888 8.802 2.877 1.00 . A A . 25 GLN OE1 1 1 15 10841 1 1 26 ASP C C -6.818 8.921 -2.453 1.00 . A A . 26 ASP C 1 1 15 10842 1 1 26 ASP CA C -6.258 9.540 -1.188 1.00 . A A . 26 ASP CA 1 1 15 10843 1 1 26 ASP CB C -5.038 10.409 -1.512 1.00 . A A . 26 ASP CB 1 1 15 10844 1 1 26 ASP CG C -4.558 11.247 -0.325 1.00 . A A . 26 ASP CG 1 1 15 10845 1 1 26 ASP H H -4.958 8.558 0.141 1.00 . A A . 26 ASP H 1 1 15 10846 1 1 26 ASP HA H -7.015 10.179 -0.746 1.00 . A A . 26 ASP HA 1 1 15 10847 1 1 26 ASP HB2 H -4.219 9.788 -1.863 1.00 . A A . 26 ASP HB2 1 1 15 10848 1 1 26 ASP HB3 H -5.314 11.076 -2.325 1.00 . A A . 26 ASP HB3 1 1 15 10849 1 1 26 ASP N N -5.888 8.499 -0.249 1.00 . A A . 26 ASP N 1 1 15 10850 1 1 26 ASP O O -7.925 9.248 -2.876 1.00 . A A . 26 ASP O 1 1 15 10851 1 1 26 ASP OD1 O -4.921 10.971 0.818 1.00 . A A . 26 ASP OD1 1 1 15 10852 1 1 26 ASP OD2 O -3.727 12.279 -0.626 1.00 . A A . 26 ASP OD2 1 1 15 10853 1 1 27 TRP C C -7.322 6.184 -3.903 1.00 . A A . 27 TRP C 1 1 15 10854 1 1 27 TRP CA C -6.421 7.359 -4.282 1.00 . A A . 27 TRP CA 1 1 15 10855 1 1 27 TRP CB C -5.176 6.809 -4.984 1.00 . A A . 27 TRP CB 1 1 15 10856 1 1 27 TRP CD1 C -3.719 8.882 -5.038 1.00 . A A . 27 TRP CD1 1 1 15 10857 1 1 27 TRP CD2 C -3.514 7.625 -6.877 1.00 . A A . 27 TRP CD2 1 1 15 10858 1 1 27 TRP CE2 C -2.492 8.618 -6.937 1.00 . A A . 27 TRP CE2 1 1 15 10859 1 1 27 TRP CE3 C -3.609 6.727 -7.958 1.00 . A A . 27 TRP CE3 1 1 15 10860 1 1 27 TRP CG C -4.206 7.759 -5.606 1.00 . A A . 27 TRP CG 1 1 15 10861 1 1 27 TRP CH2 C -1.627 7.680 -8.994 1.00 . A A . 27 TRP CH2 1 1 15 10862 1 1 27 TRP CZ2 C -1.563 8.661 -7.988 1.00 . A A . 27 TRP CZ2 1 1 15 10863 1 1 27 TRP CZ3 C -2.667 6.740 -8.999 1.00 . A A . 27 TRP CZ3 1 1 15 10864 1 1 27 TRP H H -5.186 7.737 -2.590 1.00 . A A . 27 TRP H 1 1 15 10865 1 1 27 TRP HA H -6.949 8.044 -4.949 1.00 . A A . 27 TRP HA 1 1 15 10866 1 1 27 TRP HB2 H -4.601 6.129 -4.367 1.00 . A A . 27 TRP HB2 1 1 15 10867 1 1 27 TRP HB3 H -5.564 6.215 -5.804 1.00 . A A . 27 TRP HB3 1 1 15 10868 1 1 27 TRP HD1 H -3.998 9.267 -4.072 1.00 . A A . 27 TRP HD1 1 1 15 10869 1 1 27 TRP HE1 H -2.106 10.160 -5.533 1.00 . A A . 27 TRP HE1 1 1 15 10870 1 1 27 TRP HE3 H -4.412 6.011 -7.984 1.00 . A A . 27 TRP HE3 1 1 15 10871 1 1 27 TRP HH2 H -0.886 7.625 -9.768 1.00 . A A . 27 TRP HH2 1 1 15 10872 1 1 27 TRP HZ2 H -0.789 9.413 -8.004 1.00 . A A . 27 TRP HZ2 1 1 15 10873 1 1 27 TRP HZ3 H -2.735 6.015 -9.796 1.00 . A A . 27 TRP HZ3 1 1 15 10874 1 1 27 TRP N N -6.054 8.006 -3.042 1.00 . A A . 27 TRP N 1 1 15 10875 1 1 27 TRP NE1 N -2.684 9.378 -5.799 1.00 . A A . 27 TRP NE1 1 1 15 10876 1 1 27 TRP O O -8.525 6.203 -4.161 1.00 . A A . 27 TRP O 1 1 15 10877 1 1 28 GLU C C -8.563 3.579 -2.705 1.00 . A A . 28 GLU C 1 1 15 10878 1 1 28 GLU CA C -7.233 3.796 -3.437 1.00 . A A . 28 GLU CA 1 1 15 10879 1 1 28 GLU CB C -6.130 2.785 -3.057 1.00 . A A . 28 GLU CB 1 1 15 10880 1 1 28 GLU CD C -5.051 0.546 -3.651 1.00 . A A . 28 GLU CD 1 1 15 10881 1 1 28 GLU CG C -6.278 1.447 -3.803 1.00 . A A . 28 GLU CG 1 1 15 10882 1 1 28 GLU H H -5.803 5.302 -2.910 1.00 . A A . 28 GLU H 1 1 15 10883 1 1 28 GLU HA H -7.434 3.674 -4.504 1.00 . A A . 28 GLU HA 1 1 15 10884 1 1 28 GLU HB2 H -5.162 3.204 -3.337 1.00 . A A . 28 GLU HB2 1 1 15 10885 1 1 28 GLU HB3 H -6.131 2.605 -1.981 1.00 . A A . 28 GLU HB3 1 1 15 10886 1 1 28 GLU HG2 H -7.160 0.921 -3.446 1.00 . A A . 28 GLU HG2 1 1 15 10887 1 1 28 GLU HG3 H -6.418 1.635 -4.865 1.00 . A A . 28 GLU HG3 1 1 15 10888 1 1 28 GLU N N -6.748 5.162 -3.260 1.00 . A A . 28 GLU N 1 1 15 10889 1 1 28 GLU O O -9.512 3.111 -3.324 1.00 . A A . 28 GLU O 1 1 15 10890 1 1 28 GLU OE1 O -4.041 0.765 -4.330 1.00 . A A . 28 GLU OE1 1 1 15 10891 1 1 28 GLU OE2 O -5.172 -0.492 -2.780 1.00 . A A . 28 GLU OE2 1 1 15 10892 1 1 29 LYS C C -9.543 3.413 0.798 1.00 . A A . 29 LYS C 1 1 15 10893 1 1 29 LYS CA C -9.737 4.176 -0.521 1.00 . A A . 29 LYS CA 1 1 15 10894 1 1 29 LYS CB C -11.108 3.936 -1.150 1.00 . A A . 29 LYS CB 1 1 15 10895 1 1 29 LYS CD C -11.909 6.343 -1.401 1.00 . A A . 29 LYS CD 1 1 15 10896 1 1 29 LYS CE C -11.239 7.567 -2.035 1.00 . A A . 29 LYS CE 1 1 15 10897 1 1 29 LYS CG C -11.582 5.022 -2.130 1.00 . A A . 29 LYS CG 1 1 15 10898 1 1 29 LYS H H -7.755 4.239 -1.003 1.00 . A A . 29 LYS H 1 1 15 10899 1 1 29 LYS HA H -9.677 5.225 -0.242 1.00 . A A . 29 LYS HA 1 1 15 10900 1 1 29 LYS HB2 H -11.181 2.941 -1.589 1.00 . A A . 29 LYS HB2 1 1 15 10901 1 1 29 LYS HB3 H -11.775 3.967 -0.309 1.00 . A A . 29 LYS HB3 1 1 15 10902 1 1 29 LYS HD2 H -12.991 6.491 -1.435 1.00 . A A . 29 LYS HD2 1 1 15 10903 1 1 29 LYS HD3 H -11.636 6.291 -0.346 1.00 . A A . 29 LYS HD3 1 1 15 10904 1 1 29 LYS HE2 H -11.607 7.693 -3.055 1.00 . A A . 29 LYS HE2 1 1 15 10905 1 1 29 LYS HE3 H -11.510 8.454 -1.459 1.00 . A A . 29 LYS HE3 1 1 15 10906 1 1 29 LYS HG2 H -10.859 5.158 -2.930 1.00 . A A . 29 LYS HG2 1 1 15 10907 1 1 29 LYS HG3 H -12.499 4.657 -2.596 1.00 . A A . 29 LYS HG3 1 1 15 10908 1 1 29 LYS HZ1 H -9.503 6.499 -2.349 1.00 . A A . 29 LYS HZ1 1 1 15 10909 1 1 29 LYS HZ2 H -9.388 8.128 -2.751 1.00 . A A . 29 LYS HZ2 1 1 15 10910 1 1 29 LYS N N -8.612 3.918 -1.409 1.00 . A A . 29 LYS N 1 1 15 10911 1 1 29 LYS NZ N -9.768 7.454 -2.070 1.00 . A A . 29 LYS NZ 1 1 15 10912 1 1 29 LYS O O -10.482 2.859 1.367 1.00 . A A . 29 LYS O 1 1 15 10913 1 1 30 ALA C C -8.073 3.388 3.703 1.00 . A A . 30 ALA C 1 1 15 10914 1 1 30 ALA CA C -7.920 2.570 2.426 1.00 . A A . 30 ALA CA 1 1 15 10915 1 1 30 ALA CB C -6.464 2.166 2.231 1.00 . A A . 30 ALA CB 1 1 15 10916 1 1 30 ALA H H -7.572 3.879 0.809 1.00 . A A . 30 ALA H 1 1 15 10917 1 1 30 ALA HA H -8.533 1.671 2.480 1.00 . A A . 30 ALA HA 1 1 15 10918 1 1 30 ALA HB1 H -6.333 1.807 1.212 1.00 . A A . 30 ALA HB1 1 1 15 10919 1 1 30 ALA HB2 H -5.828 3.036 2.398 1.00 . A A . 30 ALA HB2 1 1 15 10920 1 1 30 ALA HB3 H -6.195 1.380 2.926 1.00 . A A . 30 ALA HB3 1 1 15 10921 1 1 30 ALA N N -8.304 3.358 1.274 1.00 . A A . 30 ALA N 1 1 15 10922 1 1 30 ALA O O -8.138 4.615 3.659 1.00 . A A . 30 ALA O 1 1 15 10923 1 1 31 SER C C -6.464 4.029 6.135 1.00 . A A . 31 SER C 1 1 15 10924 1 1 31 SER CA C -7.836 3.352 6.127 1.00 . A A . 31 SER CA 1 1 15 10925 1 1 31 SER CB C -7.936 2.270 7.199 1.00 . A A . 31 SER CB 1 1 15 10926 1 1 31 SER H H -7.932 1.712 4.893 1.00 . A A . 31 SER H 1 1 15 10927 1 1 31 SER HA H -8.613 4.090 6.309 1.00 . A A . 31 SER HA 1 1 15 10928 1 1 31 SER HB2 H -7.083 1.607 7.128 1.00 . A A . 31 SER HB2 1 1 15 10929 1 1 31 SER HB3 H -7.878 2.757 8.159 1.00 . A A . 31 SER HB3 1 1 15 10930 1 1 31 SER HG H -9.861 2.155 6.934 1.00 . A A . 31 SER HG 1 1 15 10931 1 1 31 SER N N -8.047 2.716 4.855 1.00 . A A . 31 SER N 1 1 15 10932 1 1 31 SER O O -6.330 5.147 6.620 1.00 . A A . 31 SER O 1 1 15 10933 1 1 31 SER OG O -9.141 1.529 7.060 1.00 . A A . 31 SER OG 1 1 15 10934 1 1 32 HIS C C -3.263 2.973 4.575 1.00 . A A . 32 HIS C 1 1 15 10935 1 1 32 HIS CA C -4.090 3.880 5.497 1.00 . A A . 32 HIS CA 1 1 15 10936 1 1 32 HIS CB C -3.473 4.032 6.903 1.00 . A A . 32 HIS CB 1 1 15 10937 1 1 32 HIS CD2 C -3.118 1.628 7.671 1.00 . A A . 32 HIS CD2 1 1 15 10938 1 1 32 HIS CE1 C -0.953 1.579 7.786 1.00 . A A . 32 HIS CE1 1 1 15 10939 1 1 32 HIS CG C -2.652 2.861 7.349 1.00 . A A . 32 HIS CG 1 1 15 10940 1 1 32 HIS H H -5.608 2.432 5.189 1.00 . A A . 32 HIS H 1 1 15 10941 1 1 32 HIS HA H -4.157 4.867 5.035 1.00 . A A . 32 HIS HA 1 1 15 10942 1 1 32 HIS HB2 H -2.847 4.899 6.932 1.00 . A A . 32 HIS HB2 1 1 15 10943 1 1 32 HIS HB3 H -4.244 4.205 7.653 1.00 . A A . 32 HIS HB3 1 1 15 10944 1 1 32 HIS HD1 H -0.630 3.566 7.098 1.00 . A A . 32 HIS HD1 1 1 15 10945 1 1 32 HIS HD2 H -4.153 1.387 7.547 1.00 . A A . 32 HIS HD2 1 1 15 10946 1 1 32 HIS HE1 H 0.051 1.208 7.900 1.00 . A A . 32 HIS HE1 1 1 15 10947 1 1 32 HIS N N -5.440 3.341 5.612 1.00 . A A . 32 HIS N 1 1 15 10948 1 1 32 HIS ND1 N -1.271 2.837 7.422 1.00 . A A . 32 HIS ND1 1 1 15 10949 1 1 32 HIS NE2 N -2.045 0.816 7.962 1.00 . A A . 32 HIS NE2 1 1 15 10950 1 1 32 HIS O O -3.800 2.003 4.031 1.00 . A A . 32 HIS O 1 1 15 10951 1 1 33 GLY C C 0.335 2.265 4.435 1.00 . A A . 33 GLY C 1 1 15 10952 1 1 33 GLY CA C -1.016 2.386 3.738 1.00 . A A . 33 GLY CA 1 1 15 10953 1 1 33 GLY H H -1.560 4.024 4.963 1.00 . A A . 33 GLY H 1 1 15 10954 1 1 33 GLY HA2 H -1.424 1.400 3.678 1.00 . A A . 33 GLY HA2 1 1 15 10955 1 1 33 GLY HA3 H -0.855 2.710 2.722 1.00 . A A . 33 GLY HA3 1 1 15 10956 1 1 33 GLY N N -1.956 3.243 4.450 1.00 . A A . 33 GLY N 1 1 15 10957 1 1 33 GLY O O 0.582 2.925 5.441 1.00 . A A . 33 GLY O 1 1 15 10958 1 1 34 ALA C C 3.244 0.173 3.472 1.00 . A A . 34 ALA C 1 1 15 10959 1 1 34 ALA CA C 2.502 1.073 4.466 1.00 . A A . 34 ALA CA 1 1 15 10960 1 1 34 ALA CB C 2.321 0.376 5.820 1.00 . A A . 34 ALA CB 1 1 15 10961 1 1 34 ALA H H 0.898 0.851 3.103 1.00 . A A . 34 ALA H 1 1 15 10962 1 1 34 ALA HA H 3.052 1.999 4.613 1.00 . A A . 34 ALA HA 1 1 15 10963 1 1 34 ALA HB1 H 1.598 -0.435 5.730 1.00 . A A . 34 ALA HB1 1 1 15 10964 1 1 34 ALA HB2 H 3.273 -0.023 6.169 1.00 . A A . 34 ALA HB2 1 1 15 10965 1 1 34 ALA HB3 H 1.955 1.086 6.559 1.00 . A A . 34 ALA HB3 1 1 15 10966 1 1 34 ALA N N 1.194 1.386 3.916 1.00 . A A . 34 ALA N 1 1 15 10967 1 1 34 ALA O O 2.643 -0.762 2.944 1.00 . A A . 34 ALA O 1 1 15 10968 1 1 35 CYS C C 5.786 -1.665 2.978 1.00 . A A . 35 CYS C 1 1 15 10969 1 1 35 CYS CA C 5.312 -0.388 2.283 1.00 . A A . 35 CYS CA 1 1 15 10970 1 1 35 CYS CB C 6.523 0.397 1.790 1.00 . A A . 35 CYS CB 1 1 15 10971 1 1 35 CYS H H 5.004 1.223 3.611 1.00 . A A . 35 CYS H 1 1 15 10972 1 1 35 CYS HA H 4.710 -0.628 1.410 1.00 . A A . 35 CYS HA 1 1 15 10973 1 1 35 CYS HB2 H 7.072 0.816 2.631 1.00 . A A . 35 CYS HB2 1 1 15 10974 1 1 35 CYS HB3 H 7.182 -0.311 1.306 1.00 . A A . 35 CYS HB3 1 1 15 10975 1 1 35 CYS N N 4.525 0.434 3.192 1.00 . A A . 35 CYS N 1 1 15 10976 1 1 35 CYS O O 6.045 -1.648 4.183 1.00 . A A . 35 CYS O 1 1 15 10977 1 1 35 CYS SG S 6.135 1.678 0.575 1.00 . A A . 35 CYS SG 1 1 15 10978 1 1 36 HIS C C 7.230 -4.739 1.560 1.00 . A A . 36 HIS C 1 1 15 10979 1 1 36 HIS CA C 6.630 -3.964 2.719 1.00 . A A . 36 HIS CA 1 1 15 10980 1 1 36 HIS CB C 5.740 -4.945 3.487 1.00 . A A . 36 HIS CB 1 1 15 10981 1 1 36 HIS CD2 C 3.190 -4.694 3.474 1.00 . A A . 36 HIS CD2 1 1 15 10982 1 1 36 HIS CE1 C 3.004 -3.306 5.159 1.00 . A A . 36 HIS CE1 1 1 15 10983 1 1 36 HIS CG C 4.432 -4.407 3.957 1.00 . A A . 36 HIS CG 1 1 15 10984 1 1 36 HIS H H 5.664 -2.760 1.256 1.00 . A A . 36 HIS H 1 1 15 10985 1 1 36 HIS HA H 7.421 -3.652 3.393 1.00 . A A . 36 HIS HA 1 1 15 10986 1 1 36 HIS HB2 H 5.500 -5.788 2.837 1.00 . A A . 36 HIS HB2 1 1 15 10987 1 1 36 HIS HB3 H 6.297 -5.336 4.339 1.00 . A A . 36 HIS HB3 1 1 15 10988 1 1 36 HIS HD1 H 5.082 -2.932 5.371 1.00 . A A . 36 HIS HD1 1 1 15 10989 1 1 36 HIS HD2 H 3.005 -5.319 2.606 1.00 . A A . 36 HIS HD2 1 1 15 10990 1 1 36 HIS HE1 H 2.575 -2.647 5.901 1.00 . A A . 36 HIS HE1 1 1 15 10991 1 1 36 HIS N N 5.923 -2.774 2.242 1.00 . A A . 36 HIS N 1 1 15 10992 1 1 36 HIS ND1 N 4.317 -3.477 4.972 1.00 . A A . 36 HIS ND1 1 1 15 10993 1 1 36 HIS NE2 N 2.290 -4.060 4.307 1.00 . A A . 36 HIS NE2 1 1 15 10994 1 1 36 HIS O O 6.764 -4.631 0.429 1.00 . A A . 36 HIS O 1 1 15 10995 1 1 37 LYS C C 7.782 -7.807 0.884 1.00 . A A . 37 LYS C 1 1 15 10996 1 1 37 LYS CA C 8.709 -6.591 0.949 1.00 . A A . 37 LYS CA 1 1 15 10997 1 1 37 LYS CB C 10.133 -6.950 1.376 1.00 . A A . 37 LYS CB 1 1 15 10998 1 1 37 LYS CD C 12.147 -8.467 0.892 1.00 . A A . 37 LYS CD 1 1 15 10999 1 1 37 LYS CE C 13.421 -7.670 0.562 1.00 . A A . 37 LYS CE 1 1 15 11000 1 1 37 LYS CG C 10.870 -7.804 0.337 1.00 . A A . 37 LYS CG 1 1 15 11001 1 1 37 LYS H H 8.485 -5.680 2.843 1.00 . A A . 37 LYS H 1 1 15 11002 1 1 37 LYS HA H 8.792 -6.143 -0.029 1.00 . A A . 37 LYS HA 1 1 15 11003 1 1 37 LYS HB2 H 10.687 -6.040 1.490 1.00 . A A . 37 LYS HB2 1 1 15 11004 1 1 37 LYS HB3 H 10.094 -7.417 2.349 1.00 . A A . 37 LYS HB3 1 1 15 11005 1 1 37 LYS HD2 H 12.062 -8.590 1.975 1.00 . A A . 37 LYS HD2 1 1 15 11006 1 1 37 LYS HD3 H 12.221 -9.469 0.472 1.00 . A A . 37 LYS HD3 1 1 15 11007 1 1 37 LYS HE2 H 13.306 -7.154 -0.394 1.00 . A A . 37 LYS HE2 1 1 15 11008 1 1 37 LYS HE3 H 13.568 -6.936 1.353 1.00 . A A . 37 LYS HE3 1 1 15 11009 1 1 37 LYS HG2 H 10.190 -8.585 0.043 1.00 . A A . 37 LYS HG2 1 1 15 11010 1 1 37 LYS HG3 H 11.062 -7.218 -0.564 1.00 . A A . 37 LYS HG3 1 1 15 11011 1 1 37 LYS HZ1 H 14.335 -9.513 0.367 1.00 . A A . 37 LYS HZ1 1 1 15 11012 1 1 37 LYS HZ2 H 15.158 -8.256 -0.390 1.00 . A A . 37 LYS HZ2 1 1 15 11013 1 1 37 LYS N N 8.168 -5.629 1.887 1.00 . A A . 37 LYS N 1 1 15 11014 1 1 37 LYS NZ N 14.622 -8.526 0.447 1.00 . A A . 37 LYS NZ 1 1 15 11015 1 1 37 LYS O O 7.284 -8.285 1.908 1.00 . A A . 37 LYS O 1 1 15 11016 1 1 38 ARG C C 7.500 -10.104 -1.897 1.00 . A A . 38 ARG C 1 1 15 11017 1 1 38 ARG CA C 6.843 -9.527 -0.644 1.00 . A A . 38 ARG CA 1 1 15 11018 1 1 38 ARG CB C 5.372 -9.230 -0.954 1.00 . A A . 38 ARG CB 1 1 15 11019 1 1 38 ARG CD C 4.288 -9.695 1.322 1.00 . A A . 38 ARG CD 1 1 15 11020 1 1 38 ARG CG C 4.543 -8.671 0.210 1.00 . A A . 38 ARG CG 1 1 15 11021 1 1 38 ARG CZ C 3.869 -8.589 3.534 1.00 . A A . 38 ARG CZ 1 1 15 11022 1 1 38 ARG H H 7.902 -7.774 -1.136 1.00 . A A . 38 ARG H 1 1 15 11023 1 1 38 ARG HA H 6.929 -10.237 0.180 1.00 . A A . 38 ARG HA 1 1 15 11024 1 1 38 ARG HB2 H 5.356 -8.498 -1.762 1.00 . A A . 38 ARG HB2 1 1 15 11025 1 1 38 ARG HB3 H 4.911 -10.149 -1.312 1.00 . A A . 38 ARG HB3 1 1 15 11026 1 1 38 ARG HD2 H 3.759 -10.547 0.890 1.00 . A A . 38 ARG HD2 1 1 15 11027 1 1 38 ARG HD3 H 5.225 -10.072 1.728 1.00 . A A . 38 ARG HD3 1 1 15 11028 1 1 38 ARG HG2 H 5.009 -7.770 0.609 1.00 . A A . 38 ARG HG2 1 1 15 11029 1 1 38 ARG HG3 H 3.574 -8.400 -0.200 1.00 . A A . 38 ARG HG3 1 1 15 11030 1 1 38 ARG HH11 H 5.849 -8.570 2.987 1.00 . A A . 38 ARG HH11 1 1 15 11031 1 1 38 ARG HH12 H 5.544 -8.120 4.635 1.00 . A A . 38 ARG HH12 1 1 15 11032 1 1 38 ARG HH21 H 1.984 -8.313 4.331 1.00 . A A . 38 ARG HH21 1 1 15 11033 1 1 38 ARG HH22 H 3.295 -7.887 5.375 1.00 . A A . 38 ARG HH22 1 1 15 11034 1 1 38 ARG N N 7.544 -8.292 -0.336 1.00 . A A . 38 ARG N 1 1 15 11035 1 1 38 ARG NE N 3.432 -9.125 2.381 1.00 . A A . 38 ARG NE 1 1 15 11036 1 1 38 ARG NH1 N 5.181 -8.406 3.739 1.00 . A A . 38 ARG NH1 1 1 15 11037 1 1 38 ARG NH2 N 2.990 -8.225 4.476 1.00 . A A . 38 ARG NH2 1 1 15 11038 1 1 38 ARG O O 7.702 -9.367 -2.859 1.00 . A A . 38 ARG O 1 1 15 11039 1 1 39 GLU C C 9.758 -11.193 -3.476 1.00 . A A . 39 GLU C 1 1 15 11040 1 1 39 GLU CA C 8.551 -12.028 -3.023 1.00 . A A . 39 GLU CA 1 1 15 11041 1 1 39 GLU CB C 7.555 -12.257 -4.172 1.00 . A A . 39 GLU CB 1 1 15 11042 1 1 39 GLU CD C 5.411 -13.393 -4.917 1.00 . A A . 39 GLU CD 1 1 15 11043 1 1 39 GLU CG C 6.369 -13.140 -3.755 1.00 . A A . 39 GLU CG 1 1 15 11044 1 1 39 GLU H H 7.662 -11.960 -1.087 1.00 . A A . 39 GLU H 1 1 15 11045 1 1 39 GLU HA H 8.927 -13.000 -2.698 1.00 . A A . 39 GLU HA 1 1 15 11046 1 1 39 GLU HB2 H 7.173 -11.298 -4.524 1.00 . A A . 39 GLU HB2 1 1 15 11047 1 1 39 GLU HB3 H 8.075 -12.745 -4.999 1.00 . A A . 39 GLU HB3 1 1 15 11048 1 1 39 GLU HG2 H 6.743 -14.101 -3.400 1.00 . A A . 39 GLU HG2 1 1 15 11049 1 1 39 GLU HG3 H 5.805 -12.662 -2.956 1.00 . A A . 39 GLU HG3 1 1 15 11050 1 1 39 GLU N N 7.870 -11.390 -1.894 1.00 . A A . 39 GLU N 1 1 15 11051 1 1 39 GLU O O 9.993 -11.008 -4.667 1.00 . A A . 39 GLU O 1 1 15 11052 1 1 39 GLU OE1 O 5.496 -12.715 -5.938 1.00 . A A . 39 GLU OE1 1 1 15 11053 1 1 39 GLU OE2 O 4.500 -14.384 -4.734 1.00 . A A . 39 GLU OE2 1 1 15 11054 1 1 40 ASN C C 11.272 -8.339 -3.194 1.00 . A A . 40 ASN C 1 1 15 11055 1 1 40 ASN CA C 11.620 -9.735 -2.658 1.00 . A A . 40 ASN CA 1 1 15 11056 1 1 40 ASN CB C 12.714 -10.401 -3.484 1.00 . A A . 40 ASN CB 1 1 15 11057 1 1 40 ASN CG C 14.063 -9.708 -3.288 1.00 . A A . 40 ASN CG 1 1 15 11058 1 1 40 ASN H H 10.279 -10.922 -1.571 1.00 . A A . 40 ASN H 1 1 15 11059 1 1 40 ASN HA H 12.016 -9.591 -1.659 1.00 . A A . 40 ASN HA 1 1 15 11060 1 1 40 ASN HB2 H 12.805 -11.448 -3.199 1.00 . A A . 40 ASN HB2 1 1 15 11061 1 1 40 ASN HB3 H 12.385 -10.367 -4.516 1.00 . A A . 40 ASN HB3 1 1 15 11062 1 1 40 ASN HD21 H 14.457 -9.707 -5.287 1.00 . A A . 40 ASN HD21 1 1 15 11063 1 1 40 ASN HD22 H 15.681 -8.991 -4.262 1.00 . A A . 40 ASN HD22 1 1 15 11064 1 1 40 ASN N N 10.492 -10.640 -2.506 1.00 . A A . 40 ASN N 1 1 15 11065 1 1 40 ASN ND2 N 14.787 -9.446 -4.371 1.00 . A A . 40 ASN ND2 1 1 15 11066 1 1 40 ASN O O 12.113 -7.446 -3.151 1.00 . A A . 40 ASN O 1 1 15 11067 1 1 40 ASN OD1 O 14.456 -9.417 -2.159 1.00 . A A . 40 ASN OD1 1 1 15 11068 1 1 41 HIS C C 8.975 -6.016 -3.125 1.00 . A A . 41 HIS C 1 1 15 11069 1 1 41 HIS CA C 9.583 -6.867 -4.232 1.00 . A A . 41 HIS CA 1 1 15 11070 1 1 41 HIS CB C 8.557 -7.143 -5.333 1.00 . A A . 41 HIS CB 1 1 15 11071 1 1 41 HIS CD2 C 8.954 -9.288 -6.745 1.00 . A A . 41 HIS CD2 1 1 15 11072 1 1 41 HIS CE1 C 10.418 -8.494 -8.152 1.00 . A A . 41 HIS CE1 1 1 15 11073 1 1 41 HIS CG C 9.143 -7.961 -6.460 1.00 . A A . 41 HIS CG 1 1 15 11074 1 1 41 HIS H H 9.339 -8.837 -3.520 1.00 . A A . 41 HIS H 1 1 15 11075 1 1 41 HIS HA H 10.415 -6.343 -4.696 1.00 . A A . 41 HIS HA 1 1 15 11076 1 1 41 HIS HB2 H 7.723 -7.683 -4.886 1.00 . A A . 41 HIS HB2 1 1 15 11077 1 1 41 HIS HB3 H 8.170 -6.197 -5.718 1.00 . A A . 41 HIS HB3 1 1 15 11078 1 1 41 HIS HD1 H 10.395 -6.506 -7.438 1.00 . A A . 41 HIS HD1 1 1 15 11079 1 1 41 HIS HD2 H 8.356 -9.973 -6.165 1.00 . A A . 41 HIS HD2 1 1 15 11080 1 1 41 HIS HE1 H 11.147 -8.433 -8.949 1.00 . A A . 41 HIS HE1 1 1 15 11081 1 1 41 HIS N N 10.041 -8.123 -3.662 1.00 . A A . 41 HIS N 1 1 15 11082 1 1 41 HIS ND1 N 10.046 -7.455 -7.383 1.00 . A A . 41 HIS ND1 1 1 15 11083 1 1 41 HIS NE2 N 9.775 -9.619 -7.803 1.00 . A A . 41 HIS NE2 1 1 15 11084 1 1 41 HIS O O 8.052 -6.461 -2.446 1.00 . A A . 41 HIS O 1 1 15 11085 1 1 42 TRP C C 7.661 -3.259 -2.584 1.00 . A A . 42 TRP C 1 1 15 11086 1 1 42 TRP CA C 8.912 -3.873 -1.983 1.00 . A A . 42 TRP CA 1 1 15 11087 1 1 42 TRP CB C 9.958 -2.856 -1.549 1.00 . A A . 42 TRP CB 1 1 15 11088 1 1 42 TRP CD1 C 11.944 -4.183 -0.743 1.00 . A A . 42 TRP CD1 1 1 15 11089 1 1 42 TRP CD2 C 10.802 -3.232 0.931 1.00 . A A . 42 TRP CD2 1 1 15 11090 1 1 42 TRP CE2 C 11.887 -3.938 1.517 1.00 . A A . 42 TRP CE2 1 1 15 11091 1 1 42 TRP CE3 C 9.852 -2.675 1.811 1.00 . A A . 42 TRP CE3 1 1 15 11092 1 1 42 TRP CG C 10.882 -3.387 -0.512 1.00 . A A . 42 TRP CG 1 1 15 11093 1 1 42 TRP CH2 C 11.092 -3.465 3.753 1.00 . A A . 42 TRP CH2 1 1 15 11094 1 1 42 TRP CZ2 C 12.013 -4.100 2.902 1.00 . A A . 42 TRP CZ2 1 1 15 11095 1 1 42 TRP CZ3 C 10.025 -2.731 3.202 1.00 . A A . 42 TRP CZ3 1 1 15 11096 1 1 42 TRP H H 10.189 -4.439 -3.566 1.00 . A A . 42 TRP H 1 1 15 11097 1 1 42 TRP HA H 8.614 -4.385 -1.081 1.00 . A A . 42 TRP HA 1 1 15 11098 1 1 42 TRP HB2 H 10.532 -2.513 -2.405 1.00 . A A . 42 TRP HB2 1 1 15 11099 1 1 42 TRP HB3 H 9.461 -1.999 -1.111 1.00 . A A . 42 TRP HB3 1 1 15 11100 1 1 42 TRP HD1 H 12.210 -4.568 -1.711 1.00 . A A . 42 TRP HD1 1 1 15 11101 1 1 42 TRP HE1 H 13.394 -5.043 0.559 1.00 . A A . 42 TRP HE1 1 1 15 11102 1 1 42 TRP HE3 H 8.953 -2.254 1.402 1.00 . A A . 42 TRP HE3 1 1 15 11103 1 1 42 TRP HH2 H 11.187 -3.570 4.825 1.00 . A A . 42 TRP HH2 1 1 15 11104 1 1 42 TRP HZ2 H 12.747 -4.795 3.281 1.00 . A A . 42 TRP HZ2 1 1 15 11105 1 1 42 TRP HZ3 H 9.303 -2.234 3.833 1.00 . A A . 42 TRP HZ3 1 1 15 11106 1 1 42 TRP N N 9.496 -4.808 -2.923 1.00 . A A . 42 TRP N 1 1 15 11107 1 1 42 TRP NE1 N 12.575 -4.473 0.447 1.00 . A A . 42 TRP NE1 1 1 15 11108 1 1 42 TRP O O 7.764 -2.451 -3.494 1.00 . A A . 42 TRP O 1 1 15 11109 1 1 43 LYS C C 4.752 -2.077 -1.518 1.00 . A A . 43 LYS C 1 1 15 11110 1 1 43 LYS CA C 5.219 -3.077 -2.561 1.00 . A A . 43 LYS CA 1 1 15 11111 1 1 43 LYS CB C 4.162 -4.176 -2.704 1.00 . A A . 43 LYS CB 1 1 15 11112 1 1 43 LYS CD C 5.383 -5.314 -4.647 1.00 . A A . 43 LYS CD 1 1 15 11113 1 1 43 LYS CE C 4.393 -5.046 -5.802 1.00 . A A . 43 LYS CE 1 1 15 11114 1 1 43 LYS CG C 4.748 -5.471 -3.252 1.00 . A A . 43 LYS CG 1 1 15 11115 1 1 43 LYS H H 6.423 -4.340 -1.378 1.00 . A A . 43 LYS H 1 1 15 11116 1 1 43 LYS HA H 5.337 -2.586 -3.528 1.00 . A A . 43 LYS HA 1 1 15 11117 1 1 43 LYS HB2 H 3.795 -4.412 -1.712 1.00 . A A . 43 LYS HB2 1 1 15 11118 1 1 43 LYS HB3 H 3.317 -3.826 -3.296 1.00 . A A . 43 LYS HB3 1 1 15 11119 1 1 43 LYS HD2 H 6.179 -4.568 -4.643 1.00 . A A . 43 LYS HD2 1 1 15 11120 1 1 43 LYS HD3 H 5.845 -6.278 -4.858 1.00 . A A . 43 LYS HD3 1 1 15 11121 1 1 43 LYS HE2 H 4.910 -5.303 -6.729 1.00 . A A . 43 LYS HE2 1 1 15 11122 1 1 43 LYS HE3 H 3.530 -5.708 -5.712 1.00 . A A . 43 LYS HE3 1 1 15 11123 1 1 43 LYS HG2 H 5.437 -5.846 -2.487 1.00 . A A . 43 LYS HG2 1 1 15 11124 1 1 43 LYS HG3 H 3.987 -6.234 -3.308 1.00 . A A . 43 LYS HG3 1 1 15 11125 1 1 43 LYS HZ1 H 4.373 -3.216 -6.772 1.00 . A A . 43 LYS HZ1 1 1 15 11126 1 1 43 LYS HZ2 H 2.911 -3.620 -6.046 1.00 . A A . 43 LYS HZ2 1 1 15 11127 1 1 43 LYS N N 6.475 -3.649 -2.120 1.00 . A A . 43 LYS N 1 1 15 11128 1 1 43 LYS NZ N 3.936 -3.640 -5.941 1.00 . A A . 43 LYS NZ 1 1 15 11129 1 1 43 LYS O O 4.790 -2.363 -0.321 1.00 . A A . 43 LYS O 1 1 15 11130 1 1 44 CYS C C 2.053 -1.117 -0.950 1.00 . A A . 44 CYS C 1 1 15 11131 1 1 44 CYS CA C 3.261 -0.212 -1.186 1.00 . A A . 44 CYS CA 1 1 15 11132 1 1 44 CYS CB C 2.894 1.074 -1.908 1.00 . A A . 44 CYS CB 1 1 15 11133 1 1 44 CYS H H 4.252 -0.765 -2.967 1.00 . A A . 44 CYS H 1 1 15 11134 1 1 44 CYS HA H 3.690 0.078 -0.236 1.00 . A A . 44 CYS HA 1 1 15 11135 1 1 44 CYS HB2 H 3.744 1.737 -1.757 1.00 . A A . 44 CYS HB2 1 1 15 11136 1 1 44 CYS HB3 H 2.743 0.890 -2.969 1.00 . A A . 44 CYS HB3 1 1 15 11137 1 1 44 CYS N N 4.233 -0.944 -1.975 1.00 . A A . 44 CYS N 1 1 15 11138 1 1 44 CYS O O 1.587 -1.761 -1.890 1.00 . A A . 44 CYS O 1 1 15 11139 1 1 44 CYS SG S 1.410 1.881 -1.277 1.00 . A A . 44 CYS SG 1 1 15 11140 1 1 45 PHE C C -0.585 -0.979 1.307 1.00 . A A . 45 PHE C 1 1 15 11141 1 1 45 PHE CA C 0.392 -1.952 0.671 1.00 . A A . 45 PHE CA 1 1 15 11142 1 1 45 PHE CB C 0.723 -3.063 1.671 1.00 . A A . 45 PHE CB 1 1 15 11143 1 1 45 PHE CD1 C 1.928 -4.782 0.288 1.00 . A A . 45 PHE CD1 1 1 15 11144 1 1 45 PHE CD2 C -0.198 -5.388 1.299 1.00 . A A . 45 PHE CD2 1 1 15 11145 1 1 45 PHE CE1 C 2.030 -6.069 -0.264 1.00 . A A . 45 PHE CE1 1 1 15 11146 1 1 45 PHE CE2 C -0.091 -6.682 0.762 1.00 . A A . 45 PHE CE2 1 1 15 11147 1 1 45 PHE CG C 0.817 -4.444 1.073 1.00 . A A . 45 PHE CG 1 1 15 11148 1 1 45 PHE CZ C 1.022 -7.021 -0.027 1.00 . A A . 45 PHE CZ 1 1 15 11149 1 1 45 PHE H H 2.044 -0.708 1.051 1.00 . A A . 45 PHE H 1 1 15 11150 1 1 45 PHE HA H -0.090 -2.383 -0.208 1.00 . A A . 45 PHE HA 1 1 15 11151 1 1 45 PHE HB2 H 1.668 -2.817 2.139 1.00 . A A . 45 PHE HB2 1 1 15 11152 1 1 45 PHE HB3 H -0.035 -3.091 2.454 1.00 . A A . 45 PHE HB3 1 1 15 11153 1 1 45 PHE HD1 H 2.701 -4.046 0.127 1.00 . A A . 45 PHE HD1 1 1 15 11154 1 1 45 PHE HD2 H -1.080 -5.109 1.856 1.00 . A A . 45 PHE HD2 1 1 15 11155 1 1 45 PHE HE1 H 2.872 -6.324 -0.890 1.00 . A A . 45 PHE HE1 1 1 15 11156 1 1 45 PHE HE2 H -0.876 -7.407 0.928 1.00 . A A . 45 PHE HE2 1 1 15 11157 1 1 45 PHE HZ H 1.086 -7.998 -0.483 1.00 . A A . 45 PHE HZ 1 1 15 11158 1 1 45 PHE N N 1.596 -1.225 0.301 1.00 . A A . 45 PHE N 1 1 15 11159 1 1 45 PHE O O -0.179 0.012 1.911 1.00 . A A . 45 PHE O 1 1 15 11160 1 1 46 CYS C C -3.806 -1.405 2.592 1.00 . A A . 46 CYS C 1 1 15 11161 1 1 46 CYS CA C -2.995 -0.534 1.653 1.00 . A A . 46 CYS CA 1 1 15 11162 1 1 46 CYS CB C -3.844 -0.142 0.446 1.00 . A A . 46 CYS CB 1 1 15 11163 1 1 46 CYS H H -2.100 -2.167 0.711 1.00 . A A . 46 CYS H 1 1 15 11164 1 1 46 CYS HA H -2.691 0.345 2.225 1.00 . A A . 46 CYS HA 1 1 15 11165 1 1 46 CYS HB2 H -4.239 -1.046 -0.010 1.00 . A A . 46 CYS HB2 1 1 15 11166 1 1 46 CYS HB3 H -4.677 0.440 0.813 1.00 . A A . 46 CYS HB3 1 1 15 11167 1 1 46 CYS N N -1.867 -1.307 1.190 1.00 . A A . 46 CYS N 1 1 15 11168 1 1 46 CYS O O -3.772 -2.632 2.507 1.00 . A A . 46 CYS O 1 1 15 11169 1 1 46 CYS SG S -3.024 0.825 -0.848 1.00 . A A . 46 CYS SG 1 1 15 11170 1 1 47 TYR C C -6.533 -0.796 4.753 1.00 . A A . 47 TYR C 1 1 15 11171 1 1 47 TYR CA C -5.132 -1.375 4.665 1.00 . A A . 47 TYR CA 1 1 15 11172 1 1 47 TYR CB C -4.309 -0.976 5.894 1.00 . A A . 47 TYR CB 1 1 15 11173 1 1 47 TYR CD1 C -1.899 -1.385 5.243 1.00 . A A . 47 TYR CD1 1 1 15 11174 1 1 47 TYR CD2 C -2.938 -2.825 6.905 1.00 . A A . 47 TYR CD2 1 1 15 11175 1 1 47 TYR CE1 C -0.755 -2.196 5.251 1.00 . A A . 47 TYR CE1 1 1 15 11176 1 1 47 TYR CE2 C -1.794 -3.629 6.925 1.00 . A A . 47 TYR CE2 1 1 15 11177 1 1 47 TYR CG C -3.014 -1.737 6.022 1.00 . A A . 47 TYR CG 1 1 15 11178 1 1 47 TYR CZ C -0.727 -3.338 6.064 1.00 . A A . 47 TYR CZ 1 1 15 11179 1 1 47 TYR H H -4.444 0.262 3.522 1.00 . A A . 47 TYR H 1 1 15 11180 1 1 47 TYR HA H -5.165 -2.463 4.574 1.00 . A A . 47 TYR HA 1 1 15 11181 1 1 47 TYR HB2 H -4.078 0.080 5.794 1.00 . A A . 47 TYR HB2 1 1 15 11182 1 1 47 TYR HB3 H -4.884 -1.105 6.811 1.00 . A A . 47 TYR HB3 1 1 15 11183 1 1 47 TYR HD1 H -1.936 -0.520 4.602 1.00 . A A . 47 TYR HD1 1 1 15 11184 1 1 47 TYR HD2 H -3.764 -3.065 7.551 1.00 . A A . 47 TYR HD2 1 1 15 11185 1 1 47 TYR HE1 H 0.081 -1.944 4.615 1.00 . A A . 47 TYR HE1 1 1 15 11186 1 1 47 TYR HE2 H -1.765 -4.489 7.579 1.00 . A A . 47 TYR HE2 1 1 15 11187 1 1 47 TYR HH H 0.245 -4.886 6.682 1.00 . A A . 47 TYR HH 1 1 15 11188 1 1 47 TYR N N -4.496 -0.753 3.519 1.00 . A A . 47 TYR N 1 1 15 11189 1 1 47 TYR O O -6.668 0.366 5.127 1.00 . A A . 47 TYR O 1 1 15 11190 1 1 47 TYR OH O 0.330 -4.191 6.022 1.00 . A A . 47 TYR OH 1 1 15 11191 1 1 48 PHE C C -9.609 -1.442 5.667 1.00 . A A . 48 PHE C 1 1 15 11192 1 1 48 PHE CA C -8.916 -1.030 4.368 1.00 . A A . 48 PHE CA 1 1 15 11193 1 1 48 PHE CB C -9.609 -1.671 3.159 1.00 . A A . 48 PHE CB 1 1 15 11194 1 1 48 PHE CD1 C -7.972 -1.141 1.277 1.00 . A A . 48 PHE CD1 1 1 15 11195 1 1 48 PHE CD2 C -10.275 -0.374 1.091 1.00 . A A . 48 PHE CD2 1 1 15 11196 1 1 48 PHE CE1 C -7.669 -0.515 0.056 1.00 . A A . 48 PHE CE1 1 1 15 11197 1 1 48 PHE CE2 C -9.983 0.193 -0.159 1.00 . A A . 48 PHE CE2 1 1 15 11198 1 1 48 PHE CG C -9.274 -1.052 1.814 1.00 . A A . 48 PHE CG 1 1 15 11199 1 1 48 PHE CZ C -8.678 0.139 -0.668 1.00 . A A . 48 PHE CZ 1 1 15 11200 1 1 48 PHE H H -7.467 -2.523 4.128 1.00 . A A . 48 PHE H 1 1 15 11201 1 1 48 PHE HA H -8.954 0.053 4.266 1.00 . A A . 48 PHE HA 1 1 15 11202 1 1 48 PHE HB2 H -9.386 -2.736 3.132 1.00 . A A . 48 PHE HB2 1 1 15 11203 1 1 48 PHE HB3 H -10.675 -1.605 3.314 1.00 . A A . 48 PHE HB3 1 1 15 11204 1 1 48 PHE HD1 H -7.191 -1.672 1.801 1.00 . A A . 48 PHE HD1 1 1 15 11205 1 1 48 PHE HD2 H -11.267 -0.246 1.502 1.00 . A A . 48 PHE HD2 1 1 15 11206 1 1 48 PHE HE1 H -6.662 -0.536 -0.334 1.00 . A A . 48 PHE HE1 1 1 15 11207 1 1 48 PHE HE2 H -10.753 0.725 -0.700 1.00 . A A . 48 PHE HE2 1 1 15 11208 1 1 48 PHE HZ H -8.454 0.634 -1.599 1.00 . A A . 48 PHE HZ 1 1 15 11209 1 1 48 PHE N N -7.566 -1.551 4.369 1.00 . A A . 48 PHE N 1 1 15 11210 1 1 48 PHE O O -9.042 -2.205 6.442 1.00 . A A . 48 PHE O 1 1 15 11211 1 1 49 ASN C C -11.119 -1.548 8.280 1.00 . A A . 49 ASN C 1 1 15 11212 1 1 49 ASN CA C -11.799 -1.355 6.913 1.00 . A A . 49 ASN CA 1 1 15 11213 1 1 49 ASN CB C -12.777 -2.483 6.527 1.00 . A A . 49 ASN CB 1 1 15 11214 1 1 49 ASN CG C -12.197 -3.895 6.566 1.00 . A A . 49 ASN CG 1 1 15 11215 1 1 49 ASN H H -11.227 -0.415 5.105 1.00 . A A . 49 ASN H 1 1 15 11216 1 1 49 ASN HA H -12.418 -0.466 7.034 1.00 . A A . 49 ASN HA 1 1 15 11217 1 1 49 ASN HB2 H -13.611 -2.454 7.227 1.00 . A A . 49 ASN HB2 1 1 15 11218 1 1 49 ASN HB3 H -13.177 -2.290 5.531 1.00 . A A . 49 ASN HB3 1 1 15 11219 1 1 49 ASN HD21 H -11.077 -3.587 4.897 1.00 . A A . 49 ASN HD21 1 1 15 11220 1 1 49 ASN HD22 H -10.917 -5.151 5.690 1.00 . A A . 49 ASN HD22 1 1 15 11221 1 1 49 ASN N N -10.875 -1.031 5.820 1.00 . A A . 49 ASN N 1 1 15 11222 1 1 49 ASN ND2 N -11.353 -4.245 5.603 1.00 . A A . 49 ASN ND2 1 1 15 11223 1 1 49 ASN O O -11.502 -2.431 9.046 1.00 . A A . 49 ASN O 1 1 15 11224 1 1 49 ASN OD1 O -12.530 -4.692 7.440 1.00 . A A . 49 ASN OD1 1 1 15 11225 1 1 50 CYS C C -9.830 -0.707 11.063 1.00 . A A . 50 CYS C 1 1 15 11226 1 1 50 CYS CA C -9.209 -1.037 9.711 1.00 . A A . 50 CYS CA 1 1 15 11227 1 1 50 CYS CB C -7.875 -0.338 9.498 1.00 . A A . 50 CYS CB 1 1 15 11228 1 1 50 CYS H H -9.831 -0.004 7.952 1.00 . A A . 50 CYS H 1 1 15 11229 1 1 50 CYS HA H -8.984 -2.090 9.702 1.00 . A A . 50 CYS HA 1 1 15 11230 1 1 50 CYS HB2 H -7.442 -0.702 8.568 1.00 . A A . 50 CYS HB2 1 1 15 11231 1 1 50 CYS HB3 H -8.087 0.717 9.411 1.00 . A A . 50 CYS HB3 1 1 15 11232 1 1 50 CYS N N -10.108 -0.736 8.601 1.00 . A A . 50 CYS N 1 1 15 11233 1 1 50 CYS O O -10.098 -1.651 11.869 1.00 . A A . 50 CYS O 1 1 15 11234 1 1 50 CYS OXT O -10.076 0.498 11.379 1.00 . A A . 50 CYS OXT 1 1 15 11235 1 1 50 CYS SG S -6.626 -0.524 10.789 1.00 . A A . 50 CYS SG 1 1 16 11236 1 1 1 LEU C C -9.379 -5.589 9.764 1.00 . A A . 1 LEU C 1 1 16 11237 1 1 1 LEU CA C -10.309 -6.152 10.850 1.00 . A A . 1 LEU CA 1 1 16 11238 1 1 1 LEU CB C -11.050 -7.389 10.316 1.00 . A A . 1 LEU CB 1 1 16 11239 1 1 1 LEU CD1 C -12.662 -9.270 10.653 1.00 . A A . 1 LEU CD1 1 1 16 11240 1 1 1 LEU CD2 C -11.277 -8.522 12.594 1.00 . A A . 1 LEU CD2 1 1 16 11241 1 1 1 LEU CG C -12.003 -8.060 11.323 1.00 . A A . 1 LEU CG 1 1 16 11242 1 1 1 LEU H1 H -11.831 -4.796 10.521 1.00 . A A . 1 LEU H1 1 1 16 11243 1 1 1 LEU H2 H -11.871 -5.515 12.040 1.00 . A A . 1 LEU H2 1 1 16 11244 1 1 1 LEU H3 H -10.736 -4.322 11.705 1.00 . A A . 1 LEU H3 1 1 16 11245 1 1 1 LEU HA H -9.696 -6.461 11.695 1.00 . A A . 1 LEU HA 1 1 16 11246 1 1 1 LEU HB2 H -11.632 -7.100 9.439 1.00 . A A . 1 LEU HB2 1 1 16 11247 1 1 1 LEU HB3 H -10.306 -8.123 9.999 1.00 . A A . 1 LEU HB3 1 1 16 11248 1 1 1 LEU HD11 H -13.201 -8.954 9.760 1.00 . A A . 1 LEU HD11 1 1 16 11249 1 1 1 LEU HD12 H -11.906 -10.003 10.373 1.00 . A A . 1 LEU HD12 1 1 16 11250 1 1 1 LEU HD13 H -13.370 -9.733 11.340 1.00 . A A . 1 LEU HD13 1 1 16 11251 1 1 1 LEU HD21 H -10.433 -9.162 12.332 1.00 . A A . 1 LEU HD21 1 1 16 11252 1 1 1 LEU HD22 H -10.920 -7.669 13.169 1.00 . A A . 1 LEU HD22 1 1 16 11253 1 1 1 LEU HD23 H -11.966 -9.089 13.221 1.00 . A A . 1 LEU HD23 1 1 16 11254 1 1 1 LEU HG H -12.796 -7.365 11.604 1.00 . A A . 1 LEU HG 1 1 16 11255 1 1 1 LEU N N -11.259 -5.117 11.314 1.00 . A A . 1 LEU N 1 1 16 11256 1 1 1 LEU O O -9.792 -5.416 8.622 1.00 . A A . 1 LEU O 1 1 16 11257 1 1 2 CYS C C -6.794 -5.296 8.059 1.00 . A A . 2 CYS C 1 1 16 11258 1 1 2 CYS CA C -7.222 -4.490 9.282 1.00 . A A . 2 CYS CA 1 1 16 11259 1 1 2 CYS CB C -6.071 -3.900 10.119 1.00 . A A . 2 CYS CB 1 1 16 11260 1 1 2 CYS H H -7.840 -5.412 11.070 1.00 . A A . 2 CYS H 1 1 16 11261 1 1 2 CYS HA H -7.757 -3.633 8.883 1.00 . A A . 2 CYS HA 1 1 16 11262 1 1 2 CYS HB2 H -5.328 -4.680 10.279 1.00 . A A . 2 CYS HB2 1 1 16 11263 1 1 2 CYS HB3 H -5.600 -3.088 9.571 1.00 . A A . 2 CYS HB3 1 1 16 11264 1 1 2 CYS N N -8.143 -5.246 10.125 1.00 . A A . 2 CYS N 1 1 16 11265 1 1 2 CYS O O -5.791 -6.006 8.071 1.00 . A A . 2 CYS O 1 1 16 11266 1 1 2 CYS SG S -6.540 -3.306 11.775 1.00 . A A . 2 CYS SG 1 1 16 11267 1 1 3 ASN C C -6.200 -5.312 5.056 1.00 . A A . 3 ASN C 1 1 16 11268 1 1 3 ASN CA C -7.417 -5.904 5.753 1.00 . A A . 3 ASN CA 1 1 16 11269 1 1 3 ASN CB C -8.677 -5.755 4.890 1.00 . A A . 3 ASN CB 1 1 16 11270 1 1 3 ASN CG C -8.493 -6.237 3.455 1.00 . A A . 3 ASN CG 1 1 16 11271 1 1 3 ASN H H -8.443 -4.645 7.121 1.00 . A A . 3 ASN H 1 1 16 11272 1 1 3 ASN HA H -7.253 -6.963 5.965 1.00 . A A . 3 ASN HA 1 1 16 11273 1 1 3 ASN HB2 H -9.514 -6.282 5.346 1.00 . A A . 3 ASN HB2 1 1 16 11274 1 1 3 ASN HB3 H -8.919 -4.701 4.829 1.00 . A A . 3 ASN HB3 1 1 16 11275 1 1 3 ASN HD21 H -8.327 -8.157 4.089 1.00 . A A . 3 ASN HD21 1 1 16 11276 1 1 3 ASN HD22 H -8.222 -7.910 2.358 1.00 . A A . 3 ASN HD22 1 1 16 11277 1 1 3 ASN N N -7.581 -5.158 6.988 1.00 . A A . 3 ASN N 1 1 16 11278 1 1 3 ASN ND2 N -8.316 -7.541 3.290 1.00 . A A . 3 ASN ND2 1 1 16 11279 1 1 3 ASN O O -6.318 -4.354 4.289 1.00 . A A . 3 ASN O 1 1 16 11280 1 1 3 ASN OD1 O -8.549 -5.463 2.498 1.00 . A A . 3 ASN OD1 1 1 16 11281 1 1 4 GLU C C -3.750 -6.197 3.409 1.00 . A A . 4 GLU C 1 1 16 11282 1 1 4 GLU CA C -3.760 -5.551 4.793 1.00 . A A . 4 GLU CA 1 1 16 11283 1 1 4 GLU CB C -2.674 -6.114 5.718 1.00 . A A . 4 GLU CB 1 1 16 11284 1 1 4 GLU CD C -0.188 -6.501 6.011 1.00 . A A . 4 GLU CD 1 1 16 11285 1 1 4 GLU CG C -1.291 -6.013 5.080 1.00 . A A . 4 GLU CG 1 1 16 11286 1 1 4 GLU H H -5.019 -6.576 6.102 1.00 . A A . 4 GLU H 1 1 16 11287 1 1 4 GLU HA H -3.639 -4.471 4.726 1.00 . A A . 4 GLU HA 1 1 16 11288 1 1 4 GLU HB2 H -2.687 -5.569 6.662 1.00 . A A . 4 GLU HB2 1 1 16 11289 1 1 4 GLU HB3 H -2.882 -7.167 5.919 1.00 . A A . 4 GLU HB3 1 1 16 11290 1 1 4 GLU HG2 H -1.312 -6.658 4.206 1.00 . A A . 4 GLU HG2 1 1 16 11291 1 1 4 GLU HG3 H -1.094 -4.982 4.780 1.00 . A A . 4 GLU HG3 1 1 16 11292 1 1 4 GLU N N -5.033 -5.864 5.386 1.00 . A A . 4 GLU N 1 1 16 11293 1 1 4 GLU O O -3.995 -7.396 3.290 1.00 . A A . 4 GLU O 1 1 16 11294 1 1 4 GLU OE1 O -0.312 -7.772 6.479 1.00 . A A . 4 GLU OE1 1 1 16 11295 1 1 4 GLU OE2 O 0.743 -5.746 6.290 1.00 . A A . 4 GLU OE2 1 1 16 11296 1 1 5 ARG C C -2.300 -5.105 0.274 1.00 . A A . 5 ARG C 1 1 16 11297 1 1 5 ARG CA C -3.428 -5.861 0.989 1.00 . A A . 5 ARG CA 1 1 16 11298 1 1 5 ARG CB C -4.799 -5.640 0.332 1.00 . A A . 5 ARG CB 1 1 16 11299 1 1 5 ARG CD C -6.440 -3.915 -0.496 1.00 . A A . 5 ARG CD 1 1 16 11300 1 1 5 ARG CG C -5.281 -4.192 0.464 1.00 . A A . 5 ARG CG 1 1 16 11301 1 1 5 ARG CZ C -8.908 -3.774 -0.198 1.00 . A A . 5 ARG CZ 1 1 16 11302 1 1 5 ARG H H -3.293 -4.423 2.534 1.00 . A A . 5 ARG H 1 1 16 11303 1 1 5 ARG HA H -3.201 -6.927 0.972 1.00 . A A . 5 ARG HA 1 1 16 11304 1 1 5 ARG HB2 H -4.727 -5.895 -0.725 1.00 . A A . 5 ARG HB2 1 1 16 11305 1 1 5 ARG HB3 H -5.535 -6.298 0.798 1.00 . A A . 5 ARG HB3 1 1 16 11306 1 1 5 ARG HD2 H -6.443 -2.843 -0.662 1.00 . A A . 5 ARG HD2 1 1 16 11307 1 1 5 ARG HD3 H -6.277 -4.403 -1.460 1.00 . A A . 5 ARG HD3 1 1 16 11308 1 1 5 ARG HG2 H -5.584 -3.987 1.496 1.00 . A A . 5 ARG HG2 1 1 16 11309 1 1 5 ARG HG3 H -4.470 -3.515 0.205 1.00 . A A . 5 ARG HG3 1 1 16 11310 1 1 5 ARG HH11 H -8.223 -2.728 -1.814 1.00 . A A . 5 ARG HH11 1 1 16 11311 1 1 5 ARG HH12 H -9.899 -2.465 -1.430 1.00 . A A . 5 ARG HH12 1 1 16 11312 1 1 5 ARG HH21 H -9.788 -4.625 1.412 1.00 . A A . 5 ARG HH21 1 1 16 11313 1 1 5 ARG HH22 H -10.862 -3.644 0.443 1.00 . A A . 5 ARG HH22 1 1 16 11314 1 1 5 ARG N N -3.477 -5.410 2.371 1.00 . A A . 5 ARG N 1 1 16 11315 1 1 5 ARG NE N -7.722 -4.330 0.086 1.00 . A A . 5 ARG NE 1 1 16 11316 1 1 5 ARG NH1 N -9.038 -2.953 -1.245 1.00 . A A . 5 ARG NH1 1 1 16 11317 1 1 5 ARG NH2 N -9.950 -4.047 0.591 1.00 . A A . 5 ARG NH2 1 1 16 11318 1 1 5 ARG O O -1.944 -4.010 0.717 1.00 . A A . 5 ARG O 1 1 16 11319 1 1 6 PRO C C -0.931 -3.870 -2.291 1.00 . A A . 6 PRO C 1 1 16 11320 1 1 6 PRO CA C -0.547 -5.092 -1.447 1.00 . A A . 6 PRO CA 1 1 16 11321 1 1 6 PRO CB C 0.043 -6.222 -2.298 1.00 . A A . 6 PRO CB 1 1 16 11322 1 1 6 PRO CD C -1.992 -6.993 -1.332 1.00 . A A . 6 PRO CD 1 1 16 11323 1 1 6 PRO CG C -1.178 -7.083 -2.620 1.00 . A A . 6 PRO CG 1 1 16 11324 1 1 6 PRO HA H 0.198 -4.777 -0.717 1.00 . A A . 6 PRO HA 1 1 16 11325 1 1 6 PRO HB2 H 0.548 -5.879 -3.202 1.00 . A A . 6 PRO HB2 1 1 16 11326 1 1 6 PRO HB3 H 0.735 -6.805 -1.688 1.00 . A A . 6 PRO HB3 1 1 16 11327 1 1 6 PRO HD2 H -3.049 -7.127 -1.556 1.00 . A A . 6 PRO HD2 1 1 16 11328 1 1 6 PRO HD3 H -1.654 -7.764 -0.639 1.00 . A A . 6 PRO HD3 1 1 16 11329 1 1 6 PRO HG2 H -1.737 -6.624 -3.438 1.00 . A A . 6 PRO HG2 1 1 16 11330 1 1 6 PRO HG3 H -0.910 -8.109 -2.875 1.00 . A A . 6 PRO HG3 1 1 16 11331 1 1 6 PRO N N -1.695 -5.681 -0.777 1.00 . A A . 6 PRO N 1 1 16 11332 1 1 6 PRO O O -2.094 -3.481 -2.377 1.00 . A A . 6 PRO O 1 1 16 11333 1 1 7 SER C C -1.049 -2.267 -4.872 1.00 . A A . 7 SER C 1 1 16 11334 1 1 7 SER CA C 0.006 -2.114 -3.780 1.00 . A A . 7 SER CA 1 1 16 11335 1 1 7 SER CB C 1.385 -1.905 -4.412 1.00 . A A . 7 SER CB 1 1 16 11336 1 1 7 SER H H 1.011 -3.663 -2.790 1.00 . A A . 7 SER H 1 1 16 11337 1 1 7 SER HA H -0.238 -1.230 -3.192 1.00 . A A . 7 SER HA 1 1 16 11338 1 1 7 SER HB2 H 1.267 -1.214 -5.248 1.00 . A A . 7 SER HB2 1 1 16 11339 1 1 7 SER HB3 H 2.058 -1.466 -3.675 1.00 . A A . 7 SER HB3 1 1 16 11340 1 1 7 SER HG H 1.173 -3.544 -5.384 1.00 . A A . 7 SER HG 1 1 16 11341 1 1 7 SER N N 0.086 -3.283 -2.922 1.00 . A A . 7 SER N 1 1 16 11342 1 1 7 SER O O -0.818 -3.008 -5.825 1.00 . A A . 7 SER O 1 1 16 11343 1 1 7 SER OG O 1.900 -3.143 -4.880 1.00 . A A . 7 SER OG 1 1 16 11344 1 1 8 GLN C C -2.608 -0.252 -6.786 1.00 . A A . 8 GLN C 1 1 16 11345 1 1 8 GLN CA C -3.124 -1.320 -5.811 1.00 . A A . 8 GLN CA 1 1 16 11346 1 1 8 GLN CB C -4.482 -0.960 -5.191 1.00 . A A . 8 GLN CB 1 1 16 11347 1 1 8 GLN CD C -6.600 -1.872 -4.107 1.00 . A A . 8 GLN CD 1 1 16 11348 1 1 8 GLN CG C -5.153 -2.166 -4.512 1.00 . A A . 8 GLN CG 1 1 16 11349 1 1 8 GLN H H -2.264 -0.970 -3.916 1.00 . A A . 8 GLN H 1 1 16 11350 1 1 8 GLN HA H -3.239 -2.248 -6.376 1.00 . A A . 8 GLN HA 1 1 16 11351 1 1 8 GLN HB2 H -4.351 -0.187 -4.440 1.00 . A A . 8 GLN HB2 1 1 16 11352 1 1 8 GLN HB3 H -5.121 -0.582 -5.987 1.00 . A A . 8 GLN HB3 1 1 16 11353 1 1 8 GLN HE21 H -7.108 -1.342 -6.003 1.00 . A A . 8 GLN HE21 1 1 16 11354 1 1 8 GLN HE22 H -8.393 -1.259 -4.820 1.00 . A A . 8 GLN HE22 1 1 16 11355 1 1 8 GLN HG2 H -5.150 -3.010 -5.200 1.00 . A A . 8 GLN HG2 1 1 16 11356 1 1 8 GLN HG3 H -4.580 -2.444 -3.626 1.00 . A A . 8 GLN HG3 1 1 16 11357 1 1 8 GLN N N -2.146 -1.509 -4.759 1.00 . A A . 8 GLN N 1 1 16 11358 1 1 8 GLN NE2 N -7.430 -1.443 -5.053 1.00 . A A . 8 GLN NE2 1 1 16 11359 1 1 8 GLN O O -1.951 -0.590 -7.765 1.00 . A A . 8 GLN O 1 1 16 11360 1 1 8 GLN OE1 O -6.988 -2.037 -2.951 1.00 . A A . 8 GLN OE1 1 1 16 11361 1 1 9 THR C C -1.074 2.306 -7.727 1.00 . A A . 9 THR C 1 1 16 11362 1 1 9 THR CA C -2.566 2.069 -7.531 1.00 . A A . 9 THR CA 1 1 16 11363 1 1 9 THR CB C -3.191 3.405 -7.122 1.00 . A A . 9 THR CB 1 1 16 11364 1 1 9 THR CG2 C -4.691 3.397 -7.405 1.00 . A A . 9 THR CG2 1 1 16 11365 1 1 9 THR H H -3.364 1.308 -5.696 1.00 . A A . 9 THR H 1 1 16 11366 1 1 9 THR HA H -2.986 1.763 -8.492 1.00 . A A . 9 THR HA 1 1 16 11367 1 1 9 THR HB H -2.743 4.197 -7.725 1.00 . A A . 9 THR HB 1 1 16 11368 1 1 9 THR HG1 H -3.589 3.241 -5.218 1.00 . A A . 9 THR HG1 1 1 16 11369 1 1 9 THR HG21 H -5.137 2.471 -7.052 1.00 . A A . 9 THR HG21 1 1 16 11370 1 1 9 THR HG22 H -5.174 4.235 -6.915 1.00 . A A . 9 THR HG22 1 1 16 11371 1 1 9 THR HG23 H -4.851 3.487 -8.479 1.00 . A A . 9 THR HG23 1 1 16 11372 1 1 9 THR N N -2.835 1.042 -6.520 1.00 . A A . 9 THR N 1 1 16 11373 1 1 9 THR O O -0.645 2.692 -8.812 1.00 . A A . 9 THR O 1 1 16 11374 1 1 9 THR OG1 O -2.919 3.677 -5.757 1.00 . A A . 9 THR OG1 1 1 16 11375 1 1 10 TRP C C 1.889 1.628 -7.766 1.00 . A A . 10 TRP C 1 1 16 11376 1 1 10 TRP CA C 1.131 2.398 -6.677 1.00 . A A . 10 TRP CA 1 1 16 11377 1 1 10 TRP CB C 1.651 2.058 -5.280 1.00 . A A . 10 TRP CB 1 1 16 11378 1 1 10 TRP CD1 C 4.139 1.588 -5.425 1.00 . A A . 10 TRP CD1 1 1 16 11379 1 1 10 TRP CD2 C 3.656 3.388 -4.177 1.00 . A A . 10 TRP CD2 1 1 16 11380 1 1 10 TRP CE2 C 5.054 3.159 -4.042 1.00 . A A . 10 TRP CE2 1 1 16 11381 1 1 10 TRP CE3 C 3.126 4.523 -3.535 1.00 . A A . 10 TRP CE3 1 1 16 11382 1 1 10 TRP CG C 3.091 2.327 -4.995 1.00 . A A . 10 TRP CG 1 1 16 11383 1 1 10 TRP CH2 C 5.238 4.963 -2.445 1.00 . A A . 10 TRP CH2 1 1 16 11384 1 1 10 TRP CZ2 C 5.855 3.969 -3.220 1.00 . A A . 10 TRP CZ2 1 1 16 11385 1 1 10 TRP CZ3 C 3.893 5.279 -2.638 1.00 . A A . 10 TRP CZ3 1 1 16 11386 1 1 10 TRP H H -0.714 1.745 -5.833 1.00 . A A . 10 TRP H 1 1 16 11387 1 1 10 TRP HA H 1.232 3.473 -6.846 1.00 . A A . 10 TRP HA 1 1 16 11388 1 1 10 TRP HB2 H 1.063 2.621 -4.556 1.00 . A A . 10 TRP HB2 1 1 16 11389 1 1 10 TRP HB3 H 1.472 1.003 -5.089 1.00 . A A . 10 TRP HB3 1 1 16 11390 1 1 10 TRP HD1 H 4.050 0.719 -6.068 1.00 . A A . 10 TRP HD1 1 1 16 11391 1 1 10 TRP HE1 H 6.239 1.732 -5.074 1.00 . A A . 10 TRP HE1 1 1 16 11392 1 1 10 TRP HE3 H 2.123 4.822 -3.756 1.00 . A A . 10 TRP HE3 1 1 16 11393 1 1 10 TRP HH2 H 5.759 5.494 -1.682 1.00 . A A . 10 TRP HH2 1 1 16 11394 1 1 10 TRP HZ2 H 6.919 3.815 -3.145 1.00 . A A . 10 TRP HZ2 1 1 16 11395 1 1 10 TRP HZ3 H 3.471 6.102 -2.078 1.00 . A A . 10 TRP HZ3 1 1 16 11396 1 1 10 TRP N N -0.279 2.052 -6.691 1.00 . A A . 10 TRP N 1 1 16 11397 1 1 10 TRP NE1 N 5.307 2.087 -4.881 1.00 . A A . 10 TRP NE1 1 1 16 11398 1 1 10 TRP O O 2.882 2.125 -8.292 1.00 . A A . 10 TRP O 1 1 16 11399 1 1 11 SER C C 3.332 -0.382 -9.523 1.00 . A A . 11 SER C 1 1 16 11400 1 1 11 SER CA C 1.822 -0.332 -9.285 1.00 . A A . 11 SER CA 1 1 16 11401 1 1 11 SER CB C 1.103 0.213 -10.529 1.00 . A A . 11 SER CB 1 1 16 11402 1 1 11 SER H H 0.549 0.125 -7.681 1.00 . A A . 11 SER H 1 1 16 11403 1 1 11 SER HA H 1.503 -1.357 -9.104 1.00 . A A . 11 SER HA 1 1 16 11404 1 1 11 SER HB2 H 1.516 1.187 -10.796 1.00 . A A . 11 SER HB2 1 1 16 11405 1 1 11 SER HB3 H 1.265 -0.472 -11.364 1.00 . A A . 11 SER HB3 1 1 16 11406 1 1 11 SER HG H -0.434 1.175 -9.825 1.00 . A A . 11 SER HG 1 1 16 11407 1 1 11 SER N N 1.412 0.428 -8.111 1.00 . A A . 11 SER N 1 1 16 11408 1 1 11 SER O O 3.798 -0.062 -10.613 1.00 . A A . 11 SER O 1 1 16 11409 1 1 11 SER OG O -0.282 0.346 -10.295 1.00 . A A . 11 SER OG 1 1 16 11410 1 1 12 GLY C C 6.223 -1.386 -7.428 1.00 . A A . 12 GLY C 1 1 16 11411 1 1 12 GLY CA C 5.539 -0.951 -8.714 1.00 . A A . 12 GLY CA 1 1 16 11412 1 1 12 GLY H H 3.706 -1.087 -7.643 1.00 . A A . 12 GLY H 1 1 16 11413 1 1 12 GLY HA2 H 5.748 -1.687 -9.492 1.00 . A A . 12 GLY HA2 1 1 16 11414 1 1 12 GLY HA3 H 5.936 0.017 -9.022 1.00 . A A . 12 GLY HA3 1 1 16 11415 1 1 12 GLY N N 4.105 -0.830 -8.532 1.00 . A A . 12 GLY N 1 1 16 11416 1 1 12 GLY O O 5.596 -1.991 -6.547 1.00 . A A . 12 GLY O 1 1 16 11417 1 1 13 ASN C C 8.151 0.005 -5.253 1.00 . A A . 13 ASN C 1 1 16 11418 1 1 13 ASN CA C 8.313 -1.241 -6.138 1.00 . A A . 13 ASN CA 1 1 16 11419 1 1 13 ASN CB C 9.775 -1.513 -6.512 1.00 . A A . 13 ASN CB 1 1 16 11420 1 1 13 ASN CG C 10.587 -1.914 -5.285 1.00 . A A . 13 ASN CG 1 1 16 11421 1 1 13 ASN H H 7.926 -0.527 -8.088 1.00 . A A . 13 ASN H 1 1 16 11422 1 1 13 ASN HA H 7.945 -2.128 -5.633 1.00 . A A . 13 ASN HA 1 1 16 11423 1 1 13 ASN HB2 H 9.812 -2.338 -7.225 1.00 . A A . 13 ASN HB2 1 1 16 11424 1 1 13 ASN HB3 H 10.211 -0.630 -6.983 1.00 . A A . 13 ASN HB3 1 1 16 11425 1 1 13 ASN HD21 H 11.279 -0.011 -5.032 1.00 . A A . 13 ASN HD21 1 1 16 11426 1 1 13 ASN HD22 H 11.768 -1.158 -3.820 1.00 . A A . 13 ASN HD22 1 1 16 11427 1 1 13 ASN N N 7.517 -1.068 -7.338 1.00 . A A . 13 ASN N 1 1 16 11428 1 1 13 ASN ND2 N 11.290 -0.959 -4.687 1.00 . A A . 13 ASN ND2 1 1 16 11429 1 1 13 ASN O O 7.795 1.070 -5.757 1.00 . A A . 13 ASN O 1 1 16 11430 1 1 13 ASN OD1 O 10.562 -3.071 -4.862 1.00 . A A . 13 ASN OD1 1 1 16 11431 1 1 14 CYS C C 9.409 1.236 -2.178 1.00 . A A . 14 CYS C 1 1 16 11432 1 1 14 CYS CA C 8.121 0.918 -2.945 1.00 . A A . 14 CYS CA 1 1 16 11433 1 1 14 CYS CB C 6.970 0.473 -2.026 1.00 . A A . 14 CYS CB 1 1 16 11434 1 1 14 CYS H H 8.596 -1.040 -3.595 1.00 . A A . 14 CYS H 1 1 16 11435 1 1 14 CYS HA H 7.822 1.836 -3.440 1.00 . A A . 14 CYS HA 1 1 16 11436 1 1 14 CYS HB2 H 6.057 0.449 -2.620 1.00 . A A . 14 CYS HB2 1 1 16 11437 1 1 14 CYS HB3 H 7.170 -0.532 -1.661 1.00 . A A . 14 CYS HB3 1 1 16 11438 1 1 14 CYS N N 8.356 -0.120 -3.943 1.00 . A A . 14 CYS N 1 1 16 11439 1 1 14 CYS O O 10.370 0.474 -2.213 1.00 . A A . 14 CYS O 1 1 16 11440 1 1 14 CYS SG S 6.645 1.483 -0.557 1.00 . A A . 14 CYS SG 1 1 16 11441 1 1 15 GLY C C 9.930 3.852 0.358 1.00 . A A . 15 GLY C 1 1 16 11442 1 1 15 GLY CA C 10.479 2.767 -0.563 1.00 . A A . 15 GLY CA 1 1 16 11443 1 1 15 GLY H H 8.593 2.941 -1.497 1.00 . A A . 15 GLY H 1 1 16 11444 1 1 15 GLY HA2 H 10.792 1.913 0.033 1.00 . A A . 15 GLY HA2 1 1 16 11445 1 1 15 GLY HA3 H 11.330 3.157 -1.121 1.00 . A A . 15 GLY HA3 1 1 16 11446 1 1 15 GLY N N 9.430 2.379 -1.493 1.00 . A A . 15 GLY N 1 1 16 11447 1 1 15 GLY O O 9.989 3.761 1.584 1.00 . A A . 15 GLY O 1 1 16 11448 1 1 16 ASN C C 7.478 5.668 1.170 1.00 . A A . 16 ASN C 1 1 16 11449 1 1 16 ASN CA C 8.779 6.021 0.447 1.00 . A A . 16 ASN CA 1 1 16 11450 1 1 16 ASN CB C 8.597 7.187 -0.533 1.00 . A A . 16 ASN CB 1 1 16 11451 1 1 16 ASN CG C 8.330 8.498 0.199 1.00 . A A . 16 ASN CG 1 1 16 11452 1 1 16 ASN H H 9.337 4.879 -1.263 1.00 . A A . 16 ASN H 1 1 16 11453 1 1 16 ASN HA H 9.510 6.341 1.194 1.00 . A A . 16 ASN HA 1 1 16 11454 1 1 16 ASN HB2 H 9.521 7.312 -1.099 1.00 . A A . 16 ASN HB2 1 1 16 11455 1 1 16 ASN HB3 H 7.784 6.989 -1.231 1.00 . A A . 16 ASN HB3 1 1 16 11456 1 1 16 ASN HD21 H 8.973 9.602 -1.389 1.00 . A A . 16 ASN HD21 1 1 16 11457 1 1 16 ASN HD22 H 8.437 10.499 0.016 1.00 . A A . 16 ASN HD22 1 1 16 11458 1 1 16 ASN N N 9.330 4.874 -0.256 1.00 . A A . 16 ASN N 1 1 16 11459 1 1 16 ASN ND2 N 8.578 9.622 -0.461 1.00 . A A . 16 ASN ND2 1 1 16 11460 1 1 16 ASN O O 6.385 6.042 0.740 1.00 . A A . 16 ASN O 1 1 16 11461 1 1 16 ASN OD1 O 7.880 8.503 1.340 1.00 . A A . 16 ASN OD1 1 1 16 11462 1 1 17 THR C C 5.649 5.890 3.531 1.00 . A A . 17 THR C 1 1 16 11463 1 1 17 THR CA C 6.461 4.641 3.153 1.00 . A A . 17 THR CA 1 1 16 11464 1 1 17 THR CB C 6.916 3.820 4.372 1.00 . A A . 17 THR CB 1 1 16 11465 1 1 17 THR CG2 C 7.576 4.654 5.476 1.00 . A A . 17 THR CG2 1 1 16 11466 1 1 17 THR H H 8.522 4.615 2.533 1.00 . A A . 17 THR H 1 1 16 11467 1 1 17 THR HA H 5.833 3.990 2.551 1.00 . A A . 17 THR HA 1 1 16 11468 1 1 17 THR HB H 7.657 3.096 4.036 1.00 . A A . 17 THR HB 1 1 16 11469 1 1 17 THR HG1 H 5.225 3.708 5.333 1.00 . A A . 17 THR HG1 1 1 16 11470 1 1 17 THR HG21 H 8.416 5.216 5.067 1.00 . A A . 17 THR HG21 1 1 16 11471 1 1 17 THR HG22 H 6.863 5.342 5.930 1.00 . A A . 17 THR HG22 1 1 16 11472 1 1 17 THR HG23 H 7.952 3.984 6.251 1.00 . A A . 17 THR HG23 1 1 16 11473 1 1 17 THR N N 7.599 4.980 2.307 1.00 . A A . 17 THR N 1 1 16 11474 1 1 17 THR O O 4.421 5.840 3.633 1.00 . A A . 17 THR O 1 1 16 11475 1 1 17 THR OG1 O 5.822 3.092 4.899 1.00 . A A . 17 THR OG1 1 1 16 11476 1 1 18 ALA C C 4.799 8.775 2.892 1.00 . A A . 18 ALA C 1 1 16 11477 1 1 18 ALA CA C 5.693 8.290 4.033 1.00 . A A . 18 ALA CA 1 1 16 11478 1 1 18 ALA CB C 6.745 9.335 4.420 1.00 . A A . 18 ALA CB 1 1 16 11479 1 1 18 ALA H H 7.334 7.021 3.582 1.00 . A A . 18 ALA H 1 1 16 11480 1 1 18 ALA HA H 5.050 8.133 4.903 1.00 . A A . 18 ALA HA 1 1 16 11481 1 1 18 ALA HB1 H 7.346 8.963 5.250 1.00 . A A . 18 ALA HB1 1 1 16 11482 1 1 18 ALA HB2 H 7.397 9.556 3.577 1.00 . A A . 18 ALA HB2 1 1 16 11483 1 1 18 ALA HB3 H 6.247 10.254 4.733 1.00 . A A . 18 ALA HB3 1 1 16 11484 1 1 18 ALA N N 6.334 7.024 3.713 1.00 . A A . 18 ALA N 1 1 16 11485 1 1 18 ALA O O 3.842 9.506 3.150 1.00 . A A . 18 ALA O 1 1 16 11486 1 1 19 HIS C C 3.079 7.411 0.674 1.00 . A A . 19 HIS C 1 1 16 11487 1 1 19 HIS CA C 4.113 8.528 0.556 1.00 . A A . 19 HIS CA 1 1 16 11488 1 1 19 HIS CB C 4.784 8.510 -0.825 1.00 . A A . 19 HIS CB 1 1 16 11489 1 1 19 HIS CD2 C 2.513 9.048 -2.023 1.00 . A A . 19 HIS CD2 1 1 16 11490 1 1 19 HIS CE1 C 3.101 8.425 -4.038 1.00 . A A . 19 HIS CE1 1 1 16 11491 1 1 19 HIS CG C 3.834 8.665 -1.994 1.00 . A A . 19 HIS CG 1 1 16 11492 1 1 19 HIS H H 5.914 7.835 1.479 1.00 . A A . 19 HIS H 1 1 16 11493 1 1 19 HIS HA H 3.605 9.489 0.655 1.00 . A A . 19 HIS HA 1 1 16 11494 1 1 19 HIS HB2 H 5.516 9.299 -0.895 1.00 . A A . 19 HIS HB2 1 1 16 11495 1 1 19 HIS HB3 H 5.311 7.568 -0.942 1.00 . A A . 19 HIS HB3 1 1 16 11496 1 1 19 HIS HD1 H 5.135 8.087 -3.615 1.00 . A A . 19 HIS HD1 1 1 16 11497 1 1 19 HIS HD2 H 1.913 9.336 -1.164 1.00 . A A . 19 HIS HD2 1 1 16 11498 1 1 19 HIS HE1 H 3.048 8.168 -5.088 1.00 . A A . 19 HIS HE1 1 1 16 11499 1 1 19 HIS N N 5.077 8.389 1.640 1.00 . A A . 19 HIS N 1 1 16 11500 1 1 19 HIS ND1 N 4.219 8.374 -3.296 1.00 . A A . 19 HIS ND1 1 1 16 11501 1 1 19 HIS NE2 N 2.044 8.805 -3.304 1.00 . A A . 19 HIS NE2 1 1 16 11502 1 1 19 HIS O O 1.888 7.704 0.660 1.00 . A A . 19 HIS O 1 1 16 11503 1 1 20 CYS C C 1.402 5.180 1.657 1.00 . A A . 20 CYS C 1 1 16 11504 1 1 20 CYS CA C 2.627 4.982 0.766 1.00 . A A . 20 CYS CA 1 1 16 11505 1 1 20 CYS CB C 3.359 3.730 1.248 1.00 . A A . 20 CYS CB 1 1 16 11506 1 1 20 CYS H H 4.519 5.993 0.790 1.00 . A A . 20 CYS H 1 1 16 11507 1 1 20 CYS HA H 2.289 4.821 -0.256 1.00 . A A . 20 CYS HA 1 1 16 11508 1 1 20 CYS HB2 H 4.213 3.500 0.612 1.00 . A A . 20 CYS HB2 1 1 16 11509 1 1 20 CYS HB3 H 3.702 3.886 2.265 1.00 . A A . 20 CYS HB3 1 1 16 11510 1 1 20 CYS N N 3.516 6.150 0.765 1.00 . A A . 20 CYS N 1 1 16 11511 1 1 20 CYS O O 0.262 4.938 1.254 1.00 . A A . 20 CYS O 1 1 16 11512 1 1 20 CYS SG S 2.262 2.302 1.347 1.00 . A A . 20 CYS SG 1 1 16 11513 1 1 21 ASP C C -0.436 6.893 3.330 1.00 . A A . 21 ASP C 1 1 16 11514 1 1 21 ASP CA C 0.565 5.843 3.829 1.00 . A A . 21 ASP CA 1 1 16 11515 1 1 21 ASP CB C 1.135 6.234 5.192 1.00 . A A . 21 ASP CB 1 1 16 11516 1 1 21 ASP CG C 0.005 6.281 6.207 1.00 . A A . 21 ASP CG 1 1 16 11517 1 1 21 ASP H H 2.606 5.821 3.165 1.00 . A A . 21 ASP H 1 1 16 11518 1 1 21 ASP HA H 0.042 4.888 3.932 1.00 . A A . 21 ASP HA 1 1 16 11519 1 1 21 ASP HB2 H 1.867 5.493 5.513 1.00 . A A . 21 ASP HB2 1 1 16 11520 1 1 21 ASP HB3 H 1.620 7.209 5.137 1.00 . A A . 21 ASP HB3 1 1 16 11521 1 1 21 ASP N N 1.643 5.659 2.878 1.00 . A A . 21 ASP N 1 1 16 11522 1 1 21 ASP O O -1.638 6.719 3.518 1.00 . A A . 21 ASP O 1 1 16 11523 1 1 21 ASP OD1 O -0.365 5.229 6.728 1.00 . A A . 21 ASP OD1 1 1 16 11524 1 1 21 ASP OD2 O -0.546 7.504 6.427 1.00 . A A . 21 ASP OD2 1 1 16 11525 1 1 22 LYS C C -1.622 8.245 0.920 1.00 . A A . 22 LYS C 1 1 16 11526 1 1 22 LYS CA C -0.860 8.928 2.051 1.00 . A A . 22 LYS CA 1 1 16 11527 1 1 22 LYS CB C -0.139 10.154 1.474 1.00 . A A . 22 LYS CB 1 1 16 11528 1 1 22 LYS CD C 1.347 12.116 1.929 1.00 . A A . 22 LYS CD 1 1 16 11529 1 1 22 LYS CE C 2.216 12.869 2.949 1.00 . A A . 22 LYS CE 1 1 16 11530 1 1 22 LYS CG C 0.806 10.787 2.479 1.00 . A A . 22 LYS CG 1 1 16 11531 1 1 22 LYS H H 1.017 7.970 2.410 1.00 . A A . 22 LYS H 1 1 16 11532 1 1 22 LYS HA H -1.523 9.305 2.822 1.00 . A A . 22 LYS HA 1 1 16 11533 1 1 22 LYS HB2 H 0.421 9.889 0.579 1.00 . A A . 22 LYS HB2 1 1 16 11534 1 1 22 LYS HB3 H -0.895 10.888 1.201 1.00 . A A . 22 LYS HB3 1 1 16 11535 1 1 22 LYS HD2 H 1.905 11.940 1.008 1.00 . A A . 22 LYS HD2 1 1 16 11536 1 1 22 LYS HD3 H 0.496 12.757 1.685 1.00 . A A . 22 LYS HD3 1 1 16 11537 1 1 22 LYS HE2 H 2.461 13.855 2.551 1.00 . A A . 22 LYS HE2 1 1 16 11538 1 1 22 LYS HE3 H 1.640 13.008 3.869 1.00 . A A . 22 LYS HE3 1 1 16 11539 1 1 22 LYS HG2 H 0.283 10.943 3.424 1.00 . A A . 22 LYS HG2 1 1 16 11540 1 1 22 LYS HG3 H 1.579 10.041 2.595 1.00 . A A . 22 LYS HG3 1 1 16 11541 1 1 22 LYS HZ1 H 3.340 11.145 3.091 1.00 . A A . 22 LYS HZ1 1 1 16 11542 1 1 22 LYS HZ2 H 4.228 12.508 2.662 1.00 . A A . 22 LYS HZ2 1 1 16 11543 1 1 22 LYS N N 0.039 7.958 2.671 1.00 . A A . 22 LYS N 1 1 16 11544 1 1 22 LYS NZ N 3.469 12.152 3.263 1.00 . A A . 22 LYS NZ 1 1 16 11545 1 1 22 LYS O O -2.844 8.315 0.844 1.00 . A A . 22 LYS O 1 1 16 11546 1 1 23 GLN C C -2.556 6.213 -0.995 1.00 . A A . 23 GLN C 1 1 16 11547 1 1 23 GLN CA C -1.308 7.065 -1.245 1.00 . A A . 23 GLN CA 1 1 16 11548 1 1 23 GLN CB C -0.149 6.238 -1.823 1.00 . A A . 23 GLN CB 1 1 16 11549 1 1 23 GLN CD C -0.409 6.140 -4.343 1.00 . A A . 23 GLN CD 1 1 16 11550 1 1 23 GLN CG C -0.491 5.358 -3.030 1.00 . A A . 23 GLN CG 1 1 16 11551 1 1 23 GLN H H 0.126 7.550 0.238 1.00 . A A . 23 GLN H 1 1 16 11552 1 1 23 GLN HA H -1.552 7.882 -1.925 1.00 . A A . 23 GLN HA 1 1 16 11553 1 1 23 GLN HB2 H 0.716 6.866 -2.021 1.00 . A A . 23 GLN HB2 1 1 16 11554 1 1 23 GLN HB3 H 0.154 5.531 -1.058 1.00 . A A . 23 GLN HB3 1 1 16 11555 1 1 23 GLN HE21 H -1.467 4.723 -5.387 1.00 . A A . 23 GLN HE21 1 1 16 11556 1 1 23 GLN HE22 H -0.814 6.047 -6.320 1.00 . A A . 23 GLN HE22 1 1 16 11557 1 1 23 GLN HG2 H 0.238 4.548 -3.049 1.00 . A A . 23 GLN HG2 1 1 16 11558 1 1 23 GLN HG3 H -1.461 4.893 -2.919 1.00 . A A . 23 GLN HG3 1 1 16 11559 1 1 23 GLN N N -0.863 7.603 0.030 1.00 . A A . 23 GLN N 1 1 16 11560 1 1 23 GLN NE2 N -0.911 5.575 -5.435 1.00 . A A . 23 GLN NE2 1 1 16 11561 1 1 23 GLN O O -3.593 6.405 -1.631 1.00 . A A . 23 GLN O 1 1 16 11562 1 1 23 GLN OE1 O 0.124 7.252 -4.383 1.00 . A A . 23 GLN OE1 1 1 16 11563 1 1 24 CYS C C -4.776 5.063 0.843 1.00 . A A . 24 CYS C 1 1 16 11564 1 1 24 CYS CA C -3.529 4.359 0.298 1.00 . A A . 24 CYS CA 1 1 16 11565 1 1 24 CYS CB C -3.011 3.364 1.338 1.00 . A A . 24 CYS CB 1 1 16 11566 1 1 24 CYS H H -1.562 5.184 0.437 1.00 . A A . 24 CYS H 1 1 16 11567 1 1 24 CYS HA H -3.822 3.825 -0.611 1.00 . A A . 24 CYS HA 1 1 16 11568 1 1 24 CYS HB2 H -2.607 3.915 2.186 1.00 . A A . 24 CYS HB2 1 1 16 11569 1 1 24 CYS HB3 H -3.840 2.757 1.689 1.00 . A A . 24 CYS HB3 1 1 16 11570 1 1 24 CYS N N -2.456 5.286 -0.042 1.00 . A A . 24 CYS N 1 1 16 11571 1 1 24 CYS O O -5.886 4.548 0.705 1.00 . A A . 24 CYS O 1 1 16 11572 1 1 24 CYS SG S -1.752 2.210 0.755 1.00 . A A . 24 CYS SG 1 1 16 11573 1 1 25 GLN C C -6.300 7.907 0.896 1.00 . A A . 25 GLN C 1 1 16 11574 1 1 25 GLN CA C -5.720 7.012 2.003 1.00 . A A . 25 GLN CA 1 1 16 11575 1 1 25 GLN CB C -5.246 7.842 3.204 1.00 . A A . 25 GLN CB 1 1 16 11576 1 1 25 GLN CD C -4.237 7.681 5.551 1.00 . A A . 25 GLN CD 1 1 16 11577 1 1 25 GLN CG C -4.852 6.927 4.374 1.00 . A A . 25 GLN CG 1 1 16 11578 1 1 25 GLN H H -3.683 6.630 1.539 1.00 . A A . 25 GLN H 1 1 16 11579 1 1 25 GLN HA H -6.498 6.342 2.375 1.00 . A A . 25 GLN HA 1 1 16 11580 1 1 25 GLN HB2 H -4.397 8.463 2.920 1.00 . A A . 25 GLN HB2 1 1 16 11581 1 1 25 GLN HB3 H -6.065 8.493 3.517 1.00 . A A . 25 GLN HB3 1 1 16 11582 1 1 25 GLN HE21 H -5.693 9.102 5.511 1.00 . A A . 25 GLN HE21 1 1 16 11583 1 1 25 GLN HE22 H -4.462 9.296 6.743 1.00 . A A . 25 GLN HE22 1 1 16 11584 1 1 25 GLN HG2 H -5.733 6.391 4.728 1.00 . A A . 25 GLN HG2 1 1 16 11585 1 1 25 GLN HG3 H -4.123 6.199 4.023 1.00 . A A . 25 GLN HG3 1 1 16 11586 1 1 25 GLN N N -4.610 6.223 1.482 1.00 . A A . 25 GLN N 1 1 16 11587 1 1 25 GLN NE2 N -4.841 8.798 5.951 1.00 . A A . 25 GLN NE2 1 1 16 11588 1 1 25 GLN O O -7.499 8.187 0.871 1.00 . A A . 25 GLN O 1 1 16 11589 1 1 25 GLN OE1 O -3.220 7.273 6.107 1.00 . A A . 25 GLN OE1 1 1 16 11590 1 1 26 ASP C C -6.367 8.723 -2.272 1.00 . A A . 26 ASP C 1 1 16 11591 1 1 26 ASP CA C -5.767 9.376 -1.030 1.00 . A A . 26 ASP CA 1 1 16 11592 1 1 26 ASP CB C -4.524 10.188 -1.417 1.00 . A A . 26 ASP CB 1 1 16 11593 1 1 26 ASP CG C -3.970 11.065 -0.298 1.00 . A A . 26 ASP CG 1 1 16 11594 1 1 26 ASP H H -4.470 8.113 0.089 1.00 . A A . 26 ASP H 1 1 16 11595 1 1 26 ASP HA H -6.499 10.078 -0.637 1.00 . A A . 26 ASP HA 1 1 16 11596 1 1 26 ASP HB2 H -3.739 9.511 -1.737 1.00 . A A . 26 ASP HB2 1 1 16 11597 1 1 26 ASP HB3 H -4.778 10.840 -2.251 1.00 . A A . 26 ASP HB3 1 1 16 11598 1 1 26 ASP N N -5.442 8.387 -0.011 1.00 . A A . 26 ASP N 1 1 16 11599 1 1 26 ASP O O -7.483 9.063 -2.662 1.00 . A A . 26 ASP O 1 1 16 11600 1 1 26 ASP OD1 O -4.845 11.483 0.654 1.00 . A A . 26 ASP OD1 1 1 16 11601 1 1 26 ASP OD2 O -2.778 11.357 -0.311 1.00 . A A . 26 ASP OD2 1 1 16 11602 1 1 27 TRP C C -7.023 6.122 -3.881 1.00 . A A . 27 TRP C 1 1 16 11603 1 1 27 TRP CA C -5.982 7.198 -4.165 1.00 . A A . 27 TRP CA 1 1 16 11604 1 1 27 TRP CB C -4.755 6.546 -4.812 1.00 . A A . 27 TRP CB 1 1 16 11605 1 1 27 TRP CD1 C -3.075 8.422 -4.757 1.00 . A A . 27 TRP CD1 1 1 16 11606 1 1 27 TRP CD2 C -3.273 7.528 -6.786 1.00 . A A . 27 TRP CD2 1 1 16 11607 1 1 27 TRP CE2 C -2.274 8.537 -6.878 1.00 . A A . 27 TRP CE2 1 1 16 11608 1 1 27 TRP CE3 C -3.578 6.807 -7.951 1.00 . A A . 27 TRP CE3 1 1 16 11609 1 1 27 TRP CG C -3.753 7.468 -5.418 1.00 . A A . 27 TRP CG 1 1 16 11610 1 1 27 TRP CH2 C -1.906 8.046 -9.219 1.00 . A A . 27 TRP CH2 1 1 16 11611 1 1 27 TRP CZ2 C -1.597 8.806 -8.077 1.00 . A A . 27 TRP CZ2 1 1 16 11612 1 1 27 TRP CZ3 C -2.900 7.054 -9.157 1.00 . A A . 27 TRP CZ3 1 1 16 11613 1 1 27 TRP H H -4.740 7.539 -2.470 1.00 . A A . 27 TRP H 1 1 16 11614 1 1 27 TRP HA H -6.387 7.947 -4.848 1.00 . A A . 27 TRP HA 1 1 16 11615 1 1 27 TRP HB2 H -4.227 5.878 -4.142 1.00 . A A . 27 TRP HB2 1 1 16 11616 1 1 27 TRP HB3 H -5.134 5.912 -5.602 1.00 . A A . 27 TRP HB3 1 1 16 11617 1 1 27 TRP HD1 H -3.205 8.604 -3.711 1.00 . A A . 27 TRP HD1 1 1 16 11618 1 1 27 TRP HE1 H -1.593 9.828 -5.344 1.00 . A A . 27 TRP HE1 1 1 16 11619 1 1 27 TRP HE3 H -4.343 6.056 -7.874 1.00 . A A . 27 TRP HE3 1 1 16 11620 1 1 27 TRP HH2 H -1.388 8.222 -10.148 1.00 . A A . 27 TRP HH2 1 1 16 11621 1 1 27 TRP HZ2 H -0.843 9.578 -8.122 1.00 . A A . 27 TRP HZ2 1 1 16 11622 1 1 27 TRP HZ3 H -3.144 6.479 -10.040 1.00 . A A . 27 TRP HZ3 1 1 16 11623 1 1 27 TRP N N -5.612 7.821 -2.902 1.00 . A A . 27 TRP N 1 1 16 11624 1 1 27 TRP NE1 N -2.206 9.072 -5.605 1.00 . A A . 27 TRP NE1 1 1 16 11625 1 1 27 TRP O O -8.112 6.098 -4.447 1.00 . A A . 27 TRP O 1 1 16 11626 1 1 28 GLU C C -8.294 5.058 -1.240 1.00 . A A . 28 GLU C 1 1 16 11627 1 1 28 GLU CA C -7.564 4.284 -2.346 1.00 . A A . 28 GLU CA 1 1 16 11628 1 1 28 GLU CB C -6.740 3.059 -1.897 1.00 . A A . 28 GLU CB 1 1 16 11629 1 1 28 GLU CD C -5.971 2.460 -4.257 1.00 . A A . 28 GLU CD 1 1 16 11630 1 1 28 GLU CG C -6.670 1.983 -2.991 1.00 . A A . 28 GLU CG 1 1 16 11631 1 1 28 GLU H H -5.752 5.367 -2.538 1.00 . A A . 28 GLU H 1 1 16 11632 1 1 28 GLU HA H -8.344 3.965 -3.038 1.00 . A A . 28 GLU HA 1 1 16 11633 1 1 28 GLU HB2 H -5.725 3.367 -1.658 1.00 . A A . 28 GLU HB2 1 1 16 11634 1 1 28 GLU HB3 H -7.137 2.593 -1.000 1.00 . A A . 28 GLU HB3 1 1 16 11635 1 1 28 GLU HG2 H -6.107 1.135 -2.600 1.00 . A A . 28 GLU HG2 1 1 16 11636 1 1 28 GLU HG3 H -7.672 1.640 -3.246 1.00 . A A . 28 GLU HG3 1 1 16 11637 1 1 28 GLU N N -6.650 5.216 -2.979 1.00 . A A . 28 GLU N 1 1 16 11638 1 1 28 GLU O O -8.382 6.281 -1.300 1.00 . A A . 28 GLU O 1 1 16 11639 1 1 28 GLU OE1 O -6.731 3.151 -5.151 1.00 . A A . 28 GLU OE1 1 1 16 11640 1 1 28 GLU OE2 O -4.781 2.190 -4.425 1.00 . A A . 28 GLU OE2 1 1 16 11641 1 1 29 LYS C C -9.412 3.810 1.973 1.00 . A A . 29 LYS C 1 1 16 11642 1 1 29 LYS CA C -9.557 4.881 0.899 1.00 . A A . 29 LYS CA 1 1 16 11643 1 1 29 LYS CB C -11.043 5.092 0.526 1.00 . A A . 29 LYS CB 1 1 16 11644 1 1 29 LYS CD C -11.211 7.632 0.388 1.00 . A A . 29 LYS CD 1 1 16 11645 1 1 29 LYS CE C -10.854 8.791 -0.554 1.00 . A A . 29 LYS CE 1 1 16 11646 1 1 29 LYS CG C -11.367 6.298 -0.366 1.00 . A A . 29 LYS CG 1 1 16 11647 1 1 29 LYS H H -8.609 3.392 -0.150 1.00 . A A . 29 LYS H 1 1 16 11648 1 1 29 LYS HA H -9.069 5.777 1.248 1.00 . A A . 29 LYS HA 1 1 16 11649 1 1 29 LYS HB2 H -11.400 4.188 0.030 1.00 . A A . 29 LYS HB2 1 1 16 11650 1 1 29 LYS HB3 H -11.618 5.214 1.444 1.00 . A A . 29 LYS HB3 1 1 16 11651 1 1 29 LYS HD2 H -12.156 7.852 0.889 1.00 . A A . 29 LYS HD2 1 1 16 11652 1 1 29 LYS HD3 H -10.445 7.554 1.162 1.00 . A A . 29 LYS HD3 1 1 16 11653 1 1 29 LYS HE2 H -11.519 8.785 -1.420 1.00 . A A . 29 LYS HE2 1 1 16 11654 1 1 29 LYS HE3 H -10.984 9.735 -0.022 1.00 . A A . 29 LYS HE3 1 1 16 11655 1 1 29 LYS HG2 H -10.774 6.254 -1.274 1.00 . A A . 29 LYS HG2 1 1 16 11656 1 1 29 LYS HG3 H -12.412 6.213 -0.675 1.00 . A A . 29 LYS HG3 1 1 16 11657 1 1 29 LYS HZ1 H -9.248 7.725 -1.280 1.00 . A A . 29 LYS HZ1 1 1 16 11658 1 1 29 LYS HZ2 H -9.292 9.328 -1.785 1.00 . A A . 29 LYS HZ2 1 1 16 11659 1 1 29 LYS N N -8.779 4.374 -0.210 1.00 . A A . 29 LYS N 1 1 16 11660 1 1 29 LYS NZ N -9.450 8.692 -0.991 1.00 . A A . 29 LYS NZ 1 1 16 11661 1 1 29 LYS O O -10.374 3.312 2.552 1.00 . A A . 29 LYS O 1 1 16 11662 1 1 30 ALA C C -7.780 3.343 4.575 1.00 . A A . 30 ALA C 1 1 16 11663 1 1 30 ALA CA C -7.750 2.559 3.264 1.00 . A A . 30 ALA CA 1 1 16 11664 1 1 30 ALA CB C -6.336 2.073 2.949 1.00 . A A . 30 ALA CB 1 1 16 11665 1 1 30 ALA H H -7.409 3.923 1.689 1.00 . A A . 30 ALA H 1 1 16 11666 1 1 30 ALA HA H -8.437 1.715 3.300 1.00 . A A . 30 ALA HA 1 1 16 11667 1 1 30 ALA HB1 H -6.301 1.691 1.928 1.00 . A A . 30 ALA HB1 1 1 16 11668 1 1 30 ALA HB2 H -5.642 2.906 3.051 1.00 . A A . 30 ALA HB2 1 1 16 11669 1 1 30 ALA HB3 H -6.044 1.283 3.630 1.00 . A A . 30 ALA HB3 1 1 16 11670 1 1 30 ALA N N -8.148 3.445 2.197 1.00 . A A . 30 ALA N 1 1 16 11671 1 1 30 ALA O O -7.762 4.572 4.558 1.00 . A A . 30 ALA O 1 1 16 11672 1 1 31 SER C C -6.068 3.930 6.895 1.00 . A A . 31 SER C 1 1 16 11673 1 1 31 SER CA C -7.454 3.286 6.973 1.00 . A A . 31 SER CA 1 1 16 11674 1 1 31 SER CB C -7.519 2.239 8.078 1.00 . A A . 31 SER CB 1 1 16 11675 1 1 31 SER H H -7.681 1.645 5.738 1.00 . A A . 31 SER H 1 1 16 11676 1 1 31 SER HA H -8.197 4.048 7.193 1.00 . A A . 31 SER HA 1 1 16 11677 1 1 31 SER HB2 H -6.819 1.435 7.879 1.00 . A A . 31 SER HB2 1 1 16 11678 1 1 31 SER HB3 H -7.216 2.722 8.990 1.00 . A A . 31 SER HB3 1 1 16 11679 1 1 31 SER HG H -9.098 1.238 7.450 1.00 . A A . 31 SER HG 1 1 16 11680 1 1 31 SER N N -7.750 2.652 5.717 1.00 . A A . 31 SER N 1 1 16 11681 1 1 31 SER O O -5.885 5.057 7.350 1.00 . A A . 31 SER O 1 1 16 11682 1 1 31 SER OG O -8.829 1.731 8.237 1.00 . A A . 31 SER OG 1 1 16 11683 1 1 32 HIS C C -2.926 2.910 5.174 1.00 . A A . 32 HIS C 1 1 16 11684 1 1 32 HIS CA C -3.737 3.758 6.166 1.00 . A A . 32 HIS CA 1 1 16 11685 1 1 32 HIS CB C -3.063 3.884 7.548 1.00 . A A . 32 HIS CB 1 1 16 11686 1 1 32 HIS CD2 C -2.607 1.482 8.259 1.00 . A A . 32 HIS CD2 1 1 16 11687 1 1 32 HIS CE1 C -0.448 1.465 8.222 1.00 . A A . 32 HIS CE1 1 1 16 11688 1 1 32 HIS CG C -2.190 2.728 7.927 1.00 . A A . 32 HIS CG 1 1 16 11689 1 1 32 HIS H H -5.281 2.313 5.917 1.00 . A A . 32 HIS H 1 1 16 11690 1 1 32 HIS HA H -3.844 4.750 5.725 1.00 . A A . 32 HIS HA 1 1 16 11691 1 1 32 HIS HB2 H -2.474 4.776 7.585 1.00 . A A . 32 HIS HB2 1 1 16 11692 1 1 32 HIS HB3 H -3.809 4.006 8.334 1.00 . A A . 32 HIS HB3 1 1 16 11693 1 1 32 HIS HD1 H -0.201 3.479 7.567 1.00 . A A . 32 HIS HD1 1 1 16 11694 1 1 32 HIS HD2 H -3.633 1.211 8.187 1.00 . A A . 32 HIS HD2 1 1 16 11695 1 1 32 HIS HE1 H 0.552 1.085 8.244 1.00 . A A . 32 HIS HE1 1 1 16 11696 1 1 32 HIS N N -5.081 3.218 6.331 1.00 . A A . 32 HIS N 1 1 16 11697 1 1 32 HIS ND1 N -0.806 2.728 7.913 1.00 . A A . 32 HIS ND1 1 1 16 11698 1 1 32 HIS NE2 N -1.509 0.685 8.474 1.00 . A A . 32 HIS NE2 1 1 16 11699 1 1 32 HIS O O -3.460 1.951 4.609 1.00 . A A . 32 HIS O 1 1 16 11700 1 1 33 GLY C C 0.671 2.302 4.879 1.00 . A A . 33 GLY C 1 1 16 11701 1 1 33 GLY CA C -0.687 2.472 4.198 1.00 . A A . 33 GLY CA 1 1 16 11702 1 1 33 GLY H H -1.252 4.010 5.536 1.00 . A A . 33 GLY H 1 1 16 11703 1 1 33 GLY HA2 H -1.084 1.497 4.017 1.00 . A A . 33 GLY HA2 1 1 16 11704 1 1 33 GLY HA3 H -0.543 2.935 3.228 1.00 . A A . 33 GLY HA3 1 1 16 11705 1 1 33 GLY N N -1.635 3.233 5.007 1.00 . A A . 33 GLY N 1 1 16 11706 1 1 33 GLY O O 0.955 2.986 5.861 1.00 . A A . 33 GLY O 1 1 16 11707 1 1 34 ALA C C 3.658 0.322 3.859 1.00 . A A . 34 ALA C 1 1 16 11708 1 1 34 ALA CA C 2.863 1.166 4.864 1.00 . A A . 34 ALA CA 1 1 16 11709 1 1 34 ALA CB C 2.823 0.501 6.246 1.00 . A A . 34 ALA CB 1 1 16 11710 1 1 34 ALA H H 1.191 0.814 3.596 1.00 . A A . 34 ALA H 1 1 16 11711 1 1 34 ALA HA H 3.347 2.137 4.962 1.00 . A A . 34 ALA HA 1 1 16 11712 1 1 34 ALA HB1 H 2.221 -0.404 6.217 1.00 . A A . 34 ALA HB1 1 1 16 11713 1 1 34 ALA HB2 H 3.831 0.249 6.568 1.00 . A A . 34 ALA HB2 1 1 16 11714 1 1 34 ALA HB3 H 2.391 1.188 6.973 1.00 . A A . 34 ALA HB3 1 1 16 11715 1 1 34 ALA N N 1.502 1.382 4.382 1.00 . A A . 34 ALA N 1 1 16 11716 1 1 34 ALA O O 3.128 -0.633 3.292 1.00 . A A . 34 ALA O 1 1 16 11717 1 1 35 CYS C C 6.231 -1.374 3.339 1.00 . A A . 35 CYS C 1 1 16 11718 1 1 35 CYS CA C 5.809 -0.047 2.706 1.00 . A A . 35 CYS CA 1 1 16 11719 1 1 35 CYS CB C 7.059 0.800 2.450 1.00 . A A . 35 CYS CB 1 1 16 11720 1 1 35 CYS H H 5.318 1.451 4.154 1.00 . A A . 35 CYS H 1 1 16 11721 1 1 35 CYS HA H 5.290 -0.194 1.759 1.00 . A A . 35 CYS HA 1 1 16 11722 1 1 35 CYS HB2 H 6.796 1.838 2.492 1.00 . A A . 35 CYS HB2 1 1 16 11723 1 1 35 CYS HB3 H 7.788 0.626 3.241 1.00 . A A . 35 CYS HB3 1 1 16 11724 1 1 35 CYS N N 4.930 0.666 3.635 1.00 . A A . 35 CYS N 1 1 16 11725 1 1 35 CYS O O 6.506 -1.404 4.540 1.00 . A A . 35 CYS O 1 1 16 11726 1 1 35 CYS SG S 7.901 0.625 0.865 1.00 . A A . 35 CYS SG 1 1 16 11727 1 1 36 HIS C C 7.692 -4.381 1.954 1.00 . A A . 36 HIS C 1 1 16 11728 1 1 36 HIS CA C 6.906 -3.718 3.064 1.00 . A A . 36 HIS CA 1 1 16 11729 1 1 36 HIS CB C 5.897 -4.777 3.477 1.00 . A A . 36 HIS CB 1 1 16 11730 1 1 36 HIS CD2 C 3.504 -4.809 4.330 1.00 . A A . 36 HIS CD2 1 1 16 11731 1 1 36 HIS CE1 C 3.666 -3.304 5.903 1.00 . A A . 36 HIS CE1 1 1 16 11732 1 1 36 HIS CG C 4.776 -4.329 4.347 1.00 . A A . 36 HIS CG 1 1 16 11733 1 1 36 HIS H H 6.011 -2.432 1.609 1.00 . A A . 36 HIS H 1 1 16 11734 1 1 36 HIS HA H 7.542 -3.530 3.925 1.00 . A A . 36 HIS HA 1 1 16 11735 1 1 36 HIS HB2 H 5.468 -5.212 2.574 1.00 . A A . 36 HIS HB2 1 1 16 11736 1 1 36 HIS HB3 H 6.427 -5.578 3.995 1.00 . A A . 36 HIS HB3 1 1 16 11737 1 1 36 HIS HD1 H 5.666 -2.736 5.485 1.00 . A A . 36 HIS HD1 1 1 16 11738 1 1 36 HIS HD2 H 3.184 -5.546 3.606 1.00 . A A . 36 HIS HD2 1 1 16 11739 1 1 36 HIS HE1 H 3.418 -2.638 6.717 1.00 . A A . 36 HIS HE1 1 1 16 11740 1 1 36 HIS N N 6.290 -2.479 2.588 1.00 . A A . 36 HIS N 1 1 16 11741 1 1 36 HIS ND1 N 4.871 -3.351 5.319 1.00 . A A . 36 HIS ND1 1 1 16 11742 1 1 36 HIS NE2 N 2.818 -4.192 5.354 1.00 . A A . 36 HIS NE2 1 1 16 11743 1 1 36 HIS O O 7.207 -4.439 0.829 1.00 . A A . 36 HIS O 1 1 16 11744 1 1 37 LYS C C 8.828 -7.307 1.590 1.00 . A A . 37 LYS C 1 1 16 11745 1 1 37 LYS CA C 9.493 -5.944 1.448 1.00 . A A . 37 LYS CA 1 1 16 11746 1 1 37 LYS CB C 10.974 -5.994 1.804 1.00 . A A . 37 LYS CB 1 1 16 11747 1 1 37 LYS CD C 13.186 -7.140 1.243 1.00 . A A . 37 LYS CD 1 1 16 11748 1 1 37 LYS CE C 14.278 -6.162 0.787 1.00 . A A . 37 LYS CE 1 1 16 11749 1 1 37 LYS CG C 11.785 -6.747 0.749 1.00 . A A . 37 LYS CG 1 1 16 11750 1 1 37 LYS H H 9.071 -4.983 3.288 1.00 . A A . 37 LYS H 1 1 16 11751 1 1 37 LYS HA H 9.437 -5.614 0.420 1.00 . A A . 37 LYS HA 1 1 16 11752 1 1 37 LYS HB2 H 11.337 -4.989 1.831 1.00 . A A . 37 LYS HB2 1 1 16 11753 1 1 37 LYS HB3 H 11.093 -6.415 2.793 1.00 . A A . 37 LYS HB3 1 1 16 11754 1 1 37 LYS HD2 H 13.191 -7.213 2.333 1.00 . A A . 37 LYS HD2 1 1 16 11755 1 1 37 LYS HD3 H 13.407 -8.132 0.850 1.00 . A A . 37 LYS HD3 1 1 16 11756 1 1 37 LYS HE2 H 14.001 -5.701 -0.162 1.00 . A A . 37 LYS HE2 1 1 16 11757 1 1 37 LYS HE3 H 14.369 -5.385 1.545 1.00 . A A . 37 LYS HE3 1 1 16 11758 1 1 37 LYS HG2 H 11.238 -7.650 0.543 1.00 . A A . 37 LYS HG2 1 1 16 11759 1 1 37 LYS HG3 H 11.814 -6.183 -0.185 1.00 . A A . 37 LYS HG3 1 1 16 11760 1 1 37 LYS HZ1 H 15.429 -7.845 0.454 1.00 . A A . 37 LYS HZ1 1 1 16 11761 1 1 37 LYS HZ2 H 16.040 -6.448 -0.254 1.00 . A A . 37 LYS HZ2 1 1 16 11762 1 1 37 LYS N N 8.805 -5.011 2.317 1.00 . A A . 37 LYS N 1 1 16 11763 1 1 37 LYS NZ N 15.580 -6.834 0.583 1.00 . A A . 37 LYS NZ 1 1 16 11764 1 1 37 LYS O O 8.576 -7.768 2.703 1.00 . A A . 37 LYS O 1 1 16 11765 1 1 38 ARG C C 8.289 -9.911 -0.902 1.00 . A A . 38 ARG C 1 1 16 11766 1 1 38 ARG CA C 7.849 -9.218 0.387 1.00 . A A . 38 ARG CA 1 1 16 11767 1 1 38 ARG CB C 6.334 -8.965 0.424 1.00 . A A . 38 ARG CB 1 1 16 11768 1 1 38 ARG CD C 5.567 -11.029 1.651 1.00 . A A . 38 ARG CD 1 1 16 11769 1 1 38 ARG CG C 5.675 -9.501 1.704 1.00 . A A . 38 ARG CG 1 1 16 11770 1 1 38 ARG CZ C 4.771 -12.911 3.066 1.00 . A A . 38 ARG CZ 1 1 16 11771 1 1 38 ARG H H 8.691 -7.436 -0.414 1.00 . A A . 38 ARG H 1 1 16 11772 1 1 38 ARG HA H 8.157 -9.829 1.238 1.00 . A A . 38 ARG HA 1 1 16 11773 1 1 38 ARG HB2 H 6.159 -7.890 0.374 1.00 . A A . 38 ARG HB2 1 1 16 11774 1 1 38 ARG HB3 H 5.867 -9.417 -0.451 1.00 . A A . 38 ARG HB3 1 1 16 11775 1 1 38 ARG HD2 H 4.947 -11.296 0.793 1.00 . A A . 38 ARG HD2 1 1 16 11776 1 1 38 ARG HD3 H 6.563 -11.457 1.534 1.00 . A A . 38 ARG HD3 1 1 16 11777 1 1 38 ARG HG2 H 6.255 -9.185 2.574 1.00 . A A . 38 ARG HG2 1 1 16 11778 1 1 38 ARG HG3 H 4.671 -9.078 1.782 1.00 . A A . 38 ARG HG3 1 1 16 11779 1 1 38 ARG HH11 H 5.568 -13.468 1.260 1.00 . A A . 38 ARG HH11 1 1 16 11780 1 1 38 ARG HH12 H 5.023 -14.785 2.250 1.00 . A A . 38 ARG HH12 1 1 16 11781 1 1 38 ARG HH21 H 3.932 -12.690 4.921 1.00 . A A . 38 ARG HH21 1 1 16 11782 1 1 38 ARG HH22 H 4.071 -14.327 4.375 1.00 . A A . 38 ARG HH22 1 1 16 11783 1 1 38 ARG N N 8.535 -7.937 0.456 1.00 . A A . 38 ARG N 1 1 16 11784 1 1 38 ARG NE N 4.954 -11.594 2.864 1.00 . A A . 38 ARG NE 1 1 16 11785 1 1 38 ARG NH1 N 5.145 -13.792 2.128 1.00 . A A . 38 ARG NH1 1 1 16 11786 1 1 38 ARG NH2 N 4.216 -13.343 4.204 1.00 . A A . 38 ARG NH2 1 1 16 11787 1 1 38 ARG O O 8.256 -9.293 -1.963 1.00 . A A . 38 ARG O 1 1 16 11788 1 1 39 GLU C C 10.530 -10.952 -2.543 1.00 . A A . 39 GLU C 1 1 16 11789 1 1 39 GLU CA C 9.452 -11.849 -1.910 1.00 . A A . 39 GLU CA 1 1 16 11790 1 1 39 GLU CB C 8.440 -12.365 -2.947 1.00 . A A . 39 GLU CB 1 1 16 11791 1 1 39 GLU CD C 6.344 -12.857 -1.572 1.00 . A A . 39 GLU CD 1 1 16 11792 1 1 39 GLU CG C 7.493 -13.436 -2.388 1.00 . A A . 39 GLU CG 1 1 16 11793 1 1 39 GLU H H 8.752 -11.621 0.083 1.00 . A A . 39 GLU H 1 1 16 11794 1 1 39 GLU HA H 9.974 -12.713 -1.495 1.00 . A A . 39 GLU HA 1 1 16 11795 1 1 39 GLU HB2 H 7.866 -11.535 -3.366 1.00 . A A . 39 GLU HB2 1 1 16 11796 1 1 39 GLU HB3 H 9.002 -12.826 -3.761 1.00 . A A . 39 GLU HB3 1 1 16 11797 1 1 39 GLU HG2 H 7.050 -13.973 -3.227 1.00 . A A . 39 GLU HG2 1 1 16 11798 1 1 39 GLU HG3 H 8.053 -14.153 -1.785 1.00 . A A . 39 GLU HG3 1 1 16 11799 1 1 39 GLU N N 8.772 -11.157 -0.813 1.00 . A A . 39 GLU N 1 1 16 11800 1 1 39 GLU O O 10.720 -10.940 -3.755 1.00 . A A . 39 GLU O 1 1 16 11801 1 1 39 GLU OE1 O 5.479 -12.054 -2.247 1.00 . A A . 39 GLU OE1 1 1 16 11802 1 1 39 GLU OE2 O 6.243 -13.128 -0.374 1.00 . A A . 39 GLU OE2 1 1 16 11803 1 1 40 ASN C C 11.738 -8.071 -2.951 1.00 . A A . 40 ASN C 1 1 16 11804 1 1 40 ASN CA C 12.247 -9.211 -2.062 1.00 . A A . 40 ASN CA 1 1 16 11805 1 1 40 ASN CB C 13.432 -9.921 -2.705 1.00 . A A . 40 ASN CB 1 1 16 11806 1 1 40 ASN CG C 14.710 -9.085 -2.637 1.00 . A A . 40 ASN CG 1 1 16 11807 1 1 40 ASN H H 11.090 -10.340 -0.726 1.00 . A A . 40 ASN H 1 1 16 11808 1 1 40 ASN HA H 12.575 -8.767 -1.128 1.00 . A A . 40 ASN HA 1 1 16 11809 1 1 40 ASN HB2 H 13.585 -10.875 -2.210 1.00 . A A . 40 ASN HB2 1 1 16 11810 1 1 40 ASN HB3 H 13.140 -10.128 -3.728 1.00 . A A . 40 ASN HB3 1 1 16 11811 1 1 40 ASN HD21 H 15.281 -9.668 -4.502 1.00 . A A . 40 ASN HD21 1 1 16 11812 1 1 40 ASN HD22 H 16.372 -8.577 -3.675 1.00 . A A . 40 ASN HD22 1 1 16 11813 1 1 40 ASN N N 11.228 -10.184 -1.702 1.00 . A A . 40 ASN N 1 1 16 11814 1 1 40 ASN ND2 N 15.521 -9.116 -3.690 1.00 . A A . 40 ASN ND2 1 1 16 11815 1 1 40 ASN O O 12.533 -7.398 -3.599 1.00 . A A . 40 ASN O 1 1 16 11816 1 1 40 ASN OD1 O 14.984 -8.424 -1.633 1.00 . A A . 40 ASN OD1 1 1 16 11817 1 1 41 HIS C C 9.176 -5.823 -2.645 1.00 . A A . 41 HIS C 1 1 16 11818 1 1 41 HIS CA C 9.803 -6.735 -3.684 1.00 . A A . 41 HIS CA 1 1 16 11819 1 1 41 HIS CB C 8.762 -7.284 -4.655 1.00 . A A . 41 HIS CB 1 1 16 11820 1 1 41 HIS CD2 C 9.394 -9.505 -5.848 1.00 . A A . 41 HIS CD2 1 1 16 11821 1 1 41 HIS CE1 C 10.741 -8.692 -7.360 1.00 . A A . 41 HIS CE1 1 1 16 11822 1 1 41 HIS CG C 9.415 -8.143 -5.712 1.00 . A A . 41 HIS CG 1 1 16 11823 1 1 41 HIS H H 9.796 -8.418 -2.438 1.00 . A A . 41 HIS H 1 1 16 11824 1 1 41 HIS HA H 10.541 -6.189 -4.265 1.00 . A A . 41 HIS HA 1 1 16 11825 1 1 41 HIS HB2 H 8.040 -7.873 -4.086 1.00 . A A . 