NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | item_count |
381251 | 1iy6 | 5470 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 614 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1iy6 # This FRED archive file contains, for PDB entry <1iy6>: # # - 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_1iy6 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1iy6 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5841.57 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 $OMSVP3 A . 1 1 stop_ save_ save_OMSVP3 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name OMSVP3 _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code AVSVDCSEYPKCACTMEYRPLCGSDNKTYGNKCNFCCAVVESNGTLTLSHFGKC _Entity.Number_of_monomers 54 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ALA . 1 1 2 VAL . 1 1 3 SER . 1 1 4 VAL . 1 1 5 ASP . 1 1 6 CYS . 1 1 7 SER . 1 1 8 GLU . 1 1 9 TYR . 1 1 10 PRO . 1 1 11 LYS . 1 1 12 CYS . 1 1 13 ALA . 1 1 14 CYS . 1 1 15 THR . 1 1 16 MET . 1 1 17 GLU . 1 1 18 TYR . 1 1 19 ARG . 1 1 20 PRO . 1 1 21 LEU . 1 1 22 CYS . 1 1 23 GLY . 1 1 24 SER . 1 1 25 ASP . 1 1 26 ASN . 1 1 27 LYS . 1 1 28 THR . 1 1 29 TYR . 1 1 30 GLY . 1 1 31 ASN . 1 1 32 LYS . 1 1 33 CYS . 1 1 34 ASN . 1 1 35 PHE . 1 1 36 CYS . 1 1 37 CYS . 1 1 38 ALA . 1 1 39 VAL . 1 1 40 VAL . 1 1 41 GLU . 1 1 42 SER . 1 1 43 ASN . 1 1 44 GLY . 1 1 45 THR . 1 1 46 LEU . 1 1 47 THR . 1 1 48 LEU . 1 1 49 SER . 1 1 50 HIS . 1 1 51 PHE . 1 1 52 GLY . 1 1 53 LYS . 1 1 54 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 ALA 1 1 1 1 VAL 2 2 1 1 SER 3 3 1 1 VAL 4 4 1 1 ASP 5 5 1 1 CYS 6 6 1 1 SER 7 7 1 1 GLU 8 8 1 1 TYR 9 9 1 1 PRO 10 10 1 1 LYS 11 11 1 1 CYS 12 12 1 1 ALA 13 13 1 1 CYS 14 14 1 1 THR 15 15 1 1 MET 16 16 1 1 GLU 17 17 1 1 TYR 18 18 1 1 ARG 19 19 1 1 PRO 20 20 1 1 LEU 21 21 1 1 CYS 22 22 1 1 GLY 23 23 1 1 SER 24 24 1 1 ASP 25 25 1 1 ASN 26 26 1 1 LYS 27 27 1 1 THR 28 28 1 1 TYR 29 29 1 1 GLY 30 30 1 1 ASN 31 31 1 1 LYS 32 32 1 1 CYS 33 33 1 1 ASN 34 34 1 1 PHE 35 35 1 1 CYS 36 36 1 1 CYS 37 37 1 1 ALA 38 38 1 1 VAL 39 39 1 1 VAL 40 40 1 1 GLU 41 41 1 1 SER 42 42 1 1 ASN 43 43 1 1 GLY 44 44 1 1 THR 45 45 1 1 LEU 46 46 1 1 THR 47 47 1 1 LEU 48 48 1 1 SER 49 49 1 1 HIS 50 50 1 1 PHE 51 51 1 1 GLY 52 52 1 1 LYS 53 53 1 1 CYS 54 54 1 1 stop_ save_ save_CNS/XPLOR_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 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 10 PRO QB . 12 . HB# 1 1 1 1 2 1 1 40 VAL MG2 . 42 . HG2* 1 1 2 1 1 1 1 10 PRO QD . 12 . HD# 1 1 2 1 2 1 1 40 VAL MG2 . 42 . HG2* 1 1 3 1 1 1 1 17 GLU H . 19 . HN 1 1 3 1 2 1 1 31 ASN HB3 . 33 . HB1 1 1 4 1 1 1 1 17 GLU H . 19 . HN 1 1 4 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 5 1 1 1 1 18 TYR QE . 20 . HE# 1 1 5 1 2 1 1 30 GLY QA . 32 . HA# 1 1 6 1 1 1 1 19 ARG H . 21 . HN 1 1 6 1 2 1 1 19 ARG QB . 21 . HB# 1 1 7 1 1 1 1 20 PRO QG . 22 . HG# 1 1 7 1 2 1 1 53 LYS H . 55 . HN 1 1 8 1 1 1 1 10 PRO QD . 12 . HD# 1 1 8 1 2 1 1 40 VAL HB . 42 . HB 1 1 9 1 1 1 1 1 ALA MB . 3 . HB# 1 1 9 1 2 1 1 2 VAL H . 4 . HN 1 1 10 1 1 1 1 2 VAL H . 4 . HN 1 1 10 1 2 1 1 2 VAL QG . 4 . HG* 1 1 11 1 1 1 1 2 VAL HB . 4 . HB 1 1 11 1 2 1 1 48 LEU QD . 50 . HD2* 1 1 12 1 1 1 1 2 VAL QG . 4 . HG* 1 1 12 1 2 1 1 3 SER QB . 5 . HB# 1 1 13 1 1 1 1 2 VAL QG . 4 . HG* 1 1 13 1 2 1 1 48 LEU H . 50 . HN 1 1 14 1 1 1 1 2 VAL QG . 4 . HG* 1 1 14 1 2 1 1 48 LEU QD . 50 . HD* 1 1 15 1 1 1 1 2 VAL HA . 4 . HA 1 1 15 1 2 1 1 3 SER H . 5 . HN 1 1 16 1 1 1 1 2 VAL HB . 4 . HB 1 1 16 1 2 1 1 3 SER H . 5 . HN 1 1 17 1 1 1 1 3 SER H . 5 . HN 1 1 17 1 2 1 1 3 SER QB . 5 . HB# 1 1 18 1 1 1 1 3 SER HA . 5 . HA 1 1 18 1 2 1 1 48 LEU QD . 50 . HD2* 1 1 19 1 1 1 1 3 SER HA . 5 . HA 1 1 19 1 2 1 1 4 VAL H . 6 . HN 1 1 20 1 1 1 1 3 SER QB . 5 . HB# 1 1 20 1 2 1 1 4 VAL H . 6 . HN 1 1 21 1 1 1 1 4 VAL H . 6 . HN 1 1 21 1 2 1 1 4 VAL HB . 6 . HB 1 1 22 1 1 1 1 4 VAL H . 6 . HN 1 1 22 1 2 1 1 4 VAL MG1 . 6 . HG1* 1 1 23 1 1 1 1 4 VAL H . 6 . HN 1 1 23 1 2 1 1 4 VAL MG2 . 6 . HG2* 1 1 24 1 1 1 1 4 VAL HB . 6 . HB 1 1 24 1 2 1 1 35 PHE QE . 37 . HE* 1 1 25 1 1 1 1 4 VAL HB . 6 . HB 1 1 25 1 2 1 1 48 LEU QD . 50 . HD* 1 1 26 1 1 1 1 4 VAL MG1 . 6 . HG1* 1 1 26 1 2 1 1 5 ASP H . 7 . HN 1 1 27 1 1 1 1 4 VAL MG2 . 6 . HG2* 1 1 27 1 2 1 1 5 ASP H . 7 . HN 1 1 28 1 1 1 1 4 VAL MG1 . 6 . HG1* 1 1 28 1 2 1 1 35 PHE QD . 37 . HD* 1 1 29 1 1 1 1 4 VAL MG2 . 6 . HG2* 1 1 29 1 2 1 1 35 PHE QD . 37 . HD* 1 1 30 1 1 1 1 4 VAL MG1 . 6 . HG1* 1 1 30 1 2 1 1 35 PHE QE . 37 . HE* 1 1 31 1 1 1 1 4 VAL MG2 . 6 . HG2* 1 1 31 1 2 1 1 35 PHE QE . 37 . HE* 1 1 32 1 1 1 1 4 VAL MG1 . 6 . HG1* 1 1 32 1 2 1 1 48 LEU QD . 50 . HD* 1 1 33 1 1 1 1 4 VAL HA . 6 . HA 1 1 33 1 2 1 1 5 ASP H . 7 . HN 1 1 34 1 1 1 1 4 VAL HB . 6 . HB 1 1 34 1 2 1 1 5 ASP H . 7 . HN 1 1 35 1 1 1 1 5 ASP H . 7 . HN 1 1 35 1 2 1 1 5 ASP QB . 7 . HB# 1 1 36 1 1 1 1 5 ASP HA . 7 . HA 1 1 36 1 2 1 1 7 SER H . 9 . HN 1 1 37 1 1 1 1 4 VAL MG2 . 6 . HG2* 1 1 37 1 2 1 1 6 CYS H . 8 . HN 1 1 38 1 1 1 1 5 ASP HA . 7 . HA 1 1 38 1 2 1 1 6 CYS H . 8 . HN 1 1 39 1 1 1 1 6 CYS H . 8 . HN 1 1 39 1 2 1 1 6 CYS QB . 8 . HB# 1 1 40 1 1 1 1 6 CYS H . 8 . HN 1 1 40 1 2 1 1 7 SER H . 9 . HN 1 1 41 1 1 1 1 6 CYS H . 8 . HN 1 1 41 1 2 1 1 7 SER QB . 9 . HB# 1 1 42 1 1 1 1 6 CYS HA . 8 . HA 1 1 42 1 2 1 1 9 TYR QD . 11 . HD* 1 1 43 1 1 1 1 6 CYS HA . 8 . HA 1 1 43 1 2 1 1 9 TYR QE . 11 . HE* 1 1 44 1 1 1 1 6 CYS QB . 8 . HB# 1 1 44 1 2 1 1 39 VAL MG1 . 41 . HG1* 1 1 45 1 1 1 1 6 CYS QB . 8 . HB# 1 1 45 1 2 1 1 39 VAL MG2 . 41 . HG2* 1 1 46 1 1 1 1 5 ASP QB . 7 . HB# 1 1 46 1 2 1 1 7 SER H . 9 . HN 1 1 47 1 1 1 1 6 CYS HA . 8 . HA 1 1 47 1 2 1 1 7 SER H . 9 . HN 1 1 48 1 1 1 1 6 CYS QB . 8 . HB# 1 1 48 1 2 1 1 7 SER H . 9 . HN 1 1 49 1 1 1 1 7 SER H . 9 . HN 1 1 49 1 2 1 1 7 SER QB . 9 . HB# 1 1 50 1 1 1 1 7 SER H . 9 . HN 1 1 50 1 2 1 1 8 GLU H . 10 . HN 1 1 51 1 1 1 1 6 CYS HA . 8 . HA 1 1 51 1 2 1 1 8 GLU H . 10 . HN 1 1 52 1 1 1 1 7 SER HA . 9 . HA 1 1 52 1 2 1 1 8 GLU H . 10 . HN 1 1 53 1 1 1 1 7 SER QB . 9 . HB# 1 1 53 1 2 1 1 8 GLU H . 10 . HN 1 1 54 1 1 1 1 8 GLU H . 10 . HN 1 1 54 1 2 1 1 8 GLU QB . 10 . HB# 1 1 55 1 1 1 1 8 GLU H . 10 . HN 1 1 55 1 2 1 1 8 GLU QG . 10 . HG# 1 1 56 1 1 1 1 8 GLU H . 10 . HN 1 1 56 1 2 1 1 9 TYR H . 11 . HN 1 1 57 1 1 1 1 8 GLU QG . 10 . HG# 1 1 57 1 2 1 1 10 PRO QD . 12 . HD# 1 1 58 1 1 1 1 8 GLU HA . 10 . HA 1 1 58 1 2 1 1 9 TYR H . 11 . HN 1 1 59 1 1 1 1 8 GLU QB . 10 . HB# 1 1 59 1 2 1 1 9 TYR H . 11 . HN 1 1 60 1 1 1 1 9 TYR H . 11 . HN 1 1 60 1 2 1 1 9 TYR HB3 . 11 . HB1 1 1 61 1 1 1 1 9 TYR H . 11 . HN 1 1 61 1 2 1 1 10 PRO QD . 12 . HD# 1 1 62 1 1 1 1 9 TYR HA . 11 . HA 1 1 62 1 2 1 1 9 TYR QD . 11 . HD* 1 1 63 1 1 1 1 9 TYR HA . 11 . HA 1 1 63 1 2 1 1 10 PRO QG . 12 . HG# 1 1 64 1 1 1 1 9 TYR HA . 11 . HA 1 1 64 1 2 1 1 10 PRO QD . 12 . HD# 1 1 65 1 1 1 1 9 TYR HA . 11 . HA 1 1 65 1 2 1 1 11 LYS QG . 13 . HG# 1 1 66 1 1 1 1 9 TYR QD . 11 . HD* 1 1 66 1 2 1 1 33 CYS HB2 . 35 . HB2 1 1 67 1 1 1 1 9 TYR QD . 11 . HD* 1 1 67 1 2 1 1 33 CYS HA . 35 . HA 1 1 68 1 1 1 1 9 TYR QE . 11 . HE* 1 1 68 1 2 1 1 33 CYS HB2 . 35 . HB2 1 1 69 1 1 1 1 9 TYR QE . 11 . HE* 1 1 69 1 2 1 1 33 CYS HA . 35 . HA 1 1 70 1 1 1 1 10 PRO QG . 12 . HG# 1 1 70 1 2 1 1 40 VAL MG1 . 42 . HG1* 1 1 71 1 1 1 1 10 PRO QG . 12 . HG# 1 1 71 1 2 1 1 40 VAL MG2 . 42 . HG2* 1 1 72 1 1 1 1 10 PRO QD . 12 . HD# 1 1 72 1 2 1 1 11 LYS H . 13 . HN 1 1 73 1 1 1 1 11 LYS H . 13 . HN 1 1 73 1 2 1 1 12 CYS H . 14 . HN 1 1 74 1 1 1 1 11 LYS HA . 13 . HA 1 1 74 1 2 1 1 12 CYS H . 14 . HN 1 1 75 1 1 1 1 11 LYS QB . 13 . HB# 1 1 75 1 2 1 1 12 CYS H . 14 . HN 1 1 76 1 1 1 1 12 CYS H . 14 . HN 1 1 76 1 2 1 1 12 CYS QB . 14 . HB# 1 1 77 1 1 1 1 12 CYS H . 14 . HN 1 1 77 1 2 1 1 13 ALA H . 15 . HN 1 1 78 1 1 1 1 12 CYS HA . 14 . HA 1 1 78 1 2 1 1 13 ALA H . 15 . HN 1 1 79 1 1 1 1 13 ALA H . 15 . HN 1 1 79 1 2 1 1 13 ALA MB . 15 . HB# 1 1 80 1 1 1 1 13 ALA HA . 15 . HA 1 1 80 1 2 1 1 14 CYS H . 16 . HN 1 1 81 1 1 1 1 13 ALA MB . 15 . HB# 1 1 81 1 2 1 1 14 CYS H . 16 . HN 1 1 82 1 1 1 1 14 CYS H . 16 . HN 1 1 82 1 2 1 1 14 CYS HB3 . 16 . HB1 1 1 83 1 1 1 1 14 CYS H . 16 . HN 1 1 83 1 2 1 1 14 CYS HB2 . 16 . HB2 1 1 84 1 1 1 1 14 CYS HB3 . 16 . HB1 1 1 84 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 85 1 1 1 1 14 CYS HB2 . 16 . HB2 1 1 85 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 86 1 1 1 1 14 CYS HB3 . 16 . HB1 1 1 86 1 2 1 1 33 CYS QB . 35 . HB# 1 1 87 1 1 1 1 14 CYS HB2 . 16 . HB2 1 1 87 1 2 1 1 33 CYS QB . 35 . HB# 1 1 88 1 1 1 1 14 CYS HB2 . 16 . HB2 1 1 88 1 2 1 1 34 ASN QD . 36 . HD2# 1 1 89 1 1 1 1 14 CYS HA . 16 . HA 1 1 89 1 2 1 1 15 THR H . 17 . HN 1 1 90 1 1 1 1 14 CYS HB3 . 16 . HB1 1 1 90 1 2 1 1 15 THR H . 17 . HN 1 1 91 1 1 1 1 14 CYS HB2 . 16 . HB2 1 1 91 1 2 1 1 15 THR H . 17 . HN 1 1 92 1 1 1 1 15 THR H . 17 . HN 1 1 92 1 2 1 1 16 MET H . 18 . HN 1 1 93 1 1 1 1 15 THR H . 17 . HN 1 1 93 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 94 1 1 1 1 15 THR H . 17 . HN 1 1 94 1 2 1 1 33 CYS QB . 35 . HB# 1 1 95 1 1 1 1 15 THR HB . 17 . HB 1 1 95 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 96 1 1 1 1 16 MET H . 18 . HN 1 1 96 1 2 1 1 16 MET QB . 18 . HB# 1 1 97 1 1 1 1 16 MET H . 18 . HN 1 1 97 1 2 1 1 16 MET QG . 18 . HG# 1 1 98 1 1 1 1 16 MET H . 18 . HN 1 1 98 1 2 1 1 17 GLU H . 19 . HN 1 1 99 1 1 1 1 16 MET HA . 18 . HA 1 1 99 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 100 1 1 1 1 16 MET HA . 18 . HA 1 1 100 1 2 1 1 17 GLU H . 19 . HN 1 1 101 1 1 1 1 17 GLU H . 19 . HN 1 1 101 1 2 1 1 17 GLU QB . 19 . HB# 1 1 102 1 1 1 1 17 GLU H . 19 . HN 1 1 102 1 2 1 1 17 GLU QG . 19 . HG# 1 1 103 1 1 1 1 17 GLU QG . 19 . HG# 1 1 103 1 2 1 1 19 ARG QG . 21 . HG# 1 1 104 1 1 1 1 17 GLU QB . 19 . HB# 1 1 104 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 105 1 1 1 1 17 GLU QG . 19 . HG# 1 1 105 1 2 1 1 31 ASN QB . 33 . HB# 1 1 106 1 1 1 1 17 GLU QG . 19 . HG# 1 1 106 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 107 1 1 1 1 17 GLU HA . 19 . HA 1 1 107 1 2 1 1 18 TYR H . 20 . HN 1 1 108 1 1 1 1 17 GLU QB . 19 . HB# 1 1 108 1 2 1 1 18 TYR H . 20 . HN 1 1 109 1 1 1 1 17 GLU QG . 19 . HG# 1 1 109 1 2 1 1 18 TYR H . 20 . HN 1 1 110 1 1 1 1 18 TYR H . 20 . HN 1 1 110 1 2 1 1 18 TYR HB3 . 20 . HB1 1 1 111 1 1 1 1 18 TYR H . 20 . HN 1 1 111 1 2 1 1 18 TYR HB2 . 20 . HB2 1 1 112 1 1 1 1 18 TYR H . 20 . HN 1 1 112 1 2 1 1 18 TYR QD . 20 . HD* 1 1 113 1 1 1 1 18 TYR HA . 20 . HA 1 1 113 1 2 1 1 18 TYR QD . 20 . HD* 1 1 114 1 1 1 1 18 TYR HA . 20 . HA 1 1 114 1 2 1 1 19 ARG HE . 21 . HE 1 1 115 1 1 1 1 18 TYR HA . 20 . HA 1 1 115 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 116 1 1 1 1 18 TYR QB . 20 . HB# 1 1 116 1 2 1 1 19 ARG HE . 21 . HE 1 1 117 1 1 1 1 18 TYR QE . 20 . HE* 1 1 117 1 2 1 1 19 ARG HA . 21 . HA 1 1 118 1 1 1 1 18 TYR QE . 20 . HE# 1 1 118 1 2 1 1 20 PRO HA . 22 . HA 1 1 119 1 1 1 1 18 TYR QE . 20 . HE* 1 1 119 1 2 1 1 20 PRO QB . 22 . HB# 1 1 120 1 1 1 1 18 TYR QE . 20 . HE* 1 1 120 1 2 1 1 20 PRO QG . 22 . HG# 1 1 121 1 1 1 1 18 TYR HA . 20 . HA 1 1 121 1 2 1 1 19 ARG H . 21 . HN 1 1 122 1 1 1 1 18 TYR HB3 . 20 . HB1 1 1 122 1 2 1 1 19 ARG H . 21 . HN 1 1 123 1 1 1 1 18 TYR HB2 . 20 . HB2 1 1 123 1 2 1 1 19 ARG H . 21 . HN 1 1 124 1 1 1 1 17 GLU QG . 19 . HG# 1 1 124 1 2 1 1 19 ARG H . 21 . HN 1 1 125 1 1 1 1 19 ARG H . 21 . HN 1 1 125 1 2 1 1 19 ARG QG . 21 . HG# 1 1 126 1 1 1 1 19 ARG H . 21 . HN 1 1 126 1 2 1 1 19 ARG HE . 21 . HE 1 1 127 1 1 1 1 19 ARG H . 21 . HN 1 1 127 1 2 1 1 20 PRO QD . 22 . HD# 1 1 128 1 1 1 1 19 ARG H . 21 . HN 1 1 128 1 2 1 1 30 GLY QA . 32 . HA# 1 1 129 1 1 1 1 19 ARG H . 21 . HN 1 1 129 1 2 1 1 31 ASN HA . 33 . HA 1 1 130 1 1 1 1 19 ARG H . 21 . HN 1 1 130 1 2 1 1 31 ASN QB . 33 . HB# 1 1 131 1 1 1 1 19 ARG H . 21 . HN 1 1 131 1 2 1 1 31 ASN QD . 33 . HD2# 1 1 132 1 1 1 1 19 ARG HA . 21 . HA 1 1 132 1 2 1 1 20 PRO QD . 22 . HD# 1 1 133 1 1 1 1 19 ARG QB . 21 . HB# 1 1 133 1 2 1 1 31 ASN HA . 33 . HA 1 1 134 1 1 1 1 19 ARG HE . 21 . HE 1 1 134 1 2 1 1 19 ARG QG . 21 . HG# 1 1 135 1 1 1 1 19 ARG QD . 21 . HD* 1 1 135 1 2 1 1 19 ARG QG . 21 . HG# 1 1 136 1 1 1 1 20 PRO HA . 22 . HA 1 1 136 1 2 1 1 30 GLY QA . 32 . HA# 1 1 137 1 1 1 1 20 PRO QB . 22 . HB# 1 1 137 1 2 1 1 30 GLY QA . 32 . HA# 1 1 138 1 1 1 1 20 PRO QB . 22 . HB# 1 1 138 1 2 1 1 52 GLY QA . 54 . HA# 1 1 139 1 1 1 1 20 PRO QB . 22 . HB# 1 1 139 1 2 1 1 53 LYS HA . 55 . HA 1 1 140 1 1 1 1 20 PRO QG . 22 . HG# 1 1 140 1 2 1 1 52 GLY QA . 54 . HA# 1 1 141 1 1 1 1 20 PRO QG . 22 . HG# 1 1 141 1 2 1 1 53 LYS HA . 55 . HA 1 1 142 1 1 1 1 19 ARG H . 21 . HN 1 1 142 1 2 1 1 20 PRO HA . 22 . HA 1 1 143 1 1 1 1 19 ARG H . 21 . HN 1 1 143 1 2 1 1 19 ARG QD . 21 . HD1* 1 1 144 1 1 1 1 19 ARG H . 21 . HN 1 1 144 1 2 1 1 29 TYR QB . 31 . HB1 1 1 145 1 1 1 1 19 ARG HA . 21 . HA 1 1 145 1 2 1 1 22 CYS H . 24 . HN 1 1 146 1 1 1 1 19 ARG HA . 21 . HA 1 1 146 1 2 1 1 48 LEU QD . 50 . HD1* 1 1 147 1 1 1 1 19 ARG HA . 21 . HA 1 1 147 1 2 1 1 52 GLY H . 54 . HN 1 1 148 1 1 1 1 19 ARG QB . 21 . HB# 1 1 148 1 2 1 1 22 CYS H . 24 . HN 1 1 149 1 1 1 1 19 ARG QB . 21 . HB# 1 1 149 1 2 1 1 29 TYR H . 31 . HN 1 1 150 1 1 1 1 19 ARG QB . 21 . HB# 1 1 150 1 2 1 1 35 PHE QB . 37 . HB2 1 1 151 1 1 1 1 19 ARG QB . 21 . HB# 1 1 151 1 2 1 1 35 PHE QD . 37 . HD# 1 1 152 1 1 1 1 19 ARG QB . 21 . HB# 1 1 152 1 2 1 1 52 GLY H . 54 . HN 1 1 153 1 1 1 1 19 ARG QD . 21 . HD2* 1 1 153 1 2 1 1 22 CYS H . 24 . HN 1 1 154 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 154 1 2 1 1 31 ASN H . 33 . HN 1 1 155 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 155 1 2 1 1 32 LYS H . 34 . HN 1 1 156 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 156 1 2 1 1 32 LYS HA . 34 . HA 1 1 157 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 157 1 2 1 1 35 PHE QB . 37 . HB1 1 1 158 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 158 1 2 1 1 35 PHE QD . 37 . HD# 1 1 159 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 159 1 2 1 1 36 CYS H . 38 . HN 1 1 160 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 160 1 2 1 1 48 LEU QD . 50 . HD1* 1 1 161 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 161 1 2 1 1 51 PHE QD . 53 . HD2 1 1 162 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 162 1 2 1 1 51 PHE QE . 53 . HE2 1 1 163 1 1 1 1 19 ARG QD . 21 . HD2* 1 1 163 1 2 1 1 52 GLY H . 54 . HN 1 1 164 1 1 1 1 22 CYS H . 24 . HN 1 1 164 1 2 1 1 22 CYS QB . 24 . HB# 1 1 165 1 1 1 1 22 CYS H . 24 . HN 1 1 165 1 2 1 1 23 GLY H . 25 . HN 1 1 166 1 1 1 1 22 CYS H . 24 . HN 1 1 166 1 2 1 1 48 LEU QD . 50 . HD1* 1 1 167 1 1 1 1 22 CYS HA . 24 . HA 1 1 167 1 2 1 1 23 GLY H . 25 . HN 1 1 168 1 1 1 1 22 CYS HA . 24 . HA 1 1 168 1 2 1 1 29 TYR H . 31 . HN 1 1 169 1 1 1 1 22 CYS QB . 24 . HB# 1 1 169 1 2 1 1 23 GLY H . 25 . HN 1 1 170 1 1 1 1 22 CYS QB . 24 . HB# 1 1 170 1 2 1 1 50 HIS H . 52 . HN 1 1 171 1 1 1 1 22 CYS QB . 24 . HB# 1 1 171 1 2 1 1 50 HIS HE1 . 52 . HE1 1 1 172 1 1 1 1 22 CYS QB . 24 . HB# 1 1 172 1 2 1 1 54 CYS H . 56 . HN 1 1 173 1 1 1 1 22 CYS QB . 24 . HB# 1 1 173 1 2 1 1 54 CYS HA . 56 . HA 1 1 174 1 1 1 1 23 GLY H . 25 . HN 1 1 174 1 2 1 1 27 LYS H . 29 . HN 1 1 175 1 1 1 1 23 GLY H . 25 . HN 1 1 175 1 2 1 1 27 LYS HA . 29 . HA 1 1 176 1 1 1 1 23 GLY H . 25 . HN 1 1 176 1 2 1 1 29 TYR QE . 31 . HE1 1 1 177 1 1 1 1 23 GLY QA . 25 . HA# 1 1 177 1 2 1 1 24 SER H . 26 . HN 1 1 178 1 1 1 1 23 GLY QA . 25 . HA# 1 1 178 1 2 1 1 35 PHE QD . 37 . HD2 1 1 179 1 1 1 1 23 GLY QA . 25 . HA# 1 1 179 1 2 1 1 35 PHE QE . 37 . HE# 1 1 180 1 1 1 1 23 GLY QA . 25 . HA# 1 1 180 1 2 1 1 48 LEU QB . 50 . HB# 1 1 181 1 1 1 1 23 GLY QA . 25 . HA# 1 1 181 1 2 1 1 48 LEU QD . 50 . HD1* 1 1 182 1 1 1 1 24 SER H . 26 . HN 1 1 182 1 2 1 1 24 SER QB . 26 . HB# 1 1 183 1 1 1 1 24 SER H . 26 . HN 1 1 183 1 2 1 1 25 ASP H . 27 . HN 1 1 184 1 1 1 1 24 SER H . 26 . HN 1 1 184 1 2 1 1 35 PHE QE . 37 . HE2 1 1 185 1 1 1 1 24 SER H . 26 . HN 1 1 185 1 2 1 1 46 LEU MD1 . 48 . HD1* 1 1 186 1 1 1 1 24 SER H . 26 . HN 1 1 186 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 187 1 1 1 1 24 SER H . 26 . HN 1 1 187 1 2 1 1 48 LEU H . 50 . HN 1 1 188 1 1 1 1 24 SER H . 26 . HN 1 1 188 1 2 1 1 48 LEU HA . 50 . HA 1 1 189 1 1 1 1 24 SER H . 26 . HN 1 1 189 1 2 1 1 48 LEU QD . 50 . HD1* 1 1 190 1 1 1 1 24 SER H . 26 . HN 1 1 190 1 2 1 1 49 SER QB . 51 . HB# 1 1 191 1 1 1 1 24 SER HA . 26 . HA 1 1 191 1 2 1 1 25 ASP H . 27 . HN 1 1 192 1 1 1 1 24 SER HA . 26 . HA 1 1 192 1 2 1 1 26 ASN H . 28 . HN 1 1 193 1 1 1 1 24 SER HA . 26 . HA 1 1 193 1 2 1 1 49 SER QB . 51 . HB# 1 1 194 1 1 1 1 25 ASP H . 27 . HN 1 1 194 1 2 1 1 25 ASP HB3 . 27 . HB1 1 1 195 1 1 1 1 25 ASP H . 27 . HN 1 1 195 1 2 1 1 25 ASP HB2 . 27 . HB2 1 1 196 1 1 1 1 25 ASP H . 27 . HN 1 1 196 1 2 1 1 26 ASN H . 28 . HN 1 1 197 1 1 1 1 25 ASP H . 27 . HN 1 1 197 1 2 1 1 27 LYS H . 29 . HN 1 1 198 1 1 1 1 25 ASP H . 27 . HN 1 1 198 1 2 1 1 46 LEU MD1 . 48 . HD1* 1 1 199 1 1 1 1 25 ASP HB3 . 27 . HB1 1 1 199 1 2 1 1 26 ASN H . 28 . HN 1 1 200 1 1 1 1 25 ASP HB2 . 27 . HB2 1 1 200 1 2 1 1 26 ASN H . 28 . HN 1 1 201 1 1 1 1 25 ASP HB3 . 27 . HB1 1 1 201 1 2 1 1 27 LYS H . 29 . HN 1 1 202 1 1 1 1 25 ASP HB2 . 27 . HB2 1 1 202 1 2 1 1 27 LYS H . 29 . HN 1 1 203 1 1 1 1 25 ASP HB3 . 27 . HB1 1 1 203 1 2 1 1 47 THR H . 49 . HN 1 1 204 1 1 1 1 26 ASN H . 28 . HN 1 1 204 1 2 1 1 26 ASN HA . 28 . HA 1 1 205 1 1 1 1 26 ASN H . 28 . HN 1 1 205 1 2 1 1 26 ASN HB3 . 28 . HB1 1 1 206 1 1 1 1 26 ASN H . 28 . HN 1 1 206 1 2 1 1 26 ASN HB2 . 28 . HB2 1 1 207 1 1 1 1 26 ASN H . 28 . HN 1 1 207 1 2 1 1 27 LYS H . 29 . HN 1 1 208 1 1 1 1 27 LYS H . 29 . HN 1 1 208 1 2 1 1 27 LYS QB . 29 . HB# 1 1 209 1 1 1 1 27 LYS H . 29 . HN 1 1 209 1 2 1 1 27 LYS QG . 29 . HG# 1 1 210 1 1 1 1 27 LYS H . 29 . HN 1 1 210 1 2 1 1 27 LYS QD . 29 . HD# 1 1 211 1 1 1 1 27 LYS HA . 29 . HA 1 1 211 1 2 1 1 28 THR H . 30 . HN 1 1 212 1 1 1 1 27 LYS QB . 29 . HB# 1 1 212 1 2 1 1 28 THR H . 30 . HN 1 1 213 1 1 1 1 27 LYS QG . 29 . HG# 1 1 213 1 2 1 1 28 THR H . 30 . HN 1 1 214 1 1 1 1 27 LYS QD . 29 . HD# 1 1 214 1 2 1 1 28 THR H . 30 . HN 1 1 215 1 1 1 1 28 THR H . 30 . HN 1 1 215 1 2 1 1 28 THR HB . 30 . HB 1 1 216 1 1 1 1 28 THR H . 30 . HN 1 1 216 1 2 1 1 28 THR MG . 30 . HG2# 1 1 217 1 1 1 1 28 THR H . 30 . HN 1 1 217 1 2 1 1 29 TYR H . 31 . HN 1 1 218 1 1 1 1 28 THR HB . 30 . HB 1 1 218 1 2 1 1 29 TYR H . 31 . HN 1 1 219 1 1 1 1 28 THR MG . 30 . HG2# 1 1 219 1 2 1 1 29 TYR H . 31 . HN 1 1 220 1 1 1 1 28 THR MG . 30 . HG2# 1 1 220 1 2 1 1 30 GLY H . 32 . HN 1 1 221 1 1 1 1 28 THR MG . 30 . HG2# 1 1 221 1 2 1 1 53 LYS H . 55 . HN 1 1 222 1 1 1 1 29 TYR H . 31 . HN 1 1 222 1 2 1 1 29 TYR QB . 31 . HB1 1 1 223 1 1 1 1 29 TYR H . 31 . HN 1 1 223 1 2 1 1 29 TYR QE . 31 . HE# 1 1 224 1 1 1 1 29 TYR H . 31 . HN 1 1 224 1 2 1 1 30 GLY H . 32 . HN 1 1 225 1 1 1 1 29 TYR HA . 31 . HA 1 1 225 1 2 1 1 30 GLY H . 32 . HN 1 1 226 1 1 1 1 29 TYR HA . 31 . HA 1 1 226 1 2 1 1 31 ASN H . 33 . HN 1 1 227 1 1 1 1 29 TYR QB . 31 . HB1 1 1 227 1 2 1 1 30 GLY H . 32 . HN 1 1 228 1 1 1 1 29 TYR QD . 31 . HD# 1 1 228 1 2 1 1 30 GLY H . 32 . HN 1 1 229 1 1 1 1 29 TYR QE . 31 . HE# 1 1 229 1 2 1 1 35 PHE HA . 37 . HA 1 1 230 1 1 1 1 30 GLY H . 32 . HN 1 1 230 1 2 1 1 31 ASN H . 33 . HN 1 1 231 1 1 1 1 30 GLY H . 32 . HN 1 1 231 1 2 1 1 34 ASN HB3 . 36 . HB1 1 1 232 1 1 1 1 30 GLY H . 32 . HN 1 1 232 1 2 1 1 34 ASN HB2 . 36 . HB2 1 1 233 1 1 1 1 30 GLY QA . 32 . HA# 1 1 233 1 2 1 1 31 ASN H . 33 . HN 1 1 234 1 1 1 1 31 ASN H . 33 . HN 1 1 234 1 2 1 1 31 ASN HB3 . 33 . HB1 1 1 235 1 1 1 1 31 ASN H . 33 . HN 1 1 235 1 2 1 1 34 ASN HB3 . 36 . HB1 1 1 236 1 1 1 1 31 ASN H . 33 . HN 1 1 236 1 2 1 1 34 ASN HB2 . 36 . HB2 1 1 237 1 1 1 1 31 ASN HA . 33 . HA 1 1 237 1 2 1 1 32 LYS H . 34 . HN 1 1 238 1 1 1 1 31 ASN QD . 33 . HD2# 1 1 238 1 2 1 1 34 ASN H . 36 . HN 1 1 239 1 1 1 1 32 LYS H . 34 . HN 1 1 239 1 2 1 1 33 CYS H . 35 . HN 1 1 240 1 1 1 1 32 LYS H . 34 . HN 1 1 240 1 2 1 1 35 PHE QB . 37 . HB1 1 1 241 1 1 1 1 32 LYS HA . 34 . HA 1 1 241 1 2 1 1 33 CYS H . 35 . HN 1 1 242 1 1 1 1 32 LYS HA . 34 . HA 1 1 242 1 2 1 1 35 PHE H . 37 . HN 1 1 243 1 1 1 1 32 LYS HA . 34 . HA 1 1 243 1 2 1 1 35 PHE QD . 37 . HD# 1 1 244 1 1 1 1 32 LYS HA . 34 . HA 1 1 244 1 2 1 1 36 CYS H . 38 . HN 1 1 245 1 1 1 1 33 CYS H . 35 . HN 1 1 245 1 2 1 1 33 CYS HB3 . 35 . HB1 1 1 246 1 1 1 1 33 CYS H . 35 . HN 1 1 246 1 2 1 1 33 CYS HB2 . 35 . HB2 1 1 247 1 1 1 1 33 CYS H . 35 . HN 1 1 247 1 2 1 1 34 ASN H . 36 . HN 1 1 248 1 1 1 1 33 CYS HB3 . 35 . HB1 1 1 248 1 2 1 1 34 ASN H . 36 . HN 1 1 249 1 1 1 1 33 CYS HB2 . 35 . HB2 1 1 249 1 2 1 1 34 ASN H . 36 . HN 1 1 250 1 1 1 1 34 ASN H . 36 . HN 1 1 250 1 2 1 1 34 ASN HB3 . 36 . HB1 1 1 251 1 1 1 1 34 ASN H . 36 . HN 1 1 251 1 2 1 1 34 ASN HB2 . 36 . HB2 1 1 252 1 1 1 1 34 ASN H . 36 . HN 1 1 252 1 2 1 1 34 ASN QD . 36 . HD2# 1 1 253 1 1 1 1 35 PHE H . 37 . HN 1 1 253 1 2 1 1 35 PHE QB . 37 . HB1 1 1 254 1 1 1 1 35 PHE H . 37 . HN 1 1 254 1 2 1 1 35 PHE QD . 37 . HD# 1 1 255 1 1 1 1 35 PHE H . 37 . HN 1 1 255 1 2 1 1 36 CYS H . 38 . HN 1 1 256 1 1 1 1 35 PHE H . 37 . HN 1 1 256 1 2 1 1 36 CYS HB2 . 38 . HB2 1 1 257 1 1 1 1 35 PHE HA . 37 . HA 1 1 257 1 2 1 1 35 PHE QD . 37 . HD# 1 1 258 1 1 1 1 35 PHE HA . 37 . HA 1 1 258 1 2 1 1 36 CYS H . 38 . HN 1 1 259 1 1 1 1 35 PHE HA . 37 . HA 1 1 259 1 2 1 1 38 ALA H . 40 . HN 1 1 260 1 1 1 1 35 PHE HA . 37 . HA 1 1 260 1 2 1 1 38 ALA MB . 40 . HB# 1 1 261 1 1 1 1 35 PHE HA . 37 . HA 1 1 261 1 2 1 1 39 VAL H . 41 . HN 1 1 262 1 1 1 1 35 PHE HA . 37 . HA 1 1 262 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 263 1 1 1 1 35 PHE QB . 37 . HB1 1 1 263 1 2 1 1 35 PHE QD . 37 . HD# 1 1 264 1 1 1 1 35 PHE QB . 37 . HB1 1 1 264 1 2 1 1 36 CYS H . 38 . HN 1 1 265 1 1 1 1 35 PHE QB . 37 . HB1 1 1 265 1 2 1 1 36 CYS HB2 . 38 . HB2 1 1 266 1 1 1 1 35 PHE QD . 37 . HD# 1 1 266 1 2 1 1 36 CYS H . 38 . HN 1 1 267 1 1 1 1 35 PHE QD . 37 . HD# 1 1 267 1 2 1 1 36 CYS HA . 38 . HA 1 1 268 1 1 1 1 35 PHE QE . 37 . HE# 1 1 268 1 2 1 1 36 CYS HA . 38 . HA 1 1 269 1 1 1 1 35 PHE QE . 37 . HE# 1 1 269 1 2 1 1 39 VAL H . 41 . HN 1 1 270 1 1 1 1 35 PHE QE . 37 . HE2 1 1 270 1 2 1 1 46 LEU MD1 . 48 . HD1* 1 1 271 1 1 1 1 35 PHE QE . 37 . HE2 1 1 271 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 272 1 1 1 1 35 PHE QE . 37 . HE# 1 1 272 1 2 1 1 47 THR HA . 49 . HA 1 1 273 1 1 1 1 35 PHE QD . 37 . HD# 1 1 273 1 2 1 1 48 LEU HA . 50 . HA 1 1 274 1 1 1 1 35 PHE QE . 37 . HE# 1 1 274 1 2 1 1 48 LEU HA . 50 . HA 1 1 275 1 1 1 1 35 PHE QD . 37 . HD# 1 1 275 1 2 1 1 48 LEU QB . 50 . HB# 1 1 276 1 1 1 1 35 PHE QE . 37 . HE# 1 1 276 1 2 1 1 48 LEU QB . 50 . HB# 1 1 277 1 1 1 1 35 PHE QE . 37 . HE# 1 1 277 1 2 1 1 48 LEU HG . 50 . HG 1 1 278 1 1 1 1 35 PHE QD . 37 . HD# 1 1 278 1 2 1 1 48 LEU QD . 50 . HD1* 1 1 279 1 1 1 1 35 PHE QE . 37 . HE# 1 1 279 1 2 1 1 48 LEU QD . 50 . HD1* 1 1 280 1 1 1 1 36 CYS H . 38 . HN 1 1 280 1 2 1 1 36 CYS HB3 . 38 . HB1 1 1 281 1 1 1 1 36 CYS H . 38 . HN 1 1 281 1 2 1 1 36 CYS HB2 . 38 . HB2 1 1 282 1 1 1 1 36 CYS H . 38 . HN 1 1 282 1 2 1 1 38 ALA H . 40 . HN 1 1 283 1 1 1 1 36 CYS H . 38 . HN 1 1 283 1 2 1 1 39 VAL HB . 41 . HB 1 1 284 1 1 1 1 36 CYS H . 38 . HN 1 1 284 1 2 1 1 39 VAL MG2 . 41 . HG2* 1 1 285 1 1 1 1 36 CYS HA . 38 . HA 1 1 285 1 2 1 1 38 ALA H . 40 . HN 1 1 286 1 1 1 1 36 CYS HA . 38 . HA 1 1 286 1 2 1 1 39 VAL H . 41 . HN 1 1 287 1 1 1 1 36 CYS HA . 38 . HA 1 1 287 1 2 1 1 39 VAL HB . 41 . HB 1 1 288 1 1 1 1 36 CYS HA . 38 . HA 1 1 288 1 2 1 1 39 VAL MG1 . 41 . HG1* 1 1 289 1 1 1 1 36 CYS HA . 38 . HA 1 1 289 1 2 1 1 39 VAL MG2 . 41 . HG2* 1 1 290 1 1 1 1 38 ALA H . 40 . HN 1 1 290 1 2 1 1 38 ALA MB . 40 . HB# 1 1 291 1 1 1 1 38 ALA H . 40 . HN 1 1 291 1 2 1 1 39 VAL H . 41 . HN 1 1 292 1 1 1 1 38 ALA H . 40 . HN 1 1 292 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 293 1 1 1 1 38 ALA HA . 40 . HA 1 1 293 1 2 1 1 39 VAL H . 41 . HN 1 1 294 1 1 1 1 38 ALA HA . 40 . HA 1 1 294 1 2 1 1 41 GLU H . 43 . HN 1 1 295 1 1 1 1 38 ALA HA . 40 . HA 1 1 295 1 2 1 1 41 GLU QB . 43 . HB# 1 1 296 1 1 1 1 38 ALA MB . 40 . HB# 1 1 296 1 2 1 1 39 VAL H . 41 . HN 1 1 297 1 1 1 1 38 ALA MB . 40 . HB# 1 1 297 1 2 1 1 39 VAL HA . 41 . HA 1 1 298 1 1 1 1 38 ALA MB . 40 . HB# 1 1 298 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 299 1 1 1 1 38 ALA MB . 40 . HB1 1 1 299 1 2 1 1 46 LEU MD1 . 48 . HD1* 1 1 300 1 1 1 1 39 VAL H . 41 . HN 1 1 300 1 2 1 1 39 VAL HB . 41 . HB 1 1 301 1 1 1 1 39 VAL H . 41 . HN 1 1 301 1 2 1 1 39 VAL MG2 . 41 . HG2* 1 1 302 1 1 1 1 39 VAL H . 41 . HN 1 1 302 1 2 1 1 40 VAL H . 42 . HN 1 1 303 1 1 1 1 39 VAL H . 41 . HN 1 1 303 1 2 1 1 40 VAL HB . 42 . HB 1 1 304 1 1 1 1 39 VAL H . 41 . HN 1 1 304 1 2 1 1 40 VAL MG2 . 42 . HG2* 1 1 305 1 1 1 1 39 VAL H . 41 . HN 1 1 305 1 2 1 1 41 GLU QG . 43 . HG# 1 1 306 1 1 1 1 39 VAL H . 41 . HN 1 1 306 1 2 1 1 46 LEU QB . 48 . HB# 1 1 307 1 1 1 1 39 VAL H . 41 . HN 1 1 307 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 308 1 1 1 1 39 VAL HA . 41 . HA 1 1 308 1 2 1 1 40 VAL H . 42 . HN 1 1 309 1 1 1 1 39 VAL HA . 41 . HA 1 1 309 1 2 1 1 42 SER H . 44 . HN 1 1 310 1 1 1 1 39 VAL HA . 41 . HA 1 1 310 1 2 1 1 46 LEU H . 48 . HN 1 1 311 1 1 1 1 39 VAL HA . 41 . HA 1 1 311 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 312 1 1 1 1 39 VAL HB . 41 . HB 1 1 312 1 2 1 1 40 VAL H . 42 . HN 1 1 313 1 1 1 1 39 VAL MG1 . 41 . HG1* 1 1 313 1 2 1 1 40 VAL H . 42 . HN 1 1 314 1 1 1 1 39 VAL MG2 . 41 . HG2* 1 1 314 1 2 1 1 40 VAL H . 42 . HN 1 1 315 1 1 1 1 39 VAL MG1 . 41 . HG1* 1 1 315 1 2 1 1 40 VAL HA . 42 . HA 1 1 316 1 1 1 1 39 VAL MG1 . 41 . HG1* 1 1 316 1 2 1 1 44 GLY H . 46 . HN 1 1 317 1 1 1 1 39 VAL MG1 . 41 . HG1* 1 1 317 1 2 1 1 44 GLY QA . 46 . HA# 1 1 318 1 1 1 1 39 VAL MG1 . 41 . HG1* 1 1 318 1 2 1 1 45 THR H . 47 . HN 1 1 319 1 1 1 1 39 VAL MG1 . 41 . HG1* 1 1 319 1 2 1 1 46 LEU H . 48 . HN 1 1 320 1 1 1 1 39 VAL MG2 . 41 . HG2* 1 1 320 1 2 1 1 46 LEU H . 48 . HN 1 1 321 1 1 1 1 39 VAL MG1 . 41 . HG1* 1 1 321 1 2 1 1 46 LEU QB . 48 . HB# 1 1 322 1 1 1 1 39 VAL MG2 . 41 . HG2* 1 1 322 1 2 1 1 46 LEU QB . 48 . HB# 1 1 323 1 1 1 1 39 VAL MG2 . 41 . HG2* 1 1 323 1 2 1 1 46 LEU HG . 48 . HG 1 1 324 1 1 1 1 39 VAL MG2 . 41 . HG2* 1 1 324 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 325 1 1 1 1 40 VAL H . 42 . HN 1 1 325 1 2 1 1 40 VAL HB . 42 . HB 1 1 326 1 1 1 1 40 VAL H . 42 . HN 1 1 326 1 2 1 1 41 GLU QG . 43 . HG# 1 1 327 1 1 1 1 40 VAL HA . 42 . HA 1 1 327 1 2 1 1 41 GLU H . 43 . HN 1 1 328 1 1 1 1 40 VAL HA . 42 . HA 1 1 328 1 2 1 1 42 SER H . 44 . HN 1 1 329 1 1 1 1 40 VAL HA . 42 . HA 1 1 329 1 2 1 1 43 ASN H . 45 . HN 1 1 330 1 1 1 1 40 VAL HA . 42 . HA 1 1 330 1 2 1 1 44 GLY H . 46 . HN 1 1 331 1 1 1 1 40 VAL HB . 42 . HB# 1 1 331 1 2 1 1 41 GLU H . 43 . HN 1 1 332 1 1 1 1 40 VAL MG1 . 42 . HG1* 1 1 332 1 2 1 1 41 GLU H . 43 . HN 1 1 333 1 1 1 1 40 VAL MG2 . 42 . HG2* 1 1 333 1 2 1 1 41 GLU H . 43 . HN 1 1 334 1 1 1 1 41 GLU H . 43 . HN 1 1 334 1 2 1 1 41 GLU QB . 43 . HB# 1 1 335 1 1 1 1 41 GLU H . 43 . HN 1 1 335 1 2 1 1 41 GLU QG . 43 . HG# 1 1 336 1 1 1 1 41 GLU HA . 43 . HA 1 1 336 1 2 1 1 42 SER H . 44 . HN 1 1 337 1 1 1 1 41 GLU QB . 43 . HB# 1 1 337 1 2 1 1 42 SER H . 44 . HN 1 1 338 1 1 1 1 41 GLU QG . 43 . HG# 1 1 338 1 2 1 1 42 SER H . 44 . HN 1 1 339 1 1 1 1 42 SER H . 44 . HN 1 1 339 1 2 1 1 42 SER QB . 44 . HB# 1 1 340 1 1 1 1 42 SER H . 44 . HN 1 1 340 1 2 1 1 43 ASN H . 45 . HN 1 1 341 1 1 1 1 42 SER HA . 44 . HA 1 1 341 1 2 1 1 43 ASN H . 45 . HN 1 1 342 1 1 1 1 42 SER QB . 44 . HB# 1 1 342 1 2 1 1 46 LEU H . 48 . HN 1 1 343 1 1 1 1 43 ASN H . 45 . HN 1 1 343 1 2 1 1 43 ASN HA . 45 . HA 1 1 344 1 1 1 1 43 ASN H . 45 . HN 1 1 344 1 2 1 1 43 ASN HB3 . 45 . HB1 1 1 345 1 1 1 1 43 ASN H . 45 . HN 1 1 345 1 2 1 1 43 ASN HB2 . 45 . HB2 1 1 346 1 1 1 1 43 ASN H . 45 . HN 1 1 346 1 2 1 1 44 GLY H . 46 . HN 1 1 347 1 1 1 1 43 ASN HA . 45 . HA 1 1 347 1 2 1 1 44 GLY H . 46 . HN 1 1 348 1 1 1 1 44 GLY H . 46 . HN 1 1 348 1 2 1 1 45 THR H . 47 . HN 1 1 349 1 1 1 1 44 GLY H . 46 . HN 1 1 349 1 2 1 1 45 THR MG . 47 . HG2# 1 1 350 1 1 1 1 44 GLY QA . 46 . HA# 1 1 350 1 2 1 1 45 THR H . 47 . HN 1 1 351 1 1 1 1 44 GLY QA . 46 . HA# 1 1 351 1 2 1 1 46 LEU H . 48 . HN 1 1 352 1 1 1 1 45 THR H . 47 . HN 1 1 352 1 2 1 1 45 THR MG . 47 . HG2# 1 1 353 1 1 1 1 45 THR H . 47 . HN 1 1 353 1 2 1 1 46 LEU H . 48 . HN 1 1 354 1 1 1 1 45 THR H . 47 . HN 1 1 354 1 2 1 1 46 LEU QB . 48 . HB# 1 1 355 1 1 1 1 45 THR HA . 47 . HA 1 1 355 1 2 1 1 46 LEU H . 48 . HN 1 1 356 1 1 1 1 46 LEU H . 48 . HN 1 1 356 1 2 1 1 46 LEU QB . 48 . HB# 1 1 357 1 1 1 1 46 LEU H . 48 . HN 1 1 357 1 2 1 1 46 LEU MD1 . 48 . HD1* 1 1 358 1 1 1 1 46 LEU H . 48 . HN 1 1 358 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 359 1 1 1 1 46 LEU H . 48 . HN 1 1 359 1 2 1 1 47 THR H . 49 . HN 1 1 360 1 1 1 1 46 LEU HA . 48 . HA 1 1 360 1 2 1 1 47 THR H . 49 . HN 1 1 361 1 1 1 1 46 LEU MD1 . 48 . HD1* 1 1 361 1 2 1 1 47 THR H . 49 . HN 1 1 362 1 1 1 1 47 THR H . 49 . HN 1 1 362 1 2 1 1 47 THR MG . 49 . HG2# 1 1 363 1 1 1 1 47 THR HA . 49 . HA 1 1 363 1 2 1 1 47 THR HB . 49 . HB 1 1 364 1 1 1 1 47 THR HA . 49 . HA 1 1 364 1 2 1 1 48 LEU H . 50 . HN 1 1 365 1 1 1 1 47 THR HB . 49 . HB 1 1 365 1 2 1 1 48 LEU H . 50 . HN 1 1 366 1 1 1 1 47 THR MG . 49 . HG2# 1 1 366 1 2 1 1 48 LEU H . 50 . HN 1 1 367 1 1 1 1 48 LEU H . 50 . HN 1 1 367 1 2 1 1 48 LEU QB . 50 . HB# 1 1 368 1 1 1 1 48 LEU H . 50 . HN 1 1 368 1 2 1 1 48 LEU HG . 50 . HG 1 1 369 1 1 1 1 48 LEU H . 50 . HN 1 1 369 1 2 1 1 48 LEU QD . 50 . HD1* 1 1 370 1 1 1 1 48 LEU HA . 50 . HA 1 1 370 1 2 1 1 49 SER H . 51 . HN 1 1 371 1 1 1 1 48 LEU HG . 50 . HG 1 1 371 1 2 1 1 49 SER H . 51 . HN 1 1 372 1 1 1 1 48 LEU HG . 50 . HG 1 1 372 1 2 1 1 49 SER HA . 51 . HA 1 1 373 1 1 1 1 48 LEU HG . 50 . HG 1 1 373 1 2 1 1 50 HIS H . 52 . HN 1 1 374 1 1 1 1 48 LEU HG . 50 . HG 1 1 374 1 2 1 1 50 HIS HA . 52 . HA 1 1 375 1 1 1 1 48 LEU QD . 50 . HD1* 1 1 375 1 2 1 1 49 SER H . 51 . HN 1 1 376 1 1 1 1 48 LEU QD . 50 . HD1* 1 1 376 1 2 1 1 50 HIS H . 52 . HN 1 1 377 1 1 1 1 48 LEU QD . 50 . HD1* 1 1 377 1 2 1 1 50 HIS HA . 52 . HA 1 1 378 1 1 1 1 48 LEU QD . 50 . HD1* 1 1 378 1 2 1 1 51 PHE H . 53 . HN 1 1 379 1 1 1 1 48 LEU QD . 50 . HD2* 1 1 379 1 2 1 1 51 PHE QE . 53 . HE# 1 1 380 1 1 1 1 49 SER H . 51 . HN 1 1 380 1 2 1 1 49 SER QB . 51 . HB# 1 1 381 1 1 1 1 49 SER QB . 51 . HB# 1 1 381 1 2 1 1 50 HIS H . 52 . HN 1 1 382 1 1 1 1 50 HIS H . 52 . HN 1 1 382 1 2 1 1 50 HIS QB . 52 . HB# 1 1 383 1 1 1 1 50 HIS HA . 52 . HA 1 1 383 1 2 1 1 51 PHE H . 53 . HN 1 1 384 1 1 1 1 50 HIS QB . 52 . HB# 1 1 384 1 2 1 1 51 PHE H . 53 . HN 1 1 385 1 1 1 1 50 HIS HE1 . 52 . HE1 1 1 385 1 2 1 1 52 GLY H . 54 . HN 1 1 386 1 1 1 1 50 HIS HE1 . 52 . HE1 1 1 386 1 2 1 1 54 CYS QB . 56 . HB# 1 1 387 1 1 1 1 51 PHE H . 53 . HN 1 1 387 1 2 1 1 51 PHE QB . 53 . HB1 1 1 388 1 1 1 1 51 PHE HA . 53 . HA 1 1 388 1 2 1 1 51 PHE QD . 53 . HD# 1 1 389 1 1 1 1 51 PHE HA . 53 . HA 1 1 389 1 2 1 1 52 GLY H . 54 . HN 1 1 390 1 1 1 1 51 PHE QB . 53 . HB1 1 1 390 1 2 1 1 52 GLY H . 54 . HN 1 1 391 1 1 1 1 52 GLY QA . 54 . HA# 1 1 391 1 2 1 1 53 LYS H . 55 . HN 1 1 392 1 1 1 1 53 LYS H . 55 . HN 1 1 392 1 2 1 1 53 LYS QB . 55 . HB# 1 1 393 1 1 1 1 53 LYS H . 55 . HN 1 1 393 1 2 1 1 53 LYS QG . 55 . HG# 1 1 394 1 1 1 1 53 LYS HA . 55 . HA 1 1 394 1 2 1 1 54 CYS H . 56 . HN 1 1 395 1 1 1 1 53 LYS QB . 55 . HB# 1 1 395 1 2 1 1 54 CYS H . 56 . HN 1 1 396 1 1 1 1 53 LYS QG . 55 . HG# 1 1 396 1 2 1 1 54 CYS H . 56 . HN 1 1 397 1 1 1 1 53 LYS QG . 55 . HG# 1 1 397 1 2 1 1 54 CYS QB . 56 . HB# 1 1 398 1 1 1 1 50 HIS H . 52 . HN 1 1 398 1 2 1 1 51 PHE H . 53 . HN 1 1 399 1 1 1 1 25 ASP H . 27 . HN 1 1 399 1 2 1 1 46 LEU HG . 48 . HG 1 1 400 1 1 1 1 22 CYS QB . 24 . HB# 1 1 400 1 2 1 1 49 SER H . 51 . HN 1 1 401 1 1 1 1 42 SER QB . 44 . HB# 1 1 401 1 2 1 1 43 ASN H . 45 . HN 1 1 402 1 1 1 1 19 ARG H . 21 . HN 1 1 402 1 2 1 1 29 TYR H . 31 . HN 1 1 403 1 1 1 1 36 CYS H . 38 . HN 1 1 403 1 2 1 1 39 VAL H . 41 . HN 1 1 404 1 1 1 1 19 ARG QB . 21 . HB# 1 1 404 1 2 1 1 22 CYS QB . 24 . HB# 1 1 405 1 1 1 1 19 ARG QB . 21 . HB1 1 1 405 1 2 1 1 48 LEU HA . 50 . HA 1 1 406 1 1 1 1 19 ARG QD . 21 . HD1* 1 1 406 1 2 1 1 32 LYS QB . 34 . HB# 1 1 407 1 1 1 1 19 ARG QD . 21 . HD2* 1 1 407 1 2 1 1 32 LYS HB2 . 34 . HB2 1 1 408 1 1 1 1 22 CYS HA . 24 . HA 1 1 408 1 2 1 1 28 THR HA . 30 . HA 1 1 409 1 1 1 1 23 GLY H . 25 . HN 1 1 409 1 2 1 1 28 THR HA . 30 . HA 1 1 410 1 1 1 1 23 GLY H . 25 . HN 1 1 410 1 2 1 1 29 TYR QB . 31 . HB# 1 1 411 1 1 1 1 24 SER H . 26 . HN 1 1 411 1 2 1 1 47 THR HA . 49 . HA 1 1 412 1 1 1 1 24 SER H . 26 . HN 1 1 412 1 2 1 1 49 SER HA . 51 . HA 1 1 413 1 1 1 1 24 SER QB . 26 . HB# 1 1 413 1 2 1 1 46 LEU HG . 48 . HG 1 1 414 1 1 1 1 28 THR HA . 30 . HA 1 1 414 1 2 1 1 29 TYR H . 31 . HN 1 1 415 1 1 1 1 28 THR MG . 30 . HG2# 1 1 415 1 2 1 1 54 CYS H . 56 . HN 1 1 416 1 1 1 1 31 ASN H . 33 . HN 1 1 416 1 2 1 1 32 LYS H . 34 . HN 1 1 417 1 1 1 1 31 ASN HA . 33 . HA 1 1 417 1 2 1 1 34 ASN H . 36 . HN 1 1 418 1 1 1 1 33 CYS HA . 35 . HA 1 1 418 1 2 1 1 36 CYS H . 38 . HN 1 1 419 1 1 1 1 34 ASN HA . 36 . HA 1 1 419 1 2 1 1 38 ALA H . 40 . HN 1 1 420 1 1 1 1 38 ALA HA . 40 . HA 1 1 420 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 421 1 1 1 1 38 ALA MB . 40 . HB# 1 1 421 1 2 1 1 39 VAL MG2 . 41 . HG2* 1 1 422 1 1 1 1 39 VAL HB . 41 . HB 1 1 422 1 2 1 1 40 VAL MG1 . 42 . HG1* 1 1 423 1 1 1 1 39 VAL HB . 41 . HB 1 1 423 1 2 1 1 40 VAL MG2 . 42 . HG2* 1 1 424 1 1 1 1 40 VAL MG1 . 42 . HG1* 1 1 424 1 2 1 1 41 GLU QB . 43 . HB# 1 1 425 1 1 1 1 40 VAL MG2 . 42 . HG2* 1 1 425 1 2 1 1 41 GLU QB . 43 . HB# 1 1 426 1 1 1 1 42 SER QB . 44 . HB# 1 1 426 1 2 1 1 46 LEU QB . 48 . HB# 1 1 427 1 1 1 1 42 SER HB3 . 44 . HB1 1 1 427 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 428 1 1 1 1 46 LEU HG . 48 . HG 1 1 428 1 2 1 1 47 THR HA . 49 . HA 1 1 429 1 1 1 1 46 LEU HG . 48 . HG 1 1 429 1 2 1 1 48 LEU HA . 50 . HA 1 1 430 1 1 1 1 48 LEU QB . 50 . HB# 1 1 430 1 2 1 1 49 SER H . 51 . HN 1 1 431 1 1 1 1 48 LEU QB . 50 . HB# 1 1 431 1 2 1 1 49 SER HA . 51 . HA 1 1 432 1 1 1 1 48 LEU HG . 50 . HG 1 1 432 1 2 1 1 51 PHE H . 53 . HN 1 1 433 1 1 1 1 49 SER H . 51 . HN 1 1 433 1 2 1 1 50 HIS H . 52 . HN 1 1 434 1 1 1 1 11 LYS QG . 13 . HG# 1 1 434 1 2 1 1 37 CYS QB . 39 . HB# 1 1 435 1 1 1 1 35 PHE H . 37 . HN 1 1 435 1 2 1 1 37 CYS H . 39 . HN 1 1 436 1 1 1 1 36 CYS H . 38 . HN 1 1 436 1 2 1 1 37 CYS H . 39 . HN 1 1 437 1 1 1 1 34 ASN HA . 36 . HA 1 1 437 1 2 1 1 37 CYS H . 39 . HN 1 1 438 1 1 1 1 35 PHE HA . 37 . HA 1 1 438 1 2 1 1 37 CYS H . 39 . HN 1 1 439 1 1 1 1 36 CYS HA . 38 . HA 1 1 439 1 2 1 1 37 CYS H . 39 . HN 1 1 440 1 1 1 1 36 CYS QB . 38 . HB# 1 1 440 1 2 1 1 37 CYS H . 39 . HN 1 1 441 1 1 1 1 37 CYS H . 39 . HN 1 1 441 1 2 1 1 37 CYS QB . 39 . HB# 1 1 442 1 1 1 1 37 CYS H . 39 . HN 1 1 442 1 2 1 1 38 ALA H . 40 . HN 1 1 443 1 1 1 1 37 CYS H . 39 . HN 1 1 443 1 2 1 1 38 ALA MB . 40 . HB# 1 1 444 1 1 1 1 37 CYS H . 39 . HN 1 1 444 1 2 1 1 39 VAL QG . 41 . HG* 1 1 445 1 1 1 1 37 CYS HA . 39 . HA 1 1 445 1 2 1 1 40 VAL HB . 42 . HB 1 1 446 1 1 1 1 37 CYS HA . 39 . HA 1 1 446 1 2 1 1 40 VAL QG . 42 . HG* 1 1 447 1 1 1 1 37 CYS HA . 39 . HA 1 1 447 1 2 1 1 38 ALA H . 40 . HN 1 1 448 1 1 1 1 37 CYS HA . 39 . HA 1 1 448 1 2 1 1 40 VAL H . 42 . HN 1 1 449 1 1 1 1 19 ARG QB . 21 . HB# 1 1 449 1 2 1 1 48 LEU QD . 50 . HD* 1 1 450 1 1 1 1 19 ARG QD . 21 . HD2* 1 1 450 1 2 1 1 51 PHE QB . 53 . HB1 1 1 451 1 1 1 1 22 CYS HA . 24 . HA 1 1 451 1 2 1 1 29 TYR QD . 31 . HD* 1 1 452 1 1 1 1 23 GLY H . 25 . HN 1 1 452 1 2 1 1 29 TYR QD . 31 . HD* 1 1 453 1 1 1 1 24 SER H . 26 . HN 1 1 453 1 2 1 1 46 LEU HG . 48 . HG 1 1 454 1 1 1 1 24 SER H . 26 . HN 1 1 454 1 2 1 1 35 PHE QD . 37 . HD* 1 1 455 1 1 1 1 25 ASP H . 27 . HN 1 1 455 1 2 1 1 27 LYS QB . 29 . HB# 1 1 456 1 1 1 1 26 ASN QB . 28 . HB# 1 1 456 1 2 1 1 27 LYS H . 29 . HN 1 1 457 1 1 1 1 28 THR MG . 30 . HG2# 1 1 457 1 2 1 1 54 CYS QB . 56 . HB# 1 1 458 1 1 1 1 28 THR HG1 . 30 . HG1 1 1 458 1 2 1 1 54 CYS QB . 56 . HB# 1 1 459 1 1 1 1 29 TYR HD2 . 31 . HD2 1 1 459 1 2 1 1 34 ASN QB . 36 . HB# 1 1 460 1 1 1 1 29 TYR QE . 31 . HE* 1 1 460 1 2 1 1 35 PHE QE . 37 . HE* 1 1 461 1 1 1 1 29 TYR QE . 31 . HE* 1 1 461 1 2 1 1 46 LEU QD . 48 . HD* 1 1 462 1 1 1 1 31 ASN QD . 33 . HD2# 1 1 462 1 2 1 1 33 CYS QB . 35 . HB# 1 1 463 1 1 1 1 31 ASN QD . 33 . HD2# 1 1 463 1 2 1 1 34 ASN QD . 36 . HD2# 1 1 464 1 1 1 1 31 ASN HA . 33 . HA 1 1 464 1 2 1 1 33 CYS H . 35 . HN 1 1 465 1 1 1 1 31 ASN QB . 33 . HB# 1 1 465 1 2 1 1 33 CYS H . 35 . HN 1 1 466 1 1 1 1 32 LYS HA . 34 . HA 1 1 466 1 2 1 1 35 PHE QB . 37 . HB1 1 1 467 1 1 1 1 32 LYS HA . 34 . HA 1 1 467 1 2 1 1 34 ASN H . 36 . HN 1 1 468 1 1 1 1 32 LYS QB . 34 . HB# 1 1 468 1 2 1 1 33 CYS H . 35 . HN 1 1 469 1 1 1 1 32 LYS QG . 34 . HG# 1 1 469 1 2 1 1 33 CYS H . 35 . HN 1 1 470 1 1 1 1 32 LYS QD . 34 . HD# 1 1 470 1 2 1 1 33 CYS H . 35 . HN 1 1 471 1 1 1 1 32 LYS QG . 34 . HG# 1 1 471 1 2 1 1 36 CYS H . 38 . HN 1 1 472 1 1 1 1 33 CYS HA . 35 . HA 1 1 472 1 2 1 1 34 ASN H . 36 . HN 1 1 473 1 1 1 1 34 ASN H . 36 . HN 1 1 473 1 2 1 1 35 PHE H . 37 . HN 1 1 474 1 1 1 1 34 ASN HA . 36 . HA 1 1 474 1 2 1 1 35 PHE H . 37 . HN 1 1 475 1 1 1 1 34 ASN QB . 36 . HB# 1 1 475 1 2 1 1 35 PHE H . 37 . HN 1 1 476 1 1 1 1 35 PHE QD . 37 . HD* 1 1 476 1 2 1 1 39 VAL MG1 . 41 . HG1* 1 1 477 1 1 1 1 35 PHE QD . 37 . HD* 1 1 477 1 2 1 1 39 VAL MG2 . 41 . HG2* 1 1 478 1 1 1 1 35 PHE QE . 37 . HE* 1 1 478 1 2 1 1 39 VAL MG2 . 41 . HG2* 1 1 479 1 1 1 1 35 PHE QD . 37 . HD* 1 1 479 1 2 1 1 46 LEU HG . 48 . HG 1 1 480 1 1 1 1 35 PHE QE . 37 . HE* 1 1 480 1 2 1 1 46 LEU HG . 48 . HG 1 1 481 1 1 1 1 35 PHE QD . 37 . HD2 1 1 481 1 2 1 1 46 LEU MD1 . 48 . HD1* 1 1 482 1 1 1 1 35 PHE QD . 37 . HD2 1 1 482 1 2 1 1 46 LEU MD2 . 48 . HD2* 1 1 483 1 1 1 1 39 VAL HA . 41 . HA 1 1 483 1 2 1 1 46 LEU QB . 48 . HB# 1 1 484 1 1 1 1 39 VAL HA . 41 . HA 1 1 484 1 2 1 1 41 GLU H . 43 . HN 1 1 485 1 1 1 1 40 VAL MG1 . 42 . HG1* 1 1 485 1 2 1 1 41 GLU HA . 43 . HA 1 1 486 1 1 1 1 42 SER QB . 44 . HB# 1 1 486 1 2 1 1 45 THR H . 47 . HN 1 1 487 1 1 1 1 43 ASN H . 45 . HN 1 1 487 1 2 1 1 45 THR H . 47 . HN 1 1 488 1 1 1 1 43 ASN QB . 45 . HB# 1 1 488 1 2 1 1 44 GLY H . 46 . HN 1 1 489 1 1 1 1 45 THR H . 47 . HN 1 1 489 1 2 1 1 45 THR HB . 47 . HB# 1 1 490 1 1 1 1 46 LEU QD . 48 . HD* 1 1 490 1 2 1 1 47 THR HA . 49 . HA 1 1 491 1 1 1 1 46 LEU QD . 48 . HD* 1 1 491 1 2 1 1 48 LEU HA . 50 . HA 1 1 492 1 1 1 1 46 LEU HG . 48 . HG 1 1 492 1 2 1 1 47 THR H . 49 . HN 1 1 493 1 1 1 1 46 LEU QB . 48 . HB# 1 1 493 1 2 1 1 47 THR H . 49 . HN 1 1 494 1 1 1 1 24 SER QB . 26 . HB# 1 1 494 1 2 1 1 47 THR H . 49 . HN 1 1 495 1 1 1 1 51 PHE H . 53 . HN 1 1 495 1 2 1 1 52 GLY H . 54 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.0 1.8 7.4 1 1 2 1 . . . . . 3.0 1.8 6.4 1 1 3 1 . . . . . 5.0 1.8 5.0 1 1 4 1 . . . . . 4.0 1.8 5.0 1 1 5 1 . . . . . 3.5 1.8 6.9 1 1 6 1 . . . . . 2.8 1.8 3.8 1 1 7 1 . . . . . 4.5 1.8 5.5 1 1 8 1 . . . . . 5.0 1.8 6.0 1 1 9 1 . . . . . 2.0 1.8 6.0 1 1 10 1 . . . . . 2.0 1.8 6.0 1 1 11 1 . . . . . 2.0 1.8 7.5 1 1 12 1 . . . . . 2.0 1.8 7.5 1 1 13 1 . . . . . 2.0 1.8 9.0 1 1 14 1 . . . . . 2.0 1.8 10.0 1 1 15 1 . . . . . 2.0 1.8 3.0 1 1 16 1 . . . . . 2.0 1.8 5.5 1 1 17 1 . . . . . 2.0 1.8 4.5 1 1 18 1 . . . . . 2.0 1.8 9.0 1 1 19 1 . . . . . 2.0 1.8 3.0 1 1 20 1 . . . . . 2.0 1.8 4.5 1 1 21 1 . . . . . 2.0 1.8 3.5 1 1 22 1 . . . . . 2.0 1.8 5.0 1 1 23 1 . . . . . 2.0 1.8 6.0 1 1 24 1 . . . . . 2.0 1.8 7.5 1 1 25 1 . . . . . 2.0 1.8 9.0 1 1 26 1 . . . . . 2.0 1.8 5.5 1 1 27 1 . . . . . 2.0 1.8 5.0 1 1 28 1 . . . . . 2.0 1.8 9.0 1 1 29 1 . . . . . 2.0 1.8 9.0 1 1 30 1 . . . . . 2.0 1.8 9.0 1 1 31 1 . . . . . 2.0 1.8 9.0 1 1 32 1 . . . . . 2.0 1.8 9.0 1 1 33 1 . . . . . 2.0 1.8 2.5 1 1 34 1 . . . . . 2.0 1.8 5.0 1 1 35 1 . . . . . 2.0 1.8 4.5 1 1 36 1 . . . . . 2.0 1.8 5.0 1 1 37 1 . . . . . 2.0 1.8 7.5 1 1 38 1 . . . . . 2.0 1.8 2.5 1 1 39 1 . . . . . 2.0 1.8 4.5 1 1 40 1 . . . . . 2.0 1.8 3.0 1 1 41 1 . . . . . 2.0 1.8 5.5 1 1 42 1 . . . . . 2.0 1.8 6.5 1 1 43 1 . . . . . 2.0 1.8 6.5 1 1 44 1 . . . . . 2.0 1.8 7.0 1 1 45 1 . . . . . 2.0 1.8 7.0 1 1 46 1 . . . . . 2.0 1.8 6.5 1 1 47 1 . . . . . 2.0 1.8 3.0 1 1 48 1 . . . . . 2.0 1.8 5.5 1 1 49 1 . . . . . 2.0 1.8 4.5 1 1 50 1 . . . . . 2.0 1.8 4.0 1 1 51 1 . . . . . 2.0 1.8 5.0 1 1 52 1 . . . . . 2.0 1.8 3.0 1 1 53 1 . . . . . 2.0 1.8 4.5 1 1 54 1 . . . . . 2.0 1.8 4.5 1 1 55 1 . . . . . 2.0 1.8 6.5 1 1 56 1 . . . . . 2.0 1.8 3.0 1 1 57 1 . . . . . 2.0 1.8 8.0 1 1 58 1 . . . . . 2.0 1.8 3.0 1 1 59 1 . . . . . 2.0 1.8 5.5 1 1 60 1 . . . . . 2.0 1.8 3.5 1 1 61 1 . . . . . 2.0 1.8 6.5 1 1 62 1 . . . . . 2.0 1.8 6.5 1 1 63 1 . . . . . 2.0 1.8 5.5 1 1 64 1 . . . . . 2.0 1.8 5.0 1 1 65 1 . . . . . 2.0 1.8 6.5 1 1 66 1 . . . . . 2.0 1.8 7.5 1 1 67 1 . . . . . 2.0 1.8 7.0 1 1 68 1 . . . . . 2.0 1.8 7.5 1 1 69 1 . . . . . 2.0 1.8 7.0 1 1 70 1 . . . . . 2.0 1.8 6.9 1 1 71 1 . . . . . 2.0 1.8 7.7 1 1 72 1 . . . . . 2.0 1.8 5.5 1 1 73 1 . . . . . 2.0 1.8 3.5 1 1 74 1 . . . . . 2.0 1.8 2.5 1 1 75 1 . . . . . 2.0 1.8 4.5 1 1 76 1 . . . . . 2.0 1.8 4.5 1 1 77 1 . . . . . 2.0 1.8 3.0 1 1 78 1 . . . . . 2.0 1.8 3.0 1 1 79 1 . . . . . 2.0 1.8 4.5 1 1 80 1 . . . . . 2.0 1.8 3.5 1 1 81 1 . . . . . 2.0 1.8 4.5 1 1 82 1 . . . . . 2.0 1.8 4.0 1 1 83 1 . . . . . 2.0 1.8 2.8 1 1 84 1 . . . . . 2.0 1.8 5.0 1 1 85 1 . . . . . 2.0 1.8 5.0 1 1 86 1 . . . . . 2.0 1.8 5.0 1 1 87 1 . . . . . 2.0 1.8 5.0 1 1 88 1 . . . . . 2.0 1.8 6.0 1 1 89 1 . . . . . 2.0 1.8 2.5 1 1 90 1 . . . . . 2.0 1.8 2.8 1 1 91 1 . . . . . 2.0 1.8 4.0 1 1 92 1 . . . . . 2.0 1.8 4.0 1 1 93 1 . . . . . 2.0 1.8 6.5 1 1 94 1 . . . . . 2.0 1.8 6.5 1 1 95 1 . . . . . 2.0 1.8 7.0 1 1 96 1 . . . . . 2.0 1.8 4.5 1 1 97 1 . . . . . 2.0 1.8 6.5 1 1 98 1 . . . . . 2.0 1.8 3.0 1 1 99 1 . . . . . 2.0 1.8 6.5 1 1 100 1 . . . . . 2.0 1.8 3.5 1 1 101 1 . . . . . 2.0 1.8 4.5 1 1 102 1 . . . . . 2.0 1.8 4.5 1 1 103 1 . . . . . 2.0 1.8 5.5 1 1 104 1 . . . . . 2.0 1.8 8.0 1 1 105 1 . . . . . 2.0 1.8 8.0 1 1 106 1 . . . . . 2.0 1.8 8.0 1 1 107 1 . . . . . 2.0 1.8 2.5 1 1 108 1 . . . . . 2.0 1.8 4.5 1 1 109 1 . . . . . 2.0 1.8 5.5 1 1 110 1 . . . . . 2.0 1.8 3.0 1 1 111 1 . . . . . 2.0 1.8 3.5 1 1 112 1 . . . . . 2.0 1.8 9.0 1 1 113 1 . . . . . 2.0 1.8 7.5 1 1 114 1 . . . . . 2.0 1.8 5.0 1 1 115 1 . . . . . 2.0 1.8 6.5 1 1 116 1 . . . . . 2.0 1.8 6.5 1 1 117 1 . . . . . 2.0 1.8 6.5 1 1 118 1 . . . . . 2.0 1.8 6.5 1 1 119 1 . . . . . 2.0 1.8 9.0 1 1 120 1 . . . . . 2.0 1.8 9.0 1 1 121 1 . . . . . 2.0 1.8 2.5 1 1 122 1 . . . . . 2.0 1.8 4.0 1 1 123 1 . . . . . 2.0 1.8 5.0 1 1 124 1 . . . . . 2.0 1.8 6.5 1 1 125 1 . . . . . 2.0 1.8 5.5 1 1 126 1 . . . . . 2.0 1.8 4.0 1 1 127 1 . . . . . 2.0 1.8 6.5 1 1 128 1 . . . . . 2.0 1.8 6.5 1 1 129 1 . . . . . 2.0 1.8 5.0 1 1 130 1 . . . . . 2.0 1.8 6.5 1 1 131 1 . . . . . 2.0 1.8 6.5 1 1 132 1 . . . . . 2.0 1.8 6.5 1 1 133 1 . . . . . 2.0 1.8 6.5 1 1 134 1 . . . . . 2.0 1.8 5.5 1 1 135 1 . . . . . 2.0 1.8 9.0 1 1 136 1 . . . . . 2.0 1.8 5.5 1 1 137 1 . . . . . 2.0 1.8 6.5 1 1 138 1 . . . . . 2.0 1.8 8.0 1 1 139 1 . . . . . 2.0 1.8 6.5 1 1 140 1 . . . . . 2.0 1.8 8.0 1 1 141 1 . . . . . 2.0 1.8 6.5 1 1 142 1 . . . . . 2.8 1.8 2.8 1 1 143 1 . . . . . 4.0 1.8 6.4 1 1 144 1 . . . . . 5.0 1.8 5.0 1 1 145 1 . . . . . 2.5 1.8 2.5 1 1 146 1 . . . . . 5.0 1.8 7.4 1 1 147 1 . . . . . 3.5 1.8 3.5 1 1 148 1 . . . . . 3.5 1.8 4.5 1 1 149 1 . . . . . 5.0 1.8 6.0 1 1 150 1 . . . . . 5.0 1.8 6.0 1 1 151 1 . . . . . 3.5 1.8 6.9 1 1 152 1 . . . . . 5.0 1.8 6.0 1 1 153 1 . . . . . 5.5 1.8 7.9 1 1 154 1 . . . . . 5.5 1.8 7.9 1 1 155 1 . . . . . 5.0 1.8 7.4 1 1 156 1 . . . . . 3.5 1.8 5.9 1 1 157 1 . . . . . 4.0 1.8 6.4 1 1 158 1 . . . . . 3.0 1.8 6.4 1 1 159 1 . . . . . 5.5 1.8 7.9 1 1 160 1 . . . . . 3.5 1.8 8.3 1 1 161 1 . . . . . 5.0 1.8 5.4 1 1 162 1 . . . . . 5.0 1.8 7.4 1 1 163 1 . . . . . 4.5 1.8 6.9 1 1 164 1 . . . . . 2.8 1.8 3.8 1 1 165 1 . . . . . 5.0 1.8 5.0 1 1 166 1 . . . . . 5.0 1.8 7.4 1 1 167 1 . . . . . 2.5 1.8 2.5 1 1 168 1 . . . . . 5.0 1.8 5.0 1 1 169 1 . . . . . 5.0 1.8 6.0 1 1 170 1 . . . . . 3.5 1.8 4.5 1 1 171 1 . . . . . 3.5 1.8 4.5 1 1 172 1 . . . . . 4.0 1.8 5.0 1 1 173 1 . . . . . 3.5 1.8 4.5 1 1 174 1 . . . . . 3.5 1.8 3.5 1 1 175 1 . . . . . 5.0 1.8 5.0 1 1 176 1 . . . . . 4.0 1.8 4.0 1 1 177 1 . . . . . 3.5 1.8 4.5 1 1 178 1 . . . . . 3.0 1.8 4.0 1 1 179 1 . . . . . 3.0 1.8 6.4 1 1 180 1 . . . . . 5.0 1.8 7.0 1 1 181 1 . . . . . 4.5 1.8 7.9 1 1 182 1 . . . . . 3.5 1.8 4.5 1 1 183 1 . . . . . 2.8 1.8 2.8 1 1 184 1 . . . . . 3.5 1.8 3.5 1 1 185 1 . . . . . 5.0 1.8 7.4 1 1 186 1 . . . . . 5.0 1.8 7.4 1 1 187 1 . . . . . 3.5 1.8 3.5 1 1 188 1 . . . . . 3.5 1.8 3.5 1 1 189 1 . . . . . 5.5 1.8 6.7 1 1 190 1 . . . . . 5.0 1.8 6.0 1 1 191 1 . . . . . 4.0 1.8 4.0 1 1 192 1 . . . . . 3.5 1.8 3.5 1 1 193 1 . . . . . 3.0 1.8 4.0 1 1 194 1 . . . . . 2.8 1.8 2.8 1 1 195 1 . . . . . 4.0 1.8 4.0 1 1 196 1 . . . . . 2.8 1.8 2.8 1 1 197 1 . . . . . 5.0 1.8 5.0 1 1 198 1 . . . . . 4.0 1.8 6.4 1 1 199 1 . . . . . 4.5 1.8 4.5 1 1 200 1 . . . . . 4.5 1.8 4.5 1 1 201 1 . . . . . 5.0 1.8 5.0 1 1 202 1 . . . . . 5.0 1.8 5.0 1 1 203 1 . . . . . 5.0 1.8 5.0 1 1 204 1 . . . . . 2.5 0.8 2.5 1 1 205 1 . . . . . 4.0 1.8 4.0 1 1 206 1 . . . . . 4.0 1.8 4.0 1 1 207 1 . . . . . 2.8 1.8 2.8 1 1 208 1 . . . . . 3.5 1.8 4.5 1 1 209 1 . . . . . 3.5 1.8 4.5 1 1 210 1 . . . . . 5.0 1.8 6.0 1 1 211 1 . . . . . 2.5 1.8 2.5 1 1 212 1 . . . . . 4.0 1.8 5.0 1 1 213 1 . . . . . 5.0 1.8 6.0 1 1 214 1 . . . . . 3.5 1.8 4.5 1 1 215 1 . . . . . 3.5 1.8 3.5 1 1 216 1 . . . . . 4.0 1.8 5.0 1 1 217 1 . . . . . 5.0 1.8 5.0 1 1 218 1 . . . . . 5.0 1.8 5.0 1 1 219 1 . . . . . 4.0 1.8 5.0 1 1 220 1 . . . . . 5.5 1.8 6.5 1 1 221 1 . . . . . 5.5 1.8 6.5 1 1 222 1 . . . . . 3.5 1.8 3.5 1 1 223 1 . . . . . 4.0 1.8 6.4 1 1 224 1 . . . . . 5.0 1.8 5.0 1 1 225 1 . . . . . 2.8 1.8 2.8 1 1 226 1 . . . . . 4.0 1.8 4.0 1 1 227 1 . . . . . 5.0 1.8 5.0 1 1 228 1 . . . . . 5.0 1.8 7.4 1 1 229 1 . . . . . 4.0 1.8 6.4 1 1 230 1 . . . . . 3.5 1.8 3.5 1 1 231 1 . . . . . 4.0 1.8 4.0 1 1 232 1 . . . . . 3.5 1.8 3.5 1 1 233 1 . . . . . 3.5 1.8 4.5 1 1 234 1 . . . . . 4.0 1.8 4.0 1 1 235 1 . . . . . 5.0 1.8 5.0 1 1 236 1 . . . . . 2.8 1.8 2.8 1 1 237 1 . . . . . 3.5 1.8 3.5 1 1 238 1 . . . . . 5.0 1.8 6.0 1 1 239 1 . . . . . 2.8 1.8 2.8 1 1 240 1 . . . . . 5.0 1.8 5.0 1 1 241 1 . . . . . 4.0 1.8 4.0 1 1 242 1 . . . . . 3.5 1.8 3.5 1 1 243 1 . . . . . 3.5 1.8 5.9 1 1 244 1 . . . . . 4.0 1.8 4.0 1 1 245 1 . . . . . 2.5 1.8 2.5 1 1 246 1 . . . . . 2.8 1.8 2.8 1 1 247 1 . . . . . 2.5 1.8 2.5 1 1 248 1 . . . . . 2.8 1.8 2.8 1 1 249 1 . . . . . 4.0 1.8 4.0 1 1 250 1 . . . . . 3.0 1.8 3.0 1 1 251 1 . . . . . 3.0 1.8 3.0 1 1 252 1 . . . . . 3.5 1.8 4.5 1 1 253 1 . . . . . 2.8 1.8 2.8 1 1 254 1 . . . . . 4.0 1.8 6.4 1 1 255 1 . . . . . 2.5 1.8 2.5 1 1 256 1 . . . . . 5.0 1.8 5.0 1 1 257 1 . . . . . 2.8 1.8 5.2 1 1 258 1 . . . . . 4.0 1.8 4.0 1 1 259 1 . . . . . 5.0 1.8 5.0 1 1 260 1 . . . . . 4.0 1.8 5.0 1 1 261 1 . . . . . 4.3 1.8 4.3 1 1 262 1 . . . . . 5.0 1.8 7.4 1 1 263 1 . . . . . 2.8 1.8 5.2 1 1 264 1 . . . . . 2.8 1.8 2.8 1 1 265 1 . . . . . 5.0 1.8 5.0 1 1 266 1 . . . . . 3.5 1.8 5.9 1 1 267 1 . . . . . 3.5 1.8 5.9 1 1 268 1 . . . . . 5.0 1.8 7.4 1 1 269 1 . . . . . 5.0 1.8 7.4 1 1 270 1 . . . . . 5.0 1.8 7.4 1 1 271 1 . . . . . 5.0 1.8 7.4 1 1 272 1 . . . . . 3.0 1.8 5.4 1 1 273 1 . . . . . 3.5 1.8 5.9 1 1 274 1 . . . . . 3.5 1.8 5.9 1 1 275 1 . . . . . 3.5 1.8 6.9 1 1 276 1 . . . . . 3.0 1.8 6.4 1 1 277 1 . . . . . 5.0 1.8 7.4 1 1 278 1 . . . . . 5.0 1.8 8.4 1 1 279 1 . . . . . 5.0 1.8 7.4 1 1 280 1 . . . . . 4.0 1.8 4.0 1 1 281 1 . . . . . 2.8 1.8 2.8 1 1 282 1 . . . . . 5.0 1.8 5.0 1 1 283 1 . . . . . 5.0 1.8 5.0 1 1 284 1 . . . . . 5.0 2.8 7.4 1 1 285 1 . . . . . 5.0 1.8 5.0 1 1 286 1 . . . . . 3.5 1.8 3.5 1 1 287 1 . . . . . 5.0 1.8 5.0 1 1 288 1 . . . . . 4.0 1.8 6.4 1 1 289 1 . . . . . 4.0 1.8 6.4 1 1 290 1 . . . . . 3.3 1.8 4.3 1 1 291 1 . . . . . 2.5 1.8 2.5 1 1 292 1 . . . . . 5.0 1.8 7.4 1 1 293 1 . . . . . 3.5 1.8 3.5 1 1 294 1 . . . . . 3.5 1.8 3.5 1 1 295 1 . . . . . 3.5 1.8 4.5 1 1 296 1 . . . . . 3.3 1.8 4.3 1 1 297 1 . . . . . 4.5 1.8 5.5 1 1 298 1 . . . . . 5.0 1.8 8.4 1 1 299 1 . . . . . 5.0 1.8 7.4 1 1 300 1 . . . . . 2.8 1.8 2.8 1 1 301 1 . . . . . 4.0 1.8 6.4 1 1 302 1 . . . . . 2.5 1.8 2.5 1 1 303 1 . . . . . 5.0 1.8 5.0 1 1 304 1 . . . . . 4.0 1.8 6.4 1 1 305 1 . . . . . 5.0 1.8 6.0 1 1 306 1 . . . . . 5.0 1.8 6.0 1 1 307 1 . . . . . 3.0 1.8 5.4 1 1 308 1 . . . . . 3.5 1.8 3.5 1 1 309 1 . . . . . 4.0 1.8 4.0 1 1 310 1 . . . . . 4.0 1.8 4.0 1 1 311 1 . . . . . 5.0 1.8 7.4 1 1 312 1 . . . . . 2.8 1.8 2.8 1 1 313 1 . . . . . 4.0 1.8 6.4 1 1 314 1 . . . . . 5.0 1.8 7.4 1 1 315 1 . . . . . 5.0 1.8 7.4 1 1 316 1 . . . . . 5.0 1.8 7.4 1 1 317 1 . . . . . 4.0 1.8 7.4 1 1 318 1 . . . . . 5.0 1.8 7.4 1 1 319 1 . . . . . 5.0 1.8 7.4 1 1 320 1 . . . . . 5.0 1.8 7.4 1 1 321 1 . . . . . 4.0 1.8 7.4 1 1 322 1 . . . . . 4.0 1.8 7.4 1 1 323 1 . . . . . 4.0 1.8 6.4 1 1 324 1 . . . . . 5.0 1.8 9.8 1 1 325 1 . . . . . 2.8 1.8 2.8 1 1 326 1 . . . . . 5.0 1.8 6.0 1 1 327 1 . . . . . 4.0 1.8 4.0 1 1 328 1 . . . . . 5.0 1.8 5.0 1 1 329 1 . . . . . 4.0 1.8 4.0 1 1 330 1 . . . . . 5.0 1.8 5.0 1 1 331 1 . . . . . 3.0 1.8 4.0 1 1 332 1 . . . . . 4.0 1.8 6.4 1 1 333 1 . . . . . 4.0 1.8 6.4 1 1 334 1 . . . . . 2.8 1.8 3.8 1 1 335 1 . . . . . 3.5 1.8 4.5 1 1 336 1 . . . . . 5.0 1.8 5.0 1 1 337 1 . . . . . 5.0 1.8 6.0 1 1 338 1 . . . . . 5.0 1.8 6.0 1 1 339 1 . . . . . 2.8 1.8 3.8 1 1 340 1 . . . . . 3.5 1.8 3.5 1 1 341 1 . . . . . 5.0 1.8 5.0 1 1 342 1 . . . . . 4.0 1.8 5.0 1 1 343 1 . . . . . 2.5 1.8 2.5 1 1 344 1 . . . . . 4.0 1.8 4.0 1 1 345 1 . . . . . 3.5 1.8 3.5 1 1 346 1 . . . . . 3.5 1.8 3.5 1 1 347 1 . . . . . 3.5 1.8 3.5 1 1 348 1 . . . . . 2.8 1.8 2.8 1 1 349 1 . . . . . 5.5 1.8 6.5 1 1 350 1 . . . . . 5.0 1.8 6.0 1 1 351 1 . . . . . 5.0 1.8 6.0 1 1 352 1 . . . . . 3.3 1.8 4.3 1 1 353 1 . . . . . 3.5 1.8 3.5 1 1 354 1 . . . . . 5.0 1.8 6.0 1 1 355 1 . . . . . 3.5 1.8 3.5 1 1 356 1 . . . . . 2.8 1.8 3.8 1 1 357 1 . . . . . 5.0 1.8 7.4 1 1 358 1 . . . . . 5.0 1.8 7.4 1 1 359 1 . . . . . 5.0 1.8 6.0 1 1 360 1 . . . . . 2.8 1.8 2.8 1 1 361 1 . . . . . 5.0 1.8 7.4 1 1 362 1 . . . . . 4.0 1.8 5.0 1 1 363 1 . . . . . 2.5 1.8 2.5 1 1 364 1 . . . . . 2.8 1.8 2.8 1 1 365 1 . . . . . 2.8 1.8 2.8 1 1 366 1 . . . . . 4.5 1.8 6.5 1 1 367 1 . . . . . 2.8 1.8 3.8 1 1 368 1 . . . . . 5.0 1.8 5.0 1 1 369 1 . . . . . 4.5 1.8 6.9 1 1 370 1 . . . . . 2.8 1.8 2.8 1 1 371 1 . . . . . 5.0 1.8 5.0 1 1 372 1 . . . . . 4.0 1.8 4.0 1 1 373 1 . . . . . 3.5 1.8 3.5 1 1 374 1 . . . . . 5.0 1.8 5.0 1 1 375 1 . . . . . 3.3 1.8 5.7 1 1 376 1 . . . . . 4.0 1.8 6.4 1 1 377 1 . . . . . 5.0 1.8 7.4 1 1 378 1 . . . . . 4.0 1.8 6.4 1 1 379 1 . . . . . 5.0 1.8 8.4 1 1 380 1 . . . . . 3.5 1.8 4.5 1 1 381 1 . . . . . 2.8 1.8 3.8 1 1 382 1 . . . . . 3.5 1.8 4.5 1 1 383 1 . . . . . 2.5 1.8 2.5 1 1 384 1 . . . . . 3.5 1.8 4.5 1 1 385 1 . . . . . 5.0 1.8 5.0 1 1 386 1 . . . . . 5.0 1.8 6.0 1 1 387 1 . . . . . . 2.5 2.8 1 1 388 1 . . . . . 3.5 1.8 5.9 1 1 389 1 . . . . . 2.5 1.8 2.5 1 1 390 1 . . . . . 5.0 1.8 5.0 1 1 391 1 . . . . . 2.5 1.8 3.5 1 1 392 1 . . . . . 3.5 1.8 4.5 1 1 393 1 . . . . . 3.5 1.8 4.5 1 1 394 1 . . . . . 2.8 1.8 2.8 1 1 395 1 . . . . . 3.5 1.8 4.5 1 1 396 1 . . . . . 5.0 1.8 6.0 1 1 397 1 . . . . . 5.0 1.8 7.0 1 1 398 1 . . . . . 3.5 1.8 3.5 1 1 399 1 . . . . . 5.0 1.8 5.0 1 1 400 1 . . . . . 3.5 1.8 4.5 1 1 401 1 . . . . . 5.0 1.8 6.0 1 1 402 1 . . . . . 3.5 1.8 3.5 1 1 403 1 . . . . . 5.0 1.8 5.0 1 1 404 1 . . . . . 5.0 1.8 7.0 1 1 405 1 . . . . . 5.0 1.8 5.0 1 1 406 1 . . . . . 5.0 1.8 8.4 1 1 407 1 . . . . . 5.0 1.8 7.4 1 1 408 1 . . . . . 5.0 1.8 5.0 1 1 409 1 . . . . . 5.0 1.8 5.0 1 1 410 1 . . . . . 5.0 1.8 6.0 1 1 411 1 . . . . . 5.0 1.8 5.0 1 1 412 1 . . . . . 5.0 1.8 5.0 1 1 413 1 . . . . . 5.0 1.8 6.0 1 1 414 1 . . . . . 2.5 1.8 2.5 1 1 415 1 . . . . . 5.0 1.8 6.0 1 1 416 1 . . . . . 4.3 1.8 4.3 1 1 417 1 . . . . . 5.0 1.8 5.0 1 1 418 1 . . . . . 5.0 1.8 5.0 1 1 419 1 . . . . . 5.0 1.8 5.0 1 1 420 1 . . . . . 5.0 1.8 7.4 1 1 421 1 . . . . . 4.3 1.8 7.7 1 1 422 1 . . . . . 5.0 1.8 7.4 1 1 423 1 . . . . . 4.3 1.8 6.7 1 1 424 1 . . . . . 4.3 1.8 7.7 1 1 425 1 . . . . . 5.0 1.8 8.4 1 1 426 1 . . . . . 4.3 1.8 6.3 1 1 427 1 . . . . . 5.0 1.8 7.4 1 1 428 1 . . . . . 5.0 1.8 5.0 1 1 429 1 . . . . . 5.0 1.8 6.0 1 1 430 1 . . . . . 3.5 1.8 4.5 1 1 431 1 . . . . . 5.0 1.8 6.0 1 1 432 1 . . . . . 5.0 1.8 5.0 1 1 433 1 . . . . . 3.5 1.8 3.5 1 1 434 1 . . . . . 2.0 1.8 6.5 1 1 435 1 . . . . . 2.0 1.8 4.0 1 1 436 1 . . . . . 2.0 1.8 2.5 1 1 437 1 . . . . . 2.0 1.8 4.0 1 1 438 1 . . . . . 2.0 1.8 4.0 1 1 439 1 . . . . . 2.0 1.8 3.5 1 1 440 1 . . . . . 2.0 1.8 4.5 1 1 441 1 . . . . . 2.0 1.8 4.0 1 1 442 1 . . . . . 2.0 1.8 2.5 1 1 443 1 . . . . . 2.0 1.8 5.5 1 1 444 1 . . . . . 2.0 1.8 7.5 1 1 445 1 . . . . . 2.0 1.8 5.0 1 1 446 1 . . . . . 2.0 1.8 7.5 1 1 447 1 . . . . . 2.0 1.8 3.5 1 1 448 1 . . . . . 2.0 1.8 4.0 1 1 449 1 . . . . . 2.0 1.8 9.0 1 1 450 1 . . . . . 2.0 1.8 6.5 1 1 451 1 . . . . . 2.0 1.8 9.0 1 1 452 1 . . . . . 2.0 1.8 7.5 1 1 453 1 . . . . . 2.0 1.8 5.0 1 1 454 1 . . . . . 2.0 1.8 7.5 1 1 455 1 . . . . . 2.0 1.8 6.5 1 1 456 1 . . . . . 2.0 1.8 5.5 1 1 457 1 . . . . . 2.0 1.8 8.0 1 1 458 1 . . . . . 2.0 1.8 8.5 1 1 459 1 . . . . . 2.0 1.8 9.0 1 1 460 1 . . . . . 2.0 1.8 10.0 1 1 461 1 . . . . . 2.0 1.8 9.0 1 1 462 1 . . . . . 2.0 1.8 8.0 1 1 463 1 . . . . . 2.0 1.8 8.0 1 1 464 1 . . . . . 2.0 1.8 4.0 1 1 465 1 . . . . . 2.0 1.8 6.5 1 1 466 1 . . . . . 2.0 1.8 4.0 1 1 467 1 . . . . . 2.0 1.8 4.0 1 1 468 1 . . . . . 2.0 1.8 4.5 1 1 469 1 . . . . . 2.0 1.8 6.5 1 1 470 1 . . . . . 2.0 1.8 6.5 1 1 471 1 . . . . . 2.0 1.8 6.5 1 1 472 1 . . . . . 2.0 1.8 3.5 1 1 473 1 . . . . . 2.0 1.8 2.5 1 1 474 1 . . . . . 2.0 1.8 3.5 1 1 475 1 . . . . . 2.0 1.8 5.5 1 1 476 1 . . . . . 2.0 1.8 9.0 1 1 477 1 . . . . . 2.0 1.8 9.0 1 1 478 1 . . . . . 2.0 1.8 9.0 1 1 479 1 . . . . . 2.0 1.8 7.5 1 1 480 1 . . . . . 2.0 1.8 7.5 1 1 481 1 . . . . . 2.0 1.8 10.0 1 1 482 1 . . . . . 2.0 1.8 10.0 1 1 483 1 . . . . . 2.0 1.8 6.5 1 1 484 1 . . . . . 2.0 1.8 4.0 1 1 485 1 . . . . . 2.0 1.8 7.5 1 1 486 1 . . . . . 2.0 1.8 6.5 1 1 487 1 . . . . . 2.0 1.8 4.0 1 1 488 1 . . . . . 2.0 1.8 6.5 1 1 489 1 . . . . . 2.0 1.8 4.0 1 1 490 1 . . . . . 2.0 1.8 7.5 1 1 491 1 . . . . . 2.0 1.8 7.5 1 1 492 1 . . . . . 2.0 1.8 5.0 1 1 493 1 . . . . . 2.0 1.8 5.5 1 1 494 1 . . . . . 2.0 1.8 6.5 1 1 495 1 . . . . . 2.0 1.8 5.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 6 CYS O . 8 . O 1 2 1 1 2 1 1 9 TYR N . 11 . N 1 2 2 1 1 1 1 6 CYS O . 8 . O 1 2 2 1 2 1 1 9 TYR H . 11 . HN 1 2 3 1 1 1 1 19 ARG N . 21 . N 1 2 3 1 2 1 1 30 GLY O . 32 . O 1 2 4 1 1 1 1 19 ARG H . 21 . HN 1 2 4 1 2 1 1 30 GLY O . 32 . O 1 2 5 1 1 1 1 22 CYS N . 24 . N 1 2 5 1 2 1 1 50 HIS O . 52 . O 1 2 6 1 1 1 1 22 CYS H . 24 . HN 1 2 6 1 2 1 1 50 HIS O . 52 . O 1 2 7 1 1 1 1 19 ARG N . 21 . N 1 2 7 1 2 1 1 29 TYR O . 31 . O 1 2 8 1 1 1 1 19 ARG H . 21 . HN 1 2 8 1 2 1 1 29 TYR O . 31 . O 1 2 9 1 1 1 1 23 GLY N . 25 . N 1 2 9 1 2 1 1 27 LYS O . 29 . O 1 2 10 1 1 1 1 23 GLY H . 25 . HN 1 2 10 1 2 1 1 27 LYS O . 29 . O 1 2 11 1 1 1 1 24 SER N . 26 . N 1 2 11 1 2 1 1 47 THR O . 49 . O 1 2 12 1 1 1 1 24 SER H . 26 . HN 1 2 12 1 2 1 1 47 THR O . 49 . O 1 2 13 1 1 1 1 23 GLY O . 25 . O 1 2 13 1 2 1 1 25 ASP N . 27 . N 1 2 14 1 1 1 1 23 GLY O . 25 . O 1 2 14 1 2 1 1 25 ASP H . 27 . HN 1 2 15 1 1 1 1 23 GLY O . 25 . O 1 2 15 1 2 1 1 26 ASN N . 28 . N 1 2 16 1 1 1 1 23 GLY O . 25 . O 1 2 16 1 2 1 1 26 ASN H . 28 . HN 1 2 17 1 1 1 1 23 GLY O . 25 . O 1 2 17 1 2 1 1 27 LYS N . 29 . N 1 2 18 1 1 1 1 23 GLY O . 25 . O 1 2 18 1 2 1 1 27 LYS H . 29 . HN 1 2 19 1 1 1 1 19 ARG O . 21 . O 1 2 19 1 2 1 1 29 TYR N . 31 . N 1 2 20 1 1 1 1 19 ARG O . 21 . O 1 2 20 1 2 1 1 29 TYR H . 31 . HN 1 2 21 1 1 1 1 31 ASN OD1 . 33 . OD1 1 2 21 1 2 1 1 33 CYS N . 35 . N 1 2 22 1 1 1 1 31 ASN OD1 . 33 . OD1 1 2 22 1 2 1 1 33 CYS H . 35 . HN 1 2 23 1 1 1 1 31 ASN OD1 . 33 . OD1 1 2 23 1 2 1 1 34 ASN N . 36 . N 1 2 24 1 1 1 1 31 ASN OD1 . 33 . OD1 1 2 24 1 2 1 1 34 ASN H . 36 . HN 1 2 25 1 1 1 1 31 ASN O . 33 . O 1 2 25 1 2 1 1 35 PHE N . 37 . N 1 2 26 1 1 1 1 31 ASN O . 33 . O 1 2 26 1 2 1 1 35 PHE H . 37 . HN 1 2 27 1 1 1 1 32 LYS O . 34 . O 1 2 27 1 2 1 1 36 CYS N . 38 . N 1 2 28 1 1 1 1 32 LYS O . 34 . O 1 2 28 1 2 1 1 36 CYS H . 38 . HN 1 2 29 1 1 1 1 33 CYS O . 35 . O 1 2 29 1 2 1 1 37 CYS N . 39 . N 1 2 30 1 1 1 1 33 CYS O . 35 . O 1 2 30 1 2 1 1 37 CYS H . 39 . HN 1 2 31 1 1 1 1 34 ASN O . 36 . O 1 2 31 1 2 1 1 38 ALA N . 40 . N 1 2 32 1 1 1 1 34 ASN O . 36 . O 1 2 32 1 2 1 1 38 ALA H . 40 . HN 1 2 33 1 1 1 1 35 PHE O . 37 . O 1 2 33 1 2 1 1 39 VAL N . 41 . N 1 2 34 1 1 1 1 35 PHE O . 37 . O 1 2 34 1 2 1 1 39 VAL H . 41 . HN 1 2 35 1 1 1 1 36 CYS O . 38 . O 1 2 35 1 2 1 1 40 VAL N . 42 . N 1 2 36 1 1 1 1 36 CYS O . 38 . O 1 2 36 1 2 1 1 40 VAL H . 42 . HN 1 2 37 1 1 1 1 37 CYS O . 39 . O 1 2 37 1 2 1 1 41 GLU N . 43 . N 1 2 38 1 1 1 1 37 CYS O . 39 . O 1 2 38 1 2 1 1 41 GLU H . 43 . HN 1 2 39 1 1 1 1 38 ALA O . 40 . O 1 2 39 1 2 1 1 42 SER N . 44 . N 1 2 40 1 1 1 1 38 ALA O . 40 . O 1 2 40 1 2 1 1 42 SER H . 44 . HN 1 2 41 1 1 1 1 39 VAL O . 41 . O 1 2 41 1 2 1 1 44 GLY N . 46 . N 1 2 42 1 1 1 1 39 VAL O . 41 . O 1 2 42 1 2 1 1 44 GLY H . 46 . HN 1 2 43 1 1 1 1 42 SER O . 44 . O 1 2 43 1 2 1 1 45 THR N . 47 . N 1 2 44 1 1 1 1 42 SER O . 44 . O 1 2 44 1 2 1 1 45 THR H . 47 . HN 1 2 45 1 1 1 1 22 CYS O . 24 . O 1 2 45 1 2 1 1 49 SER N . 51 . N 1 2 46 1 1 1 1 22 CYS O . 24 . O 1 2 46 1 2 1 1 49 SER H . 51 . HN 1 2 47 1 1 1 1 22 CYS O . 24 . O 1 2 47 1 2 1 1 50 HIS N . 52 . N 1 2 48 1 1 1 1 22 CYS O . 24 . O 1 2 48 1 2 1 1 50 HIS H . 52 . HN 1 2 49 1 1 1 1 20 PRO O . 22 . O 1 2 49 1 2 1 1 52 GLY N . 54 . N 1 2 50 1 1 1 1 20 PRO O . 22 . O 1 2 50 1 2 1 1 52 GLY H . 54 . HN 1 2 51 1 1 1 1 28 THR OG1 . 30 . OG1 1 2 51 1 2 1 1 54 CYS N . 56 . N 1 2 52 1 1 1 1 28 THR OG1 . 30 . OG1 1 2 52 1 2 1 1 54 CYS H . 56 . HN 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.3 2.5 3.5 1 2 2 1 . . . . . 2.3 1.5 2.5 1 2 3 1 . . . . . 3.3 2.5 3.5 1 2 4 1 . . . . . 2.3 1.5 2.5 1 2 5 1 . . . . . 3.3 2.5 3.5 1 2 6 1 . . . . . 2.3 1.5 2.5 1 2 7 1 . . . . . 3.3 2.5 3.5 1 2 8 1 . . . . . 2.3 1.5 2.5 1 2 9 1 . . . . . 3.3 2.5 3.5 1 2 10 1 . . . . . 2.3 1.5 2.5 1 2 11 1 . . . . . 3.3 2.5 3.5 1 2 12 1 . . . . . 2.3 1.5 2.5 1 2 13 1 . . . . . 3.3 2.5 3.5 1 2 14 1 . . . . . 2.3 1.5 2.5 1 2 15 1 . . . . . 3.3 2.5 3.5 1 2 16 1 . . . . . 2.3 1.5 2.5 1 2 17 1 . . . . . 3.3 2.5 3.5 1 2 18 1 . . . . . 2.3 1.5 2.5 1 2 19 1 . . . . . 3.3 2.5 3.5 1 2 20 1 . . . . . 2.3 1.5 2.5 1 2 21 1 . . . . . 3.3 2.5 3.5 1 2 22 1 . . . . . 2.3 1.5 2.5 1 2 23 1 . . . . . 3.3 2.5 3.5 1 2 24 1 . . . . . 2.3 1.5 2.5 1 2 25 1 . . . . . 3.3 2.5 3.5 1 2 26 1 . . . . . 2.3 1.5 2.5 1 2 27 1 . . . . . 3.3 2.5 3.5 1 2 28 1 . . . . . 2.3 1.5 2.5 1 2 29 1 . . . . . 3.3 2.5 3.5 1 2 30 1 . . . . . 2.3 1.5 2.5 1 2 31 1 . . . . . 3.3 2.5 3.5 1 2 32 1 . . . . . 2.3 1.5 2.5 1 2 33 1 . . . . . 3.3 2.5 3.5 1 2 34 1 . . . . . 2.3 1.5 2.5 1 2 35 1 . . . . . 3.3 2.5 3.5 1 2 36 1 . . . . . 2.3 1.5 2.5 1 2 37 1 . . . . . 3.3 2.5 3.5 1 2 38 1 . . . . . 2.3 1.5 2.5 1 2 39 1 . . . . . 3.3 2.5 3.5 1 2 40 1 . . . . . 2.3 1.5 2.5 1 2 41 1 . . . . . 3.3 2.5 3.5 1 2 42 1 . . . . . 2.3 1.5 2.5 1 2 43 1 . . . . . 3.3 2.5 3.5 1 2 44 1 . . . . . 2.3 1.5 2.5 1 2 45 1 . . . . . 3.3 2.5 3.5 1 2 46 1 . . . . . 2.3 1.5 2.5 1 2 47 1 . . . . . 3.3 2.5 3.5 1 2 48 1 . . . . . 2.3 1.5 2.5 1 2 49 1 . . . . . 3.3 2.5 3.5 1 2 50 1 . . . . . 2.3 1.5 2.5 1 2 51 1 . . . . . 3.3 2.5 3.5 1 2 52 1 . . . . . 2.3 1.5 2.5 1 2 stop_ save_ save_CNS/XPLOR_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 SER C 1 1 4 VAL N 1 1 4 VAL CA 1 1 4 VAL C -150.0 -89.99999 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 2 . 1 1 4 VAL N 1 1 4 VAL CA 1 1 4 VAL CB 1 1 4 VAL CG1 0.0 120.0 . 6 . N . 6 . CA . 6 . CB . 6 . CG1 1 1 3 . 1 1 4 VAL C 1 1 5 ASP N 1 1 5 ASP CA 1 1 5 ASP C -170.0 -70.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 4 . 1 1 5 ASP C 1 1 6 CYS N 1 1 6 CYS CA 1 1 6 CYS C -160.0 -80.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 5 . 1 1 6 CYS C 1 1 7 SER N 1 1 7 SER CA 1 1 7 SER C -89.99999 -30.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 6 . 1 1 8 GLU C 1 1 9 TYR N 1 1 9 TYR CA 1 1 9 TYR C -150.0 -89.99999 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 7 . 1 1 10 PRO C 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C -170.0 -70.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 8 . 1 1 12 CYS C 1 1 13 ALA N 1 1 13 ALA CA 1 1 13 ALA C -150.0 -89.99999 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 9 . 1 1 13 ALA C 1 1 14 CYS N 1 1 14 CYS CA 1 1 14 CYS C -160.0 -80.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 10 . 1 1 14 CYS N 1 1 14 CYS CA 1 1 14 CYS CB 1 1 14 CYS SG -120.0 0.0 . 16 . N . 16 . CA . 16 . CB . 16 . SG 1 1 11 . 1 1 14 CYS C 1 1 15 THR N 1 1 15 THR CA 1 1 15 THR C -160.0 -80.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 12 . 1 1 15 THR C 1 1 16 MET N 1 1 16 MET CA 1 1 16 MET C -160.0 -80.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 13 . 1 1 16 MET C 1 1 17 GLU N 1 1 17 GLU CA 1 1 17 GLU C -89.99999 -30.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 14 . 1 1 17 GLU C 1 1 18 TYR N 1 1 18 TYR CA 1 1 18 TYR C -150.0 -89.99999 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 15 . 1 1 18 TYR N 1 1 18 TYR CA 1 1 18 TYR CB 1 1 18 TYR CG 120.0 240.0 . 20 . N . 20 . CA . 20 . CB . 20 . CG 1 1 16 . 1 1 18 TYR C 1 1 19 ARG N 1 1 19 ARG CA 1 1 19 ARG C -170.0 -70.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 17 . 1 1 20 PRO C 1 1 19 ARG N 1 1 19 ARG CA 1 1 19 ARG C -160.0 -80.0 . 22 . C . 21 . N . 21 . CA . 21 . C 1 1 18 . 1 1 19 ARG N 1 1 19 ARG CA 1 1 19 ARG CB 1 1 19 ARG CG -120.0 0.0 . 21 . N . 21 . CA . 21 . CB . 21 . CG 1 1 19 . 1 1 19 ARG C 1 1 22 CYS N 1 1 22 CYS CA 1 1 22 CYS C -150.0 -89.99999 . 21 . C . 24 . N . 24 . CA . 24 . C 1 1 20 . 1 1 23 GLY C 1 1 24 SER N 1 1 24 SER CA 1 1 24 SER C -89.99999 -30.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 21 . 1 1 24 SER N 1 1 24 SER CA 1 1 24 SER C 1 1 25 ASP N -70.0 10.0 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 22 . 1 1 24 SER C 1 1 25 ASP N 1 1 25 ASP CA 1 1 25 ASP C -160.0 -80.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 23 . 1 1 25 ASP N 1 1 25 ASP CA 1 1 25 ASP C 1 1 26 ASN N -40.0 40.0 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 24 . 1 1 25 ASP N 1 1 25 ASP CA 1 1 25 ASP CB 1 1 25 ASP CG 0.0 120.0 . 27 . N . 27 . CA . 27 . CB . 27 . CG 1 1 25 . 1 1 25 ASP C 1 1 26 ASN N 1 1 26 ASN CA 1 1 26 ASN C 20.0 100.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 26 . 1 1 26 ASN N 1 1 26 ASN CA 1 1 26 ASN C 1 1 27 LYS N -10.0 70.0 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 27 . 1 1 26 ASN N 1 1 26 ASN CA 1 1 26 ASN CB 1 1 26 ASN CG 120.0 240.0 . 28 . N . 28 . CA . 28 . CB . 28 . CG 1 1 28 . 1 1 26 ASN C 1 1 27 LYS N 1 1 27 LYS CA 1 1 27 LYS C -150.0 -89.99999 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 29 . 1 1 27 LYS C 1 1 28 THR N 1 1 28 THR CA 1 1 28 THR C -160.0 -80.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 30 . 1 1 28 THR N 1 1 28 THR CA 1 1 28 THR CB 1 1 28 THR OG1 -120.0 0.0 . 30 . N . 30 . CA . 30 . CB . 30 . OG1 1 1 31 . 1 1 28 THR C 1 1 29 TYR N 1 1 29 TYR CA 1 1 29 TYR C -150.0 -89.99999 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 32 . 1 1 29 TYR N 1 1 29 TYR CA 1 1 29 TYR CB 1 1 29 TYR CG -120.0 0.0 . 31 . N . 31 . CA . 31 . CB . 31 . CG 1 1 33 . 1 1 31 ASN N 1 1 31 ASN CA 1 1 31 ASN CB 1 1 31 ASN CG 0.0 120.0 . 33 . N . 33 . CA . 33 . CB . 33 . CG 1 1 34 . 1 1 31 ASN C 1 1 32 LYS N 1 1 32 LYS CA 1 1 32 LYS C -89.99999 -30.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 35 . 1 1 32 LYS N 1 1 32 LYS CA 1 1 32 LYS C 1 1 33 CYS N -70.0 -10.0 . 34 . N . 34 . CA . 34 . C . 35 . N 1 1 36 . 1 1 32 LYS C 1 1 33 CYS N 1 1 33 CYS CA 1 1 33 CYS C -89.99999 -30.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 37 . 1 1 33 CYS N 1 1 33 CYS CA 1 1 33 CYS C 1 1 34 ASN N -70.0 -10.0 . 35 . N . 35 . CA . 35 . C . 36 . N 1 1 38 . 1 1 33 CYS N 1 1 33 CYS CA 1 1 33 CYS CB 1 1 33 CYS SG 120.0 240.0 . 35 . N . 35 . CA . 35 . CB . 35 . SG 1 1 39 . 1 1 33 CYS C 1 1 34 ASN N 1 1 34 ASN CA 1 1 34 ASN C -89.99999 -30.0 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 40 . 1 1 34 ASN N 1 1 34 ASN CA 1 1 34 ASN C 1 1 35 PHE N -70.0 -10.0 . 36 . N . 36 . CA . 36 . C . 37 . N 1 1 41 . 1 1 34 ASN C 1 1 35 PHE N 1 1 35 PHE CA 1 1 35 PHE C -89.99999 -30.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 42 . 1 1 35 PHE N 1 1 35 PHE CA 1 1 35 PHE C 1 1 36 CYS N -70.0 -10.0 . 37 . N . 37 . CA . 37 . C . 38 . N 1 1 43 . 1 1 35 PHE N 1 1 35 PHE CA 1 1 35 PHE CB 1 1 35 PHE CG 120.0 240.0 . 37 . N . 37 . CA . 37 . CB . 37 . CG 1 1 44 . 1 1 35 PHE C 1 1 36 CYS N 1 1 36 CYS CA 1 1 36 CYS C -89.99999 -30.0 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 45 . 1 1 36 CYS N 1 1 36 CYS CA 1 1 36 CYS C 1 1 37 CYS N -70.0 -10.0 . 38 . N . 38 . CA . 38 . C . 39 . N 1 1 46 . 1 1 36 CYS N 1 1 36 CYS CA 1 1 36 CYS CB 1 1 36 CYS SG -120.0 0.0 . 38 . N . 38 . CA . 38 . CB . 38 . SG 1 1 47 . 1 1 36 CYS C 1 1 37 CYS N 1 1 37 CYS CA 1 1 37 CYS C -89.99999 -30.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 48 . 1 1 37 CYS N 1 1 37 CYS CA 1 1 37 CYS C 1 1 38 ALA N -70.0 -10.0 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 49 . 1 1 37 CYS N 1 1 37 CYS CA 1 1 37 CYS CB 1 1 37 CYS SG 120.0 240.0 . 39 . N . 39 . CA . 39 . CB . 39 . SG 1 1 50 . 1 1 37 CYS C 1 1 38 ALA N 1 1 38 ALA CA 1 1 38 ALA C -110.0 -10.0 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 51 . 1 1 38 ALA N 1 1 38 ALA CA 1 1 38 ALA C 1 1 39 VAL N -70.0 -10.0 . 40 . N . 40 . CA . 40 . C . 41 . N 1 1 52 . 1 1 38 ALA C 1 1 39 VAL N 1 1 39 VAL CA 1 1 39 VAL C -89.99999 -30.0 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 53 . 1 1 39 VAL N 1 1 39 VAL CA 1 1 39 VAL C 1 1 40 VAL N -70.0 -10.0 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 54 . 1 1 39 VAL N 1 1 39 VAL CA 1 1 39 VAL CB 1 1 39 VAL CG1 120.0 240.0 . 41 . N . 41 . CA . 41 . CB . 41 . CG1 1 1 55 . 1 1 39 VAL C 1 1 40 VAL N 1 1 40 VAL CA 1 1 40 VAL C -89.99999 -30.0 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 56 . 1 1 40 VAL N 1 1 40 VAL CA 1 1 40 VAL C 1 1 41 GLU N -70.0 -10.0 . 42 . N . 42 . CA . 42 . C . 43 . N 1 1 57 . 1 1 40 VAL N 1 1 40 VAL CA 1 1 40 VAL CB 1 1 40 VAL CG1 120.0 240.0 . 42 . N . 42 . CA . 42 . CB . 42 . CG1 1 1 58 . 1 1 40 VAL C 1 1 41 GLU N 1 1 41 GLU CA 1 1 41 GLU C -110.0 -10.0 . 42 . C . 43 . N . 43 . CA . 43 . C 1 1 59 . 1 1 41 GLU N 1 1 41 GLU CA 1 1 41 GLU C 1 1 42 SER N -70.0 -10.0 . 43 . N . 43 . CA . 43 . C . 44 . N 1 1 60 . 1 1 44 GLY C 1 1 45 THR N 1 1 45 THR CA 1 1 45 THR C -160.0 -80.0 . 46 . C . 47 . N . 47 . CA . 47 . C 1 1 61 . 1 1 46 LEU N 1 1 46 LEU CA 1 1 46 LEU CB 1 1 46 LEU CG 120.0 240.0 . 48 . N . 48 . CA . 48 . CB . 48 . CG 1 1 62 . 1 1 46 LEU C 1 1 47 THR N 1 1 47 THR CA 1 1 47 THR C -150.0 -89.99999 . 48 . C . 49 . N . 49 . CA . 49 . C 1 1 63 . 1 1 47 THR N 1 1 47 THR CA 1 1 47 THR CB 1 1 47 THR OG1 0.0 120.0 . 49 . N . 49 . CA . 49 . CB . 49 . OG1 1 1 64 . 1 1 48 LEU N 1 1 48 LEU CA 1 1 48 LEU CB 1 1 48 LEU CG 120.0 240.0 . 50 . N . 50 . CA . 50 . CB . 50 . CG 1 1 65 . 1 1 48 LEU C 1 1 49 SER N 1 1 49 SER CA 1 1 49 SER C -150.0 -89.99999 . 50 . C . 51 . N . 51 . CA . 51 . C 1 1 66 . 1 1 51 PHE N 1 1 51 PHE CA 1 1 51 PHE CB 1 1 51 PHE CG -120.0 0.0 . 53 . N . 53 . CA . 53 . CB . 53 . CG 1 1 67 . 1 1 52 GLY C 1 1 53 LYS N 1 1 53 LYS CA 1 1 53 LYS C -89.99999 -30.0 . 54 . C . 55 . N . 55 . CA . 55 . C 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 ALA C C 8.745 6.149 -9.092 1.00 . A A . 3 ALA C 1 1 1 2 1 1 1 ALA CA C 9.494 6.979 -8.046 1.00 . A A . 3 ALA CA 1 1 1 3 1 1 1 ALA CB C 10.080 6.051 -6.980 1.00 . A A . 3 ALA CB 1 1 1 4 1 1 1 ALA H1 H 7.959 7.437 -6.715 1.00 . A A . 3 ALA H1 1 1 1 5 1 1 1 ALA H2 H 7.944 8.368 -8.136 1.00 . A A . 3 ALA H2 1 1 1 6 1 1 1 ALA H3 H 9.089 8.683 -6.921 1.00 . A A . 3 ALA H3 1 1 1 7 1 1 1 ALA HA H 10.291 7.525 -8.526 1.00 . A A . 3 ALA HA 1 1 1 8 1 1 1 ALA HB1 H 9.391 5.242 -6.788 1.00 . A A . 3 ALA HB1 1 1 1 9 1 1 1 ALA HB2 H 10.245 6.608 -6.069 1.00 . A A . 3 ALA HB2 1 1 1 10 1 1 1 ALA HB3 H 11.019 5.648 -7.331 1.00 . A A . 3 ALA HB3 1 1 1 11 1 1 1 ALA N N 8.550 7.939 -7.406 1.00 . A A . 3 ALA N 1 1 1 12 1 1 1 ALA O O 9.274 5.826 -10.137 1.00 . A A . 3 ALA O 1 1 1 13 1 1 2 VAL C C 5.264 5.412 -9.740 1.00 . A A . 4 VAL C 1 1 1 14 1 1 2 VAL CA C 6.734 4.994 -9.799 1.00 . A A . 4 VAL CA 1 1 1 15 1 1 2 VAL CB C 6.856 3.509 -9.456 1.00 . A A . 4 VAL CB 1 1 1 16 1 1 2 VAL CG1 C 6.071 2.684 -10.477 1.00 . A A . 4 VAL CG1 1 1 1 17 1 1 2 VAL CG2 C 8.331 3.097 -9.496 1.00 . A A . 4 VAL CG2 1 1 1 18 1 1 2 VAL H H 7.107 6.071 -7.972 1.00 . A A . 4 VAL H 1 1 1 19 1 1 2 VAL HA H 7.117 5.166 -10.794 1.00 . A A . 4 VAL HA 1 1 1 20 1 1 2 VAL HB H 6.456 3.333 -8.469 1.00 . A A . 4 VAL HB 1 1 1 21 1 1 2 VAL HG11 H 5.022 2.938 -10.415 1.00 . A A . 4 VAL HG11 1 1 1 22 1 1 2 VAL HG12 H 6.199 1.633 -10.267 1.00 . A A . 4 VAL HG12 1 1 1 23 1 1 2 VAL HG13 H 6.436 2.899 -11.471 1.00 . A A . 4 VAL HG13 1 1 1 24 1 1 2 VAL HG21 H 8.776 3.259 -8.524 1.00 . A A . 4 VAL HG21 1 1 1 25 1 1 2 VAL HG22 H 8.850 3.691 -10.233 1.00 . A A . 4 VAL HG22 1 1 1 26 1 1 2 VAL HG23 H 8.406 2.052 -9.756 1.00 . A A . 4 VAL HG23 1 1 1 27 1 1 2 VAL N N 7.516 5.801 -8.819 1.00 . A A . 4 VAL N 1 1 1 28 1 1 2 VAL O O 4.769 5.833 -8.714 1.00 . A A . 4 VAL O 1 1 1 29 1 1 3 SER C C 2.250 4.442 -10.828 1.00 . A A . 5 SER C 1 1 1 30 1 1 3 SER CA C 3.126 5.697 -10.842 1.00 . A A . 5 SER CA 1 1 1 31 1 1 3 SER CB C 2.828 6.514 -12.098 1.00 . A A . 5 SER CB 1 1 1 32 1 1 3 SER H H 4.981 4.964 -11.653 1.00 . A A . 5 SER H 1 1 1 33 1 1 3 SER HA H 2.913 6.294 -9.966 1.00 . A A . 5 SER HA 1 1 1 34 1 1 3 SER HB2 H 3.680 7.126 -12.343 1.00 . A A . 5 SER HB2 1 1 1 35 1 1 3 SER HB3 H 2.621 5.844 -12.923 1.00 . A A . 5 SER HB3 1 1 1 36 1 1 3 SER HG H 1.081 7.225 -12.578 1.00 . A A . 5 SER HG 1 1 1 37 1 1 3 SER N N 4.563 5.303 -10.835 1.00 . A A . 5 SER N 1 1 1 38 1 1 3 SER O O 2.496 3.494 -11.548 1.00 . A A . 5 SER O 1 1 1 39 1 1 3 SER OG O 1.704 7.352 -11.859 1.00 . A A . 5 SER OG 1 1 1 40 1 1 4 VAL C C -1.080 3.638 -10.356 1.00 . A A . 6 VAL C 1 1 1 41 1 1 4 VAL CA C 0.340 3.233 -9.955 1.00 . A A . 6 VAL CA 1 1 1 42 1 1 4 VAL CB C 0.326 2.673 -8.531 1.00 . A A . 6 VAL CB 1 1 1 43 1 1 4 VAL CG1 C -0.127 3.762 -7.556 1.00 . A A . 6 VAL CG1 1 1 1 44 1 1 4 VAL CG2 C -0.645 1.492 -8.458 1.00 . A A . 6 VAL CG2 1 1 1 45 1 1 4 VAL H H 1.048 5.201 -9.441 1.00 . A A . 6 VAL H 1 1 1 46 1 1 4 VAL HA H 0.704 2.478 -10.637 1.00 . A A . 6 VAL HA 1 1 1 47 1 1 4 VAL HB H 1.320 2.342 -8.265 1.00 . A A . 6 VAL HB 1 1 1 48 1 1 4 VAL HG11 H -0.956 3.395 -6.969 1.00 . A A . 6 VAL HG11 1 1 1 49 1 1 4 VAL HG12 H -0.437 4.636 -8.111 1.00 . A A . 6 VAL HG12 1 1 1 50 1 1 4 VAL HG13 H 0.690 4.022 -6.901 1.00 . A A . 6 VAL HG13 1 1 1 51 1 1 4 VAL HG21 H -1.550 1.737 -8.994 1.00 . A A . 6 VAL HG21 1 1 1 52 1 1 4 VAL HG22 H -0.881 1.285 -7.426 1.00 . A A . 6 VAL HG22 1 1 1 53 1 1 4 VAL HG23 H -0.187 0.622 -8.904 1.00 . A A . 6 VAL HG23 1 1 1 54 1 1 4 VAL N N 1.229 4.427 -10.014 1.00 . A A . 6 VAL N 1 1 1 55 1 1 4 VAL O O -1.555 4.700 -10.006 1.00 . A A . 6 VAL O 1 1 1 56 1 1 5 ASP C C -4.146 2.245 -10.765 1.00 . A A . 7 ASP C 1 1 1 57 1 1 5 ASP CA C -3.151 3.141 -11.508 1.00 . A A . 7 ASP CA 1 1 1 58 1 1 5 ASP CB C -3.296 2.925 -13.016 1.00 . A A . 7 ASP CB 1 1 1 59 1 1 5 ASP CG C -2.362 3.880 -13.760 1.00 . A A . 7 ASP CG 1 1 1 60 1 1 5 ASP H H -1.362 1.948 -11.359 1.00 . A A . 7 ASP H 1 1 1 61 1 1 5 ASP HA H -3.354 4.174 -11.272 1.00 . A A . 7 ASP HA 1 1 1 62 1 1 5 ASP HB2 H -3.038 1.905 -13.259 1.00 . A A . 7 ASP HB2 1 1 1 63 1 1 5 ASP HB3 H -4.316 3.120 -13.311 1.00 . A A . 7 ASP HB3 1 1 1 64 1 1 5 ASP N N -1.763 2.800 -11.087 1.00 . A A . 7 ASP N 1 1 1 65 1 1 5 ASP O O -4.253 1.065 -11.032 1.00 . A A . 7 ASP O 1 1 1 66 1 1 5 ASP OD1 O -1.163 3.781 -13.557 1.00 . A A . 7 ASP OD1 1 1 1 67 1 1 5 ASP OD2 O -2.860 4.695 -14.518 1.00 . A A . 7 ASP OD2 1 1 1 68 1 1 6 CYS C C -7.189 2.754 -9.000 1.00 . A A . 8 CYS C 1 1 1 69 1 1 6 CYS CA C -5.867 1.987 -9.078 1.00 . A A . 8 CYS CA 1 1 1 70 1 1 6 CYS CB C -5.342 1.727 -7.664 1.00 . A A . 8 CYS CB 1 1 1 71 1 1 6 CYS H H -4.774 3.755 -9.641 1.00 . A A . 8 CYS H 1 1 1 72 1 1 6 CYS HA H -6.025 1.046 -9.585 1.00 . A A . 8 CYS HA 1 1 1 73 1 1 6 CYS HB2 H -4.700 2.541 -7.362 1.00 . A A . 8 CYS HB2 1 1 1 74 1 1 6 CYS HB3 H -6.175 1.652 -6.980 1.00 . A A . 8 CYS HB3 1 1 1 75 1 1 6 CYS N N -4.876 2.801 -9.837 1.00 . A A . 8 CYS N 1 1 1 76 1 1 6 CYS O O -7.818 2.818 -7.962 1.00 . A A . 8 CYS O 1 1 1 77 1 1 6 CYS SG S -4.403 0.179 -7.644 1.00 . A A . 8 CYS SG 1 1 1 78 1 1 7 SER C C -9.986 3.317 -9.433 1.00 . A A . 9 SER C 1 1 1 79 1 1 7 SER CA C -8.876 4.113 -10.117 1.00 . A A . 9 SER CA 1 1 1 80 1 1 7 SER CB C -9.274 4.393 -11.567 1.00 . A A . 9 SER CB 1 1 1 81 1 1 7 SER H H -7.071 3.267 -10.908 1.00 . A A . 9 SER H 1 1 1 82 1 1 7 SER HA H -8.735 5.049 -9.599 1.00 . A A . 9 SER HA 1 1 1 83 1 1 7 SER HB2 H -10.318 4.654 -11.612 1.00 . A A . 9 SER HB2 1 1 1 84 1 1 7 SER HB3 H -8.683 5.215 -11.948 1.00 . A A . 9 SER HB3 1 1 1 85 1 1 7 SER HG H -9.762 3.156 -12.987 1.00 . A A . 9 SER HG 1 1 1 86 1 1 7 SER N N -7.604 3.337 -10.095 1.00 . A A . 9 SER N 1 1 1 87 1 1 7 SER O O -10.727 2.588 -10.065 1.00 . A A . 9 SER O 1 1 1 88 1 1 7 SER OG O -9.049 3.228 -12.348 1.00 . A A . 9 SER OG 1 1 1 89 1 1 8 GLU C C -10.803 1.235 -7.333 1.00 . A A . 10 GLU C 1 1 1 90 1 1 8 GLU CA C -11.165 2.718 -7.407 1.00 . A A . 10 GLU CA 1 1 1 91 1 1 8 GLU CB C -12.503 2.881 -8.129 1.00 . A A . 10 GLU CB 1 1 1 92 1 1 8 GLU CD C -14.601 1.877 -7.213 1.00 . A A . 10 GLU CD 1 1 1 93 1 1 8 GLU CG C -13.620 3.046 -7.097 1.00 . A A . 10 GLU CG 1 1 1 94 1 1 8 GLU H H -9.493 4.051 -7.669 1.00 . A A . 10 GLU H 1 1 1 95 1 1 8 GLU HA H -11.247 3.117 -6.408 1.00 . A A . 10 GLU HA 1 1 1 96 1 1 8 GLU HB2 H -12.466 3.753 -8.765 1.00 . A A . 10 GLU HB2 1 1 1 97 1 1 8 GLU HB3 H -12.698 2.006 -8.729 1.00 . A A . 10 GLU HB3 1 1 1 98 1 1 8 GLU HG2 H -13.193 3.060 -6.105 1.00 . A A . 10 GLU HG2 1 1 1 99 1 1 8 GLU HG3 H -14.144 3.972 -7.276 1.00 . A A . 10 GLU HG3 1 1 1 100 1 1 8 GLU N N -10.106 3.457 -8.147 1.00 . A A . 10 GLU N 1 1 1 101 1 1 8 GLU O O -11.480 0.393 -7.887 1.00 . A A . 10 GLU O 1 1 1 102 1 1 8 GLU OE1 O -14.213 0.856 -7.754 1.00 . A A . 10 GLU OE1 1 1 1 103 1 1 8 GLU OE2 O -15.723 2.025 -6.759 1.00 . A A . 10 GLU OE2 1 1 1 104 1 1 9 TYR C C -9.140 -0.895 -5.057 1.00 . A A . 11 TYR C 1 1 1 105 1 1 9 TYR CA C -9.341 -0.525 -6.533 1.00 . A A . 11 TYR CA 1 1 1 106 1 1 9 TYR CB C -8.032 -0.752 -7.294 1.00 . A A . 11 TYR CB 1 1 1 107 1 1 9 TYR CD1 C -8.607 -2.735 -8.738 1.00 . A A . 11 TYR CD1 1 1 1 108 1 1 9 TYR CD2 C -7.073 -3.049 -6.887 1.00 . A A . 11 TYR CD2 1 1 1 109 1 1 9 TYR CE1 C -8.486 -4.089 -9.069 1.00 . A A . 11 TYR CE1 1 1 1 110 1 1 9 TYR CE2 C -6.953 -4.405 -7.218 1.00 . A A . 11 TYR CE2 1 1 1 111 1 1 9 TYR CG C -7.901 -2.214 -7.648 1.00 . A A . 11 TYR CG 1 1 1 112 1 1 9 TYR CZ C -7.660 -4.925 -8.309 1.00 . A A . 11 TYR CZ 1 1 1 113 1 1 9 TYR H H -9.207 1.603 -6.205 1.00 . A A . 11 TYR H 1 1 1 114 1 1 9 TYR HA H -10.115 -1.149 -6.956 1.00 . A A . 11 TYR HA 1 1 1 115 1 1 9 TYR HB2 H -8.035 -0.162 -8.198 1.00 . A A . 11 TYR HB2 1 1 1 116 1 1 9 TYR HB3 H -7.200 -0.457 -6.673 1.00 . A A . 11 TYR HB3 1 1 1 117 1 1 9 TYR HD1 H -9.244 -2.091 -9.325 1.00 . A A . 11 TYR HD1 1 1 1 118 1 1 9 TYR HD2 H -6.529 -2.649 -6.045 1.00 . A A . 11 TYR HD2 1 1 1 119 1 1 9 TYR HE1 H -9.032 -4.491 -9.911 1.00 . A A . 11 TYR HE1 1 1 1 120 1 1 9 TYR HE2 H -6.317 -5.050 -6.630 1.00 . A A . 11 TYR HE2 1 1 1 121 1 1 9 TYR HH H -8.423 -6.643 -8.638 1.00 . A A . 11 TYR HH 1 1 1 122 1 1 9 TYR N N -9.741 0.908 -6.646 1.00 . A A . 11 TYR N 1 1 1 123 1 1 9 TYR O O -8.054 -1.273 -4.661 1.00 . A A . 11 TYR O 1 1 1 124 1 1 9 TYR OH O -7.543 -6.260 -8.634 1.00 . A A . 11 TYR OH 1 1 1 125 1 1 10 PRO C C -10.196 -2.628 -2.648 1.00 . A A . 12 PRO C 1 1 1 126 1 1 10 PRO CA C -10.166 -1.110 -2.850 1.00 . A A . 12 PRO CA 1 1 1 127 1 1 10 PRO CB C -11.441 -0.462 -2.305 1.00 . A A . 12 PRO CB 1 1 1 128 1 1 10 PRO CD C -11.511 -0.323 -4.775 1.00 . A A . 12 PRO CD 1 1 1 129 1 1 10 PRO CG C -12.394 -0.299 -3.513 1.00 . A A . 12 PRO CG 1 1 1 130 1 1 10 PRO HA H -9.299 -0.677 -2.375 1.00 . A A . 12 PRO HA 1 1 1 131 1 1 10 PRO HB2 H -11.891 -1.102 -1.557 1.00 . A A . 12 PRO HB2 1 1 1 132 1 1 10 PRO HB3 H -11.218 0.504 -1.884 1.00 . A A . 12 PRO HB3 1 1 1 133 1 1 10 PRO HD2 H -11.912 -1.013 -5.504 1.00 . A A . 12 PRO HD2 1 1 1 134 1 1 10 PRO HD3 H -11.428 0.667 -5.190 1.00 . A A . 12 PRO HD3 1 1 1 135 1 1 10 PRO HG2 H -13.104 -1.115 -3.536 1.00 . A A . 12 PRO HG2 1 1 1 136 1 1 10 PRO HG3 H -12.913 0.644 -3.450 1.00 . A A . 12 PRO HG3 1 1 1 137 1 1 10 PRO N N -10.195 -0.784 -4.287 1.00 . A A . 12 PRO N 1 1 1 138 1 1 10 PRO O O -11.201 -3.272 -2.867 1.00 . A A . 12 PRO O 1 1 1 139 1 1 11 LYS C C -8.198 -4.989 -0.798 1.00 . A A . 13 LYS C 1 1 1 140 1 1 11 LYS CA C -9.069 -4.673 -2.015 1.00 . A A . 13 LYS CA 1 1 1 141 1 1 11 LYS CB C -8.479 -5.357 -3.251 1.00 . A A . 13 LYS CB 1 1 1 142 1 1 11 LYS CD C -10.495 -5.184 -4.722 1.00 . A A . 13 LYS CD 1 1 1 143 1 1 11 LYS CE C -11.195 -4.260 -5.722 1.00 . A A . 13 LYS CE 1 1 1 144 1 1 11 LYS CG C -9.053 -4.716 -4.517 1.00 . A A . 13 LYS CG 1 1 1 145 1 1 11 LYS H H -8.301 -2.663 -2.056 1.00 . A A . 13 LYS H 1 1 1 146 1 1 11 LYS HA H -10.072 -5.035 -1.846 1.00 . A A . 13 LYS HA 1 1 1 147 1 1 11 LYS HB2 H -7.405 -5.243 -3.246 1.00 . A A . 13 LYS HB2 1 1 1 148 1 1 11 LYS HB3 H -8.731 -6.407 -3.236 1.00 . A A . 13 LYS HB3 1 1 1 149 1 1 11 LYS HD2 H -10.494 -6.194 -5.104 1.00 . A A . 13 LYS HD2 1 1 1 150 1 1 11 LYS HD3 H -11.020 -5.156 -3.779 1.00 . A A . 13 LYS HD3 1 1 1 151 1 1 11 LYS HE2 H -12.165 -3.980 -5.336 1.00 . A A . 13 LYS HE2 1 1 1 152 1 1 11 LYS HE3 H -10.597 -3.373 -5.870 1.00 . A A . 13 LYS HE3 1 1 1 153 1 1 11 LYS HG2 H -9.035 -3.641 -4.416 1.00 . A A . 13 LYS HG2 1 1 1 154 1 1 11 LYS HG3 H -8.459 -5.008 -5.369 1.00 . A A . 13 LYS HG3 1 1 1 155 1 1 11 LYS HZ1 H -10.902 -5.898 -6.971 1.00 . A A . 13 LYS HZ1 1 1 1 156 1 1 11 LYS HZ2 H -10.929 -4.405 -7.781 1.00 . A A . 13 LYS HZ2 1 1 1 157 1 1 11 LYS HZ3 H -12.375 -5.096 -7.217 1.00 . A A . 13 LYS HZ3 1 1 1 158 1 1 11 LYS N N -9.101 -3.200 -2.230 1.00 . A A . 13 LYS N 1 1 1 159 1 1 11 LYS NZ N -11.363 -4.968 -7.021 1.00 . A A . 13 LYS NZ 1 1 1 160 1 1 11 LYS O O -7.030 -5.290 -0.922 1.00 . A A . 13 LYS O 1 1 1 161 1 1 12 CYS C C -8.141 -6.691 1.983 1.00 . A A . 14 CYS C 1 1 1 162 1 1 12 CYS CA C -7.949 -5.225 1.597 1.00 . A A . 14 CYS CA 1 1 1 163 1 1 12 CYS CB C -8.402 -4.331 2.751 1.00 . A A . 14 CYS CB 1 1 1 164 1 1 12 CYS H H -9.700 -4.681 0.463 1.00 . A A . 14 CYS H 1 1 1 165 1 1 12 CYS HA H -6.905 -5.044 1.390 1.00 . A A . 14 CYS HA 1 1 1 166 1 1 12 CYS HB2 H -9.420 -4.008 2.580 1.00 . A A . 14 CYS HB2 1 1 1 167 1 1 12 CYS HB3 H -8.350 -4.883 3.677 1.00 . A A . 14 CYS HB3 1 1 1 168 1 1 12 CYS N N -8.755 -4.925 0.379 1.00 . A A . 14 CYS N 1 1 1 169 1 1 12 CYS O O -8.198 -7.035 3.148 1.00 . A A . 14 CYS O 1 1 1 170 1 1 12 CYS SG S -7.319 -2.885 2.847 1.00 . A A . 14 CYS SG 1 1 1 171 1 1 13 ALA C C -7.374 -9.829 0.601 1.00 . A A . 15 ALA C 1 1 1 172 1 1 13 ALA CA C -8.434 -9.002 1.331 1.00 . A A . 15 ALA CA 1 1 1 173 1 1 13 ALA CB C -9.827 -9.445 0.875 1.00 . A A . 15 ALA CB 1 1 1 174 1 1 13 ALA H H -8.198 -7.261 0.083 1.00 . A A . 15 ALA H 1 1 1 175 1 1 13 ALA HA H -8.340 -9.154 2.396 1.00 . A A . 15 ALA HA 1 1 1 176 1 1 13 ALA HB1 H -10.253 -10.108 1.613 1.00 . A A . 15 ALA HB1 1 1 1 177 1 1 13 ALA HB2 H -9.749 -9.962 -0.069 1.00 . A A . 15 ALA HB2 1 1 1 178 1 1 13 ALA HB3 H -10.462 -8.579 0.759 1.00 . A A . 15 ALA HB3 1 1 1 179 1 1 13 ALA N N -8.245 -7.559 1.015 1.00 . A A . 15 ALA N 1 1 1 180 1 1 13 ALA O O -7.499 -11.030 0.463 1.00 . A A . 15 ALA O 1 1 1 181 1 1 14 CYS C C -4.358 -10.648 0.437 1.00 . A A . 16 CYS C 1 1 1 182 1 1 14 CYS CA C -5.266 -9.962 -0.582 1.00 . A A . 16 CYS CA 1 1 1 183 1 1 14 CYS CB C -4.432 -9.010 -1.438 1.00 . A A . 16 CYS CB 1 1 1 184 1 1 14 CYS H H -6.242 -8.232 0.256 1.00 . A A . 16 CYS H 1 1 1 185 1 1 14 CYS HA H -5.724 -10.708 -1.215 1.00 . A A . 16 CYS HA 1 1 1 186 1 1 14 CYS HB2 H -4.011 -8.237 -0.812 1.00 . A A . 16 CYS HB2 1 1 1 187 1 1 14 CYS HB3 H -3.636 -9.566 -1.910 1.00 . A A . 16 CYS HB3 1 1 1 188 1 1 14 CYS N N -6.329 -9.201 0.134 1.00 . A A . 16 CYS N 1 1 1 189 1 1 14 CYS O O -4.128 -10.144 1.518 1.00 . A A . 16 CYS O 1 1 1 190 1 1 14 CYS SG S -5.479 -8.254 -2.707 1.00 . A A . 16 CYS SG 1 1 1 191 1 1 15 THR C C -2.123 -13.556 0.288 1.00 . A A . 17 THR C 1 1 1 192 1 1 15 THR CA C -2.947 -12.517 1.050 1.00 . A A . 17 THR CA 1 1 1 193 1 1 15 THR CB C -3.796 -13.217 2.114 1.00 . A A . 17 THR CB 1 1 1 194 1 1 15 THR CG2 C -2.911 -14.151 2.939 1.00 . A A . 17 THR CG2 1 1 1 195 1 1 15 THR H H -4.039 -12.180 -0.779 1.00 . A A . 17 THR H 1 1 1 196 1 1 15 THR HA H -2.284 -11.811 1.528 1.00 . A A . 17 THR HA 1 1 1 197 1 1 15 THR HB H -4.572 -13.795 1.634 1.00 . A A . 17 THR HB 1 1 1 198 1 1 15 THR HG1 H -5.067 -12.678 3.485 1.00 . A A . 17 THR HG1 1 1 1 199 1 1 15 THR HG21 H -1.873 -13.919 2.755 1.00 . A A . 17 THR HG21 1 1 1 200 1 1 15 THR HG22 H -3.106 -15.176 2.657 1.00 . A A . 17 THR HG22 1 1 1 201 1 1 15 THR HG23 H -3.128 -14.020 3.989 1.00 . A A . 17 THR HG23 1 1 1 202 1 1 15 THR N N -3.842 -11.795 0.100 1.00 . A A . 17 THR N 1 1 1 203 1 1 15 THR O O -2.352 -14.745 0.402 1.00 . A A . 17 THR O 1 1 1 204 1 1 15 THR OG1 O -4.387 -12.244 2.964 1.00 . A A . 17 THR OG1 1 1 1 205 1 1 16 MET C C 0.965 -13.454 -1.689 1.00 . A A . 18 MET C 1 1 1 206 1 1 16 MET CA C -0.345 -14.105 -1.254 1.00 . A A . 18 MET CA 1 1 1 207 1 1 16 MET CB C -1.118 -14.560 -2.492 1.00 . A A . 18 MET CB 1 1 1 208 1 1 16 MET CE C -2.673 -16.073 -4.491 1.00 . A A . 18 MET CE 1 1 1 209 1 1 16 MET CG C -0.305 -15.618 -3.242 1.00 . A A . 18 MET CG 1 1 1 210 1 1 16 MET H H -0.997 -12.166 -0.576 1.00 . A A . 18 MET H 1 1 1 211 1 1 16 MET HA H -0.132 -14.957 -0.631 1.00 . A A . 18 MET HA 1 1 1 212 1 1 16 MET HB2 H -2.066 -14.979 -2.188 1.00 . A A . 18 MET HB2 1 1 1 213 1 1 16 MET HB3 H -1.288 -13.714 -3.140 1.00 . A A . 18 MET HB3 1 1 1 214 1 1 16 MET HE1 H -3.285 -15.571 -3.754 1.00 . A A . 18 MET HE1 1 1 1 215 1 1 16 MET HE2 H -3.289 -16.740 -5.072 1.00 . A A . 18 MET HE2 1 1 1 216 1 1 16 MET HE3 H -2.221 -15.343 -5.147 1.00 . A A . 18 MET HE3 1 1 1 217 1 1 16 MET HG2 H 0.093 -15.190 -4.149 1.00 . A A . 18 MET HG2 1 1 1 218 1 1 16 MET HG3 H 0.507 -15.958 -2.617 1.00 . A A . 18 MET HG3 1 1 1 219 1 1 16 MET N N -1.169 -13.127 -0.491 1.00 . A A . 18 MET N 1 1 1 220 1 1 16 MET O O 2.030 -13.801 -1.219 1.00 . A A . 18 MET O 1 1 1 221 1 1 16 MET SD S -1.375 -17.018 -3.655 1.00 . A A . 18 MET SD 1 1 1 222 1 1 17 GLU C C 2.768 -11.057 -1.927 1.00 . A A . 19 GLU C 1 1 1 223 1 1 17 GLU CA C 2.133 -11.847 -3.071 1.00 . A A . 19 GLU CA 1 1 1 224 1 1 17 GLU CB C 1.786 -10.894 -4.216 1.00 . A A . 19 GLU CB 1 1 1 225 1 1 17 GLU CD C 3.301 -11.010 -6.204 1.00 . A A . 19 GLU CD 1 1 1 226 1 1 17 GLU CG C 3.076 -10.354 -4.840 1.00 . A A . 19 GLU CG 1 1 1 227 1 1 17 GLU H H 0.023 -12.264 -2.957 1.00 . A A . 19 GLU H 1 1 1 228 1 1 17 GLU HA H 2.832 -12.592 -3.423 1.00 . A A . 19 GLU HA 1 1 1 229 1 1 17 GLU HB2 H 1.216 -11.425 -4.966 1.00 . A A . 19 GLU HB2 1 1 1 230 1 1 17 GLU HB3 H 1.200 -10.072 -3.835 1.00 . A A . 19 GLU HB3 1 1 1 231 1 1 17 GLU HG2 H 2.996 -9.284 -4.964 1.00 . A A . 19 GLU HG2 1 1 1 232 1 1 17 GLU HG3 H 3.911 -10.580 -4.194 1.00 . A A . 19 GLU HG3 1 1 1 233 1 1 17 GLU N N 0.893 -12.519 -2.590 1.00 . A A . 19 GLU N 1 1 1 234 1 1 17 GLU O O 2.266 -10.028 -1.517 1.00 . A A . 19 GLU O 1 1 1 235 1 1 17 GLU OE1 O 3.601 -12.193 -6.229 1.00 . A A . 19 GLU OE1 1 1 1 236 1 1 17 GLU OE2 O 3.169 -10.320 -7.201 1.00 . A A . 19 GLU OE2 1 1 1 237 1 1 18 TYR C C 5.536 -9.786 -0.885 1.00 . A A . 20 TYR C 1 1 1 238 1 1 18 TYR CA C 4.544 -10.791 -0.301 1.00 . A A . 20 TYR CA 1 1 1 239 1 1 18 TYR CB C 5.291 -11.779 0.597 1.00 . A A . 20 TYR CB 1 1 1 240 1 1 18 TYR CD1 C 6.317 -10.246 2.319 1.00 . A A . 20 TYR CD1 1 1 1 241 1 1 18 TYR CD2 C 4.479 -11.681 2.984 1.00 . A A . 20 TYR CD2 1 1 1 242 1 1 18 TYR CE1 C 6.386 -9.731 3.619 1.00 . A A . 20 TYR CE1 1 1 1 243 1 1 18 TYR CE2 C 4.547 -11.165 4.285 1.00 . A A . 20 TYR CE2 1 1 1 244 1 1 18 TYR CG C 5.365 -11.223 2.001 1.00 . A A . 20 TYR CG 1 1 1 245 1 1 18 TYR CZ C 5.501 -10.190 4.603 1.00 . A A . 20 TYR CZ 1 1 1 246 1 1 18 TYR H H 4.266 -12.350 -1.760 1.00 . A A . 20 TYR H 1 1 1 247 1 1 18 TYR HA H 3.802 -10.265 0.281 1.00 . A A . 20 TYR HA 1 1 1 248 1 1 18 TYR HB2 H 4.766 -12.723 0.611 1.00 . A A . 20 TYR HB2 1 1 1 249 1 1 18 TYR HB3 H 6.290 -11.925 0.217 1.00 . A A . 20 TYR HB3 1 1 1 250 1 1 18 TYR HD1 H 7.001 -9.892 1.561 1.00 . A A . 20 TYR HD1 1 1 1 251 1 1 18 TYR HD2 H 3.744 -12.434 2.739 1.00 . A A . 20 TYR HD2 1 1 1 252 1 1 18 TYR HE1 H 7.121 -8.977 3.863 1.00 . A A . 20 TYR HE1 1 1 1 253 1 1 18 TYR HE2 H 3.863 -11.520 5.043 1.00 . A A . 20 TYR HE2 1 1 1 254 1 1 18 TYR HH H 4.705 -9.327 6.111 1.00 . A A . 20 TYR HH 1 1 1 255 1 1 18 TYR N N 3.874 -11.523 -1.412 1.00 . A A . 20 TYR N 1 1 1 256 1 1 18 TYR O O 6.450 -10.139 -1.605 1.00 . A A . 20 TYR O 1 1 1 257 1 1 18 TYR OH O 5.569 -9.681 5.885 1.00 . A A . 20 TYR OH 1 1 1 258 1 1 19 ARG C C 6.340 -6.331 -0.108 1.00 . A A . 21 ARG C 1 1 1 259 1 1 19 ARG CA C 6.285 -7.493 -1.103 1.00 . A A . 21 ARG CA 1 1 1 260 1 1 19 ARG CB C 5.772 -6.984 -2.452 1.00 . A A . 21 ARG CB 1 1 1 261 1 1 19 ARG CD C 6.546 -7.859 -4.661 1.00 . A A . 21 ARG CD 1 1 1 262 1 1 19 ARG CG C 6.920 -6.988 -3.461 1.00 . A A . 21 ARG CG 1 1 1 263 1 1 19 ARG CZ C 6.896 -10.258 -4.636 1.00 . A A . 21 ARG CZ 1 1 1 264 1 1 19 ARG H H 4.620 -8.276 0.007 1.00 . A A . 21 ARG H 1 1 1 265 1 1 19 ARG HA H 7.269 -7.916 -1.231 1.00 . A A . 21 ARG HA 1 1 1 266 1 1 19 ARG HB2 H 4.979 -7.628 -2.803 1.00 . A A . 21 ARG HB2 1 1 1 267 1 1 19 ARG HB3 H 5.398 -5.977 -2.340 1.00 . A A . 21 ARG HB3 1 1 1 268 1 1 19 ARG HD2 H 5.688 -7.434 -5.160 1.00 . A A . 21 ARG HD2 1 1 1 269 1 1 19 ARG HD3 H 7.378 -7.901 -5.348 1.00 . A A . 21 ARG HD3 1 1 1 270 1 1 19 ARG HE H 5.492 -9.372 -3.548 1.00 . A A . 21 ARG HE 1 1 1 271 1 1 19 ARG HG2 H 7.113 -5.978 -3.793 1.00 . A A . 21 ARG HG2 1 1 1 272 1 1 19 ARG HG3 H 7.809 -7.388 -2.993 1.00 . A A . 21 ARG HG3 1 1 1 273 1 1 19 ARG HH11 H 5.871 -10.395 -6.349 1.00 . A A . 21 ARG HH11 1 1 1 274 1 1 19 ARG HH12 H 7.131 -11.563 -6.136 1.00 . A A . 21 ARG HH12 1 1 1 275 1 1 19 ARG HH21 H 8.083 -10.366 -3.028 1.00 . A A . 21 ARG HH21 1 1 1 276 1 1 19 ARG HH22 H 8.381 -11.546 -4.259 1.00 . A A . 21 ARG HH22 1 1 1 277 1 1 19 ARG N N 5.361 -8.533 -0.577 1.00 . A A . 21 ARG N 1 1 1 278 1 1 19 ARG NE N 6.217 -9.235 -4.193 1.00 . A A . 21 ARG NE 1 1 1 279 1 1 19 ARG NH1 N 6.610 -10.778 -5.798 1.00 . A A . 21 ARG NH1 1 1 1 280 1 1 19 ARG NH2 N 7.862 -10.762 -3.918 1.00 . A A . 21 ARG NH2 1 1 1 281 1 1 19 ARG O O 5.411 -5.554 -0.020 1.00 . A A . 21 ARG O 1 1 1 282 1 1 20 PRO C C 8.007 -3.875 0.946 1.00 . A A . 22 PRO C 1 1 1 283 1 1 20 PRO CA C 7.617 -5.192 1.628 1.00 . A A . 22 PRO CA 1 1 1 284 1 1 20 PRO CB C 8.758 -5.729 2.495 1.00 . A A . 22 PRO CB 1 1 1 285 1 1 20 PRO CD C 8.557 -7.194 0.511 1.00 . A A . 22 PRO CD 1 1 1 286 1 1 20 PRO CG C 9.523 -6.757 1.625 1.00 . A A . 22 PRO CG 1 1 1 287 1 1 20 PRO HA H 6.728 -5.065 2.224 1.00 . A A . 22 PRO HA 1 1 1 288 1 1 20 PRO HB2 H 9.414 -4.920 2.786 1.00 . A A . 22 PRO HB2 1 1 1 289 1 1 20 PRO HB3 H 8.359 -6.221 3.369 1.00 . A A . 22 PRO HB3 1 1 1 290 1 1 20 PRO HD2 H 9.034 -7.105 -0.457 1.00 . A A . 22 PRO HD2 1 1 1 291 1 1 20 PRO HD3 H 8.216 -8.203 0.676 1.00 . A A . 22 PRO HD3 1 1 1 292 1 1 20 PRO HG2 H 10.402 -6.296 1.196 1.00 . A A . 22 PRO HG2 1 1 1 293 1 1 20 PRO HG3 H 9.804 -7.613 2.219 1.00 . A A . 22 PRO HG3 1 1 1 294 1 1 20 PRO N N 7.425 -6.249 0.622 1.00 . A A . 22 PRO N 1 1 1 295 1 1 20 PRO O O 9.163 -3.624 0.669 1.00 . A A . 22 PRO O 1 1 1 296 1 1 21 LEU C C 7.427 -0.624 1.037 1.00 . A A . 23 LEU C 1 1 1 297 1 1 21 LEU CA C 7.342 -1.737 -0.001 1.00 . A A . 23 LEU CA 1 1 1 298 1 1 21 LEU CB C 6.204 -1.389 -0.963 1.00 . A A . 23 LEU CB 1 1 1 299 1 1 21 LEU CD1 C 4.353 -2.339 -2.337 1.00 . A A . 23 LEU CD1 1 1 1 300 1 1 21 LEU CD2 C 6.667 -3.245 -2.561 1.00 . A A . 23 LEU CD2 1 1 1 301 1 1 21 LEU CG C 5.643 -2.666 -1.585 1.00 . A A . 23 LEU CG 1 1 1 302 1 1 21 LEU H H 6.120 -3.265 0.901 1.00 . A A . 23 LEU H 1 1 1 303 1 1 21 LEU HA H 8.271 -1.806 -0.545 1.00 . A A . 23 LEU HA 1 1 1 304 1 1 21 LEU HB2 H 5.420 -0.885 -0.415 1.00 . A A . 23 LEU HB2 1 1 1 305 1 1 21 LEU HB3 H 6.572 -0.735 -1.741 1.00 . A A . 23 LEU HB3 1 1 1 306 1 1 21 LEU HD11 H 3.729 -3.218 -2.381 1.00 . A A . 23 LEU HD11 1 1 1 307 1 1 21 LEU HD12 H 4.593 -2.015 -3.339 1.00 . A A . 23 LEU HD12 1 1 1 308 1 1 21 LEU HD13 H 3.827 -1.549 -1.820 1.00 . A A . 23 LEU HD13 1 1 1 309 1 1 21 LEU HD21 H 7.309 -3.940 -2.040 1.00 . A A . 23 LEU HD21 1 1 1 310 1 1 21 LEU HD22 H 7.262 -2.444 -2.969 1.00 . A A . 23 LEU HD22 1 1 1 311 1 1 21 LEU HD23 H 6.153 -3.758 -3.360 1.00 . A A . 23 LEU HD23 1 1 1 312 1 1 21 LEU HG H 5.433 -3.387 -0.809 1.00 . A A . 23 LEU HG 1 1 1 313 1 1 21 LEU N N 7.044 -3.037 0.670 1.00 . A A . 23 LEU N 1 1 1 314 1 1 21 LEU O O 6.688 -0.606 1.990 1.00 . A A . 23 LEU O 1 1 1 315 1 1 22 CYS C C 7.328 2.496 1.371 1.00 . A A . 24 CYS C 1 1 1 316 1 1 22 CYS CA C 8.352 1.457 1.814 1.00 . A A . 24 CYS CA 1 1 1 317 1 1 22 CYS CB C 9.753 2.069 1.799 1.00 . A A . 24 CYS CB 1 1 1 318 1 1 22 CYS H H 8.853 0.333 0.043 1.00 . A A . 24 CYS H 1 1 1 319 1 1 22 CYS HA H 8.111 1.101 2.805 1.00 . A A . 24 CYS HA 1 1 1 320 1 1 22 CYS HB2 H 10.481 1.309 2.045 1.00 . A A . 24 CYS HB2 1 1 1 321 1 1 22 CYS HB3 H 9.962 2.465 0.817 1.00 . A A . 24 CYS HB3 1 1 1 322 1 1 22 CYS N N 8.282 0.335 0.841 1.00 . A A . 24 CYS N 1 1 1 323 1 1 22 CYS O O 7.580 3.295 0.497 1.00 . A A . 24 CYS O 1 1 1 324 1 1 22 CYS SG S 9.835 3.402 3.020 1.00 . A A . 24 CYS SG 1 1 1 325 1 1 23 GLY C C 5.270 4.762 2.193 1.00 . A A . 25 GLY C 1 1 1 326 1 1 23 GLY CA C 5.093 3.412 1.517 1.00 . A A . 25 GLY CA 1 1 1 327 1 1 23 GLY H H 5.963 1.792 2.630 1.00 . A A . 25 GLY H 1 1 1 328 1 1 23 GLY HA2 H 5.136 3.539 0.446 1.00 . A A . 25 GLY HA2 1 1 1 329 1 1 23 GLY HA3 H 4.130 3.005 1.786 1.00 . A A . 25 GLY HA3 1 1 1 330 1 1 23 GLY N N 6.155 2.461 1.940 1.00 . A A . 25 GLY N 1 1 1 331 1 1 23 GLY O O 5.696 4.853 3.338 1.00 . A A . 25 GLY O 1 1 1 332 1 1 24 SER C C 4.234 7.266 3.385 1.00 . A A . 26 SER C 1 1 1 333 1 1 24 SER CA C 5.021 7.185 2.072 1.00 . A A . 26 SER CA 1 1 1 334 1 1 24 SER CB C 4.462 8.207 1.084 1.00 . A A . 26 SER CB 1 1 1 335 1 1 24 SER H H 4.551 5.701 0.579 1.00 . A A . 26 SER H 1 1 1 336 1 1 24 SER HA H 6.059 7.407 2.266 1.00 . A A . 26 SER HA 1 1 1 337 1 1 24 SER HB2 H 3.943 7.698 0.290 1.00 . A A . 26 SER HB2 1 1 1 338 1 1 24 SER HB3 H 3.771 8.865 1.597 1.00 . A A . 26 SER HB3 1 1 1 339 1 1 24 SER HG H 5.517 8.857 -0.418 1.00 . A A . 26 SER HG 1 1 1 340 1 1 24 SER N N 4.910 5.817 1.493 1.00 . A A . 26 SER N 1 1 1 341 1 1 24 SER O O 4.289 8.257 4.085 1.00 . A A . 26 SER O 1 1 1 342 1 1 24 SER OG O 5.537 8.959 0.536 1.00 . A A . 26 SER OG 1 1 1 343 1 1 25 ASP C C 3.689 6.040 6.185 1.00 . A A . 27 ASP C 1 1 1 344 1 1 25 ASP CA C 2.740 6.274 5.002 1.00 . A A . 27 ASP CA 1 1 1 345 1 1 25 ASP CB C 1.672 5.180 4.969 1.00 . A A . 27 ASP CB 1 1 1 346 1 1 25 ASP CG C 2.334 3.817 5.164 1.00 . A A . 27 ASP CG 1 1 1 347 1 1 25 ASP H H 3.462 5.446 3.167 1.00 . A A . 27 ASP H 1 1 1 348 1 1 25 ASP HA H 2.265 7.238 5.107 1.00 . A A . 27 ASP HA 1 1 1 349 1 1 25 ASP HB2 H 0.954 5.351 5.758 1.00 . A A . 27 ASP HB2 1 1 1 350 1 1 25 ASP HB3 H 1.170 5.196 4.015 1.00 . A A . 27 ASP HB3 1 1 1 351 1 1 25 ASP N N 3.509 6.237 3.735 1.00 . A A . 27 ASP N 1 1 1 352 1 1 25 ASP O O 3.261 5.918 7.314 1.00 . A A . 27 ASP O 1 1 1 353 1 1 25 ASP OD1 O 3.098 3.422 4.298 1.00 . A A . 27 ASP OD1 1 1 1 354 1 1 25 ASP OD2 O 2.066 3.189 6.175 1.00 . A A . 27 ASP OD2 1 1 1 355 1 1 26 ASN C C 6.058 4.332 7.439 1.00 . A A . 28 ASN C 1 1 1 356 1 1 26 ASN CA C 5.961 5.805 7.040 1.00 . A A . 28 ASN CA 1 1 1 357 1 1 26 ASN CB C 5.517 6.621 8.258 1.00 . A A . 28 ASN CB 1 1 1 358 1 1 26 ASN CG C 6.742 7.216 8.960 1.00 . A A . 28 ASN CG 1 1 1 359 1 1 26 ASN H H 5.300 6.111 5.018 1.00 . A A . 28 ASN H 1 1 1 360 1 1 26 ASN HA H 6.930 6.150 6.717 1.00 . A A . 28 ASN HA 1 1 1 361 1 1 26 ASN HB2 H 4.863 7.420 7.938 1.00 . A A . 28 ASN HB2 1 1 1 362 1 1 26 ASN HB3 H 4.989 5.979 8.948 1.00 . A A . 28 ASN HB3 1 1 1 363 1 1 26 ASN HD21 H 7.988 5.815 8.302 1.00 . A A . 28 ASN HD21 1 1 1 364 1 1 26 ASN HD22 H 8.689 7.007 9.288 1.00 . A A . 28 ASN HD22 1 1 1 365 1 1 26 ASN N N 4.977 5.997 5.933 1.00 . A A . 28 ASN N 1 1 1 366 1 1 26 ASN ND2 N 7.903 6.631 8.839 1.00 . A A . 28 ASN ND2 1 1 1 367 1 1 26 ASN O O 6.499 4.018 8.526 1.00 . A A . 28 ASN O 1 1 1 368 1 1 26 ASN OD1 O 6.640 8.224 9.631 1.00 . A A . 28 ASN OD1 1 1 1 369 1 1 27 LYS C C 5.927 1.111 5.768 1.00 . A A . 29 LYS C 1 1 1 370 1 1 27 LYS CA C 5.782 1.985 6.998 1.00 . A A . 29 LYS CA 1 1 1 371 1 1 27 LYS CB C 4.545 1.560 7.787 1.00 . A A . 29 LYS CB 1 1 1 372 1 1 27 LYS CD C 5.145 0.264 9.841 1.00 . A A . 29 LYS CD 1 1 1 373 1 1 27 LYS CE C 6.208 0.363 10.943 1.00 . A A . 29 LYS CE 1 1 1 374 1 1 27 LYS CG C 4.845 1.658 9.286 1.00 . A A . 29 LYS CG 1 1 1 375 1 1 27 LYS H H 5.324 3.665 5.697 1.00 . A A . 29 LYS H 1 1 1 376 1 1 27 LYS HA H 6.657 1.860 7.617 1.00 . A A . 29 LYS HA 1 1 1 377 1 1 27 LYS HB2 H 3.715 2.206 7.537 1.00 . A A . 29 LYS HB2 1 1 1 378 1 1 27 LYS HB3 H 4.295 0.539 7.540 1.00 . A A . 29 LYS HB3 1 1 1 379 1 1 27 LYS HD2 H 4.239 -0.160 10.251 1.00 . A A . 29 LYS HD2 1 1 1 380 1 1 27 LYS HD3 H 5.510 -0.368 9.046 1.00 . A A . 29 LYS HD3 1 1 1 381 1 1 27 LYS HE2 H 6.458 1.401 11.107 1.00 . A A . 29 LYS HE2 1 1 1 382 1 1 27 LYS HE3 H 5.818 -0.061 11.856 1.00 . A A . 29 LYS HE3 1 1 1 383 1 1 27 LYS HG2 H 5.702 2.299 9.439 1.00 . A A . 29 LYS HG2 1 1 1 384 1 1 27 LYS HG3 H 3.989 2.073 9.800 1.00 . A A . 29 LYS HG3 1 1 1 385 1 1 27 LYS HZ1 H 7.226 -1.401 10.488 1.00 . A A . 29 LYS HZ1 1 1 1 386 1 1 27 LYS HZ2 H 8.192 -0.214 11.228 1.00 . A A . 29 LYS HZ2 1 1 1 387 1 1 27 LYS HZ3 H 7.745 -0.055 9.596 1.00 . A A . 29 LYS HZ3 1 1 1 388 1 1 27 LYS N N 5.669 3.418 6.593 1.00 . A A . 29 LYS N 1 1 1 389 1 1 27 LYS NZ N 7.435 -0.383 10.532 1.00 . A A . 29 LYS NZ 1 1 1 390 1 1 27 LYS O O 5.838 1.577 4.655 1.00 . A A . 29 LYS O 1 1 1 391 1 1 28 THR C C 4.894 -1.579 4.386 1.00 . A A . 30 THR C 1 1 1 392 1 1 28 THR CA C 6.280 -1.053 4.784 1.00 . A A . 30 THR CA 1 1 1 393 1 1 28 THR CB C 7.222 -2.211 5.119 1.00 . A A . 30 THR CB 1 1 1 394 1 1 28 THR CG2 C 7.411 -3.083 3.876 1.00 . A A . 30 THR CG2 1 1 1 395 1 1 28 THR H H 6.203 -0.518 6.867 1.00 . A A . 30 THR H 1 1 1 396 1 1 28 THR HA H 6.691 -0.486 3.969 1.00 . A A . 30 THR HA 1 1 1 397 1 1 28 THR HB H 6.800 -2.806 5.914 1.00 . A A . 30 THR HB 1 1 1 398 1 1 28 THR HG1 H 8.331 -0.813 5.908 1.00 . A A . 30 THR HG1 1 1 1 399 1 1 28 THR HG21 H 8.373 -3.571 3.921 1.00 . A A . 30 THR HG21 1 1 1 400 1 1 28 THR HG22 H 7.362 -2.464 2.992 1.00 . A A . 30 THR HG22 1 1 1 401 1 1 28 THR HG23 H 6.631 -3.830 3.836 1.00 . A A . 30 THR HG23 1 1 1 402 1 1 28 THR N N 6.140 -0.158 5.957 1.00 . A A . 30 THR N 1 1 1 403 1 1 28 THR O O 3.947 -1.489 5.142 1.00 . A A . 30 THR O 1 1 1 404 1 1 28 THR OG1 O 8.481 -1.684 5.531 1.00 . A A . 30 THR OG1 1 1 1 405 1 1 29 TYR C C 3.516 -4.119 2.498 1.00 . A A . 31 TYR C 1 1 1 406 1 1 29 TYR CA C 3.436 -2.612 2.748 1.00 . A A . 31 TYR CA 1 1 1 407 1 1 29 TYR CB C 3.057 -1.901 1.446 1.00 . A A . 31 TYR CB 1 1 1 408 1 1 29 TYR CD1 C 1.043 -0.773 2.467 1.00 . A A . 31 TYR CD1 1 1 1 409 1 1 29 TYR CD2 C 2.700 0.597 1.341 1.00 . A A . 31 TYR CD2 1 1 1 410 1 1 29 TYR CE1 C 0.294 0.376 2.758 1.00 . A A . 31 TYR CE1 1 1 1 411 1 1 29 TYR CE2 C 1.951 1.743 1.633 1.00 . A A . 31 TYR CE2 1 1 1 412 1 1 29 TYR CG C 2.246 -0.662 1.758 1.00 . A A . 31 TYR CG 1 1 1 413 1 1 29 TYR CZ C 0.748 1.633 2.340 1.00 . A A . 31 TYR CZ 1 1 1 414 1 1 29 TYR H H 5.529 -2.162 2.600 1.00 . A A . 31 TYR H 1 1 1 415 1 1 29 TYR HA H 2.689 -2.407 3.500 1.00 . A A . 31 TYR HA 1 1 1 416 1 1 29 TYR HB2 H 3.957 -1.616 0.919 1.00 . A A . 31 TYR HB2 1 1 1 417 1 1 29 TYR HB3 H 2.476 -2.568 0.830 1.00 . A A . 31 TYR HB3 1 1 1 418 1 1 29 TYR HD1 H 0.691 -1.741 2.789 1.00 . A A . 31 TYR HD1 1 1 1 419 1 1 29 TYR HD2 H 3.628 0.685 0.794 1.00 . A A . 31 TYR HD2 1 1 1 420 1 1 29 TYR HE1 H -0.633 0.291 3.305 1.00 . A A . 31 TYR HE1 1 1 1 421 1 1 29 TYR HE2 H 2.301 2.714 1.312 1.00 . A A . 31 TYR HE2 1 1 1 422 1 1 29 TYR HH H 0.500 3.525 2.311 1.00 . A A . 31 TYR HH 1 1 1 423 1 1 29 TYR N N 4.762 -2.107 3.200 1.00 . A A . 31 TYR N 1 1 1 424 1 1 29 TYR O O 4.571 -4.661 2.239 1.00 . A A . 31 TYR O 1 1 1 425 1 1 29 TYR OH O 0.010 2.763 2.627 1.00 . A A . 31 TYR OH 1 1 1 426 1 1 30 GLY C C 2.355 -6.543 0.824 1.00 . A A . 32 GLY C 1 1 1 427 1 1 30 GLY CA C 2.422 -6.272 2.328 1.00 . A A . 32 GLY CA 1 1 1 428 1 1 30 GLY H H 1.562 -4.349 2.776 1.00 . A A . 32 GLY H 1 1 1 429 1 1 30 GLY HA2 H 3.337 -6.690 2.728 1.00 . A A . 32 GLY HA2 1 1 1 430 1 1 30 GLY HA3 H 1.575 -6.728 2.814 1.00 . A A . 32 GLY HA3 1 1 1 431 1 1 30 GLY N N 2.406 -4.802 2.568 1.00 . A A . 32 GLY N 1 1 1 432 1 1 30 GLY O O 2.681 -7.619 0.363 1.00 . A A . 32 GLY O 1 1 1 433 1 1 31 ASN C C 1.126 -4.601 -2.069 1.00 . A A . 33 ASN C 1 1 1 434 1 1 31 ASN CA C 1.853 -5.784 -1.424 1.00 . A A . 33 ASN CA 1 1 1 435 1 1 31 ASN CB C 1.098 -7.083 -1.724 1.00 . A A . 33 ASN CB 1 1 1 436 1 1 31 ASN CG C -0.133 -7.187 -0.824 1.00 . A A . 33 ASN CG 1 1 1 437 1 1 31 ASN H H 1.673 -4.717 0.437 1.00 . A A . 33 ASN H 1 1 1 438 1 1 31 ASN HA H 2.851 -5.852 -1.829 1.00 . A A . 33 ASN HA 1 1 1 439 1 1 31 ASN HB2 H 0.787 -7.085 -2.759 1.00 . A A . 33 ASN HB2 1 1 1 440 1 1 31 ASN HB3 H 1.746 -7.928 -1.542 1.00 . A A . 33 ASN HB3 1 1 1 441 1 1 31 ASN HD21 H 0.520 -8.808 0.122 1.00 . A A . 33 ASN HD21 1 1 1 442 1 1 31 ASN HD22 H -0.995 -8.234 0.627 1.00 . A A . 33 ASN HD22 1 1 1 443 1 1 31 ASN N N 1.934 -5.578 0.050 1.00 . A A . 33 ASN N 1 1 1 444 1 1 31 ASN ND2 N -0.209 -8.156 0.048 1.00 . A A . 33 ASN ND2 1 1 1 445 1 1 31 ASN O O 0.528 -3.785 -1.398 1.00 . A A . 33 ASN O 1 1 1 446 1 1 31 ASN OD1 O -1.036 -6.382 -0.919 1.00 . A A . 33 ASN OD1 1 1 1 447 1 1 32 LYS C C -0.999 -3.433 -3.791 1.00 . A A . 34 LYS C 1 1 1 448 1 1 32 LYS CA C 0.502 -3.374 -4.067 1.00 . A A . 34 LYS CA 1 1 1 449 1 1 32 LYS CB C 0.745 -3.483 -5.575 1.00 . A A . 34 LYS CB 1 1 1 450 1 1 32 LYS CD C -1.231 -4.485 -6.735 1.00 . A A . 34 LYS CD 1 1 1 451 1 1 32 LYS CE C -1.102 -4.493 -8.260 1.00 . A A . 34 LYS CE 1 1 1 452 1 1 32 LYS CG C 0.130 -4.783 -6.103 1.00 . A A . 34 LYS CG 1 1 1 453 1 1 32 LYS H H 1.674 -5.166 -3.886 1.00 . A A . 34 LYS H 1 1 1 454 1 1 32 LYS HA H 0.894 -2.436 -3.706 1.00 . A A . 34 LYS HA 1 1 1 455 1 1 32 LYS HB2 H 0.290 -2.641 -6.074 1.00 . A A . 34 LYS HB2 1 1 1 456 1 1 32 LYS HB3 H 1.806 -3.485 -5.768 1.00 . A A . 34 LYS HB3 1 1 1 457 1 1 32 LYS HD2 H -1.941 -5.242 -6.431 1.00 . A A . 34 LYS HD2 1 1 1 458 1 1 32 LYS HD3 H -1.576 -3.517 -6.409 1.00 . A A . 34 LYS HD3 1 1 1 459 1 1 32 LYS HE2 H -0.084 -4.259 -8.535 1.00 . A A . 34 LYS HE2 1 1 1 460 1 1 32 LYS HE3 H -1.362 -5.470 -8.639 1.00 . A A . 34 LYS HE3 1 1 1 461 1 1 32 LYS HG2 H 0.787 -5.213 -6.846 1.00 . A A . 34 LYS HG2 1 1 1 462 1 1 32 LYS HG3 H 0.002 -5.478 -5.288 1.00 . A A . 34 LYS HG3 1 1 1 463 1 1 32 LYS HZ1 H -1.492 -2.597 -9.025 1.00 . A A . 34 LYS HZ1 1 1 1 464 1 1 32 LYS HZ2 H -2.791 -3.280 -8.170 1.00 . A A . 34 LYS HZ2 1 1 1 465 1 1 32 LYS HZ3 H -2.416 -3.831 -9.732 1.00 . A A . 34 LYS HZ3 1 1 1 466 1 1 32 LYS N N 1.182 -4.501 -3.369 1.00 . A A . 34 LYS N 1 1 1 467 1 1 32 LYS NZ N -2.020 -3.473 -8.841 1.00 . A A . 34 LYS NZ 1 1 1 468 1 1 32 LYS O O -1.708 -2.459 -3.947 1.00 . A A . 34 LYS O 1 1 1 469 1 1 33 CYS C C -3.226 -3.890 -1.787 1.00 . A A . 35 CYS C 1 1 1 470 1 1 33 CYS CA C -2.942 -4.667 -3.073 1.00 . A A . 35 CYS CA 1 1 1 471 1 1 33 CYS CB C -3.321 -6.140 -2.899 1.00 . A A . 35 CYS CB 1 1 1 472 1 1 33 CYS H H -0.901 -5.340 -3.236 1.00 . A A . 35 CYS H 1 1 1 473 1 1 33 CYS HA H -3.508 -4.240 -3.887 1.00 . A A . 35 CYS HA 1 1 1 474 1 1 33 CYS HB2 H -3.088 -6.680 -3.805 1.00 . A A . 35 CYS HB2 1 1 1 475 1 1 33 CYS HB3 H -2.764 -6.561 -2.076 1.00 . A A . 35 CYS HB3 1 1 1 476 1 1 33 CYS N N -1.489 -4.564 -3.369 1.00 . A A . 35 CYS N 1 1 1 477 1 1 33 CYS O O -4.270 -3.289 -1.624 1.00 . A A . 35 CYS O 1 1 1 478 1 1 33 CYS SG S -5.093 -6.276 -2.560 1.00 . A A . 35 CYS SG 1 1 1 479 1 1 34 ASN C C -2.111 -1.667 0.126 1.00 . A A . 36 ASN C 1 1 1 480 1 1 34 ASN CA C -2.463 -3.131 0.381 1.00 . A A . 36 ASN CA 1 1 1 481 1 1 34 ASN CB C -1.520 -3.707 1.438 1.00 . A A . 36 ASN CB 1 1 1 482 1 1 34 ASN CG C -2.300 -3.997 2.721 1.00 . A A . 36 ASN CG 1 1 1 483 1 1 34 ASN H H -1.445 -4.352 -1.050 1.00 . A A . 36 ASN H 1 1 1 484 1 1 34 ASN HA H -3.486 -3.212 0.717 1.00 . A A . 36 ASN HA 1 1 1 485 1 1 34 ASN HB2 H -1.081 -4.623 1.067 1.00 . A A . 36 ASN HB2 1 1 1 486 1 1 34 ASN HB3 H -0.739 -2.996 1.643 1.00 . A A . 36 ASN HB3 1 1 1 487 1 1 34 ASN HD21 H -3.689 -5.072 1.797 1.00 . A A . 36 ASN HD21 1 1 1 488 1 1 34 ASN HD22 H -3.890 -4.915 3.475 1.00 . A A . 36 ASN HD22 1 1 1 489 1 1 34 ASN N N -2.285 -3.881 -0.886 1.00 . A A . 36 ASN N 1 1 1 490 1 1 34 ASN ND2 N -3.383 -4.721 2.659 1.00 . A A . 36 ASN ND2 1 1 1 491 1 1 34 ASN O O -2.480 -0.782 0.873 1.00 . A A . 36 ASN O 1 1 1 492 1 1 34 ASN OD1 O -1.920 -3.560 3.789 1.00 . A A . 36 ASN OD1 1 1 1 493 1 1 35 PHE C C -2.195 0.710 -1.877 1.00 . A A . 37 PHE C 1 1 1 494 1 1 35 PHE CA C -1.000 -0.018 -1.261 1.00 . A A . 37 PHE CA 1 1 1 495 1 1 35 PHE CB C 0.164 -0.054 -2.256 1.00 . A A . 37 PHE CB 1 1 1 496 1 1 35 PHE CD1 C -0.115 2.185 -3.390 1.00 . A A . 37 PHE CD1 1 1 1 497 1 1 35 PHE CD2 C 1.825 1.818 -1.981 1.00 . A A . 37 PHE CD2 1 1 1 498 1 1 35 PHE CE1 C 0.327 3.485 -3.661 1.00 . A A . 37 PHE CE1 1 1 1 499 1 1 35 PHE CE2 C 2.268 3.118 -2.252 1.00 . A A . 37 PHE CE2 1 1 1 500 1 1 35 PHE CG C 0.635 1.351 -2.548 1.00 . A A . 37 PHE CG 1 1 1 501 1 1 35 PHE CZ C 1.519 3.952 -3.092 1.00 . A A . 37 PHE CZ 1 1 1 502 1 1 35 PHE H H -1.108 -2.146 -1.516 1.00 . A A . 37 PHE H 1 1 1 503 1 1 35 PHE HA H -0.695 0.492 -0.361 1.00 . A A . 37 PHE HA 1 1 1 504 1 1 35 PHE HB2 H 0.978 -0.624 -1.831 1.00 . A A . 37 PHE HB2 1 1 1 505 1 1 35 PHE HB3 H -0.160 -0.523 -3.175 1.00 . A A . 37 PHE HB3 1 1 1 506 1 1 35 PHE HD1 H -1.034 1.826 -3.828 1.00 . A A . 37 PHE HD1 1 1 1 507 1 1 35 PHE HD2 H 2.403 1.176 -1.331 1.00 . A A . 37 PHE HD2 1 1 1 508 1 1 35 PHE HE1 H -0.249 4.128 -4.309 1.00 . A A . 37 PHE HE1 1 1 1 509 1 1 35 PHE HE2 H 3.186 3.479 -1.814 1.00 . A A . 37 PHE HE2 1 1 1 510 1 1 35 PHE HZ H 1.861 4.953 -3.303 1.00 . A A . 37 PHE HZ 1 1 1 511 1 1 35 PHE N N -1.392 -1.412 -0.932 1.00 . A A . 37 PHE N 1 1 1 512 1 1 35 PHE O O -2.463 1.855 -1.571 1.00 . A A . 37 PHE O 1 1 1 513 1 1 36 CYS C C -5.262 0.687 -2.369 1.00 . A A . 38 CYS C 1 1 1 514 1 1 36 CYS CA C -4.103 0.700 -3.365 1.00 . A A . 38 CYS CA 1 1 1 515 1 1 36 CYS CB C -4.501 -0.068 -4.628 1.00 . A A . 38 CYS CB 1 1 1 516 1 1 36 CYS H H -2.691 -0.872 -2.967 1.00 . A A . 38 CYS H 1 1 1 517 1 1 36 CYS HA H -3.860 1.720 -3.623 1.00 . A A . 38 CYS HA 1 1 1 518 1 1 36 CYS HB2 H -4.505 -1.128 -4.417 1.00 . A A . 38 CYS HB2 1 1 1 519 1 1 36 CYS HB3 H -5.488 0.239 -4.940 1.00 . A A . 38 CYS HB3 1 1 1 520 1 1 36 CYS N N -2.920 0.051 -2.738 1.00 . A A . 38 CYS N 1 1 1 521 1 1 36 CYS O O -6.207 1.442 -2.487 1.00 . A A . 38 CYS O 1 1 1 522 1 1 36 CYS SG S -3.312 0.284 -5.946 1.00 . A A . 38 CYS SG 1 1 1 523 1 1 37 CYS C C -6.088 0.884 0.658 1.00 . A A . 39 CYS C 1 1 1 524 1 1 37 CYS CA C -6.294 -0.221 -0.377 1.00 . A A . 39 CYS CA 1 1 1 525 1 1 37 CYS CB C -6.290 -1.581 0.319 1.00 . A A . 39 CYS CB 1 1 1 526 1 1 37 CYS H H -4.421 -0.766 -1.298 1.00 . A A . 39 CYS H 1 1 1 527 1 1 37 CYS HA H -7.239 -0.073 -0.873 1.00 . A A . 39 CYS HA 1 1 1 528 1 1 37 CYS HB2 H -6.205 -2.364 -0.421 1.00 . A A . 39 CYS HB2 1 1 1 529 1 1 37 CYS HB3 H -5.454 -1.636 1.000 1.00 . A A . 39 CYS HB3 1 1 1 530 1 1 37 CYS N N -5.195 -0.165 -1.381 1.00 . A A . 39 CYS N 1 1 1 531 1 1 37 CYS O O -7.008 1.586 1.025 1.00 . A A . 39 CYS O 1 1 1 532 1 1 37 CYS SG S -7.836 -1.781 1.238 1.00 . A A . 39 CYS SG 1 1 1 533 1 1 38 ALA C C -4.851 3.473 1.453 1.00 . A A . 40 ALA C 1 1 1 534 1 1 38 ALA CA C -4.614 2.120 2.120 1.00 . A A . 40 ALA CA 1 1 1 535 1 1 38 ALA CB C -3.164 2.027 2.600 1.00 . A A . 40 ALA CB 1 1 1 536 1 1 38 ALA H H -4.154 0.483 0.802 1.00 . A A . 40 ALA H 1 1 1 537 1 1 38 ALA HA H -5.284 2.008 2.960 1.00 . A A . 40 ALA HA 1 1 1 538 1 1 38 ALA HB1 H -3.057 1.177 3.259 1.00 . A A . 40 ALA HB1 1 1 1 539 1 1 38 ALA HB2 H -2.902 2.929 3.133 1.00 . A A . 40 ALA HB2 1 1 1 540 1 1 38 ALA HB3 H -2.509 1.908 1.750 1.00 . A A . 40 ALA HB3 1 1 1 541 1 1 38 ALA N N -4.882 1.051 1.121 1.00 . A A . 40 ALA N 1 1 1 542 1 1 38 ALA O O -5.200 4.446 2.093 1.00 . A A . 40 ALA O 1 1 1 543 1 1 39 VAL C C -6.397 5.096 -0.628 1.00 . A A . 41 VAL C 1 1 1 544 1 1 39 VAL CA C -4.894 4.814 -0.563 1.00 . A A . 41 VAL CA 1 1 1 545 1 1 39 VAL CB C -4.326 4.697 -1.980 1.00 . A A . 41 VAL CB 1 1 1 546 1 1 39 VAL CG1 C -4.869 5.832 -2.853 1.00 . A A . 41 VAL CG1 1 1 1 547 1 1 39 VAL CG2 C -2.800 4.789 -1.920 1.00 . A A . 41 VAL CG2 1 1 1 548 1 1 39 VAL H H -4.397 2.731 -0.333 1.00 . A A . 41 VAL H 1 1 1 549 1 1 39 VAL HA H -4.400 5.617 -0.039 1.00 . A A . 41 VAL HA 1 1 1 550 1 1 39 VAL HB H -4.614 3.745 -2.405 1.00 . A A . 41 VAL HB 1 1 1 551 1 1 39 VAL HG11 H -5.916 5.662 -3.054 1.00 . A A . 41 VAL HG11 1 1 1 552 1 1 39 VAL HG12 H -4.323 5.862 -3.785 1.00 . A A . 41 VAL HG12 1 1 1 553 1 1 39 VAL HG13 H -4.751 6.772 -2.336 1.00 . A A . 41 VAL HG13 1 1 1 554 1 1 39 VAL HG21 H -2.369 4.076 -2.607 1.00 . A A . 41 VAL HG21 1 1 1 555 1 1 39 VAL HG22 H -2.465 4.571 -0.917 1.00 . A A . 41 VAL HG22 1 1 1 556 1 1 39 VAL HG23 H -2.489 5.786 -2.195 1.00 . A A . 41 VAL HG23 1 1 1 557 1 1 39 VAL N N -4.671 3.534 0.161 1.00 . A A . 41 VAL N 1 1 1 558 1 1 39 VAL O O -6.831 6.230 -0.583 1.00 . A A . 41 VAL O 1 1 1 559 1 1 40 VAL C C -9.155 4.829 0.559 1.00 . A A . 42 VAL C 1 1 1 560 1 1 40 VAL CA C -8.669 4.269 -0.784 1.00 . A A . 42 VAL CA 1 1 1 561 1 1 40 VAL CB C -9.352 2.924 -1.079 1.00 . A A . 42 VAL CB 1 1 1 562 1 1 40 VAL CG1 C -10.799 2.937 -0.574 1.00 . A A . 42 VAL CG1 1 1 1 563 1 1 40 VAL CG2 C -9.353 2.680 -2.589 1.00 . A A . 42 VAL CG2 1 1 1 564 1 1 40 VAL H H -6.821 3.161 -0.757 1.00 . A A . 42 VAL H 1 1 1 565 1 1 40 VAL HA H -8.903 4.971 -1.571 1.00 . A A . 42 VAL HA 1 1 1 566 1 1 40 VAL HB H -8.809 2.131 -0.588 1.00 . A A . 42 VAL HB 1 1 1 567 1 1 40 VAL HG11 H -11.223 3.920 -0.714 1.00 . A A . 42 VAL HG11 1 1 1 568 1 1 40 VAL HG12 H -10.816 2.684 0.476 1.00 . A A . 42 VAL HG12 1 1 1 569 1 1 40 VAL HG13 H -11.379 2.213 -1.128 1.00 . A A . 42 VAL HG13 1 1 1 570 1 1 40 VAL HG21 H -8.747 3.428 -3.076 1.00 . A A . 42 VAL HG21 1 1 1 571 1 1 40 VAL HG22 H -10.365 2.737 -2.963 1.00 . A A . 42 VAL HG22 1 1 1 572 1 1 40 VAL HG23 H -8.950 1.699 -2.795 1.00 . A A . 42 VAL HG23 1 1 1 573 1 1 40 VAL N N -7.194 4.068 -0.726 1.00 . A A . 42 VAL N 1 1 1 574 1 1 40 VAL O O -10.144 5.533 0.626 1.00 . A A . 42 VAL O 1 1 1 575 1 1 41 GLU C C -8.072 6.281 3.322 1.00 . A A . 43 GLU C 1 1 1 576 1 1 41 GLU CA C -8.903 5.047 2.960 1.00 . A A . 43 GLU CA 1 1 1 577 1 1 41 GLU CB C -8.705 3.967 4.025 1.00 . A A . 43 GLU CB 1 1 1 578 1 1 41 GLU CD C -6.914 4.077 5.766 1.00 . A A . 43 GLU CD 1 1 1 579 1 1 41 GLU CG C -7.211 3.780 4.295 1.00 . A A . 43 GLU CG 1 1 1 580 1 1 41 GLU H H -7.676 3.956 1.560 1.00 . A A . 43 GLU H 1 1 1 581 1 1 41 GLU HA H -9.947 5.320 2.915 1.00 . A A . 43 GLU HA 1 1 1 582 1 1 41 GLU HB2 H -9.202 4.267 4.937 1.00 . A A . 43 GLU HB2 1 1 1 583 1 1 41 GLU HB3 H -9.126 3.036 3.677 1.00 . A A . 43 GLU HB3 1 1 1 584 1 1 41 GLU HG2 H -6.931 2.761 4.069 1.00 . A A . 43 GLU HG2 1 1 1 585 1 1 41 GLU HG3 H -6.646 4.456 3.672 1.00 . A A . 43 GLU HG3 1 1 1 586 1 1 41 GLU N N -8.470 4.525 1.630 1.00 . A A . 43 GLU N 1 1 1 587 1 1 41 GLU O O -8.363 6.980 4.272 1.00 . A A . 43 GLU O 1 1 1 588 1 1 41 GLU OE1 O -7.827 3.970 6.568 1.00 . A A . 43 GLU OE1 1 1 1 589 1 1 41 GLU OE2 O -5.779 4.409 6.065 1.00 . A A . 43 GLU OE2 1 1 1 590 1 1 42 SER C C -6.714 8.954 2.100 1.00 . A A . 44 SER C 1 1 1 591 1 1 42 SER CA C -6.192 7.743 2.877 1.00 . A A . 44 SER CA 1 1 1 592 1 1 42 SER CB C -4.747 7.461 2.465 1.00 . A A . 44 SER CB 1 1 1 593 1 1 42 SER H H -6.819 5.979 1.811 1.00 . A A . 44 SER H 1 1 1 594 1 1 42 SER HA H -6.229 7.951 3.936 1.00 . A A . 44 SER HA 1 1 1 595 1 1 42 SER HB2 H -4.734 6.742 1.663 1.00 . A A . 44 SER HB2 1 1 1 596 1 1 42 SER HB3 H -4.285 8.381 2.128 1.00 . A A . 44 SER HB3 1 1 1 597 1 1 42 SER HG H -4.099 5.978 3.545 1.00 . A A . 44 SER HG 1 1 1 598 1 1 42 SER N N -7.038 6.554 2.573 1.00 . A A . 44 SER N 1 1 1 599 1 1 42 SER O O -6.279 10.070 2.305 1.00 . A A . 44 SER O 1 1 1 600 1 1 42 SER OG O -4.035 6.936 3.577 1.00 . A A . 44 SER OG 1 1 1 601 1 1 43 ASN C C -7.174 10.292 -0.650 1.00 . A A . 45 ASN C 1 1 1 602 1 1 43 ASN CA C -8.190 9.880 0.415 1.00 . A A . 45 ASN CA 1 1 1 603 1 1 43 ASN CB C -8.466 11.065 1.343 1.00 . A A . 45 ASN CB 1 1 1 604 1 1 43 ASN CG C -9.571 11.938 0.744 1.00 . A A . 45 ASN CG 1 1 1 605 1 1 43 ASN H H -7.977 7.834 1.055 1.00 . A A . 45 ASN H 1 1 1 606 1 1 43 ASN HA H -9.109 9.574 -0.064 1.00 . A A . 45 ASN HA 1 1 1 607 1 1 43 ASN HB2 H -8.781 10.698 2.309 1.00 . A A . 45 ASN HB2 1 1 1 608 1 1 43 ASN HB3 H -7.567 11.651 1.454 1.00 . A A . 45 ASN HB3 1 1 1 609 1 1 43 ASN HD21 H -9.244 11.323 -1.116 1.00 . A A . 45 ASN HD21 1 1 1 610 1 1 43 ASN HD22 H -10.492 12.459 -0.935 1.00 . A A . 45 ASN HD22 1 1 1 611 1 1 43 ASN N N -7.642 8.742 1.207 1.00 . A A . 45 ASN N 1 1 1 612 1 1 43 ASN ND2 N -9.787 11.904 -0.543 1.00 . A A . 45 ASN ND2 1 1 1 613 1 1 43 ASN O O -7.143 11.426 -1.087 1.00 . A A . 45 ASN O 1 1 1 614 1 1 43 ASN OD1 O -10.243 12.660 1.453 1.00 . A A . 45 ASN OD1 1 1 1 615 1 1 44 GLY C C -4.176 10.495 -1.458 1.00 . A A . 46 GLY C 1 1 1 616 1 1 44 GLY CA C -5.326 9.724 -2.106 1.00 . A A . 46 GLY CA 1 1 1 617 1 1 44 GLY H H -6.381 8.473 -0.705 1.00 . A A . 46 GLY H 1 1 1 618 1 1 44 GLY HA2 H -4.947 8.815 -2.554 1.00 . A A . 46 GLY HA2 1 1 1 619 1 1 44 GLY HA3 H -5.783 10.338 -2.869 1.00 . A A . 46 GLY HA3 1 1 1 620 1 1 44 GLY N N -6.341 9.382 -1.071 1.00 . A A . 46 GLY N 1 1 1 621 1 1 44 GLY O O -3.388 11.132 -2.127 1.00 . A A . 46 GLY O 1 1 1 622 1 1 45 THR C C -1.881 10.184 0.936 1.00 . A A . 47 THR C 1 1 1 623 1 1 45 THR CA C -2.972 11.175 0.530 1.00 . A A . 47 THR CA 1 1 1 624 1 1 45 THR CB C -3.524 11.877 1.772 1.00 . A A . 47 THR CB 1 1 1 625 1 1 45 THR CG2 C -4.760 12.691 1.385 1.00 . A A . 47 THR CG2 1 1 1 626 1 1 45 THR H H -4.718 9.925 0.366 1.00 . A A . 47 THR H 1 1 1 627 1 1 45 THR HA H -2.556 11.910 -0.143 1.00 . A A . 47 THR HA 1 1 1 628 1 1 45 THR HB H -2.774 12.540 2.176 1.00 . A A . 47 THR HB 1 1 1 629 1 1 45 THR HG1 H -3.071 10.607 3.175 1.00 . A A . 