NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
408341 | 1ywj | 6558 | cing | 4-filtered-FRED | STAR | entry | full | 622 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ywj # This FRED archive file contains, for PDB entry <1ywj>: # # - 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_1ywj _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1ywj _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 3434.68 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 $Formin_binding_protein_3 A . 1 1 stop_ save_ save_Formin_binding_protein_3 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Formin binding protein 3" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSRRASVGSAKSMWTEHKSPDGRTYYYNTETKQSTWEKPDD _Entity.Number_of_monomers 41 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 SER . 1 1 3 ARG . 1 1 4 ARG . 1 1 5 ALA . 1 1 6 SER . 1 1 7 VAL . 1 1 8 GLY . 1 1 9 SER . 1 1 10 ALA . 1 1 11 LYS . 1 1 12 SER . 1 1 13 MET . 1 1 14 TRP . 1 1 15 THR . 1 1 16 GLU . 1 1 17 HIS . 1 1 18 LYS . 1 1 19 SER . 1 1 20 PRO . 1 1 21 ASP . 1 1 22 GLY . 1 1 23 ARG . 1 1 24 THR . 1 1 25 TYR . 1 1 26 TYR . 1 1 27 TYR . 1 1 28 ASN . 1 1 29 THR . 1 1 30 GLU . 1 1 31 THR . 1 1 32 LYS . 1 1 33 GLN . 1 1 34 SER . 1 1 35 THR . 1 1 36 TRP . 1 1 37 GLU . 1 1 38 LYS . 1 1 39 PRO . 1 1 40 ASP . 1 1 41 ASP . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 SER 2 2 1 1 ARG 3 3 1 1 ARG 4 4 1 1 ALA 5 5 1 1 SER 6 6 1 1 VAL 7 7 1 1 GLY 8 8 1 1 SER 9 9 1 1 ALA 10 10 1 1 LYS 11 11 1 1 SER 12 12 1 1 MET 13 13 1 1 TRP 14 14 1 1 THR 15 15 1 1 GLU 16 16 1 1 HIS 17 17 1 1 LYS 18 18 1 1 SER 19 19 1 1 PRO 20 20 1 1 ASP 21 21 1 1 GLY 22 22 1 1 ARG 23 23 1 1 THR 24 24 1 1 TYR 25 25 1 1 TYR 26 26 1 1 TYR 27 27 1 1 ASN 28 28 1 1 THR 29 29 1 1 GLU 30 30 1 1 THR 31 31 1 1 LYS 32 32 1 1 GLN 33 33 1 1 SER 34 34 1 1 THR 35 35 1 1 TRP 36 36 1 1 GLU 37 37 1 1 LYS 38 38 1 1 PRO 39 39 1 1 ASP 40 40 1 1 ASP 41 41 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 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 31 THR HB . 34 . HB 1 1 1 1 2 1 1 31 THR MG . 34 . HG2% 1 1 2 1 1 1 1 38 LYS HB2 . 41 . HB2 1 1 2 1 2 1 1 38 LYS QG . 41 . HG1 1 1 3 1 1 1 1 25 TYR HA . 28 . HA 1 1 3 1 2 1 1 25 TYR HB3 . 28 . HB1 1 1 4 1 1 1 1 21 ASP HA . 24 . HA 1 1 4 1 2 1 1 21 ASP QB . 24 . HB2 1 1 5 1 1 1 1 16 GLU HA . 19 . HA 1 1 5 1 2 1 1 16 GLU HB3 . 19 . HB1 1 1 6 1 1 1 1 28 ASN HB3 . 31 . HB1 1 1 6 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 7 1 1 1 1 35 THR HA . 38 . HA 1 1 7 1 2 1 1 35 THR HB . 38 . HB 1 1 8 1 1 1 1 23 ARG QD . 26 . HD1 1 1 8 1 2 1 1 23 ARG QG . 26 . HG2 1 1 9 1 1 1 1 32 LYS QB . 35 . HB2 1 1 9 1 2 1 1 32 LYS HG3 . 35 . HG1 1 1 10 1 1 1 1 29 THR HA . 32 . HA 1 1 10 1 2 1 1 29 THR HB . 32 . HB 1 1 11 1 1 1 1 24 THR HB . 27 . HB 1 1 11 1 2 1 1 24 THR MG . 27 . HG2% 1 1 12 1 1 1 1 32 LYS HA . 35 . HA 1 1 12 1 2 1 1 32 LYS QB . 35 . HB2 1 1 13 1 1 1 1 39 PRO HA . 42 . HA 1 1 13 1 2 1 1 39 PRO HB3 . 42 . HB2 1 1 14 1 1 1 1 15 THR HB . 18 . HB 1 1 14 1 2 1 1 15 THR MG . 18 . HG2% 1 1 15 1 1 1 1 29 THR HB . 32 . HB 1 1 15 1 2 1 1 29 THR MG . 32 . HG2% 1 1 16 1 1 1 1 15 THR HA . 18 . HA 1 1 16 1 2 1 1 15 THR HB . 18 . HB 1 1 17 1 1 1 1 38 LYS HA . 41 . HA 1 1 17 1 2 1 1 39 PRO HD3 . 42 . HD1 1 1 18 1 1 1 1 18 LYS HA . 21 . HA 1 1 18 1 2 1 1 18 LYS HB3 . 21 . HB1 1 1 19 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 19 1 2 1 1 25 TYR QD . 28 . HD% 1 1 20 1 1 1 1 17 HIS HA . 20 . HA 1 1 20 1 2 1 1 17 HIS HB3 . 20 . HB1 1 1 21 1 1 1 1 33 GLN HB2 . 36 . HB2 1 1 21 1 2 1 1 33 GLN HG3 . 36 . HG1 1 1 22 1 1 1 1 27 TYR HA . 30 . HA 1 1 22 1 2 1 1 27 TYR HB3 . 30 . HB1 1 1 23 1 1 1 1 31 THR HA . 34 . HA 1 1 23 1 2 1 1 31 THR MG . 34 . HG2% 1 1 24 1 1 1 1 14 TRP HZ3 . 17 . HZ3 1 1 24 1 2 1 1 35 THR MG . 38 . HG2% 1 1 25 1 1 1 1 35 THR HB . 38 . HB 1 1 25 1 2 1 1 35 THR MG . 38 . HG2% 1 1 26 1 1 1 1 24 THR HA . 27 . HA 1 1 26 1 2 1 1 24 THR MG . 27 . HG2% 1 1 27 1 1 1 1 38 LYS HA . 41 . HA 1 1 27 1 2 1 1 39 PRO HD2 . 42 . HD2 1 1 28 1 1 1 1 14 TRP HA . 17 . HA 1 1 28 1 2 1 1 28 ASN HA . 31 . HA 1 1 29 1 1 1 1 18 LYS HA . 21 . HA 1 1 29 1 2 1 1 24 THR HA . 27 . HA 1 1 30 1 1 1 1 23 ARG HB3 . 26 . HB1 1 1 30 1 2 1 1 23 ARG QD . 26 . HD1 1 1 31 1 1 1 1 12 SER HA . 15 . HA 1 1 31 1 2 1 1 12 SER HB3 . 15 . HB1 1 1 32 1 1 1 1 14 TRP HA . 17 . HA 1 1 32 1 2 1 1 14 TRP HB2 . 17 . HB2 1 1 33 1 1 1 1 29 THR HA . 32 . HA 1 1 33 1 2 1 1 29 THR MG . 32 . HG2% 1 1 34 1 1 1 1 38 LYS HD3 . 41 . HD1 1 1 34 1 2 1 1 38 LYS QG . 41 . HG1 1 1 35 1 1 1 1 26 TYR QB . 29 . HB2 1 1 35 1 2 1 1 28 ASN HA . 31 . HA 1 1 36 1 1 1 1 27 TYR HA . 30 . HA 1 1 36 1 2 1 1 34 SER HA . 37 . HA 1 1 37 1 1 1 1 16 GLU HA . 19 . HA 1 1 37 1 2 1 1 26 TYR HA . 29 . HA 1 1 38 1 1 1 1 27 TYR HA . 30 . HA 1 1 38 1 2 1 1 27 TYR QD . 30 . HD% 1 1 39 1 1 1 1 23 ARG HA . 26 . HA 1 1 39 1 2 1 1 23 ARG HG3 . 26 . HG1 1 1 40 1 1 1 1 36 TRP HA . 39 . HA 1 1 40 1 2 1 1 36 TRP HE3 . 39 . HE3 1 1 41 1 1 1 1 36 TRP HA . 39 . HA 1 1 41 1 2 1 1 36 TRP HB3 . 39 . HB1 1 1 42 1 1 1 1 38 LYS HA . 41 . HA 1 1 42 1 2 1 1 38 LYS HB2 . 41 . HB2 1 1 43 1 1 1 1 32 LYS HA . 35 . HA 1 1 43 1 2 1 1 32 LYS HG3 . 35 . HG1 1 1 44 1 1 1 1 15 THR HA . 18 . HA 1 1 44 1 2 1 1 15 THR MG . 18 . HG2% 1 1 45 1 1 1 1 16 GLU QG . 19 . HG1 1 1 45 1 2 1 1 24 THR MG . 27 . HG2% 1 1 46 1 1 1 1 26 TYR HA . 29 . HA 1 1 46 1 2 1 1 26 TYR QB . 29 . HB1 1 1 47 1 1 1 1 26 TYR HA . 29 . HA 1 1 47 1 2 1 1 26 TYR QD . 29 . HD% 1 1 48 1 1 1 1 16 GLU HA . 19 . HA 1 1 48 1 2 1 1 17 HIS HB3 . 20 . HB1 1 1 49 1 1 1 1 23 ARG HB3 . 26 . HB1 1 1 49 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 50 1 1 1 1 13 MET HB3 . 16 . HB1 1 1 50 1 1 1 1 13 MET ME . 16 . HE% 1 1 50 1 2 1 1 13 MET HG2 . 16 . HG1 1 1 51 1 1 1 1 28 ASN HA . 31 . HA 1 1 51 1 2 1 1 28 ASN HB2 . 31 . HB2 1 1 52 1 1 1 1 27 TYR QD . 30 . HD% 1 1 52 1 2 1 1 34 SER HA . 37 . HA 1 1 53 1 1 1 1 13 MET HB2 . 16 . HB2 1 1 53 1 2 1 1 13 MET HG2 . 16 . HG1 1 1 54 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 54 1 2 1 1 36 TRP HA . 39 . HA 1 1 55 1 1 1 1 16 GLU HA . 19 . HA 1 1 55 1 2 1 1 16 GLU QG . 19 . HG1 1 1 56 1 1 1 1 16 GLU QG . 19 . HG1 1 1 56 1 2 1 1 26 TYR QE . 29 . HE% 1 1 57 1 1 1 1 33 GLN HA . 36 . HA 1 1 57 1 2 1 1 33 GLN HB3 . 36 . HB1 1 1 58 1 1 1 1 27 TYR QD . 30 . HD% 1 1 58 1 2 1 1 29 THR MG . 32 . HG2% 1 1 59 1 1 1 1 27 TYR QE . 30 . HE% 1 1 59 1 2 1 1 29 THR MG . 32 . HG2% 1 1 60 1 1 1 1 27 TYR QE . 30 . HE% 1 1 60 1 2 1 1 32 LYS HA . 35 . HA 1 1 61 1 1 1 1 35 THR HB . 38 . HB 1 1 61 1 2 1 1 37 GLU HG2 . 40 . HG1 1 1 62 1 1 1 1 39 PRO HD2 . 42 . HD2 1 1 62 1 2 1 1 39 PRO HG3 . 42 . HG1 1 1 63 1 1 1 1 14 TRP HA . 17 . HA 1 1 63 1 2 1 1 14 TRP HD1 . 17 . HD1 1 1 63 1 2 1 1 14 TRP HE3 . 17 . HE3 1 1 64 1 1 1 1 38 LYS HA . 41 . HA 1 1 64 1 2 1 1 38 LYS QG . 41 . HG2 1 1 65 1 1 1 1 24 THR HA . 27 . HA 1 1 65 1 2 1 1 24 THR HB . 27 . HB 1 1 66 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 66 1 2 1 1 36 TRP HE3 . 39 . HE3 1 1 67 1 1 1 1 17 HIS HB2 . 20 . HB2 1 1 67 1 2 1 1 17 HIS HD2 . 20 . HD2 1 1 68 1 1 1 1 32 LYS HD3 . 35 . HD1 1 1 68 1 2 1 1 32 LYS HE3 . 35 . HE1 1 1 69 1 1 1 1 18 LYS HA . 21 . HA 1 1 69 1 2 1 1 18 LYS QG . 21 . HG1 1 1 70 1 1 1 1 33 GLN HG3 . 36 . HG1 1 1 70 1 2 1 1 35 THR HB . 38 . HB 1 1 71 1 1 1 1 35 THR HA . 38 . HA 1 1 71 1 2 1 1 35 THR MG . 38 . HG2% 1 1 72 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 72 1 2 1 1 26 TYR QB . 29 . HB2 1 1 73 1 1 1 1 13 MET HA . 16 . HA 1 1 73 1 2 1 1 29 THR HB . 32 . HB 1 1 74 1 1 1 1 28 ASN HA . 31 . HA 1 1 74 1 2 1 1 28 ASN HB3 . 31 . HB1 1 1 75 1 1 1 1 38 LYS HA . 41 . HA 1 1 75 1 2 1 1 38 LYS HB3 . 41 . HB1 1 1 76 1 1 1 1 22 GLY HA2 . 25 . HA2 1 1 76 1 2 1 1 23 ARG HG2 . 26 . HG2 1 1 77 1 1 1 1 18 LYS HA . 21 . HA 1 1 77 1 2 1 1 18 LYS QD . 21 . HD1 1 1 78 1 1 1 1 39 PRO HB3 . 42 . HB2 1 1 78 1 2 1 1 39 PRO HG2 . 42 . HG2 1 1 79 1 1 1 1 18 LYS HA . 21 . HA 1 1 79 1 2 1 1 24 THR MG . 27 . HG2% 1 1 80 1 1 1 1 39 PRO HB3 . 42 . HB2 1 1 80 1 2 1 1 39 PRO HD2 . 42 . HD2 1 1 81 1 1 1 1 13 MET HA . 16 . HA 1 1 81 1 2 1 1 13 MET HG3 . 16 . HG2 1 1 82 1 1 1 1 36 TRP HB3 . 39 . HB1 1 1 82 1 2 1 1 36 TRP HE3 . 39 . HE3 1 1 83 1 1 1 1 32 LYS HA . 35 . HA 1 1 83 1 2 1 1 32 LYS HD3 . 35 . HD1 1 1 84 1 1 1 1 17 HIS HB3 . 20 . HB1 1 1 84 1 2 1 1 25 TYR QE . 28 . HE% 1 1 85 1 1 1 1 26 TYR QD . 29 . HD% 1 1 85 1 2 1 1 36 TRP HA . 39 . HA 1 1 86 1 1 1 1 39 PRO HD3 . 42 . HD1 1 1 86 1 2 1 1 39 PRO HG3 . 42 . HG1 1 1 87 1 1 1 1 14 TRP HH2 . 17 . HH2 1 1 87 1 1 1 1 14 TRP HZ3 . 17 . HZ3 1 1 87 1 2 1 1 28 ASN HB2 . 31 . HB2 1 1 88 1 1 1 1 18 LYS QG . 21 . HG1 1 1 88 1 2 1 1 24 THR HA . 27 . HA 1 1 89 1 1 1 1 26 TYR QD . 29 . HD% 1 1 89 1 2 1 1 39 PRO HD3 . 42 . HD1 1 1 90 1 1 1 1 26 TYR QD . 29 . HD% 1 1 90 1 2 1 1 39 PRO HD2 . 42 . HD2 1 1 91 1 1 1 1 27 TYR HA . 30 . HA 1 1 91 1 2 1 1 32 LYS HA . 35 . HA 1 1 92 1 1 1 1 27 TYR QE . 30 . HE% 1 1 92 1 2 1 1 32 LYS QB . 35 . HB2 1 1 93 1 1 1 1 18 LYS QE . 21 . HE1 1 1 93 1 2 1 1 18 LYS QG . 21 . HG1 1 1 94 1 1 1 1 23 ARG HB3 . 26 . HB1 1 1 94 1 2 1 1 36 TRP HE3 . 39 . HE3 1 1 95 1 1 1 1 14 TRP HD1 . 17 . HD1 1 1 95 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 95 1 2 1 1 28 ASN HA . 31 . HA 1 1 96 1 1 1 1 22 GLY HA3 . 25 . HA1 1 1 96 1 2 1 1 23 ARG HG2 . 26 . HG2 1 1 97 1 1 1 1 14 TRP HB2 . 17 . HB2 1 1 97 1 2 1 1 26 TYR QD . 29 . HD% 1 1 98 1 1 1 1 30 GLU HG2 . 33 . HG2 1 1 98 1 2 1 1 31 THR MG . 34 . HG2% 1 1 99 1 1 1 1 30 GLU HA . 33 . HA 1 1 99 1 2 1 1 30 GLU HG3 . 33 . HG1 1 1 100 1 1 1 1 18 LYS HA . 21 . HA 1 1 100 1 2 1 1 25 TYR QD . 28 . HD% 1 1 101 1 1 1 1 26 TYR QE . 29 . HE% 1 1 101 1 2 1 1 39 PRO HB2 . 42 . HB1 1 1 102 1 1 1 1 19 SER HB3 . 22 . HB1 1 1 102 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 103 1 1 1 1 14 TRP HH2 . 17 . HH2 1 1 103 1 1 1 1 14 TRP HZ3 . 17 . HZ3 1 1 103 1 2 1 1 28 ASN HB3 . 31 . HB1 1 1 104 1 1 1 1 25 TYR HA . 28 . HA 1 1 104 1 2 1 1 36 TRP HE3 . 39 . HE3 1 1 105 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 105 1 2 1 1 27 TYR HA . 30 . HA 1 1 106 1 1 1 1 27 TYR QE . 30 . HE% 1 1 106 1 2 1 1 32 LYS HG3 . 35 . HG1 1 1 107 1 1 1 1 28 ASN HB2 . 31 . HB2 1 1 107 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 108 1 1 1 1 16 GLU QG . 19 . HG1 1 1 108 1 2 1 1 24 THR HA . 27 . HA 1 1 109 1 1 1 1 30 GLU HG3 . 33 . HG1 1 1 109 1 2 1 1 31 THR MG . 34 . HG2% 1 1 110 1 1 1 1 23 ARG QD . 26 . HD1 1 1 110 1 2 1 1 36 TRP HE3 . 39 . HE3 1 1 111 1 1 1 1 14 TRP HA . 17 . HA 1 1 111 1 2 1 1 15 THR MG . 18 . HG2% 1 1 112 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 112 1 2 1 1 36 TRP HD1 . 39 . HD1 1 1 112 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 113 1 1 1 1 19 SER HB3 . 22 . HB1 1 1 113 1 2 1 1 20 PRO HB2 . 23 . HB2 1 1 114 1 1 1 1 13 MET HB3 . 16 . HB1 1 1 114 1 2 1 1 14 TRP HD1 . 17 . HD1 1 1 115 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 115 1 2 1 1 39 PRO HG3 . 42 . HG1 1 1 116 1 1 1 1 39 PRO HA . 42 . HA 1 1 116 1 2 1 1 39 PRO HD3 . 42 . HD1 1 1 117 1 1 1 1 37 GLU HG2 . 40 . HG1 1 1 117 1 2 1 1 38 LYS QG . 41 . HG2 1 1 118 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 118 1 2 1 1 28 ASN HB3 . 31 . HB1 1 1 119 1 1 1 1 14 TRP HB3 . 17 . HB1 1 1 119 1 2 1 1 26 TYR QD . 29 . HD% 1 1 120 1 1 1 1 16 GLU QG . 19 . HG1 1 1 120 1 2 1 1 26 TYR HA . 29 . HA 1 1 121 1 1 1 1 34 SER HA . 37 . HA 1 1 121 1 2 1 1 35 THR MG . 38 . HG2% 1 1 122 1 1 1 1 18 LYS QD . 21 . HD1 1 1 122 1 2 1 1 24 THR HA . 27 . HA 1 1 123 1 1 1 1 23 ARG QD . 26 . HD1 1 1 123 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 124 1 1 1 1 14 TRP HA . 17 . HA 1 1 124 1 2 1 1 29 THR MG . 32 . HG2% 1 1 125 1 1 1 1 26 TYR QD . 29 . HD% 1 1 125 1 2 1 1 39 PRO HG3 . 42 . HG1 1 1 126 1 1 1 1 13 MET HA . 16 . HA 1 1 126 1 2 1 1 13 MET ME . 16 . HE% 1 1 127 1 1 1 1 14 TRP HD1 . 17 . HD1 1 1 127 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 127 1 2 1 1 39 PRO HG2 . 42 . HG2 1 1 128 1 1 1 1 15 THR MG . 18 . HG2% 1 1 128 1 2 1 1 17 HIS HE1 . 20 . HE1 1 1 129 1 1 1 1 38 LYS HA . 41 . HA 1 1 129 1 2 1 1 39 PRO HG2 . 42 . HG2 1 1 130 1 1 1 1 16 GLU QG . 19 . HG1 1 1 130 1 2 1 1 24 THR HB . 27 . HB 1 1 131 1 1 1 1 26 TYR QB . 29 . HB2 1 1 131 1 2 1 1 39 PRO HG2 . 42 . HG2 1 1 132 1 1 1 1 28 ASN HA . 31 . HA 1 1 132 1 2 1 1 29 THR MG . 32 . HG2% 1 1 133 1 1 1 1 28 ASN HB3 . 31 . HB1 1 1 133 1 2 1 1 31 THR MG . 34 . HG2% 1 1 134 1 1 1 1 15 THR HB . 18 . HB 1 1 134 1 2 1 1 17 HIS HE1 . 20 . HE1 1 1 135 1 1 1 1 15 THR HB . 18 . HB 1 1 135 1 2 1 1 27 TYR HB3 . 30 . HB1 1 1 136 1 1 1 1 36 TRP HB3 . 39 . HB1 1 1 136 1 2 1 1 37 GLU HA . 40 . HA 1 1 137 1 1 1 1 31 THR HB . 34 . HB 1 1 137 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 138 1 1 1 1 38 LYS HA . 41 . HA 1 1 138 1 2 1 1 39 PRO HG3 . 42 . HG1 1 1 139 1 1 1 1 27 TYR QD . 30 . HD% 1 1 139 1 2 1 1 32 LYS HA . 35 . HA 1 1 140 1 1 1 1 14 TRP HH2 . 17 . HH2 1 1 140 1 2 1 1 33 GLN HB3 . 36 . HB1 1 1 141 1 1 1 1 15 THR MG . 18 . HG2% 1 1 141 1 2 1 1 17 HIS HD2 . 20 . HD2 1 1 142 1 1 1 1 14 TRP HH2 . 17 . HH2 1 1 142 1 2 1 1 28 ASN HB2 . 31 . HB2 1 1 143 1 1 1 1 14 TRP HD1 . 17 . HD1 1 1 143 1 2 1 1 39 PRO HB3 . 42 . HB2 1 1 144 1 1 1 1 23 ARG HG3 . 26 . HG1 1 1 144 1 2 1 1 36 TRP HD1 . 39 . HD1 1 1 145 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 1 145 1 2 1 1 39 PRO HA . 42 . HA 1 1 146 1 1 1 1 23 ARG HG3 . 26 . HG1 1 1 146 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 147 1 1 1 1 35 THR HA . 38 . HA 1 1 147 1 2 1 1 36 TRP HD1 . 39 . HD1 1 1 148 1 1 1 1 15 THR MG . 18 . HG2% 1 1 148 1 2 1 1 27 TYR HB3 . 30 . HB1 1 1 149 1 1 1 1 14 TRP HD1 . 17 . HD1 1 1 149 1 2 1 1 39 PRO HA . 42 . HA 1 1 150 1 1 1 1 16 GLU HA . 19 . HA 1 1 150 1 2 1 1 17 HIS HD2 . 20 . HD2 1 1 151 1 1 1 1 15 THR HB . 18 . HB 1 1 151 1 2 1 1 17 HIS HD2 . 20 . HD2 1 1 152 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 1 152 1 2 1 1 28 ASN HB2 . 31 . HB2 1 1 153 1 1 1 1 25 TYR HA . 28 . HA 1 1 153 1 2 1 1 26 TYR QE . 29 . HE% 1 1 154 1 1 1 1 14 TRP HH2 . 17 . HH2 1 1 154 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 155 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 155 1 2 1 1 28 ASN HB2 . 31 . HB2 1 1 156 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 156 1 2 1 1 35 THR MG . 38 . HG2% 1 1 157 1 1 1 1 21 ASP QB . 24 . HB2 1 1 157 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 158 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 1 158 1 2 1 1 35 THR MG . 38 . HG2% 1 1 159 1 1 1 1 16 GLU HB3 . 19 . HB1 1 1 159 1 2 1 1 26 TYR QD . 29 . HD% 1 1 160 1 1 1 1 26 TYR QE . 29 . HE% 1 1 160 1 2 1 1 37 GLU HA . 40 . HA 1 1 161 1 1 1 1 27 TYR HB3 . 30 . HB1 1 1 161 1 2 1 1 27 TYR QE . 30 . HE% 1 1 162 1 1 1 1 25 TYR QE . 28 . HE% 1 1 162 1 2 1 1 27 TYR HB3 . 30 . HB1 1 1 163 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 163 1 2 1 1 28 ASN HA . 31 . HA 1 1 164 1 1 1 1 18 LYS HB3 . 21 . HB1 1 1 164 1 2 1 1 24 THR HA . 27 . HA 1 1 165 1 1 1 1 19 SER HB3 . 22 . HB1 1 1 165 1 2 1 1 36 TRP HH2 . 39 . HH2 1 1 166 1 1 1 1 27 TYR QE . 30 . HE% 1 1 166 1 2 1 1 29 THR HB . 32 . HB 1 1 167 1 1 1 1 27 TYR QD . 30 . HD% 1 1 167 1 2 1 1 29 THR HA . 32 . HA 1 1 168 1 1 1 1 26 TYR QE . 29 . HE% 1 1 168 1 2 1 1 38 LYS HA . 41 . HA 1 1 169 1 1 1 1 25 TYR HA . 28 . HA 1 1 169 1 2 1 1 26 TYR QD . 29 . HD% 1 1 170 1 1 1 1 14 TRP HH2 . 17 . HH2 1 1 170 1 2 1 1 35 THR MG . 38 . HG2% 1 1 171 1 1 1 1 17 HIS HD2 . 20 . HD2 1 1 171 1 2 1 1 27 TYR HB3 . 30 . HB1 1 1 172 1 1 1 1 14 TRP HA . 17 . HA 1 1 172 1 2 1 1 14 TRP HE3 . 17 . HE3 1 1 173 1 1 1 1 14 TRP HB2 . 17 . HB2 1 1 173 1 2 1 1 14 TRP HE3 . 17 . HE3 1 1 174 1 1 1 1 26 TYR QB . 29 . HB2 1 1 174 1 2 1 1 26 TYR QD . 29 . HD% 1 1 175 1 1 1 1 30 GLU H . 33 . HN 1 1 175 1 2 1 1 30 GLU QB . 33 . HB1 1 1 176 1 1 1 1 28 ASN HA . 31 . HA 1 1 176 1 2 1 1 29 THR H . 32 . HN 1 1 177 1 1 1 1 24 THR HA . 27 . HA 1 1 177 1 2 1 1 25 TYR H . 28 . HN 1 1 178 1 1 1 1 37 GLU HA . 40 . HA 1 1 178 1 2 1 1 38 LYS H . 41 . HN 1 1 179 1 1 1 1 32 LYS H . 35 . HN 1 1 179 1 2 1 1 32 LYS HA . 35 . HA 1 1 180 1 1 1 1 23 ARG HA . 26 . HA 1 1 180 1 2 1 1 24 THR H . 27 . HN 1 1 181 1 1 1 1 28 ASN HD21 . 31 . HD21 1 1 181 1 2 1 1 30 GLU H . 33 . HN 1 1 182 1 1 1 1 17 HIS HA . 20 . HA 1 1 182 1 2 1 1 18 LYS H . 21 . HN 1 1 183 1 1 1 1 15 THR HA . 18 . HA 1 1 183 1 2 1 1 16 GLU H . 19 . HN 1 1 184 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 184 1 2 1 1 26 TYR H . 29 . HN 1 1 185 1 1 1 1 27 TYR HA . 30 . HA 1 1 185 1 2 1 1 28 ASN H . 31 . HN 1 1 186 1 1 1 1 23 ARG H . 26 . HN 1 1 186 1 2 1 1 23 ARG HB3 . 26 . HB1 1 1 187 1 1 1 1 30 GLU QB . 33 . HB1 1 1 187 1 2 1 1 31 THR H . 34 . HN 1 1 188 1 1 1 1 14 TRP HA . 17 . HA 1 1 188 1 2 1 1 15 THR H . 18 . HN 1 1 189 1 1 1 1 22 GLY H . 25 . HN 1 1 189 1 2 1 1 22 GLY HA2 . 25 . HA2 1 1 190 1 1 1 1 26 TYR H . 29 . HN 1 1 190 1 2 1 1 27 TYR HB3 . 30 . HB1 1 1 191 1 1 1 1 37 GLU H . 40 . HN 1 1 191 1 2 1 1 37 GLU HA . 40 . HA 1 1 192 1 1 1 1 24 THR H . 27 . HN 1 1 192 1 2 1 1 24 THR HB . 27 . HB 1 1 193 1 1 1 1 18 LYS H . 21 . HN 1 1 193 1 2 1 1 18 LYS HB3 . 21 . HB1 1 1 194 1 1 1 1 28 ASN HB3 . 31 . HB1 1 1 194 1 2 1 1 33 GLN H . 36 . HN 1 1 195 1 1 1 1 30 GLU H . 33 . HN 1 1 195 1 2 1 1 31 THR H . 34 . HN 1 1 196 1 1 1 1 34 SER HA . 37 . HA 1 1 196 1 2 1 1 35 THR H . 38 . HN 1 1 197 1 1 1 1 25 TYR HA . 28 . HA 1 1 197 1 2 1 1 26 TYR H . 29 . HN 1 1 198 1 1 1 1 26 TYR H . 29 . HN 1 1 198 1 2 1 1 26 TYR QD . 29 . HD% 1 1 199 1 1 1 1 35 THR HA . 38 . HA 1 1 199 1 2 1 1 36 TRP H . 39 . HN 1 1 200 1 1 1 1 29 THR H . 32 . HN 1 1 200 1 2 1 1 29 THR MG . 32 . HG2% 1 1 201 1 1 1 1 21 ASP H . 24 . HN 1 1 201 1 2 1 1 22 GLY H . 25 . HN 1 1 202 1 1 1 1 31 THR H . 34 . HN 1 1 202 1 2 1 1 31 THR MG . 34 . HG2% 1 1 203 1 1 1 1 36 TRP H . 39 . HN 1 1 203 1 2 1 1 37 GLU H . 40 . HN 1 1 204 1 1 1 1 28 ASN H . 31 . HN 1 1 204 1 2 1 1 28 ASN HB3 . 31 . HB1 1 1 205 1 1 1 1 23 ARG H . 26 . HN 1 1 205 1 2 1 1 23 ARG HA . 26 . HA 1 1 206 1 1 1 1 23 ARG H . 26 . HN 1 1 206 1 2 1 1 23 ARG QG . 26 . HG2 1 1 207 1 1 1 1 33 GLN HB3 . 36 . HB1 1 1 207 1 2 1 1 34 SER H . 37 . HN 1 1 208 1 1 1 1 24 THR MG . 27 . HG2% 1 1 208 1 2 1 1 25 TYR H . 28 . HN 1 1 209 1 1 1 1 22 GLY H . 25 . HN 1 1 209 1 2 1 1 23 ARG H . 26 . HN 1 1 210 1 1 1 1 36 TRP H . 39 . HN 1 1 210 1 2 1 1 36 TRP HB2 . 39 . HB2 1 1 211 1 1 1 1 16 GLU H . 19 . HN 1 1 211 1 2 1 1 16 GLU HA . 19 . HA 1 1 212 1 1 1 1 27 TYR H . 30 . HN 1 1 212 1 2 1 1 27 TYR HA . 30 . HA 1 1 213 1 1 1 1 33 GLN HG3 . 36 . HG1 1 1 213 1 2 1 1 34 SER H . 37 . HN 1 1 214 1 1 1 1 35 THR H . 38 . HN 1 1 214 1 2 1 1 35 THR MG . 38 . HG2% 1 1 215 1 1 1 1 23 ARG HB3 . 26 . HB1 1 1 215 1 2 1 1 24 THR H . 27 . HN 1 1 216 1 1 1 1 21 ASP H . 24 . HN 1 1 216 1 2 1 1 21 ASP QB . 24 . HB1 1 1 217 1 1 1 1 18 LYS H . 21 . HN 1 1 217 1 2 1 1 18 LYS QG . 21 . HG1 1 1 218 1 1 1 1 32 LYS H . 35 . HN 1 1 218 1 2 1 1 32 LYS HG3 . 35 . HG1 1 1 219 1 1 1 1 15 THR HB . 18 . HB 1 1 219 1 2 1 1 16 GLU H . 19 . HN 1 1 220 1 1 1 1 21 ASP H . 24 . HN 1 1 220 1 2 1 1 23 ARG QD . 26 . HD1 1 1 221 1 1 1 1 33 GLN H . 36 . HN 1 1 221 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 222 1 1 1 1 17 HIS H . 20 . HN 1 1 222 1 2 1 1 18 LYS QG . 21 . HG1 1 1 223 1 1 1 1 18 LYS HB3 . 21 . HB1 1 1 223 1 2 1 1 19 SER H . 22 . HN 1 1 224 1 1 1 1 35 THR MG . 38 . HG2% 1 1 224 1 2 1 1 37 GLU H . 40 . HN 1 1 225 1 1 1 1 21 ASP HA . 24 . HA 1 1 225 1 2 1 1 22 GLY H . 25 . HN 1 1 226 1 1 1 1 38 LYS H . 41 . HN 1 1 226 1 2 1 1 38 LYS HA . 41 . HA 1 1 227 1 1 1 1 19 SER H . 22 . HN 1 1 227 1 2 1 1 25 TYR H . 28 . HN 1 1 228 1 1 1 1 33 GLN HE21 . 36 . HE21 1 1 228 1 2 1 1 33 GLN HG3 . 36 . HG1 1 1 229 1 1 1 1 37 GLU HB3 . 40 . HB1 1 1 229 1 2 1 1 38 LYS H . 41 . HN 1 1 230 1 1 1 1 29 THR H . 32 . HN 1 1 230 1 2 1 1 29 THR HA . 32 . HA 1 1 231 1 1 1 1 24 THR H . 27 . HN 1 1 231 1 2 1 1 24 THR HA . 27 . HA 1 1 232 1 1 1 1 19 SER H . 22 . HN 1 1 232 1 2 1 1 19 SER HB2 . 22 . HB2 1 1 233 1 1 1 1 18 LYS H . 21 . HN 1 1 233 1 2 1 1 18 LYS HA . 21 . HA 1 1 234 1 1 1 1 37 GLU H . 40 . HN 1 1 234 1 2 1 1 39 PRO HD2 . 42 . HD2 1 1 235 1 1 1 1 25 TYR HA . 28 . HA 1 1 235 1 2 1 1 37 GLU H . 40 . HN 1 1 236 1 1 1 1 36 TRP H . 39 . HN 1 1 236 1 2 1 1 36 TRP HB3 . 39 . HB1 1 1 237 1 1 1 1 36 TRP HA . 39 . HA 1 1 237 1 2 1 1 37 GLU H . 40 . HN 1 1 238 1 1 1 1 36 TRP H . 39 . HN 1 1 238 1 2 1 1 36 TRP HA . 39 . HA 1 1 239 1 1 1 1 13 MET HB3 . 16 . HB1 1 1 239 1 1 1 1 13 MET ME . 16 . HE% 1 1 239 1 2 1 1 28 ASN HD21 . 31 . HD21 1 1 240 1 1 1 1 14 TRP HZ3 . 17 . HZ3 1 1 240 1 2 1 1 35 THR H . 38 . HN 1 1 241 1 1 1 1 15 THR MG . 18 . HG2% 1 1 241 1 2 1 1 16 GLU H . 19 . HN 1 1 242 1 1 1 1 34 SER H . 37 . HN 1 1 242 1 2 1 1 34 SER HA . 37 . HA 1 1 243 1 1 1 1 32 LYS HA . 35 . HA 1 1 243 1 2 1 1 33 GLN H . 36 . HN 1 1 244 1 1 1 1 17 HIS H . 20 . HN 1 1 244 1 2 1 1 24 THR MG . 27 . HG2% 1 1 245 1 1 1 1 25 TYR H . 28 . HN 1 1 245 1 2 1 1 25 TYR HB3 . 28 . HB1 1 1 246 1 1 1 1 15 THR H . 18 . HN 1 1 246 1 2 1 1 28 ASN HA . 31 . HA 1 1 247 1 1 1 1 15 THR H . 18 . HN 1 1 247 1 2 1 1 15 THR MG . 18 . HG2% 1 1 248 1 1 1 1 15 THR H . 18 . HN 1 1 248 1 2 1 1 15 THR HB . 18 . HB 1 1 249 1 1 1 1 22 GLY H . 25 . HN 1 1 249 1 2 1 1 23 ARG HG3 . 26 . HG1 1 1 250 1 1 1 1 17 HIS H . 20 . HN 1 1 250 1 2 1 1 25 TYR QD . 28 . HD% 1 1 251 1 1 1 1 17 HIS H . 20 . HN 1 1 251 1 2 1 1 24 THR HA . 27 . HA 1 1 252 1 1 1 1 29 THR H . 32 . HN 1 1 252 1 2 1 1 31 THR H . 34 . HN 1 1 253 1 1 1 1 26 TYR QB . 29 . HB2 1 1 253 1 2 1 1 35 THR H . 38 . HN 1 1 254 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 254 1 2 1 1 35 THR H . 38 . HN 1 1 255 1 1 1 1 35 THR HB . 38 . HB 1 1 255 1 2 1 1 36 TRP H . 39 . HN 1 1 256 1 1 1 1 17 HIS H . 20 . HN 1 1 256 1 2 1 1 26 TYR HA . 29 . HA 1 1 257 1 1 1 1 27 TYR HB3 . 30 . HB1 1 1 257 1 2 1 1 28 ASN H . 31 . HN 1 1 258 1 1 1 1 32 LYS H . 35 . HN 1 1 258 1 2 1 1 34 SER H . 37 . HN 1 1 259 1 1 1 1 36 TRP H . 39 . HN 1 1 259 1 2 1 1 36 TRP HD1 . 39 . HD1 1 1 260 1 1 1 1 33 GLN HE22 . 36 . HE22 1 1 260 1 2 1 1 33 GLN HG3 . 36 . HG1 1 1 261 1 1 1 1 24 THR H . 27 . HN 1 1 261 1 2 1 1 24 THR MG . 27 . HG2% 1 1 262 1 1 1 1 19 SER H . 22 . HN 1 1 262 1 2 1 1 23 ARG H . 26 . HN 1 1 263 1 1 1 1 18 LYS HA . 21 . HA 1 1 263 1 2 1 1 25 TYR H . 28 . HN 1 1 264 1 1 1 1 38 LYS H . 41 . HN 1 1 264 1 2 1 1 39 PRO HD2 . 42 . HD2 1 1 265 1 1 1 1 23 ARG H . 26 . HN 1 1 265 1 2 1 1 23 ARG QD . 26 . HD1 1 1 266 1 1 1 1 26 TYR H . 29 . HN 1 1 266 1 2 1 1 35 THR MG . 38 . HG2% 1 1 267 1 1 1 1 14 TRP HE1 . 17 . HE1 1 1 267 1 2 1 1 39 PRO QB . 42 . HB2 1 1 268 1 1 1 1 22 GLY H . 25 . HN 1 1 268 1 2 1 1 23 ARG HB3 . 26 . HB1 1 1 269 1 1 1 1 28 ASN HD21 . 31 . HD21 1 1 269 1 2 1 1 31 THR MG . 34 . HG2% 1 1 270 1 1 1 1 32 LYS H . 35 . HN 1 1 270 1 2 1 1 32 LYS HD3 . 35 . HD1 1 1 271 1 1 1 1 30 GLU H . 33 . HN 1 1 271 1 2 1 1 31 THR MG . 34 . HG2% 1 1 272 1 1 1 1 14 TRP HA . 17 . HA 1 1 272 1 2 1 1 29 THR H . 32 . HN 1 1 273 1 1 1 1 33 GLN H . 36 . HN 1 1 273 1 2 1 1 34 SER H . 37 . HN 1 1 274 1 1 1 1 28 ASN H . 31 . HN 1 1 274 1 2 1 1 34 SER HA . 37 . HA 1 1 275 1 1 1 1 29 THR MG . 32 . HG2% 1 1 275 1 2 1 1 30 GLU H . 33 . HN 1 1 276 1 1 1 1 35 THR MG . 38 . HG2% 1 1 276 1 2 1 1 36 TRP H . 39 . HN 1 1 277 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 277 1 2 1 1 36 TRP H . 39 . HN 1 1 278 1 1 1 1 26 TYR H . 29 . HN 1 1 278 1 2 1 1 35 THR H . 38 . HN 1 1 279 1 1 1 1 21 ASP QB . 24 . HB1 1 1 279 1 2 1 1 22 GLY H . 25 . HN 1 1 280 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 280 1 2 1 1 27 TYR H . 30 . HN 1 1 281 1 1 1 1 20 PRO HG2 . 23 . HG1 1 1 281 1 2 1 1 36 TRP HE1 . 39 . HE1 1 1 282 1 1 1 1 16 GLU QG . 19 . HG1 1 1 282 1 2 1 1 25 TYR H . 28 . HN 1 1 283 1 1 1 1 14 TRP HD1 . 17 . HD1 1 1 283 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 283 1 2 1 1 15 THR H . 18 . HN 1 1 284 1 1 1 1 31 THR H . 34 . HN 1 1 284 1 2 1 1 33 GLN H . 36 . HN 1 1 285 1 1 1 1 24 THR HB . 27 . HB 1 1 285 1 2 1 1 25 TYR H . 28 . HN 1 1 286 1 1 1 1 16 GLU HA . 19 . HA 1 1 286 1 2 1 1 27 TYR H . 30 . HN 1 1 287 1 1 1 1 35 THR HA . 38 . HA 1 1 287 1 2 1 1 36 TRP HE1 . 39 . HE1 1 1 288 1 1 1 1 33 GLN HE21 . 36 . HE21 1 1 288 1 2 1 1 35 THR HB . 38 . HB 1 1 289 1 1 1 1 33 GLN HE22 . 36 . HE22 1 1 289 1 2 1 1 35 THR HA . 38 . HA 1 1 290 1 1 1 1 34 SER H . 37 . HN 1 1 290 1 2 1 1 35 THR H . 38 . HN 1 1 291 1 1 1 1 18 LYS H . 21 . HN 1 1 291 1 2 1 1 19 SER H . 22 . HN 1 1 292 1 1 1 1 27 TYR QE . 30 . HE% 1 1 292 1 2 1 1 32 LYS H . 35 . HN 1 1 293 1 1 1 1 27 TYR H . 30 . HN 1 1 293 1 2 1 1 28 ASN H . 31 . HN 1 1 294 1 1 1 1 31 THR MG . 34 . HG2% 1 1 294 1 2 1 1 33 GLN H . 36 . HN 1 1 295 1 1 1 1 27 TYR HA . 30 . HA 1 1 295 1 2 1 1 35 THR H . 38 . HN 1 1 296 1 1 1 1 19 SER H . 22 . HN 1 1 296 1 2 1 1 22 GLY H . 25 . HN 1 1 297 1 1 1 1 35 THR H . 38 . HN 1 1 297 1 2 1 1 37 GLU HB3 . 40 . HB1 1 1 298 1 1 1 1 14 TRP HE1 . 17 . HE1 1 1 298 1 2 1 1 28 ASN HD21 . 31 . HD21 1 1 299 1 1 1 1 20 PRO HB3 . 23 . HB1 1 1 299 1 2 1 1 21 ASP H . 24 . HN 1 1 300 1 1 1 1 23 ARG QD . 26 . HD1 1 1 300 1 2 1 1 24 THR H . 27 . HN 1 1 301 1 1 1 1 28 ASN H . 31 . HN 1 1 301 1 2 1 1 28 ASN HD21 . 31 . HD21 1 1 302 1 1 1 1 15 THR MG . 18 . HG2% 1 1 302 1 2 1 1 27 TYR H . 30 . HN 1 1 303 1 1 1 1 17 HIS H . 20 . HN 1 1 303 1 2 1 1 26 TYR H . 29 . HN 1 1 304 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 304 1 2 1 1 36 TRP HE1 . 39 . HE1 1 1 305 1 1 1 1 23 ARG QD . 26 . HD1 1 1 305 1 2 1 1 36 TRP HE1 . 39 . HE1 1 1 306 1 1 1 1 12 SER H . 15 . HN 1 1 306 1 2 1 1 13 MET HG3 . 16 . HG2 1 1 307 1 1 1 1 26 TYR H . 29 . HN 1 1 307 1 2 1 1 36 TRP HB3 . 39 . HB1 1 1 308 1 1 1 1 23 ARG H . 26 . HN 1 1 308 1 2 1 1 24 THR H . 27 . HN 1 1 309 1 1 1 1 15 THR H . 18 . HN 1 1 309 1 2 1 1 29 THR H . 32 . HN 1 1 310 1 1 1 1 34 SER H . 37 . HN 1 1 310 1 2 1 1 35 THR MG . 38 . HG2% 1 1 311 1 1 1 1 33 GLN HE21 . 36 . HE21 1 1 311 1 2 1 1 35 THR HA . 38 . HA 1 1 312 1 1 1 1 35 THR H . 38 . HN 1 1 312 1 2 1 1 36 TRP H . 39 . HN 1 1 313 1 1 1 1 28 ASN HD21 . 31 . HD21 1 1 313 1 2 1 1 29 THR MG . 32 . HG2% 1 1 314 1 1 1 1 16 GLU QG . 19 . HG1 1 1 314 1 2 1 1 18 LYS H . 21 . HN 1 1 315 1 1 1 1 31 THR H . 34 . HN 1 1 315 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 316 1 1 1 1 13 MET HG3 . 16 . HG2 1 1 316 1 2 1 1 14 TRP HE1 . 17 . HE1 1 1 317 1 1 1 1 24 THR H . 27 . HN 1 1 317 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 318 1 1 1 1 34 SER H . 37 . HN 1 1 318 1 2 1 1 35 THR HA . 38 . HA 1 1 319 1 1 1 1 14 TRP HA . 17 . HA 1 1 319 1 2 1 1 16 GLU H . 19 . HN 1 1 320 1 1 1 1 28 ASN H . 31 . HN 1 1 320 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 321 1 1 1 1 12 SER H . 15 . HN 1 1 321 1 2 1 1 15 THR HA . 18 . HA 1 1 322 1 1 1 1 14 TRP HE1 . 17 . HE1 1 1 322 1 2 1 1 39 PRO HA . 42 . HA 1 1 323 1 1 1 1 13 MET ME . 16 . HE% 1 1 323 1 2 1 1 14 TRP HE1 . 17 . HE1 1 1 324 1 1 1 1 25 TYR H . 28 . HN 1 1 324 1 2 1 1 25 TYR QE . 28 . HE% 1 1 325 1 1 1 1 14 TRP HA . 17 . HA 1 1 325 1 2 1 1 28 ASN H . 31 . HN 1 1 326 1 1 1 1 32 LYS QB . 35 . HB1 1 1 326 1 2 1 1 32 LYS HD3 . 35 . HD1 1 1 327 1 1 1 1 23 ARG HB3 . 26 . HB1 1 1 327 1 2 1 1 23 ARG QG . 26 . HG2 1 1 328 1 1 1 1 26 TYR QD . 29 . HD% 1 1 328 1 2 1 1 37 GLU HG2 . 40 . HG1 1 1 329 1 1 1 1 13 MET HA . 16 . HA 1 1 329 1 2 1 1 13 MET HG2 . 16 . HG1 1 1 330 1 1 1 1 14 TRP HB3 . 17 . HB1 1 1 330 1 2 1 1 14 TRP HD1 . 17 . HD1 1 1 330 1 2 1 1 14 TRP HE3 . 17 . HE3 1 1 331 1 1 1 1 33 GLN HA . 36 . HA 1 1 331 1 2 1 1 34 SER H . 37 . HN 1 1 332 1 1 1 1 32 LYS H . 35 . HN 1 1 332 1 2 1 1 33 GLN H . 36 . HN 1 1 333 1 1 1 1 20 PRO HA . 23 . HA 1 1 333 1 2 1 1 20 PRO HB2 . 23 . HB2 1 1 334 1 1 1 1 30 GLU HA . 33 . HA 1 1 334 1 2 1 1 30 GLU HG2 . 33 . HG2 1 1 335 1 1 1 1 20 PRO HA . 23 . HA 1 1 335 1 2 1 1 20 PRO HB3 . 23 . HB1 1 1 336 1 1 1 1 33 GLN HB2 . 36 . HB2 1 1 336 1 2 1 1 34 SER H . 37 . HN 1 1 337 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 337 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 338 1 1 1 1 28 ASN HB3 . 31 . HB1 1 1 338 1 2 1 1 32 LYS H . 35 . HN 1 1 339 1 1 1 1 18 LYS HB3 . 21 . HB1 1 1 339 1 2 1 1 18 LYS QE . 21 . HE1 1 1 340 1 1 1 1 38 LYS HD3 . 41 . HD1 1 1 340 1 2 1 1 38 LYS HE2 . 41 . HE1 1 1 341 1 1 1 1 15 THR HB . 18 . HB 1 1 341 1 2 1 1 29 THR MG . 32 . HG2% 1 1 342 1 1 1 1 32 LYS HE3 . 35 . HE1 1 1 342 1 2 1 1 32 LYS HG3 . 35 . HG1 1 1 343 1 1 1 1 18 LYS QD . 21 . HD1 1 1 343 1 2 1 1 18 LYS QE . 21 . HE1 1 1 344 1 1 1 1 26 TYR HA . 29 . HA 1 1 344 1 2 1 1 27 TYR H . 30 . HN 1 1 345 1 1 1 1 21 ASP QB . 24 . HB1 1 1 345 1 2 1 1 23 ARG HG2 . 26 . HG2 1 1 346 1 1 1 1 14 TRP HB2 . 17 . HB2 1 1 346 1 2 1 1 14 TRP HD1 . 17 . HD1 1 1 346 1 2 1 1 14 TRP HE3 . 17 . HE3 1 1 347 1 1 1 1 29 THR HA . 32 . HA 1 1 347 1 2 1 1 32 LYS H . 35 . HN 1 1 348 1 1 1 1 13 MET H . 16 . HN 1 1 348 1 2 1 1 14 TRP H . 17 . HN 1 1 349 1 1 1 1 13 MET H . 16 . HN 1 1 349 1 2 1 1 13 MET HG3 . 16 . HG2 1 1 350 1 1 1 1 31 THR H . 34 . HN 1 1 350 1 2 1 1 31 THR HA . 34 . HA 1 1 351 1 1 1 1 13 MET HB3 . 16 . HB1 1 1 351 1 1 1 1 13 MET ME . 16 . HE% 1 1 351 1 2 1 1 31 THR HA . 34 . HA 1 1 352 1 1 1 1 28 ASN H . 31 . HN 1 1 352 1 2 1 1 32 LYS HA . 35 . HA 1 1 353 1 1 1 1 13 MET HB2 . 16 . HB2 1 1 353 1 2 1 1 31 THR H . 34 . HN 1 1 354 1 1 1 1 20 PRO HB3 . 23 . HB1 1 1 354 1 2 1 1 20 PRO HD3 . 23 . HD2 1 1 355 1 1 1 1 28 ASN HB3 . 31 . HB1 1 1 355 1 2 1 1 32 LYS HA . 35 . HA 1 1 356 1 1 1 1 14 TRP HA . 17 . HA 1 1 356 1 2 1 1 14 TRP HB3 . 17 . HB1 1 1 357 1 1 1 1 18 LYS QG . 21 . HG1 1 1 357 1 2 1 1 19 SER H . 22 . HN 1 1 358 1 1 1 1 23 ARG QD . 26 . HD1 1 1 358 1 2 1 1 23 ARG HG3 . 26 . HG1 1 1 359 1 1 1 1 19 SER H . 22 . HN 1 1 359 1 2 1 1 24 THR HA . 27 . HA 1 1 360 1 1 1 1 27 TYR HB3 . 30 . HB1 1 1 360 1 2 1 1 34 SER HA . 37 . HA 1 1 361 1 1 1 1 14 TRP H . 17 . HN 1 1 361 1 2 1 1 14 TRP HB2 . 17 . HB2 1 1 362 1 1 1 1 37 GLU H . 40 . HN 1 1 362 1 2 1 1 39 PRO HA . 42 . HA 1 1 363 1 1 1 1 31 THR H . 34 . HN 1 1 363 1 2 1 1 32 LYS HA . 35 . HA 1 1 364 1 1 1 1 39 PRO QB . 42 . HB2 1 1 364 1 2 1 1 39 PRO HD3 . 42 . HD1 1 1 365 1 1 1 1 18 LYS HA . 21 . HA 1 1 365 1 2 1 1 19 SER H . 22 . HN 1 1 366 1 1 1 1 17 HIS HB3 . 20 . HB1 1 1 366 1 2 1 1 18 LYS HA . 21 . HA 1 1 367 1 1 1 1 31 THR MG . 34 . HG2% 1 1 367 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 368 1 1 1 1 27 TYR HB3 . 30 . HB1 1 1 368 1 2 1 1 27 TYR QD . 30 . HD% 1 1 369 1 1 1 1 36 TRP HB3 . 39 . HB1 1 1 369 1 2 1 1 37 GLU H . 40 . HN 1 1 370 1 1 1 1 24 THR MG . 27 . HG2% 1 1 370 1 2 1 1 25 TYR HA . 28 . HA 1 1 371 1 1 1 1 22 GLY HA2 . 25 . HA2 1 1 371 1 2 1 1 23 ARG H . 26 . HN 1 1 372 1 1 1 1 18 LYS QG . 21 . HG1 1 1 372 1 2 1 1 25 TYR H . 28 . HN 1 1 373 1 1 1 1 20 PRO HD3 . 23 . HD2 1 1 373 1 2 1 1 25 TYR QD . 28 . HD% 1 1 374 1 1 1 1 20 PRO HB2 . 23 . HB2 1 1 374 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 375 1 1 1 1 29 THR HB . 32 . HB 1 1 375 1 2 1 1 31 THR H . 34 . HN 1 1 376 1 1 1 1 28 ASN H . 31 . HN 1 1 376 1 2 1 1 33 GLN H . 36 . HN 1 1 377 1 1 1 1 29 THR HA . 32 . HA 1 1 377 1 2 1 1 30 GLU H . 33 . HN 1 1 378 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 378 1 2 1 1 26 TYR HA . 29 . HA 1 1 379 1 1 1 1 22 GLY HA3 . 25 . HA1 1 1 379 1 2 1 1 23 ARG H . 26 . HN 1 1 380 1 1 1 1 23 ARG H . 26 . HN 1 1 380 1 2 1 1 23 ARG HG3 . 26 . HG1 1 1 381 1 1 1 1 31 THR H . 34 . HN 1 1 381 1 2 1 1 32 LYS H . 35 . HN 1 1 382 1 1 1 1 16 GLU H . 19 . HN 1 1 382 1 2 1 1 16 GLU HB3 . 19 . HB1 1 1 383 1 1 1 1 32 LYS HA . 35 . HA 1 1 383 1 2 1 1 34 SER H . 37 . HN 1 1 384 1 1 1 1 27 TYR QE . 30 . HE% 1 1 384 1 2 1 1 29 THR HA . 32 . HA 1 1 385 1 1 1 1 37 GLU HG2 . 40 . HG1 1 1 385 1 2 1 1 38 LYS HA . 41 . HA 1 1 386 1 1 1 1 24 THR MG . 27 . HG2% 1 1 386 1 2 1 1 26 TYR QE . 29 . HE% 1 1 387 1 1 1 1 23 ARG H . 26 . HN 1 1 387 1 2 1 1 23 ARG HG2 . 26 . HG2 1 1 388 1 1 1 1 23 ARG HG2 . 26 . HG2 1 1 388 1 2 1 1 24 THR H . 27 . HN 1 1 389 1 1 1 1 23 ARG HG2 . 26 . HG2 1 1 389 1 2 1 1 24 THR HA . 27 . HA 1 1 390 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 1 390 1 2 1 1 39 PRO HB3 . 42 . HB2 1 1 391 1 1 1 1 26 TYR QB . 29 . HB2 1 1 391 1 2 1 1 35 THR MG . 38 . HG2% 1 1 392 1 1 1 1 32 LYS HA . 35 . HA 1 1 392 1 2 1 1 34 SER HA . 37 . HA 1 1 393 1 1 1 1 23 ARG HG2 . 26 . HG2 1 1 393 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 394 1 1 1 1 14 TRP HD1 . 17 . HD1 1 1 394 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 394 1 2 1 1 39 PRO HB3 . 42 . HB2 1 1 395 1 1 1 1 35 THR MG . 38 . HG2% 1 1 395 1 2 1 1 37 GLU HB2 . 40 . HB2 1 1 396 1 1 1 1 16 GLU QG . 19 . HG1 1 1 396 1 2 1 1 17 HIS H . 20 . HN 1 1 397 1 1 1 1 17 HIS H . 20 . HN 1 1 397 1 2 1 1 25 TYR H . 28 . HN 1 1 398 1 1 1 1 14 TRP HD1 . 17 . HD1 1 1 398 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 398 1 2 1 1 39 PRO HB2 . 42 . HB1 1 1 399 1 1 1 1 38 LYS HE2 . 41 . HE1 1 1 399 1 2 1 1 38 LYS QG . 41 . HG1 1 1 400 1 1 1 1 26 TYR H . 29 . HN 1 1 400 1 2 1 1 26 TYR QB . 29 . HB2 1 1 401 1 1 1 1 12 SER H . 15 . HN 1 1 401 1 2 1 1 13 MET H . 16 . HN 1 1 402 1 1 1 1 26 TYR QD . 29 . HD% 1 1 402 1 2 1 1 35 THR MG . 38 . HG2% 1 1 403 1 1 1 1 25 TYR H . 28 . HN 1 1 403 1 2 1 1 25 TYR QD . 28 . HD% 1 1 404 1 1 1 1 14 TRP HE1 . 17 . HE1 1 1 404 1 2 1 1 39 PRO HB3 . 42 . HB2 1 1 405 1 1 1 1 23 ARG HG3 . 26 . HG1 1 1 405 1 2 1 1 36 TRP HH2 . 39 . HH2 1 1 406 1 1 1 1 17 HIS H . 20 . HN 1 1 406 1 2 1 1 17 HIS HB2 . 20 . HB2 1 1 407 1 1 1 1 14 TRP H . 17 . HN 1 1 407 1 2 1 1 14 TRP HD1 . 17 . HD1 1 1 408 1 1 1 1 20 PRO HD2 . 23 . HD1 1 1 408 1 2 1 1 25 TYR QE . 28 . HE% 1 1 409 1 1 1 1 13 MET HB3 . 16 . HB1 1 1 409 1 1 1 1 13 MET ME . 16 . HE% 1 1 409 1 2 1 1 14 TRP HD1 . 17 . HD1 1 1 410 1 1 1 1 37 GLU H . 40 . HN 1 1 410 1 2 1 1 39 PRO QB . 42 . HB2 1 1 411 1 1 1 1 37 GLU H . 40 . HN 1 1 411 1 2 1 1 39 PRO HB3 . 42 . HB2 1 1 412 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 1 412 1 2 1 1 39 PRO HB2 . 42 . HB1 1 1 413 1 1 1 1 19 SER HB2 . 22 . HB2 1 1 413 1 2 1 1 25 TYR QD . 28 . HD% 1 1 414 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 414 1 2 1 1 34 SER HA . 37 . HA 1 1 415 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 415 1 2 1 1 26 TYR QD . 29 . HD% 1 1 416 1 1 1 1 28 ASN HB2 . 31 . HB2 1 1 416 1 2 1 1 32 LYS H . 35 . HN 1 1 417 1 1 1 1 22 GLY H . 25 . HN 1 1 417 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 418 1 1 1 1 31 THR HA . 34 . HA 1 1 418 1 2 1 1 32 LYS H . 35 . HN 1 1 419 1 1 1 1 16 GLU H . 19 . HN 1 1 419 1 2 1 1 26 TYR QB . 29 . HB2 1 1 420 1 1 1 1 16 GLU HA . 19 . HA 1 1 420 1 2 1 1 24 THR MG . 27 . HG2% 1 1 421 1 1 1 1 28 ASN HB2 . 31 . HB2 1 1 421 1 2 1 1 28 ASN HD21 . 31 . HD21 1 1 422 1 1 1 1 19 SER HB2 . 22 . HB2 1 1 422 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 423 1 1 1 1 31 THR HB . 34 . HB 1 1 423 1 2 1 1 32 LYS H . 35 . HN 1 1 424 1 1 1 1 25 TYR QD . 28 . HD% 1 1 424 1 2 1 1 35 THR H . 38 . HN 1 1 425 1 1 1 1 38 LYS H . 41 . HN 1 1 425 1 2 1 1 38 LYS QG . 41 . HG1 1 1 426 1 1 1 1 25 TYR QD . 28 . HD% 1 1 426 1 2 1 1 34 SER HA . 37 . HA 1 1 427 1 1 1 1 22 GLY H . 25 . HN 1 1 427 1 2 1 1 23 ARG QD . 26 . HD1 1 1 428 1 1 1 1 38 LYS QG . 41 . HG2 1 1 428 1 2 1 1 39 PRO HD3 . 42 . HD1 1 1 429 1 1 1 1 26 TYR H . 29 . HN 1 1 429 1 2 1 1 36 TRP HA . 39 . HA 1 1 430 1 1 1 1 35 THR H . 38 . HN 1 1 430 1 2 1 1 35 THR HB . 38 . HB 1 1 431 1 1 1 1 19 SER H . 22 . HN 1 1 431 1 2 1 1 24 THR MG . 27 . HG2% 1 1 432 1 1 1 1 25 TYR QD . 28 . HD% 1 1 432 1 2 1 1 36 TRP HE3 . 39 . HE3 1 1 433 1 1 1 1 12 SER HB3 . 15 . HB1 1 1 433 1 2 1 1 14 TRP HD1 . 17 . HD1 1 1 434 1 1 1 1 31 THR MG . 34 . HG2% 1 1 434 1 2 1 1 33 GLN HE21 . 36 . HE21 1 1 435 1 1 1 1 14 TRP H . 17 . HN 1 1 435 1 2 1 1 15 THR H . 18 . HN 1 1 436 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 1 436 1 2 1 1 28 ASN HD21 . 31 . HD21 1 1 437 1 1 1 1 37 GLU H . 40 . HN 1 1 437 1 2 1 1 38 LYS QG . 41 . HG1 1 1 438 1 1 1 1 14 TRP HH2 . 17 . HH2 1 1 438 1 2 1 1 39 PRO HB3 . 42 . HB2 1 1 439 1 1 1 1 13 MET HB3 . 16 . HB1 1 1 439 1 1 1 1 13 MET ME . 16 . HE% 1 1 439 1 2 1 1 29 THR HA . 32 . HA 1 1 440 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 440 1 2 1 1 36 TRP HH2 . 39 . HH2 1 1 441 1 1 1 1 14 TRP HE1 . 17 . HE1 1 1 441 1 2 1 1 39 PRO HG3 . 42 . HG1 1 1 442 1 1 1 1 27 TYR QE . 30 . HE% 1 1 442 1 2 1 1 32 LYS HD3 . 35 . HD1 1 1 443 1 1 1 1 28 ASN HD21 . 31 . HD21 1 1 443 1 2 1 1 31 THR H . 34 . HN 1 1 444 1 1 1 1 30 GLU HG3 . 33 . HG1 1 1 444 1 2 1 1 31 THR H . 34 . HN 1 1 445 1 1 1 1 31 THR MG . 34 . HG2% 1 1 445 1 2 1 1 32 LYS H . 35 . HN 1 1 446 1 1 1 1 14 TRP HH2 . 17 . HH2 1 1 446 1 2 1 1 31 THR MG . 34 . HG2% 1 1 447 1 1 1 1 27 TYR HA . 30 . HA 1 1 447 1 2 1 1 28 ASN HB3 . 31 . HB1 1 1 448 1 1 1 1 14 TRP HD1 . 17 . HD1 1 1 448 1 1 1 1 14 TRP HE3 . 17 . HE3 1 1 448 1 2 1 1 28 ASN HB2 . 31 . HB2 1 1 449 1 1 1 1 31 THR HA . 34 . HA 1 1 449 1 2 1 1 32 LYS HG3 . 35 . HG1 1 1 450 1 1 1 1 33 GLN H . 36 . HN 1 1 450 1 2 1 1 34 SER HA . 37 . HA 1 1 451 1 1 1 1 13 MET HG2 . 16 . HG1 1 1 451 1 2 1 1 31 THR H . 34 . HN 1 1 452 1 1 1 1 20 PRO HD3 . 23 . HD2 1 1 452 1 2 1 1 36 TRP HH2 . 39 . HH2 1 1 453 1 1 1 1 14 TRP HA . 17 . HA 1 1 453 1 2 1 1 39 PRO HB2 . 42 . HB1 1 1 454 1 1 1 1 25 TYR QE . 28 . HE% 1 1 454 1 2 1 1 27 TYR HA . 30 . HA 1 1 455 1 1 1 1 13 MET H . 16 . HN 1 1 455 1 2 1 1 13 MET HG2 . 16 . HG1 1 1 456 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 1 456 1 2 1 1 33 GLN HB3 . 36 . HB1 1 1 457 1 1 1 1 26 TYR QD . 29 . HD% 1 1 457 1 2 1 1 37 GLU H . 40 . HN 1 1 458 1 1 1 1 25 TYR QE . 28 . HE% 1 1 458 1 2 1 1 34 SER HA . 37 . HA 1 1 459 1 1 1 1 33 GLN H . 36 . HN 1 1 459 1 2 1 1 33 GLN HE21 . 36 . HE21 1 1 460 1 1 1 1 27 TYR QD . 30 . HD% 1 1 460 1 2 1 1 34 SER H . 37 . HN 1 1 461 1 1 1 1 12 SER HB2 . 15 . HB2 1 1 461 1 2 1 1 13 MET HB3 . 16 . HB1 1 1 461 1 2 1 1 13 MET ME . 16 . HE% 1 1 462 1 1 1 1 18 LYS H . 21 . HN 1 1 462 1 2 1 1 24 THR HA . 27 . HA 1 1 463 1 1 1 1 25 TYR H . 28 . HN 1 1 463 1 2 1 1 36 TRP HA . 39 . HA 1 1 464 1 1 1 1 26 TYR QD . 29 . HD% 1 1 464 1 2 1 1 39 PRO HG2 . 42 . HG2 1 1 465 1 1 1 1 23 ARG H . 26 . HN 1 1 465 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 466 1 1 1 1 12 SER HB2 . 15 . HB2 1 1 466 1 2 1 1 13 MET H . 16 . HN 1 1 467 1 1 1 1 16 GLU H . 19 . HN 1 1 467 1 2 1 1 26 TYR HA . 29 . HA 1 1 468 1 1 1 1 17 HIS H . 20 . HN 1 1 468 1 2 1 1 25 TYR QE . 28 . HE% 1 1 469 1 1 1 1 14 TRP HB3 . 17 . HB1 1 1 469 1 2 1 1 34 SER HA . 37 . HA 1 1 470 1 1 1 1 18 LYS QG . 21 . HG1 1 1 470 1 2 1 1 24 THR MG . 27 . HG2% 1 1 471 1 1 1 1 13 MET HG2 . 16 . HG1 1 1 471 1 2 1 1 28 ASN HD21 . 31 . HD21 1 1 472 1 1 1 1 12 SER HB3 . 15 . HB1 1 1 472 1 2 1 1 13 MET H . 16 . HN 1 1 473 1 1 1 1 18 LYS QE . 21 . HE1 1 1 473 1 2 1 1 24 THR MG . 27 . HG2% 1 1 474 1 1 1 1 32 LYS H . 35 . HN 1 1 474 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 475 1 1 1 1 18 LYS HA . 21 . HA 1 1 475 1 2 1 1 23 ARG H . 26 . HN 1 1 476 1 1 1 1 21 ASP QB . 24 . HB2 1 1 476 1 2 1 1 36 TRP HE1 . 39 . HE1 1 1 477 1 1 1 1 37 GLU H . 40 . HN 1 1 477 1 2 1 1 39 PRO HG3 . 42 . HG1 1 1 478 1 1 1 1 19 SER HB2 . 22 . HB2 1 1 478 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 479 1 1 1 1 26 TYR QE . 29 . HE% 1 1 479 1 2 1 1 37 GLU H . 40 . HN 1 1 480 1 1 1 1 27 TYR H . 30 . HN 1 1 480 1 2 1 1 34 SER HA . 37 . HA 1 1 481 1 1 1 1 25 TYR H . 28 . HN 1 1 481 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 482 1 1 1 1 20 PRO HD3 . 23 . HD2 1 1 482 1 2 1 1 36 TRP HZ2 . 39 . HZ2 1 1 483 1 1 1 1 18 LYS QG . 21 . HG1 1 1 483 1 2 1 1 24 THR H . 27 . HN 1 1 484 1 1 1 1 26 TYR H . 29 . HN 1 1 484 1 2 1 1 34 SER HA . 37 . HA 1 1 485 1 1 1 1 24 THR MG . 27 . HG2% 1 1 485 1 2 1 1 26 TYR H . 29 . HN 1 1 486 1 1 1 1 18 LYS HA . 21 . HA 1 1 486 1 2 1 1 24 THR H . 27 . HN 1 1 487 1 1 1 1 18 LYS QG . 21 . HG1 1 1 487 1 2 1 1 23 ARG H . 26 . HN 1 1 488 1 1 1 1 29 THR HA . 32 . HA 1 1 488 1 2 1 1 32 LYS HG3 . 35 . HG1 1 1 489 1 1 1 1 25 TYR HB3 . 28 . HB1 1 1 489 1 2 1 1 34 SER HA . 37 . HA 1 1 490 1 1 1 1 24 THR MG . 27 . HG2% 1 1 490 1 2 1 1 25 TYR HB3 . 28 . HB1 1 1 491 1 1 1 1 26 TYR QE . 29 . HE% 1 1 491 1 2 1 1 39 PRO HG3 . 42 . HG1 1 1 492 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 1 492 1 2 1 1 33 GLN HB2 . 36 . HB2 1 1 493 1 1 1 1 37 GLU H . 40 . HN 1 1 493 1 2 1 1 39 PRO HG2 . 42 . HG2 1 1 494 1 1 1 1 32 LYS H . 35 . HN 1 1 494 1 2 1 1 32 LYS HE3 . 35 . HE1 1 1 495 1 1 1 1 24 THR MG . 27 . HG2% 1 1 495 1 2 1 1 26 TYR HA . 29 . HA 1 1 496 1 1 1 1 33 GLN HB3 . 36 . HB1 1 1 496 1 2 1 1 33 GLN HE21 . 36 . HE21 1 1 497 1 1 1 1 12 SER HB2 . 15 . HB2 1 1 497 1 2 1 1 14 TRP H . 17 . HN 1 1 498 1 1 1 1 13 MET HB3 . 16 . HB1 1 1 498 1 1 1 1 13 MET ME . 16 . HE% 1 1 498 1 2 1 1 14 TRP HE1 . 17 . HE1 1 1 499 1 1 1 1 23 ARG HA . 26 . HA 1 1 499 1 2 1 1 23 ARG HB3 . 26 . HB1 1 1 500 1 1 1 1 25 TYR HA . 28 . HA 1 1 500 1 2 1 1 25 TYR QD . 28 . HD% 1 1 501 1 1 1 1 16 GLU HA . 19 . HA 1 1 501 1 2 1 1 17 HIS H . 20 . HN 1 1 502 1 1 1 1 38 LYS H . 41 . HN 1 1 502 1 2 1 1 38 LYS HB3 . 41 . HB1 1 1 503 1 1 1 1 27 TYR H . 30 . HN 1 1 503 1 2 1 1 27 TYR HB3 . 30 . HB1 1 1 504 1 1 1 1 22 GLY H . 25 . HN 1 1 504 1 2 1 1 22 GLY HA3 . 25 . HA1 1 1 505 1 1 1 1 33 GLN H . 36 . HN 1 1 505 1 2 1 1 33 GLN HA . 36 . HA 1 1 506 1 1 1 1 28 ASN H . 31 . HN 1 1 506 1 2 1 1 28 ASN HA . 31 . HA 1 1 507 1 1 1 1 19 SER H . 22 . HN 1 1 507 1 2 1 1 19 SER HB3 . 22 . HB1 1 1 508 1 1 1 1 12 SER H . 15 . HN 1 1 508 1 2 1 1 12 SER HB2 . 15 . HB2 1 1 509 1 1 1 1 18 LYS H . 21 . HN 1 1 509 1 2 1 1 18 LYS QD . 21 . HD1 1 1 510 1 1 1 1 38 LYS H . 41 . HN 1 1 510 1 2 1 1 38 LYS HB2 . 41 . HB2 1 1 511 1 1 1 1 37 GLU H . 40 . HN 1 1 511 1 2 1 1 37 GLU HB3 . 40 . HB1 1 1 512 1 1 1 1 37 GLU HA . 40 . HA 1 1 512 1 2 1 1 37 GLU HB2 . 40 . HB2 1 1 513 1 1 1 1 23 ARG HA . 26 . HA 1 1 513 1 2 1 1 23 ARG QG . 26 . HG2 1 1 514 1 1 1 1 38 LYS HB2 . 41 . HB2 1 1 514 1 2 1 1 38 LYS HE2 . 41 . HE1 1 1 515 1 1 1 1 13 MET H . 16 . HN 1 1 515 1 2 1 1 13 MET HB2 . 16 . HB2 1 1 516 1 1 1 1 37 GLU H . 40 . HN 1 1 516 1 2 1 1 37 GLU HB2 . 40 . HB2 1 1 517 1 1 1 1 32 LYS H . 35 . HN 1 1 517 1 2 1 1 32 LYS QB . 35 . HB1 1 1 518 1 1 1 1 20 PRO HB3 . 23 . HB1 1 1 518 1 2 1 1 20 PRO HD2 . 23 . HD1 1 1 519 1 1 1 1 13 MET H . 16 . HN 1 1 519 1 2 1 1 13 MET HB3 . 16 . HB1 1 1 520 1 1 1 1 20 PRO HD2 . 23 . HD1 1 1 520 1 2 1 1 20 PRO HG2 . 23 . HG1 1 1 521 1 1 1 1 30 GLU HA . 33 . HA 1 1 521 1 2 1 1 31 THR H . 34 . HN 1 1 522 1 1 1 1 38 LYS HB3 . 41 . HB1 1 1 522 1 2 1 1 38 LYS QG . 41 . HG1 1 1 523 1 1 1 1 39 PRO QB . 42 . HB2 1 1 523 1 2 1 1 39 PRO HD2 . 42 . HD2 1 1 524 1 1 1 1 39 PRO HB2 . 42 . HB1 1 1 524 1 2 1 1 39 PRO HD2 . 42 . HD2 1 1 525 1 1 1 1 36 TRP HB3 . 39 . HB1 1 1 525 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 526 1 1 1 1 14 TRP H . 17 . HN 1 1 526 1 2 1 1 14 TRP HB3 . 17 . HB1 1 1 527 1 1 1 1 33 GLN HB3 . 36 . HB1 1 1 527 1 2 1 1 33 GLN HE22 . 36 . HE22 1 1 528 1 1 1 1 28 ASN HB3 . 31 . HB1 1 1 528 1 2 1 1 28 ASN HD21 . 31 . HD21 1 1 529 1 1 1 1 26 TYR HA . 29 . HA 1 1 529 1 2 1 1 26 TYR QE . 29 . HE% 1 1 530 1 1 1 1 36 TRP HA . 39 . HA 1 1 530 1 2 1 1 36 TRP HZ3 . 39 . HZ3 1 1 531 1 1 1 1 14 TRP HB3 . 17 . HB1 1 1 531 1 2 1 1 14 TRP HZ3 . 17 . HZ3 1 1 532 1 1 1 1 14 TRP HB2 . 17 . HB2 1 1 532 1 2 1 1 14 TRP HZ3 . 17 . HZ3 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 . . . . . 2.0 1.5 2.5 1 1 2 1 . . . . . 2.0 1.8 2.5 1 1 3 1 . . . . . 2.1 1.6 2.6 1 1 4 1 . . . . . 2.4 1.7 3.1 1 1 5 1 . . . . . 2.5 1.7 3.1 1 1 6 1 . . . . . 2.4 1.7 3.1 1 1 7 1 . . . . . 2.3 1.7 2.8 1 1 8 1 . . . . . 2.2 1.6 2.8 1 1 9 1 . . . . . 2.2 1.9 2.8 1 1 10 1 . . . . . 2.4 1.7 3.1 1 1 11 1 . . . . . 2.3 1.7 2.9 1 1 12 1 . . . . . 2.6 1.8 3.4 1 1 13 1 . . . . . 2.5 1.7 3.3 1 1 14 1 . . . . . 2.4 1.7 3.1 1 1 15 1 . . . . . 2.4 1.8 3.1 1 1 16 1 . . . . . 2.4 1.7 3.1 1 1 17 1 . . . . . 2.0 1.5 2.5 1 1 18 1 . . . . . 2.2 1.6 2.8 1 1 19 1 . . . . . 2.3 1.6 3.0 1 1 20 1 . . . . . 2.3 1.6 2.7 1 1 21 1 . . . . . 2.2 1.6 2.8 1 1 22 1 . . . . . 2.5 1.7 3.3 1 1 23 1 . . . . . 2.5 1.7 3.3 1 1 24 1 . . . . . 2.8 1.8 3.8 1 1 25 1 . . . . . 2.4 1.7 3.1 1 1 26 1 . . . . . 2.8 1.8 3.8 1 1 27 1 . . . . . 2.4 1.7 3.1 1 1 28 1 . . . . . 2.0 1.5 2.5 1 1 29 1 . . . . . 2.1 1.6 2.6 1 1 30 1 . . . . . 2.8 1.8 3.8 1 1 31 1 . . . . . 2.8 1.8 3.8 1 1 32 1 . . . . . 2.7 1.8 3.6 1 1 33 1 . . . . . 2.7 1.8 3.6 1 1 34 1 . . . . . 2.6 1.8 3.4 1 1 35 1 . . . . . 3.4 0.0 6.0 1 1 36 1 . . . . . 1.8 1.4 2.2 1 1 37 1 . . . . . 2.3 1.6 3.0 1 1 38 1 . . . . . 2.3 1.6 3.0 1 1 39 1 . . . . . 3.1 1.9 4.3 1 1 40 1 . . . . . 3.0 1.9 4.1 1 1 41 1 . . . . . 2.3 1.6 3.0 1 1 42 1 . . . . . 2.7 1.8 3.3 1 1 43 1 . . . . . 2.8 1.8 3.8 1 1 44 1 . . . . . 2.7 1.8 3.6 1 1 45 1 . . . . . 2.5 1.7 3.3 1 1 46 1 . . . . . 2.3 1.9 3.0 1 1 47 1 . . . . . 2.6 2.0 3.5 1 1 48 1 . . . . . 3.5 0.0 6.0 1 1 49 1 . . . . . 3.5 2.0 5.0 1 1 50 1 . . . . . 3.1 1.9 4.3 1 1 51 1 . . . . . 2.4 1.7 3.1 1 1 52 1 . . . . . 3.1 1.9 4.3 1 1 53 1 . . . . . 2.5 1.7 3.3 1 1 54 1 . . . . . 3.3 1.9 4.7 1 1 55 1 . . . . . 2.8 1.8 3.8 1 1 56 1 . . . . . 2.8 0.0 6.0 1 1 57 1 . . . . . 2.9 2.0 4.0 1 1 58 1 . . . . . 2.8 1.8 3.8 1 1 59 1 . . . . . 3.0 1.9 4.1 1 1 60 1 . . . . . 2.8 1.8 3.8 1 1 61 1 . . . . . 4.6 1.9 6.0 1 1 62 1 . . . . . 3.0 1.9 4.1 1 1 63 1 . . . . . 3.1 1.9 4.3 1 1 64 1 . . . . . 3.2 2.0 4.5 1 1 65 1 . . . . . 2.7 1.8 3.6 1 1 66 1 . . . . . 3.0 1.9 4.1 1 1 67 1 . . . . . 2.9 1.8 3.8 1 1 68 1 . . . . . 2.9 1.8 3.1 1 1 69 1 . . . . . 2.6 2.0 3.5 1 1 70 1 . . . . . 3.3 0.0 6.0 1 1 71 1 . . . . . 3.4 2.0 4.8 1 1 72 1 . . . . . . 1.9 2.8 1 1 73 1 . . . . . 3.9 2.0 5.8 1 1 74 1 . . . . . 2.9 1.9 3.1 1 1 75 1 . . . . . 2.8 1.8 3.8 1 1 76 1 . . . . . 3.7 2.0 5.4 1 1 77 1 . . . . . 4.0 2.0 6.0 1 1 78 1 . . . . . 2.9 1.9 3.9 1 1 79 1 . . . . . 4.3 2.0 6.0 1 1 80 1 . . . . . 3.9 2.0 5.6 1 1 81 1 . . . . . 3.2 1.9 4.5 1 1 82 1 . . . . . 2.9 1.8 4.0 1 1 83 1 . . . . . 3.5 2.0 5.1 1 1 84 1 . . . . . 4.6 2.0 6.0 1 1 85 1 . . . . . 3.0 1.8 4.2 1 1 86 1 . . . . . 2.8 1.8 3.8 1 1 87 1 . . . . . 3.3 2.0 4.6 1 1 88 1 . . . . . 4.1 2.0 6.0 1 1 89 1 . . . . . 3.4 1.9 4.9 1 1 90 1 . . . . . 2.8 0.0 6.0 1 1 91 1 . . . . . 4.0 2.0 6.0 1 1 92 1 . . . . . 4.6 2.0 6.0 1 1 93 1 . . . . . . 2.0 3.4 1 1 94 1 . . . . . 4.5 2.0 6.0 1 1 95 1 . . . . . 3.8 2.0 5.6 1 1 96 1 . . . . . 4.0 2.0 6.0 1 1 97 1 . . . . . 3.9 2.0 5.8 1 1 98 1 . . . . . 4.6 2.0 6.0 1 1 99 1 . . . . . 3.8 2.0 5.6 1 1 100 1 . . . . . 4.9 1.8 6.0 1 1 101 1 . . . . . 4.4 1.9 6.0 1 1 102 1 . . . . . 4.6 2.0 6.0 1 1 103 1 . . . . . 4.4 2.0 6.0 1 1 104 1 . . . . . 3.3 1.9 4.7 1 1 105 1 . . . . . 3.8 2.0 5.6 1 1 106 1 . . . . . 4.7 2.0 6.0 1 1 107 1 . . . . . 4.7 1.9 6.0 1 1 108 1 . . . . . 4.3 1.9 6.0 1 1 109 1 . . . . . 4.6 1.9 6.0 1 1 110 1 . . . . . 4.2 2.0 6.0 1 1 111 1 . . . . . 4.5 2.0 6.0 1 1 112 1 . . . . . 4.1 2.0 6.0 1 1 113 1 . . . . . 5.1 1.8 6.0 1 1 114 1 . . . . . 4.9 1.8 6.0 1 1 115 1 . . . . . 4.2 2.0 6.0 1 1 116 1 . . . . . 4.3 2.0 6.0 1 1 117 1 . . . . . 4.0 2.0 6.0 1 1 118 1 . . . . . 4.8 1.9 6.0 1 1 119 1 . . . . . 4.4 2.0 6.0 1 1 120 1 . . . . . 4.5 2.0 6.0 1 1 121 1 . . . . . 4.7 1.9 6.0 1 1 122 1 . . . . . 6.0 1.3 6.0 1 1 123 1 . . . . . 4.3 2.0 6.0 1 1 124 1 . . . . . 4.9 1.9 6.0 1 1 125 1 . . . . . 3.6 2.0 5.2 1 1 126 1 . . . . . 5.6 1.7 6.0 1 1 127 1 . . . . . 3.5 2.0 5.0 1 1 128 1 . . . . . 5.1 1.9 6.0 1 1 129 1 . . . . . 6.0 1.4 6.0 1 1 130 1 . . . . . 5.4 1.7 6.0 1 1 131 1 . . . . . 6.0 1.4 6.0 1 1 132 1 . . . . . 5.7 1.7 6.0 1 1 133 1 . . . . . 5.3 1.8 6.0 1 1 134 1 . . . . . 5.7 1.7 6.0 1 1 135 1 . . . . . 4.7 2.0 6.0 1 1 136 1 . . . . . 5.7 1.7 6.0 1 1 137 1 . . . . . 5.4 1.8 6.0 1 1 138 1 . . . . . 6.0 0.5 6.0 1 1 139 1 . . . . . 5.9 1.6 6.0 1 1 140 1 . . . . . 5.8 1.6 6.0 1 1 141 1 . . . . . 6.0 0.0 6.0 1 1 142 1 . . . . . 6.0 1.5 6.0 1 1 143 1 . . . . . 5.0 1.8 6.0 1 1 144 1 . . . . . 5.0 1.8 6.0 1 1 145 1 . . . . . 5.1 1.8 6.0 1 1 146 1 . . . . . 4.9 1.9 6.0 1 1 147 1 . . . . . 6.0 1.5 6.0 1 1 148 1 . . . . . 4.8 1.9 6.0 1 1 149 1 . . . . . 5.2 1.8 6.0 1 1 150 1 . . . . . 4.6 2.0 6.0 1 1 151 1 . . . . . 4.6 1.9 6.0 1 1 152 1 . . . . . 4.3 2.0 6.0 1 1 153 1 . . . . . 4.4 1.9 6.0 1 1 154 1 . . . . . 5.2 1.9 6.0 1 1 155 1 . . . . . 3.6 2.0 5.2 1 1 156 1 . . . . . 5.0 1.9 6.0 1 1 157 1 . . . . . 3.7 2.0 4.3 1 1 158 1 . . . . . 5.3 1.8 6.0 1 1 159 1 . . . . . 4.3 1.9 6.0 1 1 160 1 . . . . . 3.7 2.0 5.4 1 1 161 1 . . . . . 4.7 2.0 6.0 1 1 162 1 . . . . . 4.0 2.0 6.0 1 1 163 1 . . . . . 3.8 2.0 5.6 1 1 164 1 . . . . . 4.8 2.0 6.0 1 1 165 1 . . . . . 3.7 2.0 5.4 1 1 166 1 . . . . . 3.9 2.0 5.8 1 1 167 1 . . . . . 3.3 0.0 6.0 1 1 168 1 . . . . . 3.6 2.0 5.2 1 1 169 1 . . . . . 3.2 0.0 6.0 1 1 170 1 . . . . . 4.2 2.0 6.0 1 1 171 1 . . . . . 2.9 1.9 3.9 1 1 172 1 . . . . . 3.1 1.9 4.3 1 1 173 1 . . . . . 3.5 2.0 5.0 1 1 174 1 . . . . . 2.3 1.9 3.0 1 1 175 1 . . . . . 2.0 1.9 2.2 1 1 176 1 . . . . . 1.9 1.9 2.4 1 1 177 1 . . . . . 1.9 1.5 2.3 1 1 178 1 . . . . . 2.1 1.6 2.7 1 1 179 1 . . . . . 2.1 1.6 2.6 1 1 180 1 . . . . . 2.3 1.7 2.9 1 1 181 1 . . . . . 2.2 1.6 2.8 1 1 182 1 . . . . . 2.2 1.6 2.8 1 1 183 1 . . . . . 2.3 1.7 2.9 1 1 184 1 . . . . . 3.3 2.0 4.6 1 1 185 1 . . . . . 2.0 1.5 2.5 1 1 186 1 . . . . . 2.9 1.9 3.9 1 1 187 1 . . . . . 2.3 1.7 2.9 1 1 188 1 . . . . . 2.3 1.7 2.9 1 1 189 1 . . . . . 2.5 1.7 3.3 1 1 190 1 . . . . . 3.5 0.0 6.0 1 1 191 1 . . . . . 2.4 1.7 2.9 1 1 192 1 . . . . . 2.6 1.8 3.4 1 1 193 1 . . . . . 3.3 2.0 4.7 1 1 194 1 . . . . . 1.7 1.3 2.2 1 1 195 1 . . . . . 2.5 1.7 3.3 1 1 196 1 . . . . . 2.2 1.6 2.8 1 1 197 1 . . . . . 2.4 1.7 3.1 1 1 198 1 . . . . . 2.4 0.0 6.0 1 1 199 1 . . . . . 2.7 1.8 3.6 1 1 200 1 . . . . . 2.7 1.8 3.6 1 1 201 1 . . . . . 2.7 1.8 3.6 1 1 202 1 . . . . . 3.6 2.0 5.2 1 1 203 1 . . . . . 3.2 1.9 4.5 1 1 204 1 . . . . . 2.7 1.8 2.8 1 1 205 1 . . . . . 2.8 1.8 3.8 1 1 206 1 . . . . . 2.7 1.8 3.6 1 1 207 1 . . . . . 3.5 2.0 5.0 1 1 208 1 . . . . . 3.5 2.0 5.0 1 1 209 1 . . . . . 3.0 1.9 4.1 1 1 210 1 . . . . . 3.0 1.9 4.1 1 1 211 1 . . . . . 2.8 1.8 3.8 1 1 212 1 . . . . . 2.6 1.7 3.5 1 1 213 1 . . . . . 4.1 2.0 6.0 1 1 214 1 . . . . . 2.7 1.8 3.6 1 1 215 1 . . . . . 3.8 2.0 5.6 1 1 216 1 . . . . . 3.7 2.0 5.4 1 1 217 1 . . . . . . 1.9 2.2 1 1 218 1 . . . . . 3.1 1.9 4.3 1 1 219 1 . . . . . 3.5 1.9 5.1 1 1 220 1 . . . . . 4.1 2.0 6.0 1 1 221 1 . . . . . 2.8 1.8 3.8 1 1 222 1 . . . . . 3.8 0.0 6.0 1 1 223 1 . . . . . 3.0 1.9 4.1 1 1 224 1 . . . . . 3.2 2.0 4.4 1 1 225 1 . . . . . 3.3 2.0 4.6 1 1 226 1 . . . . . 2.8 2.0 3.8 1 1 227 1 . . . . . 3.7 2.0 5.4 1 1 228 1 . . . . . 3.2 2.0 4.5 1 1 229 1 . . . . . 4.2 2.0 6.0 1 1 230 1 . . . . . 3.0 1.9 4.1 1 1 231 1 . . . . . 2.9 1.9 3.9 1 1 232 1 . . . . . 3.0 1.9 4.1 1 1 233 1 . . . . . 2.8 1.8 3.8 1 1 234 1 . . . . . 4.2 2.0 6.0 1 1 235 1 . . . . . 4.0 2.0 6.0 1 1 236 1 . . . . . 3.6 2.0 5.2 1 1 237 1 . . . . . 2.8 1.8 3.8 1 1 238 1 . . . . . 3.0 1.9 4.1 1 1 239 1 . . . . . 3.8 2.0 5.6 1 1 240 1 . . . . . 3.4 1.9 4.9 1 1 241 1 . . . . . 4.3 2.0 6.0 1 1 242 1 . . . . . 3.0 1.9 4.1 1 1 243 1 . . . . . 2.9 1.8 3.0 1 1 244 1 . . . . . 4.3 2.0 6.0 1 1 245 1 . . . . . 3.1 1.9 4.3 1 1 246 1 . . . . . 4.1 2.0 6.0 1 1 247 1 . . . . . 3.7 2.0 5.4 1 1 248 1 . . . . . 3.5 2.0 3.6 1 1 249 1 . . . . . 4.4 1.9 6.0 1 1 250 1 . . . . . 3.1 1.9 4.3 1 1 251 1 . . . . . 3.8 2.0 5.6 1 1 252 1 . . . . . 4.0 2.0 6.0 1 1 253 1 . . . . . 3.2 1.9 4.5 1 1 254 1 . . . . . 4.8 2.0 6.0 1 1 255 1 . . . . . 4.4 2.0 6.0 1 1 256 1 . . . . . 4.4 2.0 6.0 1 1 257 1 . . . . . 4.4 2.0 6.0 1 1 258 1 . . . . . 4.8 1.9 6.0 1 1 259 1 . . . . . 3.4 1.9 4.9 1 1 260 1 . . . . . 4.1 2.0 4.3 1 1 261 1 . . . . . 3.3 1.9 4.7 1 1 262 1 . . . . . 3.4 2.0 4.8 1 1 263 1 . . . . . 