41 HIS HB2 1 1 16 11826 1 1 41 HIS HB3 H 8.218 -6.457 -5.106 1.00 . A A . 41 HIS HB3 1 1 16 11827 1 1 41 HIS HD1 H 10.470 -6.659 -6.865 1.00 . A A . 41 HIS HD1 1 1 16 11828 1 1 41 HIS HD2 H 8.915 -10.193 -5.168 1.00 . A A . 41 HIS HD2 1 1 16 11829 1 1 41 HIS HE1 H 11.458 -8.629 -8.165 1.00 . A A . 41 HIS HE1 1 1 16 11830 1 1 41 HIS N N 10.426 -7.834 -2.972 1.00 . A A . 41 HIS N 1 1 16 11831 1 1 41 HIS ND1 N 10.236 -7.631 -6.705 1.00 . A A . 41 HIS ND1 1 1 16 11832 1 1 41 HIS NE2 N 10.252 -9.846 -6.875 1.00 . A A . 41 HIS NE2 1 1 16 11833 1 1 41 HIS O O 8.352 -6.278 -1.853 1.00 . A A . 41 HIS O 1 1 16 11834 1 1 42 TRP C C 7.621 -3.177 -2.319 1.00 . A A . 42 TRP C 1 1 16 11835 1 1 42 TRP CA C 8.964 -3.584 -1.746 1.00 . A A . 42 TRP CA 1 1 16 11836 1 1 42 TRP CB C 9.892 -2.399 -1.542 1.00 . A A . 42 TRP CB 1 1 16 11837 1 1 42 TRP CD1 C 12.150 -3.164 -0.692 1.00 . A A . 42 TRP CD1 1 1 16 11838 1 1 42 TRP CD2 C 10.832 -2.343 0.918 1.00 . A A . 42 TRP CD2 1 1 16 11839 1 1 42 TRP CE2 C 12.057 -2.710 1.535 1.00 . A A . 42 TRP CE2 1 1 16 11840 1 1 42 TRP CE3 C 9.787 -1.932 1.763 1.00 . A A . 42 TRP CE3 1 1 16 11841 1 1 42 TRP CG C 10.934 -2.621 -0.503 1.00 . A A . 42 TRP CG 1 1 16 11842 1 1 42 TRP CH2 C 11.184 -2.193 3.732 1.00 . A A . 42 TRP CH2 1 1 16 11843 1 1 42 TRP CZ2 C 12.219 -2.697 2.924 1.00 . A A . 42 TRP CZ2 1 1 16 11844 1 1 42 TRP CZ3 C 9.990 -1.738 3.138 1.00 . A A . 42 TRP CZ3 1 1 16 11845 1 1 42 TRP H H 10.200 -4.204 -3.346 1.00 . A A . 42 TRP H 1 1 16 11846 1 1 42 TRP HA H 8.811 -4.012 -0.770 1.00 . A A . 42 TRP HA 1 1 16 11847 1 1 42 TRP HB2 H 10.360 -2.112 -2.478 1.00 . A A . 42 TRP HB2 1 1 16 11848 1 1 42 TRP HB3 H 9.300 -1.565 -1.185 1.00 . A A . 42 TRP HB3 1 1 16 11849 1 1 42 TRP HD1 H 12.499 -3.553 -1.634 1.00 . A A . 42 TRP HD1 1 1 16 11850 1 1 42 TRP HE1 H 13.759 -3.559 0.654 1.00 . A A . 42 TRP HE1 1 1 16 11851 1 1 42 TRP HE3 H 8.807 -1.824 1.343 1.00 . A A . 42 TRP HE3 1 1 16 11852 1 1 42 TRP HH2 H 11.300 -2.202 4.805 1.00 . A A . 42 TRP HH2 1 1 16 11853 1 1 42 TRP HZ2 H 13.089 -3.176 3.346 1.00 . A A . 42 TRP HZ2 1 1 16 11854 1 1 42 TRP HZ3 H 9.201 -1.254 3.710 1.00 . A A . 42 TRP HZ3 1 1 16 11855 1 1 42 TRP N N 9.585 -4.558 -2.618 1.00 . A A . 42 TRP N 1 1 16 11856 1 1 42 TRP NE1 N 12.836 -3.190 0.504 1.00 . A A . 42 TRP NE1 1 1 16 11857 1 1 42 TRP O O 7.591 -2.599 -3.396 1.00 . A A . 42 TRP O 1 1 16 11858 1 1 43 LYS C C 4.708 -2.009 -1.055 1.00 . A A . 43 LYS C 1 1 16 11859 1 1 43 LYS CA C 5.186 -3.041 -2.070 1.00 . A A . 43 LYS CA 1 1 16 11860 1 1 43 LYS CB C 4.204 -4.214 -2.152 1.00 . A A . 43 LYS CB 1 1 16 11861 1 1 43 LYS CD C 5.645 -5.587 -3.807 1.00 . A A . 43 LYS CD 1 1 16 11862 1 1 43 LYS CE C 4.753 -5.490 -5.064 1.00 . A A . 43 LYS CE 1 1 16 11863 1 1 43 LYS CG C 4.918 -5.533 -2.449 1.00 . A A . 43 LYS CG 1 1 16 11864 1 1 43 LYS H H 6.555 -4.060 -0.823 1.00 . A A . 43 LYS H 1 1 16 11865 1 1 43 LYS HA H 5.231 -2.602 -3.062 1.00 . A A . 43 LYS HA 1 1 16 11866 1 1 43 LYS HB2 H 3.710 -4.319 -1.191 1.00 . A A . 43 LYS HB2 1 1 16 11867 1 1 43 LYS HB3 H 3.425 -4.011 -2.882 1.00 . A A . 43 LYS HB3 1 1 16 11868 1 1 43 LYS HD2 H 6.442 -4.853 -3.879 1.00 . A A . 43 LYS HD2 1 1 16 11869 1 1 43 LYS HD3 H 6.113 -6.570 -3.831 1.00 . A A . 43 LYS HD3 1 1 16 11870 1 1 43 LYS HE2 H 5.339 -5.879 -5.900 1.00 . A A . 43 LYS HE2 1 1 16 11871 1 1 43 LYS HE3 H 3.879 -6.134 -4.946 1.00 . A A . 43 LYS HE3 1 1 16 11872 1 1 43 LYS HG2 H 5.557 -5.730 -1.578 1.00 . A A . 43 LYS HG2 1 1 16 11873 1 1 43 LYS HG3 H 4.226 -6.356 -2.446 1.00 . A A . 43 LYS HG3 1 1 16 11874 1 1 43 LYS HZ1 H 4.735 -3.860 -6.343 1.00 . A A . 43 LYS HZ1 1 1 16 11875 1 1 43 LYS HZ2 H 3.296 -4.084 -5.502 1.00 . A A . 43 LYS HZ2 1 1 16 11876 1 1 43 LYS N N 6.506 -3.490 -1.661 1.00 . A A . 43 LYS N 1 1 16 11877 1 1 43 LYS NZ N 4.323 -4.116 -5.434 1.00 . A A . 43 LYS NZ 1 1 16 11878 1 1 43 LYS O O 4.937 -2.167 0.143 1.00 . A A . 43 LYS O 1 1 16 11879 1 1 44 CYS C C 1.956 -0.901 -0.319 1.00 . A A . 44 CYS C 1 1 16 11880 1 1 44 CYS CA C 3.221 -0.128 -0.669 1.00 . A A . 44 CYS CA 1 1 16 11881 1 1 44 CYS CB C 2.892 1.178 -1.387 1.00 . A A . 44 CYS CB 1 1 16 11882 1 1 44 CYS H H 3.892 -0.886 -2.527 1.00 . A A . 44 CYS H 1 1 16 11883 1 1 44 CYS HA H 3.765 0.114 0.239 1.00 . A A . 44 CYS HA 1 1 16 11884 1 1 44 CYS HB2 H 3.790 1.793 -1.385 1.00 . A A . 44 CYS HB2 1 1 16 11885 1 1 44 CYS HB3 H 2.583 0.979 -2.413 1.00 . A A . 44 CYS HB3 1 1 16 11886 1 1 44 CYS N N 4.022 -0.975 -1.532 1.00 . A A . 44 CYS N 1 1 16 11887 1 1 44 CYS O O 1.099 -1.065 -1.179 1.00 . A A . 44 CYS O 1 1 16 11888 1 1 44 CYS SG S 1.562 2.100 -0.593 1.00 . A A . 44 CYS SG 1 1 16 11889 1 1 45 PHE C C -0.328 -1.120 1.908 1.00 . A A . 45 PHE C 1 1 16 11890 1 1 45 PHE CA C 0.664 -2.134 1.346 1.00 . A A . 45 PHE CA 1 1 16 11891 1 1 45 PHE CB C 1.020 -3.183 2.404 1.00 . A A . 45 PHE CB 1 1 16 11892 1 1 45 PHE CD1 C 2.732 -4.658 1.258 1.00 . A A . 45 PHE CD1 1 1 16 11893 1 1 45 PHE CD2 C 0.610 -5.635 1.933 1.00 . A A . 45 PHE CD2 1 1 16 11894 1 1 45 PHE CE1 C 3.176 -5.924 0.835 1.00 . A A . 45 PHE CE1 1 1 16 11895 1 1 45 PHE CE2 C 1.034 -6.890 1.465 1.00 . A A . 45 PHE CE2 1 1 16 11896 1 1 45 PHE CG C 1.462 -4.519 1.845 1.00 . A A . 45 PHE CG 1 1 16 11897 1 1 45 PHE CZ C 2.322 -7.036 0.922 1.00 . A A . 45 PHE CZ 1 1 16 11898 1 1 45 PHE H H 2.554 -1.206 1.606 1.00 . A A . 45 PHE H 1 1 16 11899 1 1 45 PHE HA H 0.205 -2.642 0.497 1.00 . A A . 45 PHE HA 1 1 16 11900 1 1 45 PHE HB2 H 1.788 -2.778 3.060 1.00 . A A . 45 PHE HB2 1 1 16 11901 1 1 45 PHE HB3 H 0.146 -3.362 3.028 1.00 . A A . 45 PHE HB3 1 1 16 11902 1 1 45 PHE HD1 H 3.387 -3.802 1.189 1.00 . A A . 45 PHE HD1 1 1 16 11903 1 1 45 PHE HD2 H -0.383 -5.531 2.347 1.00 . A A . 45 PHE HD2 1 1 16 11904 1 1 45 PHE HE1 H 4.175 -6.042 0.444 1.00 . A A . 45 PHE HE1 1 1 16 11905 1 1 45 PHE HE2 H 0.371 -7.740 1.526 1.00 . A A . 45 PHE HE2 1 1 16 11906 1 1 45 PHE HZ H 2.648 -8.002 0.566 1.00 . A A . 45 PHE HZ 1 1 16 11907 1 1 45 PHE N N 1.857 -1.429 0.903 1.00 . A A . 45 PHE N 1 1 16 11908 1 1 45 PHE O O 0.076 -0.120 2.500 1.00 . A A . 45 PHE O 1 1 16 11909 1 1 46 CYS C C -3.556 -1.456 3.168 1.00 . A A . 46 CYS C 1 1 16 11910 1 1 46 CYS CA C -2.732 -0.610 2.214 1.00 . A A . 46 CYS CA 1 1 16 11911 1 1 46 CYS CB C -3.604 -0.208 1.026 1.00 . A A . 46 CYS CB 1 1 16 11912 1 1 46 CYS H H -1.863 -2.281 1.295 1.00 . A A . 46 CYS H 1 1 16 11913 1 1 46 CYS HA H -2.410 0.267 2.781 1.00 . A A . 46 CYS HA 1 1 16 11914 1 1 46 CYS HB2 H -3.990 -1.116 0.568 1.00 . A A . 46 CYS HB2 1 1 16 11915 1 1 46 CYS HB3 H -4.442 0.352 1.423 1.00 . A A . 46 CYS HB3 1 1 16 11916 1 1 46 CYS N N -1.617 -1.407 1.746 1.00 . A A . 46 CYS N 1 1 16 11917 1 1 46 CYS O O -3.551 -2.682 3.075 1.00 . A A . 46 CYS O 1 1 16 11918 1 1 46 CYS SG S -2.858 0.794 -0.285 1.00 . A A . 46 CYS SG 1 1 16 11919 1 1 47 TYR C C -6.271 -0.884 5.381 1.00 . A A . 47 TYR C 1 1 16 11920 1 1 47 TYR CA C -4.844 -1.396 5.267 1.00 . A A . 47 TYR CA 1 1 16 11921 1 1 47 TYR CB C -4.014 -0.948 6.471 1.00 . A A . 47 TYR CB 1 1 16 11922 1 1 47 TYR CD1 C -1.581 -1.197 5.833 1.00 . A A . 47 TYR CD1 1 1 16 11923 1 1 47 TYR CD2 C -2.533 -2.700 7.500 1.00 . A A . 47 TYR CD2 1 1 16 11924 1 1 47 TYR CE1 C -0.327 -1.800 6.006 1.00 . A A . 47 TYR CE1 1 1 16 11925 1 1 47 TYR CE2 C -1.270 -3.266 7.708 1.00 . A A . 47 TYR CE2 1 1 16 11926 1 1 47 TYR CG C -2.678 -1.634 6.596 1.00 . A A . 47 TYR CG 1 1 16 11927 1 1 47 TYR CZ C -0.168 -2.800 6.976 1.00 . A A . 47 TYR CZ 1 1 16 11928 1 1 47 TYR H H -4.156 0.227 4.094 1.00 . A A . 47 TYR H 1 1 16 11929 1 1 47 TYR HA H -4.858 -2.481 5.196 1.00 . A A . 47 TYR HA 1 1 16 11930 1 1 47 TYR HB2 H -3.839 0.118 6.346 1.00 . A A . 47 TYR HB2 1 1 16 11931 1 1 47 TYR HB3 H -4.542 -1.077 7.413 1.00 . A A . 47 TYR HB3 1 1 16 11932 1 1 47 TYR HD1 H -1.694 -0.394 5.123 1.00 . A A . 47 TYR HD1 1 1 16 11933 1 1 47 TYR HD2 H -3.384 -3.069 8.054 1.00 . A A . 47 TYR HD2 1 1 16 11934 1 1 47 TYR HE1 H 0.496 -1.504 5.375 1.00 . A A . 47 TYR HE1 1 1 16 11935 1 1 47 TYR HE2 H -1.152 -4.056 8.437 1.00 . A A . 47 TYR HE2 1 1 16 11936 1 1 47 TYR HH H 0.971 -4.231 7.560 1.00 . A A . 47 TYR HH 1 1 16 11937 1 1 47 TYR N N -4.229 -0.787 4.100 1.00 . A A . 47 TYR N 1 1 16 11938 1 1 47 TYR O O -6.469 0.255 5.797 1.00 . A A . 47 TYR O 1 1 16 11939 1 1 47 TYR OH O 1.058 -3.334 7.211 1.00 . A A . 47 TYR OH 1 1 16 11940 1 1 48 PHE C C -9.507 -1.273 5.961 1.00 . A A . 48 PHE C 1 1 16 11941 1 1 48 PHE CA C -8.594 -1.194 4.740 1.00 . A A . 48 PHE CA 1 1 16 11942 1 1 48 PHE CB C -9.152 -1.926 3.518 1.00 . A A . 48 PHE CB 1 1 16 11943 1 1 48 PHE CD1 C -7.512 -1.269 1.707 1.00 . A A . 48 PHE CD1 1 1 16 11944 1 1 48 PHE CD2 C -9.832 -0.553 1.508 1.00 . A A . 48 PHE CD2 1 1 16 11945 1 1 48 PHE CE1 C -7.216 -0.630 0.492 1.00 . A A . 48 PHE CE1 1 1 16 11946 1 1 48 PHE CE2 C -9.541 0.057 0.278 1.00 . A A . 48 PHE CE2 1 1 16 11947 1 1 48 PHE CG C -8.826 -1.240 2.210 1.00 . A A . 48 PHE CG 1 1 16 11948 1 1 48 PHE CZ C -8.238 -0.011 -0.242 1.00 . A A . 48 PHE CZ 1 1 16 11949 1 1 48 PHE H H -7.058 -2.642 4.695 1.00 . A A . 48 PHE H 1 1 16 11950 1 1 48 PHE HA H -8.544 -0.140 4.481 1.00 . A A . 48 PHE HA 1 1 16 11951 1 1 48 PHE HB2 H -8.784 -2.948 3.467 1.00 . A A . 48 PHE HB2 1 1 16 11952 1 1 48 PHE HB3 H -10.227 -1.981 3.622 1.00 . A A . 48 PHE HB3 1 1 16 11953 1 1 48 PHE HD1 H -6.729 -1.779 2.250 1.00 . A A . 48 PHE HD1 1 1 16 11954 1 1 48 PHE HD2 H -10.832 -0.468 1.914 1.00 . A A . 48 PHE HD2 1 1 16 11955 1 1 48 PHE HE1 H -6.215 -0.634 0.097 1.00 . A A . 48 PHE HE1 1 1 16 11956 1 1 48 PHE HE2 H -10.315 0.585 -0.261 1.00 . A A . 48 PHE HE2 1 1 16 11957 1 1 48 PHE HZ H -8.024 0.408 -1.210 1.00 . A A . 48 PHE HZ 1 1 16 11958 1 1 48 PHE N N -7.262 -1.698 5.013 1.00 . A A . 48 PHE N 1 1 16 11959 1 1 48 PHE O O -9.736 -0.272 6.632 1.00 . A A . 48 PHE O 1 1 16 11960 1 1 49 ASN C C -11.001 -2.664 8.524 1.00 . A A . 49 ASN C 1 1 16 11961 1 1 49 ASN CA C -11.277 -2.657 7.014 1.00 . A A . 49 ASN CA 1 1 16 11962 1 1 49 ASN CB C -11.917 -3.977 6.541 1.00 . A A . 49 ASN CB 1 1 16 11963 1 1 49 ASN CG C -12.290 -3.932 5.062 1.00 . A A . 49 ASN CG 1 1 16 11964 1 1 49 ASN H H -9.744 -3.235 5.691 1.00 . A A . 49 ASN H 1 1 16 11965 1 1 49 ASN HA H -11.973 -1.843 6.806 1.00 . A A . 49 ASN HA 1 1 16 11966 1 1 49 ASN HB2 H -11.207 -4.794 6.668 1.00 . A A . 49 ASN HB2 1 1 16 11967 1 1 49 ASN HB3 H -12.808 -4.207 7.126 1.00 . A A . 49 ASN HB3 1 1 16 11968 1 1 49 ASN HD21 H -14.222 -3.427 5.468 1.00 . A A . 49 ASN HD21 1 1 16 11969 1 1 49 ASN HD22 H -13.806 -3.588 3.773 1.00 . A A . 49 ASN HD22 1 1 16 11970 1 1 49 ASN N N -10.048 -2.458 6.245 1.00 . A A . 49 ASN N 1 1 16 11971 1 1 49 ASN ND2 N -13.541 -3.617 4.746 1.00 . A A . 49 ASN ND2 1 1 16 11972 1 1 49 ASN O O -11.619 -3.408 9.285 1.00 . A A . 49 ASN O 1 1 16 11973 1 1 49 ASN OD1 O -11.442 -4.169 4.203 1.00 . A A . 49 ASN OD1 1 1 16 11974 1 1 50 CYS C C -10.300 -1.605 11.413 1.00 . A A . 50 CYS C 1 1 16 11975 1 1 50 CYS CA C -9.375 -1.925 10.249 1.00 . A A . 50 CYS CA 1 1 16 11976 1 1 50 CYS CB C -8.103 -1.090 10.212 1.00 . A A . 50 CYS CB 1 1 16 11977 1 1 50 CYS H H -9.660 -1.214 8.256 1.00 . A A . 50 CYS H 1 1 16 11978 1 1 50 CYS HA H -9.057 -2.933 10.418 1.00 . A A . 50 CYS HA 1 1 16 11979 1 1 50 CYS HB2 H -7.552 -1.349 9.310 1.00 . A A . 50 CYS HB2 1 1 16 11980 1 1 50 CYS HB3 H -8.402 -0.053 10.153 1.00 . A A . 50 CYS HB3 1 1 16 11981 1 1 50 CYS N N -10.034 -1.852 8.949 1.00 . A A . 50 CYS N 1 1 16 11982 1 1 50 CYS O O -10.712 -2.568 12.132 1.00 . A A . 50 CYS O 1 1 16 11983 1 1 50 CYS OXT O -10.650 -0.409 11.660 1.00 . A A . 50 CYS OXT 1 1 16 11984 1 1 50 CYS SG S -6.929 -1.262 11.576 1.00 . A A . 50 CYS SG 1 1 17 11985 1 1 1 LEU C C -9.741 -4.923 9.705 1.00 . A A . 1 LEU C 1 1 17 11986 1 1 1 LEU CA C -10.555 -5.125 10.978 1.00 . A A . 1 LEU CA 1 1 17 11987 1 1 1 LEU CB C -10.807 -6.619 11.239 1.00 . A A . 1 LEU CB 1 1 17 11988 1 1 1 LEU CD1 C -8.670 -7.010 12.578 1.00 . A A . 1 LEU CD1 1 1 17 11989 1 1 1 LEU CD2 C -9.910 -8.930 11.572 1.00 . A A . 1 LEU CD2 1 1 17 11990 1 1 1 LEU CG C -9.526 -7.458 11.385 1.00 . A A . 1 LEU CG 1 1 17 11991 1 1 1 LEU H1 H -12.340 -4.774 10.005 1.00 . A A . 1 LEU H1 1 1 17 11992 1 1 1 LEU H2 H -12.403 -4.519 11.667 1.00 . A A . 1 LEU H2 1 1 17 11993 1 1 1 LEU H3 H -11.641 -3.397 10.671 1.00 . A A . 1 LEU H3 1 1 17 11994 1 1 1 LEU HA H -10.035 -4.692 11.833 1.00 . A A . 1 LEU HA 1 1 17 11995 1 1 1 LEU HB2 H -11.397 -6.722 12.151 1.00 . A A . 1 LEU HB2 1 1 17 11996 1 1 1 LEU HB3 H -11.387 -7.022 10.408 1.00 . A A . 1 LEU HB3 1 1 17 11997 1 1 1 LEU HD11 H -9.266 -7.021 13.492 1.00 . A A . 1 LEU HD11 1 1 17 11998 1 1 1 LEU HD12 H -7.828 -7.692 12.699 1.00 . A A . 1 LEU HD12 1 1 17 11999 1 1 1 LEU HD13 H -8.273 -6.009 12.418 1.00 . A A . 1 LEU HD13 1 1 17 12000 1 1 1 LEU HD21 H -10.496 -9.272 10.717 1.00 . A A . 1 LEU HD21 1 1 17 12001 1 1 1 LEU HD22 H -9.012 -9.543 11.645 1.00 . A A . 1 LEU HD22 1 1 17 12002 1 1 1 LEU HD23 H -10.500 -9.054 12.481 1.00 . A A . 1 LEU HD23 1 1 17 12003 1 1 1 LEU HG H -8.925 -7.387 10.477 1.00 . A A . 1 LEU HG 1 1 17 12004 1 1 1 LEU N N -11.831 -4.399 10.818 1.00 . A A . 1 LEU N 1 1 17 12005 1 1 1 LEU O O -10.335 -4.995 8.634 1.00 . A A . 1 LEU O 1 1 17 12006 1 1 2 CYS C C -7.601 -5.105 7.512 1.00 . A A . 2 CYS C 1 1 17 12007 1 1 2 CYS CA C -7.736 -4.071 8.633 1.00 . A A . 2 CYS CA 1 1 17 12008 1 1 2 CYS CB C -6.387 -3.416 8.962 1.00 . A A . 2 CYS CB 1 1 17 12009 1 1 2 CYS H H -7.982 -4.496 10.683 1.00 . A A . 2 CYS H 1 1 17 12010 1 1 2 CYS HA H -8.345 -3.256 8.251 1.00 . A A . 2 CYS HA 1 1 17 12011 1 1 2 CYS HB2 H -5.636 -4.204 9.014 1.00 . A A . 2 CYS HB2 1 1 17 12012 1 1 2 CYS HB3 H -6.152 -2.794 8.109 1.00 . A A . 2 CYS HB3 1 1 17 12013 1 1 2 CYS N N -8.450 -4.573 9.794 1.00 . A A . 2 CYS N 1 1 17 12014 1 1 2 CYS O O -6.814 -6.046 7.604 1.00 . A A . 2 CYS O 1 1 17 12015 1 1 2 CYS SG S -6.088 -2.388 10.434 1.00 . A A . 2 CYS SG 1 1 17 12016 1 1 3 ASN C C -6.913 -5.177 4.510 1.00 . A A . 3 ASN C 1 1 17 12017 1 1 3 ASN CA C -8.200 -5.642 5.185 1.00 . A A . 3 ASN CA 1 1 17 12018 1 1 3 ASN CB C -9.427 -5.392 4.292 1.00 . A A . 3 ASN CB 1 1 17 12019 1 1 3 ASN CG C -9.226 -5.870 2.857 1.00 . A A . 3 ASN CG 1 1 17 12020 1 1 3 ASN H H -8.934 -4.072 6.411 1.00 . A A . 3 ASN H 1 1 17 12021 1 1 3 ASN HA H -8.139 -6.710 5.404 1.00 . A A . 3 ASN HA 1 1 17 12022 1 1 3 ASN HB2 H -10.297 -5.892 4.717 1.00 . A A . 3 ASN HB2 1 1 17 12023 1 1 3 ASN HB3 H -9.618 -4.323 4.263 1.00 . A A . 3 ASN HB3 1 1 17 12024 1 1 3 ASN HD21 H -8.829 -7.769 3.476 1.00 . A A . 3 ASN HD21 1 1 17 12025 1 1 3 ASN HD22 H -8.773 -7.500 1.750 1.00 . A A . 3 ASN HD22 1 1 17 12026 1 1 3 ASN N N -8.329 -4.885 6.417 1.00 . A A . 3 ASN N 1 1 17 12027 1 1 3 ASN ND2 N -8.907 -7.149 2.685 1.00 . A A . 3 ASN ND2 1 1 17 12028 1 1 3 ASN O O -6.931 -4.266 3.682 1.00 . A A . 3 ASN O 1 1 17 12029 1 1 3 ASN OD1 O -9.365 -5.108 1.901 1.00 . A A . 3 ASN OD1 1 1 17 12030 1 1 4 GLU C C -4.462 -6.233 2.968 1.00 . A A . 4 GLU C 1 1 17 12031 1 1 4 GLU CA C -4.482 -5.575 4.347 1.00 . A A . 4 GLU CA 1 1 17 12032 1 1 4 GLU CB C -3.471 -6.219 5.309 1.00 . A A . 4 GLU CB 1 1 17 12033 1 1 4 GLU CD C -1.075 -6.918 5.718 1.00 . A A . 4 GLU CD 1 1 17 12034 1 1 4 GLU CG C -2.056 -6.291 4.732 1.00 . A A . 4 GLU CG 1 1 17 12035 1 1 4 GLU H H -5.862 -6.505 5.621 1.00 . A A . 4 GLU H 1 1 17 12036 1 1 4 GLU HA H -4.275 -4.511 4.268 1.00 . A A . 4 GLU HA 1 1 17 12037 1 1 4 GLU HB2 H -3.460 -5.663 6.246 1.00 . A A . 4 GLU HB2 1 1 17 12038 1 1 4 GLU HB3 H -3.789 -7.241 5.523 1.00 . A A . 4 GLU HB3 1 1 17 12039 1 1 4 GLU HG2 H -2.117 -6.933 3.859 1.00 . A A . 4 GLU HG2 1 1 17 12040 1 1 4 GLU HG3 H -1.691 -5.305 4.438 1.00 . A A . 4 GLU HG3 1 1 17 12041 1 1 4 GLU N N -5.800 -5.799 4.900 1.00 . A A . 4 GLU N 1 1 17 12042 1 1 4 GLU O O -4.822 -7.402 2.841 1.00 . A A . 4 GLU O 1 1 17 12043 1 1 4 GLU OE1 O -1.273 -8.229 6.011 1.00 . A A . 4 GLU OE1 1 1 17 12044 1 1 4 GLU OE2 O -0.173 -6.228 6.192 1.00 . A A . 4 GLU OE2 1 1 17 12045 1 1 5 ARG C C -2.841 -5.259 -0.160 1.00 . A A . 5 ARG C 1 1 17 12046 1 1 5 ARG CA C -3.991 -5.967 0.571 1.00 . A A . 5 ARG CA 1 1 17 12047 1 1 5 ARG CB C -5.349 -5.749 -0.111 1.00 . A A . 5 ARG CB 1 1 17 12048 1 1 5 ARG CD C -6.933 -4.054 -1.076 1.00 . A A . 5 ARG CD 1 1 17 12049 1 1 5 ARG CG C -5.816 -4.291 -0.056 1.00 . A A . 5 ARG CG 1 1 17 12050 1 1 5 ARG CZ C -9.387 -3.715 -0.984 1.00 . A A . 5 ARG CZ 1 1 17 12051 1 1 5 ARG H H -3.790 -4.517 2.099 1.00 . A A . 5 ARG H 1 1 17 12052 1 1 5 ARG HA H -3.784 -7.036 0.591 1.00 . A A . 5 ARG HA 1 1 17 12053 1 1 5 ARG HB2 H -5.260 -6.051 -1.154 1.00 . A A . 5 ARG HB2 1 1 17 12054 1 1 5 ARG HB3 H -6.107 -6.370 0.366 1.00 . A A . 5 ARG HB3 1 1 17 12055 1 1 5 ARG HD2 H -6.861 -3.014 -1.378 1.00 . A A . 5 ARG HD2 1 1 17 12056 1 1 5 ARG HD3 H -6.800 -4.685 -1.954 1.00 . A A . 5 ARG HD3 1 1 17 12057 1 1 5 ARG HG2 H -6.146 -4.035 0.954 1.00 . A A . 5 ARG HG2 1 1 17 12058 1 1 5 ARG HG3 H -4.985 -3.639 -0.321 1.00 . A A . 5 ARG HG3 1 1 17 12059 1 1 5 ARG HH11 H -8.557 -3.151 -2.774 1.00 . A A . 5 ARG HH11 1 1 17 12060 1 1 5 ARG HH12 H -10.203 -2.651 -2.544 1.00 . A A . 5 ARG HH12 1 1 17 12061 1 1 5 ARG HH21 H -10.425 -4.196 0.685 1.00 . A A . 5 ARG HH21 1 1 17 12062 1 1 5 ARG HH22 H -11.354 -3.318 -0.512 1.00 . A A . 5 ARG HH22 1 1 17 12063 1 1 5 ARG N N -4.051 -5.488 1.942 1.00 . A A . 5 ARG N 1 1 17 12064 1 1 5 ARG NE N -8.265 -4.278 -0.510 1.00 . A A . 5 ARG NE 1 1 17 12065 1 1 5 ARG NH1 N -9.389 -3.127 -2.189 1.00 . A A . 5 ARG NH1 1 1 17 12066 1 1 5 ARG NH2 N -10.488 -3.753 -0.231 1.00 . A A . 5 ARG NH2 1 1 17 12067 1 1 5 ARG O O -2.485 -4.139 0.218 1.00 . A A . 5 ARG O 1 1 17 12068 1 1 6 PRO C C -1.450 -4.174 -2.749 1.00 . A A . 6 PRO C 1 1 17 12069 1 1 6 PRO CA C -1.076 -5.367 -1.869 1.00 . A A . 6 PRO CA 1 1 17 12070 1 1 6 PRO CB C -0.522 -6.534 -2.695 1.00 . A A . 6 PRO CB 1 1 17 12071 1 1 6 PRO CD C -2.544 -7.239 -1.658 1.00 . A A . 6 PRO CD 1 1 17 12072 1 1 6 PRO CG C -1.759 -7.388 -2.961 1.00 . A A . 6 PRO CG 1 1 17 12073 1 1 6 PRO HA H -0.319 -5.041 -1.160 1.00 . A A . 6 PRO HA 1 1 17 12074 1 1 6 PRO HB2 H -0.035 -6.224 -3.621 1.00 . A A . 6 PRO HB2 1 1 17 12075 1 1 6 PRO HB3 H 0.178 -7.107 -2.085 1.00 . A A . 6 PRO HB3 1 1 17 12076 1 1 6 PRO HD2 H -3.606 -7.380 -1.855 1.00 . A A . 6 PRO HD2 1 1 17 12077 1 1 6 PRO HD3 H -2.195 -7.982 -0.940 1.00 . A A . 6 PRO HD3 1 1 17 12078 1 1 6 PRO HG2 H -2.330 -6.954 -3.783 1.00 . A A . 6 PRO HG2 1 1 17 12079 1 1 6 PRO HG3 H -1.511 -8.427 -3.180 1.00 . A A . 6 PRO HG3 1 1 17 12080 1 1 6 PRO N N -2.228 -5.906 -1.165 1.00 . A A . 6 PRO N 1 1 17 12081 1 1 6 PRO O O -2.622 -3.825 -2.894 1.00 . A A . 6 PRO O 1 1 17 12082 1 1 7 SER C C -1.702 -2.471 -5.167 1.00 . A A . 7 SER C 1 1 17 12083 1 1 7 SER CA C -0.463 -2.451 -4.268 1.00 . A A . 7 SER CA 1 1 17 12084 1 1 7 SER CB C 0.826 -2.455 -5.097 1.00 . A A . 7 SER CB 1 1 17 12085 1 1 7 SER H H 0.510 -3.922 -3.159 1.00 . A A . 7 SER H 1 1 17 12086 1 1 7 SER HA H -0.459 -1.513 -3.710 1.00 . A A . 7 SER HA 1 1 17 12087 1 1 7 SER HB2 H 0.556 -2.093 -6.090 1.00 . A A . 7 SER HB2 1 1 17 12088 1 1 7 SER HB3 H 1.540 -1.767 -4.644 1.00 . A A . 7 SER HB3 1 1 17 12089 1 1 7 SER HG H 0.710 -4.342 -5.487 1.00 . A A . 7 SER HG 1 1 17 12090 1 1 7 SER N N -0.417 -3.577 -3.351 1.00 . A A . 7 SER N 1 1 17 12091 1 1 7 SER O O -1.781 -3.277 -6.092 1.00 . A A . 7 SER O 1 1 17 12092 1 1 7 SER OG O 1.410 -3.753 -5.176 1.00 . A A . 7 SER OG 1 1 17 12093 1 1 8 GLN C C -3.485 -0.364 -6.807 1.00 . A A . 8 GLN C 1 1 17 12094 1 1 8 GLN CA C -3.835 -1.339 -5.682 1.00 . A A . 8 GLN CA 1 1 17 12095 1 1 8 GLN CB C -4.925 -0.748 -4.774 1.00 . A A . 8 GLN CB 1 1 17 12096 1 1 8 GLN CD C -5.933 -2.927 -3.923 1.00 . A A . 8 GLN CD 1 1 17 12097 1 1 8 GLN CG C -5.287 -1.600 -3.550 1.00 . A A . 8 GLN CG 1 1 17 12098 1 1 8 GLN H H -2.485 -0.953 -4.109 1.00 . A A . 8 GLN H 1 1 17 12099 1 1 8 GLN HA H -4.187 -2.274 -6.120 1.00 . A A . 8 GLN HA 1 1 17 12100 1 1 8 GLN HB2 H -4.608 0.223 -4.393 1.00 . A A . 8 GLN HB2 1 1 17 12101 1 1 8 GLN HB3 H -5.816 -0.597 -5.375 1.00 . A A . 8 GLN HB3 1 1 17 12102 1 1 8 GLN HE21 H -4.129 -3.867 -3.942 1.00 . A A . 8 GLN HE21 1 1 17 12103 1 1 8 GLN HE22 H -5.515 -4.854 -4.396 1.00 . A A . 8 GLN HE22 1 1 17 12104 1 1 8 GLN HG2 H -4.412 -1.772 -2.924 1.00 . A A . 8 GLN HG2 1 1 17 12105 1 1 8 GLN HG3 H -6.011 -1.031 -2.965 1.00 . A A . 8 GLN HG3 1 1 17 12106 1 1 8 GLN N N -2.640 -1.564 -4.892 1.00 . A A . 8 GLN N 1 1 17 12107 1 1 8 GLN NE2 N -5.130 -3.966 -4.117 1.00 . A A . 8 GLN NE2 1 1 17 12108 1 1 8 GLN O O -3.559 -0.684 -7.988 1.00 . A A . 8 GLN O 1 1 17 12109 1 1 8 GLN OE1 O -7.159 -3.036 -3.964 1.00 . A A . 8 GLN OE1 1 1 17 12110 1 1 9 THR C C -1.210 1.709 -7.654 1.00 . A A . 9 THR C 1 1 17 12111 1 1 9 THR CA C -2.657 1.944 -7.245 1.00 . A A . 9 THR CA 1 1 17 12112 1 1 9 THR CB C -2.745 3.197 -6.360 1.00 . A A . 9 THR CB 1 1 17 12113 1 1 9 THR CG2 C -4.191 3.674 -6.294 1.00 . A A . 9 THR CG2 1 1 17 12114 1 1 9 THR H H -3.038 1.054 -5.419 1.00 . A A . 9 THR H 1 1 17 12115 1 1 9 THR HA H -3.283 2.046 -8.134 1.00 . A A . 9 THR HA 1 1 17 12116 1 1 9 THR HB H -2.124 3.996 -6.770 1.00 . A A . 9 THR HB 1 1 17 12117 1 1 9 THR HG1 H -2.576 3.500 -4.398 1.00 . A A . 9 THR HG1 1 1 17 12118 1 1 9 THR HG21 H -4.829 2.863 -5.954 1.00 . A A . 9 THR HG21 1 1 17 12119 1 1 9 THR HG22 H -4.263 4.517 -5.609 1.00 . A A . 9 THR HG22 1 1 17 12120 1 1 9 THR HG23 H -4.519 3.987 -7.286 1.00 . A A . 9 THR HG23 1 1 17 12121 1 1 9 THR N N -3.092 0.846 -6.407 1.00 . A A . 9 THR N 1 1 17 12122 1 1 9 THR O O -0.862 1.675 -8.836 1.00 . A A . 9 THR O 1 1 17 12123 1 1 9 THR OG1 O -2.300 2.840 -5.052 1.00 . A A . 9 THR OG1 1 1 17 12124 1 1 10 TRP C C 1.621 0.394 -7.427 1.00 . A A . 10 TRP C 1 1 17 12125 1 1 10 TRP CA C 1.076 1.616 -6.679 1.00 . A A . 10 TRP CA 1 1 17 12126 1 1 10 TRP CB C 1.600 1.712 -5.242 1.00 . A A . 10 TRP CB 1 1 17 12127 1 1 10 TRP CD1 C 4.099 1.559 -5.600 1.00 . A A . 10 TRP CD1 1 1 17 12128 1 1 10 TRP CD2 C 3.493 3.449 -4.554 1.00 . A A . 10 TRP CD2 1 1 17 12129 1 1 10 TRP CE2 C 4.888 3.545 -4.813 1.00 . A A . 10 TRP CE2 1 1 17 12130 1 1 10 TRP CE3 C 2.893 4.525 -3.864 1.00 . A A . 10 TRP CE3 1 1 17 12131 1 1 10 TRP CG C 3.007 2.200 -5.131 1.00 . A A . 10 TRP CG 1 1 17 12132 1 1 10 TRP CH2 C 5.007 5.733 -3.792 1.00 . A A . 10 TRP CH2 1 1 17 12133 1 1 10 TRP CZ2 C 5.641 4.669 -4.452 1.00 . A A . 10 TRP CZ2 1 1 17 12134 1 1 10 TRP CZ3 C 3.634 5.661 -3.487 1.00 . A A . 10 TRP CZ3 1 1 17 12135 1 1 10 TRP H H -0.811 1.713 -5.715 1.00 . A A . 10 TRP H 1 1 17 12136 1 1 10 TRP HA H 1.381 2.517 -7.212 1.00 . A A . 10 TRP HA 1 1 17 12137 1 1 10 TRP HB2 H 0.978 2.419 -4.693 1.00 . A A . 10 TRP HB2 1 1 17 12138 1 1 10 TRP HB3 H 1.494 0.741 -4.763 1.00 . A A . 10 TRP HB3 1 1 17 12139 1 1 10 TRP HD1 H 4.091 0.597 -6.094 1.00 . A A . 10 TRP HD1 1 1 17 12140 1 1 10 TRP HE1 H 6.146 2.142 -5.760 1.00 . A A . 10 TRP HE1 1 1 17 12141 1 1 10 TRP HE3 H 1.844 4.473 -3.630 1.00 . A A . 10 TRP HE3 1 1 17 12142 1 1 10 TRP HH2 H 5.597 6.596 -3.545 1.00 . A A . 10 TRP HH2 1 1 17 12143 1 1 10 TRP HZ2 H 6.684 4.730 -4.719 1.00 . A A . 10 TRP HZ2 1 1 17 12144 1 1 10 TRP HZ3 H 3.128 6.477 -2.975 1.00 . A A . 10 TRP HZ3 1 1 17 12145 1 1 10 TRP N N -0.372 1.599 -6.623 1.00 . A A . 10 TRP N 1 1 17 12146 1 1 10 TRP NE1 N 5.209 2.363 -5.445 1.00 . A A . 10 TRP NE1 1 1 17 12147 1 1 10 TRP O O 2.189 -0.526 -6.838 1.00 . A A . 10 TRP O 1 1 17 12148 1 1 11 SER C C 3.230 -0.887 -9.875 1.00 . A A . 11 SER C 1 1 17 12149 1 1 11 SER CA C 1.741 -0.794 -9.551 1.00 . A A . 11 SER CA 1 1 17 12150 1 1 11 SER CB C 0.862 -0.753 -10.807 1.00 . A A . 11 SER CB 1 1 17 12151 1 1 11 SER H H 0.909 1.122 -9.155 1.00 . A A . 11 SER H 1 1 17 12152 1 1 11 SER HA H 1.488 -1.678 -8.963 1.00 . A A . 11 SER HA 1 1 17 12153 1 1 11 SER HB2 H 1.142 0.096 -11.432 1.00 . A A . 11 SER HB2 1 1 17 12154 1 1 11 SER HB3 H 1.009 -1.670 -11.380 1.00 . A A . 11 SER HB3 1 1 17 12155 1 1 11 SER HG H -0.654 0.174 -9.945 1.00 . A A . 11 SER HG 1 1 17 12156 1 1 11 SER N N 1.456 0.374 -8.743 1.00 . A A . 11 SER N 1 1 17 12157 1 1 11 SER O O 3.631 -0.802 -11.032 1.00 . A A . 11 SER O 1 1 17 12158 1 1 11 SER OG O -0.501 -0.647 -10.433 1.00 . A A . 11 SER OG 1 1 17 12159 1 1 12 GLY C C 6.130 -1.452 -7.621 1.00 . A A . 12 GLY C 1 1 17 12160 1 1 12 GLY CA C 5.489 -1.190 -8.979 1.00 . A A . 12 GLY CA 1 1 17 12161 1 1 12 GLY H H 3.649 -1.103 -7.907 1.00 . A A . 12 GLY H 1 1 17 12162 1 1 12 GLY HA2 H 5.728 -2.015 -9.649 1.00 . A A . 12 GLY HA2 1 1 17 12163 1 1 12 GLY HA3 H 5.877 -0.261 -9.401 1.00 . A A . 12 GLY HA3 1 1 17 12164 1 1 12 GLY N N 4.050 -1.073 -8.840 1.00 . A A . 12 GLY N 1 1 17 12165 1 1 12 GLY O O 5.516 -2.083 -6.750 1.00 . A A . 12 GLY O 1 1 17 12166 1 1 13 ASN C C 7.906 0.290 -5.440 1.00 . A A . 13 ASN C 1 1 17 12167 1 1 13 ASN CA C 8.110 -1.015 -6.205 1.00 . A A . 13 ASN CA 1 1 17 12168 1 1 13 ASN CB C 9.599 -1.244 -6.489 1.00 . A A . 13 ASN CB 1 1 17 12169 1 1 13 ASN CG C 10.375 -1.570 -5.215 1.00 . A A . 13 ASN CG 1 1 17 12170 1 1 13 ASN H H 7.761 -0.405 -8.197 1.00 . A A . 13 ASN H 1 1 17 12171 1 1 13 ASN HA H 7.749 -1.861 -5.624 1.00 . A A . 13 ASN HA 1 1 17 12172 1 1 13 ASN HB2 H 9.698 -2.090 -7.168 1.00 . A A . 13 ASN HB2 1 1 17 12173 1 1 13 ASN HB3 H 10.029 -0.363 -6.970 1.00 . A A . 13 ASN HB3 1 1 17 12174 1 1 13 ASN HD21 H 10.603 0.415 -4.664 1.00 . A A . 13 ASN HD21 1 1 17 12175 1 1 13 ASN HD22 H 11.377 -0.774 -3.654 1.00 . A A . 13 ASN HD22 1 1 17 12176 1 1 13 ASN N N 7.362 -0.961 -7.453 1.00 . A A . 13 ASN N 1 1 17 12177 1 1 13 ASN ND2 N 10.823 -0.563 -4.469 1.00 . A A . 13 ASN ND2 1 1 17 12178 1 1 13 ASN O O 7.719 1.342 -6.050 1.00 . A A . 13 ASN O 1 1 17 12179 1 1 13 ASN OD1 O 10.567 -2.741 -4.890 1.00 . A A . 13 ASN OD1 1 1 17 12180 1 1 14 CYS C C 8.886 2.402 -3.506 1.00 . A A . 14 CYS C 1 1 17 12181 1 1 14 CYS CA C 7.821 1.353 -3.203 1.00 . A A . 14 CYS CA 1 1 17 12182 1 1 14 CYS CB C 7.997 0.852 -1.768 1.00 . A A . 14 CYS CB 1 1 17 12183 1 1 14 CYS H H 8.080 -0.687 -3.700 1.00 . A A . 14 CYS H 1 1 17 12184 1 1 14 CYS HA H 6.826 1.785 -3.300 1.00 . A A . 14 CYS HA 1 1 17 12185 1 1 14 CYS HB2 H 7.284 0.050 -1.578 1.00 . A A . 14 CYS HB2 1 1 17 12186 1 1 14 CYS HB3 H 9.011 0.467 -1.669 1.00 . A A . 14 CYS HB3 1 1 17 12187 1 1 14 CYS N N 7.932 0.223 -4.112 1.00 . A A . 14 CYS N 1 1 17 12188 1 1 14 CYS O O 9.967 2.070 -3.995 1.00 . A A . 14 CYS O 1 1 17 12189 1 1 14 CYS SG S 7.783 2.110 -0.489 1.00 . A A . 14 CYS SG 1 1 17 12190 1 1 15 GLY C C 9.641 5.349 -1.816 1.00 . A A . 15 GLY C 1 1 17 12191 1 1 15 GLY CA C 9.478 4.792 -3.225 1.00 . A A . 15 GLY CA 1 1 17 12192 1 1 15 GLY H H 7.657 3.799 -2.776 1.00 . A A . 15 GLY H 1 1 17 12193 1 1 15 GLY HA2 H 10.454 4.504 -3.604 1.00 . A A . 15 GLY HA2 1 1 17 12194 1 1 15 GLY HA3 H 9.064 5.566 -3.872 1.00 . A A . 15 GLY HA3 1 1 17 12195 1 1 15 GLY N N 8.567 3.657 -3.186 1.00 . A A . 15 GLY N 1 1 17 12196 1 1 15 GLY O O 10.751 5.502 -1.317 1.00 . A A . 15 GLY O 1 1 17 12197 1 1 16 ASN C C 7.114 5.615 0.823 1.00 . A A . 16 ASN C 1 1 17 12198 1 1 16 ASN CA C 8.449 6.048 0.229 1.00 . A A . 16 ASN CA 1 1 17 12199 1 1 16 ASN CB C 8.650 7.564 0.349 1.00 . A A . 16 ASN CB 1 1 17 12200 1 1 16 ASN CG C 8.920 7.990 1.788 1.00 . A A . 16 ASN CG 1 1 17 12201 1 1 16 ASN H H 7.636 5.476 -1.640 1.00 . A A . 16 ASN H 1 1 17 12202 1 1 16 ASN HA H 9.257 5.550 0.769 1.00 . A A . 16 ASN HA 1 1 17 12203 1 1 16 ASN HB2 H 9.516 7.852 -0.251 1.00 . A A . 16 ASN HB2 1 1 17 12204 1 1 16 ASN HB3 H 7.774 8.099 -0.018 1.00 . A A . 16 ASN HB3 1 1 17 12205 1 1 16 ASN HD21 H 10.246 9.424 1.198 1.00 . A A . 16 ASN HD21 1 1 17 12206 1 1 16 ASN HD22 H 9.964 9.281 2.919 1.00 . A A . 16 ASN HD22 1 1 17 12207 1 1 16 ASN N N 8.511 5.632 -1.165 1.00 . A A . 16 ASN N 1 1 17 12208 1 1 16 ASN ND2 N 9.771 8.990 1.977 1.00 . A A . 16 ASN ND2 1 1 17 12209 1 1 16 ASN O O 6.060 5.878 0.239 1.00 . A A . 16 ASN O 1 1 17 12210 1 1 16 ASN OD1 O 8.350 7.439 2.725 1.00 . A A . 16 ASN OD1 1 1 17 12211 1 1 17 THR C C 5.024 5.727 3.012 1.00 . A A . 17 THR C 1 1 17 12212 1 1 17 THR CA C 5.934 4.531 2.674 1.00 . A A . 17 THR CA 1 1 17 12213 1 1 17 THR CB C 6.315 3.654 3.877 1.00 . A A . 17 THR CB 1 1 17 12214 1 1 17 THR CG2 C 6.871 4.445 5.064 1.00 . A A . 17 THR CG2 1 1 17 12215 1 1 17 THR H H 8.030 4.834 2.447 1.00 . A A . 17 THR H 1 1 17 12216 1 1 17 THR HA H 5.405 3.890 1.976 1.00 . A A . 17 THR HA 1 1 17 12217 1 1 17 THR HB H 7.085 2.959 3.542 1.00 . A A . 17 THR HB 1 1 17 12218 1 1 17 THR HG1 H 4.558 3.447 4.684 1.00 . A A . 17 THR HG1 1 1 17 12219 1 1 17 THR HG21 H 7.726 5.047 4.750 1.00 . A A . 17 THR HG21 1 1 17 12220 1 1 17 THR HG22 H 6.109 5.099 5.489 1.00 . A A . 17 THR HG22 1 1 17 12221 1 1 17 THR HG23 H 7.201 3.749 5.835 1.00 . A A . 17 THR HG23 1 1 17 12222 1 1 17 THR N N 7.140 4.971 1.990 1.00 . A A . 17 THR N 1 1 17 12223 1 1 17 THR O O 3.797 5.628 2.968 1.00 . A A . 17 THR O 1 1 17 12224 1 1 17 THR OG1 O 5.215 2.867 4.287 1.00 . A A . 17 THR OG1 1 1 17 12225 1 1 18 ALA C C 4.149 8.594 2.248 1.00 . A A . 18 ALA C 1 1 17 12226 1 1 18 ALA CA C 4.894 8.128 3.504 1.00 . A A . 18 ALA CA 1 1 17 12227 1 1 18 ALA CB C 5.857 9.212 3.997 1.00 . A A . 18 ALA CB 1 1 17 12228 1 1 18 ALA H H 6.642 6.935 3.281 1.00 . A A . 18 ALA H 1 1 17 12229 1 1 18 ALA HA H 4.148 7.955 4.281 1.00 . A A . 18 ALA HA 1 1 17 12230 1 1 18 ALA HB1 H 6.382 8.862 4.887 1.00 . A A . 18 ALA HB1 1 1 17 12231 1 1 18 ALA HB2 H 6.583 9.453 3.220 1.00 . A A . 18 ALA HB2 1 1 17 12232 1 1 18 ALA HB3 H 5.297 10.112 4.251 1.00 . A A . 18 ALA HB3 1 1 17 12233 1 1 18 ALA N N 5.627 6.891 3.281 1.00 . A A . 18 ALA N 1 1 17 12234 1 1 18 ALA O O 3.245 9.423 2.355 1.00 . A A . 18 ALA O 1 1 17 12235 1 1 19 HIS C C 2.774 7.143 -0.330 1.00 . A A . 19 HIS C 1 1 17 12236 1 1 19 HIS CA C 3.775 8.292 -0.174 1.00 . A A . 19 HIS CA 1 1 17 12237 1 1 19 HIS CB C 4.738 8.379 -1.365 1.00 . A A . 19 HIS CB 1 1 17 12238 1 1 19 HIS CD2 C 2.875 9.272 -2.973 1.00 . A A . 19 HIS CD2 1 1 17 12239 1 1 19 HIS CE1 C 4.106 9.457 -4.770 1.00 . A A . 19 HIS CE1 1 1 17 12240 1 1 19 HIS CG C 4.166 8.928 -2.651 1.00 . A A . 19 HIS CG 1 1 17 12241 1 1 19 HIS H H 5.270 7.413 1.037 1.00 . A A . 19 HIS H 1 1 17 12242 1 1 19 HIS HA H 3.229 9.235 -0.118 1.00 . A A . 19 HIS HA 1 1 17 12243 1 1 19 HIS HB2 H 5.563 9.021 -1.102 1.00 . A A . 19 HIS HB2 1 1 17 12244 1 1 19 HIS HB3 H 5.147 7.388 -1.542 1.00 . A A . 19 HIS HB3 1 1 17 12245 1 1 19 HIS HD1 H 5.953 9.034 -3.854 1.00 . A A . 19 HIS HD1 1 1 17 12246 1 1 19 HIS HD2 H 2.018 9.213 -2.316 1.00 . A A . 19 HIS HD2 1 1 17 12247 1 1 19 HIS HE1 H 4.399 9.607 -5.803 1.00 . A A . 19 HIS HE1 1 1 17 12248 1 1 19 HIS N N 4.525 8.099 1.061 1.00 . A A . 19 HIS N 1 1 17 12249 1 1 19 HIS ND1 N 4.951 9.152 -3.774 1.00 . A A . 19 HIS ND1 1 1 17 12250 1 1 19 HIS NE2 N 2.841 9.522 -4.332 1.00 . A A . 19 HIS NE2 1 1 17 12251 1 1 19 HIS O O 1.614 7.395 -0.649 1.00 . A A . 19 HIS O 1 1 17 12252 1 1 20 CYS C C 1.017 4.978 0.587 1.00 . A A . 20 CYS C 1 1 17 12253 1 1 20 CYS CA C 2.330 4.722 -0.137 1.00 . A A . 20 CYS CA 1 1 17 12254 1 1 20 CYS CB C 2.993 3.514 0.522 1.00 . A A . 20 CYS CB 1 1 17 12255 1 1 20 CYS H H 4.187 5.759 0.124 1.00 . A A . 20 CYS H 1 1 17 12256 1 1 20 CYS HA H 2.107 4.484 -1.176 1.00 . A A . 20 CYS HA 1 1 17 12257 1 1 20 CYS HB2 H 3.846 3.203 -0.072 1.00 . A A . 20 CYS HB2 1 1 17 12258 1 1 20 CYS HB3 H 3.320 3.775 1.518 1.00 . A A . 20 CYS HB3 1 1 17 12259 1 1 20 CYS N N 3.206 5.896 -0.097 1.00 . A A . 20 CYS N 1 1 17 12260 1 1 20 CYS O O -0.060 4.761 0.042 1.00 . A A . 20 CYS O 1 1 17 12261 1 1 20 CYS SG S 1.869 2.125 0.779 1.00 . A A . 20 CYS SG 1 1 17 12262 1 1 21 ASP C C -0.959 6.791 1.956 1.00 . A A . 21 ASP C 1 1 17 12263 1 1 21 ASP CA C -0.046 5.756 2.631 1.00 . A A . 21 ASP CA 1 1 17 12264 1 1 21 ASP CB C 0.432 6.265 3.992 1.00 . A A . 21 ASP CB 1 1 17 12265 1 1 21 ASP CG C -0.753 6.685 4.844 1.00 . A A . 21 ASP CG 1 1 17 12266 1 1 21 ASP H H 2.050 5.635 2.207 1.00 . A A . 21 ASP H 1 1 17 12267 1 1 21 ASP HA H -0.601 4.822 2.776 1.00 . A A . 21 ASP HA 1 1 17 12268 1 1 21 ASP HB2 H 0.983 5.479 4.510 1.00 . A A . 21 ASP HB2 1 1 17 12269 1 1 21 ASP HB3 H 1.091 7.124 3.855 1.00 . A A . 21 ASP HB3 1 1 17 12270 1 1 21 ASP N N 1.121 5.506 1.807 1.00 . A A . 21 ASP N 1 1 17 12271 1 1 21 ASP O O -2.183 6.672 2.028 1.00 . A A . 21 ASP O 1 1 17 12272 1 1 21 ASP OD1 O -1.594 5.839 5.140 1.00 . A A . 21 ASP OD1 1 1 17 12273 1 1 21 ASP OD2 O -0.797 7.999 5.190 1.00 . A A . 21 ASP OD2 1 1 17 12274 1 1 22 LYS C C -1.911 7.956 -0.611 1.00 . A A . 22 LYS C 1 1 17 12275 1 1 22 LYS CA C -1.185 8.717 0.486 1.00 . A A . 22 LYS CA 1 1 17 12276 1 1 22 LYS CB C -0.374 9.867 -0.119 1.00 . A A . 22 LYS CB 1 1 17 12277 1 1 22 LYS CD C 0.950 11.929 0.530 1.00 . A A . 22 LYS CD 1 1 17 12278 1 1 22 LYS CE C 1.553 12.723 1.699 1.00 . A A . 22 LYS CE 1 1 17 12279 1 1 22 LYS CG C 0.369 10.588 0.996 1.00 . A A . 22 LYS CG 1 1 17 12280 1 1 22 LYS H H 0.616 7.758 1.114 1.00 . A A . 22 LYS H 1 1 17 12281 1 1 22 LYS HA H -1.913 9.166 1.159 1.00 . A A . 22 LYS HA 1 1 17 12282 1 1 22 LYS HB2 H 0.326 9.506 -0.865 1.00 . A A . 22 LYS HB2 1 1 17 12283 1 1 22 LYS HB3 H -1.066 10.557 -0.602 1.00 . A A . 22 LYS HB3 1 1 17 12284 1 1 22 LYS HD2 H 1.689 11.766 -0.256 1.00 . A A . 22 LYS HD2 1 1 17 12285 1 1 22 LYS HD3 H 0.133 12.524 0.109 1.00 . A A . 22 LYS HD3 1 1 17 12286 1 1 22 LYS HE2 H 1.844 13.714 1.343 1.00 . A A . 22 LYS HE2 1 1 17 12287 1 1 22 LYS HE3 H 0.792 12.849 2.469 1.00 . A A . 22 LYS HE3 1 1 17 12288 1 1 22 LYS HG2 H -0.334 10.745 1.815 1.00 . A A . 22 LYS HG2 1 1 17 12289 1 1 22 LYS HG3 H 1.142 9.901 1.315 1.00 . A A . 22 LYS HG3 1 1 17 12290 1 1 22 LYS HZ1 H 2.695 11.048 2.091 1.00 . A A . 22 LYS HZ1 1 1 17 12291 1 1 22 LYS HZ2 H 3.592 12.453 1.873 1.00 . A A . 22 LYS HZ2 1 1 17 12292 1 1 22 LYS N N -0.383 7.784 1.266 1.00 . A A . 22 LYS N 1 1 17 12293 1 1 22 LYS NZ N 2.735 12.058 2.287 1.00 . A A . 22 LYS NZ 1 1 17 12294 1 1 22 LYS O O -3.128 8.071 -0.745 1.00 . A A . 22 LYS O 1 1 17 12295 1 1 23 GLN C C -2.689 5.182 -1.978 1.00 . A A . 23 GLN C 1 1 17 12296 1 1 23 GLN CA C -1.839 6.376 -2.452 1.00 . A A . 23 GLN CA 1 1 17 12297 1 1 23 GLN CB C -0.847 5.963 -3.545 1.00 . A A . 23 GLN CB 1 1 17 12298 1 1 23 GLN CD C 0.740 6.997 -5.283 1.00 . A A . 23 GLN CD 1 1 17 12299 1 1 23 GLN CG C 0.074 7.127 -3.923 1.00 . A A . 23 GLN CG 1 1 17 12300 1 1 23 GLN H H -0.214 6.994 -1.150 1.00 . A A . 23 GLN H 1 1 17 12301 1 1 23 GLN HA H -2.495 7.093 -2.925 1.00 . A A . 23 GLN HA 1 1 17 12302 1 1 23 GLN HB2 H -0.258 5.114 -3.198 1.00 . A A . 23 GLN HB2 1 1 17 12303 1 1 23 GLN HB3 H -1.435 5.662 -4.414 1.00 . A A . 23 GLN HB3 1 1 17 12304 1 1 23 GLN HE21 H 0.303 5.009 -5.461 1.00 . A A . 23 GLN HE21 1 1 17 12305 1 1 23 GLN HE22 H 1.173 5.763 -6.782 1.00 . A A . 23 GLN HE22 1 1 17 12306 1 1 23 GLN HG2 H -0.506 8.048 -3.959 1.00 . A A . 23 GLN HG2 1 1 17 12307 1 1 23 GLN HG3 H 0.861 7.211 -3.182 1.00 . A A . 23 GLN HG3 1 1 17 12308 1 1 23 GLN N N -1.198 7.116 -1.367 1.00 . A A . 23 GLN N 1 1 17 12309 1 1 23 GLN NE2 N 0.737 5.814 -5.881 1.00 . A A . 23 GLN NE2 1 1 17 12310 1 1 23 GLN O O -2.819 4.191 -2.697 1.00 . A A . 23 GLN O 1 1 17 12311 1 1 23 GLN OE1 O 1.278 7.981 -5.788 1.00 . A A . 23 GLN OE1 1 1 17 12312 1 1 24 CYS C C -5.286 5.145 0.567 1.00 . A A . 24 CYS C 1 1 17 12313 1 1 24 CYS CA C -4.188 4.353 -0.153 1.00 . A A . 24 CYS CA 1 1 17 12314 1 1 24 CYS CB C -3.381 3.506 0.842 1.00 . A A . 24 CYS CB 1 1 17 12315 1 1 24 CYS H H -3.229 6.211 -0.352 1.00 . A A . 24 CYS H 1 1 17 12316 1 1 24 CYS HA H -4.656 3.693 -0.889 1.00 . A A . 24 CYS HA 1 1 17 12317 1 1 24 CYS HB2 H -2.829 4.165 1.511 1.00 . A A . 24 CYS HB2 1 1 17 12318 1 1 24 CYS HB3 H -4.071 2.921 1.443 1.00 . A A . 24 CYS HB3 1 1 17 12319 1 1 24 CYS N N -3.327 5.321 -0.814 1.00 . A A . 24 CYS N 1 1 17 12320 1 1 24 CYS O O -6.468 4.852 0.410 1.00 . A A . 24 CYS O 1 1 17 12321 1 1 24 CYS SG S -2.204 2.311 0.162 1.00 . A A . 24 CYS SG 1 1 17 12322 1 1 25 GLN C C -6.519 8.032 0.928 1.00 . A A . 25 GLN C 1 1 17 12323 1 1 25 GLN CA C -5.930 7.049 1.945 1.00 . A A . 25 GLN CA 1 1 17 12324 1 1 25 GLN CB C -5.336 7.796 3.145 1.00 . A A . 25 GLN CB 1 1 17 12325 1 1 25 GLN CD C -4.294 7.600 5.417 1.00 . A A . 25 GLN CD 1 1 17 12326 1 1 25 GLN CG C -4.806 6.834 4.203 1.00 . A A . 25 GLN CG 1 1 17 12327 1 1 25 GLN H H -3.946 6.372 1.508 1.00 . A A . 25 GLN H 1 1 17 12328 1 1 25 GLN HA H -6.751 6.438 2.329 1.00 . A A . 25 GLN HA 1 1 17 12329 1 1 25 GLN HB2 H -4.518 8.443 2.841 1.00 . A A . 25 GLN HB2 1 1 17 12330 1 1 25 GLN HB3 H -6.117 8.408 3.601 1.00 . A A . 25 GLN HB3 1 1 17 12331 1 1 25 GLN HE21 H -5.466 6.509 6.644 1.00 . A A . 25 GLN HE21 1 1 17 12332 1 1 25 GLN HE22 H -4.505 7.761 7.426 1.00 . A A . 25 GLN HE22 1 1 17 12333 1 1 25 GLN HG2 H -5.611 6.161 4.497 1.00 . A A . 25 GLN HG2 1 1 17 12334 1 1 25 GLN HG3 H -3.983 6.252 3.794 1.00 . A A . 25 GLN HG3 1 1 17 12335 1 1 25 GLN N N -4.929 6.182 1.330 1.00 . A A . 25 GLN N 1 1 17 12336 1 1 25 GLN NE2 N -4.798 7.272 6.596 1.00 . A A . 25 GLN NE2 1 1 17 12337 1 1 25 GLN O O -7.732 8.244 0.887 1.00 . A A . 25 GLN O 1 1 17 12338 1 1 25 GLN OE1 O -3.448 8.483 5.299 1.00 . A A . 25 GLN OE1 1 1 17 12339 1 1 26 ASP C C -6.679 9.192 -2.045 1.00 . A A . 26 ASP C 1 1 17 12340 1 1 26 ASP CA C -6.090 9.759 -0.759 1.00 . A A . 26 ASP CA 1 1 17 12341 1 1 26 ASP CB C -4.934 10.718 -1.065 1.00 . A A . 26 ASP CB 1 1 17 12342 1 1 26 ASP CG C -4.452 11.466 0.173 1.00 . A A . 26 ASP CG 1 1 17 12343 1 1 26 ASP H H -4.695 8.375 0.074 1.00 . A A . 26 ASP H 1 1 17 12344 1 1 26 ASP HA H -6.858 10.351 -0.267 1.00 . A A . 26 ASP HA 1 1 17 12345 1 1 26 ASP HB2 H -4.103 10.182 -1.509 1.00 . A A . 26 ASP HB2 1 1 17 12346 1 1 26 ASP HB3 H -5.282 11.448 -1.795 1.00 . A A . 26 ASP HB3 1 1 17 12347 1 1 26 ASP N N -5.668 8.672 0.116 1.00 . A A . 26 ASP N 1 1 17 12348 1 1 26 ASP O O -7.811 9.517 -2.398 1.00 . A A . 26 ASP O 1 1 17 12349 1 1 26 ASP OD1 O -5.368 12.261 0.788 1.00 . A A . 26 ASP OD1 1 1 17 12350 1 1 26 ASP OD2 O -3.294 11.324 0.555 1.00 . A A . 26 ASP OD2 1 1 17 12351 1 1 27 TRP C C -7.323 6.791 -3.954 1.00 . A A . 27 TRP C 1 1 17 12352 1 1 27 TRP CA C -6.215 7.839 -4.050 1.00 . A A . 27 TRP CA 1 1 17 12353 1 1 27 TRP CB C -4.964 7.204 -4.655 1.00 . A A . 27 TRP CB 1 1 17 12354 1 1 27 TRP CD1 C -3.521 9.310 -4.618 1.00 . A A . 27 TRP CD1 1 1 17 12355 1 1 27 TRP CD2 C -3.003 7.912 -6.282 1.00 . A A . 27 TRP CD2 1 1 17 12356 1 1 27 TRP CE2 C -2.092 9.004 -6.364 1.00 . A A . 27 TRP CE2 1 1 17 12357 1 1 27 TRP CE3 C -2.893 6.906 -7.263 1.00 . A A . 27 TRP CE3 1 1 17 12358 1 1 27 TRP CG C -3.885 8.121 -5.146 1.00 . A A . 27 TRP CG 1 1 17 12359 1 1 27 TRP CH2 C -0.986 8.025 -8.280 1.00 . A A . 27 TRP CH2 1 1 17 12360 1 1 27 TRP CZ2 C -1.103 9.076 -7.356 1.00 . A A . 27 TRP CZ2 1 1 17 12361 1 1 27 TRP CZ3 C -1.886 6.947 -8.240 1.00 . A A . 27 TRP CZ3 1 1 17 12362 1 1 27 TRP H H -4.979 8.171 -2.335 1.00 . A A . 27 TRP H 1 1 17 12363 1 1 27 TRP HA H -6.546 8.647 -4.705 1.00 . A A . 27 TRP HA 1 1 17 12364 1 1 27 TRP HB2 H -4.525 6.504 -3.945 1.00 . A A . 27 TRP HB2 1 1 17 12365 1 1 27 TRP HB3 H -5.295 6.626 -5.517 1.00 . A A . 27 TRP HB3 1 1 17 12366 1 1 27 TRP HD1 H -3.976 9.790 -3.767 1.00 . A A . 27 TRP HD1 1 1 17 12367 1 1 27 TRP HE1 H -2.004 10.714 -5.119 1.00 . A A . 27 TRP HE1 1 1 17 12368 1 1 27 TRP HE3 H -3.617 6.110 -7.270 1.00 . A A . 27 TRP HE3 1 1 17 12369 1 1 27 TRP HH2 H -0.213 8.031 -9.029 1.00 . A A . 27 TRP HH2 1 1 17 12370 1 1 27 TRP HZ2 H -0.427 9.918 -7.400 1.00 . A A . 27 TRP HZ2 1 1 17 12371 1 1 27 TRP HZ3 H -1.811 6.154 -8.970 1.00 . A A . 27 TRP HZ3 1 1 17 12372 1 1 27 TRP N N -5.896 8.350 -2.721 1.00 . A A . 27 TRP N 1 1 17 12373 1 1 27 TRP NE1 N -2.454 9.833 -5.320 1.00 . A A . 27 TRP NE1 1 1 17 12374 1 1 27 TRP O O -8.395 6.947 -4.533 1.00 . A A . 27 TRP O 1 1 17 12375 1 1 28 GLU C C -8.876 5.349 -1.693 1.00 . A A . 28 GLU C 1 1 17 12376 1 1 28 GLU CA C -8.036 4.725 -2.818 1.00 . A A . 28 GLU CA 1 1 17 12377 1 1 28 GLU CB C -7.288 3.447 -2.402 1.00 . A A . 28 GLU CB 1 1 17 12378 1 1 28 GLU CD C -7.335 2.199 -4.600 1.00 . A A . 28 GLU CD 1 1 17 12379 1 1 28 GLU CG C -6.454 2.822 -3.524 1.00 . A A . 28 GLU CG 1 1 17 12380 1 1 28 GLU H H -6.149 5.686 -2.751 1.00 . A A . 28 GLU H 1 1 17 12381 1 1 28 GLU HA H -8.700 4.506 -3.655 1.00 . A A . 28 GLU HA 1 1 17 12382 1 1 28 GLU HB2 H -6.611 3.695 -1.605 1.00 . A A . 28 GLU HB2 1 1 17 12383 1 1 28 GLU HB3 H -7.951 2.686 -2.013 1.00 . A A . 28 GLU HB3 1 1 17 12384 1 1 28 GLU HG2 H -5.793 3.567 -3.961 1.00 . A A . 28 GLU HG2 1 1 17 12385 1 1 28 GLU HG3 H -5.837 2.032 -3.094 1.00 . A A . 28 GLU HG3 1 1 17 12386 1 1 28 GLU N N -7.046 5.718 -3.209 1.00 . A A . 28 GLU N 1 1 17 12387 1 1 28 GLU O O -9.065 6.560 -1.675 1.00 . A A . 28 GLU O 1 1 17 12388 1 1 28 GLU OE1 O -7.799 1.077 -4.414 1.00 . A A . 28 GLU OE1 1 1 17 12389 1 1 28 GLU OE2 O -7.557 2.949 -5.711 1.00 . A A . 28 GLU OE2 1 1 17 12390 1 1 29 LYS C C -9.881 3.871 1.484 1.00 . A A . 29 LYS C 1 1 17 12391 1 1 29 LYS CA C -10.053 4.998 0.465 1.00 . A A . 29 LYS CA 1 1 17 12392 1 1 29 LYS CB C -11.544 5.253 0.151 1.00 . A A . 29 LYS CB 1 1 17 12393 1 1 29 LYS CD C -11.659 7.798 0.438 1.00 . A A . 29 LYS CD 1 1 17 12394 1 1 29 LYS CE C -11.210 9.065 -0.307 1.00 . A A . 29 LYS CE 1 1 17 12395 1 1 29 LYS CG C -11.900 6.600 -0.502 1.00 . A A . 29 LYS CG 1 1 17 12396 1 1 29 LYS H H -9.025 3.613 -0.666 1.00 . A A . 29 LYS H 1 1 17 12397 1 1 29 LYS HA H -9.553 5.870 0.861 1.00 . A A . 29 LYS HA 1 1 17 12398 1 1 29 LYS HB2 H -11.908 4.444 -0.485 1.00 . A A . 29 LYS HB2 1 1 17 12399 1 1 29 LYS HB3 H -12.099 5.210 1.087 1.00 . A A . 29 LYS HB3 1 1 17 12400 1 1 29 LYS HD2 H -12.598 8.009 0.958 1.00 . A A . 29 LYS HD2 1 1 17 12401 1 1 29 LYS HD3 H -10.921 7.557 1.203 1.00 . A A . 29 LYS HD3 1 1 17 12402 1 1 29 LYS HE2 H -11.882 9.260 -1.146 1.00 . A A . 29 LYS HE2 1 1 17 12403 1 1 29 LYS HE3 H -11.259 9.913 0.379 1.00 . A A . 29 LYS HE3 1 1 17 12404 1 1 29 LYS HG2 H -11.387 6.701 -1.453 1.00 . A A . 29 LYS HG2 1 1 17 12405 1 1 29 LYS HG3 H -12.967 6.575 -0.737 1.00 . A A . 29 LYS HG3 1 1 17 12406 1 1 29 LYS HZ1 H -9.644 7.964 -1.076 1.00 . A A . 29 LYS HZ1 1 1 17 12407 1 1 29 LYS HZ2 H -9.683 9.560 -1.604 1.00 . A A . 29 LYS HZ2 1 1 17 12408 1 1 29 LYS N N -9.300 4.574 -0.698 1.00 . A A . 29 LYS N 1 1 17 12409 1 1 29 LYS NZ N -9.822 8.939 -0.794 1.00 . A A . 29 LYS NZ 1 1 17 12410 1 1 29 LYS O O -10.828 3.244 1.951 1.00 . A A . 29 LYS O 1 1 17 12411 1 1 30 ALA C C -7.952 3.384 4.093 1.00 . A A . 30 ALA C 1 1 17 12412 1 1 30 ALA CA C -8.153 2.660 2.762 1.00 . A A . 30 ALA CA 1 1 17 12413 1 1 30 ALA CB C -6.838 2.073 2.254 1.00 . A A . 30 ALA CB 1 1 17 12414 1 1 30 ALA H H -7.898 4.199 1.351 1.00 . A A . 30 ALA H 1 1 17 12415 1 1 30 ALA HA H -8.889 1.863 2.867 1.00 . A A . 30 ALA HA 1 1 17 12416 1 1 30 ALA HB1 H -6.956 1.729 1.226 1.00 . A A . 30 ALA HB1 1 1 17 12417 1 1 30 ALA HB2 H -6.075 2.846 2.295 1.00 . A A . 30 ALA HB2 1 1 17 12418 1 1 30 ALA HB3 H -6.524 1.237 2.867 1.00 . A A . 30 ALA HB3 1 1 17 12419 1 1 30 ALA N N -8.608 3.617 1.780 1.00 . A A . 30 ALA N 1 1 17 12420 1 1 30 ALA O O -7.729 4.594 4.116 1.00 . A A . 30 ALA O 1 1 17 12421 1 1 31 SER C C -6.228 3.718 6.519 1.00 . A A . 31 SER C 1 1 17 12422 1 1 31 SER CA C -7.645 3.127 6.518 1.00 . A A . 31 SER CA 1 1 17 12423 1 1 31 SER CB C -7.799 1.948 7.480 1.00 . A A . 31 SER CB 1 1 17 12424 1 1 31 SER H H -8.099 1.644 5.170 1.00 . A A . 31 SER H 1 1 17 12425 1 1 31 SER HA H -8.353 3.895 6.816 1.00 . A A . 31 SER HA 1 1 17 12426 1 1 31 SER HB2 H -6.981 1.249 7.334 1.00 . A A . 31 SER HB2 1 1 17 12427 1 1 31 SER HB3 H -7.736 2.324 8.490 1.00 . A A . 31 SER HB3 1 1 17 12428 1 1 31 SER HG H -9.734 1.952 7.259 1.00 . A A . 31 SER HG 1 1 17 12429 1 1 31 SER N N -7.994 2.650 5.204 1.00 . A A . 31 SER N 1 1 17 12430 1 1 31 SER O O -6.025 4.814 7.036 1.00 . A A . 31 SER O 1 1 17 12431 1 1 31 SER OG O -9.040 1.286 7.263 1.00 . A A . 31 SER OG 1 1 17 12432 1 1 32 HIS C C -3.207 2.776 4.592 1.00 . A A . 32 HIS C 1 1 17 12433 1 1 32 HIS CA C -3.914 3.564 5.693 1.00 . A A . 32 HIS CA 1 1 17 12434 1 1 32 HIS CB C -3.076 3.607 6.985 1.00 . A A . 32 HIS CB 1 1 17 12435 1 1 32 HIS CD2 C -2.993 1.159 7.689 1.00 . A A . 32 HIS CD2 1 1 17 12436 1 1 32 HIS CE1 C -0.850 0.828 7.715 1.00 . A A . 32 HIS CE1 1 1 17 12437 1 1 32 HIS CG C -2.390 2.323 7.342 1.00 . A A . 32 HIS CG 1 1 17 12438 1 1 32 HIS H H -5.484 2.150 5.452 1.00 . A A . 32 HIS H 1 1 17 12439 1 1 32 HIS HA H -4.028 4.585 5.343 1.00 . A A . 32 HIS HA 1 1 17 12440 1 1 32 HIS HB2 H -2.289 4.331 6.885 1.00 . A A . 32 HIS HB2 1 1 17 12441 1 1 32 HIS HB3 H -3.697 3.932 7.822 1.00 . A A . 32 HIS HB3 1 1 17 12442 1 1 32 HIS HD1 H -0.300 2.729 6.963 1.00 . A A . 32 HIS HD1 1 1 17 12443 1 1 32 HIS HD2 H -4.052 1.054 7.617 1.00 . A A . 32 HIS HD2 1 1 17 12444 1 1 32 HIS HE1 H 0.101 0.326 7.788 1.00 . A A . 32 HIS HE1 1 1 17 12445 1 1 32 HIS N N -5.250 3.016 5.927 1.00 . A A . 32 HIS N 1 1 17 12446 1 1 32 HIS ND1 N -1.020 2.105 7.325 1.00 . A A . 32 HIS ND1 1 1 17 12447 1 1 32 HIS NE2 N -2.021 0.227 7.977 1.00 . A A . 32 HIS NE2 1 1 17 12448 1 1 32 HIS O O -3.767 1.808 4.069 1.00 . A A . 32 HIS O 1 1 17 12449 1 1 33 GLY C C 0.302 2.160 4.297 1.00 . A A . 33 GLY C 1 1 17 12450 1 1 33 GLY CA C -1.010 2.350 3.541 1.00 . A A . 33 GLY CA 1 1 17 12451 1 1 33 GLY H H -1.602 4.000 4.735 1.00 . A A . 33 GLY H 1 1 17 12452 1 1 33 GLY HA2 H -1.438 1.390 3.360 1.00 . A A . 33 GLY HA2 1 1 17 12453 1 1 33 GLY HA3 H -0.809 2.766 2.564 1.00 . A A . 33 GLY HA3 1 1 17 12454 1 1 33 GLY N N -1.958 3.153 4.303 1.00 . A A . 33 GLY N 1 1 17 12455 1 1 33 GLY O O 0.549 2.862 5.281 1.00 . A A . 33 GLY O 1 1 17 12456 1 1 34 ALA C C 3.235 0.021 3.419 1.00 . A A . 34 ALA C 1 1 17 12457 1 1 34 ALA CA C 2.464 0.950 4.371 1.00 . A A . 34 ALA CA 1 1 17 12458 1 1 34 ALA CB C 2.390 0.358 5.783 1.00 . A A . 34 ALA CB 1 1 17 12459 1 1 34 ALA H H 0.811 0.621 3.076 1.00 . A A . 34 ALA H 1 1 17 12460 1 1 34 ALA HA H 2.973 1.908 4.426 1.00 . A A . 34 ALA HA 1 1 17 12461 1 1 34 ALA HB1 H 1.777 -0.540 5.784 1.00 . A A . 34 ALA HB1 1 1 17 12462 1 1 34 ALA HB2 H 3.393 0.111 6.132 1.00 . A A . 34 ALA HB2 1 1 17 12463 1 1 34 ALA HB3 H 1.957 1.086 6.471 1.00 . A A . 34 ALA HB3 1 1 17 12464 1 1 34 ALA N N 1.120 1.196 3.858 1.00 . A A . 34 ALA N 1 1 17 12465 1 1 34 ALA O O 2.665 -0.951 2.924 1.00 . A A . 34 ALA O 1 1 17 12466 1 1 35 CYS C C 5.901 -1.741 2.938 1.00 . A A . 35 CYS C 1 1 17 12467 1 1 35 CYS CA C 5.346 -0.489 2.249 1.00 . A A . 35 CYS CA 1 1 17 12468 1 1 35 CYS CB C 6.490 0.369 1.712 1.00 . A A . 35 CYS CB 1 1 17 12469 1 1 35 CYS H H 4.959 1.119 3.561 1.00 . A A . 35 CYS H 1 1 17 12470 1 1 35 CYS HA H 4.747 -0.783 1.394 1.00 . A A . 35 CYS HA 1 1 17 12471 1 1 35 CYS HB2 H 6.997 0.881 2.528 1.00 . A A . 35 CYS HB2 1 1 17 12472 1 1 35 CYS HB3 H 7.207 -0.299 1.258 1.00 . A A . 35 CYS HB3 1 1 17 12473 1 1 35 CYS N N 4.517 0.302 3.153 1.00 . A A . 35 CYS N 1 1 17 12474 1 1 35 CYS O O 6.224 -1.695 4.126 1.00 . A A . 35 CYS O 1 1 17 12475 1 1 35 CYS SG S 6.003 1.552 0.433 1.00 . A A . 35 CYS SG 1 1 17 12476 1 1 36 HIS C C 7.399 -4.813 1.589 1.00 . A A . 36 HIS C 1 1 17 12477 1 1 36 HIS CA C 6.668 -4.088 2.710 1.00 . A A . 36 HIS CA 1 1 17 12478 1 1 36 HIS CB C 5.664 -5.095 3.262 1.00 . A A . 36 HIS CB 1 1 17 12479 1 1 36 HIS CD2 C 3.176 -4.728 3.715 1.00 . A A . 36 HIS CD2 1 1 17 12480 1 1 36 HIS CE1 C 3.339 -3.332 5.390 1.00 . A A . 36 HIS CE1 1 1 17 12481 1 1 36 HIS CG C 4.494 -4.502 3.974 1.00 . A A . 36 HIS CG 1 1 17 12482 1 1 36 HIS H H 5.687 -2.873 1.254 1.00 . A A . 36 HIS H 1 1 17 12483 1 1 36 HIS HA H 7.357 -3.841 3.513 1.00 . A A . 36 HIS HA 1 1 17 12484 1 1 36 HIS HB2 H 5.265 -5.683 2.433 1.00 . A A . 36 HIS HB2 1 1 17 12485 1 1 36 HIS HB3 H 6.180 -5.784 3.935 1.00 . A A . 36 HIS HB3 1 1 17 12486 1 1 36 HIS HD1 H 5.439 -3.088 5.285 1.00 . A A . 36 HIS HD1 1 1 17 12487 1 1 36 HIS HD2 H 2.829 -5.351 2.901 1.00 . A A . 36 HIS HD2 1 1 17 12488 1 1 36 HIS HE1 H 3.069 -2.652 6.186 1.00 . A A . 36 HIS HE1 1 1 17 12489 1 1 36 HIS N N 6.022 -2.867 2.217 1.00 . A A . 36 HIS N 1 1 17 12490 1 1 36 HIS ND1 N 4.595 -3.586 5.002 1.00 . A A . 36 HIS ND1 1 1 17 12491 1 1 36 HIS NE2 N 2.454 -4.023 4.652 1.00 . A A . 36 HIS NE2 1 1 17 12492 1 1 36 HIS O O 6.883 -4.875 0.474 1.00 . A A . 36 HIS O 1 1 17 12493 1 1 37 LYS C C 8.584 -7.704 0.940 1.00 . A A . 37 LYS C 1 1 17 12494 1 1 37 LYS CA C 9.218 -6.320 0.962 1.00 . A A . 37 LYS CA 1 1 17 12495 1 1 37 LYS CB C 10.704 -6.395 1.296 1.00 . A A . 37 LYS CB 1 1 17 12496 1 1 37 LYS CD C 12.882 -7.573 0.598 1.00 . A A . 37 LYS CD 1 1 17 12497 1 1 37 LYS CE C 14.017 -6.578 0.301 1.00 . A A . 37 LYS CE 1 1 17 12498 1 1 37 LYS CG C 11.503 -7.042 0.158 1.00 . A A . 37 LYS CG 1 1 17 12499 1 1 37 LYS H H 8.870 -5.414 2.852 1.00 . A A . 37 LYS H 1 1 17 12500 1 1 37 LYS HA H 9.169 -5.886 -0.027 1.00 . A A . 37 LYS HA 1 1 17 12501 1 1 37 LYS HB2 H 11.049 -5.391 1.396 1.00 . A A . 37 LYS HB2 1 1 17 12502 1 1 37 LYS HB3 H 10.842 -6.889 2.248 1.00 . A A . 37 LYS HB3 1 1 17 12503 1 1 37 LYS HD2 H 12.869 -7.814 1.664 1.00 . A A . 37 LYS HD2 1 1 17 12504 1 1 37 LYS HD3 H 13.071 -8.508 0.070 1.00 . A A . 37 LYS HD3 1 1 17 12505 1 1 37 LYS HE2 H 13.816 -6.043 -0.628 1.00 . A A . 37 LYS HE2 1 1 17 12506 1 1 37 LYS HE3 H 14.069 -5.864 1.122 1.00 . A A . 37 LYS HE3 1 1 17 12507 1 1 37 LYS HG2 H 10.911 -7.867 -0.217 1.00 . A A . 37 LYS HG2 1 1 17 12508 1 1 37 LYS HG3 H 11.593 -6.331 -0.664 1.00 . A A . 37 LYS HG3 1 1 17 12509 1 1 37 LYS HZ1 H 15.184 -8.257 -0.003 1.00 . A A . 37 LYS HZ1 1 1 17 12510 1 1 37 LYS HZ2 H 15.809 -6.856 -0.690 1.00 . A A . 37 LYS HZ2 1 1 17 12511 1 1 37 LYS N N 8.516 -5.471 1.909 1.00 . A A . 37 LYS N 1 1 17 12512 1 1 37 LYS NZ N 15.328 -7.247 0.133 1.00 . A A . 37 LYS NZ 1 1 17 12513 1 1 37 LYS O O 8.540 -8.400 1.957 1.00 . A A . 37 LYS O 1 1 17 12514 1 1 38 ARG C C 8.364 -9.882 -1.817 1.00 . A A . 38 ARG C 1 1 17 12515 1 1 38 ARG CA C 7.600 -9.412 -0.581 1.00 . A A . 38 ARG CA 1 1 17 12516 1 1 38 ARG CB C 6.116 -9.313 -0.941 1.00 . A A . 38 ARG CB 1 1 17 12517 1 1 38 ARG CD C 5.044 -9.915 1.324 1.00 . A A . 38 ARG CD 1 1 17 12518 1 1 38 ARG CG C 5.137 -8.903 0.173 1.00 . A A . 38 ARG CG 1 1 17 12519 1 1 38 ARG CZ C 6.643 -10.675 3.116 1.00 . A A . 38 ARG CZ 1 1 17 12520 1 1 38 ARG H H 8.197 -7.428 -1.006 1.00 . A A . 38 ARG H 1 1 17 12521 1 1 38 ARG HA H 7.764 -10.130 0.221 1.00 . A A . 38 ARG HA 1 1 17 12522 1 1 38 ARG HB2 H 6.040 -8.572 -1.739 1.00 . A A . 38 ARG HB2 1 1 17 12523 1 1 38 ARG HB3 H 5.814 -10.280 -1.337 1.00 . A A . 38 ARG HB3 1 1 17 12524 1 1 38 ARG HD2 H 4.149 -9.693 1.912 1.00 . A A . 38 ARG HD2 1 1 17 12525 1 1 38 ARG HD3 H 4.958 -10.922 0.911 1.00 . A A . 38 ARG HD3 1 1 17 12526 1 1 38 ARG HG2 H 5.396 -7.916 0.554 1.00 . A A . 38 ARG HG2 1 1 17 12527 1 1 38 ARG HG3 H 4.149 -8.838 -0.286 1.00 . A A . 38 ARG HG3 1 1 17 12528 1 1 38 ARG HH11 H 4.976 -11.835 3.041 1.00 . A A . 38 ARG HH11 1 1 17 12529 1 1 38 ARG HH12 H 6.189 -12.393 4.152 1.00 . A A . 38 ARG HH12 1 1 17 12530 1 1 38 ARG HH21 H 8.401 -9.698 3.305 1.00 . A A . 38 ARG HH21 1 1 17 12531 1 1 38 ARG HH22 H 8.230 -11.079 4.372 1.00 . A A . 38 ARG HH22 1 1 17 12532 1 1 38 ARG N N 8.107 -8.092 -0.241 1.00 . A A . 38 ARG N 1 1 17 12533 1 1 38 ARG NE N 6.215 -9.803 2.194 1.00 . A A . 38 ARG NE 1 1 17 12534 1 1 38 ARG NH1 N 5.884 -11.718 3.466 1.00 . A A . 38 ARG NH1 1 1 17 12535 1 1 38 ARG NH2 N 7.845 -10.474 3.661 1.00 . A A . 38 ARG NH2 1 1 17 12536 1 1 38 ARG O O 8.407 -9.153 -2.802 1.00 . A A . 38 ARG O 1 1 17 12537 1 1 39 GLU C C 10.660 -10.655 -3.537 1.00 . A A . 39 GLU C 1 1 17 12538 1 1 39 GLU CA C 9.685 -11.665 -2.909 1.00 . A A . 39 GLU CA 1 1 17 12539 1 1 39 GLU CB C 8.683 -12.245 -3.921 1.00 . A A . 39 GLU CB 1 1 17 12540 1 1 39 GLU CD C 6.738 -12.969 -2.407 1.00 . A A . 39 GLU CD 1 1 17 12541 1 1 39 GLU CG C 7.864 -13.411 -3.337 1.00 . A A . 39 GLU CG 1 1 17 12542 1 1 39 GLU H H 8.741 -11.693 -1.008 1.00 . A A . 39 GLU H 1 1 17 12543 1 1 39 GLU HA H 10.293 -12.486 -2.528 1.00 . A A . 39 GLU HA 1 1 17 12544 1 1 39 GLU HB2 H 8.015 -11.463 -4.286 1.00 . A A . 39 GLU HB2 1 1 17 12545 1 1 39 GLU HB3 H 9.249 -12.632 -4.769 1.00 . A A . 39 GLU HB3 1 1 17 12546 1 1 39 GLU HG2 H 7.412 -13.960 -4.165 1.00 . A A . 39 GLU HG2 1 1 17 12547 1 1 39 GLU HG3 H 8.525 -14.097 -2.805 1.00 . A A . 39 GLU HG3 1 1 17 12548 1 1 39 GLU N N 8.963 -11.076 -1.781 1.00 . A A . 39 GLU N 1 1 17 12549 1 1 39 GLU O O 10.762 -10.529 -4.753 1.00 . A A . 39 GLU O 1 1 17 12550 1 1 39 GLU OE1 O 6.958 -12.821 -1.204 1.00 . A A . 39 GLU OE1 1 1 17 12551 1 1 39 GLU OE2 O 5.532 -12.748 -2.993 1.00 . A A . 39 GLU OE2 1 1 17 12552 1 1 40 ASN C C 11.753 -7.694 -3.760 1.00 . A A . 40 ASN C 1 1 17 12553 1 1 40 ASN CA C 12.332 -8.886 -2.998 1.00 . A A . 40 ASN CA 1 1 17 12554 1 1 40 ASN CB C 13.518 -9.497 -3.728 1.00 . A A . 40 ASN CB 1 1 17 12555 1 1 40 ASN CG C 14.774 -8.641 -3.568 1.00 . A A . 40 ASN CG 1 1 17 12556 1 1 40 ASN H H 11.291 -10.177 -1.711 1.00 . A A . 40 ASN H 1 1 17 12557 1 1 40 ASN HA H 12.677 -8.493 -2.049 1.00 . A A . 40 ASN HA 1 1 17 12558 1 1 40 ASN HB2 H 13.708 -10.491 -3.333 1.00 . A A . 40 ASN HB2 1 1 17 12559 1 1 40 ASN HB3 H 13.211 -9.603 -4.763 1.00 . A A . 40 ASN HB3 1 1 17 12560 1 1 40 ASN HD21 H 15.217 -8.759 -5.549 1.00 . A A . 40 ASN HD21 1 1 17 12561 1 1 40 ASN HD22 H 16.335 -7.838 -4.570 1.00 . A A . 40 ASN HD22 1 1 17 12562 1 1 40 ASN N N 11.368 -9.925 -2.674 1.00 . A A . 40 ASN N 1 1 17 12563 1 1 40 ASN ND2 N 15.502 -8.398 -4.653 1.00 . A A . 40 ASN ND2 1 1 17 12564 1 1 40 ASN O O 12.495 -6.940 -4.382 1.00 . A A . 40 ASN O 1 1 17 12565 1 1 40 ASN OD1 O 15.098 -8.209 -2.459 1.00 . A A . 40 ASN OD1 1 1 17 12566 1 1 41 HIS C C 9.064 -5.631 -3.093 1.00 . A A . 41 HIS C 1 1 17 12567 1 1 41 HIS CA C 9.738 -6.362 -4.248 1.00 . A A . 41 HIS CA 1 1 17 12568 1 1 41 HIS CB C 8.720 -6.851 -5.272 1.00 . A A . 41 HIS CB 1 1 17 12569 1 1 41 HIS CD2 C 9.445 -8.870 -6.735 1.00 . A A . 41 HIS CD2 1 1 17 12570 1 1 41 HIS CE1 C 10.729 -7.815 -8.147 1.00 . A A . 41 HIS CE1 1 1 17 12571 1 1 41 HIS CG C 9.407 -7.537 -6.429 1.00 . A A . 41 HIS CG 1 1 17 12572 1 1 41 HIS H H 9.856 -8.172 -3.212 1.00 . A A . 41 HIS H 1 1 17 12573 1 1 41 HIS HA H 10.437 -5.709 -4.758 1.00 . A A . 41 HIS HA 1 1 17 12574 1 1 41 HIS HB2 H 8.045 -7.549 -4.778 1.00 . A A . 41 HIS HB2 1 1 17 12575 1 1 41 HIS HB3 H 8.120 -6.010 -5.618 1.00 . A A . 41 HIS HB3 1 1 17 12576 1 1 41 HIS HD1 H 10.390 -5.874 -7.386 1.00 . A A . 41 HIS HD1 1 1 17 12577 1 1 41 HIS HD2 H 8.993 -9.656 -6.148 1.00 . A A . 41 HIS HD2 1 1 17 12578 1 1 41 HIS HE1 H 11.425 -7.616 -8.951 1.00 . A A . 41 HIS HE1 1 1 17 12579 1 1 41 HIS N N 10.437 -7.501 -3.695 1.00 . A A . 41 HIS N 1 1 17 12580 1 1 41 HIS ND1 N 10.197 -6.868 -7.353 1.00 . A A . 41 HIS ND1 1 1 17 12581 1 1 41 HIS NE2 N 10.296 -9.041 -7.809 1.00 . A A . 41 HIS NE2 1 1 17 12582 1 1 41 HIS O O 8.227 -6.214 -2.403 1.00 . A A . 41 HIS O 1 1 17 12583 1 1 42 TRP C C 7.414 -3.126 -2.424 1.00 . A A . 42 TRP C 1 1 17 12584 1 1 42 TRP CA C 8.759 -3.559 -1.872 1.00 . A A . 42 TRP CA 1 1 17 12585 1 1 42 TRP CB C 9.633 -2.378 -1.463 1.00 . A A . 42 TRP CB 1 1 17 12586 1 1 42 TRP CD1 C 11.907 -3.268 -0.821 1.00 . A A . 42 TRP CD1 1 1 17 12587 1 1 42 TRP CD2 C 10.680 -2.655 0.950 1.00 . A A . 42 TRP CD2 1 1 17 12588 1 1 42 TRP CE2 C 11.913 -3.153 1.452 1.00 . A A . 42 TRP CE2 1 1 17 12589 1 1 42 TRP CE3 C 9.689 -2.323 1.894 1.00 . A A . 42 TRP CE3 1 1 17 12590 1 1 42 TRP CG C 10.712 -2.738 -0.502 1.00 . A A . 42 TRP CG 1 1 17 12591 1 1 42 TRP CH2 C 11.142 -2.967 3.739 1.00 . A A . 42 TRP CH2 1 1 17 12592 1 1 42 TRP CZ2 C 12.134 -3.352 2.820 1.00 . A A . 42 TRP CZ2 1 1 17 12593 1 1 42 TRP CZ3 C 9.934 -2.421 3.273 1.00 . A A . 42 TRP CZ3 1 1 17 12594 1 1 42 TRP H H 10.072 -3.909 -3.503 1.00 . A A . 42 TRP H 1 1 17 12595 1 1 42 TRP HA H 8.591 -4.124 -0.970 1.00 . A A . 42 TRP HA 1 1 17 12596 1 1 42 TRP HB2 H 10.055 -1.890 -2.337 1.00 . A A . 42 TRP HB2 1 1 17 12597 1 1 42 TRP HB3 H 9.008 -1.663 -0.942 1.00 . A A . 42 TRP HB3 1 1 17 12598 1 1 42 TRP HD1 H 12.202 -3.528 -1.824 1.00 . A A . 42 TRP HD1 1 1 17 12599 1 1 42 TRP HE1 H 13.555 -3.901 0.378 1.00 . A A . 42 TRP HE1 1 1 17 12600 1 1 42 TRP HE3 H 8.714 -2.041 1.546 1.00 . A A . 42 TRP HE3 1 1 17 12601 1 1 42 TRP HH2 H 11.289 -3.123 4.797 1.00 . A A . 42 TRP HH2 1 1 17 12602 1 1 42 TRP HZ2 H 13.009 -3.901 3.133 1.00 . A A . 42 TRP HZ2 1 1 17 12603 1 1 42 TRP HZ3 H 9.168 -2.102 3.968 1.00 . A A . 42 TRP HZ3 1 1 17 12604 1 1 42 TRP N N 9.432 -4.373 -2.864 1.00 . A A . 42 TRP N 1 1 17 12605 1 1 42 TRP NE1 N 12.637 -3.494 0.327 1.00 . A A . 42 TRP NE1 1 1 17 12606 1 1 42 TRP O O 7.367 -2.260 -3.284 1.00 . A A . 42 TRP O 1 1 17 12607 1 1 43 LYS C C 4.473 -2.336 -1.365 1.00 . A A . 43 LYS C 1 1 17 12608 1 1 43 LYS CA C 4.993 -3.315 -2.398 1.00 . A A . 43 LYS CA 1 1 17 12609 1 1 43 LYS CB C 4.036 -4.503 -2.518 1.00 . A A . 43 LYS CB 1 1 17 12610 1 1 43 LYS CD C 5.484 -5.612 -4.329 1.00 . A A . 43 LYS CD 1 1 17 12611 1 1 43 LYS CE C 4.567 -5.487 -5.567 1.00 . A A . 43 LYS CE 1 1 17 12612 1 1 43 LYS CG C 4.767 -5.761 -2.973 1.00 . A A . 43 LYS CG 1 1 17 12613 1 1 43 LYS H H 6.385 -4.452 -1.266 1.00 . A A . 43 LYS H 1 1 17 12614 1 1 43 LYS HA H 5.038 -2.847 -3.380 1.00 . A A . 43 LYS HA 1 1 17 12615 1 1 43 LYS HB2 H 3.628 -4.712 -1.537 1.00 . A A . 43 LYS HB2 1 1 17 12616 1 1 43 LYS HB3 H 3.203 -4.261 -3.174 1.00 . A A . 43 LYS HB3 1 1 17 12617 1 1 43 LYS HD2 H 6.213 -4.802 -4.320 1.00 . A A . 43 LYS HD2 1 1 17 12618 1 1 43 LYS HD3 H 6.035 -6.543 -4.449 1.00 . A A . 43 LYS HD3 1 1 17 12619 1 1 43 LYS HE2 H 5.180 -5.717 -6.440 1.00 . A A . 43 LYS HE2 1 1 17 12620 1 1 43 LYS HE3 H 3.772 -6.234 -5.514 1.00 . A A . 43 LYS HE3 1 1 17 12621 1 1 43 LYS HG2 H 5.417 -6.029 -2.132 1.00 . A A . 43 LYS HG2 1 1 17 12622 1 1 43 LYS HG3 H 4.089 -6.591 -3.067 1.00 . A A . 43 LYS HG3 1 1 17 12623 1 1 43 LYS HZ1 H 4.321 -3.760 -6.685 1.00 . A A . 43 LYS HZ1 1 1 17 12624 1 1 43 LYS HZ2 H 2.948 -4.221 -5.829 1.00 . A A . 43 LYS HZ2 1 1 17 12625 1 1 43 LYS N N 6.316 -3.732 -1.980 1.00 . A A . 43 LYS N 1 1 17 12626 1 1 43 LYS NZ N 3.975 -4.142 -5.793 1.00 . A A . 43 LYS NZ 1 1 17 12627 1 1 43 LYS O O 4.532 -2.611 -0.167 1.00 . A A . 43 LYS O 1 1 17 12628 1 1 44 CYS C C 1.754 -1.292 -0.826 1.00 . A A . 44 CYS C 1 1 17 12629 1 1 44 CYS CA C 3.001 -0.446 -1.046 1.00 . A A . 44 CYS CA 1 1 17 12630 1 1 44 CYS CB C 2.674 0.835 -1.796 1.00 . A A . 44 CYS CB 1 1 17 12631 1 1 44 CYS H H 3.926 -1.080 -2.834 1.00 . A A . 44 CYS H 1 1 17 12632 1 1 44 CYS HA H 3.433 -0.167 -0.093 1.00 . A A . 44 CYS HA 1 1 17 12633 1 1 44 CYS HB2 H 3.547 1.481 -1.717 1.00 . A A . 44 CYS HB2 1 1 17 12634 1 1 44 CYS HB3 H 2.479 0.604 -2.836 1.00 . A A . 44 CYS HB3 1 1 17 12635 1 1 44 CYS N N 3.929 -1.224 -1.838 1.00 . A A . 44 CYS N 1 1 17 12636 1 1 44 CYS O O 1.106 -1.660 -1.800 1.00 . A A . 44 CYS O 1 1 17 12637 1 1 44 CYS SG S 1.232 1.696 -1.142 1.00 . A A . 44 CYS SG 1 1 17 12638 1 1 45 PHE C C -0.753 -1.240 1.302 1.00 . A A . 45 PHE C 1 1 17 12639 1 1 45 PHE CA C 0.203 -2.303 0.782 1.00 . A A . 45 PHE CA 1 1 17 12640 1 1 45 PHE CB C 0.443 -3.367 1.860 1.00 . A A . 45 PHE CB 1 1 17 12641 1 1 45 PHE CD1 C 1.922 -4.991 0.600 1.00 . A A . 45 PHE CD1 1 1 17 12642 1 1 45 PHE CD2 C -0.123 -5.823 1.617 1.00 . A A . 45 PHE CD2 1 1 17 12643 1 1 45 PHE CE1 C 2.253 -6.299 0.204 1.00 . A A . 45 PHE CE1 1 1 17 12644 1 1 45 PHE CE2 C 0.185 -7.123 1.183 1.00 . A A . 45 PHE CE2 1 1 17 12645 1 1 45 PHE CG C 0.752 -4.756 1.342 1.00 . A A . 45 PHE CG 1 1 17 12646 1 1 45 PHE CZ C 1.378 -7.363 0.481 1.00 . A A . 45 PHE CZ 1 1 17 12647 1 1 45 PHE H H 2.019 -1.299 1.192 1.00 . A A . 45 PHE H 1 1 17 12648 1 1 45 PHE HA H -0.249 -2.783 -0.089 1.00 . A A . 45 PHE HA 1 1 17 12649 1 1 45 PHE HB2 H 1.248 -3.020 2.499 1.00 . A A . 45 PHE HB2 1 1 17 12650 1 1 45 PHE HB3 H -0.440 -3.447 2.490 1.00 . A A . 45 PHE HB3 1 1 17 12651 1 1 45 PHE HD1 H 2.592 -4.169 0.392 1.00 . A A . 45 PHE HD1 1 1 17 12652 1 1 45 PHE HD2 H -1.051 -5.646 2.136 1.00 . A A . 45 PHE HD2 1 1 17 12653 1 1 45 PHE HE1 H 3.181 -6.498 -0.307 1.00 . A A . 45 PHE HE1 1 1 17 12654 1 1 45 PHE HE2 H -0.497 -7.938 1.387 1.00 . A A . 45 PHE HE2 1 1 17 12655 1 1 45 PHE HZ H 1.615 -8.360 0.138 1.00 . A A . 45 PHE HZ 1 1 17 12656 1 1 45 PHE N N 1.451 -1.647 0.425 1.00 . A A . 45 PHE N 1 1 17 12657 1 1 45 PHE O O -0.319 -0.276 1.934 1.00 . A A . 45 PHE O 1 1 17 12658 1 1 46 CYS C C -3.946 -1.492 2.522 1.00 . A A . 46 CYS C 1 1 17 12659 1 1 46 CYS CA C -3.134 -0.633 1.571 1.00 . A A . 46 CYS CA 1 1 17 12660 1 1 46 CYS CB C -4.033 -0.181 0.417 1.00 . A A . 46 CYS CB 1 1 17 12661 1 1 46 CYS H H -2.322 -2.322 0.628 1.00 . A A . 46 CYS H 1 1 17 12662 1 1 46 CYS HA H -2.792 0.219 2.165 1.00 . A A . 46 CYS HA 1 1 17 12663 1 1 46 CYS HB2 H -4.392 -1.075 -0.087 1.00 . A A . 46 CYS HB2 1 1 17 12664 1 1 46 CYS HB3 H -4.886 0.326 0.856 1.00 . A A . 46 CYS HB3 1 1 17 12665 1 1 46 CYS N N -2.047 -1.448 1.066 1.00 . A A . 46 CYS N 1 1 17 12666 1 1 46 CYS O O -3.924 -2.720 2.447 1.00 . A A . 46 CYS O 1 1 17 12667 1 1 46 CYS SG S -3.371 0.924 -0.858 1.00 . A A . 46 CYS SG 1 1 17 12668 1 1 47 TYR C C -6.699 -0.846 4.627 1.00 . A A . 47 TYR C 1 1 17 12669 1 1 47 TYR CA C -5.310 -1.444 4.559 1.00 . A A . 47 TYR CA 1 1 17 12670 1 1 47 TYR CB C -4.518 -1.057 5.804 1.00 . A A . 47 TYR CB 1 1 17 12671 1 1 47 TYR CD1 C -2.064 -1.278 5.200 1.00 . A A . 47 TYR CD1 1 1 17 12672 1 1 47 TYR CD2 C -3.054 -2.843 6.784 1.00 . A A . 47 TYR CD2 1 1 17 12673 1 1 47 TYR CE1 C -0.829 -1.932 5.329 1.00 . A A . 47 TYR CE1 1 1 17 12674 1 1 47 TYR CE2 C -1.810 -3.460 6.952 1.00 . A A . 47 TYR CE2 1 1 17 12675 1 1 47 TYR CG C -3.178 -1.740 5.923 1.00 . A A . 47 TYR CG 1 1 17 12676 1 1 47 TYR CZ C -0.709 -3.022 6.204 1.00 . A A . 47 TYR CZ 1 1 17 12677 1 1 47 TYR H H -4.556 0.188 3.453 1.00 . A A . 47 TYR H 1 1 17 12678 1 1 47 TYR HA H -5.362 -2.527 4.478 1.00 . A A . 47 TYR HA 1 1 17 12679 1 1 47 TYR HB2 H -4.356 0.015 5.754 1.00 . A A . 47 TYR HB2 1 1 17 12680 1 1 47 TYR HB3 H -5.097 -1.261 6.703 1.00 . A A . 47 TYR HB3 1 1 17 12681 1 1 47 TYR HD1 H -2.149 -0.424 4.548 1.00 . A A . 47 TYR HD1 1 1 17 12682 1 1 47 TYR HD2 H -3.910 -3.217 7.325 1.00 . A A . 47 TYR HD2 1 1 17 12683 1 1 47 TYR HE1 H 0.012 -1.609 4.731 1.00 . A A . 47 TYR HE1 1 1 17 12684 1 1 47 TYR HE2 H -1.713 -4.292 7.635 1.00 . A A . 47 TYR HE2 1 1 17 12685 1 1 47 TYR HH H 0.344 -4.554 6.700 1.00 . A A . 47 TYR HH 1 1 17 12686 1 1 47 TYR N N -4.632 -0.824 3.441 1.00 . A A . 47 TYR N 1 1 17 12687 1 1 47 TYR O O -6.833 0.279 5.097 1.00 . A A . 47 TYR O 1 1 17 12688 1 1 47 TYR OH O 0.477 -3.670 6.324 1.00 . A A . 47 TYR OH 1 1 17 12689 1 1 48 PHE C C -9.820 -1.562 5.389 1.00 . A A . 48 PHE C 1 1 17 12690 1 1 48 PHE CA C -9.077 -1.061 4.150 1.00 . A A . 48 PHE CA 1 1 17 12691 1 1 48 PHE CB C -9.703 -1.603 2.860 1.00 . A A . 48 PHE CB 1 1 17 12692 1 1 48 PHE CD1 C -7.959 -1.243 1.051 1.00 . A A . 48 PHE CD1 1 1 17 12693 1 1 48 PHE CD2 C -10.098 -0.100 0.858 1.00 . A A . 48 PHE CD2 1 1 17 12694 1 1 48 PHE CE1 C -7.575 -0.724 -0.196 1.00 . A A . 48 PHE CE1 1 1 17 12695 1 1 48 PHE CE2 C -9.734 0.366 -0.418 1.00 . A A . 48 PHE CE2 1 1 17 12696 1 1 48 PHE CG C -9.237 -0.958 1.567 1.00 . A A . 48 PHE CG 1 1 17 12697 1 1 48 PHE CZ C -8.486 0.019 -0.961 1.00 . A A . 48 PHE CZ 1 1 17 12698 1 1 48 PHE H H -7.594 -2.507 3.827 1.00 . A A . 48 PHE H 1 1 17 12699 1 1 48 PHE HA H -9.111 0.026 4.139 1.00 . A A . 48 PHE HA 1 1 17 12700 1 1 48 PHE HB2 H -9.519 -2.670 2.784 1.00 . A A . 48 PHE HB2 1 1 17 12701 1 1 48 PHE HB3 H -10.771 -1.494 2.936 1.00 . A A . 48 PHE HB3 1 1 17 12702 1 1 48 PHE HD1 H -7.272 -1.876 1.593 1.00 . A A . 48 PHE HD1 1 1 17 12703 1 1 48 PHE HD2 H -11.052 0.195 1.273 1.00 . A A . 48 PHE HD2 1 1 17 12704 1 1 48 PHE HE1 H -6.587 -0.908 -0.581 1.00 . A A . 48 PHE HE1 1 1 17 12705 1 1 48 PHE HE2 H -10.418 0.988 -0.979 1.00 . A A . 48 PHE HE2 1 1 17 12706 1 1 48 PHE HZ H -8.216 0.344 -1.955 1.00 . A A . 48 PHE HZ 1 1 17 12707 1 1 48 PHE N N -7.724 -1.566 4.181 1.00 . A A . 48 PHE N 1 1 17 12708 1 1 48 PHE O O -9.262 -2.309 6.187 1.00 . A A . 48 PHE O 1 1 17 12709 1 1 49 ASN C C -11.636 -1.949 7.864 1.00 . A A . 49 ASN C 1 1 17 12710 1 1 49 ASN CA C -12.067 -1.891 6.391 1.00 . A A . 49 ASN CA 1 1 17 12711 1 1 49 ASN CB C -12.374 -3.309 5.866 1.00 . A A . 49 ASN CB 1 1 17 12712 1 1 49 ASN CG C -12.856 -3.316 4.418 1.00 . A A . 49 ASN CG 1 1 17 12713 1 1 49 ASN H H -11.485 -0.581 4.828 1.00 . A A . 49 ASN H 1 1 17 12714 1 1 49 ASN HA H -12.981 -1.300 6.365 1.00 . A A . 49 ASN HA 1 1 17 12715 1 1 49 ASN HB2 H -11.473 -3.921 5.937 1.00 . A A . 49 ASN HB2 1 1 17 12716 1 1 49 ASN HB3 H -13.141 -3.777 6.481 1.00 . A A . 49 ASN HB3 1 1 17 12717 1 1 49 ASN HD21 H -14.729 -2.709 4.949 1.00 . A A . 49 ASN HD21 1 1 17 12718 1 1 49 ASN HD22 H -14.453 -2.963 3.238 1.00 . A A . 49 ASN HD22 1 1 17 12719 1 1 49 ASN N N -11.109 -1.236 5.498 1.00 . A A . 49 ASN N 1 1 17 12720 1 1 49 ASN ND2 N -14.113 -2.954 4.187 1.00 . A A . 49 ASN ND2 1 1 17 12721 1 1 49 ASN O O -12.140 -2.792 8.612 1.00 . A A . 49 ASN O 1 1 17 12722 1 1 49 ASN OD1 O -12.097 -3.633 3.507 1.00 . A A . 49 ASN OD1 1 1 17 12723 1 1 50 CYS C C -11.019 -0.878 10.760 1.00 . A A . 50 CYS C 1 1 17 12724 1 1 50 CYS CA C -10.115 -1.322 9.619 1.00 . A A . 50 CYS CA 1 1 17 12725 1 1 50 CYS CB C -8.691 -0.804 9.765 1.00 . A A . 50 CYS CB 1 1 17 12726 1 1 50 CYS H H -10.307 -0.396 7.691 1.00 . A A . 50 CYS H 1 1 17 12727 1 1 50 CYS HA H -9.994 -2.385 9.718 1.00 . A A . 50 CYS HA 1 1 17 12728 1 1 50 CYS HB2 H -8.120 -0.987 8.857 1.00 . A A . 50 CYS HB2 1 1 17 12729 1 1 50 CYS HB3 H -8.712 0.258 9.973 1.00 . A A . 50 CYS HB3 1 1 17 12730 1 1 50 CYS N N -10.714 -1.088 8.312 1.00 . A A . 50 CYS N 1 1 17 12731 1 1 50 CYS O O -11.492 -1.761 11.541 1.00 . A A . 50 CYS O 1 1 17 12732 1 1 50 CYS OXT O -11.295 0.351 10.928 1.00 . A A . 50 CYS OXT 1 1 17 12733 1 1 50 CYS SG S -7.924 -1.693 11.143 1.00 . A A . 50 CYS SG 1 1 18 12734 1 1 1 LEU C C -9.557 -4.284 9.286 1.00 . A A . 1 LEU C 1 1 18 12735 1 1 1 LEU CA C -10.441 -4.858 10.392 1.00 . A A . 1 LEU CA 1 1 18 12736 1 1 1 LEU CB C -10.269 -6.382 10.521 1.00 . A A . 1 LEU CB 1 1 18 12737 1 1 1 LEU CD1 C -9.857 -8.582 9.409 1.00 . A A . 1 LEU CD1 1 1 18 12738 1 1 1 LEU CD2 C -12.013 -7.436 8.961 1.00 . A A . 1 LEU CD2 1 1 18 12739 1 1 1 LEU CG C -10.522 -7.211 9.243 1.00 . A A . 1 LEU CG 1 1 18 12740 1 1 1 LEU H1 H -12.152 -4.823 9.249 1.00 . A A . 1 LEU H1 1 1 18 12741 1 1 1 LEU H2 H -12.433 -4.849 10.907 1.00 . A A . 1 LEU H2 1 1 18 12742 1 1 1 LEU H3 H -11.910 -3.433 10.165 1.00 . A A . 1 LEU H3 1 1 18 12743 1 1 1 LEU HA H -10.135 -4.411 11.340 1.00 . A A . 1 LEU HA 1 1 18 12744 1 1 1 LEU HB2 H -9.235 -6.549 10.827 1.00 . A A . 1 LEU HB2 1 1 18 12745 1 1 1 LEU HB3 H -10.908 -6.754 11.324 1.00 . A A . 1 LEU HB3 1 1 18 12746 1 1 1 LEU HD11 H -10.278 -9.104 10.269 1.00 . A A . 1 LEU HD11 1 1 18 12747 1 1 1 LEU HD12 H -10.017 -9.185 8.514 1.00 . A A . 1 LEU HD12 1 1 18 12748 1 1 1 LEU HD13 H -8.783 -8.463 9.556 1.00 . A A . 1 LEU HD13 1 1 18 12749 1 1 1 LEU HD21 H -12.502 -7.863 9.838 1.00 . A A . 1 LEU HD21 1 1 18 12750 1 1 1 LEU HD22 H -12.513 -6.513 8.683 1.00 . A A . 1 LEU HD22 1 1 18 12751 1 1 1 LEU HD23 H -12.124 -8.135 8.129 1.00 . A A . 1 LEU HD23 1 1 18 12752 1 1 1 LEU HG H -10.063 -6.732 8.378 1.00 . A A . 1 LEU HG 1 1 18 12753 1 1 1 LEU N N -11.838 -4.461 10.161 1.00 . A A . 1 LEU N 1 1 18 12754 1 1 1 LEU O O -10.073 -3.922 8.235 1.00 . A A . 1 LEU O 1 1 18 12755 1 1 2 CYS C C -7.059 -4.527 7.381 1.00 . A A . 2 CYS C 1 1 18 12756 1 1 2 CYS CA C -7.303 -3.597 8.575 1.00 . A A . 2 CYS CA 1 1 18 12757 1 1 2 CYS CB C -6.018 -3.186 9.324 1.00 . A A . 2 CYS CB 1 1 18 12758 1 1 2 CYS H H -7.870 -4.508 10.389 1.00 . A A . 2 CYS H 1 1 18 12759 1 1 2 CYS HA H -7.748 -2.679 8.190 1.00 . A A . 2 CYS HA 1 1 18 12760 1 1 2 CYS HB2 H -5.386 -4.065 9.443 1.00 . A A . 2 CYS HB2 1 1 18 12761 1 1 2 CYS HB3 H -5.476 -2.453 8.743 1.00 . A A . 2 CYS HB3 1 1 18 12762 1 1 2 CYS N N -8.249 -4.189 9.509 1.00 . A A . 2 CYS N 1 1 18 12763 1 1 2 CYS O O -6.060 -5.239 7.335 1.00 . A A . 2 CYS O 1 1 18 12764 1 1 2 CYS SG S -6.213 -2.511 10.998 1.00 . A A . 2 CYS SG 1 1 18 12765 1 1 3 ASN C C -7.052 -5.896 4.459 1.00 . A A . 3 ASN C 1 1 18 12766 1 1 3 ASN CA C -8.158 -5.683 5.501 1.00 . A A . 3 ASN CA 1 1 18 12767 1 1 3 ASN CB C -9.453 -5.501 4.679 1.00 . A A . 3 ASN CB 1 1 18 12768 1 1 3 ASN CG C -10.650 -5.004 5.463 1.00 . A A . 3 ASN CG 1 1 18 12769 1 1 3 ASN H H -8.769 -3.925 6.542 1.00 . A A . 3 ASN H 1 1 18 12770 1 1 3 ASN HA H -8.227 -6.581 6.112 1.00 . A A . 3 ASN HA 1 1 18 12771 1 1 3 ASN HB2 H -9.260 -4.758 3.903 1.00 . A A . 3 ASN HB2 1 1 18 12772 1 1 3 ASN HB3 H -9.746 -6.421 4.175 1.00 . A A . 3 ASN HB3 1 1 18 12773 1 1 3 ASN HD21 H -11.363 -6.881 5.787 1.00 . A A . 3 ASN HD21 1 1 18 12774 1 1 3 ASN HD22 H -12.352 -5.573 6.396 1.00 . A A . 3 ASN HD22 1 1 18 12775 1 1 3 ASN N N -7.964 -4.526 6.394 1.00 . A A . 3 ASN N 1 1 18 12776 1 1 3 ASN ND2 N -11.512 -5.895 5.943 1.00 . A A . 3 ASN ND2 1 1 18 12777 1 1 3 ASN O O -7.289 -6.632 3.500 1.00 . A A . 3 ASN O 1 1 18 12778 1 1 3 ASN OD1 O -10.807 -3.795 5.602 1.00 . A A . 3 ASN OD1 1 1 18 12779 1 1 4 GLU C C -4.897 -5.851 2.415 1.00 . A A . 4 GLU C 1 1 18 12780 1 1 4 GLU CA C -4.667 -5.500 3.888 1.00 . A A . 4 GLU CA 1 1 18 12781 1 1 4 GLU CB C -3.797 -6.477 4.675 1.00 . A A . 4 GLU CB 1 1 18 12782 1 1 4 GLU CD C -1.413 -7.318 4.710 1.00 . A A . 4 GLU CD 1 1 18 12783 1 1 4 GLU CG C -2.396 -6.336 4.088 1.00 . A A . 4 GLU CG 1 1 18 12784 1 1 4 GLU H H -5.704 -4.852 5.491 1.00 . A A . 4 GLU H 1 1 18 12785 1 1 4 GLU HA H -4.147 -4.540 3.915 1.00 . A A . 4 GLU HA 1 1 18 12786 1 1 4 GLU HB2 H -3.780 -6.218 5.736 1.00 . A A . 4 GLU HB2 1 1 18 12787 1 1 4 GLU HB3 H -4.169 -7.495 4.557 1.00 . A A . 4 GLU HB3 1 1 18 12788 1 1 4 GLU HG2 H -2.559 -6.491 3.033 1.00 . A A . 4 GLU HG2 1 1 18 12789 1 1 4 GLU HG3 H -1.967 -5.337 4.183 1.00 . A A . 4 GLU HG3 1 1 18 12790 1 1 4 GLU N N -5.899 -5.234 4.585 1.00 . A A . 4 GLU N 1 1 18 12791 1 1 4 GLU O O -5.005 -7.026 2.065 1.00 . A A . 4 GLU O 1 1 18 12792 1 1 4 GLU OE1 O -1.598 -8.631 4.424 1.00 . A A . 4 GLU OE1 1 1 18 12793 1 1 4 GLU OE2 O -0.514 -6.871 5.423 1.00 . A A . 4 GLU OE2 1 1 18 12794 1 1 5 ARG C C -3.820 -4.566 -0.505 1.00 . A A . 5 ARG C 1 1 18 12795 1 1 5 ARG CA C -5.146 -4.954 0.131 1.00 . A A . 5 ARG CA 1 1 18 12796 1 1 5 ARG CB C -6.260 -4.018 -0.347 1.00 . A A . 5 ARG CB 1 1 18 12797 1 1 5 ARG CD C -8.456 -5.295 -0.103 1.00 . A A . 5 ARG CD 1 1 18 12798 1 1 5 ARG CG C -7.374 -4.783 -1.066 1.00 . A A . 5 ARG CG 1 1 18 12799 1 1 5 ARG CZ C -7.785 -7.639 0.513 1.00 . A A . 5 ARG CZ 1 1 18 12800 1 1 5 ARG H H -4.691 -3.941 1.925 1.00 . A A . 5 ARG H 1 1 18 12801 1 1 5 ARG HA H -5.371 -5.985 -0.130 1.00 . A A . 5 ARG HA 1 1 18 12802 1 1 5 ARG HB2 H -6.675 -3.454 0.487 1.00 . A A . 5 ARG HB2 1 1 18 12803 1 1 5 ARG HB3 H -5.844 -3.300 -1.058 1.00 . A A . 5 ARG HB3 1 1 18 12804 1 1 5 ARG HD2 H -8.816 -4.457 0.497 1.00 . A A . 5 ARG HD2 1 1 18 12805 1 1 5 ARG HD3 H -9.312 -5.661 -0.673 1.00 . A A . 5 ARG HD3 1 1 18 12806 1 1 5 ARG HG2 H -7.811 -4.083 -1.775 1.00 . A A . 5 ARG HG2 1 1 18 12807 1 1 5 ARG HG3 H -6.947 -5.609 -1.633 1.00 . A A . 5 ARG HG3 1 1 18 12808 1 1 5 ARG HH11 H -8.567 -7.497 -1.354 1.00 . A A . 5 ARG HH11 1 1 18 12809 1 1 5 ARG HH12 H -8.072 -9.101 -0.901 1.00 . A A . 5 ARG HH12 1 1 18 12810 1 1 5 ARG HH21 H -6.788 -7.978 2.227 1.00 . A A . 