47 THR HG1 1 1 1 630 1 1 45 THR HG21 H -5.037 12.461 0.367 1.00 . A A . 47 THR HG21 1 1 1 631 1 1 45 THR HG22 H -4.539 13.744 1.468 1.00 . A A . 47 THR HG22 1 1 1 632 1 1 45 THR HG23 H -5.578 12.440 2.045 1.00 . A A . 47 THR HG23 1 1 1 633 1 1 45 THR N N -4.073 10.443 -0.158 1.00 . A A . 47 THR N 1 1 1 634 1 1 45 THR O O -1.043 10.473 1.768 1.00 . A A . 47 THR O 1 1 1 635 1 1 45 THR OG1 O -3.878 10.906 2.747 1.00 . A A . 47 THR OG1 1 1 1 636 1 1 46 LEU C C -0.107 7.612 -0.587 1.00 . A A . 48 LEU C 1 1 1 637 1 1 46 LEU CA C -0.846 8.008 0.690 1.00 . A A . 48 LEU CA 1 1 1 638 1 1 46 LEU CB C -1.515 6.778 1.306 1.00 . A A . 48 LEU CB 1 1 1 639 1 1 46 LEU CD1 C 0.056 7.062 3.236 1.00 . A A . 48 LEU CD1 1 1 1 640 1 1 46 LEU CD2 C -1.267 4.962 2.997 1.00 . A A . 48 LEU CD2 1 1 1 641 1 1 46 LEU CG C -0.532 6.065 2.236 1.00 . A A . 48 LEU CG 1 1 1 642 1 1 46 LEU H H -2.565 8.811 -0.322 1.00 . A A . 48 LEU H 1 1 1 643 1 1 46 LEU HA H -0.146 8.435 1.391 1.00 . A A . 48 LEU HA 1 1 1 644 1 1 46 LEU HB2 H -2.385 7.087 1.870 1.00 . A A . 48 LEU HB2 1 1 1 645 1 1 46 LEU HB3 H -1.819 6.103 0.520 1.00 . A A . 48 LEU HB3 1 1 1 646 1 1 46 LEU HD11 H -0.045 6.669 4.237 1.00 . A A . 48 LEU HD11 1 1 1 647 1 1 46 LEU HD12 H -0.472 8.001 3.164 1.00 . A A . 48 LEU HD12 1 1 1 648 1 1 46 LEU HD13 H 1.102 7.219 3.015 1.00 . A A . 48 LEU HD13 1 1 1 649 1 1 46 LEU HD21 H -1.617 4.215 2.299 1.00 . A A . 48 LEU HD21 1 1 1 650 1 1 46 LEU HD22 H -2.107 5.386 3.523 1.00 . A A . 48 LEU HD22 1 1 1 651 1 1 46 LEU HD23 H -0.591 4.504 3.705 1.00 . A A . 48 LEU HD23 1 1 1 652 1 1 46 LEU HG H 0.265 5.631 1.649 1.00 . A A . 48 LEU HG 1 1 1 653 1 1 46 LEU N N -1.882 9.020 0.349 1.00 . A A . 48 LEU N 1 1 1 654 1 1 46 LEU O O -0.654 7.675 -1.670 1.00 . A A . 48 LEU O 1 1 1 655 1 1 47 THR C C 2.963 5.807 -1.427 1.00 . A A . 49 THR C 1 1 1 656 1 1 47 THR CA C 1.883 6.856 -1.718 1.00 . A A . 49 THR CA 1 1 1 657 1 1 47 THR CB C 2.542 8.112 -2.301 1.00 . A A . 49 THR CB 1 1 1 658 1 1 47 THR CG2 C 1.684 9.340 -1.994 1.00 . A A . 49 THR CG2 1 1 1 659 1 1 47 THR H H 1.577 7.191 0.391 1.00 . A A . 49 THR H 1 1 1 660 1 1 47 THR HA H 1.191 6.458 -2.442 1.00 . A A . 49 THR HA 1 1 1 661 1 1 47 THR HB H 2.636 8.004 -3.371 1.00 . A A . 49 THR HB 1 1 1 662 1 1 47 THR HG1 H 4.436 8.534 -2.428 1.00 . A A . 49 THR HG1 1 1 1 663 1 1 47 THR HG21 H 2.120 10.210 -2.464 1.00 . A A . 49 THR HG21 1 1 1 664 1 1 47 THR HG22 H 1.641 9.491 -0.926 1.00 . A A . 49 THR HG22 1 1 1 665 1 1 47 THR HG23 H 0.686 9.187 -2.376 1.00 . A A . 49 THR HG23 1 1 1 666 1 1 47 THR N N 1.137 7.225 -0.483 1.00 . A A . 49 THR N 1 1 1 667 1 1 47 THR O O 2.885 5.044 -0.485 1.00 . A A . 49 THR O 1 1 1 668 1 1 47 THR OG1 O 3.830 8.278 -1.727 1.00 . A A . 49 THR OG1 1 1 1 669 1 1 48 LEU C C 6.359 5.595 -1.750 1.00 . A A . 50 LEU C 1 1 1 670 1 1 48 LEU CA C 5.097 4.818 -2.142 1.00 . A A . 50 LEU CA 1 1 1 671 1 1 48 LEU CB C 5.305 4.157 -3.513 1.00 . A A . 50 LEU CB 1 1 1 672 1 1 48 LEU CD1 C 5.745 1.967 -2.392 1.00 . A A . 50 LEU CD1 1 1 1 673 1 1 48 LEU CD2 C 6.410 2.309 -4.772 1.00 . A A . 50 LEU CD2 1 1 1 674 1 1 48 LEU CG C 6.278 2.982 -3.404 1.00 . A A . 50 LEU CG 1 1 1 675 1 1 48 LEU H H 3.969 6.417 -3.000 1.00 . A A . 50 LEU H 1 1 1 676 1 1 48 LEU HA H 4.877 4.064 -1.398 1.00 . A A . 50 LEU HA 1 1 1 677 1 1 48 LEU HB2 H 4.355 3.800 -3.884 1.00 . A A . 50 LEU HB2 1 1 1 678 1 1 48 LEU HB3 H 5.704 4.886 -4.202 1.00 . A A . 50 LEU HB3 1 1 1 679 1 1 48 LEU HD11 H 4.746 2.249 -2.091 1.00 . A A . 50 LEU HD11 1 1 1 680 1 1 48 LEU HD12 H 6.390 1.949 -1.525 1.00 . A A . 50 LEU HD12 1 1 1 681 1 1 48 LEU HD13 H 5.721 0.987 -2.843 1.00 . A A . 50 LEU HD13 1 1 1 682 1 1 48 LEU HD21 H 6.440 1.239 -4.644 1.00 . A A . 50 LEU HD21 1 1 1 683 1 1 48 LEU HD22 H 7.322 2.640 -5.248 1.00 . A A . 50 LEU HD22 1 1 1 684 1 1 48 LEU HD23 H 5.564 2.576 -5.389 1.00 . A A . 50 LEU HD23 1 1 1 685 1 1 48 LEU HG H 7.244 3.339 -3.088 1.00 . A A . 50 LEU HG 1 1 1 686 1 1 48 LEU N N 3.964 5.784 -2.266 1.00 . A A . 50 LEU N 1 1 1 687 1 1 48 LEU O O 6.373 6.810 -1.755 1.00 . A A . 50 LEU O 1 1 1 688 1 1 49 SER C C 9.874 4.915 -1.656 1.00 . A A . 51 SER C 1 1 1 689 1 1 49 SER CA C 8.671 5.625 -1.030 1.00 . A A . 51 SER CA 1 1 1 690 1 1 49 SER CB C 8.809 5.633 0.494 1.00 . A A . 51 SER CB 1 1 1 691 1 1 49 SER H H 7.392 3.937 -1.417 1.00 . A A . 51 SER H 1 1 1 692 1 1 49 SER HA H 8.629 6.643 -1.392 1.00 . A A . 51 SER HA 1 1 1 693 1 1 49 SER HB2 H 9.401 4.791 0.809 1.00 . A A . 51 SER HB2 1 1 1 694 1 1 49 SER HB3 H 9.294 6.547 0.806 1.00 . A A . 51 SER HB3 1 1 1 695 1 1 49 SER HG H 7.103 6.407 1.021 1.00 . A A . 51 SER HG 1 1 1 696 1 1 49 SER N N 7.418 4.912 -1.414 1.00 . A A . 51 SER N 1 1 1 697 1 1 49 SER O O 10.720 5.536 -2.268 1.00 . A A . 51 SER O 1 1 1 698 1 1 49 SER OG O 7.518 5.544 1.083 1.00 . A A . 51 SER OG 1 1 1 699 1 1 50 HIS C C 10.962 1.382 -1.763 1.00 . A A . 52 HIS C 1 1 1 700 1 1 50 HIS CA C 11.096 2.871 -2.110 1.00 . A A . 52 HIS CA 1 1 1 701 1 1 50 HIS CB C 12.423 3.434 -1.577 1.00 . A A . 52 HIS CB 1 1 1 702 1 1 50 HIS CD2 C 12.398 3.472 1.051 1.00 . A A . 52 HIS CD2 1 1 1 703 1 1 50 HIS CE1 C 13.413 1.589 1.400 1.00 . A A . 52 HIS CE1 1 1 1 704 1 1 50 HIS CG C 12.683 2.938 -0.181 1.00 . A A . 52 HIS CG 1 1 1 705 1 1 50 HIS H H 9.256 3.134 -1.032 1.00 . A A . 52 HIS H 1 1 1 706 1 1 50 HIS HA H 11.068 2.984 -3.183 1.00 . A A . 52 HIS HA 1 1 1 707 1 1 50 HIS HB2 H 13.229 3.117 -2.222 1.00 . A A . 52 HIS HB2 1 1 1 708 1 1 50 HIS HB3 H 12.378 4.513 -1.569 1.00 . A A . 52 HIS HB3 1 1 1 709 1 1 50 HIS HD1 H 13.671 1.114 -0.609 1.00 . A A . 52 HIS HD1 1 1 1 710 1 1 50 HIS HD2 H 11.896 4.412 1.221 1.00 . A A . 52 HIS HD2 1 1 1 711 1 1 50 HIS HE1 H 13.866 0.738 1.886 1.00 . A A . 52 HIS HE1 1 1 1 712 1 1 50 HIS N N 9.953 3.619 -1.517 1.00 . A A . 52 HIS N 1 1 1 713 1 1 50 HIS ND1 N 13.332 1.739 0.066 1.00 . A A . 52 HIS ND1 1 1 1 714 1 1 50 HIS NE2 N 12.859 2.617 2.049 1.00 . A A . 52 HIS NE2 1 1 1 715 1 1 50 HIS O O 11.154 0.970 -0.636 1.00 . A A . 52 HIS O 1 1 1 716 1 1 51 PHE C C 11.547 -1.375 -1.532 1.00 . A A . 53 PHE C 1 1 1 717 1 1 51 PHE CA C 10.460 -0.884 -2.493 1.00 . A A . 53 PHE CA 1 1 1 718 1 1 51 PHE CB C 10.587 -1.626 -3.825 1.00 . A A . 53 PHE CB 1 1 1 719 1 1 51 PHE CD1 C 8.245 -0.980 -4.491 1.00 . A A . 53 PHE CD1 1 1 1 720 1 1 51 PHE CD2 C 8.917 -3.301 -4.692 1.00 . A A . 53 PHE CD2 1 1 1 721 1 1 51 PHE CE1 C 6.974 -1.306 -4.980 1.00 . A A . 53 PHE CE1 1 1 1 722 1 1 51 PHE CE2 C 7.647 -3.627 -5.182 1.00 . A A . 53 PHE CE2 1 1 1 723 1 1 51 PHE CG C 9.216 -1.977 -4.347 1.00 . A A . 53 PHE CG 1 1 1 724 1 1 51 PHE CZ C 6.677 -2.628 -5.326 1.00 . A A . 53 PHE CZ 1 1 1 725 1 1 51 PHE H H 10.461 0.944 -3.626 1.00 . A A . 53 PHE H 1 1 1 726 1 1 51 PHE HA H 9.488 -1.076 -2.066 1.00 . A A . 53 PHE HA 1 1 1 727 1 1 51 PHE HB2 H 11.093 -0.994 -4.541 1.00 . A A . 53 PHE HB2 1 1 1 728 1 1 51 PHE HB3 H 11.158 -2.529 -3.679 1.00 . A A . 53 PHE HB3 1 1 1 729 1 1 51 PHE HD1 H 8.475 0.040 -4.223 1.00 . A A . 53 PHE HD1 1 1 1 730 1 1 51 PHE HD2 H 9.667 -4.069 -4.581 1.00 . A A . 53 PHE HD2 1 1 1 731 1 1 51 PHE HE1 H 6.226 -0.539 -5.089 1.00 . A A . 53 PHE HE1 1 1 1 732 1 1 51 PHE HE2 H 7.417 -4.648 -5.448 1.00 . A A . 53 PHE HE2 1 1 1 733 1 1 51 PHE HZ H 5.697 -2.879 -5.704 1.00 . A A . 53 PHE HZ 1 1 1 734 1 1 51 PHE N N 10.621 0.580 -2.733 1.00 . A A . 53 PHE N 1 1 1 735 1 1 51 PHE O O 12.726 -1.276 -1.807 1.00 . A A . 53 PHE O 1 1 1 736 1 1 52 GLY C C 11.828 -1.827 1.962 1.00 . A A . 54 GLY C 1 1 1 737 1 1 52 GLY CA C 12.154 -2.402 0.583 1.00 . A A . 54 GLY CA 1 1 1 738 1 1 52 GLY H H 10.199 -1.969 -0.207 1.00 . A A . 54 GLY H 1 1 1 739 1 1 52 GLY HA2 H 12.113 -3.481 0.622 1.00 . A A . 54 GLY HA2 1 1 1 740 1 1 52 GLY HA3 H 13.143 -2.087 0.289 1.00 . A A . 54 GLY HA3 1 1 1 741 1 1 52 GLY N N 11.155 -1.902 -0.405 1.00 . A A . 54 GLY N 1 1 1 742 1 1 52 GLY O O 11.337 -0.722 2.080 1.00 . A A . 54 GLY O 1 1 1 743 1 1 53 LYS C C 12.220 -0.597 4.478 1.00 . A A . 55 LYS C 1 1 1 744 1 1 53 LYS CA C 11.793 -2.058 4.378 1.00 . A A . 55 LYS CA 1 1 1 745 1 1 53 LYS CB C 12.561 -2.880 5.417 1.00 . A A . 55 LYS CB 1 1 1 746 1 1 53 LYS CD C 11.158 -3.605 7.361 1.00 . A A . 55 LYS CD 1 1 1 747 1 1 53 LYS CE C 11.692 -4.126 8.699 1.00 . A A . 55 LYS CE 1 1 1 748 1 1 53 LYS CG C 12.081 -2.507 6.825 1.00 . A A . 55 LYS CG 1 1 1 749 1 1 53 LYS H H 12.485 -3.457 2.890 1.00 . A A . 55 LYS H 1 1 1 750 1 1 53 LYS HA H 10.733 -2.137 4.568 1.00 . A A . 55 LYS HA 1 1 1 751 1 1 53 LYS HB2 H 12.388 -3.932 5.244 1.00 . A A . 55 LYS HB2 1 1 1 752 1 1 53 LYS HB3 H 13.617 -2.669 5.332 1.00 . A A . 55 LYS HB3 1 1 1 753 1 1 53 LYS HD2 H 10.165 -3.203 7.502 1.00 . A A . 55 LYS HD2 1 1 1 754 1 1 53 LYS HD3 H 11.118 -4.419 6.652 1.00 . A A . 55 LYS HD3 1 1 1 755 1 1 53 LYS HE2 H 12.770 -4.056 8.711 1.00 . A A . 55 LYS HE2 1 1 1 756 1 1 53 LYS HE3 H 11.284 -3.532 9.505 1.00 . A A . 55 LYS HE3 1 1 1 757 1 1 53 LYS HG2 H 12.934 -2.402 7.479 1.00 . A A . 55 LYS HG2 1 1 1 758 1 1 53 LYS HG3 H 11.540 -1.573 6.784 1.00 . A A . 55 LYS HG3 1 1 1 759 1 1 53 LYS HZ1 H 10.253 -5.599 9.008 1.00 . A A . 55 LYS HZ1 1 1 1 760 1 1 53 LYS HZ2 H 11.759 -5.946 9.714 1.00 . A A . 55 LYS HZ2 1 1 1 761 1 1 53 LYS HZ3 H 11.549 -6.095 8.034 1.00 . A A . 55 LYS HZ3 1 1 1 762 1 1 53 LYS N N 12.093 -2.568 3.008 1.00 . A A . 55 LYS N 1 1 1 763 1 1 53 LYS NZ N 11.283 -5.549 8.877 1.00 . A A . 55 LYS NZ 1 1 1 764 1 1 53 LYS O O 13.336 -0.242 4.153 1.00 . A A . 55 LYS O 1 1 1 765 1 1 54 CYS C C 13.042 1.808 5.792 1.00 . A A . 56 CYS C 1 1 1 766 1 1 54 CYS CA C 11.721 1.694 5.030 1.00 . A A . 56 CYS CA 1 1 1 767 1 1 54 CYS CB C 10.626 2.461 5.774 1.00 . A A . 56 CYS CB 1 1 1 768 1 1 54 CYS H H 10.442 -0.043 5.176 1.00 . A A . 56 CYS H 1 1 1 769 1 1 54 CYS HA H 11.843 2.108 4.040 1.00 . A A . 56 CYS HA 1 1 1 770 1 1 54 CYS HB2 H 10.383 1.946 6.692 1.00 . A A . 56 CYS HB2 1 1 1 771 1 1 54 CYS HB3 H 10.974 3.459 5.999 1.00 . A A . 56 CYS HB3 1 1 1 772 1 1 54 CYS N N 11.344 0.259 4.921 1.00 . A A . 56 CYS N 1 1 1 773 1 1 54 CYS O O 13.111 1.296 6.898 1.00 . A A . 56 CYS O 1 1 1 774 1 1 54 CYS OXT O 13.965 2.396 5.253 1.00 . A A . 56 CYS OXT 1 1 1 775 1 1 54 CYS SG S 9.156 2.559 4.725 1.00 . A A . 56 CYS SG 1 1 2 776 1 1 1 ALA C C 0.412 10.310 -8.268 1.00 . A A . 3 ALA C 1 1 2 777 1 1 1 ALA CA C -0.719 9.613 -7.511 1.00 . A A . 3 ALA CA 1 1 2 778 1 1 1 ALA CB C -1.844 10.615 -7.240 1.00 . A A . 3 ALA CB 1 1 2 779 1 1 1 ALA H1 H -0.430 8.072 -6.141 1.00 . A A . 3 ALA H1 1 1 2 780 1 1 1 ALA H2 H -0.639 9.602 -5.431 1.00 . A A . 3 ALA H2 1 1 2 781 1 1 1 ALA H3 H 0.831 9.205 -6.184 1.00 . A A . 3 ALA H3 1 1 2 782 1 1 1 ALA HA H -1.101 8.797 -8.107 1.00 . A A . 3 ALA HA 1 1 2 783 1 1 1 ALA HB1 H -2.517 10.207 -6.500 1.00 . A A . 3 ALA HB1 1 1 2 784 1 1 1 ALA HB2 H -2.386 10.806 -8.154 1.00 . A A . 3 ALA HB2 1 1 2 785 1 1 1 ALA HB3 H -1.422 11.539 -6.871 1.00 . A A . 3 ALA HB3 1 1 2 786 1 1 1 ALA N N -0.200 9.083 -6.220 1.00 . A A . 3 ALA N 1 1 2 787 1 1 1 ALA O O 0.272 11.430 -8.718 1.00 . A A . 3 ALA O 1 1 2 788 1 1 2 VAL C C 3.186 9.346 -10.223 1.00 . A A . 4 VAL C 1 1 2 789 1 1 2 VAL CA C 2.668 10.292 -9.143 1.00 . A A . 4 VAL CA 1 1 2 790 1 1 2 VAL CB C 3.797 10.610 -8.161 1.00 . A A . 4 VAL CB 1 1 2 791 1 1 2 VAL CG1 C 3.533 11.962 -7.496 1.00 . A A . 4 VAL CG1 1 1 2 792 1 1 2 VAL CG2 C 3.860 9.519 -7.091 1.00 . A A . 4 VAL CG2 1 1 2 793 1 1 2 VAL H H 1.631 8.756 -8.044 1.00 . A A . 4 VAL H 1 1 2 794 1 1 2 VAL HA H 2.326 11.198 -9.607 1.00 . A A . 4 VAL HA 1 1 2 795 1 1 2 VAL HB H 4.736 10.649 -8.694 1.00 . A A . 4 VAL HB 1 1 2 796 1 1 2 VAL HG11 H 3.329 11.812 -6.446 1.00 . A A . 4 VAL HG11 1 1 2 797 1 1 2 VAL HG12 H 2.683 12.435 -7.965 1.00 . A A . 4 VAL HG12 1 1 2 798 1 1 2 VAL HG13 H 4.402 12.592 -7.606 1.00 . A A . 4 VAL HG13 1 1 2 799 1 1 2 VAL HG21 H 3.412 8.613 -7.473 1.00 . A A . 4 VAL HG21 1 1 2 800 1 1 2 VAL HG22 H 3.321 9.843 -6.213 1.00 . A A . 4 VAL HG22 1 1 2 801 1 1 2 VAL HG23 H 4.891 9.329 -6.831 1.00 . A A . 4 VAL HG23 1 1 2 802 1 1 2 VAL N N 1.534 9.659 -8.414 1.00 . A A . 4 VAL N 1 1 2 803 1 1 2 VAL O O 4.198 9.598 -10.847 1.00 . A A . 4 VAL O 1 1 2 804 1 1 3 SER C C 2.347 5.903 -11.155 1.00 . A A . 5 SER C 1 1 2 805 1 1 3 SER CA C 2.918 7.283 -11.490 1.00 . A A . 5 SER CA 1 1 2 806 1 1 3 SER CB C 4.445 7.191 -11.526 1.00 . A A . 5 SER CB 1 1 2 807 1 1 3 SER H H 1.677 8.105 -9.931 1.00 . A A . 5 SER H 1 1 2 808 1 1 3 SER HA H 2.553 7.600 -12.456 1.00 . A A . 5 SER HA 1 1 2 809 1 1 3 SER HB2 H 4.743 6.203 -11.838 1.00 . A A . 5 SER HB2 1 1 2 810 1 1 3 SER HB3 H 4.832 7.918 -12.228 1.00 . A A . 5 SER HB3 1 1 2 811 1 1 3 SER HG H 5.618 8.144 -10.300 1.00 . A A . 5 SER HG 1 1 2 812 1 1 3 SER N N 2.490 8.266 -10.448 1.00 . A A . 5 SER N 1 1 2 813 1 1 3 SER O O 3.000 4.894 -11.327 1.00 . A A . 5 SER O 1 1 2 814 1 1 3 SER OG O 4.961 7.447 -10.226 1.00 . A A . 5 SER OG 1 1 2 815 1 1 4 VAL C C -0.951 4.527 -10.703 1.00 . A A . 6 VAL C 1 1 2 816 1 1 4 VAL CA C 0.532 4.527 -10.331 1.00 . A A . 6 VAL CA 1 1 2 817 1 1 4 VAL CB C 0.680 4.276 -8.828 1.00 . A A . 6 VAL CB 1 1 2 818 1 1 4 VAL CG1 C 0.010 5.411 -8.051 1.00 . A A . 6 VAL CG1 1 1 2 819 1 1 4 VAL CG2 C 0.010 2.948 -8.467 1.00 . A A . 6 VAL CG2 1 1 2 820 1 1 4 VAL H H 0.621 6.672 -10.541 1.00 . A A . 6 VAL H 1 1 2 821 1 1 4 VAL HA H 1.041 3.748 -10.878 1.00 . A A . 6 VAL HA 1 1 2 822 1 1 4 VAL HB H 1.730 4.233 -8.571 1.00 . A A . 6 VAL HB 1 1 2 823 1 1 4 VAL HG11 H -0.320 6.173 -8.742 1.00 . A A . 6 VAL HG11 1 1 2 824 1 1 4 VAL HG12 H 0.718 5.838 -7.356 1.00 . A A . 6 VAL HG12 1 1 2 825 1 1 4 VAL HG13 H -0.839 5.024 -7.509 1.00 . A A . 6 VAL HG13 1 1 2 826 1 1 4 VAL HG21 H 0.368 2.613 -7.504 1.00 . A A . 6 VAL HG21 1 1 2 827 1 1 4 VAL HG22 H 0.248 2.208 -9.217 1.00 . A A . 6 VAL HG22 1 1 2 828 1 1 4 VAL HG23 H -1.061 3.086 -8.424 1.00 . A A . 6 VAL HG23 1 1 2 829 1 1 4 VAL N N 1.134 5.848 -10.676 1.00 . A A . 6 VAL N 1 1 2 830 1 1 4 VAL O O -1.688 5.429 -10.360 1.00 . A A . 6 VAL O 1 1 2 831 1 1 5 ASP C C -3.581 2.498 -10.875 1.00 . A A . 7 ASP C 1 1 2 832 1 1 5 ASP CA C -2.833 3.463 -11.797 1.00 . A A . 7 ASP CA 1 1 2 833 1 1 5 ASP CB C -2.949 2.976 -13.242 1.00 . A A . 7 ASP CB 1 1 2 834 1 1 5 ASP CG C -3.201 4.169 -14.167 1.00 . A A . 7 ASP CG 1 1 2 835 1 1 5 ASP H H -0.787 2.801 -11.672 1.00 . A A . 7 ASP H 1 1 2 836 1 1 5 ASP HA H -3.268 4.447 -11.714 1.00 . A A . 7 ASP HA 1 1 2 837 1 1 5 ASP HB2 H -2.033 2.484 -13.531 1.00 . A A . 7 ASP HB2 1 1 2 838 1 1 5 ASP HB3 H -3.772 2.282 -13.324 1.00 . A A . 7 ASP HB3 1 1 2 839 1 1 5 ASP N N -1.397 3.519 -11.405 1.00 . A A . 7 ASP N 1 1 2 840 1 1 5 ASP O O -3.952 1.410 -11.270 1.00 . A A . 7 ASP O 1 1 2 841 1 1 5 ASP OD1 O -3.955 5.046 -13.776 1.00 . A A . 7 ASP OD1 1 1 2 842 1 1 5 ASP OD2 O -2.635 4.186 -15.247 1.00 . A A . 7 ASP OD2 1 1 2 843 1 1 6 CYS C C -5.771 2.718 -8.167 1.00 . A A . 8 CYS C 1 1 2 844 1 1 6 CYS CA C -4.538 1.991 -8.708 1.00 . A A . 8 CYS CA 1 1 2 845 1 1 6 CYS CB C -3.619 1.606 -7.548 1.00 . A A . 8 CYS CB 1 1 2 846 1 1 6 CYS H H -3.505 3.769 -9.351 1.00 . A A . 8 CYS H 1 1 2 847 1 1 6 CYS HA H -4.850 1.100 -9.232 1.00 . A A . 8 CYS HA 1 1 2 848 1 1 6 CYS HB2 H -2.591 1.783 -7.828 1.00 . A A . 8 CYS HB2 1 1 2 849 1 1 6 CYS HB3 H -3.865 2.200 -6.681 1.00 . A A . 8 CYS HB3 1 1 2 850 1 1 6 CYS N N -3.809 2.887 -9.649 1.00 . A A . 8 CYS N 1 1 2 851 1 1 6 CYS O O -6.235 2.450 -7.074 1.00 . A A . 8 CYS O 1 1 2 852 1 1 6 CYS SG S -3.845 -0.149 -7.161 1.00 . A A . 8 CYS SG 1 1 2 853 1 1 7 SER C C -8.781 3.524 -8.686 1.00 . A A . 9 SER C 1 1 2 854 1 1 7 SER CA C -7.527 4.373 -8.464 1.00 . A A . 9 SER CA 1 1 2 855 1 1 7 SER CB C -7.651 5.683 -9.242 1.00 . A A . 9 SER CB 1 1 2 856 1 1 7 SER H H -5.937 3.824 -9.811 1.00 . A A . 9 SER H 1 1 2 857 1 1 7 SER HA H -7.428 4.587 -7.413 1.00 . A A . 9 SER HA 1 1 2 858 1 1 7 SER HB2 H -8.257 5.528 -10.120 1.00 . A A . 9 SER HB2 1 1 2 859 1 1 7 SER HB3 H -8.118 6.431 -8.613 1.00 . A A . 9 SER HB3 1 1 2 860 1 1 7 SER HG H -6.260 5.947 -10.578 1.00 . A A . 9 SER HG 1 1 2 861 1 1 7 SER N N -6.318 3.631 -8.930 1.00 . A A . 9 SER N 1 1 2 862 1 1 7 SER O O -9.891 4.019 -8.672 1.00 . A A . 9 SER O 1 1 2 863 1 1 7 SER OG O -6.357 6.119 -9.637 1.00 . A A . 9 SER OG 1 1 2 864 1 1 8 GLU C C -9.460 -0.014 -8.494 1.00 . A A . 10 GLU C 1 1 2 865 1 1 8 GLU CA C -9.777 1.356 -9.093 1.00 . A A . 10 GLU CA 1 1 2 866 1 1 8 GLU CB C -10.047 1.210 -10.592 1.00 . A A . 10 GLU CB 1 1 2 867 1 1 8 GLU CD C -12.026 0.044 -11.576 1.00 . A A . 10 GLU CD 1 1 2 868 1 1 8 GLU CG C -11.552 1.304 -10.850 1.00 . A A . 10 GLU CG 1 1 2 869 1 1 8 GLU H H -7.713 1.876 -8.881 1.00 . A A . 10 GLU H 1 1 2 870 1 1 8 GLU HA H -10.646 1.773 -8.606 1.00 . A A . 10 GLU HA 1 1 2 871 1 1 8 GLU HB2 H -9.538 1.997 -11.129 1.00 . A A . 10 GLU HB2 1 1 2 872 1 1 8 GLU HB3 H -9.686 0.250 -10.931 1.00 . A A . 10 GLU HB3 1 1 2 873 1 1 8 GLU HG2 H -12.074 1.396 -9.908 1.00 . A A . 10 GLU HG2 1 1 2 874 1 1 8 GLU HG3 H -11.758 2.169 -11.462 1.00 . A A . 10 GLU HG3 1 1 2 875 1 1 8 GLU N N -8.611 2.250 -8.881 1.00 . A A . 10 GLU N 1 1 2 876 1 1 8 GLU O O -9.965 -1.027 -8.934 1.00 . A A . 10 GLU O 1 1 2 877 1 1 8 GLU OE1 O -11.691 -0.107 -12.739 1.00 . A A . 10 GLU OE1 1 1 2 878 1 1 8 GLU OE2 O -12.716 -0.748 -10.956 1.00 . A A . 10 GLU OE2 1 1 2 879 1 1 9 TYR C C -8.638 -1.393 -5.383 1.00 . A A . 11 TYR C 1 1 2 880 1 1 9 TYR CA C -8.267 -1.363 -6.875 1.00 . A A . 11 TYR CA 1 1 2 881 1 1 9 TYR CB C -6.762 -1.596 -7.014 1.00 . A A . 11 TYR CB 1 1 2 882 1 1 9 TYR CD1 C -7.042 -2.908 -9.151 1.00 . A A . 11 TYR CD1 1 1 2 883 1 1 9 TYR CD2 C -5.757 -3.885 -7.341 1.00 . A A . 11 TYR CD2 1 1 2 884 1 1 9 TYR CE1 C -6.810 -4.047 -9.932 1.00 . A A . 11 TYR CE1 1 1 2 885 1 1 9 TYR CE2 C -5.526 -5.025 -8.121 1.00 . A A . 11 TYR CE2 1 1 2 886 1 1 9 TYR CG C -6.516 -2.827 -7.856 1.00 . A A . 11 TYR CG 1 1 2 887 1 1 9 TYR CZ C -6.051 -5.105 -9.416 1.00 . A A . 11 TYR CZ 1 1 2 888 1 1 9 TYR H H -8.212 0.777 -7.152 1.00 . A A . 11 TYR H 1 1 2 889 1 1 9 TYR HA H -8.796 -2.152 -7.388 1.00 . A A . 11 TYR HA 1 1 2 890 1 1 9 TYR HB2 H -6.307 -0.739 -7.488 1.00 . A A . 11 TYR HB2 1 1 2 891 1 1 9 TYR HB3 H -6.328 -1.739 -6.036 1.00 . A A . 11 TYR HB3 1 1 2 892 1 1 9 TYR HD1 H -7.628 -2.092 -9.549 1.00 . A A . 11 TYR HD1 1 1 2 893 1 1 9 TYR HD2 H -5.352 -3.823 -6.342 1.00 . A A . 11 TYR HD2 1 1 2 894 1 1 9 TYR HE1 H -7.216 -4.110 -10.930 1.00 . A A . 11 TYR HE1 1 1 2 895 1 1 9 TYR HE2 H -4.941 -5.840 -7.723 1.00 . A A . 11 TYR HE2 1 1 2 896 1 1 9 TYR HH H -5.576 -5.939 -11.066 1.00 . A A . 11 TYR HH 1 1 2 897 1 1 9 TYR N N -8.617 -0.052 -7.492 1.00 . A A . 11 TYR N 1 1 2 898 1 1 9 TYR O O -7.846 -1.829 -4.570 1.00 . A A . 11 TYR O 1 1 2 899 1 1 9 TYR OH O -5.821 -6.228 -10.184 1.00 . A A . 11 TYR OH 1 1 2 900 1 1 10 PRO C C -10.685 -2.394 -3.256 1.00 . A A . 12 PRO C 1 1 2 901 1 1 10 PRO CA C -10.312 -0.967 -3.663 1.00 . A A . 12 PRO CA 1 1 2 902 1 1 10 PRO CB C -11.555 -0.077 -3.698 1.00 . A A . 12 PRO CB 1 1 2 903 1 1 10 PRO CD C -10.811 -0.420 -6.025 1.00 . A A . 12 PRO CD 1 1 2 904 1 1 10 PRO CG C -12.041 -0.079 -5.165 1.00 . A A . 12 PRO CG 1 1 2 905 1 1 10 PRO HA H -9.573 -0.554 -2.997 1.00 . A A . 12 PRO HA 1 1 2 906 1 1 10 PRO HB2 H -12.319 -0.481 -3.047 1.00 . A A . 12 PRO HB2 1 1 2 907 1 1 10 PRO HB3 H -11.302 0.928 -3.399 1.00 . A A . 12 PRO HB3 1 1 2 908 1 1 10 PRO HD2 H -11.061 -1.160 -6.773 1.00 . A A . 12 PRO HD2 1 1 2 909 1 1 10 PRO HD3 H -10.429 0.476 -6.481 1.00 . A A . 12 PRO HD3 1 1 2 910 1 1 10 PRO HG2 H -12.812 -0.826 -5.299 1.00 . A A . 12 PRO HG2 1 1 2 911 1 1 10 PRO HG3 H -12.415 0.896 -5.434 1.00 . A A . 12 PRO HG3 1 1 2 912 1 1 10 PRO N N -9.833 -0.958 -5.057 1.00 . A A . 12 PRO N 1 1 2 913 1 1 10 PRO O O -11.812 -2.820 -3.415 1.00 . A A . 12 PRO O 1 1 2 914 1 1 11 LYS C C -9.000 -5.045 -1.367 1.00 . A A . 13 LYS C 1 1 2 915 1 1 11 LYS CA C -10.064 -4.539 -2.341 1.00 . A A . 13 LYS CA 1 1 2 916 1 1 11 LYS CB C -10.089 -5.431 -3.584 1.00 . A A . 13 LYS CB 1 1 2 917 1 1 11 LYS CD C -8.866 -6.068 -5.670 1.00 . A A . 13 LYS CD 1 1 2 918 1 1 11 LYS CE C -7.725 -7.079 -5.551 1.00 . A A . 13 LYS CE 1 1 2 919 1 1 11 LYS CG C -8.860 -5.143 -4.451 1.00 . A A . 13 LYS CG 1 1 2 920 1 1 11 LYS H H -8.845 -2.787 -2.625 1.00 . A A . 13 LYS H 1 1 2 921 1 1 11 LYS HA H -11.030 -4.565 -1.860 1.00 . A A . 13 LYS HA 1 1 2 922 1 1 11 LYS HB2 H -10.082 -6.468 -3.282 1.00 . A A . 13 LYS HB2 1 1 2 923 1 1 11 LYS HB3 H -10.983 -5.227 -4.154 1.00 . A A . 13 LYS HB3 1 1 2 924 1 1 11 LYS HD2 H -9.810 -6.592 -5.719 1.00 . A A . 13 LYS HD2 1 1 2 925 1 1 11 LYS HD3 H -8.732 -5.482 -6.567 1.00 . A A . 13 LYS HD3 1 1 2 926 1 1 11 LYS HE2 H -7.450 -7.430 -6.535 1.00 . A A . 13 LYS HE2 1 1 2 927 1 1 11 LYS HE3 H -6.873 -6.607 -5.085 1.00 . A A . 13 LYS HE3 1 1 2 928 1 1 11 LYS HG2 H -8.883 -4.114 -4.780 1.00 . A A . 13 LYS HG2 1 1 2 929 1 1 11 LYS HG3 H -7.963 -5.317 -3.875 1.00 . A A . 13 LYS HG3 1 1 2 930 1 1 11 LYS HZ1 H -9.060 -8.611 -5.099 1.00 . A A . 13 LYS HZ1 1 1 2 931 1 1 11 LYS HZ2 H -8.318 -7.914 -3.738 1.00 . A A . 13 LYS HZ2 1 1 2 932 1 1 11 LYS HZ3 H -7.444 -8.974 -4.737 1.00 . A A . 13 LYS HZ3 1 1 2 933 1 1 11 LYS N N -9.751 -3.142 -2.742 1.00 . A A . 13 LYS N 1 1 2 934 1 1 11 LYS NZ N -8.170 -8.232 -4.719 1.00 . A A . 13 LYS NZ 1 1 2 935 1 1 11 LYS O O -7.973 -5.559 -1.765 1.00 . A A . 13 LYS O 1 1 2 936 1 1 12 CYS C C -8.534 -6.838 1.265 1.00 . A A . 14 CYS C 1 1 2 937 1 1 12 CYS CA C -8.244 -5.376 0.910 1.00 . A A . 14 CYS CA 1 1 2 938 1 1 12 CYS CB C -8.340 -4.518 2.174 1.00 . A A . 14 CYS CB 1 1 2 939 1 1 12 CYS H H -10.073 -4.486 0.204 1.00 . A A . 14 CYS H 1 1 2 940 1 1 12 CYS HA H -7.250 -5.297 0.496 1.00 . A A . 14 CYS HA 1 1 2 941 1 1 12 CYS HB2 H -9.131 -4.895 2.806 1.00 . A A . 14 CYS HB2 1 1 2 942 1 1 12 CYS HB3 H -7.403 -4.560 2.710 1.00 . A A . 14 CYS HB3 1 1 2 943 1 1 12 CYS N N -9.238 -4.904 -0.093 1.00 . A A . 14 CYS N 1 1 2 944 1 1 12 CYS O O -8.254 -7.289 2.357 1.00 . A A . 14 CYS O 1 1 2 945 1 1 12 CYS SG S -8.697 -2.803 1.720 1.00 . A A . 14 CYS SG 1 1 2 946 1 1 13 ALA C C -8.330 -9.898 -0.007 1.00 . A A . 15 ALA C 1 1 2 947 1 1 13 ALA CA C -9.399 -9.012 0.634 1.00 . A A . 15 ALA CA 1 1 2 948 1 1 13 ALA CB C -10.770 -9.366 0.053 1.00 . A A . 15 ALA CB 1 1 2 949 1 1 13 ALA H H -9.311 -7.201 -0.527 1.00 . A A . 15 ALA H 1 1 2 950 1 1 13 ALA HA H -9.408 -9.173 1.702 1.00 . A A . 15 ALA HA 1 1 2 951 1 1 13 ALA HB1 H -10.640 -9.965 -0.837 1.00 . A A . 15 ALA HB1 1 1 2 952 1 1 13 ALA HB2 H -11.301 -8.460 -0.197 1.00 . A A . 15 ALA HB2 1 1 2 953 1 1 13 ALA HB3 H -11.338 -9.926 0.782 1.00 . A A . 15 ALA HB3 1 1 2 954 1 1 13 ALA N N -9.093 -7.582 0.348 1.00 . A A . 15 ALA N 1 1 2 955 1 1 13 ALA O O -8.632 -10.861 -0.683 1.00 . A A . 15 ALA O 1 1 2 956 1 1 14 CYS C C -5.563 -11.489 0.570 1.00 . A A . 16 CYS C 1 1 2 957 1 1 14 CYS CA C -5.995 -10.399 -0.411 1.00 . A A . 16 CYS CA 1 1 2 958 1 1 14 CYS CB C -4.800 -9.504 -0.737 1.00 . A A . 16 CYS CB 1 1 2 959 1 1 14 CYS H H -6.857 -8.795 0.739 1.00 . A A . 16 CYS H 1 1 2 960 1 1 14 CYS HA H -6.355 -10.860 -1.319 1.00 . A A . 16 CYS HA 1 1 2 961 1 1 14 CYS HB2 H -4.610 -8.840 0.092 1.00 . A A . 16 CYS HB2 1 1 2 962 1 1 14 CYS HB3 H -3.928 -10.115 -0.917 1.00 . A A . 16 CYS HB3 1 1 2 963 1 1 14 CYS N N -7.081 -9.578 0.193 1.00 . A A . 16 CYS N 1 1 2 964 1 1 14 CYS O O -6.016 -11.541 1.696 1.00 . A A . 16 CYS O 1 1 2 965 1 1 14 CYS SG S -5.169 -8.531 -2.217 1.00 . A A . 16 CYS SG 1 1 2 966 1 1 15 THR C C -2.913 -13.058 1.711 1.00 . A A . 17 THR C 1 1 2 967 1 1 15 THR CA C -4.233 -13.456 1.046 1.00 . A A . 17 THR CA 1 1 2 968 1 1 15 THR CB C -4.029 -14.737 0.234 1.00 . A A . 17 THR CB 1 1 2 969 1 1 15 THR CG2 C -5.261 -15.632 0.377 1.00 . A A . 17 THR CG2 1 1 2 970 1 1 15 THR H H -4.348 -12.302 -0.770 1.00 . A A . 17 THR H 1 1 2 971 1 1 15 THR HA H -4.978 -13.630 1.807 1.00 . A A . 17 THR HA 1 1 2 972 1 1 15 THR HB H -3.163 -15.263 0.603 1.00 . A A . 17 THR HB 1 1 2 973 1 1 15 THR HG1 H -4.697 -14.228 -1.521 1.00 . A A . 17 THR HG1 1 1 2 974 1 1 15 THR HG21 H -5.030 -16.624 0.016 1.00 . A A . 17 THR HG21 1 1 2 975 1 1 15 THR HG22 H -6.074 -15.221 -0.203 1.00 . A A . 17 THR HG22 1 1 2 976 1 1 15 THR HG23 H -5.550 -15.685 1.416 1.00 . A A . 17 THR HG23 1 1 2 977 1 1 15 THR N N -4.694 -12.363 0.145 1.00 . A A . 17 THR N 1 1 2 978 1 1 15 THR O O -2.899 -12.450 2.763 1.00 . A A . 17 THR O 1 1 2 979 1 1 15 THR OG1 O -3.836 -14.404 -1.133 1.00 . A A . 17 THR OG1 1 1 2 980 1 1 16 MET C C 0.578 -12.863 0.658 1.00 . A A . 18 MET C 1 1 2 981 1 1 16 MET CA C -0.494 -13.046 1.735 1.00 . A A . 18 MET CA 1 1 2 982 1 1 16 MET CB C -0.063 -14.167 2.684 1.00 . A A . 18 MET CB 1 1 2 983 1 1 16 MET CE C -0.833 -11.901 5.955 1.00 . A A . 18 MET CE 1 1 2 984 1 1 16 MET CG C -0.559 -13.861 4.096 1.00 . A A . 18 MET CG 1 1 2 985 1 1 16 MET H H -1.828 -13.900 0.272 1.00 . A A . 18 MET H 1 1 2 986 1 1 16 MET HA H -0.601 -12.128 2.294 1.00 . A A . 18 MET HA 1 1 2 987 1 1 16 MET HB2 H -0.484 -15.103 2.347 1.00 . A A . 18 MET HB2 1 1 2 988 1 1 16 MET HB3 H 1.014 -14.239 2.689 1.00 . A A . 18 MET HB3 1 1 2 989 1 1 16 MET HE1 H -1.799 -12.301 5.681 1.00 . A A . 18 MET HE1 1 1 2 990 1 1 16 MET HE2 H -0.866 -10.824 5.916 1.00 . A A . 18 MET HE2 1 1 2 991 1 1 16 MET HE3 H -0.578 -12.216 6.958 1.00 . A A . 18 MET HE3 1 1 2 992 1 1 16 MET HG2 H -1.598 -13.572 4.059 1.00 . A A . 18 MET HG2 1 1 2 993 1 1 16 MET HG3 H -0.452 -14.741 4.713 1.00 . A A . 18 MET HG3 1 1 2 994 1 1 16 MET N N -1.802 -13.403 1.115 1.00 . A A . 18 MET N 1 1 2 995 1 1 16 MET O O 1.647 -13.434 0.737 1.00 . A A . 18 MET O 1 1 2 996 1 1 16 MET SD S 0.420 -12.510 4.798 1.00 . A A . 18 MET SD 1 1 2 997 1 1 17 GLU C C 2.586 -11.222 -0.743 1.00 . A A . 19 GLU C 1 1 2 998 1 1 17 GLU CA C 1.350 -11.848 -1.393 1.00 . A A . 19 GLU CA 1 1 2 999 1 1 17 GLU CB C 0.799 -10.904 -2.464 1.00 . A A . 19 GLU CB 1 1 2 1000 1 1 17 GLU CD C 1.844 -11.860 -4.523 1.00 . A A . 19 GLU CD 1 1 2 1001 1 1 17 GLU CG C 1.859 -10.682 -3.546 1.00 . A A . 19 GLU CG 1 1 2 1002 1 1 17 GLU H H -0.541 -11.596 -0.388 1.00 . A A . 19 GLU H 1 1 2 1003 1 1 17 GLU HA H 1.615 -12.795 -1.842 1.00 . A A . 19 GLU HA 1 1 2 1004 1 1 17 GLU HB2 H -0.084 -11.340 -2.908 1.00 . A A . 19 GLU HB2 1 1 2 1005 1 1 17 GLU HB3 H 0.546 -9.956 -2.012 1.00 . A A . 19 GLU HB3 1 1 2 1006 1 1 17 GLU HG2 H 1.643 -9.768 -4.079 1.00 . A A . 19 GLU HG2 1 1 2 1007 1 1 17 GLU HG3 H 2.833 -10.610 -3.086 1.00 . A A . 19 GLU HG3 1 1 2 1008 1 1 17 GLU N N 0.319 -12.063 -0.339 1.00 . A A . 19 GLU N 1 1 2 1009 1 1 17 GLU O O 2.479 -10.289 0.028 1.00 . A A . 19 GLU O 1 1 2 1010 1 1 17 GLU OE1 O 0.949 -12.682 -4.416 1.00 . A A . 19 GLU OE1 1 1 2 1011 1 1 17 GLU OE2 O 2.728 -11.918 -5.360 1.00 . A A . 19 GLU OE2 1 1 2 1012 1 1 18 TYR C C 5.560 -10.036 -1.262 1.00 . A A . 20 TYR C 1 1 2 1013 1 1 18 TYR CA C 4.973 -11.144 -0.388 1.00 . A A . 20 TYR CA 1 1 2 1014 1 1 18 TYR CB C 6.030 -12.222 -0.172 1.00 . A A . 20 TYR CB 1 1 2 1015 1 1 18 TYR CD1 C 6.310 -12.358 2.329 1.00 . A A . 20 TYR CD1 1 1 2 1016 1 1 18 TYR CD2 C 7.965 -11.152 1.032 1.00 . A A . 20 TYR CD2 1 1 2 1017 1 1 18 TYR CE1 C 7.010 -12.054 3.503 1.00 . A A . 20 TYR CE1 1 1 2 1018 1 1 18 TYR CE2 C 8.663 -10.845 2.205 1.00 . A A . 20 TYR CE2 1 1 2 1019 1 1 18 TYR CG C 6.789 -11.908 1.094 1.00 . A A . 20 TYR CG 1 1 2 1020 1 1 18 TYR CZ C 8.186 -11.297 3.441 1.00 . A A . 20 TYR CZ 1 1 2 1021 1 1 18 TYR H H 3.835 -12.488 -1.637 1.00 . A A . 20 TYR H 1 1 2 1022 1 1 18 TYR HA H 4.700 -10.726 0.570 1.00 . A A . 20 TYR HA 1 1 2 1023 1 1 18 TYR HB2 H 5.554 -13.188 -0.085 1.00 . A A . 20 TYR HB2 1 1 2 1024 1 1 18 TYR HB3 H 6.711 -12.223 -1.007 1.00 . A A . 20 TYR HB3 1 1 2 1025 1 1 18 TYR HD1 H 5.403 -12.941 2.377 1.00 . A A . 20 TYR HD1 1 1 2 1026 1 1 18 TYR HD2 H 8.333 -10.805 0.078 1.00 . A A . 20 TYR HD2 1 1 2 1027 1 1 18 TYR HE1 H 6.640 -12.399 4.457 1.00 . A A . 20 TYR HE1 1 1 2 1028 1 1 18 TYR HE2 H 9.570 -10.260 2.156 1.00 . A A . 20 TYR HE2 1 1 2 1029 1 1 18 TYR HH H 8.548 -10.153 4.928 1.00 . A A . 20 TYR HH 1 1 2 1030 1 1 18 TYR N N 3.758 -11.727 -1.024 1.00 . A A . 20 TYR N 1 1 2 1031 1 1 18 TYR O O 6.141 -10.280 -2.300 1.00 . A A . 20 TYR O 1 1 2 1032 1 1 18 TYR OH O 8.874 -10.995 4.598 1.00 . A A . 20 TYR OH 1 1 2 1033 1 1 19 ARG C C 6.012 -6.459 -0.609 1.00 . A A . 21 ARG C 1 1 2 1034 1 1 19 ARG CA C 5.969 -7.655 -1.565 1.00 . A A . 21 ARG CA 1 1 2 1035 1 1 19 ARG CB C 5.063 -7.323 -2.754 1.00 . A A . 21 ARG CB 1 1 2 1036 1 1 19 ARG CD C 5.651 -8.002 -5.082 1.00 . A A . 21 ARG CD 1 1 2 1037 1 1 19 ARG CG C 5.923 -6.987 -3.973 1.00 . A A . 21 ARG CG 1 1 2 1038 1 1 19 ARG CZ C 6.694 -10.169 -4.808 1.00 . A A . 21 ARG CZ 1 1 2 1039 1 1 19 ARG H H 4.970 -8.680 0.029 1.00 . A A . 21 ARG H 1 1 2 1040 1 1 19 ARG HA H 6.967 -7.877 -1.914 1.00 . A A . 21 ARG HA 1 1 2 1041 1 1 19 ARG HB2 H 4.435 -8.173 -2.978 1.00 . A A . 21 ARG HB2 1 1 2 1042 1 1 19 ARG HB3 H 4.446 -6.473 -2.509 1.00 . A A . 21 ARG HB3 1 1 2 1043 1 1 19 ARG HD2 H 4.675 -7.820 -5.506 1.00 . A A . 21 ARG HD2 1 1 2 1044 1 1 19 ARG HD3 H 6.403 -7.903 -5.852 1.00 . A A . 21 ARG HD3 1 1 2 1045 1 1 19 ARG HE H 4.986 -9.684 -3.913 1.00 . A A . 21 ARG HE 1 1 2 1046 1 1 19 ARG HG2 H 5.677 -5.995 -4.322 1.00 . A A . 21 ARG HG2 1 1 2 1047 1 1 19 ARG HG3 H 6.966 -7.025 -3.699 1.00 . A A . 21 ARG HG3 1 1 2 1048 1 1 19 ARG HH11 H 7.893 -9.452 -3.373 1.00 . A A . 21 ARG HH11 1 1 2 1049 1 1 19 ARG HH12 H 8.566 -10.714 -4.350 1.00 . A A . 21 ARG HH12 1 1 2 1050 1 1 19 ARG HH21 H 5.729 -11.072 -6.311 1.00 . A A . 21 ARG HH21 1 1 2 1051 1 1 19 ARG HH22 H 7.341 -11.631 -6.013 1.00 . A A . 21 ARG HH22 1 1 2 1052 1 1 19 ARG N N 5.425 -8.823 -0.818 1.00 . A A . 21 ARG N 1 1 2 1053 1 1 19 ARG NE N 5.700 -9.376 -4.513 1.00 . A A . 21 ARG NE 1 1 2 1054 1 1 19 ARG NH1 N 7.804 -10.107 -4.123 1.00 . A A . 21 ARG NH1 1 1 2 1055 1 1 19 ARG NH2 N 6.578 -11.024 -5.786 1.00 . A A . 21 ARG NH2 1 1 2 1056 1 1 19 ARG O O 5.087 -5.674 -0.559 1.00 . A A . 21 ARG O 1 1 2 1057 1 1 20 PRO C C 7.588 -3.968 0.422 1.00 . A A . 22 PRO C 1 1 2 1058 1 1 20 PRO CA C 7.266 -5.290 1.123 1.00 . A A . 22 PRO CA 1 1 2 1059 1 1 20 PRO CB C 8.445 -5.775 1.971 1.00 . A A . 22 PRO CB 1 1 2 1060 1 1 20 PRO CD C 8.209 -7.320 0.056 1.00 . A A . 22 PRO CD 1 1 2 1061 1 1 20 PRO CG C 9.211 -6.803 1.105 1.00 . A A . 22 PRO CG 1 1 2 1062 1 1 20 PRO HA H 6.389 -5.193 1.740 1.00 . A A . 22 PRO HA 1 1 2 1063 1 1 20 PRO HB2 H 9.088 -4.942 2.221 1.00 . A A . 22 PRO HB2 1 1 2 1064 1 1 20 PRO HB3 H 8.087 -6.252 2.870 1.00 . A A . 22 PRO HB3 1 1 2 1065 1 1 20 PRO HD2 H 8.653 -7.303 -0.931 1.00 . A A . 22 PRO HD2 1 1 2 1066 1 1 20 PRO HD3 H 7.876 -8.314 0.306 1.00 . A A . 22 PRO HD3 1 1 2 1067 1 1 20 PRO HG2 H 10.050 -6.324 0.619 1.00 . A A . 22 PRO HG2 1 1 2 1068 1 1 20 PRO HG3 H 9.554 -7.623 1.717 1.00 . A A . 22 PRO HG3 1 1 2 1069 1 1 20 PRO N N 7.081 -6.369 0.136 1.00 . A A . 22 PRO N 1 1 2 1070 1 1 20 PRO O O 8.663 -3.783 -0.114 1.00 . A A . 22 PRO O 1 1 2 1071 1 1 21 LEU C C 6.946 -0.625 0.815 1.00 . A A . 23 LEU C 1 1 2 1072 1 1 21 LEU CA C 6.927 -1.733 -0.241 1.00 . A A . 23 LEU CA 1 1 2 1073 1 1 21 LEU CB C 5.824 -1.452 -1.266 1.00 . A A . 23 LEU CB 1 1 2 1074 1 1 21 LEU CD1 C 5.160 -1.704 -3.660 1.00 . A A . 23 LEU CD1 1 1 2 1075 1 1 21 LEU CD2 C 7.563 -1.911 -3.008 1.00 . A A . 23 LEU CD2 1 1 2 1076 1 1 21 LEU CG C 6.123 -2.189 -2.574 1.00 . A A . 23 LEU CG 1 1 2 1077 1 1 21 LEU H H 5.797 -3.208 0.868 1.00 . A A . 23 LEU H 1 1 2 1078 1 1 21 LEU HA H 7.884 -1.769 -0.737 1.00 . A A . 23 LEU HA 1 1 2 1079 1 1 21 LEU HB2 H 4.883 -1.800 -0.875 1.00 . A A . 23 LEU HB2 1 1 2 1080 1 1 21 LEU HB3 H 5.769 -0.390 -1.456 1.00 . A A . 23 LEU HB3 1 1 2 1081 1 1 21 LEU HD11 H 4.158 -1.665 -3.260 1.00 . A A . 23 LEU HD11 1 1 2 1082 1 1 21 LEU HD12 H 5.189 -2.386 -4.497 1.00 . A A . 23 LEU HD12 1 1 2 1083 1 1 21 LEU HD13 H 5.454 -0.718 -3.990 1.00 . A A . 23 LEU HD13 1 1 2 1084 1 1 21 LEU HD21 H 7.879 -0.955 -2.617 1.00 . A A . 23 LEU HD21 1 1 2 1085 1 1 21 LEU HD22 H 7.618 -1.898 -4.085 1.00 . A A . 23 LEU HD22 1 1 2 1086 1 1 21 LEU HD23 H 8.210 -2.687 -2.626 1.00 . A A . 23 LEU HD23 1 1 2 1087 1 1 21 LEU HG H 5.989 -3.251 -2.426 1.00 . A A . 23 LEU HG 1 1 2 1088 1 1 21 LEU N N 6.664 -3.042 0.425 1.00 . A A . 23 LEU N 1 1 2 1089 1 1 21 LEU O O 6.178 -0.639 1.752 1.00 . A A . 23 LEU O 1 1 2 1090 1 1 22 CYS C C 7.067 2.619 1.256 1.00 . A A . 24 CYS C 1 1 2 1091 1 1 22 CYS CA C 7.906 1.417 1.697 1.00 . A A . 24 CYS CA 1 1 2 1092 1 1 22 CYS CB C 9.365 1.853 1.854 1.00 . A A . 24 CYS CB 1 1 2 1093 1 1 22 CYS H H 8.452 0.314 -0.073 1.00 . A A . 24 CYS H 1 1 2 1094 1 1 22 CYS HA H 7.539 1.052 2.643 1.00 . A A . 24 CYS HA 1 1 2 1095 1 1 22 CYS HB2 H 10.004 0.983 1.825 1.00 . A A . 24 CYS HB2 1 1 2 1096 1 1 22 CYS HB3 H 9.630 2.522 1.050 1.00 . A A . 24 CYS HB3 1 1 2 1097 1 1 22 CYS N N 7.830 0.326 0.683 1.00 . A A . 24 CYS N 1 1 2 1098 1 1 22 CYS O O 7.506 3.440 0.476 1.00 . A A . 24 CYS O 1 1 2 1099 1 1 22 CYS SG S 9.574 2.703 3.440 1.00 . A A . 24 CYS SG 1 1 2 1100 1 1 23 GLY C C 5.643 5.198 1.884 1.00 . A A . 25 GLY C 1 1 2 1101 1 1 23 GLY CA C 5.014 3.903 1.370 1.00 . A A . 25 GLY CA 1 1 2 1102 1 1 23 GLY H H 5.527 2.068 2.394 1.00 . A A . 25 GLY H 1 1 2 1103 1 1 23 GLY HA2 H 4.941 3.952 0.295 1.00 . A A . 25 GLY HA2 1 1 2 1104 1 1 23 GLY HA3 H 4.029 3.792 1.796 1.00 . A A . 25 GLY HA3 1 1 2 1105 1 1 23 GLY N N 5.866 2.739 1.758 1.00 . A A . 25 GLY N 1 1 2 1106 1 1 23 GLY O O 6.362 5.205 2.867 1.00 . A A . 25 GLY O 1 1 2 1107 1 1 24 SER C C 5.610 7.894 3.116 1.00 . A A . 26 SER C 1 1 2 1108 1 1 24 SER CA C 5.960 7.603 1.654 1.00 . A A . 26 SER CA 1 1 2 1109 1 1 24 SER CB C 5.418 8.727 0.774 1.00 . A A . 26 SER CB 1 1 2 1110 1 1 24 SER H H 4.791 6.258 0.426 1.00 . A A . 26 SER H 1 1 2 1111 1 1 24 SER HA H 7.032 7.564 1.554 1.00 . A A . 26 SER HA 1 1 2 1112 1 1 24 SER HB2 H 5.355 8.388 -0.247 1.00 . A A . 26 SER HB2 1 1 2 1113 1 1 24 SER HB3 H 4.433 9.009 1.119 1.00 . A A . 26 SER HB3 1 1 2 1114 1 1 24 SER HG H 5.763 10.635 0.929 1.00 . A A . 26 SER HG 1 1 2 1115 1 1 24 SER N N 5.376 6.296 1.220 1.00 . A A . 26 SER N 1 1 2 1116 1 1 24 SER O O 6.179 8.773 3.730 1.00 . A A . 26 SER O 1 1 2 1117 1 1 24 SER OG O 6.297 9.843 0.842 1.00 . A A . 26 SER OG 1 1 2 1118 1 1 25 ASP C C 5.361 6.759 6.028 1.00 . A A . 27 ASP C 1 1 2 1119 1 1 25 ASP CA C 4.325 7.418 5.107 1.00 . A A . 27 ASP CA 1 1 2 1120 1 1 25 ASP CB C 2.942 6.827 5.386 1.00 . A A . 27 ASP CB 1 1 2 1121 1 1 25 ASP CG C 3.038 5.300 5.430 1.00 . A A . 27 ASP CG 1 1 2 1122 1 1 25 ASP H H 4.236 6.462 3.180 1.00 . A A . 27 ASP H 1 1 2 1123 1 1 25 ASP HA H 4.306 8.482 5.292 1.00 . A A . 27 ASP HA 1 1 2 1124 1 1 25 ASP HB2 H 2.578 7.193 6.335 1.00 . A A . 27 ASP HB2 1 1 2 1125 1 1 25 ASP HB3 H 2.261 7.119 4.600 1.00 . A A . 27 ASP HB3 1 1 2 1126 1 1 25 ASP N N 4.688 7.169 3.684 1.00 . A A . 27 ASP N 1 1 2 1127 1 1 25 ASP O O 5.148 6.624 7.216 1.00 . A A . 27 ASP O 1 1 2 1128 1 1 25 ASP OD1 O 3.886 4.760 4.742 1.00 . A A . 27 ASP OD1 1 1 2 1129 1 1 25 ASP OD2 O 2.259 4.698 6.152 1.00 . A A . 27 ASP OD2 1 1 2 1130 1 1 26 ASN C C 6.976 4.363 6.849 1.00 . A A . 28 ASN C 1 1 2 1131 1 1 26 ASN CA C 7.516 5.696 6.340 1.00 . A A . 28 ASN CA 1 1 2 1132 1 1 26 ASN CB C 7.846 6.601 7.527 1.00 . A A . 28 ASN CB 1 1 2 1133 1 1 26 ASN CG C 9.338 6.945 7.513 1.00 . A A . 28 ASN CG 1 1 2 1134 1 1 26 ASN H H 6.639 6.454 4.537 1.00 . A A . 28 ASN H 1 1 2 1135 1 1 26 ASN HA H 8.409 5.524 5.755 1.00 . A A . 28 ASN HA 1 1 2 1136 1 1 26 ASN HB2 H 7.265 7.509 7.458 1.00 . A A . 28 ASN HB2 1 1 2 1137 1 1 26 ASN HB3 H 7.606 6.090 8.446 1.00 . A A . 28 ASN HB3 1 1 2 1138 1 1 26 ASN HD21 H 9.888 5.223 8.333 1.00 . A A . 28 ASN HD21 1 1 2 1139 1 1 26 ASN HD22 H 11.155 6.294 7.976 1.00 . A A . 28 ASN HD22 1 1 2 1140 1 1 26 ASN N N 6.481 6.344 5.493 1.00 . A A . 28 ASN N 1 1 2 1141 1 1 26 ASN ND2 N 10.198 6.082 7.980 1.00 . A A . 28 ASN ND2 1 1 2 1142 1 1 26 ASN O O 7.178 3.992 7.988 1.00 . A A . 28 ASN O 1 1 2 1143 1 1 26 ASN OD1 O 9.724 8.010 7.073 1.00 . A A . 28 ASN OD1 1 1 2 1144 1 1 27 LYS C C 5.979 1.265 5.401 1.00 . A A . 29 LYS C 1 1 2 1145 1 1 27 LYS CA C 5.717 2.336 6.460 1.00 . A A . 29 LYS CA 1 1 2 1146 1 1 27 LYS CB C 4.208 2.482 6.674 1.00 . A A . 29 LYS CB 1 1 2 1147 1 1 27 LYS CD C 2.288 1.862 8.144 1.00 . A A . 29 LYS CD 1 1 2 1148 1 1 27 LYS CE C 1.928 2.309 9.562 1.00 . A A . 29 LYS CE 1 1 2 1149 1 1 27 LYS CG C 3.810 1.815 7.991 1.00 . A A . 29 LYS CG 1 1 2 1150 1 1 27 LYS H H 6.119 3.960 5.098 1.00 . A A . 29 LYS H 1 1 2 1151 1 1 27 LYS HA H 6.182 2.043 7.387 1.00 . A A . 29 LYS HA 1 1 2 1152 1 1 27 LYS HB2 H 3.951 3.531 6.709 1.00 . A A . 29 LYS HB2 1 1 2 1153 1 1 27 LYS HB3 H 3.681 2.009 5.860 1.00 . A A . 29 LYS HB3 1 1 2 1154 1 1 27 LYS HD2 H 1.877 2.561 7.430 1.00 . A A . 29 LYS HD2 1 1 2 1155 1 1 27 LYS HD3 H 1.878 0.879 7.964 1.00 . A A . 29 LYS HD3 1 1 2 1156 1 1 27 LYS HE2 H 2.758 2.853 9.989 1.00 . A A . 29 LYS HE2 1 1 2 1157 1 1 27 LYS HE3 H 1.058 2.947 9.528 1.00 . A A . 29 LYS HE3 1 1 2 1158 1 1 27 LYS HG2 H 4.141 0.787 7.989 1.00 . A A . 29 LYS HG2 1 1 2 1159 1 1 27 LYS HG3 H 4.268 2.340 8.816 1.00 . A A . 29 LYS HG3 1 1 2 1160 1 1 27 LYS HZ1 H 0.702 1.222 10.846 1.00 . A A . 29 LYS HZ1 1 1 2 1161 1 1 27 LYS HZ2 H 2.363 1.022 11.139 1.00 . A A . 29 LYS HZ2 1 1 2 1162 1 1 27 LYS HZ3 H 1.634 0.262 9.806 1.00 . A A . 29 LYS HZ3 1 1 2 1163 1 1 27 LYS N N 6.278 3.640 6.015 1.00 . A A . 29 LYS N 1 1 2 1164 1 1 27 LYS NZ N 1.634 1.114 10.402 1.00 . A A . 29 LYS NZ 1 1 2 1165 1 1 27 LYS O O 6.313 1.560 4.272 1.00 . A A . 29 LYS O 1 1 2 1166 1 1 28 THR C C 4.799 -1.931 4.678 1.00 . A A . 30 THR C 1 1 2 1167 1 1 28 THR CA C 6.061 -1.077 4.785 1.00 . A A . 30 THR CA 1 1 2 1168 1 1 28 THR CB C 7.218 -1.957 5.265 1.00 . A A . 30 THR CB 1 1 2 1169 1 1 28 THR CG2 C 7.608 -2.937 4.158 1.00 . A A . 30 THR CG2 1 1 2 1170 1 1 28 THR H H 5.555 -0.193 6.680 1.00 . A A . 30 THR H 1 1 2 1171 1 1 28 THR HA H 6.302 -0.657 3.822 1.00 . A A . 30 THR HA 1 1 2 1172 1 1 28 THR HB H 6.909 -2.512 6.137 1.00 . A A . 30 THR HB 1 1 2 1173 1 1 28 THR HG1 H 8.854 -1.604 6.253 1.00 . A A . 30 THR HG1 1 1 2 1174 1 1 28 THR HG21 H 6.715 -3.361 3.723 1.00 . A A . 30 THR HG21 1 1 2 1175 1 1 28 THR HG22 H 8.216 -3.727 4.574 1.00 . A A . 30 THR HG22 1 1 2 1176 1 1 28 THR HG23 H 8.167 -2.416 3.396 1.00 . A A . 30 THR HG23 1 1 2 1177 1 1 28 THR N N 5.827 0.021 5.764 1.00 . A A . 30 THR N 1 1 2 1178 1 1 28 THR O O 4.313 -2.456 5.660 1.00 . A A . 30 THR O 1 1 2 1179 1 1 28 THR OG1 O 8.332 -1.141 5.594 1.00 . A A . 30 THR OG1 1 1 2 1180 1 1 29 TYR C C 3.417 -4.343 3.011 1.00 . A A . 31 TYR C 1 1 2 1181 1 1 29 TYR CA C 3.029 -2.909 3.366 1.00 . A A . 31 TYR CA 1 1 2 1182 1 1 29 TYR CB C 2.107 -2.367 2.268 1.00 . A A . 31 TYR CB 1 1 2 1183 1 1 29 TYR CD1 C 2.967 0.005 2.320 1.00 . A A . 31 TYR CD1 1 1 2 1184 1 1 29 TYR CD2 C 2.922 -1.191 0.213 1.00 . A A . 31 TYR CD2 1 1 2 1185 1 1 29 TYR CE1 C 3.484 1.128 1.667 1.00 . A A . 31 TYR CE1 1 1 2 1186 1 1 29 TYR CE2 C 3.440 -0.072 -0.438 1.00 . A A . 31 TYR CE2 1 1 2 1187 1 1 29 TYR CG C 2.688 -1.155 1.589 1.00 . A A . 31 TYR CG 1 1 2 1188 1 1 29 TYR CZ C 3.720 1.086 0.286 1.00 . A A . 31 TYR CZ 1 1 2 1189 1 1 29 TYR H H 4.656 -1.656 2.715 1.00 . A A . 31 TYR H 1 1 2 1190 1 1 29 TYR HA H 2.500 -2.909 4.307 1.00 . A A . 31 TYR HA 1 1 2 1191 1 1 29 TYR HB2 H 1.947 -3.134 1.530 1.00 . A A . 31 TYR HB2 1 1 2 1192 1 1 29 TYR HB3 H 1.165 -2.100 2.709 1.00 . A A . 31 TYR HB3 1 1 2 1193 1 1 29 TYR HD1 H 2.785 0.031 3.384 1.00 . A A . 31 TYR HD1 1 1 2 1194 1 1 29 TYR HD2 H 2.705 -2.088 -0.348 1.00 . A A . 31 TYR HD2 1 1 2 1195 1 1 29 TYR HE1 H 3.697 2.025 2.225 1.00 . A A . 31 TYR HE1 1 1 2 1196 1 1 29 TYR HE2 H 3.625 -0.102 -1.501 1.00 . A A . 31 TYR HE2 1 1 2 1197 1 1 29 TYR HH H 5.070 1.943 -0.748 1.00 . A A . 31 TYR HH 1 1 2 1198 1 1 29 TYR N N 4.257 -2.080 3.499 1.00 . A A . 31 TYR N 1 1 2 1199 1 1 29 TYR O O 4.520 -4.612 2.573 1.00 . A A . 31 TYR O 1 1 2 1200 1 1 29 TYR OH O 4.226 2.187 -0.365 1.00 . A A . 31 TYR OH 1 1 2 1201 1 1 30 GLY C C 2.777 -6.878 1.347 1.00 . A A . 32 GLY C 1 1 2 1202 1 1 30 GLY CA C 2.808 -6.686 2.864 1.00 . A A . 32 GLY CA 1 1 2 1203 1 1 30 GLY H H 1.627 -5.021 3.539 1.00 . A A . 32 GLY H 1 1 2 1204 1 1 30 GLY HA2 H 3.789 -6.943 3.242 1.00 . A A . 32 GLY HA2 1 1 2 1205 1 1 30 GLY HA3 H 2.068 -7.326 3.319 1.00 . A A . 32 GLY HA3 1 1 2 1206 1 1 30 GLY N N 2.509 -5.266 3.191 1.00 . A A . 32 GLY N 1 1 2 1207 1 1 30 GLY O O 3.254 -7.867 0.833 1.00 . A A . 32 GLY O 1 1 2 1208 1 1 31 ASN C C 1.421 -4.907 -1.470 1.00 . A A . 33 ASN C 1 1 2 1209 1 1 31 ASN CA C 2.172 -6.088 -0.855 1.00 . A A . 33 ASN CA 1 1 2 1210 1 1 31 ASN CB C 1.463 -7.393 -1.221 1.00 . A A . 33 ASN CB 1 1 2 1211 1 1 31 ASN CG C 0.189 -7.534 -0.388 1.00 . A A . 33 ASN CG 1 1 2 1212 1 1 31 ASN H H 1.835 -5.149 1.053 1.00 . A A . 33 ASN H 1 1 2 1213 1 1 31 ASN HA H 3.177 -6.110 -1.244 1.00 . A A . 33 ASN HA 1 1 2 1214 1 1 31 ASN HB2 H 1.208 -7.382 -2.271 1.00 . A A . 33 ASN HB2 1 1 2 1215 1 1 31 ASN HB3 H 2.117 -8.227 -1.018 1.00 . A A . 33 ASN HB3 1 1 2 1216 1 1 31 ASN HD21 H 0.418 -9.485 -0.102 1.00 . A A . 33 ASN HD21 1 1 2 1217 1 1 31 ASN HD22 H -0.960 -8.803 0.617 1.00 . A A . 33 ASN HD22 1 1 2 1218 1 1 31 ASN N N 2.220 -5.942 0.624 1.00 . A A . 33 ASN N 1 1 2 1219 1 1 31 ASN ND2 N -0.145 -8.705 0.081 1.00 . A A . 33 ASN ND2 1 1 2 1220 1 1 31 ASN O O 0.786 -4.135 -0.781 1.00 . A A . 33 ASN O 1 1 2 1221 1 1 31 ASN OD1 O -0.509 -6.567 -0.160 1.00 . A A . 33 ASN OD1 1 1 2 1222 1 1 32 LYS C C -0.709 -3.753 -3.176 1.00 . A A . 34 LYS C 1 1 2 1223 1 1 32 LYS CA C 0.791 -3.641 -3.436 1.00 . A A . 34 LYS CA 1 1 2 1224 1 1 32 LYS CB C 1.056 -3.703 -4.942 1.00 . A A . 34 LYS CB 1 1 2 1225 1 1 32 LYS CD C 1.846 -2.325 -6.868 1.00 . A A . 34 LYS CD 1 1 2 1226 1 1 32 LYS CE C 1.540 -0.855 -7.163 1.00 . A A . 34 LYS CE 1 1 2 1227 1 1 32 LYS CG C 1.948 -2.532 -5.356 1.00 . A A . 34 LYS CG 1 1 2 1228 1 1 32 LYS H H 2.016 -5.394 -3.290 1.00 . A A . 34 LYS H 1 1 2 1229 1 1 32 LYS HA H 1.153 -2.704 -3.044 1.00 . A A . 34 LYS HA 1 1 2 1230 1 1 32 LYS HB2 H 1.550 -4.634 -5.182 1.00 . A A . 34 LYS HB2 1 1 2 1231 1 1 32 LYS HB3 H 0.120 -3.646 -5.476 1.00 . A A . 34 LYS HB3 1 1 2 1232 1 1 32 LYS HD2 H 2.784 -2.598 -7.332 1.00 . A A . 34 LYS HD2 1 1 2 1233 1 1 32 LYS HD3 H 1.055 -2.942 -7.263 1.00 . A A . 34 LYS HD3 1 1 2 1234 1 1 32 LYS HE2 H 1.357 -0.732 -8.221 1.00 . A A . 34 LYS HE2 1 1 2 1235 1 1 32 LYS HE3 H 0.664 -0.553 -6.609 1.00 . A A . 34 LYS HE3 1 1 2 1236 1 1 32 LYS HG2 H 1.624 -1.636 -4.846 1.00 . A A . 34 LYS HG2 1 1 2 1237 1 1 32 LYS HG3 H 2.972 -2.747 -5.091 1.00 . A A . 34 LYS HG3 1 1 2 1238 1 1 32 LYS HZ1 H 3.082 0.475 -7.592 1.00 . A A . 34 LYS HZ1 1 1 2 1239 1 1 32 LYS HZ2 H 3.437 -0.618 -6.341 1.00 . A A . 34 LYS HZ2 1 1 2 1240 1 1 32 LYS HZ3 H 2.390 0.690 -6.060 1.00 . A A . 34 LYS HZ3 1 1 2 1241 1 1 32 LYS N N 1.494 -4.763 -2.762 1.00 . A A . 34 LYS N 1 1 2 1242 1 1 32 LYS NZ N 2.700 -0.013 -6.759 1.00 . A A . 34 LYS NZ 1 1 2 1243 1 1 32 LYS O O -1.456 -2.825 -3.405 1.00 . A A . 34 LYS O 1 1 2 1244 1 1 33 CYS C C -2.944 -4.197 -1.163 1.00 . A A . 35 CYS C 1 1 2 1245 1 1 33 CYS CA C -2.614 -5.022 -2.403 1.00 . A A . 35 CYS CA 1 1 2 1246 1 1 33 CYS CB C -2.945 -6.491 -2.145 1.00 . A A . 35 CYS CB 1 1 2 1247 1 1 33 CYS H H -0.545 -5.616 -2.499 1.00 . A A . 35 CYS H 1 1 2 1248 1 1 33 CYS HA H -3.187 -4.661 -3.244 1.00 . A A . 35 CYS HA 1 1 2 1249 1 1 33 CYS HB2 H -2.752 -7.067 -3.038 1.00 . A A . 35 CYS HB2 1 1 2 1250 1 1 33 CYS HB3 H -2.331 -6.862 -1.337 1.00 . A A . 35 CYS HB3 1 1 2 1251 1 1 33 CYS N N -1.160 -4.876 -2.688 1.00 . A A . 35 CYS N 1 1 2 1252 1 1 33 CYS O O -4.001 -3.607 -1.052 1.00 . A A . 35 CYS O 1 1 2 1253 1 1 33 CYS SG S -4.690 -6.641 -1.693 1.00 . A A . 35 CYS SG 1 1 2 1254 1 1 34 ASN C C -1.937 -1.885 0.686 1.00 . A A . 36 ASN C 1 1 2 1255 1 1 34 ASN CA C -2.256 -3.346 0.994 1.00 . A A . 36 ASN CA 1 1 2 1256 1 1 34 ASN CB C -1.325 -3.847 2.099 1.00 . A A . 36 ASN CB 1 1 2 1257 1 1 34 ASN CG C -2.117 -4.004 3.399 1.00 . A A . 36 ASN CG 1 1 2 1258 1 1 34 ASN H H -1.183 -4.611 -0.359 1.00 . A A . 36 ASN H 1 1 2 1259 1 1 34 ASN HA H -3.285 -3.438 1.309 1.00 . A A . 36 ASN HA 1 1 2 1260 1 1 34 ASN HB2 H -0.903 -4.801 1.812 1.00 . A A . 36 ASN HB2 1 1 2 1261 1 1 34 ASN HB3 H -0.531 -3.136 2.246 1.00 . A A . 36 ASN HB3 1 1 2 1262 1 1 34 ASN HD21 H -3.239 -5.486 2.703 1.00 . A A . 36 ASN HD21 1 1 2 1263 1 1 34 ASN HD22 H -3.562 -5.021 4.302 1.00 . A A . 36 ASN HD22 1 1 2 1264 1 1 34 ASN N N -2.029 -4.141 -0.237 1.00 . A A . 36 ASN N 1 1 2 1265 1 1 34 ASN ND2 N -3.050 -4.912 3.474 1.00 . A A . 36 ASN ND2 1 1 2 1266 1 1 34 ASN O O -2.372 -0.980 1.371 1.00 . A A . 36 ASN O 1 1 2 1267 1 1 34 ASN OD1 O -1.885 -3.291 4.355 1.00 . A A . 36 ASN OD1 1 1 2 1268 1 1 35 PHE C C -2.031 0.396 -1.391 1.00 . A A . 37 PHE C 1 1 2 1269 1 1 35 PHE CA C -0.823 -0.264 -0.725 1.00 . A A . 37 PHE CA 1 1 2 1270 1 1 35 PHE CB C 0.355 -0.288 -1.704 1.00 . A A . 37 PHE CB 1 1 2 1271 1 1 35 PHE CD1 C 1.334 1.907 -0.937 1.00 . A A . 37 PHE CD1 1 1 2 1272 1 1 35 PHE CD2 C 0.686 1.665 -3.262 1.00 . A A . 37 PHE CD2 1 1 2 1273 1 1 35 PHE CE1 C 1.747 3.223 -1.187 1.00 . A A . 37 PHE CE1 1 1 2 1274 1 1 35 PHE CE2 C 1.098 2.979 -3.512 1.00 . A A . 37 PHE CE2 1 1 2 1275 1 1 35 PHE CG C 0.805 1.128 -1.975 1.00 . A A . 37 PHE CG 1 1 2 1276 1 1 35 PHE CZ C 1.628 3.757 -2.476 1.00 . A A . 37 PHE CZ 1 1 2 1277 1 1 35 PHE H H -0.846 -2.405 -0.887 1.00 . A A . 37 PHE H 1 1 2 1278 1 1 35 PHE HA H -0.548 0.291 0.159 1.00 . A A . 37 PHE HA 1 1 2 1279 1 1 35 PHE HB2 H 1.169 -0.851 -1.274 1.00 . A A . 37 PHE HB2 1 1 2 1280 1 1 35 PHE HB3 H 0.048 -0.754 -2.630 1.00 . A A . 37 PHE HB3 1 1 2 1281 1 1 35 PHE HD1 H 1.425 1.492 0.057 1.00 . A A . 37 PHE HD1 1 1 2 1282 1 1 35 PHE HD2 H 0.279 1.064 -4.063 1.00 . A A . 37 PHE HD2 1 1 2 1283 1 1 35 PHE HE1 H 2.159 3.825 -0.384 1.00 . A A . 37 PHE HE1 1 1 2 1284 1 1 35 PHE HE2 H 1.007 3.393 -4.506 1.00 . A A . 37 PHE HE2 1 1 2 1285 1 1 35 PHE HZ H 1.944 4.769 -2.671 1.00 . A A . 37 PHE HZ 1 1 2 1286 1 1 35 PHE N N -1.178 -1.656 -0.350 1.00 . A A . 37 PHE N 1 1 2 1287 1 1 35 PHE O O -2.374 1.525 -1.103 1.00 . A A . 37 PHE O 1 1 2 1288 1 1 36 CYS C C -5.056 0.243 -1.974 1.00 . A A . 38 CYS C 1 1 2 1289 1 1 36 CYS CA C -3.878 0.263 -2.948 1.00 . A A . 38 CYS CA 1 1 2 1290 1 1 36 CYS CB C -4.214 -0.572 -4.186 1.00 . A A . 38 CYS CB 1 1 2 1291 1 1 36 CYS H H -2.395 -1.221 -2.477 1.00 . A A . 38 CYS H 1 1 2 1292 1 1 36 CYS HA H -3.671 1.281 -3.244 1.00 . A A . 38 CYS HA 1 1 2 1293 1 1 36 CYS HB2 H -4.314 -1.610 -3.904 1.00 . A A . 38 CYS HB2 1 1 2 1294 1 1 36 CYS HB3 H -5.141 -0.224 -4.616 1.00 . A A . 38 CYS HB3 1 1 2 1295 1 1 36 CYS N N -2.685 -0.310 -2.270 1.00 . A A . 38 CYS N 1 1 2 1296 1 1 36 CYS O O -6.029 0.951 -2.142 1.00 . A A . 38 CYS O 1 1 2 1297 1 1 36 CYS SG S -2.883 -0.401 -5.402 1.00 . A A . 38 CYS SG 1 1 2 1298 1 1 37 CYS C C -5.986 0.618 0.949 1.00 . A A . 39 CYS C 1 1 2 1299 1 1 37 CYS CA C -6.073 -0.615 0.052 1.00 . A A . 39 CYS CA 1 1 2 1300 1 1 37 CYS CB C -5.932 -1.879 0.904 1.00 . A A . 39 CYS CB 1 1 2 1301 1 1 37 CYS H H -4.170 -1.113 -0.823 1.00 . A A . 39 CYS H 1 1 2 1302 1 1 37 CYS HA H -7.022 -0.623 -0.460 1.00 . A A . 39 CYS HA 1 1 2 1303 1 1 37 CYS HB2 H -6.176 -2.745 0.307 1.00 . A A . 39 CYS HB2 1 1 2 1304 1 1 37 CYS HB3 H -4.916 -1.961 1.259 1.00 . A A . 39 CYS HB3 1 1 2 1305 1 1 37 CYS N N -4.969 -0.558 -0.945 1.00 . A A . 39 CYS N 1 1 2 1306 1 1 37 CYS O O -6.975 1.261 1.242 1.00 . A A . 39 CYS O 1 1 2 1307 1 1 37 CYS SG S -7.060 -1.785 2.319 1.00 . A A . 39 CYS SG 1 1 2 1308 1 1 38 ALA C C -4.662 3.402 1.373 1.00 . A A . 40 ALA C 1 1 2 1309 1 1 38 ALA CA C -4.637 2.149 2.247 1.00 . A A . 40 ALA CA 1 1 2 1310 1 1 38 ALA CB C -3.301 2.061 2.990 1.00 . A A . 40 ALA CB 1 1 2 1311 1 1 38 ALA H H -4.022 0.422 1.120 1.00 . A A . 40 ALA H 1 1 2 1312 1 1 38 ALA HA H -5.445 2.190 2.961 1.00 . A A . 40 ALA HA 1 1 2 1313 1 1 38 ALA HB1 H -2.641 1.385 2.467 1.00 . A A . 40 ALA HB1 1 1 2 1314 1 1 38 ALA HB2 H -3.472 1.695 3.992 1.00 . A A . 40 ALA HB2 1 1 2 1315 1 1 38 ALA HB3 H -2.849 3.041 3.037 1.00 . A A . 40 ALA HB3 1 1 2 1316 1 1 38 ALA N N -4.803 0.954 1.377 1.00 . A A . 40 ALA N 1 1 2 1317 1 1 38 ALA O O -4.891 4.499 1.844 1.00 . A A . 40 ALA O 1 1 2 1318 1 1 39 VAL C C -5.906 4.807 -1.103 1.00 . A A . 41 VAL C 1 1 2 1319 1 1 39 VAL CA C -4.456 4.422 -0.816 1.00 . A A . 41 VAL CA 1 1 2 1320 1 1 39 VAL CB C -3.755 4.066 -2.128 1.00 . A A . 41 VAL CB 1 1 2 1321 1 1 39 VAL CG1 C -4.038 5.148 -3.171 1.00 . A A . 41 VAL CG1 1 1 2 1322 1 1 39 VAL CG2 C -2.248 3.972 -1.890 1.00 . A A . 41 VAL CG2 1 1 2 1323 1 1 39 VAL H H -4.262 2.350 -0.262 1.00 . A A . 41 VAL H 1 1 2 1324 1 1 39 VAL HA H -3.950 5.251 -0.347 1.00 . A A . 41 VAL HA 1 1 2 1325 1 1 39 VAL HB H -4.125 3.116 -2.487 1.00 . A A . 41 VAL HB 1 1 2 1326 1 1 39 VAL HG11 H -3.577 6.075 -2.862 1.00 . A A . 41 VAL HG11 1 1 2 1327 1 1 39 VAL HG12 H -5.106 5.290 -3.262 1.00 . A A . 41 VAL HG12 1 1 2 1328 1 1 39 VAL HG13 H -3.633 4.845 -4.125 1.00 . A A . 41 VAL HG13 1 1 2 1329 1 1 39 VAL HG21 H -1.790 4.928 -2.105 1.00 . A A . 41 VAL HG21 1 1 2 1330 1 1 39 VAL HG22 H -1.827 3.217 -2.536 1.00 . A A . 41 VAL HG22 1 1 2 1331 1 1 39 VAL HG23 H -2.062 3.709 -0.860 1.00 . A A . 41 VAL HG23 1 1 2 1332 1 1 39 VAL N N -4.438 3.246 0.096 1.00 . A A . 41 VAL N 1 1 2 1333 1 1 39 VAL O O -6.240 5.967 -1.231 1.00 . A A . 41 VAL O 1 1 2 1334 1 1 40 VAL C C -8.918 4.458 -0.170 1.00 . A A . 42 VAL C 1 1 2 1335 1 1 40 VAL CA C -8.199 4.144 -1.484 1.00 . A A . 42 VAL CA 1 1 2 1336 1 1 40 VAL CB C -8.857 2.938 -2.155 1.00 . A A . 42 VAL CB 1 1 2 1337 1 1 40 VAL CG1 C -10.300 3.283 -2.525 1.00 . A A . 42 VAL CG1 1 1 2 1338 1 1 40 VAL CG2 C -8.078 2.578 -3.423 1.00 . A A . 42 VAL CG2 1 1 2 1339 1 1 40 VAL H H -6.479 2.909 -1.098 1.00 . A A . 42 VAL H 1 1 2 1340 1 1 40 VAL HA H -8.261 4.999 -2.141 1.00 . A A . 42 VAL HA 1 1 2 1341 1 1 40 VAL HB H -8.850 2.098 -1.475 1.00 . A A . 42 VAL HB 1 1 2 1342 1 1 40 VAL HG11 H -10.528 4.283 -2.185 1.00 . A A . 42 VAL HG11 1 1 2 1343 1 1 40 VAL HG12 H -10.970 2.582 -2.053 1.00 . A A . 42 VAL HG12 1 1 2 1344 1 1 40 VAL HG13 H -10.419 3.232 -3.597 1.00 . A A . 42 VAL HG13 1 1 2 1345 1 1 40 VAL HG21 H -7.042 2.859 -3.300 1.00 . A A . 42 VAL HG21 1 1 2 1346 1 1 40 VAL HG22 H -8.498 3.108 -4.265 1.00 . A A . 42 VAL HG22 1 1 2 1347 1 1 40 VAL HG23 H -8.145 1.514 -3.596 1.00 . A A . 42 VAL HG23 1 1 2 1348 1 1 40 VAL N N -6.771 3.838 -1.205 1.00 . A A . 42 VAL N 1 1 2 1349 1 1 40 VAL O O -10.010 4.991 -0.162 1.00 . A A . 42 VAL O 1 1 2 1350 1 1 41 GLU C C -8.438 5.750 2.806 1.00 . A A . 43 GLU C 1 1 2 1351 1 1 41 GLU CA C -8.968 4.424 2.251 1.00 . A A . 43 GLU CA 1 1 2 1352 1 1 41 GLU CB C -8.669 3.286 3.236 1.00 . A A . 43 GLU CB 1 1 2 1353 1 1 41 GLU CD C -7.247 4.399 4.967 1.00 . A A . 43 GLU CD 1 1 2 1354 1 1 41 GLU CG C -7.246 3.428 3.785 1.00 . A A . 43 GLU CG 1 1 2 1355 1 1 41 GLU H H -7.431 3.710 0.917 1.00 . A A . 43 GLU H 1 1 2 1356 1 1 41 GLU HA H -10.036 4.500 2.106 1.00 . A A . 43 GLU HA 1 1 2 1357 1 1 41 GLU HB2 H -9.375 3.327 4.054 1.00 . A A . 43 GLU HB2 1 1 2 1358 1 1 41 GLU HB3 H -8.763 2.338 2.729 1.00 . A A . 43 GLU HB3 1 1 2 1359 1 1 41 GLU HG2 H -6.890 2.462 4.113 1.00 . A A . 43 GLU HG2 1 1 2 1360 1 1 41 GLU HG3 H -6.598 3.808 3.010 1.00 . A A . 43 GLU HG3 1 1 2 1361 1 1 41 GLU N N -8.314 4.136 0.942 1.00 . A A . 43 GLU N 1 1 2 1362 1 1 41 GLU O O -9.049 6.366 3.656 1.00 . A A . 43 GLU O 1 1 2 1363 1 1 41 GLU OE1 O -8.111 4.264 5.818 1.00 . A A . 43 GLU OE1 1 1 2 1364 1 1 41 GLU OE2 O -6.382 5.259 5.002 1.00 . A A . 43 GLU OE2 1 1 2 1365 1 1 42 SER C C -7.011 8.585 1.798 1.00 . A A . 44 SER C 1 1 2 1366 1 1 42 SER CA C -6.742 7.483 2.826 1.00 . A A . 44 SER CA 1 1 2 1367 1 1 42 SER CB C -5.234 7.332 3.033 1.00 . A A . 44 SER CB 1 1 2 1368 1 1 42 SER H H -6.830 5.685 1.640 1.00 . A A . 44 SER H 1 1 2 1369 1 1 42 SER HA H -7.211 7.743 3.764 1.00 . A A . 44 SER HA 1 1 2 1370 1 1 42 SER HB2 H -4.990 6.292 3.165 1.00 . A A . 44 SER HB2 1 1 2 1371 1 1 42 SER HB3 H -4.712 7.715 2.166 1.00 . A A . 44 SER HB3 1 1 2 1372 1 1 42 SER HG H -3.993 7.719 4.481 1.00 . A A . 44 SER HG 1 1 2 1373 1 1 42 SER N N -7.307 6.196 2.328 1.00 . A A . 44 SER N 1 1 2 1374 1 1 42 SER O O -6.483 9.676 1.886 1.00 . A A . 44 SER O 1 1 2 1375 1 1 42 SER OG O -4.845 8.055 4.194 1.00 . A A . 44 SER OG 1 1 2 1376 1 1 43 ASN C C -6.913 9.542 -1.103 1.00 . A A . 45 ASN C 1 1 2 1377 1 1 43 ASN CA C -8.141 9.324 -0.221 1.00 . A A . 45 ASN CA 1 1 2 1378 1 1 43 ASN CB C -8.534 10.642 0.452 1.00 . A A . 45 ASN CB 1 1 2 1379 1 1 43 ASN CG C -9.140 11.582 -0.593 1.00 . A A . 45 ASN CG 1 1 2 1380 1 1 43 ASN H H -8.239 7.417 0.769 1.00 . A A . 45 ASN H 1 1 2 1381 1 1 43 ASN HA H -8.961 8.975 -0.830 1.00 . A A . 45 ASN HA 1 1 2 1382 1 1 43 ASN HB2 H -9.261 10.446 1.227 1.00 . A A . 45 ASN HB2 1 1 2 1383 1 1 43 ASN HB3 H -7.659 11.102 0.884 1.00 . A A . 45 ASN HB3 1 1 2 1384 1 1 43 ASN HD21 H -7.878 13.063 -0.201 1.00 . A A . 45 ASN HD21 1 1 2 1385 1 1 43 ASN HD22 H -9.019 13.383 -1.416 1.00 . A A . 45 ASN HD22 1 1 2 1386 1 1 43 ASN N N -7.829 8.303 0.820 1.00 . A A . 45 ASN N 1 1 2 1387 1 1 43 ASN ND2 N -8.637 12.775 -0.749 1.00 . A A . 45 ASN ND2 1 1 2 1388 1 1 43 ASN O O -6.827 10.504 -1.840 1.00 . A A . 45 ASN O 1 1 2 1389 1 1 43 ASN OD1 O -10.082 11.226 -1.273 1.00 . A A . 45 ASN OD1 1 1 2 1390 1 1 44 GLY C C -3.638 9.458 -1.033 1.00 . A A . 46 GLY C 1 1 2 1391 1 1 44 GLY CA C -4.738 8.805 -1.867 1.00 . A A . 46 GLY CA 1 1 2 1392 1 1 44 GLY H H -6.052 7.887 -0.430 1.00 . A A . 46 GLY H 1 1 2 1393 1 1 44 GLY HA2 H -4.410 7.832 -2.203 1.00 . A A . 46 GLY HA2 1 1 2 1394 1 1 44 GLY HA3 H -4.957 9.430 -2.720 1.00 . A A . 46 GLY HA3 1 1 2 1395 1 1 44 GLY N N -5.961 8.655 -1.033 1.00 . A A . 46 GLY N 1 1 2 1396 1 1 44 GLY O O -2.732 10.076 -1.555 1.00 . A A . 46 GLY O 1 1 2 1397 1 1 45 THR C C -1.425 9.055 1.138 1.00 . A A . 47 THR C 1 1 2 1398 1 1 45 THR CA C -2.672 9.940 1.127 1.00 . A A . 47 THR CA 1 1 2 1399 1 1 45 THR CB C -3.220 10.072 2.546 1.00 . A A . 47 THR CB 1 1 2 1400 1 1 45 THR CG2 C -2.105 10.538 3.476 1.00 . A A . 47 THR CG2 1 1 2 1401 1 1 45 THR H H -4.451 8.828 0.667 1.00 . A A . 47 THR H 1 1 2 1402 1 1 45 THR HA H -2.417 10.916 0.748 1.00 . A A . 47 THR HA 1 1 2 1403 1 1 45 THR HB H -3.588 9.115 2.881 1.00 . A A . 47 THR HB 1 1 2 1404 1 1 45 THR HG1 H -4.727 10.967 1.706 1.00 . A A . 47 THR HG1 1 1 2 1405 1 1 45 THR HG21 H -1.897 9.767 4.201 1.00 . A A . 47 THR HG21 1 1 2 1406 1 1 45 THR HG22 H -2.417 11.438 3.984 1.00 . A A . 47 THR HG22 1 1 2 1407 1 1 45 THR HG23 H -1.216 10.739 2.897 1.00 . A A . 47 THR HG23 1 1 2 1408 1 1 45 THR N N -3.710 9.326 0.263 1.00 . A A . 47 THR N 1 1 2 1409 1 1 45 THR O O -0.311 9.534 1.218 1.00 . A A . 47 THR O 1 1 2 1410 1 1 45 THR OG1 O -4.279 11.018 2.554 1.00 . A A . 47 THR OG1 1 1 2 1411 1 1 46 LEU C C 0.284 6.955 -0.310 1.00 . A A . 48 LEU C 1 1 2 1412 1 1 46 LEU CA C -0.420 6.855 1.046 1.00 . A A . 48 LEU CA 1 1 2 1413 1 1 46 LEU CB C -0.880 5.414 1.283 1.00 . A A . 48 LEU CB 1 1 2 1414 1 1 46 LEU CD1 C 0.300 4.915 3.430 1.00 . A A . 48 LEU CD1 1 1 2 1415 1 1 46 LEU CD2 C 0.004 3.120 1.720 1.00 . A A . 48 LEU CD2 1 1 2 1416 1 1 46 LEU CG C 0.252 4.615 1.930 1.00 . A A . 48 LEU CG 1 1 2 1417 1 1 46 LEU H H -2.505 7.397 0.980 1.00 . A A . 48 LEU H 1 1 2 1418 1 1 46 LEU HA H 0.264 7.150 1.829 1.00 . A A . 48 LEU HA 1 1 2 1419 1 1 46 LEU HB2 H -1.740 5.415 1.939 1.00 . A A . 48 LEU HB2 1 1 2 1420 1 1 46 LEU HB3 H -1.146 4.960 0.341 1.00 . A A . 48 LEU HB3 1 1 2 1421 1 1 46 LEU HD11 H 0.870 5.817 3.600 1.00 . A A . 48 LEU HD11 1 1 2 1422 1 1 46 LEU HD12 H 0.769 4.091 3.947 1.00 . A A . 48 LEU HD12 1 1 2 1423 1 1 46 LEU HD13 H -0.705 5.049 3.803 1.00 . A A . 48 LEU HD13 1 1 2 1424 1 1 46 LEU HD21 H 0.944 2.620 1.538 1.00 . A A . 48 LEU HD21 1 1 2 1425 1 1 46 LEU HD22 H -0.649 2.980 0.871 1.00 . A A . 48 LEU HD22 1 1 2 1426 1 1 46 LEU HD23 H -0.460 2.704 2.603 1.00 . A A . 48 LEU HD23 1 1 2 1427 1 1 46 LEU HG H 1.193 4.893 1.478 1.00 . A A . 48 LEU HG 1 1 2 1428 1 1 46 LEU N N -1.600 7.766 1.049 1.00 . A A . 48 LEU N 1 1 2 1429 1 1 46 LEU O O -0.349 7.138 -1.332 1.00 . A A . 48 LEU O 1 1 2 1430 1 1 47 THR C C 3.555 6.057 -1.613 1.00 . A A . 49 THR C 1 1 2 1431 1 1 47 THR CA C 2.309 6.955 -1.632 1.00 . A A . 49 THR CA 1 1 2 1432 1 1 47 THR CB C 2.702 8.416 -1.868 1.00 . A A . 49 THR CB 1 1 2 1433 1 1 47 THR CG2 C 1.443 9.244 -2.122 1.00 . A A . 49 THR CG2 1 1 2 1434 1 1 47 THR H H 2.083 6.711 0.499 1.00 . A A . 49 THR H 1 1 2 1435 1 1 47 THR HA H 1.658 6.633 -2.430 1.00 . A A . 49 THR HA 1 1 2 1436 1 1 47 THR HB H 3.349 8.485 -2.725 1.00 . A A . 49 THR HB 1 1 2 1437 1 1 47 THR HG1 H 3.514 9.857 -0.852 1.00 . A A . 49 THR HG1 1 1 2 1438 1 1 47 THR HG21 H 1.708 10.146 -2.653 1.00 . A A . 49 THR HG21 1 1 2 1439 1 1 47 THR HG22 H 0.985 9.501 -1.179 1.00 . A A . 49 THR HG22 1 1 2 1440 1 1 47 THR HG23 H 0.747 8.669 -2.716 1.00 . A A . 49 THR HG23 1 1 2 1441 1 1 47 THR N N 1.585 6.850 -0.334 1.00 . A A . 49 THR N 1 1 2 1442 1 1 47 THR O O 3.647 5.124 -0.846 1.00 . A A . 49 THR O 1 1 2 1443 1 1 47 THR OG1 O 3.371 8.916 -0.723 1.00 . A A . 49 THR OG1 1 1 2 1444 1 1 48 LEU C C 6.933 6.286 -2.048 1.00 . A A . 50 LEU C 1 1 2 1445 1 1 48 LEU CA C 5.729 5.471 -2.525 1.00 . A A . 50 LEU CA 1 1 2 1446 1 1 48 LEU CB C 5.949 5.017 -3.973 1.00 . A A . 50 LEU CB 1 1 2 1447 1 1 48 LEU CD1 C 7.383 3.011 -3.545 1.00 . A A . 50 LEU CD1 1 1 2 1448 1 1 48 LEU CD2 C 7.699 4.356 -5.626 1.00 . A A . 50 LEU CD2 1 1 2 1449 1 1 48 LEU CG C 7.351 4.421 -4.137 1.00 . A A . 50 LEU CG 1 1 2 1450 1 1 48 LEU H H 4.398 7.062 -3.089 1.00 . A A . 50 LEU H 1 1 2 1451 1 1 48 LEU HA H 5.601 4.606 -1.890 1.00 . A A . 50 LEU HA 1 1 2 1452 1 1 48 LEU HB2 H 5.211 4.271 -4.230 1.00 . A A . 50 LEU HB2 1 1 2 1453 1 1 48 LEU HB3 H 5.844 5.866 -4.633 1.00 . A A . 50 LEU HB3 1 1 2 1454 1 1 48 LEU HD11 H 8.277 2.890 -2.952 1.00 . A A . 50 LEU HD11 1 1 2 1455 1 1 48 LEU HD12 H 7.381 2.285 -4.345 1.00 . A A . 50 LEU HD12 1 1 2 1456 1 1 48 LEU HD13 H 6.515 2.862 -2.922 1.00 . A A . 50 LEU HD13 1 1 2 1457 1 1 48 LEU HD21 H 7.821 5.358 -6.010 1.00 . A A . 50 LEU HD21 1 1 2 1458 1 1 48 LEU HD22 H 6.903 3.859 -6.161 1.00 . A A . 50 LEU HD22 1 1 2 1459 1 1 48 LEU HD23 H 8.619 3.805 -5.757 1.00 . A A . 50 LEU HD23 1 1 2 1460 1 1 48 LEU HG H 8.072 5.043 -3.627 1.00 . A A . 50 LEU HG 1 1 2 1461 1 1 48 LEU N N 4.500 6.318 -2.470 1.00 . A A . 50 LEU N 1 1 2 1462 1 1 48 LEU O O 6.955 7.496 -2.154 1.00 . A A . 50 LEU O 1 1 2 1463 1 1 49 SER C C 10.398 5.531 -1.161 1.00 . A A . 51 SER C 1 1 2 1464 1 1 49 SER CA C 9.133 6.390 -1.044 1.00 . A A . 51 SER CA 1 1 2 1465 1 1 49 SER CB C 8.929 6.790 0.415 1.00 . A A . 51 SER CB 1 1 2 1466 1 1 49 SER H H 7.906 4.660 -1.443 1.00 . A A . 51 SER H 1 1 2 1467 1 1 49 SER HA H 9.251 7.281 -1.642 1.00 . A A . 51 SER HA 1 1 2 1468 1 1 49 SER HB2 H 8.576 7.806 0.465 1.00 . A A . 51 SER HB2 1 1 2 1469 1 1 49 SER HB3 H 8.199 6.133 0.867 1.00 . A A . 51 SER HB3 1 1 2 1470 1 1 49 SER HG H 10.179 7.370 1.790 1.00 . A A . 51 SER HG 1 1 2 1471 1 1 49 SER N N 7.938 5.636 -1.523 1.00 . A A . 51 SER N 1 1 2 1472 1 1 49 SER O O 11.475 6.039 -1.402 1.00 . A A . 51 SER O 1 1 2 1473 1 1 49 SER OG O 10.167 6.693 1.109 1.00 . A A . 51 SER OG 1 1 2 1474 1 1 50 HIS C C 11.078 1.913 -1.231 1.00 . A A . 52 HIS C 1 1 2 1475 1 1 50 HIS CA C 11.498 3.379 -1.067 1.00 . A A . 52 HIS CA 1 1 2 1476 1 1 50 HIS CB C 12.329 3.553 0.217 1.00 . A A . 52 HIS CB 1 1 2 1477 1 1 50 HIS CD2 C 14.479 2.039 0.086 1.00 . A A . 52 HIS CD2 1 1 2 1478 1 1 50 HIS CE1 C 13.728 0.336 1.194 1.00 . A A . 52 HIS CE1 1 1 2 1479 1 1 50 HIS CG C 13.192 2.341 0.455 1.00 . A A . 52 HIS CG 1 1 2 1480 1 1 50 HIS H H 9.419 3.843 -0.777 1.00 . A A . 52 HIS H 1 1 2 1481 1 1 50 HIS HA H 12.090 3.679 -1.919 1.00 . A A . 52 HIS HA 1 1 2 1482 1 1 50 HIS HB2 H 12.958 4.425 0.119 1.00 . A A . 52 HIS HB2 1 1 2 1483 1 1 50 HIS HB3 H 11.663 3.689 1.056 1.00 . A A . 52 HIS HB3 1 1 2 1484 1 1 50 HIS HD1 H 11.848 1.141 1.568 1.00 . A A . 52 HIS HD1 1 1 2 1485 1 1 50 HIS HD2 H 15.132 2.686 -0.483 1.00 . A A . 52 HIS HD2 1 1 2 1486 1 1 50 HIS HE1 H 13.654 -0.627 1.676 1.00 . A A . 52 HIS HE1 1 1 2 1487 1 1 50 HIS N N 10.288 4.242 -0.979 1.00 . A A . 52 HIS N 1 1 2 1488 1 1 50 HIS ND1 N 12.735 1.240 1.162 1.00 . A A . 52 HIS ND1 1 1 2 1489 1 1 50 HIS NE2 N 14.817 0.771 0.553 1.00 . A A . 52 HIS NE2 1 1 2 1490 1 1 50 HIS O O 10.776 1.230 -0.273 1.00 . A A . 52 HIS O 1 1 2 1491 1 1 51 PHE C C 11.513 -0.901 -1.767 1.00 . A A . 53 PHE C 1 1 2 1492 1 1 51 PHE CA C 10.682 0.008 -2.677 1.00 . A A . 53 PHE CA 1 1 2 1493 1 1 51 PHE CB C 10.964 -0.356 -4.138 1.00 . A A . 53 PHE CB 1 1 2 1494 1 1 51 PHE CD1 C 8.544 0.239 -4.516 1.00 . A A . 53 PHE CD1 1 1 2 1495 1 1 51 PHE CD2 C 9.582 -1.410 -5.959 1.00 . A A . 53 PHE CD2 1 1 2 1496 1 1 51 PHE CE1 C 7.340 0.094 -5.215 1.00 . A A . 53 PHE CE1 1 1 2 1497 1 1 51 PHE CE2 C 8.377 -1.557 -6.658 1.00 . A A . 53 PHE CE2 1 1 2 1498 1 1 51 PHE CG C 9.665 -0.513 -4.888 1.00 . A A . 53 PHE CG 1 1 2 1499 1 1 51 PHE CZ C 7.257 -0.805 -6.286 1.00 . A A . 53 PHE CZ 1 1 2 1500 1 1 51 PHE H H 11.319 2.000 -3.193 1.00 . A A . 53 PHE H 1 1 2 1501 1 1 51 PHE HA H 9.632 -0.126 -2.466 1.00 . A A . 53 PHE HA 1 1 2 1502 1 1 51 PHE HB2 H 11.550 0.428 -4.595 1.00 . A A . 53 PHE HB2 1 1 2 1503 1 1 51 PHE HB3 H 11.515 -1.283 -4.176 1.00 . A A . 53 PHE HB3 1 1 2 1504 1 1 51 PHE HD1 H 8.608 0.930 -3.688 1.00 . A A . 53 PHE HD1 1 1 2 1505 1 1 51 PHE HD2 H 10.447 -1.990 -6.245 1.00 . A A . 53 PHE HD2 1 1 2 1506 1 1 51 PHE HE1 H 6.474 0.673 -4.928 1.00 . A A . 53 PHE HE1 1 1 2 1507 1 1 51 PHE HE2 H 8.314 -2.249 -7.484 1.00 . A A . 53 PHE HE2 1 1 2 1508 1 1 51 PHE HZ H 6.328 -0.919 -6.825 1.00 . A A . 53 PHE HZ 1 1 2 1509 1 1 51 PHE N N 11.067 1.430 -2.440 1.00 . A A . 53 PHE N 1 1 2 1510 1 1 51 PHE O O 12.728 -0.845 -1.764 1.00 . A A . 53 PHE O 1 1 2 1511 1 1 52 GLY C C 11.306 -2.349 1.361 1.00 . A A . 54 GLY C 1 1 2 1512 1 1 52 GLY CA C 11.642 -2.654 -0.101 1.00 . A A . 54 GLY CA 1 1 2 1513 1 1 52 GLY H H 9.896 -1.782 -1.017 1.00 . A A . 54 GLY H 1 1 2 1514 1 1 52 GLY HA2 H 11.384 -3.680 -0.325 1.00 . A A . 54 GLY HA2 1 1 2 1515 1 1 52 GLY HA3 H 12.700 -2.508 -0.260 1.00 . A A . 54 GLY HA3 1 1 2 1516 1 1 52 GLY N N 10.876 -1.744 -1.000 1.00 . A A . 54 GLY N 1 1 2 1517 1 1 52 GLY O O 10.494 -1.495 1.657 1.00 . A A . 54 GLY O 1 1 2 1518 1 1 53 LYS C C 12.235 -1.447 4.132 1.00 . A A . 55 LYS C 1 1 2 1519 1 1 53 LYS CA C 11.649 -2.800 3.721 1.00 . A A . 55 LYS CA 1 1 2 1520 1 1 53 LYS CB C 12.293 -3.911 4.555 1.00 . A A . 55 LYS CB 1 1 2 1521 1 1 53 LYS CD C 11.908 -5.447 6.487 1.00 . A A . 55 LYS CD 1 1 2 1522 1 1 53 LYS CE C 13.345 -5.321 6.995 1.00 . A A . 55 LYS CE 1 1 2 1523 1 1 53 LYS CG C 11.482 -4.129 5.836 1.00 . A A . 55 LYS CG 1 1 2 1524 1 1 53 LYS H H 12.577 -3.728 2.013 1.00 . A A . 55 LYS H 1 1 2 1525 1 1 53 LYS HA H 10.581 -2.796 3.888 1.00 . A A . 55 LYS HA 1 1 2 1526 1 1 53 LYS HB2 H 12.313 -4.826 3.981 1.00 . A A . 55 LYS HB2 1 1 2 1527 1 1 53 LYS HB3 H 13.302 -3.626 4.815 1.00 . A A . 55 LYS HB3 1 1 2 1528 1 1 53 LYS HD2 H 11.251 -5.667 7.317 1.00 . A A . 55 LYS HD2 1 1 2 1529 1 1 53 LYS HD3 H 11.853 -6.243 5.760 1.00 . A A . 55 LYS HD3 1 1 2 1530 1 1 53 LYS HE2 H 13.858 -4.549 6.440 1.00 . A A . 55 LYS HE2 1 1 2 1531 1 1 53 LYS HE3 H 13.336 -5.065 8.045 1.00 . A A . 55 LYS HE3 1 1 2 1532 1 1 53 LYS HG2 H 11.662 -3.312 6.520 1.00 . A A . 55 LYS HG2 1 1 2 1533 1 1 53 LYS HG3 H 10.431 -4.173 5.594 1.00 . A A . 55 LYS HG3 1 1 2 1534 1 1 53 LYS HZ1 H 15.080 -6.453 6.778 1.00 . A A . 55 LYS HZ1 1 1 2 1535 1 1 53 LYS HZ2 H 13.747 -7.056 5.914 1.00 . A A . 55 LYS HZ2 1 1 2 1536 1 1 53 LYS HZ3 H 13.831 -7.254 7.599 1.00 . A A . 55 LYS HZ3 1 1 2 1537 1 1 53 LYS N N 11.927 -3.045 2.277 1.00 . A A . 55 LYS N 1 1 2 1538 1 1 53 LYS NZ N 14.054 -6.619 6.807 1.00 . A A . 55 LYS NZ 1 1 2 1539 1 1 53 LYS O O 13.310 -1.072 3.708 1.00 . A A . 55 LYS O 1 1 2 1540 1 1 54 CYS C C 13.060 0.424 6.527 1.00 . A A . 56 CYS C 1 1 2 1541 1 1 54 CYS CA C 12.057 0.616 5.389 1.00 . A A . 56 CYS CA 1 1 2 1542 1 1 54 CYS CB C 10.896 1.486 5.875 1.00 . A A . 56 CYS CB 1 1 2 1543 1 1 54 CYS H H 10.672 -1.032 5.284 1.00 . A A . 56 CYS H 1 1 2 1544 1 1 54 CYS HA H 12.547 1.100 4.556 1.00 . A A . 56 CYS HA 1 1 2 1545 1 1 54 CYS HB2 H 10.644 1.218 6.890 1.00 . A A . 56 CYS HB2 1 1 2 1546 1 1 54 CYS HB3 H 11.185 2.526 5.838 1.00 . A A . 56 CYS HB3 1 1 2 1547 1 1 54 CYS N N 11.537 -0.712 4.954 1.00 . A A . 56 CYS N 1 1 2 1548 1 1 54 CYS O O 13.933 1.264 6.670 1.00 . A A . 56 CYS O 1 1 2 1549 1 1 54 CYS OXT O 12.940 -0.562 7.236 1.00 . A A . 56 CYS OXT 1 1 2 1550 1 1 54 CYS SG S 9.457 1.224 4.809 1.00 . A A . 56 CYS SG 1 1 3 1551 1 1 1 ALA C C 3.988 8.808 -8.928 1.00 . A A . 3 ALA C 1 1 3 1552 1 1 1 ALA CA C 2.845 9.824 -8.863 1.00 . A A . 3 ALA CA 1 1 3 1553 1 1 1 ALA CB C 2.227 9.811 -7.463 1.00 . A A . 3 ALA CB 1 1 3 1554 1 1 1 ALA H1 H 2.235 9.428 -10.814 1.00 . A A . 3 ALA H1 1 1 3 1555 1 1 1 ALA H2 H 1.051 10.184 -9.858 1.00 . A A . 3 ALA H2 1 1 3 1556 1 1 1 ALA H3 H 1.403 8.536 -9.636 1.00 . A A . 3 ALA H3 1 1 3 1557 1 1 1 ALA HA H 3.227 10.811 -9.078 1.00 . A A . 3 ALA HA 1 1 3 1558 1 1 1 ALA HB1 H 1.204 9.469 -7.524 1.00 . A A . 3 ALA HB1 1 1 3 1559 1 1 1 ALA HB2 H 2.249 10.809 -7.050 1.00 . A A . 3 ALA HB2 1 1 3 1560 1 1 1 ALA HB3 H 2.791 9.145 -6.827 1.00 . A A . 3 ALA HB3 1 1 3 1561 1 1 1 ALA N N 1.805 9.466 -9.869 1.00 . A A . 3 ALA N 1 1 3 1562 1 1 1 ALA O O 5.130 9.160 -9.146 1.00 . A A . 3 ALA O 1 1 3 1563 1 1 2 VAL C C 4.256 5.292 -9.552 1.00 . A A . 4 VAL C 1 1 3 1564 1 1 2 VAL CA C 4.763 6.518 -8.791 1.00 . A A . 4 VAL CA 1 1 3 1565 1 1 2 VAL CB C 5.147 6.112 -7.367 1.00 . A A . 4 VAL CB 1 1 3 1566 1 1 2 VAL CG1 C 5.761 7.309 -6.640 1.00 . A A . 4 VAL CG1 1 1 3 1567 1 1 2 VAL CG2 C 3.897 5.648 -6.616 1.00 . A A . 4 VAL CG2 1 1 3 1568 1 1 2 VAL H H 2.764 7.287 -8.565 1.00 . A A . 4 VAL H 1 1 3 1569 1 1 2 VAL HA H 5.629 6.922 -9.295 1.00 . A A . 4 VAL HA 1 1 3 1570 1 1 2 VAL HB H 5.867 5.307 -7.404 1.00 . A A . 4 VAL HB 1 1 3 1571 1 1 2 VAL HG11 H 5.896 7.067 -5.597 1.00 . A A . 4 VAL HG11 1 1 3 1572 1 1 2 VAL HG12 H 5.101 8.160 -6.729 1.00 . A A . 4 VAL HG12 1 1 3 1573 1 1 2 VAL HG13 H 6.716 7.548 -7.081 1.00 . A A . 4 VAL HG13 1 1 3 1574 1 1 2 VAL HG21 H 3.225 5.156 -7.303 1.00 . A A . 4 VAL HG21 1 1 3 1575 1 1 2 VAL HG22 H 3.403 6.503 -6.178 1.00 . A A . 4 VAL HG22 1 1 3 1576 1 1 2 VAL HG23 H 4.182 4.958 -5.834 1.00 . A A . 4 VAL HG23 1 1 3 1577 1 1 2 VAL N N 3.691 7.552 -8.740 1.00 . A A . 4 VAL N 1 1 3 1578 1 1 2 VAL O O 4.593 4.169 -9.235 1.00 . A A . 4 VAL O 1 1 3 1579 1 1 3 SER C C 1.916 3.570 -10.477 1.00 . A A . 5 SER C 1 1 3 1580 1 1 3 SER CA C 2.922 4.342 -11.332 1.00 . A A . 5 SER CA 1 1 3 1581 1 1 3 SER CB C 4.078 3.417 -11.719 1.00 . A A . 5 SER CB 1 1 3 1582 1 1 3 SER H H 3.186 6.411 -10.794 1.00 . A A . 5 SER H 1 1 3 1583 1 1 3 SER HA H 2.433 4.701 -12.226 1.00 . A A . 5 SER HA 1 1 3 1584 1 1 3 SER HB2 H 5.008 3.957 -11.662 1.00 . A A . 5 SER HB2 1 1 3 1585 1 1 3 SER HB3 H 4.110 2.577 -11.036 1.00 . A A . 5 SER HB3 1 1 3 1586 1 1 3 SER HG H 4.527 3.400 -13.613 1.00 . A A . 5 SER HG 1 1 3 1587 1 1 3 SER N N 3.448 5.497 -10.555 1.00 . A A . 5 SER N 1 1 3 1588 1 1 3 SER O O 2.229 2.543 -9.909 1.00 . A A . 5 SER O 1 1 3 1589 1 1 3 SER OG O 3.887 2.956 -13.049 1.00 . A A . 5 SER OG 1 1 3 1590 1 1 4 VAL C C -1.706 3.606 -10.139 1.00 . A A . 6 VAL C 1 1 3 1591 1 1 4 VAL CA C -0.313 3.350 -9.558 1.00 . A A . 6 VAL CA 1 1 3 1592 1 1 4 VAL CB C -0.257 3.868 -8.120 1.00 . A A . 6 VAL CB 1 1 3 1593 1 1 4 VAL CG1 C -0.260 5.398 -8.128 1.00 . A A . 6 VAL CG1 1 1 3 1594 1 1 4 VAL CG2 C -1.477 3.362 -7.346 1.00 . A A . 6 VAL CG2 1 1 3 1595 1 1 4 VAL H H 0.477 4.889 -10.842 1.00 . A A . 6 VAL H 1 1 3 1596 1 1 4 VAL HA H -0.110 2.289 -9.567 1.00 . A A . 6 VAL HA 1 1 3 1597 1 1 4 VAL HB H 0.646 3.513 -7.645 1.00 . A A . 6 VAL HB 1 1 3 1598 1 1 4 VAL HG11 H 0.359 5.762 -7.322 1.00 . A A . 6 VAL HG11 1 1 3 1599 1 1 4 VAL HG12 H -1.271 5.756 -7.996 1.00 . A A . 6 VAL HG12 1 1 3 1600 1 1 4 VAL HG13 H 0.127 5.755 -9.070 1.00 . A A . 6 VAL HG13 1 1 3 1601 1 1 4 VAL HG21 H -2.028 2.663 -7.959 1.00 . A A . 6 VAL HG21 1 1 3 1602 1 1 4 VAL HG22 H -2.113 4.195 -7.090 1.00 . A A . 6 VAL HG22 1 1 3 1603 1 1 4 VAL HG23 H -1.150 2.867 -6.443 1.00 . A A . 6 VAL HG23 1 1 3 1604 1 1 4 VAL N N 0.709 4.057 -10.378 1.00 . A A . 6 VAL N 1 1 3 1605 1 1 4 VAL O O -2.275 4.665 -9.963 1.00 . A A . 6 VAL O 1 1 3 1606 1 1 5 ASP C C -4.629 2.017 -10.597 1.00 . A A . 7 ASP C 1 1 3 1607 1 1 5 ASP CA C -3.618 2.830 -11.408 1.00 . A A . 7 ASP CA 1 1 3 1608 1 1 5 ASP CB C -3.622 2.346 -12.858 1.00 . A A . 7 ASP CB 1 1 3 1609 1 1 5 ASP CG C -2.702 3.234 -13.697 1.00 . A A . 7 ASP CG 1 1 3 1610 1 1 5 ASP H H -1.785 1.794 -10.949 1.00 . A A . 7 ASP H 1 1 3 1611 1 1 5 ASP HA H -3.886 3.875 -11.374 1.00 . A A . 7 ASP HA 1 1 3 1612 1 1 5 ASP HB2 H -3.272 1.323 -12.897 1.00 . A A . 7 ASP HB2 1 1 3 1613 1 1 5 ASP HB3 H -4.625 2.397 -13.251 1.00 . A A . 7 ASP HB3 1 1 3 1614 1 1 5 ASP N N -2.261 2.643 -10.823 1.00 . A A . 7 ASP N 1 1 3 1615 1 1 5 ASP O O -4.987 0.914 -10.959 1.00 . A A . 7 ASP O 1 1 3 1616 1 1 5 ASP OD1 O -1.644 3.589 -13.204 1.00 . A A . 7 ASP OD1 1 1 3 1617 1 1 5 ASP OD2 O -3.071 3.543 -14.817 1.00 . A A . 7 ASP OD2 1 1 3 1618 1 1 6 CYS C C -7.096 2.785 -8.084 1.00 . A A . 8 CYS C 1 1 3 1619 1 1 6 CYS CA C -6.068 1.808 -8.659 1.00 . A A . 8 CYS CA 1 1 3 1620 1 1 6 CYS CB C -5.330 1.111 -7.515 1.00 . A A . 8 CYS CB 1 1 3 1621 1 1 6 CYS H H -4.780 3.442 -9.223 1.00 . A A . 8 CYS H 1 1 3 1622 1 1 6 CYS HA H -6.572 1.066 -9.264 1.00 . A A . 8 CYS HA 1 1 3 1623 1 1 6 CYS HB2 H -5.006 1.847 -6.793 1.00 . A A . 8 CYS HB2 1 1 3 1624 1 1 6 CYS HB3 H -5.991 0.405 -7.038 1.00 . A A . 8 CYS HB3 1 1 3 1625 1 1 6 CYS N N -5.086 2.552 -9.498 1.00 . A A . 8 CYS N 1 1 3 1626 1 1 6 CYS O O -7.398 2.762 -6.906 1.00 . A A . 8 CYS O 1 1 3 1627 1 1 6 CYS SG S -3.889 0.240 -8.176 1.00 . A A . 8 CYS SG 1 1 3 1628 1 1 7 SER C C -10.033 3.925 -8.273 1.00 . A A . 9 SER C 1 1 3 1629 1 1 7 SER CA C -8.670 4.611 -8.409 1.00 . A A . 9 SER CA 1 1 3 1630 1 1 7 SER CB C -8.781 5.781 -9.386 1.00 . A A . 9 SER CB 1 1 3 1631 1 1 7 SER H H -7.403 3.632 -9.857 1.00 . A A . 9 SER H 1 1 3 1632 1 1 7 SER HA H -8.362 4.978 -7.443 1.00 . A A . 9 SER HA 1 1 3 1633 1 1 7 SER HB2 H -9.608 5.616 -10.056 1.00 . A A . 9 SER HB2 1 1 3 1634 1 1 7 SER HB3 H -8.945 6.697 -8.832 1.00 . A A . 9 SER HB3 1 1 3 1635 1 1 7 SER HG H -7.764 5.579 -11.034 1.00 . A A . 9 SER HG 1 1 3 1636 1 1 7 SER N N -7.652 3.637 -8.909 1.00 . A A . 9 SER N 1 1 3 1637 1 1 7 SER O O -11.062 4.567 -8.209 1.00 . A A . 9 SER O 1 1 3 1638 1 1 7 SER OG O -7.580 5.880 -10.141 1.00 . A A . 9 SER OG 1 1 3 1639 1 1 8 GLU C C -10.960 0.470 -7.581 1.00 . A A . 10 GLU C 1 1 3 1640 1 1 8 GLU CA C -11.308 1.872 -8.072 1.00 . A A . 10 GLU CA 1 1 3 1641 1 1 8 GLU CB C -12.016 1.786 -9.426 1.00 . A A . 10 GLU CB 1 1 3 1642 1 1 8 GLU CD C -10.910 2.219 -11.625 1.00 . A A . 10 GLU CD 1 1 3 1643 1 1 8 GLU CG C -11.052 1.224 -10.473 1.00 . A A . 10 GLU CG 1 1 3 1644 1 1 8 GLU H H -9.200 2.138 -8.263 1.00 . A A . 10 GLU H 1 1 3 1645 1 1 8 GLU HA H -11.947 2.365 -7.353 1.00 . A A . 10 GLU HA 1 1 3 1646 1 1 8 GLU HB2 H -12.876 1.137 -9.341 1.00 . A A . 10 GLU HB2 1 1 3 1647 1 1 8 GLU HB3 H -12.336 2.772 -9.727 1.00 . A A . 10 GLU HB3 1 1 3 1648 1 1 8 GLU HG2 H -10.086 1.056 -10.019 1.00 . A A . 10 GLU HG2 1 1 3 1649 1 1 8 GLU HG3 H -11.437 0.289 -10.853 1.00 . A A . 10 GLU HG3 1 1 3 1650 1 1 8 GLU N N -10.039 2.626 -8.217 1.00 . A A . 10 GLU N 1 1 3 1651 1 1 8 GLU O O -11.608 -0.500 -7.918 1.00 . A A . 10 GLU O 1 1 3 1652 1 1 8 GLU OE1 O -11.905 2.486 -12.278 1.00 . A A . 10 GLU OE1 1 1 3 1653 1 1 8 GLU OE2 O -9.808 2.699 -11.834 1.00 . A A . 10 GLU OE2 1 1 3 1654 1 1 9 TYR C C -9.506 -0.998 -4.752 1.00 . A A . 11 TYR C 1 1 3 1655 1 1 9 TYR CA C -9.498 -0.976 -6.287 1.00 . A A . 11 TYR CA 1 1 3 1656 1 1 9 TYR CB C -8.078 -1.262 -6.780 1.00 . A A . 11 TYR CB 1 1 3 1657 1 1 9 TYR CD1 C -8.081 -3.718 -6.218 1.00 . A A . 11 TYR CD1 1 1 3 1658 1 1 9 TYR CD2 C -7.707 -3.045 -8.516 1.00 . A A . 11 TYR CD2 1 1 3 1659 1 1 9 TYR CE1 C -7.961 -5.060 -6.591 1.00 . A A . 11 TYR CE1 1 1 3 1660 1 1 9 TYR CE2 C -7.587 -4.387 -8.892 1.00 . A A . 11 TYR CE2 1 1 3 1661 1 1 9 TYR CG C -7.954 -2.710 -7.180 1.00 . A A . 11 TYR CG 1 1 3 1662 1 1 9 TYR CZ C -7.713 -5.396 -7.929 1.00 . A A . 11 TYR CZ 1 1 3 1663 1 1 9 TYR H H -9.402 1.162 -6.550 1.00 . A A . 11 TYR H 1 1 3 1664 1 1 9 TYR HA H -10.168 -1.733 -6.664 1.00 . A A . 11 TYR HA 1 1 3 1665 1 1 9 TYR HB2 H -7.861 -0.635 -7.632 1.00 . A A . 11 TYR HB2 1 1 3 1666 1 1 9 TYR HB3 H -7.375 -1.048 -5.989 1.00 . A A . 11 TYR HB3 1 1 3 1667 1 1 9 TYR HD1 H -8.270 -3.459 -5.186 1.00 . A A . 11 TYR HD1 1 1 3 1668 1 1 9 TYR HD2 H -7.609 -2.267 -9.259 1.00 . A A . 11 TYR HD2 1 1 3 1669 1 1 9 TYR HE1 H -8.058 -5.837 -5.849 1.00 . A A . 11 TYR HE1 1 1 3 1670 1 1 9 TYR HE2 H -7.395 -4.643 -9.922 1.00 . A A . 11 TYR HE2 1 1 3 1671 1 1 9 TYR HH H -7.761 -6.783 -9.241 1.00 . A A . 11 TYR HH 1 1 3 1672 1 1 9 TYR N N -9.918 0.361 -6.794 1.00 . A A . 11 TYR N 1 1 3 1673 1 1 9 TYR O O -8.464 -1.087 -4.136 1.00 . A A . 11 TYR O 1 1 3 1674 1 1 9 TYR OH O -7.594 -6.721 -8.298 1.00 . A A . 11 TYR OH 1 1 3 1675 1 1 10 PRO C C -10.718 -2.403 -2.207 1.00 . A A . 12 PRO C 1 1 3 1676 1 1 10 PRO CA C -10.847 -0.962 -2.714 1.00 . A A . 12 PRO CA 1 1 3 1677 1 1 10 PRO CB C -12.270 -0.442 -2.503 1.00 . A A . 12 PRO CB 1 1 3 1678 1 1 10 PRO CD C -11.948 -0.819 -4.928 1.00 . A A . 12 PRO CD 1 1 3 1679 1 1 10 PRO CG C -13.022 -0.689 -3.832 1.00 . A A . 12 PRO CG 1 1 3 1680 1 1 10 PRO HA H -10.135 -0.315 -2.230 1.00 . A A . 12 PRO HA 1 1 3 1681 1 1 10 PRO HB2 H -12.746 -0.982 -1.695 1.00 . A A . 12 PRO HB2 1 1 3 1682 1 1 10 PRO HB3 H -12.251 0.616 -2.286 1.00 . A A . 12 PRO HB3 1 1 3 1683 1 1 10 PRO HD2 H -12.121 -1.703 -5.526 1.00 . A A . 12 PRO HD2 1 1 3 1684 1 1 10 PRO HD3 H -11.936 0.062 -5.545 1.00 . A A . 12 PRO HD3 1 1 3 1685 1 1 10 PRO HG2 H -13.601 -1.600 -3.765 1.00 . A A . 12 PRO HG2 1 1 3 1686 1 1 10 PRO HG3 H -13.669 0.146 -4.053 1.00 . A A . 12 PRO HG3 1 1 3 1687 1 1 10 PRO N N -10.681 -0.933 -4.179 1.00 . A A . 12 PRO N 1 1 3 1688 1 1 10 PRO O O -11.632 -3.194 -2.328 1.00 . A A . 12 PRO O 1 1 3 1689 1 1 11 LYS C C -8.173 -4.235 -0.272 1.00 . A A . 13 LYS C 1 1 3 1690 1 1 11 LYS CA C -9.423 -4.146 -1.149 1.00 . A A . 13 LYS CA 1 1 3 1691 1 1 11 LYS CB C -9.281 -5.096 -2.339 1.00 . A A . 13 LYS CB 1 1 3 1692 1 1 11 LYS CD C -10.796 -6.287 -3.925 1.00 . A A . 13 LYS CD 1 1 3 1693 1 1 11 LYS CE C -10.574 -7.783 -4.159 1.00 . A A . 13 LYS CE 1 1 3 1694 1 1 11 LYS CG C -10.539 -5.955 -2.455 1.00 . A A . 13 LYS CG 1 1 3 1695 1 1 11 LYS H H -8.863 -2.106 -1.560 1.00 . A A . 13 LYS H 1 1 3 1696 1 1 11 LYS HA H -10.289 -4.427 -0.568 1.00 . A A . 13 LYS HA 1 1 3 1697 1 1 11 LYS HB2 H -9.151 -4.519 -3.245 1.00 . A A . 13 LYS HB2 1 1 3 1698 1 1 11 LYS HB3 H -8.423 -5.733 -2.192 1.00 . A A . 13 LYS HB3 1 1 3 1699 1 1 11 LYS HD2 H -11.816 -6.030 -4.178 1.00 . A A . 13 LYS HD2 1 1 3 1700 1 1 11 LYS HD3 H -10.117 -5.723 -4.546 1.00 . A A . 13 LYS HD3 1 1 3 1701 1 1 11 LYS HE2 H -10.304 -8.256 -3.226 1.00 . A A . 13 LYS HE2 1 1 3 1702 1 1 11 LYS HE3 H -11.482 -8.228 -4.539 1.00 . A A . 13 LYS HE3 1 1 3 1703 1 1 11 LYS HG2 H -10.403 -6.870 -1.897 1.00 . A A . 13 LYS HG2 1 1 3 1704 1 1 11 LYS HG3 H -11.383 -5.411 -2.057 1.00 . A A . 13 LYS HG3 1 1 3 1705 1 1 11 LYS HZ1 H -9.691 -7.438 -6.012 1.00 . A A . 13 LYS HZ1 1 1 3 1706 1 1 11 LYS HZ2 H -9.385 -8.983 -5.375 1.00 . A A . 13 LYS HZ2 1 1 3 1707 1 1 11 LYS HZ3 H -8.583 -7.626 -4.742 1.00 . A A . 13 LYS HZ3 1 1 3 1708 1 1 11 LYS N N -9.592 -2.753 -1.647 1.00 . A A . 13 LYS N 1 1 3 1709 1 1 11 LYS NZ N -9.476 -7.972 -5.147 1.00 . A A . 13 LYS NZ 1 1 3 1710 1 1 11 LYS O O -7.071 -4.404 -0.758 1.00 . A A . 13 LYS O 1 1 3 1711 1 1 12 CYS C C -7.061 -5.632 2.493 1.00 . A A . 14 CYS C 1 1 3 1712 1 1 12 CYS CA C -7.157 -4.215 1.924 1.00 . A A . 14 CYS CA 1 1 3 1713 1 1 12 CYS CB C -7.316 -3.212 3.069 1.00 . A A . 14 CYS CB 1 1 3 1714 1 1 12 CYS H H -9.230 -3.997 1.389 1.00 . A A . 14 CYS H 1 1 3 1715 1 1 12 CYS HA H -6.259 -3.992 1.368 1.00 . A A . 14 CYS HA 1 1 3 1716 1 1 12 CYS HB2 H -8.346 -3.193 3.389 1.00 . A A . 14 CYS HB2 1 1 3 1717 1 1 12 CYS HB3 H -6.686 -3.507 3.895 1.00 . A A . 14 CYS HB3 1 1 3 1718 1 1 12 CYS N N -8.334 -4.130 1.017 1.00 . A A . 14 CYS N 1 1 3 1719 1 1 12 CYS O O -6.462 -5.860 3.524 1.00 . A A . 14 CYS O 1 1 3 1720 1 1 12 CYS SG S -6.829 -1.564 2.499 1.00 . A A . 14 CYS SG 1 1 3 1721 1 1 13 ALA C C -6.868 -8.850 1.285 1.00 . A A . 15 ALA C 1 1 3 1722 1 1 13 ALA CA C -7.597 -7.986 2.313 1.00 . A A . 15 ALA CA 1 1 3 1723 1 1 13 ALA CB C -9.019 -8.515 2.507 1.00 . A A . 15 ALA CB 1 1 3 1724 1 1 13 ALA H H -8.122 -6.371 0.992 1.00 . A A . 15 ALA H 1 1 3 1725 1 1 13 ALA HA H -7.067 -8.020 3.255 1.00 . A A . 15 ALA HA 1 1 3 1726 1 1 13 ALA HB1 H -9.052 -9.562 2.245 1.00 . A A . 15 ALA HB1 1 1 3 1727 1 1 13 ALA HB2 H -9.699 -7.964 1.874 1.00 . A A . 15 ALA HB2 1 1 3 1728 1 1 13 ALA HB3 H -9.311 -8.393 3.540 1.00 . A A . 15 ALA HB3 1 1 3 1729 1 1 13 ALA N N -7.649 -6.583 1.823 1.00 . A A . 15 ALA N 1 1 3 1730 1 1 13 ALA O O -7.437 -9.755 0.706 1.00 . A A . 15 ALA O 1 1 3 1731 1 1 14 CYS C C -3.780 -10.195 0.760 1.00 . A A . 16 CYS C 1 1 3 1732 1 1 14 CYS CA C -4.853 -9.373 0.049 1.00 . A A . 16 CYS CA 1 1 3 1733 1 1 14 CYS CB C -4.187 -8.434 -0.957 1.00 . A A . 16 CYS CB 1 1 3 1734 1 1 14 CYS H H -5.176 -7.836 1.519 1.00 . A A . 16 CYS H 1 1 3 1735 1 1 14 CYS HA H -5.529 -10.036 -0.472 1.00 . A A . 16 CYS HA 1 1 3 1736 1 1 14 CYS HB2 H -3.266 -8.056 -0.539 1.00 . A A . 16 CYS HB2 1 1 3 1737 1 1 14 CYS HB3 H -3.975 -8.978 -1.866 1.00 . A A . 16 CYS HB3 1 1 3 1738 1 1 14 CYS N N -5.615 -8.574 1.046 1.00 . A A . 16 CYS N 1 1 3 1739 1 1 14 CYS O O -3.310 -9.840 1.822 1.00 . A A . 16 CYS O 1 1 3 1740 1 1 14 CYS SG S -5.296 -7.051 -1.322 1.00 . A A . 16 CYS SG 1 1 3 1741 1 1 15 THR C C -1.733 -13.064 -0.247 1.00 . A A . 17 THR C 1 1 3 1742 1 1 15 THR CA C -2.345 -12.144 0.811 1.00 . A A . 17 THR CA 1 1 3 1743 1 1 15 THR CB C -2.974 -12.988 1.924 1.00 . A A . 17 THR CB 1 1 3 1744 1 1 15 THR CG2 C -3.910 -14.030 1.313 1.00 . A A . 17 THR CG2 1 1 3 1745 1 1 15 THR H H -3.782 -11.556 -0.681 1.00 . A A . 17 THR H 1 1 3 1746 1 1 15 THR HA H -1.573 -11.515 1.229 1.00 . A A . 17 THR HA 1 1 3 1747 1 1 15 THR HB H -3.537 -12.348 2.586 1.00 . A A . 17 THR HB 1 1 3 1748 1 1 15 THR HG1 H -1.163 -13.095 2.625 1.00 . A A . 17 THR HG1 1 1 3 1749 1 1 15 THR HG21 H -4.915 -13.866 1.672 1.00 . A A . 17 THR HG21 1 1 3 1750 1 1 15 THR HG22 H -3.583 -15.020 1.599 1.00 . A A . 17 THR HG22 1 1 3 1751 1 1 15 THR HG23 H -3.895 -13.943 0.236 1.00 . A A . 17 THR HG23 1 1 3 1752 1 1 15 THR N N -3.389 -11.293 0.177 1.00 . A A . 17 THR N 1 1 3 1753 1 1 15 THR O O -1.276 -14.150 0.048 1.00 . A A . 17 THR O 1 1 3 1754 1 1 15 THR OG1 O -1.949 -13.644 2.657 1.00 . A A . 17 THR OG1 1 1 3 1755 1 1 16 MET C C 0.344 -13.191 -2.704 1.00 . A A . 18 MET C 1 1 3 1756 1 1 16 MET CA C -1.148 -13.489 -2.559 1.00 . A A . 18 MET CA 1 1 3 1757 1 1 16 MET CB C -1.859 -13.185 -3.880 1.00 . A A . 18 MET CB 1 1 3 1758 1 1 16 MET CE C -3.514 -15.515 -6.712 1.00 . A A . 18 MET CE 1 1 3 1759 1 1 16 MET CG C -2.523 -14.458 -4.413 1.00 . A A . 18 MET CG 1 1 3 1760 1 1 16 MET H H -2.100 -11.759 -1.698 1.00 . A A . 18 MET H 1 1 3 1761 1 1 16 MET HA H -1.284 -14.527 -2.309 1.00 . A A . 18 MET HA 1 1 3 1762 1 1 16 MET HB2 H -2.612 -12.428 -3.717 1.00 . A A . 18 MET HB2 1 1 3 1763 1 1 16 MET HB3 H -1.141 -12.826 -4.602 1.00 . A A . 18 MET HB3 1 1 3 1764 1 1 16 MET HE1 H -4.221 -16.264 -6.385 1.00 . A A . 18 MET HE1 1 1 3 1765 1 1 16 MET HE2 H -2.511 -15.896 -6.599 1.00 . A A . 18 MET HE2 1 1 3 1766 1 1 16 MET HE3 H -3.690 -15.274 -7.752 1.00 . A A . 18 MET HE3 1 1 3 1767 1 1 16 MET HG2 H -1.768 -15.112 -4.825 1.00 . A A . 18 MET HG2 1 1 3 1768 1 1 16 MET HG3 H -3.035 -14.962 -3.608 1.00 . A A . 18 MET HG3 1 1 3 1769 1 1 16 MET N N -1.725 -12.638 -1.481 1.00 . A A . 18 MET N 1 1 3 1770 1 1 16 MET O O 1.184 -13.919 -2.216 1.00 . A A . 18 MET O 1 1 3 1771 1 1 16 MET SD S -3.713 -14.023 -5.707 1.00 . A A . 18 MET SD 1 1 3 1772 1 1 17 GLU C C 2.644 -11.064 -2.316 1.00 . A A . 19 GLU C 1 1 3 1773 1 1 17 GLU CA C 2.120 -11.785 -3.561 1.00 . A A . 19 GLU CA 1 1 3 1774 1 1 17 GLU CB C 2.273 -10.870 -4.780 1.00 . A A . 19 GLU CB 1 1 3 1775 1 1 17 GLU CD C 3.865 -9.446 -6.075 1.00 . A A . 19 GLU CD 1 1 3 1776 1 1 17 GLU CG C 3.678 -10.263 -4.796 1.00 . A A . 19 GLU CG 1 1 3 1777 1 1 17 GLU H H -0.014 -11.557 -3.765 1.00 . A A . 19 GLU H 1 1 3 1778 1 1 17 GLU HA H 2.690 -12.690 -3.719 1.00 . A A . 19 GLU HA 1 1 3 1779 1 1 17 GLU HB2 H 2.119 -11.444 -5.682 1.00 . A A . 19 GLU HB2 1 1 3 1780 1 1 17 GLU HB3 H 1.542 -10.076 -4.728 1.00 . A A . 19 GLU HB3 1 1 3 1781 1 1 17 GLU HG2 H 3.802 -9.620 -3.935 1.00 . A A . 19 GLU HG2 1 1 3 1782 1 1 17 GLU HG3 H 4.413 -11.054 -4.765 1.00 . A A . 19 GLU HG3 1 1 3 1783 1 1 17 GLU N N 0.680 -12.128 -3.377 1.00 . A A . 19 GLU N 1 1 3 1784 1 1 17 GLU O O 2.079 -10.085 -1.871 1.00 . A A . 19 GLU O 1 1 3 1785 1 1 17 GLU OE1 O 3.378 -8.328 -6.118 1.00 . A A . 19 GLU OE1 1 1 3 1786 1 1 17 GLU OE2 O 4.491 -9.952 -6.991 1.00 . A A . 19 GLU OE2 1 1 3 1787 1 1 18 TYR C C 5.482 -10.010 -0.950 1.00 . A A . 20 TYR C 1 1 3 1788 1 1 18 TYR CA C 4.282 -10.862 -0.547 1.00 . A A . 20 TYR CA 1 1 3 1789 1 1 18 TYR CB C 4.733 -11.901 0.475 1.00 . A A . 20 TYR CB 1 1 3 1790 1 1 18 TYR CD1 C 5.734 -10.528 2.337 1.00 . A A . 20 TYR CD1 1 1 3 1791 1 1 18 TYR CD2 C 3.546 -11.520 2.667 1.00 . A A . 20 TYR CD2 1 1 3 1792 1 1 18 TYR CE1 C 5.676 -9.971 3.622 1.00 . A A . 20 TYR CE1 1 1 3 1793 1 1 18 TYR CE2 C 3.488 -10.964 3.951 1.00 . A A . 20 TYR CE2 1 1 3 1794 1 1 18 TYR CG C 4.669 -11.302 1.860 1.00 . A A . 20 TYR CG 1 1 3 1795 1 1 18 TYR CZ C 4.553 -10.190 4.428 1.00 . A A . 20 TYR CZ 1 1 3 1796 1 1 18 TYR H H 4.174 -12.320 -2.130 1.00 . A A . 20 TYR H 1 1 3 1797 1 1 18 TYR HA H 3.524 -10.230 -0.107 1.00 . A A . 20 TYR HA 1 1 3 1798 1 1 18 TYR HB2 H 4.088 -12.765 0.422 1.00 . A A . 20 TYR HB2 1 1 3 1799 1 1 18 TYR HB3 H 5.748 -12.192 0.258 1.00 . A A . 20 TYR HB3 1 1 3 1800 1 1 18 TYR HD1 H 6.601 -10.359 1.716 1.00 . A A . 20 TYR HD1 1 1 3 1801 1 1 18 TYR HD2 H 2.724 -12.116 2.300 1.00 . A A . 20 TYR HD2 1 1 3 1802 1 1 18 TYR HE1 H 6.497 -9.374 3.990 1.00 . A A . 20 TYR HE1 1 1 3 1803 1 1 18 TYR HE2 H 2.622 -11.132 4.574 1.00 . A A . 20 TYR HE2 1 1 3 1804 1 1 18 TYR HH H 4.727 -10.329 6.325 1.00 . A A . 20 TYR HH 1 1 3 1805 1 1 18 TYR N N 3.725 -11.533 -1.754 1.00 . A A . 20 TYR N 1 1 3 1806 1 1 18 TYR O O 6.504 -10.513 -1.369 1.00 . A A . 20 TYR O 1 1 3 1807 1 1 18 TYR OH O 4.494 -9.643 5.693 1.00 . A A . 20 TYR OH 1 1 3 1808 1 1 19 ARG C C 6.463 -6.614 -0.238 1.00 . A A . 21 ARG C 1 1 3 1809 1 1 19 ARG CA C 6.477 -7.817 -1.188 1.00 . A A . 21 ARG CA 1 1 3 1810 1 1 19 ARG CB C 6.281 -7.336 -2.627 1.00 . A A . 21 ARG CB 1 1 3 1811 1 1 19 ARG CD C 8.570 -8.183 -3.193 1.00 . A A . 21 ARG CD 1 1 3 1812 1 1 19 ARG CG C 7.636 -6.970 -3.238 1.00 . A A . 21 ARG CG 1 1 3 1813 1 1 19 ARG CZ C 8.329 -10.220 -4.485 1.00 . A A . 21 ARG CZ 1 1 3 1814 1 1 19 ARG H H 4.524 -8.356 -0.477 1.00 . A A . 21 ARG H 1 1 3 1815 1 1 19 ARG HA H 7.412 -8.346 -1.108 1.00 . A A . 21 ARG HA 1 1 3 1816 1 1 19 ARG HB2 H 5.822 -8.121 -3.210 1.00 . A A . 21 ARG HB2 1 1 3 1817 1 1 19 ARG HB3 H 5.642 -6.465 -2.630 1.00 . A A . 21 ARG HB3 1 1 3 1818 1 1 19 ARG HD2 H 9.394 -8.026 -3.873 1.00 . A A . 21 ARG HD2 1 1 3 1819 1 1 19 ARG HD3 H 8.951 -8.307 -2.191 1.00 . A A . 21 ARG HD3 1 1 3 1820 1 1 19 ARG HE H 6.952 -9.605 -3.195 1.00 . A A . 21 ARG HE 1 1 3 1821 1 1 19 ARG HG2 H 7.496 -6.662 -4.264 1.00 . A A . 21 ARG HG2 1 1 3 1822 1 1 19 ARG HG3 H 8.075 -6.160 -2.677 1.00 . A A . 21 ARG HG3 1 1 3 1823 1 1 19 ARG HH11 H 10.099 -10.377 -3.560 1.00 . A A . 21 ARG HH11 1 1 3 1824 1 1 19 ARG HH12 H 9.936 -11.285 -5.027 1.00 . A A . 21 ARG HH12 1 1 3 1825 1 1 19 ARG HH21 H 6.679 -10.253 -5.620 1.00 . A A . 21 ARG HH21 1 1 3 1826 1 1 19 ARG HH22 H 8.002 -11.213 -6.194 1.00 . A A . 21 ARG HH22 1 1 3 1827 1 1 19 ARG N N 5.358 -8.725 -0.821 1.00 . A A . 21 ARG N 1 1 3 1828 1 1 19 ARG NE N 7.823 -9.407 -3.598 1.00 . A A . 21 ARG NE 1 1 3 1829 1 1 19 ARG NH1 N 9.550 -10.661 -4.347 1.00 . A A . 21 ARG NH1 1 1 3 1830 1 1 19 ARG NH2 N 7.614 -10.590 -5.513 1.00 . A A . 21 ARG NH2 1 1 3 1831 1 1 19 ARG O O 5.495 -5.879 -0.196 1.00 . A A . 21 ARG O 1 1 3 1832 1 1 20 PRO C C 7.992 -4.035 0.754 1.00 . A A . 22 PRO C 1 1 3 1833 1 1 20 PRO CA C 7.649 -5.342 1.473 1.00 . A A . 22 PRO CA 1 1 3 1834 1 1 20 PRO CB C 8.798 -5.783 2.381 1.00 . A A . 22 PRO CB 1 1 3 1835 1 1 20 PRO CD C 8.705 -7.339 0.458 1.00 . A A . 22 PRO CD 1 1 3 1836 1 1 20 PRO CG C 9.630 -6.801 1.567 1.00 . A A . 22 PRO CG 1 1 3 1837 1 1 20 PRO HA H 6.744 -5.237 2.047 1.00 . A A . 22 PRO HA 1 1 3 1838 1 1 20 PRO HB2 H 9.406 -4.929 2.649 1.00 . A A . 22 PRO HB2 1 1 3 1839 1 1 20 PRO HB3 H 8.409 -6.258 3.268 1.00 . A A . 22 PRO HB3 1 1 3 1840 1 1 20 PRO HD2 H 9.193 -7.275 -0.505 1.00 . A A . 22 PRO HD2 1 1 3 1841 1 1 20 PRO HD3 H 8.412 -8.356 0.670 1.00 . A A . 22 PRO HD3 1 1 3 1842 1 1 20 PRO HG2 H 10.489 -6.309 1.130 1.00 . A A . 22 PRO HG2 1 1 3 1843 1 1 20 PRO HG3 H 9.948 -7.613 2.200 1.00 . A A . 22 PRO HG3 1 1 3 1844 1 1 20 PRO N N 7.527 -6.448 0.507 1.00 . A A . 22 PRO N 1 1 3 1845 1 1 20 PRO O O 8.901 -3.975 -0.049 1.00 . A A . 22 PRO O 1 1 3 1846 1 1 21 LEU C C 7.548 -0.561 1.403 1.00 . A A . 23 LEU C 1 1 3 1847 1 1 21 LEU CA C 7.547 -1.687 0.367 1.00 . A A . 23 LEU CA 1 1 3 1848 1 1 21 LEU CB C 6.458 -1.401 -0.671 1.00 . A A . 23 LEU CB 1 1 3 1849 1 1 21 LEU CD1 C 5.040 -2.395 -2.469 1.00 . A A . 23 LEU CD1 1 1 3 1850 1 1 21 LEU CD2 C 7.280 -3.377 -1.966 1.00 . A A . 23 LEU CD2 1 1 3 1851 1 1 21 LEU CG C 6.046 -2.703 -1.361 1.00 . A A . 23 LEU CG 1 1 3 1852 1 1 21 LEU H H 6.534 -3.066 1.679 1.00 . A A . 23 LEU H 1 1 3 1853 1 1 21 LEU HA H 8.508 -1.730 -0.122 1.00 . A A . 23 LEU HA 1 1 3 1854 1 1 21 LEU HB2 H 5.600 -0.972 -0.176 1.00 . A A . 23 LEU HB2 1 1 3 1855 1 1 21 LEU HB3 H 6.830 -0.700 -1.406 1.00 . A A . 23 LEU HB3 1 1 3 1856 1 1 21 LEU HD11 H 5.468 -2.653 -3.428 1.00 . A A . 23 LEU HD11 1 1 3 1857 1 1 21 LEU HD12 H 4.800 -1.342 -2.454 1.00 . A A . 23 LEU HD12 1 1 3 1858 1 1 21 LEU HD13 H 4.141 -2.971 -2.309 1.00 . A A . 23 LEU HD13 1 1 3 1859 1 1 21 LEU HD21 H 7.417 -4.350 -1.518 1.00 . A A . 23 LEU HD21 1 1 3 1860 1 1 21 LEU HD22 H 8.152 -2.768 -1.779 1.00 . A A . 23 LEU HD22 1 1 3 1861 1 1 21 LEU HD23 H 7.141 -3.488 -3.032 1.00 . A A . 23 LEU HD23 1 1 3 1862 1 1 21 LEU HG H 5.592 -3.365 -0.637 1.00 . A A . 23 LEU HG 1 1 3 1863 1 1 21 LEU N N 7.266 -2.991 1.035 1.00 . A A . 23 LEU N 1 1 3 1864 1 1 21 LEU O O 6.790 -0.568 2.348 1.00 . A A . 23 LEU O 1 1 3 1865 1 1 22 CYS C C 7.331 2.562 1.696 1.00 . A A . 24 CYS C 1 1 3 1866 1 1 22 CYS CA C 8.375 1.561 2.179 1.00 . A A . 24 CYS CA 1 1 3 1867 1 1 22 CYS CB C 9.759 2.209 2.203 1.00 . A A . 24 CYS CB 1 1 3 1868 1 1 22 CYS H H 8.959 0.441 0.435 1.00 . A A . 24 CYS H 1 1 3 1869 1 1 22 CYS HA H 8.114 1.206 3.166 1.00 . A A . 24 CYS HA 1 1 3 1870 1 1 22 CYS HB2 H 10.514 1.449 2.063 1.00 . A A . 24 CYS HB2 1 1 3 1871 1 1 22 CYS HB3 H 9.832 2.939 1.411 1.00 . A A . 24 CYS HB3 1 1 3 1872 1 1 22 CYS N N 8.367 0.429 1.216 1.00 . A A . 24 CYS N 1 1 3 1873 1 1 22 CYS O O 7.567 3.328 0.787 1.00 . A A . 24 CYS O 1 1 3 1874 1 1 22 CYS SG S 10.013 3.021 3.799 1.00 . A A . 24 CYS SG 1 1 3 1875 1 1 23 GLY C C 5.197 4.810 2.467 1.00 . A A . 25 GLY C 1 1 3 1876 1 1 23 GLY CA C 5.084 3.444 1.801 1.00 . A A . 25 GLY CA 1 1 3 1877 1 1 23 GLY H H 5.977 1.883 2.982 1.00 . A A . 25 GLY H 1 1 3 1878 1 1 23 GLY HA2 H 5.160 3.565 0.731 1.00 . A A . 25 GLY HA2 1 1 3 1879 1 1 23 GLY HA3 H 4.124 3.012 2.041 1.00 . A A . 25 GLY HA3 1 1 3 1880 1 1 23 GLY N N 6.159 2.530 2.266 1.00 . A A . 25 GLY N 1 1 3 1881 1 1 23 GLY O O 5.626 4.931 3.604 1.00 . A A . 25 GLY O 1 1 3 1882 1 1 24 SER C C 4.047 7.286 3.637 1.00 . A A . 26 SER C 1 1 3 1883 1 1 24 SER CA C 4.817 7.221 2.315 1.00 . A A . 26 SER CA 1 1 3 1884 1 1 24 SER CB C 4.172 8.181 1.317 1.00 . A A . 26 SER CB 1 1 3 1885 1 1 24 SER H H 4.423 5.687 0.855 1.00 . A A . 26 SER H 1 1 3 1886 1 1 24 SER HA H 5.844 7.514 2.480 1.00 . A A . 26 SER HA 1 1 3 1887 1 1 24 SER HB2 H 3.526 7.631 0.652 1.00 . A A . 26 SER HB2 1 1 3 1888 1 1 24 SER HB3 H 3.587 8.916 1.856 1.00 . A A . 26 SER HB3 1 1 3 1889 1 1 24 SER HG H 4.963 9.757 0.499 1.00 . A A . 26 SER HG 1 1 3 1890 1 1 24 SER N N 4.779 5.836 1.761 1.00 . A A . 26 SER N 1 1 3 1891 1 1 24 SER O O 4.067 8.288 4.323 1.00 . A A . 26 SER O 1 1 3 1892 1 1 24 SER OG O 5.185 8.825 0.559 1.00 . A A . 26 SER OG 1 1 3 1893 1 1 25 ASP C C 3.579 6.078 6.454 1.00 . A A . 27 ASP C 1 1 3 1894 1 1 25 ASP CA C 2.604 6.253 5.282 1.00 . A A . 27 ASP CA 1 1 3 1895 1 1 25 ASP CB C 1.587 5.102 5.279 1.00 . A A . 27 ASP CB 1 1 3 1896 1 1 25 ASP CG C 2.291 3.784 5.607 1.00 . A A . 27 ASP CG 1 1 3 1897 1 1 25 ASP H H 3.346 5.435 3.447 1.00 . A A . 27 ASP H 1 1 3 1898 1 1 25 ASP HA H 2.084 7.195 5.379 1.00 . A A . 27 ASP HA 1 1 3 1899 1 1 25 ASP HB2 H 0.823 5.295 6.017 1.00 . A A . 27 ASP HB2 1 1 3 1900 1 1 25 ASP HB3 H 1.134 5.026 4.303 1.00 . A A . 27 ASP HB3 1 1 3 1901 1 1 25 ASP N N 3.366 6.233 4.007 1.00 . A A . 27 ASP N 1 1 3 1902 1 1 25 ASP O O 3.175 5.984 7.596 1.00 . A A . 27 ASP O 1 1 3 1903 1 1 25 ASP OD1 O 2.830 3.179 4.695 1.00 . A A . 27 ASP OD1 1 1 3 1904 1 1 25 ASP OD2 O 2.276 3.403 6.765 1.00 . A A . 27 ASP OD2 1 1 3 1905 1 1 26 ASN C C 5.879 4.427 7.733 1.00 . A A . 28 ASN C 1 1 3 1906 1 1 26 ASN CA C 5.853 5.882 7.272 1.00 . A A . 28 ASN CA 1 1 3 1907 1 1 26 ASN CB C 5.458 6.776 8.450 1.00 . A A . 28 ASN CB 1 1 3 1908 1 1 26 ASN CG C 6.706 7.450 9.023 1.00 . A A . 28 ASN CG 1 1 3 1909 1 1 26 ASN H H 5.165 6.120 5.255 1.00 . A A . 28 ASN H 1 1 3 1910 1 1 26 ASN HA H 6.832 6.165 6.916 1.00 . A A . 28 ASN HA 1 1 3 1911 1 1 26 ASN HB2 H 4.763 7.530 8.109 1.00 . A A . 28 ASN HB2 1 1 3 1912 1 1 26 ASN HB3 H 4.992 6.175 9.216 1.00 . A A . 28 ASN HB3 1 1 3 1913 1 1 26 ASN HD21 H 5.967 9.286 8.853 1.00 . A A . 28 ASN HD21 1 1 3 1914 1 1 26 ASN HD22 H 7.533 9.190 9.502 1.00 . A A . 28 ASN HD22 1 1 3 1915 1 1 26 ASN N N 4.859 6.040 6.178 1.00 . A A . 28 ASN N 1 1 3 1916 1 1 26 ASN ND2 N 6.738 8.750 9.135 1.00 . A A . 28 ASN ND2 1 1 3 1917 1 1 26 ASN O O 6.178 4.141 8.876 1.00 . A A . 28 ASN O 1 1 3 1918 1 1 26 ASN OD1 O 7.660 6.787 9.372 1.00 . A A . 28 ASN OD1 1 1 3 1919 1 1 27 LYS C C 5.913 1.147 6.143 1.00 . A A . 29 LYS C 1 1 3 1920 1 1 27 LYS CA C 5.586 2.067 7.310 1.00 . A A . 29 LYS CA 1 1 3 1921 1 1 27 LYS CB C 4.216 1.671 7.871 1.00 . A A . 29 LYS CB 1 1 3 1922 1 1 27 LYS CD C 4.733 2.284 10.239 1.00 . A A . 29 LYS CD 1 1 3 1923 1 1 27 LYS CE C 4.711 3.468 11.209 1.00 . A A . 29 LYS CE 1 1 3 1924 1 1 27 LYS CG C 3.834 2.587 9.037 1.00 . A A . 29 LYS CG 1 1 3 1925 1 1 27 LYS H H 5.329 3.732 5.939 1.00 . A A . 29 LYS H 1 1 3 1926 1 1 27 LYS HA H 6.332 1.941 8.075 1.00 . A A . 29 LYS HA 1 1 3 1927 1 1 27 LYS HB2 H 3.474 1.750 7.092 1.00 . A A . 29 LYS HB2 1 1 3 1928 1 1 27 LYS HB3 H 4.257 0.649 8.220 1.00 . A A . 29 LYS HB3 1 1 3 1929 1 1 27 LYS HD2 H 4.369 1.400 10.743 1.00 . A A . 29 LYS HD2 1 1 3 1930 1 1 27 LYS HD3 H 5.744 2.116 9.900 1.00 . A A . 29 LYS HD3 1 1 3 1931 1 1 27 LYS HE2 H 5.384 3.271 12.031 1.00 . A A . 29 LYS HE2 1 1 3 1932 1 1 27 LYS HE3 H 5.027 4.363 10.693 1.00 . A A . 29 LYS HE3 1 1 3 1933 1 1 27 LYS HG2 H 3.956 3.618 8.744 1.00 . A A . 29 LYS HG2 1 1 3 1934 1 1 27 LYS HG3 H 2.803 2.410 9.310 1.00 . A A . 29 LYS HG3 1 1 3 1935 1 1 27 LYS HZ1 H 3.189 3.051 12.566 1.00 . A A . 29 LYS HZ1 1 1 3 1936 1 1 27 LYS HZ2 H 2.643 3.396 10.993 1.00 . A A . 29 LYS HZ2 1 1 3 1937 1 1 27 LYS HZ3 H 3.192 4.650 11.999 1.00 . A A . 29 LYS HZ3 1 1 3 1938 1 1 27 LYS N N 5.569 3.495 6.868 1.00 . A A . 29 LYS N 1 1 3 1939 1 1 27 LYS NZ N 3.330 3.655 11.731 1.00 . A A . 29 LYS NZ 1 1 3 1940 1 1 27 LYS O O 6.063 1.573 5.020 1.00 . A A . 29 LYS O 1 1 3 1941 1 1 28 THR C C 4.964 -1.572 4.738 1.00 . A A . 30 THR C 1 1 3 1942 1 1 28 THR CA C 6.297 -1.101 5.332 1.00 . A A . 30 THR CA 1 1 3 1943 1 1 28 THR CB C 7.082 -2.284 5.910 1.00 . A A . 30 THR CB 1 1 3 1944 1 1 28 THR CG2 C 7.130 -3.426 4.894 1.00 . A A . 30 THR CG2 1 1 3 1945 1 1 28 THR H H 5.863 -0.439 7.332 1.00 . A A . 30 THR H 1 1 3 1946 1 1 28 THR HA H 6.882 -0.618 4.564 1.00 . A A . 30 THR HA 1 1 3 1947 1 1 28 THR HB H 6.601 -2.631 6.813 1.00 . A A . 30 THR HB 1 1 3 1948 1 1 28 THR HG1 H 8.662 -2.253 7.051 1.00 . A A . 30 THR HG1 1 1 3 1949 1 1 28 THR HG21 H 6.198 -3.972 4.918 1.00 . A A . 30 THR HG21 1 1 3 1950 1 1 28 THR HG22 H 7.943 -4.093 5.142 1.00 . A A . 30 THR HG22 1 1 3 1951 1 1 28 THR HG23 H 7.284 -3.022 3.905 1.00 . A A . 30 THR HG23 1 1 3 1952 1 1 28 THR N N 6.004 -0.125 6.414 1.00 . A A . 30 THR N 1 1 3 1953 1 1 28 THR O O 3.923 -1.448 5.351 1.00 . A A . 30 THR O 1 1 3 1954 1 1 28 THR OG1 O 8.411 -1.865 6.210 1.00 . A A . 30 THR OG1 1 1 3 1955 1 1 29 TYR C C 3.727 -4.058 2.724 1.00 . A A . 31 TYR C 1 1 3 1956 1 1 29 TYR CA C 3.710 -2.541 2.904 1.00 . A A . 31 TYR CA 1 1 3 1957 1 1 29 TYR CB C 3.581 -1.881 1.530 1.00 . A A . 31 TYR CB 1 1 3 1958 1 1 29 TYR CD1 C 1.245 -0.976 1.859 1.00 . A A . 31 TYR CD1 1 1 3 1959 1 1 29 TYR CD2 C 3.041 0.576 1.365 1.00 . A A . 31 TYR CD2 1 1 3 1960 1 1 29 TYR CE1 C 0.337 0.092 1.906 1.00 . A A . 31 TYR CE1 1 1 3 1961 1 1 29 TYR CE2 C 2.135 1.642 1.412 1.00 . A A . 31 TYR CE2 1 1 3 1962 1 1 29 TYR CG C 2.598 -0.733 1.590 1.00 . A A . 31 TYR CG 1 1 3 1963 1 1 29 TYR CZ C 0.783 1.401 1.681 1.00 . A A . 31 TYR CZ 1 1 3 1964 1 1 29 TYR H H 5.822 -2.171 3.063 1.00 . A A . 31 TYR H 1 1 3 1965 1 1 29 TYR HA H 2.871 -2.258 3.520 1.00 . A A . 31 TYR HA 1 1 3 1966 1 1 29 TYR HB2 H 4.546 -1.507 1.226 1.00 . A A . 31 TYR HB2 1 1 3 1967 1 1 29 TYR HB3 H 3.238 -2.611 0.813 1.00 . A A . 31 TYR HB3 1 1 3 1968 1 1 29 TYR HD1 H 0.900 -1.985 2.032 1.00 . A A . 31 TYR HD1 1 1 3 1969 1 1 29 TYR HD2 H 4.084 0.763 1.159 1.00 . A A . 31 TYR HD2 1 1 3 1970 1 1 29 TYR HE1 H -0.706 -0.094 2.112 1.00 . A A . 31 TYR HE1 1 1 3 1971 1 1 29 TYR HE2 H 2.479 2.651 1.237 1.00 . A A . 31 TYR HE2 1 1 3 1972 1 1 29 TYR HH H 0.209 3.145 1.143 1.00 . A A . 31 TYR HH 1 1 3 1973 1 1 29 TYR N N 4.981 -2.090 3.544 1.00 . A A . 31 TYR N 1 1 3 1974 1 1 29 TYR O O 4.771 -4.667 2.595 1.00 . A A . 31 TYR O 1 1 3 1975 1 1 29 TYR OH O -0.111 2.454 1.729 1.00 . A A . 31 TYR OH 1 1 3 1976 1 1 30 GLY C C 2.554 -6.476 1.028 1.00 . A A . 32 GLY C 1 1 3 1977 1 1 30 GLY CA C 2.507 -6.146 2.520 1.00 . A A . 32 GLY CA 1 1 3 1978 1 1 30 GLY H H 1.744 -4.153 2.800 1.00 . A A . 32 GLY H 1 1 3 1979 1 1 30 GLY HA2 H 3.348 -6.609 3.019 1.00 . A A . 32 GLY HA2 1 1 3 1980 1 1 30 GLY HA3 H 1.586 -6.523 2.939 1.00 . A A . 32 GLY HA3 1 1 3 1981 1 1 30 GLY N N 2.572 -4.669 2.704 1.00 . A A . 32 GLY N 1 1 3 1982 1 1 30 GLY O O 2.987 -7.538 0.633 1.00 . A A . 32 GLY O 1 1 3 1983 1 1 31 ASN C C 1.436 -4.703 -2.019 1.00 . A A . 33 ASN C 1 1 3 1984 1 1 31 ASN CA C 2.143 -5.837 -1.274 1.00 . A A . 33 ASN CA 1 1 3 1985 1 1 31 ASN CB C 1.446 -7.166 -1.578 1.00 . A A . 33 ASN CB 1 1 3 1986 1 1 31 ASN CG C 0.160 -7.278 -0.759 1.00 . A A . 33 ASN CG 1 1 3 1987 1 1 31 ASN H H 1.770 -4.718 0.530 1.00 . A A . 33 ASN H 1 1 3 1988 1 1 31 ASN HA H 3.168 -5.889 -1.604 1.00 . A A . 33 ASN HA 1 1 3 1989 1 1 31 ASN HB2 H 1.207 -7.212 -2.630 1.00 . A A . 33 ASN HB2 1 1 3 1990 1 1 31 ASN HB3 H 2.104 -7.983 -1.323 1.00 . A A . 33 ASN HB3 1 1 3 1991 1 1 31 ASN HD21 H 0.683 -8.997 0.088 1.00 . A A . 33 ASN HD21 1 1 3 1992 1 1 31 ASN HD22 H -0.829 -8.387 0.558 1.00 . A A . 33 ASN HD22 1 1 3 1993 1 1 31 ASN N N 2.114 -5.571 0.192 1.00 . A A . 33 ASN N 1 1 3 1994 1 1 31 ASN ND2 N -0.010 -8.306 0.028 1.00 . A A . 33 ASN ND2 1 1 3 1995 1 1 31 ASN O O 0.777 -3.868 -1.431 1.00 . A A . 33 ASN O 1 1 3 1996 1 1 31 ASN OD1 O -0.701 -6.427 -0.842 1.00 . A A . 33 ASN OD1 1 1 3 1997 1 1 32 LYS C C -0.580 -3.662 -3.959 1.00 . A A . 34 LYS C 1 1 3 1998 1 1 32 LYS CA C 0.940 -3.595 -4.118 1.00 . A A . 34 LYS CA 1 1 3 1999 1 1 32 LYS CB C 1.302 -3.788 -5.592 1.00 . A A . 34 LYS CB 1 1 3 2000 1 1 32 LYS CD C 1.757 -2.594 -7.733 1.00 . A A . 34 LYS CD 1 1 3 2001 1 1 32 LYS CE C 2.978 -1.821 -8.234 1.00 . A A . 34 LYS CE 1 1 3 2002 1 1 32 LYS CG C 1.637 -2.434 -6.218 1.00 . A A . 34 LYS CG 1 1 3 2003 1 1 32 LYS H H 2.127 -5.344 -3.754 1.00 . A A . 34 LYS H 1 1 3 2004 1 1 32 LYS HA H 1.292 -2.631 -3.785 1.00 . A A . 34 LYS HA 1 1 3 2005 1 1 32 LYS HB2 H 2.158 -4.442 -5.668 1.00 . A A . 34 LYS HB2 1 1 3 2006 1 1 32 LYS HB3 H 0.465 -4.226 -6.115 1.00 . A A . 34 LYS HB3 1 1 3 2007 1 1 32 LYS HD2 H 1.869 -3.641 -7.975 1.00 . A A . 34 LYS HD2 1 1 3 2008 1 1 32 LYS HD3 H 0.868 -2.207 -8.207 1.00 . A A . 34 LYS HD3 1 1 3 2009 1 1 32 LYS HE2 H 3.769 -1.883 -7.500 1.00 . A A . 34 LYS HE2 1 1 3 2010 1 1 32 LYS HE3 H 3.317 -2.251 -9.166 1.00 . A A . 34 LYS HE3 1 1 3 2011 1 1 32 LYS HG2 H 0.852 -1.727 -5.989 1.00 . A A . 34 LYS HG2 1 1 3 2012 1 1 32 LYS HG3 H 2.574 -2.075 -5.819 1.00 . A A . 34 LYS HG3 1 1 3 2013 1 1 32 LYS HZ1 H 1.580 -0.313 -8.559 1.00 . A A . 34 LYS HZ1 1 1 3 2014 1 1 32 LYS HZ2 H 3.080 -0.041 -9.310 1.00 . A A . 34 LYS HZ2 1 1 3 2015 1 1 32 LYS HZ3 H 2.916 0.172 -7.632 1.00 . A A . 34 LYS HZ3 1 1 3 2016 1 1 32 LYS N N 1.583 -4.667 -3.312 1.00 . A A . 34 LYS N 1 1 3 2017 1 1 32 LYS NZ N 2.611 -0.393 -8.450 1.00 . A A . 34 LYS NZ 1 1 3 2018 1 1 32 LYS O O -1.281 -2.721 -4.270 1.00 . A A . 34 LYS O 1 1 3 2019 1 1 33 CYS C C -2.953 -4.035 -2.058 1.00 . A A . 35 CYS C 1 1 3 2020 1 1 33 CYS CA C -2.572 -4.845 -3.296 1.00 . A A . 35 CYS CA 1 1 3 2021 1 1 33 CYS CB C -2.969 -6.307 -3.112 1.00 . A A . 35 CYS CB 1 1 3 2022 1 1 33 CYS H H -0.526 -5.508 -3.211 1.00 . A A . 35 CYS H 1 1 3 2023 1 1 33 CYS HA H -3.068 -4.437 -4.165 1.00 . A A . 35 CYS HA 1 1 3 2024 1 1 33 CYS HB2 H -2.528 -6.898 -3.902 1.00 . A A . 35 CYS HB2 1 1 3 2025 1 1 33 CYS HB3 H -2.607 -6.657 -2.158 1.00 . A A . 35 CYS HB3 1 1 3 2026 1 1 33 CYS N N -1.100 -4.755 -3.471 1.00 . A A . 35 CYS N 1 1 3 2027 1 1 33 CYS O O -4.011 -3.440 -1.983 1.00 . A A . 35 CYS O 1 1 3 2028 1 1 33 CYS SG S -4.770 -6.462 -3.179 1.00 . A A . 35 CYS SG 1 1 3 2029 1 1 34 ASN C C -1.981 -1.740 -0.162 1.00 . A A . 36 ASN C 1 1 3 2030 1 1 34 ASN CA C -2.335 -3.197 0.127 1.00 . A A . 36 ASN CA 1 1 3 2031 1 1 34 ASN CB C -1.452 -3.726 1.259 1.00 . A A . 36 ASN CB 1 1 3 2032 1 1 34 ASN CG C -2.290 -3.912 2.524 1.00 . A A . 36 ASN CG 1 1 3 2033 1 1 34 ASN H H -1.216 -4.449 -1.201 1.00 . A A . 36 ASN H 1 1 3 2034 1 1 34 ASN HA H -3.378 -3.278 0.401 1.00 . A A . 36 ASN HA 1 1 3 2035 1 1 34 ASN HB2 H -1.022 -4.674 0.967 1.00 . A A . 36 ASN HB2 1 1 3 2036 1 1 34 ASN HB3 H -0.661 -3.020 1.453 1.00 . A A . 36 ASN HB3 1 1 3 2037 1 1 34 ASN HD21 H -3.601 -5.119 1.646 1.00 . A A . 36 ASN HD21 1 1 3 2038 1 1 34 ASN HD22 H -3.892 -4.801 3.288 1.00 . A A . 36 ASN HD22 1 1 3 2039 1 1 34 ASN N N -2.070 -3.985 -1.101 1.00 . A A . 36 ASN N 1 1 3 2040 1 1 34 ASN ND2 N -3.350 -4.673 2.483 1.00 . A A . 36 ASN ND2 1 1 3 2041 1 1 34 ASN O O -2.388 -0.833 0.536 1.00 . A A . 36 ASN O 1 1 3 2042 1 1 34 ASN OD1 O -1.977 -3.363 3.560 1.00 . A A . 36 ASN OD1 1 1 3 2043 1 1 35 PHE C C -1.951 0.536 -2.334 1.00 . A A . 37 PHE C 1 1 3 2044 1 1 35 PHE CA C -0.816 -0.134 -1.560 1.00 . A A . 37 PHE CA 1 1 3 2045 1 1 35 PHE CB C 0.441 -0.196 -2.431 1.00 . A A . 37 PHE CB 1 1 3 2046 1 1 35 PHE CD1 C 0.339 1.954 -3.744 1.00 . A A . 37 PHE CD1 1 1 3 2047 1 1 35 PHE CD2 C 1.979 1.743 -1.971 1.00 . A A . 37 PHE CD2 1 1 3 2048 1 1 35 PHE CE1 C 0.798 3.249 -4.015 1.00 . A A . 37 PHE CE1 1 1 3 2049 1 1 35 PHE CE2 C 2.438 3.037 -2.241 1.00 . A A . 37 PHE CE2 1 1 3 2050 1 1 35 PHE CG C 0.931 1.202 -2.721 1.00 . A A . 37 PHE CG 1 1 3 2051 1 1 35 PHE CZ C 1.848 3.791 -3.263 1.00 . A A . 37 PHE CZ 1 1 3 2052 1 1 35 PHE H H -0.902 -2.270 -1.742 1.00 . A A . 37 PHE H 1 1 3 2053 1 1 35 PHE HA H -0.611 0.427 -0.664 1.00 . A A . 37 PHE HA 1 1 3 2054 1 1 35 PHE HB2 H 1.211 -0.747 -1.910 1.00 . A A . 37 PHE HB2 1 1 3 2055 1 1 35 PHE HB3 H 0.211 -0.698 -3.359 1.00 . A A . 37 PHE HB3 1 1 3 2056 1 1 35 PHE HD1 H -0.471 1.536 -4.322 1.00 . A A . 37 PHE HD1 1 1 3 2057 1 1 35 PHE HD2 H 2.434 1.163 -1.182 1.00 . A A . 37 PHE HD2 1 1 3 2058 1 1 35 PHE HE1 H 0.342 3.830 -4.804 1.00 . A A . 37 PHE HE1 1 1 3 2059 1 1 35 PHE HE2 H 3.247 3.455 -1.660 1.00 . A A . 37 PHE HE2 1 1 3 2060 1 1 35 PHE HZ H 2.203 4.789 -3.472 1.00 . A A . 37 PHE HZ 1 1 3 2061 1 1 35 PHE N N -1.216 -1.518 -1.198 1.00 . A A . 37 PHE N 1 1 3 2062 1 1 35 PHE O O -2.285 1.680 -2.098 1.00 . A A . 37 PHE O 1 1 3 2063 1 1 36 CYS C C -4.900 0.540 -3.139 1.00 . A A . 38 CYS C 1 1 3 2064 1 1 36 CYS CA C -3.667 0.428 -4.035 1.00 . A A . 38 CYS CA 1 1 3 2065 1 1 36 CYS CB C -3.986 -0.466 -5.235 1.00 . A A . 38 CYS CB 1 1 3 2066 1 1 36 CYS H H -2.270 -1.089 -3.424 1.00 . A A . 38 CYS H 1 1 3 2067 1 1 36 CYS HA H -3.381 1.411 -4.381 1.00 . A A . 38 CYS HA 1 1 3 2068 1 1 36 CYS HB2 H -3.947 -1.502 -4.933 1.00 . A A . 38 CYS HB2 1 1 3 2069 1 1 36 CYS HB3 H -4.975 -0.235 -5.603 1.00 . A A . 38 CYS HB3 1 1 3 2070 1 1 36 CYS N N -2.551 -0.168 -3.253 1.00 . A A . 38 CYS N 1 1 3 2071 1 1 36 CYS O O -5.778 1.348 -3.371 1.00 . A A . 38 CYS O 1 1 3 2072 1 1 36 CYS SG S -2.771 -0.176 -6.546 1.00 . A A . 38 CYS SG 1 1 3 2073 1 1 37 CYS C C -5.917 0.912 -0.168 1.00 . A A . 39 CYS C 1 1 3 2074 1 1 37 CYS CA C -6.149 -0.190 -1.201 1.00 . A A . 39 CYS CA 1 1 3 2075 1 1 37 CYS CB C -6.339 -1.530 -0.488 1.00 . A A . 39 CYS CB 1 1 3 2076 1 1 37 CYS H H -4.249 -0.904 -1.933 1.00 . A A . 39 CYS H 1 1 3 2077 1 1 37 CYS HA H -7.031 0.040 -1.776 1.00 . A A . 39 CYS HA 1 1 3 2078 1 1 37 CYS HB2 H -6.567 -2.297 -1.215 1.00 . A A . 39 CYS HB2 1 1 3 2079 1 1 37 CYS HB3 H -5.435 -1.792 0.041 1.00 . A A . 39 CYS HB3 1 1 3 2080 1 1 37 CYS N N -4.971 -0.262 -2.109 1.00 . A A . 39 CYS N 1 1 3 2081 1 1 37 CYS O O -6.826 1.622 0.213 1.00 . A A . 39 CYS O 1 1 3 2082 1 1 37 CYS SG S -7.708 -1.389 0.688 1.00 . A A . 39 CYS SG 1 1 3 2083 1 1 38 ALA C C -4.427 3.488 0.575 1.00 . A A . 40 ALA C 1 1 3 2084 1 1 38 ALA CA C -4.404 2.130 1.276 1.00 . A A . 40 ALA CA 1 1 3 2085 1 1 38 ALA CB C -3.019 1.889 1.881 1.00 . A A . 40 ALA CB 1 1 3 2086 1 1 38 ALA H H -3.984 0.487 -0.052 1.00 . A A . 40 ALA H 1 1 3 2087 1 1 38 ALA HA H -5.150 2.112 2.056 1.00 . A A . 40 ALA HA 1 1 3 2088 1 1 38 ALA HB1 H -2.814 0.829 1.898 1.00 . A A . 40 ALA HB1 1 1 3 2089 1 1 38 ALA HB2 H -2.995 2.276 2.889 1.00 . A A . 40 ALA HB2 1 1 3 2090 1 1 38 ALA HB3 H -2.273 2.391 1.285 1.00 . A A . 40 ALA HB3 1 1 3 2091 1 1 38 ALA N N -4.702 1.066 0.277 1.00 . A A . 40 ALA N 1 1 3 2092 1 1 38 ALA O O -4.565 4.520 1.200 1.00 . A A . 40 ALA O 1 1 3 2093 1 1 39 VAL C C -5.766 5.218 -1.679 1.00 . A A . 41 VAL C 1 1 3 2094 1 1 39 VAL CA C -4.316 4.775 -1.477 1.00 . A A . 41 VAL CA 1 1 3 2095 1 1 39 VAL CB C -3.636 4.573 -2.836 1.00 . A A . 41 VAL CB 1 1 3 2096 1 1 39 VAL CG1 C -4.007 5.720 -3.780 1.00 . A A . 41 VAL CG1 1 1 3 2097 1 1 39 VAL CG2 C -2.118 4.545 -2.644 1.00 . A A . 41 VAL CG2 1 1 3 2098 1 1 39 VAL H H -4.190 2.644 -1.206 1.00 . A A . 41 VAL H 1 1 3 2099 1 1 39 VAL HA H -3.784 5.527 -0.916 1.00 . A A . 41 VAL HA 1 1 3 2100 1 1 39 VAL HB H -3.961 3.634 -3.263 1.00 . A A . 41 VAL HB 1 1 3 2101 1 1 39 VAL HG11 H -4.999 5.553 -4.176 1.00 . A A . 41 VAL HG11 1 1 3 2102 1 1 39 VAL HG12 H -3.298 5.760 -4.593 1.00 . A A . 41 VAL HG12 1 1 3 2103 1 1 39 VAL HG13 H -3.987 6.653 -3.238 1.00 . A A . 41 VAL HG13 1 1 3 2104 1 1 39 VAL HG21 H -1.716 5.533 -2.810 1.00 . A A . 41 VAL HG21 1 1 3 2105 1 1 39 VAL HG22 H -1.678 3.855 -3.348 1.00 . A A . 41 VAL HG22 1 1 3 2106 1 1 39 VAL HG23 H -1.888 4.227 -1.637 1.00 . A A . 41 VAL HG23 1 1 3 2107 1 1 39 VAL N N -4.297 3.490 -0.724 1.00 . A A . 41 VAL N 1 1 3 2108 1 1 39 VAL O O -6.083 6.389 -1.616 1.00 . A A . 41 VAL O 1 1 3 2109 1 1 40 VAL C C -8.773 4.779 -0.765 1.00 . A A . 42 VAL C 1 1 3 2110 1 1 40 VAL CA C -8.079 4.653 -2.123 1.00 . A A . 42 VAL CA 1 1 3 2111 1 1 40 VAL CB C -8.769 3.566 -2.949 1.00 . A A . 42 VAL CB 1 1 3 2112 1 1 40 VAL CG1 C -10.242 3.929 -3.146 1.00 . A A . 42 VAL CG1 1 1 3 2113 1 1 40 VAL CG2 C -8.083 3.451 -4.312 1.00 . A A . 42 VAL CG2 1 1 3 2114 1 1 40 VAL H H -6.370 3.351 -1.963 1.00 . A A . 42 VAL H 1 1 3 2115 1 1 40 VAL HA H -8.141 5.596 -2.647 1.00 . A A . 42 VAL HA 1 1 3 2116 1 1 40 VAL HB H -8.699 2.622 -2.428 1.00 . A A . 42 VAL HB 1 1 3 2117 1 1 40 VAL HG11 H -10.330 4.989 -3.329 1.00 . A A . 42 VAL HG11 1 1 3 2118 1 1 40 VAL HG12 H -10.800 3.670 -2.257 1.00 . A A . 42 VAL HG12 1 1 3 2119 1 1 40 VAL HG13 H -10.638 3.384 -3.990 1.00 . A A . 42 VAL HG13 1 1 3 2120 1 1 40 VAL HG21 H -8.304 4.329 -4.902 1.00 . A A . 42 VAL HG21 1 1 3 2121 1 1 40 VAL HG22 H -8.446 2.572 -4.826 1.00 . A A . 42 VAL HG22 1 1 3 2122 1 1 40 VAL HG23 H -7.015 3.371 -4.173 1.00 . A A . 42 VAL HG23 1 1 3 2123 1 1 40 VAL N N -6.648 4.289 -1.918 1.00 . A A . 42 VAL N 1 1 3 2124 1 1 40 VAL O O -9.894 5.239 -0.669 1.00 . A A . 42 VAL O 1 1 3 2125 1 1 41 GLU C C -8.292 5.773 2.310 1.00 . A A . 43 GLU C 1 1 3 2126 1 1 41 GLU CA C -8.738 4.471 1.637 1.00 . A A . 43 GLU CA 1 1 3 2127 1 1 41 GLU CB C -8.298 3.278 2.489 1.00 . A A . 43 GLU CB 1 1 3 2128 1 1 41 GLU CD C -10.539 2.356 3.104 1.00 . A A . 43 GLU CD 1 1 3 2129 1 1 41 GLU CG C -9.271 2.115 2.282 1.00 . A A . 43 GLU CG 1 1 3 2130 1 1 41 GLU H H -7.212 4.006 0.190 1.00 . A A . 43 GLU H 1 1 3 2131 1 1 41 GLU HA H -9.813 4.467 1.539 1.00 . A A . 43 GLU HA 1 1 3 2132 1 1 41 GLU HB2 H -7.304 2.973 2.195 1.00 . A A . 43 GLU HB2 1 1 3 2133 1 1 41 GLU HB3 H -8.294 3.562 3.531 1.00 . A A . 43 GLU HB3 1 1 3 2134 1 1 41 GLU HG2 H -9.529 2.043 1.235 1.00 . A A . 43 GLU HG2 1 1 3 2135 1 1 41 GLU HG3 H -8.808 1.196 2.603 1.00 . A A . 43 GLU HG3 1 1 3 2136 1 1 41 GLU N N -8.115 4.373 0.287 1.00 . A A . 43 GLU N 1 1 3 2137 1 1 41 GLU O O -8.961 6.292 3.182 1.00 . A A . 43 GLU O 1 1 3 2138 1 1 41 GLU OE1 O -10.540 3.283 3.896 1.00 . A A . 43 GLU OE1 1 1 3 2139 1 1 41 GLU OE2 O -11.488 1.610 2.925 1.00 . A A . 43 GLU OE2 1 1 3 2140 1 1 42 SER C C -7.113 8.760 1.667 1.00 . A A . 44 SER C 1 1 3 2141 1 1 42 SER CA C -6.686 7.570 2.532 1.00 . A A . 44 SER CA 1 1 3 2142 1 1 42 SER CB C -5.159 7.537 2.636 1.00 . A A . 44 SER CB 1 1 3 2143 1 1 42 SER H H -6.643 5.871 1.208 1.00 . A A . 44 SER H 1 1 3 2144 1 1 42 SER HA H -7.110 7.672 3.519 1.00 . A A . 44 SER HA 1 1 3 2145 1 1 42 SER HB2 H -4.788 8.527 2.841 1.00 . A A . 44 SER HB2 1 1 3 2146 1 1 42 SER HB3 H -4.868 6.872 3.439 1.00 . A A . 44 SER HB3 1 1 3 2147 1 1 42 SER HG H -4.070 7.782 1.042 1.00 . A A . 44 SER HG 1 1 3 2148 1 1 42 SER N N -7.169 6.304 1.913 1.00 . A A . 44 SER N 1 1 3 2149 1 1 42 SER O O -6.740 9.887 1.921 1.00 . A A . 44 SER O 1 1 3 2150 1 1 42 SER OG O -4.614 7.079 1.405 1.00 . A A . 44 SER OG 1 1 3 2151 1 1 43 ASN C C -7.151 10.135 -1.057 1.00 . A A . 45 ASN C 1 1 3 2152 1 1 43 ASN CA C -8.337 9.639 -0.229 1.00 . A A . 45 ASN CA 1 1 3 2153 1 1 43 ASN CB C -8.868 10.785 0.635 1.00 . A A . 45 ASN CB 1 1 3 2154 1 1 43 ASN CG C -9.964 11.534 -0.125 1.00 . A A . 45 ASN CG 1 1 3 2155 1 1 43 ASN H H -8.183 7.602 0.458 1.00 . A A . 45 ASN H 1 1 3 2156 1 1 43 ASN HA H -9.120 9.294 -0.889 1.00 . A A . 45 ASN HA 1 1 3 2157 1 1 43 ASN HB2 H -9.272 10.387 1.554 1.00 . A A . 45 ASN HB2 1 1 3 2158 1 1 43 ASN HB3 H -8.062 11.467 0.864 1.00 . A A . 45 ASN HB3 1 1 3 2159 1 1 43 ASN HD21 H -8.826 13.120 -0.491 1.00 . A A . 45 ASN HD21 1 1 3 2160 1 1 43 ASN HD22 H -10.407 13.206 -1.102 1.00 . A A . 45 ASN HD22 1 1 3 2161 1 1 43 ASN N N -7.893 8.519 0.648 1.00 . A A . 45 ASN N 1 1 3 2162 1 1 43 ASN ND2 N -9.711 12.718 -0.613 1.00 . A A . 45 ASN ND2 1 1 3 2163 1 1 43 ASN O O -7.210 11.175 -1.682 1.00 . A A . 45 ASN O 1 1 3 2164 1 1 43 ASN OD1 O -11.064 11.038 -0.274 1.00 . A A . 45 ASN OD1 1 1 3 2165 1 1 44 GLY C C -3.827 10.395 -0.894 1.00 . A A . 46 GLY C 1 1 3 2166 1 1 44 GLY CA C -4.881 9.828 -1.845 1.00 . A A . 46 GLY CA 1 1 3 2167 1 1 44 GLY H H -6.047 8.566 -0.547 1.00 . A A . 46 GLY H 1 1 3 2168 1 1 44 GLY HA2 H -4.473 8.979 -2.375 1.00 . A A . 46 GLY HA2 1 1 3 2169 1 1 44 GLY HA3 H -5.169 10.589 -2.552 1.00 . A A . 46 GLY HA3 1 1 3 2170 1 1 44 GLY N N -6.074 9.400 -1.062 1.00 . A A . 46 GLY N 1 1 3 2171 1 1 44 GLY O O -2.823 10.935 -1.313 1.00 . A A . 46 GLY O 1 1 3 2172 1 1 45 THR C C -1.992 9.761 1.645 1.00 . A A . 47 THR C 1 1 3 2173 1 1 45 THR CA C -3.068 10.814 1.367 1.00 . A A . 47 THR CA 1 1 3 2174 1 1 45 THR CB C -3.797 11.160 2.666 1.00 . A A . 47 THR CB 1 1 3 2175 1 1 45 THR CG2 C -3.095 12.332 3.344 1.00 . A A . 47 THR CG2 1 1 3 2176 1 1 45 THR H H -4.867 9.847 0.709 1.00 . A A . 47 THR H 1 1 3 2177 1 1 45 THR HA H -2.607 11.704 0.965 1.00 . A A . 47 THR HA 1 1 3 2178 1 1 45 THR HB H -3.787 10.308 3.327 1.00 . A A . 47 THR HB 1 1 3 2179 1 1 45 THR HG1 H -5.177 12.472 2.271 1.00 . A A . 47 THR HG1 1 1 3 2180 1 1 45 THR HG21 H -2.143 12.002 3.733 1.00 . A A . 47 THR HG21 1 1 3 2181 1 1 45 THR HG22 H -3.709 12.700 4.152 1.00 . A A . 47 THR HG22 1 1 3 2182 1 1 45 THR HG23 H -2.937 13.120 2.623 1.00 . A A . 47 THR HG23 1 1 3 2183 1 1 45 THR N N -4.050 10.280 0.389 1.00 . A A . 47 THR N 1 1 3 2184 1 1 45 THR O O -1.260 9.852 2.611 1.00 . A A . 47 THR O 1 1 3 2185 1 1 45 THR OG1 O -5.140 11.518 2.372 1.00 . A A . 47 THR OG1 1 1 3 2186 1 1 46 LEU C C -0.091 7.454 -0.273 1.00 . A A . 48 LEU C 1 1 3 2187 1 1 46 LEU CA C -0.849 7.716 1.030 1.00 . A A . 48 LEU CA 1 1 3 2188 1 1 46 LEU CB C -1.517 6.423 1.502 1.00 . A A . 48 LEU CB 1 1 3 2189 1 1 46 LEU CD1 C -0.296 6.704 3.660 1.00 . A A . 48 LEU CD1 1 1 3 2190 1 1 46 LEU CD2 C -1.314 4.494 3.076 1.00 . A A . 48 LEU CD2 1 1 3 2191 1 1 46 LEU CG C -0.609 5.733 2.519 1.00 . A A . 48 LEU CG 1 1 3 2192 1 1 46 LEU H H -2.481 8.709 0.031 1.00 . A A . 48 LEU H 1 1 3 2193 1 1 46 LEU HA H -0.155 8.057 1.783 1.00 . A A . 48 LEU HA 1 1 3 2194 1 1 46 LEU HB2 H -2.466 6.654 1.962 1.00 . A A . 48 LEU HB2 1 1 3 2195 1 1 46 LEU HB3 H -1.673 5.767 0.659 1.00 . A A . 48 LEU HB3 1 1 3 2196 1 1 46 LEU HD11 H -0.557 6.249 4.603 1.00 . A A . 48 LEU HD11 1 1 3 2197 1 1 46 LEU HD12 H -0.867 7.611 3.527 1.00 . A A . 48 LEU HD12 1 1 3 2198 1 1 46 LEU HD13 H 0.758 6.940 3.654 1.00 . A A . 48 LEU HD13 1 1 3 2199 1 1 46 LEU HD21 H -1.984 4.094 2.330 1.00 . A A . 48 LEU HD21 1 1 3 2200 1 1 46 LEU HD22 H -1.877 4.765 3.957 1.00 . A A . 48 LEU HD22 1 1 3 2201 1 1 46 LEU HD23 H -0.578 3.746 3.337 1.00 . A A . 48 LEU HD23 1 1 3 2202 1 1 46 LEU HG H 0.313 5.438 2.036 1.00 . A A . 48 LEU HG 1 1 3 2203 1 1 46 LEU N N -1.885 8.765 0.806 1.00 . A A . 48 LEU N 1 1 3 2204 1 1 46 LEU O O -0.626 7.607 -1.353 1.00 . A A . 48 LEU O 1 1 3 2205 1 1 47 THR C C 3.010 5.746 -1.164 1.00 . A A . 49 THR C 1 1 3 2206 1 1 47 THR CA C 1.946 6.816 -1.421 1.00 . A A . 49 THR CA 1 1 3 2207 1 1 47 THR CB C 2.638 8.111 -1.867 1.00 . A A . 49 THR CB 1 1 3 2208 1 1 47 THR CG2 C 1.863 9.326 -1.345 1.00 . A A . 49 THR CG2 1 1 3 2209 1 1 47 THR H H 1.572 6.961 0.700 1.00 . A A . 49 THR H 1 1 3 2210 1 1 47 THR HA H 1.286 6.479 -2.204 1.00 . A A . 49 THR HA 1 1 3 2211 1 1 47 THR HB H 2.669 8.148 -2.945 1.00 . A A . 49 THR HB 1 1 3 2212 1 1 47 THR HG1 H 4.504 8.653 -1.958 1.00 . A A . 49 THR HG1 1 1 3 2213 1 1 47 THR HG21 H 2.293 10.228 -1.753 1.00 . A A . 49 THR HG21 1 1 3 2214 1 1 47 THR HG22 H 1.922 9.355 -0.267 1.00 . A A . 49 THR HG22 1 1 3 2215 1 1 47 THR HG23 H 0.829 9.253 -1.648 1.00 . A A . 49 THR HG23 1 1 3 2216 1 1 47 THR N N 1.156 7.072 -0.180 1.00 . A A . 49 THR N 1 1 3 2217 1 1 47 THR O O 2.885 4.923 -0.278 1.00 . A A . 49 THR O 1 1 3 2218 1 1 47 THR OG1 O 3.964 8.138 -1.355 1.00 . A A . 