4.4 2.0 6.0 1 1 264 1 . . . . . 4.7 2.0 6.0 1 1 265 1 . . . . . 5.1 1.8 6.0 1 1 266 1 . . . . . 3.9 2.0 5.8 1 1 267 1 . . . . . 3.7 2.0 5.4 1 1 268 1 . . . . . 4.5 2.0 6.0 1 1 269 1 . . . . . 4.9 1.9 6.0 1 1 270 1 . . . . . 4.3 2.0 6.0 1 1 271 1 . . . . . 5.4 1.8 6.0 1 1 272 1 . . . . . 3.8 2.0 5.6 1 1 273 1 . . . . . 3.9 2.0 5.8 1 1 274 1 . . . . . 3.9 2.0 5.8 1 1 275 1 . . . . . 4.9 1.9 6.0 1 1 276 1 . . . . . 3.9 2.0 5.8 1 1 277 1 . . . . . 4.3 2.0 6.0 1 1 278 1 . . . . . 3.4 2.0 4.8 1 1 279 1 . . . . . 4.5 2.0 6.0 1 1 280 1 . . . . . 4.3 2.0 6.0 1 1 281 1 . . . . . 5.3 1.8 6.0 1 1 282 1 . . . . . 4.1 2.0 6.0 1 1 283 1 . . . . . 4.8 2.0 6.0 1 1 284 1 . . . . . 5.2 1.8 6.0 1 1 285 1 . . . . . 4.9 1.9 6.0 1 1 286 1 . . . . . 3.8 2.0 5.6 1 1 287 1 . . . . . 4.6 1.9 6.0 1 1 288 1 . . . . . 4.8 2.0 6.0 1 1 289 1 . . . . . 5.3 1.8 6.0 1 1 290 1 . . . . . 4.7 1.9 6.0 1 1 291 1 . . . . . 5.2 1.8 6.0 1 1 292 1 . . . . . 5.4 1.7 6.0 1 1 293 1 . . . . . 4.6 2.0 6.0 1 1 294 1 . . . . . 5.0 1.9 6.0 1 1 295 1 . . . . . 5.0 1.9 6.0 1 1 296 1 . . . . . 4.7 1.9 6.0 1 1 297 1 . . . . . 5.6 1.6 6.0 1 1 298 1 . . . . . 5.3 1.8 6.0 1 1 299 1 . . . . . 4.4 2.0 6.0 1 1 300 1 . . . . . 5.8 1.6 6.0 1 1 301 1 . . . . . 4.8 2.0 6.0 1 1 302 1 . . . . . 4.9 1.9 6.0 1 1 303 1 . . . . . 5.2 1.8 6.0 1 1 304 1 . . . . . 4.6 1.9 6.0 1 1 305 1 . . . . . 4.2 2.0 6.0 1 1 306 1 . . . . . 6.0 0.2 6.0 1 1 307 1 . . . . . 5.3 1.7 6.0 1 1 308 1 . . . . . 5.2 1.9 6.0 1 1 309 1 . . . . . 5.2 1.8 6.0 1 1 310 1 . . . . . 5.3 1.7 6.0 1 1 311 1 . . . . . 5.9 1.6 6.0 1 1 312 1 . . . . . 5.2 1.9 6.0 1 1 313 1 . . . . . 6.0 1.5 6.0 1 1 314 1 . . . . . 6.0 1.5 6.0 1 1 315 1 . . . . . 6.0 1.1 6.0 1 1 316 1 . . . . . 6.0 0.6 6.0 1 1 317 1 . . . . . 4.5 1.9 6.0 1 1 318 1 . . . . . 5.4 1.8 6.0 1 1 319 1 . . . . . 6.0 1.3 6.0 1 1 320 1 . . . . . 6.0 1.4 6.0 1 1 321 1 . . . . . 5.4 1.7 6.0 1 1 322 1 . . . . . 5.6 1.7 6.0 1 1 323 1 . . . . . 5.7 1.7 6.0 1 1 324 1 . . . . . 6.0 0.9 6.0 1 1 325 1 . . . . . 6.0 0.0 6.0 1 1 326 1 . . . . . 1.9 1.4 2.4 1 1 327 1 . . . . . 1.9 1.5 2.3 1 1 328 1 . . . . . 2.3 0.0 6.0 1 1 329 1 . . . . . 2.4 1.7 3.1 1 1 330 1 . . . . . 1.9 1.5 2.3 1 1 331 1 . . . . . 1.9 1.5 2.3 1 1 332 1 . . . . . 1.7 1.3 2.2 1 1 333 1 . . . . . 2.4 1.7 3.1 1 1 334 1 . . . . . 2.7 1.8 3.6 1 1 335 1 . . . . . 2.0 1.5 2.5 1 1 336 1 . . . . . 3.1 1.9 4.3 1 1 337 1 . . . . . 2.1 0.0 6.0 1 1 338 1 . . . . . 1.9 1.5 2.3 1 1 339 1 . . . . . 3.6 2.0 5.2 1 1 340 1 . . . . . 2.3 1.7 2.9 1 1 341 1 . . . . . 2.8 0.0 6.0 1 1 342 1 . . . . . 2.5 1.7 3.3 1 1 343 1 . . . . . 2.3 1.6 3.0 1 1 344 1 . . . . . 2.0 1.5 2.5 1 1 345 1 . . . . . 2.3 1.6 3.0 1 1 346 1 . . . . . 2.5 1.7 3.3 1 1 347 1 . . . . . 2.5 0.0 6.0 1 1 348 1 . . . . . 2.2 1.6 2.8 1 1 349 1 . . . . . 3.1 1.9 4.3 1 1 350 1 . . . . . 2.4 1.7 3.1 1 1 351 1 . . . . . 3.3 2.0 4.6 1 1 352 1 . . . . . 3.1 1.9 4.3 1 1 353 1 . . . . . 3.8 2.0 5.6 1 1 354 1 . . . . . 3.5 2.0 5.0 1 1 355 1 . . . . . 3.1 1.9 4.3 1 1 356 1 . . . . . 2.1 1.5 2.7 1 1 357 1 . . . . . 3.5 2.0 5.0 1 1 358 1 . . . . . 2.3 1.6 3.0 1 1 359 1 . . . . . 2.5 1.7 3.3 1 1 360 1 . . . . . 3.7 2.0 5.4 1 1 361 1 . . . . . 2.5 1.7 3.3 1 1 362 1 . . . . . 3.4 0.0 6.0 1 1 363 1 . . . . . 3.7 2.0 5.4 1 1 364 1 . . . . . 3.1 1.9 4.3 1 1 365 1 . . . . . 2.3 1.6 3.0 1 1 366 1 . . . . . 3.5 2.0 5.0 1 1 367 1 . . . . . 2.5 1.7 3.3 1 1 368 1 . . . . . 2.6 1.8 3.4 1 1 369 1 . . . . . 3.7 2.0 5.4 1 1 370 1 . . . . . 3.2 1.9 4.5 1 1 371 1 . . . . . 2.8 1.8 3.8 1 1 372 1 . . . . . 4.4 2.0 6.0 1 1 373 1 . . . . . 3.5 0.0 6.0 1 1 374 1 . . . . . 2.8 1.8 3.8 1 1 375 1 . . . . . 4.0 2.0 6.0 1 1 376 1 . . . . . 2.8 1.8 3.8 1 1 377 1 . . . . . 3.3 2.0 4.6 1 1 378 1 . . . . . 3.7 2.0 5.4 1 1 379 1 . . . . . 3.9 2.0 5.8 1 1 380 1 . . . . . 3.5 1.9 5.1 1 1 381 1 . . . . . 2.7 1.8 3.6 1 1 382 1 . . . . . 2.7 1.8 3.6 1 1 383 1 . . . . . 3.8 2.0 5.6 1 1 384 1 . . . . . 3.5 2.0 5.0 1 1 385 1 . . . . . 3.3 0.0 6.0 1 1 386 1 . . . . . 3.4 1.9 4.9 1 1 387 1 . . . . . 2.8 1.8 3.8 1 1 388 1 . . . . . 4.4 2.0 6.0 1 1 389 1 . . . . . 3.9 2.0 5.8 1 1 390 1 . . . . . 3.6 1.9 5.3 1 1 391 1 . . . . . 3.5 2.0 5.0 1 1 392 1 . . . . . 4.7 2.0 6.0 1 1 393 1 . . . . . 3.9 2.0 5.8 1 1 394 1 . . . . . 3.4 1.9 4.9 1 1 395 1 . . . . . 4.8 1.9 6.0 1 1 396 1 . . . . . 3.4 1.9 4.9 1 1 397 1 . . . . . 3.5 2.0 5.0 1 1 398 1 . . . . . 3.5 2.0 5.0 1 1 399 1 . . . . . 4.5 2.0 6.0 1 1 400 1 . . . . . 3.1 1.9 4.3 1 1 401 1 . . . . . 3.4 2.0 4.8 1 1 402 1 . . . . . 4.4 1.9 6.0 1 1 403 1 . . . . . 3.3 2.0 4.6 1 1 404 1 . . . . . 3.7 2.0 5.4 1 1 405 1 . . . . . 3.6 2.0 5.2 1 1 406 1 . . . . . 3.6 1.9 5.3 1 1 407 1 . . . . . 3.4 1.9 4.9 1 1 408 1 . . . . . 5.5 1.8 6.0 1 1 409 1 . . . . . 5.2 1.8 6.0 1 1 410 1 . . . . . 4.3 2.0 6.0 1 1 411 1 . . . . . 4.5 2.0 6.0 1 1 412 1 . . . . . 4.5 1.9 6.0 1 1 413 1 . . . . . 4.0 2.0 6.0 1 1 414 1 . . . . . 4.3 2.0 6.0 1 1 415 1 . . . . . 5.3 1.8 6.0 1 1 416 1 . . . . . 5.6 1.7 6.0 1 1 417 1 . . . . . 5.5 1.7 6.0 1 1 418 1 . . . . . 4.5 1.9 6.0 1 1 419 1 . . . . . 5.1 1.8 6.0 1 1 420 1 . . . . . 6.0 1.3 6.0 1 1 421 1 . . . . . 4.0 2.0 6.0 1 1 422 1 . . . . . 4.1 2.0 6.0 1 1 423 1 . . . . . 3.9 2.0 5.8 1 1 424 1 . . . . . 5.3 1.8 6.0 1 1 425 1 . . . . . 4.7 2.0 6.0 1 1 426 1 . . . . . 5.1 1.8 6.0 1 1 427 1 . . . . . 6.0 1.1 6.0 1 1 428 1 . . . . . 3.5 0.0 6.0 1 1 429 1 . . . . . 4.1 2.0 6.0 1 1 430 1 . . . . . 4.8 2.0 6.0 1 1 431 1 . . . . . 6.0 0.0 6.0 1 1 432 1 . . . . . 6.0 1.0 6.0 1 1 433 1 . . . . . 6.0 1.4 6.0 1 1 434 1 . . . . . 6.0 0.1 6.0 1 1 435 1 . . . . . 5.4 1.7 6.0 1 1 436 1 . . . . . 5.6 1.6 6.0 1 1 437 1 . . . . . 3.6 0.0 6.0 1 1 438 1 . . . . . 5.4 1.7 6.0 1 1 439 1 . . . . . 6.0 0.0 6.0 1 1 440 1 . . . . . 4.8 1.9 6.0 1 1 441 1 . . . . . 6.0 1.0 6.0 1 1 442 1 . . . . . 3.7 0.0 6.0 1 1 443 1 . . . . . 4.3 2.0 6.0 1 1 444 1 . . . . . 5.3 1.8 6.0 1 1 445 1 . . . . . 5.8 1.7 6.0 1 1 446 1 . . . . . 6.0 1.4 6.0 1 1 447 1 . . . . . 6.0 1.4 6.0 1 1 448 1 . . . . . 4.3 2.0 6.0 1 1 449 1 . . . . . 5.1 1.8 6.0 1 1 450 1 . . . . . 5.8 1.7 6.0 1 1 451 1 . . . . . 6.0 0.0 6.0 1 1 452 1 . . . . . 5.4 1.7 6.0 1 1 453 1 . . . . . 6.0 0.8 6.0 1 1 454 1 . . . . . 6.0 1.1 6.0 1 1 455 1 . . . . . 4.1 2.0 6.0 1 1 456 1 . . . . . 6.0 1.5 6.0 1 1 457 1 . . . . . 4.3 2.0 6.0 1 1 458 1 . . . . . 6.0 1.0 6.0 1 1 459 1 . . . . . 5.9 1.6 6.0 1 1 460 1 . . . . . 5.3 1.8 6.0 1 1 461 1 . . . . . 6.0 0.0 6.0 1 1 462 1 . . . . . 5.8 1.6 6.0 1 1 463 1 . . . . . 6.0 1.1 6.0 1 1 464 1 . . . . . 5.5 1.8 6.0 1 1 465 1 . . . . . 5.4 1.8 6.0 1 1 466 1 . . . . . 5.6 1.7 6.0 1 1 467 1 . . . . . 6.0 1.2 6.0 1 1 468 1 . . . . . 5.5 1.7 6.0 1 1 469 1 . . . . . 6.0 0.9 6.0 1 1 470 1 . . . . . 6.0 0.6 6.0 1 1 471 1 . . . . . 6.0 0.0 6.0 1 1 472 1 . . . . . 4.5 2.0 6.0 1 1 473 1 . . . . . 6.0 1.2 6.0 1 1 474 1 . . . . . 6.0 1.1 6.0 1 1 475 1 . . . . . 6.0 1.2 6.0 1 1 476 1 . . . . . 6.0 1.5 6.0 1 1 477 1 . . . . . 5.8 1.5 6.0 1 1 478 1 . . . . . 6.0 0.5 6.0 1 1 479 1 . . . . . 5.3 1.8 6.0 1 1 480 1 . . . . . 6.0 1.5 6.0 1 1 481 1 . . . . . 4.8 1.9 6.0 1 1 482 1 . . . . . 6.0 0.0 6.0 1 1 483 1 . . . . . 6.0 1.2 6.0 1 1 484 1 . . . . . 6.0 1.4 6.0 1 1 485 1 . . . . . 6.0 0.1 6.0 1 1 486 1 . . . . . 6.0 1.1 6.0 1 1 487 1 . . . . . 6.0 0.5 6.0 1 1 488 1 . . . . . 6.0 1.2 6.0 1 1 489 1 . . . . . 6.0 0.0 6.0 1 1 490 1 . . . . . 6.0 0.0 6.0 1 1 491 1 . . . . . 5.7 1.7 6.0 1 1 492 1 . . . . . 6.0 0.0 6.0 1 1 493 1 . . . . . 6.0 0.0 6.0 1 1 494 1 . . . . . 4.3 2.0 6.0 1 1 495 1 . . . . . 6.0 0.0 6.0 1 1 496 1 . . . . . 4.1 2.0 6.0 1 1 497 1 . . . . . 6.0 0.0 6.0 1 1 498 1 . . . . . 6.0 0.0 6.0 1 1 499 1 . . . . . 2.2 1.8 2.8 1 1 500 1 . . . . . 2.8 0.0 6.0 1 1 501 1 . . . . . 1.9 1.4 2.2 1 1 502 1 . . . . . 2.3 1.6 3.0 1 1 503 1 . . . . . 2.5 1.9 3.3 1 1 504 1 . . . . . . 1.9 2.7 1 1 505 1 . . . . . 2.9 1.9 3.0 1 1 506 1 . . . . . 2.9 1.8 4.0 1 1 507 1 . . . . . 3.9 2.0 5.2 1 1 508 1 . . . . . 2.3 1.7 2.9 1 1 509 1 . . . . . 2.3 1.7 2.9 1 1 510 1 . . . . . 2.4 1.7 3.1 1 1 511 1 . . . . . 2.1 0.0 6.0 1 1 512 1 . . . . . 2.0 1.5 2.5 1 1 513 1 . . . . . 2.6 1.8 3.4 1 1 514 1 . . . . . 2.5 1.7 3.3 1 1 515 1 . . . . . 2.3 1.6 3.0 1 1 516 1 . . . . . 3.3 2.0 4.6 1 1 517 1 . . . . . 3.3 2.0 4.6 1 1 518 1 . . . . . 3.3 2.0 4.6 1 1 519 1 . . . . . 3.0 1.9 4.1 1 1 520 1 . . . . . 2.4 1.7 3.1 1 1 521 1 . . . . . 2.6 1.8 3.4 1 1 522 1 . . . . . 3.2 1.9 4.5 1 1 523 1 . . . . . 3.7 1.9 5.5 1 1 524 1 . . . . . 3.6 2.0 5.2 1 1 525 1 . . . . . 4.0 2.0 6.0 1 1 526 1 . . . . . 4.2 1.9 6.0 1 1 527 1 . . . . . 3.9 2.0 5.8 1 1 528 1 . . . . . 4.0 2.0 6.0 1 1 529 1 . . . . . 5.0 1.8 6.0 1 1 530 1 . . . . . 6.0 1.0 6.0 1 1 531 1 . . . . . 6.0 0.4 6.0 1 1 532 1 . . . . . 6.0 0.0 6.0 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 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 2 . OR 1 2 7 2 . 3 . 1 2 7 3 . . . 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 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 30 GLU QB . 33 . HB1 1 2 1 1 1 1 1 32 LYS QB . 35 . HB1 1 2 1 1 1 1 1 33 GLN HB3 . 36 . HB1 1 2 1 1 2 1 1 31 THR HA . 34 . HA 1 2 2 1 1 1 1 16 GLU HA . 19 . HA 1 2 2 1 1 1 1 23 ARG HA . 26 . HA 1 2 2 1 2 1 1 24 THR MG . 27 . HG2% 1 2 3 1 1 1 1 18 LYS HB3 . 21 . HB1 1 2 3 1 2 1 1 20 PRO HD2 . 23 . HD1 1 2 3 1 2 1 1 22 GLY HA2 . 25 . HA2 1 2 4 1 1 1 1 15 THR HA . 18 . HA 1 2 4 1 1 1 1 25 TYR HA . 28 . HA 1 2 4 1 2 1 1 16 GLU QG . 19 . HG1 1 2 5 1 1 1 1 14 TRP HA . 17 . HA 1 2 5 1 2 1 1 15 THR MG . 18 . HG2% 1 2 5 1 2 1 1 39 PRO HB2 . 42 . HB1 1 2 6 1 1 1 1 14 TRP HE3 . 17 . HE3 1 2 6 1 1 1 1 36 TRP HD1 . 39 . HD1 1 2 6 1 2 1 1 35 THR MG . 38 . HG2% 1 2 7 2 1 1 1 13 MET HB2 . 16 . HB2 1 2 7 2 2 1 1 26 TYR HA . 29 . HA 1 2 7 3 1 1 1 20 PRO HD2 . 23 . HD1 1 2 7 3 1 1 1 36 TRP HB3 . 39 . HB1 1 2 7 3 2 1 1 25 TYR HB3 . 28 . HB1 1 2 8 1 1 1 1 29 THR HA . 32 . HA 1 2 8 1 2 1 1 32 LYS QB . 35 . HB1 1 2 8 1 2 1 1 33 GLN HB3 . 36 . HB1 1 2 9 1 1 1 1 14 TRP HZ3 . 17 . HZ3 1 2 9 1 1 1 1 27 TYR QD . 30 . HD% 1 2 9 1 2 1 1 28 ASN HA . 31 . HA 1 2 10 1 1 1 1 18 LYS QG . 21 . HG1 1 2 10 1 2 1 1 20 PRO HD2 . 23 . HD1 1 2 10 1 2 1 1 22 GLY HA2 . 25 . HA2 1 2 11 1 1 1 1 14 TRP HH2 . 17 . HH2 1 2 11 1 2 1 1 31 THR HB . 34 . HB 1 2 11 1 2 1 1 35 THR HB . 38 . HB 1 2 12 1 1 1 1 27 TYR QD . 30 . HD% 1 2 12 1 2 1 1 28 ASN HA . 31 . HA 1 2 12 1 2 1 1 33 GLN HA . 36 . HA 1 2 13 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 2 13 1 2 1 1 31 THR HB . 34 . HB 1 2 13 1 2 1 1 35 THR HB . 38 . HB 1 2 14 1 1 1 1 14 TRP HH2 . 17 . HH2 1 2 14 1 2 1 1 28 ASN HB3 . 31 . HB1 1 2 14 1 2 1 1 37 GLU HG2 . 40 . HG1 1 2 15 1 1 1 1 14 TRP HE3 . 17 . HE3 1 2 15 1 2 1 1 28 ASN HB3 . 31 . HB1 1 2 15 1 2 1 1 37 GLU HG2 . 40 . HG1 1 2 15 1 2 1 1 39 PRO HD2 . 42 . HD2 1 2 16 1 1 1 1 14 TRP HZ2 . 17 . HZ2 1 2 16 1 2 1 1 28 ASN HB3 . 31 . HB1 1 2 16 1 2 1 1 37 GLU HG2 . 40 . HG1 1 2 17 1 1 1 1 20 PRO HB3 . 23 . HB1 1 2 17 1 1 1 1 25 TYR HB3 . 28 . HB1 1 2 17 1 2 1 1 36 TRP HH2 . 39 . HH2 1 2 18 1 1 1 1 21 ASP QB . 24 . HB2 1 2 18 1 1 1 1 23 ARG QD . 26 . HD1 1 2 18 1 2 1 1 36 TRP HH2 . 39 . HH2 1 2 19 1 1 1 1 16 GLU HA . 19 . HA 1 2 19 1 1 1 1 37 GLU HA . 40 . HA 1 2 19 1 2 1 1 26 TYR QD . 29 . HD% 1 2 20 1 1 1 1 20 PRO HD2 . 23 . HD1 1 2 20 1 1 1 1 36 TRP HB3 . 39 . HB1 1 2 20 1 2 1 1 25 TYR QE . 28 . HE% 1 2 21 1 1 1 1 13 MET HA . 16 . HA 1 2 21 1 1 1 1 16 GLU HA . 19 . HA 1 2 21 1 2 1 1 15 THR MG . 18 . HG2% 1 2 22 1 1 1 1 15 THR H . 18 . HN 1 2 22 1 1 1 1 27 TYR H . 30 . HN 1 2 22 1 2 1 1 16 GLU H . 19 . HN 1 2 23 1 1 1 1 14 TRP HZ3 . 17 . HZ3 1 2 23 1 1 1 1 33 GLN HE22 . 36 . HE22 1 2 23 1 2 1 1 28 ASN H . 31 . HN 1 2 24 1 1 1 1 13 MET HB3 . 16 . HB1 1 2 24 1 1 1 1 13 MET ME . 16 . HE% 1 2 24 1 1 1 1 30 GLU QB . 33 . HB1 1 2 24 1 2 1 1 29 THR H . 32 . HN 1 2 25 1 1 1 1 17 HIS H . 20 . HN 1 2 25 1 2 1 1 26 TYR QB . 29 . HB2 1 2 25 1 2 1 1 27 TYR HB3 . 30 . HB1 1 2 26 1 1 1 1 25 TYR QD . 28 . HD% 1 2 26 1 1 1 1 26 TYR QD . 29 . HD% 1 2 26 1 2 1 1 27 TYR H . 30 . HN 1 2 27 1 1 1 1 20 PRO HD2 . 23 . HD1 1 2 27 1 1 1 1 22 GLY HA2 . 25 . HA2 1 2 27 1 2 1 1 21 ASP H . 24 . HN 1 2 28 1 1 1 1 32 LYS H . 35 . HN 1 2 28 1 1 1 1 36 TRP HE3 . 39 . HE3 1 2 28 1 2 1 1 34 SER H . 37 . HN 1 2 29 1 1 1 1 15 THR H . 18 . HN 1 2 29 1 2 1 1 26 TYR QB . 29 . HB2 1 2 29 1 2 1 1 27 TYR HB3 . 30 . HB1 1 2 30 1 1 1 1 16 GLU QG . 19 . HG1 1 2 30 1 1 1 1 23 ARG HB3 . 26 . HB1 1 2 30 1 2 1 1 19 SER H . 22 . HN 1 2 31 1 1 1 1 16 GLU HA . 19 . HA 1 2 31 1 1 1 1 17 HIS HA . 20 . HA 1 2 31 1 2 1 1 25 TYR H . 28 . HN 1 2 32 1 1 1 1 34 SER H . 37 . HN 1 2 32 1 1 1 1 36 TRP H . 39 . HN 1 2 32 1 2 1 1 35 THR H . 38 . HN 1 2 33 1 1 1 1 18 LYS H . 21 . HN 1 2 33 1 1 1 1 22 GLY H . 25 . HN 1 2 33 1 2 1 1 19 SER H . 22 . HN 1 2 34 1 1 1 1 14 TRP H . 17 . HN 1 2 34 1 1 1 1 30 GLU H . 33 . HN 1 2 34 1 2 1 1 15 THR H . 18 . HN 1 2 35 1 1 1 1 16 GLU H . 19 . HN 1 2 35 1 2 1 1 25 TYR QD . 28 . HD% 1 2 35 1 2 1 1 26 TYR QD . 29 . HD% 1 2 36 1 1 1 1 15 THR HA . 18 . HA 1 2 36 1 1 1 1 35 THR HA . 38 . HA 1 2 36 1 2 1 1 29 THR H . 32 . HN 1 2 37 1 1 1 1 17 HIS H . 20 . HN 1 2 37 1 2 1 1 19 SER H . 22 . HN 1 2 37 1 2 1 1 27 TYR H . 30 . HN 1 2 38 1 1 1 1 15 THR HA . 18 . HA 1 2 38 1 1 1 1 25 TYR HA . 28 . HA 1 2 38 1 2 1 1 27 TYR H . 30 . HN 1 2 39 1 1 1 1 14 TRP HZ3 . 17 . HZ3 1 2 39 1 1 1 1 27 TYR QD . 30 . HD% 1 2 39 1 2 1 1 29 THR H . 32 . HN 1 2 40 1 1 1 1 17 HIS HD2 . 20 . HD2 1 2 40 1 1 1 1 25 TYR QD . 28 . HD% 1 2 40 1 2 1 1 18 LYS H . 21 . 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 . . . . . 3.9 2.0 5.8 1 2 2 1 . . . . . 4.5 1.9 6.0 1 2 3 1 . . . . . 3.4 2.0 4.8 1 2 4 1 . . . . . 3.9 2.0 5.8 1 2 5 1 . . . . . 4.5 2.0 6.0 1 2 6 1 . . . . . 4.9 2.0 6.0 1 2 7 2 . . . . . 4.6 1.9 6.0 1 2 7 3 . . . . . 4.6 1.9 6.0 1 2 8 1 . . . . . 5.0 1.8 6.0 1 2 9 1 . . . . . 4.8 1.9 6.0 1 2 10 1 . . . . . 4.8 1.9 6.0 1 2 11 1 . . . . . 5.6 1.7 6.0 1 2 12 1 . . . . . 6.0 0.0 6.0 1 2 13 1 . . . . . 5.5 1.7 6.0 1 2 14 1 . . . . . 5.2 1.9 6.0 1 2 15 1 . . . . . 5.7 1.7 6.0 1 2 16 1 . . . . . 5.3 1.8 6.0 1 2 17 1 . . . . . 5.0 1.9 6.0 1 2 18 1 . . . . . 4.4 2.0 6.0 1 2 19 1 . . . . . 4.3 1.9 6.0 1 2 20 1 . . . . . 3.3 1.9 4.7 1 2 21 1 . . . . . 2.7 0.0 6.0 1 2 22 1 . . . . . 3.5 2.0 5.0 1 2 23 1 . . . . . 3.3 1.9 4.7 1 2 24 1 . . . . . 4.0 2.0 6.0 1 2 25 1 . . . . . 4.1 2.0 6.0 1 2 26 1 . . . . . 3.8 2.0 5.6 1 2 27 1 . . . . . 4.6 1.9 6.0 1 2 28 1 . . . . . 3.1 0.0 6.0 1 2 29 1 . . . . . 3.5 1.9 5.1 1 2 30 1 . . . . . 5.0 1.8 6.0 1 2 31 1 . . . . . 4.7 1.9 6.0 1 2 32 1 . . . . . 4.7 2.0 6.0 1 2 33 1 . . . . . 5.0 1.9 6.0 1 2 34 1 . . . . . 5.0 1.9 6.0 1 2 35 1 . . . . . 5.4 1.7 6.0 1 2 36 1 . . . . . 3.5 0.0 6.0 1 2 37 1 . . . . . 5.5 1.8 6.0 1 2 38 1 . . . . . 5.1 1.9 6.0 1 2 39 1 . . . . . 5.2 1.8 6.0 1 2 40 1 . . . . . 6.0 0.9 6.0 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 13 MET O . 16 . O 1 3 1 1 2 1 1 29 THR H . 32 . HN 1 3 2 1 1 1 1 13 MET O . 16 . O 1 3 2 1 2 1 1 29 THR N . 32 . N 1 3 3 1 1 1 1 15 THR H . 18 . HN 1 3 3 1 2 1 1 27 TYR O . 30 . O 1 3 4 1 1 1 1 15 THR N . 18 . N 1 3 4 1 2 1 1 27 TYR O . 30 . O 1 3 5 1 1 1 1 15 THR O . 18 . O 1 3 5 1 2 1 1 27 TYR H . 30 . HN 1 3 6 1 1 1 1 15 THR O . 18 . O 1 3 6 1 2 1 1 27 TYR N . 30 . N 1 3 7 1 1 1 1 17 HIS H . 20 . HN 1 3 7 1 2 1 1 25 TYR O . 28 . O 1 3 8 1 1 1 1 17 HIS N . 20 . N 1 3 8 1 2 1 1 25 TYR O . 28 . O 1 3 9 1 1 1 1 17 HIS O . 20 . O 1 3 9 1 2 1 1 25 TYR H . 28 . HN 1 3 10 1 1 1 1 17 HIS O . 20 . O 1 3 10 1 2 1 1 25 TYR N . 28 . N 1 3 11 1 1 1 1 19 SER O . 22 . O 1 3 11 1 2 1 1 23 ARG H . 26 . HN 1 3 12 1 1 1 1 19 SER O . 22 . O 1 3 12 1 2 1 1 23 ARG N . 26 . N 1 3 13 1 1 1 1 19 SER H . 22 . HN 1 3 13 1 2 1 1 23 ARG O . 26 . O 1 3 14 1 1 1 1 19 SER N . 22 . N 1 3 14 1 2 1 1 23 ARG O . 26 . O 1 3 15 1 1 1 1 28 ASN O . 31 . O 1 3 15 1 2 1 1 33 GLN H . 36 . HN 1 3 16 1 1 1 1 28 ASN O . 31 . O 1 3 16 1 2 1 1 33 GLN N . 36 . N 1 3 17 1 1 1 1 28 ASN H . 31 . HN 1 3 17 1 2 1 1 33 GLN O . 36 . O 1 3 18 1 1 1 1 28 ASN N . 31 . N 1 3 18 1 2 1 1 33 GLN O . 36 . O 1 3 19 1 1 1 1 26 TYR H . 29 . HN 1 3 19 1 2 1 1 35 THR O . 38 . O 1 3 20 1 1 1 1 26 TYR N . 29 . N 1 3 20 1 2 1 1 35 THR O . 38 . O 1 3 21 1 1 1 1 26 TYR O . 29 . O 1 3 21 1 2 1 1 35 THR H . 38 . HN 1 3 22 1 1 1 1 26 TYR O . 29 . O 1 3 22 1 2 1 1 35 THR N . 38 . N 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.8 1.5 2.1 1 3 2 1 . . . . . 2.8 2.5 3.1 1 3 3 1 . . . . . 1.8 1.5 2.1 1 3 4 1 . . . . . 2.8 2.5 3.1 1 3 5 1 . . . . . 1.8 1.5 2.1 1 3 6 1 . . . . . 2.8 2.5 3.1 1 3 7 1 . . . . . 1.8 1.5 2.1 1 3 8 1 . . . . . 2.8 2.5 3.1 1 3 9 1 . . . . . 1.8 1.5 2.1 1 3 10 1 . . . . . 2.8 2.5 3.1 1 3 11 1 . . . . . 1.8 1.5 2.1 1 3 12 1 . . . . . 2.8 2.5 3.1 1 3 13 1 . . . . . 1.8 1.5 2.1 1 3 14 1 . . . . . 2.8 2.5 3.1 1 3 15 1 . . . . . 1.8 1.5 2.1 1 3 16 1 . . . . . 2.8 2.5 3.1 1 3 17 1 . . . . . 1.8 1.5 2.1 1 3 18 1 . . . . . 2.8 2.5 3.1 1 3 19 1 . . . . . 1.8 1.5 2.1 1 3 20 1 . . . . . 2.8 2.5 3.1 1 3 21 1 . . . . . 1.8 1.5 2.1 1 3 22 1 . . . . . 2.8 2.5 3.1 1 3 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 13 MET C 1 1 14 TRP N 1 1 14 TRP CA 1 1 14 TRP C -165.0 -105.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 2 . 1 1 14 TRP C 1 1 15 THR N 1 1 15 THR CA 1 1 15 THR C -165.0 -105.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 3 . 1 1 15 THR C 1 1 16 GLU N 1 1 16 GLU CA 1 1 16 GLU C -165.0 -105.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 4 . 1 1 16 GLU C 1 1 17 HIS N 1 1 17 HIS CA 1 1 17 HIS C -165.0 -105.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 5 . 1 1 22 GLY C 1 1 23 ARG N 1 1 23 ARG CA 1 1 23 ARG C -165.0 -105.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 6 . 1 1 23 ARG C 1 1 24 THR N 1 1 24 THR CA 1 1 24 THR C -165.0 -105.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 7 . 1 1 24 THR C 1 1 25 TYR N 1 1 25 TYR CA 1 1 25 TYR C -165.0 -105.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 8 . 1 1 25 TYR C 1 1 26 TYR N 1 1 26 TYR CA 1 1 26 TYR C -165.0 -105.0 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 9 . 1 1 26 TYR C 1 1 27 TYR N 1 1 27 TYR CA 1 1 27 TYR C -165.0 -105.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 10 . 1 1 32 LYS C 1 1 33 GLN N 1 1 33 GLN CA 1 1 33 GLN C -165.0 -105.0 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 11 . 1 1 33 GLN C 1 1 34 SER N 1 1 34 SER CA 1 1 34 SER C -165.0 -105.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 12 . 1 1 34 SER C 1 1 35 THR N 1 1 35 THR CA 1 1 35 THR C -165.0 -105.0 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 13 . 1 1 35 THR C 1 1 36 TRP N 1 1 36 TRP CA 1 1 36 TRP C -165.0 -105.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 14 . 1 1 36 TRP C 1 1 37 GLU N 1 1 37 GLU CA 1 1 37 GLU C -165.0 -105.0 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 15 . 1 1 14 TRP N 1 1 14 TRP CA 1 1 14 TRP C 1 1 15 THR N 105.0 165.0 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 16 . 1 1 15 THR N 1 1 15 THR CA 1 1 15 THR C 1 1 16 GLU N 105.0 165.0 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 17 . 1 1 16 GLU N 1 1 16 GLU CA 1 1 16 GLU C 1 1 17 HIS N 105.0 165.0 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 18 . 1 1 17 HIS N 1 1 17 HIS CA 1 1 17 HIS C 1 1 18 LYS N 105.0 165.0 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 19 . 1 1 23 ARG N 1 1 23 ARG CA 1 1 23 ARG C 1 1 24 THR N 105.0 165.0 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 20 . 1 1 24 THR N 1 1 24 THR CA 1 1 24 THR C 1 1 25 TYR N 105.0 165.0 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 21 . 1 1 25 TYR N 1 1 25 TYR CA 1 1 25 TYR C 1 1 26 TYR N 105.0 165.0 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 22 . 1 1 26 TYR N 1 1 26 TYR CA 1 1 26 TYR C 1 1 27 TYR N 105.0 165.0 . 29 . N . 29 . CA . 29 . C . 30 . N 1 1 23 . 1 1 27 TYR N 1 1 27 TYR CA 1 1 27 TYR C 1 1 28 ASN N 105.0 165.0 . 30 . N . 30 . CA . 30 . C . 31 . N 1 1 24 . 1 1 33 GLN N 1 1 33 GLN CA 1 1 33 GLN C 1 1 34 SER N 105.0 165.0 . 36 . N . 36 . CA . 36 . C . 37 . N 1 1 25 . 1 1 34 SER N 1 1 34 SER CA 1 1 34 SER C 1 1 35 THR N 105.0 165.0 . 37 . N . 37 . CA . 37 . C . 38 . N 1 1 26 . 1 1 35 THR N 1 1 35 THR CA 1 1 35 THR C 1 1 36 TRP N 105.0 165.0 . 38 . N . 38 . CA . 38 . C . 39 . N 1 1 27 . 1 1 36 TRP N 1 1 36 TRP CA 1 1 36 TRP C 1 1 37 GLU N 105.0 165.0 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 28 . 1 1 37 GLU N 1 1 37 GLU CA 1 1 37 GLU C 1 1 38 LYS N 105.0 165.0 . 40 . N . 40 . CA . 40 . C . 41 . N 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 12 SER C C -11.073 -2.020 -2.932 1.00 . A A . 15 SER C 1 1 1 2 1 1 12 SER CA C -10.704 -3.271 -3.720 1.00 . A A . 15 SER CA 1 1 1 3 1 1 12 SER CB C -11.617 -4.426 -3.314 1.00 . A A . 15 SER CB 1 1 1 4 1 1 12 SER H H -8.843 -3.252 -2.717 1.00 . A A . 15 SER H 1 1 1 5 1 1 12 SER HA H -10.829 -3.074 -4.774 1.00 . A A . 15 SER HA 1 1 1 6 1 1 12 SER HB2 H -11.354 -4.750 -2.318 1.00 . A A . 15 SER HB2 1 1 1 7 1 1 12 SER HB3 H -12.644 -4.092 -3.325 1.00 . A A . 15 SER HB3 1 1 1 8 1 1 12 SER HG H -12.315 -5.675 -4.651 1.00 . A A . 15 SER HG 1 1 1 9 1 1 12 SER N N -9.310 -3.630 -3.491 1.00 . A A . 15 SER N 1 1 1 10 1 1 12 SER O O -11.587 -1.049 -3.489 1.00 . A A . 15 SER O 1 1 1 11 1 1 12 SER OG O -11.482 -5.524 -4.200 1.00 . A A . 15 SER OG 1 1 1 12 1 1 13 MET C C -9.890 -0.022 -0.604 1.00 . A A . 16 MET C 1 1 1 13 1 1 13 MET CA C -11.104 -0.930 -0.756 1.00 . A A . 16 MET CA 1 1 1 14 1 1 13 MET CB C -11.544 -1.430 0.621 1.00 . A A . 16 MET CB 1 1 1 15 1 1 13 MET CE C -13.164 -1.429 3.277 1.00 . A A . 16 MET CE 1 1 1 16 1 1 13 MET CG C -12.878 -2.158 0.612 1.00 . A A . 16 MET CG 1 1 1 17 1 1 13 MET H H -10.397 -2.861 -1.250 1.00 . A A . 16 MET H 1 1 1 18 1 1 13 MET HA H -11.910 -0.366 -1.200 1.00 . A A . 16 MET HA 1 1 1 19 1 1 13 MET HB2 H -10.794 -2.106 1.002 1.00 . A A . 16 MET HB2 1 1 1 20 1 1 13 MET HB3 H -11.624 -0.584 1.289 1.00 . A A . 16 MET HB3 1 1 1 21 1 1 13 MET HE1 H -13.417 -1.705 4.290 1.00 . A A . 16 MET HE1 1 1 1 22 1 1 13 MET HE2 H -13.844 -0.666 2.930 1.00 . A A . 16 MET HE2 1 1 1 23 1 1 13 MET HE3 H -12.153 -1.051 3.250 1.00 . A A . 16 MET HE3 1 1 1 24 1 1 13 MET HG2 H -13.652 -1.459 0.334 1.00 . A A . 16 MET HG2 1 1 1 25 1 1 13 MET HG3 H -12.833 -2.953 -0.118 1.00 . A A . 16 MET HG3 1 1 1 26 1 1 13 MET N N -10.806 -2.055 -1.631 1.00 . A A . 16 MET N 1 1 1 27 1 1 13 MET O O -10.003 1.104 -0.119 1.00 . A A . 16 MET O 1 1 1 28 1 1 13 MET SD S -13.292 -2.869 2.217 1.00 . A A . 16 MET SD 1 1 1 29 1 1 14 TRP C C -7.053 0.778 -2.276 1.00 . A A . 17 TRP C 1 1 1 30 1 1 14 TRP CA C -7.495 0.254 -0.919 1.00 . A A . 17 TRP CA 1 1 1 31 1 1 14 TRP CB C -6.368 -0.592 -0.321 1.00 . A A . 17 TRP CB 1 1 1 32 1 1 14 TRP CD1 C -7.660 -2.255 1.136 1.00 . A A . 17 TRP CD1 1 1 1 33 1 1 14 TRP CD2 C -6.159 -1.019 2.235 1.00 . A A . 17 TRP CD2 1 1 1 34 1 1 14 TRP CE2 C -6.788 -1.876 3.154 1.00 . A A . 17 TRP CE2 1 1 1 35 1 1 14 TRP CE3 C -5.174 -0.144 2.689 1.00 . A A . 17 TRP CE3 1 1 1 36 1 1 14 TRP CG C -6.733 -1.271 0.956 1.00 . A A . 17 TRP CG 1 1 1 37 1 1 14 TRP CH2 C -5.490 -1.015 4.927 1.00 . A A . 17 TRP CH2 1 1 1 38 1 1 14 TRP CZ2 C -6.461 -1.883 4.506 1.00 . A A . 17 TRP CZ2 1 1 1 39 1 1 14 TRP CZ3 C -4.847 -0.152 4.029 1.00 . A A . 17 TRP CZ3 1 1 1 40 1 1 14 TRP H H -8.700 -1.418 -1.405 1.00 . A A . 17 TRP H 1 1 1 41 1 1 14 TRP HA H -7.683 1.092 -0.267 1.00 . A A . 17 TRP HA 1 1 1 42 1 1 14 TRP HB2 H -6.077 -1.350 -1.028 1.00 . A A . 17 TRP HB2 1 1 1 43 1 1 14 TRP HB3 H -5.518 0.051 -0.122 1.00 . A A . 17 TRP HB3 1 1 1 44 1 1 14 TRP HD1 H -8.268 -2.670 0.345 1.00 . A A . 17 TRP HD1 1 1 1 45 1 1 14 TRP HE1 H -8.287 -3.309 2.837 1.00 . A A . 17 TRP HE1 1 1 1 46 1 1 14 TRP HE3 H -4.666 0.526 2.009 1.00 . A A . 17 TRP HE3 1 1 1 47 1 1 14 TRP HH2 H -5.203 -0.987 5.968 1.00 . A A . 17 TRP HH2 1 1 1 48 1 1 14 TRP HZ2 H -6.951 -2.541 5.208 1.00 . A A . 17 TRP HZ2 1 1 1 49 1 1 14 TRP HZ3 H -4.087 0.517 4.397 1.00 . A A . 17 TRP HZ3 1 1 1 50 1 1 14 TRP N N -8.728 -0.517 -1.021 1.00 . A A . 17 TRP N 1 1 1 51 1 1 14 TRP NE1 N -7.702 -2.623 2.457 1.00 . A A . 17 TRP NE1 1 1 1 52 1 1 14 TRP O O -7.269 0.141 -3.308 1.00 . A A . 17 TRP O 1 1 1 53 1 1 15 THR C C -4.470 2.978 -3.238 1.00 . A A . 18 THR C 1 1 1 54 1 1 15 THR CA C -5.920 2.567 -3.467 1.00 . A A . 18 THR CA 1 1 1 55 1 1 15 THR CB C -6.750 3.799 -3.870 1.00 . A A . 18 THR CB 1 1 1 56 1 1 15 THR CG2 C -6.450 4.204 -5.305 1.00 . A A . 18 THR CG2 1 1 1 57 1 1 15 THR H H -6.309 2.405 -1.402 1.00 . A A . 18 THR H 1 1 1 58 1 1 15 THR HA H -5.967 1.837 -4.262 1.00 . A A . 18 THR HA 1 1 1 59 1 1 15 THR HB H -6.494 4.621 -3.217 1.00 . A A . 18 THR HB 1 1 1 60 1 1 15 THR HG1 H -8.397 2.831 -4.367 1.00 . A A . 18 THR HG1 1 1 1 61 1 1 15 THR HG21 H -5.390 4.379 -5.414 1.00 . A A . 18 THR HG21 1 1 1 62 1 1 15 THR HG22 H -6.990 5.108 -5.544 1.00 . A A . 18 THR HG22 1 1 1 63 1 1 15 THR HG23 H -6.755 3.414 -5.973 1.00 . A A . 18 THR HG23 1 1 1 64 1 1 15 THR N N -6.430 1.946 -2.258 1.00 . A A . 18 THR N 1 1 1 65 1 1 15 THR O O -4.198 3.882 -2.448 1.00 . A A . 18 THR O 1 1 1 66 1 1 15 THR OG1 O -8.148 3.513 -3.738 1.00 . A A . 18 THR OG1 1 1 1 67 1 1 16 GLU C C -1.524 3.500 -4.831 1.00 . A A . 19 GLU C 1 1 1 68 1 1 16 GLU CA C -2.125 2.619 -3.741 1.00 . A A . 19 GLU CA 1 1 1 69 1 1 16 GLU CB C -1.330 1.315 -3.638 1.00 . A A . 19 GLU CB 1 1 1 70 1 1 16 GLU CD C -2.418 0.209 -5.637 1.00 . A A . 19 GLU CD 1 1 1 71 1 1 16 GLU CG C -1.117 0.608 -4.970 1.00 . A A . 19 GLU CG 1 1 1 72 1 1 16 GLU H H -3.809 1.628 -4.560 1.00 . A A . 19 GLU H 1 1 1 73 1 1 16 GLU HA H -2.039 3.141 -2.804 1.00 . A A . 19 GLU HA 1 1 1 74 1 1 16 GLU HB2 H -0.362 1.531 -3.213 1.00 . A A . 19 GLU HB2 1 1 1 75 1 1 16 GLU HB3 H -1.858 0.641 -2.981 1.00 . A A . 19 GLU HB3 1 1 1 76 1 1 16 GLU HG2 H -0.579 1.270 -5.633 1.00 . A A . 19 GLU HG2 1 1 1 77 1 1 16 GLU HG3 H -0.530 -0.282 -4.799 1.00 . A A . 19 GLU HG3 1 1 1 78 1 1 16 GLU N N -3.541 2.329 -3.934 1.00 . A A . 19 GLU N 1 1 1 79 1 1 16 GLU O O -1.888 3.413 -6.005 1.00 . A A . 19 GLU O 1 1 1 80 1 1 16 GLU OE1 O -3.037 -0.776 -5.185 1.00 . A A . 19 GLU OE1 1 1 1 81 1 1 16 GLU OE2 O -2.817 0.881 -6.611 1.00 . A A . 19 GLU OE2 1 1 1 82 1 1 17 HIS C C 1.508 5.581 -4.729 1.00 . A A . 20 HIS C 1 1 1 83 1 1 17 HIS CA C 0.119 5.273 -5.293 1.00 . A A . 20 HIS CA 1 1 1 84 1 1 17 HIS CB C -0.662 6.583 -5.448 1.00 . A A . 20 HIS CB 1 1 1 85 1 1 17 HIS CD2 C -3.234 6.305 -5.244 1.00 . A A . 20 HIS CD2 1 1 1 86 1 1 17 HIS CE1 C -3.713 6.196 -7.381 1.00 . A A . 20 HIS CE1 1 1 1 87 1 1 17 HIS CG C -2.070 6.409 -5.929 1.00 . A A . 20 HIS CG 1 1 1 88 1 1 17 HIS H H -0.357 4.352 -3.449 1.00 . A A . 20 HIS H 1 1 1 89 1 1 17 HIS HA H 0.223 4.801 -6.258 1.00 . A A . 20 HIS HA 1 1 1 90 1 1 17 HIS HB2 H -0.702 7.082 -4.492 1.00 . A A . 20 HIS HB2 1 1 1 91 1 1 17 HIS HB3 H -0.146 7.216 -6.155 1.00 . A A . 20 HIS HB3 1 1 1 92 1 1 17 HIS HD1 H -1.777 6.379 -8.015 1.00 . A A . 20 HIS HD1 1 1 1 93 1 1 17 HIS HD2 H -3.350 6.316 -4.167 1.00 . A A . 20 HIS HD2 1 1 1 94 1 1 17 HIS HE1 H -4.260 6.112 -8.308 1.00 . A A . 20 HIS HE1 1 1 1 95 1 1 17 HIS HE2 H -5.199 6.198 -5.973 1.00 . A A . 20 HIS HE2 1 1 1 96 1 1 17 HIS N N -0.586 4.349 -4.405 1.00 . A A . 20 HIS N 1 1 1 97 1 1 17 HIS ND1 N -2.405 6.335 -7.264 1.00 . A A . 20 HIS ND1 1 1 1 98 1 1 17 HIS NE2 N -4.240 6.174 -6.170 1.00 . A A . 20 HIS NE2 1 1 1 99 1 1 17 HIS O O 1.727 5.476 -3.522 1.00 . A A . 20 HIS O 1 1 1 100 1 1 18 LYS C C 3.806 7.268 -4.017 1.00 . A A . 21 LYS C 1 1 1 101 1 1 18 LYS CA C 3.803 6.283 -5.181 1.00 . A A . 21 LYS CA 1 1 1 102 1 1 18 LYS CB C 4.592 6.868 -6.350 1.00 . A A . 21 LYS CB 1 1 1 103 1 1 18 LYS CD C 3.616 6.513 -8.635 1.00 . A A . 21 LYS CD 1 1 1 104 1 1 18 LYS CE C 3.560 5.593 -9.844 1.00 . A A . 21 LYS CE 1 1 1 105 1 1 18 LYS CG C 4.567 5.982 -7.575 1.00 . A A . 21 LYS CG 1 1 1 106 1 1 18 LYS H H 2.228 5.979 -6.560 1.00 . A A . 21 LYS H 1 1 1 107 1 1 18 LYS HA H 4.281 5.369 -4.861 1.00 . A A . 21 LYS HA 1 1 1 108 1 1 18 LYS HB2 H 4.172 7.828 -6.612 1.00 . A A . 21 LYS HB2 1 1 1 109 1 1 18 LYS HB3 H 5.620 7.001 -6.046 1.00 . A A . 21 LYS HB3 1 1 1 110 1 1 18 LYS HD2 H 2.626 6.592 -8.210 1.00 . A A . 21 LYS HD2 1 1 1 111 1 1 18 LYS HD3 H 3.954 7.489 -8.951 1.00 . A A . 21 LYS HD3 1 1 1 112 1 1 18 LYS HE2 H 3.184 4.630 -9.531 1.00 . A A . 21 LYS HE2 1 1 1 113 1 1 18 LYS HE3 H 2.890 6.020 -10.576 1.00 . A A . 21 LYS HE3 1 1 1 114 1 1 18 LYS HG2 H 5.562 5.923 -7.990 1.00 . A A . 21 LYS HG2 1 1 1 115 1 1 18 LYS HG3 H 4.241 4.999 -7.271 1.00 . A A . 21 LYS HG3 1 1 1 116 1 1 18 LYS HZ1 H 4.829 4.786 -11.293 1.00 . A A . 21 LYS HZ1 1 1 1 117 1 1 18 LYS HZ2 H 5.556 4.981 -9.780 1.00 . A A . 21 LYS HZ2 1 1 1 118 1 1 18 LYS HZ3 H 5.285 6.328 -10.766 1.00 . A A . 21 LYS HZ3 1 1 1 119 1 1 18 LYS N N 2.445 5.952 -5.604 1.00 . A A . 21 LYS N 1 1 1 120 1 1 18 LYS NZ N 4.902 5.409 -10.464 1.00 . A A . 21 LYS NZ 1 1 1 121 1 1 18 LYS O O 2.846 8.008 -3.807 1.00 . A A . 21 LYS O 1 1 1 122 1 1 19 SER C C 6.499 8.097 -1.595 1.00 . A A . 22 SER C 1 1 1 123 1 1 19 SER CA C 5.058 8.144 -2.118 1.00 . A A . 22 SER CA 1 1 1 124 1 1 19 SER CB C 4.073 7.732 -1.025 1.00 . A A . 22 SER CB 1 1 1 125 1 1 19 SER H H 5.629 6.647 -3.496 1.00 . A A . 22 SER H 1 1 1 126 1 1 19 SER HA H 4.834 9.151 -2.436 1.00 . A A . 22 SER HA 1 1 1 127 1 1 19 SER HB2 H 3.663 6.761 -1.262 1.00 . A A . 22 SER HB2 1 1 1 128 1 1 19 SER HB3 H 4.587 7.685 -0.077 1.00 . A A . 22 SER HB3 1 1 1 129 1 1 19 SER HG H 2.701 8.893 -1.804 1.00 . A A . 22 SER HG 1 1 1 130 1 1 19 SER N N 4.903 7.265 -3.269 1.00 . A A . 22 SER N 1 1 1 131 1 1 19 SER O O 7.307 7.316 -2.103 1.00 . A A . 22 SER O 1 1 1 132 1 1 19 SER OG O 3.011 8.664 -0.924 1.00 . A A . 22 SER OG 1 1 1 133 1 1 20 PRO C C 8.920 7.663 -0.019 1.00 . A A . 23 PRO C 1 1 1 134 1 1 20 PRO CA C 8.182 9.001 0.000 1.00 . A A . 23 PRO CA 1 1 1 135 1 1 20 PRO CB C 7.903 9.433 1.440 1.00 . A A . 23 PRO CB 1 1 1 136 1 1 20 PRO CD C 5.970 9.943 0.046 1.00 . A A . 23 PRO CD 1 1 1 137 1 1 20 PRO CG C 6.569 10.122 1.422 1.00 . A A . 23 PRO CG 1 1 1 138 1 1 20 PRO HA H 8.792 9.749 -0.485 1.00 . A A . 23 PRO HA 1 1 1 139 1 1 20 PRO HB2 H 7.883 8.562 2.078 1.00 . A A . 23 PRO HB2 1 1 1 140 1 1 20 PRO HB3 H 8.683 10.103 1.770 1.00 . A A . 23 PRO HB3 1 1 1 141 1 1 20 PRO HD2 H 4.959 9.577 0.125 1.00 . A A . 23 PRO HD2 1 1 1 142 1 1 20 PRO HD3 H 5.989 10.873 -0.499 1.00 . A A . 23 PRO HD3 1 1 1 143 1 1 20 PRO HG2 H 5.924 9.675 2.163 1.00 . A A . 23 PRO HG2 1 1 1 144 1 1 20 PRO HG3 H 6.703 11.173 1.633 1.00 . A A . 23 PRO HG3 1 1 1 145 1 1 20 PRO N N 6.845 8.944 -0.590 1.00 . A A . 23 PRO N 1 1 1 146 1 1 20 PRO O O 8.302 6.598 0.027 1.00 . A A . 23 PRO O 1 1 1 147 1 1 21 ASP C C 11.061 5.897 -1.483 1.00 . A A . 24 ASP C 1 1 1 148 1 1 21 ASP CA C 11.112 6.561 -0.108 1.00 . A A . 24 ASP CA 1 1 1 149 1 1 21 ASP CB C 10.723 5.559 0.986 1.00 . A A . 24 ASP CB 1 1 1 150 1 1 21 ASP CG C 11.727 4.431 1.121 1.00 . A A . 24 ASP CG 1 1 1 151 1 1 21 ASP H H 10.669 8.630 -0.087 1.00 . A A . 24 ASP H 1 1 1 152 1 1 21 ASP HA H 12.124 6.894 0.071 1.00 . A A . 24 ASP HA 1 1 1 153 1 1 21 ASP HB2 H 10.663 6.076 1.932 1.00 . A A . 24 ASP HB2 1 1 1 154 1 1 21 ASP HB3 H 9.758 5.134 0.752 1.00 . A A . 24 ASP HB3 1 1 1 155 1 1 21 ASP N N 10.250 7.743 -0.072 1.00 . A A . 24 ASP N 1 1 1 156 1 1 21 ASP O O 11.786 4.938 -1.750 1.00 . A A . 24 ASP O 1 1 1 157 1 1 21 ASP OD1 O 11.574 3.411 0.419 1.00 . A A . 24 ASP OD1 1 1 1 158 1 1 21 ASP OD2 O 12.669 4.569 1.930 1.00 . A A . 24 ASP OD2 1 1 1 159 1 1 22 GLY C C 9.354 4.556 -3.713 1.00 . A A . 25 GLY C 1 1 1 160 1 1 22 GLY CA C 10.072 5.885 -3.691 1.00 . A A . 25 GLY CA 1 1 1 161 1 1 22 GLY H H 9.641 7.172 -2.079 1.00 . A A . 25 GLY H 1 1 1 162 1 1 22 GLY HA2 H 9.514 6.585 -4.300 1.00 . A A . 25 GLY HA2 1 1 1 163 1 1 22 GLY HA3 H 11.054 5.762 -4.107 1.00 . A A . 25 GLY HA3 1 1 1 164 1 1 22 GLY N N 10.200 6.420 -2.352 1.00 . A A . 25 GLY N 1 1 1 165 1 1 22 GLY O O 9.801 3.605 -4.354 1.00 . A A . 25 GLY O 1 1 1 166 1 1 23 ARG C C 5.956 3.671 -2.948 1.00 . A A . 26 ARG C 1 1 1 167 1 1 23 ARG CA C 7.427 3.296 -2.940 1.00 . A A . 26 ARG CA 1 1 1 168 1 1 23 ARG CB C 7.777 2.474 -1.697 1.00 . A A . 26 ARG CB 1 1 1 169 1 1 23 ARG CD C 8.728 2.475 0.624 1.00 . A A . 26 ARG CD 1 1 1 170 1 1 23 ARG CG C 8.077 3.309 -0.464 1.00 . A A . 26 ARG CG 1 1 1 171 1 1 23 ARG CZ C 7.988 0.777 2.242 1.00 . A A . 26 ARG CZ 1 1 1 172 1 1 23 ARG H H 7.939 5.302 -2.525 1.00 . A A . 26 ARG H 1 1 1 173 1 1 23 ARG HA H 7.639 2.708 -3.821 1.00 . A A . 26 ARG HA 1 1 1 174 1 1 23 ARG HB2 H 6.947 1.825 -1.467 1.00 . A A . 26 ARG HB2 1 1 1 175 1 1 23 ARG HB3 H 8.645 1.869 -1.914 1.00 . A A . 26 ARG HB3 1 1 1 176 1 1 23 ARG HD2 H 9.658 2.077 0.247 1.00 . A A . 26 ARG HD2 1 1 1 177 1 1 23 ARG HD3 H 8.928 3.113 1.469 1.00 . A A . 26 ARG HD3 1 1 1 178 1 1 23 ARG HE H 7.198 1.048 0.429 1.00 . A A . 26 ARG HE 1 1 1 179 1 1 23 ARG HG2 H 8.742 4.113 -0.737 1.00 . A A . 26 ARG HG2 1 1 1 180 1 1 23 ARG HG3 H 7.156 3.716 -0.083 1.00 . A A . 26 ARG HG3 1 1 1 181 1 1 23 ARG HH11 H 9.497 1.960 2.884 1.00 . A A . 26 ARG HH11 1 1 1 182 1 1 23 ARG HH12 H 8.973 0.749 4.007 1.00 . A A . 26 ARG HH12 1 1 1 183 1 1 23 ARG HH21 H 6.503 -0.550 1.904 1.00 . A A . 26 ARG HH21 1 1 1 184 1 1 23 ARG HH22 H 7.272 -0.676 3.450 1.00 . A A . 26 ARG HH22 1 1 1 185 1 1 23 ARG N N 8.237 4.501 -3.008 1.00 . A A . 26 ARG N 1 1 1 186 1 1 23 ARG NE N 7.879 1.369 1.055 1.00 . A A . 26 ARG NE 1 1 1 187 1 1 23 ARG NH1 N 8.894 1.196 3.115 1.00 . A A . 26 ARG NH1 1 1 1 188 1 1 23 ARG NH2 N 7.189 -0.232 2.557 1.00 . A A . 26 ARG NH2 1 1 1 189 1 1 23 ARG O O 5.608 4.832 -2.741 1.00 . A A . 26 ARG O 1 1 1 190 1 1 24 THR C C 2.946 2.484 -1.986 1.00 . A A . 27 THR C 1 1 1 191 1 1 24 THR CA C 3.663 2.961 -3.242 1.00 . A A . 27 THR CA 1 1 1 192 1 1 24 THR CB C 3.016 2.297 -4.474 1.00 . A A . 27 THR CB 1 1 1 193 1 1 24 THR CG2 C 3.343 0.812 -4.528 1.00 . A A . 27 THR CG2 1 1 1 194 1 1 24 THR H H 5.423 1.781 -3.305 1.00 . A A . 27 THR H 1 1 1 195 1 1 24 THR HA H 3.534 4.031 -3.330 1.00 . A A . 27 THR HA 1 1 1 196 1 1 24 THR HB H 3.408 2.768 -5.363 1.00 . A A . 27 THR HB 1 1 1 197 1 1 24 THR HG1 H 1.382 3.249 -3.912 1.00 . A A . 27 THR HG1 1 1 1 198 1 1 24 THR HG21 H 3.023 0.339 -3.611 1.00 . A A . 27 THR HG21 1 1 1 199 1 1 24 THR HG22 H 4.408 0.682 -4.647 1.00 . A A . 27 THR HG22 1 1 1 200 1 1 24 THR HG23 H 2.828 0.361 -5.364 1.00 . A A . 27 THR HG23 1 1 1 201 1 1 24 THR N N 5.094 2.696 -3.183 1.00 . A A . 27 THR N 1 1 1 202 1 1 24 THR O O 3.118 1.345 -1.550 1.00 . A A . 27 THR O 1 1 1 203 1 1 24 THR OG1 O 1.595 2.476 -4.439 1.00 . A A . 27 THR OG1 1 1 1 204 1 1 25 TYR C C -0.069 2.789 -0.574 1.00 . A A . 28 TYR C 1 1 1 205 1 1 25 TYR CA C 1.377 3.047 -0.209 1.00 . A A . 28 TYR CA 1 1 1 206 1 1 25 TYR CB C 1.444 4.197 0.802 1.00 . A A . 28 TYR CB 1 1 1 207 1 1 25 TYR CD1 C 1.093 6.329 -0.504 1.00 . A A . 28 TYR CD1 1 1 1 208 1 1 25 TYR CD2 C -0.647 5.606 0.949 1.00 . A A . 28 TYR CD2 1 1 1 209 1 1 25 TYR CE1 C 0.339 7.428 -0.869 1.00 . A A . 28 TYR CE1 1 1 1 210 1 1 25 TYR CE2 C -1.408 6.703 0.592 1.00 . A A . 28 TYR CE2 1 1 1 211 1 1 25 TYR CG C 0.615 5.401 0.408 1.00 . A A . 28 TYR CG 1 1 1 212 1 1 25 TYR CZ C -0.911 7.610 -0.317 1.00 . A A . 28 TYR CZ 1 1 1 213 1 1 25 TYR H H 2.045 4.260 -1.810 1.00 . A A . 28 TYR H 1 1 1 214 1 1 25 TYR HA H 1.798 2.156 0.232 1.00 . A A . 28 TYR HA 1 1 1 215 1 1 25 TYR HB2 H 1.084 3.847 1.758 1.00 . A A . 28 TYR HB2 1 1 1 216 1 1 25 TYR HB3 H 2.468 4.518 0.906 1.00 . A A . 28 TYR HB3 1 1 1 217 1 1 25 TYR HD1 H 2.073 6.186 -0.935 1.00 . A A . 28 TYR HD1 1 1 1 218 1 1 25 TYR HD2 H -1.036 4.893 1.663 1.00 . A A . 28 TYR HD2 1 1 1 219 1 1 25 TYR HE1 H 0.731 8.140 -1.582 1.00 . A A . 28 TYR HE1 1 1 1 220 1 1 25 TYR HE2 H -2.387 6.845 1.025 1.00 . A A . 28 TYR HE2 1 1 1 221 1 1 25 TYR HH H -2.053 9.096 0.107 1.00 . A A . 28 TYR HH 1 1 1 222 1 1 25 TYR N N 2.135 3.368 -1.412 1.00 . A A . 28 TYR N 1 1 1 223 1 1 25 TYR O O -0.564 3.339 -1.551 1.00 . A A . 28 TYR O 1 1 1 224 1 1 25 TYR OH O -1.665 8.703 -0.678 1.00 . A A . 28 TYR OH 1 1 1 225 1 1 26 TYR C C -3.031 2.470 0.909 1.00 . A A . 29 TYR C 1 1 1 226 1 1 26 TYR CA C -2.143 1.666 -0.026 1.00 . A A . 29 TYR CA 1 1 1 227 1 1 26 TYR CB C -2.413 0.171 0.166 1.00 . A A . 29 TYR CB 1 1 1 228 1 1 26 TYR CD1 C -0.183 -0.962 0.534 1.00 . A A . 29 TYR CD1 1 1 1 229 1 1 26 TYR CD2 C -1.313 -1.349 -1.528 1.00 . A A . 29 TYR CD2 1 1 1 230 1 1 26 TYR CE1 C 0.851 -1.786 0.127 1.00 . A A . 29 TYR CE1 1 1 1 231 1 1 26 TYR CE2 C -0.284 -2.173 -1.943 1.00 . A A . 29 TYR CE2 1 1 1 232 1 1 26 TYR CG C -1.281 -0.729 -0.286 1.00 . A A . 29 TYR CG 1 1 1 233 1 1 26 TYR CZ C 0.794 -2.387 -1.112 1.00 . A A . 29 TYR CZ 1 1 1 234 1 1 26 TYR H H -0.307 1.601 1.014 1.00 . A A . 29 TYR H 1 1 1 235 1 1 26 TYR HA H -2.367 1.941 -1.046 1.00 . A A . 29 TYR HA 1 1 1 236 1 1 26 TYR HB2 H -2.591 -0.019 1.207 1.00 . A A . 29 TYR HB2 1 1 1 237 1 1 26 TYR HB3 H -3.295 -0.100 -0.394 1.00 . A A . 29 TYR HB3 1 1 1 238 1 1 26 TYR HD1 H -0.141 -0.489 1.504 1.00 . A A . 29 TYR HD1 1 1 1 239 1 1 26 TYR HD2 H -2.159 -1.178 -2.178 1.00 . A A . 29 TYR HD2 1 1 1 240 1 1 26 TYR HE1 H 1.695 -1.955 0.778 1.00 . A A . 29 TYR HE1 1 1 1 241 1 1 26 TYR HE2 H -0.328 -2.644 -2.913 1.00 . A A . 29 TYR HE2 1 1 1 242 1 1 26 TYR HH H 2.053 -3.810 -0.812 1.00 . A A . 29 TYR HH 1 1 1 243 1 1 26 TYR N N -0.749 1.984 0.230 1.00 . A A . 29 TYR N 1 1 1 244 1 1 26 TYR O O -2.911 2.380 2.133 1.00 . A A . 29 TYR O 1 1 1 245 1 1 26 TYR OH O 1.821 -3.208 -1.523 1.00 . A A . 29 TYR OH 1 1 1 246 1 1 27 TYR C C -6.224 3.522 1.085 1.00 . A A . 30 TYR C 1 1 1 247 1 1 27 TYR CA C -4.817 4.102 1.086 1.00 . A A . 30 TYR CA 1 1 1 248 1 1 27 TYR CB C -4.821 5.526 0.514 1.00 . A A . 30 TYR CB 1 1 1 249 1 1 27 TYR CD1 C -6.521 6.606 2.050 1.00 . A A . 30 TYR CD1 1 1 1 250 1 1 27 TYR CD2 C -6.890 6.723 -0.302 1.00 . A A . 30 TYR CD2 1 1 1 251 1 1 27 TYR CE1 C -7.688 7.312 2.272 1.00 . A A . 30 TYR CE1 1 1 1 252 1 1 27 TYR CE2 C -8.058 7.430 -0.088 1.00 . A A . 30 TYR CE2 1 1 1 253 1 1 27 TYR CG C -6.102 6.299 0.761 1.00 . A A . 30 TYR CG 1 1 1 254 1 1 27 TYR CZ C -8.453 7.721 1.200 1.00 . A A . 30 TYR CZ 1 1 1 255 1 1 27 TYR H H -3.952 3.289 -0.656 1.00 . A A . 30 TYR H 1 1 1 256 1 1 27 TYR HA H -4.456 4.136 2.103 1.00 . A A . 30 TYR HA 1 1 1 257 1 1 27 TYR HB2 H -4.013 6.084 0.961 1.00 . A A . 30 TYR HB2 1 1 1 258 1 1 27 TYR HB3 H -4.662 5.475 -0.555 1.00 . A A . 30 TYR HB3 1 1 1 259 1 1 27 TYR HD1 H -5.921 6.285 2.887 1.00 . A A . 30 TYR HD1 1 1 1 260 1 1 27 TYR HD2 H -6.579 6.492 -1.311 1.00 . A A . 30 TYR HD2 1 1 1 261 1 1 27 TYR HE1 H -7.997 7.542 3.282 1.00 . A A . 30 TYR HE1 1 1 1 262 1 1 27 TYR HE2 H -8.656 7.750 -0.929 1.00 . A A . 30 TYR HE2 1 1 1 263 1 1 27 TYR HH H -10.310 8.076 0.853 1.00 . A A . 30 TYR HH 1 1 1 264 1 1 27 TYR N N -3.911 3.266 0.321 1.00 . A A . 30 TYR N 1 1 1 265 1 1 27 TYR O O -6.921 3.549 0.069 1.00 . A A . 30 TYR O 1 1 1 266 1 1 27 TYR OH O -9.615 8.425 1.417 1.00 . A A . 30 TYR OH 1 1 1 267 1 1 28 ASN C C -8.958 3.565 2.330 1.00 . A A . 31 ASN C 1 1 1 268 1 1 28 ASN CA C -7.959 2.428 2.368 1.00 . A A . 31 ASN CA 1 1 1 269 1 1 28 ASN CB C -8.078 1.659 3.687 1.00 . A A . 31 ASN CB 1 1 1 270 1 1 28 ASN CG C -9.195 0.630 3.676 1.00 . A A . 31 ASN CG 1 1 1 271 1 1 28 ASN H H -6.039 3.007 3.003 1.00 . A A . 31 ASN H 1 1 1 272 1 1 28 ASN HA H -8.138 1.762 1.537 1.00 . A A . 31 ASN HA 1 1 1 273 1 1 28 ASN HB2 H -7.148 1.147 3.881 1.00 . A A . 31 ASN HB2 1 1 1 274 1 1 28 ASN HB3 H -8.269 2.360 4.487 1.00 . A A . 31 ASN HB3 1 1 1 275 1 1 28 ASN HD21 H -10.171 1.651 2.280 1.00 . A A . 31 ASN HD21 1 1 1 276 1 1 28 ASN HD22 H -10.933 0.199 2.816 1.00 . A A . 31 ASN HD22 1 1 1 277 1 1 28 ASN N N -6.634 2.994 2.230 1.00 . A A . 31 ASN N 1 1 1 278 1 1 28 ASN ND2 N -10.202 0.848 2.838 1.00 . A A . 31 ASN ND2 1 1 1 279 1 1 28 ASN O O -9.022 4.356 3.264 1.00 . A A . 31 ASN O 1 1 1 280 1 1 28 ASN OD1 O -9.150 -0.356 4.412 1.00 . A A . 31 ASN OD1 1 1 1 281 1 1 29 THR C C -11.716 4.757 2.172 1.00 . A A . 32 THR C 1 1 1 282 1 1 29 THR CA C -10.689 4.720 1.044 1.00 . A A . 32 THR CA 1 1 1 283 1 1 29 THR CB C -11.431 4.564 -0.296 1.00 . A A . 32 THR CB 1 1 1 284 1 1 29 THR CG2 C -10.465 4.683 -1.465 1.00 . A A . 32 THR CG2 1 1 1 285 1 1 29 THR H H -9.564 3.007 0.507 1.00 . A A . 32 THR H 1 1 1 286 1 1 29 THR HA H -10.163 5.663 1.025 1.00 . A A . 32 THR HA 1 1 1 287 1 1 29 THR HB H -12.169 5.348 -0.375 1.00 . A A . 32 THR HB 1 1 1 288 1 1 29 THR HG1 H -11.658 2.684 0.256 1.00 . A A . 32 THR HG1 1 1 1 289 1 1 29 THR HG21 H -11.011 4.597 -2.393 1.00 . A A . 32 THR HG21 1 1 1 290 1 1 29 THR HG22 H -9.729 3.896 -1.407 1.00 . A A . 32 THR HG22 1 1 1 291 1 1 29 THR HG23 H -9.970 5.643 -1.427 1.00 . A A . 32 THR HG23 1 1 1 292 1 1 29 THR N N -9.698 3.662 1.227 1.00 . A A . 32 THR N 1 1 1 293 1 1 29 THR O O -11.929 5.798 2.793 1.00 . A A . 32 THR O 1 1 1 294 1 1 29 THR OG1 O -12.092 3.293 -0.344 1.00 . A A . 32 THR OG1 1 1 1 295 1 1 30 GLU C C -12.768 3.718 4.862 1.00 . A A . 33 GLU C 1 1 1 296 1 1 30 GLU CA C -13.370 3.537 3.474 1.00 . A A . 33 GLU CA 1 1 1 297 1 1 30 GLU CB C -14.088 2.192 3.380 1.00 . A A . 33 GLU CB 1 1 1 298 1 1 30 GLU CD C -15.728 0.573 4.422 1.00 . A A . 33 GLU CD 1 1 1 299 1 1 30 GLU CG C -14.960 1.871 4.585 1.00 . A A . 33 GLU CG 1 1 1 300 1 1 30 GLU H H -12.140 2.817 1.916 1.00 . A A . 33 GLU H 1 1 1 301 1 1 30 GLU HA H -14.082 4.322 3.306 1.00 . A A . 33 GLU HA 1 1 1 302 1 1 30 GLU HB2 H -14.715 2.193 2.501 1.00 . A A . 33 GLU HB2 1 1 1 303 1 1 30 GLU HB3 H -13.345 1.415 3.278 1.00 . A A . 33 GLU HB3 1 1 1 304 1 1 30 GLU HG2 H -14.330 1.789 5.458 1.00 . A A . 33 GLU HG2 1 1 1 305 1 1 30 GLU HG3 H -15.666 2.676 4.726 1.00 . A A . 33 GLU HG3 1 1 1 306 1 1 30 GLU N N -12.357 3.622 2.433 1.00 . A A . 33 GLU N 1 1 1 307 1 1 30 GLU O O -13.095 4.665 5.578 1.00 . A A . 33 GLU O 1 1 1 308 1 1 30 GLU OE1 O -16.686 0.547 3.621 1.00 . A A . 33 GLU OE1 1 1 1 309 1 1 30 GLU OE2 O -15.373 -0.415 5.098 1.00 . A A . 33 GLU OE2 1 1 1 310 1 1 31 THR C C -10.411 4.095 6.731 1.00 . A A . 34 THR C 1 1 1 311 1 1 31 THR CA C -11.241 2.828 6.533 1.00 . A A . 34 THR CA 1 1 1 312 1 1 31 THR CB C -10.331 1.598 6.725 1.00 . A A . 34 THR CB 1 1 1 313 1 1 31 THR CG2 C -9.685 1.606 8.102 1.00 . A A . 34 THR CG2 1 1 1 314 1 1 31 THR H H -11.678 2.081 4.602 1.00 . A A . 34 THR H 1 1 1 315 1 1 31 THR HA H -12.013 2.793 7.287 1.00 . A A . 34 THR HA 1 1 1 316 1 1 31 THR HB H -9.550 1.629 5.978 1.00 . A A . 34 THR HB 1 1 1 317 1 1 31 THR HG1 H -11.206 0.217 5.621 1.00 . A A . 34 THR HG1 1 1 1 318 1 1 31 THR HG21 H -10.453 1.633 8.860 1.00 . A A . 34 THR HG21 1 1 1 319 1 1 31 THR HG22 H -9.053 2.476 8.198 1.00 . A A . 34 THR HG22 1 1 1 320 1 1 31 THR HG23 H -9.089 0.713 8.225 1.00 . A A . 34 THR HG23 1 1 1 321 1 1 31 THR N N -11.892 2.799 5.229 1.00 . A A . 34 THR N 1 1 1 322 1 1 31 THR O O -10.349 4.634 7.836 1.00 . A A . 34 THR O 1 1 1 323 1 1 31 THR OG1 O -11.091 0.396 6.557 1.00 . A A . 34 THR OG1 1 1 1 324 1 1 32 LYS C C -7.581 5.348 6.251 1.00 . A A . 35 LYS C 1 1 1 325 1 1 32 LYS CA C -8.913 5.733 5.670 1.00 . A A . 35 LYS CA 1 1 1 326 1 1 32 LYS CB C -9.546 6.890 6.452 1.00 . A A . 35 LYS CB 1 1 1 327 1 1 32 LYS CD C -11.480 8.460 6.743 1.00 . A A . 35 LYS CD 1 1 1 328 1 1 32 LYS CE C -12.820 8.922 6.195 1.00 . A A . 35 LYS CE 1 1 1 329 1 1 32 LYS CG C -10.930 7.280 5.959 1.00 . A A . 35 LYS CG 1 1 1 330 1 1 32 LYS H H -9.811 4.026 4.829 1.00 . A A . 35 LYS H 1 1 1 331 1 1 32 LYS HA H -8.752 6.035 4.643 1.00 . A A . 35 LYS HA 1 1 1 332 1 1 32 LYS HB2 H -9.625 6.608 7.491 1.00 . A A . 35 LYS HB2 1 1 1 333 1 1 32 LYS HB3 H -8.905 7.756 6.374 1.00 . A A . 35 LYS HB3 1 1 1 334 1 1 32 LYS HD2 H -11.606 8.166 7.774 1.00 . A A . 35 LYS HD2 1 1 1 335 1 1 32 LYS HD3 H -10.775 9.277 6.685 1.00 . A A . 35 LYS HD3 1 1 1 336 1 1 32 LYS HE2 H -13.519 8.101 6.250 1.00 . A A . 35 LYS HE2 1 1 1 337 1 1 32 LYS HE3 H -13.179 9.741 6.799 1.00 . A A . 35 LYS HE3 1 1 1 338 1 1 32 LYS HG2 H -10.868 7.551 4.916 1.00 . A A . 35 LYS HG2 1 1 1 339 1 1 32 LYS HG3 H -11.596 6.439 6.078 1.00 . A A . 35 LYS HG3 1 1 1 340 1 1 32 LYS HZ1 H -13.643 9.688 4.435 1.00 . A A . 35 LYS HZ1 1 1 1 341 1 1 32 LYS HZ2 H -12.382 8.591 4.179 1.00 . A A . 35 LYS HZ2 1 1 1 342 1 1 32 LYS HZ3 H -12.042 10.161 4.705 1.00 . A A . 35 LYS HZ3 1 1 1 343 1 1 32 LYS N N -9.760 4.543 5.654 1.00 . A A . 35 LYS N 1 1 1 344 1 1 32 LYS NZ N -12.714 9.372 4.779 1.00 . A A . 35 LYS NZ 1 1 1 345 1 1 32 LYS O O -7.040 6.015 7.133 1.00 . A A . 35 LYS O 1 1 1 346 1 1 33 GLN C C -4.733 3.765 5.099 1.00 . A A . 36 GLN C 1 1 1 347 1 1 33 GLN CA C -5.785 3.726 6.196 1.00 . A A . 36 GLN CA 1 1 1 348 1 1 33 GLN CB C -5.952 2.297 6.710 1.00 . A A . 36 GLN CB 1 1 1 349 1 1 33 GLN CD C -4.172 2.568 8.482 1.00 . A A . 36 GLN CD 1 1 1 350 1 1 33 GLN CG C -4.690 1.723 7.334 1.00 . A A . 36 GLN CG 1 1 1 351 1 1 33 GLN H H -7.547 3.790 4.999 1.00 . A A . 36 GLN H 1 1 1 352 1 1 33 GLN HA H -5.455 4.351 7.012 1.00 . A A . 36 GLN HA 1 1 1 353 1 1 33 GLN HB2 H -6.735 2.283 7.454 1.00 . A A . 36 GLN HB2 1 1 1 354 1 1 33 GLN HB3 H -6.239 1.666 5.885 1.00 . A A . 36 GLN HB3 1 1 1 355 1 1 33 GLN HE21 H -3.102 3.670 7.218 1.00 . A A . 36 GLN HE21 1 1 1 356 1 1 33 GLN HE22 H -2.983 4.111 8.884 1.00 . A A . 36 GLN HE22 1 1 1 357 1 1 33 GLN HG2 H -4.906 0.733 7.706 1.00 . A A . 36 GLN HG2 1 1 1 358 1 1 33 GLN HG3 H -3.925 1.664 6.574 1.00 . A A . 36 GLN HG3 1 1 1 359 1 1 33 GLN N N -7.060 4.249 5.730 1.00 . A A . 36 GLN N 1 1 1 360 1 1 33 GLN NE2 N -3.334 3.549 8.162 1.00 . A A . 36 GLN NE2 1 1 1 361 1 1 33 GLN O O -4.708 2.921 4.206 1.00 . A A . 36 GLN O 1 1 1 362 1 1 33 GLN OE1 O -4.523 2.346 9.640 1.00 . A A . 36 GLN OE1 1 1 1 363 1 1 34 SER C C -1.443 4.435 4.828 1.00 . A A . 37 SER C 1 1 1 364 1 1 34 SER CA C -2.770 4.914 4.236 1.00 . A A . 37 SER CA 1 1 1 365 1 1 34 SER CB C -2.647 6.384 3.832 1.00 . A A . 37 SER CB 1 1 1 366 1 1 34 SER H H -3.949 5.381 5.933 1.00 . A A . 37 SER H 1 1 1 367 1 1 34 SER HA H -3.012 4.324 3.362 1.00 . A A . 37 SER HA 1 1 1 368 1 1 34 SER HB2 H -2.496 6.986 4.715 1.00 . A A . 37 SER HB2 1 1 1 369 1 1 34 SER HB3 H -1.804 6.503 3.168 1.00 . A A . 37 SER HB3 1 1 1 370 1 1 34 SER HG H -3.933 7.773 3.334 1.00 . A A . 37 SER HG 1 1 1 371 1 1 34 SER N N -3.852 4.743 5.201 1.00 . A A . 37 SER N 1 1 1 372 1 1 34 SER O O -0.879 5.084 5.708 1.00 . A A . 37 SER O 1 1 1 373 1 1 34 SER OG O -3.815 6.835 3.171 1.00 . A A . 37 SER OG 1 1 1 374 1 1 35 THR C C 0.827 1.644 3.903 1.00 . A A . 38 THR C 1 1 1 375 1 1 35 THR CA C 0.305 2.730 4.841 1.00 . A A . 38 THR CA 1 1 1 376 1 1 35 THR CB C 0.128 2.134 6.251 1.00 . A A . 38 THR CB 1 1 1 377 1 1 35 THR CG2 C -0.991 1.103 6.268 1.00 . A A . 38 THR CG2 1 1 1 378 1 1 35 THR H H -1.437 2.823 3.635 1.00 . A A . 38 THR H 1 1 1 379 1 1 35 THR HA H 1.035 3.525 4.896 1.00 . A A . 38 THR HA 1 1 1 380 1 1 35 THR HB H -0.128 2.933 6.932 1.00 . A A . 38 THR HB 1 1 1 381 1 1 35 THR HG1 H 1.152 0.768 7.241 1.00 . A A . 38 THR HG1 1 1 1 382 1 1 35 THR HG21 H -1.100 0.707 7.266 1.00 . A A . 38 THR HG21 1 1 1 383 1 1 35 THR HG22 H -0.752 0.300 5.586 1.00 . A A . 38 THR HG22 1 1 1 384 1 1 35 THR HG23 H -1.915 1.571 5.962 1.00 . A A . 38 THR HG23 1 1 1 385 1 1 35 THR N N -0.947 3.297 4.342 1.00 . A A . 38 THR N 1 1 1 386 1 1 35 THR O O 0.119 1.213 2.994 1.00 . A A . 38 THR O 1 1 1 387 1 1 35 THR OG1 O 1.350 1.525 6.685 1.00 . A A . 38 THR OG1 1 1 1 388 1 1 36 TRP C C 2.513 -1.189 4.009 1.00 . A A . 39 TRP C 1 1 1 389 1 1 36 TRP CA C 2.642 0.150 3.288 1.00 . A A . 39 TRP CA 1 1 1 390 1 1 36 TRP CB C 4.133 0.401 3.001 1.00 . A A . 39 TRP CB 1 1 1 391 1 1 36 TRP CD1 C 5.029 2.355 4.348 1.00 . A A . 39 TRP CD1 1 1 1 392 1 1 36 TRP CD2 C 4.766 2.802 2.178 1.00 . A A . 39 TRP CD2 1 1 1 393 1 1 36 TRP CE2 C 5.273 3.951 2.810 1.00 . A A . 39 TRP CE2 1 1 1 394 1 1 36 TRP CE3 C 4.522 2.840 0.808 1.00 . A A . 39 TRP CE3 1 1 1 395 1 1 36 TRP CG C 4.608 1.802 3.186 1.00 . A A . 39 TRP CG 1 1 1 396 1 1 36 TRP CH2 C 5.295 5.133 0.771 1.00 . A A . 39 TRP CH2 1 1 1 397 1 1 36 TRP CZ2 C 5.543 5.123 2.113 1.00 . A A . 39 TRP CZ2 1 1 1 398 1 1 36 TRP CZ3 C 4.788 4.006 0.117 1.00 . A A . 39 TRP CZ3 1 1 1 399 1 1 36 TRP H H 2.594 1.580 4.856 1.00 . A A . 39 TRP H 1 1 1 400 1 1 36 TRP HA H 2.093 0.111 2.358 1.00 . A A . 39 TRP HA 1 1 1 401 1 1 36 TRP HB2 H 4.718 -0.206 3.673 1.00 . A A . 39 TRP HB2 1 1 1 402 1 1 36 TRP HB3 H 4.351 0.114 1.983 1.00 . A A . 39 TRP HB3 1 1 1 403 1 1 36 TRP HD1 H 5.038 1.831 5.286 1.00 . A A . 39 TRP HD1 1 1 1 404 1 1 36 TRP HE1 H 5.762 4.267 4.826 1.00 . A A . 39 TRP HE1 1 1 1 405 1 1 36 TRP HE3 H 4.131 1.980 0.285 1.00 . A A . 39 TRP HE3 1 1 1 406 1 1 36 TRP HH2 H 5.490 6.023 0.191 1.00 . A A . 39 TRP HH2 1 1 1 407 1 1 36 TRP HZ2 H 5.941 5.996 2.598 1.00 . A A . 39 TRP HZ2 1 1 1 408 1 1 36 TRP HZ3 H 4.604 4.056 -0.945 1.00 . A A . 39 TRP HZ3 1 1 1 409 1 1 36 TRP N N 2.065 1.198 4.125 1.00 . A A . 39 TRP N 1 1 1 410 1 1 36 TRP NE1 N 5.425 3.655 4.138 1.00 . A A . 39 TRP NE1 1 1 1 411 1 1 36 TRP O O 3.284 -1.489 4.922 1.00 . A A . 39 TRP O 1 1 1 412 1 1 37 GLU C C 0.326 -4.115 3.365 1.00 . A A . 40 GLU C 1 1 1 413 1 1 37 GLU CA C 1.290 -3.287 4.210 1.00 . A A . 40 GLU CA 1 1 1 414 1 1 37 GLU CB C 0.726 -3.094 5.624 1.00 . A A . 40 GLU CB 1 1 1 415 1 1 37 GLU CD C -1.314 -2.891 7.102 1.00 . A A . 40 GLU CD 1 1 1 416 1 1 37 GLU CG C -0.795 -3.086 5.691 1.00 . A A . 40 GLU CG 1 1 1 417 1 1 37 GLU H H 0.972 -1.712 2.839 1.00 . A A . 40 GLU H 1 1 1 418 1 1 37 GLU HA H 2.234 -3.808 4.275 1.00 . A A . 40 GLU HA 1 1 1 419 1 1 37 GLU HB2 H 1.088 -3.890 6.256 1.00 . A A . 40 GLU HB2 1 1 1 420 1 1 37 GLU HB3 H 1.082 -2.148 6.010 1.00 . A A . 40 GLU HB3 1 1 1 421 1 1 37 GLU HG2 H -1.165 -2.284 5.072 1.00 . A A . 40 GLU HG2 1 1 1 422 1 1 37 GLU HG3 H -1.163 -4.029 5.315 1.00 . A A . 40 GLU HG3 1 1 1 423 1 1 37 GLU N N 1.534 -1.991 3.592 1.00 . A A . 40 GLU N 1 1 1 424 1 1 37 GLU O O -0.332 -3.588 2.470 1.00 . A A . 40 GLU O 1 1 1 425 1 1 37 GLU OE1 O -1.342 -1.734 7.570 1.00 . A A . 40 GLU OE1 1 1 1 426 1 1 37 GLU OE2 O -1.695 -3.897 7.738 1.00 . A A . 40 GLU OE2 1 1 1 427 1 1 38 LYS C C -2.094 -5.945 3.229 1.00 . A A . 41 LYS C 1 1 1 428 1 1 38 LYS CA C -0.633 -6.312 2.956 1.00 . A A . 41 LYS CA 1 1 1 429 1 1 38 LYS CB C -0.368 -7.745 3.419 1.00 . A A . 41 LYS CB 1 1 1 430 1 1 38 LYS CD C 1.204 -9.387 4.513 1.00 . A A . 41 LYS CD 1 1 1 431 1 1 38 LYS CE C 1.629 -10.065 3.221 1.00 . A A . 41 LYS CE 1 1 1 432 1 1 38 LYS CG C 0.864 -7.918 4.299 1.00 . A A . 41 LYS CG 1 1 1 433 1 1 38 LYS H H 0.811 -5.773 4.354 1.00 . A A . 41 LYS H 1 1 1 434 1 1 38 LYS HA H -0.431 -6.235 1.900 1.00 . A A . 41 LYS HA 1 1 1 435 1 1 38 LYS HB2 H -1.219 -8.082 3.979 1.00 . A A . 41 LYS HB2 1 1 1 436 1 1 38 LYS HB3 H -0.247 -8.363 2.553 1.00 . A A . 41 LYS HB3 1 1 1 437 1 1 38 LYS HD2 H 2.012 -9.457 5.226 1.00 . A A . 41 LYS HD2 1 1 1 438 1 1 38 LYS HD3 H 0.333 -9.893 4.906 1.00 . A A . 41 LYS HD3 1 1 1 439 1 1 38 LYS HE2 H 0.805 -10.030 2.524 1.00 . A A . 41 LYS HE2 1 1 1 440 1 1 38 LYS HE3 H 2.471 -9.530 2.808 1.00 . A A . 41 LYS HE3 1 1 1 441 1 1 38 LYS HG2 H 1.703 -7.429 3.828 1.00 . A A . 41 LYS HG2 1 1 1 442 1 1 38 LYS HG3 H 0.673 -7.463 5.260 1.00 . A A . 41 LYS HG3 1 1 1 443 1 1 38 LYS HZ1 H 1.224 -12.013 3.859 1.00 . A A . 41 LYS HZ1 1 1 1 444 1 1 38 LYS HZ2 H 2.833 -11.540 4.083 1.00 . A A . 41 LYS HZ2 1 1 1 445 1 1 38 LYS HZ3 H 2.274 -11.930 2.534 1.00 . A A . 41 LYS HZ3 1 1 1 446 1 1 38 LYS N N 0.251 -5.410 3.655 1.00 . A A . 41 LYS N 1 1 1 447 1 1 38 LYS NZ N 2.017 -11.486 3.440 1.00 . A A . 41 LYS NZ 1 1 1 448 1 1 38 LYS O O -2.596 -6.177 4.328 1.00 . A A . 41 LYS O 1 1 1 449 1 1 39 PRO C C -5.158 -6.146 2.240 1.00 . A A . 