5 ARG HH21 1 1 18 12811 1 1 5 ARG HH22 H -7.063 -9.420 1.273 1.00 . A A . 5 ARG HH22 1 1 18 12812 1 1 5 ARG N N -4.987 -4.838 1.567 1.00 . A A . 5 ARG N 1 1 18 12813 1 1 5 ARG NE N -7.941 -6.338 0.801 1.00 . A A . 5 ARG NE 1 1 18 12814 1 1 5 ARG NH1 N -8.175 -8.125 -0.669 1.00 . A A . 5 ARG NH1 1 1 18 12815 1 1 5 ARG NH2 N -7.224 -8.438 1.423 1.00 . A A . 5 ARG NH2 1 1 18 12816 1 1 5 ARG O O -3.075 -3.790 0.097 1.00 . A A . 5 ARG O 1 1 18 12817 1 1 6 PRO C C -1.945 -3.585 -2.839 1.00 . A A . 6 PRO C 1 1 18 12818 1 1 6 PRO CA C -2.165 -4.961 -2.209 1.00 . A A . 6 PRO CA 1 1 18 12819 1 1 6 PRO CB C -1.990 -6.115 -3.201 1.00 . A A . 6 PRO CB 1 1 18 12820 1 1 6 PRO CD C -4.278 -6.011 -2.512 1.00 . A A . 6 PRO CD 1 1 18 12821 1 1 6 PRO CG C -3.407 -6.325 -3.728 1.00 . A A . 6 PRO CG 1 1 18 12822 1 1 6 PRO HA H -1.509 -5.095 -1.363 1.00 . A A . 6 PRO HA 1 1 18 12823 1 1 6 PRO HB2 H -1.281 -5.903 -4.004 1.00 . A A . 6 PRO HB2 1 1 18 12824 1 1 6 PRO HB3 H -1.677 -7.009 -2.657 1.00 . A A . 6 PRO HB3 1 1 18 12825 1 1 6 PRO HD2 H -5.198 -5.540 -2.852 1.00 . A A . 6 PRO HD2 1 1 18 12826 1 1 6 PRO HD3 H -4.484 -6.934 -1.971 1.00 . A A . 6 PRO HD3 1 1 18 12827 1 1 6 PRO HG2 H -3.611 -5.598 -4.514 1.00 . A A . 6 PRO HG2 1 1 18 12828 1 1 6 PRO HG3 H -3.565 -7.336 -4.105 1.00 . A A . 6 PRO HG3 1 1 18 12829 1 1 6 PRO N N -3.496 -5.103 -1.688 1.00 . A A . 6 PRO N 1 1 18 12830 1 1 6 PRO O O -2.847 -2.743 -2.902 1.00 . A A . 6 PRO O 1 1 18 12831 1 1 7 SER C C -1.147 -2.458 -5.543 1.00 . A A . 7 SER C 1 1 18 12832 1 1 7 SER CA C -0.419 -2.267 -4.214 1.00 . A A . 7 SER CA 1 1 18 12833 1 1 7 SER CB C 1.086 -2.248 -4.452 1.00 . A A . 7 SER CB 1 1 18 12834 1 1 7 SER H H -0.024 -4.097 -3.259 1.00 . A A . 7 SER H 1 1 18 12835 1 1 7 SER HA H -0.696 -1.309 -3.775 1.00 . A A . 7 SER HA 1 1 18 12836 1 1 7 SER HB2 H 1.222 -1.504 -5.227 1.00 . A A . 7 SER HB2 1 1 18 12837 1 1 7 SER HB3 H 1.616 -1.935 -3.558 1.00 . A A . 7 SER HB3 1 1 18 12838 1 1 7 SER HG H 0.903 -3.829 -5.534 1.00 . A A . 7 SER HG 1 1 18 12839 1 1 7 SER N N -0.730 -3.383 -3.348 1.00 . A A . 7 SER N 1 1 18 12840 1 1 7 SER O O -0.701 -3.262 -6.363 1.00 . A A . 7 SER O 1 1 18 12841 1 1 7 SER OG O 1.547 -3.519 -4.877 1.00 . A A . 7 SER OG 1 1 18 12842 1 1 8 GLN C C -2.739 -0.328 -7.648 1.00 . A A . 8 GLN C 1 1 18 12843 1 1 8 GLN CA C -2.989 -1.678 -6.983 1.00 . A A . 8 GLN CA 1 1 18 12844 1 1 8 GLN CB C -4.467 -1.882 -6.643 1.00 . A A . 8 GLN CB 1 1 18 12845 1 1 8 GLN CD C -6.144 -3.390 -5.462 1.00 . A A . 8 GLN CD 1 1 18 12846 1 1 8 GLN CG C -4.699 -3.216 -5.918 1.00 . A A . 8 GLN CG 1 1 18 12847 1 1 8 GLN H H -2.576 -1.147 -4.994 1.00 . A A . 8 GLN H 1 1 18 12848 1 1 8 GLN HA H -2.673 -2.470 -7.662 1.00 . A A . 8 GLN HA 1 1 18 12849 1 1 8 GLN HB2 H -4.838 -1.069 -6.022 1.00 . A A . 8 GLN HB2 1 1 18 12850 1 1 8 GLN HB3 H -5.017 -1.864 -7.573 1.00 . A A . 8 GLN HB3 1 1 18 12851 1 1 8 GLN HE21 H -6.853 -3.170 -7.358 1.00 . A A . 8 GLN HE21 1 1 18 12852 1 1 8 GLN HE22 H -8.054 -3.429 -6.106 1.00 . A A . 8 GLN HE22 1 1 18 12853 1 1 8 GLN HG2 H -4.414 -4.034 -6.575 1.00 . A A . 8 GLN HG2 1 1 18 12854 1 1 8 GLN HG3 H -4.081 -3.266 -5.026 1.00 . A A . 8 GLN HG3 1 1 18 12855 1 1 8 GLN N N -2.227 -1.713 -5.749 1.00 . A A . 8 GLN N 1 1 18 12856 1 1 8 GLN NE2 N -7.093 -3.321 -6.390 1.00 . A A . 8 GLN NE2 1 1 18 12857 1 1 8 GLN O O -2.359 -0.250 -8.812 1.00 . A A . 8 GLN O 1 1 18 12858 1 1 8 GLN OE1 O -6.409 -3.578 -4.278 1.00 . A A . 8 GLN OE1 1 1 18 12859 1 1 9 THR C C -1.227 2.364 -7.543 1.00 . A A . 9 THR C 1 1 18 12860 1 1 9 THR CA C -2.716 2.103 -7.368 1.00 . A A . 9 THR CA 1 1 18 12861 1 1 9 THR CB C -3.322 3.065 -6.346 1.00 . A A . 9 THR CB 1 1 18 12862 1 1 9 THR CG2 C -4.841 2.956 -6.440 1.00 . A A . 9 THR CG2 1 1 18 12863 1 1 9 THR H H -3.208 0.626 -5.920 1.00 . A A . 9 THR H 1 1 18 12864 1 1 9 THR HA H -3.209 2.233 -8.333 1.00 . A A . 9 THR HA 1 1 18 12865 1 1 9 THR HB H -3.007 4.083 -6.569 1.00 . A A . 9 THR HB 1 1 18 12866 1 1 9 THR HG1 H -3.419 2.025 -4.680 1.00 . A A . 9 THR HG1 1 1 18 12867 1 1 9 THR HG21 H -5.153 1.915 -6.409 1.00 . A A . 9 THR HG21 1 1 18 12868 1 1 9 THR HG22 H -5.299 3.487 -5.611 1.00 . A A . 9 THR HG22 1 1 18 12869 1 1 9 THR HG23 H -5.179 3.382 -7.384 1.00 . A A . 9 THR HG23 1 1 18 12870 1 1 9 THR N N -2.902 0.748 -6.878 1.00 . A A . 9 THR N 1 1 18 12871 1 1 9 THR O O -0.764 2.744 -8.618 1.00 . A A . 9 THR O 1 1 18 12872 1 1 9 THR OG1 O -2.885 2.747 -5.034 1.00 . A A . 9 THR OG1 1 1 18 12873 1 1 10 TRP C C 1.459 0.873 -7.326 1.00 . A A . 10 TRP C 1 1 18 12874 1 1 10 TRP CA C 0.980 2.086 -6.509 1.00 . A A . 10 TRP CA 1 1 18 12875 1 1 10 TRP CB C 1.501 2.097 -5.062 1.00 . A A . 10 TRP CB 1 1 18 12876 1 1 10 TRP CD1 C 4.003 1.838 -5.363 1.00 . A A . 10 TRP CD1 1 1 18 12877 1 1 10 TRP CD2 C 3.467 3.721 -4.268 1.00 . A A . 10 TRP CD2 1 1 18 12878 1 1 10 TRP CE2 C 4.873 3.757 -4.501 1.00 . A A . 10 TRP CE2 1 1 18 12879 1 1 10 TRP CE3 C 2.917 4.798 -3.540 1.00 . A A . 10 TRP CE3 1 1 18 12880 1 1 10 TRP CG C 2.928 2.518 -4.902 1.00 . A A . 10 TRP CG 1 1 18 12881 1 1 10 TRP CH2 C 5.092 5.895 -3.391 1.00 . A A . 10 TRP CH2 1 1 18 12882 1 1 10 TRP CZ2 C 5.676 4.826 -4.085 1.00 . A A . 10 TRP CZ2 1 1 18 12883 1 1 10 TRP CZ3 C 3.714 5.877 -3.109 1.00 . A A . 10 TRP CZ3 1 1 18 12884 1 1 10 TRP H H -0.954 1.870 -5.622 1.00 . A A . 10 TRP H 1 1 18 12885 1 1 10 TRP HA H 1.327 2.999 -6.998 1.00 . A A . 10 TRP HA 1 1 18 12886 1 1 10 TRP HB2 H 0.898 2.805 -4.490 1.00 . A A . 10 TRP HB2 1 1 18 12887 1 1 10 TRP HB3 H 1.347 1.112 -4.625 1.00 . A A . 10 TRP HB3 1 1 18 12888 1 1 10 TRP HD1 H 3.962 0.887 -5.875 1.00 . A A . 10 TRP HD1 1 1 18 12889 1 1 10 TRP HE1 H 6.078 2.329 -5.474 1.00 . A A . 10 TRP HE1 1 1 18 12890 1 1 10 TRP HE3 H 1.862 4.790 -3.319 1.00 . A A . 10 TRP HE3 1 1 18 12891 1 1 10 TRP HH2 H 5.709 6.727 -3.093 1.00 . A A . 10 TRP HH2 1 1 18 12892 1 1 10 TRP HZ2 H 6.725 4.845 -4.337 1.00 . A A . 10 TRP HZ2 1 1 18 12893 1 1 10 TRP HZ3 H 3.257 6.705 -2.575 1.00 . A A . 10 TRP HZ3 1 1 18 12894 1 1 10 TRP N N -0.469 2.103 -6.479 1.00 . A A . 10 TRP N 1 1 18 12895 1 1 10 TRP NE1 N 5.145 2.583 -5.166 1.00 . A A . 10 TRP NE1 1 1 18 12896 1 1 10 TRP O O 2.054 -0.058 -6.788 1.00 . A A . 10 TRP O 1 1 18 12897 1 1 11 SER C C 3.169 -0.116 -9.745 1.00 . A A . 11 SER C 1 1 18 12898 1 1 11 SER CA C 1.664 -0.232 -9.495 1.00 . A A . 11 SER CA 1 1 18 12899 1 1 11 SER CB C 0.873 -0.249 -10.809 1.00 . A A . 11 SER CB 1 1 18 12900 1 1 11 SER H H 0.669 1.615 -9.034 1.00 . A A . 11 SER H 1 1 18 12901 1 1 11 SER HA H 1.504 -1.178 -8.977 1.00 . A A . 11 SER HA 1 1 18 12902 1 1 11 SER HB2 H 0.805 0.754 -11.230 1.00 . A A . 11 SER HB2 1 1 18 12903 1 1 11 SER HB3 H 1.388 -0.887 -11.530 1.00 . A A . 11 SER HB3 1 1 18 12904 1 1 11 SER HG H -0.912 -0.306 -9.945 1.00 . A A . 11 SER HG 1 1 18 12905 1 1 11 SER N N 1.211 0.853 -8.636 1.00 . A A . 11 SER N 1 1 18 12906 1 1 11 SER O O 3.602 0.232 -10.841 1.00 . A A . 11 SER O 1 1 18 12907 1 1 11 SER OG O -0.415 -0.800 -10.612 1.00 . A A . 11 SER OG 1 1 18 12908 1 1 12 GLY C C 6.032 -0.935 -7.517 1.00 . A A . 12 GLY C 1 1 18 12909 1 1 12 GLY CA C 5.413 -0.452 -8.824 1.00 . A A . 12 GLY CA 1 1 18 12910 1 1 12 GLY H H 3.542 -0.647 -7.829 1.00 . A A . 12 GLY H 1 1 18 12911 1 1 12 GLY HA2 H 5.720 -1.118 -9.631 1.00 . A A . 12 GLY HA2 1 1 18 12912 1 1 12 GLY HA3 H 5.762 0.560 -9.043 1.00 . A A . 12 GLY HA3 1 1 18 12913 1 1 12 GLY N N 3.967 -0.435 -8.727 1.00 . A A . 12 GLY N 1 1 18 12914 1 1 12 GLY O O 5.367 -1.594 -6.707 1.00 . A A . 12 GLY O 1 1 18 12915 1 1 13 ASN C C 7.838 0.487 -5.227 1.00 . A A . 13 ASN C 1 1 18 12916 1 1 13 ASN CA C 8.020 -0.775 -6.066 1.00 . A A . 13 ASN CA 1 1 18 12917 1 1 13 ASN CB C 9.506 -1.029 -6.341 1.00 . A A . 13 ASN CB 1 1 18 12918 1 1 13 ASN CG C 10.261 -1.453 -5.082 1.00 . A A . 13 ASN CG 1 1 18 12919 1 1 13 ASN H H 7.752 -0.008 -8.013 1.00 . A A . 13 ASN H 1 1 18 12920 1 1 13 ASN HA H 7.614 -1.642 -5.546 1.00 . A A . 13 ASN HA 1 1 18 12921 1 1 13 ASN HB2 H 9.589 -1.837 -7.066 1.00 . A A . 13 ASN HB2 1 1 18 12922 1 1 13 ASN HB3 H 9.968 -0.135 -6.765 1.00 . A A . 13 ASN HB3 1 1 18 12923 1 1 13 ASN HD21 H 10.531 0.484 -4.412 1.00 . A A . 13 ASN HD21 1 1 18 12924 1 1 13 ASN HD22 H 11.268 -0.781 -3.466 1.00 . A A . 13 ASN HD22 1 1 18 12925 1 1 13 ASN N N 7.307 -0.594 -7.321 1.00 . A A . 13 ASN N 1 1 18 12926 1 1 13 ASN ND2 N 10.726 -0.508 -4.270 1.00 . A A . 13 ASN ND2 1 1 18 12927 1 1 13 ASN O O 7.676 1.577 -5.776 1.00 . A A . 13 ASN O 1 1 18 12928 1 1 13 ASN OD1 O 10.429 -2.647 -4.835 1.00 . A A . 13 ASN OD1 1 1 18 12929 1 1 14 CYS C C 8.870 2.466 -3.214 1.00 . A A . 14 CYS C 1 1 18 12930 1 1 14 CYS CA C 7.768 1.441 -2.955 1.00 . A A . 14 CYS CA 1 1 18 12931 1 1 14 CYS CB C 7.917 0.885 -1.541 1.00 . A A . 14 CYS CB 1 1 18 12932 1 1 14 CYS H H 7.949 -0.593 -3.540 1.00 . A A . 14 CYS H 1 1 18 12933 1 1 14 CYS HA H 6.789 1.909 -3.044 1.00 . A A . 14 CYS HA 1 1 18 12934 1 1 14 CYS HB2 H 7.213 0.064 -1.408 1.00 . A A . 14 CYS HB2 1 1 18 12935 1 1 14 CYS HB3 H 8.935 0.515 -1.426 1.00 . A A . 14 CYS HB3 1 1 18 12936 1 1 14 CYS N N 7.850 0.344 -3.907 1.00 . A A . 14 CYS N 1 1 18 12937 1 1 14 CYS O O 9.943 2.114 -3.709 1.00 . A A . 14 CYS O 1 1 18 12938 1 1 14 CYS SG S 7.632 2.077 -0.217 1.00 . A A . 14 CYS SG 1 1 18 12939 1 1 15 GLY C C 9.701 5.369 -1.475 1.00 . A A . 15 GLY C 1 1 18 12940 1 1 15 GLY CA C 9.538 4.828 -2.888 1.00 . A A . 15 GLY CA 1 1 18 12941 1 1 15 GLY H H 7.690 3.884 -2.438 1.00 . A A . 15 GLY H 1 1 18 12942 1 1 15 GLY HA2 H 10.511 4.511 -3.258 1.00 . A A . 15 GLY HA2 1 1 18 12943 1 1 15 GLY HA3 H 9.154 5.614 -3.537 1.00 . A A . 15 GLY HA3 1 1 18 12944 1 1 15 GLY N N 8.593 3.720 -2.856 1.00 . A A . 15 GLY N 1 1 18 12945 1 1 15 GLY O O 10.802 5.427 -0.936 1.00 . A A . 15 GLY O 1 1 18 12946 1 1 16 ASN C C 7.147 5.622 1.099 1.00 . A A . 16 ASN C 1 1 18 12947 1 1 16 ASN CA C 8.482 6.102 0.542 1.00 . A A . 16 ASN CA 1 1 18 12948 1 1 16 ASN CB C 8.651 7.617 0.717 1.00 . A A . 16 ASN CB 1 1 18 12949 1 1 16 ASN CG C 8.887 7.990 2.176 1.00 . A A . 16 ASN CG 1 1 18 12950 1 1 16 ASN H H 7.709 5.657 -1.378 1.00 . A A . 16 ASN H 1 1 18 12951 1 1 16 ASN HA H 9.290 5.604 1.082 1.00 . A A . 16 ASN HA 1 1 18 12952 1 1 16 ASN HB2 H 9.524 7.938 0.147 1.00 . A A . 16 ASN HB2 1 1 18 12953 1 1 16 ASN HB3 H 7.775 8.150 0.350 1.00 . A A . 16 ASN HB3 1 1 18 12954 1 1 16 ASN HD21 H 10.005 9.616 1.660 1.00 . A A . 16 ASN HD21 1 1 18 12955 1 1 16 ASN HD22 H 9.778 9.337 3.375 1.00 . A A . 16 ASN HD22 1 1 18 12956 1 1 16 ASN N N 8.573 5.734 -0.863 1.00 . A A . 16 ASN N 1 1 18 12957 1 1 16 ASN ND2 N 9.606 9.080 2.416 1.00 . A A . 16 ASN ND2 1 1 18 12958 1 1 16 ASN O O 6.092 5.959 0.557 1.00 . A A . 16 ASN O 1 1 18 12959 1 1 16 ASN OD1 O 8.408 7.317 3.084 1.00 . A A . 16 ASN OD1 1 1 18 12960 1 1 17 THR C C 5.089 5.541 3.300 1.00 . A A . 17 THR C 1 1 18 12961 1 1 17 THR CA C 5.974 4.369 2.839 1.00 . A A . 17 THR CA 1 1 18 12962 1 1 17 THR CB C 6.335 3.364 3.945 1.00 . A A . 17 THR CB 1 1 18 12963 1 1 17 THR CG2 C 6.904 4.021 5.206 1.00 . A A . 17 THR CG2 1 1 18 12964 1 1 17 THR H H 8.074 4.656 2.619 1.00 . A A . 17 THR H 1 1 18 12965 1 1 17 THR HA H 5.440 3.807 2.083 1.00 . A A . 17 THR HA 1 1 18 12966 1 1 17 THR HB H 7.091 2.687 3.547 1.00 . A A . 17 THR HB 1 1 18 12967 1 1 17 THR HG1 H 4.540 3.140 4.661 1.00 . A A . 17 THR HG1 1 1 18 12968 1 1 17 THR HG21 H 7.772 4.632 4.954 1.00 . A A . 17 THR HG21 1 1 18 12969 1 1 17 THR HG22 H 6.156 4.646 5.693 1.00 . A A . 17 THR HG22 1 1 18 12970 1 1 17 THR HG23 H 7.218 3.245 5.905 1.00 . A A . 17 THR HG23 1 1 18 12971 1 1 17 THR N N 7.182 4.858 2.191 1.00 . A A . 17 THR N 1 1 18 12972 1 1 17 THR O O 3.860 5.456 3.286 1.00 . A A . 17 THR O 1 1 18 12973 1 1 17 THR OG1 O 5.212 2.569 4.275 1.00 . A A . 17 THR OG1 1 1 18 12974 1 1 18 ALA C C 4.215 8.463 2.808 1.00 . A A . 18 ALA C 1 1 18 12975 1 1 18 ALA CA C 4.982 7.886 3.997 1.00 . A A . 18 ALA CA 1 1 18 12976 1 1 18 ALA CB C 5.946 8.919 4.585 1.00 . A A . 18 ALA CB 1 1 18 12977 1 1 18 ALA H H 6.721 6.716 3.628 1.00 . A A . 18 ALA H 1 1 18 12978 1 1 18 ALA HA H 4.231 7.639 4.751 1.00 . A A . 18 ALA HA 1 1 18 12979 1 1 18 ALA HB1 H 6.483 8.488 5.430 1.00 . A A . 18 ALA HB1 1 1 18 12980 1 1 18 ALA HB2 H 6.662 9.239 3.827 1.00 . A A . 18 ALA HB2 1 1 18 12981 1 1 18 ALA HB3 H 5.386 9.789 4.930 1.00 . A A . 18 ALA HB3 1 1 18 12982 1 1 18 ALA N N 5.706 6.674 3.650 1.00 . A A . 18 ALA N 1 1 18 12983 1 1 18 ALA O O 3.273 9.223 3.030 1.00 . A A . 18 ALA O 1 1 18 12984 1 1 19 HIS C C 2.779 7.311 0.148 1.00 . A A . 19 HIS C 1 1 18 12985 1 1 19 HIS CA C 3.785 8.433 0.390 1.00 . A A . 19 HIS CA 1 1 18 12986 1 1 19 HIS CB C 4.657 8.647 -0.851 1.00 . A A . 19 HIS CB 1 1 18 12987 1 1 19 HIS CD2 C 2.645 9.767 -2.100 1.00 . A A . 19 HIS CD2 1 1 18 12988 1 1 19 HIS CE1 C 3.576 9.959 -4.067 1.00 . A A . 19 HIS CE1 1 1 18 12989 1 1 19 HIS CG C 3.922 9.260 -2.022 1.00 . A A . 19 HIS CG 1 1 18 12990 1 1 19 HIS H H 5.348 7.460 1.447 1.00 . A A . 19 HIS H 1 1 18 12991 1 1 19 HIS HA H 3.245 9.361 0.581 1.00 . A A . 19 HIS HA 1 1 18 12992 1 1 19 HIS HB2 H 5.473 9.313 -0.604 1.00 . A A . 19 HIS HB2 1 1 18 12993 1 1 19 HIS HB3 H 5.090 7.693 -1.142 1.00 . A A . 19 HIS HB3 1 1 18 12994 1 1 19 HIS HD1 H 5.437 9.122 -3.551 1.00 . A A . 19 HIS HD1 1 1 18 12995 1 1 19 HIS HD2 H 1.913 9.797 -1.299 1.00 . A A . 19 HIS HD2 1 1 18 12996 1 1 19 HIS HE1 H 3.718 10.173 -5.119 1.00 . A A . 19 HIS HE1 1 1 18 12997 1 1 19 HIS N N 4.585 8.116 1.568 1.00 . A A . 19 HIS N 1 1 18 12998 1 1 19 HIS ND1 N 4.505 9.400 -3.275 1.00 . A A . 19 HIS ND1 1 1 18 12999 1 1 19 HIS NE2 N 2.440 10.203 -3.396 1.00 . A A . 19 HIS NE2 1 1 18 13000 1 1 19 HIS O O 1.611 7.603 -0.105 1.00 . A A . 19 HIS O 1 1 18 13001 1 1 20 CYS C C 1.055 5.076 0.883 1.00 . A A . 20 CYS C 1 1 18 13002 1 1 20 CYS CA C 2.345 4.876 0.107 1.00 . A A . 20 CYS CA 1 1 18 13003 1 1 20 CYS CB C 3.024 3.622 0.653 1.00 . A A . 20 CYS CB 1 1 18 13004 1 1 20 CYS H H 4.209 5.892 0.398 1.00 . A A . 20 CYS H 1 1 18 13005 1 1 20 CYS HA H 2.093 4.720 -0.940 1.00 . A A . 20 CYS HA 1 1 18 13006 1 1 20 CYS HB2 H 3.844 3.330 0.001 1.00 . A A . 20 CYS HB2 1 1 18 13007 1 1 20 CYS HB3 H 3.393 3.816 1.647 1.00 . A A . 20 CYS HB3 1 1 18 13008 1 1 20 CYS N N 3.220 6.047 0.225 1.00 . A A . 20 CYS N 1 1 18 13009 1 1 20 CYS O O -0.040 4.867 0.367 1.00 . A A . 20 CYS O 1 1 18 13010 1 1 20 CYS SG S 1.887 2.245 0.886 1.00 . A A . 20 CYS SG 1 1 18 13011 1 1 21 ASP C C -0.902 6.765 2.390 1.00 . A A . 21 ASP C 1 1 18 13012 1 1 21 ASP CA C 0.083 5.765 3.008 1.00 . A A . 21 ASP CA 1 1 18 13013 1 1 21 ASP CB C 0.651 6.277 4.349 1.00 . A A . 21 ASP CB 1 1 18 13014 1 1 21 ASP CG C -0.198 7.362 5.001 1.00 . A A . 21 ASP CG 1 1 18 13015 1 1 21 ASP H H 2.148 5.667 2.472 1.00 . A A . 21 ASP H 1 1 18 13016 1 1 21 ASP HA H -0.419 4.807 3.137 1.00 . A A . 21 ASP HA 1 1 18 13017 1 1 21 ASP HB2 H 0.770 5.441 5.041 1.00 . A A . 21 ASP HB2 1 1 18 13018 1 1 21 ASP HB3 H 1.636 6.719 4.195 1.00 . A A . 21 ASP HB3 1 1 18 13019 1 1 21 ASP N N 1.202 5.574 2.109 1.00 . A A . 21 ASP N 1 1 18 13020 1 1 21 ASP O O -2.111 6.563 2.446 1.00 . A A . 21 ASP O 1 1 18 13021 1 1 21 ASP OD1 O -1.343 6.931 5.586 1.00 . A A . 21 ASP OD1 1 1 18 13022 1 1 21 ASP OD2 O 0.189 8.534 4.957 1.00 . A A . 21 ASP OD2 1 1 18 13023 1 1 22 LYS C C -1.877 8.393 -0.076 1.00 . A A . 22 LYS C 1 1 18 13024 1 1 22 LYS CA C -1.224 8.878 1.207 1.00 . A A . 22 LYS CA 1 1 18 13025 1 1 22 LYS CB C -0.451 10.188 1.019 1.00 . A A . 22 LYS CB 1 1 18 13026 1 1 22 LYS CD C 0.851 11.840 2.539 1.00 . A A . 22 LYS CD 1 1 18 13027 1 1 22 LYS CE C 1.201 12.052 4.024 1.00 . A A . 22 LYS CE 1 1 18 13028 1 1 22 LYS CG C 0.223 10.459 2.358 1.00 . A A . 22 LYS CG 1 1 18 13029 1 1 22 LYS H H 0.614 7.860 1.625 1.00 . A A . 22 LYS H 1 1 18 13030 1 1 22 LYS HA H -2.014 9.093 1.924 1.00 . A A . 22 LYS HA 1 1 18 13031 1 1 22 LYS HB2 H 0.291 10.096 0.229 1.00 . A A . 22 LYS HB2 1 1 18 13032 1 1 22 LYS HB3 H -1.152 10.987 0.773 1.00 . A A . 22 LYS HB3 1 1 18 13033 1 1 22 LYS HD2 H 1.748 11.912 1.921 1.00 . A A . 22 LYS HD2 1 1 18 13034 1 1 22 LYS HD3 H 0.149 12.614 2.224 1.00 . A A . 22 LYS HD3 1 1 18 13035 1 1 22 LYS HE2 H 1.909 12.880 4.102 1.00 . A A . 22 LYS HE2 1 1 18 13036 1 1 22 LYS HE3 H 0.294 12.328 4.567 1.00 . A A . 22 LYS HE3 1 1 18 13037 1 1 22 LYS HG2 H -0.521 10.292 3.139 1.00 . A A . 22 LYS HG2 1 1 18 13038 1 1 22 LYS HG3 H 1.012 9.716 2.418 1.00 . A A . 22 LYS HG3 1 1 18 13039 1 1 22 LYS HZ1 H 1.139 10.044 4.515 1.00 . A A . 22 LYS HZ1 1 1 18 13040 1 1 22 LYS HZ2 H 2.689 10.632 4.233 1.00 . A A . 22 LYS HZ2 1 1 18 13041 1 1 22 LYS N N -0.386 7.830 1.776 1.00 . A A . 22 LYS N 1 1 18 13042 1 1 22 LYS NZ N 1.775 10.842 4.658 1.00 . A A . 22 LYS NZ 1 1 18 13043 1 1 22 LYS O O -3.072 8.600 -0.258 1.00 . A A . 22 LYS O 1 1 18 13044 1 1 23 GLN C C -2.887 6.142 -1.685 1.00 . A A . 23 GLN C 1 1 18 13045 1 1 23 GLN CA C -1.773 7.101 -2.109 1.00 . A A . 23 GLN CA 1 1 18 13046 1 1 23 GLN CB C -0.809 6.468 -3.111 1.00 . A A . 23 GLN CB 1 1 18 13047 1 1 23 GLN CD C 0.993 7.178 -4.803 1.00 . A A . 23 GLN CD 1 1 18 13048 1 1 23 GLN CG C 0.362 7.405 -3.428 1.00 . A A . 23 GLN CG 1 1 18 13049 1 1 23 GLN H H -0.159 7.521 -0.719 1.00 . A A . 23 GLN H 1 1 18 13050 1 1 23 GLN HA H -2.215 7.924 -2.663 1.00 . A A . 23 GLN HA 1 1 18 13051 1 1 23 GLN HB2 H -0.430 5.518 -2.729 1.00 . A A . 23 GLN HB2 1 1 18 13052 1 1 23 GLN HB3 H -1.390 6.287 -4.014 1.00 . A A . 23 GLN HB3 1 1 18 13053 1 1 23 GLN HE21 H 0.113 5.352 -5.078 1.00 . A A . 23 GLN HE21 1 1 18 13054 1 1 23 GLN HE22 H 1.128 5.929 -6.380 1.00 . A A . 23 GLN HE22 1 1 18 13055 1 1 23 GLN HG2 H -0.007 8.432 -3.424 1.00 . A A . 23 GLN HG2 1 1 18 13056 1 1 23 GLN HG3 H 1.114 7.307 -2.651 1.00 . A A . 23 GLN HG3 1 1 18 13057 1 1 23 GLN N N -1.131 7.707 -0.948 1.00 . A A . 23 GLN N 1 1 18 13058 1 1 23 GLN NE2 N 0.722 6.056 -5.466 1.00 . A A . 23 GLN NE2 1 1 18 13059 1 1 23 GLN O O -3.994 6.199 -2.214 1.00 . A A . 23 GLN O 1 1 18 13060 1 1 23 GLN OE1 O 1.729 8.039 -5.275 1.00 . A A . 23 GLN OE1 1 1 18 13061 1 1 24 CYS C C -4.862 5.116 0.341 1.00 . A A . 24 CYS C 1 1 18 13062 1 1 24 CYS CA C -3.626 4.374 -0.169 1.00 . A A . 24 CYS CA 1 1 18 13063 1 1 24 CYS CB C -3.016 3.501 0.926 1.00 . A A . 24 CYS CB 1 1 18 13064 1 1 24 CYS H H -1.687 5.258 -0.306 1.00 . A A . 24 CYS H 1 1 18 13065 1 1 24 CYS HA H -3.955 3.736 -0.992 1.00 . A A . 24 CYS HA 1 1 18 13066 1 1 24 CYS HB2 H -2.432 4.117 1.608 1.00 . A A . 24 CYS HB2 1 1 18 13067 1 1 24 CYS HB3 H -3.818 3.039 1.497 1.00 . A A . 24 CYS HB3 1 1 18 13068 1 1 24 CYS N N -2.623 5.291 -0.696 1.00 . A A . 24 CYS N 1 1 18 13069 1 1 24 CYS O O -5.981 4.654 0.116 1.00 . A A . 24 CYS O 1 1 18 13070 1 1 24 CYS SG S -1.985 2.149 0.329 1.00 . A A . 24 CYS SG 1 1 18 13071 1 1 25 GLN C C -6.567 7.720 0.337 1.00 . A A . 25 GLN C 1 1 18 13072 1 1 25 GLN CA C -5.824 7.041 1.495 1.00 . A A . 25 GLN CA 1 1 18 13073 1 1 25 GLN CB C -5.351 8.116 2.482 1.00 . A A . 25 GLN CB 1 1 18 13074 1 1 25 GLN CD C -4.436 8.635 4.763 1.00 . A A . 25 GLN CD 1 1 18 13075 1 1 25 GLN CG C -4.964 7.539 3.847 1.00 . A A . 25 GLN CG 1 1 18 13076 1 1 25 GLN H H -3.747 6.579 1.214 1.00 . A A . 25 GLN H 1 1 18 13077 1 1 25 GLN HA H -6.512 6.377 2.017 1.00 . A A . 25 GLN HA 1 1 18 13078 1 1 25 GLN HB2 H -4.504 8.659 2.059 1.00 . A A . 25 GLN HB2 1 1 18 13079 1 1 25 GLN HB3 H -6.167 8.825 2.639 1.00 . A A . 25 GLN HB3 1 1 18 13080 1 1 25 GLN HE21 H -6.299 9.395 5.041 1.00 . A A . 25 GLN HE21 1 1 18 13081 1 1 25 GLN HE22 H -4.998 10.232 5.868 1.00 . A A . 25 GLN HE22 1 1 18 13082 1 1 25 GLN HG2 H -5.836 7.085 4.314 1.00 . A A . 25 GLN HG2 1 1 18 13083 1 1 25 GLN HG3 H -4.204 6.773 3.724 1.00 . A A . 25 GLN HG3 1 1 18 13084 1 1 25 GLN N N -4.688 6.272 0.993 1.00 . A A . 25 GLN N 1 1 18 13085 1 1 25 GLN NE2 N -5.318 9.500 5.252 1.00 . A A . 25 GLN NE2 1 1 18 13086 1 1 25 GLN O O -7.791 7.670 0.263 1.00 . A A . 25 GLN O 1 1 18 13087 1 1 25 GLN OE1 O -3.238 8.724 5.021 1.00 . A A . 25 GLN OE1 1 1 18 13088 1 1 26 ASP C C -6.970 8.313 -2.722 1.00 . A A . 26 ASP C 1 1 18 13089 1 1 26 ASP CA C -6.404 9.200 -1.615 1.00 . A A . 26 ASP CA 1 1 18 13090 1 1 26 ASP CB C -5.347 10.161 -2.180 1.00 . A A . 26 ASP CB 1 1 18 13091 1 1 26 ASP CG C -4.890 11.223 -1.182 1.00 . A A . 26 ASP CG 1 1 18 13092 1 1 26 ASP H H -4.825 8.356 -0.445 1.00 . A A . 26 ASP H 1 1 18 13093 1 1 26 ASP HA H -7.217 9.799 -1.216 1.00 . A A . 26 ASP HA 1 1 18 13094 1 1 26 ASP HB2 H -4.477 9.600 -2.504 1.00 . A A . 26 ASP HB2 1 1 18 13095 1 1 26 ASP HB3 H -5.767 10.671 -3.046 1.00 . A A . 26 ASP HB3 1 1 18 13096 1 1 26 ASP N N -5.831 8.385 -0.553 1.00 . A A . 26 ASP N 1 1 18 13097 1 1 26 ASP O O -8.151 8.385 -3.070 1.00 . A A . 26 ASP O 1 1 18 13098 1 1 26 ASP OD1 O -5.869 11.861 -0.483 1.00 . A A . 26 ASP OD1 1 1 18 13099 1 1 26 ASP OD2 O -3.692 11.464 -1.059 1.00 . A A . 26 ASP OD2 1 1 18 13100 1 1 27 TRP C C -7.272 5.576 -4.187 1.00 . A A . 27 TRP C 1 1 18 13101 1 1 27 TRP CA C -6.401 6.778 -4.537 1.00 . A A . 27 TRP CA 1 1 18 13102 1 1 27 TRP CB C -5.122 6.238 -5.180 1.00 . A A . 27 TRP CB 1 1 18 13103 1 1 27 TRP CD1 C -3.642 8.293 -5.357 1.00 . A A . 27 TRP CD1 1 1 18 13104 1 1 27 TRP CD2 C -3.545 6.968 -7.154 1.00 . A A . 27 TRP CD2 1 1 18 13105 1 1 27 TRP CE2 C -2.506 7.931 -7.298 1.00 . A A . 27 TRP CE2 1 1 18 13106 1 1 27 TRP CE3 C -3.718 6.031 -8.189 1.00 . A A . 27 TRP CE3 1 1 18 13107 1 1 27 TRP CG C -4.169 7.159 -5.858 1.00 . A A . 27 TRP CG 1 1 18 13108 1 1 27 TRP CH2 C -1.749 6.865 -9.333 1.00 . A A . 27 TRP CH2 1 1 18 13109 1 1 27 TRP CZ2 C -1.622 7.901 -8.389 1.00 . A A . 27 TRP CZ2 1 1 18 13110 1 1 27 TRP CZ3 C -2.820 5.965 -9.263 1.00 . A A . 27 TRP CZ3 1 1 18 13111 1 1 27 TRP H H -5.173 7.406 -2.922 1.00 . A A . 27 TRP H 1 1 18 13112 1 1 27 TRP HA H -6.916 7.423 -5.250 1.00 . A A . 27 TRP HA 1 1 18 13113 1 1 27 TRP HB2 H -4.546 5.615 -4.501 1.00 . A A . 27 TRP HB2 1 1 18 13114 1 1 27 TRP HB3 H -5.477 5.590 -5.974 1.00 . A A . 27 TRP HB3 1 1 18 13115 1 1 27 TRP HD1 H -3.873 8.713 -4.395 1.00 . A A . 27 TRP HD1 1 1 18 13116 1 1 27 TRP HE1 H -2.072 9.559 -6.001 1.00 . A A . 27 TRP HE1 1 1 18 13117 1 1 27 TRP HE3 H -4.537 5.336 -8.140 1.00 . A A . 27 TRP HE3 1 1 18 13118 1 1 27 TRP HH2 H -1.024 6.719 -10.110 1.00 . A A . 27 TRP HH2 1 1 18 13119 1 1 27 TRP HZ2 H -0.830 8.627 -8.475 1.00 . A A . 27 TRP HZ2 1 1 18 13120 1 1 27 TRP HZ3 H -2.933 5.201 -10.017 1.00 . A A . 27 TRP HZ3 1 1 18 13121 1 1 27 TRP N N -6.100 7.503 -3.319 1.00 . A A . 27 TRP N 1 1 18 13122 1 1 27 TRP NE1 N -2.645 8.750 -6.192 1.00 . A A . 27 TRP NE1 1 1 18 13123 1 1 27 TRP O O -8.408 5.482 -4.655 1.00 . A A . 27 TRP O 1 1 18 13124 1 1 28 GLU C C -8.507 3.360 -2.389 1.00 . A A . 28 GLU C 1 1 18 13125 1 1 28 GLU CA C -7.256 3.297 -3.273 1.00 . A A . 28 GLU CA 1 1 18 13126 1 1 28 GLU CB C -6.151 2.305 -2.823 1.00 . A A . 28 GLU CB 1 1 18 13127 1 1 28 GLU CD C -4.972 0.095 -3.467 1.00 . A A . 28 GLU CD 1 1 18 13128 1 1 28 GLU CG C -6.253 0.938 -3.536 1.00 . A A . 28 GLU CG 1 1 18 13129 1 1 28 GLU H H -5.808 4.854 -2.995 1.00 . A A . 28 GLU H 1 1 18 13130 1 1 28 GLU HA H -7.587 2.996 -4.268 1.00 . A A . 28 GLU HA 1 1 18 13131 1 1 28 GLU HB2 H -5.181 2.725 -3.090 1.00 . A A . 28 GLU HB2 1 1 18 13132 1 1 28 GLU HB3 H -6.170 2.167 -1.741 1.00 . A A . 28 GLU HB3 1 1 18 13133 1 1 28 GLU HG2 H -7.083 0.367 -3.125 1.00 . A A . 28 GLU HG2 1 1 18 13134 1 1 28 GLU HG3 H -6.455 1.098 -4.595 1.00 . A A . 28 GLU HG3 1 1 18 13135 1 1 28 GLU N N -6.710 4.643 -3.407 1.00 . A A . 28 GLU N 1 1 18 13136 1 1 28 GLU O O -9.591 3.033 -2.867 1.00 . A A . 28 GLU O 1 1 18 13137 1 1 28 GLU OE1 O -4.017 0.385 -4.191 1.00 . A A . 28 GLU OE1 1 1 18 13138 1 1 28 GLU OE2 O -4.991 -0.973 -2.619 1.00 . A A . 28 GLU OE2 1 1 18 13139 1 1 29 LYS C C -9.325 3.883 1.105 1.00 . A A . 29 LYS C 1 1 18 13140 1 1 29 LYS CA C -9.284 4.531 -0.275 1.00 . A A . 29 LYS CA 1 1 18 13141 1 1 29 LYS CB C -10.646 4.809 -0.893 1.00 . A A . 29 LYS CB 1 1 18 13142 1 1 29 LYS CD C -11.639 5.866 -2.966 1.00 . A A . 29 LYS CD 1 1 18 13143 1 1 29 LYS CE C -11.641 7.093 -3.892 1.00 . A A . 29 LYS CE 1 1 18 13144 1 1 29 LYS CG C -10.525 5.943 -1.920 1.00 . A A . 29 LYS CG 1 1 18 13145 1 1 29 LYS H H -7.419 4.020 -0.845 1.00 . A A . 29 LYS H 1 1 18 13146 1 1 29 LYS HA H -8.840 5.508 -0.104 1.00 . A A . 29 LYS HA 1 1 18 13147 1 1 29 LYS HB2 H -11.129 3.911 -1.275 1.00 . A A . 29 LYS HB2 1 1 18 13148 1 1 29 LYS HB3 H -11.226 5.184 -0.067 1.00 . A A . 29 LYS HB3 1 1 18 13149 1 1 29 LYS HD2 H -11.498 4.953 -3.551 1.00 . A A . 29 LYS HD2 1 1 18 13150 1 1 29 LYS HD3 H -12.603 5.800 -2.459 1.00 . A A . 29 LYS HD3 1 1 18 13151 1 1 29 LYS HE2 H -12.345 6.907 -4.705 1.00 . A A . 29 LYS HE2 1 1 18 13152 1 1 29 LYS HE3 H -11.979 7.970 -3.335 1.00 . A A . 29 LYS HE3 1 1 18 13153 1 1 29 LYS HG2 H -10.559 6.897 -1.388 1.00 . A A . 29 LYS HG2 1 1 18 13154 1 1 29 LYS HG3 H -9.559 5.865 -2.411 1.00 . A A . 29 LYS HG3 1 1 18 13155 1 1 29 LYS HZ1 H -9.916 6.507 -4.864 1.00 . A A . 29 LYS HZ1 1 1 18 13156 1 1 29 LYS HZ2 H -10.384 8.089 -5.192 1.00 . A A . 29 LYS HZ2 1 1 18 13157 1 1 29 LYS N N -8.355 3.810 -1.136 1.00 . A A . 29 LYS N 1 1 18 13158 1 1 29 LYS NZ N -10.305 7.371 -4.458 1.00 . A A . 29 LYS NZ 1 1 18 13159 1 1 29 LYS O O -10.370 3.433 1.569 1.00 . A A . 29 LYS O 1 1 18 13160 1 1 30 ALA C C -7.690 4.004 4.149 1.00 . A A . 30 ALA C 1 1 18 13161 1 1 30 ALA CA C -7.921 3.074 2.959 1.00 . A A . 30 ALA CA 1 1 18 13162 1 1 30 ALA CB C -6.706 2.193 2.701 1.00 . A A . 30 ALA CB 1 1 18 13163 1 1 30 ALA H H -7.354 4.256 1.296 1.00 . A A . 30 ALA H 1 1 18 13164 1 1 30 ALA HA H -8.783 2.449 3.177 1.00 . A A . 30 ALA HA 1 1 18 13165 1 1 30 ALA HB1 H -5.888 2.804 2.328 1.00 . A A . 30 ALA HB1 1 1 18 13166 1 1 30 ALA HB2 H -6.383 1.717 3.615 1.00 . A A . 30 ALA HB2 1 1 18 13167 1 1 30 ALA HB3 H -6.966 1.432 1.964 1.00 . A A . 30 ALA HB3 1 1 18 13168 1 1 30 ALA N N -8.156 3.821 1.738 1.00 . A A . 30 ALA N 1 1 18 13169 1 1 30 ALA O O -7.504 5.204 3.973 1.00 . A A . 30 ALA O 1 1 18 13170 1 1 31 SER C C -5.825 4.642 6.458 1.00 . A A . 31 SER C 1 1 18 13171 1 1 31 SER CA C -7.288 4.207 6.547 1.00 . A A . 31 SER CA 1 1 18 13172 1 1 31 SER CB C -7.520 3.321 7.764 1.00 . A A . 31 SER CB 1 1 18 13173 1 1 31 SER H H -7.748 2.458 5.522 1.00 . A A . 31 SER H 1 1 18 13174 1 1 31 SER HA H -7.923 5.084 6.643 1.00 . A A . 31 SER HA 1 1 18 13175 1 1 31 SER HB2 H -6.955 2.403 7.662 1.00 . A A . 31 SER HB2 1 1 18 13176 1 1 31 SER HB3 H -7.156 3.853 8.627 1.00 . A A . 31 SER HB3 1 1 18 13177 1 1 31 SER HG H -9.222 2.502 7.216 1.00 . A A . 31 SER HG 1 1 18 13178 1 1 31 SER N N -7.652 3.455 5.368 1.00 . A A . 31 SER N 1 1 18 13179 1 1 31 SER O O -5.481 5.769 6.806 1.00 . A A . 31 SER O 1 1 18 13180 1 1 31 SER OG O -8.895 3.046 7.943 1.00 . A A . 31 SER OG 1 1 18 13181 1 1 32 HIS C C -3.009 3.072 4.701 1.00 . A A . 32 HIS C 1 1 18 13182 1 1 32 HIS CA C -3.568 4.083 5.692 1.00 . A A . 32 HIS CA 1 1 18 13183 1 1 32 HIS CB C -2.704 4.132 6.969 1.00 . A A . 32 HIS CB 1 1 18 13184 1 1 32 HIS CD2 C -2.907 1.730 7.830 1.00 . A A . 32 HIS CD2 1 1 18 13185 1 1 32 HIS CE1 C -0.813 1.175 7.957 1.00 . A A . 32 HIS CE1 1 1 18 13186 1 1 32 HIS CG C -2.176 2.801 7.434 1.00 . A A . 32 HIS CG 1 1 18 13187 1 1 32 HIS H H -5.288 2.852 5.649 1.00 . A A . 32 HIS H 1 1 18 13188 1 1 32 HIS HA H -3.561 5.063 5.209 1.00 . A A . 32 HIS HA 1 1 18 13189 1 1 32 HIS HB2 H -1.833 4.728 6.781 1.00 . A A . 32 HIS HB2 1 1 18 13190 1 1 32 HIS HB3 H -3.258 4.612 7.778 1.00 . A A . 32 HIS HB3 1 1 18 13191 1 1 32 HIS HD1 H -0.041 2.944 7.104 1.00 . A A . 32 HIS HD1 1 1 18 13192 1 1 32 HIS HD2 H -3.970 1.734 7.757 1.00 . A A . 32 HIS HD2 1 1 18 13193 1 1 32 HIS HE1 H 0.086 0.598 8.118 1.00 . A A . 32 HIS HE1 1 1 18 13194 1 1 32 HIS N N -4.950 3.743 5.993 1.00 . A A . 32 HIS N 1 1 18 13195 1 1 32 HIS ND1 N -0.838 2.434 7.481 1.00 . A A . 32 HIS ND1 1 1 18 13196 1 1 32 HIS NE2 N -2.051 0.708 8.186 1.00 . A A . 32 HIS NE2 1 1 18 13197 1 1 32 HIS O O -3.705 2.145 4.280 1.00 . A A . 32 HIS O 1 1 18 13198 1 1 33 GLY C C 0.407 2.033 4.402 1.00 . A A . 33 GLY C 1 1 18 13199 1 1 33 GLY CA C -0.896 2.308 3.671 1.00 . A A . 33 GLY CA 1 1 18 13200 1 1 33 GLY H H -1.226 4.005 4.849 1.00 . A A . 33 GLY H 1 1 18 13201 1 1 33 GLY HA2 H -1.436 1.397 3.553 1.00 . A A . 33 GLY HA2 1 1 18 13202 1 1 33 GLY HA3 H -0.678 2.686 2.683 1.00 . A A . 33 GLY HA3 1 1 18 13203 1 1 33 GLY N N -1.717 3.235 4.421 1.00 . A A . 33 GLY N 1 1 18 13204 1 1 33 GLY O O 0.745 2.751 5.349 1.00 . A A . 33 GLY O 1 1 18 13205 1 1 34 ALA C C 3.128 -0.301 3.498 1.00 . A A . 34 ALA C 1 1 18 13206 1 1 34 ALA CA C 2.418 0.611 4.504 1.00 . A A . 34 ALA CA 1 1 18 13207 1 1 34 ALA CB C 2.253 -0.057 5.873 1.00 . A A . 34 ALA CB 1 1 18 13208 1 1 34 ALA H H 0.739 0.417 3.225 1.00 . A A . 34 ALA H 1 1 18 13209 1 1 34 ALA HA H 3.002 1.519 4.640 1.00 . A A . 34 ALA HA 1 1 18 13210 1 1 34 ALA HB1 H 1.585 -0.914 5.802 1.00 . A A . 34 ALA HB1 1 1 18 13211 1 1 34 ALA HB2 H 3.223 -0.383 6.246 1.00 . A A . 34 ALA HB2 1 1 18 13212 1 1 34 ALA HB3 H 1.834 0.660 6.578 1.00 . A A . 34 ALA HB3 1 1 18 13213 1 1 34 ALA N N 1.117 0.985 3.980 1.00 . A A . 34 ALA N 1 1 18 13214 1 1 34 ALA O O 2.520 -1.243 2.982 1.00 . A A . 34 ALA O 1 1 18 13215 1 1 35 CYS C C 5.725 -2.068 2.907 1.00 . A A . 35 CYS C 1 1 18 13216 1 1 35 CYS CA C 5.200 -0.782 2.261 1.00 . A A . 35 CYS CA 1 1 18 13217 1 1 35 CYS CB C 6.350 0.088 1.757 1.00 . A A . 35 CYS CB 1 1 18 13218 1 1 35 CYS H H 4.852 0.803 3.603 1.00 . A A . 35 CYS H 1 1 18 13219 1 1 35 CYS HA H 4.591 -1.029 1.400 1.00 . A A . 35 CYS HA 1 1 18 13220 1 1 35 CYS HB2 H 6.902 0.509 2.597 1.00 . A A . 35 CYS HB2 1 1 18 13221 1 1 35 CYS HB3 H 7.025 -0.552 1.210 1.00 . A A . 35 CYS HB3 1 1 18 13222 1 1 35 CYS N N 4.399 -0.011 3.197 1.00 . A A . 35 CYS N 1 1 18 13223 1 1 35 CYS O O 6.036 -2.069 4.099 1.00 . A A . 35 CYS O 1 1 18 13224 1 1 35 CYS SG S 5.849 1.400 0.618 1.00 . A A . 35 CYS SG 1 1 18 13225 1 1 36 HIS C C 7.204 -5.111 1.500 1.00 . A A . 36 HIS C 1 1 18 13226 1 1 36 HIS CA C 6.439 -4.419 2.619 1.00 . A A . 36 HIS CA 1 1 18 13227 1 1 36 HIS CB C 5.383 -5.414 3.099 1.00 . A A . 36 HIS CB 1 1 18 13228 1 1 36 HIS CD2 C 2.916 -4.717 3.346 1.00 . A A . 36 HIS CD2 1 1 18 13229 1 1 36 HIS CE1 C 3.088 -3.668 5.266 1.00 . A A . 36 HIS CE1 1 1 18 13230 1 1 36 HIS CG C 4.215 -4.772 3.771 1.00 . A A . 36 HIS CG 1 1 18 13231 1 1 36 HIS H H 5.459 -3.150 1.199 1.00 . A A . 36 HIS H 1 1 18 13232 1 1 36 HIS HA H 7.113 -4.211 3.449 1.00 . A A . 36 HIS HA 1 1 18 13233 1 1 36 HIS HB2 H 5.012 -5.973 2.240 1.00 . A A . 36 HIS HB2 1 1 18 13234 1 1 36 HIS HB3 H 5.847 -6.131 3.779 1.00 . A A . 36 HIS HB3 1 1 18 13235 1 1 36 HIS HD1 H 5.186 -3.825 5.438 1.00 . A A . 36 HIS HD1 1 1 18 13236 1 1 36 HIS HD2 H 2.539 -5.125 2.409 1.00 . A A . 36 HIS HD2 1 1 18 13237 1 1 36 HIS HE1 H 2.828 -3.107 6.151 1.00 . A A . 36 HIS HE1 1 1 18 13238 1 1 36 HIS N N 5.830 -3.170 2.148 1.00 . A A . 36 HIS N 1 1 18 13239 1 1 36 HIS ND1 N 4.327 -4.071 4.959 1.00 . A A . 36 HIS ND1 1 1 18 13240 1 1 36 HIS NE2 N 2.210 -4.053 4.328 1.00 . A A . 36 HIS NE2 1 1 18 13241 1 1 36 HIS O O 6.717 -5.147 0.374 1.00 . A A . 36 HIS O 1 1 18 13242 1 1 37 LYS C C 8.574 -7.867 0.665 1.00 . A A . 37 LYS C 1 1 18 13243 1 1 37 LYS CA C 9.132 -6.458 0.839 1.00 . A A . 37 LYS CA 1 1 18 13244 1 1 37 LYS CB C 10.605 -6.458 1.244 1.00 . A A . 37 LYS CB 1 1 18 13245 1 1 37 LYS CD C 12.917 -7.404 0.585 1.00 . A A . 37 LYS CD 1 1 18 13246 1 1 37 LYS CE C 14.011 -6.349 0.353 1.00 . A A . 37 LYS CE 1 1 18 13247 1 1 37 LYS CG C 11.526 -6.940 0.115 1.00 . A A . 37 LYS CG 1 1 18 13248 1 1 37 LYS H H 8.631 -5.749 2.784 1.00 . A A . 37 LYS H 1 1 18 13249 1 1 37 LYS HA H 9.095 -5.931 -0.106 1.00 . A A . 37 LYS HA 1 1 18 13250 1 1 37 LYS HB2 H 10.854 -5.440 1.443 1.00 . A A . 37 LYS HB2 1 1 18 13251 1 1 37 LYS HB3 H 10.735 -7.018 2.160 1.00 . A A . 37 LYS HB3 1 1 18 13252 1 1 37 LYS HD2 H 12.885 -7.685 1.640 1.00 . A A . 37 LYS HD2 1 1 18 13253 1 1 37 LYS HD3 H 13.174 -8.304 0.027 1.00 . A A . 37 LYS HD3 1 1 18 13254 1 1 37 LYS HE2 H 13.797 -5.778 -0.553 1.00 . A A . 37 LYS HE2 1 1 18 13255 1 1 37 LYS HE3 H 14.027 -5.674 1.209 1.00 . A A . 37 LYS HE3 1 1 18 13256 1 1 37 LYS HG2 H 11.039 -7.789 -0.336 1.00 . A A . 37 LYS HG2 1 1 18 13257 1 1 37 LYS HG3 H 11.591 -6.171 -0.656 1.00 . A A . 37 LYS HG3 1 1 18 13258 1 1 37 LYS HZ1 H 15.242 -7.974 0.016 1.00 . A A . 37 LYS HZ1 1 1 18 13259 1 1 37 LYS HZ2 H 15.805 -6.537 -0.653 1.00 . A A . 37 LYS HZ2 1 1 18 13260 1 1 37 LYS N N 8.336 -5.737 1.819 1.00 . A A . 37 LYS N 1 1 18 13261 1 1 37 LYS NZ N 15.345 -6.960 0.166 1.00 . A A . 37 LYS NZ 1 1 18 13262 1 1 37 LYS O O 8.476 -8.633 1.620 1.00 . A A . 37 LYS O 1 1 18 13263 1 1 38 ARG C C 8.219 -9.831 -2.316 1.00 . A A . 38 ARG C 1 1 18 13264 1 1 38 ARG CA C 7.593 -9.439 -0.976 1.00 . A A . 38 ARG CA 1 1 18 13265 1 1 38 ARG CB C 6.091 -9.176 -1.096 1.00 . A A . 38 ARG CB 1 1 18 13266 1 1 38 ARG CD C 5.174 -11.404 -0.213 1.00 . A A . 38 ARG CD 1 1 18 13267 1 1 38 ARG CG C 5.234 -10.411 -1.385 1.00 . A A . 38 ARG CG 1 1 18 13268 1 1 38 ARG CZ C 6.549 -13.284 0.703 1.00 . A A . 38 ARG CZ 1 1 18 13269 1 1 38 ARG H H 8.274 -7.468 -1.283 1.00 . A A . 38 ARG H 1 1 18 13270 1 1 38 ARG HA H 7.781 -10.211 -0.228 1.00 . A A . 38 ARG HA 1 1 18 13271 1 1 38 ARG HB2 H 5.741 -8.715 -0.172 1.00 . A A . 38 ARG HB2 1 1 18 13272 1 1 38 ARG HB3 H 5.939 -8.457 -1.903 1.00 . A A . 38 ARG HB3 1 1 18 13273 1 1 38 ARG HD2 H 5.249 -10.841 0.720 1.00 . A A . 38 ARG HD2 1 1 18 13274 1 1 38 ARG HD3 H 4.199 -11.898 -0.242 1.00 . A A . 38 ARG HD3 1 1 18 13275 1 1 38 ARG HG2 H 4.225 -10.034 -1.551 1.00 . A A . 38 ARG HG2 1 1 18 13276 1 1 38 ARG HG3 H 5.565 -10.893 -2.302 1.00 . A A . 38 ARG HG3 1 1 18 13277 1 1 38 ARG HH11 H 5.314 -12.433 2.080 1.00 . A A . 38 ARG HH11 1 1 18 13278 1 1 38 ARG HH12 H 6.252 -13.761 2.681 1.00 . A A . 38 ARG HH12 1 1 18 13279 1 1 38 ARG HH21 H 7.795 -14.362 -0.476 1.00 . A A . 38 ARG HH21 1 1 18 13280 1 1 38 ARG HH22 H 7.727 -14.908 1.182 1.00 . A A . 38 ARG HH22 1 1 18 13281 1 1 38 ARG N N 8.211 -8.191 -0.573 1.00 . A A . 38 ARG N 1 1 18 13282 1 1 38 ARG NE N 6.205 -12.455 -0.297 1.00 . A A . 38 ARG NE 1 1 18 13283 1 1 38 ARG NH1 N 6.006 -13.149 1.918 1.00 . A A . 38 ARG NH1 1 1 18 13284 1 1 38 ARG NH2 N 7.439 -14.254 0.471 1.00 . A A . 38 ARG NH2 1 1 18 13285 1 1 38 ARG O O 8.242 -9.013 -3.234 1.00 . A A . 38 ARG O 1 1 18 13286 1 1 39 GLU C C 10.616 -10.417 -3.973 1.00 . A A . 39 GLU C 1 1 18 13287 1 1 39 GLU CA C 9.578 -11.475 -3.570 1.00 . A A . 39 GLU CA 1 1 18 13288 1 1 39 GLU CB C 8.657 -11.864 -4.738 1.00 . A A . 39 GLU CB 1 1 18 13289 1 1 39 GLU CD C 7.889 -13.912 -3.429 1.00 . A A . 39 GLU CD 1 1 18 13290 1 1 39 GLU CG C 7.474 -12.750 -4.323 1.00 . A A . 39 GLU CG 1 1 18 13291 1 1 39 GLU H H 8.730 -11.669 -1.635 1.00 . A A . 39 GLU H 1 1 18 13292 1 1 39 GLU HA H 10.142 -12.360 -3.271 1.00 . A A . 39 GLU HA 1 1 18 13293 1 1 39 GLU HB2 H 8.258 -10.961 -5.202 1.00 . A A . 39 GLU HB2 1 1 18 13294 1 1 39 GLU HB3 H 9.257 -12.395 -5.480 1.00 . A A . 39 GLU HB3 1 1 18 13295 1 1 39 GLU HG2 H 6.738 -12.147 -3.797 1.00 . A A . 39 GLU HG2 1 1 18 13296 1 1 39 GLU HG3 H 6.998 -13.148 -5.221 1.00 . A A . 39 GLU HG3 1 1 18 13297 1 1 39 GLU N N 8.795 -11.034 -2.414 1.00 . A A . 39 GLU N 1 1 18 13298 1 1 39 GLU O O 10.812 -10.126 -5.149 1.00 . A A . 39 GLU O 1 1 18 13299 1 1 39 GLU OE1 O 8.398 -15.003 -4.062 1.00 . A A . 39 GLU OE1 1 1 18 13300 1 1 39 GLU OE2 O 7.764 -13.801 -2.206 1.00 . A A . 39 GLU OE2 1 1 18 13301 1 1 40 ASN C C 11.726 -7.482 -3.706 1.00 . A A . 40 ASN C 1 1 18 13302 1 1 40 ASN CA C 12.252 -8.772 -3.072 1.00 . A A . 40 ASN CA 1 1 18 13303 1 1 40 ASN CB C 13.486 -9.287 -3.803 1.00 . A A . 40 ASN CB 1 1 18 13304 1 1 40 ASN CG C 14.725 -8.435 -3.512 1.00 . A A . 40 ASN CG 1 1 18 13305 1 1 40 ASN H H 11.108 -10.203 -2.052 1.00 . A A . 40 ASN H 1 1 18 13306 1 1 40 ASN HA H 12.537 -8.530 -2.054 1.00 . A A . 40 ASN HA 1 1 18 13307 1 1 40 ASN HB2 H 13.679 -10.313 -3.503 1.00 . A A . 40 ASN HB2 1 1 18 13308 1 1 40 ASN HB3 H 13.236 -9.289 -4.858 1.00 . A A . 40 ASN HB3 1 1 18 13309 1 1 40 ASN HD21 H 15.356 -8.547 -5.443 1.00 . A A . 40 ASN HD21 1 1 18 13310 1 1 40 ASN HD22 H 16.377 -7.631 -4.357 1.00 . A A . 40 ASN HD22 1 1 18 13311 1 1 40 ASN N N 11.265 -9.831 -2.965 1.00 . A A . 40 ASN N 1 1 18 13312 1 1 40 ASN ND2 N 15.553 -8.188 -4.521 1.00 . A A . 40 ASN ND2 1 1 18 13313 1 1 40 ASN O O 12.514 -6.662 -4.168 1.00 . A A . 40 ASN O 1 1 18 13314 1 1 40 ASN OD1 O 14.949 -8.015 -2.374 1.00 . A A . 40 ASN OD1 1 1 18 13315 1 1 41 HIS C C 8.979 -5.440 -3.091 1.00 . A A . 41 HIS C 1 1 18 13316 1 1 41 HIS CA C 9.775 -6.076 -4.220 1.00 . A A . 41 HIS CA 1 1 18 13317 1 1 41 HIS CB C 8.893 -6.433 -5.411 1.00 . A A . 41 HIS CB 1 1 18 13318 1 1 41 HIS CD2 C 9.842 -8.168 -7.103 1.00 . A A . 41 HIS CD2 1 1 18 13319 1 1 41 HIS CE1 C 11.257 -6.869 -8.137 1.00 . A A . 41 HIS CE1 1 1 18 13320 1 1 41 HIS CG C 9.732 -6.910 -6.575 1.00 . A A . 41 HIS CG 1 1 18 13321 1 1 41 HIS H H 9.774 -7.993 -3.377 1.00 . A A . 41 HIS H 1 1 18 13322 1 1 41 HIS HA H 10.528 -5.378 -4.574 1.00 . A A . 41 HIS HA 1 1 18 13323 1 1 41 HIS HB2 H 8.199 -7.215 -5.101 1.00 . A A . 41 HIS HB2 1 1 18 13324 1 1 41 HIS HB3 H 8.303 -5.564 -5.695 1.00 . A A . 41 HIS HB3 1 1 18 13325 1 1 41 HIS HD1 H 10.781 -5.102 -7.086 1.00 . A A . 41 HIS HD1 1 1 18 13326 1 1 41 HIS HD2 H 9.340 -9.048 -6.732 1.00 . A A . 41 HIS HD2 1 1 18 13327 1 1 41 HIS HE1 H 12.039 -6.526 -8.802 1.00 . A A . 41 HIS HE1 1 1 18 13328 1 1 41 HIS N N 10.406 -7.280 -3.719 1.00 . A A . 41 HIS N 1 1 18 13329 1 1 41 HIS ND1 N 10.611 -6.084 -7.258 1.00 . A A . 41 HIS ND1 1 1 18 13330 1 1 41 HIS NE2 N 10.816 -8.137 -8.081 1.00 . A A . 41 HIS NE2 1 1 18 13331 1 1 41 HIS O O 8.127 -6.095 -2.495 1.00 . A A . 41 HIS O 1 1 18 13332 1 1 42 TRP C C 7.197 -3.010 -2.295 1.00 . A A . 42 TRP C 1 1 18 13333 1 1 42 TRP CA C 8.553 -3.442 -1.757 1.00 . A A . 42 TRP CA 1 1 18 13334 1 1 42 TRP CB C 9.396 -2.274 -1.261 1.00 . A A . 42 TRP CB 1 1 18 13335 1 1 42 TRP CD1 C 11.696 -3.120 -0.633 1.00 . A A . 42 TRP CD1 1 1 18 13336 1 1 42 TRP CD2 C 10.403 -2.704 1.145 1.00 . A A . 42 TRP CD2 1 1 18 13337 1 1 42 TRP CE2 C 11.650 -3.172 1.643 1.00 . A A . 42 TRP CE2 1 1 18 13338 1 1 42 TRP CE3 C 9.377 -2.492 2.084 1.00 . A A . 42 TRP CE3 1 1 18 13339 1 1 42 TRP CG C 10.469 -2.670 -0.306 1.00 . A A . 42 TRP CG 1 1 18 13340 1 1 42 TRP CH2 C 10.824 -3.174 3.919 1.00 . A A . 42 TRP CH2 1 1 18 13341 1 1 42 TRP CZ2 C 11.857 -3.438 3.003 1.00 . A A . 42 TRP CZ2 1 1 18 13342 1 1 42 TRP CZ3 C 9.596 -2.671 3.459 1.00 . A A . 42 TRP CZ3 1 1 18 13343 1 1 42 TRP H H 9.935 -3.669 -3.353 1.00 . A A . 42 TRP H 1 1 18 13344 1 1 42 TRP HA H 8.394 -4.072 -0.895 1.00 . A A . 42 TRP HA 1 1 18 13345 1 1 42 TRP HB2 H 9.814 -1.720 -2.099 1.00 . A A . 42 TRP HB2 1 1 18 13346 1 1 42 TRP HB3 H 8.748 -1.613 -0.701 1.00 . A A . 42 TRP HB3 1 1 18 13347 1 1 42 TRP HD1 H 12.030 -3.282 -1.643 1.00 . A A . 42 TRP HD1 1 1 18 13348 1 1 42 TRP HE1 H 13.341 -3.774 0.559 1.00 . A A . 42 TRP HE1 1 1 18 13349 1 1 42 TRP HE3 H 8.397 -2.242 1.730 1.00 . A A . 42 TRP HE3 1 1 18 13350 1 1 42 TRP HH2 H 10.949 -3.389 4.969 1.00 . A A . 42 TRP HH2 1 1 18 13351 1 1 42 TRP HZ2 H 12.764 -3.935 3.310 1.00 . A A . 42 TRP HZ2 1 1 18 13352 1 1 42 TRP HZ3 H 8.796 -2.450 4.151 1.00 . A A . 42 TRP HZ3 1 1 18 13353 1 1 42 TRP N N 9.276 -4.181 -2.774 1.00 . A A . 42 TRP N 1 1 18 13354 1 1 42 TRP NE1 N 12.410 -3.399 0.515 1.00 . A A . 42 TRP NE1 1 1 18 13355 1 1 42 TRP O O 7.132 -2.147 -3.162 1.00 . A A . 42 TRP O 1 1 18 13356 1 1 43 LYS C C 4.075 -2.467 -1.217 1.00 . A A . 43 LYS C 1 1 18 13357 1 1 43 LYS CA C 4.761 -3.327 -2.266 1.00 . A A . 43 LYS CA 1 1 18 13358 1 1 43 LYS CB C 3.979 -4.621 -2.482 1.00 . A A . 43 LYS CB 1 1 18 13359 1 1 43 LYS CD C 5.543 -5.328 -4.437 1.00 . A A . 43 LYS CD 1 1 18 13360 1 1 43 LYS CE C 4.612 -5.114 -5.650 1.00 . A A . 43 LYS CE 1 1 18 13361 1 1 43 LYS CG C 4.852 -5.704 -3.110 1.00 . A A . 43 LYS CG 1 1 18 13362 1 1 43 LYS H H 6.215 -4.397 -1.182 1.00 . A A . 43 LYS H 1 1 18 13363 1 1 43 LYS HA H 4.787 -2.794 -3.218 1.00 . A A . 43 LYS HA 1 1 18 13364 1 1 43 LYS HB2 H 3.662 -5.000 -1.511 1.00 . A A . 43 LYS HB2 1 1 18 13365 1 1 43 LYS HB3 H 3.096 -4.429 -3.086 1.00 . A A . 43 LYS HB3 1 1 18 13366 1 1 43 LYS HD2 H 6.212 -4.477 -4.324 1.00 . A A . 43 LYS HD2 1 1 18 13367 1 1 43 LYS HD3 H 6.160 -6.194 -4.672 1.00 . A A . 43 LYS HD3 1 1 18 13368 1 1 43 LYS HE2 H 5.210 -5.264 -6.552 1.00 . A A . 43 LYS HE2 1 1 18 13369 1 1 43 LYS HE3 H 3.819 -5.864 -5.646 1.00 . A A . 43 LYS HE3 1 1 18 13370 1 1 43 LYS HG2 H 5.547 -5.995 -2.316 1.00 . A A . 43 LYS HG2 1 1 18 13371 1 1 43 LYS HG3 H 4.266 -6.586 -3.298 1.00 . A A . 43 LYS HG3 1 1 18 13372 1 1 43 LYS HZ1 H 4.379 -3.288 -6.589 1.00 . A A . 43 LYS HZ1 1 1 18 13373 1 1 43 LYS HZ2 H 2.993 -3.841 -5.814 1.00 . A A . 43 LYS HZ2 1 1 18 13374 1 1 43 LYS N N 6.111 -3.626 -1.831 1.00 . A A . 43 LYS N 1 1 18 13375 1 1 43 LYS NZ N 4.017 -3.762 -5.750 1.00 . A A . 43 LYS NZ 1 1 18 13376 1 1 43 LYS O O 4.028 -2.833 -0.042 1.00 . A A . 43 LYS O 1 1 18 13377 1 1 44 CYS C C 1.320 -1.083 -0.698 1.00 . A A . 44 CYS C 1 1 18 13378 1 1 44 CYS CA C 2.693 -0.446 -0.899 1.00 . A A . 44 CYS CA 1 1 18 13379 1 1 44 CYS CB C 2.567 0.867 -1.667 1.00 . A A . 44 CYS CB 1 1 18 13380 1 1 44 CYS H H 3.664 -1.127 -2.647 1.00 . A A . 44 CYS H 1 1 18 13381 1 1 44 CYS HA H 3.132 -0.231 0.070 1.00 . A A . 44 CYS HA 1 1 18 13382 1 1 44 CYS HB2 H 3.515 1.398 -1.588 1.00 . A A . 44 CYS HB2 1 1 18 13383 1 1 44 CYS HB3 H 2.356 0.658 -2.709 1.00 . A A . 44 CYS HB3 1 1 18 13384 1 1 44 CYS N N 3.542 -1.336 -1.668 1.00 . A A . 44 CYS N 1 1 18 13385 1 1 44 CYS O O 0.503 -1.063 -1.612 1.00 . A A . 44 CYS O 1 1 18 13386 1 1 44 CYS SG S 1.246 1.921 -1.047 1.00 . A A . 44 CYS SG 1 1 18 13387 1 1 45 PHE C C -1.083 -1.280 1.515 1.00 . A A . 45 PHE C 1 1 18 13388 1 1 45 PHE CA C -0.226 -2.290 0.754 1.00 . A A . 45 PHE CA 1 1 18 13389 1 1 45 PHE CB C -0.022 -3.559 1.582 1.00 . A A . 45 PHE CB 1 1 18 13390 1 1 45 PHE CD1 C 0.922 -4.802 -0.458 1.00 . A A . 45 PHE CD1 1 1 18 13391 1 1 45 PHE CD2 C 0.150 -6.069 1.466 1.00 . A A . 45 PHE CD2 1 1 18 13392 1 1 45 PHE CE1 C 1.133 -6.004 -1.158 1.00 . A A . 45 PHE CE1 1 1 18 13393 1 1 45 PHE CE2 C 0.394 -7.270 0.778 1.00 . A A . 45 PHE CE2 1 1 18 13394 1 1 45 PHE CG C 0.368 -4.828 0.838 1.00 . A A . 45 PHE CG 1 1 18 13395 1 1 45 PHE CZ C 0.871 -7.238 -0.542 1.00 . A A . 45 PHE CZ 1 1 18 13396 1 1 45 PHE H H 1.742 -1.636 1.224 1.00 . A A . 45 PHE H 1 1 18 13397 1 1 45 PHE HA H -0.752 -2.558 -0.165 1.00 . A A . 45 PHE HA 1 1 18 13398 1 1 45 PHE HB2 H 0.715 -3.333 2.344 1.00 . A A . 45 PHE HB2 1 1 18 13399 1 1 45 PHE HB3 H -0.963 -3.769 2.088 1.00 . A A . 45 PHE HB3 1 1 18 13400 1 1 45 PHE HD1 H 1.144 -3.868 -0.950 1.00 . A A . 45 PHE HD1 1 1 18 13401 1 1 45 PHE HD2 H -0.212 -6.104 2.478 1.00 . A A . 45 PHE HD2 1 1 18 13402 1 1 45 PHE HE1 H 1.485 -5.986 -2.180 1.00 . A A . 45 PHE HE1 1 1 18 13403 1 1 45 PHE HE2 H 0.200 -8.218 1.260 1.00 . A A . 45 PHE HE2 1 1 18 13404 1 1 45 PHE HZ H 1.031 -8.159 -1.081 1.00 . A A . 45 PHE HZ 1 1 18 13405 1 1 45 PHE N N 1.067 -1.685 0.466 1.00 . A A . 45 PHE N 1 1 18 13406 1 1 45 PHE O O -0.544 -0.440 2.235 1.00 . A A . 45 PHE O 1 1 18 13407 1 1 46 CYS C C -4.305 -1.171 2.865 1.00 . A A . 46 CYS C 1 1 18 13408 1 1 46 CYS CA C -3.396 -0.446 1.885 1.00 . A A . 46 CYS CA 1 1 18 13409 1 1 46 CYS CB C -4.229 0.099 0.725 1.00 . A A . 46 CYS CB 1 1 18 13410 1 1 46 CYS H H -2.769 -2.132 0.796 1.00 . A A . 46 CYS H 1 1 18 13411 1 1 46 CYS HA H -2.937 0.379 2.432 1.00 . A A . 46 CYS HA 1 1 18 13412 1 1 46 CYS HB2 H -4.812 -0.717 0.307 1.00 . A A . 46 CYS HB2 1 1 18 13413 1 1 46 CYS HB3 H -4.919 0.828 1.128 1.00 . A A . 46 CYS HB3 1 1 18 13414 1 1 46 CYS N N -2.405 -1.372 1.362 1.00 . A A . 46 CYS N 1 1 18 13415 1 1 46 CYS O O -4.491 -2.379 2.758 1.00 . A A . 46 CYS O 1 1 18 13416 1 1 46 CYS SG S -3.340 0.905 -0.629 1.00 . A A . 46 CYS SG 1 1 18 13417 1 1 47 TYR C C -6.850 -0.345 5.242 1.00 . A A . 47 TYR C 1 1 18 13418 1 1 47 TYR CA C -5.506 -1.033 4.999 1.00 . A A . 47 TYR CA 1 1 18 13419 1 1 47 TYR CB C -4.563 -0.813 6.177 1.00 . A A . 47 TYR CB 1 1 18 13420 1 1 47 TYR CD1 C -3.339 -2.957 6.653 1.00 . A A . 47 TYR CD1 1 1 18 13421 1 1 47 TYR CD2 C -2.167 -1.208 5.432 1.00 . A A . 47 TYR CD2 1 1 18 13422 1 1 47 TYR CE1 C -2.216 -3.788 6.551 1.00 . A A . 47 TYR CE1 1 1 18 13423 1 1 47 TYR CE2 C -1.068 -2.067 5.268 1.00 . A A . 47 TYR CE2 1 1 18 13424 1 1 47 TYR CG C -3.319 -1.667 6.096 1.00 . A A . 47 TYR CG 1 1 18 13425 1 1 47 TYR CZ C -1.100 -3.358 5.824 1.00 . A A . 47 TYR CZ 1 1 18 13426 1 1 47 TYR H H -4.638 0.547 3.862 1.00 . A A . 47 TYR H 1 1 18 13427 1 1 47 TYR HA H -5.660 -2.111 4.874 1.00 . A A . 47 TYR HA 1 1 18 13428 1 1 47 TYR HB2 H -4.277 0.235 6.172 1.00 . A A . 47 TYR HB2 1 1 18 13429 1 1 47 TYR HB3 H -5.085 -1.014 7.109 1.00 . A A . 47 TYR HB3 1 1 18 13430 1 1 47 TYR HD1 H -4.225 -3.335 7.131 1.00 . A A . 47 TYR HD1 1 1 18 13431 1 1 47 TYR HD2 H -2.145 -0.218 5.004 1.00 . A A . 47 TYR HD2 1 1 18 13432 1 1 47 TYR HE1 H -2.233 -4.769 7.003 1.00 . A A . 47 TYR HE1 1 1 18 13433 1 1 47 TYR HE2 H -0.225 -1.747 4.676 1.00 . A A . 47 TYR HE2 1 1 18 13434 1 1 47 TYR HH H -0.248 -5.115 5.901 1.00 . A A . 47 TYR HH 1 1 18 13435 1 1 47 TYR N N -4.850 -0.447 3.838 1.00 . A A . 47 TYR N 1 1 18 13436 1 1 47 TYR O O -6.891 0.773 5.753 1.00 . A A . 47 TYR O 1 1 18 13437 1 1 47 TYR OH O -0.052 -4.203 5.635 1.00 . A A . 47 TYR OH 1 1 18 13438 1 1 48 PHE C C -9.989 -0.114 5.969 1.00 . A A . 48 PHE C 1 1 18 13439 1 1 48 PHE CA C -9.220 -0.355 4.672 1.00 . A A . 48 PHE CA 1 1 18 13440 1 1 48 PHE CB C -9.999 -1.126 3.603 1.00 . A A . 48 PHE CB 1 1 18 13441 1 1 48 PHE CD1 C -8.442 -1.259 1.592 1.00 . A A . 48 PHE CD1 1 1 18 13442 1 1 48 PHE CD2 C -10.371 0.225 1.498 1.00 . A A . 48 PHE CD2 1 1 18 13443 1 1 48 PHE CE1 C -8.060 -0.832 0.306 1.00 . A A . 48 PHE CE1 1 1 18 13444 1 1 48 PHE CE2 C -9.994 0.636 0.209 1.00 . A A . 48 PHE CE2 1 1 18 13445 1 1 48 PHE CG C -9.600 -0.726 2.194 1.00 . A A . 48 PHE CG 1 1 18 13446 1 1 48 PHE CZ C -8.837 0.111 -0.384 1.00 . A A . 48 PHE CZ 1 1 18 13447 1 1 48 PHE H H -7.873 -1.926 4.464 1.00 . A A . 48 PHE H 1 1 18 13448 1 1 48 PHE HA H -9.033 0.633 4.264 1.00 . A A . 48 PHE HA 1 1 18 13449 1 1 48 PHE HB2 H -9.884 -2.203 3.728 1.00 . A A . 48 PHE HB2 1 1 18 13450 1 1 48 PHE HB3 H -11.050 -0.910 3.741 1.00 . A A . 48 PHE HB3 1 1 18 13451 1 1 48 PHE HD1 H -7.833 -1.980 2.117 1.00 . A A . 48 PHE HD1 1 1 18 13452 1 1 48 PHE HD2 H -11.241 0.676 1.955 1.00 . A A . 48 PHE HD2 1 1 18 13453 1 1 48 PHE HE1 H -7.167 -1.223 -0.160 1.00 . A A . 48 PHE HE1 1 1 18 13454 1 1 48 PHE HE2 H -10.585 1.374 -0.317 1.00 . A A . 48 PHE HE2 1 1 18 13455 1 1 48 PHE HZ H -8.558 0.434 -1.373 1.00 . A A . 48 PHE HZ 1 1 18 13456 1 1 48 PHE N N -7.948 -1.013 4.876 1.00 . A A . 48 PHE N 1 1 18 13457 1 1 48 PHE O O -9.912 0.980 6.520 1.00 . A A . 48 PHE O 1 1 18 13458 1 1 49 ASN C C -10.974 -1.054 8.900 1.00 . A A . 49 ASN C 1 1 18 13459 1 1 49 ASN CA C -11.698 -0.908 7.561 1.00 . A A . 49 ASN CA 1 1 18 13460 1 1 49 ASN CB C -12.864 -1.903 7.433 1.00 . A A . 49 ASN CB 1 1 18 13461 1 1 49 ASN CG C -13.624 -1.770 6.115 1.00 . A A . 49 ASN CG 1 1 18 13462 1 1 49 ASN H H -10.641 -2.029 6.096 1.00 . A A . 49 ASN H 1 1 18 13463 1 1 49 ASN HA H -12.117 0.100 7.508 1.00 . A A . 49 ASN HA 1 1 18 13464 1 1 49 ASN HB2 H -12.494 -2.922 7.534 1.00 . A A . 49 ASN HB2 1 1 18 13465 1 1 49 ASN HB3 H -13.569 -1.715 8.243 1.00 . A A . 49 ASN HB3 1 1 18 13466 1 1 49 ASN HD21 H -12.408 -3.122 5.218 1.00 . A A . 49 ASN HD21 1 1 18 13467 1 1 49 ASN HD22 H -13.698 -2.499 4.215 1.00 . A A . 49 ASN HD22 1 1 18 13468 1 1 49 ASN N N -10.734 -1.100 6.475 1.00 . A A . 49 ASN N 1 1 18 13469 1 1 49 ASN ND2 N -13.212 -2.523 5.097 1.00 . A A . 49 ASN ND2 1 1 18 13470 1 1 49 ASN O O -11.393 -1.811 9.779 1.00 . A A . 49 ASN O 1 1 18 13471 1 1 49 ASN OD1 O -14.583 -1.013 6.015 1.00 . A A . 49 ASN OD1 1 1 18 13472 1 1 50 CYS C C -9.307 0.158 11.370 1.00 . A A . 50 CYS C 1 1 18 13473 1 1 50 CYS CA C -8.872 -0.546 10.088 1.00 . A A . 50 CYS CA 1 1 18 13474 1 1 50 CYS CB C -7.504 -0.071 9.617 1.00 . A A . 50 CYS CB 1 1 18 13475 1 1 50 CYS H H -9.607 0.236 8.237 1.00 . A A . 50 CYS H 1 1 18 13476 1 1 50 CYS HA H -8.770 -1.600 10.295 1.00 . A A . 50 CYS HA 1 1 18 13477 1 1 50 CYS HB2 H -7.278 -0.501 8.645 1.00 . A A . 50 CYS HB2 1 1 18 13478 1 1 50 CYS HB3 H -7.566 1.002 9.512 1.00 . A A . 50 CYS HB3 1 1 18 13479 1 1 50 CYS N N -9.837 -0.373 9.015 1.00 . A A . 50 CYS N 1 1 18 13480 1 1 50 CYS O O -9.169 1.415 11.482 1.00 . A A . 50 CYS O 1 1 18 13481 1 1 50 CYS OXT O -9.808 -0.515 12.324 1.00 . A A . 50 CYS OXT 1 1 18 13482 1 1 50 CYS SG S -6.120 -0.446 10.718 1.00 . A A . 50 CYS SG 1 1 19 13483 1 1 1 LEU C C -9.413 -5.682 8.644 1.00 . A A . 1 LEU C 1 1 19 13484 1 1 1 LEU CA C -10.358 -6.191 9.734 1.00 . A A . 1 LEU CA 1 1 19 13485 1 1 1 LEU CB C -10.225 -7.704 9.985 1.00 . A A . 1 LEU CB 1 1 19 13486 1 1 1 LEU CD1 C -10.160 -8.563 7.558 1.00 . A A . 1 LEU CD1 1 1 19 13487 1 1 1 LEU CD2 C -10.724 -10.086 9.444 1.00 . A A . 1 LEU CD2 1 1 19 13488 1 1 1 LEU CG C -10.842 -8.645 8.931 1.00 . A A . 1 LEU CG 1 1 19 13489 1 1 1 LEU H1 H -11.807 -4.769 9.383 1.00 . A A . 1 LEU H1 1 1 19 13490 1 1 1 LEU H2 H -12.026 -6.199 8.527 1.00 . A A . 1 LEU H2 1 1 19 13491 1 1 1 LEU H3 H -12.371 -6.143 10.171 1.00 . A A . 1 LEU H3 1 1 19 13492 1 1 1 LEU HA H -10.076 -5.684 10.659 1.00 . A A . 1 LEU HA 1 1 19 13493 1 1 1 LEU HB2 H -9.170 -7.952 10.107 1.00 . A A . 1 LEU HB2 1 1 19 13494 1 1 1 LEU HB3 H -10.720 -7.911 10.935 1.00 . A A . 1 LEU HB3 1 1 19 13495 1 1 1 LEU HD11 H -9.077 -8.603 7.666 1.00 . A A . 1 LEU HD11 1 1 19 13496 1 1 1 LEU HD12 H -10.482 -9.400 6.938 1.00 . A A . 1 LEU HD12 1 1 19 13497 1 1 1 LEU HD13 H -10.446 -7.648 7.042 1.00 . A A . 1 LEU HD13 1 1 19 13498 1 1 1 LEU HD21 H -11.222 -10.182 10.409 1.00 . A A . 1 LEU HD21 1 1 19 13499 1 1 1 LEU HD22 H -11.195 -10.772 8.741 1.00 . A A . 1 LEU HD22 1 1 19 13500 1 1 1 LEU HD23 H -9.674 -10.358 9.558 1.00 . A A . 1 LEU HD23 1 1 19 13501 1 1 1 LEU HG H -11.904 -8.428 8.812 1.00 . A A . 1 LEU HG 1 1 19 13502 1 1 1 LEU N N -11.745 -5.796 9.431 1.00 . A A . 1 LEU N 1 1 19 13503 1 1 1 LEU O O -9.872 -5.301 7.569 1.00 . A A . 1 LEU O 1 1 19 13504 1 1 2 CYS C C -6.851 -5.863 6.795 1.00 . A A . 2 CYS C 1 1 19 13505 1 1 2 CYS CA C -7.132 -5.032 8.042 1.00 . A A . 2 CYS CA 1 1 19 13506 1 1 2 CYS CB C -5.864 -4.627 8.805 1.00 . A A . 2 CYS CB 1 1 19 13507 1 1 2 CYS H H -7.775 -5.944 9.823 1.00 . A A . 2 CYS H 1 1 19 13508 1 1 2 CYS HA H -7.568 -4.095 7.700 1.00 . A A . 2 CYS HA 1 1 19 13509 1 1 2 CYS HB2 H -5.246 -5.514 8.944 1.00 . A A . 2 CYS HB2 1 1 19 13510 1 1 2 CYS HB3 H -5.318 -3.924 8.193 1.00 . A A . 2 CYS HB3 1 1 19 13511 1 1 2 CYS N N -8.113 -5.631 8.927 1.00 . A A . 2 CYS N 1 1 19 13512 1 1 2 CYS O O -5.982 -6.732 6.779 1.00 . A A . 2 CYS O 1 1 19 13513 1 1 2 CYS SG S -6.106 -3.925 10.457 1.00 . A A . 2 CYS SG 1 1 19 13514 1 1 3 ASN C C -6.021 -5.565 3.855 1.00 . A A . 3 ASN C 1 1 19 13515 1 1 3 ASN CA C -7.335 -6.126 4.397 1.00 . A A . 3 ASN CA 1 1 19 13516 1 1 3 ASN CB C -8.492 -5.777 3.442 1.00 . A A . 3 ASN CB 1 1 19 13517 1 1 3 ASN CG C -9.851 -5.912 4.105 1.00 . A A . 3 ASN CG 1 1 19 13518 1 1 3 ASN H H -8.306 -4.865 5.822 1.00 . A A . 3 ASN H 1 1 19 13519 1 1 3 ASN HA H -7.275 -7.212 4.494 1.00 . A A . 3 ASN HA 1 1 19 13520 1 1 3 ASN HB2 H -8.402 -4.738 3.143 1.00 . A A . 3 ASN HB2 1 1 19 13521 1 1 3 ASN HB3 H -8.460 -6.364 2.522 1.00 . A A . 3 ASN HB3 1 1 19 13522 1 1 3 ASN HD21 H -10.041 -7.870 3.578 1.00 . A A . 3 ASN HD21 1 1 19 13523 1 1 3 ASN HD22 H -11.374 -7.189 4.485 1.00 . A A . 3 ASN HD22 1 1 19 13524 1 1 3 ASN N N -7.546 -5.522 5.706 1.00 . A A . 3 ASN N 1 1 19 13525 1 1 3 ASN ND2 N -10.470 -7.086 4.047 1.00 . A A . 3 ASN ND2 1 1 19 13526 1 1 3 ASN O O -6.027 -4.604 3.087 1.00 . A A . 3 ASN O 1 1 19 13527 1 1 3 ASN OD1 O -10.336 -4.937 4.673 1.00 . A A . 3 ASN OD1 1 1 19 13528 1 1 4 GLU C C -3.299 -6.111 2.480 1.00 . A A . 4 GLU C 1 1 19 13529 1 1 4 GLU CA C -3.578 -5.689 3.924 1.00 . A A . 4 GLU CA 1 1 19 13530 1 1 4 GLU CB C -2.559 -6.284 4.906 1.00 . A A . 4 GLU CB 1 1 19 13531 1 1 4 GLU CD C -0.046 -6.538 4.335 1.00 . A A . 4 GLU CD 1 1 19 13532 1 1 4 GLU CG C -1.216 -5.604 4.638 1.00 . A A . 4 GLU CG 1 1 19 13533 1 1 4 GLU H H -4.942 -6.805 5.047 1.00 . A A . 4 GLU H 1 1 19 13534 1 1 4 GLU HA H -3.553 -4.601 4.014 1.00 . A A . 4 GLU HA 1 1 19 13535 1 1 4 GLU HB2 H -2.867 -6.050 5.928 1.00 . A A . 4 GLU HB2 1 1 19 13536 1 1 4 GLU HB3 H -2.506 -7.368 4.808 1.00 . A A . 4 GLU HB3 1 1 19 13537 1 1 4 GLU HG2 H -1.375 -4.928 3.803 1.00 . A A . 4 GLU HG2 1 1 19 13538 1 1 4 GLU HG3 H -0.955 -5.020 5.515 1.00 . A A . 4 GLU HG3 1 1 19 13539 1 1 4 GLU N N -4.895 -6.135 4.293 1.00 . A A . 4 GLU N 1 1 19 13540 1 1 4 GLU O O -2.629 -7.114 2.231 1.00 . A A . 4 GLU O 1 1 19 13541 1 1 4 GLU OE1 O -0.276 -7.615 3.529 1.00 . A A . 4 GLU OE1 1 1 19 13542 1 1 4 GLU OE2 O 1.063 -6.266 4.797 1.00 . A A . 4 GLU OE2 1 1 19 13543 1 1 5 ARG C C -2.666 -4.951 -0.560 1.00 . A A . 5 ARG C 1 1 19 13544 1 1 5 ARG CA C -3.853 -5.644 0.120 1.00 . A A . 5 ARG CA 1 1 19 13545 1 1 5 ARG CB C -5.214 -5.189 -0.429 1.00 . A A . 5 ARG CB 1 1 19 13546 1 1 5 ARG CD C -7.199 -5.738 -1.920 1.00 . A A . 5 ARG CD 1 1 19 13547 1 1 5 ARG CG C -5.684 -5.896 -1.709 1.00 . A A . 5 ARG CG 1 1 19 13548 1 1 5 ARG CZ C -8.858 -3.863 -2.114 1.00 . A A . 5 ARG CZ 1 1 19 13549 1 1 5 ARG H H -4.216 -4.449 1.861 1.00 . A A . 5 ARG H 1 1 19 13550 1 1 5 ARG HA H -3.795 -6.728 0.022 1.00 . A A . 5 ARG HA 1 1 19 13551 1 1 5 ARG HB2 H -5.956 -5.399 0.339 1.00 . A A . 5 ARG HB2 1 1 19 13552 1 1 5 ARG HB3 H -5.162 -4.118 -0.607 1.00 . A A . 5 ARG HB3 1 1 19 13553 1 1 5 ARG HD2 H -7.469 -6.261 -2.840 1.00 . A A . 5 ARG HD2 1 1 19 13554 1 1 5 ARG HD3 H -7.713 -6.209 -1.081 1.00 . A A . 5 ARG HD3 1 1 19 13555 1 1 5 ARG HG2 H -5.142 -5.500 -2.571 1.00 . A A . 5 ARG HG2 1 1 19 13556 1 1 5 ARG HG3 H -5.487 -6.964 -1.620 1.00 . A A . 5 ARG HG3 1 1 19 13557 1 1 5 ARG HH11 H -9.710 -5.703 -2.013 1.00 . A A . 5 ARG HH11 1 1 19 13558 1 1 5 ARG HH12 H -10.840 -4.391 -2.150 1.00 . A A . 5 ARG HH12 1 1 19 13559 1 1 5 ARG HH21 H -8.261 -1.931 -2.309 1.00 . A A . 5 ARG HH21 1 1 19 13560 1 1 5 ARG HH22 H -9.983 -2.130 -2.284 1.00 . A A . 5 ARG HH22 1 1 19 13561 1 1 5 ARG N N -3.814 -5.329 1.538 1.00 . A A . 5 ARG N 1 1 19 13562 1 1 5 ARG NE N -7.600 -4.327 -2.028 1.00 . A A . 5 ARG NE 1 1 19 13563 1 1 5 ARG NH1 N -9.888 -4.713 -2.082 1.00 . A A . 5 ARG NH1 1 1 19 13564 1 1 5 ARG NH2 N -9.067 -2.551 -2.238 1.00 . A A . 5 ARG NH2 1 1 19 13565 1 1 5 ARG O O -2.332 -3.824 -0.189 1.00 . A A . 5 ARG O 1 1 19 13566 1 1 6 PRO C C -1.091 -3.945 -3.073 1.00 . A A . 6 PRO C 1 1 19 13567 1 1 6 PRO CA C -0.777 -5.101 -2.124 1.00 . A A . 6 PRO CA 1 1 19 13568 1 1 6 PRO CB C -0.159 -6.292 -2.862 1.00 . A A . 6 PRO CB 1 1 19 13569 1 1 6 PRO CD C -2.306 -6.935 -2.019 1.00 . A A . 6 PRO CD 1 1 19 13570 1 1 6 PRO CG C -1.374 -7.151 -3.211 1.00 . A A . 6 PRO CG 1 1 19 13571 1 1 6 PRO HA H -0.077 -4.743 -1.368 1.00 . A A . 6 PRO HA 1 1 19 13572 1 1 6 PRO HB2 H 0.406 -5.998 -3.749 1.00 . A A . 6 PRO HB2 1 1 19 13573 1 1 6 PRO HB3 H 0.485 -6.847 -2.181 1.00 . A A . 6 PRO HB3 1 1 19 13574 1 1 6 PRO HD2 H -3.341 -6.988 -2.350 1.00 . A A . 6 PRO HD2 1 1 19 13575 1 1 6 PRO HD3 H -2.121 -7.678 -1.243 1.00 . A A . 6 PRO HD3 1 1 19 13576 1 1 6 PRO HG2 H -1.843 -6.757 -4.114 1.00 . A A . 6 PRO HG2 1 1 19 13577 1 1 6 PRO HG3 H -1.116 -8.201 -3.352 1.00 . A A . 6 PRO HG3 1 1 19 13578 1 1 6 PRO N N -1.983 -5.619 -1.503 1.00 . A A . 6 PRO N 1 1 19 13579 1 1 6 PRO O O -2.243 -3.722 -3.438 1.00 . A A . 6 PRO O 1 1 19 13580 1 1 7 SER C C -1.082 -2.098 -5.421 1.00 . A A . 7 SER C 1 1 19 13581 1 1 7 SER CA C -0.024 -2.061 -4.321 1.00 . A A . 7 SER CA 1 1 19 13582 1 1 7 SER CB C 1.361 -1.950 -4.967 1.00 . A A . 7 SER CB 1 1 19 13583 1 1 7 SER H H 0.841 -3.404 -2.984 1.00 . A A . 7 SER H 1 1 19 13584 1 1 7 SER HA H -0.179 -1.174 -3.703 1.00 . A A . 7 SER HA 1 1 19 13585 1 1 7 SER HB2 H 1.278 -1.224 -5.774 1.00 . A A . 7 SER HB2 1 1 19 13586 1 1 7 SER HB3 H 2.092 -1.606 -4.237 1.00 . A A . 7 SER HB3 1 1 19 13587 1 1 7 SER HG H 0.973 -3.520 -6.003 1.00 . A A . 7 SER HG 1 1 19 13588 1 1 7 SER N N -0.034 -3.231 -3.461 1.00 . A A . 7 SER N 1 1 19 13589 1 1 7 SER O O -0.879 -2.763 -6.437 1.00 . A A . 7 SER O 1 1 19 13590 1 1 7 SER OG O 1.747 -3.204 -5.508 1.00 . A A . 7 SER OG 1 1 19 13591 1 1 8 GLN C C -2.680 0.207 -7.016 1.00 . A A . 8 GLN C 1 1 19 13592 1 1 8 GLN CA C -3.146 -1.023 -6.236 1.00 . A A . 8 GLN CA 1 1 19 13593 1 1 8 GLN CB C -4.490 -0.794 -5.532 1.00 . A A . 8 GLN CB 1 1 19 13594 1 1 8 GLN CD C -6.350 -1.801 -4.179 1.00 . A A . 8 GLN CD 1 1 19 13595 1 1 8 GLN CG C -5.026 -2.071 -4.878 1.00 . A A . 8 GLN CG 1 1 19 13596 1 1 8 GLN H H -2.230 -0.845 -4.350 1.00 . A A . 8 GLN H 1 1 19 13597 1 1 8 GLN HA H -3.245 -1.859 -6.933 1.00 . A A . 8 GLN HA 1 1 19 13598 1 1 8 GLN HB2 H -4.388 -0.038 -4.751 1.00 . A A . 8 GLN HB2 1 1 19 13599 1 1 8 GLN HB3 H -5.201 -0.439 -6.275 1.00 . A A . 8 GLN HB3 1 1 19 13600 1 1 8 GLN HE21 H -7.226 -1.182 -5.904 1.00 . A A . 8 GLN HE21 1 1 19 13601 1 1 8 GLN HE22 H -8.193 -1.000 -4.450 1.00 . A A . 8 GLN HE22 1 1 19 13602 1 1 8 GLN HG2 H -5.151 -2.846 -5.632 1.00 . A A . 8 GLN HG2 1 1 19 13603 1 1 8 GLN HG3 H -4.313 -2.426 -4.133 1.00 . A A . 8 GLN HG3 1 1 19 13604 1 1 8 GLN N N -2.143 -1.314 -5.236 1.00 . A A . 8 GLN N 1 1 19 13605 1 1 8 GLN NE2 N -7.347 -1.320 -4.912 1.00 . A A . 8 GLN NE2 1 1 19 13606 1 1 8 GLN O O -1.876 0.101 -7.936 1.00 . A A . 8 GLN O 1 1 19 13607 1 1 8 GLN OE1 O -6.482 -2.000 -2.971 1.00 . A A . 8 GLN OE1 1 1 19 13608 1 1 9 THR C C -1.432 3.112 -7.217 1.00 . A A . 9 THR C 1 1 19 13609 1 1 9 THR CA C -2.886 2.651 -7.292 1.00 . A A . 9 THR CA 1 1 19 13610 1 1 9 THR CB C -3.811 3.687 -6.643 1.00 . A A . 9 THR CB 1 1 19 13611 1 1 9 THR CG2 C -5.199 3.615 -7.277 1.00 . A A . 9 THR CG2 1 1 19 13612 1 1 9 THR H H -3.667 1.498 -5.754 1.00 . A A . 9 THR H 1 1 19 13613 1 1 9 THR HA H -3.144 2.542 -8.346 1.00 . A A . 9 THR HA 1 1 19 13614 1 1 9 THR HB H -3.392 4.683 -6.792 1.00 . A A . 9 THR HB 1 1 19 13615 1 1 9 THR HG1 H -4.487 4.085 -4.856 1.00 . A A . 9 THR HG1 1 1 19 13616 1 1 9 THR HG21 H -5.597 2.606 -7.184 1.00 . A A . 9 THR HG21 1 1 19 13617 1 1 9 THR HG22 H -5.879 4.307 -6.785 1.00 . A A . 9 THR HG22 1 1 19 13618 1 1 9 THR HG23 H -5.131 3.880 -8.334 1.00 . A A . 9 THR HG23 1 1 19 13619 1 1 9 THR N N -3.092 1.400 -6.583 1.00 . A A . 9 THR N 1 1 19 13620 1 1 9 THR O O -1.039 4.042 -7.916 1.00 . A A . 9 THR O 1 1 19 13621 1 1 9 THR OG1 O -3.936 3.409 -5.257 1.00 . A A . 9 THR OG1 1 1 19 13622 1 1 10 TRP C C 1.391 2.010 -7.735 1.00 . A A . 10 TRP C 1 1 19 13623 1 1 10 TRP CA C 0.816 2.612 -6.444 1.00 . A A . 10 TRP CA 1 1 19 13624 1 1 10 TRP CB C 1.444 1.964 -5.212 1.00 . A A . 10 TRP CB 1 1 19 13625 1 1 10 TRP CD1 C 3.929 1.627 -5.606 1.00 . A A . 10 TRP CD1 1 1 19 13626 1 1 10 TRP CD2 C 3.449 3.485 -4.456 1.00 . A A . 10 TRP CD2 1 1 19 13627 1 1 10 TRP CE2 C 4.844 3.517 -4.713 1.00 . A A . 10 TRP CE2 1 1 19 13628 1 1 10 TRP CE3 C 2.893 4.566 -3.753 1.00 . A A . 10 TRP CE3 1 1 19 13629 1 1 10 TRP CG C 2.887 2.308 -5.085 1.00 . A A . 10 TRP CG 1 1 19 13630 1 1 10 TRP CH2 C 5.062 5.668 -3.629 1.00 . A A . 10 TRP CH2 1 1 19 13631 1 1 10 TRP CZ2 C 5.651 4.588 -4.308 1.00 . A A . 10 TRP CZ2 1 1 19 13632 1 1 10 TRP CZ3 C 3.675 5.672 -3.377 1.00 . A A . 10 TRP CZ3 1 1 19 13633 1 1 10 TRP H H -1.007 1.734 -5.800 1.00 . A A . 10 TRP H 1 1 19 13634 1 1 10 TRP HA H 1.046 3.680 -6.428 1.00 . A A . 10 TRP HA 1 1 19 13635 1 1 10 TRP HB2 H 0.933 2.334 -4.323 1.00 . A A . 10 TRP HB2 1 1 19 13636 1 1 10 TRP HB3 H 1.321 0.888 -5.250 1.00 . A A . 10 TRP HB3 1 1 19 13637 1 1 10 TRP HD1 H 3.845 0.717 -6.184 1.00 . A A . 10 TRP HD1 1 1 19 13638 1 1 10 TRP HE1 H 6.013 2.091 -5.728 1.00 . A A . 10 TRP HE1 1 1 19 13639 1 1 10 TRP HE3 H 1.838 4.532 -3.535 1.00 . A A . 10 TRP HE3 1 1 19 13640 1 1 10 TRP HH2 H 5.687 6.495 -3.337 1.00 . A A . 10 TRP HH2 1 1 19 13641 1 1 10 TRP HZ2 H 6.696 4.609 -4.570 1.00 . A A . 10 TRP HZ2 1 1 19 13642 1 1 10 TRP HZ3 H 3.174 6.526 -2.931 1.00 . A A . 10 TRP HZ3 1 1 19 13643 1 1 10 TRP N N -0.620 2.451 -6.391 1.00 . A A . 10 TRP N 1 1 19 13644 1 1 10 TRP NE1 N 5.090 2.344 -5.396 1.00 . A A . 10 TRP NE1 1 1 19 13645 1 1 10 TRP O O 2.307 2.580 -8.316 1.00 . A A . 10 TRP O 1 1 19 13646 1 1 11 SER C C 2.817 0.134 -9.584 1.00 . A A . 11 SER C 1 1 19 13647 1 1 11 SER CA C 1.301 0.112 -9.344 1.00 . A A . 11 SER CA 1 1 19 13648 1 1 11 SER CB C 0.541 0.644 -10.566 1.00 . A A . 11 SER CB 1 1 19 13649 1 1 11 SER H H 0.039 0.499 -7.692 1.00 . A A . 11 SER H 1 1 19 13650 1 1 11 SER HA H 1.029 -0.931 -9.193 1.00 . A A . 11 SER HA 1 1 19 13651 1 1 11 SER HB2 H 0.699 1.722 -10.658 1.00 . A A . 11 SER HB2 1 1 19 13652 1 1 11 SER HB3 H 0.918 0.165 -11.472 1.00 . A A . 11 SER HB3 1 1 19 13653 1 1 11 SER HG H -1.130 0.455 -9.548 1.00 . A A . 11 SER HG 1 1 19 13654 1 1 11 SER N N 0.874 0.844 -8.152 1.00 . A A . 11 SER N 1 1 19 13655 1 1 11 SER O O 3.276 0.642 -10.603 1.00 . A A . 11 SER O 1 1 19 13656 1 1 11 SER OG O -0.841 0.360 -10.464 1.00 . A A . 11 SER OG 1 1 19 13657 1 1 12 GLY C C 5.738 -1.099 -7.627 1.00 . A A . 12 GLY C 1 1 19 13658 1 1 12 GLY CA C 5.043 -0.540 -8.863 1.00 . A A . 12 GLY CA 1 1 19 13659 1 1 12 GLY H H 3.204 -0.884 -7.854 1.00 . A A . 12 GLY H 1 1 19 13660 1 1 12 GLY HA2 H 5.264 -1.182 -9.717 1.00 . A A . 12 GLY HA2 1 1 19 13661 1 1 12 GLY HA3 H 5.429 0.462 -9.062 1.00 . A A . 12 GLY HA3 1 1 19 13662 1 1 12 GLY N N 3.601 -0.460 -8.679 1.00 . A A . 12 GLY N 1 1 19 13663 1 1 12 GLY O O 5.107 -1.764 -6.795 1.00 . A A . 12 GLY O 1 1 19 13664 1 1 13 ASN C C 7.725 0.240 -5.453 1.00 . A A . 13 ASN C 1 1 19 13665 1 1 13 ASN CA C 7.812 -1.033 -6.293 1.00 . A A . 13 ASN CA 1 1 19 13666 1 1 13 ASN CB C 9.271 -1.362 -6.638 1.00 . A A . 13 ASN CB 1 1 19 13667 1 1 13 ASN CG C 10.091 -1.763 -5.408 1.00 . A A . 13 ASN CG 1 1 19 13668 1 1 13 ASN H H 7.461 -0.227 -8.213 1.00 . A A . 13 ASN H 1 1 19 13669 1 1 13 ASN HA H 7.383 -1.877 -5.763 1.00 . A A . 13 ASN HA 1 1 19 13670 1 1 13 ASN HB2 H 9.282 -2.198 -7.338 1.00 . A A . 13 ASN HB2 1 1 19 13671 1 1 13 ASN HB3 H 9.740 -0.503 -7.122 1.00 . A A . 13 ASN HB3 1 1 19 13672 1 1 13 ASN HD21 H 10.375 0.194 -4.779 1.00 . A A . 13 ASN HD21 1 1 19 13673 1 1 13 ASN HD22 H 11.160 -1.055 -3.853 1.00 . A A . 13 ASN HD22 1 1 19 13674 1 1 13 ASN N N 7.038 -0.816 -7.508 1.00 . A A . 13 ASN N 1 1 19 13675 1 1 13 ASN ND2 N 10.578 -0.796 -4.632 1.00 . A A . 13 ASN ND2 1 1 19 13676 1 1 13 ASN O O 7.591 1.327 -6.009 1.00 . A A . 13 ASN O 1 1 19 13677 1 1 13 ASN OD1 O 10.302 -2.951 -5.160 1.00 . A A . 13 ASN OD1 1 1 19 13678 1 1 14 CYS C C 8.847 2.250 -3.517 1.00 . A A . 14 CYS C 1 1 19 13679 1 1 14 CYS CA C 7.748 1.236 -3.196 1.00 . A A . 14 CYS CA 1 1 19 13680 1 1 14 CYS CB C 7.934 0.718 -1.771 1.00 . A A . 14 CYS CB 1 1 19 13681 1 1 14 CYS H H 7.952 -0.804 -3.750 1.00 . A A . 14 CYS H 1 1 19 13682 1 1 14 CYS HA H 6.773 1.720 -3.262 1.00 . A A . 14 CYS HA 1 1 19 13683 1 1 14 CYS HB2 H 7.142 0.007 -1.538 1.00 . A A . 14 CYS HB2 1 1 19 13684 1 1 14 CYS HB3 H 8.896 0.212 -1.719 1.00 . A A . 14 CYS HB3 1 1 19 13685 1 1 14 CYS N N 7.776 0.117 -4.127 1.00 . A A . 14 CYS N 1 1 19 13686 1 1 14 CYS O O 9.893 1.883 -4.055 1.00 . A A . 14 CYS O 1 1 19 13687 1 1 14 CYS SG S 7.944 2.015 -0.508 1.00 . A A . 14 CYS SG 1 1 19 13688 1 1 15 GLY C C 9.596 5.319 -1.868 1.00 . A A . 15 GLY C 1 1 19 13689 1 1 15 GLY CA C 9.529 4.622 -3.224 1.00 . A A . 15 GLY CA 1 1 19 13690 1 1 15 GLY H H 7.714 3.669 -2.689 1.00 . A A . 15 GLY H 1 1 19 13691 1 1 15 GLY HA2 H 10.526 4.274 -3.482 1.00 . A A . 15 GLY HA2 1 1 19 13692 1 1 15 GLY HA3 H 9.197 5.332 -3.980 1.00 . A A . 15 GLY HA3 1 1 19 13693 1 1 15 GLY N N 8.593 3.510 -3.158 1.00 . A A . 15 GLY N 1 1 19 13694 1 1 15 GLY O O 10.671 5.533 -1.321 1.00 . A A . 15 GLY O 1 1 19 13695 1 1 16 ASN C C 6.981 5.794 0.655 1.00 . A A . 16 ASN C 1 1 19 13696 1 1 16 ASN CA C 8.285 6.253 0.008 1.00 . A A . 16 ASN CA 1 1 19 13697 1 1 16 ASN CB C 8.360 7.782 -0.075 1.00 . A A . 16 ASN CB 1 1 19 13698 1 1 16 ASN CG C 8.543 8.412 1.300 1.00 . A A . 16 ASN CG 1 1 19 13699 1 1 16 ASN H H 7.584 5.452 -1.828 1.00 . A A . 16 ASN H 1 1 19 13700 1 1 16 ASN HA H 9.119 5.909 0.625 1.00 . A A . 16 ASN HA 1 1 19 13701 1 1 16 ASN HB2 H 9.221 8.057 -0.685 1.00 . A A . 16 ASN HB2 1 1 19 13702 1 1 16 ASN HB3 H 7.460 8.194 -0.530 1.00 . A A . 16 ASN HB3 1 1 19 13703 1 1 16 ASN HD21 H 9.848 9.806 0.580 1.00 . A A . 16 ASN HD21 1 1 19 13704 1 1 16 ASN HD22 H 9.473 9.893 2.287 1.00 . A A . 16 ASN HD22 1 1 19 13705 1 1 16 ASN N N 8.425 5.663 -1.320 1.00 . A A . 16 ASN N 1 1 19 13706 1 1 16 ASN ND2 N 9.349 9.462 1.387 1.00 . A A . 16 ASN ND2 1 1 19 13707 1 1 16 ASN O O 5.911 5.948 0.069 1.00 . A A . 16 ASN O 1 1 19 13708 1 1 16 ASN OD1 O 7.943 7.974 2.276 1.00 . A A . 16 ASN OD1 1 1 19 13709 1 1 17 THR C C 4.931 5.846 2.974 1.00 . A A . 17 THR C 1 1 19 13710 1 1 17 THR CA C 5.914 4.729 2.593 1.00 . A A . 17 THR CA 1 1 19 13711 1 1 17 THR CB C 6.384 3.876 3.781 1.00 . A A . 17 THR CB 1 1 19 13712 1 1 17 THR CG2 C 7.006 4.698 4.914 1.00 . A A . 17 THR CG2 1 1 19 13713 1 1 17 THR H H 7.972 5.187 2.310 1.00 . A A . 17 THR H 1 1 19 13714 1 1 17 THR HA H 5.395 4.057 1.917 1.00 . A A . 17 THR HA 1 1 19 13715 1 1 17 THR HB H 7.136 3.186 3.404 1.00 . A A . 17 THR HB 1 1 19 13716 1 1 17 THR HG1 H 4.656 3.687 4.654 1.00 . A A . 17 THR HG1 1 1 19 13717 1 1 17 THR HG21 H 7.837 5.296 4.541 1.00 . A A . 17 THR HG21 1 1 19 13718 1 1 17 THR HG22 H 6.266 5.360 5.367 1.00 . A A . 17 THR HG22 1 1 19 13719 1 1 17 THR HG23 H 7.383 4.021 5.682 1.00 . A A . 17 THR HG23 1 1 19 13720 1 1 17 THR N N 7.066 5.243 1.867 1.00 . A A . 17 THR N 1 1 19 13721 1 1 17 THR O O 3.723 5.611 3.045 1.00 . A A . 17 THR O 1 1 19 13722 1 1 17 THR OG1 O 5.320 3.096 4.283 1.00 . A A . 17 THR OG1 1 1 19 13723 1 1 18 ALA C C 3.660 8.366 2.125 1.00 . A A . 18 ALA C 1 1 19 13724 1 1 18 ALA CA C 4.531 8.211 3.370 1.00 . A A . 18 ALA CA 1 1 19 13725 1 1 18 ALA CB C 5.347 9.476 3.645 1.00 . A A . 18 ALA CB 1 1 19 13726 1 1 18 ALA H H 6.414 7.244 3.087 1.00 . A A . 18 ALA H 1 1 19 13727 1 1 18 ALA HA H 3.888 8.024 4.233 1.00 . A A . 18 ALA HA 1 1 19 13728 1 1 18 ALA HB1 H 5.971 9.328 4.526 1.00 . A A . 18 ALA HB1 1 1 19 13729 1 1 18 ALA HB2 H 5.982 9.717 2.792 1.00 . A A . 18 ALA HB2 1 1 19 13730 1 1 18 ALA HB3 H 4.670 10.312 3.827 1.00 . A A . 18 ALA HB3 1 1 19 13731 1 1 18 ALA N N 5.419 7.071 3.182 1.00 . A A . 18 ALA N 1 1 19 13732 1 1 18 ALA O O 2.437 8.465 2.208 1.00 . A A . 18 ALA O 1 1 19 13733 1 1 19 HIS C C 2.642 7.250 -0.492 1.00 . A A . 19 HIS C 1 1 19 13734 1 1 19 HIS CA C 3.568 8.457 -0.308 1.00 . A A . 19 HIS CA 1 1 19 13735 1 1 19 HIS CB C 4.537 8.646 -1.483 1.00 . A A . 19 HIS CB 1 1 19 13736 1 1 19 HIS CD2 C 2.617 9.500 -3.033 1.00 . A A . 19 HIS CD2 1 1 19 13737 1 1 19 HIS CE1 C 3.618 9.219 -4.955 1.00 . A A . 19 HIS CE1 1 1 19 13738 1 1 19 HIS CG C 3.883 9.029 -2.791 1.00 . A A . 19 HIS CG 1 1 19 13739 1 1 19 HIS H H 5.285 8.171 0.936 1.00 . A A . 19 HIS H 1 1 19 13740 1 1 19 HIS HA H 2.955 9.355 -0.237 1.00 . A A . 19 HIS HA 1 1 19 13741 1 1 19 HIS HB2 H 5.235 9.438 -1.240 1.00 . A A . 19 HIS HB2 1 1 19 13742 1 1 19 HIS HB3 H 5.106 7.728 -1.605 1.00 . A A . 19 HIS HB3 1 1 19 13743 1 1 19 HIS HD1 H 5.488 8.642 -4.180 1.00 . A A . 19 HIS HD1 1 1 19 13744 1 1 19 HIS HD2 H 1.856 9.682 -2.284 1.00 . A A . 19 HIS HD2 1 1 19 13745 1 1 19 HIS HE1 H 3.797 9.171 -6.021 1.00 . A A . 19 HIS HE1 1 1 19 13746 1 1 19 HIS N N 4.290 8.348 0.946 1.00 . A A . 19 HIS N 1 1 19 13747 1 1 19 HIS ND1 N 4.532 8.929 -4.015 1.00 . A A . 19 HIS ND1 1 1 19 13748 1 1 19 HIS NE2 N 2.443 9.559 -4.403 1.00 . A A . 19 HIS NE2 1 1 19 13749 1 1 19 HIS O O 1.520 7.425 -0.957 1.00 . A A . 19 HIS O 1 1 19 13750 1 1 20 CYS C C 0.935 5.127 0.621 1.00 . A A . 20 CYS C 1 1 19 13751 1 1 20 CYS CA C 2.224 4.854 -0.145 1.00 . A A . 20 CYS CA 1 1 19 13752 1 1 20 CYS CB C 2.924 3.649 0.484 1.00 . A A . 20 CYS CB 1 1 19 13753 1 1 20 CYS H H 4.053 5.943 0.163 1.00 . A A . 20 CYS H 1 1 19 13754 1 1 20 CYS HA H 1.962 4.610 -1.170 1.00 . A A . 20 CYS HA 1 1 19 13755 1 1 20 CYS HB2 H 3.782 3.356 -0.118 1.00 . A A . 20 CYS HB2 1 1 19 13756 1 1 20 CYS HB3 H 3.269 3.903 1.476 1.00 . A A . 20 CYS HB3 1 1 19 13757 1 1 20 CYS N N 3.087 6.039 -0.136 1.00 . A A . 20 CYS N 1 1 19 13758 1 1 20 CYS O O -0.166 4.918 0.108 1.00 . A A . 20 CYS O 1 1 19 13759 1 1 20 CYS SG S 1.837 2.230 0.748 1.00 . A A . 20 CYS SG 1 1 19 13760 1 1 21 ASP C C -0.945 6.998 2.003 1.00 . A A . 21 ASP C 1 1 19 13761 1 1 21 ASP CA C -0.067 5.939 2.676 1.00 . A A . 21 ASP CA 1 1 19 13762 1 1 21 ASP CB C 0.398 6.428 4.049 1.00 . A A . 21 ASP CB 1 1 19 13763 1 1 21 ASP CG C -0.811 6.875 4.851 1.00 . A A . 21 ASP CG 1 1 19 13764 1 1 21 ASP H H 2.016 5.809 2.209 1.00 . A A . 21 ASP H 1 1 19 13765 1 1 21 ASP HA H -0.645 5.016 2.807 1.00 . A A . 21 ASP HA 1 1 19 13766 1 1 21 ASP HB2 H 0.913 5.629 4.581 1.00 . A A . 21 ASP HB2 1 1 19 13767 1 1 21 ASP HB3 H 1.078 7.273 3.945 1.00 . A A . 21 ASP HB3 1 1 19 13768 1 1 21 ASP N N 1.080 5.655 1.838 1.00 . A A . 21 ASP N 1 1 19 13769 1 1 21 ASP O O -2.160 6.806 1.923 1.00 . A A . 21 ASP O 1 1 19 13770 1 1 21 ASP OD1 O -1.678 6.044 5.108 1.00 . A A . 21 ASP OD1 1 1 19 13771 1 1 21 ASP OD2 O -0.866 8.193 5.176 1.00 . A A . 21 ASP OD2 1 1 19 13772 1 1 22 LYS C C -1.932 8.402 -0.319 1.00 . A A . 22 LYS C 1 1 19 13773 1 1 22 LYS CA C -1.095 9.087 0.743 1.00 . A A . 22 LYS CA 1 1 19 13774 1 1 22 LYS CB C -0.225 10.136 0.042 1.00 . A A . 22 LYS CB 1 1 19 13775 1 1 22 LYS CD C 1.077 12.319 0.452 1.00 . A A . 22 LYS CD 1 1 19 13776 1 1 22 LYS CE C 0.121 13.196 -0.380 1.00 . A A . 22 LYS CE 1 1 19 13777 1 1 22 LYS CG C 0.469 11.037 1.048 1.00 . A A . 22 LYS CG 1 1 19 13778 1 1 22 LYS H H 0.662 8.190 1.618 1.00 . A A . 22 LYS H 1 1 19 13779 1 1 22 LYS HA H -1.754 9.606 1.437 1.00 . A A . 22 LYS HA 1 1 19 13780 1 1 22 LYS HB2 H 0.518 9.654 -0.582 1.00 . A A . 22 LYS HB2 1 1 19 13781 1 1 22 LYS HB3 H -0.875 10.727 -0.601 1.00 . A A . 22 LYS HB3 1 1 19 13782 1 1 22 LYS HD2 H 1.473 12.912 1.280 1.00 . A A . 22 LYS HD2 1 1 19 13783 1 1 22 LYS HD3 H 1.923 12.045 -0.182 1.00 . A A . 22 LYS HD3 1 1 19 13784 1 1 22 LYS HE2 H 0.577 14.181 -0.498 1.00 . A A . 22 LYS HE2 1 1 19 13785 1 1 22 LYS HE3 H 0.002 12.762 -1.376 1.00 . A A . 22 LYS HE3 1 1 19 13786 1 1 22 LYS HG2 H -0.207 11.276 1.868 1.00 . A A . 22 LYS HG2 1 1 19 13787 1 1 22 LYS HG3 H 1.272 10.417 1.430 1.00 . A A . 22 LYS HG3 1 1 19 13788 1 1 22 LYS HZ1 H -1.770 14.030 -0.324 1.00 . A A . 22 LYS HZ1 1 1 19 13789 1 1 22 LYS HZ2 H -1.705 12.442 0.226 1.00 . A A . 22 LYS HZ2 1 1 19 13790 1 1 22 LYS N N -0.342 8.088 1.499 1.00 . A A . 22 LYS N 1 1 19 13791 1 1 22 LYS NZ N -1.222 13.352 0.225 1.00 . A A . 22 LYS NZ 1 1 19 13792 1 1 22 LYS O O -3.146 8.543 -0.318 1.00 . A A . 22 LYS O 1 1 19 13793 1 1 23 GLN C C -3.163 6.165 -1.785 1.00 . A A . 23 GLN C 1 1 19 13794 1 1 23 GLN CA C -1.986 6.995 -2.307 1.00 . A A . 23 GLN CA 1 1 19 13795 1 1 23 GLN CB C -1.069 6.214 -3.247 1.00 . A A . 23 GLN CB 1 1 19 13796 1 1 23 GLN CD C 0.039 7.440 -5.197 1.00 . A A . 23 GLN CD 1 1 19 13797 1 1 23 GLN CG C 0.124 7.056 -3.726 1.00 . A A . 23 GLN CG 1 1 19 13798 1 1 23 GLN H H -0.280 7.572 -1.112 1.00 . A A . 