49 THR OG1 1 1 3 2219 1 1 48 LEU C C 6.437 5.530 -1.404 1.00 . A A . 50 LEU C 1 1 3 2220 1 1 48 LEU CA C 5.163 4.778 -1.809 1.00 . A A . 50 LEU CA 1 1 3 2221 1 1 48 LEU CB C 5.378 4.089 -3.164 1.00 . A A . 50 LEU CB 1 1 3 2222 1 1 48 LEU CD1 C 5.857 2.058 -1.776 1.00 . A A . 50 LEU CD1 1 1 3 2223 1 1 48 LEU CD2 C 6.160 1.986 -4.252 1.00 . A A . 50 LEU CD2 1 1 3 2224 1 1 48 LEU CG C 6.283 2.864 -3.006 1.00 . A A . 50 LEU CG 1 1 3 2225 1 1 48 LEU H H 4.106 6.449 -2.647 1.00 . A A . 50 LEU H 1 1 3 2226 1 1 48 LEU HA H 4.912 4.041 -1.056 1.00 . A A . 50 LEU HA 1 1 3 2227 1 1 48 LEU HB2 H 4.423 3.777 -3.562 1.00 . A A . 50 LEU HB2 1 1 3 2228 1 1 48 LEU HB3 H 5.839 4.785 -3.848 1.00 . A A . 50 LEU HB3 1 1 3 2229 1 1 48 LEU HD11 H 6.016 1.006 -1.964 1.00 . A A . 50 LEU HD11 1 1 3 2230 1 1 48 LEU HD12 H 4.810 2.235 -1.574 1.00 . A A . 50 LEU HD12 1 1 3 2231 1 1 48 LEU HD13 H 6.445 2.364 -0.924 1.00 . A A . 50 LEU HD13 1 1 3 2232 1 1 48 LEU HD21 H 7.007 1.318 -4.307 1.00 . A A . 50 LEU HD21 1 1 3 2233 1 1 48 LEU HD22 H 6.136 2.610 -5.133 1.00 . A A . 50 LEU HD22 1 1 3 2234 1 1 48 LEU HD23 H 5.249 1.408 -4.197 1.00 . A A . 50 LEU HD23 1 1 3 2235 1 1 48 LEU HG H 7.308 3.188 -2.892 1.00 . A A . 50 LEU HG 1 1 3 2236 1 1 48 LEU N N 4.053 5.767 -1.950 1.00 . A A . 50 LEU N 1 1 3 2237 1 1 48 LEU O O 6.442 6.741 -1.316 1.00 . A A . 50 LEU O 1 1 3 2238 1 1 49 SER C C 10.000 4.829 -1.287 1.00 . A A . 51 SER C 1 1 3 2239 1 1 49 SER CA C 8.762 5.555 -0.754 1.00 . A A . 51 SER CA 1 1 3 2240 1 1 49 SER CB C 8.844 5.633 0.770 1.00 . A A . 51 SER CB 1 1 3 2241 1 1 49 SER H H 7.510 3.863 -1.221 1.00 . A A . 51 SER H 1 1 3 2242 1 1 49 SER HA H 8.738 6.554 -1.160 1.00 . A A . 51 SER HA 1 1 3 2243 1 1 49 SER HB2 H 7.883 5.905 1.173 1.00 . A A . 51 SER HB2 1 1 3 2244 1 1 49 SER HB3 H 9.137 4.669 1.164 1.00 . A A . 51 SER HB3 1 1 3 2245 1 1 49 SER HG H 10.550 6.169 1.537 1.00 . A A . 51 SER HG 1 1 3 2246 1 1 49 SER N N 7.517 4.839 -1.153 1.00 . A A . 51 SER N 1 1 3 2247 1 1 49 SER O O 10.976 5.453 -1.657 1.00 . A A . 51 SER O 1 1 3 2248 1 1 49 SER OG O 9.801 6.618 1.139 1.00 . A A . 51 SER OG 1 1 3 2249 1 1 50 HIS C C 11.044 1.303 -1.472 1.00 . A A . 52 HIS C 1 1 3 2250 1 1 50 HIS CA C 11.177 2.790 -1.830 1.00 . A A . 52 HIS CA 1 1 3 2251 1 1 50 HIS CB C 12.449 3.410 -1.200 1.00 . A A . 52 HIS CB 1 1 3 2252 1 1 50 HIS CD2 C 14.419 1.673 -0.986 1.00 . A A . 52 HIS CD2 1 1 3 2253 1 1 50 HIS CE1 C 13.994 0.959 1.015 1.00 . A A . 52 HIS CE1 1 1 3 2254 1 1 50 HIS CG C 13.314 2.358 -0.546 1.00 . A A . 52 HIS CG 1 1 3 2255 1 1 50 HIS H H 9.197 3.027 -1.024 1.00 . A A . 52 HIS H 1 1 3 2256 1 1 50 HIS HA H 11.227 2.892 -2.903 1.00 . A A . 52 HIS HA 1 1 3 2257 1 1 50 HIS HB2 H 13.021 3.903 -1.971 1.00 . A A . 52 HIS HB2 1 1 3 2258 1 1 50 HIS HB3 H 12.155 4.139 -0.458 1.00 . A A . 52 HIS HB3 1 1 3 2259 1 1 50 HIS HD1 H 12.336 2.178 1.324 1.00 . A A . 52 HIS HD1 1 1 3 2260 1 1 50 HIS HD2 H 14.885 1.798 -1.953 1.00 . A A . 52 HIS HD2 1 1 3 2261 1 1 50 HIS HE1 H 14.040 0.410 1.943 1.00 . A A . 52 HIS HE1 1 1 3 2262 1 1 50 HIS N N 9.984 3.524 -1.326 1.00 . A A . 52 HIS N 1 1 3 2263 1 1 50 HIS ND1 N 13.063 1.887 0.734 1.00 . A A . 52 HIS ND1 1 1 3 2264 1 1 50 HIS NE2 N 14.848 0.791 0.000 1.00 . A A . 52 HIS NE2 1 1 3 2265 1 1 50 HIS O O 11.129 0.918 -0.323 1.00 . A A . 52 HIS O 1 1 3 2266 1 1 51 PHE C C 11.812 -1.411 -1.187 1.00 . A A . 53 PHE C 1 1 3 2267 1 1 51 PHE CA C 10.715 -0.986 -2.169 1.00 . A A . 53 PHE CA 1 1 3 2268 1 1 51 PHE CB C 10.876 -1.767 -3.475 1.00 . A A . 53 PHE CB 1 1 3 2269 1 1 51 PHE CD1 C 8.585 -1.488 -4.490 1.00 . A A . 53 PHE CD1 1 1 3 2270 1 1 51 PHE CD2 C 10.472 -0.397 -5.553 1.00 . A A . 53 PHE CD2 1 1 3 2271 1 1 51 PHE CE1 C 7.732 -0.970 -5.472 1.00 . A A . 53 PHE CE1 1 1 3 2272 1 1 51 PHE CE2 C 9.619 0.120 -6.535 1.00 . A A . 53 PHE CE2 1 1 3 2273 1 1 51 PHE CG C 9.955 -1.201 -4.530 1.00 . A A . 53 PHE CG 1 1 3 2274 1 1 51 PHE CZ C 8.249 -0.165 -6.495 1.00 . A A . 53 PHE CZ 1 1 3 2275 1 1 51 PHE H H 10.777 0.796 -3.365 1.00 . A A . 53 PHE H 1 1 3 2276 1 1 51 PHE HA H 9.746 -1.191 -1.740 1.00 . A A . 53 PHE HA 1 1 3 2277 1 1 51 PHE HB2 H 11.898 -1.695 -3.814 1.00 . A A . 53 PHE HB2 1 1 3 2278 1 1 51 PHE HB3 H 10.628 -2.799 -3.303 1.00 . A A . 53 PHE HB3 1 1 3 2279 1 1 51 PHE HD1 H 8.187 -2.107 -3.702 1.00 . A A . 53 PHE HD1 1 1 3 2280 1 1 51 PHE HD2 H 11.529 -0.176 -5.584 1.00 . A A . 53 PHE HD2 1 1 3 2281 1 1 51 PHE HE1 H 6.675 -1.190 -5.440 1.00 . A A . 53 PHE HE1 1 1 3 2282 1 1 51 PHE HE2 H 10.017 0.742 -7.324 1.00 . A A . 53 PHE HE2 1 1 3 2283 1 1 51 PHE HZ H 7.592 0.233 -7.252 1.00 . A A . 53 PHE HZ 1 1 3 2284 1 1 51 PHE N N 10.842 0.468 -2.449 1.00 . A A . 53 PHE N 1 1 3 2285 1 1 51 PHE O O 12.950 -1.000 -1.298 1.00 . A A . 53 PHE O 1 1 3 2286 1 1 52 GLY C C 12.084 -2.249 2.165 1.00 . A A . 54 GLY C 1 1 3 2287 1 1 52 GLY CA C 12.509 -2.677 0.759 1.00 . A A . 54 GLY CA 1 1 3 2288 1 1 52 GLY H H 10.561 -2.550 -0.151 1.00 . A A . 54 GLY H 1 1 3 2289 1 1 52 GLY HA2 H 12.606 -3.752 0.719 1.00 . A A . 54 GLY HA2 1 1 3 2290 1 1 52 GLY HA3 H 13.458 -2.220 0.520 1.00 . A A . 54 GLY HA3 1 1 3 2291 1 1 52 GLY N N 11.482 -2.230 -0.226 1.00 . A A . 54 GLY N 1 1 3 2292 1 1 52 GLY O O 11.773 -1.098 2.401 1.00 . A A . 54 GLY O 1 1 3 2293 1 1 53 LYS C C 12.334 -1.474 4.877 1.00 . A A . 55 LYS C 1 1 3 2294 1 1 53 LYS CA C 11.657 -2.789 4.488 1.00 . A A . 55 LYS CA 1 1 3 2295 1 1 53 LYS CB C 12.079 -3.893 5.465 1.00 . A A . 55 LYS CB 1 1 3 2296 1 1 53 LYS CD C 13.951 -3.274 7.002 1.00 . A A . 55 LYS CD 1 1 3 2297 1 1 53 LYS CE C 14.435 -4.381 7.943 1.00 . A A . 55 LYS CE 1 1 3 2298 1 1 53 LYS CG C 13.599 -3.876 5.640 1.00 . A A . 55 LYS CG 1 1 3 2299 1 1 53 LYS H H 12.318 -4.084 2.895 1.00 . A A . 55 LYS H 1 1 3 2300 1 1 53 LYS HA H 10.586 -2.665 4.527 1.00 . A A . 55 LYS HA 1 1 3 2301 1 1 53 LYS HB2 H 11.605 -3.727 6.421 1.00 . A A . 55 LYS HB2 1 1 3 2302 1 1 53 LYS HB3 H 11.775 -4.853 5.075 1.00 . A A . 55 LYS HB3 1 1 3 2303 1 1 53 LYS HD2 H 14.734 -2.539 6.879 1.00 . A A . 55 LYS HD2 1 1 3 2304 1 1 53 LYS HD3 H 13.077 -2.803 7.425 1.00 . A A . 55 LYS HD3 1 1 3 2305 1 1 53 LYS HE2 H 13.773 -5.232 7.870 1.00 . A A . 55 LYS HE2 1 1 3 2306 1 1 53 LYS HE3 H 15.436 -4.678 7.666 1.00 . A A . 55 LYS HE3 1 1 3 2307 1 1 53 LYS HG2 H 13.978 -4.888 5.583 1.00 . A A . 55 LYS HG2 1 1 3 2308 1 1 53 LYS HG3 H 14.046 -3.280 4.858 1.00 . A A . 55 LYS HG3 1 1 3 2309 1 1 53 LYS HZ1 H 14.052 -4.603 9.978 1.00 . A A . 55 LYS HZ1 1 1 3 2310 1 1 53 LYS HZ2 H 13.853 -3.016 9.404 1.00 . A A . 55 LYS HZ2 1 1 3 2311 1 1 53 LYS HZ3 H 15.413 -3.651 9.631 1.00 . A A . 55 LYS HZ3 1 1 3 2312 1 1 53 LYS N N 12.065 -3.160 3.102 1.00 . A A . 55 LYS N 1 1 3 2313 1 1 53 LYS NZ N 14.438 -3.875 9.345 1.00 . A A . 55 LYS NZ 1 1 3 2314 1 1 53 LYS O O 13.497 -1.259 4.595 1.00 . A A . 55 LYS O 1 1 3 2315 1 1 54 CYS C C 13.156 0.488 7.118 1.00 . A A . 56 CYS C 1 1 3 2316 1 1 54 CYS CA C 12.238 0.710 5.913 1.00 . A A . 56 CYS CA 1 1 3 2317 1 1 54 CYS CB C 11.145 1.717 6.282 1.00 . A A . 56 CYS CB 1 1 3 2318 1 1 54 CYS H H 10.679 -0.775 5.735 1.00 . A A . 56 CYS H 1 1 3 2319 1 1 54 CYS HA H 12.818 1.097 5.086 1.00 . A A . 56 CYS HA 1 1 3 2320 1 1 54 CYS HB2 H 10.813 1.533 7.293 1.00 . A A . 56 CYS HB2 1 1 3 2321 1 1 54 CYS HB3 H 11.541 2.720 6.212 1.00 . A A . 56 CYS HB3 1 1 3 2322 1 1 54 CYS N N 11.619 -0.587 5.517 1.00 . A A . 56 CYS N 1 1 3 2323 1 1 54 CYS O O 13.857 1.417 7.483 1.00 . A A . 56 CYS O 1 1 3 2324 1 1 54 CYS OXT O 13.146 -0.609 7.651 1.00 . A A . 56 CYS OXT 1 1 3 2325 1 1 54 CYS SG S 9.747 1.541 5.146 1.00 . A A . 56 CYS SG 1 1 4 2326 1 1 1 ALA C C 8.414 5.392 -9.076 1.00 . A A . 3 ALA C 1 1 4 2327 1 1 1 ALA CA C 9.604 5.834 -9.930 1.00 . A A . 3 ALA CA 1 1 4 2328 1 1 1 ALA CB C 10.028 4.690 -10.854 1.00 . A A . 3 ALA CB 1 1 4 2329 1 1 1 ALA H1 H 11.242 5.342 -8.741 1.00 . A A . 3 ALA H1 1 1 4 2330 1 1 1 ALA H2 H 10.378 6.702 -8.201 1.00 . A A . 3 ALA H2 1 1 4 2331 1 1 1 ALA H3 H 11.399 6.821 -9.555 1.00 . A A . 3 ALA H3 1 1 4 2332 1 1 1 ALA HA H 9.322 6.691 -10.524 1.00 . A A . 3 ALA HA 1 1 4 2333 1 1 1 ALA HB1 H 10.780 4.090 -10.363 1.00 . A A . 3 ALA HB1 1 1 4 2334 1 1 1 ALA HB2 H 10.433 5.097 -11.767 1.00 . A A . 3 ALA HB2 1 1 4 2335 1 1 1 ALA HB3 H 9.170 4.076 -11.082 1.00 . A A . 3 ALA HB3 1 1 4 2336 1 1 1 ALA N N 10.742 6.203 -9.040 1.00 . A A . 3 ALA N 1 1 4 2337 1 1 1 ALA O O 8.426 4.335 -8.476 1.00 . A A . 3 ALA O 1 1 4 2338 1 1 2 VAL C C 4.969 5.716 -9.109 1.00 . A A . 4 VAL C 1 1 4 2339 1 1 2 VAL CA C 6.196 5.816 -8.203 1.00 . A A . 4 VAL CA 1 1 4 2340 1 1 2 VAL CB C 5.954 6.882 -7.132 1.00 . A A . 4 VAL CB 1 1 4 2341 1 1 2 VAL CG1 C 5.069 6.306 -6.026 1.00 . A A . 4 VAL CG1 1 1 4 2342 1 1 2 VAL CG2 C 7.294 7.318 -6.538 1.00 . A A . 4 VAL CG2 1 1 4 2343 1 1 2 VAL H H 7.395 7.040 -9.509 1.00 . A A . 4 VAL H 1 1 4 2344 1 1 2 VAL HA H 6.371 4.862 -7.729 1.00 . A A . 4 VAL HA 1 1 4 2345 1 1 2 VAL HB H 5.462 7.734 -7.579 1.00 . A A . 4 VAL HB 1 1 4 2346 1 1 2 VAL HG11 H 5.605 5.525 -5.506 1.00 . A A . 4 VAL HG11 1 1 4 2347 1 1 2 VAL HG12 H 4.169 5.896 -6.462 1.00 . A A . 4 VAL HG12 1 1 4 2348 1 1 2 VAL HG13 H 4.808 7.089 -5.330 1.00 . A A . 4 VAL HG13 1 1 4 2349 1 1 2 VAL HG21 H 7.834 6.449 -6.188 1.00 . A A . 4 VAL HG21 1 1 4 2350 1 1 2 VAL HG22 H 7.120 7.990 -5.710 1.00 . A A . 4 VAL HG22 1 1 4 2351 1 1 2 VAL HG23 H 7.877 7.822 -7.294 1.00 . A A . 4 VAL HG23 1 1 4 2352 1 1 2 VAL N N 7.385 6.192 -9.018 1.00 . A A . 4 VAL N 1 1 4 2353 1 1 2 VAL O O 4.631 6.645 -9.819 1.00 . A A . 4 VAL O 1 1 4 2354 1 1 3 SER C C 2.047 3.610 -9.205 1.00 . A A . 5 SER C 1 1 4 2355 1 1 3 SER CA C 3.091 4.440 -9.951 1.00 . A A . 5 SER CA 1 1 4 2356 1 1 3 SER CB C 3.477 3.728 -11.247 1.00 . A A . 5 SER CB 1 1 4 2357 1 1 3 SER H H 4.586 3.863 -8.512 1.00 . A A . 5 SER H 1 1 4 2358 1 1 3 SER HA H 2.682 5.413 -10.181 1.00 . A A . 5 SER HA 1 1 4 2359 1 1 3 SER HB2 H 3.957 4.424 -11.914 1.00 . A A . 5 SER HB2 1 1 4 2360 1 1 3 SER HB3 H 4.160 2.919 -11.022 1.00 . A A . 5 SER HB3 1 1 4 2361 1 1 3 SER HG H 2.463 2.298 -12.091 1.00 . A A . 5 SER HG 1 1 4 2362 1 1 3 SER N N 4.298 4.599 -9.092 1.00 . A A . 5 SER N 1 1 4 2363 1 1 3 SER O O 2.258 2.451 -8.908 1.00 . A A . 5 SER O 1 1 4 2364 1 1 3 SER OG O 2.304 3.217 -11.867 1.00 . A A . 5 SER OG 1 1 4 2365 1 1 4 VAL C C -1.506 3.802 -8.725 1.00 . A A . 6 VAL C 1 1 4 2366 1 1 4 VAL CA C -0.131 3.439 -8.164 1.00 . A A . 6 VAL CA 1 1 4 2367 1 1 4 VAL CB C -0.075 3.798 -6.679 1.00 . A A . 6 VAL CB 1 1 4 2368 1 1 4 VAL CG1 C -0.216 5.313 -6.516 1.00 . A A . 6 VAL CG1 1 1 4 2369 1 1 4 VAL CG2 C -1.219 3.097 -5.941 1.00 . A A . 6 VAL CG2 1 1 4 2370 1 1 4 VAL H H 0.775 5.132 -9.142 1.00 . A A . 6 VAL H 1 1 4 2371 1 1 4 VAL HA H 0.037 2.379 -8.284 1.00 . A A . 6 VAL HA 1 1 4 2372 1 1 4 VAL HB H 0.871 3.478 -6.268 1.00 . A A . 6 VAL HB 1 1 4 2373 1 1 4 VAL HG11 H 0.727 5.728 -6.192 1.00 . A A . 6 VAL HG11 1 1 4 2374 1 1 4 VAL HG12 H -0.976 5.527 -5.780 1.00 . A A . 6 VAL HG12 1 1 4 2375 1 1 4 VAL HG13 H -0.496 5.752 -7.462 1.00 . A A . 6 VAL HG13 1 1 4 2376 1 1 4 VAL HG21 H -1.579 3.736 -5.149 1.00 . A A . 6 VAL HG21 1 1 4 2377 1 1 4 VAL HG22 H -0.861 2.169 -5.521 1.00 . A A . 6 VAL HG22 1 1 4 2378 1 1 4 VAL HG23 H -2.023 2.894 -6.633 1.00 . A A . 6 VAL HG23 1 1 4 2379 1 1 4 VAL N N 0.923 4.195 -8.895 1.00 . A A . 6 VAL N 1 1 4 2380 1 1 4 VAL O O -2.198 4.650 -8.197 1.00 . A A . 6 VAL O 1 1 4 2381 1 1 5 ASP C C -4.273 2.473 -9.821 1.00 . A A . 7 ASP C 1 1 4 2382 1 1 5 ASP CA C -3.249 3.466 -10.372 1.00 . A A . 7 ASP CA 1 1 4 2383 1 1 5 ASP CB C -3.183 3.337 -11.896 1.00 . A A . 7 ASP CB 1 1 4 2384 1 1 5 ASP CG C -2.519 2.011 -12.269 1.00 . A A . 7 ASP CG 1 1 4 2385 1 1 5 ASP H H -1.343 2.477 -10.194 1.00 . A A . 7 ASP H 1 1 4 2386 1 1 5 ASP HA H -3.540 4.471 -10.105 1.00 . A A . 7 ASP HA 1 1 4 2387 1 1 5 ASP HB2 H -4.184 3.367 -12.303 1.00 . A A . 7 ASP HB2 1 1 4 2388 1 1 5 ASP HB3 H -2.605 4.154 -12.302 1.00 . A A . 7 ASP HB3 1 1 4 2389 1 1 5 ASP N N -1.913 3.162 -9.786 1.00 . A A . 7 ASP N 1 1 4 2390 1 1 5 ASP O O -4.519 1.434 -10.401 1.00 . A A . 7 ASP O 1 1 4 2391 1 1 5 ASP OD1 O -3.216 1.010 -12.302 1.00 . A A . 7 ASP OD1 1 1 4 2392 1 1 5 ASP OD2 O -1.325 2.018 -12.518 1.00 . A A . 7 ASP OD2 1 1 4 2393 1 1 6 CYS C C -7.117 2.614 -7.682 1.00 . A A . 8 CYS C 1 1 4 2394 1 1 6 CYS CA C -5.869 1.842 -8.113 1.00 . A A . 8 CYS CA 1 1 4 2395 1 1 6 CYS CB C -5.262 1.149 -6.892 1.00 . A A . 8 CYS CB 1 1 4 2396 1 1 6 CYS H H -4.654 3.618 -8.243 1.00 . A A . 8 CYS H 1 1 4 2397 1 1 6 CYS HA H -6.141 1.099 -8.849 1.00 . A A . 8 CYS HA 1 1 4 2398 1 1 6 CYS HB2 H -4.862 1.892 -6.218 1.00 . A A . 8 CYS HB2 1 1 4 2399 1 1 6 CYS HB3 H -6.026 0.578 -6.386 1.00 . A A . 8 CYS HB3 1 1 4 2400 1 1 6 CYS N N -4.869 2.778 -8.700 1.00 . A A . 8 CYS N 1 1 4 2401 1 1 6 CYS O O -7.552 2.522 -6.549 1.00 . A A . 8 CYS O 1 1 4 2402 1 1 6 CYS SG S -3.933 0.041 -7.422 1.00 . A A . 8 CYS SG 1 1 4 2403 1 1 7 SER C C -10.168 3.200 -8.235 1.00 . A A . 9 SER C 1 1 4 2404 1 1 7 SER CA C -8.943 4.122 -8.205 1.00 . A A . 9 SER CA 1 1 4 2405 1 1 7 SER CB C -9.144 5.275 -9.190 1.00 . A A . 9 SER CB 1 1 4 2406 1 1 7 SER H H -7.361 3.411 -9.487 1.00 . A A . 9 SER H 1 1 4 2407 1 1 7 SER HA H -8.825 4.520 -7.208 1.00 . A A . 9 SER HA 1 1 4 2408 1 1 7 SER HB2 H -10.021 5.837 -8.916 1.00 . A A . 9 SER HB2 1 1 4 2409 1 1 7 SER HB3 H -8.280 5.925 -9.160 1.00 . A A . 9 SER HB3 1 1 4 2410 1 1 7 SER HG H -9.200 5.470 -11.125 1.00 . A A . 9 SER HG 1 1 4 2411 1 1 7 SER N N -7.715 3.359 -8.574 1.00 . A A . 9 SER N 1 1 4 2412 1 1 7 SER O O -11.290 3.648 -8.367 1.00 . A A . 9 SER O 1 1 4 2413 1 1 7 SER OG O -9.313 4.751 -10.500 1.00 . A A . 9 SER OG 1 1 4 2414 1 1 8 GLU C C -10.620 -0.360 -7.521 1.00 . A A . 10 GLU C 1 1 4 2415 1 1 8 GLU CA C -11.099 0.965 -8.111 1.00 . A A . 10 GLU CA 1 1 4 2416 1 1 8 GLU CB C -11.578 0.743 -9.548 1.00 . A A . 10 GLU CB 1 1 4 2417 1 1 8 GLU CD C -13.947 1.004 -8.791 1.00 . A A . 10 GLU CD 1 1 4 2418 1 1 8 GLU CG C -12.885 1.505 -9.772 1.00 . A A . 10 GLU CG 1 1 4 2419 1 1 8 GLU H H -9.056 1.583 -7.991 1.00 . A A . 10 GLU H 1 1 4 2420 1 1 8 GLU HA H -11.906 1.359 -7.513 1.00 . A A . 10 GLU HA 1 1 4 2421 1 1 8 GLU HB2 H -10.828 1.101 -10.239 1.00 . A A . 10 GLU HB2 1 1 4 2422 1 1 8 GLU HB3 H -11.746 -0.311 -9.712 1.00 . A A . 10 GLU HB3 1 1 4 2423 1 1 8 GLU HG2 H -12.716 2.559 -9.613 1.00 . A A . 10 GLU HG2 1 1 4 2424 1 1 8 GLU HG3 H -13.227 1.343 -10.784 1.00 . A A . 10 GLU HG3 1 1 4 2425 1 1 8 GLU N N -9.960 1.920 -8.103 1.00 . A A . 10 GLU N 1 1 4 2426 1 1 8 GLU O O -11.137 -1.414 -7.837 1.00 . A A . 10 GLU O 1 1 4 2427 1 1 8 GLU OE1 O -14.217 -0.185 -8.798 1.00 . A A . 10 GLU OE1 1 1 4 2428 1 1 8 GLU OE2 O -14.472 1.819 -8.050 1.00 . A A . 10 GLU OE2 1 1 4 2429 1 1 9 TYR C C -9.165 -1.509 -4.535 1.00 . A A . 11 TYR C 1 1 4 2430 1 1 9 TYR CA C -9.108 -1.580 -6.067 1.00 . A A . 11 TYR CA 1 1 4 2431 1 1 9 TYR CB C -7.658 -1.790 -6.506 1.00 . A A . 11 TYR CB 1 1 4 2432 1 1 9 TYR CD1 C -7.966 -3.026 -8.681 1.00 . A A . 11 TYR CD1 1 1 4 2433 1 1 9 TYR CD2 C -7.060 -4.223 -6.777 1.00 . A A . 11 TYR CD2 1 1 4 2434 1 1 9 TYR CE1 C -7.873 -4.189 -9.456 1.00 . A A . 11 TYR CE1 1 1 4 2435 1 1 9 TYR CE2 C -6.967 -5.385 -7.551 1.00 . A A . 11 TYR CE2 1 1 4 2436 1 1 9 TYR CG C -7.559 -3.044 -7.342 1.00 . A A . 11 TYR CG 1 1 4 2437 1 1 9 TYR CZ C -7.373 -5.368 -8.891 1.00 . A A . 11 TYR CZ 1 1 4 2438 1 1 9 TYR H H -9.216 0.547 -6.435 1.00 . A A . 11 TYR H 1 1 4 2439 1 1 9 TYR HA H -9.707 -2.411 -6.410 1.00 . A A . 11 TYR HA 1 1 4 2440 1 1 9 TYR HB2 H -7.332 -0.941 -7.090 1.00 . A A . 11 TYR HB2 1 1 4 2441 1 1 9 TYR HB3 H -7.028 -1.890 -5.634 1.00 . A A . 11 TYR HB3 1 1 4 2442 1 1 9 TYR HD1 H -8.352 -2.116 -9.117 1.00 . A A . 11 TYR HD1 1 1 4 2443 1 1 9 TYR HD2 H -6.747 -4.236 -5.743 1.00 . A A . 11 TYR HD2 1 1 4 2444 1 1 9 TYR HE1 H -8.186 -4.176 -10.490 1.00 . A A . 11 TYR HE1 1 1 4 2445 1 1 9 TYR HE2 H -6.581 -6.295 -7.115 1.00 . A A . 11 TYR HE2 1 1 4 2446 1 1 9 TYR HH H -7.146 -7.256 -9.059 1.00 . A A . 11 TYR HH 1 1 4 2447 1 1 9 TYR N N -9.626 -0.316 -6.669 1.00 . A A . 11 TYR N 1 1 4 2448 1 1 9 TYR O O -8.139 -1.513 -3.882 1.00 . A A . 11 TYR O 1 1 4 2449 1 1 9 TYR OH O -7.280 -6.513 -9.653 1.00 . A A . 11 TYR OH 1 1 4 2450 1 1 10 PRO C C -10.391 -2.811 -1.942 1.00 . A A . 12 PRO C 1 1 4 2451 1 1 10 PRO CA C -10.583 -1.416 -2.549 1.00 . A A . 12 PRO CA 1 1 4 2452 1 1 10 PRO CB C -12.042 -0.974 -2.421 1.00 . A A . 12 PRO CB 1 1 4 2453 1 1 10 PRO CD C -11.602 -1.459 -4.806 1.00 . A A . 12 PRO CD 1 1 4 2454 1 1 10 PRO CG C -12.724 -1.348 -3.759 1.00 . A A . 12 PRO CG 1 1 4 2455 1 1 10 PRO HA H -9.931 -0.697 -2.082 1.00 . A A . 12 PRO HA 1 1 4 2456 1 1 10 PRO HB2 H -12.515 -1.494 -1.599 1.00 . A A . 12 PRO HB2 1 1 4 2457 1 1 10 PRO HB3 H -12.095 0.093 -2.271 1.00 . A A . 12 PRO HB3 1 1 4 2458 1 1 10 PRO HD2 H -11.698 -2.376 -5.371 1.00 . A A . 12 PRO HD2 1 1 4 2459 1 1 10 PRO HD3 H -11.615 -0.603 -5.460 1.00 . A A . 12 PRO HD3 1 1 4 2460 1 1 10 PRO HG2 H -13.236 -2.295 -3.658 1.00 . A A . 12 PRO HG2 1 1 4 2461 1 1 10 PRO HG3 H -13.419 -0.578 -4.049 1.00 . A A . 12 PRO HG3 1 1 4 2462 1 1 10 PRO N N -10.362 -1.466 -4.006 1.00 . A A . 12 PRO N 1 1 4 2463 1 1 10 PRO O O -11.224 -3.681 -2.095 1.00 . A A . 12 PRO O 1 1 4 2464 1 1 11 LYS C C -7.924 -4.264 0.360 1.00 . A A . 13 LYS C 1 1 4 2465 1 1 11 LYS CA C -9.066 -4.368 -0.651 1.00 . A A . 13 LYS CA 1 1 4 2466 1 1 11 LYS CB C -8.695 -5.366 -1.749 1.00 . A A . 13 LYS CB 1 1 4 2467 1 1 11 LYS CD C -8.840 -7.844 -2.027 1.00 . A A . 13 LYS CD 1 1 4 2468 1 1 11 LYS CE C -9.491 -9.055 -1.355 1.00 . A A . 13 LYS CE 1 1 4 2469 1 1 11 LYS CG C -9.625 -6.580 -1.677 1.00 . A A . 13 LYS CG 1 1 4 2470 1 1 11 LYS H H -8.642 -2.316 -1.146 1.00 . A A . 13 LYS H 1 1 4 2471 1 1 11 LYS HA H -9.964 -4.700 -0.149 1.00 . A A . 13 LYS HA 1 1 4 2472 1 1 11 LYS HB2 H -8.797 -4.892 -2.714 1.00 . A A . 13 LYS HB2 1 1 4 2473 1 1 11 LYS HB3 H -7.674 -5.689 -1.612 1.00 . A A . 13 LYS HB3 1 1 4 2474 1 1 11 LYS HD2 H -8.843 -7.984 -3.099 1.00 . A A . 13 LYS HD2 1 1 4 2475 1 1 11 LYS HD3 H -7.823 -7.746 -1.679 1.00 . A A . 13 LYS HD3 1 1 4 2476 1 1 11 LYS HE2 H -8.726 -9.671 -0.905 1.00 . A A . 13 LYS HE2 1 1 4 2477 1 1 11 LYS HE3 H -10.176 -8.717 -0.591 1.00 . A A . 13 LYS HE3 1 1 4 2478 1 1 11 LYS HG2 H -10.025 -6.668 -0.676 1.00 . A A . 13 LYS HG2 1 1 4 2479 1 1 11 LYS HG3 H -10.435 -6.455 -2.379 1.00 . A A . 13 LYS HG3 1 1 4 2480 1 1 11 LYS HZ1 H -10.343 -10.827 -2.037 1.00 . A A . 13 LYS HZ1 1 1 4 2481 1 1 11 LYS HZ2 H -9.702 -9.847 -3.269 1.00 . A A . 13 LYS HZ2 1 1 4 2482 1 1 11 LYS HZ3 H -11.171 -9.430 -2.524 1.00 . A A . 13 LYS HZ3 1 1 4 2483 1 1 11 LYS N N -9.304 -3.029 -1.259 1.00 . A A . 13 LYS N 1 1 4 2484 1 1 11 LYS NZ N -10.233 -9.849 -2.373 1.00 . A A . 13 LYS NZ 1 1 4 2485 1 1 11 LYS O O -6.763 -4.327 0.010 1.00 . A A . 13 LYS O 1 1 4 2486 1 1 12 CYS C C -6.848 -5.356 3.210 1.00 . A A . 14 CYS C 1 1 4 2487 1 1 12 CYS CA C -7.183 -3.974 2.646 1.00 . A A . 14 CYS CA 1 1 4 2488 1 1 12 CYS CB C -7.677 -3.063 3.770 1.00 . A A . 14 CYS CB 1 1 4 2489 1 1 12 CYS H H -9.190 -4.037 1.870 1.00 . A A . 14 CYS H 1 1 4 2490 1 1 12 CYS HA H -6.298 -3.543 2.201 1.00 . A A . 14 CYS HA 1 1 4 2491 1 1 12 CYS HB2 H -8.650 -3.397 4.103 1.00 . A A . 14 CYS HB2 1 1 4 2492 1 1 12 CYS HB3 H -6.981 -3.097 4.595 1.00 . A A . 14 CYS HB3 1 1 4 2493 1 1 12 CYS N N -8.247 -4.093 1.611 1.00 . A A . 14 CYS N 1 1 4 2494 1 1 12 CYS O O -6.517 -5.499 4.371 1.00 . A A . 14 CYS O 1 1 4 2495 1 1 12 CYS SG S -7.799 -1.367 3.151 1.00 . A A . 14 CYS SG 1 1 4 2496 1 1 13 ALA C C -6.000 -8.568 1.751 1.00 . A A . 15 ALA C 1 1 4 2497 1 1 13 ALA CA C -6.608 -7.745 2.890 1.00 . A A . 15 ALA CA 1 1 4 2498 1 1 13 ALA CB C -7.890 -8.422 3.381 1.00 . A A . 15 ALA CB 1 1 4 2499 1 1 13 ALA H H -7.192 -6.238 1.465 1.00 . A A . 15 ALA H 1 1 4 2500 1 1 13 ALA HA H -5.901 -7.680 3.704 1.00 . A A . 15 ALA HA 1 1 4 2501 1 1 13 ALA HB1 H -7.758 -9.493 3.371 1.00 . A A . 15 ALA HB1 1 1 4 2502 1 1 13 ALA HB2 H -8.710 -8.153 2.732 1.00 . A A . 15 ALA HB2 1 1 4 2503 1 1 13 ALA HB3 H -8.107 -8.095 4.388 1.00 . A A . 15 ALA HB3 1 1 4 2504 1 1 13 ALA N N -6.926 -6.375 2.399 1.00 . A A . 15 ALA N 1 1 4 2505 1 1 13 ALA O O -6.625 -9.465 1.221 1.00 . A A . 15 ALA O 1 1 4 2506 1 1 14 CYS C C -2.902 -9.759 0.774 1.00 . A A . 16 CYS C 1 1 4 2507 1 1 14 CYS CA C -4.150 -9.040 0.260 1.00 . A A . 16 CYS CA 1 1 4 2508 1 1 14 CYS CB C -3.750 -8.088 -0.865 1.00 . A A . 16 CYS CB 1 1 4 2509 1 1 14 CYS H H -4.298 -7.542 1.805 1.00 . A A . 16 CYS H 1 1 4 2510 1 1 14 CYS HA H -4.851 -9.768 -0.120 1.00 . A A . 16 CYS HA 1 1 4 2511 1 1 14 CYS HB2 H -2.886 -7.517 -0.563 1.00 . A A . 16 CYS HB2 1 1 4 2512 1 1 14 CYS HB3 H -3.512 -8.660 -1.749 1.00 . A A . 16 CYS HB3 1 1 4 2513 1 1 14 CYS N N -4.788 -8.271 1.367 1.00 . A A . 16 CYS N 1 1 4 2514 1 1 14 CYS O O -2.242 -9.308 1.690 1.00 . A A . 16 CYS O 1 1 4 2515 1 1 14 CYS SG S -5.120 -6.963 -1.221 1.00 . A A . 16 CYS SG 1 1 4 2516 1 1 15 THR C C -0.949 -12.594 -0.495 1.00 . A A . 17 THR C 1 1 4 2517 1 1 15 THR CA C -1.366 -11.632 0.619 1.00 . A A . 17 THR CA 1 1 4 2518 1 1 15 THR CB C -1.692 -12.428 1.886 1.00 . A A . 17 THR CB 1 1 4 2519 1 1 15 THR CG2 C -0.408 -12.680 2.679 1.00 . A A . 17 THR CG2 1 1 4 2520 1 1 15 THR H H -3.121 -11.210 -0.557 1.00 . A A . 17 THR H 1 1 4 2521 1 1 15 THR HA H -0.560 -10.942 0.823 1.00 . A A . 17 THR HA 1 1 4 2522 1 1 15 THR HB H -2.134 -13.374 1.614 1.00 . A A . 17 THR HB 1 1 4 2523 1 1 15 THR HG1 H -2.870 -12.243 3.421 1.00 . A A . 17 THR HG1 1 1 4 2524 1 1 15 THR HG21 H -0.458 -12.153 3.620 1.00 . A A . 17 THR HG21 1 1 4 2525 1 1 15 THR HG22 H 0.441 -12.325 2.113 1.00 . A A . 17 THR HG22 1 1 4 2526 1 1 15 THR HG23 H -0.301 -13.738 2.864 1.00 . A A . 17 THR HG23 1 1 4 2527 1 1 15 THR N N -2.574 -10.873 0.183 1.00 . A A . 17 THR N 1 1 4 2528 1 1 15 THR O O -0.373 -13.636 -0.248 1.00 . A A . 17 THR O 1 1 4 2529 1 1 15 THR OG1 O -2.606 -11.688 2.684 1.00 . A A . 17 THR OG1 1 1 4 2530 1 1 16 MET C C 0.587 -12.921 -3.244 1.00 . A A . 18 MET C 1 1 4 2531 1 1 16 MET CA C -0.873 -13.152 -2.853 1.00 . A A . 18 MET CA 1 1 4 2532 1 1 16 MET CB C -1.777 -12.858 -4.053 1.00 . A A . 18 MET CB 1 1 4 2533 1 1 16 MET CE C -4.911 -14.562 -3.952 1.00 . A A . 18 MET CE 1 1 4 2534 1 1 16 MET CG C -3.181 -12.501 -3.562 1.00 . A A . 18 MET CG 1 1 4 2535 1 1 16 MET H H -1.714 -11.414 -1.897 1.00 . A A . 18 MET H 1 1 4 2536 1 1 16 MET HA H -1.002 -14.178 -2.553 1.00 . A A . 18 MET HA 1 1 4 2537 1 1 16 MET HB2 H -1.370 -12.030 -4.616 1.00 . A A . 18 MET HB2 1 1 4 2538 1 1 16 MET HB3 H -1.830 -13.731 -4.685 1.00 . A A . 18 MET HB3 1 1 4 2539 1 1 16 MET HE1 H -4.866 -14.420 -2.882 1.00 . A A . 18 MET HE1 1 1 4 2540 1 1 16 MET HE2 H -4.248 -15.364 -4.235 1.00 . A A . 18 MET HE2 1 1 4 2541 1 1 16 MET HE3 H -5.921 -14.813 -4.246 1.00 . A A . 18 MET HE3 1 1 4 2542 1 1 16 MET HG2 H -3.371 -12.998 -2.622 1.00 . A A . 18 MET HG2 1 1 4 2543 1 1 16 MET HG3 H -3.254 -11.432 -3.425 1.00 . A A . 18 MET HG3 1 1 4 2544 1 1 16 MET N N -1.243 -12.255 -1.721 1.00 . A A . 18 MET N 1 1 4 2545 1 1 16 MET O O 1.442 -13.751 -3.008 1.00 . A A . 18 MET O 1 1 4 2546 1 1 16 MET SD S -4.404 -13.036 -4.785 1.00 . A A . 18 MET SD 1 1 4 2547 1 1 17 GLU C C 3.076 -10.970 -3.080 1.00 . A A . 19 GLU C 1 1 4 2548 1 1 17 GLU CA C 2.283 -11.528 -4.264 1.00 . A A . 19 GLU CA 1 1 4 2549 1 1 17 GLU CB C 2.290 -10.511 -5.411 1.00 . A A . 19 GLU CB 1 1 4 2550 1 1 17 GLU CD C 0.570 -8.695 -5.460 1.00 . A A . 19 GLU CD 1 1 4 2551 1 1 17 GLU CG C 1.923 -9.118 -4.883 1.00 . A A . 19 GLU CG 1 1 4 2552 1 1 17 GLU H H 0.173 -11.153 -4.035 1.00 . A A . 19 GLU H 1 1 4 2553 1 1 17 GLU HA H 2.743 -12.446 -4.599 1.00 . A A . 19 GLU HA 1 1 4 2554 1 1 17 GLU HB2 H 3.274 -10.479 -5.854 1.00 . A A . 19 GLU HB2 1 1 4 2555 1 1 17 GLU HB3 H 1.571 -10.810 -6.159 1.00 . A A . 19 GLU HB3 1 1 4 2556 1 1 17 GLU HG2 H 1.864 -9.140 -3.805 1.00 . A A . 19 GLU HG2 1 1 4 2557 1 1 17 GLU HG3 H 2.678 -8.409 -5.188 1.00 . A A . 19 GLU HG3 1 1 4 2558 1 1 17 GLU N N 0.879 -11.805 -3.848 1.00 . A A . 19 GLU N 1 1 4 2559 1 1 17 GLU O O 2.529 -10.348 -2.190 1.00 . A A . 19 GLU O 1 1 4 2560 1 1 17 GLU OE1 O -0.215 -9.571 -5.781 1.00 . A A . 19 GLU OE1 1 1 4 2561 1 1 17 GLU OE2 O 0.342 -7.501 -5.569 1.00 . A A . 19 GLU OE2 1 1 4 2562 1 1 18 TYR C C 5.871 -9.356 -2.399 1.00 . A A . 20 TYR C 1 1 4 2563 1 1 18 TYR CA C 5.197 -10.652 -1.951 1.00 . A A . 20 TYR CA 1 1 4 2564 1 1 18 TYR CB C 6.270 -11.671 -1.581 1.00 . A A . 20 TYR CB 1 1 4 2565 1 1 18 TYR CD1 C 5.669 -11.920 0.855 1.00 . A A . 20 TYR CD1 1 1 4 2566 1 1 18 TYR CD2 C 7.856 -11.046 0.276 1.00 . A A . 20 TYR CD2 1 1 4 2567 1 1 18 TYR CE1 C 5.981 -11.801 2.214 1.00 . A A . 20 TYR CE1 1 1 4 2568 1 1 18 TYR CE2 C 8.168 -10.927 1.635 1.00 . A A . 20 TYR CE2 1 1 4 2569 1 1 18 TYR CG C 6.606 -11.543 -0.115 1.00 . A A . 20 TYR CG 1 1 4 2570 1 1 18 TYR CZ C 7.231 -11.304 2.604 1.00 . A A . 20 TYR CZ 1 1 4 2571 1 1 18 TYR H H 4.786 -11.677 -3.799 1.00 . A A . 20 TYR H 1 1 4 2572 1 1 18 TYR HA H 4.570 -10.457 -1.093 1.00 . A A . 20 TYR HA 1 1 4 2573 1 1 18 TYR HB2 H 5.910 -12.668 -1.785 1.00 . A A . 20 TYR HB2 1 1 4 2574 1 1 18 TYR HB3 H 7.154 -11.478 -2.166 1.00 . A A . 20 TYR HB3 1 1 4 2575 1 1 18 TYR HD1 H 4.705 -12.303 0.554 1.00 . A A . 20 TYR HD1 1 1 4 2576 1 1 18 TYR HD2 H 8.579 -10.755 -0.472 1.00 . A A . 20 TYR HD2 1 1 4 2577 1 1 18 TYR HE1 H 5.257 -12.092 2.962 1.00 . A A . 20 TYR HE1 1 1 4 2578 1 1 18 TYR HE2 H 9.132 -10.543 1.936 1.00 . A A . 20 TYR HE2 1 1 4 2579 1 1 18 TYR HH H 6.717 -11.105 4.431 1.00 . A A . 20 TYR HH 1 1 4 2580 1 1 18 TYR N N 4.364 -11.179 -3.069 1.00 . A A . 20 TYR N 1 1 4 2581 1 1 18 TYR O O 6.729 -9.354 -3.258 1.00 . A A . 20 TYR O 1 1 4 2582 1 1 18 TYR OH O 7.539 -11.185 3.945 1.00 . A A . 20 TYR OH 1 1 4 2583 1 1 19 ARG C C 6.036 -5.986 -1.024 1.00 . A A . 21 ARG C 1 1 4 2584 1 1 19 ARG CA C 6.091 -6.953 -2.211 1.00 . A A . 21 ARG CA 1 1 4 2585 1 1 19 ARG CB C 5.303 -6.359 -3.381 1.00 . A A . 21 ARG CB 1 1 4 2586 1 1 19 ARG CD C 7.448 -5.809 -4.535 1.00 . A A . 21 ARG CD 1 1 4 2587 1 1 19 ARG CG C 6.118 -5.243 -4.035 1.00 . A A . 21 ARG CG 1 1 4 2588 1 1 19 ARG CZ C 7.656 -7.378 -6.368 1.00 . A A . 21 ARG CZ 1 1 4 2589 1 1 19 ARG H H 4.794 -8.289 -1.140 1.00 . A A . 21 ARG H 1 1 4 2590 1 1 19 ARG HA H 7.116 -7.105 -2.509 1.00 . A A . 21 ARG HA 1 1 4 2591 1 1 19 ARG HB2 H 5.099 -7.132 -4.108 1.00 . A A . 21 ARG HB2 1 1 4 2592 1 1 19 ARG HB3 H 4.372 -5.953 -3.018 1.00 . A A . 21 ARG HB3 1 1 4 2593 1 1 19 ARG HD2 H 7.876 -5.136 -5.263 1.00 . A A . 21 ARG HD2 1 1 4 2594 1 1 19 ARG HD3 H 8.128 -5.921 -3.704 1.00 . A A . 21 ARG HD3 1 1 4 2595 1 1 19 ARG HE H 6.718 -7.830 -4.676 1.00 . A A . 21 ARG HE 1 1 4 2596 1 1 19 ARG HG2 H 5.565 -4.833 -4.867 1.00 . A A . 21 ARG HG2 1 1 4 2597 1 1 19 ARG HG3 H 6.310 -4.467 -3.310 1.00 . A A . 21 ARG HG3 1 1 4 2598 1 1 19 ARG HH11 H 6.887 -5.706 -7.156 1.00 . A A . 21 ARG HH11 1 1 4 2599 1 1 19 ARG HH12 H 7.756 -6.723 -8.257 1.00 . A A . 21 ARG HH12 1 1 4 2600 1 1 19 ARG HH21 H 8.535 -9.104 -5.861 1.00 . A A . 21 ARG HH21 1 1 4 2601 1 1 19 ARG HH22 H 8.686 -8.646 -7.524 1.00 . A A . 21 ARG HH22 1 1 4 2602 1 1 19 ARG N N 5.485 -8.256 -1.824 1.00 . A A . 21 ARG N 1 1 4 2603 1 1 19 ARG NE N 7.211 -7.137 -5.165 1.00 . A A . 21 ARG NE 1 1 4 2604 1 1 19 ARG NH1 N 7.414 -6.537 -7.335 1.00 . A A . 21 ARG NH1 1 1 4 2605 1 1 19 ARG NH2 N 8.347 -8.460 -6.602 1.00 . A A . 21 ARG NH2 1 1 4 2606 1 1 19 ARG O O 5.039 -5.325 -0.811 1.00 . A A . 21 ARG O 1 1 4 2607 1 1 20 PRO C C 7.444 -3.592 0.416 1.00 . A A . 22 PRO C 1 1 4 2608 1 1 20 PRO CA C 7.228 -5.034 0.879 1.00 . A A . 22 PRO CA 1 1 4 2609 1 1 20 PRO CB C 8.455 -5.568 1.625 1.00 . A A . 22 PRO CB 1 1 4 2610 1 1 20 PRO CD C 8.329 -6.724 -0.559 1.00 . A A . 22 PRO CD 1 1 4 2611 1 1 20 PRO CG C 9.292 -6.347 0.582 1.00 . A A . 22 PRO CG 1 1 4 2612 1 1 20 PRO HA H 6.352 -5.110 1.503 1.00 . A A . 22 PRO HA 1 1 4 2613 1 1 20 PRO HB2 H 9.030 -4.745 2.029 1.00 . A A . 22 PRO HB2 1 1 4 2614 1 1 20 PRO HB3 H 8.149 -6.233 2.416 1.00 . A A . 22 PRO HB3 1 1 4 2615 1 1 20 PRO HD2 H 8.757 -6.460 -1.516 1.00 . A A . 22 PRO HD2 1 1 4 2616 1 1 20 PRO HD3 H 8.094 -7.777 -0.523 1.00 . A A . 22 PRO HD3 1 1 4 2617 1 1 20 PRO HG2 H 10.090 -5.721 0.206 1.00 . A A . 22 PRO HG2 1 1 4 2618 1 1 20 PRO HG3 H 9.699 -7.242 1.027 1.00 . A A . 22 PRO HG3 1 1 4 2619 1 1 20 PRO N N 7.117 -5.922 -0.289 1.00 . A A . 22 PRO N 1 1 4 2620 1 1 20 PRO O O 8.513 -3.225 -0.028 1.00 . A A . 22 PRO O 1 1 4 2621 1 1 21 LEU C C 6.673 -0.432 1.261 1.00 . A A . 23 LEU C 1 1 4 2622 1 1 21 LEU CA C 6.576 -1.363 0.052 1.00 . A A . 23 LEU CA 1 1 4 2623 1 1 21 LEU CB C 5.357 -0.973 -0.785 1.00 . A A . 23 LEU CB 1 1 4 2624 1 1 21 LEU CD1 C 4.059 -1.568 -2.834 1.00 . A A . 23 LEU CD1 1 1 4 2625 1 1 21 LEU CD2 C 6.485 -1.004 -3.010 1.00 . A A . 23 LEU CD2 1 1 4 2626 1 1 21 LEU CG C 5.420 -1.674 -2.142 1.00 . A A . 23 LEU CG 1 1 4 2627 1 1 21 LEU H H 5.574 -3.092 0.854 1.00 . A A . 23 LEU H 1 1 4 2628 1 1 21 LEU HA H 7.469 -1.267 -0.549 1.00 . A A . 23 LEU HA 1 1 4 2629 1 1 21 LEU HB2 H 4.456 -1.270 -0.266 1.00 . A A . 23 LEU HB2 1 1 4 2630 1 1 21 LEU HB3 H 5.350 0.096 -0.934 1.00 . A A . 23 LEU HB3 1 1 4 2631 1 1 21 LEU HD11 H 4.205 -1.402 -3.891 1.00 . A A . 23 LEU HD11 1 1 4 2632 1 1 21 LEU HD12 H 3.505 -0.742 -2.413 1.00 . A A . 23 LEU HD12 1 1 4 2633 1 1 21 LEU HD13 H 3.508 -2.484 -2.686 1.00 . A A . 23 LEU HD13 1 1 4 2634 1 1 21 LEU HD21 H 6.007 -0.373 -3.745 1.00 . A A . 23 LEU HD21 1 1 4 2635 1 1 21 LEU HD22 H 7.071 -1.762 -3.511 1.00 . A A . 23 LEU HD22 1 1 4 2636 1 1 21 LEU HD23 H 7.132 -0.404 -2.387 1.00 . A A . 23 LEU HD23 1 1 4 2637 1 1 21 LEU HG H 5.670 -2.715 -1.998 1.00 . A A . 23 LEU HG 1 1 4 2638 1 1 21 LEU N N 6.432 -2.775 0.503 1.00 . A A . 23 LEU N 1 1 4 2639 1 1 21 LEU O O 5.919 -0.543 2.206 1.00 . A A . 23 LEU O 1 1 4 2640 1 1 22 CYS C C 6.980 2.740 2.010 1.00 . A A . 24 CYS C 1 1 4 2641 1 1 22 CYS CA C 7.728 1.451 2.362 1.00 . A A . 24 CYS CA 1 1 4 2642 1 1 22 CYS CB C 9.212 1.756 2.591 1.00 . A A . 24 CYS CB 1 1 4 2643 1 1 22 CYS H H 8.178 0.575 0.447 1.00 . A A . 24 CYS H 1 1 4 2644 1 1 22 CYS HA H 7.304 1.018 3.254 1.00 . A A . 24 CYS HA 1 1 4 2645 1 1 22 CYS HB2 H 9.718 0.859 2.918 1.00 . A A . 24 CYS HB2 1 1 4 2646 1 1 22 CYS HB3 H 9.656 2.103 1.669 1.00 . A A . 24 CYS HB3 1 1 4 2647 1 1 22 CYS N N 7.588 0.497 1.227 1.00 . A A . 24 CYS N 1 1 4 2648 1 1 22 CYS O O 7.569 3.723 1.607 1.00 . A A . 24 CYS O 1 1 4 2649 1 1 22 CYS SG S 9.378 3.036 3.859 1.00 . A A . 24 CYS SG 1 1 4 2650 1 1 23 GLY C C 5.560 5.196 2.365 1.00 . A A . 25 GLY C 1 1 4 2651 1 1 23 GLY CA C 4.881 3.946 1.807 1.00 . A A . 25 GLY CA 1 1 4 2652 1 1 23 GLY H H 5.227 1.924 2.466 1.00 . A A . 25 GLY H 1 1 4 2653 1 1 23 GLY HA2 H 4.796 4.031 0.734 1.00 . A A . 25 GLY HA2 1 1 4 2654 1 1 23 GLY HA3 H 3.894 3.855 2.238 1.00 . A A . 25 GLY HA3 1 1 4 2655 1 1 23 GLY N N 5.680 2.733 2.147 1.00 . A A . 25 GLY N 1 1 4 2656 1 1 23 GLY O O 6.211 5.153 3.389 1.00 . A A . 25 GLY O 1 1 4 2657 1 1 24 SER C C 5.685 7.798 3.659 1.00 . A A . 26 SER C 1 1 4 2658 1 1 24 SER CA C 6.026 7.580 2.183 1.00 . A A . 26 SER CA 1 1 4 2659 1 1 24 SER CB C 5.494 8.755 1.361 1.00 . A A . 26 SER CB 1 1 4 2660 1 1 24 SER H H 4.868 6.319 0.878 1.00 . A A . 26 SER H 1 1 4 2661 1 1 24 SER HA H 7.095 7.519 2.068 1.00 . A A . 26 SER HA 1 1 4 2662 1 1 24 SER HB2 H 5.225 8.415 0.375 1.00 . A A . 26 SER HB2 1 1 4 2663 1 1 24 SER HB3 H 4.620 9.167 1.849 1.00 . A A . 26 SER HB3 1 1 4 2664 1 1 24 SER HG H 6.073 10.603 1.174 1.00 . A A . 26 SER HG 1 1 4 2665 1 1 24 SER N N 5.402 6.314 1.699 1.00 . A A . 26 SER N 1 1 4 2666 1 1 24 SER O O 6.345 8.544 4.355 1.00 . A A . 26 SER O 1 1 4 2667 1 1 24 SER OG O 6.504 9.749 1.253 1.00 . A A . 26 SER OG 1 1 4 2668 1 1 25 ASP C C 5.056 6.304 6.430 1.00 . A A . 27 ASP C 1 1 4 2669 1 1 25 ASP CA C 4.281 7.312 5.578 1.00 . A A . 27 ASP CA 1 1 4 2670 1 1 25 ASP CB C 2.778 7.072 5.734 1.00 . A A . 27 ASP CB 1 1 4 2671 1 1 25 ASP CG C 2.451 5.611 5.417 1.00 . A A . 27 ASP CG 1 1 4 2672 1 1 25 ASP H H 4.146 6.553 3.571 1.00 . A A . 27 ASP H 1 1 4 2673 1 1 25 ASP HA H 4.519 8.315 5.901 1.00 . A A . 27 ASP HA 1 1 4 2674 1 1 25 ASP HB2 H 2.480 7.297 6.747 1.00 . A A . 27 ASP HB2 1 1 4 2675 1 1 25 ASP HB3 H 2.244 7.711 5.052 1.00 . A A . 27 ASP HB3 1 1 4 2676 1 1 25 ASP N N 4.661 7.148 4.145 1.00 . A A . 27 ASP N 1 1 4 2677 1 1 25 ASP O O 4.621 5.904 7.491 1.00 . A A . 27 ASP O 1 1 4 2678 1 1 25 ASP OD1 O 3.107 5.050 4.556 1.00 . A A . 27 ASP OD1 1 1 4 2679 1 1 25 ASP OD2 O 1.546 5.079 6.039 1.00 . A A . 27 ASP OD2 1 1 4 2680 1 1 26 ASN C C 6.192 3.679 7.061 1.00 . A A . 28 ASN C 1 1 4 2681 1 1 26 ASN CA C 7.026 4.919 6.737 1.00 . A A . 28 ASN CA 1 1 4 2682 1 1 26 ASN CB C 7.500 5.568 8.039 1.00 . A A . 28 ASN CB 1 1 4 2683 1 1 26 ASN CG C 8.813 4.920 8.485 1.00 . A A . 28 ASN CG 1 1 4 2684 1 1 26 ASN H H 6.530 6.236 5.113 1.00 . A A . 28 ASN H 1 1 4 2685 1 1 26 ASN HA H 7.883 4.630 6.149 1.00 . A A . 28 ASN HA 1 1 4 2686 1 1 26 ASN HB2 H 7.656 6.625 7.879 1.00 . A A . 28 ASN HB2 1 1 4 2687 1 1 26 ASN HB3 H 6.753 5.425 8.806 1.00 . A A . 28 ASN HB3 1 1 4 2688 1 1 26 ASN HD21 H 8.465 5.215 10.418 1.00 . A A . 28 ASN HD21 1 1 4 2689 1 1 26 ASN HD22 H 9.931 4.440 10.054 1.00 . A A . 28 ASN HD22 1 1 4 2690 1 1 26 ASN N N 6.205 5.895 5.968 1.00 . A A . 28 ASN N 1 1 4 2691 1 1 26 ASN ND2 N 9.093 4.853 9.758 1.00 . A A . 28 ASN ND2 1 1 4 2692 1 1 26 ASN O O 6.290 3.120 8.136 1.00 . A A . 28 ASN O 1 1 4 2693 1 1 26 ASN OD1 O 9.591 4.472 7.667 1.00 . A A . 28 ASN OD1 1 1 4 2694 1 1 27 LYS C C 5.013 0.855 5.570 1.00 . A A . 29 LYS C 1 1 4 2695 1 1 27 LYS CA C 4.540 2.031 6.428 1.00 . A A . 29 LYS CA 1 1 4 2696 1 1 27 LYS CB C 3.073 2.327 6.117 1.00 . A A . 29 LYS CB 1 1 4 2697 1 1 27 LYS CD C 1.655 1.322 7.911 1.00 . A A . 29 LYS CD 1 1 4 2698 1 1 27 LYS CE C 0.788 1.629 9.134 1.00 . A A . 29 LYS CE 1 1 4 2699 1 1 27 LYS CG C 2.325 2.608 7.421 1.00 . A A . 29 LYS CG 1 1 4 2700 1 1 27 LYS H H 5.298 3.703 5.282 1.00 . A A . 29 LYS H 1 1 4 2701 1 1 27 LYS HA H 4.638 1.769 7.469 1.00 . A A . 29 LYS HA 1 1 4 2702 1 1 27 LYS HB2 H 3.009 3.187 5.471 1.00 . A A . 29 LYS HB2 1 1 4 2703 1 1 27 LYS HB3 H 2.630 1.473 5.627 1.00 . A A . 29 LYS HB3 1 1 4 2704 1 1 27 LYS HD2 H 1.037 0.916 7.122 1.00 . A A . 29 LYS HD2 1 1 4 2705 1 1 27 LYS HD3 H 2.413 0.602 8.180 1.00 . A A . 29 LYS HD3 1 1 4 2706 1 1 27 LYS HE2 H 0.990 0.905 9.910 1.00 . A A . 29 LYS HE2 1 1 4 2707 1 1 27 LYS HE3 H 1.016 2.620 9.497 1.00 . A A . 29 LYS HE3 1 1 4 2708 1 1 27 LYS HG2 H 3.022 2.958 8.169 1.00 . A A . 29 LYS HG2 1 1 4 2709 1 1 27 LYS HG3 H 1.571 3.361 7.250 1.00 . A A . 29 LYS HG3 1 1 4 2710 1 1 27 LYS HZ1 H -1.232 1.459 9.606 1.00 . A A . 29 LYS HZ1 1 1 4 2711 1 1 27 LYS HZ2 H -0.803 0.737 8.129 1.00 . A A . 29 LYS HZ2 1 1 4 2712 1 1 27 LYS HZ3 H -0.919 2.429 8.251 1.00 . A A . 29 LYS HZ3 1 1 4 2713 1 1 27 LYS N N 5.370 3.240 6.147 1.00 . A A . 29 LYS N 1 1 4 2714 1 1 27 LYS NZ N -0.651 1.558 8.751 1.00 . A A . 29 LYS NZ 1 1 4 2715 1 1 27 LYS O O 5.379 1.015 4.423 1.00 . A A . 29 LYS O 1 1 4 2716 1 1 28 THR C C 4.204 -2.329 4.932 1.00 . A A . 30 THR C 1 1 4 2717 1 1 28 THR CA C 5.439 -1.526 5.350 1.00 . A A . 30 THR CA 1 1 4 2718 1 1 28 THR CB C 6.341 -2.400 6.227 1.00 . A A . 30 THR CB 1 1 4 2719 1 1 28 THR CG2 C 6.890 -3.562 5.398 1.00 . A A . 30 THR CG2 1 1 4 2720 1 1 28 THR H H 4.696 -0.431 7.049 1.00 . A A . 30 THR H 1 1 4 2721 1 1 28 THR HA H 5.981 -1.212 4.471 1.00 . A A . 30 THR HA 1 1 4 2722 1 1 28 THR HB H 5.766 -2.795 7.052 1.00 . A A . 30 THR HB 1 1 4 2723 1 1 28 THR HG1 H 7.438 -0.788 6.257 1.00 . A A . 30 THR HG1 1 1 4 2724 1 1 28 THR HG21 H 7.522 -4.181 6.019 1.00 . A A . 30 THR HG21 1 1 4 2725 1 1 28 THR HG22 H 7.468 -3.174 4.571 1.00 . A A . 30 THR HG22 1 1 4 2726 1 1 28 THR HG23 H 6.070 -4.152 5.017 1.00 . A A . 30 THR HG23 1 1 4 2727 1 1 28 THR N N 5.001 -0.329 6.123 1.00 . A A . 30 THR N 1 1 4 2728 1 1 28 THR O O 3.532 -2.921 5.753 1.00 . A A . 30 THR O 1 1 4 2729 1 1 28 THR OG1 O 7.420 -1.622 6.732 1.00 . A A . 30 THR OG1 1 1 4 2730 1 1 29 TYR C C 3.117 -4.481 2.709 1.00 . A A . 31 TYR C 1 1 4 2731 1 1 29 TYR CA C 2.701 -3.095 3.203 1.00 . A A . 31 TYR CA 1 1 4 2732 1 1 29 TYR CB C 2.048 -2.321 2.062 1.00 . A A . 31 TYR CB 1 1 4 2733 1 1 29 TYR CD1 C 0.517 -1.185 3.707 1.00 . A A . 31 TYR CD1 1 1 4 2734 1 1 29 TYR CD2 C 1.652 0.165 2.043 1.00 . A A . 31 TYR CD2 1 1 4 2735 1 1 29 TYR CE1 C -0.091 -0.036 4.225 1.00 . A A . 31 TYR CE1 1 1 4 2736 1 1 29 TYR CE2 C 1.044 1.315 2.561 1.00 . A A . 31 TYR CE2 1 1 4 2737 1 1 29 TYR CG C 1.389 -1.084 2.616 1.00 . A A . 31 TYR CG 1 1 4 2738 1 1 29 TYR CZ C 0.172 1.213 3.652 1.00 . A A . 31 TYR CZ 1 1 4 2739 1 1 29 TYR H H 4.441 -1.855 3.020 1.00 . A A . 31 TYR H 1 1 4 2740 1 1 29 TYR HA H 2.000 -3.196 4.017 1.00 . A A . 31 TYR HA 1 1 4 2741 1 1 29 TYR HB2 H 2.801 -2.037 1.341 1.00 . A A . 31 TYR HB2 1 1 4 2742 1 1 29 TYR HB3 H 1.310 -2.940 1.587 1.00 . A A . 31 TYR HB3 1 1 4 2743 1 1 29 TYR HD1 H 0.316 -2.150 4.149 1.00 . A A . 31 TYR HD1 1 1 4 2744 1 1 29 TYR HD2 H 2.324 0.242 1.202 1.00 . A A . 31 TYR HD2 1 1 4 2745 1 1 29 TYR HE1 H -0.764 -0.115 5.066 1.00 . A A . 31 TYR HE1 1 1 4 2746 1 1 29 TYR HE2 H 1.248 2.279 2.120 1.00 . A A . 31 TYR HE2 1 1 4 2747 1 1 29 TYR HH H 0.237 3.040 4.201 1.00 . A A . 31 TYR HH 1 1 4 2748 1 1 29 TYR N N 3.895 -2.345 3.667 1.00 . A A . 31 TYR N 1 1 4 2749 1 1 29 TYR O O 4.216 -4.679 2.229 1.00 . A A . 31 TYR O 1 1 4 2750 1 1 29 TYR OH O -0.427 2.346 4.162 1.00 . A A . 31 TYR OH 1 1 4 2751 1 1 30 GLY C C 2.707 -6.825 0.837 1.00 . A A . 32 GLY C 1 1 4 2752 1 1 30 GLY CA C 2.579 -6.816 2.360 1.00 . A A . 32 GLY CA 1 1 4 2753 1 1 30 GLY H H 1.361 -5.259 3.212 1.00 . A A . 32 GLY H 1 1 4 2754 1 1 30 GLY HA2 H 3.514 -7.125 2.804 1.00 . A A . 32 GLY HA2 1 1 4 2755 1 1 30 GLY HA3 H 1.796 -7.498 2.655 1.00 . A A . 32 GLY HA3 1 1 4 2756 1 1 30 GLY N N 2.242 -5.443 2.823 1.00 . A A . 32 GLY N 1 1 4 2757 1 1 30 GLY O O 3.407 -7.639 0.273 1.00 . A A . 32 GLY O 1 1 4 2758 1 1 31 ASN C C 1.427 -4.646 -1.852 1.00 . A A . 33 ASN C 1 1 4 2759 1 1 31 ASN CA C 2.133 -5.893 -1.319 1.00 . A A . 33 ASN CA 1 1 4 2760 1 1 31 ASN CB C 1.474 -7.145 -1.903 1.00 . A A . 33 ASN CB 1 1 4 2761 1 1 31 ASN CG C 0.077 -7.319 -1.302 1.00 . A A . 33 ASN CG 1 1 4 2762 1 1 31 ASN H H 1.477 -5.275 0.634 1.00 . A A . 33 ASN H 1 1 4 2763 1 1 31 ASN HA H 3.172 -5.868 -1.609 1.00 . A A . 33 ASN HA 1 1 4 2764 1 1 31 ASN HB2 H 1.394 -7.041 -2.975 1.00 . A A . 33 ASN HB2 1 1 4 2765 1 1 31 ASN HB3 H 2.075 -8.010 -1.668 1.00 . A A . 33 ASN HB3 1 1 4 2766 1 1 31 ASN HD21 H 0.095 -9.297 -1.473 1.00 . A A . 33 ASN HD21 1 1 4 2767 1 1 31 ASN HD22 H -1.316 -8.641 -0.796 1.00 . A A . 33 ASN HD22 1 1 4 2768 1 1 31 ASN N N 2.038 -5.927 0.165 1.00 . A A . 33 ASN N 1 1 4 2769 1 1 31 ASN ND2 N -0.423 -8.519 -1.181 1.00 . A A . 33 ASN ND2 1 1 4 2770 1 1 31 ASN O O 0.722 -3.962 -1.137 1.00 . A A . 33 ASN O 1 1 4 2771 1 1 31 ASN OD1 O -0.565 -6.354 -0.937 1.00 . A A . 33 ASN OD1 1 1 4 2772 1 1 32 LYS C C -0.549 -3.263 -3.581 1.00 . A A . 34 LYS C 1 1 4 2773 1 1 32 LYS CA C 0.971 -3.143 -3.696 1.00 . A A . 34 LYS CA 1 1 4 2774 1 1 32 LYS CB C 1.363 -3.027 -5.171 1.00 . A A . 34 LYS CB 1 1 4 2775 1 1 32 LYS CD C 2.239 -0.811 -5.931 1.00 . A A . 34 LYS CD 1 1 4 2776 1 1 32 LYS CE C 2.021 0.609 -5.405 1.00 . A A . 34 LYS CE 1 1 4 2777 1 1 32 LYS CG C 0.976 -1.642 -5.695 1.00 . A A . 34 LYS CG 1 1 4 2778 1 1 32 LYS H H 2.194 -4.906 -3.654 1.00 . A A . 34 LYS H 1 1 4 2779 1 1 32 LYS HA H 1.298 -2.262 -3.167 1.00 . A A . 34 LYS HA 1 1 4 2780 1 1 32 LYS HB2 H 2.430 -3.164 -5.271 1.00 . A A . 34 LYS HB2 1 1 4 2781 1 1 32 LYS HB3 H 0.847 -3.783 -5.743 1.00 . A A . 34 LYS HB3 1 1 4 2782 1 1 32 LYS HD2 H 3.071 -1.266 -5.410 1.00 . A A . 34 LYS HD2 1 1 4 2783 1 1 32 LYS HD3 H 2.453 -0.773 -6.988 1.00 . A A . 34 LYS HD3 1 1 4 2784 1 1 32 LYS HE2 H 1.048 0.960 -5.714 1.00 . A A . 34 LYS HE2 1 1 4 2785 1 1 32 LYS HE3 H 2.077 0.605 -4.327 1.00 . A A . 34 LYS HE3 1 1 4 2786 1 1 32 LYS HG2 H 0.434 -1.747 -6.624 1.00 . A A . 34 LYS HG2 1 1 4 2787 1 1 32 LYS HG3 H 0.351 -1.145 -4.969 1.00 . A A . 34 LYS HG3 1 1 4 2788 1 1 32 LYS HZ1 H 2.871 1.711 -6.954 1.00 . A A . 34 LYS HZ1 1 1 4 2789 1 1 32 LYS HZ2 H 4.001 1.047 -5.873 1.00 . A A . 34 LYS HZ2 1 1 4 2790 1 1 32 LYS HZ3 H 3.080 2.400 -5.418 1.00 . A A . 34 LYS HZ3 1 1 4 2791 1 1 32 LYS N N 1.619 -4.344 -3.105 1.00 . A A . 34 LYS N 1 1 4 2792 1 1 32 LYS NZ N 3.073 1.509 -5.954 1.00 . A A . 34 LYS NZ 1 1 4 2793 1 1 32 LYS O O -1.265 -2.297 -3.746 1.00 . A A . 34 LYS O 1 1 4 2794 1 1 33 CYS C C -2.959 -3.845 -1.887 1.00 . A A . 35 CYS C 1 1 4 2795 1 1 33 CYS CA C -2.523 -4.577 -3.153 1.00 . A A . 35 CYS CA 1 1 4 2796 1 1 33 CYS CB C -2.887 -6.056 -3.054 1.00 . A A . 35 CYS CB 1 1 4 2797 1 1 33 CYS H H -0.466 -5.204 -3.147 1.00 . A A . 35 CYS H 1 1 4 2798 1 1 33 CYS HA H -3.011 -4.137 -4.010 1.00 . A A . 35 CYS HA 1 1 4 2799 1 1 33 CYS HB2 H -2.474 -6.585 -3.901 1.00 . A A . 35 CYS HB2 1 1 4 2800 1 1 33 CYS HB3 H -2.480 -6.465 -2.142 1.00 . A A . 35 CYS HB3 1 1 4 2801 1 1 33 CYS N N -1.052 -4.431 -3.288 1.00 . A A . 35 CYS N 1 1 4 2802 1 1 33 CYS O O -3.999 -3.217 -1.841 1.00 . A A . 35 CYS O 1 1 4 2803 1 1 33 CYS SG S -4.689 -6.232 -3.053 1.00 . A A . 35 CYS SG 1 1 4 2804 1 1 34 ASN C C -2.171 -1.708 0.191 1.00 . A A . 36 ASN C 1 1 4 2805 1 1 34 ASN CA C -2.489 -3.187 0.391 1.00 . A A . 36 ASN CA 1 1 4 2806 1 1 34 ASN CB C -1.646 -3.747 1.537 1.00 . A A . 36 ASN CB 1 1 4 2807 1 1 34 ASN CG C -2.529 -3.944 2.769 1.00 . A A . 36 ASN CG 1 1 4 2808 1 1 34 ASN H H -1.308 -4.391 -0.934 1.00 . A A . 36 ASN H 1 1 4 2809 1 1 34 ASN HA H -3.539 -3.310 0.611 1.00 . A A . 36 ASN HA 1 1 4 2810 1 1 34 ASN HB2 H -1.220 -4.695 1.240 1.00 . A A . 36 ASN HB2 1 1 4 2811 1 1 34 ASN HB3 H -0.853 -3.054 1.770 1.00 . A A . 36 ASN HB3 1 1 4 2812 1 1 34 ASN HD21 H -3.475 -5.514 2.008 1.00 . A A . 36 ASN HD21 1 1 4 2813 1 1 34 ASN HD22 H -3.968 -5.056 3.566 1.00 . A A . 36 ASN HD22 1 1 4 2814 1 1 34 ASN N N -2.150 -3.899 -0.865 1.00 . A A . 36 ASN N 1 1 4 2815 1 1 34 ASN ND2 N -3.397 -4.919 2.782 1.00 . A A . 36 ASN ND2 1 1 4 2816 1 1 34 ASN O O -2.773 -0.839 0.790 1.00 . A A . 36 ASN O 1 1 4 2817 1 1 34 ASN OD1 O -2.431 -3.205 3.728 1.00 . A A . 36 ASN OD1 1 1 4 2818 1 1 35 PHE C C -2.017 0.639 -1.723 1.00 . A A . 37 PHE C 1 1 4 2819 1 1 35 PHE CA C -0.873 -0.008 -0.948 1.00 . A A . 37 PHE CA 1 1 4 2820 1 1 35 PHE CB C 0.411 0.033 -1.782 1.00 . A A . 37 PHE CB 1 1 4 2821 1 1 35 PHE CD1 C 0.288 2.355 -2.756 1.00 . A A . 37 PHE CD1 1 1 4 2822 1 1 35 PHE CD2 C 1.978 1.882 -1.082 1.00 . A A . 37 PHE CD2 1 1 4 2823 1 1 35 PHE CE1 C 0.743 3.677 -2.841 1.00 . A A . 37 PHE CE1 1 1 4 2824 1 1 35 PHE CE2 C 2.434 3.204 -1.169 1.00 . A A . 37 PHE CE2 1 1 4 2825 1 1 35 PHE CG C 0.905 1.459 -1.877 1.00 . A A . 37 PHE CG 1 1 4 2826 1 1 35 PHE CZ C 1.816 4.101 -2.047 1.00 . A A . 37 PHE CZ 1 1 4 2827 1 1 35 PHE H H -0.776 -2.145 -1.151 1.00 . A A . 37 PHE H 1 1 4 2828 1 1 35 PHE HA H -0.722 0.518 -0.018 1.00 . A A . 37 PHE HA 1 1 4 2829 1 1 35 PHE HB2 H 1.165 -0.580 -1.312 1.00 . A A . 37 PHE HB2 1 1 4 2830 1 1 35 PHE HB3 H 0.208 -0.346 -2.775 1.00 . A A . 37 PHE HB3 1 1 4 2831 1 1 35 PHE HD1 H -0.540 2.028 -3.367 1.00 . A A . 37 PHE HD1 1 1 4 2832 1 1 35 PHE HD2 H 2.455 1.191 -0.404 1.00 . A A . 37 PHE HD2 1 1 4 2833 1 1 35 PHE HE1 H 0.267 4.369 -3.520 1.00 . A A . 37 PHE HE1 1 1 4 2834 1 1 35 PHE HE2 H 3.261 3.532 -0.556 1.00 . A A . 37 PHE HE2 1 1 4 2835 1 1 35 PHE HZ H 2.168 5.120 -2.114 1.00 . A A . 37 PHE HZ 1 1 4 2836 1 1 35 PHE N N -1.234 -1.423 -0.673 1.00 . A A . 37 PHE N 1 1 4 2837 1 1 35 PHE O O -2.277 1.821 -1.605 1.00 . A A . 37 PHE O 1 1 4 2838 1 1 36 CYS C C -5.074 0.513 -2.353 1.00 . A A . 38 CYS C 1 1 4 2839 1 1 36 CYS CA C -3.859 0.416 -3.279 1.00 . A A . 38 CYS CA 1 1 4 2840 1 1 36 CYS CB C -4.177 -0.511 -4.455 1.00 . A A . 38 CYS CB 1 1 4 2841 1 1 36 CYS H H -2.494 -1.088 -2.574 1.00 . A A . 38 CYS H 1 1 4 2842 1 1 36 CYS HA H -3.605 1.399 -3.648 1.00 . A A . 38 CYS HA 1 1 4 2843 1 1 36 CYS HB2 H -4.199 -1.535 -4.111 1.00 . A A . 38 CYS HB2 1 1 4 2844 1 1 36 CYS HB3 H -5.138 -0.249 -4.872 1.00 . A A . 38 CYS HB3 1 1 4 2845 1 1 36 CYS N N -2.716 -0.137 -2.506 1.00 . A A . 38 CYS N 1 1 4 2846 1 1 36 CYS O O -5.998 1.262 -2.599 1.00 . A A . 38 CYS O 1 1 4 2847 1 1 36 CYS SG S -2.899 -0.331 -5.726 1.00 . A A . 38 CYS SG 1 1 4 2848 1 1 37 CYS C C -6.102 1.115 0.481 1.00 . A A . 39 CYS C 1 1 4 2849 1 1 37 CYS CA C -6.211 -0.179 -0.327 1.00 . A A . 39 CYS CA 1 1 4 2850 1 1 37 CYS CB C -6.173 -1.436 0.580 1.00 . A A . 39 CYS CB 1 1 4 2851 1 1 37 CYS H H -4.308 -0.823 -1.097 1.00 . A A . 39 CYS H 1 1 4 2852 1 1 37 CYS HA H -7.134 -0.168 -0.883 1.00 . A A . 39 CYS HA 1 1 4 2853 1 1 37 CYS HB2 H -7.091 -1.985 0.455 1.00 . A A . 39 CYS HB2 1 1 4 2854 1 1 37 CYS HB3 H -5.346 -2.062 0.276 1.00 . A A . 39 CYS HB3 1 1 4 2855 1 1 37 CYS N N -5.069 -0.234 -1.281 1.00 . A A . 39 CYS N 1 1 4 2856 1 1 37 CYS O O -7.047 1.869 0.606 1.00 . A A . 39 CYS O 1 1 4 2857 1 1 37 CYS SG S -5.983 -1.010 2.342 1.00 . A A . 39 CYS SG 1 1 4 2858 1 1 38 ALA C C -4.949 3.816 0.881 1.00 . A A . 40 ALA C 1 1 4 2859 1 1 38 ALA CA C -4.762 2.622 1.812 1.00 . A A . 40 ALA CA 1 1 4 2860 1 1 38 ALA CB C -3.353 2.648 2.406 1.00 . A A . 40 ALA CB 1 1 4 2861 1 1 38 ALA H H -4.200 0.756 0.895 1.00 . A A . 40 ALA H 1 1 4 2862 1 1 38 ALA HA H -5.494 2.660 2.605 1.00 . A A . 40 ALA HA 1 1 4 2863 1 1 38 ALA HB1 H -3.189 1.751 2.984 1.00 . A A . 40 ALA HB1 1 1 4 2864 1 1 38 ALA HB2 H -3.248 3.513 3.044 1.00 . A A . 40 ALA HB2 1 1 4 2865 1 1 38 ALA HB3 H -2.628 2.698 1.607 1.00 . A A . 40 ALA HB3 1 1 4 2866 1 1 38 ALA N N -4.948 1.376 1.021 1.00 . A A . 40 ALA N 1 1 4 2867 1 1 38 ALA O O -5.325 4.893 1.296 1.00 . A A . 40 ALA O 1 1 4 2868 1 1 39 VAL C C -6.341 4.936 -1.653 1.00 . A A . 41 VAL C 1 1 4 2869 1 1 39 VAL CA C -4.853 4.735 -1.356 1.00 . A A . 41 VAL CA 1 1 4 2870 1 1 39 VAL CB C -4.119 4.384 -2.649 1.00 . A A . 41 VAL CB 1 1 4 2871 1 1 39 VAL CG1 C -4.488 5.395 -3.734 1.00 . A A . 41 VAL CG1 1 1 4 2872 1 1 39 VAL CG2 C -2.609 4.428 -2.402 1.00 . A A . 41 VAL CG2 1 1 4 2873 1 1 39 VAL H H -4.392 2.739 -0.688 1.00 . A A . 41 VAL H 1 1 4 2874 1 1 39 VAL HA H -4.442 5.643 -0.941 1.00 . A A . 41 VAL HA 1 1 4 2875 1 1 39 VAL HB H -4.407 3.391 -2.966 1.00 . A A . 41 VAL HB 1 1 4 2876 1 1 39 VAL HG11 H -3.591 5.873 -4.101 1.00 . A A . 41 VAL HG11 1 1 4 2877 1 1 39 VAL HG12 H -5.150 6.141 -3.322 1.00 . A A . 41 VAL HG12 1 1 4 2878 1 1 39 VAL HG13 H -4.984 4.885 -4.548 1.00 . A A . 41 VAL HG13 1 1 4 2879 1 1 39 VAL HG21 H -2.106 3.822 -3.143 1.00 . A A . 41 VAL HG21 1 1 4 2880 1 1 39 VAL HG22 H -2.393 4.045 -1.416 1.00 . A A . 41 VAL HG22 1 1 4 2881 1 1 39 VAL HG23 H -2.263 5.448 -2.477 1.00 . A A . 41 VAL HG23 1 1 4 2882 1 1 39 VAL N N -4.692 3.622 -0.381 1.00 . A A . 41 VAL N 1 1 4 2883 1 1 39 VAL O O -6.789 6.035 -1.918 1.00 . A A . 41 VAL O 1 1 4 2884 1 1 40 VAL C C -9.261 4.652 -0.683 1.00 . A A . 42 VAL C 1 1 4 2885 1 1 40 VAL CA C -8.568 4.013 -1.888 1.00 . A A . 42 VAL CA 1 1 4 2886 1 1 40 VAL CB C -9.166 2.629 -2.153 1.00 . A A . 42 VAL CB 1 1 4 2887 1 1 40 VAL CG1 C -10.688 2.741 -2.269 1.00 . A A . 42 VAL CG1 1 1 4 2888 1 1 40 VAL CG2 C -8.598 2.071 -3.459 1.00 . A A . 42 VAL CG2 1 1 4 2889 1 1 40 VAL H H -6.726 3.007 -1.395 1.00 . A A . 42 VAL H 1 1 4 2890 1 1 40 VAL HA H -8.713 4.638 -2.757 1.00 . A A . 42 VAL HA 1 1 4 2891 1 1 40 VAL HB H -8.916 1.965 -1.337 1.00 . A A . 42 VAL HB 1 1 4 2892 1 1 40 VAL HG11 H -10.943 3.658 -2.781 1.00 . A A . 42 VAL HG11 1 1 4 2893 1 1 40 VAL HG12 H -11.126 2.745 -1.282 1.00 . A A . 42 VAL HG12 1 1 4 2894 1 1 40 VAL HG13 H -11.069 1.900 -2.828 1.00 . A A . 42 VAL HG13 1 1 4 2895 1 1 40 VAL HG21 H -9.355 2.112 -4.227 1.00 . A A . 42 VAL HG21 1 1 4 2896 1 1 40 VAL HG22 H -8.291 1.046 -3.309 1.00 . A A . 42 VAL HG22 1 1 4 2897 1 1 40 VAL HG23 H -7.746 2.662 -3.761 1.00 . A A . 42 VAL HG23 1 1 4 2898 1 1 40 VAL N N -7.109 3.883 -1.610 1.00 . A A . 42 VAL N 1 1 4 2899 1 1 40 VAL O O -10.380 5.119 -0.776 1.00 . A A . 42 VAL O 1 1 4 2900 1 1 41 GLU C C -8.676 6.703 1.858 1.00 . A A . 43 GLU C 1 1 4 2901 1 1 41 GLU CA C -9.234 5.293 1.657 1.00 . A A . 43 GLU CA 1 1 4 2902 1 1 41 GLU CB C -8.936 4.449 2.909 1.00 . A A . 43 GLU CB 1 1 4 2903 1 1 41 GLU CD C -7.882 2.360 3.788 1.00 . A A . 43 GLU CD 1 1 4 2904 1 1 41 GLU CG C -8.087 3.227 2.545 1.00 . A A . 43 GLU CG 1 1 4 2905 1 1 41 GLU H H -7.706 4.297 0.501 1.00 . A A . 43 GLU H 1 1 4 2906 1 1 41 GLU HA H -10.303 5.350 1.514 1.00 . A A . 43 GLU HA 1 1 4 2907 1 1 41 GLU HB2 H -8.400 5.054 3.627 1.00 . A A . 43 GLU HB2 1 1 4 2908 1 1 41 GLU HB3 H -9.866 4.119 3.345 1.00 . A A . 43 GLU HB3 1 1 4 2909 1 1 41 GLU HG2 H -8.594 2.651 1.784 1.00 . A A . 43 GLU HG2 1 1 4 2910 1 1 41 GLU HG3 H -7.127 3.551 2.172 1.00 . A A . 43 GLU HG3 1 1 4 2911 1 1 41 GLU N N -8.608 4.679 0.447 1.00 . A A . 43 GLU N 1 1 4 2912 1 1 41 GLU O O -9.277 7.531 2.513 1.00 . A A . 43 GLU O 1 1 4 2913 1 1 41 GLU OE1 O -6.911 2.589 4.492 1.00 . A A . 43 GLU OE1 1 1 4 2914 1 1 41 GLU OE2 O -8.698 1.482 4.016 1.00 . A A . 43 GLU OE2 1 1 4 2915 1 1 42 SER C C -7.275 9.194 0.231 1.00 . A A . 44 SER C 1 1 4 2916 1 1 42 SER CA C -6.934 8.341 1.456 1.00 . A A . 44 SER CA 1 1 4 2917 1 1 42 SER CB C -5.415 8.218 1.585 1.00 . A A . 44 SER CB 1 1 4 2918 1 1 42 SER H H -7.063 6.301 0.773 1.00 . A A . 44 SER H 1 1 4 2919 1 1 42 SER HA H -7.335 8.810 2.342 1.00 . A A . 44 SER HA 1 1 4 2920 1 1 42 SER HB2 H -4.967 8.208 0.605 1.00 . A A . 44 SER HB2 1 1 4 2921 1 1 42 SER HB3 H -5.032 9.063 2.143 1.00 . A A . 44 SER HB3 1 1 4 2922 1 1 42 SER HG H -4.785 7.228 3.138 1.00 . A A . 44 SER HG 1 1 4 2923 1 1 42 SER N N -7.530 6.984 1.297 1.00 . A A . 44 SER N 1 1 4 2924 1 1 42 SER O O -6.983 10.373 0.183 1.00 . A A . 44 SER O 1 1 4 2925 1 1 42 SER OG O -5.098 7.006 2.258 1.00 . A A . 44 SER OG 1 1 4 2926 1 1 43 ASN C C -6.968 9.732 -2.753 1.00 . A A . 45 ASN C 1 1 4 2927 1 1 43 ASN CA C -8.243 9.387 -1.981 1.00 . A A . 45 ASN CA 1 1 4 2928 1 1 43 ASN CB C -8.956 10.678 -1.572 1.00 . A A . 45 ASN CB 1 1 4 2929 1 1 43 ASN CG C -9.708 11.249 -2.775 1.00 . A A . 45 ASN CG 1 1 4 2930 1 1 43 ASN H H -8.113 7.656 -0.706 1.00 . A A . 45 ASN H 1 1 4 2931 1 1 43 ASN HA H -8.896 8.797 -2.608 1.00 . A A . 45 ASN HA 1 1 4 2932 1 1 43 ASN HB2 H -9.655 10.467 -0.776 1.00 . A A . 45 ASN HB2 1 1 4 2933 1 1 43 ASN HB3 H -8.228 11.399 -1.230 1.00 . A A . 45 ASN HB3 1 1 4 2934 1 1 43 ASN HD21 H -11.502 10.905 -1.999 1.00 . A A . 45 ASN HD21 1 1 4 2935 1 1 43 ASN HD22 H -11.503 11.626 -3.535 1.00 . A A . 45 ASN HD22 1 1 4 2936 1 1 43 ASN N N -7.888 8.608 -0.762 1.00 . A A . 45 ASN N 1 1 4 2937 1 1 43 ASN ND2 N -11.013 11.261 -2.769 1.00 . A A . 45 ASN ND2 1 1 4 2938 1 1 43 ASN O O -6.955 10.620 -3.583 1.00 . A A . 45 ASN O 1 1 4 2939 1 1 43 ASN OD1 O -9.102 11.691 -3.731 1.00 . A A . 45 ASN OD1 1 1 4 2940 1 1 44 GLY C C -3.761 10.269 -2.353 1.00 . A A . 46 GLY C 1 1 4 2941 1 1 44 GLY CA C -4.622 9.335 -3.203 1.00 . A A . 46 GLY CA 1 1 4 2942 1 1 44 GLY H H -5.923 8.331 -1.811 1.00 . A A . 46 GLY H 1 1 4 2943 1 1 44 GLY HA2 H -4.087 8.412 -3.382 1.00 . A A . 46 GLY HA2 1 1 4 2944 1 1 44 GLY HA3 H -4.841 9.813 -4.147 1.00 . A A . 46 GLY HA3 1 1 4 2945 1 1 44 GLY N N -5.894 9.041 -2.485 1.00 . A A . 46 GLY N 1 1 4 2946 1 1 44 GLY O O -2.874 10.937 -2.849 1.00 . A A . 46 GLY O 1 1 4 2947 1 1 45 THR C C -1.973 10.442 0.296 1.00 . A A . 47 THR C 1 1 4 2948 1 1 45 THR CA C -3.209 11.205 -0.193 1.00 . A A . 47 THR CA 1 1 4 2949 1 1 45 THR CB C -4.066 11.631 1.003 1.00 . A A . 47 THR CB 1 1 4 2950 1 1 45 THR CG2 C -3.176 12.223 2.093 1.00 . A A . 47 THR CG2 1 1 4 2951 1 1 45 THR H H -4.728 9.772 -0.692 1.00 . A A . 47 THR H 1 1 4 2952 1 1 45 THR HA H -2.899 12.079 -0.746 1.00 . A A . 47 THR HA 1 1 4 2953 1 1 45 THR HB H -4.587 10.772 1.396 1.00 . A A . 47 THR HB 1 1 4 2954 1 1 45 THR HG1 H -5.804 12.147 0.299 1.00 . A A . 47 THR HG1 1 1 4 2955 1 1 45 THR HG21 H -2.662 11.425 2.609 1.00 . A A . 47 THR HG21 1 1 4 2956 1 1 45 THR HG22 H -3.784 12.772 2.795 1.00 . A A . 47 THR HG22 1 1 4 2957 1 1 45 THR HG23 H -2.452 12.887 1.645 1.00 . A A . 47 THR HG23 1 1 4 2958 1 1 45 THR N N -4.012 10.320 -1.074 1.00 . A A . 47 THR N 1 1 4 2959 1 1 45 THR O O -1.193 10.944 1.082 1.00 . A A . 47 THR O 1 1 4 2960 1 1 45 THR OG1 O -5.010 12.606 0.582 1.00 . A A . 47 THR OG1 1 1 4 2961 1 1 46 LEU C C 0.419 8.364 -0.858 1.00 . A A . 48 LEU C 1 1 4 2962 1 1 46 LEU CA C -0.602 8.443 0.280 1.00 . A A . 48 LEU CA 1 1 4 2963 1 1 46 LEU CB C -1.042 7.030 0.671 1.00 . A A . 48 LEU CB 1 1 4 2964 1 1 46 LEU CD1 C -0.682 7.349 3.124 1.00 . A A . 48 LEU CD1 1 1 4 2965 1 1 46 LEU CD2 C -0.482 5.071 2.121 1.00 . A A . 48 LEU CD2 1 1 4 2966 1 1 46 LEU CG C -0.239 6.565 1.888 1.00 . A A . 48 LEU CG 1 1 4 2967 1 1 46 LEU H H -2.425 8.842 -0.794 1.00 . A A . 48 LEU H 1 1 4 2968 1 1 46 LEU HA H -0.150 8.927 1.134 1.00 . A A . 48 LEU HA 1 1 4 2969 1 1 46 LEU HB2 H -2.095 7.034 0.912 1.00 . A A . 48 LEU HB2 1 1 4 2970 1 1 46 LEU HB3 H -0.864 6.356 -0.154 1.00 . A A . 48 LEU HB3 1 1 4 2971 1 1 46 LEU HD11 H -0.257 6.899 4.008 1.00 . A A . 48 LEU HD11 1 1 4 2972 1 1 46 LEU HD12 H -1.761 7.332 3.193 1.00 . A A . 48 LEU HD12 1 1 4 2973 1 1 46 LEU HD13 H -0.343 8.371 3.042 1.00 . A A . 48 LEU HD13 1 1 4 2974 1 1 46 LEU HD21 H -0.291 4.833 3.157 1.00 . A A . 48 LEU HD21 1 1 4 2975 1 1 46 LEU HD22 H 0.181 4.497 1.491 1.00 . A A . 48 LEU HD22 1 1 4 2976 1 1 46 LEU HD23 H -1.507 4.832 1.879 1.00 . A A . 48 LEU HD23 1 1 4 2977 1 1 46 LEU HG H 0.813 6.737 1.711 1.00 . A A . 48 LEU HG 1 1 4 2978 1 1 46 LEU N N -1.787 9.232 -0.161 1.00 . A A . 48 LEU N 1 1 4 2979 1 1 46 LEU O O 0.121 8.674 -1.995 1.00 . A A . 48 LEU O 1 1 4 2980 1 1 47 THR C C 3.653 6.735 -1.254 1.00 . A A . 49 THR C 1 1 4 2981 1 1 47 THR CA C 2.670 7.857 -1.614 1.00 . A A . 49 THR CA 1 1 4 2982 1 1 47 THR CB C 3.410 9.196 -1.705 1.00 . A A . 49 THR CB 1 1 4 2983 1 1 47 THR CG2 C 2.547 10.211 -2.459 1.00 . A A . 49 THR CG2 1 1 4 2984 1 1 47 THR H H 1.839 7.711 0.366 1.00 . A A . 49 THR H 1 1 4 2985 1 1 47 THR HA H 2.211 7.640 -2.564 1.00 . A A . 49 THR HA 1 1 4 2986 1 1 47 THR HB H 4.335 9.062 -2.235 1.00 . A A . 49 THR HB 1 1 4 2987 1 1 47 THR HG1 H 3.681 10.639 -0.429 1.00 . A A . 49 THR HG1 1 1 4 2988 1 1 47 THR HG21 H 2.515 9.949 -3.505 1.00 . A A . 49 THR HG21 1 1 4 2989 1 1 47 THR HG22 H 2.973 11.197 -2.348 1.00 . A A . 49 THR HG22 1 1 4 2990 1 1 47 THR HG23 H 1.547 10.204 -2.055 1.00 . A A . 49 THR HG23 1 1 4 2991 1 1 47 THR N N 1.622 7.954 -0.557 1.00 . A A . 49 THR N 1 1 4 2992 1 1 47 THR O O 3.355 5.873 -0.451 1.00 . A A . 49 THR O 1 1 4 2993 1 1 47 THR OG1 O 3.677 9.679 -0.396 1.00 . A A . 49 THR OG1 1 1 4 2994 1 1 48 LEU C C 7.138 6.357 -1.127 1.00 . A A . 50 LEU C 1 1 4 2995 1 1 48 LEU CA C 5.828 5.682 -1.548 1.00 . A A . 50 LEU CA 1 1 4 2996 1 1 48 LEU CB C 6.061 4.843 -2.807 1.00 . A A . 50 LEU CB 1 1 4 2997 1 1 48 LEU CD1 C 6.061 2.707 -1.514 1.00 . A A . 50 LEU CD1 1 1 4 2998 1 1 48 LEU CD2 C 7.194 2.824 -3.737 1.00 . A A . 50 LEU CD2 1 1 4 2999 1 1 48 LEU CG C 6.874 3.597 -2.455 1.00 . A A . 50 LEU CG 1 1 4 3000 1 1 48 LEU H H 5.031 7.437 -2.491 1.00 . A A . 50 LEU H 1 1 4 3001 1 1 48 LEU HA H 5.471 5.050 -0.749 1.00 . A A . 50 LEU HA 1 1 4 3002 1 1 48 LEU HB2 H 5.109 4.545 -3.220 1.00 . A A . 50 LEU HB2 1 1 4 3003 1 1 48 LEU HB3 H 6.600 5.429 -3.535 1.00 . A A . 50 LEU HB3 1 1 4 3004 1 1 48 LEU HD11 H 5.937 1.731 -1.960 1.00 . A A . 50 LEU HD11 1 1 4 3005 1 1 48 LEU HD12 H 5.092 3.152 -1.346 1.00 . A A . 50 LEU HD12 1 1 4 3006 1 1 48 LEU HD13 H 6.582 2.610 -0.572 1.00 . A A . 50 LEU HD13 1 1 4 3007 1 1 48 LEU HD21 H 6.802 3.362 -4.589 1.00 . A A . 50 LEU HD21 1 1 4 3008 1 1 48 LEU HD22 H 6.740 1.846 -3.690 1.00 . A A . 50 LEU HD22 1 1 4 3009 1 1 48 LEU HD23 H 8.264 2.721 -3.838 1.00 . A A . 50 LEU HD23 1 1 4 3010 1 1 48 LEU HG H 7.794 3.891 -1.972 1.00 . A A . 50 LEU HG 1 1 4 3011 1 1 48 LEU N N 4.818 6.738 -1.846 1.00 . A A . 50 LEU N 1 1 4 3012 1 1 48 LEU O O 7.337 7.532 -1.365 1.00 . A A . 50 LEU O 1 1 4 3013 1 1 49 SER C C 10.489 5.314 -0.224 1.00 . A A . 51 SER C 1 1 4 3014 1 1 49 SER CA C 9.311 6.282 -0.070 1.00 . A A . 51 SER CA 1 1 4 3015 1 1 49 SER CB C 9.202 6.702 1.395 1.00 . A A . 51 SER CB 1 1 4 3016 1 1 49 SER H H 7.862 4.696 -0.301 1.00 . A A . 51 SER H 1 1 4 3017 1 1 49 SER HA H 9.491 7.157 -0.675 1.00 . A A . 51 SER HA 1 1 4 3018 1 1 49 SER HB2 H 8.367 6.198 1.854 1.00 . A A . 51 SER HB2 1 1 4 3019 1 1 49 SER HB3 H 10.112 6.430 1.915 1.00 . A A . 51 SER HB3 1 1 4 3020 1 1 49 SER HG H 8.355 8.348 0.798 1.00 . A A . 51 SER HG 1 1 4 3021 1 1 49 SER N N 8.033 5.640 -0.498 1.00 . A A . 51 SER N 1 1 4 3022 1 1 49 SER O O 11.610 5.729 -0.447 1.00 . A A . 51 SER O 1 1 4 3023 1 1 49 SER OG O 9.002 8.107 1.465 1.00 . A A . 51 SER OG 1 1 4 3024 1 1 50 HIS C C 10.885 1.713 -0.685 1.00 . A A . 52 HIS C 1 1 4 3025 1 1 50 HIS CA C 11.398 3.078 -0.216 1.00 . A A . 52 HIS CA 1 1 4 3026 1 1 50 HIS CB C 12.089 2.944 1.151 1.00 . A A . 52 HIS CB 1 1 4 3027 1 1 50 HIS CD2 C 13.912 1.145 0.542 1.00 . A A . 52 HIS CD2 1 1 4 3028 1 1 50 HIS CE1 C 13.320 -0.386 1.956 1.00 . A A . 52 HIS CE1 1 1 4 3029 1 1 50 HIS CG C 12.836 1.638 1.237 1.00 . A A . 52 HIS CG 1 1 4 3030 1 1 50 HIS H H 9.363 3.707 0.100 1.00 . A A . 52 HIS H 1 1 4 3031 1 1 50 HIS HA H 12.107 3.458 -0.937 1.00 . A A . 52 HIS HA 1 1 4 3032 1 1 50 HIS HB2 H 12.783 3.762 1.282 1.00 . A A . 52 HIS HB2 1 1 4 3033 1 1 50 HIS HB3 H 11.343 2.981 1.931 1.00 . A A . 52 HIS HB3 1 1 4 3034 1 1 50 HIS HD1 H 11.743 0.689 2.782 1.00 . A A . 52 HIS HD1 1 1 4 3035 1 1 50 HIS HD2 H 14.442 1.670 -0.239 1.00 . A A . 52 HIS HD2 1 1 4 3036 1 1 50 HIS HE1 H 13.273 -1.306 2.517 1.00 . A A . 52 HIS HE1 1 1 4 3037 1 1 50 HIS N N 10.264 4.035 -0.092 1.00 . A A . 52 HIS N 1 1 4 3038 1 1 50 HIS ND1 N 12.477 0.646 2.134 1.00 . A A . 52 HIS ND1 1 1 4 3039 1 1 50 HIS NE2 N 14.216 -0.135 0.997 1.00 . A A . 52 HIS NE2 1 1 4 3040 1 1 50 HIS O O 10.555 0.855 0.110 1.00 . A A . 52 HIS O 1 1 4 3041 1 1 51 PHE C C 11.032 -0.934 -1.694 1.00 . A A . 53 PHE C 1 1 4 3042 1 1 51 PHE CA C 10.364 0.191 -2.492 1.00 . A A . 53 PHE CA 1 1 4 3043 1 1 51 PHE CB C 10.753 0.067 -3.968 1.00 . A A . 53 PHE CB 1 1 4 3044 1 1 51 PHE CD1 C 8.989 -1.398 -5.009 1.00 . A A . 53 PHE CD1 1 1 4 3045 1 1 51 PHE CD2 C 8.884 0.995 -5.383 1.00 . A A . 53 PHE CD2 1 1 4 3046 1 1 51 PHE CE1 C 7.837 -1.571 -5.787 1.00 . A A . 53 PHE CE1 1 1 4 3047 1 1 51 PHE CE2 C 7.732 0.823 -6.160 1.00 . A A . 53 PHE CE2 1 1 4 3048 1 1 51 PHE CG C 9.511 -0.116 -4.807 1.00 . A A . 53 PHE CG 1 1 4 3049 1 1 51 PHE CZ C 7.210 -0.460 -6.363 1.00 . A A . 53 PHE CZ 1 1 4 3050 1 1 51 PHE H H 11.115 2.206 -2.590 1.00 . A A . 53 PHE H 1 1 4 3051 1 1 51 PHE HA H 9.290 0.120 -2.392 1.00 . A A . 53 PHE HA 1 1 4 3052 1 1 51 PHE HB2 H 11.269 0.963 -4.279 1.00 . A A . 53 PHE HB2 1 1 4 3053 1 1 51 PHE HB3 H 11.404 -0.785 -4.098 1.00 . A A . 53 PHE HB3 1 1 4 3054 1 1 51 PHE HD1 H 9.474 -2.255 -4.565 1.00 . A A . 53 PHE HD1 1 1 4 3055 1 1 51 PHE HD2 H 9.288 1.985 -5.228 1.00 . A A . 53 PHE HD2 1 1 4 3056 1 1 51 PHE HE1 H 7.434 -2.560 -5.943 1.00 . A A . 53 PHE HE1 1 1 4 3057 1 1 51 PHE HE2 H 7.248 1.679 -6.606 1.00 . A A . 53 PHE HE2 1 1 4 3058 1 1 51 PHE HZ H 6.322 -0.593 -6.963 1.00 . A A . 53 PHE HZ 1 1 4 3059 1 1 51 PHE N N 10.833 1.503 -1.969 1.00 . A A . 53 PHE N 1 1 4 3060 1 1 51 PHE O O 12.141 -1.337 -1.984 1.00 . A A . 53 PHE O 1 1 4 3061 1 1 52 GLY C C 10.488 -2.422 1.570 1.00 . A A . 54 GLY C 1 1 4 3062 1 1 52 GLY CA C 10.978 -2.532 0.125 1.00 . A A . 54 GLY CA 1 1 4 3063 1 1 52 GLY H H 9.480 -1.099 -0.469 1.00 . A A . 54 GLY H 1 1 4 3064 1 1 52 GLY HA2 H 10.685 -3.489 -0.283 1.00 . A A . 54 GLY HA2 1 1 4 3065 1 1 52 GLY HA3 H 12.053 -2.444 0.104 1.00 . A A . 54 GLY HA3 1 1 4 3066 1 1 52 GLY N N 10.371 -1.439 -0.690 1.00 . A A . 54 GLY N 1 1 4 3067 1 1 52 GLY O O 9.873 -1.448 1.954 1.00 . A A . 54 GLY O 1 1 4 3068 1 1 53 LYS C C 10.987 -2.196 4.508 1.00 . A A . 55 LYS C 1 1 4 3069 1 1 53 LYS CA C 10.304 -3.364 3.794 1.00 . A A . 55 LYS CA 1 1 4 3070 1 1 53 LYS CB C 10.673 -4.673 4.493 1.00 . A A . 55 LYS CB 1 1 4 3071 1 1 53 LYS CD C 12.580 -6.051 5.331 1.00 . A A . 55 LYS CD 1 1 4 3072 1 1 53 LYS CE C 14.085 -6.307 5.210 1.00 . A A . 55 LYS CE 1 1 4 3073 1 1 53 LYS CG C 12.189 -4.870 4.443 1.00 . A A . 55 LYS CG 1 1 4 3074 1 1 53 LYS H H 11.253 -4.192 2.046 1.00 . A A . 55 LYS H 1 1 4 3075 1 1 53 LYS HA H 9.233 -3.228 3.826 1.00 . A A . 55 LYS HA 1 1 4 3076 1 1 53 LYS HB2 H 10.348 -4.635 5.524 1.00 . A A . 55 LYS HB2 1 1 4 3077 1 1 53 LYS HB3 H 10.189 -5.498 3.993 1.00 . A A . 55 LYS HB3 1 1 4 3078 1 1 53 LYS HD2 H 12.334 -5.825 6.358 1.00 . A A . 55 LYS HD2 1 1 4 3079 1 1 53 LYS HD3 H 12.041 -6.932 5.017 1.00 . A A . 55 LYS HD3 1 1 4 3080 1 1 53 LYS HE2 H 14.613 -5.365 5.233 1.00 . A A . 55 LYS HE2 1 1 4 3081 1 1 53 LYS HE3 H 14.411 -6.923 6.035 1.00 . A A . 55 LYS HE3 1 1 4 3082 1 1 53 LYS HG2 H 12.492 -5.067 3.424 1.00 . A A . 55 LYS HG2 1 1 4 3083 1 1 53 LYS HG3 H 12.681 -3.976 4.798 1.00 . A A . 55 LYS HG3 1 1 4 3084 1 1 53 LYS HZ1 H 13.490 -7.111 3.384 1.00 . A A . 55 LYS HZ1 1 1 4 3085 1 1 53 LYS HZ2 H 14.772 -7.945 4.123 1.00 . A A . 55 LYS HZ2 1 1 4 3086 1 1 53 LYS HZ3 H 15.051 -6.446 3.370 1.00 . A A . 55 LYS HZ3 1 1 4 3087 1 1 53 LYS N N 10.756 -3.414 2.375 1.00 . A A . 55 LYS N 1 1 4 3088 1 1 53 LYS NZ N 14.371 -7.004 3.925 1.00 . A A . 55 LYS NZ 1 1 4 3089 1 1 53 LYS O O 12.173 -1.974 4.361 1.00 . A A . 55 LYS O 1 1 4 3090 1 1 54 CYS C C 11.083 -0.685 7.471 1.00 . A A . 56 CYS C 1 1 4 3091 1 1 54 CYS CA C 10.854 -0.299 6.008 1.00 . A A . 56 CYS CA 1 1 4 3092 1 1 54 CYS CB C 9.908 0.903 5.939 1.00 . A A . 56 CYS CB 1 1 4 3093 1 1 54 CYS H H 9.294 -1.648 5.389 1.00 . A A . 56 CYS H 1 1 4 3094 1 1 54 CYS HA H 11.798 -0.041 5.552 1.00 . A A . 56 CYS HA 1 1 4 3095 1 1 54 CYS HB2 H 9.030 0.638 5.370 1.00 . A A . 56 CYS HB2 1 1 4 3096 1 1 54 CYS HB3 H 9.617 1.189 6.939 1.00 . A A . 56 CYS HB3 1 1 4 3097 1 1 54 CYS N N 10.248 -1.450 5.283 1.00 . A A . 56 CYS N 1 1 4 3098 1 1 54 CYS O O 10.116 -0.717 8.213 1.00 . A A . 56 CYS O 1 1 4 3099 1 1 54 CYS OXT O 12.222 -0.946 7.822 1.00 . A A . 56 CYS OXT 1 1 4 3100 1 1 54 CYS SG S 10.753 2.290 5.139 1.00 . A A . 56 CYS SG 1 1 5 3101 1 1 1 ALA C C 5.752 8.865 -9.292 1.00 . A A . 3 ALA C 1 1 5 3102 1 1 1 ALA CA C 5.753 9.953 -8.217 1.00 . A A . 3 ALA CA 1 1 5 3103 1 1 1 ALA CB C 7.174 10.497 -8.046 1.00 . A A . 3 ALA CB 1 1 5 3104 1 1 1 ALA H1 H 4.840 10.123 -6.353 1.00 . A A . 3 ALA H1 1 1 5 3105 1 1 1 ALA H2 H 6.090 8.974 -6.410 1.00 . A A . 3 ALA H2 1 1 5 3106 1 1 1 ALA H3 H 4.582 8.630 -7.115 1.00 . A A . 3 ALA H3 1 1 5 3107 1 1 1 ALA HA H 5.094 10.755 -8.515 1.00 . A A . 3 ALA HA 1 1 5 3108 1 1 1 ALA HB1 H 7.379 11.218 -8.823 1.00 . A A . 3 ALA HB1 1 1 5 3109 1 1 1 ALA HB2 H 7.881 9.684 -8.113 1.00 . A A . 3 ALA HB2 1 1 5 3110 1 1 1 ALA HB3 H 7.264 10.973 -7.080 1.00 . A A . 3 ALA HB3 1 1 5 3111 1 1 1 ALA N N 5.281 9.377 -6.927 1.00 . A A . 3 ALA N 1 1 5 3112 1 1 1 ALA O O 5.351 9.091 -10.416 1.00 . A A . 3 ALA O 1 1 5 3113 1 1 2 VAL C C 4.801 6.343 -10.480 1.00 . A A . 4 VAL C 1 1 5 3114 1 1 2 VAL CA C 6.219 6.585 -9.958 1.00 . A A . 4 VAL CA 1 1 5 3115 1 1 2 VAL CB C 6.747 5.308 -9.305 1.00 . A A . 4 VAL CB 1 1 5 3116 1 1 2 VAL CG1 C 5.915 4.987 -8.062 1.00 . A A . 4 VAL CG1 1 1 5 3117 1 1 2 VAL CG2 C 6.649 4.149 -10.300 1.00 . A A . 4 VAL CG2 1 1 5 3118 1 1 2 VAL H H 6.514 7.523 -8.042 1.00 . A A . 4 VAL H 1 1 5 3119 1 1 2 VAL HA H 6.861 6.861 -10.781 1.00 . A A . 4 VAL HA 1 1 5 3120 1 1 2 VAL HB H 7.779 5.452 -9.019 1.00 . A A . 4 VAL HB 1 1 5 3121 1 1 2 VAL HG11 H 6.172 4.002 -7.702 1.00 . A A . 4 VAL HG11 1 1 5 3122 1 1 2 VAL HG12 H 4.866 5.016 -8.313 1.00 . A A . 4 VAL HG12 1 1 5 3123 1 1 2 VAL HG13 H 6.122 5.716 -7.292 1.00 . A A . 4 VAL HG13 1 1 5 3124 1 1 2 VAL HG21 H 7.269 3.331 -9.964 1.00 . A A . 4 VAL HG21 1 1 5 3125 1 1 2 VAL HG22 H 6.985 4.481 -11.272 1.00 . A A . 4 VAL HG22 1 1 5 3126 1 1 2 VAL HG23 H 5.623 3.819 -10.368 1.00 . A A . 4 VAL HG23 1 1 5 3127 1 1 2 VAL N N 6.197 7.686 -8.955 1.00 . A A . 4 VAL N 1 1 5 3128 1 1 2 VAL O O 3.830 6.748 -9.872 1.00 . A A . 4 VAL O 1 1 5 3129 1 1 3 SER C C 2.696 4.218 -11.459 1.00 . A A . 5 SER C 1 1 5 3130 1 1 3 SER CA C 3.315 5.430 -12.157 1.00 . A A . 5 SER CA 1 1 5 3131 1 1 3 SER CB C 3.421 5.151 -13.658 1.00 . A A . 5 SER CB 1 1 5 3132 1 1 3 SER H H 5.468 5.371 -12.077 1.00 . A A . 5 SER H 1 1 5 3133 1 1 3 SER HA H 2.691 6.295 -11.995 1.00 . A A . 5 SER HA 1 1 5 3134 1 1 3 SER HB2 H 4.023 4.274 -13.823 1.00 . A A . 5 SER HB2 1 1 5 3135 1 1 3 SER HB3 H 2.431 4.986 -14.062 1.00 . A A . 5 SER HB3 1 1 5 3136 1 1 3 SER HG H 4.698 5.930 -14.902 1.00 . A A . 5 SER HG 1 1 5 3137 1 1 3 SER N N 4.673 5.689 -11.601 1.00 . A A . 5 SER N 1 1 5 3138 1 1 3 SER O O 3.316 3.183 -11.319 1.00 . A A . 5 SER O 1 1 5 3139 1 1 3 SER OG O 4.029 6.264 -14.300 1.00 . A A . 5 SER OG 1 1 5 3140 1 1 4 VAL C C -0.627 3.066 -10.846 1.00 . A A . 6 VAL C 1 1 5 3141 1 1 4 VAL CA C 0.809 3.199 -10.334 1.00 . A A . 6 VAL CA 1 1 5 3142 1 1 4 VAL CB C 0.794 3.451 -8.825 1.00 . A A . 6 VAL CB 1 1 5 3143 1 1 4 VAL CG1 C -0.135 4.623 -8.511 1.00 . A A . 6 VAL CG1 1 1 5 3144 1 1 4 VAL CG2 C 0.292 2.196 -8.106 1.00 . A A . 6 VAL CG2 1 1 5 3145 1 1 4 VAL H H 0.991 5.184 -11.145 1.00 . A A . 6 VAL H 1 1 5 3146 1 1 4 VAL HA H 1.352 2.288 -10.541 1.00 . A A . 6 VAL HA 1 1 5 3147 1 1 4 VAL HB H 1.794 3.684 -8.490 1.00 . A A . 6 VAL HB 1 1 5 3148 1 1 4 VAL HG11 H 0.422 5.399 -8.007 1.00 . A A . 6 VAL HG11 1 1 5 3149 1 1 4 VAL HG12 H -0.938 4.286 -7.873 1.00 . A A . 6 VAL HG12 1 1 5 3150 1 1 4 VAL HG13 H -0.546 5.014 -9.430 1.00 . A A . 6 VAL HG13 1 1 5 3151 1 1 4 VAL HG21 H -0.779 2.122 -8.219 1.00 . A A . 6 VAL HG21 1 1 5 3152 1 1 4 VAL HG22 H 0.539 2.260 -7.057 1.00 . A A . 6 VAL HG22 1 1 5 3153 1 1 4 VAL HG23 H 0.761 1.323 -8.535 1.00 . A A . 6 VAL HG23 1 1 5 3154 1 1 4 VAL N N 1.473 4.340 -11.020 1.00 . A A . 6 VAL N 1 1 5 3155 1 1 4 VAL O O -1.221 4.020 -11.308 1.00 . A A . 6 VAL O 1 1 5 3156 1 1 5 ASP C C -3.519 1.480 -10.073 1.00 . A A . 7 ASP C 1 1 5 3157 1 1 5 ASP CA C -2.582 1.699 -11.262 1.00 . A A . 7 ASP CA 1 1 5 3158 1 1 5 ASP CB C -2.636 0.481 -12.185 1.00 . A A . 7 ASP CB 1 1 5 3159 1 1 5 ASP CG C -1.946 -0.704 -11.507 1.00 . A A . 7 ASP CG 1 1 5 3160 1 1 5 ASP H H -0.691 1.132 -10.401 1.00 . A A . 7 ASP H 1 1 5 3161 1 1 5 ASP HA H -2.895 2.577 -11.808 1.00 . A A . 7 ASP HA 1 1 5 3162 1 1 5 ASP HB2 H -3.667 0.230 -12.389 1.00 . A A . 7 ASP HB2 1 1 5 3163 1 1 5 ASP HB3 H -2.130 0.707 -13.112 1.00 . A A . 7 ASP HB3 1 1 5 3164 1 1 5 ASP N N -1.187 1.890 -10.773 1.00 . A A . 7 ASP N 1 1 5 3165 1 1 5 ASP O O -3.678 0.377 -9.591 1.00 . A A . 7 ASP O 1 1 5 3166 1 1 5 ASP OD1 O -0.742 -0.829 -11.657 1.00 . A A . 7 ASP OD1 1 1 5 3167 1 1 5 ASP OD2 O -2.634 -1.467 -10.848 1.00 . A A . 7 ASP OD2 1 1 5 3168 1 1 6 CYS C C -6.359 3.159 -8.730 1.00 . A A . 8 CYS C 1 1 5 3169 1 1 6 CYS CA C -5.077 2.376 -8.447 1.00 . A A . 8 CYS CA 1 1 5 3170 1 1 6 CYS CB C -4.414 2.916 -7.177 1.00 . A A . 8 CYS CB 1 1 5 3171 1 1 6 CYS H H -4.005 3.403 -10.008 1.00 . A A . 8 CYS H 1 1 5 3172 1 1 6 CYS HA H -5.317 1.333 -8.311 1.00 . A A . 8 CYS HA 1 1 5 3173 1 1 6 CYS HB2 H -3.352 2.725 -7.216 1.00 . A A . 8 CYS HB2 1 1 5 3174 1 1 6 CYS HB3 H -4.586 3.981 -7.108 1.00 . A A . 8 CYS HB3 1 1 5 3175 1 1 6 CYS N N -4.144 2.523 -9.600 1.00 . A A . 8 CYS N 1 1 5 3176 1 1 6 CYS O O -7.062 3.563 -7.828 1.00 . A A . 8 CYS O 1 1 5 3177 1 1 6 CYS SG S -5.125 2.095 -5.727 1.00 . A A . 8 CYS SG 1 1 5 3178 1 1 7 SER C C -9.118 3.360 -9.822 1.00 . A A . 9 SER C 1 1 5 3179 1 1 7 SER CA C -7.901 4.120 -10.342 1.00 . A A . 9 SER CA 1 1 5 3180 1 1 7 SER CB C -7.994 4.248 -11.864 1.00 . A A . 9 SER CB 1 1 5 3181 1 1 7 SER H H -6.084 3.031 -10.686 1.00 . A A . 9 SER H 1 1 5 3182 1 1 7 SER HA H -7.871 5.104 -9.897 1.00 . A A . 9 SER HA 1 1 5 3183 1 1 7 SER HB2 H -7.229 4.918 -12.218 1.00 . A A . 9 SER HB2 1 1 5 3184 1 1 7 SER HB3 H -7.853 3.274 -12.315 1.00 . A A . 9 SER HB3 1 1 5 3185 1 1 7 SER HG H -9.387 4.651 -13.161 1.00 . A A . 9 SER HG 1 1 5 3186 1 1 7 SER N N -6.666 3.370 -9.982 1.00 . A A . 9 SER N 1 1 5 3187 1 1 7 SER O O -9.710 2.557 -10.517 1.00 . A A . 9 SER O 1 1 5 3188 1 1 7 SER OG O -9.270 4.768 -12.216 1.00 . A A . 9 SER OG 1 1 5 3189 1 1 8 GLU C C -10.389 1.394 -8.000 1.00 . A A . 10 GLU C 1 1 5 3190 1 1 8 GLU CA C -10.667 2.897 -8.022 1.00 . A A . 10 GLU CA 1 1 5 3191 1 1 8 GLU CB C -11.906 3.171 -8.879 1.00 . A A . 10 GLU CB 1 1 5 3192 1 1 8 GLU CD C -12.261 5.524 -8.116 1.00 . A A . 10 GLU CD 1 1 5 3193 1 1 8 GLU CG C -11.913 4.638 -9.313 1.00 . A A . 10 GLU CG 1 1 5 3194 1 1 8 GLU H H -8.997 4.253 -8.062 1.00 . A A . 10 GLU H 1 1 5 3195 1 1 8 GLU HA H -10.840 3.247 -7.015 1.00 . A A . 10 GLU HA 1 1 5 3196 1 1 8 GLU HB2 H -11.886 2.536 -9.753 1.00 . A A . 10 GLU HB2 1 1 5 3197 1 1 8 GLU HB3 H -12.795 2.963 -8.303 1.00 . A A . 10 GLU HB3 1 1 5 3198 1 1 8 GLU HG2 H -10.936 4.907 -9.689 1.00 . A A . 10 GLU HG2 1 1 5 3199 1 1 8 GLU HG3 H -12.651 4.780 -10.089 1.00 . A A . 10 GLU HG3 1 1 5 3200 1 1 8 GLU N N -9.492 3.604 -8.601 1.00 . A A . 10 GLU N 1 1 5 3201 1 1 8 GLU O O -11.211 0.595 -8.405 1.00 . A A . 10 GLU O 1 1 5 3202 1 1 8 GLU OE1 O -12.955 5.048 -7.232 1.00 . A A . 10 GLU OE1 1 1 5 3203 1 1 8 GLU OE2 O -11.827 6.664 -8.102 1.00 . A A . 10 GLU OE2 1 1 5 3204 1 1 9 TYR C C -8.385 -0.828 -6.093 1.00 . A A . 11 TYR C 1 1 5 3205 1 1 9 TYR CA C -8.911 -0.451 -7.484 1.00 . A A . 11 TYR CA 1 1 5 3206 1 1 9 TYR CB C -7.838 -0.757 -8.535 1.00 . A A . 11 TYR CB 1 1 5 3207 1 1 9 TYR CD1 C -8.621 -3.155 -8.392 1.00 . A A . 11 TYR CD1 1 1 5 3208 1 1 9 TYR CD2 C -6.276 -2.715 -8.826 1.00 . A A . 11 TYR CD2 1 1 5 3209 1 1 9 TYR CE1 C -8.371 -4.532 -8.441 1.00 . A A . 11 TYR CE1 1 1 5 3210 1 1 9 TYR CE2 C -6.027 -4.091 -8.875 1.00 . A A . 11 TYR CE2 1 1 5 3211 1 1 9 TYR CG C -7.574 -2.245 -8.584 1.00 . A A . 11 TYR CG 1 1 5 3212 1 1 9 TYR CZ C -7.075 -5.000 -8.683 1.00 . A A . 11 TYR CZ 1 1 5 3213 1 1 9 TYR H H -8.587 1.661 -7.208 1.00 . A A . 11 TYR H 1 1 5 3214 1 1 9 TYR HA H -9.800 -1.024 -7.701 1.00 . A A . 11 TYR HA 1 1 5 3215 1 1 9 TYR HB2 H -8.180 -0.420 -9.503 1.00 . A A . 11 TYR HB2 1 1 5 3216 1 1 9 TYR HB3 H -6.927 -0.240 -8.276 1.00 . A A . 11 TYR HB3 1 1 5 3217 1 1 9 TYR HD1 H -9.623 -2.797 -8.207 1.00 . A A . 11 TYR HD1 1 1 5 3218 1 1 9 TYR HD2 H -5.468 -2.014 -8.975 1.00 . A A . 11 TYR HD2 1 1 5 3219 1 1 9 TYR HE1 H -9.179 -5.233 -8.292 1.00 . A A . 11 TYR HE1 1 1 5 3220 1 1 9 TYR HE2 H -5.027 -4.453 -9.061 1.00 . A A . 11 TYR HE2 1 1 5 3221 1 1 9 TYR HH H -6.331 -6.597 -7.948 1.00 . A A . 11 TYR HH 1 1 5 3222 1 1 9 TYR N N -9.237 1.001 -7.529 1.00 . A A . 11 TYR N 1 1 5 3223 1 1 9 TYR O O -7.293 -1.346 -5.969 1.00 . A A . 11 TYR O 1 1 5 3224 1 1 9 TYR OH O -6.830 -6.357 -8.732 1.00 . A A . 11 TYR OH 1 1 5 3225 1 1 10 PRO C C -9.026 -2.370 -3.420 1.00 . A A . 12 PRO C 1 1 5 3226 1 1 10 PRO CA C -8.820 -0.879 -3.692 1.00 . A A . 12 PRO CA 1 1 5 3227 1 1 10 PRO CB C -9.798 -0.042 -2.865 1.00 . A A . 12 PRO CB 1 1 5 3228 1 1 10 PRO CD C -10.508 0.067 -5.233 1.00 . A A . 12 PRO CD 1 1 5 3229 1 1 10 PRO CG C -11.006 0.245 -3.786 1.00 . A A . 12 PRO CG 1 1 5 3230 1 1 10 PRO HA H -7.806 -0.584 -3.480 1.00 . A A . 12 PRO HA 1 1 5 3231 1 1 10 PRO HB2 H -10.115 -0.599 -1.993 1.00 . A A . 12 PRO HB2 1 1 5 3232 1 1 10 PRO HB3 H -9.336 0.886 -2.569 1.00 . A A . 12 PRO HB3 1 1 5 3233 1 1 10 PRO HD2 H -11.178 -0.577 -5.788 1.00 . A A . 12 PRO HD2 1 1 5 3234 1 1 10 PRO HD3 H -10.412 1.024 -5.712 1.00 . A A . 12 PRO HD3 1 1 5 3235 1 1 10 PRO HG2 H -11.804 -0.454 -3.577 1.00 . A A . 12 PRO HG2 1 1 5 3236 1 1 10 PRO HG3 H -11.351 1.257 -3.642 1.00 . A A . 12 PRO HG3 1 1 5 3237 1 1 10 PRO N N -9.181 -0.565 -5.084 1.00 . A A . 12 PRO N 1 1 5 3238 1 1 10 PRO O O -9.761 -3.041 -4.115 1.00 . A A . 12 PRO O 1 1 5 3239 1 1 11 LYS C C -8.014 -4.631 -0.700 1.00 . A A . 13 LYS C 1 1 5 3240 1 1 11 LYS CA C -8.554 -4.340 -2.100 1.00 . A A . 13 LYS CA 1 1 5 3241 1 1 11 LYS CB C -7.786 -5.176 -3.124 1.00 . A A . 13 LYS CB 1 1 5 3242 1 1 11 LYS CD C -8.660 -6.966 -4.637 1.00 . A A . 13 LYS CD 1 1 5 3243 1 1 11 LYS CE C -7.733 -7.217 -5.828 1.00 . A A . 13 LYS CE 1 1 5 3244 1 1 11 LYS CG C -8.693 -5.469 -4.319 1.00 . A A . 13 LYS CG 1 1 5 3245 1 1 11 LYS H H -7.801 -2.334 -1.862 1.00 . A A . 13 LYS H 1 1 5 3246 1 1 11 LYS HA H -9.601 -4.597 -2.141 1.00 . A A . 13 LYS HA 1 1 5 3247 1 1 11 LYS HB2 H -6.915 -4.629 -3.455 1.00 . A A . 13 LYS HB2 1 1 5 3248 1 1 11 LYS HB3 H -7.478 -6.106 -2.671 1.00 . A A . 13 LYS HB3 1 1 5 3249 1 1 11 LYS HD2 H -8.299 -7.509 -3.776 1.00 . A A . 13 LYS HD2 1 1 5 3250 1 1 11 LYS HD3 H -9.656 -7.303 -4.883 1.00 . A A . 13 LYS HD3 1 1 5 3251 1 1 11 LYS HE2 H -8.240 -6.951 -6.743 1.00 . A A . 13 LYS HE2 1 1 5 3252 1 1 11 LYS HE3 H -6.841 -6.616 -5.723 1.00 . A A . 13 LYS HE3 1 1 5 3253 1 1 11 LYS HG2 H -9.704 -5.173 -4.081 1.00 . A A . 13 LYS HG2 1 1 5 3254 1 1 11 LYS HG3 H -8.347 -4.911 -5.176 1.00 . A A . 13 LYS HG3 1 1 5 3255 1 1 11 LYS HZ1 H -6.548 -8.788 -6.511 1.00 . A A . 13 LYS HZ1 1 1 5 3256 1 1 11 LYS HZ2 H -8.166 -9.217 -6.214 1.00 . A A . 13 LYS HZ2 1 1 5 3257 1 1 11 LYS HZ3 H -7.095 -8.977 -4.917 1.00 . A A . 13 LYS HZ3 1 1 5 3258 1 1 11 LYS N N -8.388 -2.893 -2.412 1.00 . A A . 13 LYS N 1 1 5 3259 1 1 11 LYS NZ N -7.357 -8.659 -5.871 1.00 . A A . 13 LYS NZ 1 1 5 3260 1 1 11 LYS O O -6.840 -4.884 -0.516 1.00 . A A . 13 LYS O 1 1 5 3261 1 1 12 CYS C C -8.613 -6.370 1.981 1.00 . A A . 14 CYS C 1 1 5 3262 1 1 12 CYS CA C -8.399 -4.888 1.673 1.00 . A A . 14 CYS CA 1 1 5 3263 1 1 12 CYS CB C -9.197 -4.034 2.659 1.00 . A A . 14 CYS CB 1 1 5 3264 1 1 12 CYS H H -9.807 -4.405 0.119 1.00 . A A . 14 CYS H 1 1 5 3265 1 1 12 CYS HA H -7.349 -4.651 1.756 1.00 . A A . 14 CYS HA 1 1 5 3266 1 1 12 CYS HB2 H -10.183 -4.456 2.789 1.00 . A A . 14 CYS HB2 1 1 5 3267 1 1 12 CYS HB3 H -8.687 -4.010 3.611 1.00 . A A . 14 CYS HB3 1 1 5 3268 1 1 12 CYS N N -8.863 -4.605 0.288 1.00 . A A . 14 CYS N 1 1 5 3269 1 1 12 CYS O O -8.746 -6.768 3.120 1.00 . A A . 14 CYS O 1 1 5 3270 1 1 12 CYS SG S -9.338 -2.351 2.006 1.00 . A A . 14 CYS SG 1 1 5 3271 1 1 13 ALA C C -7.987 -9.439 0.204 1.00 . A A . 15 ALA C 1 1 5 3272 1 1 13 ALA CA C -8.853 -8.648 1.188 1.00 . A A . 15 ALA CA 1 1 5 3273 1 1 13 ALA CB C -10.325 -8.993 0.961 1.00 . A A . 15 ALA CB 1 1 5 3274 1 1 13 ALA H H -8.537 -6.844 0.056 1.00 . A A . 15 ALA H 1 1 5 3275 1 1 13 ALA HA H -8.574 -8.901 2.200 1.00 . A A . 15 ALA HA 1 1 5 3276 1 1 13 ALA HB1 H -10.895 -8.733 1.841 1.00 . A A . 15 ALA HB1 1 1 5 3277 1 1 13 ALA HB2 H -10.422 -10.051 0.770 1.00 . A A . 15 ALA HB2 1 1 5 3278 1 1 13 ALA HB3 H -10.698 -8.439 0.113 1.00 . A A . 15 ALA HB3 1 1 5 3279 1 1 13 ALA N N -8.647 -7.189 0.966 1.00 . A A . 15 ALA N 1 1 5 3280 1 1 13 ALA O O -8.488 -10.150 -0.643 1.00 . A A . 15 ALA O 1 1 5 3281 1 1 14 CYS C C -5.139 -11.227 0.111 1.00 . A A . 16 CYS C 1 1 5 3282 1 1 14 CYS CA C -5.800 -10.064 -0.624 1.00 . A A . 16 CYS CA 1 1 5 3283 1 1 14 CYS CB C -4.725 -9.122 -1.165 1.00 . A A . 16 CYS CB 1 1 5 3284 1 1 14 CYS H H -6.306 -8.738 0.997 1.00 . A A . 16 CYS H 1 1 5 3285 1 1 14 CYS HA H -6.380 -10.451 -1.447 1.00 . A A . 16 CYS HA 1 1 5 3286 1 1 14 CYS HB2 H -4.588 -8.297 -0.481 1.00 . A A . 16 CYS HB2 1 1 5 3287 1 1 14 CYS HB3 H -3.795 -9.661 -1.271 1.00 . A A . 16 CYS HB3 1 1 5 3288 1 1 14 CYS N N -6.692 -9.319 0.308 1.00 . A A . 16 CYS N 1 1 5 3289 1 1 14 CYS O O -5.363 -11.445 1.285 1.00 . A A . 16 CYS O 1 1 5 3290 1 1 14 CYS SG S -5.244 -8.491 -2.780 1.00 . A A . 16 CYS SG 1 1 5 3291 1 1 15 THR C C -2.441 -12.627 0.866 1.00 . A A . 17 THR C 1 1 5 3292 1 1 15 THR CA C -3.649 -13.134 0.060 1.00 . A A . 17 THR CA 1 1 5 3293 1 1 15 THR CB C -3.206 -14.111 -1.035 1.00 . A A . 17 THR CB 1 1 5 3294 1 1 15 THR CG2 C -2.129 -13.458 -1.904 1.00 . A A . 17 THR CG2 1 1 5 3295 1 1 15 THR H H -4.172 -11.780 -1.525 1.00 . A A . 17 THR H 1 1 5 3296 1 1 15 THR HA H -4.339 -13.630 0.726 1.00 . A A . 17 THR HA 1 1 5 3297 1 1 15 THR HB H -4.054 -14.359 -1.654 1.00 . A A . 17 THR HB 1 1 5 3298 1 1 15 THR HG1 H -2.019 -15.653 -1.018 1.00 . A A . 17 THR HG1 1 1 5 3299 1 1 15 THR HG21 H -1.925 -12.463 -1.538 1.00 . A A . 17 THR HG21 1 1 5 3300 1 1 15 THR HG22 H -2.477 -13.402 -2.925 1.00 . A A . 17 THR HG22 1 1 5 3301 1 1 15 THR HG23 H -1.225 -14.048 -1.864 1.00 . A A . 17 THR HG23 1 1 5 3302 1 1 15 THR N N -4.329 -11.977 -0.579 1.00 . A A . 17 THR N 1 1 5 3303 1 1 15 THR O O -2.552 -11.683 1.622 1.00 . A A . 17 THR O 1 1 5 3304 1 1 15 THR OG1 O -2.698 -15.297 -0.441 1.00 . A A . 17 THR OG1 1 1 5 3305 1 1 16 MET C C 1.114 -12.673 0.592 1.00 . A A . 18 MET C 1 1 5 3306 1 1 16 MET CA C -0.111 -12.771 1.508 1.00 . A A . 18 MET CA 1 1 5 3307 1 1 16 MET CB C 0.176 -13.764 2.636 1.00 . A A . 18 MET CB 1 1 5 3308 1 1 16 MET CE C -2.530 -16.207 4.504 1.00 . A A . 18 MET CE 1 1 5 3309 1 1 16 MET CG C -1.144 -14.241 3.243 1.00 . A A . 18 MET CG 1 1 5 3310 1 1 16 MET H H -1.207 -14.002 0.126 1.00 . A A . 18 MET H 1 1 5 3311 1 1 16 MET HA H -0.322 -11.800 1.930 1.00 . A A . 18 MET HA 1 1 5 3312 1 1 16 MET HB2 H 0.718 -14.611 2.240 1.00 . A A . 18 MET HB2 1 1 5 3313 1 1 16 MET HB3 H 0.768 -13.281 3.399 1.00 . A A . 18 MET HB3 1 1 5 3314 1 1 16 MET HE1 H -2.574 -17.026 5.208 1.00 . A A . 18 MET HE1 1 1 5 3315 1 1 16 MET HE2 H -2.863 -16.549 3.538 1.00 . A A . 18 MET HE2 1 1 5 3316 1 1 16 MET HE3 H -3.170 -15.402 4.839 1.00 . A A . 18 MET HE3 1 1 5 3317 1 1 16 MET HG2 H -1.607 -13.426 3.780 1.00 . A A . 18 MET HG2 1 1 5 3318 1 1 16 MET HG3 H -1.804 -14.574 2.455 1.00 . A A . 18 MET HG3 1 1 5 3319 1 1 16 MET N N -1.292 -13.239 0.729 1.00 . A A . 18 MET N 1 1 5 3320 1 1 16 MET O O 2.226 -12.944 1.001 1.00 . A A . 18 MET O 1 1 5 3321 1 1 16 MET SD S -0.826 -15.610 4.384 1.00 . A A . 18 MET SD 1 1 5 3322 1 1 17 GLU C C 3.220 -11.424 -0.853 1.00 . A A . 19 GLU C 1 1 5 3323 1 1 17 GLU CA C 2.087 -12.165 -1.566 1.00 . A A . 19 GLU CA 1 1 5 3324 1 1 17 GLU CB C 1.669 -11.385 -2.813 1.00 . A A . 19 GLU CB 1 1 5 3325 1 1 17 GLU CD C 2.433 -10.553 -5.039 1.00 . A A . 19 GLU CD 1 1 5 3326 1 1 17 GLU CG C 2.772 -11.476 -3.868 1.00 . A A . 19 GLU CG 1 1 5 3327 1 1 17 GLU H H 0.022 -12.064 -0.951 1.00 . A A . 19 GLU H 1 1 5 3328 1 1 17 GLU HA H 2.423 -13.150 -1.851 1.00 . A A . 19 GLU HA 1 1 5 3329 1 1 17 GLU HB2 H 0.754 -11.803 -3.209 1.00 . A A . 19 GLU HB2 1 1 5 3330 1 1 17 GLU HB3 H 1.507 -10.350 -2.552 1.00 . A A . 19 GLU HB3 1 1 5 3331 1 1 17 GLU HG2 H 3.713 -11.175 -3.431 1.00 . A A . 19 GLU HG2 1 1 5 3332 1 1 17 GLU HG3 H 2.847 -12.493 -4.223 1.00 . A A . 19 GLU HG3 1 1 5 3333 1 1 17 GLU N N 0.925 -12.283 -0.639 1.00 . A A . 19 GLU N 1 1 5 3334 1 1 17 GLU O O 2.988 -10.655 0.058 1.00 . A A . 19 GLU O 1 1 5 3335 1 1 17 GLU OE1 O 1.256 -10.311 -5.255 1.00 . A A . 19 GLU OE1 1 1 5 3336 1 1 17 GLU OE2 O 3.354 -10.103 -5.699 1.00 . A A . 19 GLU OE2 1 1 5 3337 1 1 18 TYR C C 6.095 -9.801 -1.413 1.00 . A A . 20 TYR C 1 1 5 3338 1 1 18 TYR CA C 5.574 -10.959 -0.564 1.00 . A A . 20 TYR CA 1 1 5 3339 1 1 18 TYR CB C 6.714 -11.938 -0.314 1.00 . A A . 20 TYR CB 1 1 5 3340 1 1 18 TYR CD1 C 7.926 -10.327 1.192 1.00 . A A . 20 TYR CD1 1 1 5 3341 1 1 18 TYR CD2 C 7.422 -12.547 2.025 1.00 . A A . 20 TYR CD2 1 1 5 3342 1 1 18 TYR CE1 C 8.534 -10.005 2.409 1.00 . A A . 20 TYR CE1 1 1 5 3343 1 1 18 TYR CE2 C 8.029 -12.226 3.243 1.00 . A A . 20 TYR CE2 1 1 5 3344 1 1 18 TYR CG C 7.372 -11.598 0.999 1.00 . A A . 20 TYR CG 1 1 5 3345 1 1 18 TYR CZ C 8.586 -10.956 3.436 1.00 . A A . 20 TYR CZ 1 1 5 3346 1 1 18 TYR H H 4.619 -12.281 -1.977 1.00 . A A . 20 TYR H 1 1 5 3347 1 1 18 TYR HA H 5.229 -10.573 0.382 1.00 . A A . 20 TYR HA 1 1 5 3348 1 1 18 TYR HB2 H 6.328 -12.947 -0.281 1.00 . A A . 20 TYR HB2 1 1 5 3349 1 1 18 TYR HB3 H 7.435 -11.848 -1.109 1.00 . A A . 20 TYR HB3 1 1 5 3350 1 1 18 TYR HD1 H 7.886 -9.596 0.399 1.00 . A A . 20 TYR HD1 1 1 5 3351 1 1 18 TYR HD2 H 6.993 -13.527 1.876 1.00 . A A . 20 TYR HD2 1 1 5 3352 1 1 18 TYR HE1 H 8.962 -9.023 2.556 1.00 . A A . 20 TYR HE1 1 1 5 3353 1 1 18 TYR HE2 H 8.068 -12.956 4.035 1.00 . A A . 20 TYR HE2 1 1 5 3354 1 1 18 TYR HH H 10.085 -10.359 4.457 1.00 . A A . 20 TYR HH 1 1 5 3355 1 1 18 TYR N N 4.444 -11.652 -1.246 1.00 . A A . 20 TYR N 1 1 5 3356 1 1 18 TYR O O 6.809 -9.989 -2.374 1.00 . A A . 20 TYR O 1 1 5 3357 1 1 18 TYR OH O 9.187 -10.641 4.639 1.00 . A A . 20 TYR OH 1 1 5 3358 1 1 19 ARG C C 6.211 -6.220 -0.758 1.00 . A A . 21 ARG C 1 1 5 3359 1 1 19 ARG CA C 6.229 -7.389 -1.747 1.00 . A A . 21 ARG CA 1 1 5 3360 1 1 19 ARG CB C 5.307 -7.050 -2.930 1.00 . A A . 21 ARG CB 1 1 5 3361 1 1 19 ARG CD C 5.568 -9.048 -4.449 1.00 . A A . 21 ARG CD 1 1 5 3362 1 1 19 ARG CG C 4.629 -8.313 -3.481 1.00 . A A . 21 ARG CG 1 1 5 3363 1 1 19 ARG CZ C 7.382 -7.791 -5.465 1.00 . A A . 21 ARG CZ 1 1 5 3364 1 1 19 ARG H H 5.203 -8.505 -0.233 1.00 . A A . 21 ARG H 1 1 5 3365 1 1 19 ARG HA H 7.236 -7.546 -2.100 1.00 . A A . 21 ARG HA 1 1 5 3366 1 1 19 ARG HB2 H 4.551 -6.355 -2.602 1.00 . A A . 21 ARG HB2 1 1 5 3367 1 1 19 ARG HB3 H 5.891 -6.591 -3.715 1.00 . A A . 21 ARG HB3 1 1 5 3368 1 1 19 ARG HD2 H 5.641 -10.085 -4.157 1.00 . A A . 21 ARG HD2 1 1 5 3369 1 1 19 ARG HD3 H 5.167 -8.987 -5.450 1.00 . A A . 21 ARG HD3 1 1 5 3370 1 1 19 ARG HE H 7.480 -8.506 -3.615 1.00 . A A . 21 ARG HE 1 1 5 3371 1 1 19 ARG HG2 H 4.364 -8.967 -2.666 1.00 . A A . 21 ARG HG2 1 1 5 3372 1 1 19 ARG HG3 H 3.732 -8.028 -4.010 1.00 . A A . 21 ARG HG3 1 1 5 3373 1 1 19 ARG HH11 H 6.459 -8.975 -6.790 1.00 . A A . 21 ARG HH11 1 1 5 3374 1 1 19 ARG HH12 H 7.405 -7.690 -7.464 1.00 . A A . 21 ARG HH12 1 1 5 3375 1 1 19 ARG HH21 H 8.412 -6.457 -4.386 1.00 . A A . 21 ARG HH21 1 1 5 3376 1 1 19 ARG HH22 H 8.512 -6.268 -6.104 1.00 . A A . 21 ARG HH22 1 1 5 3377 1 1 19 ARG N N 5.757 -8.605 -1.026 1.00 . A A . 21 ARG N 1 1 5 3378 1 1 19 ARG NE N 6.929 -8.432 -4.421 1.00 . A A . 21 ARG NE 1 1 5 3379 1 1 19 ARG NH1 N 7.056 -8.183 -6.667 1.00 . A A . 21 ARG NH1 1 1 5 3380 1 1 19 ARG NH2 N 8.162 -6.758 -5.306 1.00 . A A . 21 ARG NH2 1 1 5 3381 1 1 19 ARG O O 5.186 -5.598 -0.562 1.00 . A A . 21 ARG O 1 1 5 3382 1 1 20 PRO C C 7.522 -3.513 0.158 1.00 . A A . 22 PRO C 1 1 5 3383 1 1 20 PRO CA C 7.476 -4.885 0.840 1.00 . A A . 22 PRO CA 1 1 5 3384 1 1 20 PRO CB C 8.801 -5.200 1.540 1.00 . A A . 22 PRO CB 1 1 5 3385 1 1 20 PRO CD C 8.588 -6.720 -0.399 1.00 . A A . 22 PRO CD 1 1 5 3386 1 1 20 PRO CG C 9.609 -6.089 0.566 1.00 . A A . 22 PRO CG 1 1 5 3387 1 1 20 PRO HA H 6.670 -4.930 1.554 1.00 . A A . 22 PRO HA 1 1 5 3388 1 1 20 PRO HB2 H 9.337 -4.283 1.745 1.00 . A A . 22 PRO HB2 1 1 5 3389 1 1 20 PRO HB3 H 8.617 -5.738 2.457 1.00 . A A . 22 PRO HB3 1 1 5 3390 1 1 20 PRO HD2 H 8.912 -6.597 -1.423 1.00 . A A . 22 PRO HD2 1 1 5 3391 1 1 20 PRO HD3 H 8.442 -7.764 -0.168 1.00 . A A . 22 PRO HD3 1 1 5 3392 1 1 20 PRO HG2 H 10.318 -5.485 0.019 1.00 . A A . 22 PRO HG2 1 1 5 3393 1 1 20 PRO HG3 H 10.122 -6.864 1.112 1.00 . A A . 22 PRO HG3 1 1 5 3394 1 1 20 PRO N N 7.341 -5.965 -0.152 1.00 . A A . 22 PRO N 1 1 5 3395 1 1 20 PRO O O 8.337 -3.264 -0.709 1.00 . A A . 22 PRO O 1 1 5 3396 1 1 21 LEU C C 6.767 -0.217 1.049 1.00 . A A . 23 LEU C 1 1 5 3397 1 1 21 LEU CA C 6.637 -1.261 -0.060 1.00 . A A . 23 LEU CA 1 1 5 3398 1 1 21 LEU CB C 5.318 -1.044 -0.807 1.00 . A A . 23 LEU CB 1 1 5 3399 1 1 21 LEU CD1 C 3.898 -2.328 -2.415 1.00 . A A . 23 LEU CD1 1 1 5 3400 1 1 21 LEU CD2 C 5.836 -0.990 -3.249 1.00 . A A . 23 LEU CD2 1 1 5 3401 1 1 21 LEU CG C 5.321 -1.860 -2.101 1.00 . A A . 23 LEU CG 1 1 5 3402 1 1 21 LEU H H 6.008 -2.847 1.254 1.00 . A A . 23 LEU H 1 1 5 3403 1 1 21 LEU HA H 7.464 -1.164 -0.749 1.00 . A A . 23 LEU HA 1 1 5 3404 1 1 21 LEU HB2 H 4.495 -1.361 -0.182 1.00 . A A . 23 LEU HB2 1 1 5 3405 1 1 21 LEU HB3 H 5.206 0.005 -1.046 1.00 . A A . 23 LEU HB3 1 1 5 3406 1 1 21 LEU HD11 H 3.886 -2.818 -3.378 1.00 . A A . 23 LEU HD11 1 1 5 3407 1 1 21 LEU HD12 H 3.235 -1.477 -2.436 1.00 . A A . 23 LEU HD12 1 1 5 3408 1 1 21 LEU HD13 H 3.572 -3.022 -1.655 1.00 . A A . 23 LEU HD13 1 1 5 3409 1 1 21 LEU HD21 H 6.904 -0.865 -3.154 1.00 . A A . 23 LEU HD21 1 1 5 3410 1 1 21 LEU HD22 H 5.356 -0.023 -3.210 1.00 . A A . 23 LEU HD22 1 1 5 3411 1 1 21 LEU HD23 H 5.611 -1.467 -4.191 1.00 . A A . 23 LEU HD23 1 1 5 3412 1 1 21 LEU HG H 5.964 -2.720 -1.982 1.00 . A A . 23 LEU HG 1 1 5 3413 1 1 21 LEU N N 6.651 -2.622 0.550 1.00 . A A . 23 LEU N 1 1 5 3414 1 1 21 LEU O O 6.040 -0.240 2.022 1.00 . A A . 23 LEU O 1 1 5 3415 1 1 22 CYS C C 6.930 2.926 1.636 1.00 . A A . 24 CYS C 1 1 5 3416 1 1 22 CYS CA C 7.841 1.745 1.967 1.00 . A A . 24 CYS CA 1 1 5 3417 1 1 22 CYS CB C 9.298 2.212 2.014 1.00 . A A . 24 CYS CB 1 1 5 3418 1 1 22 CYS H H 8.258 0.711 0.121 1.00 . A A . 24 CYS H 1 1 5 3419 1 1 22 CYS HA H 7.563 1.333 2.926 1.00 . A A . 24 CYS HA 1 1 5 3420 1 1 22 CYS HB2 H 9.951 1.353 2.019 1.00 . A A . 24 CYS HB2 1 1 5 3421 1 1 22 CYS HB3 H 9.510 2.821 1.146 1.00 . A A . 24 CYS HB3 1 1 5 3422 1 1 22 CYS N N 7.681 0.703 0.914 1.00 . A A . 24 CYS N 1 1 5 3423 1 1 22 CYS O O 7.373 3.953 1.168 1.00 . A A . 24 CYS O 1 1 5 3424 1 1 22 CYS SG S 9.571 3.185 3.515 1.00 . A A . 24 CYS SG 1 1 5 3425 1 1 23 GLY C C 5.245 5.202 2.120 1.00 . A A . 25 GLY C 1 1 5 3426 1 1 23 GLY CA C 4.703 3.885 1.567 1.00 . A A . 25 GLY CA 1 1 5 3427 1 1 23 GLY H H 5.321 1.937 2.250 1.00 . A A . 25 GLY H 1 1 5 3428 1 1 23 GLY HA2 H 4.580 3.966 0.497 1.00 . A A . 25 GLY HA2 1 1 5 3429 1 1 23 GLY HA3 H 3.748 3.673 2.024 1.00 . A A . 25 GLY HA3 1 1 5 3430 1 1 23 GLY N N 5.655 2.779 1.873 1.00 . A A . 25 GLY N 1 1 5 3431 1 1 23 GLY O O 5.974 5.220 3.091 1.00 . A A . 25 GLY O 1 1 5 3432 1 1 24 SER C C 5.136 7.762 3.500 1.00 . A A . 26 SER C 1 1 5 3433 1 1 24 SER CA C 5.372 7.633 1.993 1.00 . A A . 26 SER CA 1 1 5 3434 1 1 24 SER CB C 4.620 8.746 1.263 1.00 . A A . 26 SER CB 1 1 5 3435 1 1 24 SER H H 4.297 6.261 0.726 1.00 . A A . 26 SER H 1 1 5 3436 1 1 24 SER HA H 6.428 7.723 1.788 1.00 . A A . 26 SER HA 1 1 5 3437 1 1 24 SER HB2 H 4.739 8.626 0.199 1.00 . A A . 26 SER HB2 1 1 5 3438 1 1 24 SER HB3 H 3.568 8.694 1.514 1.00 . A A . 26 SER HB3 1 1 5 3439 1 1 24 SER HG H 5.499 9.916 2.544 1.00 . A A . 26 SER HG 1 1 5 3440 1 1 24 SER N N 4.887 6.306 1.508 1.00 . A A . 26 SER N 1 1 5 3441 1 1 24 SER O O 5.740 8.583 4.161 1.00 . A A . 26 SER O 1 1 5 3442 1 1 24 SER OG O 5.151 10.006 1.654 1.00 . A A . 26 SER OG 1 1 5 3443 1 1 25 ASP C C 5.019 6.169 6.271 1.00 . A A . 27 ASP C 1 1 5 3444 1 1 25 ASP CA C 4.004 7.037 5.521 1.00 . A A . 27 ASP CA 1 1 5 3445 1 1 25 ASP CB C 2.592 6.528 5.811 1.00 . A A . 27 ASP CB 1 1 5 3446 1 1 25 ASP CG C 2.536 5.017 5.580 1.00 . A A . 27 ASP CG 1 1 5 3447 1 1 25 ASP H H 3.792 6.302 3.509 1.00 . A A . 27 ASP H 1 1 5 3448 1 1 25 ASP HA H 4.093 8.062 5.849 1.00 . A A . 27 ASP HA 1 1 5 3449 1 1 25 ASP HB2 H 2.336 6.746 6.837 1.00 . A A . 27 ASP HB2 1 1 5 3450 1 1 25 ASP HB3 H 1.891 7.017 5.152 1.00 . A A . 27 ASP HB3 1 1 5 3451 1 1 25 ASP N N 4.268 6.958 4.054 1.00 . A A . 27 ASP N 1 1 5 3452 1 1 25 ASP O O 4.770 5.715 7.369 1.00 . A A . 27 ASP O 1 1 5 3453 1 1 25 ASP OD1 O 3.334 4.527 4.798 1.00 . A A . 27 ASP OD1 1 1 5 3454 1 1 25 ASP OD2 O 1.697 4.375 6.190 1.00 . A A . 27 ASP OD2 1 1 5 3455 1 1 26 ASN C C 6.562 3.771 6.776 1.00 . A A . 28 ASN C 1 1 5 3456 1 1 26 ASN CA C 7.191 5.096 6.352 1.00 . A A . 28 ASN CA 1 1 5 3457 1 1 26 ASN CB C 7.727 5.826 7.584 1.00 . A A . 28 ASN CB 1 1 5 3458 1 1 26 ASN CG C 9.217 5.517 7.750 1.00 . A A . 28 ASN CG 1 1 5 3459 1 1 26 ASN H H 6.337 6.309 4.799 1.00 . A A . 28 ASN H 1 1 5 3460 1 1 26 ASN HA H 8.002 4.905 5.664 1.00 . A A . 28 ASN HA 1 1 5 3461 1 1 26 ASN HB2 H 7.591 6.890 7.460 1.00 . A A . 28 ASN HB2 1 1 5 3462 1 1 26 ASN HB3 H 7.193 5.493 8.461 1.00 . A A . 28 ASN HB3 1 1 5 3463 1 1 26 ASN HD21 H 9.029 4.915 9.633 1.00 . A A . 28 ASN HD21 1 1 5 3464 1 1 26 ASN HD22 H 10.606 4.857 9.006 1.00 . A A . 28 ASN HD22 1 1 5 3465 1 1 26 ASN N N 6.160 5.935 5.683 1.00 . A A . 28 ASN N 1 1 5 3466 1 1 26 ASN ND2 N 9.654 5.058 8.891 1.00 . A A . 28 ASN ND2 1 1 5 3467 1 1 26 ASN O O 6.796 3.282 7.863 1.00 . A A . 28 ASN O 1 1 5 3468 1 1 26 ASN OD1 O 9.992 5.693 6.830 1.00 . A A . 28 ASN OD1 1 1 5 3469 1 1 27 LYS C C 5.520 0.801 5.313 1.00 . A A . 29 LYS C 1 1 5 3470 1 1 27 LYS CA C 5.111 1.899 6.297 1.00 . A A . 29 LYS CA 1 1 5 3471 1 1 27 LYS CB C 3.592 2.069 6.274 1.00 . A A . 29 LYS CB 1 1 5 3472 1 1 27 LYS CD C 2.098 1.456 8.180 1.00 . A A . 29 LYS CD 1 1 5 3473 1 1 27 LYS CE C 2.543 0.810 9.492 1.00 . A A . 29 LYS CE 1 1 5 3474 1 1 27 LYS CG C 2.944 0.910 7.030 1.00 . A A . 29 LYS CG 1 1 5 3475 1 1 27 LYS H H 5.574 3.604 5.057 1.00 . A A . 29 LYS H 1 1 5 3476 1 1 27 LYS HA H 5.422 1.619 7.289 1.00 . A A . 29 LYS HA 1 1 5 3477 1 1 27 LYS HB2 H 3.326 3.003 6.749 1.00 . A A . 29 LYS HB2 1 1 5 3478 1 1 27 LYS HB3 H 3.243 2.071 5.253 1.00 . A A . 29 LYS HB3 1 1 5 3479 1 1 27 LYS HD2 H 2.227 2.528 8.242 1.00 . A A . 29 LYS HD2 1 1 5 3480 1 1 27 LYS HD3 H 1.058 1.228 8.001 1.00 . A A . 29 LYS HD3 1 1 5 3481 1 1 27 LYS HE2 H 3.074 -0.106 9.280 1.00 . A A . 29 LYS HE2 1 1 5 3482 1 1 27 LYS HE3 H 3.194 1.488 10.026 1.00 . A A . 29 LYS HE3 1 1 5 3483 1 1 27 LYS HG2 H 2.317 0.347 6.354 1.00 . A A . 29 LYS HG2 1 1 5 3484 1 1 27 LYS HG3 H 3.713 0.268 7.428 1.00 . A A . 29 LYS HG3 1 1 5 3485 1 1 27 LYS HZ1 H 0.813 1.380 10.500 1.00 . A A . 29 LYS HZ1 1 1 5 3486 1 1 27 LYS HZ2 H 1.656 0.104 11.238 1.00 . A A . 29 LYS HZ2 1 1 5 3487 1 1 27 LYS HZ3 H 0.742 -0.178 9.833 1.00 . A A . 29 LYS HZ3 1 1 5 3488 1 1 27 LYS N N 5.758 3.189 5.929 1.00 . A A . 29 LYS N 1 1 5 3489 1 1 27 LYS NZ N 1.348 0.506 10.329 1.00 . A A . 29 LYS NZ 1 1 5 3490 1 1 27 LYS O O 5.902 1.064 4.190 1.00 . A A . 29 LYS O 1 1 5 3491 1 1 28 THR C C 4.562 -2.357 4.467 1.00 . A A . 30 THR C 1 1 5 3492 1 1 28 THR CA C 5.816 -1.561 4.834 1.00 . A A . 30 THR CA 1 1 5 3493 1 1 28 THR CB C 6.808 -2.478 5.553 1.00 . A A . 30 THR CB 1 1 5 3494 1 1 28 THR CG2 C 7.159 -3.660 4.648 1.00 . A A . 30 THR CG2 1 1 5 3495 1 1 28 THR H H 5.126 -0.619 6.643 1.00 . A A . 30 THR H 1 1 5 3496 1 1 28 THR HA H 6.271 -1.169 3.936 1.00 . A A . 30 THR HA 1 1 5 3497 1 1 28 THR HB H 6.361 -2.848 6.463 1.00 . A A . 30 THR HB 1 1 5 3498 1 1 28 THR HG1 H 8.456 -2.227 6.553 1.00 . A A . 30 THR HG1 1 1 5 3499 1 1 28 THR HG21 H 8.136 -3.503 4.215 1.00 . A A . 30 THR HG21 1 1 5 3500 1 1 28 THR HG22 H 6.424 -3.741 3.860 1.00 . A A . 30 THR HG22 1 1 5 3501 1 1 28 THR HG23 H 7.165 -4.569 5.229 1.00 . A A . 30 THR HG23 1 1 5 3502 1 1 28 THR N N 5.439 -0.433 5.732 1.00 . A A . 30 THR N 1 1 5 3503 1 1 28 THR O O 3.958 -3.001 5.303 1.00 . A A . 30 THR O 1 1 5 3504 1 1 28 THR OG1 O 7.987 -1.750 5.865 1.00 . A A . 30 THR OG1 1 1 5 3505 1 1 29 TYR C C 3.335 -4.447 2.301 1.00 . A A . 31 TYR C 1 1 5 3506 1 1 29 TYR CA C 2.947 -3.056 2.803 1.00 . A A . 31 TYR CA 1 1 5 3507 1 1 29 TYR CB C 2.269 -2.276 1.680 1.00 . A A . 31 TYR CB 1 1 5 3508 1 1 29 TYR CD1 C 0.498 -0.967 2.905 1.00 . A A . 31 TYR CD1 1 1 5 3509 1 1 29 TYR CD2 C 2.453 0.206 2.079 1.00 . A A . 31 TYR CD2 1 1 5 3510 1 1 29 TYR CE1 C -0.003 0.235 3.423 1.00 . A A . 31 TYR CE1 1 1 5 3511 1 1 29 TYR CE2 C 1.953 1.406 2.597 1.00 . A A . 31 TYR CE2 1 1 5 3512 1 1 29 TYR CG C 1.725 -0.981 2.233 1.00 . A A . 31 TYR CG 1 1 5 3513 1 1 29 TYR CZ C 0.724 1.421 3.268 1.00 . A A . 31 TYR CZ 1 1 5 3514 1 1 29 TYR H H 4.656 -1.784 2.570 1.00 . A A . 31 TYR H 1 1 5 3515 1 1 29 TYR HA H 2.267 -3.149 3.636 1.00 . A A . 31 TYR HA 1 1 5 3516 1 1 29 TYR HB2 H 2.991 -2.062 0.905 1.00 . A A . 31 TYR HB2 1 1 5 3517 1 1 29 TYR HB3 H 1.465 -2.859 1.272 1.00 . A A . 31 TYR HB3 1 1 5 3518 1 1 29 TYR HD1 H -0.064 -1.881 3.024 1.00 . A A . 31 TYR HD1 1 1 5 3519 1 1 29 TYR HD2 H 3.400 0.195 1.561 1.00 . A A . 31 TYR HD2 1 1 5 3520 1 1 29 TYR HE1 H -0.951 0.246 3.941 1.00 . A A . 31 TYR HE1 1 1 5 3521 1 1 29 TYR HE2 H 2.514 2.321 2.478 1.00 . A A . 31 TYR HE2 1 1 5 3522 1 1 29 TYR HH H 0.971 3.205 3.897 1.00 . A A . 31 TYR HH 1 1 5 3523 1 1 29 TYR N N 4.161 -2.313 3.226 1.00 . A A . 31 TYR N 1 1 5 3524 1 1 29 TYR O O 4.447 -4.676 1.869 1.00 . A A . 31 TYR O 1 1 5 3525 1 1 29 TYR OH O 0.232 2.604 3.779 1.00 . A A . 31 TYR OH 1 1 5 3526 1 1 30 GLY C C 2.669 -6.798 0.353 1.00 . A A . 32 GLY C 1 1 5 3527 1 1 30 GLY CA C 2.732 -6.756 1.880 1.00 . A A . 32 GLY CA 1 1 5 3528 1 1 30 GLY H H 1.531 -5.171 2.705 1.00 . A A . 32 GLY H 1 1 5 3529 1 1 30 GLY HA2 H 3.724 -7.033 2.209 1.00 . A A . 32 GLY HA2 1 1 5 3530 1 1 30 GLY HA3 H 2.012 -7.448 2.287 1.00 . A A . 32 GLY HA3 1 1 5 3531 1 1 30 GLY N N 2.422 -5.378 2.354 1.00 . A A . 32 GLY N 1 1 5 3532 1 1 30 GLY O O 3.273 -7.640 -0.279 1.00 . A A . 32 GLY O 1 1 5 3533 1 1 31 ASN C C 1.055 -4.659 -2.192 1.00 . A A . 33 ASN C 1 1 5 3534 1 1 31 ASN CA C 1.851 -5.884 -1.736 1.00 . A A . 33 ASN CA 1 1 5 3535 1 1 31 ASN CB C 1.156 -7.159 -2.217 1.00 . A A . 33 ASN CB 1 1 5 3536 1 1 31 ASN CG C -0.035 -7.467 -1.310 1.00 . A A . 33 ASN CG 1 1 5 3537 1 1 31 ASN H H 1.465 -5.216 0.274 1.00 . A A . 33 ASN H 1 1 5 3538 1 1 31 ASN HA H 2.844 -5.838 -2.155 1.00 . A A . 33 ASN HA 1 1 5 3539 1 1 31 ASN HB2 H 0.810 -7.019 -3.232 1.00 . A A . 33 ASN HB2 1 1 5 3540 1 1 31 ASN HB3 H 1.853 -7.983 -2.185 1.00 . A A . 33 ASN HB3 1 1 5 3541 1 1 31 ASN HD21 H 0.778 -9.120 -0.568 1.00 . A A . 33 ASN HD21 1 1 5 3542 1 1 31 ASN HD22 H -0.762 -8.737 0.033 1.00 . A A . 33 ASN HD22 1 1 5 3543 1 1 31 ASN N N 1.944 -5.891 -0.250 1.00 . A A . 33 ASN N 1 1 5 3544 1 1 31 ASN ND2 N -0.003 -8.529 -0.552 1.00 . A A . 33 ASN ND2 1 1 5 3545 1 1 31 ASN O O 0.388 -4.011 -1.411 1.00 . A A . 33 ASN O 1 1 5 3546 1 1 31 ASN OD1 O -1.004 -6.736 -1.293 1.00 . A A . 33 ASN OD1 1 1 5 3547 1 1 32 LYS C C -1.106 -3.327 -3.748 1.00 . A A . 34 LYS C 1 1 5 3548 1 1 32 LYS CA C 0.394 -3.146 -3.968 1.00 . A A . 34 LYS CA 1 1 5 3549 1 1 32 LYS CB C 0.678 -2.970 -5.461 1.00 . A A . 34 LYS CB 1 1 5 3550 1 1 32 LYS CD C 0.941 -4.528 -7.396 1.00 . A A . 34 LYS CD 1 1 5 3551 1 1 32 LYS CE C 0.101 -5.092 -8.544 1.00 . A A . 34 LYS CE 1 1 5 3552 1 1 32 LYS CG C 0.023 -4.108 -6.247 1.00 . A A . 34 LYS CG 1 1 5 3553 1 1 32 LYS H H 1.684 -4.865 -4.058 1.00 . A A . 34 LYS H 1 1 5 3554 1 1 32 LYS HA H 0.723 -2.267 -3.435 1.00 . A A . 34 LYS HA 1 1 5 3555 1 1 32 LYS HB2 H 0.277 -2.024 -5.795 1.00 . A A . 34 LYS HB2 1 1 5 3556 1 1 32 LYS HB3 H 1.744 -2.988 -5.629 1.00 . A A . 34 LYS HB3 1 1 5 3557 1 1 32 LYS HD2 H 1.496 -3.669 -7.745 1.00 . A A . 34 LYS HD2 1 1 5 3558 1 1 32 LYS HD3 H 1.629 -5.284 -7.051 1.00 . A A . 34 LYS HD3 1 1 5 3559 1 1 32 LYS HE2 H -0.120 -6.132 -8.351 1.00 . A A . 34 LYS HE2 1 1 5 3560 1 1 32 LYS HE3 H -0.821 -4.537 -8.623 1.00 . A A . 34 LYS HE3 1 1 5 3561 1 1 32 LYS HG2 H -0.143 -4.950 -5.590 1.00 . A A . 34 LYS HG2 1 1 5 3562 1 1 32 LYS HG3 H -0.922 -3.772 -6.648 1.00 . A A . 34 LYS HG3 1 1 5 3563 1 1 32 LYS HZ1 H 1.139 -5.921 -10.148 1.00 . A A . 34 LYS HZ1 1 1 5 3564 1 1 32 LYS HZ2 H 1.717 -4.400 -9.660 1.00 . A A . 34 LYS HZ2 1 1 5 3565 1 1 32 LYS HZ3 H 0.268 -4.519 -10.539 1.00 . A A . 34 LYS HZ3 1 1 5 3566 1 1 32 LYS N N 1.132 -4.333 -3.453 1.00 . A A . 34 LYS N 1 1 5 3567 1 1 32 LYS NZ N 0.864 -4.975 -9.819 1.00 . A A . 34 LYS NZ 1 1 5 3568 1 1 32 LYS O O -1.870 -2.386 -3.839 1.00 . A A . 34 LYS O 1 1 5 3569 1 1 33 CYS C C -3.324 -4.151 -1.826 1.00 . A A . 35 CYS C 1 1 5 3570 1 1 33 CYS CA C -2.996 -4.722 -3.203 1.00 . A A . 35 CYS CA 1 1 5 3571 1 1 33 CYS CB C -3.316 -6.216 -3.242 1.00 . A A . 35 CYS CB 1 1 5 3572 1 1 33 CYS H H -0.918 -5.268 -3.360 1.00 . A A . 35 CYS H 1 1 5 3573 1 1 33 CYS HA H -3.568 -4.203 -3.958 1.00 . A A . 35 CYS HA 1 1 5 3574 1 1 33 CYS HB2 H -3.238 -6.574 -4.257 1.00 . A A . 35 CYS HB2 1 1 5 3575 1 1 33 CYS HB3 H -2.616 -6.751 -2.618 1.00 . A A . 35 CYS HB3 1 1 5 3576 1 1 33 CYS N N -1.543 -4.516 -3.444 1.00 . A A . 35 CYS N 1 1 5 3577 1 1 33 CYS O O -4.373 -3.572 -1.601 1.00 . A A . 35 CYS O 1 1 5 3578 1 1 33 CYS SG S -4.997 -6.492 -2.634 1.00 . A A . 35 CYS SG 1 1 5 3579 1 1 34 ASN C C -2.304 -2.248 0.419 1.00 . A A . 36 ASN C 1 1 5 3580 1 1 34 ASN CA C -2.622 -3.739 0.452 1.00 . A A . 36 ASN CA 1 1 5 3581 1 1 34 ASN CB C -1.680 -4.445 1.427 1.00 . A A . 36 ASN CB 1 1 5 3582 1 1 34 ASN CG C -2.452 -4.864 2.679 1.00 . A A . 36 ASN CG 1 1 5 3583 1 1 34 ASN H H -1.562 -4.728 -1.127 1.00 . A A . 36 ASN H 1 1 5 3584 1 1 34 ASN HA H -3.648 -3.892 0.754 1.00 . A A . 36 ASN HA 1 1 5 3585 1 1 34 ASN HB2 H -1.262 -5.321 0.951 1.00 . A A . 36 ASN HB2 1 1 5 3586 1 1 34 ASN HB3 H -0.883 -3.774 1.702 1.00 . A A . 36 ASN HB3 1 1 5 3587 1 1 34 ASN HD21 H -3.452 -6.304 1.749 1.00 . A A . 36 ASN HD21 1 1 5 3588 1 1 34 ASN HD22 H -3.807 -6.123 3.399 1.00 . A A . 36 ASN HD22 1 1 5 3589 1 1 34 ASN N N -2.408 -4.286 -0.909 1.00 . A A . 36 ASN N 1 1 5 3590 1 1 34 ASN ND2 N -3.309 -5.844 2.603 1.00 . A A . 36 ASN ND2 1 1 5 3591 1 1 34 ASN O O -2.705 -1.491 1.281 1.00 . A A . 36 ASN O 1 1 5 3592 1 1 34 ASN OD1 O -2.273 -4.294 3.737 1.00 . A A . 36 ASN OD1 1 1 5 3593 1 1 35 PHE C C -2.405 0.363 -1.329 1.00 . A A . 37 PHE C 1 1 5 3594 1 1 35 PHE CA C -1.232 -0.387 -0.703 1.00 . A A . 37 PHE CA 1 1 5 3595 1 1 35 PHE CB C 0.004 -0.240 -1.595 1.00 . A A . 37 PHE CB 1 1 5 3596 1 1 35 PHE CD1 C 1.171 1.800 -0.687 1.00 . A A . 37 PHE CD1 1 1 5 3597 1 1 35 PHE CD2 C -0.061 1.987 -2.766 1.00 . A A . 37 PHE CD2 1 1 5 3598 1 1 35 PHE CE1 C 1.517 3.154 -0.771 1.00 . A A . 37 PHE CE1 1 1 5 3599 1 1 35 PHE CE2 C 0.285 3.340 -2.851 1.00 . A A . 37 PHE CE2 1 1 5 3600 1 1 35 PHE CG C 0.382 1.218 -1.685 1.00 . A A . 37 PHE CG 1 1 5 3601 1 1 35 PHE CZ C 1.073 3.924 -1.853 1.00 . A A . 37 PHE CZ 1 1 5 3602 1 1 35 PHE H H -1.279 -2.457 -1.267 1.00 . A A . 37 PHE H 1 1 5 3603 1 1 35 PHE HA H -1.026 0.017 0.275 1.00 . A A . 37 PHE HA 1 1 5 3604 1 1 35 PHE HB2 H 0.825 -0.804 -1.177 1.00 . A A . 37 PHE HB2 1 1 5 3605 1 1 35 PHE HB3 H -0.221 -0.611 -2.584 1.00 . A A . 37 PHE HB3 1 1 5 3606 1 1 35 PHE HD1 H 1.512 1.206 0.148 1.00 . A A . 37 PHE HD1 1 1 5 3607 1 1 35 PHE HD2 H -0.669 1.537 -3.536 1.00 . A A . 37 PHE HD2 1 1 5 3608 1 1 35 PHE HE1 H 2.126 3.605 -0.001 1.00 . A A . 37 PHE HE1 1 1 5 3609 1 1 35 PHE HE2 H -0.057 3.934 -3.686 1.00 . A A . 37 PHE HE2 1 1 5 3610 1 1 35 PHE HZ H 1.338 4.966 -1.920 1.00 . A A . 37 PHE HZ 1 1 5 3611 1 1 35 PHE N N -1.585 -1.824 -0.584 1.00 . A A . 37 PHE N 1 1 5 3612 1 1 35 PHE O O -2.674 1.502 -1.005 1.00 . A A . 37 PHE O 1 1 5 3613 1 1 36 CYS C C -5.404 0.496 -1.845 1.00 . A A . 38 CYS C 1 1 5 3614 1 1 36 CYS CA C -4.272 0.397 -2.864 1.00 . A A . 38 CYS CA 1 1 5 3615 1 1 36 CYS CB C -4.733 -0.417 -4.075 1.00 . A A . 38 CYS CB 1 1 5 3616 1 1 36 CYS H H -2.881 -1.193 -2.464 1.00 . A A . 38 CYS H 1 1 5 3617 1 1 36 CYS HA H -3.985 1.388 -3.183 1.00 . A A . 38 CYS HA 1 1 5 3618 1 1 36 CYS HB2 H -4.351 -1.424 -3.998 1.00 . A A . 38 CYS HB2 1 1 5 3619 1 1 36 CYS HB3 H -5.813 -0.442 -4.101 1.00 . A A . 38 CYS HB3 1 1 5 3620 1 1 36 CYS N N -3.110 -0.273 -2.223 1.00 . A A . 38 CYS N 1 1 5 3621 1 1 36 CYS O O -6.234 1.381 -1.906 1.00 . A A . 38 CYS O 1 1 5 3622 1 1 36 CYS SG S -4.109 0.352 -5.592 1.00 . A A . 38 CYS SG 1 1 5 3623 1 1 37 CYS C C -6.175 0.764 1.134 1.00 . A A . 39 CYS C 1 1 5 3624 1 1 37 CYS CA C -6.511 -0.348 0.135 1.00 . A A . 39 CYS CA 1 1 5 3625 1 1 37 CYS CB C -6.603 -1.700 0.855 1.00 . A A . 39 CYS CB 1 1 5 3626 1 1 37 CYS H H -4.752 -1.110 -0.859 1.00 . A A . 39 CYS H 1 1 5 3627 1 1 37 CYS HA H -7.453 -0.126 -0.341 1.00 . A A . 39 CYS HA 1 1 5 3628 1 1 37 CYS HB2 H -7.103 -2.413 0.214 1.00 . A A . 39 CYS HB2 1 1 5 3629 1 1 37 CYS HB3 H -5.608 -2.056 1.076 1.00 . A A . 39 CYS HB3 1 1 5 3630 1 1 37 CYS N N -5.438 -0.403 -0.897 1.00 . A A . 39 CYS N 1 1 5 3631 1 1 37 CYS O O -7.035 1.500 1.577 1.00 . A A . 39 CYS O 1 1 5 3632 1 1 37 CYS SG S -7.538 -1.520 2.399 1.00 . A A . 39 CYS SG 1 1 5 3633 1 1 38 ALA C C -4.604 3.323 1.737 1.00 . A A . 40 ALA C 1 1 5 3634 1 1 38 ALA CA C -4.526 1.966 2.441 1.00 . A A . 40 ALA CA 1 1 5 3635 1 1 38 ALA CB C -3.093 1.716 2.914 1.00 . A A . 40 ALA CB 1 1 5 3636 1 1 38 ALA H H -4.248 0.297 1.105 1.00 . A A . 40 ALA H 1 1 5 3637 1 1 38 ALA HA H -5.195 1.958 3.290 1.00 . A A . 40 ALA HA 1 1 5 3638 1 1 38 ALA HB1 H -2.835 2.435 3.677 1.00 . A A . 40 ALA HB1 1 1 5 3639 1 1 38 ALA HB2 H -2.415 1.818 2.079 1.00 . A A . 40 ALA HB2 1 1 5 3640 1 1 38 ALA HB3 H -3.015 0.717 3.320 1.00 . A A . 40 ALA HB3 1 1 5 3641 1 1 38 ALA N N -4.925 0.897 1.482 1.00 . A A . 40 ALA N 1 1 5 3642 1 1 38 ALA O O -4.716 4.357 2.364 1.00 . A A . 40 ALA O 1 1 5 3643 1 1 39 VAL C C -6.064 5.084 -0.384 1.00 . A A . 41 VAL C 1 1 5 3644 1 1 39 VAL CA C -4.612 4.607 -0.320 1.00 . A A . 41 VAL CA 1 1 5 3645 1 1 39 VAL CB C -4.085 4.389 -1.741 1.00 . A A . 41 VAL CB 1 1 5 3646 1 1 39 VAL CG1 C -4.457 5.586 -2.619 1.00 . A A . 41 VAL CG1 1 1 5 3647 1 1 39 VAL CG2 C -2.562 4.238 -1.702 1.00 . A A . 41 VAL CG2 1 1 5 3648 1 1 39 VAL H H -4.451 2.477 -0.051 1.00 . A A . 41 VAL H 1 1 5 3649 1 1 39 VAL HA H -4.010 5.351 0.178 1.00 . A A . 41 VAL HA 1 1 5 3650 1 1 39 VAL HB H -4.527 3.491 -2.152 1.00 . A A . 41 VAL HB 1 1 5 3651 1 1 39 VAL HG11 H -4.578 6.463 -1.999 1.00 . A A . 41 VAL HG11 1 1 5 3652 1 1 39 VAL HG12 H -5.381 5.380 -3.136 1.00 . A A . 41 VAL HG12 1 1 5 3653 1 1 39 VAL HG13 H -3.672 5.761 -3.341 1.00 . A A . 41 VAL HG13 1 1 5 3654 1 1 39 VAL HG21 H -2.107 5.211 -1.590 1.00 . A A . 41 VAL HG21 1 1 5 3655 1 1 39 VAL HG22 H -2.221 3.785 -2.621 1.00 . A A . 41 VAL HG22 1 1 5 3656 1 1 39 VAL HG23 H -2.283 3.612 -0.868 1.00 . A A . 41 VAL HG23 1 1 5 3657 1 1 39 VAL N N -4.543 3.323 0.434 1.00 . A A . 41 VAL N 1 1 5 3658 1 1 39 VAL O O -6.340 6.268 -0.388 1.00 . A A . 41 VAL O 1 1 5 3659 1 1 40 VAL C C -8.948 4.877 0.896 1.00 . A A . 42 VAL C 1 1 5 3660 1 1 40 VAL CA C -8.426 4.571 -0.512 1.00 . A A . 42 VAL CA 1 1 5 3661 1 1 40 VAL CB C -9.239 3.431 -1.134 1.00 . A A . 42 VAL CB 1 1 5 3662 1 1 40 VAL CG1 C -10.729 3.633 -0.847 1.00 . A A . 42 VAL CG1 1 1 5 3663 1 1 40 VAL CG2 C -9.013 3.421 -2.648 1.00 . A A . 42 VAL CG2 1 1 5 3664 1 1 40 VAL H H -6.747 3.225 -0.442 1.00 . A A . 42 VAL H 1 1 5 3665 1 1 40 VAL HA H -8.521 5.454 -1.126 1.00 . A A . 42 VAL HA 1 1 5 3666 1 1 40 VAL HB H -8.916 2.488 -0.715 1.00 . A A . 42 VAL HB 1 1 5 3667 1 1 40 VAL HG11 H -11.310 2.975 -1.474 1.00 . A A . 42 VAL HG11 1 1 5 3668 1 1 40 VAL HG12 H -10.999 4.659 -1.053 1.00 . A A . 42 VAL HG12 1 1 5 3669 1 1 40 VAL HG13 H -10.929 3.411 0.192 1.00 . A A . 42 VAL HG13 1 1 5 3670 1 1 40 VAL HG21 H -9.290 4.381 -3.059 1.00 . A A . 42 VAL HG21 1 1 5 3671 1 1 40 VAL HG22 H -9.618 2.649 -3.099 1.00 . A A . 42 VAL HG22 1 1 5 3672 1 1 40 VAL HG23 H -7.970 3.230 -2.855 1.00 . A A . 42 VAL HG23 1 1 5 3673 1 1 40 VAL N N -6.993 4.173 -0.441 1.00 . A A . 42 VAL N 1 1 5 3674 1 1 40 VAL O O -9.989 5.478 1.062 1.00 . A A . 42 VAL O 1 1 5 3675 1 1 41 GLU C C -8.172 6.108 3.758 1.00 . A A . 43 GLU C 1 1 5 3676 1 1 41 GLU CA C -8.705 4.747 3.299 1.00 . A A . 43 GLU CA 1 1 5 3677 1 1 41 GLU CB C -8.209 3.648 4.245 1.00 . A A . 43 GLU CB 1 1 5 3678 1 1 41 GLU CD C -6.294 2.928 5.679 1.00 . A A . 43 GLU CD 1 1 5 3679 1 1 41 GLU CG C -6.710 3.814 4.503 1.00 . A A . 43 GLU CG 1 1 5 3680 1 1 41 GLU H H -7.396 3.986 1.763 1.00 . A A . 43 GLU H 1 1 5 3681 1 1 41 GLU HA H -9.785 4.768 3.309 1.00 . A A . 43 GLU HA 1 1 5 3682 1 1 41 GLU HB2 H -8.744 3.714 5.181 1.00 . A A . 43 GLU HB2 1 1 5 3683 1 1 41 GLU HB3 H -8.389 2.682 3.796 1.00 . A A . 43 GLU HB3 1 1 5 3684 1 1 41 GLU HG2 H -6.160 3.523 3.621 1.00 . A A . 43 GLU HG2 1 1 5 3685 1 1 41 GLU HG3 H -6.493 4.844 4.739 1.00 . A A . 43 GLU HG3 1 1 5 3686 1 1 41 GLU N N -8.235 4.470 1.911 1.00 . A A . 43 GLU N 1 1 5 3687 1 1 41 GLU O O -8.761 6.764 4.594 1.00 . A A . 43 GLU O 1 1 5 3688 1 1 41 GLU OE1 O -6.050 1.754 5.455 1.00 . A A . 43 GLU OE1 1 1 5 3689 1 1 41 GLU OE2 O -6.229 3.439 6.786 1.00 . A A . 43 GLU OE2 1 1 5 3690 1 1 42 SER C C -7.140 8.966 2.777 1.00 . A A . 44 SER C 1 1 5 3691 1 1 42 SER CA C -6.504 7.860 3.623 1.00 . A A . 44 SER CA 1 1 5 3692 1 1 42 SER CB C -4.991 7.861 3.409 1.00 . A A . 44 SER CB 1 1 5 3693 1 1 42 SER H H -6.606 5.998 2.540 1.00 . A A . 44 SER H 1 1 5 3694 1 1 42 SER HA H -6.720 8.037 4.666 1.00 . A A . 44 SER HA 1 1 5 3695 1 1 42 SER HB2 H -4.637 6.848 3.306 1.00 . A A . 44 SER HB2 1 1 5 3696 1 1 42 SER HB3 H -4.755 8.415 2.510 1.00 . A A . 44 SER HB3 1 1 5 3697 1 1 42 SER HG H -4.835 9.271 4.740 1.00 . A A . 44 SER HG 1 1 5 3698 1 1 42 SER N N -7.066 6.540 3.216 1.00 . A A . 44 SER N 1 1 5 3699 1 1 42 SER O O -6.668 10.085 2.743 1.00 . A A . 44 SER O 1 1 5 3700 1 1 42 SER OG O -4.359 8.464 4.532 1.00 . A A . 44 SER OG 1 1 5 3701 1 1 43 ASN C C -8.022 9.933 -0.007 1.00 . A A . 45 ASN C 1 1 5 3702 1 1 43 ASN CA C -8.871 9.687 1.239 1.00 . A A . 45 ASN CA 1 1 5 3703 1 1 43 ASN CB C -9.014 10.991 2.025 1.00 . A A . 45 ASN CB 1 1 5 3704 1 1 43 ASN CG C -10.177 11.808 1.455 1.00 . A A . 45 ASN CG 1 1 5 3705 1 1 43 ASN H H -8.562 7.749 2.125 1.00 . A A . 45 ASN H 1 1 5 3706 1 1 43 ASN HA H -9.848 9.332 0.945 1.00 . A A . 45 ASN HA 1 1 5 3707 1 1 43 ASN HB2 H -9.207 10.766 3.064 1.00 . A A . 45 ASN HB2 1 1 5 3708 1 1 43 ASN HB3 H -8.103 11.563 1.943 1.00 . A A . 45 ASN HB3 1 1 5 3709 1 1 43 ASN HD21 H -10.761 12.483 3.229 1.00 . A A . 45 ASN HD21 1 1 5 3710 1 1 43 ASN HD22 H -11.683 13.020 1.909 1.00 . A A . 45 ASN HD22 1 1 5 3711 1 1 43 ASN N N -8.204 8.659 2.088 1.00 . A A . 45 ASN N 1 1 5 3712 1 1 43 ASN ND2 N -10.937 12.494 2.265 1.00 . A A . 45 ASN ND2 1 1 5 3713 1 1 43 ASN O O -8.057 10.995 -0.596 1.00 . A A . 45 ASN O 1 1 5 3714 1 1 43 ASN OD1 O -10.397 11.822 0.260 1.00 . A A . 45 ASN OD1 1 1 5 3715 1 1 44 GLY C C -5.294 10.149 -1.302 1.00 . A A . 46 GLY C 1 1 5 3716 1 1 44 GLY CA C -6.398 9.138 -1.614 1.00 . A A . 46 GLY CA 1 1 5 3717 1 1 44 GLY H H -7.239 8.111 0.082 1.00 . A A . 46 GLY H 1 1 5 3718 1 1 44 GLY HA2 H -5.957 8.190 -1.887 1.00 . A A . 46 GLY HA2 1 1 5 3719 1 1 44 GLY HA3 H -6.998 9.507 -2.431 1.00 . A A . 46 GLY HA3 1 1 5 3720 1 1 44 GLY N N -7.255 8.959 -0.410 1.00 . A A . 46 GLY N 1 1 5 3721 1 1 44 GLY O O -4.787 10.817 -2.180 1.00 . A A . 46 GLY O 1 1 5 3722 1 1 45 THR C C -2.565 10.499 0.674 1.00 . A A . 47 THR C 1 1 5 3723 1 1 45 THR CA C -3.852 11.246 0.309 1.00 . A A . 47 THR CA 1 1 5 3724 1 1 45 THR CB C -4.315 12.087 1.502 1.00 . A A . 47 THR CB 1 1 5 3725 1 1 45 THR CG2 C -5.587 12.847 1.127 1.00 . A A . 47 THR CG2 1 1 5 3726 1 1 45 THR H H -5.347 9.723 0.642 1.00 . A A . 47 THR H 1 1 5 3727 1 1 45 THR HA H -3.660 11.896 -0.532 1.00 . A A . 47 THR HA 1 1 5 3728 1 1 45 THR HB H -3.544 12.793 1.768 1.00 . A A . 47 THR HB 1 1 5 3729 1 1 45 THR HG1 H -3.746 11.054 3.050 1.00 . A A . 47 THR HG1 1 1 5 3730 1 1 45 THR HG21 H -5.484 13.255 0.132 1.00 . A A . 47 THR HG21 1 1 5 3731 1 1 45 THR HG22 H -5.749 13.650 1.831 1.00 . A A . 47 THR HG22 1 1 5 3732 1 1 45 THR HG23 H -6.431 12.172 1.152 1.00 . A A . 47 THR HG23 1 1 5 3733 1 1 45 THR N N -4.921 10.270 -0.055 1.00 . A A . 47 THR N 1 1 5 3734 1 1 45 THR O O -1.571 11.097 1.037 1.00 . A A . 47 THR O 1 1 5 3735 1 1 45 THR OG1 O -4.578 11.233 2.608 1.00 . A A . 47 THR OG1 1 1 5 3736 1 1 46 LEU C C -0.533 8.181 -0.363 1.00 . A A . 48 LEU C 1 1 5 3737 1 1 46 LEU CA C -1.349 8.413 0.911 1.00 . A A . 48 LEU CA 1 1 5 3738 1 1 46 LEU CB C -1.758 7.066 1.511 1.00 . A A . 48 LEU CB 1 1 5 3739 1 1 46 LEU CD1 C -0.798 6.270 3.674 1.00 . A A . 48 LEU CD1 1 1 5 3740 1 1 46 LEU CD2 C -0.326 5.024 1.561 1.00 . A A . 48 LEU CD2 1 1 5 3741 1 1 46 LEU CG C -0.546 6.410 2.172 1.00 . A A . 48 LEU CG 1 1 5 3742 1 1 46 LEU H H -3.382 8.734 0.276 1.00 . A A . 48 LEU H 1 1 5 3743 1 1 46 LEU HA H -0.751 8.961 1.626 1.00 . A A . 48 LEU HA 1 1 5 3744 1 1 46 LEU HB2 H -2.531 7.222 2.250 1.00 . A A . 48 LEU HB2 1 1 5 3745 1 1 46 LEU HB3 H -2.131 6.422 0.729 1.00 . A A . 48 LEU HB3 1 1 5 3746 1 1 46 LEU HD11 H -0.494 7.177 4.176 1.00 . A A . 48 LEU HD11 1 1 5 3747 1 1 46 LEU HD12 H -0.228 5.437 4.059 1.00 . A A . 48 LEU HD12 1 1 5 3748 1 1 46 LEU HD13 H -1.850 6.099 3.849 1.00 . A A . 48 LEU HD13 1 1 5 3749 1 1 46 LEU HD21 H 0.244 4.415 2.247 1.00 . A A . 48 LEU HD21 1 1 5 3750 1 1 46 LEU HD22 H 0.214 5.122 0.631 1.00 . A A . 48 LEU HD22 1 1 5 3751 1 1 46 LEU HD23 H -1.282 4.558 1.375 1.00 . A A . 48 LEU HD23 1 1 5 3752 1 1 46 LEU HG H 0.329 7.021 2.009 1.00 . A A . 48 LEU HG 1 1 5 3753 1 1 46 LEU N N -2.572 9.198 0.575 1.00 . A A . 48 LEU N 1 1 5 3754 1 1 46 LEU O O -1.067 8.175 -1.455 1.00 . A A . 48 LEU O 1 1 5 3755 1 1 47 THR C C 2.666 6.719 -1.184 1.00 . A A . 49 THR C 1 1 5 3756 1 1 47 THR CA C 1.591 7.779 -1.457 1.00 . A A . 49 THR CA 1 1 5 3757 1 1 47 THR CB C 2.259 9.101 -1.854 1.00 . A A . 49 THR CB 1 1 5 3758 1 1 47 THR CG2 C 1.191 10.170 -2.091 1.00 . A A . 49 THR CG2 1 1 5 3759 1 1 47 THR H H 1.171 8.012 0.647 1.00 . A A . 49 THR H 1 1 5 3760 1 1 47 THR HA H 0.963 7.443 -2.268 1.00 . A A . 49 THR HA 1 1 5 3761 1 1 47 THR HB H 2.824 8.961 -2.763 1.00 . A A . 49 THR HB 1 1 5 3762 1 1 47 THR HG1 H 3.502 10.371 -1.066 1.00 . A A . 49 THR HG1 1 1 5 3763 1 1 47 THR HG21 H 1.341 10.987 -1.401 1.00 . A A . 49 THR HG21 1 1 5 3764 1 1 47 THR HG22 H 0.213 9.743 -1.936 1.00 . A A . 49 THR HG22 1 1 5 3765 1 1 47 THR HG23 H 1.268 10.537 -3.103 1.00 . A A . 49 THR HG23 1 1 5 3766 1 1 47 THR N N 0.756 7.998 -0.241 1.00 . A A . 49 THR N 1 1 5 3767 1 1 47 THR O O 2.530 5.888 -0.309 1.00 . A A . 49 THR O 1 1 5 3768 1 1 47 THR OG1 O 3.129 9.523 -0.815 1.00 . A A . 49 THR OG1 1 1 5 3769 1 1 48 LEU C C 6.086 6.499 -1.312 1.00 . A A . 50 LEU C 1 1 5 3770 1 1 48 LEU CA C 4.829 5.753 -1.778 1.00 . A A . 50 LEU CA 1 1 5 3771 1 1 48 LEU CB C 5.074 5.069 -3.134 1.00 . A A . 50 LEU CB 1 1 5 3772 1 1 48 LEU CD1 C 6.605 3.252 -2.344 1.00 . A A . 50 LEU CD1 1 1 5 3773 1 1 48 LEU CD2 C 6.798 4.123 -4.672 1.00 . A A . 50 LEU CD2 1 1 5 3774 1 1 48 LEU CG C 6.496 4.501 -3.220 1.00 . A A . 50 LEU CG 1 1 5 3775 1 1 48 LEU H H 3.794 7.419 -2.644 1.00 . A A . 50 LEU H 1 1 5 3776 1 1 48 LEU HA H 4.549 5.012 -1.041 1.00 . A A . 50 LEU HA 1 1 5 3777 1 1 48 LEU HB2 H 4.365 4.265 -3.257 1.00 . A A . 50 LEU HB2 1 1 5 3778 1 1 48 LEU HB3 H 4.933 5.791 -3.925 1.00 . A A . 50 LEU HB3 1 1 5 3779 1 1 48 LEU HD11 H 6.023 3.390 -1.446 1.00 . A A . 50 LEU HD11 1 1 5 3780 1 1 48 LEU HD12 H 7.640 3.088 -2.080 1.00 . A A . 50 LEU HD12 1 1 5 3781 1 1 48 LEU HD13 H 6.232 2.398 -2.888 1.00 . A A . 50 LEU HD13 1 1 5 3782 1 1 48 LEU HD21 H 6.017 3.476 -5.045 1.00 . A A . 50 LEU HD21 1 1 5 3783 1 1 48 LEU HD22 H 7.745 3.610 -4.722 1.00 . A A . 50 LEU HD22 1 1 5 3784 1 1 48 LEU HD23 H 6.841 5.019 -5.276 1.00 . A A . 50 LEU HD23 1 1 5 3785 1 1 48 LEU HG H 7.208 5.241 -2.886 1.00 . A A . 50 LEU HG 1 1 5 3786 1 1 48 LEU N N 3.726 6.745 -1.947 1.00 . A A . 50 LEU N 1 1 5 3787 1 1 48 LEU O O 6.178 7.705 -1.433 1.00 . A A . 50 LEU O 1 1 5 3788 1 1 49 SER C C 9.536 5.807 -0.858 1.00 . A A . 51 SER C 1 1 5 3789 1 1 49 SER CA C 8.287 6.498 -0.299 1.00 . A A . 51 SER CA 1 1 5 3790 1 1 49 SER CB C 8.326 6.472 1.234 1.00 . A A . 51 SER CB 1 1 5 3791 1 1 49 SER H H 6.965 4.834 -0.675 1.00 . A A . 51 SER H 1 1 5 3792 1 1 49 SER HA H 8.268 7.523 -0.635 1.00 . A A . 51 SER HA 1 1 5 3793 1 1 49 SER HB2 H 8.380 7.479 1.609 1.00 . A A . 51 SER HB2 1 1 5 3794 1 1 49 SER HB3 H 7.428 6.001 1.607 1.00 . A A . 51 SER HB3 1 1 5 3795 1 1 49 SER HG H 9.899 6.266 2.364 1.00 . A A . 51 SER HG 1 1 5 3796 1 1 49 SER N N 7.053 5.804 -0.773 1.00 . A A . 51 SER N 1 1 5 3797 1 1 49 SER O O 10.538 6.443 -1.116 1.00 . A A . 51 SER O 1 1 5 3798 1 1 49 SER OG O 9.472 5.752 1.674 1.00 . A A . 51 SER OG 1 1 5 3799 1 1 50 HIS C C 10.415 2.300 -1.622 1.00 . A A . 52 HIS C 1 1 5 3800 1 1 50 HIS CA C 10.694 3.809 -1.571 1.00 . A A . 52 HIS CA 1 1 5 3801 1 1 50 HIS CB C 11.902 4.130 -0.661 1.00 . A A . 