42 PRO C 1 1 1 450 1 1 39 PRO CA C -4.199 -4.968 2.389 1.00 . A A . 42 PRO CA 1 1 1 451 1 1 39 PRO CB C -4.420 -3.954 1.252 1.00 . A A . 42 PRO CB 1 1 1 452 1 1 39 PRO CD C -2.306 -5.045 0.897 1.00 . A A . 42 PRO CD 1 1 1 453 1 1 39 PRO CG C -3.111 -3.830 0.538 1.00 . A A . 42 PRO CG 1 1 1 454 1 1 39 PRO HA H -4.367 -4.485 3.340 1.00 . A A . 42 PRO HA 1 1 1 455 1 1 39 PRO HB2 H -5.193 -4.319 0.591 1.00 . A A . 42 PRO HB2 1 1 1 456 1 1 39 PRO HB3 H -4.725 -3.009 1.674 1.00 . A A . 42 PRO HB3 1 1 1 457 1 1 39 PRO HD2 H -2.505 -5.850 0.207 1.00 . A A . 42 PRO HD2 1 1 1 458 1 1 39 PRO HD3 H -1.252 -4.811 0.917 1.00 . A A . 42 PRO HD3 1 1 1 459 1 1 39 PRO HG2 H -3.277 -3.795 -0.528 1.00 . A A . 42 PRO HG2 1 1 1 460 1 1 39 PRO HG3 H -2.603 -2.935 0.866 1.00 . A A . 42 PRO HG3 1 1 1 461 1 1 39 PRO N N -2.799 -5.365 2.237 1.00 . A A . 42 PRO N 1 1 1 462 1 1 39 PRO O O -6.223 -6.019 1.634 1.00 . A A . 42 PRO O 1 1 2 463 1 1 12 SER C C -10.299 -1.322 -2.870 1.00 . A A . 15 SER C 1 1 2 464 1 1 12 SER CA C -10.097 -2.542 -3.759 1.00 . A A . 15 SER CA 1 1 2 465 1 1 12 SER CB C -11.323 -3.451 -3.684 1.00 . A A . 15 SER CB 1 1 2 466 1 1 12 SER H H -8.552 -3.140 -2.449 1.00 . A A . 15 SER H 1 1 2 467 1 1 12 SER HA H -9.958 -2.215 -4.779 1.00 . A A . 15 SER HA 1 1 2 468 1 1 12 SER HB2 H -11.395 -3.864 -2.689 1.00 . A A . 15 SER HB2 1 1 2 469 1 1 12 SER HB3 H -12.210 -2.876 -3.902 1.00 . A A . 15 SER HB3 1 1 2 470 1 1 12 SER HG H -10.626 -5.185 -4.272 1.00 . A A . 15 SER HG 1 1 2 471 1 1 12 SER N N -8.905 -3.274 -3.353 1.00 . A A . 15 SER N 1 1 2 472 1 1 12 SER O O -10.170 -0.182 -3.320 1.00 . A A . 15 SER O 1 1 2 473 1 1 12 SER OG O -11.228 -4.517 -4.612 1.00 . A A . 15 SER OG 1 1 2 474 1 1 13 MET C C -9.536 0.301 -0.454 1.00 . A A . 16 MET C 1 1 2 475 1 1 13 MET CA C -10.822 -0.497 -0.639 1.00 . A A . 16 MET CA 1 1 2 476 1 1 13 MET CB C -11.279 -1.070 0.707 1.00 . A A . 16 MET CB 1 1 2 477 1 1 13 MET CE C -12.905 -1.431 3.416 1.00 . A A . 16 MET CE 1 1 2 478 1 1 13 MET CG C -12.645 -1.738 0.658 1.00 . A A . 16 MET CG 1 1 2 479 1 1 13 MET H H -10.711 -2.501 -1.309 1.00 . A A . 16 MET H 1 1 2 480 1 1 13 MET HA H -11.589 0.158 -1.025 1.00 . A A . 16 MET HA 1 1 2 481 1 1 13 MET HB2 H -10.556 -1.801 1.039 1.00 . A A . 16 MET HB2 1 1 2 482 1 1 13 MET HB3 H -11.321 -0.268 1.427 1.00 . A A . 16 MET HB3 1 1 2 483 1 1 13 MET HE1 H -13.511 -0.584 3.132 1.00 . A A . 16 MET HE1 1 1 2 484 1 1 13 MET HE2 H -11.879 -1.120 3.532 1.00 . A A . 16 MET HE2 1 1 2 485 1 1 13 MET HE3 H -13.267 -1.830 4.352 1.00 . A A . 16 MET HE3 1 1 2 486 1 1 13 MET HG2 H -13.399 -0.974 0.546 1.00 . A A . 16 MET HG2 1 1 2 487 1 1 13 MET HG3 H -12.675 -2.401 -0.194 1.00 . A A . 16 MET HG3 1 1 2 488 1 1 13 MET N N -10.615 -1.572 -1.602 1.00 . A A . 16 MET N 1 1 2 489 1 1 13 MET O O -9.562 1.436 0.019 1.00 . A A . 16 MET O 1 1 2 490 1 1 13 MET SD S -13.010 -2.694 2.147 1.00 . A A . 16 MET SD 1 1 2 491 1 1 14 TRP C C -6.624 0.830 -2.077 1.00 . A A . 17 TRP C 1 1 2 492 1 1 14 TRP CA C -7.112 0.339 -0.723 1.00 . A A . 17 TRP CA 1 1 2 493 1 1 14 TRP CB C -6.080 -0.628 -0.136 1.00 . A A . 17 TRP CB 1 1 2 494 1 1 14 TRP CD1 C -7.505 -2.231 1.267 1.00 . A A . 17 TRP CD1 1 1 2 495 1 1 14 TRP CD2 C -5.970 -1.091 2.423 1.00 . A A . 17 TRP CD2 1 1 2 496 1 1 14 TRP CE2 C -6.671 -1.923 3.314 1.00 . A A . 17 TRP CE2 1 1 2 497 1 1 14 TRP CE3 C -4.952 -0.278 2.915 1.00 . A A . 17 TRP CE3 1 1 2 498 1 1 14 TRP CG C -6.520 -1.297 1.125 1.00 . A A . 17 TRP CG 1 1 2 499 1 1 14 TRP CH2 C -5.376 -1.155 5.132 1.00 . A A . 17 TRP CH2 1 1 2 500 1 1 14 TRP CZ2 C -6.382 -1.964 4.675 1.00 . A A . 17 TRP CZ2 1 1 2 501 1 1 14 TRP CZ3 C -4.663 -0.318 4.263 1.00 . A A . 17 TRP CZ3 1 1 2 502 1 1 14 TRP H H -8.468 -1.206 -1.224 1.00 . A A . 17 TRP H 1 1 2 503 1 1 14 TRP HA H -7.214 1.185 -0.066 1.00 . A A . 17 TRP HA 1 1 2 504 1 1 14 TRP HB2 H -5.859 -1.396 -0.856 1.00 . A A . 17 TRP HB2 1 1 2 505 1 1 14 TRP HB3 H -5.172 -0.080 0.082 1.00 . A A . 17 TRP HB3 1 1 2 506 1 1 14 TRP HD1 H -8.113 -2.603 0.456 1.00 . A A . 17 TRP HD1 1 1 2 507 1 1 14 TRP HE1 H -8.238 -3.266 2.941 1.00 . A A . 17 TRP HE1 1 1 2 508 1 1 14 TRP HE3 H -4.392 0.374 2.260 1.00 . A A . 17 TRP HE3 1 1 2 509 1 1 14 TRP HH2 H -5.116 -1.153 6.181 1.00 . A A . 17 TRP HH2 1 1 2 510 1 1 14 TRP HZ2 H -6.923 -2.604 5.356 1.00 . A A . 17 TRP HZ2 1 1 2 511 1 1 14 TRP HZ3 H -3.879 0.303 4.657 1.00 . A A . 17 TRP HZ3 1 1 2 512 1 1 14 TRP N N -8.415 -0.303 -0.844 1.00 . A A . 17 TRP N 1 1 2 513 1 1 14 TRP NE1 N -7.605 -2.611 2.583 1.00 . A A . 17 TRP NE1 1 1 2 514 1 1 14 TRP O O -6.771 0.142 -3.088 1.00 . A A . 17 TRP O 1 1 2 515 1 1 15 THR C C -4.004 2.519 -3.333 1.00 . A A . 18 THR C 1 1 2 516 1 1 15 THR CA C -5.527 2.602 -3.312 1.00 . A A . 18 THR CA 1 1 2 517 1 1 15 THR CB C -5.959 4.069 -3.461 1.00 . A A . 18 THR CB 1 1 2 518 1 1 15 THR CG2 C -7.474 4.180 -3.551 1.00 . A A . 18 THR CG2 1 1 2 519 1 1 15 THR H H -5.976 2.531 -1.257 1.00 . A A . 18 THR H 1 1 2 520 1 1 15 THR HA H -5.926 2.038 -4.143 1.00 . A A . 18 THR HA 1 1 2 521 1 1 15 THR HB H -5.530 4.462 -4.366 1.00 . A A . 18 THR HB 1 1 2 522 1 1 15 THR HG1 H -5.044 4.256 -1.724 1.00 . A A . 18 THR HG1 1 1 2 523 1 1 15 THR HG21 H -7.751 5.213 -3.697 1.00 . A A . 18 THR HG21 1 1 2 524 1 1 15 THR HG22 H -7.916 3.814 -2.636 1.00 . A A . 18 THR HG22 1 1 2 525 1 1 15 THR HG23 H -7.829 3.591 -4.383 1.00 . A A . 18 THR HG23 1 1 2 526 1 1 15 THR N N -6.047 2.023 -2.090 1.00 . A A . 18 THR N 1 1 2 527 1 1 15 THR O O -3.343 2.879 -2.361 1.00 . A A . 18 THR O 1 1 2 528 1 1 15 THR OG1 O -5.485 4.836 -2.348 1.00 . A A . 18 THR OG1 1 1 2 529 1 1 16 GLU C C -1.408 3.032 -5.426 1.00 . A A . 19 GLU C 1 1 2 530 1 1 16 GLU CA C -2.008 1.907 -4.585 1.00 . A A . 19 GLU CA 1 1 2 531 1 1 16 GLU CB C -1.685 0.554 -5.225 1.00 . A A . 19 GLU CB 1 1 2 532 1 1 16 GLU CD C 0.075 -0.966 -6.211 1.00 . A A . 19 GLU CD 1 1 2 533 1 1 16 GLU CG C -0.204 0.335 -5.486 1.00 . A A . 19 GLU CG 1 1 2 534 1 1 16 GLU H H -4.036 1.800 -5.192 1.00 . A A . 19 GLU H 1 1 2 535 1 1 16 GLU HA H -1.574 1.940 -3.597 1.00 . A A . 19 GLU HA 1 1 2 536 1 1 16 GLU HB2 H -2.032 -0.232 -4.572 1.00 . A A . 19 GLU HB2 1 1 2 537 1 1 16 GLU HB3 H -2.207 0.482 -6.168 1.00 . A A . 19 GLU HB3 1 1 2 538 1 1 16 GLU HG2 H 0.166 1.151 -6.088 1.00 . A A . 19 GLU HG2 1 1 2 539 1 1 16 GLU HG3 H 0.317 0.323 -4.539 1.00 . A A . 19 GLU HG3 1 1 2 540 1 1 16 GLU N N -3.455 2.057 -4.447 1.00 . A A . 19 GLU N 1 1 2 541 1 1 16 GLU O O -1.626 3.100 -6.636 1.00 . A A . 19 GLU O 1 1 2 542 1 1 16 GLU OE1 O 0.216 -2.006 -5.533 1.00 . A A . 19 GLU OE1 1 1 2 543 1 1 16 GLU OE2 O 0.154 -0.946 -7.457 1.00 . A A . 19 GLU OE2 1 1 2 544 1 1 17 HIS C C 1.335 5.385 -4.819 1.00 . A A . 20 HIS C 1 1 2 545 1 1 17 HIS CA C -0.005 5.036 -5.463 1.00 . A A . 20 HIS CA 1 1 2 546 1 1 17 HIS CB C -0.911 6.270 -5.437 1.00 . A A . 20 HIS CB 1 1 2 547 1 1 17 HIS CD2 C -3.462 5.821 -5.301 1.00 . A A . 20 HIS CD2 1 1 2 548 1 1 17 HIS CE1 C -3.886 5.721 -7.451 1.00 . A A . 20 HIS CE1 1 1 2 549 1 1 17 HIS CG C -2.293 6.022 -5.957 1.00 . A A . 20 HIS CG 1 1 2 550 1 1 17 HIS H H -0.507 3.800 -3.805 1.00 . A A . 20 HIS H 1 1 2 551 1 1 17 HIS HA H 0.165 4.745 -6.489 1.00 . A A . 20 HIS HA 1 1 2 552 1 1 17 HIS HB2 H -1.000 6.619 -4.420 1.00 . A A . 20 HIS HB2 1 1 2 553 1 1 17 HIS HB3 H -0.462 7.045 -6.040 1.00 . A A . 20 HIS HB3 1 1 2 554 1 1 17 HIS HD1 H -1.955 6.061 -8.037 1.00 . A A . 20 HIS HD1 1 1 2 555 1 1 17 HIS HD2 H -3.602 5.810 -4.229 1.00 . A A . 20 HIS HD2 1 1 2 556 1 1 17 HIS HE1 H -4.404 5.616 -8.393 1.00 . A A . 20 HIS HE1 1 1 2 557 1 1 17 HIS HE2 H -5.392 5.528 -6.076 1.00 . A A . 20 HIS HE2 1 1 2 558 1 1 17 HIS N N -0.644 3.912 -4.774 1.00 . A A . 20 HIS N 1 1 2 559 1 1 17 HIS ND1 N -2.594 5.953 -7.301 1.00 . A A . 20 HIS ND1 1 1 2 560 1 1 17 HIS NE2 N -4.435 5.636 -6.253 1.00 . A A . 20 HIS NE2 1 1 2 561 1 1 17 HIS O O 1.502 5.235 -3.611 1.00 . A A . 20 HIS O 1 1 2 562 1 1 18 LYS C C 3.504 7.122 -3.902 1.00 . A A . 21 LYS C 1 1 2 563 1 1 18 LYS CA C 3.606 6.225 -5.129 1.00 . A A . 21 LYS CA 1 1 2 564 1 1 18 LYS CB C 4.410 6.921 -6.223 1.00 . A A . 21 LYS CB 1 1 2 565 1 1 18 LYS CD C 4.712 6.577 -8.692 1.00 . A A . 21 LYS CD 1 1 2 566 1 1 18 LYS CE C 5.085 5.583 -9.780 1.00 . A A . 21 LYS CE 1 1 2 567 1 1 18 LYS CG C 4.850 5.965 -7.309 1.00 . A A . 21 LYS CG 1 1 2 568 1 1 18 LYS H H 2.118 5.902 -6.596 1.00 . A A . 21 LYS H 1 1 2 569 1 1 18 LYS HA H 4.119 5.320 -4.848 1.00 . A A . 21 LYS HA 1 1 2 570 1 1 18 LYS HB2 H 3.802 7.693 -6.671 1.00 . A A . 21 LYS HB2 1 1 2 571 1 1 18 LYS HB3 H 5.289 7.369 -5.784 1.00 . A A . 21 LYS HB3 1 1 2 572 1 1 18 LYS HD2 H 3.688 6.884 -8.836 1.00 . A A . 21 LYS HD2 1 1 2 573 1 1 18 LYS HD3 H 5.363 7.436 -8.762 1.00 . A A . 21 LYS HD3 1 1 2 574 1 1 18 LYS HE2 H 5.050 6.083 -10.736 1.00 . A A . 21 LYS HE2 1 1 2 575 1 1 18 LYS HE3 H 6.087 5.227 -9.594 1.00 . A A . 21 LYS HE3 1 1 2 576 1 1 18 LYS HG2 H 5.885 5.700 -7.144 1.00 . A A . 21 LYS HG2 1 1 2 577 1 1 18 LYS HG3 H 4.236 5.083 -7.248 1.00 . A A . 21 LYS HG3 1 1 2 578 1 1 18 LYS HZ1 H 4.194 3.907 -8.905 1.00 . A A . 21 LYS HZ1 1 1 2 579 1 1 18 LYS HZ2 H 4.427 3.766 -10.574 1.00 . A A . 21 LYS HZ2 1 1 2 580 1 1 18 LYS HZ3 H 3.182 4.741 -9.974 1.00 . A A . 21 LYS HZ3 1 1 2 581 1 1 18 LYS N N 2.290 5.844 -5.632 1.00 . A A . 21 LYS N 1 1 2 582 1 1 18 LYS NZ N 4.157 4.418 -9.810 1.00 . A A . 21 LYS NZ 1 1 2 583 1 1 18 LYS O O 2.474 7.747 -3.652 1.00 . A A . 21 LYS O 1 1 2 584 1 1 19 SER C C 6.103 7.967 -1.388 1.00 . A A . 22 SER C 1 1 2 585 1 1 19 SER CA C 4.667 7.968 -1.931 1.00 . A A . 22 SER CA 1 1 2 586 1 1 19 SER CB C 3.690 7.390 -0.903 1.00 . A A . 22 SER CB 1 1 2 587 1 1 19 SER H H 5.393 6.687 -3.440 1.00 . A A . 22 SER H 1 1 2 588 1 1 19 SER HA H 4.380 8.983 -2.166 1.00 . A A . 22 SER HA 1 1 2 589 1 1 19 SER HB2 H 3.630 6.318 -1.032 1.00 . A A . 22 SER HB2 1 1 2 590 1 1 19 SER HB3 H 4.038 7.611 0.093 1.00 . A A . 22 SER HB3 1 1 2 591 1 1 19 SER HG H 1.889 7.389 -1.671 1.00 . A A . 22 SER HG 1 1 2 592 1 1 19 SER N N 4.599 7.183 -3.154 1.00 . A A . 22 SER N 1 1 2 593 1 1 19 SER O O 6.957 7.254 -1.925 1.00 . A A . 22 SER O 1 1 2 594 1 1 19 SER OG O 2.394 7.938 -1.068 1.00 . A A . 22 SER OG 1 1 2 595 1 1 20 PRO C C 8.540 7.566 0.190 1.00 . A A . 23 PRO C 1 1 2 596 1 1 20 PRO CA C 7.728 8.859 0.270 1.00 . A A . 23 PRO CA 1 1 2 597 1 1 20 PRO CB C 7.408 9.193 1.723 1.00 . A A . 23 PRO CB 1 1 2 598 1 1 20 PRO CD C 5.452 9.669 0.363 1.00 . A A . 23 PRO CD 1 1 2 599 1 1 20 PRO CG C 6.139 9.985 1.676 1.00 . A A . 23 PRO CG 1 1 2 600 1 1 20 PRO HA H 8.300 9.666 -0.162 1.00 . A A . 23 PRO HA 1 1 2 601 1 1 20 PRO HB2 H 7.280 8.278 2.284 1.00 . A A . 23 PRO HB2 1 1 2 602 1 1 20 PRO HB3 H 8.215 9.771 2.147 1.00 . A A . 23 PRO HB3 1 1 2 603 1 1 20 PRO HD2 H 4.513 9.176 0.546 1.00 . A A . 23 PRO HD2 1 1 2 604 1 1 20 PRO HD3 H 5.296 10.573 -0.205 1.00 . A A . 23 PRO HD3 1 1 2 605 1 1 20 PRO HG2 H 5.505 9.698 2.502 1.00 . A A . 23 PRO HG2 1 1 2 606 1 1 20 PRO HG3 H 6.368 11.040 1.732 1.00 . A A . 23 PRO HG3 1 1 2 607 1 1 20 PRO N N 6.395 8.768 -0.331 1.00 . A A . 23 PRO N 1 1 2 608 1 1 20 PRO O O 7.984 6.467 0.168 1.00 . A A . 23 PRO O 1 1 2 609 1 1 21 ASP C C 10.826 5.995 -1.327 1.00 . A A . 24 ASP C 1 1 2 610 1 1 21 ASP CA C 10.797 6.597 0.078 1.00 . A A . 24 ASP CA 1 1 2 611 1 1 21 ASP CB C 10.445 5.522 1.112 1.00 . A A . 24 ASP CB 1 1 2 612 1 1 21 ASP CG C 11.604 4.586 1.397 1.00 . A A . 24 ASP CG 1 1 2 613 1 1 21 ASP H H 10.229 8.633 0.181 1.00 . A A . 24 ASP H 1 1 2 614 1 1 21 ASP HA H 11.783 6.980 0.302 1.00 . A A . 24 ASP HA 1 1 2 615 1 1 21 ASP HB2 H 10.162 6.003 2.038 1.00 . A A . 24 ASP HB2 1 1 2 616 1 1 21 ASP HB3 H 9.614 4.938 0.746 1.00 . A A . 24 ASP HB3 1 1 2 617 1 1 21 ASP N N 9.865 7.723 0.154 1.00 . A A . 24 ASP N 1 1 2 618 1 1 21 ASP O O 11.545 5.029 -1.583 1.00 . A A . 24 ASP O 1 1 2 619 1 1 21 ASP OD1 O 11.793 3.622 0.626 1.00 . A A . 24 ASP OD1 1 1 2 620 1 1 21 ASP OD2 O 12.323 4.816 2.392 1.00 . A A . 24 ASP OD2 1 1 2 621 1 1 22 GLY C C 9.318 4.753 -3.723 1.00 . A A . 25 GLY C 1 1 2 622 1 1 22 GLY CA C 10.000 6.092 -3.600 1.00 . A A . 25 GLY CA 1 1 2 623 1 1 22 GLY H H 9.478 7.322 -1.970 1.00 . A A . 25 GLY H 1 1 2 624 1 1 22 GLY HA2 H 9.460 6.808 -4.210 1.00 . A A . 25 GLY HA2 1 1 2 625 1 1 22 GLY HA3 H 11.007 6.010 -3.966 1.00 . A A . 25 GLY HA3 1 1 2 626 1 1 22 GLY N N 10.041 6.572 -2.233 1.00 . A A . 25 GLY N 1 1 2 627 1 1 22 GLY O O 9.785 3.865 -4.437 1.00 . A A . 25 GLY O 1 1 2 628 1 1 23 ARG C C 5.951 3.740 -3.066 1.00 . A A . 26 ARG C 1 1 2 629 1 1 23 ARG CA C 7.425 3.394 -3.048 1.00 . A A . 26 ARG CA 1 1 2 630 1 1 23 ARG CB C 7.761 2.485 -1.863 1.00 . A A . 26 ARG CB 1 1 2 631 1 1 23 ARG CD C 8.809 2.316 0.400 1.00 . A A . 26 ARG CD 1 1 2 632 1 1 23 ARG CG C 8.075 3.220 -0.574 1.00 . A A . 26 ARG CG 1 1 2 633 1 1 23 ARG CZ C 10.638 0.674 0.254 1.00 . A A . 26 ARG CZ 1 1 2 634 1 1 23 ARG H H 7.891 5.371 -2.475 1.00 . A A . 26 ARG H 1 1 2 635 1 1 23 ARG HA H 7.665 2.875 -3.966 1.00 . A A . 26 ARG HA 1 1 2 636 1 1 23 ARG HB2 H 6.919 1.838 -1.679 1.00 . A A . 26 ARG HB2 1 1 2 637 1 1 23 ARG HB3 H 8.616 1.878 -2.123 1.00 . A A . 26 ARG HB3 1 1 2 638 1 1 23 ARG HD2 H 9.048 2.884 1.283 1.00 . A A . 26 ARG HD2 1 1 2 639 1 1 23 ARG HD3 H 8.161 1.493 0.665 1.00 . A A . 26 ARG HD3 1 1 2 640 1 1 23 ARG HE H 10.448 2.280 -0.915 1.00 . A A . 26 ARG HE 1 1 2 641 1 1 23 ARG HG2 H 8.691 4.075 -0.798 1.00 . A A . 26 ARG HG2 1 1 2 642 1 1 23 ARG HG3 H 7.153 3.544 -0.119 1.00 . A A . 26 ARG HG3 1 1 2 643 1 1 23 ARG HH11 H 9.271 0.288 1.691 1.00 . A A . 26 ARG HH11 1 1 2 644 1 1 23 ARG HH12 H 10.567 -0.855 1.572 1.00 . A A . 26 ARG HH12 1 1 2 645 1 1 23 ARG HH21 H 12.155 0.779 -1.078 1.00 . A A . 26 ARG HH21 1 1 2 646 1 1 23 ARG HH22 H 12.206 -0.576 0.001 1.00 . A A . 26 ARG HH22 1 1 2 647 1 1 23 ARG N N 8.205 4.617 -3.023 1.00 . A A . 26 ARG N 1 1 2 648 1 1 23 ARG NE N 10.042 1.784 -0.174 1.00 . A A . 26 ARG NE 1 1 2 649 1 1 23 ARG NH1 N 10.115 -0.021 1.254 1.00 . A A . 26 ARG NH1 1 1 2 650 1 1 23 ARG NH2 N 11.758 0.258 -0.321 1.00 . A A . 26 ARG NH2 1 1 2 651 1 1 23 ARG O O 5.578 4.882 -2.819 1.00 . A A . 26 ARG O 1 1 2 652 1 1 24 THR C C 2.978 2.540 -2.157 1.00 . A A . 27 THR C 1 1 2 653 1 1 24 THR CA C 3.683 3.008 -3.418 1.00 . A A . 27 THR CA 1 1 2 654 1 1 24 THR CB C 3.053 2.308 -4.636 1.00 . A A . 27 THR CB 1 1 2 655 1 1 24 THR CG2 C 3.403 0.828 -4.657 1.00 . A A . 27 THR CG2 1 1 2 656 1 1 24 THR H H 5.458 1.856 -3.494 1.00 . A A . 27 THR H 1 1 2 657 1 1 24 THR HA H 3.537 4.072 -3.527 1.00 . A A . 27 THR HA 1 1 2 658 1 1 24 THR HB H 3.440 2.767 -5.535 1.00 . A A . 27 THR HB 1 1 2 659 1 1 24 THR HG1 H 1.326 2.777 -5.465 1.00 . A A . 27 THR HG1 1 1 2 660 1 1 24 THR HG21 H 3.028 0.356 -3.761 1.00 . A A . 27 THR HG21 1 1 2 661 1 1 24 THR HG22 H 4.476 0.713 -4.702 1.00 . A A . 27 THR HG22 1 1 2 662 1 1 24 THR HG23 H 2.954 0.364 -5.523 1.00 . A A . 27 THR HG23 1 1 2 663 1 1 24 THR N N 5.112 2.760 -3.346 1.00 . A A . 27 THR N 1 1 2 664 1 1 24 THR O O 3.191 1.421 -1.690 1.00 . A A . 27 THR O 1 1 2 665 1 1 24 THR OG1 O 1.631 2.469 -4.608 1.00 . A A . 27 THR OG1 1 1 2 666 1 1 25 TYR C C -0.036 2.717 -0.696 1.00 . A A . 28 TYR C 1 1 2 667 1 1 25 TYR CA C 1.403 3.091 -0.396 1.00 . A A . 28 TYR CA 1 1 2 668 1 1 25 TYR CB C 1.454 4.259 0.611 1.00 . A A . 28 TYR CB 1 1 2 669 1 1 25 TYR CD1 C 0.120 5.702 -1.035 1.00 . A A . 28 TYR CD1 1 1 2 670 1 1 25 TYR CD2 C 0.628 6.593 1.118 1.00 . A A . 28 TYR CD2 1 1 2 671 1 1 25 TYR CE1 C -0.541 6.871 -1.364 1.00 . A A . 28 TYR CE1 1 1 2 672 1 1 25 TYR CE2 C -0.032 7.763 0.793 1.00 . A A . 28 TYR CE2 1 1 2 673 1 1 25 TYR CG C 0.720 5.538 0.214 1.00 . A A . 28 TYR CG 1 1 2 674 1 1 25 TYR CZ C -0.614 7.896 -0.448 1.00 . A A . 28 TYR CZ 1 1 2 675 1 1 25 TYR H H 2.005 4.281 -2.033 1.00 . A A . 28 TYR H 1 1 2 676 1 1 25 TYR HA H 1.886 2.235 0.052 1.00 . A A . 28 TYR HA 1 1 2 677 1 1 25 TYR HB2 H 1.025 3.924 1.543 1.00 . A A . 28 TYR HB2 1 1 2 678 1 1 25 TYR HB3 H 2.487 4.517 0.785 1.00 . A A . 28 TYR HB3 1 1 2 679 1 1 25 TYR HD1 H 0.176 4.902 -1.753 1.00 . A A . 28 TYR HD1 1 1 2 680 1 1 25 TYR HD2 H 1.088 6.491 2.089 1.00 . A A . 28 TYR HD2 1 1 2 681 1 1 25 TYR HE1 H -0.997 6.975 -2.337 1.00 . A A . 28 TYR HE1 1 1 2 682 1 1 25 TYR HE2 H -0.089 8.567 1.511 1.00 . A A . 28 TYR HE2 1 1 2 683 1 1 25 TYR HH H -2.116 8.847 -1.181 1.00 . A A . 28 TYR HH 1 1 2 684 1 1 25 TYR N N 2.132 3.408 -1.612 1.00 . A A . 28 TYR N 1 1 2 685 1 1 25 TYR O O -0.540 2.937 -1.804 1.00 . A A . 28 TYR O 1 1 2 686 1 1 25 TYR OH O -1.273 9.059 -0.773 1.00 . A A . 28 TYR OH 1 1 2 687 1 1 26 TYR C C -2.948 2.554 1.068 1.00 . A A . 29 TYR C 1 1 2 688 1 1 26 TYR CA C -2.058 1.714 0.172 1.00 . A A . 29 TYR CA 1 1 2 689 1 1 26 TYR CB C -2.183 0.235 0.516 1.00 . A A . 29 TYR CB 1 1 2 690 1 1 26 TYR CD1 C -0.070 -0.915 -0.246 1.00 . A A . 29 TYR CD1 1 1 2 691 1 1 26 TYR CD2 C -2.044 -1.208 -1.550 1.00 . A A . 29 TYR CD2 1 1 2 692 1 1 26 TYR CE1 C 0.635 -1.712 -1.126 1.00 . A A . 29 TYR CE1 1 1 2 693 1 1 26 TYR CE2 C -1.345 -2.004 -2.436 1.00 . A A . 29 TYR CE2 1 1 2 694 1 1 26 TYR CG C -1.420 -0.651 -0.441 1.00 . A A . 29 TYR CG 1 1 2 695 1 1 26 TYR CZ C -0.006 -2.254 -2.218 1.00 . A A . 29 TYR CZ 1 1 2 696 1 1 26 TYR H H -0.210 1.976 1.141 1.00 . A A . 29 TYR H 1 1 2 697 1 1 26 TYR HA H -2.356 1.860 -0.853 1.00 . A A . 29 TYR HA 1 1 2 698 1 1 26 TYR HB2 H -1.793 0.069 1.509 1.00 . A A . 29 TYR HB2 1 1 2 699 1 1 26 TYR HB3 H -3.221 -0.049 0.486 1.00 . A A . 29 TYR HB3 1 1 2 700 1 1 26 TYR HD1 H 0.430 -0.490 0.613 1.00 . A A . 29 TYR HD1 1 1 2 701 1 1 26 TYR HD2 H -3.093 -1.011 -1.717 1.00 . A A . 29 TYR HD2 1 1 2 702 1 1 26 TYR HE1 H 1.685 -1.908 -0.957 1.00 . A A . 29 TYR HE1 1 1 2 703 1 1 26 TYR HE2 H -1.846 -2.428 -3.292 1.00 . A A . 29 TYR HE2 1 1 2 704 1 1 26 TYR HH H 1.266 -3.638 -2.607 1.00 . A A . 29 TYR HH 1 1 2 705 1 1 26 TYR N N -0.680 2.131 0.297 1.00 . A A . 29 TYR N 1 1 2 706 1 1 26 TYR O O -2.945 2.396 2.288 1.00 . A A . 29 TYR O 1 1 2 707 1 1 26 TYR OH O 0.694 -3.044 -3.097 1.00 . A A . 29 TYR OH 1 1 2 708 1 1 27 TYR C C -6.035 3.838 1.072 1.00 . A A . 30 TYR C 1 1 2 709 1 1 27 TYR CA C -4.603 4.326 1.189 1.00 . A A . 30 TYR CA 1 1 2 710 1 1 27 TYR CB C -4.492 5.763 0.667 1.00 . A A . 30 TYR CB 1 1 2 711 1 1 27 TYR CD1 C -5.828 6.883 2.503 1.00 . A A . 30 TYR CD1 1 1 2 712 1 1 27 TYR CD2 C -6.425 7.336 0.239 1.00 . A A . 30 TYR CD2 1 1 2 713 1 1 27 TYR CE1 C -6.841 7.715 2.941 1.00 . A A . 30 TYR CE1 1 1 2 714 1 1 27 TYR CE2 C -7.439 8.170 0.670 1.00 . A A . 30 TYR CE2 1 1 2 715 1 1 27 TYR CG C -5.602 6.678 1.146 1.00 . A A . 30 TYR CG 1 1 2 716 1 1 27 TYR CZ C -7.643 8.355 2.020 1.00 . A A . 30 TYR CZ 1 1 2 717 1 1 27 TYR H H -3.668 3.520 -0.524 1.00 . A A . 30 TYR H 1 1 2 718 1 1 27 TYR HA H -4.311 4.303 2.228 1.00 . A A . 30 TYR HA 1 1 2 719 1 1 27 TYR HB2 H -3.553 6.185 0.995 1.00 . A A . 30 TYR HB2 1 1 2 720 1 1 27 TYR HB3 H -4.516 5.749 -0.414 1.00 . A A . 30 TYR HB3 1 1 2 721 1 1 27 TYR HD1 H -5.199 6.380 3.221 1.00 . A A . 30 TYR HD1 1 1 2 722 1 1 27 TYR HD2 H -6.263 7.187 -0.819 1.00 . A A . 30 TYR HD2 1 1 2 723 1 1 27 TYR HE1 H -7.000 7.861 3.999 1.00 . A A . 30 TYR HE1 1 1 2 724 1 1 27 TYR HE2 H -8.068 8.671 -0.051 1.00 . A A . 30 TYR HE2 1 1 2 725 1 1 27 TYR HH H -9.458 8.989 1.971 1.00 . A A . 30 TYR HH 1 1 2 726 1 1 27 TYR N N -3.709 3.448 0.452 1.00 . A A . 30 TYR N 1 1 2 727 1 1 27 TYR O O -6.679 3.999 0.034 1.00 . A A . 30 TYR O 1 1 2 728 1 1 27 TYR OH O -8.651 9.186 2.453 1.00 . A A . 30 TYR OH 1 1 2 729 1 1 28 ASN C C -8.849 3.879 2.301 1.00 . A A . 31 ASN C 1 1 2 730 1 1 28 ASN CA C -7.878 2.727 2.173 1.00 . A A . 31 ASN CA 1 1 2 731 1 1 28 ASN CB C -8.073 1.768 3.340 1.00 . A A . 31 ASN CB 1 1 2 732 1 1 28 ASN CG C -9.294 0.897 3.152 1.00 . A A . 31 ASN CG 1 1 2 733 1 1 28 ASN H H -5.965 3.146 2.941 1.00 . A A . 31 ASN H 1 1 2 734 1 1 28 ASN HA H -8.061 2.206 1.247 1.00 . A A . 31 ASN HA 1 1 2 735 1 1 28 ASN HB2 H -7.205 1.133 3.433 1.00 . A A . 31 ASN HB2 1 1 2 736 1 1 28 ASN HB3 H -8.201 2.342 4.249 1.00 . A A . 31 ASN HB3 1 1 2 737 1 1 28 ASN HD21 H -10.470 2.445 3.547 1.00 . A A . 31 ASN HD21 1 1 2 738 1 1 28 ASN HD22 H -11.275 0.958 3.214 1.00 . A A . 31 ASN HD22 1 1 2 739 1 1 28 ASN N N -6.524 3.237 2.146 1.00 . A A . 31 ASN N 1 1 2 740 1 1 28 ASN ND2 N -10.465 1.493 3.318 1.00 . A A . 31 ASN ND2 1 1 2 741 1 1 28 ASN O O -8.875 4.551 3.328 1.00 . A A . 31 ASN O 1 1 2 742 1 1 28 ASN OD1 O -9.189 -0.290 2.847 1.00 . A A . 31 ASN OD1 1 1 2 743 1 1 29 THR C C -11.730 4.968 2.241 1.00 . A A . 32 THR C 1 1 2 744 1 1 29 THR CA C -10.608 5.184 1.231 1.00 . A A . 32 THR CA 1 1 2 745 1 1 29 THR CB C -11.229 5.335 -0.167 1.00 . A A . 32 THR CB 1 1 2 746 1 1 29 THR CG2 C -10.294 6.094 -1.097 1.00 . A A . 32 THR CG2 1 1 2 747 1 1 29 THR H H -9.554 3.515 0.468 1.00 . A A . 32 THR H 1 1 2 748 1 1 29 THR HA H -10.092 6.100 1.474 1.00 . A A . 32 THR HA 1 1 2 749 1 1 29 THR HB H -12.150 5.888 -0.073 1.00 . A A . 32 THR HB 1 1 2 750 1 1 29 THR HG1 H -11.892 4.146 -1.594 1.00 . A A . 32 THR HG1 1 1 2 751 1 1 29 THR HG21 H -10.098 7.074 -0.689 1.00 . A A . 32 THR HG21 1 1 2 752 1 1 29 THR HG22 H -10.756 6.193 -2.068 1.00 . A A . 32 THR HG22 1 1 2 753 1 1 29 THR HG23 H -9.365 5.551 -1.194 1.00 . A A . 32 THR HG23 1 1 2 754 1 1 29 THR N N -9.634 4.100 1.253 1.00 . A A . 32 THR N 1 1 2 755 1 1 29 THR O O -12.198 5.914 2.873 1.00 . A A . 32 THR O 1 1 2 756 1 1 29 THR OG1 O -11.518 4.045 -0.715 1.00 . A A . 32 THR OG1 1 1 2 757 1 1 30 GLU C C -12.876 3.678 4.754 1.00 . A A . 33 GLU C 1 1 2 758 1 1 30 GLU CA C -13.241 3.388 3.306 1.00 . A A . 33 GLU CA 1 1 2 759 1 1 30 GLU CB C -13.628 1.919 3.152 1.00 . A A . 33 GLU CB 1 1 2 760 1 1 30 GLU CD C -14.064 2.111 0.669 1.00 . A A . 33 GLU CD 1 1 2 761 1 1 30 GLU CG C -14.603 1.666 2.016 1.00 . A A . 33 GLU CG 1 1 2 762 1 1 30 GLU H H -11.740 3.005 1.866 1.00 . A A . 33 GLU H 1 1 2 763 1 1 30 GLU HA H -14.087 3.992 3.044 1.00 . A A . 33 GLU HA 1 1 2 764 1 1 30 GLU HB2 H -12.735 1.344 2.967 1.00 . A A . 33 GLU HB2 1 1 2 765 1 1 30 GLU HB3 H -14.082 1.580 4.071 1.00 . A A . 33 GLU HB3 1 1 2 766 1 1 30 GLU HG2 H -14.813 0.608 1.969 1.00 . A A . 33 GLU HG2 1 1 2 767 1 1 30 GLU HG3 H -15.515 2.204 2.218 1.00 . A A . 33 GLU HG3 1 1 2 768 1 1 30 GLU N N -12.160 3.721 2.388 1.00 . A A . 33 GLU N 1 1 2 769 1 1 30 GLU O O -13.458 4.560 5.388 1.00 . A A . 33 GLU O 1 1 2 770 1 1 30 GLU OE1 O -13.391 1.299 0.001 1.00 . A A . 33 GLU OE1 1 1 2 771 1 1 30 GLU OE2 O -14.317 3.273 0.284 1.00 . A A . 33 GLU OE2 1 1 2 772 1 1 31 THR C C -10.565 4.307 6.840 1.00 . A A . 34 THR C 1 1 2 773 1 1 31 THR CA C -11.488 3.100 6.657 1.00 . A A . 34 THR CA 1 1 2 774 1 1 31 THR CB C -10.789 1.840 7.205 1.00 . A A . 34 THR CB 1 1 2 775 1 1 31 THR CG2 C -9.567 1.487 6.375 1.00 . A A . 34 THR CG2 1 1 2 776 1 1 31 THR H H -11.479 2.268 4.710 1.00 . A A . 34 THR H 1 1 2 777 1 1 31 THR HA H -12.380 3.258 7.242 1.00 . A A . 34 THR HA 1 1 2 778 1 1 31 THR HB H -11.485 1.015 7.163 1.00 . A A . 34 THR HB 1 1 2 779 1 1 31 THR HG1 H -9.886 1.297 8.872 1.00 . A A . 34 THR HG1 1 1 2 780 1 1 31 THR HG21 H -8.930 2.354 6.285 1.00 . A A . 34 THR HG21 1 1 2 781 1 1 31 THR HG22 H -9.883 1.168 5.395 1.00 . A A . 34 THR HG22 1 1 2 782 1 1 31 THR HG23 H -9.024 0.688 6.857 1.00 . A A . 34 THR HG23 1 1 2 783 1 1 31 THR N N -11.912 2.937 5.272 1.00 . A A . 34 THR N 1 1 2 784 1 1 31 THR O O -10.581 4.935 7.899 1.00 . A A . 34 THR O 1 1 2 785 1 1 31 THR OG1 O -10.397 2.050 8.566 1.00 . A A . 34 THR OG1 1 1 2 786 1 1 32 LYS C C -7.491 5.268 6.392 1.00 . A A . 35 LYS C 1 1 2 787 1 1 32 LYS CA C -8.810 5.729 5.827 1.00 . A A . 35 LYS CA 1 1 2 788 1 1 32 LYS CB C -9.348 6.937 6.608 1.00 . A A . 35 LYS CB 1 1 2 789 1 1 32 LYS CD C -11.279 8.498 7.033 1.00 . A A . 35 LYS CD 1 1 2 790 1 1 32 LYS CE C -10.485 9.794 6.959 1.00 . A A . 35 LYS CE 1 1 2 791 1 1 32 LYS CG C -10.700 7.432 6.114 1.00 . A A . 35 LYS CG 1 1 2 792 1 1 32 LYS H H -9.728 4.000 5.038 1.00 . A A . 35 LYS H 1 1 2 793 1 1 32 LYS HA H -8.640 6.022 4.799 1.00 . A A . 35 LYS HA 1 1 2 794 1 1 32 LYS HB2 H -9.444 6.668 7.648 1.00 . A A . 35 LYS HB2 1 1 2 795 1 1 32 LYS HB3 H -8.641 7.750 6.520 1.00 . A A . 35 LYS HB3 1 1 2 796 1 1 32 LYS HD2 H -12.299 8.697 6.739 1.00 . A A . 35 LYS HD2 1 1 2 797 1 1 32 LYS HD3 H -11.259 8.131 8.049 1.00 . A A . 35 LYS HD3 1 1 2 798 1 1 32 LYS HE2 H -10.896 10.494 7.671 1.00 . A A . 35 LYS HE2 1 1 2 799 1 1 32 LYS HE3 H -9.456 9.586 7.213 1.00 . A A . 35 LYS HE3 1 1 2 800 1 1 32 LYS HG2 H -10.580 7.850 5.126 1.00 . A A . 35 LYS HG2 1 1 2 801 1 1 32 LYS HG3 H -11.384 6.596 6.071 1.00 . A A . 35 LYS HG3 1 1 2 802 1 1 32 LYS HZ1 H -11.523 10.572 5.322 1.00 . A A . 35 LYS HZ1 1 1 2 803 1 1 32 LYS HZ2 H -10.099 9.759 4.906 1.00 . A A . 35 LYS HZ2 1 1 2 804 1 1 32 LYS HZ3 H -10.022 11.303 5.591 1.00 . A A . 35 LYS HZ3 1 1 2 805 1 1 32 LYS N N -9.746 4.599 5.814 1.00 . A A . 35 LYS N 1 1 2 806 1 1 32 LYS NZ N -10.536 10.399 5.600 1.00 . A A . 35 LYS NZ 1 1 2 807 1 1 32 LYS O O -6.954 5.846 7.337 1.00 . A A . 35 LYS O 1 1 2 808 1 1 33 GLN C C -4.664 3.712 5.124 1.00 . A A . 36 GLN C 1 1 2 809 1 1 33 GLN CA C -5.710 3.638 6.224 1.00 . A A . 36 GLN CA 1 1 2 810 1 1 33 GLN CB C -5.901 2.185 6.660 1.00 . A A . 36 GLN CB 1 1 2 811 1 1 33 GLN CD C -4.190 2.384 8.510 1.00 . A A . 36 GLN CD 1 1 2 812 1 1 33 GLN CG C -4.672 1.580 7.317 1.00 . A A . 36 GLN CG 1 1 2 813 1 1 33 GLN H H -7.459 3.811 5.020 1.00 . A A . 36 GLN H 1 1 2 814 1 1 33 GLN HA H -5.364 4.211 7.070 1.00 . A A . 36 GLN HA 1 1 2 815 1 1 33 GLN HB2 H -6.722 2.136 7.360 1.00 . A A . 36 GLN HB2 1 1 2 816 1 1 33 GLN HB3 H -6.144 1.595 5.790 1.00 . A A . 36 GLN HB3 1 1 2 817 1 1 33 GLN HE21 H -2.993 3.455 7.339 1.00 . A A . 36 GLN HE21 1 1 2 818 1 1 33 GLN HE22 H -2.962 3.864 9.016 1.00 . A A . 36 GLN HE22 1 1 2 819 1 1 33 GLN HG2 H -4.913 0.582 7.651 1.00 . A A . 36 GLN HG2 1 1 2 820 1 1 33 GLN HG3 H -3.876 1.533 6.589 1.00 . A A . 36 GLN HG3 1 1 2 821 1 1 33 GLN N N -6.975 4.208 5.788 1.00 . A A . 36 GLN N 1 1 2 822 1 1 33 GLN NE2 N -3.291 3.330 8.264 1.00 . A A . 36 GLN NE2 1 1 2 823 1 1 33 GLN O O -4.662 2.912 4.191 1.00 . A A . 36 GLN O 1 1 2 824 1 1 33 GLN OE1 O -4.621 2.155 9.642 1.00 . A A . 36 GLN OE1 1 1 2 825 1 1 34 SER C C -1.361 4.341 4.856 1.00 . A A . 37 SER C 1 1 2 826 1 1 34 SER CA C -2.686 4.861 4.296 1.00 . A A . 37 SER CA 1 1 2 827 1 1 34 SER CB C -2.548 6.343 3.938 1.00 . A A . 37 SER CB 1 1 2 828 1 1 34 SER H H -3.839 5.275 6.025 1.00 . A A . 37 SER H 1 1 2 829 1 1 34 SER HA H -2.938 4.306 3.407 1.00 . A A . 37 SER HA 1 1 2 830 1 1 34 SER HB2 H -1.729 6.469 3.248 1.00 . A A . 37 SER HB2 1 1 2 831 1 1 34 SER HB3 H -3.462 6.685 3.479 1.00 . A A . 37 SER HB3 1 1 2 832 1 1 34 SER HG H -2.606 8.023 4.944 1.00 . A A . 37 SER HG 1 1 2 833 1 1 34 SER N N -3.763 4.668 5.263 1.00 . A A . 37 SER N 1 1 2 834 1 1 34 SER O O -0.760 4.970 5.727 1.00 . A A . 37 SER O 1 1 2 835 1 1 34 SER OG O -2.297 7.126 5.093 1.00 . A A . 37 SER OG 1 1 2 836 1 1 35 THR C C 0.829 1.535 3.841 1.00 . A A . 38 THR C 1 1 2 837 1 1 35 THR CA C 0.336 2.592 4.821 1.00 . A A . 38 THR CA 1 1 2 838 1 1 35 THR CB C 0.165 1.949 6.212 1.00 . A A . 38 THR CB 1 1 2 839 1 1 35 THR CG2 C -0.925 0.888 6.191 1.00 . A A . 38 THR CG2 1 1 2 840 1 1 35 THR H H -1.433 2.724 3.665 1.00 . A A . 38 THR H 1 1 2 841 1 1 35 THR HA H 1.076 3.375 4.896 1.00 . A A . 38 THR HA 1 1 2 842 1 1 35 THR HB H -0.119 2.719 6.915 1.00 . A A . 38 THR HB 1 1 2 843 1 1 35 THR HG1 H 1.460 0.464 6.302 1.00 . A A . 38 THR HG1 1 1 2 844 1 1 35 THR HG21 H -1.852 1.330 5.857 1.00 . A A . 38 THR HG21 1 1 2 845 1 1 35 THR HG22 H -1.056 0.486 7.185 1.00 . A A . 38 THR HG22 1 1 2 846 1 1 35 THR HG23 H -0.641 0.094 5.516 1.00 . A A . 38 THR HG23 1 1 2 847 1 1 35 THR N N -0.910 3.191 4.355 1.00 . A A . 38 THR N 1 1 2 848 1 1 35 THR O O 0.105 1.145 2.925 1.00 . A A . 38 THR O 1 1 2 849 1 1 35 THR OG1 O 1.400 1.361 6.638 1.00 . A A . 38 THR OG1 1 1 2 850 1 1 36 TRP C C 2.468 -1.305 3.840 1.00 . A A . 39 TRP C 1 1 2 851 1 1 36 TRP CA C 2.620 0.049 3.160 1.00 . A A . 39 TRP CA 1 1 2 852 1 1 36 TRP CB C 4.113 0.296 2.888 1.00 . A A . 39 TRP CB 1 1 2 853 1 1 36 TRP CD1 C 4.964 2.221 4.293 1.00 . A A . 39 TRP CD1 1 1 2 854 1 1 36 TRP CD2 C 4.748 2.713 2.128 1.00 . A A . 39 TRP CD2 1 1 2 855 1 1 36 TRP CE2 C 5.229 3.851 2.799 1.00 . A A . 39 TRP CE2 1 1 2 856 1 1 36 TRP CE3 C 4.536 2.781 0.753 1.00 . A A . 39 TRP CE3 1 1 2 857 1 1 36 TRP CG C 4.576 1.690 3.109 1.00 . A A . 39 TRP CG 1 1 2 858 1 1 36 TRP CH2 C 5.289 5.079 0.790 1.00 . A A . 39 TRP CH2 1 1 2 859 1 1 36 TRP CZ2 C 5.503 5.040 2.138 1.00 . A A . 39 TRP CZ2 1 1 2 860 1 1 36 TRP CZ3 C 4.808 3.964 0.096 1.00 . A A . 39 TRP CZ3 1 1 2 861 1 1 36 TRP H H 2.597 1.419 4.777 1.00 . A A . 39 TRP H 1 1 2 862 1 1 36 TRP HA H 2.071 0.052 2.230 1.00 . A A . 39 TRP HA 1 1 2 863 1 1 36 TRP HB2 H 4.693 -0.327 3.549 1.00 . A A . 39 TRP HB2 1 1 2 864 1 1 36 TRP HB3 H 4.334 0.034 1.864 1.00 . A A . 39 TRP HB3 1 1 2 865 1 1 36 TRP HD1 H 4.955 1.676 5.219 1.00 . A A . 39 TRP HD1 1 1 2 866 1 1 36 TRP HE1 H 5.666 4.129 4.832 1.00 . A A . 39 TRP HE1 1 1 2 867 1 1 36 TRP HE3 H 4.166 1.929 0.202 1.00 . A A . 39 TRP HE3 1 1 2 868 1 1 36 TRP HH2 H 5.490 5.985 0.238 1.00 . A A . 39 TRP HH2 1 1 2 869 1 1 36 TRP HZ2 H 5.876 5.904 2.655 1.00 . A A . 39 TRP HZ2 1 1 2 870 1 1 36 TRP HZ3 H 4.652 4.036 -0.969 1.00 . A A . 39 TRP HZ3 1 1 2 871 1 1 36 TRP N N 2.060 1.070 4.036 1.00 . A A . 39 TRP N 1 1 2 872 1 1 36 TRP NE1 N 5.351 3.528 4.123 1.00 . A A . 39 TRP NE1 1 1 2 873 1 1 36 TRP O O 3.218 -1.638 4.758 1.00 . A A . 39 TRP O 1 1 2 874 1 1 37 GLU C C 0.309 -4.195 3.049 1.00 . A A . 40 GLU C 1 1 2 875 1 1 37 GLU CA C 1.219 -3.386 3.965 1.00 . A A . 40 GLU CA 1 1 2 876 1 1 37 GLU CB C 0.563 -3.197 5.336 1.00 . A A . 40 GLU CB 1 1 2 877 1 1 37 GLU CD C -1.811 -4.072 5.278 1.00 . A A . 40 GLU CD 1 1 2 878 1 1 37 GLU CG C -0.917 -2.849 5.273 1.00 . A A . 40 GLU CG 1 1 2 879 1 1 37 GLU H H 0.943 -1.778 2.625 1.00 . A A . 40 GLU H 1 1 2 880 1 1 37 GLU HA H 2.156 -3.907 4.085 1.00 . A A . 40 GLU HA 1 1 2 881 1 1 37 GLU HB2 H 0.674 -4.106 5.908 1.00 . A A . 40 GLU HB2 1 1 2 882 1 1 37 GLU HB3 H 1.071 -2.392 5.851 1.00 . A A . 40 GLU HB3 1 1 2 883 1 1 37 GLU HG2 H -1.167 -2.236 6.125 1.00 . A A . 40 GLU HG2 1 1 2 884 1 1 37 GLU HG3 H -1.100 -2.292 4.364 1.00 . A A . 40 GLU HG3 1 1 2 885 1 1 37 GLU N N 1.491 -2.083 3.381 1.00 . A A . 40 GLU N 1 1 2 886 1 1 37 GLU O O -0.407 -3.629 2.225 1.00 . A A . 40 GLU O 1 1 2 887 1 1 37 GLU OE1 O -1.496 -5.037 6.005 1.00 . A A . 40 GLU OE1 1 1 2 888 1 1 37 GLU OE2 O -2.828 -4.064 4.553 1.00 . A A . 40 GLU OE2 1 1 2 889 1 1 38 LYS C C -1.958 -6.158 2.693 1.00 . A A . 41 LYS C 1 1 2 890 1 1 38 LYS CA C -0.478 -6.394 2.394 1.00 . A A . 41 LYS CA 1 1 2 891 1 1 38 LYS CB C -0.110 -7.843 2.693 1.00 . A A . 41 LYS CB 1 1 2 892 1 1 38 LYS CD C 1.663 -9.449 3.484 1.00 . A A . 41 LYS CD 1 1 2 893 1 1 38 LYS CE C 0.616 -10.439 3.966 1.00 . A A . 41 LYS CE 1 1 2 894 1 1 38 LYS CG C 1.150 -8.017 3.530 1.00 . A A . 41 LYS CG 1 1 2 895 1 1 38 LYS H H 0.929 -5.912 3.860 1.00 . A A . 41 LYS H 1 1 2 896 1 1 38 LYS HA H -0.283 -6.184 1.355 1.00 . A A . 41 LYS HA 1 1 2 897 1 1 38 LYS HB2 H -0.923 -8.300 3.224 1.00 . A A . 41 LYS HB2 1 1 2 898 1 1 38 LYS HB3 H 0.039 -8.352 1.765 1.00 . A A . 41 LYS HB3 1 1 2 899 1 1 38 LYS HD2 H 1.926 -9.692 2.467 1.00 . A A . 41 LYS HD2 1 1 2 900 1 1 38 LYS HD3 H 2.536 -9.528 4.113 1.00 . A A . 41 LYS HD3 1 1 2 901 1 1 38 LYS HE2 H 0.298 -10.154 4.958 1.00 . A A . 41 LYS HE2 1 1 2 902 1 1 38 LYS HE3 H -0.229 -10.401 3.293 1.00 . A A . 41 LYS HE3 1 1 2 903 1 1 38 LYS HG2 H 1.915 -7.360 3.146 1.00 . A A . 41 LYS HG2 1 1 2 904 1 1 38 LYS HG3 H 0.929 -7.757 4.555 1.00 . A A . 41 LYS HG3 1 1 2 905 1 1 38 LYS HZ1 H 0.417 -12.478 4.373 1.00 . A A . 41 LYS HZ1 1 1 2 906 1 1 38 LYS HZ2 H 1.979 -11.879 4.622 1.00 . A A . 41 LYS HZ2 1 1 2 907 1 1 38 LYS HZ3 H 1.414 -12.136 3.049 1.00 . A A . 41 LYS HZ3 1 1 2 908 1 1 38 LYS N N 0.341 -5.515 3.196 1.00 . A A . 41 LYS N 1 1 2 909 1 1 38 LYS NZ N 1.143 -11.830 4.006 1.00 . A A . 41 LYS NZ 1 1 2 910 1 1 38 LYS O O -2.447 -6.554 3.752 1.00 . A A . 41 LYS O 1 1 2 911 1 1 39 PRO C C -4.997 -6.444 1.722 1.00 . A A . 42 PRO C 1 1 2 912 1 1 39 PRO CA C -4.115 -5.224 1.961 1.00 . A A . 42 PRO CA 1 1 2 913 1 1 39 PRO CB C -4.415 -4.128 0.924 1.00 . A A . 42 PRO CB 1 1 2 914 1 1 39 PRO CD C -2.239 -5.043 0.458 1.00 . A A . 42 PRO CD 1 1 2 915 1 1 39 PRO CG C -3.123 -3.854 0.218 1.00 . A A . 42 PRO CG 1 1 2 916 1 1 39 PRO HA H -4.297 -4.838 2.953 1.00 . A A . 42 PRO HA 1 1 2 917 1 1 39 PRO HB2 H -5.171 -4.477 0.235 1.00 . A A . 42 PRO HB2 1 1 2 918 1 1 39 PRO HB3 H -4.772 -3.246 1.433 1.00 . A A . 42 PRO HB3 1 1 2 919 1 1 39 PRO HD2 H -2.395 -5.793 -0.304 1.00 . A A . 42 PRO HD2 1 1 2 920 1 1 39 PRO HD3 H -1.202 -4.745 0.496 1.00 . A A . 42 PRO HD3 1 1 2 921 1 1 39 PRO HG2 H -3.303 -3.732 -0.840 1.00 . A A . 42 PRO HG2 1 1 2 922 1 1 39 PRO HG3 H -2.671 -2.963 0.626 1.00 . A A . 42 PRO HG3 1 1 2 923 1 1 39 PRO N N -2.699 -5.517 1.766 1.00 . A A . 42 PRO N 1 1 2 924 1 1 39 PRO O O -5.645 -6.563 0.682 1.00 . A A . 42 PRO O 1 1 3 925 1 1 12 SER C C -10.545 -1.620 -2.803 1.00 . A A . 15 SER C 1 1 3 926 1 1 12 SER CA C -10.325 -3.015 -3.376 1.00 . A A . 15 SER CA 1 1 3 927 1 1 12 SER CB C -11.266 -4.015 -2.700 1.00 . A A . 15 SER CB 1 1 3 928 1 1 12 SER H H -8.406 -3.031 -2.486 1.00 . A A . 15 SER H 1 1 3 929 1 1 12 SER HA H -10.536 -2.995 -4.434 1.00 . A A . 15 SER HA 1 1 3 930 1 1 12 SER HB2 H -11.173 -4.975 -3.184 1.00 . A A . 15 SER HB2 1 1 3 931 1 1 12 SER HB3 H -10.996 -4.108 -1.658 1.00 . A A . 15 SER HB3 1 1 3 932 1 1 12 SER HG H -12.866 -3.155 -1.969 1.00 . A A . 15 SER HG 1 1 3 933 1 1 12 SER N N -8.940 -3.434 -3.202 1.00 . A A . 15 SER N 1 1 3 934 1 1 12 SER O O -10.593 -0.637 -3.543 1.00 . A A . 15 SER O 1 1 3 935 1 1 12 SER OG O -12.615 -3.589 -2.787 1.00 . A A . 15 SER OG 1 1 3 936 1 1 13 MET C C -9.562 0.467 -0.613 1.00 . A A . 16 MET C 1 1 3 937 1 1 13 MET CA C -10.886 -0.258 -0.818 1.00 . A A . 16 MET CA 1 1 3 938 1 1 13 MET CB C -11.579 -0.454 0.534 1.00 . A A . 16 MET CB 1 1 3 939 1 1 13 MET CE C -12.716 -1.565 3.200 1.00 . A A . 16 MET CE 1 1 3 940 1 1 13 MET CG C -12.893 -1.210 0.448 1.00 . A A . 16 MET CG 1 1 3 941 1 1 13 MET H H -10.633 -2.357 -0.944 1.00 . A A . 16 MET H 1 1 3 942 1 1 13 MET HA H -11.518 0.345 -1.453 1.00 . A A . 16 MET HA 1 1 3 943 1 1 13 MET HB2 H -10.915 -1.001 1.188 1.00 . A A . 16 MET HB2 1 1 3 944 1 1 13 MET HB3 H -11.775 0.517 0.966 1.00 . A A . 16 MET HB3 1 1 3 945 1 1 13 MET HE1 H -11.866 -0.900 3.194 1.00 . A A . 16 MET HE1 1 1 3 946 1 1 13 MET HE2 H -12.387 -2.573 2.994 1.00 . A A . 16 MET HE2 1 1 3 947 1 1 13 MET HE3 H -13.190 -1.533 4.170 1.00 . A A . 16 MET HE3 1 1 3 948 1 1 13 MET HG2 H -13.461 -0.826 -0.386 1.00 . A A . 16 MET HG2 1 1 3 949 1 1 13 MET HG3 H -12.680 -2.256 0.285 1.00 . A A . 16 MET HG3 1 1 3 950 1 1 13 MET N N -10.677 -1.539 -1.483 1.00 . A A . 16 MET N 1 1 3 951 1 1 13 MET O O -9.533 1.587 -0.108 1.00 . A A . 16 MET O 1 1 3 952 1 1 13 MET SD S -13.887 -1.050 1.946 1.00 . A A . 16 MET SD 1 1 3 953 1 1 14 TRP C C -6.609 0.918 -2.190 1.00 . A A . 17 TRP C 1 1 3 954 1 1 14 TRP CA C -7.142 0.413 -0.858 1.00 . A A . 17 TRP CA 1 1 3 955 1 1 14 TRP CB C -6.161 -0.605 -0.270 1.00 . A A . 17 TRP CB 1 1 3 956 1 1 14 TRP CD1 C -7.653 -2.108 1.170 1.00 . A A . 17 TRP CD1 1 1 3 957 1 1 14 TRP CD2 C -6.077 -0.999 2.299 1.00 . A A . 17 TRP CD2 1 1 3 958 1 1 14 TRP CE2 C -6.812 -1.774 3.210 1.00 . A A . 17 TRP CE2 1 1 3 959 1 1 14 TRP CE3 C -5.028 -0.214 2.770 1.00 . A A . 17 TRP CE3 1 1 3 960 1 1 14 TRP CG C -6.629 -1.222 1.006 1.00 . A A . 17 TRP CG 1 1 3 961 1 1 14 TRP CH2 C -5.494 -1.006 5.009 1.00 . A A . 17 TRP CH2 1 1 3 962 1 1 14 TRP CZ2 C -6.531 -1.786 4.572 1.00 . A A . 17 TRP CZ2 1 1 3 963 1 1 14 TRP CZ3 C -4.745 -0.225 4.117 1.00 . A A . 17 TRP CZ3 1 1 3 964 1 1 14 TRP H H -8.554 -1.063 -1.416 1.00 . A A . 17 TRP H 1 1 3 965 1 1 14 TRP HA H -7.225 1.249 -0.182 1.00 . A A . 17 TRP HA 1 1 3 966 1 1 14 TRP HB2 H -5.999 -1.396 -0.979 1.00 . A A . 17 TRP HB2 1 1 3 967 1 1 14 TRP HB3 H -5.220 -0.110 -0.072 1.00 . A A . 17 TRP HB3 1 1 3 968 1 1 14 TRP HD1 H -8.272 -2.480 0.368 1.00 . A A . 17 TRP HD1 1 1 3 969 1 1 14 TRP HE1 H -8.432 -3.064 2.869 1.00 . A A . 17 TRP HE1 1 1 3 970 1 1 14 TRP HE3 H -4.440 0.393 2.097 1.00 . A A . 17 TRP HE3 1 1 3 971 1 1 14 TRP HH2 H -5.238 -0.983 6.058 1.00 . A A . 17 TRP HH2 1 1 3 972 1 1 14 TRP HZ2 H -7.100 -2.381 5.269 1.00 . A A . 17 TRP HZ2 1 1 3 973 1 1 14 TRP HZ3 H -3.937 0.375 4.496 1.00 . A A . 17 TRP HZ3 1 1 3 974 1 1 14 TRP N N -8.468 -0.175 -1.011 1.00 . A A . 17 TRP N 1 1 3 975 1 1 14 TRP NE1 N -7.771 -2.445 2.497 1.00 . A A . 17 TRP NE1 1 1 3 976 1 1 14 TRP O O -6.735 0.249 -3.216 1.00 . A A . 17 TRP O 1 1 3 977 1 1 15 THR C C -3.932 2.612 -3.334 1.00 . A A . 18 THR C 1 1 3 978 1 1 15 THR CA C -5.454 2.699 -3.361 1.00 . A A . 18 THR CA 1 1 3 979 1 1 15 THR CB C -5.878 4.169 -3.511 1.00 . A A . 18 THR CB 1 1 3 980 1 1 15 THR CG2 C -7.372 4.276 -3.775 1.00 . A A . 18 THR CG2 1 1 3 981 1 1 15 THR H H -5.965 2.597 -1.321 1.00 . A A . 18 THR H 1 1 3 982 1 1 15 THR HA H -5.828 2.146 -4.209 1.00 . A A . 18 THR HA 1 1 3 983 1 1 15 THR HB H -5.350 4.594 -4.347 1.00 . A A . 18 THR HB 1 1 3 984 1 1 15 THR HG1 H -5.026 4.344 -1.741 1.00 . A A . 18 THR HG1 1 1 3 985 1 1 15 THR HG21 H -7.651 5.317 -3.852 1.00 . A A . 18 THR HG21 1 1 3 986 1 1 15 THR HG22 H -7.915 3.817 -2.962 1.00 . A A . 18 THR HG22 1 1 3 987 1 1 15 THR HG23 H -7.612 3.770 -4.699 1.00 . A A . 18 THR HG23 1 1 3 988 1 1 15 THR N N -6.018 2.106 -2.165 1.00 . A A . 18 THR N 1 1 3 989 1 1 15 THR O O -3.298 2.967 -2.342 1.00 . A A . 18 THR O 1 1 3 990 1 1 15 THR OG1 O -5.543 4.901 -2.327 1.00 . A A . 18 THR OG1 1 1 3 991 1 1 16 GLU C C -1.280 3.132 -5.354 1.00 . A A . 19 GLU C 1 1 3 992 1 1 16 GLU CA C -1.901 2.000 -4.532 1.00 . A A . 19 GLU CA 1 1 3 993 1 1 16 GLU CB C -1.575 0.644 -5.167 1.00 . A A . 19 GLU CB 1 1 3 994 1 1 16 GLU CD C 0.196 -0.991 -5.922 1.00 . A A . 19 GLU CD 1 1 3 995 1 1 16 GLU CG C -0.088 0.368 -5.311 1.00 . A A . 19 GLU CG 1 1 3 996 1 1 16 GLU H H -3.911 1.886 -5.187 1.00 . A A . 19 GLU H 1 1 3 997 1 1 16 GLU HA H -1.493 2.027 -3.535 1.00 . A A . 19 GLU HA 1 1 3 998 1 1 16 GLU HB2 H -2.002 -0.135 -4.555 1.00 . A A . 19 GLU HB2 1 1 3 999 1 1 16 GLU HB3 H -2.023 0.603 -6.148 1.00 . A A . 19 GLU HB3 1 1 3 1000 1 1 16 GLU HG2 H 0.346 1.127 -5.944 1.00 . A A . 19 GLU HG2 1 1 3 1001 1 1 16 GLU HG3 H 0.370 0.410 -4.334 1.00 . A A . 19 GLU HG3 1 1 3 1002 1 1 16 GLU N N -3.350 2.151 -4.431 1.00 . A A . 19 GLU N 1 1 3 1003 1 1 16 GLU O O -1.462 3.202 -6.569 1.00 . A A . 19 GLU O 1 1 3 1004 1 1 16 GLU OE1 O 0.147 -1.104 -7.165 1.00 . A A . 19 GLU OE1 1 1 3 1005 1 1 16 GLU OE2 O 0.465 -1.940 -5.157 1.00 . A A . 19 GLU OE2 1 1 3 1006 1 1 17 HIS C C 1.471 5.468 -4.726 1.00 . A A . 20 HIS C 1 1 3 1007 1 1 17 HIS CA C 0.106 5.154 -5.343 1.00 . A A . 20 HIS CA 1 1 3 1008 1 1 17 HIS CB C -0.781 6.398 -5.252 1.00 . A A . 20 HIS CB 1 1 3 1009 1 1 17 HIS CD2 C -3.328 5.916 -5.276 1.00 . A A . 20 HIS CD2 1 1 3 1010 1 1 17 HIS CE1 C -3.677 6.145 -7.429 1.00 . A A . 20 HIS CE1 1 1 3 1011 1 1 17 HIS CG C -2.140 6.221 -5.852 1.00 . A A . 20 HIS CG 1 1 3 1012 1 1 17 HIS H H -0.431 3.904 -3.706 1.00 . A A . 20 HIS H 1 1 3 1013 1 1 17 HIS HA H 0.243 4.896 -6.382 1.00 . A A . 20 HIS HA 1 1 3 1014 1 1 17 HIS HB2 H -0.909 6.663 -4.213 1.00 . A A . 20 HIS HB2 1 1 3 1015 1 1 17 HIS HB3 H -0.292 7.214 -5.767 1.00 . A A . 20 HIS HB3 1 1 3 1016 1 1 17 HIS HD1 H -1.730 6.579 -7.888 1.00 . A A . 20 HIS HD1 1 1 3 1017 1 1 17 HIS HD2 H -3.505 5.738 -4.223 1.00 . A A . 20 HIS HD2 1 1 3 1018 1 1 17 HIS HE1 H -4.162 6.185 -8.394 1.00 . A A . 20 HIS HE1 1 1 3 1019 1 1 17 HIS HE2 H -5.197 5.585 -6.176 1.00 . A A . 20 HIS HE2 1 1 3 1020 1 1 17 HIS N N -0.543 4.018 -4.676 1.00 . A A . 20 HIS N 1 1 3 1021 1 1 17 HIS ND1 N -2.393 6.357 -7.200 1.00 . A A . 20 HIS ND1 1 1 3 1022 1 1 17 HIS NE2 N -4.266 5.876 -6.279 1.00 . A A . 20 HIS NE2 1 1 3 1023 1 1 17 HIS O O 1.635 5.416 -3.508 1.00 . A A . 20 HIS O 1 1 3 1024 1 1 18 LYS C C 3.787 7.284 -4.122 1.00 . A A . 21 LYS C 1 1 3 1025 1 1 18 LYS CA C 3.794 6.134 -5.121 1.00 . A A . 21 LYS CA 1 1 3 1026 1 1 18 LYS CB C 4.680 6.499 -6.309 1.00 . A A . 21 LYS CB 1 1 3 1027 1 1 18 LYS CD C 4.909 5.748 -8.689 1.00 . A A . 21 LYS CD 1 1 3 1028 1 1 18 LYS CE C 5.176 4.568 -9.610 1.00 . A A . 21 LYS CE 1 1 3 1029 1 1 18 LYS CG C 4.943 5.330 -7.229 1.00 . A A . 21 LYS CG 1 1 3 1030 1 1 18 LYS H H 2.264 5.790 -6.542 1.00 . A A . 21 LYS H 1 1 3 1031 1 1 18 LYS HA H 4.203 5.261 -4.639 1.00 . A A . 21 LYS HA 1 1 3 1032 1 1 18 LYS HB2 H 4.197 7.281 -6.878 1.00 . A A . 21 LYS HB2 1 1 3 1033 1 1 18 LYS HB3 H 5.627 6.864 -5.942 1.00 . A A . 21 LYS HB3 1 1 3 1034 1 1 18 LYS HD2 H 3.934 6.152 -8.914 1.00 . A A . 21 LYS HD2 1 1 3 1035 1 1 18 LYS HD3 H 5.664 6.502 -8.856 1.00 . A A . 21 LYS HD3 1 1 3 1036 1 1 18 LYS HE2 H 5.145 4.913 -10.633 1.00 . A A . 21 LYS HE2 1 1 3 1037 1 1 18 LYS HE3 H 6.158 4.175 -9.393 1.00 . A A . 21 LYS HE3 1 1 3 1038 1 1 18 LYS HG2 H 5.914 4.916 -7.003 1.00 . A A . 21 LYS HG2 1 1 3 1039 1 1 18 LYS HG3 H 4.183 4.587 -7.056 1.00 . A A . 21 LYS HG3 1 1 3 1040 1 1 18 LYS HZ1 H 3.218 3.845 -9.653 1.00 . A A . 21 LYS HZ1 1 1 3 1041 1 1 18 LYS HZ2 H 4.181 3.144 -8.452 1.00 . A A . 21 LYS HZ2 1 1 3 1042 1 1 18 LYS HZ3 H 4.384 2.691 -10.068 1.00 . A A . 21 LYS HZ3 1 1 3 1043 1 1 18 LYS N N 2.447 5.797 -5.578 1.00 . A A . 21 LYS N 1 1 3 1044 1 1 18 LYS NZ N 4.169 3.487 -9.434 1.00 . A A . 21 LYS NZ 1 1 3 1045 1 1 18 LYS O O 2.850 8.081 -4.077 1.00 . A A . 21 LYS O 1 1 3 1046 1 1 19 SER C C 6.366 8.215 -1.604 1.00 . A A . 22 SER C 1 1 3 1047 1 1 19 SER CA C 5.015 8.396 -2.319 1.00 . A A . 22 SER CA 1 1 3 1048 1 1 19 SER CB C 3.840 8.320 -1.338 1.00 . A A . 22 SER CB 1 1 3 1049 1 1 19 SER H H 5.564 6.690 -3.439 1.00 . A A . 22 SER H 1 1 3 1050 1 1 19 SER HA H 5.004 9.355 -2.815 1.00 . A A . 22 SER HA 1 1 3 1051 1 1 19 SER HB2 H 3.474 9.316 -1.143 1.00 . A A . 22 SER HB2 1 1 3 1052 1 1 19 SER HB3 H 3.052 7.728 -1.776 1.00 . A A . 22 SER HB3 1 1 3 1053 1 1 19 SER HG H 4.224 8.397 0.579 1.00 . A A . 22 SER HG 1 1 3 1054 1 1 19 SER N N 4.858 7.360 -3.335 1.00 . A A . 22 SER N 1 1 3 1055 1 1 19 SER O O 7.128 7.322 -1.984 1.00 . A A . 22 SER O 1 1 3 1056 1 1 19 SER OG O 4.225 7.731 -0.111 1.00 . A A . 22 SER OG 1 1 3 1057 1 1 20 PRO C C 8.643 7.623 0.118 1.00 . A A . 23 PRO C 1 1 3 1058 1 1 20 PRO CA C 7.953 8.984 0.166 1.00 . A A . 23 PRO CA 1 1 3 1059 1 1 20 PRO CB C 7.486 9.306 1.583 1.00 . A A . 23 PRO CB 1 1 3 1060 1 1 20 PRO CD C 5.898 10.172 -0.047 1.00 . A A . 23 PRO CD 1 1 3 1061 1 1 20 PRO CG C 6.300 10.213 1.414 1.00 . A A . 23 PRO CG 1 1 3 1062 1 1 20 PRO HA H 8.647 9.745 -0.158 1.00 . A A . 23 PRO HA 1 1 3 1063 1 1 20 PRO HB2 H 7.212 8.391 2.087 1.00 . A A . 23 PRO HB2 1 1 3 1064 1 1 20 PRO HB3 H 8.281 9.797 2.124 1.00 . A A . 23 PRO HB3 1 1 3 1065 1 1 20 PRO HD2 H 4.845 9.978 -0.139 1.00 . A A . 23 PRO HD2 1 1 3 1066 1 1 20 PRO HD3 H 6.154 11.099 -0.536 1.00 . A A . 23 PRO HD3 1 1 3 1067 1 1 20 PRO HG2 H 5.486 9.859 2.031 1.00 . A A . 23 PRO HG2 1 1 3 1068 1 1 20 PRO HG3 H 6.570 11.219 1.698 1.00 . A A . 23 PRO HG3 1 1 3 1069 1 1 20 PRO N N 6.698 9.058 -0.582 1.00 . A A . 23 PRO N 1 1 3 1070 1 1 20 PRO O O 7.993 6.577 0.162 1.00 . A A . 23 PRO O 1 1 3 1071 1 1 21 ASP C C 10.750 5.854 -1.421 1.00 . A A . 24 ASP C 1 1 3 1072 1 1 21 ASP CA C 10.807 6.463 -0.023 1.00 . A A . 24 ASP CA 1 1 3 1073 1 1 21 ASP CB C 10.388 5.435 1.033 1.00 . A A . 24 ASP CB 1 1 3 1074 1 1 21 ASP CG C 11.436 4.359 1.243 1.00 . A A . 24 ASP CG 1 1 3 1075 1 1 21 ASP H H 10.417 8.540 0.037 1.00 . A A . 24 ASP H 1 1 3 1076 1 1 21 ASP HA H 11.826 6.766 0.172 1.00 . A A . 24 ASP HA 1 1 3 1077 1 1 21 ASP HB2 H 10.225 5.941 1.974 1.00 . A A . 24 ASP HB2 1 1 3 1078 1 1 21 ASP HB3 H 9.469 4.962 0.720 1.00 . A A . 24 ASP HB3 1 1 3 1079 1 1 21 ASP N N 9.976 7.665 0.045 1.00 . A A . 24 ASP N 1 1 3 1080 1 1 21 ASP O O 11.333 4.801 -1.678 1.00 . A A . 24 ASP O 1 1 3 1081 1 1 21 ASP OD1 O 11.406 3.347 0.512 1.00 . A A . 24 ASP OD1 1 1 3 1082 1 1 21 ASP OD2 O 12.288 4.529 2.141 1.00 . A A . 24 ASP OD2 1 1 3 1083 1 1 22 GLY C C 9.219 4.734 -3.789 1.00 . A A . 25 GLY C 1 1 3 1084 1 1 22 GLY CA C 9.921 6.067 -3.688 1.00 . A A . 25 GLY CA 1 1 3 1085 1 1 22 GLY H H 9.588 7.354 -2.049 1.00 . A A . 25 GLY H 1 1 3 1086 1 1 22 GLY HA2 H 9.354 6.792 -4.260 1.00 . A A . 25 GLY HA2 1 1 3 1087 1 1 22 GLY HA3 H 10.906 5.979 -4.111 1.00 . A A . 25 GLY HA3 1 1 3 1088 1 1 22 GLY N N 10.040 6.532 -2.320 1.00 . A A . 25 GLY N 1 1 3 1089 1 1 22 GLY O O 9.621 3.864 -4.561 1.00 . A A . 25 GLY O 1 1 3 1090 1 1 23 ARG C C 5.903 3.713 -3.025 1.00 . A A . 26 ARG C 1 1 3 1091 1 1 23 ARG CA C 7.378 3.362 -3.006 1.00 . A A . 26 ARG CA 1 1 3 1092 1 1 23 ARG CB C 7.718 2.480 -1.802 1.00 . A A . 26 ARG CB 1 1 3 1093 1 1 23 ARG CD C 8.551 2.354 0.555 1.00 . A A . 26 ARG CD 1 1 3 1094 1 1 23 ARG CG C 7.962 3.248 -0.520 1.00 . A A . 26 ARG CG 1 1 3 1095 1 1 23 ARG CZ C 7.896 0.389 1.883 1.00 . A A . 26 ARG CZ 1 1 3 1096 1 1 23 ARG H H 7.902 5.321 -2.411 1.00 . A A . 26 ARG H 1 1 3 1097 1 1 23 ARG HA H 7.614 2.825 -3.912 1.00 . A A . 26 ARG HA 1 1 3 1098 1 1 23 ARG HB2 H 6.903 1.793 -1.632 1.00 . A A . 26 ARG HB2 1 1 3 1099 1 1 23 ARG HB3 H 8.609 1.916 -2.028 1.00 . A A . 26 ARG HB3 1 1 3 1100 1 1 23 ARG HD2 H 9.493 1.959 0.201 1.00 . A A . 26 ARG HD2 1 1 3 1101 1 1 23 ARG HD3 H 8.721 2.946 1.439 1.00 . A A . 26 ARG HD3 1 1 3 1102 1 1 23 ARG HE H 6.859 1.125 0.344 1.00 . A A . 26 ARG HE 1 1 3 1103 1 1 23 ARG HG2 H 8.648 4.052 -0.724 1.00 . A A . 26 ARG HG2 1 1 3 1104 1 1 23 ARG HG3 H 7.028 3.650 -0.166 1.00 . A A . 26 ARG HG3 1 1 3 1105 1 1 23 ARG HH11 H 9.623 1.265 2.465 1.00 . A A . 26 ARG HH11 1 1 3 1106 1 1 23 ARG HH12 H 9.147 -0.122 3.385 1.00 . A A . 26 ARG HH12 1 1 3 1107 1 1 23 ARG HH21 H 6.227 -0.701 1.553 1.00 . A A . 26 ARG HH21 1 1 3 1108 1 1 23 ARG HH22 H 7.218 -1.240 2.868 1.00 . A A . 26 ARG HH22 1 1 3 1109 1 1 23 ARG N N 8.166 4.583 -3.005 1.00 . A A . 26 ARG N 1 1 3 1110 1 1 23 ARG NE N 7.666 1.243 0.889 1.00 . A A . 26 ARG NE 1 1 3 1111 1 1 23 ARG NH1 N 8.977 0.522 2.640 1.00 . A A . 26 ARG NH1 1 1 3 1112 1 1 23 ARG NH2 N 7.043 -0.599 2.120 1.00 . A A . 26 ARG NH2 1 1 3 1113 1 1 23 ARG O O 5.533 4.860 -2.782 1.00 . A A . 26 ARG O 1 1 3 1114 1 1 24 THR C C 2.920 2.484 -2.130 1.00 . A A . 27 THR C 1 1 3 1115 1 1 24 THR CA C 3.633 2.984 -3.379 1.00 . A A . 27 THR CA 1 1 3 1116 1 1 24 THR CB C 3.013 2.326 -4.624 1.00 . A A . 27 THR CB 1 1 3 1117 1 1 24 THR CG2 C 3.285 0.829 -4.644 1.00 . A A . 27 THR CG2 1 1 3 1118 1 1 24 THR H H 5.405 1.832 -3.468 1.00 . A A . 27 THR H 1 1 3 1119 1 1 24 THR HA H 3.492 4.053 -3.456 1.00 . A A . 27 THR HA 1 1 3 1120 1 1 24 THR HB H 3.457 2.769 -5.504 1.00 . A A . 27 THR HB 1 1 3 1121 1 1 24 THR HG1 H 1.330 2.784 -5.539 1.00 . A A . 27 THR HG1 1 1 3 1122 1 1 24 THR HG21 H 4.350 0.657 -4.662 1.00 . A A . 27 THR HG21 1 1 3 1123 1 1 24 THR HG22 H 2.835 0.394 -5.524 1.00 . A A . 27 THR HG22 1 1 3 1124 1 1 24 THR HG23 H 2.861 0.374 -3.761 1.00 . A A . 27 THR HG23 1 1 3 1125 1 1 24 THR N N 5.062 2.735 -3.309 1.00 . A A . 27 THR N 1 1 3 1126 1 1 24 THR O O 3.150 1.363 -1.673 1.00 . A A . 27 THR O 1 1 3 1127 1 1 24 THR OG1 O 1.605 2.563 -4.646 1.00 . A A . 27 THR OG1 1 1 3 1128 1 1 25 TYR C C -0.119 2.616 -0.689 1.00 . A A . 28 TYR C 1 1 3 1129 1 1 25 TYR CA C 1.313 2.995 -0.373 1.00 . A A . 28 TYR CA 1 1 3 1130 1 1 25 TYR CB C 1.309 4.173 0.609 1.00 . A A . 28 TYR CB 1 1 3 1131 1 1 25 TYR CD1 C -0.805 5.512 0.235 1.00 . A A . 28 TYR CD1 1 1 3 1132 1 1 25 TYR CD2 C 1.256 6.431 -0.522 1.00 . A A . 28 TYR CD2 1 1 3 1133 1 1 25 TYR CE1 C -1.477 6.626 -0.232 1.00 . A A . 28 TYR CE1 1 1 3 1134 1 1 25 TYR CE2 C 0.590 7.547 -0.991 1.00 . A A . 28 TYR CE2 1 1 3 1135 1 1 25 TYR CG C 0.573 5.395 0.098 1.00 . A A . 28 TYR CG 1 1 3 1136 1 1 25 TYR CZ C -0.775 7.639 -0.845 1.00 . A A . 28 TYR CZ 1 1 3 1137 1 1 25 TYR H H 1.904 4.202 -2.002 1.00 . A A . 28 TYR H 1 1 3 1138 1 1 25 TYR HA H 1.802 2.154 0.093 1.00 . A A . 28 TYR HA 1 1 3 1139 1 1 25 TYR HB2 H 0.832 3.863 1.526 1.00 . A A . 28 TYR HB2 1 1 3 1140 1 1 25 TYR HB3 H 2.325 4.464 0.821 1.00 . A A . 28 TYR HB3 1 1 3 1141 1 1 25 TYR HD1 H -1.355 4.718 0.717 1.00 . A A . 28 TYR HD1 1 1 3 1142 1 1 25 TYR HD2 H 2.329 6.358 -0.637 1.00 . A A . 28 TYR HD2 1 1 3 1143 1 1 25 TYR HE1 H -2.548 6.699 -0.117 1.00 . A A . 28 TYR HE1 1 1 3 1144 1 1 25 TYR HE2 H 1.141 8.342 -1.471 1.00 . A A . 28 TYR HE2 1 1 3 1145 1 1 25 TYR HH H -1.145 8.949 -2.203 1.00 . A A . 28 TYR HH 1 1 3 1146 1 1 25 TYR N N 2.051 3.331 -1.582 1.00 . A A . 28 TYR N 1 1 3 1147 1 1 25 TYR O O -0.623 2.874 -1.786 1.00 . A A . 28 TYR O 1 1 3 1148 1 1 25 TYR OH O -1.441 8.750 -1.311 1.00 . A A . 28 TYR OH 1 1 3 1149 1 1 26 TYR C C -3.032 2.449 1.061 1.00 . A A . 29 TYR C 1 1 3 1150 1 1 26 TYR CA C -2.142 1.590 0.175 1.00 . A A . 29 TYR CA 1 1 3 1151 1 1 26 TYR CB C -2.279 0.123 0.564 1.00 . A A . 29 TYR CB 1 1 3 1152 1 1 26 TYR CD1 C -2.045 -1.325 -1.493 1.00 . A A . 29 TYR CD1 1 1 3 1153 1 1 26 TYR CD2 C -0.192 -1.183 0.001 1.00 . A A . 29 TYR CD2 1 1 3 1154 1 1 26 TYR CE1 C -1.326 -2.179 -2.309 1.00 . A A . 29 TYR CE1 1 1 3 1155 1 1 26 TYR CE2 C 0.534 -2.034 -0.811 1.00 . A A . 29 TYR CE2 1 1 3 1156 1 1 26 TYR CG C -1.491 -0.813 -0.325 1.00 . A A . 29 TYR CG 1 1 3 1157 1 1 26 TYR CZ C -0.038 -2.529 -1.964 1.00 . A A . 29 TYR CZ 1 1 3 1158 1 1 26 TYR H H -0.289 1.839 1.136 1.00 . A A . 29 TYR H 1 1 3 1159 1 1 26 TYR HA H -2.442 1.713 -0.854 1.00 . A A . 29 TYR HA 1 1 3 1160 1 1 26 TYR HB2 H -1.927 -0.006 1.576 1.00 . A A . 29 TYR HB2 1 1 3 1161 1 1 26 TYR HB3 H -3.316 -0.154 0.512 1.00 . A A . 29 TYR HB3 1 1 3 1162 1 1 26 TYR HD1 H -3.054 -1.049 -1.761 1.00 . A A . 29 TYR HD1 1 1 3 1163 1 1 26 TYR HD2 H 0.254 -0.794 0.904 1.00 . A A . 29 TYR HD2 1 1 3 1164 1 1 26 TYR HE1 H -1.774 -2.566 -3.212 1.00 . A A . 29 TYR HE1 1 1 3 1165 1 1 26 TYR HE2 H 1.542 -2.309 -0.541 1.00 . A A . 29 TYR HE2 1 1 3 1166 1 1 26 TYR HH H 1.138 -4.026 -2.237 1.00 . A A . 29 TYR HH 1 1 3 1167 1 1 26 TYR N N -0.763 2.010 0.297 1.00 . A A . 29 TYR N 1 1 3 1168 1 1 26 TYR O O -2.968 2.362 2.288 1.00 . A A . 29 TYR O 1 1 3 1169 1 1 26 TYR OH O 0.681 -3.376 -2.776 1.00 . A A . 29 TYR OH 1 1 3 1170 1 1 27 TYR C C -6.177 3.619 1.149 1.00 . A A . 30 TYR C 1 1 3 1171 1 1 27 TYR CA C -4.754 4.153 1.175 1.00 . A A . 30 TYR CA 1 1 3 1172 1 1 27 TYR CB C -4.707 5.572 0.599 1.00 . A A . 30 TYR CB 1 1 3 1173 1 1 27 TYR CD1 C -6.064 6.826 2.325 1.00 . A A . 30 TYR CD1 1 1 3 1174 1 1 27 TYR CD2 C -6.801 6.877 0.058 1.00 . A A . 30 TYR CD2 1 1 3 1175 1 1 27 TYR CE1 C -7.134 7.619 2.694 1.00 . A A . 30 TYR CE1 1 1 3 1176 1 1 27 TYR CE2 C -7.873 7.670 0.420 1.00 . A A . 30 TYR CE2 1 1 3 1177 1 1 27 TYR CG C -5.880 6.441 1.002 1.00 . A A . 30 TYR CG 1 1 3 1178 1 1 27 TYR CZ C -8.034 8.039 1.739 1.00 . A A . 30 TYR CZ 1 1 3 1179 1 1 27 TYR H H -3.872 3.295 -0.541 1.00 . A A . 30 TYR H 1 1 3 1180 1 1 27 TYR HA H -4.415 4.181 2.200 1.00 . A A . 30 TYR HA 1 1 3 1181 1 1 27 TYR HB2 H -3.806 6.058 0.940 1.00 . A A . 30 TYR HB2 1 1 3 1182 1 1 27 TYR HB3 H -4.690 5.514 -0.481 1.00 . A A . 30 TYR HB3 1 1 3 1183 1 1 27 TYR HD1 H -5.357 6.496 3.071 1.00 . A A . 30 TYR HD1 1 1 3 1184 1 1 27 TYR HD2 H -6.672 6.586 -0.974 1.00 . A A . 30 TYR HD2 1 1 3 1185 1 1 27 TYR HE1 H -7.259 7.909 3.727 1.00 . A A . 30 TYR HE1 1 1 3 1186 1 1 27 TYR HE2 H -8.579 7.999 -0.329 1.00 . A A . 30 TYR HE2 1 1 3 1187 1 1 27 TYR HH H -9.902 8.496 1.692 1.00 . A A . 