23 GLN H 1 1 19 13799 1 1 23 GLN HA H -2.351 7.789 -2.946 1.00 . A A . 23 GLN HA 1 1 19 13800 1 1 23 GLN HB2 H -0.677 5.355 -2.699 1.00 . A A . 23 GLN HB2 1 1 19 13801 1 1 23 GLN HB3 H -1.659 5.839 -4.082 1.00 . A A . 23 GLN HB3 1 1 19 13802 1 1 23 GLN HE21 H -0.291 5.507 -5.777 1.00 . A A . 23 GLN HE21 1 1 19 13803 1 1 23 GLN HE22 H -0.232 6.682 -7.053 1.00 . A A . 23 GLN HE22 1 1 19 13804 1 1 23 GLN HG2 H 0.208 7.984 -3.169 1.00 . A A . 23 GLN HG2 1 1 19 13805 1 1 23 GLN HG3 H 1.038 6.499 -3.601 1.00 . A A . 23 GLN HG3 1 1 19 13806 1 1 23 GLN N N -1.282 7.678 -1.229 1.00 . A A . 23 GLN N 1 1 19 13807 1 1 23 GLN NE2 N -0.168 6.463 -6.072 1.00 . A A . 23 GLN NE2 1 1 19 13808 1 1 23 GLN O O -4.301 6.347 -2.218 1.00 . A A . 23 GLN O 1 1 19 13809 1 1 23 GLN OE1 O 0.206 8.611 -5.535 1.00 . A A . 23 GLN OE1 1 1 19 13810 1 1 24 CYS C C -5.131 5.102 0.277 1.00 . A A . 24 CYS C 1 1 19 13811 1 1 24 CYS CA C -3.923 4.370 -0.324 1.00 . A A . 24 CYS CA 1 1 19 13812 1 1 24 CYS CB C -3.310 3.438 0.725 1.00 . A A . 24 CYS CB 1 1 19 13813 1 1 24 CYS H H -1.948 5.185 -0.484 1.00 . A A . 24 CYS H 1 1 19 13814 1 1 24 CYS HA H -4.286 3.795 -1.182 1.00 . A A . 24 CYS HA 1 1 19 13815 1 1 24 CYS HB2 H -2.849 4.041 1.507 1.00 . A A . 24 CYS HB2 1 1 19 13816 1 1 24 CYS HB3 H -4.102 2.845 1.174 1.00 . A A . 24 CYS HB3 1 1 19 13817 1 1 24 CYS N N -2.903 5.280 -0.824 1.00 . A A . 24 CYS N 1 1 19 13818 1 1 24 CYS O O -6.262 4.638 0.133 1.00 . A A . 24 CYS O 1 1 19 13819 1 1 24 CYS SG S -2.083 2.255 0.128 1.00 . A A . 24 CYS SG 1 1 19 13820 1 1 25 GLN C C -6.669 7.916 0.533 1.00 . A A . 25 GLN C 1 1 19 13821 1 1 25 GLN CA C -6.010 6.989 1.567 1.00 . A A . 25 GLN CA 1 1 19 13822 1 1 25 GLN CB C -5.488 7.799 2.760 1.00 . A A . 25 GLN CB 1 1 19 13823 1 1 25 GLN CD C -4.368 7.732 5.006 1.00 . A A . 25 GLN CD 1 1 19 13824 1 1 25 GLN CG C -4.918 6.899 3.855 1.00 . A A . 25 GLN CG 1 1 19 13825 1 1 25 GLN H H -3.956 6.536 1.118 1.00 . A A . 25 GLN H 1 1 19 13826 1 1 25 GLN HA H -6.764 6.302 1.961 1.00 . A A . 25 GLN HA 1 1 19 13827 1 1 25 GLN HB2 H -4.708 8.487 2.443 1.00 . A A . 25 GLN HB2 1 1 19 13828 1 1 25 GLN HB3 H -6.310 8.376 3.188 1.00 . A A . 25 GLN HB3 1 1 19 13829 1 1 25 GLN HE21 H -5.517 6.736 6.346 1.00 . A A . 25 GLN HE21 1 1 19 13830 1 1 25 GLN HE22 H -4.524 8.027 7.004 1.00 . A A . 25 GLN HE22 1 1 19 13831 1 1 25 GLN HG2 H -5.708 6.238 4.211 1.00 . A A . 25 GLN HG2 1 1 19 13832 1 1 25 GLN HG3 H -4.104 6.292 3.461 1.00 . A A . 25 GLN HG3 1 1 19 13833 1 1 25 GLN N N -4.914 6.221 0.974 1.00 . A A . 25 GLN N 1 1 19 13834 1 1 25 GLN NE2 N -4.844 7.487 6.217 1.00 . A A . 25 GLN NE2 1 1 19 13835 1 1 25 GLN O O -7.878 8.159 0.556 1.00 . A A . 25 GLN O 1 1 19 13836 1 1 25 GLN OE1 O -3.514 8.594 4.816 1.00 . A A . 25 GLN OE1 1 1 19 13837 1 1 26 ASP C C -6.863 9.002 -2.514 1.00 . A A . 26 ASP C 1 1 19 13838 1 1 26 ASP CA C -6.223 9.582 -1.255 1.00 . A A . 26 ASP CA 1 1 19 13839 1 1 26 ASP CB C -5.009 10.457 -1.619 1.00 . A A . 26 ASP CB 1 1 19 13840 1 1 26 ASP CG C -4.338 11.190 -0.447 1.00 . A A . 26 ASP CG 1 1 19 13841 1 1 26 ASP H H -4.889 8.199 -0.339 1.00 . A A . 26 ASP H 1 1 19 13842 1 1 26 ASP HA H -6.956 10.233 -0.788 1.00 . A A . 26 ASP HA 1 1 19 13843 1 1 26 ASP HB2 H -4.258 9.851 -2.119 1.00 . A A . 26 ASP HB2 1 1 19 13844 1 1 26 ASP HB3 H -5.344 11.196 -2.342 1.00 . A A . 26 ASP HB3 1 1 19 13845 1 1 26 ASP N N -5.852 8.509 -0.340 1.00 . A A . 26 ASP N 1 1 19 13846 1 1 26 ASP O O -8.010 9.324 -2.822 1.00 . A A . 26 ASP O 1 1 19 13847 1 1 26 ASP OD1 O -4.961 11.158 0.764 1.00 . A A . 26 ASP OD1 1 1 19 13848 1 1 26 ASP OD2 O -3.268 11.774 -0.633 1.00 . A A . 26 ASP OD2 1 1 19 13849 1 1 27 TRP C C -7.532 6.489 -4.215 1.00 . A A . 27 TRP C 1 1 19 13850 1 1 27 TRP CA C -6.507 7.579 -4.500 1.00 . A A . 27 TRP CA 1 1 19 13851 1 1 27 TRP CB C -5.302 6.926 -5.188 1.00 . A A . 27 TRP CB 1 1 19 13852 1 1 27 TRP CD1 C -3.683 8.864 -5.204 1.00 . A A . 27 TRP CD1 1 1 19 13853 1 1 27 TRP CD2 C -3.637 7.699 -7.107 1.00 . A A . 27 TRP CD2 1 1 19 13854 1 1 27 TRP CE2 C -2.591 8.664 -7.188 1.00 . A A . 27 TRP CE2 1 1 19 13855 1 1 27 TRP CE3 C -3.818 6.847 -8.211 1.00 . A A . 27 TRP CE3 1 1 19 13856 1 1 27 TRP CG C -4.269 7.811 -5.802 1.00 . A A . 27 TRP CG 1 1 19 13857 1 1 27 TRP CH2 C -1.897 7.824 -9.349 1.00 . A A . 27 TRP CH2 1 1 19 13858 1 1 27 TRP CZ2 C -1.736 8.742 -8.295 1.00 . A A . 27 TRP CZ2 1 1 19 13859 1 1 27 TRP CZ3 C -2.941 6.883 -9.307 1.00 . A A . 27 TRP CZ3 1 1 19 13860 1 1 27 TRP H H -5.218 7.884 -2.834 1.00 . A A . 27 TRP H 1 1 19 13861 1 1 27 TRP HA H -6.945 8.336 -5.152 1.00 . A A . 27 TRP HA 1 1 19 13862 1 1 27 TRP HB2 H -4.777 6.241 -4.533 1.00 . A A . 27 TRP HB2 1 1 19 13863 1 1 27 TRP HB3 H -5.702 6.302 -5.977 1.00 . A A . 27 TRP HB3 1 1 19 13864 1 1 27 TRP HD1 H -3.912 9.199 -4.212 1.00 . A A . 27 TRP HD1 1 1 19 13865 1 1 27 TRP HE1 H -2.061 10.120 -5.738 1.00 . A A . 27 TRP HE1 1 1 19 13866 1 1 27 TRP HE3 H -4.634 6.144 -8.194 1.00 . A A . 27 TRP HE3 1 1 19 13867 1 1 27 TRP HH2 H -1.226 7.827 -10.190 1.00 . A A . 27 TRP HH2 1 1 19 13868 1 1 27 TRP HZ2 H -0.947 9.478 -8.330 1.00 . A A . 27 TRP HZ2 1 1 19 13869 1 1 27 TRP HZ3 H -3.061 6.171 -10.110 1.00 . A A . 27 TRP HZ3 1 1 19 13870 1 1 27 TRP N N -6.108 8.165 -3.227 1.00 . A A . 27 TRP N 1 1 19 13871 1 1 27 TRP NE1 N -2.681 9.368 -6.000 1.00 . A A . 27 TRP NE1 1 1 19 13872 1 1 27 TRP O O -8.667 6.545 -4.684 1.00 . A A . 27 TRP O 1 1 19 13873 1 1 28 GLU C C -8.726 5.125 -1.704 1.00 . A A . 28 GLU C 1 1 19 13874 1 1 28 GLU CA C -7.999 4.480 -2.895 1.00 . A A . 28 GLU CA 1 1 19 13875 1 1 28 GLU CB C -7.190 3.193 -2.594 1.00 . A A . 28 GLU CB 1 1 19 13876 1 1 28 GLU CD C -8.909 1.355 -3.140 1.00 . A A . 28 GLU CD 1 1 19 13877 1 1 28 GLU CG C -7.584 2.021 -3.512 1.00 . A A . 28 GLU CG 1 1 19 13878 1 1 28 GLU H H -6.189 5.602 -3.012 1.00 . A A . 28 GLU H 1 1 19 13879 1 1 28 GLU HA H -8.759 4.256 -3.645 1.00 . A A . 28 GLU HA 1 1 19 13880 1 1 28 GLU HB2 H -6.134 3.393 -2.781 1.00 . A A . 28 GLU HB2 1 1 19 13881 1 1 28 GLU HB3 H -7.259 2.873 -1.557 1.00 . A A . 28 GLU HB3 1 1 19 13882 1 1 28 GLU HG2 H -7.635 2.367 -4.545 1.00 . A A . 28 GLU HG2 1 1 19 13883 1 1 28 GLU HG3 H -6.801 1.264 -3.451 1.00 . A A . 28 GLU HG3 1 1 19 13884 1 1 28 GLU N N -7.105 5.493 -3.433 1.00 . A A . 28 GLU N 1 1 19 13885 1 1 28 GLU O O -8.879 6.343 -1.672 1.00 . A A . 28 GLU O 1 1 19 13886 1 1 28 GLU OE1 O -9.882 2.165 -2.642 1.00 . A A . 28 GLU OE1 1 1 19 13887 1 1 28 GLU OE2 O -9.037 0.138 -3.274 1.00 . A A . 28 GLU OE2 1 1 19 13888 1 1 29 LYS C C -9.653 3.715 1.517 1.00 . A A . 29 LYS C 1 1 19 13889 1 1 29 LYS CA C -9.886 4.789 0.460 1.00 . A A . 29 LYS CA 1 1 19 13890 1 1 29 LYS CB C -11.391 4.932 0.141 1.00 . A A . 29 LYS CB 1 1 19 13891 1 1 29 LYS CD C -11.694 7.465 0.145 1.00 . A A . 29 LYS CD 1 1 19 13892 1 1 29 LYS CE C -11.388 8.687 -0.729 1.00 . A A . 29 LYS CE 1 1 19 13893 1 1 29 LYS CG C -11.810 6.166 -0.675 1.00 . A A . 29 LYS CG 1 1 19 13894 1 1 29 LYS H H -8.908 3.392 -0.698 1.00 . A A . 29 LYS H 1 1 19 13895 1 1 29 LYS HA H -9.438 5.702 0.814 1.00 . A A . 29 LYS HA 1 1 19 13896 1 1 29 LYS HB2 H -11.714 4.037 -0.393 1.00 . A A . 29 LYS HB2 1 1 19 13897 1 1 29 LYS HB3 H -11.946 4.974 1.079 1.00 . A A . 29 LYS HB3 1 1 19 13898 1 1 29 LYS HD2 H -12.643 7.623 0.662 1.00 . A A . 29 LYS HD2 1 1 19 13899 1 1 29 LYS HD3 H -10.923 7.374 0.912 1.00 . A A . 29 LYS HD3 1 1 19 13900 1 1 29 LYS HE2 H -12.064 8.713 -1.586 1.00 . A A . 29 LYS HE2 1 1 19 13901 1 1 29 LYS HE3 H -11.543 9.592 -0.138 1.00 . A A . 29 LYS HE3 1 1 19 13902 1 1 29 LYS HG2 H -11.252 6.204 -1.606 1.00 . A A . 29 LYS HG2 1 1 19 13903 1 1 29 LYS HG3 H -12.860 6.041 -0.950 1.00 . A A . 29 LYS HG3 1 1 19 13904 1 1 29 LYS HZ1 H -9.736 7.721 -1.504 1.00 . A A . 29 LYS HZ1 1 1 19 13905 1 1 29 LYS HZ2 H -9.871 9.331 -1.972 1.00 . A A . 29 LYS HZ2 1 1 19 13906 1 1 29 LYS N N -9.119 4.363 -0.689 1.00 . A A . 29 LYS N 1 1 19 13907 1 1 29 LYS NZ N -9.984 8.670 -1.190 1.00 . A A . 29 LYS NZ 1 1 19 13908 1 1 29 LYS O O -10.569 3.061 2.011 1.00 . A A . 29 LYS O 1 1 19 13909 1 1 30 ALA C C -7.957 3.404 4.217 1.00 . A A . 30 ALA C 1 1 19 13910 1 1 30 ALA CA C -7.916 2.657 2.885 1.00 . A A . 30 ALA CA 1 1 19 13911 1 1 30 ALA CB C -6.489 2.228 2.557 1.00 . A A . 30 ALA CB 1 1 19 13912 1 1 30 ALA H H -7.672 4.079 1.329 1.00 . A A . 30 ALA H 1 1 19 13913 1 1 30 ALA HA H -8.557 1.784 2.930 1.00 . A A . 30 ALA HA 1 1 19 13914 1 1 30 ALA HB1 H -6.456 1.807 1.553 1.00 . A A . 30 ALA HB1 1 1 19 13915 1 1 30 ALA HB2 H -5.832 3.097 2.613 1.00 . A A . 30 ALA HB2 1 1 19 13916 1 1 30 ALA HB3 H -6.148 1.483 3.268 1.00 . A A . 30 ALA HB3 1 1 19 13917 1 1 30 ALA N N -8.370 3.523 1.818 1.00 . A A . 30 ALA N 1 1 19 13918 1 1 30 ALA O O -7.948 4.633 4.231 1.00 . A A . 30 ALA O 1 1 19 13919 1 1 31 SER C C -6.222 3.944 6.508 1.00 . A A . 31 SER C 1 1 19 13920 1 1 31 SER CA C -7.585 3.253 6.621 1.00 . A A . 31 SER CA 1 1 19 13921 1 1 31 SER CB C -7.531 2.134 7.658 1.00 . A A . 31 SER CB 1 1 19 13922 1 1 31 SER H H -7.876 1.669 5.317 1.00 . A A . 31 SER H 1 1 19 13923 1 1 31 SER HA H -8.344 3.971 6.923 1.00 . A A . 31 SER HA 1 1 19 13924 1 1 31 SER HB2 H -6.777 1.415 7.359 1.00 . A A . 31 SER HB2 1 1 19 13925 1 1 31 SER HB3 H -7.222 2.579 8.589 1.00 . A A . 31 SER HB3 1 1 19 13926 1 1 31 SER HG H -9.151 1.248 6.990 1.00 . A A . 31 SER HG 1 1 19 13927 1 1 31 SER N N -7.922 2.678 5.341 1.00 . A A . 31 SER N 1 1 19 13928 1 1 31 SER O O -6.062 5.088 6.931 1.00 . A A . 31 SER O 1 1 19 13929 1 1 31 SER OG O -8.776 1.481 7.852 1.00 . A A . 31 SER OG 1 1 19 13930 1 1 32 HIS C C -3.200 2.949 4.617 1.00 . A A . 32 HIS C 1 1 19 13931 1 1 32 HIS CA C -3.913 3.797 5.668 1.00 . A A . 32 HIS CA 1 1 19 13932 1 1 32 HIS CB C -3.087 3.874 6.967 1.00 . A A . 32 HIS CB 1 1 19 13933 1 1 32 HIS CD2 C -2.962 1.428 7.694 1.00 . A A . 32 HIS CD2 1 1 19 13934 1 1 32 HIS CE1 C -0.816 1.140 7.730 1.00 . A A . 32 HIS CE1 1 1 19 13935 1 1 32 HIS CG C -2.385 2.602 7.342 1.00 . A A . 32 HIS CG 1 1 19 13936 1 1 32 HIS H H -5.434 2.341 5.522 1.00 . A A . 32 HIS H 1 1 19 13937 1 1 32 HIS HA H -4.040 4.801 5.265 1.00 . A A . 32 HIS HA 1 1 19 13938 1 1 32 HIS HB2 H -2.307 4.601 6.871 1.00 . A A . 32 HIS HB2 1 1 19 13939 1 1 32 HIS HB3 H -3.718 4.200 7.795 1.00 . A A . 32 HIS HB3 1 1 19 13940 1 1 32 HIS HD1 H -0.303 3.041 6.956 1.00 . A A . 32 HIS HD1 1 1 19 13941 1 1 32 HIS HD2 H -4.015 1.291 7.619 1.00 . A A . 32 HIS HD2 1 1 19 13942 1 1 32 HIS HE1 H 0.139 0.648 7.801 1.00 . A A . 32 HIS HE1 1 1 19 13943 1 1 32 HIS N N -5.235 3.246 5.931 1.00 . A A . 32 HIS N 1 1 19 13944 1 1 32 HIS ND1 N -1.012 2.409 7.330 1.00 . A A . 32 HIS ND1 1 1 19 13945 1 1 32 HIS NE2 N -1.975 0.526 8.015 1.00 . A A . 32 HIS NE2 1 1 19 13946 1 1 32 HIS O O -3.729 1.916 4.189 1.00 . A A . 32 HIS O 1 1 19 13947 1 1 33 GLY C C 0.300 2.408 4.301 1.00 . A A . 33 GLY C 1 1 19 13948 1 1 33 GLY CA C -1.016 2.540 3.543 1.00 . A A . 33 GLY CA 1 1 19 13949 1 1 33 GLY H H -1.642 4.233 4.658 1.00 . A A . 33 GLY H 1 1 19 13950 1 1 33 GLY HA2 H -1.426 1.565 3.397 1.00 . A A . 33 GLY HA2 1 1 19 13951 1 1 33 GLY HA3 H -0.828 2.934 2.555 1.00 . A A . 33 GLY HA3 1 1 19 13952 1 1 33 GLY N N -1.975 3.351 4.277 1.00 . A A . 33 GLY N 1 1 19 13953 1 1 33 GLY O O 0.529 3.137 5.270 1.00 . A A . 33 GLY O 1 1 19 13954 1 1 34 ALA C C 3.257 0.328 3.437 1.00 . A A . 34 ALA C 1 1 19 13955 1 1 34 ALA CA C 2.495 1.266 4.383 1.00 . A A . 34 ALA CA 1 1 19 13956 1 1 34 ALA CB C 2.446 0.700 5.807 1.00 . A A . 34 ALA CB 1 1 19 13957 1 1 34 ALA H H 0.844 0.855 3.119 1.00 . A A . 34 ALA H 1 1 19 13958 1 1 34 ALA HA H 2.990 2.236 4.405 1.00 . A A . 34 ALA HA 1 1 19 13959 1 1 34 ALA HB1 H 1.836 -0.202 5.828 1.00 . A A . 34 ALA HB1 1 1 19 13960 1 1 34 ALA HB2 H 3.454 0.464 6.147 1.00 . A A . 34 ALA HB2 1 1 19 13961 1 1 34 ALA HB3 H 2.015 1.435 6.486 1.00 . A A . 34 ALA HB3 1 1 19 13962 1 1 34 ALA N N 1.143 1.462 3.881 1.00 . A A . 34 ALA N 1 1 19 13963 1 1 34 ALA O O 2.667 -0.627 2.930 1.00 . A A . 34 ALA O 1 1 19 13964 1 1 35 CYS C C 5.887 -1.478 3.019 1.00 . A A . 35 CYS C 1 1 19 13965 1 1 35 CYS CA C 5.353 -0.245 2.290 1.00 . A A . 35 CYS CA 1 1 19 13966 1 1 35 CYS CB C 6.537 0.554 1.759 1.00 . A A . 35 CYS CB 1 1 19 13967 1 1 35 CYS H H 5.013 1.382 3.586 1.00 . A A . 35 CYS H 1 1 19 13968 1 1 35 CYS HA H 4.751 -0.533 1.433 1.00 . A A . 35 CYS HA 1 1 19 13969 1 1 35 CYS HB2 H 7.075 1.028 2.576 1.00 . A A . 35 CYS HB2 1 1 19 13970 1 1 35 CYS HB3 H 7.216 -0.158 1.310 1.00 . A A . 35 CYS HB3 1 1 19 13971 1 1 35 CYS N N 4.545 0.581 3.176 1.00 . A A . 35 CYS N 1 1 19 13972 1 1 35 CYS O O 6.224 -1.389 4.202 1.00 . A A . 35 CYS O 1 1 19 13973 1 1 35 CYS SG S 6.134 1.752 0.472 1.00 . A A . 35 CYS SG 1 1 19 13974 1 1 36 HIS C C 7.332 -4.582 1.684 1.00 . A A . 36 HIS C 1 1 19 13975 1 1 36 HIS CA C 6.734 -3.788 2.833 1.00 . A A . 36 HIS CA 1 1 19 13976 1 1 36 HIS CB C 5.858 -4.772 3.610 1.00 . A A . 36 HIS CB 1 1 19 13977 1 1 36 HIS CD2 C 3.345 -4.457 3.944 1.00 . A A . 36 HIS CD2 1 1 19 13978 1 1 36 HIS CE1 C 3.408 -2.996 5.569 1.00 . A A . 36 HIS CE1 1 1 19 13979 1 1 36 HIS CG C 4.644 -4.186 4.246 1.00 . A A . 36 HIS CG 1 1 19 13980 1 1 36 HIS H H 5.725 -2.641 1.353 1.00 . A A . 36 HIS H 1 1 19 13981 1 1 36 HIS HA H 7.521 -3.452 3.500 1.00 . A A . 36 HIS HA 1 1 19 13982 1 1 36 HIS HB2 H 5.502 -5.543 2.924 1.00 . A A . 36 HIS HB2 1 1 19 13983 1 1 36 HIS HB3 H 6.464 -5.263 4.373 1.00 . A A . 36 HIS HB3 1 1 19 13984 1 1 36 HIS HD1 H 5.502 -2.692 5.518 1.00 . A A . 36 HIS HD1 1 1 19 13985 1 1 36 HIS HD2 H 3.052 -5.124 3.138 1.00 . A A . 36 HIS HD2 1 1 19 13986 1 1 36 HIS HE1 H 3.101 -2.286 6.324 1.00 . A A . 36 HIS HE1 1 1 19 13987 1 1 36 HIS N N 6.003 -2.622 2.332 1.00 . A A . 36 HIS N 1 1 19 13988 1 1 36 HIS ND1 N 4.683 -3.229 5.240 1.00 . A A . 36 HIS ND1 1 1 19 13989 1 1 36 HIS NE2 N 2.569 -3.755 4.843 1.00 . A A . 36 HIS NE2 1 1 19 13990 1 1 36 HIS O O 6.841 -4.515 0.559 1.00 . A A . 36 HIS O 1 1 19 13991 1 1 37 LYS C C 7.895 -7.662 1.126 1.00 . A A . 37 LYS C 1 1 19 13992 1 1 37 LYS CA C 8.819 -6.440 1.112 1.00 . A A . 37 LYS CA 1 1 19 13993 1 1 37 LYS CB C 10.264 -6.749 1.513 1.00 . A A . 37 LYS CB 1 1 19 13994 1 1 37 LYS CD C 12.318 -8.238 1.038 1.00 . A A . 37 LYS CD 1 1 19 13995 1 1 37 LYS CE C 13.603 -7.476 0.680 1.00 . A A . 37 LYS CE 1 1 19 13996 1 1 37 LYS CG C 11.044 -7.572 0.483 1.00 . A A . 37 LYS CG 1 1 19 13997 1 1 37 LYS H H 8.611 -5.470 2.975 1.00 . A A . 37 LYS H 1 1 19 13998 1 1 37 LYS HA H 8.865 -6.041 0.110 1.00 . A A . 37 LYS HA 1 1 19 13999 1 1 37 LYS HB2 H 10.767 -5.808 1.593 1.00 . A A . 37 LYS HB2 1 1 19 14000 1 1 37 LYS HB3 H 10.271 -7.192 2.498 1.00 . A A . 37 LYS HB3 1 1 19 14001 1 1 37 LYS HD2 H 12.241 -8.350 2.123 1.00 . A A . 37 LYS HD2 1 1 19 14002 1 1 37 LYS HD3 H 12.375 -9.245 0.622 1.00 . A A . 37 LYS HD3 1 1 19 14003 1 1 37 LYS HE2 H 13.499 -6.996 -0.296 1.00 . A A . 37 LYS HE2 1 1 19 14004 1 1 37 LYS HE3 H 13.772 -6.713 1.440 1.00 . A A . 37 LYS HE3 1 1 19 14005 1 1 37 LYS HG2 H 10.393 -8.363 0.154 1.00 . A A . 37 LYS HG2 1 1 19 14006 1 1 37 LYS HG3 H 11.256 -6.954 -0.393 1.00 . A A . 37 LYS HG3 1 1 19 14007 1 1 37 LYS HZ1 H 14.470 -9.346 0.522 1.00 . A A . 37 LYS HZ1 1 1 19 14008 1 1 37 LYS HZ2 H 15.338 -8.122 -0.238 1.00 . A A . 37 LYS HZ2 1 1 19 14009 1 1 37 LYS N N 8.287 -5.446 2.021 1.00 . A A . 37 LYS N 1 1 19 14010 1 1 37 LYS NZ N 14.783 -8.366 0.594 1.00 . A A . 37 LYS NZ 1 1 19 14011 1 1 37 LYS O O 7.365 -8.063 2.166 1.00 . A A . 37 LYS O 1 1 19 14012 1 1 38 ARG C C 7.413 -10.093 -1.519 1.00 . A A . 38 ARG C 1 1 19 14013 1 1 38 ARG CA C 6.879 -9.427 -0.252 1.00 . A A . 38 ARG CA 1 1 19 14014 1 1 38 ARG CB C 5.409 -9.026 -0.387 1.00 . A A . 38 ARG CB 1 1 19 14015 1 1 38 ARG CD C 4.288 -10.557 1.306 1.00 . A A . 38 ARG CD 1 1 19 14016 1 1 38 ARG CG C 4.518 -10.243 -0.179 1.00 . A A . 38 ARG CG 1 1 19 14017 1 1 38 ARG CZ C 3.551 -8.712 2.869 1.00 . A A . 38 ARG CZ 1 1 19 14018 1 1 38 ARG H H 7.951 -7.759 -0.905 1.00 . A A . 38 ARG H 1 1 19 14019 1 1 38 ARG HA H 7.028 -10.090 0.602 1.00 . A A . 38 ARG HA 1 1 19 14020 1 1 38 ARG HB2 H 5.148 -8.257 0.339 1.00 . A A . 38 ARG HB2 1 1 19 14021 1 1 38 ARG HB3 H 5.244 -8.621 -1.388 1.00 . A A . 38 ARG HB3 1 1 19 14022 1 1 38 ARG HD2 H 3.854 -11.557 1.362 1.00 . A A . 38 ARG HD2 1 1 19 14023 1 1 38 ARG HD3 H 5.226 -10.594 1.859 1.00 . A A . 38 ARG HD3 1 1 19 14024 1 1 38 ARG HG2 H 3.569 -10.052 -0.675 1.00 . A A . 38 ARG HG2 1 1 19 14025 1 1 38 ARG HG3 H 4.994 -11.096 -0.661 1.00 . A A . 38 ARG HG3 1 1 19 14026 1 1 38 ARG HH11 H 5.615 -8.638 2.671 1.00 . A A . 38 ARG HH11 1 1 19 14027 1 1 38 ARG HH12 H 4.964 -7.769 4.012 1.00 . A A . 38 ARG HH12 1 1 19 14028 1 1 38 ARG HH21 H 1.551 -8.369 3.208 1.00 . A A . 38 ARG HH21 1 1 19 14029 1 1 38 ARG HH22 H 2.576 -7.433 4.197 1.00 . A A . 38 ARG HH22 1 1 19 14030 1 1 38 ARG N N 7.655 -8.227 -0.056 1.00 . A A . 38 ARG N 1 1 19 14031 1 1 38 ARG NE N 3.315 -9.635 1.921 1.00 . A A . 38 ARG NE 1 1 19 14032 1 1 38 ARG NH1 N 4.797 -8.352 3.209 1.00 . A A . 38 ARG NH1 1 1 19 14033 1 1 38 ARG NH2 N 2.503 -8.143 3.477 1.00 . A A . 38 ARG NH2 1 1 19 14034 1 1 38 ARG O O 7.594 -9.410 -2.524 1.00 . A A . 38 ARG O 1 1 19 14035 1 1 39 GLU C C 9.596 -11.347 -3.107 1.00 . A A . 39 GLU C 1 1 19 14036 1 1 39 GLU CA C 8.403 -12.128 -2.536 1.00 . A A . 39 GLU CA 1 1 19 14037 1 1 39 GLU CB C 7.386 -12.544 -3.611 1.00 . A A . 39 GLU CB 1 1 19 14038 1 1 39 GLU CD C 6.251 -14.059 -1.889 1.00 . A A . 39 GLU CD 1 1 19 14039 1 1 39 GLU CG C 6.059 -13.072 -3.037 1.00 . A A . 39 GLU CG 1 1 19 14040 1 1 39 GLU H H 7.440 -11.938 -0.664 1.00 . A A . 39 GLU H 1 1 19 14041 1 1 39 GLU HA H 8.813 -13.038 -2.096 1.00 . A A . 39 GLU HA 1 1 19 14042 1 1 39 GLU HB2 H 7.160 -11.685 -4.243 1.00 . A A . 39 GLU HB2 1 1 19 14043 1 1 39 GLU HB3 H 7.844 -13.317 -4.229 1.00 . A A . 39 GLU HB3 1 1 19 14044 1 1 39 GLU HG2 H 5.465 -12.234 -2.681 1.00 . A A . 39 GLU HG2 1 1 19 14045 1 1 39 GLU HG3 H 5.498 -13.560 -3.834 1.00 . A A . 39 GLU HG3 1 1 19 14046 1 1 39 GLU N N 7.735 -11.389 -1.464 1.00 . A A . 39 GLU N 1 1 19 14047 1 1 39 GLU O O 9.811 -11.293 -4.313 1.00 . A A . 39 GLU O 1 1 19 14048 1 1 39 GLU OE1 O 6.318 -13.629 -0.735 1.00 . A A . 39 GLU OE1 1 1 19 14049 1 1 39 GLU OE2 O 6.354 -15.371 -2.229 1.00 . A A . 39 GLU OE2 1 1 19 14050 1 1 40 ASN C C 11.229 -8.643 -3.305 1.00 . A A . 40 ASN C 1 1 19 14051 1 1 40 ASN CA C 11.526 -9.896 -2.475 1.00 . A A . 40 ASN CA 1 1 19 14052 1 1 40 ASN CB C 12.626 -10.736 -3.113 1.00 . A A . 40 ASN CB 1 1 19 14053 1 1 40 ASN CG C 14.007 -10.107 -2.930 1.00 . A A . 40 ASN CG 1 1 19 14054 1 1 40 ASN H H 10.167 -10.923 -1.247 1.00 . A A . 40 ASN H 1 1 19 14055 1 1 40 ASN HA H 11.872 -9.553 -1.506 1.00 . A A . 40 ASN HA 1 1 19 14056 1 1 40 ASN HB2 H 12.620 -11.728 -2.671 1.00 . A A . 40 ASN HB2 1 1 19 14057 1 1 40 ASN HB3 H 12.357 -10.838 -4.158 1.00 . A A . 40 ASN HB3 1 1 19 14058 1 1 40 ASN HD21 H 14.578 -10.606 -4.818 1.00 . A A . 40 ASN HD21 1 1 19 14059 1 1 40 ASN HD22 H 15.771 -9.761 -3.858 1.00 . A A . 40 ASN HD22 1 1 19 14060 1 1 40 ASN N N 10.365 -10.729 -2.209 1.00 . A A . 40 ASN N 1 1 19 14061 1 1 40 ASN ND2 N 14.854 -10.166 -3.953 1.00 . A A . 40 ASN ND2 1 1 19 14062 1 1 40 ASN O O 12.142 -8.058 -3.880 1.00 . A A . 40 ASN O 1 1 19 14063 1 1 40 ASN OD1 O 14.324 -9.581 -1.859 1.00 . A A . 40 ASN OD1 1 1 19 14064 1 1 41 HIS C C 8.941 -6.071 -2.969 1.00 . A A . 41 HIS C 1 1 19 14065 1 1 41 HIS CA C 9.542 -6.996 -4.020 1.00 . A A . 41 HIS CA 1 1 19 14066 1 1 41 HIS CB C 8.534 -7.357 -5.105 1.00 . A A . 41 HIS CB 1 1 19 14067 1 1 41 HIS CD2 C 9.009 -9.517 -6.470 1.00 . A A . 41 HIS CD2 1 1 19 14068 1 1 41 HIS CE1 C 10.569 -8.741 -7.783 1.00 . A A . 41 HIS CE1 1 1 19 14069 1 1 41 HIS CG C 9.179 -8.187 -6.190 1.00 . A A . 41 HIS CG 1 1 19 14070 1 1 41 HIS H H 9.236 -8.743 -2.902 1.00 . A A . 41 HIS H 1 1 19 14071 1 1 41 HIS HA H 10.386 -6.517 -4.502 1.00 . A A . 41 HIS HA 1 1 19 14072 1 1 41 HIS HB2 H 7.723 -7.921 -4.643 1.00 . A A . 41 HIS HB2 1 1 19 14073 1 1 41 HIS HB3 H 8.102 -6.445 -5.517 1.00 . A A . 41 HIS HB3 1 1 19 14074 1 1 41 HIS HD1 H 10.501 -6.747 -7.095 1.00 . A A . 41 HIS HD1 1 1 19 14075 1 1 41 HIS HD2 H 8.381 -10.197 -5.914 1.00 . A A . 41 HIS HD2 1 1 19 14076 1 1 41 HIS HE1 H 11.354 -8.692 -8.524 1.00 . A A . 41 HIS HE1 1 1 19 14077 1 1 41 HIS N N 9.970 -8.211 -3.353 1.00 . A A . 41 HIS N 1 1 19 14078 1 1 41 HIS ND1 N 10.143 -7.692 -7.056 1.00 . A A . 41 HIS ND1 1 1 19 14079 1 1 41 HIS NE2 N 9.903 -9.864 -7.462 1.00 . A A . 41 HIS NE2 1 1 19 14080 1 1 41 HIS O O 8.019 -6.468 -2.258 1.00 . A A . 41 HIS O 1 1 19 14081 1 1 42 TRP C C 7.670 -3.277 -2.551 1.00 . A A . 42 TRP C 1 1 19 14082 1 1 42 TRP CA C 8.928 -3.863 -1.940 1.00 . A A . 42 TRP CA 1 1 19 14083 1 1 42 TRP CB C 9.979 -2.813 -1.607 1.00 . A A . 42 TRP CB 1 1 19 14084 1 1 42 TRP CD1 C 12.038 -4.020 -0.784 1.00 . A A . 42 TRP CD1 1 1 19 14085 1 1 42 TRP CD2 C 10.875 -3.064 0.875 1.00 . A A . 42 TRP CD2 1 1 19 14086 1 1 42 TRP CE2 C 11.990 -3.714 1.470 1.00 . A A . 42 TRP CE2 1 1 19 14087 1 1 42 TRP CE3 C 9.928 -2.492 1.747 1.00 . A A . 42 TRP CE3 1 1 19 14088 1 1 42 TRP CG C 10.941 -3.268 -0.566 1.00 . A A . 42 TRP CG 1 1 19 14089 1 1 42 TRP CH2 C 11.226 -3.161 3.698 1.00 . A A . 42 TRP CH2 1 1 19 14090 1 1 42 TRP CZ2 C 12.147 -3.810 2.857 1.00 . A A . 42 TRP CZ2 1 1 19 14091 1 1 42 TRP CZ3 C 10.132 -2.478 3.138 1.00 . A A . 42 TRP CZ3 1 1 19 14092 1 1 42 TRP H H 10.170 -4.538 -3.507 1.00 . A A . 42 TRP H 1 1 19 14093 1 1 42 TRP HA H 8.652 -4.317 -1.000 1.00 . A A . 42 TRP HA 1 1 19 14094 1 1 42 TRP HB2 H 10.511 -2.508 -2.507 1.00 . A A . 42 TRP HB2 1 1 19 14095 1 1 42 TRP HB3 H 9.485 -1.940 -1.198 1.00 . A A . 42 TRP HB3 1 1 19 14096 1 1 42 TRP HD1 H 12.322 -4.404 -1.749 1.00 . A A . 42 TRP HD1 1 1 19 14097 1 1 42 TRP HE1 H 13.503 -4.828 0.540 1.00 . A A . 42 TRP HE1 1 1 19 14098 1 1 42 TRP HE3 H 9.012 -2.104 1.340 1.00 . A A . 42 TRP HE3 1 1 19 14099 1 1 42 TRP HH2 H 11.348 -3.210 4.770 1.00 . A A . 42 TRP HH2 1 1 19 14100 1 1 42 TRP HZ2 H 12.917 -4.453 3.253 1.00 . A A . 42 TRP HZ2 1 1 19 14101 1 1 42 TRP HZ3 H 9.420 -1.960 3.767 1.00 . A A . 42 TRP HZ3 1 1 19 14102 1 1 42 TRP N N 9.478 -4.858 -2.841 1.00 . A A . 42 TRP N 1 1 19 14103 1 1 42 TRP NE1 N 12.675 -4.272 0.412 1.00 . A A . 42 TRP NE1 1 1 19 14104 1 1 42 TRP O O 7.765 -2.548 -3.528 1.00 . A A . 42 TRP O 1 1 19 14105 1 1 43 LYS C C 4.790 -2.021 -1.453 1.00 . A A . 43 LYS C 1 1 19 14106 1 1 43 LYS CA C 5.236 -3.041 -2.483 1.00 . A A . 43 LYS CA 1 1 19 14107 1 1 43 LYS CB C 4.152 -4.115 -2.638 1.00 . A A . 43 LYS CB 1 1 19 14108 1 1 43 LYS CD C 5.539 -5.535 -4.269 1.00 . A A . 43 LYS CD 1 1 19 14109 1 1 43 LYS CE C 4.694 -5.479 -5.560 1.00 . A A . 43 LYS CE 1 1 19 14110 1 1 43 LYS CG C 4.755 -5.484 -2.946 1.00 . A A . 43 LYS CG 1 1 19 14111 1 1 43 LYS H H 6.449 -4.231 -1.229 1.00 . A A . 43 LYS H 1 1 19 14112 1 1 43 LYS HA H 5.364 -2.577 -3.457 1.00 . A A . 43 LYS HA 1 1 19 14113 1 1 43 LYS HB2 H 3.604 -4.204 -1.705 1.00 . A A . 43 LYS HB2 1 1 19 14114 1 1 43 LYS HB3 H 3.429 -3.815 -3.390 1.00 . A A . 43 LYS HB3 1 1 19 14115 1 1 43 LYS HD2 H 6.325 -4.783 -4.314 1.00 . A A . 43 LYS HD2 1 1 19 14116 1 1 43 LYS HD3 H 6.021 -6.511 -4.259 1.00 . A A . 43 LYS HD3 1 1 19 14117 1 1 43 LYS HE2 H 5.338 -5.802 -6.381 1.00 . A A . 43 LYS HE2 1 1 19 14118 1 1 43 LYS HE3 H 3.864 -6.185 -5.490 1.00 . A A . 43 LYS HE3 1 1 19 14119 1 1 43 LYS HG2 H 5.337 -5.751 -2.054 1.00 . A A . 43 LYS HG2 1 1 19 14120 1 1 43 LYS HG3 H 3.999 -6.247 -3.007 1.00 . A A . 43 LYS HG3 1 1 19 14121 1 1 43 LYS HZ1 H 4.533 -3.867 -6.849 1.00 . A A . 43 LYS HZ1 1 1 19 14122 1 1 43 LYS HZ2 H 3.140 -4.169 -5.955 1.00 . A A . 43 LYS HZ2 1 1 19 14123 1 1 43 LYS N N 6.492 -3.607 -2.029 1.00 . A A . 43 LYS N 1 1 19 14124 1 1 43 LYS NZ N 4.170 -4.138 -5.924 1.00 . A A . 43 LYS NZ 1 1 19 14125 1 1 43 LYS O O 4.954 -2.239 -0.255 1.00 . A A . 43 LYS O 1 1 19 14126 1 1 44 CYS C C 2.022 -1.254 -0.826 1.00 . A A . 44 CYS C 1 1 19 14127 1 1 44 CYS CA C 3.165 -0.278 -1.097 1.00 . A A . 44 CYS CA 1 1 19 14128 1 1 44 CYS CB C 2.697 0.959 -1.841 1.00 . A A . 44 CYS CB 1 1 19 14129 1 1 44 CYS H H 4.085 -0.831 -2.914 1.00 . A A . 44 CYS H 1 1 19 14130 1 1 44 CYS HA H 3.600 0.056 -0.164 1.00 . A A . 44 CYS HA 1 1 19 14131 1 1 44 CYS HB2 H 3.525 1.661 -1.773 1.00 . A A . 44 CYS HB2 1 1 19 14132 1 1 44 CYS HB3 H 2.490 0.712 -2.880 1.00 . A A . 44 CYS HB3 1 1 19 14133 1 1 44 CYS N N 4.153 -0.955 -1.916 1.00 . A A . 44 CYS N 1 1 19 14134 1 1 44 CYS O O 1.627 -1.970 -1.742 1.00 . A A . 44 CYS O 1 1 19 14135 1 1 44 CYS SG S 1.220 1.733 -1.164 1.00 . A A . 44 CYS SG 1 1 19 14136 1 1 45 PHE C C -0.662 -1.097 1.370 1.00 . A A . 45 PHE C 1 1 19 14137 1 1 45 PHE CA C 0.341 -2.077 0.771 1.00 . A A . 45 PHE CA 1 1 19 14138 1 1 45 PHE CB C 0.693 -3.154 1.799 1.00 . A A . 45 PHE CB 1 1 19 14139 1 1 45 PHE CD1 C 2.581 -4.506 0.787 1.00 . A A . 45 PHE CD1 1 1 19 14140 1 1 45 PHE CD2 C 0.428 -5.582 1.131 1.00 . A A . 45 PHE CD2 1 1 19 14141 1 1 45 PHE CE1 C 3.125 -5.731 0.366 1.00 . A A . 45 PHE CE1 1 1 19 14142 1 1 45 PHE CE2 C 0.950 -6.788 0.634 1.00 . A A . 45 PHE CE2 1 1 19 14143 1 1 45 PHE CG C 1.245 -4.440 1.218 1.00 . A A . 45 PHE CG 1 1 19 14144 1 1 45 PHE CZ C 2.299 -6.862 0.248 1.00 . A A . 45 PHE CZ 1 1 19 14145 1 1 45 PHE H H 1.931 -0.780 1.169 1.00 . A A . 45 PHE H 1 1 19 14146 1 1 45 PHE HA H -0.108 -2.543 -0.105 1.00 . A A . 45 PHE HA 1 1 19 14147 1 1 45 PHE HB2 H 1.401 -2.736 2.509 1.00 . A A . 45 PHE HB2 1 1 19 14148 1 1 45 PHE HB3 H -0.205 -3.387 2.359 1.00 . A A . 45 PHE HB3 1 1 19 14149 1 1 45 PHE HD1 H 3.203 -3.624 0.831 1.00 . A A . 45 PHE HD1 1 1 19 14150 1 1 45 PHE HD2 H -0.616 -5.526 1.399 1.00 . A A . 45 PHE HD2 1 1 19 14151 1 1 45 PHE HE1 H 4.171 -5.787 0.099 1.00 . A A . 45 PHE HE1 1 1 19 14152 1 1 45 PHE HE2 H 0.301 -7.645 0.516 1.00 . A A . 45 PHE HE2 1 1 19 14153 1 1 45 PHE HZ H 2.690 -7.774 -0.172 1.00 . A A . 45 PHE HZ 1 1 19 14154 1 1 45 PHE N N 1.534 -1.330 0.414 1.00 . A A . 45 PHE N 1 1 19 14155 1 1 45 PHE O O -0.263 -0.145 2.042 1.00 . A A . 45 PHE O 1 1 19 14156 1 1 46 CYS C C -3.900 -1.451 2.555 1.00 . A A . 46 CYS C 1 1 19 14157 1 1 46 CYS CA C -3.075 -0.576 1.626 1.00 . A A . 46 CYS CA 1 1 19 14158 1 1 46 CYS CB C -3.948 -0.160 0.441 1.00 . A A . 46 CYS CB 1 1 19 14159 1 1 46 CYS H H -2.189 -2.198 0.635 1.00 . A A . 46 CYS H 1 1 19 14160 1 1 46 CYS HA H -2.766 0.295 2.212 1.00 . A A . 46 CYS HA 1 1 19 14161 1 1 46 CYS HB2 H -4.313 -1.068 -0.023 1.00 . A A . 46 CYS HB2 1 1 19 14162 1 1 46 CYS HB3 H -4.796 0.386 0.833 1.00 . A A . 46 CYS HB3 1 1 19 14163 1 1 46 CYS N N -1.948 -1.356 1.146 1.00 . A A . 46 CYS N 1 1 19 14164 1 1 46 CYS O O -3.903 -2.674 2.426 1.00 . A A . 46 CYS O 1 1 19 14165 1 1 46 CYS SG S -3.221 0.843 -0.879 1.00 . A A . 46 CYS SG 1 1 19 14166 1 1 47 TYR C C -6.641 -0.942 4.734 1.00 . A A . 47 TYR C 1 1 19 14167 1 1 47 TYR CA C -5.203 -1.450 4.646 1.00 . A A . 47 TYR CA 1 1 19 14168 1 1 47 TYR CB C -4.424 -0.986 5.885 1.00 . A A . 47 TYR CB 1 1 19 14169 1 1 47 TYR CD1 C -1.962 -1.186 5.231 1.00 . A A . 47 TYR CD1 1 1 19 14170 1 1 47 TYR CD2 C -2.810 -2.444 7.133 1.00 . A A . 47 TYR CD2 1 1 19 14171 1 1 47 TYR CE1 C -0.688 -1.741 5.436 1.00 . A A . 47 TYR CE1 1 1 19 14172 1 1 47 TYR CE2 C -1.530 -2.954 7.372 1.00 . A A . 47 TYR CE2 1 1 19 14173 1 1 47 TYR CG C -3.034 -1.559 6.064 1.00 . A A . 47 TYR CG 1 1 19 14174 1 1 47 TYR CZ C -0.480 -2.632 6.503 1.00 . A A . 47 TYR CZ 1 1 19 14175 1 1 47 TYR H H -4.476 0.206 3.539 1.00 . A A . 47 TYR H 1 1 19 14176 1 1 47 TYR HA H -5.187 -2.539 4.582 1.00 . A A . 47 TYR HA 1 1 19 14177 1 1 47 TYR HB2 H -4.331 0.094 5.819 1.00 . A A . 47 TYR HB2 1 1 19 14178 1 1 47 TYR HB3 H -4.996 -1.201 6.786 1.00 . A A . 47 TYR HB3 1 1 19 14179 1 1 47 TYR HD1 H -2.098 -0.456 4.450 1.00 . A A . 47 TYR HD1 1 1 19 14180 1 1 47 TYR HD2 H -3.604 -2.688 7.817 1.00 . A A . 47 TYR HD2 1 1 19 14181 1 1 47 TYR HE1 H 0.121 -1.484 4.768 1.00 . A A . 47 TYR HE1 1 1 19 14182 1 1 47 TYR HE2 H -1.373 -3.624 8.205 1.00 . A A . 47 TYR HE2 1 1 19 14183 1 1 47 TYR HH H 0.747 -3.772 7.474 1.00 . A A . 47 TYR HH 1 1 19 14184 1 1 47 TYR N N -4.561 -0.807 3.514 1.00 . A A . 47 TYR N 1 1 19 14185 1 1 47 TYR O O -6.851 0.163 5.230 1.00 . A A . 47 TYR O 1 1 19 14186 1 1 47 TYR OH O 0.736 -3.204 6.695 1.00 . A A . 47 TYR OH 1 1 19 14187 1 1 48 PHE C C -9.811 -1.139 5.349 1.00 . A A . 48 PHE C 1 1 19 14188 1 1 48 PHE CA C -8.963 -1.182 4.087 1.00 . A A . 48 PHE CA 1 1 19 14189 1 1 48 PHE CB C -9.606 -1.897 2.905 1.00 . A A . 48 PHE CB 1 1 19 14190 1 1 48 PHE CD1 C -9.313 -0.258 1.017 1.00 . A A . 48 PHE CD1 1 1 19 14191 1 1 48 PHE CD2 C -7.859 -2.209 1.088 1.00 . A A . 48 PHE CD2 1 1 19 14192 1 1 48 PHE CE1 C -8.509 0.306 0.016 1.00 . A A . 48 PHE CE1 1 1 19 14193 1 1 48 PHE CE2 C -7.074 -1.652 0.070 1.00 . A A . 48 PHE CE2 1 1 19 14194 1 1 48 PHE CG C -8.935 -1.473 1.618 1.00 . A A . 48 PHE CG 1 1 19 14195 1 1 48 PHE CZ C -7.377 -0.382 -0.448 1.00 . A A . 48 PHE CZ 1 1 19 14196 1 1 48 PHE H H -7.453 -2.591 3.829 1.00 . A A . 48 PHE H 1 1 19 14197 1 1 48 PHE HA H -8.865 -0.144 3.786 1.00 . A A . 48 PHE HA 1 1 19 14198 1 1 48 PHE HB2 H -9.591 -2.974 3.027 1.00 . A A . 48 PHE HB2 1 1 19 14199 1 1 48 PHE HB3 H -10.640 -1.603 2.880 1.00 . A A . 48 PHE HB3 1 1 19 14200 1 1 48 PHE HD1 H -10.161 0.300 1.393 1.00 . A A . 48 PHE HD1 1 1 19 14201 1 1 48 PHE HD2 H -7.576 -3.163 1.511 1.00 . A A . 48 PHE HD2 1 1 19 14202 1 1 48 PHE HE1 H -8.744 1.289 -0.351 1.00 . A A . 48 PHE HE1 1 1 19 14203 1 1 48 PHE HE2 H -6.213 -2.187 -0.298 1.00 . A A . 48 PHE HE2 1 1 19 14204 1 1 48 PHE HZ H -6.736 0.063 -1.196 1.00 . A A . 48 PHE HZ 1 1 19 14205 1 1 48 PHE N N -7.637 -1.721 4.303 1.00 . A A . 48 PHE N 1 1 19 14206 1 1 48 PHE O O -9.869 -0.095 5.992 1.00 . A A . 48 PHE O 1 1 19 14207 1 1 49 ASN C C -10.722 -2.368 8.172 1.00 . A A . 49 ASN C 1 1 19 14208 1 1 49 ASN CA C -11.441 -2.209 6.830 1.00 . A A . 49 ASN CA 1 1 19 14209 1 1 49 ASN CB C -12.522 -3.281 6.611 1.00 . A A . 49 ASN CB 1 1 19 14210 1 1 49 ASN CG C -13.262 -3.093 5.288 1.00 . A A . 49 ASN CG 1 1 19 14211 1 1 49 ASN H H -10.300 -3.119 5.274 1.00 . A A . 49 ASN H 1 1 19 14212 1 1 49 ASN HA H -11.951 -1.244 6.839 1.00 . A A . 49 ASN HA 1 1 19 14213 1 1 49 ASN HB2 H -12.077 -4.274 6.641 1.00 . A A . 49 ASN HB2 1 1 19 14214 1 1 49 ASN HB3 H -13.253 -3.209 7.418 1.00 . A A . 49 ASN HB3 1 1 19 14215 1 1 49 ASN HD21 H -11.985 -4.347 4.340 1.00 . A A . 49 ASN HD21 1 1 19 14216 1 1 49 ASN HD22 H -13.247 -3.662 3.335 1.00 . A A . 49 ASN HD22 1 1 19 14217 1 1 49 ASN N N -10.461 -2.237 5.742 1.00 . A A . 49 ASN N 1 1 19 14218 1 1 49 ASN ND2 N -12.795 -3.752 4.230 1.00 . A A . 49 ASN ND2 1 1 19 14219 1 1 49 ASN O O -11.135 -3.155 9.026 1.00 . A A . 49 ASN O 1 1 19 14220 1 1 49 ASN OD1 O -14.245 -2.365 5.216 1.00 . A A . 49 ASN OD1 1 1 19 14221 1 1 50 CYS C C -9.084 -0.888 10.605 1.00 . A A . 50 CYS C 1 1 19 14222 1 1 50 CYS CA C -8.678 -1.779 9.438 1.00 . A A . 50 CYS CA 1 1 19 14223 1 1 50 CYS CB C -7.264 -1.467 8.968 1.00 . A A . 50 CYS CB 1 1 19 14224 1 1 50 CYS H H -9.389 -1.001 7.577 1.00 . A A . 50 CYS H 1 1 19 14225 1 1 50 CYS HA H -8.663 -2.808 9.770 1.00 . A A . 50 CYS HA 1 1 19 14226 1 1 50 CYS HB2 H -7.060 -1.981 8.032 1.00 . A A . 50 CYS HB2 1 1 19 14227 1 1 50 CYS HB3 H -7.215 -0.406 8.787 1.00 . A A . 50 CYS HB3 1 1 19 14228 1 1 50 CYS N N -9.612 -1.643 8.328 1.00 . A A . 50 CYS N 1 1 19 14229 1 1 50 CYS O O -9.215 -1.406 11.758 1.00 . A A . 50 CYS O 1 1 19 14230 1 1 50 CYS OXT O -9.288 0.353 10.427 1.00 . A A . 50 CYS OXT 1 1 19 14231 1 1 50 CYS SG S -5.932 -1.869 10.125 1.00 . A A . 50 CYS SG 1 1 20 14232 1 1 1 LEU C C -9.749 -5.116 9.624 1.00 . A A . 1 LEU C 1 1 20 14233 1 1 1 LEU CA C -10.615 -5.538 10.815 1.00 . A A . 1 LEU CA 1 1 20 14234 1 1 1 LEU CB C -11.433 -6.791 10.479 1.00 . A A . 1 LEU CB 1 1 20 14235 1 1 1 LEU CD1 C -9.557 -8.431 11.028 1.00 . A A . 1 LEU CD1 1 1 20 14236 1 1 1 LEU CD2 C -11.531 -9.158 9.679 1.00 . A A . 1 LEU CD2 1 1 20 14237 1 1 1 LEU CG C -10.594 -7.985 9.990 1.00 . A A . 1 LEU CG 1 1 20 14238 1 1 1 LEU H1 H -10.924 -3.618 11.504 1.00 . A A . 1 LEU H1 1 1 20 14239 1 1 1 LEU H2 H -12.111 -4.168 10.447 1.00 . A A . 1 LEU H2 1 1 20 14240 1 1 1 LEU H3 H -12.071 -4.730 12.031 1.00 . A A . 1 LEU H3 1 1 20 14241 1 1 1 LEU HA H -9.977 -5.772 11.669 1.00 . A A . 1 LEU HA 1 1 20 14242 1 1 1 LEU HB2 H -11.983 -7.090 11.371 1.00 . A A . 1 LEU HB2 1 1 20 14243 1 1 1 LEU HB3 H -12.148 -6.531 9.696 1.00 . A A . 1 LEU HB3 1 1 20 14244 1 1 1 LEU HD11 H -10.042 -8.635 11.983 1.00 . A A . 1 LEU HD11 1 1 20 14245 1 1 1 LEU HD12 H -9.064 -9.340 10.683 1.00 . A A . 1 LEU HD12 1 1 20 14246 1 1 1 LEU HD13 H -8.793 -7.665 11.164 1.00 . A A . 1 LEU HD13 1 1 20 14247 1 1 1 LEU HD21 H -12.260 -8.861 8.924 1.00 . A A . 1 LEU HD21 1 1 20 14248 1 1 1 LEU HD22 H -10.955 -10.001 9.296 1.00 . A A . 1 LEU HD22 1 1 20 14249 1 1 1 LEU HD23 H -12.059 -9.468 10.583 1.00 . A A . 1 LEU HD23 1 1 20 14250 1 1 1 LEU HG H -10.075 -7.724 9.066 1.00 . A A . 1 LEU HG 1 1 20 14251 1 1 1 LEU N N -11.496 -4.430 11.230 1.00 . A A . 1 LEU N 1 1 20 14252 1 1 1 LEU O O -10.257 -4.947 8.521 1.00 . A A . 1 LEU O 1 1 20 14253 1 1 2 CYS C C -7.259 -5.147 7.716 1.00 . A A . 2 CYS C 1 1 20 14254 1 1 2 CYS CA C -7.528 -4.270 8.935 1.00 . A A . 2 CYS CA 1 1 20 14255 1 1 2 CYS CB C -6.277 -3.762 9.673 1.00 . A A . 2 CYS CB 1 1 20 14256 1 1 2 CYS H H -8.110 -5.074 10.791 1.00 . A A . 2 CYS H 1 1 20 14257 1 1 2 CYS HA H -8.005 -3.373 8.556 1.00 . A A . 2 CYS HA 1 1 20 14258 1 1 2 CYS HB2 H -5.601 -4.606 9.819 1.00 . A A . 2 CYS HB2 1 1 20 14259 1 1 2 CYS HB3 H -5.771 -3.018 9.067 1.00 . A A . 2 CYS HB3 1 1 20 14260 1 1 2 CYS N N -8.456 -4.899 9.864 1.00 . A A . 2 CYS N 1 1 20 14261 1 1 2 CYS O O -6.381 -6.008 7.722 1.00 . A A . 2 CYS O 1 1 20 14262 1 1 2 CYS SG S -6.591 -3.070 11.327 1.00 . A A . 2 CYS SG 1 1 20 14263 1 1 3 ASN C C -6.683 -5.095 4.688 1.00 . A A . 3 ASN C 1 1 20 14264 1 1 3 ASN CA C -7.932 -5.614 5.389 1.00 . A A . 3 ASN CA 1 1 20 14265 1 1 3 ASN CB C -9.193 -5.367 4.548 1.00 . A A . 3 ASN CB 1 1 20 14266 1 1 3 ASN CG C -9.032 -5.797 3.090 1.00 . A A . 3 ASN CG 1 1 20 14267 1 1 3 ASN H H -8.691 -4.139 6.723 1.00 . A A . 3 ASN H 1 1 20 14268 1 1 3 ASN HA H -7.834 -6.687 5.568 1.00 . A A . 3 ASN HA 1 1 20 14269 1 1 3 ASN HB2 H -10.034 -5.903 4.982 1.00 . A A . 3 ASN HB2 1 1 20 14270 1 1 3 ASN HB3 H -9.414 -4.305 4.563 1.00 . A A . 3 ASN HB3 1 1 20 14271 1 1 3 ASN HD21 H -8.658 -7.713 3.654 1.00 . A A . 3 ASN HD21 1 1 20 14272 1 1 3 ASN HD22 H -8.645 -7.404 1.931 1.00 . A A . 3 ASN HD22 1 1 20 14273 1 1 3 ASN N N -8.029 -4.907 6.653 1.00 . A A . 3 ASN N 1 1 20 14274 1 1 3 ASN ND2 N -8.745 -7.073 2.876 1.00 . A A . 3 ASN ND2 1 1 20 14275 1 1 3 ASN O O -6.755 -4.175 3.873 1.00 . A A . 3 ASN O 1 1 20 14276 1 1 3 ASN OD1 O -9.189 -5.005 2.159 1.00 . A A . 3 ASN OD1 1 1 20 14277 1 1 4 GLU C C -4.301 -6.099 3.041 1.00 . A A . 4 GLU C 1 1 20 14278 1 1 4 GLU CA C -4.271 -5.418 4.409 1.00 . A A . 4 GLU CA 1 1 20 14279 1 1 4 GLU CB C -3.166 -5.970 5.319 1.00 . A A . 4 GLU CB 1 1 20 14280 1 1 4 GLU CD C -0.652 -6.281 5.518 1.00 . A A . 4 GLU CD 1 1 20 14281 1 1 4 GLU CG C -1.817 -5.923 4.607 1.00 . A A . 4 GLU CG 1 1 20 14282 1 1 4 GLU H H -5.543 -6.383 5.766 1.00 . A A . 4 GLU H 1 1 20 14283 1 1 4 GLU HA H -4.123 -4.348 4.299 1.00 . A A . 4 GLU HA 1 1 20 14284 1 1 4 GLU HB2 H -3.126 -5.380 6.235 1.00 . A A . 4 GLU HB2 1 1 20 14285 1 1 4 GLU HB3 H -3.385 -7.007 5.579 1.00 . A A . 4 GLU HB3 1 1 20 14286 1 1 4 GLU HG2 H -1.870 -6.664 3.814 1.00 . A A . 4 GLU HG2 1 1 20 14287 1 1 4 GLU HG3 H -1.656 -4.930 4.185 1.00 . A A . 4 GLU HG3 1 1 20 14288 1 1 4 GLU N N -5.540 -5.682 5.036 1.00 . A A . 4 GLU N 1 1 20 14289 1 1 4 GLU O O -4.613 -7.285 2.947 1.00 . A A . 4 GLU O 1 1 20 14290 1 1 4 GLU OE1 O -0.768 -7.438 6.221 1.00 . A A . 4 GLU OE1 1 1 20 14291 1 1 4 GLU OE2 O 0.320 -5.528 5.574 1.00 . A A . 4 GLU OE2 1 1 20 14292 1 1 5 ARG C C -2.758 -5.134 -0.083 1.00 . A A . 5 ARG C 1 1 20 14293 1 1 5 ARG CA C -3.940 -5.820 0.616 1.00 . A A . 5 ARG CA 1 1 20 14294 1 1 5 ARG CB C -5.289 -5.548 -0.070 1.00 . A A . 5 ARG CB 1 1 20 14295 1 1 5 ARG CD C -6.889 -3.800 -0.921 1.00 . A A . 5 ARG CD 1 1 20 14296 1 1 5 ARG CG C -5.748 -4.093 0.060 1.00 . A A . 5 ARG CG 1 1 20 14297 1 1 5 ARG CZ C -9.351 -3.494 -0.684 1.00 . A A . 5 ARG CZ 1 1 20 14298 1 1 5 ARG H H -3.750 -4.368 2.130 1.00 . A A . 5 ARG H 1 1 20 14299 1 1 5 ARG HA H -3.766 -6.896 0.624 1.00 . A A . 5 ARG HA 1 1 20 14300 1 1 5 ARG HB2 H -5.193 -5.795 -1.127 1.00 . A A . 5 ARG HB2 1 1 20 14301 1 1 5 ARG HB3 H -6.056 -6.187 0.368 1.00 . A A . 5 ARG HB3 1 1 20 14302 1 1 5 ARG HD2 H -6.819 -2.747 -1.180 1.00 . A A . 5 ARG HD2 1 1 20 14303 1 1 5 ARG HD3 H -6.774 -4.377 -1.839 1.00 . A A . 5 ARG HD3 1 1 20 14304 1 1 5 ARG HG2 H -6.064 -3.886 1.087 1.00 . A A . 5 ARG HG2 1 1 20 14305 1 1 5 ARG HG3 H -4.917 -3.431 -0.180 1.00 . A A . 5 ARG HG3 1 1 20 14306 1 1 5 ARG HH11 H -8.604 -2.726 -2.422 1.00 . A A . 5 ARG HH11 1 1 20 14307 1 1 5 ARG HH12 H -10.265 -2.317 -2.098 1.00 . A A . 5 ARG HH12 1 1 20 14308 1 1 5 ARG HH21 H -10.296 -4.118 0.989 1.00 . A A . 5 ARG HH21 1 1 20 14309 1 1 5 ARG HH22 H -11.294 -3.160 -0.087 1.00 . A A . 5 ARG HH22 1 1 20 14310 1 1 5 ARG N N -3.988 -5.347 1.988 1.00 . A A . 5 ARG N 1 1 20 14311 1 1 5 ARG NE N -8.200 -4.073 -0.316 1.00 . A A . 5 ARG NE 1 1 20 14312 1 1 5 ARG NH1 N -9.427 -2.807 -1.829 1.00 . A A . 5 ARG NH1 1 1 20 14313 1 1 5 ARG NH2 N -10.416 -3.614 0.113 1.00 . A A . 5 ARG NH2 1 1 20 14314 1 1 5 ARG O O -2.367 -4.039 0.328 1.00 . A A . 5 ARG O 1 1 20 14315 1 1 6 PRO C C -1.289 -4.042 -2.628 1.00 . A A . 6 PRO C 1 1 20 14316 1 1 6 PRO CA C -0.965 -5.262 -1.762 1.00 . A A . 6 PRO CA 1 1 20 14317 1 1 6 PRO CB C -0.423 -6.435 -2.590 1.00 . A A . 6 PRO CB 1 1 20 14318 1 1 6 PRO CD C -2.497 -7.090 -1.616 1.00 . A A . 6 PRO CD 1 1 20 14319 1 1 6 PRO CG C -1.681 -7.245 -2.899 1.00 . A A . 6 PRO CG 1 1 20 14320 1 1 6 PRO HA H -0.211 -4.967 -1.034 1.00 . A A . 6 PRO HA 1 1 20 14321 1 1 6 PRO HB2 H 0.098 -6.129 -3.497 1.00 . A A . 6 PRO HB2 1 1 20 14322 1 1 6 PRO HB3 H 0.241 -7.034 -1.966 1.00 . A A . 6 PRO HB3 1 1 20 14323 1 1 6 PRO HD2 H -3.558 -7.186 -1.842 1.00 . A A . 6 PRO HD2 1 1 20 14324 1 1 6 PRO HD3 H -2.194 -7.858 -0.902 1.00 . A A . 6 PRO HD3 1 1 20 14325 1 1 6 PRO HG2 H -2.216 -6.782 -3.730 1.00 . A A . 6 PRO HG2 1 1 20 14326 1 1 6 PRO HG3 H -1.459 -8.289 -3.128 1.00 . A A . 6 PRO HG3 1 1 20 14327 1 1 6 PRO N N -2.147 -5.779 -1.091 1.00 . A A . 6 PRO N 1 1 20 14328 1 1 6 PRO O O -2.437 -3.612 -2.735 1.00 . A A . 6 PRO O 1 1 20 14329 1 1 7 SER C C -1.296 -2.521 -5.260 1.00 . A A . 7 SER C 1 1 20 14330 1 1 7 SER CA C -0.311 -2.327 -4.110 1.00 . A A . 7 SER CA 1 1 20 14331 1 1 7 SER CB C 1.083 -2.066 -4.669 1.00 . A A . 7 SER CB 1 1 20 14332 1 1 7 SER H H 0.666 -3.908 -3.138 1.00 . A A . 7 SER H 1 1 20 14333 1 1 7 SER HA H -0.590 -1.438 -3.545 1.00 . A A . 7 SER HA 1 1 20 14334 1 1 7 SER HB2 H 0.922 -1.343 -5.463 1.00 . A A . 7 SER HB2 1 1 20 14335 1 1 7 SER HB3 H 1.725 -1.633 -3.903 1.00 . A A . 7 SER HB3 1 1 20 14336 1 1 7 SER HG H 0.965 -3.641 -5.757 1.00 . A A . 7 SER HG 1 1 20 14337 1 1 7 SER N N -0.248 -3.496 -3.255 1.00 . A A . 7 SER N 1 1 20 14338 1 1 7 SER O O -0.955 -3.193 -6.232 1.00 . A A . 7 SER O 1 1 20 14339 1 1 7 SER OG O 1.651 -3.262 -5.184 1.00 . A A . 7 SER OG 1 1 20 14340 1 1 8 GLN C C -3.068 -0.602 -7.144 1.00 . A A . 8 GLN C 1 1 20 14341 1 1 8 GLN CA C -3.425 -1.795 -6.250 1.00 . A A . 8 GLN CA 1 1 20 14342 1 1 8 GLN CB C -4.834 -1.644 -5.667 1.00 . A A . 8 GLN CB 1 1 20 14343 1 1 8 GLN CD C -6.711 -2.927 -4.566 1.00 . A A . 8 GLN CD 1 1 20 14344 1 1 8 GLN CG C -5.198 -2.779 -4.699 1.00 . A A . 8 GLN CG 1 1 20 14345 1 1 8 GLN H H -2.688 -1.415 -4.308 1.00 . A A . 8 GLN H 1 1 20 14346 1 1 8 GLN HA H -3.396 -2.704 -6.854 1.00 . A A . 8 GLN HA 1 1 20 14347 1 1 8 GLN HB2 H -4.932 -0.691 -5.148 1.00 . A A . 8 GLN HB2 1 1 20 14348 1 1 8 GLN HB3 H -5.522 -1.648 -6.506 1.00 . A A . 8 GLN HB3 1 1 20 14349 1 1 8 GLN HE21 H -6.798 -4.121 -6.205 1.00 . A A . 8 GLN HE21 1 1 20 14350 1 1 8 GLN HE22 H -8.331 -3.786 -5.431 1.00 . A A . 8 GLN HE22 1 1 20 14351 1 1 8 GLN HG2 H -4.784 -3.720 -5.062 1.00 . A A . 8 GLN HG2 1 1 20 14352 1 1 8 GLN HG3 H -4.770 -2.570 -3.718 1.00 . A A . 8 GLN HG3 1 1 20 14353 1 1 8 GLN N N -2.466 -1.887 -5.168 1.00 . A A . 8 GLN N 1 1 20 14354 1 1 8 GLN NE2 N -7.329 -3.679 -5.469 1.00 . A A . 8 GLN NE2 1 1 20 14355 1 1 8 GLN O O -2.945 -0.736 -8.356 1.00 . A A . 8 GLN O 1 1 20 14356 1 1 8 GLN OE1 O -7.336 -2.360 -3.668 1.00 . A A . 8 GLN OE1 1 1 20 14357 1 1 9 THR C C -1.060 1.771 -7.573 1.00 . A A . 9 THR C 1 1 20 14358 1 1 9 THR CA C -2.534 1.811 -7.194 1.00 . A A . 9 THR CA 1 1 20 14359 1 1 9 THR CB C -2.774 2.942 -6.181 1.00 . A A . 9 THR CB 1 1 20 14360 1 1 9 THR CG2 C -4.253 3.306 -6.160 1.00 . A A . 9 THR CG2 1 1 20 14361 1 1 9 THR H H -2.984 0.644 -5.525 1.00 . A A . 9 THR H 1 1 20 14362 1 1 9 THR HA H -3.132 1.966 -8.095 1.00 . A A . 9 THR HA 1 1 20 14363 1 1 9 THR HB H -2.195 3.824 -6.465 1.00 . A A . 9 THR HB 1 1 20 14364 1 1 9 THR HG1 H -2.583 3.154 -4.217 1.00 . A A . 9 THR HG1 1 1 20 14365 1 1 9 THR HG21 H -4.842 2.436 -5.884 1.00 . A A . 9 THR HG21 1 1 20 14366 1 1 9 THR HG22 H -4.415 4.110 -5.441 1.00 . A A . 9 THR HG22 1 1 20 14367 1 1 9 THR HG23 H -4.564 3.639 -7.151 1.00 . A A . 9 THR HG23 1 1 20 14368 1 1 9 THR N N -2.897 0.572 -6.530 1.00 . A A . 9 THR N 1 1 20 14369 1 1 9 THR O O -0.680 1.894 -8.738 1.00 . A A . 9 THR O 1 1 20 14370 1 1 9 THR OG1 O -2.375 2.486 -4.890 1.00 . A A . 9 THR OG1 1 1 20 14371 1 1 10 TRP C C 1.840 0.660 -7.409 1.00 . A A . 10 TRP C 1 1 20 14372 1 1 10 TRP CA C 1.208 1.769 -6.560 1.00 . A A . 10 TRP CA 1 1 20 14373 1 1 10 TRP CB C 1.695 1.753 -5.111 1.00 . A A . 10 TRP CB 1 1 20 14374 1 1 10 TRP CD1 C 4.209 1.468 -5.215 1.00 . A A . 10 TRP CD1 1 1 20 14375 1 1 10 TRP CD2 C 3.596 3.437 -4.328 1.00 . A A . 10 TRP CD2 1 1 20 14376 1 1 10 TRP CE2 C 5.017 3.430 -4.386 1.00 . A A . 10 TRP CE2 1 1 20 14377 1 1 10 TRP CE3 C 2.980 4.581 -3.779 1.00 . A A . 10 TRP CE3 1 1 20 14378 1 1 10 TRP CG C 3.110 2.187 -4.898 1.00 . A A . 10 TRP CG 1 1 20 14379 1 1 10 TRP CH2 C 5.139 5.647 -3.427 1.00 . A A . 10 TRP CH2 1 1 20 14380 1 1 10 TRP CZ2 C 5.786 4.512 -3.940 1.00 . A A . 10 TRP CZ2 1 1 20 14381 1 1 10 TRP CZ3 C 3.732 5.685 -3.345 1.00 . A A . 10 TRP CZ3 1 1 20 14382 1 1 10 TRP H H -0.699 1.608 -5.629 1.00 . A A . 10 TRP H 1 1 20 14383 1 1 10 TRP HA H 1.463 2.738 -6.996 1.00 . A A . 10 TRP HA 1 1 20 14384 1 1 10 TRP HB2 H 1.064 2.426 -4.526 1.00 . A A . 10 TRP HB2 1 1 20 14385 1 1 10 TRP HB3 H 1.558 0.750 -4.719 1.00 . A A . 10 TRP HB3 1 1 20 14386 1 1 10 TRP HD1 H 4.193 0.479 -5.657 1.00 . A A . 10 TRP HD1 1 1 20 14387 1 1 10 TRP HE1 H 6.295 1.944 -5.156 1.00 . A A . 10 TRP HE1 1 1 20 14388 1 1 10 TRP HE3 H 1.908 4.602 -3.692 1.00 . A A . 10 TRP HE3 1 1 20 14389 1 1 10 TRP HH2 H 5.744 6.478 -3.109 1.00 . A A . 10 TRP HH2 1 1 20 14390 1 1 10 TRP HZ2 H 6.864 4.481 -4.009 1.00 . A A . 10 TRP HZ2 1 1 20 14391 1 1 10 TRP HZ3 H 3.209 6.555 -2.946 1.00 . A A . 10 TRP HZ3 1 1 20 14392 1 1 10 TRP N N -0.236 1.643 -6.532 1.00 . A A . 10 TRP N 1 1 20 14393 1 1 10 TRP NE1 N 5.340 2.213 -4.948 1.00 . A A . 10 TRP NE1 1 1 20 14394 1 1 10 TRP O O 2.416 -0.300 -6.900 1.00 . A A . 10 TRP O 1 1 20 14395 1 1 11 SER C C 3.632 -0.278 -9.863 1.00 . A A . 11 SER C 1 1 20 14396 1 1 11 SER CA C 2.124 -0.293 -9.623 1.00 . A A . 11 SER CA 1 1 20 14397 1 1 11 SER CB C 1.310 -0.172 -10.916 1.00 . A A . 11 SER CB 1 1 20 14398 1 1 11 SER H H 1.161 1.530 -9.085 1.00 . A A . 11 SER H 1 1 20 14399 1 1 11 SER HA H 1.893 -1.240 -9.134 1.00 . A A . 11 SER HA 1 1 20 14400 1 1 11 SER HB2 H 1.573 0.752 -11.436 1.00 . A A . 11 SER HB2 1 1 20 14401 1 1 11 SER HB3 H 1.543 -1.014 -11.570 1.00 . A A . 11 SER HB3 1 1 20 14402 1 1 11 SER HG H -0.297 0.550 -10.015 1.00 . A A . 11 SER HG 1 1 20 14403 1 1 11 SER N N 1.734 0.776 -8.726 1.00 . A A . 11 SER N 1 1 20 14404 1 1 11 SER O O 4.091 -0.033 -10.976 1.00 . A A . 11 SER O 1 1 20 14405 1 1 11 SER OG O -0.075 -0.176 -10.614 1.00 . A A . 11 SER OG 1 1 20 14406 1 1 12 GLY C C 6.438 -0.986 -7.518 1.00 . A A . 12 GLY C 1 1 20 14407 1 1 12 GLY CA C 5.849 -0.581 -8.868 1.00 . A A . 12 GLY CA 1 1 20 14408 1 1 12 GLY H H 3.951 -0.716 -7.915 1.00 . A A . 12 GLY H 1 1 20 14409 1 1 12 GLY HA2 H 6.175 -1.296 -9.625 1.00 . A A . 12 GLY HA2 1 1 20 14410 1 1 12 GLY HA3 H 6.207 0.412 -9.140 1.00 . A A . 12 GLY HA3 1 1 20 14411 1 1 12 GLY N N 4.403 -0.554 -8.809 1.00 . A A . 12 GLY N 1 1 20 14412 1 1 12 GLY O O 5.785 -1.682 -6.727 1.00 . A A . 12 GLY O 1 1 20 14413 1 1 13 ASN C C 8.250 0.423 -5.112 1.00 . A A . 13 ASN C 1 1 20 14414 1 1 13 ASN CA C 8.422 -0.779 -6.051 1.00 . A A . 13 ASN CA 1 1 20 14415 1 1 13 ASN CB C 9.895 -1.050 -6.376 1.00 . A A . 13 ASN CB 1 1 20 14416 1 1 13 ASN CG C 10.647 -1.535 -5.141 1.00 . A A . 13 ASN CG 1 1 20 14417 1 1 13 ASN H H 8.104 0.067 -7.959 1.00 . A A . 13 ASN H 1 1 20 14418 1 1 13 ASN HA H 8.029 -1.683 -5.594 1.00 . A A . 13 ASN HA 1 1 20 14419 1 1 13 ASN HB2 H 9.952 -1.833 -7.135 1.00 . A A . 13 ASN HB2 1 1 20 14420 1 1 13 ASN HB3 H 10.361 -0.148 -6.775 1.00 . A A . 13 ASN HB3 1 1 20 14421 1 1 13 ASN HD21 H 11.269 0.354 -4.680 1.00 . A A . 13 ASN HD21 1 1 20 14422 1 1 13 ASN HD22 H 11.741 -0.893 -3.562 1.00 . A A . 13 ASN HD22 1 1 20 14423 1 1 13 ASN N N 7.677 -0.547 -7.280 1.00 . A A . 13 ASN N 1 1 20 14424 1 1 13 ASN ND2 N 11.289 -0.621 -4.421 1.00 . A A . 13 ASN ND2 1 1 20 14425 1 1 13 ASN O O 8.009 1.534 -5.579 1.00 . A A . 13 ASN O 1 1 20 14426 1 1 13 ASN OD1 O 10.629 -2.723 -4.823 1.00 . A A . 13 ASN OD1 1 1 20 14427 1 1 14 CYS C C 9.215 1.581 -1.971 1.00 . A A . 14 CYS C 1 1 20 14428 1 1 14 CYS CA C 7.971 1.167 -2.751 1.00 . A A . 14 CYS CA 1 1 20 14429 1 1 14 CYS CB C 6.933 0.526 -1.821 1.00 . A A . 14 CYS CB 1 1 20 14430 1 1 14 CYS H H 8.484 -0.744 -3.496 1.00 . A A . 14 CYS H 1 1 20 14431 1 1 14 CYS HA H 7.522 2.055 -3.196 1.00 . A A . 14 CYS HA 1 1 20 14432 1 1 14 CYS HB2 H 6.212 0.016 -2.454 1.00 . A A . 14 CYS HB2 1 1 20 14433 1 1 14 CYS HB3 H 7.400 -0.210 -1.169 1.00 . A A . 14 CYS HB3 1 1 20 14434 1 1 14 CYS N N 8.316 0.208 -3.798 1.00 . A A . 14 CYS N 1 1 20 14435 1 1 14 CYS O O 10.191 0.836 -1.912 1.00 . A A . 14 CYS O 1 1 20 14436 1 1 14 CYS SG S 5.950 1.644 -0.795 1.00 . A A . 14 CYS SG 1 1 20 14437 1 1 15 GLY C C 9.660 4.409 0.350 1.00 . A A . 15 GLY C 1 1 20 14438 1 1 15 GLY CA C 10.221 3.273 -0.496 1.00 . A A . 15 GLY CA 1 1 20 14439 1 1 15 GLY H H 8.320 3.304 -1.435 1.00 . A A . 15 GLY H 1 1 20 14440 1 1 15 GLY HA2 H 10.577 2.482 0.162 1.00 . A A . 15 GLY HA2 1 1 20 14441 1 1 15 GLY HA3 H 11.048 3.641 -1.102 1.00 . A A . 15 GLY HA3 1 1 20 14442 1 1 15 GLY N N 9.171 2.769 -1.368 1.00 . A A . 15 GLY N 1 1 20 14443 1 1 15 GLY O O 9.668 4.370 1.580 1.00 . A A . 15 GLY O 1 1 20 14444 1 1 16 ASN C C 7.092 6.074 0.906 1.00 . A A . 16 ASN C 1 1 20 14445 1 1 16 ASN CA C 8.428 6.522 0.317 1.00 . A A . 16 ASN CA 1 1 20 14446 1 1 16 ASN CB C 8.279 7.688 -0.665 1.00 . A A . 16 ASN CB 1 1 20 14447 1 1 16 ASN CG C 7.890 8.972 0.055 1.00 . A A . 16 ASN CG 1 1 20 14448 1 1 16 ASN H H 9.118 5.359 -1.338 1.00 . A A . 16 ASN H 1 1 20 14449 1 1 16 ASN HA H 9.068 6.872 1.130 1.00 . A A . 16 ASN HA 1 1 20 14450 1 1 16 ASN HB2 H 9.245 7.858 -1.145 1.00 . A A . 16 ASN HB2 1 1 20 14451 1 1 16 ASN HB3 H 7.544 7.467 -1.436 1.00 . A A . 16 ASN HB3 1 1 20 14452 1 1 16 ASN HD21 H 9.062 10.111 -1.165 1.00 . A A . 16 ASN HD21 1 1 20 14453 1 1 16 ASN HD22 H 8.161 10.961 0.069 1.00 . A A . 16 ASN HD22 1 1 20 14454 1 1 16 ASN N N 9.084 5.400 -0.332 1.00 . A A . 16 ASN N 1 1 20 14455 1 1 16 ASN ND2 N 8.402 10.107 -0.404 1.00 . A A . 16 ASN ND2 1 1 20 14456 1 1 16 ASN O O 6.030 6.257 0.311 1.00 . A A . 16 ASN O 1 1 20 14457 1 1 16 ASN OD1 O 7.104 8.951 0.999 1.00 . A A . 16 ASN OD1 1 1 20 14458 1 1 17 THR C C 4.951 5.983 3.118 1.00 . A A . 17 THR C 1 1 20 14459 1 1 17 THR CA C 5.992 4.908 2.756 1.00 . A A . 17 THR CA 1 1 20 14460 1 1 17 THR CB C 6.431 4.029 3.936 1.00 . A A . 17 THR CB 1 1 20 14461 1 1 17 THR CG2 C 6.950 4.835 5.131 1.00 . A A . 17 THR CG2 1 1 20 14462 1 1 17 THR H H 8.082 5.235 2.438 1.00 . A A . 17 THR H 1 1 20 14463 1 1 17 THR HA H 5.533 4.236 2.036 1.00 . A A . 17 THR HA 1 1 20 14464 1 1 17 THR HB H 7.236 3.381 3.586 1.00 . A A . 17 THR HB 1 1 20 14465 1 1 17 THR HG1 H 4.643 3.735 4.635 1.00 . A A . 17 THR HG1 1 1 20 14466 1 1 17 THR HG21 H 7.777 5.474 4.822 1.00 . A A . 17 THR HG21 1 1 20 14467 1 1 17 THR HG22 H 6.157 5.452 5.557 1.00 . A A . 17 THR HG22 1 1 20 14468 1 1 17 THR HG23 H 7.306 4.148 5.900 1.00 . A A . 17 THR HG23 1 1 20 14469 1 1 17 THR N N 7.156 5.468 2.091 1.00 . A A . 17 THR N 1 1 20 14470 1 1 17 THR O O 3.758 5.686 3.217 1.00 . A A . 17 THR O 1 1 20 14471 1 1 17 THR OG1 O 5.376 3.182 4.342 1.00 . A A . 17 THR OG1 1 1 20 14472 1 1 18 ALA C C 3.599 8.463 2.144 1.00 . A A . 18 ALA C 1 1 20 14473 1 1 18 ALA CA C 4.419 8.336 3.429 1.00 . A A . 18 ALA CA 1 1 20 14474 1 1 18 ALA CB C 5.150 9.637 3.776 1.00 . A A . 18 ALA CB 1 1 20 14475 1 1 18 ALA H H 6.348 7.459 3.173 1.00 . A A . 18 ALA H 1 1 20 14476 1 1 18 ALA HA H 3.741 8.107 4.253 1.00 . A A . 18 ALA HA 1 1 20 14477 1 1 18 ALA HB1 H 5.710 9.507 4.703 1.00 . A A . 18 ALA HB1 1 1 20 14478 1 1 18 ALA HB2 H 5.836 9.923 2.982 1.00 . A A . 18 ALA HB2 1 1 20 14479 1 1 18 ALA HB3 H 4.419 10.435 3.916 1.00 . A A . 18 ALA HB3 1 1 20 14480 1 1 18 ALA N N 5.369 7.243 3.280 1.00 . A A . 18 ALA N 1 1 20 14481 1 1 18 ALA O O 2.369 8.430 2.174 1.00 . A A . 18 ALA O 1 1 20 14482 1 1 19 HIS C C 2.723 7.349 -0.462 1.00 . A A . 19 HIS C 1 1 20 14483 1 1 19 HIS CA C 3.613 8.584 -0.302 1.00 . A A . 19 HIS CA 1 1 20 14484 1 1 19 HIS CB C 4.645 8.687 -1.429 1.00 . A A . 19 HIS CB 1 1 20 14485 1 1 19 HIS CD2 C 2.845 9.329 -3.212 1.00 . A A . 19 HIS CD2 1 1 20 14486 1 1 19 HIS CE1 C 4.118 9.173 -4.984 1.00 . A A . 19 HIS CE1 1 1 20 14487 1 1 19 HIS CG C 4.115 9.005 -2.805 1.00 . A A . 19 HIS CG 1 1 20 14488 1 1 19 HIS H H 5.289 8.545 1.032 1.00 . A A . 19 HIS H 1 1 20 14489 1 1 19 HIS HA H 2.990 9.477 -0.335 1.00 . A A . 19 HIS HA 1 1 20 14490 1 1 19 HIS HB2 H 5.341 9.473 -1.198 1.00 . A A . 19 HIS HB2 1 1 20 14491 1 1 19 HIS HB3 H 5.199 7.754 -1.459 1.00 . A A . 19 HIS HB3 1 1 20 14492 1 1 19 HIS HD1 H 5.924 8.815 -3.963 1.00 . A A . 19 HIS HD1 1 1 20 14493 1 1 19 HIS HD2 H 1.972 9.408 -2.576 1.00 . A A . 19 HIS HD2 1 1 20 14494 1 1 19 HIS HE1 H 4.438 9.143 -6.017 1.00 . A A . 19 HIS HE1 1 1 20 14495 1 1 19 HIS N N 4.275 8.560 0.995 1.00 . A A . 19 HIS N 1 1 20 14496 1 1 19 HIS ND1 N 4.928 8.991 -3.930 1.00 . A A . 19 HIS ND1 1 1 20 14497 1 1 19 HIS NE2 N 2.851 9.371 -4.593 1.00 . A A . 19 HIS NE2 1 1 20 14498 1 1 19 HIS O O 1.587 7.485 -0.906 1.00 . A A . 19 HIS O 1 1 20 14499 1 1 20 CYS C C 1.098 5.159 0.623 1.00 . A A . 20 CYS C 1 1 20 14500 1 1 20 CYS CA C 2.412 4.939 -0.110 1.00 . A A . 20 CYS CA 1 1 20 14501 1 1 20 CYS CB C 3.136 3.779 0.564 1.00 . A A . 20 CYS CB 1 1 20 14502 1 1 20 CYS H H 4.188 6.112 0.203 1.00 . A A . 20 CYS H 1 1 20 14503 1 1 20 CYS HA H 2.188 4.668 -1.140 1.00 . A A . 20 CYS HA 1 1 20 14504 1 1 20 CYS HB2 H 3.982 3.458 -0.037 1.00 . A A . 20 CYS HB2 1 1 20 14505 1 1 20 CYS HB3 H 3.494 4.090 1.531 1.00 . A A . 20 CYS HB3 1 1 20 14506 1 1 20 CYS N N 3.221 6.160 -0.102 1.00 . A A . 20 CYS N 1 1 20 14507 1 1 20 CYS O O 0.025 4.894 0.083 1.00 . A A . 20 CYS O 1 1 20 14508 1 1 20 CYS SG S 2.057 2.384 0.946 1.00 . A A . 20 CYS SG 1 1 20 14509 1 1 21 ASP C C -0.917 6.922 1.943 1.00 . A A . 21 ASP C 1 1 20 14510 1 1 21 ASP CA C -0.002 5.912 2.649 1.00 . A A . 21 ASP CA 1 1 20 14511 1 1 21 ASP CB C 0.435 6.418 4.027 1.00 . A A . 21 ASP CB 1 1 20 14512 1 1 21 ASP CG C -0.771 6.862 4.832 1.00 . A A . 21 ASP CG 1 1 20 14513 1 1 21 ASP H H 2.096 5.883 2.244 1.00 . A A . 21 ASP H 1 1 20 14514 1 1 21 ASP HA H -0.539 4.964 2.777 1.00 . A A . 21 ASP HA 1 1 20 14515 1 1 21 ASP HB2 H 0.955 5.626 4.564 1.00 . A A . 21 ASP HB2 1 1 20 14516 1 1 21 ASP HB3 H 1.107 7.266 3.927 1.00 . A A . 21 ASP HB3 1 1 20 14517 1 1 21 ASP N N 1.181 5.690 1.842 1.00 . A A . 21 ASP N 1 1 20 14518 1 1 21 ASP O O -2.136 6.752 1.951 1.00 . A A . 21 ASP O 1 1 20 14519 1 1 21 ASP OD1 O -1.626 6.029 5.115 1.00 . A A . 21 ASP OD1 1 1 20 14520 1 1 21 ASP OD2 O -0.814 8.181 5.158 1.00 . A A . 21 ASP OD2 1 1 20 14521 1 1 22 LYS C C -1.883 8.003 -0.642 1.00 . A A . 22 LYS C 1 1 20 14522 1 1 22 LYS CA C -1.172 8.811 0.443 1.00 . A A . 22 LYS CA 1 1 20 14523 1 1 22 LYS CB C -0.433 9.991 -0.181 1.00 . A A . 22 LYS CB 1 1 20 14524 1 1 22 LYS CD C 0.691 12.175 0.448 1.00 . A A . 22 LYS CD 1 1 20 14525 1 1 22 LYS CE C -0.136 13.277 1.131 1.00 . A A . 22 LYS CE 1 1 20 14526 1 1 22 LYS CG C 0.319 10.755 0.902 1.00 . A A . 22 LYS CG 1 1 20 14527 1 1 22 LYS H H 0.660 8.050 1.310 1.00 . A A . 22 LYS H 1 1 20 14528 1 1 22 LYS HA H -1.894 9.275 1.107 1.00 . A A . 22 LYS HA 1 1 20 14529 1 1 22 LYS HB2 H 0.262 9.655 -0.950 1.00 . A A . 22 LYS HB2 1 1 20 14530 1 1 22 LYS HB3 H -1.175 10.641 -0.646 1.00 . A A . 22 LYS HB3 1 1 20 14531 1 1 22 LYS HD2 H 1.742 12.352 0.693 1.00 . A A . 22 LYS HD2 1 1 20 14532 1 1 22 LYS HD3 H 0.596 12.255 -0.637 1.00 . A A . 22 LYS HD3 1 1 20 14533 1 1 22 LYS HE2 H 0.233 13.413 2.149 1.00 . A A . 22 LYS HE2 1 1 20 14534 1 1 22 LYS HE3 H 0.018 14.214 0.589 1.00 . A A . 22 LYS HE3 1 1 20 14535 1 1 22 LYS HG2 H -0.221 10.740 1.847 1.00 . A A . 22 LYS HG2 1 1 20 14536 1 1 22 LYS HG3 H 1.207 10.165 1.049 1.00 . A A . 22 LYS HG3 1 1 20 14537 1 1 22 LYS HZ1 H -1.807 12.211 0.553 1.00 . A A . 22 LYS HZ1 1 1 20 14538 1 1 22 LYS HZ2 H -1.831 12.701 2.161 1.00 . A A . 22 LYS HZ2 1 1 20 14539 1 1 22 LYS N N -0.352 7.943 1.282 1.00 . A A . 22 LYS N 1 1 20 14540 1 1 22 LYS NZ N -1.583 12.979 1.201 1.00 . A A . 22 LYS NZ 1 1 20 14541 1 1 22 LYS O O -3.102 8.109 -0.779 1.00 . A A . 22 LYS O 1 1 20 14542 1 1 23 GLN C C -2.619 5.171 -1.963 1.00 . A A . 23 GLN C 1 1 20 14543 1 1 23 GLN CA C -1.789 6.370 -2.459 1.00 . A A . 23 GLN CA 1 1 20 14544 1 1 23 GLN CB C -0.802 5.931 -3.546 1.00 . A A . 23 GLN CB 1 1 20 14545 1 1 23 GLN CD C 0.719 6.880 -5.379 1.00 . A A . 23 GLN CD 1 1 20 14546 1 1 23 GLN CG C 0.113 7.073 -3.998 1.00 . A A . 23 GLN CG 1 1 20 14547 1 1 23 GLN H H -0.179 7.046 -1.174 1.00 . A A . 23 GLN H 1 1 20 14548 1 1 23 GLN HA H -2.448 7.064 -2.958 1.00 . A A . 23 GLN HA 1 1 20 14549 1 1 23 GLN HB2 H -0.207 5.100 -3.171 1.00 . A A . 23 GLN HB2 1 1 20 14550 1 1 23 GLN HB3 H -1.401 5.590 -4.393 1.00 . A A . 23 GLN HB3 1 1 20 14551 1 1 23 GLN HE21 H 0.304 4.881 -5.434 1.00 . A A . 23 GLN HE21 1 1 20 14552 1 1 23 GLN HE22 H 1.091 5.578 -6.837 1.00 . A A . 23 GLN HE22 1 1 20 14553 1 1 23 GLN HG2 H -0.457 7.998 -4.042 1.00 . A A . 23 GLN HG2 1 1 20 14554 1 1 23 GLN HG3 H 0.933 7.172 -3.297 1.00 . A A . 23 GLN HG3 1 1 20 14555 1 1 23 GLN N N -1.166 7.155 -1.390 1.00 . A A . 23 GLN N 1 1 20 14556 1 1 23 GLN NE2 N 0.708 5.669 -5.917 1.00 . A A . 23 GLN NE2 1 1 20 14557 1 1 23 GLN O O -2.733 4.161 -2.659 1.00 . A A . 23 GLN O 1 1 20 14558 1 1 23 GLN OE1 O 1.218 7.841 -5.959 1.00 . A A . 23 GLN OE1 1 1 20 14559 1 1 24 CYS C C -5.228 5.185 0.538 1.00 . A A . 24 CYS C 1 1 20 14560 1 1 24 CYS CA C -4.124 4.373 -0.131 1.00 . A A . 24 CYS CA 1 1 20 14561 1 1 24 CYS CB C -3.329 3.577 0.915 1.00 . A A . 24 CYS CB 1 1 20 14562 1 1 24 CYS H H -3.163 6.228 -0.357 1.00 . A A . 24 CYS H 1 1 20 14563 1 1 24 CYS HA H -4.590 3.681 -0.840 1.00 . A A . 24 CYS HA 1 1 20 14564 1 1 24 CYS HB2 H -2.809 4.263 1.580 1.00 . A A . 24 CYS HB2 1 1 20 14565 1 1 24 CYS HB3 H -4.028 2.995 1.509 1.00 . A A . 24 CYS HB3 1 1 20 14566 1 1 24 CYS N N -3.263 5.331 -0.806 1.00 . A A . 24 CYS N 1 1 20 14567 1 1 24 CYS O O -6.402 4.902 0.338 1.00 . A A . 24 CYS O 1 1 20 14568 1 1 24 CYS SG S -2.109 2.400 0.289 1.00 . A A . 24 CYS SG 1 1 20 14569 1 1 25 GLN C C -6.514 8.029 0.845 1.00 . A A . 25 GLN C 1 1 20 14570 1 1 25 GLN CA C -5.888 7.098 1.891 1.00 . A A . 25 GLN CA 1 1 20 14571 1 1 25 GLN CB C -5.301 7.898 3.060 1.00 . A A . 25 GLN CB 1 1 20 14572 1 1 25 GLN CD C -4.264 7.804 5.334 1.00 . A A . 25 GLN CD 1 1 20 14573 1 1 25 GLN CG C -4.749 6.981 4.149 1.00 . A A . 25 GLN CG 1 1 20 14574 1 1 25 GLN H H -3.900 6.417 1.490 1.00 . A A . 25 GLN H 1 1 20 14575 1 1 25 GLN HA H -6.689 6.482 2.306 1.00 . A A . 25 GLN HA 1 1 20 14576 1 1 25 GLN HB2 H -4.496 8.546 2.730 1.00 . A A . 25 GLN HB2 1 1 20 14577 1 1 25 GLN HB3 H -6.090 8.509 3.501 1.00 . A A . 25 GLN HB3 1 1 20 14578 1 1 25 GLN HE21 H -5.388 6.705 6.595 1.00 . A A . 25 GLN HE21 1 1 20 14579 1 1 25 GLN HE22 H -4.482 8.019 7.339 1.00 . A A . 25 GLN HE22 1 1 20 14580 1 1 25 GLN HG2 H -5.537 6.297 4.465 1.00 . A A . 25 GLN HG2 1 1 20 14581 1 1 25 GLN HG3 H -3.913 6.405 3.761 1.00 . A A . 25 GLN HG3 1 1 20 14582 1 1 25 GLN N N -4.880 6.230 1.297 1.00 . A A . 25 GLN N 1 1 20 14583 1 1 25 GLN NE2 N -4.755 7.495 6.522 1.00 . A A . 25 GLN NE2 1 1 20 14584 1 1 25 GLN O O -7.732 8.188 0.815 1.00 . A A . 25 GLN O 1 1 20 14585 1 1 25 GLN OE1 O -3.454 8.716 5.185 1.00 . A A . 25 GLN OE1 1 1 20 14586 1 1 26 ASP C C -6.780 8.895 -2.189 1.00 . A A . 26 ASP C 1 1 20 14587 1 1 26 ASP CA C -6.220 9.628 -0.979 1.00 . A A . 26 ASP CA 1 1 20 14588 1 1 26 ASP CB C -5.149 10.644 -1.404 1.00 . A A . 26 ASP CB 1 1 20 14589 1 1 26 ASP CG C -4.793 11.630 -0.296 1.00 . A A . 26 ASP CG 1 1 20 14590 1 1 26 ASP H H -4.719 8.409 -0.054 1.00 . A A . 26 ASP H 1 1 20 14591 1 1 26 ASP HA H -7.036 10.193 -0.537 1.00 . A A . 26 ASP HA 1 1 20 14592 1 1 26 ASP HB2 H -4.256 10.131 -1.744 1.00 . A A . 26 ASP HB2 1 1 20 14593 1 1 26 ASP HB3 H -5.542 11.223 -2.240 1.00 . A A . 26 ASP HB3 1 1 20 14594 1 1 26 ASP N N -5.702 8.661 -0.013 1.00 . A A . 26 ASP N 1 1 20 14595 1 1 26 ASP O O -7.944 9.064 -2.553 1.00 . A A . 26 ASP O 1 1 20 14596 1 1 26 ASP OD1 O -5.841 12.251 0.309 1.00 . A A . 26 ASP OD1 1 1 20 14597 1 1 26 ASP OD2 O -3.611 11.833 -0.016 1.00 . A A . 26 ASP OD2 1 1 20 14598 1 1 27 TRP C C -7.346 6.482 -4.002 1.00 . A A . 27 TRP C 1 1 20 14599 1 1 27 TRP CA C -6.253 7.534 -4.136 1.00 . A A . 27 TRP CA 1 1 20 14600 1 1 27 TRP CB C -5.007 6.887 -4.736 1.00 . A A . 27 TRP CB 1 1 20 14601 1 1 27 TRP CD1 C -3.567 8.997 -4.774 1.00 . A A . 27 TRP CD1 1 1 20 14602 1 1 27 TRP CD2 C -3.070 7.541 -6.395 1.00 . A A . 27 TRP CD2 1 1 20 14603 1 1 27 TRP CE2 C -2.168 8.634 -6.535 1.00 . A A . 27 TRP CE2 1 1 20 14604 1 1 27 TRP CE3 C -2.977 6.497 -7.335 1.00 . A A . 27 TRP CE3 1 1 20 14605 1 1 27 TRP CG C -3.936 7.790 -5.258 1.00 . A A . 27 TRP CG 1 1 20 14606 1 1 27 TRP CH2 C -1.089 7.573 -8.424 1.00 . A A . 27 TRP CH2 1 1 20 14607 1 1 27 TRP CZ2 C -1.198 8.666 -7.548 1.00 . A A . 27 TRP CZ2 1 1 20 14608 1 1 27 TRP CZ3 C -1.984 6.496 -8.326 1.00 . A A . 27 TRP CZ3 1 1 20 14609 1 1 27 TRP H H -5.010 7.960 -2.446 1.00 . A A . 27 TRP H 1 1 20 14610 1 1 27 TRP HA H -6.594 8.326 -4.805 1.00 . A A . 27 TRP HA 1 1 20 14611 1 1 27 TRP HB2 H -4.557 6.205 -4.015 1.00 . A A . 27 TRP HB2 1 1 20 14612 1 1 27 TRP HB3 H -5.345 6.297 -5.588 1.00 . A A . 27 TRP HB3 1 1 20 14613 1 1 27 TRP HD1 H -4.012 9.503 -3.933 1.00 . A A . 27 TRP HD1 1 1 20 14614 1 1 27 TRP HE1 H -2.067 10.385 -5.346 1.00 . A A . 27 TRP HE1 1 1 20 14615 1 1 27 TRP HE3 H -3.696 5.699 -7.299 1.00 . A A . 27 TRP HE3 1 1 20 14616 1 1 27 TRP HH2 H -0.323 7.534 -9.178 1.00 . A A . 27 TRP HH2 1 1 20 14617 1 1 27 TRP HZ2 H -0.524 9.504 -7.638 1.00 . A A . 27 TRP HZ2 1 1 20 14618 1 1 27 TRP HZ3 H -1.915 5.671 -9.021 1.00 . A A . 27 TRP HZ3 1 1 20 14619 1 1 27 TRP N N -5.944 8.069 -2.817 1.00 . A A . 27 TRP N 1 1 20 14620 1 1 27 TRP NE1 N -2.515 9.497 -5.512 1.00 . A A . 27 TRP NE1 1 1 20 14621 1 1 27 TRP O O -8.420 6.620 -4.583 1.00 . A A . 27 TRP O 1 1 20 14622 1 1 28 GLU C C -9.133 4.894 -2.059 1.00 . A A . 28 GLU C 1 1 20 14623 1 1 28 GLU CA C -8.005 4.375 -2.958 1.00 . A A . 28 GLU CA 1 1 20 14624 1 1 28 GLU CB C -7.217 3.188 -2.380 1.00 . A A . 28 GLU CB 1 1 20 14625 1 1 28 GLU CD C -6.469 0.966 -3.347 1.00 . A A . 28 GLU CD 1 1 20 14626 1 1 28 GLU CG C -6.362 2.485 -3.446 1.00 . A A . 28 GLU CG 1 1 20 14627 1 1 28 GLU H H -6.190 5.445 -2.715 1.00 . A A . 28 GLU H 1 1 20 14628 1 1 28 GLU HA H -8.466 4.070 -3.901 1.00 . A A . 28 GLU HA 1 1 20 14629 1 1 28 GLU HB2 H -6.555 3.530 -1.599 1.00 . A A . 28 GLU HB2 1 1 20 14630 1 1 28 GLU HB3 H -7.880 2.487 -1.900 1.00 . A A . 28 GLU HB3 1 1 20 14631 1 1 28 GLU HG2 H -6.693 2.775 -4.443 1.00 . A A . 28 GLU HG2 1 1 20 14632 1 1 28 GLU HG3 H -5.319 2.780 -3.329 1.00 . A A . 28 GLU HG3 1 1 20 14633 1 1 28 GLU N N -7.079 5.461 -3.190 1.00 . A A . 28 GLU N 1 1 20 14634 1 1 28 GLU O O -10.139 5.358 -2.588 1.00 . A A . 28 GLU O 1 1 20 14635 1 1 28 GLU OE1 O -7.521 0.400 -3.994 1.00 . A A . 28 GLU OE1 1 1 20 14636 1 1 28 GLU OE2 O -5.642 0.329 -2.701 1.00 . A A . 28 GLU OE2 1 1 20 14637 1 1 29 LYS C C -9.654 4.149 1.435 1.00 . A A . 29 LYS C 1 1 20 14638 1 1 29 LYS CA C -9.676 5.290 0.417 1.00 . A A . 29 LYS CA 1 1 20 14639 1 1 29 LYS CB C -11.065 5.806 0.089 1.00 . A A . 29 LYS CB 1 1 20 14640 1 1 29 LYS CD C -12.029 7.407 -1.613 1.00 . A A . 29 LYS CD 1 1 20 14641 1 1 29 LYS CE C -11.604 8.415 -2.690 1.00 . A A . 29 LYS CE 1 1 20 14642 1 1 29 LYS CG C -10.964 7.211 -0.525 1.00 . A A . 29 LYS CG 1 1 20 14643 1 1 29 LYS H H -8.027 4.532 -0.441 1.00 . A A . 29 LYS H 1 1 20 14644 1 1 29 LYS HA H -9.134 6.109 0.887 1.00 . A A . 29 LYS HA 1 1 20 14645 1 1 29 LYS HB2 H -11.602 5.081 -0.525 1.00 . A A . 29 LYS HB2 1 1 20 14646 1 1 29 LYS HB3 H -11.549 5.874 1.049 1.00 . A A . 29 LYS HB3 1 1 20 14647 1 1 29 LYS HD2 H -12.230 6.454 -2.105 1.00 . A A . 29 LYS HD2 1 1 20 14648 1 1 29 LYS HD3 H -12.950 7.728 -1.129 1.00 . A A . 29 LYS HD3 1 1 20 14649 1 1 29 LYS HE2 H -12.405 8.465 -3.432 1.00 . A A . 29 LYS HE2 1 1 20 14650 1 1 29 LYS HE3 H -11.474 9.406 -2.252 1.00 . A A . 29 LYS HE3 1 1 20 14651 1 1 29 LYS HG2 H -11.086 7.962 0.259 1.00 . A A . 29 LYS HG2 1 1 20 14652 1 1 29 LYS HG3 H -9.962 7.344 -0.931 1.00 . A A . 29 LYS HG3 1 1 20 14653 1 1 29 LYS HZ1 H -10.377 6.990 -3.545 1.00 . A A . 29 LYS HZ1 1 1 20 14654 1 1 29 LYS HZ2 H -10.274 8.505 -4.267 1.00 . A A . 29 LYS HZ2 1 1 20 14655 1 1 29 LYS N N -8.921 4.851 -0.740 1.00 . A A . 29 LYS N 1 1 20 14656 1 1 29 LYS NZ N -10.356 8.005 -3.371 1.00 . A A . 29 LYS NZ 1 1 20 14657 1 1 29 LYS O O -10.675 3.555 1.772 1.00 . A A . 29 LYS O 1 1 20 14658 1 1 30 ALA C C -7.850 3.528 4.208 1.00 . A A . 30 ALA C 1 1 20 14659 1 1 30 ALA CA C -8.129 2.829 2.876 1.00 . A A . 30 ALA CA 1 1 20 14660 1 1 30 ALA CB C -6.898 2.067 2.383 1.00 . A A . 30 ALA CB 1 1 20 14661 1 1 30 ALA H H -7.665 4.406 1.567 1.00 . A A . 30 ALA H 1 1 20 14662 1 1 30 ALA HA H -8.963 2.134 2.983 1.00 . A A . 30 ALA HA 1 1 20 14663 1 1 30 ALA HB1 H -7.011 1.826 1.327 1.00 . A A . 30 ALA HB1 1 1 20 14664 1 1 30 ALA HB2 H -6.013 2.688 2.513 1.00 . A A . 30 ALA HB2 1 1 20 14665 1 1 30 ALA HB3 H -6.776 1.144 2.937 1.00 . A A . 30 ALA HB3 1 1 20 14666 1 1 30 ALA N N -8.440 3.839 1.887 1.00 . A A . 30 ALA N 1 1 20 14667 1 1 30 ALA O O -7.631 4.737 4.238 1.00 . A A . 30 ALA O 1 1 20 14668 1 1 31 SER C C -6.045 3.883 6.584 1.00 . A A . 31 SER C 1 1 20 14669 1 1 31 SER CA C -7.448 3.268 6.615 1.00 . A A . 31 SER CA 1 1 20 14670 1 1 31 SER CB C -7.555 2.096 7.590 1.00 . A A . 31 SER CB 1 1 20 14671 1 1 31 SER H H -7.906 1.771 5.280 1.00 . A A . 31 SER H 1 1 20 14672 1 1 31 SER HA H -8.164 4.026 6.924 1.00 . A A . 31 SER HA 1 1 20 14673 1 1 31 SER HB2 H -6.709 1.428 7.459 1.00 . A A . 31 SER HB2 1 1 20 14674 1 1 31 SER HB3 H -7.499 2.492 8.593 1.00 . A A . 31 SER HB3 1 1 20 14675 1 1 31 SER HG H -9.488 2.021 7.360 1.00 . A A . 31 SER HG 1 1 20 14676 1 1 31 SER N N -7.819 2.777 5.310 1.00 . A A . 31 SER N 1 1 20 14677 1 1 31 SER O O -5.853 4.996 7.068 1.00 . A A . 31 SER O 1 1 20 14678 1 1 31 SER OG O -8.769 1.383 7.388 1.00 . A A . 31 SER OG 1 1 20 14679 1 1 32 HIS C C -3.038 2.922 4.660 1.00 . A A . 32 HIS C 1 1 20 14680 1 1 32 HIS CA C -3.738 3.734 5.748 1.00 . A A . 32 HIS CA 1 1 20 14681 1 1 32 HIS CB C -2.889 3.807 7.034 1.00 . A A . 32 HIS CB 1 1 20 14682 1 1 32 HIS CD2 C -2.741 1.369 7.769 1.00 . A A . 32 HIS CD2 1 1 20 14683 1 1 32 HIS CE1 C -0.594 1.074 7.747 1.00 . A A . 32 HIS CE1 1 1 20 14684 1 1 32 HIS CG C -2.170 2.540 7.397 1.00 . A A . 32 HIS CG 1 1 20 14685 1 1 32 HIS H H -5.291 2.298 5.552 1.00 . A A . 32 HIS H 1 1 20 14686 1 1 32 HIS HA H -3.869 4.747 5.373 1.00 . A A . 32 HIS HA 1 1 20 14687 1 1 32 HIS HB2 H -2.117 4.544 6.924 1.00 . A A . 32 HIS HB2 1 1 20 14688 1 1 32 HIS HB3 H -3.510 4.124 7.873 1.00 . A A . 32 HIS HB3 1 1 20 14689 1 1 32 HIS HD1 H -0.093 2.976 6.969 1.00 . A A . 32 HIS HD1 1 1 20 14690 1 1 32 HIS HD2 H -3.798 1.241 7.721 1.00 . A A . 32 HIS HD2 1 1 20 14691 1 1 32 HIS HE1 H 0.365 0.587 7.800 1.00 . A A . 32 HIS HE1 1 1 20 14692 1 1 32 HIS N N -5.064 3.179 6.004 1.00 . A A . 32 HIS N 1 1 20 14693 1 1 32 HIS ND1 N -0.797 2.346 7.355 1.00 . A A . 32 HIS ND1 1 1 20 14694 1 1 32 HIS NE2 N -1.748 0.456 8.042 1.00 . A A . 32 HIS NE2 1 1 20 14695 1 1 32 HIS O O -3.596 1.937 4.172 1.00 . A A . 32 HIS O 1 1 20 14696 1 1 33 GLY C C 0.478 2.334 4.314 1.00 . A A . 33 GLY C 1 1 20 14697 1 1 33 GLY CA C -0.855 2.490 3.589 1.00 . A A . 33 GLY CA 1 1 20 14698 1 1 33 GLY H H -1.446 4.167 4.750 1.00 . A A . 33 GLY H 1 1 20 14699 1 1 33 GLY HA2 H -1.281 1.522 3.438 1.00 . A A . 33 GLY HA2 1 1 20 14700 1 1 33 GLY HA3 H -0.677 2.887 2.602 1.00 . A A . 33 GLY HA3 1 1 20 14701 1 1 33 GLY N N -1.794 3.301 4.348 1.00 . A A . 33 GLY N 1 1 20 14702 1 1 33 GLY O O 0.734 3.061 5.276 1.00 . A A . 33 GLY O 1 1 20 14703 1 1 34 ALA C C 3.470 0.313 3.366 1.00 . A A . 34 ALA C 1 1 20 14704 1 1 34 ALA CA C 2.670 1.193 4.345 1.00 . A A . 34 ALA CA 1 1 20 14705 1 1 34 ALA CB C 2.647 0.594 5.757 1.00 . A A . 34 ALA CB 1 1 20 14706 1 1 34 ALA H H 0.982 0.767 3.123 1.00 . A A . 34 ALA H 1 1 20 14707 1 1 34 ALA HA H 3.134 2.175 4.394 1.00 . A A . 34 ALA HA 1 1 20 14708 1 1 34 ALA HB1 H 2.081 -0.335 5.763 1.00 . A A . 34 ALA HB1 1 1 20 14709 1 1 34 ALA HB2 H 3.662 0.402 6.097 1.00 . A A . 34 ALA HB2 1 1 20 14710 1 1 34 ALA HB3 H 2.177 1.294 6.449 1.00 . A A . 34 ALA HB3 1 1 20 14711 1 1 34 ALA N N 1.303 1.377 3.876 1.00 . A A . 34 ALA N 1 1 20 14712 1 1 34 ALA O O 2.926 -0.656 2.834 1.00 . A A . 34 ALA O 1 1 20 14713 1 1 35 CYS C C 6.010 -1.470 2.941 1.00 . A A . 35 CYS C 1 1 20 14714 1 1 35 CYS CA C 5.624 -0.150 2.252 1.00 . A A . 35 CYS CA 1 1 20 14715 1 1 35 CYS CB C 6.935 0.610 2.011 1.00 . A A . 35 CYS CB 1 1 20 14716 1 1 35 CYS H H 5.178 1.432 3.581 1.00 . A A . 35 CYS H 1 1 20 14717 1 1 35 CYS HA H 5.128 -0.309 1.294 1.00 . A A . 35 CYS HA 1 1 20 14718 1 1 35 CYS HB2 H 7.365 0.890 2.974 1.00 . A A . 35 CYS HB2 1 1 20 14719 1 1 35 CYS HB3 H 7.613 -0.093 1.557 1.00 . A A . 35 CYS HB3 1 1 20 14720 1 1 35 CYS N N 4.756 0.622 3.137 1.00 . A A . 35 CYS N 1 1 20 14721 1 1 35 CYS O O 6.274 -1.465 4.146 1.00 . A A . 35 CYS O 1 1 20 14722 1 1 35 CYS SG S 7.022 2.065 0.935 1.00 . A A . 35 CYS SG 1 1 20 14723 1 1 36 HIS C C 7.415 -4.587 1.603 1.00 . A A . 36 HIS C 1 1 20 14724 1 1 36 HIS CA C 6.688 -3.849 2.713 1.00 . A A . 36 HIS CA 1 1 20 14725 1 1 36 HIS CB C 5.646 -4.856 3.182 1.00 . A A . 36 HIS CB 1 1 20 14726 1 1 36 HIS CD2 C 3.222 -4.723 3.915 1.00 . A A . 36 HIS CD2 1 1 20 14727 1 1 36 HIS CE1 C 3.406 -3.235 5.501 1.00 . A A . 36 HIS CE1 1 1 20 14728 1 1 36 HIS CG C 4.517 -4.329 3.997 1.00 . A A . 36 HIS CG 1 1 20 14729 1 1 36 HIS H H 5.802 -2.576 1.243 1.00 . A A . 36 HIS H 1 1 20 14730 1 1 36 HIS HA H 7.354 -3.652 3.549 1.00 . A A . 36 HIS HA 1 1 20 14731 1 1 36 HIS HB2 H 5.200 -5.329 2.304 1.00 . A A . 36 HIS HB2 1 1 20 14732 1 1 36 HIS HB3 H 6.145 -5.638 3.754 1.00 . A A . 36 HIS HB3 1 1 20 14733 1 1 36 HIS HD1 H 5.447 -2.778 5.157 1.00 . A A . 36 HIS HD1 1 1 20 14734 1 1 36 HIS HD2 H 2.899 -5.444 3.172 1.00 . A A . 36 HIS HD2 1 1 20 14735 1 1 36 HIS HE1 H 3.169 -2.546 6.298 1.00 . A A . 36 HIS HE1 1 1 20 14736 1 1 36 HIS N N 6.092 -2.599 2.218 1.00 . A A . 36 HIS N 1 1 20 14737 1 1 36 HIS ND1 N 4.629 -3.355 4.969 1.00 . A A . 36 HIS ND1 1 1 20 14738 1 1 36 HIS NE2 N 2.529 -4.075 4.919 1.00 . A A . 36 HIS NE2 1 1 20 14739 1 1 36 HIS O O 6.912 -4.612 0.483 1.00 . A A . 36 HIS O 1 1 20 14740 1 1 37 LYS C C 8.414 -7.554 1.001 1.00 . A A . 37 LYS C 1 1 20 14741 1 1 37 LYS CA C 9.147 -6.214 1.007 1.00 . A A . 37 LYS CA 1 1 20 14742 1 1 37 LYS CB C 10.624 -6.369 1.371 1.00 . A A . 37 LYS CB 1 1 20 14743 1 1 37 LYS CD C 12.797 -7.601 0.716 1.00 . A A . 37 LYS CD 1 1 20 14744 1 1 37 LYS CE C 13.979 -6.677 0.376 1.00 . A A . 37 LYS CE 1 1 20 14745 1 1 37 LYS CG C 11.439 -7.036 0.255 1.00 . A A . 37 LYS CG 1 1 20 14746 1 1 37 LYS H H 8.799 -5.308 2.896 1.00 . A A . 37 LYS H 1 1 20 14747 1 1 37 LYS HA H 9.135 -5.791 0.012 1.00 . A A . 37 LYS HA 1 1 20 14748 1 1 37 LYS HB2 H 11.013 -5.382 1.500 1.00 . A A . 37 LYS HB2 1 1 20 14749 1 1 37 LYS HB3 H 10.720 -6.881 2.317 1.00 . A A . 37 LYS HB3 1 1 20 14750 1 1 37 LYS HD2 H 12.776 -7.803 1.789 1.00 . A A . 37 LYS HD2 1 1 20 14751 1 1 37 LYS HD3 H 12.944 -8.561 0.218 1.00 . A A . 37 LYS HD3 1 1 20 14752 1 1 37 LYS HE2 H 13.790 -6.158 -0.566 1.00 . A A . 37 LYS HE2 1 1 20 14753 1 1 37 LYS HE3 H 14.082 -5.942 1.175 1.00 . A A . 37 LYS HE3 1 1 20 14754 1 1 37 LYS HG2 H 10.846 -7.862 -0.104 1.00 . A A . 37 LYS HG2 1 1 20 14755 1 1 37 LYS HG3 H 11.551 -6.341 -0.579 1.00 . A A . 37 LYS HG3 1 1 20 14756 1 1 37 LYS HZ1 H 15.043 -8.426 0.097 1.00 . A A . 37 LYS HZ1 1 1 20 14757 1 1 37 LYS HZ2 H 15.737 -7.078 -0.631 1.00 . A A . 37 LYS HZ2 1 1 20 14758 1 1 37 LYS N N 8.486 -5.312 1.937 1.00 . A A . 37 LYS N 1 1 20 14759 1 1 37 LYS NZ N 15.246 -7.421 0.206 1.00 . A A . 37 LYS NZ 1 1 20 14760 1 1 37 LYS O O 8.231 -8.179 2.042 1.00 . A A . 37 LYS O 1 1 20 14761 1 1 38 ARG C C 7.974 -9.826 -1.717 1.00 . A A . 38 ARG C 1 1 20 14762 1 1 38 ARG CA C 7.332 -9.240 -0.464 1.00 . A A . 38 ARG CA 1 1 20 14763 1 1 38 ARG CB C 5.836 -8.961 -0.674 1.00 . A A . 38 ARG CB 1 1 20 14764 1 1 38 ARG CD C 4.885 -11.324 -0.292 1.00 . A A . 38 ARG CD 1 1 20 14765 1 1 38 ARG CG C 5.030 -10.136 -1.253 1.00 . A A . 38 ARG CG 1 1 20 14766 1 1 38 ARG CZ C 3.858 -13.622 -0.480 1.00 . A A . 38 ARG CZ 1 1 20 14767 1 1 38 ARG H H 8.176 -7.361 -0.981 1.00 . A A . 38 ARG H 1 1 20 14768 1 1 38 ARG HA H 7.461 -9.925 0.376 1.00 . A A . 38 ARG HA 1 1 20 14769 1 1 38 ARG HB2 H 5.400 -8.645 0.277 1.00 . A A . 38 ARG HB2 1 1 20 14770 1 1 38 ARG HB3 H 5.755 -8.131 -1.379 1.00 . A A . 38 ARG HB3 1 1 20 14771 1 1 38 ARG HD2 H 5.849 -11.579 0.146 1.00 . A A . 38 ARG HD2 1 1 20 14772 1 1 38 ARG HD3 H 4.199 -11.031 0.504 1.00 . A A . 38 ARG HD3 1 1 20 14773 1 1 38 ARG HG2 H 4.030 -9.772 -1.493 1.00 . A A . 38 ARG HG2 1 1 20 14774 1 1 38 ARG HG3 H 5.487 -10.465 -2.187 1.00 . A A . 38 ARG HG3 1 1 20 14775 1 1 38 ARG HH11 H 3.902 -12.946 1.439 1.00 . A A . 38 ARG HH11 1 1 20 14776 1 1 38 ARG HH12 H 3.257 -14.546 1.252 1.00 . A A . 38 ARG HH12 1 1 20 14777 1 1 38 ARG HH21 H 3.803 -14.551 -2.278 1.00 . A A . 38 ARG HH21 1 1 20 14778 1 1 38 ARG HH22 H 3.144 -15.497 -0.962 1.00 . A A . 38 ARG HH22 1 1 20 14779 1 1 38 ARG N N 8.007 -7.981 -0.193 1.00 . A A . 38 ARG N 1 1 20 14780 1 1 38 ARG NE N 4.381 -12.507 -1.014 1.00 . A A . 38 ARG NE 1 1 20 14781 1 1 38 ARG NH1 N 3.653 -13.716 0.838 1.00 . A A . 38 ARG NH1 1 1 20 14782 1 1 38 ARG NH2 N 3.558 -14.638 -1.293 1.00 . A A . 38 ARG NH2 1 1 20 14783 1 1 38 ARG O O 8.006 -9.155 -2.746 1.00 . A A . 38 ARG O 1 1 20 14784 1 1 39 GLU C C 10.231 -10.787 -3.386 1.00 . A A . 