52 HIS CB 1 1 5 3802 1 1 50 HIS CD2 C 13.604 2.131 -0.877 1.00 . A A . 52 HIS CD2 1 1 5 3803 1 1 50 HIS CE1 C 13.235 1.195 1.042 1.00 . A A . 52 HIS CE1 1 1 5 3804 1 1 50 HIS CG C 12.641 2.880 -0.248 1.00 . A A . 52 HIS CG 1 1 5 3805 1 1 50 HIS H H 8.684 4.010 -0.825 1.00 . A A . 52 HIS H 1 1 5 3806 1 1 50 HIS HA H 10.899 4.164 -2.571 1.00 . A A . 52 HIS HA 1 1 5 3807 1 1 50 HIS HB2 H 12.583 4.778 -1.194 1.00 . A A . 52 HIS HB2 1 1 5 3808 1 1 50 HIS HB3 H 11.550 4.642 0.223 1.00 . A A . 52 HIS HB3 1 1 5 3809 1 1 50 HIS HD1 H 11.782 2.550 1.659 1.00 . A A . 52 HIS HD1 1 1 5 3810 1 1 50 HIS HD2 H 14.011 2.336 -1.857 1.00 . A A . 52 HIS HD2 1 1 5 3811 1 1 50 HIS HE1 H 13.288 0.527 1.888 1.00 . A A . 52 HIS HE1 1 1 5 3812 1 1 50 HIS N N 9.496 4.514 -1.041 1.00 . A A . 52 HIS N 1 1 5 3813 1 1 50 HIS ND1 N 12.420 2.263 0.974 1.00 . A A . 52 HIS ND1 1 1 5 3814 1 1 50 HIS NE2 N 13.979 1.068 -0.061 1.00 . A A . 52 HIS NE2 1 1 5 3815 1 1 50 HIS O O 10.421 1.621 -0.615 1.00 . A A . 52 HIS O 1 1 5 3816 1 1 51 PHE C C 10.900 -0.457 -2.053 1.00 . A A . 53 PHE C 1 1 5 3817 1 1 51 PHE CA C 9.910 0.322 -2.922 1.00 . A A . 53 PHE CA 1 1 5 3818 1 1 51 PHE CB C 10.091 -0.092 -4.384 1.00 . A A . 53 PHE CB 1 1 5 3819 1 1 51 PHE CD1 C 8.610 1.462 -5.705 1.00 . A A . 53 PHE CD1 1 1 5 3820 1 1 51 PHE CD2 C 7.874 -0.819 -5.334 1.00 . A A . 53 PHE CD2 1 1 5 3821 1 1 51 PHE CE1 C 7.439 1.722 -6.427 1.00 . A A . 53 PHE CE1 1 1 5 3822 1 1 51 PHE CE2 C 6.704 -0.558 -6.056 1.00 . A A . 53 PHE CE2 1 1 5 3823 1 1 51 PHE CG C 8.828 0.192 -5.158 1.00 . A A . 53 PHE CG 1 1 5 3824 1 1 51 PHE CZ C 6.486 0.711 -6.602 1.00 . A A . 53 PHE CZ 1 1 5 3825 1 1 51 PHE H H 10.186 2.342 -3.589 1.00 . A A . 53 PHE H 1 1 5 3826 1 1 51 PHE HA H 8.900 0.108 -2.607 1.00 . A A . 53 PHE HA 1 1 5 3827 1 1 51 PHE HB2 H 10.909 0.465 -4.815 1.00 . A A . 53 PHE HB2 1 1 5 3828 1 1 51 PHE HB3 H 10.312 -1.143 -4.430 1.00 . A A . 53 PHE HB3 1 1 5 3829 1 1 51 PHE HD1 H 9.345 2.242 -5.570 1.00 . A A . 53 PHE HD1 1 1 5 3830 1 1 51 PHE HD2 H 8.042 -1.799 -4.914 1.00 . A A . 53 PHE HD2 1 1 5 3831 1 1 51 PHE HE1 H 7.270 2.702 -6.850 1.00 . A A . 53 PHE HE1 1 1 5 3832 1 1 51 PHE HE2 H 5.969 -1.338 -6.191 1.00 . A A . 53 PHE HE2 1 1 5 3833 1 1 51 PHE HZ H 5.582 0.912 -7.158 1.00 . A A . 53 PHE HZ 1 1 5 3834 1 1 51 PHE N N 10.180 1.777 -2.792 1.00 . A A . 53 PHE N 1 1 5 3835 1 1 51 PHE O O 12.090 -0.455 -2.299 1.00 . A A . 53 PHE O 1 1 5 3836 1 1 52 GLY C C 10.945 -1.695 1.302 1.00 . A A . 54 GLY C 1 1 5 3837 1 1 52 GLY CA C 11.338 -1.903 -0.160 1.00 . A A . 54 GLY CA 1 1 5 3838 1 1 52 GLY H H 9.457 -1.116 -0.859 1.00 . A A . 54 GLY H 1 1 5 3839 1 1 52 GLY HA2 H 11.269 -2.953 -0.408 1.00 . A A . 54 GLY HA2 1 1 5 3840 1 1 52 GLY HA3 H 12.352 -1.565 -0.307 1.00 . A A . 54 GLY HA3 1 1 5 3841 1 1 52 GLY N N 10.420 -1.125 -1.041 1.00 . A A . 54 GLY N 1 1 5 3842 1 1 52 GLY O O 10.049 -0.935 1.613 1.00 . A A . 54 GLY O 1 1 5 3843 1 1 53 LYS C C 11.747 -0.844 4.140 1.00 . A A . 55 LYS C 1 1 5 3844 1 1 53 LYS CA C 11.272 -2.212 3.648 1.00 . A A . 55 LYS CA 1 1 5 3845 1 1 53 LYS CB C 11.964 -3.314 4.451 1.00 . A A . 55 LYS CB 1 1 5 3846 1 1 53 LYS CD C 11.858 -5.803 4.253 1.00 . A A . 55 LYS CD 1 1 5 3847 1 1 53 LYS CE C 12.676 -6.172 5.492 1.00 . A A . 55 LYS CE 1 1 5 3848 1 1 53 LYS CG C 11.048 -4.536 4.534 1.00 . A A . 55 LYS CG 1 1 5 3849 1 1 53 LYS H H 12.325 -2.977 1.931 1.00 . A A . 55 LYS H 1 1 5 3850 1 1 53 LYS HA H 10.203 -2.290 3.778 1.00 . A A . 55 LYS HA 1 1 5 3851 1 1 53 LYS HB2 H 12.889 -3.588 3.965 1.00 . A A . 55 LYS HB2 1 1 5 3852 1 1 53 LYS HB3 H 12.172 -2.956 5.449 1.00 . A A . 55 LYS HB3 1 1 5 3853 1 1 53 LYS HD2 H 11.186 -6.613 4.010 1.00 . A A . 55 LYS HD2 1 1 5 3854 1 1 53 LYS HD3 H 12.526 -5.626 3.424 1.00 . A A . 55 LYS HD3 1 1 5 3855 1 1 53 LYS HE2 H 13.673 -5.766 5.400 1.00 . A A . 55 LYS HE2 1 1 5 3856 1 1 53 LYS HE3 H 12.200 -5.765 6.373 1.00 . A A . 55 LYS HE3 1 1 5 3857 1 1 53 LYS HG2 H 10.615 -4.596 5.521 1.00 . A A . 55 LYS HG2 1 1 5 3858 1 1 53 LYS HG3 H 10.261 -4.446 3.800 1.00 . A A . 55 LYS HG3 1 1 5 3859 1 1 53 LYS HZ1 H 13.216 -8.046 4.765 1.00 . A A . 55 LYS HZ1 1 1 5 3860 1 1 53 LYS HZ2 H 11.790 -8.046 5.687 1.00 . A A . 55 LYS HZ2 1 1 5 3861 1 1 53 LYS HZ3 H 13.300 -7.911 6.454 1.00 . A A . 55 LYS HZ3 1 1 5 3862 1 1 53 LYS N N 11.607 -2.368 2.204 1.00 . A A . 55 LYS N 1 1 5 3863 1 1 53 LYS NZ N 12.751 -7.655 5.608 1.00 . A A . 55 LYS NZ 1 1 5 3864 1 1 53 LYS O O 12.838 -0.406 3.830 1.00 . A A . 55 LYS O 1 1 5 3865 1 1 54 CYS C C 12.516 1.016 6.390 1.00 . A A . 56 CYS C 1 1 5 3866 1 1 54 CYS CA C 11.344 1.173 5.419 1.00 . A A . 56 CYS CA 1 1 5 3867 1 1 54 CYS CB C 10.164 1.820 6.148 1.00 . A A . 56 CYS CB 1 1 5 3868 1 1 54 CYS H H 10.063 -0.539 5.145 1.00 . A A . 56 CYS H 1 1 5 3869 1 1 54 CYS HA H 11.643 1.799 4.591 1.00 . A A . 56 CYS HA 1 1 5 3870 1 1 54 CYS HB2 H 9.848 1.182 6.960 1.00 . A A . 56 CYS HB2 1 1 5 3871 1 1 54 CYS HB3 H 10.467 2.780 6.541 1.00 . A A . 56 CYS HB3 1 1 5 3872 1 1 54 CYS N N 10.938 -0.167 4.907 1.00 . A A . 56 CYS N 1 1 5 3873 1 1 54 CYS O O 12.289 0.543 7.491 1.00 . A A . 56 CYS O 1 1 5 3874 1 1 54 CYS OXT O 13.621 1.374 6.015 1.00 . A A . 56 CYS OXT 1 1 5 3875 1 1 54 CYS SG S 8.791 2.048 4.990 1.00 . A A . 56 CYS SG 1 1 6 3876 1 1 1 ALA C C 7.180 8.696 -8.904 1.00 . A A . 3 ALA C 1 1 6 3877 1 1 1 ALA CA C 6.865 10.034 -8.235 1.00 . A A . 3 ALA CA 1 1 6 3878 1 1 1 ALA CB C 6.563 11.082 -9.311 1.00 . A A . 3 ALA CB 1 1 6 3879 1 1 1 ALA H1 H 8.678 11.035 -8.023 1.00 . A A . 3 ALA H1 1 1 6 3880 1 1 1 ALA H2 H 8.543 9.637 -7.067 1.00 . A A . 3 ALA H2 1 1 6 3881 1 1 1 ALA H3 H 7.713 11.053 -6.629 1.00 . A A . 3 ALA H3 1 1 6 3882 1 1 1 ALA HA H 6.005 9.922 -7.591 1.00 . A A . 3 ALA HA 1 1 6 3883 1 1 1 ALA HB1 H 7.291 11.002 -10.105 1.00 . A A . 3 ALA HB1 1 1 6 3884 1 1 1 ALA HB2 H 6.612 12.069 -8.875 1.00 . A A . 3 ALA HB2 1 1 6 3885 1 1 1 ALA HB3 H 5.575 10.913 -9.710 1.00 . A A . 3 ALA HB3 1 1 6 3886 1 1 1 ALA N N 8.038 10.474 -7.427 1.00 . A A . 3 ALA N 1 1 6 3887 1 1 1 ALA O O 8.213 8.526 -9.521 1.00 . A A . 3 ALA O 1 1 6 3888 1 1 2 VAL C C 5.390 6.067 -10.356 1.00 . A A . 4 VAL C 1 1 6 3889 1 1 2 VAL CA C 6.550 6.417 -9.424 1.00 . A A . 4 VAL CA 1 1 6 3890 1 1 2 VAL CB C 6.677 5.344 -8.341 1.00 . A A . 4 VAL CB 1 1 6 3891 1 1 2 VAL CG1 C 8.113 5.316 -7.818 1.00 . A A . 4 VAL CG1 1 1 6 3892 1 1 2 VAL CG2 C 5.721 5.664 -7.190 1.00 . A A . 4 VAL CG2 1 1 6 3893 1 1 2 VAL H H 5.469 7.897 -8.290 1.00 . A A . 4 VAL H 1 1 6 3894 1 1 2 VAL HA H 7.465 6.463 -9.994 1.00 . A A . 4 VAL HA 1 1 6 3895 1 1 2 VAL HB H 6.429 4.381 -8.761 1.00 . A A . 4 VAL HB 1 1 6 3896 1 1 2 VAL HG11 H 8.355 6.270 -7.375 1.00 . A A . 4 VAL HG11 1 1 6 3897 1 1 2 VAL HG12 H 8.790 5.116 -8.635 1.00 . A A . 4 VAL HG12 1 1 6 3898 1 1 2 VAL HG13 H 8.210 4.539 -7.073 1.00 . A A . 4 VAL HG13 1 1 6 3899 1 1 2 VAL HG21 H 4.842 6.156 -7.579 1.00 . A A . 4 VAL HG21 1 1 6 3900 1 1 2 VAL HG22 H 6.214 6.313 -6.482 1.00 . A A . 4 VAL HG22 1 1 6 3901 1 1 2 VAL HG23 H 5.432 4.747 -6.697 1.00 . A A . 4 VAL HG23 1 1 6 3902 1 1 2 VAL N N 6.297 7.742 -8.790 1.00 . A A . 4 VAL N 1 1 6 3903 1 1 2 VAL O O 4.476 6.846 -10.547 1.00 . A A . 4 VAL O 1 1 6 3904 1 1 3 SER C C 3.323 3.614 -11.113 1.00 . A A . 5 SER C 1 1 6 3905 1 1 3 SER CA C 4.320 4.500 -11.861 1.00 . A A . 5 SER CA 1 1 6 3906 1 1 3 SER CB C 4.901 3.726 -13.043 1.00 . A A . 5 SER CB 1 1 6 3907 1 1 3 SER H H 6.165 4.289 -10.772 1.00 . A A . 5 SER H 1 1 6 3908 1 1 3 SER HA H 3.815 5.383 -12.222 1.00 . A A . 5 SER HA 1 1 6 3909 1 1 3 SER HB2 H 5.976 3.706 -12.968 1.00 . A A . 5 SER HB2 1 1 6 3910 1 1 3 SER HB3 H 4.524 2.712 -13.029 1.00 . A A . 5 SER HB3 1 1 6 3911 1 1 3 SER HG H 3.572 4.328 -14.329 1.00 . A A . 5 SER HG 1 1 6 3912 1 1 3 SER N N 5.419 4.901 -10.939 1.00 . A A . 5 SER N 1 1 6 3913 1 1 3 SER O O 3.106 2.472 -11.465 1.00 . A A . 5 SER O 1 1 6 3914 1 1 3 SER OG O 4.528 4.369 -14.254 1.00 . A A . 5 SER OG 1 1 6 3915 1 1 4 VAL C C 0.343 3.967 -9.428 1.00 . A A . 6 VAL C 1 1 6 3916 1 1 4 VAL CA C 1.724 3.320 -9.319 1.00 . A A . 6 VAL CA 1 1 6 3917 1 1 4 VAL CB C 2.142 3.263 -7.849 1.00 . A A . 6 VAL CB 1 1 6 3918 1 1 4 VAL CG1 C 1.940 4.636 -7.207 1.00 . A A . 6 VAL CG1 1 1 6 3919 1 1 4 VAL CG2 C 1.282 2.229 -7.121 1.00 . A A . 6 VAL CG2 1 1 6 3920 1 1 4 VAL H H 2.897 5.056 -9.817 1.00 . A A . 6 VAL H 1 1 6 3921 1 1 4 VAL HA H 1.689 2.320 -9.722 1.00 . A A . 6 VAL HA 1 1 6 3922 1 1 4 VAL HB H 3.183 2.982 -7.780 1.00 . A A . 6 VAL HB 1 1 6 3923 1 1 4 VAL HG11 H 1.881 5.390 -7.978 1.00 . A A . 6 VAL HG11 1 1 6 3924 1 1 4 VAL HG12 H 2.772 4.855 -6.553 1.00 . A A . 6 VAL HG12 1 1 6 3925 1 1 4 VAL HG13 H 1.024 4.635 -6.635 1.00 . A A . 6 VAL HG13 1 1 6 3926 1 1 4 VAL HG21 H 0.670 2.725 -6.382 1.00 . A A . 6 VAL HG21 1 1 6 3927 1 1 4 VAL HG22 H 1.922 1.508 -6.632 1.00 . A A . 6 VAL HG22 1 1 6 3928 1 1 4 VAL HG23 H 0.648 1.723 -7.833 1.00 . A A . 6 VAL HG23 1 1 6 3929 1 1 4 VAL N N 2.710 4.133 -10.084 1.00 . A A . 6 VAL N 1 1 6 3930 1 1 4 VAL O O 0.221 5.159 -9.623 1.00 . A A . 6 VAL O 1 1 6 3931 1 1 5 ASP C C -3.100 2.750 -8.930 1.00 . A A . 7 ASP C 1 1 6 3932 1 1 5 ASP CA C -2.067 3.773 -9.407 1.00 . A A . 7 ASP CA 1 1 6 3933 1 1 5 ASP CB C -2.356 4.147 -10.862 1.00 . A A . 7 ASP CB 1 1 6 3934 1 1 5 ASP CG C -2.498 5.665 -10.983 1.00 . A A . 7 ASP CG 1 1 6 3935 1 1 5 ASP H H -0.584 2.231 -9.150 1.00 . A A . 7 ASP H 1 1 6 3936 1 1 5 ASP HA H -2.128 4.657 -8.791 1.00 . A A . 7 ASP HA 1 1 6 3937 1 1 5 ASP HB2 H -1.541 3.811 -11.488 1.00 . A A . 7 ASP HB2 1 1 6 3938 1 1 5 ASP HB3 H -3.273 3.675 -11.181 1.00 . A A . 7 ASP HB3 1 1 6 3939 1 1 5 ASP N N -0.700 3.192 -9.306 1.00 . A A . 7 ASP N 1 1 6 3940 1 1 5 ASP O O -2.968 1.563 -9.158 1.00 . A A . 7 ASP O 1 1 6 3941 1 1 5 ASP OD1 O -1.568 6.360 -10.606 1.00 . A A . 7 ASP OD1 1 1 6 3942 1 1 5 ASP OD2 O -3.534 6.108 -11.450 1.00 . A A . 7 ASP OD2 1 1 6 3943 1 1 6 CYS C C -6.538 2.681 -8.361 1.00 . A A . 8 CYS C 1 1 6 3944 1 1 6 CYS CA C -5.183 2.263 -7.785 1.00 . A A . 8 CYS CA 1 1 6 3945 1 1 6 CYS CB C -5.244 2.305 -6.256 1.00 . A A . 8 CYS CB 1 1 6 3946 1 1 6 CYS H H -4.222 4.164 -8.104 1.00 . A A . 8 CYS H 1 1 6 3947 1 1 6 CYS HA H -4.946 1.261 -8.110 1.00 . A A . 8 CYS HA 1 1 6 3948 1 1 6 CYS HB2 H -5.572 3.282 -5.935 1.00 . A A . 8 CYS HB2 1 1 6 3949 1 1 6 CYS HB3 H -5.941 1.558 -5.904 1.00 . A A . 8 CYS HB3 1 1 6 3950 1 1 6 CYS N N -4.134 3.203 -8.272 1.00 . A A . 8 CYS N 1 1 6 3951 1 1 6 CYS O O -7.523 2.759 -7.658 1.00 . A A . 8 CYS O 1 1 6 3952 1 1 6 CYS SG S -3.602 1.967 -5.571 1.00 . A A . 8 CYS SG 1 1 6 3953 1 1 7 SER C C -8.975 2.408 -9.882 1.00 . A A . 9 SER C 1 1 6 3954 1 1 7 SER CA C -7.862 3.373 -10.279 1.00 . A A . 9 SER CA 1 1 6 3955 1 1 7 SER CB C -7.697 3.360 -11.800 1.00 . A A . 9 SER CB 1 1 6 3956 1 1 7 SER H H -5.776 2.887 -10.176 1.00 . A A . 9 SER H 1 1 6 3957 1 1 7 SER HA H -8.118 4.371 -9.955 1.00 . A A . 9 SER HA 1 1 6 3958 1 1 7 SER HB2 H -6.836 3.946 -12.075 1.00 . A A . 9 SER HB2 1 1 6 3959 1 1 7 SER HB3 H -7.559 2.341 -12.137 1.00 . A A . 9 SER HB3 1 1 6 3960 1 1 7 SER HG H -9.199 4.596 -11.814 1.00 . A A . 9 SER HG 1 1 6 3961 1 1 7 SER N N -6.585 2.955 -9.639 1.00 . A A . 9 SER N 1 1 6 3962 1 1 7 SER O O -9.221 1.418 -10.541 1.00 . A A . 9 SER O 1 1 6 3963 1 1 7 SER OG O -8.857 3.919 -12.402 1.00 . A A . 9 SER OG 1 1 6 3964 1 1 8 GLU C C -10.172 0.426 -7.988 1.00 . A A . 10 GLU C 1 1 6 3965 1 1 8 GLU CA C -10.743 1.800 -8.340 1.00 . A A . 10 GLU CA 1 1 6 3966 1 1 8 GLU CB C -11.788 1.649 -9.451 1.00 . A A . 10 GLU CB 1 1 6 3967 1 1 8 GLU CD C -12.231 3.848 -10.549 1.00 . A A . 10 GLU CD 1 1 6 3968 1 1 8 GLU CG C -12.701 2.877 -9.465 1.00 . A A . 10 GLU CG 1 1 6 3969 1 1 8 GLU H H -9.411 3.493 -8.290 1.00 . A A . 10 GLU H 1 1 6 3970 1 1 8 GLU HA H -11.209 2.229 -7.466 1.00 . A A . 10 GLU HA 1 1 6 3971 1 1 8 GLU HB2 H -11.291 1.559 -10.406 1.00 . A A . 10 GLU HB2 1 1 6 3972 1 1 8 GLU HB3 H -12.381 0.765 -9.270 1.00 . A A . 10 GLU HB3 1 1 6 3973 1 1 8 GLU HG2 H -13.715 2.567 -9.672 1.00 . A A . 10 GLU HG2 1 1 6 3974 1 1 8 GLU HG3 H -12.662 3.366 -8.504 1.00 . A A . 10 GLU HG3 1 1 6 3975 1 1 8 GLU N N -9.642 2.691 -8.802 1.00 . A A . 10 GLU N 1 1 6 3976 1 1 8 GLU O O -10.510 -0.571 -8.595 1.00 . A A . 10 GLU O 1 1 6 3977 1 1 8 GLU OE1 O -12.483 3.576 -11.712 1.00 . A A . 10 GLU OE1 1 1 6 3978 1 1 8 GLU OE2 O -11.630 4.849 -10.198 1.00 . A A . 10 GLU OE2 1 1 6 3979 1 1 9 TYR C C -8.845 -1.162 -5.106 1.00 . A A . 11 TYR C 1 1 6 3980 1 1 9 TYR CA C -8.721 -0.948 -6.623 1.00 . A A . 11 TYR CA 1 1 6 3981 1 1 9 TYR CB C -7.243 -0.969 -7.017 1.00 . A A . 11 TYR CB 1 1 6 3982 1 1 9 TYR CD1 C -7.741 -3.001 -8.427 1.00 . A A . 11 TYR CD1 1 1 6 3983 1 1 9 TYR CD2 C -5.667 -2.931 -7.170 1.00 . A A . 11 TYR CD2 1 1 6 3984 1 1 9 TYR CE1 C -7.397 -4.265 -8.922 1.00 . A A . 11 TYR CE1 1 1 6 3985 1 1 9 TYR CE2 C -5.324 -4.193 -7.664 1.00 . A A . 11 TYR CE2 1 1 6 3986 1 1 9 TYR CG C -6.876 -2.333 -7.551 1.00 . A A . 11 TYR CG 1 1 6 3987 1 1 9 TYR CZ C -6.189 -4.861 -8.541 1.00 . A A . 11 TYR CZ 1 1 6 3988 1 1 9 TYR H H -9.049 1.178 -6.532 1.00 . A A . 11 TYR H 1 1 6 3989 1 1 9 TYR HA H -9.241 -1.740 -7.140 1.00 . A A . 11 TYR HA 1 1 6 3990 1 1 9 TYR HB2 H -7.063 -0.226 -7.780 1.00 . A A . 11 TYR HB2 1 1 6 3991 1 1 9 TYR HB3 H -6.637 -0.749 -6.150 1.00 . A A . 11 TYR HB3 1 1 6 3992 1 1 9 TYR HD1 H -8.673 -2.542 -8.722 1.00 . A A . 11 TYR HD1 1 1 6 3993 1 1 9 TYR HD2 H -5.001 -2.415 -6.494 1.00 . A A . 11 TYR HD2 1 1 6 3994 1 1 9 TYR HE1 H -8.064 -4.780 -9.598 1.00 . A A . 11 TYR HE1 1 1 6 3995 1 1 9 TYR HE2 H -4.392 -4.654 -7.371 1.00 . A A . 11 TYR HE2 1 1 6 3996 1 1 9 TYR HH H -6.513 -6.733 -8.728 1.00 . A A . 11 TYR HH 1 1 6 3997 1 1 9 TYR N N -9.308 0.363 -7.011 1.00 . A A . 11 TYR N 1 1 6 3998 1 1 9 TYR O O -7.877 -1.508 -4.459 1.00 . A A . 11 TYR O 1 1 6 3999 1 1 9 TYR OH O -5.850 -6.107 -9.029 1.00 . A A . 11 TYR OH 1 1 6 4000 1 1 10 PRO C C -10.416 -2.637 -2.811 1.00 . A A . 12 PRO C 1 1 6 4001 1 1 10 PRO CA C -10.299 -1.146 -3.143 1.00 . A A . 12 PRO CA 1 1 6 4002 1 1 10 PRO CB C -11.645 -0.449 -2.932 1.00 . A A . 12 PRO CB 1 1 6 4003 1 1 10 PRO CD C -11.216 -0.540 -5.364 1.00 . A A . 12 PRO CD 1 1 6 4004 1 1 10 PRO CG C -12.335 -0.419 -4.314 1.00 . A A . 12 PRO CG 1 1 6 4005 1 1 10 PRO HA H -9.537 -0.674 -2.544 1.00 . A A . 12 PRO HA 1 1 6 4006 1 1 10 PRO HB2 H -12.243 -1.008 -2.223 1.00 . A A . 12 PRO HB2 1 1 6 4007 1 1 10 PRO HB3 H -11.492 0.558 -2.579 1.00 . A A . 12 PRO HB3 1 1 6 4008 1 1 10 PRO HD2 H -11.471 -1.281 -6.109 1.00 . A A . 12 PRO HD2 1 1 6 4009 1 1 10 PRO HD3 H -11.039 0.417 -5.822 1.00 . A A . 12 PRO HD3 1 1 6 4010 1 1 10 PRO HG2 H -13.021 -1.250 -4.402 1.00 . A A . 12 PRO HG2 1 1 6 4011 1 1 10 PRO HG3 H -12.860 0.515 -4.446 1.00 . A A . 12 PRO HG3 1 1 6 4012 1 1 10 PRO N N -10.033 -0.963 -4.582 1.00 . A A . 12 PRO N 1 1 6 4013 1 1 10 PRO O O -11.303 -3.317 -3.285 1.00 . A A . 12 PRO O 1 1 6 4014 1 1 11 LYS C C -8.626 -4.902 -0.518 1.00 . A A . 13 LYS C 1 1 6 4015 1 1 11 LYS CA C -9.605 -4.596 -1.651 1.00 . A A . 13 LYS CA 1 1 6 4016 1 1 11 LYS CB C -9.253 -5.451 -2.875 1.00 . A A . 13 LYS CB 1 1 6 4017 1 1 11 LYS CD C -7.859 -5.563 -4.949 1.00 . A A . 13 LYS CD 1 1 6 4018 1 1 11 LYS CE C -6.334 -5.632 -4.858 1.00 . A A . 13 LYS CE 1 1 6 4019 1 1 11 LYS CG C -8.394 -4.641 -3.851 1.00 . A A . 13 LYS CG 1 1 6 4020 1 1 11 LYS H H -8.822 -2.588 -1.627 1.00 . A A . 13 LYS H 1 1 6 4021 1 1 11 LYS HA H -10.609 -4.833 -1.328 1.00 . A A . 13 LYS HA 1 1 6 4022 1 1 11 LYS HB2 H -8.705 -6.326 -2.554 1.00 . A A . 13 LYS HB2 1 1 6 4023 1 1 11 LYS HB3 H -10.162 -5.760 -3.369 1.00 . A A . 13 LYS HB3 1 1 6 4024 1 1 11 LYS HD2 H -8.274 -6.553 -4.821 1.00 . A A . 13 LYS HD2 1 1 6 4025 1 1 11 LYS HD3 H -8.143 -5.175 -5.915 1.00 . A A . 13 LYS HD3 1 1 6 4026 1 1 11 LYS HE2 H -5.903 -4.800 -5.396 1.00 . A A . 13 LYS HE2 1 1 6 4027 1 1 11 LYS HE3 H -6.032 -5.585 -3.821 1.00 . A A . 13 LYS HE3 1 1 6 4028 1 1 11 LYS HG2 H -8.996 -3.862 -4.297 1.00 . A A . 13 LYS HG2 1 1 6 4029 1 1 11 LYS HG3 H -7.566 -4.198 -3.320 1.00 . A A . 13 LYS HG3 1 1 6 4030 1 1 11 LYS HZ1 H -5.133 -7.335 -4.840 1.00 . A A . 13 LYS HZ1 1 1 6 4031 1 1 11 LYS HZ2 H -5.445 -6.723 -6.394 1.00 . A A . 13 LYS HZ2 1 1 6 4032 1 1 11 LYS HZ3 H -6.655 -7.569 -5.553 1.00 . A A . 13 LYS HZ3 1 1 6 4033 1 1 11 LYS N N -9.531 -3.150 -2.003 1.00 . A A . 13 LYS N 1 1 6 4034 1 1 11 LYS NZ N -5.856 -6.911 -5.457 1.00 . A A . 13 LYS NZ 1 1 6 4035 1 1 11 LYS O O -7.455 -5.134 -0.743 1.00 . A A . 13 LYS O 1 1 6 4036 1 1 12 CYS C C -8.230 -6.709 2.137 1.00 . A A . 14 CYS C 1 1 6 4037 1 1 12 CYS CA C -8.190 -5.209 1.844 1.00 . A A . 14 CYS CA 1 1 6 4038 1 1 12 CYS CB C -8.649 -4.430 3.079 1.00 . A A . 14 CYS CB 1 1 6 4039 1 1 12 CYS H H -10.045 -4.725 0.861 1.00 . A A . 14 CYS H 1 1 6 4040 1 1 12 CYS HA H -7.182 -4.920 1.589 1.00 . A A . 14 CYS HA 1 1 6 4041 1 1 12 CYS HB2 H -9.627 -4.008 2.896 1.00 . A A . 14 CYS HB2 1 1 6 4042 1 1 12 CYS HB3 H -8.698 -5.096 3.928 1.00 . A A . 14 CYS HB3 1 1 6 4043 1 1 12 CYS N N -9.095 -4.910 0.699 1.00 . A A . 14 CYS N 1 1 6 4044 1 1 12 CYS O O -7.954 -7.147 3.236 1.00 . A A . 14 CYS O 1 1 6 4045 1 1 12 CYS SG S -7.474 -3.097 3.422 1.00 . A A . 14 CYS SG 1 1 6 4046 1 1 13 ALA C C -7.919 -9.676 0.206 1.00 . A A . 15 ALA C 1 1 6 4047 1 1 13 ALA CA C -8.628 -8.973 1.365 1.00 . A A . 15 ALA CA 1 1 6 4048 1 1 13 ALA CB C -10.090 -9.423 1.422 1.00 . A A . 15 ALA CB 1 1 6 4049 1 1 13 ALA H H -8.785 -7.121 0.277 1.00 . A A . 15 ALA H 1 1 6 4050 1 1 13 ALA HA H -8.137 -9.225 2.293 1.00 . A A . 15 ALA HA 1 1 6 4051 1 1 13 ALA HB1 H -10.438 -9.644 0.424 1.00 . A A . 15 ALA HB1 1 1 6 4052 1 1 13 ALA HB2 H -10.693 -8.636 1.849 1.00 . A A . 15 ALA HB2 1 1 6 4053 1 1 13 ALA HB3 H -10.169 -10.309 2.035 1.00 . A A . 15 ALA HB3 1 1 6 4054 1 1 13 ALA N N -8.571 -7.499 1.156 1.00 . A A . 15 ALA N 1 1 6 4055 1 1 13 ALA O O -8.544 -10.175 -0.709 1.00 . A A . 15 ALA O 1 1 6 4056 1 1 14 CYS C C -5.294 -11.706 -0.361 1.00 . A A . 16 CYS C 1 1 6 4057 1 1 14 CYS CA C -5.860 -10.380 -0.860 1.00 . A A . 16 CYS CA 1 1 6 4058 1 1 14 CYS CB C -4.718 -9.469 -1.311 1.00 . A A . 16 CYS CB 1 1 6 4059 1 1 14 CYS H H -6.132 -9.304 0.984 1.00 . A A . 16 CYS H 1 1 6 4060 1 1 14 CYS HA H -6.517 -10.569 -1.694 1.00 . A A . 16 CYS HA 1 1 6 4061 1 1 14 CYS HB2 H -4.298 -8.965 -0.453 1.00 . A A . 16 CYS HB2 1 1 6 4062 1 1 14 CYS HB3 H -3.953 -10.061 -1.793 1.00 . A A . 16 CYS HB3 1 1 6 4063 1 1 14 CYS N N -6.615 -9.714 0.237 1.00 . A A . 16 CYS N 1 1 6 4064 1 1 14 CYS O O -5.517 -12.108 0.764 1.00 . A A . 16 CYS O 1 1 6 4065 1 1 14 CYS SG S -5.359 -8.244 -2.481 1.00 . A A . 16 CYS SG 1 1 6 4066 1 1 15 THR C C -2.740 -13.468 0.078 1.00 . A A . 17 THR C 1 1 6 4067 1 1 15 THR CA C -3.988 -13.702 -0.785 1.00 . A A . 17 THR CA 1 1 6 4068 1 1 15 THR CB C -3.619 -14.505 -2.035 1.00 . A A . 17 THR CB 1 1 6 4069 1 1 15 THR CG2 C -3.026 -15.854 -1.625 1.00 . A A . 17 THR CG2 1 1 6 4070 1 1 15 THR H H -4.410 -12.046 -2.099 1.00 . A A . 17 THR H 1 1 6 4071 1 1 15 THR HA H -4.719 -14.250 -0.211 1.00 . A A . 17 THR HA 1 1 6 4072 1 1 15 THR HB H -2.893 -13.957 -2.614 1.00 . A A . 17 THR HB 1 1 6 4073 1 1 15 THR HG1 H -5.256 -13.882 -2.880 1.00 . A A . 17 THR HG1 1 1 6 4074 1 1 15 THR HG21 H -3.782 -16.442 -1.125 1.00 . A A . 17 THR HG21 1 1 6 4075 1 1 15 THR HG22 H -2.194 -15.694 -0.955 1.00 . A A . 17 THR HG22 1 1 6 4076 1 1 15 THR HG23 H -2.685 -16.379 -2.505 1.00 . A A . 17 THR HG23 1 1 6 4077 1 1 15 THR N N -4.567 -12.391 -1.195 1.00 . A A . 17 THR N 1 1 6 4078 1 1 15 THR O O -2.842 -13.128 1.239 1.00 . A A . 17 THR O 1 1 6 4079 1 1 15 THR OG1 O -4.786 -14.718 -2.817 1.00 . A A . 17 THR OG1 1 1 6 4080 1 1 16 MET C C 0.871 -13.225 -0.569 1.00 . A A . 18 MET C 1 1 6 4081 1 1 16 MET CA C -0.335 -13.434 0.350 1.00 . A A . 18 MET CA 1 1 6 4082 1 1 16 MET CB C -0.096 -14.658 1.237 1.00 . A A . 18 MET CB 1 1 6 4083 1 1 16 MET CE C -1.710 -16.155 4.553 1.00 . A A . 18 MET CE 1 1 6 4084 1 1 16 MET CG C -0.975 -14.559 2.485 1.00 . A A . 18 MET CG 1 1 6 4085 1 1 16 MET H H -1.486 -13.927 -1.401 1.00 . A A . 18 MET H 1 1 6 4086 1 1 16 MET HA H -0.466 -12.562 0.972 1.00 . A A . 18 MET HA 1 1 6 4087 1 1 16 MET HB2 H -0.344 -15.555 0.688 1.00 . A A . 18 MET HB2 1 1 6 4088 1 1 16 MET HB3 H 0.943 -14.691 1.533 1.00 . A A . 18 MET HB3 1 1 6 4089 1 1 16 MET HE1 H -2.204 -15.403 5.153 1.00 . A A . 18 MET HE1 1 1 6 4090 1 1 16 MET HE2 H -1.464 -17.002 5.171 1.00 . A A . 18 MET HE2 1 1 6 4091 1 1 16 MET HE3 H -2.365 -16.472 3.752 1.00 . A A . 18 MET HE3 1 1 6 4092 1 1 16 MET HG2 H -1.096 -13.523 2.760 1.00 . A A . 18 MET HG2 1 1 6 4093 1 1 16 MET HG3 H -1.943 -14.992 2.276 1.00 . A A . 18 MET HG3 1 1 6 4094 1 1 16 MET N N -1.563 -13.650 -0.466 1.00 . A A . 18 MET N 1 1 6 4095 1 1 16 MET O O 1.879 -13.892 -0.446 1.00 . A A . 18 MET O 1 1 6 4096 1 1 16 MET SD S -0.195 -15.459 3.848 1.00 . A A . 18 MET SD 1 1 6 4097 1 1 17 GLU C C 3.027 -11.312 -1.636 1.00 . A A . 19 GLU C 1 1 6 4098 1 1 17 GLU CA C 1.928 -12.050 -2.403 1.00 . A A . 19 GLU CA 1 1 6 4099 1 1 17 GLU CB C 1.461 -11.194 -3.582 1.00 . A A . 19 GLU CB 1 1 6 4100 1 1 17 GLU CD C -0.153 -12.439 -5.023 1.00 . A A . 19 GLU CD 1 1 6 4101 1 1 17 GLU CG C 1.319 -12.074 -4.824 1.00 . A A . 19 GLU CG 1 1 6 4102 1 1 17 GLU H H -0.039 -11.770 -1.567 1.00 . A A . 19 GLU H 1 1 6 4103 1 1 17 GLU HA H 2.311 -12.991 -2.767 1.00 . A A . 19 GLU HA 1 1 6 4104 1 1 17 GLU HB2 H 0.508 -10.745 -3.346 1.00 . A A . 19 GLU HB2 1 1 6 4105 1 1 17 GLU HB3 H 2.187 -10.418 -3.774 1.00 . A A . 19 GLU HB3 1 1 6 4106 1 1 17 GLU HG2 H 1.678 -11.537 -5.690 1.00 . A A . 19 GLU HG2 1 1 6 4107 1 1 17 GLU HG3 H 1.896 -12.977 -4.694 1.00 . A A . 19 GLU HG3 1 1 6 4108 1 1 17 GLU N N 0.780 -12.302 -1.485 1.00 . A A . 19 GLU N 1 1 6 4109 1 1 17 GLU O O 2.756 -10.560 -0.721 1.00 . A A . 19 GLU O 1 1 6 4110 1 1 17 GLU OE1 O -0.714 -13.059 -4.135 1.00 . A A . 19 GLU OE1 1 1 6 4111 1 1 17 GLU OE2 O -0.695 -12.092 -6.059 1.00 . A A . 19 GLU OE2 1 1 6 4112 1 1 18 TYR C C 5.814 -9.591 -2.047 1.00 . A A . 20 TYR C 1 1 6 4113 1 1 18 TYR CA C 5.365 -10.823 -1.266 1.00 . A A . 20 TYR CA 1 1 6 4114 1 1 18 TYR CB C 6.557 -11.755 -1.105 1.00 . A A . 20 TYR CB 1 1 6 4115 1 1 18 TYR CD1 C 8.039 -10.200 0.208 1.00 . A A . 20 TYR CD1 1 1 6 4116 1 1 18 TYR CD2 C 7.272 -12.243 1.264 1.00 . A A . 20 TYR CD2 1 1 6 4117 1 1 18 TYR CE1 C 8.736 -9.858 1.374 1.00 . A A . 20 TYR CE1 1 1 6 4118 1 1 18 TYR CE2 C 7.968 -11.901 2.430 1.00 . A A . 20 TYR CE2 1 1 6 4119 1 1 18 TYR CG C 7.308 -11.391 0.153 1.00 . A A . 20 TYR CG 1 1 6 4120 1 1 18 TYR CZ C 8.700 -10.709 2.485 1.00 . A A . 20 TYR CZ 1 1 6 4121 1 1 18 TYR H H 4.472 -12.132 -2.729 1.00 . A A . 20 TYR H 1 1 6 4122 1 1 18 TYR HA H 5.015 -10.521 -0.290 1.00 . A A . 20 TYR HA 1 1 6 4123 1 1 18 TYR HB2 H 6.217 -12.779 -1.048 1.00 . A A . 20 TYR HB2 1 1 6 4124 1 1 18 TYR HB3 H 7.205 -11.633 -1.954 1.00 . A A . 20 TYR HB3 1 1 6 4125 1 1 18 TYR HD1 H 8.068 -9.543 -0.649 1.00 . A A . 20 TYR HD1 1 1 6 4126 1 1 18 TYR HD2 H 6.707 -13.163 1.221 1.00 . A A . 20 TYR HD2 1 1 6 4127 1 1 18 TYR HE1 H 9.300 -8.938 1.415 1.00 . A A . 20 TYR HE1 1 1 6 4128 1 1 18 TYR HE2 H 7.940 -12.558 3.286 1.00 . A A . 20 TYR HE2 1 1 6 4129 1 1 18 TYR HH H 10.299 -10.202 3.398 1.00 . A A . 20 TYR HH 1 1 6 4130 1 1 18 TYR N N 4.265 -11.520 -1.991 1.00 . A A . 20 TYR N 1 1 6 4131 1 1 18 TYR O O 6.591 -9.675 -2.976 1.00 . A A . 20 TYR O 1 1 6 4132 1 1 18 TYR OH O 9.384 -10.371 3.635 1.00 . A A . 20 TYR OH 1 1 6 4133 1 1 19 ARG C C 5.918 -6.098 -1.270 1.00 . A A . 21 ARG C 1 1 6 4134 1 1 19 ARG CA C 5.743 -7.186 -2.335 1.00 . A A . 21 ARG CA 1 1 6 4135 1 1 19 ARG CB C 4.661 -6.744 -3.332 1.00 . A A . 21 ARG CB 1 1 6 4136 1 1 19 ARG CD C 4.804 -8.288 -5.291 1.00 . A A . 21 ARG CD 1 1 6 4137 1 1 19 ARG CG C 4.026 -7.959 -4.017 1.00 . A A . 21 ARG CG 1 1 6 4138 1 1 19 ARG CZ C 6.497 -9.907 -5.899 1.00 . A A . 21 ARG CZ 1 1 6 4139 1 1 19 ARG H H 4.740 -8.421 -0.890 1.00 . A A . 21 ARG H 1 1 6 4140 1 1 19 ARG HA H 6.677 -7.337 -2.857 1.00 . A A . 21 ARG HA 1 1 6 4141 1 1 19 ARG HB2 H 3.897 -6.190 -2.809 1.00 . A A . 21 ARG HB2 1 1 6 4142 1 1 19 ARG HB3 H 5.109 -6.108 -4.083 1.00 . A A . 21 ARG HB3 1 1 6 4143 1 1 19 ARG HD2 H 4.122 -8.338 -6.127 1.00 . A A . 21 ARG HD2 1 1 6 4144 1 1 19 ARG HD3 H 5.539 -7.518 -5.472 1.00 . A A . 21 ARG HD3 1 1 6 4145 1 1 19 ARG HE H 5.184 -10.230 -4.445 1.00 . A A . 21 ARG HE 1 1 6 4146 1 1 19 ARG HG2 H 4.047 -8.808 -3.351 1.00 . A A . 21 ARG HG2 1 1 6 4147 1 1 19 ARG HG3 H 3.003 -7.731 -4.274 1.00 . A A . 21 ARG HG3 1 1 6 4148 1 1 19 ARG HH11 H 7.778 -8.682 -4.968 1.00 . A A . 21 ARG HH11 1 1 6 4149 1 1 19 ARG HH12 H 8.432 -9.583 -6.295 1.00 . A A . 21 ARG HH12 1 1 6 4150 1 1 19 ARG HH21 H 5.452 -11.201 -7.010 1.00 . A A . 21 ARG HH21 1 1 6 4151 1 1 19 ARG HH22 H 7.115 -11.007 -7.451 1.00 . A A . 21 ARG HH22 1 1 6 4152 1 1 19 ARG N N 5.344 -8.449 -1.653 1.00 . A A . 21 ARG N 1 1 6 4153 1 1 19 ARG NE N 5.490 -9.599 -5.130 1.00 . A A . 21 ARG NE 1 1 6 4154 1 1 19 ARG NH1 N 7.660 -9.347 -5.706 1.00 . A A . 21 ARG NH1 1 1 6 4155 1 1 19 ARG NH2 N 6.342 -10.773 -6.862 1.00 . A A . 21 ARG NH2 1 1 6 4156 1 1 19 ARG O O 4.961 -5.473 -0.865 1.00 . A A . 21 ARG O 1 1 6 4157 1 1 20 PRO C C 7.458 -3.499 -0.389 1.00 . A A . 22 PRO C 1 1 6 4158 1 1 20 PRO CA C 7.462 -4.915 0.197 1.00 . A A . 22 PRO CA 1 1 6 4159 1 1 20 PRO CB C 8.864 -5.321 0.659 1.00 . A A . 22 PRO CB 1 1 6 4160 1 1 20 PRO CD C 8.302 -6.673 -1.335 1.00 . A A . 22 PRO CD 1 1 6 4161 1 1 20 PRO CG C 9.481 -6.149 -0.493 1.00 . A A . 22 PRO CG 1 1 6 4162 1 1 20 PRO HA H 6.771 -4.986 1.022 1.00 . A A . 22 PRO HA 1 1 6 4163 1 1 20 PRO HB2 H 9.460 -4.439 0.849 1.00 . A A . 22 PRO HB2 1 1 6 4164 1 1 20 PRO HB3 H 8.800 -5.927 1.549 1.00 . A A . 22 PRO HB3 1 1 6 4165 1 1 20 PRO HD2 H 8.469 -6.473 -2.384 1.00 . A A . 22 PRO HD2 1 1 6 4166 1 1 20 PRO HD3 H 8.156 -7.729 -1.167 1.00 . A A . 22 PRO HD3 1 1 6 4167 1 1 20 PRO HG2 H 10.122 -5.523 -1.096 1.00 . A A . 22 PRO HG2 1 1 6 4168 1 1 20 PRO HG3 H 10.041 -6.981 -0.093 1.00 . A A . 22 PRO HG3 1 1 6 4169 1 1 20 PRO N N 7.137 -5.912 -0.837 1.00 . A A . 22 PRO N 1 1 6 4170 1 1 20 PRO O O 8.316 -3.133 -1.167 1.00 . A A . 22 PRO O 1 1 6 4171 1 1 21 LEU C C 6.599 -0.327 0.629 1.00 . A A . 23 LEU C 1 1 6 4172 1 1 21 LEU CA C 6.426 -1.305 -0.530 1.00 . A A . 23 LEU CA 1 1 6 4173 1 1 21 LEU CB C 5.056 -1.058 -1.171 1.00 . A A . 23 LEU CB 1 1 6 4174 1 1 21 LEU CD1 C 3.794 -2.841 -2.385 1.00 . A A . 23 LEU CD1 1 1 6 4175 1 1 21 LEU CD2 C 4.679 -0.876 -3.634 1.00 . A A . 23 LEU CD2 1 1 6 4176 1 1 21 LEU CG C 4.948 -1.843 -2.480 1.00 . A A . 23 LEU CG 1 1 6 4177 1 1 21 LEU H H 5.818 -3.019 0.623 1.00 . A A . 23 LEU H 1 1 6 4178 1 1 21 LEU HA H 7.205 -1.146 -1.260 1.00 . A A . 23 LEU HA 1 1 6 4179 1 1 21 LEU HB2 H 4.280 -1.381 -0.493 1.00 . A A . 23 LEU HB2 1 1 6 4180 1 1 21 LEU HB3 H 4.938 0.004 -1.375 1.00 . A A . 23 LEU HB3 1 1 6 4181 1 1 21 LEU HD11 H 4.095 -3.685 -1.782 1.00 . A A . 23 LEU HD11 1 1 6 4182 1 1 21 LEU HD12 H 3.530 -3.183 -3.375 1.00 . A A . 23 LEU HD12 1 1 6 4183 1 1 21 LEU HD13 H 2.938 -2.361 -1.930 1.00 . A A . 23 LEU HD13 1 1 6 4184 1 1 21 LEU HD21 H 5.308 -1.133 -4.474 1.00 . A A . 23 LEU HD21 1 1 6 4185 1 1 21 LEU HD22 H 4.897 0.132 -3.316 1.00 . A A . 23 LEU HD22 1 1 6 4186 1 1 21 LEU HD23 H 3.643 -0.946 -3.926 1.00 . A A . 23 LEU HD23 1 1 6 4187 1 1 21 LEU HG H 5.872 -2.375 -2.660 1.00 . A A . 23 LEU HG 1 1 6 4188 1 1 21 LEU N N 6.495 -2.700 -0.009 1.00 . A A . 23 LEU N 1 1 6 4189 1 1 21 LEU O O 5.907 -0.409 1.623 1.00 . A A . 23 LEU O 1 1 6 4190 1 1 22 CYS C C 6.698 2.742 1.363 1.00 . A A . 24 CYS C 1 1 6 4191 1 1 22 CYS CA C 7.659 1.590 1.614 1.00 . A A . 24 CYS CA 1 1 6 4192 1 1 22 CYS CB C 9.091 2.123 1.633 1.00 . A A . 24 CYS CB 1 1 6 4193 1 1 22 CYS H H 8.038 0.684 -0.305 1.00 . A A . 24 CYS H 1 1 6 4194 1 1 22 CYS HA H 7.428 1.120 2.559 1.00 . A A . 24 CYS HA 1 1 6 4195 1 1 22 CYS HB2 H 9.777 1.310 1.817 1.00 . A A . 24 CYS HB2 1 1 6 4196 1 1 22 CYS HB3 H 9.318 2.577 0.681 1.00 . A A . 24 CYS HB3 1 1 6 4197 1 1 22 CYS N N 7.492 0.611 0.511 1.00 . A A . 24 CYS N 1 1 6 4198 1 1 22 CYS O O 6.794 3.423 0.369 1.00 . A A . 24 CYS O 1 1 6 4199 1 1 22 CYS SG S 9.252 3.360 2.945 1.00 . A A . 24 CYS SG 1 1 6 4200 1 1 23 GLY C C 5.478 5.395 2.358 1.00 . A A . 25 GLY C 1 1 6 4201 1 1 23 GLY CA C 4.794 4.070 2.032 1.00 . A A . 25 GLY CA 1 1 6 4202 1 1 23 GLY H H 5.689 2.389 3.035 1.00 . A A . 25 GLY H 1 1 6 4203 1 1 23 GLY HA2 H 4.467 4.073 1.001 1.00 . A A . 25 GLY HA2 1 1 6 4204 1 1 23 GLY HA3 H 3.943 3.937 2.682 1.00 . A A . 25 GLY HA3 1 1 6 4205 1 1 23 GLY N N 5.761 2.959 2.242 1.00 . A A . 25 GLY N 1 1 6 4206 1 1 23 GLY O O 6.306 5.470 3.244 1.00 . A A . 25 GLY O 1 1 6 4207 1 1 24 SER C C 5.664 8.114 3.409 1.00 . A A . 26 SER C 1 1 6 4208 1 1 24 SER CA C 5.773 7.766 1.920 1.00 . A A . 26 SER CA 1 1 6 4209 1 1 24 SER CB C 5.058 8.838 1.104 1.00 . A A . 26 SER CB 1 1 6 4210 1 1 24 SER H H 4.468 6.357 0.936 1.00 . A A . 26 SER H 1 1 6 4211 1 1 24 SER HA H 6.814 7.733 1.633 1.00 . A A . 26 SER HA 1 1 6 4212 1 1 24 SER HB2 H 4.100 8.466 0.784 1.00 . A A . 26 SER HB2 1 1 6 4213 1 1 24 SER HB3 H 4.913 9.718 1.717 1.00 . A A . 26 SER HB3 1 1 6 4214 1 1 24 SER HG H 5.421 9.903 -0.483 1.00 . A A . 26 SER HG 1 1 6 4215 1 1 24 SER N N 5.140 6.441 1.651 1.00 . A A . 26 SER N 1 1 6 4216 1 1 24 SER O O 6.363 8.975 3.905 1.00 . A A . 26 SER O 1 1 6 4217 1 1 24 SER OG O 5.840 9.162 -0.038 1.00 . A A . 26 SER OG 1 1 6 4218 1 1 25 ASP C C 5.675 6.975 6.391 1.00 . A A . 27 ASP C 1 1 6 4219 1 1 25 ASP CA C 4.638 7.758 5.579 1.00 . A A . 27 ASP CA 1 1 6 4220 1 1 25 ASP CB C 3.234 7.356 6.027 1.00 . A A . 27 ASP CB 1 1 6 4221 1 1 25 ASP CG C 3.093 5.836 5.960 1.00 . A A . 27 ASP CG 1 1 6 4222 1 1 25 ASP H H 4.233 6.772 3.710 1.00 . A A . 27 ASP H 1 1 6 4223 1 1 25 ASP HA H 4.779 8.817 5.744 1.00 . A A . 27 ASP HA 1 1 6 4224 1 1 25 ASP HB2 H 3.068 7.691 7.041 1.00 . A A . 27 ASP HB2 1 1 6 4225 1 1 25 ASP HB3 H 2.507 7.811 5.374 1.00 . A A . 27 ASP HB3 1 1 6 4226 1 1 25 ASP N N 4.792 7.457 4.126 1.00 . A A . 27 ASP N 1 1 6 4227 1 1 25 ASP O O 5.519 6.768 7.578 1.00 . A A . 27 ASP O 1 1 6 4228 1 1 25 ASP OD1 O 3.722 5.239 5.102 1.00 . A A . 27 ASP OD1 1 1 6 4229 1 1 25 ASP OD2 O 2.355 5.293 6.766 1.00 . A A . 27 ASP OD2 1 1 6 4230 1 1 26 ASN C C 7.173 4.490 7.070 1.00 . A A . 28 ASN C 1 1 6 4231 1 1 26 ASN CA C 7.778 5.774 6.496 1.00 . A A . 28 ASN CA 1 1 6 4232 1 1 26 ASN CB C 8.336 6.632 7.634 1.00 . A A . 28 ASN CB 1 1 6 4233 1 1 26 ASN CG C 9.839 6.379 7.767 1.00 . A A . 28 ASN CG 1 1 6 4234 1 1 26 ASN H H 6.840 6.719 4.809 1.00 . A A . 28 ASN H 1 1 6 4235 1 1 26 ASN HA H 8.577 5.520 5.816 1.00 . A A . 28 ASN HA 1 1 6 4236 1 1 26 ASN HB2 H 8.162 7.676 7.418 1.00 . A A . 28 ASN HB2 1 1 6 4237 1 1 26 ASN HB3 H 7.845 6.368 8.559 1.00 . A A . 28 ASN HB3 1 1 6 4238 1 1 26 ASN HD21 H 10.299 8.307 7.900 1.00 . A A . 28 ASN HD21 1 1 6 4239 1 1 26 ASN HD22 H 11.617 7.238 7.974 1.00 . A A . 28 ASN HD22 1 1 6 4240 1 1 26 ASN N N 6.732 6.540 5.762 1.00 . A A . 28 ASN N 1 1 6 4241 1 1 26 ASN ND2 N 10.652 7.392 7.890 1.00 . A A . 28 ASN ND2 1 1 6 4242 1 1 26 ASN O O 7.499 4.081 8.167 1.00 . A A . 28 ASN O 1 1 6 4243 1 1 26 ASN OD1 O 10.278 5.247 7.755 1.00 . A A . 28 ASN OD1 1 1 6 4244 1 1 27 LYS C C 6.018 1.425 5.923 1.00 . A A . 29 LYS C 1 1 6 4245 1 1 27 LYS CA C 5.684 2.591 6.860 1.00 . A A . 29 LYS CA 1 1 6 4246 1 1 27 LYS CB C 4.167 2.758 6.943 1.00 . A A . 29 LYS CB 1 1 6 4247 1 1 27 LYS CD C 3.113 1.101 8.489 1.00 . A A . 29 LYS CD 1 1 6 4248 1 1 27 LYS CE C 2.680 0.842 9.933 1.00 . A A . 29 LYS CE 1 1 6 4249 1 1 27 LYS CG C 3.707 2.506 8.380 1.00 . A A . 29 LYS CG 1 1 6 4250 1 1 27 LYS H H 6.046 4.198 5.456 1.00 . A A . 29 LYS H 1 1 6 4251 1 1 27 LYS HA H 6.075 2.381 7.844 1.00 . A A . 29 LYS HA 1 1 6 4252 1 1 27 LYS HB2 H 3.899 3.762 6.649 1.00 . A A . 29 LYS HB2 1 1 6 4253 1 1 27 LYS HB3 H 3.689 2.049 6.284 1.00 . A A . 29 LYS HB3 1 1 6 4254 1 1 27 LYS HD2 H 2.258 1.020 7.834 1.00 . A A . 29 LYS HD2 1 1 6 4255 1 1 27 LYS HD3 H 3.857 0.373 8.202 1.00 . A A . 29 LYS HD3 1 1 6 4256 1 1 27 LYS HE2 H 3.382 1.310 10.607 1.00 . A A . 29 LYS HE2 1 1 6 4257 1 1 27 LYS HE3 H 1.696 1.259 10.094 1.00 . A A . 29 LYS HE3 1 1 6 4258 1 1 27 LYS HG2 H 4.552 2.594 9.048 1.00 . A A . 29 LYS HG2 1 1 6 4259 1 1 27 LYS HG3 H 2.957 3.234 8.651 1.00 . A A . 29 LYS HG3 1 1 6 4260 1 1 27 LYS HZ1 H 3.038 -0.822 11.133 1.00 . A A . 29 LYS HZ1 1 1 6 4261 1 1 27 LYS HZ2 H 3.213 -1.117 9.468 1.00 . A A . 29 LYS HZ2 1 1 6 4262 1 1 27 LYS HZ3 H 1.664 -0.963 10.149 1.00 . A A . 29 LYS HZ3 1 1 6 4263 1 1 27 LYS N N 6.298 3.850 6.342 1.00 . A A . 29 LYS N 1 1 6 4264 1 1 27 LYS NZ N 2.647 -0.626 10.190 1.00 . A A . 29 LYS NZ 1 1 6 4265 1 1 27 LYS O O 6.461 1.617 4.809 1.00 . A A . 29 LYS O 1 1 6 4266 1 1 28 THR C C 4.807 -1.642 5.085 1.00 . A A . 30 THR C 1 1 6 4267 1 1 28 THR CA C 6.114 -0.962 5.501 1.00 . A A . 30 THR CA 1 1 6 4268 1 1 28 THR CB C 6.987 -1.959 6.272 1.00 . A A . 30 THR CB 1 1 6 4269 1 1 28 THR CG2 C 7.028 -3.292 5.522 1.00 . A A . 30 THR CG2 1 1 6 4270 1 1 28 THR H H 5.451 0.077 7.270 1.00 . A A . 30 THR H 1 1 6 4271 1 1 28 THR HA H 6.641 -0.629 4.620 1.00 . A A . 30 THR HA 1 1 6 4272 1 1 28 THR HB H 6.570 -2.117 7.255 1.00 . A A . 30 THR HB 1 1 6 4273 1 1 28 THR HG1 H 8.793 -2.008 6.992 1.00 . A A . 30 THR HG1 1 1 6 4274 1 1 28 THR HG21 H 6.503 -4.043 6.094 1.00 . A A . 30 THR HG21 1 1 6 4275 1 1 28 THR HG22 H 8.055 -3.597 5.387 1.00 . A A . 30 THR HG22 1 1 6 4276 1 1 28 THR HG23 H 6.556 -3.178 4.558 1.00 . A A . 30 THR HG23 1 1 6 4277 1 1 28 THR N N 5.809 0.214 6.368 1.00 . A A . 30 THR N 1 1 6 4278 1 1 28 THR O O 3.949 -1.913 5.902 1.00 . A A . 30 THR O 1 1 6 4279 1 1 28 THR OG1 O 8.304 -1.440 6.391 1.00 . A A . 30 THR OG1 1 1 6 4280 1 1 29 TYR C C 3.712 -4.028 2.967 1.00 . A A . 31 TYR C 1 1 6 4281 1 1 29 TYR CA C 3.407 -2.578 3.344 1.00 . A A . 31 TYR CA 1 1 6 4282 1 1 29 TYR CB C 2.887 -1.833 2.116 1.00 . A A . 31 TYR CB 1 1 6 4283 1 1 29 TYR CD1 C 2.633 0.374 3.306 1.00 . A A . 31 TYR CD1 1 1 6 4284 1 1 29 TYR CD2 C 0.694 -0.597 2.222 1.00 . A A . 31 TYR CD2 1 1 6 4285 1 1 29 TYR CE1 C 1.858 1.465 3.714 1.00 . A A . 31 TYR CE1 1 1 6 4286 1 1 29 TYR CE2 C -0.081 0.493 2.630 1.00 . A A . 31 TYR CE2 1 1 6 4287 1 1 29 TYR CG C 2.051 -0.657 2.559 1.00 . A A . 31 TYR CG 1 1 6 4288 1 1 29 TYR CZ C 0.501 1.525 3.376 1.00 . A A . 31 TYR CZ 1 1 6 4289 1 1 29 TYR H H 5.353 -1.692 3.179 1.00 . A A . 31 TYR H 1 1 6 4290 1 1 29 TYR HA H 2.661 -2.557 4.123 1.00 . A A . 31 TYR HA 1 1 6 4291 1 1 29 TYR HB2 H 3.722 -1.480 1.529 1.00 . A A . 31 TYR HB2 1 1 6 4292 1 1 29 TYR HB3 H 2.286 -2.498 1.522 1.00 . A A . 31 TYR HB3 1 1 6 4293 1 1 29 TYR HD1 H 3.681 0.328 3.565 1.00 . A A . 31 TYR HD1 1 1 6 4294 1 1 29 TYR HD2 H 0.245 -1.394 1.646 1.00 . A A . 31 TYR HD2 1 1 6 4295 1 1 29 TYR HE1 H 2.308 2.261 4.290 1.00 . A A . 31 TYR HE1 1 1 6 4296 1 1 29 TYR HE2 H -1.128 0.540 2.370 1.00 . A A . 31 TYR HE2 1 1 6 4297 1 1 29 TYR HH H -0.893 2.291 4.435 1.00 . A A . 31 TYR HH 1 1 6 4298 1 1 29 TYR N N 4.651 -1.918 3.820 1.00 . A A . 31 TYR N 1 1 6 4299 1 1 29 TYR O O 4.784 -4.341 2.488 1.00 . A A . 31 TYR O 1 1 6 4300 1 1 29 TYR OH O -0.265 2.602 3.779 1.00 . A A . 31 TYR OH 1 1 6 4301 1 1 30 GLY C C 2.930 -6.513 1.313 1.00 . A A . 32 GLY C 1 1 6 4302 1 1 30 GLY CA C 3.022 -6.342 2.828 1.00 . A A . 32 GLY CA 1 1 6 4303 1 1 30 GLY H H 1.919 -4.645 3.564 1.00 . A A . 32 GLY H 1 1 6 4304 1 1 30 GLY HA2 H 4.009 -6.633 3.166 1.00 . A A . 32 GLY HA2 1 1 6 4305 1 1 30 GLY HA3 H 2.280 -6.964 3.304 1.00 . A A . 32 GLY HA3 1 1 6 4306 1 1 30 GLY N N 2.780 -4.917 3.178 1.00 . A A . 32 GLY N 1 1 6 4307 1 1 30 GLY O O 3.600 -7.342 0.730 1.00 . A A . 32 GLY O 1 1 6 4308 1 1 31 ASN C C 1.219 -4.652 -1.367 1.00 . A A . 33 ASN C 1 1 6 4309 1 1 31 ASN CA C 1.981 -5.856 -0.811 1.00 . A A . 33 ASN CA 1 1 6 4310 1 1 31 ASN CB C 1.231 -7.144 -1.153 1.00 . A A . 33 ASN CB 1 1 6 4311 1 1 31 ASN CG C 0.015 -7.283 -0.239 1.00 . A A . 33 ASN CG 1 1 6 4312 1 1 31 ASN H H 1.573 -5.066 1.149 1.00 . A A . 33 ASN H 1 1 6 4313 1 1 31 ASN HA H 2.964 -5.889 -1.251 1.00 . A A . 33 ASN HA 1 1 6 4314 1 1 31 ASN HB2 H 0.908 -7.110 -2.184 1.00 . A A . 33 ASN HB2 1 1 6 4315 1 1 31 ASN HB3 H 1.886 -7.991 -1.008 1.00 . A A . 33 ASN HB3 1 1 6 4316 1 1 31 ASN HD21 H 0.546 -9.074 0.432 1.00 . A A . 33 ASN HD21 1 1 6 4317 1 1 31 ASN HD22 H -0.901 -8.461 1.070 1.00 . A A . 33 ASN HD22 1 1 6 4318 1 1 31 ASN N N 2.106 -5.732 0.665 1.00 . A A . 33 ASN N 1 1 6 4319 1 1 31 ASN ND2 N -0.125 -8.363 0.481 1.00 . A A . 33 ASN ND2 1 1 6 4320 1 1 31 ASN O O 0.561 -3.930 -0.646 1.00 . A A . 33 ASN O 1 1 6 4321 1 1 31 ASN OD1 O -0.814 -6.400 -0.177 1.00 . A A . 33 ASN OD1 1 1 6 4322 1 1 32 LYS C C -0.904 -3.427 -3.044 1.00 . A A . 34 LYS C 1 1 6 4323 1 1 32 LYS CA C 0.600 -3.279 -3.266 1.00 . A A . 34 LYS CA 1 1 6 4324 1 1 32 LYS CB C 0.893 -3.246 -4.766 1.00 . A A . 34 LYS CB 1 1 6 4325 1 1 32 LYS CD C -0.141 -2.004 -6.670 1.00 . A A . 34 LYS CD 1 1 6 4326 1 1 32 LYS CE C 0.496 -1.053 -7.684 1.00 . A A . 34 LYS CE 1 1 6 4327 1 1 32 LYS CG C 0.563 -1.860 -5.321 1.00 . A A . 34 LYS CG 1 1 6 4328 1 1 32 LYS H H 1.849 -5.023 -3.204 1.00 . A A . 34 LYS H 1 1 6 4329 1 1 32 LYS HA H 0.941 -2.362 -2.812 1.00 . A A . 34 LYS HA 1 1 6 4330 1 1 32 LYS HB2 H 1.938 -3.462 -4.933 1.00 . A A . 34 LYS HB2 1 1 6 4331 1 1 32 LYS HB3 H 0.288 -3.985 -5.268 1.00 . A A . 34 LYS HB3 1 1 6 4332 1 1 32 LYS HD2 H -0.044 -3.023 -7.019 1.00 . A A . 34 LYS HD2 1 1 6 4333 1 1 32 LYS HD3 H -1.187 -1.760 -6.558 1.00 . A A . 34 LYS HD3 1 1 6 4334 1 1 32 LYS HE2 H -0.012 -0.100 -7.652 1.00 . A A . 34 LYS HE2 1 1 6 4335 1 1 32 LYS HE3 H 1.539 -0.914 -7.441 1.00 . A A . 34 LYS HE3 1 1 6 4336 1 1 32 LYS HG2 H -0.083 -1.340 -4.630 1.00 . A A . 34 LYS HG2 1 1 6 4337 1 1 32 LYS HG3 H 1.476 -1.298 -5.453 1.00 . A A . 34 LYS HG3 1 1 6 4338 1 1 32 LYS HZ1 H 0.757 -0.962 -9.748 1.00 . A A . 34 LYS HZ1 1 1 6 4339 1 1 32 LYS HZ2 H -0.623 -1.826 -9.261 1.00 . A A . 34 LYS HZ2 1 1 6 4340 1 1 32 LYS HZ3 H 0.920 -2.520 -9.099 1.00 . A A . 34 LYS HZ3 1 1 6 4341 1 1 32 LYS N N 1.310 -4.431 -2.648 1.00 . A A . 34 LYS N 1 1 6 4342 1 1 32 LYS NZ N 0.378 -1.634 -9.051 1.00 . A A . 34 LYS NZ 1 1 6 4343 1 1 32 LYS O O -1.659 -2.495 -3.229 1.00 . A A . 34 LYS O 1 1 6 4344 1 1 33 CYS C C -3.173 -3.982 -1.136 1.00 . A A . 35 CYS C 1 1 6 4345 1 1 33 CYS CA C -2.804 -4.767 -2.393 1.00 . A A . 35 CYS CA 1 1 6 4346 1 1 33 CYS CB C -3.104 -6.255 -2.195 1.00 . A A . 35 CYS CB 1 1 6 4347 1 1 33 CYS H H -0.725 -5.324 -2.482 1.00 . A A . 35 CYS H 1 1 6 4348 1 1 33 CYS HA H -3.364 -4.390 -3.236 1.00 . A A . 35 CYS HA 1 1 6 4349 1 1 33 CYS HB2 H -2.939 -6.782 -3.124 1.00 . A A . 35 CYS HB2 1 1 6 4350 1 1 33 CYS HB3 H -2.453 -6.657 -1.435 1.00 . A A . 35 CYS HB3 1 1 6 4351 1 1 33 CYS N N -1.348 -4.583 -2.637 1.00 . A A . 35 CYS N 1 1 6 4352 1 1 33 CYS O O -4.232 -3.391 -1.039 1.00 . A A . 35 CYS O 1 1 6 4353 1 1 33 CYS SG S -4.827 -6.466 -1.684 1.00 . A A . 35 CYS SG 1 1 6 4354 1 1 34 ASN C C -2.258 -1.714 0.788 1.00 . A A . 36 ASN C 1 1 6 4355 1 1 34 ASN CA C -2.542 -3.190 1.063 1.00 . A A . 36 ASN CA 1 1 6 4356 1 1 34 ASN CB C -1.604 -3.696 2.161 1.00 . A A . 36 ASN CB 1 1 6 4357 1 1 34 ASN CG C -2.393 -3.915 3.454 1.00 . A A . 36 ASN CG 1 1 6 4358 1 1 34 ASN H H -1.433 -4.416 -0.298 1.00 . A A . 36 ASN H 1 1 6 4359 1 1 34 ASN HA H -3.570 -3.319 1.367 1.00 . A A . 36 ASN HA 1 1 6 4360 1 1 34 ASN HB2 H -1.151 -4.628 1.851 1.00 . A A . 36 ASN HB2 1 1 6 4361 1 1 34 ASN HB3 H -0.831 -2.965 2.333 1.00 . A A . 36 ASN HB3 1 1 6 4362 1 1 34 ASN HD21 H -3.647 -5.218 2.635 1.00 . A A . 36 ASN HD21 1 1 6 4363 1 1 34 ASN HD22 H -3.912 -4.893 4.280 1.00 . A A . 36 ASN HD22 1 1 6 4364 1 1 34 ASN N N -2.284 -3.952 -0.183 1.00 . A A . 36 ASN N 1 1 6 4365 1 1 34 ASN ND2 N -3.401 -4.744 3.457 1.00 . A A . 36 ASN ND2 1 1 6 4366 1 1 34 ASN O O -2.709 -0.836 1.497 1.00 . A A . 36 ASN O 1 1 6 4367 1 1 34 ASN OD1 O -2.089 -3.327 4.473 1.00 . A A . 36 ASN OD1 1 1 6 4368 1 1 35 PHE C C -2.379 0.616 -1.279 1.00 . A A . 37 PHE C 1 1 6 4369 1 1 35 PHE CA C -1.177 -0.034 -0.590 1.00 . A A . 37 PHE CA 1 1 6 4370 1 1 35 PHE CB C 0.031 -0.020 -1.532 1.00 . A A . 37 PHE CB 1 1 6 4371 1 1 35 PHE CD1 C 1.343 2.039 -0.893 1.00 . A A . 37 PHE CD1 1 1 6 4372 1 1 35 PHE CD2 C -0.017 2.097 -2.902 1.00 . A A . 37 PHE CD2 1 1 6 4373 1 1 35 PHE CE1 C 1.743 3.361 -1.126 1.00 . A A . 37 PHE CE1 1 1 6 4374 1 1 35 PHE CE2 C 0.384 3.419 -3.134 1.00 . A A . 37 PHE CE2 1 1 6 4375 1 1 35 PHE CG C 0.463 1.406 -1.781 1.00 . A A . 37 PHE CG 1 1 6 4376 1 1 35 PHE CZ C 1.263 4.050 -2.247 1.00 . A A . 37 PHE CZ 1 1 6 4377 1 1 35 PHE H H -1.158 -2.172 -0.799 1.00 . A A . 37 PHE H 1 1 6 4378 1 1 35 PHE HA H -0.942 0.511 0.309 1.00 . A A . 37 PHE HA 1 1 6 4379 1 1 35 PHE HB2 H 0.844 -0.571 -1.082 1.00 . A A . 37 PHE HB2 1 1 6 4380 1 1 35 PHE HB3 H -0.238 -0.484 -2.470 1.00 . A A . 37 PHE HB3 1 1 6 4381 1 1 35 PHE HD1 H 1.714 1.506 -0.030 1.00 . A A . 37 PHE HD1 1 1 6 4382 1 1 35 PHE HD2 H -0.695 1.611 -3.586 1.00 . A A . 37 PHE HD2 1 1 6 4383 1 1 35 PHE HE1 H 2.421 3.850 -0.442 1.00 . A A . 37 PHE HE1 1 1 6 4384 1 1 35 PHE HE2 H 0.014 3.951 -3.998 1.00 . A A . 37 PHE HE2 1 1 6 4385 1 1 35 PHE HZ H 1.572 5.070 -2.426 1.00 . A A . 37 PHE HZ 1 1 6 4386 1 1 35 PHE N N -1.507 -1.443 -0.246 1.00 . A A . 37 PHE N 1 1 6 4387 1 1 35 PHE O O -2.688 1.769 -1.050 1.00 . A A . 37 PHE O 1 1 6 4388 1 1 36 CYS C C -5.422 0.508 -1.821 1.00 . A A . 38 CYS C 1 1 6 4389 1 1 36 CYS CA C -4.252 0.459 -2.805 1.00 . A A . 38 CYS CA 1 1 6 4390 1 1 36 CYS CB C -4.626 -0.418 -4.002 1.00 . A A . 38 CYS CB 1 1 6 4391 1 1 36 CYS H H -2.805 -1.045 -2.277 1.00 . A A . 38 CYS H 1 1 6 4392 1 1 36 CYS HA H -4.024 1.458 -3.144 1.00 . A A . 38 CYS HA 1 1 6 4393 1 1 36 CYS HB2 H -4.524 -1.458 -3.731 1.00 . A A . 38 CYS HB2 1 1 6 4394 1 1 36 CYS HB3 H -5.650 -0.221 -4.286 1.00 . A A . 38 CYS HB3 1 1 6 4395 1 1 36 CYS N N -3.066 -0.116 -2.113 1.00 . A A . 38 CYS N 1 1 6 4396 1 1 36 CYS O O -6.354 1.269 -1.985 1.00 . A A . 38 CYS O 1 1 6 4397 1 1 36 CYS SG S -3.532 -0.046 -5.396 1.00 . A A . 38 CYS SG 1 1 6 4398 1 1 37 CYS C C -6.274 0.891 1.155 1.00 . A A . 39 CYS C 1 1 6 4399 1 1 37 CYS CA C -6.478 -0.288 0.207 1.00 . A A . 39 CYS CA 1 1 6 4400 1 1 37 CYS CB C -6.462 -1.597 1.000 1.00 . A A . 39 CYS CB 1 1 6 4401 1 1 37 CYS H H -4.608 -0.900 -0.676 1.00 . A A . 39 CYS H 1 1 6 4402 1 1 37 CYS HA H -7.424 -0.184 -0.301 1.00 . A A . 39 CYS HA 1 1 6 4403 1 1 37 CYS HB2 H -6.467 -2.433 0.315 1.00 . A A . 39 CYS HB2 1 1 6 4404 1 1 37 CYS HB3 H -5.572 -1.637 1.610 1.00 . A A . 39 CYS HB3 1 1 6 4405 1 1 37 CYS N N -5.374 -0.297 -0.794 1.00 . A A . 39 CYS N 1 1 6 4406 1 1 37 CYS O O -7.216 1.518 1.600 1.00 . A A . 39 CYS O 1 1 6 4407 1 1 37 CYS SG S -7.925 -1.676 2.060 1.00 . A A . 39 CYS SG 1 1 6 4408 1 1 38 ALA C C -4.930 3.655 1.575 1.00 . A A . 40 ALA C 1 1 6 4409 1 1 38 ALA CA C -4.768 2.353 2.363 1.00 . A A . 40 ALA CA 1 1 6 4410 1 1 38 ALA CB C -3.337 2.251 2.893 1.00 . A A . 40 ALA CB 1 1 6 4411 1 1 38 ALA H H -4.303 0.691 1.077 1.00 . A A . 40 ALA H 1 1 6 4412 1 1 38 ALA HA H -5.464 2.340 3.189 1.00 . A A . 40 ALA HA 1 1 6 4413 1 1 38 ALA HB1 H -3.256 2.797 3.821 1.00 . A A . 40 ALA HB1 1 1 6 4414 1 1 38 ALA HB2 H -2.654 2.670 2.168 1.00 . A A . 40 ALA HB2 1 1 6 4415 1 1 38 ALA HB3 H -3.089 1.213 3.063 1.00 . A A . 40 ALA HB3 1 1 6 4416 1 1 38 ALA N N -5.045 1.206 1.456 1.00 . A A . 40 ALA N 1 1 6 4417 1 1 38 ALA O O -5.177 4.706 2.132 1.00 . A A . 40 ALA O 1 1 6 4418 1 1 39 VAL C C -6.431 5.082 -0.801 1.00 . A A . 41 VAL C 1 1 6 4419 1 1 39 VAL CA C -4.945 4.815 -0.556 1.00 . A A . 41 VAL CA 1 1 6 4420 1 1 39 VAL CB C -4.228 4.612 -1.896 1.00 . A A . 41 VAL CB 1 1 6 4421 1 1 39 VAL CG1 C -4.705 5.659 -2.908 1.00 . A A . 41 VAL CG1 1 1 6 4422 1 1 39 VAL CG2 C -2.719 4.759 -1.692 1.00 . A A . 41 VAL CG2 1 1 6 4423 1 1 39 VAL H H -4.600 2.728 -0.150 1.00 . A A . 41 VAL H 1 1 6 4424 1 1 39 VAL HA H -4.510 5.656 -0.038 1.00 . A A . 41 VAL HA 1 1 6 4425 1 1 39 VAL HB H -4.447 3.623 -2.273 1.00 . A A . 41 VAL HB 1 1 6 4426 1 1 39 VAL HG11 H -4.083 5.617 -3.789 1.00 . A A . 41 VAL HG11 1 1 6 4427 1 1 39 VAL HG12 H -4.639 6.641 -2.466 1.00 . A A . 41 VAL HG12 1 1 6 4428 1 1 39 VAL HG13 H -5.730 5.455 -3.181 1.00 . A A . 41 VAL HG13 1 1 6 4429 1 1 39 VAL HG21 H -2.506 5.727 -1.263 1.00 . A A . 41 VAL HG21 1 1 6 4430 1 1 39 VAL HG22 H -2.216 4.668 -2.645 1.00 . A A . 41 VAL HG22 1 1 6 4431 1 1 39 VAL HG23 H -2.368 3.984 -1.026 1.00 . A A . 41 VAL HG23 1 1 6 4432 1 1 39 VAL N N -4.797 3.588 0.277 1.00 . A A . 41 VAL N 1 1 6 4433 1 1 39 VAL O O -6.875 6.212 -0.816 1.00 . A A . 41 VAL O 1 1 6 4434 1 1 40 VAL C C -9.344 4.638 0.073 1.00 . A A . 42 VAL C 1 1 6 4435 1 1 40 VAL CA C -8.660 4.243 -1.237 1.00 . A A . 42 VAL CA 1 1 6 4436 1 1 40 VAL CB C -9.270 2.942 -1.763 1.00 . A A . 42 VAL CB 1 1 6 4437 1 1 40 VAL CG1 C -10.798 3.031 -1.706 1.00 . A A . 42 VAL CG1 1 1 6 4438 1 1 40 VAL CG2 C -8.826 2.720 -3.210 1.00 . A A . 42 VAL CG2 1 1 6 4439 1 1 40 VAL H H -6.824 3.146 -0.977 1.00 . A A . 42 VAL H 1 1 6 4440 1 1 40 VAL HA H -8.800 5.028 -1.967 1.00 . A A . 42 VAL HA 1 1 6 4441 1 1 40 VAL HB H -8.937 2.116 -1.151 1.00 . A A . 42 VAL HB 1 1 6 4442 1 1 40 VAL HG11 H -11.159 2.479 -0.851 1.00 . A A . 42 VAL HG11 1 1 6 4443 1 1 40 VAL HG12 H -11.217 2.612 -2.608 1.00 . A A . 42 VAL HG12 1 1 6 4444 1 1 40 VAL HG13 H -11.095 4.065 -1.617 1.00 . A A . 42 VAL HG13 1 1 6 4445 1 1 40 VAL HG21 H -7.937 2.109 -3.224 1.00 . A A . 42 VAL HG21 1 1 6 4446 1 1 40 VAL HG22 H -8.615 3.674 -3.673 1.00 . A A . 42 VAL HG22 1 1 6 4447 1 1 40 VAL HG23 H -9.613 2.222 -3.756 1.00 . A A . 42 VAL HG23 1 1 6 4448 1 1 40 VAL N N -7.203 4.048 -0.993 1.00 . A A . 42 VAL N 1 1 6 4449 1 1 40 VAL O O -10.419 5.204 0.078 1.00 . A A . 42 VAL O 1 1 6 4450 1 1 41 GLU C C -8.938 6.121 2.883 1.00 . A A . 43 GLU C 1 1 6 4451 1 1 41 GLU CA C -9.344 4.697 2.496 1.00 . A A . 43 GLU CA 1 1 6 4452 1 1 41 GLU CB C -8.862 3.718 3.569 1.00 . A A . 43 GLU CB 1 1 6 4453 1 1 41 GLU CD C -6.964 3.156 5.092 1.00 . A A . 43 GLU CD 1 1 6 4454 1 1 41 GLU CG C -7.383 3.971 3.867 1.00 . A A . 43 GLU CG 1 1 6 4455 1 1 41 GLU H H -7.863 3.883 1.160 1.00 . A A . 43 GLU H 1 1 6 4456 1 1 41 GLU HA H -10.421 4.640 2.415 1.00 . A A . 43 GLU HA 1 1 6 4457 1 1 41 GLU HB2 H -9.441 3.859 4.470 1.00 . A A . 43 GLU HB2 1 1 6 4458 1 1 41 GLU HB3 H -8.987 2.705 3.215 1.00 . A A . 43 GLU HB3 1 1 6 4459 1 1 41 GLU HG2 H -6.789 3.675 3.014 1.00 . A A . 43 GLU HG2 1 1 6 4460 1 1 41 GLU HG3 H -7.231 5.020 4.066 1.00 . A A . 43 GLU HG3 1 1 6 4461 1 1 41 GLU N N -8.729 4.340 1.186 1.00 . A A . 43 GLU N 1 1 6 4462 1 1 41 GLU O O -9.671 6.825 3.550 1.00 . A A . 43 GLU O 1 1 6 4463 1 1 41 GLU OE1 O -7.768 2.364 5.556 1.00 . A A . 43 GLU OE1 1 1 6 4464 1 1 41 GLU OE2 O -5.846 3.337 5.545 1.00 . A A . 43 GLU OE2 1 1 6 4465 1 1 42 SER C C -7.827 8.914 1.748 1.00 . A A . 44 SER C 1 1 6 4466 1 1 42 SER CA C -7.333 7.934 2.817 1.00 . A A . 44 SER CA 1 1 6 4467 1 1 42 SER CB C -5.806 7.979 2.886 1.00 . A A . 44 SER CB 1 1 6 4468 1 1 42 SER H H -7.199 5.972 1.933 1.00 . A A . 44 SER H 1 1 6 4469 1 1 42 SER HA H -7.745 8.212 3.777 1.00 . A A . 44 SER HA 1 1 6 4470 1 1 42 SER HB2 H -5.396 7.077 2.464 1.00 . A A . 44 SER HB2 1 1 6 4471 1 1 42 SER HB3 H -5.447 8.832 2.325 1.00 . A A . 44 SER HB3 1 1 6 4472 1 1 42 SER HG H -4.464 7.874 4.293 1.00 . A A . 44 SER HG 1 1 6 4473 1 1 42 SER N N -7.777 6.553 2.471 1.00 . A A . 44 SER N 1 1 6 4474 1 1 42 SER O O -7.590 10.103 1.828 1.00 . A A . 44 SER O 1 1 6 4475 1 1 42 SER OG O -5.398 8.086 4.245 1.00 . A A . 44 SER OG 1 1 6 4476 1 1 43 ASN C C -7.871 9.686 -1.272 1.00 . A A . 45 ASN C 1 1 6 4477 1 1 43 ASN CA C -9.017 9.322 -0.329 1.00 . A A . 45 ASN CA 1 1 6 4478 1 1 43 ASN CB C -9.592 10.595 0.293 1.00 . A A . 45 ASN CB 1 1 6 4479 1 1 43 ASN CG C -10.538 11.268 -0.703 1.00 . A A . 45 ASN CG 1 1 6 4480 1 1 43 ASN H H -8.684 7.462 0.702 1.00 . A A . 45 ASN H 1 1 6 4481 1 1 43 ASN HA H -9.790 8.813 -0.886 1.00 . A A . 45 ASN HA 1 1 6 4482 1 1 43 ASN HB2 H -10.133 10.343 1.192 1.00 . A A . 45 ASN HB2 1 1 6 4483 1 1 43 ASN HB3 H -8.787 11.272 0.535 1.00 . A A . 45 ASN HB3 1 1 6 4484 1 1 43 ASN HD21 H -11.484 12.318 0.691 1.00 . A A . 45 ASN HD21 1 1 6 4485 1 1 43 ASN HD22 H -12.037 12.554 -0.896 1.00 . A A . 45 ASN HD22 1 1 6 4486 1 1 43 ASN N N -8.509 8.423 0.747 1.00 . A A . 45 ASN N 1 1 6 4487 1 1 43 ASN ND2 N -11.427 12.117 -0.267 1.00 . A A . 45 ASN ND2 1 1 6 4488 1 1 43 ASN O O -8.007 10.535 -2.131 1.00 . A A . 45 ASN O 1 1 6 4489 1 1 43 ASN OD1 O -10.467 11.019 -1.891 1.00 . A A . 45 ASN OD1 1 1 6 4490 1 1 44 GLY C C -4.579 10.228 -1.257 1.00 . A A . 46 GLY C 1 1 6 4491 1 1 44 GLY CA C -5.590 9.363 -2.010 1.00 . A A . 46 GLY CA 1 1 6 4492 1 1 44 GLY H H -6.650 8.372 -0.421 1.00 . A A . 46 GLY H 1 1 6 4493 1 1 44 GLY HA2 H -5.118 8.442 -2.320 1.00 . A A . 46 GLY HA2 1 1 6 4494 1 1 44 GLY HA3 H -5.940 9.898 -2.879 1.00 . A A . 46 GLY HA3 1 1 6 4495 1 1 44 GLY N N -6.741 9.052 -1.120 1.00 . A A . 46 GLY N 1 1 6 4496 1 1 44 GLY O O -3.665 10.779 -1.840 1.00 . A A . 46 GLY O 1 1 6 4497 1 1 45 THR C C -2.513 10.383 1.107 1.00 . A A . 47 THR C 1 1 6 4498 1 1 45 THR CA C -3.783 11.187 0.812 1.00 . A A . 47 THR CA 1 1 6 4499 1 1 45 THR CB C -4.446 11.600 2.127 1.00 . A A . 47 THR CB 1 1 6 4500 1 1 45 THR CG2 C -3.486 12.473 2.924 1.00 . A A . 47 THR CG2 1 1 6 4501 1 1 45 THR H H -5.477 9.908 0.487 1.00 . A A . 47 THR H 1 1 6 4502 1 1 45 THR HA H -3.527 12.071 0.247 1.00 . A A . 47 THR HA 1 1 6 4503 1 1 45 THR HB H -4.685 10.718 2.703 1.00 . A A . 47 THR HB 1 1 6 4504 1 1 45 THR HG1 H -5.874 12.186 0.935 1.00 . A A . 47 THR HG1 1 1 6 4505 1 1 45 THR HG21 H -2.541 12.531 2.405 1.00 . A A . 47 THR HG21 1 1 6 4506 1 1 45 THR HG22 H -3.336 12.041 3.901 1.00 . A A . 47 THR HG22 1 1 6 4507 1 1 45 THR HG23 H -3.904 13.463 3.025 1.00 . A A . 47 THR HG23 1 1 6 4508 1 1 45 THR N N -4.733 10.356 0.031 1.00 . A A . 47 THR N 1 1 6 4509 1 1 45 THR O O -1.483 10.931 1.443 1.00 . A A . 47 THR O 1 1 6 4510 1 1 45 THR OG1 O -5.638 12.329 1.855 1.00 . A A . 47 THR OG1 1 1 6 4511 1 1 46 LEU C C -0.548 8.108 -0.021 1.00 . A A . 48 LEU C 1 1 6 4512 1 1 46 LEU CA C -1.379 8.245 1.258 1.00 . A A . 48 LEU CA 1 1 6 4513 1 1 46 LEU CB C -1.828 6.860 1.729 1.00 . A A . 48 LEU CB 1 1 6 4514 1 1 46 LEU CD1 C -0.915 5.771 3.780 1.00 . A A . 48 LEU CD1 1 1 6 4515 1 1 46 LEU CD2 C -0.421 4.809 1.528 1.00 . A A . 48 LEU CD2 1 1 6 4516 1 1 46 LEU CG C -0.636 6.103 2.314 1.00 . A A . 48 LEU CG 1 1 6 4517 1 1 46 LEU H H -3.421 8.662 0.713 1.00 . A A . 48 LEU H 1 1 6 4518 1 1 46 LEU HA H -0.781 8.710 2.028 1.00 . A A . 48 LEU HA 1 1 6 4519 1 1 46 LEU HB2 H -2.592 6.969 2.486 1.00 . A A . 48 LEU HB2 1 1 6 4520 1 1 46 LEU HB3 H -2.228 6.307 0.893 1.00 . A A . 48 LEU HB3 1 1 6 4521 1 1 46 LEU HD11 H -0.326 4.915 4.073 1.00 . A A . 48 LEU HD11 1 1 6 4522 1 1 46 LEU HD12 H -1.963 5.546 3.904 1.00 . A A . 48 LEU HD12 1 1 6 4523 1 1 46 LEU HD13 H -0.652 6.618 4.397 1.00 . A A . 48 LEU HD13 1 1 6 4524 1 1 46 LEU HD21 H -1.119 4.769 0.704 1.00 . A A . 48 LEU HD21 1 1 6 4525 1 1 46 LEU HD22 H -0.581 3.962 2.177 1.00 . A A . 48 LEU HD22 1 1 6 4526 1 1 46 LEU HD23 H 0.588 4.784 1.146 1.00 . A A . 48 LEU HD23 1 1 6 4527 1 1 46 LEU HG H 0.249 6.719 2.248 1.00 . A A . 48 LEU HG 1 1 6 4528 1 1 46 LEU N N -2.581 9.085 0.985 1.00 . A A . 48 LEU N 1 1 6 4529 1 1 46 LEU O O -1.056 8.237 -1.117 1.00 . A A . 48 LEU O 1 1 6 4530 1 1 47 THR C C 2.673 6.657 -0.866 1.00 . A A . 49 THR C 1 1 6 4531 1 1 47 THR CA C 1.583 7.713 -1.107 1.00 . A A . 49 THR CA 1 1 6 4532 1 1 47 THR CB C 2.225 9.066 -1.425 1.00 . A A . 49 THR CB 1 1 6 4533 1 1 47 THR CG2 C 1.179 9.998 -2.040 1.00 . A A . 49 THR CG2 1 1 6 4534 1 1 47 THR H H 1.124 7.756 0.998 1.00 . A A . 49 THR H 1 1 6 4535 1 1 47 THR HA H 0.972 7.408 -1.941 1.00 . A A . 49 THR HA 1 1 6 4536 1 1 47 THR HB H 3.029 8.927 -2.127 1.00 . A A . 49 THR HB 1 1 6 4537 1 1 47 THR HG1 H 3.474 10.203 -0.464 1.00 . A A . 49 THR HG1 1 1 6 4538 1 1 47 THR HG21 H 0.445 10.260 -1.291 1.00 . A A . 49 THR HG21 1 1 6 4539 1 1 47 THR HG22 H 0.690 9.499 -2.863 1.00 . A A . 49 THR HG22 1 1 6 4540 1 1 47 THR HG23 H 1.662 10.894 -2.399 1.00 . A A . 49 THR HG23 1 1 6 4541 1 1 47 THR N N 0.728 7.851 0.106 1.00 . A A . 49 THR N 1 1 6 4542 1 1 47 THR O O 2.611 5.890 0.075 1.00 . A A . 49 THR O 1 1 6 4543 1 1 47 THR OG1 O 2.728 9.645 -0.231 1.00 . A A . 49 THR OG1 1 1 6 4544 1 1 48 LEU C C 6.111 6.345 -1.637 1.00 . A A . 50 LEU C 1 1 6 4545 1 1 48 LEU CA C 4.764 5.615 -1.568 1.00 . A A . 50 LEU CA 1 1 6 4546 1 1 48 LEU CB C 4.679 4.601 -2.710 1.00 . A A . 50 LEU CB 1 1 6 4547 1 1 48 LEU CD1 C 5.589 2.295 -2.420 1.00 . A A . 50 LEU CD1 1 1 6 4548 1 1 48 LEU CD2 C 6.589 3.827 -4.120 1.00 . A A . 50 LEU CD2 1 1 6 4549 1 1 48 LEU CG C 5.948 3.748 -2.732 1.00 . A A . 50 LEU CG 1 1 6 4550 1 1 48 LEU H H 3.684 7.240 -2.464 1.00 . A A . 50 LEU H 1 1 6 4551 1 1 48 LEU HA H 4.671 5.097 -0.622 1.00 . A A . 50 LEU HA 1 1 6 4552 1 1 48 LEU HB2 H 3.819 3.964 -2.561 1.00 . A A . 50 LEU HB2 1 1 6 4553 1 1 48 LEU HB3 H 4.580 5.123 -3.650 1.00 . A A . 50 LEU HB3 1 1 6 4554 1 1 48 LEU HD11 H 4.605 2.074 -2.809 1.00 . A A . 50 LEU HD11 1 1 6 4555 1 1 48 LEU HD12 H 5.596 2.145 -1.351 1.00 . A A . 50 LEU HD12 1 1 6 4556 1 1 48 LEU HD13 H 6.314 1.639 -2.879 1.00 . A A . 50 LEU HD13 1 1 6 4557 1 1 48 LEU HD21 H 7.257 2.990 -4.256 1.00 . A A . 50 LEU HD21 1 1 6 4558 1 1 48 LEU HD22 H 7.145 4.749 -4.207 1.00 . A A . 50 LEU HD22 1 1 6 4559 1 1 48 LEU HD23 H 5.818 3.799 -4.875 1.00 . A A . 50 LEU HD23 1 1 6 4560 1 1 48 LEU HG H 6.643 4.114 -1.990 1.00 . A A . 50 LEU HG 1 1 6 4561 1 1 48 LEU N N 3.664 6.613 -1.718 1.00 . A A . 50 LEU N 1 1 6 4562 1 1 48 LEU O O 6.323 7.196 -2.478 1.00 . A A . 50 LEU O 1 1 6 4563 1 1 49 SER C C 9.330 5.957 -1.661 1.00 . A A . 51 SER C 1 1 6 4564 1 1 49 SER CA C 8.342 6.712 -0.763 1.00 . A A . 51 SER CA 1 1 6 4565 1 1 49 SER CB C 8.893 6.757 0.662 1.00 . A A . 51 SER CB 1 1 6 4566 1 1 49 SER H H 6.827 5.351 -0.079 1.00 . A A . 51 SER H 1 1 6 4567 1 1 49 SER HA H 8.221 7.718 -1.131 1.00 . A A . 51 SER HA 1 1 6 4568 1 1 49 SER HB2 H 8.172 6.335 1.343 1.00 . A A . 51 SER HB2 1 1 6 4569 1 1 49 SER HB3 H 9.808 6.182 0.712 1.00 . A A . 51 SER HB3 1 1 6 4570 1 1 49 SER HG H 9.490 8.113 1.925 1.00 . A A . 51 SER HG 1 1 6 4571 1 1 49 SER N N 7.019 6.028 -0.754 1.00 . A A . 51 SER N 1 1 6 4572 1 1 49 SER O O 10.197 6.554 -2.268 1.00 . A A . 51 SER O 1 1 6 4573 1 1 49 SER OG O 9.145 8.107 1.028 1.00 . A A . 51 SER OG 1 1 6 4574 1 1 50 HIS C C 9.866 2.391 -2.479 1.00 . A A . 52 HIS C 1 1 6 4575 1 1 50 HIS CA C 10.157 3.887 -2.612 1.00 . A A . 52 HIS CA 1 1 6 4576 1 1 50 HIS CB C 11.603 4.160 -2.178 1.00 . A A . 52 HIS CB 1 1 6 4577 1 1 50 HIS CD2 C 11.670 4.004 0.444 1.00 . A A . 52 HIS CD2 1 1 6 4578 1 1 50 HIS CE1 C 12.484 2.003 0.621 1.00 . A A . 52 HIS CE1 1 1 6 4579 1 1 50 HIS CG C 11.856 3.536 -0.833 1.00 . A A . 52 HIS CG 1 1 6 4580 1 1 50 HIS H H 8.512 4.185 -1.268 1.00 . A A . 52 HIS H 1 1 6 4581 1 1 50 HIS HA H 10.031 4.186 -3.643 1.00 . A A . 52 HIS HA 1 1 6 4582 1 1 50 HIS HB2 H 12.281 3.735 -2.902 1.00 . A A . 52 HIS HB2 1 1 6 4583 1 1 50 HIS HB3 H 11.768 5.224 -2.115 1.00 . A A . 52 HIS HB3 1 1 6 4584 1 1 50 HIS HD1 H 12.624 1.652 -1.425 1.00 . A A . 52 HIS HD1 1 1 6 4585 1 1 50 HIS HD2 H 11.278 4.977 0.699 1.00 . A A . 52 HIS HD2 1 1 6 4586 1 1 50 HIS HE1 H 12.861 1.078 1.030 1.00 . A A . 52 HIS HE1 1 1 6 4587 1 1 50 HIS N N 9.215 4.657 -1.755 1.00 . A A . 52 HIS N 1 1 6 4588 1 1 50 HIS ND1 N 12.376 2.258 -0.696 1.00 . A A . 52 HIS ND1 1 1 6 4589 1 1 50 HIS NE2 N 12.066 3.035 1.361 1.00 . A A . 52 HIS NE2 1 1 6 4590 1 1 50 HIS O O 10.075 1.790 -1.442 1.00 . A A . 52 HIS O 1 1 6 4591 1 1 51 PHE C C 10.242 -0.393 -2.785 1.00 . A A . 53 PHE C 1 1 6 4592 1 1 51 PHE CA C 9.090 0.334 -3.483 1.00 . A A . 53 PHE CA 1 1 6 4593 1 1 51 PHE CB C 8.962 -0.196 -4.912 1.00 . A A . 53 PHE CB 1 1 6 4594 1 1 51 PHE CD1 C 6.748 0.945 -5.266 1.00 . A A . 53 PHE CD1 1 1 6 4595 1 1 51 PHE CD2 C 8.499 1.271 -6.909 1.00 . A A . 53 PHE CD2 1 1 6 4596 1 1 51 PHE CE1 C 5.895 1.769 -6.011 1.00 . A A . 53 PHE CE1 1 1 6 4597 1 1 51 PHE CE2 C 7.647 2.094 -7.654 1.00 . A A . 53 PHE CE2 1 1 6 4598 1 1 51 PHE CG C 8.048 0.697 -5.714 1.00 . A A . 53 PHE CG 1 1 6 4599 1 1 51 PHE CZ C 6.345 2.343 -7.206 1.00 . A A . 53 PHE CZ 1 1 6 4600 1 1 51 PHE H H 9.225 2.295 -4.344 1.00 . A A . 53 PHE H 1 1 6 4601 1 1 51 PHE HA H 8.169 0.163 -2.946 1.00 . A A . 53 PHE HA 1 1 6 4602 1 1 51 PHE HB2 H 9.938 -0.220 -5.374 1.00 . A A . 53 PHE HB2 1 1 6 4603 1 1 51 PHE HB3 H 8.555 -1.191 -4.886 1.00 . A A . 53 PHE HB3 1 1 6 4604 1 1 51 PHE HD1 H 6.403 0.504 -4.346 1.00 . A A . 53 PHE HD1 1 1 6 4605 1 1 51 PHE HD2 H 9.504 1.080 -7.254 1.00 . A A . 53 PHE HD2 1 1 6 4606 1 1 51 PHE HE1 H 4.891 1.961 -5.664 1.00 . A A . 53 PHE HE1 1 1 6 4607 1 1 51 PHE HE2 H 7.994 2.537 -8.576 1.00 . A A . 53 PHE HE2 1 1 6 4608 1 1 51 PHE HZ H 5.687 2.978 -7.781 1.00 . A A . 53 PHE HZ 1 1 6 4609 1 1 51 PHE N N 9.387 1.789 -3.526 1.00 . A A . 53 PHE N 1 1 6 4610 1 1 51 PHE O O 11.346 -0.448 -3.290 1.00 . A A . 53 PHE O 1 1 6 4611 1 1 52 GLY C C 10.831 -1.640 0.589 1.00 . A A . 54 GLY C 1 1 6 4612 1 1 52 GLY CA C 11.095 -1.668 -0.917 1.00 . A A . 54 GLY CA 1 1 6 4613 1 1 52 GLY H H 9.107 -0.897 -1.236 1.00 . A A . 54 GLY H 1 1 6 4614 1 1 52 GLY HA2 H 11.135 -2.692 -1.258 1.00 . A A . 54 GLY HA2 1 1 6 4615 1 1 52 GLY HA3 H 12.037 -1.182 -1.121 1.00 . A A . 54 GLY HA3 1 1 6 4616 1 1 52 GLY N N 10.002 -0.950 -1.630 1.00 . A A . 54 GLY N 1 1 6 4617 1 1 52 GLY O O 10.302 -0.683 1.119 1.00 . A A . 54 GLY O 1 1 6 4618 1 1 53 LYS C C 11.461 -1.402 3.369 1.00 . A A . 55 LYS C 1 1 6 4619 1 1 53 LYS CA C 10.967 -2.711 2.755 1.00 . A A . 55 LYS CA 1 1 6 4620 1 1 53 LYS CB C 11.737 -3.881 3.372 1.00 . A A . 55 LYS CB 1 1 6 4621 1 1 53 LYS CD C 12.484 -4.923 5.519 1.00 . A A . 55 LYS CD 1 1 6 4622 1 1 53 LYS CE C 13.971 -4.643 5.298 1.00 . A A . 55 LYS CE 1 1 6 4623 1 1 53 LYS CG C 11.653 -3.798 4.898 1.00 . A A . 55 LYS CG 1 1 6 4624 1 1 53 LYS H H 11.623 -3.445 0.838 1.00 . A A . 55 LYS H 1 1 6 4625 1 1 53 LYS HA H 9.912 -2.829 2.953 1.00 . A A . 55 LYS HA 1 1 6 4626 1 1 53 LYS HB2 H 11.307 -4.814 3.036 1.00 . A A . 55 LYS HB2 1 1 6 4627 1 1 53 LYS HB3 H 12.772 -3.831 3.068 1.00 . A A . 55 LYS HB3 1 1 6 4628 1 1 53 LYS HD2 H 12.281 -4.977 6.578 1.00 . A A . 55 LYS HD2 1 1 6 4629 1 1 53 LYS HD3 H 12.224 -5.862 5.053 1.00 . A A . 55 LYS HD3 1 1 6 4630 1 1 53 LYS HE2 H 14.086 -3.737 4.721 1.00 . A A . 55 LYS HE2 1 1 6 4631 1 1 53 LYS HE3 H 14.462 -4.525 6.253 1.00 . A A . 55 LYS HE3 1 1 6 4632 1 1 53 LYS HG2 H 12.034 -2.843 5.228 1.00 . A A . 55 LYS HG2 1 1 6 4633 1 1 53 LYS HG3 H 10.623 -3.902 5.208 1.00 . A A . 55 LYS HG3 1 1 6 4634 1 1 53 LYS HZ1 H 14.266 -5.769 3.571 1.00 . A A . 55 LYS HZ1 1 1 6 4635 1 1 53 LYS HZ2 H 14.304 -6.678 5.006 1.00 . A A . 55 LYS HZ2 1 1 6 4636 1 1 53 LYS HZ3 H 15.624 -5.692 4.585 1.00 . A A . 55 LYS HZ3 1 1 6 4637 1 1 53 LYS N N 11.197 -2.682 1.284 1.00 . A A . 55 LYS N 1 1 6 4638 1 1 53 LYS NZ N 14.587 -5.781 4.559 1.00 . A A . 55 LYS NZ 1 1 6 4639 1 1 53 LYS O O 12.362 -0.766 2.860 1.00 . A A . 55 LYS O 1 1 6 4640 1 1 54 CYS C C 11.603 0.018 6.590 1.00 . A A . 56 CYS C 1 1 6 4641 1 1 54 CYS CA C 11.314 0.275 5.107 1.00 . A A . 56 CYS CA 1 1 6 4642 1 1 54 CYS CB C 10.208 1.323 4.969 1.00 . A A . 56 CYS CB 1 1 6 4643 1 1 54 CYS H H 10.151 -1.517 4.855 1.00 . A A . 56 CYS H 1 1 6 4644 1 1 54 CYS HA H 12.210 0.633 4.624 1.00 . A A . 56 CYS HA 1 1 6 4645 1 1 54 CYS HB2 H 9.367 0.890 4.449 1.00 . A A . 56 CYS HB2 1 1 6 4646 1 1 54 CYS HB3 H 9.896 1.653 5.948 1.00 . A A . 56 CYS HB3 1 1 6 4647 1 1 54 CYS N N 10.877 -0.992 4.461 1.00 . A A . 56 CYS N 1 1 6 4648 1 1 54 CYS O O 11.060 0.735 7.414 1.00 . A A . 56 CYS O 1 1 6 4649 1 1 54 CYS OXT O 12.366 -0.891 6.874 1.00 . A A . 56 CYS OXT 1 1 6 4650 1 1 54 CYS SG S 10.838 2.736 4.028 1.00 . A A . 56 CYS SG 1 1 7 4651 1 1 1 ALA C C 4.778 9.835 -10.321 1.00 . A A . 3 ALA C 1 1 7 4652 1 1 1 ALA CA C 4.472 11.335 -10.325 1.00 . A A . 3 ALA CA 1 1 7 4653 1 1 1 ALA CB C 3.164 11.589 -11.078 1.00 . A A . 3 ALA CB 1 1 7 4654 1 1 1 ALA H1 H 5.752 12.968 -10.509 1.00 . A A . 3 ALA H1 1 1 7 4655 1 1 1 ALA H2 H 5.323 12.254 -11.990 1.00 . A A . 3 ALA H2 1 1 7 4656 1 1 1 ALA H3 H 6.448 11.491 -10.969 1.00 . A A . 3 ALA H3 1 1 7 4657 1 1 1 ALA HA H 4.377 11.685 -9.309 1.00 . A A . 3 ALA HA 1 1 7 4658 1 1 1 ALA HB1 H 3.275 12.459 -11.709 1.00 . A A . 3 ALA HB1 1 1 7 4659 1 1 1 ALA HB2 H 2.369 11.758 -10.367 1.00 . A A . 3 ALA HB2 1 1 7 4660 1 1 1 ALA HB3 H 2.926 10.730 -11.687 1.00 . A A . 3 ALA HB3 1 1 7 4661 1 1 1 ALA N N 5.582 12.067 -10.999 1.00 . A A . 3 ALA N 1 1 7 4662 1 1 1 ALA O O 5.287 9.292 -11.280 1.00 . A A . 3 ALA O 1 1 7 4663 1 1 2 VAL C C 3.776 6.953 -10.093 1.00 . A A . 4 VAL C 1 1 7 4664 1 1 2 VAL CA C 4.742 7.700 -9.173 1.00 . A A . 4 VAL CA 1 1 7 4665 1 1 2 VAL CB C 4.556 7.216 -7.733 1.00 . A A . 4 VAL CB 1 1 7 4666 1 1 2 VAL CG1 C 5.552 7.934 -6.823 1.00 . A A . 4 VAL CG1 1 1 7 4667 1 1 2 VAL CG2 C 3.130 7.529 -7.272 1.00 . A A . 4 VAL CG2 1 1 7 4668 1 1 2 VAL H H 4.061 9.623 -8.481 1.00 . A A . 4 VAL H 1 1 7 4669 1 1 2 VAL HA H 5.758 7.508 -9.487 1.00 . A A . 4 VAL HA 1 1 7 4670 1 1 2 VAL HB H 4.727 6.151 -7.687 1.00 . A A . 4 VAL HB 1 1 7 4671 1 1 2 VAL HG11 H 6.286 7.226 -6.464 1.00 . A A . 4 VAL HG11 1 1 7 4672 1 1 2 VAL HG12 H 5.027 8.365 -5.983 1.00 . A A . 4 VAL HG12 1 1 7 4673 1 1 2 VAL HG13 H 6.048 8.716 -7.378 1.00 . A A . 4 VAL HG13 1 1 7 4674 1 1 2 VAL HG21 H 2.803 6.769 -6.577 1.00 . A A . 4 VAL HG21 1 1 7 4675 1 1 2 VAL HG22 H 2.470 7.543 -8.127 1.00 . A A . 4 VAL HG22 1 1 7 4676 1 1 2 VAL HG23 H 3.112 8.493 -6.786 1.00 . A A . 4 VAL HG23 1 1 7 4677 1 1 2 VAL N N 4.471 9.163 -9.244 1.00 . A A . 4 VAL N 1 1 7 4678 1 1 2 VAL O O 2.757 7.476 -10.496 1.00 . A A . 4 VAL O 1 1 7 4679 1 1 3 SER C C 2.255 4.089 -10.473 1.00 . A A . 5 SER C 1 1 7 4680 1 1 3 SER CA C 3.192 4.951 -11.322 1.00 . A A . 5 SER CA 1 1 7 4681 1 1 3 SER CB C 4.031 4.052 -12.231 1.00 . A A . 5 SER CB 1 1 7 4682 1 1 3 SER H H 4.917 5.329 -10.093 1.00 . A A . 5 SER H 1 1 7 4683 1 1 3 SER HA H 2.608 5.628 -11.926 1.00 . A A . 5 SER HA 1 1 7 4684 1 1 3 SER HB2 H 3.843 3.018 -11.993 1.00 . A A . 5 SER HB2 1 1 7 4685 1 1 3 SER HB3 H 3.765 4.235 -13.264 1.00 . A A . 5 SER HB3 1 1 7 4686 1 1 3 SER HG H 5.871 3.500 -11.915 1.00 . A A . 5 SER HG 1 1 7 4687 1 1 3 SER N N 4.091 5.731 -10.428 1.00 . A A . 5 SER N 1 1 7 4688 1 1 3 SER O O 2.487 2.912 -10.277 1.00 . A A . 5 SER O 1 1 7 4689 1 1 3 SER OG O 5.410 4.335 -12.027 1.00 . A A . 5 SER OG 1 1 7 4690 1 1 4 VAL C C -1.164 4.429 -9.292 1.00 . A A . 6 VAL C 1 1 7 4691 1 1 4 VAL CA C 0.255 3.879 -9.123 1.00 . A A . 6 VAL CA 1 1 7 4692 1 1 4 VAL CB C 0.672 3.988 -7.656 1.00 . A A . 6 VAL CB 1 1 7 4693 1 1 4 VAL CG1 C 0.373 5.398 -7.143 1.00 . A A . 6 VAL CG1 1 1 7 4694 1 1 4 VAL CG2 C -0.107 2.966 -6.826 1.00 . A A . 6 VAL CG2 1 1 7 4695 1 1 4 VAL H H 1.035 5.617 -10.131 1.00 . A A . 6 VAL H 1 1 7 4696 1 1 4 VAL HA H 0.278 2.843 -9.427 1.00 . A A . 6 VAL HA 1 1 7 4697 1 1 4 VAL HB H 1.732 3.792 -7.569 1.00 . A A . 6 VAL HB 1 1 7 4698 1 1 4 VAL HG11 H -0.614 5.419 -6.705 1.00 . A A . 6 VAL HG11 1 1 7 4699 1 1 4 VAL HG12 H 0.417 6.098 -7.964 1.00 . A A . 6 VAL HG12 1 1 7 4700 1 1 4 VAL HG13 H 1.104 5.672 -6.396 1.00 . A A . 6 VAL HG13 1 1 7 4701 1 1 4 VAL HG21 H -0.138 2.024 -7.352 1.00 . A A . 6 VAL HG21 1 1 7 4702 1 1 4 VAL HG22 H -1.113 3.323 -6.667 1.00 . A A . 6 VAL HG22 1 1 7 4703 1 1 4 VAL HG23 H 0.382 2.829 -5.872 1.00 . A A . 6 VAL HG23 1 1 7 4704 1 1 4 VAL N N 1.202 4.666 -9.963 1.00 . A A . 6 VAL N 1 1 7 4705 1 1 4 VAL O O -1.414 5.602 -9.094 1.00 . A A . 6 VAL O 1 1 7 4706 1 1 5 ASP C C -4.463 2.938 -9.457 1.00 . A A . 7 ASP C 1 1 7 4707 1 1 5 ASP CA C -3.498 4.061 -9.842 1.00 . A A . 7 ASP CA 1 1 7 4708 1 1 5 ASP CB C -3.718 4.448 -11.307 1.00 . A A . 7 ASP CB 1 1 7 4709 1 1 5 ASP CG C -5.080 5.129 -11.458 1.00 . A A . 7 ASP CG 1 1 7 4710 1 1 5 ASP H H -1.872 2.649 -9.813 1.00 . A A . 7 ASP H 1 1 7 4711 1 1 5 ASP HA H -3.675 4.920 -9.211 1.00 . A A . 7 ASP HA 1 1 7 4712 1 1 5 ASP HB2 H -2.939 5.129 -11.619 1.00 . A A . 7 ASP HB2 1 1 7 4713 1 1 5 ASP HB3 H -3.690 3.562 -11.922 1.00 . A A . 7 ASP HB3 1 1 7 4714 1 1 5 ASP N N -2.095 3.590 -9.659 1.00 . A A . 7 ASP N 1 1 7 4715 1 1 5 ASP O O -4.469 1.880 -10.055 1.00 . A A . 7 ASP O 1 1 7 4716 1 1 5 ASP OD1 O -6.037 4.626 -10.893 1.00 . A A . 7 ASP OD1 1 1 7 4717 1 1 5 ASP OD2 O -5.142 6.140 -12.137 1.00 . A A . 7 ASP OD2 1 1 7 4718 1 1 6 CYS C C -7.596 2.727 -7.738 1.00 . A A . 8 CYS C 1 1 7 4719 1 1 6 CYS CA C -6.234 2.094 -8.032 1.00 . A A . 8 CYS CA 1 1 7 4720 1 1 6 CYS CB C -5.718 1.395 -6.764 1.00 . A A . 8 CYS CB 1 1 7 4721 1 1 6 CYS H H -5.253 4.013 -7.985 1.00 . A A . 8 CYS H 1 1 7 4722 1 1 6 CYS HA H -6.340 1.367 -8.824 1.00 . A A . 8 CYS HA 1 1 7 4723 1 1 6 CYS HB2 H -6.149 1.867 -5.894 1.00 . A A . 8 CYS HB2 1 1 7 4724 1 1 6 CYS HB3 H -6.011 0.355 -6.787 1.00 . A A . 8 CYS HB3 1 1 7 4725 1 1 6 CYS N N -5.276 3.155 -8.458 1.00 . A A . 8 CYS N 1 1 7 4726 1 1 6 CYS O O -8.119 2.618 -6.644 1.00 . A A . 8 CYS O 1 1 7 4727 1 1 6 CYS SG S -3.910 1.508 -6.673 1.00 . A A . 8 CYS SG 1 1 7 4728 1 1 7 SER C C -10.636 2.981 -8.551 1.00 . A A . 9 SER C 1 1 7 4729 1 1 7 SER CA C -9.512 4.027 -8.498 1.00 . A A . 9 SER CA 1 1 7 4730 1 1 7 SER CB C -9.744 5.068 -9.593 1.00 . A A . 9 SER CB 1 1 7 4731 1 1 7 SER H H -7.740 3.447 -9.582 1.00 . A A . 9 SER H 1 1 7 4732 1 1 7 SER HA H -9.524 4.515 -7.535 1.00 . A A . 9 SER HA 1 1 7 4733 1 1 7 SER HB2 H -8.875 5.127 -10.226 1.00 . A A . 9 SER HB2 1 1 7 4734 1 1 7 SER HB3 H -10.600 4.779 -10.188 1.00 . A A . 9 SER HB3 1 1 7 4735 1 1 7 SER HG H -10.647 6.229 -8.321 1.00 . A A . 9 SER HG 1 1 7 4736 1 1 7 SER N N -8.179 3.380 -8.709 1.00 . A A . 9 SER N 1 1 7 4737 1 1 7 SER O O -11.730 3.259 -8.998 1.00 . A A . 9 SER O 1 1 7 4738 1 1 7 SER OG O -9.972 6.337 -8.995 1.00 . A A . 9 SER OG 1 1 7 4739 1 1 8 GLU C C -10.853 -0.518 -7.445 1.00 . A A . 10 GLU C 1 1 7 4740 1 1 8 GLU CA C -11.425 0.735 -8.105 1.00 . A A . 10 GLU CA 1 1 7 4741 1 1 8 GLU CB C -11.827 0.419 -9.547 1.00 . A A . 10 GLU CB 1 1 7 4742 1 1 8 GLU CD C -11.029 -1.580 -10.816 1.00 . A A . 10 GLU CD 1 1 7 4743 1 1 8 GLU CG C -10.638 -0.200 -10.285 1.00 . A A . 10 GLU CG 1 1 7 4744 1 1 8 GLU H H -9.503 1.579 -7.732 1.00 . A A . 10 GLU H 1 1 7 4745 1 1 8 GLU HA H -12.289 1.074 -7.551 1.00 . A A . 10 GLU HA 1 1 7 4746 1 1 8 GLU HB2 H -12.652 -0.277 -9.545 1.00 . A A . 10 GLU HB2 1 1 7 4747 1 1 8 GLU HB3 H -12.125 1.330 -10.045 1.00 . A A . 10 GLU HB3 1 1 7 4748 1 1 8 GLU HG2 H -10.358 0.438 -11.110 1.00 . A A . 10 GLU HG2 1 1 7 4749 1 1 8 GLU HG3 H -9.805 -0.300 -9.606 1.00 . A A . 10 GLU HG3 1 1 7 4750 1 1 8 GLU N N -10.380 1.786 -8.091 1.00 . A A . 10 GLU N 1 1 7 4751 1 1 8 GLU O O -11.173 -1.629 -7.817 1.00 . A A . 10 GLU O 1 1 7 4752 1 1 8 GLU OE1 O -11.349 -2.435 -10.007 1.00 . A A . 10 GLU OE1 1 1 7 4753 1 1 8 GLU OE2 O -11.001 -1.759 -12.023 1.00 . A A . 10 GLU OE2 1 1 7 4754 1 1 9 TYR C C -9.676 -1.521 -4.285 1.00 . A A . 11 TYR C 1 1 7 4755 1 1 9 TYR CA C -9.397 -1.540 -5.797 1.00 . A A . 11 TYR CA 1 1 7 4756 1 1 9 TYR CB C -7.884 -1.534 -6.026 1.00 . A A . 11 TYR CB 1 1 7 4757 1 1 9 TYR CD1 C -7.779 -3.009 -8.065 1.00 . A A . 11 TYR CD1 1 1 7 4758 1 1 9 TYR CD2 C -6.786 -3.803 -6.000 1.00 . A A . 11 TYR CD2 1 1 7 4759 1 1 9 TYR CE1 C -7.398 -4.194 -8.705 1.00 . A A . 11 TYR CE1 1 1 7 4760 1 1 9 TYR CE2 C -6.405 -4.990 -6.640 1.00 . A A . 11 TYR CE2 1 1 7 4761 1 1 9 TYR CG C -7.473 -2.813 -6.714 1.00 . A A . 11 TYR CG 1 1 7 4762 1 1 9 TYR CZ C -6.711 -5.185 -7.992 1.00 . A A . 11 TYR CZ 1 1 7 4763 1 1 9 TYR H H -9.735 0.562 -6.188 1.00 . A A . 11 TYR H 1 1 7 4764 1 1 9 TYR HA H -9.816 -2.437 -6.225 1.00 . A A . 11 TYR HA 1 1 7 4765 1 1 9 TYR HB2 H -7.617 -0.691 -6.645 1.00 . A A . 11 TYR HB2 1 1 7 4766 1 1 9 TYR HB3 H -7.376 -1.458 -5.076 1.00 . A A . 11 TYR HB3 1 1 7 4767 1 1 9 TYR HD1 H -8.309 -2.245 -8.615 1.00 . A A . 11 TYR HD1 1 1 7 4768 1 1 9 TYR HD2 H -6.550 -3.651 -4.957 1.00 . A A . 11 TYR HD2 1 1 7 4769 1 1 9 TYR HE1 H -7.635 -4.344 -9.748 1.00 . A A . 11 TYR HE1 1 1 7 4770 1 1 9 TYR HE2 H -5.875 -5.753 -6.091 1.00 . A A . 11 TYR HE2 1 1 7 4771 1 1 9 TYR HH H -7.013 -6.571 -9.269 1.00 . A A . 11 TYR HH 1 1 7 4772 1 1 9 TYR N N -9.996 -0.348 -6.468 1.00 . A A . 11 TYR N 1 1 7 4773 1 1 9 TYR O O -8.755 -1.538 -3.492 1.00 . A A . 11 TYR O 1 1 7 4774 1 1 9 TYR OH O -6.337 -6.353 -8.624 1.00 . A A . 11 TYR OH 1 1 7 4775 1 1 10 PRO C C -11.206 -2.928 -1.919 1.00 . A A . 12 PRO C 1 1 7 4776 1 1 10 PRO CA C -11.358 -1.521 -2.511 1.00 . A A . 12 PRO CA 1 1 7 4777 1 1 10 PRO CB C -12.833 -1.118 -2.570 1.00 . A A . 12 PRO CB 1 1 7 4778 1 1 10 PRO CD C -12.057 -1.484 -4.887 1.00 . A A . 12 PRO CD 1 1 7 4779 1 1 10 PRO CG C -13.314 -1.457 -3.998 1.00 . A A . 12 PRO CG 1 1 7 4780 1 1 10 PRO HA H -10.798 -0.799 -1.938 1.00 . A A . 12 PRO HA 1 1 7 4781 1 1 10 PRO HB2 H -13.399 -1.681 -1.839 1.00 . A A . 12 PRO HB2 1 1 7 4782 1 1 10 PRO HB3 H -12.939 -0.061 -2.391 1.00 . A A . 12 PRO HB3 1 1 7 4783 1 1 10 PRO HD2 H -12.050 -2.365 -5.512 1.00 . A A . 12 PRO HD2 1 1 7 4784 1 1 10 PRO HD3 H -12.008 -0.589 -5.484 1.00 . A A . 12 PRO HD3 1 1 7 4785 1 1 10 PRO HG2 H -13.797 -2.426 -4.005 1.00 . A A . 12 PRO HG2 1 1 7 4786 1 1 10 PRO HG3 H -13.995 -0.699 -4.351 1.00 . A A . 12 PRO HG3 1 1 7 4787 1 1 10 PRO N N -10.937 -1.511 -3.926 1.00 . A A . 12 PRO N 1 1 7 4788 1 1 10 PRO O O -12.156 -3.678 -1.829 1.00 . A A . 12 PRO O 1 1 7 4789 1 1 11 LYS C C -8.509 -4.630 -0.118 1.00 . A A . 13 LYS C 1 1 7 4790 1 1 11 LYS CA C -9.803 -4.642 -0.931 1.00 . A A . 13 LYS CA 1 1 7 4791 1 1 11 LYS CB C -9.688 -5.674 -2.055 1.00 . A A . 13 LYS CB 1 1 7 4792 1 1 11 LYS CD C -9.939 -4.892 -4.414 1.00 . A A . 13 LYS CD 1 1 7 4793 1 1 11 LYS CE C -10.360 -6.273 -4.921 1.00 . A A . 13 LYS CE 1 1 7 4794 1 1 11 LYS CG C -8.961 -5.053 -3.248 1.00 . A A . 13 LYS CG 1 1 7 4795 1 1 11 LYS H H -9.265 -2.666 -1.597 1.00 . A A . 13 LYS H 1 1 7 4796 1 1 11 LYS HA H -10.632 -4.895 -0.288 1.00 . A A . 13 LYS HA 1 1 7 4797 1 1 11 LYS HB2 H -9.132 -6.530 -1.701 1.00 . A A . 13 LYS HB2 1 1 7 4798 1 1 11 LYS HB3 H -10.676 -5.987 -2.359 1.00 . A A . 13 LYS HB3 1 1 7 4799 1 1 11 LYS HD2 H -10.810 -4.348 -4.081 1.00 . A A . 13 LYS HD2 1 1 7 4800 1 1 11 LYS HD3 H -9.459 -4.348 -5.214 1.00 . A A . 13 LYS HD3 1 1 7 4801 1 1 11 LYS HE2 H -10.304 -6.986 -4.113 1.00 . A A . 13 LYS HE2 1 1 7 4802 1 1 11 LYS HE3 H -11.374 -6.227 -5.290 1.00 . A A . 13 LYS HE3 1 1 7 4803 1 1 11 LYS HG2 H -8.572 -4.084 -2.968 1.00 . A A . 13 LYS HG2 1 1 7 4804 1 1 11 LYS HG3 H -8.147 -5.695 -3.549 1.00 . A A . 13 LYS HG3 1 1 7 4805 1 1 11 LYS HZ1 H -9.902 -6.507 -6.939 1.00 . A A . 13 LYS HZ1 1 1 7 4806 1 1 11 LYS HZ2 H -9.253 -7.715 -5.936 1.00 . A A . 13 LYS HZ2 1 1 7 4807 1 1 11 LYS HZ3 H -8.560 -6.163 -5.961 1.00 . A A . 13 LYS HZ3 1 1 7 4808 1 1 11 LYS N N -10.018 -3.287 -1.517 1.00 . A A . 13 LYS N 1 1 7 4809 1 1 11 LYS NZ N -9.450 -6.696 -6.022 1.00 . A A . 13 LYS NZ 1 1 7 4810 1 1 11 LYS O O -7.434 -4.836 -0.645 1.00 . A A . 13 LYS O 1 1 7 4811 1 1 12 CYS C C -7.115 -5.714 2.607 1.00 . A A . 14 CYS C 1 1 7 4812 1 1 12 CYS CA C -7.365 -4.338 1.989 1.00 . A A . 14 CYS CA 1 1 7 4813 1 1 12 CYS CB C -7.526 -3.299 3.102 1.00 . A A . 14 CYS CB 1 1 7 4814 1 1 12 CYS H H -9.473 -4.202 1.563 1.00 . A A . 14 CYS H 1 1 7 4815 1 1 12 CYS HA H -6.523 -4.068 1.368 1.00 . A A . 14 CYS HA 1 1 7 4816 1 1 12 CYS HB2 H -8.174 -3.696 3.870 1.00 . A A . 14 CYS HB2 1 1 7 4817 1 1 12 CYS HB3 H -6.558 -3.079 3.529 1.00 . A A . 14 CYS HB3 1 1 7 4818 1 1 12 CYS N N -8.600 -4.378 1.157 1.00 . A A . 14 CYS N 1 1 7 4819 1 1 12 CYS O O -6.567 -5.831 3.685 1.00 . A A . 14 CYS O 1 1 7 4820 1 1 12 CYS SG S -8.250 -1.776 2.434 1.00 . A A . 14 CYS SG 1 1 7 4821 1 1 13 ALA C C -6.607 -8.986 1.411 1.00 . A A . 15 ALA C 1 1 7 4822 1 1 13 ALA CA C -7.289 -8.127 2.476 1.00 . A A . 15 ALA CA 1 1 7 4823 1 1 13 ALA CB C -8.634 -8.748 2.854 1.00 . A A . 15 ALA CB 1 1 7 4824 1 1 13 ALA H H -7.946 -6.641 1.062 1.00 . A A . 15 ALA H 1 1 7 4825 1 1 13 ALA HA H -6.658 -8.069 3.351 1.00 . A A . 15 ALA HA 1 1 7 4826 1 1 13 ALA HB1 H -9.222 -8.905 1.962 1.00 . A A . 15 ALA HB1 1 1 7 4827 1 1 13 ALA HB2 H -9.162 -8.083 3.522 1.00 . A A . 15 ALA HB2 1 1 7 4828 1 1 13 ALA HB3 H -8.467 -9.694 3.348 1.00 . A A . 15 ALA HB3 1 1 7 4829 1 1 13 ALA N N -7.508 -6.757 1.931 1.00 . A A . 15 ALA N 1 1 7 4830 1 1 13 ALA O O -7.147 -9.976 0.959 1.00 . A A . 15 ALA O 1 1 7 4831 1 1 14 CYS C C -3.576 -10.197 0.591 1.00 . A A . 16 CYS C 1 1 7 4832 1 1 14 CYS CA C -4.716 -9.403 -0.042 1.00 . A A . 16 CYS CA 1 1 7 4833 1 1 14 CYS CB C -4.141 -8.465 -1.101 1.00 . A A . 16 CYS CB 1 1 7 4834 1 1 14 CYS H H -5.010 -7.806 1.372 1.00 . A A . 16 CYS H 1 1 7 4835 1 1 14 CYS HA H -5.411 -10.086 -0.510 1.00 . A A . 16 CYS HA 1 1 7 4836 1 1 14 CYS HB2 H -3.206 -8.055 -0.747 1.00 . A A . 16 CYS HB2 1 1 7 4837 1 1 14 CYS HB3 H -3.971 -9.018 -2.012 1.00 . A A . 16 CYS HB3 1 1 7 4838 1 1 14 CYS N N -5.427 -8.611 1.000 1.00 . A A . 16 CYS N 1 1 7 4839 1 1 14 CYS O O -3.000 -9.800 1.586 1.00 . A A . 16 CYS O 1 1 7 4840 1 1 14 CYS SG S -5.309 -7.118 -1.413 1.00 . A A . 16 CYS SG 1 1 7 4841 1 1 15 THR C C -1.652 -13.119 -0.517 1.00 . A A . 17 THR C 1 1 7 4842 1 1 15 THR CA C -2.136 -12.146 0.562 1.00 . A A . 17 THR CA 1 1 7 4843 1 1 15 THR CB C -2.639 -12.932 1.776 1.00 . A A . 17 THR CB 1 1 7 4844 1 1 15 THR CG2 C -3.939 -13.652 1.415 1.00 . A A . 17 THR CG2 1 1 7 4845 1 1 15 THR H H -3.721 -11.605 -0.794 1.00 . A A . 17 THR H 1 1 7 4846 1 1 15 THR HA H -1.319 -11.504 0.860 1.00 . A A . 17 THR HA 1 1 7 4847 1 1 15 THR HB H -2.824 -12.251 2.592 1.00 . A A . 17 THR HB 1 1 7 4848 1 1 15 THR HG1 H -1.464 -13.747 3.094 1.00 . A A . 17 THR HG1 1 1 7 4849 1 1 15 THR HG21 H -4.519 -13.035 0.747 1.00 . A A . 17 THR HG21 1 1 7 4850 1 1 15 THR HG22 H -4.505 -13.842 2.315 1.00 . A A . 17 THR HG22 1 1 7 4851 1 1 15 THR HG23 H -3.707 -14.590 0.930 1.00 . A A . 17 THR HG23 1 1 7 4852 1 1 15 THR N N -3.244 -11.315 0.013 1.00 . A A . 17 THR N 1 1 7 4853 1 1 15 THR O O -1.840 -14.314 -0.412 1.00 . A A . 17 THR O 1 1 7 4854 1 1 15 THR OG1 O -1.657 -13.883 2.164 1.00 . A A . 17 THR OG1 1 1 7 4855 1 1 16 MET C C 0.976 -13.513 -2.681 1.00 . A A . 18 MET C 1 1 7 4856 1 1 16 MET CA C -0.553 -13.530 -2.634 1.00 . A A . 18 MET CA 1 1 7 4857 1 1 16 MET CB C -1.108 -13.062 -3.981 1.00 . A A . 18 MET CB 1 1 7 4858 1 1 16 MET CE C -3.291 -11.345 -5.838 1.00 . A A . 18 MET CE 1 1 7 4859 1 1 16 MET CG C -2.629 -13.223 -3.993 1.00 . A A . 18 MET CG 1 1 7 4860 1 1 16 MET H H -0.895 -11.655 -1.629 1.00 . A A . 18 MET H 1 1 7 4861 1 1 16 MET HA H -0.894 -14.536 -2.436 1.00 . A A . 18 MET HA 1 1 7 4862 1 1 16 MET HB2 H -0.855 -12.024 -4.134 1.00 . A A . 18 MET HB2 1 1 7 4863 1 1 16 MET HB3 H -0.679 -13.659 -4.773 1.00 . A A . 18 MET HB3 1 1 7 4864 1 1 16 MET HE1 H -4.321 -11.018 -5.798 1.00 . A A . 18 MET HE1 1 1 7 4865 1 1 16 MET HE2 H -2.854 -11.040 -6.775 1.00 . A A . 18 MET HE2 1 1 7 4866 1 1 16 MET HE3 H -2.734 -10.903 -5.023 1.00 . A A . 18 MET HE3 1 1 7 4867 1 1 16 MET HG2 H -2.895 -14.175 -3.559 1.00 . A A . 18 MET HG2 1 1 7 4868 1 1 16 MET HG3 H -3.079 -12.427 -3.417 1.00 . A A . 18 MET HG3 1 1 7 4869 1 1 16 MET N N -1.036 -12.622 -1.556 1.00 . A A . 18 MET N 1 1 7 4870 1 1 16 MET O O 1.636 -14.301 -2.031 1.00 . A A . 18 MET O 1 1 7 4871 1 1 16 MET SD S -3.229 -13.149 -5.699 1.00 . A A . 18 MET SD 1 1 7 4872 1 1 17 GLU C C 3.582 -11.688 -2.416 1.00 . A A . 19 GLU C 1 1 7 4873 1 1 17 GLU CA C 3.030 -12.561 -3.545 1.00 . A A . 19 GLU CA 1 1 7 4874 1 1 17 GLU CB C 3.427 -11.958 -4.894 1.00 . A A . 19 GLU CB 1 1 7 4875 1 1 17 GLU CD C 5.471 -13.391 -4.991 1.00 . A A . 19 GLU CD 1 1 7 4876 1 1 17 GLU CG C 4.952 -11.953 -5.023 1.00 . A A . 19 GLU CG 1 1 7 4877 1 1 17 GLU H H 0.993 -12.003 -3.967 1.00 . A A . 19 GLU H 1 1 7 4878 1 1 17 GLU HA H 3.439 -13.558 -3.463 1.00 . A A . 19 GLU HA 1 1 7 4879 1 1 17 GLU HB2 H 2.999 -12.547 -5.692 1.00 . A A . 19 GLU HB2 1 1 7 4880 1 1 17 GLU HB3 H 3.059 -10.945 -4.957 1.00 . A A . 19 GLU HB3 1 1 7 4881 1 1 17 GLU HG2 H 5.233 -11.487 -5.956 1.00 . A A . 19 GLU HG2 1 1 7 4882 1 1 17 GLU HG3 H 5.380 -11.399 -4.201 1.00 . A A . 19 GLU HG3 1 1 7 4883 1 1 17 GLU N N 1.544 -12.625 -3.450 1.00 . A A . 19 GLU N 1 1 7 4884 1 1 17 GLU O O 2.883 -10.866 -1.856 1.00 . A A . 19 GLU O 1 1 7 4885 1 1 17 GLU OE1 O 4.989 -14.191 -5.775 1.00 . A A . 19 GLU OE1 1 1 7 4886 1 1 17 GLU OE2 O 6.341 -13.669 -4.182 1.00 . A A . 19 GLU OE2 1 1 7 4887 1 1 18 TYR C C 6.029 -9.762 -1.588 1.00 . A A . 20 TYR C 1 1 7 4888 1 1 18 TYR CA C 5.430 -11.036 -0.990 1.00 . A A . 20 TYR CA 1 1 7 4889 1 1 18 TYR CB C 6.530 -11.839 -0.292 1.00 . A A . 20 TYR CB 1 1 7 4890 1 1 18 TYR CD1 C 7.430 -10.323 1.511 1.00 . A A . 20 TYR CD1 1 1 7 4891 1 1 18 TYR CD2 C 5.910 -12.107 2.136 1.00 . A A . 20 TYR CD2 1 1 7 4892 1 1 18 TYR CE1 C 7.517 -9.928 2.851 1.00 . A A . 20 TYR CE1 1 1 7 4893 1 1 18 TYR CE2 C 5.998 -11.713 3.476 1.00 . A A . 20 TYR CE2 1 1 7 4894 1 1 18 TYR CG C 6.626 -11.412 1.153 1.00 . A A . 20 TYR CG 1 1 7 4895 1 1 18 TYR CZ C 6.802 -10.624 3.834 1.00 . A A . 20 TYR CZ 1 1 7 4896 1 1 18 TYR H H 5.377 -12.525 -2.547 1.00 . A A . 20 TYR H 1 1 7 4897 1 1 18 TYR HA H 4.665 -10.775 -0.274 1.00 . A A . 20 TYR HA 1 1 7 4898 1 1 18 TYR HB2 H 6.295 -12.892 -0.342 1.00 . A A . 20 TYR HB2 1 1 7 4899 1 1 18 TYR HB3 H 7.475 -11.657 -0.782 1.00 . A A . 20 TYR HB3 1 1 7 4900 1 1 18 TYR HD1 H 7.981 -9.788 0.752 1.00 . A A . 20 TYR HD1 1 1 7 4901 1 1 18 TYR HD2 H 5.291 -12.947 1.861 1.00 . A A . 20 TYR HD2 1 1 7 4902 1 1 18 TYR HE1 H 8.138 -9.088 3.126 1.00 . A A . 20 TYR HE1 1 1 7 4903 1 1 18 TYR HE2 H 5.448 -12.249 4.235 1.00 . A A . 20 TYR HE2 1 1 7 4904 1 1 18 TYR HH H 6.359 -9.440 5.265 1.00 . A A . 20 TYR HH 1 1 7 4905 1 1 18 TYR N N 4.832 -11.858 -2.079 1.00 . A A . 20 TYR N 1 1 7 4906 1 1 18 TYR O O 6.879 -9.811 -2.454 1.00 . A A . 20 TYR O 1 1 7 4907 1 1 18 TYR OH O 6.888 -10.234 5.155 1.00 . A A . 20 TYR OH 1 1 7 4908 1 1 19 ARG C C 6.083 -6.270 -0.588 1.00 . A A . 21 ARG C 1 1 7 4909 1 1 19 ARG CA C 6.137 -7.345 -1.675 1.00 . A A . 21 ARG CA 1 1 7 4910 1 1 19 ARG CB C 5.298 -6.898 -2.874 1.00 . A A . 21 ARG CB 1 1 7 4911 1 1 19 ARG CD C 4.909 -7.560 -5.250 1.00 . A A . 21 ARG CD 1 1 7 4912 1 1 19 ARG CG C 5.971 -7.353 -4.170 1.00 . A A . 21 ARG CG 1 1 7 4913 1 1 19 ARG CZ C 2.632 -8.391 -5.282 1.00 . A A . 21 ARG CZ 1 1 7 4914 1 1 19 ARG H H 4.905 -8.603 -0.434 1.00 . A A . 21 ARG H 1 1 7 4915 1 1 19 ARG HA H 7.161 -7.493 -1.987 1.00 . A A . 21 ARG HA 1 1 7 4916 1 1 19 ARG HB2 H 4.313 -7.337 -2.807 1.00 . A A . 21 ARG HB2 1 1 7 4917 1 1 19 ARG HB3 H 5.214 -5.823 -2.873 1.00 . A A . 21 ARG HB3 1 1 7 4918 1 1 19 ARG HD2 H 4.521 -6.601 -5.562 1.00 . A A . 21 ARG HD2 1 1 7 4919 1 1 19 ARG HD3 H 5.350 -8.063 -6.098 1.00 . A A . 21 ARG HD3 1 1 7 4920 1 1 19 ARG HE H 3.947 -8.935 -3.898 1.00 . A A . 21 ARG HE 1 1 7 4921 1 1 19 ARG HG2 H 6.674 -6.600 -4.494 1.00 . A A . 21 ARG HG2 1 1 7 4922 1 1 19 ARG HG3 H 6.493 -8.283 -3.998 1.00 . A A . 21 ARG HG3 1 1 7 4923 1 1 19 ARG HH11 H 3.287 -7.484 -6.943 1.00 . A A . 21 ARG HH11 1 1 7 4924 1 1 19 ARG HH12 H 1.600 -7.881 -6.920 1.00 . A A . 21 ARG HH12 1 1 7 4925 1 1 19 ARG HH21 H 1.704 -9.295 -3.756 1.00 . A A . 21 ARG HH21 1 1 7 4926 1 1 19 ARG HH22 H 0.705 -8.905 -5.116 1.00 . A A . 21 ARG HH22 1 1 7 4927 1 1 19 ARG N N 5.592 -8.621 -1.133 1.00 . A A . 21 ARG N 1 1 7 4928 1 1 19 ARG NE N 3.800 -8.390 -4.700 1.00 . A A . 21 ARG NE 1 1 7 4929 1 1 19 ARG NH1 N 2.497 -7.879 -6.474 1.00 . A A . 21 ARG NH1 1 1 7 4930 1 1 19 ARG NH2 N 1.600 -8.904 -4.671 1.00 . A A . 21 ARG NH2 1 1 7 4931 1 1 19 ARG O O 5.082 -5.600 -0.432 1.00 . A A . 21 ARG O 1 1 7 4932 1 1 20 PRO C C 7.508 -3.750 0.647 1.00 . A A . 22 PRO C 1 1 7 4933 1 1 20 PRO CA C 7.276 -5.151 1.220 1.00 . A A . 22 PRO CA 1 1 7 4934 1 1 20 PRO CB C 8.492 -5.630 2.018 1.00 . A A . 22 PRO CB 1 1 7 4935 1 1 20 PRO CD C 8.379 -6.956 -0.068 1.00 . A A . 22 PRO CD 1 1 7 4936 1 1 20 PRO CG C 9.332 -6.502 1.054 1.00 . A A . 22 PRO CG 1 1 7 4937 1 1 20 PRO HA H 6.396 -5.169 1.843 1.00 . A A . 22 PRO HA 1 1 7 4938 1 1 20 PRO HB2 H 9.071 -4.781 2.356 1.00 . A A . 22 PRO HB2 1 1 7 4939 1 1 20 PRO HB3 H 8.175 -6.224 2.862 1.00 . A A . 22 PRO HB3 1 1 7 4940 1 1 20 PRO HD2 H 8.817 -6.757 -1.037 1.00 . A A . 22 PRO HD2 1 1 7 4941 1 1 20 PRO HD3 H 8.145 -8.004 0.035 1.00 . A A . 22 PRO HD3 1 1 7 4942 1 1 20 PRO HG2 H 10.144 -5.919 0.642 1.00 . A A . 22 PRO HG2 1 1 7 4943 1 1 20 PRO HG3 H 9.719 -7.364 1.574 1.00 . A A . 22 PRO HG3 1 1 7 4944 1 1 20 PRO N N 7.166 -6.137 0.134 1.00 . A A . 22 PRO N 1 1 7 4945 1 1 20 PRO O O 8.564 -3.447 0.128 1.00 . A A . 22 PRO O 1 1 7 4946 1 1 21 LEU C C 6.729 -0.522 1.369 1.00 . A A . 23 LEU C 1 1 7 4947 1 1 21 LEU CA C 6.689 -1.510 0.205 1.00 . A A . 23 LEU CA 1 1 7 4948 1 1 21 LEU CB C 5.505 -1.159 -0.700 1.00 . A A . 23 LEU CB 1 1 7 4949 1 1 21 LEU CD1 C 4.018 -1.985 -2.531 1.00 . A A . 23 LEU CD1 1 1 7 4950 1 1 21 LEU CD2 C 6.332 -2.898 -2.296 1.00 . A A . 23 LEU CD2 1 1 7 4951 1 1 21 LEU CG C 5.109 -2.381 -1.534 1.00 . A A . 23 LEU CG 1 1 7 4952 1 1 21 LEU H H 5.684 -3.158 1.165 1.00 . A A . 23 LEU H 1 1 7 4953 1 1 21 LEU HA H 7.609 -1.444 -0.358 1.00 . A A . 23 LEU HA 1 1 7 4954 1 1 21 LEU HB2 H 4.667 -0.854 -0.090 1.00 . A A . 23 LEU HB2 1 1 7 4955 1 1 21 LEU HB3 H 5.782 -0.348 -1.360 1.00 . A A . 23 LEU HB3 1 1 7 4956 1 1 21 LEU HD11 H 3.484 -2.869 -2.850 1.00 . A A . 23 LEU HD11 1 1 7 4957 1 1 21 LEU HD12 H 4.470 -1.509 -3.388 1.00 . A A . 23 LEU HD12 1 1 7 4958 1 1 21 LEU HD13 H 3.330 -1.299 -2.060 1.00 . A A . 23 LEU HD13 1 1 7 4959 1 1 21 LEU HD21 H 6.575 -3.893 -1.954 1.00 . A A . 23 LEU HD21 1 1 7 4960 1 1 21 LEU HD22 H 7.171 -2.241 -2.120 1.00 . A A . 23 LEU HD22 1 1 7 4961 1 1 21 LEU HD23 H 6.111 -2.924 -3.354 1.00 . A A . 23 LEU HD23 1 1 7 4962 1 1 21 LEU HG H 4.736 -3.155 -0.880 1.00 . A A . 23 LEU HG 1 1 7 4963 1 1 21 LEU N N 6.527 -2.892 0.740 1.00 . A A . 23 LEU N 1 1 7 4964 1 1 21 LEU O O 5.862 -0.514 2.216 1.00 . A A . 23 LEU O 1 1 7 4965 1 1 22 CYS C C 7.021 2.561 2.115 1.00 . A A . 24 CYS C 1 1 7 4966 1 1 22 CYS CA C 7.791 1.309 2.524 1.00 . A A . 24 CYS CA 1 1 7 4967 1 1 22 CYS CB C 9.253 1.669 2.796 1.00 . A A . 24 CYS CB 1 1 7 4968 1 1 22 CYS H H 8.410 0.312 0.718 1.00 . A A . 24 CYS H 1 1 7 4969 1 1 22 CYS HA H 7.349 0.886 3.414 1.00 . A A . 24 CYS HA 1 1 7 4970 1 1 22 CYS HB2 H 9.866 0.786 2.693 1.00 . A A . 24 CYS HB2 1 1 7 4971 1 1 22 CYS HB3 H 9.576 2.416 2.087 1.00 . A A . 24 CYS HB3 1 1 7 4972 1 1 22 CYS N N 7.719 0.322 1.414 1.00 . A A . 24 CYS N 1 1 7 4973 1 1 22 CYS O O 7.586 3.512 1.621 1.00 . A A . 24 CYS O 1 1 7 4974 1 1 22 CYS SG S 9.414 2.322 4.476 1.00 . A A . 24 CYS SG 1 1 7 4975 1 1 23 GLY C C 5.627 5.028 2.391 1.00 . A A . 25 GLY C 1 1 7 4976 1 1 23 GLY CA C 4.921 3.756 1.924 1.00 . A A . 25 GLY CA 1 1 7 4977 1 1 23 GLY H H 5.293 1.784 2.708 1.00 . A A . 25 GLY H 1 1 7 4978 1 1 23 GLY HA2 H 4.806 3.780 0.850 1.00 . A A . 25 GLY HA2 1 1 7 4979 1 1 23 GLY HA3 H 3.949 3.697 2.389 1.00 . A A . 25 GLY HA3 1 1 7 4980 1 1 23 GLY N N 5.731 2.566 2.311 1.00 . A A . 25 GLY N 1 1 7 4981 1 1 23 GLY O O 6.332 5.025 3.380 1.00 . A A . 25 GLY O 1 1 7 4982 1 1 24 SER C C 5.858 7.670 3.583 1.00 . A A . 26 SER C 1 1 7 4983 1 1 24 SER CA C 6.101 7.396 2.095 1.00 . A A . 26 SER CA 1 1 7 4984 1 1 24 SER CB C 5.523 8.546 1.275 1.00 . A A . 26 SER CB 1 1 7 4985 1 1 24 SER H H 4.864 6.097 0.891 1.00 . A A . 26 SER H 1 1 7 4986 1 1 24 SER HA H 7.162 7.325 1.912 1.00 . A A . 26 SER HA 1 1 7 4987 1 1 24 SER HB2 H 4.462 8.401 1.151 1.00 . A A . 26 SER HB2 1 1 7 4988 1 1 24 SER HB3 H 5.699 9.480 1.792 1.00 . A A . 26 SER HB3 1 1 7 4989 1 1 24 SER HG H 7.088 8.450 0.123 1.00 . A A . 26 SER HG 1 1 7 4990 1 1 24 SER N N 5.440 6.118 1.690 1.00 . A A . 26 SER N 1 1 7 4991 1 1 24 SER O O 6.560 8.446 4.200 1.00 . A A . 26 SER O 1 1 7 4992 1 1 24 SER OG O 6.145 8.572 -0.004 1.00 . A A . 26 SER OG 1 1 7 4993 1 1 25 ASP C C 5.438 6.314 6.455 1.00 . A A . 27 ASP C 1 1 7 4994 1 1 25 ASP CA C 4.590 7.268 5.612 1.00 . A A . 27 ASP CA 1 1 7 4995 1 1 25 ASP CB C 3.109 7.004 5.884 1.00 . A A . 27 ASP CB 1 1 7 4996 1 1 25 ASP CG C 2.803 5.523 5.651 1.00 . A A . 27 ASP CG 1 1 7 4997 1 1 25 ASP H H 4.318 6.421 3.654 1.00 . A A . 27 ASP H 1 1 7 4998 1 1 25 ASP HA H 4.828 8.289 5.873 1.00 . A A . 27 ASP HA 1 1 7 4999 1 1 25 ASP HB2 H 2.878 7.265 6.906 1.00 . A A . 27 ASP HB2 1 1 7 5000 1 1 25 ASP HB3 H 2.511 7.601 5.215 1.00 . A A . 27 ASP HB3 1 1 7 5001 1 1 25 ASP N N 4.873 7.042 4.165 1.00 . A A . 27 ASP N 1 1 7 5002 1 1 25 ASP O O 5.086 5.967 7.565 1.00 . A A . 27 ASP O 1 1 7 5003 1 1 25 ASP OD1 O 3.625 4.856 5.047 1.00 . A A . 27 ASP OD1 1 1 7 5004 1 1 25 ASP OD2 O 1.750 5.081 6.083 1.00 . A A . 27 ASP OD2 1 1 7 5005 1 1 26 ASN C C 6.595 3.748 7.149 1.00 . A A . 28 ASN C 1 1 7 5006 1 1 26 ASN CA C 7.422 4.949 6.689 1.00 . A A . 28 ASN CA 1 1 7 5007 1 1 26 ASN CB C 8.012 5.665 7.907 1.00 . A A . 28 ASN CB 1 1 7 5008 1 1 26 ASN CG C 9.351 5.025 8.274 1.00 . A A . 28 ASN CG 1 1 7 5009 1 1 26 ASN H H 6.809 6.174 5.035 1.00 . A A . 28 ASN H 1 1 7 5010 1 1 26 ASN HA H 8.224 4.608 6.051 1.00 . A A . 28 ASN HA 1 1 7 5011 1 1 26 ASN HB2 H 8.163 6.710 7.671 1.00 . A A . 28 ASN HB2 1 1 7 5012 1 1 26 ASN HB3 H 7.331 5.578 8.742 1.00 . A A . 28 ASN HB3 1 1 7 5013 1 1 26 ASN HD21 H 8.653 4.173 9.925 1.00 . A A . 28 ASN HD21 1 1 7 5014 1 1 26 ASN HD22 H 10.294 3.885 9.599 1.00 . A A . 28 ASN HD22 1 1 7 5015 1 1 26 ASN N N 6.549 5.884 5.931 1.00 . A A . 28 ASN N 1 1 7 5016 1 1 26 ASN ND2 N 9.439 4.301 9.357 1.00 . A A . 28 ASN ND2 1 1 7 5017 1 1 26 ASN O O 6.741 3.269 8.256 1.00 . A A . 28 ASN O 1 1 7 5018 1 1 26 ASN OD1 O 10.327 5.182 7.567 1.00 . A A . 28 ASN OD1 1 1 7 5019 1 1 27 LYS C C 5.243 0.880 5.830 1.00 . A A . 29 LYS C 1 1 7 5020 1 1 27 LYS CA C 4.891 2.087 6.704 1.00 . A A . 29 LYS CA 1 1 7 5021 1 1 27 LYS CB C 3.412 2.433 6.529 1.00 . A A . 29 LYS CB 1 1 7 5022 1 1 27 LYS CD C 1.955 1.735 8.433 1.00 . A A . 29 LYS CD 1 1 7 5023 1 1 27 LYS CE C 1.013 0.646 8.952 1.00 . A A . 29 LYS CE 1 1 7 5024 1 1 27 LYS CG C 2.552 1.301 7.092 1.00 . A A . 29 LYS CG 1 1 7 5025 1 1 27 LYS H H 5.621 3.659 5.417 1.00 . A A . 29 LYS H 1 1 7 5026 1 1 27 LYS HA H 5.081 1.845 7.737 1.00 . A A . 29 LYS HA 1 1 7 5027 1 1 27 LYS HB2 H 3.194 3.350 7.057 1.00 . A A . 29 LYS HB2 1 1 7 5028 1 1 27 LYS HB3 H 3.193 2.561 5.480 1.00 . A A . 29 LYS HB3 1 1 7 5029 1 1 27 LYS HD2 H 2.751 1.892 9.147 1.00 . A A . 29 LYS HD2 1 1 7 5030 1 1 27 LYS HD3 H 1.402 2.653 8.300 1.00 . A A . 29 LYS HD3 1 1 7 5031 1 1 27 LYS HE2 H -0.009 0.988 8.872 1.00 . A A . 29 LYS HE2 1 1 7 5032 1 1 27 LYS HE3 H 1.141 -0.251 8.365 1.00 . A A . 29 LYS HE3 1 1 7 5033 1 1 27 LYS HG2 H 1.756 1.074 6.399 1.00 . A A . 29 LYS HG2 1 1 7 5034 1 1 27 LYS HG3 H 3.163 0.424 7.240 1.00 . A A . 29 LYS HG3 1 1 7 5035 1 1 27 LYS HZ1 H 0.736 0.948 10.994 1.00 . A A . 29 LYS HZ1 1 1 7 5036 1 1 27 LYS HZ2 H 2.334 0.566 10.561 1.00 . A A . 29 LYS HZ2 1 1 7 5037 1 1 27 LYS HZ3 H 1.144 -0.645 10.581 1.00 . A A . 29 LYS HZ3 1 1 7 5038 1 1 27 LYS N N 5.726 3.257 6.308 1.00 . A A . 29 LYS N 1 1 7 5039 1 1 27 LYS NZ N 1.330 0.357 10.380 1.00 . A A . 29 LYS NZ 1 1 7 5040 1 1 27 LYS O O 5.608 1.020 4.679 1.00 . A A . 29 LYS O 1 1 7 5041 1 1 28 THR C C 4.184 -2.207 5.109 1.00 . A A . 30 THR C 1 1 7 5042 1 1 28 THR CA C 5.473 -1.521 5.573 1.00 . A A . 30 THR CA 1 1 7 5043 1 1 28 THR CB C 6.280 -2.493 6.438 1.00 . A A . 30 THR CB 1 1 7 5044 1 1 28 THR CG2 C 6.518 -3.792 5.665 1.00 . A A . 30 THR CG2 1 1 7 5045 1 1 28 THR H H 4.847 -0.394 7.301 1.00 . A A . 30 THR H 1 1 7 5046 1 1 28 THR HA H 6.061 -1.237 4.712 1.00 . A A . 30 THR HA 1 1 7 5047 1 1 28 THR HB H 5.730 -2.713 7.341 1.00 . A A . 30 THR HB 1 1 7 5048 1 1 28 THR HG1 H 7.477 -1.598 7.684 1.00 . A A . 30 THR HG1 1 1 7 5049 1 1 28 THR HG21 H 5.570 -4.270 5.463 1.00 . A A . 30 THR HG21 1 1 7 5050 1 1 28 THR HG22 H 7.136 -4.455 6.253 1.00 . A A . 30 THR HG22 1 1 7 5051 1 1 28 THR HG23 H 7.016 -3.571 4.732 1.00 . A A . 30 THR HG23 1 1 7 5052 1 1 28 THR N N 5.141 -0.305 6.370 1.00 . A A . 30 THR N 1 1 7 5053 1 1 28 THR O O 3.441 -2.751 5.899 1.00 . A A . 30 THR O 1 1 7 5054 1 1 28 THR OG1 O 7.529 -1.904 6.775 1.00 . A A . 30 THR OG1 1 1 7 5055 1 1 29 TYR C C 3.002 -4.274 2.912 1.00 . A A . 31 TYR C 1 1 7 5056 1 1 29 TYR CA C 2.686 -2.831 3.309 1.00 . A A . 31 TYR CA 1 1 7 5057 1 1 29 TYR CB C 2.202 -2.052 2.088 1.00 . A A . 31 TYR CB 1 1 7 5058 1 1 29 TYR CD1 C 2.399 0.279 3.023 1.00 . A A . 31 TYR CD1 1 1 7 5059 1 1 29 TYR CD2 C 0.198 -0.562 2.455 1.00 . A A . 31 TYR CD2 1 1 7 5060 1 1 29 TYR CE1 C 1.830 1.491 3.435 1.00 . A A . 31 TYR CE1 1 1 7 5061 1 1 29 TYR CE2 C -0.372 0.648 2.867 1.00 . A A . 31 TYR CE2 1 1 7 5062 1 1 29 TYR CG C 1.584 -0.746 2.534 1.00 . A A . 31 TYR CG 1 1 7 5063 1 1 29 TYR CZ C 0.444 1.675 3.357 1.00 . A A . 31 TYR CZ 1 1 7 5064 1 1 29 TYR H H 4.529 -1.743 3.213 1.00 . A A . 31 TYR H 1 1 7 5065 1 1 29 TYR HA H 1.920 -2.824 4.070 1.00 . A A . 31 TYR HA 1 1 7 5066 1 1 29 TYR HB2 H 3.040 -1.848 1.437 1.00 . A A . 31 TYR HB2 1 1 7 5067 1 1 29 TYR HB3 H 1.470 -2.633 1.557 1.00 . A A . 31 TYR HB3 1 1 7 5068 1 1 29 TYR HD1 H 3.468 0.137 3.084 1.00 . A A . 31 TYR HD1 1 1 7 5069 1 1 29 TYR HD2 H -0.431 -1.351 2.076 1.00 . A A . 31 TYR HD2 1 1 7 5070 1 1 29 TYR HE1 H 2.458 2.281 3.810 1.00 . A A . 31 TYR HE1 1 1 7 5071 1 1 29 TYR HE2 H -1.441 0.790 2.808 1.00 . A A . 31 TYR HE2 1 1 7 5072 1 1 29 TYR HH H -1.037 2.871 3.493 1.00 . A A . 31 TYR HH 1 1 7 5073 1 1 29 TYR N N 3.918 -2.184 3.832 1.00 . A A . 31 TYR N 1 1 7 5074 1 1 29 TYR O O 4.098 -4.586 2.491 1.00 . A A . 31 TYR O 1 1 7 5075 1 1 29 TYR OH O -0.116 2.868 3.764 1.00 . A A . 31 TYR OH 1 1 7 5076 1 1 30 GLY C C 2.513 -6.714 1.177 1.00 . A A . 32 GLY C 1 1 7 5077 1 1 30 GLY CA C 2.305 -6.586 2.687 1.00 . A A . 32 GLY CA 1 1 7 5078 1 1 30 GLY H H 1.177 -4.892 3.397 1.00 . A A . 32 GLY H 1 1 7 5079 1 1 30 GLY HA2 H 3.190 -6.934 3.203 1.00 . A A . 32 GLY HA2 1 1 7 5080 1 1 30 GLY HA3 H 1.458 -7.187 2.983 1.00 . A A . 32 GLY HA3 1 1 7 5081 1 1 30 GLY N N 2.053 -5.162 3.050 1.00 . A A . 32 GLY N 1 1 7 5082 1 1 30 GLY O O 3.197 -7.603 0.711 1.00 . A A . 32 GLY O 1 1 7 5083 1 1 31 ASN C C 1.429 -4.728 -1.742 1.00 . A A . 33 ASN C 1 1 7 5084 1 1 31 ASN CA C 2.114 -5.917 -1.070 1.00 . A A . 33 ASN CA 1 1 7 5085 1 1 31 ASN CB C 1.512 -7.225 -1.591 1.00 . A A . 33 ASN CB 1 1 7 5086 1 1 31 ASN CG C -0.003 -7.217 -1.392 1.00 . A A . 33 ASN CG 1 1 7 5087 1 1 31 ASN H H 1.392 -5.118 0.793 1.00 . A A . 33 ASN H 1 1 7 5088 1 1 31 ASN HA H 3.167 -5.894 -1.303 1.00 . A A . 33 ASN HA 1 1 7 5089 1 1 31 ASN HB2 H 1.738 -7.328 -2.643 1.00 . A A . 33 ASN HB2 1 1 7 5090 1 1 31 ASN HB3 H 1.939 -8.056 -1.050 1.00 . A A . 33 ASN HB3 1 1 7 5091 1 1 31 ASN HD21 H -0.297 -8.826 -2.517 1.00 . A A . 33 ASN HD21 1 1 7 5092 1 1 31 ASN HD22 H -1.697 -8.146 -1.843 1.00 . A A . 33 ASN HD22 1 1 7 5093 1 1 31 ASN N N 1.937 -5.833 0.405 1.00 . A A . 33 ASN N 1 1 7 5094 1 1 31 ASN ND2 N -0.727 -8.139 -1.965 1.00 . A A . 33 ASN ND2 1 1 7 5095 1 1 31 ASN O O 0.731 -3.957 -1.114 1.00 . A A . 33 ASN O 1 1 7 5096 1 1 31 ASN OD1 O -0.533 -6.364 -0.710 1.00 . A A . 33 ASN OD1 1 1 7 5097 1 1 32 LYS C C -0.492 -3.501 -3.668 1.00 . A A . 34 LYS C 1 1 7 5098 1 1 32 LYS CA C 1.033 -3.431 -3.754 1.00 . A A . 34 LYS CA 1 1 7 5099 1 1 32 LYS CB C 1.466 -3.492 -5.218 1.00 . A A . 34 LYS CB 1 1 7 5100 1 1 32 LYS CD C 0.810 -2.194 -7.246 1.00 . A A . 34 LYS CD 1 1 7 5101 1 1 32 LYS CE C -0.716 -2.241 -7.163 1.00 . A A . 34 LYS CE 1 1 7 5102 1 1 32 LYS CG C 1.392 -2.096 -5.836 1.00 . A A . 34 LYS CG 1 1 7 5103 1 1 32 LYS H H 2.222 -5.197 -3.488 1.00 . A A . 34 LYS H 1 1 7 5104 1 1 32 LYS HA H 1.370 -2.503 -3.318 1.00 . A A . 34 LYS HA 1 1 7 5105 1 1 32 LYS HB2 H 2.480 -3.860 -5.278 1.00 . A A . 34 LYS HB2 1 1 7 5106 1 1 32 LYS HB3 H 0.809 -4.157 -5.760 1.00 . A A . 34 LYS HB3 1 1 7 5107 1 1 32 LYS HD2 H 1.114 -1.333 -7.822 1.00 . A A . 34 LYS HD2 1 1 7 5108 1 1 32 LYS HD3 H 1.170 -3.093 -7.723 1.00 . A A . 34 LYS HD3 1 1 7 5109 1 1 32 LYS HE2 H -1.037 -1.857 -6.206 1.00 . A A . 34 LYS HE2 1 1 7 5110 1 1 32 LYS HE3 H -1.139 -1.638 -7.953 1.00 . A A . 34 LYS HE3 1 1 7 5111 1 1 32 LYS HG2 H 0.760 -1.467 -5.225 1.00 . A A . 34 LYS HG2 1 1 7 5112 1 1 32 LYS HG3 H 2.384 -1.671 -5.885 1.00 . A A . 34 LYS HG3 1 1 7 5113 1 1 32 LYS HZ1 H -1.772 -3.910 -6.499 1.00 . A A . 34 LYS HZ1 1 1 7 5114 1 1 32 LYS HZ2 H -0.352 -4.283 -7.356 1.00 . A A . 34 LYS HZ2 1 1 7 5115 1 1 32 LYS HZ3 H -1.733 -3.744 -8.186 1.00 . A A . 34 LYS HZ3 1 1 7 5116 1 1 32 LYS N N 1.645 -4.569 -3.016 1.00 . A A . 34 LYS N 1 1 7 5117 1 1 32 LYS NZ N -1.178 -3.651 -7.312 1.00 . A A . 34 LYS NZ 1 1 7 5118 1 1 32 LYS O O -1.180 -2.542 -3.957 1.00 . A A . 34 LYS O 1 1 7 5119 1 1 33 CYS C C -2.952 -3.932 -1.922 1.00 . A A . 35 CYS C 1 1 7 5120 1 1 33 CYS CA C -2.513 -4.714 -3.157 1.00 . A A . 35 CYS CA 1 1 7 5121 1 1 33 CYS CB C -2.915 -6.180 -3.016 1.00 . A A . 35 CYS CB 1 1 7 5122 1 1 33 CYS H H -0.473 -5.384 -3.020 1.00 . A A . 35 CYS H 1 1 7 5123 1 1 33 CYS HA H -2.971 -4.291 -4.038 1.00 . A A . 35 CYS HA 1 1 7 5124 1 1 33 CYS HB2 H -2.432 -6.760 -3.789 1.00 . A A . 35 CYS HB2 1 1 7 5125 1 1 33 CYS HB3 H -2.602 -6.540 -2.049 1.00 . A A . 35 CYS HB3 1 1 7 5126 1 1 33 CYS N N -1.034 -4.617 -3.264 1.00 . A A . 35 CYS N 1 1 7 5127 1 1 33 CYS O O -3.991 -3.299 -1.901 1.00 . A A . 35 CYS O 1 1 7 5128 1 1 33 CYS SG S -4.712 -6.335 -3.176 1.00 . A A . 35 CYS SG 1 1 7 5129 1 1 34 ASN C C -2.117 -1.732 0.089 1.00 . A A . 36 ASN C 1 1 7 5130 1 1 34 ASN CA C -2.477 -3.196 0.331 1.00 . A A . 36 ASN CA 1 1 7 5131 1 1 34 ASN CB C -1.669 -3.757 1.501 1.00 . A A . 36 ASN CB 1 1 7 5132 1 1 34 ASN CG C -2.569 -3.873 2.732 1.00 . A A . 36 ASN CG 1 1 7 5133 1 1 34 ASN H H -1.303 -4.449 -0.952 1.00 . A A . 36 ASN H 1 1 7 5134 1 1 34 ASN HA H -3.534 -3.282 0.537 1.00 . A A . 36 ASN HA 1 1 7 5135 1 1 34 ASN HB2 H -1.290 -4.734 1.240 1.00 . A A . 36 ASN HB2 1 1 7 5136 1 1 34 ASN HB3 H -0.844 -3.100 1.719 1.00 . A A . 36 ASN HB3 1 1 7 5137 1 1 34 ASN HD21 H -3.823 -5.142 1.860 1.00 . A A . 36 ASN HD21 1 1 7 5138 1 1 34 ASN HD22 H -4.205 -4.729 3.461 1.00 . A A . 36 ASN HD22 1 1 7 5139 1 1 34 ASN N N -2.144 -3.952 -0.899 1.00 . A A . 36 ASN N 1 1 7 5140 1 1 34 ASN ND2 N -3.619 -4.646 2.681 1.00 . A A . 36 ASN ND2 1 1 7 5141 1 1 34 ASN O O -2.648 -0.833 0.708 1.00 . A A . 36 ASN O 1 1 7 5142 1 1 34 ASN OD1 O -2.314 -3.258 3.749 1.00 . A A . 36 ASN OD1 1 1 7 5143 1 1 35 PHE C C -1.954 0.533 -1.987 1.00 . A A . 37 PHE C 1 1 7 5144 1 1 35 PHE CA C -0.831 -0.099 -1.166 1.00 . A A . 37 PHE CA 1 1 7 5145 1 1 35 PHE CB C 0.467 -0.125 -1.982 1.00 . A A . 37 PHE CB 1 1 7 5146 1 1 35 PHE CD1 C 0.527 2.072 -3.219 1.00 . A A . 37 PHE CD1 1 1 7 5147 1 1 35 PHE CD2 C 1.936 1.795 -1.263 1.00 . A A . 37 PHE CD2 1 1 7 5148 1 1 35 PHE CE1 C 1.014 3.374 -3.385 1.00 . A A . 37 PHE CE1 1 1 7 5149 1 1 35 PHE CE2 C 2.421 3.099 -1.430 1.00 . A A . 37 PHE CE2 1 1 7 5150 1 1 35 PHE CG C 0.988 1.282 -2.158 1.00 . A A . 37 PHE CG 1 1 7 5151 1 1 35 PHE CZ C 1.960 3.888 -2.490 1.00 . A A . 37 PHE CZ 1 1 7 5152 1 1 35 PHE H H -0.830 -2.242 -1.334 1.00 . A A . 37 PHE H 1 1 7 5153 1 1 35 PHE HA H -0.684 0.465 -0.257 1.00 . A A . 37 PHE HA 1 1 7 5154 1 1 35 PHE HB2 H 1.205 -0.719 -1.462 1.00 . A A . 37 PHE HB2 1 1 7 5155 1 1 35 PHE HB3 H 0.274 -0.563 -2.951 1.00 . A A . 37 PHE HB3 1 1 7 5156 1 1 35 PHE HD1 H -0.203 1.677 -3.909 1.00 . A A . 37 PHE HD1 1 1 7 5157 1 1 35 PHE HD2 H 2.293 1.186 -0.446 1.00 . A A . 37 PHE HD2 1 1 7 5158 1 1 35 PHE HE1 H 0.658 3.983 -4.202 1.00 . A A . 37 PHE HE1 1 1 7 5159 1 1 35 PHE HE2 H 3.153 3.495 -0.739 1.00 . A A . 37 PHE HE2 1 1 7 5160 1 1 35 PHE HZ H 2.335 4.892 -2.618 1.00 . A A . 37 PHE HZ 1 1 7 5161 1 1 35 PHE N N -1.226 -1.494 -0.838 1.00 . A A . 37 PHE N 1 1 7 5162 1 1 35 PHE O O -2.241 1.707 -1.872 1.00 . A A . 37 PHE O 1 1 7 5163 1 1 36 CYS C C -4.914 0.544 -2.679 1.00 . A A . 38 CYS C 1 1 7 5164 1 1 36 CYS CA C -3.733 0.281 -3.612 1.00 . A A . 38 CYS CA 1 1 7 5165 1 1 36 CYS CB C -4.136 -0.750 -4.670 1.00 . A A . 38 CYS CB 1 1 7 5166 1 1 36 CYS H H -2.369 -1.200 -2.862 1.00 . A A . 38 CYS H 1 1 7 5167 1 1 36 CYS HA H -3.433 1.201 -4.093 1.00 . A A . 38 CYS HA 1 1 7 5168 1 1 36 CYS HB2 H -3.843 -1.736 -4.340 1.00 . A A . 38 CYS HB2 1 1 7 5169 1 1 36 CYS HB3 H -5.207 -0.722 -4.811 1.00 . A A . 38 CYS HB3 1 1 7 5170 1 1 36 CYS N N -2.608 -0.253 -2.800 1.00 . A A . 38 CYS N 1 1 7 5171 1 1 36 CYS O O -5.755 1.382 -2.941 1.00 . A A . 38 CYS O 1 1 7 5172 1 1 36 CYS SG S -3.311 -0.370 -6.236 1.00 . A A . 38 CYS SG 1 1 7 5173 1 1 37 CYS C C -5.863 1.348 0.130 1.00 . A A . 39 CYS C 1 1 7 5174 1 1 37 CYS CA C -6.088 0.037 -0.618 1.00 . A A . 39 CYS CA 1 1 7 5175 1 1 37 CYS CB C -6.117 -1.118 0.382 1.00 . A A . 39 CYS CB 1 1 7 5176 1 1 37 CYS H H -4.279 -0.832 -1.394 1.00 . A A . 39 CYS H 1 1 7 5177 1 1 37 CYS HA H -7.024 0.081 -1.150 1.00 . A A . 39 CYS HA 1 1 7 5178 1 1 37 CYS HB2 H -5.431 -1.890 0.064 1.00 . A A . 39 CYS HB2 1 1 7 5179 1 1 37 CYS HB3 H -5.827 -0.758 1.358 1.00 . A A . 39 CYS HB3 1 1 7 5180 1 1 37 CYS N N -4.974 -0.167 -1.584 1.00 . A A . 39 CYS N 1 1 7 5181 1 1 37 CYS O O -6.770 2.133 0.319 1.00 . A A . 39 CYS O 1 1 7 5182 1 1 37 CYS SG S -7.792 -1.795 0.464 1.00 . A A . 39 CYS SG 1 1 7 5183 1 1 38 ALA C C -4.566 4.022 0.309 1.00 . A A . 40 ALA C 1 1 7 5184 1 1 38 ALA CA C -4.357 2.855 1.270 1.00 . A A . 40 ALA CA 1 1 7 5185 1 1 38 ALA CB C -2.906 2.843 1.755 1.00 . A A . 40 ALA CB 1 1 7 5186 1 1 38 ALA H H -3.938 0.946 0.369 1.00 . A A . 40 ALA H 1 1 7 5187 1 1 38 ALA HA H -5.023 2.955 2.114 1.00 . A A . 40 ALA HA 1 1 7 5188 1 1 38 ALA HB1 H -2.513 1.839 1.688 1.00 . A A . 40 ALA HB1 1 1 7 5189 1 1 38 ALA HB2 H -2.866 3.177 2.781 1.00 . A A . 40 ALA HB2 1 1 7 5190 1 1 38 ALA HB3 H -2.315 3.502 1.138 1.00 . A A . 40 ALA HB3 1 1 7 5191 1 1 38 ALA N N -4.653 1.592 0.544 1.00 . A A . 40 ALA N 1 1 7 5192 1 1 38 ALA O O -4.855 5.132 0.708 1.00 . A A . 40 ALA O 1 1 7 5193 1 1 39 VAL C C -6.107 5.137 -2.140 1.00 . A A . 41 VAL C 1 1 7 5194 1 1 39 VAL CA C -4.611 4.846 -1.970 1.00 . A A . 41 VAL CA 1 1 7 5195 1 1 39 VAL CB C -4.020 4.392 -3.309 1.00 . A A . 41 VAL CB 1 1 7 5196 1 1 39 VAL CG1 C -4.524 5.299 -4.434 1.00 . A A . 41 VAL CG1 1 1 7 5197 1 1 39 VAL CG2 C -2.493 4.470 -3.243 1.00 . A A . 41 VAL CG2 1 1 7 5198 1 1 39 VAL H H -4.190 2.858 -1.253 1.00 . A A . 41 VAL H 1 1 7 5199 1 1 39 VAL HA H -4.107 5.739 -1.639 1.00 . A A . 41 VAL HA 1 1 7 5200 1 1 39 VAL HB H -4.321 3.372 -3.506 1.00 . A A . 41 VAL HB 1 1 7 5201 1 1 39 VAL HG11 H -4.459 6.330 -4.121 1.00 . A A . 41 VAL HG11 1 1 7 5202 1 1 39 VAL HG12 H -5.552 5.055 -4.660 1.00 . A A . 41 VAL HG12 1 1 7 5203 1 1 39 VAL HG13 H -3.916 5.151 -5.315 1.00 . A A . 41 VAL HG13 1 1 7 5204 1 1 39 VAL HG21 H -2.158 5.374 -3.731 1.00 . A A . 41 VAL HG21 1 1 7 5205 1 1 39 VAL HG22 H -2.068 3.612 -3.742 1.00 . A A . 41 VAL HG22 1 1 7 5206 1 1 39 VAL HG23 H -2.177 4.480 -2.211 1.00 . A A . 41 VAL HG23 1 1 7 5207 1 1 39 VAL N N -4.423 3.767 -0.962 1.00 . A A . 41 VAL N 1 1 7 5208 1 1 39 VAL O O -6.508 6.261 -2.367 1.00 . A A . 41 VAL O 1 1 7 5209 1 1 40 VAL C C -9.015 4.779 -0.870 1.00 . A A . 42 VAL C 1 1 7 5210 1 1 40 VAL CA C -8.399 4.354 -2.206 1.00 . A A . 42 VAL CA 1 1 7 5211 1 1 40 VAL CB C -9.060 3.062 -2.696 1.00 . A A . 42 VAL CB 1 1 7 5212 1 1 40 VAL CG1 C -10.579 3.168 -2.541 1.00 . A A . 42 VAL CG1 1 1 7 5213 1 1 40 VAL CG2 C -8.719 2.850 -4.171 1.00 . A A . 42 VAL CG2 1 1 7 5214 1 1 40 VAL H H -6.588 3.233 -1.861 1.00 . A A . 42 VAL H 1 1 7 5215 1 1 40 VAL HA H -8.560 5.135 -2.934 1.00 . A A . 42 VAL HA 1 1 7 5216 1 1 40 VAL HB H -8.696 2.226 -2.117 1.00 . A A . 42 VAL HB 1 1 7 5217 1 1 40 VAL HG11 H -10.911 4.133 -2.893 1.00 . A A . 42 VAL HG11 1 1 7 5218 1 1 40 VAL HG12 H -10.844 3.054 -1.501 1.00 . A A . 42 VAL HG12 1 1 7 5219 1 1 40 VAL HG13 H -11.055 2.390 -3.120 1.00 . A A . 42 VAL HG13 1 1 7 5220 1 1 40 VAL HG21 H -8.282 1.871 -4.303 1.00 . A A . 42 VAL HG21 1 1 7 5221 1 1 40 VAL HG22 H -8.016 3.605 -4.490 1.00 . A A . 42 VAL HG22 1 1 7 5222 1 1 40 VAL HG23 H -9.620 2.925 -4.763 1.00 . A A . 42 VAL HG23 1 1 7 5223 1 1 40 VAL N N -6.932 4.133 -2.040 1.00 . A A . 42 VAL N 1 1 7 5224 1 1 40 VAL O O -10.148 5.216 -0.812 1.00 . A A . 42 VAL O 1 1 7 5225 1 1 41 GLU C C -8.166 6.360 1.982 1.00 . A A . 43 GLU C 1 1 7 5226 1 1 41 GLU CA C -8.839 5.063 1.526 1.00 . A A . 43 GLU CA 1 1 7 5227 1 1 41 GLU CB C -8.579 3.957 2.554 1.00 . A A . 43 GLU CB 1 1 7 5228 1 1 41 GLU CD C -6.987 4.461 4.417 1.00 . A A . 43 GLU CD 1 1 7 5229 1 1 41 GLU CG C -7.106 3.972 2.972 1.00 . A A . 43 GLU CG 1 1 7 5230 1 1 41 GLU H H -7.371 4.306 0.140 1.00 . A A . 43 GLU H 1 1 7 5231 1 1 41 GLU HA H -9.902 5.223 1.435 1.00 . A A . 43 GLU HA 1 1 7 5232 1 1 41 GLU HB2 H -9.200 4.122 3.422 1.00 . A A . 43 GLU HB2 1 1 7 5233 1 1 41 GLU HB3 H -8.817 2.997 2.120 1.00 . A A . 43 GLU HB3 1 1 7 5234 1 1 41 GLU HG2 H -6.702 2.972 2.896 1.00 . A A . 43 GLU HG2 1 1 7 5235 1 1 41 GLU HG3 H -6.553 4.634 2.322 1.00 . A A . 43 GLU HG3 1 1 7 5236 1 1 41 GLU N N -8.284 4.658 0.204 1.00 . A A . 43 GLU N 1 1 7 5237 1 1 41 GLU O O -8.585 6.986 2.935 1.00 . A A . 43 GLU O 1 1 7 5238 1 1 41 GLU OE1 O -7.166 5.647 4.636 1.00 . A A . 43 GLU OE1 1 1 7 5239 1 1 41 GLU OE2 O -6.717 3.641 5.279 1.00 . A A . 43 GLU OE2 1 1 7 5240 1 1 42 SER C C -6.752 9.124 0.687 1.00 . A A . 44 SER C 1 1 7 5241 1 1 42 SER CA C -6.426 8.020 1.698 1.00 . A A . 44 SER CA 1 1 7 5242 1 1 42 SER CB C -4.918 7.774 1.718 1.00 . A A . 44 SER CB 1 1 7 5243 1 1 42 SER H H -6.805 6.245 0.541 1.00 . A A . 44 SER H 1 1 7 5244 1 1 42 SER HA H -6.754 8.325 2.681 1.00 . A A . 44 SER HA 1 1 7 5245 1 1 42 SER HB2 H -4.440 8.489 2.366 1.00 . A A . 44 SER HB2 1 1 7 5246 1 1 42 SER HB3 H -4.723 6.773 2.083 1.00 . A A . 44 SER HB3 1 1 7 5247 1 1 42 SER HG H -3.873 7.145 0.201 1.00 . A A . 44 SER HG 1 1 7 5248 1 1 42 SER N N -7.126 6.766 1.307 1.00 . A A . 44 SER N 1 1 7 5249 1 1 42 SER O O -6.382 10.267 0.862 1.00 . A A . 44 SER O 1 1 7 5250 1 1 42 SER OG O -4.404 7.919 0.400 1.00 . A A . 44 SER OG 1 1 7 5251 1 1 43 ASN C C -6.581 10.112 -2.270 1.00 . A A . 45 ASN C 1 1 7 5252 1 1 43 ASN CA C -7.798 9.816 -1.391 1.00 . A A . 45 ASN CA 1 1 7 5253 1 1 43 ASN CB C -8.246 11.101 -0.692 1.00 . A A . 45 ASN CB 1 1 7 5254 1 1 43 ASN CG C -9.112 11.923 -1.647 1.00 . A A . 45 ASN CG 1 1 7 5255 1 1 43 ASN H H -7.732 7.862 -0.491 1.00 . A A . 45 ASN H 1 1 7 5256 1 1 43 ASN HA H -8.602 9.445 -2.008 1.00 . A A . 45 ASN HA 1 1 7 5257 1 1 43 ASN HB2 H -8.819 10.849 0.189 1.00 . A A . 45 ASN HB2 1 1 7 5258 1 1 43 ASN HB3 H -7.380 11.678 -0.407 1.00 . A A . 45 ASN HB3 1 1 7 5259 1 1 43 ASN HD21 H -10.759 10.875 -1.279 1.00 . A A . 45 ASN HD21 1 1 7 5260 1 1 43 ASN HD22 H -10.939 12.142 -2.394 1.00 . A A . 45 ASN HD22 1 1 7 5261 1 1 43 ASN N N -7.444 8.790 -0.369 1.00 . A A . 45 ASN N 1 1 7 5262 1 1 43 ASN ND2 N -10.374 11.621 -1.785 1.00 . A A . 45 ASN ND2 1 1 7 5263 1 1 43 ASN O O -6.510 11.135 -2.922 1.00 . A A . 45 ASN O 1 1 7 5264 1 1 43 ASN OD1 O -8.635 12.846 -2.276 1.00 . A A . 45 ASN OD1 1 1 7 5265 1 1 44 GLY C C -3.431 10.353 -2.383 1.00 . A A . 46 GLY C 1 1 7 5266 1 1 44 GLY CA C -4.418 9.460 -3.138 1.00 . A A . 46 GLY CA 1 1 7 5267 1 1 44 GLY H H -5.702 8.406 -1.765 1.00 . A A . 46 GLY H 1 1 7 5268 1 1 44 GLY HA2 H -3.948 8.514 -3.364 1.00 . A A . 46 GLY HA2 1 1 7 5269 1 1 44 GLY HA3 H -4.708 9.949 -4.055 1.00 . A A . 46 GLY HA3 1 1 7 5270 1 1 44 GLY N N -5.624 9.226 -2.297 1.00 . A A . 46 GLY N 1 1 7 5271 1 1 44 GLY O O -2.453 10.818 -2.934 1.00 . A A . 46 GLY O 1 1 7 5272 1 1 45 THR C C -1.539 10.634 0.096 1.00 . A A . 47 THR C 1 1 7 5273 1 1 45 THR CA C -2.753 11.458 -0.335 1.00 . A A . 47 THR CA 1 1 7 5274 1 1 45 THR CB C -3.482 11.989 0.901 1.00 . A A . 47 THR CB 1 1 7 5275 1 1 45 THR CG2 C -3.750 10.837 1.871 1.00 . A A . 47 THR CG2 1 1 7 5276 1 1 45 THR H H -4.474 10.211 -0.698 1.00 . A A . 47 THR H 1 1 7 5277 1 1 45 THR HA H -2.427 12.287 -0.945 1.00 . A A . 47 THR HA 1 1 7 5278 1 1 45 THR HB H -4.421 12.431 0.606 1.00 . A A . 47 THR HB 1 1 7 5279 1 1 45 THR HG1 H -3.216 13.753 1.678 1.00 . A A . 47 THR HG1 1 1 7 5280 1 1 45 THR HG21 H -4.292 10.056 1.360 1.00 . A A . 47 THR HG21 1 1 7 5281 1 1 45 THR HG22 H -4.336 11.197 2.704 1.00 . A A . 47 THR HG22 1 1 7 5282 1 1 45 THR HG23 H -2.811 10.446 2.233 1.00 . A A . 47 THR HG23 1 1 7 5283 1 1 45 THR N N -3.680 10.596 -1.124 1.00 . A A . 47 THR N 1 1 7 5284 1 1 45 THR O O -0.445 11.145 0.234 1.00 . A A . 47 THR O 1 1 7 5285 1 1 45 THR OG1 O -2.676 12.971 1.538 1.00 . A A . 47 THR OG1 1 1 7 5286 1 1 46 LEU C C 0.294 8.211 -0.506 1.00 . A A . 48 LEU C 1 1 7 5287 1 1 46 LEU CA C -0.580 8.495 0.715 1.00 . A A . 48 LEU CA 1 1 7 5288 1 1 46 LEU CB C -1.117 7.178 1.280 1.00 . A A . 48 LEU CB 1 1 7 5289 1 1 46 LEU CD1 C -0.252 5.446 2.859 1.00 . A A . 48 LEU CD1 1 1 7 5290 1 1 46 LEU CD2 C 0.242 5.269 0.416 1.00 . A A . 48 LEU CD2 1 1 7 5291 1 1 46 LEU CG C 0.050 6.239 1.585 1.00 . A A . 48 LEU CG 1 1 7 5292 1 1 46 LEU H H -2.612 8.968 0.179 1.00 . A A . 48 LEU H 1 1 7 5293 1 1 46 LEU HA H 0.003 9.002 1.470 1.00 . A A . 48 LEU HA 1 1 7 5294 1 1 46 LEU HB2 H -1.669 7.375 2.187 1.00 . A A . 48 LEU HB2 1 1 7 5295 1 1 46 LEU HB3 H -1.769 6.715 0.554 1.00 . A A . 48 LEU HB3 1 1 7 5296 1 1 46 LEU HD11 H -0.905 6.024 3.496 1.00 . A A . 48 LEU HD11 1 1 7 5297 1 1 46 LEU HD12 H 0.670 5.240 3.383 1.00 . A A . 48 LEU HD12 1 1 7 5298 1 1 46 LEU HD13 H -0.734 4.515 2.599 1.00 . A A . 48 LEU HD13 1 1 7 5299 1 1 46 LEU HD21 H 1.231 4.837 0.465 1.00 . A A . 48 LEU HD21 1 1 7 5300 1 1 46 LEU HD22 H 0.127 5.803 -0.516 1.00 . A A . 48 LEU HD22 1 1 7 5301 1 1 46 LEU HD23 H -0.497 4.484 0.474 1.00 . A A . 48 LEU HD23 1 1 7 5302 1 1 46 LEU HG H 0.950 6.817 1.728 1.00 . A A . 48 LEU HG 1 1 7 5303 1 1 46 LEU N N -1.722 9.359 0.302 1.00 . A A . 48 LEU N 1 1 7 5304 1 1 46 LEU O O -0.170 8.243 -1.629 1.00 . A A . 48 LEU O 1 1 7 5305 1 1 47 THR C C 3.392 6.509 -1.173 1.00 . A A . 49 THR C 1 1 7 5306 1 1 47 THR CA C 2.439 7.674 -1.475 1.00 . A A . 49 THR CA 1 1 7 5307 1 1 47 THR CB C 3.241 8.938 -1.800 1.00 . A A . 49 THR CB 1 1 7 5308 1 1 47 THR CG2 C 2.277 10.079 -2.130 1.00 . A A . 49 THR CG2 1 1 7 5309 1 1 47 THR H H 1.921 7.928 0.602 1.00 . A A . 49 THR H 1 1 7 5310 1 1 47 THR HA H 1.830 7.416 -2.328 1.00 . A A . 49 THR HA 1 1 7 5311 1 1 47 THR HB H 3.877 8.757 -2.650 1.00 . A A . 49 THR HB 1 1 7 5312 1 1 47 THR HG1 H 4.513 10.100 -0.900 1.00 . A A . 49 THR HG1 1 1 7 5313 1 1 47 THR HG21 H 2.717 10.714 -2.884 1.00 . A A . 49 THR HG21 1 1 7 5314 1 1 47 THR HG22 H 2.086 10.658 -1.238 1.00 . A A . 49 THR HG22 1 1 7 5315 1 1 47 THR HG23 H 1.349 9.670 -2.499 1.00 . A A . 49 THR HG23 1 1 7 5316 1 1 47 THR N N 1.556 7.943 -0.308 1.00 . A A . 49 THR N 1 1 7 5317 1 1 47 THR O O 3.142 5.688 -0.314 1.00 . A A . 49 THR O 1 1 7 5318 1 1 47 THR OG1 O 4.035 9.297 -0.680 1.00 . A A . 49 THR OG1 1 1 7 5319 1 1 48 LEU C C 6.796 5.939 -1.258 1.00 . A A . 50 LEU C 1 1 7 5320 1 1 48 LEU CA C 5.462 5.337 -1.710 1.00 . A A . 50 LEU CA 1 1 7 5321 1 1 48 LEU CB C 5.643 4.623 -3.056 1.00 . A A . 50 LEU CB 1 1 7 5322 1 1 48 LEU CD1 C 6.210 2.257 -2.486 1.00 . A A . 50 LEU CD1 1 1 7 5323 1 1 48 LEU CD2 C 7.382 3.411 -4.366 1.00 . A A . 50 LEU CD2 1 1 7 5324 1 1 48 LEU CG C 6.771 3.595 -2.974 1.00 . A A . 50 LEU CG 1 1 7 5325 1 1 48 LEU H H 4.632 7.106 -2.584 1.00 . A A . 50 LEU H 1 1 7 5326 1 1 48 LEU HA H 5.102 4.636 -0.971 1.00 . A A . 50 LEU HA 1 1 7 5327 1 1 48 LEU HB2 H 4.723 4.124 -3.321 1.00 . A A . 50 LEU HB2 1 1 7 5328 1 1 48 LEU HB3 H 5.882 5.354 -3.815 1.00 . A A . 50 LEU HB3 1 1 7 5329 1 1 48 LEU HD11 H 6.970 1.495 -2.575 1.00 . A A . 50 LEU HD11 1 1 7 5330 1 1 48 LEU HD12 H 5.355 1.986 -3.087 1.00 . A A . 50 LEU HD12 1 1 7 5331 1 1 48 LEU HD13 H 5.910 2.347 -1.453 1.00 . A A . 50 LEU HD13 1 1 7 5332 1 1 48 LEU HD21 H 8.175 4.130 -4.509 1.00 . A A . 50 LEU HD21 1 1 7 5333 1 1 48 LEU HD22 H 6.620 3.565 -5.117 1.00 . A A . 50 LEU HD22 1 1 7 5334 1 1 48 LEU HD23 H 7.780 2.412 -4.457 1.00 . A A . 50 LEU HD23 1 1 7 5335 1 1 48 LEU HG H 7.529 3.941 -2.290 1.00 . A A . 50 LEU HG 1 1 7 5336 1 1 48 LEU N N 4.473 6.436 -1.899 1.00 . A A . 50 LEU N 1 1 7 5337 1 1 48 LEU O O 7.111 7.071 -1.568 1.00 . A A . 50 LEU O 1 1 7 5338 1 1 49 SER C C 10.033 4.935 -0.699 1.00 . A A . 51 SER C 1 1 7 5339 1 1 49 SER CA C 8.894 5.736 -0.066 1.00 . A A . 51 SER CA 1 1 7 5340 1 1 49 SER CB C 8.982 5.633 1.457 1.00 . A A . 51 SER CB 1 1 7 5341 1 1 49 SER H H 7.314 4.286 -0.291 1.00 . A A . 51 SER H 1 1 7 5342 1 1 49 SER HA H 8.977 6.773 -0.360 1.00 . A A . 51 SER HA 1 1 7 5343 1 1 49 SER HB2 H 7.992 5.654 1.880 1.00 . A A . 51 SER HB2 1 1 7 5344 1 1 49 SER HB3 H 9.465 4.703 1.725 1.00 . A A . 51 SER HB3 1 1 7 5345 1 1 49 SER HG H 10.624 6.426 2.137 1.00 . A A . 51 SER HG 1 1 7 5346 1 1 49 SER N N 7.583 5.197 -0.530 1.00 . A A . 51 SER N 1 1 7 5347 1 1 49 SER O O 11.005 5.492 -1.169 1.00 . A A . 51 SER O 1 1 7 5348 1 1 49 SER OG O 9.731 6.731 1.960 1.00 . A A . 51 SER OG 1 1 7 5349 1 1 50 HIS C C 10.669 1.322 -1.167 1.00 . A A . 52 HIS C 1 1 7 5350 1 1 50 HIS CA C 11.006 2.807 -1.324 1.00 . A A . 52 HIS CA 1 1 7 5351 1 1 50 HIS CB C 12.335 3.101 -0.621 1.00 . A A . 52 HIS CB 1 1 7 5352 1 1 50 HIS CD2 C 11.753 3.256 1.939 1.00 . A A . 52 HIS CD2 1 1 7 5353 1 1 50 HIS CE1 C 12.532 1.332 2.556 1.00 . A A . 52 HIS CE1 1 1 7 5354 1 1 50 HIS CG C 12.258 2.652 0.814 1.00 . A A . 52 HIS CG 1 1 7 5355 1 1 50 HIS H H 9.133 3.198 -0.339 1.00 . A A . 52 HIS H 1 1 7 5356 1 1 50 HIS HA H 11.095 3.047 -2.373 1.00 . A A . 52 HIS HA 1 1 7 5357 1 1 50 HIS HB2 H 13.129 2.568 -1.122 1.00 . A A . 52 HIS HB2 1 1 7 5358 1 1 50 HIS HB3 H 12.534 4.161 -0.656 1.00 . A A . 52 HIS HB3 1 1 7 5359 1 1 50 HIS HD1 H 13.180 0.750 0.666 1.00 . A A . 52 HIS HD1 1 1 7 5360 1 1 50 HIS HD2 H 11.290 4.231 1.966 1.00 . A A . 52 HIS HD2 1 1 7 5361 1 1 50 HIS HE1 H 12.811 0.479 3.157 1.00 . A A . 52 HIS HE1 1 1 7 5362 1 1 50 HIS N N 9.925 3.632 -0.719 1.00 . A A . 52 HIS N 1 1 7 5363 1 1 50 HIS ND1 N 12.750 1.425 1.232 1.00 . A A . 52 HIS ND1 1 1 7 5364 1 1 50 HIS NE2 N 11.927 2.421 3.037 1.00 . A A . 52 HIS NE2 1 1 7 5365 1 1 50 HIS O O 10.760 0.763 -0.093 1.00 . A A . 52 HIS O 1 1 7 5366 1 1 51 PHE C C 11.004 -1.488 -1.310 1.00 . A A . 53 PHE C 1 1 7 5367 1 1 51 PHE CA C 9.952 -0.767 -2.159 1.00 . A A . 53 PHE CA 1 1 7 5368 1 1 51 PHE CB C 9.959 -1.356 -3.570 1.00 . A A . 53 PHE CB 1 1 7 5369 1 1 51 PHE CD1 C 7.684 -0.315 -3.892 1.00 . A A . 53 PHE CD1 1 1 7 5370 1 1 51 PHE CD2 C 9.224 -0.361 -5.765 1.00 . A A . 53 PHE CD2 1 1 7 5371 1 1 51 PHE CE1 C 6.731 0.327 -4.693 1.00 . A A . 53 PHE CE1 1 1 7 5372 1 1 51 PHE CE2 C 8.271 0.281 -6.565 1.00 . A A . 53 PHE CE2 1 1 7 5373 1 1 51 PHE CG C 8.930 -0.658 -4.428 1.00 . A A . 53 PHE CG 1 1 7 5374 1 1 51 PHE CZ C 7.025 0.625 -6.030 1.00 . A A . 53 PHE CZ 1 1 7 5375 1 1 51 PHE H H 10.221 1.147 -3.088 1.00 . A A . 53 PHE H 1 1 7 5376 1 1 51 PHE HA H 8.976 -0.894 -1.717 1.00 . A A . 53 PHE HA 1 1 7 5377 1 1 51 PHE HB2 H 10.937 -1.226 -4.009 1.00 . A A . 53 PHE HB2 1 1 7 5378 1 1 51 PHE HB3 H 9.728 -2.404 -3.519 1.00 . A A . 53 PHE HB3 1 1 7 5379 1 1 51 PHE HD1 H 7.456 -0.545 -2.862 1.00 . A A . 53 PHE HD1 1 1 7 5380 1 1 51 PHE HD2 H 10.186 -0.625 -6.178 1.00 . A A . 53 PHE HD2 1 1 7 5381 1 1 51 PHE HE1 H 5.769 0.592 -4.280 1.00 . A A . 53 PHE HE1 1 1 7 5382 1 1 51 PHE HE2 H 8.498 0.510 -7.596 1.00 . A A . 53 PHE HE2 1 1 7 5383 1 1 51 PHE HZ H 6.289 1.120 -6.647 1.00 . A A . 53 PHE HZ 1 1 7 5384 1 1 51 PHE N N 10.286 0.679 -2.234 1.00 . A A . 