30 TYR HH 1 1 3 1188 1 1 27 TYR N N -3.860 3.275 0.437 1.00 . A A . 30 TYR N 1 1 3 1189 1 1 27 TYR O O -6.854 3.665 0.122 1.00 . A A . 30 TYR O 1 1 3 1190 1 1 27 TYR OH O -9.101 8.829 2.103 1.00 . A A . 30 TYR OH 1 1 3 1191 1 1 28 ASN C C -8.935 3.743 2.426 1.00 . A A . 31 ASN C 1 1 3 1192 1 1 28 ASN CA C -7.961 2.582 2.417 1.00 . A A . 31 ASN CA 1 1 3 1193 1 1 28 ASN CB C -8.089 1.767 3.709 1.00 . A A . 31 ASN CB 1 1 3 1194 1 1 28 ASN CG C -9.241 0.780 3.678 1.00 . A A . 31 ASN CG 1 1 3 1195 1 1 28 ASN H H -6.039 3.125 3.076 1.00 . A A . 31 ASN H 1 1 3 1196 1 1 28 ASN HA H -8.160 1.949 1.566 1.00 . A A . 31 ASN HA 1 1 3 1197 1 1 28 ASN HB2 H -7.175 1.215 3.869 1.00 . A A . 31 ASN HB2 1 1 3 1198 1 1 28 ASN HB3 H -8.243 2.443 4.537 1.00 . A A . 31 ASN HB3 1 1 3 1199 1 1 28 ASN HD21 H -10.231 1.922 2.392 1.00 . A A . 31 ASN HD21 1 1 3 1200 1 1 28 ASN HD22 H -11.025 0.465 2.861 1.00 . A A . 31 ASN HD22 1 1 3 1201 1 1 28 ASN N N -6.621 3.114 2.292 1.00 . A A . 31 ASN N 1 1 3 1202 1 1 28 ASN ND2 N -10.269 1.088 2.898 1.00 . A A . 31 ASN ND2 1 1 3 1203 1 1 28 ASN O O -9.032 4.455 3.418 1.00 . A A . 31 ASN O 1 1 3 1204 1 1 28 ASN OD1 O -9.207 -0.253 4.347 1.00 . A A . 31 ASN OD1 1 1 3 1205 1 1 29 THR C C -11.655 5.005 2.235 1.00 . A A . 32 THR C 1 1 3 1206 1 1 29 THR CA C -10.574 5.040 1.158 1.00 . A A . 32 THR CA 1 1 3 1207 1 1 29 THR CB C -11.251 5.010 -0.224 1.00 . A A . 32 THR CB 1 1 3 1208 1 1 29 THR CG2 C -10.250 5.324 -1.326 1.00 . A A . 32 THR CG2 1 1 3 1209 1 1 29 THR H H -9.450 3.359 0.533 1.00 . A A . 32 THR H 1 1 3 1210 1 1 29 THR HA H -10.031 5.970 1.243 1.00 . A A . 32 THR HA 1 1 3 1211 1 1 29 THR HB H -12.030 5.759 -0.243 1.00 . A A . 32 THR HB 1 1 3 1212 1 1 29 THR HG1 H -12.616 3.621 0.097 1.00 . A A . 32 THR HG1 1 1 3 1213 1 1 29 THR HG21 H -9.437 4.612 -1.287 1.00 . A A . 32 THR HG21 1 1 3 1214 1 1 29 THR HG22 H -9.861 6.322 -1.186 1.00 . A A . 32 THR HG22 1 1 3 1215 1 1 29 THR HG23 H -10.739 5.260 -2.287 1.00 . A A . 32 THR HG23 1 1 3 1216 1 1 29 THR N N -9.612 3.950 1.299 1.00 . A A . 32 THR N 1 1 3 1217 1 1 29 THR O O -11.920 6.013 2.889 1.00 . A A . 32 THR O 1 1 3 1218 1 1 29 THR OG1 O -11.838 3.723 -0.457 1.00 . A A . 32 THR OG1 1 1 3 1219 1 1 30 GLU C C -12.801 3.801 4.823 1.00 . A A . 33 GLU C 1 1 3 1220 1 1 30 GLU CA C -13.340 3.699 3.402 1.00 . A A . 33 GLU CA 1 1 3 1221 1 1 30 GLU CB C -14.050 2.360 3.198 1.00 . A A . 33 GLU CB 1 1 3 1222 1 1 30 GLU CD C -15.704 0.668 4.090 1.00 . A A . 33 GLU CD 1 1 3 1223 1 1 30 GLU CG C -14.986 1.982 4.336 1.00 . A A . 33 GLU CG 1 1 3 1224 1 1 30 GLU H H -12.023 3.069 1.876 1.00 . A A . 33 GLU H 1 1 3 1225 1 1 30 GLU HA H -14.046 4.491 3.247 1.00 . A A . 33 GLU HA 1 1 3 1226 1 1 30 GLU HB2 H -14.628 2.410 2.288 1.00 . A A . 33 GLU HB2 1 1 3 1227 1 1 30 GLU HB3 H -13.302 1.589 3.096 1.00 . A A . 33 GLU HB3 1 1 3 1228 1 1 30 GLU HG2 H -14.411 1.893 5.245 1.00 . A A . 33 GLU HG2 1 1 3 1229 1 1 30 GLU HG3 H -15.723 2.761 4.453 1.00 . A A . 33 GLU HG3 1 1 3 1230 1 1 30 GLU N N -12.281 3.847 2.414 1.00 . A A . 33 GLU N 1 1 3 1231 1 1 30 GLU O O -13.133 4.729 5.561 1.00 . A A . 33 GLU O 1 1 3 1232 1 1 30 GLU OE1 O -16.647 0.652 3.270 1.00 . A A . 33 GLU OE1 1 1 3 1233 1 1 30 GLU OE2 O -15.325 -0.343 4.716 1.00 . A A . 33 GLU OE2 1 1 3 1234 1 1 31 THR C C -10.540 4.041 6.818 1.00 . A A . 34 THR C 1 1 3 1235 1 1 31 THR CA C -11.385 2.801 6.528 1.00 . A A . 34 THR CA 1 1 3 1236 1 1 31 THR CB C -10.514 1.544 6.719 1.00 . A A . 34 THR CB 1 1 3 1237 1 1 31 THR CG2 C -9.992 1.456 8.145 1.00 . A A . 34 THR CG2 1 1 3 1238 1 1 31 THR H H -11.741 2.144 4.546 1.00 . A A . 34 THR H 1 1 3 1239 1 1 31 THR HA H -12.196 2.758 7.240 1.00 . A A . 34 THR HA 1 1 3 1240 1 1 31 THR HB H -9.670 1.603 6.046 1.00 . A A . 34 THR HB 1 1 3 1241 1 1 31 THR HG1 H -10.682 -0.339 6.154 1.00 . A A . 34 THR HG1 1 1 3 1242 1 1 31 THR HG21 H -10.825 1.416 8.832 1.00 . A A . 34 THR HG21 1 1 3 1243 1 1 31 THR HG22 H -9.388 2.324 8.362 1.00 . A A . 34 THR HG22 1 1 3 1244 1 1 31 THR HG23 H -9.392 0.564 8.254 1.00 . A A . 34 THR HG23 1 1 3 1245 1 1 31 THR N N -11.969 2.843 5.191 1.00 . A A . 34 THR N 1 1 3 1246 1 1 31 THR O O -10.520 4.533 7.946 1.00 . A A . 34 THR O 1 1 3 1247 1 1 31 THR OG1 O -11.275 0.370 6.413 1.00 . A A . 34 THR OG1 1 1 3 1248 1 1 32 LYS C C -7.644 5.265 6.476 1.00 . A A . 35 LYS C 1 1 3 1249 1 1 32 LYS CA C -8.963 5.689 5.889 1.00 . A A . 35 LYS CA 1 1 3 1250 1 1 32 LYS CB C -9.597 6.822 6.708 1.00 . A A . 35 LYS CB 1 1 3 1251 1 1 32 LYS CD C -11.147 8.774 6.528 1.00 . A A . 35 LYS CD 1 1 3 1252 1 1 32 LYS CE C -12.594 9.183 6.311 1.00 . A A . 35 LYS CE 1 1 3 1253 1 1 32 LYS CG C -10.910 7.326 6.140 1.00 . A A . 35 LYS CG 1 1 3 1254 1 1 32 LYS H H -9.854 4.033 4.944 1.00 . A A . 35 LYS H 1 1 3 1255 1 1 32 LYS HA H -8.773 6.038 4.881 1.00 . A A . 35 LYS HA 1 1 3 1256 1 1 32 LYS HB2 H -9.776 6.470 7.712 1.00 . A A . 35 LYS HB2 1 1 3 1257 1 1 32 LYS HB3 H -8.909 7.654 6.750 1.00 . A A . 35 LYS HB3 1 1 3 1258 1 1 32 LYS HD2 H -10.896 8.898 7.570 1.00 . A A . 35 LYS HD2 1 1 3 1259 1 1 32 LYS HD3 H -10.509 9.405 5.927 1.00 . A A . 35 LYS HD3 1 1 3 1260 1 1 32 LYS HE2 H -12.845 9.031 5.272 1.00 . A A . 35 LYS HE2 1 1 3 1261 1 1 32 LYS HE3 H -13.227 8.562 6.927 1.00 . A A . 35 LYS HE3 1 1 3 1262 1 1 32 LYS HG2 H -10.880 7.251 5.063 1.00 . A A . 35 LYS HG2 1 1 3 1263 1 1 32 LYS HG3 H -11.717 6.721 6.526 1.00 . A A . 35 LYS HG3 1 1 3 1264 1 1 32 LYS HZ1 H -12.571 10.782 7.654 1.00 . A A . 35 LYS HZ1 1 1 3 1265 1 1 32 LYS HZ2 H -13.827 10.855 6.523 1.00 . A A . 35 LYS HZ2 1 1 3 1266 1 1 32 LYS HZ3 H -12.245 11.226 6.054 1.00 . A A . 35 LYS HZ3 1 1 3 1267 1 1 32 LYS N N -9.831 4.516 5.791 1.00 . A A . 35 LYS N 1 1 3 1268 1 1 32 LYS NZ N -12.825 10.612 6.660 1.00 . A A . 35 LYS NZ 1 1 3 1269 1 1 32 LYS O O -7.133 5.865 7.421 1.00 . A A . 35 LYS O 1 1 3 1270 1 1 33 GLN C C -4.803 3.671 5.228 1.00 . A A . 36 GLN C 1 1 3 1271 1 1 33 GLN CA C -5.830 3.669 6.342 1.00 . A A . 36 GLN CA 1 1 3 1272 1 1 33 GLN CB C -6.021 2.257 6.874 1.00 . A A . 36 GLN CB 1 1 3 1273 1 1 33 GLN CD C -3.881 1.994 8.193 1.00 . A A . 36 GLN CD 1 1 3 1274 1 1 33 GLN CG C -5.395 2.024 8.239 1.00 . A A . 36 GLN CG 1 1 3 1275 1 1 33 GLN H H -7.569 3.801 5.118 1.00 . A A . 36 GLN H 1 1 3 1276 1 1 33 GLN HA H -5.471 4.296 7.143 1.00 . A A . 36 GLN HA 1 1 3 1277 1 1 33 GLN HB2 H -7.073 2.069 6.950 1.00 . A A . 36 GLN HB2 1 1 3 1278 1 1 33 GLN HB3 H -5.586 1.556 6.176 1.00 . A A . 36 GLN HB3 1 1 3 1279 1 1 33 GLN HE21 H -3.805 3.963 8.460 1.00 . A A . 36 GLN HE21 1 1 3 1280 1 1 33 GLN HE22 H -2.279 3.167 8.308 1.00 . A A . 36 GLN HE22 1 1 3 1281 1 1 33 GLN HG2 H -5.702 2.820 8.902 1.00 . A A . 36 GLN HG2 1 1 3 1282 1 1 33 GLN HG3 H -5.747 1.080 8.627 1.00 . A A . 36 GLN HG3 1 1 3 1283 1 1 33 GLN N N -7.100 4.213 5.888 1.00 . A A . 36 GLN N 1 1 3 1284 1 1 33 GLN NE2 N -3.258 3.159 8.335 1.00 . A A . 36 GLN NE2 1 1 3 1285 1 1 33 GLN O O -4.805 2.816 4.345 1.00 . A A . 36 GLN O 1 1 3 1286 1 1 33 GLN OE1 O -3.277 0.935 8.031 1.00 . A A . 36 GLN OE1 1 1 3 1287 1 1 34 SER C C -1.513 4.308 4.906 1.00 . A A . 37 SER C 1 1 3 1288 1 1 34 SER CA C -2.843 4.791 4.330 1.00 . A A . 37 SER CA 1 1 3 1289 1 1 34 SER CB C -2.721 6.255 3.908 1.00 . A A . 37 SER CB 1 1 3 1290 1 1 34 SER H H -3.989 5.264 6.050 1.00 . A A . 37 SER H 1 1 3 1291 1 1 34 SER HA H -3.096 4.195 3.468 1.00 . A A . 37 SER HA 1 1 3 1292 1 1 34 SER HB2 H -3.632 6.565 3.420 1.00 . A A . 37 SER HB2 1 1 3 1293 1 1 34 SER HB3 H -2.556 6.867 4.783 1.00 . A A . 37 SER HB3 1 1 3 1294 1 1 34 SER HG H -1.936 6.944 2.252 1.00 . A A . 37 SER HG 1 1 3 1295 1 1 34 SER N N -3.913 4.633 5.310 1.00 . A A . 37 SER N 1 1 3 1296 1 1 34 SER O O -0.955 4.941 5.802 1.00 . A A . 37 SER O 1 1 3 1297 1 1 34 SER OG O -1.639 6.440 3.012 1.00 . A A . 37 SER OG 1 1 3 1298 1 1 35 THR C C 0.801 1.573 3.940 1.00 . A A . 38 THR C 1 1 3 1299 1 1 35 THR CA C 0.251 2.630 4.889 1.00 . A A . 38 THR CA 1 1 3 1300 1 1 35 THR CB C 0.074 2.003 6.284 1.00 . A A . 38 THR CB 1 1 3 1301 1 1 35 THR CG2 C -0.906 0.842 6.234 1.00 . A A . 38 THR CG2 1 1 3 1302 1 1 35 THR H H -1.492 2.714 3.677 1.00 . A A . 38 THR H 1 1 3 1303 1 1 35 THR HA H 0.964 3.436 4.967 1.00 . A A . 38 THR HA 1 1 3 1304 1 1 35 THR HB H -0.316 2.756 6.953 1.00 . A A . 38 THR HB 1 1 3 1305 1 1 35 THR HG1 H 1.663 2.159 7.444 1.00 . A A . 38 THR HG1 1 1 3 1306 1 1 35 THR HG21 H -1.857 1.190 5.860 1.00 . A A . 38 THR HG21 1 1 3 1307 1 1 35 THR HG22 H -1.036 0.437 7.227 1.00 . A A . 38 THR HG22 1 1 3 1308 1 1 35 THR HG23 H -0.521 0.074 5.580 1.00 . A A . 38 THR HG23 1 1 3 1309 1 1 35 THR N N -1.006 3.185 4.394 1.00 . A A . 38 THR N 1 1 3 1310 1 1 35 THR O O 0.113 1.143 3.015 1.00 . A A . 38 THR O 1 1 3 1311 1 1 35 THR OG1 O 1.337 1.545 6.781 1.00 . A A . 38 THR OG1 1 1 3 1312 1 1 36 TRP C C 2.551 -1.214 4.044 1.00 . A A . 39 TRP C 1 1 3 1313 1 1 36 TRP CA C 2.651 0.129 3.331 1.00 . A A . 39 TRP CA 1 1 3 1314 1 1 36 TRP CB C 4.137 0.426 3.069 1.00 . A A . 39 TRP CB 1 1 3 1315 1 1 36 TRP CD1 C 4.916 2.483 4.331 1.00 . A A . 39 TRP CD1 1 1 3 1316 1 1 36 TRP CD2 C 4.668 2.809 2.140 1.00 . A A . 39 TRP CD2 1 1 3 1317 1 1 36 TRP CE2 C 5.107 4.011 2.721 1.00 . A A . 39 TRP CE2 1 1 3 1318 1 1 36 TRP CE3 C 4.444 2.769 0.765 1.00 . A A . 39 TRP CE3 1 1 3 1319 1 1 36 TRP CG C 4.542 1.854 3.191 1.00 . A A . 39 TRP CG 1 1 3 1320 1 1 36 TRP CH2 C 5.107 5.088 0.628 1.00 . A A . 39 TRP CH2 1 1 3 1321 1 1 36 TRP CZ2 C 5.330 5.157 1.971 1.00 . A A . 39 TRP CZ2 1 1 3 1322 1 1 36 TRP CZ3 C 4.666 3.910 0.025 1.00 . A A . 39 TRP CZ3 1 1 3 1323 1 1 36 TRP H H 2.556 1.536 4.914 1.00 . A A . 39 TRP H 1 1 3 1324 1 1 36 TRP HA H 2.116 0.087 2.394 1.00 . A A . 39 TRP HA 1 1 3 1325 1 1 36 TRP HB2 H 4.729 -0.120 3.787 1.00 . A A . 39 TRP HB2 1 1 3 1326 1 1 36 TRP HB3 H 4.394 0.097 2.074 1.00 . A A . 39 TRP HB3 1 1 3 1327 1 1 36 TRP HD1 H 4.934 2.006 5.294 1.00 . A A . 39 TRP HD1 1 1 3 1328 1 1 36 TRP HE1 H 5.546 4.451 4.724 1.00 . A A . 39 TRP HE1 1 1 3 1329 1 1 36 TRP HE3 H 4.104 1.866 0.281 1.00 . A A . 39 TRP HE3 1 1 3 1330 1 1 36 TRP HH2 H 5.268 5.956 0.007 1.00 . A A . 39 TRP HH2 1 1 3 1331 1 1 36 TRP HZ2 H 5.674 6.071 2.420 1.00 . A A . 39 TRP HZ2 1 1 3 1332 1 1 36 TRP HZ3 H 4.501 3.900 -1.040 1.00 . A A . 39 TRP HZ3 1 1 3 1333 1 1 36 TRP N N 2.044 1.152 4.171 1.00 . A A . 39 TRP N 1 1 3 1334 1 1 36 TRP NE1 N 5.252 3.789 4.064 1.00 . A A . 39 TRP NE1 1 1 3 1335 1 1 36 TRP O O 3.331 -1.506 4.950 1.00 . A A . 39 TRP O 1 1 3 1336 1 1 37 GLU C C 0.453 -4.184 3.369 1.00 . A A . 40 GLU C 1 1 3 1337 1 1 37 GLU CA C 1.383 -3.340 4.232 1.00 . A A . 40 GLU CA 1 1 3 1338 1 1 37 GLU CB C 0.801 -3.178 5.643 1.00 . A A . 40 GLU CB 1 1 3 1339 1 1 37 GLU CD C -1.261 -3.044 7.100 1.00 . A A . 40 GLU CD 1 1 3 1340 1 1 37 GLU CG C -0.718 -3.242 5.698 1.00 . A A . 40 GLU CG 1 1 3 1341 1 1 37 GLU H H 0.989 -1.746 2.901 1.00 . A A . 40 GLU H 1 1 3 1342 1 1 37 GLU HA H 2.343 -3.830 4.298 1.00 . A A . 40 GLU HA 1 1 3 1343 1 1 37 GLU HB2 H 1.195 -3.957 6.276 1.00 . A A . 40 GLU HB2 1 1 3 1344 1 1 37 GLU HB3 H 1.109 -2.218 6.033 1.00 . A A . 40 GLU HB3 1 1 3 1345 1 1 37 GLU HG2 H -1.123 -2.471 5.060 1.00 . A A . 40 GLU HG2 1 1 3 1346 1 1 37 GLU HG3 H -1.038 -4.209 5.339 1.00 . A A . 40 GLU HG3 1 1 3 1347 1 1 37 GLU N N 1.586 -2.032 3.628 1.00 . A A . 40 GLU N 1 1 3 1348 1 1 37 GLU O O -0.221 -3.663 2.483 1.00 . A A . 40 GLU O 1 1 3 1349 1 1 37 GLU OE1 O -1.245 -4.014 7.886 1.00 . A A . 40 GLU OE1 1 1 3 1350 1 1 37 GLU OE2 O -1.702 -1.918 7.412 1.00 . A A . 40 GLU OE2 1 1 3 1351 1 1 38 LYS C C -1.897 -6.119 3.235 1.00 . A A . 41 LYS C 1 1 3 1352 1 1 38 LYS CA C -0.430 -6.396 2.902 1.00 . A A . 41 LYS CA 1 1 3 1353 1 1 38 LYS CB C -0.074 -7.835 3.269 1.00 . A A . 41 LYS CB 1 1 3 1354 1 1 38 LYS CD C 1.666 -9.443 4.117 1.00 . A A . 41 LYS CD 1 1 3 1355 1 1 38 LYS CE C 0.712 -10.290 4.943 1.00 . A A . 41 LYS CE 1 1 3 1356 1 1 38 LYS CG C 1.218 -7.990 4.060 1.00 . A A . 41 LYS CG 1 1 3 1357 1 1 38 LYS H H 0.993 -5.850 4.329 1.00 . A A . 41 LYS H 1 1 3 1358 1 1 38 LYS HA H -0.263 -6.246 1.846 1.00 . A A . 41 LYS HA 1 1 3 1359 1 1 38 LYS HB2 H -0.873 -8.245 3.858 1.00 . A A . 41 LYS HB2 1 1 3 1360 1 1 38 LYS HB3 H 0.024 -8.398 2.366 1.00 . A A . 41 LYS HB3 1 1 3 1361 1 1 38 LYS HD2 H 1.703 -9.837 3.113 1.00 . A A . 41 LYS HD2 1 1 3 1362 1 1 38 LYS HD3 H 2.650 -9.487 4.560 1.00 . A A . 41 LYS HD3 1 1 3 1363 1 1 38 LYS HE2 H -0.277 -10.218 4.515 1.00 . A A . 41 LYS HE2 1 1 3 1364 1 1 38 LYS HE3 H 1.043 -11.318 4.911 1.00 . A A . 41 LYS HE3 1 1 3 1365 1 1 38 LYS HG2 H 1.990 -7.403 3.590 1.00 . A A . 41 LYS HG2 1 1 3 1366 1 1 38 LYS HG3 H 1.055 -7.638 5.069 1.00 . A A . 41 LYS HG3 1 1 3 1367 1 1 38 LYS HZ1 H -0.026 -10.418 6.894 1.00 . A A . 41 LYS HZ1 1 1 3 1368 1 1 38 LYS HZ2 H 0.370 -8.845 6.414 1.00 . A A . 41 LYS HZ2 1 1 3 1369 1 1 38 LYS HZ3 H 1.596 -9.944 6.805 1.00 . A A . 41 LYS HZ3 1 1 3 1370 1 1 38 LYS N N 0.424 -5.487 3.631 1.00 . A A . 41 LYS N 1 1 3 1371 1 1 38 LYS NZ N 0.659 -9.843 6.363 1.00 . A A . 41 LYS NZ 1 1 3 1372 1 1 38 LYS O O -2.354 -6.445 4.330 1.00 . A A . 41 LYS O 1 1 3 1373 1 1 39 PRO C C -4.988 -6.369 2.241 1.00 . A A . 42 PRO C 1 1 3 1374 1 1 39 PRO CA C -4.062 -5.190 2.530 1.00 . A A . 42 PRO CA 1 1 3 1375 1 1 39 PRO CB C -4.334 -4.038 1.548 1.00 . A A . 42 PRO CB 1 1 3 1376 1 1 39 PRO CD C -2.246 -5.107 0.959 1.00 . A A . 42 PRO CD 1 1 3 1377 1 1 39 PRO CG C -3.098 -3.892 0.710 1.00 . A A . 42 PRO CG 1 1 3 1378 1 1 39 PRO HA H -4.220 -4.844 3.541 1.00 . A A . 42 PRO HA 1 1 3 1379 1 1 39 PRO HB2 H -5.190 -4.282 0.937 1.00 . A A . 42 PRO HB2 1 1 3 1380 1 1 39 PRO HB3 H -4.536 -3.135 2.104 1.00 . A A . 42 PRO HB3 1 1 3 1381 1 1 39 PRO HD2 H -2.465 -5.879 0.234 1.00 . A A . 42 PRO HD2 1 1 3 1382 1 1 39 PRO HD3 H -1.199 -4.849 0.936 1.00 . A A . 42 PRO HD3 1 1 3 1383 1 1 39 PRO HG2 H -3.372 -3.838 -0.332 1.00 . A A . 42 PRO HG2 1 1 3 1384 1 1 39 PRO HG3 H -2.565 -2.998 1.002 1.00 . A A . 42 PRO HG3 1 1 3 1385 1 1 39 PRO N N -2.662 -5.515 2.302 1.00 . A A . 42 PRO N 1 1 3 1386 1 1 39 PRO O O -5.758 -6.347 1.280 1.00 . A A . 42 PRO O 1 1 4 1387 1 1 12 SER C C -10.607 -1.835 -2.935 1.00 . A A . 15 SER C 1 1 4 1388 1 1 12 SER CA C -10.250 -3.128 -3.656 1.00 . A A . 15 SER CA 1 1 4 1389 1 1 12 SER CB C -11.142 -4.266 -3.160 1.00 . A A . 15 SER CB 1 1 4 1390 1 1 12 SER H H -8.391 -3.118 -2.647 1.00 . A A . 15 SER H 1 1 4 1391 1 1 12 SER HA H -10.404 -2.993 -4.716 1.00 . A A . 15 SER HA 1 1 4 1392 1 1 12 SER HB2 H -10.925 -4.462 -2.121 1.00 . A A . 15 SER HB2 1 1 4 1393 1 1 12 SER HB3 H -12.179 -3.980 -3.264 1.00 . A A . 15 SER HB3 1 1 4 1394 1 1 12 SER HG H -11.731 -5.717 -4.336 1.00 . A A . 15 SER HG 1 1 4 1395 1 1 12 SER N N -8.847 -3.460 -3.444 1.00 . A A . 15 SER N 1 1 4 1396 1 1 12 SER O O -10.932 -0.828 -3.565 1.00 . A A . 15 SER O 1 1 4 1397 1 1 12 SER OG O -10.917 -5.451 -3.902 1.00 . A A . 15 SER OG 1 1 4 1398 1 1 13 MET C C -9.583 0.112 -0.551 1.00 . A A . 16 MET C 1 1 4 1399 1 1 13 MET CA C -10.845 -0.709 -0.793 1.00 . A A . 16 MET CA 1 1 4 1400 1 1 13 MET CB C -11.448 -1.139 0.546 1.00 . A A . 16 MET CB 1 1 4 1401 1 1 13 MET CE C -13.307 -1.290 3.087 1.00 . A A . 16 MET CE 1 1 4 1402 1 1 13 MET CG C -12.788 -1.844 0.416 1.00 . A A . 16 MET CG 1 1 4 1403 1 1 13 MET H H -10.283 -2.711 -1.170 1.00 . A A . 16 MET H 1 1 4 1404 1 1 13 MET HA H -11.562 -0.102 -1.327 1.00 . A A . 16 MET HA 1 1 4 1405 1 1 13 MET HB2 H -10.759 -1.810 1.037 1.00 . A A . 16 MET HB2 1 1 4 1406 1 1 13 MET HB3 H -11.585 -0.263 1.164 1.00 . A A . 16 MET HB3 1 1 4 1407 1 1 13 MET HE1 H -12.345 -0.800 3.076 1.00 . A A . 16 MET HE1 1 1 4 1408 1 1 13 MET HE2 H -13.512 -1.653 4.083 1.00 . A A . 16 MET HE2 1 1 4 1409 1 1 13 MET HE3 H -14.074 -0.587 2.796 1.00 . A A . 16 MET HE3 1 1 4 1410 1 1 13 MET HG2 H -13.539 -1.114 0.154 1.00 . A A . 16 MET HG2 1 1 4 1411 1 1 13 MET HG3 H -12.717 -2.582 -0.369 1.00 . A A . 16 MET HG3 1 1 4 1412 1 1 13 MET N N -10.541 -1.875 -1.610 1.00 . A A . 16 MET N 1 1 4 1413 1 1 13 MET O O -9.627 1.157 0.095 1.00 . A A . 16 MET O 1 1 4 1414 1 1 13 MET SD S -13.292 -2.666 1.942 1.00 . A A . 16 MET SD 1 1 4 1415 1 1 14 TRP C C -6.661 0.858 -2.228 1.00 . A A . 17 TRP C 1 1 4 1416 1 1 14 TRP CA C -7.182 0.313 -0.908 1.00 . A A . 17 TRP CA 1 1 4 1417 1 1 14 TRP CB C -6.137 -0.632 -0.308 1.00 . A A . 17 TRP CB 1 1 4 1418 1 1 14 TRP CD1 C -7.567 -2.347 0.943 1.00 . A A . 17 TRP CD1 1 1 4 1419 1 1 14 TRP CD2 C -6.151 -1.193 2.229 1.00 . A A . 17 TRP CD2 1 1 4 1420 1 1 14 TRP CE2 C -6.868 -2.085 3.045 1.00 . A A . 17 TRP CE2 1 1 4 1421 1 1 14 TRP CE3 C -5.197 -0.361 2.810 1.00 . A A . 17 TRP CE3 1 1 4 1422 1 1 14 TRP CG C -6.616 -1.371 0.895 1.00 . A A . 17 TRP CG 1 1 4 1423 1 1 14 TRP CH2 C -5.716 -1.336 4.963 1.00 . A A . 17 TRP CH2 1 1 4 1424 1 1 14 TRP CZ2 C -6.659 -2.164 4.418 1.00 . A A . 17 TRP CZ2 1 1 4 1425 1 1 14 TRP CZ3 C -4.988 -0.440 4.169 1.00 . A A . 17 TRP CZ3 1 1 4 1426 1 1 14 TRP H H -8.492 -1.203 -1.593 1.00 . A A . 17 TRP H 1 1 4 1427 1 1 14 TRP HA H -7.335 1.136 -0.228 1.00 . A A . 17 TRP HA 1 1 4 1428 1 1 14 TRP HB2 H -5.845 -1.358 -1.047 1.00 . A A . 17 TRP HB2 1 1 4 1429 1 1 14 TRP HB3 H -5.269 -0.054 -0.018 1.00 . A A . 17 TRP HB3 1 1 4 1430 1 1 14 TRP HD1 H -8.110 -2.711 0.084 1.00 . A A . 17 TRP HD1 1 1 4 1431 1 1 14 TRP HE1 H -8.352 -3.474 2.526 1.00 . A A . 17 TRP HE1 1 1 4 1432 1 1 14 TRP HE3 H -4.624 0.334 2.212 1.00 . A A . 17 TRP HE3 1 1 4 1433 1 1 14 TRP HH2 H -5.520 -1.363 6.025 1.00 . A A . 17 TRP HH2 1 1 4 1434 1 1 14 TRP HZ2 H -7.216 -2.846 5.041 1.00 . A A . 17 TRP HZ2 1 1 4 1435 1 1 14 TRP HZ3 H -4.254 0.196 4.632 1.00 . A A . 17 TRP HZ3 1 1 4 1436 1 1 14 TRP N N -8.460 -0.372 -1.077 1.00 . A A . 17 TRP N 1 1 4 1437 1 1 14 TRP NE1 N -7.728 -2.780 2.235 1.00 . A A . 17 TRP NE1 1 1 4 1438 1 1 14 TRP O O -6.689 0.173 -3.252 1.00 . A A . 17 TRP O 1 1 4 1439 1 1 15 THR C C -4.113 2.797 -3.266 1.00 . A A . 18 THR C 1 1 4 1440 1 1 15 THR CA C -5.633 2.733 -3.374 1.00 . A A . 18 THR CA 1 1 4 1441 1 1 15 THR CB C -6.189 4.156 -3.549 1.00 . A A . 18 THR CB 1 1 4 1442 1 1 15 THR CG2 C -7.677 4.123 -3.864 1.00 . A A . 18 THR CG2 1 1 4 1443 1 1 15 THR H H -6.207 2.595 -1.354 1.00 . A A . 18 THR H 1 1 4 1444 1 1 15 THR HA H -5.910 2.144 -4.235 1.00 . A A . 18 THR HA 1 1 4 1445 1 1 15 THR HB H -5.673 4.626 -4.370 1.00 . A A . 18 THR HB 1 1 4 1446 1 1 15 THR HG1 H -6.655 4.730 -1.719 1.00 . A A . 18 THR HG1 1 1 4 1447 1 1 15 THR HG21 H -8.207 3.653 -3.049 1.00 . A A . 18 THR HG21 1 1 4 1448 1 1 15 THR HG22 H -7.842 3.561 -4.772 1.00 . A A . 18 THR HG22 1 1 4 1449 1 1 15 THR HG23 H -8.041 5.132 -3.994 1.00 . A A . 18 THR HG23 1 1 4 1450 1 1 15 THR N N -6.185 2.095 -2.195 1.00 . A A . 18 THR N 1 1 4 1451 1 1 15 THR O O -3.578 3.263 -2.262 1.00 . A A . 18 THR O 1 1 4 1452 1 1 15 THR OG1 O -5.965 4.921 -2.358 1.00 . A A . 18 THR OG1 1 1 4 1453 1 1 16 GLU C C -1.399 3.489 -5.118 1.00 . A A . 19 GLU C 1 1 4 1454 1 1 16 GLU CA C -1.958 2.345 -4.274 1.00 . A A . 19 GLU CA 1 1 4 1455 1 1 16 GLU CB C -1.414 0.992 -4.752 1.00 . A A . 19 GLU CB 1 1 4 1456 1 1 16 GLU CD C -0.573 -0.425 -6.671 1.00 . A A . 19 GLU CD 1 1 4 1457 1 1 16 GLU CG C -1.105 0.927 -6.239 1.00 . A A . 19 GLU CG 1 1 4 1458 1 1 16 GLU H H -3.879 1.978 -5.079 1.00 . A A . 19 GLU H 1 1 4 1459 1 1 16 GLU HA H -1.655 2.497 -3.252 1.00 . A A . 19 GLU HA 1 1 4 1460 1 1 16 GLU HB2 H -0.508 0.778 -4.212 1.00 . A A . 19 GLU HB2 1 1 4 1461 1 1 16 GLU HB3 H -2.142 0.227 -4.525 1.00 . A A . 19 GLU HB3 1 1 4 1462 1 1 16 GLU HG2 H -2.009 1.135 -6.792 1.00 . A A . 19 GLU HG2 1 1 4 1463 1 1 16 GLU HG3 H -0.364 1.677 -6.467 1.00 . A A . 19 GLU HG3 1 1 4 1464 1 1 16 GLU N N -3.414 2.338 -4.299 1.00 . A A . 19 GLU N 1 1 4 1465 1 1 16 GLU O O -1.765 3.659 -6.283 1.00 . A A . 19 GLU O 1 1 4 1466 1 1 16 GLU OE1 O 0.517 -0.812 -6.200 1.00 . A A . 19 GLU OE1 1 1 4 1467 1 1 16 GLU OE2 O -1.243 -1.094 -7.485 1.00 . A A . 19 GLU OE2 1 1 4 1468 1 1 17 HIS C C 1.491 5.707 -4.671 1.00 . A A . 20 HIS C 1 1 4 1469 1 1 17 HIS CA C 0.090 5.420 -5.200 1.00 . A A . 20 HIS CA 1 1 4 1470 1 1 17 HIS CB C -0.769 6.676 -5.034 1.00 . A A . 20 HIS CB 1 1 4 1471 1 1 17 HIS CD2 C -3.322 6.218 -5.105 1.00 . A A . 20 HIS CD2 1 1 4 1472 1 1 17 HIS CE1 C -3.669 6.669 -7.223 1.00 . A A . 20 HIS CE1 1 1 4 1473 1 1 17 HIS CG C -2.131 6.570 -5.647 1.00 . A A . 20 HIS CG 1 1 4 1474 1 1 17 HIS H H -0.287 4.109 -3.569 1.00 . A A . 20 HIS H 1 1 4 1475 1 1 17 HIS HA H 0.154 5.176 -6.250 1.00 . A A . 20 HIS HA 1 1 4 1476 1 1 17 HIS HB2 H -0.896 6.876 -3.981 1.00 . A A . 20 HIS HB2 1 1 4 1477 1 1 17 HIS HB3 H -0.258 7.510 -5.494 1.00 . A A . 20 HIS HB3 1 1 4 1478 1 1 17 HIS HD1 H -1.718 7.128 -7.637 1.00 . A A . 20 HIS HD1 1 1 4 1479 1 1 17 HIS HD2 H -3.501 5.937 -4.075 1.00 . A A . 20 HIS HD2 1 1 4 1480 1 1 17 HIS HE1 H -4.153 6.811 -8.177 1.00 . A A . 20 HIS HE1 1 1 4 1481 1 1 17 HIS HE2 H -5.226 6.170 -5.989 1.00 . A A . 20 HIS HE2 1 1 4 1482 1 1 17 HIS N N -0.522 4.285 -4.508 1.00 . A A . 20 HIS N 1 1 4 1483 1 1 17 HIS ND1 N -2.383 6.845 -6.974 1.00 . A A . 20 HIS ND1 1 1 4 1484 1 1 17 HIS NE2 N -4.260 6.287 -6.106 1.00 . A A . 20 HIS NE2 1 1 4 1485 1 1 17 HIS O O 1.707 5.759 -3.459 1.00 . A A . 20 HIS O 1 1 4 1486 1 1 18 LYS C C 3.876 7.370 -4.255 1.00 . A A . 21 LYS C 1 1 4 1487 1 1 18 LYS CA C 3.816 6.194 -5.216 1.00 . A A . 21 LYS CA 1 1 4 1488 1 1 18 LYS CB C 4.644 6.506 -6.458 1.00 . A A . 21 LYS CB 1 1 4 1489 1 1 18 LYS CD C 3.870 5.722 -8.711 1.00 . A A . 21 LYS CD 1 1 4 1490 1 1 18 LYS CE C 3.982 4.628 -9.760 1.00 . A A . 21 LYS CE 1 1 4 1491 1 1 18 LYS CG C 4.652 5.373 -7.456 1.00 . A A . 21 LYS CG 1 1 4 1492 1 1 18 LYS H H 2.229 5.770 -6.537 1.00 . A A . 21 LYS H 1 1 4 1493 1 1 18 LYS HA H 4.228 5.325 -4.728 1.00 . A A . 21 LYS HA 1 1 4 1494 1 1 18 LYS HB2 H 4.236 7.383 -6.939 1.00 . A A . 21 LYS HB2 1 1 4 1495 1 1 18 LYS HB3 H 5.662 6.706 -6.160 1.00 . A A . 21 LYS HB3 1 1 4 1496 1 1 18 LYS HD2 H 2.830 5.853 -8.452 1.00 . A A . 21 LYS HD2 1 1 4 1497 1 1 18 LYS HD3 H 4.259 6.643 -9.122 1.00 . A A . 21 LYS HD3 1 1 4 1498 1 1 18 LYS HE2 H 3.590 3.710 -9.348 1.00 . A A . 21 LYS HE2 1 1 4 1499 1 1 18 LYS HE3 H 3.399 4.911 -10.623 1.00 . A A . 21 LYS HE3 1 1 4 1500 1 1 18 LYS HG2 H 5.672 5.146 -7.728 1.00 . A A . 21 LYS HG2 1 1 4 1501 1 1 18 LYS HG3 H 4.199 4.514 -6.988 1.00 . A A . 21 LYS HG3 1 1 4 1502 1 1 18 LYS HZ1 H 5.790 5.280 -10.577 1.00 . A A . 21 LYS HZ1 1 1 4 1503 1 1 18 LYS HZ2 H 5.439 3.657 -10.902 1.00 . A A . 21 LYS HZ2 1 1 4 1504 1 1 18 LYS HZ3 H 5.968 4.115 -9.361 1.00 . A A . 21 LYS HZ3 1 1 4 1505 1 1 18 LYS N N 2.445 5.883 -5.588 1.00 . A A . 21 LYS N 1 1 4 1506 1 1 18 LYS NZ N 5.394 4.405 -10.179 1.00 . A A . 21 LYS NZ 1 1 4 1507 1 1 18 LYS O O 3.022 8.257 -4.280 1.00 . A A . 21 LYS O 1 1 4 1508 1 1 19 SER C C 6.475 8.259 -1.777 1.00 . A A . 22 SER C 1 1 4 1509 1 1 19 SER CA C 5.096 8.417 -2.432 1.00 . A A . 22 SER CA 1 1 4 1510 1 1 19 SER CB C 3.971 8.350 -1.396 1.00 . A A . 22 SER CB 1 1 4 1511 1 1 19 SER H H 5.540 6.625 -3.456 1.00 . A A . 22 SER H 1 1 4 1512 1 1 19 SER HA H 5.055 9.367 -2.942 1.00 . A A . 22 SER HA 1 1 4 1513 1 1 19 SER HB2 H 3.582 9.343 -1.225 1.00 . A A . 22 SER HB2 1 1 4 1514 1 1 19 SER HB3 H 3.182 7.715 -1.771 1.00 . A A . 22 SER HB3 1 1 4 1515 1 1 19 SER HG H 3.703 7.785 0.460 1.00 . A A . 22 SER HG 1 1 4 1516 1 1 19 SER N N 4.899 7.366 -3.416 1.00 . A A . 22 SER N 1 1 4 1517 1 1 19 SER O O 7.211 7.333 -2.141 1.00 . A A . 22 SER O 1 1 4 1518 1 1 19 SER OG O 4.432 7.825 -0.164 1.00 . A A . 22 SER OG 1 1 4 1519 1 1 20 PRO C C 8.714 7.696 -0.016 1.00 . A A . 23 PRO C 1 1 4 1520 1 1 20 PRO CA C 8.150 9.107 -0.140 1.00 . A A . 23 PRO CA 1 1 4 1521 1 1 20 PRO CB C 7.830 9.682 1.245 1.00 . A A . 23 PRO CB 1 1 4 1522 1 1 20 PRO CD C 6.098 10.312 -0.337 1.00 . A A . 23 PRO CD 1 1 4 1523 1 1 20 PRO CG C 6.512 10.394 1.112 1.00 . A A . 23 PRO CG 1 1 4 1524 1 1 20 PRO HA H 8.880 9.737 -0.628 1.00 . A A . 23 PRO HA 1 1 4 1525 1 1 20 PRO HB2 H 7.768 8.876 1.962 1.00 . A A . 23 PRO HB2 1 1 4 1526 1 1 20 PRO HB3 H 8.613 10.365 1.539 1.00 . A A . 23 PRO HB3 1 1 4 1527 1 1 20 PRO HD2 H 5.038 10.143 -0.415 1.00 . A A . 23 PRO HD2 1 1 4 1528 1 1 20 PRO HD3 H 6.376 11.210 -0.864 1.00 . A A . 23 PRO HD3 1 1 4 1529 1 1 20 PRO HG2 H 5.774 9.907 1.735 1.00 . A A . 23 PRO HG2 1 1 4 1530 1 1 20 PRO HG3 H 6.625 11.426 1.409 1.00 . A A . 23 PRO HG3 1 1 4 1531 1 1 20 PRO N N 6.861 9.158 -0.826 1.00 . A A . 23 PRO N 1 1 4 1532 1 1 20 PRO O O 7.964 6.723 0.075 1.00 . A A . 23 PRO O 1 1 4 1533 1 1 21 ASP C C 10.727 5.618 -1.263 1.00 . A A . 24 ASP C 1 1 4 1534 1 1 21 ASP CA C 10.747 6.329 0.089 1.00 . A A . 24 ASP CA 1 1 4 1535 1 1 21 ASP CB C 10.138 5.440 1.184 1.00 . A A . 24 ASP CB 1 1 4 1536 1 1 21 ASP CG C 10.184 6.095 2.551 1.00 . A A . 24 ASP CG 1 1 4 1537 1 1 21 ASP H H 10.572 8.432 -0.057 1.00 . A A . 24 ASP H 1 1 4 1538 1 1 21 ASP HA H 11.775 6.543 0.346 1.00 . A A . 24 ASP HA 1 1 4 1539 1 1 21 ASP HB2 H 9.109 5.232 0.941 1.00 . A A . 24 ASP HB2 1 1 4 1540 1 1 21 ASP HB3 H 10.683 4.511 1.234 1.00 . A A . 24 ASP HB3 1 1 4 1541 1 1 21 ASP N N 10.045 7.607 -0.002 1.00 . A A . 24 ASP N 1 1 4 1542 1 1 21 ASP O O 11.229 4.502 -1.402 1.00 . A A . 24 ASP O 1 1 4 1543 1 1 21 ASP OD1 O 9.228 6.822 2.894 1.00 . A A . 24 ASP OD1 1 1 4 1544 1 1 21 ASP OD2 O 11.177 5.882 3.279 1.00 . A A . 24 ASP OD2 1 1 4 1545 1 1 22 GLY C C 9.314 4.437 -3.640 1.00 . A A . 25 GLY C 1 1 4 1546 1 1 22 GLY CA C 10.061 5.740 -3.599 1.00 . A A . 25 GLY CA 1 1 4 1547 1 1 22 GLY H H 9.737 7.154 -2.073 1.00 . A A . 25 GLY H 1 1 4 1548 1 1 22 GLY HA2 H 9.547 6.446 -4.239 1.00 . A A . 25 GLY HA2 1 1 4 1549 1 1 22 GLY HA3 H 11.060 5.587 -3.971 1.00 . A A . 25 GLY HA3 1 1 4 1550 1 1 22 GLY N N 10.139 6.287 -2.258 1.00 . A A . 25 GLY N 1 1 4 1551 1 1 22 GLY O O 9.812 3.433 -4.148 1.00 . A A . 25 GLY O 1 1 4 1552 1 1 23 ARG C C 5.802 3.670 -3.078 1.00 . A A . 26 ARG C 1 1 4 1553 1 1 23 ARG CA C 7.268 3.278 -3.069 1.00 . A A . 26 ARG CA 1 1 4 1554 1 1 23 ARG CB C 7.593 2.427 -1.843 1.00 . A A . 26 ARG CB 1 1 4 1555 1 1 23 ARG CD C 8.902 2.377 0.288 1.00 . A A . 26 ARG CD 1 1 4 1556 1 1 23 ARG CG C 8.054 3.227 -0.640 1.00 . A A . 26 ARG CG 1 1 4 1557 1 1 23 ARG CZ C 11.337 2.013 0.354 1.00 . A A . 26 ARG CZ 1 1 4 1558 1 1 23 ARG H H 7.764 5.303 -2.730 1.00 . A A . 26 ARG H 1 1 4 1559 1 1 23 ARG HA H 7.474 2.702 -3.958 1.00 . A A . 26 ARG HA 1 1 4 1560 1 1 23 ARG HB2 H 6.709 1.882 -1.560 1.00 . A A . 26 ARG HB2 1 1 4 1561 1 1 23 ARG HB3 H 8.371 1.725 -2.102 1.00 . A A . 26 ARG HB3 1 1 4 1562 1 1 23 ARG HD2 H 9.076 2.928 1.196 1.00 . A A . 26 ARG HD2 1 1 4 1563 1 1 23 ARG HD3 H 8.363 1.469 0.518 1.00 . A A . 26 ARG HD3 1 1 4 1564 1 1 23 ARG HE H 10.191 1.793 -1.266 1.00 . A A . 26 ARG HE 1 1 4 1565 1 1 23 ARG HG2 H 8.639 4.067 -0.979 1.00 . A A . 26 ARG HG2 1 1 4 1566 1 1 23 ARG HG3 H 7.190 3.580 -0.099 1.00 . A A . 26 ARG HG3 1 1 4 1567 1 1 23 ARG HH11 H 10.518 2.566 2.117 1.00 . A A . 26 ARG HH11 1 1 4 1568 1 1 23 ARG HH12 H 12.231 2.309 2.142 1.00 . A A . 26 ARG HH12 1 1 4 1569 1 1 23 ARG HH21 H 12.445 1.454 -1.241 1.00 . A A . 26 ARG HH21 1 1 4 1570 1 1 23 ARG HH22 H 13.326 1.680 0.232 1.00 . A A . 26 ARG HH22 1 1 4 1571 1 1 23 ARG N N 8.105 4.461 -3.108 1.00 . A A . 26 ARG N 1 1 4 1572 1 1 23 ARG NE N 10.186 2.027 -0.314 1.00 . A A . 26 ARG NE 1 1 4 1573 1 1 23 ARG NH1 N 11.364 2.321 1.644 1.00 . A A . 26 ARG NH1 1 1 4 1574 1 1 23 ARG NH2 N 12.462 1.688 -0.270 1.00 . A A . 26 ARG NH2 1 1 4 1575 1 1 23 ARG O O 5.462 4.833 -2.877 1.00 . A A . 26 ARG O 1 1 4 1576 1 1 24 THR C C 2.822 2.527 -2.074 1.00 . A A . 27 THR C 1 1 4 1577 1 1 24 THR CA C 3.511 2.959 -3.362 1.00 . A A . 27 THR CA 1 1 4 1578 1 1 24 THR CB C 2.854 2.234 -4.554 1.00 . A A . 27 THR CB 1 1 4 1579 1 1 24 THR CG2 C 3.090 0.730 -4.483 1.00 . A A . 27 THR CG2 1 1 4 1580 1 1 24 THR H H 5.267 1.779 -3.413 1.00 . A A . 27 THR H 1 1 4 1581 1 1 24 THR HA H 3.379 4.025 -3.492 1.00 . A A . 27 THR HA 1 1 4 1582 1 1 24 THR HB H 3.293 2.609 -5.468 1.00 . A A . 27 THR HB 1 1 4 1583 1 1 24 THR HG1 H 0.967 1.674 -4.445 1.00 . A A . 27 THR HG1 1 1 4 1584 1 1 24 THR HG21 H 4.151 0.530 -4.508 1.00 . A A . 27 THR HG21 1 1 4 1585 1 1 24 THR HG22 H 2.613 0.251 -5.326 1.00 . A A . 27 THR HG22 1 1 4 1586 1 1 24 THR HG23 H 2.671 0.341 -3.566 1.00 . A A . 27 THR HG23 1 1 4 1587 1 1 24 THR N N 4.938 2.695 -3.302 1.00 . A A . 27 THR N 1 1 4 1588 1 1 24 THR O O 3.022 1.411 -1.593 1.00 . A A . 27 THR O 1 1 4 1589 1 1 24 THR OG1 O 1.447 2.496 -4.572 1.00 . A A . 27 THR OG1 1 1 4 1590 1 1 25 TYR C C -0.148 2.806 -0.568 1.00 . A A . 28 TYR C 1 1 4 1591 1 1 25 TYR CA C 1.301 3.132 -0.280 1.00 . A A . 28 TYR CA 1 1 4 1592 1 1 25 TYR CB C 1.383 4.310 0.702 1.00 . A A . 28 TYR CB 1 1 4 1593 1 1 25 TYR CD1 C -0.732 5.652 0.336 1.00 . A A . 28 TYR CD1 1 1 4 1594 1 1 25 TYR CD2 C 1.348 6.642 -0.268 1.00 . A A . 28 TYR CD2 1 1 4 1595 1 1 25 TYR CE1 C -1.398 6.790 -0.075 1.00 . A A . 28 TYR CE1 1 1 4 1596 1 1 25 TYR CE2 C 0.688 7.784 -0.681 1.00 . A A . 28 TYR CE2 1 1 4 1597 1 1 25 TYR CG C 0.652 5.558 0.247 1.00 . A A . 28 TYR CG 1 1 4 1598 1 1 25 TYR CZ C -0.685 7.852 -0.582 1.00 . A A . 28 TYR CZ 1 1 4 1599 1 1 25 TYR H H 1.891 4.294 -1.943 1.00 . A A . 28 TYR H 1 1 4 1600 1 1 25 TYR HA H 1.767 2.268 0.171 1.00 . A A . 28 TYR HA 1 1 4 1601 1 1 25 TYR HB2 H 0.955 4.008 1.646 1.00 . A A . 28 TYR HB2 1 1 4 1602 1 1 25 TYR HB3 H 2.420 4.570 0.854 1.00 . A A . 28 TYR HB3 1 1 4 1603 1 1 25 TYR HD1 H -1.290 4.818 0.735 1.00 . A A . 28 TYR HD1 1 1 4 1604 1 1 25 TYR HD2 H 2.425 6.587 -0.343 1.00 . A A . 28 TYR HD2 1 1 4 1605 1 1 25 TYR HE1 H -2.475 6.842 0.002 1.00 . A A . 28 TYR HE1 1 1 4 1606 1 1 25 TYR HE2 H 1.248 8.617 -1.079 1.00 . A A . 28 TYR HE2 1 1 4 1607 1 1 25 TYR HH H -1.996 9.235 -0.328 1.00 . A A . 28 TYR HH 1 1 4 1608 1 1 25 TYR N N 2.011 3.423 -1.515 1.00 . A A . 28 TYR N 1 1 4 1609 1 1 25 TYR O O -0.691 3.193 -1.606 1.00 . A A . 28 TYR O 1 1 4 1610 1 1 25 TYR OH O -1.346 8.988 -0.990 1.00 . A A . 28 TYR OH 1 1 4 1611 1 1 26 TYR C C -3.043 2.531 1.142 1.00 . A A . 29 TYR C 1 1 4 1612 1 1 26 TYR CA C -2.153 1.703 0.232 1.00 . A A . 29 TYR CA 1 1 4 1613 1 1 26 TYR CB C -2.296 0.223 0.560 1.00 . A A . 29 TYR CB 1 1 4 1614 1 1 26 TYR CD1 C -2.172 -1.030 -1.627 1.00 . A A . 29 TYR CD1 1 1 4 1615 1 1 26 TYR CD2 C -0.289 -1.117 -0.168 1.00 . A A . 29 TYR CD2 1 1 4 1616 1 1 26 TYR CE1 C -1.508 -1.827 -2.539 1.00 . A A . 29 TYR CE1 1 1 4 1617 1 1 26 TYR CE2 C 0.383 -1.910 -1.078 1.00 . A A . 29 TYR CE2 1 1 4 1618 1 1 26 TYR CG C -1.576 -0.664 -0.427 1.00 . A A . 29 TYR CG 1 1 4 1619 1 1 26 TYR CZ C -0.230 -2.262 -2.262 1.00 . A A . 29 TYR CZ 1 1 4 1620 1 1 26 TYR H H -0.274 1.845 1.172 1.00 . A A . 29 TYR H 1 1 4 1621 1 1 26 TYR HA H -2.449 1.866 -0.794 1.00 . A A . 29 TYR HA 1 1 4 1622 1 1 26 TYR HB2 H -1.886 0.037 1.541 1.00 . A A . 29 TYR HB2 1 1 4 1623 1 1 26 TYR HB3 H -3.340 -0.040 0.557 1.00 . A A . 29 TYR HB3 1 1 4 1624 1 1 26 TYR HD1 H -3.173 -0.686 -1.842 1.00 . A A . 29 TYR HD1 1 1 4 1625 1 1 26 TYR HD2 H 0.188 -0.842 0.761 1.00 . A A . 29 TYR HD2 1 1 4 1626 1 1 26 TYR HE1 H -1.990 -2.101 -3.467 1.00 . A A . 29 TYR HE1 1 1 4 1627 1 1 26 TYR HE2 H 1.383 -2.254 -0.859 1.00 . A A . 29 TYR HE2 1 1 4 1628 1 1 26 TYR HH H 0.346 -2.669 -4.050 1.00 . A A . 29 TYR HH 1 1 4 1629 1 1 26 TYR N N -0.767 2.101 0.365 1.00 . A A . 29 TYR N 1 1 4 1630 1 1 26 TYR O O -2.967 2.426 2.365 1.00 . A A . 29 TYR O 1 1 4 1631 1 1 26 TYR OH O 0.437 -3.047 -3.172 1.00 . A A . 29 TYR OH 1 1 4 1632 1 1 27 TYR C C -6.211 3.642 1.226 1.00 . A A . 30 TYR C 1 1 4 1633 1 1 27 TYR CA C -4.796 4.202 1.278 1.00 . A A . 30 TYR CA 1 1 4 1634 1 1 27 TYR CB C -4.762 5.626 0.713 1.00 . A A . 30 TYR CB 1 1 4 1635 1 1 27 TYR CD1 C -6.062 6.948 2.433 1.00 . A A . 30 TYR CD1 1 1 4 1636 1 1 27 TYR CD2 C -6.928 6.827 0.215 1.00 . A A . 30 TYR CD2 1 1 4 1637 1 1 27 TYR CE1 C -7.137 7.729 2.814 1.00 . A A . 30 TYR CE1 1 1 4 1638 1 1 27 TYR CE2 C -8.006 7.608 0.588 1.00 . A A . 30 TYR CE2 1 1 4 1639 1 1 27 TYR CG C -5.939 6.484 1.129 1.00 . A A . 30 TYR CG 1 1 4 1640 1 1 27 TYR CZ C -8.105 8.056 1.888 1.00 . A A . 30 TYR CZ 1 1 4 1641 1 1 27 TYR H H -3.897 3.383 -0.445 1.00 . A A . 30 TYR H 1 1 4 1642 1 1 27 TYR HA H -4.466 4.221 2.305 1.00 . A A . 30 TYR HA 1 1 4 1643 1 1 27 TYR HB2 H -3.862 6.116 1.053 1.00 . A A . 30 TYR HB2 1 1 4 1644 1 1 27 TYR HB3 H -4.750 5.577 -0.367 1.00 . A A . 30 TYR HB3 1 1 4 1645 1 1 27 TYR HD1 H -5.303 6.692 3.155 1.00 . A A . 30 TYR HD1 1 1 4 1646 1 1 27 TYR HD2 H -6.847 6.474 -0.803 1.00 . A A . 30 TYR HD2 1 1 4 1647 1 1 27 TYR HE1 H -7.216 8.081 3.831 1.00 . A A . 30 TYR HE1 1 1 4 1648 1 1 27 TYR HE2 H -8.764 7.863 -0.138 1.00 . A A . 30 TYR HE2 1 1 4 1649 1 1 27 TYR HH H -8.868 9.574 2.788 1.00 . A A . 30 TYR HH 1 1 4 1650 1 1 27 TYR N N -3.886 3.351 0.533 1.00 . A A . 30 TYR N 1 1 4 1651 1 1 27 TYR O O -6.899 3.749 0.210 1.00 . A A . 30 TYR O 1 1 4 1652 1 1 27 TYR OH O -9.178 8.833 2.264 1.00 . A A . 30 TYR OH 1 1 4 1653 1 1 28 ASN C C -8.961 3.624 2.375 1.00 . A A . 31 ASN C 1 1 4 1654 1 1 28 ASN CA C -7.968 2.480 2.426 1.00 . A A . 31 ASN CA 1 1 4 1655 1 1 28 ASN CB C -8.116 1.687 3.733 1.00 . A A . 31 ASN CB 1 1 4 1656 1 1 28 ASN CG C -9.215 0.639 3.675 1.00 . A A . 31 ASN CG 1 1 4 1657 1 1 28 ASN H H -6.044 2.991 3.104 1.00 . A A . 31 ASN H 1 1 4 1658 1 1 28 ASN HA H -8.126 1.826 1.580 1.00 . A A . 31 ASN HA 1 1 4 1659 1 1 28 ASN HB2 H -7.184 1.185 3.944 1.00 . A A . 31 ASN HB2 1 1 4 1660 1 1 28 ASN HB3 H -8.338 2.372 4.540 1.00 . A A . 31 ASN HB3 1 1 4 1661 1 1 28 ASN HD21 H -10.177 1.668 2.277 1.00 . A A . 31 ASN HD21 1 1 4 1662 1 1 28 ASN HD22 H -10.925 0.194 2.766 1.00 . A A . 31 ASN HD22 1 1 4 1663 1 1 28 ASN N N -6.635 3.041 2.331 1.00 . A A . 31 ASN N 1 1 4 1664 1 1 28 ASN ND2 N -10.205 0.857 2.820 1.00 . A A . 31 ASN ND2 1 1 4 1665 1 1 28 ASN O O -9.035 4.412 3.308 1.00 . A A . 31 ASN O 1 1 4 1666 1 1 28 ASN OD1 O -9.169 -0.360 4.391 1.00 . A A . 31 ASN OD1 1 1 4 1667 1 1 29 THR C C -11.769 4.785 2.113 1.00 . A A . 32 THR C 1 1 4 1668 1 1 29 THR CA C -10.658 4.804 1.068 1.00 . A A . 32 THR CA 1 1 4 1669 1 1 29 THR CB C -11.298 4.729 -0.331 1.00 . A A . 32 THR CB 1 1 4 1670 1 1 29 THR CG2 C -10.245 4.864 -1.419 1.00 . A A . 32 THR CG2 1 1 4 1671 1 1 29 THR H H -9.548 3.079 0.542 1.00 . A A . 32 THR H 1 1 4 1672 1 1 29 THR HA H -10.131 5.745 1.141 1.00 . A A . 32 THR HA 1 1 4 1673 1 1 29 THR HB H -12.004 5.542 -0.432 1.00 . A A . 32 THR HB 1 1 4 1674 1 1 29 THR HG1 H -12.865 3.651 -0.854 1.00 . A A . 32 THR HG1 1 1 4 1675 1 1 29 THR HG21 H -9.729 5.806 -1.306 1.00 . A A . 32 THR HG21 1 1 4 1676 1 1 29 THR HG22 H -10.720 4.829 -2.388 1.00 . A A . 32 THR HG22 1 1 4 1677 1 1 29 THR HG23 H -9.536 4.053 -1.337 1.00 . A A . 32 THR HG23 1 1 4 1678 1 1 29 THR N N -9.683 3.732 1.261 1.00 . A A . 32 THR N 1 1 4 1679 1 1 29 THR O O -12.127 5.825 2.666 1.00 . A A . 32 THR O 1 1 4 1680 1 1 29 THR OG1 O -11.994 3.487 -0.485 1.00 . A A . 32 THR OG1 1 1 4 1681 1 1 30 GLU C C -12.920 3.613 4.776 1.00 . A A . 33 GLU C 1 1 4 1682 1 1 30 GLU CA C -13.404 3.467 3.338 1.00 . A A . 33 GLU CA 1 1 4 1683 1 1 30 GLU CB C -14.086 2.115 3.143 1.00 . A A . 33 GLU CB 1 1 4 1684 1 1 30 GLU CD C -16.204 2.715 4.388 1.00 . A A . 33 GLU CD 1 1 4 1685 1 1 30 GLU CG C -15.051 1.739 4.259 1.00 . A A . 33 GLU CG 1 1 4 1686 1 1 30 GLU H H -11.987 2.806 1.918 1.00 . A A . 33 GLU H 1 1 4 1687 1 1 30 GLU HA H -14.117 4.245 3.139 1.00 . A A . 33 GLU HA 1 1 4 1688 1 1 30 GLU HB2 H -14.637 2.134 2.214 1.00 . A A . 33 GLU HB2 1 1 4 1689 1 1 30 GLU HB3 H -13.323 1.353 3.080 1.00 . A A . 33 GLU HB3 1 1 4 1690 1 1 30 GLU HG2 H -15.452 0.757 4.056 1.00 . A A . 33 GLU HG2 1 1 4 1691 1 1 30 GLU HG3 H -14.510 1.719 5.194 1.00 . A A . 33 GLU HG3 1 1 4 1692 1 1 30 GLU N N -12.319 3.606 2.378 1.00 . A A . 33 GLU N 1 1 4 1693 1 1 30 GLU O O -13.456 4.409 5.546 1.00 . A A . 33 GLU O 1 1 4 1694 1 1 30 GLU OE1 O -17.234 2.509 3.712 1.00 . A A . 33 GLU OE1 1 1 4 1695 1 1 30 GLU OE2 O -16.077 3.685 5.163 1.00 . A A . 33 GLU OE2 1 1 4 1696 1 1 31 THR C C -10.487 4.091 6.731 1.00 . A A . 34 THR C 1 1 4 1697 1 1 31 THR CA C -11.359 2.861 6.480 1.00 . A A . 34 THR CA 1 1 4 1698 1 1 31 THR CB C -10.528 1.595 6.763 1.00 . A A . 34 THR CB 1 1 4 1699 1 1 31 THR CG2 C -10.076 1.553 8.216 1.00 . A A . 34 THR CG2 1 1 4 1700 1 1 31 THR H H -11.516 2.243 4.459 1.00 . A A . 34 THR H 1 1 4 1701 1 1 31 THR HA H -12.188 2.876 7.170 1.00 . A A . 34 THR HA 1 1 4 1702 1 1 31 THR HB H -9.652 1.607 6.129 1.00 . A A . 34 THR HB 1 1 4 1703 1 1 31 THR HG1 H -10.846 -0.351 6.801 1.00 . A A . 34 THR HG1 1 1 4 1704 1 1 31 THR HG21 H -9.483 2.429 8.435 1.00 . A A . 34 THR HG21 1 1 4 1705 1 1 31 THR HG22 H -9.484 0.666 8.384 1.00 . A A . 34 THR HG22 1 1 4 1706 1 1 31 THR HG23 H -10.942 1.535 8.862 1.00 . A A . 34 THR HG23 1 1 4 1707 1 1 31 THR N N -11.906 2.841 5.127 1.00 . A A . 34 THR N 1 1 4 1708 1 1 31 THR O O -10.442 4.605 7.849 1.00 . A A . 34 THR O 1 1 4 1709 1 1 31 THR OG1 O -11.301 0.426 6.469 1.00 . A A . 34 THR OG1 1 1 4 1710 1 1 32 LYS C C -7.581 5.241 6.329 1.00 . A A . 35 LYS C 1 1 4 1711 1 1 32 LYS CA C -8.894 5.692 5.751 1.00 . A A . 35 LYS CA 1 1 4 1712 1 1 32 LYS CB C -9.495 6.848 6.562 1.00 . A A . 35 LYS CB 1 1 4 1713 1 1 32 LYS CD C -11.330 8.554 6.787 1.00 . A A . 35 LYS CD 1 1 4 1714 1 1 32 LYS CE C -11.789 8.167 8.183 1.00 . A A . 35 LYS CE 1 1 4 1715 1 1 32 LYS CG C -10.820 7.350 6.011 1.00 . A A . 35 LYS CG 1 1 4 1716 1 1 32 LYS H H -9.833 4.040 4.848 1.00 . A A . 35 LYS H 1 1 4 1717 1 1 32 LYS HA H -8.712 6.024 4.736 1.00 . A A . 35 LYS HA 1 1 4 1718 1 1 32 LYS HB2 H -9.651 6.519 7.578 1.00 . A A . 35 LYS HB2 1 1 4 1719 1 1 32 LYS HB3 H -8.796 7.671 6.564 1.00 . A A . 35 LYS HB3 1 1 4 1720 1 1 32 LYS HD2 H -10.534 9.280 6.869 1.00 . A A . 35 LYS HD2 1 1 4 1721 1 1 32 LYS HD3 H -12.162 8.989 6.251 1.00 . A A . 35 LYS HD3 1 1 4 1722 1 1 32 LYS HE2 H -12.603 7.462 8.098 1.00 . A A . 35 LYS HE2 1 1 4 1723 1 1 32 LYS HE3 H -10.964 7.703 8.703 1.00 . A A . 35 LYS HE3 1 1 4 1724 1 1 32 LYS HG2 H -10.686 7.631 4.978 1.00 . A A . 35 LYS HG2 1 1 4 1725 1 1 32 LYS HG3 H -11.550 6.556 6.079 1.00 . A A . 35 LYS HG3 1 1 4 1726 1 1 32 LYS HZ1 H -13.042 9.813 8.472 1.00 . A A . 35 LYS HZ1 1 1 4 1727 1 1 32 LYS HZ2 H -11.477 10.031 9.073 1.00 . A A . 35 LYS HZ2 1 1 4 1728 1 1 32 LYS HZ3 H -12.573 9.050 9.907 1.00 . A A . 35 LYS HZ3 1 1 4 1729 1 1 32 LYS N N -9.786 4.536 5.685 1.00 . A A . 35 LYS N 1 1 4 1730 1 1 32 LYS NZ N -12.253 9.348 8.963 1.00 . A A . 35 LYS NZ 1 1 4 1731 1 1 32 LYS O O -7.035 5.847 7.252 1.00 . A A . 35 LYS O 1 1 4 1732 1 1 33 GLN C C -4.754 3.657 5.142 1.00 . A A . 36 GLN C 1 1 4 1733 1 1 33 GLN CA C -5.826 3.576 6.212 1.00 . A A . 36 GLN CA 1 1 4 1734 1 1 33 GLN CB C -6.035 2.124 6.624 1.00 . A A . 36 GLN CB 1 1 4 1735 1 1 33 GLN CD C -4.399 2.231 8.547 1.00 . A A . 36 GLN CD 1 1 4 1736 1 1 33 GLN CG C -4.822 1.495 7.289 1.00 . A A . 36 GLN CG 1 1 4 1737 1 1 33 GLN H H -7.569 3.746 4.999 1.00 . A A . 36 GLN H 1 1 4 1738 1 1 33 GLN HA H -5.497 4.137 7.074 1.00 . A A . 36 GLN HA 1 1 4 1739 1 1 33 GLN HB2 H -6.861 2.082 7.311 1.00 . A A . 36 GLN HB2 1 1 4 1740 1 1 33 GLN HB3 H -6.279 1.544 5.745 1.00 . A A . 36 GLN HB3 1 1 4 1741 1 1 33 GLN HE21 H -3.191 3.401 7.487 1.00 . A A . 36 GLN HE21 1 1 4 1742 1 1 33 GLN HE22 H -3.223 3.702 9.187 1.00 . A A . 36 GLN HE22 1 1 4 1743 1 1 33 GLN HG2 H -5.059 0.475 7.551 1.00 . A A . 36 GLN HG2 1 1 4 1744 1 1 33 GLN HG3 H -3.998 1.505 6.590 1.00 . A A . 36 GLN HG3 1 1 4 1745 1 1 33 GLN N N -7.080 4.156 5.757 1.00 . A A . 36 GLN N 1 1 4 1746 1 1 33 GLN NE2 N -3.515 3.210 8.391 1.00 . A A . 36 GLN NE2 1 1 4 1747 1 1 33 GLN O O -4.710 2.852 4.216 1.00 . A A . 36 GLN O 1 1 4 1748 1 1 33 GLN OE1 O -4.861 1.922 9.645 1.00 . A A . 36 GLN OE1 1 1 4 1749 1 1 34 SER C C -1.452 4.325 4.981 1.00 . A A . 37 SER C 1 1 4 1750 1 1 34 SER CA C -2.766 4.825 4.382 1.00 . A A . 37 SER CA 1 1 4 1751 1 1 34 SER CB C -2.646 6.310 4.032 1.00 . A A . 37 SER CB 1 1 4 1752 1 1 34 SER H H -3.972 5.208 6.085 1.00 . A A . 37 SER H 1 1 4 1753 1 1 34 SER HA H -2.986 4.268 3.484 1.00 . A A . 37 SER HA 1 1 4 1754 1 1 34 SER HB2 H -3.553 6.636 3.544 1.00 . A A . 37 SER HB2 1 1 4 1755 1 1 34 SER HB3 H -2.498 6.879 4.937 1.00 . A A . 37 SER HB3 1 1 4 1756 1 1 34 SER HG H -1.312 5.720 2.726 1.00 . A A . 37 SER HG 1 1 4 1757 1 1 34 SER N N -3.868 4.615 5.314 1.00 . A A . 37 SER N 1 1 4 1758 1 1 34 SER O O -0.914 4.940 5.901 1.00 . A A . 37 SER O 1 1 4 1759 1 1 34 SER OG O -1.553 6.541 3.161 1.00 . A A . 37 SER OG 1 1 4 1760 1 1 35 THR C C 0.895 1.616 4.016 1.00 . A A . 38 THR C 1 1 4 1761 1 1 35 THR CA C 0.313 2.645 4.976 1.00 . A A . 38 THR CA 1 1 4 1762 1 1 35 THR CB C 0.097 1.983 6.350 1.00 . A A . 38 THR CB 1 1 4 1763 1 1 35 THR CG2 C -0.981 0.912 6.271 1.00 . A A . 38 THR CG2 1 1 4 1764 1 1 35 THR H H -1.400 2.754 3.721 1.00 . A A . 38 THR H 1 1 4 1765 1 1 35 THR HA H 1.021 3.452 5.096 1.00 . A A . 38 THR HA 1 1 4 1766 1 1 35 THR HB H -0.220 2.741 7.052 1.00 . A A . 38 THR HB 1 1 4 1767 1 1 35 THR HG1 H 1.266 1.247 7.760 1.00 . A A . 38 THR HG1 1 1 4 1768 1 1 35 THR HG21 H -0.688 0.158 5.557 1.00 . A A . 38 THR HG21 1 1 4 1769 1 1 35 THR HG22 H -1.912 1.362 5.959 1.00 . A A . 38 THR HG22 1 1 4 1770 1 1 35 THR HG23 H -1.109 0.459 7.243 1.00 . A A . 38 THR HG23 1 1 4 1771 1 1 35 THR N N -0.932 3.212 4.460 1.00 . A A . 38 THR N 1 1 4 1772 1 1 35 THR O O 0.235 1.207 3.059 1.00 . A A . 38 THR O 1 1 4 1773 1 1 35 THR OG1 O 1.321 1.401 6.813 1.00 . A A . 38 THR OG1 1 1 4 1774 1 1 36 TRP C C 2.675 -1.166 4.086 1.00 . A A . 39 TRP C 1 1 4 1775 1 1 36 TRP CA C 2.777 0.201 3.421 1.00 . A A . 39 TRP CA 1 1 4 1776 1 1 36 TRP CB C 4.268 0.510 3.216 1.00 . A A . 39 TRP CB 1 1 4 1777 1 1 36 TRP CD1 C 5.029 2.639 4.371 1.00 . A A . 39 TRP CD1 1 1 4 1778 1 1 36 TRP CD2 C 4.756 2.852 2.166 1.00 . A A . 39 TRP CD2 1 1 4 1779 1 1 36 TRP CE2 C 5.188 4.085 2.683 1.00 . A A . 39 TRP CE2 1 1 4 1780 1 1 36 TRP CE3 C 4.519 2.743 0.796 1.00 . A A . 39 TRP CE3 1 1 4 1781 1 1 36 TRP CG C 4.652 1.948 3.265 1.00 . A A . 39 TRP CG 1 1 4 1782 1 1 36 TRP CH2 C 5.155 5.063 0.542 1.00 . A A . 39 TRP CH2 1 1 4 1783 1 1 36 TRP CZ2 C 5.393 5.196 1.879 1.00 . A A . 39 TRP CZ2 1 1 4 1784 1 1 36 TRP CZ3 C 4.722 3.851 -0.001 1.00 . A A . 39 TRP CZ3 1 1 4 1785 1 1 36 TRP H H 2.620 1.560 5.039 1.00 . A A . 39 TRP H 1 1 4 1786 1 1 36 TRP HA H 2.273 0.183 2.465 1.00 . A A . 39 TRP HA 1 1 4 1787 1 1 36 TRP HB2 H 4.831 0.019 3.993 1.00 . A A . 39 TRP HB2 1 1 4 1788 1 1 36 TRP HB3 H 4.579 0.123 2.257 1.00 . A A . 39 TRP HB3 1 1 4 1789 1 1 36 TRP HD1 H 5.061 2.213 5.360 1.00 . A A . 39 TRP HD1 1 1 4 1790 1 1 36 TRP HE1 H 5.653 4.629 4.652 1.00 . A A . 39 TRP HE1 1 1 4 1791 1 1 36 TRP HE3 H 4.183 1.814 0.358 1.00 . A A . 39 TRP HE3 1 1 4 1792 1 1 36 TRP HH2 H 5.302 5.902 -0.121 1.00 . A A . 39 TRP HH2 1 1 4 1793 1 1 36 TRP HZ2 H 5.727 6.135 2.283 1.00 . A A . 39 TRP HZ2 1 1 4 1794 1 1 36 TRP HZ3 H 4.545 3.787 -1.062 1.00 . A A . 39 TRP HZ3 1 1 4 1795 1 1 36 TRP N N 2.135 1.195 4.270 1.00 . A A . 39 TRP N 1 1 4 1796 1 1 36 TRP NE1 N 5.353 3.931 4.032 1.00 . A A . 39 TRP NE1 1 1 4 1797 1 1 36 TRP O O 3.426 -1.470 5.013 1.00 . A A . 39 TRP O 1 1 4 1798 1 1 37 GLU C C 0.660 -4.143 3.251 1.00 . A A . 40 GLU C 1 1 4 1799 1 1 37 GLU CA C 1.550 -3.316 4.167 1.00 . A A . 40 GLU CA 1 1 4 1800 1 1 37 GLU CB C 0.931 -3.213 5.568 1.00 . A A . 40 GLU CB 1 1 4 1801 1 1 37 GLU CD C -1.156 -3.213 6.989 1.00 . A A . 40 GLU CD 1 1 4 1802 1 1 37 GLU CG C -0.584 -3.346 5.591 1.00 . A A . 40 GLU CG 1 1 4 1803 1 1 37 GLU H H 1.169 -1.697 2.873 1.00 . A A . 40 GLU H 1 1 4 1804 1 1 37 GLU HA H 2.517 -3.791 4.241 1.00 . A A . 40 GLU HA 1 1 4 1805 1 1 37 GLU HB2 H 1.349 -3.988 6.192 1.00 . A A . 40 GLU HB2 1 1 4 1806 1 1 37 GLU HB3 H 1.188 -2.249 5.986 1.00 . A A . 40 GLU HB3 1 1 4 1807 1 1 37 GLU HG2 H -1.010 -2.576 4.968 1.00 . A A . 40 GLU HG2 1 1 4 1808 1 1 37 GLU HG3 H -0.854 -4.316 5.199 1.00 . A A . 40 GLU HG3 1 1 4 1809 1 1 37 GLU N N 1.742 -1.989 3.612 1.00 . A A . 40 GLU N 1 1 4 1810 1 1 37 GLU O O -0.060 -3.594 2.420 1.00 . A A . 40 GLU O 1 1 4 1811 1 1 37 GLU OE1 O -1.202 -4.232 7.711 1.00 . A A . 40 GLU OE1 1 1 4 1812 1 1 37 GLU OE2 O -1.556 -2.090 7.362 1.00 . A A . 40 GLU OE2 1 1 4 1813 1 1 38 LYS C C -1.575 -6.156 2.945 1.00 . A A . 41 LYS C 1 1 4 1814 1 1 38 LYS CA C -0.096 -6.356 2.614 1.00 . A A . 41 LYS CA 1 1 4 1815 1 1 38 LYS CB C 0.322 -7.795 2.904 1.00 . A A . 41 LYS CB 1 1 4 1816 1 1 38 LYS CD C 0.941 -9.421 4.725 1.00 . A A . 41 LYS CD 1 1 4 1817 1 1 38 LYS CE C 1.487 -10.391 3.689 1.00 . A A . 41 LYS CE 1 1 4 1818 1 1 38 LYS CG C 1.017 -7.978 4.240 1.00 . A A . 41 LYS CG 1 1 4 1819 1 1 38 LYS H H 1.312 -5.841 4.075 1.00 . A A . 41 LYS H 1 1 4 1820 1 1 38 LYS HA H 0.075 -6.137 1.572 1.00 . A A . 41 LYS HA 1 1 4 1821 1 1 38 LYS HB2 H -0.550 -8.406 2.908 1.00 . A A . 41 LYS HB2 1 1 4 1822 1 1 38 LYS HB3 H 0.991 -8.129 2.126 1.00 . A A . 41 LYS HB3 1 1 4 1823 1 1 38 LYS HD2 H 1.518 -9.517 5.631 1.00 . A A . 41 LYS HD2 1 1 4 1824 1 1 38 LYS HD3 H -0.091 -9.668 4.926 1.00 . A A . 41 LYS HD3 1 1 4 1825 1 1 38 LYS HE2 H 0.752 -10.516 2.908 1.00 . A A . 41 LYS HE2 1 1 4 1826 1 1 38 LYS HE3 H 2.390 -9.977 3.269 1.00 . A A . 41 LYS HE3 1 1 4 1827 1 1 38 LYS HG2 H 2.054 -7.697 4.138 1.00 . A A . 41 LYS HG2 1 1 4 1828 1 1 38 LYS HG3 H 0.540 -7.338 4.966 1.00 . A A . 41 LYS HG3 1 1 4 1829 1 1 38 LYS HZ1 H 2.179 -12.358 3.555 1.00 . A A . 41 LYS HZ1 1 1 4 1830 1 1 38 LYS HZ2 H 0.924 -12.147 4.669 1.00 . A A . 41 LYS HZ2 1 1 4 1831 1 1 38 LYS HZ3 H 2.486 -11.623 5.049 1.00 . A A . 41 LYS HZ3 1 1 4 1832 1 1 38 LYS N N 0.714 -5.459 3.407 1.00 . A A . 41 LYS N 1 1 4 1833 1 1 38 LYS NZ N 1.790 -11.723 4.282 1.00 . A A . 41 LYS NZ 1 1 4 1834 1 1 38 LYS O O -2.031 -6.573 4.011 1.00 . A A . 41 LYS O 1 1 4 1835 1 1 39 PRO C C -4.637 -6.458 1.905 1.00 . A A . 42 PRO C 1 1 4 1836 1 1 39 PRO CA C -3.765 -5.263 2.274 1.00 . A A . 42 PRO CA 1 1 4 1837 1 1 39 PRO CB C -4.075 -4.068 1.359 1.00 . A A . 42 PRO CB 1 1 4 1838 1 1 39 PRO CD C -1.935 -5.020 0.732 1.00 . A A . 42 PRO CD 1 1 4 1839 1 1 39 PRO CG C -2.856 -3.848 0.514 1.00 . A A . 42 PRO CG 1 1 4 1840 1 1 39 PRO HA H -3.946 -4.986 3.302 1.00 . A A . 42 PRO HA 1 1 4 1841 1 1 39 PRO HB2 H -4.935 -4.298 0.749 1.00 . A A . 42 PRO HB2 1 1 4 1842 1 1 39 PRO HB3 H -4.289 -3.201 1.967 1.00 . A A . 42 PRO HB3 1 1 4 1843 1 1 39 PRO HD2 H -2.084 -5.767 -0.032 1.00 . A A . 42 PRO HD2 1 1 4 1844 1 1 39 PRO HD3 H -0.906 -4.694 0.751 1.00 . A A . 42 PRO HD3 1 1 4 1845 1 1 39 PRO HG2 H -3.144 -3.792 -0.524 1.00 . A A . 42 PRO HG2 1 1 4 1846 1 1 39 PRO HG3 H -2.368 -2.931 0.812 1.00 . A A . 42 PRO HG3 1 1 4 1847 1 1 39 PRO N N -2.351 -5.520 2.045 1.00 . A A . 42 PRO N 1 1 4 1848 1 1 39 PRO O O -5.069 -6.594 0.760 1.00 . A A . 42 PRO O 1 1 5 1849 1 1 12 SER C C -10.957 -1.330 -2.739 1.00 . A A . 15 SER C 1 1 5 1850 1 1 12 SER CA C -10.856 -2.579 -3.607 1.00 . A A . 15 SER CA 1 1 5 1851 1 1 12 SER CB C -12.023 -3.518 -3.304 1.00 . A A . 15 SER CB 1 1 5 1852 1 1 12 SER H H -9.102 -3.097 -2.548 1.00 . A A . 15 SER H 1 1 5 1853 1 1 12 SER HA H -10.897 -2.288 -4.647 1.00 . A A . 15 SER HA 1 1 5 1854 1 1 12 SER HB2 H -11.907 -3.918 -2.309 1.00 . A A . 15 SER HB2 1 1 5 1855 1 1 12 SER HB3 H -12.950 -2.968 -3.366 1.00 . A A . 15 SER HB3 1 1 5 1856 1 1 12 SER HG H -12.963 -4.928 -4.286 1.00 . A A . 15 SER HG 1 1 5 1857 1 1 12 SER N N -9.590 -3.263 -3.380 1.00 . A A . 15 SER N 1 1 5 1858 1 1 12 SER O O -11.084 -0.216 -3.248 1.00 . A A . 15 SER O 1 1 5 1859 1 1 12 SER OG O -12.065 -4.594 -4.226 1.00 . A A . 15 SER OG 1 1 5 1860 1 1 13 MET C C -9.649 0.322 -0.395 1.00 . A A . 16 MET C 1 1 5 1861 1 1 13 MET CA C -10.978 -0.420 -0.482 1.00 . A A . 16 MET CA 1 1 5 1862 1 1 13 MET CB C -11.363 -0.935 0.907 1.00 . A A . 16 MET CB 1 1 5 1863 1 1 13 MET CE C -12.691 -1.169 3.707 1.00 . A A . 16 MET CE 1 1 5 1864 1 1 13 MET CG C -12.715 -1.626 0.962 1.00 . A A . 16 MET CG 1 1 5 1865 1 1 13 MET H H -10.794 -2.440 -1.085 1.00 . A A . 16 MET H 1 1 5 1866 1 1 13 MET HA H -11.739 0.261 -0.829 1.00 . A A . 16 MET HA 1 1 5 1867 1 1 13 MET HB2 H -10.613 -1.637 1.237 1.00 . A A . 16 MET HB2 1 1 5 1868 1 1 13 MET HB3 H -11.385 -0.100 1.590 1.00 . A A . 16 MET HB3 1 1 5 1869 1 1 13 MET HE1 H -12.740 -1.566 4.710 1.00 . A A . 16 MET HE1 1 1 5 1870 1 1 13 MET HE2 H -13.441 -0.403 3.588 1.00 . A A . 16 MET HE2 1 1 5 1871 1 1 13 MET HE3 H -11.712 -0.743 3.536 1.00 . A A . 16 MET HE3 1 1 5 1872 1 1 13 MET HG2 H -13.489 -0.883 0.834 1.00 . A A . 16 MET HG2 1 1 5 1873 1 1 13 MET HG3 H -12.770 -2.344 0.157 1.00 . A A . 16 MET HG3 1 1 5 1874 1 1 13 MET N N -10.896 -1.527 -1.427 1.00 . A A . 16 MET N 1 1 5 1875 1 1 13 MET O O -9.596 1.464 0.058 1.00 . A A . 16 MET O 1 1 5 1876 1 1 13 MET SD S -12.987 -2.485 2.526 1.00 . A A . 16 MET SD 1 1 5 1877 1 1 14 TRP C C -6.774 0.694 -2.166 1.00 . A A . 17 TRP C 1 1 5 1878 1 1 14 TRP CA C -7.246 0.263 -0.788 1.00 . A A . 17 TRP CA 1 1 5 1879 1 1 14 TRP CB C -6.235 -0.722 -0.194 1.00 . A A . 17 TRP CB 1 1 5 1880 1 1 14 TRP CD1 C -7.687 -2.296 1.209 1.00 . A A . 17 TRP CD1 1 1 5 1881 1 1 14 TRP CD2 C -6.186 -1.121 2.371 1.00 . A A . 17 TRP CD2 1 1 5 1882 1 1 14 TRP CE2 C -6.907 -1.928 3.266 1.00 . A A . 17 TRP CE2 1 1 5 1883 1 1 14 TRP CE3 C -5.183 -0.291 2.865 1.00 . A A . 17 TRP CE3 1 1 5 1884 1 1 14 TRP CG C -6.701 -1.364 1.068 1.00 . A A . 17 TRP CG 1 1 5 1885 1 1 14 TRP CH2 C -5.663 -1.102 5.093 1.00 . A A . 17 TRP CH2 1 1 5 1886 1 1 14 TRP CZ2 C -6.656 -1.926 4.633 1.00 . A A . 17 TRP CZ2 1 1 5 1887 1 1 14 TRP CZ3 C -4.930 -0.291 4.217 1.00 . A A . 17 TRP CZ3 1 1 5 1888 1 1 14 TRP H H -8.684 -1.237 -1.198 1.00 . A A . 17 TRP H 1 1 5 1889 1 1 14 TRP HA H -7.293 1.135 -0.158 1.00 . A A . 17 TRP HA 1 1 5 1890 1 1 14 TRP HB2 H -6.033 -1.501 -0.908 1.00 . A A . 17 TRP HB2 1 1 5 1891 1 1 14 TRP HB3 H -5.317 -0.194 0.022 1.00 . A A . 17 TRP HB3 1 1 5 1892 1 1 14 TRP HD1 H -8.271 -2.694 0.392 1.00 . A A . 17 TRP HD1 1 1 5 1893 1 1 14 TRP HE1 H -8.461 -3.286 2.887 1.00 . A A . 17 TRP HE1 1 1 5 1894 1 1 14 TRP HE3 H -4.607 0.340 2.204 1.00 . A A . 17 TRP HE3 1 1 5 1895 1 1 14 TRP HH2 H -5.432 -1.069 6.147 1.00 . A A . 17 TRP HH2 1 1 5 1896 1 1 14 TRP HZ2 H -7.217 -2.542 5.317 1.00 . A A . 17 TRP HZ2 1 1 5 1897 1 1 14 TRP HZ3 H -4.156 0.344 4.613 1.00 . A A . 17 TRP HZ3 1 1 5 1898 1 1 14 TRP N N -8.577 -0.333 -0.835 1.00 . A A . 17 TRP N 1 1 5 1899 1 1 14 TRP NE1 N -7.820 -2.639 2.530 1.00 . A A . 17 TRP NE1 1 1 5 1900 1 1 14 TRP O O -6.946 -0.026 -3.149 1.00 . A A . 17 TRP O 1 1 5 1901 1 1 15 THR C C -4.126 2.414 -3.429 1.00 . A A . 18 THR C 1 1 5 1902 1 1 15 THR CA C -5.653 2.399 -3.472 1.00 . A A . 18 THR CA 1 1 5 1903 1 1 15 THR CB C -6.190 3.812 -3.776 1.00 . A A . 18 THR CB 1 1 5 1904 1 1 15 THR CG2 C -5.640 4.837 -2.796 1.00 . A A . 18 THR CG2 1 1 5 1905 1 1 15 THR H H -6.094 2.415 -1.407 1.00 . A A . 18 THR H 1 1 5 1906 1 1 15 THR HA H -5.973 1.737 -4.263 1.00 . A A . 18 THR HA 1 1 5 1907 1 1 15 THR HB H -7.266 3.796 -3.690 1.00 . A A . 18 THR HB 1 1 5 1908 1 1 15 THR HG1 H -4.910 3.996 -5.264 1.00 . A A . 18 THR HG1 1 1 5 1909 1 1 15 THR HG21 H -5.880 4.536 -1.788 1.00 . A A . 18 THR HG21 1 1 5 1910 1 1 15 THR HG22 H -6.082 5.801 -2.998 1.00 . A A . 18 THR HG22 1 1 5 1911 1 1 15 THR HG23 H -4.567 4.903 -2.907 1.00 . A A . 18 THR HG23 1 1 5 1912 1 1 15 THR N N -6.178 1.878 -2.225 1.00 . A A . 18 THR N 1 1 5 1913 1 1 15 THR O O -3.527 2.808 -2.430 1.00 . A A . 18 THR O 1 1 5 1914 1 1 15 THR OG1 O -5.838 4.187 -5.111 1.00 . A A . 18 THR OG1 1 1 5 1915 1 1 16 GLU C C -1.472 3.068 -5.422 1.00 . A A . 19 GLU C 1 1 5 1916 1 1 16 GLU CA C -2.046 1.920 -4.590 1.00 . A A . 