39 GLU C 1 1 20 14785 1 1 39 GLU CA C 9.178 -11.714 -2.759 1.00 . A A . 39 GLU CA 1 1 20 14786 1 1 39 GLU CB C 8.128 -12.213 -3.767 1.00 . A A . 39 GLU CB 1 1 20 14787 1 1 39 GLU CD C 6.034 -13.647 -3.998 1.00 . A A . 39 GLU CD 1 1 20 14788 1 1 39 GLU CG C 7.246 -13.303 -3.136 1.00 . A A . 39 GLU CG 1 1 20 14789 1 1 39 GLU H H 8.466 -11.545 -0.759 1.00 . A A . 39 GLU H 1 1 20 14790 1 1 39 GLU HA H 9.714 -12.584 -2.376 1.00 . A A . 39 GLU HA 1 1 20 14791 1 1 39 GLU HB2 H 7.510 -11.376 -4.095 1.00 . A A . 39 GLU HB2 1 1 20 14792 1 1 39 GLU HB3 H 8.632 -12.633 -4.637 1.00 . A A . 39 GLU HB3 1 1 20 14793 1 1 39 GLU HG2 H 7.840 -14.207 -2.997 1.00 . A A . 39 GLU HG2 1 1 20 14794 1 1 39 GLU HG3 H 6.887 -12.977 -2.161 1.00 . A A . 39 GLU HG3 1 1 20 14795 1 1 39 GLU N N 8.512 -11.049 -1.637 1.00 . A A . 39 GLU N 1 1 20 14796 1 1 39 GLU O O 10.365 -10.691 -4.603 1.00 . A A . 39 GLU O 1 1 20 14797 1 1 39 GLU OE1 O 6.279 -13.919 -5.306 1.00 . A A . 39 GLU OE1 1 1 20 14798 1 1 39 GLU OE2 O 4.917 -13.657 -3.475 1.00 . A A . 39 GLU OE2 1 1 20 14799 1 1 40 ASN C C 11.505 -7.896 -3.611 1.00 . A A . 40 ASN C 1 1 20 14800 1 1 40 ASN CA C 11.995 -9.115 -2.829 1.00 . A A . 40 ASN CA 1 1 20 14801 1 1 40 ASN CB C 13.156 -9.805 -3.533 1.00 . A A . 40 ASN CB 1 1 20 14802 1 1 40 ASN CG C 14.458 -9.016 -3.385 1.00 . A A . 40 ASN CG 1 1 20 14803 1 1 40 ASN H H 10.847 -10.314 -1.552 1.00 . A A . 40 ASN H 1 1 20 14804 1 1 40 ASN HA H 12.347 -8.744 -1.874 1.00 . A A . 40 ASN HA 1 1 20 14805 1 1 40 ASN HB2 H 13.289 -10.797 -3.112 1.00 . A A . 40 ASN HB2 1 1 20 14806 1 1 40 ASN HB3 H 12.856 -9.918 -4.569 1.00 . A A . 40 ASN HB3 1 1 20 14807 1 1 40 ASN HD21 H 14.939 -9.284 -5.343 1.00 . A A . 40 ASN HD21 1 1 20 14808 1 1 40 ASN HD22 H 16.088 -8.371 -4.393 1.00 . A A . 40 ASN HD22 1 1 20 14809 1 1 40 ASN N N 10.964 -10.087 -2.518 1.00 . A A . 40 ASN N 1 1 20 14810 1 1 40 ASN ND2 N 15.224 -8.885 -4.464 1.00 . A A . 40 ASN ND2 1 1 20 14811 1 1 40 ASN O O 12.309 -7.197 -4.222 1.00 . A A . 40 ASN O 1 1 20 14812 1 1 40 ASN OD1 O 14.785 -8.539 -2.296 1.00 . A A . 40 ASN OD1 1 1 20 14813 1 1 41 HIS C C 8.966 -5.622 -3.056 1.00 . A A . 41 HIS C 1 1 20 14814 1 1 41 HIS CA C 9.610 -6.433 -4.172 1.00 . A A . 41 HIS CA 1 1 20 14815 1 1 41 HIS CB C 8.591 -6.865 -5.221 1.00 . A A . 41 HIS CB 1 1 20 14816 1 1 41 HIS CD2 C 9.219 -8.952 -6.633 1.00 . A A . 41 HIS CD2 1 1 20 14817 1 1 41 HIS CE1 C 10.598 -8.004 -8.031 1.00 . A A . 41 HIS CE1 1 1 20 14818 1 1 41 HIS CG C 9.258 -7.614 -6.349 1.00 . A A . 41 HIS CG 1 1 20 14819 1 1 41 HIS H H 9.555 -8.239 -3.112 1.00 . A A . 41 HIS H 1 1 20 14820 1 1 41 HIS HA H 10.370 -5.842 -4.674 1.00 . A A . 41 HIS HA 1 1 20 14821 1 1 41 HIS HB2 H 7.856 -7.507 -4.735 1.00 . A A . 41 HIS HB2 1 1 20 14822 1 1 41 HIS HB3 H 8.061 -5.988 -5.594 1.00 . A A . 41 HIS HB3 1 1 20 14823 1 1 41 HIS HD1 H 10.364 -6.035 -7.311 1.00 . A A . 41 HIS HD1 1 1 20 14824 1 1 41 HIS HD2 H 8.702 -9.699 -6.046 1.00 . A A . 41 HIS HD2 1 1 20 14825 1 1 41 HIS HE1 H 11.323 -7.864 -8.820 1.00 . A A . 41 HIS HE1 1 1 20 14826 1 1 41 HIS N N 10.202 -7.615 -3.578 1.00 . A A . 41 HIS N 1 1 20 14827 1 1 41 HIS ND1 N 10.110 -7.013 -7.264 1.00 . A A . 41 HIS ND1 1 1 20 14828 1 1 41 HIS NE2 N 10.081 -9.195 -7.682 1.00 . A A . 41 HIS NE2 1 1 20 14829 1 1 41 HIS O O 8.093 -6.137 -2.359 1.00 . A A . 41 HIS O 1 1 20 14830 1 1 42 TRP C C 7.439 -3.012 -2.453 1.00 . A A . 42 TRP C 1 1 20 14831 1 1 42 TRP CA C 8.768 -3.497 -1.895 1.00 . A A . 42 TRP CA 1 1 20 14832 1 1 42 TRP CB C 9.712 -2.360 -1.511 1.00 . A A . 42 TRP CB 1 1 20 14833 1 1 42 TRP CD1 C 11.945 -3.334 -0.842 1.00 . A A . 42 TRP CD1 1 1 20 14834 1 1 42 TRP CD2 C 10.738 -2.651 0.916 1.00 . A A . 42 TRP CD2 1 1 20 14835 1 1 42 TRP CE2 C 11.959 -3.173 1.430 1.00 . A A . 42 TRP CE2 1 1 20 14836 1 1 42 TRP CE3 C 9.759 -2.275 1.857 1.00 . A A . 42 TRP CE3 1 1 20 14837 1 1 42 TRP CG C 10.768 -2.755 -0.536 1.00 . A A . 42 TRP CG 1 1 20 14838 1 1 42 TRP CH2 C 11.200 -2.922 3.712 1.00 . A A . 42 TRP CH2 1 1 20 14839 1 1 42 TRP CZ2 C 12.183 -3.339 2.801 1.00 . A A . 42 TRP CZ2 1 1 20 14840 1 1 42 TRP CZ3 C 9.999 -2.366 3.240 1.00 . A A . 42 TRP CZ3 1 1 20 14841 1 1 42 TRP H H 10.060 -3.958 -3.512 1.00 . A A . 42 TRP H 1 1 20 14842 1 1 42 TRP HA H 8.585 -4.038 -0.985 1.00 . A A . 42 TRP HA 1 1 20 14843 1 1 42 TRP HB2 H 10.167 -1.925 -2.394 1.00 . A A . 42 TRP HB2 1 1 20 14844 1 1 42 TRP HB3 H 9.141 -1.583 -1.020 1.00 . A A . 42 TRP HB3 1 1 20 14845 1 1 42 TRP HD1 H 12.238 -3.614 -1.840 1.00 . A A . 42 TRP HD1 1 1 20 14846 1 1 42 TRP HE1 H 13.556 -4.027 0.376 1.00 . A A . 42 TRP HE1 1 1 20 14847 1 1 42 TRP HE3 H 8.793 -1.976 1.501 1.00 . A A . 42 TRP HE3 1 1 20 14848 1 1 42 TRP HH2 H 11.338 -3.062 4.775 1.00 . A A . 42 TRP HH2 1 1 20 14849 1 1 42 TRP HZ2 H 13.055 -3.883 3.130 1.00 . A A . 42 TRP HZ2 1 1 20 14850 1 1 42 TRP HZ3 H 9.242 -2.045 3.940 1.00 . A A . 42 TRP HZ3 1 1 20 14851 1 1 42 TRP N N 9.394 -4.375 -2.866 1.00 . A A . 42 TRP N 1 1 20 14852 1 1 42 TRP NE1 N 12.663 -3.570 0.312 1.00 . A A . 42 TRP NE1 1 1 20 14853 1 1 42 TRP O O 7.441 -2.253 -3.412 1.00 . A A . 42 TRP O 1 1 20 14854 1 1 43 LYS C C 4.464 -2.025 -1.334 1.00 . A A . 43 LYS C 1 1 20 14855 1 1 43 LYS CA C 4.992 -3.003 -2.366 1.00 . A A . 43 LYS CA 1 1 20 14856 1 1 43 LYS CB C 4.001 -4.161 -2.522 1.00 . A A . 43 LYS CB 1 1 20 14857 1 1 43 LYS CD C 5.480 -5.357 -4.247 1.00 . A A . 43 LYS CD 1 1 20 14858 1 1 43 LYS CE C 4.629 -5.139 -5.520 1.00 . A A . 43 LYS CE 1 1 20 14859 1 1 43 LYS CG C 4.710 -5.450 -2.912 1.00 . A A . 43 LYS CG 1 1 20 14860 1 1 43 LYS H H 6.326 -4.147 -1.181 1.00 . A A . 43 LYS H 1 1 20 14861 1 1 43 LYS HA H 5.070 -2.522 -3.336 1.00 . A A . 43 LYS HA 1 1 20 14862 1 1 43 LYS HB2 H 3.508 -4.333 -1.572 1.00 . A A . 43 LYS HB2 1 1 20 14863 1 1 43 LYS HB3 H 3.225 -3.903 -3.237 1.00 . A A . 43 LYS HB3 1 1 20 14864 1 1 43 LYS HD2 H 6.278 -4.618 -4.214 1.00 . A A . 43 LYS HD2 1 1 20 14865 1 1 43 LYS HD3 H 5.951 -6.332 -4.352 1.00 . A A . 43 LYS HD3 1 1 20 14866 1 1 43 LYS HE2 H 5.241 -5.443 -6.371 1.00 . A A . 43 LYS HE2 1 1 20 14867 1 1 43 LYS HE3 H 3.752 -5.788 -5.493 1.00 . A A . 43 LYS HE3 1 1 20 14868 1 1 43 LYS HG2 H 5.307 -5.717 -2.029 1.00 . A A . 43 LYS HG2 1 1 20 14869 1 1 43 LYS HG3 H 4.010 -6.261 -3.019 1.00 . A A . 43 LYS HG3 1 1 20 14870 1 1 43 LYS HZ1 H 4.635 -3.402 -6.649 1.00 . A A . 43 LYS HZ1 1 1 20 14871 1 1 43 LYS HZ2 H 3.177 -3.703 -5.869 1.00 . A A . 43 LYS HZ2 1 1 20 14872 1 1 43 LYS N N 6.300 -3.466 -1.930 1.00 . A A . 43 LYS N 1 1 20 14873 1 1 43 LYS NZ N 4.202 -3.739 -5.777 1.00 . A A . 43 LYS NZ 1 1 20 14874 1 1 43 LYS O O 4.646 -2.231 -0.136 1.00 . A A . 43 LYS O 1 1 20 14875 1 1 44 CYS C C 1.655 -1.044 -0.665 1.00 . A A . 44 CYS C 1 1 20 14876 1 1 44 CYS CA C 2.898 -0.216 -0.950 1.00 . A A . 44 CYS CA 1 1 20 14877 1 1 44 CYS CB C 2.512 1.060 -1.677 1.00 . A A . 44 CYS CB 1 1 20 14878 1 1 44 CYS H H 3.673 -0.875 -2.798 1.00 . A A . 44 CYS H 1 1 20 14879 1 1 44 CYS HA H 3.394 0.042 -0.016 1.00 . A A . 44 CYS HA 1 1 20 14880 1 1 44 CYS HB2 H 3.385 1.704 -1.733 1.00 . A A . 44 CYS HB2 1 1 20 14881 1 1 44 CYS HB3 H 2.173 0.811 -2.672 1.00 . A A . 44 CYS HB3 1 1 20 14882 1 1 44 CYS N N 3.767 -0.997 -1.802 1.00 . A A . 44 CYS N 1 1 20 14883 1 1 44 CYS O O 0.839 -1.227 -1.563 1.00 . A A . 44 CYS O 1 1 20 14884 1 1 44 CYS SG S 1.183 1.958 -0.874 1.00 . A A . 44 CYS SG 1 1 20 14885 1 1 45 PHE C C -0.654 -1.196 1.484 1.00 . A A . 45 PHE C 1 1 20 14886 1 1 45 PHE CA C 0.299 -2.253 0.940 1.00 . A A . 45 PHE CA 1 1 20 14887 1 1 45 PHE CB C 0.597 -3.314 1.997 1.00 . A A . 45 PHE CB 1 1 20 14888 1 1 45 PHE CD1 C 2.348 -4.734 0.830 1.00 . A A . 45 PHE CD1 1 1 20 14889 1 1 45 PHE CD2 C 0.276 -5.787 1.545 1.00 . A A . 45 PHE CD2 1 1 20 14890 1 1 45 PHE CE1 C 2.841 -5.986 0.423 1.00 . A A . 45 PHE CE1 1 1 20 14891 1 1 45 PHE CE2 C 0.752 -7.032 1.099 1.00 . A A . 45 PHE CE2 1 1 20 14892 1 1 45 PHE CG C 1.083 -4.639 1.438 1.00 . A A . 45 PHE CG 1 1 20 14893 1 1 45 PHE CZ C 2.041 -7.134 0.550 1.00 . A A . 45 PHE CZ 1 1 20 14894 1 1 45 PHE H H 2.189 -1.348 1.274 1.00 . A A . 45 PHE H 1 1 20 14895 1 1 45 PHE HA H -0.161 -2.742 0.082 1.00 . A A . 45 PHE HA 1 1 20 14896 1 1 45 PHE HB2 H 1.319 -2.902 2.694 1.00 . A A . 45 PHE HB2 1 1 20 14897 1 1 45 PHE HB3 H -0.309 -3.506 2.565 1.00 . A A . 45 PHE HB3 1 1 20 14898 1 1 45 PHE HD1 H 2.970 -3.857 0.744 1.00 . A A . 45 PHE HD1 1 1 20 14899 1 1 45 PHE HD2 H -0.719 -5.717 1.957 1.00 . A A . 45 PHE HD2 1 1 20 14900 1 1 45 PHE HE1 H 3.844 -6.070 0.029 1.00 . A A . 45 PHE HE1 1 1 20 14901 1 1 45 PHE HE2 H 0.126 -7.909 1.184 1.00 . A A . 45 PHE HE2 1 1 20 14902 1 1 45 PHE HZ H 2.413 -8.095 0.226 1.00 . A A . 45 PHE HZ 1 1 20 14903 1 1 45 PHE N N 1.523 -1.581 0.544 1.00 . A A . 45 PHE N 1 1 20 14904 1 1 45 PHE O O -0.219 -0.277 2.178 1.00 . A A . 45 PHE O 1 1 20 14905 1 1 46 CYS C C -3.835 -1.376 2.638 1.00 . A A . 46 CYS C 1 1 20 14906 1 1 46 CYS CA C -3.025 -0.530 1.681 1.00 . A A . 46 CYS CA 1 1 20 14907 1 1 46 CYS CB C -3.926 -0.077 0.533 1.00 . A A . 46 CYS CB 1 1 20 14908 1 1 46 CYS H H -2.212 -2.205 0.703 1.00 . A A . 46 CYS H 1 1 20 14909 1 1 46 CYS HA H -2.670 0.326 2.264 1.00 . A A . 46 CYS HA 1 1 20 14910 1 1 46 CYS HB2 H -4.331 -0.959 0.040 1.00 . A A . 46 CYS HB2 1 1 20 14911 1 1 46 CYS HB3 H -4.757 0.463 0.974 1.00 . A A . 46 CYS HB3 1 1 20 14912 1 1 46 CYS N N -1.939 -1.353 1.183 1.00 . A A . 46 CYS N 1 1 20 14913 1 1 46 CYS O O -3.855 -2.601 2.544 1.00 . A A . 46 CYS O 1 1 20 14914 1 1 46 CYS SG S -3.230 0.996 -0.749 1.00 . A A . 46 CYS SG 1 1 20 14915 1 1 47 TYR C C -6.488 -0.735 4.854 1.00 . A A . 47 TYR C 1 1 20 14916 1 1 47 TYR CA C -5.097 -1.319 4.737 1.00 . A A . 47 TYR CA 1 1 20 14917 1 1 47 TYR CB C -4.269 -0.926 5.956 1.00 . A A . 47 TYR CB 1 1 20 14918 1 1 47 TYR CD1 C -1.824 -1.179 5.304 1.00 . A A . 47 TYR CD1 1 1 20 14919 1 1 47 TYR CD2 C -2.773 -2.644 7.004 1.00 . A A . 47 TYR CD2 1 1 20 14920 1 1 47 TYR CE1 C -0.557 -1.737 5.538 1.00 . A A . 47 TYR CE1 1 1 20 14921 1 1 47 TYR CE2 C -1.498 -3.155 7.277 1.00 . A A . 47 TYR CE2 1 1 20 14922 1 1 47 TYR CG C -2.925 -1.604 6.071 1.00 . A A . 47 TYR CG 1 1 20 14923 1 1 47 TYR CZ C -0.388 -2.678 6.565 1.00 . A A . 47 TYR CZ 1 1 20 14924 1 1 47 TYR H H -4.381 0.309 3.595 1.00 . A A . 47 TYR H 1 1 20 14925 1 1 47 TYR HA H -5.156 -2.401 4.656 1.00 . A A . 47 TYR HA 1 1 20 14926 1 1 47 TYR HB2 H -4.106 0.143 5.890 1.00 . A A . 47 TYR HB2 1 1 20 14927 1 1 47 TYR HB3 H -4.831 -1.119 6.870 1.00 . A A . 47 TYR HB3 1 1 20 14928 1 1 47 TYR HD1 H -1.936 -0.402 4.565 1.00 . A A . 47 TYR HD1 1 1 20 14929 1 1 47 TYR HD2 H -3.626 -3.022 7.548 1.00 . A A . 47 TYR HD2 1 1 20 14930 1 1 47 TYR HE1 H 0.280 -1.429 4.928 1.00 . A A . 47 TYR HE1 1 1 20 14931 1 1 47 TYR HE2 H -1.381 -3.917 8.035 1.00 . A A . 47 TYR HE2 1 1 20 14932 1 1 47 TYR HH H 0.820 -3.825 7.548 1.00 . A A . 47 TYR HH 1 1 20 14933 1 1 47 TYR N N -4.471 -0.704 3.588 1.00 . A A . 47 TYR N 1 1 20 14934 1 1 47 TYR O O -6.613 0.406 5.284 1.00 . A A . 47 TYR O 1 1 20 14935 1 1 47 TYR OH O 0.855 -3.120 6.893 1.00 . A A . 47 TYR OH 1 1 20 14936 1 1 48 PHE C C -9.525 -1.536 5.819 1.00 . A A . 48 PHE C 1 1 20 14937 1 1 48 PHE CA C -8.884 -1.017 4.530 1.00 . A A . 48 PHE CA 1 1 20 14938 1 1 48 PHE CB C -9.576 -1.605 3.295 1.00 . A A . 48 PHE CB 1 1 20 14939 1 1 48 PHE CD1 C -7.996 -1.118 1.369 1.00 . A A . 48 PHE CD1 1 1 20 14940 1 1 48 PHE CD2 C -10.231 -0.151 1.337 1.00 . A A . 48 PHE CD2 1 1 20 14941 1 1 48 PHE CE1 C -7.742 -0.564 0.104 1.00 . A A . 48 PHE CE1 1 1 20 14942 1 1 48 PHE CE2 C -9.996 0.347 0.047 1.00 . A A . 48 PHE CE2 1 1 20 14943 1 1 48 PHE CG C -9.253 -0.936 1.977 1.00 . A A . 48 PHE CG 1 1 20 14944 1 1 48 PHE CZ C -8.770 0.093 -0.587 1.00 . A A . 48 PHE CZ 1 1 20 14945 1 1 48 PHE H H -7.381 -2.428 4.131 1.00 . A A . 48 PHE H 1 1 20 14946 1 1 48 PHE HA H -8.956 0.069 4.500 1.00 . A A . 48 PHE HA 1 1 20 14947 1 1 48 PHE HB2 H -9.310 -2.653 3.190 1.00 . A A . 48 PHE HB2 1 1 20 14948 1 1 48 PHE HB3 H -10.642 -1.584 3.452 1.00 . A A . 48 PHE HB3 1 1 20 14949 1 1 48 PHE HD1 H -7.222 -1.690 1.860 1.00 . A A . 48 PHE HD1 1 1 20 14950 1 1 48 PHE HD2 H -11.174 0.066 1.824 1.00 . A A . 48 PHE HD2 1 1 20 14951 1 1 48 PHE HE1 H -6.763 -0.643 -0.344 1.00 . A A . 48 PHE HE1 1 1 20 14952 1 1 48 PHE HE2 H -10.756 0.937 -0.449 1.00 . A A . 48 PHE HE2 1 1 20 14953 1 1 48 PHE HZ H -8.621 0.425 -1.600 1.00 . A A . 48 PHE HZ 1 1 20 14954 1 1 48 PHE N N -7.518 -1.483 4.469 1.00 . A A . 48 PHE N 1 1 20 14955 1 1 48 PHE O O -8.905 -2.291 6.562 1.00 . A A . 48 PHE O 1 1 20 14956 1 1 49 ASN C C -11.214 -1.924 8.421 1.00 . A A . 49 ASN C 1 1 20 14957 1 1 49 ASN CA C -11.710 -1.898 6.964 1.00 . A A . 49 ASN CA 1 1 20 14958 1 1 49 ASN CB C -12.031 -3.318 6.452 1.00 . A A . 49 ASN CB 1 1 20 14959 1 1 49 ASN CG C -12.760 -3.341 5.111 1.00 . A A . 49 ASN CG 1 1 20 14960 1 1 49 ASN H H -11.259 -0.638 5.335 1.00 . A A . 49 ASN H 1 1 20 14961 1 1 49 ASN HA H -12.633 -1.320 6.981 1.00 . A A . 49 ASN HA 1 1 20 14962 1 1 49 ASN HB2 H -11.106 -3.886 6.338 1.00 . A A . 49 ASN HB2 1 1 20 14963 1 1 49 ASN HB3 H -12.659 -3.839 7.174 1.00 . A A . 49 ASN HB3 1 1 20 14964 1 1 49 ASN HD21 H -13.117 -5.342 5.261 1.00 . A A . 49 ASN HD21 1 1 20 14965 1 1 49 ASN HD22 H -13.726 -4.550 3.819 1.00 . A A . 49 ASN HD22 1 1 20 14966 1 1 49 ASN N N -10.811 -1.236 6.017 1.00 . A A . 49 ASN N 1 1 20 14967 1 1 49 ASN ND2 N -13.225 -4.517 4.693 1.00 . A A . 49 ASN ND2 1 1 20 14968 1 1 49 ASN O O -11.746 -2.679 9.234 1.00 . A A . 49 ASN O 1 1 20 14969 1 1 49 ASN OD1 O -12.895 -2.326 4.436 1.00 . A A . 49 ASN OD1 1 1 20 14970 1 1 50 CYS C C -10.090 -1.018 11.263 1.00 . A A . 50 CYS C 1 1 20 14971 1 1 50 CYS CA C -9.390 -1.382 9.960 1.00 . A A . 50 CYS CA 1 1 20 14972 1 1 50 CYS CB C -8.023 -0.739 9.792 1.00 . A A . 50 CYS CB 1 1 20 14973 1 1 50 CYS H H -9.849 -0.471 8.089 1.00 . A A . 50 CYS H 1 1 20 14974 1 1 50 CYS HA H -9.203 -2.437 10.023 1.00 . A A . 50 CYS HA 1 1 20 14975 1 1 50 CYS HB2 H -7.593 -1.102 8.860 1.00 . A A . 50 CYS HB2 1 1 20 14976 1 1 50 CYS HB3 H -8.186 0.327 9.717 1.00 . A A . 50 CYS HB3 1 1 20 14977 1 1 50 CYS N N -10.207 -1.122 8.777 1.00 . A A . 50 CYS N 1 1 20 14978 1 1 50 CYS O O -10.532 -1.960 11.990 1.00 . A A . 50 CYS O 1 1 20 14979 1 1 50 CYS OXT O -10.228 0.195 11.612 1.00 . A A . 50 CYS OXT 1 1 20 14980 1 1 50 CYS SG S -6.770 -1.006 11.068 1.00 . A A . 50 CYS SG 1 1 21 14981 1 1 1 LEU C C -8.928 -5.153 9.236 1.00 . A A . 1 LEU C 1 1 21 14982 1 1 1 LEU CA C -9.793 -5.833 10.299 1.00 . A A . 1 LEU CA 1 1 21 14983 1 1 1 LEU CB C -10.226 -7.225 9.808 1.00 . A A . 1 LEU CB 1 1 21 14984 1 1 1 LEU CD1 C -11.710 -7.784 11.833 1.00 . A A . 1 LEU CD1 1 1 21 14985 1 1 1 LEU CD2 C -10.899 -9.580 10.300 1.00 . A A . 1 LEU CD2 1 1 21 14986 1 1 1 LEU CG C -10.552 -8.226 10.931 1.00 . A A . 1 LEU CG 1 1 21 14987 1 1 1 LEU H1 H -10.638 -4.068 10.950 1.00 . A A . 1 LEU H1 1 1 21 14988 1 1 1 LEU H2 H -11.514 -4.843 9.741 1.00 . A A . 1 LEU H2 1 1 21 14989 1 1 1 LEU H3 H -11.544 -5.437 11.314 1.00 . A A . 1 LEU H3 1 1 21 14990 1 1 1 LEU HA H -9.205 -5.964 11.210 1.00 . A A . 1 LEU HA 1 1 21 14991 1 1 1 LEU HB2 H -11.075 -7.129 9.130 1.00 . A A . 1 LEU HB2 1 1 21 14992 1 1 1 LEU HB3 H -9.395 -7.653 9.243 1.00 . A A . 1 LEU HB3 1 1 21 14993 1 1 1 LEU HD11 H -12.581 -7.523 11.231 1.00 . A A . 1 LEU HD11 1 1 21 14994 1 1 1 LEU HD12 H -11.980 -8.601 12.503 1.00 . A A . 1 LEU HD12 1 1 21 14995 1 1 1 LEU HD13 H -11.413 -6.937 12.450 1.00 . A A . 1 LEU HD13 1 1 21 14996 1 1 1 LEU HD21 H -10.071 -9.927 9.681 1.00 . A A . 1 LEU HD21 1 1 21 14997 1 1 1 LEU HD22 H -11.082 -10.318 11.082 1.00 . A A . 1 LEU HD22 1 1 21 14998 1 1 1 LEU HD23 H -11.793 -9.487 9.681 1.00 . A A . 1 LEU HD23 1 1 21 14999 1 1 1 LEU HG H -9.665 -8.364 11.553 1.00 . A A . 1 LEU HG 1 1 21 15000 1 1 1 LEU N N -10.960 -4.981 10.599 1.00 . A A . 1 LEU N 1 1 21 15001 1 1 1 LEU O O -9.341 -5.074 8.083 1.00 . A A . 1 LEU O 1 1 21 15002 1 1 2 CYS C C -6.163 -4.646 7.735 1.00 . A A . 2 CYS C 1 1 21 15003 1 1 2 CYS CA C -6.896 -3.794 8.778 1.00 . A A . 2 CYS CA 1 1 21 15004 1 1 2 CYS CB C -5.959 -2.960 9.677 1.00 . A A . 2 CYS CB 1 1 21 15005 1 1 2 CYS H H -7.483 -4.719 10.577 1.00 . A A . 2 CYS H 1 1 21 15006 1 1 2 CYS HA H -7.518 -3.087 8.237 1.00 . A A . 2 CYS HA 1 1 21 15007 1 1 2 CYS HB2 H -5.106 -3.575 9.960 1.00 . A A . 2 CYS HB2 1 1 21 15008 1 1 2 CYS HB3 H -5.597 -2.100 9.118 1.00 . A A . 2 CYS HB3 1 1 21 15009 1 1 2 CYS N N -7.759 -4.629 9.613 1.00 . A A . 2 CYS N 1 1 21 15010 1 1 2 CYS O O -4.938 -4.744 7.720 1.00 . A A . 2 CYS O 1 1 21 15011 1 1 2 CYS SG S -6.669 -2.364 11.240 1.00 . A A . 2 CYS SG 1 1 21 15012 1 1 3 ASN C C -5.724 -6.271 4.894 1.00 . A A . 3 ASN C 1 1 21 15013 1 1 3 ASN CA C -6.482 -6.530 6.192 1.00 . A A . 3 ASN CA 1 1 21 15014 1 1 3 ASN CB C -7.658 -7.498 5.976 1.00 . A A . 3 ASN CB 1 1 21 15015 1 1 3 ASN CG C -8.746 -6.968 5.049 1.00 . A A . 3 ASN CG 1 1 21 15016 1 1 3 ASN H H -7.905 -5.054 6.809 1.00 . A A . 3 ASN H 1 1 21 15017 1 1 3 ASN HA H -5.786 -7.047 6.855 1.00 . A A . 3 ASN HA 1 1 21 15018 1 1 3 ASN HB2 H -7.269 -8.422 5.543 1.00 . A A . 3 ASN HB2 1 1 21 15019 1 1 3 ASN HB3 H -8.106 -7.731 6.938 1.00 . A A . 3 ASN HB3 1 1 21 15020 1 1 3 ASN HD21 H -9.720 -8.745 5.071 1.00 . A A . 3 ASN HD21 1 1 21 15021 1 1 3 ASN HD22 H -10.505 -7.484 4.156 1.00 . A A . 3 ASN HD22 1 1 21 15022 1 1 3 ASN N N -6.921 -5.303 6.856 1.00 . A A . 3 ASN N 1 1 21 15023 1 1 3 ASN ND2 N -9.732 -7.799 4.723 1.00 . A A . 3 ASN ND2 1 1 21 15024 1 1 3 ASN O O -6.046 -6.864 3.867 1.00 . A A . 3 ASN O 1 1 21 15025 1 1 3 ASN OD1 O -8.749 -5.804 4.649 1.00 . A A . 3 ASN OD1 1 1 21 15026 1 1 4 GLU C C -3.607 -6.101 2.826 1.00 . A A . 4 GLU C 1 1 21 15027 1 1 4 GLU CA C -3.458 -5.545 4.246 1.00 . A A . 4 GLU CA 1 1 21 15028 1 1 4 GLU CB C -2.458 -6.350 5.096 1.00 . A A . 4 GLU CB 1 1 21 15029 1 1 4 GLU CD C -0.284 -7.333 4.028 1.00 . A A . 4 GLU CD 1 1 21 15030 1 1 4 GLU CG C -1.032 -6.109 4.569 1.00 . A A . 4 GLU CG 1 1 21 15031 1 1 4 GLU H H -4.628 -4.913 5.837 1.00 . A A . 4 GLU H 1 1 21 15032 1 1 4 GLU HA H -3.081 -4.522 4.164 1.00 . A A . 4 GLU HA 1 1 21 15033 1 1 4 GLU HB2 H -2.502 -5.975 6.120 1.00 . A A . 4 GLU HB2 1 1 21 15034 1 1 4 GLU HB3 H -2.723 -7.408 5.119 1.00 . A A . 4 GLU HB3 1 1 21 15035 1 1 4 GLU HG2 H -1.077 -5.338 3.798 1.00 . A A . 4 GLU HG2 1 1 21 15036 1 1 4 GLU HG3 H -0.439 -5.726 5.398 1.00 . A A . 4 GLU HG3 1 1 21 15037 1 1 4 GLU N N -4.725 -5.387 4.944 1.00 . A A . 4 GLU N 1 1 21 15038 1 1 4 GLU O O -3.380 -7.290 2.616 1.00 . A A . 4 GLU O 1 1 21 15039 1 1 4 GLU OE1 O -1.004 -8.315 3.421 1.00 . A A . 4 GLU OE1 1 1 21 15040 1 1 4 GLU OE2 O 0.943 -7.371 4.154 1.00 . A A . 4 GLU OE2 1 1 21 15041 1 1 5 ARG C C -3.173 -4.888 -0.440 1.00 . A A . 5 ARG C 1 1 21 15042 1 1 5 ARG CA C -4.145 -5.635 0.466 1.00 . A A . 5 ARG CA 1 1 21 15043 1 1 5 ARG CB C -5.616 -5.420 0.101 1.00 . A A . 5 ARG CB 1 1 21 15044 1 1 5 ARG CD C -7.823 -6.663 0.000 1.00 . A A . 5 ARG CD 1 1 21 15045 1 1 5 ARG CG C -6.310 -6.779 0.218 1.00 . A A . 5 ARG CG 1 1 21 15046 1 1 5 ARG CZ C -9.709 -5.548 1.223 1.00 . A A . 5 ARG CZ 1 1 21 15047 1 1 5 ARG H H -3.912 -4.269 2.077 1.00 . A A . 5 ARG H 1 1 21 15048 1 1 5 ARG HA H -3.903 -6.690 0.349 1.00 . A A . 5 ARG HA 1 1 21 15049 1 1 5 ARG HB2 H -6.071 -4.701 0.781 1.00 . A A . 5 ARG HB2 1 1 21 15050 1 1 5 ARG HB3 H -5.714 -5.048 -0.920 1.00 . A A . 5 ARG HB3 1 1 21 15051 1 1 5 ARG HD2 H -7.993 -6.050 -0.884 1.00 . A A . 5 ARG HD2 1 1 21 15052 1 1 5 ARG HD3 H -8.220 -7.665 -0.181 1.00 . A A . 5 ARG HD3 1 1 21 15053 1 1 5 ARG HG2 H -5.880 -7.435 -0.541 1.00 . A A . 5 ARG HG2 1 1 21 15054 1 1 5 ARG HG3 H -6.084 -7.205 1.198 1.00 . A A . 5 ARG HG3 1 1 21 15055 1 1 5 ARG HH11 H -10.051 -5.715 -0.776 1.00 . A A . 5 ARG HH11 1 1 21 15056 1 1 5 ARG HH12 H -11.329 -4.947 0.116 1.00 . A A . 5 ARG HH12 1 1 21 15057 1 1 5 ARG HH21 H -9.641 -5.270 3.226 1.00 . A A . 5 ARG HH21 1 1 21 15058 1 1 5 ARG HH22 H -11.118 -4.721 2.531 1.00 . A A . 5 ARG HH22 1 1 21 15059 1 1 5 ARG N N -3.926 -5.254 1.855 1.00 . A A . 5 ARG N 1 1 21 15060 1 1 5 ARG NE N -8.488 -6.109 1.191 1.00 . A A . 5 ARG NE 1 1 21 15061 1 1 5 ARG NH1 N -10.424 -5.394 0.104 1.00 . A A . 5 ARG NH1 1 1 21 15062 1 1 5 ARG NH2 N -10.207 -5.153 2.396 1.00 . A A . 5 ARG NH2 1 1 21 15063 1 1 5 ARG O O -2.635 -3.858 -0.034 1.00 . A A . 5 ARG O 1 1 21 15064 1 1 6 PRO C C -1.584 -3.778 -2.938 1.00 . A A . 6 PRO C 1 1 21 15065 1 1 6 PRO CA C -1.606 -5.162 -2.281 1.00 . A A . 6 PRO CA 1 1 21 15066 1 1 6 PRO CB C -1.402 -6.293 -3.297 1.00 . A A . 6 PRO CB 1 1 21 15067 1 1 6 PRO CD C -3.489 -6.616 -2.220 1.00 . A A . 6 PRO CD 1 1 21 15068 1 1 6 PRO CG C -2.827 -6.760 -3.589 1.00 . A A . 6 PRO CG 1 1 21 15069 1 1 6 PRO HA H -0.837 -5.223 -1.515 1.00 . A A . 6 PRO HA 1 1 21 15070 1 1 6 PRO HB2 H -0.887 -5.977 -4.206 1.00 . A A . 6 PRO HB2 1 1 21 15071 1 1 6 PRO HB3 H -0.851 -7.106 -2.823 1.00 . A A . 6 PRO HB3 1 1 21 15072 1 1 6 PRO HD2 H -4.566 -6.486 -2.332 1.00 . A A . 6 PRO HD2 1 1 21 15073 1 1 6 PRO HD3 H -3.275 -7.511 -1.636 1.00 . A A . 6 PRO HD3 1 1 21 15074 1 1 6 PRO HG2 H -3.297 -6.077 -4.299 1.00 . A A . 6 PRO HG2 1 1 21 15075 1 1 6 PRO HG3 H -2.864 -7.782 -3.965 1.00 . A A . 6 PRO HG3 1 1 21 15076 1 1 6 PRO N N -2.856 -5.456 -1.613 1.00 . A A . 6 PRO N 1 1 21 15077 1 1 6 PRO O O -2.581 -3.056 -2.955 1.00 . A A . 6 PRO O 1 1 21 15078 1 1 7 SER C C -1.133 -2.203 -5.512 1.00 . A A . 7 SER C 1 1 21 15079 1 1 7 SER CA C -0.244 -2.215 -4.276 1.00 . A A . 7 SER CA 1 1 21 15080 1 1 7 SER CB C 1.219 -2.106 -4.707 1.00 . A A . 7 SER CB 1 1 21 15081 1 1 7 SER H H 0.366 -4.047 -3.426 1.00 . A A . 7 SER H 1 1 21 15082 1 1 7 SER HA H -0.500 -1.346 -3.671 1.00 . A A . 7 SER HA 1 1 21 15083 1 1 7 SER HB2 H 1.267 -1.277 -5.412 1.00 . A A . 7 SER HB2 1 1 21 15084 1 1 7 SER HB3 H 1.854 -1.890 -3.850 1.00 . A A . 7 SER HB3 1 1 21 15085 1 1 7 SER HG H 0.919 -3.534 -5.962 1.00 . A A . 7 SER HG 1 1 21 15086 1 1 7 SER N N -0.429 -3.431 -3.509 1.00 . A A . 7 SER N 1 1 21 15087 1 1 7 SER O O -0.804 -2.844 -6.510 1.00 . A A . 7 SER O 1 1 21 15088 1 1 7 SER OG O 1.630 -3.310 -5.338 1.00 . A A . 7 SER OG 1 1 21 15089 1 1 8 GLN C C -2.579 0.105 -7.259 1.00 . A A . 8 GLN C 1 1 21 15090 1 1 8 GLN CA C -3.110 -1.130 -6.528 1.00 . A A . 8 GLN CA 1 1 21 15091 1 1 8 GLN CB C -4.496 -0.913 -5.906 1.00 . A A . 8 GLN CB 1 1 21 15092 1 1 8 GLN CD C -5.771 -1.795 -3.941 1.00 . A A . 8 GLN CD 1 1 21 15093 1 1 8 GLN CG C -4.990 -2.175 -5.191 1.00 . A A . 8 GLN CG 1 1 21 15094 1 1 8 GLN H H -2.440 -1.035 -4.543 1.00 . A A . 8 GLN H 1 1 21 15095 1 1 8 GLN HA H -3.155 -1.968 -7.226 1.00 . A A . 8 GLN HA 1 1 21 15096 1 1 8 GLN HB2 H -4.436 -0.116 -5.164 1.00 . A A . 8 GLN HB2 1 1 21 15097 1 1 8 GLN HB3 H -5.215 -0.623 -6.675 1.00 . A A . 8 GLN HB3 1 1 21 15098 1 1 8 GLN HE21 H -4.199 -2.284 -2.739 1.00 . A A . 8 GLN HE21 1 1 21 15099 1 1 8 GLN HE22 H -5.611 -1.598 -1.937 1.00 . A A . 8 GLN HE22 1 1 21 15100 1 1 8 GLN HG2 H -5.621 -2.725 -5.877 1.00 . A A . 8 GLN HG2 1 1 21 15101 1 1 8 GLN HG3 H -4.175 -2.840 -4.912 1.00 . A A . 8 GLN HG3 1 1 21 15102 1 1 8 GLN N N -2.203 -1.418 -5.442 1.00 . A A . 8 GLN N 1 1 21 15103 1 1 8 GLN NE2 N -5.148 -1.910 -2.772 1.00 . A A . 8 GLN NE2 1 1 21 15104 1 1 8 GLN O O -1.705 -0.004 -8.117 1.00 . A A . 8 GLN O 1 1 21 15105 1 1 8 GLN OE1 O -6.910 -1.343 -4.028 1.00 . A A . 8 GLN OE1 1 1 21 15106 1 1 9 THR C C -1.372 3.073 -7.267 1.00 . A A . 9 THR C 1 1 21 15107 1 1 9 THR CA C -2.785 2.559 -7.520 1.00 . A A . 9 THR CA 1 1 21 15108 1 1 9 THR CB C -3.801 3.566 -6.977 1.00 . A A . 9 THR CB 1 1 21 15109 1 1 9 THR CG2 C -5.149 3.409 -7.679 1.00 . A A . 9 THR CG2 1 1 21 15110 1 1 9 THR H H -3.673 1.366 -6.076 1.00 . A A . 9 THR H 1 1 21 15111 1 1 9 THR HA H -2.910 2.456 -8.599 1.00 . A A . 9 THR HA 1 1 21 15112 1 1 9 THR HB H -3.415 4.572 -7.149 1.00 . A A . 9 THR HB 1 1 21 15113 1 1 9 THR HG1 H -4.678 3.920 -5.272 1.00 . A A . 9 THR HG1 1 1 21 15114 1 1 9 THR HG21 H -5.537 2.403 -7.522 1.00 . A A . 9 THR HG21 1 1 21 15115 1 1 9 THR HG22 H -5.867 4.128 -7.284 1.00 . A A . 9 THR HG22 1 1 21 15116 1 1 9 THR HG23 H -5.028 3.587 -8.748 1.00 . A A . 9 THR HG23 1 1 21 15117 1 1 9 THR N N -3.045 1.289 -6.864 1.00 . A A . 9 THR N 1 1 21 15118 1 1 9 THR O O -0.972 4.077 -7.847 1.00 . A A . 9 THR O 1 1 21 15119 1 1 9 THR OG1 O -3.996 3.324 -5.594 1.00 . A A . 9 THR OG1 1 1 21 15120 1 1 10 TRP C C 1.464 2.159 -7.631 1.00 . A A . 10 TRP C 1 1 21 15121 1 1 10 TRP CA C 0.822 2.689 -6.340 1.00 . A A . 10 TRP CA 1 1 21 15122 1 1 10 TRP CB C 1.444 2.041 -5.099 1.00 . A A . 10 TRP CB 1 1 21 15123 1 1 10 TRP CD1 C 3.900 1.725 -5.640 1.00 . A A . 10 TRP CD1 1 1 21 15124 1 1 10 TRP CD2 C 3.533 3.406 -4.206 1.00 . A A . 10 TRP CD2 1 1 21 15125 1 1 10 TRP CE2 C 4.897 3.486 -4.596 1.00 . A A . 10 TRP CE2 1 1 21 15126 1 1 10 TRP CE3 C 3.083 4.337 -3.250 1.00 . A A . 10 TRP CE3 1 1 21 15127 1 1 10 TRP CG C 2.900 2.348 -4.976 1.00 . A A . 10 TRP CG 1 1 21 15128 1 1 10 TRP CH2 C 5.243 5.455 -3.240 1.00 . A A . 10 TRP CH2 1 1 21 15129 1 1 10 TRP CZ2 C 5.747 4.499 -4.134 1.00 . A A . 10 TRP CZ2 1 1 21 15130 1 1 10 TRP CZ3 C 3.921 5.358 -2.782 1.00 . A A . 10 TRP CZ3 1 1 21 15131 1 1 10 TRP H H -0.990 1.658 -5.864 1.00 . A A . 10 TRP H 1 1 21 15132 1 1 10 TRP HA H 0.988 3.770 -6.290 1.00 . A A . 10 TRP HA 1 1 21 15133 1 1 10 TRP HB2 H 0.940 2.430 -4.213 1.00 . A A . 10 TRP HB2 1 1 21 15134 1 1 10 TRP HB3 H 1.302 0.963 -5.133 1.00 . A A . 10 TRP HB3 1 1 21 15135 1 1 10 TRP HD1 H 3.761 0.905 -6.331 1.00 . A A . 10 TRP HD1 1 1 21 15136 1 1 10 TRP HE1 H 5.983 2.172 -5.831 1.00 . A A . 10 TRP HE1 1 1 21 15137 1 1 10 TRP HE3 H 2.083 4.251 -2.864 1.00 . A A . 10 TRP HE3 1 1 21 15138 1 1 10 TRP HH2 H 5.846 6.279 -2.919 1.00 . A A . 10 TRP HH2 1 1 21 15139 1 1 10 TRP HZ2 H 6.755 4.574 -4.514 1.00 . A A . 10 TRP HZ2 1 1 21 15140 1 1 10 TRP HZ3 H 3.540 6.097 -2.097 1.00 . A A . 10 TRP HZ3 1 1 21 15141 1 1 10 TRP N N -0.606 2.434 -6.381 1.00 . A A . 10 TRP N 1 1 21 15142 1 1 10 TRP NE1 N 5.081 2.403 -5.428 1.00 . A A . 10 TRP NE1 1 1 21 15143 1 1 10 TRP O O 2.375 2.779 -8.173 1.00 . A A . 10 TRP O 1 1 21 15144 1 1 11 SER C C 2.839 0.341 -9.664 1.00 . A A . 11 SER C 1 1 21 15145 1 1 11 SER CA C 1.332 0.450 -9.410 1.00 . A A . 11 SER CA 1 1 21 15146 1 1 11 SER CB C 0.629 1.271 -10.499 1.00 . A A . 11 SER CB 1 1 21 15147 1 1 11 SER H H 0.165 0.607 -7.673 1.00 . A A . 11 SER H 1 1 21 15148 1 1 11 SER HA H 0.936 -0.564 -9.428 1.00 . A A . 11 SER HA 1 1 21 15149 1 1 11 SER HB2 H 1.131 2.233 -10.618 1.00 . A A . 11 SER HB2 1 1 21 15150 1 1 11 SER HB3 H 0.685 0.734 -11.449 1.00 . A A . 11 SER HB3 1 1 21 15151 1 1 11 SER HG H -1.061 0.762 -9.641 1.00 . A A . 11 SER HG 1 1 21 15152 1 1 11 SER N N 0.990 1.001 -8.107 1.00 . A A . 11 SER N 1 1 21 15153 1 1 11 SER O O 3.330 0.811 -10.686 1.00 . A A . 11 SER O 1 1 21 15154 1 1 11 SER OG O -0.726 1.505 -10.157 1.00 . A A . 11 SER OG 1 1 21 15155 1 1 12 GLY C C 5.657 -1.082 -7.691 1.00 . A A . 12 GLY C 1 1 21 15156 1 1 12 GLY CA C 5.003 -0.528 -8.953 1.00 . A A . 12 GLY CA 1 1 21 15157 1 1 12 GLY H H 3.143 -0.709 -7.942 1.00 . A A . 12 GLY H 1 1 21 15158 1 1 12 GLY HA2 H 5.167 -1.226 -9.775 1.00 . A A . 12 GLY HA2 1 1 21 15159 1 1 12 GLY HA3 H 5.469 0.428 -9.203 1.00 . A A . 12 GLY HA3 1 1 21 15160 1 1 12 GLY N N 3.576 -0.325 -8.768 1.00 . A A . 12 GLY N 1 1 21 15161 1 1 12 GLY O O 4.996 -1.744 -6.879 1.00 . A A . 12 GLY O 1 1 21 15162 1 1 13 ASN C C 7.623 0.251 -5.463 1.00 . A A . 13 ASN C 1 1 21 15163 1 1 13 ASN CA C 7.688 -1.030 -6.292 1.00 . A A . 13 ASN CA 1 1 21 15164 1 1 13 ASN CB C 9.141 -1.419 -6.594 1.00 . A A . 13 ASN CB 1 1 21 15165 1 1 13 ASN CG C 9.915 -1.847 -5.342 1.00 . A A . 13 ASN CG 1 1 21 15166 1 1 13 ASN H H 7.401 -0.210 -8.213 1.00 . A A . 13 ASN H 1 1 21 15167 1 1 13 ASN HA H 7.218 -1.855 -5.760 1.00 . A A . 13 ASN HA 1 1 21 15168 1 1 13 ASN HB2 H 9.138 -2.260 -7.289 1.00 . A A . 13 ASN HB2 1 1 21 15169 1 1 13 ASN HB3 H 9.656 -0.583 -7.067 1.00 . A A . 13 ASN HB3 1 1 21 15170 1 1 13 ASN HD21 H 10.253 0.099 -4.709 1.00 . A A . 13 ASN HD21 1 1 21 15171 1 1 13 ASN HD22 H 10.990 -1.171 -3.774 1.00 . A A . 13 ASN HD22 1 1 21 15172 1 1 13 ASN N N 6.953 -0.801 -7.527 1.00 . A A . 13 ASN N 1 1 21 15173 1 1 13 ASN ND2 N 10.421 -0.898 -4.559 1.00 . A A . 13 ASN ND2 1 1 21 15174 1 1 13 ASN O O 7.561 1.342 -6.026 1.00 . A A . 13 ASN O 1 1 21 15175 1 1 13 ASN OD1 O 10.075 -3.040 -5.082 1.00 . A A . 13 ASN OD1 1 1 21 15176 1 1 14 CYS C C 8.764 2.180 -3.436 1.00 . A A . 14 CYS C 1 1 21 15177 1 1 14 CYS CA C 7.593 1.227 -3.192 1.00 . A A . 14 CYS CA 1 1 21 15178 1 1 14 CYS CB C 7.689 0.664 -1.779 1.00 . A A . 14 CYS CB 1 1 21 15179 1 1 14 CYS H H 7.708 -0.808 -3.762 1.00 . A A . 14 CYS H 1 1 21 15180 1 1 14 CYS HA H 6.650 1.761 -3.286 1.00 . A A . 14 CYS HA 1 1 21 15181 1 1 14 CYS HB2 H 6.873 -0.040 -1.620 1.00 . A A . 14 CYS HB2 1 1 21 15182 1 1 14 CYS HB3 H 8.641 0.144 -1.706 1.00 . A A . 14 CYS HB3 1 1 21 15183 1 1 14 CYS N N 7.608 0.123 -4.138 1.00 . A A . 14 CYS N 1 1 21 15184 1 1 14 CYS O O 9.807 1.767 -3.946 1.00 . A A . 14 CYS O 1 1 21 15185 1 1 14 CYS SG S 7.660 1.898 -0.456 1.00 . A A . 14 CYS SG 1 1 21 15186 1 1 15 GLY C C 9.751 5.008 -1.612 1.00 . A A . 15 GLY C 1 1 21 15187 1 1 15 GLY CA C 9.576 4.489 -3.035 1.00 . A A . 15 GLY CA 1 1 21 15188 1 1 15 GLY H H 7.679 3.644 -2.621 1.00 . A A . 15 GLY H 1 1 21 15189 1 1 15 GLY HA2 H 10.534 4.121 -3.391 1.00 . A A . 15 GLY HA2 1 1 21 15190 1 1 15 GLY HA3 H 9.250 5.307 -3.679 1.00 . A A . 15 GLY HA3 1 1 21 15191 1 1 15 GLY N N 8.571 3.439 -3.042 1.00 . A A . 15 GLY N 1 1 21 15192 1 1 15 GLY O O 10.862 5.076 -1.095 1.00 . A A . 15 GLY O 1 1 21 15193 1 1 16 ASN C C 7.251 5.423 1.053 1.00 . A A . 16 ASN C 1 1 21 15194 1 1 16 ASN CA C 8.597 5.782 0.424 1.00 . A A . 16 ASN CA 1 1 21 15195 1 1 16 ASN CB C 8.878 7.287 0.535 1.00 . A A . 16 ASN CB 1 1 21 15196 1 1 16 ASN CG C 9.183 7.703 1.974 1.00 . A A . 16 ASN CG 1 1 21 15197 1 1 16 ASN H H 7.757 5.271 -1.456 1.00 . A A . 16 ASN H 1 1 21 15198 1 1 16 ASN HA H 9.386 5.250 0.961 1.00 . A A . 16 ASN HA 1 1 21 15199 1 1 16 ASN HB2 H 9.752 7.522 -0.076 1.00 . A A . 16 ASN HB2 1 1 21 15200 1 1 16 ASN HB3 H 8.028 7.858 0.161 1.00 . A A . 16 ASN HB3 1 1 21 15201 1 1 16 ASN HD21 H 10.293 9.301 1.367 1.00 . A A . 16 ASN HD21 1 1 21 15202 1 1 16 ASN HD22 H 10.146 9.073 3.099 1.00 . A A . 16 ASN HD22 1 1 21 15203 1 1 16 ASN N N 8.633 5.357 -0.968 1.00 . A A . 16 ASN N 1 1 21 15204 1 1 16 ASN ND2 N 9.921 8.793 2.156 1.00 . A A . 16 ASN ND2 1 1 21 15205 1 1 16 ASN O O 6.198 5.817 0.544 1.00 . A A . 16 ASN O 1 1 21 15206 1 1 16 ASN OD1 O 8.739 7.063 2.923 1.00 . A A . 16 ASN OD1 1 1 21 15207 1 1 17 THR C C 5.306 5.603 3.345 1.00 . A A . 17 THR C 1 1 21 15208 1 1 17 THR CA C 6.092 4.345 2.935 1.00 . A A . 17 THR CA 1 1 21 15209 1 1 17 THR CB C 6.483 3.431 4.110 1.00 . A A . 17 THR CB 1 1 21 15210 1 1 17 THR CG2 C 7.090 4.190 5.295 1.00 . A A . 17 THR CG2 1 1 21 15211 1 1 17 THR H H 8.186 4.470 2.569 1.00 . A A . 17 THR H 1 1 21 15212 1 1 17 THR HA H 5.479 3.753 2.268 1.00 . A A . 17 THR HA 1 1 21 15213 1 1 17 THR HB H 7.236 2.730 3.745 1.00 . A A . 17 THR HB 1 1 21 15214 1 1 17 THR HG1 H 5.593 2.283 5.403 1.00 . A A . 17 THR HG1 1 1 21 15215 1 1 17 THR HG21 H 7.922 4.810 4.958 1.00 . A A . 17 THR HG21 1 1 21 15216 1 1 17 THR HG22 H 6.340 4.821 5.773 1.00 . A A . 17 THR HG22 1 1 21 15217 1 1 17 THR HG23 H 7.467 3.479 6.032 1.00 . A A . 17 THR HG23 1 1 21 15218 1 1 17 THR N N 7.284 4.706 2.179 1.00 . A A . 17 THR N 1 1 21 15219 1 1 17 THR O O 4.073 5.620 3.347 1.00 . A A . 17 THR O 1 1 21 15220 1 1 17 THR OG1 O 5.381 2.655 4.542 1.00 . A A . 17 THR OG1 1 1 21 15221 1 1 18 ALA C C 4.630 8.559 2.786 1.00 . A A . 18 ALA C 1 1 21 15222 1 1 18 ALA CA C 5.430 7.980 3.952 1.00 . A A . 18 ALA CA 1 1 21 15223 1 1 18 ALA CB C 6.515 8.957 4.412 1.00 . A A . 18 ALA CB 1 1 21 15224 1 1 18 ALA H H 7.039 6.644 3.575 1.00 . A A . 18 ALA H 1 1 21 15225 1 1 18 ALA HA H 4.728 7.831 4.774 1.00 . A A . 18 ALA HA 1 1 21 15226 1 1 18 ALA HB1 H 7.086 8.520 5.233 1.00 . A A . 18 ALA HB1 1 1 21 15227 1 1 18 ALA HB2 H 7.189 9.187 3.586 1.00 . A A . 18 ALA HB2 1 1 21 15228 1 1 18 ALA HB3 H 6.053 9.882 4.756 1.00 . A A . 18 ALA HB3 1 1 21 15229 1 1 18 ALA N N 6.026 6.695 3.625 1.00 . A A . 18 ALA N 1 1 21 15230 1 1 18 ALA O O 3.748 9.387 3.027 1.00 . A A . 18 ALA O 1 1 21 15231 1 1 19 HIS C C 2.916 7.297 0.448 1.00 . A A . 19 HIS C 1 1 21 15232 1 1 19 HIS CA C 3.977 8.396 0.444 1.00 . A A . 19 HIS CA 1 1 21 15233 1 1 19 HIS CB C 4.681 8.505 -0.915 1.00 . A A . 19 HIS CB 1 1 21 15234 1 1 19 HIS CD2 C 2.442 9.246 -2.065 1.00 . A A . 19 HIS CD2 1 1 21 15235 1 1 19 HIS CE1 C 2.986 8.755 -4.126 1.00 . A A . 19 HIS CE1 1 1 21 15236 1 1 19 HIS CG C 3.740 8.787 -2.072 1.00 . A A . 19 HIS CG 1 1 21 15237 1 1 19 HIS H H 5.614 7.439 1.399 1.00 . A A . 19 HIS H 1 1 21 15238 1 1 19 HIS HA H 3.480 9.353 0.610 1.00 . A A . 19 HIS HA 1 1 21 15239 1 1 19 HIS HB2 H 5.415 9.304 -0.874 1.00 . A A . 19 HIS HB2 1 1 21 15240 1 1 19 HIS HB3 H 5.215 7.575 -1.103 1.00 . A A . 19 HIS HB3 1 1 21 15241 1 1 19 HIS HD1 H 4.996 8.261 -3.747 1.00 . A A . 19 HIS HD1 1 1 21 15242 1 1 19 HIS HD2 H 1.862 9.505 -1.184 1.00 . A A . 19 HIS HD2 1 1 21 15243 1 1 19 HIS HE1 H 2.919 8.592 -5.194 1.00 . A A . 19 HIS HE1 1 1 21 15244 1 1 19 HIS N N 4.901 8.147 1.539 1.00 . A A . 19 HIS N 1 1 21 15245 1 1 19 HIS ND1 N 4.097 8.568 -3.395 1.00 . A A . 19 HIS ND1 1 1 21 15246 1 1 19 HIS NE2 N 1.957 9.149 -3.360 1.00 . A A . 19 HIS NE2 1 1 21 15247 1 1 19 HIS O O 1.738 7.626 0.401 1.00 . A A . 19 HIS O 1 1 21 15248 1 1 20 CYS C C 1.122 5.075 1.237 1.00 . A A . 20 CYS C 1 1 21 15249 1 1 20 CYS CA C 2.388 4.876 0.416 1.00 . A A . 20 CYS CA 1 1 21 15250 1 1 20 CYS CB C 3.052 3.599 0.911 1.00 . A A . 20 CYS CB 1 1 21 15251 1 1 20 CYS H H 4.308 5.824 0.543 1.00 . A A . 20 CYS H 1 1 21 15252 1 1 20 CYS HA H 2.094 4.743 -0.622 1.00 . A A . 20 CYS HA 1 1 21 15253 1 1 20 CYS HB2 H 3.894 3.358 0.269 1.00 . A A . 20 CYS HB2 1 1 21 15254 1 1 20 CYS HB3 H 3.391 3.740 1.929 1.00 . A A . 20 CYS HB3 1 1 21 15255 1 1 20 CYS N N 3.311 6.018 0.494 1.00 . A A . 20 CYS N 1 1 21 15256 1 1 20 CYS O O 0.004 4.878 0.753 1.00 . A A . 20 CYS O 1 1 21 15257 1 1 20 CYS SG S 1.915 2.203 1.008 1.00 . A A . 20 CYS SG 1 1 21 15258 1 1 21 ASP C C -0.757 6.715 2.838 1.00 . A A . 21 ASP C 1 1 21 15259 1 1 21 ASP CA C 0.216 5.684 3.402 1.00 . A A . 21 ASP CA 1 1 21 15260 1 1 21 ASP CB C 0.782 6.179 4.742 1.00 . A A . 21 ASP CB 1 1 21 15261 1 1 21 ASP CG C -0.322 6.569 5.718 1.00 . A A . 21 ASP CG 1 1 21 15262 1 1 21 ASP H H 2.272 5.640 2.806 1.00 . A A . 21 ASP H 1 1 21 15263 1 1 21 ASP HA H -0.286 4.718 3.510 1.00 . A A . 21 ASP HA 1 1 21 15264 1 1 21 ASP HB2 H 1.396 5.392 5.185 1.00 . A A . 21 ASP HB2 1 1 21 15265 1 1 21 ASP HB3 H 1.410 7.054 4.578 1.00 . A A . 21 ASP HB3 1 1 21 15266 1 1 21 ASP N N 1.316 5.526 2.474 1.00 . A A . 21 ASP N 1 1 21 15267 1 1 21 ASP O O -1.965 6.507 2.896 1.00 . A A . 21 ASP O 1 1 21 15268 1 1 21 ASP OD1 O -0.947 7.757 5.485 1.00 . A A . 21 ASP OD1 1 1 21 15269 1 1 21 ASP OD2 O -0.586 5.807 6.646 1.00 . A A . 21 ASP OD2 1 1 21 15270 1 1 22 LYS C C -1.708 8.276 0.409 1.00 . A A . 22 LYS C 1 1 21 15271 1 1 22 LYS CA C -1.057 8.835 1.667 1.00 . A A . 22 LYS CA 1 1 21 15272 1 1 22 LYS CB C -0.271 10.103 1.316 1.00 . A A . 22 LYS CB 1 1 21 15273 1 1 22 LYS CD C 1.268 11.889 2.212 1.00 . A A . 22 LYS CD 1 1 21 15274 1 1 22 LYS CE C 1.892 12.505 3.474 1.00 . A A . 22 LYS CE 1 1 21 15275 1 1 22 LYS CG C 0.574 10.551 2.498 1.00 . A A . 22 LYS CG 1 1 21 15276 1 1 22 LYS H H 0.769 7.830 2.123 1.00 . A A . 22 LYS H 1 1 21 15277 1 1 22 LYS HA H -1.804 9.135 2.395 1.00 . A A . 22 LYS HA 1 1 21 15278 1 1 22 LYS HB2 H 0.372 9.927 0.457 1.00 . A A . 22 LYS HB2 1 1 21 15279 1 1 22 LYS HB3 H -0.983 10.890 1.067 1.00 . A A . 22 LYS HB3 1 1 21 15280 1 1 22 LYS HD2 H 2.037 11.735 1.451 1.00 . A A . 22 LYS HD2 1 1 21 15281 1 1 22 LYS HD3 H 0.539 12.598 1.815 1.00 . A A . 22 LYS HD3 1 1 21 15282 1 1 22 LYS HE2 H 2.513 13.352 3.172 1.00 . A A . 22 LYS HE2 1 1 21 15283 1 1 22 LYS HE3 H 1.098 12.879 4.122 1.00 . A A . 22 LYS HE3 1 1 21 15284 1 1 22 LYS HG2 H -0.065 10.619 3.381 1.00 . A A . 22 LYS HG2 1 1 21 15285 1 1 22 LYS HG3 H 1.307 9.763 2.614 1.00 . A A . 22 LYS HG3 1 1 21 15286 1 1 22 LYS HZ1 H 2.391 10.584 4.033 1.00 . A A . 22 LYS HZ1 1 1 21 15287 1 1 22 LYS HZ2 H 3.701 11.635 3.949 1.00 . A A . 22 LYS HZ2 1 1 21 15288 1 1 22 LYS N N -0.232 7.812 2.285 1.00 . A A . 22 LYS N 1 1 21 15289 1 1 22 LYS NZ N 2.714 11.542 4.231 1.00 . A A . 22 LYS NZ 1 1 21 15290 1 1 22 LYS O O -2.890 8.484 0.181 1.00 . A A . 22 LYS O 1 1 21 15291 1 1 23 GLN C C -2.585 6.394 -1.717 1.00 . A A . 23 GLN C 1 1 21 15292 1 1 23 GLN CA C -1.283 7.209 -1.782 1.00 . A A . 23 GLN CA 1 1 21 15293 1 1 23 GLN CB C -0.111 6.405 -2.379 1.00 . A A . 23 GLN CB 1 1 21 15294 1 1 23 GLN CD C -0.316 6.696 -4.889 1.00 . A A . 23 GLN CD 1 1 21 15295 1 1 23 GLN CG C -0.384 5.713 -3.723 1.00 . A A . 23 GLN CG 1 1 21 15296 1 1 23 GLN H H 0.027 7.417 -0.117 1.00 . A A . 23 GLN H 1 1 21 15297 1 1 23 GLN HA H -1.446 8.108 -2.374 1.00 . A A . 23 GLN HA 1 1 21 15298 1 1 23 GLN HB2 H 0.787 7.014 -2.439 1.00 . A A . 23 GLN HB2 1 1 21 15299 1 1 23 GLN HB3 H 0.101 5.594 -1.684 1.00 . A A . 23 GLN HB3 1 1 21 15300 1 1 23 GLN HE21 H -0.634 5.213 -6.292 1.00 . A A . 23 GLN HE21 1 1 21 15301 1 1 23 GLN HE22 H -0.377 6.789 -6.917 1.00 . A A . 23 GLN HE22 1 1 21 15302 1 1 23 GLN HG2 H 0.407 4.989 -3.905 1.00 . A A . 23 GLN HG2 1 1 21 15303 1 1 23 GLN HG3 H -1.331 5.181 -3.719 1.00 . A A . 23 GLN HG3 1 1 21 15304 1 1 23 GLN N N -0.925 7.582 -0.421 1.00 . A A . 23 GLN N 1 1 21 15305 1 1 23 GLN NE2 N -0.456 6.195 -6.111 1.00 . A A . 23 GLN NE2 1 1 21 15306 1 1 23 GLN O O -3.527 6.647 -2.469 1.00 . A A . 23 GLN O 1 1 21 15307 1 1 23 GLN OE1 O -0.085 7.891 -4.695 1.00 . A A . 23 GLN OE1 1 1 21 15308 1 1 24 CYS C C -5.039 5.325 -0.013 1.00 . A A . 24 CYS C 1 1 21 15309 1 1 24 CYS CA C -3.793 4.581 -0.519 1.00 . A A . 24 CYS CA 1 1 21 15310 1 1 24 CYS CB C -3.397 3.507 0.500 1.00 . A A . 24 CYS CB 1 1 21 15311 1 1 24 CYS H H -1.813 5.309 -0.199 1.00 . A A . 24 CYS H 1 1 21 15312 1 1 24 CYS HA H -4.063 4.093 -1.458 1.00 . A A . 24 CYS HA 1 1 21 15313 1 1 24 CYS HB2 H -2.932 3.988 1.358 1.00 . A A . 24 CYS HB2 1 1 21 15314 1 1 24 CYS HB3 H -4.293 2.990 0.843 1.00 . A A . 24 CYS HB3 1 1 21 15315 1 1 24 CYS N N -2.643 5.453 -0.768 1.00 . A A . 24 CYS N 1 1 21 15316 1 1 24 CYS O O -6.124 4.740 0.008 1.00 . A A . 24 CYS O 1 1 21 15317 1 1 24 CYS SG S -2.277 2.228 -0.117 1.00 . A A . 24 CYS SG 1 1 21 15318 1 1 25 GLN C C -6.317 8.451 -0.316 1.00 . A A . 25 GLN C 1 1 21 15319 1 1 25 GLN CA C -5.982 7.466 0.825 1.00 . A A . 25 GLN CA 1 1 21 15320 1 1 25 GLN CB C -5.576 8.216 2.107 1.00 . A A . 25 GLN CB 1 1 21 15321 1 1 25 GLN CD C -4.711 7.954 4.504 1.00 . A A . 25 GLN CD 1 1 21 15322 1 1 25 GLN CG C -5.249 7.247 3.257 1.00 . A A . 25 GLN CG 1 1 21 15323 1 1 25 GLN H H -3.962 6.982 0.422 1.00 . A A . 25 GLN H 1 1 21 15324 1 1 25 GLN HA H -6.860 6.870 1.079 1.00 . A A . 25 GLN HA 1 1 21 15325 1 1 25 GLN HB2 H -4.707 8.844 1.912 1.00 . A A . 25 GLN HB2 1 1 21 15326 1 1 25 GLN HB3 H -6.405 8.861 2.404 1.00 . A A . 25 GLN HB3 1 1 21 15327 1 1 25 GLN HE21 H -6.304 9.216 4.559 1.00 . A A . 25 GLN HE21 1 1 21 15328 1 1 25 GLN HE22 H -5.108 9.430 5.823 1.00 . A A . 25 GLN HE22 1 1 21 15329 1 1 25 GLN HG2 H -6.147 6.690 3.529 1.00 . A A . 25 GLN HG2 1 1 21 15330 1 1 25 GLN HG3 H -4.493 6.541 2.925 1.00 . A A . 25 GLN HG3 1 1 21 15331 1 1 25 GLN N N -4.893 6.584 0.414 1.00 . A A . 25 GLN N 1 1 21 15332 1 1 25 GLN NE2 N -5.426 8.963 4.989 1.00 . A A . 25 GLN NE2 1 1 21 15333 1 1 25 GLN O O -7.475 8.816 -0.541 1.00 . A A . 25 GLN O 1 1 21 15334 1 1 25 GLN OE1 O -3.658 7.605 5.038 1.00 . A A . 25 GLN OE1 1 1 21 15335 1 1 26 ASP C C -6.030 9.306 -3.314 1.00 . A A . 26 ASP C 1 1 21 15336 1 1 26 ASP CA C -5.345 9.898 -2.092 1.00 . A A . 26 ASP CA 1 1 21 15337 1 1 26 ASP CB C -3.944 10.390 -2.483 1.00 . A A . 26 ASP CB 1 1 21 15338 1 1 26 ASP CG C -3.190 11.116 -1.377 1.00 . A A . 26 ASP CG 1 1 21 15339 1 1 26 ASP H H -4.372 8.533 -0.799 1.00 . A A . 26 ASP H 1 1 21 15340 1 1 26 ASP HA H -5.919 10.755 -1.751 1.00 . A A . 26 ASP HA 1 1 21 15341 1 1 26 ASP HB2 H -3.342 9.551 -2.812 1.00 . A A . 26 ASP HB2 1 1 21 15342 1 1 26 ASP HB3 H -4.046 11.075 -3.325 1.00 . A A . 26 ASP HB3 1 1 21 15343 1 1 26 ASP N N -5.282 8.899 -1.035 1.00 . A A . 26 ASP N 1 1 21 15344 1 1 26 ASP O O -7.044 9.829 -3.773 1.00 . A A . 26 ASP O 1 1 21 15345 1 1 26 ASP OD1 O -3.930 11.882 -0.531 1.00 . A A . 26 ASP OD1 1 1 21 15346 1 1 26 ASP OD2 O -1.969 10.989 -1.305 1.00 . A A . 26 ASP OD2 1 1 21 15347 1 1 27 TRP C C -7.094 6.625 -4.588 1.00 . A A . 27 TRP C 1 1 21 15348 1 1 27 TRP CA C -5.976 7.561 -5.032 1.00 . A A . 27 TRP CA 1 1 21 15349 1 1 27 TRP CB C -4.854 6.765 -5.707 1.00 . A A . 27 TRP CB 1 1 21 15350 1 1 27 TRP CD1 C -3.070 8.542 -5.892 1.00 . A A . 27 TRP CD1 1 1 21 15351 1 1 27 TRP CD2 C -3.313 7.378 -7.773 1.00 . A A . 27 TRP CD2 1 1 21 15352 1 1 27 TRP CE2 C -2.213 8.262 -7.977 1.00 . A A . 27 TRP CE2 1 1 21 15353 1 1 27 TRP CE3 C -3.649 6.511 -8.825 1.00 . A A . 27 TRP CE3 1 1 21 15354 1 1 27 TRP CG C -3.807 7.548 -6.422 1.00 . A A . 27 TRP CG 1 1 21 15355 1 1 27 TRP CH2 C -1.773 7.310 -10.159 1.00 . A A . 27 TRP CH2 1 1 21 15356 1 1 27 TRP CZ2 C -1.467 8.257 -9.166 1.00 . A A . 27 TRP CZ2 1 1 21 15357 1 1 27 TRP CZ3 C -2.850 6.424 -9.973 1.00 . A A . 27 TRP CZ3 1 1 21 15358 1 1 27 TRP H H -4.669 7.808 -3.362 1.00 . A A . 27 TRP H 1 1 21 15359 1 1 27 TRP HA H -6.372 8.291 -5.740 1.00 . A A . 27 TRP HA 1 1 21 15360 1 1 27 TRP HB2 H -4.339 6.110 -5.009 1.00 . A A . 27 TRP HB2 1 1 21 15361 1 1 27 TRP HB3 H -5.333 6.127 -6.443 1.00 . A A . 27 TRP HB3 1 1 21 15362 1 1 27 TRP HD1 H -3.160 8.880 -4.881 1.00 . A A . 27 TRP HD1 1 1 21 15363 1 1 27 TRP HE1 H -1.443 9.690 -6.601 1.00 . A A . 27 TRP HE1 1 1 21 15364 1 1 27 TRP HE3 H -4.500 5.863 -8.694 1.00 . A A . 27 TRP HE3 1 1 21 15365 1 1 27 TRP HH2 H -1.176 7.244 -11.054 1.00 . A A . 27 TRP HH2 1 1 21 15366 1 1 27 TRP HZ2 H -0.640 8.939 -9.299 1.00 . A A . 27 TRP HZ2 1 1 21 15367 1 1 27 TRP HZ3 H -3.050 5.633 -10.678 1.00 . A A . 27 TRP HZ3 1 1 21 15368 1 1 27 TRP N N -5.471 8.215 -3.836 1.00 . A A . 27 TRP N 1 1 21 15369 1 1 27 TRP NE1 N -2.130 8.980 -6.799 1.00 . A A . 27 TRP NE1 1 1 21 15370 1 1 27 TRP O O -8.275 6.902 -4.795 1.00 . A A . 27 TRP O 1 1 21 15371 1 1 28 GLU C C -8.263 5.320 -2.054 1.00 . A A . 28 GLU C 1 1 21 15372 1 1 28 GLU CA C -7.628 4.620 -3.265 1.00 . A A . 28 GLU CA 1 1 21 15373 1 1 28 GLU CB C -6.839 3.340 -2.890 1.00 . A A . 28 GLU CB 1 1 21 15374 1 1 28 GLU CD C -8.627 1.552 -3.283 1.00 . A A . 28 GLU CD 1 1 21 15375 1 1 28 GLU CG C -7.262 2.101 -3.694 1.00 . A A . 28 GLU CG 1 1 21 15376 1 1 28 GLU H H -5.735 5.525 -3.602 1.00 . A A . 28 GLU H 1 1 21 15377 1 1 28 GLU HA H -8.422 4.379 -3.971 1.00 . A A . 28 GLU HA 1 1 21 15378 1 1 28 GLU HB2 H -5.777 3.492 -3.078 1.00 . A A . 28 GLU HB2 1 1 21 15379 1 1 28 GLU HB3 H -6.931 3.104 -1.829 1.00 . A A . 28 GLU HB3 1 1 21 15380 1 1 28 GLU HG2 H -7.271 2.338 -4.760 1.00 . A A . 28 GLU HG2 1 1 21 15381 1 1 28 GLU HG3 H -6.521 1.320 -3.521 1.00 . A A . 28 GLU HG3 1 1 21 15382 1 1 28 GLU N N -6.705 5.566 -3.873 1.00 . A A . 28 GLU N 1 1 21 15383 1 1 28 GLU O O -8.119 6.528 -1.894 1.00 . A A . 28 GLU O 1 1 21 15384 1 1 28 GLU OE1 O -9.308 2.180 -2.475 1.00 . A A . 28 GLU OE1 1 1 21 15385 1 1 28 GLU OE2 O -9.002 0.368 -3.837 1.00 . A A . 28 GLU OE2 1 1 21 15386 1 1 29 LYS C C -9.715 3.796 0.901 1.00 . A A . 29 LYS C 1 1 21 15387 1 1 29 LYS CA C -9.588 5.028 0.019 1.00 . A A . 29 LYS CA 1 1 21 15388 1 1 29 LYS CB C -10.958 5.675 -0.265 1.00 . A A . 29 LYS CB 1 1 21 15389 1 1 29 LYS CD C -11.153 7.318 -2.208 1.00 . A A . 29 LYS CD 1 1 21 15390 1 1 29 LYS CE C -10.646 8.674 -2.713 1.00 . A A . 29 LYS CE 1 1 21 15391 1 1 29 LYS CG C -10.871 7.144 -0.708 1.00 . A A . 29 LYS CG 1 1 21 15392 1 1 29 LYS H H -8.971 3.584 -1.333 1.00 . A A . 29 LYS H 1 1 21 15393 1 1 29 LYS HA H -8.917 5.708 0.518 1.00 . A A . 29 LYS HA 1 1 21 15394 1 1 29 LYS HB2 H -11.525 5.078 -0.979 1.00 . A A . 29 LYS HB2 1 1 21 15395 1 1 29 LYS HB3 H -11.509 5.680 0.675 1.00 . A A . 29 LYS HB3 1 1 21 15396 1 1 29 LYS HD2 H -10.686 6.516 -2.781 1.00 . A A . 29 LYS HD2 1 1 21 15397 1 1 29 LYS HD3 H -12.232 7.252 -2.364 1.00 . A A . 29 LYS HD3 1 1 21 15398 1 1 29 LYS HE2 H -11.044 8.849 -3.713 1.00 . A A . 29 LYS HE2 1 1 21 15399 1 1 29 LYS HE3 H -10.992 9.475 -2.054 1.00 . A A . 29 LYS HE3 1 1 21 15400 1 1 29 LYS HG2 H -11.625 7.714 -0.163 1.00 . A A . 29 LYS HG2 1 1 21 15401 1 1 29 LYS HG3 H -9.899 7.545 -0.422 1.00 . A A . 29 LYS HG3 1 1 21 15402 1 1 29 LYS HZ1 H -8.836 7.766 -3.101 1.00 . A A . 29 LYS HZ1 1 1 21 15403 1 1 29 LYS HZ2 H -8.874 9.406 -3.470 1.00 . A A . 29 LYS HZ2 1 1 21 15404 1 1 29 LYS N N -8.908 4.573 -1.170 1.00 . A A . 29 LYS N 1 1 21 15405 1 1 29 LYS NZ N -9.173 8.689 -2.794 1.00 . A A . 29 LYS NZ 1 1 21 15406 1 1 29 LYS O O -10.789 3.383 1.334 1.00 . A A . 29 LYS O 1 1 21 15407 1 1 30 ALA C C -8.186 3.235 3.551 1.00 . A A . 30 ALA C 1 1 21 15408 1 1 30 ALA CA C -8.337 2.359 2.305 1.00 . A A . 30 ALA CA 1 1 21 15409 1 1 30 ALA CB C -7.095 1.521 2.010 1.00 . A A . 30 ALA CB 1 1 21 15410 1 1 30 ALA H H -7.713 3.694 0.794 1.00 . A A . 30 ALA H 1 1 21 15411 1 1 30 ALA HA H -9.198 1.700 2.422 1.00 . A A . 30 ALA HA 1 1 21 15412 1 1 30 ALA HB1 H -7.172 1.116 1.002 1.00 . A A . 30 ALA HB1 1 1 21 15413 1 1 30 ALA HB2 H -6.203 2.142 2.086 1.00 . A A . 30 ALA HB2 1 1 21 15414 1 1 30 ALA HB3 H -7.029 0.692 2.702 1.00 . A A . 30 ALA HB3 1 1 21 15415 1 1 30 ALA N N -8.538 3.240 1.179 1.00 . A A . 30 ALA N 1 1 21 15416 1 1 30 ALA O O -8.055 4.454 3.438 1.00 . A A . 30 ALA O 1 1 21 15417 1 1 31 SER C C -6.613 4.070 5.929 1.00 . A A . 31 SER C 1 1 21 15418 1 1 31 SER CA C -7.961 3.351 5.980 1.00 . A A . 31 SER CA 1 1 21 15419 1 1 31 SER CB C -8.038 2.332 7.114 1.00 . A A . 31 SER CB 1 1 21 15420 1 1 31 SER H H -8.178 1.638 4.859 1.00 . A A . 31 SER H 1 1 21 15421 1 1 31 SER HA H -8.752 4.080 6.127 1.00 . A A . 31 SER HA 1 1 21 15422 1 1 31 SER HB2 H -7.149 1.712 7.119 1.00 . A A . 31 SER HB2 1 1 21 15423 1 1 31 SER HB3 H -8.060 2.873 8.049 1.00 . A A . 31 SER HB3 1 1 21 15424 1 1 31 SER HG H -9.950 2.104 6.825 1.00 . A A . 31 SER HG 1 1 21 15425 1 1 31 SER N N -8.188 2.641 4.746 1.00 . A A . 31 SER N 1 1 21 15426 1 1 31 SER O O -6.515 5.225 6.329 1.00 . A A . 31 SER O 1 1 21 15427 1 1 31 SER OG O -9.196 1.523 6.969 1.00 . A A . 31 SER OG 1 1 21 15428 1 1 32 HIS C C -3.472 3.031 4.237 1.00 . A A . 32 HIS C 1 1 21 15429 1 1 32 HIS CA C -4.301 4.008 5.082 1.00 . A A . 32 HIS CA 1 1 21 15430 1 1 32 HIS CB C -3.555 4.461 6.354 1.00 . A A . 32 HIS CB 1 1 21 15431 1 1 32 HIS CD2 C -3.322 2.142 7.419 1.00 . A A . 32 HIS CD2 1 1 21 15432 1 1 32 HIS CE1 C -1.230 2.201 8.000 1.00 . A A . 32 HIS CE1 1 1 21 15433 1 1 32 HIS CG C -2.834 3.366 7.091 1.00 . A A . 32 HIS CG 1 1 21 15434 1 1 32 HIS H H -5.743 2.456 5.051 1.00 . A A . 32 HIS H 1 1 21 15435 1 1 32 HIS HA H -4.516 4.880 4.460 1.00 . A A . 32 HIS HA 1 1 21 15436 1 1 32 HIS HB2 H -2.814 5.161 6.031 1.00 . A A . 32 HIS HB2 1 1 21 15437 1 1 32 HIS HB3 H -4.210 4.990 7.044 1.00 . A A . 32 HIS HB3 1 1 21 15438 1 1 32 HIS HD1 H -0.867 4.191 7.361 1.00 . A A . 32 HIS HD1 1 1 21 15439 1 1 32 HIS HD2 H -4.306 1.841 7.130 1.00 . A A . 32 HIS HD2 1 1 21 15440 1 1 32 HIS HE1 H -0.259 1.901 8.365 1.00 . A A . 32 HIS HE1 1 1 21 15441 1 1 32 HIS N N -5.579 3.392 5.413 1.00 . A A . 32 HIS N 1 1 21 15442 1 1 32 HIS ND1 N -1.511 3.416 7.498 1.00 . A A . 32 HIS ND1 1 1 21 15443 1 1 32 HIS NE2 N -2.305 1.397 7.980 1.00 . A A . 32 HIS NE2 1 1 21 15444 1 1 32 HIS O O -4.031 2.079 3.688 1.00 . A A . 32 HIS O 1 1 21 15445 1 1 33 GLY C C 0.101 2.184 4.331 1.00 . A A . 33 GLY C 1 1 21 15446 1 1 33 GLY CA C -1.196 2.337 3.542 1.00 . A A . 33 GLY CA 1 1 21 15447 1 1 33 GLY H H -1.753 4.005 4.694 1.00 . A A . 33 GLY H 1 1 21 15448 1 1 33 GLY HA2 H -1.636 1.369 3.479 1.00 . A A . 33 GLY HA2 1 1 21 15449 1 1 33 GLY HA3 H -0.966 2.664 2.535 1.00 . A A . 33 GLY HA3 1 1 21 15450 1 1 33 GLY N N -2.150 3.229 4.187 1.00 . A A . 33 GLY N 1 1 21 15451 1 1 33 GLY O O 0.321 2.920 5.294 1.00 . A A . 33 GLY O 1 1 21 15452 1 1 34 ALA C C 3.041 0.019 3.533 1.00 . A A . 34 ALA C 1 1 21 15453 1 1 34 ALA CA C 2.273 0.975 4.466 1.00 . A A . 34 ALA CA 1 1 21 15454 1 1 34 ALA CB C 2.141 0.395 5.879 1.00 . A A . 34 ALA CB 1 1 21 15455 1 1 34 ALA H H 0.648 0.635 3.147 1.00 . A A . 34 ALA H 1 1 21 15456 1 1 34 ALA HA H 2.806 1.926 4.523 1.00 . A A . 34 ALA HA 1 1 21 15457 1 1 34 ALA HB1 H 1.537 -0.510 5.857 1.00 . A A . 34 ALA HB1 1 1 21 15458 1 1 34 ALA HB2 H 3.126 0.165 6.281 1.00 . A A . 34 ALA HB2 1 1 21 15459 1 1 34 ALA HB3 H 1.657 1.119 6.540 1.00 . A A . 34 ALA HB3 1 1 21 15460 1 1 34 ALA N N 0.942 1.224 3.925 1.00 . A A . 34 ALA N 1 1 21 15461 1 1 34 ALA O O 2.468 -0.961 3.052 1.00 . A A . 34 ALA O 1 1 21 15462 1 1 35 CYS C C 5.655 -1.786 3.014 1.00 . A A . 35 CYS C 1 1 21 15463 1 1 35 CYS CA C 5.133 -0.513 2.344 1.00 . A A . 35 CYS CA 1 1 21 15464 1 1 35 CYS CB C 6.305 0.306 1.808 1.00 . A A . 35 CYS CB 1 1 21 15465 1 1 35 CYS H H 4.776 1.115 3.633 1.00 . A A . 35 CYS H 1 1 21 15466 1 1 35 CYS HA H 4.521 -0.781 1.492 1.00 . A A . 35 CYS HA 1 1 21 15467 1 1 35 CYS HB2 H 6.828 0.798 2.625 1.00 . A A . 35 CYS HB2 1 1 21 15468 1 1 35 CYS HB3 H 6.999 -0.386 1.357 1.00 . A A . 35 CYS HB3 1 1 21 15469 1 1 35 CYS N N 4.324 0.291 3.251 1.00 . A A . 35 CYS N 1 1 21 15470 1 1 35 CYS O O 5.954 -1.775 4.209 1.00 . A A . 35 CYS O 1 1 21 15471 1 1 35 CYS SG S 5.873 1.506 0.529 1.00 . A A . 35 CYS SG 1 1 21 15472 1 1 36 HIS C C 7.115 -4.851 1.611 1.00 . A A . 36 HIS C 1 1 21 15473 1 1 36 HIS CA C 6.377 -4.141 2.733 1.00 . A A . 36 HIS CA 1 1 21 15474 1 1 36 HIS CB C 5.333 -5.148 3.205 1.00 . A A . 36 HIS CB 1 1 21 15475 1 1 36 HIS CD2 C 2.856 -4.794 3.688 1.00 . A A . 36 HIS CD2 1 1 21 15476 1 1 36 HIS CE1 C 3.036 -3.396 5.361 1.00 . A A . 36 HIS CE1 1 1 21 15477 1 1 36 HIS CG C 4.173 -4.568 3.938 1.00 . A A . 36 HIS CG 1 1 21 15478 1 1 36 HIS H H 5.475 -2.856 1.289 1.00 . A A . 36 HIS H 1 1 21 15479 1 1 36 HIS HA H 7.043 -3.941 3.568 1.00 . A A . 36 HIS HA 1 1 21 15480 1 1 36 HIS HB2 H 4.923 -5.661 2.333 1.00 . A A . 36 HIS HB2 1 1 21 15481 1 1 36 HIS HB3 H 5.821 -5.890 3.838 1.00 . A A . 36 HIS HB3 1 1 21 15482 1 1 36 HIS HD1 H 5.135 -3.167 5.253 1.00 . A A . 36 HIS HD1 1 1 21 15483 1 1 36 HIS HD2 H 2.520 -5.403 2.857 1.00 . A A . 36 HIS HD2 1 1 21 15484 1 1 36 HIS HE1 H 2.784 -2.702 6.150 1.00 . A A . 36 HIS HE1 1 1 21 15485 1 1 36 HIS N N 5.771 -2.893 2.263 1.00 . A A . 36 HIS N 1 1 21 15486 1 1 36 HIS ND1 N 4.288 -3.662 4.974 1.00 . A A . 36 HIS ND1 1 1 21 15487 1 1 36 HIS NE2 N 2.143 -4.099 4.644 1.00 . A A . 36 HIS NE2 1 1 21 15488 1 1 36 HIS O O 6.631 -4.848 0.481 1.00 . A A . 36 HIS O 1 1 21 15489 1 1 37 LYS C C 8.113 -7.819 0.998 1.00 . A A . 37 LYS C 1 1 21 15490 1 1 37 LYS CA C 8.842 -6.479 1.018 1.00 . A A . 37 LYS CA 1 1 21 15491 1 1 37 LYS CB C 10.312 -6.640 1.403 1.00 . A A . 37 LYS CB 1 1 21 15492 1 1 37 LYS CD C 12.509 -7.849 0.821 1.00 . A A . 37 LYS CD 1 1 21 15493 1 1 37 LYS CE C 13.634 -6.868 0.457 1.00 . A A . 37 LYS CE 1 1 21 15494 1 1 37 LYS CG C 11.128 -7.370 0.332 1.00 . A A . 37 LYS CG 1 1 21 15495 1 1 37 LYS H H 8.509 -5.566 2.903 1.00 . A A . 37 LYS H 1 1 21 15496 1 1 37 LYS HA H 8.842 -6.047 0.030 1.00 . A A . 37 LYS HA 1 1 21 15497 1 1 37 LYS HB2 H 10.723 -5.658 1.494 1.00 . A A . 37 LYS HB2 1 1 21 15498 1 1 37 LYS HB3 H 10.379 -7.118 2.374 1.00 . A A . 37 LYS HB3 1 1 21 15499 1 1 37 LYS HD2 H 12.487 -8.002 1.904 1.00 . A A . 37 LYS HD2 1 1 21 15500 1 1 37 LYS HD3 H 12.709 -8.824 0.379 1.00 . A A . 37 LYS HD3 1 1 21 15501 1 1 37 LYS HE2 H 13.384 -6.317 -0.451 1.00 . A A . 37 LYS HE2 1 1 21 15502 1 1 37 LYS HE3 H 13.738 -6.170 1.285 1.00 . A A . 37 LYS HE3 1 1 21 15503 1 1 37 LYS HG2 H 10.564 -8.243 0.053 1.00 . A A . 37 LYS HG2 1 1 21 15504 1 1 37 LYS HG3 H 11.196 -6.753 -0.566 1.00 . A A . 37 LYS HG3 1 1 21 15505 1 1 37 LYS HZ1 H 14.779 -8.548 0.087 1.00 . A A . 37 LYS HZ1 1 1 21 15506 1 1 37 LYS HZ2 H 15.365 -7.149 -0.638 1.00 . A A . 37 LYS HZ2 1 1 21 15507 1 1 37 LYS N N 8.180 -5.582 1.949 1.00 . A A . 37 LYS N 1 1 21 15508 1 1 37 LYS NZ N 14.932 -7.538 0.211 1.00 . A A . 37 LYS NZ 1 1 21 15509 1 1 37 LYS O O 7.812 -8.389 2.048 1.00 . A A . 37 LYS O 1 1 21 15510 1 1 38 ARG C C 8.172 -10.122 -1.750 1.00 . A A . 38 ARG C 1 1 21 15511 1 1 38 ARG CA C 7.471 -9.707 -0.460 1.00 . A A . 38 ARG CA 1 1 21 15512 1 1 38 ARG CB C 5.966 -9.930 -0.614 1.00 . A A . 38 ARG CB 1 1 21 15513 1 1 38 ARG CD C 4.715 -8.494 1.031 1.00 . A A . 38 ARG CD 1 1 21 15514 1 1 38 ARG CG C 5.187 -9.912 0.708 1.00 . A A . 38 ARG CG 1 1 21 15515 1 1 38 ARG CZ C 4.323 -8.561 3.502 1.00 . A A . 38 ARG CZ 1 1 21 15516 1 1 38 ARG H H 8.030 -7.742 -1.021 1.00 . A A . 38 ARG H 1 1 21 15517 1 1 38 ARG HA H 7.827 -10.324 0.364 1.00 . A A . 38 ARG HA 1 1 21 15518 1 1 38 ARG HB2 H 5.565 -9.212 -1.331 1.00 . A A . 38 ARG HB2 1 1 21 15519 1 1 38 ARG HB3 H 5.848 -10.930 -1.033 1.00 . A A . 38 ARG HB3 1 1 21 15520 1 1 38 ARG HD2 H 5.556 -7.813 1.110 1.00 . A A . 38 ARG HD2 1 1 21 15521 1 1 38 ARG HD3 H 4.126 -8.188 0.175 1.00 . A A . 38 ARG HD3 1 1 21 15522 1 1 38 ARG HG2 H 4.302 -10.539 0.587 1.00 . A A . 38 ARG HG2 1 1 21 15523 1 1 38 ARG HG3 H 5.797 -10.333 1.507 1.00 . A A . 38 ARG HG3 1 1 21 15524 1 1 38 ARG HH11 H 6.298 -8.763 2.972 1.00 . A A . 38 ARG HH11 1 1 21 15525 1 1 38 ARG HH12 H 5.981 -8.912 4.671 1.00 . A A . 38 ARG HH12 1 1 21 15526 1 1 38 ARG HH21 H 2.484 -8.256 4.356 1.00 . A A . 38 ARG HH21 1 1 21 15527 1 1 38 ARG HH22 H 3.754 -8.631 5.476 1.00 . A A . 38 ARG HH22 1 1 21 15528 1 1 38 ARG N N 7.818 -8.316 -0.206 1.00 . A A . 38 ARG N 1 1 21 15529 1 1 38 ARG NE N 3.876 -8.429 2.241 1.00 . A A . 38 ARG NE 1 1 21 15530 1 1 38 ARG NH1 N 5.627 -8.755 3.740 1.00 . A A . 38 ARG NH1 1 1 21 15531 1 1 38 ARG NH2 N 3.465 -8.481 4.522 1.00 . A A . 38 ARG NH2 1 1 21 15532 1 1 38 ARG O O 8.234 -9.333 -2.691 1.00 . A A . 38 ARG O 1 1 21 15533 1 1 39 GLU C C 10.468 -10.838 -3.443 1.00 . A A . 39 GLU C 1 1 21 15534 1 1 39 GLU CA C 9.467 -11.876 -2.919 1.00 . A A . 39 GLU CA 1 1 21 15535 1 1 39 GLU CB C 8.498 -12.348 -4.020 1.00 . A A . 39 GLU CB 1 1 21 15536 1 1 39 GLU CD C 8.086 -14.717 -3.114 1.00 . A A . 39 GLU CD 1 1 21 15537 1 1 39 GLU CG C 7.468 -13.386 -3.539 1.00 . A A . 39 GLU CG 1 1 21 15538 1 1 39 GLU H H 8.577 -11.933 -0.976 1.00 . A A . 39 GLU H 1 1 21 15539 1 1 39 GLU HA H 10.052 -12.726 -2.569 1.00 . A A . 39 GLU HA 1 1 21 15540 1 1 39 GLU HB2 H 7.957 -11.483 -4.405 1.00 . A A . 39 GLU HB2 1 1 21 15541 1 1 39 GLU HB3 H 9.076 -12.778 -4.839 1.00 . A A . 39 GLU HB3 1 1 21 15542 1 1 39 GLU HG2 H 6.885 -12.983 -2.710 1.00 . A A . 39 GLU HG2 1 1 21 15543 1 1 39 GLU HG3 H 6.785 -13.592 -4.362 1.00 . A A . 39 GLU HG3 1 1 21 15544 1 1 39 GLU N N 8.713 -11.342 -1.785 1.00 . A A . 39 GLU N 1 1 21 15545 1 1 39 GLU O O 10.542 -10.565 -4.638 1.00 . A A . 39 GLU O 1 1 21 15546 1 1 39 GLU OE1 O 9.258 -14.964 -3.381 1.00 . A A . 39 GLU OE1 1 1 21 15547 1 1 39 GLU OE2 O 7.265 -15.562 -2.440 1.00 . A A . 39 GLU OE2 1 1 21 15548 1 1 40 ASN C C 11.560 -7.796 -3.171 1.00 . A A . 40 ASN C 1 1 21 15549 1 1 40 ASN CA C 12.156 -9.138 -2.721 1.00 . A A . 40 ASN CA 1 1 21 15550 1 1 40 ASN CB C 13.268 -9.605 -3.653 1.00 . A A . 40 ASN CB 1 1 21 15551 1 1 40 ASN CG C 14.501 -8.710 -3.537 1.00 . A A . 40 ASN CG 1 1 21 15552 1 1 40 ASN H H 11.119 -10.559 -1.583 1.00 . A A . 40 ASN H 1 1 21 15553 1 1 40 ASN HA H 12.607 -8.964 -1.750 1.00 . A A . 40 ASN HA 1 1 21 15554 1 1 40 ASN HB2 H 13.549 -10.628 -3.410 1.00 . A A . 40 ASN HB2 1 1 21 15555 1 1 40 ASN HB3 H 12.855 -9.602 -4.654 1.00 . A A . 40 ASN HB3 1 1 21 15556 1 1 40 ASN HD21 H 14.782 -8.674 -5.554 1.00 . A A . 40 ASN HD21 1 1 21 15557 1 1 40 ASN HD22 H 15.935 -7.764 -4.601 1.00 . A A . 40 ASN HD22 1 1 21 15558 1 1 40 ASN N N 11.194 -10.210 -2.516 1.00 . A A . 40 ASN N 1 1 21 15559 1 1 40 ASN ND2 N 15.116 -8.351 -4.660 1.00 . A A . 40 ASN ND2 1 1 21 15560 1 1 40 ASN O O 12.236 -6.775 -3.081 1.00 . A A . 40 ASN O 1 1 21 15561 1 1 40 ASN OD1 O 14.908 -8.349 -2.430 1.00 . A A . 40 ASN OD1 1 1 21 15562 1 1 41 HIS C C 8.973 -5.839 -2.992 1.00 . A A . 41 HIS C 1 1 21 15563 1 1 41 HIS CA C 9.644 -6.582 -4.138 1.00 . A A . 41 HIS CA 1 1 21 15564 1 1 41 HIS CB C 8.622 -6.982 -5.204 1.00 . A A . 41 HIS CB 1 1 21 15565 1 1 41 HIS CD2 C 9.294 -8.968 -6.741 1.00 . A A . 41 HIS CD2 1 1 21 15566 1 1 41 HIS CE1 C 10.561 -7.882 -8.146 1.00 . A A . 41 HIS CE1 1 1 21 15567 1 1 41 HIS CG C 9.285 -7.645 -6.388 1.00 . A A . 41 HIS CG 1 1 21 15568 1 1 41 HIS H H 9.735 -8.600 -3.520 1.00 . A A . 41 HIS H 1 1 21 15569 1 1 41 HIS HA H 10.371 -5.937 -4.625 1.00 . A A . 41 HIS HA 1 1 21 15570 1 1 41 HIS HB2 H 7.905 -7.665 -4.747 1.00 . A A . 41 HIS HB2 1 1 21 15571 1 1 41 HIS HB3 H 8.070 -6.096 -5.529 1.00 . A A . 41 HIS HB3 1 1 21 15572 1 1 41 HIS HD1 H 10.264 -5.964 -7.312 1.00 . A A . 41 HIS HD1 1 1 21 15573 1 1 41 HIS HD2 H 8.830 -9.770 -6.187 1.00 . A A . 41 HIS HD2 1 1 21 15574 1 1 41 HIS HE1 H 11.241 -7.666 -8.959 1.00 . A A . 41 HIS HE1 1 1 21 15575 1 1 41 HIS N N 10.305 -7.769 -3.623 1.00 . A A . 41 HIS N 1 1 21 15576 1 1 41 HIS ND1 N 10.065 -6.957 -7.304 1.00 . A A . 41 HIS ND1 1 1 21 15577 1 1 41 HIS NE2 N 10.116 -9.112 -7.842 1.00 . A A . 41 HIS NE2 1 1 21 15578 1 1 41 HIS O O 8.098 -6.392 -2.327 1.00 . A A . 41 HIS O 1 1 21 15579 1 1 42 TRP C C 7.398 -3.225 -2.481 1.00 . A A . 42 TRP C 1 1 21 15580 1 1 42 TRP CA C 8.675 -3.723 -1.833 1.00 . A A . 42 TRP CA 1 1 21 15581 1 1 42 TRP CB C 9.583 -2.592 -1.373 1.00 . A A . 42 TRP CB 1 1 21 15582 1 1 42 TRP CD1 C 11.752 -3.632 -0.615 1.00 . A A . 42 TRP CD1 1 1 21 15583 1 1 42 TRP CD2 C 10.504 -2.897 1.092 1.00 . A A . 42 TRP CD2 1 1 21 15584 1 1 42 TRP CE2 C 11.685 -3.459 1.651 1.00 . A A . 42 TRP CE2 1 1 21 15585 1 1 42 TRP CE3 C 9.496 -2.499 1.994 1.00 . A A . 42 TRP CE3 1 1 21 15586 1 1 42 TRP CG C 10.588 -3.008 -0.355 1.00 . A A . 42 TRP CG 1 1 21 15587 1 1 42 TRP CH2 C 10.841 -3.201 3.903 1.00 . A A . 42 TRP CH2 1 1 21 15588 1 1 42 TRP CZ2 C 11.843 -3.653 3.028 1.00 . A A . 42 TRP CZ2 1 1 21 15589 1 1 42 TRP CZ3 C 9.676 -2.608 3.384 1.00 . A A . 42 TRP CZ3 1 1 21 15590 1 1 42 TRP H H 10.004 -4.147 -3.422 1.00 . A A . 42 TRP H 1 1 21 15591 1 1 42 TRP HA H 8.411 -4.268 -0.943 1.00 . A A . 42 TRP HA 1 1 21 15592 1 1 42 TRP HB2 H 10.079 -2.129 -2.221 1.00 . A A . 42 TRP HB2 1 1 21 15593 1 1 42 TRP HB3 H 8.967 -1.848 -0.886 1.00 . A A . 42 TRP HB3 1 1 21 15594 1 1 42 TRP HD1 H 12.059 -3.955 -1.595 1.00 . A A . 42 TRP HD1 1 1 21 15595 1 1 42 TRP HE1 H 13.335 -4.287 0.652 1.00 . A A . 42 TRP HE1 1 1 21 15596 1 1 42 TRP HE3 H 8.553 -2.161 1.604 1.00 . A A . 42 TRP HE3 1 1 21 15597 1 1 42 TRP HH2 H 10.945 -3.340 4.969 1.00 . A A . 42 TRP HH2 1 1 21 15598 1 1 42 TRP HZ2 H 12.671 -4.251 3.376 1.00 . A A . 42 TRP HZ2 1 1 21 15599 1 1 42 TRP HZ3 H 8.893 -2.265 4.043 1.00 . A A . 42 TRP HZ3 1 1 21 15600 1 1 42 TRP N N 9.373 -4.591 -2.760 1.00 . A A . 42 TRP N 1 1 21 15601 1 1 42 TRP NE1 N 12.435 -3.847 0.562 1.00 . A A . 42 TRP NE1 1 1 21 15602 1 1 42 TRP O O 7.471 -2.533 -3.488 1.00 . A A . 42 TRP O 1 1 21 15603 1 1 43 LYS C C 4.391 -2.148 -1.389 1.00 . A A . 43 LYS C 1 1 21 15604 1 1 43 LYS CA C 4.949 -3.091 -2.441 1.00 . A A . 43 LYS CA 1 1 21 15605 1 1 43 LYS CB C 3.960 -4.237 -2.671 1.00 . A A . 43 LYS CB 1 1 21 15606 1 1 43 LYS CD C 5.473 -5.492 -4.331 1.00 . A A . 43 LYS CD 1 1 21 15607 1 1 43 LYS CE C 4.638 -5.433 -5.629 1.00 . A A . 43 LYS CE 1 1 21 15608 1 1 43 LYS CG C 4.668 -5.542 -3.019 1.00 . A A . 43 LYS CG 1 1 21 15609 1 1 43 LYS H H 6.198 -4.233 -1.179 1.00 . A A . 43 LYS H 1 1 21 15610 1 1 43 LYS HA H 5.073 -2.581 -3.392 1.00 . A A . 43 LYS HA 1 1 21 15611 1 1 43 LYS HB2 H 3.410 -4.401 -1.752 1.00 . A A . 43 LYS HB2 1 1 21 15612 1 1 43 LYS HB3 H 3.228 -3.964 -3.424 1.00 . A A . 43 LYS HB3 1 1 21 15613 1 1 43 LYS HD2 H 6.210 -4.693 -4.333 1.00 . A A . 43 LYS HD2 1 1 21 15614 1 1 43 LYS HD3 H 6.014 -6.438 -4.352 1.00 . A A . 43 LYS HD3 1 1 21 15615 1 1 43 LYS HE2 H 5.299 -5.712 -6.453 1.00 . A A . 43 LYS HE2 1 1 21 15616 1 1 43 LYS HE3 H 3.834 -6.170 -5.586 1.00 . A A . 43 LYS HE3 1 1 21 15617 1 1 43 LYS HG2 H 5.252 -5.806 -2.128 1.00 . A A . 43 LYS HG2 1 1 21 15618 1 1 43 LYS HG3 H 3.968 -6.351 -3.124 1.00 . A A . 43 LYS HG3 1 1 21 15619 1 1 43 LYS HZ1 H 4.416 -3.803 -6.882 1.00 . A A . 43 LYS HZ1 1 1 21 15620 1 1 43 LYS HZ2 H 3.044 -4.163 -5.979 1.00 . A A . 43 LYS HZ2 1 1 21 15621 1 1 43 LYS N N 6.226 -3.586 -1.960 1.00 . A A . 43 LYS N 1 1 21 15622 1 1 43 LYS NZ N 4.072 -4.104 -5.959 1.00 . A A . 43 LYS NZ 1 1 21 15623 1 1 43 LYS O O 4.457 -2.452 -0.198 1.00 . A A . 43 LYS O 1 1 21 15624 1 1 44 CYS C C 1.619 -1.013 -0.792 1.00 . A A . 44 CYS C 1 1 21 15625 1 1 44 CYS CA C 2.919 -0.249 -0.997 1.00 . A A . 44 CYS CA 1 1 21 15626 1 1 44 CYS CB C 2.658 1.088 -1.674 1.00 . A A . 44 CYS CB 1 1 21 15627 1 1 44 CYS H H 3.808 -0.850 -2.819 1.00 . A A . 44 CYS H 1 1 21 15628 1 1 44 CYS HA H 3.372 -0.036 -0.037 1.00 . A A . 44 CYS HA 1 1 21 15629 1 1 44 CYS HB2 H 3.567 1.677 -1.569 1.00 . A A . 44 CYS HB2 1 1 21 15630 1 1 44 CYS HB3 H 2.428 0.927 -2.724 1.00 . A A . 44 CYS HB3 1 1 21 15631 1 1 44 CYS N N 3.805 -1.040 -1.830 1.00 . A A . 44 CYS N 1 1 21 15632 1 1 44 CYS O O 0.850 -1.127 -1.736 1.00 . A A . 44 CYS O 1 1 21 15633 1 1 44 CYS SG S 1.278 1.991 -0.947 1.00 . A A . 44 CYS SG 1 1 21 15634 1 1 45 PHE C C -0.849 -1.154 1.239 1.00 . A A . 45 PHE C 1 1 21 15635 1 1 45 PHE CA C 0.101 -2.206 0.678 1.00 . A A . 45 PHE CA 1 1 21 15636 1 1 45 PHE CB C 0.275 -3.347 1.683 1.00 . A A . 45 PHE CB 1 1 21 15637 1 1 45 PHE CD1 C 1.911 -4.853 0.470 1.00 . A A . 45 PHE CD1 1 1 21 15638 1 1 45 PHE CD2 C -0.252 -5.758 1.098 1.00 . A A . 45 PHE CD2 1 1 21 15639 1 1 45 PHE CE1 C 2.280 -6.106 -0.044 1.00 . A A . 45 PHE CE1 1 1 21 15640 1 1 45 PHE CE2 C 0.108 -7.007 0.566 1.00 . A A . 45 PHE CE2 1 1 21 15641 1 1 45 PHE CG C 0.653 -4.681 1.068 1.00 . A A . 45 PHE CG 1 1 21 15642 1 1 45 PHE CZ C 1.376 -7.182 -0.009 1.00 . A A . 45 PHE CZ 1 1 21 15643 1 1 45 PHE H H 1.990 -1.382 1.187 1.00 . A A . 45 PHE H 1 1 21 15644 1 1 45 PHE HA H -0.323 -2.628 -0.240 1.00 . A A . 45 PHE HA 1 1 21 15645 1 1 45 PHE HB2 H 1.016 -3.044 2.417 1.00 . A A . 45 PHE HB2 1 1 21 15646 1 1 45 PHE HB3 H -0.665 -3.477 2.214 1.00 . A A . 45 PHE HB3 1 1 21 15647 1 1 45 PHE HD1 H 2.609 -4.027 0.439 1.00 . A A . 45 PHE HD1 1 1 21 15648 1 1 45 PHE HD2 H -1.243 -5.626 1.499 1.00 . A A . 45 PHE HD2 1 1 21 15649 1 1 45 PHE HE1 H 3.256 -6.234 -0.486 1.00 . A A . 45 PHE HE1 1 1 21 15650 1 1 45 PHE HE2 H -0.599 -7.826 0.581 1.00 . A A . 45 PHE HE2 1 1 21 15651 1 1 45 PHE HZ H 1.640 -8.135 -0.447 1.00 . A A . 45 PHE HZ 1 1 21 15652 1 1 45 PHE N N 1.377 -1.564 0.398 1.00 . A A . 45 PHE N 1 1 21 15653 1 1 45 PHE O O -0.426 -0.266 1.977 1.00 . A A . 45 PHE O 1 1 21 15654 1 1 46 CYS C C -3.917 -1.339 2.542 1.00 . A A . 46 CYS C 1 1 21 15655 1 1 46 CYS CA C -3.225 -0.510 1.465 1.00 . A A . 46 CYS CA 1 1 21 15656 1 1 46 CYS CB C -4.200 -0.142 0.344 1.00 . A A . 46 CYS CB 1 1 21 15657 1 1 46 CYS H H -2.395 -2.107 0.373 1.00 . A A . 46 CYS H 1 1 21 15658 1 1 46 CYS HA H -2.867 0.400 1.945 1.00 . A A . 46 CYS HA 1 1 21 15659 1 1 46 CYS HB2 H -4.618 -1.055 -0.069 1.00 . A A . 46 CYS HB2 1 1 21 15660 1 1 46 CYS HB3 H -5.006 0.425 0.791 1.00 . A A . 46 CYS HB3 1 1 21 15661 1 1 46 CYS N N -2.134 -1.295 0.920 1.00 . A A . 46 CYS N 1 1 21 15662 1 1 46 CYS O O -3.816 -2.561 2.558 1.00 . A A . 46 CYS O 1 1 21 15663 1 1 46 CYS SG S -3.551 0.855 -1.026 1.00 . A A . 46 CYS SG 1 1 21 15664 1 1 47 TYR C C -6.537 -0.753 4.829 1.00 . A A . 47 TYR C 1 1 21 15665 1 1 47 TYR CA C -5.112 -1.258 4.701 1.00 . A A . 47 TYR CA 1 1 21 15666 1 1 47 TYR CB C -4.267 -0.745 5.869 1.00 . A A . 47 TYR CB 1 1 21 15667 1 1 47 TYR CD1 C -1.905 -1.355 5.204 1.00 . A A . 47 TYR CD1 1 1 21 15668 1 1 47 TYR CD2 C -2.873 -2.358 7.200 1.00 . A A . 47 TYR CD2 1 1 21 15669 1 1 47 TYR CE1 C -0.736 -2.107 5.390 1.00 . A A . 47 TYR CE1 1 1 21 15670 1 1 47 TYR CE2 C -1.695 -3.088 7.403 1.00 . A A . 47 TYR CE2 1 1 21 15671 1 1 47 TYR CG C -2.984 -1.502 6.093 1.00 . A A . 47 TYR CG 1 1 21 15672 1 1 47 TYR CZ C -0.639 -2.970 6.491 1.00 . A A . 47 TYR CZ 1 1 21 15673 1 1 47 TYR H H -4.602 0.343 3.413 1.00 . A A . 47 TYR H 1 1 21 15674 1 1 47 TYR HA H -5.091 -2.351 4.679 1.00 . A A . 47 TYR HA 1 1 21 15675 1 1 47 TYR HB2 H -4.009 0.287 5.654 1.00 . A A . 47 TYR HB2 1 1 21 15676 1 1 47 TYR HB3 H -4.849 -0.760 6.791 1.00 . A A . 47 TYR HB3 1 1 21 15677 1 1 47 TYR HD1 H -1.967 -0.675 4.371 1.00 . A A . 47 TYR HD1 1 1 21 15678 1 1 47 TYR HD2 H -3.686 -2.465 7.897 1.00 . A A . 47 TYR HD2 1 1 21 15679 1 1 47 TYR HE1 H 0.076 -2.004 4.688 1.00 . A A . 47 TYR HE1 1 1 21 15680 1 1 47 TYR HE2 H -1.628 -3.754 8.252 1.00 . A A . 47 TYR HE2 1 1 21 15681 1 1 47 TYR HH H 0.443 -4.217 7.500 1.00 . A A . 47 TYR HH 1 1 21 15682 1 1 47 TYR N N -4.573 -0.670 3.483 1.00 . A A . 47 TYR N 1 1 21 15683 1 1 47 TYR O O -6.714 0.423 5.134 1.00 . A A . 47 TYR O 1 1 21 15684 1 1 47 TYR OH O 0.481 -3.717 6.677 1.00 . A A . 47 TYR OH 1 1 21 15685 1 1 48 PHE C C -9.640 -1.500 5.764 1.00 . A A . 48 PHE C 1 1 21 15686 1 1 48 PHE CA C -8.919 -1.145 4.469 1.00 . A A . 48 PHE CA 1 1 21 15687 1 1 48 PHE CB C -9.534 -1.965 3.336 1.00 . A A . 48 PHE CB 1 1 21 15688 1 1 48 PHE CD1 C -7.884 -2.290 1.440 1.00 . A A . 48 PHE CD1 1 1 21 15689 1 1 48 PHE CD2 C -9.729 -0.729 1.139 1.00 . A A . 48 PHE CD2 1 1 21 15690 1 1 48 PHE CE1 C -7.469 -2.051 0.119 1.00 . A A . 48 PHE CE1 1 1 21 15691 1 1 48 PHE CE2 C -9.302 -0.475 -0.174 1.00 . A A . 48 PHE CE2 1 1 21 15692 1 1 48 PHE CG C -9.030 -1.649 1.943 1.00 . A A . 48 PHE CG 1 1 21 15693 1 1 48 PHE CZ C -8.177 -1.143 -0.686 1.00 . A A . 48 PHE CZ 1 1 21 15694 1 1 48 PHE H H -7.408 -2.575 4.416 1.00 . A A . 48 PHE H 1 1 21 15695 1 1 48 PHE HA H -9.015 -0.082 4.254 1.00 . A A . 48 PHE HA 1 1 21 15696 1 1 48 PHE HB2 H -9.358 -3.016 3.550 1.00 . A A . 48 PHE HB2 1 1 21 15697 1 1 48 PHE HB3 H -10.603 -1.825 3.352 1.00 . A A . 48 PHE HB3 1 1 21 15698 1 1 48 PHE HD1 H -7.321 -2.974 2.056 1.00 . A A . 48 PHE HD1 1 1 21 15699 1 1 48 PHE HD2 H -10.604 -0.216 1.515 1.00 . A A . 48 PHE HD2 1 1 21 15700 1 1 48 PHE HE1 H -6.613 -2.576 -0.276 1.00 . A A . 48 PHE HE1 1 1 21 15701 1 1 48 PHE HE2 H -9.847 0.228 -0.788 1.00 . A A . 48 PHE HE2 1 1 21 15702 1 1 48 PHE HZ H -7.876 -0.969 -1.707 1.00 . A A . 48 PHE HZ 1 1 21 15703 1 1 48 PHE N N -7.542 -1.586 4.549 1.00 . A A . 48 PHE N 1 1 21 15704 1 1 48 PHE O O -9.055 -2.184 6.600 1.00 . A A . 48 PHE O 1 1 21 15705 1 1 49 ASN C C -11.328 -2.120 8.107 1.00 . A A . 49 ASN C 1 1 21 15706 1 1 49 ASN CA C -11.937 -1.753 6.751 1.00 . A A . 49 ASN CA 1 1 21 15707 1 1 49 ASN CB C -12.715 -2.900 6.071 1.00 . A A . 49 ASN CB 1 1 21 15708 1 1 49 ASN CG C -11.840 -3.889 5.306 1.00 . A A . 49 ASN CG 1 1 21 15709 1 1 49 ASN H H -11.304 -0.566 5.121 1.00 . A A . 49 ASN H 1 1 21 15710 1 1 49 ASN HA H -12.668 -0.974 6.963 1.00 . A A . 49 ASN HA 1 1 21 15711 1 1 49 ASN HB2 H -13.311 -3.441 6.807 1.00 . A A . 49 ASN HB2 1 1 21 15712 1 1 49 ASN HB3 H -13.405 -2.456 5.352 1.00 . A A . 49 ASN HB3 1 1 21 15713 1 1 49 ASN HD21 H -10.726 -4.373 6.964 1.00 . A A . 49 ASN HD21 1 1 21 15714 1 1 49 ASN HD22 H -10.257 -5.137 5.477 1.00 . A A . 49 ASN HD22 1 1 21 15715 1 1 49 ASN N N -10.945 -1.179 5.837 1.00 . A A . 49 ASN N 1 1 21 15716 1 1 49 ASN ND2 N -10.899 -4.538 5.973 1.00 . A A . 49 ASN ND2 1 1 21 15717 1 1 49 ASN O O -11.451 -3.255 8.576 1.00 . A A . 49 ASN O 1 1 21 15718 1 1 49 ASN OD1 O -11.975 -4.046 4.092 1.00 . A A . 49 ASN OD1 1 1 21 15719 1 1 50 CYS C C -10.244 -1.406 11.129 1.00 . A A . 50 CYS C 1 1 21 15720 1 1 50 CYS CA C -9.628 -1.420 9.739 1.00 . A A . 50 CYS CA 1 1 21 15721 1 1 50 CYS CB C -8.461 -0.456 9.577 1.00 . A A . 50 CYS CB 1 1 21 15722 1 1 50 CYS H H -10.548 -0.274 8.219 1.00 . A A . 50 CYS H 1 1 21 15723 1 1 50 CYS HA H -9.205 -2.399 9.579 1.00 . A A . 50 CYS HA 1 1 21 15724 1 1 50 CYS HB2 H -7.936 -0.726 8.662 1.00 . A A . 50 CYS HB2 1 1 21 15725 1 1 50 CYS HB3 H -8.871 0.539 9.473 1.00 . A A . 50 CYS HB3 1 1 21 15726 1 1 50 CYS N N -10.616 -1.159 8.702 1.00 . A A . 50 CYS N 1 1 21 15727 1 1 50 CYS O O -10.454 -2.517 11.708 1.00 . A A . 50 CYS O 1 1 21 15728 1 1 50 CYS OXT O -10.542 -0.310 11.697 1.00 . A A . 50 CYS OXT 1 1 21 15729 1 1 50 CYS SG S -7.220 -0.391 10.888 1.00 . A A . 50 CYS SG 1 1 22 15730 1 1 1 LEU C C -9.796 -5.331 9.260 1.00 . A A . 1 LEU C 1 1 22 15731 1 1 1 LEU CA C -10.866 -5.357 10.352 1.00 . A A . 1 LEU CA 1 1 22 15732 1 1 1 LEU CB C -11.176 -6.789 10.804 1.00 . A A . 1 LEU CB 1 1 22 15733 1 1 1 LEU CD1 C -9.254 -6.889 12.484 1.00 . A A . 1 LEU CD1 1 1 22 15734 1 1 1 LEU CD2 C -10.402 -8.979 11.729 1.00 . A A . 1 LEU CD2 1 1 22 15735 1 1 1 LEU CG C -9.950 -7.578 11.303 1.00 . A A . 1 LEU CG 1 1 22 15736 1 1 1 LEU H1 H -12.442 -5.158 9.043 1.00 . A A . 1 LEU H1 1 1 22 15737 1 1 1 LEU H2 H -12.798 -4.700 10.622 1.00 . A A . 1 LEU H2 1 1 22 15738 1 1 1 LEU H3 H -11.863 -3.699 9.646 1.00 . A A . 1 LEU H3 1 1 22 15739 1 1 1 LEU HA H -10.514 -4.804 11.223 1.00 . A A . 1 LEU HA 1 1 22 15740 1 1 1 LEU HB2 H -11.907 -6.737 11.609 1.00 . A A . 1 LEU HB2 1 1 22 15741 1 1 1 LEU HB3 H -11.614 -7.327 9.963 1.00 . A A . 1 LEU HB3 1 1 22 15742 1 1 1 LEU HD11 H -9.974 -6.691 13.281 1.00 . A A . 1 LEU HD11 1 1 22 15743 1 1 1 LEU HD12 H -8.469 -7.539 12.873 1.00 . A A . 1 LEU HD12 1 1 22 15744 1 1 1 LEU HD13 H -8.794 -5.955 12.168 1.00 . A A . 1 LEU HD13 1 1 22 15745 1 1 1 LEU HD21 H -10.877 -9.488 10.888 1.00 . A A . 1 LEU HD21 1 1 22 15746 1 1 1 LEU HD22 H -9.538 -9.565 12.048 1.00 . A A . 1 LEU HD22 1 1 22 15747 1 1 1 LEU HD23 H -11.110 -8.913 12.555 1.00 . A A . 1 LEU HD23 1 1 22 15748 1 1 1 LEU HG H -9.228 -7.696 10.494 1.00 . A A . 1 LEU HG 1 1 22 15749 1 1 1 LEU N N -12.083 -4.678 9.880 1.00 . A A . 1 LEU N 1 1 22 15750 1 1 1 LEU O O -9.819 -6.171 8.368 1.00 . A A . 1 LEU O 1 1 22 15751 1 1 2 CYS C C -7.657 -4.944 7.230 1.00 . A A . 2 CYS C 1 1 22 15752 1 1 2 CYS CA C -7.810 -4.009 8.433 1.00 . A A . 2 CYS CA 1 1 22 15753 1 1 2 CYS CB C -6.492 -3.805 9.204 1.00 . A A . 2 CYS CB 1 1 22 15754 1 1 2 CYS H H -8.991 -3.744 10.149 1.00 . A A . 2 CYS H 1 1 22 15755 1 1 2 CYS HA H -8.046 -3.029 8.038 1.00 . A A . 2 CYS HA 1 1 22 15756 1 1 2 CYS HB2 H -6.036 -4.777 9.391 1.00 . A A . 2 CYS HB2 1 1 22 15757 1 1 2 CYS HB3 H -5.818 -3.222 8.587 1.00 . A A . 2 CYS HB3 1 1 22 15758 1 1 2 CYS N N -8.903 -4.342 9.344 1.00 . A A . 2 CYS N 1 1 22 15759 1 1 2 CYS O O -6.772 -5.798 7.210 1.00 . A A . 2 CYS O 1 1 22 15760 1 1 2 CYS SG S -6.610 -2.992 10.820 1.00 . A A . 2 CYS SG 1 1 22 15761 1 1 3 ASN C C -7.148 -5.035 4.198 1.00 . A A . 3 ASN C 1 1 22 15762 1 1 3 ASN CA C -8.347 -5.552 4.976 1.00 . A A . 3 ASN CA 1 1 22 15763 1 1 3 ASN CB C -9.588 -5.607 4.068 1.00 . A A . 3 ASN CB 1 1 22 15764 1 1 3 ASN CG C -10.939 -5.914 4.706 1.00 . A A . 3 ASN CG 1 1 22 15765 1 1 3 ASN H H -9.131 -3.974 6.223 1.00 . A A . 3 ASN H 1 1 22 15766 1 1 3 ASN HA H -8.161 -6.591 5.263 1.00 . A A . 3 ASN HA 1 1 22 15767 1 1 3 ASN HB2 H -9.702 -4.641 3.578 1.00 . A A . 3 ASN HB2 1 1 22 15768 1 1 3 ASN HB3 H -9.408 -6.350 3.288 1.00 . A A . 3 ASN HB3 1 1 22 15769 1 1 3 ASN HD21 H -10.190 -6.436 6.556 1.00 . A A . 