53 PHE N 1 1 7 5385 1 1 51 PHE O O 12.116 -1.712 -1.746 1.00 . A A . 53 PHE O 1 1 7 5386 1 1 52 GLY C C 11.235 -2.433 2.230 1.00 . A A . 54 GLY C 1 1 7 5387 1 1 52 GLY CA C 11.655 -2.559 0.763 1.00 . A A . 54 GLY CA 1 1 7 5388 1 1 52 GLY H H 9.766 -1.665 0.232 1.00 . A A . 54 GLY H 1 1 7 5389 1 1 52 GLY HA2 H 11.694 -3.603 0.486 1.00 . A A . 54 GLY HA2 1 1 7 5390 1 1 52 GLY HA3 H 12.630 -2.114 0.632 1.00 . A A . 54 GLY HA3 1 1 7 5391 1 1 52 GLY N N 10.667 -1.853 -0.104 1.00 . A A . 54 GLY N 1 1 7 5392 1 1 52 GLY O O 10.653 -1.446 2.635 1.00 . A A . 54 GLY O 1 1 7 5393 1 1 53 LYS C C 11.536 -1.989 5.034 1.00 . A A . 55 LYS C 1 1 7 5394 1 1 53 LYS CA C 11.139 -3.355 4.468 1.00 . A A . 55 LYS CA 1 1 7 5395 1 1 53 LYS CB C 11.861 -4.460 5.245 1.00 . A A . 55 LYS CB 1 1 7 5396 1 1 53 LYS CD C 11.471 -6.564 6.536 1.00 . A A . 55 LYS CD 1 1 7 5397 1 1 53 LYS CE C 10.381 -7.479 7.097 1.00 . A A . 55 LYS CE 1 1 7 5398 1 1 53 LYS CG C 10.850 -5.238 6.092 1.00 . A A . 55 LYS CG 1 1 7 5399 1 1 53 LYS H H 11.994 -4.212 2.684 1.00 . A A . 55 LYS H 1 1 7 5400 1 1 53 LYS HA H 10.071 -3.487 4.562 1.00 . A A . 55 LYS HA 1 1 7 5401 1 1 53 LYS HB2 H 12.343 -5.132 4.551 1.00 . A A . 55 LYS HB2 1 1 7 5402 1 1 53 LYS HB3 H 12.603 -4.017 5.893 1.00 . A A . 55 LYS HB3 1 1 7 5403 1 1 53 LYS HD2 H 11.944 -7.041 5.690 1.00 . A A . 55 LYS HD2 1 1 7 5404 1 1 53 LYS HD3 H 12.210 -6.377 7.302 1.00 . A A . 55 LYS HD3 1 1 7 5405 1 1 53 LYS HE2 H 10.800 -8.106 7.870 1.00 . A A . 55 LYS HE2 1 1 7 5406 1 1 53 LYS HE3 H 9.586 -6.879 7.512 1.00 . A A . 55 LYS HE3 1 1 7 5407 1 1 53 LYS HG2 H 10.585 -4.655 6.962 1.00 . A A . 55 LYS HG2 1 1 7 5408 1 1 53 LYS HG3 H 9.965 -5.436 5.506 1.00 . A A . 55 LYS HG3 1 1 7 5409 1 1 53 LYS HZ1 H 9.625 -9.280 6.377 1.00 . A A . 55 LYS HZ1 1 1 7 5410 1 1 53 LYS HZ2 H 10.547 -8.413 5.245 1.00 . A A . 55 LYS HZ2 1 1 7 5411 1 1 53 LYS HZ3 H 8.971 -7.906 5.627 1.00 . A A . 55 LYS HZ3 1 1 7 5412 1 1 53 LYS N N 11.524 -3.425 3.029 1.00 . A A . 55 LYS N 1 1 7 5413 1 1 53 LYS NZ N 9.841 -8.335 6.004 1.00 . A A . 55 LYS NZ 1 1 7 5414 1 1 53 LYS O O 12.632 -1.512 4.815 1.00 . A A . 55 LYS O 1 1 7 5415 1 1 54 CYS C C 12.052 -0.185 7.421 1.00 . A A . 56 CYS C 1 1 7 5416 1 1 54 CYS CA C 10.988 -0.021 6.334 1.00 . A A . 56 CYS CA 1 1 7 5417 1 1 54 CYS CB C 9.731 0.602 6.944 1.00 . A A . 56 CYS CB 1 1 7 5418 1 1 54 CYS H H 9.776 -1.756 5.924 1.00 . A A . 56 CYS H 1 1 7 5419 1 1 54 CYS HA H 11.367 0.623 5.555 1.00 . A A . 56 CYS HA 1 1 7 5420 1 1 54 CYS HB2 H 9.305 -0.081 7.665 1.00 . A A . 56 CYS HB2 1 1 7 5421 1 1 54 CYS HB3 H 9.989 1.529 7.434 1.00 . A A . 56 CYS HB3 1 1 7 5422 1 1 54 CYS N N 10.655 -1.355 5.758 1.00 . A A . 56 CYS N 1 1 7 5423 1 1 54 CYS O O 11.688 -0.541 8.529 1.00 . A A . 56 CYS O 1 1 7 5424 1 1 54 CYS OXT O 13.212 0.050 7.127 1.00 . A A . 56 CYS OXT 1 1 7 5425 1 1 54 CYS SG S 8.524 0.928 5.637 1.00 . A A . 56 CYS SG 1 1 8 5426 1 1 1 ALA C C 8.250 5.389 -8.419 1.00 . A A . 3 ALA C 1 1 8 5427 1 1 1 ALA CA C 9.549 5.446 -9.227 1.00 . A A . 3 ALA CA 1 1 8 5428 1 1 1 ALA CB C 10.695 4.872 -8.392 1.00 . A A . 3 ALA CB 1 1 8 5429 1 1 1 ALA H1 H 9.043 7.464 -9.331 1.00 . A A . 3 ALA H1 1 1 8 5430 1 1 1 ALA H2 H 10.038 6.931 -10.602 1.00 . A A . 3 ALA H2 1 1 8 5431 1 1 1 ALA H3 H 10.692 7.178 -9.053 1.00 . A A . 3 ALA H3 1 1 8 5432 1 1 1 ALA HA H 9.436 4.866 -10.131 1.00 . A A . 3 ALA HA 1 1 8 5433 1 1 1 ALA HB1 H 11.450 4.467 -9.049 1.00 . A A . 3 ALA HB1 1 1 8 5434 1 1 1 ALA HB2 H 10.317 4.088 -7.753 1.00 . A A . 3 ALA HB2 1 1 8 5435 1 1 1 ALA HB3 H 11.126 5.654 -7.787 1.00 . A A . 3 ALA HB3 1 1 8 5436 1 1 1 ALA N N 9.853 6.862 -9.580 1.00 . A A . 3 ALA N 1 1 8 5437 1 1 1 ALA O O 8.188 4.784 -7.367 1.00 . A A . 3 ALA O 1 1 8 5438 1 1 2 VAL C C 4.794 5.587 -9.124 1.00 . A A . 4 VAL C 1 1 8 5439 1 1 2 VAL CA C 5.918 5.988 -8.164 1.00 . A A . 4 VAL CA 1 1 8 5440 1 1 2 VAL CB C 5.632 7.379 -7.598 1.00 . A A . 4 VAL CB 1 1 8 5441 1 1 2 VAL CG1 C 6.717 7.755 -6.586 1.00 . A A . 4 VAL CG1 1 1 8 5442 1 1 2 VAL CG2 C 5.625 8.399 -8.739 1.00 . A A . 4 VAL CG2 1 1 8 5443 1 1 2 VAL H H 7.280 6.491 -9.755 1.00 . A A . 4 VAL H 1 1 8 5444 1 1 2 VAL HA H 5.977 5.274 -7.357 1.00 . A A . 4 VAL HA 1 1 8 5445 1 1 2 VAL HB H 4.668 7.377 -7.107 1.00 . A A . 4 VAL HB 1 1 8 5446 1 1 2 VAL HG11 H 7.498 7.008 -6.599 1.00 . A A . 4 VAL HG11 1 1 8 5447 1 1 2 VAL HG12 H 6.285 7.805 -5.596 1.00 . A A . 4 VAL HG12 1 1 8 5448 1 1 2 VAL HG13 H 7.134 8.717 -6.845 1.00 . A A . 4 VAL HG13 1 1 8 5449 1 1 2 VAL HG21 H 5.411 7.894 -9.668 1.00 . A A . 4 VAL HG21 1 1 8 5450 1 1 2 VAL HG22 H 6.592 8.876 -8.801 1.00 . A A . 4 VAL HG22 1 1 8 5451 1 1 2 VAL HG23 H 4.867 9.145 -8.550 1.00 . A A . 4 VAL HG23 1 1 8 5452 1 1 2 VAL N N 7.211 6.010 -8.904 1.00 . A A . 4 VAL N 1 1 8 5453 1 1 2 VAL O O 3.942 6.383 -9.465 1.00 . A A . 4 VAL O 1 1 8 5454 1 1 3 SER C C 2.664 3.110 -9.742 1.00 . A A . 5 SER C 1 1 8 5455 1 1 3 SER CA C 3.723 3.907 -10.506 1.00 . A A . 5 SER CA 1 1 8 5456 1 1 3 SER CB C 4.344 3.019 -11.583 1.00 . A A . 5 SER CB 1 1 8 5457 1 1 3 SER H H 5.486 3.732 -9.279 1.00 . A A . 5 SER H 1 1 8 5458 1 1 3 SER HA H 3.264 4.768 -10.968 1.00 . A A . 5 SER HA 1 1 8 5459 1 1 3 SER HB2 H 3.564 2.569 -12.175 1.00 . A A . 5 SER HB2 1 1 8 5460 1 1 3 SER HB3 H 4.976 3.621 -12.222 1.00 . A A . 5 SER HB3 1 1 8 5461 1 1 3 SER HG H 5.569 1.510 -11.648 1.00 . A A . 5 SER HG 1 1 8 5462 1 1 3 SER N N 4.788 4.358 -9.565 1.00 . A A . 5 SER N 1 1 8 5463 1 1 3 SER O O 2.828 1.936 -9.477 1.00 . A A . 5 SER O 1 1 8 5464 1 1 3 SER OG O 5.111 1.997 -10.961 1.00 . A A . 5 SER OG 1 1 8 5465 1 1 4 VAL C C -0.860 3.540 -9.108 1.00 . A A . 6 VAL C 1 1 8 5466 1 1 4 VAL CA C 0.503 3.022 -8.649 1.00 . A A . 6 VAL CA 1 1 8 5467 1 1 4 VAL CB C 0.667 3.275 -7.150 1.00 . A A . 6 VAL CB 1 1 8 5468 1 1 4 VAL CG1 C 0.697 4.781 -6.889 1.00 . A A . 6 VAL CG1 1 1 8 5469 1 1 4 VAL CG2 C -0.510 2.653 -6.396 1.00 . A A . 6 VAL CG2 1 1 8 5470 1 1 4 VAL H H 1.464 4.686 -9.620 1.00 . A A . 6 VAL H 1 1 8 5471 1 1 4 VAL HA H 0.573 1.962 -8.847 1.00 . A A . 6 VAL HA 1 1 8 5472 1 1 4 VAL HB H 1.591 2.832 -6.809 1.00 . A A . 6 VAL HB 1 1 8 5473 1 1 4 VAL HG11 H 0.356 5.306 -7.769 1.00 . A A . 6 VAL HG11 1 1 8 5474 1 1 4 VAL HG12 H 1.707 5.087 -6.658 1.00 . A A . 6 VAL HG12 1 1 8 5475 1 1 4 VAL HG13 H 0.050 5.015 -6.058 1.00 . A A . 6 VAL HG13 1 1 8 5476 1 1 4 VAL HG21 H -0.143 2.129 -5.526 1.00 . A A . 6 VAL HG21 1 1 8 5477 1 1 4 VAL HG22 H -1.026 1.959 -7.043 1.00 . A A . 6 VAL HG22 1 1 8 5478 1 1 4 VAL HG23 H -1.191 3.432 -6.087 1.00 . A A . 6 VAL HG23 1 1 8 5479 1 1 4 VAL N N 1.577 3.739 -9.392 1.00 . A A . 6 VAL N 1 1 8 5480 1 1 4 VAL O O -1.041 4.718 -9.341 1.00 . A A . 6 VAL O 1 1 8 5481 1 1 5 ASP C C -4.244 2.292 -8.977 1.00 . A A . 7 ASP C 1 1 8 5482 1 1 5 ASP CA C -3.171 3.116 -9.689 1.00 . A A . 7 ASP CA 1 1 8 5483 1 1 5 ASP CB C -3.295 2.916 -11.200 1.00 . A A . 7 ASP CB 1 1 8 5484 1 1 5 ASP CG C -2.616 1.604 -11.598 1.00 . A A . 7 ASP CG 1 1 8 5485 1 1 5 ASP H H -1.658 1.722 -9.051 1.00 . A A . 7 ASP H 1 1 8 5486 1 1 5 ASP HA H -3.301 4.161 -9.452 1.00 . A A . 7 ASP HA 1 1 8 5487 1 1 5 ASP HB2 H -4.339 2.878 -11.473 1.00 . A A . 7 ASP HB2 1 1 8 5488 1 1 5 ASP HB3 H -2.817 3.736 -11.713 1.00 . A A . 7 ASP HB3 1 1 8 5489 1 1 5 ASP N N -1.823 2.669 -9.242 1.00 . A A . 7 ASP N 1 1 8 5490 1 1 5 ASP O O -4.246 1.078 -9.028 1.00 . A A . 7 ASP O 1 1 8 5491 1 1 5 ASP OD1 O -3.082 0.564 -11.166 1.00 . A A . 7 ASP OD1 1 1 8 5492 1 1 5 ASP OD2 O -1.640 1.664 -12.328 1.00 . A A . 7 ASP OD2 1 1 8 5493 1 1 6 CYS C C -7.594 2.802 -7.980 1.00 . A A . 8 CYS C 1 1 8 5494 1 1 6 CYS CA C -6.238 2.198 -7.605 1.00 . A A . 8 CYS CA 1 1 8 5495 1 1 6 CYS CB C -6.035 2.300 -6.089 1.00 . A A . 8 CYS CB 1 1 8 5496 1 1 6 CYS H H -5.143 3.923 -8.289 1.00 . A A . 8 CYS H 1 1 8 5497 1 1 6 CYS HA H -6.212 1.161 -7.904 1.00 . A A . 8 CYS HA 1 1 8 5498 1 1 6 CYS HB2 H -6.514 3.197 -5.723 1.00 . A A . 8 CYS HB2 1 1 8 5499 1 1 6 CYS HB3 H -6.478 1.438 -5.609 1.00 . A A . 8 CYS HB3 1 1 8 5500 1 1 6 CYS N N -5.161 2.943 -8.315 1.00 . A A . 8 CYS N 1 1 8 5501 1 1 6 CYS O O -8.486 2.893 -7.163 1.00 . A A . 8 CYS O 1 1 8 5502 1 1 6 CYS SG S -4.266 2.362 -5.701 1.00 . A A . 8 CYS SG 1 1 8 5503 1 1 7 SER C C -10.192 2.927 -9.211 1.00 . A A . 9 SER C 1 1 8 5504 1 1 7 SER CA C -9.036 3.818 -9.655 1.00 . A A . 9 SER CA 1 1 8 5505 1 1 7 SER CB C -9.044 3.943 -11.179 1.00 . A A . 9 SER CB 1 1 8 5506 1 1 7 SER H H -7.011 3.133 -9.843 1.00 . A A . 9 SER H 1 1 8 5507 1 1 7 SER HA H -9.147 4.798 -9.212 1.00 . A A . 9 SER HA 1 1 8 5508 1 1 7 SER HB2 H -8.103 4.345 -11.515 1.00 . A A . 9 SER HB2 1 1 8 5509 1 1 7 SER HB3 H -9.193 2.965 -11.617 1.00 . A A . 9 SER HB3 1 1 8 5510 1 1 7 SER HG H -9.866 5.705 -11.284 1.00 . A A . 9 SER HG 1 1 8 5511 1 1 7 SER N N -7.747 3.216 -9.210 1.00 . A A . 9 SER N 1 1 8 5512 1 1 7 SER O O -10.613 2.032 -9.918 1.00 . A A . 9 SER O 1 1 8 5513 1 1 7 SER OG O -10.094 4.818 -11.574 1.00 . A A . 9 SER OG 1 1 8 5514 1 1 8 GLU C C -11.343 0.895 -7.341 1.00 . A A . 10 GLU C 1 1 8 5515 1 1 8 GLU CA C -11.828 2.333 -7.530 1.00 . A A . 10 GLU CA 1 1 8 5516 1 1 8 GLU CB C -12.978 2.357 -8.543 1.00 . A A . 10 GLU CB 1 1 8 5517 1 1 8 GLU CD C -15.396 2.732 -8.032 1.00 . A A . 10 GLU CD 1 1 8 5518 1 1 8 GLU CG C -14.018 3.393 -8.114 1.00 . A A . 10 GLU CG 1 1 8 5519 1 1 8 GLU H H -10.335 3.885 -7.489 1.00 . A A . 10 GLU H 1 1 8 5520 1 1 8 GLU HA H -12.171 2.726 -6.584 1.00 . A A . 10 GLU HA 1 1 8 5521 1 1 8 GLU HB2 H -12.592 2.615 -9.517 1.00 . A A . 10 GLU HB2 1 1 8 5522 1 1 8 GLU HB3 H -13.439 1.382 -8.585 1.00 . A A . 10 GLU HB3 1 1 8 5523 1 1 8 GLU HG2 H -13.752 3.792 -7.147 1.00 . A A . 10 GLU HG2 1 1 8 5524 1 1 8 GLU HG3 H -14.049 4.193 -8.839 1.00 . A A . 10 GLU HG3 1 1 8 5525 1 1 8 GLU N N -10.702 3.163 -8.038 1.00 . A A . 10 GLU N 1 1 8 5526 1 1 8 GLU O O -11.785 -0.014 -8.016 1.00 . A A . 10 GLU O 1 1 8 5527 1 1 8 GLU OE1 O -15.448 1.551 -7.727 1.00 . A A . 10 GLU OE1 1 1 8 5528 1 1 8 GLU OE2 O -16.375 3.419 -8.274 1.00 . A A . 10 GLU OE2 1 1 8 5529 1 1 9 TYR C C -9.618 -0.924 -4.728 1.00 . A A . 11 TYR C 1 1 8 5530 1 1 9 TYR CA C -9.911 -0.701 -6.216 1.00 . A A . 11 TYR CA 1 1 8 5531 1 1 9 TYR CB C -8.627 -0.895 -7.021 1.00 . A A . 11 TYR CB 1 1 8 5532 1 1 9 TYR CD1 C -8.871 -3.290 -7.764 1.00 . A A . 11 TYR CD1 1 1 8 5533 1 1 9 TYR CD2 C -7.171 -2.744 -6.124 1.00 . A A . 11 TYR CD2 1 1 8 5534 1 1 9 TYR CE1 C -8.487 -4.636 -7.715 1.00 . A A . 11 TYR CE1 1 1 8 5535 1 1 9 TYR CE2 C -6.786 -4.089 -6.075 1.00 . A A . 11 TYR CE2 1 1 8 5536 1 1 9 TYR CG C -8.214 -2.345 -6.968 1.00 . A A . 11 TYR CG 1 1 8 5537 1 1 9 TYR CZ C -7.444 -5.035 -6.871 1.00 . A A . 11 TYR CZ 1 1 8 5538 1 1 9 TYR H H -10.077 1.426 -5.903 1.00 . A A . 11 TYR H 1 1 8 5539 1 1 9 TYR HA H -10.651 -1.416 -6.545 1.00 . A A . 11 TYR HA 1 1 8 5540 1 1 9 TYR HB2 H -8.798 -0.605 -8.048 1.00 . A A . 11 TYR HB2 1 1 8 5541 1 1 9 TYR HB3 H -7.843 -0.281 -6.601 1.00 . A A . 11 TYR HB3 1 1 8 5542 1 1 9 TYR HD1 H -9.674 -2.982 -8.416 1.00 . A A . 11 TYR HD1 1 1 8 5543 1 1 9 TYR HD2 H -6.664 -2.015 -5.510 1.00 . A A . 11 TYR HD2 1 1 8 5544 1 1 9 TYR HE1 H -8.994 -5.365 -8.328 1.00 . A A . 11 TYR HE1 1 1 8 5545 1 1 9 TYR HE2 H -5.981 -4.398 -5.424 1.00 . A A . 11 TYR HE2 1 1 8 5546 1 1 9 TYR HH H -6.122 -6.393 -6.643 1.00 . A A . 11 TYR HH 1 1 8 5547 1 1 9 TYR N N -10.428 0.680 -6.434 1.00 . A A . 11 TYR N 1 1 8 5548 1 1 9 TYR O O -8.479 -1.111 -4.346 1.00 . A A . 11 TYR O 1 1 8 5549 1 1 9 TYR OH O -7.064 -6.361 -6.824 1.00 . A A . 11 TYR OH 1 1 8 5550 1 1 10 PRO C C -10.332 -2.616 -2.194 1.00 . A A . 12 PRO C 1 1 8 5551 1 1 10 PRO CA C -10.551 -1.130 -2.485 1.00 . A A . 12 PRO CA 1 1 8 5552 1 1 10 PRO CB C -11.903 -0.653 -1.946 1.00 . A A . 12 PRO CB 1 1 8 5553 1 1 10 PRO CD C -12.036 -0.685 -4.415 1.00 . A A . 12 PRO CD 1 1 8 5554 1 1 10 PRO CG C -12.891 -0.717 -3.134 1.00 . A A . 12 PRO CG 1 1 8 5555 1 1 10 PRO HA H -9.754 -0.538 -2.066 1.00 . A A . 12 PRO HA 1 1 8 5556 1 1 10 PRO HB2 H -12.235 -1.303 -1.147 1.00 . A A . 12 PRO HB2 1 1 8 5557 1 1 10 PRO HB3 H -11.825 0.363 -1.594 1.00 . A A . 12 PRO HB3 1 1 8 5558 1 1 10 PRO HD2 H -12.339 -1.471 -5.091 1.00 . A A . 12 PRO HD2 1 1 8 5559 1 1 10 PRO HD3 H -12.107 0.280 -4.894 1.00 . A A . 12 PRO HD3 1 1 8 5560 1 1 10 PRO HG2 H -13.464 -1.634 -3.090 1.00 . A A . 12 PRO HG2 1 1 8 5561 1 1 10 PRO HG3 H -13.551 0.136 -3.115 1.00 . A A . 12 PRO HG3 1 1 8 5562 1 1 10 PRO N N -10.658 -0.914 -3.937 1.00 . A A . 12 PRO N 1 1 8 5563 1 1 10 PRO O O -11.079 -3.464 -2.642 1.00 . A A . 12 PRO O 1 1 8 5564 1 1 11 LYS C C -7.946 -4.462 -0.083 1.00 . A A . 13 LYS C 1 1 8 5565 1 1 11 LYS CA C -9.037 -4.369 -1.147 1.00 . A A . 13 LYS CA 1 1 8 5566 1 1 11 LYS CB C -8.576 -5.082 -2.417 1.00 . A A . 13 LYS CB 1 1 8 5567 1 1 11 LYS CD C -9.645 -6.250 -4.350 1.00 . A A . 13 LYS CD 1 1 8 5568 1 1 11 LYS CE C -10.608 -7.369 -4.752 1.00 . A A . 13 LYS CE 1 1 8 5569 1 1 11 LYS CG C -9.625 -6.113 -2.826 1.00 . A A . 13 LYS CG 1 1 8 5570 1 1 11 LYS H H -8.712 -2.243 -1.108 1.00 . A A . 13 LYS H 1 1 8 5571 1 1 11 LYS HA H -9.940 -4.835 -0.781 1.00 . A A . 13 LYS HA 1 1 8 5572 1 1 11 LYS HB2 H -8.451 -4.360 -3.212 1.00 . A A . 13 LYS HB2 1 1 8 5573 1 1 11 LYS HB3 H -7.636 -5.580 -2.231 1.00 . A A . 13 LYS HB3 1 1 8 5574 1 1 11 LYS HD2 H -9.972 -5.318 -4.790 1.00 . A A . 13 LYS HD2 1 1 8 5575 1 1 11 LYS HD3 H -8.653 -6.487 -4.705 1.00 . A A . 13 LYS HD3 1 1 8 5576 1 1 11 LYS HE2 H -11.540 -7.250 -4.219 1.00 . A A . 13 LYS HE2 1 1 8 5577 1 1 11 LYS HE3 H -10.794 -7.322 -5.814 1.00 . A A . 13 LYS HE3 1 1 8 5578 1 1 11 LYS HG2 H -9.382 -7.066 -2.381 1.00 . A A . 13 LYS HG2 1 1 8 5579 1 1 11 LYS HG3 H -10.595 -5.790 -2.483 1.00 . A A . 13 LYS HG3 1 1 8 5580 1 1 11 LYS HZ1 H -10.530 -9.445 -4.897 1.00 . A A . 13 LYS HZ1 1 1 8 5581 1 1 11 LYS HZ2 H -10.058 -8.838 -3.381 1.00 . A A . 13 LYS HZ2 1 1 8 5582 1 1 11 LYS HZ3 H -9.013 -8.707 -4.715 1.00 . A A . 13 LYS HZ3 1 1 8 5583 1 1 11 LYS N N -9.307 -2.940 -1.456 1.00 . A A . 13 LYS N 1 1 8 5584 1 1 11 LYS NZ N -10.007 -8.690 -4.410 1.00 . A A . 13 LYS NZ 1 1 8 5585 1 1 11 LYS O O -6.770 -4.376 -0.374 1.00 . A A . 13 LYS O 1 1 8 5586 1 1 12 CYS C C -7.281 -6.163 2.774 1.00 . A A . 14 CYS C 1 1 8 5587 1 1 12 CYS CA C -7.315 -4.731 2.238 1.00 . A A . 14 CYS CA 1 1 8 5588 1 1 12 CYS CB C -7.693 -3.769 3.363 1.00 . A A . 14 CYS CB 1 1 8 5589 1 1 12 CYS H H -9.282 -4.698 1.362 1.00 . A A . 14 CYS H 1 1 8 5590 1 1 12 CYS HA H -6.343 -4.469 1.849 1.00 . A A . 14 CYS HA 1 1 8 5591 1 1 12 CYS HB2 H -8.481 -4.203 3.960 1.00 . A A . 14 CYS HB2 1 1 8 5592 1 1 12 CYS HB3 H -6.830 -3.582 3.983 1.00 . A A . 14 CYS HB3 1 1 8 5593 1 1 12 CYS N N -8.327 -4.635 1.151 1.00 . A A . 14 CYS N 1 1 8 5594 1 1 12 CYS O O -7.257 -6.390 3.968 1.00 . A A . 14 CYS O 1 1 8 5595 1 1 12 CYS SG S -8.268 -2.211 2.643 1.00 . A A . 14 CYS SG 1 1 8 5596 1 1 13 ALA C C -6.435 -9.385 1.358 1.00 . A A . 15 ALA C 1 1 8 5597 1 1 13 ALA CA C -7.244 -8.549 2.355 1.00 . A A . 15 ALA CA 1 1 8 5598 1 1 13 ALA CB C -8.674 -9.089 2.435 1.00 . A A . 15 ALA CB 1 1 8 5599 1 1 13 ALA H H -7.297 -6.924 0.942 1.00 . A A . 15 ALA H 1 1 8 5600 1 1 13 ALA HA H -6.783 -8.604 3.330 1.00 . A A . 15 ALA HA 1 1 8 5601 1 1 13 ALA HB1 H -9.188 -8.626 3.265 1.00 . A A . 15 ALA HB1 1 1 8 5602 1 1 13 ALA HB2 H -8.649 -10.159 2.579 1.00 . A A . 15 ALA HB2 1 1 8 5603 1 1 13 ALA HB3 H -9.198 -8.862 1.517 1.00 . A A . 15 ALA HB3 1 1 8 5604 1 1 13 ALA N N -7.277 -7.131 1.900 1.00 . A A . 15 ALA N 1 1 8 5605 1 1 13 ALA O O -6.913 -10.369 0.828 1.00 . A A . 15 ALA O 1 1 8 5606 1 1 14 CYS C C -3.121 -10.286 0.850 1.00 . A A . 16 CYS C 1 1 8 5607 1 1 14 CYS CA C -4.374 -9.770 0.138 1.00 . A A . 16 CYS CA 1 1 8 5608 1 1 14 CYS CB C -3.953 -8.862 -1.020 1.00 . A A . 16 CYS CB 1 1 8 5609 1 1 14 CYS H H -4.849 -8.204 1.538 1.00 . A A . 16 CYS H 1 1 8 5610 1 1 14 CYS HA H -4.938 -10.606 -0.246 1.00 . A A . 16 CYS HA 1 1 8 5611 1 1 14 CYS HB2 H -3.419 -8.008 -0.632 1.00 . A A . 16 CYS HB2 1 1 8 5612 1 1 14 CYS HB3 H -3.312 -9.413 -1.692 1.00 . A A . 16 CYS HB3 1 1 8 5613 1 1 14 CYS N N -5.214 -9.000 1.100 1.00 . A A . 16 CYS N 1 1 8 5614 1 1 14 CYS O O -2.635 -9.683 1.788 1.00 . A A . 16 CYS O 1 1 8 5615 1 1 14 CYS SG S -5.421 -8.299 -1.912 1.00 . A A . 16 CYS SG 1 1 8 5616 1 1 15 THR C C -0.684 -12.928 0.105 1.00 . A A . 17 THR C 1 1 8 5617 1 1 15 THR CA C -1.371 -11.950 1.060 1.00 . A A . 17 THR CA 1 1 8 5618 1 1 15 THR CB C -1.765 -12.684 2.344 1.00 . A A . 17 THR CB 1 1 8 5619 1 1 15 THR CG2 C -2.628 -13.896 1.994 1.00 . A A . 17 THR CG2 1 1 8 5620 1 1 15 THR H H -2.999 -11.863 -0.349 1.00 . A A . 17 THR H 1 1 8 5621 1 1 15 THR HA H -0.692 -11.144 1.299 1.00 . A A . 17 THR HA 1 1 8 5622 1 1 15 THR HB H -2.328 -12.019 2.981 1.00 . A A . 17 THR HB 1 1 8 5623 1 1 15 THR HG1 H -0.172 -12.339 3.404 1.00 . A A . 17 THR HG1 1 1 8 5624 1 1 15 THR HG21 H -2.062 -14.801 2.163 1.00 . A A . 17 THR HG21 1 1 8 5625 1 1 15 THR HG22 H -2.921 -13.843 0.957 1.00 . A A . 17 THR HG22 1 1 8 5626 1 1 15 THR HG23 H -3.510 -13.903 2.618 1.00 . A A . 17 THR HG23 1 1 8 5627 1 1 15 THR N N -2.593 -11.396 0.412 1.00 . A A . 17 THR N 1 1 8 5628 1 1 15 THR O O 0.011 -13.834 0.522 1.00 . A A . 17 THR O 1 1 8 5629 1 1 15 THR OG1 O -0.593 -13.113 3.022 1.00 . A A . 17 THR OG1 1 1 8 5630 1 1 16 MET C C 0.935 -12.974 -2.835 1.00 . A A . 18 MET C 1 1 8 5631 1 1 16 MET CA C -0.234 -13.681 -2.152 1.00 . A A . 18 MET CA 1 1 8 5632 1 1 16 MET CB C -1.263 -14.104 -3.202 1.00 . A A . 18 MET CB 1 1 8 5633 1 1 16 MET CE C -5.053 -13.209 -3.062 1.00 . A A . 18 MET CE 1 1 8 5634 1 1 16 MET CG C -2.626 -14.301 -2.533 1.00 . A A . 18 MET CG 1 1 8 5635 1 1 16 MET H H -1.439 -12.022 -1.492 1.00 . A A . 18 MET H 1 1 8 5636 1 1 16 MET HA H 0.130 -14.552 -1.635 1.00 . A A . 18 MET HA 1 1 8 5637 1 1 16 MET HB2 H -1.341 -13.337 -3.960 1.00 . A A . 18 MET HB2 1 1 8 5638 1 1 16 MET HB3 H -0.952 -15.031 -3.660 1.00 . A A . 18 MET HB3 1 1 8 5639 1 1 16 MET HE1 H -5.533 -13.655 -2.201 1.00 . A A . 18 MET HE1 1 1 8 5640 1 1 16 MET HE2 H -5.803 -12.929 -3.784 1.00 . A A . 18 MET HE2 1 1 8 5641 1 1 16 MET HE3 H -4.504 -12.330 -2.758 1.00 . A A . 18 MET HE3 1 1 8 5642 1 1 16 MET HG2 H -2.615 -15.214 -1.956 1.00 . A A . 18 MET HG2 1 1 8 5643 1 1 16 MET HG3 H -2.830 -13.466 -1.881 1.00 . A A . 18 MET HG3 1 1 8 5644 1 1 16 MET N N -0.874 -12.757 -1.175 1.00 . A A . 18 MET N 1 1 8 5645 1 1 16 MET O O 2.067 -13.410 -2.766 1.00 . A A . 18 MET O 1 1 8 5646 1 1 16 MET SD S -3.913 -14.404 -3.801 1.00 . A A . 18 MET SD 1 1 8 5647 1 1 17 GLU C C 2.776 -10.661 -3.144 1.00 . A A . 19 GLU C 1 1 8 5648 1 1 17 GLU CA C 1.760 -11.143 -4.181 1.00 . A A . 19 GLU CA 1 1 8 5649 1 1 17 GLU CB C 1.173 -9.938 -4.920 1.00 . A A . 19 GLU CB 1 1 8 5650 1 1 17 GLU CD C 1.524 -10.192 -7.379 1.00 . A A . 19 GLU CD 1 1 8 5651 1 1 17 GLU CG C 2.077 -9.569 -6.096 1.00 . A A . 19 GLU CG 1 1 8 5652 1 1 17 GLU H H -0.253 -11.553 -3.534 1.00 . A A . 19 GLU H 1 1 8 5653 1 1 17 GLU HA H 2.249 -11.796 -4.889 1.00 . A A . 19 GLU HA 1 1 8 5654 1 1 17 GLU HB2 H 0.187 -10.187 -5.286 1.00 . A A . 19 GLU HB2 1 1 8 5655 1 1 17 GLU HB3 H 1.105 -9.100 -4.242 1.00 . A A . 19 GLU HB3 1 1 8 5656 1 1 17 GLU HG2 H 2.110 -8.494 -6.201 1.00 . A A . 19 GLU HG2 1 1 8 5657 1 1 17 GLU HG3 H 3.074 -9.944 -5.917 1.00 . A A . 19 GLU HG3 1 1 8 5658 1 1 17 GLU N N 0.667 -11.884 -3.494 1.00 . A A . 19 GLU N 1 1 8 5659 1 1 17 GLU O O 2.422 -10.292 -2.041 1.00 . A A . 19 GLU O 1 1 8 5660 1 1 17 GLU OE1 O 1.475 -11.409 -7.449 1.00 . A A . 19 GLU OE1 1 1 8 5661 1 1 17 GLU OE2 O 1.157 -9.442 -8.268 1.00 . A A . 19 GLU OE2 1 1 8 5662 1 1 18 TYR C C 5.616 -8.844 -2.938 1.00 . A A . 20 TYR C 1 1 8 5663 1 1 18 TYR CA C 5.067 -10.203 -2.507 1.00 . A A . 20 TYR CA 1 1 8 5664 1 1 18 TYR CB C 6.215 -11.209 -2.453 1.00 . A A . 20 TYR CB 1 1 8 5665 1 1 18 TYR CD1 C 7.652 -10.061 -0.730 1.00 . A A . 20 TYR CD1 1 1 8 5666 1 1 18 TYR CD2 C 6.678 -12.213 -0.187 1.00 . A A . 20 TYR CD2 1 1 8 5667 1 1 18 TYR CE1 C 8.255 -10.015 0.533 1.00 . A A . 20 TYR CE1 1 1 8 5668 1 1 18 TYR CE2 C 7.280 -12.167 1.075 1.00 . A A . 20 TYR CE2 1 1 8 5669 1 1 18 TYR CG C 6.863 -11.160 -1.091 1.00 . A A . 20 TYR CG 1 1 8 5670 1 1 18 TYR CZ C 8.069 -11.068 1.435 1.00 . A A . 20 TYR CZ 1 1 8 5671 1 1 18 TYR H H 4.305 -10.963 -4.376 1.00 . A A . 20 TYR H 1 1 8 5672 1 1 18 TYR HA H 4.622 -10.115 -1.527 1.00 . A A . 20 TYR HA 1 1 8 5673 1 1 18 TYR HB2 H 5.835 -12.203 -2.639 1.00 . A A . 20 TYR HB2 1 1 8 5674 1 1 18 TYR HB3 H 6.944 -10.954 -3.205 1.00 . A A . 20 TYR HB3 1 1 8 5675 1 1 18 TYR HD1 H 7.797 -9.249 -1.428 1.00 . A A . 20 TYR HD1 1 1 8 5676 1 1 18 TYR HD2 H 6.069 -13.061 -0.464 1.00 . A A . 20 TYR HD2 1 1 8 5677 1 1 18 TYR HE1 H 8.863 -9.168 0.810 1.00 . A A . 20 TYR HE1 1 1 8 5678 1 1 18 TYR HE2 H 7.136 -12.979 1.772 1.00 . A A . 20 TYR HE2 1 1 8 5679 1 1 18 TYR HH H 9.097 -10.173 2.772 1.00 . A A . 20 TYR HH 1 1 8 5680 1 1 18 TYR N N 4.037 -10.661 -3.482 1.00 . A A . 20 TYR N 1 1 8 5681 1 1 18 TYR O O 6.246 -8.714 -3.968 1.00 . A A . 20 TYR O 1 1 8 5682 1 1 18 TYR OH O 8.663 -11.024 2.680 1.00 . A A . 20 TYR OH 1 1 8 5683 1 1 19 ARG C C 5.823 -5.573 -1.269 1.00 . A A . 21 ARG C 1 1 8 5684 1 1 19 ARG CA C 5.891 -6.478 -2.503 1.00 . A A . 21 ARG CA 1 1 8 5685 1 1 19 ARG CB C 5.026 -5.880 -3.616 1.00 . A A . 21 ARG CB 1 1 8 5686 1 1 19 ARG CD C 5.137 -6.342 -6.068 1.00 . A A . 21 ARG CD 1 1 8 5687 1 1 19 ARG CG C 5.867 -5.710 -4.883 1.00 . A A . 21 ARG CG 1 1 8 5688 1 1 19 ARG CZ C 6.079 -8.459 -6.765 1.00 . A A . 21 ARG CZ 1 1 8 5689 1 1 19 ARG H H 4.882 -7.970 -1.326 1.00 . A A . 21 ARG H 1 1 8 5690 1 1 19 ARG HA H 6.914 -6.550 -2.841 1.00 . A A . 21 ARG HA 1 1 8 5691 1 1 19 ARG HB2 H 4.196 -6.540 -3.820 1.00 . A A . 21 ARG HB2 1 1 8 5692 1 1 19 ARG HB3 H 4.653 -4.917 -3.303 1.00 . A A . 21 ARG HB3 1 1 8 5693 1 1 19 ARG HD2 H 4.097 -6.057 -6.044 1.00 . A A . 21 ARG HD2 1 1 8 5694 1 1 19 ARG HD3 H 5.584 -6.000 -6.990 1.00 . A A . 21 ARG HD3 1 1 8 5695 1 1 19 ARG HE H 4.705 -8.321 -5.336 1.00 . A A . 21 ARG HE 1 1 8 5696 1 1 19 ARG HG2 H 6.022 -4.658 -5.074 1.00 . A A . 21 ARG HG2 1 1 8 5697 1 1 19 ARG HG3 H 6.822 -6.196 -4.749 1.00 . A A . 21 ARG HG3 1 1 8 5698 1 1 19 ARG HH11 H 7.647 -7.313 -6.281 1.00 . A A . 21 ARG HH11 1 1 8 5699 1 1 19 ARG HH12 H 7.963 -8.571 -7.429 1.00 . A A . 21 ARG HH12 1 1 8 5700 1 1 19 ARG HH21 H 4.704 -9.755 -7.428 1.00 . A A . 21 ARG HH21 1 1 8 5701 1 1 19 ARG HH22 H 6.297 -9.954 -8.077 1.00 . A A . 21 ARG HH22 1 1 8 5702 1 1 19 ARG N N 5.385 -7.835 -2.152 1.00 . A A . 21 ARG N 1 1 8 5703 1 1 19 ARG NE N 5.249 -7.825 -5.983 1.00 . A A . 21 ARG NE 1 1 8 5704 1 1 19 ARG NH1 N 7.327 -8.086 -6.829 1.00 . A A . 21 ARG NH1 1 1 8 5705 1 1 19 ARG NH2 N 5.661 -9.468 -7.479 1.00 . A A . 21 ARG NH2 1 1 8 5706 1 1 19 ARG O O 4.842 -4.886 -1.060 1.00 . A A . 21 ARG O 1 1 8 5707 1 1 20 PRO C C 7.294 -3.335 0.382 1.00 . A A . 22 PRO C 1 1 8 5708 1 1 20 PRO CA C 6.969 -4.790 0.738 1.00 . A A . 22 PRO CA 1 1 8 5709 1 1 20 PRO CB C 8.124 -5.439 1.506 1.00 . A A . 22 PRO CB 1 1 8 5710 1 1 20 PRO CD C 8.058 -6.441 -0.756 1.00 . A A . 22 PRO CD 1 1 8 5711 1 1 20 PRO CG C 8.974 -6.196 0.458 1.00 . A A . 22 PRO CG 1 1 8 5712 1 1 20 PRO HA H 6.061 -4.853 1.312 1.00 . A A . 22 PRO HA 1 1 8 5713 1 1 20 PRO HB2 H 8.719 -4.678 1.993 1.00 . A A . 22 PRO HB2 1 1 8 5714 1 1 20 PRO HB3 H 7.741 -6.135 2.235 1.00 . A A . 22 PRO HB3 1 1 8 5715 1 1 20 PRO HD2 H 8.548 -6.131 -1.668 1.00 . A A . 22 PRO HD2 1 1 8 5716 1 1 20 PRO HD3 H 7.772 -7.479 -0.811 1.00 . A A . 22 PRO HD3 1 1 8 5717 1 1 20 PRO HG2 H 9.825 -5.594 0.168 1.00 . A A . 22 PRO HG2 1 1 8 5718 1 1 20 PRO HG3 H 9.305 -7.141 0.861 1.00 . A A . 22 PRO HG3 1 1 8 5719 1 1 20 PRO N N 6.872 -5.601 -0.488 1.00 . A A . 22 PRO N 1 1 8 5720 1 1 20 PRO O O 8.440 -2.969 0.214 1.00 . A A . 22 PRO O 1 1 8 5721 1 1 21 LEU C C 6.567 -0.219 1.169 1.00 . A A . 23 LEU C 1 1 8 5722 1 1 21 LEU CA C 6.559 -1.077 -0.093 1.00 . A A . 23 LEU CA 1 1 8 5723 1 1 21 LEU CB C 5.461 -0.556 -1.030 1.00 . A A . 23 LEU CB 1 1 8 5724 1 1 21 LEU CD1 C 4.245 -0.992 -3.168 1.00 . A A . 23 LEU CD1 1 1 8 5725 1 1 21 LEU CD2 C 6.407 -2.156 -2.714 1.00 . A A . 23 LEU CD2 1 1 8 5726 1 1 21 LEU CG C 5.122 -1.617 -2.081 1.00 . A A . 23 LEU CG 1 1 8 5727 1 1 21 LEU H H 5.374 -2.814 0.396 1.00 . A A . 23 LEU H 1 1 8 5728 1 1 21 LEU HA H 7.516 -0.999 -0.582 1.00 . A A . 23 LEU HA 1 1 8 5729 1 1 21 LEU HB2 H 4.576 -0.334 -0.450 1.00 . A A . 23 LEU HB2 1 1 8 5730 1 1 21 LEU HB3 H 5.802 0.348 -1.522 1.00 . A A . 23 LEU HB3 1 1 8 5731 1 1 21 LEU HD11 H 4.042 0.039 -2.916 1.00 . A A . 23 LEU HD11 1 1 8 5732 1 1 21 LEU HD12 H 3.314 -1.534 -3.237 1.00 . A A . 23 LEU HD12 1 1 8 5733 1 1 21 LEU HD13 H 4.760 -1.036 -4.116 1.00 . A A . 23 LEU HD13 1 1 8 5734 1 1 21 LEU HD21 H 6.388 -1.973 -3.778 1.00 . A A . 23 LEU HD21 1 1 8 5735 1 1 21 LEU HD22 H 6.481 -3.218 -2.532 1.00 . A A . 23 LEU HD22 1 1 8 5736 1 1 21 LEU HD23 H 7.261 -1.657 -2.280 1.00 . A A . 23 LEU HD23 1 1 8 5737 1 1 21 LEU HG H 4.583 -2.429 -1.610 1.00 . A A . 23 LEU HG 1 1 8 5738 1 1 21 LEU N N 6.295 -2.502 0.260 1.00 . A A . 23 LEU N 1 1 8 5739 1 1 21 LEU O O 5.676 -0.298 1.992 1.00 . A A . 23 LEU O 1 1 8 5740 1 1 22 CYS C C 6.832 2.782 2.163 1.00 . A A . 24 CYS C 1 1 8 5741 1 1 22 CYS CA C 7.590 1.505 2.511 1.00 . A A . 24 CYS CA 1 1 8 5742 1 1 22 CYS CB C 9.040 1.847 2.861 1.00 . A A . 24 CYS CB 1 1 8 5743 1 1 22 CYS H H 8.253 0.689 0.633 1.00 . A A . 24 CYS H 1 1 8 5744 1 1 22 CYS HA H 7.116 1.012 3.346 1.00 . A A . 24 CYS HA 1 1 8 5745 1 1 22 CYS HB2 H 9.640 1.842 1.963 1.00 . A A . 24 CYS HB2 1 1 8 5746 1 1 22 CYS HB3 H 9.079 2.825 3.316 1.00 . A A . 24 CYS HB3 1 1 8 5747 1 1 22 CYS N N 7.552 0.623 1.317 1.00 . A A . 24 CYS N 1 1 8 5748 1 1 22 CYS O O 7.413 3.759 1.747 1.00 . A A . 24 CYS O 1 1 8 5749 1 1 22 CYS SG S 9.685 0.620 4.023 1.00 . A A . 24 CYS SG 1 1 8 5750 1 1 23 GLY C C 5.328 5.225 2.554 1.00 . A A . 25 GLY C 1 1 8 5751 1 1 23 GLY CA C 4.716 3.963 1.946 1.00 . A A . 25 GLY CA 1 1 8 5752 1 1 23 GLY H H 5.086 1.951 2.613 1.00 . A A . 25 GLY H 1 1 8 5753 1 1 23 GLY HA2 H 4.682 4.066 0.872 1.00 . A A . 25 GLY HA2 1 1 8 5754 1 1 23 GLY HA3 H 3.714 3.837 2.325 1.00 . A A . 25 GLY HA3 1 1 8 5755 1 1 23 GLY N N 5.531 2.764 2.297 1.00 . A A . 25 GLY N 1 1 8 5756 1 1 23 GLY O O 5.986 5.182 3.575 1.00 . A A . 25 GLY O 1 1 8 5757 1 1 24 SER C C 5.283 7.818 3.920 1.00 . A A . 26 SER C 1 1 8 5758 1 1 24 SER CA C 5.644 7.644 2.440 1.00 . A A . 26 SER CA 1 1 8 5759 1 1 24 SER CB C 5.047 8.798 1.634 1.00 . A A . 26 SER CB 1 1 8 5760 1 1 24 SER H H 4.560 6.345 1.105 1.00 . A A . 26 SER H 1 1 8 5761 1 1 24 SER HA H 6.717 7.654 2.331 1.00 . A A . 26 SER HA 1 1 8 5762 1 1 24 SER HB2 H 5.086 8.563 0.584 1.00 . A A . 26 SER HB2 1 1 8 5763 1 1 24 SER HB3 H 4.017 8.945 1.930 1.00 . A A . 26 SER HB3 1 1 8 5764 1 1 24 SER HG H 5.804 10.498 1.068 1.00 . A A . 26 SER HG 1 1 8 5765 1 1 24 SER N N 5.099 6.351 1.925 1.00 . A A . 26 SER N 1 1 8 5766 1 1 24 SER O O 5.881 8.611 4.620 1.00 . A A . 26 SER O 1 1 8 5767 1 1 24 SER OG O 5.798 9.980 1.877 1.00 . A A . 26 SER OG 1 1 8 5768 1 1 25 ASP C C 4.798 6.297 6.696 1.00 . A A . 27 ASP C 1 1 8 5769 1 1 25 ASP CA C 3.926 7.218 5.839 1.00 . A A . 27 ASP CA 1 1 8 5770 1 1 25 ASP CB C 2.458 6.826 6.003 1.00 . A A . 27 ASP CB 1 1 8 5771 1 1 25 ASP CG C 2.256 5.389 5.522 1.00 . A A . 27 ASP CG 1 1 8 5772 1 1 25 ASP H H 3.844 6.454 3.827 1.00 . A A . 27 ASP H 1 1 8 5773 1 1 25 ASP HA H 4.063 8.242 6.155 1.00 . A A . 27 ASP HA 1 1 8 5774 1 1 25 ASP HB2 H 2.178 6.902 7.043 1.00 . A A . 27 ASP HB2 1 1 8 5775 1 1 25 ASP HB3 H 1.844 7.490 5.415 1.00 . A A . 27 ASP HB3 1 1 8 5776 1 1 25 ASP N N 4.315 7.088 4.405 1.00 . A A . 27 ASP N 1 1 8 5777 1 1 25 ASP O O 4.426 5.908 7.785 1.00 . A A . 27 ASP O 1 1 8 5778 1 1 25 ASP OD1 O 3.230 4.783 5.107 1.00 . A A . 27 ASP OD1 1 1 8 5779 1 1 25 ASP OD2 O 1.131 4.921 5.575 1.00 . A A . 27 ASP OD2 1 1 8 5780 1 1 26 ASN C C 6.125 3.742 7.303 1.00 . A A . 28 ASN C 1 1 8 5781 1 1 26 ASN CA C 6.855 5.048 6.993 1.00 . A A . 28 ASN CA 1 1 8 5782 1 1 26 ASN CB C 7.251 5.734 8.302 1.00 . A A . 28 ASN CB 1 1 8 5783 1 1 26 ASN CG C 8.357 4.928 8.989 1.00 . A A . 28 ASN CG 1 1 8 5784 1 1 26 ASN H H 6.236 6.267 5.333 1.00 . A A . 28 ASN H 1 1 8 5785 1 1 26 ASN HA H 7.742 4.835 6.416 1.00 . A A . 28 ASN HA 1 1 8 5786 1 1 26 ASN HB2 H 7.609 6.732 8.092 1.00 . A A . 28 ASN HB2 1 1 8 5787 1 1 26 ASN HB3 H 6.392 5.789 8.954 1.00 . A A . 28 ASN HB3 1 1 8 5788 1 1 26 ASN HD21 H 9.762 5.485 7.701 1.00 . A A . 28 ASN HD21 1 1 8 5789 1 1 26 ASN HD22 H 10.282 4.440 8.933 1.00 . A A . 28 ASN HD22 1 1 8 5790 1 1 26 ASN N N 5.957 5.944 6.212 1.00 . A A . 28 ASN N 1 1 8 5791 1 1 26 ASN ND2 N 9.568 4.952 8.500 1.00 . A A . 28 ASN ND2 1 1 8 5792 1 1 26 ASN O O 6.297 3.156 8.354 1.00 . A A . 28 ASN O 1 1 8 5793 1 1 26 ASN OD1 O 8.116 4.266 9.980 1.00 . A A . 28 ASN OD1 1 1 8 5794 1 1 27 LYS C C 5.018 0.953 5.632 1.00 . A A . 29 LYS C 1 1 8 5795 1 1 27 LYS CA C 4.571 2.007 6.643 1.00 . A A . 29 LYS CA 1 1 8 5796 1 1 27 LYS CB C 3.067 2.252 6.499 1.00 . A A . 29 LYS CB 1 1 8 5797 1 1 27 LYS CD C 0.927 1.070 7.021 1.00 . A A . 29 LYS CD 1 1 8 5798 1 1 27 LYS CE C 0.393 -0.151 7.773 1.00 . A A . 29 LYS CE 1 1 8 5799 1 1 27 LYS CG C 2.316 1.431 7.549 1.00 . A A . 29 LYS CG 1 1 8 5800 1 1 27 LYS H H 5.185 3.766 5.550 1.00 . A A . 29 LYS H 1 1 8 5801 1 1 27 LYS HA H 4.783 1.659 7.640 1.00 . A A . 29 LYS HA 1 1 8 5802 1 1 27 LYS HB2 H 2.858 3.302 6.644 1.00 . A A . 29 LYS HB2 1 1 8 5803 1 1 27 LYS HB3 H 2.745 1.953 5.513 1.00 . A A . 29 LYS HB3 1 1 8 5804 1 1 27 LYS HD2 H 0.258 1.906 7.170 1.00 . A A . 29 LYS HD2 1 1 8 5805 1 1 27 LYS HD3 H 0.991 0.843 5.967 1.00 . A A . 29 LYS HD3 1 1 8 5806 1 1 27 LYS HE2 H 0.138 -0.925 7.066 1.00 . A A . 29 LYS HE2 1 1 8 5807 1 1 27 LYS HE3 H 1.151 -0.516 8.450 1.00 . A A . 29 LYS HE3 1 1 8 5808 1 1 27 LYS HG2 H 2.869 0.526 7.758 1.00 . A A . 29 LYS HG2 1 1 8 5809 1 1 27 LYS HG3 H 2.215 2.010 8.455 1.00 . A A . 29 LYS HG3 1 1 8 5810 1 1 27 LYS HZ1 H -1.524 -0.529 8.492 1.00 . A A . 29 LYS HZ1 1 1 8 5811 1 1 27 LYS HZ2 H -1.221 1.108 8.150 1.00 . A A . 29 LYS HZ2 1 1 8 5812 1 1 27 LYS HZ3 H -0.561 0.392 9.542 1.00 . A A . 29 LYS HZ3 1 1 8 5813 1 1 27 LYS N N 5.310 3.278 6.395 1.00 . A A . 29 LYS N 1 1 8 5814 1 1 27 LYS NZ N -0.820 0.234 8.548 1.00 . A A . 29 LYS NZ 1 1 8 5815 1 1 27 LYS O O 5.428 1.267 4.537 1.00 . A A . 29 LYS O 1 1 8 5816 1 1 28 THR C C 4.152 -2.214 4.656 1.00 . A A . 30 THR C 1 1 8 5817 1 1 28 THR CA C 5.367 -1.367 5.039 1.00 . A A . 30 THR CA 1 1 8 5818 1 1 28 THR CB C 6.420 -2.261 5.700 1.00 . A A . 30 THR CB 1 1 8 5819 1 1 28 THR CG2 C 6.728 -3.448 4.785 1.00 . A A . 30 THR CG2 1 1 8 5820 1 1 28 THR H H 4.610 -0.539 6.879 1.00 . A A . 30 THR H 1 1 8 5821 1 1 28 THR HA H 5.784 -0.915 4.151 1.00 . A A . 30 THR HA 1 1 8 5822 1 1 28 THR HB H 6.043 -2.627 6.642 1.00 . A A . 30 THR HB 1 1 8 5823 1 1 28 THR HG1 H 7.938 -1.731 6.793 1.00 . A A . 30 THR HG1 1 1 8 5824 1 1 28 THR HG21 H 7.374 -4.143 5.300 1.00 . A A . 30 THR HG21 1 1 8 5825 1 1 28 THR HG22 H 7.220 -3.095 3.889 1.00 . A A . 30 THR HG22 1 1 8 5826 1 1 28 THR HG23 H 5.807 -3.945 4.516 1.00 . A A . 30 THR HG23 1 1 8 5827 1 1 28 THR N N 4.944 -0.300 5.989 1.00 . A A . 30 THR N 1 1 8 5828 1 1 28 THR O O 3.604 -2.932 5.466 1.00 . A A . 30 THR O 1 1 8 5829 1 1 28 THR OG1 O 7.606 -1.510 5.921 1.00 . A A . 30 THR OG1 1 1 8 5830 1 1 29 TYR C C 3.017 -4.294 2.492 1.00 . A A . 31 TYR C 1 1 8 5831 1 1 29 TYR CA C 2.552 -2.926 2.992 1.00 . A A . 31 TYR CA 1 1 8 5832 1 1 29 TYR CB C 1.842 -2.174 1.871 1.00 . A A . 31 TYR CB 1 1 8 5833 1 1 29 TYR CD1 C 0.166 -0.850 3.208 1.00 . A A . 31 TYR CD1 1 1 8 5834 1 1 29 TYR CD2 C 1.973 0.331 2.107 1.00 . A A . 31 TYR CD2 1 1 8 5835 1 1 29 TYR CE1 C -0.323 0.363 3.708 1.00 . A A . 31 TYR CE1 1 1 8 5836 1 1 29 TYR CE2 C 1.486 1.545 2.607 1.00 . A A . 31 TYR CE2 1 1 8 5837 1 1 29 TYR CG C 1.313 -0.866 2.407 1.00 . A A . 31 TYR CG 1 1 8 5838 1 1 29 TYR CZ C 0.339 1.561 3.409 1.00 . A A . 31 TYR CZ 1 1 8 5839 1 1 29 TYR H H 4.179 -1.548 2.785 1.00 . A A . 31 TYR H 1 1 8 5840 1 1 29 TYR HA H 1.876 -3.057 3.824 1.00 . A A . 31 TYR HA 1 1 8 5841 1 1 29 TYR HB2 H 2.540 -1.980 1.070 1.00 . A A . 31 TYR HB2 1 1 8 5842 1 1 29 TYR HB3 H 1.027 -2.767 1.499 1.00 . A A . 31 TYR HB3 1 1 8 5843 1 1 29 TYR HD1 H -0.344 -1.774 3.440 1.00 . A A . 31 TYR HD1 1 1 8 5844 1 1 29 TYR HD2 H 2.859 0.318 1.488 1.00 . A A . 31 TYR HD2 1 1 8 5845 1 1 29 TYR HE1 H -1.208 0.374 4.327 1.00 . A A . 31 TYR HE1 1 1 8 5846 1 1 29 TYR HE2 H 1.996 2.466 2.375 1.00 . A A . 31 TYR HE2 1 1 8 5847 1 1 29 TYR HH H -0.202 2.679 4.859 1.00 . A A . 31 TYR HH 1 1 8 5848 1 1 29 TYR N N 3.727 -2.133 3.426 1.00 . A A . 31 TYR N 1 1 8 5849 1 1 29 TYR O O 4.039 -4.416 1.844 1.00 . A A . 31 TYR O 1 1 8 5850 1 1 29 TYR OH O -0.141 2.756 3.904 1.00 . A A . 31 TYR OH 1 1 8 5851 1 1 30 GLY C C 2.712 -6.772 0.835 1.00 . A A . 32 GLY C 1 1 8 5852 1 1 30 GLY CA C 2.675 -6.694 2.363 1.00 . A A . 32 GLY CA 1 1 8 5853 1 1 30 GLY H H 1.464 -5.200 3.332 1.00 . A A . 32 GLY H 1 1 8 5854 1 1 30 GLY HA2 H 3.654 -6.925 2.756 1.00 . A A . 32 GLY HA2 1 1 8 5855 1 1 30 GLY HA3 H 1.961 -7.411 2.738 1.00 . A A . 32 GLY HA3 1 1 8 5856 1 1 30 GLY N N 2.278 -5.325 2.801 1.00 . A A . 32 GLY N 1 1 8 5857 1 1 30 GLY O O 3.443 -7.558 0.266 1.00 . A A . 32 GLY O 1 1 8 5858 1 1 31 ASN C C 1.181 -4.809 -1.880 1.00 . A A . 33 ASN C 1 1 8 5859 1 1 31 ASN CA C 1.932 -6.019 -1.324 1.00 . A A . 33 ASN CA 1 1 8 5860 1 1 31 ASN CB C 1.245 -7.303 -1.794 1.00 . A A . 33 ASN CB 1 1 8 5861 1 1 31 ASN CG C -0.047 -7.510 -1.003 1.00 . A A . 33 ASN CG 1 1 8 5862 1 1 31 ASN H H 1.344 -5.345 0.631 1.00 . A A . 33 ASN H 1 1 8 5863 1 1 31 ASN HA H 2.949 -6.006 -1.683 1.00 . A A . 33 ASN HA 1 1 8 5864 1 1 31 ASN HB2 H 1.015 -7.224 -2.847 1.00 . A A . 33 ASN HB2 1 1 8 5865 1 1 31 ASN HB3 H 1.903 -8.144 -1.631 1.00 . A A . 33 ASN HB3 1 1 8 5866 1 1 31 ASN HD21 H 0.315 -9.427 -0.639 1.00 . A A . 33 ASN HD21 1 1 8 5867 1 1 31 ASN HD22 H -1.137 -8.828 0.005 1.00 . A A . 33 ASN HD22 1 1 8 5868 1 1 31 ASN N N 1.931 -5.971 0.163 1.00 . A A . 33 ASN N 1 1 8 5869 1 1 31 ASN ND2 N -0.312 -8.687 -0.504 1.00 . A A . 33 ASN ND2 1 1 8 5870 1 1 31 ASN O O 0.569 -4.051 -1.155 1.00 . A A . 33 ASN O 1 1 8 5871 1 1 31 ASN OD1 O -0.823 -6.590 -0.836 1.00 . A A . 33 ASN OD1 1 1 8 5872 1 1 32 LYS C C -0.966 -3.566 -3.541 1.00 . A A . 34 LYS C 1 1 8 5873 1 1 32 LYS CA C 0.538 -3.475 -3.801 1.00 . A A . 34 LYS CA 1 1 8 5874 1 1 32 LYS CB C 0.800 -3.486 -5.308 1.00 . A A . 34 LYS CB 1 1 8 5875 1 1 32 LYS CD C -0.464 -1.976 -6.848 1.00 . A A . 34 LYS CD 1 1 8 5876 1 1 32 LYS CE C -0.349 -3.110 -7.866 1.00 . A A . 34 LYS CE 1 1 8 5877 1 1 32 LYS CG C 0.697 -2.061 -5.855 1.00 . A A . 34 LYS CG 1 1 8 5878 1 1 32 LYS H H 1.737 -5.248 -3.721 1.00 . A A . 34 LYS H 1 1 8 5879 1 1 32 LYS HA H 0.915 -2.557 -3.378 1.00 . A A . 34 LYS HA 1 1 8 5880 1 1 32 LYS HB2 H 1.792 -3.873 -5.497 1.00 . A A . 34 LYS HB2 1 1 8 5881 1 1 32 LYS HB3 H 0.069 -4.112 -5.796 1.00 . A A . 34 LYS HB3 1 1 8 5882 1 1 32 LYS HD2 H -1.400 -2.063 -6.314 1.00 . A A . 34 LYS HD2 1 1 8 5883 1 1 32 LYS HD3 H -0.429 -1.027 -7.361 1.00 . A A . 34 LYS HD3 1 1 8 5884 1 1 32 LYS HE2 H 0.514 -3.717 -7.633 1.00 . A A . 34 LYS HE2 1 1 8 5885 1 1 32 LYS HE3 H -1.238 -3.720 -7.827 1.00 . A A . 34 LYS HE3 1 1 8 5886 1 1 32 LYS HG2 H 0.524 -1.375 -5.037 1.00 . A A . 34 LYS HG2 1 1 8 5887 1 1 32 LYS HG3 H 1.617 -1.799 -6.355 1.00 . A A . 34 LYS HG3 1 1 8 5888 1 1 32 LYS HZ1 H -1.116 -2.177 -9.563 1.00 . A A . 34 LYS HZ1 1 1 8 5889 1 1 32 LYS HZ2 H 0.136 -3.279 -9.885 1.00 . A A . 34 LYS HZ2 1 1 8 5890 1 1 32 LYS HZ3 H 0.490 -1.759 -9.213 1.00 . A A . 34 LYS HZ3 1 1 8 5891 1 1 32 LYS N N 1.233 -4.627 -3.168 1.00 . A A . 34 LYS N 1 1 8 5892 1 1 32 LYS NZ N -0.199 -2.538 -9.235 1.00 . A A . 34 LYS NZ 1 1 8 5893 1 1 32 LYS O O -1.696 -2.625 -3.771 1.00 . A A . 34 LYS O 1 1 8 5894 1 1 33 CYS C C -3.192 -4.006 -1.489 1.00 . A A . 35 CYS C 1 1 8 5895 1 1 33 CYS CA C -2.901 -4.780 -2.772 1.00 . A A . 35 CYS CA 1 1 8 5896 1 1 33 CYS CB C -3.300 -6.243 -2.589 1.00 . A A . 35 CYS CB 1 1 8 5897 1 1 33 CYS H H -0.847 -5.431 -2.859 1.00 . A A . 35 CYS H 1 1 8 5898 1 1 33 CYS HA H -3.458 -4.349 -3.591 1.00 . A A . 35 CYS HA 1 1 8 5899 1 1 33 CYS HB2 H -3.082 -6.794 -3.494 1.00 . A A . 35 CYS HB2 1 1 8 5900 1 1 33 CYS HB3 H -2.744 -6.668 -1.768 1.00 . A A . 35 CYS HB3 1 1 8 5901 1 1 33 CYS N N -1.443 -4.678 -3.052 1.00 . A A . 35 CYS N 1 1 8 5902 1 1 33 CYS O O -4.230 -3.391 -1.336 1.00 . A A . 35 CYS O 1 1 8 5903 1 1 33 CYS SG S -5.074 -6.336 -2.236 1.00 . A A . 35 CYS SG 1 1 8 5904 1 1 34 ASN C C -2.072 -1.816 0.465 1.00 . A A . 36 ASN C 1 1 8 5905 1 1 34 ASN CA C -2.453 -3.278 0.697 1.00 . A A . 36 ASN CA 1 1 8 5906 1 1 34 ASN CB C -1.549 -3.886 1.770 1.00 . A A . 36 ASN CB 1 1 8 5907 1 1 34 ASN CG C -2.347 -4.091 3.057 1.00 . A A . 36 ASN CG 1 1 8 5908 1 1 34 ASN H H -1.431 -4.508 -0.729 1.00 . A A . 36 ASN H 1 1 8 5909 1 1 34 ASN HA H -3.485 -3.342 1.009 1.00 . A A . 36 ASN HA 1 1 8 5910 1 1 34 ASN HB2 H -1.172 -4.839 1.424 1.00 . A A . 36 ASN HB2 1 1 8 5911 1 1 34 ASN HB3 H -0.722 -3.222 1.960 1.00 . A A . 36 ASN HB3 1 1 8 5912 1 1 34 ASN HD21 H -3.282 -5.707 2.383 1.00 . A A . 36 ASN HD21 1 1 8 5913 1 1 34 ASN HD22 H -3.696 -5.234 3.959 1.00 . A A . 36 ASN HD22 1 1 8 5914 1 1 34 ASN N N -2.264 -4.019 -0.573 1.00 . A A . 36 ASN N 1 1 8 5915 1 1 34 ASN ND2 N -3.176 -5.095 3.141 1.00 . A A . 36 ASN ND2 1 1 8 5916 1 1 34 ASN O O -2.526 -0.924 1.153 1.00 . A A . 36 ASN O 1 1 8 5917 1 1 34 ASN OD1 O -2.214 -3.332 3.996 1.00 . A A . 36 ASN OD1 1 1 8 5918 1 1 35 PHE C C -1.979 0.541 -1.526 1.00 . A A . 37 PHE C 1 1 8 5919 1 1 35 PHE CA C -0.829 -0.173 -0.814 1.00 . A A . 37 PHE CA 1 1 8 5920 1 1 35 PHE CB C 0.404 -0.188 -1.723 1.00 . A A . 37 PHE CB 1 1 8 5921 1 1 35 PHE CD1 C 1.770 1.783 -0.921 1.00 . A A . 37 PHE CD1 1 1 8 5922 1 1 35 PHE CD2 C 0.542 1.981 -3.004 1.00 . A A . 37 PHE CD2 1 1 8 5923 1 1 35 PHE CE1 C 2.242 3.095 -1.074 1.00 . A A . 37 PHE CE1 1 1 8 5924 1 1 35 PHE CE2 C 1.012 3.292 -3.156 1.00 . A A . 37 PHE CE2 1 1 8 5925 1 1 35 PHE CG C 0.920 1.225 -1.886 1.00 . A A . 37 PHE CG 1 1 8 5926 1 1 35 PHE CZ C 1.862 3.848 -2.193 1.00 . A A . 37 PHE CZ 1 1 8 5927 1 1 35 PHE H H -0.899 -2.307 -1.058 1.00 . A A . 37 PHE H 1 1 8 5928 1 1 35 PHE HA H -0.599 0.342 0.107 1.00 . A A . 37 PHE HA 1 1 8 5929 1 1 35 PHE HB2 H 1.172 -0.811 -1.284 1.00 . A A . 37 PHE HB2 1 1 8 5930 1 1 35 PHE HB3 H 0.132 -0.586 -2.690 1.00 . A A . 37 PHE HB3 1 1 8 5931 1 1 35 PHE HD1 H 2.063 1.201 -0.061 1.00 . A A . 37 PHE HD1 1 1 8 5932 1 1 35 PHE HD2 H -0.113 1.553 -3.748 1.00 . A A . 37 PHE HD2 1 1 8 5933 1 1 35 PHE HE1 H 2.898 3.528 -0.330 1.00 . A A . 37 PHE HE1 1 1 8 5934 1 1 35 PHE HE2 H 0.719 3.873 -4.019 1.00 . A A . 37 PHE HE2 1 1 8 5935 1 1 35 PHE HZ H 2.223 4.859 -2.312 1.00 . A A . 37 PHE HZ 1 1 8 5936 1 1 35 PHE N N -1.243 -1.570 -0.514 1.00 . A A . 37 PHE N 1 1 8 5937 1 1 35 PHE O O -2.284 1.683 -1.246 1.00 . A A . 37 PHE O 1 1 8 5938 1 1 36 CYS C C -4.953 0.596 -2.209 1.00 . A A . 38 CYS C 1 1 8 5939 1 1 36 CYS CA C -3.764 0.495 -3.163 1.00 . A A . 38 CYS CA 1 1 8 5940 1 1 36 CYS CB C -4.152 -0.366 -4.370 1.00 . A A . 38 CYS CB 1 1 8 5941 1 1 36 CYS H H -2.367 -1.053 -2.638 1.00 . A A . 38 CYS H 1 1 8 5942 1 1 36 CYS HA H -3.480 1.483 -3.495 1.00 . A A . 38 CYS HA 1 1 8 5943 1 1 36 CYS HB2 H -3.666 -1.327 -4.296 1.00 . A A . 38 CYS HB2 1 1 8 5944 1 1 36 CYS HB3 H -5.222 -0.505 -4.381 1.00 . A A . 38 CYS HB3 1 1 8 5945 1 1 36 CYS N N -2.626 -0.133 -2.438 1.00 . A A . 38 CYS N 1 1 8 5946 1 1 36 CYS O O -5.833 1.415 -2.382 1.00 . A A . 38 CYS O 1 1 8 5947 1 1 36 CYS SG S -3.634 0.453 -5.903 1.00 . A A . 38 CYS SG 1 1 8 5948 1 1 37 CYS C C -5.896 1.057 0.676 1.00 . A A . 39 CYS C 1 1 8 5949 1 1 37 CYS CA C -6.103 -0.169 -0.219 1.00 . A A . 39 CYS CA 1 1 8 5950 1 1 37 CYS CB C -6.127 -1.476 0.610 1.00 . A A . 39 CYS CB 1 1 8 5951 1 1 37 CYS H H -4.253 -0.874 -1.069 1.00 . A A . 39 CYS H 1 1 8 5952 1 1 37 CYS HA H -7.032 -0.064 -0.754 1.00 . A A . 39 CYS HA 1 1 8 5953 1 1 37 CYS HB2 H -6.852 -2.153 0.181 1.00 . A A . 39 CYS HB2 1 1 8 5954 1 1 37 CYS HB3 H -5.150 -1.937 0.571 1.00 . A A . 39 CYS HB3 1 1 8 5955 1 1 37 CYS N N -4.979 -0.226 -1.193 1.00 . A A . 39 CYS N 1 1 8 5956 1 1 37 CYS O O -6.808 1.817 0.931 1.00 . A A . 39 CYS O 1 1 8 5957 1 1 37 CYS SG S -6.572 -1.156 2.345 1.00 . A A . 39 CYS SG 1 1 8 5958 1 1 38 ALA C C -4.554 3.702 1.169 1.00 . A A . 40 ALA C 1 1 8 5959 1 1 38 ALA CA C -4.425 2.434 2.009 1.00 . A A . 40 ALA CA 1 1 8 5960 1 1 38 ALA CB C -3.009 2.335 2.579 1.00 . A A . 40 ALA CB 1 1 8 5961 1 1 38 ALA H H -3.974 0.636 0.915 1.00 . A A . 40 ALA H 1 1 8 5962 1 1 38 ALA HA H -5.140 2.461 2.818 1.00 . A A . 40 ALA HA 1 1 8 5963 1 1 38 ALA HB1 H -2.569 3.319 2.626 1.00 . A A . 40 ALA HB1 1 1 8 5964 1 1 38 ALA HB2 H -2.409 1.700 1.944 1.00 . A A . 40 ALA HB2 1 1 8 5965 1 1 38 ALA HB3 H -3.051 1.912 3.573 1.00 . A A . 40 ALA HB3 1 1 8 5966 1 1 38 ALA N N -4.696 1.257 1.143 1.00 . A A . 40 ALA N 1 1 8 5967 1 1 38 ALA O O -4.913 4.754 1.659 1.00 . A A . 40 ALA O 1 1 8 5968 1 1 39 VAL C C -5.863 5.084 -1.247 1.00 . A A . 41 VAL C 1 1 8 5969 1 1 39 VAL CA C -4.384 4.801 -0.983 1.00 . A A . 41 VAL CA 1 1 8 5970 1 1 39 VAL CB C -3.663 4.533 -2.306 1.00 . A A . 41 VAL CB 1 1 8 5971 1 1 39 VAL CG1 C -3.954 5.669 -3.289 1.00 . A A . 41 VAL CG1 1 1 8 5972 1 1 39 VAL CG2 C -2.155 4.453 -2.055 1.00 . A A . 41 VAL CG2 1 1 8 5973 1 1 39 VAL H H -3.989 2.745 -0.475 1.00 . A A . 41 VAL H 1 1 8 5974 1 1 39 VAL HA H -3.938 5.652 -0.493 1.00 . A A . 41 VAL HA 1 1 8 5975 1 1 39 VAL HB H -4.010 3.599 -2.723 1.00 . A A . 41 VAL HB 1 1 8 5976 1 1 39 VAL HG11 H -4.750 6.287 -2.903 1.00 . A A . 41 VAL HG11 1 1 8 5977 1 1 39 VAL HG12 H -4.248 5.253 -4.241 1.00 . A A . 41 VAL HG12 1 1 8 5978 1 1 39 VAL HG13 H -3.065 6.268 -3.419 1.00 . A A . 41 VAL HG13 1 1 8 5979 1 1 39 VAL HG21 H -1.807 3.454 -2.267 1.00 . A A . 41 VAL HG21 1 1 8 5980 1 1 39 VAL HG22 H -1.948 4.694 -1.022 1.00 . A A . 41 VAL HG22 1 1 8 5981 1 1 39 VAL HG23 H -1.645 5.155 -2.698 1.00 . A A . 41 VAL HG23 1 1 8 5982 1 1 39 VAL N N -4.270 3.607 -0.101 1.00 . A A . 41 VAL N 1 1 8 5983 1 1 39 VAL O O -6.286 6.222 -1.304 1.00 . A A . 41 VAL O 1 1 8 5984 1 1 40 VAL C C -8.698 4.966 -0.403 1.00 . A A . 42 VAL C 1 1 8 5985 1 1 40 VAL CA C -8.105 4.272 -1.632 1.00 . A A . 42 VAL CA 1 1 8 5986 1 1 40 VAL CB C -8.792 2.916 -1.872 1.00 . A A . 42 VAL CB 1 1 8 5987 1 1 40 VAL CG1 C -10.278 3.001 -1.517 1.00 . A A . 42 VAL CG1 1 1 8 5988 1 1 40 VAL CG2 C -8.652 2.532 -3.346 1.00 . A A . 42 VAL CG2 1 1 8 5989 1 1 40 VAL H H -6.294 3.151 -1.328 1.00 . A A . 42 VAL H 1 1 8 5990 1 1 40 VAL HA H -8.237 4.904 -2.500 1.00 . A A . 42 VAL HA 1 1 8 5991 1 1 40 VAL HB H -8.322 2.160 -1.260 1.00 . A A . 42 VAL HB 1 1 8 5992 1 1 40 VAL HG11 H -10.777 2.100 -1.837 1.00 . A A . 42 VAL HG11 1 1 8 5993 1 1 40 VAL HG12 H -10.718 3.853 -2.013 1.00 . A A . 42 VAL HG12 1 1 8 5994 1 1 40 VAL HG13 H -10.386 3.112 -0.448 1.00 . A A . 42 VAL HG13 1 1 8 5995 1 1 40 VAL HG21 H -7.962 3.206 -3.832 1.00 . A A . 42 VAL HG21 1 1 8 5996 1 1 40 VAL HG22 H -9.617 2.597 -3.827 1.00 . A A . 42 VAL HG22 1 1 8 5997 1 1 40 VAL HG23 H -8.280 1.521 -3.420 1.00 . A A . 42 VAL HG23 1 1 8 5998 1 1 40 VAL N N -6.654 4.059 -1.391 1.00 . A A . 42 VAL N 1 1 8 5999 1 1 40 VAL O O -9.627 5.743 -0.502 1.00 . A A . 42 VAL O 1 1 8 6000 1 1 41 GLU C C -8.382 6.856 1.891 1.00 . A A . 43 GLU C 1 1 8 6001 1 1 41 GLU CA C -8.672 5.358 1.984 1.00 . A A . 43 GLU CA 1 1 8 6002 1 1 41 GLU CB C -7.972 4.771 3.214 1.00 . A A . 43 GLU CB 1 1 8 6003 1 1 41 GLU CD C -9.656 3.674 4.699 1.00 . A A . 43 GLU CD 1 1 8 6004 1 1 41 GLU CG C -8.628 3.441 3.591 1.00 . A A . 43 GLU CG 1 1 8 6005 1 1 41 GLU H H -7.396 4.081 0.809 1.00 . A A . 43 GLU H 1 1 8 6006 1 1 41 GLU HA H -9.738 5.198 2.059 1.00 . A A . 43 GLU HA 1 1 8 6007 1 1 41 GLU HB2 H -6.928 4.608 2.990 1.00 . A A . 43 GLU HB2 1 1 8 6008 1 1 41 GLU HB3 H -8.060 5.460 4.040 1.00 . A A . 43 GLU HB3 1 1 8 6009 1 1 41 GLU HG2 H -9.119 3.024 2.724 1.00 . A A . 43 GLU HG2 1 1 8 6010 1 1 41 GLU HG3 H -7.873 2.755 3.942 1.00 . A A . 43 GLU HG3 1 1 8 6011 1 1 41 GLU N N -8.154 4.702 0.753 1.00 . A A . 43 GLU N 1 1 8 6012 1 1 41 GLU O O -9.191 7.683 2.262 1.00 . A A . 43 GLU O 1 1 8 6013 1 1 41 GLU OE1 O -10.653 4.322 4.428 1.00 . A A . 43 GLU OE1 1 1 8 6014 1 1 41 GLU OE2 O -9.429 3.198 5.800 1.00 . A A . 43 GLU OE2 1 1 8 6015 1 1 42 SER C C -7.310 9.142 -0.140 1.00 . A A . 44 SER C 1 1 8 6016 1 1 42 SER CA C -6.887 8.650 1.248 1.00 . A A . 44 SER CA 1 1 8 6017 1 1 42 SER CB C -5.379 8.831 1.424 1.00 . A A . 44 SER CB 1 1 8 6018 1 1 42 SER H H -6.598 6.523 1.083 1.00 . A A . 44 SER H 1 1 8 6019 1 1 42 SER HA H -7.408 9.217 2.005 1.00 . A A . 44 SER HA 1 1 8 6020 1 1 42 SER HB2 H -4.912 7.871 1.566 1.00 . A A . 44 SER HB2 1 1 8 6021 1 1 42 SER HB3 H -4.968 9.301 0.540 1.00 . A A . 44 SER HB3 1 1 8 6022 1 1 42 SER HG H -5.692 10.424 2.499 1.00 . A A . 44 SER HG 1 1 8 6023 1 1 42 SER N N -7.232 7.209 1.384 1.00 . A A . 44 SER N 1 1 8 6024 1 1 42 SER O O -7.165 10.302 -0.470 1.00 . A A . 44 SER O 1 1 8 6025 1 1 42 SER OG O -5.134 9.645 2.564 1.00 . A A . 44 SER OG 1 1 8 6026 1 1 43 ASN C C -7.079 8.992 -3.195 1.00 . A A . 45 ASN C 1 1 8 6027 1 1 43 ASN CA C -8.290 8.674 -2.314 1.00 . A A . 45 ASN CA 1 1 8 6028 1 1 43 ASN CB C -9.181 9.910 -2.204 1.00 . A A . 45 ASN CB 1 1 8 6029 1 1 43 ASN CG C -10.525 9.627 -2.877 1.00 . A A . 45 ASN CG 1 1 8 6030 1 1 43 ASN H H -7.958 7.339 -0.662 1.00 . A A . 45 ASN H 1 1 8 6031 1 1 43 ASN HA H -8.853 7.868 -2.760 1.00 . A A . 45 ASN HA 1 1 8 6032 1 1 43 ASN HB2 H -9.341 10.147 -1.162 1.00 . A A . 45 ASN HB2 1 1 8 6033 1 1 43 ASN HB3 H -8.702 10.743 -2.694 1.00 . A A . 45 ASN HB3 1 1 8 6034 1 1 43 ASN HD21 H -11.086 8.297 -1.514 1.00 . A A . 45 ASN HD21 1 1 8 6035 1 1 43 ASN HD22 H -12.201 8.570 -2.764 1.00 . A A . 45 ASN HD22 1 1 8 6036 1 1 43 ASN N N -7.843 8.266 -0.952 1.00 . A A . 45 ASN N 1 1 8 6037 1 1 43 ASN ND2 N -11.338 8.760 -2.340 1.00 . A A . 45 ASN ND2 1 1 8 6038 1 1 43 ASN O O -7.211 9.559 -4.261 1.00 . A A . 45 ASN O 1 1 8 6039 1 1 43 ASN OD1 O -10.838 10.201 -3.902 1.00 . A A . 45 ASN OD1 1 1 8 6040 1 1 44 GLY C C -3.806 9.928 -2.871 1.00 . A A . 46 GLY C 1 1 8 6041 1 1 44 GLY CA C -4.693 8.913 -3.591 1.00 . A A . 46 GLY CA 1 1 8 6042 1 1 44 GLY H H -5.813 8.173 -1.904 1.00 . A A . 46 GLY H 1 1 8 6043 1 1 44 GLY HA2 H -4.142 7.997 -3.745 1.00 . A A . 46 GLY HA2 1 1 8 6044 1 1 44 GLY HA3 H -4.995 9.317 -4.545 1.00 . A A . 46 GLY HA3 1 1 8 6045 1 1 44 GLY N N -5.902 8.631 -2.766 1.00 . A A . 46 GLY N 1 1 8 6046 1 1 44 GLY O O -2.834 10.413 -3.415 1.00 . A A . 46 GLY O 1 1 8 6047 1 1 45 THR C C -2.064 10.536 -0.358 1.00 . A A . 47 THR C 1 1 8 6048 1 1 45 THR CA C -3.312 11.233 -0.897 1.00 . A A . 47 THR CA 1 1 8 6049 1 1 45 THR CB C -4.140 11.779 0.263 1.00 . A A . 47 THR CB 1 1 8 6050 1 1 45 THR CG2 C -3.465 13.025 0.821 1.00 . A A . 47 THR CG2 1 1 8 6051 1 1 45 THR H H -4.918 9.854 -1.231 1.00 . A A . 47 THR H 1 1 8 6052 1 1 45 THR HA H -3.023 12.040 -1.549 1.00 . A A . 47 THR HA 1 1 8 6053 1 1 45 THR HB H -4.211 11.034 1.039 1.00 . A A . 47 THR HB 1 1 8 6054 1 1 45 THR HG1 H -5.426 13.020 -0.505 1.00 . A A . 47 THR HG1 1 1 8 6055 1 1 45 THR HG21 H -4.182 13.597 1.390 1.00 . A A . 47 THR HG21 1 1 8 6056 1 1 45 THR HG22 H -3.088 13.624 0.006 1.00 . A A . 47 THR HG22 1 1 8 6057 1 1 45 THR HG23 H -2.647 12.733 1.463 1.00 . A A . 47 THR HG23 1 1 8 6058 1 1 45 THR N N -4.132 10.253 -1.651 1.00 . A A . 47 THR N 1 1 8 6059 1 1 45 THR O O -0.980 11.085 -0.374 1.00 . A A . 47 THR O 1 1 8 6060 1 1 45 THR OG1 O -5.441 12.109 -0.202 1.00 . A A . 47 THR OG1 1 1 8 6061 1 1 46 LEU C C 0.035 8.510 -0.467 1.00 . A A . 48 LEU C 1 1 8 6062 1 1 46 LEU CA C -1.022 8.596 0.636 1.00 . A A . 48 LEU CA 1 1 8 6063 1 1 46 LEU CB C -1.441 7.187 1.066 1.00 . A A . 48 LEU CB 1 1 8 6064 1 1 46 LEU CD1 C -0.396 7.676 3.287 1.00 . A A . 48 LEU CD1 1 1 8 6065 1 1 46 LEU CD2 C -0.997 5.333 2.679 1.00 . A A . 48 LEU CD2 1 1 8 6066 1 1 46 LEU CG C -0.481 6.668 2.141 1.00 . A A . 48 LEU CG 1 1 8 6067 1 1 46 LEU H H -3.087 8.903 0.103 1.00 . A A . 48 LEU H 1 1 8 6068 1 1 46 LEU HA H -0.616 9.129 1.482 1.00 . A A . 48 LEU HA 1 1 8 6069 1 1 46 LEU HB2 H -2.444 7.218 1.465 1.00 . A A . 48 LEU HB2 1 1 8 6070 1 1 46 LEU HB3 H -1.414 6.527 0.213 1.00 . A A . 48 LEU HB3 1 1 8 6071 1 1 46 LEU HD11 H -0.044 7.178 4.179 1.00 . A A . 48 LEU HD11 1 1 8 6072 1 1 46 LEU HD12 H -1.374 8.095 3.471 1.00 . A A . 48 LEU HD12 1 1 8 6073 1 1 46 LEU HD13 H 0.290 8.466 3.022 1.00 . A A . 48 LEU HD13 1 1 8 6074 1 1 46 LEU HD21 H -1.334 4.718 1.857 1.00 . A A . 48 LEU HD21 1 1 8 6075 1 1 46 LEU HD22 H -1.819 5.512 3.355 1.00 . A A . 48 LEU HD22 1 1 8 6076 1 1 46 LEU HD23 H -0.202 4.826 3.206 1.00 . A A . 48 LEU HD23 1 1 8 6077 1 1 46 LEU HG H 0.500 6.530 1.709 1.00 . A A . 48 LEU HG 1 1 8 6078 1 1 46 LEU N N -2.206 9.329 0.108 1.00 . A A . 48 LEU N 1 1 8 6079 1 1 46 LEU O O -0.281 8.512 -1.641 1.00 . A A . 48 LEU O 1 1 8 6080 1 1 47 THR C C 3.249 7.161 -0.895 1.00 . A A . 49 THR C 1 1 8 6081 1 1 47 THR CA C 2.351 8.378 -1.142 1.00 . A A . 49 THR CA 1 1 8 6082 1 1 47 THR CB C 3.180 9.661 -1.089 1.00 . A A . 49 THR CB 1 1 8 6083 1 1 47 THR CG2 C 2.491 10.752 -1.910 1.00 . A A . 49 THR CG2 1 1 8 6084 1 1 47 THR H H 1.523 8.457 0.845 1.00 . A A . 49 THR H 1 1 8 6085 1 1 47 THR HA H 1.900 8.294 -2.117 1.00 . A A . 49 THR HA 1 1 8 6086 1 1 47 THR HB H 4.154 9.474 -1.500 1.00 . A A . 49 THR HB 1 1 8 6087 1 1 47 THR HG1 H 2.579 10.691 0.447 1.00 . A A . 49 THR HG1 1 1 8 6088 1 1 47 THR HG21 H 2.169 10.343 -2.857 1.00 . A A . 49 THR HG21 1 1 8 6089 1 1 47 THR HG22 H 3.183 11.562 -2.086 1.00 . A A . 49 THR HG22 1 1 8 6090 1 1 47 THR HG23 H 1.634 11.123 -1.368 1.00 . A A . 49 THR HG23 1 1 8 6091 1 1 47 THR N N 1.285 8.448 -0.106 1.00 . A A . 49 THR N 1 1 8 6092 1 1 47 THR O O 2.911 6.268 -0.143 1.00 . A A . 49 THR O 1 1 8 6093 1 1 47 THR OG1 O 3.304 10.090 0.259 1.00 . A A . 49 THR OG1 1 1 8 6094 1 1 48 LEU C C 6.716 6.533 -1.024 1.00 . A A . 50 LEU C 1 1 8 6095 1 1 48 LEU CA C 5.329 5.978 -1.364 1.00 . A A . 50 LEU CA 1 1 8 6096 1 1 48 LEU CB C 5.399 5.191 -2.675 1.00 . A A . 50 LEU CB 1 1 8 6097 1 1 48 LEU CD1 C 5.842 2.801 -2.095 1.00 . A A . 50 LEU CD1 1 1 8 6098 1 1 48 LEU CD2 C 7.106 3.896 -3.950 1.00 . A A . 50 LEU CD2 1 1 8 6099 1 1 48 LEU CG C 6.475 4.110 -2.574 1.00 . A A . 50 LEU CG 1 1 8 6100 1 1 48 LEU H H 4.627 7.852 -2.135 1.00 . A A . 50 LEU H 1 1 8 6101 1 1 48 LEU HA H 4.989 5.327 -0.569 1.00 . A A . 50 LEU HA 1 1 8 6102 1 1 48 LEU HB2 H 4.441 4.729 -2.867 1.00 . A A . 50 LEU HB2 1 1 8 6103 1 1 48 LEU HB3 H 5.642 5.863 -3.486 1.00 . A A . 50 LEU HB3 1 1 8 6104 1 1 48 LEU HD11 H 4.770 2.851 -2.223 1.00 . A A . 50 LEU HD11 1 1 8 6105 1 1 48 LEU HD12 H 6.073 2.651 -1.050 1.00 . A A . 50 LEU HD12 1 1 8 6106 1 1 48 LEU HD13 H 6.235 1.979 -2.672 1.00 . A A . 50 LEU HD13 1 1 8 6107 1 1 48 LEU HD21 H 6.330 3.879 -4.701 1.00 . A A . 50 LEU HD21 1 1 8 6108 1 1 48 LEU HD22 H 7.639 2.958 -3.960 1.00 . A A . 50 LEU HD22 1 1 8 6109 1 1 48 LEU HD23 H 7.792 4.703 -4.160 1.00 . A A . 50 LEU HD23 1 1 8 6110 1 1 48 LEU HG H 7.234 4.419 -1.872 1.00 . A A . 50 LEU HG 1 1 8 6111 1 1 48 LEU N N 4.388 7.123 -1.534 1.00 . A A . 50 LEU N 1 1 8 6112 1 1 48 LEU O O 7.099 7.591 -1.484 1.00 . A A . 50 LEU O 1 1 8 6113 1 1 49 SER C C 9.884 5.547 -0.637 1.00 . A A . 51 SER C 1 1 8 6114 1 1 49 SER CA C 8.830 6.329 0.142 1.00 . A A . 51 SER CA 1 1 8 6115 1 1 49 SER CB C 9.065 6.128 1.640 1.00 . A A . 51 SER CB 1 1 8 6116 1 1 49 SER H H 7.144 4.986 0.135 1.00 . A A . 51 SER H 1 1 8 6117 1 1 49 SER HA H 8.908 7.380 -0.097 1.00 . A A . 51 SER HA 1 1 8 6118 1 1 49 SER HB2 H 9.680 5.259 1.796 1.00 . A A . 51 SER HB2 1 1 8 6119 1 1 49 SER HB3 H 9.567 6.998 2.043 1.00 . A A . 51 SER HB3 1 1 8 6120 1 1 49 SER HG H 7.871 6.353 3.158 1.00 . A A . 51 SER HG 1 1 8 6121 1 1 49 SER N N 7.471 5.834 -0.225 1.00 . A A . 51 SER N 1 1 8 6122 1 1 49 SER O O 10.826 6.109 -1.162 1.00 . A A . 51 SER O 1 1 8 6123 1 1 49 SER OG O 7.819 5.940 2.293 1.00 . A A . 51 SER OG 1 1 8 6124 1 1 50 HIS C C 10.358 1.961 -1.362 1.00 . A A . 52 HIS C 1 1 8 6125 1 1 50 HIS CA C 10.736 3.439 -1.455 1.00 . A A . 52 HIS CA 1 1 8 6126 1 1 50 HIS CB C 12.127 3.651 -0.851 1.00 . A A . 52 HIS CB 1 1 8 6127 1 1 50 HIS CD2 C 11.822 4.019 1.735 1.00 . A A . 52 HIS CD2 1 1 8 6128 1 1 50 HIS CE1 C 12.318 2.019 2.399 1.00 . A A . 52 HIS CE1 1 1 8 6129 1 1 50 HIS CG C 12.106 3.287 0.609 1.00 . A A . 52 HIS CG 1 1 8 6130 1 1 50 HIS H H 8.974 3.817 -0.283 1.00 . A A . 52 HIS H 1 1 8 6131 1 1 50 HIS HA H 10.746 3.742 -2.492 1.00 . A A . 52 HIS HA 1 1 8 6132 1 1 50 HIS HB2 H 12.842 3.027 -1.367 1.00 . A A . 52 HIS HB2 1 1 8 6133 1 1 50 HIS HB3 H 12.412 4.687 -0.959 1.00 . A A . 52 HIS HB3 1 1 8 6134 1 1 50 HIS HD1 H 12.672 1.247 0.499 1.00 . A A . 52 HIS HD1 1 1 8 6135 1 1 50 HIS HD2 H 11.540 5.062 1.743 1.00 . A A . 52 HIS HD2 1 1 8 6136 1 1 50 HIS HE1 H 12.510 1.160 3.026 1.00 . A A . 52 HIS HE1 1 1 8 6137 1 1 50 HIS N N 9.739 4.254 -0.714 1.00 . A A . 52 HIS N 1 1 8 6138 1 1 50 HIS ND1 N 12.421 2.013 1.058 1.00 . A A . 52 HIS ND1 1 1 8 6139 1 1 50 HIS NE2 N 11.955 3.217 2.864 1.00 . A A . 52 HIS NE2 1 1 8 6140 1 1 50 HIS O O 10.524 1.329 -0.336 1.00 . A A . 52 HIS O 1 1 8 6141 1 1 51 PHE C C 10.556 -0.837 -1.706 1.00 . A A . 53 PHE C 1 1 8 6142 1 1 51 PHE CA C 9.460 -0.029 -2.404 1.00 . A A . 53 PHE CA 1 1 8 6143 1 1 51 PHE CB C 9.303 -0.539 -3.837 1.00 . A A . 53 PHE CB 1 1 8 6144 1 1 51 PHE CD1 C 7.087 0.565 -4.330 1.00 . A A . 53 PHE CD1 1 1 8 6145 1 1 51 PHE CD2 C 9.000 1.114 -5.714 1.00 . A A . 53 PHE CD2 1 1 8 6146 1 1 51 PHE CE1 C 6.290 1.433 -5.088 1.00 . A A . 53 PHE CE1 1 1 8 6147 1 1 51 PHE CE2 C 8.203 1.979 -6.473 1.00 . A A . 53 PHE CE2 1 1 8 6148 1 1 51 PHE CG C 8.442 0.407 -4.643 1.00 . A A . 53 PHE CG 1 1 8 6149 1 1 51 PHE CZ C 6.848 2.139 -6.160 1.00 . A A . 53 PHE CZ 1 1 8 6150 1 1 51 PHE H H 9.716 1.931 -3.238 1.00 . A A . 53 PHE H 1 1 8 6151 1 1 51 PHE HA H 8.528 -0.146 -1.872 1.00 . A A . 53 PHE HA 1 1 8 6152 1 1 51 PHE HB2 H 10.275 -0.615 -4.297 1.00 . A A . 53 PHE HB2 1 1 8 6153 1 1 51 PHE HB3 H 8.841 -1.511 -3.818 1.00 . A A . 53 PHE HB3 1 1 8 6154 1 1 51 PHE HD1 H 6.655 0.022 -3.503 1.00 . A A . 53 PHE HD1 1 1 8 6155 1 1 51 PHE HD2 H 10.046 0.991 -5.956 1.00 . A A . 53 PHE HD2 1 1 8 6156 1 1 51 PHE HE1 H 5.245 1.556 -4.846 1.00 . A A . 53 PHE HE1 1 1 8 6157 1 1 51 PHE HE2 H 8.635 2.524 -7.301 1.00 . A A . 53 PHE HE2 1 1 8 6158 1 1 51 PHE HZ H 6.235 2.807 -6.746 1.00 . A A . 53 PHE HZ 1 1 8 6159 1 1 51 PHE N N 9.846 1.405 -2.425 1.00 . A A . 53 PHE N 1 1 8 6160 1 1 51 PHE O O 11.589 -1.121 -2.281 1.00 . A A . 53 PHE O 1 1 8 6161 1 1 52 GLY C C 10.999 -2.136 1.717 1.00 . A A . 54 GLY C 1 1 8 6162 1 1 52 GLY CA C 11.385 -2.000 0.245 1.00 . A A . 54 GLY CA 1 1 8 6163 1 1 52 GLY H H 9.509 -0.974 -0.024 1.00 . A A . 54 GLY H 1 1 8 6164 1 1 52 GLY HA2 H 11.465 -2.981 -0.199 1.00 . A A . 54 GLY HA2 1 1 8 6165 1 1 52 GLY HA3 H 12.335 -1.494 0.173 1.00 . A A . 54 GLY HA3 1 1 8 6166 1 1 52 GLY N N 10.346 -1.211 -0.475 1.00 . A A . 54 GLY N 1 1 8 6167 1 1 52 GLY O O 10.170 -1.405 2.224 1.00 . A A . 54 GLY O 1 1 8 6168 1 1 53 LYS C C 11.837 -2.080 4.654 1.00 . A A . 55 LYS C 1 1 8 6169 1 1 53 LYS CA C 11.264 -3.247 3.852 1.00 . A A . 55 LYS CA 1 1 8 6170 1 1 53 LYS CB C 11.864 -4.561 4.357 1.00 . A A . 55 LYS CB 1 1 8 6171 1 1 53 LYS CD C 14.058 -5.627 4.899 1.00 . A A . 55 LYS CD 1 1 8 6172 1 1 53 LYS CE C 15.366 -6.077 4.247 1.00 . A A . 55 LYS CE 1 1 8 6173 1 1 53 LYS CG C 13.345 -4.631 3.981 1.00 . A A . 55 LYS CG 1 1 8 6174 1 1 53 LYS H H 12.262 -3.644 1.985 1.00 . A A . 55 LYS H 1 1 8 6175 1 1 53 LYS HA H 10.191 -3.273 3.973 1.00 . A A . 55 LYS HA 1 1 8 6176 1 1 53 LYS HB2 H 11.763 -4.613 5.432 1.00 . A A . 55 LYS HB2 1 1 8 6177 1 1 53 LYS HB3 H 11.341 -5.391 3.907 1.00 . A A . 55 LYS HB3 1 1 8 6178 1 1 53 LYS HD2 H 14.269 -5.155 5.848 1.00 . A A . 55 LYS HD2 1 1 8 6179 1 1 53 LYS HD3 H 13.424 -6.486 5.059 1.00 . A A . 55 LYS HD3 1 1 8 6180 1 1 53 LYS HE2 H 15.434 -7.154 4.279 1.00 . A A . 55 LYS HE2 1 1 8 6181 1 1 53 LYS HE3 H 15.387 -5.745 3.219 1.00 . A A . 55 LYS HE3 1 1 8 6182 1 1 53 LYS HG2 H 13.440 -4.954 2.954 1.00 . A A . 55 LYS HG2 1 1 8 6183 1 1 53 LYS HG3 H 13.793 -3.656 4.094 1.00 . A A . 55 LYS HG3 1 1 8 6184 1 1 53 LYS HZ1 H 16.258 -4.544 5.341 1.00 . A A . 55 LYS HZ1 1 1 8 6185 1 1 53 LYS HZ2 H 17.332 -5.396 4.336 1.00 . A A . 55 LYS HZ2 1 1 8 6186 1 1 53 LYS HZ3 H 16.775 -6.098 5.779 1.00 . A A . 55 LYS HZ3 1 1 8 6187 1 1 53 LYS N N 11.595 -3.067 2.411 1.00 . A A . 55 LYS N 1 1 8 6188 1 1 53 LYS NZ N 16.519 -5.484 4.982 1.00 . A A . 55 LYS NZ 1 1 8 6189 1 1 53 LYS O O 13.006 -1.761 4.557 1.00 . A A . 55 LYS O 1 1 8 6190 1 1 54 CYS C C 12.531 -0.782 7.283 1.00 . A A . 56 CYS C 1 1 8 6191 1 1 54 CYS CA C 11.518 -0.286 6.249 1.00 . A A . 56 CYS CA 1 1 8 6192 1 1 54 CYS CB C 10.339 0.372 6.965 1.00 . A A . 56 CYS CB 1 1 8 6193 1 1 54 CYS H H 10.083 -1.709 5.504 1.00 . A A . 56 CYS H 1 1 8 6194 1 1 54 CYS HA H 11.990 0.434 5.597 1.00 . A A . 56 CYS HA 1 1 8 6195 1 1 54 CYS HB2 H 9.643 -0.390 7.288 1.00 . A A . 56 CYS HB2 1 1 8 6196 1 1 54 CYS HB3 H 10.697 0.920 7.824 1.00 . A A . 56 CYS HB3 1 1 8 6197 1 1 54 CYS N N 11.024 -1.436 5.444 1.00 . A A . 56 CYS N 1 1 8 6198 1 1 54 CYS O O 13.713 -0.769 6.978 1.00 . A A . 56 CYS O 1 1 8 6199 1 1 54 CYS OXT O 12.109 -1.164 8.362 1.00 . A A . 56 CYS OXT 1 1 8 6200 1 1 54 CYS SG S 9.506 1.508 5.829 1.00 . A A . 56 CYS SG 1 1 9 6201 1 1 1 ALA C C 3.562 8.591 -8.283 1.00 . A A . 3 ALA C 1 1 9 6202 1 1 1 ALA CA C 2.776 9.131 -7.086 1.00 . A A . 3 ALA CA 1 1 9 6203 1 1 1 ALA CB C 1.654 10.048 -7.583 1.00 . A A . 3 ALA CB 1 1 9 6204 1 1 1 ALA H1 H 3.986 9.301 -5.399 1.00 . A A . 3 ALA H1 1 1 9 6205 1 1 1 ALA H2 H 3.199 10.742 -5.835 1.00 . A A . 3 ALA H2 1 1 9 6206 1 1 1 ALA H3 H 4.532 10.194 -6.734 1.00 . A A . 3 ALA H3 1 1 9 6207 1 1 1 ALA HA H 2.348 8.305 -6.535 1.00 . A A . 3 ALA HA 1 1 9 6208 1 1 1 ALA HB1 H 2.031 11.055 -7.682 1.00 . A A . 3 ALA HB1 1 1 9 6209 1 1 1 ALA HB2 H 0.839 10.036 -6.874 1.00 . A A . 3 ALA HB2 1 1 9 6210 1 1 1 ALA HB3 H 1.303 9.698 -8.542 1.00 . A A . 3 ALA HB3 1 1 9 6211 1 1 1 ALA N N 3.693 9.900 -6.196 1.00 . A A . 3 ALA N 1 1 9 6212 1 1 1 ALA O O 3.287 8.923 -9.419 1.00 . A A . 3 ALA O 1 1 9 6213 1 1 2 VAL C C 5.263 5.676 -9.138 1.00 . A A . 4 VAL C 1 1 9 6214 1 1 2 VAL CA C 5.342 7.203 -9.164 1.00 . A A . 4 VAL CA 1 1 9 6215 1 1 2 VAL CB C 6.801 7.642 -9.015 1.00 . A A . 4 VAL CB 1 1 9 6216 1 1 2 VAL CG1 C 6.857 9.153 -8.790 1.00 . A A . 4 VAL CG1 1 1 9 6217 1 1 2 VAL CG2 C 7.431 6.925 -7.819 1.00 . A A . 4 VAL CG2 1 1 9 6218 1 1 2 VAL H H 4.746 7.506 -7.116 1.00 . A A . 4 VAL H 1 1 9 6219 1 1 2 VAL HA H 4.951 7.568 -10.102 1.00 . A A . 4 VAL HA 1 1 9 6220 1 1 2 VAL HB H 7.344 7.391 -9.914 1.00 . A A . 4 VAL HB 1 1 9 6221 1 1 2 VAL HG11 H 6.711 9.663 -9.731 1.00 . A A . 4 VAL HG11 1 1 9 6222 1 1 2 VAL HG12 H 7.820 9.421 -8.382 1.00 . A A . 4 VAL HG12 1 1 9 6223 1 1 2 VAL HG13 H 6.080 9.443 -8.100 1.00 . A A . 4 VAL HG13 1 1 9 6224 1 1 2 VAL HG21 H 6.677 6.751 -7.066 1.00 . A A . 4 VAL HG21 1 1 9 6225 1 1 2 VAL HG22 H 8.218 7.538 -7.406 1.00 . A A . 4 VAL HG22 1 1 9 6226 1 1 2 VAL HG23 H 7.843 5.980 -8.141 1.00 . A A . 4 VAL HG23 1 1 9 6227 1 1 2 VAL N N 4.540 7.762 -8.039 1.00 . A A . 4 VAL N 1 1 9 6228 1 1 2 VAL O O 5.377 5.056 -8.099 1.00 . A A . 4 VAL O 1 1 9 6229 1 1 3 SER C C 3.731 3.118 -9.559 1.00 . A A . 5 SER C 1 1 9 6230 1 1 3 SER CA C 4.984 3.575 -10.308 1.00 . A A . 5 SER CA 1 1 9 6231 1 1 3 SER CB C 6.224 2.976 -9.645 1.00 . A A . 5 SER CB 1 1 9 6232 1 1 3 SER H H 4.982 5.578 -11.101 1.00 . A A . 5 SER H 1 1 9 6233 1 1 3 SER HA H 4.929 3.242 -11.335 1.00 . A A . 5 SER HA 1 1 9 6234 1 1 3 SER HB2 H 7.063 3.639 -9.780 1.00 . A A . 5 SER HB2 1 1 9 6235 1 1 3 SER HB3 H 6.038 2.846 -8.587 1.00 . A A . 5 SER HB3 1 1 9 6236 1 1 3 SER HG H 7.435 1.509 -10.056 1.00 . A A . 5 SER HG 1 1 9 6237 1 1 3 SER N N 5.069 5.062 -10.272 1.00 . A A . 5 SER N 1 1 9 6238 1 1 3 SER O O 3.692 2.044 -8.992 1.00 . A A . 5 SER O 1 1 9 6239 1 1 3 SER OG O 6.519 1.721 -10.245 1.00 . A A . 5 SER OG 1 1 9 6240 1 1 4 VAL C C 0.262 3.675 -9.782 1.00 . A A . 6 VAL C 1 1 9 6241 1 1 4 VAL CA C 1.456 3.533 -8.838 1.00 . A A . 6 VAL CA 1 1 9 6242 1 1 4 VAL CB C 1.255 4.436 -7.619 1.00 . A A . 6 VAL CB 1 1 9 6243 1 1 4 VAL CG1 C 0.974 5.866 -8.082 1.00 . A A . 6 VAL CG1 1 1 9 6244 1 1 4 VAL CG2 C 0.072 3.923 -6.797 1.00 . A A . 6 VAL CG2 1 1 9 6245 1 1 4 VAL H H 2.755 4.787 -10.013 1.00 . A A . 6 VAL H 1 1 9 6246 1 1 4 VAL HA H 1.537 2.506 -8.513 1.00 . A A . 6 VAL HA 1 1 9 6247 1 1 4 VAL HB H 2.150 4.425 -7.013 1.00 . A A . 6 VAL HB 1 1 9 6248 1 1 4 VAL HG11 H 1.301 5.984 -9.105 1.00 . A A . 6 VAL HG11 1 1 9 6249 1 1 4 VAL HG12 H 1.508 6.560 -7.451 1.00 . A A . 6 VAL HG12 1 1 9 6250 1 1 4 VAL HG13 H -0.086 6.063 -8.018 1.00 . A A . 6 VAL HG13 1 1 9 6251 1 1 4 VAL HG21 H -0.669 3.499 -7.458 1.00 . A A . 6 VAL HG21 1 1 9 6252 1 1 4 VAL HG22 H -0.365 4.741 -6.244 1.00 . A A . 6 VAL HG22 1 1 9 6253 1 1 4 VAL HG23 H 0.416 3.166 -6.108 1.00 . A A . 6 VAL HG23 1 1 9 6254 1 1 4 VAL N N 2.705 3.925 -9.550 1.00 . A A . 6 VAL N 1 1 9 6255 1 1 4 VAL O O 0.217 4.561 -10.614 1.00 . A A . 6 VAL O 1 1 9 6256 1 1 5 ASP C C -2.998 1.969 -10.027 1.00 . A A . 7 ASP C 1 1 9 6257 1 1 5 ASP CA C -1.898 2.893 -10.555 1.00 . A A . 7 ASP CA 1 1 9 6258 1 1 5 ASP CB C -1.512 2.466 -11.975 1.00 . A A . 7 ASP CB 1 1 9 6259 1 1 5 ASP CG C -0.399 1.416 -11.913 1.00 . A A . 7 ASP CG 1 1 9 6260 1 1 5 ASP H H -0.651 2.101 -8.988 1.00 . A A . 7 ASP H 1 1 9 6261 1 1 5 ASP HA H -2.262 3.909 -10.573 1.00 . A A . 7 ASP HA 1 1 9 6262 1 1 5 ASP HB2 H -2.374 2.048 -12.473 1.00 . A A . 7 ASP HB2 1 1 9 6263 1 1 5 ASP HB3 H -1.160 3.326 -12.525 1.00 . A A . 7 ASP HB3 1 1 9 6264 1 1 5 ASP N N -0.707 2.808 -9.664 1.00 . A A . 7 ASP N 1 1 9 6265 1 1 5 ASP O O -3.146 0.847 -10.470 1.00 . A A . 7 ASP O 1 1 9 6266 1 1 5 ASP OD1 O -0.633 0.369 -11.333 1.00 . A A . 7 ASP OD1 1 1 9 6267 1 1 5 ASP OD2 O 0.667 1.679 -12.444 1.00 . A A . 7 ASP OD2 1 1 9 6268 1 1 6 CYS C C -6.181 2.361 -8.591 1.00 . A A . 8 CYS C 1 1 9 6269 1 1 6 CYS CA C -4.865 1.585 -8.533 1.00 . A A . 8 CYS CA 1 1 9 6270 1 1 6 CYS CB C -4.550 1.225 -7.080 1.00 . A A . 8 CYS CB 1 1 9 6271 1 1 6 CYS H H -3.638 3.342 -8.745 1.00 . A A . 8 CYS H 1 1 9 6272 1 1 6 CYS HA H -4.952 0.682 -9.118 1.00 . A A . 8 CYS HA 1 1 9 6273 1 1 6 CYS HB2 H -3.919 1.989 -6.648 1.00 . A A . 8 CYS HB2 1 1 9 6274 1 1 6 CYS HB3 H -5.470 1.156 -6.518 1.00 . A A . 8 CYS HB3 1 1 9 6275 1 1 6 CYS N N -3.772 2.433 -9.086 1.00 . A A . 8 CYS N 1 1 9 6276 1 1 6 CYS O O -6.871 2.504 -7.602 1.00 . A A . 8 CYS O 1 1 9 6277 1 1 6 CYS SG S -3.689 -0.367 -7.024 1.00 . A A . 8 CYS SG 1 1 9 6278 1 1 7 SER C C -8.956 2.800 -9.348 1.00 . A A . 9 SER C 1 1 9 6279 1 1 7 SER CA C -7.796 3.629 -9.890 1.00 . A A . 9 SER CA 1 1 9 6280 1 1 7 SER CB C -8.038 3.942 -11.366 1.00 . A A . 9 SER CB 1 1 9 6281 1 1 7 SER H H -5.956 2.729 -10.523 1.00 . A A . 9 SER H 1 1 9 6282 1 1 7 SER HA H -7.722 4.552 -9.334 1.00 . A A . 9 SER HA 1 1 9 6283 1 1 7 SER HB2 H -9.054 4.270 -11.506 1.00 . A A . 9 SER HB2 1 1 9 6284 1 1 7 SER HB3 H -7.362 4.727 -11.681 1.00 . A A . 9 SER HB3 1 1 9 6285 1 1 7 SER HG H -7.696 3.032 -13.051 1.00 . A A . 9 SER HG 1 1 9 6286 1 1 7 SER N N -6.529 2.860 -9.747 1.00 . A A . 9 SER N 1 1 9 6287 1 1 7 SER O O -9.602 2.067 -10.070 1.00 . A A . 9 SER O 1 1 9 6288 1 1 7 SER OG O -7.814 2.769 -12.137 1.00 . A A . 9 SER OG 1 1 9 6289 1 1 8 GLU C C -9.894 0.683 -7.277 1.00 . A A . 10 GLU C 1 1 9 6290 1 1 8 GLU CA C -10.335 2.134 -7.476 1.00 . A A . 10 GLU CA 1 1 9 6291 1 1 8 GLU CB C -11.550 2.175 -8.406 1.00 . A A . 10 GLU CB 1 1 9 6292 1 1 8 GLU CD C -13.957 1.513 -8.415 1.00 . A A . 10 GLU CD 1 1 9 6293 1 1 8 GLU CG C -12.833 2.120 -7.575 1.00 . A A . 10 GLU CG 1 1 9 6294 1 1 8 GLU H H -8.679 3.509 -7.525 1.00 . A A . 10 GLU H 1 1 9 6295 1 1 8 GLU HA H -10.599 2.565 -6.522 1.00 . A A . 10 GLU HA 1 1 9 6296 1 1 8 GLU HB2 H -11.531 3.088 -8.981 1.00 . A A . 10 GLU HB2 1 1 9 6297 1 1 8 GLU HB3 H -11.520 1.327 -9.075 1.00 . A A . 10 GLU HB3 1 1 9 6298 1 1 8 GLU HG2 H -12.668 1.510 -6.698 1.00 . A A . 10 GLU HG2 1 1 9 6299 1 1 8 GLU HG3 H -13.110 3.119 -7.274 1.00 . A A . 10 GLU HG3 1 1 9 6300 1 1 8 GLU N N -9.219 2.912 -8.081 1.00 . A A . 10 GLU N 1 1 9 6301 1 1 8 GLU O O -10.482 -0.234 -7.816 1.00 . A A . 10 GLU O 1 1 9 6302 1 1 8 GLU OE1 O -13.668 1.034 -9.500 1.00 . A A . 10 GLU OE1 1 1 9 6303 1 1 8 GLU OE2 O -15.089 1.536 -7.960 1.00 . A A . 10 GLU OE2 1 1 9 6304 1 1 9 TYR C C -8.171 -1.179 -4.782 1.00 . A A . 11 TYR C 1 1 9 6305 1 1 9 TYR CA C -8.391 -0.930 -6.280 1.00 . A A . 11 TYR CA 1 1 9 6306 1 1 9 TYR CB C -7.072 -1.141 -7.023 1.00 . A A . 11 TYR CB 1 1 9 6307 1 1 9 TYR CD1 C -6.446 -3.507 -6.422 1.00 . A A . 11 TYR CD1 1 1 9 6308 1 1 9 TYR CD2 C -7.248 -3.043 -8.664 1.00 . A A . 11 TYR CD2 1 1 9 6309 1 1 9 TYR CE1 C -6.300 -4.859 -6.754 1.00 . A A . 11 TYR CE1 1 1 9 6310 1 1 9 TYR CE2 C -7.103 -4.396 -8.995 1.00 . A A . 11 TYR CE2 1 1 9 6311 1 1 9 TYR CG C -6.918 -2.598 -7.378 1.00 . A A . 11 TYR CG 1 1 9 6312 1 1 9 TYR CZ C -6.630 -5.304 -8.040 1.00 . A A . 11 TYR CZ 1 1 9 6313 1 1 9 TYR H H -8.398 1.216 -6.081 1.00 . A A . 11 TYR H 1 1 9 6314 1 1 9 TYR HA H -9.127 -1.624 -6.656 1.00 . A A . 11 TYR HA 1 1 9 6315 1 1 9 TYR HB2 H -7.069 -0.548 -7.926 1.00 . A A . 11 TYR HB2 1 1 9 6316 1 1 9 TYR HB3 H -6.251 -0.836 -6.391 1.00 . A A . 11 TYR HB3 1 1 9 6317 1 1 9 TYR HD1 H -6.193 -3.163 -5.429 1.00 . A A . 11 TYR HD1 1 1 9 6318 1 1 9 TYR HD2 H -7.613 -2.343 -9.399 1.00 . A A . 11 TYR HD2 1 1 9 6319 1 1 9 TYR HE1 H -5.936 -5.560 -6.017 1.00 . A A . 11 TYR HE1 1 1 9 6320 1 1 9 TYR HE2 H -7.357 -4.738 -9.987 1.00 . A A . 11 TYR HE2 1 1 9 6321 1 1 9 TYR HH H -5.561 -6.794 -8.574 1.00 . A A . 11 TYR HH 1 1 9 6322 1 1 9 TYR N N -8.863 0.465 -6.507 1.00 . A A . 11 TYR N 1 1 9 6323 1 1 9 TYR O O -7.095 -1.571 -4.377 1.00 . A A . 11 TYR O 1 1 9 6324 1 1 9 TYR OH O -6.486 -6.638 -8.368 1.00 . A A . 11 TYR OH 1 1 9 6325 1 1 10 PRO C C -9.269 -2.648 -2.214 1.00 . A A . 12 PRO C 1 1 9 6326 1 1 10 PRO CA C -9.143 -1.157 -2.544 1.00 . A A . 12 PRO CA 1 1 9 6327 1 1 10 PRO CB C -10.358 -0.387 -2.025 1.00 . A A . 12 PRO CB 1 1 9 6328 1 1 10 PRO CD C -10.509 -0.477 -4.493 1.00 . A A . 12 PRO CD 1 1 9 6329 1 1 10 PRO CG C -11.342 -0.279 -3.212 1.00 . A A . 12 PRO CG 1 1 9 6330 1 1 10 PRO HA H -8.237 -0.745 -2.132 1.00 . A A . 12 PRO HA 1 1 9 6331 1 1 10 PRO HB2 H -10.816 -0.924 -1.206 1.00 . A A . 12 PRO HB2 1 1 9 6332 1 1 10 PRO HB3 H -10.063 0.601 -1.706 1.00 . A A . 12 PRO HB3 1 1 9 6333 1 1 10 PRO HD2 H -10.970 -1.215 -5.133 1.00 . A A . 12 PRO HD2 1 1 9 6334 1 1 10 PRO HD3 H -10.395 0.460 -5.009 1.00 . A A . 12 PRO HD3 1 1 9 6335 1 1 10 PRO HG2 H -12.099 -1.048 -3.136 1.00 . A A . 12 PRO HG2 1 1 9 6336 1 1 10 PRO HG3 H -11.803 0.696 -3.225 1.00 . A A . 12 PRO HG3 1 1 9 6337 1 1 10 PRO N N -9.200 -0.954 -4.001 1.00 . A A . 12 PRO N 1 1 9 6338 1 1 10 PRO O O -10.148 -3.328 -2.705 1.00 . A A . 12 PRO O 1 1 9 6339 1 1 11 LYS C C -7.617 -4.888 0.195 1.00 . A A . 13 LYS C 1 1 9 6340 1 1 11 LYS CA C -8.481 -4.606 -1.037 1.00 . A A . 13 LYS CA 1 1 9 6341 1 1 11 LYS CB C -7.981 -5.443 -2.214 1.00 . A A . 13 LYS CB 1 1 9 6342 1 1 11 LYS CD C -9.105 -7.093 -3.716 1.00 . A A . 13 LYS CD 1 1 9 6343 1 1 11 LYS CE C -9.793 -7.165 -5.081 1.00 . A A . 13 LYS CE 1 1 9 6344 1 1 11 LYS CG C -9.123 -5.650 -3.211 1.00 . A A . 13 LYS CG 1 1 9 6345 1 1 11 LYS H H -7.697 -2.600 -1.003 1.00 . A A . 13 LYS H 1 1 9 6346 1 1 11 LYS HA H -9.507 -4.867 -0.822 1.00 . A A . 13 LYS HA 1 1 9 6347 1 1 11 LYS HB2 H -7.164 -4.929 -2.700 1.00 . A A . 13 LYS HB2 1 1 9 6348 1 1 11 LYS HB3 H -7.639 -6.402 -1.856 1.00 . A A . 13 LYS HB3 1 1 9 6349 1 1 11 LYS HD2 H -8.083 -7.430 -3.809 1.00 . A A . 13 LYS HD2 1 1 9 6350 1 1 11 LYS HD3 H -9.631 -7.726 -3.016 1.00 . A A . 13 LYS HD3 1 1 9 6351 1 1 11 LYS HE2 H -10.630 -7.845 -5.027 1.00 . A A . 13 LYS HE2 1 1 9 6352 1 1 11 LYS HE3 H -10.146 -6.182 -5.357 1.00 . A A . 13 LYS HE3 1 1 9 6353 1 1 11 LYS HG2 H -10.066 -5.450 -2.724 1.00 . A A . 13 LYS HG2 1 1 9 6354 1 1 11 LYS HG3 H -8.999 -4.977 -4.046 1.00 . A A . 13 LYS HG3 1 1 9 6355 1 1 11 LYS HZ1 H -8.851 -7.024 -6.932 1.00 . A A . 13 LYS HZ1 1 1 9 6356 1 1 11 LYS HZ2 H -9.074 -8.617 -6.386 1.00 . A A . 13 LYS HZ2 1 1 9 6357 1 1 11 LYS HZ3 H -7.864 -7.642 -5.699 1.00 . A A . 13 LYS HZ3 1 1 9 6358 1 1 11 LYS N N -8.400 -3.161 -1.389 1.00 . A A . 13 LYS N 1 1 9 6359 1 1 11 LYS NZ N -8.822 -7.648 -6.101 1.00 . A A . 13 LYS NZ 1 1 9 6360 1 1 11 LYS O O -6.434 -5.146 0.089 1.00 . A A . 13 LYS O 1 1 9 6361 1 1 12 CYS C C -7.550 -6.598 2.959 1.00 . A A . 14 CYS C 1 1 9 6362 1 1 12 CYS CA C -7.417 -5.119 2.598 1.00 . A A . 14 CYS CA 1 1 9 6363 1 1 12 CYS CB C -7.955 -4.261 3.745 1.00 . A A . 14 CYS CB 1 1 9 6364 1 1 12 CYS H H -9.157 -4.642 1.423 1.00 . A A . 14 CYS H 1 1 9 6365 1 1 12 CYS HA H -6.378 -4.882 2.424 1.00 . A A . 14 CYS HA 1 1 9 6366 1 1 12 CYS HB2 H -9.031 -4.209 3.682 1.00 . A A . 14 CYS HB2 1 1 9 6367 1 1 12 CYS HB3 H -7.670 -4.703 4.689 1.00 . A A . 14 CYS HB3 1 1 9 6368 1 1 12 CYS N N -8.201 -4.847 1.361 1.00 . A A . 14 CYS N 1 1 9 6369 1 1 12 CYS O O -7.418 -6.985 4.103 1.00 . A A . 14 CYS O 1 1 9 6370 1 1 12 CYS SG S -7.262 -2.593 3.626 1.00 . A A . 14 CYS SG 1 1 9 6371 1 1 13 ALA C C -7.517 -9.670 1.023 1.00 . A A . 15 ALA C 1 1 9 6372 1 1 13 ALA CA C -7.954 -8.884 2.261 1.00 . A A . 15 ALA CA 1 1 9 6373 1 1 13 ALA CB C -9.415 -9.205 2.582 1.00 . A A . 15 ALA CB 1 1 9 6374 1 1 13 ALA H H -7.911 -7.089 1.072 1.00 . A A . 15 ALA H 1 1 9 6375 1 1 13 ALA HA H -7.331 -9.157 3.100 1.00 . A A . 15 ALA HA 1 1 9 6376 1 1 13 ALA HB1 H -9.916 -8.308 2.913 1.00 . A A . 15 ALA HB1 1 1 9 6377 1 1 13 ALA HB2 H -9.457 -9.949 3.363 1.00 . A A . 15 ALA HB2 1 1 9 6378 1 1 13 ALA HB3 H -9.904 -9.585 1.697 1.00 . A A . 15 ALA HB3 1 1 9 6379 1 1 13 ALA N N -7.810 -7.426 1.987 1.00 . A A . 15 ALA N 1 1 9 6380 1 1 13 ALA O O -8.331 -10.145 0.257 1.00 . A A . 15 ALA O 1 1 9 6381 1 1 14 CYS C C -5.130 -11.875 0.067 1.00 . A A . 16 CYS C 1 1 9 6382 1 1 14 CYS CA C -5.741 -10.550 -0.372 1.00 . A A . 16 CYS CA 1 1 9 6383 1 1 14 CYS CB C -4.685 -9.713 -1.094 1.00 . A A . 16 CYS CB 1 1 9 6384 1 1 14 CYS H H -5.596 -9.407 1.447 1.00 . A A . 16 CYS H 1 1 9 6385 1 1 14 CYS HA H -6.560 -10.746 -1.044 1.00 . A A . 16 CYS HA 1 1 9 6386 1 1 14 CYS HB2 H -4.176 -9.081 -0.380 1.00 . A A . 16 CYS HB2 1 1 9 6387 1 1 14 CYS HB3 H -3.970 -10.366 -1.571 1.00 . A A . 16 CYS HB3 1 1 9 6388 1 1 14 CYS N N -6.235 -9.803 0.819 1.00 . A A . 16 CYS N 1 1 9 6389 1 1 14 CYS O O -5.158 -12.236 1.228 1.00 . A A . 16 CYS O 1 1 9 6390 1 1 14 CYS SG S -5.491 -8.683 -2.346 1.00 . A A . 16 CYS SG 1 1 9 6391 1 1 15 THR C C -2.593 -13.701 0.110 1.00 . A A . 17 THR C 1 1 9 6392 1 1 15 THR CA C -3.975 -13.920 -0.511 1.00 . A A . 17 THR CA 1 1 9 6393 1 1 15 THR CB C -3.841 -14.771 -1.777 1.00 . A A . 17 THR CB 1 1 9 6394 1 1 15 THR CG2 C -3.123 -16.080 -1.441 1.00 . A A . 17 THR CG2 1 1 9 6395 1 1 15 THR H H -4.585 -12.293 -1.787 1.00 . A A . 17 THR H 1 1 9 6396 1 1 15 THR HA H -4.609 -14.432 0.198 1.00 . A A . 17 THR HA 1 1 9 6397 1 1 15 THR HB H -3.272 -14.232 -2.517 1.00 . A A . 17 THR HB 1 1 9 6398 1 1 15 THR HG1 H -5.664 -15.419 -1.574 1.00 . A A . 17 THR HG1 1 1 9 6399 1 1 15 THR HG21 H -3.850 -16.830 -1.169 1.00 . A A . 17 THR HG21 1 1 9 6400 1 1 15 THR HG22 H -2.447 -15.918 -0.614 1.00 . A A . 17 THR HG22 1 1 9 6401 1 1 15 THR HG23 H -2.564 -16.415 -2.302 1.00 . A A . 17 THR HG23 1 1 9 6402 1 1 15 THR N N -4.584 -12.606 -0.859 1.00 . A A . 17 THR N 1 1 9 6403 1 1 15 THR O O -2.464 -13.541 1.308 1.00 . A A . 17 THR O 1 1 9 6404 1 1 15 THR OG1 O -5.135 -15.058 -2.289 1.00 . A A . 17 THR OG1 1 1 9 6405 1 1 16 MET C C 0.762 -12.960 -1.177 1.00 . A A . 18 MET C 1 1 9 6406 1 1 16 MET CA C -0.192 -13.500 -0.109 1.00 . A A . 18 MET CA 1 1 9 6407 1 1 16 MET CB C 0.336 -14.837 0.412 1.00 . A A . 18 MET CB 1 1 9 6408 1 1 16 MET CE C 0.490 -15.875 4.373 1.00 . A A . 18 MET CE 1 1 9 6409 1 1 16 MET CG C 0.606 -14.731 1.914 1.00 . A A . 18 MET CG 1 1 9 6410 1 1 16 MET H H -1.667 -13.837 -1.645 1.00 . A A . 18 MET H 1 1 9 6411 1 1 16 MET HA H -0.248 -12.796 0.709 1.00 . A A . 18 MET HA 1 1 9 6412 1 1 16 MET HB2 H -0.397 -15.608 0.231 1.00 . A A . 18 MET HB2 1 1 9 6413 1 1 16 MET HB3 H 1.254 -15.085 -0.100 1.00 . A A . 18 MET HB3 1 1 9 6414 1 1 16 MET HE1 H -0.394 -15.265 4.498 1.00 . A A . 18 MET HE1 1 1 9 6415 1 1 16 MET HE2 H 1.360 -15.301 4.647 1.00 . A A . 18 MET HE2 1 1 9 6416 1 1 16 MET HE3 H 0.422 -16.750 5.004 1.00 . A A . 18 MET HE3 1 1 9 6417 1 1 16 MET HG2 H 1.563 -14.257 2.075 1.00 . A A . 18 MET HG2 1 1 9 6418 1 1 16 MET HG3 H -0.170 -14.141 2.378 1.00 . A A . 18 MET HG3 1 1 9 6419 1 1 16 MET N N -1.554 -13.700 -0.682 1.00 . A A . 18 MET N 1 1 9 6420 1 1 16 MET O O 1.946 -13.232 -1.152 1.00 . A A . 18 MET O 1 1 9 6421 1 1 16 MET SD S 0.624 -16.387 2.642 1.00 . A A . 18 MET SD 1 1 9 6422 1 1 17 GLU C C 2.408 -11.045 -2.485 1.00 . A A . 19 GLU C 1 1 9 6423 1 1 17 GLU CA C 1.170 -11.638 -3.160 1.00 . A A . 19 GLU CA 1 1 9 6424 1 1 17 GLU CB C 0.435 -10.542 -3.935 1.00 . A A . 19 GLU CB 1 1 9 6425 1 1 17 GLU CD C 0.144 -10.205 -6.393 1.00 . A A . 19 GLU CD 1 1 9 6426 1 1 17 GLU CG C 1.162 -10.269 -5.253 1.00 . A A . 19 GLU CG 1 1 9 6427 1 1 17 GLU H H -0.686 -11.973 -2.113 1.00 . A A . 19 GLU H 1 1 9 6428 1 1 17 GLU HA H 1.466 -12.426 -3.838 1.00 . A A . 19 GLU HA 1 1 9 6429 1 1 17 GLU HB2 H -0.575 -10.863 -4.141 1.00 . A A . 19 GLU HB2 1 1 9 6430 1 1 17 GLU HB3 H 0.414 -9.638 -3.345 1.00 . A A . 19 GLU HB3 1 1 9 6431 1 1 17 GLU HG2 H 1.689 -9.328 -5.185 1.00 . A A . 19 GLU HG2 1 1 9 6432 1 1 17 GLU HG3 H 1.867 -11.063 -5.447 1.00 . A A . 19 GLU HG3 1 1 9 6433 1 1 17 GLU N N 0.269 -12.191 -2.109 1.00 . A A . 19 GLU N 1 1 9 6434 1 1 17 GLU O O 2.374 -10.687 -1.324 1.00 . A A . 19 GLU O 1 1 9 6435 1 1 17 GLU OE1 O -0.750 -9.378 -6.314 1.00 . A A . 19 GLU OE1 1 1 9 6436 1 1 17 GLU OE2 O 0.275 -10.981 -7.324 1.00 . A A . 19 GLU OE2 1 1 9 6437 1 1 18 TYR C C 5.178 -9.113 -3.286 1.00 . A A . 20 TYR C 1 1 9 6438 1 1 18 TYR CA C 4.728 -10.373 -2.552 1.00 . A A . 20 TYR CA 1 1 9 6439 1 1 18 TYR CB C 5.855 -11.397 -2.587 1.00 . A A . 20 TYR CB 1 1 9 6440 1 1 18 TYR CD1 C 7.609 -10.204 -1.232 1.00 . A A . 20 TYR CD1 1 1 9 6441 1 1 18 TYR CD2 C 6.529 -12.154 -0.279 1.00 . A A . 20 TYR CD2 1 1 9 6442 1 1 18 TYR CE1 C 8.377 -10.060 -0.073 1.00 . A A . 20 TYR CE1 1 1 9 6443 1 1 18 TYR CE2 C 7.296 -12.010 0.883 1.00 . A A . 20 TYR CE2 1 1 9 6444 1 1 18 TYR CG C 6.686 -11.251 -1.336 1.00 . A A . 20 TYR CG 1 1 9 6445 1 1 18 TYR CZ C 8.221 -10.962 0.986 1.00 . A A . 20 TYR CZ 1 1 9 6446 1 1 18 TYR H H 3.526 -11.237 -4.121 1.00 . A A . 20 TYR H 1 1 9 6447 1 1 18 TYR HA H 4.510 -10.122 -1.526 1.00 . A A . 20 TYR HA 1 1 9 6448 1 1 18 TYR HB2 H 5.441 -12.393 -2.638 1.00 . A A . 20 TYR HB2 1 1 9 6449 1 1 18 TYR HB3 H 6.471 -11.213 -3.451 1.00 . A A . 20 TYR HB3 1 1 9 6450 1 1 18 TYR HD1 H 7.728 -9.507 -2.049 1.00 . A A . 20 TYR HD1 1 1 9 6451 1 1 18 TYR HD2 H 5.817 -12.963 -0.359 1.00 . A A . 20 TYR HD2 1 1 9 6452 1 1 18 TYR HE1 H 9.089 -9.251 0.007 1.00 . A A . 20 TYR HE1 1 1 9 6453 1 1 18 TYR HE2 H 7.176 -12.706 1.700 1.00 . A A . 20 TYR HE2 1 1 9 6454 1 1 18 TYR HH H 8.389 -10.558 2.845 1.00 . A A . 20 TYR HH 1 1 9 6455 1 1 18 TYR N N 3.506 -10.940 -3.187 1.00 . A A . 20 TYR N 1 1 9 6456 1 1 18 TYR O O 5.713 -9.170 -4.372 1.00 . A A . 20 TYR O 1 1 9 6457 1 1 18 TYR OH O 8.977 -10.819 2.133 1.00 . A A . 20 TYR OH 1 1 9 6458 1 1 19 ARG C C 5.626 -5.683 -2.142 1.00 . A A . 21 ARG C 1 1 9 6459 1 1 19 ARG CA C 5.395 -6.684 -3.276 1.00 . A A . 21 ARG CA 1 1 9 6460 1 1 19 ARG CB C 4.301 -6.132 -4.203 1.00 . A A . 21 ARG CB 1 1 9 6461 1 1 19 ARG CD C 4.296 -7.841 -6.057 1.00 . A A . 21 ARG CD 1 1 9 6462 1 1 19 ARG CG C 3.516 -7.273 -4.861 1.00 . A A . 21 ARG CG 1 1 9 6463 1 1 19 ARG CZ C 5.971 -6.351 -6.982 1.00 . A A . 21 ARG CZ 1 1 9 6464 1 1 19 ARG H H 4.561 -7.989 -1.795 1.00 . A A . 21 ARG H 1 1 9 6465 1 1 19 ARG HA H 6.312 -6.819 -3.828 1.00 . A A . 21 ARG HA 1 1 9 6466 1 1 19 ARG HB2 H 3.622 -5.520 -3.626 1.00 . A A . 21 ARG HB2 1 1 9 6467 1 1 19 ARG HB3 H 4.758 -5.527 -4.971 1.00 . A A . 21 ARG HB3 1 1 9 6468 1 1 19 ARG HD2 H 4.363 -8.915 -5.963 1.00 . A A . 21 ARG HD2 1 1 9 6469 1 1 19 ARG HD3 H 3.775 -7.595 -6.971 1.00 . A A . 21 ARG HD3 1 1 9 6470 1 1 19 ARG HE H 6.351 -7.572 -5.465 1.00 . A A . 21 ARG HE 1 1 9 6471 1 1 19 ARG HG2 H 3.341 -8.055 -4.139 1.00 . A A . 21 ARG HG2 1 1 9 6472 1 1 19 ARG HG3 H 2.566 -6.894 -5.208 1.00 . A A . 21 ARG HG3 1 1 9 6473 1 1 19 ARG HH11 H 5.407 -7.463 -8.548 1.00 . A A . 21 ARG HH11 1 1 9 6474 1 1 19 ARG HH12 H 6.008 -5.884 -8.928 1.00 . A A . 21 ARG HH12 1 1 9 6475 1 1 19 ARG HH21 H 6.605 -5.026 -5.623 1.00 . A A . 21 ARG HH21 1 1 9 6476 1 1 19 ARG HH22 H 6.690 -4.505 -7.272 1.00 . A A . 21 ARG HH22 1 1 9 6477 1 1 19 ARG N N 4.977 -7.982 -2.673 1.00 . A A . 21 ARG N 1 1 9 6478 1 1 19 ARG NE N 5.672 -7.265 -6.100 1.00 . A A . 21 ARG NE 1 1 9 6479 1 1 19 ARG NH1 N 5.781 -6.584 -8.252 1.00 . A A . 21 ARG NH1 1 1 9 6480 1 1 19 ARG NH2 N 6.460 -5.204 -6.596 1.00 . A A . 21 ARG NH2 1 1 9 6481 1 1 19 ARG O O 4.702 -5.037 -1.694 1.00 . A A . 21 ARG O 1 1 9 6482 1 1 20 PRO C C 7.236 -3.229 -1.108 1.00 . A A . 22 PRO C 1 1 9 6483 1 1 20 PRO CA C 7.216 -4.674 -0.611 1.00 . A A . 22 PRO CA 1 1 9 6484 1 1 20 PRO CB C 8.610 -5.147 -0.193 1.00 . A A . 22 PRO CB 1 1 9 6485 1 1 20 PRO CD C 7.982 -6.360 -2.255 1.00 . A A . 22 PRO CD 1 1 9 6486 1 1 20 PRO CG C 9.188 -5.917 -1.402 1.00 . A A . 22 PRO CG 1 1 9 6487 1 1 20 PRO HA H 6.530 -4.781 0.214 1.00 . A A . 22 PRO HA 1 1 9 6488 1 1 20 PRO HB2 H 9.234 -4.296 0.044 1.00 . A A . 22 PRO HB2 1 1 9 6489 1 1 20 PRO HB3 H 8.539 -5.806 0.658 1.00 . A A . 22 PRO HB3 1 1 9 6490 1 1 20 PRO HD2 H 8.143 -6.113 -3.296 1.00 . A A . 22 PRO HD2 1 1 9 6491 1 1 20 PRO HD3 H 7.801 -7.418 -2.139 1.00 . A A . 22 PRO HD3 1 1 9 6492 1 1 20 PRO HG2 H 9.836 -5.270 -1.976 1.00 . A A . 22 PRO HG2 1 1 9 6493 1 1 20 PRO HG3 H 9.733 -6.784 -1.063 1.00 . A A . 22 PRO HG3 1 1 9 6494 1 1 20 PRO N N 6.850 -5.586 -1.704 1.00 . A A . 22 PRO N 1 1 9 6495 1 1 20 PRO O O 7.980 -2.874 -2.001 1.00 . A A . 22 PRO O 1 1 9 6496 1 1 21 LEU C C 6.115 -0.119 0.302 1.00 . A A . 23 LEU C 1 1 9 6497 1 1 21 LEU CA C 6.363 -0.966 -0.944 1.00 . A A . 23 LEU CA 1 1 9 6498 1 1 21 LEU CB C 5.220 -0.752 -1.941 1.00 . A A . 23 LEU CB 1 1 9 6499 1 1 21 LEU CD1 C 4.133 -1.948 -3.845 1.00 . A A . 23 LEU CD1 1 1 9 6500 1 1 21 LEU CD2 C 6.311 -0.777 -4.187 1.00 . A A . 23 LEU CD2 1 1 9 6501 1 1 21 LEU CG C 5.470 -1.587 -3.198 1.00 . A A . 23 LEU CG 1 1 9 6502 1 1 21 LEU H H 5.826 -2.717 0.185 1.00 . A A . 23 LEU H 1 1 9 6503 1 1 21 LEU HA H 7.302 -0.682 -1.396 1.00 . A A . 23 LEU HA 1 1 9 6504 1 1 21 LEU HB2 H 4.286 -1.054 -1.488 1.00 . A A . 23 LEU HB2 1 1 9 6505 1 1 21 LEU HB3 H 5.169 0.293 -2.210 1.00 . A A . 23 LEU HB3 1 1 9 6506 1 1 21 LEU HD11 H 4.295 -2.217 -4.879 1.00 . A A . 23 LEU HD11 1 1 9 6507 1 1 21 LEU HD12 H 3.467 -1.099 -3.794 1.00 . A A . 23 LEU HD12 1 1 9 6508 1 1 21 LEU HD13 H 3.693 -2.783 -3.321 1.00 . A A . 23 LEU HD13 1 1 9 6509 1 1 21 LEU HD21 H 5.660 -0.172 -4.800 1.00 . A A . 23 LEU HD21 1 1 9 6510 1 1 21 LEU HD22 H 6.875 -1.450 -4.815 1.00 . A A . 23 LEU HD22 1 1 9 6511 1 1 21 LEU HD23 H 6.990 -0.137 -3.642 1.00 . A A . 23 LEU HD23 1 1 9 6512 1 1 21 LEU HG H 5.995 -2.491 -2.932 1.00 . A A . 23 LEU HG 1 1 9 6513 1 1 21 LEU N N 6.414 -2.397 -0.530 1.00 . A A . 23 LEU N 1 1 9 6514 1 1 21 LEU O O 5.098 -0.244 0.951 1.00 . A A . 23 LEU O 1 1 9 6515 1 1 22 CYS C C 6.070 2.835 1.497 1.00 . A A . 24 CYS C 1 1 9 6516 1 1 22 CYS CA C 6.826 1.565 1.870 1.00 . A A . 24 CYS CA 1 1 9 6517 1 1 22 CYS CB C 8.174 1.934 2.494 1.00 . A A . 24 CYS CB 1 1 9 6518 1 1 22 CYS H H 7.851 0.829 0.126 1.00 . A A . 24 CYS H 1 1 9 6519 1 1 22 CYS HA H 6.246 1.000 2.582 1.00 . A A . 24 CYS HA 1 1 9 6520 1 1 22 CYS HB2 H 8.897 1.165 2.273 1.00 . A A . 24 CYS HB2 1 1 9 6521 1 1 22 CYS HB3 H 8.515 2.875 2.089 1.00 . A A . 24 CYS HB3 1 1 9 6522 1 1 22 CYS N N 7.032 0.738 0.653 1.00 . A A . 24 CYS N 1 1 9 6523 1 1 22 CYS O O 6.595 3.718 0.837 1.00 . A A . 24 CYS O 1 1 9 6524 1 1 22 CYS SG S 7.988 2.086 4.289 1.00 . A A . 24 CYS SG 1 1 9 6525 1 1 23 GLY C C 4.762 5.377 2.050 1.00 . A A . 25 GLY C 1 1 9 6526 1 1 23 GLY CA C 4.020 4.125 1.602 1.00 . A A . 25 GLY CA 1 1 9 6527 1 1 23 GLY H H 4.446 2.198 2.441 1.00 . A A . 25 GLY H 1 1 9 6528 1 1 23 GLY HA2 H 3.838 4.168 0.539 1.00 . A A . 25 GLY HA2 1 1 9 6529 1 1 23 GLY HA3 H 3.079 4.066 2.124 1.00 . A A . 25 GLY HA3 1 1 9 6530 1 1 23 GLY N N 4.836 2.926 1.916 1.00 . A A . 25 GLY N 1 1 9 6531 1 1 23 GLY O O 5.527 5.357 2.996 1.00 . A A . 25 GLY O 1 1 9 6532 1 1 24 SER C C 4.983 8.052 3.237 1.00 . A A . 26 SER C 1 1 9 6533 1 1 24 SER CA C 5.219 7.743 1.754 1.00 . A A . 26 SER CA 1 1 9 6534 1 1 24 SER CB C 4.661 8.893 0.912 1.00 . A A . 26 SER CB 1 1 9 6535 1 1 24 SER H H 3.911 6.446 0.621 1.00 . A A . 26 SER H 1 1 9 6536 1 1 24 SER HA H 6.279 7.648 1.574 1.00 . A A . 26 SER HA 1 1 9 6537 1 1 24 SER HB2 H 5.097 8.870 -0.071 1.00 . A A . 26 SER HB2 1 1 9 6538 1 1 24 SER HB3 H 3.587 8.791 0.830 1.00 . A A . 26 SER HB3 1 1 9 6539 1 1 24 SER HG H 5.570 10.613 0.946 1.00 . A A . 26 SER HG 1 1 9 6540 1 1 24 SER N N 4.535 6.468 1.378 1.00 . A A . 26 SER N 1 1 9 6541 1 1 24 SER O O 5.652 8.881 3.820 1.00 . A A . 26 SER O 1 1 9 6542 1 1 24 SER OG O 4.985 10.130 1.535 1.00 . A A . 26 SER OG 1 1 9 6543 1 1 25 ASP C C 4.755 6.936 6.184 1.00 . A A . 27 ASP C 1 1 9 6544 1 1 25 ASP CA C 3.748 7.671 5.287 1.00 . A A . 27 ASP CA 1 1 9 6545 1 1 25 ASP CB C 2.331 7.194 5.605 1.00 . A A . 27 ASP CB 1 1 9 6546 1 1 25 ASP CG C 2.308 5.666 5.682 1.00 . A A . 27 ASP CG 1 1 9 6547 1 1 25 ASP H H 3.492 6.748 3.362 1.00 . A A . 27 ASP H 1 1 9 6548 1 1 25 ASP HA H 3.814 8.733 5.472 1.00 . A A . 27 ASP HA 1 1 9 6549 1 1 25 ASP HB2 H 2.015 7.609 6.551 1.00 . A A . 27 ASP HB2 1 1 9 6550 1 1 25 ASP HB3 H 1.661 7.523 4.823 1.00 . A A . 27 ASP HB3 1 1 9 6551 1 1 25 ASP N N 4.032 7.403 3.849 1.00 . A A . 27 ASP N 1 1 9 6552 1 1 25 ASP O O 4.567 6.831 7.380 1.00 . A A . 27 ASP O 1 1 9 6553 1 1 25 ASP OD1 O 3.247 5.055 5.196 1.00 . A A . 27 ASP OD1 1 1 9 6554 1 1 25 ASP OD2 O 1.355 5.134 6.225 1.00 . A A . 27 ASP OD2 1 1 9 6555 1 1 26 ASN C C 6.284 4.369 6.913 1.00 . A A . 28 ASN C 1 1 9 6556 1 1 26 ASN CA C 6.838 5.722 6.458 1.00 . A A . 28 ASN CA 1 1 9 6557 1 1 26 ASN CB C 7.171 6.569 7.688 1.00 . A A . 28 ASN CB 1 1 9 6558 1 1 26 ASN CG C 8.641 6.368 8.062 1.00 . A A . 28 ASN CG 1 1 9 6559 1 1 26 ASN H H 5.967 6.533 4.664 1.00 . A A . 28 ASN H 1 1 9 6560 1 1 26 ASN HA H 7.734 5.566 5.877 1.00 . A A . 28 ASN HA 1 1 9 6561 1 1 26 ASN HB2 H 6.994 7.610 7.467 1.00 . A A . 28 ASN HB2 1 1 9 6562 1 1 26 ASN HB3 H 6.547 6.263 8.515 1.00 . A A . 28 ASN HB3 1 1 9 6563 1 1 26 ASN HD21 H 9.280 7.863 6.923 1.00 . A A . 28 ASN HD21 1 1 9 6564 1 1 26 ASN HD22 H 10.490 7.033 7.776 1.00 . A A . 28 ASN HD22 1 1 9 6565 1 1 26 ASN N N 5.824 6.435 5.626 1.00 . A A . 28 ASN N 1 1 9 6566 1 1 26 ASN ND2 N 9.546 7.153 7.544 1.00 . A A . 28 ASN ND2 1 1 9 6567 1 1 26 ASN O O 6.553 3.917 8.008 1.00 . A A . 28 ASN O 1 1 9 6568 1 1 26 ASN OD1 O 8.971 5.488 8.832 1.00 . A A . 28 ASN OD1 1 1 9 6569 1 1 27 LYS C C 5.278 1.355 5.413 1.00 . A A . 29 LYS C 1 1 9 6570 1 1 27 LYS CA C 4.954 2.392 6.485 1.00 . A A . 29 LYS CA 1 1 9 6571 1 1 27 LYS CB C 3.436 2.504 6.640 1.00 . A A . 29 LYS CB 1 1 9 6572 1 1 27 LYS CD C 2.118 0.973 8.113 1.00 . A A . 29 LYS CD 1 1 9 6573 1 1 27 LYS CE C 3.074 0.347 9.130 1.00 . A A . 29 LYS CE 1 1 9 6574 1 1 27 LYS CG C 2.825 1.104 6.763 1.00 . A A . 29 LYS CG 1 1 9 6575 1 1 27 LYS H H 5.307 4.096 5.203 1.00 . A A . 29 LYS H 1 1 9 6576 1 1 27 LYS HA H 5.389 2.086 7.420 1.00 . A A . 29 LYS HA 1 1 9 6577 1 1 27 LYS HB2 H 3.207 3.075 7.527 1.00 . A A . 29 LYS HB2 1 1 9 6578 1 1 27 LYS HB3 H 3.022 3.000 5.776 1.00 . A A . 29 LYS HB3 1 1 9 6579 1 1 27 LYS HD2 H 1.814 1.950 8.456 1.00 . A A . 29 LYS HD2 1 1 9 6580 1 1 27 LYS HD3 H 1.249 0.342 8.004 1.00 . A A . 29 LYS HD3 1 1 9 6581 1 1 27 LYS HE2 H 2.505 -0.147 9.904 1.00 . A A . 29 LYS HE2 1 1 9 6582 1 1 27 LYS HE3 H 3.708 -0.374 8.634 1.00 . A A . 29 LYS HE3 1 1 9 6583 1 1 27 LYS HG2 H 2.111 0.953 5.966 1.00 . A A . 29 LYS HG2 1 1 9 6584 1 1 27 LYS HG3 H 3.604 0.362 6.694 1.00 . A A . 29 LYS HG3 1 1 9 6585 1 1 27 LYS HZ1 H 4.824 1.474 9.231 1.00 . A A . 29 LYS HZ1 1 1 9 6586 1 1 27 LYS HZ2 H 4.097 1.185 10.740 1.00 . A A . 29 LYS HZ2 1 1 9 6587 1 1 27 LYS HZ3 H 3.426 2.326 9.675 1.00 . A A . 29 LYS HZ3 1 1 9 6588 1 1 27 LYS N N 5.515 3.716 6.085 1.00 . A A . 29 LYS N 1 1 9 6589 1 1 27 LYS NZ N 3.919 1.414 9.740 1.00 . A A . 29 LYS NZ 1 1 9 6590 1 1 27 LYS O O 5.224 1.637 4.240 1.00 . A A . 29 LYS O 1 1 9 6591 1 1 28 THR C C 4.624 -1.632 4.430 1.00 . A A . 30 THR C 1 1 9 6592 1 1 28 THR CA C 5.915 -0.895 4.792 1.00 . A A . 30 THR CA 1 1 9 6593 1 1 28 THR CB C 6.933 -1.888 5.358 1.00 . A A . 30 THR CB 1 1 9 6594 1 1 28 THR CG2 C 7.210 -2.979 4.322 1.00 . A A . 30 THR CG2 1 1 9 6595 1 1 28 THR H H 5.633 -0.062 6.761 1.00 . A A . 30 THR H 1 1 9 6596 1 1 28 THR HA H 6.321 -0.427 3.906 1.00 . A A . 30 THR HA 1 1 9 6597 1 1 28 THR HB H 6.537 -2.341 6.254 1.00 . A A . 30 THR HB 1 1 9 6598 1 1 28 THR HG1 H 8.795 -1.860 5.926 1.00 . A A . 30 THR HG1 1 1 9 6599 1 1 28 THR HG21 H 6.666 -2.759 3.414 1.00 . A A . 30 THR HG21 1 1 9 6600 1 1 28 THR HG22 H 6.889 -3.935 4.710 1.00 . A A . 30 THR HG22 1 1 9 6601 1 1 28 THR HG23 H 8.268 -3.015 4.108 1.00 . A A . 30 THR HG23 1 1 9 6602 1 1 28 THR N N 5.604 0.153 5.805 1.00 . A A . 30 THR N 1 1 9 6603 1 1 28 THR O O 3.823 -1.954 5.286 1.00 . A A . 30 THR O 1 1 9 6604 1 1 28 THR OG1 O 8.143 -1.206 5.664 1.00 . A A . 30 THR OG1 1 1 9 6605 1 1 29 TYR C C 3.501 -4.023 2.330 1.00 . A A . 31 TYR C 1 1 9 6606 1 1 29 TYR CA C 3.166 -2.592 2.754 1.00 . A A . 31 TYR CA 1 1 9 6607 1 1 29 TYR CB C 2.548 -1.836 1.579 1.00 . A A . 31 TYR CB 1 1 9 6608 1 1 29 TYR CD1 C 0.423 -0.852 2.514 1.00 . A A . 31 TYR CD1 1 1 9 6609 1 1 29 TYR CD2 C 2.334 0.601 2.185 1.00 . A A . 31 TYR CD2 1 1 9 6610 1 1 29 TYR CE1 C -0.318 0.230 3.003 1.00 . A A . 31 TYR CE1 1 1 9 6611 1 1 29 TYR CE2 C 1.593 1.684 2.676 1.00 . A A . 31 TYR CE2 1 1 9 6612 1 1 29 TYR CG C 1.748 -0.667 2.104 1.00 . A A . 31 TYR CG 1 1 9 6613 1 1 29 TYR CZ C 0.269 1.498 3.084 1.00 . A A . 31 TYR CZ 1 1 9 6614 1 1 29 TYR H H 5.060 -1.616 2.497 1.00 . A A . 31 TYR H 1 1 9 6615 1 1 29 TYR HA H 2.467 -2.613 3.575 1.00 . A A . 31 TYR HA 1 1 9 6616 1 1 29 TYR HB2 H 3.335 -1.473 0.932 1.00 . A A . 31 TYR HB2 1 1 9 6617 1 1 29 TYR HB3 H 1.904 -2.496 1.028 1.00 . A A . 31 TYR HB3 1 1 9 6618 1 1 29 TYR HD1 H -0.029 -1.830 2.452 1.00 . A A . 31 TYR HD1 1 1 9 6619 1 1 29 TYR HD2 H 3.355 0.745 1.870 1.00 . A A . 31 TYR HD2 1 1 9 6620 1 1 29 TYR HE1 H -1.340 0.087 3.319 1.00 . A A . 31 TYR HE1 1 1 9 6621 1 1 29 TYR HE2 H 2.044 2.662 2.739 1.00 . A A . 31 TYR HE2 1 1 9 6622 1 1 29 TYR HH H -0.114 2.792 4.436 1.00 . A A . 31 TYR HH 1 1 9 6623 1 1 29 TYR N N 4.409 -1.891 3.171 1.00 . A A . 31 TYR N 1 1 9 6624 1 1 29 TYR O O 4.479 -4.266 1.651 1.00 . A A . 31 TYR O 1 1 9 6625 1 1 29 TYR OH O -0.461 2.566 3.569 1.00 . A A . 31 TYR OH 1 1 9 6626 1 1 30 GLY C C 2.872 -6.542 0.831 1.00 . A A . 32 GLY C 1 1 9 6627 1 1 30 GLY CA C 2.968 -6.387 2.348 1.00 . A A . 32 GLY CA 1 1 9 6628 1 1 30 GLY H H 1.912 -4.753 3.273 1.00 . A A . 32 GLY H 1 1 9 6629 1 1 30 GLY HA2 H 3.961 -6.661 2.677 1.00 . A A . 32 GLY HA2 1 1 9 6630 1 1 30 GLY HA3 H 2.243 -7.032 2.818 1.00 . A A . 32 GLY HA3 1 1 9 6631 1 1 30 GLY N N 2.695 -4.971 2.726 1.00 . A A . 32 GLY N 1 1 9 6632 1 1 30 GLY O O 3.607 -7.298 0.228 1.00 . A A . 32 GLY O 1 1 9 6633 1 1 31 ASN C C 0.976 -4.791 -1.790 1.00 . A A . 33 ASN C 1 1 9 6634 1 1 31 ASN CA C 1.842 -5.938 -1.272 1.00 . A A . 33 ASN CA 1 1 9 6635 1 1 31 ASN CB C 1.193 -7.275 -1.638 1.00 . A A . 33 ASN CB 1 1 9 6636 1 1 31 ASN CG C 0.024 -7.555 -0.693 1.00 . A A . 33 ASN CG 1 1 9 6637 1 1 31 ASN H H 1.393 -5.221 0.705 1.00 . A A . 33 ASN H 1 1 9 6638 1 1 31 ASN HA H 2.819 -5.881 -1.724 1.00 . A A . 33 ASN HA 1 1 9 6639 1 1 31 ASN HB2 H 0.829 -7.231 -2.655 1.00 . A A . 33 ASN HB2 1 1 9 6640 1 1 31 ASN HB3 H 1.922 -8.066 -1.550 1.00 . A A . 33 ASN HB3 1 1 9 6641 1 1 31 ASN HD21 H 0.421 -9.496 -0.552 1.00 . A A . 33 ASN HD21 1 1 9 6642 1 1 31 ASN HD22 H -0.918 -8.963 0.344 1.00 . A A . 33 ASN HD22 1 1 9 6643 1 1 31 ASN N N 1.975 -5.830 0.205 1.00 . A A . 33 ASN N 1 1 9 6644 1 1 31 ASN ND2 N -0.175 -8.773 -0.264 1.00 . A A . 33 ASN ND2 1 1 9 6645 1 1 31 ASN O O 0.352 -4.075 -1.033 1.00 . A A . 33 ASN O 1 1 9 6646 1 1 31 ASN OD1 O -0.716 -6.659 -0.342 1.00 . A A . 33 ASN OD1 1 1 9 6647 1 1 32 LYS C C -1.347 -3.707 -3.305 1.00 . A A . 34 LYS C 1 1 9 6648 1 1 32 LYS CA C 0.124 -3.515 -3.667 1.00 . A A . 34 LYS CA 1 1 9 6649 1 1 32 LYS CB C 0.281 -3.511 -5.191 1.00 . A A . 34 LYS CB 1 1 9 6650 1 1 32 LYS CD C -1.004 -4.535 -7.077 1.00 . A A . 34 LYS CD 1 1 9 6651 1 1 32 LYS CE C -0.887 -5.744 -8.008 1.00 . A A . 34 LYS CE 1 1 9 6652 1 1 32 LYS CG C -0.263 -4.820 -5.768 1.00 . A A . 34 LYS CG 1 1 9 6653 1 1 32 LYS H H 1.456 -5.198 -3.662 1.00 . A A . 34 LYS H 1 1 9 6654 1 1 32 LYS HA H 0.461 -2.573 -3.269 1.00 . A A . 34 LYS HA 1 1 9 6655 1 1 32 LYS HB2 H -0.269 -2.678 -5.605 1.00 . A A . 34 LYS HB2 1 1 9 6656 1 1 32 LYS HB3 H 1.326 -3.415 -5.444 1.00 . A A . 34 LYS HB3 1 1 9 6657 1 1 32 LYS HD2 H -2.046 -4.343 -6.867 1.00 . A A . 34 LYS HD2 1 1 9 6658 1 1 32 LYS HD3 H -0.569 -3.671 -7.558 1.00 . A A . 34 LYS HD3 1 1 9 6659 1 1 32 LYS HE2 H 0.150 -6.037 -8.089 1.00 . A A . 34 LYS HE2 1 1 9 6660 1 1 32 LYS HE3 H -1.462 -6.565 -7.607 1.00 . A A . 34 LYS HE3 1 1 9 6661 1 1 32 LYS HG2 H 0.557 -5.498 -5.957 1.00 . A A . 34 LYS HG2 1 1 9 6662 1 1 32 LYS HG3 H -0.945 -5.270 -5.062 1.00 . A A . 34 LYS HG3 1 1 9 6663 1 1 32 LYS HZ1 H -0.641 -4.977 -9.929 1.00 . A A . 34 LYS HZ1 1 1 9 6664 1 1 32 LYS HZ2 H -2.176 -4.689 -9.258 1.00 . A A . 34 LYS HZ2 1 1 9 6665 1 1 32 LYS HZ3 H -1.770 -6.238 -9.828 1.00 . A A . 34 LYS HZ3 1 1 9 6666 1 1 32 LYS N N 0.940 -4.612 -3.080 1.00 . A A . 34 LYS N 1 1 9 6667 1 1 32 LYS NZ N -1.407 -5.385 -9.358 1.00 . A A . 34 LYS NZ 1 1 9 6668 1 1 32 LYS O O -2.158 -2.829 -3.504 1.00 . A A . 34 LYS O 1 1 9 6669 1 1 33 CYS C C -3.365 -4.277 -1.075 1.00 . A A . 35 CYS C 1 1 9 6670 1 1 33 CYS CA C -3.122 -5.039 -2.376 1.00 . A A . 35 CYS CA 1 1 9 6671 1 1 33 CYS CB C -3.382 -6.531 -2.162 1.00 . A A . 35 CYS CB 1 1 9 6672 1 1 33 CYS H H -1.043 -5.538 -2.593 1.00 . A A . 35 CYS H 1 1 9 6673 1 1 33 CYS HA H -3.770 -4.658 -3.150 1.00 . A A . 35 CYS HA 1 1 9 6674 1 1 33 CYS HB2 H -3.144 -7.069 -3.068 1.00 . A A . 35 CYS HB2 1 1 9 6675 1 1 33 CYS HB3 H -2.760 -6.892 -1.357 1.00 . A A . 35 CYS HB3 1 1 9 6676 1 1 33 CYS N N -1.704 -4.835 -2.761 1.00 . A A . 35 CYS N 1 1 9 6677 1 1 33 CYS O O -4.408 -3.685 -0.862 1.00 . A A . 35 CYS O 1 1 9 6678 1 1 33 CYS SG S -5.123 -6.792 -1.746 1.00 . A A . 35 CYS SG 1 1 9 6679 1 1 34 ASN C C -2.133 -2.084 0.852 1.00 . A A . 36 ASN C 1 1 9 6680 1 1 34 ASN CA C -2.523 -3.543 1.072 1.00 . A A . 36 ASN CA 1 1 9 6681 1 1 34 ASN CB C -1.593 -4.176 2.107 1.00 . A A . 36 ASN CB 1 1 9 6682 1 1 34 ASN CG C -2.355 -4.391 3.415 1.00 . A A . 36 ASN CG 1 1 9 6683 1 1 34 ASN H H -1.550 -4.734 -0.422 1.00 . A A . 36 ASN H 1 1 9 6684 1 1 34 ASN HA H -3.544 -3.600 1.417 1.00 . A A . 36 ASN HA 1 1 9 6685 1 1 34 ASN HB2 H -1.234 -5.126 1.736 1.00 . A A . 36 ASN HB2 1 1 9 6686 1 1 34 ASN HB3 H -0.755 -3.523 2.282 1.00 . A A . 36 ASN HB3 1 1 9 6687 1 1 34 ASN HD21 H -3.554 -5.775 2.648 1.00 . A A . 36 ASN HD21 1 1 9 6688 1 1 34 ASN HD22 H -3.819 -5.410 4.285 1.00 . A A . 36 ASN HD22 1 1 9 6689 1 1 34 ASN N N -2.387 -4.271 -0.212 1.00 . A A . 36 ASN N 1 1 9 6690 1 1 34 ASN ND2 N -3.323 -5.264 3.453 1.00 . A A . 36 ASN ND2 1 1 9 6691 1 1 34 ASN O O -2.429 -1.220 1.655 1.00 . A A . 36 ASN O 1 1 9 6692 1 1 34 ASN OD1 O -2.066 -3.759 4.412 1.00 . A A . 36 ASN OD1 1 1 9 6693 1 1 35 PHE C C -2.226 0.346 -1.159 1.00 . A A . 37 PHE C 1 1 9 6694 1 1 35 PHE CA C -1.055 -0.408 -0.526 1.00 . A A . 37 PHE CA 1 1 9 6695 1 1 35 PHE CB C 0.121 -0.422 -1.503 1.00 . A A . 37 PHE CB 1 1 9 6696 1 1 35 PHE CD1 C 1.277 1.800 -1.169 1.00 . A A . 37 PHE CD1 1 1 9 6697 1 1 35 PHE CD2 C -0.156 1.497 -3.104 1.00 . A A . 37 PHE CD2 1 1 9 6698 1 1 35 PHE CE1 C 1.548 3.114 -1.576 1.00 . A A . 37 PHE CE1 1 1 9 6699 1 1 35 PHE CE2 C 0.115 2.807 -3.510 1.00 . A A . 37 PHE CE2 1 1 9 6700 1 1 35 PHE CG C 0.425 0.992 -1.936 1.00 . A A . 37 PHE CG 1 1 9 6701 1 1 35 PHE CZ C 0.964 3.616 -2.747 1.00 . A A . 37 PHE CZ 1 1 9 6702 1 1 35 PHE H H -1.246 -2.521 -0.867 1.00 . A A . 37 PHE H 1 1 9 6703 1 1 35 PHE HA H -0.764 0.082 0.390 1.00 . A A . 37 PHE HA 1 1 9 6704 1 1 35 PHE HB2 H 0.988 -0.856 -1.025 1.00 . A A . 37 PHE HB2 1 1 9 6705 1 1 35 PHE HB3 H -0.141 -1.013 -2.369 1.00 . A A . 37 PHE HB3 1 1 9 6706 1 1 35 PHE HD1 H 1.724 1.410 -0.266 1.00 . A A . 37 PHE HD1 1 1 9 6707 1 1 35 PHE HD2 H -0.812 0.873 -3.693 1.00 . A A . 37 PHE HD2 1 1 9 6708 1 1 35 PHE HE1 H 2.205 3.741 -0.986 1.00 . A A . 37 PHE HE1 1 1 9 6709 1 1 35 PHE HE2 H -0.333 3.196 -4.410 1.00 . A A . 37 PHE HE2 1 1 9 6710 1 1 35 PHE HZ H 1.168 4.626 -3.064 1.00 . A A . 37 PHE HZ 1 1 9 6711 1 1 35 PHE N N -1.470 -1.806 -0.237 1.00 . A A . 37 PHE N 1 1 9 6712 1 1 35 PHE O O -2.563 1.442 -0.759 1.00 . A A . 37 PHE O 1 1 9 6713 1 1 36 CYS C C -5.189 0.445 -1.848 1.00 . A A . 38 CYS C 1 1 9 6714 1 1 36 CYS CA C -3.998 0.435 -2.804 1.00 . A A . 38 CYS CA 1 1 9 6715 1 1 36 CYS CB C -4.373 -0.324 -4.078 1.00 . A A . 38 CYS CB 1 1 9 6716 1 1 36 CYS H H -2.563 -1.121 -2.445 1.00 . A A . 38 CYS H 1 1 9 6717 1 1 36 CYS HA H -3.728 1.450 -3.055 1.00 . A A . 38 CYS HA 1 1 9 6718 1 1 36 CYS HB2 H -4.713 -1.316 -3.819 1.00 . A A . 38 CYS HB2 1 1 9 6719 1 1 36 CYS HB3 H -5.162 0.204 -4.593 1.00 . A A . 38 CYS HB3 1 1 9 6720 1 1 36 CYS N N -2.849 -0.238 -2.143 1.00 . A A . 38 CYS N 1 1 9 6721 1 1 36 CYS O O -6.090 1.250 -1.972 1.00 . A A . 38 CYS O 1 1 9 6722 1 1 36 CYS SG S -2.924 -0.447 -5.156 1.00 . A A . 38 CYS SG 1 1 9 6723 1 1 37 CYS C C -6.199 0.728 1.025 1.00 . A A . 39 CYS C 1 1 9 6724 1 1 37 CYS CA C -6.335 -0.461 0.077 1.00 . A A . 39 CYS CA 1 1 9 6725 1 1 37 CYS CB C -6.299 -1.761 0.882 1.00 . A A . 39 CYS CB 1 1 9 6726 1 1 37 CYS H H -4.460 -1.081 -0.793 1.00 . A A . 39 CYS H 1 1 9 6727 1 1 37 CYS HA H -7.267 -0.391 -0.459 1.00 . A A . 39 CYS HA 1 1 9 6728 1 1 37 CYS HB2 H -6.180 -2.599 0.211 1.00 . A A . 39 CYS HB2 1 1 9 6729 1 1 37 CYS HB3 H -5.469 -1.733 1.573 1.00 . A A . 39 CYS HB3 1 1 9 6730 1 1 37 CYS N N -5.201 -0.439 -0.886 1.00 . A A . 39 CYS N 1 1 9 6731 1 1 37 CYS O O -7.141 1.457 1.276 1.00 . A A . 39 CYS O 1 1 9 6732 1 1 37 CYS SG S -7.846 -1.943 1.805 1.00 . A A . 39 CYS SG 1 1 9 6733 1 1 38 ALA C C -4.833 3.383 1.682 1.00 . A A . 40 ALA C 1 1 9 6734 1 1 38 ALA CA C -4.805 2.074 2.474 1.00 . A A . 40 ALA CA 1 1 9 6735 1 1 38 ALA CB C -3.445 1.920 3.158 1.00 . A A . 40 ALA CB 1 1 9 6736 1 1 38 ALA H H -4.282 0.333 1.317 1.00 . A A . 40 ALA H 1 1 9 6737 1 1 38 ALA HA H -5.585 2.086 3.220 1.00 . A A . 40 ALA HA 1 1 9 6738 1 1 38 ALA HB1 H -3.097 2.888 3.489 1.00 . A A . 40 ALA HB1 1 1 9 6739 1 1 38 ALA HB2 H -2.736 1.504 2.459 1.00 . A A . 40 ALA HB2 1 1 9 6740 1 1 38 ALA HB3 H -3.542 1.263 4.008 1.00 . A A . 40 ALA HB3 1 1 9 6741 1 1 38 ALA N N -5.024 0.932 1.544 1.00 . A A . 40 ALA N 1 1 9 6742 1 1 38 ALA O O -5.110 4.438 2.218 1.00 . A A . 40 ALA O 1 1 9 6743 1 1 39 VAL C C -6.016 4.976 -0.660 1.00 . A A . 41 VAL C 1 1 9 6744 1 1 39 VAL CA C -4.569 4.558 -0.419 1.00 . A A . 41 VAL CA 1 1 9 6745 1 1 39 VAL CB C -3.883 4.285 -1.759 1.00 . A A . 41 VAL CB 1 1 9 6746 1 1 39 VAL CG1 C -4.170 5.434 -2.727 1.00 . A A . 41 VAL CG1 1 1 9 6747 1 1 39 VAL CG2 C -2.372 4.167 -1.546 1.00 . A A . 41 VAL CG2 1 1 9 6748 1 1 39 VAL H H -4.339 2.458 -0.003 1.00 . A A . 41 VAL H 1 1 9 6749 1 1 39 VAL HA H -4.050 5.348 0.102 1.00 . A A . 41 VAL HA 1 1 9 6750 1 1 39 VAL HB H -4.263 3.362 -2.176 1.00 . A A . 41 VAL HB 1 1 9 6751 1 1 39 VAL HG11 H -3.242 5.789 -3.150 1.00 . A A . 41 VAL HG11 1 1 9 6752 1 1 39 VAL HG12 H -4.656 6.239 -2.196 1.00 . A A . 41 VAL HG12 1 1 9 6753 1 1 39 VAL HG13 H -4.817 5.085 -3.519 1.00 . A A . 41 VAL HG13 1 1 9 6754 1 1 39 VAL HG21 H -1.972 3.422 -2.216 1.00 . A A . 41 VAL HG21 1 1 9 6755 1 1 39 VAL HG22 H -2.176 3.877 -0.524 1.00 . A A . 41 VAL HG22 1 1 9 6756 1 1 39 VAL HG23 H -1.906 5.120 -1.746 1.00 . A A . 41 VAL HG23 1 1 9 6757 1 1 39 VAL N N -4.554 3.320 0.410 1.00 . A A . 41 VAL N 1 1 9 6758 1 1 39 VAL O O -6.364 6.137 -0.572 1.00 . A A . 41 VAL O 1 1 9 6759 1 1 40 VAL C C -8.862 5.016 0.064 1.00 . A A . 42 VAL C 1 1 9 6760 1 1 40 VAL CA C -8.291 4.370 -1.197 1.00 . A A . 42 VAL CA 1 1 9 6761 1 1 40 VAL CB C -9.072 3.095 -1.519 1.00 . A A . 42 VAL CB 1 1 9 6762 1 1 40 VAL CG1 C -10.542 3.439 -1.755 1.00 . A A . 42 VAL CG1 1 1 9 6763 1 1 40 VAL CG2 C -8.492 2.449 -2.779 1.00 . A A . 42 VAL CG2 1 1 9 6764 1 1 40 VAL H H -6.558 3.105 -1.016 1.00 . A A . 42 VAL H 1 1 9 6765 1 1 40 VAL HA H -8.369 5.062 -2.023 1.00 . A A . 42 VAL HA 1 1 9 6766 1 1 40 VAL HB H -8.992 2.406 -0.691 1.00 . A A . 42 VAL HB 1 1 9 6767 1 1 40 VAL HG11 H -11.164 2.634 -1.394 1.00 . A A . 42 VAL HG11 1 1 9 6768 1 1 40 VAL HG12 H -10.714 3.580 -2.812 1.00 . A A . 42 VAL HG12 1 1 9 6769 1 1 40 VAL HG13 H -10.788 4.349 -1.228 1.00 . A A . 42 VAL HG13 1 1 9 6770 1 1 40 VAL HG21 H -7.634 3.016 -3.112 1.00 . A A . 42 VAL HG21 1 1 9 6771 1 1 40 VAL HG22 H -9.241 2.441 -3.556 1.00 . A A . 42 VAL HG22 1 1 9 6772 1 1 40 VAL HG23 H -8.191 1.436 -2.558 1.00 . A A . 42 VAL HG23 1 1 9 6773 1 1 40 VAL N N -6.863 4.034 -0.958 1.00 . A A . 42 VAL N 1 1 9 6774 1 1 40 VAL O O -9.736 5.858 0.004 1.00 . A A . 42 VAL O 1 1 9 6775 1 1 41 GLU C C -8.211 6.586 2.693 1.00 . A A . 43 GLU C 1 1 9 6776 1 1 41 GLU CA C -8.874 5.224 2.476 1.00 . A A . 43 GLU CA 1 1 9 6777 1 1 41 GLU CB C -8.535 4.299 3.646 1.00 . A A . 43 GLU CB 1 1 9 6778 1 1 41 GLU CD C -9.629 2.162 4.333 1.00 . A A . 43 GLU CD 1 1 9 6779 1 1 41 GLU CG C -8.800 2.847 3.245 1.00 . A A . 43 GLU CG 1 1 9 6780 1 1 41 GLU H H -7.658 3.950 1.234 1.00 . A A . 43 GLU H 1 1 9 6781 1 1 41 GLU HA H -9.945 5.349 2.413 1.00 . A A . 43 GLU HA 1 1 9 6782 1 1 41 GLU HB2 H -7.492 4.416 3.906 1.00 . A A . 43 GLU HB2 1 1 9 6783 1 1 41 GLU HB3 H -9.149 4.554 4.496 1.00 . A A . 43 GLU HB3 1 1 9 6784 1 1 41 GLU HG2 H -9.343 2.825 2.311 1.00 . A A . 43 GLU HG2 1 1 9 6785 1 1 41 GLU HG3 H -7.862 2.327 3.129 1.00 . A A . 43 GLU HG3 1 1 9 6786 1 1 41 GLU N N -8.368 4.629 1.209 1.00 . A A . 43 GLU N 1 1 9 6787 1 1 41 GLU O O -8.777 7.474 3.299 1.00 . A A . 43 GLU O 1 1 9 6788 1 1 41 GLU OE1 O -9.048 1.761 5.328 1.00 . A A . 43 GLU OE1 1 1 9 6789 1 1 41 GLU OE2 O -10.830 2.049 4.153 1.00 . A A . 43 GLU OE2 1 1 9 6790 1 1 42 SER C C -6.874 9.080 1.382 1.00 . A A . 44 SER C 1 1 9 6791 1 1 42 SER CA C -6.314 8.061 2.377 1.00 . A A . 44 SER CA 1 1 9 6792 1 1 42 SER CB C -4.817 7.875 2.125 1.00 . A A . 44 SER CB 1 1 9 6793 1 1 42 SER H H -6.575 6.029 1.714 1.00 . A A . 44 SER H 1 1 9 6794 1 1 42 SER HA H -6.468 8.420 3.385 1.00 . A A . 44 SER HA 1 1 9 6795 1 1 42 SER HB2 H -4.612 6.840 1.907 1.00 . A A . 44 SER HB2 1 1 9 6796 1 1 42 SER HB3 H -4.516 8.485 1.284 1.00 . A A . 44 SER HB3 1 1 9 6797 1 1 42 SER HG H -4.445 9.101 3.590 1.00 . A A . 44 SER HG 1 1 9 6798 1 1 42 SER N N -7.013 6.758 2.201 1.00 . A A . 44 SER N 1 1 9 6799 1 1 42 SER O O -6.559 10.253 1.435 1.00 . A A . 44 SER O 1 1 9 6800 1 1 42 SER OG O -4.094 8.259 3.288 1.00 . A A . 44 SER OG 1 1 9 6801 1 1 43 ASN C C -7.206 9.957 -1.554 1.00 . A A . 45 ASN C 1 1 9 6802 1 1 43 ASN CA C -8.277 9.591 -0.526 1.00 . A A . 45 ASN CA 1 1 9 6803 1 1 43 ASN CB C -8.749 10.857 0.189 1.00 . A A . 45 ASN CB 1 1 9 6804 1 1 43 ASN CG C -10.092 11.304 -0.392 1.00 . A A . 45 ASN CG 1 1 9 6805 1 1 43 ASN H H -7.941 7.696 0.442 1.00 . A A . 45 ASN H 1 1 9 6806 1 1 43 ASN HA H -9.113 9.124 -1.025 1.00 . A A . 45 ASN HA 1 1 9 6807 1 1 43 ASN HB2 H -8.861 10.654 1.244 1.00 . A A . 45 ASN HB2 1 1 9 6808 1 1 43 ASN HB3 H -8.021 11.642 0.049 1.00 . A A . 45 ASN HB3 1 1 9 6809 1 1 43 ASN HD21 H -10.683 12.187 1.286 1.00 . A A . 45 ASN HD21 1 1 9 6810 1 1 43 ASN HD22 H -11.785 12.265 -0.003 1.00 . A A . 45 ASN HD22 1 1 9 6811 1 1 43 ASN N N -7.701 8.645 0.471 1.00 . A A . 45 ASN N 1 1 9 6812 1 1 43 ASN ND2 N -10.922 11.975 0.359 1.00 . A A . 45 ASN ND2 1 1 9 6813 1 1 43 ASN O O -7.355 10.889 -2.317 1.00 . A A . 45 ASN O 1 1 9 6814 1 1 43 ASN OD1 O -10.389 11.041 -1.540 1.00 . A A . 45 ASN OD1 1 1 9 6815 1 1 44 GLY C C -4.004 10.444 -1.886 1.00 . A A . 46 GLY C 1 1 9 6816 1 1 44 GLY CA C -5.039 9.538 -2.552 1.00 . A A . 46 GLY CA 1 1 9 6817 1 1 44 GLY H H -6.019 8.483 -0.951 1.00 . A A . 46 GLY H 1 1 9 6818 1 1 44 GLY HA2 H -4.567 8.619 -2.869 1.00 . A A . 46 GLY HA2 1 1 9 6819 1 1 44 GLY HA3 H -5.458 10.045 -3.409 1.00 . A A . 46 GLY HA3 1 1 9 6820 1 1 44 GLY N N -6.122 9.230 -1.577 1.00 . A A . 46 GLY N 1 1 9 6821 1 1 44 GLY O O -3.186 11.057 -2.542 1.00 . A A . 46 GLY O 1 1 9 6822 1 1 45 THR C C -1.895 10.538 0.643 1.00 . A A . 47 THR C 1 1 9 6823 1 1 45 THR CA C -3.052 11.399 0.127 1.00 . A A . 47 THR CA 1 1 9 6824 1 1 45 THR CB C -3.743 12.095 1.304 1.00 . A A . 47 THR CB 1 1 9 6825 1 1 45 THR CG2 C -3.990 11.086 2.427 1.00 . A A . 47 THR CG2 1 1 9 6826 1 1 45 THR H H -4.704 10.029 -0.074 1.00 . A A . 47 THR H 1 1 9 6827 1 1 45 THR HA H -2.668 12.144 -0.556 1.00 . A A . 47 THR HA 1 1 9 6828 1 1 45 THR HB H -4.687 12.502 0.977 1.00 . A A . 47 THR HB 1 1 9 6829 1 1 45 THR HG1 H -2.309 12.773 2.429 1.00 . A A . 47 THR HG1 1 1 9 6830 1 1 45 THR HG21 H -4.984 11.226 2.825 1.00 . A A . 47 THR HG21 1 1 9 6831 1 1 45 THR HG22 H -3.264 11.235 3.211 1.00 . A A . 47 THR HG22 1 1 9 6832 1 1 45 THR HG23 H -3.896 10.084 2.036 1.00 . A A . 47 THR HG23 1 1 9 6833 1 1 45 THR N N -4.034 10.533 -0.584 1.00 . A A . 47 THR N 1 1 9 6834 1 1 45 THR O O -1.098 10.970 1.452 1.00 . A A . 47 THR O 1 1 9 6835 1 1 45 THR OG1 O -2.914 13.144 1.783 1.00 . A A . 47 THR OG1 1 1 9 6836 1 1 46 LEU C C -0.100 7.711 -0.568 1.00 . A A . 48 LEU C 1 1 9 6837 1 1 46 LEU CA C -0.700 8.430 0.641 1.00 . A A . 48 LEU CA 1 1 9 6838 1 1 46 LEU CB C -1.267 7.395 1.617 1.00 . A A . 48 LEU CB 1 1 9 6839 1 1 46 LEU CD1 C -0.072 6.332 3.537 1.00 . A A . 48 LEU CD1 1 1 9 6840 1 1 46 LEU CD2 C -0.514 5.019 1.462 1.00 . A A . 48 LEU CD2 1 1 9 6841 1 1 46 LEU CG C -0.171 6.405 2.013 1.00 . A A . 48 LEU CG 1 1 9 6842 1 1 46 LEU H H -2.456 8.994 -0.470 1.00 . A A . 48 LEU H 1 1 9 6843 1 1 46 LEU HA H 0.062 9.015 1.134 1.00 . A A . 48 LEU HA 1 1 9 6844 1 1 46 LEU HB2 H -1.636 7.896 2.499 1.00 . A A . 48 LEU HB2 1 1 9 6845 1 1 46 LEU HB3 H -2.077 6.860 1.142 1.00 . A A . 48 LEU HB3 1 1 9 6846 1 1 46 LEU HD11 H -0.721 5.550 3.903 1.00 . A A . 48 LEU HD11 1 1 9 6847 1 1 46 LEU HD12 H -0.373 7.277 3.964 1.00 . A A . 48 LEU HD12 1 1 9 6848 1 1 46 LEU HD13 H 0.947 6.115 3.822 1.00 . A A . 48 LEU HD13 1 1 9 6849 1 1 46 LEU HD21 H -1.176 5.121 0.614 1.00 . A A . 48 LEU HD21 1 1 9 6850 1 1 46 LEU HD22 H -1.000 4.435 2.229 1.00 . A A . 48 LEU HD22 1 1 9 6851 1 1 46 LEU HD23 H 0.394 4.521 1.151 1.00 . A A . 48 LEU HD23 1 1 9 6852 1 1 46 LEU HG H 0.774 6.733 1.606 1.00 . A A . 48 LEU HG 1 1 9 6853 1 1 46 LEU N N -1.801 9.322 0.180 1.00 . A A . 48 LEU N 1 1 9 6854 1 1 46 LEU O O -0.797 7.047 -1.307 1.00 . A A . 48 LEU O 1 1 9 6855 1 1 47 THR C C 3.225 6.693 -1.649 1.00 . A A . 49 THR C 1 1 9 6856 1 1 47 THR CA C 1.793 7.128 -1.950 1.00 . A A . 49 THR CA 1 1 9 6857 1 1 47 THR CB C 1.809 8.033 -3.173 1.00 . A A . 49 THR CB 1 1 9 6858 1 1 47 THR CG2 C 0.385 8.226 -3.695 1.00 . A A . 49 THR CG2 1 1 9 6859 1 1 47 THR H H 1.744 8.359 -0.173 1.00 . A A . 49 THR H 1 1 9 6860 1 1 47 THR HA H 1.205 6.252 -2.174 1.00 . A A . 49 THR HA 1 1 9 6861 1 1 47 THR HB H 2.409 7.561 -3.937 1.00 . A A . 49 THR HB 1 1 9 6862 1 1 47 THR HG1 H 2.971 9.156 -2.090 1.00 . A A . 49 THR HG1 1 1 9 6863 1 1 47 THR HG21 H 0.020 9.198 -3.397 1.00 . A A . 49 THR HG21 1 1 9 6864 1 1 47 THR HG22 H -0.256 7.460 -3.287 1.00 . A A . 49 THR HG22 1 1 9 6865 1 1 47 THR HG23 H 0.385 8.157 -4.773 1.00 . A A . 49 THR HG23 1 1 9 6866 1 1 47 THR N N 1.186 7.827 -0.780 1.00 . A A . 49 THR N 1 1 9 6867 1 1 47 THR O O 4.019 7.427 -1.100 1.00 . A A . 49 THR O 1 1 9 6868 1 1 47 THR OG1 O 2.371 9.291 -2.828 1.00 . A A . 49 THR OG1 1 1 9 6869 1 1 48 LEU C C 5.982 5.996 -2.000 1.00 . A A . 50 LEU C 1 1 9 6870 1 1 48 LEU CA C 4.905 4.930 -1.820 1.00 . A A . 50 LEU CA 1 1 9 6871 1 1 48 LEU CB C 5.137 3.802 -2.829 1.00 . A A . 50 LEU CB 1 1 9 6872 1 1 48 LEU CD1 C 6.688 2.324 -1.539 1.00 . A A . 50 LEU CD1 1 1 9 6873 1 1 48 LEU CD2 C 6.953 2.564 -4.011 1.00 . A A . 50 LEU CD2 1 1 9 6874 1 1 48 LEU CG C 6.575 3.292 -2.719 1.00 . A A . 50 LEU CG 1 1 9 6875 1 1 48 LEU H H 2.870 4.962 -2.495 1.00 . A A . 50 LEU H 1 1 9 6876 1 1 48 LEU HA H 4.970 4.528 -0.824 1.00 . A A . 50 LEU HA 1 1 9 6877 1 1 48 LEU HB2 H 4.451 2.993 -2.624 1.00 . A A . 50 LEU HB2 1 1 9 6878 1 1 48 LEU HB3 H 4.966 4.173 -3.828 1.00 . A A . 50 LEU HB3 1 1 9 6879 1 1 48 LEU HD11 H 5.723 2.216 -1.069 1.00 . A A . 50 LEU HD11 1 1 9 6880 1 1 48 LEU HD12 H 7.396 2.713 -0.822 1.00 . A A . 50 LEU HD12 1 1 9 6881 1 1 48 LEU HD13 H 7.027 1.362 -1.893 1.00 . A A . 50 LEU HD13 1 1 9 6882 1 1 48 LEU HD21 H 7.452 3.253 -4.678 1.00 . A A . 50 LEU HD21 1 1 9 6883 1 1 48 LEU HD22 H 6.059 2.188 -4.486 1.00 . A A . 50 LEU HD22 1 1 9 6884 1 1 48 LEU HD23 H 7.614 1.740 -3.783 1.00 . A A . 50 LEU HD23 1 1 9 6885 1 1 48 LEU HG H 7.245 4.125 -2.564 1.00 . A A . 50 LEU HG 1 1 9 6886 1 1 48 LEU N N 3.543 5.497 -2.039 1.00 . A A . 50 LEU N 1 1 9 6887 1 1 48 LEU O O 5.970 6.764 -2.941 1.00 . A A . 50 LEU O 1 1 9 6888 1 1 49 SER C C 9.369 6.265 -1.003 1.00 . A A . 51 SER C 1 1 9 6889 1 1 49 SER CA C 8.044 7.003 -1.207 1.00 . A A . 51 SER CA 1 1 9 6890 1 1 49 SER CB C 7.895 8.070 -0.128 1.00 . A A . 51 SER CB 1 1 9 6891 1 1 49 SER H H 6.922 5.373 -0.368 1.00 . A A . 51 SER H 1 1 9 6892 1 1 49 SER HA H 8.027 7.465 -2.181 1.00 . A A . 51 SER HA 1 1 9 6893 1 1 49 SER HB2 H 6.863 8.354 -0.040 1.00 . A A . 51 SER HB2 1 1 9 6894 1 1 49 SER HB3 H 8.241 7.673 0.817 1.00 . A A . 51 SER HB3 1 1 9 6895 1 1 49 SER HG H 8.167 9.715 -1.132 1.00 . A A . 51 SER HG 1 1 9 6896 1 1 49 SER N N 6.932 6.021 -1.105 1.00 . A A . 51 SER N 1 1 9 6897 1 1 49 SER O O 10.427 6.864 -0.971 1.00 . A A . 51 SER O 1 1 9 6898 1 1 49 SER OG O 8.666 9.210 -0.486 1.00 . A A . 51 SER OG 1 1 9 6899 1 1 50 HIS C C 10.133 2.712 -0.555 1.00 . A A . 52 HIS C 1 1 9 6900 1 1 50 HIS CA C 10.546 4.182 -0.650 1.00 . A A . 52 HIS CA 1 1 9 6901 1 1 50 HIS CB C 11.251 4.661 0.639 1.00 . A A . 52 HIS CB 1 1 9 6902 1 1 50 HIS CD2 C 11.777 3.252 2.799 1.00 . A A . 52 HIS CD2 1 1 9 6903 1 1 50 HIS CE1 C 12.583 1.487 1.835 1.00 . A A . 52 HIS CE1 1 1 9 6904 1 1 50 HIS CG C 11.759 3.492 1.450 1.00 . A A . 52 HIS CG 1 1 9 6905 1 1 50 HIS H H 8.459 4.499 -0.886 1.00 . A A . 52 HIS H 1 1 9 6906 1 1 50 HIS HA H 11.205 4.315 -1.497 1.00 . A A . 52 HIS HA 1 1 9 6907 1 1 50 HIS HB2 H 12.083 5.295 0.374 1.00 . A A . 52 HIS HB2 1 1 9 6908 1 1 50 HIS HB3 H 10.550 5.229 1.235 1.00 . A A . 52 HIS HB3 1 1 9 6909 1 1 50 HIS HD1 H 12.427 2.215 -0.100 1.00 . A A . 52 HIS HD1 1 1 9 6910 1 1 50 HIS HD2 H 11.440 3.941 3.560 1.00 . A A . 52 HIS HD2 1 1 9 6911 1 1 50 HIS HE1 H 12.952 0.490 1.662 1.00 . A A . 52 HIS HE1 1 1 9 6912 1 1 50 HIS N N 9.316 4.968 -0.859 1.00 . A A . 52 HIS N 1 1 9 6913 1 1 50 HIS ND1 N 12.285 2.355 0.857 1.00 . A A . 52 HIS ND1 1 1 9 6914 1 1 50 HIS NE2 N 12.299 1.985 3.041 1.00 . A A . 52 HIS NE2 1 1 9 6915 1 1 50 HIS O O 9.298 2.342 0.239 1.00 . A A . 52 HIS O 1 1 9 6916 1 1 51 PHE C C 9.990 -0.060 0.003 1.00 . A A . 53 PHE C 1 1 9 6917 1 1 51 PHE CA C 10.392 0.432 -1.395 1.00 . A A . 53 PHE CA 1 1 9 6918 1 1 51 PHE CB C 11.611 -0.352 -1.878 1.00 . A A . 53 PHE CB 1 1 9 6919 1 1 51 PHE CD1 C 10.563 -0.477 -4.167 1.00 . A A . 53 PHE CD1 1 1 9 6920 1 1 51 PHE CD2 C 11.578 -2.474 -3.239 1.00 . A A . 53 PHE CD2 1 1 9 6921 1 1 51 PHE CE1 C 10.220 -1.187 -5.322 1.00 . A A . 53 PHE CE1 1 1 9 6922 1 1 51 PHE CE2 C 11.235 -3.184 -4.395 1.00 . A A . 53 PHE CE2 1 1 9 6923 1 1 51 PHE CG C 11.244 -1.119 -3.126 1.00 . A A . 53 PHE CG 1 1 9 6924 1 1 51 PHE CZ C 10.555 -2.542 -5.437 1.00 . A A . 53 PHE CZ 1 1 9 6925 1 1 51 PHE H H 11.358 2.256 -2.012 1.00 . A A . 53 PHE H 1 1 9 6926 1 1 51 PHE HA H 9.574 0.259 -2.076 1.00 . A A . 53 PHE HA 1 1 9 6927 1 1 51 PHE HB2 H 12.416 0.334 -2.101 1.00 . A A . 53 PHE HB2 1 1 9 6928 1 1 51 PHE HB3 H 11.926 -1.043 -1.111 1.00 . A A . 53 PHE HB3 1 1 9 6929 1 1 51 PHE HD1 H 10.303 0.568 -4.079 1.00 . A A . 53 PHE HD1 1 1 9 6930 1 1 51 PHE HD2 H 12.102 -2.969 -2.436 1.00 . A A . 53 PHE HD2 1 1 9 6931 1 1 51 PHE HE1 H 9.695 -0.692 -6.126 1.00 . A A . 53 PHE HE1 1 1 9 6932 1 1 51 PHE HE2 H 11.493 -4.230 -4.483 1.00 . A A . 53 PHE HE2 1 1 9 6933 1 1 51 PHE HZ H 10.290 -3.091 -6.329 1.00 . A A . 53 PHE HZ 1 1 9 6934 1 1 51 PHE N N 10.712 1.895 -1.381 1.00 . A A . 53 PHE N 1 1 9 6935 1 1 51 PHE O O 10.391 0.474 1.014 1.00 . A A . 53 PHE O 1 1 9 6936 1 1 52 GLY C C 9.754 -1.600 2.415 1.00 . A A . 54 GLY C 1 1 9 6937 1 1 52 GLY CA C 8.680 -1.641 1.329 1.00 . A A . 54 GLY CA 1 1 9 6938 1 1 52 GLY H H 8.878 -1.466 -0.797 1.00 . A A . 54 GLY H 1 1 9 6939 1 1 52 GLY HA2 H 7.825 -1.069 1.658 1.00 . A A . 54 GLY HA2 1 1 9 6940 1 1 52 GLY HA3 H 8.379 -2.666 1.172 1.00 . A A . 54 GLY HA3 1 1 9 6941 1 1 52 GLY N N 9.177 -1.076 0.039 1.00 . A A . 54 GLY N 1 1 9 6942 1 1 52 GLY O O 9.686 -0.797 3.321 1.00 . A A . 54 GLY O 1 1 9 6943 1 1 53 LYS C C 12.073 -1.179 4.002 1.00 . A A . 55 LYS C 1 1 9 6944 1 1 53 LYS CA C 11.796 -2.555 3.382 1.00 . A A . 55 LYS CA 1 1 9 6945 1 1 53 LYS CB C 13.081 -3.087 2.744 1.00 . A A . 55 LYS CB 1 1 9 6946 1 1 53 LYS CD C 14.900 -1.935 1.468 1.00 . A A . 55 LYS CD 1 1 9 6947 1 1 53 LYS CE C 15.720 -3.222 1.594 1.00 . A A . 55 LYS CE 1 1 9 6948 1 1 53 LYS CG C 13.406 -2.269 1.492 1.00 . A A . 55 LYS CG 1 1 9 6949 1 1 53 LYS H H 10.717 -3.135 1.609 1.00 . A A . 55 LYS H 1 1 9 6950 1 1 53 LYS HA H 11.486 -3.237 4.159 1.00 . A A . 55 LYS HA 1 1 9 6951 1 1 53 LYS HB2 H 13.894 -3.003 3.451 1.00 . A A . 55 LYS HB2 1 1 9 6952 1 1 53 LYS HB3 H 12.947 -4.122 2.470 1.00 . A A . 55 LYS HB3 1 1 9 6953 1 1 53 LYS HD2 H 15.143 -1.445 0.536 1.00 . A A . 55 LYS HD2 1 1 9 6954 1 1 53 LYS HD3 H 15.136 -1.279 2.292 1.00 . A A . 55 LYS HD3 1 1 9 6955 1 1 53 LYS HE2 H 15.076 -4.076 1.447 1.00 . A A . 55 LYS HE2 1 1 9 6956 1 1 53 LYS HE3 H 16.500 -3.226 0.847 1.00 . A A . 55 LYS HE3 1 1 9 6957 1 1 53 LYS HG2 H 13.149 -2.841 0.613 1.00 . A A . 55 LYS HG2 1 1 9 6958 1 1 53 LYS HG3 H 12.836 -1.354 1.505 1.00 . A A . 55 LYS HG3 1 1 9 6959 1 1 53 LYS HZ1 H 17.368 -3.217 2.867 1.00 . A A . 55 LYS HZ1 1 1 9 6960 1 1 53 LYS HZ2 H 16.084 -4.195 3.398 1.00 . A A . 55 LYS HZ2 1 1 9 6961 1 1 53 LYS HZ3 H 15.979 -2.505 3.531 1.00 . A A . 55 LYS HZ3 1 1 9 6962 1 1 53 LYS N N 10.717 -2.486 2.343 1.00 . A A . 55 LYS N 1 1 9 6963 1 1 53 LYS NZ N 16.334 -3.290 2.950 1.00 . A A . 55 LYS NZ 1 1 9 6964 1 1 53 LYS O O 12.947 -0.457 3.565 1.00 . A A . 55 LYS O 1 1 9 6965 1 1 54 CYS C C 12.418 0.291 6.947 1.00 . A A . 56 CYS C 1 1 9 6966 1 1 54 CYS CA C 11.576 0.498 5.688 1.00 . A A . 56 CYS CA 1 1 9 6967 1 1 54 CYS CB C 10.234 1.129 6.073 1.00 . A A . 