19 GLU CA 1 1 5 1917 1 1 16 GLU CB C -1.624 0.575 -5.189 1.00 . A A . 19 GLU CB 1 1 5 1918 1 1 16 GLU CD C 0.257 -0.969 -5.856 1.00 . A A . 19 GLU CD 1 1 5 1919 1 1 16 GLU CG C -0.122 0.356 -5.227 1.00 . A A . 19 GLU CG 1 1 5 1920 1 1 16 GLU H H -4.038 1.678 -5.274 1.00 . A A . 19 GLU H 1 1 5 1921 1 1 16 GLU HA H -1.660 1.991 -3.587 1.00 . A A . 19 GLU HA 1 1 5 1922 1 1 16 GLU HB2 H -2.065 -0.218 -4.603 1.00 . A A . 19 GLU HB2 1 1 5 1923 1 1 16 GLU HB3 H -2.000 0.512 -6.200 1.00 . A A . 19 GLU HB3 1 1 5 1924 1 1 16 GLU HG2 H 0.330 1.152 -5.801 1.00 . A A . 19 GLU HG2 1 1 5 1925 1 1 16 GLU HG3 H 0.259 0.382 -4.216 1.00 . A A . 19 GLU HG3 1 1 5 1926 1 1 16 GLU N N -3.505 1.981 -4.514 1.00 . A A . 19 GLU N 1 1 5 1927 1 1 16 GLU O O -1.748 3.183 -6.616 1.00 . A A . 19 GLU O 1 1 5 1928 1 1 16 GLU OE1 O 0.284 -1.986 -5.130 1.00 . A A . 19 GLU OE1 1 1 5 1929 1 1 16 GLU OE2 O 0.527 -0.992 -7.075 1.00 . A A . 19 GLU OE2 1 1 5 1930 1 1 17 HIS C C 1.308 5.409 -4.824 1.00 . A A . 20 HIS C 1 1 5 1931 1 1 17 HIS CA C -0.043 5.064 -5.450 1.00 . A A . 20 HIS CA 1 1 5 1932 1 1 17 HIS CB C -0.948 6.297 -5.367 1.00 . A A . 20 HIS CB 1 1 5 1933 1 1 17 HIS CD2 C -3.529 6.082 -5.406 1.00 . A A . 20 HIS CD2 1 1 5 1934 1 1 17 HIS CE1 C -3.797 5.821 -7.566 1.00 . A A . 20 HIS CE1 1 1 5 1935 1 1 17 HIS CG C -2.301 6.113 -5.975 1.00 . A A . 20 HIS CG 1 1 5 1936 1 1 17 HIS H H -0.482 3.766 -3.819 1.00 . A A . 20 HIS H 1 1 5 1937 1 1 17 HIS HA H 0.104 4.802 -6.487 1.00 . A A . 20 HIS HA 1 1 5 1938 1 1 17 HIS HB2 H -1.090 6.558 -4.329 1.00 . A A . 20 HIS HB2 1 1 5 1939 1 1 17 HIS HB3 H -0.466 7.120 -5.874 1.00 . A A . 20 HIS HB3 1 1 5 1940 1 1 17 HIS HD1 H -1.803 5.921 -8.014 1.00 . A A . 20 HIS HD1 1 1 5 1941 1 1 17 HIS HD2 H -3.751 6.178 -4.351 1.00 . A A . 20 HIS HD2 1 1 5 1942 1 1 17 HIS HE1 H -4.251 5.674 -8.536 1.00 . A A . 20 HIS HE1 1 1 5 1943 1 1 17 HIS HE2 H -5.415 5.934 -6.317 1.00 . A A . 20 HIS HE2 1 1 5 1944 1 1 17 HIS N N -0.665 3.916 -4.774 1.00 . A A . 20 HIS N 1 1 5 1945 1 1 17 HIS ND1 N -2.503 5.945 -7.329 1.00 . A A . 20 HIS ND1 1 1 5 1946 1 1 17 HIS NE2 N -4.441 5.901 -6.418 1.00 . A A . 20 HIS NE2 1 1 5 1947 1 1 17 HIS O O 1.510 5.208 -3.629 1.00 . A A . 20 HIS O 1 1 5 1948 1 1 18 LYS C C 3.431 7.205 -3.911 1.00 . A A . 21 LYS C 1 1 5 1949 1 1 18 LYS CA C 3.552 6.320 -5.144 1.00 . A A . 21 LYS CA 1 1 5 1950 1 1 18 LYS CB C 4.325 7.058 -6.233 1.00 . A A . 21 LYS CB 1 1 5 1951 1 1 18 LYS CD C 3.513 6.741 -8.585 1.00 . A A . 21 LYS CD 1 1 5 1952 1 1 18 LYS CE C 3.675 5.943 -9.870 1.00 . A A . 21 LYS CE 1 1 5 1953 1 1 18 LYS CG C 4.458 6.246 -7.501 1.00 . A A . 21 LYS CG 1 1 5 1954 1 1 18 LYS H H 2.051 6.002 -6.597 1.00 . A A . 21 LYS H 1 1 5 1955 1 1 18 LYS HA H 4.092 5.423 -4.877 1.00 . A A . 21 LYS HA 1 1 5 1956 1 1 18 LYS HB2 H 3.810 7.978 -6.467 1.00 . A A . 21 LYS HB2 1 1 5 1957 1 1 18 LYS HB3 H 5.315 7.287 -5.870 1.00 . A A . 21 LYS HB3 1 1 5 1958 1 1 18 LYS HD2 H 2.496 6.640 -8.237 1.00 . A A . 21 LYS HD2 1 1 5 1959 1 1 18 LYS HD3 H 3.726 7.780 -8.788 1.00 . A A . 21 LYS HD3 1 1 5 1960 1 1 18 LYS HE2 H 3.437 4.909 -9.668 1.00 . A A . 21 LYS HE2 1 1 5 1961 1 1 18 LYS HE3 H 2.990 6.333 -10.609 1.00 . A A . 21 LYS HE3 1 1 5 1962 1 1 18 LYS HG2 H 5.474 6.311 -7.860 1.00 . A A . 21 LYS HG2 1 1 5 1963 1 1 18 LYS HG3 H 4.216 5.223 -7.267 1.00 . A A . 21 LYS HG3 1 1 5 1964 1 1 18 LYS HZ1 H 5.133 5.493 -11.295 1.00 . A A . 21 LYS HZ1 1 1 5 1965 1 1 18 LYS HZ2 H 5.733 5.622 -9.719 1.00 . A A . 21 LYS HZ2 1 1 5 1966 1 1 18 LYS HZ3 H 5.319 7.016 -10.581 1.00 . A A . 21 LYS HZ3 1 1 5 1967 1 1 18 LYS N N 2.238 5.921 -5.637 1.00 . A A . 21 LYS N 1 1 5 1968 1 1 18 LYS NZ N 5.062 6.024 -10.404 1.00 . A A . 21 LYS NZ 1 1 5 1969 1 1 18 LYS O O 2.386 7.807 -3.662 1.00 . A A . 21 LYS O 1 1 5 1970 1 1 19 SER C C 5.957 8.059 -1.330 1.00 . A A . 22 SER C 1 1 5 1971 1 1 19 SER CA C 4.550 8.076 -1.933 1.00 . A A . 22 SER CA 1 1 5 1972 1 1 19 SER CB C 3.524 7.516 -0.943 1.00 . A A . 22 SER CB 1 1 5 1973 1 1 19 SER H H 5.322 6.796 -3.425 1.00 . A A . 22 SER H 1 1 5 1974 1 1 19 SER HA H 4.285 9.093 -2.184 1.00 . A A . 22 SER HA 1 1 5 1975 1 1 19 SER HB2 H 3.905 7.611 0.062 1.00 . A A . 22 SER HB2 1 1 5 1976 1 1 19 SER HB3 H 2.600 8.070 -1.032 1.00 . A A . 22 SER HB3 1 1 5 1977 1 1 19 SER HG H 4.031 5.750 -1.620 1.00 . A A . 22 SER HG 1 1 5 1978 1 1 19 SER N N 4.517 7.285 -3.154 1.00 . A A . 22 SER N 1 1 5 1979 1 1 19 SER O O 6.828 7.343 -1.833 1.00 . A A . 22 SER O 1 1 5 1980 1 1 19 SER OG O 3.263 6.150 -1.205 1.00 . A A . 22 SER OG 1 1 5 1981 1 1 20 PRO C C 8.304 7.634 0.342 1.00 . A A . 23 PRO C 1 1 5 1982 1 1 20 PRO CA C 7.507 8.935 0.408 1.00 . A A . 23 PRO CA 1 1 5 1983 1 1 20 PRO CB C 7.117 9.241 1.854 1.00 . A A . 23 PRO CB 1 1 5 1984 1 1 20 PRO CD C 5.262 9.790 0.374 1.00 . A A . 23 PRO CD 1 1 5 1985 1 1 20 PRO CG C 5.776 9.912 1.791 1.00 . A A . 23 PRO CG 1 1 5 1986 1 1 20 PRO HA H 8.109 9.744 0.020 1.00 . A A . 23 PRO HA 1 1 5 1987 1 1 20 PRO HB2 H 7.065 8.318 2.414 1.00 . A A . 23 PRO HB2 1 1 5 1988 1 1 20 PRO HB3 H 7.859 9.890 2.296 1.00 . A A . 23 PRO HB3 1 1 5 1989 1 1 20 PRO HD2 H 4.264 9.381 0.374 1.00 . A A . 23 PRO HD2 1 1 5 1990 1 1 20 PRO HD3 H 5.275 10.751 -0.115 1.00 . A A . 23 PRO HD3 1 1 5 1991 1 1 20 PRO HG2 H 5.096 9.422 2.472 1.00 . A A . 23 PRO HG2 1 1 5 1992 1 1 20 PRO HG3 H 5.881 10.955 2.059 1.00 . A A . 23 PRO HG3 1 1 5 1993 1 1 20 PRO N N 6.210 8.863 -0.263 1.00 . A A . 23 PRO N 1 1 5 1994 1 1 20 PRO O O 7.731 6.546 0.282 1.00 . A A . 23 PRO O 1 1 5 1995 1 1 21 ASP C C 10.542 6.003 -1.099 1.00 . A A . 24 ASP C 1 1 5 1996 1 1 21 ASP CA C 10.530 6.613 0.302 1.00 . A A . 24 ASP CA 1 1 5 1997 1 1 21 ASP CB C 10.139 5.556 1.345 1.00 . A A . 24 ASP CB 1 1 5 1998 1 1 21 ASP CG C 10.185 6.099 2.760 1.00 . A A . 24 ASP CG 1 1 5 1999 1 1 21 ASP H H 10.016 8.662 0.423 1.00 . A A . 24 ASP H 1 1 5 2000 1 1 21 ASP HA H 11.524 6.969 0.526 1.00 . A A . 24 ASP HA 1 1 5 2001 1 1 21 ASP HB2 H 9.136 5.213 1.144 1.00 . A A . 24 ASP HB2 1 1 5 2002 1 1 21 ASP HB3 H 10.819 4.721 1.278 1.00 . A A . 24 ASP HB3 1 1 5 2003 1 1 21 ASP N N 9.630 7.763 0.364 1.00 . A A . 24 ASP N 1 1 5 2004 1 1 21 ASP O O 11.062 4.907 -1.307 1.00 . A A . 24 ASP O 1 1 5 2005 1 1 21 ASP OD1 O 11.280 6.097 3.362 1.00 . A A . 24 ASP OD1 1 1 5 2006 1 1 21 ASP OD2 O 9.126 6.526 3.266 1.00 . A A . 24 ASP OD2 1 1 5 2007 1 1 22 GLY C C 9.292 4.901 -3.566 1.00 . A A . 25 GLY C 1 1 5 2008 1 1 22 GLY CA C 9.916 6.269 -3.433 1.00 . A A . 25 GLY CA 1 1 5 2009 1 1 22 GLY H H 9.560 7.591 -1.821 1.00 . A A . 25 GLY H 1 1 5 2010 1 1 22 GLY HA2 H 9.332 6.968 -4.020 1.00 . A A . 25 GLY HA2 1 1 5 2011 1 1 22 GLY HA3 H 10.920 6.237 -3.822 1.00 . A A . 25 GLY HA3 1 1 5 2012 1 1 22 GLY N N 9.963 6.732 -2.055 1.00 . A A . 25 GLY N 1 1 5 2013 1 1 22 GLY O O 9.834 4.017 -4.229 1.00 . A A . 25 GLY O 1 1 5 2014 1 1 23 ARG C C 5.924 3.765 -3.014 1.00 . A A . 26 ARG C 1 1 5 2015 1 1 23 ARG CA C 7.413 3.480 -2.971 1.00 . A A . 26 ARG CA 1 1 5 2016 1 1 23 ARG CB C 7.771 2.610 -1.765 1.00 . A A . 26 ARG CB 1 1 5 2017 1 1 23 ARG CD C 8.524 2.522 0.627 1.00 . A A . 26 ARG CD 1 1 5 2018 1 1 23 ARG CG C 7.979 3.397 -0.488 1.00 . A A . 26 ARG CG 1 1 5 2019 1 1 23 ARG CZ C 10.553 1.227 1.136 1.00 . A A . 26 ARG CZ 1 1 5 2020 1 1 23 ARG H H 7.766 5.491 -2.430 1.00 . A A . 26 ARG H 1 1 5 2021 1 1 23 ARG HA H 7.694 2.962 -3.876 1.00 . A A . 26 ARG HA 1 1 5 2022 1 1 23 ARG HB2 H 6.977 1.898 -1.600 1.00 . A A . 26 ARG HB2 1 1 5 2023 1 1 23 ARG HB3 H 8.683 2.076 -1.982 1.00 . A A . 26 ARG HB3 1 1 5 2024 1 1 23 ARG HD2 H 8.618 3.119 1.521 1.00 . A A . 26 ARG HD2 1 1 5 2025 1 1 23 ARG HD3 H 7.827 1.715 0.806 1.00 . A A . 26 ARG HD3 1 1 5 2026 1 1 23 ARG HE H 10.181 2.129 -0.604 1.00 . A A . 26 ARG HE 1 1 5 2027 1 1 23 ARG HG2 H 8.676 4.194 -0.684 1.00 . A A . 26 ARG HG2 1 1 5 2028 1 1 23 ARG HG3 H 7.038 3.812 -0.177 1.00 . A A . 26 ARG HG3 1 1 5 2029 1 1 23 ARG HH11 H 9.220 1.344 2.652 1.00 . A A . 26 ARG HH11 1 1 5 2030 1 1 23 ARG HH12 H 10.653 0.430 2.992 1.00 . A A . 26 ARG HH12 1 1 5 2031 1 1 23 ARG HH21 H 12.069 0.927 -0.167 1.00 . A A . 26 ARG HH21 1 1 5 2032 1 1 23 ARG HH22 H 12.270 0.192 1.389 1.00 . A A . 26 ARG HH22 1 1 5 2033 1 1 23 ARG N N 8.143 4.737 -2.935 1.00 . A A . 26 ARG N 1 1 5 2034 1 1 23 ARG NE N 9.829 1.957 0.294 1.00 . A A . 26 ARG NE 1 1 5 2035 1 1 23 ARG NH1 N 10.105 0.980 2.360 1.00 . A A . 26 ARG NH1 1 1 5 2036 1 1 23 ARG NH2 N 11.727 0.743 0.755 1.00 . A A . 26 ARG NH2 1 1 5 2037 1 1 23 ARG O O 5.501 4.894 -2.770 1.00 . A A . 26 ARG O 1 1 5 2038 1 1 24 THR C C 2.974 2.441 -2.167 1.00 . A A . 27 THR C 1 1 5 2039 1 1 24 THR CA C 3.689 2.953 -3.408 1.00 . A A . 27 THR CA 1 1 5 2040 1 1 24 THR CB C 3.103 2.262 -4.653 1.00 . A A . 27 THR CB 1 1 5 2041 1 1 24 THR CG2 C 3.292 0.751 -4.584 1.00 . A A . 27 THR CG2 1 1 5 2042 1 1 24 THR H H 5.506 1.866 -3.477 1.00 . A A . 27 THR H 1 1 5 2043 1 1 24 THR HA H 3.514 4.015 -3.496 1.00 . A A . 27 THR HA 1 1 5 2044 1 1 24 THR HB H 3.619 2.633 -5.528 1.00 . A A . 27 THR HB 1 1 5 2045 1 1 24 THR HG1 H 1.532 2.922 -5.643 1.00 . A A . 27 THR HG1 1 1 5 2046 1 1 24 THR HG21 H 2.947 0.302 -5.504 1.00 . A A . 27 THR HG21 1 1 5 2047 1 1 24 THR HG22 H 2.722 0.353 -3.756 1.00 . A A . 27 THR HG22 1 1 5 2048 1 1 24 THR HG23 H 4.339 0.523 -4.442 1.00 . A A . 27 THR HG23 1 1 5 2049 1 1 24 THR N N 5.125 2.755 -3.316 1.00 . A A . 27 THR N 1 1 5 2050 1 1 24 THR O O 3.211 1.320 -1.714 1.00 . A A . 27 THR O 1 1 5 2051 1 1 24 THR OG1 O 1.711 2.568 -4.769 1.00 . A A . 27 THR OG1 1 1 5 2052 1 1 25 TYR C C -0.088 2.541 -0.750 1.00 . A A . 28 TYR C 1 1 5 2053 1 1 25 TYR CA C 1.347 2.915 -0.424 1.00 . A A . 28 TYR CA 1 1 5 2054 1 1 25 TYR CB C 1.364 4.053 0.619 1.00 . A A . 28 TYR CB 1 1 5 2055 1 1 25 TYR CD1 C 0.156 5.560 -1.060 1.00 . A A . 28 TYR CD1 1 1 5 2056 1 1 25 TYR CD2 C 0.874 6.501 1.006 1.00 . A A . 28 TYR CD2 1 1 5 2057 1 1 25 TYR CE1 C -0.364 6.783 -1.440 1.00 . A A . 28 TYR CE1 1 1 5 2058 1 1 25 TYR CE2 C 0.357 7.727 0.631 1.00 . A A . 28 TYR CE2 1 1 5 2059 1 1 25 TYR CG C 0.786 5.392 0.171 1.00 . A A . 28 TYR CG 1 1 5 2060 1 1 25 TYR CZ C -0.261 7.862 -0.592 1.00 . A A . 28 TYR CZ 1 1 5 2061 1 1 25 TYR H H 1.953 4.156 -2.025 1.00 . A A . 28 TYR H 1 1 5 2062 1 1 25 TYR HA H 1.831 2.051 0.008 1.00 . A A . 28 TYR HA 1 1 5 2063 1 1 25 TYR HB2 H 0.797 3.735 1.481 1.00 . A A . 28 TYR HB2 1 1 5 2064 1 1 25 TYR HB3 H 2.384 4.225 0.925 1.00 . A A . 28 TYR HB3 1 1 5 2065 1 1 25 TYR HD1 H 0.075 4.719 -1.728 1.00 . A A . 28 TYR HD1 1 1 5 2066 1 1 25 TYR HD2 H 1.361 6.396 1.965 1.00 . A A . 28 TYR HD2 1 1 5 2067 1 1 25 TYR HE1 H -0.848 6.888 -2.400 1.00 . A A . 28 TYR HE1 1 1 5 2068 1 1 25 TYR HE2 H 0.438 8.573 1.297 1.00 . A A . 28 TYR HE2 1 1 5 2069 1 1 25 TYR HH H -1.638 8.951 -1.376 1.00 . A A . 28 TYR HH 1 1 5 2070 1 1 25 TYR N N 2.095 3.277 -1.618 1.00 . A A . 28 TYR N 1 1 5 2071 1 1 25 TYR O O -0.584 2.790 -1.856 1.00 . A A . 28 TYR O 1 1 5 2072 1 1 25 TYR OH O -0.778 9.081 -0.967 1.00 . A A . 28 TYR OH 1 1 5 2073 1 1 26 TYR C C -2.981 2.393 0.980 1.00 . A A . 29 TYR C 1 1 5 2074 1 1 26 TYR CA C -2.116 1.513 0.095 1.00 . A A . 29 TYR CA 1 1 5 2075 1 1 26 TYR CB C -2.279 0.052 0.496 1.00 . A A . 29 TYR CB 1 1 5 2076 1 1 26 TYR CD1 C -1.989 -1.323 -1.603 1.00 . A A . 29 TYR CD1 1 1 5 2077 1 1 26 TYR CD2 C -0.263 -1.393 0.039 1.00 . A A . 29 TYR CD2 1 1 5 2078 1 1 26 TYR CE1 C -1.274 -2.197 -2.399 1.00 . A A . 29 TYR CE1 1 1 5 2079 1 1 26 TYR CE2 C 0.460 -2.267 -0.751 1.00 . A A . 29 TYR CE2 1 1 5 2080 1 1 26 TYR CG C -1.497 -0.907 -0.372 1.00 . A A . 29 TYR CG 1 1 5 2081 1 1 26 TYR CZ C -0.051 -2.667 -1.969 1.00 . A A . 29 TYR CZ 1 1 5 2082 1 1 26 TYR H H -0.260 1.730 1.058 1.00 . A A . 29 TYR H 1 1 5 2083 1 1 26 TYR HA H -2.415 1.640 -0.933 1.00 . A A . 29 TYR HA 1 1 5 2084 1 1 26 TYR HB2 H -1.944 -0.073 1.513 1.00 . A A . 29 TYR HB2 1 1 5 2085 1 1 26 TYR HB3 H -3.322 -0.213 0.432 1.00 . A A . 29 TYR HB3 1 1 5 2086 1 1 26 TYR HD1 H -2.948 -0.953 -1.937 1.00 . A A . 29 TYR HD1 1 1 5 2087 1 1 26 TYR HD2 H 0.134 -1.078 0.993 1.00 . A A . 29 TYR HD2 1 1 5 2088 1 1 26 TYR HE1 H -1.673 -2.509 -3.352 1.00 . A A . 29 TYR HE1 1 1 5 2089 1 1 26 TYR HE2 H 1.417 -2.634 -0.414 1.00 . A A . 29 TYR HE2 1 1 5 2090 1 1 26 TYR HH H 1.008 -4.252 -2.220 1.00 . A A . 29 TYR HH 1 1 5 2091 1 1 26 TYR N N -0.734 1.921 0.223 1.00 . A A . 29 TYR N 1 1 5 2092 1 1 26 TYR O O -2.932 2.290 2.205 1.00 . A A . 29 TYR O 1 1 5 2093 1 1 26 TYR OH O 0.665 -3.536 -2.759 1.00 . A A . 29 TYR OH 1 1 5 2094 1 1 27 TYR C C -6.071 3.665 1.092 1.00 . A A . 30 TYR C 1 1 5 2095 1 1 27 TYR CA C -4.633 4.156 1.099 1.00 . A A . 30 TYR CA 1 1 5 2096 1 1 27 TYR CB C -4.544 5.570 0.513 1.00 . A A . 30 TYR CB 1 1 5 2097 1 1 27 TYR CD1 C -5.740 6.799 2.373 1.00 . A A . 30 TYR CD1 1 1 5 2098 1 1 27 TYR CD2 C -6.499 7.126 0.137 1.00 . A A . 30 TYR CD2 1 1 5 2099 1 1 27 TYR CE1 C -6.716 7.661 2.835 1.00 . A A . 30 TYR CE1 1 1 5 2100 1 1 27 TYR CE2 C -7.478 7.990 0.591 1.00 . A A . 30 TYR CE2 1 1 5 2101 1 1 27 TYR CG C -5.615 6.516 1.018 1.00 . A A . 30 TYR CG 1 1 5 2102 1 1 27 TYR CZ C -7.582 8.254 1.940 1.00 . A A . 30 TYR CZ 1 1 5 2103 1 1 27 TYR H H -3.786 3.271 -0.620 1.00 . A A . 30 TYR H 1 1 5 2104 1 1 27 TYR HA H -4.281 4.179 2.119 1.00 . A A . 30 TYR HA 1 1 5 2105 1 1 27 TYR HB2 H -3.584 5.996 0.768 1.00 . A A . 30 TYR HB2 1 1 5 2106 1 1 27 TYR HB3 H -4.629 5.514 -0.563 1.00 . A A . 30 TYR HB3 1 1 5 2107 1 1 27 TYR HD1 H -5.062 6.333 3.072 1.00 . A A . 30 TYR HD1 1 1 5 2108 1 1 27 TYR HD2 H -6.416 6.917 -0.919 1.00 . A A . 30 TYR HD2 1 1 5 2109 1 1 27 TYR HE1 H -6.797 7.869 3.891 1.00 . A A . 30 TYR HE1 1 1 5 2110 1 1 27 TYR HE2 H -8.155 8.454 -0.110 1.00 . A A . 30 TYR HE2 1 1 5 2111 1 1 27 TYR HH H -8.172 9.719 3.036 1.00 . A A . 30 TYR HH 1 1 5 2112 1 1 27 TYR N N -3.775 3.249 0.358 1.00 . A A . 30 TYR N 1 1 5 2113 1 1 27 TYR O O -6.776 3.765 0.087 1.00 . A A . 30 TYR O 1 1 5 2114 1 1 27 TYR OH O -8.554 9.113 2.396 1.00 . A A . 30 TYR OH 1 1 5 2115 1 1 28 ASN C C -8.789 3.802 2.397 1.00 . A A . 31 ASN C 1 1 5 2116 1 1 28 ASN CA C -7.840 2.623 2.386 1.00 . A A . 31 ASN CA 1 1 5 2117 1 1 28 ASN CB C -7.960 1.840 3.695 1.00 . A A . 31 ASN CB 1 1 5 2118 1 1 28 ASN CG C -9.109 0.847 3.692 1.00 . A A . 31 ASN CG 1 1 5 2119 1 1 28 ASN H H -5.878 3.081 2.988 1.00 . A A . 31 ASN H 1 1 5 2120 1 1 28 ASN HA H -8.070 1.978 1.551 1.00 . A A . 31 ASN HA 1 1 5 2121 1 1 28 ASN HB2 H -7.043 1.299 3.868 1.00 . A A . 31 ASN HB2 1 1 5 2122 1 1 28 ASN HB3 H -8.119 2.540 4.506 1.00 . A A . 31 ASN HB3 1 1 5 2123 1 1 28 ASN HD21 H -10.093 1.937 2.363 1.00 . A A . 31 ASN HD21 1 1 5 2124 1 1 28 ASN HD22 H -10.886 0.500 2.885 1.00 . A A . 31 ASN HD22 1 1 5 2125 1 1 28 ASN N N -6.490 3.124 2.229 1.00 . A A . 31 ASN N 1 1 5 2126 1 1 28 ASN ND2 N -10.132 1.123 2.898 1.00 . A A . 31 ASN ND2 1 1 5 2127 1 1 28 ASN O O -8.867 4.515 3.391 1.00 . A A . 31 ASN O 1 1 5 2128 1 1 28 ASN OD1 O -9.075 -0.158 4.400 1.00 . A A . 31 ASN OD1 1 1 5 2129 1 1 29 THR C C -11.607 5.020 2.082 1.00 . A A . 32 THR C 1 1 5 2130 1 1 29 THR CA C -10.402 5.143 1.155 1.00 . A A . 32 THR CA 1 1 5 2131 1 1 29 THR CB C -10.910 5.285 -0.289 1.00 . A A . 32 THR CB 1 1 5 2132 1 1 29 THR CG2 C -9.820 5.832 -1.199 1.00 . A A . 32 THR CG2 1 1 5 2133 1 1 29 THR H H -9.348 3.420 0.516 1.00 . A A . 32 THR H 1 1 5 2134 1 1 29 THR HA H -9.863 6.044 1.406 1.00 . A A . 32 THR HA 1 1 5 2135 1 1 29 THR HB H -11.741 5.973 -0.292 1.00 . A A . 32 THR HB 1 1 5 2136 1 1 29 THR HG1 H -11.079 3.907 -1.692 1.00 . A A . 32 THR HG1 1 1 5 2137 1 1 29 THR HG21 H -9.518 6.808 -0.849 1.00 . A A . 32 THR HG21 1 1 5 2138 1 1 29 THR HG22 H -10.199 5.911 -2.207 1.00 . A A . 32 THR HG22 1 1 5 2139 1 1 29 THR HG23 H -8.972 5.165 -1.184 1.00 . A A . 32 THR HG23 1 1 5 2140 1 1 29 THR N N -9.474 4.022 1.281 1.00 . A A . 32 THR N 1 1 5 2141 1 1 29 THR O O -12.216 6.027 2.446 1.00 . A A . 32 THR O 1 1 5 2142 1 1 29 THR OG1 O -11.358 4.015 -0.779 1.00 . A A . 32 THR OG1 1 1 5 2143 1 1 30 GLU C C -12.785 3.912 4.779 1.00 . A A . 33 GLU C 1 1 5 2144 1 1 30 GLU CA C -13.099 3.575 3.329 1.00 . A A . 33 GLU CA 1 1 5 2145 1 1 30 GLU CB C -13.545 2.122 3.202 1.00 . A A . 33 GLU CB 1 1 5 2146 1 1 30 GLU CD C -14.339 1.582 5.556 1.00 . A A . 33 GLU CD 1 1 5 2147 1 1 30 GLU CG C -14.722 1.743 4.096 1.00 . A A . 33 GLU CG 1 1 5 2148 1 1 30 GLU H H -11.428 3.026 2.166 1.00 . A A . 33 GLU H 1 1 5 2149 1 1 30 GLU HA H -13.892 4.212 2.994 1.00 . A A . 33 GLU HA 1 1 5 2150 1 1 30 GLU HB2 H -13.832 1.939 2.176 1.00 . A A . 33 GLU HB2 1 1 5 2151 1 1 30 GLU HB3 H -12.707 1.488 3.446 1.00 . A A . 33 GLU HB3 1 1 5 2152 1 1 30 GLU HG2 H -15.473 2.515 4.023 1.00 . A A . 33 GLU HG2 1 1 5 2153 1 1 30 GLU HG3 H -15.136 0.809 3.743 1.00 . A A . 33 GLU HG3 1 1 5 2154 1 1 30 GLU N N -11.953 3.798 2.465 1.00 . A A . 33 GLU N 1 1 5 2155 1 1 30 GLU O O -13.471 4.724 5.400 1.00 . A A . 33 GLU O 1 1 5 2156 1 1 30 GLU OE1 O -13.648 0.596 5.885 1.00 . A A . 33 GLU OE1 1 1 5 2157 1 1 30 GLU OE2 O -14.732 2.443 6.370 1.00 . A A . 33 GLU OE2 1 1 5 2158 1 1 31 THR C C -10.382 4.678 6.840 1.00 . A A . 34 THR C 1 1 5 2159 1 1 31 THR CA C -11.362 3.512 6.703 1.00 . A A . 34 THR CA 1 1 5 2160 1 1 31 THR CB C -10.752 2.250 7.347 1.00 . A A . 34 THR CB 1 1 5 2161 1 1 31 THR CG2 C -9.357 1.977 6.810 1.00 . A A . 34 THR CG2 1 1 5 2162 1 1 31 THR H H -11.227 2.674 4.756 1.00 . A A . 34 THR H 1 1 5 2163 1 1 31 THR HA H -12.263 3.754 7.244 1.00 . A A . 34 THR HA 1 1 5 2164 1 1 31 THR HB H -11.383 1.404 7.115 1.00 . A A . 34 THR HB 1 1 5 2165 1 1 31 THR HG1 H -11.452 2.908 9.070 1.00 . A A . 34 THR HG1 1 1 5 2166 1 1 31 THR HG21 H -8.995 1.040 7.207 1.00 . A A . 34 THR HG21 1 1 5 2167 1 1 31 THR HG22 H -8.694 2.775 7.109 1.00 . A A . 34 THR HG22 1 1 5 2168 1 1 31 THR HG23 H -9.393 1.922 5.736 1.00 . A A . 34 THR HG23 1 1 5 2169 1 1 31 THR N N -11.746 3.288 5.312 1.00 . A A . 34 THR N 1 1 5 2170 1 1 31 THR O O -10.339 5.333 7.882 1.00 . A A . 34 THR O 1 1 5 2171 1 1 31 THR OG1 O -10.688 2.410 8.770 1.00 . A A . 34 THR OG1 1 1 5 2172 1 1 32 LYS C C -7.300 5.493 6.321 1.00 . A A . 35 LYS C 1 1 5 2173 1 1 32 LYS CA C -8.598 5.981 5.734 1.00 . A A . 35 LYS CA 1 1 5 2174 1 1 32 LYS CB C -9.083 7.254 6.442 1.00 . A A . 35 LYS CB 1 1 5 2175 1 1 32 LYS CD C -10.948 8.899 6.796 1.00 . A A . 35 LYS CD 1 1 5 2176 1 1 32 LYS CE C -12.395 9.223 6.464 1.00 . A A . 35 LYS CE 1 1 5 2177 1 1 32 LYS CG C -10.430 7.752 5.944 1.00 . A A . 35 LYS CG 1 1 5 2178 1 1 32 LYS H H -9.623 4.279 5.031 1.00 . A A . 35 LYS H 1 1 5 2179 1 1 32 LYS HA H -8.419 6.204 4.689 1.00 . A A . 35 LYS HA 1 1 5 2180 1 1 32 LYS HB2 H -9.163 7.057 7.500 1.00 . A A . 35 LYS HB2 1 1 5 2181 1 1 32 LYS HB3 H -8.354 8.036 6.286 1.00 . A A . 35 LYS HB3 1 1 5 2182 1 1 32 LYS HD2 H -10.882 8.620 7.837 1.00 . A A . 35 LYS HD2 1 1 5 2183 1 1 32 LYS HD3 H -10.341 9.773 6.615 1.00 . A A . 35 LYS HD3 1 1 5 2184 1 1 32 LYS HE2 H -12.709 10.065 7.063 1.00 . A A . 35 LYS HE2 1 1 5 2185 1 1 32 LYS HE3 H -12.461 9.482 5.417 1.00 . A A . 35 LYS HE3 1 1 5 2186 1 1 32 LYS HG2 H -10.322 8.095 4.926 1.00 . A A . 35 LYS HG2 1 1 5 2187 1 1 32 LYS HG3 H -11.140 6.939 5.980 1.00 . A A . 35 LYS HG3 1 1 5 2188 1 1 32 LYS HZ1 H -13.240 7.801 7.740 1.00 . A A . 35 LYS HZ1 1 1 5 2189 1 1 32 LYS HZ2 H -13.021 7.253 6.156 1.00 . A A . 35 LYS HZ2 1 1 5 2190 1 1 32 LYS HZ3 H -14.281 8.323 6.513 1.00 . A A . 35 LYS HZ3 1 1 5 2191 1 1 32 LYS N N -9.586 4.900 5.787 1.00 . A A . 35 LYS N 1 1 5 2192 1 1 32 LYS NZ N -13.297 8.069 6.737 1.00 . A A . 35 LYS NZ 1 1 5 2193 1 1 32 LYS O O -6.723 6.111 7.218 1.00 . A A . 35 LYS O 1 1 5 2194 1 1 33 GLN C C -4.580 3.692 5.138 1.00 . A A . 36 GLN C 1 1 5 2195 1 1 33 GLN CA C -5.605 3.764 6.260 1.00 . A A . 36 GLN CA 1 1 5 2196 1 1 33 GLN CB C -5.864 2.366 6.817 1.00 . A A . 36 GLN CB 1 1 5 2197 1 1 33 GLN CD C -4.066 2.586 8.578 1.00 . A A . 36 GLN CD 1 1 5 2198 1 1 33 GLN CG C -4.643 1.733 7.466 1.00 . A A . 36 GLN CG 1 1 5 2199 1 1 33 GLN H H -7.364 3.934 5.071 1.00 . A A . 36 GLN H 1 1 5 2200 1 1 33 GLN HA H -5.212 4.388 7.049 1.00 . A A . 36 GLN HA 1 1 5 2201 1 1 33 GLN HB2 H -6.649 2.423 7.556 1.00 . A A . 36 GLN HB2 1 1 5 2202 1 1 33 GLN HB3 H -6.185 1.728 6.010 1.00 . A A . 36 GLN HB3 1 1 5 2203 1 1 33 GLN HE21 H -2.871 3.507 7.284 1.00 . A A . 36 GLN HE21 1 1 5 2204 1 1 33 GLN HE22 H -2.743 4.029 8.925 1.00 . A A . 36 GLN HE22 1 1 5 2205 1 1 33 GLN HG2 H -4.925 0.776 7.877 1.00 . A A . 36 GLN HG2 1 1 5 2206 1 1 33 GLN HG3 H -3.883 1.589 6.711 1.00 . A A . 36 GLN HG3 1 1 5 2207 1 1 33 GLN N N -6.847 4.365 5.796 1.00 . A A . 36 GLN N 1 1 5 2208 1 1 33 GLN NE2 N -3.131 3.462 8.227 1.00 . A A . 36 GLN NE2 1 1 5 2209 1 1 33 GLN O O -4.635 2.812 4.281 1.00 . A A . 36 GLN O 1 1 5 2210 1 1 33 GLN OE1 O -4.455 2.459 9.739 1.00 . A A . 36 GLN OE1 1 1 5 2211 1 1 34 SER C C -1.256 4.138 4.747 1.00 . A A . 37 SER C 1 1 5 2212 1 1 34 SER CA C -2.571 4.669 4.174 1.00 . A A . 37 SER CA 1 1 5 2213 1 1 34 SER CB C -2.378 6.104 3.682 1.00 . A A . 37 SER CB 1 1 5 2214 1 1 34 SER H H -3.660 5.282 5.886 1.00 . A A . 37 SER H 1 1 5 2215 1 1 34 SER HA H -2.872 4.051 3.345 1.00 . A A . 37 SER HA 1 1 5 2216 1 1 34 SER HB2 H -1.585 6.128 2.948 1.00 . A A . 37 SER HB2 1 1 5 2217 1 1 34 SER HB3 H -3.294 6.455 3.231 1.00 . A A . 37 SER HB3 1 1 5 2218 1 1 34 SER HG H -2.791 7.515 4.975 1.00 . A A . 37 SER HG 1 1 5 2219 1 1 34 SER N N -3.632 4.612 5.176 1.00 . A A . 37 SER N 1 1 5 2220 1 1 34 SER O O -0.678 4.744 5.650 1.00 . A A . 37 SER O 1 1 5 2221 1 1 34 SER OG O -2.034 6.970 4.749 1.00 . A A . 37 SER OG 1 1 5 2222 1 1 35 THR C C 0.973 1.350 3.730 1.00 . A A . 38 THR C 1 1 5 2223 1 1 35 THR CA C 0.457 2.405 4.704 1.00 . A A . 38 THR CA 1 1 5 2224 1 1 35 THR CB C 0.258 1.760 6.087 1.00 . A A . 38 THR CB 1 1 5 2225 1 1 35 THR CG2 C -0.824 0.690 6.037 1.00 . A A . 38 THR CG2 1 1 5 2226 1 1 35 THR H H -1.285 2.561 3.499 1.00 . A A . 38 THR H 1 1 5 2227 1 1 35 THR HA H 1.194 3.188 4.796 1.00 . A A . 38 THR HA 1 1 5 2228 1 1 35 THR HB H -0.049 2.526 6.784 1.00 . A A . 38 THR HB 1 1 5 2229 1 1 35 THR HG1 H 1.629 1.414 7.463 1.00 . A A . 38 THR HG1 1 1 5 2230 1 1 35 THR HG21 H -0.534 -0.083 5.340 1.00 . A A . 38 THR HG21 1 1 5 2231 1 1 35 THR HG22 H -1.754 1.134 5.715 1.00 . A A . 38 THR HG22 1 1 5 2232 1 1 35 THR HG23 H -0.951 0.260 7.020 1.00 . A A . 38 THR HG23 1 1 5 2233 1 1 35 THR N N -0.784 3.008 4.221 1.00 . A A . 38 THR N 1 1 5 2234 1 1 35 THR O O 0.263 0.952 2.808 1.00 . A A . 38 THR O 1 1 5 2235 1 1 35 THR OG1 O 1.486 1.180 6.543 1.00 . A A . 38 THR OG1 1 1 5 2236 1 1 36 TRP C C 2.672 -1.485 3.740 1.00 . A A . 39 TRP C 1 1 5 2237 1 1 36 TRP CA C 2.783 -0.124 3.063 1.00 . A A . 39 TRP CA 1 1 5 2238 1 1 36 TRP CB C 4.268 0.152 2.766 1.00 . A A . 39 TRP CB 1 1 5 2239 1 1 36 TRP CD1 C 5.206 2.025 4.197 1.00 . A A . 39 TRP CD1 1 1 5 2240 1 1 36 TRP CD2 C 4.803 2.616 2.085 1.00 . A A . 39 TRP CD2 1 1 5 2241 1 1 36 TRP CE2 C 5.322 3.730 2.768 1.00 . A A . 39 TRP CE2 1 1 5 2242 1 1 36 TRP CE3 C 4.476 2.747 0.737 1.00 . A A . 39 TRP CE3 1 1 5 2243 1 1 36 TRP CG C 4.730 1.544 3.024 1.00 . A A . 39 TRP CG 1 1 5 2244 1 1 36 TRP CH2 C 5.192 5.057 0.826 1.00 . A A . 39 TRP CH2 1 1 5 2245 1 1 36 TRP CZ2 C 5.522 4.955 2.146 1.00 . A A . 39 TRP CZ2 1 1 5 2246 1 1 36 TRP CZ3 C 4.674 3.966 0.120 1.00 . A A . 39 TRP CZ3 1 1 5 2247 1 1 36 TRP H H 2.740 1.248 4.682 1.00 . A A . 39 TRP H 1 1 5 2248 1 1 36 TRP HA H 2.225 -0.136 2.139 1.00 . A A . 39 TRP HA 1 1 5 2249 1 1 36 TRP HB2 H 4.870 -0.489 3.392 1.00 . A A . 39 TRP HB2 1 1 5 2250 1 1 36 TRP HB3 H 4.468 -0.073 1.729 1.00 . A A . 39 TRP HB3 1 1 5 2251 1 1 36 TRP HD1 H 5.283 1.435 5.094 1.00 . A A . 39 TRP HD1 1 1 5 2252 1 1 36 TRP HE1 H 5.932 3.915 4.765 1.00 . A A . 39 TRP HE1 1 1 5 2253 1 1 36 TRP HE3 H 4.075 1.916 0.178 1.00 . A A . 39 TRP HE3 1 1 5 2254 1 1 36 TRP HH2 H 5.330 5.992 0.304 1.00 . A A . 39 TRP HH2 1 1 5 2255 1 1 36 TRP HZ2 H 5.923 5.801 2.674 1.00 . A A . 39 TRP HZ2 1 1 5 2256 1 1 36 TRP HZ3 H 4.424 4.086 -0.923 1.00 . A A . 39 TRP HZ3 1 1 5 2257 1 1 36 TRP N N 2.210 0.895 3.936 1.00 . A A . 39 TRP N 1 1 5 2258 1 1 36 TRP NE1 N 5.565 3.344 4.058 1.00 . A A . 39 TRP NE1 1 1 5 2259 1 1 36 TRP O O 3.460 -1.814 4.628 1.00 . A A . 39 TRP O 1 1 5 2260 1 1 37 GLU C C 0.487 -4.379 3.013 1.00 . A A . 40 GLU C 1 1 5 2261 1 1 37 GLU CA C 1.466 -3.593 3.879 1.00 . A A . 40 GLU CA 1 1 5 2262 1 1 37 GLU CB C 0.929 -3.460 5.310 1.00 . A A . 40 GLU CB 1 1 5 2263 1 1 37 GLU CD C -1.081 -3.333 6.833 1.00 . A A . 40 GLU CD 1 1 5 2264 1 1 37 GLU CG C -0.585 -3.553 5.418 1.00 . A A . 40 GLU CG 1 1 5 2265 1 1 37 GLU H H 1.095 -1.960 2.597 1.00 . A A . 40 GLU H 1 1 5 2266 1 1 37 GLU HA H 2.412 -4.112 3.900 1.00 . A A . 40 GLU HA 1 1 5 2267 1 1 37 GLU HB2 H 1.360 -4.241 5.918 1.00 . A A . 40 GLU HB2 1 1 5 2268 1 1 37 GLU HB3 H 1.235 -2.500 5.703 1.00 . A A . 40 GLU HB3 1 1 5 2269 1 1 37 GLU HG2 H -1.027 -2.804 4.778 1.00 . A A . 40 GLU HG2 1 1 5 2270 1 1 37 GLU HG3 H -0.897 -4.535 5.092 1.00 . A A . 40 GLU HG3 1 1 5 2271 1 1 37 GLU N N 1.689 -2.273 3.313 1.00 . A A . 40 GLU N 1 1 5 2272 1 1 37 GLU O O -0.247 -3.797 2.216 1.00 . A A . 40 GLU O 1 1 5 2273 1 1 37 GLU OE1 O -1.008 -4.282 7.643 1.00 . A A . 40 GLU OE1 1 1 5 2274 1 1 37 GLU OE2 O -1.543 -2.212 7.133 1.00 . A A . 40 GLU OE2 1 1 5 2275 1 1 38 LYS C C -1.862 -6.279 2.851 1.00 . A A . 41 LYS C 1 1 5 2276 1 1 38 LYS CA C -0.416 -6.556 2.439 1.00 . A A . 41 LYS CA 1 1 5 2277 1 1 38 LYS CB C -0.067 -8.012 2.726 1.00 . A A . 41 LYS CB 1 1 5 2278 1 1 38 LYS CD C 0.582 -9.650 4.523 1.00 . A A . 41 LYS CD 1 1 5 2279 1 1 38 LYS CE C 1.397 -10.613 3.674 1.00 . A A . 41 LYS CE 1 1 5 2280 1 1 38 LYS CG C 0.701 -8.219 4.021 1.00 . A A . 41 LYS CG 1 1 5 2281 1 1 38 LYS H H 1.099 -6.105 3.805 1.00 . A A . 41 LYS H 1 1 5 2282 1 1 38 LYS HA H -0.294 -6.357 1.386 1.00 . A A . 41 LYS HA 1 1 5 2283 1 1 38 LYS HB2 H -0.975 -8.567 2.797 1.00 . A A . 41 LYS HB2 1 1 5 2284 1 1 38 LYS HB3 H 0.527 -8.398 1.913 1.00 . A A . 41 LYS HB3 1 1 5 2285 1 1 38 LYS HD2 H 0.940 -9.694 5.541 1.00 . A A . 41 LYS HD2 1 1 5 2286 1 1 38 LYS HD3 H -0.457 -9.947 4.491 1.00 . A A . 41 LYS HD3 1 1 5 2287 1 1 38 LYS HE2 H 1.222 -11.619 4.025 1.00 . A A . 41 LYS HE2 1 1 5 2288 1 1 38 LYS HE3 H 1.074 -10.529 2.648 1.00 . A A . 41 LYS HE3 1 1 5 2289 1 1 38 LYS HG2 H 1.742 -7.994 3.850 1.00 . A A . 41 LYS HG2 1 1 5 2290 1 1 38 LYS HG3 H 0.303 -7.549 4.767 1.00 . A A . 41 LYS HG3 1 1 5 2291 1 1 38 LYS HZ1 H 3.047 -9.362 3.397 1.00 . A A . 41 LYS HZ1 1 1 5 2292 1 1 38 LYS HZ2 H 3.387 -11.003 3.174 1.00 . A A . 41 LYS HZ2 1 1 5 2293 1 1 38 LYS HZ3 H 3.183 -10.389 4.735 1.00 . A A . 41 LYS HZ3 1 1 5 2294 1 1 38 LYS N N 0.482 -5.695 3.176 1.00 . A A . 41 LYS N 1 1 5 2295 1 1 38 LYS NZ N 2.856 -10.322 3.750 1.00 . A A . 41 LYS NZ 1 1 5 2296 1 1 38 LYS O O -2.272 -6.649 3.952 1.00 . A A . 41 LYS O 1 1 5 2297 1 1 39 PRO C C -4.983 -6.483 2.042 1.00 . A A . 42 PRO C 1 1 5 2298 1 1 39 PRO CA C -4.046 -5.306 2.295 1.00 . A A . 42 PRO CA 1 1 5 2299 1 1 39 PRO CB C -4.384 -4.145 1.352 1.00 . A A . 42 PRO CB 1 1 5 2300 1 1 39 PRO CD C -2.292 -5.156 0.646 1.00 . A A . 42 PRO CD 1 1 5 2301 1 1 39 PRO CG C -3.216 -3.985 0.426 1.00 . A A . 42 PRO CG 1 1 5 2302 1 1 39 PRO HA H -4.148 -4.978 3.319 1.00 . A A . 42 PRO HA 1 1 5 2303 1 1 39 PRO HB2 H -5.285 -4.381 0.804 1.00 . A A . 42 PRO HB2 1 1 5 2304 1 1 39 PRO HB3 H -4.543 -3.249 1.935 1.00 . A A . 42 PRO HB3 1 1 5 2305 1 1 39 PRO HD2 H -2.466 -5.922 -0.093 1.00 . A A . 42 PRO HD2 1 1 5 2306 1 1 39 PRO HD3 H -1.263 -4.833 0.620 1.00 . A A . 42 PRO HD3 1 1 5 2307 1 1 39 PRO HG2 H -3.565 -3.978 -0.594 1.00 . A A . 42 PRO HG2 1 1 5 2308 1 1 39 PRO HG3 H -2.703 -3.060 0.648 1.00 . A A . 42 PRO HG3 1 1 5 2309 1 1 39 PRO N N -2.660 -5.625 1.985 1.00 . A A . 42 PRO N 1 1 5 2310 1 1 39 PRO O O -5.342 -6.768 0.899 1.00 . A A . 42 PRO O 1 1 6 2311 1 1 12 SER C C -10.728 -0.993 -2.840 1.00 . A A . 15 SER C 1 1 6 2312 1 1 12 SER CA C -10.699 -2.206 -3.762 1.00 . A A . 15 SER CA 1 1 6 2313 1 1 12 SER CB C -11.945 -3.062 -3.533 1.00 . A A . 15 SER CB 1 1 6 2314 1 1 12 SER H H -9.010 -2.888 -2.691 1.00 . A A . 15 SER H 1 1 6 2315 1 1 12 SER HA H -10.686 -1.868 -4.787 1.00 . A A . 15 SER HA 1 1 6 2316 1 1 12 SER HB2 H -11.870 -3.545 -2.571 1.00 . A A . 15 SER HB2 1 1 6 2317 1 1 12 SER HB3 H -12.822 -2.431 -3.553 1.00 . A A . 15 SER HB3 1 1 6 2318 1 1 12 SER HG H -11.365 -4.697 -4.445 1.00 . A A . 15 SER HG 1 1 6 2319 1 1 12 SER N N -9.496 -2.997 -3.534 1.00 . A A . 15 SER N 1 1 6 2320 1 1 12 SER O O -10.654 0.149 -3.295 1.00 . A A . 15 SER O 1 1 6 2321 1 1 12 SER OG O -12.075 -4.057 -4.533 1.00 . A A . 15 SER OG 1 1 6 2322 1 1 13 MET C C -9.516 0.502 -0.437 1.00 . A A . 16 MET C 1 1 6 2323 1 1 13 MET CA C -10.873 -0.182 -0.547 1.00 . A A . 16 MET CA 1 1 6 2324 1 1 13 MET CB C -11.267 -0.736 0.823 1.00 . A A . 16 MET CB 1 1 6 2325 1 1 13 MET CE C -12.319 -1.256 3.640 1.00 . A A . 16 MET CE 1 1 6 2326 1 1 13 MET CG C -12.656 -1.346 0.875 1.00 . A A . 16 MET CG 1 1 6 2327 1 1 13 MET H H -10.897 -2.182 -1.241 1.00 . A A . 16 MET H 1 1 6 2328 1 1 13 MET HA H -11.609 0.543 -0.861 1.00 . A A . 16 MET HA 1 1 6 2329 1 1 13 MET HB2 H -10.554 -1.495 1.108 1.00 . A A . 16 MET HB2 1 1 6 2330 1 1 13 MET HB3 H -11.226 0.067 1.542 1.00 . A A . 16 MET HB3 1 1 6 2331 1 1 13 MET HE1 H -12.855 -0.321 3.596 1.00 . A A . 16 MET HE1 1 1 6 2332 1 1 13 MET HE2 H -11.264 -1.072 3.499 1.00 . A A . 16 MET HE2 1 1 6 2333 1 1 13 MET HE3 H -12.477 -1.715 4.605 1.00 . A A . 16 MET HE3 1 1 6 2334 1 1 13 MET HG2 H -13.386 -0.549 0.867 1.00 . A A . 16 MET HG2 1 1 6 2335 1 1 13 MET HG3 H -12.795 -1.968 0.003 1.00 . A A . 16 MET HG3 1 1 6 2336 1 1 13 MET N N -10.838 -1.250 -1.540 1.00 . A A . 16 MET N 1 1 6 2337 1 1 13 MET O O -9.417 1.627 0.048 1.00 . A A . 16 MET O 1 1 6 2338 1 1 13 MET SD S -12.916 -2.353 2.352 1.00 . A A . 16 MET SD 1 1 6 2339 1 1 14 TRP C C -6.643 0.840 -2.185 1.00 . A A . 17 TRP C 1 1 6 2340 1 1 14 TRP CA C -7.119 0.353 -0.827 1.00 . A A . 17 TRP CA 1 1 6 2341 1 1 14 TRP CB C -6.147 -0.703 -0.296 1.00 . A A . 17 TRP CB 1 1 6 2342 1 1 14 TRP CD1 C -7.629 -2.297 1.051 1.00 . A A . 17 TRP CD1 1 1 6 2343 1 1 14 TRP CD2 C -6.110 -1.188 2.255 1.00 . A A . 17 TRP CD2 1 1 6 2344 1 1 14 TRP CE2 C -6.848 -2.012 3.121 1.00 . A A . 17 TRP CE2 1 1 6 2345 1 1 14 TRP CE3 C -5.095 -0.393 2.776 1.00 . A A . 17 TRP CE3 1 1 6 2346 1 1 14 TRP CG C -6.626 -1.379 0.944 1.00 . A A . 17 TRP CG 1 1 6 2347 1 1 14 TRP CH2 C -5.591 -1.269 4.976 1.00 . A A . 17 TRP CH2 1 1 6 2348 1 1 14 TRP CZ2 C -6.598 -2.060 4.488 1.00 . A A . 17 TRP CZ2 1 1 6 2349 1 1 14 TRP CZ3 C -4.843 -0.440 4.128 1.00 . A A . 17 TRP CZ3 1 1 6 2350 1 1 14 TRP H H -8.616 -1.072 -1.285 1.00 . A A . 17 TRP H 1 1 6 2351 1 1 14 TRP HA H -7.129 1.187 -0.145 1.00 . A A . 17 TRP HA 1 1 6 2352 1 1 14 TRP HB2 H -5.991 -1.457 -1.045 1.00 . A A . 17 TRP HB2 1 1 6 2353 1 1 14 TRP HB3 H -5.202 -0.228 -0.069 1.00 . A A . 17 TRP HB3 1 1 6 2354 1 1 14 TRP HD1 H -8.219 -2.656 0.220 1.00 . A A . 17 TRP HD1 1 1 6 2355 1 1 14 TRP HE1 H -8.422 -3.330 2.695 1.00 . A A . 17 TRP HE1 1 1 6 2356 1 1 14 TRP HE3 H -4.506 0.251 2.136 1.00 . A A . 17 TRP HE3 1 1 6 2357 1 1 14 TRP HH2 H -5.361 -1.275 6.030 1.00 . A A . 17 TRP HH2 1 1 6 2358 1 1 14 TRP HZ2 H -7.170 -2.690 5.151 1.00 . A A . 17 TRP HZ2 1 1 6 2359 1 1 14 TRP HZ3 H -4.061 0.168 4.545 1.00 . A A . 17 TRP HZ3 1 1 6 2360 1 1 14 TRP N N -8.473 -0.185 -0.894 1.00 . A A . 17 TRP N 1 1 6 2361 1 1 14 TRP NE1 N -7.771 -2.683 2.361 1.00 . A A . 17 TRP NE1 1 1 6 2362 1 1 14 TRP O O -6.815 0.163 -3.198 1.00 . A A . 17 TRP O 1 1 6 2363 1 1 15 THR C C -4.003 2.488 -3.439 1.00 . A A . 18 THR C 1 1 6 2364 1 1 15 THR CA C -5.524 2.606 -3.415 1.00 . A A . 18 THR CA 1 1 6 2365 1 1 15 THR CB C -5.925 4.085 -3.546 1.00 . A A . 18 THR CB 1 1 6 2366 1 1 15 THR CG2 C -7.431 4.226 -3.710 1.00 . A A . 18 THR CG2 1 1 6 2367 1 1 15 THR H H -5.954 2.521 -1.357 1.00 . A A . 18 THR H 1 1 6 2368 1 1 15 THR HA H -5.938 2.060 -4.249 1.00 . A A . 18 THR HA 1 1 6 2369 1 1 15 THR HB H -5.446 4.493 -4.418 1.00 . A A . 18 THR HB 1 1 6 2370 1 1 15 THR HG1 H -6.254 5.233 -1.977 1.00 . A A . 18 THR HG1 1 1 6 2371 1 1 15 THR HG21 H -7.929 3.778 -2.862 1.00 . A A . 18 THR HG21 1 1 6 2372 1 1 15 THR HG22 H -7.743 3.726 -4.615 1.00 . A A . 18 THR HG22 1 1 6 2373 1 1 15 THR HG23 H -7.691 5.272 -3.768 1.00 . A A . 18 THR HG23 1 1 6 2374 1 1 15 THR N N -6.045 2.024 -2.194 1.00 . A A . 18 THR N 1 1 6 2375 1 1 15 THR O O -3.332 2.854 -2.477 1.00 . A A . 18 THR O 1 1 6 2376 1 1 15 THR OG1 O -5.496 4.816 -2.392 1.00 . A A . 18 THR OG1 1 1 6 2377 1 1 16 GLU C C -1.399 2.887 -5.546 1.00 . A A . 19 GLU C 1 1 6 2378 1 1 16 GLU CA C -2.024 1.803 -4.672 1.00 . A A . 19 GLU CA 1 1 6 2379 1 1 16 GLU CB C -1.737 0.421 -5.260 1.00 . A A . 19 GLU CB 1 1 6 2380 1 1 16 GLU CD C -0.029 -1.158 -6.234 1.00 . A A . 19 GLU CD 1 1 6 2381 1 1 16 GLU CG C -0.261 0.135 -5.477 1.00 . A A . 19 GLU CG 1 1 6 2382 1 1 16 GLU H H -4.050 1.739 -5.289 1.00 . A A . 19 GLU H 1 1 6 2383 1 1 16 GLU HA H -1.593 1.860 -3.685 1.00 . A A . 19 GLU HA 1 1 6 2384 1 1 16 GLU HB2 H -2.127 -0.329 -4.588 1.00 . A A . 19 GLU HB2 1 1 6 2385 1 1 16 GLU HB3 H -2.242 0.335 -6.211 1.00 . A A . 19 GLU HB3 1 1 6 2386 1 1 16 GLU HG2 H 0.171 0.948 -6.041 1.00 . A A . 19 GLU HG2 1 1 6 2387 1 1 16 GLU HG3 H 0.224 0.066 -4.515 1.00 . A A . 19 GLU HG3 1 1 6 2388 1 1 16 GLU N N -3.466 1.989 -4.544 1.00 . A A . 19 GLU N 1 1 6 2389 1 1 16 GLU O O -1.615 2.924 -6.758 1.00 . A A . 19 GLU O 1 1 6 2390 1 1 16 GLU OE1 O -0.285 -2.235 -5.658 1.00 . A A . 19 GLU OE1 1 1 6 2391 1 1 16 GLU OE2 O 0.406 -1.092 -7.402 1.00 . A A . 19 GLU OE2 1 1 6 2392 1 1 17 HIS C C 1.364 5.231 -4.962 1.00 . A A . 20 HIS C 1 1 6 2393 1 1 17 HIS CA C 0.045 4.859 -5.635 1.00 . A A . 20 HIS CA 1 1 6 2394 1 1 17 HIS CB C -0.858 6.098 -5.688 1.00 . A A . 20 HIS CB 1 1 6 2395 1 1 17 HIS CD2 C -3.397 5.648 -5.436 1.00 . A A . 20 HIS CD2 1 1 6 2396 1 1 17 HIS CE1 C -3.900 5.447 -7.560 1.00 . A A . 20 HIS CE1 1 1 6 2397 1 1 17 HIS CG C -2.255 5.819 -6.143 1.00 . A A . 20 HIS CG 1 1 6 2398 1 1 17 HIS H H -0.470 3.673 -3.950 1.00 . A A . 20 HIS H 1 1 6 2399 1 1 17 HIS HA H 0.247 4.525 -6.642 1.00 . A A . 20 HIS HA 1 1 6 2400 1 1 17 HIS HB2 H -0.914 6.533 -4.702 1.00 . A A . 20 HIS HB2 1 1 6 2401 1 1 17 HIS HB3 H -0.424 6.819 -6.367 1.00 . A A . 20 HIS HB3 1 1 6 2402 1 1 17 HIS HD1 H -1.994 5.758 -8.232 1.00 . A A . 20 HIS HD1 1 1 6 2403 1 1 17 HIS HD2 H -3.498 5.687 -4.358 1.00 . A A . 20 HIS HD2 1 1 6 2404 1 1 17 HIS HE1 H -4.454 5.297 -8.475 1.00 . A A . 20 HIS HE1 1 1 6 2405 1 1 17 HIS HE2 H -5.348 5.278 -6.120 1.00 . A A . 20 HIS HE2 1 1 6 2406 1 1 17 HIS N N -0.614 3.766 -4.918 1.00 . A A . 20 HIS N 1 1 6 2407 1 1 17 HIS ND1 N -2.605 5.686 -7.470 1.00 . A A . 20 HIS ND1 1 1 6 2408 1 1 17 HIS NE2 N -4.404 5.418 -6.340 1.00 . A A . 20 HIS NE2 1 1 6 2409 1 1 17 HIS O O 1.557 4.960 -3.779 1.00 . A A . 20 HIS O 1 1 6 2410 1 1 18 LYS C C 3.386 7.067 -3.904 1.00 . A A . 21 LYS C 1 1 6 2411 1 1 18 LYS CA C 3.558 6.266 -5.188 1.00 . A A . 21 LYS CA 1 1 6 2412 1 1 18 LYS CB C 4.306 7.098 -6.224 1.00 . A A . 21 LYS CB 1 1 6 2413 1 1 18 LYS CD C 3.504 6.970 -8.597 1.00 . A A . 21 LYS CD 1 1 6 2414 1 1 18 LYS CE C 3.632 6.243 -9.927 1.00 . A A . 21 LYS CE 1 1 6 2415 1 1 18 LYS CG C 4.441 6.387 -7.553 1.00 . A A . 21 LYS CG 1 1 6 2416 1 1 18 LYS H H 2.077 5.996 -6.671 1.00 . A A . 21 LYS H 1 1 6 2417 1 1 18 LYS HA H 4.133 5.378 -4.968 1.00 . A A . 21 LYS HA 1 1 6 2418 1 1 18 LYS HB2 H 3.774 8.025 -6.383 1.00 . A A . 21 LYS HB2 1 1 6 2419 1 1 18 LYS HB3 H 5.296 7.316 -5.853 1.00 . A A . 21 LYS HB3 1 1 6 2420 1 1 18 LYS HD2 H 2.487 6.880 -8.246 1.00 . A A . 21 LYS HD2 1 1 6 2421 1 1 18 LYS HD3 H 3.745 8.012 -8.742 1.00 . A A . 21 LYS HD3 1 1 6 2422 1 1 18 LYS HE2 H 4.648 6.338 -10.279 1.00 . A A . 21 LYS HE2 1 1 6 2423 1 1 18 LYS HE3 H 3.399 5.199 -9.776 1.00 . A A . 21 LYS HE3 1 1 6 2424 1 1 18 LYS HG2 H 5.458 6.475 -7.900 1.00 . A A . 21 LYS HG2 1 1 6 2425 1 1 18 LYS HG3 H 4.194 5.347 -7.402 1.00 . A A . 21 LYS HG3 1 1 6 2426 1 1 18 LYS HZ1 H 2.909 7.813 -11.101 1.00 . A A . 21 LYS HZ1 1 1 6 2427 1 1 18 LYS HZ2 H 1.723 6.695 -10.647 1.00 . A A . 21 LYS HZ2 1 1 6 2428 1 1 18 LYS HZ3 H 2.836 6.300 -11.858 1.00 . A A . 21 LYS HZ3 1 1 6 2429 1 1 18 LYS N N 2.270 5.844 -5.722 1.00 . A A . 21 LYS N 1 1 6 2430 1 1 18 LYS NZ N 2.711 6.802 -10.956 1.00 . A A . 21 LYS NZ 1 1 6 2431 1 1 18 LYS O O 2.325 7.640 -3.650 1.00 . A A . 21 LYS O 1 1 6 2432 1 1 19 SER C C 5.826 7.885 -1.234 1.00 . A A . 22 SER C 1 1 6 2433 1 1 19 SER CA C 4.421 7.815 -1.834 1.00 . A A . 22 SER CA 1 1 6 2434 1 1 19 SER CB C 3.457 7.118 -0.870 1.00 . A A . 22 SER CB 1 1 6 2435 1 1 19 SER H H 5.256 6.633 -3.371 1.00 . A A . 22 SER H 1 1 6 2436 1 1 19 SER HA H 4.069 8.818 -2.021 1.00 . A A . 22 SER HA 1 1 6 2437 1 1 19 SER HB2 H 3.374 6.075 -1.139 1.00 . A A . 22 SER HB2 1 1 6 2438 1 1 19 SER HB3 H 3.835 7.200 0.138 1.00 . A A . 22 SER HB3 1 1 6 2439 1 1 19 SER HG H 1.929 8.032 -0.056 1.00 . A A . 22 SER HG 1 1 6 2440 1 1 19 SER N N 4.441 7.102 -3.102 1.00 . A A . 22 SER N 1 1 6 2441 1 1 19 SER O O 6.750 7.256 -1.755 1.00 . A A . 22 SER O 1 1 6 2442 1 1 19 SER OG O 2.172 7.707 -0.927 1.00 . A A . 22 SER OG 1 1 6 2443 1 1 20 PRO C C 8.239 7.634 0.399 1.00 . A A . 23 PRO C 1 1 6 2444 1 1 20 PRO CA C 7.292 8.825 0.544 1.00 . A A . 23 PRO CA 1 1 6 2445 1 1 20 PRO CB C 6.836 8.982 1.989 1.00 . A A . 23 PRO CB 1 1 6 2446 1 1 20 PRO CD C 4.971 9.478 0.536 1.00 . A A . 23 PRO CD 1 1 6 2447 1 1 20 PRO CG C 5.579 9.783 1.890 1.00 . A A . 23 PRO CG 1 1 6 2448 1 1 20 PRO HA H 7.797 9.725 0.231 1.00 . A A . 23 PRO HA 1 1 6 2449 1 1 20 PRO HB2 H 6.652 8.006 2.419 1.00 . A A . 23 PRO HB2 1 1 6 2450 1 1 20 PRO HB3 H 7.593 9.500 2.557 1.00 . A A . 23 PRO HB3 1 1 6 2451 1 1 20 PRO HD2 H 4.055 8.918 0.654 1.00 . A A . 23 PRO HD2 1 1 6 2452 1 1 20 PRO HD3 H 4.785 10.393 -0.008 1.00 . A A . 23 PRO HD3 1 1 6 2453 1 1 20 PRO HG2 H 4.898 9.493 2.677 1.00 . A A . 23 PRO HG2 1 1 6 2454 1 1 20 PRO HG3 H 5.809 10.836 1.965 1.00 . A A . 23 PRO HG3 1 1 6 2455 1 1 20 PRO N N 6.008 8.664 -0.139 1.00 . A A . 23 PRO N 1 1 6 2456 1 1 20 PRO O O 7.812 6.478 0.390 1.00 . A A . 23 PRO O 1 1 6 2457 1 1 21 ASP C C 10.594 6.321 -1.260 1.00 . A A . 24 ASP C 1 1 6 2458 1 1 21 ASP CA C 10.584 6.931 0.143 1.00 . A A . 24 ASP CA 1 1 6 2459 1 1 21 ASP CB C 10.431 5.836 1.203 1.00 . A A . 24 ASP CB 1 1 6 2460 1 1 21 ASP CG C 11.724 5.083 1.451 1.00 . A A . 24 ASP CG 1 1 6 2461 1 1 21 ASP H H 9.792 8.887 0.294 1.00 . A A . 24 ASP H 1 1 6 2462 1 1 21 ASP HA H 11.529 7.430 0.300 1.00 . A A . 24 ASP HA 1 1 6 2463 1 1 21 ASP HB2 H 10.116 6.286 2.133 1.00 . A A . 24 ASP HB2 1 1 6 2464 1 1 21 ASP HB3 H 9.680 5.132 0.878 1.00 . A A . 24 ASP HB3 1 1 6 2465 1 1 21 ASP N N 9.533 7.942 0.284 1.00 . A A . 24 ASP N 1 1 6 2466 1 1 21 ASP O O 11.250 5.308 -1.502 1.00 . A A . 24 ASP O 1 1 6 2467 1 1 21 ASP OD1 O 11.996 4.111 0.716 1.00 . A A . 24 ASP OD1 1 1 6 2468 1 1 21 ASP OD2 O 12.464 5.466 2.381 1.00 . A A . 24 ASP OD2 1 1 6 2469 1 1 22 GLY C C 9.286 5.064 -3.689 1.00 . A A . 25 GLY C 1 1 6 2470 1 1 22 GLY CA C 9.814 6.478 -3.554 1.00 . A A . 25 GLY CA 1 1 6 2471 1 1 22 GLY H H 9.357 7.745 -1.925 1.00 . A A . 25 GLY H 1 1 6 2472 1 1 22 GLY HA2 H 9.170 7.136 -4.123 1.00 . A A . 25 GLY HA2 1 1 6 2473 1 1 22 GLY HA3 H 10.807 6.523 -3.968 1.00 . A A . 25 GLY HA3 1 1 6 2474 1 1 22 GLY N N 9.865 6.951 -2.180 1.00 . A A . 25 GLY N 1 1 6 2475 1 1 22 GLY O O 9.893 4.227 -4.358 1.00 . A A . 25 GLY O 1 1 6 2476 1 1 23 ARG C C 6.007 3.676 -3.172 1.00 . A A . 26 ARG C 1 1 6 2477 1 1 23 ARG CA C 7.515 3.494 -3.117 1.00 . A A . 26 ARG CA 1 1 6 2478 1 1 23 ARG CB C 7.935 2.600 -1.945 1.00 . A A . 26 ARG CB 1 1 6 2479 1 1 23 ARG CD C 9.363 2.745 0.102 1.00 . A A . 26 ARG CD 1 1 6 2480 1 1 23 ARG CG C 8.180 3.334 -0.646 1.00 . A A . 26 ARG CG 1 1 6 2481 1 1 23 ARG CZ C 10.136 0.550 0.896 1.00 . A A . 26 ARG CZ 1 1 6 2482 1 1 23 ARG H H 7.726 5.513 -2.530 1.00 . A A . 26 ARG H 1 1 6 2483 1 1 23 ARG HA H 7.831 3.028 -4.040 1.00 . A A . 26 ARG HA 1 1 6 2484 1 1 23 ARG HB2 H 7.163 1.866 -1.775 1.00 . A A . 26 ARG HB2 1 1 6 2485 1 1 23 ARG HB3 H 8.844 2.092 -2.211 1.00 . A A . 26 ARG HB3 1 1 6 2486 1 1 23 ARG HD2 H 10.272 3.051 -0.391 1.00 . A A . 26 ARG HD2 1 1 6 2487 1 1 23 ARG HD3 H 9.353 3.129 1.107 1.00 . A A . 26 ARG HD3 1 1 6 2488 1 1 23 ARG HE H 8.645 0.834 -0.400 1.00 . A A . 26 ARG HE 1 1 6 2489 1 1 23 ARG HG2 H 8.382 4.368 -0.865 1.00 . A A . 26 ARG HG2 1 1 6 2490 1 1 23 ARG HG3 H 7.302 3.254 -0.026 1.00 . A A . 26 ARG HG3 1 1 6 2491 1 1 23 ARG HH11 H 11.129 2.132 1.668 1.00 . A A . 26 ARG HH11 1 1 6 2492 1 1 23 ARG HH12 H 11.668 0.578 2.215 1.00 . A A . 26 ARG HH12 1 1 6 2493 1 1 23 ARG HH21 H 9.350 -1.219 0.314 1.00 . A A . 26 ARG HH21 1 1 6 2494 1 1 23 ARG HH22 H 10.657 -1.325 1.445 1.00 . A A . 26 ARG HH22 1 1 6 2495 1 1 23 ARG N N 8.153 4.802 -3.056 1.00 . A A . 26 ARG N 1 1 6 2496 1 1 23 ARG NE N 9.316 1.287 0.151 1.00 . A A . 26 ARG NE 1 1 6 2497 1 1 23 ARG NH1 N 11.052 1.134 1.654 1.00 . A A . 26 ARG NH1 1 1 6 2498 1 1 23 ARG NH2 N 10.039 -0.773 0.884 1.00 . A A . 26 ARG NH2 1 1 6 2499 1 1 23 ARG O O 5.509 4.777 -2.953 1.00 . A A . 26 ARG O 1 1 6 2500 1 1 24 THR C C 3.116 2.246 -2.309 1.00 . A A . 27 THR C 1 1 6 2501 1 1 24 THR CA C 3.824 2.717 -3.572 1.00 . A A . 27 THR CA 1 1 6 2502 1 1 24 THR CB C 3.294 1.923 -4.783 1.00 . A A . 27 THR CB 1 1 6 2503 1 1 24 THR CG2 C 3.600 0.436 -4.649 1.00 . A A . 27 THR CG2 1 1 6 2504 1 1 24 THR H H 5.710 1.738 -3.563 1.00 . A A . 27 THR H 1 1 6 2505 1 1 24 THR HA H 3.590 3.762 -3.729 1.00 . A A . 27 THR HA 1 1 6 2506 1 1 24 THR HB H 3.777 2.294 -5.675 1.00 . A A . 27 THR HB 1 1 6 2507 1 1 24 THR HG1 H 1.639 2.129 -5.836 1.00 . A A . 27 THR HG1 1 1 6 2508 1 1 24 THR HG21 H 3.064 0.032 -3.801 1.00 . A A . 27 THR HG21 1 1 6 2509 1 1 24 THR HG22 H 4.660 0.298 -4.504 1.00 . A A . 27 THR HG22 1 1 6 2510 1 1 24 THR HG23 H 3.289 -0.078 -5.548 1.00 . A A . 27 THR HG23 1 1 6 2511 1 1 24 THR N N 5.274 2.608 -3.451 1.00 . A A . 27 THR N 1 1 6 2512 1 1 24 THR O O 3.320 1.127 -1.837 1.00 . A A . 27 THR O 1 1 6 2513 1 1 24 THR OG1 O 1.880 2.114 -4.907 1.00 . A A . 27 THR OG1 1 1 6 2514 1 1 25 TYR C C 0.082 2.533 -0.843 1.00 . A A . 28 TYR C 1 1 6 2515 1 1 25 TYR CA C 1.541 2.850 -0.549 1.00 . A A . 28 TYR CA 1 1 6 2516 1 1 25 TYR CB C 1.653 4.032 0.435 1.00 . A A . 28 TYR CB 1 1 6 2517 1 1 25 TYR CD1 C 0.203 5.489 -1.089 1.00 . A A . 28 TYR CD1 1 1 6 2518 1 1 25 TYR CD2 C 0.411 6.091 1.208 1.00 . A A . 28 TYR CD2 1 1 6 2519 1 1 25 TYR CE1 C -0.620 6.578 -1.303 1.00 . A A . 28 TYR CE1 1 1 6 2520 1 1 25 TYR CE2 C -0.408 7.183 1.000 1.00 . A A . 28 TYR CE2 1 1 6 2521 1 1 25 TYR CG C 0.734 5.220 0.173 1.00 . A A . 28 TYR CG 1 1 6 2522 1 1 25 TYR CZ C -0.922 7.421 -0.256 1.00 . A A . 28 TYR CZ 1 1 6 2523 1 1 25 TYR H H 2.175 4.001 -2.195 1.00 . A A . 28 TYR H 1 1 6 2524 1 1 25 TYR HA H 1.990 1.981 -0.091 1.00 . A A . 28 TYR HA 1 1 6 2525 1 1 25 TYR HB2 H 1.441 3.674 1.427 1.00 . A A . 28 TYR HB2 1 1 6 2526 1 1 25 TYR HB3 H 2.669 4.398 0.413 1.00 . A A . 28 TYR HB3 1 1 6 2527 1 1 25 TYR HD1 H 0.436 4.828 -1.907 1.00 . A A . 28 TYR HD1 1 1 6 2528 1 1 25 TYR HD2 H 0.812 5.903 2.193 1.00 . A A . 28 TYR HD2 1 1 6 2529 1 1 25 TYR HE1 H -1.022 6.765 -2.287 1.00 . A A . 28 TYR HE1 1 1 6 2530 1 1 25 TYR HE2 H -0.641 7.846 1.818 1.00 . A A . 28 TYR HE2 1 1 6 2531 1 1 25 TYR HH H -1.360 9.281 -0.042 1.00 . A A . 28 TYR HH 1 1 6 2532 1 1 25 TYR N N 2.282 3.131 -1.767 1.00 . A A . 28 TYR N 1 1 6 2533 1 1 25 TYR O O -0.412 2.760 -1.954 1.00 . A A . 28 TYR O 1 1 6 2534 1 1 25 TYR OH O -1.739 8.509 -0.467 1.00 . A A . 28 TYR OH 1 1 6 2535 1 1 26 TYR C C -2.836 2.504 0.959 1.00 . A A . 29 TYR C 1 1 6 2536 1 1 26 TYR CA C -1.989 1.630 0.051 1.00 . A A . 29 TYR CA 1 1 6 2537 1 1 26 TYR CB C -2.166 0.157 0.401 1.00 . A A . 29 TYR CB 1 1 6 2538 1 1 26 TYR CD1 C -0.097 -1.116 -0.269 1.00 . A A . 29 TYR CD1 1 1 6 2539 1 1 26 TYR CD2 C -1.998 -1.228 -1.704 1.00 . A A . 29 TYR CD2 1 1 6 2540 1 1 26 TYR CE1 C 0.608 -1.929 -1.134 1.00 . A A . 29 TYR CE1 1 1 6 2541 1 1 26 TYR CE2 C -1.299 -2.044 -2.572 1.00 . A A . 29 TYR CE2 1 1 6 2542 1 1 26 TYR CG C -1.410 -0.752 -0.538 1.00 . A A . 29 TYR CG 1 1 6 2543 1 1 26 TYR CZ C 0.004 -2.390 -2.283 1.00 . A A . 29 TYR CZ 1 1 6 2544 1 1 26 TYR H H -0.125 1.833 1.012 1.00 . A A . 29 TYR H 1 1 6 2545 1 1 26 TYR HA H -2.292 1.787 -0.970 1.00 . A A . 29 TYR HA 1 1 6 2546 1 1 26 TYR HB2 H -1.802 -0.016 1.402 1.00 . A A . 29 TYR HB2 1 1 6 2547 1 1 26 TYR HB3 H -3.213 -0.099 0.352 1.00 . A A . 29 TYR HB3 1 1 6 2548 1 1 26 TYR HD1 H 0.374 -0.755 0.633 1.00 . A A . 29 TYR HD1 1 1 6 2549 1 1 26 TYR HD2 H -3.019 -0.953 -1.927 1.00 . A A . 29 TYR HD2 1 1 6 2550 1 1 26 TYR HE1 H 1.629 -2.201 -0.907 1.00 . A A . 29 TYR HE1 1 1 6 2551 1 1 26 TYR HE2 H -1.773 -2.406 -3.472 1.00 . A A . 29 TYR HE2 1 1 6 2552 1 1 26 TYR HH H 0.603 -2.881 -4.042 1.00 . A A . 29 TYR HH 1 1 6 2553 1 1 26 TYR N N -0.589 1.991 0.164 1.00 . A A . 29 TYR N 1 1 6 2554 1 1 26 TYR O O -2.757 2.406 2.183 1.00 . A A . 29 TYR O 1 1 6 2555 1 1 26 TYR OH O 0.705 -3.202 -3.145 1.00 . A A . 29 TYR OH 1 1 6 2556 1 1 27 TYR C C -5.946 3.756 1.118 1.00 . A A . 30 TYR C 1 1 6 2557 1 1 27 TYR CA C -4.509 4.257 1.099 1.00 . A A . 30 TYR CA 1 1 6 2558 1 1 27 TYR CB C -4.440 5.663 0.491 1.00 . A A . 30 TYR CB 1 1 6 2559 1 1 27 TYR CD1 C -5.695 6.833 2.351 1.00 . A A . 30 TYR CD1 1 1 6 2560 1 1 27 TYR CD2 C -6.339 7.282 0.100 1.00 . A A . 30 TYR CD2 1 1 6 2561 1 1 27 TYR CE1 C -6.673 7.696 2.806 1.00 . A A . 30 TYR CE1 1 1 6 2562 1 1 27 TYR CE2 C -7.316 8.148 0.548 1.00 . A A . 30 TYR CE2 1 1 6 2563 1 1 27 TYR CG C -5.512 6.610 0.991 1.00 . A A . 30 TYR CG 1 1 6 2564 1 1 27 TYR CZ C -7.481 8.352 1.901 1.00 . A A . 30 TYR CZ 1 1 6 2565 1 1 27 TYR H H -3.685 3.366 -0.629 1.00 . A A . 30 TYR H 1 1 6 2566 1 1 27 TYR HA H -4.141 4.297 2.113 1.00 . A A . 30 TYR HA 1 1 6 2567 1 1 27 TYR HB2 H -3.481 6.100 0.727 1.00 . A A . 30 TYR HB2 1 1 6 2568 1 1 27 TYR HB3 H -4.538 5.587 -0.583 1.00 . A A . 30 TYR HB3 1 1 6 2569 1 1 27 TYR HD1 H -5.062 6.318 3.057 1.00 . A A . 30 TYR HD1 1 1 6 2570 1 1 27 TYR HD2 H -6.209 7.120 -0.961 1.00 . A A . 30 TYR HD2 1 1 6 2571 1 1 27 TYR HE1 H -6.801 7.856 3.867 1.00 . A A . 30 TYR HE1 1 1 6 2572 1 1 27 TYR HE2 H -7.950 8.661 -0.162 1.00 . A A . 30 TYR HE2 1 1 6 2573 1 1 27 TYR HH H -9.278 9.035 1.893 1.00 . A A . 30 TYR HH 1 1 6 2574 1 1 27 TYR N N -3.655 3.351 0.350 1.00 . A A . 30 TYR N 1 1 6 2575 1 1 27 TYR O O -6.636 3.762 0.099 1.00 . A A . 30 TYR O 1 1 6 2576 1 1 27 TYR OH O -8.454 9.214 2.351 1.00 . A A . 30 TYR OH 1 1 6 2577 1 1 28 ASN C C -8.702 3.978 2.481 1.00 . A A . 31 ASN C 1 1 6 2578 1 1 28 ASN CA C -7.731 2.814 2.471 1.00 . A A . 31 ASN CA 1 1 6 2579 1 1 28 ASN CB C -7.828 2.035 3.784 1.00 . A A . 31 ASN CB 1 1 6 2580 1 1 28 ASN CG C -8.893 0.955 3.757 1.00 . A A . 31 ASN CG 1 1 6 2581 1 1 28 ASN H H -5.791 3.372 3.068 1.00 . A A . 31 ASN H 1 1 6 2582 1 1 28 ASN HA H -7.962 2.161 1.644 1.00 . A A . 31 ASN HA 1 1 6 2583 1 1 28 ASN HB2 H -6.876 1.568 3.989 1.00 . A A . 31 ASN HB2 1 1 6 2584 1 1 28 ASN HB3 H -8.063 2.725 4.583 1.00 . A A . 31 ASN HB3 1 1 6 2585 1 1 28 ASN HD21 H -9.920 1.955 2.388 1.00 . A A . 31 ASN HD21 1 1 6 2586 1 1 28 ASN HD22 H -10.611 0.460 2.897 1.00 . A A . 31 ASN HD22 1 1 6 2587 1 1 28 ASN N N -6.383 3.324 2.293 1.00 . A A . 31 ASN N 1 1 6 2588 1 1 28 ASN ND2 N -9.909 1.143 2.930 1.00 . A A . 31 ASN ND2 1 1 6 2589 1 1 28 ASN O O -8.802 4.688 3.476 1.00 . A A . 31 ASN O 1 1 6 2590 1 1 28 ASN OD1 O -8.802 -0.039 4.476 1.00 . A A . 31 ASN OD1 1 1 6 2591 1 1 29 THR C C -11.605 5.070 2.059 1.00 . A A . 32 THR C 1 1 6 2592 1 1 29 THR CA C -10.343 5.279 1.227 1.00 . A A . 32 THR CA 1 1 6 2593 1 1 29 THR CB C -10.758 5.476 -0.242 1.00 . A A . 32 THR CB 1 1 6 2594 1 1 29 THR CG2 C -9.560 5.860 -1.098 1.00 . A A . 32 THR CG2 1 1 6 2595 1 1 29 THR H H -9.251 3.576 0.602 1.00 . A A . 32 THR H 1 1 6 2596 1 1 29 THR HA H -9.854 6.183 1.558 1.00 . A A . 32 THR HA 1 1 6 2597 1 1 29 THR HB H -11.486 6.271 -0.291 1.00 . A A . 32 THR HB 1 1 6 2598 1 1 29 THR HG1 H -11.731 3.774 -0.024 1.00 . A A . 32 THR HG1 1 1 6 2599 1 1 29 THR HG21 H -8.792 5.107 -1.004 1.00 . A A . 32 THR HG21 1 1 6 2600 1 1 29 THR HG22 H -9.172 6.812 -0.767 1.00 . A A . 32 THR HG22 1 1 6 2601 1 1 29 THR HG23 H -9.866 5.935 -2.131 1.00 . A A . 32 THR HG23 1 1 6 2602 1 1 29 THR N N -9.392 4.180 1.362 1.00 . A A . 32 THR N 1 1 6 2603 1 1 29 THR O O -12.307 6.031 2.375 1.00 . A A . 32 THR O 1 1 6 2604 1 1 29 THR OG1 O -11.347 4.272 -0.750 1.00 . A A . 32 THR OG1 1 1 6 2605 1 1 30 GLU C C -12.883 3.763 4.680 1.00 . A A . 33 GLU C 1 1 6 2606 1 1 30 GLU CA C -13.091 3.525 3.188 1.00 . A A . 33 GLU CA 1 1 6 2607 1 1 30 GLU CB C -13.524 2.085 2.937 1.00 . A A . 33 GLU CB 1 1 6 2608 1 1 30 GLU CD C -15.250 0.294 3.408 1.00 . A A . 33 GLU CD 1 1 6 2609 1 1 30 GLU CG C -14.665 1.627 3.834 1.00 . A A . 33 GLU CG 1 1 6 2610 1 1 30 GLU H H -11.303 3.090 2.154 1.00 . A A . 33 GLU H 1 1 6 2611 1 1 30 GLU HA H -13.868 4.182 2.848 1.00 . A A . 33 GLU HA 1 1 6 2612 1 1 30 GLU HB2 H -13.842 1.992 1.909 1.00 . A A . 33 GLU HB2 1 1 6 2613 1 1 30 GLU HB3 H -12.674 1.440 3.101 1.00 . A A . 33 GLU HB3 1 1 6 2614 1 1 30 GLU HG2 H -14.296 1.533 4.844 1.00 . A A . 33 GLU HG2 1 1 6 2615 1 1 30 GLU HG3 H -15.447 2.372 3.805 1.00 . A A . 33 GLU HG3 1 1 6 2616 1 1 30 GLU N N -11.897 3.824 2.415 1.00 . A A . 33 GLU N 1 1 6 2617 1 1 30 GLU O O -13.731 4.363 5.342 1.00 . A A . 33 GLU O 1 1 6 2618 1 1 30 GLU OE1 O -15.744 0.201 2.265 1.00 . A A . 33 GLU OE1 1 1 6 2619 1 1 30 GLU OE2 O -15.219 -0.654 4.219 1.00 . A A . 33 GLU OE2 1 1 6 2620 1 1 31 THR C C -10.504 4.617 6.880 1.00 . A A . 34 THR C 1 1 6 2621 1 1 31 THR CA C -11.469 3.457 6.628 1.00 . A A . 34 THR CA 1 1 6 2622 1 1 31 THR CB C -10.891 2.167 7.247 1.00 . A A . 34 THR CB 1 1 6 2623 1 1 31 THR CG2 C -9.435 1.974 6.857 1.00 . A A . 34 THR CG2 1 1 6 2624 1 1 31 THR H H -11.120 2.836 4.626 1.00 . A A . 34 THR H 1 1 6 2625 1 1 31 THR HA H -12.403 3.672 7.124 1.00 . A A . 34 THR HA 1 1 6 2626 1 1 31 THR HB H -11.461 1.323 6.885 1.00 . A A . 34 THR HB 1 1 6 2627 1 1 31 THR HG1 H -11.612 2.914 8.926 1.00 . A A . 34 THR HG1 1 1 6 2628 1 1 31 THR HG21 H -8.825 2.700 7.372 1.00 . A A . 34 THR HG21 1 1 6 2629 1 1 31 THR HG22 H -9.331 2.110 5.792 1.00 . A A . 34 THR HG22 1 1 6 2630 1 1 31 THR HG23 H -9.118 0.978 7.126 1.00 . A A . 34 THR HG23 1 1 6 2631 1 1 31 THR N N -11.761 3.295 5.206 1.00 . A A . 34 THR N 1 1 6 2632 1 1 31 THR O O -10.501 5.195 7.966 1.00 . A A . 34 THR O 1 1 6 2633 1 1 31 THR OG1 O -10.995 2.223 8.676 1.00 . A A . 34 THR OG1 1 1 6 2634 1 1 32 LYS C C -7.414 5.488 6.539 1.00 . A A . 35 LYS C 1 1 6 2635 1 1 32 LYS CA C -8.693 6.005 5.932 1.00 . A A . 35 LYS CA 1 1 6 2636 1 1 32 LYS CB C -9.215 7.227 6.702 1.00 . A A . 35 LYS CB 1 1 6 2637 1 1 32 LYS CD C -10.922 9.060 6.872 1.00 . A A . 35 LYS CD 1 1 6 2638 1 1 32 LYS CE C -12.184 9.661 6.276 1.00 . A A . 35 LYS CE 1 1 6 2639 1 1 32 LYS CG C -10.517 7.785 6.152 1.00 . A A . 35 LYS CG 1 1 6 2640 1 1 32 LYS H H -9.684 4.356 5.073 1.00 . A A . 35 LYS H 1 1 6 2641 1 1 32 LYS HA H -8.475 6.297 4.912 1.00 . A A . 35 LYS HA 1 1 6 2642 1 1 32 LYS HB2 H -9.373 6.949 7.733 1.00 . A A . 35 LYS HB2 1 1 6 2643 1 1 32 LYS HB3 H -8.470 8.007 6.661 1.00 . A A . 35 LYS HB3 1 1 6 2644 1 1 32 LYS HD2 H -11.099 8.833 7.912 1.00 . A A . 35 LYS HD2 1 1 6 2645 1 1 32 LYS HD3 H -10.117 9.777 6.788 1.00 . A A . 35 LYS HD3 1 1 6 2646 1 1 32 LYS HE2 H -12.400 10.589 6.783 1.00 . A A . 35 LYS HE2 1 1 6 2647 1 1 32 LYS HE3 H -12.016 9.857 5.227 1.00 . A A . 