3 ASN HD21 1 1 22 15770 1 1 3 ASN HD22 H -11.918 -6.545 6.336 1.00 . A A . 3 ASN HD22 1 1 22 15771 1 1 3 ASN N N -8.492 -4.764 6.198 1.00 . A A . 3 ASN N 1 1 22 15772 1 1 3 ASN ND2 N -11.005 -6.368 5.949 1.00 . A A . 3 ASN ND2 1 1 22 15773 1 1 3 ASN O O -7.268 -4.070 3.441 1.00 . A A . 3 ASN O 1 1 22 15774 1 1 3 ASN OD1 O -11.963 -5.728 4.058 1.00 . A A . 3 ASN OD1 1 1 22 15775 1 1 4 GLU C C -4.914 -6.022 2.284 1.00 . A A . 4 GLU C 1 1 22 15776 1 1 4 GLU CA C -4.774 -5.435 3.692 1.00 . A A . 4 GLU CA 1 1 22 15777 1 1 4 GLU CB C -3.637 -6.080 4.500 1.00 . A A . 4 GLU CB 1 1 22 15778 1 1 4 GLU CD C -1.120 -6.438 4.571 1.00 . A A . 4 GLU CD 1 1 22 15779 1 1 4 GLU CG C -2.318 -6.016 3.734 1.00 . A A . 4 GLU CG 1 1 22 15780 1 1 4 GLU H H -5.978 -6.443 5.070 1.00 . A A . 4 GLU H 1 1 22 15781 1 1 4 GLU HA H -4.593 -4.366 3.656 1.00 . A A . 4 GLU HA 1 1 22 15782 1 1 4 GLU HB2 H -3.536 -5.563 5.454 1.00 . A A . 4 GLU HB2 1 1 22 15783 1 1 4 GLU HB3 H -3.870 -7.127 4.693 1.00 . A A . 4 GLU HB3 1 1 22 15784 1 1 4 GLU HG2 H -2.431 -6.712 2.907 1.00 . A A . 4 GLU HG2 1 1 22 15785 1 1 4 GLU HG3 H -2.138 -5.006 3.365 1.00 . A A . 4 GLU HG3 1 1 22 15786 1 1 4 GLU N N -6.003 -5.686 4.404 1.00 . A A . 4 GLU N 1 1 22 15787 1 1 4 GLU O O -5.271 -7.189 2.142 1.00 . A A . 4 GLU O 1 1 22 15788 1 1 4 GLU OE1 O -1.190 -7.665 5.152 1.00 . A A . 4 GLU OE1 1 1 22 15789 1 1 4 GLU OE2 O -0.166 -5.668 4.681 1.00 . A A . 4 GLU OE2 1 1 22 15790 1 1 5 ARG C C -3.275 -5.093 -0.760 1.00 . A A . 5 ARG C 1 1 22 15791 1 1 5 ARG CA C -4.563 -5.650 -0.141 1.00 . A A . 5 ARG CA 1 1 22 15792 1 1 5 ARG CB C -5.818 -5.202 -0.912 1.00 . A A . 5 ARG CB 1 1 22 15793 1 1 5 ARG CD C -6.906 -3.292 -2.183 1.00 . A A . 5 ARG CD 1 1 22 15794 1 1 5 ARG CG C -5.934 -3.677 -1.060 1.00 . A A . 5 ARG CG 1 1 22 15795 1 1 5 ARG CZ C -9.366 -2.866 -2.224 1.00 . A A . 5 ARG CZ 1 1 22 15796 1 1 5 ARG H H -4.329 -4.275 1.442 1.00 . A A . 5 ARG H 1 1 22 15797 1 1 5 ARG HA H -4.528 -6.739 -0.168 1.00 . A A . 5 ARG HA 1 1 22 15798 1 1 5 ARG HB2 H -5.776 -5.639 -1.908 1.00 . A A . 5 ARG HB2 1 1 22 15799 1 1 5 ARG HB3 H -6.703 -5.592 -0.408 1.00 . A A . 5 ARG HB3 1 1 22 15800 1 1 5 ARG HD2 H -6.767 -2.226 -2.370 1.00 . A A . 5 ARG HD2 1 1 22 15801 1 1 5 ARG HD3 H -6.632 -3.829 -3.093 1.00 . A A . 5 ARG HD3 1 1 22 15802 1 1 5 ARG HG2 H -6.237 -3.237 -0.107 1.00 . A A . 5 ARG HG2 1 1 22 15803 1 1 5 ARG HG3 H -4.972 -3.256 -1.343 1.00 . A A . 5 ARG HG3 1 1 22 15804 1 1 5 ARG HH11 H -8.354 -1.818 -3.661 1.00 . A A . 5 ARG HH11 1 1 22 15805 1 1 5 ARG HH12 H -10.009 -1.344 -3.456 1.00 . A A . 5 ARG HH12 1 1 22 15806 1 1 5 ARG HH21 H -10.656 -3.752 -0.907 1.00 . A A . 5 ARG HH21 1 1 22 15807 1 1 5 ARG HH22 H -11.359 -2.517 -1.897 1.00 . A A . 5 ARG HH22 1 1 22 15808 1 1 5 ARG N N -4.631 -5.224 1.249 1.00 . A A . 5 ARG N 1 1 22 15809 1 1 5 ARG NE N -8.302 -3.591 -1.833 1.00 . A A . 5 ARG NE 1 1 22 15810 1 1 5 ARG NH1 N -9.244 -1.934 -3.175 1.00 . A A . 5 ARG NH1 1 1 22 15811 1 1 5 ARG NH2 N -10.556 -3.075 -1.648 1.00 . A A . 5 ARG NH2 1 1 22 15812 1 1 5 ARG O O -2.804 -4.040 -0.318 1.00 . A A . 5 ARG O 1 1 22 15813 1 1 6 PRO C C -1.728 -4.120 -3.299 1.00 . A A . 6 PRO C 1 1 22 15814 1 1 6 PRO CA C -1.474 -5.340 -2.413 1.00 . A A . 6 PRO CA 1 1 22 15815 1 1 6 PRO CB C -0.988 -6.546 -3.223 1.00 . A A . 6 PRO CB 1 1 22 15816 1 1 6 PRO CD C -3.122 -7.063 -2.295 1.00 . A A . 6 PRO CD 1 1 22 15817 1 1 6 PRO CG C -2.287 -7.278 -3.557 1.00 . A A . 6 PRO CG 1 1 22 15818 1 1 6 PRO HA H -0.712 -5.071 -1.683 1.00 . A A . 6 PRO HA 1 1 22 15819 1 1 6 PRO HB2 H -0.432 -6.272 -4.120 1.00 . A A . 6 PRO HB2 1 1 22 15820 1 1 6 PRO HB3 H -0.375 -7.184 -2.585 1.00 . A A . 6 PRO HB3 1 1 22 15821 1 1 6 PRO HD2 H -4.181 -7.078 -2.552 1.00 . A A . 6 PRO HD2 1 1 22 15822 1 1 6 PRO HD3 H -2.901 -7.854 -1.575 1.00 . A A . 6 PRO HD3 1 1 22 15823 1 1 6 PRO HG2 H -2.773 -6.788 -4.402 1.00 . A A . 6 PRO HG2 1 1 22 15824 1 1 6 PRO HG3 H -2.128 -8.335 -3.776 1.00 . A A . 6 PRO HG3 1 1 22 15825 1 1 6 PRO N N -2.688 -5.784 -1.752 1.00 . A A . 6 PRO N 1 1 22 15826 1 1 6 PRO O O -2.859 -3.674 -3.488 1.00 . A A . 6 PRO O 1 1 22 15827 1 1 7 SER C C -1.482 -2.624 -5.977 1.00 . A A . 7 SER C 1 1 22 15828 1 1 7 SER CA C -0.599 -2.456 -4.740 1.00 . A A . 7 SER CA 1 1 22 15829 1 1 7 SER CB C 0.862 -2.173 -5.103 1.00 . A A . 7 SER CB 1 1 22 15830 1 1 7 SER H H 0.265 -3.997 -3.660 1.00 . A A . 7 SER H 1 1 22 15831 1 1 7 SER HA H -0.936 -1.584 -4.183 1.00 . A A . 7 SER HA 1 1 22 15832 1 1 7 SER HB2 H 0.910 -2.180 -6.185 1.00 . A A . 7 SER HB2 1 1 22 15833 1 1 7 SER HB3 H 1.128 -1.188 -4.735 1.00 . A A . 7 SER HB3 1 1 22 15834 1 1 7 SER HG H 1.740 -2.927 -3.585 1.00 . A A . 7 SER HG 1 1 22 15835 1 1 7 SER N N -0.637 -3.591 -3.849 1.00 . A A . 7 SER N 1 1 22 15836 1 1 7 SER O O -1.208 -3.465 -6.832 1.00 . A A . 7 SER O 1 1 22 15837 1 1 7 SER OG O 1.773 -3.111 -4.540 1.00 . A A . 7 SER OG 1 1 22 15838 1 1 8 GLN C C -2.944 -0.295 -7.951 1.00 . A A . 8 GLN C 1 1 22 15839 1 1 8 GLN CA C -3.340 -1.596 -7.252 1.00 . A A . 8 GLN CA 1 1 22 15840 1 1 8 GLN CB C -4.802 -1.550 -6.805 1.00 . A A . 8 GLN CB 1 1 22 15841 1 1 8 GLN CD C -6.777 -2.880 -6.022 1.00 . A A . 8 GLN CD 1 1 22 15842 1 1 8 GLN CG C -5.263 -2.870 -6.185 1.00 . A A . 8 GLN CG 1 1 22 15843 1 1 8 GLN H H -2.668 -1.145 -5.318 1.00 . A A . 8 GLN H 1 1 22 15844 1 1 8 GLN HA H -3.207 -2.422 -7.953 1.00 . A A . 8 GLN HA 1 1 22 15845 1 1 8 GLN HB2 H -4.962 -0.752 -6.080 1.00 . A A . 8 GLN HB2 1 1 22 15846 1 1 8 GLN HB3 H -5.396 -1.335 -7.684 1.00 . A A . 8 GLN HB3 1 1 22 15847 1 1 8 GLN HE21 H -7.039 -3.903 -7.762 1.00 . A A . 8 GLN HE21 1 1 22 15848 1 1 8 GLN HE22 H -8.501 -3.484 -6.891 1.00 . A A . 8 GLN HE22 1 1 22 15849 1 1 8 GLN HG2 H -4.954 -3.703 -6.817 1.00 . A A . 8 GLN HG2 1 1 22 15850 1 1 8 GLN HG3 H -4.801 -2.994 -5.205 1.00 . A A . 8 GLN HG3 1 1 22 15851 1 1 8 GLN N N -2.499 -1.769 -6.084 1.00 . A A . 8 GLN N 1 1 22 15852 1 1 8 GLN NE2 N -7.495 -3.477 -6.967 1.00 . A A . 8 GLN NE2 1 1 22 15853 1 1 8 GLN O O -2.458 -0.310 -9.079 1.00 . A A . 8 GLN O 1 1 22 15854 1 1 8 GLN OE1 O -7.309 -2.340 -5.055 1.00 . A A . 8 GLN OE1 1 1 22 15855 1 1 9 THR C C -1.365 2.394 -7.880 1.00 . A A . 9 THR C 1 1 22 15856 1 1 9 THR CA C -2.863 2.170 -7.768 1.00 . A A . 9 THR CA 1 1 22 15857 1 1 9 THR CB C -3.447 3.171 -6.761 1.00 . A A . 9 THR CB 1 1 22 15858 1 1 9 THR CG2 C -4.887 3.509 -7.137 1.00 . A A . 9 THR CG2 1 1 22 15859 1 1 9 THR H H -3.480 0.810 -6.312 1.00 . A A . 9 THR H 1 1 22 15860 1 1 9 THR HA H -3.314 2.314 -8.749 1.00 . A A . 9 THR HA 1 1 22 15861 1 1 9 THR HB H -2.839 4.079 -6.791 1.00 . A A . 9 THR HB 1 1 22 15862 1 1 9 THR HG1 H -3.248 3.290 -4.797 1.00 . A A . 9 THR HG1 1 1 22 15863 1 1 9 THR HG21 H -4.927 3.911 -8.152 1.00 . A A . 9 THR HG21 1 1 22 15864 1 1 9 THR HG22 H -5.504 2.615 -7.092 1.00 . A A . 9 THR HG22 1 1 22 15865 1 1 9 THR HG23 H -5.271 4.255 -6.445 1.00 . A A . 9 THR HG23 1 1 22 15866 1 1 9 THR N N -3.110 0.833 -7.254 1.00 . A A . 9 THR N 1 1 22 15867 1 1 9 THR O O -0.855 2.885 -8.884 1.00 . A A . 9 THR O 1 1 22 15868 1 1 9 THR OG1 O -3.452 2.605 -5.453 1.00 . A A . 9 THR OG1 1 1 22 15869 1 1 10 TRP C C 1.280 0.830 -7.657 1.00 . A A . 10 TRP C 1 1 22 15870 1 1 10 TRP CA C 0.794 2.021 -6.828 1.00 . A A . 10 TRP CA 1 1 22 15871 1 1 10 TRP CB C 1.273 1.965 -5.382 1.00 . A A . 10 TRP CB 1 1 22 15872 1 1 10 TRP CD1 C 3.777 1.578 -5.623 1.00 . A A . 10 TRP CD1 1 1 22 15873 1 1 10 TRP CD2 C 3.262 3.500 -4.596 1.00 . A A . 10 TRP CD2 1 1 22 15874 1 1 10 TRP CE2 C 4.676 3.465 -4.714 1.00 . A A . 10 TRP CE2 1 1 22 15875 1 1 10 TRP CE3 C 2.693 4.631 -3.985 1.00 . A A . 10 TRP CE3 1 1 22 15876 1 1 10 TRP CG C 2.715 2.304 -5.207 1.00 . A A . 10 TRP CG 1 1 22 15877 1 1 10 TRP CH2 C 4.884 5.637 -3.674 1.00 . A A . 10 TRP CH2 1 1 22 15878 1 1 10 TRP CZ2 C 5.488 4.509 -4.251 1.00 . A A . 10 TRP CZ2 1 1 22 15879 1 1 10 TRP CZ3 C 3.483 5.699 -3.542 1.00 . A A . 10 TRP CZ3 1 1 22 15880 1 1 10 TRP H H -1.142 1.642 -6.028 1.00 . A A . 10 TRP H 1 1 22 15881 1 1 10 TRP HA H 1.162 2.945 -7.279 1.00 . A A . 10 TRP HA 1 1 22 15882 1 1 10 TRP HB2 H 0.698 2.691 -4.807 1.00 . A A . 10 TRP HB2 1 1 22 15883 1 1 10 TRP HB3 H 1.052 0.988 -4.969 1.00 . A A . 10 TRP HB3 1 1 22 15884 1 1 10 TRP HD1 H 3.727 0.630 -6.145 1.00 . A A . 10 TRP HD1 1 1 22 15885 1 1 10 TRP HE1 H 5.872 1.987 -5.621 1.00 . A A . 10 TRP HE1 1 1 22 15886 1 1 10 TRP HE3 H 1.626 4.675 -3.868 1.00 . A A . 10 TRP HE3 1 1 22 15887 1 1 10 TRP HH2 H 5.518 6.448 -3.360 1.00 . A A . 10 TRP HH2 1 1 22 15888 1 1 10 TRP HZ2 H 6.562 4.457 -4.367 1.00 . A A . 10 TRP HZ2 1 1 22 15889 1 1 10 TRP HZ3 H 2.964 6.552 -3.113 1.00 . A A . 10 TRP HZ3 1 1 22 15890 1 1 10 TRP N N -0.650 2.024 -6.822 1.00 . A A . 10 TRP N 1 1 22 15891 1 1 10 TRP NE1 N 4.936 2.271 -5.354 1.00 . A A . 10 TRP NE1 1 1 22 15892 1 1 10 TRP O O 1.756 -0.163 -7.109 1.00 . A A . 10 TRP O 1 1 22 15893 1 1 11 SER C C 2.927 -0.444 -10.055 1.00 . A A . 11 SER C 1 1 22 15894 1 1 11 SER CA C 1.422 -0.249 -9.830 1.00 . A A . 11 SER CA 1 1 22 15895 1 1 11 SER CB C 0.655 -0.076 -11.148 1.00 . A A . 11 SER CB 1 1 22 15896 1 1 11 SER H H 0.607 1.661 -9.383 1.00 . A A . 11 SER H 1 1 22 15897 1 1 11 SER HA H 1.062 -1.137 -9.310 1.00 . A A . 11 SER HA 1 1 22 15898 1 1 11 SER HB2 H 1.211 0.581 -11.819 1.00 . A A . 11 SER HB2 1 1 22 15899 1 1 11 SER HB3 H 0.529 -1.045 -11.635 1.00 . A A . 11 SER HB3 1 1 22 15900 1 1 11 SER HG H -1.127 0.025 -10.285 1.00 . A A . 11 SER HG 1 1 22 15901 1 1 11 SER N N 1.138 0.891 -8.977 1.00 . A A . 11 SER N 1 1 22 15902 1 1 11 SER O O 3.404 -0.354 -11.182 1.00 . A A . 11 SER O 1 1 22 15903 1 1 11 SER OG O -0.605 0.535 -10.921 1.00 . A A . 11 SER OG 1 1 22 15904 1 1 12 GLY C C 5.779 -1.245 -7.766 1.00 . A A . 12 GLY C 1 1 22 15905 1 1 12 GLY CA C 5.124 -0.912 -9.106 1.00 . A A . 12 GLY CA 1 1 22 15906 1 1 12 GLY H H 3.248 -0.778 -8.079 1.00 . A A . 12 GLY H 1 1 22 15907 1 1 12 GLY HA2 H 5.330 -1.728 -9.800 1.00 . A A . 12 GLY HA2 1 1 22 15908 1 1 12 GLY HA3 H 5.560 0.005 -9.505 1.00 . A A . 12 GLY HA3 1 1 22 15909 1 1 12 GLY N N 3.687 -0.726 -8.992 1.00 . A A . 12 GLY N 1 1 22 15910 1 1 12 GLY O O 5.168 -1.892 -6.906 1.00 . A A . 12 GLY O 1 1 22 15911 1 1 13 ASN C C 7.724 0.256 -5.542 1.00 . A A . 13 ASN C 1 1 22 15912 1 1 13 ASN CA C 7.844 -0.992 -6.414 1.00 . A A . 13 ASN CA 1 1 22 15913 1 1 13 ASN CB C 9.304 -1.255 -6.802 1.00 . A A . 13 ASN CB 1 1 22 15914 1 1 13 ASN CG C 10.095 -1.964 -5.704 1.00 . A A . 13 ASN CG 1 1 22 15915 1 1 13 ASN H H 7.430 -0.236 -8.343 1.00 . A A . 13 ASN H 1 1 22 15916 1 1 13 ASN HA H 7.469 -1.865 -5.881 1.00 . A A . 13 ASN HA 1 1 22 15917 1 1 13 ASN HB2 H 9.311 -1.912 -7.672 1.00 . A A . 13 ASN HB2 1 1 22 15918 1 1 13 ASN HB3 H 9.797 -0.321 -7.077 1.00 . A A . 13 ASN HB3 1 1 22 15919 1 1 13 ASN HD21 H 10.319 -0.267 -4.524 1.00 . A A . 13 ASN HD21 1 1 22 15920 1 1 13 ASN HD22 H 11.117 -1.705 -3.984 1.00 . A A . 13 ASN HD22 1 1 22 15921 1 1 13 ASN N N 7.035 -0.811 -7.613 1.00 . A A . 13 ASN N 1 1 22 15922 1 1 13 ASN ND2 N 10.529 -1.253 -4.663 1.00 . A A . 13 ASN ND2 1 1 22 15923 1 1 13 ASN O O 7.478 1.347 -6.052 1.00 . A A . 13 ASN O 1 1 22 15924 1 1 13 ASN OD1 O 10.336 -3.168 -5.800 1.00 . A A . 13 ASN OD1 1 1 22 15925 1 1 14 CYS C C 8.937 1.595 -2.647 1.00 . A A . 14 CYS C 1 1 22 15926 1 1 14 CYS CA C 7.612 1.093 -3.204 1.00 . A A . 14 CYS CA 1 1 22 15927 1 1 14 CYS CB C 6.760 0.441 -2.107 1.00 . A A . 14 CYS CB 1 1 22 15928 1 1 14 CYS H H 8.147 -0.823 -3.905 1.00 . A A . 14 CYS H 1 1 22 15929 1 1 14 CYS HA H 7.058 1.931 -3.624 1.00 . A A . 14 CYS HA 1 1 22 15930 1 1 14 CYS HB2 H 6.046 -0.202 -2.611 1.00 . A A . 14 CYS HB2 1 1 22 15931 1 1 14 CYS HB3 H 7.377 -0.179 -1.463 1.00 . A A . 14 CYS HB3 1 1 22 15932 1 1 14 CYS N N 7.867 0.095 -4.231 1.00 . A A . 14 CYS N 1 1 22 15933 1 1 14 CYS O O 9.990 1.029 -2.947 1.00 . A A . 14 CYS O 1 1 22 15934 1 1 14 CYS SG S 5.763 1.536 -1.071 1.00 . A A . 14 CYS SG 1 1 22 15935 1 1 15 GLY C C 9.437 4.241 -0.130 1.00 . A A . 15 GLY C 1 1 22 15936 1 1 15 GLY CA C 9.983 3.181 -1.076 1.00 . A A . 15 GLY CA 1 1 22 15937 1 1 15 GLY H H 7.966 3.063 -1.667 1.00 . A A . 15 GLY H 1 1 22 15938 1 1 15 GLY HA2 H 10.466 2.392 -0.505 1.00 . A A . 15 GLY HA2 1 1 22 15939 1 1 15 GLY HA3 H 10.697 3.632 -1.764 1.00 . A A . 15 GLY HA3 1 1 22 15940 1 1 15 GLY N N 8.869 2.646 -1.833 1.00 . A A . 15 GLY N 1 1 22 15941 1 1 15 GLY O O 9.446 4.093 1.092 1.00 . A A . 15 GLY O 1 1 22 15942 1 1 16 ASN C C 6.860 5.857 0.578 1.00 . A A . 16 ASN C 1 1 22 15943 1 1 16 ASN CA C 8.200 6.342 0.034 1.00 . A A . 16 ASN CA 1 1 22 15944 1 1 16 ASN CB C 8.059 7.613 -0.810 1.00 . A A . 16 ASN CB 1 1 22 15945 1 1 16 ASN CG C 7.667 8.801 0.059 1.00 . A A . 16 ASN CG 1 1 22 15946 1 1 16 ASN H H 8.875 5.328 -1.727 1.00 . A A . 16 ASN H 1 1 22 15947 1 1 16 ASN HA H 8.845 6.601 0.879 1.00 . A A . 16 ASN HA 1 1 22 15948 1 1 16 ASN HB2 H 9.028 7.839 -1.259 1.00 . A A . 16 ASN HB2 1 1 22 15949 1 1 16 ASN HB3 H 7.330 7.476 -1.607 1.00 . A A . 16 ASN HB3 1 1 22 15950 1 1 16 ASN HD21 H 8.338 10.136 -1.329 1.00 . A A . 16 ASN HD21 1 1 22 15951 1 1 16 ASN HD22 H 7.644 10.811 0.131 1.00 . A A . 16 ASN HD22 1 1 22 15952 1 1 16 ASN N N 8.860 5.288 -0.719 1.00 . A A . 16 ASN N 1 1 22 15953 1 1 16 ASN ND2 N 7.880 10.013 -0.439 1.00 . A A . 16 ASN ND2 1 1 22 15954 1 1 16 ASN O O 5.799 6.121 0.012 1.00 . A A . 16 ASN O 1 1 22 15955 1 1 16 ASN OD1 O 7.151 8.636 1.162 1.00 . A A . 16 ASN OD1 1 1 22 15956 1 1 17 THR C C 4.749 5.834 2.743 1.00 . A A . 17 THR C 1 1 22 15957 1 1 17 THR CA C 5.715 4.682 2.399 1.00 . A A . 17 THR CA 1 1 22 15958 1 1 17 THR CB C 6.129 3.816 3.601 1.00 . A A . 17 THR CB 1 1 22 15959 1 1 17 THR CG2 C 6.671 4.628 4.782 1.00 . A A . 17 THR CG2 1 1 22 15960 1 1 17 THR H H 7.824 4.883 2.047 1.00 . A A . 17 THR H 1 1 22 15961 1 1 17 THR HA H 5.212 4.023 1.698 1.00 . A A . 17 THR HA 1 1 22 15962 1 1 17 THR HB H 6.916 3.141 3.267 1.00 . A A . 17 THR HB 1 1 22 15963 1 1 17 THR HG1 H 4.377 3.565 4.401 1.00 . A A . 17 THR HG1 1 1 22 15964 1 1 17 THR HG21 H 7.512 5.242 4.460 1.00 . A A . 17 THR HG21 1 1 22 15965 1 1 17 THR HG22 H 5.896 5.267 5.204 1.00 . A A . 17 THR HG22 1 1 22 15966 1 1 17 THR HG23 H 7.017 3.942 5.555 1.00 . A A . 17 THR HG23 1 1 22 15967 1 1 17 THR N N 6.906 5.166 1.716 1.00 . A A . 17 THR N 1 1 22 15968 1 1 17 THR O O 3.529 5.658 2.741 1.00 . A A . 17 THR O 1 1 22 15969 1 1 17 THR OG1 O 5.056 2.999 4.023 1.00 . A A . 17 THR OG1 1 1 22 15970 1 1 18 ALA C C 3.851 8.792 1.972 1.00 . A A . 18 ALA C 1 1 22 15971 1 1 18 ALA CA C 4.474 8.219 3.251 1.00 . A A . 18 ALA CA 1 1 22 15972 1 1 18 ALA CB C 5.321 9.269 3.980 1.00 . A A . 18 ALA CB 1 1 22 15973 1 1 18 ALA H H 6.283 7.159 2.916 1.00 . A A . 18 ALA H 1 1 22 15974 1 1 18 ALA HA H 3.652 7.940 3.914 1.00 . A A . 18 ALA HA 1 1 22 15975 1 1 18 ALA HB1 H 5.733 8.842 4.894 1.00 . A A . 18 ALA HB1 1 1 22 15976 1 1 18 ALA HB2 H 6.137 9.610 3.343 1.00 . A A . 18 ALA HB2 1 1 22 15977 1 1 18 ALA HB3 H 4.697 10.126 4.242 1.00 . A A . 18 ALA HB3 1 1 22 15978 1 1 18 ALA N N 5.282 7.036 2.989 1.00 . A A . 18 ALA N 1 1 22 15979 1 1 18 ALA O O 3.036 9.708 2.056 1.00 . A A . 18 ALA O 1 1 22 15980 1 1 19 HIS C C 2.489 7.251 -0.579 1.00 . A A . 19 HIS C 1 1 22 15981 1 1 19 HIS CA C 3.446 8.444 -0.435 1.00 . A A . 19 HIS CA 1 1 22 15982 1 1 19 HIS CB C 4.402 8.614 -1.619 1.00 . A A . 19 HIS CB 1 1 22 15983 1 1 19 HIS CD2 C 2.501 9.251 -3.308 1.00 . A A . 19 HIS CD2 1 1 22 15984 1 1 19 HIS CE1 C 3.700 9.152 -5.136 1.00 . A A . 19 HIS CE1 1 1 22 15985 1 1 19 HIS CG C 3.796 8.959 -2.960 1.00 . A A . 19 HIS CG 1 1 22 15986 1 1 19 HIS H H 4.975 7.617 0.776 1.00 . A A . 19 HIS H 1 1 22 15987 1 1 19 HIS HA H 2.849 9.354 -0.376 1.00 . A A . 19 HIS HA 1 1 22 15988 1 1 19 HIS HB2 H 5.094 9.410 -1.387 1.00 . A A . 19 HIS HB2 1 1 22 15989 1 1 19 HIS HB3 H 4.972 7.696 -1.713 1.00 . A A . 19 HIS HB3 1 1 22 15990 1 1 19 HIS HD1 H 5.557 8.843 -4.198 1.00 . A A . 19 HIS HD1 1 1 22 15991 1 1 19 HIS HD2 H 1.653 9.292 -2.635 1.00 . A A . 19 HIS HD2 1 1 22 15992 1 1 19 HIS HE1 H 3.975 9.145 -6.183 1.00 . A A . 19 HIS HE1 1 1 22 15993 1 1 19 HIS N N 4.220 8.291 0.790 1.00 . A A . 19 HIS N 1 1 22 15994 1 1 19 HIS ND1 N 4.559 8.988 -4.119 1.00 . A A . 19 HIS ND1 1 1 22 15995 1 1 19 HIS NE2 N 2.445 9.301 -4.690 1.00 . A A . 19 HIS NE2 1 1 22 15996 1 1 19 HIS O O 1.327 7.445 -0.935 1.00 . A A . 19 HIS O 1 1 22 15997 1 1 20 CYS C C 0.792 5.017 0.376 1.00 . A A . 20 CYS C 1 1 22 15998 1 1 20 CYS CA C 2.112 4.817 -0.357 1.00 . A A . 20 CYS CA 1 1 22 15999 1 1 20 CYS CB C 2.812 3.596 0.238 1.00 . A A . 20 CYS CB 1 1 22 16000 1 1 20 CYS H H 3.933 5.919 -0.063 1.00 . A A . 20 CYS H 1 1 22 16001 1 1 20 CYS HA H 1.881 4.599 -1.398 1.00 . A A . 20 CYS HA 1 1 22 16002 1 1 20 CYS HB2 H 3.678 3.325 -0.361 1.00 . A A . 20 CYS HB2 1 1 22 16003 1 1 20 CYS HB3 H 3.135 3.829 1.244 1.00 . A A . 20 CYS HB3 1 1 22 16004 1 1 20 CYS N N 2.952 6.021 -0.300 1.00 . A A . 20 CYS N 1 1 22 16005 1 1 20 CYS O O -0.268 4.718 -0.168 1.00 . A A . 20 CYS O 1 1 22 16006 1 1 20 CYS SG S 1.728 2.166 0.461 1.00 . A A . 20 CYS SG 1 1 22 16007 1 1 21 ASP C C -1.325 6.718 1.627 1.00 . A A . 21 ASP C 1 1 22 16008 1 1 21 ASP CA C -0.366 5.777 2.369 1.00 . A A . 21 ASP CA 1 1 22 16009 1 1 21 ASP CB C -0.014 6.344 3.762 1.00 . A A . 21 ASP CB 1 1 22 16010 1 1 21 ASP CG C 0.052 7.876 3.806 1.00 . A A . 21 ASP CG 1 1 22 16011 1 1 21 ASP H H 1.760 5.781 1.993 1.00 . A A . 21 ASP H 1 1 22 16012 1 1 21 ASP HA H -0.832 4.792 2.489 1.00 . A A . 21 ASP HA 1 1 22 16013 1 1 21 ASP HB2 H -0.779 6.019 4.465 1.00 . A A . 21 ASP HB2 1 1 22 16014 1 1 21 ASP HB3 H 0.940 5.936 4.101 1.00 . A A . 21 ASP HB3 1 1 22 16015 1 1 21 ASP N N 0.848 5.589 1.582 1.00 . A A . 21 ASP N 1 1 22 16016 1 1 21 ASP O O -2.542 6.591 1.751 1.00 . A A . 21 ASP O 1 1 22 16017 1 1 21 ASP OD1 O 0.988 8.466 3.274 1.00 . A A . 21 ASP OD1 1 1 22 16018 1 1 21 ASP OD2 O -0.957 8.532 4.439 1.00 . A A . 21 ASP OD2 1 1 22 16019 1 1 22 LYS C C -2.204 7.860 -1.111 1.00 . A A . 22 LYS C 1 1 22 16020 1 1 22 LYS CA C -1.579 8.589 0.068 1.00 . A A . 22 LYS CA 1 1 22 16021 1 1 22 LYS CB C -0.792 9.830 -0.360 1.00 . A A . 22 LYS CB 1 1 22 16022 1 1 22 LYS CD C 0.379 11.806 0.776 1.00 . A A . 22 LYS CD 1 1 22 16023 1 1 22 LYS CE C 1.341 12.211 1.909 1.00 . A A . 22 LYS CE 1 1 22 16024 1 1 22 LYS CG C -0.084 10.350 0.886 1.00 . A A . 22 LYS CG 1 1 22 16025 1 1 22 LYS H H 0.216 7.633 0.670 1.00 . A A . 22 LYS H 1 1 22 16026 1 1 22 LYS HA H -2.354 8.965 0.727 1.00 . A A . 22 LYS HA 1 1 22 16027 1 1 22 LYS HB2 H -0.069 9.592 -1.137 1.00 . A A . 22 LYS HB2 1 1 22 16028 1 1 22 LYS HB3 H -1.486 10.579 -0.742 1.00 . A A . 22 LYS HB3 1 1 22 16029 1 1 22 LYS HD2 H 0.877 11.963 -0.184 1.00 . A A . 22 LYS HD2 1 1 22 16030 1 1 22 LYS HD3 H -0.506 12.447 0.802 1.00 . A A . 22 LYS HD3 1 1 22 16031 1 1 22 LYS HE2 H 2.366 12.142 1.539 1.00 . A A . 22 LYS HE2 1 1 22 16032 1 1 22 LYS HE3 H 1.153 13.251 2.182 1.00 . A A . 22 LYS HE3 1 1 22 16033 1 1 22 LYS HG2 H -0.768 10.259 1.731 1.00 . A A . 22 LYS HG2 1 1 22 16034 1 1 22 LYS HG3 H 0.751 9.674 1.016 1.00 . A A . 22 LYS HG3 1 1 22 16035 1 1 22 LYS HZ1 H 1.052 10.376 2.819 1.00 . A A . 22 LYS HZ1 1 1 22 16036 1 1 22 LYS HZ2 H 2.115 11.387 3.642 1.00 . A A . 22 LYS HZ2 1 1 22 16037 1 1 22 LYS N N -0.781 7.656 0.843 1.00 . A A . 22 LYS N 1 1 22 16038 1 1 22 LYS NZ N 1.234 11.348 3.110 1.00 . A A . 22 LYS NZ 1 1 22 16039 1 1 22 LYS O O -3.406 7.985 -1.332 1.00 . A A . 22 LYS O 1 1 22 16040 1 1 23 GLN C C -2.923 5.069 -2.451 1.00 . A A . 23 GLN C 1 1 22 16041 1 1 23 GLN CA C -2.062 6.253 -2.919 1.00 . A A . 23 GLN CA 1 1 22 16042 1 1 23 GLN CB C -1.062 5.800 -3.976 1.00 . A A . 23 GLN CB 1 1 22 16043 1 1 23 GLN CD C 0.481 6.762 -5.772 1.00 . A A . 23 GLN CD 1 1 22 16044 1 1 23 GLN CG C -0.104 6.925 -4.380 1.00 . A A . 23 GLN CG 1 1 22 16045 1 1 23 GLN H H -0.480 6.861 -1.560 1.00 . A A . 23 GLN H 1 1 22 16046 1 1 23 GLN HA H -2.691 6.967 -3.432 1.00 . A A . 23 GLN HA 1 1 22 16047 1 1 23 GLN HB2 H -0.510 4.936 -3.606 1.00 . A A . 23 GLN HB2 1 1 22 16048 1 1 23 GLN HB3 H -1.658 5.497 -4.839 1.00 . A A . 23 GLN HB3 1 1 22 16049 1 1 23 GLN HE21 H -0.065 4.796 -5.908 1.00 . A A . 23 GLN HE21 1 1 22 16050 1 1 23 GLN HE22 H 0.623 5.523 -7.335 1.00 . A A . 23 GLN HE22 1 1 22 16051 1 1 23 GLN HG2 H -0.650 7.865 -4.402 1.00 . A A . 23 GLN HG2 1 1 22 16052 1 1 23 GLN HG3 H 0.711 6.982 -3.665 1.00 . A A . 23 GLN HG3 1 1 22 16053 1 1 23 GLN N N -1.450 7.011 -1.824 1.00 . A A . 23 GLN N 1 1 22 16054 1 1 23 GLN NE2 N 0.359 5.584 -6.371 1.00 . A A . 23 GLN NE2 1 1 22 16055 1 1 23 GLN O O -3.030 4.060 -3.150 1.00 . A A . 23 GLN O 1 1 22 16056 1 1 23 GLN OE1 O 1.034 7.720 -6.304 1.00 . A A . 23 GLN OE1 1 1 22 16057 1 1 24 CYS C C -5.542 5.042 0.046 1.00 . A A . 24 CYS C 1 1 22 16058 1 1 24 CYS CA C -4.423 4.257 -0.633 1.00 . A A . 24 CYS CA 1 1 22 16059 1 1 24 CYS CB C -3.600 3.467 0.393 1.00 . A A . 24 CYS CB 1 1 22 16060 1 1 24 CYS H H -3.543 6.144 -0.888 1.00 . A A . 24 CYS H 1 1 22 16061 1 1 24 CYS HA H -4.865 3.569 -1.353 1.00 . A A . 24 CYS HA 1 1 22 16062 1 1 24 CYS HB2 H -3.046 4.155 1.028 1.00 . A A . 24 CYS HB2 1 1 22 16063 1 1 24 CYS HB3 H -4.283 2.900 1.022 1.00 . A A . 24 CYS HB3 1 1 22 16064 1 1 24 CYS N N -3.591 5.232 -1.311 1.00 . A A . 24 CYS N 1 1 22 16065 1 1 24 CYS O O -6.711 4.722 -0.128 1.00 . A A . 24 CYS O 1 1 22 16066 1 1 24 CYS SG S -2.424 2.262 -0.268 1.00 . A A . 24 CYS SG 1 1 22 16067 1 1 25 GLN C C -6.793 7.943 0.354 1.00 . A A . 25 GLN C 1 1 22 16068 1 1 25 GLN CA C -6.175 6.996 1.390 1.00 . A A . 25 GLN CA 1 1 22 16069 1 1 25 GLN CB C -5.516 7.799 2.518 1.00 . A A . 25 GLN CB 1 1 22 16070 1 1 25 GLN CD C -4.283 7.537 4.723 1.00 . A A . 25 GLN CD 1 1 22 16071 1 1 25 GLN CG C -5.156 6.862 3.673 1.00 . A A . 25 GLN CG 1 1 22 16072 1 1 25 GLN H H -4.213 6.276 0.981 1.00 . A A . 25 GLN H 1 1 22 16073 1 1 25 GLN HA H -6.971 6.399 1.839 1.00 . A A . 25 GLN HA 1 1 22 16074 1 1 25 GLN HB2 H -4.620 8.298 2.143 1.00 . A A . 25 GLN HB2 1 1 22 16075 1 1 25 GLN HB3 H -6.215 8.555 2.877 1.00 . A A . 25 GLN HB3 1 1 22 16076 1 1 25 GLN HE21 H -5.675 8.973 5.063 1.00 . A A . 25 GLN HE21 1 1 22 16077 1 1 25 GLN HE22 H -4.212 9.088 6.021 1.00 . A A . 25 GLN HE22 1 1 22 16078 1 1 25 GLN HG2 H -6.065 6.502 4.151 1.00 . A A . 25 GLN HG2 1 1 22 16079 1 1 25 GLN HG3 H -4.612 6.011 3.271 1.00 . A A . 25 GLN HG3 1 1 22 16080 1 1 25 GLN N N -5.195 6.101 0.786 1.00 . A A . 25 GLN N 1 1 22 16081 1 1 25 GLN NE2 N -4.754 8.637 5.301 1.00 . A A . 25 GLN NE2 1 1 22 16082 1 1 25 GLN O O -8.002 8.151 0.353 1.00 . A A . 25 GLN O 1 1 22 16083 1 1 25 GLN OE1 O -3.178 7.081 5.008 1.00 . A A . 25 GLN OE1 1 1 22 16084 1 1 26 ASP C C -6.964 9.050 -2.670 1.00 . A A . 26 ASP C 1 1 22 16085 1 1 26 ASP CA C -6.405 9.634 -1.381 1.00 . A A . 26 ASP CA 1 1 22 16086 1 1 26 ASP CB C -5.267 10.613 -1.681 1.00 . A A . 26 ASP CB 1 1 22 16087 1 1 26 ASP CG C -4.873 11.416 -0.447 1.00 . A A . 26 ASP CG 1 1 22 16088 1 1 26 ASP H H -4.985 8.292 -0.528 1.00 . A A . 26 ASP H 1 1 22 16089 1 1 26 ASP HA H -7.195 10.211 -0.904 1.00 . A A . 26 ASP HA 1 1 22 16090 1 1 26 ASP HB2 H -4.402 10.090 -2.069 1.00 . A A . 26 ASP HB2 1 1 22 16091 1 1 26 ASP HB3 H -5.606 11.299 -2.454 1.00 . A A . 26 ASP HB3 1 1 22 16092 1 1 26 ASP N N -5.961 8.569 -0.487 1.00 . A A . 26 ASP N 1 1 22 16093 1 1 26 ASP O O -8.064 9.398 -3.093 1.00 . A A . 26 ASP O 1 1 22 16094 1 1 26 ASP OD1 O -5.709 12.432 -0.104 1.00 . A A . 26 ASP OD1 1 1 22 16095 1 1 26 ASP OD2 O -3.852 11.123 0.169 1.00 . A A . 26 ASP OD2 1 1 22 16096 1 1 27 TRP C C -7.625 6.625 -4.476 1.00 . A A . 27 TRP C 1 1 22 16097 1 1 27 TRP CA C -6.492 7.641 -4.621 1.00 . A A . 27 TRP CA 1 1 22 16098 1 1 27 TRP CB C -5.250 6.959 -5.203 1.00 . A A . 27 TRP CB 1 1 22 16099 1 1 27 TRP CD1 C -3.706 8.980 -5.145 1.00 . A A . 27 TRP CD1 1 1 22 16100 1 1 27 TRP CD2 C -3.297 7.622 -6.868 1.00 . A A . 27 TRP CD2 1 1 22 16101 1 1 27 TRP CE2 C -2.329 8.666 -6.927 1.00 . A A . 27 TRP CE2 1 1 22 16102 1 1 27 TRP CE3 C -3.255 6.648 -7.886 1.00 . A A . 27 TRP CE3 1 1 22 16103 1 1 27 TRP CG C -4.142 7.832 -5.704 1.00 . A A . 27 TRP CG 1 1 22 16104 1 1 27 TRP CH2 C -1.300 7.686 -8.887 1.00 . A A . 27 TRP CH2 1 1 22 16105 1 1 27 TRP CZ2 C -1.351 8.718 -7.932 1.00 . A A . 27 TRP CZ2 1 1 22 16106 1 1 27 TRP CZ3 C -2.257 6.661 -8.869 1.00 . A A . 27 TRP CZ3 1 1 22 16107 1 1 27 TRP H H -5.276 7.995 -2.887 1.00 . A A . 27 TRP H 1 1 22 16108 1 1 27 TRP HA H -6.812 8.441 -5.291 1.00 . A A . 27 TRP HA 1 1 22 16109 1 1 27 TRP HB2 H -4.826 6.264 -4.478 1.00 . A A . 27 TRP HB2 1 1 22 16110 1 1 27 TRP HB3 H -5.593 6.380 -6.056 1.00 . A A . 27 TRP HB3 1 1 22 16111 1 1 27 TRP HD1 H -4.117 9.430 -4.258 1.00 . A A . 27 TRP HD1 1 1 22 16112 1 1 27 TRP HE1 H -2.137 10.326 -5.621 1.00 . A A . 27 TRP HE1 1 1 22 16113 1 1 27 TRP HE3 H -4.018 5.893 -7.917 1.00 . A A . 27 TRP HE3 1 1 22 16114 1 1 27 TRP HH2 H -0.536 7.665 -9.643 1.00 . A A . 27 TRP HH2 1 1 22 16115 1 1 27 TRP HZ2 H -0.629 9.520 -7.959 1.00 . A A . 27 TRP HZ2 1 1 22 16116 1 1 27 TRP HZ3 H -2.226 5.884 -9.620 1.00 . A A . 27 TRP HZ3 1 1 22 16117 1 1 27 TRP N N -6.179 8.178 -3.301 1.00 . A A . 27 TRP N 1 1 22 16118 1 1 27 TRP NE1 N -2.632 9.477 -5.850 1.00 . A A . 27 TRP NE1 1 1 22 16119 1 1 27 TRP O O -8.749 6.854 -4.927 1.00 . A A . 27 TRP O 1 1 22 16120 1 1 28 GLU C C -8.997 5.343 -2.041 1.00 . A A . 28 GLU C 1 1 22 16121 1 1 28 GLU CA C -8.331 4.625 -3.231 1.00 . A A . 28 GLU CA 1 1 22 16122 1 1 28 GLU CB C -7.617 3.302 -2.882 1.00 . A A . 28 GLU CB 1 1 22 16123 1 1 28 GLU CD C -6.570 1.171 -3.814 1.00 . A A . 28 GLU CD 1 1 22 16124 1 1 28 GLU CG C -7.227 2.513 -4.142 1.00 . A A . 28 GLU CG 1 1 22 16125 1 1 28 GLU H H -6.402 5.474 -3.374 1.00 . A A . 28 GLU H 1 1 22 16126 1 1 28 GLU HA H -9.102 4.429 -3.979 1.00 . A A . 28 GLU HA 1 1 22 16127 1 1 28 GLU HB2 H -6.716 3.523 -2.326 1.00 . A A . 28 GLU HB2 1 1 22 16128 1 1 28 GLU HB3 H -8.228 2.666 -2.255 1.00 . A A . 28 GLU HB3 1 1 22 16129 1 1 28 GLU HG2 H -8.127 2.308 -4.720 1.00 . A A . 28 GLU HG2 1 1 22 16130 1 1 28 GLU HG3 H -6.550 3.112 -4.749 1.00 . A A . 28 GLU HG3 1 1 22 16131 1 1 28 GLU N N -7.332 5.538 -3.759 1.00 . A A . 28 GLU N 1 1 22 16132 1 1 28 GLU O O -9.060 6.569 -2.037 1.00 . A A . 28 GLU O 1 1 22 16133 1 1 28 GLU OE1 O -7.260 0.277 -3.322 1.00 . A A . 28 GLU OE1 1 1 22 16134 1 1 28 GLU OE2 O -5.245 1.036 -4.108 1.00 . A A . 28 GLU OE2 1 1 22 16135 1 1 29 LYS C C -10.029 4.071 1.220 1.00 . A A . 29 LYS C 1 1 22 16136 1 1 29 LYS CA C -10.110 5.166 0.158 1.00 . A A . 29 LYS CA 1 1 22 16137 1 1 29 LYS CB C -11.561 5.611 -0.122 1.00 . A A . 29 LYS CB 1 1 22 16138 1 1 29 LYS CD C -12.111 6.906 -2.272 1.00 . A A . 29 LYS CD 1 1 22 16139 1 1 29 LYS CE C -11.843 8.225 -3.019 1.00 . A A . 29 LYS CE 1 1 22 16140 1 1 29 LYS CG C -11.698 6.991 -0.791 1.00 . A A . 29 LYS CG 1 1 22 16141 1 1 29 LYS H H -9.289 3.646 -0.967 1.00 . A A . 29 LYS H 1 1 22 16142 1 1 29 LYS HA H -9.508 5.991 0.511 1.00 . A A . 29 LYS HA 1 1 22 16143 1 1 29 LYS HB2 H -12.096 4.845 -0.688 1.00 . A A . 29 LYS HB2 1 1 22 16144 1 1 29 LYS HB3 H -12.047 5.696 0.850 1.00 . A A . 29 LYS HB3 1 1 22 16145 1 1 29 LYS HD2 H -11.592 6.085 -2.769 1.00 . A A . 29 LYS HD2 1 1 22 16146 1 1 29 LYS HD3 H -13.180 6.688 -2.306 1.00 . A A . 29 LYS HD3 1 1 22 16147 1 1 29 LYS HE2 H -12.446 8.255 -3.928 1.00 . A A . 29 LYS HE2 1 1 22 16148 1 1 29 LYS HE3 H -12.133 9.066 -2.384 1.00 . A A . 29 LYS HE3 1 1 22 16149 1 1 29 LYS HG2 H -12.482 7.542 -0.266 1.00 . A A . 29 LYS HG2 1 1 22 16150 1 1 29 LYS HG3 H -10.775 7.556 -0.648 1.00 . A A . 29 LYS HG3 1 1 22 16151 1 1 29 LYS HZ1 H -10.078 7.447 -3.751 1.00 . A A . 29 LYS HZ1 1 1 22 16152 1 1 29 LYS HZ2 H -10.326 9.065 -4.137 1.00 . A A . 29 LYS HZ2 1 1 22 16153 1 1 29 LYS N N -9.457 4.628 -1.016 1.00 . A A . 29 LYS N 1 1 22 16154 1 1 29 LYS NZ N -10.422 8.353 -3.400 1.00 . A A . 29 LYS NZ 1 1 22 16155 1 1 29 LYS O O -11.023 3.579 1.752 1.00 . A A . 29 LYS O 1 1 22 16156 1 1 30 ALA C C -8.110 3.582 3.809 1.00 . A A . 30 ALA C 1 1 22 16157 1 1 30 ALA CA C -8.370 2.783 2.531 1.00 . A A . 30 ALA CA 1 1 22 16158 1 1 30 ALA CB C -7.094 2.089 2.057 1.00 . A A . 30 ALA CB 1 1 22 16159 1 1 30 ALA H H -8.042 4.176 0.988 1.00 . A A . 30 ALA H 1 1 22 16160 1 1 30 ALA HA H -9.149 2.043 2.706 1.00 . A A . 30 ALA HA 1 1 22 16161 1 1 30 ALA HB1 H -7.248 1.669 1.063 1.00 . A A . 30 ALA HB1 1 1 22 16162 1 1 30 ALA HB2 H -6.284 2.815 2.019 1.00 . A A . 30 ALA HB2 1 1 22 16163 1 1 30 ALA HB3 H -6.819 1.291 2.737 1.00 . A A . 30 ALA HB3 1 1 22 16164 1 1 30 ALA N N -8.781 3.692 1.485 1.00 . A A . 30 ALA N 1 1 22 16165 1 1 30 ALA O O -7.959 4.800 3.765 1.00 . A A . 30 ALA O 1 1 22 16166 1 1 31 SER C C -6.215 4.014 6.167 1.00 . A A . 31 SER C 1 1 22 16167 1 1 31 SER CA C -7.650 3.492 6.214 1.00 . A A . 31 SER CA 1 1 22 16168 1 1 31 SER CB C -7.824 2.415 7.275 1.00 . A A . 31 SER CB 1 1 22 16169 1 1 31 SER H H -8.074 1.891 4.986 1.00 . A A . 31 SER H 1 1 22 16170 1 1 31 SER HA H -8.327 4.311 6.446 1.00 . A A . 31 SER HA 1 1 22 16171 1 1 31 SER HB2 H -7.062 1.653 7.137 1.00 . A A . 31 SER HB2 1 1 22 16172 1 1 31 SER HB3 H -7.670 2.868 8.242 1.00 . A A . 31 SER HB3 1 1 22 16173 1 1 31 SER HG H -9.757 2.543 7.095 1.00 . A A . 31 SER HG 1 1 22 16174 1 1 31 SER N N -8.016 2.901 4.953 1.00 . A A . 31 SER N 1 1 22 16175 1 1 31 SER O O -5.939 5.115 6.635 1.00 . A A . 31 SER O 1 1 22 16176 1 1 31 SER OG O -9.114 1.831 7.180 1.00 . A A . 31 SER OG 1 1 22 16177 1 1 32 HIS C C -3.335 2.847 4.195 1.00 . A A . 32 HIS C 1 1 22 16178 1 1 32 HIS CA C -3.954 3.709 5.286 1.00 . A A . 32 HIS CA 1 1 22 16179 1 1 32 HIS CB C -3.050 3.772 6.533 1.00 . A A . 32 HIS CB 1 1 22 16180 1 1 32 HIS CD2 C -3.072 1.336 7.297 1.00 . A A . 32 HIS CD2 1 1 22 16181 1 1 32 HIS CE1 C -0.950 0.893 7.288 1.00 . A A . 32 HIS CE1 1 1 22 16182 1 1 32 HIS CG C -2.421 2.463 6.920 1.00 . A A . 32 HIS CG 1 1 22 16183 1 1 32 HIS H H -5.581 2.354 5.168 1.00 . A A . 32 HIS H 1 1 22 16184 1 1 32 HIS HA H -4.053 4.713 4.888 1.00 . A A . 32 HIS HA 1 1 22 16185 1 1 32 HIS HB2 H -2.236 4.447 6.339 1.00 . A A . 32 HIS HB2 1 1 22 16186 1 1 32 HIS HB3 H -3.606 4.174 7.379 1.00 . A A . 32 HIS HB3 1 1 22 16187 1 1 32 HIS HD1 H -0.316 2.762 6.519 1.00 . A A . 32 HIS HD1 1 1 22 16188 1 1 32 HIS HD2 H -4.136 1.285 7.246 1.00 . A A . 32 HIS HD2 1 1 22 16189 1 1 32 HIS HE1 H -0.022 0.346 7.352 1.00 . A A . 32 HIS HE1 1 1 22 16190 1 1 32 HIS N N -5.293 3.230 5.597 1.00 . A A . 32 HIS N 1 1 22 16191 1 1 32 HIS ND1 N -1.062 2.176 6.891 1.00 . A A . 32 HIS ND1 1 1 22 16192 1 1 32 HIS NE2 N -2.147 0.353 7.566 1.00 . A A . 32 HIS NE2 1 1 22 16193 1 1 32 HIS O O -3.960 1.901 3.713 1.00 . A A . 32 HIS O 1 1 22 16194 1 1 33 GLY C C 0.164 2.191 3.837 1.00 . A A . 33 GLY C 1 1 22 16195 1 1 33 GLY CA C -1.180 2.297 3.133 1.00 . A A . 33 GLY CA 1 1 22 16196 1 1 33 GLY H H -1.634 3.936 4.342 1.00 . A A . 33 GLY H 1 1 22 16197 1 1 33 GLY HA2 H -1.618 1.327 3.081 1.00 . A A . 33 GLY HA2 1 1 22 16198 1 1 33 GLY HA3 H -1.038 2.640 2.118 1.00 . A A . 33 GLY HA3 1 1 22 16199 1 1 33 GLY N N -2.074 3.152 3.884 1.00 . A A . 33 GLY N 1 1 22 16200 1 1 33 GLY O O 0.417 2.951 4.778 1.00 . A A . 33 GLY O 1 1 22 16201 1 1 34 ALA C C 3.164 0.177 2.948 1.00 . A A . 34 ALA C 1 1 22 16202 1 1 34 ALA CA C 2.356 1.064 3.909 1.00 . A A . 34 ALA CA 1 1 22 16203 1 1 34 ALA CB C 2.305 0.476 5.325 1.00 . A A . 34 ALA CB 1 1 22 16204 1 1 34 ALA H H 0.680 0.608 2.680 1.00 . A A . 34 ALA H 1 1 22 16205 1 1 34 ALA HA H 2.817 2.047 3.954 1.00 . A A . 34 ALA HA 1 1 22 16206 1 1 34 ALA HB1 H 1.713 -0.439 5.328 1.00 . A A . 34 ALA HB1 1 1 22 16207 1 1 34 ALA HB2 H 3.311 0.260 5.679 1.00 . A A . 34 ALA HB2 1 1 22 16208 1 1 34 ALA HB3 H 1.844 1.190 6.008 1.00 . A A . 34 ALA HB3 1 1 22 16209 1 1 34 ALA N N 0.996 1.236 3.418 1.00 . A A . 34 ALA N 1 1 22 16210 1 1 34 ALA O O 2.601 -0.762 2.378 1.00 . A A . 34 ALA O 1 1 22 16211 1 1 35 CYS C C 5.693 -1.664 2.681 1.00 . A A . 35 CYS C 1 1 22 16212 1 1 35 CYS CA C 5.354 -0.357 1.938 1.00 . A A . 35 CYS CA 1 1 22 16213 1 1 35 CYS CB C 6.683 0.376 1.710 1.00 . A A . 35 CYS CB 1 1 22 16214 1 1 35 CYS H H 4.894 1.249 3.226 1.00 . A A . 35 CYS H 1 1 22 16215 1 1 35 CYS HA H 4.887 -0.531 0.969 1.00 . A A . 35 CYS HA 1 1 22 16216 1 1 35 CYS HB2 H 7.130 0.607 2.678 1.00 . A A . 35 CYS HB2 1 1 22 16217 1 1 35 CYS HB3 H 7.324 -0.336 1.218 1.00 . A A . 35 CYS HB3 1 1 22 16218 1 1 35 CYS N N 4.464 0.453 2.764 1.00 . A A . 35 CYS N 1 1 22 16219 1 1 35 CYS O O 5.867 -1.635 3.900 1.00 . A A . 35 CYS O 1 1 22 16220 1 1 35 CYS SG S 6.820 1.866 0.688 1.00 . A A . 35 CYS SG 1 1 22 16221 1 1 36 HIS C C 7.194 -4.809 1.503 1.00 . A A . 36 HIS C 1 1 22 16222 1 1 36 HIS CA C 6.400 -4.046 2.555 1.00 . A A . 36 HIS CA 1 1 22 16223 1 1 36 HIS CB C 5.328 -5.036 2.995 1.00 . A A . 36 HIS CB 1 1 22 16224 1 1 36 HIS CD2 C 2.822 -4.765 3.356 1.00 . A A . 36 HIS CD2 1 1 22 16225 1 1 36 HIS CE1 C 2.865 -3.329 4.999 1.00 . A A . 36 HIS CE1 1 1 22 16226 1 1 36 HIS CG C 4.115 -4.453 3.634 1.00 . A A . 36 HIS CG 1 1 22 16227 1 1 36 HIS H H 5.593 -2.812 1.003 1.00 . A A . 36 HIS H 1 1 22 16228 1 1 36 HIS HA H 7.016 -3.825 3.421 1.00 . A A . 36 HIS HA 1 1 22 16229 1 1 36 HIS HB2 H 4.988 -5.598 2.124 1.00 . A A . 36 HIS HB2 1 1 22 16230 1 1 36 HIS HB3 H 5.775 -5.753 3.685 1.00 . A A . 36 HIS HB3 1 1 22 16231 1 1 36 HIS HD1 H 4.947 -2.937 4.904 1.00 . A A . 36 HIS HD1 1 1 22 16232 1 1 36 HIS HD2 H 2.549 -5.448 2.561 1.00 . A A . 36 HIS HD2 1 1 22 16233 1 1 36 HIS HE1 H 2.557 -2.646 5.777 1.00 . A A . 36 HIS HE1 1 1 22 16234 1 1 36 HIS N N 5.836 -2.807 1.991 1.00 . A A . 36 HIS N 1 1 22 16235 1 1 36 HIS ND1 N 4.138 -3.489 4.619 1.00 . A A . 36 HIS ND1 1 1 22 16236 1 1 36 HIS NE2 N 2.039 -4.130 4.299 1.00 . A A . 36 HIS NE2 1 1 22 16237 1 1 36 HIS O O 6.733 -4.888 0.370 1.00 . A A . 36 HIS O 1 1 22 16238 1 1 37 LYS C C 8.355 -7.693 0.845 1.00 . A A . 37 LYS C 1 1 22 16239 1 1 37 LYS CA C 9.015 -6.324 0.942 1.00 . A A . 37 LYS CA 1 1 22 16240 1 1 37 LYS CB C 10.486 -6.440 1.340 1.00 . A A . 37 LYS CB 1 1 22 16241 1 1 37 LYS CD C 12.631 -7.728 0.815 1.00 . A A . 37 LYS CD 1 1 22 16242 1 1 37 LYS CE C 13.711 -6.686 1.123 1.00 . A A . 37 LYS CE 1 1 22 16243 1 1 37 LYS CG C 11.351 -7.091 0.249 1.00 . A A . 37 LYS CG 1 1 22 16244 1 1 37 LYS H H 8.569 -5.467 2.848 1.00 . A A . 37 LYS H 1 1 22 16245 1 1 37 LYS HA H 9.027 -5.857 -0.033 1.00 . A A . 37 LYS HA 1 1 22 16246 1 1 37 LYS HB2 H 10.844 -5.442 1.473 1.00 . A A . 37 LYS HB2 1 1 22 16247 1 1 37 LYS HB3 H 10.566 -6.953 2.292 1.00 . A A . 37 LYS HB3 1 1 22 16248 1 1 37 LYS HD2 H 12.372 -8.291 1.715 1.00 . A A . 37 LYS HD2 1 1 22 16249 1 1 37 LYS HD3 H 13.018 -8.430 0.076 1.00 . A A . 37 LYS HD3 1 1 22 16250 1 1 37 LYS HE2 H 14.001 -6.211 0.181 1.00 . A A . 37 LYS HE2 1 1 22 16251 1 1 37 LYS HE3 H 13.300 -5.935 1.800 1.00 . A A . 37 LYS HE3 1 1 22 16252 1 1 37 LYS HG2 H 10.778 -7.882 -0.198 1.00 . A A . 37 LYS HG2 1 1 22 16253 1 1 37 LYS HG3 H 11.553 -6.391 -0.565 1.00 . A A . 37 LYS HG3 1 1 22 16254 1 1 37 LYS HZ1 H 14.935 -8.294 1.554 1.00 . A A . 37 LYS HZ1 1 1 22 16255 1 1 37 LYS HZ2 H 15.757 -6.837 1.377 1.00 . A A . 37 LYS HZ2 1 1 22 16256 1 1 37 LYS N N 8.280 -5.487 1.882 1.00 . A A . 37 LYS N 1 1 22 16257 1 1 37 LYS NZ N 14.909 -7.284 1.755 1.00 . A A . 37 LYS NZ 1 1 22 16258 1 1 37 LYS O O 8.249 -8.419 1.830 1.00 . A A . 37 LYS O 1 1 22 16259 1 1 38 ARG C C 8.356 -9.756 -1.972 1.00 . A A . 38 ARG C 1 1 22 16260 1 1 38 ARG CA C 7.491 -9.357 -0.777 1.00 . A A . 38 ARG CA 1 1 22 16261 1 1 38 ARG CB C 6.002 -9.269 -1.152 1.00 . A A . 38 ARG CB 1 1 22 16262 1 1 38 ARG CD C 5.298 -11.719 -0.832 1.00 . A A . 38 ARG CD 1 1 22 16263 1 1 38 ARG CG C 5.436 -10.539 -1.804 1.00 . A A . 38 ARG CG 1 1 22 16264 1 1 38 ARG CZ C 4.567 -14.118 -1.099 1.00 . A A . 38 ARG CZ 1 1 22 16265 1 1 38 ARG H H 8.095 -7.361 -1.118 1.00 . A A . 38 ARG H 1 1 22 16266 1 1 38 ARG HA H 7.625 -10.071 0.038 1.00 . A A . 38 ARG HA 1 1 22 16267 1 1 38 ARG HB2 H 5.421 -9.024 -0.263 1.00 . A A . 38 ARG HB2 1 1 22 16268 1 1 38 ARG HB3 H 5.884 -8.456 -1.871 1.00 . A A . 38 ARG HB3 1 1 22 16269 1 1 38 ARG HD2 H 6.218 -11.854 -0.263 1.00 . A A . 38 ARG HD2 1 1 22 16270 1 1 38 ARG HD3 H 4.482 -11.496 -0.143 1.00 . A A . 38 ARG HD3 1 1 22 16271 1 1 38 ARG HG2 H 4.442 -10.305 -2.190 1.00 . A A . 38 ARG HG2 1 1 22 16272 1 1 38 ARG HG3 H 6.057 -10.824 -2.654 1.00 . A A . 38 ARG HG3 1 1 22 16273 1 1 38 ARG HH11 H 4.278 -13.428 0.794 1.00 . A A . 38 ARG HH11 1 1 22 16274 1 1 38 ARG HH12 H 3.840 -15.092 0.559 1.00 . A A . 38 ARG HH12 1 1 22 16275 1 1 38 ARG HH21 H 4.857 -15.057 -2.868 1.00 . A A . 38 ARG HH21 1 1 22 16276 1 1 38 ARG HH22 H 4.132 -16.065 -1.635 1.00 . A A . 38 ARG HH22 1 1 22 16277 1 1 38 ARG N N 7.955 -8.041 -0.376 1.00 . A A . 38 ARG N 1 1 22 16278 1 1 38 ARG NE N 5.036 -12.958 -1.582 1.00 . A A . 38 ARG NE 1 1 22 16279 1 1 38 ARG NH1 N 4.198 -14.226 0.183 1.00 . A A . 38 ARG NH1 1 1 22 16280 1 1 38 ARG NH2 N 4.492 -15.167 -1.923 1.00 . A A . 38 ARG NH2 1 1 22 16281 1 1 38 ARG O O 8.392 -9.023 -2.957 1.00 . A A . 38 ARG O 1 1 22 16282 1 1 39 GLU C C 10.732 -10.359 -3.604 1.00 . A A . 39 GLU C 1 1 22 16283 1 1 39 GLU CA C 9.852 -11.445 -2.982 1.00 . A A . 39 GLU CA 1 1 22 16284 1 1 39 GLU CB C 8.917 -12.100 -4.012 1.00 . A A . 39 GLU CB 1 1 22 16285 1 1 39 GLU CD C 7.161 -13.920 -4.343 1.00 . A A . 39 GLU CD 1 1 22 16286 1 1 39 GLU CG C 8.243 -13.351 -3.426 1.00 . A A . 39 GLU CG 1 1 22 16287 1 1 39 GLU H H 9.016 -11.423 -1.026 1.00 . A A . 39 GLU H 1 1 22 16288 1 1 39 GLU HA H 10.513 -12.217 -2.585 1.00 . A A . 39 GLU HA 1 1 22 16289 1 1 39 GLU HB2 H 8.160 -11.377 -4.325 1.00 . A A . 39 GLU HB2 1 1 22 16290 1 1 39 GLU HB3 H 9.503 -12.382 -4.887 1.00 . A A . 39 GLU HB3 1 1 22 16291 1 1 39 GLU HG2 H 8.994 -14.123 -3.254 1.00 . A A . 39 GLU HG2 1 1 22 16292 1 1 39 GLU HG3 H 7.781 -13.108 -2.471 1.00 . A A . 39 GLU HG3 1 1 22 16293 1 1 39 GLU N N 9.060 -10.893 -1.884 1.00 . A A . 39 GLU N 1 1 22 16294 1 1 39 GLU O O 10.512 -9.954 -4.744 1.00 . A A . 39 GLU O 1 1 22 16295 1 1 39 GLU OE1 O 7.549 -14.269 -5.600 1.00 . A A . 39 GLU OE1 1 1 22 16296 1 1 39 GLU OE2 O 6.015 -14.034 -3.905 1.00 . A A . 39 GLU OE2 1 1 22 16297 1 1 40 ASN C C 11.888 -7.370 -3.240 1.00 . A A . 40 ASN C 1 1 22 16298 1 1 40 ASN CA C 12.586 -8.733 -3.143 1.00 . A A . 40 ASN CA 1 1 22 16299 1 1 40 ASN CB C 13.411 -9.060 -4.403 1.00 . A A . 40 ASN CB 1 1 22 16300 1 1 40 ASN CG C 13.987 -7.812 -5.071 1.00 . A A . 40 ASN CG 1 1 22 16301 1 1 40 ASN H H 11.729 -10.214 -1.884 1.00 . A A . 40 ASN H 1 1 22 16302 1 1 40 ASN HA H 13.297 -8.632 -2.320 1.00 . A A . 40 ASN HA 1 1 22 16303 1 1 40 ASN HB2 H 14.212 -9.747 -4.129 1.00 . A A . 40 ASN HB2 1 1 22 16304 1 1 40 ASN HB3 H 12.806 -9.551 -5.160 1.00 . A A . 40 ASN HB3 1 1 22 16305 1 1 40 ASN HD21 H 15.708 -7.905 -3.978 1.00 . A A . 40 ASN HD21 1 1 22 16306 1 1 40 ASN HD22 H 15.577 -6.576 -5.111 1.00 . A A . 40 ASN HD22 1 1 22 16307 1 1 40 ASN N N 11.671 -9.830 -2.809 1.00 . A A . 40 ASN N 1 1 22 16308 1 1 40 ASN ND2 N 15.187 -7.400 -4.678 1.00 . A A . 40 ASN ND2 1 1 22 16309 1 1 40 ASN O O 12.509 -6.347 -2.968 1.00 . A A . 40 ASN O 1 1 22 16310 1 1 40 ASN OD1 O 13.352 -7.225 -5.945 1.00 . A A . 40 ASN OD1 1 1 22 16311 1 1 41 HIS C C 9.168 -5.501 -2.914 1.00 . A A . 41 HIS C 1 1 22 16312 1 1 41 HIS CA C 9.938 -6.136 -4.049 1.00 . A A . 41 HIS CA 1 1 22 16313 1 1 41 HIS CB C 9.027 -6.449 -5.236 1.00 . A A . 41 HIS CB 1 1 22 16314 1 1 41 HIS CD2 C 10.095 -7.843 -7.166 1.00 . A A . 41 HIS CD2 1 1 22 16315 1 1 41 HIS CE1 C 11.300 -6.244 -8.050 1.00 . A A . 41 HIS CE1 1 1 22 16316 1 1 41 HIS CG C 9.860 -6.686 -6.470 1.00 . A A . 41 HIS CG 1 1 22 16317 1 1 41 HIS H H 10.075 -8.200 -3.598 1.00 . A A . 41 HIS H 1 1 22 16318 1 1 41 HIS HA H 10.678 -5.424 -4.401 1.00 . A A . 41 HIS HA 1 1 22 16319 1 1 41 HIS HB2 H 8.408 -7.314 -4.991 1.00 . A A . 41 HIS HB2 1 1 22 16320 1 1 41 HIS HB3 H 8.358 -5.602 -5.405 1.00 . A A . 41 HIS HB3 1 1 22 16321 1 1 41 HIS HD1 H 10.648 -4.703 -6.742 1.00 . A A . 41 HIS HD1 1 1 22 16322 1 1 41 HIS HD2 H 9.696 -8.820 -6.932 1.00 . A A . 41 HIS HD2 1 1 22 16323 1 1 41 HIS HE1 H 12.008 -5.719 -8.676 1.00 . A A . 41 HIS HE1 1 1 22 16324 1 1 41 HIS N N 10.607 -7.340 -3.601 1.00 . A A . 41 HIS N 1 1 22 16325 1 1 41 HIS ND1 N 10.600 -5.672 -7.057 1.00 . A A . 41 HIS ND1 1 1 22 16326 1 1 41 HIS NE2 N 11.018 -7.555 -8.155 1.00 . A A . 41 HIS NE2 1 1 22 16327 1 1 41 HIS O O 8.205 -6.070 -2.409 1.00 . A A . 41 HIS O 1 1 22 16328 1 1 42 TRP C C 7.511 -3.077 -2.464 1.00 . A A . 42 TRP C 1 1 22 16329 1 1 42 TRP CA C 8.783 -3.436 -1.707 1.00 . A A . 42 TRP CA 1 1 22 16330 1 1 42 TRP CB C 9.630 -2.253 -1.248 1.00 . A A . 42 TRP CB 1 1 22 16331 1 1 42 TRP CD1 C 11.854 -3.208 -0.526 1.00 . A A . 42 TRP CD1 1 1 22 16332 1 1 42 TRP CD2 C 10.554 -2.665 1.212 1.00 . A A . 42 TRP CD2 1 1 22 16333 1 1 42 TRP CE2 C 11.750 -3.226 1.742 1.00 . A A . 42 TRP CE2 1 1 22 16334 1 1 42 TRP CE3 C 9.520 -2.386 2.128 1.00 . A A . 42 TRP CE3 1 1 22 16335 1 1 42 TRP CG C 10.656 -2.663 -0.241 1.00 . A A . 42 TRP CG 1 1 22 16336 1 1 42 TRP CH2 C 10.845 -3.233 3.987 1.00 . A A . 42 TRP CH2 1 1 22 16337 1 1 42 TRP CZ2 C 11.895 -3.532 3.102 1.00 . A A . 42 TRP CZ2 1 1 22 16338 1 1 42 TRP CZ3 C 9.678 -2.622 3.504 1.00 . A A . 42 TRP CZ3 1 1 22 16339 1 1 42 TRP H H 10.367 -3.884 -3.029 1.00 . A A . 42 TRP H 1 1 22 16340 1 1 42 TRP HA H 8.515 -3.962 -0.804 1.00 . A A . 42 TRP HA 1 1 22 16341 1 1 42 TRP HB2 H 10.112 -1.771 -2.096 1.00 . A A . 42 TRP HB2 1 1 22 16342 1 1 42 TRP HB3 H 8.995 -1.520 -0.769 1.00 . A A . 42 TRP HB3 1 1 22 16343 1 1 42 TRP HD1 H 12.185 -3.455 -1.521 1.00 . A A . 42 TRP HD1 1 1 22 16344 1 1 42 TRP HE1 H 13.428 -3.948 0.699 1.00 . A A . 42 TRP HE1 1 1 22 16345 1 1 42 TRP HE3 H 8.572 -2.054 1.755 1.00 . A A . 42 TRP HE3 1 1 22 16346 1 1 42 TRP HH2 H 10.905 -3.515 5.026 1.00 . A A . 42 TRP HH2 1 1 22 16347 1 1 42 TRP HZ2 H 12.747 -4.106 3.426 1.00 . A A . 42 TRP HZ2 1 1 22 16348 1 1 42 TRP HZ3 H 8.876 -2.379 4.187 1.00 . A A . 42 TRP HZ3 1 1 22 16349 1 1 42 TRP N N 9.581 -4.293 -2.550 1.00 . A A . 42 TRP N 1 1 22 16350 1 1 42 TRP NE1 N 12.527 -3.506 0.638 1.00 . A A . 42 TRP NE1 1 1 22 16351 1 1 42 TRP O O 7.583 -2.459 -3.517 1.00 . A A . 42 TRP O 1 1 22 16352 1 1 43 LYS C C 4.385 -2.257 -1.576 1.00 . A A . 43 LYS C 1 1 22 16353 1 1 43 LYS CA C 5.044 -3.232 -2.526 1.00 . A A . 43 LYS CA 1 1 22 16354 1 1 43 LYS CB C 4.199 -4.507 -2.549 1.00 . A A . 43 LYS CB 1 1 22 16355 1 1 43 LYS CD C 5.617 -5.502 -4.425 1.00 . A A . 43 LYS CD 1 1 22 16356 1 1 43 LYS CE C 4.603 -5.415 -5.588 1.00 . A A . 43 LYS CE 1 1 22 16357 1 1 43 LYS CG C 4.993 -5.707 -3.032 1.00 . A A . 43 LYS CG 1 1 22 16358 1 1 43 LYS H H 6.366 -4.193 -1.225 1.00 . A A . 43 LYS H 1 1 22 16359 1 1 43 LYS HA H 5.119 -2.812 -3.529 1.00 . A A . 43 LYS HA 1 1 22 16360 1 1 43 LYS HB2 H 3.914 -4.726 -1.527 1.00 . A A . 43 LYS HB2 1 1 22 16361 1 1 43 LYS HB3 H 3.289 -4.381 -3.124 1.00 . A A . 43 LYS HB3 1 1 22 16362 1 1 43 LYS HD2 H 6.297 -4.650 -4.444 1.00 . A A . 43 LYS HD2 1 1 22 16363 1 1 43 LYS HD3 H 6.218 -6.396 -4.597 1.00 . A A . 43 LYS HD3 1 1 22 16364 1 1 43 LYS HE2 H 5.148 -5.648 -6.506 1.00 . A A . 43 LYS HE2 1 1 22 16365 1 1 43 LYS HE3 H 3.836 -6.183 -5.461 1.00 . A A . 43 LYS HE3 1 1 22 16366 1 1 43 LYS HG2 H 5.686 -5.924 -2.211 1.00 . A A . 43 LYS HG2 1 1 22 16367 1 1 43 LYS HG3 H 4.377 -6.587 -3.091 1.00 . A A . 43 LYS HG3 1 1 22 16368 1 1 43 LYS HZ1 H 4.275 -3.684 -6.679 1.00 . A A . 43 LYS HZ1 1 1 22 16369 1 1 43 LYS HZ2 H 2.933 -4.206 -5.809 1.00 . A A . 43 LYS HZ2 1 1 22 16370 1 1 43 LYS N N 6.356 -3.537 -1.995 1.00 . A A . 43 LYS N 1 1 22 16371 1 1 43 LYS NZ N 3.957 -4.090 -5.788 1.00 . A A . 43 LYS NZ 1 1 22 16372 1 1 43 LYS O O 4.409 -2.473 -0.365 1.00 . A A . 43 LYS O 1 1 22 16373 1 1 44 CYS C C 1.567 -1.391 -1.171 1.00 . A A . 44 CYS C 1 1 22 16374 1 1 44 CYS CA C 2.769 -0.479 -1.361 1.00 . A A . 44 CYS CA 1 1 22 16375 1 1 44 CYS CB C 2.397 0.776 -2.134 1.00 . A A . 44 CYS CB 1 1 22 16376 1 1 44 CYS H H 3.753 -1.115 -3.122 1.00 . A A . 44 CYS H 1 1 22 16377 1 1 44 CYS HA H 3.178 -0.188 -0.395 1.00 . A A . 44 CYS HA 1 1 22 16378 1 1 44 CYS HB2 H 3.265 1.428 -2.156 1.00 . A A . 44 CYS HB2 1 1 22 16379 1 1 44 CYS HB3 H 2.128 0.493 -3.145 1.00 . A A . 44 CYS HB3 1 1 22 16380 1 1 44 CYS N N 3.746 -1.228 -2.119 1.00 . A A . 44 CYS N 1 1 22 16381 1 1 44 CYS O O 1.100 -1.973 -2.148 1.00 . A A . 44 CYS O 1 1 22 16382 1 1 44 CYS SG S 1.023 1.705 -1.432 1.00 . A A . 44 CYS SG 1 1 22 16383 1 1 45 PHE C C -1.057 -1.239 1.000 1.00 . A A . 45 PHE C 1 1 22 16384 1 1 45 PHE CA C -0.111 -2.272 0.398 1.00 . A A . 45 PHE CA 1 1 22 16385 1 1 45 PHE CB C 0.178 -3.381 1.412 1.00 . A A . 45 PHE CB 1 1 22 16386 1 1 45 PHE CD1 C 1.766 -4.969 0.222 1.00 . A A . 45 PHE CD1 1 1 22 16387 1 1 45 PHE CD2 C -0.420 -5.782 0.897 1.00 . A A . 45 PHE CD2 1 1 22 16388 1 1 45 PHE CE1 C 2.124 -6.278 -0.162 1.00 . A A . 45 PHE CE1 1 1 22 16389 1 1 45 PHE CE2 C -0.081 -7.076 0.471 1.00 . A A . 45 PHE CE2 1 1 22 16390 1 1 45 PHE CG C 0.517 -4.736 0.820 1.00 . A A . 45 PHE CG 1 1 22 16391 1 1 45 PHE CZ C 1.200 -7.328 -0.041 1.00 . A A . 45 PHE CZ 1 1 22 16392 1 1 45 PHE H H 1.590 -1.104 0.839 1.00 . A A . 45 PHE H 1 1 22 16393 1 1 45 PHE HA H -0.574 -2.701 -0.493 1.00 . A A . 45 PHE HA 1 1 22 16394 1 1 45 PHE HB2 H 0.983 -3.036 2.053 1.00 . A A . 45 PHE HB2 1 1 22 16395 1 1 45 PHE HB3 H -0.685 -3.515 2.056 1.00 . A A . 45 PHE HB3 1 1 22 16396 1 1 45 PHE HD1 H 2.474 -4.158 0.137 1.00 . A A . 45 PHE HD1 1 1 22 16397 1 1 45 PHE HD2 H -1.415 -5.585 1.251 1.00 . A A . 45 PHE HD2 1 1 22 16398 1 1 45 PHE HE1 H 3.117 -6.497 -0.522 1.00 . A A . 45 PHE HE1 1 1 22 16399 1 1 45 PHE HE2 H -0.806 -7.875 0.538 1.00 . A A . 45 PHE HE2 1 1 22 16400 1 1 45 PHE HZ H 1.473 -8.330 -0.345 1.00 . A A . 45 PHE HZ 1 1 22 16401 1 1 45 PHE N N 1.121 -1.576 0.070 1.00 . A A . 45 PHE N 1 1 22 16402 1 1 45 PHE O O -0.597 -0.329 1.691 1.00 . A A . 45 PHE O 1 1 22 16403 1 1 46 CYS C C -4.264 -1.387 2.216 1.00 . A A . 46 CYS C 1 1 22 16404 1 1 46 CYS CA C -3.434 -0.561 1.252 1.00 . A A . 46 CYS CA 1 1 22 16405 1 1 46 CYS CB C -4.337 -0.116 0.098 1.00 . A A . 46 CYS CB 1 1 22 16406 1 1 46 CYS H H -2.639 -2.245 0.263 1.00 . A A . 46 CYS H 1 1 22 16407 1 1 46 CYS HA H -3.065 0.301 1.815 1.00 . A A . 46 CYS HA 1 1 22 16408 1 1 46 CYS HB2 H -4.787 -0.997 -0.352 1.00 . A A . 46 CYS HB2 1 1 22 16409 1 1 46 CYS HB3 H -5.137 0.471 0.530 1.00 . A A . 46 CYS HB3 1 1 22 16410 1 1 46 CYS N N -2.357 -1.402 0.751 1.00 . A A . 46 CYS N 1 1 22 16411 1 1 46 CYS O O -4.287 -2.608 2.109 1.00 . A A . 46 CYS O 1 1 22 16412 1 1 46 CYS SG S -3.619 0.869 -1.238 1.00 . A A . 46 CYS SG 1 1 22 16413 1 1 47 TYR C C -6.924 -0.720 4.529 1.00 . A A . 47 TYR C 1 1 22 16414 1 1 47 TYR CA C -5.557 -1.354 4.311 1.00 . A A . 47 TYR CA 1 1 22 16415 1 1 47 TYR CB C -4.684 -1.053 5.528 1.00 . A A . 47 TYR CB 1 1 22 16416 1 1 47 TYR CD1 C -2.248 -1.350 4.878 1.00 . A A . 47 TYR CD1 1 1 22 16417 1 1 47 TYR CD2 C -3.275 -2.918 6.434 1.00 . A A . 47 TYR CD2 1 1 22 16418 1 1 47 TYR CE1 C -0.997 -1.948 5.107 1.00 . A A . 47 TYR CE1 1 1 22 16419 1 1 47 TYR CE2 C -2.020 -3.484 6.694 1.00 . A A . 47 TYR CE2 1 1 22 16420 1 1 47 TYR CG C -3.375 -1.797 5.595 1.00 . A A . 47 TYR CG 1 1 22 16421 1 1 47 TYR CZ C -0.879 -2.971 6.060 1.00 . A A . 47 TYR CZ 1 1 22 16422 1 1 47 TYR H H -4.816 0.286 3.191 1.00 . A A . 47 TYR H 1 1 22 16423 1 1 47 TYR HA H -5.653 -2.429 4.200 1.00 . A A . 47 TYR HA 1 1 22 16424 1 1 47 TYR HB2 H -4.468 0.012 5.504 1.00 . A A . 47 TYR HB2 1 1 22 16425 1 1 47 TYR HB3 H -5.239 -1.256 6.444 1.00 . A A . 47 TYR HB3 1 1 22 16426 1 1 47 TYR HD1 H -2.329 -0.523 4.193 1.00 . A A . 47 TYR HD1 1 1 22 16427 1 1 47 TYR HD2 H -4.152 -3.323 6.914 1.00 . A A . 47 TYR HD2 1 1 22 16428 1 1 47 TYR HE1 H -0.135 -1.606 4.554 1.00 . A A . 47 TYR HE1 1 1 22 16429 1 1 47 TYR HE2 H -1.942 -4.309 7.388 1.00 . A A . 47 TYR HE2 1 1 22 16430 1 1 47 TYR HH H 0.280 -4.209 6.995 1.00 . A A . 47 TYR HH 1 1 22 16431 1 1 47 TYR N N -4.917 -0.725 3.166 1.00 . A A . 47 TYR N 1 1 22 16432 1 1 47 TYR O O -6.962 0.399 5.040 1.00 . A A . 47 TYR O 1 1 22 16433 1 1 47 TYR OH O 0.344 -3.462 6.390 1.00 . A A . 47 TYR OH 1 1 22 16434 1 1 48 PHE C C -9.919 -1.153 5.720 1.00 . A A . 48 PHE C 1 1 22 16435 1 1 48 PHE CA C -9.321 -0.733 4.375 1.00 . A A . 48 PHE CA 1 1 22 16436 1 1 48 PHE CB C -10.204 -1.237 3.230 1.00 . A A . 48 PHE CB 1 1 22 16437 1 1 48 PHE CD1 C -8.742 -1.100 1.146 1.00 . A A . 48 PHE CD1 1 1 22 16438 1 1 48 PHE CD2 C -10.748 0.277 1.272 1.00 . A A . 48 PHE CD2 1 1 22 16439 1 1 48 PHE CE1 C -8.459 -0.562 -0.119 1.00 . A A . 48 PHE CE1 1 1 22 16440 1 1 48 PHE CE2 C -10.493 0.768 -0.018 1.00 . A A . 48 PHE CE2 1 1 22 16441 1 1 48 PHE CG C -9.886 -0.675 1.853 1.00 . A A . 48 PHE CG 1 1 22 16442 1 1 48 PHE CZ C -9.354 0.337 -0.719 1.00 . A A . 48 PHE CZ 1 1 22 16443 1 1 48 PHE H H -8.029 -2.306 3.780 1.00 . A A . 48 PHE H 1 1 22 16444 1 1 48 PHE HA H -9.271 0.354 4.322 1.00 . A A . 48 PHE HA 1 1 22 16445 1 1 48 PHE HB2 H -10.160 -2.323 3.195 1.00 . A A . 48 PHE HB2 1 1 22 16446 1 1 48 PHE HB3 H -11.224 -1.001 3.474 1.00 . A A . 48 PHE HB3 1 1 22 16447 1 1 48 PHE HD1 H -8.071 -1.832 1.571 1.00 . A A . 48 PHE HD1 1 1 22 16448 1 1 48 PHE HD2 H -11.608 0.649 1.813 1.00 . A A . 48 PHE HD2 1 1 22 16449 1 1 48 PHE HE1 H -7.550 -0.834 -0.633 1.00 . A A . 48 PHE HE1 1 1 22 16450 1 1 48 PHE HE2 H -11.168 1.490 -0.458 1.00 . A A . 48 PHE HE2 1 1 22 16451 1 1 48 PHE HZ H -9.168 0.699 -1.716 1.00 . A A . 48 PHE HZ 1 1 22 16452 1 1 48 PHE N N -8.037 -1.374 4.175 1.00 . A A . 48 PHE N 1 1 22 16453 1 1 48 PHE O O -9.416 -2.079 6.358 1.00 . A A . 48 PHE O 1 1 22 16454 1 1 49 ASN C C -10.990 -1.171 8.504 1.00 . A A . 49 ASN C 1 1 22 16455 1 1 49 ASN CA C -11.855 -0.823 7.283 1.00 . A A . 49 ASN CA 1 1 22 16456 1 1 49 ASN CB C -13.047 -1.767 7.064 1.00 . A A . 49 ASN CB 1 1 22 16457 1 1 49 ASN CG C -12.682 -3.147 6.540 1.00 . A A . 49 ASN CG 1 1 22 16458 1 1 49 ASN H H -11.423 0.133 5.437 1.00 . A A . 49 ASN H 1 1 22 16459 1 1 49 ASN HA H -12.303 0.140 7.537 1.00 . A A . 49 ASN HA 1 1 22 16460 1 1 49 ASN HB2 H -13.583 -1.884 8.007 1.00 . A A . 49 ASN HB2 1 1 22 16461 1 1 49 ASN HB3 H -13.735 -1.295 6.361 1.00 . A A . 49 ASN HB3 1 1 22 16462 1 1 49 ASN HD21 H -13.017 -2.538 4.629 1.00 . A A . 49 ASN HD21 1 1 22 16463 1 1 49 ASN HD22 H -12.608 -4.227 4.822 1.00 . A A . 49 ASN HD22 1 1 22 16464 1 1 49 ASN N N -11.081 -0.580 6.062 1.00 . A A . 49 ASN N 1 1 22 16465 1 1 49 ASN ND2 N -12.734 -3.303 5.221 1.00 . A A . 49 ASN ND2 1 1 22 16466 1 1 49 ASN O O -11.280 -2.137 9.214 1.00 . A A . 49 ASN O 1 1 22 16467 1 1 49 ASN OD1 O -12.417 -4.074 7.307 1.00 . A A . 49 ASN OD1 1 1 22 16468 1 1 50 CYS C C -9.277 -0.020 11.103 1.00 . A A . 50 CYS C 1 1 22 16469 1 1 50 CYS CA C -8.952 -0.722 9.791 1.00 . A A . 50 CYS CA 1 1 22 16470 1 1 50 CYS CB C -7.538 -0.416 9.321 1.00 . A A . 50 CYS CB 1 1 22 16471 1 1 50 CYS H H -9.724 0.381 8.134 1.00 . A A . 50 CYS H 1 1 22 16472 1 1 50 CYS HA H -8.968 -1.781 9.977 1.00 . A A . 50 CYS HA 1 1 22 16473 1 1 50 CYS HB2 H -7.376 -0.846 8.333 1.00 . A A . 50 CYS HB2 1 1 22 16474 1 1 50 CYS HB3 H -7.453 0.656 9.253 1.00 . A A . 50 CYS HB3 1 1 22 16475 1 1 50 CYS N N -9.924 -0.404 8.751 1.00 . A A . 50 CYS N 1 1 22 16476 1 1 50 CYS O O -9.565 -0.713 12.128 1.00 . A A . 50 CYS O 1 1 22 16477 1 1 50 CYS OXT O -9.261 1.247 11.172 1.00 . A A . 50 CYS OXT 1 1 22 16478 1 1 50 CYS SG S -6.203 -0.982 10.406 1.00 . A A . 50 CYS SG 1 1 23 16479 1 1 1 LEU C C -9.080 -5.039 8.791 1.00 . A A . 1 LEU C 1 1 23 16480 1 1 1 LEU CA C -10.102 -5.784 9.657 1.00 . A A . 1 LEU CA 1 1 23 16481 1 1 1 LEU CB C -10.015 -7.293 9.379 1.00 . A A . 1 LEU CB 1 1 23 16482 1 1 1 LEU CD1 C -12.304 -8.407 9.557 1.00 . A A . 1 LEU CD1 1 1 23 16483 1 1 1 LEU CD2 C -10.299 -9.504 10.535 1.00 . A A . 1 LEU CD2 1 1 23 16484 1 1 1 LEU CG C -10.956 -8.147 10.249 1.00 . A A . 1 LEU CG 1 1 23 16485 1 1 1 LEU H1 H -11.717 -5.370 8.452 1.00 . A A . 1 LEU H1 1 1 23 16486 1 1 1 LEU H2 H -12.124 -5.772 10.033 1.00 . A A . 1 LEU H2 1 1 23 16487 1 1 1 LEU H3 H -11.480 -4.257 9.690 1.00 . A A . 1 LEU H3 1 1 23 16488 1 1 1 LEU HA H -9.852 -5.613 10.706 1.00 . A A . 1 LEU HA 1 1 23 16489 1 1 1 LEU HB2 H -10.208 -7.490 8.323 1.00 . A A . 1 LEU HB2 1 1 23 16490 1 1 1 LEU HB3 H -8.987 -7.590 9.588 1.00 . A A . 1 LEU HB3 1 1 23 16491 1 1 1 LEU HD11 H -12.144 -8.943 8.621 1.00 . A A . 1 LEU HD11 1 1 23 16492 1 1 1 LEU HD12 H -12.932 -9.020 10.205 1.00 . A A . 1 LEU HD12 1 1 23 16493 1 1 1 LEU HD13 H -12.834 -7.481 9.346 1.00 . A A . 1 LEU HD13 1 1 23 16494 1 1 1 LEU HD21 H -10.084 -10.023 9.601 1.00 . A A . 1 LEU HD21 1 1 23 16495 1 1 1 LEU HD22 H -9.369 -9.359 11.087 1.00 . A A . 1 LEU HD22 1 1 23 16496 1 1 1 LEU HD23 H -10.967 -10.119 11.140 1.00 . A A . 1 LEU HD23 1 1 23 16497 1 1 1 LEU HG H -11.128 -7.654 11.205 1.00 . A A . 1 LEU HG 1 1 23 16498 1 1 1 LEU N N -11.457 -5.257 9.442 1.00 . A A . 1 LEU N 1 1 23 16499 1 1 1 LEU O O -9.380 -4.661 7.658 1.00 . A A . 1 LEU O 1 1 23 16500 1 1 2 CYS C C -6.170 -5.077 7.571 1.00 . A A . 2 CYS C 1 1 23 16501 1 1 2 CYS CA C -6.758 -4.171 8.656 1.00 . A A . 2 CYS CA 1 1 23 16502 1 1 2 CYS CB C -5.726 -3.694 9.699 1.00 . A A . 2 CYS CB 1 1 23 16503 1 1 2 CYS H H -7.688 -5.152 10.260 1.00 . A A . 2 CYS H 1 1 23 16504 1 1 2 CYS HA H -7.148 -3.280 8.161 1.00 . A A . 2 CYS HA 1 1 23 16505 1 1 2 CYS HB2 H -5.084 -4.537 9.964 1.00 . A A . 2 CYS HB2 1 1 23 16506 1 1 2 CYS HB3 H -5.106 -2.915 9.270 1.00 . A A . 2 CYS HB3 1 1 23 16507 1 1 2 CYS N N -7.868 -4.840 9.319 1.00 . A A . 2 CYS N 1 1 23 16508 1 1 2 CYS O O -5.037 -5.538 7.657 1.00 . A A . 2 CYS O 1 1 23 16509 1 1 2 CYS SG S -6.375 -3.075 11.276 1.00 . A A . 2 CYS SG 1 1 23 16510 1 1 3 ASN C C -5.646 -6.486 4.678 1.00 . A A . 3 ASN C 1 1 23 16511 1 1 3 ASN CA C -6.833 -6.491 5.647 1.00 . A A . 3 ASN CA 1 1 23 16512 1 1 3 ASN CB C -8.134 -6.633 4.835 1.00 . A A . 3 ASN CB 1 1 23 16513 1 1 3 ASN CG C -8.352 -5.499 3.833 1.00 . A A . 3 ASN CG 1 1 23 16514 1 1 3 ASN H H -7.859 -4.864 6.535 1.00 . A A . 3 ASN H 1 1 23 16515 1 1 3 ASN HA H -6.727 -7.370 6.282 1.00 . A A . 3 ASN HA 1 1 23 16516 1 1 3 ASN HB2 H -8.116 -7.583 4.298 1.00 . A A . 3 ASN HB2 1 1 23 16517 1 1 3 ASN HB3 H -8.994 -6.641 5.498 1.00 . A A . 3 ASN HB3 1 1 23 16518 1 1 3 ASN HD21 H -9.866 -6.519 2.944 1.00 . A A . 3 ASN HD21 1 1 23 16519 1 1 3 ASN HD22 H -9.562 -4.914 2.316 1.00 . A A . 3 ASN HD22 1 1 23 16520 1 1 3 ASN N N -6.952 -5.320 6.520 1.00 . A A . 3 ASN N 1 1 23 16521 1 1 3 ASN ND2 N -9.339 -5.658 2.955 1.00 . A A . 3 ASN ND2 1 1 23 16522 1 1 3 ASN O O -5.654 -7.279 3.741 1.00 . A A . 3 ASN O 1 1 23 16523 1 1 3 ASN OD1 O -7.684 -4.466 3.870 1.00 . A A . 3 ASN OD1 1 1 23 16524 1 1 4 GLU C C -3.335 -6.088 2.814 1.00 . A A . 4 GLU C 1 1 23 16525 1 1 4 GLU CA C -3.329 -5.673 4.290 1.00 . A A . 4 GLU CA 1 1 23 16526 1 1 4 GLU CB C -2.379 -6.539 5.137 1.00 . A A . 4 GLU CB 1 1 23 16527 1 1 4 GLU CD C -0.073 -7.336 4.189 1.00 . A A . 4 GLU CD 1 1 23 16528 1 1 4 GLU CG C -0.927 -6.193 4.756 1.00 . A A . 4 GLU CG 1 1 23 16529 1 1 4 GLU H H -4.713 -5.082 5.732 1.00 . A A . 4 GLU H 1 1 23 16530 1 1 4 GLU HA H -2.999 -4.634 4.344 1.00 . A A . 4 GLU HA 1 1 23 16531 1 1 4 GLU HB2 H -2.526 -6.286 6.187 1.00 . A A . 4 GLU HB2 1 1 23 16532 1 1 4 GLU HB3 H -2.603 -7.600 5.018 1.00 . A A . 4 GLU HB3 1 1 23 16533 1 1 4 GLU HG2 H -0.957 -5.368 4.045 1.00 . A A . 4 GLU HG2 1 1 23 16534 1 1 4 GLU HG3 H -0.425 -5.849 5.658 1.00 . A A . 4 GLU HG3 1 1 23 16535 1 1 4 GLU N N -4.658 -5.611 4.876 1.00 . A A . 4 GLU N 1 1 23 16536 1 1 4 GLU O O -2.996 -7.224 2.493 1.00 . A A . 4 GLU O 1 1 23 16537 1 1 4 GLU OE1 O -0.687 -8.279 3.422 1.00 . A A . 4 GLU OE1 1 1 23 16538 1 1 4 GLU OE2 O 1.136 -7.348 4.439 1.00 . A A . 4 GLU OE2 1 1 23 16539 1 1 5 ARG C C -2.933 -4.510 -0.323 1.00 . A A . 5 ARG C 1 1 23 16540 1 1 5 ARG CA C -3.833 -5.428 0.493 1.00 . A A . 5 ARG CA 1 1 23 16541 1 1 5 ARG CB C -5.311 -5.261 0.135 1.00 . A A . 5 ARG CB 1 1 23 16542 1 1 5 ARG CD C -7.450 -6.639 -0.072 1.00 . A A . 5 ARG CD 1 1 23 16543 1 1 5 ARG CG C -5.915 -6.637 -0.144 1.00 . A A . 5 ARG CG 1 1 23 16544 1 1 5 ARG CZ C -7.973 -4.828 -1.719 1.00 . A A . 5 ARG CZ 1 1 23 16545 1 1 5 ARG H H -3.724 -4.209 2.240 1.00 . A A . 5 ARG H 1 1 23 16546 1 1 5 ARG HA H -3.521 -6.447 0.278 1.00 . A A . 5 ARG HA 1 1 23 16547 1 1 5 ARG HB2 H -5.838 -4.788 0.964 1.00 . A A . 5 ARG HB2 1 1 23 16548 1 1 5 ARG HB3 H -5.404 -4.638 -0.756 1.00 . A A . 5 ARG HB3 1 1 23 16549 1 1 5 ARG HD2 H -7.860 -7.473 -0.646 1.00 . A A . 5 ARG HD2 1 1 23 16550 1 1 5 ARG HD3 H -7.722 -6.802 0.973 1.00 . A A . 5 ARG HD3 1 1 23 16551 1 1 5 ARG HG2 H -5.564 -6.957 -1.124 1.00 . A A . 5 ARG HG2 1 1 23 16552 1 1 5 ARG HG3 H -5.531 -7.335 0.602 1.00 . A A . 5 ARG HG3 1 1 23 16553 1 1 5 ARG HH11 H -7.165 -6.491 -2.580 1.00 . A A . 5 ARG HH11 1 1 23 16554 1 1 5 ARG HH12 H -7.299 -5.078 -3.616 1.00 . A A . 5 ARG HH12 1 1 23 16555 1 1 5 ARG HH21 H -8.689 -2.967 -1.214 1.00 . A A . 5 ARG HH21 1 1 23 16556 1 1 5 ARG HH22 H -8.183 -3.178 -2.873 1.00 . A A . 5 ARG HH22 1 1 23 16557 1 1 5 ARG N N -3.661 -5.165 1.917 1.00 . A A . 5 ARG N 1 1 23 16558 1 1 5 ARG NE N -8.041 -5.356 -0.483 1.00 . A A . 5 ARG NE 1 1 23 16559 1 1 5 ARG NH1 N -7.457 -5.537 -2.724 1.00 . A A . 5 ARG NH1 1 1 23 16560 1 1 5 ARG NH2 N -8.376 -3.580 -1.957 1.00 . A A . 5 ARG NH2 1 1 23 16561 1 1 5 ARG O O -2.588 -3.430 0.146 1.00 . A A . 5 ARG O 1 1 23 16562 1 1 6 PRO C C -1.603 -3.034 -2.814 1.00 . A A . 6 PRO C 1 1 23 16563 1 1 6 PRO CA C -1.309 -4.360 -2.108 1.00 . A A . 6 PRO CA 1 1 23 16564 1 1 6 PRO CB C -0.793 -5.414 -3.096 1.00 . A A . 6 PRO CB 1 1 23 16565 1 1 6 PRO CD C -2.874 -6.151 -2.218 1.00 . A A . 6 PRO CD 1 1 23 16566 1 1 6 PRO CG C -2.074 -6.129 -3.520 1.00 . A A . 6 PRO CG 1 1 23 16567 1 1 6 PRO HA H -0.581 -4.225 -1.313 1.00 . A A . 6 PRO HA 1 1 23 16568 1 1 6 PRO HB2 H -0.261 -4.989 -3.948 1.00 . A A . 6 PRO HB2 1 1 23 16569 1 1 6 PRO HB3 H -0.148 -6.119 -2.570 1.00 . A A . 6 PRO HB3 1 1 23 16570 1 1 6 PRO HD2 H -3.939 -6.157 -2.436 1.00 . A A . 6 PRO HD2 1 1 23 16571 1 1 6 PRO HD3 H -2.590 -7.037 -1.649 1.00 . A A . 6 PRO HD3 1 1 23 16572 1 1 6 PRO HG2 H -2.598 -5.526 -4.265 1.00 . A A . 6 PRO HG2 1 1 23 16573 1 1 6 PRO HG3 H -1.884 -7.130 -3.910 1.00 . A A . 6 PRO HG3 1 1 23 16574 1 1 6 PRO N N -2.481 -4.946 -1.507 1.00 . A A . 6 PRO N 1 1 23 16575 1 1 6 PRO O O -2.752 -2.628 -2.997 1.00 . A A . 6 PRO O 1 1 23 16576 1 1 7 SER C C -1.390 -1.997 -5.541 1.00 . A A . 7 SER C 1 1 23 16577 1 1 7 SER CA C -0.537 -1.461 -4.385 1.00 . A A . 7 SER CA 1 1 23 16578 1 1 7 SER CB C 0.907 -1.317 -4.870 1.00 . A A . 7 SER CB 1 1 23 16579 1 1 7 SER H H 0.390 -2.668 -2.949 1.00 . A A . 7 SER H 1 1 23 16580 1 1 7 SER HA H -0.899 -0.485 -4.059 1.00 . A A . 7 SER HA 1 1 23 16581 1 1 7 SER HB2 H 0.864 -0.795 -5.825 1.00 . A A . 7 SER HB2 1 1 23 16582 1 1 7 SER HB3 H 1.492 -0.735 -4.158 1.00 . A A . 7 SER HB3 1 1 23 16583 1 1 7 SER HG H 0.806 -3.123 -5.516 1.00 . A A . 7 SER HG 1 1 23 16584 1 1 7 SER N N -0.530 -2.397 -3.280 1.00 . A A . 7 SER N 1 1 23 16585 1 1 7 SER O O -0.955 -2.923 -6.226 1.00 . A A . 7 SER O 1 1 23 16586 1 1 7 SER OG O 1.483 -2.604 -5.051 1.00 . A A . 7 SER OG 1 1 23 16587 1 1 8 GLN C C -3.086 -0.347 -7.878 1.00 . A A . 8 GLN C 1 1 23 16588 1 1 8 GLN CA C -3.350 -1.553 -6.971 1.00 . A A . 8 GLN CA 1 1 23 16589 1 1 8 GLN CB C -4.830 -1.642 -6.591 1.00 . A A . 8 GLN CB 1 1 23 16590 1 1 8 GLN CD C -6.616 -3.110 -5.492 1.00 . A A . 8 GLN CD 1 1 23 16591 1 1 8 GLN CG C -5.124 -2.886 -5.739 1.00 . A A . 8 GLN CG 1 1 23 16592 1 1 8 GLN H H -2.857 -0.675 -5.140 1.00 . A A . 8 GLN H 1 1 23 16593 1 1 8 GLN HA H -3.068 -2.460 -7.510 1.00 . A A . 8 GLN HA 1 1 23 16594 1 1 8 GLN HB2 H -5.153 -0.747 -6.061 1.00 . A A . 8 GLN HB2 1 1 23 16595 1 1 8 GLN HB3 H -5.374 -1.689 -7.526 1.00 . A A . 8 GLN HB3 1 1 23 16596 1 1 8 GLN HE21 H -7.077 -2.839 -7.456 1.00 . A A . 8 GLN HE21 1 1 23 16597 1 1 8 GLN HE22 H -8.426 -3.171 -6.397 1.00 . A A . 8 GLN HE22 1 1 23 16598 1 1 8 GLN HG2 H -4.714 -3.762 -6.241 1.00 . A A . 8 GLN HG2 1 1 23 16599 1 1 8 GLN HG3 H -4.629 -2.789 -4.774 1.00 . A A . 8 GLN HG3 1 1 23 16600 1 1 8 GLN N N -2.555 -1.397 -5.769 1.00 . A A . 8 GLN N 1 1 23 16601 1 1 8 GLN NE2 N -7.437 -3.032 -6.533 1.00 . A A . 8 GLN NE2 1 1 23 16602 1 1 8 GLN O O -2.867 -0.498 -9.075 1.00 . A A . 8 GLN O 1 1 23 16603 1 1 8 GLN OE1 O -7.042 -3.374 -4.366 1.00 . A A . 8 GLN OE1 1 1 23 16604 1 1 9 THR C C -1.300 2.181 -8.285 1.00 . A A . 9 THR C 1 1 23 16605 1 1 9 THR CA C -2.793 2.091 -7.990 1.00 . A A . 9 THR CA 1 1 23 16606 1 1 9 THR CB C -3.186 3.275 -7.094 1.00 . A A . 9 THR CB 1 1 23 16607 1 1 9 THR CG2 C -4.695 3.469 -7.047 1.00 . A A . 9 THR CG2 1 1 23 16608 1 1 9 THR H H -3.262 0.901 -6.293 1.00 . A A . 9 THR H 1 1 23 16609 1 1 9 THR HA H -3.348 2.138 -8.929 1.00 . A A . 9 THR HA 1 1 23 16610 1 1 9 THR HB H -2.750 4.177 -7.525 1.00 . A A . 9 THR HB 1 1 23 16611 1 1 9 THR HG1 H -3.219 2.465 -5.292 1.00 . A A . 9 THR HG1 1 1 23 16612 1 1 9 THR HG21 H -5.196 2.537 -6.799 1.00 . A A . 9 THR HG21 1 1 23 16613 1 1 9 THR HG22 H -4.930 4.212 -6.293 1.00 . A A . 9 THR HG22 1 1 23 16614 1 1 9 THR HG23 H -5.045 3.823 -8.019 1.00 . A A . 9 THR HG23 1 1 23 16615 1 1 9 THR N N -3.079 0.851 -7.286 1.00 . A A . 9 THR N 1 1 23 16616 1 1 9 THR O O -0.874 2.327 -9.428 1.00 . A A . 9 THR O 1 1 23 16617 1 1 9 THR OG1 O -2.680 3.111 -5.770 1.00 . A A . 9 THR OG1 1 1 23 16618 1 1 10 TRP C C 1.655 1.488 -8.071 1.00 . A A . 10 TRP C 1 1 23 16619 1 1 10 TRP CA C 0.889 2.468 -7.180 1.00 . A A . 10 TRP CA 1 1 23 16620 1 1 10 TRP CB C 1.331 2.395 -5.717 1.00 . A A . 10 TRP CB 1 1 23 16621 1 1 10 TRP CD1 C 3.839 1.994 -5.805 1.00 . A A . 10 TRP CD1 1 1 23 16622 1 1 10 TRP CD2 C 3.271 3.776 -4.571 1.00 . A A . 10 TRP CD2 1 1 23 16623 1 1 10 TRP CE2 C 4.673 3.597 -4.420 1.00 . A A . 10 TRP CE2 1 1 23 16624 1 1 10 TRP CE3 C 2.695 4.885 -3.921 1.00 . A A . 10 TRP CE3 1 1 23 16625 1 1 10 TRP CG C 2.759 2.702 -5.405 1.00 . A A . 10 TRP CG 1 1 23 16626 1 1 10 TRP CH2 C 4.793 5.405 -2.831 1.00 . A A . 10 TRP CH2 1 1 23 16627 1 1 10 TRP CZ2 C 5.442 4.431 -3.602 1.00 . A A . 10 TRP CZ2 1 1 23 16628 1 1 10 TRP CZ3 C 3.432 5.661 -3.016 1.00 . A A . 10 TRP CZ3 1 1 23 16629 1 1 10 TRP H H -1.012 2.080 -6.323 1.00 . A A . 10 TRP H 1 1 23 16630 1 1 10 TRP HA H 1.008 3.497 -7.528 1.00 . A A . 10 TRP HA 1 1 23 16631 1 1 10 TRP HB2 H 0.716 3.091 -5.148 1.00 . A A . 10 TRP HB2 1 1 23 16632 1 1 10 TRP HB3 H 1.122 1.401 -5.330 1.00 . A A . 10 TRP HB3 1 1 23 16633 1 1 10 TRP HD1 H 3.817 1.118 -6.437 1.00 . A A . 10 TRP HD1 1 1 23 16634 1 1 10 TRP HE1 H 5.918 2.179 -5.370 1.00 . A A . 10 TRP HE1 1 1 23 16635 1 1 10 TRP HE3 H 1.678 5.141 -4.135 1.00 . A A . 10 TRP HE3 1 1 23 16636 1 1 10 TRP HH2 H 5.312 5.959 -2.081 1.00 . A A . 10 TRP HH2 1 1 23 16637 1 1 10 TRP HZ2 H 6.507 4.305 -3.547 1.00 . A A . 10 TRP HZ2 1 1 23 16638 1 1 10 TRP HZ3 H 2.966 6.452 -2.446 1.00 . A A . 10 TRP HZ3 1 1 23 16639 1 1 10 TRP N N -0.519 2.130 -7.206 1.00 . A A . 10 TRP N 1 1 23 16640 1 1 10 TRP NE1 N 4.975 2.525 -5.232 1.00 . A A . 10 TRP NE1 1 1 23 16641 1 1 10 TRP O O 1.902 0.342 -7.695 1.00 . A A . 10 TRP O 1 1 23 16642 1 1 11 SER C C 3.759 0.529 -10.353 1.00 . A A . 11 SER C 1 1 23 16643 1 1 11 SER CA C 2.311 1.023 -10.367 1.00 . A A . 11 SER CA 1 1 23 16644 1 1 11 SER CB C 1.943 1.738 -11.678 1.00 . A A . 11 SER CB 1 1 23 16645 1 1 11 SER H H 1.701 2.848 -9.571 1.00 . A A . 11 SER H 1 1 23 16646 1 1 11 SER HA H 1.672 0.149 -10.246 1.00 . A A . 11 SER HA 1 1 23 16647 1 1 11 SER HB2 H 2.797 2.303 -12.056 1.00 . A A . 11 SER HB2 1 1 23 16648 1 1 11 SER HB3 H 1.657 1.001 -12.431 1.00 . A A . 11 SER HB3 1 1 23 16649 1 1 11 SER HG H 0.189 2.267 -10.932 1.00 . A A . 11 SER HG 1 1 23 16650 1 1 11 SER N N 2.005 1.927 -9.277 1.00 . A A . 11 SER N 1 1 23 16651 1 1 11 SER O O 4.462 0.654 -11.354 1.00 . A A . 11 SER O 1 1 23 16652 1 1 11 SER OG O 0.895 2.671 -11.461 1.00 . A A . 11 SER OG 1 1 23 16653 1 1 12 GLY C C 6.019 -0.911 -7.764 1.00 . A A . 12 GLY C 1 1 23 16654 1 1 12 GLY CA C 5.551 -0.625 -9.188 1.00 . A A . 12 GLY CA 1 1 23 16655 1 1 12 GLY H H 3.589 -0.150 -8.445 1.00 . A A . 12 GLY H 1 1 23 16656 1 1 12 GLY HA2 H 5.562 -1.558 -9.751 1.00 . A A . 12 GLY HA2 1 1 23 16657 1 1 12 GLY HA3 H 6.252 0.069 -9.655 1.00 . A A . 12 GLY HA3 1 1 23 16658 1 1 12 GLY N N 4.212 -0.058 -9.243 1.00 . A A . 12 GLY N 1 1 23 16659 1 1 12 GLY O O 5.249 -1.388 -6.924 1.00 . A A . 12 GLY O 1 1 23 16660 1 1 13 ASN C C 7.767 0.307 -5.326 1.00 . A A . 13 ASN C 1 1 23 16661 1 1 13 ASN CA C 7.977 -0.896 -6.250 1.00 . A A . 13 ASN CA 1 1 23 16662 1 1 13 ASN CB C 9.469 -1.143 -6.521 1.00 . A A . 13 ASN CB 1 1 23 16663 1 1 13 ASN CG C 10.225 -1.677 -5.306 1.00 . A A . 13 ASN CG 1 1 23 16664 1 1 13 ASN H H 7.850 -0.216 -8.247 1.00 . A A . 13 ASN H 1 1 23 16665 1 1 13 ASN HA H 7.547 -1.793 -5.809 1.00 . A A . 13 ASN HA 1 1 23 16666 1 1 13 ASN HB2 H 9.559 -1.887 -7.313 1.00 . A A . 13 ASN HB2 1 1 23 16667 1 1 13 ASN HB3 H 9.939 -0.220 -6.865 1.00 . A A . 13 ASN HB3 1 1 23 16668 1 1 13 ASN HD21 H 10.564 0.208 -4.545 1.00 . A A . 13 ASN HD21 1 1 23 16669 1 1 13 ASN HD22 H 11.266 -1.133 -3.664 1.00 . A A . 13 ASN HD22 1 1 23 16670 1 1 13 ASN N N 7.307 -0.654 -7.519 1.00 . A A . 13 ASN N 1 1 23 16671 1 1 13 ASN ND2 N 10.719 -0.795 -4.441 1.00 . A A . 13 ASN ND2 1 1 23 16672 1 1 13 ASN O O 7.463 1.400 -5.798 1.00 . A A . 13 ASN O 1 1 23 16673 1 1 13 ASN OD1 O 10.384 -2.885 -5.153 1.00 . A A . 13 ASN OD1 1 1 23 16674 1 1 14 CYS C C 9.022 2.235 -3.397 1.00 . A A . 14 CYS C 1 1 23 16675 1 1 14 CYS CA C 7.921 1.223 -3.054 1.00 . A A . 14 CYS CA 1 1 23 16676 1 1 14 CYS CB C 8.128 0.682 -1.636 1.00 . A A . 14 CYS CB 1 1 23 16677 1 1 14 CYS H H 8.191 -0.794 -3.690 1.00 . A A . 14 CYS H 1 1 23 16678 1 1 14 CYS HA H 6.949 1.719 -3.094 1.00 . A A . 14 CYS HA 1 1 23 16679 1 1 14 CYS HB2 H 7.336 -0.029 -1.399 1.00 . A A . 14 CYS HB2 1 1 23 16680 1 1 14 CYS HB3 H 9.086 0.171 -1.603 1.00 . A A . 14 CYS HB3 1 1 23 16681 1 1 14 CYS N N 7.923 0.128 -4.013 1.00 . A A . 14 CYS N 1 1 23 16682 1 1 14 CYS O O 10.015 1.883 -4.035 1.00 . A A . 14 CYS O 1 1 23 16683 1 1 14 CYS SG S 8.159 1.961 -0.351 1.00 . A A . 14 CYS SG 1 1 23 16684 1 1 15 GLY C C 9.829 5.347 -1.789 1.00 . A A . 15 GLY C 1 1 23 16685 1 1 15 GLY CA C 9.761 4.588 -3.109 1.00 . A A . 15 GLY CA 1 1 23 16686 1 1 15 GLY H H 8.024 3.631 -2.378 1.00 . A A . 15 GLY H 1 1 23 16687 1 1 15 GLY HA2 H 10.757 4.228 -3.353 1.00 . A A . 15 GLY HA2 1 1 23 16688 1 1 15 GLY HA3 H 9.417 5.254 -3.899 1.00 . A A . 15 GLY HA3 1 1 23 16689 1 1 15 GLY N N 8.830 3.480 -2.964 1.00 . A A . 15 GLY N 1 1 23 16690 1 1 15 GLY O O 10.902 5.529 -1.222 1.00 . A A . 15 GLY O 1 1 23 16691 1 1 16 ASN C C 7.215 5.995 0.699 1.00 . A A . 16 ASN C 1 1 23 16692 1 1 16 ASN CA C 8.527 6.392 0.021 1.00 . A A . 16 ASN CA 1 1 23 16693 1 1 16 ASN CB C 8.653 7.915 -0.093 1.00 . A A . 16 ASN CB 1 1 23 16694 1 1 16 ASN CG C 8.851 8.558 1.275 1.00 . A A . 16 ASN CG 1 1 23 16695 1 1 16 ASN H H 7.829 5.596 -1.828 1.00 . A A . 16 ASN H 1 1 23 16696 1 1 16 ASN HA H 9.350 6.045 0.649 1.00 . A A . 16 ASN HA 1 1 23 16697 1 1 16 ASN HB2 H 9.531 8.150 -0.698 1.00 . A A . 16 ASN HB2 1 1 23 16698 1 1 16 ASN HB3 H 7.771 8.342 -0.569 1.00 . A A . 16 ASN HB3 1 1 23 16699 1 1 16 ASN HD21 H 9.594 10.265 0.447 1.00 . A A . 16 ASN HD21 1 1 23 16700 1 1 16 ASN HD22 H 9.496 10.229 2.196 1.00 . A A . 16 ASN HD22 1 1 23 16701 1 1 16 ASN N N 8.661 5.761 -1.286 1.00 . A A . 16 ASN N 1 1 23 16702 1 1 16 ASN ND2 N 9.336 9.794 1.301 1.00 . A A . 16 ASN ND2 1 1 23 16703 1 1 16 ASN O O 6.128 6.360 0.241 1.00 . A A . 16 ASN O 1 1 23 16704 1 1 16 ASN OD1 O 8.550 7.961 2.305 1.00 . A A . 16 ASN OD1 1 1 23 16705 1 1 17 THR C C 5.325 6.098 3.047 1.00 . A A . 17 THR C 1 1 23 16706 1 1 17 THR CA C 6.151 4.880 2.601 1.00 . A A . 17 THR CA 1 1 23 16707 1 1 17 THR CB C 6.582 3.962 3.760 1.00 . A A . 17 THR CB 1 1 23 16708 1 1 17 THR CG2 C 7.261 4.712 4.911 1.00 . A A . 17 THR CG2 1 1 23 16709 1 1 17 THR H H 8.230 5.044 2.170 1.00 . A A . 17 THR H 1 1 23 16710 1 1 17 THR HA H 5.541 4.278 1.935 1.00 . A A . 17 THR HA 1 1 23 16711 1 1 17 THR HB H 7.298 3.239 3.368 1.00 . A A . 17 THR HB 1 1 23 16712 1 1 17 THR HG1 H 4.858 3.845 4.655 1.00 . A A . 17 THR HG1 1 1 23 16713 1 1 17 THR HG21 H 8.114 5.281 4.540 1.00 . A A . 17 THR HG21 1 1 23 16714 1 1 17 THR HG22 H 6.565 5.391 5.401 1.00 . A A . 17 THR HG22 1 1 23 16715 1 1 17 THR HG23 H 7.618 3.990 5.647 1.00 . A A . 17 THR HG23 1 1 23 16716 1 1 17 THR N N 7.312 5.283 1.824 1.00 . A A . 17 THR N 1 1 23 16717 1 1 17 THR O O 4.101 6.015 3.172 1.00 . A A . 17 THR O 1 1 23 16718 1 1 17 THR OG1 O 5.474 3.230 4.246 1.00 . A A . 17 THR OG1 1 1 23 16719 1 1 18 ALA C C 4.421 9.008 2.465 1.00 . A A . 18 ALA C 1 1 23 16720 1 1 18 ALA CA C 5.320 8.495 3.591 1.00 . A A . 18 ALA CA 1 1 23 16721 1 1 18 ALA CB C 6.357 9.552 3.985 1.00 . A A . 18 ALA CB 1 1 23 16722 1 1 18 ALA H H 6.988 7.277 3.096 1.00 . A A . 18 ALA H 1 1 23 16723 1 1 18 ALA HA H 4.687 8.309 4.461 1.00 . A A . 18 ALA HA 1 1 23 16724 1 1 18 ALA HB1 H 7.025 9.154 4.748 1.00 . A A . 18 ALA HB1 1 1 23 16725 1 1 18 ALA HB2 H 6.939 9.852 3.114 1.00 . A A . 18 ALA HB2 1 1 23 16726 1 1 18 ALA HB3 H 5.848 10.430 4.384 1.00 . A A . 18 ALA HB3 1 1 23 16727 1 1 18 ALA N N 5.983 7.248 3.239 1.00 . A A . 18 ALA N 1 1 23 16728 1 1 18 ALA O O 3.531 9.818 2.737 1.00 . A A . 18 ALA O 1 1 23 16729 1 1 19 HIS C C 2.632 7.559 0.265 1.00 . A A . 19 HIS C 1 1 23 16730 1 1 19 HIS CA C 3.612 8.726 0.177 1.00 . A A . 19 HIS CA 1 1 23 16731 1 1 19 HIS CB C 4.229 8.850 -1.224 1.00 . A A . 19 HIS CB 1 1 23 16732 1 1 19 HIS CD2 C 1.892 9.356 -2.304 1.00 . A A . 19 HIS CD2 1 1 23 16733 1 1 19 HIS CE1 C 2.395 8.801 -4.360 1.00 . A A . 19 HIS CE1 1 1 23 16734 1 1 19 HIS CG C 3.222 9.004 -2.346 1.00 . A A . 19 HIS CG 1 1 23 16735 1 1 19 HIS H H 5.364 7.892 1.048 1.00 . A A . 19 HIS H 1 1 23 16736 1 1 19 HIS HA H 3.060 9.650 0.352 1.00 . A A . 19 HIS HA 1 1 23 16737 1 1 19 HIS HB2 H 4.885 9.709 -1.258 1.00 . A A . 19 HIS HB2 1 1 23 16738 1 1 19 HIS HB3 H 4.839 7.972 -1.415 1.00 . A A . 19 HIS HB3 1 1 23 16739 1 1 19 HIS HD1 H 4.455 8.502 -4.041 1.00 . A A . 19 HIS HD1 1 1 23 16740 1 1 19 HIS HD2 H 1.332 9.606 -1.406 1.00 . A A . 19 HIS HD2 1 1 23 16741 1 1 19 HIS HE1 H 2.298 8.572 -5.413 1.00 . A A . 19 HIS HE1 1 1 23 16742 1 1 19 HIS N N 4.621 8.562 1.217 1.00 . A A . 19 HIS N 1 1 23 16743 1 1 19 HIS ND1 N 3.548 8.756 -3.673 1.00 . A A . 19 HIS ND1 1 1 23 16744 1 1 19 HIS NE2 N 1.367 9.138 -3.568 1.00 . A A . 19 HIS NE2 1 1 23 16745 1 1 19 HIS O O 1.431 7.808 0.278 1.00 . A A . 19 HIS O 1 1 23 16746 1 1 20 CYS C C 1.053 5.269 1.271 1.00 . A A . 20 CYS C 1 1 23 16747 1 1 20 CYS CA C 2.256 5.118 0.337 1.00 . A A . 20 CYS CA 1 1 23 16748 1 1 20 CYS CB C 3.039 3.879 0.766 1.00 . A A . 20 CYS CB 1 1 23 16749 1 1 20 CYS H H 4.124 6.183 0.314 1.00 . A A . 20 CYS H 1 1 23 16750 1 1 20 CYS HA H 1.886 4.951 -0.674 1.00 . A A . 20 CYS HA 1 1 23 16751 1 1 20 CYS HB2 H 3.857 3.692 0.070 1.00 . A A . 20 CYS HB2 1 1 23 16752 1 1 20 CYS HB3 H 3.428 4.034 1.765 1.00 . A A . 20 CYS HB3 1 1 23 16753 1 1 20 CYS N N 3.116 6.311 0.319 1.00 . A A . 20 CYS N 1 1 23 16754 1 1 20 CYS O O -0.085 5.004 0.890 1.00 . A A . 20 CYS O 1 1 23 16755 1 1 20 CYS SG S 2.010 2.402 0.893 1.00 . A A . 20 CYS SG 1 1 23 16756 1 1 21 ASP C C -0.813 6.917 2.976 1.00 . A A . 