56 CYS CB 1 1 9 6968 1 1 54 CYS H H 10.647 -1.419 5.368 1.00 . A A . 56 CYS H 1 1 9 6969 1 1 54 CYS HA H 12.100 1.153 5.011 1.00 . A A . 56 CYS HA 1 1 9 6970 1 1 54 CYS HB2 H 9.455 0.384 6.010 1.00 . A A . 56 CYS HB2 1 1 9 6971 1 1 54 CYS HB3 H 10.292 1.504 7.084 1.00 . A A . 56 CYS HB3 1 1 9 6972 1 1 54 CYS N N 11.344 -0.819 5.028 1.00 . A A . 56 CYS N 1 1 9 6973 1 1 54 CYS O O 12.263 -0.743 7.576 1.00 . A A . 56 CYS O 1 1 9 6974 1 1 54 CYS OXT O 13.203 1.170 7.262 1.00 . A A . 56 CYS OXT 1 1 9 6975 1 1 54 CYS SG S 9.856 2.493 4.946 1.00 . A A . 56 CYS SG 1 1 10 6976 1 1 1 ALA C C 6.755 9.528 -9.883 1.00 . A A . 3 ALA C 1 1 10 6977 1 1 1 ALA CA C 6.898 11.039 -10.068 1.00 . A A . 3 ALA CA 1 1 10 6978 1 1 1 ALA CB C 6.267 11.454 -11.401 1.00 . A A . 3 ALA CB 1 1 10 6979 1 1 1 ALA H1 H 8.897 10.631 -9.654 1.00 . A A . 3 ALA H1 1 1 10 6980 1 1 1 ALA H2 H 8.478 12.271 -9.502 1.00 . A A . 3 ALA H2 1 1 10 6981 1 1 1 ALA H3 H 8.658 11.577 -11.042 1.00 . A A . 3 ALA H3 1 1 10 6982 1 1 1 ALA HA H 6.396 11.550 -9.259 1.00 . A A . 3 ALA HA 1 1 10 6983 1 1 1 ALA HB1 H 5.206 11.256 -11.373 1.00 . A A . 3 ALA HB1 1 1 10 6984 1 1 1 ALA HB2 H 6.717 10.889 -12.204 1.00 . A A . 3 ALA HB2 1 1 10 6985 1 1 1 ALA HB3 H 6.433 12.508 -11.566 1.00 . A A . 3 ALA HB3 1 1 10 6986 1 1 1 ALA N N 8.341 11.407 -10.066 1.00 . A A . 3 ALA N 1 1 10 6987 1 1 1 ALA O O 7.379 8.746 -10.574 1.00 . A A . 3 ALA O 1 1 10 6988 1 1 2 VAL C C 4.608 7.133 -9.593 1.00 . A A . 4 VAL C 1 1 10 6989 1 1 2 VAL CA C 5.755 7.648 -8.722 1.00 . A A . 4 VAL CA 1 1 10 6990 1 1 2 VAL CB C 5.425 7.403 -7.247 1.00 . A A . 4 VAL CB 1 1 10 6991 1 1 2 VAL CG1 C 4.085 8.058 -6.908 1.00 . A A . 4 VAL CG1 1 1 10 6992 1 1 2 VAL CG2 C 5.332 5.897 -6.989 1.00 . A A . 4 VAL CG2 1 1 10 6993 1 1 2 VAL H H 5.446 9.756 -8.406 1.00 . A A . 4 VAL H 1 1 10 6994 1 1 2 VAL HA H 6.666 7.126 -8.978 1.00 . A A . 4 VAL HA 1 1 10 6995 1 1 2 VAL HB H 6.201 7.829 -6.629 1.00 . A A . 4 VAL HB 1 1 10 6996 1 1 2 VAL HG11 H 4.120 9.106 -7.170 1.00 . A A . 4 VAL HG11 1 1 10 6997 1 1 2 VAL HG12 H 3.893 7.958 -5.850 1.00 . A A . 4 VAL HG12 1 1 10 6998 1 1 2 VAL HG13 H 3.296 7.575 -7.464 1.00 . A A . 4 VAL HG13 1 1 10 6999 1 1 2 VAL HG21 H 5.666 5.682 -5.984 1.00 . A A . 4 VAL HG21 1 1 10 7000 1 1 2 VAL HG22 H 5.956 5.371 -7.695 1.00 . A A . 4 VAL HG22 1 1 10 7001 1 1 2 VAL HG23 H 4.307 5.575 -7.104 1.00 . A A . 4 VAL HG23 1 1 10 7002 1 1 2 VAL N N 5.939 9.109 -8.953 1.00 . A A . 4 VAL N 1 1 10 7003 1 1 2 VAL O O 3.702 7.865 -9.938 1.00 . A A . 4 VAL O 1 1 10 7004 1 1 3 SER C C 2.878 4.154 -10.070 1.00 . A A . 5 SER C 1 1 10 7005 1 1 3 SER CA C 3.547 5.321 -10.800 1.00 . A A . 5 SER CA 1 1 10 7006 1 1 3 SER CB C 4.133 4.824 -12.123 1.00 . A A . 5 SER CB 1 1 10 7007 1 1 3 SER H H 5.377 5.304 -9.663 1.00 . A A . 5 SER H 1 1 10 7008 1 1 3 SER HA H 2.815 6.089 -10.997 1.00 . A A . 5 SER HA 1 1 10 7009 1 1 3 SER HB2 H 4.868 4.061 -11.930 1.00 . A A . 5 SER HB2 1 1 10 7010 1 1 3 SER HB3 H 3.340 4.410 -12.732 1.00 . A A . 5 SER HB3 1 1 10 7011 1 1 3 SER HG H 4.744 5.713 -13.741 1.00 . A A . 5 SER HG 1 1 10 7012 1 1 3 SER N N 4.637 5.879 -9.951 1.00 . A A . 5 SER N 1 1 10 7013 1 1 3 SER O O 3.438 3.084 -9.947 1.00 . A A . 5 SER O 1 1 10 7014 1 1 3 SER OG O 4.751 5.909 -12.800 1.00 . A A . 5 SER OG 1 1 10 7015 1 1 4 VAL C C -0.220 2.790 -9.690 1.00 . A A . 6 VAL C 1 1 10 7016 1 1 4 VAL CA C 0.982 3.253 -8.866 1.00 . A A . 6 VAL CA 1 1 10 7017 1 1 4 VAL CB C 0.502 3.759 -7.504 1.00 . A A . 6 VAL CB 1 1 10 7018 1 1 4 VAL CG1 C -0.508 4.890 -7.705 1.00 . A A . 6 VAL CG1 1 1 10 7019 1 1 4 VAL CG2 C -0.166 2.610 -6.743 1.00 . A A . 6 VAL CG2 1 1 10 7020 1 1 4 VAL H H 1.247 5.223 -9.694 1.00 . A A . 6 VAL H 1 1 10 7021 1 1 4 VAL HA H 1.661 2.425 -8.723 1.00 . A A . 6 VAL HA 1 1 10 7022 1 1 4 VAL HB H 1.346 4.126 -6.937 1.00 . A A . 6 VAL HB 1 1 10 7023 1 1 4 VAL HG11 H -0.736 4.985 -8.757 1.00 . A A . 6 VAL HG11 1 1 10 7024 1 1 4 VAL HG12 H -0.086 5.817 -7.344 1.00 . A A . 6 VAL HG12 1 1 10 7025 1 1 4 VAL HG13 H -1.412 4.668 -7.158 1.00 . A A . 6 VAL HG13 1 1 10 7026 1 1 4 VAL HG21 H -0.807 2.058 -7.415 1.00 . A A . 6 VAL HG21 1 1 10 7027 1 1 4 VAL HG22 H -0.756 3.011 -5.931 1.00 . A A . 6 VAL HG22 1 1 10 7028 1 1 4 VAL HG23 H 0.592 1.952 -6.347 1.00 . A A . 6 VAL HG23 1 1 10 7029 1 1 4 VAL N N 1.683 4.352 -9.585 1.00 . A A . 6 VAL N 1 1 10 7030 1 1 4 VAL O O -0.842 3.567 -10.388 1.00 . A A . 6 VAL O 1 1 10 7031 1 1 5 ASP C C -2.860 0.694 -9.437 1.00 . A A . 7 ASP C 1 1 10 7032 1 1 5 ASP CA C -1.713 1.021 -10.394 1.00 . A A . 7 ASP CA 1 1 10 7033 1 1 5 ASP CB C -1.304 -0.244 -11.155 1.00 . A A . 7 ASP CB 1 1 10 7034 1 1 5 ASP CG C -1.020 0.108 -12.616 1.00 . A A . 7 ASP CG 1 1 10 7035 1 1 5 ASP H H -0.037 0.921 -9.046 1.00 . A A . 7 ASP H 1 1 10 7036 1 1 5 ASP HA H -2.035 1.775 -11.097 1.00 . A A . 7 ASP HA 1 1 10 7037 1 1 5 ASP HB2 H -0.415 -0.663 -10.704 1.00 . A A . 7 ASP HB2 1 1 10 7038 1 1 5 ASP HB3 H -2.105 -0.967 -11.109 1.00 . A A . 7 ASP HB3 1 1 10 7039 1 1 5 ASP N N -0.551 1.531 -9.616 1.00 . A A . 7 ASP N 1 1 10 7040 1 1 5 ASP O O -3.049 -0.440 -9.041 1.00 . A A . 7 ASP O 1 1 10 7041 1 1 5 ASP OD1 O -0.109 0.885 -12.853 1.00 . A A . 7 ASP OD1 1 1 10 7042 1 1 5 ASP OD2 O -1.720 -0.404 -13.476 1.00 . A A . 7 ASP OD2 1 1 10 7043 1 1 6 CYS C C -6.086 1.680 -8.846 1.00 . A A . 8 CYS C 1 1 10 7044 1 1 6 CYS CA C -4.761 1.424 -8.123 1.00 . A A . 8 CYS CA 1 1 10 7045 1 1 6 CYS CB C -4.650 2.360 -6.918 1.00 . A A . 8 CYS CB 1 1 10 7046 1 1 6 CYS H H -3.458 2.587 -9.386 1.00 . A A . 8 CYS H 1 1 10 7047 1 1 6 CYS HA H -4.727 0.399 -7.788 1.00 . A A . 8 CYS HA 1 1 10 7048 1 1 6 CYS HB2 H -4.640 3.385 -7.256 1.00 . A A . 8 CYS HB2 1 1 10 7049 1 1 6 CYS HB3 H -5.495 2.205 -6.263 1.00 . A A . 8 CYS HB3 1 1 10 7050 1 1 6 CYS N N -3.628 1.680 -9.057 1.00 . A A . 8 CYS N 1 1 10 7051 1 1 6 CYS O O -7.058 2.097 -8.250 1.00 . A A . 8 CYS O 1 1 10 7052 1 1 6 CYS SG S -3.119 2.005 -6.021 1.00 . A A . 8 CYS SG 1 1 10 7053 1 1 7 SER C C -8.549 1.018 -10.146 1.00 . A A . 9 SER C 1 1 10 7054 1 1 7 SER CA C -7.381 1.655 -10.894 1.00 . A A . 9 SER CA 1 1 10 7055 1 1 7 SER CB C -7.254 1.021 -12.280 1.00 . A A . 9 SER CB 1 1 10 7056 1 1 7 SER H H -5.336 1.100 -10.582 1.00 . A A . 9 SER H 1 1 10 7057 1 1 7 SER HA H -7.556 2.715 -10.997 1.00 . A A . 9 SER HA 1 1 10 7058 1 1 7 SER HB2 H -6.538 0.218 -12.247 1.00 . A A . 9 SER HB2 1 1 10 7059 1 1 7 SER HB3 H -8.216 0.630 -12.585 1.00 . A A . 9 SER HB3 1 1 10 7060 1 1 7 SER HG H -7.577 2.515 -13.486 1.00 . A A . 9 SER HG 1 1 10 7061 1 1 7 SER N N -6.128 1.433 -10.127 1.00 . A A . 9 SER N 1 1 10 7062 1 1 7 SER O O -8.841 -0.147 -10.310 1.00 . A A . 9 SER O 1 1 10 7063 1 1 7 SER OG O -6.812 2.005 -13.207 1.00 . A A . 9 SER OG 1 1 10 7064 1 1 8 GLU C C -9.982 -0.085 -7.896 1.00 . A A . 10 GLU C 1 1 10 7065 1 1 8 GLU CA C -10.355 1.258 -8.526 1.00 . A A . 10 GLU CA 1 1 10 7066 1 1 8 GLU CB C -11.607 1.121 -9.415 1.00 . A A . 10 GLU CB 1 1 10 7067 1 1 8 GLU CD C -10.803 0.715 -11.753 1.00 . A A . 10 GLU CD 1 1 10 7068 1 1 8 GLU CG C -11.410 0.062 -10.508 1.00 . A A . 10 GLU CG 1 1 10 7069 1 1 8 GLU H H -8.916 2.708 -9.202 1.00 . A A . 10 GLU H 1 1 10 7070 1 1 8 GLU HA H -10.569 1.960 -7.732 1.00 . A A . 10 GLU HA 1 1 10 7071 1 1 8 GLU HB2 H -12.448 0.838 -8.800 1.00 . A A . 10 GLU HB2 1 1 10 7072 1 1 8 GLU HB3 H -11.815 2.074 -9.880 1.00 . A A . 10 GLU HB3 1 1 10 7073 1 1 8 GLU HG2 H -10.760 -0.717 -10.153 1.00 . A A . 10 GLU HG2 1 1 10 7074 1 1 8 GLU HG3 H -12.368 -0.365 -10.765 1.00 . A A . 10 GLU HG3 1 1 10 7075 1 1 8 GLU N N -9.200 1.780 -9.317 1.00 . A A . 10 GLU N 1 1 10 7076 1 1 8 GLU O O -10.569 -1.110 -8.176 1.00 . A A . 10 GLU O 1 1 10 7077 1 1 8 GLU OE1 O -10.925 1.921 -11.884 1.00 . A A . 10 GLU OE1 1 1 10 7078 1 1 8 GLU OE2 O -10.227 -0.004 -12.552 1.00 . A A . 10 GLU OE2 1 1 10 7079 1 1 9 TYR C C -8.695 -1.233 -4.832 1.00 . A A . 11 TYR C 1 1 10 7080 1 1 9 TYR CA C -8.586 -1.345 -6.366 1.00 . A A . 11 TYR CA 1 1 10 7081 1 1 9 TYR CB C -7.131 -1.638 -6.746 1.00 . A A . 11 TYR CB 1 1 10 7082 1 1 9 TYR CD1 C -7.689 -4.062 -7.165 1.00 . A A . 11 TYR CD1 1 1 10 7083 1 1 9 TYR CD2 C -5.723 -3.528 -5.850 1.00 . A A . 11 TYR CD2 1 1 10 7084 1 1 9 TYR CE1 C -7.418 -5.428 -7.014 1.00 . A A . 11 TYR CE1 1 1 10 7085 1 1 9 TYR CE2 C -5.451 -4.893 -5.700 1.00 . A A . 11 TYR CE2 1 1 10 7086 1 1 9 TYR CG C -6.843 -3.112 -6.581 1.00 . A A . 11 TYR CG 1 1 10 7087 1 1 9 TYR CZ C -6.299 -5.843 -6.283 1.00 . A A . 11 TYR CZ 1 1 10 7088 1 1 9 TYR H H -8.551 0.767 -6.814 1.00 . A A . 11 TYR H 1 1 10 7089 1 1 9 TYR HA H -9.213 -2.153 -6.711 1.00 . A A . 11 TYR HA 1 1 10 7090 1 1 9 TYR HB2 H -6.966 -1.352 -7.775 1.00 . A A . 11 TYR HB2 1 1 10 7091 1 1 9 TYR HB3 H -6.472 -1.070 -6.106 1.00 . A A . 11 TYR HB3 1 1 10 7092 1 1 9 TYR HD1 H -8.552 -3.742 -7.728 1.00 . A A . 11 TYR HD1 1 1 10 7093 1 1 9 TYR HD2 H -5.068 -2.794 -5.400 1.00 . A A . 11 TYR HD2 1 1 10 7094 1 1 9 TYR HE1 H -8.072 -6.160 -7.464 1.00 . A A . 11 TYR HE1 1 1 10 7095 1 1 9 TYR HE2 H -4.588 -5.214 -5.135 1.00 . A A . 11 TYR HE2 1 1 10 7096 1 1 9 TYR HH H -6.867 -7.662 -6.166 1.00 . A A . 11 TYR HH 1 1 10 7097 1 1 9 TYR N N -9.006 -0.077 -7.028 1.00 . A A . 11 TYR N 1 1 10 7098 1 1 9 TYR O O -7.774 -1.604 -4.131 1.00 . A A . 11 TYR O 1 1 10 7099 1 1 9 TYR OH O -6.032 -7.188 -6.135 1.00 . A A . 11 TYR OH 1 1 10 7100 1 1 10 PRO C C -10.376 -1.962 -2.268 1.00 . A A . 12 PRO C 1 1 10 7101 1 1 10 PRO CA C -10.047 -0.602 -2.893 1.00 . A A . 12 PRO CA 1 1 10 7102 1 1 10 PRO CB C -11.259 0.327 -2.807 1.00 . A A . 12 PRO CB 1 1 10 7103 1 1 10 PRO CD C -10.944 -0.281 -5.182 1.00 . A A . 12 PRO CD 1 1 10 7104 1 1 10 PRO CG C -11.991 0.204 -4.163 1.00 . A A . 12 PRO CG 1 1 10 7105 1 1 10 PRO HA H -9.197 -0.149 -2.409 1.00 . A A . 12 PRO HA 1 1 10 7106 1 1 10 PRO HB2 H -11.908 0.014 -2.000 1.00 . A A . 12 PRO HB2 1 1 10 7107 1 1 10 PRO HB3 H -10.939 1.346 -2.656 1.00 . A A . 12 PRO HB3 1 1 10 7108 1 1 10 PRO HD2 H -11.339 -1.091 -5.778 1.00 . A A . 12 PRO HD2 1 1 10 7109 1 1 10 PRO HD3 H -10.637 0.541 -5.802 1.00 . A A . 12 PRO HD3 1 1 10 7110 1 1 10 PRO HG2 H -12.798 -0.512 -4.085 1.00 . A A . 12 PRO HG2 1 1 10 7111 1 1 10 PRO HG3 H -12.377 1.165 -4.465 1.00 . A A . 12 PRO HG3 1 1 10 7112 1 1 10 PRO N N -9.814 -0.742 -4.347 1.00 . A A . 12 PRO N 1 1 10 7113 1 1 10 PRO O O -11.470 -2.471 -2.414 1.00 . A A . 12 PRO O 1 1 10 7114 1 1 11 LYS C C -8.577 -4.219 0.021 1.00 . A A . 13 LYS C 1 1 10 7115 1 1 11 LYS CA C -9.726 -3.862 -0.922 1.00 . A A . 13 LYS CA 1 1 10 7116 1 1 11 LYS CB C -9.887 -4.948 -1.994 1.00 . A A . 13 LYS CB 1 1 10 7117 1 1 11 LYS CD C -8.809 -5.969 -3.995 1.00 . A A . 13 LYS CD 1 1 10 7118 1 1 11 LYS CE C -9.061 -7.445 -3.678 1.00 . A A . 13 LYS CE 1 1 10 7119 1 1 11 LYS CG C -8.552 -5.208 -2.694 1.00 . A A . 13 LYS CG 1 1 10 7120 1 1 11 LYS H H -8.578 -2.121 -1.441 1.00 . A A . 13 LYS H 1 1 10 7121 1 1 11 LYS HA H -10.640 -3.790 -0.351 1.00 . A A . 13 LYS HA 1 1 10 7122 1 1 11 LYS HB2 H -10.228 -5.861 -1.528 1.00 . A A . 13 LYS HB2 1 1 10 7123 1 1 11 LYS HB3 H -10.615 -4.625 -2.724 1.00 . A A . 13 LYS HB3 1 1 10 7124 1 1 11 LYS HD2 H -9.674 -5.553 -4.491 1.00 . A A . 13 LYS HD2 1 1 10 7125 1 1 11 LYS HD3 H -7.948 -5.884 -4.639 1.00 . A A . 13 LYS HD3 1 1 10 7126 1 1 11 LYS HE2 H -8.177 -7.873 -3.228 1.00 . A A . 13 LYS HE2 1 1 10 7127 1 1 11 LYS HE3 H -9.891 -7.529 -2.991 1.00 . A A . 13 LYS HE3 1 1 10 7128 1 1 11 LYS HG2 H -8.068 -4.267 -2.913 1.00 . A A . 13 LYS HG2 1 1 10 7129 1 1 11 LYS HG3 H -7.917 -5.803 -2.055 1.00 . A A . 13 LYS HG3 1 1 10 7130 1 1 11 LYS HZ1 H -9.880 -7.543 -5.590 1.00 . A A . 13 LYS HZ1 1 1 10 7131 1 1 11 LYS HZ2 H -9.986 -8.996 -4.716 1.00 . A A . 13 LYS HZ2 1 1 10 7132 1 1 11 LYS HZ3 H -8.500 -8.505 -5.380 1.00 . A A . 13 LYS HZ3 1 1 10 7133 1 1 11 LYS N N -9.448 -2.549 -1.562 1.00 . A A . 13 LYS N 1 1 10 7134 1 1 11 LYS NZ N -9.380 -8.177 -4.936 1.00 . A A . 13 LYS NZ 1 1 10 7135 1 1 11 LYS O O -7.520 -4.646 -0.397 1.00 . A A . 13 LYS O 1 1 10 7136 1 1 12 CYS C C -7.770 -5.856 2.641 1.00 . A A . 14 CYS C 1 1 10 7137 1 1 12 CYS CA C -7.702 -4.369 2.274 1.00 . A A . 14 CYS CA 1 1 10 7138 1 1 12 CYS CB C -7.894 -3.527 3.537 1.00 . A A . 14 CYS CB 1 1 10 7139 1 1 12 CYS H H -9.635 -3.692 1.607 1.00 . A A . 14 CYS H 1 1 10 7140 1 1 12 CYS HA H -6.739 -4.149 1.839 1.00 . A A . 14 CYS HA 1 1 10 7141 1 1 12 CYS HB2 H -8.910 -3.166 3.578 1.00 . A A . 14 CYS HB2 1 1 10 7142 1 1 12 CYS HB3 H -7.692 -4.134 4.408 1.00 . A A . 14 CYS HB3 1 1 10 7143 1 1 12 CYS N N -8.777 -4.043 1.294 1.00 . A A . 14 CYS N 1 1 10 7144 1 1 12 CYS O O -7.432 -6.246 3.741 1.00 . A A . 14 CYS O 1 1 10 7145 1 1 12 CYS SG S -6.755 -2.123 3.503 1.00 . A A . 14 CYS SG 1 1 10 7146 1 1 13 ALA C C -7.708 -8.948 0.874 1.00 . A A . 15 ALA C 1 1 10 7147 1 1 13 ALA CA C -8.293 -8.144 2.039 1.00 . A A . 15 ALA CA 1 1 10 7148 1 1 13 ALA CB C -9.759 -8.527 2.245 1.00 . A A . 15 ALA CB 1 1 10 7149 1 1 13 ALA H H -8.476 -6.360 0.853 1.00 . A A . 15 ALA H 1 1 10 7150 1 1 13 ALA HA H -7.736 -8.357 2.939 1.00 . A A . 15 ALA HA 1 1 10 7151 1 1 13 ALA HB1 H -10.219 -8.718 1.287 1.00 . A A . 15 ALA HB1 1 1 10 7152 1 1 13 ALA HB2 H -10.277 -7.717 2.737 1.00 . A A . 15 ALA HB2 1 1 10 7153 1 1 13 ALA HB3 H -9.817 -9.416 2.856 1.00 . A A . 15 ALA HB3 1 1 10 7154 1 1 13 ALA N N -8.205 -6.689 1.733 1.00 . A A . 15 ALA N 1 1 10 7155 1 1 13 ALA O O -8.409 -9.662 0.185 1.00 . A A . 15 ALA O 1 1 10 7156 1 1 14 CYS C C -5.097 -10.834 0.082 1.00 . A A . 16 CYS C 1 1 10 7157 1 1 14 CYS CA C -5.790 -9.592 -0.468 1.00 . A A . 16 CYS CA 1 1 10 7158 1 1 14 CYS CB C -4.753 -8.705 -1.160 1.00 . A A . 16 CYS CB 1 1 10 7159 1 1 14 CYS H H -5.880 -8.254 1.218 1.00 . A A . 16 CYS H 1 1 10 7160 1 1 14 CYS HA H -6.540 -9.891 -1.184 1.00 . A A . 16 CYS HA 1 1 10 7161 1 1 14 CYS HB2 H -4.460 -7.907 -0.495 1.00 . A A . 16 CYS HB2 1 1 10 7162 1 1 14 CYS HB3 H -3.886 -9.298 -1.413 1.00 . A A . 16 CYS HB3 1 1 10 7163 1 1 14 CYS N N -6.426 -8.836 0.650 1.00 . A A . 16 CYS N 1 1 10 7164 1 1 14 CYS O O -5.159 -11.131 1.259 1.00 . A A . 16 CYS O 1 1 10 7165 1 1 14 CYS SG S -5.465 -8.003 -2.668 1.00 . A A . 16 CYS SG 1 1 10 7166 1 1 15 THR C C -2.407 -12.389 0.352 1.00 . A A . 17 THR C 1 1 10 7167 1 1 15 THR CA C -3.732 -12.791 -0.312 1.00 . A A . 17 THR CA 1 1 10 7168 1 1 15 THR CB C -3.475 -13.697 -1.518 1.00 . A A . 17 THR CB 1 1 10 7169 1 1 15 THR CG2 C -3.168 -15.116 -1.037 1.00 . A A . 17 THR CG2 1 1 10 7170 1 1 15 THR H H -4.407 -11.298 -1.712 1.00 . A A . 17 THR H 1 1 10 7171 1 1 15 THR HA H -4.348 -13.312 0.405 1.00 . A A . 17 THR HA 1 1 10 7172 1 1 15 THR HB H -2.635 -13.321 -2.082 1.00 . A A . 17 THR HB 1 1 10 7173 1 1 15 THR HG1 H -4.610 -14.523 -2.863 1.00 . A A . 17 THR HG1 1 1 10 7174 1 1 15 THR HG21 H -2.992 -15.754 -1.891 1.00 . A A . 17 THR HG21 1 1 10 7175 1 1 15 THR HG22 H -4.007 -15.494 -0.473 1.00 . A A . 17 THR HG22 1 1 10 7176 1 1 15 THR HG23 H -2.290 -15.102 -0.410 1.00 . A A . 17 THR HG23 1 1 10 7177 1 1 15 THR N N -4.437 -11.562 -0.768 1.00 . A A . 17 THR N 1 1 10 7178 1 1 15 THR O O -2.391 -11.589 1.267 1.00 . A A . 17 THR O 1 1 10 7179 1 1 15 THR OG1 O -4.629 -13.715 -2.346 1.00 . A A . 17 THR OG1 1 1 10 7180 1 1 16 MET C C 1.071 -12.369 -0.521 1.00 . A A . 18 MET C 1 1 10 7181 1 1 16 MET CA C -0.003 -12.550 0.553 1.00 . A A . 18 MET CA 1 1 10 7182 1 1 16 MET CB C 0.429 -13.650 1.525 1.00 . A A . 18 MET CB 1 1 10 7183 1 1 16 MET CE C 0.658 -13.405 5.584 1.00 . A A . 18 MET CE 1 1 10 7184 1 1 16 MET CG C 0.728 -13.035 2.894 1.00 . A A . 18 MET CG 1 1 10 7185 1 1 16 MET H H -1.308 -13.572 -0.818 1.00 . A A . 18 MET H 1 1 10 7186 1 1 16 MET HA H -0.127 -11.624 1.094 1.00 . A A . 18 MET HA 1 1 10 7187 1 1 16 MET HB2 H -0.365 -14.377 1.621 1.00 . A A . 18 MET HB2 1 1 10 7188 1 1 16 MET HB3 H 1.317 -14.136 1.149 1.00 . A A . 18 MET HB3 1 1 10 7189 1 1 16 MET HE1 H 0.089 -12.811 6.287 1.00 . A A . 18 MET HE1 1 1 10 7190 1 1 16 MET HE2 H 1.534 -12.856 5.279 1.00 . A A . 18 MET HE2 1 1 10 7191 1 1 16 MET HE3 H 0.961 -14.332 6.051 1.00 . A A . 18 MET HE3 1 1 10 7192 1 1 16 MET HG2 H 1.756 -13.230 3.160 1.00 . A A . 18 MET HG2 1 1 10 7193 1 1 16 MET HG3 H 0.562 -11.969 2.854 1.00 . A A . 18 MET HG3 1 1 10 7194 1 1 16 MET N N -1.295 -12.927 -0.083 1.00 . A A . 18 MET N 1 1 10 7195 1 1 16 MET O O 2.233 -12.648 -0.298 1.00 . A A . 18 MET O 1 1 10 7196 1 1 16 MET SD S -0.367 -13.767 4.137 1.00 . A A . 18 MET SD 1 1 10 7197 1 1 17 GLU C C 2.943 -11.018 -2.142 1.00 . A A . 19 GLU C 1 1 10 7198 1 1 17 GLU CA C 1.719 -11.698 -2.755 1.00 . A A . 19 GLU CA 1 1 10 7199 1 1 17 GLU CB C 1.139 -10.811 -3.860 1.00 . A A . 19 GLU CB 1 1 10 7200 1 1 17 GLU CD C 0.164 -11.358 -6.097 1.00 . A A . 19 GLU CD 1 1 10 7201 1 1 17 GLU CG C 1.416 -11.450 -5.223 1.00 . A A . 19 GLU CG 1 1 10 7202 1 1 17 GLU H H -0.237 -11.672 -1.848 1.00 . A A . 19 GLU H 1 1 10 7203 1 1 17 GLU HA H 2.004 -12.654 -3.168 1.00 . A A . 19 GLU HA 1 1 10 7204 1 1 17 GLU HB2 H 0.073 -10.708 -3.717 1.00 . A A . 19 GLU HB2 1 1 10 7205 1 1 17 GLU HB3 H 1.604 -9.837 -3.820 1.00 . A A . 19 GLU HB3 1 1 10 7206 1 1 17 GLU HG2 H 2.231 -10.929 -5.705 1.00 . A A . 19 GLU HG2 1 1 10 7207 1 1 17 GLU HG3 H 1.681 -12.487 -5.086 1.00 . A A . 19 GLU HG3 1 1 10 7208 1 1 17 GLU N N 0.702 -11.898 -1.683 1.00 . A A . 19 GLU N 1 1 10 7209 1 1 17 GLU O O 2.822 -10.209 -1.242 1.00 . A A . 19 GLU O 1 1 10 7210 1 1 17 GLU OE1 O -0.838 -11.947 -5.727 1.00 . A A . 19 GLU OE1 1 1 10 7211 1 1 17 GLU OE2 O 0.228 -10.700 -7.122 1.00 . A A . 19 GLU OE2 1 1 10 7212 1 1 18 TYR C C 5.677 -9.418 -2.752 1.00 . A A . 20 TYR C 1 1 10 7213 1 1 18 TYR CA C 5.329 -10.705 -2.007 1.00 . A A . 20 TYR CA 1 1 10 7214 1 1 18 TYR CB C 6.517 -11.654 -2.077 1.00 . A A . 20 TYR CB 1 1 10 7215 1 1 18 TYR CD1 C 8.110 -10.262 -0.711 1.00 . A A . 20 TYR CD1 1 1 10 7216 1 1 18 TYR CD2 C 7.459 -12.443 0.126 1.00 . A A . 20 TYR CD2 1 1 10 7217 1 1 18 TYR CE1 C 8.912 -10.066 0.419 1.00 . A A . 20 TYR CE1 1 1 10 7218 1 1 18 TYR CE2 C 8.263 -12.246 1.257 1.00 . A A . 20 TYR CE2 1 1 10 7219 1 1 18 TYR CG C 7.383 -11.450 -0.858 1.00 . A A . 20 TYR CG 1 1 10 7220 1 1 18 TYR CZ C 8.989 -11.058 1.403 1.00 . A A . 20 TYR CZ 1 1 10 7221 1 1 18 TYR H H 4.208 -12.001 -3.318 1.00 . A A . 20 TYR H 1 1 10 7222 1 1 18 TYR HA H 5.128 -10.468 -0.973 1.00 . A A . 20 TYR HA 1 1 10 7223 1 1 18 TYR HB2 H 6.167 -12.676 -2.111 1.00 . A A . 20 TYR HB2 1 1 10 7224 1 1 18 TYR HB3 H 7.088 -11.434 -2.963 1.00 . A A . 20 TYR HB3 1 1 10 7225 1 1 18 TYR HD1 H 8.050 -9.495 -1.470 1.00 . A A . 20 TYR HD1 1 1 10 7226 1 1 18 TYR HD2 H 6.900 -13.359 0.015 1.00 . A A . 20 TYR HD2 1 1 10 7227 1 1 18 TYR HE1 H 9.471 -9.149 0.531 1.00 . A A . 20 TYR HE1 1 1 10 7228 1 1 18 TYR HE2 H 8.323 -13.010 2.017 1.00 . A A . 20 TYR HE2 1 1 10 7229 1 1 18 TYR HH H 10.699 -10.922 2.238 1.00 . A A . 20 TYR HH 1 1 10 7230 1 1 18 TYR N N 4.120 -11.339 -2.601 1.00 . A A . 20 TYR N 1 1 10 7231 1 1 18 TYR O O 6.244 -9.433 -3.825 1.00 . A A . 20 TYR O 1 1 10 7232 1 1 18 TYR OH O 9.782 -10.865 2.515 1.00 . A A . 20 TYR OH 1 1 10 7233 1 1 19 ARG C C 5.790 -5.973 -1.641 1.00 . A A . 21 ARG C 1 1 10 7234 1 1 19 ARG CA C 5.660 -6.989 -2.778 1.00 . A A . 21 ARG CA 1 1 10 7235 1 1 19 ARG CB C 4.539 -6.539 -3.731 1.00 . A A . 21 ARG CB 1 1 10 7236 1 1 19 ARG CD C 3.875 -8.686 -4.907 1.00 . A A . 21 ARG CD 1 1 10 7237 1 1 19 ARG CG C 3.463 -7.629 -3.867 1.00 . A A . 21 ARG CG 1 1 10 7238 1 1 19 ARG CZ C 5.077 -8.270 -6.973 1.00 . A A . 21 ARG CZ 1 1 10 7239 1 1 19 ARG H H 4.915 -8.347 -1.296 1.00 . A A . 21 ARG H 1 1 10 7240 1 1 19 ARG HA H 6.595 -7.050 -3.318 1.00 . A A . 21 ARG HA 1 1 10 7241 1 1 19 ARG HB2 H 4.085 -5.641 -3.339 1.00 . A A . 21 ARG HB2 1 1 10 7242 1 1 19 ARG HB3 H 4.958 -6.325 -4.700 1.00 . A A . 21 ARG HB3 1 1 10 7243 1 1 19 ARG HD2 H 4.101 -9.613 -4.406 1.00 . A A . 21 ARG HD2 1 1 10 7244 1 1 19 ARG HD3 H 3.057 -8.847 -5.593 1.00 . A A . 21 ARG HD3 1 1 10 7245 1 1 19 ARG HE H 5.862 -7.896 -5.188 1.00 . A A . 21 ARG HE 1 1 10 7246 1 1 19 ARG HG2 H 3.316 -8.108 -2.910 1.00 . A A . 21 ARG HG2 1 1 10 7247 1 1 19 ARG HG3 H 2.535 -7.171 -4.179 1.00 . A A . 21 ARG HG3 1 1 10 7248 1 1 19 ARG HH11 H 4.754 -10.243 -7.068 1.00 . A A . 21 ARG HH11 1 1 10 7249 1 1 19 ARG HH12 H 4.894 -9.434 -8.592 1.00 . A A . 21 ARG HH12 1 1 10 7250 1 1 19 ARG HH21 H 5.397 -6.305 -7.184 1.00 . A A . 21 ARG HH21 1 1 10 7251 1 1 19 ARG HH22 H 5.260 -7.205 -8.658 1.00 . A A . 21 ARG HH22 1 1 10 7252 1 1 19 ARG N N 5.353 -8.310 -2.164 1.00 . A A . 21 ARG N 1 1 10 7253 1 1 19 ARG NE N 5.076 -8.231 -5.668 1.00 . A A . 21 ARG NE 1 1 10 7254 1 1 19 ARG NH1 N 4.895 -9.404 -7.593 1.00 . A A . 21 ARG NH1 1 1 10 7255 1 1 19 ARG NH2 N 5.258 -7.174 -7.659 1.00 . A A . 21 ARG NH2 1 1 10 7256 1 1 19 ARG O O 4.805 -5.416 -1.197 1.00 . A A . 21 ARG O 1 1 10 7257 1 1 20 PRO C C 7.232 -3.404 -0.532 1.00 . A A . 22 PRO C 1 1 10 7258 1 1 20 PRO CA C 7.287 -4.861 -0.069 1.00 . A A . 22 PRO CA 1 1 10 7259 1 1 20 PRO CB C 8.704 -5.247 0.359 1.00 . A A . 22 PRO CB 1 1 10 7260 1 1 20 PRO CD C 8.193 -6.456 -1.735 1.00 . A A . 22 PRO CD 1 1 10 7261 1 1 20 PRO CG C 9.351 -5.946 -0.857 1.00 . A A . 22 PRO CG 1 1 10 7262 1 1 20 PRO HA H 6.600 -5.025 0.745 1.00 . A A . 22 PRO HA 1 1 10 7263 1 1 20 PRO HB2 H 9.265 -4.360 0.626 1.00 . A A . 22 PRO HB2 1 1 10 7264 1 1 20 PRO HB3 H 8.667 -5.929 1.193 1.00 . A A . 22 PRO HB3 1 1 10 7265 1 1 20 PRO HD2 H 8.348 -6.172 -2.768 1.00 . A A . 22 PRO HD2 1 1 10 7266 1 1 20 PRO HD3 H 8.091 -7.526 -1.646 1.00 . A A . 22 PRO HD3 1 1 10 7267 1 1 20 PRO HG2 H 9.956 -5.240 -1.411 1.00 . A A . 22 PRO HG2 1 1 10 7268 1 1 20 PRO HG3 H 9.956 -6.778 -0.532 1.00 . A A . 22 PRO HG3 1 1 10 7269 1 1 20 PRO N N 6.999 -5.782 -1.183 1.00 . A A . 22 PRO N 1 1 10 7270 1 1 20 PRO O O 7.954 -2.995 -1.420 1.00 . A A . 22 PRO O 1 1 10 7271 1 1 21 LEU C C 6.415 -0.310 0.926 1.00 . A A . 23 LEU C 1 1 10 7272 1 1 21 LEU CA C 6.291 -1.184 -0.321 1.00 . A A . 23 LEU CA 1 1 10 7273 1 1 21 LEU CB C 4.939 -0.915 -0.987 1.00 . A A . 23 LEU CB 1 1 10 7274 1 1 21 LEU CD1 C 3.409 -2.433 -2.244 1.00 . A A . 23 LEU CD1 1 1 10 7275 1 1 21 LEU CD2 C 4.956 -0.917 -3.483 1.00 . A A . 23 LEU CD2 1 1 10 7276 1 1 21 LEU CG C 4.793 -1.786 -2.234 1.00 . A A . 23 LEU CG 1 1 10 7277 1 1 21 LEU H H 5.817 -2.968 0.791 1.00 . A A . 23 LEU H 1 1 10 7278 1 1 21 LEU HA H 7.086 -0.946 -1.011 1.00 . A A . 23 LEU HA 1 1 10 7279 1 1 21 LEU HB2 H 4.145 -1.145 -0.292 1.00 . A A . 23 LEU HB2 1 1 10 7280 1 1 21 LEU HB3 H 4.879 0.127 -1.270 1.00 . A A . 23 LEU HB3 1 1 10 7281 1 1 21 LEU HD11 H 3.199 -2.849 -1.270 1.00 . A A . 23 LEU HD11 1 1 10 7282 1 1 21 LEU HD12 H 3.383 -3.218 -2.985 1.00 . A A . 23 LEU HD12 1 1 10 7283 1 1 21 LEU HD13 H 2.666 -1.685 -2.484 1.00 . A A . 23 LEU HD13 1 1 10 7284 1 1 21 LEU HD21 H 3.985 -0.712 -3.907 1.00 . A A . 23 LEU HD21 1 1 10 7285 1 1 21 LEU HD22 H 5.564 -1.438 -4.208 1.00 . A A . 23 LEU HD22 1 1 10 7286 1 1 21 LEU HD23 H 5.435 0.013 -3.213 1.00 . A A . 23 LEU HD23 1 1 10 7287 1 1 21 LEU HG H 5.552 -2.556 -2.226 1.00 . A A . 23 LEU HG 1 1 10 7288 1 1 21 LEU N N 6.386 -2.616 0.072 1.00 . A A . 23 LEU N 1 1 10 7289 1 1 21 LEU O O 5.609 -0.391 1.832 1.00 . A A . 23 LEU O 1 1 10 7290 1 1 22 CYS C C 6.736 2.691 1.917 1.00 . A A . 24 CYS C 1 1 10 7291 1 1 22 CYS CA C 7.548 1.423 2.168 1.00 . A A . 24 CYS CA 1 1 10 7292 1 1 22 CYS CB C 9.020 1.789 2.378 1.00 . A A . 24 CYS CB 1 1 10 7293 1 1 22 CYS H H 8.038 0.604 0.236 1.00 . A A . 24 CYS H 1 1 10 7294 1 1 22 CYS HA H 7.168 0.916 3.044 1.00 . A A . 24 CYS HA 1 1 10 7295 1 1 22 CYS HB2 H 9.579 0.903 2.642 1.00 . A A . 24 CYS HB2 1 1 10 7296 1 1 22 CYS HB3 H 9.421 2.211 1.469 1.00 . A A . 24 CYS HB3 1 1 10 7297 1 1 22 CYS N N 7.403 0.540 0.978 1.00 . A A . 24 CYS N 1 1 10 7298 1 1 22 CYS O O 7.249 3.684 1.448 1.00 . A A . 24 CYS O 1 1 10 7299 1 1 22 CYS SG S 9.140 3.004 3.716 1.00 . A A . 24 CYS SG 1 1 10 7300 1 1 23 GLY C C 5.277 5.103 2.522 1.00 . A A . 25 GLY C 1 1 10 7301 1 1 23 GLY CA C 4.599 3.846 1.979 1.00 . A A . 25 GLY CA 1 1 10 7302 1 1 23 GLY H H 5.073 1.835 2.588 1.00 . A A . 25 GLY H 1 1 10 7303 1 1 23 GLY HA2 H 4.428 3.961 0.917 1.00 . A A . 25 GLY HA2 1 1 10 7304 1 1 23 GLY HA3 H 3.653 3.707 2.481 1.00 . A A . 25 GLY HA3 1 1 10 7305 1 1 23 GLY N N 5.464 2.654 2.215 1.00 . A A . 25 GLY N 1 1 10 7306 1 1 23 GLY O O 5.989 5.058 3.505 1.00 . A A . 25 GLY O 1 1 10 7307 1 1 24 SER C C 5.360 7.706 3.857 1.00 . A A . 26 SER C 1 1 10 7308 1 1 24 SER CA C 5.676 7.495 2.372 1.00 . A A . 26 SER CA 1 1 10 7309 1 1 24 SER CB C 5.121 8.669 1.567 1.00 . A A . 26 SER CB 1 1 10 7310 1 1 24 SER H H 4.470 6.239 1.098 1.00 . A A . 26 SER H 1 1 10 7311 1 1 24 SER HA H 6.746 7.441 2.237 1.00 . A A . 26 SER HA 1 1 10 7312 1 1 24 SER HB2 H 5.224 8.467 0.513 1.00 . A A . 26 SER HB2 1 1 10 7313 1 1 24 SER HB3 H 4.074 8.803 1.805 1.00 . A A . 26 SER HB3 1 1 10 7314 1 1 24 SER HG H 5.823 9.956 2.844 1.00 . A A . 26 SER HG 1 1 10 7315 1 1 24 SER N N 5.053 6.228 1.891 1.00 . A A . 26 SER N 1 1 10 7316 1 1 24 SER O O 5.990 8.502 4.524 1.00 . A A . 26 SER O 1 1 10 7317 1 1 24 SER OG O 5.849 9.845 1.891 1.00 . A A . 26 SER OG 1 1 10 7318 1 1 25 ASP C C 4.986 6.339 6.698 1.00 . A A . 27 ASP C 1 1 10 7319 1 1 25 ASP CA C 4.038 7.172 5.824 1.00 . A A . 27 ASP CA 1 1 10 7320 1 1 25 ASP CB C 2.597 6.710 6.050 1.00 . A A . 27 ASP CB 1 1 10 7321 1 1 25 ASP CG C 2.531 5.184 5.972 1.00 . A A . 27 ASP CG 1 1 10 7322 1 1 25 ASP H H 3.888 6.371 3.832 1.00 . A A . 27 ASP H 1 1 10 7323 1 1 25 ASP HA H 4.126 8.213 6.095 1.00 . A A . 27 ASP HA 1 1 10 7324 1 1 25 ASP HB2 H 2.264 7.037 7.023 1.00 . A A . 27 ASP HB2 1 1 10 7325 1 1 25 ASP HB3 H 1.961 7.134 5.288 1.00 . A A . 27 ASP HB3 1 1 10 7326 1 1 25 ASP N N 4.390 7.005 4.383 1.00 . A A . 27 ASP N 1 1 10 7327 1 1 25 ASP O O 4.706 6.077 7.851 1.00 . A A . 27 ASP O 1 1 10 7328 1 1 25 ASP OD1 O 3.411 4.602 5.359 1.00 . A A . 27 ASP OD1 1 1 10 7329 1 1 25 ASP OD2 O 1.603 4.622 6.529 1.00 . A A . 27 ASP OD2 1 1 10 7330 1 1 26 ASN C C 6.452 3.768 7.316 1.00 . A A . 28 ASN C 1 1 10 7331 1 1 26 ASN CA C 7.067 5.126 6.971 1.00 . A A . 28 ASN CA 1 1 10 7332 1 1 26 ASN CB C 7.392 5.880 8.262 1.00 . A A . 28 ASN CB 1 1 10 7333 1 1 26 ASN CG C 8.895 6.159 8.333 1.00 . A A . 28 ASN CG 1 1 10 7334 1 1 26 ASN H H 6.319 6.155 5.242 1.00 . A A . 28 ASN H 1 1 10 7335 1 1 26 ASN HA H 7.976 4.976 6.405 1.00 . A A . 28 ASN HA 1 1 10 7336 1 1 26 ASN HB2 H 6.851 6.815 8.277 1.00 . A A . 28 ASN HB2 1 1 10 7337 1 1 26 ASN HB3 H 7.098 5.281 9.109 1.00 . A A . 28 ASN HB3 1 1 10 7338 1 1 26 ASN HD21 H 8.675 7.841 9.367 1.00 . A A . 28 ASN HD21 1 1 10 7339 1 1 26 ASN HD22 H 10.279 7.416 9.007 1.00 . A A . 28 ASN HD22 1 1 10 7340 1 1 26 ASN N N 6.106 5.929 6.166 1.00 . A A . 28 ASN N 1 1 10 7341 1 1 26 ASN ND2 N 9.318 7.227 8.953 1.00 . A A . 28 ASN ND2 1 1 10 7342 1 1 26 ASN O O 6.660 3.240 8.390 1.00 . A A . 28 ASN O 1 1 10 7343 1 1 26 ASN OD1 O 9.691 5.398 7.821 1.00 . A A . 28 ASN OD1 1 1 10 7344 1 1 27 LYS C C 5.425 0.867 5.632 1.00 . A A . 29 LYS C 1 1 10 7345 1 1 27 LYS CA C 5.072 1.880 6.722 1.00 . A A . 29 LYS CA 1 1 10 7346 1 1 27 LYS CB C 3.557 2.047 6.798 1.00 . A A . 29 LYS CB 1 1 10 7347 1 1 27 LYS CD C 3.267 0.971 9.031 1.00 . A A . 29 LYS CD 1 1 10 7348 1 1 27 LYS CE C 2.264 1.921 9.688 1.00 . A A . 29 LYS CE 1 1 10 7349 1 1 27 LYS CG C 2.963 0.854 7.534 1.00 . A A . 29 LYS CG 1 1 10 7350 1 1 27 LYS H H 5.523 3.627 5.562 1.00 . A A . 29 LYS H 1 1 10 7351 1 1 27 LYS HA H 5.438 1.521 7.666 1.00 . A A . 29 LYS HA 1 1 10 7352 1 1 27 LYS HB2 H 3.321 2.956 7.331 1.00 . A A . 29 LYS HB2 1 1 10 7353 1 1 27 LYS HB3 H 3.147 2.094 5.801 1.00 . A A . 29 LYS HB3 1 1 10 7354 1 1 27 LYS HD2 H 3.193 -0.004 9.489 1.00 . A A . 29 LYS HD2 1 1 10 7355 1 1 27 LYS HD3 H 4.266 1.357 9.166 1.00 . A A . 29 LYS HD3 1 1 10 7356 1 1 27 LYS HE2 H 2.699 2.341 10.583 1.00 . A A . 29 LYS HE2 1 1 10 7357 1 1 27 LYS HE3 H 2.014 2.715 9.000 1.00 . A A . 29 LYS HE3 1 1 10 7358 1 1 27 LYS HG2 H 1.896 0.836 7.381 1.00 . A A . 29 LYS HG2 1 1 10 7359 1 1 27 LYS HG3 H 3.401 -0.053 7.150 1.00 . A A . 29 LYS HG3 1 1 10 7360 1 1 27 LYS HZ1 H 1.149 0.167 9.788 1.00 . A A . 29 LYS HZ1 1 1 10 7361 1 1 27 LYS HZ2 H 0.221 1.565 9.527 1.00 . A A . 29 LYS HZ2 1 1 10 7362 1 1 27 LYS HZ3 H 0.861 1.242 11.067 1.00 . A A . 29 LYS HZ3 1 1 10 7363 1 1 27 LYS N N 5.691 3.194 6.422 1.00 . A A . 29 LYS N 1 1 10 7364 1 1 27 LYS NZ N 1.030 1.167 10.045 1.00 . A A . 29 LYS NZ 1 1 10 7365 1 1 27 LYS O O 5.662 1.219 4.493 1.00 . A A . 29 LYS O 1 1 10 7366 1 1 28 THR C C 4.547 -2.274 4.679 1.00 . A A . 30 THR C 1 1 10 7367 1 1 28 THR CA C 5.793 -1.436 4.965 1.00 . A A . 30 THR CA 1 1 10 7368 1 1 28 THR CB C 6.901 -2.341 5.510 1.00 . A A . 30 THR CB 1 1 10 7369 1 1 28 THR CG2 C 7.052 -3.566 4.606 1.00 . A A . 30 THR CG2 1 1 10 7370 1 1 28 THR H H 5.264 -0.653 6.899 1.00 . A A . 30 THR H 1 1 10 7371 1 1 28 THR HA H 6.128 -0.963 4.054 1.00 . A A . 30 THR HA 1 1 10 7372 1 1 28 THR HB H 6.646 -2.664 6.507 1.00 . A A . 30 THR HB 1 1 10 7373 1 1 28 THR HG1 H 8.721 -2.076 6.141 1.00 . A A . 30 THR HG1 1 1 10 7374 1 1 28 THR HG21 H 6.143 -4.149 4.635 1.00 . A A . 30 THR HG21 1 1 10 7375 1 1 28 THR HG22 H 7.877 -4.170 4.953 1.00 . A A . 30 THR HG22 1 1 10 7376 1 1 28 THR HG23 H 7.242 -3.245 3.592 1.00 . A A . 30 THR HG23 1 1 10 7377 1 1 28 THR N N 5.459 -0.392 5.975 1.00 . A A . 30 THR N 1 1 10 7378 1 1 28 THR O O 3.875 -2.730 5.582 1.00 . A A . 30 THR O 1 1 10 7379 1 1 28 THR OG1 O 8.125 -1.620 5.543 1.00 . A A . 30 THR OG1 1 1 10 7380 1 1 29 TYR C C 3.449 -4.625 2.515 1.00 . A A . 31 TYR C 1 1 10 7381 1 1 29 TYR CA C 3.022 -3.275 3.094 1.00 . A A . 31 TYR CA 1 1 10 7382 1 1 29 TYR CB C 2.195 -2.509 2.067 1.00 . A A . 31 TYR CB 1 1 10 7383 1 1 29 TYR CD1 C 0.674 -1.617 3.872 1.00 . A A . 31 TYR CD1 1 1 10 7384 1 1 29 TYR CD2 C 1.625 -0.061 2.272 1.00 . A A . 31 TYR CD2 1 1 10 7385 1 1 29 TYR CE1 C 0.013 -0.559 4.508 1.00 . A A . 31 TYR CE1 1 1 10 7386 1 1 29 TYR CE2 C 0.964 0.997 2.909 1.00 . A A . 31 TYR CE2 1 1 10 7387 1 1 29 TYR CG C 1.479 -1.369 2.752 1.00 . A A . 31 TYR CG 1 1 10 7388 1 1 29 TYR CZ C 0.159 0.748 4.026 1.00 . A A . 31 TYR CZ 1 1 10 7389 1 1 29 TYR H H 4.770 -2.096 2.714 1.00 . A A . 31 TYR H 1 1 10 7390 1 1 29 TYR HA H 2.434 -3.433 3.985 1.00 . A A . 31 TYR HA 1 1 10 7391 1 1 29 TYR HB2 H 2.849 -2.116 1.301 1.00 . A A . 31 TYR HB2 1 1 10 7392 1 1 29 TYR HB3 H 1.477 -3.170 1.622 1.00 . A A . 31 TYR HB3 1 1 10 7393 1 1 29 TYR HD1 H 0.562 -2.624 4.243 1.00 . A A . 31 TYR HD1 1 1 10 7394 1 1 29 TYR HD2 H 2.246 0.131 1.410 1.00 . A A . 31 TYR HD2 1 1 10 7395 1 1 29 TYR HE1 H -0.607 -0.751 5.371 1.00 . A A . 31 TYR HE1 1 1 10 7396 1 1 29 TYR HE2 H 1.076 2.005 2.537 1.00 . A A . 31 TYR HE2 1 1 10 7397 1 1 29 TYR HH H -0.238 1.785 5.580 1.00 . A A . 31 TYR HH 1 1 10 7398 1 1 29 TYR N N 4.225 -2.476 3.430 1.00 . A A . 31 TYR N 1 1 10 7399 1 1 29 TYR O O 4.543 -4.777 2.007 1.00 . A A . 31 TYR O 1 1 10 7400 1 1 29 TYR OH O -0.493 1.791 4.654 1.00 . A A . 31 TYR OH 1 1 10 7401 1 1 30 GLY C C 2.781 -6.983 0.540 1.00 . A A . 32 GLY C 1 1 10 7402 1 1 30 GLY CA C 2.950 -6.955 2.061 1.00 . A A . 32 GLY CA 1 1 10 7403 1 1 30 GLY H H 1.720 -5.466 3.015 1.00 . A A . 32 GLY H 1 1 10 7404 1 1 30 GLY HA2 H 3.978 -7.177 2.311 1.00 . A A . 32 GLY HA2 1 1 10 7405 1 1 30 GLY HA3 H 2.305 -7.698 2.503 1.00 . A A . 32 GLY HA3 1 1 10 7406 1 1 30 GLY N N 2.595 -5.610 2.595 1.00 . A A . 32 GLY N 1 1 10 7407 1 1 30 GLY O O 3.261 -7.880 -0.122 1.00 . A A . 32 GLY O 1 1 10 7408 1 1 31 ASN C C 1.238 -4.739 -1.956 1.00 . A A . 33 ASN C 1 1 10 7409 1 1 31 ASN CA C 1.936 -6.023 -1.505 1.00 . A A . 33 ASN CA 1 1 10 7410 1 1 31 ASN CB C 1.103 -7.237 -1.924 1.00 . A A . 33 ASN CB 1 1 10 7411 1 1 31 ASN CG C -0.195 -7.274 -1.119 1.00 . A A . 33 ASN CG 1 1 10 7412 1 1 31 ASN H H 1.725 -5.295 0.513 1.00 . A A . 33 ASN H 1 1 10 7413 1 1 31 ASN HA H 2.906 -6.081 -1.974 1.00 . A A . 33 ASN HA 1 1 10 7414 1 1 31 ASN HB2 H 0.871 -7.169 -2.977 1.00 . A A . 33 ASN HB2 1 1 10 7415 1 1 31 ASN HB3 H 1.665 -8.140 -1.736 1.00 . A A . 33 ASN HB3 1 1 10 7416 1 1 31 ASN HD21 H -0.300 -9.257 -1.112 1.00 . A A . 33 ASN HD21 1 1 10 7417 1 1 31 ASN HD22 H -1.564 -8.460 -0.307 1.00 . A A . 33 ASN HD22 1 1 10 7418 1 1 31 ASN N N 2.109 -6.018 -0.027 1.00 . A A . 33 ASN N 1 1 10 7419 1 1 31 ASN ND2 N -0.731 -8.426 -0.822 1.00 . A A . 33 ASN ND2 1 1 10 7420 1 1 31 ASN O O 0.631 -4.035 -1.173 1.00 . A A . 33 ASN O 1 1 10 7421 1 1 31 ASN OD1 O -0.729 -6.246 -0.762 1.00 . A A . 33 ASN OD1 1 1 10 7422 1 1 32 LYS C C -0.824 -3.263 -3.544 1.00 . A A . 34 LYS C 1 1 10 7423 1 1 32 LYS CA C 0.690 -3.194 -3.743 1.00 . A A . 34 LYS CA 1 1 10 7424 1 1 32 LYS CB C 1.007 -3.040 -5.235 1.00 . A A . 34 LYS CB 1 1 10 7425 1 1 32 LYS CD C 0.891 -4.186 -7.454 1.00 . A A . 34 LYS CD 1 1 10 7426 1 1 32 LYS CE C 0.709 -5.534 -8.156 1.00 . A A . 34 LYS CE 1 1 10 7427 1 1 32 LYS CG C 0.871 -4.393 -5.938 1.00 . A A . 34 LYS CG 1 1 10 7428 1 1 32 LYS H H 1.832 -5.014 -3.821 1.00 . A A . 34 LYS H 1 1 10 7429 1 1 32 LYS HA H 1.076 -2.340 -3.207 1.00 . A A . 34 LYS HA 1 1 10 7430 1 1 32 LYS HB2 H 0.318 -2.334 -5.676 1.00 . A A . 34 LYS HB2 1 1 10 7431 1 1 32 LYS HB3 H 2.016 -2.676 -5.351 1.00 . A A . 34 LYS HB3 1 1 10 7432 1 1 32 LYS HD2 H 0.090 -3.519 -7.737 1.00 . A A . 34 LYS HD2 1 1 10 7433 1 1 32 LYS HD3 H 1.838 -3.755 -7.747 1.00 . A A . 34 LYS HD3 1 1 10 7434 1 1 32 LYS HE2 H 0.936 -6.332 -7.465 1.00 . A A . 34 LYS HE2 1 1 10 7435 1 1 32 LYS HE3 H -0.313 -5.629 -8.492 1.00 . A A . 34 LYS HE3 1 1 10 7436 1 1 32 LYS HG2 H 1.694 -5.031 -5.653 1.00 . A A . 34 LYS HG2 1 1 10 7437 1 1 32 LYS HG3 H -0.062 -4.856 -5.653 1.00 . A A . 34 LYS HG3 1 1 10 7438 1 1 32 LYS HZ1 H 2.613 -5.609 -8.997 1.00 . A A . 34 LYS HZ1 1 1 10 7439 1 1 32 LYS HZ2 H 1.464 -4.796 -9.951 1.00 . A A . 34 LYS HZ2 1 1 10 7440 1 1 32 LYS HZ3 H 1.444 -6.493 -9.851 1.00 . A A . 34 LYS HZ3 1 1 10 7441 1 1 32 LYS N N 1.331 -4.431 -3.218 1.00 . A A . 34 LYS N 1 1 10 7442 1 1 32 LYS NZ N 1.627 -5.614 -9.326 1.00 . A A . 34 LYS NZ 1 1 10 7443 1 1 32 LYS O O -1.518 -2.277 -3.689 1.00 . A A . 34 LYS O 1 1 10 7444 1 1 33 CYS C C -3.151 -3.718 -1.707 1.00 . A A . 35 CYS C 1 1 10 7445 1 1 33 CYS CA C -2.819 -4.493 -2.978 1.00 . A A . 35 CYS CA 1 1 10 7446 1 1 33 CYS CB C -3.240 -5.955 -2.819 1.00 . A A . 35 CYS CB 1 1 10 7447 1 1 33 CYS H H -0.784 -5.197 -3.067 1.00 . A A . 35 CYS H 1 1 10 7448 1 1 33 CYS HA H -3.337 -4.052 -3.816 1.00 . A A . 35 CYS HA 1 1 10 7449 1 1 33 CYS HB2 H -2.986 -6.502 -3.716 1.00 . A A . 35 CYS HB2 1 1 10 7450 1 1 33 CYS HB3 H -2.724 -6.388 -1.975 1.00 . A A . 35 CYS HB3 1 1 10 7451 1 1 33 CYS N N -1.351 -4.407 -3.197 1.00 . A A . 35 CYS N 1 1 10 7452 1 1 33 CYS O O -4.156 -3.039 -1.616 1.00 . A A . 35 CYS O 1 1 10 7453 1 1 33 CYS SG S -5.028 -6.035 -2.546 1.00 . A A . 35 CYS SG 1 1 10 7454 1 1 34 ASN C C -2.113 -1.616 0.308 1.00 . A A . 36 ASN C 1 1 10 7455 1 1 34 ASN CA C -2.504 -3.075 0.527 1.00 . A A . 36 ASN CA 1 1 10 7456 1 1 34 ASN CB C -1.595 -3.704 1.576 1.00 . A A . 36 ASN CB 1 1 10 7457 1 1 34 ASN CG C -2.429 -4.503 2.575 1.00 . A A . 36 ASN CG 1 1 10 7458 1 1 34 ASN H H -1.488 -4.334 -0.827 1.00 . A A . 36 ASN H 1 1 10 7459 1 1 34 ASN HA H -3.535 -3.149 0.829 1.00 . A A . 36 ASN HA 1 1 10 7460 1 1 34 ASN HB2 H -0.892 -4.365 1.088 1.00 . A A . 36 ASN HB2 1 1 10 7461 1 1 34 ASN HB3 H -1.057 -2.933 2.086 1.00 . A A . 36 ASN HB3 1 1 10 7462 1 1 34 ASN HD21 H -3.932 -3.213 2.567 1.00 . A A . 36 ASN HD21 1 1 10 7463 1 1 34 ASN HD22 H -4.142 -4.568 3.562 1.00 . A A . 36 ASN HD22 1 1 10 7464 1 1 34 ASN N N -2.291 -3.800 -0.730 1.00 . A A . 36 ASN N 1 1 10 7465 1 1 34 ASN ND2 N -3.598 -4.056 2.934 1.00 . A A . 36 ASN ND2 1 1 10 7466 1 1 34 ASN O O -2.535 -0.728 1.021 1.00 . A A . 36 ASN O 1 1 10 7467 1 1 34 ASN OD1 O -2.013 -5.549 3.033 1.00 . A A . 36 ASN OD1 1 1 10 7468 1 1 35 PHE C C -2.021 0.758 -1.677 1.00 . A A . 37 PHE C 1 1 10 7469 1 1 35 PHE CA C -0.873 0.020 -0.986 1.00 . A A . 37 PHE CA 1 1 10 7470 1 1 35 PHE CB C 0.346 -0.023 -1.911 1.00 . A A . 37 PHE CB 1 1 10 7471 1 1 35 PHE CD1 C 1.338 2.125 -1.029 1.00 . A A . 37 PHE CD1 1 1 10 7472 1 1 35 PHE CD2 C 0.937 1.912 -3.412 1.00 . A A . 37 PHE CD2 1 1 10 7473 1 1 35 PHE CE1 C 1.843 3.416 -1.230 1.00 . A A . 37 PHE CE1 1 1 10 7474 1 1 35 PHE CE2 C 1.442 3.202 -3.613 1.00 . A A . 37 PHE CE2 1 1 10 7475 1 1 35 PHE CG C 0.885 1.372 -2.121 1.00 . A A . 37 PHE CG 1 1 10 7476 1 1 35 PHE CZ C 1.895 3.954 -2.522 1.00 . A A . 37 PHE CZ 1 1 10 7477 1 1 35 PHE H H -0.985 -2.111 -1.247 1.00 . A A . 37 PHE H 1 1 10 7478 1 1 35 PHE HA H -0.618 0.525 -0.067 1.00 . A A . 37 PHE HA 1 1 10 7479 1 1 35 PHE HB2 H 1.113 -0.641 -1.466 1.00 . A A . 37 PHE HB2 1 1 10 7480 1 1 35 PHE HB3 H 0.057 -0.441 -2.863 1.00 . A A . 37 PHE HB3 1 1 10 7481 1 1 35 PHE HD1 H 1.298 1.710 -0.033 1.00 . A A . 37 PHE HD1 1 1 10 7482 1 1 35 PHE HD2 H 0.589 1.332 -4.254 1.00 . A A . 37 PHE HD2 1 1 10 7483 1 1 35 PHE HE1 H 2.193 3.997 -0.389 1.00 . A A . 37 PHE HE1 1 1 10 7484 1 1 35 PHE HE2 H 1.483 3.617 -4.610 1.00 . A A . 37 PHE HE2 1 1 10 7485 1 1 35 PHE HZ H 2.284 4.949 -2.678 1.00 . A A . 37 PHE HZ 1 1 10 7486 1 1 35 PHE N N -1.306 -1.371 -0.688 1.00 . A A . 37 PHE N 1 1 10 7487 1 1 35 PHE O O -2.209 1.945 -1.497 1.00 . A A . 37 PHE O 1 1 10 7488 1 1 36 CYS C C -5.092 0.850 -2.165 1.00 . A A . 38 CYS C 1 1 10 7489 1 1 36 CYS CA C -3.938 0.704 -3.153 1.00 . A A . 38 CYS CA 1 1 10 7490 1 1 36 CYS CB C -4.381 -0.162 -4.335 1.00 . A A . 38 CYS CB 1 1 10 7491 1 1 36 CYS H H -2.626 -0.902 -2.580 1.00 . A A . 38 CYS H 1 1 10 7492 1 1 36 CYS HA H -3.640 1.679 -3.510 1.00 . A A . 38 CYS HA 1 1 10 7493 1 1 36 CYS HB2 H -4.426 -1.196 -4.027 1.00 . A A . 38 CYS HB2 1 1 10 7494 1 1 36 CYS HB3 H -5.358 0.157 -4.669 1.00 . A A . 38 CYS HB3 1 1 10 7495 1 1 36 CYS N N -2.794 0.056 -2.458 1.00 . A A . 38 CYS N 1 1 10 7496 1 1 36 CYS O O -5.967 1.678 -2.329 1.00 . A A . 38 CYS O 1 1 10 7497 1 1 36 CYS SG S -3.193 0.015 -5.688 1.00 . A A . 38 CYS SG 1 1 10 7498 1 1 37 CYS C C -5.896 1.319 0.812 1.00 . A A . 39 CYS C 1 1 10 7499 1 1 37 CYS CA C -6.187 0.148 -0.122 1.00 . A A . 39 CYS CA 1 1 10 7500 1 1 37 CYS CB C -6.258 -1.147 0.686 1.00 . A A . 39 CYS CB 1 1 10 7501 1 1 37 CYS H H -4.376 -0.604 -1.015 1.00 . A A . 39 CYS H 1 1 10 7502 1 1 37 CYS HA H -7.127 0.314 -0.623 1.00 . A A . 39 CYS HA 1 1 10 7503 1 1 37 CYS HB2 H -6.560 -1.958 0.041 1.00 . A A . 39 CYS HB2 1 1 10 7504 1 1 37 CYS HB3 H -5.287 -1.363 1.107 1.00 . A A . 39 CYS HB3 1 1 10 7505 1 1 37 CYS N N -5.097 0.053 -1.130 1.00 . A A . 39 CYS N 1 1 10 7506 1 1 37 CYS O O -6.750 2.140 1.084 1.00 . A A . 39 CYS O 1 1 10 7507 1 1 37 CYS SG S -7.466 -0.953 2.020 1.00 . A A . 39 CYS SG 1 1 10 7508 1 1 38 ALA C C -4.395 3.832 1.386 1.00 . A A . 40 ALA C 1 1 10 7509 1 1 38 ALA CA C -4.327 2.537 2.192 1.00 . A A . 40 ALA CA 1 1 10 7510 1 1 38 ALA CB C -2.905 2.335 2.722 1.00 . A A . 40 ALA CB 1 1 10 7511 1 1 38 ALA H H -4.017 0.744 1.045 1.00 . A A . 40 ALA H 1 1 10 7512 1 1 38 ALA HA H -5.023 2.582 3.018 1.00 . A A . 40 ALA HA 1 1 10 7513 1 1 38 ALA HB1 H -2.582 3.229 3.235 1.00 . A A . 40 ALA HB1 1 1 10 7514 1 1 38 ALA HB2 H -2.239 2.133 1.896 1.00 . A A . 40 ALA HB2 1 1 10 7515 1 1 38 ALA HB3 H -2.892 1.500 3.407 1.00 . A A . 40 ALA HB3 1 1 10 7516 1 1 38 ALA N N -4.689 1.411 1.291 1.00 . A A . 40 ALA N 1 1 10 7517 1 1 38 ALA O O -4.582 4.906 1.924 1.00 . A A . 40 ALA O 1 1 10 7518 1 1 39 VAL C C -5.794 5.341 -0.925 1.00 . A A . 41 VAL C 1 1 10 7519 1 1 39 VAL CA C -4.330 4.945 -0.765 1.00 . A A . 41 VAL CA 1 1 10 7520 1 1 39 VAL CB C -3.721 4.643 -2.139 1.00 . A A . 41 VAL CB 1 1 10 7521 1 1 39 VAL CG1 C -4.135 5.728 -3.139 1.00 . A A . 41 VAL CG1 1 1 10 7522 1 1 39 VAL CG2 C -2.195 4.619 -2.026 1.00 . A A . 41 VAL CG2 1 1 10 7523 1 1 39 VAL H H -4.121 2.852 -0.317 1.00 . A A . 41 VAL H 1 1 10 7524 1 1 39 VAL HA H -3.786 5.751 -0.296 1.00 . A A . 41 VAL HA 1 1 10 7525 1 1 39 VAL HB H -4.074 3.683 -2.486 1.00 . A A . 41 VAL HB 1 1 10 7526 1 1 39 VAL HG11 H -3.579 5.602 -4.056 1.00 . A A . 41 VAL HG11 1 1 10 7527 1 1 39 VAL HG12 H -3.925 6.701 -2.721 1.00 . A A . 41 VAL HG12 1 1 10 7528 1 1 39 VAL HG13 H -5.192 5.644 -3.344 1.00 . A A . 41 VAL HG13 1 1 10 7529 1 1 39 VAL HG21 H -1.914 4.504 -0.990 1.00 . A A . 41 VAL HG21 1 1 10 7530 1 1 39 VAL HG22 H -1.792 5.545 -2.408 1.00 . A A . 41 VAL HG22 1 1 10 7531 1 1 39 VAL HG23 H -1.804 3.792 -2.601 1.00 . A A . 41 VAL HG23 1 1 10 7532 1 1 39 VAL N N -4.259 3.731 0.091 1.00 . A A . 41 VAL N 1 1 10 7533 1 1 39 VAL O O -6.133 6.504 -0.954 1.00 . A A . 41 VAL O 1 1 10 7534 1 1 40 VAL C C -8.737 4.864 0.220 1.00 . A A . 42 VAL C 1 1 10 7535 1 1 40 VAL CA C -8.113 4.693 -1.168 1.00 . A A . 42 VAL CA 1 1 10 7536 1 1 40 VAL CB C -8.812 3.547 -1.906 1.00 . A A . 42 VAL CB 1 1 10 7537 1 1 40 VAL CG1 C -10.322 3.782 -1.901 1.00 . A A . 42 VAL CG1 1 1 10 7538 1 1 40 VAL CG2 C -8.311 3.490 -3.351 1.00 . A A . 42 VAL CG2 1 1 10 7539 1 1 40 VAL H H -6.367 3.447 -0.988 1.00 . A A . 42 VAL H 1 1 10 7540 1 1 40 VAL HA H -8.229 5.609 -1.730 1.00 . A A . 42 VAL HA 1 1 10 7541 1 1 40 VAL HB H -8.592 2.614 -1.410 1.00 . A A . 42 VAL HB 1 1 10 7542 1 1 40 VAL HG11 H -10.775 3.200 -1.112 1.00 . A A . 42 VAL HG11 1 1 10 7543 1 1 40 VAL HG12 H -10.737 3.481 -2.852 1.00 . A A . 42 VAL HG12 1 1 10 7544 1 1 40 VAL HG13 H -10.523 4.830 -1.736 1.00 . A A . 42 VAL HG13 1 1 10 7545 1 1 40 VAL HG21 H -9.142 3.298 -4.013 1.00 . A A . 42 VAL HG21 1 1 10 7546 1 1 40 VAL HG22 H -7.583 2.698 -3.448 1.00 . A A . 42 VAL HG22 1 1 10 7547 1 1 40 VAL HG23 H -7.854 4.434 -3.611 1.00 . A A . 42 VAL HG23 1 1 10 7548 1 1 40 VAL N N -6.666 4.379 -1.020 1.00 . A A . 42 VAL N 1 1 10 7549 1 1 40 VAL O O -9.872 5.276 0.356 1.00 . A A . 42 VAL O 1 1 10 7550 1 1 41 GLU C C -8.257 6.071 3.186 1.00 . A A . 43 GLU C 1 1 10 7551 1 1 41 GLU CA C -8.550 4.673 2.633 1.00 . A A . 43 GLU CA 1 1 10 7552 1 1 41 GLU CB C -7.892 3.630 3.539 1.00 . A A . 43 GLU CB 1 1 10 7553 1 1 41 GLU CD C -9.422 2.391 5.074 1.00 . A A . 43 GLU CD 1 1 10 7554 1 1 41 GLU CG C -8.807 2.412 3.673 1.00 . A A . 43 GLU CG 1 1 10 7555 1 1 41 GLU H H -7.094 4.205 1.119 1.00 . A A . 43 GLU H 1 1 10 7556 1 1 41 GLU HA H -9.618 4.509 2.615 1.00 . A A . 43 GLU HA 1 1 10 7557 1 1 41 GLU HB2 H -6.948 3.326 3.109 1.00 . A A . 43 GLU HB2 1 1 10 7558 1 1 41 GLU HB3 H -7.721 4.058 4.515 1.00 . A A . 43 GLU HB3 1 1 10 7559 1 1 41 GLU HG2 H -9.592 2.469 2.934 1.00 . A A . 43 GLU HG2 1 1 10 7560 1 1 41 GLU HG3 H -8.231 1.511 3.520 1.00 . A A . 43 GLU HG3 1 1 10 7561 1 1 41 GLU N N -8.004 4.542 1.252 1.00 . A A . 43 GLU N 1 1 10 7562 1 1 41 GLU O O -8.963 6.567 4.042 1.00 . A A . 43 GLU O 1 1 10 7563 1 1 41 GLU OE1 O -8.822 2.959 5.971 1.00 . A A . 43 GLU OE1 1 1 10 7564 1 1 41 GLU OE2 O -10.483 1.806 5.225 1.00 . A A . 43 GLU OE2 1 1 10 7565 1 1 42 SER C C -7.376 9.142 2.265 1.00 . A A . 44 SER C 1 1 10 7566 1 1 42 SER CA C -6.883 8.067 3.240 1.00 . A A . 44 SER CA 1 1 10 7567 1 1 42 SER CB C -5.369 8.188 3.413 1.00 . A A . 44 SER CB 1 1 10 7568 1 1 42 SER H H -6.651 6.292 2.036 1.00 . A A . 44 SER H 1 1 10 7569 1 1 42 SER HA H -7.363 8.208 4.197 1.00 . A A . 44 SER HA 1 1 10 7570 1 1 42 SER HB2 H -4.889 7.305 3.025 1.00 . A A . 44 SER HB2 1 1 10 7571 1 1 42 SER HB3 H -5.015 9.055 2.874 1.00 . A A . 44 SER HB3 1 1 10 7572 1 1 42 SER HG H -5.723 8.888 5.194 1.00 . A A . 44 SER HG 1 1 10 7573 1 1 42 SER N N -7.217 6.708 2.719 1.00 . A A . 44 SER N 1 1 10 7574 1 1 42 SER O O -6.875 10.249 2.245 1.00 . A A . 44 SER O 1 1 10 7575 1 1 42 SER OG O -5.064 8.315 4.797 1.00 . A A . 44 SER OG 1 1 10 7576 1 1 43 ASN C C -7.907 9.989 -0.670 1.00 . A A . 45 ASN C 1 1 10 7577 1 1 43 ASN CA C -8.881 9.839 0.498 1.00 . A A . 45 ASN CA 1 1 10 7578 1 1 43 ASN CB C -9.041 11.187 1.205 1.00 . A A . 45 ASN CB 1 1 10 7579 1 1 43 ASN CG C -10.319 11.874 0.716 1.00 . A A . 45 ASN CG 1 1 10 7580 1 1 43 ASN H H -8.746 7.934 1.495 1.00 . A A . 45 ASN H 1 1 10 7581 1 1 43 ASN HA H -9.840 9.512 0.126 1.00 . A A . 45 ASN HA 1 1 10 7582 1 1 43 ASN HB2 H -9.102 11.029 2.271 1.00 . A A . 45 ASN HB2 1 1 10 7583 1 1 43 ASN HB3 H -8.190 11.815 0.982 1.00 . A A . 45 ASN HB3 1 1 10 7584 1 1 43 ASN HD21 H -10.520 12.981 2.353 1.00 . A A . 45 ASN HD21 1 1 10 7585 1 1 43 ASN HD22 H -11.719 13.206 1.172 1.00 . A A . 45 ASN HD22 1 1 10 7586 1 1 43 ASN N N -8.354 8.830 1.462 1.00 . A A . 45 ASN N 1 1 10 7587 1 1 43 ASN ND2 N -10.901 12.760 1.477 1.00 . A A . 45 ASN ND2 1 1 10 7588 1 1 43 ASN O O -7.857 11.012 -1.325 1.00 . A A . 45 ASN O 1 1 10 7589 1 1 43 ASN OD1 O -10.791 11.602 -0.370 1.00 . A A . 45 ASN OD1 1 1 10 7590 1 1 44 GLY C C -5.041 10.031 -1.706 1.00 . A A . 46 GLY C 1 1 10 7591 1 1 44 GLY CA C -6.162 9.056 -2.064 1.00 . A A . 46 GLY CA 1 1 10 7592 1 1 44 GLY H H -7.194 8.164 -0.394 1.00 . A A . 46 GLY H 1 1 10 7593 1 1 44 GLY HA2 H -5.743 8.078 -2.250 1.00 . A A . 46 GLY HA2 1 1 10 7594 1 1 44 GLY HA3 H -6.668 9.406 -2.950 1.00 . A A . 46 GLY HA3 1 1 10 7595 1 1 44 GLY N N -7.134 8.977 -0.936 1.00 . A A . 46 GLY N 1 1 10 7596 1 1 44 GLY O O -4.357 10.546 -2.568 1.00 . A A . 46 GLY O 1 1 10 7597 1 1 45 THR C C -2.567 10.465 0.508 1.00 . A A . 47 THR C 1 1 10 7598 1 1 45 THR CA C -3.766 11.242 -0.047 1.00 . A A . 47 THR CA 1 1 10 7599 1 1 45 THR CB C -4.302 12.216 1.011 1.00 . A A . 47 THR CB 1 1 10 7600 1 1 45 THR CG2 C -4.333 11.544 2.388 1.00 . A A . 47 THR CG2 1 1 10 7601 1 1 45 THR H H -5.409 9.870 0.243 1.00 . A A . 47 THR H 1 1 10 7602 1 1 45 THR HA H -3.451 11.800 -0.916 1.00 . A A . 47 THR HA 1 1 10 7603 1 1 45 THR HB H -5.303 12.518 0.742 1.00 . A A . 47 THR HB 1 1 10 7604 1 1 45 THR HG1 H -3.605 13.866 0.257 1.00 . A A . 47 THR HG1 1 1 10 7605 1 1 45 THR HG21 H -4.035 10.512 2.295 1.00 . A A . 47 THR HG21 1 1 10 7606 1 1 45 THR HG22 H -5.335 11.594 2.789 1.00 . A A . 47 THR HG22 1 1 10 7607 1 1 45 THR HG23 H -3.654 12.057 3.053 1.00 . A A . 47 THR HG23 1 1 10 7608 1 1 45 THR N N -4.846 10.294 -0.443 1.00 . A A . 47 THR N 1 1 10 7609 1 1 45 THR O O -1.859 10.933 1.377 1.00 . A A . 47 THR O 1 1 10 7610 1 1 45 THR OG1 O -3.464 13.360 1.061 1.00 . A A . 47 THR OG1 1 1 10 7611 1 1 46 LEU C C -0.096 8.437 -0.586 1.00 . A A . 48 LEU C 1 1 10 7612 1 1 46 LEU CA C -1.176 8.480 0.498 1.00 . A A . 48 LEU CA 1 1 10 7613 1 1 46 LEU CB C -1.640 7.058 0.819 1.00 . A A . 48 LEU CB 1 1 10 7614 1 1 46 LEU CD1 C -0.324 6.653 2.907 1.00 . A A . 48 LEU CD1 1 1 10 7615 1 1 46 LEU CD2 C -0.786 4.770 1.332 1.00 . A A . 48 LEU CD2 1 1 10 7616 1 1 46 LEU CG C -0.486 6.267 1.435 1.00 . A A . 48 LEU CG 1 1 10 7617 1 1 46 LEU H H -2.911 8.924 -0.699 1.00 . A A . 48 LEU H 1 1 10 7618 1 1 46 LEU HA H -0.773 8.938 1.389 1.00 . A A . 48 LEU HA 1 1 10 7619 1 1 46 LEU HB2 H -2.464 7.099 1.517 1.00 . A A . 48 LEU HB2 1 1 10 7620 1 1 46 LEU HB3 H -1.963 6.572 -0.090 1.00 . A A . 48 LEU HB3 1 1 10 7621 1 1 46 LEU HD11 H -1.291 6.897 3.323 1.00 . A A . 48 LEU HD11 1 1 10 7622 1 1 46 LEU HD12 H 0.327 7.511 2.985 1.00 . A A . 48 LEU HD12 1 1 10 7623 1 1 46 LEU HD13 H 0.103 5.824 3.453 1.00 . A A . 48 LEU HD13 1 1 10 7624 1 1 46 LEU HD21 H -0.073 4.305 0.667 1.00 . A A . 48 LEU HD21 1 1 10 7625 1 1 46 LEU HD22 H -1.784 4.628 0.944 1.00 . A A . 48 LEU HD22 1 1 10 7626 1 1 46 LEU HD23 H -0.712 4.320 2.310 1.00 . A A . 48 LEU HD23 1 1 10 7627 1 1 46 LEU HG H 0.428 6.488 0.904 1.00 . A A . 48 LEU HG 1 1 10 7628 1 1 46 LEU N N -2.331 9.282 0.006 1.00 . A A . 48 LEU N 1 1 10 7629 1 1 46 LEU O O -0.375 8.596 -1.758 1.00 . A A . 48 LEU O 1 1 10 7630 1 1 47 THR C C 3.147 6.997 -0.959 1.00 . A A . 49 THR C 1 1 10 7631 1 1 47 THR CA C 2.225 8.193 -1.220 1.00 . A A . 49 THR CA 1 1 10 7632 1 1 47 THR CB C 3.028 9.490 -1.141 1.00 . A A . 49 THR CB 1 1 10 7633 1 1 47 THR CG2 C 2.274 10.602 -1.872 1.00 . A A . 49 THR CG2 1 1 10 7634 1 1 47 THR H H 1.344 8.113 0.742 1.00 . A A . 49 THR H 1 1 10 7635 1 1 47 THR HA H 1.798 8.103 -2.206 1.00 . A A . 49 THR HA 1 1 10 7636 1 1 47 THR HB H 3.986 9.349 -1.608 1.00 . A A . 49 THR HB 1 1 10 7637 1 1 47 THR HG1 H 3.442 10.786 0.249 1.00 . A A . 49 THR HG1 1 1 10 7638 1 1 47 THR HG21 H 1.331 10.220 -2.233 1.00 . A A . 49 THR HG21 1 1 10 7639 1 1 47 THR HG22 H 2.865 10.947 -2.707 1.00 . A A . 49 THR HG22 1 1 10 7640 1 1 47 THR HG23 H 2.095 11.423 -1.192 1.00 . A A . 49 THR HG23 1 1 10 7641 1 1 47 THR N N 1.136 8.233 -0.207 1.00 . A A . 49 THR N 1 1 10 7642 1 1 47 THR O O 2.833 6.108 -0.192 1.00 . A A . 49 THR O 1 1 10 7643 1 1 47 THR OG1 O 3.208 9.855 0.219 1.00 . A A . 49 THR OG1 1 1 10 7644 1 1 48 LEU C C 6.550 6.434 -0.843 1.00 . A A . 50 LEU C 1 1 10 7645 1 1 48 LEU CA C 5.250 5.859 -1.413 1.00 . A A . 50 LEU CA 1 1 10 7646 1 1 48 LEU CB C 5.524 5.203 -2.773 1.00 . A A . 50 LEU CB 1 1 10 7647 1 1 48 LEU CD1 C 5.906 2.979 -1.685 1.00 . A A . 50 LEU CD1 1 1 10 7648 1 1 48 LEU CD2 C 6.788 3.419 -3.980 1.00 . A A . 50 LEU CD2 1 1 10 7649 1 1 48 LEU CG C 6.507 4.040 -2.610 1.00 . A A . 50 LEU CG 1 1 10 7650 1 1 48 LEU H H 4.507 7.705 -2.206 1.00 . A A . 50 LEU H 1 1 10 7651 1 1 48 LEU HA H 4.841 5.129 -0.730 1.00 . A A . 50 LEU HA 1 1 10 7652 1 1 48 LEU HB2 H 4.596 4.832 -3.184 1.00 . A A . 50 LEU HB2 1 1 10 7653 1 1 48 LEU HB3 H 5.946 5.935 -3.445 1.00 . A A . 50 LEU HB3 1 1 10 7654 1 1 48 LEU HD11 H 6.490 2.073 -1.750 1.00 . A A . 50 LEU HD11 1 1 10 7655 1 1 48 LEU HD12 H 4.888 2.774 -1.985 1.00 . A A . 50 LEU HD12 1 1 10 7656 1 1 48 LEU HD13 H 5.915 3.342 -0.668 1.00 . A A . 50 LEU HD13 1 1 10 7657 1 1 48 LEU HD21 H 7.474 2.591 -3.867 1.00 . A A . 50 LEU HD21 1 1 10 7658 1 1 48 LEU HD22 H 7.227 4.162 -4.629 1.00 . A A . 50 LEU HD22 1 1 10 7659 1 1 48 LEU HD23 H 5.863 3.064 -4.412 1.00 . A A . 50 LEU HD23 1 1 10 7660 1 1 48 LEU HG H 7.430 4.406 -2.187 1.00 . A A . 50 LEU HG 1 1 10 7661 1 1 48 LEU N N 4.285 6.976 -1.598 1.00 . A A . 50 LEU N 1 1 10 7662 1 1 48 LEU O O 6.759 7.631 -0.843 1.00 . A A . 50 LEU O 1 1 10 7663 1 1 49 SER C C 9.879 5.284 -0.299 1.00 . A A . 51 SER C 1 1 10 7664 1 1 49 SER CA C 8.700 6.115 0.216 1.00 . A A . 51 SER CA 1 1 10 7665 1 1 49 SER CB C 8.650 6.027 1.741 1.00 . A A . 51 SER CB 1 1 10 7666 1 1 49 SER H H 7.236 4.641 -0.360 1.00 . A A . 51 SER H 1 1 10 7667 1 1 49 SER HA H 8.834 7.145 -0.077 1.00 . A A . 51 SER HA 1 1 10 7668 1 1 49 SER HB2 H 7.693 5.644 2.051 1.00 . A A . 51 SER HB2 1 1 10 7669 1 1 49 SER HB3 H 9.431 5.362 2.088 1.00 . A A . 51 SER HB3 1 1 10 7670 1 1 49 SER HG H 9.537 7.269 2.947 1.00 . A A . 51 SER HG 1 1 10 7671 1 1 49 SER N N 7.422 5.600 -0.354 1.00 . A A . 51 SER N 1 1 10 7672 1 1 49 SER O O 10.997 5.754 -0.361 1.00 . A A . 51 SER O 1 1 10 7673 1 1 49 SER OG O 8.837 7.323 2.292 1.00 . A A . 51 SER OG 1 1 10 7674 1 1 50 HIS C C 10.207 1.818 -1.518 1.00 . A A . 52 HIS C 1 1 10 7675 1 1 50 HIS CA C 10.761 3.203 -1.156 1.00 . A A . 52 HIS CA 1 1 10 7676 1 1 50 HIS CB C 11.830 3.100 -0.051 1.00 . A A . 52 HIS CB 1 1 10 7677 1 1 50 HIS CD2 C 13.706 1.357 -0.658 1.00 . A A . 52 HIS CD2 1 1 10 7678 1 1 50 HIS CE1 C 12.840 -0.378 0.312 1.00 . A A . 52 HIS CE1 1 1 10 7679 1 1 50 HIS CG C 12.522 1.763 -0.093 1.00 . A A . 52 HIS CG 1 1 10 7680 1 1 50 HIS H H 8.744 3.680 -0.598 1.00 . A A . 52 HIS H 1 1 10 7681 1 1 50 HIS HA H 11.194 3.658 -2.035 1.00 . A A . 52 HIS HA 1 1 10 7682 1 1 50 HIS HB2 H 12.561 3.881 -0.190 1.00 . A A . 52 HIS HB2 1 1 10 7683 1 1 50 HIS HB3 H 11.358 3.226 0.912 1.00 . A A . 52 HIS HB3 1 1 10 7684 1 1 50 HIS HD1 H 11.138 0.595 1.002 1.00 . A A . 52 HIS HD1 1 1 10 7685 1 1 50 HIS HD2 H 14.379 1.990 -1.216 1.00 . A A . 52 HIS HD2 1 1 10 7686 1 1 50 HIS HE1 H 12.683 -1.379 0.680 1.00 . A A . 52 HIS HE1 1 1 10 7687 1 1 50 HIS N N 9.646 4.051 -0.660 1.00 . A A . 52 HIS N 1 1 10 7688 1 1 50 HIS ND1 N 11.988 0.640 0.517 1.00 . A A . 52 HIS ND1 1 1 10 7689 1 1 50 HIS NE2 N 13.905 0.003 -0.400 1.00 . A A . 52 HIS NE2 1 1 10 7690 1 1 50 HIS O O 9.910 1.015 -0.659 1.00 . A A . 52 HIS O 1 1 10 7691 1 1 51 PHE C C 10.268 -0.898 -2.463 1.00 . A A . 53 PHE C 1 1 10 7692 1 1 51 PHE CA C 9.538 0.213 -3.219 1.00 . A A . 53 PHE CA 1 1 10 7693 1 1 51 PHE CB C 9.769 0.034 -4.722 1.00 . A A . 53 PHE CB 1 1 10 7694 1 1 51 PHE CD1 C 7.934 -1.470 -5.578 1.00 . A A . 53 PHE CD1 1 1 10 7695 1 1 51 PHE CD2 C 7.740 0.922 -5.929 1.00 . A A . 53 PHE CD2 1 1 10 7696 1 1 51 PHE CE1 C 6.713 -1.666 -6.234 1.00 . A A . 53 PHE CE1 1 1 10 7697 1 1 51 PHE CE2 C 6.519 0.725 -6.586 1.00 . A A . 53 PHE CE2 1 1 10 7698 1 1 51 PHE CG C 8.448 -0.176 -5.424 1.00 . A A . 53 PHE CG 1 1 10 7699 1 1 51 PHE CZ C 6.006 -0.567 -6.738 1.00 . A A . 53 PHE CZ 1 1 10 7700 1 1 51 PHE H H 10.310 2.212 -3.459 1.00 . A A . 53 PHE H 1 1 10 7701 1 1 51 PHE HA H 8.480 0.159 -3.008 1.00 . A A . 53 PHE HA 1 1 10 7702 1 1 51 PHE HB2 H 10.250 0.916 -5.117 1.00 . A A . 53 PHE HB2 1 1 10 7703 1 1 51 PHE HB3 H 10.403 -0.825 -4.887 1.00 . A A . 53 PHE HB3 1 1 10 7704 1 1 51 PHE HD1 H 8.480 -2.317 -5.189 1.00 . A A . 53 PHE HD1 1 1 10 7705 1 1 51 PHE HD2 H 8.136 1.920 -5.811 1.00 . A A . 53 PHE HD2 1 1 10 7706 1 1 51 PHE HE1 H 6.316 -2.663 -6.352 1.00 . A A . 53 PHE HE1 1 1 10 7707 1 1 51 PHE HE2 H 5.973 1.572 -6.974 1.00 . A A . 53 PHE HE2 1 1 10 7708 1 1 51 PHE HZ H 5.063 -0.718 -7.244 1.00 . A A . 53 PHE HZ 1 1 10 7709 1 1 51 PHE N N 10.067 1.542 -2.788 1.00 . A A . 53 PHE N 1 1 10 7710 1 1 51 PHE O O 11.285 -1.397 -2.900 1.00 . A A . 53 PHE O 1 1 10 7711 1 1 52 GLY C C 10.183 -2.088 0.950 1.00 . A A . 54 GLY C 1 1 10 7712 1 1 52 GLY CA C 10.411 -2.356 -0.537 1.00 . A A . 54 GLY CA 1 1 10 7713 1 1 52 GLY H H 8.936 -0.863 -0.998 1.00 . A A . 54 GLY H 1 1 10 7714 1 1 52 GLY HA2 H 9.988 -3.314 -0.804 1.00 . A A . 54 GLY HA2 1 1 10 7715 1 1 52 GLY HA3 H 11.471 -2.360 -0.741 1.00 . A A . 54 GLY HA3 1 1 10 7716 1 1 52 GLY N N 9.755 -1.284 -1.331 1.00 . A A . 54 GLY N 1 1 10 7717 1 1 52 GLY O O 9.492 -1.161 1.323 1.00 . A A . 54 GLY O 1 1 10 7718 1 1 53 LYS C C 11.471 -1.526 3.727 1.00 . A A . 55 LYS C 1 1 10 7719 1 1 53 LYS CA C 10.566 -2.668 3.262 1.00 . A A . 55 LYS CA 1 1 10 7720 1 1 53 LYS CB C 10.928 -3.945 4.020 1.00 . A A . 55 LYS CB 1 1 10 7721 1 1 53 LYS CD C 12.232 -3.910 6.147 1.00 . A A . 55 LYS CD 1 1 10 7722 1 1 53 LYS CE C 12.451 -5.410 6.354 1.00 . A A . 55 LYS CE 1 1 10 7723 1 1 53 LYS CG C 10.855 -3.679 5.524 1.00 . A A . 55 LYS CG 1 1 10 7724 1 1 53 LYS H H 11.310 -3.631 1.485 1.00 . A A . 55 LYS H 1 1 10 7725 1 1 53 LYS HA H 9.535 -2.414 3.457 1.00 . A A . 55 LYS HA 1 1 10 7726 1 1 53 LYS HB2 H 10.232 -4.729 3.758 1.00 . A A . 55 LYS HB2 1 1 10 7727 1 1 53 LYS HB3 H 11.930 -4.248 3.758 1.00 . A A . 55 LYS HB3 1 1 10 7728 1 1 53 LYS HD2 H 12.995 -3.521 5.489 1.00 . A A . 55 LYS HD2 1 1 10 7729 1 1 53 LYS HD3 H 12.286 -3.405 7.100 1.00 . A A . 55 LYS HD3 1 1 10 7730 1 1 53 LYS HE2 H 11.785 -5.767 7.126 1.00 . A A . 55 LYS HE2 1 1 10 7731 1 1 53 LYS HE3 H 12.245 -5.934 5.432 1.00 . A A . 55 LYS HE3 1 1 10 7732 1 1 53 LYS HG2 H 10.548 -2.657 5.695 1.00 . A A . 55 LYS HG2 1 1 10 7733 1 1 53 LYS HG3 H 10.141 -4.351 5.973 1.00 . A A . 55 LYS HG3 1 1 10 7734 1 1 53 LYS HZ1 H 14.502 -5.382 5.991 1.00 . A A . 55 LYS HZ1 1 1 10 7735 1 1 53 LYS HZ2 H 13.989 -6.669 6.974 1.00 . A A . 55 LYS HZ2 1 1 10 7736 1 1 53 LYS HZ3 H 14.083 -5.096 7.609 1.00 . A A . 55 LYS HZ3 1 1 10 7737 1 1 53 LYS N N 10.755 -2.888 1.803 1.00 . A A . 55 LYS N 1 1 10 7738 1 1 53 LYS NZ N 13.863 -5.658 6.763 1.00 . A A . 55 LYS NZ 1 1 10 7739 1 1 53 LYS O O 12.680 -1.594 3.616 1.00 . A A . 55 LYS O 1 1 10 7740 1 1 54 CYS C C 11.069 1.283 5.965 1.00 . A A . 56 CYS C 1 1 10 7741 1 1 54 CYS CA C 11.726 0.666 4.722 1.00 . A A . 56 CYS CA 1 1 10 7742 1 1 54 CYS CB C 11.877 1.690 3.569 1.00 . A A . 56 CYS CB 1 1 10 7743 1 1 54 CYS H H 9.921 -0.441 4.332 1.00 . A A . 56 CYS H 1 1 10 7744 1 1 54 CYS HA H 12.703 0.297 4.993 1.00 . A A . 56 CYS HA 1 1 10 7745 1 1 54 CYS HB2 H 12.926 1.839 3.370 1.00 . A A . 56 CYS HB2 1 1 10 7746 1 1 54 CYS HB3 H 11.407 1.288 2.684 1.00 . A A . 56 CYS HB3 1 1 10 7747 1 1 54 CYS N N 10.897 -0.477 4.249 1.00 . A A . 56 CYS N 1 1 10 7748 1 1 54 CYS O O 9.876 1.536 5.917 1.00 . A A . 56 CYS O 1 1 10 7749 1 1 54 CYS OXT O 11.772 1.491 6.940 1.00 . A A . 56 CYS OXT 1 1 10 7750 1 1 54 CYS SG S 11.124 3.298 3.963 1.00 . A A . 56 CYS SG 1 1 11 7751 1 1 1 ALA C C 3.634 8.040 -8.672 1.00 . A A . 3 ALA C 1 1 11 7752 1 1 1 ALA CA C 2.600 9.102 -8.295 1.00 . A A . 3 ALA CA 1 1 11 7753 1 1 1 ALA CB C 1.519 8.469 -7.417 1.00 . A A . 3 ALA CB 1 1 11 7754 1 1 1 ALA H1 H 2.088 10.686 -9.546 1.00 . A A . 3 ALA H1 1 1 11 7755 1 1 1 ALA H2 H 0.963 9.412 -9.545 1.00 . A A . 3 ALA H2 1 1 11 7756 1 1 1 ALA H3 H 2.440 9.243 -10.367 1.00 . A A . 3 ALA H3 1 1 11 7757 1 1 1 ALA HA H 3.085 9.899 -7.751 1.00 . A A . 3 ALA HA 1 1 11 7758 1 1 1 ALA HB1 H 1.848 8.465 -6.388 1.00 . A A . 3 ALA HB1 1 1 11 7759 1 1 1 ALA HB2 H 1.340 7.455 -7.742 1.00 . A A . 3 ALA HB2 1 1 11 7760 1 1 1 ALA HB3 H 0.607 9.041 -7.501 1.00 . A A . 3 ALA HB3 1 1 11 7761 1 1 1 ALA N N 1.976 9.652 -9.532 1.00 . A A . 3 ALA N 1 1 11 7762 1 1 1 ALA O O 3.636 6.947 -8.141 1.00 . A A . 3 ALA O 1 1 11 7763 1 1 2 VAL C C 4.867 6.136 -10.610 1.00 . A A . 4 VAL C 1 1 11 7764 1 1 2 VAL CA C 5.547 7.362 -9.996 1.00 . A A . 4 VAL CA 1 1 11 7765 1 1 2 VAL CB C 6.359 6.936 -8.772 1.00 . A A . 4 VAL CB 1 1 11 7766 1 1 2 VAL CG1 C 7.396 5.891 -9.188 1.00 . A A . 4 VAL CG1 1 1 11 7767 1 1 2 VAL CG2 C 7.071 8.156 -8.186 1.00 . A A . 4 VAL CG2 1 1 11 7768 1 1 2 VAL H H 4.494 9.241 -9.998 1.00 . A A . 4 VAL H 1 1 11 7769 1 1 2 VAL HA H 6.206 7.812 -10.724 1.00 . A A . 4 VAL HA 1 1 11 7770 1 1 2 VAL HB H 5.698 6.511 -8.031 1.00 . A A . 4 VAL HB 1 1 11 7771 1 1 2 VAL HG11 H 7.001 4.901 -9.009 1.00 . A A . 4 VAL HG11 1 1 11 7772 1 1 2 VAL HG12 H 8.298 6.028 -8.609 1.00 . A A . 4 VAL HG12 1 1 11 7773 1 1 2 VAL HG13 H 7.621 6.005 -10.238 1.00 . A A . 4 VAL HG13 1 1 11 7774 1 1 2 VAL HG21 H 8.131 8.081 -8.380 1.00 . A A . 4 VAL HG21 1 1 11 7775 1 1 2 VAL HG22 H 6.902 8.195 -7.120 1.00 . A A . 4 VAL HG22 1 1 11 7776 1 1 2 VAL HG23 H 6.684 9.054 -8.645 1.00 . A A . 4 VAL HG23 1 1 11 7777 1 1 2 VAL N N 4.513 8.353 -9.585 1.00 . A A . 4 VAL N 1 1 11 7778 1 1 2 VAL O O 5.290 5.015 -10.405 1.00 . A A . 4 VAL O 1 1 11 7779 1 1 3 SER C C 2.594 4.246 -10.896 1.00 . A A . 5 SER C 1 1 11 7780 1 1 3 SER CA C 3.114 5.183 -11.988 1.00 . A A . 5 SER CA 1 1 11 7781 1 1 3 SER CB C 4.086 4.422 -12.888 1.00 . A A . 5 SER CB 1 1 11 7782 1 1 3 SER H H 3.496 7.251 -11.514 1.00 . A A . 5 SER H 1 1 11 7783 1 1 3 SER HA H 2.285 5.544 -12.579 1.00 . A A . 5 SER HA 1 1 11 7784 1 1 3 SER HB2 H 5.095 4.734 -12.675 1.00 . A A . 5 SER HB2 1 1 11 7785 1 1 3 SER HB3 H 3.993 3.360 -12.701 1.00 . A A . 5 SER HB3 1 1 11 7786 1 1 3 SER HG H 3.666 3.871 -14.706 1.00 . A A . 5 SER HG 1 1 11 7787 1 1 3 SER N N 3.819 6.338 -11.361 1.00 . A A . 5 SER N 1 1 11 7788 1 1 3 SER O O 3.346 3.750 -10.082 1.00 . A A . 5 SER O 1 1 11 7789 1 1 3 SER OG O 3.785 4.706 -14.247 1.00 . A A . 5 SER OG 1 1 11 7790 1 1 4 VAL C C -0.495 2.385 -10.365 1.00 . A A . 6 VAL C 1 1 11 7791 1 1 4 VAL CA C 0.753 3.092 -9.825 1.00 . A A . 6 VAL CA 1 1 11 7792 1 1 4 VAL CB C 0.379 3.913 -8.589 1.00 . A A . 6 VAL CB 1 1 11 7793 1 1 4 VAL CG1 C -0.530 5.073 -8.999 1.00 . A A . 6 VAL CG1 1 1 11 7794 1 1 4 VAL CG2 C -0.359 3.019 -7.588 1.00 . A A . 6 VAL CG2 1 1 11 7795 1 1 4 VAL H H 0.718 4.407 -11.535 1.00 . A A . 6 VAL H 1 1 11 7796 1 1 4 VAL HA H 1.494 2.355 -9.556 1.00 . A A . 6 VAL HA 1 1 11 7797 1 1 4 VAL HB H 1.277 4.305 -8.131 1.00 . A A . 6 VAL HB 1 1 11 7798 1 1 4 VAL HG11 H -0.247 5.963 -8.457 1.00 . A A . 6 VAL HG11 1 1 11 7799 1 1 4 VAL HG12 H -1.556 4.823 -8.773 1.00 . A A . 6 VAL HG12 1 1 11 7800 1 1 4 VAL HG13 H -0.429 5.250 -10.059 1.00 . A A . 6 VAL HG13 1 1 11 7801 1 1 4 VAL HG21 H -1.381 3.353 -7.493 1.00 . A A . 6 VAL HG21 1 1 11 7802 1 1 4 VAL HG22 H 0.129 3.076 -6.625 1.00 . A A . 6 VAL HG22 1 1 11 7803 1 1 4 VAL HG23 H -0.345 1.998 -7.938 1.00 . A A . 6 VAL HG23 1 1 11 7804 1 1 4 VAL N N 1.312 3.999 -10.869 1.00 . A A . 6 VAL N 1 1 11 7805 1 1 4 VAL O O -1.565 2.959 -10.425 1.00 . A A . 6 VAL O 1 1 11 7806 1 1 5 ASP C C -2.533 0.154 -10.118 1.00 . A A . 7 ASP C 1 1 11 7807 1 1 5 ASP CA C -1.558 0.404 -11.268 1.00 . A A . 7 ASP CA 1 1 11 7808 1 1 5 ASP CB C -1.113 -0.936 -11.856 1.00 . A A . 7 ASP CB 1 1 11 7809 1 1 5 ASP CG C -2.131 -1.401 -12.899 1.00 . A A . 7 ASP CG 1 1 11 7810 1 1 5 ASP H H 0.496 0.693 -10.684 1.00 . A A . 7 ASP H 1 1 11 7811 1 1 5 ASP HA H -2.044 0.992 -12.033 1.00 . A A . 7 ASP HA 1 1 11 7812 1 1 5 ASP HB2 H -0.145 -0.821 -12.321 1.00 . A A . 7 ASP HB2 1 1 11 7813 1 1 5 ASP HB3 H -1.049 -1.671 -11.067 1.00 . A A . 7 ASP HB3 1 1 11 7814 1 1 5 ASP N N -0.372 1.142 -10.747 1.00 . A A . 7 ASP N 1 1 11 7815 1 1 5 ASP O O -2.396 -0.795 -9.372 1.00 . A A . 7 ASP O 1 1 11 7816 1 1 5 ASP OD1 O -2.452 -0.617 -13.776 1.00 . A A . 7 ASP OD1 1 1 11 7817 1 1 5 ASP OD2 O -2.570 -2.536 -12.805 1.00 . A A . 7 ASP OD2 1 1 11 7818 1 1 6 CYS C C -5.817 1.478 -9.230 1.00 . A A . 8 CYS C 1 1 11 7819 1 1 6 CYS CA C -4.490 0.816 -8.852 1.00 . A A . 8 CYS CA 1 1 11 7820 1 1 6 CYS CB C -3.936 1.466 -7.583 1.00 . A A . 8 CYS CB 1 1 11 7821 1 1 6 CYS H H -3.601 1.764 -10.571 1.00 . A A . 8 CYS H 1 1 11 7822 1 1 6 CYS HA H -4.648 -0.239 -8.680 1.00 . A A . 8 CYS HA 1 1 11 7823 1 1 6 CYS HB2 H -2.922 1.795 -7.758 1.00 . A A . 8 CYS HB2 1 1 11 7824 1 1 6 CYS HB3 H -4.547 2.315 -7.314 1.00 . A A . 8 CYS HB3 1 1 11 7825 1 1 6 CYS N N -3.512 1.001 -9.961 1.00 . A A . 8 CYS N 1 1 11 7826 1 1 6 CYS O O -6.595 1.861 -8.378 1.00 . A A . 8 CYS O 1 1 11 7827 1 1 6 CYS SG S -3.951 0.265 -6.233 1.00 . A A . 8 CYS SG 1 1 11 7828 1 1 7 SER C C -8.522 1.811 -10.157 1.00 . A A . 9 SER C 1 1 11 7829 1 1 7 SER CA C -7.323 2.253 -10.996 1.00 . A A . 9 SER CA 1 1 11 7830 1 1 7 SER CB C -7.554 1.851 -12.454 1.00 . A A . 9 SER CB 1 1 11 7831 1 1 7 SER H H -5.409 1.297 -11.155 1.00 . A A . 9 SER H 1 1 11 7832 1 1 7 SER HA H -7.222 3.326 -10.937 1.00 . A A . 9 SER HA 1 1 11 7833 1 1 7 SER HB2 H -7.164 2.612 -13.107 1.00 . A A . 9 SER HB2 1 1 11 7834 1 1 7 SER HB3 H -7.048 0.915 -12.652 1.00 . A A . 9 SER HB3 1 1 11 7835 1 1 7 SER HG H -9.109 0.812 -12.996 1.00 . A A . 9 SER HG 1 1 11 7836 1 1 7 SER N N -6.064 1.614 -10.507 1.00 . A A . 9 SER N 1 1 11 7837 1 1 7 SER O O -9.224 0.881 -10.498 1.00 . A A . 9 SER O 1 1 11 7838 1 1 7 SER OG O -8.950 1.706 -12.685 1.00 . A A . 9 SER OG 1 1 11 7839 1 1 8 GLU C C -9.762 0.682 -7.701 1.00 . A A . 10 GLU C 1 1 11 7840 1 1 8 GLU CA C -9.927 2.113 -8.209 1.00 . A A . 10 GLU CA 1 1 11 7841 1 1 8 GLU CB C -11.217 2.213 -9.026 1.00 . A A . 10 GLU CB 1 1 11 7842 1 1 8 GLU CD C -10.998 2.907 -11.416 1.00 . A A . 10 GLU CD 1 1 11 7843 1 1 8 GLU CG C -11.131 3.409 -9.977 1.00 . A A . 10 GLU CG 1 1 11 7844 1 1 8 GLU H H -8.187 3.226 -8.816 1.00 . A A . 10 GLU H 1 1 11 7845 1 1 8 GLU HA H -9.981 2.790 -7.369 1.00 . A A . 10 GLU HA 1 1 11 7846 1 1 8 GLU HB2 H -11.351 1.306 -9.598 1.00 . A A . 10 GLU HB2 1 1 11 7847 1 1 8 GLU HB3 H -12.056 2.346 -8.360 1.00 . A A . 10 GLU HB3 1 1 11 7848 1 1 8 GLU HG2 H -12.027 4.007 -9.885 1.00 . A A . 10 GLU HG2 1 1 11 7849 1 1 8 GLU HG3 H -10.269 4.008 -9.725 1.00 . A A . 10 GLU HG3 1 1 11 7850 1 1 8 GLU N N -8.767 2.479 -9.067 1.00 . A A . 10 GLU N 1 1 11 7851 1 1 8 GLU O O -10.479 -0.213 -8.099 1.00 . A A . 10 GLU O 1 1 11 7852 1 1 8 GLU OE1 O -11.390 1.780 -11.671 1.00 . A A . 10 GLU OE1 1 1 11 7853 1 1 8 GLU OE2 O -10.506 3.660 -12.242 1.00 . A A . 10 GLU OE2 1 1 11 7854 1 1 9 TYR C C -8.680 -0.947 -4.762 1.00 . A A . 11 TYR C 1 1 11 7855 1 1 9 TYR CA C -8.621 -0.929 -6.299 1.00 . A A . 11 TYR CA 1 1 11 7856 1 1 9 TYR CB C -7.254 -1.445 -6.757 1.00 . A A . 11 TYR CB 1 1 11 7857 1 1 9 TYR CD1 C -7.874 -2.580 -8.919 1.00 . A A . 11 TYR CD1 1 1 11 7858 1 1 9 TYR CD2 C -7.179 -3.948 -7.042 1.00 . A A . 11 TYR CD2 1 1 11 7859 1 1 9 TYR CE1 C -8.050 -3.733 -9.694 1.00 . A A . 11 TYR CE1 1 1 11 7860 1 1 9 TYR CE2 C -7.355 -5.101 -7.817 1.00 . A A . 11 TYR CE2 1 1 11 7861 1 1 9 TYR CG C -7.440 -2.688 -7.592 1.00 . A A . 11 TYR CG 1 1 11 7862 1 1 9 TYR CZ C -7.788 -4.992 -9.144 1.00 . A A . 11 TYR CZ 1 1 11 7863 1 1 9 TYR H H -8.246 1.190 -6.521 1.00 . A A . 11 TYR H 1 1 11 7864 1 1 9 TYR HA H -9.391 -1.575 -6.692 1.00 . A A . 11 TYR HA 1 1 11 7865 1 1 9 TYR HB2 H -6.761 -0.684 -7.346 1.00 . A A . 11 TYR HB2 1 1 11 7866 1 1 9 TYR HB3 H -6.648 -1.679 -5.893 1.00 . A A . 11 TYR HB3 1 1 11 7867 1 1 9 TYR HD1 H -8.077 -1.608 -9.344 1.00 . A A . 11 TYR HD1 1 1 11 7868 1 1 9 TYR HD2 H -6.844 -4.032 -6.019 1.00 . A A . 11 TYR HD2 1 1 11 7869 1 1 9 TYR HE1 H -8.384 -3.650 -10.717 1.00 . A A . 11 TYR HE1 1 1 11 7870 1 1 9 TYR HE2 H -7.153 -6.072 -7.393 1.00 . A A . 11 TYR HE2 1 1 11 7871 1 1 9 TYR HH H -7.679 -5.926 -10.804 1.00 . A A . 11 TYR HH 1 1 11 7872 1 1 9 TYR N N -8.822 0.455 -6.824 1.00 . A A . 11 TYR N 1 1 11 7873 1 1 9 TYR O O -7.710 -1.285 -4.117 1.00 . A A . 11 TYR O 1 1 11 7874 1 1 9 TYR OH O -7.961 -6.127 -9.907 1.00 . A A . 11 TYR OH 1 1 11 7875 1 1 10 PRO C C -10.311 -2.001 -2.240 1.00 . A A . 12 PRO C 1 1 11 7876 1 1 10 PRO CA C -10.044 -0.584 -2.757 1.00 . A A . 12 PRO CA 1 1 11 7877 1 1 10 PRO CB C -11.295 0.278 -2.593 1.00 . A A . 12 PRO CB 1 1 11 7878 1 1 10 PRO CD C -11.002 -0.187 -5.009 1.00 . A A . 12 PRO CD 1 1 11 7879 1 1 10 PRO CG C -12.042 0.223 -3.948 1.00 . A A . 12 PRO CG 1 1 11 7880 1 1 10 PRO HA H -9.210 -0.134 -2.243 1.00 . A A . 12 PRO HA 1 1 11 7881 1 1 10 PRO HB2 H -11.919 -0.123 -1.804 1.00 . A A . 12 PRO HB2 1 1 11 7882 1 1 10 PRO HB3 H -11.020 1.295 -2.369 1.00 . A A . 12 PRO HB3 1 1 11 7883 1 1 10 PRO HD2 H -11.373 -1.010 -5.604 1.00 . A A . 12 PRO HD2 1 1 11 7884 1 1 10 PRO HD3 H -10.755 0.654 -5.633 1.00 . A A . 12 PRO HD3 1 1 11 7885 1 1 10 PRO HG2 H -12.837 -0.508 -3.903 1.00 . A A . 12 PRO HG2 1 1 11 7886 1 1 10 PRO HG3 H -12.444 1.194 -4.190 1.00 . A A . 12 PRO HG3 1 1 11 7887 1 1 10 PRO N N -9.824 -0.600 -4.220 1.00 . A A . 12 PRO N 1 1 11 7888 1 1 10 PRO O O -11.421 -2.492 -2.307 1.00 . A A . 12 PRO O 1 1 11 7889 1 1 11 LYS C C -8.283 -4.531 -0.492 1.00 . A A . 13 LYS C 1 1 11 7890 1 1 11 LYS CA C -9.535 -4.047 -1.220 1.00 . A A . 13 LYS CA 1 1 11 7891 1 1 11 LYS CB C -9.838 -4.985 -2.393 1.00 . A A . 13 LYS CB 1 1 11 7892 1 1 11 LYS CD C -9.358 -5.455 -4.803 1.00 . A A . 13 LYS CD 1 1 11 7893 1 1 11 LYS CE C -10.097 -4.827 -5.987 1.00 . A A . 13 LYS CE 1 1 11 7894 1 1 11 LYS CG C -9.222 -4.426 -3.678 1.00 . A A . 13 LYS CG 1 1 11 7895 1 1 11 LYS H H -8.424 -2.263 -1.676 1.00 . A A . 13 LYS H 1 1 11 7896 1 1 11 LYS HA H -10.371 -4.047 -0.536 1.00 . A A . 13 LYS HA 1 1 11 7897 1 1 11 LYS HB2 H -9.419 -5.959 -2.188 1.00 . A A . 13 LYS HB2 1 1 11 7898 1 1 11 LYS HB3 H -10.907 -5.073 -2.517 1.00 . A A . 13 LYS HB3 1 1 11 7899 1 1 11 LYS HD2 H -8.375 -5.772 -5.119 1.00 . A A . 13 LYS HD2 1 1 11 7900 1 1 11 LYS HD3 H -9.915 -6.308 -4.445 1.00 . A A . 13 LYS HD3 1 1 11 7901 1 1 11 LYS HE2 H -10.035 -3.751 -5.921 1.00 . A A . 13 LYS HE2 1 1 11 7902 1 1 11 LYS HE3 H -9.643 -5.159 -6.909 1.00 . A A . 13 LYS HE3 1 1 11 7903 1 1 11 LYS HG2 H -9.735 -3.516 -3.957 1.00 . A A . 13 LYS HG2 1 1 11 7904 1 1 11 LYS HG3 H -8.177 -4.212 -3.512 1.00 . A A . 13 LYS HG3 1 1 11 7905 1 1 11 LYS HZ1 H -11.636 -6.146 -6.463 1.00 . A A . 13 LYS HZ1 1 1 11 7906 1 1 11 LYS HZ2 H -12.110 -4.516 -6.419 1.00 . A A . 13 LYS HZ2 1 1 11 7907 1 1 11 LYS HZ3 H -11.835 -5.364 -4.971 1.00 . A A . 13 LYS HZ3 1 1 11 7908 1 1 11 LYS N N -9.313 -2.666 -1.728 1.00 . A A . 13 LYS N 1 1 11 7909 1 1 11 LYS NZ N -11.527 -5.245 -5.958 1.00 . A A . 13 LYS NZ 1 1 11 7910 1 1 11 LYS O O -7.317 -4.936 -1.106 1.00 . A A . 13 LYS O 1 1 11 7911 1 1 12 CYS C C -7.300 -6.459 1.948 1.00 . A A . 14 CYS C 1 1 11 7912 1 1 12 CYS CA C -7.091 -4.996 1.558 1.00 . A A . 14 CYS CA 1 1 11 7913 1 1 12 CYS CB C -6.821 -4.168 2.831 1.00 . A A . 14 CYS CB 1 1 11 7914 1 1 12 CYS H H -9.085 -4.195 1.282 1.00 . A A . 14 CYS H 1 1 11 7915 1 1 12 CYS HA H -6.230 -4.931 0.909 1.00 . A A . 14 CYS HA 1 1 11 7916 1 1 12 CYS HB2 H -6.568 -4.839 3.640 1.00 . A A . 14 CYS HB2 1 1 11 7917 1 1 12 CYS HB3 H -5.985 -3.508 2.650 1.00 . A A . 14 CYS HB3 1 1 11 7918 1 1 12 CYS N N -8.293 -4.511 0.810 1.00 . A A . 14 CYS N 1 1 11 7919 1 1 12 CYS O O -6.834 -6.913 2.974 1.00 . A A . 14 CYS O 1 1 11 7920 1 1 12 CYS SG S -8.266 -3.189 3.310 1.00 . A A . 14 CYS SG 1 1 11 7921 1 1 13 ALA C C -7.191 -9.492 0.710 1.00 . A A . 15 ALA C 1 1 11 7922 1 1 13 ALA CA C -8.225 -8.639 1.448 1.00 . A A . 15 ALA CA 1 1 11 7923 1 1 13 ALA CB C -9.631 -9.039 1.002 1.00 . A A . 15 ALA CB 1 1 11 7924 1 1 13 ALA H H -8.355 -6.818 0.304 1.00 . A A . 15 ALA H 1 1 11 7925 1 1 13 ALA HA H -8.128 -8.794 2.512 1.00 . A A . 15 ALA HA 1 1 11 7926 1 1 13 ALA HB1 H -9.653 -9.140 -0.074 1.00 . A A . 15 ALA HB1 1 1 11 7927 1 1 13 ALA HB2 H -10.336 -8.279 1.306 1.00 . A A . 15 ALA HB2 1 1 11 7928 1 1 13 ALA HB3 H -9.900 -9.980 1.457 1.00 . A A . 15 ALA HB3 1 1 11 7929 1 1 13 ALA N N -7.992 -7.203 1.130 1.00 . A A . 15 ALA N 1 1 11 7930 1 1 13 ALA O O -7.342 -10.690 0.578 1.00 . A A . 15 ALA O 1 1 11 7931 1 1 14 CYS C C -4.087 -10.223 0.501 1.00 . A A . 16 CYS C 1 1 11 7932 1 1 14 CYS CA C -5.099 -9.663 -0.498 1.00 . A A . 16 CYS CA 1 1 11 7933 1 1 14 CYS CB C -4.371 -8.756 -1.491 1.00 . A A . 16 CYS CB 1 1 11 7934 1 1 14 CYS H H -6.037 -7.917 0.346 1.00 . A A . 16 CYS H 1 1 11 7935 1 1 14 CYS HA H -5.566 -10.475 -1.032 1.00 . A A . 16 CYS HA 1 1 11 7936 1 1 14 CYS HB2 H -3.911 -7.935 -0.960 1.00 . A A . 16 CYS HB2 1 1 11 7937 1 1 14 CYS HB3 H -3.610 -9.325 -2.003 1.00 . A A . 16 CYS HB3 1 1 11 7938 1 1 14 CYS N N -6.140 -8.884 0.229 1.00 . A A . 16 CYS N 1 1 11 7939 1 1 14 CYS O O -3.831 -9.640 1.535 1.00 . A A . 16 CYS O 1 1 11 7940 1 1 14 CYS SG S -5.554 -8.107 -2.697 1.00 . A A . 16 CYS SG 1 1 11 7941 1 1 15 THR C C -1.657 -12.967 0.368 1.00 . A A . 17 THR C 1 1 11 7942 1 1 15 THR CA C -2.510 -11.948 1.128 1.00 . A A . 17 THR CA 1 1 11 7943 1 1 15 THR CB C -3.239 -12.637 2.287 1.00 . A A . 17 THR CB 1 1 11 7944 1 1 15 THR CG2 C -3.960 -13.886 1.774 1.00 . A A . 17 THR CG2 1 1 11 7945 1 1 15 THR H H -3.728 -11.803 -0.643 1.00 . A A . 17 THR H 1 1 11 7946 1 1 15 THR HA H -1.873 -11.168 1.519 1.00 . A A . 17 THR HA 1 1 11 7947 1 1 15 THR HB H -3.964 -11.958 2.709 1.00 . A A . 17 THR HB 1 1 11 7948 1 1 15 THR HG1 H -2.011 -12.203 3.730 1.00 . A A . 17 THR HG1 1 1 11 7949 1 1 15 THR HG21 H -4.348 -13.696 0.785 1.00 . A A . 17 THR HG21 1 1 11 7950 1 1 15 THR HG22 H -4.774 -14.131 2.439 1.00 . A A . 17 THR HG22 1 1 11 7951 1 1 15 THR HG23 H -3.265 -14.713 1.736 1.00 . A A . 17 THR HG23 1 1 11 7952 1 1 15 THR N N -3.509 -11.351 0.199 1.00 . A A . 17 THR N 1 1 11 7953 1 1 15 THR O O -1.124 -13.897 0.940 1.00 . A A . 17 THR O 1 1 11 7954 1 1 15 THR OG1 O -2.298 -13.003 3.285 1.00 . A A . 17 THR OG1 1 1 11 7955 1 1 16 MET C C 0.663 -13.153 -2.020 1.00 . A A . 18 MET C 1 1 11 7956 1 1 16 MET CA C -0.713 -13.758 -1.725 1.00 . A A . 18 MET CA 1 1 11 7957 1 1 16 MET CB C -1.431 -14.062 -3.043 1.00 . A A . 18 MET CB 1 1 11 7958 1 1 16 MET CE C -4.080 -16.527 -2.918 1.00 . A A . 18 MET CE 1 1 11 7959 1 1 16 MET CG C -1.550 -15.578 -3.222 1.00 . A A . 18 MET CG 1 1 11 7960 1 1 16 MET H H -1.968 -12.043 -1.364 1.00 . A A . 18 MET H 1 1 11 7961 1 1 16 MET HA H -0.587 -14.672 -1.169 1.00 . A A . 18 MET HA 1 1 11 7962 1 1 16 MET HB2 H -2.419 -13.623 -3.024 1.00 . A A . 18 MET HB2 1 1 11 7963 1 1 16 MET HB3 H -0.868 -13.649 -3.866 1.00 . A A . 18 MET HB3 1 1 11 7964 1 1 16 MET HE1 H -4.153 -17.605 -2.951 1.00 . A A . 18 MET HE1 1 1 11 7965 1 1 16 MET HE2 H -5.062 -16.099 -3.045 1.00 . A A . 18 MET HE2 1 1 11 7966 1 1 16 MET HE3 H -3.676 -16.217 -1.964 1.00 . A A . 18 MET HE3 1 1 11 7967 1 1 16 MET HG2 H -0.658 -15.955 -3.702 1.00 . A A . 18 MET HG2 1 1 11 7968 1 1 16 MET HG3 H -1.663 -16.047 -2.255 1.00 . A A . 18 MET HG3 1 1 11 7969 1 1 16 MET N N -1.527 -12.799 -0.922 1.00 . A A . 18 MET N 1 1 11 7970 1 1 16 MET O O 1.652 -13.516 -1.417 1.00 . A A . 18 MET O 1 1 11 7971 1 1 16 MET SD S -2.993 -15.956 -4.248 1.00 . A A . 18 MET SD 1 1 11 7972 1 1 17 GLU C C 2.762 -11.173 -2.007 1.00 . A A . 19 GLU C 1 1 11 7973 1 1 17 GLU CA C 2.048 -11.615 -3.288 1.00 . A A . 19 GLU CA 1 1 11 7974 1 1 17 GLU CB C 1.821 -10.400 -4.190 1.00 . A A . 19 GLU CB 1 1 11 7975 1 1 17 GLU CD C 1.578 -10.031 -6.652 1.00 . A A . 19 GLU CD 1 1 11 7976 1 1 17 GLU CG C 2.452 -10.655 -5.561 1.00 . A A . 19 GLU CG 1 1 11 7977 1 1 17 GLU H H -0.078 -11.966 -3.425 1.00 . A A . 19 GLU H 1 1 11 7978 1 1 17 GLU HA H 2.661 -12.336 -3.808 1.00 . A A . 19 GLU HA 1 1 11 7979 1 1 17 GLU HB2 H 0.760 -10.230 -4.305 1.00 . A A . 19 GLU HB2 1 1 11 7980 1 1 17 GLU HB3 H 2.278 -9.530 -3.743 1.00 . A A . 19 GLU HB3 1 1 11 7981 1 1 17 GLU HG2 H 3.437 -10.213 -5.592 1.00 . A A . 19 GLU HG2 1 1 11 7982 1 1 17 GLU HG3 H 2.528 -11.718 -5.730 1.00 . A A . 19 GLU HG3 1 1 11 7983 1 1 17 GLU N N 0.733 -12.239 -2.947 1.00 . A A . 19 GLU N 1 1 11 7984 1 1 17 GLU O O 2.209 -11.217 -0.926 1.00 . A A . 19 GLU O 1 1 11 7985 1 1 17 GLU OE1 O 0.991 -8.995 -6.392 1.00 . A A . 19 GLU OE1 1 1 11 7986 1 1 17 GLU OE2 O 1.514 -10.600 -7.730 1.00 . A A . 19 GLU OE2 1 1 11 7987 1 1 18 TYR C C 5.645 -9.129 -1.297 1.00 . A A . 20 TYR C 1 1 11 7988 1 1 18 TYR CA C 4.756 -10.303 -0.923 1.00 . A A . 20 TYR CA 1 1 11 7989 1 1 18 TYR CB C 5.630 -11.441 -0.432 1.00 . A A . 20 TYR CB 1 1 11 7990 1 1 18 TYR CD1 C 5.891 -10.045 1.654 1.00 . A A . 20 TYR CD1 1 1 11 7991 1 1 18 TYR CD2 C 7.703 -11.516 0.999 1.00 . A A . 20 TYR CD2 1 1 11 7992 1 1 18 TYR CE1 C 6.631 -9.628 2.768 1.00 . A A . 20 TYR CE1 1 1 11 7993 1 1 18 TYR CE2 C 8.444 -11.099 2.112 1.00 . A A . 20 TYR CE2 1 1 11 7994 1 1 18 TYR CG C 6.427 -10.989 0.769 1.00 . A A . 20 TYR CG 1 1 11 7995 1 1 18 TYR CZ C 7.907 -10.157 2.997 1.00 . A A . 20 TYR CZ 1 1 11 7996 1 1 18 TYR H H 4.417 -10.724 -3.010 1.00 . A A . 20 TYR H 1 1 11 7997 1 1 18 TYR HA H 4.071 -10.001 -0.150 1.00 . A A . 20 TYR HA 1 1 11 7998 1 1 18 TYR HB2 H 5.014 -12.285 -0.163 1.00 . A A . 20 TYR HB2 1 1 11 7999 1 1 18 TYR HB3 H 6.304 -11.719 -1.224 1.00 . A A . 20 TYR HB3 1 1 11 8000 1 1 18 TYR HD1 H 4.907 -9.638 1.479 1.00 . A A . 20 TYR HD1 1 1 11 8001 1 1 18 TYR HD2 H 8.117 -12.242 0.316 1.00 . A A . 20 TYR HD2 1 1 11 8002 1 1 18 TYR HE1 H 6.217 -8.901 3.452 1.00 . A A . 20 TYR HE1 1 1 11 8003 1 1 18 TYR HE2 H 9.428 -11.507 2.288 1.00 . A A . 20 TYR HE2 1 1 11 8004 1 1 18 TYR HH H 9.267 -10.439 4.306 1.00 . A A . 20 TYR HH 1 1 11 8005 1 1 18 TYR N N 3.993 -10.748 -2.125 1.00 . A A . 20 TYR N 1 1 11 8006 1 1 18 TYR O O 6.831 -9.114 -1.034 1.00 . A A . 20 TYR O 1 1 11 8007 1 1 18 TYR OH O 8.636 -9.748 4.095 1.00 . A A . 20 TYR OH 1 1 11 8008 1 1 19 ARG C C 5.912 -5.949 -1.172 1.00 . A A . 21 ARG C 1 1 11 8009 1 1 19 ARG CA C 5.850 -6.954 -2.331 1.00 . A A . 21 ARG CA 1 1 11 8010 1 1 19 ARG CB C 5.155 -6.304 -3.529 1.00 . A A . 21 ARG CB 1 1 11 8011 1 1 19 ARG CD C 6.493 -7.664 -5.137 1.00 . A A . 21 ARG CD 1 1 11 8012 1 1 19 ARG CG C 5.079 -7.309 -4.680 1.00 . A A . 21 ARG CG 1 1 11 8013 1 1 19 ARG CZ C 7.825 -9.676 -5.320 1.00 . A A . 21 ARG CZ 1 1 11 8014 1 1 19 ARG H H 4.119 -8.218 -2.104 1.00 . A A . 21 ARG H 1 1 11 8015 1 1 19 ARG HA H 6.846 -7.253 -2.614 1.00 . A A . 21 ARG HA 1 1 11 8016 1 1 19 ARG HB2 H 4.156 -6.003 -3.248 1.00 . A A . 21 ARG HB2 1 1 11 8017 1 1 19 ARG HB3 H 5.717 -5.439 -3.848 1.00 . A A . 21 ARG HB3 1 1 11 8018 1 1 19 ARG HD2 H 6.574 -7.519 -6.204 1.00 . A A . 21 ARG HD2 1 1 11 8019 1 1 19 ARG HD3 H 7.203 -7.026 -4.633 1.00 . A A . 21 ARG HD3 1 1 11 8020 1 1 19 ARG HE H 6.188 -9.580 -4.201 1.00 . A A . 21 ARG HE 1 1 11 8021 1 1 19 ARG HG2 H 4.573 -8.203 -4.344 1.00 . A A . 21 ARG HG2 1 1 11 8022 1 1 19 ARG HG3 H 4.534 -6.875 -5.504 1.00 . A A . 21 ARG HG3 1 1 11 8023 1 1 19 ARG HH11 H 6.992 -9.909 -7.124 1.00 . A A . 21 ARG HH11 1 1 11 8024 1 1 19 ARG HH12 H 8.606 -10.516 -6.959 1.00 . A A . 21 ARG HH12 1 1 11 8025 1 1 19 ARG HH21 H 8.902 -9.583 -3.635 1.00 . A A . 21 ARG HH21 1 1 11 8026 1 1 19 ARG HH22 H 9.688 -10.329 -4.986 1.00 . A A . 21 ARG HH22 1 1 11 8027 1 1 19 ARG N N 5.072 -8.154 -1.912 1.00 . A A . 21 ARG N 1 1 11 8028 1 1 19 ARG NE N 6.782 -9.087 -4.804 1.00 . A A . 21 ARG NE 1 1 11 8029 1 1 19 ARG NH1 N 7.806 -10.063 -6.565 1.00 . A A . 21 ARG NH1 1 1 11 8030 1 1 19 ARG NH2 N 8.888 -9.878 -4.589 1.00 . A A . 21 ARG NH2 1 1 11 8031 1 1 19 ARG O O 4.908 -5.372 -0.808 1.00 . A A . 21 ARG O 1 1 11 8032 1 1 20 PRO C C 7.378 -3.395 -0.026 1.00 . A A . 22 PRO C 1 1 11 8033 1 1 20 PRO CA C 7.307 -4.830 0.495 1.00 . A A . 22 PRO CA 1 1 11 8034 1 1 20 PRO CB C 8.656 -5.261 1.073 1.00 . A A . 22 PRO CB 1 1 11 8035 1 1 20 PRO CD C 8.317 -6.462 -1.066 1.00 . A A . 22 PRO CD 1 1 11 8036 1 1 20 PRO CG C 9.394 -6.013 -0.059 1.00 . A A . 22 PRO CG 1 1 11 8037 1 1 20 PRO HA H 6.532 -4.933 1.238 1.00 . A A . 22 PRO HA 1 1 11 8038 1 1 20 PRO HB2 H 9.223 -4.390 1.376 1.00 . A A . 22 PRO HB2 1 1 11 8039 1 1 20 PRO HB3 H 8.508 -5.921 1.913 1.00 . A A . 22 PRO HB3 1 1 11 8040 1 1 20 PRO HD2 H 8.588 -6.157 -2.067 1.00 . A A . 22 PRO HD2 1 1 11 8041 1 1 20 PRO HD3 H 8.177 -7.528 -1.018 1.00 . A A . 22 PRO HD3 1 1 11 8042 1 1 20 PRO HG2 H 10.101 -5.352 -0.540 1.00 . A A . 22 PRO HG2 1 1 11 8043 1 1 20 PRO HG3 H 9.902 -6.875 0.340 1.00 . A A . 22 PRO HG3 1 1 11 8044 1 1 20 PRO N N 7.092 -5.765 -0.624 1.00 . A A . 22 PRO N 1 1 11 8045 1 1 20 PRO O O 8.284 -3.032 -0.749 1.00 . A A . 22 PRO O 1 1 11 8046 1 1 21 LEU C C 6.566 -0.235 1.060 1.00 . A A . 23 LEU C 1 1 11 8047 1 1 21 LEU CA C 6.452 -1.170 -0.143 1.00 . A A . 23 LEU CA 1 1 11 8048 1 1 21 LEU CB C 5.157 -0.862 -0.902 1.00 . A A . 23 LEU CB 1 1 11 8049 1 1 21 LEU CD1 C 3.256 -2.311 -1.635 1.00 . A A . 23 LEU CD1 1 1 11 8050 1 1 21 LEU CD2 C 5.094 -1.754 -3.235 1.00 . A A . 23 LEU CD2 1 1 11 8051 1 1 21 LEU CG C 4.760 -2.060 -1.773 1.00 . A A . 23 LEU CG 1 1 11 8052 1 1 21 LEU H H 5.710 -2.888 0.919 1.00 . A A . 23 LEU H 1 1 11 8053 1 1 21 LEU HA H 7.298 -1.022 -0.796 1.00 . A A . 23 LEU HA 1 1 11 8054 1 1 21 LEU HB2 H 4.368 -0.654 -0.194 1.00 . A A . 23 LEU HB2 1 1 11 8055 1 1 21 LEU HB3 H 5.310 0.000 -1.533 1.00 . A A . 23 LEU HB3 1 1 11 8056 1 1 21 LEU HD11 H 2.763 -2.066 -2.564 1.00 . A A . 23 LEU HD11 1 1 11 8057 1 1 21 LEU HD12 H 2.859 -1.694 -0.843 1.00 . A A . 23 LEU HD12 1 1 11 8058 1 1 21 LEU HD13 H 3.085 -3.352 -1.400 1.00 . A A . 23 LEU HD13 1 1 11 8059 1 1 21 LEU HD21 H 6.126 -1.446 -3.310 1.00 . A A . 23 LEU HD21 1 1 11 8060 1 1 21 LEU HD22 H 4.453 -0.962 -3.592 1.00 . A A . 23 LEU HD22 1 1 11 8061 1 1 21 LEU HD23 H 4.939 -2.641 -3.831 1.00 . A A . 23 LEU HD23 1 1 11 8062 1 1 21 LEU HG H 5.299 -2.937 -1.454 1.00 . A A . 23 LEU HG 1 1 11 8063 1 1 21 LEU N N 6.432 -2.577 0.335 1.00 . A A . 23 LEU N 1 1 11 8064 1 1 21 LEU O O 5.847 -0.368 2.027 1.00 . A A . 23 LEU O 1 1 11 8065 1 1 22 CYS C C 6.652 2.828 1.941 1.00 . A A . 24 CYS C 1 1 11 8066 1 1 22 CYS CA C 7.606 1.653 2.150 1.00 . A A . 24 CYS CA 1 1 11 8067 1 1 22 CYS CB C 9.050 2.161 2.218 1.00 . A A . 24 CYS CB 1 1 11 8068 1 1 22 CYS H H 8.026 0.808 0.215 1.00 . A A . 24 CYS H 1 1 11 8069 1 1 22 CYS HA H 7.357 1.145 3.070 1.00 . A A . 24 CYS HA 1 1 11 8070 1 1 22 CYS HB2 H 9.726 1.319 2.237 1.00 . A A . 24 CYS HB2 1 1 11 8071 1 1 22 CYS HB3 H 9.260 2.770 1.350 1.00 . A A . 24 CYS HB3 1 1 11 8072 1 1 22 CYS N N 7.458 0.713 1.007 1.00 . A A . 24 CYS N 1 1 11 8073 1 1 22 CYS O O 7.004 3.834 1.360 1.00 . A A . 24 CYS O 1 1 11 8074 1 1 22 CYS SG S 9.271 3.148 3.720 1.00 . A A . 24 CYS SG 1 1 11 8075 1 1 23 GLY C C 4.981 5.085 2.838 1.00 . A A . 25 GLY C 1 1 11 8076 1 1 23 GLY CA C 4.447 3.796 2.222 1.00 . A A . 25 GLY CA 1 1 11 8077 1 1 23 GLY H H 5.175 1.873 2.864 1.00 . A A . 25 GLY H 1 1 11 8078 1 1 23 GLY HA2 H 4.273 3.949 1.165 1.00 . A A . 25 GLY HA2 1 1 11 8079 1 1 23 GLY HA3 H 3.520 3.529 2.705 1.00 . A A . 25 GLY HA3 1 1 11 8080 1 1 23 GLY N N 5.437 2.699 2.403 1.00 . A A . 25 GLY N 1 1 11 8081 1 1 23 GLY O O 5.718 5.058 3.805 1.00 . A A . 25 GLY O 1 1 11 8082 1 1 24 SER C C 4.862 7.579 4.348 1.00 . A A . 26 SER C 1 1 11 8083 1 1 24 SER CA C 5.101 7.519 2.834 1.00 . A A . 26 SER CA 1 1 11 8084 1 1 24 SER CB C 4.346 8.666 2.165 1.00 . A A . 26 SER CB 1 1 11 8085 1 1 24 SER H H 4.020 6.208 1.502 1.00 . A A . 26 SER H 1 1 11 8086 1 1 24 SER HA H 6.158 7.621 2.634 1.00 . A A . 26 SER HA 1 1 11 8087 1 1 24 SER HB2 H 4.824 8.922 1.234 1.00 . A A . 26 SER HB2 1 1 11 8088 1 1 24 SER HB3 H 3.327 8.359 1.972 1.00 . A A . 26 SER HB3 1 1 11 8089 1 1 24 SER HG H 5.239 9.879 3.395 1.00 . A A . 26 SER HG 1 1 11 8090 1 1 24 SER N N 4.615 6.216 2.285 1.00 . A A . 26 SER N 1 1 11 8091 1 1 24 SER O O 5.442 8.390 5.041 1.00 . A A . 26 SER O 1 1 11 8092 1 1 24 SER OG O 4.357 9.799 3.024 1.00 . A A . 26 SER OG 1 1 11 8093 1 1 25 ASP C C 4.858 6.031 7.096 1.00 . A A . 27 ASP C 1 1 11 8094 1 1 25 ASP CA C 3.738 6.752 6.337 1.00 . A A . 27 ASP CA 1 1 11 8095 1 1 25 ASP CB C 2.413 6.040 6.618 1.00 . A A . 27 ASP CB 1 1 11 8096 1 1 25 ASP CG C 2.574 4.543 6.346 1.00 . A A . 27 ASP CG 1 1 11 8097 1 1 25 ASP H H 3.548 6.090 4.297 1.00 . A A . 27 ASP H 1 1 11 8098 1 1 25 ASP HA H 3.673 7.775 6.678 1.00 . A A . 27 ASP HA 1 1 11 8099 1 1 25 ASP HB2 H 2.137 6.190 7.652 1.00 . A A . 27 ASP HB2 1 1 11 8100 1 1 25 ASP HB3 H 1.644 6.440 5.976 1.00 . A A . 27 ASP HB3 1 1 11 8101 1 1 25 ASP N N 4.011 6.733 4.869 1.00 . A A . 27 ASP N 1 1 11 8102 1 1 25 ASP O O 4.705 5.678 8.248 1.00 . A A . 27 ASP O 1 1 11 8103 1 1 25 ASP OD1 O 3.167 4.206 5.334 1.00 . A A . 27 ASP OD1 1 1 11 8104 1 1 25 ASP OD2 O 2.104 3.759 7.154 1.00 . A A . 27 ASP OD2 1 1 11 8105 1 1 26 ASN C C 6.672 3.689 7.519 1.00 . A A . 28 ASN C 1 1 11 8106 1 1 26 ASN CA C 7.095 5.115 7.169 1.00 . A A . 28 ASN CA 1 1 11 8107 1 1 26 ASN CB C 7.428 5.868 8.454 1.00 . A A . 28 ASN CB 1 1 11 8108 1 1 26 ASN CG C 8.912 6.231 8.462 1.00 . A A . 28 ASN CG 1 1 11 8109 1 1 26 ASN H H 6.095 6.099 5.546 1.00 . A A . 28 ASN H 1 1 11 8110 1 1 26 ASN HA H 7.964 5.088 6.530 1.00 . A A . 28 ASN HA 1 1 11 8111 1 1 26 ASN HB2 H 6.834 6.767 8.508 1.00 . A A . 28 ASN HB2 1 1 11 8112 1 1 26 ASN HB3 H 7.210 5.239 9.305 1.00 . A A . 28 ASN HB3 1 1 11 8113 1 1 26 ASN HD21 H 9.458 4.600 9.454 1.00 . A A . 28 ASN HD21 1 1 11 8114 1 1 26 ASN HD22 H 10.721 5.657 9.045 1.00 . A A . 28 ASN HD22 1 1 11 8115 1 1 26 ASN N N 5.981 5.809 6.469 1.00 . A A . 28 ASN N 1 1 11 8116 1 1 26 ASN ND2 N 9.769 5.429 9.033 1.00 . A A . 28 ASN ND2 1 1 11 8117 1 1 26 ASN O O 7.020 3.171 8.561 1.00 . A A . 28 ASN O 1 1 11 8118 1 1 26 ASN OD1 O 9.298 7.257 7.939 1.00 . A A . 28 ASN OD1 1 1 11 8119 1 1 27 LYS C C 5.720 0.746 5.788 1.00 . A A . 29 LYS C 1 1 11 8120 1 1 27 LYS CA C 5.484 1.661 6.986 1.00 . A A . 29 LYS CA 1 1 11 8121 1 1 27 LYS CB C 3.998 1.665 7.333 1.00 . A A . 29 LYS CB 1 1 11 8122 1 1 27 LYS CD C 3.214 0.949 9.594 1.00 . A A . 29 LYS CD 1 1 11 8123 1 1 27 LYS CE C 4.124 0.378 10.683 1.00 . A A . 29 LYS CE 1 1 11 8124 1 1 27 LYS CG C 3.692 0.466 8.223 1.00 . A A . 29 LYS CG 1 1 11 8125 1 1 27 LYS H H 5.634 3.472 5.835 1.00 . A A . 29 LYS H 1 1 11 8126 1 1 27 LYS HA H 6.045 1.294 7.828 1.00 . A A . 29 LYS HA 1 1 11 8127 1 1 27 LYS HB2 H 3.749 2.579 7.854 1.00 . A A . 29 LYS HB2 1 1 11 8128 1 1 27 LYS HB3 H 3.415 1.595 6.427 1.00 . A A . 29 LYS HB3 1 1 11 8129 1 1 27 LYS HD2 H 3.246 2.029 9.626 1.00 . A A . 29 LYS HD2 1 1 11 8130 1 1 27 LYS HD3 H 2.200 0.613 9.761 1.00 . A A . 29 LYS HD3 1 1 11 8131 1 1 27 LYS HE2 H 3.528 0.102 11.540 1.00 . A A . 29 LYS HE2 1 1 11 8132 1 1 27 LYS HE3 H 4.633 -0.494 10.301 1.00 . A A . 29 LYS HE3 1 1 11 8133 1 1 27 LYS HG2 H 2.924 -0.133 7.761 1.00 . A A . 29 LYS HG2 1 1 11 8134 1 1 27 LYS HG3 H 4.587 -0.122 8.344 1.00 . A A . 29 LYS HG3 1 1 11 8135 1 1 27 LYS HZ1 H 4.902 2.312 10.627 1.00 . A A . 29 LYS HZ1 1 1 11 8136 1 1 27 LYS HZ2 H 6.077 1.097 10.791 1.00 . A A . 29 LYS HZ2 1 1 11 8137 1 1 27 LYS HZ3 H 5.108 1.527 12.117 1.00 . A A . 29 LYS HZ3 1 1 11 8138 1 1 27 LYS N N 5.918 3.046 6.670 1.00 . A A . 29 LYS N 1 1 11 8139 1 1 27 LYS NZ N 5.128 1.406 11.084 1.00 . A A . 29 LYS NZ 1 1 11 8140 1 1 27 LYS O O 5.940 1.195 4.682 1.00 . A A . 29 LYS O 1 1 11 8141 1 1 28 THR C C 4.587 -2.261 4.620 1.00 . A A . 30 THR C 1 1 11 8142 1 1 28 THR CA C 5.885 -1.492 4.882 1.00 . A A . 30 THR CA 1 1 11 8143 1 1 28 THR CB C 7.000 -2.475 5.246 1.00 . A A . 30 THR CB 1 1 11 8144 1 1 28 THR CG2 C 7.044 -3.601 4.212 1.00 . A A . 30 THR CG2 1 1 11 8145 1 1 28 THR H H 5.489 -0.879 6.904 1.00 . A A . 30 THR H 1 1 11 8146 1 1 28 THR HA H 6.164 -0.944 3.996 1.00 . A A . 30 THR HA 1 1 11 8147 1 1 28 THR HB H 6.809 -2.894 6.221 1.00 . A A . 30 THR HB 1 1 11 8148 1 1 28 THR HG1 H 8.605 -1.819 4.365 1.00 . A A . 30 THR HG1 1 1 11 8149 1 1 28 THR HG21 H 6.418 -3.344 3.371 1.00 . A A . 30 THR HG21 1 1 11 8150 1 1 28 THR HG22 H 6.687 -4.516 4.660 1.00 . A A . 30 THR HG22 1 1 11 8151 1 1 28 THR HG23 H 8.059 -3.740 3.873 1.00 . A A . 30 THR HG23 1 1 11 8152 1 1 28 THR N N 5.671 -0.540 6.003 1.00 . A A . 30 THR N 1 1 11 8153 1 1 28 THR O O 3.918 -2.697 5.535 1.00 . A A . 30 THR O 1 1 11 8154 1 1 28 THR OG1 O 8.247 -1.791 5.255 1.00 . A A . 30 THR OG1 1 1 11 8155 1 1 29 TYR C C 3.300 -4.487 2.393 1.00 . A A . 31 TYR C 1 1 11 8156 1 1 29 TYR CA C 2.967 -3.146 3.053 1.00 . A A . 31 TYR CA 1 1 11 8157 1 1 29 TYR CB C 2.146 -2.283 2.102 1.00 . A A . 31 TYR CB 1 1 11 8158 1 1 29 TYR CD1 C 0.891 -1.362 4.080 1.00 . A A . 31 TYR CD1 1 1 11 8159 1 1 29 TYR CD2 C 1.698 0.185 2.396 1.00 . A A . 31 TYR CD2 1 1 11 8160 1 1 29 TYR CE1 C 0.353 -0.293 4.807 1.00 . A A . 31 TYR CE1 1 1 11 8161 1 1 29 TYR CE2 C 1.161 1.255 3.123 1.00 . A A . 31 TYR CE2 1 1 11 8162 1 1 29 TYR CG C 1.564 -1.125 2.877 1.00 . A A . 31 TYR CG 1 1 11 8163 1 1 29 TYR CZ C 0.487 1.016 4.327 1.00 . A A . 31 TYR CZ 1 1 11 8164 1 1 29 TYR H H 4.766 -2.052 2.654 1.00 . A A . 31 TYR H 1 1 11 8165 1 1 29 TYR HA H 2.403 -3.321 3.954 1.00 . A A . 31 TYR HA 1 1 11 8166 1 1 29 TYR HB2 H 2.780 -1.909 1.311 1.00 . A A . 31 TYR HB2 1 1 11 8167 1 1 29 TYR HB3 H 1.352 -2.870 1.681 1.00 . A A . 31 TYR HB3 1 1 11 8168 1 1 29 TYR HD1 H 0.787 -2.372 4.450 1.00 . A A . 31 TYR HD1 1 1 11 8169 1 1 29 TYR HD2 H 2.219 0.370 1.468 1.00 . A A . 31 TYR HD2 1 1 11 8170 1 1 29 TYR HE1 H -0.167 -0.478 5.735 1.00 . A A . 31 TYR HE1 1 1 11 8171 1 1 29 TYR HE2 H 1.265 2.266 2.755 1.00 . A A . 31 TYR HE2 1 1 11 8172 1 1 29 TYR HH H 0.664 2.708 5.198 1.00 . A A . 31 TYR HH 1 1 11 8173 1 1 29 TYR N N 4.221 -2.420 3.377 1.00 . A A . 31 TYR N 1 1 11 8174 1 1 29 TYR O O 4.362 -4.667 1.829 1.00 . A A . 31 TYR O 1 1 11 8175 1 1 29 TYR OH O -0.041 2.073 5.042 1.00 . A A . 31 TYR OH 1 1 11 8176 1 1 30 GLY C C 2.551 -6.679 0.336 1.00 . A A . 32 GLY C 1 1 11 8177 1 1 30 GLY CA C 2.663 -6.768 1.859 1.00 . A A . 32 GLY CA 1 1 11 8178 1 1 30 GLY H H 1.554 -5.266 2.935 1.00 . A A . 32 GLY H 1 1 11 8179 1 1 30 GLY HA2 H 3.658 -7.096 2.129 1.00 . A A . 32 GLY HA2 1 1 11 8180 1 1 30 GLY HA3 H 1.939 -7.478 2.227 1.00 . A A . 32 GLY HA3 1 1 11 8181 1 1 30 GLY N N 2.401 -5.433 2.469 1.00 . A A . 32 GLY N 1 1 11 8182 1 1 30 GLY O O 3.111 -7.487 -0.381 1.00 . A A . 32 GLY O 1 1 11 8183 1 1 31 ASN C C 0.925 -4.322 -1.996 1.00 . A A . 33 ASN C 1 1 11 8184 1 1 31 ASN CA C 1.703 -5.589 -1.648 1.00 . A A . 33 ASN CA 1 1 11 8185 1 1 31 ASN CB C 0.955 -6.805 -2.198 1.00 . A A . 33 ASN CB 1 1 11 8186 1 1 31 ASN CG C -0.218 -7.148 -1.279 1.00 . A A . 33 ASN CG 1 1 11 8187 1 1 31 ASN H H 1.393 -5.065 0.420 1.00 . A A . 33 ASN H 1 1 11 8188 1 1 31 ASN HA H 2.683 -5.540 -2.095 1.00 . A A . 33 ASN HA 1 1 11 8189 1 1 31 ASN HB2 H 0.583 -6.578 -3.186 1.00 . A A . 33 ASN HB2 1 1 11 8190 1 1 31 ASN HB3 H 1.627 -7.648 -2.251 1.00 . A A . 33 ASN HB3 1 1 11 8191 1 1 31 ASN HD21 H 0.366 -9.022 -0.999 1.00 . A A . 33 ASN HD21 1 1 11 8192 1 1 31 ASN HD22 H -1.060 -8.579 -0.194 1.00 . A A . 33 ASN HD22 1 1 11 8193 1 1 31 ASN N N 1.837 -5.710 -0.169 1.00 . A A . 33 ASN N 1 1 11 8194 1 1 31 ASN ND2 N -0.311 -8.349 -0.782 1.00 . A A . 33 ASN ND2 1 1 11 8195 1 1 31 ASN O O 0.406 -3.637 -1.138 1.00 . A A . 33 ASN O 1 1 11 8196 1 1 31 ASN OD1 O -1.057 -6.313 -1.011 1.00 . A A . 33 ASN OD1 1 1 11 8197 1 1 32 LYS C C -1.379 -2.954 -3.353 1.00 . A A . 34 LYS C 1 1 11 8198 1 1 32 LYS CA C 0.103 -2.792 -3.686 1.00 . A A . 34 LYS CA 1 1 11 8199 1 1 32 LYS CB C 0.285 -2.597 -5.198 1.00 . A A . 34 LYS CB 1 1 11 8200 1 1 32 LYS CD C -1.979 -2.601 -6.259 1.00 . A A . 34 LYS CD 1 1 11 8201 1 1 32 LYS CE C -1.672 -3.073 -7.681 1.00 . A A . 34 LYS CE 1 1 11 8202 1 1 32 LYS CG C -0.837 -1.714 -5.758 1.00 . A A . 34 LYS CG 1 1 11 8203 1 1 32 LYS H H 1.271 -4.581 -3.928 1.00 . A A . 34 LYS H 1 1 11 8204 1 1 32 LYS HA H 0.491 -1.934 -3.161 1.00 . A A . 34 LYS HA 1 1 11 8205 1 1 32 LYS HB2 H 1.238 -2.127 -5.385 1.00 . A A . 34 LYS HB2 1 1 11 8206 1 1 32 LYS HB3 H 0.257 -3.559 -5.687 1.00 . A A . 34 LYS HB3 1 1 11 8207 1 1 32 LYS HD2 H -2.082 -3.457 -5.609 1.00 . A A . 34 LYS HD2 1 1 11 8208 1 1 32 LYS HD3 H -2.899 -2.036 -6.260 1.00 . A A . 34 LYS HD3 1 1 11 8209 1 1 32 LYS HE2 H -2.564 -3.498 -8.119 1.00 . A A . 34 LYS HE2 1 1 11 8210 1 1 32 LYS HE3 H -1.345 -2.233 -8.275 1.00 . A A . 34 LYS HE3 1 1 11 8211 1 1 32 LYS HG2 H -1.201 -1.059 -4.981 1.00 . A A . 34 LYS HG2 1 1 11 8212 1 1 32 LYS HG3 H -0.454 -1.124 -6.578 1.00 . A A . 34 LYS HG3 1 1 11 8213 1 1 32 LYS HZ1 H -0.634 -4.674 -8.514 1.00 . A A . 34 LYS HZ1 1 1 11 8214 1 1 32 LYS HZ2 H -0.736 -4.722 -6.819 1.00 . A A . 34 LYS HZ2 1 1 11 8215 1 1 32 LYS HZ3 H 0.329 -3.638 -7.578 1.00 . A A . 34 LYS HZ3 1 1 11 8216 1 1 32 LYS N N 0.843 -4.010 -3.258 1.00 . A A . 34 LYS N 1 1 11 8217 1 1 32 LYS NZ N -0.597 -4.105 -7.645 1.00 . A A . 34 LYS NZ 1 1 11 8218 1 1 32 LYS O O -2.128 -2.000 -3.348 1.00 . A A . 34 LYS O 1 1 11 8219 1 1 33 CYS C C -3.489 -3.758 -1.338 1.00 . A A . 35 CYS C 1 1 11 8220 1 1 33 CYS CA C -3.240 -4.349 -2.725 1.00 . A A . 35 CYS CA 1 1 11 8221 1 1 33 CYS CB C -3.543 -5.845 -2.726 1.00 . A A . 35 CYS CB 1 1 11 8222 1 1 33 CYS H H -1.192 -4.912 -3.064 1.00 . A A . 35 CYS H 1 1 11 8223 1 1 33 CYS HA H -3.862 -3.848 -3.450 1.00 . A A . 35 CYS HA 1 1 11 8224 1 1 33 CYS HB2 H -3.191 -6.281 -3.650 1.00 . A A . 35 CYS HB2 1 1 11 8225 1 1 33 CYS HB3 H -3.038 -6.310 -1.895 1.00 . A A . 35 CYS HB3 1 1 11 8226 1 1 33 CYS N N -1.810 -4.149 -3.065 1.00 . A A . 35 CYS N 1 1 11 8227 1 1 33 CYS O O -4.513 -3.155 -1.071 1.00 . A A . 35 CYS O 1 1 11 8228 1 1 33 CYS SG S -5.329 -6.102 -2.580 1.00 . A A . 35 CYS SG 1 1 11 8229 1 1 34 ASN C C -2.386 -1.830 0.797 1.00 . A A . 36 ASN C 1 1 11 8230 1 1 34 ASN CA C -2.684 -3.322 0.896 1.00 . A A . 36 ASN CA 1 1 11 8231 1 1 34 ASN CB C -1.678 -3.990 1.833 1.00 . A A . 36 ASN CB 1 1 11 8232 1 1 34 ASN CG C -2.374 -4.404 3.132 1.00 . A A . 36 ASN CG 1 1 11 8233 1 1 34 ASN H H -1.706 -4.356 -0.711 1.00 . A A . 36 ASN H 1 1 11 8234 1 1 34 ASN HA H -3.689 -3.479 1.257 1.00 . A A . 36 ASN HA 1 1 11 8235 1 1 34 ASN HB2 H -1.263 -4.864 1.352 1.00 . A A . 36 ASN HB2 1 1 11 8236 1 1 34 ASN HB3 H -0.885 -3.296 2.056 1.00 . A A . 36 ASN HB3 1 1 11 8237 1 1 34 ASN HD21 H -3.855 -5.350 2.205 1.00 . A A . 36 ASN HD21 1 1 11 8238 1 1 34 ASN HD22 H -3.931 -5.366 3.900 1.00 . A A . 36 ASN HD22 1 1 11 8239 1 1 34 ASN N N -2.536 -3.897 -0.463 1.00 . A A . 36 ASN N 1 1 11 8240 1 1 34 ASN ND2 N -3.479 -5.097 3.074 1.00 . A A . 36 ASN ND2 1 1 11 8241 1 1 34 ASN O O -2.833 -1.028 1.595 1.00 . A A . 36 ASN O 1 1 11 8242 1 1 34 ASN OD1 O -1.909 -4.093 4.210 1.00 . A A . 36 ASN OD1 1 1 11 8243 1 1 35 PHE C C -2.512 0.715 -0.914 1.00 . A A . 37 PHE C 1 1 11 8244 1 1 35 PHE CA C -1.281 -0.033 -0.406 1.00 . A A . 37 PHE CA 1 1 11 8245 1 1 35 PHE CB C -0.154 0.050 -1.440 1.00 . A A . 37 PHE CB 1 1 11 8246 1 1 35 PHE CD1 C -0.400 2.271 -2.608 1.00 . A A . 37 PHE CD1 1 1 11 8247 1 1 35 PHE CD2 C 1.304 2.031 -0.900 1.00 . A A . 37 PHE CD2 1 1 11 8248 1 1 35 PHE CE1 C -0.009 3.601 -2.813 1.00 . A A . 37 PHE CE1 1 1 11 8249 1 1 35 PHE CE2 C 1.694 3.359 -1.104 1.00 . A A . 37 PHE CE2 1 1 11 8250 1 1 35 PHE CG C 0.257 1.487 -1.653 1.00 . A A . 37 PHE CG 1 1 11 8251 1 1 35 PHE CZ C 1.038 4.145 -2.060 1.00 . A A . 37 PHE CZ 1 1 11 8252 1 1 35 PHE H H -1.295 -2.135 -0.830 1.00 . A A . 37 PHE H 1 1 11 8253 1 1 35 PHE HA H -0.955 0.399 0.527 1.00 . A A . 37 PHE HA 1 1 11 8254 1 1 35 PHE HB2 H 0.697 -0.515 -1.086 1.00 . A A . 37 PHE HB2 1 1 11 8255 1 1 35 PHE HB3 H -0.495 -0.368 -2.377 1.00 . A A . 37 PHE HB3 1 1 11 8256 1 1 35 PHE HD1 H -1.209 1.852 -3.190 1.00 . A A . 37 PHE HD1 1 1 11 8257 1 1 35 PHE HD2 H 1.810 1.426 -0.162 1.00 . A A . 37 PHE HD2 1 1 11 8258 1 1 35 PHE HE1 H -0.516 4.205 -3.551 1.00 . A A . 37 PHE HE1 1 1 11 8259 1 1 35 PHE HE2 H 2.503 3.778 -0.524 1.00 . A A . 37 PHE HE2 1 1 11 8260 1 1 35 PHE HZ H 1.342 5.170 -2.216 1.00 . A A . 37 PHE HZ 1 1 11 8261 1 1 35 PHE N N -1.631 -1.461 -0.202 1.00 . A A . 37 PHE N 1 1 11 8262 1 1 35 PHE O O -2.725 1.865 -0.594 1.00 . A A . 37 PHE O 1 1 11 8263 1 1 36 CYS C C -5.633 0.747 -1.135 1.00 . A A . 38 CYS C 1 1 11 8264 1 1 36 CYS CA C -4.553 0.738 -2.212 1.00 . A A . 38 CYS CA 1 1 11 8265 1 1 36 CYS CB C -5.076 -0.001 -3.440 1.00 . A A . 38 CYS CB 1 1 11 8266 1 1 36 CYS H H -3.146 -0.865 -1.933 1.00 . A A . 38 CYS H 1 1 11 8267 1 1 36 CYS HA H -4.312 1.755 -2.484 1.00 . A A . 38 CYS HA 1 1 11 8268 1 1 36 CYS HB2 H -4.423 -0.832 -3.668 1.00 . A A . 38 CYS HB2 1 1 11 8269 1 1 36 CYS HB3 H -6.070 -0.368 -3.239 1.00 . A A . 38 CYS HB3 1 1 11 8270 1 1 36 CYS N N -3.331 0.066 -1.694 1.00 . A A . 38 CYS N 1 1 11 8271 1 1 36 CYS O O -6.558 1.530 -1.182 1.00 . A A . 38 CYS O 1 1 11 8272 1 1 36 CYS SG S -5.122 1.136 -4.842 1.00 . A A . 38 CYS SG 1 1 11 8273 1 1 37 CYS C C -6.392 1.143 1.759 1.00 . A A . 39 CYS C 1 1 11 8274 1 1 37 CYS CA C -6.569 -0.111 0.906 1.00 . A A . 39 CYS CA 1 1 11 8275 1 1 37 CYS CB C -6.417 -1.351 1.786 1.00 . A A . 39 CYS CB 1 1 11 8276 1 1 37 CYS H H -4.780 -0.743 -0.125 1.00 . A A . 39 CYS H 1 1 11 8277 1 1 37 CYS HA H -7.550 -0.102 0.455 1.00 . A A . 39 CYS HA 1 1 11 8278 1 1 37 CYS HB2 H -6.584 -2.237 1.192 1.00 . A A . 39 CYS HB2 1 1 11 8279 1 1 37 CYS HB3 H -5.421 -1.378 2.201 1.00 . A A . 39 CYS HB3 1 1 11 8280 1 1 37 CYS N N -5.532 -0.110 -0.159 1.00 . A A . 39 CYS N 1 1 11 8281 1 1 37 CYS O O -7.344 1.784 2.155 1.00 . A A . 39 CYS O 1 1 11 8282 1 1 37 CYS SG S -7.631 -1.281 3.128 1.00 . A A . 39 CYS SG 1 1 11 8283 1 1 38 ALA C C -4.933 3.965 2.001 1.00 . A A . 40 ALA C 1 1 11 8284 1 1 38 ALA CA C -4.918 2.706 2.874 1.00 . A A . 40 ALA CA 1 1 11 8285 1 1 38 ALA CB C -3.556 2.577 3.556 1.00 . A A . 40 ALA CB 1 1 11 8286 1 1 38 ALA H H -4.417 0.960 1.711 1.00 . A A . 40 ALA H 1 1 11 8287 1 1 38 ALA HA H -5.686 2.786 3.628 1.00 . A A . 40 ALA HA 1 1 11 8288 1 1 38 ALA HB1 H -2.906 1.963 2.951 1.00 . A A . 40 ALA HB1 1 1 11 8289 1 1 38 ALA HB2 H -3.682 2.121 4.528 1.00 . A A . 40 ALA HB2 1 1 11 8290 1 1 38 ALA HB3 H -3.122 3.557 3.672 1.00 . A A . 40 ALA HB3 1 1 11 8291 1 1 38 ALA N N -5.170 1.496 2.043 1.00 . A A . 40 ALA N 1 1 11 8292 1 1 38 ALA O O -5.200 5.050 2.477 1.00 . A A . 40 ALA O 1 1 11 8293 1 1 39 VAL C C -6.088 5.440 -0.466 1.00 . A A . 41 VAL C 1 1 11 8294 1 1 39 VAL CA C -4.651 5.052 -0.139 1.00 . A A . 41 VAL CA 1 1 11 8295 1 1 39 VAL CB C -3.896 4.769 -1.441 1.00 . A A . 41 VAL CB 1 1 11 8296 1 1 39 VAL CG1 C -3.873 6.033 -2.303 1.00 . A A . 41 VAL CG1 1 1 11 8297 1 1 39 VAL CG2 C -2.461 4.350 -1.121 1.00 . A A . 41 VAL CG2 1 1 11 8298 1 1 39 VAL H H -4.433 2.961 0.357 1.00 . A A . 41 VAL H 1 1 11 8299 1 1 39 VAL HA H -4.178 5.865 0.382 1.00 . A A . 41 VAL HA 1 1 11 8300 1 1 39 VAL HB H -4.394 3.975 -1.981 1.00 . A A . 41 VAL HB 1 1 11 8301 1 1 39 VAL HG11 H -4.527 5.903 -3.152 1.00 . A A . 41 VAL HG11 1 1 11 8302 1 1 39 VAL HG12 H -2.866 6.215 -2.649 1.00 . A A . 41 VAL HG12 1 1 11 8303 1 1 39 VAL HG13 H -4.208 6.875 -1.716 1.00 . A A . 41 VAL HG13 1 1 11 8304 1 1 39 VAL HG21 H -2.403 4.022 -0.094 1.00 . A A . 41 VAL HG21 1 1 11 8305 1 1 39 VAL HG22 H -1.799 5.188 -1.272 1.00 . A A . 41 VAL HG22 1 1 11 8306 1 1 39 VAL HG23 H -2.172 3.539 -1.774 1.00 . A A . 41 VAL HG23 1 1 11 8307 1 1 39 VAL N N -4.648 3.842 0.733 1.00 . A A . 41 VAL N 1 1 11 8308 1 1 39 VAL O O -6.457 6.596 -0.418 1.00 . A A . 41 VAL O 1 1 11 8309 1 1 40 VAL C C -9.057 5.164 0.158 1.00 . A A . 42 VAL C 1 1 11 8310 1 1 40 VAL CA C -8.312 4.808 -1.128 1.00 . A A . 42 VAL CA 1 1 11 8311 1 1 40 VAL CB C -8.978 3.606 -1.796 1.00 . A A . 42 VAL CB 1 1 11 8312 1 1 40 VAL CG1 C -10.385 3.998 -2.248 1.00 . A A . 42 VAL CG1 1 1 11 8313 1 1 40 VAL CG2 C -8.150 3.178 -3.011 1.00 . A A . 42 VAL CG2 1 1 11 8314 1 1 40 VAL H H -6.582 3.562 -0.831 1.00 . A A . 42 VAL H 1 1 11 8315 1 1 40 VAL HA H -8.337 5.651 -1.802 1.00 . A A . 42 VAL HA 1 1 11 8316 1 1 40 VAL HB H -9.038 2.788 -1.092 1.00 . A A . 42 VAL HB 1 1 11 8317 1 1 40 VAL HG11 H -10.922 4.430 -1.417 1.00 . A A . 42 VAL HG11 1 1 11 8318 1 1 40 VAL HG12 H -10.910 3.122 -2.599 1.00 . A A . 42 VAL HG12 1 1 11 8319 1 1 40 VAL HG13 H -10.319 4.721 -3.048 1.00 . A A . 42 VAL HG13 1 1 11 8320 1 1 40 VAL HG21 H -7.389 3.920 -3.207 1.00 . A A . 42 VAL HG21 1 1 11 8321 1 1 40 VAL HG22 H -8.795 3.088 -3.873 1.00 . A A . 42 VAL HG22 1 1 11 8322 1 1 40 VAL HG23 H -7.681 2.226 -2.811 1.00 . A A . 42 VAL HG23 1 1 11 8323 1 1 40 VAL N N -6.901 4.486 -0.799 1.00 . A A . 42 VAL N 1 1 11 8324 1 1 40 VAL O O -10.049 5.866 0.134 1.00 . A A . 42 VAL O 1 1 11 8325 1 1 41 GLU C C -8.925 6.487 2.924 1.00 . A A . 43 GLU C 1 1 11 8326 1 1 41 GLU CA C -9.265 5.038 2.564 1.00 . A A . 43 GLU CA 1 1 11 8327 1 1 41 GLU CB C -8.808 4.069 3.673 1.00 . A A . 43 GLU CB 1 1 11 8328 1 1 41 GLU CD C -8.084 5.350 5.690 1.00 . A A . 43 GLU CD 1 1 11 8329 1 1 41 GLU CG C -7.598 4.631 4.429 1.00 . A A . 43 GLU CG 1 1 11 8330 1 1 41 GLU H H -7.770 4.145 1.288 1.00 . A A . 43 GLU H 1 1 11 8331 1 1 41 GLU HA H -10.334 4.949 2.428 1.00 . A A . 43 GLU HA 1 1 11 8332 1 1 41 GLU HB2 H -9.622 3.918 4.368 1.00 . A A . 43 GLU HB2 1 1 11 8333 1 1 41 GLU HB3 H -8.541 3.123 3.229 1.00 . A A . 43 GLU HB3 1 1 11 8334 1 1 41 GLU HG2 H -6.938 3.822 4.706 1.00 . A A . 43 GLU HG2 1 1 11 8335 1 1 41 GLU HG3 H -7.070 5.330 3.799 1.00 . A A . 43 GLU HG3 1 1 11 8336 1 1 41 GLU N N -8.581 4.700 1.284 1.00 . A A . 43 GLU N 1 1 11 8337 1 1 41 GLU O O -9.690 7.179 3.564 1.00 . A A . 43 GLU O 1 1 11 8338 1 1 41 GLU OE1 O -8.926 6.223 5.562 1.00 . A A . 43 GLU OE1 1 1 11 8339 1 1 41 GLU OE2 O -7.608 5.013 6.761 1.00 . A A . 43 GLU OE2 1 1 11 8340 1 1 42 SER C C -7.803 9.230 1.592 1.00 . A A . 44 SER C 1 1 11 8341 1 1 42 SER CA C -7.380 8.349 2.773 1.00 . A A . 44 SER CA 1 1 11 8342 1 1 42 SER CB C -5.865 8.416 2.954 1.00 . A A . 44 SER CB 1 1 11 8343 1 1 42 SER H H -7.194 6.366 1.963 1.00 . A A . 44 SER H 1 1 11 8344 1 1 42 SER HA H -7.869 8.692 3.672 1.00 . A A . 44 SER HA 1 1 11 8345 1 1 42 SER HB2 H -5.421 7.488 2.633 1.00 . A A . 44 SER HB2 1 1 11 8346 1 1 42 SER HB3 H -5.469 9.225 2.359 1.00 . A A . 44 SER HB3 1 1 11 8347 1 1 42 SER HG H -5.012 7.904 4.625 1.00 . A A . 44 SER HG 1 1 11 8348 1 1 42 SER N N -7.783 6.946 2.490 1.00 . A A . 44 SER N 1 1 11 8349 1 1 42 SER O O -7.777 10.443 1.665 1.00 . A A . 44 SER O 1 1 11 8350 1 1 42 SER OG O -5.566 8.629 4.327 1.00 . A A . 44 SER OG 1 1 11 8351 1 1 43 ASN C C -7.536 10.286 -1.218 1.00 . A A . 45 ASN C 1 1 11 8352 1 1 43 ASN CA C -8.663 9.404 -0.674 1.00 . A A . 45 ASN CA 1 1 11 8353 1 1 43 ASN CB C -9.837 10.288 -0.265 1.00 . A A . 45 ASN CB 1 1 11 8354 1 1 43 ASN CG C -11.067 9.923 -1.097 1.00 . A A . 45 ASN CG 1 1 11 8355 1 1 43 ASN H H -8.235 7.643 0.479 1.00 . A A . 45 ASN H 1 1 11 8356 1 1 43 ASN HA H -8.987 8.724 -1.447 1.00 . A A . 45 ASN HA 1 1 11 8357 1 1 43 ASN HB2 H -10.051 10.136 0.782 1.00 . A A . 45 ASN HB2 1 1 11 8358 1 1 43 ASN HB3 H -9.583 11.322 -0.436 1.00 . A A . 45 ASN HB3 1 1 11 8359 1 1 43 ASN HD21 H -11.249 11.735 -1.886 1.00 . A A . 45 ASN HD21 1 1 11 8360 1 1 43 ASN HD22 H -12.411 10.605 -2.389 1.00 . A A . 45 ASN HD22 1 1 11 8361 1 1 43 ASN N N -8.211 8.621 0.509 1.00 . A A . 45 ASN N 1 1 11 8362 1 1 43 ASN ND2 N -11.622 10.830 -1.854 1.00 . A A . 45 ASN ND2 1 1 11 8363 1 1 43 ASN O O -7.782 11.350 -1.749 1.00 . A A . 45 ASN O 1 1 11 8364 1 1 43 ASN OD1 O -11.529 8.800 -1.057 1.00 . A A . 45 ASN OD1 1 1 11 8365 1 1 44 GLY C C -4.217 11.089 -0.550 1.00 . A A . 46 GLY C 1 1 11 8366 1 1 44 GLY CA C -5.200 10.700 -1.657 1.00 . A A . 46 GLY CA 1 1 11 8367 1 1 44 GLY H H -6.115 8.996 -0.696 1.00 . A A . 46 GLY H 1 1 11 8368 1 1 44 GLY HA2 H -4.678 10.147 -2.424 1.00 . A A . 46 GLY HA2 1 1 11 8369 1 1 44 GLY HA3 H -5.617 11.598 -2.089 1.00 . A A . 46 GLY HA3 1 1 11 8370 1 1 44 GLY N N -6.307 9.862 -1.114 1.00 . A A . 46 GLY N 1 1 11 8371 1 1 44 GLY O O -3.188 11.680 -0.812 1.00 . A A . 46 GLY O 1 1 11 8372 1 1 45 THR C C -2.396 10.177 1.808 1.00 . A A . 47 THR C 1 1 11 8373 1 1 45 THR CA C -3.580 11.149 1.780 1.00 . A A . 47 THR CA 1 1 11 8374 1 1 45 THR CB C -4.323 11.096 3.118 1.00 . A A . 47 THR CB 1 1 11 8375 1 1 45 THR CG2 C -3.802 12.197 4.039 1.00 . A A . 47 THR CG2 1 1 11 8376 1 1 45 THR H H -5.352 10.308 0.881 1.00 . A A . 47 THR H 1 1 11 8377 1 1 45 THR HA H -3.215 12.147 1.614 1.00 . A A . 47 THR HA 1 1 11 8378 1 1 45 THR HB H -4.162 10.136 3.584 1.00 . A A . 47 THR HB 1 1 11 8379 1 1 45 THR HG1 H -5.820 12.080 2.360 1.00 . A A . 47 THR HG1 1 1 11 8380 1 1 45 THR HG21 H -3.925 11.894 5.069 1.00 . A A . 47 THR HG21 1 1 11 8381 1 1 45 THR HG22 H -4.359 13.106 3.863 1.00 . A A . 47 THR HG22 1 1 11 8382 1 1 45 THR HG23 H -2.756 12.372 3.837 1.00 . A A . 47 THR HG23 1 1 11 8383 1 1 45 THR N N -4.515 10.775 0.680 1.00 . A A . 47 THR N 1 1 11 8384 1 1 45 THR O O -1.299 10.518 1.413 1.00 . A A . 47 THR O 1 1 11 8385 1 1 45 THR OG1 O -5.713 11.288 2.891 1.00 . A A . 47 THR OG1 1 1 11 8386 1 1 46 LEU C C -0.791 7.931 0.942 1.00 . A A . 48 LEU C 1 1 11 8387 1 1 46 LEU CA C -1.471 7.997 2.313 1.00 . A A . 48 LEU CA 1 1 11 8388 1 1 46 LEU CB C -2.004 6.613 2.684 1.00 . A A . 48 LEU CB 1 1 11 8389 1 1 46 LEU CD1 C -1.267 6.080 5.012 1.00 . A A . 48 LEU CD1 1 1 11 8390 1 1 46 LEU CD2 C -1.004 4.384 3.196 1.00 . A A . 48 LEU CD2 1 1 11 8391 1 1 46 LEU CG C -0.961 5.877 3.526 1.00 . A A . 48 LEU CG 1 1 11 8392 1 1 46 LEU H H -3.489 8.717 2.583 1.00 . A A . 48 LEU H 1 1 11 8393 1 1 46 LEU HA H -0.752 8.315 3.055 1.00 . A A . 48 LEU HA 1 1 11 8394 1 1 46 LEU HB2 H -2.917 6.717 3.249 1.00 . A A . 48 LEU HB2 1 1 11 8395 1 1 46 LEU HB3 H -2.198 6.049 1.783 1.00 . A A . 48 LEU HB3 1 1 11 8396 1 1 46 LEU HD11 H -2.319 6.292 5.137 1.00 . A A . 48 LEU HD11 1 1 11 8397 1 1 46 LEU HD12 H -0.686 6.908 5.387 1.00 . A A . 48 LEU HD12 1 1 11 8398 1 1 46 LEU HD13 H -1.013 5.184 5.557 1.00 . A A . 48 LEU HD13 1 1 11 8399 1 1 46 LEU HD21 H -1.294 3.829 4.076 1.00 . A A . 48 LEU HD21 1 1 11 8400 1 1 46 LEU HD22 H -0.027 4.059 2.872 1.00 . A A . 48 LEU HD22 1 1 11 8401 1 1 46 LEU HD23 H -1.720 4.210 2.407 1.00 . A A . 48 LEU HD23 1 1 11 8402 1 1 46 LEU HG H 0.021 6.268 3.304 1.00 . A A . 48 LEU HG 1 1 11 8403 1 1 46 LEU N N -2.600 8.975 2.267 1.00 . A A . 48 LEU N 1 1 11 8404 1 1 46 LEU O O -1.406 8.176 -0.077 1.00 . A A . 48 LEU O 1 1 11 8405 1 1 47 THR C C 2.307 6.493 -0.353 1.00 . A A . 49 THR C 1 1 11 8406 1 1 47 THR CA C 1.182 7.531 -0.407 1.00 . A A . 49 THR CA 1 1 11 8407 1 1 47 THR CB C 1.774 8.902 -0.749 1.00 . A A . 49 THR CB 1 1 11 8408 1 1 47 THR CG2 C 0.697 9.975 -0.592 1.00 . A A . 49 THR CG2 1 1 11 8409 1 1 47 THR H H 0.960 7.413 1.736 1.00 . A A . 49 THR H 1 1 11 8410 1 1 47 THR HA H 0.480 7.250 -1.175 1.00 . A A . 49 THR HA 1 1 11 8411 1 1 47 THR HB H 2.125 8.898 -1.768 1.00 . A A . 49 THR HB 1 1 11 8412 1 1 47 THR HG1 H 2.816 10.107 0.369 1.00 . A A . 49 THR HG1 1 1 11 8413 1 1 47 THR HG21 H -0.221 9.636 -1.052 1.00 . A A . 49 THR HG21 1 1 11 8414 1 1 47 THR HG22 H 1.023 10.887 -1.070 1.00 . A A . 49 THR HG22 1 1 11 8415 1 1 47 THR HG23 H 0.526 10.160 0.459 1.00 . A A . 49 THR HG23 1 1 11 8416 1 1 47 THR N N 0.476 7.605 0.905 1.00 . A A . 49 THR N 1 1 11 8417 1 1 47 THR O O 2.302 5.592 0.461 1.00 . A A . 49 THR O 1 1 11 8418 1 1 47 THR OG1 O 2.859 9.181 0.126 1.00 . A A . 49 THR OG1 1 1 11 8419 1 1 48 LEU C C 5.668 6.369 -0.755 1.00 . A A . 50 LEU C 1 1 11 8420 1 1 48 LEU CA C 4.412 5.666 -1.280 1.00 . A A . 50 LEU CA 1 1 11 8421 1 1 48 LEU CB C 4.634 5.238 -2.737 1.00 . A A . 50 LEU CB 1 1 11 8422 1 1 48 LEU CD1 C 4.749 2.795 -2.207 1.00 . A A . 50 LEU CD1 1 1 11 8423 1 1 48 LEU CD2 C 5.856 3.688 -4.258 1.00 . A A . 50 LEU CD2 1 1 11 8424 1 1 48 LEU CG C 5.510 3.984 -2.798 1.00 . A A . 50 LEU CG 1 1 11 8425 1 1 48 LEU H H 3.230 7.362 -1.864 1.00 . A A . 50 LEU H 1 1 11 8426 1 1 48 LEU HA H 4.196 4.799 -0.672 1.00 . A A . 50 LEU HA 1 1 11 8427 1 1 48 LEU HB2 H 3.680 5.030 -3.197 1.00 . A A . 50 LEU HB2 1 1 11 8428 1 1 48 LEU HB3 H 5.123 6.038 -3.273 1.00 . A A . 50 LEU HB3 1 1 11 8429 1 1 48 LEU HD11 H 4.444 3.027 -1.198 1.00 . A A . 50 LEU HD11 1 1 11 8430 1 1 48 LEU HD12 H 5.389 1.925 -2.198 1.00 . A A . 50 LEU HD12 1 1 11 8431 1 1 48 LEU HD13 H 3.876 2.591 -2.810 1.00 . A A . 50 LEU HD13 1 1 11 8432 1 1 48 LEU HD21 H 5.044 4.012 -4.893 1.00 . A A . 50 LEU HD21 1 1 11 8433 1 1 48 LEU HD22 H 6.011 2.627 -4.383 1.00 . A A . 50 LEU HD22 1 1 11 8434 1 1 48 LEU HD23 H 6.759 4.218 -4.530 1.00 . A A . 50 LEU HD23 1 1 11 8435 1 1 48 LEU HG H 6.418 4.149 -2.239 1.00 . A A . 50 LEU HG 1 1 11 8436 1 1 48 LEU N N 3.265 6.623 -1.230 1.00 . A A . 50 LEU N 1 1 11 8437 1 1 48 LEU O O 5.698 7.578 -0.631 1.00 . A A . 50 LEU O 1 1 11 8438 1 1 49 SER C C 9.212 5.577 -0.360 1.00 . A A . 51 SER C 1 1 11 8439 1 1 49 SER CA C 7.933 6.302 0.090 1.00 . A A . 51 SER CA 1 1 11 8440 1 1 49 SER CB C 7.884 6.314 1.617 1.00 . A A . 51 SER CB 1 1 11 8441 1 1 49 SER H H 6.668 4.662 -0.526 1.00 . A A . 51 SER H 1 1 11 8442 1 1 49 SER HA H 7.959 7.318 -0.269 1.00 . A A . 51 SER HA 1 1 11 8443 1 1 49 SER HB2 H 6.898 6.044 1.948 1.00 . A A . 51 SER HB2 1 1 11 8444 1 1 49 SER HB3 H 8.600 5.601 2.005 1.00 . A A . 51 SER HB3 1 1 11 8445 1 1 49 SER HG H 8.821 8.013 1.472 1.00 . A A . 51 SER HG 1 1 11 8446 1 1 49 SER N N 6.704 5.635 -0.435 1.00 . A A . 51 SER N 1 1 11 8447 1 1 49 SER O O 10.274 6.165 -0.383 1.00 . A A . 51 SER O 1 1 11 8448 1 1 49 SER OG O 8.195 7.620 2.085 1.00 . A A . 51 SER OG 1 1 11 8449 1 1 50 HIS C C 10.081 2.137 -1.410 1.00 . A A . 52 HIS C 1 1 11 8450 1 1 50 HIS CA C 10.388 3.611 -1.122 1.00 . A A . 52 HIS CA 1 1 11 8451 1 1 50 HIS CB C 11.431 3.739 0.005 1.00 . A A . 52 HIS CB 1 1 11 8452 1 1 50 HIS CD2 C 13.300 2.085 -0.839 1.00 . A A . 52 HIS CD2 1 1 11 8453 1 1 50 HIS CE1 C 13.235 0.676 0.806 1.00 . A A . 52 HIS CE1 1 1 11 8454 1 1 50 HIS CG C 12.344 2.538 0.036 1.00 . A A . 52 HIS CG 1 1 11 8455 1 1 50 HIS H H 8.291 3.838 -0.677 1.00 . A A . 52 HIS H 1 1 11 8456 1 1 50 HIS HA H 10.776 4.072 -2.019 1.00 . A A . 52 HIS HA 1 1 11 8457 1 1 50 HIS HB2 H 12.020 4.628 -0.157 1.00 . A A . 52 HIS HB2 1 1 11 8458 1 1 50 HIS HB3 H 10.918 3.821 0.954 1.00 . A A . 52 HIS HB3 1 1 11 8459 1 1 50 HIS HD1 H 11.746 1.663 1.871 1.00 . A A . 52 HIS HD1 1 1 11 8460 1 1 50 HIS HD2 H 13.578 2.568 -1.764 1.00 . A A . 52 HIS HD2 1 1 11 8461 1 1 50 HIS HE1 H 13.433 -0.172 1.445 1.00 . A A . 52 HIS HE1 1 1 11 8462 1 1 50 HIS N N 9.143 4.317 -0.704 1.00 . A A . 52 HIS N 1 1 11 8463 1 1 50 HIS ND1 N 12.321 1.623 1.078 1.00 . A A . 52 HIS ND1 1 1 11 8464 1 1 50 HIS NE2 N 13.861 0.908 -0.351 1.00 . A A . 52 HIS NE2 1 1 11 8465 1 1 50 HIS O O 9.911 1.338 -0.511 1.00 . A A . 52 HIS O 1 1 11 8466 1 1 51 PHE C C 10.742 -0.557 -2.298 1.00 . A A . 53 PHE C 1 1 11 8467 1 1 51 PHE CA C 9.749 0.357 -3.026 1.00 . A A . 53 PHE CA 1 1 11 8468 1 1 51 PHE CB C 9.923 0.187 -4.538 1.00 . A A . 53 PHE CB 1 1 11 8469 1 1 51 PHE CD1 C 7.409 0.329 -4.657 1.00 . A A . 53 PHE CD1 1 1 11 8470 1 1 51 PHE CD2 C 8.579 -1.045 -6.276 1.00 . A A . 53 PHE CD2 1 1 11 8471 1 1 51 PHE CE1 C 6.187 -0.018 -5.245 1.00 . A A . 53 PHE CE1 1 1 11 8472 1 1 51 PHE CE2 C 7.357 -1.391 -6.865 1.00 . A A . 53 PHE CE2 1 1 11 8473 1 1 51 PHE CG C 8.604 -0.185 -5.170 1.00 . A A . 53 PHE CG 1 1 11 8474 1 1 51 PHE CZ C 6.161 -0.877 -6.350 1.00 . A A . 53 PHE CZ 1 1 11 8475 1 1 51 PHE H H 10.178 2.440 -3.363 1.00 . A A . 53 PHE H 1 1 11 8476 1 1 51 PHE HA H 8.740 0.099 -2.744 1.00 . A A . 53 PHE HA 1 1 11 8477 1 1 51 PHE HB2 H 10.277 1.114 -4.965 1.00 . A A . 53 PHE HB2 1 1 11 8478 1 1 51 PHE HB3 H 10.644 -0.594 -4.730 1.00 . A A . 53 PHE HB3 1 1 11 8479 1 1 51 PHE HD1 H 7.429 0.992 -3.804 1.00 . A A . 53 PHE HD1 1 1 11 8480 1 1 51 PHE HD2 H 9.501 -1.440 -6.673 1.00 . A A . 53 PHE HD2 1 1 11 8481 1 1 51 PHE HE1 H 5.264 0.380 -4.849 1.00 . A A . 53 PHE HE1 1 1 11 8482 1 1 51 PHE HE2 H 7.337 -2.054 -7.718 1.00 . A A . 53 PHE HE2 1 1 11 8483 1 1 51 PHE HZ H 5.218 -1.145 -6.805 1.00 . A A . 53 PHE HZ 1 1 11 8484 1 1 51 PHE N N 10.026 1.776 -2.661 1.00 . A A . 53 PHE N 1 1 11 8485 1 1 51 PHE O O 11.901 -0.631 -2.651 1.00 . A A . 53 PHE O 1 1 11 8486 1 1 52 GLY C C 10.988 -2.009 0.962 1.00 . A A . 54 GLY C 1 1 11 8487 1 1 52 GLY CA C 11.224 -2.160 -0.544 1.00 . A A . 54 GLY CA 1 1 11 8488 1 1 52 GLY H H 9.360 -1.182 -1.015 1.00 . A A . 54 GLY H 1 1 11 8489 1 1 52 GLY HA2 H 11.037 -3.184 -0.840 1.00 . A A . 54 GLY HA2 1 1 11 8490 1 1 52 GLY HA3 H 12.247 -1.900 -0.773 1.00 . A A . 54 GLY HA3 1 1 11 8491 1 1 52 GLY N N 10.299 -1.253 -1.286 1.00 . A A . 54 GLY N 1 1 11 8492 1 1 52 GLY O O 10.362 -1.070 1.408 1.00 . A A . 54 GLY O 1 1 11 8493 1 1 53 LYS C C 12.084 -1.656 3.778 1.00 . A A . 55 LYS C 1 1 11 8494 1 1 53 LYS CA C 11.279 -2.835 3.224 1.00 . A A . 55 LYS CA 1 1 11 8495 1 1 53 LYS CB C 11.752 -4.130 3.889 1.00 . A A . 55 LYS CB 1 1 11 8496 1 1 53 LYS CD C 10.385 -3.341 5.833 1.00 . A A . 55 LYS CD 1 1 11 8497 1 1 53 LYS CE C 9.884 -4.019 7.112 1.00 . A A . 55 LYS CE 1 1 11 8498 1 1 53 LYS CG C 11.716 -3.969 5.411 1.00 . A A . 55 LYS CG 1 1 11 8499 1 1 53 LYS H H 11.983 -3.681 1.371 1.00 . A A . 55 LYS H 1 1 11 8500 1 1 53 LYS HA H 10.230 -2.686 3.433 1.00 . A A . 55 LYS HA 1 1 11 8501 1 1 53 LYS HB2 H 11.103 -4.943 3.597 1.00 . A A . 55 LYS HB2 1 1 11 8502 1 1 53 LYS HB3 H 12.763 -4.348 3.576 1.00 . A A . 55 LYS HB3 1 1 11 8503 1 1 53 LYS HD2 H 10.527 -2.286 6.017 1.00 . A A . 55 LYS HD2 1 1 11 8504 1 1 53 LYS HD3 H 9.656 -3.475 5.048 1.00 . A A . 55 LYS HD3 1 1 11 8505 1 1 53 LYS HE2 H 9.011 -3.498 7.478 1.00 . A A . 55 LYS HE2 1 1 11 8506 1 1 53 LYS HE3 H 9.628 -5.047 6.899 1.00 . A A . 55 LYS HE3 1 1 11 8507 1 1 53 LYS HG2 H 11.823 -4.938 5.876 1.00 . A A . 55 LYS HG2 1 1 11 8508 1 1 53 LYS HG3 H 12.528 -3.330 5.723 1.00 . A A . 55 LYS HG3 1 1 11 8509 1 1 53 LYS HZ1 H 10.581 -4.320 9.053 1.00 . A A . 55 LYS HZ1 1 1 11 8510 1 1 53 LYS HZ2 H 11.293 -2.999 8.256 1.00 . A A . 55 LYS HZ2 1 1 11 8511 1 1 53 LYS HZ3 H 11.748 -4.584 7.850 1.00 . A A . 55 LYS HZ3 1 1 11 8512 1 1 53 LYS N N 11.482 -2.930 1.749 1.00 . A A . 55 LYS N 1 1 11 8513 1 1 53 LYS NZ N 10.958 -3.978 8.146 1.00 . A A . 55 LYS NZ 1 1 11 8514 1 1 53 LYS O O 13.286 -1.587 3.622 1.00 . A A . 55 LYS O 1 1 11 8515 1 1 54 CYS C C 12.994 -0.014 6.194 1.00 . A A . 56 CYS C 1 1 11 8516 1 1 54 CYS CA C 12.171 0.439 4.985 1.00 . A A . 56 CYS CA 1 1 11 8517 1 1 54 CYS CB C 11.181 1.522 5.417 1.00 . A A . 56 CYS CB 1 1 11 8518 1 1 54 CYS H H 10.461 -0.798 4.545 1.00 . A A . 56 CYS H 1 1 11 8519 1 1 54 CYS HA H 12.833 0.838 4.231 1.00 . A A . 56 CYS HA 1 1 11 8520 1 1 54 CYS HB2 H 10.186 1.105 5.463 1.00 . A A . 56 CYS HB2 1 1 11 8521 1 1 54 CYS HB3 H 11.460 1.897 6.391 1.00 . A A . 56 CYS HB3 1 1 11 8522 1 1 54 CYS N N 11.432 -0.727 4.425 1.00 . A A . 56 CYS N 1 1 11 8523 1 1 54 CYS O O 12.395 -0.377 7.192 1.00 . A A . 56 CYS O 1 1 11 8524 1 1 54 CYS OXT O 14.211 0.011 6.099 1.00 . A A . 56 CYS OXT 1 1 11 8525 1 1 54 CYS SG S 11.211 2.879 4.217 1.00 . A A . 56 CYS SG 1 1 12 8526 1 1 1 ALA C C 6.738 9.409 -8.651 1.00 . A A . 3 ALA C 1 1 12 8527 1 1 1 ALA CA C 7.586 10.678 -8.749 1.00 . A A . 3 ALA CA 1 1 12 8528 1 1 1 ALA CB C 8.784 10.564 -7.803 1.00 . A A . 