35 LYS HE3 1 1 6 2648 1 1 32 LYS HG2 H -10.390 8.001 5.101 1.00 . A A . 35 LYS HG2 1 1 6 2649 1 1 32 LYS HG3 H -11.296 7.048 6.278 1.00 . A A . 35 LYS HG3 1 1 6 2650 1 1 32 LYS HZ1 H -13.158 7.843 5.947 1.00 . A A . 35 LYS HZ1 1 1 6 2651 1 1 32 LYS HZ2 H -14.195 9.179 5.982 1.00 . A A . 35 LYS HZ2 1 1 6 2652 1 1 32 LYS HZ3 H -13.550 8.573 7.423 1.00 . A A . 35 LYS HZ3 1 1 6 2653 1 1 32 LYS N N -9.674 4.919 5.873 1.00 . A A . 35 LYS N 1 1 6 2654 1 1 32 LYS NZ N -13.354 8.750 6.417 1.00 . A A . 35 LYS NZ 1 1 6 2655 1 1 32 LYS O O -6.872 6.056 7.487 1.00 . A A . 35 LYS O 1 1 6 2656 1 1 33 GLN C C -4.690 3.682 5.312 1.00 . A A . 36 GLN C 1 1 6 2657 1 1 33 GLN CA C -5.712 3.765 6.432 1.00 . A A . 36 GLN CA 1 1 6 2658 1 1 33 GLN CB C -6.003 2.367 6.976 1.00 . A A . 36 GLN CB 1 1 6 2659 1 1 33 GLN CD C -4.163 2.448 8.711 1.00 . A A . 36 GLN CD 1 1 6 2660 1 1 33 GLN CG C -4.785 1.672 7.566 1.00 . A A . 36 GLN CG 1 1 6 2661 1 1 33 GLN H H -7.429 4.007 5.198 1.00 . A A . 36 GLN H 1 1 6 2662 1 1 33 GLN HA H -5.309 4.375 7.227 1.00 . A A . 36 GLN HA 1 1 6 2663 1 1 33 GLN HB2 H -6.756 2.441 7.747 1.00 . A A . 36 GLN HB2 1 1 6 2664 1 1 33 GLN HB3 H -6.381 1.758 6.172 1.00 . A A . 36 GLN HB3 1 1 6 2665 1 1 33 GLN HE21 H -2.938 3.375 7.449 1.00 . A A . 36 GLN HE21 1 1 6 2666 1 1 33 GLN HE22 H -2.775 3.812 9.113 1.00 . A A . 36 GLN HE22 1 1 6 2667 1 1 33 GLN HG2 H -5.082 0.701 7.930 1.00 . A A . 36 GLN HG2 1 1 6 2668 1 1 33 GLN HG3 H -4.044 1.552 6.788 1.00 . A A . 36 GLN HG3 1 1 6 2669 1 1 33 GLN N N -6.940 4.393 5.966 1.00 . A A . 36 GLN N 1 1 6 2670 1 1 33 GLN NE2 N -3.194 3.298 8.392 1.00 . A A . 36 GLN NE2 1 1 6 2671 1 1 33 GLN O O -4.758 2.807 4.449 1.00 . A A . 36 GLN O 1 1 6 2672 1 1 33 GLN OE1 O -4.546 2.281 9.869 1.00 . A A . 36 GLN OE1 1 1 6 2673 1 1 34 SER C C -1.365 4.067 4.922 1.00 . A A . 37 SER C 1 1 6 2674 1 1 34 SER CA C -2.666 4.635 4.359 1.00 . A A . 37 SER CA 1 1 6 2675 1 1 34 SER CB C -2.443 6.074 3.890 1.00 . A A . 37 SER CB 1 1 6 2676 1 1 34 SER H H -3.742 5.247 6.076 1.00 . A A . 37 SER H 1 1 6 2677 1 1 34 SER HA H -2.982 4.037 3.518 1.00 . A A . 37 SER HA 1 1 6 2678 1 1 34 SER HB2 H -1.643 6.093 3.165 1.00 . A A . 37 SER HB2 1 1 6 2679 1 1 34 SER HB3 H -3.348 6.447 3.436 1.00 . A A . 37 SER HB3 1 1 6 2680 1 1 34 SER HG H -2.452 6.556 5.790 1.00 . A A . 37 SER HG 1 1 6 2681 1 1 34 SER N N -3.726 4.585 5.359 1.00 . A A . 37 SER N 1 1 6 2682 1 1 34 SER O O -0.725 4.689 5.769 1.00 . A A . 37 SER O 1 1 6 2683 1 1 34 SER OG O -2.094 6.917 4.975 1.00 . A A . 37 SER OG 1 1 6 2684 1 1 35 THR C C 0.765 1.261 3.880 1.00 . A A . 38 THR C 1 1 6 2685 1 1 35 THR CA C 0.236 2.236 4.920 1.00 . A A . 38 THR CA 1 1 6 2686 1 1 35 THR CB C -0.016 1.470 6.234 1.00 . A A . 38 THR CB 1 1 6 2687 1 1 35 THR CG2 C -1.241 0.577 6.111 1.00 . A A . 38 THR CG2 1 1 6 2688 1 1 35 THR H H -1.533 2.420 3.785 1.00 . A A . 38 THR H 1 1 6 2689 1 1 35 THR HA H 0.978 2.999 5.104 1.00 . A A . 38 THR HA 1 1 6 2690 1 1 35 THR HB H -0.196 2.185 7.020 1.00 . A A . 38 THR HB 1 1 6 2691 1 1 35 THR HG1 H 0.840 -0.161 6.938 1.00 . A A . 38 THR HG1 1 1 6 2692 1 1 35 THR HG21 H -1.142 -0.050 5.238 1.00 . A A . 38 THR HG21 1 1 6 2693 1 1 35 THR HG22 H -2.125 1.190 6.016 1.00 . A A . 38 THR HG22 1 1 6 2694 1 1 35 THR HG23 H -1.325 -0.043 6.991 1.00 . A A . 38 THR HG23 1 1 6 2695 1 1 35 THR N N -0.979 2.882 4.452 1.00 . A A . 38 THR N 1 1 6 2696 1 1 35 THR O O 0.076 0.942 2.911 1.00 . A A . 38 THR O 1 1 6 2697 1 1 35 THR OG1 O 1.128 0.680 6.576 1.00 . A A . 38 THR OG1 1 1 6 2698 1 1 36 TRP C C 2.404 -1.547 3.799 1.00 . A A . 39 TRP C 1 1 6 2699 1 1 36 TRP CA C 2.573 -0.177 3.166 1.00 . A A . 39 TRP CA 1 1 6 2700 1 1 36 TRP CB C 4.070 0.089 2.948 1.00 . A A . 39 TRP CB 1 1 6 2701 1 1 36 TRP CD1 C 4.768 2.130 4.267 1.00 . A A . 39 TRP CD1 1 1 6 2702 1 1 36 TRP CD2 C 4.716 2.458 2.062 1.00 . A A . 39 TRP CD2 1 1 6 2703 1 1 36 TRP CE2 C 5.113 3.656 2.682 1.00 . A A . 39 TRP CE2 1 1 6 2704 1 1 36 TRP CE3 C 4.613 2.420 0.672 1.00 . A A . 39 TRP CE3 1 1 6 2705 1 1 36 TRP CG C 4.487 1.507 3.100 1.00 . A A . 39 TRP CG 1 1 6 2706 1 1 36 TRP CH2 C 5.307 4.736 0.597 1.00 . A A . 39 TRP CH2 1 1 6 2707 1 1 36 TRP CZ2 C 5.412 4.802 1.956 1.00 . A A . 39 TRP CZ2 1 1 6 2708 1 1 36 TRP CZ3 C 4.912 3.560 -0.046 1.00 . A A . 39 TRP CZ3 1 1 6 2709 1 1 36 TRP H H 2.506 1.094 4.855 1.00 . A A . 39 TRP H 1 1 6 2710 1 1 36 TRP HA H 2.045 -0.135 2.222 1.00 . A A . 39 TRP HA 1 1 6 2711 1 1 36 TRP HB2 H 4.630 -0.475 3.677 1.00 . A A . 39 TRP HB2 1 1 6 2712 1 1 36 TRP HB3 H 4.347 -0.232 1.957 1.00 . A A . 39 TRP HB3 1 1 6 2713 1 1 36 TRP HD1 H 4.697 1.652 5.227 1.00 . A A . 39 TRP HD1 1 1 6 2714 1 1 36 TRP HE1 H 5.380 4.087 4.719 1.00 . A A . 39 TRP HE1 1 1 6 2715 1 1 36 TRP HE3 H 4.311 1.520 0.159 1.00 . A A . 39 TRP HE3 1 1 6 2716 1 1 36 TRP HH2 H 5.530 5.605 -0.005 1.00 . A A . 39 TRP HH2 1 1 6 2717 1 1 36 TRP HZ2 H 5.720 5.712 2.436 1.00 . A A . 39 TRP HZ2 1 1 6 2718 1 1 36 TRP HZ3 H 4.839 3.551 -1.122 1.00 . A A . 39 TRP HZ3 1 1 6 2719 1 1 36 TRP N N 1.990 0.789 4.080 1.00 . A A . 39 TRP N 1 1 6 2720 1 1 36 TRP NE1 N 5.138 3.431 4.033 1.00 . A A . 39 TRP NE1 1 1 6 2721 1 1 36 TRP O O 3.161 -1.923 4.696 1.00 . A A . 39 TRP O 1 1 6 2722 1 1 37 GLU C C 0.176 -4.382 2.996 1.00 . A A . 40 GLU C 1 1 6 2723 1 1 37 GLU CA C 1.122 -3.597 3.895 1.00 . A A . 40 GLU CA 1 1 6 2724 1 1 37 GLU CB C 0.499 -3.410 5.281 1.00 . A A . 40 GLU CB 1 1 6 2725 1 1 37 GLU CD C -1.714 -3.171 6.478 1.00 . A A . 40 GLU CD 1 1 6 2726 1 1 37 GLU CG C -0.900 -2.812 5.251 1.00 . A A . 40 GLU CG 1 1 6 2727 1 1 37 GLU H H 0.864 -1.963 2.587 1.00 . A A . 40 GLU H 1 1 6 2728 1 1 37 GLU HA H 2.050 -4.137 3.993 1.00 . A A . 40 GLU HA 1 1 6 2729 1 1 37 GLU HB2 H 0.452 -4.364 5.782 1.00 . A A . 40 GLU HB2 1 1 6 2730 1 1 37 GLU HB3 H 1.129 -2.740 5.851 1.00 . A A . 40 GLU HB3 1 1 6 2731 1 1 37 GLU HG2 H -0.813 -1.739 5.201 1.00 . A A . 40 GLU HG2 1 1 6 2732 1 1 37 GLU HG3 H -1.416 -3.168 4.376 1.00 . A A . 40 GLU HG3 1 1 6 2733 1 1 37 GLU N N 1.411 -2.293 3.331 1.00 . A A . 40 GLU N 1 1 6 2734 1 1 37 GLU O O -0.581 -3.797 2.223 1.00 . A A . 40 GLU O 1 1 6 2735 1 1 37 GLU OE1 O -1.577 -2.475 7.505 1.00 . A A . 40 GLU OE1 1 1 6 2736 1 1 37 GLU OE2 O -2.487 -4.149 6.412 1.00 . A A . 40 GLU OE2 1 1 6 2737 1 1 38 LYS C C -2.099 -6.294 2.640 1.00 . A A . 41 LYS C 1 1 6 2738 1 1 38 LYS CA C -0.628 -6.572 2.324 1.00 . A A . 41 LYS CA 1 1 6 2739 1 1 38 LYS CB C -0.295 -8.033 2.629 1.00 . A A . 41 LYS CB 1 1 6 2740 1 1 38 LYS CD C 1.479 -9.719 3.220 1.00 . A A . 41 LYS CD 1 1 6 2741 1 1 38 LYS CE C 0.615 -10.565 4.141 1.00 . A A . 41 LYS CE 1 1 6 2742 1 1 38 LYS CG C 1.073 -8.254 3.260 1.00 . A A . 41 LYS CG 1 1 6 2743 1 1 38 LYS H H 0.860 -6.110 3.718 1.00 . A A . 41 LYS H 1 1 6 2744 1 1 38 LYS HA H -0.443 -6.377 1.280 1.00 . A A . 41 LYS HA 1 1 6 2745 1 1 38 LYS HB2 H -1.042 -8.427 3.299 1.00 . A A . 41 LYS HB2 1 1 6 2746 1 1 38 LYS HB3 H -0.324 -8.579 1.712 1.00 . A A . 41 LYS HB3 1 1 6 2747 1 1 38 LYS HD2 H 1.374 -10.083 2.209 1.00 . A A . 41 LYS HD2 1 1 6 2748 1 1 38 LYS HD3 H 2.511 -9.805 3.530 1.00 . A A . 41 LYS HD3 1 1 6 2749 1 1 38 LYS HE2 H -0.396 -10.573 3.758 1.00 . A A . 41 LYS HE2 1 1 6 2750 1 1 38 LYS HE3 H 1.003 -11.574 4.152 1.00 . A A . 41 LYS HE3 1 1 6 2751 1 1 38 LYS HG2 H 1.805 -7.674 2.722 1.00 . A A . 41 LYS HG2 1 1 6 2752 1 1 38 LYS HG3 H 1.040 -7.933 4.291 1.00 . A A . 41 LYS HG3 1 1 6 2753 1 1 38 LYS HZ1 H 1.572 -9.967 5.898 1.00 . A A . 41 LYS HZ1 1 1 6 2754 1 1 38 LYS HZ2 H 0.054 -10.666 6.151 1.00 . A A . 41 LYS HZ2 1 1 6 2755 1 1 38 LYS HZ3 H 0.167 -9.090 5.550 1.00 . A A . 41 LYS HZ3 1 1 6 2756 1 1 38 LYS N N 0.226 -5.705 3.104 1.00 . A A . 41 LYS N 1 1 6 2757 1 1 38 LYS NZ N 0.602 -10.035 5.532 1.00 . A A . 41 LYS NZ 1 1 6 2758 1 1 38 LYS O O -2.577 -6.650 3.718 1.00 . A A . 41 LYS O 1 1 6 2759 1 1 39 PRO C C -5.155 -6.542 1.696 1.00 . A A . 42 PRO C 1 1 6 2760 1 1 39 PRO CA C -4.251 -5.332 1.921 1.00 . A A . 42 PRO CA 1 1 6 2761 1 1 39 PRO CB C -4.546 -4.235 0.882 1.00 . A A . 42 PRO CB 1 1 6 2762 1 1 39 PRO CD C -2.380 -5.186 0.402 1.00 . A A . 42 PRO CD 1 1 6 2763 1 1 39 PRO CG C -3.270 -4.006 0.133 1.00 . A A . 42 PRO CG 1 1 6 2764 1 1 39 PRO HA H -4.417 -4.939 2.914 1.00 . A A . 42 PRO HA 1 1 6 2765 1 1 39 PRO HB2 H -5.333 -4.565 0.220 1.00 . A A . 42 PRO HB2 1 1 6 2766 1 1 39 PRO HB3 H -4.861 -3.338 1.394 1.00 . A A . 42 PRO HB3 1 1 6 2767 1 1 39 PRO HD2 H -2.519 -5.948 -0.350 1.00 . A A . 42 PRO HD2 1 1 6 2768 1 1 39 PRO HD3 H -1.346 -4.878 0.444 1.00 . A A . 42 PRO HD3 1 1 6 2769 1 1 39 PRO HG2 H -3.478 -3.930 -0.925 1.00 . A A . 42 PRO HG2 1 1 6 2770 1 1 39 PRO HG3 H -2.805 -3.097 0.487 1.00 . A A . 42 PRO HG3 1 1 6 2771 1 1 39 PRO N N -2.841 -5.651 1.714 1.00 . A A . 42 PRO N 1 1 6 2772 1 1 39 PRO O O -6.051 -6.515 0.851 1.00 . A A . 42 PRO O 1 1 7 2773 1 1 12 SER C C -10.521 -1.523 -3.075 1.00 . A A . 15 SER C 1 1 7 2774 1 1 12 SER CA C -10.235 -2.717 -3.976 1.00 . A A . 15 SER CA 1 1 7 2775 1 1 12 SER CB C -11.343 -3.759 -3.824 1.00 . A A . 15 SER CB 1 1 7 2776 1 1 12 SER H H -8.529 -3.080 -2.786 1.00 . A A . 15 SER H 1 1 7 2777 1 1 12 SER HA H -10.199 -2.384 -5.002 1.00 . A A . 15 SER HA 1 1 7 2778 1 1 12 SER HB2 H -11.254 -4.229 -2.857 1.00 . A A . 15 SER HB2 1 1 7 2779 1 1 12 SER HB3 H -12.305 -3.274 -3.904 1.00 . A A . 15 SER HB3 1 1 7 2780 1 1 12 SER HG H -12.129 -5.041 -5.080 1.00 . A A . 15 SER HG 1 1 7 2781 1 1 12 SER N N -8.945 -3.306 -3.643 1.00 . A A . 15 SER N 1 1 7 2782 1 1 12 SER O O -10.705 -0.402 -3.550 1.00 . A A . 15 SER O 1 1 7 2783 1 1 12 SER OG O -11.248 -4.758 -4.825 1.00 . A A . 15 SER OG 1 1 7 2784 1 1 13 MET C C -9.543 0.085 -0.547 1.00 . A A . 16 MET C 1 1 7 2785 1 1 13 MET CA C -10.809 -0.725 -0.795 1.00 . A A . 16 MET CA 1 1 7 2786 1 1 13 MET CB C -11.299 -1.328 0.523 1.00 . A A . 16 MET CB 1 1 7 2787 1 1 13 MET CE C -13.144 -1.598 3.076 1.00 . A A . 16 MET CE 1 1 7 2788 1 1 13 MET CG C -12.599 -2.106 0.398 1.00 . A A . 16 MET CG 1 1 7 2789 1 1 13 MET H H -10.410 -2.693 -1.459 1.00 . A A . 16 MET H 1 1 7 2790 1 1 13 MET HA H -11.572 -0.073 -1.193 1.00 . A A . 16 MET HA 1 1 7 2791 1 1 13 MET HB2 H -10.541 -1.995 0.904 1.00 . A A . 16 MET HB2 1 1 7 2792 1 1 13 MET HB3 H -11.451 -0.529 1.235 1.00 . A A . 16 MET HB3 1 1 7 2793 1 1 13 MET HE1 H -13.404 -1.971 4.055 1.00 . A A . 16 MET HE1 1 1 7 2794 1 1 13 MET HE2 H -13.900 -0.900 2.746 1.00 . A A . 16 MET HE2 1 1 7 2795 1 1 13 MET HE3 H -12.189 -1.096 3.126 1.00 . A A . 16 MET HE3 1 1 7 2796 1 1 13 MET HG2 H -13.391 -1.418 0.144 1.00 . A A . 16 MET HG2 1 1 7 2797 1 1 13 MET HG3 H -12.490 -2.835 -0.391 1.00 . A A . 16 MET HG3 1 1 7 2798 1 1 13 MET N N -10.557 -1.776 -1.772 1.00 . A A . 16 MET N 1 1 7 2799 1 1 13 MET O O -9.584 1.132 0.098 1.00 . A A . 16 MET O 1 1 7 2800 1 1 13 MET SD S -13.045 -2.964 1.922 1.00 . A A . 16 MET SD 1 1 7 2801 1 1 14 TRP C C -6.631 0.856 -2.199 1.00 . A A . 17 TRP C 1 1 7 2802 1 1 14 TRP CA C -7.140 0.274 -0.889 1.00 . A A . 17 TRP CA 1 1 7 2803 1 1 14 TRP CB C -6.092 -0.688 -0.327 1.00 . A A . 17 TRP CB 1 1 7 2804 1 1 14 TRP CD1 C -7.472 -2.275 1.128 1.00 . A A . 17 TRP CD1 1 1 7 2805 1 1 14 TRP CD2 C -5.945 -1.078 2.234 1.00 . A A . 17 TRP CD2 1 1 7 2806 1 1 14 TRP CE2 C -6.622 -1.894 3.154 1.00 . A A . 17 TRP CE2 1 1 7 2807 1 1 14 TRP CE3 C -4.936 -0.235 2.689 1.00 . A A . 17 TRP CE3 1 1 7 2808 1 1 14 TRP CG C -6.503 -1.332 0.951 1.00 . A A . 17 TRP CG 1 1 7 2809 1 1 14 TRP CH2 C -5.324 -1.050 4.934 1.00 . A A . 17 TRP CH2 1 1 7 2810 1 1 14 TRP CZ2 C -6.321 -1.889 4.512 1.00 . A A . 17 TRP CZ2 1 1 7 2811 1 1 14 TRP CZ3 C -4.634 -0.229 4.032 1.00 . A A . 17 TRP CZ3 1 1 7 2812 1 1 14 TRP H H -8.452 -1.239 -1.579 1.00 . A A . 17 TRP H 1 1 7 2813 1 1 14 TRP HA H -7.286 1.077 -0.185 1.00 . A A . 17 TRP HA 1 1 7 2814 1 1 14 TRP HB2 H -5.897 -1.466 -1.044 1.00 . A A . 17 TRP HB2 1 1 7 2815 1 1 14 TRP HB3 H -5.178 -0.140 -0.141 1.00 . A A . 17 TRP HB3 1 1 7 2816 1 1 14 TRP HD1 H -8.081 -2.680 0.333 1.00 . A A . 17 TRP HD1 1 1 7 2817 1 1 14 TRP HE1 H -8.170 -3.274 2.834 1.00 . A A . 17 TRP HE1 1 1 7 2818 1 1 14 TRP HE3 H -4.394 0.405 2.006 1.00 . A A . 17 TRP HE3 1 1 7 2819 1 1 14 TRP HH2 H -5.054 -1.013 5.979 1.00 . A A . 17 TRP HH2 1 1 7 2820 1 1 14 TRP HZ2 H -6.847 -2.514 5.216 1.00 . A A . 17 TRP HZ2 1 1 7 2821 1 1 14 TRP HZ3 H -3.855 0.417 4.399 1.00 . A A . 17 TRP HZ3 1 1 7 2822 1 1 14 TRP N N -8.419 -0.404 -1.066 1.00 . A A . 17 TRP N 1 1 7 2823 1 1 14 TRP NE1 N -7.552 -2.619 2.454 1.00 . A A . 17 TRP NE1 1 1 7 2824 1 1 14 TRP O O -6.646 0.193 -3.236 1.00 . A A . 17 TRP O 1 1 7 2825 1 1 15 THR C C -4.135 2.947 -3.164 1.00 . A A . 18 THR C 1 1 7 2826 1 1 15 THR CA C -5.645 2.775 -3.306 1.00 . A A . 18 THR CA 1 1 7 2827 1 1 15 THR CB C -6.294 4.156 -3.501 1.00 . A A . 18 THR CB 1 1 7 2828 1 1 15 THR CG2 C -7.746 4.017 -3.935 1.00 . A A . 18 THR CG2 1 1 7 2829 1 1 15 THR H H -6.213 2.583 -1.288 1.00 . A A . 18 THR H 1 1 7 2830 1 1 15 THR HA H -5.860 2.166 -4.169 1.00 . A A . 18 THR HA 1 1 7 2831 1 1 15 THR HB H -5.753 4.683 -4.269 1.00 . A A . 18 THR HB 1 1 7 2832 1 1 15 THR HG1 H -7.085 5.289 -2.091 1.00 . A A . 18 THR HG1 1 1 7 2833 1 1 15 THR HG21 H -8.182 4.999 -4.052 1.00 . A A . 18 THR HG21 1 1 7 2834 1 1 15 THR HG22 H -8.295 3.467 -3.186 1.00 . A A . 18 THR HG22 1 1 7 2835 1 1 15 THR HG23 H -7.791 3.490 -4.876 1.00 . A A . 18 THR HG23 1 1 7 2836 1 1 15 THR N N -6.180 2.102 -2.139 1.00 . A A . 18 THR N 1 1 7 2837 1 1 15 THR O O -3.668 3.652 -2.273 1.00 . A A . 18 THR O 1 1 7 2838 1 1 15 THR OG1 O -6.225 4.908 -2.284 1.00 . A A . 18 THR OG1 1 1 7 2839 1 1 16 GLU C C -1.355 3.407 -4.992 1.00 . A A . 19 GLU C 1 1 7 2840 1 1 16 GLU CA C -1.920 2.406 -3.986 1.00 . A A . 19 GLU CA 1 1 7 2841 1 1 16 GLU CB C -1.306 1.023 -4.214 1.00 . A A . 19 GLU CB 1 1 7 2842 1 1 16 GLU CD C -0.868 -0.877 -5.817 1.00 . A A . 19 GLU CD 1 1 7 2843 1 1 16 GLU CG C -1.351 0.551 -5.657 1.00 . A A . 19 GLU CG 1 1 7 2844 1 1 16 GLU H H -3.785 1.767 -4.739 1.00 . A A . 19 GLU H 1 1 7 2845 1 1 16 GLU HA H -1.665 2.734 -2.996 1.00 . A A . 19 GLU HA 1 1 7 2846 1 1 16 GLU HB2 H -0.278 1.047 -3.899 1.00 . A A . 19 GLU HB2 1 1 7 2847 1 1 16 GLU HB3 H -1.840 0.306 -3.609 1.00 . A A . 19 GLU HB3 1 1 7 2848 1 1 16 GLU HG2 H -2.368 0.615 -6.014 1.00 . A A . 19 GLU HG2 1 1 7 2849 1 1 16 GLU HG3 H -0.719 1.197 -6.251 1.00 . A A . 19 GLU HG3 1 1 7 2850 1 1 16 GLU N N -3.371 2.322 -4.054 1.00 . A A . 19 GLU N 1 1 7 2851 1 1 16 GLU O O -1.684 3.378 -6.178 1.00 . A A . 19 GLU O 1 1 7 2852 1 1 16 GLU OE1 O -1.650 -1.804 -5.518 1.00 . A A . 19 GLU OE1 1 1 7 2853 1 1 16 GLU OE2 O 0.292 -1.069 -6.237 1.00 . A A . 19 GLU OE2 1 1 7 2854 1 1 17 HIS C C 1.520 5.668 -4.785 1.00 . A A . 20 HIS C 1 1 7 2855 1 1 17 HIS CA C 0.127 5.332 -5.315 1.00 . A A . 20 HIS CA 1 1 7 2856 1 1 17 HIS CB C -0.717 6.608 -5.337 1.00 . A A . 20 HIS CB 1 1 7 2857 1 1 17 HIS CD2 C -3.243 6.205 -4.901 1.00 . A A . 20 HIS CD2 1 1 7 2858 1 1 17 HIS CE1 C -3.917 6.112 -6.986 1.00 . A A . 20 HIS CE1 1 1 7 2859 1 1 17 HIS CG C -2.155 6.382 -5.690 1.00 . A A . 20 HIS CG 1 1 7 2860 1 1 17 HIS H H -0.306 4.282 -3.527 1.00 . A A . 20 HIS H 1 1 7 2861 1 1 17 HIS HA H 0.215 4.947 -6.320 1.00 . A A . 20 HIS HA 1 1 7 2862 1 1 17 HIS HB2 H -0.686 7.066 -4.361 1.00 . A A . 20 HIS HB2 1 1 7 2863 1 1 17 HIS HB3 H -0.296 7.290 -6.062 1.00 . A A . 20 HIS HB3 1 1 7 2864 1 1 17 HIS HD1 H -2.060 6.410 -7.795 1.00 . A A . 20 HIS HD1 1 1 7 2865 1 1 17 HIS HD2 H -3.259 6.195 -3.818 1.00 . A A . 20 HIS HD2 1 1 7 2866 1 1 17 HIS HE1 H -4.543 6.018 -7.861 1.00 . A A . 20 HIS HE1 1 1 7 2867 1 1 17 HIS HE2 H -5.259 5.976 -5.444 1.00 . A A . 20 HIS HE2 1 1 7 2868 1 1 17 HIS N N -0.508 4.308 -4.488 1.00 . A A . 20 HIS N 1 1 7 2869 1 1 17 HIS ND1 N -2.611 6.318 -6.989 1.00 . A A . 20 HIS ND1 1 1 7 2870 1 1 17 HIS NE2 N -4.323 6.038 -5.732 1.00 . A A . 20 HIS NE2 1 1 7 2871 1 1 17 HIS O O 1.746 5.655 -3.574 1.00 . A A . 20 HIS O 1 1 7 2872 1 1 18 LYS C C 3.840 7.354 -4.198 1.00 . A A . 21 LYS C 1 1 7 2873 1 1 18 LYS CA C 3.814 6.313 -5.310 1.00 . A A . 21 LYS CA 1 1 7 2874 1 1 18 LYS CB C 4.586 6.829 -6.520 1.00 . A A . 21 LYS CB 1 1 7 2875 1 1 18 LYS CD C 3.656 6.266 -8.782 1.00 . A A . 21 LYS CD 1 1 7 2876 1 1 18 LYS CE C 3.669 5.266 -9.928 1.00 . A A . 21 LYS CE 1 1 7 2877 1 1 18 LYS CG C 4.597 5.843 -7.665 1.00 . A A . 21 LYS CG 1 1 7 2878 1 1 18 LYS H H 2.229 5.913 -6.647 1.00 . A A . 21 LYS H 1 1 7 2879 1 1 18 LYS HA H 4.290 5.417 -4.951 1.00 . A A . 21 LYS HA 1 1 7 2880 1 1 18 LYS HB2 H 4.132 7.748 -6.862 1.00 . A A . 21 LYS HB2 1 1 7 2881 1 1 18 LYS HB3 H 5.607 7.026 -6.229 1.00 . A A . 21 LYS HB3 1 1 7 2882 1 1 18 LYS HD2 H 2.652 6.334 -8.389 1.00 . A A . 21 LYS HD2 1 1 7 2883 1 1 18 LYS HD3 H 3.966 7.231 -9.153 1.00 . A A . 21 LYS HD3 1 1 7 2884 1 1 18 LYS HE2 H 4.674 5.196 -10.317 1.00 . A A . 21 LYS HE2 1 1 7 2885 1 1 18 LYS HE3 H 3.361 4.301 -9.551 1.00 . A A . 21 LYS HE3 1 1 7 2886 1 1 18 LYS HG2 H 5.599 5.765 -8.056 1.00 . A A . 21 LYS HG2 1 1 7 2887 1 1 18 LYS HG3 H 4.278 4.887 -7.283 1.00 . A A . 21 LYS HG3 1 1 7 2888 1 1 18 LYS HZ1 H 1.777 5.740 -10.677 1.00 . A A . 21 LYS HZ1 1 1 7 2889 1 1 18 LYS HZ2 H 2.782 4.964 -11.794 1.00 . A A . 21 LYS HZ2 1 1 7 2890 1 1 18 LYS HZ3 H 3.040 6.592 -11.415 1.00 . A A . 21 LYS HZ3 1 1 7 2891 1 1 18 LYS N N 2.452 5.963 -5.693 1.00 . A A . 21 LYS N 1 1 7 2892 1 1 18 LYS NZ N 2.753 5.669 -11.030 1.00 . A A . 21 LYS NZ 1 1 7 2893 1 1 18 LYS O O 2.916 8.156 -4.053 1.00 . A A . 21 LYS O 1 1 7 2894 1 1 19 SER C C 6.498 8.114 -1.719 1.00 . A A . 22 SER C 1 1 7 2895 1 1 19 SER CA C 5.091 8.253 -2.309 1.00 . A A . 22 SER CA 1 1 7 2896 1 1 19 SER CB C 4.025 7.975 -1.249 1.00 . A A . 22 SER CB 1 1 7 2897 1 1 19 SER H H 5.614 6.665 -3.601 1.00 . A A . 22 SER H 1 1 7 2898 1 1 19 SER HA H 4.966 9.257 -2.685 1.00 . A A . 22 SER HA 1 1 7 2899 1 1 19 SER HB2 H 3.635 6.978 -1.389 1.00 . A A . 22 SER HB2 1 1 7 2900 1 1 19 SER HB3 H 4.465 8.055 -0.267 1.00 . A A . 22 SER HB3 1 1 7 2901 1 1 19 SER HG H 2.918 9.432 -0.551 1.00 . A A . 22 SER HG 1 1 7 2902 1 1 19 SER N N 4.917 7.330 -3.422 1.00 . A A . 22 SER N 1 1 7 2903 1 1 19 SER O O 7.264 7.254 -2.165 1.00 . A A . 22 SER O 1 1 7 2904 1 1 19 SER OG O 2.959 8.902 -1.349 1.00 . A A . 22 SER OG 1 1 7 2905 1 1 20 PRO C C 8.785 7.533 -0.014 1.00 . A A . 23 PRO C 1 1 7 2906 1 1 20 PRO CA C 8.181 8.933 -0.079 1.00 . A A . 23 PRO CA 1 1 7 2907 1 1 20 PRO CB C 7.887 9.450 1.330 1.00 . A A . 23 PRO CB 1 1 7 2908 1 1 20 PRO CD C 6.058 10.056 -0.162 1.00 . A A . 23 PRO CD 1 1 7 2909 1 1 20 PRO CG C 6.603 10.222 1.239 1.00 . A A . 23 PRO CG 1 1 7 2910 1 1 20 PRO HA H 8.878 9.598 -0.568 1.00 . A A . 23 PRO HA 1 1 7 2911 1 1 20 PRO HB2 H 7.791 8.612 2.005 1.00 . A A . 23 PRO HB2 1 1 7 2912 1 1 20 PRO HB3 H 8.700 10.082 1.656 1.00 . A A . 23 PRO HB3 1 1 7 2913 1 1 20 PRO HD2 H 5.017 9.784 -0.127 1.00 . A A . 23 PRO HD2 1 1 7 2914 1 1 20 PRO HD3 H 6.187 10.965 -0.727 1.00 . A A . 23 PRO HD3 1 1 7 2915 1 1 20 PRO HG2 H 5.897 9.828 1.955 1.00 . A A . 23 PRO HG2 1 1 7 2916 1 1 20 PRO HG3 H 6.793 11.265 1.442 1.00 . A A . 23 PRO HG3 1 1 7 2917 1 1 20 PRO N N 6.870 8.968 -0.726 1.00 . A A . 23 PRO N 1 1 7 2918 1 1 20 PRO O O 8.065 6.535 0.004 1.00 . A A . 23 PRO O 1 1 7 2919 1 1 21 ASP C C 10.792 5.522 -1.279 1.00 . A A . 24 ASP C 1 1 7 2920 1 1 21 ASP CA C 10.845 6.213 0.082 1.00 . A A . 24 ASP CA 1 1 7 2921 1 1 21 ASP CB C 10.284 5.295 1.176 1.00 . A A . 24 ASP CB 1 1 7 2922 1 1 21 ASP CG C 10.381 5.915 2.556 1.00 . A A . 24 ASP CG 1 1 7 2923 1 1 21 ASP H H 10.624 8.317 0.039 1.00 . A A . 24 ASP H 1 1 7 2924 1 1 21 ASP HA H 11.876 6.440 0.311 1.00 . A A . 24 ASP HA 1 1 7 2925 1 1 21 ASP HB2 H 9.247 5.087 0.969 1.00 . A A . 24 ASP HB2 1 1 7 2926 1 1 21 ASP HB3 H 10.836 4.367 1.180 1.00 . A A . 24 ASP HB3 1 1 7 2927 1 1 21 ASP N N 10.116 7.479 0.034 1.00 . A A . 24 ASP N 1 1 7 2928 1 1 21 ASP O O 11.269 4.398 -1.439 1.00 . A A . 24 ASP O 1 1 7 2929 1 1 21 ASP OD1 O 9.451 6.655 2.941 1.00 . A A . 24 ASP OD1 1 1 7 2930 1 1 21 ASP OD2 O 11.388 5.664 3.251 1.00 . A A . 24 ASP OD2 1 1 7 2931 1 1 22 GLY C C 9.320 4.388 -3.647 1.00 . A A . 25 GLY C 1 1 7 2932 1 1 22 GLY CA C 10.094 5.680 -3.601 1.00 . A A . 25 GLY CA 1 1 7 2933 1 1 22 GLY H H 9.831 7.096 -2.055 1.00 . A A . 25 GLY H 1 1 7 2934 1 1 22 GLY HA2 H 9.585 6.404 -4.228 1.00 . A A . 25 GLY HA2 1 1 7 2935 1 1 22 GLY HA3 H 11.084 5.513 -3.989 1.00 . A A . 25 GLY HA3 1 1 7 2936 1 1 22 GLY N N 10.203 6.215 -2.256 1.00 . A A . 25 GLY N 1 1 7 2937 1 1 22 GLY O O 9.746 3.415 -4.267 1.00 . A A . 25 GLY O 1 1 7 2938 1 1 23 ARG C C 5.857 3.657 -2.972 1.00 . A A . 26 ARG C 1 1 7 2939 1 1 23 ARG CA C 7.313 3.220 -2.944 1.00 . A A . 26 ARG CA 1 1 7 2940 1 1 23 ARG CB C 7.612 2.374 -1.702 1.00 . A A . 26 ARG CB 1 1 7 2941 1 1 23 ARG CD C 8.496 2.333 0.648 1.00 . A A . 26 ARG CD 1 1 7 2942 1 1 23 ARG CG C 7.892 3.189 -0.455 1.00 . A A . 26 ARG CG 1 1 7 2943 1 1 23 ARG CZ C 8.265 -0.012 1.356 1.00 . A A . 26 ARG CZ 1 1 7 2944 1 1 23 ARG H H 7.893 5.206 -2.520 1.00 . A A . 26 ARG H 1 1 7 2945 1 1 23 ARG HA H 7.512 2.630 -3.828 1.00 . A A . 26 ARG HA 1 1 7 2946 1 1 23 ARG HB2 H 6.769 1.730 -1.504 1.00 . A A . 26 ARG HB2 1 1 7 2947 1 1 23 ARG HB3 H 8.478 1.764 -1.901 1.00 . A A . 26 ARG HB3 1 1 7 2948 1 1 23 ARG HD2 H 9.504 2.066 0.367 1.00 . A A . 26 ARG HD2 1 1 7 2949 1 1 23 ARG HD3 H 8.519 2.911 1.559 1.00 . A A . 26 ARG HD3 1 1 7 2950 1 1 23 ARG HE H 6.774 1.127 0.675 1.00 . A A . 26 ARG HE 1 1 7 2951 1 1 23 ARG HG2 H 8.587 3.973 -0.705 1.00 . A A . 26 ARG HG2 1 1 7 2952 1 1 23 ARG HG3 H 6.971 3.618 -0.102 1.00 . A A . 26 ARG HG3 1 1 7 2953 1 1 23 ARG HH11 H 10.138 0.737 1.499 1.00 . A A . 26 ARG HH11 1 1 7 2954 1 1 23 ARG HH12 H 9.959 -0.911 1.998 1.00 . A A . 26 ARG HH12 1 1 7 2955 1 1 23 ARG HH21 H 6.528 -1.046 1.331 1.00 . A A . 26 ARG HH21 1 1 7 2956 1 1 23 ARG HH22 H 7.907 -1.925 1.902 1.00 . A A . 26 ARG HH22 1 1 7 2957 1 1 23 ARG N N 8.174 4.388 -2.989 1.00 . A A . 26 ARG N 1 1 7 2958 1 1 23 ARG NE N 7.731 1.111 0.882 1.00 . A A . 26 ARG NE 1 1 7 2959 1 1 23 ARG NH1 N 9.560 -0.066 1.641 1.00 . A A . 26 ARG NH1 1 1 7 2960 1 1 23 ARG NH2 N 7.504 -1.082 1.545 1.00 . A A . 26 ARG NH2 1 1 7 2961 1 1 23 ARG O O 5.558 4.835 -2.779 1.00 . A A . 26 ARG O 1 1 7 2962 1 1 24 THR C C 2.805 2.614 -2.023 1.00 . A A . 27 THR C 1 1 7 2963 1 1 24 THR CA C 3.538 3.045 -3.287 1.00 . A A . 27 THR CA 1 1 7 2964 1 1 24 THR CB C 2.867 2.386 -4.509 1.00 . A A . 27 THR CB 1 1 7 2965 1 1 24 THR CG2 C 3.145 0.891 -4.547 1.00 . A A . 27 THR CG2 1 1 7 2966 1 1 24 THR H H 5.245 1.794 -3.355 1.00 . A A . 27 THR H 1 1 7 2967 1 1 24 THR HA H 3.452 4.118 -3.394 1.00 . A A . 27 THR HA 1 1 7 2968 1 1 24 THR HB H 3.271 2.833 -5.406 1.00 . A A . 27 THR HB 1 1 7 2969 1 1 24 THR HG1 H 1.081 2.165 -3.708 1.00 . A A . 27 THR HG1 1 1 7 2970 1 1 24 THR HG21 H 2.890 0.452 -3.594 1.00 . A A . 27 THR HG21 1 1 7 2971 1 1 24 THR HG22 H 4.193 0.723 -4.752 1.00 . A A . 27 THR HG22 1 1 7 2972 1 1 24 THR HG23 H 2.548 0.434 -5.323 1.00 . A A . 27 THR HG23 1 1 7 2973 1 1 24 THR N N 4.955 2.720 -3.219 1.00 . A A . 27 THR N 1 1 7 2974 1 1 24 THR O O 2.959 1.486 -1.556 1.00 . A A . 27 THR O 1 1 7 2975 1 1 24 THR OG1 O 1.455 2.608 -4.473 1.00 . A A . 27 THR OG1 1 1 7 2976 1 1 25 TYR C C -0.208 2.986 -0.612 1.00 . A A . 28 TYR C 1 1 7 2977 1 1 25 TYR CA C 1.242 3.246 -0.267 1.00 . A A . 28 TYR CA 1 1 7 2978 1 1 25 TYR CB C 1.315 4.421 0.718 1.00 . A A . 28 TYR CB 1 1 7 2979 1 1 25 TYR CD1 C 1.046 6.574 -0.582 1.00 . A A . 28 TYR CD1 1 1 7 2980 1 1 25 TYR CD2 C -0.782 5.830 0.752 1.00 . A A . 28 TYR CD2 1 1 7 2981 1 1 25 TYR CE1 C 0.313 7.677 -0.977 1.00 . A A . 28 TYR CE1 1 1 7 2982 1 1 25 TYR CE2 C -1.520 6.931 0.361 1.00 . A A . 28 TYR CE2 1 1 7 2983 1 1 25 TYR CG C 0.513 5.632 0.287 1.00 . A A . 28 TYR CG 1 1 7 2984 1 1 25 TYR CZ C -0.969 7.851 -0.504 1.00 . A A . 28 TYR CZ 1 1 7 2985 1 1 25 TYR H H 1.919 4.404 -1.903 1.00 . A A . 28 TYR H 1 1 7 2986 1 1 25 TYR HA H 1.658 2.365 0.199 1.00 . A A . 28 TYR HA 1 1 7 2987 1 1 25 TYR HB2 H 0.936 4.100 1.677 1.00 . A A . 28 TYR HB2 1 1 7 2988 1 1 25 TYR HB3 H 2.342 4.727 0.832 1.00 . A A . 28 TYR HB3 1 1 7 2989 1 1 25 TYR HD1 H 2.052 6.437 -0.951 1.00 . A A . 28 TYR HD1 1 1 7 2990 1 1 25 TYR HD2 H -1.212 5.108 1.430 1.00 . A A . 28 TYR HD2 1 1 7 2991 1 1 25 TYR HE1 H 0.745 8.398 -1.655 1.00 . A A . 28 TYR HE1 1 1 7 2992 1 1 25 TYR HE2 H -2.525 7.068 0.733 1.00 . A A . 28 TYR HE2 1 1 7 2993 1 1 25 TYR HH H -2.136 9.334 -0.131 1.00 . A A . 28 TYR HH 1 1 7 2994 1 1 25 TYR N N 2.003 3.525 -1.477 1.00 . A A . 28 TYR N 1 1 7 2995 1 1 25 TYR O O -0.743 3.580 -1.545 1.00 . A A . 28 TYR O 1 1 7 2996 1 1 25 TYR OH O -1.702 8.947 -0.896 1.00 . A A . 28 TYR OH 1 1 7 2997 1 1 26 TYR C C -3.086 2.529 0.963 1.00 . A A . 29 TYR C 1 1 7 2998 1 1 26 TYR CA C -2.237 1.798 -0.061 1.00 . A A . 29 TYR CA 1 1 7 2999 1 1 26 TYR CB C -2.479 0.288 0.034 1.00 . A A . 29 TYR CB 1 1 7 3000 1 1 26 TYR CD1 C -0.186 -0.715 0.394 1.00 . A A . 29 TYR CD1 1 1 7 3001 1 1 26 TYR CD2 C -1.317 -1.204 -1.647 1.00 . A A . 29 TYR CD2 1 1 7 3002 1 1 26 TYR CE1 C 0.886 -1.486 -0.010 1.00 . A A . 29 TYR CE1 1 1 7 3003 1 1 26 TYR CE2 C -0.247 -1.977 -2.058 1.00 . A A . 29 TYR CE2 1 1 7 3004 1 1 26 TYR CG C -1.306 -0.560 -0.416 1.00 . A A . 29 TYR CG 1 1 7 3005 1 1 26 TYR CZ C 0.852 -2.114 -1.236 1.00 . A A . 29 TYR CZ 1 1 7 3006 1 1 26 TYR H H -0.367 1.704 0.908 1.00 . A A . 29 TYR H 1 1 7 3007 1 1 26 TYR HA H -2.507 2.142 -1.049 1.00 . A A . 29 TYR HA 1 1 7 3008 1 1 26 TYR HB2 H -2.699 0.032 1.052 1.00 . A A . 29 TYR HB2 1 1 7 3009 1 1 26 TYR HB3 H -3.328 0.030 -0.583 1.00 . A A . 29 TYR HB3 1 1 7 3010 1 1 26 TYR HD1 H -0.161 -0.223 1.354 1.00 . A A . 29 TYR HD1 1 1 7 3011 1 1 26 TYR HD2 H -2.180 -1.095 -2.290 1.00 . A A . 29 TYR HD2 1 1 7 3012 1 1 26 TYR HE1 H 1.747 -1.594 0.633 1.00 . A A . 29 TYR HE1 1 1 7 3013 1 1 26 TYR HE2 H -0.275 -2.470 -3.019 1.00 . A A . 29 TYR HE2 1 1 7 3014 1 1 26 TYR HH H 2.155 -2.650 -2.543 1.00 . A A . 29 TYR HH 1 1 7 3015 1 1 26 TYR N N -0.844 2.124 0.163 1.00 . A A . 29 TYR N 1 1 7 3016 1 1 26 TYR O O -2.945 2.322 2.172 1.00 . A A . 29 TYR O 1 1 7 3017 1 1 26 TYR OH O 1.919 -2.881 -1.642 1.00 . A A . 29 TYR OH 1 1 7 3018 1 1 27 TYR C C -6.231 3.637 1.276 1.00 . A A . 30 TYR C 1 1 7 3019 1 1 27 TYR CA C -4.817 4.187 1.317 1.00 . A A . 30 TYR CA 1 1 7 3020 1 1 27 TYR CB C -4.794 5.653 0.870 1.00 . A A . 30 TYR CB 1 1 7 3021 1 1 27 TYR CD1 C -6.203 6.749 2.662 1.00 . A A . 30 TYR CD1 1 1 7 3022 1 1 27 TYR CD2 C -6.923 6.929 0.396 1.00 . A A . 30 TYR CD2 1 1 7 3023 1 1 27 TYR CE1 C -7.301 7.482 3.072 1.00 . A A . 30 TYR CE1 1 1 7 3024 1 1 27 TYR CE2 C -8.021 7.663 0.798 1.00 . A A . 30 TYR CE2 1 1 7 3025 1 1 27 TYR CG C -5.996 6.459 1.318 1.00 . A A . 30 TYR CG 1 1 7 3026 1 1 27 TYR CZ C -8.206 7.937 2.137 1.00 . A A . 30 TYR CZ 1 1 7 3027 1 1 27 TYR H H -3.999 3.516 -0.499 1.00 . A A . 30 TYR H 1 1 7 3028 1 1 27 TYR HA H -4.447 4.121 2.328 1.00 . A A . 30 TYR HA 1 1 7 3029 1 1 27 TYR HB2 H -3.913 6.127 1.275 1.00 . A A . 30 TYR HB2 1 1 7 3030 1 1 27 TYR HB3 H -4.750 5.690 -0.210 1.00 . A A . 30 TYR HB3 1 1 7 3031 1 1 27 TYR HD1 H -5.493 6.391 3.392 1.00 . A A . 30 TYR HD1 1 1 7 3032 1 1 27 TYR HD2 H -6.774 6.712 -0.652 1.00 . A A . 30 TYR HD2 1 1 7 3033 1 1 27 TYR HE1 H -7.445 7.697 4.121 1.00 . A A . 30 TYR HE1 1 1 7 3034 1 1 27 TYR HE2 H -8.731 8.019 0.066 1.00 . A A . 30 TYR HE2 1 1 7 3035 1 1 27 TYR HH H -10.086 8.335 2.103 1.00 . A A . 30 TYR HH 1 1 7 3036 1 1 27 TYR N N -3.947 3.401 0.468 1.00 . A A . 30 TYR N 1 1 7 3037 1 1 27 TYR O O -6.936 3.776 0.277 1.00 . A A . 30 TYR O 1 1 7 3038 1 1 27 TYR OH O -9.299 8.667 2.541 1.00 . A A . 30 TYR OH 1 1 7 3039 1 1 28 ASN C C -8.957 3.583 2.430 1.00 . A A . 31 ASN C 1 1 7 3040 1 1 28 ASN CA C -7.962 2.443 2.459 1.00 . A A . 31 ASN CA 1 1 7 3041 1 1 28 ASN CB C -8.109 1.634 3.752 1.00 . A A . 31 ASN CB 1 1 7 3042 1 1 28 ASN CG C -9.182 0.562 3.662 1.00 . A A . 31 ASN CG 1 1 7 3043 1 1 28 ASN H H -6.039 2.950 3.140 1.00 . A A . 31 ASN H 1 1 7 3044 1 1 28 ASN HA H -8.122 1.802 1.606 1.00 . A A . 31 ASN HA 1 1 7 3045 1 1 28 ASN HB2 H -7.169 1.153 3.974 1.00 . A A . 31 ASN HB2 1 1 7 3046 1 1 28 ASN HB3 H -8.363 2.304 4.560 1.00 . A A . 31 ASN HB3 1 1 7 3047 1 1 28 ASN HD21 H -10.184 1.630 2.323 1.00 . A A . 31 ASN HD21 1 1 7 3048 1 1 28 ASN HD22 H -10.891 0.116 2.754 1.00 . A A . 31 ASN HD22 1 1 7 3049 1 1 28 ASN N N -6.636 3.007 2.368 1.00 . A A . 31 ASN N 1 1 7 3050 1 1 28 ASN ND2 N -10.187 0.794 2.829 1.00 . A A . 31 ASN ND2 1 1 7 3051 1 1 28 ASN O O -9.000 4.378 3.361 1.00 . A A . 31 ASN O 1 1 7 3052 1 1 28 ASN OD1 O -9.104 -0.465 4.335 1.00 . A A . 31 ASN OD1 1 1 7 3053 1 1 29 THR C C -11.827 4.639 2.183 1.00 . A A . 32 THR C 1 1 7 3054 1 1 29 THR CA C -10.690 4.755 1.172 1.00 . A A . 32 THR CA 1 1 7 3055 1 1 29 THR CB C -11.285 4.751 -0.248 1.00 . A A . 32 THR CB 1 1 7 3056 1 1 29 THR CG2 C -10.209 5.028 -1.287 1.00 . A A . 32 THR CG2 1 1 7 3057 1 1 29 THR H H -9.572 3.047 0.603 1.00 . A A . 32 THR H 1 1 7 3058 1 1 29 THR HA H -10.187 5.698 1.322 1.00 . A A . 32 THR HA 1 1 7 3059 1 1 29 THR HB H -12.032 5.530 -0.311 1.00 . A A . 32 THR HB 1 1 7 3060 1 1 29 THR HG1 H -12.616 3.608 -1.152 1.00 . A A . 32 THR HG1 1 1 7 3061 1 1 29 THR HG21 H -10.642 4.982 -2.275 1.00 . A A . 32 THR HG21 1 1 7 3062 1 1 29 THR HG22 H -9.428 4.288 -1.201 1.00 . A A . 32 THR HG22 1 1 7 3063 1 1 29 THR HG23 H -9.793 6.011 -1.121 1.00 . A A . 32 THR HG23 1 1 7 3064 1 1 29 THR N N -9.702 3.691 1.333 1.00 . A A . 32 THR N 1 1 7 3065 1 1 29 THR O O -12.256 5.638 2.761 1.00 . A A . 32 THR O 1 1 7 3066 1 1 29 THR OG1 O -11.904 3.488 -0.519 1.00 . A A . 32 THR OG1 1 1 7 3067 1 1 30 GLU C C -12.950 3.346 4.768 1.00 . A A . 33 GLU C 1 1 7 3068 1 1 30 GLU CA C -13.409 3.185 3.325 1.00 . A A . 33 GLU CA 1 1 7 3069 1 1 30 GLU CB C -13.976 1.783 3.106 1.00 . A A . 33 GLU CB 1 1 7 3070 1 1 30 GLU CD C -16.129 2.170 4.374 1.00 . A A . 33 GLU CD 1 1 7 3071 1 1 30 GLU CG C -14.891 1.305 4.223 1.00 . A A . 33 GLU CG 1 1 7 3072 1 1 30 GLU H H -11.931 2.660 1.909 1.00 . A A . 33 GLU H 1 1 7 3073 1 1 30 GLU HA H -14.176 3.908 3.125 1.00 . A A . 33 GLU HA 1 1 7 3074 1 1 30 GLU HB2 H -14.538 1.777 2.184 1.00 . A A . 33 GLU HB2 1 1 7 3075 1 1 30 GLU HB3 H -13.152 1.090 3.019 1.00 . A A . 33 GLU HB3 1 1 7 3076 1 1 30 GLU HG2 H -15.202 0.294 4.009 1.00 . A A . 33 GLU HG2 1 1 7 3077 1 1 30 GLU HG3 H -14.343 1.323 5.153 1.00 . A A . 33 GLU HG3 1 1 7 3078 1 1 30 GLU N N -12.316 3.421 2.392 1.00 . A A . 33 GLU N 1 1 7 3079 1 1 30 GLU O O -13.572 4.057 5.557 1.00 . A A . 33 GLU O 1 1 7 3080 1 1 30 GLU OE1 O -17.127 1.905 3.671 1.00 . A A . 33 GLU OE1 1 1 7 3081 1 1 30 GLU OE2 O -16.099 3.111 5.193 1.00 . A A . 33 GLU OE2 1 1 7 3082 1 1 31 THR C C -10.572 4.037 6.706 1.00 . A A . 34 THR C 1 1 7 3083 1 1 31 THR CA C -11.307 2.726 6.448 1.00 . A A . 34 THR CA 1 1 7 3084 1 1 31 THR CB C -10.339 1.552 6.694 1.00 . A A . 34 THR CB 1 1 7 3085 1 1 31 THR CG2 C -9.764 1.605 8.102 1.00 . A A . 34 THR CG2 1 1 7 3086 1 1 31 THR H H -11.410 2.141 4.416 1.00 . A A . 34 THR H 1 1 7 3087 1 1 31 THR HA H -12.127 2.638 7.145 1.00 . A A . 34 THR HA 1 1 7 3088 1 1 31 THR HB H -9.526 1.623 5.987 1.00 . A A . 34 THR HB 1 1 7 3089 1 1 31 THR HG1 H -10.852 -0.014 5.610 1.00 . A A . 34 THR HG1 1 1 7 3090 1 1 31 THR HG21 H -10.567 1.540 8.821 1.00 . A A . 34 THR HG21 1 1 7 3091 1 1 31 THR HG22 H -9.232 2.534 8.239 1.00 . A A . 34 THR HG22 1 1 7 3092 1 1 31 THR HG23 H -9.085 0.778 8.244 1.00 . A A . 34 THR HG23 1 1 7 3093 1 1 31 THR N N -11.859 2.678 5.100 1.00 . A A . 34 THR N 1 1 7 3094 1 1 31 THR O O -10.673 4.610 7.792 1.00 . A A . 34 THR O 1 1 7 3095 1 1 31 THR OG1 O -11.019 0.306 6.500 1.00 . A A . 34 THR OG1 1 1 7 3096 1 1 32 LYS C C -7.716 5.404 6.414 1.00 . A A . 35 LYS C 1 1 7 3097 1 1 32 LYS CA C -9.031 5.712 5.756 1.00 . A A . 35 LYS CA 1 1 7 3098 1 1 32 LYS CB C -9.769 6.847 6.477 1.00 . A A . 35 LYS CB 1 1 7 3099 1 1 32 LYS CD C -11.807 8.313 6.606 1.00 . A A . 35 LYS CD 1 1 7 3100 1 1 32 LYS CE C -12.344 7.815 7.939 1.00 . A A . 35 LYS CE 1 1 7 3101 1 1 32 LYS CG C -11.101 7.207 5.839 1.00 . A A . 35 LYS CG 1 1 7 3102 1 1 32 LYS H H -9.749 3.935 4.894 1.00 . A A . 35 LYS H 1 1 7 3103 1 1 32 LYS HA H -8.820 6.009 4.735 1.00 . A A . 35 LYS HA 1 1 7 3104 1 1 32 LYS HB2 H -9.949 6.554 7.499 1.00 . A A . 35 LYS HB2 1 1 7 3105 1 1 32 LYS HB3 H -9.144 7.729 6.471 1.00 . A A . 35 LYS HB3 1 1 7 3106 1 1 32 LYS HD2 H -11.104 9.113 6.788 1.00 . A A . 35 LYS HD2 1 1 7 3107 1 1 32 LYS HD3 H -12.630 8.681 6.011 1.00 . A A . 35 LYS HD3 1 1 7 3108 1 1 32 LYS HE2 H -13.015 6.989 7.756 1.00 . A A . 35 LYS HE2 1 1 7 3109 1 1 32 LYS HE3 H -11.514 7.477 8.543 1.00 . A A . 35 LYS HE3 1 1 7 3110 1 1 32 LYS HG2 H -10.926 7.539 4.827 1.00 . A A . 35 LYS HG2 1 1 7 3111 1 1 32 LYS HG3 H -11.732 6.329 5.827 1.00 . A A . 35 LYS HG3 1 1 7 3112 1 1 32 LYS HZ1 H -13.423 8.512 9.586 1.00 . A A . 35 LYS HZ1 1 1 7 3113 1 1 32 LYS HZ2 H -13.890 9.207 8.116 1.00 . A A . 35 LYS HZ2 1 1 7 3114 1 1 32 LYS HZ3 H -12.448 9.688 8.858 1.00 . A A . 35 LYS HZ3 1 1 7 3115 1 1 32 LYS N N -9.817 4.481 5.698 1.00 . A A . 35 LYS N 1 1 7 3116 1 1 32 LYS NZ N -13.078 8.880 8.676 1.00 . A A . 35 LYS NZ 1 1 7 3117 1 1 32 LYS O O -7.289 6.065 7.361 1.00 . A A . 35 LYS O 1 1 7 3118 1 1 33 GLN C C -4.762 3.842 5.286 1.00 . A A . 36 GLN C 1 1 7 3119 1 1 33 GLN CA C -5.798 3.926 6.398 1.00 . A A . 36 GLN CA 1 1 7 3120 1 1 33 GLN CB C -5.946 2.567 7.082 1.00 . A A . 36 GLN CB 1 1 7 3121 1 1 33 GLN CD C -4.325 0.773 7.808 1.00 . A A . 36 GLN CD 1 1 7 3122 1 1 33 GLN CG C -4.769 2.211 7.974 1.00 . A A . 36 GLN CG 1 1 7 3123 1 1 33 GLN H H -7.490 3.911 5.105 1.00 . A A . 36 GLN H 1 1 7 3124 1 1 33 GLN HA H -5.466 4.649 7.127 1.00 . A A . 36 GLN HA 1 1 7 3125 1 1 33 GLN HB2 H -6.840 2.576 7.689 1.00 . A A . 36 GLN HB2 1 1 7 3126 1 1 33 GLN HB3 H -6.042 1.803 6.325 1.00 . A A . 36 GLN HB3 1 1 7 3127 1 1 33 GLN HE21 H -3.091 1.306 6.346 1.00 . A A . 36 GLN HE21 1 1 7 3128 1 1 33 GLN HE22 H -3.103 -0.374 6.739 1.00 . A A . 36 GLN HE22 1 1 7 3129 1 1 33 GLN HG2 H -3.939 2.857 7.729 1.00 . A A . 36 GLN HG2 1 1 7 3130 1 1 33 GLN HG3 H -5.054 2.369 9.004 1.00 . A A . 36 GLN HG3 1 1 7 3131 1 1 33 GLN N N -7.081 4.374 5.881 1.00 . A A . 36 GLN N 1 1 7 3132 1 1 33 GLN NE2 N -3.415 0.544 6.870 1.00 . A A . 36 GLN NE2 1 1 7 3133 1 1 33 GLN O O -4.761 2.907 4.486 1.00 . A A . 36 GLN O 1 1 7 3134 1 1 33 GLN OE1 O -4.795 -0.122 8.513 1.00 . A A . 36 GLN OE1 1 1 7 3135 1 1 34 SER C C -1.473 4.439 4.839 1.00 . A A . 37 SER C 1 1 7 3136 1 1 34 SER CA C -2.816 4.878 4.252 1.00 . A A . 37 SER CA 1 1 7 3137 1 1 34 SER CB C -2.696 6.297 3.696 1.00 . A A . 37 SER CB 1 1 7 3138 1 1 34 SER H H -3.943 5.538 5.921 1.00 . A A . 37 SER H 1 1 7 3139 1 1 34 SER HA H -3.091 4.209 3.451 1.00 . A A . 37 SER HA 1 1 7 3140 1 1 34 SER HB2 H -1.875 6.338 2.998 1.00 . A A . 37 SER HB2 1 1 7 3141 1 1 34 SER HB3 H -3.612 6.563 3.189 1.00 . A A . 37 SER HB3 1 1 7 3142 1 1 34 SER HG H -3.297 7.554 5.072 1.00 . A A . 37 SER HG 1 1 7 3143 1 1 34 SER N N -3.872 4.822 5.259 1.00 . A A . 37 SER N 1 1 7 3144 1 1 34 SER O O -0.934 5.091 5.733 1.00 . A A . 37 SER O 1 1 7 3145 1 1 34 SER OG O -2.459 7.234 4.732 1.00 . A A . 37 SER OG 1 1 7 3146 1 1 35 THR C C 0.885 1.754 3.829 1.00 . A A . 38 THR C 1 1 7 3147 1 1 35 THR CA C 0.338 2.793 4.803 1.00 . A A . 38 THR CA 1 1 7 3148 1 1 35 THR CB C 0.201 2.150 6.198 1.00 . A A . 38 THR CB 1 1 7 3149 1 1 35 THR CG2 C -0.573 0.844 6.121 1.00 . A A . 38 THR CG2 1 1 7 3150 1 1 35 THR H H -1.418 2.851 3.614 1.00 . A A . 38 THR H 1 1 7 3151 1 1 35 THR HA H 1.038 3.612 4.873 1.00 . A A . 38 THR HA 1 1 7 3152 1 1 35 THR HB H -0.334 2.832 6.843 1.00 . A A . 38 THR HB 1 1 7 3153 1 1 35 THR HG1 H 1.423 1.284 7.482 1.00 . A A . 38 THR HG1 1 1 7 3154 1 1 35 THR HG21 H -0.722 0.453 7.116 1.00 . A A . 38 THR HG21 1 1 7 3155 1 1 35 THR HG22 H -0.017 0.129 5.533 1.00 . A A . 38 THR HG22 1 1 7 3156 1 1 35 THR HG23 H -1.533 1.021 5.657 1.00 . A A . 38 THR HG23 1 1 7 3157 1 1 35 THR N N -0.938 3.329 4.327 1.00 . A A . 38 THR N 1 1 7 3158 1 1 35 THR O O 0.180 1.336 2.910 1.00 . A A . 38 THR O 1 1 7 3159 1 1 35 THR OG1 O 1.499 1.902 6.752 1.00 . A A . 38 THR OG1 1 1 7 3160 1 1 36 TRP C C 2.648 -1.036 3.816 1.00 . A A . 39 TRP C 1 1 7 3161 1 1 36 TRP CA C 2.723 0.329 3.141 1.00 . A A . 39 TRP CA 1 1 7 3162 1 1 36 TRP CB C 4.202 0.617 2.822 1.00 . A A . 39 TRP CB 1 1 7 3163 1 1 36 TRP CD1 C 5.156 2.526 4.196 1.00 . A A . 39 TRP CD1 1 1 7 3164 1 1 36 TRP CD2 C 4.762 3.052 2.062 1.00 . A A . 39 TRP CD2 1 1 7 3165 1 1 36 TRP CE2 C 5.301 4.179 2.705 1.00 . A A . 39 TRP CE2 1 1 7 3166 1 1 36 TRP CE3 C 4.435 3.141 0.710 1.00 . A A . 39 TRP CE3 1 1 7 3167 1 1 36 TRP CG C 4.671 2.014 3.038 1.00 . A A . 39 TRP CG 1 1 7 3168 1 1 36 TRP CH2 C 5.197 5.438 0.716 1.00 . A A . 39 TRP CH2 1 1 7 3169 1 1 36 TRP CZ2 C 5.523 5.378 2.039 1.00 . A A . 39 TRP CZ2 1 1 7 3170 1 1 36 TRP CZ3 C 4.654 4.335 0.050 1.00 . A A . 39 TRP CZ3 1 1 7 3171 1 1 36 TRP H H 2.667 1.706 4.758 1.00 . A A . 39 TRP H 1 1 7 3172 1 1 36 TRP HA H 2.154 0.306 2.224 1.00 . A A . 39 TRP HA 1 1 7 3173 1 1 36 TRP HB2 H 4.814 -0.007 3.453 1.00 . A A . 39 TRP HB2 1 1 7 3174 1 1 36 TRP HB3 H 4.391 0.366 1.789 1.00 . A A . 39 TRP HB3 1 1 7 3175 1 1 36 TRP HD1 H 5.222 1.967 5.116 1.00 . A A . 39 TRP HD1 1 1 7 3176 1 1 36 TRP HE1 H 5.915 4.427 4.695 1.00 . A A . 39 TRP HE1 1 1 7 3177 1 1 36 TRP HE3 H 4.017 2.300 0.180 1.00 . A A . 39 TRP HE3 1 1 7 3178 1 1 36 TRP HH2 H 5.351 6.351 0.162 1.00 . A A . 39 TRP HH2 1 1 7 3179 1 1 36 TRP HZ2 H 5.945 6.234 2.535 1.00 . A A . 39 TRP HZ2 1 1 7 3180 1 1 36 TRP HZ3 H 4.407 4.423 -0.997 1.00 . A A . 39 TRP HZ3 1 1 7 3181 1 1 36 TRP N N 2.138 1.335 4.021 1.00 . A A . 39 TRP N 1 1 7 3182 1 1 36 TRP NE1 N 5.538 3.836 4.009 1.00 . A A . 39 TRP NE1 1 1 7 3183 1 1 36 TRP O O 3.439 -1.342 4.708 1.00 . A A . 39 TRP O 1 1 7 3184 1 1 37 GLU C C 0.591 -4.008 3.050 1.00 . A A . 40 GLU C 1 1 7 3185 1 1 37 GLU CA C 1.511 -3.183 3.942 1.00 . A A . 40 GLU CA 1 1 7 3186 1 1 37 GLU CB C 0.933 -3.081 5.360 1.00 . A A . 40 GLU CB 1 1 7 3187 1 1 37 GLU CD C -1.122 -2.984 6.825 1.00 . A A . 40 GLU CD 1 1 7 3188 1 1 37 GLU CG C -0.585 -3.149 5.417 1.00 . A A . 40 GLU CG 1 1 7 3189 1 1 37 GLU H H 1.087 -1.553 2.672 1.00 . A A . 40 GLU H 1 1 7 3190 1 1 37 GLU HA H 2.478 -3.660 3.987 1.00 . A A . 40 GLU HA 1 1 7 3191 1 1 37 GLU HB2 H 1.330 -3.887 5.957 1.00 . A A . 40 GLU HB2 1 1 7 3192 1 1 37 GLU HB3 H 1.242 -2.137 5.790 1.00 . A A . 40 GLU HB3 1 1 7 3193 1 1 37 GLU HG2 H -0.993 -2.365 4.798 1.00 . A A . 40 GLU HG2 1 1 7 3194 1 1 37 GLU HG3 H -0.904 -4.108 5.037 1.00 . A A . 40 GLU HG3 1 1 7 3195 1 1 37 GLU N N 1.692 -1.853 3.382 1.00 . A A . 40 GLU N 1 1 7 3196 1 1 37 GLU O O -0.142 -3.458 2.229 1.00 . A A . 40 GLU O 1 1 7 3197 1 1 37 GLU OE1 O -1.031 -3.951 7.611 1.00 . A A . 40 GLU OE1 1 1 7 3198 1 1 37 GLU OE2 O -1.635 -1.891 7.142 1.00 . A A . 40 GLU OE2 1 1 7 3199 1 1 38 LYS C C -1.672 -6.007 2.784 1.00 . A A . 41 LYS C 1 1 7 3200 1 1 38 LYS CA C -0.196 -6.225 2.447 1.00 . A A . 41 LYS CA 1 1 7 3201 1 1 38 LYS CB C 0.202 -7.665 2.765 1.00 . A A . 41 LYS CB 1 1 7 3202 1 1 38 LYS CD C 0.859 -9.267 4.591 1.00 . A A . 41 LYS CD 1 1 7 3203 1 1 38 LYS CE C 1.662 -10.203 3.702 1.00 . A A . 41 LYS CE 1 1 7 3204 1 1 38 LYS CG C 0.919 -7.830 4.093 1.00 . A A . 41 LYS CG 1 1 7 3205 1 1 38 LYS H H 1.241 -5.703 3.873 1.00 . A A . 41 LYS H 1 1 7 3206 1 1 38 LYS HA H -0.030 -6.033 1.399 1.00 . A A . 41 LYS HA 1 1 7 3207 1 1 38 LYS HB2 H -0.685 -8.256 2.800 1.00 . A A . 41 LYS HB2 1 1 7 3208 1 1 38 LYS HB3 H 0.847 -8.032 1.983 1.00 . A A . 41 LYS HB3 1 1 7 3209 1 1 38 LYS HD2 H 1.261 -9.308 5.593 1.00 . A A . 41 LYS HD2 1 1 7 3210 1 1 38 LYS HD3 H -0.171 -9.590 4.602 1.00 . A A . 41 LYS HD3 1 1 7 3211 1 1 38 LYS HE2 H 1.277 -10.142 2.694 1.00 . A A . 41 LYS HE2 1 1 7 3212 1 1 38 LYS HE3 H 2.697 -9.891 3.710 1.00 . A A . 41 LYS HE3 1 1 7 3213 1 1 38 LYS HG2 H 1.953 -7.545 3.971 1.00 . A A . 41 LYS HG2 1 1 7 3214 1 1 38 LYS HG3 H 0.450 -7.184 4.821 1.00 . A A . 41 LYS HG3 1 1 7 3215 1 1 38 LYS HZ1 H 0.593 -11.945 4.137 1.00 . A A . 41 LYS HZ1 1 1 7 3216 1 1 38 LYS HZ2 H 1.929 -11.693 5.142 1.00 . A A . 41 LYS HZ2 1 1 7 3217 1 1 38 LYS HZ3 H 2.156 -12.228 3.554 1.00 . A A . 41 LYS HZ3 1 1 7 3218 1 1 38 LYS N N 0.635 -5.324 3.215 1.00 . A A . 41 LYS N 1 1 7 3219 1 1 38 LYS NZ N 1.580 -11.617 4.165 1.00 . A A . 41 LYS NZ 1 1 7 3220 1 1 38 LYS O O -2.124 -6.394 3.861 1.00 . A A . 41 LYS O 1 1 7 3221 1 1 39 PRO C C -4.733 -6.357 1.922 1.00 . A A . 42 PRO C 1 1 7 3222 1 1 39 PRO CA C -3.867 -5.118 2.107 1.00 . A A . 42 PRO CA 1 1 7 3223 1 1 39 PRO CB C -4.224 -4.054 1.056 1.00 . A A . 42 PRO CB 1 1 7 3224 1 1 39 PRO CD C -2.034 -4.906 0.552 1.00 . A A . 42 PRO CD 1 1 7 3225 1 1 39 PRO CG C -2.953 -3.739 0.333 1.00 . A A . 42 PRO CG 1 1 7 3226 1 1 39 PRO HA H -4.029 -4.714 3.096 1.00 . A A . 42 PRO HA 1 1 7 3227 1 1 39 PRO HB2 H -4.970 -4.449 0.382 1.00 . A A . 42 PRO HB2 1 1 7 3228 1 1 39 PRO HB3 H -4.615 -3.181 1.555 1.00 . A A . 42 PRO HB3 1 1 7 3229 1 1 39 PRO HD2 H -2.191 -5.661 -0.205 1.00 . A A . 42 PRO HD2 1 1 7 3230 1 1 39 PRO HD3 H -1.004 -4.584 0.563 1.00 . A A . 42 PRO HD3 1 1 7 3231 1 1 39 PRO HG2 H -3.152 -3.613 -0.721 1.00 . A A . 42 PRO HG2 1 1 7 3232 1 1 39 PRO HG3 H -2.519 -2.838 0.742 1.00 . A A . 42 PRO HG3 1 1 7 3233 1 1 39 PRO N N -2.450 -5.387 1.873 1.00 . A A . 42 PRO N 1 1 7 3234 1 1 39 PRO O O -5.772 -6.498 2.568 1.00 . A A . 42 PRO O 1 1 8 3235 1 1 12 SER C C -10.642 -1.840 -2.706 1.00 . A A . 15 SER C 1 1 8 3236 1 1 12 SER CA C -10.354 -3.130 -3.463 1.00 . A A . 15 SER CA 1 1 8 3237 1 1 12 SER CB C -11.387 -4.197 -3.093 1.00 . A A . 15 SER CB 1 1 8 3238 1 1 12 SER H H -8.606 -3.382 -2.299 1.00 . A A . 15 SER H 1 1 8 3239 1 1 12 SER HA H -10.412 -2.935 -4.522 1.00 . A A . 15 SER HA 1 1 8 3240 1 1 12 SER HB2 H -11.318 -4.410 -2.036 1.00 . A A . 15 SER HB2 1 1 8 3241 1 1 12 SER HB3 H -12.377 -3.832 -3.322 1.00 . A A . 15 SER HB3 1 1 8 3242 1 1 12 SER HG H -11.804 -5.466 -4.525 1.00 . A A . 15 SER HG 1 1 8 3243 1 1 12 SER N N -9.009 -3.605 -3.164 1.00 . A A . 15 SER N 1 1 8 3244 1 1 12 SER O O -10.916 -0.801 -3.306 1.00 . A A . 15 SER O 1 1 8 3245 1 1 12 SER OG O -11.163 -5.395 -3.814 1.00 . A A . 15 SER OG 1 1 8 3246 1 1 13 MET C C -9.537 0.052 -0.366 1.00 . A A . 16 MET C 1 1 8 3247 1 1 13 MET CA C -10.816 -0.760 -0.533 1.00 . A A . 16 MET CA 1 1 8 3248 1 1 13 MET CB C -11.329 -1.202 0.840 1.00 . A A . 16 MET CB 1 1 8 3249 1 1 13 MET CE C -13.173 -1.174 3.403 1.00 . A A . 16 MET CE 1 1 8 3250 1 1 13 MET CG C -12.649 -1.955 0.787 1.00 . A A . 16 MET CG 1 1 8 3251 1 1 13 MET H H -10.356 -2.778 -0.964 1.00 . A A . 16 MET H 1 1 8 3252 1 1 13 MET HA H -11.564 -0.145 -1.010 1.00 . A A . 16 MET HA 1 1 8 3253 1 1 13 MET HB2 H -10.592 -1.845 1.297 1.00 . A A . 16 MET HB2 1 1 8 3254 1 1 13 MET HB3 H -11.464 -0.327 1.460 1.00 . A A . 16 MET HB3 1 1 8 3255 1 1 13 MET HE1 H -12.198 -0.711 3.419 1.00 . A A . 16 MET HE1 1 1 8 3256 1 1 13 MET HE2 H -13.461 -1.441 4.409 1.00 . A A . 16 MET HE2 1 1 8 3257 1 1 13 MET HE3 H -13.894 -0.481 2.994 1.00 . A A . 16 MET HE3 1 1 8 3258 1 1 13 MET HG2 H -13.422 -1.275 0.464 1.00 . A A . 16 MET HG2 1 1 8 3259 1 1 13 MET HG3 H -12.557 -2.760 0.073 1.00 . A A . 16 MET HG3 1 1 8 3260 1 1 13 MET N N -10.574 -1.919 -1.381 1.00 . A A . 16 MET N 1 1 8 3261 1 1 13 MET O O -9.554 1.144 0.198 1.00 . A A . 16 MET O 1 1 8 3262 1 1 13 MET SD S -13.119 -2.649 2.385 1.00 . A A . 16 MET SD 1 1 8 3263 1 1 14 TRP C C -6.601 0.572 -2.132 1.00 . A A . 17 TRP C 1 1 8 3264 1 1 14 TRP CA C -7.136 0.177 -0.763 1.00 . A A . 17 TRP CA 1 1 8 3265 1 1 14 TRP CB C -6.115 -0.730 -0.069 1.00 . A A . 17 TRP CB 1 1 8 3266 1 1 14 TRP CD1 C -7.627 -2.284 1.295 1.00 . A A . 17 TRP CD1 1 1 8 3267 1 1 14 TRP CD2 C -6.141 -1.133 2.503 1.00 . A A . 17 TRP CD2 1 1 8 3268 1 1 14 TRP CE2 C -6.900 -1.934 3.374 1.00 . A A . 17 TRP CE2 1 1 8 3269 1 1 14 TRP CE3 C -5.139 -0.321 3.031 1.00 . A A . 17 TRP CE3 1 1 8 3270 1 1 14 TRP CG C -6.626 -1.365 1.183 1.00 . A A . 17 TRP CG 1 1 8 3271 1 1 14 TRP CH2 C -5.696 -1.136 5.241 1.00 . A A . 17 TRP CH2 1 1 8 3272 1 1 14 TRP CZ2 C -6.687 -1.943 4.749 1.00 . A A . 17 TRP CZ2 1 1 8 3273 1 1 14 TRP CZ3 C -4.925 -0.331 4.392 1.00 . A A . 17 TRP CZ3 1 1 8 3274 1 1 14 TRP H H -8.484 -1.360 -1.317 1.00 . A A . 17 TRP H 1 1 8 3275 1 1 14 TRP HA H -7.269 1.068 -0.173 1.00 . A A . 17 TRP HA 1 1 8 3276 1 1 14 TRP HB2 H -5.822 -1.516 -0.742 1.00 . A A . 17 TRP HB2 1 1 8 3277 1 1 14 TRP HB3 H -5.245 -0.143 0.190 1.00 . A A . 17 TRP HB3 1 1 8 3278 1 1 14 TRP HD1 H -8.194 -2.671 0.461 1.00 . A A . 17 TRP HD1 1 1 8 3279 1 1 14 TRP HE1 H -8.462 -3.268 2.947 1.00 . A A . 17 TRP HE1 1 1 8 3280 1 1 14 TRP HE3 H -4.534 0.305 2.390 1.00 . A A . 17 TRP HE3 1 1 8 3281 1 1 14 TRP HH2 H -5.494 -1.112 6.302 1.00 . A A . 17 TRP HH2 1 1 8 3282 1 1 14 TRP HZ2 H -7.275 -2.556 5.414 1.00 . A A . 17 TRP HZ2 1 1 8 3283 1 1 14 TRP HZ3 H -4.153 0.291 4.815 1.00 . A A . 17 TRP HZ3 1 1 8 3284 1 1 14 TRP N N -8.429 -0.491 -0.868 1.00 . A A . 17 TRP N 1 1 8 3285 1 1 14 TRP NE1 N -7.802 -2.629 2.612 1.00 . A A . 17 TRP NE1 1 1 8 3286 1 1 14 TRP O O -6.522 -0.253 -3.042 1.00 . A A . 17 TRP O 1 1 8 3287 1 1 15 THR C C -4.177 2.535 -3.358 1.00 . A A . 18 THR C 1 1 8 3288 1 1 15 THR CA C -5.682 2.346 -3.508 1.00 . A A . 18 THR CA 1 1 8 3289 1 1 15 THR CB C -6.328 3.686 -3.902 1.00 . A A . 18 THR CB 1 1 8 3290 1 1 15 THR CG2 C -7.822 3.519 -4.130 1.00 . A A . 18 THR CG2 1 1 8 3291 1 1 15 THR H H -6.349 2.455 -1.515 1.00 . A A . 18 THR H 1 1 8 3292 1 1 15 THR HA H -5.880 1.623 -4.285 1.00 . A A . 18 THR HA 1 1 8 3293 1 1 15 THR HB H -5.878 4.028 -4.816 1.00 . A A . 18 THR HB 1 1 8 3294 1 1 15 THR HG1 H -5.240 5.063 -3.003 1.00 . A A . 18 THR HG1 1 1 8 3295 1 1 15 THR HG21 H -7.989 2.779 -4.899 1.00 . A A . 18 THR HG21 1 1 8 3296 1 1 15 THR HG22 H -8.247 4.462 -4.438 1.00 . A A . 18 THR HG22 1 1 8 3297 1 1 15 THR HG23 H -8.292 3.195 -3.212 1.00 . A A . 18 THR HG23 1 1 8 3298 1 1 15 THR N N -6.237 1.840 -2.268 1.00 . A A . 18 THR N 1 1 8 3299 1 1 15 THR O O -3.721 3.134 -2.385 1.00 . A A . 18 THR O 1 1 8 3300 1 1 15 THR OG1 O -6.102 4.660 -2.877 1.00 . A A . 18 THR OG1 1 1 8 3301 1 1 16 GLU C C -1.420 3.238 -5.162 1.00 . A A . 19 GLU C 1 1 8 3302 1 1 16 GLU CA C -1.954 2.149 -4.235 1.00 . A A . 19 GLU CA 1 1 8 3303 1 1 16 GLU CB C -1.300 0.802 -4.553 1.00 . A A . 19 GLU CB 1 1 8 3304 1 1 16 GLU CD C -0.748 -0.936 -6.302 1.00 . A A . 19 GLU CD 1 1 8 3305 1 1 16 GLU CG C -1.238 0.473 -6.035 1.00 . A A . 19 GLU CG 1 1 8 3306 1 1 16 GLU H H -3.807 1.572 -5.076 1.00 . A A . 19 GLU H 1 1 8 3307 1 1 16 GLU HA H -1.711 2.416 -3.223 1.00 . A A . 19 GLU HA 1 1 8 3308 1 1 16 GLU HB2 H -0.296 0.809 -4.170 1.00 . A A . 19 GLU HB2 1 1 8 3309 1 1 16 GLU HB3 H -1.857 0.020 -4.057 1.00 . A A . 19 GLU HB3 1 1 8 3310 1 1 16 GLU HG2 H -2.225 0.583 -6.459 1.00 . A A . 19 GLU HG2 1 1 8 3311 1 1 16 GLU HG3 H -0.562 1.169 -6.510 1.00 . A A . 19 GLU HG3 1 1 8 3312 1 1 16 GLU N N -3.402 2.034 -4.315 1.00 . A A . 19 GLU N 1 1 8 3313 1 1 16 GLU O O -1.744 3.281 -6.349 1.00 . A A . 19 GLU O 1 1 8 3314 1 1 16 GLU OE1 O -1.586 -1.863 -6.317 1.00 . A A . 19 GLU OE1 1 1 8 3315 1 1 16 GLU OE2 O 0.473 -1.113 -6.496 1.00 . A A . 19 GLU OE2 1 1 8 3316 1 1 17 HIS C C 1.345 5.627 -4.773 1.00 . A A . 20 HIS C 1 1 8 3317 1 1 17 HIS CA C -0.009 5.229 -5.361 1.00 . A A . 20 HIS CA 1 1 8 3318 1 1 17 HIS CB C -0.942 6.445 -5.363 1.00 . A A . 20 HIS CB 1 1 8 3319 1 1 17 HIS CD2 C -3.488 5.954 -5.292 1.00 . A A . 20 HIS CD2 1 1 8 3320 1 1 17 HIS CE1 C -3.850 5.822 -7.452 1.00 . A A . 20 HIS CE1 1 1 8 3321 1 1 17 HIS CG C -2.306 6.167 -5.917 1.00 . A A . 20 HIS CG 1 1 8 3322 1 1 17 HIS H H -0.386 4.036 -3.642 1.00 . A A . 20 HIS H 1 1 8 3323 1 1 17 HIS HA H 0.135 4.892 -6.376 1.00 . A A . 20 HIS HA 1 1 8 3324 1 1 17 HIS HB2 H -1.062 6.798 -4.349 1.00 . A A . 20 HIS HB2 1 1 8 3325 1 1 17 HIS HB3 H -0.494 7.228 -5.959 1.00 . A A . 20 HIS HB3 1 1 8 3326 1 1 17 HIS HD1 H -1.908 6.186 -7.986 1.00 . A A . 20 HIS HD1 1 1 8 3327 1 1 17 HIS HD2 H -3.659 5.950 -4.225 1.00 . A A . 20 HIS HD2 1 1 8 3328 1 1 17 HIS HE1 H -4.339 5.696 -8.407 1.00 . A A . 20 HIS HE1 1 1 8 3329 1 1 17 HIS HE2 H -5.363 5.477 -6.115 1.00 . A A . 20 HIS HE2 1 1 8 3330 1 1 17 HIS N N -0.601 4.128 -4.598 1.00 . A A . 20 HIS N 1 1 8 3331 1 1 17 HIS ND1 N -2.565 6.078 -7.268 1.00 . A A . 20 HIS ND1 1 1 8 3332 1 1 17 HIS NE2 N -4.431 5.742 -6.269 1.00 . A A . 20 HIS NE2 1 1 8 3333 1 1 17 HIS O O 1.572 5.476 -3.573 1.00 . A A . 20 HIS O 1 1 8 3334 1 1 18 LYS C C 3.507 7.364 -3.898 1.00 . A A . 21 LYS C 1 1 8 3335 1 1 18 LYS CA C 3.568 6.559 -5.187 1.00 . A A . 21 LYS CA 1 1 8 3336 1 1 18 LYS CB C 4.241 7.381 -6.279 1.00 . A A . 21 LYS CB 1 1 8 3337 1 1 18 LYS CD C 3.783 7.160 -8.735 1.00 . A A . 21 LYS CD 1 1 8 3338 1 1 18 LYS CE C 3.947 6.280 -9.962 1.00 . A A . 21 LYS CE 1 1 8 3339 1 1 18 LYS CG C 4.497 6.572 -7.529 1.00 . A A . 21 LYS CG 1 1 8 3340 1 1 18 LYS H H 2.016 6.197 -6.576 1.00 . A A . 21 LYS H 1 1 8 3341 1 1 18 LYS HA H 4.155 5.671 -5.010 1.00 . A A . 21 LYS HA 1 1 8 3342 1 1 18 LYS HB2 H 3.607 8.217 -6.535 1.00 . A A . 21 LYS HB2 1 1 8 3343 1 1 18 LYS HB3 H 5.187 7.751 -5.912 1.00 . A A . 21 LYS HB3 1 1 8 3344 1 1 18 LYS HD2 H 2.732 7.254 -8.510 1.00 . A A . 21 LYS HD2 1 1 8 3345 1 1 18 LYS HD3 H 4.198 8.136 -8.945 1.00 . A A . 21 LYS HD3 1 1 8 3346 1 1 18 LYS HE2 H 3.499 5.318 -9.763 1.00 . A A . 21 LYS HE2 1 1 8 3347 1 1 18 LYS HE3 H 3.442 6.746 -10.795 1.00 . A A . 21 LYS HE3 1 1 8 3348 1 1 18 LYS HG2 H 5.559 6.549 -7.723 1.00 . A A . 21 LYS HG2 1 1 8 3349 1 1 18 LYS HG3 H 4.135 5.570 -7.357 1.00 . A A . 21 LYS HG3 1 1 8 3350 1 1 18 LYS HZ1 H 5.893 5.675 -9.507 1.00 . A A . 21 LYS HZ1 1 1 8 3351 1 1 18 LYS HZ2 H 5.815 6.990 -10.568 1.00 . A A . 21 LYS HZ2 1 1 8 3352 1 1 18 LYS HZ3 H 5.462 5.433 -11.126 1.00 . A A . 21 LYS HZ3 1 1 8 3353 1 1 18 LYS N N 2.241 6.131 -5.625 1.00 . A A . 21 LYS N 1 1 8 3354 1 1 18 LYS NZ N 5.380 6.081 -10.315 1.00 . A A . 21 LYS NZ 1 1 8 3355 1 1 18 LYS O O 2.506 8.014 -3.598 1.00 . A A . 21 LYS O 1 1 8 3356 1 1 19 SER C C 6.153 7.990 -1.382 1.00 . A A . 22 SER C 1 1 8 3357 1 1 19 SER CA C 4.705 8.013 -1.879 1.00 . A A . 22 SER CA 1 1 8 3358 1 1 19 SER CB C 3.769 7.347 -0.866 1.00 . A A . 22 SER CB 1 1 8 3359 1 1 19 SER H H 5.370 6.799 -3.470 1.00 . A A . 22 SER H 1 1 8 3360 1 1 19 SER HA H 4.398 9.038 -2.029 1.00 . A A . 22 SER HA 1 1 8 3361 1 1 19 SER HB2 H 3.833 6.275 -0.974 1.00 . A A . 22 SER HB2 1 1 8 3362 1 1 19 SER HB3 H 4.062 7.624 0.135 1.00 . A A . 22 SER HB3 1 1 8 3363 1 1 19 SER HG H 2.404 8.676 -1.308 1.00 . A A . 22 SER HG 1 1 8 3364 1 1 19 SER N N 4.603 7.318 -3.152 1.00 . A A . 22 SER N 1 1 8 3365 1 1 19 SER O O 6.993 7.314 -1.982 1.00 . A A . 22 SER O 1 1 8 3366 1 1 19 SER OG O 2.429 7.744 -1.079 1.00 . A A . 22 SER OG 1 1 8 3367 1 1 20 PRO C C 8.557 7.457 0.199 1.00 . A A . 23 PRO C 1 1 8 3368 1 1 20 PRO CA C 7.822 8.795 0.269 1.00 . A A . 23 PRO CA 1 1 8 3369 1 1 20 PRO CB C 7.586 9.200 1.733 1.00 . A A . 23 PRO CB 1 1 8 3370 1 1 20 PRO CD C 5.563 9.605 0.462 1.00 . A A . 23 PRO CD 1 1 8 3371 1 1 20 PRO CG C 6.132 9.554 1.853 1.00 . A A . 23 PRO CG 1 1 8 3372 1 1 20 PRO HA H 8.418 9.552 -0.219 1.00 . A A . 23 PRO HA 1 1 8 3373 1 1 20 PRO HB2 H 7.837 8.369 2.377 1.00 . A A . 23 PRO HB2 1 1 8 3374 1 1 20 PRO HB3 H 8.214 10.044 1.976 1.00 . A A . 23 PRO HB3 1 1 8 3375 1 1 20 PRO HD2 H 4.557 9.217 0.453 1.00 . A A . 23 PRO HD2 1 1 8 3376 1 1 20 PRO HD3 H 5.580 10.613 0.082 1.00 . A A . 23 PRO HD3 1 1 8 3377 1 1 20 PRO HG2 H 5.620 8.802 2.433 1.00 . A A . 23 PRO HG2 1 1 8 3378 1 1 20 PRO HG3 H 6.033 10.519 2.330 1.00 . A A . 