21 ASP C 1 1 23 16757 1 1 21 ASP CA C 0.227 5.895 3.455 1.00 . A A . 21 ASP CA 1 1 23 16758 1 1 21 ASP CB C 0.791 6.301 4.817 1.00 . A A . 21 ASP CB 1 1 23 16759 1 1 21 ASP CG C -0.348 6.403 5.822 1.00 . A A . 21 ASP CG 1 1 23 16760 1 1 21 ASP H H 2.264 5.934 2.764 1.00 . A A . 21 ASP H 1 1 23 16761 1 1 21 ASP HA H -0.267 4.923 3.559 1.00 . A A . 21 ASP HA 1 1 23 16762 1 1 21 ASP HB2 H 1.505 5.552 5.161 1.00 . A A . 21 ASP HB2 1 1 23 16763 1 1 21 ASP HB3 H 1.299 7.264 4.744 1.00 . A A . 21 ASP HB3 1 1 23 16764 1 1 21 ASP N N 1.302 5.748 2.491 1.00 . A A . 21 ASP N 1 1 23 16765 1 1 21 ASP O O -2.005 6.695 3.162 1.00 . A A . 21 ASP O 1 1 23 16766 1 1 21 ASP OD1 O -0.761 5.376 6.360 1.00 . A A . 21 ASP OD1 1 1 23 16767 1 1 21 ASP OD2 O -0.863 7.646 6.013 1.00 . A A . 21 ASP OD2 1 1 23 16768 1 1 22 LYS C C -2.080 8.339 0.662 1.00 . A A . 22 LYS C 1 1 23 16769 1 1 22 LYS CA C -1.303 9.000 1.792 1.00 . A A . 22 LYS CA 1 1 23 16770 1 1 22 LYS CB C -0.600 10.247 1.232 1.00 . A A . 22 LYS CB 1 1 23 16771 1 1 22 LYS CD C 0.975 12.154 1.662 1.00 . A A . 22 LYS CD 1 1 23 16772 1 1 22 LYS CE C 1.713 12.998 2.712 1.00 . A A . 22 LYS CE 1 1 23 16773 1 1 22 LYS CG C 0.341 10.881 2.243 1.00 . A A . 22 LYS CG 1 1 23 16774 1 1 22 LYS H H 0.598 8.058 2.073 1.00 . A A . 22 LYS H 1 1 23 16775 1 1 22 LYS HA H -1.963 9.337 2.587 1.00 . A A . 22 LYS HA 1 1 23 16776 1 1 22 LYS HB2 H -0.029 9.997 0.341 1.00 . A A . 22 LYS HB2 1 1 23 16777 1 1 22 LYS HB3 H -1.365 10.972 0.953 1.00 . A A . 22 LYS HB3 1 1 23 16778 1 1 22 LYS HD2 H 1.663 11.874 0.862 1.00 . A A . 22 LYS HD2 1 1 23 16779 1 1 22 LYS HD3 H 0.191 12.779 1.224 1.00 . A A . 22 LYS HD3 1 1 23 16780 1 1 22 LYS HE2 H 2.313 13.751 2.196 1.00 . A A . 22 LYS HE2 1 1 23 16781 1 1 22 LYS HE3 H 0.982 13.516 3.337 1.00 . A A . 22 LYS HE3 1 1 23 16782 1 1 22 LYS HG2 H -0.214 11.093 3.160 1.00 . A A . 22 LYS HG2 1 1 23 16783 1 1 22 LYS HG3 H 1.096 10.121 2.408 1.00 . A A . 22 LYS HG3 1 1 23 16784 1 1 22 LYS HZ1 H 2.440 11.182 3.373 1.00 . A A . 22 LYS HZ1 1 1 23 16785 1 1 22 LYS HZ2 H 3.570 12.427 3.409 1.00 . A A . 22 LYS HZ2 1 1 23 16786 1 1 22 LYS N N -0.374 8.019 2.352 1.00 . A A . 22 LYS N 1 1 23 16787 1 1 22 LYS NZ N 2.585 12.181 3.581 1.00 . A A . 22 LYS NZ 1 1 23 16788 1 1 22 LYS O O -3.305 8.324 0.659 1.00 . A A . 22 LYS O 1 1 23 16789 1 1 23 GLN C C -2.962 6.287 -1.237 1.00 . A A . 23 GLN C 1 1 23 16790 1 1 23 GLN CA C -1.787 7.213 -1.543 1.00 . A A . 23 GLN CA 1 1 23 16791 1 1 23 GLN CB C -0.596 6.445 -2.135 1.00 . A A . 23 GLN CB 1 1 23 16792 1 1 23 GLN CD C -0.848 6.223 -4.648 1.00 . A A . 23 GLN CD 1 1 23 16793 1 1 23 GLN CG C -0.909 5.503 -3.302 1.00 . A A . 23 GLN CG 1 1 23 16794 1 1 23 GLN H H -0.327 7.799 -0.129 1.00 . A A . 23 GLN H 1 1 23 16795 1 1 23 GLN HA H -2.118 8.003 -2.221 1.00 . A A . 23 GLN HA 1 1 23 16796 1 1 23 GLN HB2 H 0.219 7.118 -2.380 1.00 . A A . 23 GLN HB2 1 1 23 16797 1 1 23 GLN HB3 H -0.220 5.789 -1.358 1.00 . A A . 23 GLN HB3 1 1 23 16798 1 1 23 GLN HE21 H -1.566 4.577 -5.623 1.00 . A A . 23 GLN HE21 1 1 23 16799 1 1 23 GLN HE22 H -1.093 5.934 -6.638 1.00 . A A . 23 GLN HE22 1 1 23 16800 1 1 23 GLN HG2 H -0.156 4.717 -3.285 1.00 . A A . 23 GLN HG2 1 1 23 16801 1 1 23 GLN HG3 H -1.867 5.015 -3.178 1.00 . A A . 23 GLN HG3 1 1 23 16802 1 1 23 GLN N N -1.326 7.798 -0.297 1.00 . A A . 23 GLN N 1 1 23 16803 1 1 23 GLN NE2 N -1.177 5.515 -5.723 1.00 . A A . 23 GLN NE2 1 1 23 16804 1 1 23 GLN O O -4.038 6.404 -1.814 1.00 . A A . 23 GLN O 1 1 23 16805 1 1 23 GLN OE1 O -0.469 7.393 -4.726 1.00 . A A . 23 GLN OE1 1 1 23 16806 1 1 24 CYS C C -5.055 5.017 0.536 1.00 . A A . 24 CYS C 1 1 23 16807 1 1 24 CYS CA C -3.748 4.375 0.064 1.00 . A A . 24 CYS CA 1 1 23 16808 1 1 24 CYS CB C -3.150 3.481 1.141 1.00 . A A . 24 CYS CB 1 1 23 16809 1 1 24 CYS H H -1.831 5.302 0.127 1.00 . A A . 24 CYS H 1 1 23 16810 1 1 24 CYS HA H -3.980 3.777 -0.819 1.00 . A A . 24 CYS HA 1 1 23 16811 1 1 24 CYS HB2 H -2.702 4.095 1.923 1.00 . A A . 24 CYS HB2 1 1 23 16812 1 1 24 CYS HB3 H -3.929 2.871 1.589 1.00 . A A . 24 CYS HB3 1 1 23 16813 1 1 24 CYS N N -2.750 5.359 -0.307 1.00 . A A . 24 CYS N 1 1 23 16814 1 1 24 CYS O O -6.137 4.526 0.214 1.00 . A A . 24 CYS O 1 1 23 16815 1 1 24 CYS SG S -1.909 2.341 0.504 1.00 . A A . 24 CYS SG 1 1 23 16816 1 1 25 GLN C C -6.787 7.600 0.646 1.00 . A A . 25 GLN C 1 1 23 16817 1 1 25 GLN CA C -6.136 6.817 1.791 1.00 . A A . 25 GLN CA 1 1 23 16818 1 1 25 GLN CB C -5.734 7.738 2.953 1.00 . A A . 25 GLN CB 1 1 23 16819 1 1 25 GLN CD C -4.652 7.770 5.271 1.00 . A A . 25 GLN CD 1 1 23 16820 1 1 25 GLN CG C -5.225 6.913 4.145 1.00 . A A . 25 GLN CG 1 1 23 16821 1 1 25 GLN H H -4.054 6.533 1.445 1.00 . A A . 25 GLN H 1 1 23 16822 1 1 25 GLN HA H -6.850 6.092 2.177 1.00 . A A . 25 GLN HA 1 1 23 16823 1 1 25 GLN HB2 H -4.956 8.432 2.638 1.00 . A A . 25 GLN HB2 1 1 23 16824 1 1 25 GLN HB3 H -6.610 8.310 3.260 1.00 . A A . 25 GLN HB3 1 1 23 16825 1 1 25 GLN HE21 H -6.299 8.964 5.304 1.00 . A A . 25 GLN HE21 1 1 23 16826 1 1 25 GLN HE22 H -5.035 9.360 6.454 1.00 . A A . 25 GLN HE22 1 1 23 16827 1 1 25 GLN HG2 H -6.047 6.321 4.545 1.00 . A A . 25 GLN HG2 1 1 23 16828 1 1 25 GLN HG3 H -4.444 6.239 3.802 1.00 . A A . 25 GLN HG3 1 1 23 16829 1 1 25 GLN N N -4.964 6.113 1.289 1.00 . A A . 25 GLN N 1 1 23 16830 1 1 25 GLN NE2 N -5.383 8.796 5.696 1.00 . A A . 25 GLN NE2 1 1 23 16831 1 1 25 GLN O O -7.964 7.416 0.343 1.00 . A A . 25 GLN O 1 1 23 16832 1 1 25 GLN OE1 O -3.554 7.518 5.763 1.00 . A A . 25 GLN OE1 1 1 23 16833 1 1 26 ASP C C -6.975 8.669 -2.227 1.00 . A A . 26 ASP C 1 1 23 16834 1 1 26 ASP CA C -6.475 9.415 -0.997 1.00 . A A . 26 ASP CA 1 1 23 16835 1 1 26 ASP CB C -5.355 10.389 -1.389 1.00 . A A . 26 ASP CB 1 1 23 16836 1 1 26 ASP CG C -4.964 11.336 -0.258 1.00 . A A . 26 ASP CG 1 1 23 16837 1 1 26 ASP H H -5.031 8.505 0.278 1.00 . A A . 26 ASP H 1 1 23 16838 1 1 26 ASP HA H -7.298 9.999 -0.594 1.00 . A A . 26 ASP HA 1 1 23 16839 1 1 26 ASP HB2 H -4.476 9.833 -1.704 1.00 . A A . 26 ASP HB2 1 1 23 16840 1 1 26 ASP HB3 H -5.697 10.987 -2.231 1.00 . A A . 26 ASP HB3 1 1 23 16841 1 1 26 ASP N N -6.008 8.481 0.015 1.00 . A A . 26 ASP N 1 1 23 16842 1 1 26 ASP O O -8.117 8.837 -2.652 1.00 . A A . 26 ASP O 1 1 23 16843 1 1 26 ASP OD1 O -5.960 12.107 0.251 1.00 . A A . 26 ASP OD1 1 1 23 16844 1 1 26 ASP OD2 O -3.800 11.365 0.130 1.00 . A A . 26 ASP OD2 1 1 23 16845 1 1 27 TRP C C -7.198 5.979 -3.831 1.00 . A A . 27 TRP C 1 1 23 16846 1 1 27 TRP CA C -6.362 7.224 -4.096 1.00 . A A . 27 TRP CA 1 1 23 16847 1 1 27 TRP CB C -5.062 6.774 -4.773 1.00 . A A . 27 TRP CB 1 1 23 16848 1 1 27 TRP CD1 C -3.747 8.929 -4.785 1.00 . A A . 27 TRP CD1 1 1 23 16849 1 1 27 TRP CD2 C -3.499 7.755 -6.668 1.00 . A A . 27 TRP CD2 1 1 23 16850 1 1 27 TRP CE2 C -2.607 8.864 -6.752 1.00 . A A . 27 TRP CE2 1 1 23 16851 1 1 27 TRP CE3 C -3.539 6.867 -7.762 1.00 . A A . 27 TRP CE3 1 1 23 16852 1 1 27 TRP CG C -4.163 7.795 -5.376 1.00 . A A . 27 TRP CG 1 1 23 16853 1 1 27 TRP CH2 C -1.779 8.105 -8.897 1.00 . A A . 27 TRP CH2 1 1 23 16854 1 1 27 TRP CZ2 C -1.761 9.051 -7.856 1.00 . A A . 27 TRP CZ2 1 1 23 16855 1 1 27 TRP CZ3 C -2.681 7.031 -8.861 1.00 . A A . 27 TRP CZ3 1 1 23 16856 1 1 27 TRP H H -5.202 7.702 -2.381 1.00 . A A . 27 TRP H 1 1 23 16857 1 1 27 TRP HA H -6.898 7.897 -4.767 1.00 . A A . 27 TRP HA 1 1 23 16858 1 1 27 TRP HB2 H -4.454 6.137 -4.138 1.00 . A A . 27 TRP HB2 1 1 23 16859 1 1 27 TRP HB3 H -5.389 6.160 -5.606 1.00 . A A . 27 TRP HB3 1 1 23 16860 1 1 27 TRP HD1 H -4.040 9.243 -3.801 1.00 . A A . 27 TRP HD1 1 1 23 16861 1 1 27 TRP HE1 H -2.364 10.431 -5.336 1.00 . A A . 27 TRP HE1 1 1 23 16862 1 1 27 TRP HE3 H -4.244 6.053 -7.760 1.00 . A A . 27 TRP HE3 1 1 23 16863 1 1 27 TRP HH2 H -1.113 8.187 -9.738 1.00 . A A . 27 TRP HH2 1 1 23 16864 1 1 27 TRP HZ2 H -1.092 9.897 -7.898 1.00 . A A . 27 TRP HZ2 1 1 23 16865 1 1 27 TRP HZ3 H -2.713 6.327 -9.681 1.00 . A A . 27 TRP HZ3 1 1 23 16866 1 1 27 TRP N N -6.096 7.871 -2.828 1.00 . A A . 27 TRP N 1 1 23 16867 1 1 27 TRP NE1 N -2.827 9.570 -5.583 1.00 . A A . 27 TRP NE1 1 1 23 16868 1 1 27 TRP O O -8.347 5.899 -4.265 1.00 . A A . 27 TRP O 1 1 23 16869 1 1 28 GLU C C -8.269 3.298 -2.639 1.00 . A A . 28 GLU C 1 1 23 16870 1 1 28 GLU CA C -6.962 3.597 -3.370 1.00 . A A . 28 GLU CA 1 1 23 16871 1 1 28 GLU CB C -5.791 2.662 -3.003 1.00 . A A . 28 GLU CB 1 1 23 16872 1 1 28 GLU CD C -4.594 0.521 -3.722 1.00 . A A . 28 GLU CD 1 1 23 16873 1 1 28 GLU CG C -5.889 1.332 -3.768 1.00 . A A . 28 GLU CG 1 1 23 16874 1 1 28 GLU H H -5.681 5.198 -2.758 1.00 . A A . 28 GLU H 1 1 23 16875 1 1 28 GLU HA H -7.158 3.476 -4.437 1.00 . A A . 28 GLU HA 1 1 23 16876 1 1 28 GLU HB2 H -4.857 3.141 -3.301 1.00 . A A . 28 GLU HB2 1 1 23 16877 1 1 28 GLU HB3 H -5.765 2.478 -1.930 1.00 . A A . 28 GLU HB3 1 1 23 16878 1 1 28 GLU HG2 H -6.719 0.745 -3.376 1.00 . A A . 28 GLU HG2 1 1 23 16879 1 1 28 GLU HG3 H -6.094 1.534 -4.818 1.00 . A A . 28 GLU HG3 1 1 23 16880 1 1 28 GLU N N -6.575 4.990 -3.184 1.00 . A A . 28 GLU N 1 1 23 16881 1 1 28 GLU O O -9.187 2.759 -3.251 1.00 . A A . 28 GLU O 1 1 23 16882 1 1 28 GLU OE1 O -3.659 0.853 -4.458 1.00 . A A . 28 GLU OE1 1 1 23 16883 1 1 28 GLU OE2 O -4.586 -0.568 -2.904 1.00 . A A . 28 GLU OE2 1 1 23 16884 1 1 29 LYS C C -9.433 3.221 0.761 1.00 . A A . 29 LYS C 1 1 23 16885 1 1 29 LYS CA C -9.484 4.019 -0.540 1.00 . A A . 29 LYS CA 1 1 23 16886 1 1 29 LYS CB C -10.836 3.924 -1.243 1.00 . A A . 29 LYS CB 1 1 23 16887 1 1 29 LYS CD C -11.223 6.399 -1.797 1.00 . A A . 29 LYS CD 1 1 23 16888 1 1 29 LYS CE C -11.519 7.398 -2.925 1.00 . A A . 29 LYS CE 1 1 23 16889 1 1 29 LYS CG C -11.104 4.965 -2.342 1.00 . A A . 29 LYS CG 1 1 23 16890 1 1 29 LYS H H -7.500 4.005 -0.927 1.00 . A A . 29 LYS H 1 1 23 16891 1 1 29 LYS HA H -9.339 5.057 -0.244 1.00 . A A . 29 LYS HA 1 1 23 16892 1 1 29 LYS HB2 H -11.014 2.912 -1.608 1.00 . A A . 29 LYS HB2 1 1 23 16893 1 1 29 LYS HB3 H -11.527 4.116 -0.438 1.00 . A A . 29 LYS HB3 1 1 23 16894 1 1 29 LYS HD2 H -12.047 6.426 -1.082 1.00 . A A . 29 LYS HD2 1 1 23 16895 1 1 29 LYS HD3 H -10.312 6.704 -1.280 1.00 . A A . 29 LYS HD3 1 1 23 16896 1 1 29 LYS HE2 H -12.341 7.024 -3.538 1.00 . A A . 29 LYS HE2 1 1 23 16897 1 1 29 LYS HE3 H -11.827 8.348 -2.480 1.00 . A A . 29 LYS HE3 1 1 23 16898 1 1 29 LYS HG2 H -10.331 4.908 -3.103 1.00 . A A . 29 LYS HG2 1 1 23 16899 1 1 29 LYS HG3 H -12.051 4.691 -2.813 1.00 . A A . 29 LYS HG3 1 1 23 16900 1 1 29 LYS HZ1 H -10.017 6.758 -4.186 1.00 . A A . 29 LYS HZ1 1 1 23 16901 1 1 29 LYS HZ2 H -10.580 8.306 -4.522 1.00 . A A . 29 LYS HZ2 1 1 23 16902 1 1 29 LYS N N -8.337 3.645 -1.348 1.00 . A A . 29 LYS N 1 1 23 16903 1 1 29 LYS NZ N -10.334 7.645 -3.771 1.00 . A A . 29 LYS NZ 1 1 23 16904 1 1 29 LYS O O -10.298 2.382 1.007 1.00 . A A . 29 LYS O 1 1 23 16905 1 1 30 ALA C C -7.986 3.419 4.003 1.00 . A A . 30 ALA C 1 1 23 16906 1 1 30 ALA CA C -8.084 2.608 2.714 1.00 . A A . 30 ALA CA 1 1 23 16907 1 1 30 ALA CB C -6.773 1.892 2.403 1.00 . A A . 30 ALA CB 1 1 23 16908 1 1 30 ALA H H -7.697 4.127 1.283 1.00 . A A . 30 ALA H 1 1 23 16909 1 1 30 ALA HA H -8.880 1.882 2.858 1.00 . A A . 30 ALA HA 1 1 23 16910 1 1 30 ALA HB1 H -6.892 1.295 1.497 1.00 . A A . 30 ALA HB1 1 1 23 16911 1 1 30 ALA HB2 H -5.996 2.635 2.252 1.00 . A A . 30 ALA HB2 1 1 23 16912 1 1 30 ALA HB3 H -6.476 1.245 3.218 1.00 . A A . 30 ALA HB3 1 1 23 16913 1 1 30 ALA N N -8.392 3.445 1.564 1.00 . A A . 30 ALA N 1 1 23 16914 1 1 30 ALA O O -7.916 4.643 3.966 1.00 . A A . 30 ALA O 1 1 23 16915 1 1 31 SER C C -6.366 4.032 6.466 1.00 . A A . 31 SER C 1 1 23 16916 1 1 31 SER CA C -7.731 3.349 6.442 1.00 . A A . 31 SER CA 1 1 23 16917 1 1 31 SER CB C -7.793 2.258 7.507 1.00 . A A . 31 SER CB 1 1 23 16918 1 1 31 SER H H -7.951 1.722 5.177 1.00 . A A . 31 SER H 1 1 23 16919 1 1 31 SER HA H -8.515 4.076 6.645 1.00 . A A . 31 SER HA 1 1 23 16920 1 1 31 SER HB2 H -6.958 1.582 7.375 1.00 . A A . 31 SER HB2 1 1 23 16921 1 1 31 SER HB3 H -7.672 2.732 8.467 1.00 . A A . 31 SER HB3 1 1 23 16922 1 1 31 SER HG H -9.390 1.561 6.595 1.00 . A A . 31 SER HG 1 1 23 16923 1 1 31 SER N N -7.949 2.735 5.154 1.00 . A A . 31 SER N 1 1 23 16924 1 1 31 SER O O -6.226 5.140 6.972 1.00 . A A . 31 SER O 1 1 23 16925 1 1 31 SER OG O -9.011 1.534 7.485 1.00 . A A . 31 SER OG 1 1 23 16926 1 1 32 HIS C C -3.182 2.995 4.906 1.00 . A A . 32 HIS C 1 1 23 16927 1 1 32 HIS CA C -3.981 3.851 5.891 1.00 . A A . 32 HIS CA 1 1 23 16928 1 1 32 HIS CB C -3.368 3.870 7.305 1.00 . A A . 32 HIS CB 1 1 23 16929 1 1 32 HIS CD2 C -2.981 1.440 7.983 1.00 . A A . 32 HIS CD2 1 1 23 16930 1 1 32 HIS CE1 C -0.824 1.343 7.881 1.00 . A A . 32 HIS CE1 1 1 23 16931 1 1 32 HIS CG C -2.528 2.671 7.640 1.00 . A A . 32 HIS CG 1 1 23 16932 1 1 32 HIS H H -5.514 2.454 5.494 1.00 . A A . 32 HIS H 1 1 23 16933 1 1 32 HIS HA H -4.018 4.869 5.508 1.00 . A A . 32 HIS HA 1 1 23 16934 1 1 32 HIS HB2 H -2.751 4.737 7.433 1.00 . A A . 32 HIS HB2 1 1 23 16935 1 1 32 HIS HB3 H -4.151 3.958 8.057 1.00 . A A . 32 HIS HB3 1 1 23 16936 1 1 32 HIS HD1 H -0.511 3.340 7.229 1.00 . A A . 32 HIS HD1 1 1 23 16937 1 1 32 HIS HD2 H -4.020 1.209 7.958 1.00 . A A . 32 HIS HD2 1 1 23 16938 1 1 32 HIS HE1 H 0.167 0.930 7.872 1.00 . A A . 32 HIS HE1 1 1 23 16939 1 1 32 HIS N N -5.342 3.342 5.949 1.00 . A A . 32 HIS N 1 1 23 16940 1 1 32 HIS ND1 N -1.144 2.617 7.584 1.00 . A A . 32 HIS ND1 1 1 23 16941 1 1 32 HIS NE2 N -1.906 0.604 8.167 1.00 . A A . 32 HIS NE2 1 1 23 16942 1 1 32 HIS O O -3.718 2.018 4.370 1.00 . A A . 32 HIS O 1 1 23 16943 1 1 33 GLY C C 0.423 2.447 4.642 1.00 . A A . 33 GLY C 1 1 23 16944 1 1 33 GLY CA C -0.945 2.523 3.977 1.00 . A A . 33 GLY CA 1 1 23 16945 1 1 33 GLY H H -1.526 4.119 5.238 1.00 . A A . 33 GLY H 1 1 23 16946 1 1 33 GLY HA2 H -1.311 1.521 3.914 1.00 . A A . 33 GLY HA2 1 1 23 16947 1 1 33 GLY HA3 H -0.832 2.885 2.967 1.00 . A A . 33 GLY HA3 1 1 23 16948 1 1 33 GLY N N -1.898 3.322 4.731 1.00 . A A . 33 GLY N 1 1 23 16949 1 1 33 GLY O O 0.657 3.088 5.666 1.00 . A A . 33 GLY O 1 1 23 16950 1 1 34 ALA C C 3.339 0.415 3.587 1.00 . A A . 34 ALA C 1 1 23 16951 1 1 34 ALA CA C 2.624 1.313 4.602 1.00 . A A . 34 ALA CA 1 1 23 16952 1 1 34 ALA CB C 2.475 0.620 5.963 1.00 . A A . 34 ALA CB 1 1 23 16953 1 1 34 ALA H H 1.000 1.089 3.266 1.00 . A A . 34 ALA H 1 1 23 16954 1 1 34 ALA HA H 3.177 2.243 4.731 1.00 . A A . 34 ALA HA 1 1 23 16955 1 1 34 ALA HB1 H 1.721 -0.166 5.901 1.00 . A A . 34 ALA HB1 1 1 23 16956 1 1 34 ALA HB2 H 3.423 0.188 6.275 1.00 . A A . 34 ALA HB2 1 1 23 16957 1 1 34 ALA HB3 H 2.158 1.339 6.717 1.00 . A A . 34 ALA HB3 1 1 23 16958 1 1 34 ALA N N 1.300 1.616 4.083 1.00 . A A . 34 ALA N 1 1 23 16959 1 1 34 ALA O O 2.725 -0.524 3.078 1.00 . A A . 34 ALA O 1 1 23 16960 1 1 35 CYS C C 5.839 -1.433 3.064 1.00 . A A . 35 CYS C 1 1 23 16961 1 1 35 CYS CA C 5.375 -0.159 2.359 1.00 . A A . 35 CYS CA 1 1 23 16962 1 1 35 CYS CB C 6.602 0.590 1.850 1.00 . A A . 35 CYS CB 1 1 23 16963 1 1 35 CYS H H 5.098 1.479 3.662 1.00 . A A . 35 CYS H 1 1 23 16964 1 1 35 CYS HA H 4.758 -0.405 1.500 1.00 . A A . 35 CYS HA 1 1 23 16965 1 1 35 CYS HB2 H 7.151 1.034 2.679 1.00 . A A . 35 CYS HB2 1 1 23 16966 1 1 35 CYS HB3 H 7.253 -0.149 1.406 1.00 . A A . 35 CYS HB3 1 1 23 16967 1 1 35 CYS N N 4.609 0.683 3.266 1.00 . A A . 35 CYS N 1 1 23 16968 1 1 35 CYS O O 6.096 -1.406 4.270 1.00 . A A . 35 CYS O 1 1 23 16969 1 1 35 CYS SG S 6.297 1.816 0.559 1.00 . A A . 35 CYS SG 1 1 23 16970 1 1 36 HIS C C 7.291 -4.523 1.678 1.00 . A A . 36 HIS C 1 1 23 16971 1 1 36 HIS CA C 6.696 -3.723 2.826 1.00 . A A . 36 HIS CA 1 1 23 16972 1 1 36 HIS CB C 5.818 -4.698 3.616 1.00 . A A . 36 HIS CB 1 1 23 16973 1 1 36 HIS CD2 C 3.263 -4.468 3.607 1.00 . A A . 36 HIS CD2 1 1 23 16974 1 1 36 HIS CE1 C 3.076 -3.032 5.245 1.00 . A A . 36 HIS CE1 1 1 23 16975 1 1 36 HIS CG C 4.507 -4.167 4.083 1.00 . A A . 36 HIS CG 1 1 23 16976 1 1 36 HIS H H 5.738 -2.539 1.346 1.00 . A A . 36 HIS H 1 1 23 16977 1 1 36 HIS HA H 7.498 -3.390 3.481 1.00 . A A . 36 HIS HA 1 1 23 16978 1 1 36 HIS HB2 H 5.580 -5.553 2.983 1.00 . A A . 36 HIS HB2 1 1 23 16979 1 1 36 HIS HB3 H 6.384 -5.069 4.473 1.00 . A A . 36 HIS HB3 1 1 23 16980 1 1 36 HIS HD1 H 5.150 -2.667 5.465 1.00 . A A . 36 HIS HD1 1 1 23 16981 1 1 36 HIS HD2 H 3.085 -5.093 2.734 1.00 . A A . 36 HIS HD2 1 1 23 16982 1 1 36 HIS HE1 H 2.657 -2.331 5.951 1.00 . A A . 36 HIS HE1 1 1 23 16983 1 1 36 HIS N N 5.981 -2.548 2.334 1.00 . A A . 36 HIS N 1 1 23 16984 1 1 36 HIS ND1 N 4.389 -3.224 5.083 1.00 . A A . 36 HIS ND1 1 1 23 16985 1 1 36 HIS NE2 N 2.358 -3.816 4.422 1.00 . A A . 36 HIS NE2 1 1 23 16986 1 1 36 HIS O O 6.808 -4.452 0.549 1.00 . A A . 36 HIS O 1 1 23 16987 1 1 37 LYS C C 7.757 -7.647 1.289 1.00 . A A . 37 LYS C 1 1 23 16988 1 1 37 LYS CA C 8.710 -6.461 1.180 1.00 . A A . 37 LYS CA 1 1 23 16989 1 1 37 LYS CB C 10.122 -6.843 1.612 1.00 . A A . 37 LYS CB 1 1 23 16990 1 1 37 LYS CD C 11.992 -8.564 1.276 1.00 . A A . 37 LYS CD 1 1 23 16991 1 1 37 LYS CE C 13.330 -7.858 0.997 1.00 . A A . 37 LYS CE 1 1 23 16992 1 1 37 LYS CG C 10.790 -7.828 0.651 1.00 . A A . 37 LYS CG 1 1 23 16993 1 1 37 LYS H H 8.553 -5.399 2.993 1.00 . A A . 37 LYS H 1 1 23 16994 1 1 37 LYS HA H 8.775 -6.121 0.155 1.00 . A A . 37 LYS HA 1 1 23 16995 1 1 37 LYS HB2 H 10.711 -5.952 1.612 1.00 . A A . 37 LYS HB2 1 1 23 16996 1 1 37 LYS HB3 H 10.089 -7.209 2.630 1.00 . A A . 37 LYS HB3 1 1 23 16997 1 1 37 LYS HD2 H 11.844 -8.671 2.354 1.00 . A A . 37 LYS HD2 1 1 23 16998 1 1 37 LYS HD3 H 12.031 -9.570 0.862 1.00 . A A . 37 LYS HD3 1 1 23 16999 1 1 37 LYS HE2 H 13.321 -7.440 -0.011 1.00 . A A . 37 LYS HE2 1 1 23 17000 1 1 37 LYS HE3 H 13.455 -7.047 1.717 1.00 . A A . 37 LYS HE3 1 1 23 17001 1 1 37 LYS HG2 H 10.033 -8.551 0.375 1.00 . A A . 37 LYS HG2 1 1 23 17002 1 1 37 LYS HG3 H 11.072 -7.305 -0.265 1.00 . A A . 37 LYS HG3 1 1 23 17003 1 1 37 LYS HZ1 H 14.144 -9.756 0.973 1.00 . A A . 37 LYS HZ1 1 1 23 17004 1 1 37 LYS HZ2 H 15.130 -8.580 0.286 1.00 . A A . 37 LYS HZ2 1 1 23 17005 1 1 37 LYS N N 8.228 -5.400 2.037 1.00 . A A . 37 LYS N 1 1 23 17006 1 1 37 LYS NZ N 14.481 -8.787 1.057 1.00 . A A . 37 LYS NZ 1 1 23 17007 1 1 37 LYS O O 7.384 -8.063 2.389 1.00 . A A . 37 LYS O 1 1 23 17008 1 1 38 ARG C C 7.022 -10.035 -1.326 1.00 . A A . 38 ARG C 1 1 23 17009 1 1 38 ARG CA C 6.570 -9.390 -0.017 1.00 . A A . 38 ARG CA 1 1 23 17010 1 1 38 ARG CB C 5.092 -9.007 -0.134 1.00 . A A . 38 ARG CB 1 1 23 17011 1 1 38 ARG CD C 4.293 -9.207 2.298 1.00 . A A . 38 ARG CD 1 1 23 17012 1 1 38 ARG CG C 4.467 -8.297 1.078 1.00 . A A . 38 ARG CG 1 1 23 17013 1 1 38 ARG CZ C 4.340 -8.043 4.519 1.00 . A A . 38 ARG CZ 1 1 23 17014 1 1 38 ARG H H 7.657 -7.717 -0.726 1.00 . A A . 38 ARG H 1 1 23 17015 1 1 38 ARG HA H 6.735 -10.074 0.817 1.00 . A A . 38 ARG HA 1 1 23 17016 1 1 38 ARG HB2 H 5.017 -8.332 -0.989 1.00 . A A . 38 ARG HB2 1 1 23 17017 1 1 38 ARG HB3 H 4.533 -9.914 -0.351 1.00 . A A . 38 ARG HB3 1 1 23 17018 1 1 38 ARG HD2 H 3.613 -10.017 2.026 1.00 . A A . 38 ARG HD2 1 1 23 17019 1 1 38 ARG HD3 H 5.240 -9.666 2.576 1.00 . A A . 38 ARG HD3 1 1 23 17020 1 1 38 ARG HG2 H 5.045 -7.410 1.335 1.00 . A A . 38 ARG HG2 1 1 23 17021 1 1 38 ARG HG3 H 3.473 -7.971 0.785 1.00 . A A . 38 ARG HG3 1 1 23 17022 1 1 38 ARG HH11 H 6.218 -8.285 3.740 1.00 . A A . 38 ARG HH11 1 1 23 17023 1 1 38 ARG HH12 H 6.179 -7.840 5.421 1.00 . A A . 38 ARG HH12 1 1 23 17024 1 1 38 ARG HH21 H 2.619 -7.527 5.459 1.00 . A A . 38 ARG HH21 1 1 23 17025 1 1 38 ARG HH22 H 4.059 -7.306 6.426 1.00 . A A . 38 ARG HH22 1 1 23 17026 1 1 38 ARG N N 7.368 -8.182 0.135 1.00 . A A . 38 ARG N 1 1 23 17027 1 1 38 ARG NE N 3.689 -8.476 3.429 1.00 . A A . 38 ARG NE 1 1 23 17028 1 1 38 ARG NH1 N 5.676 -8.063 4.575 1.00 . A A . 38 ARG NH1 1 1 23 17029 1 1 38 ARG NH2 N 3.632 -7.575 5.552 1.00 . A A . 38 ARG NH2 1 1 23 17030 1 1 38 ARG O O 7.200 -9.308 -2.297 1.00 . A A . 38 ARG O 1 1 23 17031 1 1 39 GLU C C 9.181 -11.427 -2.952 1.00 . A A . 39 GLU C 1 1 23 17032 1 1 39 GLU CA C 7.819 -12.026 -2.557 1.00 . A A . 39 GLU CA 1 1 23 17033 1 1 39 GLU CB C 6.893 -11.893 -3.774 1.00 . A A . 39 GLU CB 1 1 23 17034 1 1 39 GLU CD C 4.651 -11.708 -4.872 1.00 . A A . 39 GLU CD 1 1 23 17035 1 1 39 GLU CG C 5.392 -12.138 -3.603 1.00 . A A . 39 GLU CG 1 1 23 17036 1 1 39 GLU H H 7.062 -11.916 -0.563 1.00 . A A . 39 GLU H 1 1 23 17037 1 1 39 GLU HA H 7.963 -13.079 -2.317 1.00 . A A . 39 GLU HA 1 1 23 17038 1 1 39 GLU HB2 H 7.000 -10.866 -4.106 1.00 . A A . 39 GLU HB2 1 1 23 17039 1 1 39 GLU HB3 H 7.260 -12.547 -4.567 1.00 . A A . 39 GLU HB3 1 1 23 17040 1 1 39 GLU HG2 H 5.215 -13.196 -3.414 1.00 . A A . 39 GLU HG2 1 1 23 17041 1 1 39 GLU HG3 H 4.998 -11.555 -2.772 1.00 . A A . 39 GLU HG3 1 1 23 17042 1 1 39 GLU N N 7.254 -11.353 -1.378 1.00 . A A . 39 GLU N 1 1 23 17043 1 1 39 GLU O O 9.512 -11.351 -4.133 1.00 . A A . 39 GLU O 1 1 23 17044 1 1 39 GLU OE1 O 5.208 -10.957 -5.680 1.00 . A A . 39 GLU OE1 1 1 23 17045 1 1 39 GLU OE2 O 3.390 -12.194 -5.022 1.00 . A A . 39 GLU OE2 1 1 23 17046 1 1 40 ASN C C 10.902 -8.872 -3.043 1.00 . A A . 40 ASN C 1 1 23 17047 1 1 40 ASN CA C 11.131 -10.117 -2.174 1.00 . A A . 40 ASN CA 1 1 23 17048 1 1 40 ASN CB C 12.254 -10.990 -2.723 1.00 . A A . 40 ASN CB 1 1 23 17049 1 1 40 ASN CG C 13.629 -10.352 -2.507 1.00 . A A . 40 ASN CG 1 1 23 17050 1 1 40 ASN H H 9.663 -11.132 -1.033 1.00 . A A . 40 ASN H 1 1 23 17051 1 1 40 ASN HA H 11.428 -9.765 -1.194 1.00 . A A . 40 ASN HA 1 1 23 17052 1 1 40 ASN HB2 H 12.242 -11.953 -2.219 1.00 . A A . 40 ASN HB2 1 1 23 17053 1 1 40 ASN HB3 H 12.037 -11.152 -3.774 1.00 . A A . 40 ASN HB3 1 1 23 17054 1 1 40 ASN HD21 H 14.165 -10.637 -4.450 1.00 . A A . 40 ASN HD21 1 1 23 17055 1 1 40 ASN HD22 H 15.365 -9.873 -3.430 1.00 . A A . 40 ASN HD22 1 1 23 17056 1 1 40 ASN N N 9.935 -10.926 -1.975 1.00 . A A . 40 ASN N 1 1 23 17057 1 1 40 ASN ND2 N 14.454 -10.291 -3.548 1.00 . A A . 40 ASN ND2 1 1 23 17058 1 1 40 ASN O O 11.852 -8.311 -3.577 1.00 . A A . 40 ASN O 1 1 23 17059 1 1 40 ASN OD1 O 13.953 -9.928 -1.397 1.00 . A A . 40 ASN OD1 1 1 23 17060 1 1 41 HIS C C 8.713 -6.232 -2.942 1.00 . A A . 41 HIS C 1 1 23 17061 1 1 41 HIS CA C 9.241 -7.265 -3.938 1.00 . A A . 41 HIS CA 1 1 23 17062 1 1 41 HIS CB C 8.165 -7.679 -4.954 1.00 . A A . 41 HIS CB 1 1 23 17063 1 1 41 HIS CD2 C 9.834 -9.077 -6.385 1.00 . A A . 41 HIS CD2 1 1 23 17064 1 1 41 HIS CE1 C 8.505 -10.718 -6.931 1.00 . A A . 41 HIS CE1 1 1 23 17065 1 1 41 HIS CG C 8.592 -8.817 -5.858 1.00 . A A . 41 HIS CG 1 1 23 17066 1 1 41 HIS H H 8.896 -8.924 -2.727 1.00 . A A . 41 HIS H 1 1 23 17067 1 1 41 HIS HA H 10.085 -6.864 -4.489 1.00 . A A . 41 HIS HA 1 1 23 17068 1 1 41 HIS HB2 H 7.273 -7.971 -4.403 1.00 . A A . 41 HIS HB2 1 1 23 17069 1 1 41 HIS HB3 H 7.909 -6.811 -5.557 1.00 . A A . 41 HIS HB3 1 1 23 17070 1 1 41 HIS HD1 H 6.751 -9.965 -6.045 1.00 . A A . 41 HIS HD1 1 1 23 17071 1 1 41 HIS HD2 H 10.730 -8.493 -6.225 1.00 . A A . 41 HIS HD2 1 1 23 17072 1 1 41 HIS HE1 H 8.155 -11.670 -7.303 1.00 . A A . 41 HIS HE1 1 1 23 17073 1 1 41 HIS N N 9.651 -8.427 -3.177 1.00 . A A . 41 HIS N 1 1 23 17074 1 1 41 HIS ND1 N 7.737 -9.833 -6.273 1.00 . A A . 41 HIS ND1 1 1 23 17075 1 1 41 HIS NE2 N 9.770 -10.286 -7.051 1.00 . A A . 41 HIS NE2 1 1 23 17076 1 1 41 HIS O O 7.766 -6.515 -2.207 1.00 . A A . 41 HIS O 1 1 23 17077 1 1 42 TRP C C 7.673 -3.301 -2.596 1.00 . A A . 42 TRP C 1 1 23 17078 1 1 42 TRP CA C 8.885 -3.994 -1.988 1.00 . A A . 42 TRP CA 1 1 23 17079 1 1 42 TRP CB C 10.028 -3.031 -1.683 1.00 . A A . 42 TRP CB 1 1 23 17080 1 1 42 TRP CD1 C 11.984 -4.371 -0.817 1.00 . A A . 42 TRP CD1 1 1 23 17081 1 1 42 TRP CD2 C 10.927 -3.243 0.805 1.00 . A A . 42 TRP CD2 1 1 23 17082 1 1 42 TRP CE2 C 12.008 -3.941 1.416 1.00 . A A . 42 TRP CE2 1 1 23 17083 1 1 42 TRP CE3 C 10.034 -2.572 1.666 1.00 . A A . 42 TRP CE3 1 1 23 17084 1 1 42 TRP CG C 10.957 -3.520 -0.624 1.00 . A A . 42 TRP CG 1 1 23 17085 1 1 42 TRP CH2 C 11.303 -3.268 3.629 1.00 . A A . 42 TRP CH2 1 1 23 17086 1 1 42 TRP CZ2 C 12.177 -3.994 2.804 1.00 . A A . 42 TRP CZ2 1 1 23 17087 1 1 42 TRP CZ3 C 10.244 -2.538 3.056 1.00 . A A . 42 TRP CZ3 1 1 23 17088 1 1 42 TRP H H 10.087 -4.843 -3.511 1.00 . A A . 42 TRP H 1 1 23 17089 1 1 42 TRP HA H 8.582 -4.401 -1.036 1.00 . A A . 42 TRP HA 1 1 23 17090 1 1 42 TRP HB2 H 10.585 -2.811 -2.590 1.00 . A A . 42 TRP HB2 1 1 23 17091 1 1 42 TRP HB3 H 9.613 -2.101 -1.312 1.00 . A A . 42 TRP HB3 1 1 23 17092 1 1 42 TRP HD1 H 12.218 -4.834 -1.758 1.00 . A A . 42 TRP HD1 1 1 23 17093 1 1 42 TRP HE1 H 13.433 -5.193 0.513 1.00 . A A . 42 TRP HE1 1 1 23 17094 1 1 42 TRP HE3 H 9.149 -2.123 1.251 1.00 . A A . 42 TRP HE3 1 1 23 17095 1 1 42 TRP HH2 H 11.425 -3.299 4.702 1.00 . A A . 42 TRP HH2 1 1 23 17096 1 1 42 TRP HZ2 H 12.904 -4.675 3.217 1.00 . A A . 42 TRP HZ2 1 1 23 17097 1 1 42 TRP HZ3 H 9.568 -1.971 3.681 1.00 . A A . 42 TRP HZ3 1 1 23 17098 1 1 42 TRP N N 9.347 -5.064 -2.859 1.00 . A A . 42 TRP N 1 1 23 17099 1 1 42 TRP NE1 N 12.636 -4.593 0.376 1.00 . A A . 42 TRP NE1 1 1 23 17100 1 1 42 TRP O O 7.830 -2.551 -3.551 1.00 . A A . 42 TRP O 1 1 23 17101 1 1 43 LYS C C 4.845 -1.834 -1.482 1.00 . A A . 43 LYS C 1 1 23 17102 1 1 43 LYS CA C 5.260 -2.867 -2.518 1.00 . A A . 43 LYS CA 1 1 23 17103 1 1 43 LYS CB C 4.123 -3.880 -2.665 1.00 . A A . 43 LYS CB 1 1 23 17104 1 1 43 LYS CD C 5.211 -5.141 -4.619 1.00 . A A . 43 LYS CD 1 1 23 17105 1 1 43 LYS CE C 4.215 -4.848 -5.765 1.00 . A A . 43 LYS CE 1 1 23 17106 1 1 43 LYS CG C 4.598 -5.224 -3.207 1.00 . A A . 43 LYS CG 1 1 23 17107 1 1 43 LYS H H 6.369 -4.193 -1.304 1.00 . A A . 43 LYS H 1 1 23 17108 1 1 43 LYS HA H 5.416 -2.380 -3.482 1.00 . A A . 43 LYS HA 1 1 23 17109 1 1 43 LYS HB2 H 3.726 -4.076 -1.676 1.00 . A A . 43 LYS HB2 1 1 23 17110 1 1 43 LYS HB3 H 3.313 -3.465 -3.259 1.00 . A A . 43 LYS HB3 1 1 23 17111 1 1 43 LYS HD2 H 6.042 -4.433 -4.647 1.00 . A A . 43 LYS HD2 1 1 23 17112 1 1 43 LYS HD3 H 5.627 -6.128 -4.815 1.00 . A A . 43 LYS HD3 1 1 23 17113 1 1 43 LYS HE2 H 4.704 -5.139 -6.699 1.00 . A A . 43 LYS HE2 1 1 23 17114 1 1 43 LYS HE3 H 3.321 -5.465 -5.650 1.00 . A A . 43 LYS HE3 1 1 23 17115 1 1 43 LYS HG2 H 5.276 -5.645 -2.456 1.00 . A A . 43 LYS HG2 1 1 23 17116 1 1 43 LYS HG3 H 3.772 -5.917 -3.223 1.00 . A A . 43 LYS HG3 1 1 23 17117 1 1 43 LYS HZ1 H 4.291 -3.024 -6.736 1.00 . A A . 43 LYS HZ1 1 1 23 17118 1 1 43 LYS HZ2 H 2.801 -3.365 -6.036 1.00 . A A . 43 LYS HZ2 1 1 23 17119 1 1 43 LYS N N 6.468 -3.538 -2.075 1.00 . A A . 43 LYS N 1 1 23 17120 1 1 43 LYS NZ N 3.821 -3.428 -5.913 1.00 . A A . 43 LYS NZ 1 1 23 17121 1 1 43 LYS O O 5.015 -2.054 -0.281 1.00 . A A . 43 LYS O 1 1 23 17122 1 1 44 CYS C C 2.072 -0.943 -0.814 1.00 . A A . 44 CYS C 1 1 23 17123 1 1 44 CYS CA C 3.271 -0.037 -1.097 1.00 . A A . 44 CYS CA 1 1 23 17124 1 1 44 CYS CB C 2.868 1.265 -1.778 1.00 . A A . 44 CYS CB 1 1 23 17125 1 1 44 CYS H H 4.099 -0.650 -2.936 1.00 . A A . 44 CYS H 1 1 23 17126 1 1 44 CYS HA H 3.745 0.240 -0.165 1.00 . A A . 44 CYS HA 1 1 23 17127 1 1 44 CYS HB2 H 3.721 1.930 -1.655 1.00 . A A . 44 CYS HB2 1 1 23 17128 1 1 44 CYS HB3 H 2.672 1.099 -2.836 1.00 . A A . 44 CYS HB3 1 1 23 17129 1 1 44 CYS N N 4.205 -0.762 -1.940 1.00 . A A . 44 CYS N 1 1 23 17130 1 1 44 CYS O O 1.604 -1.625 -1.727 1.00 . A A . 44 CYS O 1 1 23 17131 1 1 44 CYS SG S 1.413 2.053 -1.064 1.00 . A A . 44 CYS SG 1 1 23 17132 1 1 45 PHE C C -0.537 -0.771 1.534 1.00 . A A . 45 PHE C 1 1 23 17133 1 1 45 PHE CA C 0.422 -1.728 0.840 1.00 . A A . 45 PHE CA 1 1 23 17134 1 1 45 PHE CB C 0.788 -2.860 1.801 1.00 . A A . 45 PHE CB 1 1 23 17135 1 1 45 PHE CD1 C 2.034 -4.558 0.407 1.00 . A A . 45 PHE CD1 1 1 23 17136 1 1 45 PHE CD2 C -0.146 -5.151 1.298 1.00 . A A . 45 PHE CD2 1 1 23 17137 1 1 45 PHE CE1 C 2.130 -5.827 -0.193 1.00 . A A . 45 PHE CE1 1 1 23 17138 1 1 45 PHE CE2 C -0.054 -6.420 0.703 1.00 . A A . 45 PHE CE2 1 1 23 17139 1 1 45 PHE CG C 0.897 -4.222 1.156 1.00 . A A . 45 PHE CG 1 1 23 17140 1 1 45 PHE CZ C 1.086 -6.757 -0.045 1.00 . A A . 45 PHE CZ 1 1 23 17141 1 1 45 PHE H H 2.071 -0.467 1.176 1.00 . A A . 45 PHE H 1 1 23 17142 1 1 45 PHE HA H -0.092 -2.141 -0.028 1.00 . A A . 45 PHE HA 1 1 23 17143 1 1 45 PHE HB2 H 1.739 -2.607 2.261 1.00 . A A . 45 PHE HB2 1 1 23 17144 1 1 45 PHE HB3 H 0.040 -2.917 2.591 1.00 . A A . 45 PHE HB3 1 1 23 17145 1 1 45 PHE HD1 H 2.836 -3.841 0.310 1.00 . A A . 45 PHE HD1 1 1 23 17146 1 1 45 PHE HD2 H -1.042 -4.870 1.824 1.00 . A A . 45 PHE HD2 1 1 23 17147 1 1 45 PHE HE1 H 3.007 -6.094 -0.762 1.00 . A A . 45 PHE HE1 1 1 23 17148 1 1 45 PHE HE2 H -0.864 -7.129 0.801 1.00 . A A . 45 PHE HE2 1 1 23 17149 1 1 45 PHE HZ H 1.151 -7.730 -0.512 1.00 . A A . 45 PHE HZ 1 1 23 17150 1 1 45 PHE N N 1.620 -1.002 0.442 1.00 . A A . 45 PHE N 1 1 23 17151 1 1 45 PHE O O -0.112 0.220 2.124 1.00 . A A . 45 PHE O 1 1 23 17152 1 1 46 CYS C C -3.742 -1.303 2.903 1.00 . A A . 46 CYS C 1 1 23 17153 1 1 46 CYS CA C -2.963 -0.383 1.976 1.00 . A A . 46 CYS CA 1 1 23 17154 1 1 46 CYS CB C -3.837 0.003 0.781 1.00 . A A . 46 CYS CB 1 1 23 17155 1 1 46 CYS H H -2.058 -1.983 1.017 1.00 . A A . 46 CYS H 1 1 23 17156 1 1 46 CYS HA H -2.674 0.491 2.562 1.00 . A A . 46 CYS HA 1 1 23 17157 1 1 46 CYS HB2 H -4.196 -0.908 0.314 1.00 . A A . 46 CYS HB2 1 1 23 17158 1 1 46 CYS HB3 H -4.692 0.558 1.150 1.00 . A A . 46 CYS HB3 1 1 23 17159 1 1 46 CYS N N -1.818 -1.118 1.481 1.00 . A A . 46 CYS N 1 1 23 17160 1 1 46 CYS O O -3.623 -2.523 2.826 1.00 . A A . 46 CYS O 1 1 23 17161 1 1 46 CYS SG S -3.065 0.976 -0.534 1.00 . A A . 46 CYS SG 1 1 23 17162 1 1 47 TYR C C -6.579 -0.890 4.967 1.00 . A A . 47 TYR C 1 1 23 17163 1 1 47 TYR CA C -5.152 -1.426 4.908 1.00 . A A . 47 TYR CA 1 1 23 17164 1 1 47 TYR CB C -4.361 -1.051 6.164 1.00 . A A . 47 TYR CB 1 1 23 17165 1 1 47 TYR CD1 C -1.906 -1.240 5.551 1.00 . A A . 47 TYR CD1 1 1 23 17166 1 1 47 TYR CD2 C -2.894 -2.893 7.040 1.00 . A A . 47 TYR CD2 1 1 23 17167 1 1 47 TYR CE1 C -0.679 -1.919 5.616 1.00 . A A . 47 TYR CE1 1 1 23 17168 1 1 47 TYR CE2 C -1.652 -3.524 7.167 1.00 . A A . 47 TYR CE2 1 1 23 17169 1 1 47 TYR CG C -3.019 -1.737 6.253 1.00 . A A . 47 TYR CG 1 1 23 17170 1 1 47 TYR CZ C -0.551 -3.042 6.448 1.00 . A A . 47 TYR CZ 1 1 23 17171 1 1 47 TYR H H -4.504 0.301 3.857 1.00 . A A . 47 TYR H 1 1 23 17172 1 1 47 TYR HA H -5.136 -2.514 4.770 1.00 . A A . 47 TYR HA 1 1 23 17173 1 1 47 TYR HB2 H -4.205 0.023 6.130 1.00 . A A . 47 TYR HB2 1 1 23 17174 1 1 47 TYR HB3 H -4.913 -1.267 7.076 1.00 . A A . 47 TYR HB3 1 1 23 17175 1 1 47 TYR HD1 H -1.994 -0.350 4.953 1.00 . A A . 47 TYR HD1 1 1 23 17176 1 1 47 TYR HD2 H -3.750 -3.303 7.547 1.00 . A A . 47 TYR HD2 1 1 23 17177 1 1 47 TYR HE1 H 0.153 -1.570 5.024 1.00 . A A . 47 TYR HE1 1 1 23 17178 1 1 47 TYR HE2 H -1.566 -4.397 7.798 1.00 . A A . 47 TYR HE2 1 1 23 17179 1 1 47 TYR HH H 0.627 -4.341 7.263 1.00 . A A . 47 TYR HH 1 1 23 17180 1 1 47 TYR N N -4.501 -0.716 3.819 1.00 . A A . 47 TYR N 1 1 23 17181 1 1 47 TYR O O -6.775 0.240 5.405 1.00 . A A . 47 TYR O 1 1 23 17182 1 1 47 TYR OH O 0.643 -3.681 6.562 1.00 . A A . 47 TYR OH 1 1 23 17183 1 1 48 PHE C C -9.739 -0.591 5.074 1.00 . A A . 48 PHE C 1 1 23 17184 1 1 48 PHE CA C -8.762 -0.987 3.976 1.00 . A A . 48 PHE CA 1 1 23 17185 1 1 48 PHE CB C -9.392 -1.845 2.885 1.00 . A A . 48 PHE CB 1 1 23 17186 1 1 48 PHE CD1 C -7.479 -2.298 1.280 1.00 . A A . 48 PHE CD1 1 1 23 17187 1 1 48 PHE CD2 C -9.242 -0.760 0.607 1.00 . A A . 48 PHE CD2 1 1 23 17188 1 1 48 PHE CE1 C -6.755 -1.969 0.124 1.00 . A A . 48 PHE CE1 1 1 23 17189 1 1 48 PHE CE2 C -8.513 -0.426 -0.546 1.00 . A A . 48 PHE CE2 1 1 23 17190 1 1 48 PHE CG C -8.702 -1.658 1.547 1.00 . A A . 48 PHE CG 1 1 23 17191 1 1 48 PHE CZ C -7.259 -1.015 -0.774 1.00 . A A . 48 PHE CZ 1 1 23 17192 1 1 48 PHE H H -7.430 -2.583 4.141 1.00 . A A . 48 PHE H 1 1 23 17193 1 1 48 PHE HA H -8.456 -0.070 3.489 1.00 . A A . 48 PHE HA 1 1 23 17194 1 1 48 PHE HB2 H -9.417 -2.891 3.173 1.00 . A A . 48 PHE HB2 1 1 23 17195 1 1 48 PHE HB3 H -10.419 -1.526 2.793 1.00 . A A . 48 PHE HB3 1 1 23 17196 1 1 48 PHE HD1 H -7.044 -2.981 1.995 1.00 . A A . 48 PHE HD1 1 1 23 17197 1 1 48 PHE HD2 H -10.179 -0.254 0.798 1.00 . A A . 48 PHE HD2 1 1 23 17198 1 1 48 PHE HE1 H -5.794 -2.427 -0.062 1.00 . A A . 48 PHE HE1 1 1 23 17199 1 1 48 PHE HE2 H -8.905 0.315 -1.234 1.00 . A A . 48 PHE HE2 1 1 23 17200 1 1 48 PHE HZ H -6.688 -0.740 -1.643 1.00 . A A . 48 PHE HZ 1 1 23 17201 1 1 48 PHE N N -7.571 -1.638 4.476 1.00 . A A . 48 PHE N 1 1 23 17202 1 1 48 PHE O O -10.062 0.586 5.205 1.00 . A A . 48 PHE O 1 1 23 17203 1 1 49 ASN C C -10.704 -1.737 8.204 1.00 . A A . 49 ASN C 1 1 23 17204 1 1 49 ASN CA C -11.279 -1.409 6.829 1.00 . A A . 49 ASN CA 1 1 23 17205 1 1 49 ASN CB C -12.501 -2.270 6.453 1.00 . A A . 49 ASN CB 1 1 23 17206 1 1 49 ASN CG C -12.170 -3.739 6.180 1.00 . A A . 49 ASN CG 1 1 23 17207 1 1 49 ASN H H -9.814 -2.490 5.741 1.00 . A A . 49 ASN H 1 1 23 17208 1 1 49 ASN HA H -11.618 -0.373 6.866 1.00 . A A . 49 ASN HA 1 1 23 17209 1 1 49 ASN HB2 H -13.237 -2.216 7.256 1.00 . A A . 49 ASN HB2 1 1 23 17210 1 1 49 ASN HB3 H -12.958 -1.850 5.556 1.00 . A A . 49 ASN HB3 1 1 23 17211 1 1 49 ASN HD21 H -11.556 -3.318 4.296 1.00 . A A . 49 ASN HD21 1 1 23 17212 1 1 49 ASN HD22 H -11.443 -5.002 4.780 1.00 . A A . 49 ASN HD22 1 1 23 17213 1 1 49 ASN N N -10.220 -1.571 5.837 1.00 . A A . 49 ASN N 1 1 23 17214 1 1 49 ASN ND2 N -11.645 -4.037 4.994 1.00 . A A . 49 ASN ND2 1 1 23 17215 1 1 49 ASN O O -11.175 -2.635 8.898 1.00 . A A . 49 ASN O 1 1 23 17216 1 1 49 ASN OD1 O -12.394 -4.611 7.016 1.00 . A A . 49 ASN OD1 1 1 23 17217 1 1 50 CYS C C -9.588 -0.913 11.045 1.00 . A A . 50 CYS C 1 1 23 17218 1 1 50 CYS CA C -8.863 -1.325 9.769 1.00 . A A . 50 CYS CA 1 1 23 17219 1 1 50 CYS CB C -7.487 -0.690 9.663 1.00 . A A . 50 CYS CB 1 1 23 17220 1 1 50 CYS H H -9.356 -0.239 7.997 1.00 . A A . 50 CYS H 1 1 23 17221 1 1 50 CYS HA H -8.698 -2.388 9.809 1.00 . A A . 50 CYS HA 1 1 23 17222 1 1 50 CYS HB2 H -7.002 -1.045 8.755 1.00 . A A . 50 CYS HB2 1 1 23 17223 1 1 50 CYS HB3 H -7.632 0.377 9.592 1.00 . A A . 50 CYS HB3 1 1 23 17224 1 1 50 CYS N N -9.641 -1.024 8.578 1.00 . A A . 50 CYS N 1 1 23 17225 1 1 50 CYS O O -9.968 -1.809 11.861 1.00 . A A . 50 CYS O 1 1 23 17226 1 1 50 CYS OXT O -9.810 0.313 11.289 1.00 . A A . 50 CYS OXT 1 1 23 17227 1 1 50 CYS SG S -6.366 -1.005 11.043 1.00 . A A . 50 CYS SG 1 1 24 17228 1 1 1 LEU C C -9.365 -4.800 8.912 1.00 . A A . 1 LEU C 1 1 24 17229 1 1 1 LEU CA C -10.206 -5.459 10.013 1.00 . A A . 1 LEU CA 1 1 24 17230 1 1 1 LEU CB C -10.941 -6.692 9.470 1.00 . A A . 1 LEU CB 1 1 24 17231 1 1 1 LEU CD1 C -8.974 -8.285 9.812 1.00 . A A . 1 LEU CD1 1 1 24 17232 1 1 1 LEU CD2 C -10.874 -8.910 8.315 1.00 . A A . 1 LEU CD2 1 1 24 17233 1 1 1 LEU CG C -10.019 -7.745 8.828 1.00 . A A . 1 LEU CG 1 1 24 17234 1 1 1 LEU H1 H -10.638 -3.701 11.002 1.00 . A A . 1 LEU H1 1 1 24 17235 1 1 1 LEU H2 H -11.789 -4.146 9.858 1.00 . A A . 1 LEU H2 1 1 24 17236 1 1 1 LEU H3 H -11.709 -4.955 11.331 1.00 . A A . 1 LEU H3 1 1 24 17237 1 1 1 LEU HA H -9.554 -5.782 10.824 1.00 . A A . 1 LEU HA 1 1 24 17238 1 1 1 LEU HB2 H -11.485 -7.160 10.293 1.00 . A A . 1 LEU HB2 1 1 24 17239 1 1 1 LEU HB3 H -11.661 -6.361 8.721 1.00 . A A . 1 LEU HB3 1 1 24 17240 1 1 1 LEU HD11 H -9.463 -8.660 10.712 1.00 . A A . 1 LEU HD11 1 1 24 17241 1 1 1 LEU HD12 H -8.422 -9.101 9.344 1.00 . A A . 1 LEU HD12 1 1 24 17242 1 1 1 LEU HD13 H -8.261 -7.508 10.084 1.00 . A A . 1 LEU HD13 1 1 24 17243 1 1 1 LEU HD21 H -11.618 -8.544 7.607 1.00 . A A . 1 LEU HD21 1 1 24 17244 1 1 1 LEU HD22 H -10.240 -9.639 7.809 1.00 . A A . 1 LEU HD22 1 1 24 17245 1 1 1 LEU HD23 H -11.382 -9.396 9.146 1.00 . A A . 1 LEU HD23 1 1 24 17246 1 1 1 LEU HG H -9.499 -7.313 7.972 1.00 . A A . 1 LEU HG 1 1 24 17247 1 1 1 LEU N N -11.157 -4.492 10.595 1.00 . A A . 1 LEU N 1 1 24 17248 1 1 1 LEU O O -9.890 -4.409 7.877 1.00 . A A . 1 LEU O 1 1 24 17249 1 1 2 CYS C C -6.704 -4.775 7.137 1.00 . A A . 2 CYS C 1 1 24 17250 1 1 2 CYS CA C -7.150 -3.889 8.300 1.00 . A A . 2 CYS CA 1 1 24 17251 1 1 2 CYS CB C -5.994 -3.339 9.166 1.00 . A A . 2 CYS CB 1 1 24 17252 1 1 2 CYS H H -7.692 -4.950 10.030 1.00 . A A . 2 CYS H 1 1 24 17253 1 1 2 CYS HA H -7.672 -3.034 7.875 1.00 . A A . 2 CYS HA 1 1 24 17254 1 1 2 CYS HB2 H -5.253 -4.126 9.305 1.00 . A A . 2 CYS HB2 1 1 24 17255 1 1 2 CYS HB3 H -5.518 -2.508 8.654 1.00 . A A . 2 CYS HB3 1 1 24 17256 1 1 2 CYS N N -8.066 -4.637 9.151 1.00 . A A . 2 CYS N 1 1 24 17257 1 1 2 CYS O O -5.639 -5.384 7.184 1.00 . A A . 2 CYS O 1 1 24 17258 1 1 2 CYS SG S -6.428 -2.793 10.845 1.00 . A A . 2 CYS SG 1 1 24 17259 1 1 3 ASN C C -6.343 -6.207 4.263 1.00 . A A . 3 ASN C 1 1 24 17260 1 1 3 ASN CA C -7.546 -6.050 5.206 1.00 . A A . 3 ASN CA 1 1 24 17261 1 1 3 ASN CB C -8.800 -6.001 4.308 1.00 . A A . 3 ASN CB 1 1 24 17262 1 1 3 ASN CG C -10.075 -5.614 5.036 1.00 . A A . 3 ASN CG 1 1 24 17263 1 1 3 ASN H H -8.371 -4.319 6.136 1.00 . A A . 3 ASN H 1 1 24 17264 1 1 3 ASN HA H -7.592 -6.935 5.839 1.00 . A A . 3 ASN HA 1 1 24 17265 1 1 3 ASN HB2 H -8.636 -5.252 3.530 1.00 . A A . 3 ASN HB2 1 1 24 17266 1 1 3 ASN HB3 H -8.966 -6.957 3.809 1.00 . A A . 3 ASN HB3 1 1 24 17267 1 1 3 ASN HD21 H -10.534 -7.542 5.507 1.00 . A A . 3 ASN HD21 1 1 24 17268 1 1 3 ASN HD22 H -11.657 -6.323 6.068 1.00 . A A . 3 ASN HD22 1 1 24 17269 1 1 3 ASN N N -7.517 -4.864 6.076 1.00 . A A . 3 ASN N 1 1 24 17270 1 1 3 ASN ND2 N -10.810 -6.576 5.585 1.00 . A A . 3 ASN ND2 1 1 24 17271 1 1 3 ASN O O -6.418 -7.002 3.325 1.00 . A A . 3 ASN O 1 1 24 17272 1 1 3 ASN OD1 O -10.398 -4.430 5.092 1.00 . A A . 3 ASN OD1 1 1 24 17273 1 1 4 GLU C C -3.969 -6.066 2.447 1.00 . A A . 4 GLU C 1 1 24 17274 1 1 4 GLU CA C -3.938 -5.649 3.922 1.00 . A A . 4 GLU CA 1 1 24 17275 1 1 4 GLU CB C -3.087 -6.579 4.800 1.00 . A A . 4 GLU CB 1 1 24 17276 1 1 4 GLU CD C -0.901 -7.666 3.958 1.00 . A A . 4 GLU CD 1 1 24 17277 1 1 4 GLU CG C -1.611 -6.390 4.406 1.00 . A A . 4 GLU CG 1 1 24 17278 1 1 4 GLU H H -5.266 -4.930 5.339 1.00 . A A . 4 GLU H 1 1 24 17279 1 1 4 GLU HA H -3.502 -4.649 3.977 1.00 . A A . 4 GLU HA 1 1 24 17280 1 1 4 GLU HB2 H -3.205 -6.288 5.846 1.00 . A A . 4 GLU HB2 1 1 24 17281 1 1 4 GLU HB3 H -3.415 -7.615 4.699 1.00 . A A . 4 GLU HB3 1 1 24 17282 1 1 4 GLU HG2 H -1.568 -5.642 3.619 1.00 . A A . 4 GLU HG2 1 1 24 17283 1 1 4 GLU HG3 H -1.041 -5.995 5.246 1.00 . A A . 4 GLU HG3 1 1 24 17284 1 1 4 GLU N N -5.263 -5.451 4.475 1.00 . A A . 4 GLU N 1 1 24 17285 1 1 4 GLU O O -3.785 -7.246 2.141 1.00 . A A . 4 GLU O 1 1 24 17286 1 1 4 GLU OE1 O -1.531 -8.479 3.065 1.00 . A A . 4 GLU OE1 1 1 24 17287 1 1 4 GLU OE2 O 0.225 -7.906 4.386 1.00 . A A . 4 GLU OE2 1 1 24 17288 1 1 5 ARG C C -3.057 -4.794 -0.589 1.00 . A A . 5 ARG C 1 1 24 17289 1 1 5 ARG CA C -4.301 -5.363 0.105 1.00 . A A . 5 ARG CA 1 1 24 17290 1 1 5 ARG CB C -5.571 -4.686 -0.420 1.00 . A A . 5 ARG CB 1 1 24 17291 1 1 5 ARG CD C -7.500 -6.342 -0.520 1.00 . A A . 5 ARG CD 1 1 24 17292 1 1 5 ARG CG C -6.404 -5.611 -1.315 1.00 . A A . 5 ARG CG 1 1 24 17293 1 1 5 ARG CZ C -6.514 -8.442 0.457 1.00 . A A . 5 ARG CZ 1 1 24 17294 1 1 5 ARG H H -4.170 -4.165 1.857 1.00 . A A . 5 ARG H 1 1 24 17295 1 1 5 ARG HA H -4.388 -6.429 -0.063 1.00 . A A . 5 ARG HA 1 1 24 17296 1 1 5 ARG HB2 H -6.185 -4.328 0.404 1.00 . A A . 5 ARG HB2 1 1 24 17297 1 1 5 ARG HB3 H -5.273 -3.823 -1.012 1.00 . A A . 5 ARG HB3 1 1 24 17298 1 1 5 ARG HD2 H -8.158 -5.596 -0.072 1.00 . A A . 5 ARG HD2 1 1 24 17299 1 1 5 ARG HD3 H -8.119 -6.931 -1.198 1.00 . A A . 5 ARG HD3 1 1 24 17300 1 1 5 ARG HG2 H -6.874 -4.991 -2.079 1.00 . A A . 5 ARG HG2 1 1 24 17301 1 1 5 ARG HG3 H -5.758 -6.323 -1.825 1.00 . A A . 5 ARG HG3 1 1 24 17302 1 1 5 ARG HH11 H -6.945 -8.609 -1.521 1.00 . A A . 5 ARG HH11 1 1 24 17303 1 1 5 ARG HH12 H -6.285 -10.048 -0.806 1.00 . A A . 5 ARG HH12 1 1 24 17304 1 1 5 ARG HH21 H -5.900 -8.479 2.379 1.00 . A A . 5 ARG HH21 1 1 24 17305 1 1 5 ARG HH22 H -5.681 -9.994 1.530 1.00 . A A . 5 ARG HH22 1 1 24 17306 1 1 5 ARG N N -4.190 -5.124 1.539 1.00 . A A . 5 ARG N 1 1 24 17307 1 1 5 ARG NE N -6.944 -7.175 0.562 1.00 . A A . 5 ARG NE 1 1 24 17308 1 1 5 ARG NH1 N -6.581 -9.089 -0.711 1.00 . A A . 5 ARG NH1 1 1 24 17309 1 1 5 ARG NH2 N -6.012 -9.044 1.538 1.00 . A A . 5 ARG NH2 1 1 24 17310 1 1 5 ARG O O -2.548 -3.774 -0.127 1.00 . A A . 5 ARG O 1 1 24 17311 1 1 6 PRO C C -1.388 -3.568 -2.912 1.00 . A A . 6 PRO C 1 1 24 17312 1 1 6 PRO CA C -1.341 -4.986 -2.337 1.00 . A A . 6 PRO CA 1 1 24 17313 1 1 6 PRO CB C -1.094 -5.996 -3.463 1.00 . A A . 6 PRO CB 1 1 24 17314 1 1 6 PRO CD C -2.941 -6.742 -2.148 1.00 . A A . 6 PRO CD 1 1 24 17315 1 1 6 PRO CG C -1.755 -7.270 -2.951 1.00 . A A . 6 PRO CG 1 1 24 17316 1 1 6 PRO HA H -0.540 -5.044 -1.610 1.00 . A A . 6 PRO HA 1 1 24 17317 1 1 6 PRO HB2 H -1.609 -5.671 -4.369 1.00 . A A . 6 PRO HB2 1 1 24 17318 1 1 6 PRO HB3 H -0.033 -6.136 -3.667 1.00 . A A . 6 PRO HB3 1 1 24 17319 1 1 6 PRO HD2 H -3.813 -6.627 -2.787 1.00 . A A . 6 PRO HD2 1 1 24 17320 1 1 6 PRO HD3 H -3.144 -7.461 -1.355 1.00 . A A . 6 PRO HD3 1 1 24 17321 1 1 6 PRO HG2 H -2.063 -7.932 -3.764 1.00 . A A . 6 PRO HG2 1 1 24 17322 1 1 6 PRO HG3 H -1.063 -7.789 -2.287 1.00 . A A . 6 PRO HG3 1 1 24 17323 1 1 6 PRO N N -2.544 -5.432 -1.652 1.00 . A A . 6 PRO N 1 1 24 17324 1 1 6 PRO O O -2.399 -2.865 -2.858 1.00 . A A . 6 PRO O 1 1 24 17325 1 1 7 SER C C -1.066 -1.965 -5.488 1.00 . A A . 7 SER C 1 1 24 17326 1 1 7 SER CA C -0.106 -1.971 -4.300 1.00 . A A . 7 SER CA 1 1 24 17327 1 1 7 SER CB C 1.325 -1.917 -4.839 1.00 . A A . 7 SER CB 1 1 24 17328 1 1 7 SER H H 0.553 -3.764 -3.442 1.00 . A A . 7 SER H 1 1 24 17329 1 1 7 SER HA H -0.279 -1.099 -3.668 1.00 . A A . 7 SER HA 1 1 24 17330 1 1 7 SER HB2 H 1.317 -1.183 -5.642 1.00 . A A . 7 SER HB2 1 1 24 17331 1 1 7 SER HB3 H 2.025 -1.597 -4.069 1.00 . A A . 7 SER HB3 1 1 24 17332 1 1 7 SER HG H 0.964 -3.459 -5.926 1.00 . A A . 7 SER HG 1 1 24 17333 1 1 7 SER N N -0.267 -3.184 -3.525 1.00 . A A . 7 SER N 1 1 24 17334 1 1 7 SER O O -0.802 -2.634 -6.485 1.00 . A A . 7 SER O 1 1 24 17335 1 1 7 SER OG O 1.699 -3.190 -5.350 1.00 . A A . 7 SER OG 1 1 24 17336 1 1 8 GLN C C -2.755 0.332 -7.152 1.00 . A A . 8 GLN C 1 1 24 17337 1 1 8 GLN CA C -3.132 -0.940 -6.391 1.00 . A A . 8 GLN CA 1 1 24 17338 1 1 8 GLN CB C -4.468 -0.833 -5.660 1.00 . A A . 8 GLN CB 1 1 24 17339 1 1 8 GLN CD C -5.672 -1.952 -3.762 1.00 . A A . 8 GLN CD 1 1 24 17340 1 1 8 GLN CG C -4.840 -2.173 -5.015 1.00 . A A . 8 GLN CG 1 1 24 17341 1 1 8 GLN H H -2.311 -0.776 -4.474 1.00 . A A . 8 GLN H 1 1 24 17342 1 1 8 GLN HA H -3.174 -1.773 -7.097 1.00 . A A . 8 GLN HA 1 1 24 17343 1 1 8 GLN HB2 H -4.364 -0.094 -4.865 1.00 . A A . 8 GLN HB2 1 1 24 17344 1 1 8 GLN HB3 H -5.257 -0.528 -6.347 1.00 . A A . 8 GLN HB3 1 1 24 17345 1 1 8 GLN HE21 H -4.013 -2.055 -2.587 1.00 . A A . 8 GLN HE21 1 1 24 17346 1 1 8 GLN HE22 H -5.530 -1.668 -1.766 1.00 . A A . 8 GLN HE22 1 1 24 17347 1 1 8 GLN HG2 H -5.384 -2.748 -5.748 1.00 . A A . 8 GLN HG2 1 1 24 17348 1 1 8 GLN HG3 H -3.964 -2.760 -4.754 1.00 . A A . 8 GLN HG3 1 1 24 17349 1 1 8 GLN N N -2.126 -1.174 -5.376 1.00 . A A . 8 GLN N 1 1 24 17350 1 1 8 GLN NE2 N -5.018 -1.868 -2.610 1.00 . A A . 8 GLN NE2 1 1 24 17351 1 1 8 GLN O O -1.958 0.271 -8.084 1.00 . A A . 8 GLN O 1 1 24 17352 1 1 8 GLN OE1 O -6.888 -1.805 -3.826 1.00 . A A . 8 GLN OE1 1 1 24 17353 1 1 9 THR C C -1.499 3.184 -7.326 1.00 . A A . 9 THR C 1 1 24 17354 1 1 9 THR CA C -2.963 2.756 -7.419 1.00 . A A . 9 THR CA 1 1 24 17355 1 1 9 THR CB C -3.839 3.872 -6.831 1.00 . A A . 9 THR CB 1 1 24 17356 1 1 9 THR CG2 C -5.234 3.865 -7.456 1.00 . A A . 9 THR CG2 1 1 24 17357 1 1 9 THR H H -3.820 1.548 -5.896 1.00 . A A . 9 THR H 1 1 24 17358 1 1 9 THR HA H -3.205 2.628 -8.475 1.00 . A A . 9 THR HA 1 1 24 17359 1 1 9 THR HB H -3.373 4.836 -7.047 1.00 . A A . 9 THR HB 1 1 24 17360 1 1 9 THR HG1 H -4.716 3.196 -5.233 1.00 . A A . 9 THR HG1 1 1 24 17361 1 1 9 THR HG21 H -5.662 2.867 -7.429 1.00 . A A . 9 THR HG21 1 1 24 17362 1 1 9 THR HG22 H -5.892 4.546 -6.918 1.00 . A A . 9 THR HG22 1 1 24 17363 1 1 9 THR HG23 H -5.164 4.190 -8.494 1.00 . A A . 9 THR HG23 1 1 24 17364 1 1 9 THR N N -3.197 1.508 -6.693 1.00 . A A . 9 THR N 1 1 24 17365 1 1 9 THR O O -1.053 4.042 -8.082 1.00 . A A . 9 THR O 1 1 24 17366 1 1 9 THR OG1 O -3.939 3.735 -5.426 1.00 . A A . 9 THR OG1 1 1 24 17367 1 1 10 TRP C C 1.326 2.131 -7.705 1.00 . A A . 10 TRP C 1 1 24 17368 1 1 10 TRP CA C 0.706 2.717 -6.427 1.00 . A A . 10 TRP CA 1 1 24 17369 1 1 10 TRP CB C 1.289 2.059 -5.177 1.00 . A A . 10 TRP CB 1 1 24 17370 1 1 10 TRP CD1 C 3.767 1.626 -5.517 1.00 . A A . 10 TRP CD1 1 1 24 17371 1 1 10 TRP CD2 C 3.331 3.530 -4.423 1.00 . A A . 10 TRP CD2 1 1 24 17372 1 1 10 TRP CE2 C 4.731 3.504 -4.655 1.00 . A A . 10 TRP CE2 1 1 24 17373 1 1 10 TRP CE3 C 2.805 4.655 -3.764 1.00 . A A . 10 TRP CE3 1 1 24 17374 1 1 10 TRP CG C 2.740 2.356 -5.033 1.00 . A A . 10 TRP CG 1 1 24 17375 1 1 10 TRP CH2 C 5.016 5.667 -3.613 1.00 . A A . 10 TRP CH2 1 1 24 17376 1 1 10 TRP CZ2 C 5.572 4.555 -4.263 1.00 . A A . 10 TRP CZ2 1 1 24 17377 1 1 10 TRP CZ3 C 3.628 5.725 -3.376 1.00 . A A . 10 TRP CZ3 1 1 24 17378 1 1 10 TRP H H -1.158 1.905 -5.794 1.00 . A A . 10 TRP H 1 1 24 17379 1 1 10 TRP HA H 0.937 3.785 -6.393 1.00 . A A . 10 TRP HA 1 1 24 17380 1 1 10 TRP HB2 H 0.779 2.458 -4.299 1.00 . A A . 10 TRP HB2 1 1 24 17381 1 1 10 TRP HB3 H 1.127 0.985 -5.210 1.00 . A A . 10 TRP HB3 1 1 24 17382 1 1 10 TRP HD1 H 3.662 0.708 -6.076 1.00 . A A . 10 TRP HD1 1 1 24 17383 1 1 10 TRP HE1 H 5.862 2.030 -5.640 1.00 . A A . 10 TRP HE1 1 1 24 17384 1 1 10 TRP HE3 H 1.743 4.682 -3.576 1.00 . A A . 10 TRP HE3 1 1 24 17385 1 1 10 TRP HH2 H 5.666 6.476 -3.327 1.00 . A A . 10 TRP HH2 1 1 24 17386 1 1 10 TRP HZ2 H 6.621 4.529 -4.510 1.00 . A A . 10 TRP HZ2 1 1 24 17387 1 1 10 TRP HZ3 H 3.159 6.592 -2.925 1.00 . A A . 10 TRP HZ3 1 1 24 17388 1 1 10 TRP N N -0.732 2.564 -6.427 1.00 . A A . 10 TRP N 1 1 24 17389 1 1 10 TRP NE1 N 4.947 2.310 -5.311 1.00 . A A . 10 TRP NE1 1 1 24 17390 1 1 10 TRP O O 2.277 2.698 -8.231 1.00 . A A . 10 TRP O 1 1 24 17391 1 1 11 SER C C 2.781 0.310 -9.588 1.00 . A A . 11 SER C 1 1 24 17392 1 1 11 SER CA C 1.257 0.295 -9.383 1.00 . A A . 11 SER CA 1 1 24 17393 1 1 11 SER CB C 0.536 0.879 -10.607 1.00 . A A . 11 SER CB 1 1 24 17394 1 1 11 SER H H -0.049 0.641 -7.758 1.00 . A A . 11 SER H 1 1 24 17395 1 1 11 SER HA H 0.970 -0.752 -9.282 1.00 . A A . 11 SER HA 1 1 24 17396 1 1 11 SER HB2 H 0.693 1.960 -10.646 1.00 . A A . 11 SER HB2 1 1 24 17397 1 1 11 SER HB3 H 0.942 0.441 -11.520 1.00 . A A . 11 SER HB3 1 1 24 17398 1 1 11 SER HG H -1.174 0.675 -9.660 1.00 . A A . 11 SER HG 1 1 24 17399 1 1 11 SER N N 0.808 0.987 -8.178 1.00 . A A . 11 SER N 1 1 24 17400 1 1 11 SER O O 3.266 0.837 -10.584 1.00 . A A . 11 SER O 1 1 24 17401 1 1 11 SER OG O -0.848 0.587 -10.564 1.00 . A A . 11 SER OG 1 1 24 17402 1 1 12 GLY C C 5.667 -0.980 -7.610 1.00 . A A . 12 GLY C 1 1 24 17403 1 1 12 GLY CA C 4.983 -0.403 -8.845 1.00 . A A . 12 GLY CA 1 1 24 17404 1 1 12 GLY H H 3.124 -0.746 -7.870 1.00 . A A . 12 GLY H 1 1 24 17405 1 1 12 GLY HA2 H 5.209 -1.037 -9.704 1.00 . A A . 12 GLY HA2 1 1 24 17406 1 1 12 GLY HA3 H 5.380 0.598 -9.031 1.00 . A A . 12 GLY HA3 1 1 24 17407 1 1 12 GLY N N 3.541 -0.312 -8.679 1.00 . A A . 12 GLY N 1 1 24 17408 1 1 12 GLY O O 5.024 -1.621 -6.771 1.00 . A A . 12 GLY O 1 1 24 17409 1 1 13 ASN C C 7.667 0.308 -5.444 1.00 . A A . 13 ASN C 1 1 24 17410 1 1 13 ASN CA C 7.755 -0.960 -6.296 1.00 . A A . 13 ASN CA 1 1 24 17411 1 1 13 ASN CB C 9.212 -1.284 -6.655 1.00 . A A . 13 ASN CB 1 1 24 17412 1 1 13 ASN CG C 10.061 -1.673 -5.443 1.00 . A A . 13 ASN CG 1 1 24 17413 1 1 13 ASN H H 7.408 -0.167 -8.218 1.00 . A A . 13 ASN H 1 1 24 17414 1 1 13 ASN HA H 7.332 -1.809 -5.764 1.00 . A A . 13 ASN HA 1 1 24 17415 1 1 13 ASN HB2 H 9.219 -2.123 -7.355 1.00 . A A . 13 ASN HB2 1 1 24 17416 1 1 13 ASN HB3 H 9.668 -0.425 -7.150 1.00 . A A . 13 ASN HB3 1 1 24 17417 1 1 13 ASN HD21 H 10.348 0.290 -4.838 1.00 . A A . 13 ASN HD21 1 1 24 17418 1 1 13 ASN HD22 H 11.169 -0.944 -3.923 1.00 . A A . 13 ASN HD22 1 1 24 17419 1 1 13 ASN N N 6.976 -0.737 -7.504 1.00 . A A . 13 ASN N 1 1 24 17420 1 1 13 ASN ND2 N 10.561 -0.697 -4.688 1.00 . A A . 13 ASN ND2 1 1 24 17421 1 1 13 ASN O O 7.490 1.395 -5.988 1.00 . A A . 13 ASN O 1 1 24 17422 1 1 13 ASN OD1 O 10.285 -2.857 -5.188 1.00 . A A . 13 ASN OD1 1 1 24 17423 1 1 14 CYS C C 8.836 2.313 -3.527 1.00 . A A . 14 CYS C 1 1 24 17424 1 1 14 CYS CA C 7.751 1.289 -3.184 1.00 . A A . 14 CYS CA 1 1 24 17425 1 1 14 CYS CB C 7.989 0.756 -1.771 1.00 . A A . 14 CYS CB 1 1 24 17426 1 1 14 CYS H H 7.946 -0.743 -3.756 1.00 . A A . 14 CYS H 1 1 24 17427 1 1 14 CYS HA H 6.771 1.764 -3.216 1.00 . A A . 14 CYS HA 1 1 24 17428 1 1 14 CYS HB2 H 7.263 -0.025 -1.549 1.00 . A A . 14 CYS HB2 1 1 24 17429 1 1 14 CYS HB3 H 8.992 0.335 -1.729 1.00 . A A . 14 CYS HB3 1 1 24 17430 1 1 14 CYS N N 7.762 0.180 -4.124 1.00 . A A . 14 CYS N 1 1 24 17431 1 1 14 CYS O O 9.856 1.964 -4.120 1.00 . A A . 14 CYS O 1 1 24 17432 1 1 14 CYS SG S 7.883 2.020 -0.482 1.00 . A A . 14 CYS SG 1 1 24 17433 1 1 15 GLY C C 9.652 5.346 -1.849 1.00 . A A . 15 GLY C 1 1 24 17434 1 1 15 GLY CA C 9.537 4.674 -3.212 1.00 . A A . 15 GLY CA 1 1 24 17435 1 1 15 GLY H H 7.744 3.714 -2.610 1.00 . A A . 15 GLY H 1 1 24 17436 1 1 15 GLY HA2 H 10.522 4.330 -3.515 1.00 . A A . 15 GLY HA2 1 1 24 17437 1 1 15 GLY HA3 H 9.172 5.395 -3.945 1.00 . A A . 15 GLY HA3 1 1 24 17438 1 1 15 GLY N N 8.601 3.563 -3.121 1.00 . A A . 15 GLY N 1 1 24 17439 1 1 15 GLY O O 10.744 5.510 -1.313 1.00 . A A . 15 GLY O 1 1 24 17440 1 1 16 ASN C C 7.092 5.752 0.711 1.00 . A A . 16 ASN C 1 1 24 17441 1 1 16 ASN CA C 8.391 6.238 0.078 1.00 . A A . 16 ASN CA 1 1 24 17442 1 1 16 ASN CB C 8.469 7.770 0.070 1.00 . A A . 16 ASN CB 1 1 24 17443 1 1 16 ASN CG C 8.680 8.328 1.473 1.00 . A A . 16 ASN CG 1 1 24 17444 1 1 16 ASN H H 7.648 5.544 -1.779 1.00 . A A . 16 ASN H 1 1 24 17445 1 1 16 ASN HA H 9.229 5.861 0.666 1.00 . A A . 16 ASN HA 1 1 24 17446 1 1 16 ASN HB2 H 9.321 8.072 -0.540 1.00 . A A . 16 ASN HB2 1 1 24 17447 1 1 16 ASN HB3 H 7.563 8.205 -0.349 1.00 . A A . 16 ASN HB3 1 1 24 17448 1 1 16 ASN HD21 H 9.924 9.795 0.792 1.00 . A A . 16 ASN HD21 1 1 24 17449 1 1 16 ASN HD22 H 9.607 9.775 2.513 1.00 . A A . 16 ASN HD22 1 1 24 17450 1 1 16 ASN N N 8.503 5.712 -1.275 1.00 . A A . 16 ASN N 1 1 24 17451 1 1 16 ASN ND2 N 9.462 9.394 1.594 1.00 . A A . 16 ASN ND2 1 1 24 17452 1 1 16 ASN O O 6.018 5.944 0.141 1.00 . A A . 16 ASN O 1 1 24 17453 1 1 16 ASN OD1 O 8.122 7.820 2.442 1.00 . A A . 16 ASN OD1 1 1 24 17454 1 1 17 THR C C 5.049 5.711 3.005 1.00 . A A . 17 THR C 1 1 24 17455 1 1 17 THR CA C 6.021 4.601 2.590 1.00 . A A . 17 THR CA 1 1 24 17456 1 1 17 THR CB C 6.467 3.696 3.749 1.00 . A A . 17 THR CB 1 1 24 17457 1 1 17 THR CG2 C 7.072 4.468 4.925 1.00 . A A . 17 THR CG2 1 1 24 17458 1 1 17 THR H H 8.087 5.046 2.328 1.00 . A A . 17 THR H 1 1 24 17459 1 1 17 THR HA H 5.505 3.961 1.881 1.00 . A A . 17 THR HA 1 1 24 17460 1 1 17 THR HB H 7.224 3.018 3.357 1.00 . A A . 17 THR HB 1 1 24 17461 1 1 17 THR HG1 H 4.703 3.489 4.540 1.00 . A A . 17 THR HG1 1 1 24 17462 1 1 17 THR HG21 H 7.910 5.077 4.589 1.00 . A A . 17 THR HG21 1 1 24 17463 1 1 17 THR HG22 H 6.327 5.111 5.394 1.00 . A A . 17 THR HG22 1 1 24 17464 1 1 17 THR HG23 H 7.435 3.758 5.670 1.00 . A A . 17 THR HG23 1 1 24 17465 1 1 17 THR N N 7.182 5.132 1.891 1.00 . A A . 17 THR N 1 1 24 17466 1 1 17 THR O O 3.842 5.481 3.083 1.00 . A A . 17 THR O 1 1 24 17467 1 1 17 THR OG1 O 5.387 2.903 4.197 1.00 . A A . 17 THR OG1 1 1 24 17468 1 1 18 ALA C C 3.787 8.249 2.202 1.00 . A A . 18 ALA C 1 1 24 17469 1 1 18 ALA CA C 4.671 8.074 3.437 1.00 . A A . 18 ALA CA 1 1 24 17470 1 1 18 ALA CB C 5.500 9.331 3.712 1.00 . A A . 18 ALA CB 1 1 24 17471 1 1 18 ALA H H 6.544 7.094 3.149 1.00 . A A . 18 ALA H 1 1 24 17472 1 1 18 ALA HA H 4.036 7.886 4.305 1.00 . A A . 18 ALA HA 1 1 24 17473 1 1 18 ALA HB1 H 6.134 9.172 4.585 1.00 . A A . 18 ALA HB1 1 1 24 17474 1 1 18 ALA HB2 H 6.128 9.573 2.854 1.00 . A A . 18 ALA HB2 1 1 24 17475 1 1 18 ALA HB3 H 4.833 10.170 3.909 1.00 . A A . 18 ALA HB3 1 1 24 17476 1 1 18 ALA N N 5.546 6.931 3.234 1.00 . A A . 18 ALA N 1 1 24 17477 1 1 18 ALA O O 2.566 8.347 2.303 1.00 . A A . 18 ALA O 1 1 24 17478 1 1 19 HIS C C 2.732 7.193 -0.433 1.00 . A A . 19 HIS C 1 1 24 17479 1 1 19 HIS CA C 3.656 8.397 -0.226 1.00 . A A . 19 HIS CA 1 1 24 17480 1 1 19 HIS CB C 4.603 8.625 -1.413 1.00 . A A . 19 HIS CB 1 1 24 17481 1 1 19 HIS CD2 C 2.658 9.539 -2.903 1.00 . A A . 19 HIS CD2 1 1 24 17482 1 1 19 HIS CE1 C 3.619 9.290 -4.850 1.00 . A A . 19 HIS CE1 1 1 24 17483 1 1 19 HIS CG C 3.925 9.046 -2.697 1.00 . A A . 19 HIS CG 1 1 24 17484 1 1 19 HIS H H 5.389 8.053 0.980 1.00 . A A . 19 HIS H 1 1 24 17485 1 1 19 HIS HA H 3.040 9.289 -0.119 1.00 . A A . 19 HIS HA 1 1 24 17486 1 1 19 HIS HB2 H 5.299 9.412 -1.160 1.00 . A A . 19 HIS HB2 1 1 24 17487 1 1 19 HIS HB3 H 5.173 7.714 -1.571 1.00 . A A . 19 HIS HB3 1 1 24 17488 1 1 19 HIS HD1 H 5.494 8.668 -4.127 1.00 . A A . 19 HIS HD1 1 1 24 17489 1 1 19 HIS HD2 H 1.917 9.717 -2.134 1.00 . A A . 19 HIS HD2 1 1 24 17490 1 1 19 HIS HE1 H 3.776 9.266 -5.922 1.00 . A A . 19 HIS HE1 1 1 24 17491 1 1 19 HIS N N 4.400 8.253 1.015 1.00 . A A . 19 HIS N 1 1 24 17492 1 1 19 HIS ND1 N 4.547 8.965 -3.937 1.00 . A A . 19 HIS ND1 1 1 24 17493 1 1 19 HIS NE2 N 2.459 9.634 -4.269 1.00 . A A . 19 HIS NE2 1 1 24 17494 1 1 19 HIS O O 1.605 7.381 -0.882 1.00 . A A . 19 HIS O 1 1 24 17495 1 1 20 CYS C C 1.052 5.040 0.659 1.00 . A A . 20 CYS C 1 1 24 17496 1 1 20 CYS CA C 2.327 4.787 -0.134 1.00 . A A . 20 CYS CA 1 1 24 17497 1 1 20 CYS CB C 3.033 3.571 0.464 1.00 . A A . 20 CYS CB 1 1 24 17498 1 1 20 CYS H H 4.155 5.878 0.178 1.00 . A A . 20 CYS H 1 1 24 17499 1 1 20 CYS HA H 2.048 4.560 -1.160 1.00 . A A . 20 CYS HA 1 1 24 17500 1 1 20 CYS HB2 H 3.869 3.277 -0.164 1.00 . A A . 20 CYS HB2 1 1 24 17501 1 1 20 CYS HB3 H 3.403 3.816 1.447 1.00 . A A . 20 CYS HB3 1 1 24 17502 1 1 20 CYS N N 3.186 5.974 -0.113 1.00 . A A . 20 CYS N 1 1 24 17503 1 1 20 CYS O O -0.056 4.835 0.161 1.00 . A A . 20 CYS O 1 1 24 17504 1 1 20 CYS SG S 1.937 2.162 0.750 1.00 . A A . 20 CYS SG 1 1 24 17505 1 1 21 ASP C C -0.802 6.869 2.112 1.00 . A A . 21 ASP C 1 1 24 17506 1 1 21 ASP CA C 0.090 5.803 2.752 1.00 . A A . 21 ASP CA 1 1 24 17507 1 1 21 ASP CB C 0.585 6.269 4.123 1.00 . A A . 21 ASP CB 1 1 24 17508 1 1 21 ASP CG C -0.597 6.762 4.938 1.00 . A A . 21 ASP CG 1 1 24 17509 1 1 21 ASP H H 2.161 5.686 2.243 1.00 . A A . 21 ASP H 1 1 24 17510 1 1 21 ASP HA H -0.487 4.877 2.878 1.00 . A A . 21 ASP HA 1 1 24 17511 1 1 21 ASP HB2 H 1.075 5.449 4.645 1.00 . A A . 21 ASP HB2 1 1 24 17512 1 1 21 ASP HB3 H 1.294 7.087 4.017 1.00 . A A . 21 ASP HB3 1 1 24 17513 1 1 21 ASP N N 1.218 5.542 1.884 1.00 . A A . 21 ASP N 1 1 24 17514 1 1 21 ASP O O -2.016 6.671 2.038 1.00 . A A . 21 ASP O 1 1 24 17515 1 1 21 ASP OD1 O -1.474 5.957 5.235 1.00 . A A . 21 ASP OD1 1 1 24 17516 1 1 21 ASP OD2 O -0.621 8.090 5.223 1.00 . A A . 21 ASP OD2 1 1 24 17517 1 1 22 LYS C C -1.828 8.341 -0.167 1.00 . A A . 22 LYS C 1 1 24 17518 1 1 22 LYS CA C -0.991 8.986 0.919 1.00 . A A . 22 LYS CA 1 1 24 17519 1 1 22 LYS CB C -0.152 10.089 0.277 1.00 . A A . 22 LYS CB 1 1 24 17520 1 1 22 LYS CD C 1.022 12.292 0.892 1.00 . A A . 22 LYS CD 1 1 24 17521 1 1 22 LYS CE C -0.070 13.200 0.297 1.00 . A A . 22 LYS CE 1 1 24 17522 1 1 22 LYS CG C 0.543 10.906 1.352 1.00 . A A . 22 LYS CG 1 1 24 17523 1 1 22 LYS H H 0.792 8.079 1.732 1.00 . A A . 22 LYS H 1 1 24 17524 1 1 22 LYS HA H -1.649 9.460 1.645 1.00 . A A . 22 LYS HA 1 1 24 17525 1 1 22 LYS HB2 H 0.587 9.662 -0.393 1.00 . A A . 22 LYS HB2 1 1 24 17526 1 1 22 LYS HB3 H -0.820 10.719 -0.307 1.00 . A A . 22 LYS HB3 1 1 24 17527 1 1 22 LYS HD2 H 1.468 12.792 1.756 1.00 . A A . 22 LYS HD2 1 1 24 17528 1 1 22 LYS HD3 H 1.810 12.167 0.146 1.00 . A A . 22 LYS HD3 1 1 24 17529 1 1 22 LYS HE2 H 0.294 14.228 0.312 1.00 . A A . 22 LYS HE2 1 1 24 17530 1 1 22 LYS HE3 H -0.247 12.924 -0.745 1.00 . A A . 22 LYS HE3 1 1 24 17531 1 1 22 LYS HG2 H -0.087 10.992 2.237 1.00 . A A . 22 LYS HG2 1 1 24 17532 1 1 22 LYS HG3 H 1.398 10.295 1.606 1.00 . A A . 22 LYS HG3 1 1 24 17533 1 1 22 LYS HZ1 H -1.988 13.868 0.678 1.00 . A A . 22 LYS HZ1 1 1 24 17534 1 1 22 LYS HZ2 H -1.792 12.208 0.867 1.00 . A A . 22 LYS HZ2 1 1 24 17535 1 1 22 LYS N N -0.213 7.973 1.626 1.00 . A A . 22 LYS N 1 1 24 17536 1 1 22 LYS NZ N -1.358 13.129 1.024 1.00 . A A . 22 LYS NZ 1 1 24 17537 1 1 22 LYS O O -3.040 8.496 -0.170 1.00 . A A . 22 LYS O 1 1 24 17538 1 1 23 GLN C C -3.054 6.121 -1.686 1.00 . A A . 23 GLN C 1 1 24 17539 1 1 23 GLN CA C -1.928 7.020 -2.193 1.00 . A A . 23 GLN CA 1 1 24 17540 1 1 23 GLN CB C -1.050 6.340 -3.244 1.00 . A A . 23 GLN CB 1 1 24 17541 1 1 23 GLN CD C 0.041 7.607 -5.180 1.00 . A A . 23 GLN CD 1 1 24 17542 1 1 23 GLN CG C 0.102 7.246 -3.703 1.00 . A A . 23 GLN CG 1 1 24 17543 1 1 23 GLN H H -0.186 7.517 -1.004 1.00 . A A . 23 GLN H 1 1 24 17544 1 1 23 GLN HA H -2.357 7.856 -2.728 1.00 . A A . 23 GLN HA 1 1 24 17545 1 1 23 GLN HB2 H -0.625 5.436 -2.804 1.00 . A A . 23 GLN HB2 1 1 24 17546 1 1 23 GLN HB3 H -1.692 6.045 -4.075 1.00 . A A . 23 GLN HB3 1 1 24 17547 1 1 23 GLN HE21 H -0.351 5.680 -5.739 1.00 . A A . 23 GLN HE21 1 1 24 17548 1 1 23 GLN HE22 H -0.210 6.839 -7.029 1.00 . A A . 23 GLN HE22 1 1 24 17549 1 1 23 GLN HG2 H 0.097 8.187 -3.160 1.00 . A A . 23 GLN HG2 1 1 24 17550 1 1 23 GLN HG3 H 1.045 6.752 -3.531 1.00 . A A . 23 GLN HG3 1 1 24 17551 1 1 23 GLN N N -1.190 7.637 -1.100 1.00 . A A . 23 GLN N 1 1 24 17552 1 1 23 GLN NE2 N -0.184 6.627 -6.046 1.00 . A A . 23 GLN NE2 1 1 24 17553 1 1 23 GLN O O -4.206 6.271 -2.090 1.00 . A A . 23 GLN O 1 1 24 17554 1 1 23 GLN OE1 O 0.244 8.770 -5.531 1.00 . A A . 23 GLN OE1 1 1 24 17555 1 1 24 CYS C C -4.963 5.067 0.322 1.00 . A A . 24 CYS C 1 1 24 17556 1 1 24 CYS CA C -3.758 4.306 -0.245 1.00 . A A . 24 CYS CA 1 1 24 17557 1 1 24 CYS CB C -3.126 3.388 0.798 1.00 . A A . 24 CYS CB 1 1 24 17558 1 1 24 CYS H H -1.787 5.125 -0.445 1.00 . A A . 24 CYS H 1 1 24 17559 1 1 24 CYS HA H -4.120 3.710 -1.085 1.00 . A A . 24 CYS HA 1 1 24 17560 1 1 24 CYS HB2 H -2.593 3.988 1.534 1.00 . A A . 24 CYS HB2 1 1 24 17561 1 1 24 CYS HB3 H -3.908 2.835 1.310 1.00 . A A . 24 CYS HB3 1 1 24 17562 1 1 24 CYS N N -2.748 5.212 -0.769 1.00 . A A . 24 CYS N 1 1 24 17563 1 1 24 CYS O O -6.107 4.701 0.062 1.00 . A A . 24 CYS O 1 1 24 17564 1 1 24 CYS SG S -2.004 2.142 0.129 1.00 . A A . 24 CYS SG 1 1 24 17565 1 1 25 GLN C C -6.505 7.756 0.524 1.00 . A A . 25 GLN C 1 1 24 17566 1 1 25 GLN CA C -5.838 6.921 1.632 1.00 . A A . 25 GLN CA 1 1 24 17567 1 1 25 GLN CB C -5.316 7.802 2.778 1.00 . A A . 25 GLN CB 1 1 24 17568 1 1 25 GLN CD C -4.101 7.842 4.983 1.00 . A A . 25 GLN CD 1 1 24 17569 1 1 25 GLN CG C -4.733 6.959 3.913 1.00 . A A . 25 GLN CG 1 1 24 17570 1 1 25 GLN H H -3.776 6.430 1.264 1.00 . A A . 25 GLN H 1 1 24 17571 1 1 25 GLN HA H -6.576 6.243 2.059 1.00 . A A . 25 GLN HA 1 1 24 17572 1 1 25 GLN HB2 H -4.539 8.475 2.418 1.00 . A A . 25 GLN HB2 1 1 24 17573 1 1 25 GLN HB3 H -6.138 8.396 3.182 1.00 . A A . 25 GLN HB3 1 1 24 17574 1 1 25 GLN HE21 H -5.233 6.983 6.425 1.00 . A A . 25 GLN HE21 1 1 24 17575 1 1 25 GLN HE22 H -4.168 8.274 6.964 1.00 . A A . 25 GLN HE22 1 1 24 17576 1 1 25 GLN HG2 H -5.532 6.358 4.343 1.00 . A A . 25 GLN HG2 1 1 24 17577 1 1 25 GLN HG3 H -3.962 6.291 3.537 1.00 . A A . 25 GLN HG3 1 1 24 17578 1 1 25 GLN N N -4.734 6.147 1.074 1.00 . A A . 25 GLN N 1 1 24 17579 1 1 25 GLN NE2 N -4.543 7.702 6.224 1.00 . A A . 25 GLN NE2 1 1 24 17580 1 1 25 GLN O O -7.678 7.567 0.183 1.00 . A A . 25 GLN O 1 1 24 17581 1 1 25 GLN OE1 O -3.212 8.645 4.706 1.00 . A A . 25 GLN OE1 1 1 24 17582 1 1 26 ASP C C -6.756 9.025 -2.236 1.00 . A A . 26 ASP C 1 1 24 17583 1 1 26 ASP CA C -6.156 9.689 -1.004 1.00 . A A . 26 ASP CA 1 1 24 17584 1 1 26 ASP CB C -4.992 10.600 -1.421 1.00 . A A . 26 ASP CB 1 1 24 17585 1 1 26 ASP CG C -4.502 11.539 -0.317 1.00 . A A . 26 ASP CG 1 1 24 17586 1 1 26 ASP H H -4.753 8.672 0.220 1.00 . A A . 26 ASP H 1 1 24 17587 1 1 26 ASP HA H -6.925 10.304 -0.550 1.00 . A A . 26 ASP HA 1 1 24 17588 1 1 26 ASP HB2 H -4.165 9.996 -1.778 1.00 . A A . 26 ASP HB2 1 1 24 17589 1 1 26 ASP HB3 H -5.326 11.202 -2.263 1.00 . A A . 26 ASP HB3 1 1 24 17590 1 1 26 ASP N N -5.731 8.691 -0.034 1.00 . A A . 26 ASP N 1 1 24 17591 1 1 26 ASP O O -7.890 9.325 -2.597 1.00 . A A . 26 ASP O 1 1 24 17592 1 1 26 ASP OD1 O -5.430 12.370 0.235 1.00 . A A . 26 ASP OD1 1 1 24 17593 1 1 26 ASP OD2 O -3.310 11.546 0.009 1.00 . A A . 26 ASP OD2 1 1 24 17594 1 1 27 TRP C C -7.373 6.362 -3.706 1.00 . A A . 27 TRP C 1 1 24 17595 1 1 27 TRP CA C -6.435 7.501 -4.111 1.00 . A A . 27 TRP CA 1 1 24 17596 1 1 27 TRP CB C -5.245 6.941 -4.913 1.00 . A A . 27 TRP CB 1 1 24 17597 1 1 27 TRP CD1 C -3.736 8.955 -4.942 1.00 . A A . 27 TRP CD1 1 1 24 17598 1 1 27 TRP CD2 C -3.828 7.968 -6.938 1.00 . A A . 27 TRP CD2 1 1 24 17599 1 1 27 TRP CE2 C -2.862 9.013 -7.036 1.00 . A A . 27 TRP CE2 1 1 24 17600 1 1 27 TRP CE3 C -4.066 7.204 -8.096 1.00 . A A . 27 TRP CE3 1 1 24 17601 1 1 27 TRP CG C -4.330 7.925 -5.574 1.00 . A A . 27 TRP CG 1 1 24 17602 1 1 27 TRP CH2 C -2.375 8.450 -9.339 1.00 . A A . 27 TRP CH2 1 1 24 17603 1 1 27 TRP CZ2 C -2.147 9.264 -8.217 1.00 . A A . 27 TRP CZ2 1 1 24 17604 1 1 27 TRP CZ3 C -3.329 7.420 -9.275 1.00 . A A . 27 TRP CZ3 1 1 24 17605 1 1 27 TRP H H -5.113 7.861 -2.477 1.00 . A A . 27 TRP H 1 1 24 17606 1 1 27 TRP HA H -6.976 8.211 -4.740 1.00 . A A . 27 TRP HA 1 1 24 17607 1 1 27 TRP HB2 H -4.633 6.233 -4.372 1.00 . A A . 27 TRP HB2 1 1 24 17608 1 1 27 TRP HB3 H -5.692 6.357 -5.710 1.00 . A A . 27 TRP HB3 1 1 24 17609 1 1 27 TRP HD1 H -3.878 9.176 -3.907 1.00 . A A . 27 TRP HD1 1 1 24 17610 1 1 27 TRP HE1 H -2.269 10.376 -5.530 1.00 . A A . 27 TRP HE1 1 1 24 17611 1 1 27 TRP HE3 H -4.818 6.437 -8.048 1.00 . A A . 27 TRP HE3 1 1 24 17612 1 1 27 TRP HH2 H -1.818 8.615 -10.250 1.00 . A A . 27 TRP HH2 1 1 24 17613 1 1 27 TRP HZ2 H -1.421 10.062 -8.258 1.00 . A A . 27 TRP HZ2 1 1 24 17614 1 1 27 TRP HZ3 H -3.491 6.779 -10.128 1.00 . A A . 27 TRP HZ3 1 1 24 17615 1 1 27 TRP N N -6.005 8.133 -2.876 1.00 . A A . 27 TRP N 1 1 24 17616 1 1 27 TRP NE1 N -2.859 9.599 -5.786 1.00 . A A . 27 TRP NE1 1 1 24 17617 1 1 27 TRP O O -8.580 6.440 -3.927 1.00 . A A . 27 TRP O 1 1 24 17618 1 1 28 GLU C C -8.772 3.967 -2.333 1.00 . A A . 28 GLU C 1 1 24 17619 1 1 28 GLU CA C -7.461 4.010 -3.121 1.00 . A A . 28 GLU CA 1 1 24 17620 1 1 28 GLU CB C -6.480 2.920 -2.650 1.00 . A A . 28 GLU CB 1 1 24 17621 1 1 28 GLU CD C -6.795 1.277 -4.572 1.00 . A A . 28 GLU CD 1 1 24 17622 1 1 28 GLU CG C -6.928 1.513 -3.072 1.00 . A A . 28 GLU CG 1 1 24 17623 1 1 28 GLU H H -5.872 5.408 -2.747 1.00 . A A . 28 GLU H 1 1 24 17624 1 1 28 GLU HA H -7.694 3.829 -4.174 1.00 . A A . 28 GLU HA 1 1 24 17625 1 1 28 GLU HB2 H -5.483 3.116 -3.048 1.00 . A A . 28 GLU HB2 1 1 24 17626 1 1 28 GLU HB3 H -6.414 2.923 -1.565 1.00 . A A . 28 GLU HB3 1 1 24 17627 1 1 28 GLU HG2 H -6.306 0.782 -2.559 1.00 . A A . 28 GLU HG2 1 1 24 17628 1 1 28 GLU HG3 H -7.965 1.363 -2.777 1.00 . A A . 28 GLU HG3 1 1 24 17629 1 1 28 GLU N N -6.844 5.332 -3.038 1.00 . A A . 28 GLU N 1 1 24 17630 1 1 28 GLU O O -9.800 3.641 -2.916 1.00 . A A . 28 GLU O 1 1 24 17631 1 1 28 GLU OE1 O -5.912 1.869 -5.190 1.00 . A A . 28 GLU OE1 1 1 24 17632 1 1 28 GLU OE2 O -7.664 0.395 -5.136 1.00 . A A . 28 GLU OE2 1 1 24 17633 1 1 29 LYS C C -9.442 3.725 1.220 1.00 . A A . 29 LYS C 1 1 24 17634 1 1 29 LYS CA C -9.753 4.530 -0.049 1.00 . A A . 29 LYS CA 1 1 24 17635 1 1 29 LYS CB C -11.176 4.283 -0.553 1.00 . A A . 29 LYS CB 1 1 24 17636 1 1 29 LYS CD C -11.924 6.722 -0.802 1.00 . A A . 29 LYS CD 1 1 24 17637 1 1 29 LYS CE C -11.161 7.817 -1.556 1.00 . A A . 29 LYS CE 1 1 24 17638 1 1 29 LYS CG C -11.802 5.344 -1.475 1.00 . A A . 29 LYS CG 1 1 24 17639 1 1 29 LYS H H -7.800 4.458 -0.657 1.00 . A A . 29 LYS H 1 1 24 17640 1 1 29 LYS HA H -9.667 5.571 0.251 1.00 . A A . 29 LYS HA 1 1 24 17641 1 1 29 LYS HB2 H -11.276 3.284 -0.977 1.00 . A A . 29 LYS HB2 1 1 24 17642 1 1 29 LYS HB3 H -11.752 4.307 0.354 1.00 . A A . 29 LYS HB3 1 1 24 17643 1 1 29 LYS HD2 H -12.981 7.004 -0.795 1.00 . A A . 29 LYS HD2 1 1 24 17644 1 1 29 LYS HD3 H -11.605 6.685 0.241 1.00 . A A . 29 LYS HD3 1 1 24 17645 1 1 29 LYS HE2 H -11.604 7.945 -2.546 1.00 . A A . 29 LYS HE2 1 1 24 17646 1 1 29 LYS HE3 H -11.267 8.757 -1.011 1.00 . A A . 29 LYS HE3 1 1 24 17647 1 1 29 LYS HG2 H -11.284 5.415 -2.428 1.00 . A A . 29 LYS HG2 1 1 24 17648 1 1 29 LYS HG3 H -12.810 4.994 -1.702 1.00 . A A . 29 LYS HG3 1 1 24 17649 1 1 29 LYS HZ1 H -9.596 6.532 -1.962 1.00 . A A . 29 LYS HZ1 1 1 24 17650 1 1 29 LYS HZ2 H -9.336 8.112 -2.478 1.00 . A A . 29 LYS HZ2 1 1 24 17651 1 1 29 LYS N N -8.712 4.273 -1.030 1.00 . A A . 29 LYS N 1 1 24 17652 1 1 29 LYS NZ N -9.720 7.526 -1.722 1.00 . A A . 29 LYS NZ 1 1 24 17653 1 1 29 LYS O O -10.303 3.038 1.764 1.00 . A A . 29 LYS O 1 1 24 17654 1 1 30 ALA C C -7.807 3.774 4.101 1.00 . A A . 30 ALA C 1 1 24 17655 1 1 30 ALA CA C -7.741 2.976 2.803 1.00 . A A . 30 ALA CA 1 1 24 17656 1 1 30 ALA CB C -6.308 2.541 2.529 1.00 . A A . 30 ALA CB 1 1 24 17657 1 1 30 ALA H H -7.507 4.355 1.213 1.00 . A A . 30 ALA H 1 1 24 17658 1 1 30 ALA HA H -8.351 2.081 2.893 1.00 . A A . 30 ALA HA 1 1 24 17659 1 1 30 ALA HB1 H -6.246 2.116 1.529 1.00 . A A . 30 ALA HB1 1 1 24 17660 1 1 30 ALA HB2 H -5.649 3.407 2.611 1.00 . A A . 30 ALA HB2 1 1 24 17661 1 1 30 ALA HB3 H -6.012 1.794 3.258 1.00 . A A . 30 ALA HB3 1 1 24 17662 1 1 30 ALA N N -8.193 3.773 1.680 1.00 . A A . 30 ALA N 1 1 24 17663 1 1 30 ALA O O -7.766 5.002 4.076 1.00 . A A . 30 ALA O 1 1 24 17664 1 1 31 SER C C -6.062 4.204 6.484 1.00 . A A . 31 SER C 1 1 24 17665 1 1 31 SER CA C -7.503 3.689 6.510 1.00 . A A . 31 SER CA 1 1 24 17666 1 1 31 SER CB C -7.699 2.646 7.598 1.00 . A A . 31 SER CB 1 1 24 17667 1 1 31 SER H H -7.813 2.069 5.254 1.00 . A A . 31 SER H 1 1 24 17668 1 1 31 SER HA H -8.182 4.514 6.709 1.00 . A A . 31 SER HA 1 1 24 17669 1 1 31 SER HB2 H -7.103 1.766 7.381 1.00 . A A . 31 SER HB2 1 1 24 17670 1 1 31 SER HB3 H -7.353 3.073 8.526 1.00 . A A . 31 SER HB3 1 1 24 17671 1 1 31 SER HG H -9.370 1.877 6.914 1.00 . A A . 31 SER HG 1 1 24 17672 1 1 31 SER N N -7.814 3.079 5.243 1.00 . A A . 31 SER N 1 1 24 17673 1 1 31 SER O O -5.797 5.321 6.923 1.00 . A A . 31 SER O 1 1 24 17674 1 1 31 SER OG O -9.062 2.299 7.729 1.00 . A A . 31 SER OG 1 1 24 17675 1 1 32 HIS C C -3.093 2.955 4.676 1.00 . A A . 32 HIS C 1 1 24 17676 1 1 32 HIS CA C -3.753 3.834 5.735 1.00 . A A . 32 HIS CA 1 1 24 17677 1 1 32 HIS CB C -2.948 3.815 7.051 1.00 . A A . 32 HIS CB 1 1 24 17678 1 1 32 HIS CD2 C -2.924 1.346 7.696 1.00 . A A . 32 HIS CD2 1 1 24 17679 1 1 32 HIS CE1 C -0.793 0.955 7.688 1.00 . A A . 32 HIS CE1 1 1 24 17680 1 1 32 HIS CG C -2.295 2.502 7.374 1.00 . A A . 32 HIS CG 1 1 24 17681 1 1 32 HIS H H -5.399 2.517 5.544 1.00 . A A . 32 HIS H 1 1 24 17682 1 1 32 HIS HA H -3.788 4.853 5.356 1.00 . A A . 32 HIS HA 1 1 24 17683 1 1 32 HIS HB2 H -2.140 4.520 7.002 1.00 . A A . 32 HIS HB2 1 1 24 17684 1 1 32 HIS HB3 H -3.582 4.124 7.882 1.00 . A A . 32 HIS HB3 1 1 24 17685 1 1 32 HIS HD1 H -0.197 2.862 6.989 1.00 . A A . 32 HIS HD1 1 1 24 17686 1 1 32 HIS HD2 H -3.985 1.266 7.645 1.00 . A A . 32 HIS HD2 1 1 24 17687 1 1 32 HIS HE1 H 0.145 0.424 7.736 1.00 . A A . 32 HIS HE1 1 1 24 17688 1 1 32 HIS N N -5.126 3.400 5.957 1.00 . A A . 32 HIS N 1 1 24 17689 1 1 32 HIS ND1 N -0.933 2.248 7.340 1.00 . A A . 32 HIS ND1 1 1 24 17690 1 1 32 HIS NE2 N -1.977 0.376 7.940 1.00 . A A . 32 HIS NE2 1 1 24 17691 1 1 32 HIS O O -3.679 1.960 4.238 1.00 . A A . 32 HIS O 1 1 24 17692 1 1 33 GLY C C 0.386 2.254 4.325 1.00 . A A . 33 GLY C 1 1 24 17693 1 1 33 GLY CA C -0.938 2.433 3.590 1.00 . A A . 33 GLY CA 1 1 24 17694 1 1 33 GLY H H -1.466 4.145 4.730 1.00 . A A . 33 GLY H 1 1 24 17695 1 1 33 GLY HA2 H -1.389 1.472 3.466 1.00 . A A . 33 GLY HA2 1 1 24 17696 1 1 33 GLY HA3 H -0.753 2.805 2.592 1.00 . A A . 33 GLY HA3 1 1 24 17697 1 1 33 GLY N N -1.848 3.291 4.336 1.00 . A A . 33 GLY N 1 1 24 17698 1 1 33 GLY O O 0.646 2.957 5.305 1.00 . A A . 33 GLY O 1 1 24 17699 1 1 34 ALA C C 3.280 0.104 3.419 1.00 . A A . 34 ALA C 1 1 24 17700 1 1 34 ALA CA C 2.536 1.029 4.390 1.00 . A A . 34 ALA CA 1 1 24 17701 1 1 34 ALA CB C 2.441 0.409 5.788 1.00 . A A . 34 ALA CB 1 1 24 17702 1 1 34 ALA H H 0.878 0.716 3.103 1.00 . A A . 34 ALA H 1 1 24 17703 1 1 34 ALA HA H 3.065 1.978 4.462 1.00 . A A . 34 ALA HA 1 1 24 17704 1 1 34 ALA HB1 H 1.788 -0.465 5.766 1.00 . A A . 34 ALA HB1 1 1 24 17705 1 1 34 ALA HB2 H 3.431 0.114 6.130 1.00 . A A . 34 ALA HB2 1 1 24 17706 1 1 34 ALA HB3 H 2.036 1.137 6.491 1.00 . A A . 34 ALA HB3 1 1 24 17707 1 1 34 ALA N N 1.197 1.293 3.878 1.00 . A A . 34 ALA N 1 1 24 17708 1 1 34 ALA O O 2.678 -0.838 2.898 1.00 . A A . 34 ALA O 1 1 24 17709 1 1 35 CYS C C 5.945 -1.679 2.973 1.00 . A A . 35 CYS C 1 1 24 17710 1 1 35 CYS CA C 5.386 -0.446 2.262 1.00 . A A . 35 CYS CA 1 1 24 17711 1 1 35 CYS CB C 6.536 0.399 1.719 1.00 . A A . 35 CYS CB 1 1 24 17712 1 1 35 CYS H H 5.030 1.160 3.581 1.00 . A A . 35 CYS H 1 1 24 17713 1 1 35 CYS HA H 4.785 -0.746 1.412 1.00 . A A . 35 CYS HA 1 1 24 17714 1 1 35 CYS HB2 H 7.049 0.907 2.531 1.00 . A A . 35 CYS HB2 1 1 24 17715 1 1 35 CYS HB3 H 7.242 -0.278 1.264 1.00 . A A . 35 CYS HB3 1 1 24 17716 1 1 35 CYS N N 4.568 0.360 3.159 1.00 . A A . 35 CYS N 1 1 24 17717 1 1 35 CYS O O 6.206 -1.635 4.178 1.00 . A A . 35 CYS O 1 1 24 17718 1 1 35 CYS SG S 6.076 1.592 0.445 1.00 . A A . 35 CYS SG 1 1 24 17719 1 1 36 HIS C C 7.561 -4.696 1.656 1.00 . A A . 36 HIS C 1 1 24 17720 1 1 36 HIS CA C 6.778 -4.005 2.761 1.00 . A A . 36 HIS CA 1 1 24 17721 1 1 36 HIS CB C 5.756 -5.029 3.249 1.00 . A A . 36 HIS CB 1 1 24 17722 1 1 36 HIS CD2 C 3.243 -4.633 3.549 1.00 . A A . 36 HIS CD2 1 1 24 17723 1 1 36 HIS CE1 C 3.323 -3.299 5.284 1.00 . A A . 36 HIS CE1 1 1 24 17724 1 1 36 HIS CG C 4.548 -4.447 3.905 1.00 . A A . 36 HIS CG 1 1 24 17725 1 1 36 HIS H H 5.869 -2.791 1.267 1.00 . A A . 36 HIS H 1 1 24 17726 1 1 36 HIS HA H 7.428 -3.755 3.595 1.00 . A A . 36 HIS HA 1 1 24 17727 1 1 36 HIS HB2 H 5.401 -5.608 2.392 1.00 . A A . 36 HIS HB2 1 1 24 17728 1 1 36 HIS HB3 H 6.243 -5.722 3.936 1.00 . A A . 36 HIS HB3 1 1 24 17729 1 1 36 HIS HD1 H 5.427 -3.104 5.328 1.00 . A A . 36 HIS HD1 1 1 24 17730 1 1 36 HIS HD2 H 2.932 -5.213 2.686 1.00 . A A . 36 HIS HD2 1 1 24 17731 1 1 36 HIS HE1 H 3.015 -2.639 6.082 1.00 . A A . 36 HIS HE1 1 1 24 17732 1 1 36 HIS N N 6.139 -2.791 2.249 1.00 . A A . 36 HIS N 1 1 24 17733 1 1 36 HIS ND1 N 4.596 -3.573 4.976 1.00 . A A . 36 HIS ND1 1 1 24 17734 1 1 36 HIS NE2 N 2.475 -3.943 4.465 1.00 . A A . 36 HIS NE2 1 1 24 17735 1 1 36 HIS O O 7.134 -4.657 0.505 1.00 . A A . 36 HIS O 1 1 24 17736 1 1 37 LYS C C 8.481 -7.660 1.096 1.00 . A A . 37 LYS C 1 1 24 17737 1 1 37 LYS CA C 9.271 -6.356 1.113 1.00 . A A . 37 LYS CA 1 1 24 17738 1 1 37 LYS CB C 10.726 -6.556 1.530 1.00 . A A . 37 LYS CB 1 1 24 17739 1 1 37 LYS CD C 12.863 -7.913 1.012 1.00 . A A . 37 LYS CD 1 1 24 17740 1 1 37 LYS CE C 14.096 -7.057 0.675 1.00 . A A . 37 LYS CE 1 1 24 17741 1 1 37 LYS CG C 11.541 -7.322 0.482 1.00 . A A . 37 LYS CG 1 1 24 17742 1 1 37 LYS H H 8.875 -5.474 2.996 1.00 . A A . 37 LYS H 1 1 24 17743 1 1 37 LYS HA H 9.305 -5.933 0.117 1.00 . A A . 