3 ALA CB 1 1 12 8529 1 1 1 ALA H1 H 5.763 11.670 -8.579 1.00 . A A . 3 ALA H1 1 1 12 8530 1 1 1 ALA H2 H 7.082 12.693 -8.900 1.00 . A A . 3 ALA H2 1 1 12 8531 1 1 1 ALA H3 H 6.867 12.039 -7.347 1.00 . A A . 3 ALA H3 1 1 12 8532 1 1 1 ALA HA H 7.938 10.800 -9.763 1.00 . A A . 3 ALA HA 1 1 12 8533 1 1 1 ALA HB1 H 9.509 11.328 -8.045 1.00 . A A . 3 ALA HB1 1 1 12 8534 1 1 1 ALA HB2 H 9.239 9.590 -7.914 1.00 . A A . 3 ALA HB2 1 1 12 8535 1 1 1 ALA HB3 H 8.452 10.692 -6.783 1.00 . A A . 3 ALA HB3 1 1 12 8536 1 1 1 ALA N N 6.762 11.859 -8.364 1.00 . A A . 3 ALA N 1 1 12 8537 1 1 1 ALA O O 5.766 9.356 -7.926 1.00 . A A . 3 ALA O 1 1 12 8538 1 1 2 VAL C C 4.878 7.382 -9.772 1.00 . A A . 4 VAL C 1 1 12 8539 1 1 2 VAL CA C 6.323 7.112 -9.331 1.00 . A A . 4 VAL CA 1 1 12 8540 1 1 2 VAL CB C 6.374 6.532 -7.900 1.00 . A A . 4 VAL CB 1 1 12 8541 1 1 2 VAL CG1 C 5.059 6.778 -7.143 1.00 . A A . 4 VAL CG1 1 1 12 8542 1 1 2 VAL CG2 C 6.628 5.025 -7.980 1.00 . A A . 4 VAL CG2 1 1 12 8543 1 1 2 VAL H H 7.892 8.451 -9.953 1.00 . A A . 4 VAL H 1 1 12 8544 1 1 2 VAL HA H 6.769 6.404 -10.015 1.00 . A A . 4 VAL HA 1 1 12 8545 1 1 2 VAL HB H 7.184 6.998 -7.361 1.00 . A A . 4 VAL HB 1 1 12 8546 1 1 2 VAL HG11 H 5.263 6.853 -6.086 1.00 . A A . 4 VAL HG11 1 1 12 8547 1 1 2 VAL HG12 H 4.383 5.956 -7.322 1.00 . A A . 4 VAL HG12 1 1 12 8548 1 1 2 VAL HG13 H 4.607 7.695 -7.487 1.00 . A A . 4 VAL HG13 1 1 12 8549 1 1 2 VAL HG21 H 6.973 4.667 -7.021 1.00 . A A . 4 VAL HG21 1 1 12 8550 1 1 2 VAL HG22 H 7.378 4.825 -8.731 1.00 . A A . 4 VAL HG22 1 1 12 8551 1 1 2 VAL HG23 H 5.712 4.519 -8.245 1.00 . A A . 4 VAL HG23 1 1 12 8552 1 1 2 VAL N N 7.102 8.384 -9.377 1.00 . A A . 4 VAL N 1 1 12 8553 1 1 2 VAL O O 4.386 8.489 -9.671 1.00 . A A . 4 VAL O 1 1 12 8554 1 1 3 SER C C 2.033 5.258 -10.665 1.00 . A A . 5 SER C 1 1 12 8555 1 1 3 SER CA C 2.791 6.588 -10.704 1.00 . A A . 5 SER CA 1 1 12 8556 1 1 3 SER CB C 2.783 7.133 -12.132 1.00 . A A . 5 SER CB 1 1 12 8557 1 1 3 SER H H 4.611 5.495 -10.335 1.00 . A A . 5 SER H 1 1 12 8558 1 1 3 SER HA H 2.306 7.295 -10.047 1.00 . A A . 5 SER HA 1 1 12 8559 1 1 3 SER HB2 H 2.738 6.315 -12.831 1.00 . A A . 5 SER HB2 1 1 12 8560 1 1 3 SER HB3 H 1.917 7.768 -12.268 1.00 . A A . 5 SER HB3 1 1 12 8561 1 1 3 SER HG H 4.237 7.744 -13.271 1.00 . A A . 5 SER HG 1 1 12 8562 1 1 3 SER N N 4.197 6.381 -10.260 1.00 . A A . 5 SER N 1 1 12 8563 1 1 3 SER O O 2.164 4.432 -11.546 1.00 . A A . 5 SER O 1 1 12 8564 1 1 3 SER OG O 3.972 7.877 -12.358 1.00 . A A . 5 SER OG 1 1 12 8565 1 1 4 VAL C C -1.034 4.096 -9.644 1.00 . A A . 6 VAL C 1 1 12 8566 1 1 4 VAL CA C 0.461 3.779 -9.564 1.00 . A A . 6 VAL CA 1 1 12 8567 1 1 4 VAL CB C 0.766 3.083 -8.236 1.00 . A A . 6 VAL CB 1 1 12 8568 1 1 4 VAL CG1 C 0.499 4.050 -7.080 1.00 . A A . 6 VAL CG1 1 1 12 8569 1 1 4 VAL CG2 C -0.133 1.853 -8.089 1.00 . A A . 6 VAL CG2 1 1 12 8570 1 1 4 VAL H H 1.138 5.731 -8.957 1.00 . A A . 6 VAL H 1 1 12 8571 1 1 4 VAL HA H 0.736 3.129 -10.383 1.00 . A A . 6 VAL HA 1 1 12 8572 1 1 4 VAL HB H 1.802 2.778 -8.219 1.00 . A A . 6 VAL HB 1 1 12 8573 1 1 4 VAL HG11 H 0.280 3.488 -6.184 1.00 . A A . 6 VAL HG11 1 1 12 8574 1 1 4 VAL HG12 H -0.343 4.681 -7.325 1.00 . A A . 6 VAL HG12 1 1 12 8575 1 1 4 VAL HG13 H 1.372 4.664 -6.916 1.00 . A A . 6 VAL HG13 1 1 12 8576 1 1 4 VAL HG21 H 0.274 1.038 -8.666 1.00 . A A . 6 VAL HG21 1 1 12 8577 1 1 4 VAL HG22 H -1.125 2.087 -8.447 1.00 . A A . 6 VAL HG22 1 1 12 8578 1 1 4 VAL HG23 H -0.186 1.567 -7.048 1.00 . A A . 6 VAL HG23 1 1 12 8579 1 1 4 VAL N N 1.235 5.049 -9.654 1.00 . A A . 6 VAL N 1 1 12 8580 1 1 4 VAL O O -1.492 5.100 -9.136 1.00 . A A . 6 VAL O 1 1 12 8581 1 1 5 ASP C C -4.035 2.525 -9.525 1.00 . A A . 7 ASP C 1 1 12 8582 1 1 5 ASP CA C -3.260 3.516 -10.398 1.00 . A A . 7 ASP CA 1 1 12 8583 1 1 5 ASP CB C -3.701 3.366 -11.860 1.00 . A A . 7 ASP CB 1 1 12 8584 1 1 5 ASP CG C -2.770 2.390 -12.588 1.00 . A A . 7 ASP CG 1 1 12 8585 1 1 5 ASP H H -1.409 2.450 -10.690 1.00 . A A . 7 ASP H 1 1 12 8586 1 1 5 ASP HA H -3.469 4.523 -10.066 1.00 . A A . 7 ASP HA 1 1 12 8587 1 1 5 ASP HB2 H -4.712 2.990 -11.893 1.00 . A A . 7 ASP HB2 1 1 12 8588 1 1 5 ASP HB3 H -3.658 4.328 -12.347 1.00 . A A . 7 ASP HB3 1 1 12 8589 1 1 5 ASP N N -1.797 3.253 -10.282 1.00 . A A . 7 ASP N 1 1 12 8590 1 1 5 ASP O O -4.382 1.443 -9.953 1.00 . A A . 7 ASP O 1 1 12 8591 1 1 5 ASP OD1 O -3.060 1.205 -12.576 1.00 . A A . 7 ASP OD1 1 1 12 8592 1 1 5 ASP OD2 O -1.785 2.846 -13.145 1.00 . A A . 7 ASP OD2 1 1 12 8593 1 1 6 CYS C C -6.498 2.495 -7.236 1.00 . A A . 8 CYS C 1 1 12 8594 1 1 6 CYS CA C -5.066 1.978 -7.396 1.00 . A A . 8 CYS CA 1 1 12 8595 1 1 6 CYS CB C -4.386 1.945 -6.027 1.00 . A A . 8 CYS CB 1 1 12 8596 1 1 6 CYS H H -4.023 3.771 -7.977 1.00 . A A . 8 CYS H 1 1 12 8597 1 1 6 CYS HA H -5.083 0.983 -7.816 1.00 . A A . 8 CYS HA 1 1 12 8598 1 1 6 CYS HB2 H -4.375 2.941 -5.607 1.00 . A A . 8 CYS HB2 1 1 12 8599 1 1 6 CYS HB3 H -4.931 1.285 -5.370 1.00 . A A . 8 CYS HB3 1 1 12 8600 1 1 6 CYS N N -4.311 2.891 -8.301 1.00 . A A . 8 CYS N 1 1 12 8601 1 1 6 CYS O O -7.132 2.303 -6.214 1.00 . A A . 8 CYS O 1 1 12 8602 1 1 6 CYS SG S -2.687 1.349 -6.208 1.00 . A A . 8 CYS SG 1 1 12 8603 1 1 7 SER C C -9.433 2.592 -8.415 1.00 . A A . 9 SER C 1 1 12 8604 1 1 7 SER CA C -8.399 3.697 -8.157 1.00 . A A . 9 SER CA 1 1 12 8605 1 1 7 SER CB C -8.570 4.799 -9.204 1.00 . A A . 9 SER CB 1 1 12 8606 1 1 7 SER H H -6.482 3.296 -9.053 1.00 . A A . 9 SER H 1 1 12 8607 1 1 7 SER HA H -8.559 4.114 -7.174 1.00 . A A . 9 SER HA 1 1 12 8608 1 1 7 SER HB2 H -9.020 4.387 -10.091 1.00 . A A . 9 SER HB2 1 1 12 8609 1 1 7 SER HB3 H -9.208 5.576 -8.805 1.00 . A A . 9 SER HB3 1 1 12 8610 1 1 7 SER HG H -7.210 5.333 -10.488 1.00 . A A . 9 SER HG 1 1 12 8611 1 1 7 SER N N -7.013 3.153 -8.242 1.00 . A A . 9 SER N 1 1 12 8612 1 1 7 SER O O -10.467 2.830 -9.005 1.00 . A A . 9 SER O 1 1 12 8613 1 1 7 SER OG O -7.295 5.335 -9.532 1.00 . A A . 9 SER OG 1 1 12 8614 1 1 8 GLU C C -9.954 -0.773 -7.114 1.00 . A A . 10 GLU C 1 1 12 8615 1 1 8 GLU CA C -10.154 0.295 -8.187 1.00 . A A . 10 GLU CA 1 1 12 8616 1 1 8 GLU CB C -9.947 -0.320 -9.573 1.00 . A A . 10 GLU CB 1 1 12 8617 1 1 8 GLU CD C -11.102 -1.296 -11.570 1.00 . A A . 10 GLU CD 1 1 12 8618 1 1 8 GLU CG C -11.304 -0.694 -10.176 1.00 . A A . 10 GLU CG 1 1 12 8619 1 1 8 GLU H H -8.346 1.212 -7.492 1.00 . A A . 10 GLU H 1 1 12 8620 1 1 8 GLU HA H -11.154 0.692 -8.113 1.00 . A A . 10 GLU HA 1 1 12 8621 1 1 8 GLU HB2 H -9.451 0.396 -10.214 1.00 . A A . 10 GLU HB2 1 1 12 8622 1 1 8 GLU HB3 H -9.337 -1.207 -9.486 1.00 . A A . 10 GLU HB3 1 1 12 8623 1 1 8 GLU HG2 H -11.793 -1.417 -9.539 1.00 . A A . 10 GLU HG2 1 1 12 8624 1 1 8 GLU HG3 H -11.919 0.190 -10.254 1.00 . A A . 10 GLU HG3 1 1 12 8625 1 1 8 GLU N N -9.175 1.392 -7.971 1.00 . A A . 10 GLU N 1 1 12 8626 1 1 8 GLU O O -10.356 -1.910 -7.271 1.00 . A A . 10 GLU O 1 1 12 8627 1 1 8 GLU OE1 O -10.824 -2.481 -11.647 1.00 . A A . 10 GLU OE1 1 1 12 8628 1 1 8 GLU OE2 O -11.233 -0.561 -12.534 1.00 . A A . 10 GLU OE2 1 1 12 8629 1 1 9 TYR C C -9.552 -0.837 -3.593 1.00 . A A . 11 TYR C 1 1 12 8630 1 1 9 TYR CA C -9.101 -1.416 -4.942 1.00 . A A . 11 TYR CA 1 1 12 8631 1 1 9 TYR CB C -7.611 -1.737 -4.878 1.00 . A A . 11 TYR CB 1 1 12 8632 1 1 9 TYR CD1 C -7.337 -2.768 -7.162 1.00 . A A . 11 TYR CD1 1 1 12 8633 1 1 9 TYR CD2 C -6.974 -4.156 -5.206 1.00 . A A . 11 TYR CD2 1 1 12 8634 1 1 9 TYR CE1 C -7.043 -3.858 -7.989 1.00 . A A . 11 TYR CE1 1 1 12 8635 1 1 9 TYR CE2 C -6.682 -5.246 -6.034 1.00 . A A . 11 TYR CE2 1 1 12 8636 1 1 9 TYR CG C -7.301 -2.917 -5.769 1.00 . A A . 11 TYR CG 1 1 12 8637 1 1 9 TYR CZ C -6.716 -5.096 -7.427 1.00 . A A . 11 TYR CZ 1 1 12 8638 1 1 9 TYR H H -9.008 0.500 -5.914 1.00 . A A . 11 TYR H 1 1 12 8639 1 1 9 TYR HA H -9.657 -2.318 -5.152 1.00 . A A . 11 TYR HA 1 1 12 8640 1 1 9 TYR HB2 H -7.045 -0.879 -5.208 1.00 . A A . 11 TYR HB2 1 1 12 8641 1 1 9 TYR HB3 H -7.342 -1.973 -3.863 1.00 . A A . 11 TYR HB3 1 1 12 8642 1 1 9 TYR HD1 H -7.590 -1.813 -7.597 1.00 . A A . 11 TYR HD1 1 1 12 8643 1 1 9 TYR HD2 H -6.947 -4.270 -4.133 1.00 . A A . 11 TYR HD2 1 1 12 8644 1 1 9 TYR HE1 H -7.071 -3.744 -9.063 1.00 . A A . 11 TYR HE1 1 1 12 8645 1 1 9 TYR HE2 H -6.428 -6.203 -5.600 1.00 . A A . 11 TYR HE2 1 1 12 8646 1 1 9 TYR HH H -5.627 -5.960 -8.736 1.00 . A A . 11 TYR HH 1 1 12 8647 1 1 9 TYR N N -9.331 -0.420 -6.021 1.00 . A A . 11 TYR N 1 1 12 8648 1 1 9 TYR O O -8.738 -0.610 -2.719 1.00 . A A . 11 TYR O 1 1 12 8649 1 1 9 TYR OH O -6.425 -6.169 -8.244 1.00 . A A . 11 TYR OH 1 1 12 8650 1 1 10 PRO C C -11.631 -1.156 -1.175 1.00 . A A . 12 PRO C 1 1 12 8651 1 1 10 PRO CA C -11.434 -0.060 -2.234 1.00 . A A . 12 PRO CA 1 1 12 8652 1 1 10 PRO CB C -12.791 0.471 -2.706 1.00 . A A . 12 PRO CB 1 1 12 8653 1 1 10 PRO CD C -11.813 -0.884 -4.538 1.00 . A A . 12 PRO CD 1 1 12 8654 1 1 10 PRO CG C -13.137 -0.307 -3.998 1.00 . A A . 12 PRO CG 1 1 12 8655 1 1 10 PRO HA H -10.836 0.748 -1.846 1.00 . A A . 12 PRO HA 1 1 12 8656 1 1 10 PRO HB2 H -13.542 0.293 -1.947 1.00 . A A . 12 PRO HB2 1 1 12 8657 1 1 10 PRO HB3 H -12.721 1.526 -2.923 1.00 . A A . 12 PRO HB3 1 1 12 8658 1 1 10 PRO HD2 H -11.906 -1.947 -4.709 1.00 . A A . 12 PRO HD2 1 1 12 8659 1 1 10 PRO HD3 H -11.521 -0.377 -5.441 1.00 . A A . 12 PRO HD3 1 1 12 8660 1 1 10 PRO HG2 H -13.829 -1.108 -3.772 1.00 . A A . 12 PRO HG2 1 1 12 8661 1 1 10 PRO HG3 H -13.569 0.358 -4.729 1.00 . A A . 12 PRO HG3 1 1 12 8662 1 1 10 PRO N N -10.837 -0.615 -3.464 1.00 . A A . 12 PRO N 1 1 12 8663 1 1 10 PRO O O -12.509 -1.067 -0.341 1.00 . A A . 12 PRO O 1 1 12 8664 1 1 11 LYS C C -9.691 -3.332 0.607 1.00 . A A . 13 LYS C 1 1 12 8665 1 1 11 LYS CA C -10.968 -3.264 -0.209 1.00 . A A . 13 LYS CA 1 1 12 8666 1 1 11 LYS CB C -11.209 -4.581 -0.955 1.00 . A A . 13 LYS CB 1 1 12 8667 1 1 11 LYS CD C -10.364 -5.647 -3.048 1.00 . A A . 13 LYS CD 1 1 12 8668 1 1 11 LYS CE C -9.210 -6.512 -3.554 1.00 . A A . 13 LYS CE 1 1 12 8669 1 1 11 LYS CG C -9.955 -4.959 -1.744 1.00 . A A . 13 LYS CG 1 1 12 8670 1 1 11 LYS H H -10.123 -2.259 -1.861 1.00 . A A . 13 LYS H 1 1 12 8671 1 1 11 LYS HA H -11.789 -3.076 0.449 1.00 . A A . 13 LYS HA 1 1 12 8672 1 1 11 LYS HB2 H -11.441 -5.362 -0.246 1.00 . A A . 13 LYS HB2 1 1 12 8673 1 1 11 LYS HB3 H -12.036 -4.460 -1.638 1.00 . A A . 13 LYS HB3 1 1 12 8674 1 1 11 LYS HD2 H -11.231 -6.267 -2.870 1.00 . A A . 13 LYS HD2 1 1 12 8675 1 1 11 LYS HD3 H -10.603 -4.900 -3.789 1.00 . A A . 13 LYS HD3 1 1 12 8676 1 1 11 LYS HE2 H -8.324 -5.904 -3.660 1.00 . A A . 13 LYS HE2 1 1 12 8677 1 1 11 LYS HE3 H -9.019 -7.305 -2.846 1.00 . A A . 13 LYS HE3 1 1 12 8678 1 1 11 LYS HG2 H -9.389 -4.068 -1.968 1.00 . A A . 13 LYS HG2 1 1 12 8679 1 1 11 LYS HG3 H -9.349 -5.634 -1.159 1.00 . A A . 13 LYS HG3 1 1 12 8680 1 1 11 LYS HZ1 H -9.630 -6.344 -5.586 1.00 . A A . 13 LYS HZ1 1 1 12 8681 1 1 11 LYS HZ2 H -10.493 -7.579 -4.799 1.00 . A A . 13 LYS HZ2 1 1 12 8682 1 1 11 LYS HZ3 H -8.846 -7.786 -5.160 1.00 . A A . 13 LYS HZ3 1 1 12 8683 1 1 11 LYS N N -10.827 -2.187 -1.197 1.00 . A A . 13 LYS N 1 1 12 8684 1 1 11 LYS NZ N -9.572 -7.100 -4.875 1.00 . A A . 13 LYS NZ 1 1 12 8685 1 1 11 LYS O O -9.053 -2.337 0.891 1.00 . A A . 13 LYS O 1 1 12 8686 1 1 12 CYS C C -8.001 -6.145 2.260 1.00 . A A . 14 CYS C 1 1 12 8687 1 1 12 CYS CA C -8.098 -4.689 1.795 1.00 . A A . 14 CYS CA 1 1 12 8688 1 1 12 CYS CB C -8.162 -3.776 3.022 1.00 . A A . 14 CYS CB 1 1 12 8689 1 1 12 CYS H H -9.883 -5.245 0.726 1.00 . A A . 14 CYS H 1 1 12 8690 1 1 12 CYS HA H -7.230 -4.438 1.203 1.00 . A A . 14 CYS HA 1 1 12 8691 1 1 12 CYS HB2 H -8.962 -3.062 2.896 1.00 . A A . 14 CYS HB2 1 1 12 8692 1 1 12 CYS HB3 H -8.346 -4.372 3.905 1.00 . A A . 14 CYS HB3 1 1 12 8693 1 1 12 CYS N N -9.332 -4.497 0.981 1.00 . A A . 14 CYS N 1 1 12 8694 1 1 12 CYS O O -8.176 -6.442 3.426 1.00 . A A . 14 CYS O 1 1 12 8695 1 1 12 CYS SG S -6.594 -2.894 3.207 1.00 . A A . 14 CYS SG 1 1 12 8696 1 1 13 ALA C C -6.645 -9.245 0.887 1.00 . A A . 15 ALA C 1 1 12 8697 1 1 13 ALA CA C -7.625 -8.489 1.791 1.00 . A A . 15 ALA CA 1 1 12 8698 1 1 13 ALA CB C -9.004 -9.144 1.699 1.00 . A A . 15 ALA CB 1 1 12 8699 1 1 13 ALA H H -7.584 -6.811 0.432 1.00 . A A . 15 ALA H 1 1 12 8700 1 1 13 ALA HA H -7.276 -8.536 2.812 1.00 . A A . 15 ALA HA 1 1 12 8701 1 1 13 ALA HB1 H -9.505 -9.064 2.652 1.00 . A A . 15 ALA HB1 1 1 12 8702 1 1 13 ALA HB2 H -8.889 -10.187 1.440 1.00 . A A . 15 ALA HB2 1 1 12 8703 1 1 13 ALA HB3 H -9.590 -8.647 0.941 1.00 . A A . 15 ALA HB3 1 1 12 8704 1 1 13 ALA N N -7.725 -7.061 1.370 1.00 . A A . 15 ALA N 1 1 12 8705 1 1 13 ALA O O -7.030 -10.131 0.150 1.00 . A A . 15 ALA O 1 1 12 8706 1 1 14 CYS C C -3.217 -10.118 0.931 1.00 . A A . 16 CYS C 1 1 12 8707 1 1 14 CYS CA C -4.398 -9.647 0.086 1.00 . A A . 16 CYS CA 1 1 12 8708 1 1 14 CYS CB C -3.874 -8.737 -1.019 1.00 . A A . 16 CYS CB 1 1 12 8709 1 1 14 CYS H H -5.078 -8.211 1.548 1.00 . A A . 16 CYS H 1 1 12 8710 1 1 14 CYS HA H -4.881 -10.505 -0.359 1.00 . A A . 16 CYS HA 1 1 12 8711 1 1 14 CYS HB2 H -3.492 -7.825 -0.585 1.00 . A A . 16 CYS HB2 1 1 12 8712 1 1 14 CYS HB3 H -3.081 -9.248 -1.546 1.00 . A A . 16 CYS HB3 1 1 12 8713 1 1 14 CYS N N -5.380 -8.920 0.942 1.00 . A A . 16 CYS N 1 1 12 8714 1 1 14 CYS O O -2.768 -9.438 1.833 1.00 . A A . 16 CYS O 1 1 12 8715 1 1 14 CYS SG S -5.211 -8.344 -2.174 1.00 . A A . 16 CYS SG 1 1 12 8716 1 1 15 THR C C -0.895 -12.945 0.599 1.00 . A A . 17 THR C 1 1 12 8717 1 1 15 THR CA C -1.546 -11.812 1.396 1.00 . A A . 17 THR CA 1 1 12 8718 1 1 15 THR CB C -2.022 -12.343 2.750 1.00 . A A . 17 THR CB 1 1 12 8719 1 1 15 THR CG2 C -3.157 -13.346 2.540 1.00 . A A . 17 THR CG2 1 1 12 8720 1 1 15 THR H H -3.088 -11.793 -0.110 1.00 . A A . 17 THR H 1 1 12 8721 1 1 15 THR HA H -0.826 -11.023 1.551 1.00 . A A . 17 THR HA 1 1 12 8722 1 1 15 THR HB H -2.379 -11.522 3.353 1.00 . A A . 17 THR HB 1 1 12 8723 1 1 15 THR HG1 H -0.496 -12.327 3.954 1.00 . A A . 17 THR HG1 1 1 12 8724 1 1 15 THR HG21 H -3.381 -13.420 1.487 1.00 . A A . 17 THR HG21 1 1 12 8725 1 1 15 THR HG22 H -4.036 -13.012 3.072 1.00 . A A . 17 THR HG22 1 1 12 8726 1 1 15 THR HG23 H -2.855 -14.312 2.913 1.00 . A A . 17 THR HG23 1 1 12 8727 1 1 15 THR N N -2.709 -11.278 0.632 1.00 . A A . 17 THR N 1 1 12 8728 1 1 15 THR O O -0.282 -13.834 1.156 1.00 . A A . 17 THR O 1 1 12 8729 1 1 15 THR OG1 O -0.940 -12.982 3.411 1.00 . A A . 17 THR OG1 1 1 12 8730 1 1 16 MET C C 0.951 -13.602 -2.022 1.00 . A A . 18 MET C 1 1 12 8731 1 1 16 MET CA C -0.436 -14.018 -1.522 1.00 . A A . 18 MET CA 1 1 12 8732 1 1 16 MET CB C -1.349 -14.315 -2.715 1.00 . A A . 18 MET CB 1 1 12 8733 1 1 16 MET CE C -4.656 -13.842 -4.152 1.00 . A A . 18 MET CE 1 1 12 8734 1 1 16 MET CG C -2.802 -14.392 -2.241 1.00 . A A . 18 MET CG 1 1 12 8735 1 1 16 MET H H -1.542 -12.211 -1.130 1.00 . A A . 18 MET H 1 1 12 8736 1 1 16 MET HA H -0.342 -14.905 -0.920 1.00 . A A . 18 MET HA 1 1 12 8737 1 1 16 MET HB2 H -1.252 -13.531 -3.450 1.00 . A A . 18 MET HB2 1 1 12 8738 1 1 16 MET HB3 H -1.066 -15.259 -3.156 1.00 . A A . 18 MET HB3 1 1 12 8739 1 1 16 MET HE1 H -5.668 -14.008 -3.808 1.00 . A A . 18 MET HE1 1 1 12 8740 1 1 16 MET HE2 H -4.188 -14.791 -4.357 1.00 . A A . 18 MET HE2 1 1 12 8741 1 1 16 MET HE3 H -4.671 -13.247 -5.056 1.00 . A A . 18 MET HE3 1 1 12 8742 1 1 16 MET HG2 H -3.252 -15.304 -2.607 1.00 . A A . 18 MET HG2 1 1 12 8743 1 1 16 MET HG3 H -2.828 -14.388 -1.161 1.00 . A A . 18 MET HG3 1 1 12 8744 1 1 16 MET N N -1.035 -12.930 -0.699 1.00 . A A . 18 MET N 1 1 12 8745 1 1 16 MET O O 1.960 -14.053 -1.520 1.00 . A A . 18 MET O 1 1 12 8746 1 1 16 MET SD S -3.721 -12.966 -2.872 1.00 . A A . 18 MET SD 1 1 12 8747 1 1 17 GLU C C 3.113 -11.593 -2.447 1.00 . A A . 19 GLU C 1 1 12 8748 1 1 17 GLU CA C 2.334 -12.321 -3.543 1.00 . A A . 19 GLU CA 1 1 12 8749 1 1 17 GLU CB C 2.124 -11.380 -4.731 1.00 . A A . 19 GLU CB 1 1 12 8750 1 1 17 GLU CD C 3.265 -10.197 -6.610 1.00 . A A . 19 GLU CD 1 1 12 8751 1 1 17 GLU CG C 3.480 -11.007 -5.331 1.00 . A A . 19 GLU CG 1 1 12 8752 1 1 17 GLU H H 0.186 -12.406 -3.405 1.00 . A A . 19 GLU H 1 1 12 8753 1 1 17 GLU HA H 2.892 -13.187 -3.865 1.00 . A A . 19 GLU HA 1 1 12 8754 1 1 17 GLU HB2 H 1.522 -11.876 -5.480 1.00 . A A . 19 GLU HB2 1 1 12 8755 1 1 17 GLU HB3 H 1.620 -10.485 -4.398 1.00 . A A . 19 GLU HB3 1 1 12 8756 1 1 17 GLU HG2 H 4.038 -10.417 -4.619 1.00 . A A . 19 GLU HG2 1 1 12 8757 1 1 17 GLU HG3 H 4.029 -11.906 -5.565 1.00 . A A . 19 GLU HG3 1 1 12 8758 1 1 17 GLU N N 1.011 -12.754 -3.011 1.00 . A A . 19 GLU N 1 1 12 8759 1 1 17 GLU O O 2.542 -10.929 -1.604 1.00 . A A . 19 GLU O 1 1 12 8760 1 1 17 GLU OE1 O 2.124 -9.875 -6.899 1.00 . A A . 19 GLU OE1 1 1 12 8761 1 1 17 GLU OE2 O 4.245 -9.913 -7.280 1.00 . A A . 19 GLU OE2 1 1 12 8762 1 1 18 TYR C C 5.968 -9.841 -2.007 1.00 . A A . 20 TYR C 1 1 12 8763 1 1 18 TYR CA C 5.221 -11.026 -1.399 1.00 . A A . 20 TYR CA 1 1 12 8764 1 1 18 TYR CB C 6.235 -11.992 -0.803 1.00 . A A . 20 TYR CB 1 1 12 8765 1 1 18 TYR CD1 C 5.549 -11.194 1.488 1.00 . A A . 20 TYR CD1 1 1 12 8766 1 1 18 TYR CD2 C 7.907 -11.498 1.014 1.00 . A A . 20 TYR CD2 1 1 12 8767 1 1 18 TYR CE1 C 5.863 -10.781 2.788 1.00 . A A . 20 TYR CE1 1 1 12 8768 1 1 18 TYR CE2 C 8.221 -11.086 2.314 1.00 . A A . 20 TYR CE2 1 1 12 8769 1 1 18 TYR CG C 6.572 -11.553 0.601 1.00 . A A . 20 TYR CG 1 1 12 8770 1 1 18 TYR CZ C 7.198 -10.728 3.201 1.00 . A A . 20 TYR CZ 1 1 12 8771 1 1 18 TYR H H 4.858 -12.254 -3.134 1.00 . A A . 20 TYR H 1 1 12 8772 1 1 18 TYR HA H 4.564 -10.673 -0.618 1.00 . A A . 20 TYR HA 1 1 12 8773 1 1 18 TYR HB2 H 5.822 -12.990 -0.784 1.00 . A A . 20 TYR HB2 1 1 12 8774 1 1 18 TYR HB3 H 7.128 -11.978 -1.404 1.00 . A A . 20 TYR HB3 1 1 12 8775 1 1 18 TYR HD1 H 4.518 -11.237 1.169 1.00 . A A . 20 TYR HD1 1 1 12 8776 1 1 18 TYR HD2 H 8.697 -11.774 0.330 1.00 . A A . 20 TYR HD2 1 1 12 8777 1 1 18 TYR HE1 H 5.074 -10.504 3.472 1.00 . A A . 20 TYR HE1 1 1 12 8778 1 1 18 TYR HE2 H 9.252 -11.043 2.633 1.00 . A A . 20 TYR HE2 1 1 12 8779 1 1 18 TYR HH H 8.235 -10.863 4.798 1.00 . A A . 20 TYR HH 1 1 12 8780 1 1 18 TYR N N 4.415 -11.713 -2.447 1.00 . A A . 20 TYR N 1 1 12 8781 1 1 18 TYR O O 6.904 -9.998 -2.765 1.00 . A A . 20 TYR O 1 1 12 8782 1 1 18 TYR OH O 7.509 -10.320 4.481 1.00 . A A . 20 TYR OH 1 1 12 8783 1 1 19 ARG C C 6.070 -6.314 -1.151 1.00 . A A . 21 ARG C 1 1 12 8784 1 1 19 ARG CA C 6.236 -7.437 -2.179 1.00 . A A . 21 ARG CA 1 1 12 8785 1 1 19 ARG CB C 5.592 -7.019 -3.503 1.00 . A A . 21 ARG CB 1 1 12 8786 1 1 19 ARG CD C 6.175 -7.945 -5.749 1.00 . A A . 21 ARG CD 1 1 12 8787 1 1 19 ARG CG C 6.644 -7.035 -4.614 1.00 . A A . 21 ARG CG 1 1 12 8788 1 1 19 ARG CZ C 7.390 -10.002 -6.149 1.00 . A A . 21 ARG CZ 1 1 12 8789 1 1 19 ARG H H 4.821 -8.577 -1.034 1.00 . A A . 21 ARG H 1 1 12 8790 1 1 19 ARG HA H 7.287 -7.637 -2.332 1.00 . A A . 21 ARG HA 1 1 12 8791 1 1 19 ARG HB2 H 4.797 -7.708 -3.751 1.00 . A A . 21 ARG HB2 1 1 12 8792 1 1 19 ARG HB3 H 5.188 -6.023 -3.408 1.00 . A A . 21 ARG HB3 1 1 12 8793 1 1 19 ARG HD2 H 5.105 -7.850 -5.867 1.00 . A A . 21 ARG HD2 1 1 12 8794 1 1 19 ARG HD3 H 6.665 -7.659 -6.668 1.00 . A A . 21 ARG HD3 1 1 12 8795 1 1 19 ARG HE H 6.082 -9.802 -4.666 1.00 . A A . 21 ARG HE 1 1 12 8796 1 1 19 ARG HG2 H 6.787 -6.033 -4.990 1.00 . A A . 21 ARG HG2 1 1 12 8797 1 1 19 ARG HG3 H 7.577 -7.407 -4.220 1.00 . A A . 21 ARG HG3 1 1 12 8798 1 1 19 ARG HH11 H 8.696 -8.483 -6.194 1.00 . A A . 21 ARG HH11 1 1 12 8799 1 1 19 ARG HH12 H 9.181 -9.913 -7.042 1.00 . A A . 21 ARG HH12 1 1 12 8800 1 1 19 ARG HH21 H 6.287 -11.668 -6.273 1.00 . A A . 21 ARG HH21 1 1 12 8801 1 1 19 ARG HH22 H 7.815 -11.717 -7.089 1.00 . A A . 21 ARG HH22 1 1 12 8802 1 1 19 ARG N N 5.565 -8.660 -1.657 1.00 . A A . 21 ARG N 1 1 12 8803 1 1 19 ARG NE N 6.515 -9.357 -5.424 1.00 . A A . 21 ARG NE 1 1 12 8804 1 1 19 ARG NH1 N 8.509 -9.420 -6.489 1.00 . A A . 21 ARG NH1 1 1 12 8805 1 1 19 ARG NH2 N 7.145 -11.224 -6.533 1.00 . A A . 21 ARG NH2 1 1 12 8806 1 1 19 ARG O O 5.099 -5.584 -1.183 1.00 . A A . 21 ARG O 1 1 12 8807 1 1 20 PRO C C 7.367 -3.820 0.254 1.00 . A A . 22 PRO C 1 1 12 8808 1 1 20 PRO CA C 7.014 -5.202 0.809 1.00 . A A . 22 PRO CA 1 1 12 8809 1 1 20 PRO CB C 8.081 -5.698 1.788 1.00 . A A . 22 PRO CB 1 1 12 8810 1 1 20 PRO CD C 8.203 -7.108 -0.241 1.00 . A A . 22 PRO CD 1 1 12 8811 1 1 20 PRO CG C 9.011 -6.636 0.982 1.00 . A A . 22 PRO CG 1 1 12 8812 1 1 20 PRO HA H 6.054 -5.178 1.297 1.00 . A A . 22 PRO HA 1 1 12 8813 1 1 20 PRO HB2 H 8.642 -4.860 2.178 1.00 . A A . 22 PRO HB2 1 1 12 8814 1 1 20 PRO HB3 H 7.621 -6.246 2.593 1.00 . A A . 22 PRO HB3 1 1 12 8815 1 1 20 PRO HD2 H 8.784 -6.990 -1.146 1.00 . A A . 22 PRO HD2 1 1 12 8816 1 1 20 PRO HD3 H 7.893 -8.133 -0.119 1.00 . A A . 22 PRO HD3 1 1 12 8817 1 1 20 PRO HG2 H 9.894 -6.097 0.664 1.00 . A A . 22 PRO HG2 1 1 12 8818 1 1 20 PRO HG3 H 9.290 -7.486 1.584 1.00 . A A . 22 PRO HG3 1 1 12 8819 1 1 20 PRO N N 7.023 -6.217 -0.260 1.00 . A A . 22 PRO N 1 1 12 8820 1 1 20 PRO O O 8.352 -3.647 -0.437 1.00 . A A . 22 PRO O 1 1 12 8821 1 1 21 LEU C C 6.798 -0.462 1.205 1.00 . A A . 23 LEU C 1 1 12 8822 1 1 21 LEU CA C 6.843 -1.461 0.046 1.00 . A A . 23 LEU CA 1 1 12 8823 1 1 21 LEU CB C 5.778 -1.076 -0.985 1.00 . A A . 23 LEU CB 1 1 12 8824 1 1 21 LEU CD1 C 4.740 -2.573 -2.695 1.00 . A A . 23 LEU CD1 1 1 12 8825 1 1 21 LEU CD2 C 6.422 -0.864 -3.384 1.00 . A A . 23 LEU CD2 1 1 12 8826 1 1 21 LEU CG C 6.021 -1.845 -2.283 1.00 . A A . 23 LEU CG 1 1 12 8827 1 1 21 LEU H H 5.773 -3.001 1.111 1.00 . A A . 23 LEU H 1 1 12 8828 1 1 21 LEU HA H 7.818 -1.436 -0.417 1.00 . A A . 23 LEU HA 1 1 12 8829 1 1 21 LEU HB2 H 4.799 -1.319 -0.599 1.00 . A A . 23 LEU HB2 1 1 12 8830 1 1 21 LEU HB3 H 5.834 -0.016 -1.181 1.00 . A A . 23 LEU HB3 1 1 12 8831 1 1 21 LEU HD11 H 4.357 -3.130 -1.853 1.00 . A A . 23 LEU HD11 1 1 12 8832 1 1 21 LEU HD12 H 4.959 -3.252 -3.506 1.00 . A A . 23 LEU HD12 1 1 12 8833 1 1 21 LEU HD13 H 4.004 -1.852 -3.017 1.00 . A A . 23 LEU HD13 1 1 12 8834 1 1 21 LEU HD21 H 7.464 -1.002 -3.627 1.00 . A A . 23 LEU HD21 1 1 12 8835 1 1 21 LEU HD22 H 6.264 0.148 -3.041 1.00 . A A . 23 LEU HD22 1 1 12 8836 1 1 21 LEU HD23 H 5.821 -1.044 -4.263 1.00 . A A . 23 LEU HD23 1 1 12 8837 1 1 21 LEU HG H 6.810 -2.564 -2.133 1.00 . A A . 23 LEU HG 1 1 12 8838 1 1 21 LEU N N 6.564 -2.835 0.553 1.00 . A A . 23 LEU N 1 1 12 8839 1 1 21 LEU O O 5.890 -0.477 2.012 1.00 . A A . 23 LEU O 1 1 12 8840 1 1 22 CYS C C 6.971 2.653 1.923 1.00 . A A . 24 CYS C 1 1 12 8841 1 1 22 CYS CA C 7.750 1.423 2.389 1.00 . A A . 24 CYS CA 1 1 12 8842 1 1 22 CYS CB C 9.184 1.834 2.753 1.00 . A A . 24 CYS CB 1 1 12 8843 1 1 22 CYS H H 8.479 0.424 0.621 1.00 . A A . 24 CYS H 1 1 12 8844 1 1 22 CYS HA H 7.266 0.999 3.256 1.00 . A A . 24 CYS HA 1 1 12 8845 1 1 22 CYS HB2 H 9.503 2.641 2.112 1.00 . A A . 24 CYS HB2 1 1 12 8846 1 1 22 CYS HB3 H 9.212 2.159 3.780 1.00 . A A . 24 CYS HB3 1 1 12 8847 1 1 22 CYS N N 7.760 0.418 1.286 1.00 . A A . 24 CYS N 1 1 12 8848 1 1 22 CYS O O 7.542 3.633 1.478 1.00 . A A . 24 CYS O 1 1 12 8849 1 1 22 CYS SG S 10.295 0.428 2.537 1.00 . A A . 24 CYS SG 1 1 12 8850 1 1 23 GLY C C 5.431 5.055 2.122 1.00 . A A . 25 GLY C 1 1 12 8851 1 1 23 GLY CA C 4.838 3.758 1.572 1.00 . A A . 25 GLY CA 1 1 12 8852 1 1 23 GLY H H 5.235 1.799 2.362 1.00 . A A . 25 GLY H 1 1 12 8853 1 1 23 GLY HA2 H 4.820 3.798 0.492 1.00 . A A . 25 GLY HA2 1 1 12 8854 1 1 23 GLY HA3 H 3.833 3.641 1.944 1.00 . A A . 25 GLY HA3 1 1 12 8855 1 1 23 GLY N N 5.668 2.603 2.011 1.00 . A A . 25 GLY N 1 1 12 8856 1 1 23 GLY O O 6.067 5.066 3.158 1.00 . A A . 25 GLY O 1 1 12 8857 1 1 24 SER C C 5.426 7.690 3.370 1.00 . A A . 26 SER C 1 1 12 8858 1 1 24 SER CA C 5.778 7.455 1.900 1.00 . A A . 26 SER CA 1 1 12 8859 1 1 24 SER CB C 5.182 8.584 1.061 1.00 . A A . 26 SER CB 1 1 12 8860 1 1 24 SER H H 4.710 6.110 0.599 1.00 . A A . 26 SER H 1 1 12 8861 1 1 24 SER HA H 6.852 7.453 1.783 1.00 . A A . 26 SER HA 1 1 12 8862 1 1 24 SER HB2 H 5.773 8.729 0.172 1.00 . A A . 26 SER HB2 1 1 12 8863 1 1 24 SER HB3 H 4.169 8.325 0.781 1.00 . A A . 26 SER HB3 1 1 12 8864 1 1 24 SER HG H 4.654 10.434 1.360 1.00 . A A . 26 SER HG 1 1 12 8865 1 1 24 SER N N 5.227 6.148 1.432 1.00 . A A . 26 SER N 1 1 12 8866 1 1 24 SER O O 6.048 8.488 4.041 1.00 . A A . 26 SER O 1 1 12 8867 1 1 24 SER OG O 5.183 9.783 1.826 1.00 . A A . 26 SER OG 1 1 12 8868 1 1 25 ASP C C 4.886 6.292 6.194 1.00 . A A . 27 ASP C 1 1 12 8869 1 1 25 ASP CA C 4.056 7.218 5.308 1.00 . A A . 27 ASP CA 1 1 12 8870 1 1 25 ASP CB C 2.569 6.910 5.498 1.00 . A A . 27 ASP CB 1 1 12 8871 1 1 25 ASP CG C 2.323 5.417 5.283 1.00 . A A . 27 ASP CG 1 1 12 8872 1 1 25 ASP H H 3.942 6.375 3.326 1.00 . A A . 27 ASP H 1 1 12 8873 1 1 25 ASP HA H 4.247 8.244 5.583 1.00 . A A . 27 ASP HA 1 1 12 8874 1 1 25 ASP HB2 H 2.271 7.184 6.500 1.00 . A A . 27 ASP HB2 1 1 12 8875 1 1 25 ASP HB3 H 1.991 7.476 4.783 1.00 . A A . 27 ASP HB3 1 1 12 8876 1 1 25 ASP N N 4.434 7.013 3.879 1.00 . A A . 27 ASP N 1 1 12 8877 1 1 25 ASP O O 4.476 5.915 7.274 1.00 . A A . 27 ASP O 1 1 12 8878 1 1 25 ASP OD1 O 3.103 4.805 4.573 1.00 . A A . 27 ASP OD1 1 1 12 8879 1 1 25 ASP OD2 O 1.357 4.912 5.831 1.00 . A A . 27 ASP OD2 1 1 12 8880 1 1 26 ASN C C 6.119 3.760 6.913 1.00 . A A . 28 ASN C 1 1 12 8881 1 1 26 ASN CA C 6.911 5.017 6.559 1.00 . A A . 28 ASN CA 1 1 12 8882 1 1 26 ASN CB C 7.335 5.734 7.842 1.00 . A A . 28 ASN CB 1 1 12 8883 1 1 26 ASN CG C 8.856 5.665 7.988 1.00 . A A . 28 ASN CG 1 1 12 8884 1 1 26 ASN H H 6.358 6.232 4.872 1.00 . A A . 28 ASN H 1 1 12 8885 1 1 26 ASN HA H 7.787 4.745 5.990 1.00 . A A . 28 ASN HA 1 1 12 8886 1 1 26 ASN HB2 H 7.024 6.769 7.796 1.00 . A A . 28 ASN HB2 1 1 12 8887 1 1 26 ASN HB3 H 6.871 5.257 8.692 1.00 . A A . 28 ASN HB3 1 1 12 8888 1 1 26 ASN HD21 H 8.798 4.284 9.412 1.00 . A A . 28 ASN HD21 1 1 12 8889 1 1 26 ASN HD22 H 10.353 4.795 8.961 1.00 . A A . 28 ASN HD22 1 1 12 8890 1 1 26 ASN N N 6.051 5.920 5.745 1.00 . A A . 28 ASN N 1 1 12 8891 1 1 26 ASN ND2 N 9.379 4.846 8.860 1.00 . A A . 28 ASN ND2 1 1 12 8892 1 1 26 ASN O O 6.288 3.183 7.969 1.00 . A A . 28 ASN O 1 1 12 8893 1 1 26 ASN OD1 O 9.576 6.363 7.301 1.00 . A A . 28 ASN OD1 1 1 12 8894 1 1 27 LYS C C 4.881 0.985 5.396 1.00 . A A . 29 LYS C 1 1 12 8895 1 1 27 LYS CA C 4.447 2.114 6.326 1.00 . A A . 29 LYS CA 1 1 12 8896 1 1 27 LYS CB C 2.967 2.419 6.104 1.00 . A A . 29 LYS CB 1 1 12 8897 1 1 27 LYS CD C 2.200 1.059 8.050 1.00 . A A . 29 LYS CD 1 1 12 8898 1 1 27 LYS CE C 0.802 1.242 8.645 1.00 . A A . 29 LYS CE 1 1 12 8899 1 1 27 LYS CG C 2.134 1.213 6.529 1.00 . A A . 29 LYS CG 1 1 12 8900 1 1 27 LYS H H 5.128 3.812 5.190 1.00 . A A . 29 LYS H 1 1 12 8901 1 1 27 LYS HA H 4.603 1.815 7.351 1.00 . A A . 29 LYS HA 1 1 12 8902 1 1 27 LYS HB2 H 2.684 3.278 6.694 1.00 . A A . 29 LYS HB2 1 1 12 8903 1 1 27 LYS HB3 H 2.795 2.624 5.058 1.00 . A A . 29 LYS HB3 1 1 12 8904 1 1 27 LYS HD2 H 2.569 0.074 8.295 1.00 . A A . 29 LYS HD2 1 1 12 8905 1 1 27 LYS HD3 H 2.863 1.804 8.459 1.00 . A A . 29 LYS HD3 1 1 12 8906 1 1 27 LYS HE2 H 0.879 1.760 9.590 1.00 . A A . 29 LYS HE2 1 1 12 8907 1 1 27 LYS HE3 H 0.194 1.821 7.966 1.00 . A A . 29 LYS HE3 1 1 12 8908 1 1 27 LYS HG2 H 1.109 1.360 6.222 1.00 . A A . 29 LYS HG2 1 1 12 8909 1 1 27 LYS HG3 H 2.527 0.322 6.061 1.00 . A A . 29 LYS HG3 1 1 12 8910 1 1 27 LYS HZ1 H -0.828 0.029 9.097 1.00 . A A . 29 LYS HZ1 1 1 12 8911 1 1 27 LYS HZ2 H 0.661 -0.583 9.638 1.00 . A A . 29 LYS HZ2 1 1 12 8912 1 1 27 LYS HZ3 H 0.258 -0.657 7.989 1.00 . A A . 29 LYS HZ3 1 1 12 8913 1 1 27 LYS N N 5.251 3.331 6.038 1.00 . A A . 29 LYS N 1 1 12 8914 1 1 27 LYS NZ N 0.176 -0.093 8.859 1.00 . A A . 29 LYS NZ 1 1 12 8915 1 1 27 LYS O O 5.385 1.219 4.320 1.00 . A A . 29 LYS O 1 1 12 8916 1 1 28 THR C C 3.853 -2.109 4.432 1.00 . A A . 30 THR C 1 1 12 8917 1 1 28 THR CA C 5.102 -1.376 4.928 1.00 . A A . 30 THR CA 1 1 12 8918 1 1 28 THR CB C 5.981 -2.341 5.723 1.00 . A A . 30 THR CB 1 1 12 8919 1 1 28 THR CG2 C 6.303 -3.563 4.863 1.00 . A A . 30 THR CG2 1 1 12 8920 1 1 28 THR H H 4.287 -0.411 6.674 1.00 . A A . 30 THR H 1 1 12 8921 1 1 28 THR HA H 5.656 -0.998 4.082 1.00 . A A . 30 THR HA 1 1 12 8922 1 1 28 THR HB H 5.458 -2.658 6.611 1.00 . A A . 30 THR HB 1 1 12 8923 1 1 28 THR HG1 H 7.472 -2.041 6.934 1.00 . A A . 30 THR HG1 1 1 12 8924 1 1 28 THR HG21 H 5.975 -4.458 5.371 1.00 . A A . 30 THR HG21 1 1 12 8925 1 1 28 THR HG22 H 7.370 -3.613 4.696 1.00 . A A . 30 THR HG22 1 1 12 8926 1 1 28 THR HG23 H 5.795 -3.479 3.914 1.00 . A A . 30 THR HG23 1 1 12 8927 1 1 28 THR N N 4.694 -0.239 5.800 1.00 . A A . 30 THR N 1 1 12 8928 1 1 28 THR O O 2.981 -2.462 5.202 1.00 . A A . 30 THR O 1 1 12 8929 1 1 28 THR OG1 O 7.186 -1.685 6.090 1.00 . A A . 30 THR OG1 1 1 12 8930 1 1 29 TYR C C 2.937 -4.463 2.222 1.00 . A A . 31 TYR C 1 1 12 8931 1 1 29 TYR CA C 2.566 -3.028 2.603 1.00 . A A . 31 TYR CA 1 1 12 8932 1 1 29 TYR CB C 2.087 -2.273 1.367 1.00 . A A . 31 TYR CB 1 1 12 8933 1 1 29 TYR CD1 C 0.193 -0.869 2.261 1.00 . A A . 31 TYR CD1 1 1 12 8934 1 1 29 TYR CD2 C 2.292 0.214 1.712 1.00 . A A . 31 TYR CD2 1 1 12 8935 1 1 29 TYR CE1 C -0.339 0.365 2.656 1.00 . A A . 31 TYR CE1 1 1 12 8936 1 1 29 TYR CE2 C 1.761 1.447 2.107 1.00 . A A . 31 TYR CE2 1 1 12 8937 1 1 29 TYR CG C 1.509 -0.944 1.789 1.00 . A A . 31 TYR CG 1 1 12 8938 1 1 29 TYR CZ C 0.445 1.523 2.579 1.00 . A A . 31 TYR CZ 1 1 12 8939 1 1 29 TYR H H 4.461 -2.032 2.544 1.00 . A A . 31 TYR H 1 1 12 8940 1 1 29 TYR HA H 1.780 -3.042 3.344 1.00 . A A . 31 TYR HA 1 1 12 8941 1 1 29 TYR HB2 H 2.923 -2.107 0.702 1.00 . A A . 31 TYR HB2 1 1 12 8942 1 1 29 TYR HB3 H 1.337 -2.851 0.864 1.00 . A A . 31 TYR HB3 1 1 12 8943 1 1 29 TYR HD1 H -0.413 -1.762 2.319 1.00 . A A . 31 TYR HD1 1 1 12 8944 1 1 29 TYR HD2 H 3.307 0.155 1.347 1.00 . A A . 31 TYR HD2 1 1 12 8945 1 1 29 TYR HE1 H -1.355 0.423 3.019 1.00 . A A . 31 TYR HE1 1 1 12 8946 1 1 29 TYR HE2 H 2.366 2.339 2.047 1.00 . A A . 31 TYR HE2 1 1 12 8947 1 1 29 TYR HH H 0.284 2.954 3.833 1.00 . A A . 31 TYR HH 1 1 12 8948 1 1 29 TYR N N 3.755 -2.331 3.150 1.00 . A A . 31 TYR N 1 1 12 8949 1 1 29 TYR O O 4.022 -4.727 1.738 1.00 . A A . 31 TYR O 1 1 12 8950 1 1 29 TYR OH O -0.078 2.740 2.970 1.00 . A A . 31 TYR OH 1 1 12 8951 1 1 30 GLY C C 2.545 -6.944 0.583 1.00 . A A . 32 GLY C 1 1 12 8952 1 1 30 GLY CA C 2.331 -6.812 2.092 1.00 . A A . 32 GLY CA 1 1 12 8953 1 1 30 GLY H H 1.174 -5.151 2.827 1.00 . A A . 32 GLY H 1 1 12 8954 1 1 30 GLY HA2 H 3.223 -7.134 2.611 1.00 . A A . 32 GLY HA2 1 1 12 8955 1 1 30 GLY HA3 H 1.498 -7.432 2.388 1.00 . A A . 32 GLY HA3 1 1 12 8956 1 1 30 GLY N N 2.041 -5.390 2.436 1.00 . A A . 32 GLY N 1 1 12 8957 1 1 30 GLY O O 3.255 -7.813 0.120 1.00 . A A . 32 GLY O 1 1 12 8958 1 1 31 ASN C C 1.399 -4.966 -2.298 1.00 . A A . 33 ASN C 1 1 12 8959 1 1 31 ASN CA C 2.105 -6.157 -1.661 1.00 . A A . 33 ASN CA 1 1 12 8960 1 1 31 ASN CB C 1.495 -7.458 -2.191 1.00 . A A . 33 ASN CB 1 1 12 8961 1 1 31 ASN CG C 0.251 -7.809 -1.373 1.00 . A A . 33 ASN CG 1 1 12 8962 1 1 31 ASN H H 1.371 -5.392 0.205 1.00 . A A . 33 ASN H 1 1 12 8963 1 1 31 ASN HA H 3.153 -6.124 -1.908 1.00 . A A . 33 ASN HA 1 1 12 8964 1 1 31 ASN HB2 H 1.220 -7.328 -3.228 1.00 . A A . 33 ASN HB2 1 1 12 8965 1 1 31 ASN HB3 H 2.216 -8.256 -2.105 1.00 . A A . 33 ASN HB3 1 1 12 8966 1 1 31 ASN HD21 H 0.925 -9.603 -0.852 1.00 . A A . 33 ASN HD21 1 1 12 8967 1 1 31 ASN HD22 H -0.609 -9.202 -0.250 1.00 . A A . 33 ASN HD22 1 1 12 8968 1 1 31 ASN N N 1.938 -6.086 -0.187 1.00 . A A . 33 ASN N 1 1 12 8969 1 1 31 ASN ND2 N 0.183 -8.967 -0.775 1.00 . A A . 33 ASN ND2 1 1 12 8970 1 1 31 ASN O O 0.795 -4.158 -1.624 1.00 . A A . 33 ASN O 1 1 12 8971 1 1 31 ASN OD1 O -0.670 -7.021 -1.278 1.00 . A A . 33 ASN OD1 1 1 12 8972 1 1 32 LYS C C -0.688 -3.748 -4.004 1.00 . A A . 34 LYS C 1 1 12 8973 1 1 32 LYS CA C 0.816 -3.707 -4.274 1.00 . A A . 34 LYS CA 1 1 12 8974 1 1 32 LYS CB C 1.074 -3.793 -5.780 1.00 . A A . 34 LYS CB 1 1 12 8975 1 1 32 LYS CD C -0.135 -4.756 -7.738 1.00 . A A . 34 LYS CD 1 1 12 8976 1 1 32 LYS CE C -1.326 -5.673 -8.024 1.00 . A A . 34 LYS CE 1 1 12 8977 1 1 32 LYS CG C 0.421 -5.055 -6.345 1.00 . A A . 34 LYS CG 1 1 12 8978 1 1 32 LYS H H 1.976 -5.505 -4.108 1.00 . A A . 34 LYS H 1 1 12 8979 1 1 32 LYS HA H 1.216 -2.782 -3.892 1.00 . A A . 34 LYS HA 1 1 12 8980 1 1 32 LYS HB2 H 0.658 -2.924 -6.266 1.00 . A A . 34 LYS HB2 1 1 12 8981 1 1 32 LYS HB3 H 2.138 -3.831 -5.960 1.00 . A A . 34 LYS HB3 1 1 12 8982 1 1 32 LYS HD2 H -0.456 -3.725 -7.783 1.00 . A A . 34 LYS HD2 1 1 12 8983 1 1 32 LYS HD3 H 0.633 -4.927 -8.477 1.00 . A A . 34 LYS HD3 1 1 12 8984 1 1 32 LYS HE2 H -1.318 -5.959 -9.066 1.00 . A A . 34 LYS HE2 1 1 12 8985 1 1 32 LYS HE3 H -1.255 -6.558 -7.407 1.00 . A A . 34 LYS HE3 1 1 12 8986 1 1 32 LYS HG2 H 1.157 -5.843 -6.410 1.00 . A A . 34 LYS HG2 1 1 12 8987 1 1 32 LYS HG3 H -0.385 -5.366 -5.696 1.00 . A A . 34 LYS HG3 1 1 12 8988 1 1 32 LYS HZ1 H -3.071 -5.418 -6.917 1.00 . A A . 34 LYS HZ1 1 1 12 8989 1 1 32 LYS HZ2 H -3.214 -4.973 -8.551 1.00 . A A . 34 LYS HZ2 1 1 12 8990 1 1 32 LYS HZ3 H -2.380 -3.968 -7.465 1.00 . A A . 34 LYS HZ3 1 1 12 8991 1 1 32 LYS N N 1.477 -4.847 -3.590 1.00 . A A . 34 LYS N 1 1 12 8992 1 1 32 LYS NZ N -2.593 -4.954 -7.716 1.00 . A A . 34 LYS NZ 1 1 12 8993 1 1 32 LYS O O -1.388 -2.774 -4.203 1.00 . A A . 34 LYS O 1 1 12 8994 1 1 33 CYS C C -2.900 -4.192 -1.925 1.00 . A A . 35 CYS C 1 1 12 8995 1 1 33 CYS CA C -2.649 -4.925 -3.238 1.00 . A A . 35 CYS CA 1 1 12 8996 1 1 33 CYS CB C -3.096 -6.381 -3.105 1.00 . A A . 35 CYS CB 1 1 12 8997 1 1 33 CYS H H -0.612 -5.630 -3.363 1.00 . A A . 35 CYS H 1 1 12 8998 1 1 33 CYS HA H -3.204 -4.444 -4.032 1.00 . A A . 35 CYS HA 1 1 12 8999 1 1 33 CYS HB2 H -2.924 -6.898 -4.037 1.00 . A A . 35 CYS HB2 1 1 12 9000 1 1 33 CYS HB3 H -2.532 -6.860 -2.317 1.00 . A A . 35 CYS HB3 1 1 12 9001 1 1 33 CYS N N -1.191 -4.856 -3.535 1.00 . A A . 35 CYS N 1 1 12 9002 1 1 33 CYS O O -3.914 -3.548 -1.735 1.00 . A A . 35 CYS O 1 1 12 9003 1 1 33 CYS SG S -4.860 -6.426 -2.701 1.00 . A A . 35 CYS SG 1 1 12 9004 1 1 34 ASN C C -1.728 -2.105 0.068 1.00 . A A . 36 ASN C 1 1 12 9005 1 1 34 ASN CA C -2.111 -3.569 0.274 1.00 . A A . 36 ASN CA 1 1 12 9006 1 1 34 ASN CB C -1.182 -4.210 1.304 1.00 . A A . 36 ASN CB 1 1 12 9007 1 1 34 ASN CG C -1.941 -4.425 2.615 1.00 . A A . 36 ASN CG 1 1 12 9008 1 1 34 ASN H H -1.145 -4.779 -1.210 1.00 . A A . 36 ASN H 1 1 12 9009 1 1 34 ASN HA H -3.136 -3.635 0.611 1.00 . A A . 36 ASN HA 1 1 12 9010 1 1 34 ASN HB2 H -0.835 -5.162 0.929 1.00 . A A . 36 ASN HB2 1 1 12 9011 1 1 34 ASN HB3 H -0.338 -3.563 1.478 1.00 . A A . 36 ASN HB3 1 1 12 9012 1 1 34 ASN HD21 H -2.883 -6.044 1.958 1.00 . A A . 36 ASN HD21 1 1 12 9013 1 1 34 ASN HD22 H -3.254 -5.583 3.549 1.00 . A A . 36 ASN HD22 1 1 12 9014 1 1 34 ASN N N -1.962 -4.270 -1.023 1.00 . A A . 36 ASN N 1 1 12 9015 1 1 34 ASN ND2 N -2.761 -5.435 2.716 1.00 . A A . 36 ASN ND2 1 1 12 9016 1 1 34 ASN O O -2.198 -1.221 0.755 1.00 . A A . 36 ASN O 1 1 12 9017 1 1 34 ASN OD1 O -1.785 -3.670 3.554 1.00 . A A . 36 ASN OD1 1 1 12 9018 1 1 35 PHE C C -1.630 0.255 -1.888 1.00 . A A . 37 PHE C 1 1 12 9019 1 1 35 PHE CA C -0.473 -0.451 -1.183 1.00 . A A . 37 PHE CA 1 1 12 9020 1 1 35 PHE CB C 0.760 -0.457 -2.094 1.00 . A A . 37 PHE CB 1 1 12 9021 1 1 35 PHE CD1 C 2.231 1.449 -1.334 1.00 . A A . 37 PHE CD1 1 1 12 9022 1 1 35 PHE CD2 C 0.819 1.766 -3.280 1.00 . A A . 37 PHE CD2 1 1 12 9023 1 1 35 PHE CE1 C 2.713 2.757 -1.471 1.00 . A A . 37 PHE CE1 1 1 12 9024 1 1 35 PHE CE2 C 1.301 3.074 -3.416 1.00 . A A . 37 PHE CE2 1 1 12 9025 1 1 35 PHE CG C 1.284 0.953 -2.239 1.00 . A A . 37 PHE CG 1 1 12 9026 1 1 35 PHE CZ C 2.247 3.568 -2.512 1.00 . A A . 37 PHE CZ 1 1 12 9027 1 1 35 PHE H H -0.535 -2.581 -1.444 1.00 . A A . 37 PHE H 1 1 12 9028 1 1 35 PHE HA H -0.245 0.058 -0.258 1.00 . A A . 37 PHE HA 1 1 12 9029 1 1 35 PHE HB2 H 1.526 -1.088 -1.666 1.00 . A A . 37 PHE HB2 1 1 12 9030 1 1 35 PHE HB3 H 0.485 -0.838 -3.067 1.00 . A A . 37 PHE HB3 1 1 12 9031 1 1 35 PHE HD1 H 2.590 0.823 -0.531 1.00 . A A . 37 PHE HD1 1 1 12 9032 1 1 35 PHE HD2 H 0.089 1.384 -3.978 1.00 . A A . 37 PHE HD2 1 1 12 9033 1 1 35 PHE HE1 H 3.443 3.140 -0.773 1.00 . A A . 37 PHE HE1 1 1 12 9034 1 1 35 PHE HE2 H 0.942 3.699 -4.219 1.00 . A A . 37 PHE HE2 1 1 12 9035 1 1 35 PHE HZ H 2.617 4.577 -2.617 1.00 . A A . 37 PHE HZ 1 1 12 9036 1 1 35 PHE N N -0.885 -1.850 -0.896 1.00 . A A . 37 PHE N 1 1 12 9037 1 1 35 PHE O O -1.827 1.444 -1.745 1.00 . A A . 37 PHE O 1 1 12 9038 1 1 36 CYS C C -4.719 0.298 -2.371 1.00 . A A . 38 CYS C 1 1 12 9039 1 1 36 CYS CA C -3.559 0.130 -3.353 1.00 . A A . 38 CYS CA 1 1 12 9040 1 1 36 CYS CB C -3.991 -0.786 -4.500 1.00 . A A . 38 CYS CB 1 1 12 9041 1 1 36 CYS H H -2.225 -1.440 -2.731 1.00 . A A . 38 CYS H 1 1 12 9042 1 1 36 CYS HA H -3.274 1.094 -3.746 1.00 . A A . 38 CYS HA 1 1 12 9043 1 1 36 CYS HB2 H -4.012 -1.808 -4.153 1.00 . A A . 38 CYS HB2 1 1 12 9044 1 1 36 CYS HB3 H -4.976 -0.501 -4.837 1.00 . A A . 38 CYS HB3 1 1 12 9045 1 1 36 CYS N N -2.403 -0.481 -2.640 1.00 . A A . 38 CYS N 1 1 12 9046 1 1 36 CYS O O -5.609 1.100 -2.574 1.00 . A A . 38 CYS O 1 1 12 9047 1 1 36 CYS SG S -2.815 -0.637 -5.869 1.00 . A A . 38 CYS SG 1 1 12 9048 1 1 37 CYS C C -5.600 0.936 0.517 1.00 . A A . 39 CYS C 1 1 12 9049 1 1 37 CYS CA C -5.810 -0.334 -0.302 1.00 . A A . 39 CYS CA 1 1 12 9050 1 1 37 CYS CB C -5.787 -1.554 0.624 1.00 . A A . 39 CYS CB 1 1 12 9051 1 1 37 CYS H H -3.982 -1.090 -1.153 1.00 . A A . 39 CYS H 1 1 12 9052 1 1 37 CYS HA H -6.757 -0.282 -0.811 1.00 . A A . 39 CYS HA 1 1 12 9053 1 1 37 CYS HB2 H -6.160 -2.416 0.091 1.00 . A A . 39 CYS HB2 1 1 12 9054 1 1 37 CYS HB3 H -4.774 -1.742 0.947 1.00 . A A . 39 CYS HB3 1 1 12 9055 1 1 37 CYS N N -4.713 -0.452 -1.301 1.00 . A A . 39 CYS N 1 1 12 9056 1 1 37 CYS O O -6.509 1.716 0.723 1.00 . A A . 39 CYS O 1 1 12 9057 1 1 37 CYS SG S -6.834 -1.245 2.069 1.00 . A A . 39 CYS SG 1 1 12 9058 1 1 38 ALA C C -4.208 3.591 0.863 1.00 . A A . 40 ALA C 1 1 12 9059 1 1 38 ALA CA C -4.128 2.371 1.781 1.00 . A A . 40 ALA CA 1 1 12 9060 1 1 38 ALA CB C -2.730 2.277 2.395 1.00 . A A . 40 ALA CB 1 1 12 9061 1 1 38 ALA H H -3.687 0.509 0.795 1.00 . A A . 40 ALA H 1 1 12 9062 1 1 38 ALA HA H -4.864 2.462 2.566 1.00 . A A . 40 ALA HA 1 1 12 9063 1 1 38 ALA HB1 H -2.392 3.264 2.675 1.00 . A A . 40 ALA HB1 1 1 12 9064 1 1 38 ALA HB2 H -2.048 1.853 1.674 1.00 . A A . 40 ALA HB2 1 1 12 9065 1 1 38 ALA HB3 H -2.764 1.647 3.272 1.00 . A A . 40 ALA HB3 1 1 12 9066 1 1 38 ALA N N -4.404 1.151 0.980 1.00 . A A . 40 ALA N 1 1 12 9067 1 1 38 ALA O O -4.473 4.694 1.298 1.00 . A A . 40 ALA O 1 1 12 9068 1 1 39 VAL C C -5.524 4.964 -1.511 1.00 . A A . 41 VAL C 1 1 12 9069 1 1 39 VAL CA C -4.064 4.538 -1.358 1.00 . A A . 41 VAL CA 1 1 12 9070 1 1 39 VAL CB C -3.509 4.108 -2.717 1.00 . A A . 41 VAL CB 1 1 12 9071 1 1 39 VAL CG1 C -3.760 5.210 -3.748 1.00 . A A . 41 VAL CG1 1 1 12 9072 1 1 39 VAL CG2 C -2.005 3.858 -2.593 1.00 . A A . 41 VAL CG2 1 1 12 9073 1 1 39 VAL H H -3.785 2.495 -0.739 1.00 . A A . 41 VAL H 1 1 12 9074 1 1 39 VAL HA H -3.486 5.364 -0.975 1.00 . A A . 41 VAL HA 1 1 12 9075 1 1 39 VAL HB H -4.002 3.200 -3.035 1.00 . A A . 41 VAL HB 1 1 12 9076 1 1 39 VAL HG11 H -3.646 4.805 -4.742 1.00 . A A . 41 VAL HG11 1 1 12 9077 1 1 39 VAL HG12 H -3.047 6.008 -3.601 1.00 . A A . 41 VAL HG12 1 1 12 9078 1 1 39 VAL HG13 H -4.761 5.596 -3.629 1.00 . A A . 41 VAL HG13 1 1 12 9079 1 1 39 VAL HG21 H -1.466 4.735 -2.920 1.00 . A A . 41 VAL HG21 1 1 12 9080 1 1 39 VAL HG22 H -1.728 3.015 -3.209 1.00 . A A . 41 VAL HG22 1 1 12 9081 1 1 39 VAL HG23 H -1.759 3.648 -1.562 1.00 . A A . 41 VAL HG23 1 1 12 9082 1 1 39 VAL N N -3.991 3.395 -0.409 1.00 . A A . 41 VAL N 1 1 12 9083 1 1 39 VAL O O -5.830 6.130 -1.664 1.00 . A A . 41 VAL O 1 1 12 9084 1 1 40 VAL C C -8.386 4.861 -0.244 1.00 . A A . 42 VAL C 1 1 12 9085 1 1 40 VAL CA C -7.871 4.369 -1.597 1.00 . A A . 42 VAL CA 1 1 12 9086 1 1 40 VAL CB C -8.659 3.131 -2.037 1.00 . A A . 42 VAL CB 1 1 12 9087 1 1 40 VAL CG1 C -10.154 3.452 -2.062 1.00 . A A . 42 VAL CG1 1 1 12 9088 1 1 40 VAL CG2 C -8.205 2.716 -3.438 1.00 . A A . 42 VAL CG2 1 1 12 9089 1 1 40 VAL H H -6.155 3.092 -1.333 1.00 . A A . 42 VAL H 1 1 12 9090 1 1 40 VAL HA H -7.987 5.152 -2.333 1.00 . A A . 42 VAL HA 1 1 12 9091 1 1 40 VAL HB H -8.477 2.321 -1.344 1.00 . A A . 42 VAL HB 1 1 12 9092 1 1 40 VAL HG11 H -10.633 3.008 -1.202 1.00 . A A . 42 VAL HG11 1 1 12 9093 1 1 40 VAL HG12 H -10.593 3.049 -2.964 1.00 . A A . 42 VAL HG12 1 1 12 9094 1 1 40 VAL HG13 H -10.295 4.522 -2.041 1.00 . A A . 42 VAL HG13 1 1 12 9095 1 1 40 VAL HG21 H -7.889 3.590 -3.987 1.00 . A A . 42 VAL HG21 1 1 12 9096 1 1 40 VAL HG22 H -9.026 2.242 -3.956 1.00 . A A . 42 VAL HG22 1 1 12 9097 1 1 40 VAL HG23 H -7.380 2.023 -3.360 1.00 . A A . 42 VAL HG23 1 1 12 9098 1 1 40 VAL N N -6.428 4.024 -1.464 1.00 . A A . 42 VAL N 1 1 12 9099 1 1 40 VAL O O -9.401 5.525 -0.155 1.00 . A A . 42 VAL O 1 1 12 9100 1 1 41 GLU C C -7.726 6.473 2.332 1.00 . A A . 43 GLU C 1 1 12 9101 1 1 41 GLU CA C -8.115 5.004 2.161 1.00 . A A . 43 GLU CA 1 1 12 9102 1 1 41 GLU CB C -7.419 4.160 3.231 1.00 . A A . 43 GLU CB 1 1 12 9103 1 1 41 GLU CD C -8.715 2.924 4.976 1.00 . A A . 43 GLU CD 1 1 12 9104 1 1 41 GLU CG C -8.254 2.909 3.517 1.00 . A A . 43 GLU CG 1 1 12 9105 1 1 41 GLU H H -6.863 4.020 0.713 1.00 . A A . 43 GLU H 1 1 12 9106 1 1 41 GLU HA H -9.187 4.898 2.254 1.00 . A A . 43 GLU HA 1 1 12 9107 1 1 41 GLU HB2 H -6.439 3.867 2.877 1.00 . A A . 43 GLU HB2 1 1 12 9108 1 1 41 GLU HB3 H -7.316 4.737 4.136 1.00 . A A . 43 GLU HB3 1 1 12 9109 1 1 41 GLU HG2 H -9.115 2.897 2.866 1.00 . A A . 43 GLU HG2 1 1 12 9110 1 1 41 GLU HG3 H -7.655 2.029 3.339 1.00 . A A . 43 GLU HG3 1 1 12 9111 1 1 41 GLU N N -7.682 4.549 0.811 1.00 . A A . 43 GLU N 1 1 12 9112 1 1 41 GLU O O -8.386 7.226 3.021 1.00 . A A . 43 GLU O 1 1 12 9113 1 1 41 GLU OE1 O -8.153 3.682 5.748 1.00 . A A . 43 GLU OE1 1 1 12 9114 1 1 41 GLU OE2 O -9.624 2.176 5.295 1.00 . A A . 43 GLU OE2 1 1 12 9115 1 1 42 SER C C -6.933 9.128 0.723 1.00 . A A . 44 SER C 1 1 12 9116 1 1 42 SER CA C -6.228 8.304 1.807 1.00 . A A . 44 SER CA 1 1 12 9117 1 1 42 SER CB C -4.714 8.392 1.610 1.00 . A A . 44 SER CB 1 1 12 9118 1 1 42 SER H H -6.152 6.259 1.144 1.00 . A A . 44 SER H 1 1 12 9119 1 1 42 SER HA H -6.490 8.690 2.782 1.00 . A A . 44 SER HA 1 1 12 9120 1 1 42 SER HB2 H -4.376 7.553 1.025 1.00 . A A . 44 SER HB2 1 1 12 9121 1 1 42 SER HB3 H -4.472 9.310 1.090 1.00 . A A . 44 SER HB3 1 1 12 9122 1 1 42 SER HG H -4.716 8.580 3.551 1.00 . A A . 44 SER HG 1 1 12 9123 1 1 42 SER N N -6.662 6.884 1.699 1.00 . A A . 44 SER N 1 1 12 9124 1 1 42 SER O O -6.775 10.330 0.643 1.00 . A A . 44 SER O 1 1 12 9125 1 1 42 SER OG O -4.066 8.366 2.878 1.00 . A A . 44 SER OG 1 1 12 9126 1 1 43 ASN C C -7.414 9.671 -2.250 1.00 . A A . 45 ASN C 1 1 12 9127 1 1 43 ASN CA C -8.422 9.228 -1.188 1.00 . A A . 45 ASN CA 1 1 12 9128 1 1 43 ASN CB C -9.115 10.455 -0.593 1.00 . A A . 45 ASN CB 1 1 12 9129 1 1 43 ASN CG C -10.229 10.917 -1.534 1.00 . A A . 45 ASN CG 1 1 12 9130 1 1 43 ASN H H -7.820 7.518 -0.029 1.00 . A A . 45 ASN H 1 1 12 9131 1 1 43 ASN HA H -9.159 8.582 -1.641 1.00 . A A . 45 ASN HA 1 1 12 9132 1 1 43 ASN HB2 H -9.536 10.197 0.369 1.00 . A A . 45 ASN HB2 1 1 12 9133 1 1 43 ASN HB3 H -8.395 11.251 -0.471 1.00 . A A . 45 ASN HB3 1 1 12 9134 1 1 43 ASN HD21 H -9.028 12.064 -2.621 1.00 . A A . 45 ASN HD21 1 1 12 9135 1 1 43 ASN HD22 H -10.654 12.046 -3.110 1.00 . A A . 45 ASN HD22 1 1 12 9136 1 1 43 ASN N N -7.708 8.487 -0.110 1.00 . A A . 45 ASN N 1 1 12 9137 1 1 43 ASN ND2 N -9.948 11.744 -2.502 1.00 . A A . 45 ASN ND2 1 1 12 9138 1 1 43 ASN O O -7.713 10.483 -3.102 1.00 . A A . 45 ASN O 1 1 12 9139 1 1 43 ASN OD1 O -11.368 10.520 -1.385 1.00 . A A . 45 ASN OD1 1 1 12 9140 1 1 44 GLY C C -4.151 10.439 -2.571 1.00 . A A . 46 GLY C 1 1 12 9141 1 1 44 GLY CA C -5.197 9.527 -3.218 1.00 . A A . 46 GLY CA 1 1 12 9142 1 1 44 GLY H H -6.003 8.483 -1.514 1.00 . A A . 46 GLY H 1 1 12 9143 1 1 44 GLY HA2 H -4.715 8.638 -3.598 1.00 . A A . 46 GLY HA2 1 1 12 9144 1 1 44 GLY HA3 H -5.674 10.054 -4.030 1.00 . A A . 46 GLY HA3 1 1 12 9145 1 1 44 GLY N N -6.223 9.139 -2.208 1.00 . A A . 46 GLY N 1 1 12 9146 1 1 44 GLY O O -3.248 10.923 -3.224 1.00 . A A . 46 GLY O 1 1 12 9147 1 1 45 THR C C -2.118 10.711 -0.070 1.00 . A A . 47 THR C 1 1 12 9148 1 1 45 THR CA C -3.272 11.559 -0.612 1.00 . A A . 47 THR CA 1 1 12 9149 1 1 45 THR CB C -3.953 12.298 0.541 1.00 . A A . 47 THR CB 1 1 12 9150 1 1 45 THR CG2 C -4.841 13.410 -0.020 1.00 . A A . 47 THR CG2 1 1 12 9151 1 1 45 THR H H -4.999 10.279 -0.781 1.00 . A A . 47 THR H 1 1 12 9152 1 1 45 THR HA H -2.885 12.277 -1.320 1.00 . A A . 47 THR HA 1 1 12 9153 1 1 45 THR HB H -3.204 12.732 1.185 1.00 . A A . 47 THR HB 1 1 12 9154 1 1 45 THR HG1 H -4.272 11.172 2.095 1.00 . A A . 47 THR HG1 1 1 12 9155 1 1 45 THR HG21 H -4.733 14.298 0.586 1.00 . A A . 47 THR HG21 1 1 12 9156 1 1 45 THR HG22 H -5.872 13.088 -0.008 1.00 . A A . 47 THR HG22 1 1 12 9157 1 1 45 THR HG23 H -4.544 13.629 -1.035 1.00 . A A . 47 THR HG23 1 1 12 9158 1 1 45 THR N N -4.264 10.678 -1.293 1.00 . A A . 47 THR N 1 1 12 9159 1 1 45 THR O O -1.262 11.195 0.643 1.00 . A A . 47 THR O 1 1 12 9160 1 1 45 THR OG1 O -4.745 11.384 1.287 1.00 . A A . 47 THR OG1 1 1 12 9161 1 1 46 LEU C C -0.022 8.290 -1.064 1.00 . A A . 48 LEU C 1 1 12 9162 1 1 46 LEU CA C -0.991 8.571 0.088 1.00 . A A . 48 LEU CA 1 1 12 9163 1 1 46 LEU CB C -1.589 7.257 0.597 1.00 . A A . 48 LEU CB 1 1 12 9164 1 1 46 LEU CD1 C 0.257 6.665 2.174 1.00 . A A . 48 LEU CD1 1 1 12 9165 1 1 46 LEU CD2 C -1.067 4.862 1.065 1.00 . A A . 48 LEU CD2 1 1 12 9166 1 1 46 LEU CG C -0.468 6.259 0.891 1.00 . A A . 48 LEU CG 1 1 12 9167 1 1 46 LEU H H -2.789 9.082 -0.982 1.00 . A A . 48 LEU H 1 1 12 9168 1 1 46 LEU HA H -0.465 9.065 0.891 1.00 . A A . 48 LEU HA 1 1 12 9169 1 1 46 LEU HB2 H -2.148 7.445 1.502 1.00 . A A . 48 LEU HB2 1 1 12 9170 1 1 46 LEU HB3 H -2.246 6.845 -0.153 1.00 . A A . 48 LEU HB3 1 1 12 9171 1 1 46 LEU HD11 H 0.725 5.797 2.614 1.00 . A A . 48 LEU HD11 1 1 12 9172 1 1 46 LEU HD12 H -0.453 7.083 2.872 1.00 . A A . 48 LEU HD12 1 1 12 9173 1 1 46 LEU HD13 H 1.012 7.404 1.944 1.00 . A A . 48 LEU HD13 1 1 12 9174 1 1 46 LEU HD21 H -0.275 4.129 1.079 1.00 . A A . 48 LEU HD21 1 1 12 9175 1 1 46 LEU HD22 H -1.737 4.653 0.243 1.00 . A A . 48 LEU HD22 1 1 12 9176 1 1 46 LEU HD23 H -1.614 4.820 1.994 1.00 . A A . 48 LEU HD23 1 1 12 9177 1 1 46 LEU HG H 0.232 6.252 0.069 1.00 . A A . 48 LEU HG 1 1 12 9178 1 1 46 LEU N N -2.089 9.450 -0.404 1.00 . A A . 48 LEU N 1 1 12 9179 1 1 46 LEU O O -0.395 8.327 -2.221 1.00 . A A . 48 LEU O 1 1 12 9180 1 1 47 THR C C 3.154 6.624 -1.463 1.00 . A A . 49 THR C 1 1 12 9181 1 1 47 THR CA C 2.196 7.749 -1.863 1.00 . A A . 49 THR CA 1 1 12 9182 1 1 47 THR CB C 3.002 9.019 -2.150 1.00 . A A . 49 THR CB 1 1 12 9183 1 1 47 THR CG2 C 2.048 10.192 -2.379 1.00 . A A . 49 THR CG2 1 1 12 9184 1 1 47 THR H H 1.513 7.997 0.169 1.00 . A A . 49 THR H 1 1 12 9185 1 1 47 THR HA H 1.661 7.459 -2.754 1.00 . A A . 49 THR HA 1 1 12 9186 1 1 47 THR HB H 3.603 8.873 -3.034 1.00 . A A . 49 THR HB 1 1 12 9187 1 1 47 THR HG1 H 4.021 10.247 -1.038 1.00 . A A . 49 THR HG1 1 1 12 9188 1 1 47 THR HG21 H 1.550 10.436 -1.453 1.00 . A A . 49 THR HG21 1 1 12 9189 1 1 47 THR HG22 H 1.313 9.919 -3.121 1.00 . A A . 49 THR HG22 1 1 12 9190 1 1 47 THR HG23 H 2.607 11.049 -2.724 1.00 . A A . 49 THR HG23 1 1 12 9191 1 1 47 THR N N 1.221 8.017 -0.768 1.00 . A A . 49 THR N 1 1 12 9192 1 1 47 THR O O 2.869 5.819 -0.598 1.00 . A A . 49 THR O 1 1 12 9193 1 1 47 THR OG1 O 3.846 9.303 -1.044 1.00 . A A . 49 THR OG1 1 1 12 9194 1 1 48 LEU C C 6.577 6.194 -1.294 1.00 . A A . 50 LEU C 1 1 12 9195 1 1 48 LEU CA C 5.295 5.519 -1.788 1.00 . A A . 50 LEU CA 1 1 12 9196 1 1 48 LEU CB C 5.584 4.713 -3.060 1.00 . A A . 50 LEU CB 1 1 12 9197 1 1 48 LEU CD1 C 6.236 2.638 -1.823 1.00 . A A . 50 LEU CD1 1 1 12 9198 1 1 48 LEU CD2 C 7.115 3.051 -4.122 1.00 . A A . 50 LEU CD2 1 1 12 9199 1 1 48 LEU CG C 6.714 3.712 -2.801 1.00 . A A . 50 LEU CG 1 1 12 9200 1 1 48 LEU H H 4.486 7.238 -2.785 1.00 . A A . 50 LEU H 1 1 12 9201 1 1 48 LEU HA H 4.909 4.864 -1.022 1.00 . A A . 50 LEU HA 1 1 12 9202 1 1 48 LEU HB2 H 4.692 4.179 -3.356 1.00 . A A . 50 LEU HB2 1 1 12 9203 1 1 48 LEU HB3 H 5.878 5.386 -3.851 1.00 . A A . 50 LEU HB3 1 1 12 9204 1 1 48 LEU HD11 H 6.226 3.038 -0.822 1.00 . A A . 50 LEU HD11 1 1 12 9205 1 1 48 LEU HD12 H 6.907 1.791 -1.865 1.00 . A A . 50 LEU HD12 1 1 12 9206 1 1 48 LEU HD13 H 5.240 2.320 -2.094 1.00 . A A . 50 LEU HD13 1 1 12 9207 1 1 48 LEU HD21 H 7.301 3.813 -4.865 1.00 . A A . 50 LEU HD21 1 1 12 9208 1 1 48 LEU HD22 H 6.316 2.408 -4.459 1.00 . A A . 50 LEU HD22 1 1 12 9209 1 1 48 LEU HD23 H 8.010 2.466 -3.973 1.00 . A A . 50 LEU HD23 1 1 12 9210 1 1 48 LEU HG H 7.565 4.229 -2.383 1.00 . A A . 50 LEU HG 1 1 12 9211 1 1 48 LEU N N 4.290 6.574 -2.098 1.00 . A A . 50 LEU N 1 1 12 9212 1 1 48 LEU O O 6.805 7.362 -1.541 1.00 . A A . 50 LEU O 1 1 12 9213 1 1 49 SER C C 9.881 5.380 -0.650 1.00 . A A . 51 SER C 1 1 12 9214 1 1 49 SER CA C 8.660 6.102 -0.076 1.00 . A A . 51 SER CA 1 1 12 9215 1 1 49 SER CB C 8.685 6.004 1.448 1.00 . A A . 51 SER CB 1 1 12 9216 1 1 49 SER H H 7.209 4.544 -0.387 1.00 . A A . 51 SER H 1 1 12 9217 1 1 49 SER HA H 8.690 7.143 -0.367 1.00 . A A . 51 SER HA 1 1 12 9218 1 1 49 SER HB2 H 7.707 5.735 1.809 1.00 . A A . 51 SER HB2 1 1 12 9219 1 1 49 SER HB3 H 9.397 5.246 1.747 1.00 . A A . 51 SER HB3 1 1 12 9220 1 1 49 SER HG H 8.503 7.428 2.762 1.00 . A A . 51 SER HG 1 1 12 9221 1 1 49 SER N N 7.410 5.481 -0.588 1.00 . A A . 51 SER N 1 1 12 9222 1 1 49 SER O O 10.904 5.988 -0.897 1.00 . A A . 51 SER O 1 1 12 9223 1 1 49 SER OG O 9.056 7.263 1.995 1.00 . A A . 51 SER OG 1 1 12 9224 1 1 50 HIS C C 10.723 1.843 -1.219 1.00 . A A . 52 HIS C 1 1 12 9225 1 1 50 HIS CA C 10.954 3.350 -1.408 1.00 . A A . 52 HIS CA 1 1 12 9226 1 1 50 HIS CB C 12.238 3.821 -0.682 1.00 . A A . 52 HIS CB 1 1 12 9227 1 1 50 HIS CD2 C 14.120 1.986 -0.512 1.00 . A A . 52 HIS CD2 1 1 12 9228 1 1 50 HIS CE1 C 13.445 1.018 1.304 1.00 . A A . 52 HIS CE1 1 1 12 9229 1 1 50 HIS CG C 12.996 2.656 -0.096 1.00 . A A . 52 HIS CG 1 1 12 9230 1 1 50 HIS H H 8.963 3.612 -0.657 1.00 . A A . 52 HIS H 1 1 12 9231 1 1 50 HIS HA H 11.045 3.566 -2.463 1.00 . A A . 52 HIS HA 1 1 12 9232 1 1 50 HIS HB2 H 12.873 4.337 -1.384 1.00 . A A . 52 HIS HB2 1 1 12 9233 1 1 50 HIS HB3 H 11.965 4.500 0.113 1.00 . A A . 52 HIS HB3 1 1 12 9234 1 1 50 HIS HD1 H 11.814 2.267 1.615 1.00 . A A . 52 HIS HD1 1 1 12 9235 1 1 50 HIS HD2 H 14.700 2.228 -1.390 1.00 . A A . 52 HIS HD2 1 1 12 9236 1 1 50 HIS HE1 H 13.358 0.337 2.135 1.00 . A A . 52 HIS HE1 1 1 12 9237 1 1 50 HIS N N 9.791 4.092 -0.860 1.00 . A A . 52 HIS N 1 1 12 9238 1 1 50 HIS ND1 N 12.587 2.023 1.065 1.00 . A A . 52 HIS ND1 1 1 12 9239 1 1 50 HIS NE2 N 14.402 0.951 0.375 1.00 . A A . 52 HIS NE2 1 1 12 9240 1 1 50 HIS O O 10.616 1.351 -0.115 1.00 . A A . 52 HIS O 1 1 12 9241 1 1 51 PHE C C 11.262 -0.932 -1.049 1.00 . A A . 53 PHE C 1 1 12 9242 1 1 51 PHE CA C 10.444 -0.358 -2.215 1.00 . A A . 53 PHE CA 1 1 12 9243 1 1 51 PHE CB C 10.925 -0.997 -3.521 1.00 . A A . 53 PHE CB 1 1 12 9244 1 1 51 PHE CD1 C 9.068 -2.701 -3.524 1.00 . A A . 53 PHE CD1 1 1 12 9245 1 1 51 PHE CD2 C 9.443 -1.375 -5.519 1.00 . A A . 53 PHE CD2 1 1 12 9246 1 1 51 PHE CE1 C 8.013 -3.364 -4.163 1.00 . A A . 53 PHE CE1 1 1 12 9247 1 1 51 PHE CE2 C 8.388 -2.037 -6.158 1.00 . A A . 53 PHE CE2 1 1 12 9248 1 1 51 PHE CG C 9.783 -1.707 -4.203 1.00 . A A . 53 PHE CG 1 1 12 9249 1 1 51 PHE CZ C 7.673 -3.031 -5.480 1.00 . A A . 53 PHE CZ 1 1 12 9250 1 1 51 PHE H H 10.739 1.552 -3.166 1.00 . A A . 53 PHE H 1 1 12 9251 1 1 51 PHE HA H 9.395 -0.574 -2.069 1.00 . A A . 53 PHE HA 1 1 12 9252 1 1 51 PHE HB2 H 11.310 -0.228 -4.173 1.00 . A A . 53 PHE HB2 1 1 12 9253 1 1 51 PHE HB3 H 11.709 -1.707 -3.303 1.00 . A A . 53 PHE HB3 1 1 12 9254 1 1 51 PHE HD1 H 9.332 -2.957 -2.509 1.00 . A A . 53 PHE HD1 1 1 12 9255 1 1 51 PHE HD2 H 9.995 -0.607 -6.042 1.00 . A A . 53 PHE HD2 1 1 12 9256 1 1 51 PHE HE1 H 7.462 -4.131 -3.641 1.00 . A A . 53 PHE HE1 1 1 12 9257 1 1 51 PHE HE2 H 8.125 -1.780 -7.174 1.00 . A A . 53 PHE HE2 1 1 12 9258 1 1 51 PHE HZ H 6.860 -3.542 -5.973 1.00 . A A . 53 PHE HZ 1 1 12 9259 1 1 51 PHE N N 10.652 1.120 -2.297 1.00 . A A . 53 PHE N 1 1 12 9260 1 1 51 PHE O O 12.413 -0.591 -0.864 1.00 . A A . 53 PHE O 1 1 12 9261 1 1 52 GLY C C 10.546 -2.466 2.117 1.00 . A A . 54 GLY C 1 1 12 9262 1 1 52 GLY CA C 11.441 -2.399 0.876 1.00 . A A . 54 GLY CA 1 1 12 9263 1 1 52 GLY H H 9.756 -2.074 -0.430 1.00 . A A . 54 GLY H 1 1 12 9264 1 1 52 GLY HA2 H 11.767 -3.395 0.613 1.00 . A A . 54 GLY HA2 1 1 12 9265 1 1 52 GLY HA3 H 12.303 -1.784 1.093 1.00 . A A . 54 GLY HA3 1 1 12 9266 1 1 52 GLY N N 10.683 -1.806 -0.266 1.00 . A A . 54 GLY N 1 1 12 9267 1 1 52 GLY O O 9.387 -2.101 2.078 1.00 . A A . 54 GLY O 1 1 12 9268 1 1 53 LYS C C 10.434 -1.719 5.288 1.00 . A A . 55 LYS C 1 1 12 9269 1 1 53 LYS CA C 10.257 -3.000 4.463 1.00 . A A . 55 LYS CA 1 1 12 9270 1 1 53 LYS CB C 10.703 -4.205 5.292 1.00 . A A . 55 LYS CB 1 1 12 9271 1 1 53 LYS CD C 8.682 -5.669 5.287 1.00 . A A . 55 LYS CD 1 1 12 9272 1 1 53 LYS CE C 9.020 -7.109 5.673 1.00 . A A . 55 LYS CE 1 1 12 9273 1 1 53 LYS CG C 9.524 -4.706 6.125 1.00 . A A . 55 LYS CG 1 1 12 9274 1 1 53 LYS H H 12.010 -3.207 3.235 1.00 . A A . 55 LYS H 1 1 12 9275 1 1 53 LYS HA H 9.216 -3.114 4.200 1.00 . A A . 55 LYS HA 1 1 12 9276 1 1 53 LYS HB2 H 11.039 -4.991 4.631 1.00 . A A . 55 LYS HB2 1 1 12 9277 1 1 53 LYS HB3 H 11.508 -3.914 5.948 1.00 . A A . 55 LYS HB3 1 1 12 9278 1 1 53 LYS HD2 H 7.633 -5.483 5.472 1.00 . A A . 55 LYS HD2 1 1 12 9279 1 1 53 LYS HD3 H 8.896 -5.518 4.240 1.00 . A A . 55 LYS HD3 1 1 12 9280 1 1 53 LYS HE2 H 9.053 -7.722 4.784 1.00 . A A . 55 LYS HE2 1 1 12 9281 1 1 53 LYS HE3 H 9.982 -7.135 6.163 1.00 . A A . 55 LYS HE3 1 1 12 9282 1 1 53 LYS HG2 H 9.895 -5.217 7.000 1.00 . A A . 55 LYS HG2 1 1 12 9283 1 1 53 LYS HG3 H 8.915 -3.867 6.426 1.00 . A A . 55 LYS HG3 1 1 12 9284 1 1 53 LYS HZ1 H 7.503 -8.448 6.162 1.00 . A A . 55 LYS HZ1 1 1 12 9285 1 1 53 LYS HZ2 H 7.279 -6.886 6.792 1.00 . A A . 55 LYS HZ2 1 1 12 9286 1 1 53 LYS HZ3 H 8.423 -7.931 7.490 1.00 . A A . 55 LYS HZ3 1 1 12 9287 1 1 53 LYS N N 11.074 -2.923 3.221 1.00 . A A . 55 LYS N 1 1 12 9288 1 1 53 LYS NZ N 7.978 -7.634 6.599 1.00 . A A . 55 LYS NZ 1 1 12 9289 1 1 53 LYS O O 11.329 -1.618 6.105 1.00 . A A . 55 LYS O 1 1 12 9290 1 1 54 CYS C C 8.396 1.296 5.793 1.00 . A A . 56 CYS C 1 1 12 9291 1 1 54 CYS CA C 9.705 0.517 5.889 1.00 . A A . 56 CYS CA 1 1 12 9292 1 1 54 CYS CB C 10.857 1.403 5.374 1.00 . A A . 56 CYS CB 1 1 12 9293 1 1 54 CYS H H 8.862 -0.847 4.444 1.00 . A A . 56 CYS H 1 1 12 9294 1 1 54 CYS HA H 9.887 0.268 6.923 1.00 . A A . 56 CYS HA 1 1 12 9295 1 1 54 CYS HB2 H 10.465 2.359 5.070 1.00 . A A . 56 CYS HB2 1 1 12 9296 1 1 54 CYS HB3 H 11.566 1.554 6.175 1.00 . A A . 56 CYS HB3 1 1 12 9297 1 1 54 CYS N N 9.585 -0.745 5.097 1.00 . A A . 56 CYS N 1 1 12 9298 1 1 54 CYS O O 7.422 0.717 5.348 1.00 . A A . 56 CYS O 1 1 12 9299 1 1 54 CYS OXT O 8.389 2.458 6.167 1.00 . A A . 56 CYS OXT 1 1 12 9300 1 1 54 CYS SG S 11.706 0.632 3.970 1.00 . A A . 56 CYS SG 1 1 13 9301 1 1 1 ALA C C 1.682 9.157 -7.023 1.00 . A A . 3 ALA C 1 1 13 9302 1 1 1 ALA CA C 0.671 10.180 -6.502 1.00 . A A . 3 ALA CA 1 1 13 9303 1 1 1 ALA CB C -0.265 10.595 -7.639 1.00 . A A . 3 ALA CB 1 1 13 9304 1 1 1 ALA H1 H 1.485 11.313 -4.957 1.00 . A A . 3 ALA H1 1 1 13 9305 1 1 1 ALA H2 H 0.859 12.237 -6.238 1.00 . A A . 3 ALA H2 1 1 13 9306 1 1 1 ALA H3 H 2.341 11.422 -6.417 1.00 . A A . 3 ALA H3 1 1 13 9307 1 1 1 ALA HA H 0.093 9.739 -5.704 1.00 . A A . 3 ALA HA 1 1 13 9308 1 1 1 ALA HB1 H -0.706 9.716 -8.083 1.00 . A A . 3 ALA HB1 1 1 13 9309 1 1 1 ALA HB2 H 0.295 11.135 -8.387 1.00 . A A . 3 ALA HB2 1 1 13 9310 1 1 1 ALA HB3 H -1.047 11.230 -7.246 1.00 . A A . 3 ALA HB3 1 1 13 9311 1 1 1 ALA N N 1.394 11.378 -5.989 1.00 . A A . 3 ALA N 1 1 13 9312 1 1 1 ALA O O 1.700 8.017 -6.603 1.00 . A A . 3 ALA O 1 1 13 9313 1 1 2 VAL C C 2.816 7.512 -9.293 1.00 . A A . 4 VAL C 1 1 13 9314 1 1 2 VAL CA C 3.530 8.600 -8.486 1.00 . A A . 4 VAL CA 1 1 13 9315 1 1 2 VAL CB C 4.304 7.954 -7.334 1.00 . A A . 4 VAL CB 1 1 13 9316 1 1 2 VAL CG1 C 5.532 7.229 -7.887 1.00 . A A . 4 VAL CG1 1 1 13 9317 1 1 2 VAL CG2 C 4.756 9.035 -6.350 1.00 . A A . 4 VAL CG2 1 1 13 9318 1 1 2 VAL H H 2.494 10.476 -8.267 1.00 . A A . 4 VAL H 1 1 13 9319 1 1 2 VAL HA H 4.218 9.131 -9.128 1.00 . A A . 4 VAL HA 1 1 13 9320 1 1 2 VAL HB H 3.667 7.244 -6.825 1.00 . A A . 4 VAL HB 1 1 13 9321 1 1 2 VAL HG11 H 5.931 7.784 -8.723 1.00 . A A . 4 VAL HG11 1 1 13 9322 1 1 2 VAL HG12 H 5.250 6.240 -8.214 1.00 . A A . 4 VAL HG12 1 1 13 9323 1 1 2 VAL HG13 H 6.283 7.152 -7.114 1.00 . A A . 4 VAL HG13 1 1 13 9324 1 1 2 VAL HG21 H 4.115 9.901 -6.447 1.00 . A A . 4 VAL HG21 1 1 13 9325 1 1 2 VAL HG22 H 5.776 9.317 -6.567 1.00 . A A . 4 VAL HG22 1 1 13 9326 1 1 2 VAL HG23 H 4.694 8.653 -5.341 1.00 . A A . 4 VAL HG23 1 1 13 9327 1 1 2 VAL N N 2.524 9.553 -7.939 1.00 . A A . 4 VAL N 1 1 13 9328 1 1 2 VAL O O 1.765 7.034 -8.915 1.00 . A A . 4 VAL O 1 1 13 9329 1 1 3 SER C C 2.499 4.811 -10.384 1.00 . A A . 5 SER C 1 1 13 9330 1 1 3 SER CA C 2.734 6.063 -11.234 1.00 . A A . 5 SER CA 1 1 13 9331 1 1 3 SER CB C 3.647 5.718 -12.412 1.00 . A A . 5 SER CB 1 1 13 9332 1 1 3 SER H H 4.226 7.518 -10.690 1.00 . A A . 5 SER H 1 1 13 9333 1 1 3 SER HA H 1.788 6.427 -11.608 1.00 . A A . 5 SER HA 1 1 13 9334 1 1 3 SER HB2 H 3.291 4.827 -12.898 1.00 . A A . 5 SER HB2 1 1 13 9335 1 1 3 SER HB3 H 3.643 6.537 -13.119 1.00 . A A . 5 SER HB3 1 1 13 9336 1 1 3 SER HG H 5.427 4.950 -12.572 1.00 . A A . 5 SER HG 1 1 13 9337 1 1 3 SER N N 3.378 7.119 -10.402 1.00 . A A . 5 SER N 1 1 13 9338 1 1 3 SER O O 3.415 4.066 -10.094 1.00 . A A . 5 SER O 1 1 13 9339 1 1 3 SER OG O 4.967 5.496 -11.932 1.00 . A A . 5 SER OG 1 1 13 9340 1 1 4 VAL C C -0.210 2.628 -9.751 1.00 . A A . 6 VAL C 1 1 13 9341 1 1 4 VAL CA C 0.985 3.374 -9.153 1.00 . A A . 6 VAL CA 1 1 13 9342 1 1 4 VAL CB C 0.657 3.812 -7.724 1.00 . A A . 6 VAL CB 1 1 13 9343 1 1 4 VAL CG1 C -0.686 4.547 -7.709 1.00 . A A . 6 VAL CG1 1 1 13 9344 1 1 4 VAL CG2 C 0.573 2.580 -6.820 1.00 . A A . 6 VAL CG2 1 1 13 9345 1 1 4 VAL H H 0.557 5.190 -10.230 1.00 . A A . 6 VAL H 1 1 13 9346 1 1 4 VAL HA H 1.847 2.723 -9.141 1.00 . A A . 6 VAL HA 1 1 13 9347 1 1 4 VAL HB H 1.432 4.472 -7.366 1.00 . A A . 6 VAL HB 1 1 13 9348 1 1 4 VAL HG11 H -0.837 4.998 -6.740 1.00 . A A . 6 VAL HG11 1 1 13 9349 1 1 4 VAL HG12 H -1.483 3.845 -7.909 1.00 . A A . 6 VAL HG12 1 1 13 9350 1 1 4 VAL HG13 H -0.684 5.316 -8.467 1.00 . A A . 6 VAL HG13 1 1 13 9351 1 1 4 VAL HG21 H -0.251 1.958 -7.133 1.00 . A A . 6 VAL HG21 1 1 13 9352 1 1 4 VAL HG22 H 0.420 2.894 -5.797 1.00 . A A . 6 VAL HG22 1 1 13 9353 1 1 4 VAL HG23 H 1.495 2.020 -6.889 1.00 . A A . 6 VAL HG23 1 1 13 9354 1 1 4 VAL N N 1.280 4.576 -9.983 1.00 . A A . 6 VAL N 1 1 13 9355 1 1 4 VAL O O -0.928 3.153 -10.577 1.00 . A A . 6 VAL O 1 1 13 9356 1 1 5 ASP C C -2.673 0.491 -8.852 1.00 . A A . 7 ASP C 1 1 13 9357 1 1 5 ASP CA C -1.574 0.635 -9.906 1.00 . A A . 7 ASP CA 1 1 13 9358 1 1 5 ASP CB C -1.096 -0.752 -10.340 1.00 . A A . 7 ASP CB 1 1 13 9359 1 1 5 ASP CG C 0.195 -0.618 -11.149 1.00 . A A . 7 ASP CG 1 1 13 9360 1 1 5 ASP H H 0.164 0.994 -8.684 1.00 . A A . 7 ASP H 1 1 13 9361 1 1 5 ASP HA H -1.972 1.158 -10.764 1.00 . A A . 7 ASP HA 1 1 13 9362 1 1 5 ASP HB2 H -0.912 -1.359 -9.465 1.00 . A A . 7 ASP HB2 1 1 13 9363 1 1 5 ASP HB3 H -1.854 -1.220 -10.950 1.00 . A A . 7 ASP HB3 1 1 13 9364 1 1 5 ASP N N -0.428 1.405 -9.348 1.00 . A A . 7 ASP N 1 1 13 9365 1 1 5 ASP O O -2.958 -0.592 -8.381 1.00 . A A . 7 ASP O 1 1 13 9366 1 1 5 ASP OD1 O 0.507 0.492 -11.550 1.00 . A A . 7 ASP OD1 1 1 13 9367 1 1 5 ASP OD2 O 0.850 -1.627 -11.357 1.00 . A A . 7 ASP OD2 1 1 13 9368 1 1 6 CYS C C -5.575 2.350 -7.957 1.00 . A A . 8 CYS C 1 1 13 9369 1 1 6 CYS CA C -4.398 1.497 -7.481 1.00 . A A . 8 CYS CA 1 1 13 9370 1 1 6 CYS CB C -3.901 2.017 -6.129 1.00 . A A . 8 CYS CB 1 1 13 9371 1 1 6 CYS H H -3.067 2.435 -8.892 1.00 . A A . 8 CYS H 1 1 13 9372 1 1 6 CYS HA H -4.719 0.474 -7.381 1.00 . A A . 8 CYS HA 1 1 13 9373 1 1 6 CYS HB2 H -3.793 3.090 -6.175 1.00 . A A . 8 CYS HB2 1 1 13 9374 1 1 6 CYS HB3 H -4.615 1.760 -5.361 1.00 . A A . 8 CYS HB3 1 1 13 9375 1 1 6 CYS N N -3.305 1.572 -8.490 1.00 . A A . 8 CYS N 1 1 13 9376 1 1 6 CYS O O -6.462 2.685 -7.195 1.00 . A A . 8 CYS O 1 1 13 9377 1 1 6 CYS SG S -2.300 1.266 -5.739 1.00 . A A . 8 CYS SG 1 1 13 9378 1 1 7 SER C C -8.023 2.966 -9.328 1.00 . A A . 9 SER C 1 1 13 9379 1 1 7 SER CA C -6.679 3.523 -9.784 1.00 . A A . 9 SER CA 1 1 13 9380 1 1 7 SER CB C -6.607 3.492 -11.311 1.00 . A A . 9 SER CB 1 1 13 9381 1 1 7 SER H H -4.853 2.399 -9.792 1.00 . A A . 9 SER H 1 1 13 9382 1 1 7 SER HA H -6.576 4.541 -9.439 1.00 . A A . 9 SER HA 1 1 13 9383 1 1 7 SER HB2 H -5.780 2.876 -11.622 1.00 . A A . 9 SER HB2 1 1 13 9384 1 1 7 SER HB3 H -7.528 3.081 -11.705 1.00 . A A . 9 SER HB3 1 1 13 9385 1 1 7 SER HG H -6.981 5.402 -11.291 1.00 . A A . 9 SER HG 1 1 13 9386 1 1 7 SER N N -5.579 2.693 -9.217 1.00 . A A . 9 SER N 1 1 13 9387 1 1 7 SER O O -8.619 2.131 -9.978 1.00 . A A . 9 SER O 1 1 13 9388 1 1 7 SER OG O -6.417 4.814 -11.798 1.00 . A A . 9 SER OG 1 1 13 9389 1 1 8 GLU C C -9.665 1.429 -7.372 1.00 . A A . 10 GLU C 1 1 13 9390 1 1 8 GLU CA C -9.794 2.918 -7.691 1.00 . A A . 10 GLU CA 1 1 13 9391 1 1 8 GLU CB C -10.882 3.120 -8.748 1.00 . A A . 10 GLU CB 1 1 13 9392 1 1 8 GLU CD C -13.347 3.509 -8.871 1.00 . A A . 10 GLU CD 1 1 13 9393 1 1 8 GLU CG C -12.060 3.877 -8.130 1.00 . A A . 10 GLU CG 1 1 13 9394 1 1 8 GLU H H -7.986 4.084 -7.702 1.00 . A A . 10 GLU H 1 1 13 9395 1 1 8 GLU HA H -10.057 3.459 -6.794 1.00 . A A . 10 GLU HA 1 1 13 9396 1 1 8 GLU HB2 H -10.482 3.689 -9.574 1.00 . A A . 10 GLU HB2 1 1 13 9397 1 1 8 GLU HB3 H -11.223 2.159 -9.103 1.00 . A A . 10 GLU HB3 1 1 13 9398 1 1 8 GLU HG2 H -12.155 3.608 -7.088 1.00 . A A . 10 GLU HG2 1 1 13 9399 1 1 8 GLU HG3 H -11.891 4.939 -8.214 1.00 . A A . 10 GLU HG3 1 1 13 9400 1 1 8 GLU N N -8.495 3.419 -8.208 1.00 . A A . 10 GLU N 1 1 13 9401 1 1 8 GLU O O -10.234 0.589 -8.039 1.00 . A A . 10 GLU O 1 1 13 9402 1 1 8 GLU OE1 O -13.518 2.341 -9.179 1.00 . A A . 10 GLU OE1 1 1 13 9403 1 1 8 GLU OE2 O -14.141 4.402 -9.120 1.00 . A A . 10 GLU OE2 1 1 13 9404 1 1 9 TYR C C -9.187 -0.592 -4.543 1.00 . A A . 11 TYR C 1 1 13 9405 1 1 9 TYR CA C -8.756 -0.346 -5.997 1.00 . A A . 11 TYR CA 1 1 13 9406 1 1 9 TYR CB C -7.287 -0.742 -6.158 1.00 . A A . 11 TYR CB 1 1 13 9407 1 1 9 TYR CD1 C -7.544 -1.896 -8.383 1.00 . A A . 11 TYR CD1 1 1 13 9408 1 1 9 TYR CD2 C -6.738 -3.180 -6.491 1.00 . A A . 11 TYR CD2 1 1 13 9409 1 1 9 TYR CE1 C -7.451 -3.033 -9.194 1.00 . A A . 11 TYR CE1 1 1 13 9410 1 1 9 TYR CE2 C -6.645 -4.317 -7.302 1.00 . A A . 11 TYR CE2 1 1 13 9411 1 1 9 TYR CG C -7.187 -1.969 -7.031 1.00 . A A . 11 TYR CG 1 1 13 9412 1 1 9 TYR CZ C -7.003 -4.245 -8.653 1.00 . A A . 11 TYR CZ 1 1 13 9413 1 1 9 TYR H H -8.462 1.786 -5.829 1.00 . A A . 11 TYR H 1 1 13 9414 1 1 9 TYR HA H -9.361 -0.948 -6.657 1.00 . A A . 11 TYR HA 1 1 13 9415 1 1 9 TYR HB2 H -6.741 0.071 -6.614 1.00 . A A . 11 TYR HB2 1 1 13 9416 1 1 9 TYR HB3 H -6.864 -0.959 -5.187 1.00 . A A . 11 TYR HB3 1 1 13 9417 1 1 9 TYR HD1 H -7.890 -0.962 -8.800 1.00 . A A . 11 TYR HD1 1 1 13 9418 1 1 9 TYR HD2 H -6.462 -3.237 -5.447 1.00 . A A . 11 TYR HD2 1 1 13 9419 1 1 9 TYR HE1 H -7.727 -2.977 -10.237 1.00 . A A . 11 TYR HE1 1 1 13 9420 1 1 9 TYR HE2 H -6.300 -5.252 -6.884 1.00 . A A . 11 TYR HE2 1 1 13 9421 1 1 9 TYR HH H -6.203 -5.915 -9.113 1.00 . A A . 11 TYR HH 1 1 13 9422 1 1 9 TYR N N -8.918 1.093 -6.353 1.00 . A A . 11 TYR N 1 1 13 9423 1 1 9 TYR O O -8.387 -1.015 -3.732 1.00 . A A . 11 TYR O 1 1 13 9424 1 1 9 TYR OH O -6.913 -5.366 -9.453 1.00 . A A . 11 TYR OH 1 1 13 9425 1 1 10 PRO C C -11.274 -2.033 -2.677 1.00 . A A . 12 PRO C 1 1 13 9426 1 1 10 PRO CA C -11.004 -0.544 -2.913 1.00 . A A . 12 PRO CA 1 1 13 9427 1 1 10 PRO CB C -12.317 0.242 -2.947 1.00 . A A . 12 PRO CB 1 1 13 9428 1 1 10 PRO CD C -11.410 0.181 -5.245 1.00 . A A . 12 PRO CD 1 1 13 9429 1 1 10 PRO CG C -12.708 0.366 -4.438 1.00 . A A . 12 PRO CG 1 1 13 9430 1 1 10 PRO HA H -10.350 -0.143 -2.155 1.00 . A A . 12 PRO HA 1 1 13 9431 1 1 10 PRO HB2 H -13.083 -0.293 -2.400 1.00 . A A . 12 PRO HB2 1 1 13 9432 1 1 10 PRO HB3 H -12.175 1.225 -2.525 1.00 . A A . 12 PRO HB3 1 1 13 9433 1 1 10 PRO HD2 H -11.559 -0.528 -6.048 1.00 . A A . 12 PRO HD2 1 1 13 9434 1 1 10 PRO HD3 H -11.078 1.129 -5.629 1.00 . A A . 12 PRO HD3 1 1 13 9435 1 1 10 PRO HG2 H -13.423 -0.404 -4.697 1.00 . A A . 12 PRO HG2 1 1 13 9436 1 1 10 PRO HG3 H -13.124 1.341 -4.634 1.00 . A A . 12 PRO HG3 1 1 13 9437 1 1 10 PRO N N -10.441 -0.338 -4.260 1.00 . A A . 12 PRO N 1 1 13 9438 1 1 10 PRO O O -12.326 -2.540 -3.007 1.00 . A A . 12 PRO O 1 1 13 9439 1 1 11 LYS C C -9.432 -4.722 -0.954 1.00 . A A . 13 LYS C 1 1 13 9440 1 1 11 LYS CA C -10.544 -4.192 -1.862 1.00 . A A . 13 LYS CA 1 1 13 9441 1 1 11 LYS CB C -10.517 -4.946 -3.193 1.00 . A A . 13 LYS CB 1 1 13 9442 1 1 11 LYS CD C -9.517 -5.006 -5.483 1.00 . A A . 13 LYS CD 1 1 13 9443 1 1 11 LYS CE C -8.748 -6.322 -5.350 1.00 . A A . 13 LYS CE 1 1 13 9444 1 1 11 LYS CG C -9.517 -4.276 -4.139 1.00 . A A . 13 LYS CG 1 1 13 9445 1 1 11 LYS H H -9.488 -2.314 -1.852 1.00 . A A . 13 LYS H 1 1 13 9446 1 1 11 LYS HA H -11.500 -4.340 -1.383 1.00 . A A . 13 LYS HA 1 1 13 9447 1 1 11 LYS HB2 H -10.220 -5.971 -3.021 1.00 . A A . 13 LYS HB2 1 1 13 9448 1 1 11 LYS HB3 H -11.501 -4.925 -3.638 1.00 . A A . 13 LYS HB3 1 1 13 9449 1 1 11 LYS HD2 H -10.535 -5.211 -5.783 1.00 . A A . 13 LYS HD2 1 1 13 9450 1 1 11 LYS HD3 H -9.041 -4.387 -6.229 1.00 . A A . 13 LYS HD3 1 1 13 9451 1 1 11 LYS HE2 H -7.773 -6.127 -4.925 1.00 . A A . 13 LYS HE2 1 1 13 9452 1 1 11 LYS HE3 H -9.294 -6.993 -4.703 1.00 . A A . 13 LYS HE3 1 1 13 9453 1 1 11 LYS HG2 H -9.800 -3.244 -4.288 1.00 . A A . 13 LYS HG2 1 1 13 9454 1 1 11 LYS HG3 H -8.528 -4.321 -3.707 1.00 . A A . 13 LYS HG3 1 1 13 9455 1 1 11 LYS HZ1 H -8.074 -7.844 -6.599 1.00 . A A . 13 LYS HZ1 1 1 13 9456 1 1 11 LYS HZ2 H -8.051 -6.303 -7.313 1.00 . A A . 13 LYS HZ2 1 1 13 9457 1 1 11 LYS HZ3 H -9.523 -7.126 -7.107 1.00 . A A . 13 LYS HZ3 1 1 13 9458 1 1 11 LYS N N -10.333 -2.738 -2.111 1.00 . A A . 13 LYS N 1 1 13 9459 1 1 11 LYS NZ N -8.587 -6.946 -6.693 1.00 . A A . 13 LYS NZ 1 1 13 9460 1 1 11 LYS O O -8.355 -5.058 -1.405 1.00 . A A . 13 LYS O 1 1 13 9461 1 1 12 CYS C C -8.761 -6.828 1.387 1.00 . A A . 14 CYS C 1 1 13 9462 1 1 12 CYS CA C -8.643 -5.307 1.260 1.00 . A A . 14 CYS CA 1 1 13 9463 1 1 12 CYS CB C -8.840 -4.665 2.635 1.00 . A A . 14 CYS CB 1 1 13 9464 1 1 12 CYS H H -10.559 -4.524 0.667 1.00 . A A . 14 CYS H 1 1 13 9465 1 1 12 CYS HA H -7.665 -5.053 0.882 1.00 . A A . 14 CYS HA 1 1 13 9466 1 1 12 CYS HB2 H -9.849 -4.288 2.714 1.00 . A A . 14 CYS HB2 1 1 13 9467 1 1 12 CYS HB3 H -8.669 -5.403 3.404 1.00 . A A . 14 CYS HB3 1 1 13 9468 1 1 12 CYS N N -9.685 -4.800 0.323 1.00 . A A . 14 CYS N 1 1 13 9469 1 1 12 CYS O O -8.402 -7.406 2.392 1.00 . A A . 14 CYS O 1 1 13 9470 1 1 12 CYS SG S -7.668 -3.300 2.837 1.00 . A A . 14 CYS SG 1 1 13 9471 1 1 13 ALA C C -8.466 -9.598 -0.604 1.00 . A A . 15 ALA C 1 1 13 9472 1 1 13 ALA CA C -9.393 -8.964 0.436 1.00 . A A . 15 ALA CA 1 1 13 9473 1 1 13 ALA CB C -10.842 -9.358 0.142 1.00 . A A . 15 ALA CB 1 1 13 9474 1 1 13 ALA H H -9.539 -6.998 -0.432 1.00 . A A . 15 ALA H 1 1 13 9475 1 1 13 ALA HA H -9.117 -9.309 1.422 1.00 . A A . 15 ALA HA 1 1 13 9476 1 1 13 ALA HB1 H -11.019 -10.367 0.485 1.00 . A A . 15 ALA HB1 1 1 13 9477 1 1 13 ALA HB2 H -11.022 -9.303 -0.921 1.00 . A A . 15 ALA HB2 1 1 13 9478 1 1 13 ALA HB3 H -11.511 -8.682 0.655 1.00 . A A . 15 ALA HB3 1 1 13 9479 1 1 13 ALA N N -9.258 -7.481 0.372 1.00 . A A . 15 ALA N 1 1 13 9480 1 1 13 ALA O O -8.859 -9.858 -1.724 1.00 . A A . 15 ALA O 1 1 13 9481 1 1 14 CYS C C -5.766 -11.782 -0.671 1.00 . A A . 16 CYS C 1 1 13 9482 1 1 14 CYS CA C -6.283 -10.451 -1.213 1.00 . A A . 16 CYS CA 1 1 13 9483 1 1 14 CYS CB C -5.105 -9.501 -1.435 1.00 . A A . 16 CYS CB 1 1 13 9484 1 1 14 CYS H H -6.938 -9.621 0.664 1.00 . A A . 16 CYS H 1 1 13 9485 1 1 14 CYS HA H -6.784 -10.622 -2.153 1.00 . A A . 16 CYS HA 1 1 13 9486 1 1 14 CYS HB2 H -4.970 -8.882 -0.561 1.00 . A A . 16 CYS HB2 1 1 13 9487 1 1 14 CYS HB3 H -4.206 -10.074 -1.613 1.00 . A A . 16 CYS HB3 1 1 13 9488 1 1 14 CYS N N -7.236 -9.842 -0.243 1.00 . A A . 16 CYS N 1 1 13 9489 1 1 14 CYS O O -6.132 -12.218 0.403 1.00 . A A . 16 CYS O 1 1 13 9490 1 1 14 CYS SG S -5.443 -8.452 -2.871 1.00 . A A . 16 CYS SG 1 1 13 9491 1 1 15 THR C C -3.238 -13.512 0.040 1.00 . A A . 17 THR C 1 1 13 9492 1 1 15 THR CA C -4.372 -13.741 -0.972 1.00 . A A . 17 THR CA 1 1 13 9493 1 1 15 THR CB C -3.847 -14.500 -2.193 1.00 . A A . 17 THR CB 1 1 13 9494 1 1 15 THR CG2 C -3.438 -15.914 -1.782 1.00 . A A . 17 THR CG2 1 1 13 9495 1 1 15 THR H H -4.652 -12.056 -2.283 1.00 . A A . 17 THR H 1 1 13 9496 1 1 15 THR HA H -5.157 -14.316 -0.504 1.00 . A A . 17 THR HA 1 1 13 9497 1 1 15 THR HB H -2.990 -13.982 -2.596 1.00 . A A . 17 THR HB 1 1 13 9498 1 1 15 THR HG1 H -5.048 -13.672 -3.478 1.00 . A A . 17 THR HG1 1 1 13 9499 1 1 15 THR HG21 H -2.369 -15.954 -1.644 1.00 . A A . 17 THR HG21 1 1 13 9500 1 1 15 THR HG22 H -3.729 -16.611 -2.554 1.00 . A A . 17 THR HG22 1 1 13 9501 1 1 15 THR HG23 H -3.931 -16.178 -0.857 1.00 . A A . 17 THR HG23 1 1 13 9502 1 1 15 THR N N -4.921 -12.431 -1.419 1.00 . A A . 17 THR N 1 1 13 9503 1 1 15 THR O O -3.472 -13.068 1.146 1.00 . A A . 17 THR O 1 1 13 9504 1 1 15 THR OG1 O -4.867 -14.566 -3.180 1.00 . A A . 17 THR OG1 1 1 13 9505 1 1 16 MET C C 0.352 -13.134 -0.125 1.00 . A A . 18 MET C 1 1 13 9506 1 1 16 MET CA C -0.888 -13.602 0.641 1.00 . A A . 18 MET CA 1 1 13 9507 1 1 16 MET CB C -0.583 -14.918 1.359 1.00 . A A . 18 MET CB 1 1 13 9508 1 1 16 MET CE C -3.260 -17.589 2.985 1.00 . A A . 18 MET CE 1 1 13 9509 1 1 16 MET CG C -1.897 -15.602 1.738 1.00 . A A . 18 MET CG 1 1 13 9510 1 1 16 MET H H -1.827 -14.168 -1.206 1.00 . A A . 18 MET H 1 1 13 9511 1 1 16 MET HA H -1.167 -12.851 1.366 1.00 . A A . 18 MET HA 1 1 13 9512 1 1 16 MET HB2 H -0.015 -15.563 0.704 1.00 . A A . 18 MET HB2 1 1 13 9513 1 1 16 MET HB3 H -0.013 -14.718 2.253 1.00 . A A . 18 MET HB3 1 1 13 9514 1 1 16 MET HE1 H -3.562 -17.996 2.030 1.00 . A A . 18 MET HE1 1 1 13 9515 1 1 16 MET HE2 H -3.918 -16.778 3.251 1.00 . A A . 18 MET HE2 1 1 13 9516 1 1 16 MET HE3 H -3.312 -18.357 3.744 1.00 . A A . 18 MET HE3 1 1 13 9517 1 1 16 MET HG2 H -2.547 -14.888 2.224 1.00 . A A . 18 MET HG2 1 1 13 9518 1 1 16 MET HG3 H -2.377 -15.977 0.845 1.00 . A A . 18 MET HG3 1 1 13 9519 1 1 16 MET N N -2.011 -13.809 -0.316 1.00 . A A . 18 MET N 1 1 13 9520 1 1 16 MET O O 1.454 -13.582 0.124 1.00 . A A . 18 MET O 1 1 13 9521 1 1 16 MET SD S -1.561 -16.976 2.866 1.00 . A A . 18 MET SD 1 1 13 9522 1 1 17 GLU C C 2.300 -10.996 -0.895 1.00 . A A . 19 GLU C 1 1 13 9523 1 1 17 GLU CA C 1.342 -11.731 -1.835 1.00 . A A . 19 GLU CA 1 1 13 9524 1 1 17 GLU CB C 0.847 -10.768 -2.916 1.00 . A A . 19 GLU CB 1 1 13 9525 1 1 17 GLU CD C 0.651 -11.087 -5.384 1.00 . A A . 19 GLU CD 1 1 13 9526 1 1 17 GLU CG C 1.627 -11.004 -4.210 1.00 . A A . 19 GLU CG 1 1 13 9527 1 1 17 GLU H H -0.719 -11.885 -1.235 1.00 . A A . 19 GLU H 1 1 13 9528 1 1 17 GLU HA H 1.854 -12.563 -2.297 1.00 . A A . 19 GLU HA 1 1 13 9529 1 1 17 GLU HB2 H -0.205 -10.938 -3.093 1.00 . A A . 19 GLU HB2 1 1 13 9530 1 1 17 GLU HB3 H 0.998 -9.750 -2.587 1.00 . A A . 19 GLU HB3 1 1 13 9531 1 1 17 GLU HG2 H 2.315 -10.186 -4.370 1.00 . A A . 19 GLU HG2 1 1 13 9532 1 1 17 GLU HG3 H 2.179 -11.929 -4.135 1.00 . A A . 19 GLU HG3 1 1 13 9533 1 1 17 GLU N N 0.178 -12.234 -1.053 1.00 . A A . 19 GLU N 1 1 13 9534 1 1 17 GLU O O 1.887 -10.400 0.079 1.00 . A A . 19 GLU O 1 1 13 9535 1 1 17 GLU OE1 O -0.477 -11.495 -5.162 1.00 . A A . 19 GLU OE1 1 1 13 9536 1 1 17 GLU OE2 O 1.049 -10.740 -6.484 1.00 . A A . 19 GLU OE2 1 1 13 9537 1 1 18 TYR C C 5.426 -9.386 -1.102 1.00 . A A . 20 TYR C 1 1 13 9538 1 1 18 TYR CA C 4.547 -10.335 -0.284 1.00 . A A . 20 TYR CA 1 1 13 9539 1 1 18 TYR CB C 5.433 -11.357 0.423 1.00 . A A . 20 TYR CB 1 1 13 9540 1 1 18 TYR CD1 C 4.914 -10.363 2.683 1.00 . A A . 20 TYR CD1 1 1 13 9541 1 1 18 TYR CD2 C 7.233 -10.719 2.067 1.00 . A A . 20 TYR CD2 1 1 13 9542 1 1 18 TYR CE1 C 5.322 -9.846 3.918 1.00 . A A . 20 TYR CE1 1 1 13 9543 1 1 18 TYR CE2 C 7.641 -10.201 3.302 1.00 . A A . 20 TYR CE2 1 1 13 9544 1 1 18 TYR CG C 5.870 -10.800 1.757 1.00 . A A . 20 TYR CG 1 1 13 9545 1 1 18 TYR CZ C 6.685 -9.765 4.227 1.00 . A A . 20 TYR CZ 1 1 13 9546 1 1 18 TYR H H 3.894 -11.522 -1.962 1.00 . A A . 20 TYR H 1 1 13 9547 1 1 18 TYR HA H 4.003 -9.766 0.455 1.00 . A A . 20 TYR HA 1 1 13 9548 1 1 18 TYR HB2 H 4.881 -12.273 0.574 1.00 . A A . 20 TYR HB2 1 1 13 9549 1 1 18 TYR HB3 H 6.302 -11.554 -0.184 1.00 . A A . 20 TYR HB3 1 1 13 9550 1 1 18 TYR HD1 H 3.862 -10.426 2.443 1.00 . A A . 20 TYR HD1 1 1 13 9551 1 1 18 TYR HD2 H 7.970 -11.054 1.354 1.00 . A A . 20 TYR HD2 1 1 13 9552 1 1 18 TYR HE1 H 4.586 -9.509 4.632 1.00 . A A . 20 TYR HE1 1 1 13 9553 1 1 18 TYR HE2 H 8.692 -10.138 3.541 1.00 . A A . 20 TYR HE2 1 1 13 9554 1 1 18 TYR HH H 7.596 -9.932 5.896 1.00 . A A . 20 TYR HH 1 1 13 9555 1 1 18 TYR N N 3.577 -11.035 -1.174 1.00 . A A . 20 TYR N 1 1 13 9556 1 1 18 TYR O O 6.207 -9.798 -1.936 1.00 . A A . 20 TYR O 1 1 13 9557 1 1 18 TYR OH O 7.088 -9.255 5.445 1.00 . A A . 20 TYR OH 1 1 13 9558 1 1 19 ARG C C 6.455 -5.974 -0.596 1.00 . A A . 21 ARG C 1 1 13 9559 1 1 19 ARG CA C 6.124 -7.106 -1.574 1.00 . A A . 21 ARG CA 1 1 13 9560 1 1 19 ARG CB C 5.331 -6.539 -2.757 1.00 . A A . 21 ARG CB 1 1 13 9561 1 1 19 ARG CD C 5.385 -8.484 -4.324 1.00 . A A . 21 ARG CD 1 1 13 9562 1 1 19 ARG CG C 4.495 -7.645 -3.407 1.00 . A A . 21 ARG CG 1 1 13 9563 1 1 19 ARG CZ C 5.587 -10.825 -4.916 1.00 . A A . 21 ARG CZ 1 1 13 9564 1 1 19 ARG H H 4.679 -7.823 -0.162 1.00 . A A . 21 ARG H 1 1 13 9565 1 1 19 ARG HA H 7.036 -7.563 -1.930 1.00 . A A . 21 ARG HA 1 1 13 9566 1 1 19 ARG HB2 H 4.677 -5.753 -2.407 1.00 . A A . 21 ARG HB2 1 1 13 9567 1 1 19 ARG HB3 H 6.016 -6.135 -3.487 1.00 . A A . 21 ARG HB3 1 1 13 9568 1 1 19 ARG HD2 H 5.179 -8.234 -5.354 1.00 . A A . 21 ARG HD2 1 1 13 9569 1 1 19 ARG HD3 H 6.423 -8.279 -4.104 1.00 . A A . 21 ARG HD3 1 1 13 9570 1 1 19 ARG HE H 4.564 -10.208 -3.329 1.00 . A A . 21 ARG HE 1 1 13 9571 1 1 19 ARG HG2 H 4.069 -8.276 -2.640 1.00 . A A . 21 ARG HG2 1 1 13 9572 1 1 19 ARG HG3 H 3.701 -7.202 -3.988 1.00 . A A . 21 ARG HG3 1 1 13 9573 1 1 19 ARG HH11 H 7.307 -9.847 -5.222 1.00 . A A . 21 ARG HH11 1 1 13 9574 1 1 19 ARG HH12 H 7.138 -11.348 -6.070 1.00 . A A . 21 ARG HH12 1 1 13 9575 1 1 19 ARG HH21 H 3.979 -12.014 -4.803 1.00 . A A . 21 ARG HH21 1 1 13 9576 1 1 19 ARG HH22 H 5.253 -12.574 -5.836 1.00 . A A . 21 ARG HH22 1 1 13 9577 1 1 19 ARG N N 5.306 -8.115 -0.848 1.00 . A A . 21 ARG N 1 1 13 9578 1 1 19 ARG NE N 5.107 -9.930 -4.096 1.00 . A A . 21 ARG NE 1 1 13 9579 1 1 19 ARG NH1 N 6.769 -10.661 -5.444 1.00 . A A . 21 ARG NH1 1 1 13 9580 1 1 19 ARG NH2 N 4.885 -11.887 -5.208 1.00 . A A . 21 ARG NH2 1 1 13 9581 1 1 19 ARG O O 5.674 -5.059 -0.427 1.00 . A A . 21 ARG O 1 1 13 9582 1 1 20 PRO C C 8.515 -3.804 0.355 1.00 . A A . 22 PRO C 1 1 13 9583 1 1 20 PRO CA C 8.045 -5.093 1.030 1.00 . A A . 22 PRO CA 1 1 13 9584 1 1 20 PRO CB C 9.196 -5.800 1.747 1.00 . A A . 22 PRO CB 1 1 13 9585 1 1 20 PRO CD C 8.542 -7.195 -0.185 1.00 . A A . 22 PRO CD 1 1 13 9586 1 1 20 PRO CG C 9.702 -6.897 0.783 1.00 . A A . 22 PRO CG 1 1 13 9587 1 1 20 PRO HA H 7.256 -4.883 1.734 1.00 . A A . 22 PRO HA 1 1 13 9588 1 1 20 PRO HB2 H 9.986 -5.093 1.960 1.00 . A A . 22 PRO HB2 1 1 13 9589 1 1 20 PRO HB3 H 8.844 -6.253 2.661 1.00 . A A . 22 PRO HB3 1 1 13 9590 1 1 20 PRO HD2 H 8.895 -7.197 -1.208 1.00 . A A . 22 PRO HD2 1 1 13 9591 1 1 20 PRO HD3 H 8.076 -8.137 0.058 1.00 . A A . 22 PRO HD3 1 1 13 9592 1 1 20 PRO HG2 H 10.564 -6.539 0.236 1.00 . A A . 22 PRO HG2 1 1 13 9593 1 1 20 PRO HG3 H 9.955 -7.788 1.335 1.00 . A A . 22 PRO HG3 1 1 13 9594 1 1 20 PRO N N 7.594 -6.084 0.037 1.00 . A A . 22 PRO N 1 1 13 9595 1 1 20 PRO O O 9.596 -3.730 -0.196 1.00 . A A . 22 PRO O 1 1 13 9596 1 1 21 LEU C C 8.131 -0.392 0.856 1.00 . A A . 23 LEU C 1 1 13 9597 1 1 21 LEU CA C 8.078 -1.476 -0.219 1.00 . A A . 23 LEU CA 1 1 13 9598 1 1 21 LEU CB C 7.020 -1.069 -1.251 1.00 . A A . 23 LEU CB 1 1 13 9599 1 1 21 LEU CD1 C 5.807 -1.794 -3.313 1.00 . A A . 23 LEU CD1 1 1 13 9600 1 1 21 LEU CD2 C 7.984 -2.858 -2.705 1.00 . A A . 23 LEU CD2 1 1 13 9601 1 1 21 LEU CG C 6.689 -2.260 -2.154 1.00 . A A . 23 LEU CG 1 1 13 9602 1 1 21 LEU H H 6.838 -2.886 0.867 1.00 . A A . 23 LEU H 1 1 13 9603 1 1 21 LEU HA H 9.039 -1.558 -0.699 1.00 . A A . 23 LEU HA 1 1 13 9604 1 1 21 LEU HB2 H 6.132 -0.756 -0.732 1.00 . A A . 23 LEU HB2 1 1 13 9605 1 1 21 LEU HB3 H 7.387 -0.246 -1.850 1.00 . A A . 23 LEU HB3 1 1 13 9606 1 1 21 LEU HD11 H 5.718 -0.718 -3.292 1.00 . A A . 23 LEU HD11 1 1 13 9607 1 1 21 LEU HD12 H 4.829 -2.238 -3.222 1.00 . A A . 23 LEU HD12 1 1 13 9608 1 1 21 LEU HD13 H 6.252 -2.100 -4.248 1.00 . A A . 23 LEU HD13 1 1 13 9609 1 1 21 LEU HD21 H 8.265 -3.715 -2.109 1.00 . A A . 23 LEU HD21 1 1 13 9610 1 1 21 LEU HD22 H 8.767 -2.118 -2.664 1.00 . A A . 23 LEU HD22 1 1 13 9611 1 1 21 LEU HD23 H 7.831 -3.167 -3.729 1.00 . A A . 23 LEU HD23 1 1 13 9612 1 1 21 LEU HG H 6.159 -3.009 -1.583 1.00 . A A . 23 LEU HG 1 1 13 9613 1 1 21 LEU N N 7.702 -2.785 0.408 1.00 . A A . 23 LEU N 1 1 13 9614 1 1 21 LEU O O 7.780 -0.613 1.990 1.00 . A A . 23 LEU O 1 1 13 9615 1 1 22 CYS C C 7.441 2.862 1.176 1.00 . A A . 24 CYS C 1 1 13 9616 1 1 22 CYS CA C 8.572 1.887 1.512 1.00 . A A . 24 CYS CA 1 1 13 9617 1 1 22 CYS CB C 9.922 2.602 1.463 1.00 . A A . 24 CYS CB 1 1 13 9618 1 1 22 CYS H H 8.814 0.964 -0.424 1.00 . A A . 24 CYS H 1 1 13 9619 1 1 22 CYS HA H 8.413 1.474 2.497 1.00 . A A . 24 CYS HA 1 1 13 9620 1 1 22 CYS HB2 H 10.329 2.543 0.466 1.00 . A A . 24 CYS HB2 1 1 13 9621 1 1 22 CYS HB3 H 9.794 3.636 1.743 1.00 . A A . 24 CYS HB3 1 1 13 9622 1 1 22 CYS N N 8.543 0.791 0.504 1.00 . A A . 24 CYS N 1 1 13 9623 1 1 22 CYS O O 7.565 3.677 0.290 1.00 . A A . 24 CYS O 1 1 13 9624 1 1 22 CYS SG S 11.056 1.807 2.622 1.00 . A A . 24 CYS SG 1 1 13 9625 1 1 23 GLY C C 5.381 5.040 2.137 1.00 . A A . 25 GLY C 1 1 13 9626 1 1 23 GLY CA C 5.166 3.648 1.555 1.00 . A A . 25 GLY CA 1 1 13 9627 1 1 23 GLY H H 6.245 2.073 2.553 1.00 . A A . 25 GLY H 1 1 13 9628 1 1 23 GLY HA2 H 5.046 3.727 0.484 1.00 . A A . 25 GLY HA2 1 1 13 9629 1 1 23 GLY HA3 H 4.268 3.220 1.981 1.00 . A A . 25 GLY HA3 1 1 13 9630 1 1 23 GLY N N 6.327 2.756 1.856 1.00 . A A . 25 GLY N 1 1 13 9631 1 1 23 GLY O O 5.832 5.195 3.257 1.00 . A A . 25 GLY O 1 1 13 9632 1 1 24 SER C C 4.339 7.650 3.147 1.00 . A A . 26 SER C 1 1 13 9633 1 1 24 SER CA C 5.203 7.450 1.897 1.00 . A A . 26 SER CA 1 1 13 9634 1 1 24 SER CB C 4.773 8.443 0.818 1.00 . A A . 26 SER CB 1 1 13 9635 1 1 24 SER H H 4.651 5.905 0.491 1.00 . A A . 26 SER H 1 1 13 9636 1 1 24 SER HA H 6.240 7.617 2.147 1.00 . A A . 26 SER HA 1 1 13 9637 1 1 24 SER HB2 H 4.386 7.910 -0.033 1.00 . A A . 26 SER HB2 1 1 13 9638 1 1 24 SER HB3 H 4.003 9.093 1.215 1.00 . A A . 26 SER HB3 1 1 13 9639 1 1 24 SER HG H 5.697 10.138 0.575 1.00 . A A . 26 SER HG 1 1 13 9640 1 1 24 SER N N 5.035 6.058 1.388 1.00 . A A . 26 SER N 1 1 13 9641 1 1 24 SER O O 4.441 8.649 3.828 1.00 . A A . 26 SER O 1 1 13 9642 1 1 24 SER OG O 5.897 9.214 0.415 1.00 . A A . 26 SER OG 1 1 13 9643 1 1 25 ASP C C 3.385 6.419 5.906 1.00 . A A . 27 ASP C 1 1 13 9644 1 1 25 ASP CA C 2.617 6.846 4.650 1.00 . A A . 27 ASP CA 1 1 13 9645 1 1 25 ASP CB C 1.373 5.968 4.482 1.00 . A A . 27 ASP CB 1 1 13 9646 1 1 25 ASP CG C 1.780 4.497 4.370 1.00 . A A . 27 ASP CG 1 1 13 9647 1 1 25 ASP H H 3.417 5.914 2.887 1.00 . A A . 27 ASP H 1 1 13 9648 1 1 25 ASP HA H 2.314 7.876 4.753 1.00 . A A . 27 ASP HA 1 1 13 9649 1 1 25 ASP HB2 H 0.726 6.097 5.338 1.00 . A A . 27 ASP HB2 1 1 13 9650 1 1 25 ASP HB3 H 0.847 6.262 3.587 1.00 . A A . 27 ASP HB3 1 1 13 9651 1 1 25 ASP N N 3.487 6.708 3.450 1.00 . A A . 27 ASP N 1 1 13 9652 1 1 25 ASP O O 2.809 6.232 6.959 1.00 . A A . 27 ASP O 1 1 13 9653 1 1 25 ASP OD1 O 2.459 4.158 3.415 1.00 . A A . 27 ASP OD1 1 1 13 9654 1 1 25 ASP OD2 O 1.394 3.732 5.237 1.00 . A A . 27 ASP OD2 1 1 13 9655 1 1 26 ASN C C 5.264 4.377 7.283 1.00 . A A . 28 ASN C 1 1 13 9656 1 1 26 ASN CA C 5.473 5.867 7.003 1.00 . A A . 28 ASN CA 1 1 13 9657 1 1 26 ASN CB C 5.009 6.678 8.217 1.00 . A A . 28 ASN CB 1 1 13 9658 1 1 26 ASN CG C 6.151 6.789 9.232 1.00 . A A . 28 ASN CG 1 1 13 9659 1 1 26 ASN H H 5.130 6.430 4.954 1.00 . A A . 28 ASN H 1 1 13 9660 1 1 26 ASN HA H 6.520 6.057 6.822 1.00 . A A . 28 ASN HA 1 1 13 9661 1 1 26 ASN HB2 H 4.713 7.666 7.897 1.00 . A A . 28 ASN HB2 1 1 13 9662 1 1 26 ASN HB3 H 4.168 6.183 8.679 1.00 . A A . 28 ASN HB3 1 1 13 9663 1 1 26 ASN HD21 H 5.199 5.752 10.634 1.00 . A A . 28 ASN HD21 1 1 13 9664 1 1 26 ASN HD22 H 6.745 6.305 11.065 1.00 . A A . 28 ASN HD22 1 1 13 9665 1 1 26 ASN N N 4.680 6.271 5.808 1.00 . A A . 28 ASN N 1 1 13 9666 1 1 26 ASN ND2 N 6.021 6.236 10.408 1.00 . A A . 28 ASN ND2 1 1 13 9667 1 1 26 ASN O O 5.339 3.936 8.412 1.00 . A A . 28 ASN O 1 1 13 9668 1 1 26 ASN OD1 O 7.170 7.389 8.953 1.00 . A A . 28 ASN OD1 1 1 13 9669 1 1 27 LYS C C 5.219 1.365 5.264 1.00 . A A . 29 LYS C 1 1 13 9670 1 1 27 LYS CA C 4.796 2.136 6.508 1.00 . A A . 29 LYS CA 1 1 13 9671 1 1 27 LYS CB C 3.322 1.869 6.808 1.00 . A A . 29 LYS CB 1 1 13 9672 1 1 27 LYS CD C 3.747 0.519 8.862 1.00 . A A . 29 LYS CD 1 1 13 9673 1 1 27 LYS CE C 3.885 0.618 10.380 1.00 . A A . 29 LYS CE 1 1 13 9674 1 1 27 LYS CG C 3.112 1.800 8.322 1.00 . A A . 29 LYS CG 1 1 13 9675 1 1 27 LYS H H 4.951 3.959 5.355 1.00 . A A . 29 LYS H 1 1 13 9676 1 1 27 LYS HA H 5.398 1.820 7.348 1.00 . A A . 29 LYS HA 1 1 13 9677 1 1 27 LYS HB2 H 2.724 2.667 6.399 1.00 . A A . 29 LYS HB2 1 1 13 9678 1 1 27 LYS HB3 H 3.027 0.931 6.361 1.00 . A A . 29 LYS HB3 1 1 13 9679 1 1 27 LYS HD2 H 3.122 -0.325 8.610 1.00 . A A . 29 LYS HD2 1 1 13 9680 1 1 27 LYS HD3 H 4.724 0.388 8.420 1.00 . A A . 29 LYS HD3 1 1 13 9681 1 1 27 LYS HE2 H 4.285 1.587 10.643 1.00 . A A . 29 LYS HE2 1 1 13 9682 1 1 27 LYS HE3 H 2.916 0.492 10.839 1.00 . A A . 29 LYS HE3 1 1 13 9683 1 1 27 LYS HG2 H 3.572 2.658 8.789 1.00 . A A . 29 LYS HG2 1 1 13 9684 1 1 27 LYS HG3 H 2.054 1.794 8.539 1.00 . A A . 29 LYS HG3 1 1 13 9685 1 1 27 LYS HZ1 H 4.344 -1.373 10.774 1.00 . A A . 29 LYS HZ1 1 1 13 9686 1 1 27 LYS HZ2 H 5.043 -0.272 11.863 1.00 . A A . 29 LYS HZ2 1 1 13 9687 1 1 27 LYS HZ3 H 5.677 -0.439 10.296 1.00 . A A . 29 LYS HZ3 1 1 13 9688 1 1 27 LYS N N 5.004 3.593 6.271 1.00 . A A . 29 LYS N 1 1 13 9689 1 1 27 LYS NZ N 4.807 -0.447 10.865 1.00 . A A . 29 LYS NZ 1 1 13 9690 1 1 27 LYS O O 5.032 1.822 4.158 1.00 . A A . 29 LYS O 1 1 13 9691 1 1 28 THR C C 5.018 -1.284 3.611 1.00 . A A . 30 THR C 1 1 13 9692 1 1 28 THR CA C 6.227 -0.578 4.239 1.00 . A A . 30 THR CA 1 1 13 9693 1 1 28 THR CB C 7.294 -1.606 4.668 1.00 . A A . 30 THR CB 1 1 13 9694 1 1 28 THR CG2 C 7.283 -2.824 3.731 1.00 . A A . 30 THR CG2 1 1 13 9695 1 1 28 THR H H 5.933 -0.150 6.332 1.00 . A A . 30 THR H 1 1 13 9696 1 1 28 THR HA H 6.653 0.101 3.519 1.00 . A A . 30 THR HA 1 1 13 9697 1 1 28 THR HB H 7.086 -1.934 5.675 1.00 . A A . 30 THR HB 1 1 13 9698 1 1 28 THR HG1 H 8.906 -0.935 5.530 1.00 . A A . 30 THR HG1 1 1 13 9699 1 1 28 THR HG21 H 8.025 -3.536 4.058 1.00 . A A . 30 THR HG21 1 1 13 9700 1 1 28 THR HG22 H 7.509 -2.511 2.725 1.00 . A A . 30 THR HG22 1 1 13 9701 1 1 28 THR HG23 H 6.308 -3.286 3.754 1.00 . A A . 30 THR HG23 1 1 13 9702 1 1 28 THR N N 5.788 0.204 5.429 1.00 . A A . 30 THR N 1 1 13 9703 1 1 28 THR O O 3.961 -1.377 4.204 1.00 . A A . 30 THR O 1 1 13 9704 1 1 28 THR OG1 O 8.579 -0.995 4.629 1.00 . A A . 30 THR OG1 1 1 13 9705 1 1 29 TYR C C 4.069 -3.954 2.093 1.00 . A A . 31 TYR C 1 1 13 9706 1 1 29 TYR CA C 4.050 -2.479 1.734 1.00 . A A . 31 TYR CA 1 1 13 9707 1 1 29 TYR CB C 4.243 -2.457 0.217 1.00 . A A . 31 TYR CB 1 1 13 9708 1 1 29 TYR CD1 C 4.145 0.062 0.290 1.00 . A A . 31 TYR CD1 1 1 13 9709 1 1 29 TYR CD2 C 3.449 -1.093 -1.721 1.00 . A A . 31 TYR CD2 1 1 13 9710 1 1 29 TYR CE1 C 3.891 1.286 -0.338 1.00 . A A . 31 TYR CE1 1 1 13 9711 1 1 29 TYR CE2 C 3.188 0.127 -2.342 1.00 . A A . 31 TYR CE2 1 1 13 9712 1 1 29 TYR CG C 3.923 -1.126 -0.404 1.00 . A A . 31 TYR CG 1 1 13 9713 1 1 29 TYR CZ C 3.415 1.318 -1.652 1.00 . A A . 31 TYR CZ 1 1 13 9714 1 1 29 TYR H H 6.028 -1.690 1.955 1.00 . A A . 31 TYR H 1 1 13 9715 1 1 29 TYR HA H 3.105 -2.032 1.996 1.00 . A A . 31 TYR HA 1 1 13 9716 1 1 29 TYR HB2 H 5.267 -2.703 -0.006 1.00 . A A . 31 TYR HB2 1 1 13 9717 1 1 29 TYR HB3 H 3.609 -3.211 -0.219 1.00 . A A . 31 TYR HB3 1 1 13 9718 1 1 29 TYR HD1 H 4.512 0.039 1.306 1.00 . A A . 31 TYR HD1 1 1 13 9719 1 1 29 TYR HD2 H 3.271 -2.017 -2.253 1.00 . A A . 31 TYR HD2 1 1 13 9720 1 1 29 TYR HE1 H 4.056 2.204 0.192 1.00 . A A . 31 TYR HE1 1 1 13 9721 1 1 29 TYR HE2 H 2.821 0.151 -3.359 1.00 . A A . 31 TYR HE2 1 1 13 9722 1 1 29 TYR HH H 3.361 2.425 -3.203 1.00 . A A . 31 TYR HH 1 1 13 9723 1 1 29 TYR N N 5.174 -1.780 2.412 1.00 . A A . 31 TYR N 1 1 13 9724 1 1 29 TYR O O 5.019 -4.649 1.773 1.00 . A A . 31 TYR O 1 1 13 9725 1 1 29 TYR OH O 3.173 2.527 -2.268 1.00 . A A . 31 TYR OH 1 1 13 9726 1 1 30 GLY C C 2.795 -6.554 1.527 1.00 . A A . 32 GLY C 1 1 13 9727 1 1 30 GLY CA C 2.961 -5.928 2.911 1.00 . A A . 32 GLY CA 1 1 13 9728 1 1 30 GLY H H 2.225 -3.903 2.840 1.00 . A A . 32 GLY H 1 1 13 9729 1 1 30 GLY HA2 H 3.885 -6.258 3.372 1.00 . A A . 32 GLY HA2 1 1 13 9730 1 1 30 GLY HA3 H 2.117 -6.178 3.530 1.00 . A A . 32 GLY HA3 1 1 13 9731 1 1 30 GLY N N 3.009 -4.463 2.657 1.00 . A A . 32 GLY N 1 1 13 9732 1 1 30 GLY O O 3.207 -7.664 1.260 1.00 . A A . 32 GLY O 1 1 13 9733 1 1 31 ASN C C 1.221 -5.057 -1.448 1.00 . A A . 33 ASN C 1 1 13 9734 1 1 31 ASN CA C 2.007 -6.192 -0.772 1.00 . A A . 33 ASN CA 1 1 13 9735 1 1 31 ASN CB C 1.261 -7.537 -0.871 1.00 . A A . 33 ASN CB 1 1 13 9736 1 1 31 ASN CG C -0.063 -7.497 -0.105 1.00 . A A . 33 ASN CG 1 1 13 9737 1 1 31 ASN H H 1.921 -4.888 0.910 1.00 . A A . 33 ASN H 1 1 13 9738 1 1 31 ASN HA H 2.973 -6.280 -1.253 1.00 . A A . 33 ASN HA 1 1 13 9739 1 1 31 ASN HB2 H 1.062 -7.755 -1.909 1.00 . A A . 33 ASN HB2 1 1 13 9740 1 1 31 ASN HB3 H 1.884 -8.317 -0.460 1.00 . A A . 33 ASN HB3 1 1 13 9741 1 1 31 ASN HD21 H 0.418 -9.009 1.091 1.00 . A A . 33 ASN HD21 1 1 13 9742 1 1 31 ASN HD22 H -1.119 -8.336 1.353 1.00 . A A . 33 ASN HD22 1 1 13 9743 1 1 31 ASN N N 2.212 -5.783 0.640 1.00 . A A . 33 ASN N 1 1 13 9744 1 1 31 ASN ND2 N -0.271 -8.350 0.862 1.00 . A A . 33 ASN ND2 1 1 13 9745 1 1 31 ASN O O 0.494 -4.337 -0.804 1.00 . A A . 33 ASN O 1 1 13 9746 1 1 31 ASN OD1 O -0.925 -6.704 -0.405 1.00 . A A . 33 ASN OD1 1 1 13 9747 1 1 32 LYS C C -0.805 -3.808 -3.199 1.00 . A A . 34 LYS C 1 1 13 9748 1 1 32 LYS CA C 0.707 -3.728 -3.415 1.00 . A A . 34 LYS CA 1 1 13 9749 1 1 32 LYS CB C 1.010 -3.795 -4.912 1.00 . A A . 34 LYS CB 1 1 13 9750 1 1 32 LYS CD C 1.590 -2.237 -6.775 1.00 . A A . 34 LYS CD 1 1 13 9751 1 1 32 LYS CE C 2.517 -1.047 -6.520 1.00 . A A . 34 LYS CE 1 1 13 9752 1 1 32 LYS CG C 0.685 -2.448 -5.561 1.00 . A A . 34 LYS CG 1 1 13 9753 1 1 32 LYS H H 2.032 -5.395 -3.208 1.00 . A A . 34 LYS H 1 1 13 9754 1 1 32 LYS HA H 1.070 -2.791 -3.024 1.00 . A A . 34 LYS HA 1 1 13 9755 1 1 32 LYS HB2 H 2.056 -4.023 -5.058 1.00 . A A . 34 LYS HB2 1 1 13 9756 1 1 32 LYS HB3 H 0.406 -4.566 -5.367 1.00 . A A . 34 LYS HB3 1 1 13 9757 1 1 32 LYS HD2 H 2.181 -3.126 -6.943 1.00 . A A . 34 LYS HD2 1 1 13 9758 1 1 32 LYS HD3 H 0.984 -2.038 -7.645 1.00 . A A . 34 LYS HD3 1 1 13 9759 1 1 32 LYS HE2 H 2.239 -0.228 -7.167 1.00 . A A . 34 LYS HE2 1 1 13 9760 1 1 32 LYS HE3 H 2.430 -0.737 -5.489 1.00 . A A . 34 LYS HE3 1 1 13 9761 1 1 32 LYS HG2 H -0.349 -2.440 -5.874 1.00 . A A . 34 LYS HG2 1 1 13 9762 1 1 32 LYS HG3 H 0.851 -1.655 -4.847 1.00 . A A . 34 LYS HG3 1 1 13 9763 1 1 32 LYS HZ1 H 3.990 -1.842 -7.759 1.00 . A A . 34 LYS HZ1 1 1 13 9764 1 1 32 LYS HZ2 H 4.230 -2.156 -6.107 1.00 . A A . 34 LYS HZ2 1 1 13 9765 1 1 32 LYS HZ3 H 4.542 -0.608 -6.735 1.00 . A A . 34 LYS HZ3 1 1 13 9766 1 1 32 LYS N N 1.406 -4.847 -2.719 1.00 . A A . 34 LYS N 1 1 13 9767 1 1 32 LYS NZ N 3.926 -1.443 -6.802 1.00 . A A . 34 LYS NZ 1 1 13 9768 1 1 32 LYS O O -1.515 -2.856 -3.437 1.00 . A A . 34 LYS O 1 1 13 9769 1 1 33 CYS C C -3.121 -4.295 -1.218 1.00 . A A . 35 CYS C 1 1 13 9770 1 1 33 CYS CA C -2.785 -5.014 -2.526 1.00 . A A . 35 CYS CA 1 1 13 9771 1 1 33 CYS CB C -3.197 -6.481 -2.428 1.00 . A A . 35 CYS CB 1 1 13 9772 1 1 33 CYS H H -0.732 -5.689 -2.561 1.00 . A A . 35 CYS H 1 1 13 9773 1 1 33 CYS HA H -3.307 -4.542 -3.344 1.00 . A A . 35 CYS HA 1 1 13 9774 1 1 33 CYS HB2 H -2.899 -6.998 -3.329 1.00 . A A . 35 CYS HB2 1 1 13 9775 1 1 33 CYS HB3 H -2.713 -6.933 -1.576 1.00 . A A . 35 CYS HB3 1 1 13 9776 1 1 33 CYS N N -1.312 -4.921 -2.752 1.00 . A A . 35 CYS N 1 1 13 9777 1 1 33 CYS O O -4.182 -3.725 -1.054 1.00 . A A . 35 CYS O 1 1 13 9778 1 1 33 CYS SG S -4.992 -6.590 -2.236 1.00 . A A . 35 CYS SG 1 1 13 9779 1 1 34 ASN C C -2.109 -2.147 0.807 1.00 . A A . 36 ASN C 1 1 13 9780 1 1 34 ASN CA C -2.398 -3.630 1.001 1.00 . A A . 36 ASN CA 1 1 13 9781 1 1 34 ASN CB C -1.400 -4.203 2.007 1.00 . A A . 36 ASN CB 1 1 13 9782 1 1 34 ASN CG C -2.138 -4.706 3.248 1.00 . A A . 36 ASN CG 1 1 13 9783 1 1 34 ASN H H -1.362 -4.758 -0.469 1.00 . A A . 36 ASN H 1 1 13 9784 1 1 34 ASN HA H -3.408 -3.773 1.353 1.00 . A A . 36 ASN HA 1 1 13 9785 1 1 34 ASN HB2 H -0.858 -5.021 1.550 1.00 . A A . 36 ASN HB2 1 1 13 9786 1 1 34 ASN HB3 H -0.705 -3.433 2.289 1.00 . A A . 36 ASN HB3 1 1 13 9787 1 1 34 ASN HD21 H -1.969 -6.619 2.746 1.00 . A A . 36 ASN HD21 1 1 13 9788 1 1 34 ASN HD22 H -2.783 -6.322 4.205 1.00 . A A . 36 ASN HD22 1 1 13 9789 1 1 34 ASN N N -2.201 -4.310 -0.298 1.00 . A A . 36 ASN N 1 1 13 9790 1 1 34 ASN ND2 N -2.311 -5.989 3.414 1.00 . A A . 36 ASN ND2 1 1 13 9791 1 1 34 ASN O O -2.544 -1.307 1.568 1.00 . A A . 36 ASN O 1 1 13 9792 1 1 34 ASN OD1 O -2.560 -3.923 4.077 1.00 . A A . 36 ASN OD1 1 1 13 9793 1 1 35 PHE C C -2.202 0.262 -1.207 1.00 . A A . 37 PHE C 1 1 13 9794 1 1 35 PHE CA C -1.034 -0.404 -0.480 1.00 . A A . 37 PHE CA 1 1 13 9795 1 1 35 PHE CB C 0.218 -0.316 -1.357 1.00 . A A . 37 PHE CB 1 1 13 9796 1 1 35 PHE CD1 C 0.997 1.950 -0.528 1.00 . A A . 37 PHE CD1 1 1 13 9797 1 1 35 PHE CD2 C 0.304 1.717 -2.844 1.00 . A A . 37 PHE CD2 1 1 13 9798 1 1 35 PHE CE1 C 1.254 3.312 -0.743 1.00 . A A . 37 PHE CE1 1 1 13 9799 1 1 35 PHE CE2 C 0.553 3.078 -3.055 1.00 . A A . 37 PHE CE2 1 1 13 9800 1 1 35 PHE CG C 0.523 1.150 -1.582 1.00 . A A . 37 PHE CG 1 1 13 9801 1 1 35 PHE CZ C 1.029 3.874 -2.006 1.00 . A A . 37 PHE CZ 1 1 13 9802 1 1 35 PHE H H -1.029 -2.523 -0.817 1.00 . A A . 37 PHE H 1 1 13 9803 1 1 35 PHE HA H -0.858 0.104 0.455 1.00 . A A . 37 PHE HA 1 1 13 9804 1 1 35 PHE HB2 H 1.053 -0.809 -0.870 1.00 . A A . 37 PHE HB2 1 1 13 9805 1 1 35 PHE HB3 H 0.030 -0.796 -2.308 1.00 . A A . 37 PHE HB3 1 1 13 9806 1 1 35 PHE HD1 H 1.174 1.516 0.446 1.00 . A A . 37 PHE HD1 1 1 13 9807 1 1 35 PHE HD2 H -0.060 1.104 -3.655 1.00 . A A . 37 PHE HD2 1 1 13 9808 1 1 35 PHE HE1 H 1.627 3.929 0.067 1.00 . A A . 37 PHE HE1 1 1 13 9809 1 1 35 PHE HE2 H 0.383 3.515 -4.028 1.00 . A A . 37 PHE HE2 1 1 13 9810 1 1 35 PHE HZ H 1.219 4.923 -2.172 1.00 . A A . 37 PHE HZ 1 1 13 9811 1 1 35 PHE N N -1.367 -1.825 -0.218 1.00 . A A . 37 PHE N 1 1 13 9812 1 1 35 PHE O O -2.687 1.300 -0.804 1.00 . A A . 37 PHE O 1 1 13 9813 1 1 36 CYS C C -5.000 0.342 -2.087 1.00 . A A . 38 CYS C 1 1 13 9814 1 1 36 CYS CA C -3.799 0.265 -3.022 1.00 . A A . 38 CYS CA 1 1 13 9815 1 1 36 CYS CB C -4.141 -0.615 -4.227 1.00 . A A . 38 CYS CB 1 1 13 9816 1 1 36 CYS H H -2.260 -1.168 -2.570 1.00 . A A . 38 CYS H 1 1 13 9817 1 1 36 CYS HA H -3.534 1.257 -3.358 1.00 . A A . 38 CYS HA 1 1 13 9818 1 1 36 CYS HB2 H -4.370 -1.614 -3.889 1.00 . A A . 38 CYS HB2 1 1 13 9819 1 1 36 CYS HB3 H -4.997 -0.203 -4.740 1.00 . A A . 38 CYS HB3 1 1 13 9820 1 1 36 CYS N N -2.660 -0.331 -2.272 1.00 . A A . 38 CYS N 1 1 13 9821 1 1 36 CYS O O -5.855 1.196 -2.220 1.00 . A A . 38 CYS O 1 1 13 9822 1 1 36 CYS SG S -2.729 -0.673 -5.360 1.00 . A A . 38 CYS SG 1 1 13 9823 1 1 37 CYS C C -6.011 0.674 0.772 1.00 . A A . 39 CYS C 1 1 13 9824 1 1 37 CYS CA C -6.195 -0.517 -0.165 1.00 . A A . 39 CYS CA 1 1 13 9825 1 1 37 CYS CB C -6.203 -1.812 0.649 1.00 . A A . 39 CYS CB 1 1 13 9826 1 1 37 CYS H H -4.347 -1.211 -1.038 1.00 . A A . 39 CYS H 1 1 13 9827 1 1 37 CYS HA H -7.126 -0.416 -0.700 1.00 . A A . 39 CYS HA 1 1 13 9828 1 1 37 CYS HB2 H -5.818 -2.619 0.045 1.00 . A A . 39 CYS HB2 1 1 13 9829 1 1 37 CYS HB3 H -5.582 -1.690 1.524 1.00 . A A . 39 CYS HB3 1 1 13 9830 1 1 37 CYS N N -5.059 -0.540 -1.129 1.00 . A A . 39 CYS N 1 1 13 9831 1 1 37 CYS O O -6.934 1.416 1.050 1.00 . A A . 39 CYS O 1 1 13 9832 1 1 37 CYS SG S -7.897 -2.195 1.162 1.00 . A A . 39 CYS SG 1 1 13 9833 1 1 38 ALA C C -4.623 3.309 1.345 1.00 . A A . 40 ALA C 1 1 13 9834 1 1 38 ALA CA C -4.550 2.014 2.156 1.00 . A A . 40 ALA CA 1 1 13 9835 1 1 38 ALA CB C -3.155 1.868 2.770 1.00 . A A . 40 ALA CB 1 1 13 9836 1 1 38 ALA H H -4.087 0.260 0.996 1.00 . A A . 40 ALA H 1 1 13 9837 1 1 38 ALA HA H -5.291 2.032 2.940 1.00 . A A . 40 ALA HA 1 1 13 9838 1 1 38 ALA HB1 H -2.747 2.847 2.973 1.00 . A A . 40 ALA HB1 1 1 13 9839 1 1 38 ALA HB2 H -2.511 1.346 2.079 1.00 . A A . 40 ALA HB2 1 1 13 9840 1 1 38 ALA HB3 H -3.224 1.308 3.691 1.00 . A A . 40 ALA HB3 1 1 13 9841 1 1 38 ALA N N -4.815 0.867 1.248 1.00 . A A . 40 ALA N 1 1 13 9842 1 1 38 ALA O O -4.729 4.391 1.887 1.00 . A A . 40 ALA O 1 1 13 9843 1 1 39 VAL C C -6.086 4.904 -0.890 1.00 . A A . 41 VAL C 1 1 13 9844 1 1 39 VAL CA C -4.639 4.423 -0.809 1.00 . A A . 41 VAL CA 1 1 13 9845 1 1 39 VAL CB C -4.137 4.092 -2.217 1.00 . A A . 41 VAL CB 1 1 13 9846 1 1 39 VAL CG1 C -4.444 5.259 -3.158 1.00 . A A . 41 VAL CG1 1 1 13 9847 1 1 39 VAL CG2 C -2.627 3.856 -2.179 1.00 . A A . 41 VAL CG2 1 1 13 9848 1 1 39 VAL H H -4.485 2.319 -0.371 1.00 . A A . 41 VAL H 1 1 13 9849 1 1 39 VAL HA H -4.027 5.197 -0.380 1.00 . A A . 41 VAL HA 1 1 13 9850 1 1 39 VAL HB H -4.634 3.201 -2.574 1.00 . A A . 41 VAL HB 1 1 13 9851 1 1 39 VAL HG11 H -5.400 5.095 -3.635 1.00 . A A . 41 VAL HG11 1 1 13 9852 1 1 39 VAL HG12 H -3.674 5.326 -3.912 1.00 . A A . 41 VAL HG12 1 1 13 9853 1 1 39 VAL HG13 H -4.477 6.179 -2.594 1.00 . A A . 41 VAL HG13 1 1 13 9854 1 1 39 VAL HG21 H -2.373 3.306 -1.287 1.00 . A A . 41 VAL HG21 1 1 13 9855 1 1 39 VAL HG22 H -2.113 4.805 -2.176 1.00 . A A . 41 VAL HG22 1 1 13 9856 1 1 39 VAL HG23 H -2.330 3.288 -3.049 1.00 . A A . 41 VAL HG23 1 1 13 9857 1 1 39 VAL N N -4.570 3.203 0.044 1.00 . A A . 41 VAL N 1 1 13 9858 1 1 39 VAL O O -6.370 6.078 -0.765 1.00 . A A . 41 VAL O 1 1 13 9859 1 1 40 VAL C C -8.904 4.934 0.164 1.00 . A A . 42 VAL C 1 1 13 9860 1 1 40 VAL CA C -8.432 4.407 -1.193 1.00 . A A . 42 VAL CA 1 1 13 9861 1 1 40 VAL CB C -9.277 3.197 -1.597 1.00 . A A . 42 VAL CB 1 1 13 9862 1 1 40 VAL CG1 C -10.738 3.624 -1.757 1.00 . A A . 42 VAL CG1 1 1 13 9863 1 1 40 VAL CG2 C -8.761 2.643 -2.928 1.00 . A A . 42 VAL CG2 1 1 13 9864 1 1 40 VAL H H -6.747 3.064 -1.199 1.00 . A A . 42 VAL H 1 1 13 9865 1 1 40 VAL HA H -8.539 5.183 -1.936 1.00 . A A . 42 VAL HA 1 1 13 9866 1 1 40 VAL HB H -9.205 2.435 -0.834 1.00 . A A . 42 VAL HB 1 1 13 9867 1 1 40 VAL HG11 H -10.852 4.179 -2.677 1.00 . A A . 42 VAL HG11 1 1 13 9868 1 1 40 VAL HG12 H -11.025 4.247 -0.923 1.00 . A A . 42 VAL HG12 1 1 13 9869 1 1 40 VAL HG13 H -11.367 2.747 -1.784 1.00 . A A . 42 VAL HG13 1 1 13 9870 1 1 40 VAL HG21 H -8.699 3.442 -3.651 1.00 . A A . 42 VAL HG21 1 1 13 9871 1 1 40 VAL HG22 H -9.438 1.882 -3.289 1.00 . A A . 42 VAL HG22 1 1 13 9872 1 1 40 VAL HG23 H -7.781 2.213 -2.782 1.00 . A A . 42 VAL HG23 1 1 13 9873 1 1 40 VAL N N -7.002 4.004 -1.100 1.00 . A A . 42 VAL N 1 1 13 9874 1 1 40 VAL O O -9.834 5.709 0.248 1.00 . A A . 42 VAL O 1 1 13 9875 1 1 41 GLU C C -7.988 6.333 2.885 1.00 . A A . 43 GLU C 1 1 13 9876 1 1 41 GLU CA C -8.689 5.008 2.574 1.00 . A A . 43 GLU CA 1 1 13 9877 1 1 41 GLU CB C -8.314 3.973 3.636 1.00 . A A . 43 GLU CB 1 1 13 9878 1 1 41 GLU CD C -6.434 3.094 5.028 1.00 . A A . 43 GLU CD 1 1 13 9879 1 1 41 GLU CG C -6.795 3.957 3.817 1.00 . A A . 43 GLU CG 1 1 13 9880 1 1 41 GLU H H -7.518 3.895 1.143 1.00 . A A . 43 GLU H 1 1 13 9881 1 1 41 GLU HA H -9.759 5.159 2.584 1.00 . A A . 43 GLU HA 1 1 13 9882 1 1 41 GLU HB2 H -8.786 4.229 4.572 1.00 . A A . 43 GLU HB2 1 1 13 9883 1 1 41 GLU HB3 H -8.646 2.996 3.319 1.00 . A A . 43 GLU HB3 1 1 13 9884 1 1 41 GLU HG2 H -6.333 3.549 2.931 1.00 . A A . 43 GLU HG2 1 1 13 9885 1 1 41 GLU HG3 H -6.439 4.963 3.978 1.00 . A A . 43 GLU HG3 1 1 13 9886 1 1 41 GLU N N -8.269 4.522 1.228 1.00 . A A . 43 GLU N 1 1 13 9887 1 1 41 GLU O O -8.476 7.140 3.651 1.00 . A A . 43 GLU O 1 1 13 9888 1 1 41 GLU OE1 O -6.290 1.895 4.854 1.00 . A A . 43 GLU OE1 1 1 13 9889 1 1 41 GLU OE2 O -6.308 3.648 6.108 1.00 . A A . 43 GLU OE2 1 1 13 9890 1 1 42 SER C C -6.678 8.938 1.652 1.00 . A A . 44 SER C 1 1 13 9891 1 1 42 SER CA C -6.119 7.837 2.559 1.00 . A A . 44 SER CA 1 1 13 9892 1 1 42 SER CB C -4.629 7.638 2.274 1.00 . A A . 44 SER CB 1 1 13 9893 1 1 42 SER H H -6.468 5.901 1.682 1.00 . A A . 44 SER H 1 1 13 9894 1 1 42 SER HA H -6.253 8.121 3.593 1.00 . A A . 44 SER HA 1 1 13 9895 1 1 42 SER HB2 H -4.242 6.857 2.908 1.00 . A A . 44 SER HB2 1 1 13 9896 1 1 42 SER HB3 H -4.496 7.354 1.238 1.00 . A A . 44 SER HB3 1 1 13 9897 1 1 42 SER HG H -3.247 8.659 3.188 1.00 . A A . 44 SER HG 1 1 13 9898 1 1 42 SER N N -6.847 6.564 2.297 1.00 . A A . 44 SER N 1 1 13 9899 1 1 42 SER O O -6.190 10.051 1.636 1.00 . A A . 44 SER O 1 1 13 9900 1 1 42 SER OG O -3.932 8.846 2.542 1.00 . A A . 44 SER OG 1 1 13 9901 1 1 43 ASN C C -7.386 9.844 -1.229 1.00 . A A . 45 ASN C 1 1 13 9902 1 1 43 ASN CA C -8.291 9.663 -0.009 1.00 . A A . 45 ASN CA 1 1 13 9903 1 1 43 ASN CB C -8.414 10.994 0.736 1.00 . A A . 45 ASN CB 1 1 13 9904 1 1 43 ASN CG C -9.829 11.547 0.561 1.00 . A A . 45 ASN CG 1 1 13 9905 1 1 43 ASN H H -8.080 7.735 0.923 1.00 . A A . 45 ASN H 1 1 13 9906 1 1 43 ASN HA H -9.269 9.338 -0.331 1.00 . A A . 45 ASN HA 1 1 13 9907 1 1 43 ASN HB2 H -8.214 10.838 1.787 1.00 . A A . 45 ASN HB2 1 1 13 9908 1 1 43 ASN HB3 H -7.702 11.697 0.334 1.00 . A A . 45 ASN HB3 1 1 13 9909 1 1 43 ASN HD21 H -10.711 9.889 1.206 1.00 . A A . 45 ASN HD21 1 1 13 9910 1 1 43 ASN HD22 H -11.763 11.144 0.758 1.00 . A A . 45 ASN HD22 1 1 13 9911 1 1 43 ASN N N -7.701 8.637 0.896 1.00 . A A . 45 ASN N 1 1 13 9912 1 1 43 ASN ND2 N -10.853 10.798 0.868 1.00 . A A . 45 ASN ND2 1 1 13 9913 1 1 43 ASN O O -7.520 10.789 -1.979 1.00 . A A . 45 ASN O 1 1 13 9914 1 1 43 ASN OD1 O -10.005 12.674 0.143 1.00 . A A . 45 ASN OD1 1 1 13 9915 1 1 44 GLY C C -4.255 9.761 -2.147 1.00 . A A . 46 GLY C 1 1 13 9916 1 1 44 GLY CA C -5.543 9.070 -2.596 1.00 . A A . 46 GLY CA 1 1 13 9917 1 1 44 GLY H H -6.365 8.195 -0.808 1.00 . A A . 46 GLY H 1 1 13 9918 1 1 44 GLY HA2 H -5.313 8.088 -2.980 1.00 . A A . 46 GLY HA2 1 1 13 9919 1 1 44 GLY HA3 H -6.015 9.659 -3.367 1.00 . A A . 46 GLY HA3 1 1 13 9920 1 1 44 GLY N N -6.461 8.946 -1.430 1.00 . A A . 46 GLY N 1 1 13 9921 1 1 44 GLY O O -3.386 10.054 -2.945 1.00 . A A . 46 GLY O 1 1 13 9922 1 1 45 THR C C -1.795 9.646 -0.183 1.00 . A A . 47 THR C 1 1 13 9923 1 1 45 THR CA C -2.900 10.690 -0.369 1.00 . A A . 47 THR CA 1 1 13 9924 1 1 45 THR CB C -3.217 11.364 0.969 1.00 . A A . 47 THR CB 1 1 13 9925 1 1 45 THR CG2 C -1.919 11.706 1.700 1.00 . A A . 47 THR CG2 1 1 13 9926 1 1 45 THR H H -4.837 9.776 -0.249 1.00 . A A . 47 THR H 1 1 13 9927 1 1 45 THR HA H -2.576 11.433 -1.079 1.00 . A A . 47 THR HA 1 1 13 9928 1 1 45 THR HB H -3.802 10.694 1.578 1.00 . A A . 47 THR HB 1 1 13 9929 1 1 45 THR HG1 H -3.595 12.984 -0.044 1.00 . A A . 47 THR HG1 1 1 13 9930 1 1 45 THR HG21 H -1.990 12.699 2.115 1.00 . A A . 47 THR HG21 1 1 13 9931 1 1 45 THR HG22 H -1.094 11.663 1.004 1.00 . A A . 47 THR HG22 1 1 13 9932 1 1 45 THR HG23 H -1.758 10.992 2.494 1.00 . A A . 47 THR HG23 1 1 13 9933 1 1 45 THR N N -4.125 10.021 -0.876 1.00 . A A . 47 THR N 1 1 13 9934 1 1 45 THR O O -0.631 9.917 -0.397 1.00 . A A . 47 THR O 1 1 13 9935 1 1 45 THR OG1 O -3.958 12.554 0.734 1.00 . A A . 47 THR OG1 1 1 13 9936 1 1 46 LEU C C -0.173 7.396 -0.798 1.00 . A A . 48 LEU C 1 1 13 9937 1 1 46 LEU CA C -1.118 7.395 0.403 1.00 . A A . 48 LEU CA 1 1 13 9938 1 1 46 LEU CB C -1.792 6.027 0.518 1.00 . A A . 48 LEU CB 1 1 13 9939 1 1 46 LEU CD1 C -1.564 5.219 2.873 1.00 . A A . 48 LEU CD1 1 1 13 9940 1 1 46 LEU CD2 C -1.012 3.697 0.974 1.00 . A A . 48 LEU CD2 1 1 13 9941 1 1 46 LEU CG C -0.975 5.144 1.464 1.00 . A A . 48 LEU CG 1 1 13 9942 1 1 46 LEU H H -3.097 8.253 0.375 1.00 . A A . 48 LEU H 1 1 13 9943 1 1 46 LEU HA H -0.557 7.598 1.303 1.00 . A A . 48 LEU HA 1 1 13 9944 1 1 46 LEU HB2 H -2.792 6.150 0.908 1.00 . A A . 48 LEU HB2 1 1 13 9945 1 1 46 LEU HB3 H -1.837 5.564 -0.455 1.00 . A A . 48 LEU HB3 1 1 13 9946 1 1 46 LEU HD11 H -2.575 4.839 2.862 1.00 . A A . 48 LEU HD11 1 1 13 9947 1 1 46 LEU HD12 H -1.569 6.246 3.207 1.00 . A A . 48 LEU HD12 1 1 13 9948 1 1 46 LEU HD13 H -0.963 4.625 3.545 1.00 . A A . 48 LEU HD13 1 1 13 9949 1 1 46 LEU HD21 H -0.996 3.682 -0.105 1.00 . A A . 48 LEU HD21 1 1 13 9950 1 1 46 LEU HD22 H -1.914 3.220 1.327 1.00 . A A . 48 LEU HD22 1 1 13 9951 1 1 46 LEU HD23 H -0.152 3.166 1.354 1.00 . A A . 48 LEU HD23 1 1 13 9952 1 1 46 LEU HG H 0.047 5.492 1.484 1.00 . A A . 48 LEU HG 1 1 13 9953 1 1 46 LEU N N -2.151 8.452 0.211 1.00 . A A . 48 LEU N 1 1 13 9954 1 1 46 LEU O O -0.569 7.699 -1.905 1.00 . A A . 48 LEU O 1 1 13 9955 1 1 47 THR C C 3.142 6.044 -1.535 1.00 . A A . 49 THR C 1 1 13 9956 1 1 47 THR CA C 2.027 7.080 -1.741 1.00 . A A . 49 THR CA 1 1 13 9957 1 1 47 THR CB C 2.637 8.473 -1.874 1.00 . A A . 49 THR CB 1 1 13 9958 1 1 47 THR CG2 C 1.755 9.330 -2.785 1.00 . A A . 49 THR CG2 1 1 13 9959 1 1 47 THR H H 1.387 6.840 0.305 1.00 . A A . 49 THR H 1 1 13 9960 1 1 47 THR HA H 1.496 6.847 -2.648 1.00 . A A . 49 THR HA 1 1 13 9961 1 1 47 THR HB H 3.615 8.392 -2.306 1.00 . A A . 49 THR HB 1 1 13 9962 1 1 47 THR HG1 H 3.255 9.875 -0.675 1.00 . A A . 49 THR HG1 1 1 13 9963 1 1 47 THR HG21 H 2.366 9.789 -3.549 1.00 . A A . 49 THR HG21 1 1 13 9964 1 1 47 THR HG22 H 1.273 10.099 -2.200 1.00 . A A . 49 THR HG22 1 1 13 9965 1 1 47 THR HG23 H 1.005 8.707 -3.249 1.00 . A A . 49 THR HG23 1 1 13 9966 1 1 47 THR N N 1.077 7.073 -0.595 1.00 . A A . 49 THR N 1 1 13 9967 1 1 47 THR O O 3.082 5.206 -0.660 1.00 . A A . 49 THR O 1 1 13 9968 1 1 47 THR OG1 O 2.727 9.077 -0.592 1.00 . A A . 49 THR OG1 1 1 13 9969 1 1 48 LEU C C 6.531 5.966 -1.810 1.00 . A A . 50 LEU C 1 1 13 9970 1 1 48 LEU CA C 5.306 5.168 -2.258 1.00 . A A . 50 LEU CA 1 1 13 9971 1 1 48 LEU CB C 5.561 4.557 -3.646 1.00 . A A . 50 LEU CB 1 1 13 9972 1 1 48 LEU CD1 C 6.356 2.515 -2.433 1.00 . A A . 50 LEU CD1 1 1 13 9973 1 1 48 LEU CD2 C 6.720 2.723 -4.889 1.00 . A A . 50 LEU CD2 1 1 13 9974 1 1 48 LEU CG C 6.662 3.494 -3.568 1.00 . A A . 50 LEU CG 1 1 13 9975 1 1 48 LEU H H 4.167 6.803 -3.036 1.00 . A A . 50 LEU H 1 1 13 9976 1 1 48 LEU HA H 5.092 4.381 -1.544 1.00 . A A . 50 LEU HA 1 1 13 9977 1 1 48 LEU HB2 H 4.650 4.101 -4.007 1.00 . A A . 50 LEU HB2 1 1 13 9978 1 1 48 LEU HB3 H 5.864 5.337 -4.329 1.00 . A A . 50 LEU HB3 1 1 13 9979 1 1 48 LEU HD11 H 7.104 1.737 -2.417 1.00 . A A . 50 LEU HD11 1 1 13 9980 1 1 48 LEU HD12 H 5.385 2.075 -2.595 1.00 . A A . 50 LEU HD12 1 1 13 9981 1 1 48 LEU HD13 H 6.359 3.039 -1.489 1.00 . A A . 50 LEU HD13 1 1 13 9982 1 1 48 LEU HD21 H 6.383 1.710 -4.728 1.00 . A A . 50 LEU HD21 1 1 13 9983 1 1 48 LEU HD22 H 7.736 2.711 -5.254 1.00 . A A . 50 LEU HD22 1 1 13 9984 1 1 48 LEU HD23 H 6.082 3.205 -5.616 1.00 . A A . 50 LEU HD23 1 1 13 9985 1 1 48 LEU HG H 7.614 3.972 -3.389 1.00 . A A . 50 LEU HG 1 1 13 9986 1 1 48 LEU N N 4.157 6.113 -2.352 1.00 . A A . 50 LEU N 1 1 13 9987 1 1 48 LEU O O 6.482 7.177 -1.704 1.00 . A A . 50 LEU O 1 1 13 9988 1 1 49 SER C C 10.075 5.440 -1.733 1.00 . A A . 51 SER C 1 1 13 9989 1 1 49 SER CA C 8.833 6.064 -1.103 1.00 . A A . 51 SER CA 1 1 13 9990 1 1 49 SER CB C 8.949 5.997 0.419 1.00 . A A . 51 SER CB 1 1 13 9991 1 1 49 SER H H 7.651 4.347 -1.631 1.00 . A A . 51 SER H 1 1 13 9992 1 1 49 SER HA H 8.753 7.095 -1.412 1.00 . A A . 51 SER HA 1 1 13 9993 1 1 49 SER HB2 H 7.970 5.896 0.852 1.00 . A A . 51 SER HB2 1 1 13 9994 1 1 49 SER HB3 H 9.552 5.143 0.694 1.00 . A A . 51 SER HB3 1 1 13 9995 1 1 49 SER HG H 9.246 7.920 0.350 1.00 . A A . 51 SER HG 1 1 13 9996 1 1 49 SER N N 7.624 5.318 -1.544 1.00 . A A . 51 SER N 1 1 13 9997 1 1 49 SER O O 11.018 6.125 -2.074 1.00 . A A . 51 SER O 1 1 13 9998 1 1 49 SER OG O 9.552 7.193 0.897 1.00 . A A . 51 SER OG 1 1 13 9999 1 1 50 HIS C C 11.167 1.981 -2.307 1.00 . A A . 52 HIS C 1 1 13 10000 1 1 50 HIS CA C 11.276 3.497 -2.490 1.00 . A A . 52 HIS CA 1 1 13 10001 1 1 50 HIS CB C 12.551 4.060 -1.820 1.00 . A A . 52 HIS CB 1 1 13 10002 1 1 50 HIS CD2 C 14.453 2.246 -1.637 1.00 . A A . 52 HIS CD2 1 1 13 10003 1 1 50 HIS CE1 C 14.003 1.517 0.353 1.00 . A A . 52 HIS CE1 1 1 13 10004 1 1 50 HIS CG C 13.373 2.963 -1.186 1.00 . A A . 52 HIS CG 1 1 13 10005 1 1 50 HIS H H 9.324 3.603 -1.607 1.00 . A A . 52 HIS H 1 1 13 10006 1 1 50 HIS HA H 11.303 3.723 -3.547 1.00 . A A . 52 HIS HA 1 1 13 10007 1 1 50 HIS HB2 H 13.149 4.560 -2.565 1.00 . A A . 52 HIS HB2 1 1 13 10008 1 1 50 HIS HB3 H 12.265 4.774 -1.062 1.00 . A A . 52 HIS HB3 1 1 13 10009 1 1 50 HIS HD1 H 12.384 2.784 0.679 1.00 . A A . 52 HIS HD1 1 1 13 10010 1 1 50 HIS HD2 H 14.920 2.368 -2.603 1.00 . A A . 52 HIS HD2 1 1 13 10011 1 1 50 HIS HE1 H 14.037 0.961 1.277 1.00 . A A . 52 HIS HE1 1 1 13 10012 1 1 50 HIS N N 10.090 4.146 -1.887 1.00 . A A . 52 HIS N 1 1 13 10013 1 1 50 HIS ND1 N 13.103 2.481 0.086 1.00 . A A . 52 HIS ND1 1 1 13 10014 1 1 50 HIS NE2 N 14.849 1.334 -0.663 1.00 . A A . 52 HIS NE2 1 1 13 10015 1 1 50 HIS O O 11.227 1.466 -1.206 1.00 . A A . 52 HIS O 1 1 13 10016 1 1 51 PHE C C 12.029 -0.708 -2.348 1.00 . A A . 53 PHE C 1 1 13 10017 1 1 51 PHE CA C 10.923 -0.214 -3.284 1.00 . A A . 53 PHE CA 1 1 13 10018 1 1 51 PHE CB C 11.129 -0.827 -4.673 1.00 . A A . 53 PHE CB 1 1 13 10019 1 1 51 PHE CD1 C 8.772 -0.390 -5.458 1.00 . A A . 53 PHE CD1 1 1 13 10020 1 1 51 PHE CD2 C 9.624 -2.659 -5.528 1.00 . A A . 53 PHE CD2 1 1 13 10021 1 1 51 PHE CE1 C 7.551 -0.834 -5.984 1.00 . A A . 53 PHE CE1 1 1 13 10022 1 1 51 PHE CE2 C 8.405 -3.103 -6.054 1.00 . A A . 53 PHE CE2 1 1 13 10023 1 1 51 PHE CG C 9.808 -1.304 -5.230 1.00 . A A . 53 PHE CG 1 1 13 10024 1 1 51 PHE CZ C 7.368 -2.190 -6.283 1.00 . A A . 53 PHE CZ 1 1 13 10025 1 1 51 PHE H H 10.971 1.708 -4.252 1.00 . A A . 53 PHE H 1 1 13 10026 1 1 51 PHE HA H 9.956 -0.499 -2.896 1.00 . A A . 53 PHE HA 1 1 13 10027 1 1 51 PHE HB2 H 11.548 -0.083 -5.333 1.00 . A A . 53 PHE HB2 1 1 13 10028 1 1 51 PHE HB3 H 11.808 -1.663 -4.599 1.00 . A A . 53 PHE HB3 1 1 13 10029 1 1 51 PHE HD1 H 8.912 0.655 -5.229 1.00 . A A . 53 PHE HD1 1 1 13 10030 1 1 51 PHE HD2 H 10.424 -3.364 -5.352 1.00 . A A . 53 PHE HD2 1 1 13 10031 1 1 51 PHE HE1 H 6.753 -0.130 -6.161 1.00 . A A . 53 PHE HE1 1 1 13 10032 1 1 51 PHE HE2 H 8.263 -4.149 -6.284 1.00 . A A . 53 PHE HE2 1 1 13 10033 1 1 51 PHE HZ H 6.428 -2.531 -6.688 1.00 . A A . 53 PHE HZ 1 1 13 10034 1 1 51 PHE N N 11.015 1.268 -3.382 1.00 . A A . 53 PHE N 1 1 13 10035 1 1 51 PHE O O 13.178 -0.337 -2.485 1.00 . A A . 53 PHE O 1 1 13 10036 1 1 52 GLY C C 12.272 -1.863 0.984 1.00 . A A . 54 GLY C 1 1 13 10037 1 1 52 GLY CA C 12.746 -2.040 -0.459 1.00 . A A . 54 GLY CA 1 1 13 10038 1 1 52 GLY H H 10.771 -1.825 -1.294 1.00 . A A . 54 GLY H 1 1 13 10039 1 1 52 GLY HA2 H 12.928 -3.087 -0.655 1.00 . A A . 54 GLY HA2 1 1 13 10040 1 1 52 GLY HA3 H 13.659 -1.481 -0.606 1.00 . A A . 54 GLY HA3 1 1 13 10041 1 1 52 GLY N N 11.701 -1.536 -1.395 1.00 . A A . 54 GLY N 1 1 13 10042 1 1 52 GLY O O 11.472 -0.998 1.283 1.00 . A A . 54 GLY O 1 1 13 10043 1 1 53 LYS C C 12.898 -1.269 3.903 1.00 . A A . 55 LYS C 1 1 13 10044 1 1 53 LYS CA C 12.333 -2.558 3.304 1.00 . A A . 55 LYS CA 1 1 13 10045 1 1 53 LYS CB C 12.859 -3.758 4.093 1.00 . A A . 55 LYS CB 1 1 13 10046 1 1 53 LYS CD C 12.140 -4.867 6.214 1.00 . A A . 55 LYS CD 1 1 13 10047 1 1 53 LYS CE C 12.608 -4.919 7.670 1.00 . A A . 55 LYS CE 1 1 13 10048 1 1 53 LYS CG C 12.588 -3.547 5.584 1.00 . A A . 55 LYS CG 1 1 13 10049 1 1 53 LYS H H 13.399 -3.368 1.617 1.00 . A A . 55 LYS H 1 1 13 10050 1 1 53 LYS HA H 11.254 -2.536 3.358 1.00 . A A . 55 LYS HA 1 1 13 10051 1 1 53 LYS HB2 H 12.358 -4.655 3.758 1.00 . A A . 55 LYS HB2 1 1 13 10052 1 1 53 LYS HB3 H 13.922 -3.858 3.933 1.00 . A A . 55 LYS HB3 1 1 13 10053 1 1 53 LYS HD2 H 11.063 -4.935 6.178 1.00 . A A . 55 LYS HD2 1 1 13 10054 1 1 53 LYS HD3 H 12.573 -5.692 5.669 1.00 . A A . 55 LYS HD3 1 1 13 10055 1 1 53 LYS HE2 H 13.147 -5.839 7.842 1.00 . A A . 55 LYS HE2 1 1 13 10056 1 1 53 LYS HE3 H 13.256 -4.079 7.870 1.00 . A A . 55 LYS HE3 1 1 13 10057 1 1 53 LYS HG2 H 13.490 -3.204 6.068 1.00 . A A . 55 LYS HG2 1 1 13 10058 1 1 53 LYS HG3 H 11.808 -2.810 5.706 1.00 . A A . 55 LYS HG3 1 1 13 10059 1 1 53 LYS HZ1 H 11.466 -5.646 9.252 1.00 . A A . 55 LYS HZ1 1 1 13 10060 1 1 53 LYS HZ2 H 10.553 -4.934 8.009 1.00 . A A . 55 LYS HZ2 1 1 13 10061 1 1 53 LYS HZ3 H 11.427 -3.958 9.090 1.00 . A A . 55 LYS HZ3 1 1 13 10062 1 1 53 LYS N N 12.756 -2.677 1.881 1.00 . A A . 55 LYS N 1 1 13 10063 1 1 53 LYS NZ N 11.424 -4.860 8.574 1.00 . A A . 55 LYS NZ 1 1 13 10064 1 1 53 LYS O O 14.093 -1.054 3.922 1.00 . A A . 55 LYS O 1 1 13 10065 1 1 54 CYS C C 13.587 0.565 6.063 1.00 . A A . 56 CYS C 1 1 13 10066 1 1 54 CYS CA C 12.534 0.864 4.993 1.00 . A A . 56 CYS CA 1 1 13 10067 1 1 54 CYS CB C 11.357 1.605 5.626 1.00 . A A . 56 CYS CB 1 1 13 10068 1 1 54 CYS H H 11.083 -0.603 4.369 1.00 . A A . 56 CYS H 1 1 13 10069 1 1 54 CYS HA H 12.969 1.481 4.218 1.00 . A A . 56 CYS HA 1 1 13 10070 1 1 54 CYS HB2 H 10.967 1.025 6.449 1.00 . A A . 56 CYS HB2 1 1 13 10071 1 1 54 CYS HB3 H 11.688 2.567 5.987 1.00 . A A . 56 CYS HB3 1 1 13 10072 1 1 54 CYS N N 12.046 -0.410 4.395 1.00 . A A . 56 CYS N 1 1 13 10073 1 1 54 CYS O O 13.342 -0.307 6.879 1.00 . A A . 56 CYS O 1 1 13 10074 1 1 54 CYS OXT O 14.620 1.215 6.047 1.00 . A A . 56 CYS OXT 1 1 13 10075 1 1 54 CYS SG S 10.063 1.838 4.382 1.00 . A A . 56 CYS SG 1 1 14 10076 1 1 1 ALA C C 8.179 7.667 -10.962 1.00 . A A . 3 ALA C 1 1 14 10077 1 1 1 ALA CA C 8.912 8.991 -10.742 1.00 . A A . 3 ALA CA 1 1 14 10078 1 1 1 ALA CB C 9.314 9.585 -12.093 1.00 . A A . 3 ALA CB 1 1 14 10079 1 1 1 ALA H1 H 10.553 7.838 -10.186 1.00 . A A . 3 ALA H1 1 1 14 10080 1 1 1 ALA H2 H 9.874 8.737 -8.914 1.00 . A A . 3 ALA H2 1 1 14 10081 1 1 1 ALA H3 H 10.820 9.510 -10.094 1.00 . A A . 3 ALA H3 1 1 14 10082 1 1 1 ALA HA H 8.261 9.681 -10.225 1.00 . A A . 3 ALA HA 1 1 14 10083 1 1 1 ALA HB1 H 8.433 9.726 -12.701 1.00 . A A . 3 ALA HB1 1 1 14 10084 1 1 1 ALA HB2 H 9.995 8.913 -12.594 1.00 . A A . 3 ALA HB2 1 1 14 10085 1 1 1 ALA HB3 H 9.799 10.538 -11.936 1.00 . A A . 3 ALA HB3 1 1 14 10086 1 1 1 ALA N N 10.132 8.751 -9.921 1.00 . A A . 3 ALA N 1 1 14 10087 1 1 1 ALA O O 8.559 6.867 -11.793 1.00 . A A . 3 ALA O 1 1 14 10088 1 1 2 VAL C C 5.043 6.254 -9.643 1.00 . A A . 