23 PRO HG3 1 1 8 3379 1 1 20 PRO N N 6.473 8.739 -0.297 1.00 . A A . 23 PRO N 1 1 8 3380 1 1 20 PRO O O 7.935 6.401 0.084 1.00 . A A . 23 PRO O 1 1 8 3381 1 1 21 ASP C C 10.739 5.748 -1.207 1.00 . A A . 24 ASP C 1 1 8 3382 1 1 21 ASP CA C 10.727 6.325 0.208 1.00 . A A . 24 ASP CA 1 1 8 3383 1 1 21 ASP CB C 10.256 5.271 1.218 1.00 . A A . 24 ASP CB 1 1 8 3384 1 1 21 ASP CG C 10.309 5.777 2.646 1.00 . A A . 24 ASP CG 1 1 8 3385 1 1 21 ASP H H 10.315 8.391 0.373 1.00 . A A . 24 ASP H 1 1 8 3386 1 1 21 ASP HA H 11.734 6.624 0.463 1.00 . A A . 24 ASP HA 1 1 8 3387 1 1 21 ASP HB2 H 9.237 4.995 0.994 1.00 . A A . 24 ASP HB2 1 1 8 3388 1 1 21 ASP HB3 H 10.883 4.396 1.143 1.00 . A A . 24 ASP HB3 1 1 8 3389 1 1 21 ASP N N 9.886 7.518 0.273 1.00 . A A . 24 ASP N 1 1 8 3390 1 1 21 ASP O O 11.360 4.717 -1.465 1.00 . A A . 24 ASP O 1 1 8 3391 1 1 21 ASP OD1 O 9.353 6.458 3.073 1.00 . A A . 24 ASP OD1 1 1 8 3392 1 1 21 ASP OD2 O 11.310 5.492 3.339 1.00 . A A . 24 ASP OD2 1 1 8 3393 1 1 22 GLY C C 9.286 4.667 -3.638 1.00 . A A . 25 GLY C 1 1 8 3394 1 1 22 GLY CA C 9.983 5.993 -3.501 1.00 . A A . 25 GLY CA 1 1 8 3395 1 1 22 GLY H H 9.553 7.226 -1.846 1.00 . A A . 25 GLY H 1 1 8 3396 1 1 22 GLY HA2 H 9.438 6.729 -4.083 1.00 . A A . 25 GLY HA2 1 1 8 3397 1 1 22 GLY HA3 H 10.985 5.910 -3.884 1.00 . A A . 25 GLY HA3 1 1 8 3398 1 1 22 GLY N N 10.043 6.430 -2.119 1.00 . A A . 25 GLY N 1 1 8 3399 1 1 22 GLY O O 9.800 3.735 -4.256 1.00 . A A . 25 GLY O 1 1 8 3400 1 1 23 ARG C C 5.827 3.767 -3.063 1.00 . A A . 26 ARG C 1 1 8 3401 1 1 23 ARG CA C 7.300 3.392 -3.082 1.00 . A A . 26 ARG CA 1 1 8 3402 1 1 23 ARG CB C 7.654 2.488 -1.900 1.00 . A A . 26 ARG CB 1 1 8 3403 1 1 23 ARG CD C 8.645 2.384 0.404 1.00 . A A . 26 ARG CD 1 1 8 3404 1 1 23 ARG CG C 7.893 3.237 -0.601 1.00 . A A . 26 ARG CG 1 1 8 3405 1 1 23 ARG CZ C 8.934 -0.047 0.664 1.00 . A A . 26 ARG CZ 1 1 8 3406 1 1 23 ARG H H 7.759 5.388 -2.583 1.00 . A A . 26 ARG H 1 1 8 3407 1 1 23 ARG HA H 7.515 2.873 -4.003 1.00 . A A . 26 ARG HA 1 1 8 3408 1 1 23 ARG HB2 H 6.847 1.794 -1.743 1.00 . A A . 26 ARG HB2 1 1 8 3409 1 1 23 ARG HB3 H 8.551 1.935 -2.141 1.00 . A A . 26 ARG HB3 1 1 8 3410 1 1 23 ARG HD2 H 9.693 2.384 0.143 1.00 . A A . 26 ARG HD2 1 1 8 3411 1 1 23 ARG HD3 H 8.521 2.815 1.386 1.00 . A A . 26 ARG HD3 1 1 8 3412 1 1 23 ARG HE H 7.204 0.860 0.256 1.00 . A A . 26 ARG HE 1 1 8 3413 1 1 23 ARG HG2 H 8.472 4.122 -0.810 1.00 . A A . 26 ARG HG2 1 1 8 3414 1 1 23 ARG HG3 H 6.942 3.518 -0.180 1.00 . A A . 26 ARG HG3 1 1 8 3415 1 1 23 ARG HH11 H 10.624 1.034 0.901 1.00 . A A . 26 ARG HH11 1 1 8 3416 1 1 23 ARG HH12 H 10.808 -0.679 1.077 1.00 . A A . 26 ARG HH12 1 1 8 3417 1 1 23 ARG HH21 H 7.439 -1.397 0.485 1.00 . A A . 26 ARG HH21 1 1 8 3418 1 1 23 ARG HH22 H 8.999 -2.060 0.840 1.00 . A A . 26 ARG HH22 1 1 8 3419 1 1 23 ARG N N 8.105 4.596 -3.053 1.00 . A A . 26 ARG N 1 1 8 3420 1 1 23 ARG NE N 8.157 1.006 0.427 1.00 . A A . 26 ARG NE 1 1 8 3421 1 1 23 ARG NH1 N 10.228 0.116 0.900 1.00 . A A . 26 ARG NH1 1 1 8 3422 1 1 23 ARG NH2 N 8.415 -1.268 0.663 1.00 . A A . 26 ARG NH2 1 1 8 3423 1 1 23 ARG O O 5.479 4.912 -2.789 1.00 . A A . 26 ARG O 1 1 8 3424 1 1 24 THR C C 2.855 2.607 -2.102 1.00 . A A . 27 THR C 1 1 8 3425 1 1 24 THR CA C 3.532 3.079 -3.378 1.00 . A A . 27 THR CA 1 1 8 3426 1 1 24 THR CB C 2.857 2.400 -4.584 1.00 . A A . 27 THR CB 1 1 8 3427 1 1 24 THR CG2 C 3.247 0.932 -4.676 1.00 . A A . 27 THR CG2 1 1 8 3428 1 1 24 THR H H 5.285 1.902 -3.537 1.00 . A A . 27 THR H 1 1 8 3429 1 1 24 THR HA H 3.398 4.147 -3.470 1.00 . A A . 27 THR HA 1 1 8 3430 1 1 24 THR HB H 3.182 2.899 -5.487 1.00 . A A . 27 THR HB 1 1 8 3431 1 1 24 THR HG1 H 1.038 2.401 -5.345 1.00 . A A . 27 THR HG1 1 1 8 3432 1 1 24 THR HG21 H 2.656 0.451 -5.443 1.00 . A A . 27 THR HG21 1 1 8 3433 1 1 24 THR HG22 H 3.066 0.449 -3.726 1.00 . A A . 27 THR HG22 1 1 8 3434 1 1 24 THR HG23 H 4.294 0.852 -4.926 1.00 . A A . 27 THR HG23 1 1 8 3435 1 1 24 THR N N 4.961 2.806 -3.346 1.00 . A A . 27 THR N 1 1 8 3436 1 1 24 THR O O 3.101 1.497 -1.628 1.00 . A A . 27 THR O 1 1 8 3437 1 1 24 THR OG1 O 1.434 2.513 -4.477 1.00 . A A . 27 THR OG1 1 1 8 3438 1 1 25 TYR C C -0.147 2.744 -0.611 1.00 . A A . 28 TYR C 1 1 8 3439 1 1 25 TYR CA C 1.289 3.137 -0.325 1.00 . A A . 28 TYR CA 1 1 8 3440 1 1 25 TYR CB C 1.330 4.306 0.684 1.00 . A A . 28 TYR CB 1 1 8 3441 1 1 25 TYR CD1 C 0.036 5.765 -0.980 1.00 . A A . 28 TYR CD1 1 1 8 3442 1 1 25 TYR CD2 C 0.676 6.711 1.112 1.00 . A A . 28 TYR CD2 1 1 8 3443 1 1 25 TYR CE1 C -0.564 6.958 -1.339 1.00 . A A . 28 TYR CE1 1 1 8 3444 1 1 25 TYR CE2 C 0.078 7.907 0.757 1.00 . A A . 28 TYR CE2 1 1 8 3445 1 1 25 TYR CG C 0.669 5.614 0.253 1.00 . A A . 28 TYR CG 1 1 8 3446 1 1 25 TYR CZ C -0.541 8.023 -0.467 1.00 . A A . 28 TYR CZ 1 1 8 3447 1 1 25 TYR H H 1.844 4.326 -1.982 1.00 . A A . 28 TYR H 1 1 8 3448 1 1 25 TYR HA H 1.788 2.287 0.117 1.00 . A A . 28 TYR HA 1 1 8 3449 1 1 25 TYR HB2 H 0.840 3.988 1.591 1.00 . A A . 28 TYR HB2 1 1 8 3450 1 1 25 TYR HB3 H 2.361 4.523 0.913 1.00 . A A . 28 TYR HB3 1 1 8 3451 1 1 25 TYR HD1 H 0.017 4.935 -1.665 1.00 . A A . 28 TYR HD1 1 1 8 3452 1 1 25 TYR HD2 H 1.165 6.622 2.071 1.00 . A A . 28 TYR HD2 1 1 8 3453 1 1 25 TYR HE1 H -1.048 7.050 -2.300 1.00 . A A . 28 TYR HE1 1 1 8 3454 1 1 25 TYR HE2 H 0.097 8.742 1.441 1.00 . A A . 28 TYR HE2 1 1 8 3455 1 1 25 TYR HH H -0.557 9.942 -0.594 1.00 . A A . 28 TYR HH 1 1 8 3456 1 1 25 TYR N N 1.997 3.461 -1.552 1.00 . A A . 28 TYR N 1 1 8 3457 1 1 25 TYR O O -0.691 3.044 -1.675 1.00 . A A . 28 TYR O 1 1 8 3458 1 1 25 TYR OH O -1.138 9.212 -0.822 1.00 . A A . 28 TYR OH 1 1 8 3459 1 1 26 TYR C C -3.010 2.456 1.106 1.00 . A A . 29 TYR C 1 1 8 3460 1 1 26 TYR CA C -2.112 1.601 0.233 1.00 . A A . 29 TYR CA 1 1 8 3461 1 1 26 TYR CB C -2.216 0.134 0.640 1.00 . A A . 29 TYR CB 1 1 8 3462 1 1 26 TYR CD1 C -0.105 -1.082 -0.015 1.00 . A A . 29 TYR CD1 1 1 8 3463 1 1 26 TYR CD2 C -2.030 -1.348 -1.396 1.00 . A A . 29 TYR CD2 1 1 8 3464 1 1 26 TYR CE1 C 0.616 -1.910 -0.853 1.00 . A A . 29 TYR CE1 1 1 8 3465 1 1 26 TYR CE2 C -1.317 -2.181 -2.237 1.00 . A A . 29 TYR CE2 1 1 8 3466 1 1 26 TYR CG C -1.438 -0.787 -0.272 1.00 . A A . 29 TYR CG 1 1 8 3467 1 1 26 TYR CZ C 0.006 -2.457 -1.962 1.00 . A A . 29 TYR CZ 1 1 8 3468 1 1 26 TYR H H -0.239 1.840 1.159 1.00 . A A . 29 TYR H 1 1 8 3469 1 1 26 TYR HA H -2.416 1.706 -0.798 1.00 . A A . 29 TYR HA 1 1 8 3470 1 1 26 TYR HB2 H -1.830 0.018 1.641 1.00 . A A . 29 TYR HB2 1 1 8 3471 1 1 26 TYR HB3 H -3.250 -0.166 0.621 1.00 . A A . 29 TYR HB3 1 1 8 3472 1 1 26 TYR HD1 H 0.370 -0.653 0.855 1.00 . A A . 29 TYR HD1 1 1 8 3473 1 1 26 TYR HD2 H -3.066 -1.128 -1.609 1.00 . A A . 29 TYR HD2 1 1 8 3474 1 1 26 TYR HE1 H 1.651 -2.129 -0.636 1.00 . A A . 29 TYR HE1 1 1 8 3475 1 1 26 TYR HE2 H -1.794 -2.609 -3.105 1.00 . A A . 29 TYR HE2 1 1 8 3476 1 1 26 TYR HH H 1.272 -3.867 -2.277 1.00 . A A . 29 TYR HH 1 1 8 3477 1 1 26 TYR N N -0.741 2.051 0.347 1.00 . A A . 29 TYR N 1 1 8 3478 1 1 26 TYR O O -2.944 2.389 2.331 1.00 . A A . 29 TYR O 1 1 8 3479 1 1 26 TYR OH O 0.721 -3.279 -2.800 1.00 . A A . 29 TYR OH 1 1 8 3480 1 1 27 TYR C C -6.165 3.583 1.175 1.00 . A A . 30 TYR C 1 1 8 3481 1 1 27 TYR CA C -4.749 4.136 1.188 1.00 . A A . 30 TYR CA 1 1 8 3482 1 1 27 TYR CB C -4.721 5.539 0.573 1.00 . A A . 30 TYR CB 1 1 8 3483 1 1 27 TYR CD1 C -5.944 6.895 2.324 1.00 . A A . 30 TYR CD1 1 1 8 3484 1 1 27 TYR CD2 C -6.857 6.813 0.123 1.00 . A A . 30 TYR CD2 1 1 8 3485 1 1 27 TYR CE1 C -6.986 7.709 2.729 1.00 . A A . 30 TYR CE1 1 1 8 3486 1 1 27 TYR CE2 C -7.900 7.628 0.520 1.00 . A A . 30 TYR CE2 1 1 8 3487 1 1 27 TYR CG C -5.862 6.433 1.016 1.00 . A A . 30 TYR CG 1 1 8 3488 1 1 27 TYR CZ C -7.959 8.073 1.824 1.00 . A A . 30 TYR CZ 1 1 8 3489 1 1 27 TYR H H -3.861 3.256 -0.510 1.00 . A A . 30 TYR H 1 1 8 3490 1 1 27 TYR HA H -4.409 4.194 2.210 1.00 . A A . 30 TYR HA 1 1 8 3491 1 1 27 TYR HB2 H -3.797 6.025 0.853 1.00 . A A . 30 TYR HB2 1 1 8 3492 1 1 27 TYR HB3 H -4.763 5.453 -0.503 1.00 . A A . 30 TYR HB3 1 1 8 3493 1 1 27 TYR HD1 H -5.181 6.609 3.031 1.00 . A A . 30 TYR HD1 1 1 8 3494 1 1 27 TYR HD2 H -6.807 6.462 -0.897 1.00 . A A . 30 TYR HD2 1 1 8 3495 1 1 27 TYR HE1 H -7.032 8.058 3.750 1.00 . A A . 30 TYR HE1 1 1 8 3496 1 1 27 TYR HE2 H -8.663 7.912 -0.189 1.00 . A A . 30 TYR HE2 1 1 8 3497 1 1 27 TYR HH H -8.647 9.623 2.731 1.00 . A A . 30 TYR HH 1 1 8 3498 1 1 27 TYR N N -3.848 3.257 0.468 1.00 . A A . 30 TYR N 1 1 8 3499 1 1 27 TYR O O -6.861 3.642 0.160 1.00 . A A . 30 TYR O 1 1 8 3500 1 1 27 TYR OH O -8.996 8.885 2.224 1.00 . A A . 30 TYR OH 1 1 8 3501 1 1 28 ASN C C -8.885 3.645 2.358 1.00 . A A . 31 ASN C 1 1 8 3502 1 1 28 ASN CA C -7.910 2.491 2.447 1.00 . A A . 31 ASN CA 1 1 8 3503 1 1 28 ASN CB C -8.053 1.757 3.787 1.00 . A A . 31 ASN CB 1 1 8 3504 1 1 28 ASN CG C -9.226 0.791 3.815 1.00 . A A . 31 ASN CG 1 1 8 3505 1 1 28 ASN H H -5.980 3.019 3.079 1.00 . A A . 31 ASN H 1 1 8 3506 1 1 28 ASN HA H -8.085 1.805 1.631 1.00 . A A . 31 ASN HA 1 1 8 3507 1 1 28 ASN HB2 H -7.150 1.196 3.977 1.00 . A A . 31 ASN HB2 1 1 8 3508 1 1 28 ASN HB3 H -8.190 2.483 4.577 1.00 . A A . 31 ASN HB3 1 1 8 3509 1 1 28 ASN HD21 H -10.174 1.842 2.424 1.00 . A A . 31 ASN HD21 1 1 8 3510 1 1 28 ASN HD22 H -11.004 0.442 2.997 1.00 . A A . 31 ASN HD22 1 1 8 3511 1 1 28 ASN N N -6.578 3.035 2.311 1.00 . A A . 31 ASN N 1 1 8 3512 1 1 28 ASN ND2 N -10.236 1.052 2.995 1.00 . A A . 31 ASN ND2 1 1 8 3513 1 1 28 ASN O O -9.018 4.409 3.306 1.00 . A A . 31 ASN O 1 1 8 3514 1 1 28 ASN OD1 O -9.218 -0.186 4.563 1.00 . A A . 31 ASN OD1 1 1 8 3515 1 1 29 THR C C -11.592 4.890 1.978 1.00 . A A . 32 THR C 1 1 8 3516 1 1 29 THR CA C -10.462 4.872 0.953 1.00 . A A . 32 THR CA 1 1 8 3517 1 1 29 THR CB C -11.066 4.763 -0.458 1.00 . A A . 32 THR CB 1 1 8 3518 1 1 29 THR CG2 C -11.595 6.108 -0.921 1.00 . A A . 32 THR CG2 1 1 8 3519 1 1 29 THR H H -9.328 3.158 0.470 1.00 . A A . 32 THR H 1 1 8 3520 1 1 29 THR HA H -9.922 5.806 1.014 1.00 . A A . 32 THR HA 1 1 8 3521 1 1 29 THR HB H -11.885 4.059 -0.433 1.00 . A A . 32 THR HB 1 1 8 3522 1 1 29 THR HG1 H -9.500 3.666 -0.944 1.00 . A A . 32 THR HG1 1 1 8 3523 1 1 29 THR HG21 H -10.782 6.818 -0.961 1.00 . A A . 32 THR HG21 1 1 8 3524 1 1 29 THR HG22 H -12.346 6.458 -0.229 1.00 . A A . 32 THR HG22 1 1 8 3525 1 1 29 THR HG23 H -12.030 6.005 -1.905 1.00 . A A . 32 THR HG23 1 1 8 3526 1 1 29 THR N N -9.514 3.792 1.195 1.00 . A A . 32 THR N 1 1 8 3527 1 1 29 THR O O -12.089 5.955 2.343 1.00 . A A . 32 THR O 1 1 8 3528 1 1 29 THR OG1 O -10.074 4.299 -1.381 1.00 . A A . 32 THR OG1 1 1 8 3529 1 1 30 GLU C C -12.569 3.858 4.826 1.00 . A A . 33 GLU C 1 1 8 3530 1 1 30 GLU CA C -13.071 3.602 3.411 1.00 . A A . 33 GLU CA 1 1 8 3531 1 1 30 GLU CB C -13.703 2.215 3.316 1.00 . A A . 33 GLU CB 1 1 8 3532 1 1 30 GLU CD C -15.837 2.843 4.518 1.00 . A A . 33 GLU CD 1 1 8 3533 1 1 30 GLU CG C -14.659 1.892 4.455 1.00 . A A . 33 GLU CG 1 1 8 3534 1 1 30 GLU H H -11.564 2.894 2.112 1.00 . A A . 33 GLU H 1 1 8 3535 1 1 30 GLU HA H -13.812 4.340 3.169 1.00 . A A . 33 GLU HA 1 1 8 3536 1 1 30 GLU HB2 H -14.251 2.146 2.388 1.00 . A A . 33 GLU HB2 1 1 8 3537 1 1 30 GLU HB3 H -12.914 1.479 3.312 1.00 . A A . 33 GLU HB3 1 1 8 3538 1 1 30 GLU HG2 H -15.033 0.889 4.320 1.00 . A A . 33 GLU HG2 1 1 8 3539 1 1 30 GLU HG3 H -14.118 1.949 5.389 1.00 . A A . 33 GLU HG3 1 1 8 3540 1 1 30 GLU N N -11.997 3.712 2.436 1.00 . A A . 33 GLU N 1 1 8 3541 1 1 30 GLU O O -12.946 4.839 5.465 1.00 . A A . 33 GLU O 1 1 8 3542 1 1 30 GLU OE1 O -16.855 2.572 3.846 1.00 . A A . 33 GLU OE1 1 1 8 3543 1 1 30 GLU OE2 O -15.741 3.860 5.236 1.00 . A A . 33 GLU OE2 1 1 8 3544 1 1 31 THR C C -10.288 4.317 6.798 1.00 . A A . 34 THR C 1 1 8 3545 1 1 31 THR CA C -11.158 3.070 6.644 1.00 . A A . 34 THR CA 1 1 8 3546 1 1 31 THR CB C -10.316 1.826 6.994 1.00 . A A . 34 THR CB 1 1 8 3547 1 1 31 THR CG2 C -9.724 1.940 8.393 1.00 . A A . 34 THR CG2 1 1 8 3548 1 1 31 THR H H -11.458 2.214 4.731 1.00 . A A . 34 THR H 1 1 8 3549 1 1 31 THR HA H -11.980 3.127 7.341 1.00 . A A . 34 THR HA 1 1 8 3550 1 1 31 THR HB H -9.506 1.747 6.283 1.00 . A A . 34 THR HB 1 1 8 3551 1 1 31 THR HG1 H -11.445 0.417 7.786 1.00 . A A . 34 THR HG1 1 1 8 3552 1 1 31 THR HG21 H -9.063 2.793 8.436 1.00 . A A . 34 THR HG21 1 1 8 3553 1 1 31 THR HG22 H -9.167 1.042 8.622 1.00 . A A . 34 THR HG22 1 1 8 3554 1 1 31 THR HG23 H -10.520 2.063 9.112 1.00 . A A . 34 THR HG23 1 1 8 3555 1 1 31 THR N N -11.717 2.966 5.301 1.00 . A A . 34 THR N 1 1 8 3556 1 1 31 THR O O -10.204 4.892 7.885 1.00 . A A . 34 THR O 1 1 8 3557 1 1 31 THR OG1 O -11.126 0.648 6.911 1.00 . A A . 34 THR OG1 1 1 8 3558 1 1 32 LYS C C -7.410 5.457 6.205 1.00 . A A . 35 LYS C 1 1 8 3559 1 1 32 LYS CA C -8.751 5.871 5.664 1.00 . A A . 35 LYS CA 1 1 8 3560 1 1 32 LYS CB C -9.319 7.061 6.446 1.00 . A A . 35 LYS CB 1 1 8 3561 1 1 32 LYS CD C -11.200 8.684 6.782 1.00 . A A . 35 LYS CD 1 1 8 3562 1 1 32 LYS CE C -12.587 9.114 6.333 1.00 . A A . 35 LYS CE 1 1 8 3563 1 1 32 LYS CG C -10.728 7.451 6.030 1.00 . A A . 35 LYS CG 1 1 8 3564 1 1 32 LYS H H -9.717 4.168 4.895 1.00 . A A . 35 LYS H 1 1 8 3565 1 1 32 LYS HA H -8.620 6.150 4.626 1.00 . A A . 35 LYS HA 1 1 8 3566 1 1 32 LYS HB2 H -9.333 6.814 7.496 1.00 . A A . 35 LYS HB2 1 1 8 3567 1 1 32 LYS HB3 H -8.676 7.916 6.296 1.00 . A A . 35 LYS HB3 1 1 8 3568 1 1 32 LYS HD2 H -11.227 8.460 7.838 1.00 . A A . 35 LYS HD2 1 1 8 3569 1 1 32 LYS HD3 H -10.504 9.490 6.600 1.00 . A A . 35 LYS HD3 1 1 8 3570 1 1 32 LYS HE2 H -12.559 9.331 5.276 1.00 . A A . 35 LYS HE2 1 1 8 3571 1 1 32 LYS HE3 H -13.278 8.304 6.516 1.00 . A A . 35 LYS HE3 1 1 8 3572 1 1 32 LYS HG2 H -10.736 7.662 4.971 1.00 . A A . 35 LYS HG2 1 1 8 3573 1 1 32 LYS HG3 H -11.397 6.631 6.244 1.00 . A A . 35 LYS HG3 1 1 8 3574 1 1 32 LYS HZ1 H -12.417 11.124 6.879 1.00 . A A . 35 LYS HZ1 1 1 8 3575 1 1 32 LYS HZ2 H -13.073 10.140 8.087 1.00 . A A . 35 LYS HZ2 1 1 8 3576 1 1 32 LYS HZ3 H -14.014 10.581 6.754 1.00 . A A . 35 LYS HZ3 1 1 8 3577 1 1 32 LYS N N -9.636 4.708 5.700 1.00 . A A . 35 LYS N 1 1 8 3578 1 1 32 LYS NZ N -13.056 10.325 7.065 1.00 . A A . 35 LYS NZ 1 1 8 3579 1 1 32 LYS O O -6.821 6.125 7.054 1.00 . A A . 35 LYS O 1 1 8 3580 1 1 33 GLN C C -4.627 3.835 5.017 1.00 . A A . 36 GLN C 1 1 8 3581 1 1 33 GLN CA C -5.667 3.785 6.121 1.00 . A A . 36 GLN CA 1 1 8 3582 1 1 33 GLN CB C -5.857 2.349 6.587 1.00 . A A . 36 GLN CB 1 1 8 3583 1 1 33 GLN CD C -4.163 2.509 8.441 1.00 . A A . 36 GLN CD 1 1 8 3584 1 1 33 GLN CG C -4.610 1.753 7.209 1.00 . A A . 36 GLN CG 1 1 8 3585 1 1 33 GLN H H -7.455 3.876 4.982 1.00 . A A . 36 GLN H 1 1 8 3586 1 1 33 GLN HA H -5.317 4.377 6.954 1.00 . A A . 36 GLN HA 1 1 8 3587 1 1 33 GLN HB2 H -6.645 2.329 7.318 1.00 . A A . 36 GLN HB2 1 1 8 3588 1 1 33 GLN HB3 H -6.141 1.739 5.742 1.00 . A A . 36 GLN HB3 1 1 8 3589 1 1 33 GLN HE21 H -2.280 2.375 7.846 1.00 . A A . 36 GLN HE21 1 1 8 3590 1 1 33 GLN HE22 H -2.532 3.197 9.343 1.00 . A A . 36 GLN HE22 1 1 8 3591 1 1 33 GLN HG2 H -4.814 0.730 7.487 1.00 . A A . 36 GLN HG2 1 1 8 3592 1 1 33 GLN HG3 H -3.813 1.777 6.479 1.00 . A A . 36 GLN HG3 1 1 8 3593 1 1 33 GLN N N -6.936 4.336 5.686 1.00 . A A . 36 GLN N 1 1 8 3594 1 1 33 GLN NE2 N -2.860 2.716 8.555 1.00 . A A . 36 GLN NE2 1 1 8 3595 1 1 33 GLN O O -4.608 2.997 4.120 1.00 . A A . 36 GLN O 1 1 8 3596 1 1 33 GLN OE1 O -4.979 2.930 9.261 1.00 . A A . 36 GLN OE1 1 1 8 3597 1 1 34 SER C C -1.329 4.492 4.691 1.00 . A A . 37 SER C 1 1 8 3598 1 1 34 SER CA C -2.672 4.978 4.144 1.00 . A A . 37 SER CA 1 1 8 3599 1 1 34 SER CB C -2.560 6.449 3.737 1.00 . A A . 37 SER CB 1 1 8 3600 1 1 34 SER H H -3.813 5.420 5.879 1.00 . A A . 37 SER H 1 1 8 3601 1 1 34 SER HA H -2.931 4.395 3.275 1.00 . A A . 37 SER HA 1 1 8 3602 1 1 34 SER HB2 H -1.762 6.561 3.019 1.00 . A A . 37 SER HB2 1 1 8 3603 1 1 34 SER HB3 H -3.490 6.769 3.293 1.00 . A A . 37 SER HB3 1 1 8 3604 1 1 34 SER HG H -1.345 7.225 5.063 1.00 . A A . 37 SER HG 1 1 8 3605 1 1 34 SER N N -3.738 4.802 5.125 1.00 . A A . 37 SER N 1 1 8 3606 1 1 34 SER O O -0.711 5.161 5.520 1.00 . A A . 37 SER O 1 1 8 3607 1 1 34 SER OG O -2.282 7.270 4.858 1.00 . A A . 37 SER OG 1 1 8 3608 1 1 35 THR C C 0.823 1.618 3.757 1.00 . A A . 38 THR C 1 1 8 3609 1 1 35 THR CA C 0.386 2.754 4.677 1.00 . A A . 38 THR CA 1 1 8 3610 1 1 35 THR CB C 0.277 2.223 6.118 1.00 . A A . 38 THR CB 1 1 8 3611 1 1 35 THR CG2 C -0.830 1.185 6.231 1.00 . A A . 38 THR CG2 1 1 8 3612 1 1 35 THR H H -1.419 2.831 3.568 1.00 . A A . 38 THR H 1 1 8 3613 1 1 35 THR HA H 1.134 3.534 4.655 1.00 . A A . 38 THR HA 1 1 8 3614 1 1 35 THR HB H 0.041 3.050 6.772 1.00 . A A . 38 THR HB 1 1 8 3615 1 1 35 THR HG1 H 1.403 1.179 7.357 1.00 . A A . 38 THR HG1 1 1 8 3616 1 1 35 THR HG21 H -1.774 1.634 5.955 1.00 . A A . 38 THR HG21 1 1 8 3617 1 1 35 THR HG22 H -0.886 0.825 7.248 1.00 . A A . 38 THR HG22 1 1 8 3618 1 1 35 THR HG23 H -0.619 0.359 5.568 1.00 . A A . 38 THR HG23 1 1 8 3619 1 1 35 THR N N -0.880 3.325 4.226 1.00 . A A . 38 THR N 1 1 8 3620 1 1 35 THR O O 0.037 1.151 2.933 1.00 . A A . 38 THR O 1 1 8 3621 1 1 35 THR OG1 O 1.522 1.646 6.527 1.00 . A A . 38 THR OG1 1 1 8 3622 1 1 36 TRP C C 2.493 -1.236 3.843 1.00 . A A . 39 TRP C 1 1 8 3623 1 1 36 TRP CA C 2.554 0.069 3.060 1.00 . A A . 39 TRP CA 1 1 8 3624 1 1 36 TRP CB C 4.002 0.280 2.586 1.00 . A A . 39 TRP CB 1 1 8 3625 1 1 36 TRP CD1 C 5.229 1.829 4.167 1.00 . A A . 39 TRP CD1 1 1 8 3626 1 1 36 TRP CD2 C 4.801 2.727 2.170 1.00 . A A . 39 TRP CD2 1 1 8 3627 1 1 36 TRP CE2 C 5.489 3.676 2.943 1.00 . A A . 39 TRP CE2 1 1 8 3628 1 1 36 TRP CE3 C 4.426 3.061 0.869 1.00 . A A . 39 TRP CE3 1 1 8 3629 1 1 36 TRP CG C 4.638 1.563 2.979 1.00 . A A . 39 TRP CG 1 1 8 3630 1 1 36 TRP CH2 C 5.433 5.238 1.177 1.00 . A A . 39 TRP CH2 1 1 8 3631 1 1 36 TRP CZ2 C 5.811 4.937 2.455 1.00 . A A . 39 TRP CZ2 1 1 8 3632 1 1 36 TRP CZ3 C 4.745 4.314 0.386 1.00 . A A . 39 TRP CZ3 1 1 8 3633 1 1 36 TRP H H 2.664 1.568 4.561 1.00 . A A . 39 TRP H 1 1 8 3634 1 1 36 TRP HA H 1.904 -0.005 2.199 1.00 . A A . 39 TRP HA 1 1 8 3635 1 1 36 TRP HB2 H 4.615 -0.501 3.006 1.00 . A A . 39 TRP HB2 1 1 8 3636 1 1 36 TRP HB3 H 4.033 0.214 1.509 1.00 . A A . 39 TRP HB3 1 1 8 3637 1 1 36 TRP HD1 H 5.274 1.126 4.982 1.00 . A A . 39 TRP HD1 1 1 8 3638 1 1 36 TRP HE1 H 6.216 3.534 4.906 1.00 . A A . 39 TRP HE1 1 1 8 3639 1 1 36 TRP HE3 H 3.894 2.359 0.244 1.00 . A A . 39 TRP HE3 1 1 8 3640 1 1 36 TRP HH2 H 5.662 6.208 0.759 1.00 . A A . 39 TRP HH2 1 1 8 3641 1 1 36 TRP HZ2 H 6.343 5.658 3.049 1.00 . A A . 39 TRP HZ2 1 1 8 3642 1 1 36 TRP HZ3 H 4.463 4.591 -0.619 1.00 . A A . 39 TRP HZ3 1 1 8 3643 1 1 36 TRP N N 2.070 1.164 3.895 1.00 . A A . 39 TRP N 1 1 8 3644 1 1 36 TRP NE1 N 5.745 3.105 4.162 1.00 . A A . 39 TRP NE1 1 1 8 3645 1 1 36 TRP O O 3.330 -1.497 4.706 1.00 . A A . 39 TRP O 1 1 8 3646 1 1 37 GLU C C 0.320 -4.194 3.421 1.00 . A A . 40 GLU C 1 1 8 3647 1 1 37 GLU CA C 1.305 -3.330 4.201 1.00 . A A . 40 GLU CA 1 1 8 3648 1 1 37 GLU CB C 0.802 -3.102 5.632 1.00 . A A . 40 GLU CB 1 1 8 3649 1 1 37 GLU CD C -1.174 -2.877 7.192 1.00 . A A . 40 GLU CD 1 1 8 3650 1 1 37 GLU CG C -0.712 -3.164 5.777 1.00 . A A . 40 GLU CG 1 1 8 3651 1 1 37 GLU H H 0.856 -1.788 2.833 1.00 . A A . 40 GLU H 1 1 8 3652 1 1 37 GLU HA H 2.261 -3.830 4.236 1.00 . A A . 40 GLU HA 1 1 8 3653 1 1 37 GLU HB2 H 1.234 -3.852 6.277 1.00 . A A . 40 GLU HB2 1 1 8 3654 1 1 37 GLU HB3 H 1.129 -2.124 5.961 1.00 . A A . 40 GLU HB3 1 1 8 3655 1 1 37 GLU HG2 H -1.154 -2.436 5.115 1.00 . A A . 40 GLU HG2 1 1 8 3656 1 1 37 GLU HG3 H -1.047 -4.153 5.499 1.00 . A A . 40 GLU HG3 1 1 8 3657 1 1 37 GLU N N 1.490 -2.052 3.532 1.00 . A A . 40 GLU N 1 1 8 3658 1 1 37 GLU O O -0.483 -3.681 2.642 1.00 . A A . 40 GLU O 1 1 8 3659 1 1 37 GLU OE1 O -1.131 -3.801 8.031 1.00 . A A . 40 GLU OE1 1 1 8 3660 1 1 37 GLU OE2 O -1.579 -1.726 7.462 1.00 . A A . 40 GLU OE2 1 1 8 3661 1 1 38 LYS C C -1.955 -6.143 3.316 1.00 . A A . 41 LYS C 1 1 8 3662 1 1 38 LYS CA C -0.495 -6.437 2.969 1.00 . A A . 41 LYS CA 1 1 8 3663 1 1 38 LYS CB C -0.134 -7.860 3.392 1.00 . A A . 41 LYS CB 1 1 8 3664 1 1 38 LYS CD C 0.612 -9.334 5.292 1.00 . A A . 41 LYS CD 1 1 8 3665 1 1 38 LYS CE C 1.307 -10.365 4.415 1.00 . A A . 41 LYS CE 1 1 8 3666 1 1 38 LYS CG C 0.670 -7.942 4.679 1.00 . A A . 41 LYS CG 1 1 8 3667 1 1 38 LYS H H 1.043 -5.854 4.261 1.00 . A A . 41 LYS H 1 1 8 3668 1 1 38 LYS HA H -0.351 -6.338 1.905 1.00 . A A . 41 LYS HA 1 1 8 3669 1 1 38 LYS HB2 H -1.040 -8.404 3.541 1.00 . A A . 41 LYS HB2 1 1 8 3670 1 1 38 LYS HB3 H 0.437 -8.323 2.605 1.00 . A A . 41 LYS HB3 1 1 8 3671 1 1 38 LYS HD2 H 1.099 -9.313 6.254 1.00 . A A . 41 LYS HD2 1 1 8 3672 1 1 38 LYS HD3 H -0.423 -9.619 5.416 1.00 . A A . 41 LYS HD3 1 1 8 3673 1 1 38 LYS HE2 H 0.827 -10.378 3.448 1.00 . A A . 41 LYS HE2 1 1 8 3674 1 1 38 LYS HE3 H 2.342 -10.082 4.299 1.00 . A A . 41 LYS HE3 1 1 8 3675 1 1 38 LYS HG2 H 1.699 -7.697 4.465 1.00 . A A . 41 LYS HG2 1 1 8 3676 1 1 38 LYS HG3 H 0.266 -7.230 5.384 1.00 . A A . 41 LYS HG3 1 1 8 3677 1 1 38 LYS HZ1 H 1.722 -12.413 4.387 1.00 . A A . 41 LYS HZ1 1 1 8 3678 1 1 38 LYS HZ2 H 0.249 -12.022 5.121 1.00 . A A . 41 LYS HZ2 1 1 8 3679 1 1 38 LYS HZ3 H 1.702 -11.738 5.938 1.00 . A A . 41 LYS HZ3 1 1 8 3680 1 1 38 LYS N N 0.387 -5.503 3.635 1.00 . A A . 41 LYS N 1 1 8 3681 1 1 38 LYS NZ N 1.241 -11.730 5.007 1.00 . A A . 41 LYS NZ 1 1 8 3682 1 1 38 LYS O O -2.392 -6.409 4.436 1.00 . A A . 41 LYS O 1 1 8 3683 1 1 39 PRO C C -5.059 -6.462 2.408 1.00 . A A . 42 PRO C 1 1 8 3684 1 1 39 PRO CA C -4.139 -5.260 2.593 1.00 . A A . 42 PRO CA 1 1 8 3685 1 1 39 PRO CB C -4.441 -4.185 1.535 1.00 . A A . 42 PRO CB 1 1 8 3686 1 1 39 PRO CD C -2.334 -5.242 1.000 1.00 . A A . 42 PRO CD 1 1 8 3687 1 1 39 PRO CG C -3.206 -4.055 0.694 1.00 . A A . 42 PRO CG 1 1 8 3688 1 1 39 PRO HA H -4.286 -4.844 3.580 1.00 . A A . 42 PRO HA 1 1 8 3689 1 1 39 PRO HB2 H -5.286 -4.497 0.941 1.00 . A A . 42 PRO HB2 1 1 8 3690 1 1 39 PRO HB3 H -4.675 -3.254 2.030 1.00 . A A . 42 PRO HB3 1 1 8 3691 1 1 39 PRO HD2 H -2.540 -6.051 0.315 1.00 . A A . 42 PRO HD2 1 1 8 3692 1 1 39 PRO HD3 H -1.291 -4.966 0.962 1.00 . A A . 42 PRO HD3 1 1 8 3693 1 1 39 PRO HG2 H -3.478 -4.053 -0.351 1.00 . A A . 42 PRO HG2 1 1 8 3694 1 1 39 PRO HG3 H -2.691 -3.139 0.944 1.00 . A A . 42 PRO HG3 1 1 8 3695 1 1 39 PRO N N -2.737 -5.590 2.364 1.00 . A A . 42 PRO N 1 1 8 3696 1 1 39 PRO O O -6.138 -6.346 1.825 1.00 . A A . 42 PRO O 1 1 9 3697 1 1 12 SER C C -10.303 -1.562 -3.201 1.00 . A A . 15 SER C 1 1 9 3698 1 1 12 SER CA C -10.003 -2.813 -4.015 1.00 . A A . 15 SER CA 1 1 9 3699 1 1 12 SER CB C -11.146 -3.815 -3.861 1.00 . A A . 15 SER CB 1 1 9 3700 1 1 12 SER H H -8.357 -3.126 -2.730 1.00 . A A . 15 SER H 1 1 9 3701 1 1 12 SER HA H -9.905 -2.543 -5.056 1.00 . A A . 15 SER HA 1 1 9 3702 1 1 12 SER HB2 H -11.109 -4.241 -2.870 1.00 . A A . 15 SER HB2 1 1 9 3703 1 1 12 SER HB3 H -12.090 -3.307 -4.000 1.00 . A A . 15 SER HB3 1 1 9 3704 1 1 12 SER HG H -11.541 -5.624 -4.500 1.00 . A A . 15 SER HG 1 1 9 3705 1 1 12 SER N N -8.747 -3.413 -3.581 1.00 . A A . 15 SER N 1 1 9 3706 1 1 12 SER O O -10.321 -0.450 -3.732 1.00 . A A . 15 SER O 1 1 9 3707 1 1 12 SER OG O -11.044 -4.863 -4.810 1.00 . A A . 15 SER OG 1 1 9 3708 1 1 13 MET C C -9.589 0.189 -0.756 1.00 . A A . 16 MET C 1 1 9 3709 1 1 13 MET CA C -10.837 -0.650 -1.008 1.00 . A A . 16 MET CA 1 1 9 3710 1 1 13 MET CB C -11.373 -1.180 0.323 1.00 . A A . 16 MET CB 1 1 9 3711 1 1 13 MET CE C -13.069 -1.429 2.936 1.00 . A A . 16 MET CE 1 1 9 3712 1 1 13 MET CG C -12.726 -1.864 0.215 1.00 . A A . 16 MET CG 1 1 9 3713 1 1 13 MET H H -10.518 -2.668 -1.552 1.00 . A A . 16 MET H 1 1 9 3714 1 1 13 MET HA H -11.589 -0.031 -1.473 1.00 . A A . 16 MET HA 1 1 9 3715 1 1 13 MET HB2 H -10.667 -1.891 0.723 1.00 . A A . 16 MET HB2 1 1 9 3716 1 1 13 MET HB3 H -11.468 -0.354 1.012 1.00 . A A . 16 MET HB3 1 1 9 3717 1 1 13 MET HE1 H -13.746 -0.633 2.665 1.00 . A A . 16 MET HE1 1 1 9 3718 1 1 13 MET HE2 H -12.059 -1.047 2.964 1.00 . A A . 16 MET HE2 1 1 9 3719 1 1 13 MET HE3 H -13.335 -1.813 3.909 1.00 . A A . 16 MET HE3 1 1 9 3720 1 1 13 MET HG2 H -13.477 -1.116 0.013 1.00 . A A . 16 MET HG2 1 1 9 3721 1 1 13 MET HG3 H -12.694 -2.571 -0.601 1.00 . A A . 16 MET HG3 1 1 9 3722 1 1 13 MET N N -10.541 -1.756 -1.908 1.00 . A A . 16 MET N 1 1 9 3723 1 1 13 MET O O -9.674 1.303 -0.241 1.00 . A A . 16 MET O 1 1 9 3724 1 1 13 MET SD S -13.179 -2.744 1.723 1.00 . A A . 16 MET SD 1 1 9 3725 1 1 14 TRP C C -6.634 0.908 -2.233 1.00 . A A . 17 TRP C 1 1 9 3726 1 1 14 TRP CA C -7.168 0.346 -0.927 1.00 . A A . 17 TRP CA 1 1 9 3727 1 1 14 TRP CB C -6.125 -0.589 -0.312 1.00 . A A . 17 TRP CB 1 1 9 3728 1 1 14 TRP CD1 C -7.576 -2.111 1.144 1.00 . A A . 17 TRP CD1 1 1 9 3729 1 1 14 TRP CD2 C -6.004 -0.975 2.253 1.00 . A A . 17 TRP CD2 1 1 9 3730 1 1 14 TRP CE2 C -6.723 -1.757 3.173 1.00 . A A . 17 TRP CE2 1 1 9 3731 1 1 14 TRP CE3 C -4.962 -0.174 2.711 1.00 . A A . 17 TRP CE3 1 1 9 3732 1 1 14 TRP CG C -6.567 -1.211 0.967 1.00 . A A . 17 TRP CG 1 1 9 3733 1 1 14 TRP CH2 C -5.400 -0.963 4.958 1.00 . A A . 17 TRP CH2 1 1 9 3734 1 1 14 TRP CZ2 C -6.429 -1.758 4.533 1.00 . A A . 17 TRP CZ2 1 1 9 3735 1 1 14 TRP CZ3 C -4.668 -0.176 4.058 1.00 . A A . 17 TRP CZ3 1 1 9 3736 1 1 14 TRP H H -8.429 -1.240 -1.540 1.00 . A A . 17 TRP H 1 1 9 3737 1 1 14 TRP HA H -7.347 1.164 -0.245 1.00 . A A . 17 TRP HA 1 1 9 3738 1 1 14 TRP HB2 H -5.899 -1.380 -1.007 1.00 . A A . 17 TRP HB2 1 1 9 3739 1 1 14 TRP HB3 H -5.223 -0.024 -0.111 1.00 . A A . 17 TRP HB3 1 1 9 3740 1 1 14 TRP HD1 H -8.198 -2.494 0.348 1.00 . A A . 17 TRP HD1 1 1 9 3741 1 1 14 TRP HE1 H -8.327 -3.070 2.851 1.00 . A A . 17 TRP HE1 1 1 9 3742 1 1 14 TRP HE3 H -4.387 0.437 2.029 1.00 . A A . 17 TRP HE3 1 1 9 3743 1 1 14 TRP HH2 H -5.135 -0.932 6.004 1.00 . A A . 17 TRP HH2 1 1 9 3744 1 1 14 TRP HZ2 H -6.988 -2.356 5.235 1.00 . A A . 17 TRP HZ2 1 1 9 3745 1 1 14 TRP HZ3 H -3.864 0.439 4.429 1.00 . A A . 17 TRP HZ3 1 1 9 3746 1 1 14 TRP N N -8.432 -0.352 -1.125 1.00 . A A . 17 TRP N 1 1 9 3747 1 1 14 TRP NE1 N -7.679 -2.443 2.471 1.00 . A A . 17 TRP NE1 1 1 9 3748 1 1 14 TRP O O -6.573 0.212 -3.246 1.00 . A A . 17 TRP O 1 1 9 3749 1 1 15 THR C C -4.192 3.028 -3.193 1.00 . A A . 18 THR C 1 1 9 3750 1 1 15 THR CA C -5.697 2.836 -3.364 1.00 . A A . 18 THR CA 1 1 9 3751 1 1 15 THR CB C -6.359 4.205 -3.591 1.00 . A A . 18 THR CB 1 1 9 3752 1 1 15 THR CG2 C -7.816 4.042 -3.996 1.00 . A A . 18 THR CG2 1 1 9 3753 1 1 15 THR H H -6.341 2.682 -1.368 1.00 . A A . 18 THR H 1 1 9 3754 1 1 15 THR HA H -5.888 2.210 -4.222 1.00 . A A . 18 THR HA 1 1 9 3755 1 1 15 THR HB H -5.834 4.711 -4.385 1.00 . A A . 18 THR HB 1 1 9 3756 1 1 15 THR HG1 H -5.947 4.451 -1.678 1.00 . A A . 18 THR HG1 1 1 9 3757 1 1 15 THR HG21 H -8.347 3.508 -3.222 1.00 . A A . 18 THR HG21 1 1 9 3758 1 1 15 THR HG22 H -7.873 3.486 -4.920 1.00 . A A . 18 THR HG22 1 1 9 3759 1 1 15 THR HG23 H -8.263 5.015 -4.133 1.00 . A A . 18 THR HG23 1 1 9 3760 1 1 15 THR N N -6.247 2.175 -2.199 1.00 . A A . 18 THR N 1 1 9 3761 1 1 15 THR O O -3.755 3.769 -2.314 1.00 . A A . 18 THR O 1 1 9 3762 1 1 15 THR OG1 O -6.274 4.995 -2.398 1.00 . A A . 18 THR OG1 1 1 9 3763 1 1 16 GLU C C -1.362 3.446 -4.960 1.00 . A A . 19 GLU C 1 1 9 3764 1 1 16 GLU CA C -1.953 2.477 -3.938 1.00 . A A . 19 GLU CA 1 1 9 3765 1 1 16 GLU CB C -1.320 1.093 -4.100 1.00 . A A . 19 GLU CB 1 1 9 3766 1 1 16 GLU CD C -2.667 0.474 -6.152 1.00 . A A . 19 GLU CD 1 1 9 3767 1 1 16 GLU CG C -1.287 0.579 -5.532 1.00 . A A . 19 GLU CG 1 1 9 3768 1 1 16 GLU H H -3.793 1.795 -4.713 1.00 . A A . 19 GLU H 1 1 9 3769 1 1 16 GLU HA H -1.727 2.842 -2.954 1.00 . A A . 19 GLU HA 1 1 9 3770 1 1 16 GLU HB2 H -0.308 1.134 -3.735 1.00 . A A . 19 GLU HB2 1 1 9 3771 1 1 16 GLU HB3 H -1.878 0.387 -3.502 1.00 . A A . 19 GLU HB3 1 1 9 3772 1 1 16 GLU HG2 H -0.692 1.253 -6.129 1.00 . A A . 19 GLU HG2 1 1 9 3773 1 1 16 GLU HG3 H -0.831 -0.401 -5.537 1.00 . A A . 19 GLU HG3 1 1 9 3774 1 1 16 GLU N N -3.400 2.378 -4.040 1.00 . A A . 19 GLU N 1 1 9 3775 1 1 16 GLU O O -1.685 3.400 -6.148 1.00 . A A . 19 GLU O 1 1 9 3776 1 1 16 GLU OE1 O -3.440 -0.415 -5.735 1.00 . A A . 19 GLU OE1 1 1 9 3777 1 1 16 GLU OE2 O -2.975 1.278 -7.056 1.00 . A A . 19 GLU OE2 1 1 9 3778 1 1 17 HIS C C 1.567 5.641 -4.792 1.00 . A A . 20 HIS C 1 1 9 3779 1 1 17 HIS CA C 0.162 5.332 -5.312 1.00 . A A . 20 HIS CA 1 1 9 3780 1 1 17 HIS CB C -0.646 6.631 -5.342 1.00 . A A . 20 HIS CB 1 1 9 3781 1 1 17 HIS CD2 C -3.172 6.239 -4.889 1.00 . A A . 20 HIS CD2 1 1 9 3782 1 1 17 HIS CE1 C -3.882 6.287 -6.963 1.00 . A A . 20 HIS CE1 1 1 9 3783 1 1 17 HIS CG C -2.093 6.447 -5.684 1.00 . A A . 20 HIS CG 1 1 9 3784 1 1 17 HIS H H -0.299 4.321 -3.505 1.00 . A A . 20 HIS H 1 1 9 3785 1 1 17 HIS HA H 0.235 4.935 -6.312 1.00 . A A . 20 HIS HA 1 1 9 3786 1 1 17 HIS HB2 H -0.596 7.097 -4.369 1.00 . A A . 20 HIS HB2 1 1 9 3787 1 1 17 HIS HB3 H -0.210 7.294 -6.074 1.00 . A A . 20 HIS HB3 1 1 9 3788 1 1 17 HIS HD1 H -2.034 6.606 -7.785 1.00 . A A . 20 HIS HD1 1 1 9 3789 1 1 17 HIS HD2 H -3.169 6.165 -3.809 1.00 . A A . 20 HIS HD2 1 1 9 3790 1 1 17 HIS HE1 H -4.526 6.258 -7.830 1.00 . A A . 20 HIS HE1 1 1 9 3791 1 1 17 HIS HE2 H -5.202 6.104 -5.408 1.00 . A A . 20 HIS HE2 1 1 9 3792 1 1 17 HIS N N -0.498 4.336 -4.468 1.00 . A A . 20 HIS N 1 1 9 3793 1 1 17 HIS ND1 N -2.573 6.471 -6.977 1.00 . A A . 20 HIS ND1 1 1 9 3794 1 1 17 HIS NE2 N -4.269 6.144 -5.708 1.00 . A A . 20 HIS NE2 1 1 9 3795 1 1 17 HIS O O 1.797 5.646 -3.581 1.00 . A A . 20 HIS O 1 1 9 3796 1 1 18 LYS C C 3.927 7.301 -4.280 1.00 . A A . 21 LYS C 1 1 9 3797 1 1 18 LYS CA C 3.877 6.217 -5.344 1.00 . A A . 21 LYS CA 1 1 9 3798 1 1 18 LYS CB C 4.663 6.657 -6.575 1.00 . A A . 21 LYS CB 1 1 9 3799 1 1 18 LYS CD C 4.490 5.868 -8.948 1.00 . A A . 21 LYS CD 1 1 9 3800 1 1 18 LYS CE C 4.664 4.684 -9.885 1.00 . A A . 21 LYS CE 1 1 9 3801 1 1 18 LYS CG C 4.907 5.516 -7.532 1.00 . A A . 21 LYS CG 1 1 9 3802 1 1 18 LYS H H 2.281 5.806 -6.664 1.00 . A A . 21 LYS H 1 1 9 3803 1 1 18 LYS HA H 4.327 5.325 -4.946 1.00 . A A . 21 LYS HA 1 1 9 3804 1 1 18 LYS HB2 H 4.109 7.428 -7.091 1.00 . A A . 21 LYS HB2 1 1 9 3805 1 1 18 LYS HB3 H 5.617 7.051 -6.262 1.00 . A A . 21 LYS HB3 1 1 9 3806 1 1 18 LYS HD2 H 3.452 6.163 -8.946 1.00 . A A . 21 LYS HD2 1 1 9 3807 1 1 18 LYS HD3 H 5.100 6.687 -9.301 1.00 . A A . 21 LYS HD3 1 1 9 3808 1 1 18 LYS HE2 H 5.705 4.398 -9.893 1.00 . A A . 21 LYS HE2 1 1 9 3809 1 1 18 LYS HE3 H 4.068 3.862 -9.518 1.00 . A A . 21 LYS HE3 1 1 9 3810 1 1 18 LYS HG2 H 5.957 5.267 -7.523 1.00 . A A . 21 LYS HG2 1 1 9 3811 1 1 18 LYS HG3 H 4.330 4.672 -7.192 1.00 . A A . 21 LYS HG3 1 1 9 3812 1 1 18 LYS HZ1 H 4.823 5.781 -11.653 1.00 . A A . 21 LYS HZ1 1 1 9 3813 1 1 18 LYS HZ2 H 3.244 5.302 -11.284 1.00 . A A . 21 LYS HZ2 1 1 9 3814 1 1 18 LYS HZ3 H 4.351 4.173 -11.884 1.00 . A A . 21 LYS HZ3 1 1 9 3815 1 1 18 LYS N N 2.506 5.885 -5.713 1.00 . A A . 21 LYS N 1 1 9 3816 1 1 18 LYS NZ N 4.241 5.008 -11.274 1.00 . A A . 21 LYS NZ 1 1 9 3817 1 1 18 LYS O O 3.002 8.103 -4.142 1.00 . A A . 21 LYS O 1 1 9 3818 1 1 19 SER C C 6.634 8.169 -1.894 1.00 . A A . 22 SER C 1 1 9 3819 1 1 19 SER CA C 5.215 8.276 -2.461 1.00 . A A . 22 SER CA 1 1 9 3820 1 1 19 SER CB C 4.178 7.992 -1.377 1.00 . A A . 22 SER CB 1 1 9 3821 1 1 19 SER H H 5.728 6.657 -3.717 1.00 . A A . 22 SER H 1 1 9 3822 1 1 19 SER HA H 5.059 9.269 -2.856 1.00 . A A . 22 SER HA 1 1 9 3823 1 1 19 SER HB2 H 4.605 8.197 -0.406 1.00 . A A . 22 SER HB2 1 1 9 3824 1 1 19 SER HB3 H 3.313 8.618 -1.532 1.00 . A A . 22 SER HB3 1 1 9 3825 1 1 19 SER HG H 3.242 6.487 -2.206 1.00 . A A . 22 SER HG 1 1 9 3826 1 1 19 SER N N 5.026 7.317 -3.538 1.00 . A A . 22 SER N 1 1 9 3827 1 1 19 SER O O 7.392 7.290 -2.316 1.00 . A A . 22 SER O 1 1 9 3828 1 1 19 SER OG O 3.776 6.636 -1.422 1.00 . A A . 22 SER OG 1 1 9 3829 1 1 20 PRO C C 8.903 7.646 -0.143 1.00 . A A . 23 PRO C 1 1 9 3830 1 1 20 PRO CA C 8.348 9.054 -0.325 1.00 . A A . 23 PRO CA 1 1 9 3831 1 1 20 PRO CB C 8.110 9.720 1.040 1.00 . A A . 23 PRO CB 1 1 9 3832 1 1 20 PRO CD C 6.233 10.175 -0.411 1.00 . A A . 23 PRO CD 1 1 9 3833 1 1 20 PRO CG C 6.700 10.238 1.018 1.00 . A A . 23 PRO CG 1 1 9 3834 1 1 20 PRO HA H 9.053 9.642 -0.893 1.00 . A A . 23 PRO HA 1 1 9 3835 1 1 20 PRO HB2 H 8.243 8.988 1.824 1.00 . A A . 23 PRO HB2 1 1 9 3836 1 1 20 PRO HB3 H 8.818 10.524 1.175 1.00 . A A . 23 PRO HB3 1 1 9 3837 1 1 20 PRO HD2 H 5.176 9.963 -0.456 1.00 . A A . 23 PRO HD2 1 1 9 3838 1 1 20 PRO HD3 H 6.459 11.096 -0.925 1.00 . A A . 23 PRO HD3 1 1 9 3839 1 1 20 PRO HG2 H 6.074 9.616 1.641 1.00 . A A . 23 PRO HG2 1 1 9 3840 1 1 20 PRO HG3 H 6.681 11.258 1.372 1.00 . A A . 23 PRO HG3 1 1 9 3841 1 1 20 PRO N N 7.024 9.065 -0.948 1.00 . A A . 23 PRO N 1 1 9 3842 1 1 20 PRO O O 8.147 6.675 -0.076 1.00 . A A . 23 PRO O 1 1 9 3843 1 1 21 ASP C C 10.920 5.525 -1.238 1.00 . A A . 24 ASP C 1 1 9 3844 1 1 21 ASP CA C 10.912 6.268 0.096 1.00 . A A . 24 ASP CA 1 1 9 3845 1 1 21 ASP CB C 10.255 5.413 1.189 1.00 . A A . 24 ASP CB 1 1 9 3846 1 1 21 ASP CG C 10.181 6.136 2.519 1.00 . A A . 24 ASP CG 1 1 9 3847 1 1 21 ASP H H 10.764 8.370 -0.091 1.00 . A A . 24 ASP H 1 1 9 3848 1 1 21 ASP HA H 11.935 6.475 0.379 1.00 . A A . 24 ASP HA 1 1 9 3849 1 1 21 ASP HB2 H 9.253 5.158 0.883 1.00 . A A . 24 ASP HB2 1 1 9 3850 1 1 21 ASP HB3 H 10.825 4.507 1.325 1.00 . A A . 24 ASP HB3 1 1 9 3851 1 1 21 ASP N N 10.229 7.550 -0.054 1.00 . A A . 24 ASP N 1 1 9 3852 1 1 21 ASP O O 11.489 4.441 -1.358 1.00 . A A . 24 ASP O 1 1 9 3853 1 1 21 ASP OD1 O 11.149 6.039 3.302 1.00 . A A . 24 ASP OD1 1 1 9 3854 1 1 21 ASP OD2 O 9.155 6.799 2.779 1.00 . A A . 24 ASP OD2 1 1 9 3855 1 1 22 GLY C C 9.410 4.277 -3.579 1.00 . A A . 25 GLY C 1 1 9 3856 1 1 22 GLY CA C 10.212 5.547 -3.563 1.00 . A A . 25 GLY CA 1 1 9 3857 1 1 22 GLY H H 9.827 6.980 -2.068 1.00 . A A . 25 GLY H 1 1 9 3858 1 1 22 GLY HA2 H 9.744 6.254 -4.241 1.00 . A A . 25 GLY HA2 1 1 9 3859 1 1 22 GLY HA3 H 11.211 5.341 -3.902 1.00 . A A . 25 GLY HA3 1 1 9 3860 1 1 22 GLY N N 10.277 6.133 -2.238 1.00 . A A . 25 GLY N 1 1 9 3861 1 1 22 GLY O O 9.852 3.249 -4.091 1.00 . A A . 25 GLY O 1 1 9 3862 1 1 23 ARG C C 5.885 3.701 -2.947 1.00 . A A . 26 ARG C 1 1 9 3863 1 1 23 ARG CA C 7.323 3.224 -2.950 1.00 . A A . 26 ARG CA 1 1 9 3864 1 1 23 ARG CB C 7.615 2.380 -1.711 1.00 . A A . 26 ARG CB 1 1 9 3865 1 1 23 ARG CD C 8.479 2.306 0.640 1.00 . A A . 26 ARG CD 1 1 9 3866 1 1 23 ARG CG C 7.974 3.194 -0.484 1.00 . A A . 26 ARG CG 1 1 9 3867 1 1 23 ARG CZ C 10.125 0.498 0.928 1.00 . A A . 26 ARG CZ 1 1 9 3868 1 1 23 ARG H H 7.930 5.217 -2.631 1.00 . A A . 26 ARG H 1 1 9 3869 1 1 23 ARG HA H 7.487 2.623 -3.833 1.00 . A A . 26 ARG HA 1 1 9 3870 1 1 23 ARG HB2 H 6.741 1.794 -1.480 1.00 . A A . 26 ARG HB2 1 1 9 3871 1 1 23 ARG HB3 H 8.437 1.714 -1.928 1.00 . A A . 26 ARG HB3 1 1 9 3872 1 1 23 ARG HD2 H 8.735 2.928 1.481 1.00 . A A . 26 ARG HD2 1 1 9 3873 1 1 23 ARG HD3 H 7.692 1.623 0.923 1.00 . A A . 26 ARG HD3 1 1 9 3874 1 1 23 ARG HE H 10.120 1.809 -0.577 1.00 . A A . 26 ARG HE 1 1 9 3875 1 1 23 ARG HG2 H 8.741 3.902 -0.747 1.00 . A A . 26 ARG HG2 1 1 9 3876 1 1 23 ARG HG3 H 7.098 3.722 -0.145 1.00 . A A . 26 ARG HG3 1 1 9 3877 1 1 23 ARG HH11 H 8.708 0.587 2.367 1.00 . A A . 26 ARG HH11 1 1 9 3878 1 1 23 ARG HH12 H 9.876 -0.678 2.552 1.00 . A A . 26 ARG HH12 1 1 9 3879 1 1 23 ARG HH21 H 11.658 0.143 -0.341 1.00 . A A . 26 ARG HH21 1 1 9 3880 1 1 23 ARG HH22 H 11.552 -0.931 1.015 1.00 . A A . 26 ARG HH22 1 1 9 3881 1 1 23 ARG N N 8.218 4.360 -3.015 1.00 . A A . 26 ARG N 1 1 9 3882 1 1 23 ARG NE N 9.656 1.538 0.242 1.00 . A A . 26 ARG NE 1 1 9 3883 1 1 23 ARG NH1 N 9.520 0.104 2.040 1.00 . A A . 26 ARG NH1 1 1 9 3884 1 1 23 ARG NH2 N 11.200 -0.150 0.498 1.00 . A A . 26 ARG NH2 1 1 9 3885 1 1 23 ARG O O 5.614 4.882 -2.736 1.00 . A A . 26 ARG O 1 1 9 3886 1 1 24 THR C C 2.829 2.676 -1.966 1.00 . A A . 27 THR C 1 1 9 3887 1 1 24 THR CA C 3.555 3.130 -3.225 1.00 . A A . 27 THR CA 1 1 9 3888 1 1 24 THR CB C 2.864 2.504 -4.451 1.00 . A A . 27 THR CB 1 1 9 3889 1 1 24 THR CG2 C 3.196 1.024 -4.566 1.00 . A A . 27 THR CG2 1 1 9 3890 1 1 24 THR H H 5.238 1.854 -3.325 1.00 . A A . 27 THR H 1 1 9 3891 1 1 24 THR HA H 3.484 4.205 -3.304 1.00 . A A . 27 THR HA 1 1 9 3892 1 1 24 THR HB H 3.217 3.007 -5.340 1.00 . A A . 27 THR HB 1 1 9 3893 1 1 24 THR HG1 H 1.007 1.962 -4.829 1.00 . A A . 27 THR HG1 1 1 9 3894 1 1 24 THR HG21 H 4.252 0.905 -4.750 1.00 . A A . 27 THR HG21 1 1 9 3895 1 1 24 THR HG22 H 2.636 0.592 -5.382 1.00 . A A . 27 THR HG22 1 1 9 3896 1 1 24 THR HG23 H 2.932 0.524 -3.646 1.00 . A A . 27 THR HG23 1 1 9 3897 1 1 24 THR N N 4.964 2.784 -3.183 1.00 . A A . 27 THR N 1 1 9 3898 1 1 24 THR O O 2.989 1.538 -1.523 1.00 . A A . 27 THR O 1 1 9 3899 1 1 24 THR OG1 O 1.447 2.671 -4.353 1.00 . A A . 27 THR OG1 1 1 9 3900 1 1 25 TYR C C -0.177 2.985 -0.552 1.00 . A A . 28 TYR C 1 1 9 3901 1 1 25 TYR CA C 1.269 3.241 -0.191 1.00 . A A . 28 TYR CA 1 1 9 3902 1 1 25 TYR CB C 1.354 4.360 0.865 1.00 . A A . 28 TYR CB 1 1 9 3903 1 1 25 TYR CD1 C -0.706 5.773 0.403 1.00 . A A . 28 TYR CD1 1 1 9 3904 1 1 25 TYR CD2 C 1.433 6.798 0.204 1.00 . A A . 28 TYR CD2 1 1 9 3905 1 1 25 TYR CE1 C -1.313 6.967 0.060 1.00 . A A . 28 TYR CE1 1 1 9 3906 1 1 25 TYR CE2 C 0.834 7.994 -0.138 1.00 . A A . 28 TYR CE2 1 1 9 3907 1 1 25 TYR CG C 0.680 5.667 0.481 1.00 . A A . 28 TYR CG 1 1 9 3908 1 1 25 TYR CZ C -0.539 8.073 -0.210 1.00 . A A . 28 TYR CZ 1 1 9 3909 1 1 25 TYR H H 1.937 4.464 -1.791 1.00 . A A . 28 TYR H 1 1 9 3910 1 1 25 TYR HA H 1.688 2.336 0.223 1.00 . A A . 28 TYR HA 1 1 9 3911 1 1 25 TYR HB2 H 0.889 4.013 1.775 1.00 . A A . 28 TYR HB2 1 1 9 3912 1 1 25 TYR HB3 H 2.393 4.573 1.064 1.00 . A A . 28 TYR HB3 1 1 9 3913 1 1 25 TYR HD1 H -1.312 4.905 0.617 1.00 . A A . 28 TYR HD1 1 1 9 3914 1 1 25 TYR HD2 H 2.509 6.733 0.261 1.00 . A A . 28 TYR HD2 1 1 9 3915 1 1 25 TYR HE1 H -2.391 7.027 0.004 1.00 . A A . 28 TYR HE1 1 1 9 3916 1 1 25 TYR HE2 H 1.441 8.862 -0.348 1.00 . A A . 28 TYR HE2 1 1 9 3917 1 1 25 TYR HH H -0.692 9.643 -1.310 1.00 . A A . 28 TYR HH 1 1 9 3918 1 1 25 TYR N N 2.025 3.570 -1.394 1.00 . A A . 28 TYR N 1 1 9 3919 1 1 25 TYR O O -0.688 3.554 -1.514 1.00 . A A . 28 TYR O 1 1 9 3920 1 1 25 TYR OH O -1.141 9.263 -0.551 1.00 . A A . 28 TYR OH 1 1 9 3921 1 1 26 TYR C C -3.100 2.558 0.979 1.00 . A A . 29 TYR C 1 1 9 3922 1 1 26 TYR CA C -2.226 1.818 -0.017 1.00 . A A . 29 TYR CA 1 1 9 3923 1 1 26 TYR CB C -2.474 0.312 0.089 1.00 . A A . 29 TYR CB 1 1 9 3924 1 1 26 TYR CD1 C -0.262 -0.788 0.631 1.00 . A A . 29 TYR CD1 1 1 9 3925 1 1 26 TYR CD2 C -1.181 -1.122 -1.543 1.00 . A A . 29 TYR CD2 1 1 9 3926 1 1 26 TYR CE1 C 0.824 -1.574 0.296 1.00 . A A . 29 TYR CE1 1 1 9 3927 1 1 26 TYR CE2 C -0.098 -1.910 -1.884 1.00 . A A . 29 TYR CE2 1 1 9 3928 1 1 26 TYR CG C -1.282 -0.547 -0.283 1.00 . A A . 29 TYR CG 1 1 9 3929 1 1 26 TYR CZ C 0.901 -2.133 -0.961 1.00 . A A . 29 TYR CZ 1 1 9 3930 1 1 26 TYR H H -0.375 1.735 0.990 1.00 . A A . 29 TYR H 1 1 9 3931 1 1 26 TYR HA H -2.474 2.151 -1.015 1.00 . A A . 29 TYR HA 1 1 9 3932 1 1 26 TYR HB2 H -2.748 0.074 1.098 1.00 . A A . 29 TYR HB2 1 1 9 3933 1 1 26 TYR HB3 H -3.290 0.045 -0.565 1.00 . A A . 29 TYR HB3 1 1 9 3934 1 1 26 TYR HD1 H -0.327 -0.350 1.615 1.00 . A A . 29 TYR HD1 1 1 9 3935 1 1 26 TYR HD2 H -1.964 -0.945 -2.264 1.00 . A A . 29 TYR HD2 1 1 9 3936 1 1 26 TYR HE1 H 1.606 -1.749 1.020 1.00 . A A . 29 TYR HE1 1 1 9 3937 1 1 26 TYR HE2 H -0.039 -2.348 -2.869 1.00 . A A . 29 TYR HE2 1 1 9 3938 1 1 26 TYR HH H 2.302 -2.665 -2.165 1.00 . A A . 29 TYR HH 1 1 9 3939 1 1 26 TYR N N -0.833 2.141 0.228 1.00 . A A . 29 TYR N 1 1 9 3940 1 1 26 TYR O O -2.979 2.372 2.194 1.00 . A A . 29 TYR O 1 1 9 3941 1 1 26 TYR OH O 1.980 -2.918 -1.296 1.00 . A A . 29 TYR OH 1 1 9 3942 1 1 27 TYR C C -6.274 3.648 1.192 1.00 . A A . 30 TYR C 1 1 9 3943 1 1 27 TYR CA C -4.858 4.200 1.278 1.00 . A A . 30 TYR CA 1 1 9 3944 1 1 27 TYR CB C -4.820 5.667 0.840 1.00 . A A . 30 TYR CB 1 1 9 3945 1 1 27 TYR CD1 C -6.252 6.733 2.630 1.00 . A A . 30 TYR CD1 1 1 9 3946 1 1 27 TYR CD2 C -6.921 6.986 0.355 1.00 . A A . 30 TYR CD2 1 1 9 3947 1 1 27 TYR CE1 C -7.347 7.472 3.037 1.00 . A A . 30 TYR CE1 1 1 9 3948 1 1 27 TYR CE2 C -8.017 7.725 0.755 1.00 . A A . 30 TYR CE2 1 1 9 3949 1 1 27 TYR CG C -6.019 6.478 1.284 1.00 . A A . 30 TYR CG 1 1 9 3950 1 1 27 TYR CZ C -8.227 7.964 2.096 1.00 . A A . 30 TYR CZ 1 1 9 3951 1 1 27 TYR H H -3.990 3.524 -0.516 1.00 . A A . 30 TYR H 1 1 9 3952 1 1 27 TYR HA H -4.519 4.129 2.301 1.00 . A A . 30 TYR HA 1 1 9 3953 1 1 27 TYR HB2 H -3.938 6.132 1.255 1.00 . A A . 30 TYR HB2 1 1 9 3954 1 1 27 TYR HB3 H -4.767 5.708 -0.240 1.00 . A A . 30 TYR HB3 1 1 9 3955 1 1 27 TYR HD1 H -5.562 6.346 3.365 1.00 . A A . 30 TYR HD1 1 1 9 3956 1 1 27 TYR HD2 H -6.754 6.795 -0.695 1.00 . A A . 30 TYR HD2 1 1 9 3957 1 1 27 TYR HE1 H -7.511 7.660 4.089 1.00 . A A . 30 TYR HE1 1 1 9 3958 1 1 27 TYR HE2 H -8.706 8.111 0.018 1.00 . A A . 30 TYR HE2 1 1 9 3959 1 1 27 TYR HH H -10.099 8.398 2.028 1.00 . A A . 30 TYR HH 1 1 9 3960 1 1 27 TYR N N -3.960 3.416 0.455 1.00 . A A . 30 TYR N 1 1 9 3961 1 1 27 TYR O O -6.967 3.838 0.192 1.00 . A A . 30 TYR O 1 1 9 3962 1 1 27 TYR OH O -9.318 8.700 2.498 1.00 . A A . 30 TYR OH 1 1 9 3963 1 1 28 ASN C C -9.025 3.529 2.365 1.00 . A A . 31 ASN C 1 1 9 3964 1 1 28 ASN CA C -8.025 2.393 2.297 1.00 . A A . 31 ASN CA 1 1 9 3965 1 1 28 ASN CB C -8.168 1.490 3.527 1.00 . A A . 31 ASN CB 1 1 9 3966 1 1 28 ASN CG C -9.327 0.513 3.420 1.00 . A A . 31 ASN CG 1 1 9 3967 1 1 28 ASN H H -6.102 2.859 3.016 1.00 . A A . 31 ASN H 1 1 9 3968 1 1 28 ASN HA H -8.190 1.818 1.399 1.00 . A A . 31 ASN HA 1 1 9 3969 1 1 28 ASN HB2 H -7.259 0.923 3.655 1.00 . A A . 31 ASN HB2 1 1 9 3970 1 1 28 ASN HB3 H -8.324 2.108 4.400 1.00 . A A . 31 ASN HB3 1 1 9 3971 1 1 28 ASN HD21 H -10.270 1.714 2.152 1.00 . A A . 31 ASN HD21 1 1 9 3972 1 1 28 ASN HD22 H -11.089 0.247 2.538 1.00 . A A . 31 ASN HD22 1 1 9 3973 1 1 28 ASN N N -6.693 2.962 2.246 1.00 . A A . 31 ASN N 1 1 9 3974 1 1 28 ASN ND2 N -10.330 0.860 2.622 1.00 . A A . 31 ASN ND2 1 1 9 3975 1 1 28 ASN O O -9.084 4.229 3.364 1.00 . A A . 31 ASN O 1 1 9 3976 1 1 28 ASN OD1 O -9.319 -0.546 4.046 1.00 . A A . 31 ASN OD1 1 1 9 3977 1 1 29 THR C C -11.785 4.696 2.351 1.00 . A A . 32 THR C 1 1 9 3978 1 1 29 THR CA C -10.763 4.802 1.223 1.00 . A A . 32 THR CA 1 1 9 3979 1 1 29 THR CB C -11.511 4.799 -0.123 1.00 . A A . 32 THR CB 1 1 9 3980 1 1 29 THR CG2 C -10.576 5.164 -1.265 1.00 . A A . 32 THR CG2 1 1 9 3981 1 1 29 THR H H -9.639 3.155 0.498 1.00 . A A . 32 THR H 1 1 9 3982 1 1 29 THR HA H -10.242 5.743 1.318 1.00 . A A . 32 THR HA 1 1 9 3983 1 1 29 THR HB H -12.303 5.531 -0.076 1.00 . A A . 32 THR HB 1 1 9 3984 1 1 29 THR HG1 H -12.358 3.444 -1.280 1.00 . A A . 32 THR HG1 1 1 9 3985 1 1 29 THR HG21 H -9.782 4.434 -1.329 1.00 . A A . 32 THR HG21 1 1 9 3986 1 1 29 THR HG22 H -10.152 6.141 -1.085 1.00 . A A . 32 THR HG22 1 1 9 3987 1 1 29 THR HG23 H -11.128 5.178 -2.193 1.00 . A A . 32 THR HG23 1 1 9 3988 1 1 29 THR N N -9.770 3.731 1.282 1.00 . A A . 32 THR N 1 1 9 3989 1 1 29 THR O O -11.990 5.647 3.102 1.00 . A A . 32 THR O 1 1 9 3990 1 1 29 THR OG1 O -12.083 3.508 -0.362 1.00 . A A . 32 THR OG1 1 1 9 3991 1 1 30 GLU C C -12.830 3.527 4.865 1.00 . A A . 33 GLU C 1 1 9 3992 1 1 30 GLU CA C -13.428 3.313 3.493 1.00 . A A . 33 GLU CA 1 1 9 3993 1 1 30 GLU CB C -13.949 1.882 3.414 1.00 . A A . 33 GLU CB 1 1 9 3994 1 1 30 GLU CD C -16.428 2.323 3.203 1.00 . A A . 33 GLU CD 1 1 9 3995 1 1 30 GLU CG C -15.324 1.695 4.031 1.00 . A A . 33 GLU CG 1 1 9 3996 1 1 30 GLU H H -12.220 2.816 1.831 1.00 . A A . 33 GLU H 1 1 9 3997 1 1 30 GLU HA H -14.242 4.000 3.344 1.00 . A A . 33 GLU HA 1 1 9 3998 1 1 30 GLU HB2 H -13.988 1.584 2.384 1.00 . A A . 33 GLU HB2 1 1 9 3999 1 1 30 GLU HB3 H -13.258 1.235 3.935 1.00 . A A . 33 GLU HB3 1 1 9 4000 1 1 30 GLU HG2 H -15.520 0.639 4.129 1.00 . A A . 33 GLU HG2 1 1 9 4001 1 1 30 GLU HG3 H -15.327 2.152 5.011 1.00 . A A . 33 GLU HG3 1 1 9 4002 1 1 30 GLU N N -12.427 3.540 2.458 1.00 . A A . 33 GLU N 1 1 9 4003 1 1 30 GLU O O -13.088 4.525 5.539 1.00 . A A . 33 GLU O 1 1 9 4004 1 1 30 GLU OE1 O -16.937 1.649 2.284 1.00 . A A . 33 GLU OE1 1 1 9 4005 1 1 30 GLU OE2 O -16.782 3.490 3.472 1.00 . A A . 33 GLU OE2 1 1 9 4006 1 1 31 THR C C -10.579 3.858 6.770 1.00 . A A . 34 THR C 1 1 9 4007 1 1 31 THR CA C -11.362 2.564 6.546 1.00 . A A . 34 THR CA 1 1 9 4008 1 1 31 THR CB C -10.401 1.366 6.667 1.00 . A A . 34 THR CB 1 1 9 4009 1 1 31 THR CG2 C -9.771 1.312 8.046 1.00 . A A . 34 THR CG2 1 1 9 4010 1 1 31 THR H H -11.898 1.797 4.647 1.00 . A A . 34 THR H 1 1 9 4011 1 1 31 THR HA H -12.116 2.469 7.314 1.00 . A A . 34 THR HA 1 1 9 4012 1 1 31 THR HB H -9.617 1.476 5.933 1.00 . A A . 34 THR HB 1 1 9 4013 1 1 31 THR HG1 H -10.519 -0.482 5.987 1.00 . A A . 34 THR HG1 1 1 9 4014 1 1 31 THR HG21 H -10.544 1.175 8.787 1.00 . A A . 34 THR HG21 1 1 9 4015 1 1 31 THR HG22 H -9.248 2.237 8.237 1.00 . A A . 34 THR HG22 1 1 9 4016 1 1 31 THR HG23 H -9.076 0.488 8.091 1.00 . A A . 34 THR HG23 1 1 9 4017 1 1 31 THR N N -12.033 2.556 5.256 1.00 . A A . 34 THR N 1 1 9 4018 1 1 31 THR O O -10.610 4.424 7.864 1.00 . A A . 34 THR O 1 1 9 4019 1 1 31 THR OG1 O -11.107 0.145 6.416 1.00 . A A . 34 THR OG1 1 1 9 4020 1 1 32 LYS C C -7.711 5.168 6.350 1.00 . A A . 35 LYS C 1 1 9 4021 1 1 32 LYS CA C -9.051 5.509 5.758 1.00 . A A . 35 LYS CA 1 1 9 4022 1 1 32 LYS CB C -9.725 6.655 6.522 1.00 . A A . 35 LYS CB 1 1 9 4023 1 1 32 LYS CD C -11.701 8.182 6.759 1.00 . A A . 35 LYS CD 1 1 9 4024 1 1 32 LYS CE C -13.127 8.462 6.312 1.00 . A A . 35 LYS CE 1 1 9 4025 1 1 32 LYS CG C -11.079 7.051 5.959 1.00 . A A . 35 LYS CG 1 1 9 4026 1 1 32 LYS H H -9.853 3.755 4.915 1.00 . A A . 35 LYS H 1 1 9 4027 1 1 32 LYS HA H -8.885 5.813 4.732 1.00 . A A . 35 LYS HA 1 1 9 4028 1 1 32 LYS HB2 H -9.861 6.360 7.549 1.00 . A A . 35 LYS HB2 1 1 9 4029 1 1 32 LYS HB3 H -9.080 7.521 6.489 1.00 . A A . 35 LYS HB3 1 1 9 4030 1 1 32 LYS HD2 H -11.708 7.909 7.803 1.00 . A A . 35 LYS HD2 1 1 9 4031 1 1 32 LYS HD3 H -11.109 9.075 6.622 1.00 . A A . 35 LYS HD3 1 1 9 4032 1 1 32 LYS HE2 H -13.124 8.676 5.253 1.00 . A A . 35 LYS HE2 1 1 9 4033 1 1 32 LYS HE3 H -13.727 7.582 6.497 1.00 . A A . 35 LYS HE3 1 1 9 4034 1 1 32 LYS HG2 H -10.954 7.372 4.935 1.00 . A A . 35 LYS HG2 1 1 9 4035 1 1 32 LYS HG3 H -11.736 6.195 5.992 1.00 . A A . 35 LYS HG3 1 1 9 4036 1 1 32 LYS HZ1 H -13.694 9.446 8.063 1.00 . A A . 35 LYS HZ1 1 1 9 4037 1 1 32 LYS HZ2 H -14.712 9.751 6.748 1.00 . A A . 35 LYS HZ2 1 1 9 4038 1 1 32 LYS HZ3 H -13.190 10.485 6.827 1.00 . A A . 35 LYS HZ3 1 1 9 4039 1 1 32 LYS N N -9.868 4.295 5.727 1.00 . A A . 35 LYS N 1 1 9 4040 1 1 32 LYS NZ N -13.722 9.617 7.038 1.00 . A A . 35 LYS NZ 1 1 9 4041 1 1 32 LYS O O -7.219 5.826 7.267 1.00 . A A . 35 LYS O 1 1 9 4042 1 1 33 GLN C C -4.793 3.739 5.152 1.00 . A A . 36 GLN C 1 1 9 4043 1 1 33 GLN CA C -5.835 3.638 6.255 1.00 . A A . 36 GLN CA 1 1 9 4044 1 1 33 GLN CB C -5.947 2.194 6.737 1.00 . A A . 36 GLN CB 1 1 9 4045 1 1 33 GLN CD C -4.104 2.437 8.449 1.00 . A A . 36 GLN CD 1 1 9 4046 1 1 33 GLN CG C -4.649 1.627 7.289 1.00 . A A . 36 GLN CG 1 1 9 4047 1 1 33 GLN H H -7.586 3.658 5.048 1.00 . A A . 36 GLN H 1 1 9 4048 1 1 33 GLN HA H -5.527 4.260 7.082 1.00 . A A . 36 GLN HA 1 1 9 4049 1 1 33 GLN HB2 H -6.696 2.144 7.515 1.00 . A A . 36 GLN HB2 1 1 9 4050 1 1 33 GLN HB3 H -6.261 1.580 5.910 1.00 . A A . 36 GLN HB3 1 1 9 4051 1 1 33 GLN HE21 H -3.060 3.576 7.197 1.00 . A A . 36 GLN HE21 1 1 9 4052 1 1 33 GLN HE22 H -2.906 3.966 8.872 1.00 . A A . 36 GLN HE22 1 1 9 4053 1 1 33 GLN HG2 H -4.827 0.617 7.627 1.00 . A A . 36 GLN HG2 1 1 9 4054 1 1 33 GLN HG3 H -3.913 1.616 6.498 1.00 . A A . 36 GLN HG3 1 1 9 4055 1 1 33 GLN N N -7.129 4.116 5.798 1.00 . A A . 36 GLN N 1 1 9 4056 1 1 33 GLN NE2 N -3.273 3.426 8.141 1.00 . A A . 36 GLN NE2 1 1 9 4057 1 1 33 GLN O O -4.744 2.915 4.240 1.00 . A A . 36 GLN O 1 1 9 4058 1 1 33 GLN OE1 O -4.426 2.176 9.608 1.00 . A A . 36 GLN OE1 1 1 9 4059 1 1 34 SER C C -1.534 4.549 4.871 1.00 . A A . 37 SER C 1 1 9 4060 1 1 34 SER CA C -2.884 4.982 4.296 1.00 . A A . 37 SER CA 1 1 9 4061 1 1 34 SER CB C -2.833 6.461 3.909 1.00 . A A . 37 SER CB 1 1 9 4062 1 1 34 SER H H -4.065 5.367 6.012 1.00 . A A . 37 SER H 1 1 9 4063 1 1 34 SER HA H -3.103 4.393 3.417 1.00 . A A . 37 SER HA 1 1 9 4064 1 1 34 SER HB2 H -3.737 6.725 3.382 1.00 . A A . 37 SER HB2 1 1 9 4065 1 1 34 SER HB3 H -2.749 7.063 4.803 1.00 . A A . 37 SER HB3 1 1 9 4066 1 1 34 SER HG H -0.918 6.723 3.594 1.00 . A A . 37 SER HG 1 1 9 4067 1 1 34 SER N N -3.951 4.750 5.265 1.00 . A A . 37 SER N 1 1 9 4068 1 1 34 SER O O -0.980 5.218 5.743 1.00 . A A . 37 SER O 1 1 9 4069 1 1 34 SER OG O -1.724 6.732 3.071 1.00 . A A . 37 SER OG 1 1 9 4070 1 1 35 THR C C 0.807 1.822 3.928 1.00 . A A . 38 THR C 1 1 9 4071 1 1 35 THR CA C 0.262 2.895 4.865 1.00 . A A . 38 THR CA 1 1 9 4072 1 1 35 THR CB C 0.114 2.303 6.281 1.00 . A A . 38 THR CB 1 1 9 4073 1 1 35 THR CG2 C -0.919 1.186 6.295 1.00 . A A . 38 THR CG2 1 1 9 4074 1 1 35 THR H H -1.495 2.944 3.671 1.00 . A A . 38 THR H 1 1 9 4075 1 1 35 THR HA H 0.968 3.712 4.911 1.00 . A A . 38 THR HA 1 1 9 4076 1 1 35 THR HB H -0.215 3.085 6.949 1.00 . A A . 38 THR HB 1 1 9 4077 1 1 35 THR HG1 H 2.083 2.351 6.396 1.00 . A A . 38 THR HG1 1 1 9 4078 1 1 35 THR HG21 H -1.019 0.801 7.299 1.00 . A A . 38 THR HG21 1 1 9 4079 1 1 35 THR HG22 H -0.601 0.392 5.636 1.00 . A A . 38 THR HG22 1 1 9 4080 1 1 35 THR HG23 H -1.870 1.572 5.961 1.00 . A A . 38 THR HG23 1 1 9 4081 1 1 35 THR N N -1.012 3.428 4.378 1.00 . A A . 38 THR N 1 1 9 4082 1 1 35 THR O O 0.112 1.385 3.010 1.00 . A A . 38 THR O 1 1 9 4083 1 1 35 THR OG1 O 1.375 1.799 6.737 1.00 . A A . 38 THR OG1 1 1 9 4084 1 1 36 TRP C C 2.538 -0.989 4.010 1.00 . A A . 39 TRP C 1 1 9 4085 1 1 36 TRP CA C 2.646 0.362 3.309 1.00 . A A . 39 TRP CA 1 1 9 4086 1 1 36 TRP CB C 4.138 0.620 3.022 1.00 . A A . 39 TRP CB 1 1 9 4087 1 1 36 TRP CD1 C 5.073 2.578 4.338 1.00 . A A . 39 TRP CD1 1 1 9 4088 1 1 36 TRP CD2 C 4.753 3.013 2.173 1.00 . A A . 39 TRP CD2 1 1 9 4089 1 1 36 TRP CE2 C 5.285 4.162 2.784 1.00 . A A . 39 TRP CE2 1 1 9 4090 1 1 36 TRP CE3 C 4.469 3.046 0.808 1.00 . A A . 39 TRP CE3 1 1 9 4091 1 1 36 TRP CG C 4.617 2.020 3.190 1.00 . A A . 39 TRP CG 1 1 9 4092 1 1 36 TRP CH2 C 5.257 5.333 0.738 1.00 . A A . 39 TRP CH2 1 1 9 4093 1 1 36 TRP CZ2 C 5.543 5.329 2.072 1.00 . A A . 39 TRP CZ2 1 1 9 4094 1 1 36 TRP CZ3 C 4.724 4.206 0.105 1.00 . A A . 39 TRP CZ3 1 1 9 4095 1 1 36 TRP H H 2.576 1.783 4.886 1.00 . A A . 39 TRP H 1 1 9 4096 1 1 36 TRP HA H 2.101 0.326 2.378 1.00 . A A . 39 TRP HA 1 1 9 4097 1 1 36 TRP HB2 H 4.724 0.020 3.699 1.00 . A A . 39 TRP HB2 1 1 9 4098 1 1 36 TRP HB3 H 4.356 0.320 2.008 1.00 . A A . 39 TRP HB3 1 1 9 4099 1 1 36 TRP HD1 H 5.105 2.060 5.282 1.00 . A A . 39 TRP HD1 1 1 9 4100 1 1 36 TRP HE1 H 5.841 4.486 4.780 1.00 . A A . 39 TRP HE1 1 1 9 4101 1 1 36 TRP HE3 H 4.057 2.186 0.302 1.00 . A A . 39 TRP HE3 1 1 9 4102 1 1 36 TRP HH2 H 5.440 6.219 0.148 1.00 . A A . 39 TRP HH2 1 1 9 4103 1 1 36 TRP HZ2 H 5.958 6.201 2.542 1.00 . A A . 39 TRP HZ2 1 1 9 4104 1 1 36 TRP HZ3 H 4.510 4.251 -0.951 1.00 . A A . 39 TRP HZ3 1 1 9 4105 1 1 36 TRP N N 2.055 1.397 4.151 1.00 . A A . 39 TRP N 1 1 9 4106 1 1 36 TRP NE1 N 5.477 3.872 4.107 1.00 . A A . 39 TRP NE1 1 1 9 4107 1 1 36 TRP O O 3.304 -1.288 4.926 1.00 . A A . 39 TRP O 1 1 9 4108 1 1 37 GLU C C 0.440 -3.931 3.251 1.00 . A A . 40 GLU C 1 1 9 4109 1 1 37 GLU CA C 1.366 -3.119 4.147 1.00 . A A . 