37 LYS HA 1 1 24 17744 1 1 37 LYS HB2 H 11.155 -5.584 1.616 1.00 . A A . 37 LYS HB2 1 1 24 17745 1 1 37 LYS HB3 H 10.761 -7.014 2.508 1.00 . A A . 37 LYS HB3 1 1 24 17746 1 1 37 LYS HD2 H 12.797 -8.065 2.092 1.00 . A A . 37 LYS HD2 1 1 24 17747 1 1 37 LYS HD3 H 12.990 -8.899 0.564 1.00 . A A . 37 LYS HD3 1 1 24 17748 1 1 37 LYS HE2 H 13.950 -6.560 -0.286 1.00 . A A . 37 LYS HE2 1 1 24 17749 1 1 37 LYS HE3 H 14.211 -6.299 1.452 1.00 . A A . 37 LYS HE3 1 1 24 17750 1 1 37 LYS HG2 H 10.920 -8.143 0.166 1.00 . A A . 37 LYS HG2 1 1 24 17751 1 1 37 LYS HG3 H 11.694 -6.700 -0.402 1.00 . A A . 37 LYS HG3 1 1 24 17752 1 1 37 LYS HZ1 H 15.071 -8.866 0.466 1.00 . A A . 37 LYS HZ1 1 1 24 17753 1 1 37 LYS HZ2 H 15.858 -7.575 -0.272 1.00 . A A . 37 LYS HZ2 1 1 24 17754 1 1 37 LYS N N 8.602 -5.445 2.026 1.00 . A A . 37 LYS N 1 1 24 17755 1 1 37 LYS NZ N 15.325 -7.872 0.559 1.00 . A A . 37 LYS NZ 1 1 24 17756 1 1 37 LYS O O 8.242 -8.272 2.132 1.00 . A A . 37 LYS O 1 1 24 17757 1 1 38 ARG C C 7.730 -9.917 -1.534 1.00 . A A . 38 ARG C 1 1 24 17758 1 1 38 ARG CA C 7.127 -9.132 -0.367 1.00 . A A . 38 ARG CA 1 1 24 17759 1 1 38 ARG CB C 5.784 -8.501 -0.752 1.00 . A A . 38 ARG CB 1 1 24 17760 1 1 38 ARG CD C 4.127 -9.472 0.909 1.00 . A A . 38 ARG CD 1 1 24 17761 1 1 38 ARG CG C 4.577 -9.422 -0.560 1.00 . A A . 38 ARG CG 1 1 24 17762 1 1 38 ARG CZ C 1.909 -9.656 2.038 1.00 . A A . 38 ARG CZ 1 1 24 17763 1 1 38 ARG H H 8.243 -7.431 -0.884 1.00 . A A . 38 ARG H 1 1 24 17764 1 1 38 ARG HA H 7.014 -9.766 0.514 1.00 . A A . 38 ARG HA 1 1 24 17765 1 1 38 ARG HB2 H 5.634 -7.591 -0.168 1.00 . A A . 38 ARG HB2 1 1 24 17766 1 1 38 ARG HB3 H 5.833 -8.205 -1.800 1.00 . A A . 38 ARG HB3 1 1 24 17767 1 1 38 ARG HD2 H 4.814 -10.098 1.484 1.00 . A A . 38 ARG HD2 1 1 24 17768 1 1 38 ARG HD3 H 4.167 -8.452 1.297 1.00 . A A . 38 ARG HD3 1 1 24 17769 1 1 38 ARG HG2 H 3.770 -8.999 -1.161 1.00 . A A . 38 ARG HG2 1 1 24 17770 1 1 38 ARG HG3 H 4.810 -10.419 -0.935 1.00 . A A . 38 ARG HG3 1 1 24 17771 1 1 38 ARG HH11 H 3.360 -8.838 3.214 1.00 . A A . 38 ARG HH11 1 1 24 17772 1 1 38 ARG HH12 H 1.734 -8.670 3.827 1.00 . A A . 38 ARG HH12 1 1 24 17773 1 1 38 ARG HH21 H 0.261 -10.534 1.196 1.00 . A A . 38 ARG HH21 1 1 24 17774 1 1 38 ARG HH22 H -0.049 -9.634 2.649 1.00 . A A . 38 ARG HH22 1 1 24 17775 1 1 38 ARG N N 8.040 -8.040 -0.100 1.00 . A A . 38 ARG N 1 1 24 17776 1 1 38 ARG NE N 2.749 -9.985 1.043 1.00 . A A . 38 ARG NE 1 1 24 17777 1 1 38 ARG NH1 N 2.371 -8.992 3.102 1.00 . A A . 38 ARG NH1 1 1 24 17778 1 1 38 ARG NH2 N 0.613 -9.978 1.960 1.00 . A A . 38 ARG NH2 1 1 24 17779 1 1 38 ARG O O 7.891 -9.355 -2.615 1.00 . A A . 38 ARG O 1 1 24 17780 1 1 39 GLU C C 10.001 -11.216 -2.937 1.00 . A A . 39 GLU C 1 1 24 17781 1 1 39 GLU CA C 8.808 -11.979 -2.340 1.00 . A A . 39 GLU CA 1 1 24 17782 1 1 39 GLU CB C 7.797 -12.413 -3.414 1.00 . A A . 39 GLU CB 1 1 24 17783 1 1 39 GLU CD C 5.587 -13.540 -3.881 1.00 . A A . 39 GLU CD 1 1 24 17784 1 1 39 GLU CG C 6.621 -13.197 -2.817 1.00 . A A . 39 GLU CG 1 1 24 17785 1 1 39 GLU H H 7.984 -11.590 -0.412 1.00 . A A . 39 GLU H 1 1 24 17786 1 1 39 GLU HA H 9.201 -12.879 -1.864 1.00 . A A . 39 GLU HA 1 1 24 17787 1 1 39 GLU HB2 H 7.411 -11.533 -3.934 1.00 . A A . 39 GLU HB2 1 1 24 17788 1 1 39 GLU HB3 H 8.306 -13.045 -4.145 1.00 . A A . 39 GLU HB3 1 1 24 17789 1 1 39 GLU HG2 H 6.987 -14.122 -2.367 1.00 . A A . 39 GLU HG2 1 1 24 17790 1 1 39 GLU HG3 H 6.122 -12.608 -2.048 1.00 . A A . 39 GLU HG3 1 1 24 17791 1 1 39 GLU N N 8.135 -11.173 -1.319 1.00 . A A . 39 GLU N 1 1 24 17792 1 1 39 GLU O O 10.238 -11.240 -4.142 1.00 . A A . 39 GLU O 1 1 24 17793 1 1 39 GLU OE1 O 5.911 -14.548 -4.733 1.00 . A A . 39 GLU OE1 1 1 24 17794 1 1 39 GLU OE2 O 4.539 -12.903 -3.928 1.00 . A A . 39 GLU OE2 1 1 24 17795 1 1 40 ASN C C 11.542 -8.459 -3.272 1.00 . A A . 40 ASN C 1 1 24 17796 1 1 40 ASN CA C 11.873 -9.660 -2.384 1.00 . A A . 40 ASN CA 1 1 24 17797 1 1 40 ASN CB C 13.006 -10.494 -2.967 1.00 . A A . 40 ASN CB 1 1 24 17798 1 1 40 ASN CG C 14.362 -9.794 -2.837 1.00 . A A . 40 ASN CG 1 1 24 17799 1 1 40 ASN H H 10.528 -10.633 -1.103 1.00 . A A . 40 ASN H 1 1 24 17800 1 1 40 ASN HA H 12.208 -9.258 -1.435 1.00 . A A . 40 ASN HA 1 1 24 17801 1 1 40 ASN HB2 H 13.046 -11.449 -2.453 1.00 . A A . 40 ASN HB2 1 1 24 17802 1 1 40 ASN HB3 H 12.739 -10.677 -4.002 1.00 . A A . 40 ASN HB3 1 1 24 17803 1 1 40 ASN HD21 H 14.908 -10.326 -4.723 1.00 . A A . 40 ASN HD21 1 1 24 17804 1 1 40 ASN HD22 H 16.085 -9.399 -3.820 1.00 . A A . 40 ASN HD22 1 1 24 17805 1 1 40 ASN N N 10.736 -10.512 -2.073 1.00 . A A . 40 ASN N 1 1 24 17806 1 1 40 ASN ND2 N 15.184 -9.849 -3.879 1.00 . A A . 40 ASN ND2 1 1 24 17807 1 1 40 ASN O O 12.437 -7.884 -3.885 1.00 . A A . 40 ASN O 1 1 24 17808 1 1 40 ASN OD1 O 14.680 -9.224 -1.791 1.00 . A A . 40 ASN OD1 1 1 24 17809 1 1 41 HIS C C 9.160 -5.945 -3.049 1.00 . A A . 41 HIS C 1 1 24 17810 1 1 41 HIS CA C 9.825 -6.877 -4.055 1.00 . A A . 41 HIS CA 1 1 24 17811 1 1 41 HIS CB C 8.860 -7.305 -5.154 1.00 . A A . 41 HIS CB 1 1 24 17812 1 1 41 HIS CD2 C 9.403 -9.540 -6.360 1.00 . A A . 41 HIS CD2 1 1 24 17813 1 1 41 HIS CE1 C 10.941 -8.817 -7.724 1.00 . A A . 41 HIS CE1 1 1 24 17814 1 1 41 HIS CG C 9.541 -8.191 -6.171 1.00 . A A . 41 HIS CG 1 1 24 17815 1 1 41 HIS H H 9.546 -8.571 -2.856 1.00 . A A . 41 HIS H 1 1 24 17816 1 1 41 HIS HA H 10.670 -6.387 -4.527 1.00 . A A . 41 HIS HA 1 1 24 17817 1 1 41 HIS HB2 H 8.035 -7.848 -4.690 1.00 . A A . 41 HIS HB2 1 1 24 17818 1 1 41 HIS HB3 H 8.444 -6.420 -5.629 1.00 . A A . 41 HIS HB3 1 1 24 17819 1 1 41 HIS HD1 H 10.833 -6.785 -7.164 1.00 . A A . 41 HIS HD1 1 1 24 17820 1 1 41 HIS HD2 H 8.780 -10.192 -5.766 1.00 . A A . 41 HIS HD2 1 1 24 17821 1 1 41 HIS HE1 H 11.722 -8.797 -8.475 1.00 . A A . 41 HIS HE1 1 1 24 17822 1 1 41 HIS N N 10.272 -8.054 -3.336 1.00 . A A . 41 HIS N 1 1 24 17823 1 1 41 HIS ND1 N 10.498 -7.734 -7.065 1.00 . A A . 41 HIS ND1 1 1 24 17824 1 1 41 HIS NE2 N 10.307 -9.933 -7.328 1.00 . A A . 41 HIS NE2 1 1 24 17825 1 1 41 HIS O O 8.233 -6.364 -2.358 1.00 . A A . 41 HIS O 1 1 24 17826 1 1 42 TRP C C 7.738 -3.240 -2.552 1.00 . A A . 42 TRP C 1 1 24 17827 1 1 42 TRP CA C 9.048 -3.768 -1.987 1.00 . A A . 42 TRP CA 1 1 24 17828 1 1 42 TRP CB C 10.042 -2.665 -1.636 1.00 . A A . 42 TRP CB 1 1 24 17829 1 1 42 TRP CD1 C 12.193 -3.697 -0.805 1.00 . A A . 42 TRP CD1 1 1 24 17830 1 1 42 TRP CD2 C 10.941 -2.867 0.857 1.00 . A A . 42 TRP CD2 1 1 24 17831 1 1 42 TRP CE2 C 12.123 -3.395 1.447 1.00 . A A . 42 TRP CE2 1 1 24 17832 1 1 42 TRP CE3 C 9.936 -2.409 1.736 1.00 . A A . 42 TRP CE3 1 1 24 17833 1 1 42 TRP CG C 11.030 -3.049 -0.585 1.00 . A A . 42 TRP CG 1 1 24 17834 1 1 42 TRP CH2 C 11.292 -2.979 3.683 1.00 . A A . 42 TRP CH2 1 1 24 17835 1 1 42 TRP CZ2 C 12.293 -3.484 2.835 1.00 . A A . 42 TRP CZ2 1 1 24 17836 1 1 42 TRP CZ3 C 10.123 -2.426 3.131 1.00 . A A . 42 TRP CZ3 1 1 24 17837 1 1 42 TRP H H 10.311 -4.347 -3.588 1.00 . A A . 42 TRP H 1 1 24 17838 1 1 42 TRP HA H 8.831 -4.266 -1.057 1.00 . A A . 42 TRP HA 1 1 24 17839 1 1 42 TRP HB2 H 10.567 -2.331 -2.529 1.00 . A A . 42 TRP HB2 1 1 24 17840 1 1 42 TRP HB3 H 9.494 -1.821 -1.231 1.00 . A A . 42 TRP HB3 1 1 24 17841 1 1 42 TRP HD1 H 12.516 -4.048 -1.771 1.00 . A A . 42 TRP HD1 1 1 24 17842 1 1 42 TRP HE1 H 13.733 -4.358 0.515 1.00 . A A . 42 TRP HE1 1 1 24 17843 1 1 42 TRP HE3 H 8.991 -2.103 1.331 1.00 . A A . 42 TRP HE3 1 1 24 17844 1 1 42 TRP HH2 H 11.399 -3.046 4.755 1.00 . A A . 42 TRP HH2 1 1 24 17845 1 1 42 TRP HZ2 H 13.134 -4.033 3.226 1.00 . A A . 42 TRP HZ2 1 1 24 17846 1 1 42 TRP HZ3 H 9.349 -2.048 3.781 1.00 . A A . 42 TRP HZ3 1 1 24 17847 1 1 42 TRP N N 9.638 -4.709 -2.921 1.00 . A A . 42 TRP N 1 1 24 17848 1 1 42 TRP NE1 N 12.858 -3.882 0.389 1.00 . A A . 42 TRP NE1 1 1 24 17849 1 1 42 TRP O O 7.763 -2.480 -3.508 1.00 . A A . 42 TRP O 1 1 24 17850 1 1 43 LYS C C 4.748 -2.227 -1.375 1.00 . A A . 43 LYS C 1 1 24 17851 1 1 43 LYS CA C 5.288 -3.166 -2.436 1.00 . A A . 43 LYS CA 1 1 24 17852 1 1 43 LYS CB C 4.298 -4.321 -2.611 1.00 . A A . 43 LYS CB 1 1 24 17853 1 1 43 LYS CD C 5.679 -5.456 -4.456 1.00 . A A . 43 LYS CD 1 1 24 17854 1 1 43 LYS CE C 4.737 -5.352 -5.675 1.00 . A A . 43 LYS CE 1 1 24 17855 1 1 43 LYS CG C 4.986 -5.593 -3.088 1.00 . A A . 43 LYS CG 1 1 24 17856 1 1 43 LYS H H 6.603 -4.328 -1.253 1.00 . A A . 43 LYS H 1 1 24 17857 1 1 43 LYS HA H 5.365 -2.652 -3.394 1.00 . A A . 43 LYS HA 1 1 24 17858 1 1 43 LYS HB2 H 3.871 -4.549 -1.640 1.00 . A A . 43 LYS HB2 1 1 24 17859 1 1 43 LYS HB3 H 3.479 -4.028 -3.266 1.00 . A A . 43 LYS HB3 1 1 24 17860 1 1 43 LYS HD2 H 6.399 -4.639 -4.468 1.00 . A A . 43 LYS HD2 1 1 24 17861 1 1 43 LYS HD3 H 6.240 -6.381 -4.579 1.00 . A A . 43 LYS HD3 1 1 24 17862 1 1 43 LYS HE2 H 5.332 -5.585 -6.562 1.00 . A A . 43 LYS HE2 1 1 24 17863 1 1 43 LYS HE3 H 3.947 -6.102 -5.600 1.00 . A A . 43 LYS HE3 1 1 24 17864 1 1 43 LYS HG2 H 5.647 -5.883 -2.267 1.00 . A A . 43 LYS HG2 1 1 24 17865 1 1 43 LYS HG3 H 4.283 -6.405 -3.154 1.00 . A A . 43 LYS HG3 1 1 24 17866 1 1 43 LYS HZ1 H 4.473 -3.633 -6.796 1.00 . A A . 43 LYS HZ1 1 1 24 17867 1 1 43 LYS HZ2 H 3.108 -4.101 -5.933 1.00 . A A . 43 LYS HZ2 1 1 24 17868 1 1 43 LYS N N 6.590 -3.651 -2.012 1.00 . A A . 43 LYS N 1 1 24 17869 1 1 43 LYS NZ N 4.134 -4.015 -5.902 1.00 . A A . 43 LYS NZ 1 1 24 17870 1 1 43 LYS O O 4.772 -2.553 -0.189 1.00 . A A . 43 LYS O 1 1 24 17871 1 1 44 CYS C C 1.992 -1.373 -0.818 1.00 . A A . 44 CYS C 1 1 24 17872 1 1 44 CYS CA C 3.167 -0.421 -1.047 1.00 . A A . 44 CYS CA 1 1 24 17873 1 1 44 CYS CB C 2.749 0.820 -1.817 1.00 . A A . 44 CYS CB 1 1 24 17874 1 1 44 CYS H H 4.234 -0.908 -2.801 1.00 . A A . 44 CYS H 1 1 24 17875 1 1 44 CYS HA H 3.560 -0.090 -0.094 1.00 . A A . 44 CYS HA 1 1 24 17876 1 1 44 CYS HB2 H 3.599 1.497 -1.758 1.00 . A A . 44 CYS HB2 1 1 24 17877 1 1 44 CYS HB3 H 2.539 0.568 -2.854 1.00 . A A . 44 CYS HB3 1 1 24 17878 1 1 44 CYS N N 4.186 -1.107 -1.815 1.00 . A A . 44 CYS N 1 1 24 17879 1 1 44 CYS O O 1.621 -2.092 -1.739 1.00 . A A . 44 CYS O 1 1 24 17880 1 1 44 CYS SG S 1.297 1.655 -1.153 1.00 . A A . 44 CYS SG 1 1 24 17881 1 1 45 PHE C C -0.742 -1.134 1.355 1.00 . A A . 45 PHE C 1 1 24 17882 1 1 45 PHE CA C 0.207 -2.131 0.697 1.00 . A A . 45 PHE CA 1 1 24 17883 1 1 45 PHE CB C 0.487 -3.295 1.654 1.00 . A A . 45 PHE CB 1 1 24 17884 1 1 45 PHE CD1 C 1.931 -4.923 0.348 1.00 . A A . 45 PHE CD1 1 1 24 17885 1 1 45 PHE CD2 C -0.288 -5.628 1.043 1.00 . A A . 45 PHE CD2 1 1 24 17886 1 1 45 PHE CE1 C 2.160 -6.200 -0.199 1.00 . A A . 45 PHE CE1 1 1 24 17887 1 1 45 PHE CE2 C -0.078 -6.888 0.458 1.00 . A A . 45 PHE CE2 1 1 24 17888 1 1 45 PHE CG C 0.718 -4.643 0.998 1.00 . A A . 45 PHE CG 1 1 24 17889 1 1 45 PHE CZ C 1.145 -7.170 -0.172 1.00 . A A . 45 PHE CZ 1 1 24 17890 1 1 45 PHE H H 1.830 -0.873 1.157 1.00 . A A . 45 PHE H 1 1 24 17891 1 1 45 PHE HA H -0.256 -2.510 -0.219 1.00 . A A . 45 PHE HA 1 1 24 17892 1 1 45 PHE HB2 H 1.347 -3.023 2.256 1.00 . A A . 45 PHE HB2 1 1 24 17893 1 1 45 PHE HB3 H -0.354 -3.395 2.338 1.00 . A A . 45 PHE HB3 1 1 24 17894 1 1 45 PHE HD1 H 2.692 -4.158 0.289 1.00 . A A . 45 PHE HD1 1 1 24 17895 1 1 45 PHE HD2 H -1.251 -5.395 1.464 1.00 . A A . 45 PHE HD2 1 1 24 17896 1 1 45 PHE HE1 H 3.106 -6.433 -0.664 1.00 . A A . 45 PHE HE1 1 1 24 17897 1 1 45 PHE HE2 H -0.875 -7.618 0.452 1.00 . A A . 45 PHE HE2 1 1 24 17898 1 1 45 PHE HZ H 1.293 -8.120 -0.666 1.00 . A A . 45 PHE HZ 1 1 24 17899 1 1 45 PHE N N 1.443 -1.425 0.396 1.00 . A A . 45 PHE N 1 1 24 17900 1 1 45 PHE O O -0.290 -0.217 2.041 1.00 . A A . 45 PHE O 1 1 24 17901 1 1 46 CYS C C -3.963 -1.347 2.637 1.00 . A A . 46 CYS C 1 1 24 17902 1 1 46 CYS CA C -3.140 -0.526 1.660 1.00 . A A . 46 CYS CA 1 1 24 17903 1 1 46 CYS CB C -4.036 -0.124 0.484 1.00 . A A . 46 CYS CB 1 1 24 17904 1 1 46 CYS H H -2.311 -2.163 0.634 1.00 . A A . 46 CYS H 1 1 24 17905 1 1 46 CYS HA H -2.795 0.346 2.219 1.00 . A A . 46 CYS HA 1 1 24 17906 1 1 46 CYS HB2 H -4.457 -1.026 0.045 1.00 . A A . 46 CYS HB2 1 1 24 17907 1 1 46 CYS HB3 H -4.856 0.464 0.878 1.00 . A A . 46 CYS HB3 1 1 24 17908 1 1 46 CYS N N -2.042 -1.342 1.165 1.00 . A A . 46 CYS N 1 1 24 17909 1 1 46 CYS O O -3.926 -2.573 2.613 1.00 . A A . 46 CYS O 1 1 24 17910 1 1 46 CYS SG S -3.284 0.834 -0.856 1.00 . A A . 46 CYS SG 1 1 24 17911 1 1 47 TYR C C -6.764 -0.664 4.755 1.00 . A A . 47 TYR C 1 1 24 17912 1 1 47 TYR CA C -5.370 -1.285 4.642 1.00 . A A . 47 TYR CA 1 1 24 17913 1 1 47 TYR CB C -4.523 -0.963 5.873 1.00 . A A . 47 TYR CB 1 1 24 17914 1 1 47 TYR CD1 C -2.072 -1.210 5.225 1.00 . A A . 47 TYR CD1 1 1 24 17915 1 1 47 TYR CD2 C -3.117 -2.902 6.628 1.00 . A A . 47 TYR CD2 1 1 24 17916 1 1 47 TYR CE1 C -0.873 -1.939 5.243 1.00 . A A . 47 TYR CE1 1 1 24 17917 1 1 47 TYR CE2 C -1.905 -3.598 6.697 1.00 . A A . 47 TYR CE2 1 1 24 17918 1 1 47 TYR CG C -3.202 -1.698 5.907 1.00 . A A . 47 TYR CG 1 1 24 17919 1 1 47 TYR CZ C -0.791 -3.127 5.991 1.00 . A A . 47 TYR CZ 1 1 24 17920 1 1 47 TYR H H -4.594 0.346 3.536 1.00 . A A . 47 TYR H 1 1 24 17921 1 1 47 TYR HA H -5.434 -2.372 4.531 1.00 . A A . 47 TYR HA 1 1 24 17922 1 1 47 TYR HB2 H -4.336 0.105 5.855 1.00 . A A . 47 TYR HB2 1 1 24 17923 1 1 47 TYR HB3 H -5.076 -1.185 6.785 1.00 . A A . 47 TYR HB3 1 1 24 17924 1 1 47 TYR HD1 H -2.129 -0.284 4.675 1.00 . A A . 47 TYR HD1 1 1 24 17925 1 1 47 TYR HD2 H -3.985 -3.303 7.127 1.00 . A A . 47 TYR HD2 1 1 24 17926 1 1 47 TYR HE1 H -0.024 -1.587 4.677 1.00 . A A . 47 TYR HE1 1 1 24 17927 1 1 47 TYR HE2 H -1.851 -4.509 7.277 1.00 . A A . 47 TYR HE2 1 1 24 17928 1 1 47 TYR HH H 0.326 -4.541 6.682 1.00 . A A . 47 TYR HH 1 1 24 17929 1 1 47 TYR N N -4.685 -0.666 3.523 1.00 . A A . 47 TYR N 1 1 24 17930 1 1 47 TYR O O -6.893 0.466 5.222 1.00 . A A . 47 TYR O 1 1 24 17931 1 1 47 TYR OH O 0.372 -3.830 6.035 1.00 . A A . 47 TYR OH 1 1 24 17932 1 1 48 PHE C C -9.921 -0.662 5.395 1.00 . A A . 48 PHE C 1 1 24 17933 1 1 48 PHE CA C -9.117 -0.834 4.107 1.00 . A A . 48 PHE CA 1 1 24 17934 1 1 48 PHE CB C -9.830 -1.689 3.060 1.00 . A A . 48 PHE CB 1 1 24 17935 1 1 48 PHE CD1 C -9.710 -0.228 1.010 1.00 . A A . 48 PHE CD1 1 1 24 17936 1 1 48 PHE CD2 C -8.606 -2.399 0.945 1.00 . A A . 48 PHE CD2 1 1 24 17937 1 1 48 PHE CE1 C -9.340 0.004 -0.326 1.00 . A A . 48 PHE CE1 1 1 24 17938 1 1 48 PHE CE2 C -8.260 -2.176 -0.400 1.00 . A A . 48 PHE CE2 1 1 24 17939 1 1 48 PHE CG C -9.363 -1.436 1.642 1.00 . A A . 48 PHE CG 1 1 24 17940 1 1 48 PHE CZ C -8.638 -0.983 -1.036 1.00 . A A . 48 PHE CZ 1 1 24 17941 1 1 48 PHE H H -7.656 -2.292 3.903 1.00 . A A . 48 PHE H 1 1 24 17942 1 1 48 PHE HA H -9.010 0.163 3.690 1.00 . A A . 48 PHE HA 1 1 24 17943 1 1 48 PHE HB2 H -9.745 -2.747 3.299 1.00 . A A . 48 PHE HB2 1 1 24 17944 1 1 48 PHE HB3 H -10.881 -1.442 3.102 1.00 . A A . 48 PHE HB3 1 1 24 17945 1 1 48 PHE HD1 H -10.295 0.517 1.531 1.00 . A A . 48 PHE HD1 1 1 24 17946 1 1 48 PHE HD2 H -8.328 -3.326 1.424 1.00 . A A . 48 PHE HD2 1 1 24 17947 1 1 48 PHE HE1 H -9.634 0.923 -0.813 1.00 . A A . 48 PHE HE1 1 1 24 17948 1 1 48 PHE HE2 H -7.744 -2.937 -0.966 1.00 . A A . 48 PHE HE2 1 1 24 17949 1 1 48 PHE HZ H -8.424 -0.846 -2.084 1.00 . A A . 48 PHE HZ 1 1 24 17950 1 1 48 PHE N N -7.799 -1.391 4.325 1.00 . A A . 48 PHE N 1 1 24 17951 1 1 48 PHE O O -9.898 0.410 5.993 1.00 . A A . 48 PHE O 1 1 24 17952 1 1 49 ASN C C -11.206 -1.687 8.203 1.00 . A A . 49 ASN C 1 1 24 17953 1 1 49 ASN CA C -11.754 -1.554 6.785 1.00 . A A . 49 ASN CA 1 1 24 17954 1 1 49 ASN CB C -12.836 -2.615 6.515 1.00 . A A . 49 ASN CB 1 1 24 17955 1 1 49 ASN CG C -13.382 -2.560 5.090 1.00 . A A . 49 ASN CG 1 1 24 17956 1 1 49 ASN H H -10.506 -2.604 5.430 1.00 . A A . 49 ASN H 1 1 24 17957 1 1 49 ASN HA H -12.216 -0.570 6.683 1.00 . A A . 49 ASN HA 1 1 24 17958 1 1 49 ASN HB2 H -12.433 -3.610 6.707 1.00 . A A . 49 ASN HB2 1 1 24 17959 1 1 49 ASN HB3 H -13.668 -2.447 7.199 1.00 . A A . 49 ASN HB3 1 1 24 17960 1 1 49 ASN HD21 H -12.008 -3.916 4.458 1.00 . A A . 49 ASN HD21 1 1 24 17961 1 1 49 ASN HD22 H -13.132 -3.347 3.236 1.00 . A A . 49 ASN HD22 1 1 24 17962 1 1 49 ASN N N -10.659 -1.688 5.826 1.00 . A A . 49 ASN N 1 1 24 17963 1 1 49 ASN ND2 N -12.787 -3.333 4.182 1.00 . A A . 49 ASN ND2 1 1 24 17964 1 1 49 ASN O O -11.732 -2.443 9.020 1.00 . A A . 49 ASN O 1 1 24 17965 1 1 49 ASN OD1 O -14.327 -1.836 4.807 1.00 . A A . 49 ASN OD1 1 1 24 17966 1 1 50 CYS C C -9.908 -1.062 10.949 1.00 . A A . 50 CYS C 1 1 24 17967 1 1 50 CYS CA C -9.224 -1.260 9.604 1.00 . A A . 50 CYS CA 1 1 24 17968 1 1 50 CYS CB C -7.931 -0.478 9.453 1.00 . A A . 50 CYS CB 1 1 24 17969 1 1 50 CYS H H -9.773 -0.390 7.724 1.00 . A A . 50 CYS H 1 1 24 17970 1 1 50 CYS HA H -8.933 -2.290 9.567 1.00 . A A . 50 CYS HA 1 1 24 17971 1 1 50 CYS HB2 H -7.482 -0.761 8.502 1.00 . A A . 50 CYS HB2 1 1 24 17972 1 1 50 CYS HB3 H -8.186 0.571 9.440 1.00 . A A . 50 CYS HB3 1 1 24 17973 1 1 50 CYS N N -10.095 -1.002 8.467 1.00 . A A . 50 CYS N 1 1 24 17974 1 1 50 CYS O O -10.238 -2.093 11.612 1.00 . A A . 50 CYS O 1 1 24 17975 1 1 50 CYS OXT O -10.143 0.104 11.396 1.00 . A A . 50 CYS OXT 1 1 24 17976 1 1 50 CYS SG S -6.659 -0.726 10.708 1.00 . A A . 50 CYS SG 1 1 25 17977 1 1 1 LEU C C -9.863 -5.003 9.470 1.00 . A A . 1 LEU C 1 1 25 17978 1 1 1 LEU CA C -10.747 -5.344 10.675 1.00 . A A . 1 LEU CA 1 1 25 17979 1 1 1 LEU CB C -11.413 -6.729 10.563 1.00 . A A . 1 LEU CB 1 1 25 17980 1 1 1 LEU CD1 C -12.773 -8.475 9.412 1.00 . A A . 1 LEU CD1 1 1 25 17981 1 1 1 LEU CD2 C -13.365 -6.090 9.004 1.00 . A A . 1 LEU CD2 1 1 25 17982 1 1 1 LEU CG C -12.206 -7.056 9.282 1.00 . A A . 1 LEU CG 1 1 25 17983 1 1 1 LEU H1 H -11.225 -3.386 11.108 1.00 . A A . 1 LEU H1 1 1 25 17984 1 1 1 LEU H2 H -12.322 -4.150 10.088 1.00 . A A . 1 LEU H2 1 1 25 17985 1 1 1 LEU H3 H -12.310 -4.511 11.730 1.00 . A A . 1 LEU H3 1 1 25 17986 1 1 1 LEU HA H -10.119 -5.386 11.566 1.00 . A A . 1 LEU HA 1 1 25 17987 1 1 1 LEU HB2 H -10.615 -7.470 10.642 1.00 . A A . 1 LEU HB2 1 1 25 17988 1 1 1 LEU HB3 H -12.068 -6.864 11.424 1.00 . A A . 1 LEU HB3 1 1 25 17989 1 1 1 LEU HD11 H -11.964 -9.186 9.586 1.00 . A A . 1 LEU HD11 1 1 25 17990 1 1 1 LEU HD12 H -13.478 -8.525 10.242 1.00 . A A . 1 LEU HD12 1 1 25 17991 1 1 1 LEU HD13 H -13.287 -8.755 8.492 1.00 . A A . 1 LEU HD13 1 1 25 17992 1 1 1 LEU HD21 H -13.991 -5.986 9.890 1.00 . A A . 1 LEU HD21 1 1 25 17993 1 1 1 LEU HD22 H -12.991 -5.116 8.698 1.00 . A A . 1 LEU HD22 1 1 25 17994 1 1 1 LEU HD23 H -13.974 -6.479 8.187 1.00 . A A . 1 LEU HD23 1 1 25 17995 1 1 1 LEU HG H -11.533 -7.062 8.425 1.00 . A A . 1 LEU HG 1 1 25 17996 1 1 1 LEU N N -11.724 -4.267 10.918 1.00 . A A . 1 LEU N 1 1 25 17997 1 1 1 LEU O O -10.365 -4.829 8.367 1.00 . A A . 1 LEU O 1 1 25 17998 1 1 2 CYS C C -7.418 -5.114 7.521 1.00 . A A . 2 CYS C 1 1 25 17999 1 1 2 CYS CA C -7.656 -4.206 8.726 1.00 . A A . 2 CYS CA 1 1 25 18000 1 1 2 CYS CB C -6.377 -3.714 9.432 1.00 . A A . 2 CYS CB 1 1 25 18001 1 1 2 CYS H H -8.191 -4.984 10.607 1.00 . A A . 2 CYS H 1 1 25 18002 1 1 2 CYS HA H -8.128 -3.310 8.341 1.00 . A A . 2 CYS HA 1 1 25 18003 1 1 2 CYS HB2 H -5.706 -4.563 9.557 1.00 . A A . 2 CYS HB2 1 1 25 18004 1 1 2 CYS HB3 H -5.879 -2.972 8.814 1.00 . A A . 2 CYS HB3 1 1 25 18005 1 1 2 CYS N N -8.561 -4.823 9.686 1.00 . A A . 2 CYS N 1 1 25 18006 1 1 2 CYS O O -6.577 -6.009 7.567 1.00 . A A . 2 CYS O 1 1 25 18007 1 1 2 CYS SG S -6.636 -3.026 11.100 1.00 . A A . 2 CYS SG 1 1 25 18008 1 1 3 ASN C C -6.688 -5.125 4.546 1.00 . A A . 3 ASN C 1 1 25 18009 1 1 3 ASN CA C -7.974 -5.623 5.194 1.00 . A A . 3 ASN CA 1 1 25 18010 1 1 3 ASN CB C -9.141 -5.525 4.187 1.00 . A A . 3 ASN CB 1 1 25 18011 1 1 3 ASN CG C -10.579 -5.719 4.672 1.00 . A A . 3 ASN CG 1 1 25 18012 1 1 3 ASN H H -8.778 -4.069 6.439 1.00 . A A . 3 ASN H 1 1 25 18013 1 1 3 ASN HA H -7.869 -6.681 5.440 1.00 . A A . 3 ASN HA 1 1 25 18014 1 1 3 ASN HB2 H -9.121 -4.542 3.725 1.00 . A A . 3 ASN HB2 1 1 25 18015 1 1 3 ASN HB3 H -8.961 -6.245 3.385 1.00 . A A . 3 ASN HB3 1 1 25 18016 1 1 3 ASN HD21 H -10.150 -5.852 6.678 1.00 . A A . 3 ASN HD21 1 1 25 18017 1 1 3 ASN HD22 H -11.808 -6.103 6.214 1.00 . A A . 3 ASN HD22 1 1 25 18018 1 1 3 ASN N N -8.158 -4.874 6.431 1.00 . A A . 3 ASN N 1 1 25 18019 1 1 3 ASN ND2 N -10.848 -5.951 5.948 1.00 . A A . 3 ASN ND2 1 1 25 18020 1 1 3 ASN O O -6.717 -4.161 3.782 1.00 . A A . 3 ASN O 1 1 25 18021 1 1 3 ASN OD1 O -11.498 -5.639 3.863 1.00 . A A . 3 ASN OD1 1 1 25 18022 1 1 4 GLU C C -4.361 -6.122 2.837 1.00 . A A . 4 GLU C 1 1 25 18023 1 1 4 GLU CA C -4.291 -5.529 4.246 1.00 . A A . 4 GLU CA 1 1 25 18024 1 1 4 GLU CB C -3.204 -6.173 5.119 1.00 . A A . 4 GLU CB 1 1 25 18025 1 1 4 GLU CD C -0.694 -6.576 5.296 1.00 . A A . 4 GLU CD 1 1 25 18026 1 1 4 GLU CG C -1.846 -6.088 4.425 1.00 . A A . 4 GLU CG 1 1 25 18027 1 1 4 GLU H H -5.604 -6.545 5.521 1.00 . A A . 4 GLU H 1 1 25 18028 1 1 4 GLU HA H -4.109 -4.456 4.208 1.00 . A A . 4 GLU HA 1 1 25 18029 1 1 4 GLU HB2 H -3.162 -5.663 6.082 1.00 . A A . 4 GLU HB2 1 1 25 18030 1 1 4 GLU HB3 H -3.444 -7.224 5.287 1.00 . A A . 4 GLU HB3 1 1 25 18031 1 1 4 GLU HG2 H -1.925 -6.739 3.559 1.00 . A A . 4 GLU HG2 1 1 25 18032 1 1 4 GLU HG3 H -1.649 -5.063 4.108 1.00 . A A . 4 GLU HG3 1 1 25 18033 1 1 4 GLU N N -5.569 -5.784 4.860 1.00 . A A . 4 GLU N 1 1 25 18034 1 1 4 GLU O O -4.657 -7.304 2.678 1.00 . A A . 4 GLU O 1 1 25 18035 1 1 4 GLU OE1 O -0.830 -7.817 5.833 1.00 . A A . 4 GLU OE1 1 1 25 18036 1 1 4 GLU OE2 O 0.283 -5.844 5.473 1.00 . A A . 4 GLU OE2 1 1 25 18037 1 1 5 ARG C C -3.034 -5.059 -0.294 1.00 . A A . 5 ARG C 1 1 25 18038 1 1 5 ARG CA C -4.287 -5.586 0.417 1.00 . A A . 5 ARG CA 1 1 25 18039 1 1 5 ARG CB C -5.550 -4.872 -0.084 1.00 . A A . 5 ARG CB 1 1 25 18040 1 1 5 ARG CD C -7.051 -4.364 -2.092 1.00 . A A . 5 ARG CD 1 1 25 18041 1 1 5 ARG CG C -6.060 -5.341 -1.452 1.00 . A A . 5 ARG CG 1 1 25 18042 1 1 5 ARG CZ C -9.082 -3.085 -1.456 1.00 . A A . 5 ARG CZ 1 1 25 18043 1 1 5 ARG H H -3.847 -4.340 2.048 1.00 . A A . 5 ARG H 1 1 25 18044 1 1 5 ARG HA H -4.413 -6.662 0.299 1.00 . A A . 5 ARG HA 1 1 25 18045 1 1 5 ARG HB2 H -6.343 -5.046 0.640 1.00 . A A . 5 ARG HB2 1 1 25 18046 1 1 5 ARG HB3 H -5.310 -3.815 -0.139 1.00 . A A . 5 ARG HB3 1 1 25 18047 1 1 5 ARG HD2 H -6.517 -3.422 -2.236 1.00 . A A . 5 ARG HD2 1 1 25 18048 1 1 5 ARG HD3 H -7.340 -4.759 -3.068 1.00 . A A . 5 ARG HD3 1 1 25 18049 1 1 5 ARG HG2 H -5.222 -5.379 -2.143 1.00 . A A . 5 ARG HG2 1 1 25 18050 1 1 5 ARG HG3 H -6.506 -6.333 -1.354 1.00 . A A . 5 ARG HG3 1 1 25 18051 1 1 5 ARG HH11 H -8.189 -2.461 -3.186 1.00 . A A . 5 ARG HH11 1 1 25 18052 1 1 5 ARG HH12 H -9.392 -1.373 -2.568 1.00 . A A . 5 ARG HH12 1 1 25 18053 1 1 5 ARG HH21 H -10.210 -3.445 0.214 1.00 . A A . 5 ARG HH21 1 1 25 18054 1 1 5 ARG HH22 H -10.607 -1.996 -0.653 1.00 . A A . 5 ARG HH22 1 1 25 18055 1 1 5 ARG N N -4.129 -5.285 1.828 1.00 . A A . 5 ARG N 1 1 25 18056 1 1 5 ARG NE N -8.265 -4.141 -1.290 1.00 . A A . 5 ARG NE 1 1 25 18057 1 1 5 ARG NH1 N -8.897 -2.259 -2.488 1.00 . A A . 5 ARG NH1 1 1 25 18058 1 1 5 ARG NH2 N -10.068 -2.848 -0.586 1.00 . A A . 5 ARG NH2 1 1 25 18059 1 1 5 ARG O O -2.539 -3.990 0.073 1.00 . A A . 5 ARG O 1 1 25 18060 1 1 6 PRO C C -1.445 -4.226 -2.862 1.00 . A A . 6 PRO C 1 1 25 18061 1 1 6 PRO CA C -1.265 -5.447 -1.959 1.00 . A A . 6 PRO CA 1 1 25 18062 1 1 6 PRO CB C -0.858 -6.704 -2.738 1.00 . A A . 6 PRO CB 1 1 25 18063 1 1 6 PRO CD C -2.970 -7.106 -1.693 1.00 . A A . 6 PRO CD 1 1 25 18064 1 1 6 PRO CG C -2.182 -7.436 -2.959 1.00 . A A . 6 PRO CG 1 1 25 18065 1 1 6 PRO HA H -0.485 -5.212 -1.238 1.00 . A A . 6 PRO HA 1 1 25 18066 1 1 6 PRO HB2 H -0.353 -6.483 -3.680 1.00 . A A . 6 PRO HB2 1 1 25 18067 1 1 6 PRO HB3 H -0.215 -7.321 -2.110 1.00 . A A . 6 PRO HB3 1 1 25 18068 1 1 6 PRO HD2 H -4.039 -7.112 -1.903 1.00 . A A . 6 PRO HD2 1 1 25 18069 1 1 6 PRO HD3 H -2.760 -7.820 -0.897 1.00 . A A . 6 PRO HD3 1 1 25 18070 1 1 6 PRO HG2 H -2.689 -7.005 -3.823 1.00 . A A . 6 PRO HG2 1 1 25 18071 1 1 6 PRO HG3 H -2.047 -8.510 -3.097 1.00 . A A . 6 PRO HG3 1 1 25 18072 1 1 6 PRO N N -2.493 -5.804 -1.267 1.00 . A A . 6 PRO N 1 1 25 18073 1 1 6 PRO O O -2.551 -3.729 -3.065 1.00 . A A . 6 PRO O 1 1 25 18074 1 1 7 SER C C -1.137 -2.731 -5.502 1.00 . A A . 7 SER C 1 1 25 18075 1 1 7 SER CA C -0.220 -2.607 -4.284 1.00 . A A . 7 SER CA 1 1 25 18076 1 1 7 SER CB C 1.231 -2.503 -4.752 1.00 . A A . 7 SER CB 1 1 25 18077 1 1 7 SER H H 0.546 -4.227 -3.198 1.00 . A A . 7 SER H 1 1 25 18078 1 1 7 SER HA H -0.455 -1.685 -3.751 1.00 . A A . 7 SER HA 1 1 25 18079 1 1 7 SER HB2 H 1.224 -1.794 -5.573 1.00 . A A . 7 SER HB2 1 1 25 18080 1 1 7 SER HB3 H 1.869 -2.124 -3.955 1.00 . A A . 7 SER HB3 1 1 25 18081 1 1 7 SER HG H 0.985 -4.111 -5.772 1.00 . A A . 7 SER HG 1 1 25 18082 1 1 7 SER N N -0.321 -3.757 -3.407 1.00 . A A . 7 SER N 1 1 25 18083 1 1 7 SER O O -0.807 -3.473 -6.428 1.00 . A A . 7 SER O 1 1 25 18084 1 1 7 SER OG O 1.692 -3.769 -5.201 1.00 . A A . 7 SER OG 1 1 25 18085 1 1 8 GLN C C -2.754 -0.447 -7.343 1.00 . A A . 8 GLN C 1 1 25 18086 1 1 8 GLN CA C -3.096 -1.774 -6.663 1.00 . A A . 8 GLN CA 1 1 25 18087 1 1 8 GLN CB C -4.554 -1.761 -6.197 1.00 . A A . 8 GLN CB 1 1 25 18088 1 1 8 GLN CD C -6.534 -3.147 -5.532 1.00 . A A . 8 GLN CD 1 1 25 18089 1 1 8 GLN CG C -5.016 -3.125 -5.678 1.00 . A A . 8 GLN CG 1 1 25 18090 1 1 8 GLN H H -2.447 -1.439 -4.687 1.00 . A A . 8 GLN H 1 1 25 18091 1 1 8 GLN HA H -2.965 -2.578 -7.389 1.00 . A A . 8 GLN HA 1 1 25 18092 1 1 8 GLN HB2 H -4.706 -1.014 -5.414 1.00 . A A . 8 GLN HB2 1 1 25 18093 1 1 8 GLN HB3 H -5.161 -1.486 -7.053 1.00 . A A . 8 GLN HB3 1 1 25 18094 1 1 8 GLN HE21 H -6.768 -4.169 -7.276 1.00 . A A . 8 GLN HE21 1 1 25 18095 1 1 8 GLN HE22 H -8.242 -3.762 -6.422 1.00 . A A . 8 GLN HE22 1 1 25 18096 1 1 8 GLN HG2 H -4.701 -3.909 -6.367 1.00 . A A . 8 GLN HG2 1 1 25 18097 1 1 8 GLN HG3 H -4.563 -3.316 -4.705 1.00 . A A . 8 GLN HG3 1 1 25 18098 1 1 8 GLN N N -2.229 -1.966 -5.515 1.00 . A A . 8 GLN N 1 1 25 18099 1 1 8 GLN NE2 N -7.235 -3.750 -6.485 1.00 . A A . 8 GLN NE2 1 1 25 18100 1 1 8 GLN O O -2.361 -0.419 -8.506 1.00 . A A . 8 GLN O 1 1 25 18101 1 1 8 GLN OE1 O -7.081 -2.617 -4.569 1.00 . A A . 8 GLN OE1 1 1 25 18102 1 1 9 THR C C -1.298 2.306 -7.361 1.00 . A A . 9 THR C 1 1 25 18103 1 1 9 THR CA C -2.763 2.016 -7.084 1.00 . A A . 9 THR CA 1 1 25 18104 1 1 9 THR CB C -3.237 2.932 -5.948 1.00 . A A . 9 THR CB 1 1 25 18105 1 1 9 THR CG2 C -4.757 3.068 -5.946 1.00 . A A . 9 THR CG2 1 1 25 18106 1 1 9 THR H H -3.136 0.587 -5.621 1.00 . A A . 9 THR H 1 1 25 18107 1 1 9 THR HA H -3.349 2.175 -7.991 1.00 . A A . 9 THR HA 1 1 25 18108 1 1 9 THR HB H -2.789 3.920 -6.073 1.00 . A A . 9 THR HB 1 1 25 18109 1 1 9 THR HG1 H -2.843 3.061 -4.027 1.00 . A A . 9 THR HG1 1 1 25 18110 1 1 9 THR HG21 H -5.105 3.394 -6.926 1.00 . A A . 9 THR HG21 1 1 25 18111 1 1 9 THR HG22 H -5.215 2.112 -5.706 1.00 . A A . 9 THR HG22 1 1 25 18112 1 1 9 THR HG23 H -5.044 3.811 -5.203 1.00 . A A . 9 THR HG23 1 1 25 18113 1 1 9 THR N N -2.884 0.651 -6.597 1.00 . A A . 9 THR N 1 1 25 18114 1 1 9 THR O O -0.914 2.764 -8.434 1.00 . A A . 9 THR O 1 1 25 18115 1 1 9 THR OG1 O -2.827 2.371 -4.707 1.00 . A A . 9 THR OG1 1 1 25 18116 1 1 10 TRP C C 1.453 0.929 -7.333 1.00 . A A . 10 TRP C 1 1 25 18117 1 1 10 TRP CA C 0.961 2.093 -6.469 1.00 . A A . 10 TRP CA 1 1 25 18118 1 1 10 TRP CB C 1.547 2.059 -5.058 1.00 . A A . 10 TRP CB 1 1 25 18119 1 1 10 TRP CD1 C 4.036 1.807 -5.467 1.00 . A A . 10 TRP CD1 1 1 25 18120 1 1 10 TRP CD2 C 3.498 3.752 -4.489 1.00 . A A . 10 TRP CD2 1 1 25 18121 1 1 10 TRP CE2 C 4.895 3.795 -4.751 1.00 . A A . 10 TRP CE2 1 1 25 18122 1 1 10 TRP CE3 C 2.923 4.875 -3.866 1.00 . A A . 10 TRP CE3 1 1 25 18123 1 1 10 TRP CG C 2.973 2.496 -5.000 1.00 . A A . 10 TRP CG 1 1 25 18124 1 1 10 TRP CH2 C 5.071 6.020 -3.823 1.00 . A A . 10 TRP CH2 1 1 25 18125 1 1 10 TRP CZ2 C 5.677 4.909 -4.428 1.00 . A A . 10 TRP CZ2 1 1 25 18126 1 1 10 TRP CZ3 C 3.689 6.007 -3.542 1.00 . A A . 10 TRP CZ3 1 1 25 18127 1 1 10 TRP H H -0.900 1.716 -5.491 1.00 . A A . 10 TRP H 1 1 25 18128 1 1 10 TRP HA H 1.239 3.038 -6.939 1.00 . A A . 10 TRP HA 1 1 25 18129 1 1 10 TRP HB2 H 0.973 2.739 -4.428 1.00 . A A . 10 TRP HB2 1 1 25 18130 1 1 10 TRP HB3 H 1.431 1.055 -4.650 1.00 . A A . 10 TRP HB3 1 1 25 18131 1 1 10 TRP HD1 H 3.983 0.830 -5.935 1.00 . A A . 10 TRP HD1 1 1 25 18132 1 1 10 TRP HE1 H 6.095 2.330 -5.676 1.00 . A A . 10 TRP HE1 1 1 25 18133 1 1 10 TRP HE3 H 1.874 4.861 -3.643 1.00 . A A . 10 TRP HE3 1 1 25 18134 1 1 10 TRP HH2 H 5.682 6.876 -3.596 1.00 . A A . 10 TRP HH2 1 1 25 18135 1 1 10 TRP HZ2 H 6.728 4.925 -4.677 1.00 . A A . 10 TRP HZ2 1 1 25 18136 1 1 10 TRP HZ3 H 3.182 6.854 -3.087 1.00 . A A . 10 TRP HZ3 1 1 25 18137 1 1 10 TRP N N -0.476 2.022 -6.357 1.00 . A A . 10 TRP N 1 1 25 18138 1 1 10 TRP NE1 N 5.171 2.582 -5.348 1.00 . A A . 10 TRP NE1 1 1 25 18139 1 1 10 TRP O O 2.024 -0.033 -6.822 1.00 . A A . 10 TRP O 1 1 25 18140 1 1 11 SER C C 2.968 -0.350 -9.813 1.00 . A A . 11 SER C 1 1 25 18141 1 1 11 SER CA C 1.477 -0.182 -9.492 1.00 . A A . 11 SER CA 1 1 25 18142 1 1 11 SER CB C 0.617 -0.066 -10.759 1.00 . A A . 11 SER CB 1 1 25 18143 1 1 11 SER H H 0.605 1.696 -9.011 1.00 . A A . 11 SER H 1 1 25 18144 1 1 11 SER HA H 1.180 -1.065 -8.925 1.00 . A A . 11 SER HA 1 1 25 18145 1 1 11 SER HB2 H 1.102 0.603 -11.473 1.00 . A A . 11 SER HB2 1 1 25 18146 1 1 11 SER HB3 H 0.507 -1.047 -11.222 1.00 . A A . 11 SER HB3 1 1 25 18147 1 1 11 SER HG H -1.104 -0.019 -9.778 1.00 . A A . 11 SER HG 1 1 25 18148 1 1 11 SER N N 1.214 0.966 -8.641 1.00 . A A . 11 SER N 1 1 25 18149 1 1 11 SER O O 3.380 -0.220 -10.963 1.00 . A A . 11 SER O 1 1 25 18150 1 1 11 SER OG O -0.651 0.493 -10.463 1.00 . A A . 11 SER OG 1 1 25 18151 1 1 12 GLY C C 5.887 -1.239 -7.665 1.00 . A A . 12 GLY C 1 1 25 18152 1 1 12 GLY CA C 5.209 -0.887 -8.986 1.00 . A A . 12 GLY CA 1 1 25 18153 1 1 12 GLY H H 3.392 -0.737 -7.870 1.00 . A A . 12 GLY H 1 1 25 18154 1 1 12 GLY HA2 H 5.366 -1.706 -9.690 1.00 . A A . 12 GLY HA2 1 1 25 18155 1 1 12 GLY HA3 H 5.651 0.021 -9.399 1.00 . A A . 12 GLY HA3 1 1 25 18156 1 1 12 GLY N N 3.784 -0.670 -8.804 1.00 . A A . 12 GLY N 1 1 25 18157 1 1 12 GLY O O 5.315 -1.959 -6.837 1.00 . A A . 12 GLY O 1 1 25 18158 1 1 13 ASN C C 7.777 0.433 -5.457 1.00 . A A . 13 ASN C 1 1 25 18159 1 1 13 ASN CA C 7.889 -0.866 -6.253 1.00 . A A . 13 ASN CA 1 1 25 18160 1 1 13 ASN CB C 9.354 -1.171 -6.589 1.00 . A A . 13 ASN CB 1 1 25 18161 1 1 13 ASN CG C 10.175 -1.522 -5.347 1.00 . A A . 13 ASN CG 1 1 25 18162 1 1 13 ASN H H 7.478 -0.101 -8.177 1.00 . A A . 13 ASN H 1 1 25 18163 1 1 13 ASN HA H 7.494 -1.700 -5.677 1.00 . A A . 13 ASN HA 1 1 25 18164 1 1 13 ASN HB2 H 9.387 -2.026 -7.266 1.00 . A A . 13 ASN HB2 1 1 25 18165 1 1 13 ASN HB3 H 9.805 -0.316 -7.095 1.00 . A A . 13 ASN HB3 1 1 25 18166 1 1 13 ASN HD21 H 10.454 0.457 -4.796 1.00 . A A . 13 ASN HD21 1 1 25 18167 1 1 13 ASN HD22 H 11.255 -0.748 -3.828 1.00 . A A . 13 ASN HD22 1 1 25 18168 1 1 13 ASN N N 7.110 -0.733 -7.477 1.00 . A A . 13 ASN N 1 1 25 18169 1 1 13 ASN ND2 N 10.668 -0.525 -4.615 1.00 . A A . 13 ASN ND2 1 1 25 18170 1 1 13 ASN O O 7.632 1.503 -6.044 1.00 . A A . 13 ASN O 1 1 25 18171 1 1 13 ASN OD1 O 10.375 -2.698 -5.043 1.00 . A A . 13 ASN OD1 1 1 25 18172 1 1 14 CYS C C 8.873 2.485 -3.525 1.00 . A A . 14 CYS C 1 1 25 18173 1 1 14 CYS CA C 7.798 1.451 -3.196 1.00 . A A . 14 CYS CA 1 1 25 18174 1 1 14 CYS CB C 8.037 0.916 -1.784 1.00 . A A . 14 CYS CB 1 1 25 18175 1 1 14 CYS H H 7.960 -0.581 -3.738 1.00 . A A . 14 CYS H 1 1 25 18176 1 1 14 CYS HA H 6.811 1.914 -3.233 1.00 . A A . 14 CYS HA 1 1 25 18177 1 1 14 CYS HB2 H 7.331 0.110 -1.576 1.00 . A A . 14 CYS HB2 1 1 25 18178 1 1 14 CYS HB3 H 9.051 0.524 -1.738 1.00 . A A . 14 CYS HB3 1 1 25 18179 1 1 14 CYS N N 7.829 0.339 -4.131 1.00 . A A . 14 CYS N 1 1 25 18180 1 1 14 CYS O O 9.912 2.140 -4.091 1.00 . A A . 14 CYS O 1 1 25 18181 1 1 14 CYS SG S 7.885 2.148 -0.470 1.00 . A A . 14 CYS SG 1 1 25 18182 1 1 15 GLY C C 9.701 5.448 -1.787 1.00 . A A . 15 GLY C 1 1 25 18183 1 1 15 GLY CA C 9.557 4.846 -3.181 1.00 . A A . 15 GLY CA 1 1 25 18184 1 1 15 GLY H H 7.743 3.883 -2.648 1.00 . A A . 15 GLY H 1 1 25 18185 1 1 15 GLY HA2 H 10.536 4.516 -3.521 1.00 . A A . 15 GLY HA2 1 1 25 18186 1 1 15 GLY HA3 H 9.184 5.604 -3.869 1.00 . A A . 15 GLY HA3 1 1 25 18187 1 1 15 GLY N N 8.617 3.733 -3.130 1.00 . A A . 15 GLY N 1 1 25 18188 1 1 15 GLY O O 10.800 5.556 -1.253 1.00 . A A . 15 GLY O 1 1 25 18189 1 1 16 ASN C C 7.156 5.809 0.791 1.00 . A A . 16 ASN C 1 1 25 18190 1 1 16 ASN CA C 8.467 6.291 0.184 1.00 . A A . 16 ASN CA 1 1 25 18191 1 1 16 ASN CB C 8.579 7.819 0.243 1.00 . A A . 16 ASN CB 1 1 25 18192 1 1 16 ASN CG C 8.797 8.308 1.667 1.00 . A A . 16 ASN CG 1 1 25 18193 1 1 16 ASN H H 7.703 5.692 -1.697 1.00 . A A . 16 ASN H 1 1 25 18194 1 1 16 ASN HA H 9.295 5.866 0.755 1.00 . A A . 16 ASN HA 1 1 25 18195 1 1 16 ASN HB2 H 9.436 8.129 -0.355 1.00 . A A . 16 ASN HB2 1 1 25 18196 1 1 16 ASN HB3 H 7.683 8.298 -0.146 1.00 . A A . 16 ASN HB3 1 1 25 18197 1 1 16 ASN HD21 H 10.291 9.575 1.095 1.00 . A A . 16 ASN HD21 1 1 25 18198 1 1 16 ASN HD22 H 9.855 9.584 2.791 1.00 . A A . 16 ASN HD22 1 1 25 18199 1 1 16 ASN N N 8.566 5.823 -1.193 1.00 . A A . 16 ASN N 1 1 25 18200 1 1 16 ASN ND2 N 9.725 9.236 1.858 1.00 . A A . 16 ASN ND2 1 1 25 18201 1 1 16 ASN O O 6.098 5.989 0.188 1.00 . A A . 16 ASN O 1 1 25 18202 1 1 16 ASN OD1 O 8.109 7.876 2.589 1.00 . A A . 16 ASN OD1 1 1 25 18203 1 1 17 THR C C 5.036 5.729 3.034 1.00 . A A . 17 THR C 1 1 25 18204 1 1 17 THR CA C 6.041 4.640 2.629 1.00 . A A . 17 THR CA 1 1 25 18205 1 1 17 THR CB C 6.463 3.714 3.780 1.00 . A A . 17 THR CB 1 1 25 18206 1 1 17 THR CG2 C 7.015 4.468 4.994 1.00 . A A . 17 THR CG2 1 1 25 18207 1 1 17 THR H H 8.106 5.122 2.443 1.00 . A A . 17 THR H 1 1 25 18208 1 1 17 THR HA H 5.560 4.007 1.892 1.00 . A A . 17 THR HA 1 1 25 18209 1 1 17 THR HB H 7.241 3.053 3.400 1.00 . A A . 17 THR HB 1 1 25 18210 1 1 17 THR HG1 H 4.667 3.463 4.478 1.00 . A A . 17 THR HG1 1 1 25 18211 1 1 17 THR HG21 H 7.854 5.097 4.701 1.00 . A A . 17 THR HG21 1 1 25 18212 1 1 17 THR HG22 H 6.244 5.090 5.448 1.00 . A A . 17 THR HG22 1 1 25 18213 1 1 17 THR HG23 H 7.360 3.745 5.735 1.00 . A A . 17 THR HG23 1 1 25 18214 1 1 17 THR N N 7.214 5.199 1.978 1.00 . A A . 17 THR N 1 1 25 18215 1 1 17 THR O O 3.831 5.476 3.089 1.00 . A A . 17 THR O 1 1 25 18216 1 1 17 THR OG1 O 5.381 2.894 4.171 1.00 . A A . 17 THR OG1 1 1 25 18217 1 1 18 ALA C C 3.758 8.268 2.199 1.00 . A A . 18 ALA C 1 1 25 18218 1 1 18 ALA CA C 4.592 8.083 3.468 1.00 . A A . 18 ALA CA 1 1 25 18219 1 1 18 ALA CB C 5.388 9.348 3.802 1.00 . A A . 18 ALA CB 1 1 25 18220 1 1 18 ALA H H 6.497 7.146 3.218 1.00 . A A . 18 ALA H 1 1 25 18221 1 1 18 ALA HA H 3.925 7.867 4.304 1.00 . A A . 18 ALA HA 1 1 25 18222 1 1 18 ALA HB1 H 5.978 9.184 4.704 1.00 . A A . 18 ALA HB1 1 1 25 18223 1 1 18 ALA HB2 H 6.055 9.609 2.981 1.00 . A A . 18 ALA HB2 1 1 25 18224 1 1 18 ALA HB3 H 4.698 10.174 3.974 1.00 . A A . 18 ALA HB3 1 1 25 18225 1 1 18 ALA N N 5.500 6.959 3.279 1.00 . A A . 18 ALA N 1 1 25 18226 1 1 18 ALA O O 2.531 8.356 2.244 1.00 . A A . 18 ALA O 1 1 25 18227 1 1 19 HIS C C 2.829 7.234 -0.468 1.00 . A A . 19 HIS C 1 1 25 18228 1 1 19 HIS CA C 3.749 8.436 -0.234 1.00 . A A . 19 HIS CA 1 1 25 18229 1 1 19 HIS CB C 4.766 8.641 -1.363 1.00 . A A . 19 HIS CB 1 1 25 18230 1 1 19 HIS CD2 C 2.942 9.617 -2.963 1.00 . A A . 19 HIS CD2 1 1 25 18231 1 1 19 HIS CE1 C 4.175 9.777 -4.761 1.00 . A A . 19 HIS CE1 1 1 25 18232 1 1 19 HIS CG C 4.217 9.217 -2.648 1.00 . A A . 19 HIS CG 1 1 25 18233 1 1 19 HIS H H 5.418 8.104 1.057 1.00 . A A . 19 HIS H 1 1 25 18234 1 1 19 HIS HA H 3.135 9.336 -0.165 1.00 . A A . 19 HIS HA 1 1 25 18235 1 1 19 HIS HB2 H 5.521 9.335 -1.029 1.00 . A A . 19 HIS HB2 1 1 25 18236 1 1 19 HIS HB3 H 5.258 7.690 -1.558 1.00 . A A . 19 HIS HB3 1 1 25 18237 1 1 19 HIS HD1 H 6.005 9.260 -3.855 1.00 . A A . 19 HIS HD1 1 1 25 18238 1 1 19 HIS HD2 H 2.090 9.592 -2.298 1.00 . A A . 19 HIS HD2 1 1 25 18239 1 1 19 HIS HE1 H 4.474 9.935 -5.790 1.00 . A A . 19 HIS HE1 1 1 25 18240 1 1 19 HIS N N 4.426 8.291 1.043 1.00 . A A . 19 HIS N 1 1 25 18241 1 1 19 HIS ND1 N 5.008 9.418 -3.774 1.00 . A A . 19 HIS ND1 1 1 25 18242 1 1 19 HIS NE2 N 2.914 9.892 -4.317 1.00 . A A . 19 HIS NE2 1 1 25 18243 1 1 19 HIS O O 1.702 7.421 -0.917 1.00 . A A . 19 HIS O 1 1 25 18244 1 1 20 CYS C C 1.130 5.061 0.554 1.00 . A A . 20 CYS C 1 1 25 18245 1 1 20 CYS CA C 2.435 4.824 -0.193 1.00 . A A . 20 CYS CA 1 1 25 18246 1 1 20 CYS CB C 3.132 3.616 0.426 1.00 . A A . 20 CYS CB 1 1 25 18247 1 1 20 CYS H H 4.250 5.922 0.151 1.00 . A A . 20 CYS H 1 1 25 18248 1 1 20 CYS HA H 2.195 4.595 -1.231 1.00 . A A . 20 CYS HA 1 1 25 18249 1 1 20 CYS HB2 H 3.972 3.317 -0.194 1.00 . A A . 20 CYS HB2 1 1 25 18250 1 1 20 CYS HB3 H 3.489 3.865 1.414 1.00 . A A . 20 CYS HB3 1 1 25 18251 1 1 20 CYS N N 3.284 6.015 -0.154 1.00 . A A . 20 CYS N 1 1 25 18252 1 1 20 CYS O O 0.050 4.839 0.016 1.00 . A A . 20 CYS O 1 1 25 18253 1 1 20 CYS SG S 2.031 2.214 0.708 1.00 . A A . 20 CYS SG 1 1 25 18254 1 1 21 ASP C C -0.843 6.837 1.948 1.00 . A A . 21 ASP C 1 1 25 18255 1 1 21 ASP CA C 0.068 5.798 2.614 1.00 . A A . 21 ASP CA 1 1 25 18256 1 1 21 ASP CB C 0.529 6.261 3.998 1.00 . A A . 21 ASP CB 1 1 25 18257 1 1 21 ASP CG C -0.657 6.727 4.818 1.00 . A A . 21 ASP CG 1 1 25 18258 1 1 21 ASP H H 2.161 5.720 2.180 1.00 . A A . 21 ASP H 1 1 25 18259 1 1 21 ASP HA H -0.490 4.860 2.732 1.00 . A A . 21 ASP HA 1 1 25 18260 1 1 21 ASP HB2 H 1.028 5.441 4.516 1.00 . A A . 21 ASP HB2 1 1 25 18261 1 1 21 ASP HB3 H 1.229 7.090 3.910 1.00 . A A . 21 ASP HB3 1 1 25 18262 1 1 21 ASP N N 1.235 5.568 1.784 1.00 . A A . 21 ASP N 1 1 25 18263 1 1 21 ASP O O -2.061 6.641 1.904 1.00 . A A . 21 ASP O 1 1 25 18264 1 1 21 ASP OD1 O -1.513 5.905 5.130 1.00 . A A . 21 ASP OD1 1 1 25 18265 1 1 21 ASP OD2 O -0.691 8.053 5.118 1.00 . A A . 21 ASP OD2 1 1 25 18266 1 1 22 LYS C C -1.815 8.077 -0.501 1.00 . A A . 22 LYS C 1 1 25 18267 1 1 22 LYS CA C -1.063 8.841 0.579 1.00 . A A . 22 LYS CA 1 1 25 18268 1 1 22 LYS CB C -0.252 9.968 -0.069 1.00 . A A . 22 LYS CB 1 1 25 18269 1 1 22 LYS CD C 1.064 12.107 0.489 1.00 . A A . 22 LYS CD 1 1 25 18270 1 1 22 LYS CE C 0.083 13.069 -0.201 1.00 . A A . 22 LYS CE 1 1 25 18271 1 1 22 LYS CG C 0.446 10.797 1.000 1.00 . A A . 22 LYS CG 1 1 25 18272 1 1 22 LYS H H 0.738 8.028 1.462 1.00 . A A . 22 LYS H 1 1 25 18273 1 1 22 LYS HA H -1.782 9.314 1.249 1.00 . A A . 22 LYS HA 1 1 25 18274 1 1 22 LYS HB2 H 0.481 9.567 -0.760 1.00 . A A . 22 LYS HB2 1 1 25 18275 1 1 22 LYS HB3 H -0.950 10.589 -0.629 1.00 . A A . 22 LYS HB3 1 1 25 18276 1 1 22 LYS HD2 H 1.525 12.616 1.341 1.00 . A A . 22 LYS HD2 1 1 25 18277 1 1 22 LYS HD3 H 1.864 11.869 -0.216 1.00 . A A . 22 LYS HD3 1 1 25 18278 1 1 22 LYS HE2 H 0.574 14.036 -0.323 1.00 . A A . 22 LYS HE2 1 1 25 18279 1 1 22 LYS HE3 H -0.164 12.692 -1.196 1.00 . A A . 22 LYS HE3 1 1 25 18280 1 1 22 LYS HG2 H -0.243 10.976 1.824 1.00 . A A . 22 LYS HG2 1 1 25 18281 1 1 22 LYS HG3 H 1.243 10.164 1.368 1.00 . A A . 22 LYS HG3 1 1 25 18282 1 1 22 LYS HZ1 H -1.583 14.171 0.324 1.00 . A A . 22 LYS HZ1 1 1 25 18283 1 1 22 LYS HZ2 H -1.836 12.509 0.316 1.00 . A A . 22 LYS HZ2 1 1 25 18284 1 1 22 LYS N N -0.269 7.913 1.385 1.00 . A A . 22 LYS N 1 1 25 18285 1 1 22 LYS NZ N -1.172 13.257 0.559 1.00 . A A . 22 LYS NZ 1 1 25 18286 1 1 22 LYS O O -3.042 8.122 -0.551 1.00 . A A . 22 LYS O 1 1 25 18287 1 1 23 GLN C C -2.460 5.338 -2.046 1.00 . A A . 23 GLN C 1 1 25 18288 1 1 23 GLN CA C -1.734 6.628 -2.462 1.00 . A A . 23 GLN CA 1 1 25 18289 1 1 23 GLN CB C -0.772 6.381 -3.628 1.00 . A A . 23 GLN CB 1 1 25 18290 1 1 23 GLN CD C 0.682 7.640 -5.333 1.00 . A A . 23 GLN CD 1 1 25 18291 1 1 23 GLN CG C 0.039 7.640 -3.953 1.00 . A A . 23 GLN CG 1 1 25 18292 1 1 23 GLN H H -0.098 7.267 -1.189 1.00 . A A . 23 GLN H 1 1 25 18293 1 1 23 GLN HA H -2.464 7.318 -2.857 1.00 . A A . 23 GLN HA 1 1 25 18294 1 1 23 GLN HB2 H -0.113 5.560 -3.363 1.00 . A A . 23 GLN HB2 1 1 25 18295 1 1 23 GLN HB3 H -1.369 6.097 -4.494 1.00 . A A . 23 GLN HB3 1 1 25 18296 1 1 23 GLN HE21 H 0.502 5.623 -5.566 1.00 . A A . 23 GLN HE21 1 1 25 18297 1 1 23 GLN HE22 H 1.228 6.487 -6.900 1.00 . A A . 23 GLN HE22 1 1 25 18298 1 1 23 GLN HG2 H -0.615 8.511 -3.896 1.00 . A A . 23 GLN HG2 1 1 25 18299 1 1 23 GLN HG3 H 0.827 7.750 -3.214 1.00 . A A . 23 GLN HG3 1 1 25 18300 1 1 23 GLN N N -1.099 7.332 -1.348 1.00 . A A . 23 GLN N 1 1 25 18301 1 1 23 GLN NE2 N 0.830 6.484 -5.973 1.00 . A A . 23 GLN NE2 1 1 25 18302 1 1 23 GLN O O -2.570 4.399 -2.833 1.00 . A A . 23 GLN O 1 1 25 18303 1 1 23 GLN OE1 O 1.070 8.704 -5.814 1.00 . A A . 23 GLN OE1 1 1 25 18304 1 1 24 CYS C C -5.103 5.056 0.308 1.00 . A A . 24 CYS C 1 1 25 18305 1 1 24 CYS CA C -3.915 4.320 -0.302 1.00 . A A . 24 CYS CA 1 1 25 18306 1 1 24 CYS CB C -3.177 3.482 0.751 1.00 . A A . 24 CYS CB 1 1 25 18307 1 1 24 CYS H H -2.919 6.171 -0.282 1.00 . A A . 24 CYS H 1 1 25 18308 1 1 24 CYS HA H -4.282 3.662 -1.092 1.00 . A A . 24 CYS HA 1 1 25 18309 1 1 24 CYS HB2 H -2.676 4.139 1.461 1.00 . A A . 24 CYS HB2 1 1 25 18310 1 1 24 CYS HB3 H -3.905 2.886 1.295 1.00 . A A . 24 CYS HB3 1 1 25 18311 1 1 24 CYS N N -3.039 5.342 -0.845 1.00 . A A . 24 CYS N 1 1 25 18312 1 1 24 CYS O O -6.252 4.784 -0.044 1.00 . A A . 24 CYS O 1 1 25 18313 1 1 24 CYS SG S -1.963 2.292 0.142 1.00 . A A . 24 CYS SG 1 1 25 18314 1 1 25 GLN C C -6.502 7.794 0.836 1.00 . A A . 25 GLN C 1 1 25 18315 1 1 25 GLN CA C -5.874 6.818 1.829 1.00 . A A . 25 GLN CA 1 1 25 18316 1 1 25 GLN CB C -5.300 7.620 3.003 1.00 . A A . 25 GLN CB 1 1 25 18317 1 1 25 GLN CD C -4.139 7.617 5.217 1.00 . A A . 25 GLN CD 1 1 25 18318 1 1 25 GLN CG C -4.681 6.747 4.088 1.00 . A A . 25 GLN CG 1 1 25 18319 1 1 25 GLN H H -3.862 6.225 1.434 1.00 . A A . 25 GLN H 1 1 25 18320 1 1 25 GLN HA H -6.646 6.152 2.214 1.00 . A A . 25 GLN HA 1 1 25 18321 1 1 25 GLN HB2 H -4.531 8.309 2.657 1.00 . A A . 25 GLN HB2 1 1 25 18322 1 1 25 GLN HB3 H -6.106 8.200 3.456 1.00 . A A . 25 GLN HB3 1 1 25 18323 1 1 25 GLN HE21 H -5.212 6.597 6.599 1.00 . A A . 25 GLN HE21 1 1 25 18324 1 1 25 GLN HE22 H -4.252 7.936 7.214 1.00 . A A . 25 GLN HE22 1 1 25 18325 1 1 25 GLN HG2 H -5.443 6.067 4.466 1.00 . A A . 25 GLN HG2 1 1 25 18326 1 1 25 GLN HG3 H -3.858 6.167 3.672 1.00 . A A . 25 GLN HG3 1 1 25 18327 1 1 25 GLN N N -4.830 6.039 1.177 1.00 . A A . 25 GLN N 1 1 25 18328 1 1 25 GLN NE2 N -4.570 7.368 6.444 1.00 . A A . 25 GLN NE2 1 1 25 18329 1 1 25 GLN O O -7.721 7.841 0.692 1.00 . A A . 25 GLN O 1 1 25 18330 1 1 25 GLN OE1 O -3.336 8.518 4.990 1.00 . A A . 25 GLN OE1 1 1 25 18331 1 1 26 ASP C C -6.832 9.008 -1.926 1.00 . A A . 26 ASP C 1 1 25 18332 1 1 26 ASP CA C -6.163 9.644 -0.718 1.00 . A A . 26 ASP CA 1 1 25 18333 1 1 26 ASP CB C -5.037 10.590 -1.150 1.00 . A A . 26 ASP CB 1 1 25 18334 1 1 26 ASP CG C -4.531 11.470 -0.007 1.00 . A A . 26 ASP CG 1 1 25 18335 1 1 26 ASP H H -4.670 8.406 0.186 1.00 . A A . 26 ASP H 1 1 25 18336 1 1 26 ASP HA H -6.915 10.228 -0.197 1.00 . A A . 26 ASP HA 1 1 25 18337 1 1 26 ASP HB2 H -4.217 10.026 -1.581 1.00 . A A . 26 ASP HB2 1 1 25 18338 1 1 26 ASP HB3 H -5.431 11.229 -1.935 1.00 . A A . 26 ASP HB3 1 1 25 18339 1 1 26 ASP N N -5.670 8.592 0.157 1.00 . A A . 26 ASP N 1 1 25 18340 1 1 26 ASP O O -7.950 9.362 -2.292 1.00 . A A . 26 ASP O 1 1 25 18341 1 1 26 ASP OD1 O -5.484 12.038 0.779 1.00 . A A . 26 ASP OD1 1 1 25 18342 1 1 26 ASP OD2 O -3.318 11.640 0.150 1.00 . A A . 26 ASP OD2 1 1 25 18343 1 1 27 TRP C C -7.676 6.431 -3.475 1.00 . A A . 27 TRP C 1 1 25 18344 1 1 27 TRP CA C -6.553 7.431 -3.774 1.00 . A A . 27 TRP CA 1 1 25 18345 1 1 27 TRP CB C -5.356 6.731 -4.433 1.00 . A A . 27 TRP CB 1 1 25 18346 1 1 27 TRP CD1 C -3.890 8.797 -4.685 1.00 . A A . 27 TRP CD1 1 1 25 18347 1 1 27 TRP CD2 C -3.568 7.295 -6.310 1.00 . A A . 27 TRP CD2 1 1 25 18348 1 1 27 TRP CE2 C -2.620 8.337 -6.516 1.00 . A A . 27 TRP CE2 1 1 25 18349 1 1 27 TRP CE3 C -3.585 6.243 -7.249 1.00 . A A . 27 TRP CE3 1 1 25 18350 1 1 27 TRP CG C -4.329 7.590 -5.104 1.00 . A A . 27 TRP CG 1 1 25 18351 1 1 27 TRP CH2 C -1.694 7.204 -8.445 1.00 . A A . 27 TRP CH2 1 1 25 18352 1 1 27 TRP CZ2 C -1.700 8.309 -7.577 1.00 . A A . 27 TRP CZ2 1 1 25 18353 1 1 27 TRP CZ3 C -2.644 6.183 -8.290 1.00 . A A . 27 TRP CZ3 1 1 25 18354 1 1 27 TRP H H -5.196 7.883 -2.183 1.00 . A A . 27 TRP H 1 1 25 18355 1 1 27 TRP HA H -6.937 8.182 -4.466 1.00 . A A . 27 TRP HA 1 1 25 18356 1 1 27 TRP HB2 H -4.837 6.108 -3.705 1.00 . A A . 27 TRP HB2 1 1 25 18357 1 1 27 TRP HB3 H -5.759 6.081 -5.210 1.00 . A A . 27 TRP HB3 1 1 25 18358 1 1 27 TRP HD1 H -4.242 9.318 -3.815 1.00 . A A . 27 TRP HD1 1 1 25 18359 1 1 27 TRP HE1 H -2.368 10.105 -5.376 1.00 . A A . 27 TRP HE1 1 1 25 18360 1 1 27 TRP HE3 H -4.336 5.479 -7.167 1.00 . A A . 27 TRP HE3 1 1 25 18361 1 1 27 TRP HH2 H -0.971 7.127 -9.239 1.00 . A A . 27 TRP HH2 1 1 25 18362 1 1 27 TRP HZ2 H -0.991 9.113 -7.713 1.00 . A A . 27 TRP HZ2 1 1 25 18363 1 1 27 TRP HZ3 H -2.653 5.347 -8.977 1.00 . A A . 27 TRP HZ3 1 1 25 18364 1 1 27 TRP N N -6.121 8.069 -2.544 1.00 . A A . 27 TRP N 1 1 25 18365 1 1 27 TRP NE1 N -2.869 9.238 -5.499 1.00 . A A . 27 TRP NE1 1 1 25 18366 1 1 27 TRP O O -8.856 6.733 -3.663 1.00 . A A . 27 TRP O 1 1 25 18367 1 1 28 GLU C C -9.298 4.094 -2.164 1.00 . A A . 28 GLU C 1 1 25 18368 1 1 28 GLU CA C -8.155 4.052 -3.178 1.00 . A A . 28 GLU CA 1 1 25 18369 1 1 28 GLU CB C -7.320 2.764 -3.057 1.00 . A A . 28 GLU CB 1 1 25 18370 1 1 28 GLU CD C -9.283 1.264 -3.751 1.00 . A A . 28 GLU CD 1 1 25 18371 1 1 28 GLU CG C -7.821 1.638 -3.981 1.00 . A A . 28 GLU CG 1 1 25 18372 1 1 28 GLU H H -6.334 5.079 -2.792 1.00 . A A . 28 GLU H 1 1 25 18373 1 1 28 GLU HA H -8.581 4.093 -4.183 1.00 . A A . 28 GLU HA 1 1 25 18374 1 1 28 GLU HB2 H -6.286 2.967 -3.336 1.00 . A A . 28 GLU HB2 1 1 25 18375 1 1 28 GLU HB3 H -7.319 2.433 -2.020 1.00 . A A . 28 GLU HB3 1 1 25 18376 1 1 28 GLU HG2 H -7.704 1.948 -5.020 1.00 . A A . 28 GLU HG2 1 1 25 18377 1 1 28 GLU HG3 H -7.203 0.752 -3.824 1.00 . A A . 28 GLU HG3 1 1 25 18378 1 1 28 GLU N N -7.300 5.222 -3.042 1.00 . A A . 28 GLU N 1 1 25 18379 1 1 28 GLU O O -10.434 3.805 -2.534 1.00 . A A . 28 GLU O 1 1 25 18380 1 1 28 GLU OE1 O -10.198 1.990 -4.446 1.00 . A A . 28 GLU OE1 1 1 25 18381 1 1 28 GLU OE2 O -9.562 0.357 -2.969 1.00 . A A . 28 GLU OE2 1 1 25 18382 1 1 29 LYS C C -9.488 3.999 1.432 1.00 . A A . 29 LYS C 1 1 25 18383 1 1 29 LYS CA C -9.766 4.874 0.206 1.00 . A A . 29 LYS CA 1 1 25 18384 1 1 29 LYS CB C -11.250 5.052 -0.107 1.00 . A A . 29 LYS CB 1 1 25 18385 1 1 29 LYS CD C -11.334 7.583 -0.608 1.00 . A A . 29 LYS CD 1 1 25 18386 1 1 29 LYS CE C -11.605 8.605 -1.721 1.00 . A A . 29 LYS CE 1 1 25 18387 1 1 29 LYS CG C -11.602 6.161 -1.119 1.00 . A A . 29 LYS CG 1 1 25 18388 1 1 29 LYS H H -7.991 4.540 -0.716 1.00 . A A . 29 LYS H 1 1 25 18389 1 1 29 LYS HA H -9.372 5.852 0.466 1.00 . A A . 29 LYS HA 1 1 25 18390 1 1 29 LYS HB2 H -11.695 4.099 -0.400 1.00 . A A . 29 LYS HB2 1 1 25 18391 1 1 29 LYS HB3 H -11.654 5.338 0.849 1.00 . A A . 29 LYS HB3 1 1 25 18392 1 1 29 LYS HD2 H -12.004 7.778 0.232 1.00 . A A . 29 LYS HD2 1 1 25 18393 1 1 29 LYS HD3 H -10.308 7.695 -0.256 1.00 . A A . 29 LYS HD3 1 1 25 18394 1 1 29 LYS HE2 H -12.563 8.385 -2.196 1.00 . A A . 29 LYS HE2 1 1 25 18395 1 1 29 LYS HE3 H -11.667 9.601 -1.274 1.00 . A A . 29 LYS HE3 1 1 25 18396 1 1 29 LYS HG2 H -11.072 6.012 -2.052 1.00 . A A . 29 LYS HG2 1 1 25 18397 1 1 29 LYS HG3 H -12.670 6.066 -1.332 1.00 . A A . 29 LYS HG3 1 1 25 18398 1 1 29 LYS HZ1 H -10.352 7.668 -3.070 1.00 . A A . 29 LYS HZ1 1 1 25 18399 1 1 29 LYS HZ2 H -10.820 9.215 -3.531 1.00 . A A . 29 LYS HZ2 1 1 25 18400 1 1 29 LYS N N -8.965 4.377 -0.900 1.00 . A A . 29 LYS N 1 1 25 18401 1 1 29 LYS NZ N -10.531 8.626 -2.738 1.00 . A A . 29 LYS NZ 1 1 25 18402 1 1 29 LYS O O -10.402 3.451 2.046 1.00 . A A . 29 LYS O 1 1 25 18403 1 1 30 ALA C C -7.758 3.628 4.158 1.00 . A A . 30 ALA C 1 1 25 18404 1 1 30 ALA CA C -7.761 2.922 2.803 1.00 . A A . 30 ALA CA 1 1 25 18405 1 1 30 ALA CB C -6.356 2.445 2.454 1.00 . A A . 30 ALA CB 1 1 25 18406 1 1 30 ALA H H -7.502 4.299 1.211 1.00 . A A . 30 ALA H 1 1 25 18407 1 1 30 ALA HA H -8.419 2.056 2.855 1.00 . A A . 30 ALA HA 1 1 25 18408 1 1 30 ALA HB1 H -6.334 2.076 1.428 1.00 . A A . 30 ALA HB1 1 1 25 18409 1 1 30 ALA HB2 H -5.666 3.279 2.565 1.00 . A A . 30 ALA HB2 1 1 25 18410 1 1 30 ALA HB3 H -6.054 1.645 3.122 1.00 . A A . 30 ALA HB3 1 1 25 18411 1 1 30 ALA N N -8.208 3.816 1.750 1.00 . A A . 30 ALA N 1 1 25 18412 1 1 30 ALA O O -7.686 4.852 4.228 1.00 . A A . 30 ALA O 1 1 25 18413 1 1 31 SER C C -6.000 3.861 6.581 1.00 . A A . 31 SER C 1 1 25 18414 1 1 31 SER CA C -7.430 3.308 6.564 1.00 . A A . 31 SER CA 1 1 25 18415 1 1 31 SER CB C -7.608 2.129 7.514 1.00 . A A . 31 SER CB 1 1 25 18416 1 1 31 SER H H -7.776 1.840 5.172 1.00 . A A . 31 SER H 1 1 25 18417 1 1 31 SER HA H -8.125 4.090 6.859 1.00 . A A . 31 SER HA 1 1 25 18418 1 1 31 SER HB2 H -6.800 1.419 7.380 1.00 . A A . 31 SER HB2 1 1 25 18419 1 1 31 SER HB3 H -7.536 2.508 8.523 1.00 . A A . 31 SER HB3 1 1 25 18420 1 1 31 SER HG H -9.534 2.165 7.214 1.00 . A A . 31 SER HG 1 1 25 18421 1 1 31 SER N N -7.756 2.849 5.241 1.00 . A A . 31 SER N 1 1 25 18422 1 1 31 SER O O -5.771 4.947 7.107 1.00 . A A . 31 SER O 1 1 25 18423 1 1 31 SER OG O -8.859 1.483 7.298 1.00 . A A . 31 SER OG 1 1 25 18424 1 1 32 HIS C C -3.002 2.842 4.652 1.00 . A A . 32 HIS C 1 1 25 18425 1 1 32 HIS CA C -3.692 3.654 5.748 1.00 . A A . 32 HIS CA 1 1 25 18426 1 1 32 HIS CB C -2.847 3.693 7.036 1.00 . A A . 32 HIS CB 1 1 25 18427 1 1 32 HIS CD2 C -2.801 1.244 7.737 1.00 . A A . 32 HIS CD2 1 1 25 18428 1 1 32 HIS CE1 C -0.661 0.884 7.782 1.00 . A A . 32 HIS CE1 1 1 25 18429 1 1 32 HIS CG C -2.181 2.401 7.397 1.00 . A A . 32 HIS CG 1 1 25 18430 1 1 32 HIS H H -5.290 2.271 5.520 1.00 . A A . 32 HIS H 1 1 25 18431 1 1 32 HIS HA H -3.790 4.674 5.389 1.00 . A A . 32 HIS HA 1 1 25 18432 1 1 32 HIS HB2 H -2.046 4.400 6.928 1.00 . A A . 32 HIS HB2 1 1 25 18433 1 1 32 HIS HB3 H -3.456 4.034 7.874 1.00 . A A . 32 HIS HB3 1 1 25 18434 1 1 32 HIS HD1 H -0.082 2.776 7.032 1.00 . A A . 32 HIS HD1 1 1 25 18435 1 1 32 HIS HD2 H -3.862 1.156 7.660 1.00 . A A . 32 HIS HD2 1 1 25 18436 1 1 32 HIS HE1 H 0.286 0.376 7.871 1.00 . A A . 32 HIS HE1 1 1 25 18437 1 1 32 HIS N N -5.038 3.137 5.990 1.00 . A A . 32 HIS N 1 1 25 18438 1 1 32 HIS ND1 N -0.814 2.163 7.391 1.00 . A A . 32 HIS ND1 1 1 25 18439 1 1 32 HIS NE2 N -1.842 0.297 8.027 1.00 . A A . 32 HIS NE2 1 1 25 18440 1 1 32 HIS O O -3.576 1.871 4.151 1.00 . A A . 32 HIS O 1 1 25 18441 1 1 33 GLY C C 0.483 2.174 4.341 1.00 . A A . 33 GLY C 1 1 25 18442 1 1 33 GLY CA C -0.822 2.387 3.581 1.00 . A A . 33 GLY CA 1 1 25 18443 1 1 33 GLY H H -1.393 4.060 4.758 1.00 . A A . 33 GLY H 1 1 25 18444 1 1 33 GLY HA2 H -1.267 1.435 3.397 1.00 . A A . 33 GLY HA2 1 1 25 18445 1 1 33 GLY HA3 H -0.610 2.799 2.604 1.00 . A A . 33 GLY HA3 1 1 25 18446 1 1 33 GLY N N -1.755 3.206 4.343 1.00 . A A . 33 GLY N 1 1 25 18447 1 1 33 GLY O O 0.739 2.866 5.331 1.00 . A A . 33 GLY O 1 1 25 18448 1 1 34 ALA C C 3.369 0.017 3.423 1.00 . A A . 34 ALA C 1 1 25 18449 1 1 34 ALA CA C 2.623 0.929 4.404 1.00 . A A . 34 ALA CA 1 1 25 18450 1 1 34 ALA CB C 2.552 0.300 5.800 1.00 . A A . 34 ALA CB 1 1 25 18451 1 1 34 ALA H H 0.970 0.638 3.110 1.00 . A A . 34 ALA H 1 1 25 18452 1 1 34 ALA HA H 3.147 1.879 4.484 1.00 . A A . 34 ALA HA 1 1 25 18453 1 1 34 ALA HB1 H 1.961 -0.614 5.776 1.00 . A A . 34 ALA HB1 1 1 25 18454 1 1 34 ALA HB2 H 3.557 0.063 6.147 1.00 . A A . 34 ALA HB2 1 1 25 18455 1 1 34 ALA HB3 H 2.100 0.999 6.501 1.00 . A A . 34 ALA HB3 1 1 25 18456 1 1 34 ALA N N 1.286 1.202 3.898 1.00 . A A . 34 ALA N 1 1 25 18457 1 1 34 ALA O O 2.798 -0.958 2.932 1.00 . A A . 34 ALA O 1 1 25 18458 1 1 35 CYS C C 5.976 -1.738 2.913 1.00 . A A . 35 CYS C 1 1 25 18459 1 1 35 CYS CA C 5.451 -0.477 2.219 1.00 . A A . 35 CYS CA 1 1 25 18460 1 1 35 CYS CB C 6.600 0.377 1.686 1.00 . A A . 35 CYS CB 1 1 25 18461 1 1 35 CYS H H 5.083 1.139 3.521 1.00 . A A . 35 CYS H 1 1 25 18462 1 1 35 CYS HA H 4.847 -0.760 1.363 1.00 . A A . 35 CYS HA 1 1 25 18463 1 1 35 CYS HB2 H 7.127 0.859 2.507 1.00 . A A . 35 CYS HB2 1 1 25 18464 1 1 35 CYS HB3 H 7.293 -0.286 1.194 1.00 . A A . 35 CYS HB3 1 1 25 18465 1 1 35 CYS N N 4.637 0.319 3.125 1.00 . A A . 35 CYS N 1 1 25 18466 1 1 35 CYS O O 6.248 -1.714 4.114 1.00 . A A . 35 CYS O 1 1 25 18467 1 1 35 CYS SG S 6.106 1.612 0.464 1.00 . A A . 35 CYS SG 1 1 25 18468 1 1 36 HIS C C 7.516 -4.762 1.568 1.00 . A A . 36 HIS C 1 1 25 18469 1 1 36 HIS CA C 6.731 -4.085 2.678 1.00 . A A . 36 HIS CA 1 1 25 18470 1 1 36 HIS CB C 5.698 -5.121 3.110 1.00 . A A . 36 HIS CB 1 1 25 18471 1 1 36 HIS CD2 C 3.222 -4.941 3.686 1.00 . A A . 36 HIS CD2 1 1 25 18472 1 1 36 HIS CE1 C 3.350 -3.533 5.349 1.00 . A A . 36 HIS CE1 1 1 25 18473 1 1 36 HIS CG C 4.526 -4.595 3.867 1.00 . A A . 36 HIS CG 1 1 25 18474 1 1 36 HIS H H 5.805 -2.846 1.212 1.00 . A A . 36 HIS H 1 1 25 18475 1 1 36 HIS HA H 7.365 -3.878 3.535 1.00 . A A . 36 HIS HA 1 1 25 18476 1 1 36 HIS HB2 H 5.310 -5.616 2.218 1.00 . A A . 36 HIS HB2 1 1 25 18477 1 1 36 HIS HB3 H 6.196 -5.880 3.715 1.00 . A A . 36 HIS HB3 1 1 25 18478 1 1 36 HIS HD1 H 5.410 -3.090 5.119 1.00 . A A . 36 HIS HD1 1 1 25 18479 1 1 36 HIS HD2 H 2.905 -5.603 2.892 1.00 . A A . 36 HIS HD2 1 1 25 18480 1 1 36 HIS HE1 H 3.077 -2.874 6.160 1.00 . A A . 36 HIS HE1 1 1 25 18481 1 1 36 HIS N N 6.110 -2.855 2.184 1.00 . A A . 36 HIS N 1 1 25 18482 1 1 36 HIS ND1 N 4.599 -3.656 4.877 1.00 . A A . 36 HIS ND1 1 1 25 18483 1 1 36 HIS NE2 N 2.492 -4.333 4.687 1.00 . A A . 36 HIS NE2 1 1 25 18484 1 1 36 HIS O O 7.044 -4.781 0.433 1.00 . A A . 36 HIS O 1 1 25 18485 1 1 37 LYS C C 8.669 -7.643 0.926 1.00 . A A . 37 LYS C 1 1 25 18486 1 1 37 LYS CA C 9.333 -6.270 0.963 1.00 . A A . 37 LYS CA 1 1 25 18487 1 1 37 LYS CB C 10.813 -6.360 1.329 1.00 . A A . 37 LYS CB 1 1 25 18488 1 1 37 LYS CD C 13.023 -7.495 0.641 1.00 . A A . 37 LYS CD 1 1 25 18489 1 1 37 LYS CE C 14.160 -6.508 0.327 1.00 . A A . 37 LYS CE 1 1 25 18490 1 1 37 LYS CG C 11.644 -6.972 0.196 1.00 . A A . 37 LYS CG 1 1 25 18491 1 1 37 LYS H H 8.904 -5.449 2.875 1.00 . A A . 37 LYS H 1 1 25 18492 1 1 37 LYS HA H 9.301 -5.827 -0.022 1.00 . A A . 37 LYS HA 1 1 25 18493 1 1 37 LYS HB2 H 11.164 -5.362 1.480 1.00 . A A . 37 LYS HB2 1 1 25 18494 1 1 37 LYS HB3 H 10.927 -6.886 2.265 1.00 . A A . 37 LYS HB3 1 1 25 18495 1 1 37 LYS HD2 H 13.012 -7.726 1.709 1.00 . A A . 37 LYS HD2 1 1 25 18496 1 1 37 LYS HD3 H 13.213 -8.432 0.120 1.00 . A A . 37 LYS HD3 1 1 25 18497 1 1 37 LYS HE2 H 13.940 -5.955 -0.587 1.00 . A A . 37 LYS HE2 1 1 25 18498 1 1 37 LYS HE3 H 14.242 -5.805 1.157 1.00 . A A . 37 LYS HE3 1 1 25 18499 1 1 37 LYS HG2 H 11.081 -7.811 -0.185 1.00 . A A . 37 LYS HG2 1 1 25 18500 1 1 37 LYS HG3 H 11.726 -6.256 -0.623 1.00 . A A . 37 LYS HG3 1 1 25 18501 1 1 37 LYS HZ1 H 15.292 -8.204 -0.009 1.00 . A A . 37 LYS HZ1 1 1 25 18502 1 1 37 LYS HZ2 H 15.910 -6.814 -0.728 1.00 . A A . 37 LYS HZ2 1 1 25 18503 1 1 37 LYS N N 8.619 -5.430 1.908 1.00 . A A . 37 LYS N 1 1 25 18504 1 1 37 LYS NZ N 15.455 -7.194 0.115 1.00 . A A . 37 LYS NZ 1 1 25 18505 1 1 37 LYS O O 8.420 -8.251 1.963 1.00 . A A . 37 LYS O 1 1 25 18506 1 1 38 ARG C C 8.281 -9.909 -1.878 1.00 . A A . 38 ARG C 1 1 25 18507 1 1 38 ARG CA C 7.732 -9.385 -0.551 1.00 . A A . 38 ARG CA 1 1 25 18508 1 1 38 ARG CB C 6.211 -9.164 -0.612 1.00 . A A . 38 ARG CB 1 1 25 18509 1 1 38 ARG CD C 5.421 -11.308 0.446 1.00 . A A . 38 ARG CD 1 1 25 18510 1 1 38 ARG CG C 5.468 -9.783 0.581 1.00 . A A . 38 ARG CG 1 1 25 18511 1 1 38 ARG CZ C 4.523 -13.284 1.653 1.00 . A A . 38 ARG CZ 1 1 25 18512 1 1 38 ARG H H 8.553 -7.503 -1.082 1.00 . A A . 38 ARG H 1 1 25 18513 1 1 38 ARG HA H 7.989 -10.087 0.241 1.00 . A A . 38 ARG HA 1 1 25 18514 1 1 38 ARG HB2 H 6.015 -8.089 -0.622 1.00 . A A . 38 ARG HB2 1 1 25 18515 1 1 38 ARG HB3 H 5.818 -9.579 -1.539 1.00 . A A . 38 ARG HB3 1 1 25 18516 1 1 38 ARG HD2 H 4.934 -11.556 -0.500 1.00 . A A . 38 ARG HD2 1 1 25 18517 1 1 38 ARG HD3 H 6.439 -11.700 0.449 1.00 . A A . 38 ARG HD3 1 1 25 18518 1 1 38 ARG HG2 H 5.958 -9.491 1.512 1.00 . A A . 38 ARG HG2 1 1 25 18519 1 1 38 ARG HG3 H 4.446 -9.397 0.588 1.00 . A A . 38 ARG HG3 1 1 25 18520 1 1 38 ARG HH11 H 5.609 -13.718 -0.031 1.00 . A A . 38 ARG HH11 1 1 25 18521 1 1 38 ARG HH12 H 4.981 -15.103 0.803 1.00 . A A . 38 ARG HH12 1 1 25 18522 1 1 38 ARG HH21 H 3.408 -13.189 3.367 1.00 . A A . 38 ARG HH21 1 1 25 18523 1 1 38 ARG HH22 H 3.703 -14.789 2.778 1.00 . A A . 38 ARG HH22 1 1 25 18524 1 1 38 ARG N N 8.379 -8.112 -0.286 1.00 . A A . 38 ARG N 1 1 25 18525 1 1 38 ARG NE N 4.672 -11.951 1.538 1.00 . A A . 38 ARG NE 1 1 25 18526 1 1 38 ARG NH1 N 5.074 -14.101 0.746 1.00 . A A . 38 ARG NH1 1 1 25 18527 1 1 38 ARG NH2 N 3.826 -13.793 2.674 1.00 . A A . 38 ARG NH2 1 1 25 18528 1 1 38 ARG O O 8.297 -9.170 -2.860 1.00 . A A . 38 ARG O 1 1 25 18529 1 1 39 GLU C C 10.548 -10.734 -3.587 1.00 . A A . 39 GLU C 1 1 25 18530 1 1 39 GLU CA C 9.505 -11.723 -3.043 1.00 . A A . 39 GLU CA 1 1 25 18531 1 1 39 GLU CB C 8.521 -12.201 -4.124 1.00 . A A . 39 GLU CB 1 1 25 18532 1 1 39 GLU CD C 6.538 -12.898 -2.663 1.00 . A A . 39 GLU CD 1 1 25 18533 1 1 39 GLU CG C 7.608 -13.344 -3.652 1.00 . A A . 39 GLU CG 1 1 25 18534 1 1 39 GLU H H 8.719 -11.714 -1.068 1.00 . A A . 39 GLU H 1 1 25 18535 1 1 39 GLU HA H 10.058 -12.595 -2.689 1.00 . A A . 39 GLU HA 1 1 25 18536 1 1 39 GLU HB2 H 7.930 -11.359 -4.487 1.00 . A A . 39 GLU HB2 1 1 25 18537 1 1 39 GLU HB3 H 9.110 -12.584 -4.959 1.00 . A A . 39 GLU HB3 1 1 25 18538 1 1 39 GLU HG2 H 7.105 -13.771 -4.520 1.00 . A A . 39 GLU HG2 1 1 25 18539 1 1 39 GLU HG3 H 8.215 -14.129 -3.198 1.00 . A A . 39 GLU HG3 1 1 25 18540 1 1 39 GLU N N 8.790 -11.147 -1.902 1.00 . A A . 39 GLU N 1 1 25 18541 1 1 39 GLU O O 10.679 -10.537 -4.790 1.00 . A A . 39 GLU O 1 1 25 18542 1 1 39 GLU OE1 O 5.605 -12.029 -3.139 1.00 . A A . 39 GLU OE1 1 1 25 18543 1 1 39 GLU OE2 O 6.571 -13.306 -1.500 1.00 . A A . 39 GLU OE2 1 1 25 18544 1 1 40 ASN C C 11.801 -7.840 -3.646 1.00 . A A . 40 ASN C 1 1 25 18545 1 1 40 ASN CA C 12.298 -9.091 -2.917 1.00 . A A . 40 ASN CA 1 1 25 18546 1 1 40 ASN CB C 13.478 -9.721 -3.642 1.00 . A A . 40 ASN CB 1 1 25 18547 1 1 40 ASN CG C 14.766 -8.911 -3.455 1.00 . A A . 40 ASN CG 1 1 25 18548 1 1 40 ASN H H 11.169 -10.394 -1.721 1.00 . A A . 40 ASN H 1 1 25 18549 1 1 40 ASN HA H 12.628 -8.767 -1.936 1.00 . A A . 40 ASN HA 1 1 25 18550 1 1 40 ASN HB2 H 13.631 -10.730 -3.270 1.00 . A A . 40 ASN HB2 1 1 25 18551 1 1 40 ASN HB3 H 13.192 -9.794 -4.685 1.00 . A A . 40 ASN HB3 1 1 25 18552 1 1 40 ASN HD21 H 15.359 -9.260 -5.370 1.00 . A A . 40 ASN HD21 1 1 25 18553 1 1 40 ASN HD22 H 16.443 -8.291 -4.398 1.00 . A A . 40 ASN HD22 1 1 25 18554 1 1 40 ASN N N 11.275 -10.096 -2.670 1.00 . A A . 40 ASN N 1 1 25 18555 1 1 40 ASN ND2 N 15.589 -8.816 -4.494 1.00 . A A . 40 ASN ND2 1 1 25 18556 1 1 40 ASN O O 12.602 -7.105 -4.213 1.00 . A A . 40 ASN O 1 1 25 18557 1 1 40 ASN OD1 O 15.030 -8.388 -2.370 1.00 . A A . 40 ASN OD1 1 1 25 18558 1 1 41 HIS C C 9.199 -5.624 -3.081 1.00 . A A . 41 HIS C 1 1 25 18559 1 1 41 HIS CA C 9.895 -6.388 -4.198 1.00 . A A . 41 HIS CA 1 1 25 18560 1 1 41 HIS CB C 8.929 -6.807 -5.302 1.00 . A A . 41 HIS CB 1 1 25 18561 1 1 41 HIS CD2 C 9.712 -8.725 -6.875 1.00 . A A . 41 HIS CD2 1 1 25 18562 1 1 41 HIS CE1 C 11.128 -7.595 -8.087 1.00 . A A . 41 HIS CE1 1 1 25 18563 1 1 41 HIS CG C 9.682 -7.421 -6.460 1.00 . A A . 41 HIS CG 1 1 25 18564 1 1 41 HIS H H 9.849 -8.228 -3.189 1.00 . A A . 41 HIS H 1 1 25 18565 1 1 41 HIS HA H 10.658 -5.760 -4.648 1.00 . A A . 41 HIS HA 1 1 25 18566 1 1 41 HIS HB2 H 8.232 -7.533 -4.885 1.00 . A A . 41 HIS HB2 1 1 25 18567 1 1 41 HIS HB3 H 8.350 -5.943 -5.626 1.00 . A A . 41 HIS HB3 1 1 25 18568 1 1 41 HIS HD1 H 10.774 -5.715 -7.196 1.00 . A A . 41 HIS HD1 1 1 25 18569 1 1 41 HIS HD2 H 9.196 -9.546 -6.399 1.00 . A A . 41 HIS HD2 1 1 25 18570 1 1 41 HIS HE1 H 11.894 -7.353 -8.811 1.00 . A A . 41 HIS HE1 1 1 25 18571 1 1 41 HIS N N 10.493 -7.577 -3.623 1.00 . A A . 41 HIS N 1 1 25 18572 1 1 41 HIS ND1 N 10.557 -6.701 -7.261 1.00 . A A . 41 HIS ND1 1 1 25 18573 1 1 41 HIS NE2 N 10.639 -8.830 -7.893 1.00 . A A . 41 HIS NE2 1 1 25 18574 1 1 41 HIS O O 8.362 -6.195 -2.385 1.00 . A A . 41 HIS O 1 1 25 18575 1 1 42 TRP C C 7.544 -3.088 -2.458 1.00 . A A . 42 TRP C 1 1 25 18576 1 1 42 TRP CA C 8.895 -3.516 -1.908 1.00 . A A . 42 TRP CA 1 1 25 18577 1 1 42 TRP CB C 9.782 -2.343 -1.504 1.00 . A A . 42 TRP CB 1 1 25 18578 1 1 42 TRP CD1 C 12.043 -3.225 -0.802 1.00 . A A . 42 TRP CD1 1 1 25 18579 1 1 42 TRP CD2 C 10.767 -2.628 0.941 1.00 . A A . 42 TRP CD2 1 1 25 18580 1 1 42 TRP CE2 C 11.997 -3.109 1.470 1.00 . A A . 42 TRP CE2 1 1 25 18581 1 1 42 TRP CE3 C 9.752 -2.314 1.866 1.00 . A A . 42 TRP CE3 1 1 25 18582 1 1 42 TRP CG C 10.834 -2.703 -0.512 1.00 . A A . 42 TRP CG 1 1 25 18583 1 1 42 TRP CH2 C 11.177 -2.937 3.741 1.00 . A A . 42 TRP CH2 1 1 25 18584 1 1 42 TRP CZ2 C 12.198 -3.299 2.843 1.00 . A A . 42 TRP CZ2 1 1 25 18585 1 1 42 TRP CZ3 C 9.968 -2.420 3.251 1.00 . A A . 42 TRP CZ3 1 1 25 18586 1 1 42 TRP H H 10.173 -3.897 -3.554 1.00 . A A . 42 TRP H 1 1 25 18587 1 1 42 TRP HA H 8.730 -4.073 -1.002 1.00 . A A . 42 TRP HA 1 1 25 18588 1 1 42 TRP HB2 H 10.231 -1.882 -2.380 1.00 . A A . 42 TRP HB2 1 1 25 18589 1 1 42 TRP HB3 H 9.158 -1.605 -1.012 1.00 . A A . 42 TRP HB3 1 1 25 18590 1 1 42 TRP HD1 H 12.366 -3.477 -1.797 1.00 . A A . 42 TRP HD1 1 1 25 18591 1 1 42 TRP HE1 H 13.657 -3.866 0.439 1.00 . A A . 42 TRP HE1 1 1 25 18592 1 1 42 TRP HE3 H 8.780 -2.049 1.497 1.00 . A A . 42 TRP HE3 1 1 25 18593 1 1 42 TRP HH2 H 11.299 -3.094 4.803 1.00 . A A . 42 TRP HH2 1 1 25 18594 1 1 42 TRP HZ2 H 13.080 -3.821 3.174 1.00 . A A . 42 TRP HZ2 1 1 25 18595 1 1 42 TRP HZ3 H 9.182 -2.139 3.938 1.00 . A A . 42 TRP HZ3 1 1 25 18596 1 1 42 TRP N N 9.561 -4.355 -2.884 1.00 . A A . 42 TRP N 1 1 25 18597 1 1 42 TRP NE1 N 12.745 -3.450 0.363 1.00 . A A . 42 TRP NE1 1 1 25 18598 1 1 42 TRP O O 7.494 -2.234 -3.331 1.00 . A A . 42 TRP O 1 1 25 18599 1 1 43 LYS C C 4.555 -2.339 -1.400 1.00 . A A . 43 LYS C 1 1 25 18600 1 1 43 LYS CA C 5.114 -3.311 -2.423 1.00 . A A . 43 LYS CA 1 1 25 18601 1 1 43 LYS CB C 4.196 -4.530 -2.545 1.00 . A A . 43 LYS CB 1 1 25 18602 1 1 43 LYS CD C 5.716 -5.622 -4.315 1.00 . A A . 43 LYS CD 1 1 25 18603 1 1 43 LYS CE C 4.833 -5.535 -5.579 1.00 . A A . 43 LYS CE 1 1 25 18604 1 1 43 LYS CG C 4.965 -5.770 -2.978 1.00 . A A . 43 LYS CG 1 1 25 18605 1 1 43 LYS H H 6.531 -4.405 -1.285 1.00 . A A . 43 LYS H 1 1 25 18606 1 1 43 LYS HA H 5.156 -2.850 -3.408 1.00 . A A . 43 LYS HA 1 1 25 18607 1 1 43 LYS HB2 H 3.778 -4.741 -1.566 1.00 . A A . 43 LYS HB2 1 1 25 18608 1 1 43 LYS HB3 H 3.366 -4.318 -3.214 1.00 . A A . 43 LYS HB3 1 1 25 18609 1 1 43 LYS HD2 H 6.428 -4.798 -4.300 1.00 . A A . 43 LYS HD2 1 1 25 18610 1 1 43 LYS HD3 H 6.289 -6.543 -4.403 1.00 . A A . 43 LYS HD3 1 1 25 18611 1 1 43 LYS HE2 H 5.473 -5.753 -6.438 1.00 . A A . 43 LYS HE2 1 1 25 18612 1 1 43 LYS HE3 H 4.056 -6.301 -5.541 1.00 . A A . 43 LYS HE3 1 1 25 18613 1 1 43 LYS HG2 H 5.600 -6.020 -2.118 1.00 . A A . 43 LYS HG2 1 1 25 18614 1 1 43 LYS HG3 H 4.311 -6.617 -3.090 1.00 . A A . 43 LYS HG3 1 1 25 18615 1 1 43 LYS HZ1 H 4.532 -3.849 -6.738 1.00 . A A . 43 LYS HZ1 1 1 25 18616 1 1 43 LYS HZ2 H 3.185 -4.315 -5.846 1.00 . A A . 43 LYS HZ2 1 1 25 18617 1 1 43 LYS N N 6.449 -3.689 -2.000 1.00 . A A . 43 LYS N 1 1 25 18618 1 1 43 LYS NZ N 4.210 -4.214 -5.830 1.00 . A A . 43 LYS NZ 1 1 25 18619 1 1 43 LYS O O 4.630 -2.591 -0.199 1.00 . A A . 43 LYS O 1 1 25 18620 1 1 44 CYS C C 1.797 -1.203 -0.824 1.00 . A A . 44 CYS C 1 1 25 18621 1 1 44 CYS CA C 3.082 -0.426 -1.090 1.00 . A A . 44 CYS CA 1 1 25 18622 1 1 44 CYS CB C 2.801 0.860 -1.849 1.00 . A A . 44 CYS CB 1 1 25 18623 1 1 44 CYS H H 3.960 -1.116 -2.884 1.00 . A A . 44 CYS H 1 1 25 18624 1 1 44 CYS HA H 3.544 -0.152 -0.147 1.00 . A A . 44 CYS HA 1 1 25 18625 1 1 44 CYS HB2 H 3.695 1.479 -1.775 1.00 . A A . 44 CYS HB2 1 1 25 18626 1 1 44 CYS HB3 H 2.606 0.623 -2.888 1.00 . A A . 44 CYS HB3 1 1 25 18627 1 1 44 CYS N N 3.965 -1.254 -1.886 1.00 . A A . 44 CYS N 1 1 25 18628 1 1 44 CYS O O 1.028 -1.428 -1.752 1.00 . A A . 44 CYS O 1 1 25 18629 1 1 44 CYS SG S 1.389 1.776 -1.208 1.00 . A A . 44 CYS SG 1 1 25 18630 1 1 45 PHE C C -0.593 -1.231 1.363 1.00 . A A . 45 PHE C 1 1 25 18631 1 1 45 PHE CA C 0.340 -2.298 0.801 1.00 . A A . 45 PHE CA 1 1 25 18632 1 1 45 PHE CB C 0.608 -3.394 1.839 1.00 . A A . 45 PHE CB 1 1 25 18633 1 1 45 PHE CD1 C 2.095 -5.025 0.590 1.00 . A A . 45 PHE CD1 1 1 25 18634 1 1 45 PHE CD2 C -0.076 -5.784 1.375 1.00 . A A . 45 PHE CD2 1 1 25 18635 1 1 45 PHE CE1 C 2.395 -6.332 0.167 1.00 . A A . 45 PHE CE1 1 1 25 18636 1 1 45 PHE CE2 C 0.207 -7.083 0.920 1.00 . A A . 45 PHE CE2 1 1 25 18637 1 1 45 PHE CG C 0.882 -4.763 1.250 1.00 . A A . 45 PHE CG 1 1 25 18638 1 1 45 PHE CZ C 1.450 -7.360 0.326 1.00 . A A . 45 PHE CZ 1 1 25 18639 1 1 45 PHE H H 2.224 -1.395 1.160 1.00 . A A . 45 PHE H 1 1 25 18640 1 1 45 PHE HA H -0.138 -2.759 -0.065 1.00 . A A . 45 PHE HA 1 1 25 18641 1 1 45 PHE HB2 H 1.439 -3.077 2.462 1.00 . A A . 45 PHE HB2 1 1 25 18642 1 1 45 PHE HB3 H -0.248 -3.494 2.501 1.00 . A A . 45 PHE HB3 1 1 25 18643 1 1 45 PHE HD1 H 2.820 -4.234 0.476 1.00 . A A . 45 PHE HD1 1 1 25 18644 1 1 45 PHE HD2 H -1.049 -5.566 1.788 1.00 . A A . 45 PHE HD2 1 1 25 18645 1 1 45 PHE HE1 H 3.357 -6.561 -0.269 1.00 . A A . 45 PHE HE1 1 1 25 18646 1 1 45 PHE HE2 H -0.534 -7.865 1.018 1.00 . A A . 45 PHE HE2 1 1 25 18647 1 1 45 PHE HZ H 1.673 -8.360 -0.022 1.00 . A A . 45 PHE HZ 1 1 25 18648 1 1 45 PHE N N 1.586 -1.654 0.413 1.00 . A A . 45 PHE N 1 1 25 18649 1 1 45 PHE O O -0.141 -0.276 1.993 1.00 . A A . 45 PHE O 1 1 25 18650 1 1 46 CYS C C -3.798 -1.404 2.593 1.00 . A A . 46 CYS C 1 1 25 18651 1 1 46 CYS CA C -2.968 -0.575 1.631 1.00 . A A . 46 CYS CA 1 1 25 18652 1 1 46 CYS CB C -3.842 -0.138 0.454 1.00 . A A . 46 CYS CB 1 1 25 18653 1 1 46 CYS H H -2.178 -2.281 0.690 1.00 . A A . 46 CYS H 1 1 25 18654 1 1 46 CYS HA H -2.618 0.282 2.208 1.00 . A A . 46 CYS HA 1 1 25 18655 1 1 46 CYS HB2 H -4.221 -1.035 -0.027 1.00 . A A . 46 CYS HB2 1 1 25 18656 1 1 46 CYS HB3 H -4.686 0.410 0.856 1.00 . A A . 46 CYS HB3 1 1 25 18657 1 1 46 CYS N N -1.891 -1.421 1.146 1.00 . A A . 46 CYS N 1 1 25 18658 1 1 46 CYS O O -3.760 -2.630 2.556 1.00 . A A . 46 CYS O 1 1 25 18659 1 1 46 CYS SG S -3.108 0.877 -0.856 1.00 . A A . 46 CYS SG 1 1 25 18660 1 1 47 TYR C C -6.529 -0.728 4.773 1.00 . A A . 47 TYR C 1 1 25 18661 1 1 47 TYR CA C -5.150 -1.339 4.637 1.00 . A A . 47 TYR CA 1 1 25 18662 1 1 47 TYR CB C -4.323 -0.989 5.868 1.00 . A A . 47 TYR CB 1 1 25 18663 1 1 47 TYR CD1 C -1.876 -1.243 5.239 1.00 . A A . 47 TYR CD1 1 1 25 18664 1 1 47 TYR CD2 C -2.885 -2.820 6.799 1.00 . A A . 47 TYR CD2 1 1 25 18665 1 1 47 TYR CE1 C -0.638 -1.880 5.400 1.00 . A A . 47 TYR CE1 1 1 25 18666 1 1 47 TYR CE2 C -1.636 -3.419 7.002 1.00 . A A . 47 TYR CE2 1 1 25 18667 1 1 47 TYR CG C -2.996 -1.700 5.958 1.00 . A A . 47 TYR CG 1 1 25 18668 1 1 47 TYR CZ C -0.514 -2.937 6.313 1.00 . A A . 47 TYR CZ 1 1 25 18669 1 1 47 TYR H H -4.426 0.284 3.494 1.00 . A A . 47 TYR H 1 1 25 18670 1 1 47 TYR HA H -5.220 -2.419 4.552 1.00 . A A . 47 TYR HA 1 1 25 18671 1 1 47 TYR HB2 H -4.140 0.080 5.825 1.00 . A A . 47 TYR HB2 1 1 25 18672 1 1 47 TYR HB3 H -4.895 -1.198 6.771 1.00 . A A . 47 TYR HB3 1 1 25 18673 1 1 47 TYR HD1 H -1.960 -0.396 4.578 1.00 . A A . 47 TYR HD1 1 1 25 18674 1 1 47 TYR HD2 H -3.753 -3.208 7.314 1.00 . A A . 47 TYR HD2 1 1 25 18675 1 1 47 TYR HE1 H 0.203 -1.566 4.799 1.00 . A A . 47 TYR HE1 1 1 25 18676 1 1 47 TYR HE2 H -1.546 -4.249 7.688 1.00 . A A . 47 TYR HE2 1 1 25 18677 1 1 47 TYR HH H 0.585 -4.426 6.814 1.00 . A A . 47 TYR HH 1 1 25 18678 1 1 47 TYR N N -4.502 -0.729 3.494 1.00 . A A . 47 TYR N 1 1 25 18679 1 1 47 TYR O O -6.616 0.418 5.207 1.00 . A A . 47 TYR O 1 1 25 18680 1 1 47 TYR OH O 0.698 -3.505 6.541 1.00 . A A . 47 TYR OH 1 1 25 18681 1 1 48 PHE C C -9.660 -1.375 5.690 1.00 . A A . 48 PHE C 1 1 25 18682 1 1 48 PHE CA C -8.923 -0.879 4.445 1.00 . A A . 48 PHE CA 1 1 25 18683 1 1 48 PHE CB C -9.609 -1.392 3.177 1.00 . A A . 48 PHE CB 1 1 25 18684 1 1 48 PHE CD1 C -7.834 -1.665 1.385 1.00 . A A . 48 PHE CD1 1 1 25 18685 1 1 48 PHE CD2 C -9.424 0.169 1.189 1.00 . A A . 48 PHE CD2 1 1 25 18686 1 1 48 PHE CE1 C -7.174 -1.214 0.231 1.00 . A A . 48 PHE CE1 1 1 25 18687 1 1 48 PHE CE2 C -8.765 0.614 0.033 1.00 . A A . 48 PHE CE2 1 1 25 18688 1 1 48 PHE CG C -8.944 -0.957 1.885 1.00 . A A . 48 PHE CG 1 1 25 18689 1 1 48 PHE CZ C -7.632 -0.071 -0.439 1.00 . A A . 48 PHE CZ 1 1 25 18690 1 1 48 PHE H H -7.515 -2.375 4.032 1.00 . A A . 48 PHE H 1 1 25 18691 1 1 48 PHE HA H -8.921 0.210 4.431 1.00 . A A . 48 PHE HA 1 1 25 18692 1 1 48 PHE HB2 H -9.657 -2.477 3.200 1.00 . A A . 48 PHE HB2 1 1 25 18693 1 1 48 PHE HB3 H -10.626 -1.046 3.191 1.00 . A A . 48 PHE HB3 1 1 25 18694 1 1 48 PHE HD1 H -7.465 -2.549 1.885 1.00 . A A . 48 PHE HD1 1 1 25 18695 1 1 48 PHE HD2 H -10.278 0.723 1.558 1.00 . A A . 48 PHE HD2 1 1 25 18696 1 1 48 PHE HE1 H -6.330 -1.760 -0.154 1.00 . A A . 48 PHE HE1 1 1 25 18697 1 1 48 PHE HE2 H -9.136 1.484 -0.490 1.00 . A A . 48 PHE HE2 1 1 25 18698 1 1 48 PHE HZ H -7.120 0.262 -1.329 1.00 . A A . 48 PHE HZ 1 1 25 18699 1 1 48 PHE N N -7.593 -1.439 4.404 1.00 . A A . 48 PHE N 1 1 25 18700 1 1 48 PHE O O -9.159 -2.244 6.403 1.00 . A A . 48 PHE O 1 1 25 18701 1 1 49 ASN C C -11.308 -1.613 8.247 1.00 . A A . 49 ASN C 1 1 25 18702 1 1 49 ASN CA C -11.886 -1.395 6.839 1.00 . A A . 49 ASN CA 1 1 25 18703 1 1 49 ASN CB C -12.586 -2.658 6.312 1.00 . A A . 49 ASN CB 1 1 25 18704 1 1 49 ASN CG C -13.243 -2.422 4.954 1.00 . A A . 49 ASN CG 1 1 25 18705 1 1 49 ASN H H -11.245 -0.236 5.201 1.00 . A A . 49 ASN H 1 1 25 18706 1 1 49 ASN HA H -12.646 -0.619 6.932 1.00 . A A . 49 ASN HA 1 1 25 18707 1 1 49 ASN HB2 H -11.851 -3.459 6.236 1.00 . A A . 49 ASN HB2 1 1 25 18708 1 1 49 ASN HB3 H -13.366 -2.967 7.007 1.00 . A A . 49 ASN HB3 1 1 25 18709 1 1 49 ASN HD21 H -12.628 -4.232 4.201 1.00 . A A . 49 ASN HD21 1 1 25 18710 1 1 49 ASN HD22 H -13.567 -3.218 3.131 1.00 . A A . 49 ASN HD22 1 1 25 18711 1 1 49 ASN N N -10.912 -0.938 5.846 1.00 . A A . 49 ASN N 1 1 25 18712 1 1 49 ASN ND2 N -13.128 -3.366 4.025 1.00 . A A . 49 ASN ND2 1 1 25 18713 1 1 49 ASN O O -11.804 -2.461 8.986 1.00 . A A . 49 ASN O 1 1 25 18714 1 1 49 ASN OD1 O -13.827 -1.369 4.720 1.00 . A A . 49 ASN OD1 1 1 25 18715 1 1 50 CYS C C -10.092 -0.923 11.118 1.00 . A A . 50 CYS C 1 1 25 18716 1 1 50 CYS CA C -9.436 -1.246 9.782 1.00 . A A . 50 CYS CA 1 1 25 18717 1 1 50 CYS CB C -8.045 -0.652 9.613 1.00 . A A . 50 CYS CB 1 1 25 18718 1 1 50 CYS H H -9.906 -0.150 8.019 1.00 . A A . 50 CYS H 1 1 25 18719 1 1 50 CYS HA H -9.298 -2.311 9.779 1.00 . A A . 50 CYS HA 1 1 25 18720 1 1 50 CYS HB2 H -7.639 -1.016 8.672 1.00 . A A . 50 CYS HB2 1 1 25 18721 1 1 50 CYS HB3 H -8.174 0.418 9.561 1.00 . A A . 50 CYS HB3 1 1 25 18722 1 1 50 CYS N N -10.265 -0.871 8.640 1.00 . A A . 50 CYS N 1 1 25 18723 1 1 50 CYS O O -10.609 -1.874 11.782 1.00 . A A . 50 CYS O 1 1 25 18724 1 1 50 CYS OXT O -10.121 0.269 11.556 1.00 . A A . 50 CYS OXT 1 1 25 18725 1 1 50 CYS SG S -6.783 -0.959 10.870 1.00 . A A . 50 CYS SG 1 1 stop_ save_
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