4 VAL C 1 1 14 10089 1 1 2 VAL CA C 6.374 6.157 -10.391 1.00 . A A . 4 VAL CA 1 1 14 10090 1 1 2 VAL CB C 7.197 4.998 -9.826 1.00 . A A . 4 VAL CB 1 1 14 10091 1 1 2 VAL CG1 C 7.391 5.192 -8.321 1.00 . A A . 4 VAL CG1 1 1 14 10092 1 1 2 VAL CG2 C 6.462 3.680 -10.079 1.00 . A A . 4 VAL CG2 1 1 14 10093 1 1 2 VAL H H 6.839 8.088 -9.558 1.00 . A A . 4 VAL H 1 1 14 10094 1 1 2 VAL HA H 6.185 5.987 -11.440 1.00 . A A . 4 VAL HA 1 1 14 10095 1 1 2 VAL HB H 8.162 4.973 -10.311 1.00 . A A . 4 VAL HB 1 1 14 10096 1 1 2 VAL HG11 H 8.316 4.726 -8.013 1.00 . A A . 4 VAL HG11 1 1 14 10097 1 1 2 VAL HG12 H 6.567 4.739 -7.790 1.00 . A A . 4 VAL HG12 1 1 14 10098 1 1 2 VAL HG13 H 7.428 6.247 -8.095 1.00 . A A . 4 VAL HG13 1 1 14 10099 1 1 2 VAL HG21 H 5.770 3.492 -9.272 1.00 . A A . 4 VAL HG21 1 1 14 10100 1 1 2 VAL HG22 H 7.178 2.873 -10.135 1.00 . A A . 4 VAL HG22 1 1 14 10101 1 1 2 VAL HG23 H 5.919 3.744 -11.012 1.00 . A A . 4 VAL HG23 1 1 14 10102 1 1 2 VAL N N 7.130 7.430 -10.224 1.00 . A A . 4 VAL N 1 1 14 10103 1 1 2 VAL O O 4.971 6.035 -8.450 1.00 . A A . 4 VAL O 1 1 14 10104 1 1 3 SER C C 1.840 5.440 -9.934 1.00 . A A . 5 SER C 1 1 14 10105 1 1 3 SER CA C 2.665 6.699 -9.661 1.00 . A A . 5 SER CA 1 1 14 10106 1 1 3 SER CB C 1.923 7.919 -10.202 1.00 . A A . 5 SER CB 1 1 14 10107 1 1 3 SER H H 4.066 6.760 -11.295 1.00 . A A . 5 SER H 1 1 14 10108 1 1 3 SER HA H 2.811 6.809 -8.597 1.00 . A A . 5 SER HA 1 1 14 10109 1 1 3 SER HB2 H 1.097 8.160 -9.552 1.00 . A A . 5 SER HB2 1 1 14 10110 1 1 3 SER HB3 H 2.601 8.762 -10.246 1.00 . A A . 5 SER HB3 1 1 14 10111 1 1 3 SER HG H 2.175 7.482 -12.081 1.00 . A A . 5 SER HG 1 1 14 10112 1 1 3 SER N N 3.988 6.585 -10.334 1.00 . A A . 5 SER N 1 1 14 10113 1 1 3 SER O O 2.167 4.641 -10.789 1.00 . A A . 5 SER O 1 1 14 10114 1 1 3 SER OG O 1.425 7.627 -11.501 1.00 . A A . 5 SER OG 1 1 14 10115 1 1 4 VAL C C -1.545 4.421 -9.141 1.00 . A A . 6 VAL C 1 1 14 10116 1 1 4 VAL CA C -0.087 4.059 -9.429 1.00 . A A . 6 VAL CA 1 1 14 10117 1 1 4 VAL CB C 0.360 2.940 -8.486 1.00 . A A . 6 VAL CB 1 1 14 10118 1 1 4 VAL CG1 C 0.511 3.497 -7.070 1.00 . A A . 6 VAL CG1 1 1 14 10119 1 1 4 VAL CG2 C -0.688 1.825 -8.485 1.00 . A A . 6 VAL CG2 1 1 14 10120 1 1 4 VAL H H 0.519 5.918 -8.531 1.00 . A A . 6 VAL H 1 1 14 10121 1 1 4 VAL HA H 0.007 3.727 -10.453 1.00 . A A . 6 VAL HA 1 1 14 10122 1 1 4 VAL HB H 1.309 2.546 -8.821 1.00 . A A . 6 VAL HB 1 1 14 10123 1 1 4 VAL HG11 H 1.531 3.368 -6.740 1.00 . A A . 6 VAL HG11 1 1 14 10124 1 1 4 VAL HG12 H -0.153 2.969 -6.402 1.00 . A A . 6 VAL HG12 1 1 14 10125 1 1 4 VAL HG13 H 0.262 4.548 -7.067 1.00 . A A . 6 VAL HG13 1 1 14 10126 1 1 4 VAL HG21 H -0.195 0.868 -8.572 1.00 . A A . 6 VAL HG21 1 1 14 10127 1 1 4 VAL HG22 H -1.361 1.962 -9.318 1.00 . A A . 6 VAL HG22 1 1 14 10128 1 1 4 VAL HG23 H -1.247 1.859 -7.561 1.00 . A A . 6 VAL HG23 1 1 14 10129 1 1 4 VAL N N 0.766 5.260 -9.214 1.00 . A A . 6 VAL N 1 1 14 10130 1 1 4 VAL O O -1.853 5.049 -8.148 1.00 . A A . 6 VAL O 1 1 14 10131 1 1 5 ASP C C -4.695 3.077 -9.662 1.00 . A A . 7 ASP C 1 1 14 10132 1 1 5 ASP CA C -3.880 4.366 -9.779 1.00 . A A . 7 ASP CA 1 1 14 10133 1 1 5 ASP CB C -4.401 5.194 -10.955 1.00 . A A . 7 ASP CB 1 1 14 10134 1 1 5 ASP CG C -5.063 6.468 -10.430 1.00 . A A . 7 ASP CG 1 1 14 10135 1 1 5 ASP H H -2.176 3.534 -10.802 1.00 . A A . 7 ASP H 1 1 14 10136 1 1 5 ASP HA H -3.978 4.937 -8.867 1.00 . A A . 7 ASP HA 1 1 14 10137 1 1 5 ASP HB2 H -3.577 5.455 -11.604 1.00 . A A . 7 ASP HB2 1 1 14 10138 1 1 5 ASP HB3 H -5.125 4.615 -11.508 1.00 . A A . 7 ASP HB3 1 1 14 10139 1 1 5 ASP N N -2.444 4.036 -10.005 1.00 . A A . 7 ASP N 1 1 14 10140 1 1 5 ASP O O -4.752 2.280 -10.578 1.00 . A A . 7 ASP O 1 1 14 10141 1 1 5 ASP OD1 O -6.091 6.355 -9.783 1.00 . A A . 7 ASP OD1 1 1 14 10142 1 1 5 ASP OD2 O -4.532 7.537 -10.685 1.00 . A A . 7 ASP OD2 1 1 14 10143 1 1 6 CYS C C -7.538 2.018 -7.863 1.00 . A A . 8 CYS C 1 1 14 10144 1 1 6 CYS CA C -6.145 1.634 -8.363 1.00 . A A . 8 CYS CA 1 1 14 10145 1 1 6 CYS CB C -5.469 0.721 -7.341 1.00 . A A . 8 CYS CB 1 1 14 10146 1 1 6 CYS H H -5.271 3.526 -7.817 1.00 . A A . 8 CYS H 1 1 14 10147 1 1 6 CYS HA H -6.229 1.118 -9.309 1.00 . A A . 8 CYS HA 1 1 14 10148 1 1 6 CYS HB2 H -5.281 1.275 -6.432 1.00 . A A . 8 CYS HB2 1 1 14 10149 1 1 6 CYS HB3 H -6.115 -0.116 -7.124 1.00 . A A . 8 CYS HB3 1 1 14 10150 1 1 6 CYS N N -5.329 2.869 -8.542 1.00 . A A . 8 CYS N 1 1 14 10151 1 1 6 CYS O O -8.204 1.248 -7.198 1.00 . A A . 8 CYS O 1 1 14 10152 1 1 6 CYS SG S -3.902 0.116 -8.014 1.00 . A A . 8 CYS SG 1 1 14 10153 1 1 7 SER C C -10.384 2.711 -8.293 1.00 . A A . 9 SER C 1 1 14 10154 1 1 7 SER CA C -9.325 3.652 -7.727 1.00 . A A . 9 SER CA 1 1 14 10155 1 1 7 SER CB C -9.587 5.073 -8.226 1.00 . A A . 9 SER CB 1 1 14 10156 1 1 7 SER H H -7.426 3.803 -8.713 1.00 . A A . 9 SER H 1 1 14 10157 1 1 7 SER HA H -9.368 3.635 -6.649 1.00 . A A . 9 SER HA 1 1 14 10158 1 1 7 SER HB2 H -9.080 5.227 -9.164 1.00 . A A . 9 SER HB2 1 1 14 10159 1 1 7 SER HB3 H -10.651 5.213 -8.367 1.00 . A A . 9 SER HB3 1 1 14 10160 1 1 7 SER HG H -8.755 6.764 -7.746 1.00 . A A . 9 SER HG 1 1 14 10161 1 1 7 SER N N -7.981 3.206 -8.178 1.00 . A A . 9 SER N 1 1 14 10162 1 1 7 SER O O -10.938 2.939 -9.350 1.00 . A A . 9 SER O 1 1 14 10163 1 1 7 SER OG O -9.097 6.004 -7.271 1.00 . A A . 9 SER OG 1 1 14 10164 1 1 8 GLU C C -11.961 -0.365 -7.014 1.00 . A A . 10 GLU C 1 1 14 10165 1 1 8 GLU CA C -11.695 0.689 -8.078 1.00 . A A . 10 GLU CA 1 1 14 10166 1 1 8 GLU CB C -11.205 0.019 -9.364 1.00 . A A . 10 GLU CB 1 1 14 10167 1 1 8 GLU CD C -13.388 -0.127 -10.570 1.00 . A A . 10 GLU CD 1 1 14 10168 1 1 8 GLU CG C -12.012 0.543 -10.553 1.00 . A A . 10 GLU CG 1 1 14 10169 1 1 8 GLU H H -10.208 1.501 -6.743 1.00 . A A . 10 GLU H 1 1 14 10170 1 1 8 GLU HA H -12.597 1.212 -8.268 1.00 . A A . 10 GLU HA 1 1 14 10171 1 1 8 GLU HB2 H -10.159 0.245 -9.511 1.00 . A A . 10 GLU HB2 1 1 14 10172 1 1 8 GLU HB3 H -11.336 -1.050 -9.286 1.00 . A A . 10 GLU HB3 1 1 14 10173 1 1 8 GLU HG2 H -12.132 1.613 -10.462 1.00 . A A . 10 GLU HG2 1 1 14 10174 1 1 8 GLU HG3 H -11.492 0.315 -11.471 1.00 . A A . 10 GLU HG3 1 1 14 10175 1 1 8 GLU N N -10.668 1.654 -7.591 1.00 . A A . 10 GLU N 1 1 14 10176 1 1 8 GLU O O -13.059 -0.866 -6.869 1.00 . A A . 10 GLU O 1 1 14 10177 1 1 8 GLU OE1 O -13.960 -0.288 -9.505 1.00 . A A . 10 GLU OE1 1 1 14 10178 1 1 8 GLU OE2 O -13.846 -0.465 -11.649 1.00 . A A . 10 GLU OE2 1 1 14 10179 1 1 9 TYR C C -10.759 -1.105 -3.847 1.00 . A A . 11 TYR C 1 1 14 10180 1 1 9 TYR CA C -11.120 -1.716 -5.205 1.00 . A A . 11 TYR CA 1 1 14 10181 1 1 9 TYR CB C -10.214 -2.931 -5.477 1.00 . A A . 11 TYR CB 1 1 14 10182 1 1 9 TYR CD1 C -9.499 -2.265 -7.806 1.00 . A A . 11 TYR CD1 1 1 14 10183 1 1 9 TYR CD2 C -7.789 -2.643 -6.130 1.00 . A A . 11 TYR CD2 1 1 14 10184 1 1 9 TYR CE1 C -8.509 -1.968 -8.750 1.00 . A A . 11 TYR CE1 1 1 14 10185 1 1 9 TYR CE2 C -6.800 -2.345 -7.074 1.00 . A A . 11 TYR CE2 1 1 14 10186 1 1 9 TYR CG C -9.142 -2.601 -6.495 1.00 . A A . 11 TYR CG 1 1 14 10187 1 1 9 TYR CZ C -7.161 -2.007 -8.384 1.00 . A A . 11 TYR CZ 1 1 14 10188 1 1 9 TYR H H -10.104 -0.270 -6.429 1.00 . A A . 11 TYR H 1 1 14 10189 1 1 9 TYR HA H -12.149 -2.046 -5.176 1.00 . A A . 11 TYR HA 1 1 14 10190 1 1 9 TYR HB2 H -9.745 -3.238 -4.555 1.00 . A A . 11 TYR HB2 1 1 14 10191 1 1 9 TYR HB3 H -10.820 -3.739 -5.853 1.00 . A A . 11 TYR HB3 1 1 14 10192 1 1 9 TYR HD1 H -10.538 -2.235 -8.087 1.00 . A A . 11 TYR HD1 1 1 14 10193 1 1 9 TYR HD2 H -7.508 -2.906 -5.120 1.00 . A A . 11 TYR HD2 1 1 14 10194 1 1 9 TYR HE1 H -8.788 -1.708 -9.761 1.00 . A A . 11 TYR HE1 1 1 14 10195 1 1 9 TYR HE2 H -5.759 -2.376 -6.792 1.00 . A A . 11 TYR HE2 1 1 14 10196 1 1 9 TYR HH H -6.149 -2.438 -9.945 1.00 . A A . 11 TYR HH 1 1 14 10197 1 1 9 TYR N N -10.962 -0.696 -6.276 1.00 . A A . 11 TYR N 1 1 14 10198 1 1 9 TYR O O -9.615 -1.142 -3.442 1.00 . A A . 11 TYR O 1 1 14 10199 1 1 9 TYR OH O -6.184 -1.715 -9.315 1.00 . A A . 11 TYR OH 1 1 14 10200 1 1 10 PRO C C -11.571 -1.088 -0.761 1.00 . A A . 12 PRO C 1 1 14 10201 1 1 10 PRO CA C -11.602 0.016 -1.833 1.00 . A A . 12 PRO CA 1 1 14 10202 1 1 10 PRO CB C -12.852 0.888 -1.682 1.00 . A A . 12 PRO CB 1 1 14 10203 1 1 10 PRO CD C -13.136 -0.528 -3.696 1.00 . A A . 12 PRO CD 1 1 14 10204 1 1 10 PRO CG C -13.905 0.310 -2.657 1.00 . A A . 12 PRO CG 1 1 14 10205 1 1 10 PRO HA H -10.714 0.626 -1.785 1.00 . A A . 12 PRO HA 1 1 14 10206 1 1 10 PRO HB2 H -13.214 0.840 -0.664 1.00 . A A . 12 PRO HB2 1 1 14 10207 1 1 10 PRO HB3 H -12.628 1.908 -1.951 1.00 . A A . 12 PRO HB3 1 1 14 10208 1 1 10 PRO HD2 H -13.557 -1.520 -3.766 1.00 . A A . 12 PRO HD2 1 1 14 10209 1 1 10 PRO HD3 H -13.147 -0.041 -4.659 1.00 . A A . 12 PRO HD3 1 1 14 10210 1 1 10 PRO HG2 H -14.605 -0.313 -2.117 1.00 . A A . 12 PRO HG2 1 1 14 10211 1 1 10 PRO HG3 H -14.429 1.113 -3.154 1.00 . A A . 12 PRO HG3 1 1 14 10212 1 1 10 PRO N N -11.759 -0.583 -3.174 1.00 . A A . 12 PRO N 1 1 14 10213 1 1 10 PRO O O -12.074 -0.929 0.333 1.00 . A A . 12 PRO O 1 1 14 10214 1 1 11 LYS C C -9.836 -4.297 -0.773 1.00 . A A . 13 LYS C 1 1 14 10215 1 1 11 LYS CA C -10.852 -3.338 -0.146 1.00 . A A . 13 LYS CA 1 1 14 10216 1 1 11 LYS CB C -12.217 -4.020 0.008 1.00 . A A . 13 LYS CB 1 1 14 10217 1 1 11 LYS CD C -13.303 -6.121 0.836 1.00 . A A . 13 LYS CD 1 1 14 10218 1 1 11 LYS CE C -13.747 -5.341 2.074 1.00 . A A . 13 LYS CE 1 1 14 10219 1 1 11 LYS CG C -12.013 -5.510 0.279 1.00 . A A . 13 LYS CG 1 1 14 10220 1 1 11 LYS H H -10.565 -2.283 -1.963 1.00 . A A . 13 LYS H 1 1 14 10221 1 1 11 LYS HA H -10.493 -2.992 0.813 1.00 . A A . 13 LYS HA 1 1 14 10222 1 1 11 LYS HB2 H -12.750 -3.572 0.835 1.00 . A A . 13 LYS HB2 1 1 14 10223 1 1 11 LYS HB3 H -12.787 -3.895 -0.899 1.00 . A A . 13 LYS HB3 1 1 14 10224 1 1 11 LYS HD2 H -14.076 -6.074 0.082 1.00 . A A . 13 LYS HD2 1 1 14 10225 1 1 11 LYS HD3 H -13.124 -7.150 1.105 1.00 . A A . 13 LYS HD3 1 1 14 10226 1 1 11 LYS HE2 H -12.903 -5.200 2.734 1.00 . A A . 13 LYS HE2 1 1 14 10227 1 1 11 LYS HE3 H -14.134 -4.379 1.775 1.00 . A A . 13 LYS HE3 1 1 14 10228 1 1 11 LYS HG2 H -11.744 -6.001 -0.646 1.00 . A A . 13 LYS HG2 1 1 14 10229 1 1 11 LYS HG3 H -11.214 -5.632 0.994 1.00 . A A . 13 LYS HG3 1 1 14 10230 1 1 11 LYS HZ1 H -15.737 -5.679 2.581 1.00 . A A . 13 LYS HZ1 1 1 14 10231 1 1 11 LYS HZ2 H -14.634 -6.070 3.811 1.00 . A A . 13 LYS HZ2 1 1 14 10232 1 1 11 LYS HZ3 H -14.804 -7.092 2.464 1.00 . A A . 13 LYS HZ3 1 1 14 10233 1 1 11 LYS N N -10.968 -2.197 -1.085 1.00 . A A . 13 LYS N 1 1 14 10234 1 1 11 LYS NZ N -14.811 -6.103 2.786 1.00 . A A . 13 LYS NZ 1 1 14 10235 1 1 11 LYS O O -10.105 -4.927 -1.776 1.00 . A A . 13 LYS O 1 1 14 10236 1 1 12 CYS C C -6.682 -5.788 0.229 1.00 . A A . 14 CYS C 1 1 14 10237 1 1 12 CYS CA C -7.625 -5.251 -0.844 1.00 . A A . 14 CYS CA 1 1 14 10238 1 1 12 CYS CB C -6.811 -4.439 -1.863 1.00 . A A . 14 CYS CB 1 1 14 10239 1 1 12 CYS H H -8.444 -3.840 0.553 1.00 . A A . 14 CYS H 1 1 14 10240 1 1 12 CYS HA H -8.106 -6.076 -1.347 1.00 . A A . 14 CYS HA 1 1 14 10241 1 1 12 CYS HB2 H -5.989 -3.954 -1.360 1.00 . A A . 14 CYS HB2 1 1 14 10242 1 1 12 CYS HB3 H -6.426 -5.104 -2.618 1.00 . A A . 14 CYS HB3 1 1 14 10243 1 1 12 CYS N N -8.659 -4.377 -0.230 1.00 . A A . 14 CYS N 1 1 14 10244 1 1 12 CYS O O -5.525 -5.423 0.293 1.00 . A A . 14 CYS O 1 1 14 10245 1 1 12 CYS SG S -7.852 -3.184 -2.656 1.00 . A A . 14 CYS SG 1 1 14 10246 1 1 13 ALA C C -5.578 -8.471 1.548 1.00 . A A . 15 ALA C 1 1 14 10247 1 1 13 ALA CA C -6.285 -7.239 2.119 1.00 . A A . 15 ALA CA 1 1 14 10248 1 1 13 ALA CB C -7.139 -7.647 3.322 1.00 . A A . 15 ALA CB 1 1 14 10249 1 1 13 ALA H H -8.096 -6.942 0.986 1.00 . A A . 15 ALA H 1 1 14 10250 1 1 13 ALA HA H -5.552 -6.506 2.424 1.00 . A A . 15 ALA HA 1 1 14 10251 1 1 13 ALA HB1 H -8.058 -7.079 3.320 1.00 . A A . 15 ALA HB1 1 1 14 10252 1 1 13 ALA HB2 H -6.595 -7.451 4.234 1.00 . A A . 15 ALA HB2 1 1 14 10253 1 1 13 ALA HB3 H -7.368 -8.702 3.260 1.00 . A A . 15 ALA HB3 1 1 14 10254 1 1 13 ALA N N -7.161 -6.662 1.060 1.00 . A A . 15 ALA N 1 1 14 10255 1 1 13 ALA O O -5.907 -9.596 1.867 1.00 . A A . 15 ALA O 1 1 14 10256 1 1 14 CYS C C -2.799 -9.921 1.024 1.00 . A A . 16 CYS C 1 1 14 10257 1 1 14 CYS CA C -3.885 -9.411 0.072 1.00 . A A . 16 CYS CA 1 1 14 10258 1 1 14 CYS CB C -3.231 -8.955 -1.235 1.00 . A A . 16 CYS CB 1 1 14 10259 1 1 14 CYS H H -4.373 -7.345 0.441 1.00 . A A . 16 CYS H 1 1 14 10260 1 1 14 CYS HA H -4.583 -10.208 -0.136 1.00 . A A . 16 CYS HA 1 1 14 10261 1 1 14 CYS HB2 H -2.639 -8.071 -1.053 1.00 . A A . 16 CYS HB2 1 1 14 10262 1 1 14 CYS HB3 H -2.593 -9.742 -1.611 1.00 . A A . 16 CYS HB3 1 1 14 10263 1 1 14 CYS N N -4.612 -8.262 0.689 1.00 . A A . 16 CYS N 1 1 14 10264 1 1 14 CYS O O -2.304 -9.198 1.866 1.00 . A A . 16 CYS O 1 1 14 10265 1 1 14 CYS SG S -4.509 -8.581 -2.461 1.00 . A A . 16 CYS SG 1 1 14 10266 1 1 15 THR C C -0.788 -12.995 1.118 1.00 . A A . 17 THR C 1 1 14 10267 1 1 15 THR CA C -1.367 -11.734 1.770 1.00 . A A . 17 THR CA 1 1 14 10268 1 1 15 THR CB C -1.972 -12.095 3.130 1.00 . A A . 17 THR CB 1 1 14 10269 1 1 15 THR CG2 C -1.067 -11.578 4.251 1.00 . A A . 17 THR CG2 1 1 14 10270 1 1 15 THR H H -2.837 -11.725 0.196 1.00 . A A . 17 THR H 1 1 14 10271 1 1 15 THR HA H -0.580 -11.006 1.906 1.00 . A A . 17 THR HA 1 1 14 10272 1 1 15 THR HB H -2.061 -13.167 3.211 1.00 . A A . 17 THR HB 1 1 14 10273 1 1 15 THR HG1 H -3.909 -12.149 2.963 1.00 . A A . 17 THR HG1 1 1 14 10274 1 1 15 THR HG21 H -0.757 -10.568 4.027 1.00 . A A . 17 THR HG21 1 1 14 10275 1 1 15 THR HG22 H -0.197 -12.212 4.334 1.00 . A A . 17 THR HG22 1 1 14 10276 1 1 15 THR HG23 H -1.610 -11.589 5.184 1.00 . A A . 17 THR HG23 1 1 14 10277 1 1 15 THR N N -2.425 -11.165 0.887 1.00 . A A . 17 THR N 1 1 14 10278 1 1 15 THR O O -0.869 -14.078 1.665 1.00 . A A . 17 THR O 1 1 14 10279 1 1 15 THR OG1 O -3.258 -11.502 3.246 1.00 . A A . 17 THR OG1 1 1 14 10280 1 1 16 MET C C 1.745 -13.731 -1.300 1.00 . A A . 18 MET C 1 1 14 10281 1 1 16 MET CA C 0.365 -14.067 -0.727 1.00 . A A . 18 MET CA 1 1 14 10282 1 1 16 MET CB C -0.567 -14.509 -1.859 1.00 . A A . 18 MET CB 1 1 14 10283 1 1 16 MET CE C -2.653 -17.479 -2.848 1.00 . A A . 18 MET CE 1 1 14 10284 1 1 16 MET CG C -0.513 -16.030 -2.003 1.00 . A A . 18 MET CG 1 1 14 10285 1 1 16 MET H H -0.155 -11.989 -0.476 1.00 . A A . 18 MET H 1 1 14 10286 1 1 16 MET HA H 0.463 -14.869 -0.014 1.00 . A A . 18 MET HA 1 1 14 10287 1 1 16 MET HB2 H -1.578 -14.204 -1.632 1.00 . A A . 18 MET HB2 1 1 14 10288 1 1 16 MET HB3 H -0.253 -14.052 -2.785 1.00 . A A . 18 MET HB3 1 1 14 10289 1 1 16 MET HE1 H -2.323 -17.933 -1.922 1.00 . A A . 18 MET HE1 1 1 14 10290 1 1 16 MET HE2 H -2.950 -18.253 -3.537 1.00 . A A . 18 MET HE2 1 1 14 10291 1 1 16 MET HE3 H -3.494 -16.828 -2.656 1.00 . A A . 18 MET HE3 1 1 14 10292 1 1 16 MET HG2 H 0.517 -16.356 -2.001 1.00 . A A . 18 MET HG2 1 1 14 10293 1 1 16 MET HG3 H -1.037 -16.490 -1.178 1.00 . A A . 18 MET HG3 1 1 14 10294 1 1 16 MET N N -0.209 -12.868 -0.048 1.00 . A A . 18 MET N 1 1 14 10295 1 1 16 MET O O 2.761 -14.155 -0.784 1.00 . A A . 18 MET O 1 1 14 10296 1 1 16 MET SD S -1.297 -16.517 -3.562 1.00 . A A . 18 MET SD 1 1 14 10297 1 1 17 GLU C C 3.890 -11.727 -1.997 1.00 . A A . 19 GLU C 1 1 14 10298 1 1 17 GLU CA C 3.109 -12.617 -2.966 1.00 . A A . 19 GLU CA 1 1 14 10299 1 1 17 GLU CB C 2.881 -11.863 -4.280 1.00 . A A . 19 GLU CB 1 1 14 10300 1 1 17 GLU CD C 3.822 -11.388 -6.549 1.00 . A A . 19 GLU CD 1 1 14 10301 1 1 17 GLU CG C 4.001 -12.204 -5.266 1.00 . A A . 19 GLU CG 1 1 14 10302 1 1 17 GLU H H 0.961 -12.647 -2.761 1.00 . A A . 19 GLU H 1 1 14 10303 1 1 17 GLU HA H 3.672 -13.517 -3.162 1.00 . A A . 19 GLU HA 1 1 14 10304 1 1 17 GLU HB2 H 1.929 -12.153 -4.701 1.00 . A A . 19 GLU HB2 1 1 14 10305 1 1 17 GLU HB3 H 2.882 -10.800 -4.089 1.00 . A A . 19 GLU HB3 1 1 14 10306 1 1 17 GLU HG2 H 4.957 -11.967 -4.819 1.00 . A A . 19 GLU HG2 1 1 14 10307 1 1 17 GLU HG3 H 3.966 -13.256 -5.502 1.00 . A A . 19 GLU HG3 1 1 14 10308 1 1 17 GLU N N 1.792 -12.977 -2.361 1.00 . A A . 19 GLU N 1 1 14 10309 1 1 17 GLU O O 3.318 -10.978 -1.230 1.00 . A A . 19 GLU O 1 1 14 10310 1 1 17 GLU OE1 O 2.758 -11.475 -7.139 1.00 . A A . 19 GLU OE1 1 1 14 10311 1 1 17 GLU OE2 O 4.753 -10.692 -6.919 1.00 . A A . 19 GLU OE2 1 1 14 10312 1 1 18 TYR C C 6.361 -9.638 -1.792 1.00 . A A . 20 TYR C 1 1 14 10313 1 1 18 TYR CA C 6.003 -10.954 -1.100 1.00 . A A . 20 TYR CA 1 1 14 10314 1 1 18 TYR CB C 7.289 -11.685 -0.713 1.00 . A A . 20 TYR CB 1 1 14 10315 1 1 18 TYR CD1 C 6.753 -11.420 1.736 1.00 . A A . 20 TYR CD1 1 1 14 10316 1 1 18 TYR CD2 C 8.964 -10.805 0.952 1.00 . A A . 20 TYR CD2 1 1 14 10317 1 1 18 TYR CE1 C 7.113 -11.053 3.040 1.00 . A A . 20 TYR CE1 1 1 14 10318 1 1 18 TYR CE2 C 9.324 -10.440 2.255 1.00 . A A . 20 TYR CE2 1 1 14 10319 1 1 18 TYR CG C 7.679 -11.296 0.693 1.00 . A A . 20 TYR CG 1 1 14 10320 1 1 18 TYR CZ C 8.399 -10.563 3.298 1.00 . A A . 20 TYR CZ 1 1 14 10321 1 1 18 TYR H H 5.639 -12.410 -2.647 1.00 . A A . 20 TYR H 1 1 14 10322 1 1 18 TYR HA H 5.428 -10.745 -0.209 1.00 . A A . 20 TYR HA 1 1 14 10323 1 1 18 TYR HB2 H 7.127 -12.753 -0.762 1.00 . A A . 20 TYR HB2 1 1 14 10324 1 1 18 TYR HB3 H 8.078 -11.407 -1.394 1.00 . A A . 20 TYR HB3 1 1 14 10325 1 1 18 TYR HD1 H 5.762 -11.798 1.537 1.00 . A A . 20 TYR HD1 1 1 14 10326 1 1 18 TYR HD2 H 9.677 -10.709 0.148 1.00 . A A . 20 TYR HD2 1 1 14 10327 1 1 18 TYR HE1 H 6.399 -11.149 3.845 1.00 . A A . 20 TYR HE1 1 1 14 10328 1 1 18 TYR HE2 H 10.316 -10.062 2.455 1.00 . A A . 20 TYR HE2 1 1 14 10329 1 1 18 TYR HH H 8.958 -11.002 5.071 1.00 . A A . 20 TYR HH 1 1 14 10330 1 1 18 TYR N N 5.194 -11.801 -2.023 1.00 . A A . 20 TYR N 1 1 14 10331 1 1 18 TYR O O 7.055 -9.616 -2.788 1.00 . A A . 20 TYR O 1 1 14 10332 1 1 18 TYR OH O 8.754 -10.201 4.582 1.00 . A A . 20 TYR OH 1 1 14 10333 1 1 19 ARG C C 6.112 -6.147 -0.777 1.00 . A A . 21 ARG C 1 1 14 10334 1 1 19 ARG CA C 6.202 -7.218 -1.868 1.00 . A A . 21 ARG CA 1 1 14 10335 1 1 19 ARG CB C 5.185 -6.913 -2.973 1.00 . A A . 21 ARG CB 1 1 14 10336 1 1 19 ARG CD C 4.587 -7.489 -5.331 1.00 . A A . 21 ARG CD 1 1 14 10337 1 1 19 ARG CG C 5.734 -7.381 -4.323 1.00 . A A . 21 ARG CG 1 1 14 10338 1 1 19 ARG CZ C 2.618 -8.864 -5.641 1.00 . A A . 21 ARG CZ 1 1 14 10339 1 1 19 ARG H H 5.344 -8.594 -0.453 1.00 . A A . 21 ARG H 1 1 14 10340 1 1 19 ARG HA H 7.198 -7.231 -2.284 1.00 . A A . 21 ARG HA 1 1 14 10341 1 1 19 ARG HB2 H 4.259 -7.430 -2.762 1.00 . A A . 21 ARG HB2 1 1 14 10342 1 1 19 ARG HB3 H 5.003 -5.850 -3.011 1.00 . A A . 21 ARG HB3 1 1 14 10343 1 1 19 ARG HD2 H 4.067 -6.544 -5.386 1.00 . A A . 21 ARG HD2 1 1 14 10344 1 1 19 ARG HD3 H 4.985 -7.739 -6.304 1.00 . A A . 21 ARG HD3 1 1 14 10345 1 1 19 ARG HE H 3.787 -9.020 -4.044 1.00 . A A . 21 ARG HE 1 1 14 10346 1 1 19 ARG HG2 H 6.464 -6.669 -4.682 1.00 . A A . 21 ARG HG2 1 1 14 10347 1 1 19 ARG HG3 H 6.200 -8.347 -4.209 1.00 . A A . 21 ARG HG3 1 1 14 10348 1 1 19 ARG HH11 H 3.655 -8.789 -7.352 1.00 . A A . 21 ARG HH11 1 1 14 10349 1 1 19 ARG HH12 H 1.979 -9.195 -7.510 1.00 . A A . 21 ARG HH12 1 1 14 10350 1 1 19 ARG HH21 H 1.341 -9.010 -4.106 1.00 . A A . 21 ARG HH21 1 1 14 10351 1 1 19 ARG HH22 H 0.670 -9.323 -5.671 1.00 . A A . 21 ARG HH22 1 1 14 10352 1 1 19 ARG N N 5.896 -8.544 -1.261 1.00 . A A . 21 ARG N 1 1 14 10353 1 1 19 ARG NE N 3.641 -8.552 -4.893 1.00 . A A . 21 ARG NE 1 1 14 10354 1 1 19 ARG NH1 N 2.763 -8.957 -6.935 1.00 . A A . 21 ARG NH1 1 1 14 10355 1 1 19 ARG NH2 N 1.452 -9.082 -5.097 1.00 . A A . 21 ARG NH2 1 1 14 10356 1 1 19 ARG O O 5.105 -5.479 -0.647 1.00 . A A . 21 ARG O 1 1 14 10357 1 1 20 PRO C C 7.495 -3.642 0.571 1.00 . A A . 22 PRO C 1 1 14 10358 1 1 20 PRO CA C 7.247 -5.059 1.095 1.00 . A A . 22 PRO CA 1 1 14 10359 1 1 20 PRO CB C 8.438 -5.554 1.921 1.00 . A A . 22 PRO CB 1 1 14 10360 1 1 20 PRO CD C 8.387 -6.847 -0.187 1.00 . A A . 22 PRO CD 1 1 14 10361 1 1 20 PRO CG C 9.307 -6.406 0.967 1.00 . A A . 22 PRO CG 1 1 14 10362 1 1 20 PRO HA H 6.350 -5.092 1.690 1.00 . A A . 22 PRO HA 1 1 14 10363 1 1 20 PRO HB2 H 9.005 -4.711 2.295 1.00 . A A . 22 PRO HB2 1 1 14 10364 1 1 20 PRO HB3 H 8.093 -6.164 2.742 1.00 . A A . 22 PRO HB3 1 1 14 10365 1 1 20 PRO HD2 H 8.854 -6.640 -1.140 1.00 . A A . 22 PRO HD2 1 1 14 10366 1 1 20 PRO HD3 H 8.146 -7.894 -0.100 1.00 . A A . 22 PRO HD3 1 1 14 10367 1 1 20 PRO HG2 H 10.127 -5.813 0.587 1.00 . A A . 22 PRO HG2 1 1 14 10368 1 1 20 PRO HG3 H 9.684 -7.275 1.485 1.00 . A A . 22 PRO HG3 1 1 14 10369 1 1 20 PRO N N 7.169 -6.028 -0.013 1.00 . A A . 22 PRO N 1 1 14 10370 1 1 20 PRO O O 8.618 -3.243 0.334 1.00 . A A . 22 PRO O 1 1 14 10371 1 1 21 LEU C C 6.642 -0.534 1.112 1.00 . A A . 23 LEU C 1 1 14 10372 1 1 21 LEU CA C 6.623 -1.479 -0.089 1.00 . A A . 23 LEU CA 1 1 14 10373 1 1 21 LEU CB C 5.451 -1.108 -1.002 1.00 . A A . 23 LEU CB 1 1 14 10374 1 1 21 LEU CD1 C 4.245 -1.707 -3.107 1.00 . A A . 23 LEU CD1 1 1 14 10375 1 1 21 LEU CD2 C 6.647 -2.329 -2.823 1.00 . A A . 23 LEU CD2 1 1 14 10376 1 1 21 LEU CG C 5.308 -2.159 -2.103 1.00 . A A . 23 LEU CG 1 1 14 10377 1 1 21 LEU H H 5.556 -3.215 0.610 1.00 . A A . 23 LEU H 1 1 14 10378 1 1 21 LEU HA H 7.552 -1.394 -0.633 1.00 . A A . 23 LEU HA 1 1 14 10379 1 1 21 LEU HB2 H 4.542 -1.069 -0.420 1.00 . A A . 23 LEU HB2 1 1 14 10380 1 1 21 LEU HB3 H 5.635 -0.141 -1.448 1.00 . A A . 23 LEU HB3 1 1 14 10381 1 1 21 LEU HD11 H 4.568 -0.795 -3.586 1.00 . A A . 23 LEU HD11 1 1 14 10382 1 1 21 LEU HD12 H 3.311 -1.533 -2.591 1.00 . A A . 23 LEU HD12 1 1 14 10383 1 1 21 LEU HD13 H 4.105 -2.476 -3.853 1.00 . A A . 23 LEU HD13 1 1 14 10384 1 1 21 LEU HD21 H 7.331 -2.871 -2.188 1.00 . A A . 23 LEU HD21 1 1 14 10385 1 1 21 LEU HD22 H 7.060 -1.356 -3.049 1.00 . A A . 23 LEU HD22 1 1 14 10386 1 1 21 LEU HD23 H 6.496 -2.877 -3.741 1.00 . A A . 23 LEU HD23 1 1 14 10387 1 1 21 LEU HG H 5.011 -3.101 -1.664 1.00 . A A . 23 LEU HG 1 1 14 10388 1 1 21 LEU N N 6.453 -2.875 0.403 1.00 . A A . 23 LEU N 1 1 14 10389 1 1 21 LEU O O 5.737 -0.533 1.921 1.00 . A A . 23 LEU O 1 1 14 10390 1 1 22 CYS C C 6.978 2.496 2.032 1.00 . A A . 24 CYS C 1 1 14 10391 1 1 22 CYS CA C 7.694 1.202 2.406 1.00 . A A . 24 CYS CA 1 1 14 10392 1 1 22 CYS CB C 9.146 1.500 2.779 1.00 . A A . 24 CYS CB 1 1 14 10393 1 1 22 CYS H H 8.385 0.270 0.587 1.00 . A A . 24 CYS H 1 1 14 10394 1 1 22 CYS HA H 7.193 0.745 3.246 1.00 . A A . 24 CYS HA 1 1 14 10395 1 1 22 CYS HB2 H 9.783 1.329 1.924 1.00 . A A . 24 CYS HB2 1 1 14 10396 1 1 22 CYS HB3 H 9.234 2.529 3.095 1.00 . A A . 24 CYS HB3 1 1 14 10397 1 1 22 CYS N N 7.656 0.273 1.244 1.00 . A A . 24 CYS N 1 1 14 10398 1 1 22 CYS O O 7.589 3.463 1.623 1.00 . A A . 24 CYS O 1 1 14 10399 1 1 22 CYS SG S 9.646 0.410 4.132 1.00 . A A . 24 CYS SG 1 1 14 10400 1 1 23 GLY C C 5.586 4.961 2.435 1.00 . A A . 25 GLY C 1 1 14 10401 1 1 23 GLY CA C 4.909 3.740 1.817 1.00 . A A . 25 GLY CA 1 1 14 10402 1 1 23 GLY H H 5.210 1.722 2.498 1.00 . A A . 25 GLY H 1 1 14 10403 1 1 23 GLY HA2 H 4.877 3.849 0.742 1.00 . A A . 25 GLY HA2 1 1 14 10404 1 1 23 GLY HA3 H 3.905 3.656 2.201 1.00 . A A . 25 GLY HA3 1 1 14 10405 1 1 23 GLY N N 5.680 2.517 2.167 1.00 . A A . 25 GLY N 1 1 14 10406 1 1 23 GLY O O 6.182 4.879 3.490 1.00 . A A . 25 GLY O 1 1 14 10407 1 1 24 SER C C 5.678 7.550 3.781 1.00 . A A . 26 SER C 1 1 14 10408 1 1 24 SER CA C 6.135 7.324 2.336 1.00 . A A . 26 SER CA 1 1 14 10409 1 1 24 SER CB C 5.737 8.527 1.483 1.00 . A A . 26 SER CB 1 1 14 10410 1 1 24 SER H H 5.010 6.131 0.937 1.00 . A A . 26 SER H 1 1 14 10411 1 1 24 SER HA H 7.208 7.210 2.316 1.00 . A A . 26 SER HA 1 1 14 10412 1 1 24 SER HB2 H 5.604 8.216 0.461 1.00 . A A . 26 SER HB2 1 1 14 10413 1 1 24 SER HB3 H 4.809 8.938 1.855 1.00 . A A . 26 SER HB3 1 1 14 10414 1 1 24 SER HG H 7.018 9.615 2.464 1.00 . A A . 26 SER HG 1 1 14 10415 1 1 24 SER N N 5.496 6.092 1.788 1.00 . A A . 26 SER N 1 1 14 10416 1 1 24 SER O O 6.285 8.298 4.522 1.00 . A A . 26 SER O 1 1 14 10417 1 1 24 SER OG O 6.763 9.509 1.544 1.00 . A A . 26 SER OG 1 1 14 10418 1 1 25 ASP C C 4.877 6.136 6.523 1.00 . A A . 27 ASP C 1 1 14 10419 1 1 25 ASP CA C 4.128 7.091 5.588 1.00 . A A . 27 ASP CA 1 1 14 10420 1 1 25 ASP CB C 2.631 6.781 5.642 1.00 . A A . 27 ASP CB 1 1 14 10421 1 1 25 ASP CG C 2.409 5.291 5.374 1.00 . A A . 27 ASP CG 1 1 14 10422 1 1 25 ASP H H 4.137 6.314 3.583 1.00 . A A . 27 ASP H 1 1 14 10423 1 1 25 ASP HA H 4.295 8.111 5.902 1.00 . A A . 27 ASP HA 1 1 14 10424 1 1 25 ASP HB2 H 2.245 7.033 6.619 1.00 . A A . 27 ASP HB2 1 1 14 10425 1 1 25 ASP HB3 H 2.118 7.359 4.891 1.00 . A A . 27 ASP HB3 1 1 14 10426 1 1 25 ASP N N 4.615 6.911 4.192 1.00 . A A . 27 ASP N 1 1 14 10427 1 1 25 ASP O O 4.414 5.819 7.600 1.00 . A A . 27 ASP O 1 1 14 10428 1 1 25 ASP OD1 O 3.341 4.644 4.923 1.00 . A A . 27 ASP OD1 1 1 14 10429 1 1 25 ASP OD2 O 1.310 4.821 5.623 1.00 . A A . 27 ASP OD2 1 1 14 10430 1 1 26 ASN C C 5.958 3.493 7.259 1.00 . A A . 28 ASN C 1 1 14 10431 1 1 26 ASN CA C 6.800 4.738 6.985 1.00 . A A . 28 ASN CA 1 1 14 10432 1 1 26 ASN CB C 7.135 5.428 8.309 1.00 . A A . 28 ASN CB 1 1 14 10433 1 1 26 ASN CG C 8.636 5.317 8.578 1.00 . A A . 28 ASN CG 1 1 14 10434 1 1 26 ASN H H 6.386 5.939 5.252 1.00 . A A . 28 ASN H 1 1 14 10435 1 1 26 ASN HA H 7.714 4.454 6.485 1.00 . A A . 28 ASN HA 1 1 14 10436 1 1 26 ASN HB2 H 6.853 6.471 8.253 1.00 . A A . 28 ASN HB2 1 1 14 10437 1 1 26 ASN HB3 H 6.591 4.952 9.111 1.00 . A A . 28 ASN HB3 1 1 14 10438 1 1 26 ASN HD21 H 8.648 3.335 8.482 1.00 . A A . 28 ASN HD21 1 1 14 10439 1 1 26 ASN HD22 H 10.154 4.056 8.795 1.00 . A A . 28 ASN HD22 1 1 14 10440 1 1 26 ASN N N 6.029 5.673 6.121 1.00 . A A . 28 ASN N 1 1 14 10441 1 1 26 ASN ND2 N 9.192 4.138 8.622 1.00 . A A . 28 ASN ND2 1 1 14 10442 1 1 26 ASN O O 5.954 2.964 8.353 1.00 . A A . 28 ASN O 1 1 14 10443 1 1 26 ASN OD1 O 9.310 6.314 8.751 1.00 . A A . 28 ASN OD1 1 1 14 10444 1 1 27 LYS C C 4.797 0.692 5.552 1.00 . A A . 29 LYS C 1 1 14 10445 1 1 27 LYS CA C 4.389 1.817 6.502 1.00 . A A . 29 LYS CA 1 1 14 10446 1 1 27 LYS CB C 2.922 2.173 6.261 1.00 . A A . 29 LYS CB 1 1 14 10447 1 1 27 LYS CD C 1.523 0.112 6.457 1.00 . A A . 29 LYS CD 1 1 14 10448 1 1 27 LYS CE C 1.505 -1.089 7.405 1.00 . A A . 29 LYS CE 1 1 14 10449 1 1 27 LYS CG C 2.042 1.347 7.198 1.00 . A A . 29 LYS CG 1 1 14 10450 1 1 27 LYS H H 5.241 3.465 5.403 1.00 . A A . 29 LYS H 1 1 14 10451 1 1 27 LYS HA H 4.511 1.483 7.518 1.00 . A A . 29 LYS HA 1 1 14 10452 1 1 27 LYS HB2 H 2.770 3.225 6.455 1.00 . A A . 29 LYS HB2 1 1 14 10453 1 1 27 LYS HB3 H 2.662 1.953 5.237 1.00 . A A . 29 LYS HB3 1 1 14 10454 1 1 27 LYS HD2 H 0.522 0.303 6.098 1.00 . A A . 29 LYS HD2 1 1 14 10455 1 1 27 LYS HD3 H 2.170 -0.103 5.619 1.00 . A A . 29 LYS HD3 1 1 14 10456 1 1 27 LYS HE2 H 1.615 -1.999 6.834 1.00 . A A . 29 LYS HE2 1 1 14 10457 1 1 27 LYS HE3 H 2.320 -1.005 8.108 1.00 . A A . 29 LYS HE3 1 1 14 10458 1 1 27 LYS HG2 H 2.624 1.037 8.054 1.00 . A A . 29 LYS HG2 1 1 14 10459 1 1 27 LYS HG3 H 1.207 1.946 7.526 1.00 . A A . 29 LYS HG3 1 1 14 10460 1 1 27 LYS HZ1 H -0.142 -0.151 8.269 1.00 . A A . 29 LYS HZ1 1 1 14 10461 1 1 27 LYS HZ2 H 0.357 -1.559 9.078 1.00 . A A . 29 LYS HZ2 1 1 14 10462 1 1 27 LYS HZ3 H -0.483 -1.675 7.607 1.00 . A A . 29 LYS HZ3 1 1 14 10463 1 1 27 LYS N N 5.235 3.023 6.278 1.00 . A A . 29 LYS N 1 1 14 10464 1 1 27 LYS NZ N 0.212 -1.121 8.146 1.00 . A A . 29 LYS NZ 1 1 14 10465 1 1 27 LYS O O 4.859 0.867 4.353 1.00 . A A . 29 LYS O 1 1 14 10466 1 1 28 THR C C 4.178 -2.309 4.719 1.00 . A A . 30 THR C 1 1 14 10467 1 1 28 THR CA C 5.449 -1.612 5.211 1.00 . A A . 30 THR CA 1 1 14 10468 1 1 28 THR CB C 6.304 -2.598 6.012 1.00 . A A . 30 THR CB 1 1 14 10469 1 1 28 THR CG2 C 6.796 -3.717 5.092 1.00 . A A . 30 THR CG2 1 1 14 10470 1 1 28 THR H H 4.996 -0.592 7.051 1.00 . A A . 30 THR H 1 1 14 10471 1 1 28 THR HA H 6.013 -1.248 4.365 1.00 . A A . 30 THR HA 1 1 14 10472 1 1 28 THR HB H 5.711 -3.026 6.808 1.00 . A A . 30 THR HB 1 1 14 10473 1 1 28 THR HG1 H 7.703 -1.251 5.933 1.00 . A A . 30 THR HG1 1 1 14 10474 1 1 28 THR HG21 H 6.336 -4.649 5.382 1.00 . A A . 30 THR HG21 1 1 14 10475 1 1 28 THR HG22 H 7.870 -3.803 5.174 1.00 . A A . 30 THR HG22 1 1 14 10476 1 1 28 THR HG23 H 6.530 -3.486 4.071 1.00 . A A . 30 THR HG23 1 1 14 10477 1 1 28 THR N N 5.062 -0.470 6.081 1.00 . A A . 30 THR N 1 1 14 10478 1 1 28 THR O O 3.346 -2.726 5.499 1.00 . A A . 30 THR O 1 1 14 10479 1 1 28 THR OG1 O 7.418 -1.913 6.567 1.00 . A A . 30 THR OG1 1 1 14 10480 1 1 29 TYR C C 3.128 -4.495 2.426 1.00 . A A . 31 TYR C 1 1 14 10481 1 1 29 TYR CA C 2.792 -3.077 2.891 1.00 . A A . 31 TYR CA 1 1 14 10482 1 1 29 TYR CB C 2.274 -2.257 1.711 1.00 . A A . 31 TYR CB 1 1 14 10483 1 1 29 TYR CD1 C 0.205 -1.262 2.756 1.00 . A A . 31 TYR CD1 1 1 14 10484 1 1 29 TYR CD2 C 2.041 0.210 2.167 1.00 . A A . 31 TYR CD2 1 1 14 10485 1 1 29 TYR CE1 C -0.522 -0.163 3.232 1.00 . A A . 31 TYR CE1 1 1 14 10486 1 1 29 TYR CE2 C 1.315 1.308 2.644 1.00 . A A . 31 TYR CE2 1 1 14 10487 1 1 29 TYR CG C 1.486 -1.075 2.224 1.00 . A A . 31 TYR CG 1 1 14 10488 1 1 29 TYR CZ C 0.034 1.121 3.175 1.00 . A A . 31 TYR CZ 1 1 14 10489 1 1 29 TYR H H 4.685 -2.076 2.815 1.00 . A A . 31 TYR H 1 1 14 10490 1 1 29 TYR HA H 2.035 -3.119 3.659 1.00 . A A . 31 TYR HA 1 1 14 10491 1 1 29 TYR HB2 H 3.110 -1.904 1.124 1.00 . A A . 31 TYR HB2 1 1 14 10492 1 1 29 TYR HB3 H 1.641 -2.874 1.098 1.00 . A A . 31 TYR HB3 1 1 14 10493 1 1 29 TYR HD1 H -0.223 -2.252 2.799 1.00 . A A . 31 TYR HD1 1 1 14 10494 1 1 29 TYR HD2 H 3.030 0.353 1.757 1.00 . A A . 31 TYR HD2 1 1 14 10495 1 1 29 TYR HE1 H -1.510 -0.306 3.643 1.00 . A A . 31 TYR HE1 1 1 14 10496 1 1 29 TYR HE2 H 1.743 2.297 2.600 1.00 . A A . 31 TYR HE2 1 1 14 10497 1 1 29 TYR HH H -1.577 1.911 3.829 1.00 . A A . 31 TYR HH 1 1 14 10498 1 1 29 TYR N N 4.012 -2.425 3.430 1.00 . A A . 31 TYR N 1 1 14 10499 1 1 29 TYR O O 4.247 -4.789 2.056 1.00 . A A . 31 TYR O 1 1 14 10500 1 1 29 TYR OH O -0.682 2.204 3.645 1.00 . A A . 31 TYR OH 1 1 14 10501 1 1 30 GLY C C 2.560 -6.824 0.482 1.00 . A A . 32 GLY C 1 1 14 10502 1 1 30 GLY CA C 2.431 -6.775 2.005 1.00 . A A . 32 GLY CA 1 1 14 10503 1 1 30 GLY H H 1.271 -5.120 2.748 1.00 . A A . 32 GLY H 1 1 14 10504 1 1 30 GLY HA2 H 3.351 -7.124 2.456 1.00 . A A . 32 GLY HA2 1 1 14 10505 1 1 30 GLY HA3 H 1.615 -7.410 2.314 1.00 . A A . 32 GLY HA3 1 1 14 10506 1 1 30 GLY N N 2.167 -5.377 2.444 1.00 . A A . 32 GLY N 1 1 14 10507 1 1 30 GLY O O 3.172 -7.718 -0.067 1.00 . A A . 32 GLY O 1 1 14 10508 1 1 31 ASN C C 1.350 -4.677 -2.276 1.00 . A A . 33 ASN C 1 1 14 10509 1 1 31 ASN CA C 2.085 -5.887 -1.696 1.00 . A A . 33 ASN CA 1 1 14 10510 1 1 31 ASN CB C 1.453 -7.172 -2.233 1.00 . A A . 33 ASN CB 1 1 14 10511 1 1 31 ASN CG C 0.157 -7.456 -1.471 1.00 . A A . 33 ASN CG 1 1 14 10512 1 1 31 ASN H H 1.494 -5.161 0.244 1.00 . A A . 33 ASN H 1 1 14 10513 1 1 31 ASN HA H 3.125 -5.849 -1.988 1.00 . A A . 33 ASN HA 1 1 14 10514 1 1 31 ASN HB2 H 1.235 -7.053 -3.284 1.00 . A A . 33 ASN HB2 1 1 14 10515 1 1 31 ASN HB3 H 2.137 -7.996 -2.097 1.00 . A A . 33 ASN HB3 1 1 14 10516 1 1 31 ASN HD21 H 0.701 -9.293 -0.943 1.00 . A A . 33 ASN HD21 1 1 14 10517 1 1 31 ASN HD22 H -0.833 -8.805 -0.401 1.00 . A A . 33 ASN HD22 1 1 14 10518 1 1 31 ASN N N 1.988 -5.876 -0.210 1.00 . A A . 33 ASN N 1 1 14 10519 1 1 31 ASN ND2 N -0.006 -8.614 -0.890 1.00 . A A . 33 ASN ND2 1 1 14 10520 1 1 31 ASN O O 0.620 -3.990 -1.591 1.00 . A A . 33 ASN O 1 1 14 10521 1 1 31 ASN OD1 O -0.717 -6.614 -1.403 1.00 . A A . 33 ASN OD1 1 1 14 10522 1 1 32 LYS C C -0.642 -3.403 -4.079 1.00 . A A . 34 LYS C 1 1 14 10523 1 1 32 LYS CA C 0.873 -3.254 -4.186 1.00 . A A . 34 LYS CA 1 1 14 10524 1 1 32 LYS CB C 1.276 -3.186 -5.661 1.00 . A A . 34 LYS CB 1 1 14 10525 1 1 32 LYS CD C 3.121 -2.237 -7.056 1.00 . A A . 34 LYS CD 1 1 14 10526 1 1 32 LYS CE C 4.429 -1.476 -6.830 1.00 . A A . 34 LYS CE 1 1 14 10527 1 1 32 LYS CG C 2.159 -1.959 -5.898 1.00 . A A . 34 LYS CG 1 1 14 10528 1 1 32 LYS H H 2.144 -4.978 -4.058 1.00 . A A . 34 LYS H 1 1 14 10529 1 1 32 LYS HA H 1.173 -2.348 -3.688 1.00 . A A . 34 LYS HA 1 1 14 10530 1 1 32 LYS HB2 H 1.821 -4.080 -5.926 1.00 . A A . 34 LYS HB2 1 1 14 10531 1 1 32 LYS HB3 H 0.389 -3.111 -6.273 1.00 . A A . 34 LYS HB3 1 1 14 10532 1 1 32 LYS HD2 H 3.323 -3.296 -7.110 1.00 . A A . 34 LYS HD2 1 1 14 10533 1 1 32 LYS HD3 H 2.672 -1.909 -7.983 1.00 . A A . 34 LYS HD3 1 1 14 10534 1 1 32 LYS HE2 H 4.287 -0.740 -6.053 1.00 . A A . 34 LYS HE2 1 1 14 10535 1 1 32 LYS HE3 H 5.201 -2.170 -6.532 1.00 . A A . 34 LYS HE3 1 1 14 10536 1 1 32 LYS HG2 H 1.537 -1.110 -6.141 1.00 . A A . 34 LYS HG2 1 1 14 10537 1 1 32 LYS HG3 H 2.728 -1.746 -5.005 1.00 . A A . 34 LYS HG3 1 1 14 10538 1 1 32 LYS HZ1 H 5.513 -1.390 -8.604 1.00 . A A . 34 LYS HZ1 1 1 14 10539 1 1 32 LYS HZ2 H 5.270 0.121 -7.867 1.00 . A A . 34 LYS HZ2 1 1 14 10540 1 1 32 LYS HZ3 H 3.992 -0.643 -8.687 1.00 . A A . 34 LYS HZ3 1 1 14 10541 1 1 32 LYS N N 1.546 -4.414 -3.538 1.00 . A A . 34 LYS N 1 1 14 10542 1 1 32 LYS NZ N 4.831 -0.796 -8.092 1.00 . A A . 34 LYS NZ 1 1 14 10543 1 1 32 LYS O O -1.379 -2.470 -4.310 1.00 . A A . 34 LYS O 1 1 14 10544 1 1 33 CYS C C -3.022 -4.041 -2.303 1.00 . A A . 35 CYS C 1 1 14 10545 1 1 33 CYS CA C -2.583 -4.746 -3.586 1.00 . A A . 35 CYS CA 1 1 14 10546 1 1 33 CYS CB C -2.877 -6.250 -3.517 1.00 . A A . 35 CYS CB 1 1 14 10547 1 1 33 CYS H H -0.515 -5.309 -3.536 1.00 . A A . 35 CYS H 1 1 14 10548 1 1 33 CYS HA H -3.089 -4.311 -4.434 1.00 . A A . 35 CYS HA 1 1 14 10549 1 1 33 CYS HB2 H -2.936 -6.634 -4.519 1.00 . A A . 35 CYS HB2 1 1 14 10550 1 1 33 CYS HB3 H -2.072 -6.746 -2.995 1.00 . A A . 35 CYS HB3 1 1 14 10551 1 1 33 CYS N N -1.118 -4.562 -3.724 1.00 . A A . 35 CYS N 1 1 14 10552 1 1 33 CYS O O -4.069 -3.425 -2.234 1.00 . A A . 35 CYS O 1 1 14 10553 1 1 33 CYS SG S -4.442 -6.571 -2.660 1.00 . A A . 35 CYS SG 1 1 14 10554 1 1 34 ASN C C -2.182 -1.972 -0.108 1.00 . A A . 36 ASN C 1 1 14 10555 1 1 34 ASN CA C -2.536 -3.455 -0.007 1.00 . A A . 36 ASN CA 1 1 14 10556 1 1 34 ASN CB C -1.715 -4.102 1.109 1.00 . A A . 36 ASN CB 1 1 14 10557 1 1 34 ASN CG C -2.619 -4.393 2.306 1.00 . A A . 36 ASN CG 1 1 14 10558 1 1 34 ASN H H -1.363 -4.608 -1.386 1.00 . A A . 36 ASN H 1 1 14 10559 1 1 34 ASN HA H -3.590 -3.566 0.203 1.00 . A A . 36 ASN HA 1 1 14 10560 1 1 34 ASN HB2 H -1.285 -5.026 0.748 1.00 . A A . 36 ASN HB2 1 1 14 10561 1 1 34 ASN HB3 H -0.927 -3.432 1.407 1.00 . A A . 36 ASN HB3 1 1 14 10562 1 1 34 ASN HD21 H -3.199 -6.161 1.615 1.00 . A A . 36 ASN HD21 1 1 14 10563 1 1 34 ASN HD22 H -3.866 -5.713 3.110 1.00 . A A . 36 ASN HD22 1 1 14 10564 1 1 34 ASN N N -2.205 -4.119 -1.293 1.00 . A A . 36 ASN N 1 1 14 10565 1 1 34 ASN ND2 N -3.283 -5.515 2.348 1.00 . A A . 36 ASN ND2 1 1 14 10566 1 1 34 ASN O O -2.734 -1.139 0.585 1.00 . A A . 36 ASN O 1 1 14 10567 1 1 34 ASN OD1 O -2.723 -3.591 3.213 1.00 . A A . 36 ASN OD1 1 1 14 10568 1 1 35 PHE C C -1.879 0.511 -2.005 1.00 . A A . 37 PHE C 1 1 14 10569 1 1 35 PHE CA C -0.859 -0.214 -1.130 1.00 . A A . 37 PHE CA 1 1 14 10570 1 1 35 PHE CB C 0.514 -0.149 -1.804 1.00 . A A . 37 PHE CB 1 1 14 10571 1 1 35 PHE CD1 C 0.387 2.221 -2.641 1.00 . A A . 37 PHE CD1 1 1 14 10572 1 1 35 PHE CD2 C 2.060 1.670 -0.973 1.00 . A A . 37 PHE CD2 1 1 14 10573 1 1 35 PHE CE1 C 0.831 3.549 -2.648 1.00 . A A . 37 PHE CE1 1 1 14 10574 1 1 35 PHE CE2 C 2.504 2.999 -0.980 1.00 . A A . 37 PHE CE2 1 1 14 10575 1 1 35 PHE CG C 1.001 1.281 -1.804 1.00 . A A . 37 PHE CG 1 1 14 10576 1 1 35 PHE CZ C 1.889 3.938 -1.819 1.00 . A A . 37 PHE CZ 1 1 14 10577 1 1 35 PHE H H -0.832 -2.329 -1.517 1.00 . A A . 37 PHE H 1 1 14 10578 1 1 35 PHE HA H -0.814 0.259 -0.164 1.00 . A A . 37 PHE HA 1 1 14 10579 1 1 35 PHE HB2 H 1.214 -0.780 -1.273 1.00 . A A . 37 PHE HB2 1 1 14 10580 1 1 35 PHE HB3 H 0.427 -0.495 -2.824 1.00 . A A . 37 PHE HB3 1 1 14 10581 1 1 35 PHE HD1 H -0.429 1.923 -3.280 1.00 . A A . 37 PHE HD1 1 1 14 10582 1 1 35 PHE HD2 H 2.534 0.946 -0.326 1.00 . A A . 37 PHE HD2 1 1 14 10583 1 1 35 PHE HE1 H 0.357 4.273 -3.294 1.00 . A A . 37 PHE HE1 1 1 14 10584 1 1 35 PHE HE2 H 3.321 3.302 -0.341 1.00 . A A . 37 PHE HE2 1 1 14 10585 1 1 35 PHE HZ H 2.230 4.961 -1.827 1.00 . A A . 37 PHE HZ 1 1 14 10586 1 1 35 PHE N N -1.262 -1.639 -0.971 1.00 . A A . 37 PHE N 1 1 14 10587 1 1 35 PHE O O -2.148 1.683 -1.827 1.00 . A A . 37 PHE O 1 1 14 10588 1 1 36 CYS C C -4.746 0.641 -3.057 1.00 . A A . 38 CYS C 1 1 14 10589 1 1 36 CYS CA C -3.451 0.456 -3.836 1.00 . A A . 38 CYS CA 1 1 14 10590 1 1 36 CYS CB C -3.703 -0.442 -5.050 1.00 . A A . 38 CYS CB 1 1 14 10591 1 1 36 CYS H H -2.220 -1.119 -3.066 1.00 . A A . 38 CYS H 1 1 14 10592 1 1 36 CYS HA H -3.086 1.418 -4.164 1.00 . A A . 38 CYS HA 1 1 14 10593 1 1 36 CYS HB2 H -3.465 -1.464 -4.795 1.00 . A A . 38 CYS HB2 1 1 14 10594 1 1 36 CYS HB3 H -4.741 -0.374 -5.339 1.00 . A A . 38 CYS HB3 1 1 14 10595 1 1 36 CYS N N -2.449 -0.180 -2.947 1.00 . A A . 38 CYS N 1 1 14 10596 1 1 36 CYS O O -5.529 1.526 -3.337 1.00 . A A . 38 CYS O 1 1 14 10597 1 1 36 CYS SG S -2.656 0.098 -6.424 1.00 . A A . 38 CYS SG 1 1 14 10598 1 1 37 CYS C C -6.016 1.055 -0.225 1.00 . A A . 39 CYS C 1 1 14 10599 1 1 37 CYS CA C -6.224 -0.028 -1.276 1.00 . A A . 39 CYS CA 1 1 14 10600 1 1 37 CYS CB C -6.595 -1.350 -0.610 1.00 . A A . 39 CYS CB 1 1 14 10601 1 1 37 CYS H H -4.330 -0.889 -1.849 1.00 . A A . 39 CYS H 1 1 14 10602 1 1 37 CYS HA H -7.023 0.273 -1.936 1.00 . A A . 39 CYS HA 1 1 14 10603 1 1 37 CYS HB2 H -5.877 -2.112 -0.872 1.00 . A A . 39 CYS HB2 1 1 14 10604 1 1 37 CYS HB3 H -6.626 -1.227 0.462 1.00 . A A . 39 CYS HB3 1 1 14 10605 1 1 37 CYS N N -4.978 -0.180 -2.070 1.00 . A A . 39 CYS N 1 1 14 10606 1 1 37 CYS O O -6.884 1.867 0.024 1.00 . A A . 39 CYS O 1 1 14 10607 1 1 37 CYS SG S -8.221 -1.830 -1.202 1.00 . A A . 39 CYS SG 1 1 14 10608 1 1 38 ALA C C -4.630 3.500 0.656 1.00 . A A . 40 ALA C 1 1 14 10609 1 1 38 ALA CA C -4.599 2.155 1.379 1.00 . A A . 40 ALA CA 1 1 14 10610 1 1 38 ALA CB C -3.223 1.937 2.012 1.00 . A A . 40 ALA CB 1 1 14 10611 1 1 38 ALA H H -4.165 0.448 0.143 1.00 . A A . 40 ALA H 1 1 14 10612 1 1 38 ALA HA H -5.364 2.133 2.142 1.00 . A A . 40 ALA HA 1 1 14 10613 1 1 38 ALA HB1 H -2.686 1.186 1.453 1.00 . A A . 40 ALA HB1 1 1 14 10614 1 1 38 ALA HB2 H -3.345 1.608 3.033 1.00 . A A . 40 ALA HB2 1 1 14 10615 1 1 38 ALA HB3 H -2.669 2.864 1.995 1.00 . A A . 40 ALA HB3 1 1 14 10616 1 1 38 ALA N N -4.862 1.096 0.372 1.00 . A A . 40 ALA N 1 1 14 10617 1 1 38 ALA O O -4.821 4.541 1.254 1.00 . A A . 40 ALA O 1 1 14 10618 1 1 39 VAL C C -5.935 5.174 -1.622 1.00 . A A . 41 VAL C 1 1 14 10619 1 1 39 VAL CA C -4.481 4.736 -1.428 1.00 . A A . 41 VAL CA 1 1 14 10620 1 1 39 VAL CB C -3.821 4.491 -2.790 1.00 . A A . 41 VAL CB 1 1 14 10621 1 1 39 VAL CG1 C -4.187 5.621 -3.756 1.00 . A A . 41 VAL CG1 1 1 14 10622 1 1 39 VAL CG2 C -2.302 4.450 -2.617 1.00 . A A . 41 VAL CG2 1 1 14 10623 1 1 39 VAL H H -4.309 2.619 -1.095 1.00 . A A . 41 VAL H 1 1 14 10624 1 1 39 VAL HA H -3.941 5.504 -0.900 1.00 . A A . 41 VAL HA 1 1 14 10625 1 1 39 VAL HB H -4.162 3.546 -3.193 1.00 . A A . 41 VAL HB 1 1 14 10626 1 1 39 VAL HG11 H -3.292 5.989 -4.235 1.00 . A A . 41 VAL HG11 1 1 14 10627 1 1 39 VAL HG12 H -4.657 6.424 -3.207 1.00 . A A . 41 VAL HG12 1 1 14 10628 1 1 39 VAL HG13 H -4.871 5.248 -4.504 1.00 . A A . 41 VAL HG13 1 1 14 10629 1 1 39 VAL HG21 H -2.061 4.031 -1.651 1.00 . A A . 41 VAL HG21 1 1 14 10630 1 1 39 VAL HG22 H -1.905 5.453 -2.683 1.00 . A A . 41 VAL HG22 1 1 14 10631 1 1 39 VAL HG23 H -1.867 3.838 -3.393 1.00 . A A . 41 VAL HG23 1 1 14 10632 1 1 39 VAL N N -4.454 3.476 -0.639 1.00 . A A . 41 VAL N 1 1 14 10633 1 1 39 VAL O O -6.268 6.333 -1.477 1.00 . A A . 41 VAL O 1 1 14 10634 1 1 40 VAL C C -8.785 5.224 -0.851 1.00 . A A . 42 VAL C 1 1 14 10635 1 1 40 VAL CA C -8.236 4.620 -2.143 1.00 . A A . 42 VAL CA 1 1 14 10636 1 1 40 VAL CB C -9.050 3.374 -2.512 1.00 . A A . 42 VAL CB 1 1 14 10637 1 1 40 VAL CG1 C -10.506 3.771 -2.761 1.00 . A A . 42 VAL CG1 1 1 14 10638 1 1 40 VAL CG2 C -8.470 2.748 -3.782 1.00 . A A . 42 VAL CG2 1 1 14 10639 1 1 40 VAL H H -6.514 3.326 -2.053 1.00 . A A . 42 VAL H 1 1 14 10640 1 1 40 VAL HA H -8.314 5.348 -2.939 1.00 . A A . 42 VAL HA 1 1 14 10641 1 1 40 VAL HB H -9.008 2.658 -1.704 1.00 . A A . 42 VAL HB 1 1 14 10642 1 1 40 VAL HG11 H -11.133 3.340 -1.993 1.00 . A A . 42 VAL HG11 1 1 14 10643 1 1 40 VAL HG12 H -10.818 3.406 -3.728 1.00 . A A . 42 VAL HG12 1 1 14 10644 1 1 40 VAL HG13 H -10.595 4.847 -2.735 1.00 . A A . 42 VAL HG13 1 1 14 10645 1 1 40 VAL HG21 H -7.779 1.962 -3.513 1.00 . A A . 42 VAL HG21 1 1 14 10646 1 1 40 VAL HG22 H -7.950 3.505 -4.351 1.00 . A A . 42 VAL HG22 1 1 14 10647 1 1 40 VAL HG23 H -9.270 2.336 -4.378 1.00 . A A . 42 VAL HG23 1 1 14 10648 1 1 40 VAL N N -6.804 4.255 -1.945 1.00 . A A . 42 VAL N 1 1 14 10649 1 1 40 VAL O O -9.691 6.035 -0.869 1.00 . A A . 42 VAL O 1 1 14 10650 1 1 41 GLU C C -7.939 6.672 1.890 1.00 . A A . 43 GLU C 1 1 14 10651 1 1 41 GLU CA C -8.730 5.403 1.564 1.00 . A A . 43 GLU CA 1 1 14 10652 1 1 41 GLU CB C -8.530 4.374 2.678 1.00 . A A . 43 GLU CB 1 1 14 10653 1 1 41 GLU CD C -10.690 3.141 2.430 1.00 . A A . 43 GLU CD 1 1 14 10654 1 1 41 GLU CG C -9.172 3.046 2.271 1.00 . A A . 43 GLU CG 1 1 14 10655 1 1 41 GLU H H -7.508 4.191 0.267 1.00 . A A . 43 GLU H 1 1 14 10656 1 1 41 GLU HA H -9.779 5.644 1.478 1.00 . A A . 43 GLU HA 1 1 14 10657 1 1 41 GLU HB2 H -7.473 4.227 2.847 1.00 . A A . 43 GLU HB2 1 1 14 10658 1 1 41 GLU HB3 H -8.992 4.732 3.586 1.00 . A A . 43 GLU HB3 1 1 14 10659 1 1 41 GLU HG2 H -8.928 2.829 1.242 1.00 . A A . 43 GLU HG2 1 1 14 10660 1 1 41 GLU HG3 H -8.795 2.255 2.905 1.00 . A A . 43 GLU HG3 1 1 14 10661 1 1 41 GLU N N -8.242 4.842 0.273 1.00 . A A . 43 GLU N 1 1 14 10662 1 1 41 GLU O O -8.358 7.489 2.685 1.00 . A A . 43 GLU O 1 1 14 10663 1 1 41 GLU OE1 O -11.135 3.451 3.522 1.00 . A A . 43 GLU OE1 1 1 14 10664 1 1 41 GLU OE2 O -11.383 2.898 1.455 1.00 . A A . 43 GLU OE2 1 1 14 10665 1 1 42 SER C C -6.355 9.159 0.558 1.00 . A A . 44 SER C 1 1 14 10666 1 1 42 SER CA C -5.979 8.056 1.550 1.00 . A A . 44 SER CA 1 1 14 10667 1 1 42 SER CB C -4.496 7.716 1.396 1.00 . A A . 44 SER CB 1 1 14 10668 1 1 42 SER H H -6.480 6.170 0.640 1.00 . A A . 44 SER H 1 1 14 10669 1 1 42 SER HA H -6.167 8.399 2.557 1.00 . A A . 44 SER HA 1 1 14 10670 1 1 42 SER HB2 H -4.391 6.719 1.004 1.00 . A A . 44 SER HB2 1 1 14 10671 1 1 42 SER HB3 H -4.036 8.419 0.713 1.00 . A A . 44 SER HB3 1 1 14 10672 1 1 42 SER HG H -4.036 8.657 3.037 1.00 . A A . 44 SER HG 1 1 14 10673 1 1 42 SER N N -6.798 6.841 1.279 1.00 . A A . 44 SER N 1 1 14 10674 1 1 42 SER O O -5.730 10.198 0.503 1.00 . A A . 44 SER O 1 1 14 10675 1 1 42 SER OG O -3.863 7.788 2.667 1.00 . A A . 44 SER OG 1 1 14 10676 1 1 43 ASN C C -6.654 10.205 -2.210 1.00 . A A . 45 ASN C 1 1 14 10677 1 1 43 ASN CA C -7.789 9.972 -1.212 1.00 . A A . 45 ASN CA 1 1 14 10678 1 1 43 ASN CB C -8.103 11.272 -0.475 1.00 . A A . 45 ASN CB 1 1 14 10679 1 1 43 ASN CG C -9.610 11.375 -0.233 1.00 . A A . 45 ASN CG 1 1 14 10680 1 1 43 ASN H H -7.864 8.101 -0.170 1.00 . A A . 45 ASN H 1 1 14 10681 1 1 43 ASN HA H -8.669 9.634 -1.739 1.00 . A A . 45 ASN HA 1 1 14 10682 1 1 43 ASN HB2 H -7.583 11.284 0.471 1.00 . A A . 45 ASN HB2 1 1 14 10683 1 1 43 ASN HB3 H -7.779 12.105 -1.074 1.00 . A A . 45 ASN HB3 1 1 14 10684 1 1 43 ASN HD21 H -9.956 12.360 -1.922 1.00 . A A . 45 ASN HD21 1 1 14 10685 1 1 43 ASN HD22 H -11.325 12.048 -0.970 1.00 . A A . 45 ASN HD22 1 1 14 10686 1 1 43 ASN N N -7.374 8.940 -0.228 1.00 . A A . 45 ASN N 1 1 14 10687 1 1 43 ASN ND2 N -10.359 11.977 -1.115 1.00 . A A . 45 ASN ND2 1 1 14 10688 1 1 43 ASN O O -6.375 11.322 -2.600 1.00 . A A . 45 ASN O 1 1 14 10689 1 1 43 ASN OD1 O -10.109 10.903 0.769 1.00 . A A . 45 ASN OD1 1 1 14 10690 1 1 44 GLY C C -3.821 10.252 -3.016 1.00 . A A . 46 GLY C 1 1 14 10691 1 1 44 GLY CA C -4.878 9.313 -3.597 1.00 . A A . 46 GLY CA 1 1 14 10692 1 1 44 GLY H H -6.238 8.267 -2.297 1.00 . A A . 46 GLY H 1 1 14 10693 1 1 44 GLY HA2 H -4.435 8.347 -3.793 1.00 . A A . 46 GLY HA2 1 1 14 10694 1 1 44 GLY HA3 H -5.256 9.731 -4.518 1.00 . A A . 46 GLY HA3 1 1 14 10695 1 1 44 GLY N N -5.996 9.157 -2.626 1.00 . A A . 46 GLY N 1 1 14 10696 1 1 44 GLY O O -3.089 10.900 -3.738 1.00 . A A . 46 GLY O 1 1 14 10697 1 1 45 THR C C -1.559 10.412 -0.543 1.00 . A A . 47 THR C 1 1 14 10698 1 1 45 THR CA C -2.722 11.239 -1.100 1.00 . A A . 47 THR CA 1 1 14 10699 1 1 45 THR CB C -3.375 12.051 0.027 1.00 . A A . 47 THR CB 1 1 14 10700 1 1 45 THR CG2 C -3.498 11.194 1.289 1.00 . A A . 47 THR CG2 1 1 14 10701 1 1 45 THR H H -4.336 9.807 -1.148 1.00 . A A . 47 THR H 1 1 14 10702 1 1 45 THR HA H -2.346 11.915 -1.853 1.00 . A A . 47 THR HA 1 1 14 10703 1 1 45 THR HB H -4.359 12.367 -0.284 1.00 . A A . 47 THR HB 1 1 14 10704 1 1 45 THR HG1 H -2.121 13.439 -0.502 1.00 . A A . 47 THR HG1 1 1 14 10705 1 1 45 THR HG21 H -2.716 11.462 1.984 1.00 . A A . 47 THR HG21 1 1 14 10706 1 1 45 THR HG22 H -3.405 10.150 1.026 1.00 . A A . 47 THR HG22 1 1 14 10707 1 1 45 THR HG23 H -4.460 11.365 1.748 1.00 . A A . 47 THR HG23 1 1 14 10708 1 1 45 THR N N -3.735 10.336 -1.717 1.00 . A A . 47 THR N 1 1 14 10709 1 1 45 THR O O -0.530 10.942 -0.174 1.00 . A A . 47 THR O 1 1 14 10710 1 1 45 THR OG1 O -2.579 13.193 0.306 1.00 . A A . 47 THR OG1 1 1 14 10711 1 1 46 LEU C C 0.510 8.169 -0.986 1.00 . A A . 48 LEU C 1 1 14 10712 1 1 46 LEU CA C -0.609 8.264 0.053 1.00 . A A . 48 LEU CA 1 1 14 10713 1 1 46 LEU CB C -1.142 6.861 0.353 1.00 . A A . 48 LEU CB 1 1 14 10714 1 1 46 LEU CD1 C -0.162 7.004 2.645 1.00 . A A . 48 LEU CD1 1 1 14 10715 1 1 46 LEU CD2 C -0.766 4.781 1.682 1.00 . A A . 48 LEU CD2 1 1 14 10716 1 1 46 LEU CG C -0.221 6.174 1.362 1.00 . A A . 48 LEU CG 1 1 14 10717 1 1 46 LEU H H -2.546 8.704 -0.783 1.00 . A A . 48 LEU H 1 1 14 10718 1 1 46 LEU HA H -0.221 8.703 0.960 1.00 . A A . 48 LEU HA 1 1 14 10719 1 1 46 LEU HB2 H -2.138 6.936 0.764 1.00 . A A . 48 LEU HB2 1 1 14 10720 1 1 46 LEU HB3 H -1.169 6.284 -0.559 1.00 . A A . 48 LEU HB3 1 1 14 10721 1 1 46 LEU HD11 H 0.856 7.315 2.826 1.00 . A A . 48 LEU HD11 1 1 14 10722 1 1 46 LEU HD12 H -0.508 6.407 3.476 1.00 . A A . 48 LEU HD12 1 1 14 10723 1 1 46 LEU HD13 H -0.791 7.875 2.540 1.00 . A A . 48 LEU HD13 1 1 14 10724 1 1 46 LEU HD21 H -1.610 4.870 2.351 1.00 . A A . 48 LEU HD21 1 1 14 10725 1 1 46 LEU HD22 H 0.006 4.192 2.156 1.00 . A A . 48 LEU HD22 1 1 14 10726 1 1 46 LEU HD23 H -1.079 4.297 0.770 1.00 . A A . 48 LEU HD23 1 1 14 10727 1 1 46 LEU HG H 0.770 6.087 0.942 1.00 . A A . 48 LEU HG 1 1 14 10728 1 1 46 LEU N N -1.711 9.117 -0.480 1.00 . A A . 48 LEU N 1 1 14 10729 1 1 46 LEU O O 0.269 8.218 -2.176 1.00 . A A . 48 LEU O 1 1 14 10730 1 1 47 THR C C 3.751 6.743 -1.155 1.00 . A A . 49 THR C 1 1 14 10731 1 1 47 THR CA C 2.858 7.934 -1.518 1.00 . A A . 49 THR CA 1 1 14 10732 1 1 47 THR CB C 3.679 9.226 -1.479 1.00 . A A . 49 THR CB 1 1 14 10733 1 1 47 THR CG2 C 2.856 10.374 -2.065 1.00 . A A . 49 THR CG2 1 1 14 10734 1 1 47 THR H H 1.908 7.993 0.414 1.00 . A A . 49 THR H 1 1 14 10735 1 1 47 THR HA H 2.463 7.794 -2.513 1.00 . A A . 49 THR HA 1 1 14 10736 1 1 47 THR HB H 4.577 9.099 -2.061 1.00 . A A . 49 THR HB 1 1 14 10737 1 1 47 THR HG1 H 4.401 10.409 -0.114 1.00 . A A . 49 THR HG1 1 1 14 10738 1 1 47 THR HG21 H 2.449 10.076 -3.020 1.00 . A A . 49 THR HG21 1 1 14 10739 1 1 47 THR HG22 H 3.489 11.240 -2.198 1.00 . A A . 49 THR HG22 1 1 14 10740 1 1 47 THR HG23 H 2.049 10.619 -1.391 1.00 . A A . 49 THR HG23 1 1 14 10741 1 1 47 THR N N 1.732 8.032 -0.549 1.00 . A A . 49 THR N 1 1 14 10742 1 1 47 THR O O 3.387 5.902 -0.359 1.00 . A A . 49 THR O 1 1 14 10743 1 1 47 THR OG1 O 4.021 9.527 -0.135 1.00 . A A . 49 THR OG1 1 1 14 10744 1 1 48 LEU C C 7.117 6.081 -0.805 1.00 . A A . 50 LEU C 1 1 14 10745 1 1 48 LEU CA C 5.838 5.534 -1.441 1.00 . A A . 50 LEU CA 1 1 14 10746 1 1 48 LEU CB C 6.183 4.808 -2.743 1.00 . A A . 50 LEU CB 1 1 14 10747 1 1 48 LEU CD1 C 6.076 2.711 -1.387 1.00 . A A . 50 LEU CD1 1 1 14 10748 1 1 48 LEU CD2 C 7.004 2.658 -3.706 1.00 . A A . 50 LEU CD2 1 1 14 10749 1 1 48 LEU CG C 6.887 3.489 -2.426 1.00 . A A . 50 LEU CG 1 1 14 10750 1 1 48 LEU H H 5.184 7.358 -2.379 1.00 . A A . 50 LEU H 1 1 14 10751 1 1 48 LEU HA H 5.359 4.846 -0.760 1.00 . A A . 50 LEU HA 1 1 14 10752 1 1 48 LEU HB2 H 5.275 4.609 -3.294 1.00 . A A . 50 LEU HB2 1 1 14 10753 1 1 48 LEU HB3 H 6.837 5.428 -3.338 1.00 . A A . 50 LEU HB3 1 1 14 10754 1 1 48 LEU HD11 H 6.134 1.655 -1.603 1.00 . A A . 50 LEU HD11 1 1 14 10755 1 1 48 LEU HD12 H 5.044 3.028 -1.425 1.00 . A A . 50 LEU HD12 1 1 14 10756 1 1 48 LEU HD13 H 6.475 2.901 -0.402 1.00 . A A . 50 LEU HD13 1 1 14 10757 1 1 48 LEU HD21 H 7.943 2.876 -4.193 1.00 . A A . 50 LEU HD21 1 1 14 10758 1 1 48 LEU HD22 H 6.189 2.904 -4.371 1.00 . A A . 50 LEU HD22 1 1 14 10759 1 1 48 LEU HD23 H 6.963 1.607 -3.460 1.00 . A A . 50 LEU HD23 1 1 14 10760 1 1 48 LEU HG H 7.874 3.693 -2.036 1.00 . A A . 50 LEU HG 1 1 14 10761 1 1 48 LEU N N 4.916 6.667 -1.740 1.00 . A A . 50 LEU N 1 1 14 10762 1 1 48 LEU O O 7.354 7.273 -0.793 1.00 . A A . 50 LEU O 1 1 14 10763 1 1 49 SER C C 10.397 4.918 -0.181 1.00 . A A . 51 SER C 1 1 14 10764 1 1 49 SER CA C 9.202 5.705 0.361 1.00 . A A . 51 SER CA 1 1 14 10765 1 1 49 SER CB C 9.113 5.516 1.876 1.00 . A A . 51 SER CB 1 1 14 10766 1 1 49 SER H H 7.738 4.267 -0.291 1.00 . A A . 51 SER H 1 1 14 10767 1 1 49 SER HA H 9.335 6.752 0.138 1.00 . A A . 51 SER HA 1 1 14 10768 1 1 49 SER HB2 H 8.082 5.548 2.186 1.00 . A A . 51 SER HB2 1 1 14 10769 1 1 49 SER HB3 H 9.537 4.556 2.144 1.00 . A A . 51 SER HB3 1 1 14 10770 1 1 49 SER HG H 9.605 7.386 2.086 1.00 . A A . 51 SER HG 1 1 14 10771 1 1 49 SER N N 7.945 5.223 -0.274 1.00 . A A . 51 SER N 1 1 14 10772 1 1 49 SER O O 11.434 5.477 -0.473 1.00 . A A . 51 SER O 1 1 14 10773 1 1 49 SER OG O 9.829 6.561 2.521 1.00 . A A . 51 SER OG 1 1 14 10774 1 1 50 HIS C C 11.003 1.338 -0.844 1.00 . A A . 52 HIS C 1 1 14 10775 1 1 50 HIS CA C 11.393 2.816 -0.844 1.00 . A A . 52 HIS CA 1 1 14 10776 1 1 50 HIS CB C 12.632 3.019 0.030 1.00 . A A . 52 HIS CB 1 1 14 10777 1 1 50 HIS CD2 C 11.854 3.065 2.539 1.00 . A A . 52 HIS CD2 1 1 14 10778 1 1 50 HIS CE1 C 12.346 1.019 3.055 1.00 . A A . 52 HIS CE1 1 1 14 10779 1 1 50 HIS CG C 12.376 2.483 1.410 1.00 . A A . 52 HIS CG 1 1 14 10780 1 1 50 HIS H H 9.418 3.190 -0.087 1.00 . A A . 52 HIS H 1 1 14 10781 1 1 50 HIS HA H 11.613 3.125 -1.856 1.00 . A A . 52 HIS HA 1 1 14 10782 1 1 50 HIS HB2 H 13.469 2.495 -0.407 1.00 . A A . 52 HIS HB2 1 1 14 10783 1 1 50 HIS HB3 H 12.863 4.072 0.091 1.00 . A A . 52 HIS HB3 1 1 14 10784 1 1 50 HIS HD1 H 13.070 0.496 1.176 1.00 . A A . 52 HIS HD1 1 1 14 10785 1 1 50 HIS HD2 H 11.511 4.086 2.611 1.00 . A A . 52 HIS HD2 1 1 14 10786 1 1 50 HIS HE1 H 12.472 0.096 3.604 1.00 . A A . 52 HIS HE1 1 1 14 10787 1 1 50 HIS N N 10.262 3.627 -0.321 1.00 . A A . 52 HIS N 1 1 14 10788 1 1 50 HIS ND1 N 12.682 1.179 1.762 1.00 . A A . 52 HIS ND1 1 1 14 10789 1 1 50 HIS NE2 N 11.837 2.138 3.577 1.00 . A A . 52 HIS NE2 1 1 14 10790 1 1 50 HIS O O 10.876 0.710 0.189 1.00 . A A . 52 HIS O 1 1 14 10791 1 1 51 PHE C C 11.329 -1.475 -1.178 1.00 . A A . 53 PHE C 1 1 14 10792 1 1 51 PHE CA C 10.437 -0.648 -2.109 1.00 . A A . 53 PHE CA 1 1 14 10793 1 1 51 PHE CB C 10.650 -1.114 -3.550 1.00 . A A . 53 PHE CB 1 1 14 10794 1 1 51 PHE CD1 C 10.244 0.922 -4.987 1.00 . A A . 53 PHE CD1 1 1 14 10795 1 1 51 PHE CD2 C 8.530 -0.788 -4.874 1.00 . A A . 53 PHE CD2 1 1 14 10796 1 1 51 PHE CE1 C 9.446 1.666 -5.864 1.00 . A A . 53 PHE CE1 1 1 14 10797 1 1 51 PHE CE2 C 7.730 -0.044 -5.750 1.00 . A A . 53 PHE CE2 1 1 14 10798 1 1 51 PHE CG C 9.786 -0.305 -4.492 1.00 . A A . 53 PHE CG 1 1 14 10799 1 1 51 PHE CZ C 8.189 1.182 -6.245 1.00 . A A . 53 PHE CZ 1 1 14 10800 1 1 51 PHE H H 10.918 1.317 -2.813 1.00 . A A . 53 PHE H 1 1 14 10801 1 1 51 PHE HA H 9.401 -0.777 -1.833 1.00 . A A . 53 PHE HA 1 1 14 10802 1 1 51 PHE HB2 H 11.689 -0.986 -3.817 1.00 . A A . 53 PHE HB2 1 1 14 10803 1 1 51 PHE HB3 H 10.386 -2.153 -3.628 1.00 . A A . 53 PHE HB3 1 1 14 10804 1 1 51 PHE HD1 H 11.214 1.296 -4.691 1.00 . A A . 53 PHE HD1 1 1 14 10805 1 1 51 PHE HD2 H 8.177 -1.734 -4.494 1.00 . A A . 53 PHE HD2 1 1 14 10806 1 1 51 PHE HE1 H 9.799 2.612 -6.247 1.00 . A A . 53 PHE HE1 1 1 14 10807 1 1 51 PHE HE2 H 6.761 -0.416 -6.045 1.00 . A A . 53 PHE HE2 1 1 14 10808 1 1 51 PHE HZ H 7.573 1.755 -6.923 1.00 . A A . 53 PHE HZ 1 1 14 10809 1 1 51 PHE N N 10.812 0.785 -2.004 1.00 . A A . 53 PHE N 1 1 14 10810 1 1 51 PHE O O 12.460 -1.780 -1.502 1.00 . A A . 53 PHE O 1 1 14 10811 1 1 52 GLY C C 11.030 -2.678 2.295 1.00 . A A . 54 GLY C 1 1 14 10812 1 1 52 GLY CA C 11.672 -2.653 0.907 1.00 . A A . 54 GLY CA 1 1 14 10813 1 1 52 GLY H H 9.923 -1.594 0.222 1.00 . A A . 54 GLY H 1 1 14 10814 1 1 52 GLY HA2 H 11.757 -3.662 0.530 1.00 . A A . 54 GLY HA2 1 1 14 10815 1 1 52 GLY HA3 H 12.656 -2.214 0.979 1.00 . A A . 54 GLY HA3 1 1 14 10816 1 1 52 GLY N N 10.836 -1.845 -0.027 1.00 . A A . 54 GLY N 1 1 14 10817 1 1 52 GLY O O 10.087 -1.963 2.569 1.00 . A A . 54 GLY O 1 1 14 10818 1 1 53 LYS C C 11.423 -2.363 5.358 1.00 . A A . 55 LYS C 1 1 14 10819 1 1 53 LYS CA C 10.964 -3.578 4.547 1.00 . A A . 55 LYS CA 1 1 14 10820 1 1 53 LYS CB C 11.454 -4.861 5.227 1.00 . A A . 55 LYS CB 1 1 14 10821 1 1 53 LYS CD C 10.313 -6.618 6.589 1.00 . A A . 55 LYS CD 1 1 14 10822 1 1 53 LYS CE C 10.888 -7.178 7.892 1.00 . A A . 55 LYS CE 1 1 14 10823 1 1 53 LYS CG C 10.630 -5.124 6.489 1.00 . A A . 55 LYS CG 1 1 14 10824 1 1 53 LYS H H 12.299 -4.067 2.929 1.00 . A A . 55 LYS H 1 1 14 10825 1 1 53 LYS HA H 9.886 -3.589 4.490 1.00 . A A . 55 LYS HA 1 1 14 10826 1 1 53 LYS HB2 H 11.345 -5.692 4.545 1.00 . A A . 55 LYS HB2 1 1 14 10827 1 1 53 LYS HB3 H 12.494 -4.751 5.495 1.00 . A A . 55 LYS HB3 1 1 14 10828 1 1 53 LYS HD2 H 9.243 -6.760 6.575 1.00 . A A . 55 LYS HD2 1 1 14 10829 1 1 53 LYS HD3 H 10.756 -7.136 5.752 1.00 . A A . 55 LYS HD3 1 1 14 10830 1 1 53 LYS HE2 H 11.370 -6.384 8.443 1.00 . A A . 55 LYS HE2 1 1 14 10831 1 1 53 LYS HE3 H 10.089 -7.596 8.487 1.00 . A A . 55 LYS HE3 1 1 14 10832 1 1 53 LYS HG2 H 11.194 -4.815 7.358 1.00 . A A . 55 LYS HG2 1 1 14 10833 1 1 53 LYS HG3 H 9.708 -4.565 6.440 1.00 . A A . 55 LYS HG3 1 1 14 10834 1 1 53 LYS HZ1 H 11.435 -9.174 7.671 1.00 . A A . 55 LYS HZ1 1 1 14 10835 1 1 53 LYS HZ2 H 12.683 -8.172 8.239 1.00 . A A . 55 LYS HZ2 1 1 14 10836 1 1 53 LYS HZ3 H 12.225 -8.120 6.604 1.00 . A A . 55 LYS HZ3 1 1 14 10837 1 1 53 LYS N N 11.537 -3.500 3.173 1.00 . A A . 55 LYS N 1 1 14 10838 1 1 53 LYS NZ N 11.882 -8.241 7.579 1.00 . A A . 55 LYS NZ 1 1 14 10839 1 1 53 LYS O O 12.602 -2.095 5.477 1.00 . A A . 55 LYS O 1 1 14 10840 1 1 54 CYS C C 11.676 -0.864 7.947 1.00 . A A . 56 CYS C 1 1 14 10841 1 1 54 CYS CA C 10.889 -0.424 6.711 1.00 . A A . 56 CYS CA 1 1 14 10842 1 1 54 CYS CB C 9.633 0.331 7.151 1.00 . A A . 56 CYS CB 1 1 14 10843 1 1 54 CYS H H 9.554 -1.853 5.802 1.00 . A A . 56 CYS H 1 1 14 10844 1 1 54 CYS HA H 11.505 0.225 6.105 1.00 . A A . 56 CYS HA 1 1 14 10845 1 1 54 CYS HB2 H 8.857 -0.374 7.408 1.00 . A A . 56 CYS HB2 1 1 14 10846 1 1 54 CYS HB3 H 9.862 0.943 8.011 1.00 . A A . 56 CYS HB3 1 1 14 10847 1 1 54 CYS N N 10.501 -1.623 5.913 1.00 . A A . 56 CYS N 1 1 14 10848 1 1 54 CYS O O 12.237 -0.002 8.604 1.00 . A A . 56 CYS O 1 1 14 10849 1 1 54 CYS OXT O 11.705 -2.054 8.215 1.00 . A A . 56 CYS OXT 1 1 14 10850 1 1 54 CYS SG S 9.060 1.388 5.799 1.00 . A A . 56 CYS SG 1 1 15 10851 1 1 1 ALA C C 6.592 9.028 -10.291 1.00 . A A . 3 ALA C 1 1 15 10852 1 1 1 ALA CA C 7.077 10.460 -10.061 1.00 . A A . 3 ALA CA 1 1 15 10853 1 1 1 ALA CB C 5.990 11.254 -9.333 1.00 . A A . 3 ALA CB 1 1 15 10854 1 1 1 ALA H1 H 6.477 11.412 -11.812 1.00 . A A . 3 ALA H1 1 1 15 10855 1 1 1 ALA H2 H 7.841 10.415 -11.997 1.00 . A A . 3 ALA H2 1 1 15 10856 1 1 1 ALA H3 H 7.984 11.925 -11.229 1.00 . A A . 3 ALA H3 1 1 15 10857 1 1 1 ALA HA H 7.975 10.443 -9.462 1.00 . A A . 3 ALA HA 1 1 15 10858 1 1 1 ALA HB1 H 5.584 10.657 -8.531 1.00 . A A . 3 ALA HB1 1 1 15 10859 1 1 1 ALA HB2 H 5.203 11.506 -10.028 1.00 . A A . 3 ALA HB2 1 1 15 10860 1 1 1 ALA HB3 H 6.417 12.160 -8.928 1.00 . A A . 3 ALA HB3 1 1 15 10861 1 1 1 ALA N N 7.367 11.101 -11.374 1.00 . A A . 3 ALA N 1 1 15 10862 1 1 1 ALA O O 6.381 8.608 -11.412 1.00 . A A . 3 ALA O 1 1 15 10863 1 1 2 VAL C C 4.582 6.712 -8.719 1.00 . A A . 4 VAL C 1 1 15 10864 1 1 2 VAL CA C 5.938 6.875 -9.405 1.00 . A A . 4 VAL CA 1 1 15 10865 1 1 2 VAL CB C 6.948 5.915 -8.774 1.00 . A A . 4 VAL CB 1 1 15 10866 1 1 2 VAL CG1 C 8.222 5.887 -9.621 1.00 . A A . 4 VAL CG1 1 1 15 10867 1 1 2 VAL CG2 C 7.287 6.386 -7.358 1.00 . A A . 4 VAL CG2 1 1 15 10868 1 1 2 VAL H H 6.586 8.636 -8.346 1.00 . A A . 4 VAL H 1 1 15 10869 1 1 2 VAL HA H 5.837 6.651 -10.457 1.00 . A A . 4 VAL HA 1 1 15 10870 1 1 2 VAL HB H 6.522 4.923 -8.733 1.00 . A A . 4 VAL HB 1 1 15 10871 1 1 2 VAL HG11 H 9.082 6.010 -8.980 1.00 . A A . 4 VAL HG11 1 1 15 10872 1 1 2 VAL HG12 H 8.192 6.689 -10.342 1.00 . A A . 4 VAL HG12 1 1 15 10873 1 1 2 VAL HG13 H 8.290 4.940 -10.136 1.00 . A A . 4 VAL HG13 1 1 15 10874 1 1 2 VAL HG21 H 7.155 5.568 -6.666 1.00 . A A . 4 VAL HG21 1 1 15 10875 1 1 2 VAL HG22 H 6.631 7.200 -7.083 1.00 . A A . 4 VAL HG22 1 1 15 10876 1 1 2 VAL HG23 H 8.313 6.723 -7.327 1.00 . A A . 4 VAL HG23 1 1 15 10877 1 1 2 VAL N N 6.412 8.277 -9.241 1.00 . A A . 4 VAL N 1 1 15 10878 1 1 2 VAL O O 4.228 7.466 -7.834 1.00 . A A . 4 VAL O 1 1 15 10879 1 1 3 SER C C 2.185 4.023 -8.444 1.00 . A A . 5 SER C 1 1 15 10880 1 1 3 SER CA C 2.487 5.521 -8.495 1.00 . A A . 5 SER CA 1 1 15 10881 1 1 3 SER CB C 1.416 6.231 -9.322 1.00 . A A . 5 SER CB 1 1 15 10882 1 1 3 SER H H 4.125 5.137 -9.837 1.00 . A A . 5 SER H 1 1 15 10883 1 1 3 SER HA H 2.493 5.921 -7.492 1.00 . A A . 5 SER HA 1 1 15 10884 1 1 3 SER HB2 H 0.508 6.309 -8.749 1.00 . A A . 5 SER HB2 1 1 15 10885 1 1 3 SER HB3 H 1.762 7.224 -9.580 1.00 . A A . 5 SER HB3 1 1 15 10886 1 1 3 SER HG H 0.575 6.001 -11.061 1.00 . A A . 5 SER HG 1 1 15 10887 1 1 3 SER N N 3.820 5.734 -9.121 1.00 . A A . 5 SER N 1 1 15 10888 1 1 3 SER O O 3.077 3.198 -8.475 1.00 . A A . 5 SER O 1 1 15 10889 1 1 3 SER OG O 1.161 5.484 -10.504 1.00 . A A . 5 SER OG 1 1 15 10890 1 1 4 VAL C C -0.697 1.973 -9.117 1.00 . A A . 6 VAL C 1 1 15 10891 1 1 4 VAL CA C 0.579 2.216 -8.308 1.00 . A A . 6 VAL CA 1 1 15 10892 1 1 4 VAL CB C 0.341 1.808 -6.853 1.00 . A A . 6 VAL CB 1 1 15 10893 1 1 4 VAL CG1 C -0.784 2.661 -6.262 1.00 . A A . 6 VAL CG1 1 1 15 10894 1 1 4 VAL CG2 C -0.057 0.332 -6.796 1.00 . A A . 6 VAL CG2 1 1 15 10895 1 1 4 VAL H H 0.229 4.341 -8.339 1.00 . A A . 6 VAL H 1 1 15 10896 1 1 4 VAL HA H 1.386 1.629 -8.721 1.00 . A A . 6 VAL HA 1 1 15 10897 1 1 4 VAL HB H 1.247 1.962 -6.284 1.00 . A A . 6 VAL HB 1 1 15 10898 1 1 4 VAL HG11 H -1.468 2.949 -7.046 1.00 . A A . 6 VAL HG11 1 1 15 10899 1 1 4 VAL HG12 H -0.364 3.546 -5.808 1.00 . A A . 6 VAL HG12 1 1 15 10900 1 1 4 VAL HG13 H -1.314 2.090 -5.515 1.00 . A A . 6 VAL HG13 1 1 15 10901 1 1 4 VAL HG21 H 0.809 -0.283 -6.995 1.00 . A A . 6 VAL HG21 1 1 15 10902 1 1 4 VAL HG22 H -0.816 0.134 -7.538 1.00 . A A . 6 VAL HG22 1 1 15 10903 1 1 4 VAL HG23 H -0.444 0.102 -5.814 1.00 . A A . 6 VAL HG23 1 1 15 10904 1 1 4 VAL N N 0.934 3.662 -8.364 1.00 . A A . 6 VAL N 1 1 15 10905 1 1 4 VAL O O -1.574 2.811 -9.175 1.00 . A A . 6 VAL O 1 1 15 10906 1 1 5 ASP C C -3.219 0.357 -9.574 1.00 . A A . 7 ASP C 1 1 15 10907 1 1 5 ASP CA C -2.039 0.538 -10.531 1.00 . A A . 7 ASP CA 1 1 15 10908 1 1 5 ASP CB C -1.832 -0.743 -11.343 1.00 . A A . 7 ASP CB 1 1 15 10909 1 1 5 ASP CG C -1.750 -1.942 -10.397 1.00 . A A . 7 ASP CG 1 1 15 10910 1 1 5 ASP H H -0.098 0.162 -9.675 1.00 . A A . 7 ASP H 1 1 15 10911 1 1 5 ASP HA H -2.240 1.362 -11.200 1.00 . A A . 7 ASP HA 1 1 15 10912 1 1 5 ASP HB2 H -2.660 -0.875 -12.023 1.00 . A A . 7 ASP HB2 1 1 15 10913 1 1 5 ASP HB3 H -0.913 -0.668 -11.905 1.00 . A A . 7 ASP HB3 1 1 15 10914 1 1 5 ASP N N -0.813 0.829 -9.736 1.00 . A A . 7 ASP N 1 1 15 10915 1 1 5 ASP O O -3.183 -0.463 -8.678 1.00 . A A . 7 ASP O 1 1 15 10916 1 1 5 ASP OD1 O -0.900 -1.926 -9.524 1.00 . A A . 7 ASP OD1 1 1 15 10917 1 1 5 ASP OD2 O -2.540 -2.857 -10.564 1.00 . A A . 7 ASP OD2 1 1 15 10918 1 1 6 CYS C C -6.717 1.262 -9.629 1.00 . A A . 8 CYS C 1 1 15 10919 1 1 6 CYS CA C -5.434 0.999 -8.843 1.00 . A A . 8 CYS CA 1 1 15 10920 1 1 6 CYS CB C -5.313 2.030 -7.720 1.00 . A A . 8 CYS CB 1 1 15 10921 1 1 6 CYS H H -4.268 1.781 -10.476 1.00 . A A . 8 CYS H 1 1 15 10922 1 1 6 CYS HA H -5.464 0.005 -8.420 1.00 . A A . 8 CYS HA 1 1 15 10923 1 1 6 CYS HB2 H -4.284 2.347 -7.634 1.00 . A A . 8 CYS HB2 1 1 15 10924 1 1 6 CYS HB3 H -5.934 2.883 -7.948 1.00 . A A . 8 CYS HB3 1 1 15 10925 1 1 6 CYS N N -4.260 1.122 -9.751 1.00 . A A . 8 CYS N 1 1 15 10926 1 1 6 CYS O O -7.549 2.035 -9.212 1.00 . A A . 8 CYS O 1 1 15 10927 1 1 6 CYS SG S -5.849 1.289 -6.162 1.00 . A A . 8 CYS SG 1 1 15 10928 1 1 7 SER C C -9.349 0.791 -10.742 1.00 . A A . 9 SER C 1 1 15 10929 1 1 7 SER CA C -8.085 0.833 -11.603 1.00 . A A . 9 SER CA 1 1 15 10930 1 1 7 SER CB C -8.157 -0.268 -12.659 1.00 . A A . 9 SER CB 1 1 15 10931 1 1 7 SER H H -6.171 0.018 -11.068 1.00 . A A . 9 SER H 1 1 15 10932 1 1 7 SER HA H -8.021 1.792 -12.095 1.00 . A A . 9 SER HA 1 1 15 10933 1 1 7 SER HB2 H -8.507 -1.180 -12.208 1.00 . A A . 9 SER HB2 1 1 15 10934 1 1 7 SER HB3 H -8.840 0.030 -13.442 1.00 . A A . 9 SER HB3 1 1 15 10935 1 1 7 SER HG H -6.950 -1.061 -13.964 1.00 . A A . 9 SER HG 1 1 15 10936 1 1 7 SER N N -6.868 0.629 -10.762 1.00 . A A . 9 SER N 1 1 15 10937 1 1 7 SER O O -9.996 -0.231 -10.622 1.00 . A A . 9 SER O 1 1 15 10938 1 1 7 SER OG O -6.861 -0.484 -13.202 1.00 . A A . 9 SER OG 1 1 15 10939 1 1 8 GLU C C -11.163 0.666 -8.579 1.00 . A A . 10 GLU C 1 1 15 10940 1 1 8 GLU CA C -10.926 1.987 -9.312 1.00 . A A . 10 GLU CA 1 1 15 10941 1 1 8 GLU CB C -12.134 2.301 -10.197 1.00 . A A . 10 GLU CB 1 1 15 10942 1 1 8 GLU CD C -12.730 4.588 -11.008 1.00 . A A . 10 GLU CD 1 1 15 10943 1 1 8 GLU CG C -12.719 3.656 -9.796 1.00 . A A . 10 GLU CG 1 1 15 10944 1 1 8 GLU H H -9.158 2.704 -10.299 1.00 . A A . 10 GLU H 1 1 15 10945 1 1 8 GLU HA H -10.804 2.779 -8.588 1.00 . A A . 10 GLU HA 1 1 15 10946 1 1 8 GLU HB2 H -11.823 2.334 -11.232 1.00 . A A . 10 GLU HB2 1 1 15 10947 1 1 8 GLU HB3 H -12.884 1.535 -10.070 1.00 . A A . 10 GLU HB3 1 1 15 10948 1 1 8 GLU HG2 H -13.729 3.519 -9.436 1.00 . A A . 10 GLU HG2 1 1 15 10949 1 1 8 GLU HG3 H -12.115 4.093 -9.014 1.00 . A A . 10 GLU HG3 1 1 15 10950 1 1 8 GLU N N -9.703 1.906 -10.164 1.00 . A A . 10 GLU N 1 1 15 10951 1 1 8 GLU O O -12.288 0.247 -8.393 1.00 . A A . 10 GLU O 1 1 15 10952 1 1 8 GLU OE1 O -11.876 4.424 -11.864 1.00 . A A . 10 GLU OE1 1 1 15 10953 1 1 8 GLU OE2 O -13.591 5.450 -11.060 1.00 . A A . 10 GLU OE2 1 1 15 10954 1 1 9 TYR C C -9.413 -1.391 -6.206 1.00 . A A . 11 TYR C 1 1 15 10955 1 1 9 TYR CA C -10.327 -1.296 -7.444 1.00 . A A . 11 TYR CA 1 1 15 10956 1 1 9 TYR CB C -10.064 -2.467 -8.408 1.00 . A A . 11 TYR CB 1 1 15 10957 1 1 9 TYR CD1 C -7.766 -1.818 -9.229 1.00 . A A . 11 TYR CD1 1 1 15 10958 1 1 9 TYR CD2 C -8.023 -3.888 -7.991 1.00 . A A . 11 TYR CD2 1 1 15 10959 1 1 9 TYR CE1 C -6.393 -2.067 -9.353 1.00 . A A . 11 TYR CE1 1 1 15 10960 1 1 9 TYR CE2 C -6.651 -4.133 -8.115 1.00 . A A . 11 TYR CE2 1 1 15 10961 1 1 9 TYR CG C -8.582 -2.730 -8.548 1.00 . A A . 11 TYR CG 1 1 15 10962 1 1 9 TYR CZ C -5.836 -3.223 -8.796 1.00 . A A . 11 TYR CZ 1 1 15 10963 1 1 9 TYR H H -9.214 0.345 -8.319 1.00 . A A . 11 TYR H 1 1 15 10964 1 1 9 TYR HA H -11.356 -1.345 -7.120 1.00 . A A . 11 TYR HA 1 1 15 10965 1 1 9 TYR HB2 H -10.546 -3.356 -8.027 1.00 . A A . 11 TYR HB2 1 1 15 10966 1 1 9 TYR HB3 H -10.477 -2.229 -9.378 1.00 . A A . 11 TYR HB3 1 1 15 10967 1 1 9 TYR HD1 H -8.194 -0.927 -9.657 1.00 . A A . 11 TYR HD1 1 1 15 10968 1 1 9 TYR HD2 H -8.651 -4.592 -7.465 1.00 . A A . 11 TYR HD2 1 1 15 10969 1 1 9 TYR HE1 H -5.765 -1.363 -9.878 1.00 . A A . 11 TYR HE1 1 1 15 10970 1 1 9 TYR HE2 H -6.221 -5.026 -7.686 1.00 . A A . 11 TYR HE2 1 1 15 10971 1 1 9 TYR HH H -4.137 -3.651 -8.044 1.00 . A A . 11 TYR HH 1 1 15 10972 1 1 9 TYR N N -10.120 -0.002 -8.161 1.00 . A A . 11 TYR N 1 1 15 10973 1 1 9 TYR O O -8.267 -1.778 -6.296 1.00 . A A . 11 TYR O 1 1 15 10974 1 1 9 TYR OH O -4.484 -3.465 -8.918 1.00 . A A . 11 TYR OH 1 1 15 10975 1 1 10 PRO C C -9.224 -2.541 -3.268 1.00 . A A . 12 PRO C 1 1 15 10976 1 1 10 PRO CA C -9.235 -1.098 -3.788 1.00 . A A . 12 PRO CA 1 1 15 10977 1 1 10 PRO CB C -10.060 -0.195 -2.868 1.00 . A A . 12 PRO CB 1 1 15 10978 1 1 10 PRO CD C -11.352 -0.553 -4.951 1.00 . A A . 12 PRO CD 1 1 15 10979 1 1 10 PRO CG C -11.484 -0.140 -3.473 1.00 . A A . 12 PRO CG 1 1 15 10980 1 1 10 PRO HA H -8.234 -0.713 -3.894 1.00 . A A . 12 PRO HA 1 1 15 10981 1 1 10 PRO HB2 H -10.090 -0.611 -1.871 1.00 . A A . 12 PRO HB2 1 1 15 10982 1 1 10 PRO HB3 H -9.638 0.798 -2.845 1.00 . A A . 12 PRO HB3 1 1 15 10983 1 1 10 PRO HD2 H -12.056 -1.340 -5.187 1.00 . A A . 12 PRO HD2 1 1 15 10984 1 1 10 PRO HD3 H -11.502 0.298 -5.596 1.00 . A A . 12 PRO HD3 1 1 15 10985 1 1 10 PRO HG2 H -12.134 -0.829 -2.950 1.00 . A A . 12 PRO HG2 1 1 15 10986 1 1 10 PRO HG3 H -11.877 0.862 -3.408 1.00 . A A . 12 PRO HG3 1 1 15 10987 1 1 10 PRO N N -9.963 -1.042 -5.068 1.00 . A A . 12 PRO N 1 1 15 10988 1 1 10 PRO O O -9.853 -3.413 -3.833 1.00 . A A . 12 PRO O 1 1 15 10989 1 1 11 LYS C C -7.825 -4.218 -0.290 1.00 . A A . 13 LYS C 1 1 15 10990 1 1 11 LYS CA C -8.496 -4.197 -1.662 1.00 . A A . 13 LYS CA 1 1 15 10991 1 1 11 LYS CB C -7.724 -5.104 -2.621 1.00 . A A . 13 LYS CB 1 1 15 10992 1 1 11 LYS CD C -8.602 -7.339 -3.318 1.00 . A A . 13 LYS CD 1 1 15 10993 1 1 11 LYS CE C -9.882 -8.023 -3.804 1.00 . A A . 13 LYS CE 1 1 15 10994 1 1 11 LYS CG C -8.715 -5.827 -3.532 1.00 . A A . 13 LYS CG 1 1 15 10995 1 1 11 LYS H H -8.024 -2.094 -1.746 1.00 . A A . 13 LYS H 1 1 15 10996 1 1 11 LYS HA H -9.509 -4.561 -1.569 1.00 . A A . 13 LYS HA 1 1 15 10997 1 1 11 LYS HB2 H -7.050 -4.507 -3.220 1.00 . A A . 13 LYS HB2 1 1 15 10998 1 1 11 LYS HB3 H -7.160 -5.830 -2.057 1.00 . A A . 13 LYS HB3 1 1 15 10999 1 1 11 LYS HD2 H -7.758 -7.718 -3.874 1.00 . A A . 13 LYS HD2 1 1 15 11000 1 1 11 LYS HD3 H -8.463 -7.546 -2.268 1.00 . A A . 13 LYS HD3 1 1 15 11001 1 1 11 LYS HE2 H -10.331 -8.570 -2.988 1.00 . A A . 13 LYS HE2 1 1 15 11002 1 1 11 LYS HE3 H -10.577 -7.277 -4.163 1.00 . A A . 13 LYS HE3 1 1 15 11003 1 1 11 LYS HG2 H -9.718 -5.502 -3.295 1.00 . A A . 13 LYS HG2 1 1 15 11004 1 1 11 LYS HG3 H -8.494 -5.591 -4.561 1.00 . A A . 13 LYS HG3 1 1 15 11005 1 1 11 LYS HZ1 H -8.537 -9.201 -4.873 1.00 . A A . 13 LYS HZ1 1 1 15 11006 1 1 11 LYS HZ2 H -9.771 -8.520 -5.824 1.00 . A A . 13 LYS HZ2 1 1 15 11007 1 1 11 LYS HZ3 H -10.109 -9.836 -4.805 1.00 . A A . 13 LYS HZ3 1 1 15 11008 1 1 11 LYS N N -8.523 -2.805 -2.198 1.00 . A A . 13 LYS N 1 1 15 11009 1 1 11 LYS NZ N -9.550 -8.966 -4.910 1.00 . A A . 13 LYS NZ 1 1 15 11010 1 1 11 LYS O O -6.615 -4.253 -0.178 1.00 . A A . 13 LYS O 1 1 15 11011 1 1 12 CYS C C -7.911 -5.698 2.584 1.00 . A A . 14 CYS C 1 1 15 11012 1 1 12 CYS CA C -8.018 -4.243 2.123 1.00 . A A . 14 CYS CA 1 1 15 11013 1 1 12 CYS CB C -8.918 -3.461 3.081 1.00 . A A . 14 CYS CB 1 1 15 11014 1 1 12 CYS H H -9.576 -4.190 0.638 1.00 . A A . 14 CYS H 1 1 15 11015 1 1 12 CYS HA H -7.035 -3.799 2.103 1.00 . A A . 14 CYS HA 1 1 15 11016 1 1 12 CYS HB2 H -9.851 -3.988 3.212 1.00 . A A . 14 CYS HB2 1 1 15 11017 1 1 12 CYS HB3 H -8.424 -3.356 4.036 1.00 . A A . 14 CYS HB3 1 1 15 11018 1 1 12 CYS N N -8.604 -4.211 0.755 1.00 . A A . 14 CYS N 1 1 15 11019 1 1 12 CYS O O -7.859 -5.989 3.763 1.00 . A A . 14 CYS O 1 1 15 11020 1 1 12 CYS SG S -9.242 -1.820 2.388 1.00 . A A . 14 CYS SG 1 1 15 11021 1 1 13 ALA C C -7.024 -8.775 0.876 1.00 . A A . 15 ALA C 1 1 15 11022 1 1 13 ALA CA C -7.760 -8.053 2.007 1.00 . A A . 15 ALA CA 1 1 15 11023 1 1 13 ALA CB C -9.159 -8.651 2.175 1.00 . A A . 15 ALA CB 1 1 15 11024 1 1 13 ALA H H -7.910 -6.341 0.712 1.00 . A A . 15 ALA H 1 1 15 11025 1 1 13 ALA HA H -7.206 -8.160 2.927 1.00 . A A . 15 ALA HA 1 1 15 11026 1 1 13 ALA HB1 H -9.093 -9.567 2.743 1.00 . A A . 15 ALA HB1 1 1 15 11027 1 1 13 ALA HB2 H -9.580 -8.860 1.203 1.00 . A A . 15 ALA HB2 1 1 15 11028 1 1 13 ALA HB3 H -9.791 -7.948 2.697 1.00 . A A . 15 ALA HB3 1 1 15 11029 1 1 13 ALA N N -7.872 -6.609 1.653 1.00 . A A . 15 ALA N 1 1 15 11030 1 1 13 ALA O O -7.612 -9.504 0.104 1.00 . A A . 15 ALA O 1 1 15 11031 1 1 14 CYS C C -4.625 -10.651 0.051 1.00 . A A . 16 CYS C 1 1 15 11032 1 1 14 CYS CA C -4.961 -9.208 -0.324 1.00 . A A . 16 CYS CA 1 1 15 11033 1 1 14 CYS CB C -3.673 -8.417 -0.548 1.00 . A A . 16 CYS CB 1 1 15 11034 1 1 14 CYS H H -5.296 -7.954 1.393 1.00 . A A . 16 CYS H 1 1 15 11035 1 1 14 CYS HA H -5.543 -9.204 -1.234 1.00 . A A . 16 CYS HA 1 1 15 11036 1 1 14 CYS HB2 H -2.952 -8.679 0.213 1.00 . A A . 16 CYS HB2 1 1 15 11037 1 1 14 CYS HB3 H -3.269 -8.650 -1.522 1.00 . A A . 16 CYS HB3 1 1 15 11038 1 1 14 CYS N N -5.743 -8.559 0.766 1.00 . A A . 16 CYS N 1 1 15 11039 1 1 14 CYS O O -4.920 -11.111 1.137 1.00 . A A . 16 CYS O 1 1 15 11040 1 1 14 CYS SG S -4.041 -6.648 -0.452 1.00 . A A . 16 CYS SG 1 1 15 11041 1 1 15 THR C C -2.235 -12.863 0.008 1.00 . A A . 17 THR C 1 1 15 11042 1 1 15 THR CA C -3.660 -12.790 -0.571 1.00 . A A . 17 THR CA 1 1 15 11043 1 1 15 THR CB C -3.771 -13.593 -1.873 1.00 . A A . 17 THR CB 1 1 15 11044 1 1 15 THR CG2 C -2.911 -12.941 -2.958 1.00 . A A . 17 THR CG2 1 1 15 11045 1 1 15 THR H H -3.797 -10.976 -1.721 1.00 . A A . 17 THR H 1 1 15 11046 1 1 15 THR HA H -4.354 -13.191 0.153 1.00 . A A . 17 THR HA 1 1 15 11047 1 1 15 THR HB H -4.801 -13.599 -2.197 1.00 . A A . 17 THR HB 1 1 15 11048 1 1 15 THR HG1 H -3.595 -15.452 -2.415 1.00 . A A . 17 THR HG1 1 1 15 11049 1 1 15 THR HG21 H -3.533 -12.321 -3.587 1.00 . A A . 17 THR HG21 1 1 15 11050 1 1 15 THR HG22 H -2.444 -13.708 -3.557 1.00 . A A . 17 THR HG22 1 1 15 11051 1 1 15 THR HG23 H -2.148 -12.331 -2.496 1.00 . A A . 17 THR HG23 1 1 15 11052 1 1 15 THR N N -4.015 -11.371 -0.851 1.00 . A A . 17 THR N 1 1 15 11053 1 1 15 THR O O -1.963 -12.301 1.050 1.00 . A A . 17 THR O 1 1 15 11054 1 1 15 THR OG1 O -3.344 -14.929 -1.650 1.00 . A A . 17 THR OG1 1 1 15 11055 1 1 16 MET C C 1.053 -12.969 -1.039 1.00 . A A . 18 MET C 1 1 15 11056 1 1 16 MET CA C 0.060 -13.636 -0.082 1.00 . A A . 18 MET CA 1 1 15 11057 1 1 16 MET CB C 0.441 -15.106 0.105 1.00 . A A . 18 MET CB 1 1 15 11058 1 1 16 MET CE C 0.058 -17.211 2.479 1.00 . A A . 18 MET CE 1 1 15 11059 1 1 16 MET CG C 1.452 -15.232 1.247 1.00 . A A . 18 MET CG 1 1 15 11060 1 1 16 MET H H -1.537 -14.006 -1.469 1.00 . A A . 18 MET H 1 1 15 11061 1 1 16 MET HA H 0.093 -13.134 0.874 1.00 . A A . 18 MET HA 1 1 15 11062 1 1 16 MET HB2 H -0.445 -15.679 0.342 1.00 . A A . 18 MET HB2 1 1 15 11063 1 1 16 MET HB3 H 0.881 -15.483 -0.806 1.00 . A A . 18 MET HB3 1 1 15 11064 1 1 16 MET HE1 H 0.137 -17.414 1.419 1.00 . A A . 18 MET HE1 1 1 15 11065 1 1 16 MET HE2 H -0.965 -17.347 2.792 1.00 . A A . 18 MET HE2 1 1 15 11066 1 1 16 MET HE3 H 0.694 -17.891 3.030 1.00 . A A . 18 MET HE3 1 1 15 11067 1 1 16 MET HG2 H 2.111 -16.065 1.054 1.00 . A A . 18 MET HG2 1 1 15 11068 1 1 16 MET HG3 H 2.032 -14.324 1.317 1.00 . A A . 18 MET HG3 1 1 15 11069 1 1 16 MET N N -1.320 -13.548 -0.636 1.00 . A A . 18 MET N 1 1 15 11070 1 1 16 MET O O 2.245 -13.189 -0.957 1.00 . A A . 18 MET O 1 1 15 11071 1 1 16 MET SD S 0.571 -15.508 2.806 1.00 . A A . 18 MET SD 1 1 15 11072 1 1 17 GLU C C 2.690 -10.902 -2.096 1.00 . A A . 19 GLU C 1 1 15 11073 1 1 17 GLU CA C 1.510 -11.473 -2.886 1.00 . A A . 19 GLU CA 1 1 15 11074 1 1 17 GLU CB C 0.773 -10.337 -3.599 1.00 . A A . 19 GLU CB 1 1 15 11075 1 1 17 GLU CD C -0.502 -11.938 -5.037 1.00 . A A . 19 GLU CD 1 1 15 11076 1 1 17 GLU CG C 0.461 -10.750 -5.040 1.00 . A A . 19 GLU CG 1 1 15 11077 1 1 17 GLU H H -0.384 -11.980 -1.989 1.00 . A A . 19 GLU H 1 1 15 11078 1 1 17 GLU HA H 1.871 -12.185 -3.613 1.00 . A A . 19 GLU HA 1 1 15 11079 1 1 17 GLU HB2 H -0.149 -10.124 -3.079 1.00 . A A . 19 GLU HB2 1 1 15 11080 1 1 17 GLU HB3 H 1.394 -9.454 -3.606 1.00 . A A . 19 GLU HB3 1 1 15 11081 1 1 17 GLU HG2 H 0.008 -9.919 -5.562 1.00 . A A . 19 GLU HG2 1 1 15 11082 1 1 17 GLU HG3 H 1.376 -11.032 -5.539 1.00 . A A . 19 GLU HG3 1 1 15 11083 1 1 17 GLU N N 0.579 -12.152 -1.939 1.00 . A A . 19 GLU N 1 1 15 11084 1 1 17 GLU O O 2.512 -10.277 -1.068 1.00 . A A . 19 GLU O 1 1 15 11085 1 1 17 GLU OE1 O -0.147 -12.962 -4.478 1.00 . A A . 19 GLU OE1 1 1 15 11086 1 1 17 GLU OE2 O -1.577 -11.804 -5.595 1.00 . A A . 19 GLU OE2 1 1 15 11087 1 1 18 TYR C C 5.626 -9.341 -2.516 1.00 . A A . 20 TYR C 1 1 15 11088 1 1 18 TYR CA C 5.067 -10.573 -1.810 1.00 . A A . 20 TYR CA 1 1 15 11089 1 1 18 TYR CB C 6.163 -11.623 -1.728 1.00 . A A . 20 TYR CB 1 1 15 11090 1 1 18 TYR CD1 C 6.455 -11.954 0.754 1.00 . A A . 20 TYR CD1 1 1 15 11091 1 1 18 TYR CD2 C 8.134 -10.699 -0.466 1.00 . A A . 20 TYR CD2 1 1 15 11092 1 1 18 TYR CE1 C 7.172 -11.760 1.939 1.00 . A A . 20 TYR CE1 1 1 15 11093 1 1 18 TYR CE2 C 8.850 -10.503 0.721 1.00 . A A . 20 TYR CE2 1 1 15 11094 1 1 18 TYR CG C 6.938 -11.425 -0.449 1.00 . A A . 20 TYR CG 1 1 15 11095 1 1 18 TYR CZ C 8.369 -11.033 1.924 1.00 . A A . 20 TYR CZ 1 1 15 11096 1 1 18 TYR H H 4.026 -11.618 -3.384 1.00 . A A . 20 TYR H 1 1 15 11097 1 1 18 TYR HA H 4.760 -10.302 -0.811 1.00 . A A . 20 TYR HA 1 1 15 11098 1 1 18 TYR HB2 H 5.727 -12.610 -1.746 1.00 . A A . 20 TYR HB2 1 1 15 11099 1 1 18 TYR HB3 H 6.824 -11.499 -2.568 1.00 . A A . 20 TYR HB3 1 1 15 11100 1 1 18 TYR HD1 H 5.532 -12.515 0.765 1.00 . A A . 20 TYR HD1 1 1 15 11101 1 1 18 TYR HD2 H 8.507 -10.292 -1.394 1.00 . A A . 20 TYR HD2 1 1 15 11102 1 1 18 TYR HE1 H 6.799 -12.167 2.869 1.00 . A A . 20 TYR HE1 1 1 15 11103 1 1 18 TYR HE2 H 9.772 -9.942 0.709 1.00 . A A . 20 TYR HE2 1 1 15 11104 1 1 18 TYR HH H 8.949 -9.926 3.366 1.00 . A A . 20 TYR HH 1 1 15 11105 1 1 18 TYR N N 3.894 -11.109 -2.556 1.00 . A A . 20 TYR N 1 1 15 11106 1 1 18 TYR O O 6.416 -9.435 -3.433 1.00 . A A . 20 TYR O 1 1 15 11107 1 1 18 TYR OH O 9.074 -10.839 3.093 1.00 . A A . 20 TYR OH 1 1 15 11108 1 1 19 ARG C C 5.843 -5.874 -1.568 1.00 . A A . 21 ARG C 1 1 15 11109 1 1 19 ARG CA C 5.738 -6.928 -2.674 1.00 . A A . 21 ARG CA 1 1 15 11110 1 1 19 ARG CB C 4.769 -6.446 -3.758 1.00 . A A . 21 ARG CB 1 1 15 11111 1 1 19 ARG CD C 5.293 -8.225 -5.436 1.00 . A A . 21 ARG CD 1 1 15 11112 1 1 19 ARG CG C 4.209 -7.650 -4.521 1.00 . A A . 21 ARG CG 1 1 15 11113 1 1 19 ARG CZ C 5.494 -10.364 -6.559 1.00 . A A . 21 ARG CZ 1 1 15 11114 1 1 19 ARG H H 4.617 -8.161 -1.319 1.00 . A A . 21 ARG H 1 1 15 11115 1 1 19 ARG HA H 6.712 -7.098 -3.107 1.00 . A A . 21 ARG HA 1 1 15 11116 1 1 19 ARG HB2 H 3.956 -5.901 -3.299 1.00 . A A . 21 ARG HB2 1 1 15 11117 1 1 19 ARG HB3 H 5.291 -5.799 -4.446 1.00 . A A . 21 ARG HB3 1 1 15 11118 1 1 19 ARG HD2 H 5.175 -7.824 -6.432 1.00 . A A . 21 ARG HD2 1 1 15 11119 1 1 19 ARG HD3 H 6.267 -7.957 -5.053 1.00 . A A . 21 ARG HD3 1 1 15 11120 1 1 19 ARG HE H 4.837 -10.195 -4.694 1.00 . A A . 21 ARG HE 1 1 15 11121 1 1 19 ARG HG2 H 3.893 -8.406 -3.817 1.00 . A A . 21 ARG HG2 1 1 15 11122 1 1 19 ARG HG3 H 3.365 -7.338 -5.118 1.00 . A A . 21 ARG HG3 1 1 15 11123 1 1 19 ARG HH11 H 7.313 -9.539 -6.696 1.00 . A A . 21 ARG HH11 1 1 15 11124 1 1 19 ARG HH12 H 6.914 -10.685 -7.932 1.00 . A A . 21 ARG HH12 1 1 15 11125 1 1 19 ARG HH21 H 3.753 -11.344 -6.672 1.00 . A A . 21 ARG HH21 1 1 15 11126 1 1 19 ARG HH22 H 4.900 -11.706 -7.919 1.00 . A A . 21 ARG HH22 1 1 15 11127 1 1 19 ARG N N 5.234 -8.193 -2.071 1.00 . A A . 21 ARG N 1 1 15 11128 1 1 19 ARG NE N 5.166 -9.709 -5.479 1.00 . A A . 21 ARG NE 1 1 15 11129 1 1 19 ARG NH1 N 6.664 -10.182 -7.105 1.00 . A A . 21 ARG NH1 1 1 15 11130 1 1 19 ARG NH2 N 4.650 -11.203 -7.091 1.00 . A A . 21 ARG NH2 1 1 15 11131 1 1 19 ARG O O 4.882 -5.194 -1.268 1.00 . A A . 21 ARG O 1 1 15 11132 1 1 20 PRO C C 7.412 -3.410 -0.414 1.00 . A A . 22 PRO C 1 1 15 11133 1 1 20 PRO CA C 7.265 -4.836 0.118 1.00 . A A . 22 PRO CA 1 1 15 11134 1 1 20 PRO CB C 8.577 -5.340 0.726 1.00 . A A . 22 PRO CB 1 1 15 11135 1 1 20 PRO CD C 8.171 -6.608 -1.359 1.00 . A A . 22 PRO CD 1 1 15 11136 1 1 20 PRO CG C 9.274 -6.176 -0.373 1.00 . A A . 22 PRO CG 1 1 15 11137 1 1 20 PRO HA H 6.479 -4.887 0.854 1.00 . A A . 22 PRO HA 1 1 15 11138 1 1 20 PRO HB2 H 9.198 -4.500 1.010 1.00 . A A . 22 PRO HB2 1 1 15 11139 1 1 20 PRO HB3 H 8.375 -5.962 1.583 1.00 . A A . 22 PRO HB3 1 1 15 11140 1 1 20 PRO HD2 H 8.472 -6.398 -2.377 1.00 . A A . 22 PRO HD2 1 1 15 11141 1 1 20 PRO HD3 H 7.942 -7.656 -1.237 1.00 . A A . 22 PRO HD3 1 1 15 11142 1 1 20 PRO HG2 H 10.015 -5.573 -0.882 1.00 . A A . 22 PRO HG2 1 1 15 11143 1 1 20 PRO HG3 H 9.738 -7.047 0.060 1.00 . A A . 22 PRO HG3 1 1 15 11144 1 1 20 PRO N N 7.006 -5.784 -0.979 1.00 . A A . 22 PRO N 1 1 15 11145 1 1 20 PRO O O 8.305 -3.108 -1.181 1.00 . A A . 22 PRO O 1 1 15 11146 1 1 21 LEU C C 6.779 -0.191 0.728 1.00 . A A . 23 LEU C 1 1 15 11147 1 1 21 LEU CA C 6.621 -1.120 -0.477 1.00 . A A . 23 LEU CA 1 1 15 11148 1 1 21 LEU CB C 5.341 -0.759 -1.234 1.00 . A A . 23 LEU CB 1 1 15 11149 1 1 21 LEU CD1 C 3.456 -1.902 -2.407 1.00 . A A . 23 LEU CD1 1 1 15 11150 1 1 21 LEU CD2 C 5.675 -1.683 -3.532 1.00 . A A . 23 LEU CD2 1 1 15 11151 1 1 21 LEU CG C 4.970 -1.895 -2.190 1.00 . A A . 23 LEU CG 1 1 15 11152 1 1 21 LEU H H 5.829 -2.797 0.617 1.00 . A A . 23 LEU H 1 1 15 11153 1 1 21 LEU HA H 7.471 -1.008 -1.133 1.00 . A A . 23 LEU HA 1 1 15 11154 1 1 21 LEU HB2 H 4.538 -0.604 -0.529 1.00 . A A . 23 LEU HB2 1 1 15 11155 1 1 21 LEU HB3 H 5.501 0.146 -1.801 1.00 . A A . 23 LEU HB3 1 1 15 11156 1 1 21 LEU HD11 H 2.977 -2.412 -1.584 1.00 . A A . 23 LEU HD11 1 1 15 11157 1 1 21 LEU HD12 H 3.228 -2.413 -3.331 1.00 . A A . 23 LEU HD12 1 1 15 11158 1 1 21 LEU HD13 H 3.096 -0.886 -2.460 1.00 . A A . 23 LEU HD13 1 1 15 11159 1 1 21 LEU HD21 H 5.246 -2.344 -4.272 1.00 . A A . 23 LEU HD21 1 1 15 11160 1 1 21 LEU HD22 H 6.727 -1.899 -3.424 1.00 . A A . 23 LEU HD22 1 1 15 11161 1 1 21 LEU HD23 H 5.549 -0.659 -3.848 1.00 . A A . 23 LEU HD23 1 1 15 11162 1 1 21 LEU HG H 5.277 -2.840 -1.765 1.00 . A A . 23 LEU HG 1 1 15 11163 1 1 21 LEU N N 6.539 -2.530 -0.004 1.00 . A A . 23 LEU N 1 1 15 11164 1 1 21 LEU O O 6.059 -0.294 1.702 1.00 . A A . 23 LEU O 1 1 15 11165 1 1 22 CYS C C 7.037 2.891 1.614 1.00 . A A . 24 CYS C 1 1 15 11166 1 1 22 CYS CA C 7.914 1.652 1.817 1.00 . A A . 24 CYS CA 1 1 15 11167 1 1 22 CYS CB C 9.389 2.065 1.883 1.00 . A A . 24 CYS CB 1 1 15 11168 1 1 22 CYS H H 8.284 0.785 -0.121 1.00 . A A . 24 CYS H 1 1 15 11169 1 1 22 CYS HA H 7.634 1.160 2.737 1.00 . A A . 24 CYS HA 1 1 15 11170 1 1 22 CYS HB2 H 9.978 1.232 2.238 1.00 . A A . 24 CYS HB2 1 1 15 11171 1 1 22 CYS HB3 H 9.727 2.351 0.898 1.00 . A A . 24 CYS HB3 1 1 15 11172 1 1 22 CYS N N 7.713 0.718 0.673 1.00 . A A . 24 CYS N 1 1 15 11173 1 1 22 CYS O O 7.446 3.861 1.009 1.00 . A A . 24 CYS O 1 1 15 11174 1 1 22 CYS SG S 9.584 3.463 3.019 1.00 . A A . 24 CYS SG 1 1 15 11175 1 1 23 GLY C C 5.663 5.306 2.405 1.00 . A A . 25 GLY C 1 1 15 11176 1 1 23 GLY CA C 4.932 4.041 1.953 1.00 . A A . 25 GLY CA 1 1 15 11177 1 1 23 GLY H H 5.521 2.073 2.605 1.00 . A A . 25 GLY H 1 1 15 11178 1 1 23 GLY HA2 H 4.653 4.138 0.913 1.00 . A A . 25 GLY HA2 1 1 15 11179 1 1 23 GLY HA3 H 4.047 3.906 2.554 1.00 . A A . 25 GLY HA3 1 1 15 11180 1 1 23 GLY N N 5.832 2.865 2.118 1.00 . A A . 25 GLY N 1 1 15 11181 1 1 23 GLY O O 6.398 5.294 3.372 1.00 . A A . 25 GLY O 1 1 15 11182 1 1 24 SER C C 5.928 7.960 3.581 1.00 . A A . 26 SER C 1 1 15 11183 1 1 24 SER CA C 6.153 7.664 2.095 1.00 . A A . 26 SER CA 1 1 15 11184 1 1 24 SER CB C 5.590 8.816 1.264 1.00 . A A . 26 SER CB 1 1 15 11185 1 1 24 SER H H 4.871 6.378 0.933 1.00 . A A . 26 SER H 1 1 15 11186 1 1 24 SER HA H 7.211 7.570 1.905 1.00 . A A . 26 SER HA 1 1 15 11187 1 1 24 SER HB2 H 6.135 8.895 0.339 1.00 . A A . 26 SER HB2 1 1 15 11188 1 1 24 SER HB3 H 4.546 8.625 1.049 1.00 . A A . 26 SER HB3 1 1 15 11189 1 1 24 SER HG H 4.976 10.591 1.770 1.00 . A A . 26 SER HG 1 1 15 11190 1 1 24 SER N N 5.468 6.395 1.711 1.00 . A A . 26 SER N 1 1 15 11191 1 1 24 SER O O 6.643 8.737 4.180 1.00 . A A . 26 SER O 1 1 15 11192 1 1 24 SER OG O 5.722 10.028 1.992 1.00 . A A . 26 SER OG 1 1 15 11193 1 1 25 ASP C C 5.507 6.659 6.485 1.00 . A A . 27 ASP C 1 1 15 11194 1 1 25 ASP CA C 4.670 7.610 5.624 1.00 . A A . 27 ASP CA 1 1 15 11195 1 1 25 ASP CB C 3.185 7.389 5.912 1.00 . A A . 27 ASP CB 1 1 15 11196 1 1 25 ASP CG C 2.832 5.916 5.694 1.00 . A A . 27 ASP CG 1 1 15 11197 1 1 25 ASP H H 4.371 6.735 3.679 1.00 . A A . 27 ASP H 1 1 15 11198 1 1 25 ASP HA H 4.933 8.631 5.861 1.00 . A A . 27 ASP HA 1 1 15 11199 1 1 25 ASP HB2 H 2.972 7.663 6.936 1.00 . A A . 27 ASP HB2 1 1 15 11200 1 1 25 ASP HB3 H 2.597 8.000 5.245 1.00 . A A . 27 ASP HB3 1 1 15 11201 1 1 25 ASP N N 4.939 7.354 4.179 1.00 . A A . 27 ASP N 1 1 15 11202 1 1 25 ASP O O 5.174 6.371 7.617 1.00 . A A . 27 ASP O 1 1 15 11203 1 1 25 ASP OD1 O 3.490 5.283 4.885 1.00 . A A . 27 ASP OD1 1 1 15 11204 1 1 25 ASP OD2 O 1.908 5.447 6.339 1.00 . A A . 27 ASP OD2 1 1 15 11205 1 1 26 ASN C C 6.686 3.981 7.090 1.00 . A A . 28 ASN C 1 1 15 11206 1 1 26 ASN CA C 7.463 5.250 6.737 1.00 . A A . 28 ASN CA 1 1 15 11207 1 1 26 ASN CB C 7.912 5.941 8.027 1.00 . A A . 28 ASN CB 1 1 15 11208 1 1 26 ASN CG C 9.301 5.438 8.424 1.00 . A A . 28 ASN CG 1 1 15 11209 1 1 26 ASN H H 6.846 6.426 5.045 1.00 . A A . 28 ASN H 1 1 15 11210 1 1 26 ASN HA H 8.332 4.987 6.150 1.00 . A A . 28 ASN HA 1 1 15 11211 1 1 26 ASN HB2 H 7.947 7.010 7.867 1.00 . A A . 28 ASN HB2 1 1 15 11212 1 1 26 ASN HB3 H 7.211 5.718 8.817 1.00 . A A . 28 ASN HB3 1 1 15 11213 1 1 26 ASN HD21 H 10.181 6.157 6.795 1.00 . A A . 28 ASN HD21 1 1 15 11214 1 1 26 ASN HD22 H 11.209 5.349 7.879 1.00 . A A . 28 ASN HD22 1 1 15 11215 1 1 26 ASN N N 6.596 6.176 5.955 1.00 . A A . 28 ASN N 1 1 15 11216 1 1 26 ASN ND2 N 10.315 5.667 7.634 1.00 . A A . 28 ASN ND2 1 1 15 11217 1 1 26 ASN O O 6.931 3.356 8.103 1.00 . A A . 28 ASN O 1 1 15 11218 1 1 26 ASN OD1 O 9.466 4.832 9.463 1.00 . A A . 28 ASN OD1 1 1 15 11219 1 1 27 LYS C C 5.421 1.217 5.672 1.00 . A A . 29 LYS C 1 1 15 11220 1 1 27 LYS CA C 4.965 2.363 6.577 1.00 . A A . 29 LYS CA 1 1 15 11221 1 1 27 LYS CB C 3.480 2.636 6.346 1.00 . A A . 29 LYS CB 1 1 15 11222 1 1 27 LYS CD C 2.963 2.966 8.765 1.00 . A A . 29 LYS CD 1 1 15 11223 1 1 27 LYS CE C 3.100 2.068 9.997 1.00 . A A . 29 LYS CE 1 1 15 11224 1 1 27 LYS CG C 2.682 2.103 7.533 1.00 . A A . 29 LYS CG 1 1 15 11225 1 1 27 LYS H H 5.557 4.103 5.457 1.00 . A A . 29 LYS H 1 1 15 11226 1 1 27 LYS HA H 5.122 2.088 7.607 1.00 . A A . 29 LYS HA 1 1 15 11227 1 1 27 LYS HB2 H 3.320 3.699 6.250 1.00 . A A . 29 LYS HB2 1 1 15 11228 1 1 27 LYS HB3 H 3.157 2.137 5.444 1.00 . A A . 29 LYS HB3 1 1 15 11229 1 1 27 LYS HD2 H 3.880 3.517 8.616 1.00 . A A . 29 LYS HD2 1 1 15 11230 1 1 27 LYS HD3 H 2.147 3.656 8.914 1.00 . A A . 29 LYS HD3 1 1 15 11231 1 1 27 LYS HE2 H 2.304 1.338 10.001 1.00 . A A . 29 LYS HE2 1 1 15 11232 1 1 27 LYS HE3 H 4.053 1.561 9.971 1.00 . A A . 29 LYS HE3 1 1 15 11233 1 1 27 LYS HG2 H 1.629 2.138 7.300 1.00 . A A . 29 LYS HG2 1 1 15 11234 1 1 27 LYS HG3 H 2.977 1.085 7.734 1.00 . A A . 29 LYS HG3 1 1 15 11235 1 1 27 LYS HZ1 H 2.266 2.530 11.848 1.00 . A A . 29 LYS HZ1 1 1 15 11236 1 1 27 LYS HZ2 H 2.794 3.884 10.968 1.00 . A A . 29 LYS HZ2 1 1 15 11237 1 1 27 LYS HZ3 H 3.923 2.871 11.733 1.00 . A A . 29 LYS HZ3 1 1 15 11238 1 1 27 LYS N N 5.749 3.591 6.270 1.00 . A A . 29 LYS N 1 1 15 11239 1 1 27 LYS NZ N 3.014 2.901 11.230 1.00 . A A . 29 LYS NZ 1 1 15 11240 1 1 27 LYS O O 6.116 1.419 4.697 1.00 . A A . 29 LYS O 1 1 15 11241 1 1 28 THR C C 4.201 -1.945 4.743 1.00 . A A . 30 THR C 1 1 15 11242 1 1 28 THR CA C 5.444 -1.152 5.159 1.00 . A A . 30 THR CA 1 1 15 11243 1 1 28 THR CB C 6.377 -2.055 5.970 1.00 . A A . 30 THR CB 1 1 15 11244 1 1 28 THR CG2 C 6.558 -3.389 5.245 1.00 . A A . 30 THR CG2 1 1 15 11245 1 1 28 THR H H 4.476 -0.128 6.787 1.00 . A A . 30 THR H 1 1 15 11246 1 1 28 THR HA H 5.958 -0.801 4.277 1.00 . A A . 30 THR HA 1 1 15 11247 1 1 28 THR HB H 5.949 -2.234 6.944 1.00 . A A . 30 THR HB 1 1 15 11248 1 1 28 THR HG1 H 7.786 -1.264 7.054 1.00 . A A . 30 THR HG1 1 1 15 11249 1 1 28 THR HG21 H 6.014 -4.160 5.769 1.00 . A A . 30 THR HG21 1 1 15 11250 1 1 28 THR HG22 H 7.607 -3.644 5.216 1.00 . A A . 30 THR HG22 1 1 15 11251 1 1 28 THR HG23 H 6.180 -3.303 4.237 1.00 . A A . 30 THR HG23 1 1 15 11252 1 1 28 THR N N 5.035 0.012 5.994 1.00 . A A . 30 THR N 1 1 15 11253 1 1 28 THR O O 3.545 -2.562 5.560 1.00 . A A . 30 THR O 1 1 15 11254 1 1 28 THR OG1 O 7.639 -1.418 6.117 1.00 . A A . 30 THR OG1 1 1 15 11255 1 1 29 TYR C C 3.101 -4.049 2.482 1.00 . A A . 31 TYR C 1 1 15 11256 1 1 29 TYR CA C 2.673 -2.678 3.013 1.00 . A A . 31 TYR CA 1 1 15 11257 1 1 29 TYR CB C 1.999 -1.880 1.900 1.00 . A A . 31 TYR CB 1 1 15 11258 1 1 29 TYR CD1 C 0.252 -0.744 3.319 1.00 . A A . 31 TYR CD1 1 1 15 11259 1 1 29 TYR CD2 C 1.910 0.622 2.196 1.00 . A A . 31 TYR CD2 1 1 15 11260 1 1 29 TYR CE1 C -0.328 0.407 3.864 1.00 . A A . 31 TYR CE1 1 1 15 11261 1 1 29 TYR CE2 C 1.330 1.773 2.741 1.00 . A A . 31 TYR CE2 1 1 15 11262 1 1 29 TYR CG C 1.370 -0.637 2.484 1.00 . A A . 31 TYR CG 1 1 15 11263 1 1 29 TYR CZ C 0.212 1.666 3.575 1.00 . A A . 31 TYR CZ 1 1 15 11264 1 1 29 TYR H H 4.406 -1.428 2.837 1.00 . A A . 31 TYR H 1 1 15 11265 1 1 29 TYR HA H 1.982 -2.808 3.834 1.00 . A A . 31 TYR HA 1 1 15 11266 1 1 29 TYR HB2 H 2.737 -1.598 1.162 1.00 . A A . 31 TYR HB2 1 1 15 11267 1 1 29 TYR HB3 H 1.241 -2.482 1.437 1.00 . A A . 31 TYR HB3 1 1 15 11268 1 1 29 TYR HD1 H -0.165 -1.716 3.543 1.00 . A A . 31 TYR HD1 1 1 15 11269 1 1 29 TYR HD2 H 2.774 0.705 1.552 1.00 . A A . 31 TYR HD2 1 1 15 11270 1 1 29 TYR HE1 H -1.191 0.325 4.507 1.00 . A A . 31 TYR HE1 1 1 15 11271 1 1 29 TYR HE2 H 1.746 2.745 2.519 1.00 . A A . 31 TYR HE2 1 1 15 11272 1 1 29 TYR HH H 0.339 3.329 4.503 1.00 . A A . 31 TYR HH 1 1 15 11273 1 1 29 TYR N N 3.869 -1.932 3.481 1.00 . A A . 31 TYR N 1 1 15 11274 1 1 29 TYR O O 4.153 -4.195 1.892 1.00 . A A . 31 TYR O 1 1 15 11275 1 1 29 TYR OH O -0.360 2.800 4.112 1.00 . A A . 31 TYR OH 1 1 15 11276 1 1 30 GLY C C 2.681 -6.434 0.675 1.00 . A A . 32 GLY C 1 1 15 11277 1 1 30 GLY CA C 2.654 -6.417 2.205 1.00 . A A . 32 GLY CA 1 1 15 11278 1 1 30 GLY H H 1.451 -4.913 3.172 1.00 . A A . 32 GLY H 1 1 15 11279 1 1 30 GLY HA2 H 3.630 -6.687 2.584 1.00 . A A . 32 GLY HA2 1 1 15 11280 1 1 30 GLY HA3 H 1.923 -7.130 2.557 1.00 . A A . 32 GLY HA3 1 1 15 11281 1 1 30 GLY N N 2.293 -5.054 2.692 1.00 . A A . 32 GLY N 1 1 15 11282 1 1 30 GLY O O 3.408 -7.196 0.072 1.00 . A A . 32 GLY O 1 1 15 11283 1 1 31 ASN C C 1.156 -4.346 -1.947 1.00 . A A . 33 ASN C 1 1 15 11284 1 1 31 ASN CA C 1.893 -5.589 -1.449 1.00 . A A . 33 ASN CA 1 1 15 11285 1 1 31 ASN CB C 1.200 -6.847 -1.979 1.00 . A A . 33 ASN CB 1 1 15 11286 1 1 31 ASN CG C -0.072 -7.112 -1.176 1.00 . A A . 33 ASN CG 1 1 15 11287 1 1 31 ASN H H 1.317 -4.995 0.536 1.00 . A A . 33 ASN H 1 1 15 11288 1 1 31 ASN HA H 2.909 -5.566 -1.808 1.00 . A A . 33 ASN HA 1 1 15 11289 1 1 31 ASN HB2 H 0.946 -6.707 -3.020 1.00 . A A . 33 ASN HB2 1 1 15 11290 1 1 31 ASN HB3 H 1.866 -7.691 -1.882 1.00 . A A . 33 ASN HB3 1 1 15 11291 1 1 31 ASN HD21 H 0.535 -8.891 -0.537 1.00 . A A . 33 ASN HD21 1 1 15 11292 1 1 31 ASN HD22 H -1.000 -8.410 0.006 1.00 . A A . 33 ASN HD22 1 1 15 11293 1 1 31 ASN N N 1.897 -5.606 0.038 1.00 . A A . 33 ASN N 1 1 15 11294 1 1 31 ASN ND2 N -0.189 -8.231 -0.514 1.00 . A A . 33 ASN ND2 1 1 15 11295 1 1 31 ASN O O 0.463 -3.682 -1.204 1.00 . A A . 33 ASN O 1 1 15 11296 1 1 31 ASN OD1 O -0.968 -6.295 -1.153 1.00 . A A . 33 ASN OD1 1 1 15 11297 1 1 32 LYS C C -0.880 -2.960 -3.591 1.00 . A A . 34 LYS C 1 1 15 11298 1 1 32 LYS CA C 0.632 -2.819 -3.752 1.00 . A A . 34 LYS CA 1 1 15 11299 1 1 32 LYS CB C 0.977 -2.670 -5.234 1.00 . A A . 34 LYS CB 1 1 15 11300 1 1 32 LYS CD C 0.660 -3.860 -7.408 1.00 . A A . 34 LYS CD 1 1 15 11301 1 1 32 LYS CE C 1.988 -3.837 -8.165 1.00 . A A . 34 LYS CE 1 1 15 11302 1 1 32 LYS CG C 0.927 -4.040 -5.912 1.00 . A A . 34 LYS CG 1 1 15 11303 1 1 32 LYS H H 1.882 -4.566 -3.773 1.00 . A A . 34 LYS H 1 1 15 11304 1 1 32 LYS HA H 0.962 -1.945 -3.214 1.00 . A A . 34 LYS HA 1 1 15 11305 1 1 32 LYS HB2 H 0.265 -2.007 -5.704 1.00 . A A . 34 LYS HB2 1 1 15 11306 1 1 32 LYS HB3 H 1.970 -2.258 -5.331 1.00 . A A . 34 LYS HB3 1 1 15 11307 1 1 32 LYS HD2 H 0.054 -4.681 -7.766 1.00 . A A . 34 LYS HD2 1 1 15 11308 1 1 32 LYS HD3 H 0.138 -2.930 -7.572 1.00 . A A . 34 LYS HD3 1 1 15 11309 1 1 32 LYS HE2 H 2.131 -2.863 -8.610 1.00 . A A . 34 LYS HE2 1 1 15 11310 1 1 32 LYS HE3 H 2.797 -4.041 -7.479 1.00 . A A . 34 LYS HE3 1 1 15 11311 1 1 32 LYS HG2 H 1.871 -4.546 -5.772 1.00 . A A . 34 LYS HG2 1 1 15 11312 1 1 32 LYS HG3 H 0.134 -4.629 -5.476 1.00 . A A . 34 LYS HG3 1 1 15 11313 1 1 32 LYS HZ1 H 1.440 -5.705 -8.904 1.00 . A A . 34 LYS HZ1 1 1 15 11314 1 1 32 LYS HZ2 H 2.947 -5.153 -9.463 1.00 . A A . 34 LYS HZ2 1 1 15 11315 1 1 32 LYS HZ3 H 1.511 -4.488 -10.085 1.00 . A A . 34 LYS HZ3 1 1 15 11316 1 1 32 LYS N N 1.311 -4.022 -3.199 1.00 . A A . 34 LYS N 1 1 15 11317 1 1 32 LYS NZ N 1.970 -4.874 -9.235 1.00 . A A . 34 LYS NZ 1 1 15 11318 1 1 32 LYS O O -1.608 -1.993 -3.662 1.00 . A A . 34 LYS O 1 1 15 11319 1 1 33 CYS C C -3.209 -3.697 -1.847 1.00 . A A . 35 CYS C 1 1 15 11320 1 1 33 CYS CA C -2.822 -4.326 -3.185 1.00 . A A . 35 CYS CA 1 1 15 11321 1 1 33 CYS CB C -3.137 -5.824 -3.204 1.00 . A A . 35 CYS CB 1 1 15 11322 1 1 33 CYS H H -0.764 -4.924 -3.298 1.00 . A A . 35 CYS H 1 1 15 11323 1 1 33 CYS HA H -3.349 -3.830 -3.985 1.00 . A A . 35 CYS HA 1 1 15 11324 1 1 33 CYS HB2 H -3.236 -6.144 -4.225 1.00 . A A . 35 CYS HB2 1 1 15 11325 1 1 33 CYS HB3 H -2.323 -6.364 -2.742 1.00 . A A . 35 CYS HB3 1 1 15 11326 1 1 33 CYS N N -1.361 -4.150 -3.364 1.00 . A A . 35 CYS N 1 1 15 11327 1 1 33 CYS O O -4.247 -3.079 -1.706 1.00 . A A . 35 CYS O 1 1 15 11328 1 1 33 CYS SG S -4.674 -6.173 -2.310 1.00 . A A . 35 CYS SG 1 1 15 11329 1 1 34 ASN C C -2.377 -1.726 0.344 1.00 . A A . 36 ASN C 1 1 15 11330 1 1 34 ASN CA C -2.638 -3.224 0.452 1.00 . A A . 36 ASN CA 1 1 15 11331 1 1 34 ASN CB C -1.709 -3.840 1.498 1.00 . A A . 36 ASN CB 1 1 15 11332 1 1 34 ASN CG C -2.504 -4.144 2.767 1.00 . A A . 36 ASN CG 1 1 15 11333 1 1 34 ASN H H -1.519 -4.308 -1.023 1.00 . A A . 36 ASN H 1 1 15 11334 1 1 34 ASN HA H -3.669 -3.399 0.725 1.00 . A A . 36 ASN HA 1 1 15 11335 1 1 34 ASN HB2 H -1.287 -4.755 1.109 1.00 . A A . 36 ASN HB2 1 1 15 11336 1 1 34 ASN HB3 H -0.916 -3.147 1.727 1.00 . A A . 36 ASN HB3 1 1 15 11337 1 1 34 ASN HD21 H -4.021 -4.962 1.785 1.00 . A A . 36 ASN HD21 1 1 15 11338 1 1 34 ASN HD22 H -4.185 -4.927 3.473 1.00 . A A . 36 ASN HD22 1 1 15 11339 1 1 34 ASN N N -2.357 -3.829 -0.873 1.00 . A A . 36 ASN N 1 1 15 11340 1 1 34 ASN ND2 N -3.666 -4.726 2.668 1.00 . A A . 36 ASN ND2 1 1 15 11341 1 1 34 ASN O O -2.967 -0.923 1.039 1.00 . A A . 36 ASN O 1 1 15 11342 1 1 34 ASN OD1 O -2.061 -3.853 3.861 1.00 . A A . 36 ASN OD1 1 1 15 11343 1 1 35 PHE C C -2.398 0.742 -1.435 1.00 . A A . 37 PHE C 1 1 15 11344 1 1 35 PHE CA C -1.203 0.092 -0.742 1.00 . A A . 37 PHE CA 1 1 15 11345 1 1 35 PHE CB C 0.048 0.232 -1.615 1.00 . A A . 37 PHE CB 1 1 15 11346 1 1 35 PHE CD1 C -0.144 2.589 -2.496 1.00 . A A . 37 PHE CD1 1 1 15 11347 1 1 35 PHE CD2 C 1.542 2.101 -0.822 1.00 . A A . 37 PHE CD2 1 1 15 11348 1 1 35 PHE CE1 C 0.270 3.925 -2.524 1.00 . A A . 37 PHE CE1 1 1 15 11349 1 1 35 PHE CE2 C 1.957 3.439 -0.851 1.00 . A A . 37 PHE CE2 1 1 15 11350 1 1 35 PHE CG C 0.490 1.676 -1.644 1.00 . A A . 37 PHE CG 1 1 15 11351 1 1 35 PHE CZ C 1.322 4.350 -1.703 1.00 . A A . 37 PHE CZ 1 1 15 11352 1 1 35 PHE H H -1.056 -2.020 -1.106 1.00 . A A . 37 PHE H 1 1 15 11353 1 1 35 PHE HA H -1.040 0.560 0.215 1.00 . A A . 37 PHE HA 1 1 15 11354 1 1 35 PHE HB2 H 0.840 -0.378 -1.206 1.00 . A A . 37 PHE HB2 1 1 15 11355 1 1 35 PHE HB3 H -0.176 -0.098 -2.619 1.00 . A A . 37 PHE HB3 1 1 15 11356 1 1 35 PHE HD1 H -0.955 2.261 -3.130 1.00 . A A . 37 PHE HD1 1 1 15 11357 1 1 35 PHE HD2 H 2.032 1.398 -0.166 1.00 . A A . 37 PHE HD2 1 1 15 11358 1 1 35 PHE HE1 H -0.220 4.629 -3.181 1.00 . A A . 37 PHE HE1 1 1 15 11359 1 1 35 PHE HE2 H 2.768 3.767 -0.216 1.00 . A A . 37 PHE HE2 1 1 15 11360 1 1 35 PHE HZ H 1.642 5.382 -1.725 1.00 . A A . 37 PHE HZ 1 1 15 11361 1 1 35 PHE N N -1.504 -1.349 -0.549 1.00 . A A . 37 PHE N 1 1 15 11362 1 1 35 PHE O O -2.692 1.906 -1.243 1.00 . A A . 37 PHE O 1 1 15 11363 1 1 36 CYS C C -5.402 0.745 -1.913 1.00 . A A . 38 CYS C 1 1 15 11364 1 1 36 CYS CA C -4.289 0.522 -2.933 1.00 . A A . 38 CYS CA 1 1 15 11365 1 1 36 CYS CB C -4.758 -0.486 -3.982 1.00 . A A . 38 CYS CB 1 1 15 11366 1 1 36 CYS H H -2.842 -0.955 -2.353 1.00 . A A . 38 CYS H 1 1 15 11367 1 1 36 CYS HA H -4.039 1.456 -3.412 1.00 . A A . 38 CYS HA 1 1 15 11368 1 1 36 CYS HB2 H -4.287 -1.441 -3.800 1.00 . A A . 38 CYS HB2 1 1 15 11369 1 1 36 CYS HB3 H -5.831 -0.598 -3.921 1.00 . A A . 38 CYS HB3 1 1 15 11370 1 1 36 CYS N N -3.098 -0.019 -2.229 1.00 . A A . 38 CYS N 1 1 15 11371 1 1 36 CYS O O -6.220 1.633 -2.051 1.00 . A A . 38 CYS O 1 1 15 11372 1 1 36 CYS SG S -4.305 0.104 -5.630 1.00 . A A . 38 CYS SG 1 1 15 11373 1 1 37 CYS C C -6.066 1.261 1.089 1.00 . A A . 39 CYS C 1 1 15 11374 1 1 37 CYS CA C -6.484 0.119 0.157 1.00 . A A . 39 CYS CA 1 1 15 11375 1 1 37 CYS CB C -6.647 -1.191 0.946 1.00 . A A . 39 CYS CB 1 1 15 11376 1 1 37 CYS H H -4.753 -0.758 -0.785 1.00 . A A . 39 CYS H 1 1 15 11377 1 1 37 CYS HA H -7.419 0.372 -0.320 1.00 . A A . 39 CYS HA 1 1 15 11378 1 1 37 CYS HB2 H -7.246 -1.882 0.369 1.00 . A A . 39 CYS HB2 1 1 15 11379 1 1 37 CYS HB3 H -5.675 -1.625 1.125 1.00 . A A . 39 CYS HB3 1 1 15 11380 1 1 37 CYS N N -5.431 -0.052 -0.881 1.00 . A A . 39 CYS N 1 1 15 11381 1 1 37 CYS O O -6.891 1.961 1.641 1.00 . A A . 39 CYS O 1 1 15 11382 1 1 37 CYS SG S -7.467 -0.869 2.533 1.00 . A A . 39 CYS SG 1 1 15 11383 1 1 38 ALA C C -4.411 3.880 1.372 1.00 . A A . 40 ALA C 1 1 15 11384 1 1 38 ALA CA C -4.313 2.562 2.138 1.00 . A A . 40 ALA CA 1 1 15 11385 1 1 38 ALA CB C -2.858 2.311 2.538 1.00 . A A . 40 ALA CB 1 1 15 11386 1 1 38 ALA H H -4.138 0.888 0.795 1.00 . A A . 40 ALA H 1 1 15 11387 1 1 38 ALA HA H -4.929 2.609 3.023 1.00 . A A . 40 ALA HA 1 1 15 11388 1 1 38 ALA HB1 H -2.705 1.255 2.701 1.00 . A A . 40 ALA HB1 1 1 15 11389 1 1 38 ALA HB2 H -2.637 2.852 3.446 1.00 . A A . 40 ALA HB2 1 1 15 11390 1 1 38 ALA HB3 H -2.204 2.653 1.748 1.00 . A A . 40 ALA HB3 1 1 15 11391 1 1 38 ALA N N -4.787 1.460 1.257 1.00 . A A . 40 ALA N 1 1 15 11392 1 1 38 ALA O O -4.440 4.951 1.949 1.00 . A A . 40 ALA O 1 1 15 11393 1 1 39 VAL C C -6.024 5.465 -0.873 1.00 . A A . 41 VAL C 1 1 15 11394 1 1 39 VAL CA C -4.557 5.043 -0.752 1.00 . A A . 41 VAL CA 1 1 15 11395 1 1 39 VAL CB C -3.988 4.763 -2.144 1.00 . A A . 41 VAL CB 1 1 15 11396 1 1 39 VAL CG1 C -4.376 5.895 -3.097 1.00 . A A . 41 VAL CG1 1 1 15 11397 1 1 39 VAL CG2 C -2.462 4.668 -2.061 1.00 . A A . 41 VAL CG2 1 1 15 11398 1 1 39 VAL H H -4.436 2.931 -0.368 1.00 . A A . 41 VAL H 1 1 15 11399 1 1 39 VAL HA H -3.991 5.834 -0.282 1.00 . A A . 41 VAL HA 1 1 15 11400 1 1 39 VAL HB H -4.387 3.827 -2.511 1.00 . A A . 41 VAL HB 1 1 15 11401 1 1 39 VAL HG11 H -4.644 6.770 -2.526 1.00 . A A . 41 VAL HG11 1 1 15 11402 1 1 39 VAL HG12 H -5.218 5.586 -3.698 1.00 . A A . 41 VAL HG12 1 1 15 11403 1 1 39 VAL HG13 H -3.539 6.126 -3.739 1.00 . A A . 41 VAL HG13 1 1 15 11404 1 1 39 VAL HG21 H -2.042 5.662 -2.000 1.00 . A A . 41 VAL HG21 1 1 15 11405 1 1 39 VAL HG22 H -2.084 4.172 -2.943 1.00 . A A . 41 VAL HG22 1 1 15 11406 1 1 39 VAL HG23 H -2.183 4.105 -1.183 1.00 . A A . 41 VAL HG23 1 1 15 11407 1 1 39 VAL N N -4.462 3.806 0.071 1.00 . A A . 41 VAL N 1 1 15 11408 1 1 39 VAL O O -6.340 6.636 -0.948 1.00 . A A . 41 VAL O 1 1 15 11409 1 1 40 VAL C C -8.968 5.052 0.377 1.00 . A A . 42 VAL C 1 1 15 11410 1 1 40 VAL CA C -8.366 4.863 -1.019 1.00 . A A . 42 VAL CA 1 1 15 11411 1 1 40 VAL CB C -9.101 3.734 -1.750 1.00 . A A . 42 VAL CB 1 1 15 11412 1 1 40 VAL CG1 C -10.611 3.919 -1.594 1.00 . A A . 42 VAL CG1 1 1 15 11413 1 1 40 VAL CG2 C -8.739 3.768 -3.236 1.00 . A A . 42 VAL CG2 1 1 15 11414 1 1 40 VAL H H -6.641 3.581 -0.840 1.00 . A A . 42 VAL H 1 1 15 11415 1 1 40 VAL HA H -8.469 5.780 -1.580 1.00 . A A . 42 VAL HA 1 1 15 11416 1 1 40 VAL HB H -8.812 2.782 -1.328 1.00 . A A . 42 VAL HB 1 1 15 11417 1 1 40 VAL HG11 H -10.881 4.929 -1.869 1.00 . A A . 42 VAL HG11 1 1 15 11418 1 1 40 VAL HG12 H -10.892 3.740 -0.567 1.00 . A A . 42 VAL HG12 1 1 15 11419 1 1 40 VAL HG13 H -11.128 3.221 -2.236 1.00 . A A . 42 VAL HG13 1 1 15 11420 1 1 40 VAL HG21 H -7.727 3.414 -3.368 1.00 . A A . 42 VAL HG21 1 1 15 11421 1 1 40 VAL HG22 H -8.817 4.780 -3.603 1.00 . A A . 42 VAL HG22 1 1 15 11422 1 1 40 VAL HG23 H -9.417 3.132 -3.786 1.00 . A A . 42 VAL HG23 1 1 15 11423 1 1 40 VAL N N -6.920 4.518 -0.899 1.00 . A A . 42 VAL N 1 1 15 11424 1 1 40 VAL O O -10.083 5.511 0.524 1.00 . A A . 42 VAL O 1 1 15 11425 1 1 41 GLU C C -8.136 6.088 3.444 1.00 . A A . 43 GLU C 1 1 15 11426 1 1 41 GLU CA C -8.779 4.867 2.786 1.00 . A A . 43 GLU CA 1 1 15 11427 1 1 41 GLU CB C -8.463 3.618 3.613 1.00 . A A . 43 GLU CB 1 1 15 11428 1 1 41 GLU CD C -6.530 4.003 5.152 1.00 . A A . 43 GLU CD 1 1 15 11429 1 1 41 GLU CG C -6.948 3.485 3.775 1.00 . A A . 43 GLU CG 1 1 15 11430 1 1 41 GLU H H -7.343 4.334 1.268 1.00 . A A . 43 GLU H 1 1 15 11431 1 1 41 GLU HA H -9.850 5.005 2.740 1.00 . A A . 43 GLU HA 1 1 15 11432 1 1 41 GLU HB2 H -8.924 3.705 4.586 1.00 . A A . 43 GLU HB2 1 1 15 11433 1 1 41 GLU HB3 H -8.847 2.744 3.108 1.00 . A A . 43 GLU HB3 1 1 15 11434 1 1 41 GLU HG2 H -6.667 2.446 3.681 1.00 . A A . 43 GLU HG2 1 1 15 11435 1 1 41 GLU HG3 H -6.453 4.063 3.009 1.00 . A A . 43 GLU HG3 1 1 15 11436 1 1 41 GLU N N -8.242 4.703 1.405 1.00 . A A . 43 GLU N 1 1 15 11437 1 1 41 GLU O O -8.711 6.711 4.315 1.00 . A A . 43 GLU O 1 1 15 11438 1 1 41 GLU OE1 O -6.580 5.207 5.350 1.00 . A A . 43 GLU OE1 1 1 15 11439 1 1 41 GLU OE2 O -6.167 3.190 5.984 1.00 . A A . 43 GLU OE2 1 1 15 11440 1 1 42 SER C C -6.695 8.890 2.902 1.00 . A A . 44 SER C 1 1 15 11441 1 1 42 SER CA C -6.271 7.619 3.643 1.00 . A A . 44 SER CA 1 1 15 11442 1 1 42 SER CB C -4.755 7.450 3.541 1.00 . A A . 44 SER CB 1 1 15 11443 1 1 42 SER H H -6.497 5.923 2.333 1.00 . A A . 44 SER H 1 1 15 11444 1 1 42 SER HA H -6.554 7.700 4.683 1.00 . A A . 44 SER HA 1 1 15 11445 1 1 42 SER HB2 H -4.507 6.403 3.527 1.00 . A A . 44 SER HB2 1 1 15 11446 1 1 42 SER HB3 H -4.403 7.915 2.629 1.00 . A A . 44 SER HB3 1 1 15 11447 1 1 42 SER HG H -4.723 8.752 4.988 1.00 . A A . 44 SER HG 1 1 15 11448 1 1 42 SER N N -6.946 6.438 3.037 1.00 . A A . 44 SER N 1 1 15 11449 1 1 42 SER O O -6.193 9.966 3.160 1.00 . A A . 44 SER O 1 1 15 11450 1 1 42 SER OG O -4.139 8.062 4.667 1.00 . A A . 44 SER OG 1 1 15 11451 1 1 43 ASN C C -7.003 10.356 0.197 1.00 . A A . 45 ASN C 1 1 15 11452 1 1 43 ASN CA C -8.067 9.973 1.225 1.00 . A A . 45 ASN CA 1 1 15 11453 1 1 43 ASN CB C -8.283 11.136 2.195 1.00 . A A . 45 ASN CB 1 1 15 11454 1 1 43 ASN CG C -9.658 11.759 1.945 1.00 . A A . 45 ASN CG 1 1 15 11455 1 1 43 ASN H H -8.003 7.897 1.788 1.00 . A A . 45 ASN H 1 1 15 11456 1 1 43 ASN HA H -8.993 9.749 0.718 1.00 . A A . 45 ASN HA 1 1 15 11457 1 1 43 ASN HB2 H -8.231 10.773 3.212 1.00 . A A . 45 ASN HB2 1 1 15 11458 1 1 43 ASN HB3 H -7.519 11.881 2.038 1.00 . A A . 45 ASN HB3 1 1 15 11459 1 1 43 ASN HD21 H -9.437 13.152 3.342 1.00 . A A . 45 ASN HD21 1 1 15 11460 1 1 43 ASN HD22 H -10.913 13.193 2.506 1.00 . A A . 45 ASN HD22 1 1 15 11461 1 1 43 ASN N N -7.612 8.773 1.982 1.00 . A A . 45 ASN N 1 1 15 11462 1 1 43 ASN ND2 N -10.033 12.787 2.657 1.00 . A A . 45 ASN ND2 1 1 15 11463 1 1 43 ASN O O -6.944 11.479 -0.262 1.00 . A A . 45 ASN O 1 1 15 11464 1 1 43 ASN OD1 O -10.398 11.306 1.095 1.00 . A A . 45 ASN OD1 1 1 15 11465 1 1 44 GLY C C -3.961 10.497 -0.480 1.00 . A A . 46 GLY C 1 1 15 11466 1 1 44 GLY CA C -5.099 9.741 -1.167 1.00 . A A . 46 GLY CA 1 1 15 11467 1 1 44 GLY H H -6.223 8.530 0.213 1.00 . A A . 46 GLY H 1 1 15 11468 1 1 44 GLY HA2 H -4.720 8.821 -1.589 1.00 . A A . 46 GLY HA2 1 1 15 11469 1 1 44 GLY HA3 H -5.513 10.356 -1.952 1.00 . A A . 46 GLY HA3 1 1 15 11470 1 1 44 GLY N N -6.159 9.429 -0.169 1.00 . A A . 46 GLY N 1 1 15 11471 1 1 44 GLY O O -3.164 11.155 -1.120 1.00 . A A . 46 GLY O 1 1 15 11472 1 1 45 THR C C -1.631 10.166 1.807 1.00 . A A . 47 THR C 1 1 15 11473 1 1 45 THR CA C -2.795 11.125 1.549 1.00 . A A . 47 THR CA 1 1 15 11474 1 1 45 THR CB C -3.332 11.649 2.883 1.00 . A A . 47 THR CB 1 1 15 11475 1 1 45 THR CG2 C -3.643 10.473 3.810 1.00 . A A . 47 THR CG2 1 1 15 11476 1 1 45 THR H H -4.535 9.874 1.317 1.00 . A A . 47 THR H 1 1 15 11477 1 1 45 THR HA H -2.448 11.956 0.953 1.00 . A A . 47 THR HA 1 1 15 11478 1 1 45 THR HB H -4.236 12.213 2.711 1.00 . A A . 47 THR HB 1 1 15 11479 1 1 45 THR HG1 H -2.647 13.395 3.397 1.00 . A A . 47 THR HG1 1 1 15 11480 1 1 45 THR HG21 H -4.099 9.677 3.240 1.00 . A A . 47 THR HG21 1 1 15 11481 1 1 45 THR HG22 H -4.322 10.795 4.585 1.00 . A A . 47 THR HG22 1 1 15 11482 1 1 45 THR HG23 H -2.727 10.117 4.258 1.00 . A A . 47 THR HG23 1 1 15 11483 1 1 45 THR N N -3.880 10.409 0.820 1.00 . A A . 47 THR N 1 1 15 11484 1 1 45 THR O O -0.812 10.387 2.676 1.00 . A A . 47 THR O 1 1 15 11485 1 1 45 THR OG1 O -2.356 12.485 3.489 1.00 . A A . 47 THR OG1 1 1 15 11486 1 1 46 LEU C C 0.330 7.973 -0.063 1.00 . A A . 48 LEU C 1 1 15 11487 1 1 46 LEU CA C -0.436 8.133 1.252 1.00 . A A . 48 LEU CA 1 1 15 11488 1 1 46 LEU CB C -1.006 6.780 1.682 1.00 . A A . 48 LEU CB 1 1 15 11489 1 1 46 LEU CD1 C -0.303 5.669 3.808 1.00 . A A . 48 LEU CD1 1 1 15 11490 1 1 46 LEU CD2 C 0.263 4.630 1.607 1.00 . A A . 48 LEU CD2 1 1 15 11491 1 1 46 LEU CG C 0.091 5.953 2.357 1.00 . A A . 48 LEU CG 1 1 15 11492 1 1 46 LEU H H -2.219 8.944 0.356 1.00 . A A . 48 LEU H 1 1 15 11493 1 1 46 LEU HA H 0.233 8.502 2.015 1.00 . A A . 48 LEU HA 1 1 15 11494 1 1 46 LEU HB2 H -1.818 6.937 2.377 1.00 . A A . 48 LEU HB2 1 1 15 11495 1 1 46 LEU HB3 H -1.372 6.251 0.815 1.00 . A A . 48 LEU HB3 1 1 15 11496 1 1 46 LEU HD11 H -0.587 6.592 4.292 1.00 . A A . 48 LEU HD11 1 1 15 11497 1 1 46 LEU HD12 H 0.537 5.232 4.329 1.00 . A A . 48 LEU HD12 1 1 15 11498 1 1 46 LEU HD13 H -1.135 4.981 3.828 1.00 . A A . 48 LEU HD13 1 1 15 11499 1 1 46 LEU HD21 H 1.302 4.498 1.344 1.00 . A A . 48 LEU HD21 1 1 15 11500 1 1 46 LEU HD22 H -0.336 4.645 0.709 1.00 . A A . 48 LEU HD22 1 1 15 11501 1 1 46 LEU HD23 H -0.054 3.813 2.239 1.00 . A A . 48 LEU HD23 1 1 15 11502 1 1 46 LEU HG H 1.020 6.504 2.338 1.00 . A A . 48 LEU HG 1 1 15 11503 1 1 46 LEU N N -1.549 9.103 1.054 1.00 . A A . 48 LEU N 1 1 15 11504 1 1 46 LEU O O -0.254 7.883 -1.126 1.00 . A A . 48 LEU O 1 1 15 11505 1 1 47 THR C C 3.470 6.694 -1.080 1.00 . A A . 49 THR C 1 1 15 11506 1 1 47 THR CA C 2.429 7.797 -1.260 1.00 . A A . 49 THR CA 1 1 15 11507 1 1 47 THR CB C 3.137 9.120 -1.582 1.00 . A A . 49 THR CB 1 1 15 11508 1 1 47 THR CG2 C 2.327 10.293 -1.023 1.00 . A A . 49 THR CG2 1 1 15 11509 1 1 47 THR H H 2.088 8.024 0.858 1.00 . A A . 49 THR H 1 1 15 11510 1 1 47 THR HA H 1.775 7.536 -2.075 1.00 . A A . 49 THR HA 1 1 15 11511 1 1 47 THR HB H 3.225 9.229 -2.652 1.00 . A A . 49 THR HB 1 1 15 11512 1 1 47 THR HG1 H 4.814 9.990 -1.122 1.00 . A A . 49 THR HG1 1 1 15 11513 1 1 47 THR HG21 H 2.892 11.205 -1.132 1.00 . A A . 49 THR HG21 1 1 15 11514 1 1 47 THR HG22 H 2.119 10.120 0.023 1.00 . A A . 49 THR HG22 1 1 15 11515 1 1 47 THR HG23 H 1.397 10.378 -1.565 1.00 . A A . 49 THR HG23 1 1 15 11516 1 1 47 THR N N 1.633 7.944 -0.006 1.00 . A A . 49 THR N 1 1 15 11517 1 1 47 THR O O 3.302 5.786 -0.291 1.00 . A A . 49 THR O 1 1 15 11518 1 1 47 THR OG1 O 4.432 9.117 -1.000 1.00 . A A . 49 THR OG1 1 1 15 11519 1 1 48 LEU C C 6.928 6.425 -1.338 1.00 . A A . 50 LEU C 1 1 15 11520 1 1 48 LEU CA C 5.611 5.737 -1.706 1.00 . A A . 50 LEU CA 1 1 15 11521 1 1 48 LEU CB C 5.761 5.021 -3.051 1.00 . A A . 50 LEU CB 1 1 15 11522 1 1 48 LEU CD1 C 6.147 2.920 -1.757 1.00 . A A . 50 LEU CD1 1 1 15 11523 1 1 48 LEU CD2 C 6.691 3.005 -4.193 1.00 . A A . 50 LEU CD2 1 1 15 11524 1 1 48 LEU CG C 6.672 3.804 -2.887 1.00 . A A . 50 LEU CG 1 1 15 11525 1 1 48 LEU H H 4.643 7.514 -2.438 1.00 . A A . 50 LEU H 1 1 15 11526 1 1 48 LEU HA H 5.348 5.023 -0.940 1.00 . A A . 50 LEU HA 1 1 15 11527 1 1 48 LEU HB2 H 4.788 4.698 -3.395 1.00 . A A . 50 LEU HB2 1 1 15 11528 1 1 48 LEU HB3 H 6.191 5.696 -3.773 1.00 . A A . 50 LEU HB3 1 1 15 11529 1 1 48 LEU HD11 H 6.431 1.894 -1.939 1.00 . A A . 50 LEU HD11 1 1 15 11530 1 1 48 LEU HD12 H 5.070 2.993 -1.713 1.00 . A A . 50 LEU HD12 1 1 15 11531 1 1 48 LEU HD13 H 6.568 3.248 -0.818 1.00 . A A . 50 LEU HD13 1 1 15 11532 1 1 48 LEU HD21 H 6.646 1.949 -3.970 1.00 . A A . 50 LEU HD21 1 1 15 11533 1 1 48 LEU HD22 H 7.601 3.219 -4.733 1.00 . A A . 50 LEU HD22 1 1 15 11534 1 1 48 LEU HD23 H 5.840 3.282 -4.798 1.00 . A A . 50 LEU HD23 1 1 15 11535 1 1 48 LEU HG H 7.674 4.134 -2.652 1.00 . A A . 50 LEU HG 1 1 15 11536 1 1 48 LEU N N 4.542 6.771 -1.813 1.00 . A A . 50 LEU N 1 1 15 11537 1 1 48 LEU O O 7.042 7.633 -1.405 1.00 . A A . 50 LEU O 1 1 15 11538 1 1 49 SER C C 10.389 5.378 -0.879 1.00 . A A . 51 SER C 1 1 15 11539 1 1 49 SER CA C 9.217 6.314 -0.571 1.00 . A A . 51 SER CA 1 1 15 11540 1 1 49 SER CB C 9.205 6.638 0.922 1.00 . A A . 51 SER CB 1 1 15 11541 1 1 49 SER H H 7.815 4.704 -0.888 1.00 . A A . 51 SER H 1 1 15 11542 1 1 49 SER HA H 9.336 7.229 -1.130 1.00 . A A . 51 SER HA 1 1 15 11543 1 1 49 SER HB2 H 8.369 6.150 1.394 1.00 . A A . 51 SER HB2 1 1 15 11544 1 1 49 SER HB3 H 10.125 6.288 1.373 1.00 . A A . 51 SER HB3 1 1 15 11545 1 1 49 SER HG H 8.613 8.395 0.335 1.00 . A A . 51 SER HG 1 1 15 11546 1 1 49 SER N N 7.922 5.676 -0.944 1.00 . A A . 51 SER N 1 1 15 11547 1 1 49 SER O O 11.471 5.821 -1.211 1.00 . A A . 51 SER O 1 1 15 11548 1 1 49 SER OG O 9.084 8.044 1.095 1.00 . A A . 51 SER OG 1 1 15 11549 1 1 50 HIS C C 10.765 1.761 -1.357 1.00 . A A . 52 HIS C 1 1 15 11550 1 1 50 HIS CA C 11.323 3.156 -1.042 1.00 . A A . 52 HIS CA 1 1 15 11551 1 1 50 HIS CB C 12.239 3.106 0.193 1.00 . A A . 52 HIS CB 1 1 15 11552 1 1 50 HIS CD2 C 14.110 1.322 -0.309 1.00 . A A . 52 HIS CD2 1 1 15 11553 1 1 50 HIS CE1 C 13.325 -0.294 0.902 1.00 . A A . 52 HIS CE1 1 1 15 11554 1 1 50 HIS CG C 12.955 1.783 0.273 1.00 . A A . 52 HIS CG 1 1 15 11555 1 1 50 HIS H H 9.328 3.743 -0.487 1.00 . A A . 52 HIS H 1 1 15 11556 1 1 50 HIS HA H 11.886 3.516 -1.890 1.00 . A A . 52 HIS HA 1 1 15 11557 1 1 50 HIS HB2 H 12.968 3.900 0.126 1.00 . A A . 52 HIS HB2 1 1 15 11558 1 1 50 HIS HB3 H 11.644 3.245 1.083 1.00 . A A . 52 HIS HB3 1 1 15 11559 1 1 50 HIS HD1 H 11.660 0.744 1.586 1.00 . A A . 52 HIS HD1 1 1 15 11560 1 1 50 HIS HD2 H 14.742 1.893 -0.972 1.00 . A A . 52 HIS HD2 1 1 15 11561 1 1 50 HIS HE1 H 13.203 -1.248 1.393 1.00 . A A . 52 HIS HE1 1 1 15 11562 1 1 50 HIS N N 10.200 4.092 -0.763 1.00 . A A . 52 HIS N 1 1 15 11563 1 1 50 HIS ND1 N 12.473 0.735 1.040 1.00 . A A . 52 HIS ND1 1 1 15 11564 1 1 50 HIS NE2 N 14.342 0.009 0.089 1.00 . A A . 52 HIS NE2 1 1 15 11565 1 1 50 HIS O O 10.538 0.958 -0.474 1.00 . A A . 52 HIS O 1 1 15 11566 1 1 51 PHE C C 10.747 -0.955 -2.191 1.00 . A A . 53 PHE C 1 1 15 11567 1 1 51 PHE CA C 10.022 0.132 -2.992 1.00 . A A . 53 PHE CA 1 1 15 11568 1 1 51 PHE CB C 10.256 -0.099 -4.486 1.00 . A A . 53 PHE CB 1 1 15 11569 1 1 51 PHE CD1 C 8.213 0.772 -5.679 1.00 . A A . 53 PHE CD1 1 1 15 11570 1 1 51 PHE CD2 C 8.430 -1.617 -5.327 1.00 . A A . 53 PHE CD2 1 1 15 11571 1 1 51 PHE CE1 C 6.987 0.565 -6.324 1.00 . A A . 53 PHE CE1 1 1 15 11572 1 1 51 PHE CE2 C 7.205 -1.825 -5.972 1.00 . A A . 53 PHE CE2 1 1 15 11573 1 1 51 PHE CG C 8.934 -0.320 -5.181 1.00 . A A . 53 PHE CG 1 1 15 11574 1 1 51 PHE CZ C 6.483 -0.733 -6.469 1.00 . A A . 53 PHE CZ 1 1 15 11575 1 1 51 PHE H H 10.749 2.136 -3.303 1.00 . A A . 53 PHE H 1 1 15 11576 1 1 51 PHE HA H 8.964 0.088 -2.780 1.00 . A A . 53 PHE HA 1 1 15 11577 1 1 51 PHE HB2 H 10.743 0.768 -4.910 1.00 . A A . 53 PHE HB2 1 1 15 11578 1 1 51 PHE HB3 H 10.883 -0.966 -4.624 1.00 . A A . 53 PHE HB3 1 1 15 11579 1 1 51 PHE HD1 H 8.602 1.773 -5.567 1.00 . A A . 53 PHE HD1 1 1 15 11580 1 1 51 PHE HD2 H 8.986 -2.459 -4.943 1.00 . A A . 53 PHE HD2 1 1 15 11581 1 1 51 PHE HE1 H 6.432 1.407 -6.709 1.00 . A A . 53 PHE HE1 1 1 15 11582 1 1 51 PHE HE2 H 6.815 -2.826 -6.084 1.00 . A A . 53 PHE HE2 1 1 15 11583 1 1 51 PHE HZ H 5.538 -0.893 -6.967 1.00 . A A . 53 PHE HZ 1 1 15 11584 1 1 51 PHE N N 10.553 1.472 -2.610 1.00 . A A . 53 PHE N 1 1 15 11585 1 1 51 PHE O O 11.821 -1.392 -2.554 1.00 . A A . 53 PHE O 1 1 15 11586 1 1 52 GLY C C 10.451 -2.263 1.182 1.00 . A A . 54 GLY C 1 1 15 11587 1 1 52 GLY CA C 10.825 -2.451 -0.288 1.00 . A A . 54 GLY CA 1 1 15 11588 1 1 52 GLY H H 9.302 -1.029 -0.832 1.00 . A A . 54 GLY H 1 1 15 11589 1 1 52 GLY HA2 H 10.494 -3.425 -0.624 1.00 . A A . 54 GLY HA2 1 1 15 11590 1 1 52 GLY HA3 H 11.896 -2.378 -0.397 1.00 . A A . 54 GLY HA3 1 1 15 11591 1 1 52 GLY N N 10.168 -1.394 -1.108 1.00 . A A . 54 GLY N 1 1 15 11592 1 1 52 GLY O O 9.585 -1.479 1.515 1.00 . A A . 54 GLY O 1 1 15 11593 1 1 53 LYS C C 11.290 -1.488 4.021 1.00 . A A . 55 LYS C 1 1 15 11594 1 1 53 LYS CA C 10.771 -2.832 3.511 1.00 . A A . 55 LYS CA 1 1 15 11595 1 1 53 LYS CB C 11.431 -3.966 4.296 1.00 . A A . 55 LYS CB 1 1 15 11596 1 1 53 LYS CD C 13.647 -4.962 4.877 1.00 . A A . 55 LYS CD 1 1 15 11597 1 1 53 LYS CE C 14.600 -4.077 5.683 1.00 . A A . 55 LYS CE 1 1 15 11598 1 1 53 LYS CG C 12.892 -4.104 3.861 1.00 . A A . 55 LYS CG 1 1 15 11599 1 1 53 LYS H H 11.790 -3.602 1.777 1.00 . A A . 55 LYS H 1 1 15 11600 1 1 53 LYS HA H 9.701 -2.878 3.645 1.00 . A A . 55 LYS HA 1 1 15 11601 1 1 53 LYS HB2 H 11.388 -3.744 5.352 1.00 . A A . 55 LYS HB2 1 1 15 11602 1 1 53 LYS HB3 H 10.910 -4.891 4.100 1.00 . A A . 55 LYS HB3 1 1 15 11603 1 1 53 LYS HD2 H 12.940 -5.433 5.545 1.00 . A A . 55 LYS HD2 1 1 15 11604 1 1 53 LYS HD3 H 14.213 -5.720 4.359 1.00 . A A . 55 LYS HD3 1 1 15 11605 1 1 53 LYS HE2 H 14.259 -3.054 5.646 1.00 . A A . 55 LYS HE2 1 1 15 11606 1 1 53 LYS HE3 H 14.622 -4.413 6.709 1.00 . A A . 55 LYS HE3 1 1 15 11607 1 1 53 LYS HG2 H 12.934 -4.575 2.889 1.00 . A A . 55 LYS HG2 1 1 15 11608 1 1 53 LYS HG3 H 13.346 -3.126 3.808 1.00 . A A . 55 LYS HG3 1 1 15 11609 1 1 53 LYS HZ1 H 16.264 -3.227 4.763 1.00 . A A . 55 LYS HZ1 1 1 15 11610 1 1 53 LYS HZ2 H 15.967 -4.835 4.308 1.00 . A A . 55 LYS HZ2 1 1 15 11611 1 1 53 LYS HZ3 H 16.636 -4.491 5.831 1.00 . A A . 55 LYS HZ3 1 1 15 11612 1 1 53 LYS N N 11.095 -2.974 2.064 1.00 . A A . 55 LYS N 1 1 15 11613 1 1 53 LYS NZ N 15.970 -4.163 5.102 1.00 . A A . 55 LYS NZ 1 1 15 11614 1 1 53 LYS O O 12.247 -0.944 3.507 1.00 . A A . 55 LYS O 1 1 15 11615 1 1 54 CYS C C 11.241 0.269 7.094 1.00 . A A . 56 CYS C 1 1 15 11616 1 1 54 CYS CA C 11.117 0.364 5.572 1.00 . A A . 56 CYS CA 1 1 15 11617 1 1 54 CYS CB C 10.095 1.443 5.209 1.00 . A A . 56 CYS CB 1 1 15 11618 1 1 54 CYS H H 9.892 -1.400 5.427 1.00 . A A . 56 CYS H 1 1 15 11619 1 1 54 CYS HA H 12.077 0.619 5.145 1.00 . A A . 56 CYS HA 1 1 15 11620 1 1 54 CYS HB2 H 9.351 1.023 4.549 1.00 . A A . 56 CYS HB2 1 1 15 11621 1 1 54 CYS HB3 H 9.618 1.801 6.108 1.00 . A A . 56 CYS HB3 1 1 15 11622 1 1 54 CYS N N 10.664 -0.946 5.029 1.00 . A A . 56 CYS N 1 1 15 11623 1 1 54 CYS O O 12.360 0.279 7.580 1.00 . A A . 56 CYS O 1 1 15 11624 1 1 54 CYS OXT O 10.214 0.189 7.748 1.00 . A A . 56 CYS OXT 1 1 15 11625 1 1 54 CYS SG S 10.931 2.816 4.378 1.00 . A A . 56 CYS SG 1 1 stop_ save_
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