40 GLU CA 1 1 9 4110 1 1 37 GLU CB C 0.778 -2.998 5.561 1.00 . A A . 40 GLU CB 1 1 9 4111 1 1 37 GLU CD C -1.282 -2.951 7.024 1.00 . A A . 40 GLU CD 1 1 9 4112 1 1 37 GLU CG C -0.732 -3.164 5.627 1.00 . A A . 40 GLU CG 1 1 9 4113 1 1 37 GLU H H 0.995 -1.508 2.840 1.00 . A A . 40 GLU H 1 1 9 4114 1 1 37 GLU HA H 2.323 -3.616 4.204 1.00 . A A . 40 GLU HA 1 1 9 4115 1 1 37 GLU HB2 H 1.228 -3.753 6.189 1.00 . A A . 40 GLU HB2 1 1 9 4116 1 1 37 GLU HB3 H 1.027 -2.021 5.955 1.00 . A A . 40 GLU HB3 1 1 9 4117 1 1 37 GLU HG2 H -1.190 -2.448 4.962 1.00 . A A . 40 GLU HG2 1 1 9 4118 1 1 37 GLU HG3 H -0.986 -4.164 5.305 1.00 . A A . 40 GLU HG3 1 1 9 4119 1 1 37 GLU N N 1.578 -1.801 3.572 1.00 . A A . 40 GLU N 1 1 9 4120 1 1 37 GLU O O -0.401 -3.369 2.551 1.00 . A A . 40 GLU O 1 1 9 4121 1 1 37 GLU OE1 O -1.600 -1.794 7.368 1.00 . A A . 40 GLU OE1 1 1 9 4122 1 1 37 GLU OE2 O -1.394 -3.943 7.776 1.00 . A A . 40 GLU OE2 1 1 9 4123 1 1 38 LYS C C -1.695 -5.973 2.832 1.00 . A A . 41 LYS C 1 1 9 4124 1 1 38 LYS CA C -0.216 -6.133 2.478 1.00 . A A . 41 LYS CA 1 1 9 4125 1 1 38 LYS CB C 0.226 -7.574 2.716 1.00 . A A . 41 LYS CB 1 1 9 4126 1 1 38 LYS CD C 1.148 -9.245 4.361 1.00 . A A . 41 LYS CD 1 1 9 4127 1 1 38 LYS CE C -0.201 -9.802 4.788 1.00 . A A . 41 LYS CE 1 1 9 4128 1 1 38 LYS CG C 1.054 -7.776 3.976 1.00 . A A . 41 LYS CG 1 1 9 4129 1 1 38 LYS H H 1.282 -5.634 3.848 1.00 . A A . 41 LYS H 1 1 9 4130 1 1 38 LYS HA H -0.067 -5.886 1.439 1.00 . A A . 41 LYS HA 1 1 9 4131 1 1 38 LYS HB2 H -0.647 -8.183 2.801 1.00 . A A . 41 LYS HB2 1 1 9 4132 1 1 38 LYS HB3 H 0.809 -7.903 1.873 1.00 . A A . 41 LYS HB3 1 1 9 4133 1 1 38 LYS HD2 H 1.503 -9.806 3.509 1.00 . A A . 41 LYS HD2 1 1 9 4134 1 1 38 LYS HD3 H 1.847 -9.348 5.178 1.00 . A A . 41 LYS HD3 1 1 9 4135 1 1 38 LYS HE2 H -0.540 -9.261 5.659 1.00 . A A . 41 LYS HE2 1 1 9 4136 1 1 38 LYS HE3 H -0.905 -9.663 3.982 1.00 . A A . 41 LYS HE3 1 1 9 4137 1 1 38 LYS HG2 H 2.051 -7.400 3.803 1.00 . A A . 41 LYS HG2 1 1 9 4138 1 1 38 LYS HG3 H 0.595 -7.227 4.784 1.00 . A A . 41 LYS HG3 1 1 9 4139 1 1 38 LYS HZ1 H 0.195 -11.792 4.290 1.00 . A A . 41 LYS HZ1 1 1 9 4140 1 1 38 LYS HZ2 H -1.058 -11.602 5.413 1.00 . A A . 41 LYS HZ2 1 1 9 4141 1 1 38 LYS HZ3 H 0.550 -11.404 5.898 1.00 . A A . 41 LYS HZ3 1 1 9 4142 1 1 38 LYS N N 0.600 -5.246 3.275 1.00 . A A . 41 LYS N 1 1 9 4143 1 1 38 LYS NZ N -0.123 -11.251 5.120 1.00 . A A . 41 LYS NZ 1 1 9 4144 1 1 38 LYS O O -2.134 -6.435 3.885 1.00 . A A . 41 LYS O 1 1 9 4145 1 1 39 PRO C C -4.746 -6.348 1.907 1.00 . A A . 42 PRO C 1 1 9 4146 1 1 39 PRO CA C -3.914 -5.104 2.202 1.00 . A A . 42 PRO CA 1 1 9 4147 1 1 39 PRO CB C -4.289 -3.969 1.235 1.00 . A A . 42 PRO CB 1 1 9 4148 1 1 39 PRO CD C -2.088 -4.743 0.673 1.00 . A A . 42 PRO CD 1 1 9 4149 1 1 39 PRO CG C -3.024 -3.580 0.538 1.00 . A A . 42 PRO CG 1 1 9 4150 1 1 39 PRO HA H -4.090 -4.784 3.220 1.00 . A A . 42 PRO HA 1 1 9 4151 1 1 39 PRO HB2 H -5.028 -4.324 0.533 1.00 . A A . 42 PRO HB2 1 1 9 4152 1 1 39 PRO HB3 H -4.695 -3.141 1.796 1.00 . A A . 42 PRO HB3 1 1 9 4153 1 1 39 PRO HD2 H -2.237 -5.447 -0.134 1.00 . A A . 42 PRO HD2 1 1 9 4154 1 1 39 PRO HD3 H -1.062 -4.407 0.702 1.00 . A A . 42 PRO HD3 1 1 9 4155 1 1 39 PRO HG2 H -3.226 -3.383 -0.505 1.00 . A A . 42 PRO HG2 1 1 9 4156 1 1 39 PRO HG3 H -2.603 -2.703 1.009 1.00 . A A . 42 PRO HG3 1 1 9 4157 1 1 39 PRO N N -2.491 -5.320 1.959 1.00 . A A . 42 PRO N 1 1 9 4158 1 1 39 PRO O O -5.070 -6.628 0.752 1.00 . A A . 42 PRO O 1 1 10 4159 1 1 12 SER C C -10.318 -1.159 -2.901 1.00 . A A . 15 SER C 1 1 10 4160 1 1 12 SER CA C -10.219 -2.337 -3.859 1.00 . A A . 15 SER CA 1 1 10 4161 1 1 12 SER CB C -11.571 -3.039 -3.953 1.00 . A A . 15 SER CB 1 1 10 4162 1 1 12 SER H H -8.878 -3.226 -2.490 1.00 . A A . 15 SER H 1 1 10 4163 1 1 12 SER HA H -9.938 -1.974 -4.836 1.00 . A A . 15 SER HA 1 1 10 4164 1 1 12 SER HB2 H -11.742 -3.598 -3.045 1.00 . A A . 15 SER HB2 1 1 10 4165 1 1 12 SER HB3 H -12.350 -2.300 -4.071 1.00 . A A . 15 SER HB3 1 1 10 4166 1 1 12 SER HG H -11.296 -3.485 -5.841 1.00 . A A . 15 SER HG 1 1 10 4167 1 1 12 SER N N -9.199 -3.276 -3.414 1.00 . A A . 15 SER N 1 1 10 4168 1 1 12 SER O O -10.022 -0.022 -3.266 1.00 . A A . 15 SER O 1 1 10 4169 1 1 12 SER OG O -11.614 -3.931 -5.053 1.00 . A A . 15 SER OG 1 1 10 4170 1 1 13 MET C C -9.556 0.333 -0.482 1.00 . A A . 16 MET C 1 1 10 4171 1 1 13 MET CA C -10.873 -0.414 -0.650 1.00 . A A . 16 MET CA 1 1 10 4172 1 1 13 MET CB C -11.283 -1.035 0.689 1.00 . A A . 16 MET CB 1 1 10 4173 1 1 13 MET CE C -12.833 -1.510 3.395 1.00 . A A . 16 MET CE 1 1 10 4174 1 1 13 MET CG C -12.581 -1.822 0.638 1.00 . A A . 16 MET CG 1 1 10 4175 1 1 13 MET H H -10.969 -2.370 -1.446 1.00 . A A . 16 MET H 1 1 10 4176 1 1 13 MET HA H -11.636 0.282 -0.968 1.00 . A A . 16 MET HA 1 1 10 4177 1 1 13 MET HB2 H -10.499 -1.700 1.018 1.00 . A A . 16 MET HB2 1 1 10 4178 1 1 13 MET HB3 H -11.397 -0.245 1.416 1.00 . A A . 16 MET HB3 1 1 10 4179 1 1 13 MET HE1 H -12.907 -1.963 4.373 1.00 . A A . 16 MET HE1 1 1 10 4180 1 1 13 MET HE2 H -13.665 -0.838 3.248 1.00 . A A . 16 MET HE2 1 1 10 4181 1 1 13 MET HE3 H -11.909 -0.956 3.325 1.00 . A A . 16 MET HE3 1 1 10 4182 1 1 13 MET HG2 H -13.402 -1.132 0.512 1.00 . A A . 16 MET HG2 1 1 10 4183 1 1 13 MET HG3 H -12.546 -2.496 -0.205 1.00 . A A . 16 MET HG3 1 1 10 4184 1 1 13 MET N N -10.741 -1.444 -1.671 1.00 . A A . 16 MET N 1 1 10 4185 1 1 13 MET O O -9.533 1.481 -0.039 1.00 . A A . 16 MET O 1 1 10 4186 1 1 13 MET SD S -12.866 -2.788 2.138 1.00 . A A . 16 MET SD 1 1 10 4187 1 1 14 TRP C C -6.598 0.676 -2.089 1.00 . A A . 17 TRP C 1 1 10 4188 1 1 14 TRP CA C -7.136 0.258 -0.730 1.00 . A A . 17 TRP CA 1 1 10 4189 1 1 14 TRP CB C -6.167 -0.735 -0.083 1.00 . A A . 17 TRP CB 1 1 10 4190 1 1 14 TRP CD1 C -7.743 -2.237 1.268 1.00 . A A . 17 TRP CD1 1 1 10 4191 1 1 14 TRP CD2 C -6.199 -1.169 2.481 1.00 . A A . 17 TRP CD2 1 1 10 4192 1 1 14 TRP CE2 C -6.987 -1.945 3.348 1.00 . A A . 17 TRP CE2 1 1 10 4193 1 1 14 TRP CE3 C -5.159 -0.409 3.011 1.00 . A A . 17 TRP CE3 1 1 10 4194 1 1 14 TRP CG C -6.698 -1.363 1.162 1.00 . A A . 17 TRP CG 1 1 10 4195 1 1 14 TRP CH2 C -5.739 -1.224 5.215 1.00 . A A . 17 TRP CH2 1 1 10 4196 1 1 14 TRP CZ2 C -6.766 -1.980 4.720 1.00 . A A . 17 TRP CZ2 1 1 10 4197 1 1 14 TRP CZ3 C -4.938 -0.444 4.371 1.00 . A A . 17 TRP CZ3 1 1 10 4198 1 1 14 TRP H H -8.553 -1.237 -1.204 1.00 . A A . 17 TRP H 1 1 10 4199 1 1 14 TRP HA H -7.211 1.130 -0.101 1.00 . A A . 17 TRP HA 1 1 10 4200 1 1 14 TRP HB2 H -5.943 -1.523 -0.781 1.00 . A A . 17 TRP HB2 1 1 10 4201 1 1 14 TRP HB3 H -5.253 -0.217 0.174 1.00 . A A . 17 TRP HB3 1 1 10 4202 1 1 14 TRP HD1 H -8.335 -2.586 0.433 1.00 . A A . 17 TRP HD1 1 1 10 4203 1 1 14 TRP HE1 H -8.611 -3.203 2.917 1.00 . A A . 17 TRP HE1 1 1 10 4204 1 1 14 TRP HE3 H -4.531 0.197 2.374 1.00 . A A . 17 TRP HE3 1 1 10 4205 1 1 14 TRP HH2 H -5.530 -1.220 6.275 1.00 . A A . 17 TRP HH2 1 1 10 4206 1 1 14 TRP HZ2 H -7.379 -2.573 5.381 1.00 . A A . 17 TRP HZ2 1 1 10 4207 1 1 14 TRP HZ3 H -4.138 0.138 4.795 1.00 . A A . 17 TRP HZ3 1 1 10 4208 1 1 14 TRP N N -8.463 -0.329 -0.846 1.00 . A A . 17 TRP N 1 1 10 4209 1 1 14 TRP NE1 N -7.925 -2.589 2.583 1.00 . A A . 17 TRP NE1 1 1 10 4210 1 1 14 TRP O O -6.508 -0.135 -3.010 1.00 . A A . 17 TRP O 1 1 10 4211 1 1 15 THR C C -4.187 2.657 -3.292 1.00 . A A . 18 THR C 1 1 10 4212 1 1 15 THR CA C -5.692 2.472 -3.440 1.00 . A A . 18 THR CA 1 1 10 4213 1 1 15 THR CB C -6.338 3.817 -3.815 1.00 . A A . 18 THR CB 1 1 10 4214 1 1 15 THR CG2 C -7.813 3.636 -4.137 1.00 . A A . 18 THR CG2 1 1 10 4215 1 1 15 THR H H -6.355 2.551 -1.443 1.00 . A A . 18 THR H 1 1 10 4216 1 1 15 THR HA H -5.893 1.758 -4.226 1.00 . A A . 18 THR HA 1 1 10 4217 1 1 15 THR HB H -5.839 4.204 -4.687 1.00 . A A . 18 THR HB 1 1 10 4218 1 1 15 THR HG1 H -6.791 4.520 -2.028 1.00 . A A . 18 THR HG1 1 1 10 4219 1 1 15 THR HG21 H -8.234 4.583 -4.439 1.00 . A A . 18 THR HG21 1 1 10 4220 1 1 15 THR HG22 H -8.332 3.276 -3.260 1.00 . A A . 18 THR HG22 1 1 10 4221 1 1 15 THR HG23 H -7.922 2.921 -4.939 1.00 . A A . 18 THR HG23 1 1 10 4222 1 1 15 THR N N -6.241 1.948 -2.206 1.00 . A A . 18 THR N 1 1 10 4223 1 1 15 THR O O -3.723 3.223 -2.304 1.00 . A A . 18 THR O 1 1 10 4224 1 1 15 THR OG1 O -6.189 4.751 -2.739 1.00 . A A . 18 THR OG1 1 1 10 4225 1 1 16 GLU C C -1.441 3.411 -5.096 1.00 . A A . 19 GLU C 1 1 10 4226 1 1 16 GLU CA C -1.974 2.293 -4.204 1.00 . A A . 19 GLU CA 1 1 10 4227 1 1 16 GLU CB C -1.345 0.955 -4.591 1.00 . A A . 19 GLU CB 1 1 10 4228 1 1 16 GLU CD C -1.054 -0.772 -6.412 1.00 . A A . 19 GLU CD 1 1 10 4229 1 1 16 GLU CG C -1.380 0.670 -6.081 1.00 . A A . 19 GLU CG 1 1 10 4230 1 1 16 GLU H H -3.837 1.761 -5.046 1.00 . A A . 19 GLU H 1 1 10 4231 1 1 16 GLU HA H -1.714 2.514 -3.184 1.00 . A A . 19 GLU HA 1 1 10 4232 1 1 16 GLU HB2 H -0.317 0.952 -4.271 1.00 . A A . 19 GLU HB2 1 1 10 4233 1 1 16 GLU HB3 H -1.873 0.162 -4.082 1.00 . A A . 19 GLU HB3 1 1 10 4234 1 1 16 GLU HG2 H -2.366 0.898 -6.455 1.00 . A A . 19 GLU HG2 1 1 10 4235 1 1 16 GLU HG3 H -0.655 1.308 -6.564 1.00 . A A . 19 GLU HG3 1 1 10 4236 1 1 16 GLU N N -3.423 2.190 -4.272 1.00 . A A . 19 GLU N 1 1 10 4237 1 1 16 GLU O O -1.809 3.521 -6.267 1.00 . A A . 19 GLU O 1 1 10 4238 1 1 16 GLU OE1 O -1.627 -1.675 -5.765 1.00 . A A . 19 GLU OE1 1 1 10 4239 1 1 16 GLU OE2 O -0.227 -0.999 -7.319 1.00 . A A . 19 GLU OE2 1 1 10 4240 1 1 17 HIS C C 1.416 5.695 -4.731 1.00 . A A . 20 HIS C 1 1 10 4241 1 1 17 HIS CA C 0.021 5.365 -5.261 1.00 . A A . 20 HIS CA 1 1 10 4242 1 1 17 HIS CB C -0.856 6.615 -5.157 1.00 . A A . 20 HIS CB 1 1 10 4243 1 1 17 HIS CD2 C -3.399 6.122 -5.032 1.00 . A A . 20 HIS CD2 1 1 10 4244 1 1 17 HIS CE1 C -3.879 6.361 -7.158 1.00 . A A . 20 HIS CE1 1 1 10 4245 1 1 17 HIS CG C -2.249 6.434 -5.676 1.00 . A A . 20 HIS CG 1 1 10 4246 1 1 17 HIS H H -0.340 4.117 -3.577 1.00 . A A . 20 HIS H 1 1 10 4247 1 1 17 HIS HA H 0.099 5.075 -6.298 1.00 . A A . 20 HIS HA 1 1 10 4248 1 1 17 HIS HB2 H -0.926 6.910 -4.121 1.00 . A A . 20 HIS HB2 1 1 10 4249 1 1 17 HIS HB3 H -0.391 7.414 -5.720 1.00 . A A . 20 HIS HB3 1 1 10 4250 1 1 17 HIS HD1 H -1.964 6.803 -7.731 1.00 . A A . 20 HIS HD1 1 1 10 4251 1 1 17 HIS HD2 H -3.511 5.940 -3.972 1.00 . A A . 20 HIS HD2 1 1 10 4252 1 1 17 HIS HE1 H -4.421 6.404 -8.090 1.00 . A A . 20 HIS HE1 1 1 10 4253 1 1 17 HIS HE2 H -5.326 5.827 -5.811 1.00 . A A . 20 HIS HE2 1 1 10 4254 1 1 17 HIS N N -0.577 4.250 -4.523 1.00 . A A . 20 HIS N 1 1 10 4255 1 1 17 HIS ND1 N -2.583 6.577 -7.006 1.00 . A A . 20 HIS ND1 1 1 10 4256 1 1 17 HIS NE2 N -4.395 6.084 -5.976 1.00 . A A . 20 HIS NE2 1 1 10 4257 1 1 17 HIS O O 1.652 5.645 -3.525 1.00 . A A . 20 HIS O 1 1 10 4258 1 1 18 LYS C C 3.710 7.381 -4.112 1.00 . A A . 21 LYS C 1 1 10 4259 1 1 18 LYS CA C 3.699 6.380 -5.256 1.00 . A A . 21 LYS CA 1 1 10 4260 1 1 18 LYS CB C 4.452 6.955 -6.452 1.00 . A A . 21 LYS CB 1 1 10 4261 1 1 18 LYS CD C 3.873 6.399 -8.828 1.00 . A A . 21 LYS CD 1 1 10 4262 1 1 18 LYS CE C 4.070 5.412 -9.967 1.00 . A A . 21 LYS CE 1 1 10 4263 1 1 18 LYS CG C 4.607 5.956 -7.575 1.00 . A A . 21 LYS CG 1 1 10 4264 1 1 18 LYS H H 2.113 5.985 -6.593 1.00 . A A . 21 LYS H 1 1 10 4265 1 1 18 LYS HA H 4.196 5.480 -4.932 1.00 . A A . 21 LYS HA 1 1 10 4266 1 1 18 LYS HB2 H 3.913 7.813 -6.829 1.00 . A A . 21 LYS HB2 1 1 10 4267 1 1 18 LYS HB3 H 5.435 7.266 -6.133 1.00 . A A . 21 LYS HB3 1 1 10 4268 1 1 18 LYS HD2 H 2.819 6.474 -8.609 1.00 . A A . 21 LYS HD2 1 1 10 4269 1 1 18 LYS HD3 H 4.250 7.366 -9.132 1.00 . A A . 21 LYS HD3 1 1 10 4270 1 1 18 LYS HE2 H 3.667 4.455 -9.670 1.00 . A A . 21 LYS HE2 1 1 10 4271 1 1 18 LYS HE3 H 3.539 5.772 -10.835 1.00 . A A . 21 LYS HE3 1 1 10 4272 1 1 18 LYS HG2 H 5.657 5.839 -7.801 1.00 . A A . 21 LYS HG2 1 1 10 4273 1 1 18 LYS HG3 H 4.200 5.016 -7.241 1.00 . A A . 21 LYS HG3 1 1 10 4274 1 1 18 LYS HZ1 H 5.926 6.162 -10.569 1.00 . A A . 21 LYS HZ1 1 1 10 4275 1 1 18 LYS HZ2 H 5.609 4.595 -11.121 1.00 . A A . 21 LYS HZ2 1 1 10 4276 1 1 18 LYS HZ3 H 6.030 4.852 -9.502 1.00 . A A . 21 LYS HZ3 1 1 10 4277 1 1 18 LYS N N 2.340 6.020 -5.640 1.00 . A A . 21 LYS N 1 1 10 4278 1 1 18 LYS NZ N 5.509 5.243 -10.314 1.00 . A A . 21 LYS NZ 1 1 10 4279 1 1 18 LYS O O 2.777 8.169 -3.946 1.00 . A A . 21 LYS O 1 1 10 4280 1 1 19 SER C C 6.362 8.149 -1.645 1.00 . A A . 22 SER C 1 1 10 4281 1 1 19 SER CA C 4.936 8.227 -2.190 1.00 . A A . 22 SER CA 1 1 10 4282 1 1 19 SER CB C 3.928 7.836 -1.111 1.00 . A A . 22 SER CB 1 1 10 4283 1 1 19 SER H H 5.488 6.696 -3.534 1.00 . A A . 22 SER H 1 1 10 4284 1 1 19 SER HA H 4.735 9.237 -2.514 1.00 . A A . 22 SER HA 1 1 10 4285 1 1 19 SER HB2 H 3.479 6.891 -1.368 1.00 . A A . 22 SER HB2 1 1 10 4286 1 1 19 SER HB3 H 4.437 7.746 -0.162 1.00 . A A . 22 SER HB3 1 1 10 4287 1 1 19 SER HG H 3.078 9.528 -1.607 1.00 . A A . 22 SER HG 1 1 10 4288 1 1 19 SER N N 4.781 7.344 -3.334 1.00 . A A . 22 SER N 1 1 10 4289 1 1 19 SER O O 7.166 7.359 -2.149 1.00 . A A . 22 SER O 1 1 10 4290 1 1 19 SER OG O 2.909 8.812 -0.992 1.00 . A A . 22 SER OG 1 1 10 4291 1 1 20 PRO C C 8.672 7.610 0.029 1.00 . A A . 23 PRO C 1 1 10 4292 1 1 20 PRO CA C 8.031 8.993 -0.016 1.00 . A A . 23 PRO CA 1 1 10 4293 1 1 20 PRO CB C 7.766 9.499 1.404 1.00 . A A . 23 PRO CB 1 1 10 4294 1 1 20 PRO CD C 5.836 9.991 0.000 1.00 . A A . 23 PRO CD 1 1 10 4295 1 1 20 PRO CG C 6.444 10.206 1.365 1.00 . A A . 23 PRO CG 1 1 10 4296 1 1 20 PRO HA H 8.692 9.678 -0.526 1.00 . A A . 23 PRO HA 1 1 10 4297 1 1 20 PRO HB2 H 7.739 8.659 2.082 1.00 . A A . 23 PRO HB2 1 1 10 4298 1 1 20 PRO HB3 H 8.558 10.172 1.697 1.00 . A A . 23 PRO HB3 1 1 10 4299 1 1 20 PRO HD2 H 4.827 9.624 0.099 1.00 . A A . 23 PRO HD2 1 1 10 4300 1 1 20 PRO HD3 H 5.844 10.907 -0.566 1.00 . A A . 23 PRO HD3 1 1 10 4301 1 1 20 PRO HG2 H 5.794 9.794 2.123 1.00 . A A . 23 PRO HG2 1 1 10 4302 1 1 20 PRO HG3 H 6.593 11.260 1.542 1.00 . A A . 23 PRO HG3 1 1 10 4303 1 1 20 PRO N N 6.703 8.980 -0.625 1.00 . A A . 23 PRO N 1 1 10 4304 1 1 20 PRO O O 7.977 6.593 0.023 1.00 . A A . 23 PRO O 1 1 10 4305 1 1 21 ASP C C 10.750 5.672 -1.257 1.00 . A A . 24 ASP C 1 1 10 4306 1 1 21 ASP CA C 10.759 6.337 0.119 1.00 . A A . 24 ASP CA 1 1 10 4307 1 1 21 ASP CB C 10.193 5.386 1.187 1.00 . A A . 24 ASP CB 1 1 10 4308 1 1 21 ASP CG C 10.259 5.978 2.581 1.00 . A A . 24 ASP CG 1 1 10 4309 1 1 21 ASP H H 10.492 8.437 0.106 1.00 . A A . 24 ASP H 1 1 10 4310 1 1 21 ASP HA H 11.779 6.580 0.375 1.00 . A A . 24 ASP HA 1 1 10 4311 1 1 21 ASP HB2 H 9.162 5.170 0.959 1.00 . A A . 24 ASP HB2 1 1 10 4312 1 1 21 ASP HB3 H 10.755 4.466 1.183 1.00 . A A . 24 ASP HB3 1 1 10 4313 1 1 21 ASP N N 10.004 7.587 0.086 1.00 . A A . 24 ASP N 1 1 10 4314 1 1 21 ASP O O 11.285 4.578 -1.436 1.00 . A A . 24 ASP O 1 1 10 4315 1 1 21 ASP OD1 O 11.287 5.781 3.262 1.00 . A A . 24 ASP OD1 1 1 10 4316 1 1 21 ASP OD2 O 9.283 6.640 2.991 1.00 . A A . 24 ASP OD2 1 1 10 4317 1 1 22 GLY C C 9.333 4.532 -3.653 1.00 . A A . 25 GLY C 1 1 10 4318 1 1 22 GLY CA C 10.062 5.845 -3.584 1.00 . A A . 25 GLY CA 1 1 10 4319 1 1 22 GLY H H 9.720 7.211 -2.015 1.00 . A A . 25 GLY H 1 1 10 4320 1 1 22 GLY HA2 H 9.535 6.562 -4.203 1.00 . A A . 25 GLY HA2 1 1 10 4321 1 1 22 GLY HA3 H 11.061 5.717 -3.963 1.00 . A A . 25 GLY HA3 1 1 10 4322 1 1 22 GLY N N 10.137 6.357 -2.228 1.00 . A A . 25 GLY N 1 1 10 4323 1 1 22 GLY O O 9.866 3.533 -4.133 1.00 . A A . 25 GLY O 1 1 10 4324 1 1 23 ARG C C 5.804 3.734 -3.134 1.00 . A A . 26 ARG C 1 1 10 4325 1 1 23 ARG CA C 7.274 3.354 -3.158 1.00 . A A . 26 ARG CA 1 1 10 4326 1 1 23 ARG CB C 7.624 2.475 -1.961 1.00 . A A . 26 ARG CB 1 1 10 4327 1 1 23 ARG CD C 8.952 2.390 0.159 1.00 . A A . 26 ARG CD 1 1 10 4328 1 1 23 ARG CG C 8.081 3.249 -0.739 1.00 . A A . 26 ARG CG 1 1 10 4329 1 1 23 ARG CZ C 11.291 1.625 0.241 1.00 . A A . 26 ARG CZ 1 1 10 4330 1 1 23 ARG H H 7.738 5.383 -2.809 1.00 . A A . 26 ARG H 1 1 10 4331 1 1 23 ARG HA H 7.474 2.805 -4.066 1.00 . A A . 26 ARG HA 1 1 10 4332 1 1 23 ARG HB2 H 6.753 1.907 -1.687 1.00 . A A . 26 ARG HB2 1 1 10 4333 1 1 23 ARG HB3 H 8.413 1.795 -2.246 1.00 . A A . 26 ARG HB3 1 1 10 4334 1 1 23 ARG HD2 H 9.073 2.890 1.104 1.00 . A A . 26 ARG HD2 1 1 10 4335 1 1 23 ARG HD3 H 8.459 1.442 0.315 1.00 . A A . 26 ARG HD3 1 1 10 4336 1 1 23 ARG HE H 10.396 2.390 -1.370 1.00 . A A . 26 ARG HE 1 1 10 4337 1 1 23 ARG HG2 H 8.647 4.110 -1.059 1.00 . A A . 26 ARG HG2 1 1 10 4338 1 1 23 ARG HG3 H 7.214 3.571 -0.182 1.00 . A A . 26 ARG HG3 1 1 10 4339 1 1 23 ARG HH11 H 10.278 1.426 1.979 1.00 . A A . 26 ARG HH11 1 1 10 4340 1 1 23 ARG HH12 H 11.926 0.894 2.016 1.00 . A A . 26 ARG HH12 1 1 10 4341 1 1 23 ARG HH21 H 12.562 1.692 -1.328 1.00 . A A . 26 ARG HH21 1 1 10 4342 1 1 23 ARG HH22 H 13.224 1.044 0.136 1.00 . A A . 26 ARG HH22 1 1 10 4343 1 1 23 ARG N N 8.101 4.544 -3.171 1.00 . A A . 26 ARG N 1 1 10 4344 1 1 23 ARG NE N 10.268 2.148 -0.428 1.00 . A A . 26 ARG NE 1 1 10 4345 1 1 23 ARG NH1 N 11.153 1.287 1.516 1.00 . A A . 26 ARG NH1 1 1 10 4346 1 1 23 ARG NH2 N 12.455 1.438 -0.367 1.00 . A A . 26 ARG NH2 1 1 10 4347 1 1 23 ARG O O 5.460 4.888 -2.895 1.00 . A A . 26 ARG O 1 1 10 4348 1 1 24 THR C C 2.839 2.551 -2.119 1.00 . A A . 27 THR C 1 1 10 4349 1 1 24 THR CA C 3.508 3.022 -3.404 1.00 . A A . 27 THR CA 1 1 10 4350 1 1 24 THR CB C 2.830 2.335 -4.608 1.00 . A A . 27 THR CB 1 1 10 4351 1 1 24 THR CG2 C 3.036 0.826 -4.573 1.00 . A A . 27 THR CG2 1 1 10 4352 1 1 24 THR H H 5.270 1.851 -3.523 1.00 . A A . 27 THR H 1 1 10 4353 1 1 24 THR HA H 3.371 4.090 -3.499 1.00 . A A . 27 THR HA 1 1 10 4354 1 1 24 THR HB H 3.269 2.722 -5.517 1.00 . A A . 27 THR HB 1 1 10 4355 1 1 24 THR HG1 H 1.204 3.119 -5.400 1.00 . A A . 27 THR HG1 1 1 10 4356 1 1 24 THR HG21 H 4.087 0.603 -4.680 1.00 . A A . 27 THR HG21 1 1 10 4357 1 1 24 THR HG22 H 2.485 0.369 -5.383 1.00 . A A . 27 THR HG22 1 1 10 4358 1 1 24 THR HG23 H 2.679 0.435 -3.632 1.00 . A A . 27 THR HG23 1 1 10 4359 1 1 24 THR N N 4.940 2.762 -3.376 1.00 . A A . 27 THR N 1 1 10 4360 1 1 24 THR O O 3.069 1.432 -1.659 1.00 . A A . 27 THR O 1 1 10 4361 1 1 24 THR OG1 O 1.429 2.623 -4.610 1.00 . A A . 27 THR OG1 1 1 10 4362 1 1 25 TYR C C -0.141 2.757 -0.588 1.00 . A A . 28 TYR C 1 1 10 4363 1 1 25 TYR CA C 1.310 3.091 -0.309 1.00 . A A . 28 TYR CA 1 1 10 4364 1 1 25 TYR CB C 1.383 4.249 0.695 1.00 . A A . 28 TYR CB 1 1 10 4365 1 1 25 TYR CD1 C 1.051 6.340 -0.684 1.00 . A A . 28 TYR CD1 1 1 10 4366 1 1 25 TYR CD2 C -0.631 5.758 0.897 1.00 . A A . 28 TYR CD2 1 1 10 4367 1 1 25 TYR CE1 C 0.328 7.458 -1.049 1.00 . A A . 28 TYR CE1 1 1 10 4368 1 1 25 TYR CE2 C -1.359 6.876 0.538 1.00 . A A . 28 TYR CE2 1 1 10 4369 1 1 25 TYR CG C 0.586 5.471 0.293 1.00 . A A . 28 TYR CG 1 1 10 4370 1 1 25 TYR CZ C -0.875 7.722 -0.436 1.00 . A A . 28 TYR CZ 1 1 10 4371 1 1 25 TYR H H 1.857 4.286 -1.964 1.00 . A A . 28 TYR H 1 1 10 4372 1 1 25 TYR HA H 1.787 2.224 0.121 1.00 . A A . 28 TYR HA 1 1 10 4373 1 1 25 TYR HB2 H 1.005 3.910 1.646 1.00 . A A . 28 TYR HB2 1 1 10 4374 1 1 25 TYR HB3 H 2.412 4.546 0.812 1.00 . A A . 28 TYR HB3 1 1 10 4375 1 1 25 TYR HD1 H 1.997 6.133 -1.162 1.00 . A A . 28 TYR HD1 1 1 10 4376 1 1 25 TYR HD2 H -1.008 5.093 1.659 1.00 . A A . 28 TYR HD2 1 1 10 4377 1 1 25 TYR HE1 H 0.710 8.121 -1.811 1.00 . A A . 28 TYR HE1 1 1 10 4378 1 1 25 TYR HE2 H -2.303 7.083 1.020 1.00 . A A . 28 TYR HE2 1 1 10 4379 1 1 25 TYR HH H -1.543 8.959 -1.746 1.00 . A A . 28 TYR HH 1 1 10 4380 1 1 25 TYR N N 2.008 3.416 -1.544 1.00 . A A . 28 TYR N 1 1 10 4381 1 1 25 TYR O O -0.698 3.162 -1.610 1.00 . A A . 28 TYR O 1 1 10 4382 1 1 25 TYR OH O -1.596 8.838 -0.796 1.00 . A A . 28 TYR OH 1 1 10 4383 1 1 26 TYR C C -3.007 2.460 1.131 1.00 . A A . 29 TYR C 1 1 10 4384 1 1 26 TYR CA C -2.127 1.619 0.222 1.00 . A A . 29 TYR CA 1 1 10 4385 1 1 26 TYR CB C -2.263 0.143 0.585 1.00 . A A . 29 TYR CB 1 1 10 4386 1 1 26 TYR CD1 C -2.184 -1.271 -1.512 1.00 . A A . 29 TYR CD1 1 1 10 4387 1 1 26 TYR CD2 C -0.229 -1.158 -0.151 1.00 . A A . 29 TYR CD2 1 1 10 4388 1 1 26 TYR CE1 C -1.526 -2.109 -2.392 1.00 . A A . 29 TYR CE1 1 1 10 4389 1 1 26 TYR CE2 C 0.435 -1.993 -1.028 1.00 . A A . 29 TYR CE2 1 1 10 4390 1 1 26 TYR CG C -1.548 -0.781 -0.377 1.00 . A A . 29 TYR CG 1 1 10 4391 1 1 26 TYR CZ C -0.217 -2.466 -2.146 1.00 . A A . 29 TYR CZ 1 1 10 4392 1 1 26 TYR H H -0.237 1.765 1.136 1.00 . A A . 29 TYR H 1 1 10 4393 1 1 26 TYR HA H -2.434 1.763 -0.804 1.00 . A A . 29 TYR HA 1 1 10 4394 1 1 26 TYR HB2 H -1.846 -0.016 1.567 1.00 . A A . 29 TYR HB2 1 1 10 4395 1 1 26 TYR HB3 H -3.306 -0.123 0.598 1.00 . A A . 29 TYR HB3 1 1 10 4396 1 1 26 TYR HD1 H -3.209 -0.989 -1.703 1.00 . A A . 29 TYR HD1 1 1 10 4397 1 1 26 TYR HD2 H 0.280 -0.786 0.726 1.00 . A A . 29 TYR HD2 1 1 10 4398 1 1 26 TYR HE1 H -2.037 -2.479 -3.269 1.00 . A A . 29 TYR HE1 1 1 10 4399 1 1 26 TYR HE2 H 1.460 -2.274 -0.835 1.00 . A A . 29 TYR HE2 1 1 10 4400 1 1 26 TYR HH H 0.283 -3.006 -3.923 1.00 . A A . 29 TYR HH 1 1 10 4401 1 1 26 TYR N N -0.743 2.029 0.341 1.00 . A A . 29 TYR N 1 1 10 4402 1 1 26 TYR O O -2.963 2.324 2.354 1.00 . A A . 29 TYR O 1 1 10 4403 1 1 26 TYR OH O 0.443 -3.298 -3.022 1.00 . A A . 29 TYR OH 1 1 10 4404 1 1 27 TYR C C -6.123 3.683 1.207 1.00 . A A . 30 TYR C 1 1 10 4405 1 1 27 TYR CA C -4.696 4.193 1.276 1.00 . A A . 30 TYR CA 1 1 10 4406 1 1 27 TYR CB C -4.614 5.624 0.738 1.00 . A A . 30 TYR CB 1 1 10 4407 1 1 27 TYR CD1 C -5.942 6.724 2.591 1.00 . A A . 30 TYR CD1 1 1 10 4408 1 1 27 TYR CD2 C -6.524 7.228 0.334 1.00 . A A . 30 TYR CD2 1 1 10 4409 1 1 27 TYR CE1 C -6.942 7.563 3.042 1.00 . A A . 30 TYR CE1 1 1 10 4410 1 1 27 TYR CE2 C -7.526 8.071 0.778 1.00 . A A . 30 TYR CE2 1 1 10 4411 1 1 27 TYR CG C -5.715 6.542 1.231 1.00 . A A . 30 TYR CG 1 1 10 4412 1 1 27 TYR CZ C -7.731 8.235 2.132 1.00 . A A . 30 TYR CZ 1 1 10 4413 1 1 27 TYR H H -3.800 3.378 -0.450 1.00 . A A . 30 TYR H 1 1 10 4414 1 1 27 TYR HA H -4.373 4.187 2.306 1.00 . A A . 30 TYR HA 1 1 10 4415 1 1 27 TYR HB2 H -3.673 6.055 1.037 1.00 . A A . 30 TYR HB2 1 1 10 4416 1 1 27 TYR HB3 H -4.662 5.595 -0.341 1.00 . A A . 30 TYR HB3 1 1 10 4417 1 1 27 TYR HD1 H -5.323 6.197 3.301 1.00 . A A . 30 TYR HD1 1 1 10 4418 1 1 27 TYR HD2 H -6.361 7.099 -0.725 1.00 . A A . 30 TYR HD2 1 1 10 4419 1 1 27 TYR HE1 H -7.103 7.691 4.102 1.00 . A A . 30 TYR HE1 1 1 10 4420 1 1 27 TYR HE2 H -8.144 8.596 0.065 1.00 . A A . 30 TYR HE2 1 1 10 4421 1 1 27 TYR HH H -9.529 8.916 2.072 1.00 . A A . 30 TYR HH 1 1 10 4422 1 1 27 TYR N N -3.808 3.324 0.527 1.00 . A A . 30 TYR N 1 1 10 4423 1 1 27 TYR O O -6.801 3.817 0.187 1.00 . A A . 30 TYR O 1 1 10 4424 1 1 27 TYR OH O -8.728 9.073 2.577 1.00 . A A . 30 TYR OH 1 1 10 4425 1 1 28 ASN C C -8.883 3.724 2.407 1.00 . A A . 31 ASN C 1 1 10 4426 1 1 28 ASN CA C -7.909 2.564 2.395 1.00 . A A . 31 ASN CA 1 1 10 4427 1 1 28 ASN CB C -8.061 1.733 3.670 1.00 . A A . 31 ASN CB 1 1 10 4428 1 1 28 ASN CG C -9.218 0.753 3.612 1.00 . A A . 31 ASN CG 1 1 10 4429 1 1 28 ASN H H -5.983 3.032 3.083 1.00 . A A . 31 ASN H 1 1 10 4430 1 1 28 ASN HA H -8.095 1.944 1.531 1.00 . A A . 31 ASN HA 1 1 10 4431 1 1 28 ASN HB2 H -7.152 1.175 3.838 1.00 . A A . 31 ASN HB2 1 1 10 4432 1 1 28 ASN HB3 H -8.223 2.402 4.505 1.00 . A A . 31 ASN HB3 1 1 10 4433 1 1 28 ASN HD21 H -10.102 1.826 2.200 1.00 . A A . 31 ASN HD21 1 1 10 4434 1 1 28 ASN HD22 H -10.944 0.407 2.697 1.00 . A A . 31 ASN HD22 1 1 10 4435 1 1 28 ASN N N -6.568 3.093 2.305 1.00 . A A . 31 ASN N 1 1 10 4436 1 1 28 ASN ND2 N -10.185 1.023 2.748 1.00 . A A . 31 ASN ND2 1 1 10 4437 1 1 28 ASN O O -9.024 4.393 3.424 1.00 . A A . 31 ASN O 1 1 10 4438 1 1 28 ASN OD1 O -9.241 -0.241 4.336 1.00 . A A . 31 ASN OD1 1 1 10 4439 1 1 29 THR C C -11.749 4.806 1.925 1.00 . A A . 32 THR C 1 1 10 4440 1 1 29 THR CA C -10.466 5.081 1.150 1.00 . A A . 32 THR CA 1 1 10 4441 1 1 29 THR CB C -10.823 5.353 -0.322 1.00 . A A . 32 THR CB 1 1 10 4442 1 1 29 THR CG2 C -9.640 5.953 -1.065 1.00 . A A . 32 THR CG2 1 1 10 4443 1 1 29 THR H H -9.334 3.420 0.483 1.00 . A A . 32 THR H 1 1 10 4444 1 1 29 THR HA H -9.998 5.967 1.552 1.00 . A A . 32 THR HA 1 1 10 4445 1 1 29 THR HB H -11.643 6.056 -0.350 1.00 . A A . 32 THR HB 1 1 10 4446 1 1 29 THR HG1 H -11.310 4.283 -1.906 1.00 . A A . 32 THR HG1 1 1 10 4447 1 1 29 THR HG21 H -8.785 5.302 -0.965 1.00 . A A . 32 THR HG21 1 1 10 4448 1 1 29 THR HG22 H -9.406 6.921 -0.647 1.00 . A A . 32 THR HG22 1 1 10 4449 1 1 29 THR HG23 H -9.889 6.063 -2.111 1.00 . A A . 32 THR HG23 1 1 10 4450 1 1 29 THR N N -9.515 3.981 1.268 1.00 . A A . 32 THR N 1 1 10 4451 1 1 29 THR O O -12.541 5.715 2.171 1.00 . A A . 32 THR O 1 1 10 4452 1 1 29 THR OG1 O -11.231 4.137 -0.961 1.00 . A A . 32 THR OG1 1 1 10 4453 1 1 30 GLU C C -12.995 3.420 4.537 1.00 . A A . 33 GLU C 1 1 10 4454 1 1 30 GLU CA C -13.142 3.160 3.044 1.00 . A A . 33 GLU CA 1 1 10 4455 1 1 30 GLU CB C -13.435 1.686 2.800 1.00 . A A . 33 GLU CB 1 1 10 4456 1 1 30 GLU CD C -15.341 2.069 1.186 1.00 . A A . 33 GLU CD 1 1 10 4457 1 1 30 GLU CG C -14.003 1.396 1.420 1.00 . A A . 33 GLU CG 1 1 10 4458 1 1 30 GLU H H -11.282 2.869 2.090 1.00 . A A . 33 GLU H 1 1 10 4459 1 1 30 GLU HA H -13.962 3.745 2.675 1.00 . A A . 33 GLU HA 1 1 10 4460 1 1 30 GLU HB2 H -12.513 1.134 2.906 1.00 . A A . 33 GLU HB2 1 1 10 4461 1 1 30 GLU HB3 H -14.143 1.341 3.539 1.00 . A A . 33 GLU HB3 1 1 10 4462 1 1 30 GLU HG2 H -13.305 1.749 0.676 1.00 . A A . 33 GLU HG2 1 1 10 4463 1 1 30 GLU HG3 H -14.129 0.329 1.316 1.00 . A A . 33 GLU HG3 1 1 10 4464 1 1 30 GLU N N -11.950 3.551 2.309 1.00 . A A . 33 GLU N 1 1 10 4465 1 1 30 GLU O O -13.884 3.995 5.166 1.00 . A A . 33 GLU O 1 1 10 4466 1 1 30 GLU OE1 O -16.380 1.446 1.496 1.00 . A A . 33 GLU OE1 1 1 10 4467 1 1 30 GLU OE2 O -15.352 3.216 0.694 1.00 . A A . 33 GLU OE2 1 1 10 4468 1 1 31 THR C C -10.699 4.371 6.777 1.00 . A A . 34 THR C 1 1 10 4469 1 1 31 THR CA C -11.623 3.180 6.522 1.00 . A A . 34 THR CA 1 1 10 4470 1 1 31 THR CB C -11.023 1.916 7.171 1.00 . A A . 34 THR CB 1 1 10 4471 1 1 31 THR CG2 C -9.569 1.733 6.771 1.00 . A A . 34 THR CG2 1 1 10 4472 1 1 31 THR H H -11.201 2.559 4.539 1.00 . A A . 34 THR H 1 1 10 4473 1 1 31 THR HA H -12.576 3.373 6.991 1.00 . A A . 34 THR HA 1 1 10 4474 1 1 31 THR HB H -11.585 1.055 6.836 1.00 . A A . 34 THR HB 1 1 10 4475 1 1 31 THR HG1 H -10.575 2.737 8.908 1.00 . A A . 34 THR HG1 1 1 10 4476 1 1 31 THR HG21 H -9.233 0.750 7.070 1.00 . A A . 34 THR HG21 1 1 10 4477 1 1 31 THR HG22 H -8.964 2.483 7.258 1.00 . A A . 34 THR HG22 1 1 10 4478 1 1 31 THR HG23 H -9.478 1.835 5.704 1.00 . A A . 34 THR HG23 1 1 10 4479 1 1 31 THR N N -11.873 2.996 5.097 1.00 . A A . 34 THR N 1 1 10 4480 1 1 31 THR O O -10.766 4.995 7.836 1.00 . A A . 34 THR O 1 1 10 4481 1 1 31 THR OG1 O -11.116 2.008 8.598 1.00 . A A . 34 THR OG1 1 1 10 4482 1 1 32 LYS C C -7.567 5.285 6.441 1.00 . A A . 35 LYS C 1 1 10 4483 1 1 32 LYS CA C -8.869 5.757 5.843 1.00 . A A . 35 LYS CA 1 1 10 4484 1 1 32 LYS CB C -9.413 6.978 6.599 1.00 . A A . 35 LYS CB 1 1 10 4485 1 1 32 LYS CD C -11.268 8.648 6.879 1.00 . A A . 35 LYS CD 1 1 10 4486 1 1 32 LYS CE C -12.597 9.153 6.339 1.00 . A A . 35 LYS CE 1 1 10 4487 1 1 32 LYS CG C -10.709 7.524 6.023 1.00 . A A . 35 LYS CG 1 1 10 4488 1 1 32 LYS H H -9.786 4.048 5.026 1.00 . A A . 35 LYS H 1 1 10 4489 1 1 32 LYS HA H -8.664 6.042 4.818 1.00 . A A . 35 LYS HA 1 1 10 4490 1 1 32 LYS HB2 H -9.588 6.705 7.628 1.00 . A A . 35 LYS HB2 1 1 10 4491 1 1 32 LYS HB3 H -8.673 7.764 6.566 1.00 . A A . 35 LYS HB3 1 1 10 4492 1 1 32 LYS HD2 H -11.414 8.281 7.885 1.00 . A A . 35 LYS HD2 1 1 10 4493 1 1 32 LYS HD3 H -10.560 9.465 6.892 1.00 . A A . 35 LYS HD3 1 1 10 4494 1 1 32 LYS HE2 H -12.446 9.524 5.336 1.00 . A A . 35 LYS HE2 1 1 10 4495 1 1 32 LYS HE3 H -13.297 8.331 6.316 1.00 . A A . 35 LYS HE3 1 1 10 4496 1 1 32 LYS HG2 H -10.519 7.903 5.029 1.00 . A A . 35 LYS HG2 1 1 10 4497 1 1 32 LYS HG3 H -11.435 6.725 5.974 1.00 . A A . 35 LYS HG3 1 1 10 4498 1 1 32 LYS HZ1 H -13.311 9.909 8.150 1.00 . A A . 35 LYS HZ1 1 1 10 4499 1 1 32 LYS HZ2 H -14.071 10.563 6.788 1.00 . A A . 35 LYS HZ2 1 1 10 4500 1 1 32 LYS HZ3 H -12.505 11.055 7.201 1.00 . A A . 35 LYS HZ3 1 1 10 4501 1 1 32 LYS N N -9.825 4.648 5.797 1.00 . A A . 35 LYS N 1 1 10 4502 1 1 32 LYS NZ N -13.160 10.246 7.178 1.00 . A A . 35 LYS NZ 1 1 10 4503 1 1 32 LYS O O -7.058 5.854 7.407 1.00 . A A . 35 LYS O 1 1 10 4504 1 1 33 GLN C C -4.723 3.687 5.208 1.00 . A A . 36 GLN C 1 1 10 4505 1 1 33 GLN CA C -5.775 3.661 6.308 1.00 . A A . 36 GLN CA 1 1 10 4506 1 1 33 GLN CB C -5.979 2.229 6.796 1.00 . A A . 36 GLN CB 1 1 10 4507 1 1 33 GLN CD C -4.135 2.440 8.514 1.00 . A A . 36 GLN CD 1 1 10 4508 1 1 33 GLN CG C -4.728 1.605 7.396 1.00 . A A . 36 GLN CG 1 1 10 4509 1 1 33 GLN H H -7.503 3.828 5.071 1.00 . A A . 36 GLN H 1 1 10 4510 1 1 33 GLN HA H -5.426 4.264 7.133 1.00 . A A . 36 GLN HA 1 1 10 4511 1 1 33 GLN HB2 H -6.755 2.222 7.547 1.00 . A A . 36 GLN HB2 1 1 10 4512 1 1 33 GLN HB3 H -6.291 1.624 5.962 1.00 . A A . 36 GLN HB3 1 1 10 4513 1 1 33 GLN HE21 H -2.979 3.404 7.215 1.00 . A A . 36 GLN HE21 1 1 10 4514 1 1 33 GLN HE22 H -2.819 3.889 8.865 1.00 . A A . 36 GLN HE22 1 1 10 4515 1 1 33 GLN HG2 H -4.979 0.631 7.789 1.00 . A A . 36 GLN HG2 1 1 10 4516 1 1 33 GLN HG3 H -3.987 1.496 6.616 1.00 . A A . 36 GLN HG3 1 1 10 4517 1 1 33 GLN N N -7.034 4.229 5.845 1.00 . A A . 36 GLN N 1 1 10 4518 1 1 33 GLN NE2 N -3.218 3.335 8.162 1.00 . A A . 36 GLN NE2 1 1 10 4519 1 1 33 GLN O O -4.715 2.843 4.314 1.00 . A A . 36 GLN O 1 1 10 4520 1 1 33 GLN OE1 O -4.496 2.281 9.680 1.00 . A A . 36 GLN OE1 1 1 10 4521 1 1 34 SER C C -1.413 4.314 4.917 1.00 . A A . 37 SER C 1 1 10 4522 1 1 34 SER CA C -2.742 4.802 4.339 1.00 . A A . 37 SER CA 1 1 10 4523 1 1 34 SER CB C -2.615 6.268 3.919 1.00 . A A . 37 SER CB 1 1 10 4524 1 1 34 SER H H -3.899 5.282 6.049 1.00 . A A . 37 SER H 1 1 10 4525 1 1 34 SER HA H -2.991 4.211 3.473 1.00 . A A . 37 SER HA 1 1 10 4526 1 1 34 SER HB2 H -1.768 6.380 3.258 1.00 . A A . 37 SER HB2 1 1 10 4527 1 1 34 SER HB3 H -3.514 6.573 3.405 1.00 . A A . 37 SER HB3 1 1 10 4528 1 1 34 SER HG H -3.250 7.176 5.534 1.00 . A A . 37 SER HG 1 1 10 4529 1 1 34 SER N N -3.821 4.647 5.310 1.00 . A A . 37 SER N 1 1 10 4530 1 1 34 SER O O -0.854 4.942 5.817 1.00 . A A . 37 SER O 1 1 10 4531 1 1 34 SER OG O -2.427 7.107 5.044 1.00 . A A . 37 SER OG 1 1 10 4532 1 1 35 THR C C 0.889 1.576 3.918 1.00 . A A . 38 THR C 1 1 10 4533 1 1 35 THR CA C 0.354 2.631 4.881 1.00 . A A . 38 THR CA 1 1 10 4534 1 1 35 THR CB C 0.188 1.995 6.275 1.00 . A A . 38 THR CB 1 1 10 4535 1 1 35 THR CG2 C -0.851 0.884 6.248 1.00 . A A . 38 THR CG2 1 1 10 4536 1 1 35 THR H H -1.398 2.728 3.681 1.00 . A A . 38 THR H 1 1 10 4537 1 1 35 THR HA H 1.071 3.435 4.955 1.00 . A A . 38 THR HA 1 1 10 4538 1 1 35 THR HB H -0.142 2.757 6.964 1.00 . A A . 38 THR HB 1 1 10 4539 1 1 35 THR HG1 H 1.286 0.771 7.366 1.00 . A A . 38 THR HG1 1 1 10 4540 1 1 35 THR HG21 H -0.936 0.447 7.231 1.00 . A A . 38 THR HG21 1 1 10 4541 1 1 35 THR HG22 H -0.547 0.125 5.542 1.00 . A A . 38 THR HG22 1 1 10 4542 1 1 35 THR HG23 H -1.806 1.292 5.950 1.00 . A A . 38 THR HG23 1 1 10 4543 1 1 35 THR N N -0.909 3.193 4.399 1.00 . A A . 38 THR N 1 1 10 4544 1 1 35 THR O O 0.178 1.141 3.013 1.00 . A A . 38 THR O 1 1 10 4545 1 1 35 THR OG1 O 1.443 1.470 6.727 1.00 . A A . 38 THR OG1 1 1 10 4546 1 1 36 TRP C C 2.681 -1.203 3.972 1.00 . A A . 39 TRP C 1 1 10 4547 1 1 36 TRP CA C 2.728 0.140 3.253 1.00 . A A . 39 TRP CA 1 1 10 4548 1 1 36 TRP CB C 4.199 0.439 2.915 1.00 . A A . 39 TRP CB 1 1 10 4549 1 1 36 TRP CD1 C 5.062 2.417 4.242 1.00 . A A . 39 TRP CD1 1 1 10 4550 1 1 36 TRP CD2 C 4.763 2.843 2.072 1.00 . A A . 39 TRP CD2 1 1 10 4551 1 1 36 TRP CE2 C 5.252 4.006 2.690 1.00 . A A . 39 TRP CE2 1 1 10 4552 1 1 36 TRP CE3 C 4.500 2.868 0.702 1.00 . A A . 39 TRP CE3 1 1 10 4553 1 1 36 TRP CG C 4.639 1.849 3.087 1.00 . A A . 39 TRP CG 1 1 10 4554 1 1 36 TRP CH2 C 5.224 5.176 0.643 1.00 . A A . 39 TRP CH2 1 1 10 4555 1 1 36 TRP CZ2 C 5.487 5.179 1.984 1.00 . A A . 39 TRP CZ2 1 1 10 4556 1 1 36 TRP CZ3 C 4.734 4.035 0.002 1.00 . A A . 39 TRP CZ3 1 1 10 4557 1 1 36 TRP H H 2.677 1.549 4.838 1.00 . A A . 39 TRP H 1 1 10 4558 1 1 36 TRP HA H 2.150 0.085 2.340 1.00 . A A . 39 TRP HA 1 1 10 4559 1 1 36 TRP HB2 H 4.824 -0.153 3.564 1.00 . A A . 39 TRP HB2 1 1 10 4560 1 1 36 TRP HB3 H 4.388 0.159 1.889 1.00 . A A . 39 TRP HB3 1 1 10 4561 1 1 36 TRP HD1 H 5.093 1.899 5.186 1.00 . A A . 39 TRP HD1 1 1 10 4562 1 1 36 TRP HE1 H 5.771 4.347 4.692 1.00 . A A . 39 TRP HE1 1 1 10 4563 1 1 36 TRP HE3 H 4.121 1.995 0.191 1.00 . A A . 39 TRP HE3 1 1 10 4564 1 1 36 TRP HH2 H 5.392 6.066 0.056 1.00 . A A . 39 TRP HH2 1 1 10 4565 1 1 36 TRP HZ2 H 5.866 6.062 2.463 1.00 . A A . 39 TRP HZ2 1 1 10 4566 1 1 36 TRP HZ3 H 4.538 4.072 -1.058 1.00 . A A . 39 TRP HZ3 1 1 10 4567 1 1 36 TRP N N 2.143 1.162 4.112 1.00 . A A . 39 TRP N 1 1 10 4568 1 1 36 TRP NE1 N 5.432 3.722 4.017 1.00 . A A . 39 TRP NE1 1 1 10 4569 1 1 36 TRP O O 3.508 -1.478 4.844 1.00 . A A . 39 TRP O 1 1 10 4570 1 1 37 GLU C C 0.580 -4.197 3.430 1.00 . A A . 40 GLU C 1 1 10 4571 1 1 37 GLU CA C 1.564 -3.346 4.224 1.00 . A A . 40 GLU CA 1 1 10 4572 1 1 37 GLU CB C 1.101 -3.194 5.680 1.00 . A A . 40 GLU CB 1 1 10 4573 1 1 37 GLU CD C -0.811 -3.230 7.330 1.00 . A A . 40 GLU CD 1 1 10 4574 1 1 37 GLU CG C -0.363 -3.537 5.915 1.00 . A A . 40 GLU CG 1 1 10 4575 1 1 37 GLU H H 1.082 -1.767 2.906 1.00 . A A . 40 GLU H 1 1 10 4576 1 1 37 GLU HA H 2.530 -3.830 4.210 1.00 . A A . 40 GLU HA 1 1 10 4577 1 1 37 GLU HB2 H 1.702 -3.839 6.304 1.00 . A A . 40 GLU HB2 1 1 10 4578 1 1 37 GLU HB3 H 1.259 -2.169 5.985 1.00 . A A . 40 GLU HB3 1 1 10 4579 1 1 37 GLU HG2 H -0.969 -2.964 5.230 1.00 . A A . 40 GLU HG2 1 1 10 4580 1 1 37 GLU HG3 H -0.507 -4.590 5.728 1.00 . A A . 40 GLU HG3 1 1 10 4581 1 1 37 GLU N N 1.712 -2.037 3.607 1.00 . A A . 40 GLU N 1 1 10 4582 1 1 37 GLU O O -0.153 -3.682 2.587 1.00 . A A . 40 GLU O 1 1 10 4583 1 1 37 GLU OE1 O -0.692 -4.122 8.197 1.00 . A A . 40 GLU OE1 1 1 10 4584 1 1 37 GLU OE2 O -1.280 -2.098 7.572 1.00 . A A . 40 GLU OE2 1 1 10 4585 1 1 38 LYS C C -1.773 -6.108 3.436 1.00 . A A . 41 LYS C 1 1 10 4586 1 1 38 LYS CA C -0.327 -6.409 3.036 1.00 . A A . 41 LYS CA 1 1 10 4587 1 1 38 LYS CB C 0.034 -7.836 3.433 1.00 . A A . 41 LYS CB 1 1 10 4588 1 1 38 LYS CD C 2.085 -7.941 4.892 1.00 . A A . 41 LYS CD 1 1 10 4589 1 1 38 LYS CE C 2.684 -9.196 4.275 1.00 . A A . 41 LYS CE 1 1 10 4590 1 1 38 LYS CG C 0.565 -7.966 4.847 1.00 . A A . 41 LYS CG 1 1 10 4591 1 1 38 LYS H H 1.180 -5.852 4.371 1.00 . A A . 41 LYS H 1 1 10 4592 1 1 38 LYS HA H -0.212 -6.291 1.970 1.00 . A A . 41 LYS HA 1 1 10 4593 1 1 38 LYS HB2 H -0.844 -8.428 3.367 1.00 . A A . 41 LYS HB2 1 1 10 4594 1 1 38 LYS HB3 H 0.778 -8.217 2.751 1.00 . A A . 41 LYS HB3 1 1 10 4595 1 1 38 LYS HD2 H 2.437 -7.079 4.343 1.00 . A A . 41 LYS HD2 1 1 10 4596 1 1 38 LYS HD3 H 2.403 -7.870 5.922 1.00 . A A . 41 LYS HD3 1 1 10 4597 1 1 38 LYS HE2 H 2.358 -9.265 3.248 1.00 . A A . 41 LYS HE2 1 1 10 4598 1 1 38 LYS HE3 H 3.761 -9.118 4.306 1.00 . A A . 41 LYS HE3 1 1 10 4599 1 1 38 LYS HG2 H 0.183 -7.147 5.429 1.00 . A A . 41 LYS HG2 1 1 10 4600 1 1 38 LYS HG3 H 0.215 -8.897 5.266 1.00 . A A . 41 LYS HG3 1 1 10 4601 1 1 38 LYS HZ1 H 1.227 -10.518 4.979 1.00 . A A . 41 LYS HZ1 1 1 10 4602 1 1 38 LYS HZ2 H 2.577 -10.385 5.989 1.00 . A A . 41 LYS HZ2 1 1 10 4603 1 1 38 LYS HZ3 H 2.684 -11.267 4.550 1.00 . A A . 41 LYS HZ3 1 1 10 4604 1 1 38 LYS N N 0.571 -5.495 3.700 1.00 . A A . 41 LYS N 1 1 10 4605 1 1 38 LYS NZ N 2.264 -10.427 4.999 1.00 . A A . 41 LYS NZ 1 1 10 4606 1 1 38 LYS O O -2.172 -6.390 4.565 1.00 . A A . 41 LYS O 1 1 10 4607 1 1 39 PRO C C -4.902 -6.394 2.641 1.00 . A A . 42 PRO C 1 1 10 4608 1 1 39 PRO CA C -3.972 -5.197 2.817 1.00 . A A . 42 PRO CA 1 1 10 4609 1 1 39 PRO CB C -4.307 -4.096 1.797 1.00 . A A . 42 PRO CB 1 1 10 4610 1 1 39 PRO CD C -2.235 -5.166 1.151 1.00 . A A . 42 PRO CD 1 1 10 4611 1 1 39 PRO CG C -3.116 -3.972 0.894 1.00 . A A . 42 PRO CG 1 1 10 4612 1 1 39 PRO HA H -4.076 -4.804 3.817 1.00 . A A . 42 PRO HA 1 1 10 4613 1 1 39 PRO HB2 H -5.189 -4.378 1.241 1.00 . A A . 42 PRO HB2 1 1 10 4614 1 1 39 PRO HB3 H -4.495 -3.171 2.322 1.00 . A A . 42 PRO HB3 1 1 10 4615 1 1 39 PRO HD2 H -2.470 -5.965 0.464 1.00 . A A . 42 PRO HD2 1 1 10 4616 1 1 39 PRO HD3 H -1.194 -4.892 1.075 1.00 . A A . 42 PRO HD3 1 1 10 4617 1 1 39 PRO HG2 H -3.443 -3.966 -0.134 1.00 . A A . 42 PRO HG2 1 1 10 4618 1 1 39 PRO HG3 H -2.583 -3.060 1.120 1.00 . A A . 42 PRO HG3 1 1 10 4619 1 1 39 PRO N N -2.584 -5.532 2.525 1.00 . A A . 42 PRO N 1 1 10 4620 1 1 39 PRO O O -5.992 -6.271 2.083 1.00 . A A . 42 PRO O 1 1 11 4621 1 1 12 SER C C -10.480 -1.498 -2.904 1.00 . A A . 15 SER C 1 1 11 4622 1 1 12 SER CA C -10.282 -2.746 -3.755 1.00 . A A . 15 SER CA 1 1 11 4623 1 1 12 SER CB C -11.499 -3.657 -3.632 1.00 . A A . 15 SER CB 1 1 11 4624 1 1 12 SER H H -8.702 -3.268 -2.457 1.00 . A A . 15 SER H 1 1 11 4625 1 1 12 SER HA H -10.158 -2.454 -4.787 1.00 . A A . 15 SER HA 1 1 11 4626 1 1 12 SER HB2 H -11.379 -4.505 -4.289 1.00 . A A . 15 SER HB2 1 1 11 4627 1 1 12 SER HB3 H -11.580 -4.001 -2.612 1.00 . A A . 15 SER HB3 1 1 11 4628 1 1 12 SER HG H -13.156 -2.709 -3.186 1.00 . A A . 15 SER HG 1 1 11 4629 1 1 12 SER N N -9.085 -3.460 -3.337 1.00 . A A . 15 SER N 1 1 11 4630 1 1 12 SER O O -10.387 -0.374 -3.397 1.00 . A A . 15 SER O 1 1 11 4631 1 1 12 SER OG O -12.691 -2.974 -3.984 1.00 . A A . 15 SER OG 1 1 11 4632 1 1 13 MET C C -9.644 0.141 -0.462 1.00 . A A . 16 MET C 1 1 11 4633 1 1 13 MET CA C -10.953 -0.607 -0.690 1.00 . A A . 16 MET CA 1 1 11 4634 1 1 13 MET CB C -11.493 -1.132 0.644 1.00 . A A . 16 MET CB 1 1 11 4635 1 1 13 MET CE C -13.451 -1.231 3.137 1.00 . A A . 16 MET CE 1 1 11 4636 1 1 13 MET CG C -12.805 -1.891 0.515 1.00 . A A . 16 MET CG 1 1 11 4637 1 1 13 MET H H -10.821 -2.630 -1.292 1.00 . A A . 16 MET H 1 1 11 4638 1 1 13 MET HA H -11.674 0.072 -1.121 1.00 . A A . 16 MET HA 1 1 11 4639 1 1 13 MET HB2 H -10.761 -1.794 1.081 1.00 . A A . 16 MET HB2 1 1 11 4640 1 1 13 MET HB3 H -11.653 -0.296 1.306 1.00 . A A . 16 MET HB3 1 1 11 4641 1 1 13 MET HE1 H -12.463 -0.852 3.353 1.00 . A A . 16 MET HE1 1 1 11 4642 1 1 13 MET HE2 H -13.936 -1.516 4.060 1.00 . A A . 16 MET HE2 1 1 11 4643 1 1 13 MET HE3 H -14.031 -0.465 2.647 1.00 . A A . 16 MET HE3 1 1 11 4644 1 1 13 MET HG2 H -13.574 -1.203 0.198 1.00 . A A . 16 MET HG2 1 1 11 4645 1 1 13 MET HG3 H -12.686 -2.663 -0.232 1.00 . A A . 16 MET HG3 1 1 11 4646 1 1 13 MET N N -10.752 -1.709 -1.620 1.00 . A A . 16 MET N 1 1 11 4647 1 1 13 MET O O -9.633 1.233 0.107 1.00 . A A . 16 MET O 1 1 11 4648 1 1 13 MET SD S -13.321 -2.661 2.064 1.00 . A A . 16 MET SD 1 1 11 4649 1 1 14 TRP C C -6.684 0.642 -2.098 1.00 . A A . 17 TRP C 1 1 11 4650 1 1 14 TRP CA C -7.226 0.153 -0.760 1.00 . A A . 17 TRP CA 1 1 11 4651 1 1 14 TRP CB C -6.234 -0.844 -0.157 1.00 . A A . 17 TRP CB 1 1 11 4652 1 1 14 TRP CD1 C -7.712 -2.287 1.362 1.00 . A A . 17 TRP CD1 1 1 11 4653 1 1 14 TRP CD2 C -6.069 -1.197 2.414 1.00 . A A . 17 TRP CD2 1 1 11 4654 1 1 14 TRP CE2 C -6.788 -1.940 3.364 1.00 . A A . 17 TRP CE2 1 1 11 4655 1 1 14 TRP CE3 C -4.985 -0.429 2.833 1.00 . A A . 17 TRP CE3 1 1 11 4656 1 1 14 TRP CG C -6.675 -1.426 1.146 1.00 . A A . 17 TRP CG 1 1 11 4657 1 1 14 TRP CH2 C -5.385 -1.175 5.101 1.00 . A A . 17 TRP CH2 1 1 11 4658 1 1 14 TRP CZ2 C -6.455 -1.937 4.715 1.00 . A A . 17 TRP CZ2 1 1 11 4659 1 1 14 TRP CZ3 C -4.653 -0.425 4.171 1.00 . A A . 17 TRP CZ3 1 1 11 4660 1 1 14 TRP H H -8.619 -1.322 -1.363 1.00 . A A . 17 TRP H 1 1 11 4661 1 1 14 TRP HA H -7.325 0.996 -0.095 1.00 . A A . 17 TRP HA 1 1 11 4662 1 1 14 TRP HB2 H -6.080 -1.656 -0.845 1.00 . A A . 17 TRP HB2 1 1 11 4663 1 1 14 TRP HB3 H -5.292 -0.338 0.011 1.00 . A A . 17 TRP HB3 1 1 11 4664 1 1 14 TRP HD1 H -8.370 -2.657 0.589 1.00 . A A . 17 TRP HD1 1 1 11 4665 1 1 14 TRP HE1 H -8.446 -3.196 3.105 1.00 . A A . 17 TRP HE1 1 1 11 4666 1 1 14 TRP HE3 H -4.408 0.154 2.128 1.00 . A A . 17 TRP HE3 1 1 11 4667 1 1 14 TRP HH2 H -5.090 -1.142 6.140 1.00 . A A . 17 TRP HH2 1 1 11 4668 1 1 14 TRP HZ2 H -7.012 -2.509 5.443 1.00 . A A . 17 TRP HZ2 1 1 11 4669 1 1 14 TRP HZ3 H -3.817 0.162 4.510 1.00 . A A . 17 TRP HZ3 1 1 11 4670 1 1 14 TRP N N -8.542 -0.454 -0.915 1.00 . A A . 17 TRP N 1 1 11 4671 1 1 14 TRP NE1 N -7.787 -2.599 2.697 1.00 . A A . 17 TRP NE1 1 1 11 4672 1 1 14 TRP O O -6.555 -0.130 -3.047 1.00 . A A . 17 TRP O 1 1 11 4673 1 1 15 THR C C -4.325 2.761 -3.197 1.00 . A A . 18 THR C 1 1 11 4674 1 1 15 THR CA C -5.820 2.518 -3.372 1.00 . A A . 18 THR CA 1 1 11 4675 1 1 15 THR CB C -6.512 3.850 -3.716 1.00 . A A . 18 THR CB 1 1 11 4676 1 1 15 THR CG2 C -7.926 3.612 -4.228 1.00 . A A . 18 THR CG2 1 1 11 4677 1 1 15 THR H H -6.514 2.500 -1.382 1.00 . A A . 18 THR H 1 1 11 4678 1 1 15 THR HA H -5.978 1.825 -4.184 1.00 . A A . 18 THR HA 1 1 11 4679 1 1 15 THR HB H -5.944 4.339 -4.490 1.00 . A A . 18 THR HB 1 1 11 4680 1 1 15 THR HG1 H -7.078 4.281 -1.877 1.00 . A A . 18 THR HG1 1 1 11 4681 1 1 15 THR HG21 H -8.395 4.561 -4.440 1.00 . A A . 18 THR HG21 1 1 11 4682 1 1 15 THR HG22 H -8.496 3.087 -3.476 1.00 . A A . 18 THR HG22 1 1 11 4683 1 1 15 THR HG23 H -7.887 3.019 -5.130 1.00 . A A . 18 THR HG23 1 1 11 4684 1 1 15 THR N N -6.370 1.930 -2.164 1.00 . A A . 18 THR N 1 1 11 4685 1 1 15 THR O O -3.919 3.573 -2.369 1.00 . A A . 18 THR O 1 1 11 4686 1 1 15 THR OG1 O -6.551 4.697 -2.562 1.00 . A A . 18 THR OG1 1 1 11 4687 1 1 16 GLU C C -1.483 3.128 -4.958 1.00 . A A . 19 GLU C 1 1 11 4688 1 1 16 GLU CA C -2.063 2.219 -3.877 1.00 . A A . 19 GLU CA 1 1 11 4689 1 1 16 GLU CB C -1.383 0.846 -3.924 1.00 . A A . 19 GLU CB 1 1 11 4690 1 1 16 GLU CD C -0.920 -1.236 -5.279 1.00 . A A . 19 GLU CD 1 1 11 4691 1 1 16 GLU CG C -1.347 0.218 -5.309 1.00 . A A . 19 GLU CG 1 1 11 4692 1 1 16 GLU H H -3.879 1.434 -4.625 1.00 . A A . 19 GLU H 1 1 11 4693 1 1 16 GLU HA H -1.866 2.665 -2.919 1.00 . A A . 19 GLU HA 1 1 11 4694 1 1 16 GLU HB2 H -0.367 0.950 -3.574 1.00 . A A . 19 GLU HB2 1 1 11 4695 1 1 16 GLU HB3 H -1.914 0.176 -3.265 1.00 . A A . 19 GLU HB3 1 1 11 4696 1 1 16 GLU HG2 H -2.332 0.280 -5.746 1.00 . A A . 19 GLU HG2 1 1 11 4697 1 1 16 GLU HG3 H -0.646 0.771 -5.920 1.00 . A A . 19 GLU HG3 1 1 11 4698 1 1 16 GLU N N -3.508 2.073 -3.989 1.00 . A A . 19 GLU N 1 1 11 4699 1 1 16 GLU O O -1.790 2.993 -6.143 1.00 . A A . 19 GLU O 1 1 11 4700 1 1 16 GLU OE1 O 0.301 -1.497 -5.292 1.00 . A A . 19 GLU OE1 1 1 11 4701 1 1 16 GLU OE2 O -1.807 -2.114 -5.241 1.00 . A A . 19 GLU OE2 1 1 11 4702 1 1 17 HIS C C 1.358 5.435 -4.800 1.00 . A A . 20 HIS C 1 1 11 4703 1 1 17 HIS CA C 0.017 5.019 -5.401 1.00 . A A . 20 HIS CA 1 1 11 4704 1 1 17 HIS CB C -0.857 6.264 -5.603 1.00 . A A . 20 HIS CB 1 1 11 4705 1 1 17 HIS CD2 C -3.382 5.791 -5.227 1.00 . A A . 20 HIS CD2 1 1 11 4706 1 1 17 HIS CE1 C -3.978 5.553 -7.324 1.00 . A A . 20 HIS CE1 1 1 11 4707 1 1 17 HIS CG C -2.273 5.964 -5.989 1.00 . A A . 20 HIS CG 1 1 11 4708 1 1 17 HIS H H -0.438 4.097 -3.557 1.00 . A A . 20 HIS H 1 1 11 4709 1 1 17 HIS HA H 0.187 4.540 -6.352 1.00 . A A . 20 HIS HA 1 1 11 4710 1 1 17 HIS HB2 H -0.879 6.831 -4.685 1.00 . A A . 20 HIS HB2 1 1 11 4711 1 1 17 HIS HB3 H -0.422 6.874 -6.383 1.00 . A A . 20 HIS HB3 1 1 11 4712 1 1 17 HIS HD1 H -2.107 5.877 -8.088 1.00 . A A . 20 HIS HD1 1 1 11 4713 1 1 17 HIS HD2 H -3.434 5.843 -4.147 1.00 . A A . 20 HIS HD2 1 1 11 4714 1 1 17 HIS HE1 H -4.570 5.382 -8.212 1.00 . A A . 20 HIS HE1 1 1 11 4715 1 1 17 HIS HE2 H -5.359 5.400 -5.819 1.00 . A A . 20 HIS HE2 1 1 11 4716 1 1 17 HIS N N -0.638 4.060 -4.516 1.00 . A A . 20 HIS N 1 1 11 4717 1 1 17 HIS ND1 N -2.681 5.808 -7.298 1.00 . A A . 20 HIS ND1 1 1 11 4718 1 1 17 HIS NE2 N -4.425 5.537 -6.083 1.00 . A A . 20 HIS NE2 1 1 11 4719 1 1 17 HIS O O 1.592 5.236 -3.608 1.00 . A A . 20 HIS O 1 1 11 4720 1 1 18 LYS C C 3.454 7.247 -3.866 1.00 . A A . 21 LYS C 1 1 11 4721 1 1 18 LYS CA C 3.546 6.450 -5.160 1.00 . A A . 21 LYS CA 1 1 11 4722 1 1 18 LYS CB C 4.225 7.281 -6.240 1.00 . A A . 21 LYS CB 1 1 11 4723 1 1 18 LYS CD C 3.434 7.085 -8.612 1.00 . A A . 21 LYS CD 1 1 11 4724 1 1 18 LYS CE C 3.542 6.296 -9.908 1.00 . A A . 21 LYS CE 1 1 11 4725 1 1 18 LYS CG C 4.360 6.527 -7.543 1.00 . A A . 21 LYS CG 1 1 11 4726 1 1 18 LYS H H 2.006 6.113 -6.571 1.00 . A A . 21 LYS H 1 1 11 4727 1 1 18 LYS HA H 4.142 5.569 -4.977 1.00 . A A . 21 LYS HA 1 1 11 4728 1 1 18 LYS HB2 H 3.643 8.174 -6.418 1.00 . A A . 21 LYS HB2 1 1 11 4729 1 1 18 LYS HB3 H 5.212 7.561 -5.903 1.00 . A A . 21 LYS HB3 1 1 11 4730 1 1 18 LYS HD2 H 2.417 7.034 -8.255 1.00 . A A . 21 LYS HD2 1 1 11 4731 1 1 18 LYS HD3 H 3.702 8.113 -8.804 1.00 . A A . 21 LYS HD3 1 1 11 4732 1 1 18 LYS HE2 H 3.252 5.273 -9.717 1.00 . A A . 21 LYS HE2 1 1 11 4733 1 1 18 LYS HE3 H 2.870 6.729 -10.634 1.00 . A A . 21 LYS HE3 1 1 11 4734 1 1 18 LYS HG2 H 5.381 6.594 -7.887 1.00 . A A . 21 LYS HG2 1 1 11 4735 1 1 18 LYS HG3 H 4.101 5.494 -7.356 1.00 . A A . 21 LYS HG3 1 1 11 4736 1 1 18 LYS HZ1 H 4.965 5.773 -11.344 1.00 . A A . 21 LYS HZ1 1 1 11 4737 1 1 18 LYS HZ2 H 5.585 5.886 -9.775 1.00 . A A . 21 LYS HZ2 1 1 11 4738 1 1 18 LYS HZ3 H 5.224 7.291 -10.644 1.00 . A A . 21 LYS HZ3 1 1 11 4739 1 1 18 LYS N N 2.235 6.005 -5.623 1.00 . A A . 21 LYS N 1 1 11 4740 1 1 18 LYS NZ N 4.926 6.313 -10.456 1.00 . A A . 21 LYS NZ 1 1 11 4741 1 1 18 LYS O O 2.422 7.842 -3.554 1.00 . A A . 21 LYS O 1 1 11 4742 1 1 19 SER C C 6.080 7.983 -1.348 1.00 . A A . 22 SER C 1 1 11 4743 1 1 19 SER CA C 4.630 7.951 -1.849 1.00 . A A . 22 SER CA 1 1 11 4744 1 1 19 SER CB C 3.709 7.265 -0.837 1.00 . A A . 22 SER CB 1 1 11 4745 1 1 19 SER H H 5.340 6.760 -3.440 1.00 . A A . 22 SER H 1 1 11 4746 1 1 19 SER HA H 4.292 8.965 -2.006 1.00 . A A . 22 SER HA 1 1 11 4747 1 1 19 SER HB2 H 3.620 6.219 -1.088 1.00 . A A . 22 SER HB2 1 1 11 4748 1 1 19 SER HB3 H 4.125 7.363 0.153 1.00 . A A . 22 SER HB3 1 1 11 4749 1 1 19 SER HG H 2.497 8.803 -0.842 1.00 . A A . 22 SER HG 1 1 11 4750 1 1 19 SER N N 4.553 7.251 -3.122 1.00 . A A . 22 SER N 1 1 11 4751 1 1 19 SER O O 6.952 7.364 -1.964 1.00 . A A . 22 SER O 1 1 11 4752 1 1 19 SER OG O 2.418 7.846 -0.853 1.00 . A A . 22 SER OG 1 1 11 4753 1 1 20 PRO C C 8.553 7.551 0.174 1.00 . A A . 23 PRO C 1 1 11 4754 1 1 20 PRO CA C 7.715 8.820 0.324 1.00 . A A . 23 PRO CA 1 1 11 4755 1 1 20 PRO CB C 7.438 9.106 1.794 1.00 . A A . 23 PRO CB 1 1 11 4756 1 1 20 PRO CD C 5.395 9.486 0.569 1.00 . A A . 23 PRO CD 1 1 11 4757 1 1 20 PRO CG C 6.181 9.910 1.789 1.00 . A A . 23 PRO CG 1 1 11 4758 1 1 20 PRO HA H 8.251 9.652 -0.107 1.00 . A A . 23 PRO HA 1 1 11 4759 1 1 20 PRO HB2 H 7.312 8.175 2.328 1.00 . A A . 23 PRO HB2 1 1 11 4760 1 1 20 PRO HB3 H 8.259 9.664 2.218 1.00 . A A . 23 PRO HB3 1 1 11 4761 1 1 20 PRO HD2 H 4.560 8.869 0.863 1.00 . A A . 23 PRO HD2 1 1 11 4762 1 1 20 PRO HD3 H 5.048 10.350 0.024 1.00 . A A . 23 PRO HD3 1 1 11 4763 1 1 20 PRO HG2 H 5.615 9.704 2.686 1.00 . A A . 23 PRO HG2 1 1 11 4764 1 1 20 PRO HG3 H 6.421 10.962 1.731 1.00 . A A . 23 PRO HG3 1 1 11 4765 1 1 20 PRO N N 6.364 8.709 -0.236 1.00 . A A . 23 PRO N 1 1 11 4766 1 1 20 PRO O O 8.021 6.442 0.110 1.00 . A A . 23 PRO O 1 1 11 4767 1 1 21 ASP C C 10.764 6.046 -1.429 1.00 . A A . 24 ASP C 1 1 11 4768 1 1 21 ASP CA C 10.820 6.633 -0.021 1.00 . A A . 24 ASP CA 1 1 11 4769 1 1 21 ASP CB C 10.552 5.542 1.020 1.00 . A A . 24 ASP CB 1 1 11 4770 1 1 21 ASP CG C 11.726 4.596 1.182 1.00 . A A . 24 ASP CG 1 1 11 4771 1 1 21 ASP H H 10.222 8.652 0.188 1.00 . A A . 24 ASP H 1 1 11 4772 1 1 21 ASP HA H 11.810 7.033 0.143 1.00 . A A . 24 ASP HA 1 1 11 4773 1 1 21 ASP HB2 H 10.353 6.006 1.976 1.00 . A A . 24 ASP HB2 1 1 11 4774 1 1 21 ASP HB3 H 9.689 4.969 0.717 1.00 . A A . 24 ASP HB3 1 1 11 4775 1 1 21 ASP N N 9.872 7.738 0.125 1.00 . A A . 24 ASP N 1 1 11 4776 1 1 21 ASP O O 11.381 5.019 -1.710 1.00 . A A . 24 ASP O 1 1 11 4777 1 1 21 ASP OD1 O 12.623 4.898 1.998 1.00 . A A . 24 ASP OD1 1 1 11 4778 1 1 21 ASP OD2 O 11.750 3.553 0.496 1.00 . A A . 24 ASP OD2 1 1 11 4779 1 1 22 GLY C C 9.260 4.887 -3.793 1.00 . A A . 25 GLY C 1 1 11 4780 1 1 22 GLY CA C 9.901 6.253 -3.683 1.00 . A A . 25 GLY CA 1 1 11 4781 1 1 22 GLY H H 9.549 7.517 -2.028 1.00 . A A . 25 GLY H 1 1 11 4782 1 1 22 GLY HA2 H 9.295 6.961 -4.235 1.00 . A A . 25 GLY HA2 1 1 11 4783 1 1 22 GLY HA3 H 10.883 6.218 -4.120 1.00 . A A . 25 GLY HA3 1 1 11 4784 1 1 22 GLY N N 10.021 6.711 -2.311 1.00 . A A . 25 GLY N 1 1 11 4785 1 1 22 GLY O O 9.771 4.003 -4.480 1.00 . A A . 25 GLY O 1 1 11 4786 1 1 23 ARG C C 5.907 3.758 -3.093 1.00 . A A . 26 ARG C 1 1 11 4787 1 1 23 ARG CA C 7.397 3.468 -3.136 1.00 . A A . 26 ARG CA 1 1 11 4788 1 1 23 ARG CB C 7.816 2.542 -1.988 1.00 . A A . 26 ARG CB 1 1 11 4789 1 1 23 ARG CD C 8.958 2.358 0.226 1.00 . A A . 26 ARG CD 1 1 11 4790 1 1 23 ARG CG C 8.139 3.248 -0.690 1.00 . A A . 26 ARG CG 1 1 11 4791 1 1 23 ARG CZ C 8.913 -0.007 0.901 1.00 . A A . 26 ARG CZ 1 1 11 4792 1 1 23 ARG H H 7.784 5.471 -2.583 1.00 . A A . 26 ARG H 1 1 11 4793 1 1 23 ARG HA H 7.620 2.982 -4.076 1.00 . A A . 26 ARG HA 1 1 11 4794 1 1 23 ARG HB2 H 7.018 1.841 -1.798 1.00 . A A . 26 ARG HB2 1 1 11 4795 1 1 23 ARG HB3 H 8.693 1.994 -2.293 1.00 . A A . 26 ARG HB3 1 1 11 4796 1 1 23 ARG HD2 H 9.906 2.151 -0.246 1.00 . A A . 26 ARG HD2 1 1 11 4797 1 1 23 ARG HD3 H 9.124 2.881 1.153 1.00 . A A . 26 ARG HD3 1 1 11 4798 1 1 23 ARG HE H 7.309 1.067 0.402 1.00 . A A . 26 ARG HE 1 1 11 4799 1 1 23 ARG HG2 H 8.700 4.139 -0.910 1.00 . A A . 26 ARG HG2 1 1 11 4800 1 1 23 ARG HG3 H 7.221 3.508 -0.189 1.00 . A A . 26 ARG HG3 1 1 11 4801 1 1 23 ARG HH11 H 10.753 0.829 0.867 1.00 . A A . 26 ARG HH11 1 1 11 4802 1 1 23 ARG HH12 H 10.703 -0.835 1.346 1.00 . A A . 26 ARG HH12 1 1 11 4803 1 1 23 ARG HH21 H 7.232 -1.123 1.031 1.00 . A A . 26 ARG HH21 1 1 11 4804 1 1 23 ARG HH22 H 8.702 -1.945 1.439 1.00 . A A . 26 ARG HH22 1 1 11 4805 1 1 23 ARG N N 8.136 4.722 -3.112 1.00 . A A . 26 ARG N 1 1 11 4806 1 1 23 ARG NE N 8.282 1.095 0.509 1.00 . A A . 26 ARG NE 1 1 11 4807 1 1 23 ARG NH1 N 10.231 -0.004 1.050 1.00 . A A . 26 ARG NH1 1 1 11 4808 1 1 23 ARG NH2 N 8.226 -1.116 1.144 1.00 . A A . 26 ARG NH2 1 1 11 4809 1 1 23 ARG O O 5.501 4.881 -2.802 1.00 . A A . 26 ARG O 1 1 11 4810 1 1 24 THR C C 2.970 2.409 -2.150 1.00 . A A . 27 THR C 1 1 11 4811 1 1 24 THR CA C 3.649 2.953 -3.401 1.00 . A A . 27 THR CA 1 1 11 4812 1 1 24 THR CB C 3.012 2.297 -4.643 1.00 . A A . 27 THR CB 1 1 11 4813 1 1 24 THR CG2 C 3.385 0.824 -4.740 1.00 . A A . 27 THR CG2 1 1 11 4814 1 1 24 THR H H 5.464 1.867 -3.559 1.00 . A A . 27 THR H 1 1 11 4815 1 1 24 THR HA H 3.468 4.016 -3.456 1.00 . A A . 27 THR HA 1 1 11 4816 1 1 24 THR HB H 3.378 2.803 -5.525 1.00 . A A . 27 THR HB 1 1 11 4817 1 1 24 THR HG1 H 1.343 2.974 -3.840 1.00 . A A . 27 THR HG1 1 1 11 4818 1 1 24 THR HG21 H 4.439 0.732 -4.960 1.00 . A A . 27 THR HG21 1 1 11 4819 1 1 24 THR HG22 H 2.810 0.359 -5.528 1.00 . A A . 27 THR HG22 1 1 11 4820 1 1 24 THR HG23 H 3.170 0.334 -3.801 1.00 . A A . 27 THR HG23 1 1 11 4821 1 1 24 THR N N 5.092 2.755 -3.376 1.00 . A A . 27 THR N 1 1 11 4822 1 1 24 THR O O 3.164 1.255 -1.770 1.00 . A A . 27 THR O 1 1 11 4823 1 1 24 THR OG1 O 1.587 2.427 -4.589 1.00 . A A . 27 THR OG1 1 1 11 4824 1 1 25 TYR C C -0.017 2.623 -0.637 1.00 . A A . 28 TYR C 1 1 11 4825 1 1 25 TYR CA C 1.441 2.878 -0.310 1.00 . A A . 28 TYR CA 1 1 11 4826 1 1 25 TYR CB C 1.555 3.950 0.798 1.00 . A A . 28 TYR CB 1 1 11 4827 1 1 25 TYR CD1 C 0.299 5.633 -0.683 1.00 . A A . 28 TYR CD1 1 1 11 4828 1 1 25 TYR CD2 C 0.699 6.188 1.600 1.00 . A A . 28 TYR CD2 1 1 11 4829 1 1 25 TYR CE1 C -0.347 6.843 -0.865 1.00 . A A . 28 TYR CE1 1 1 11 4830 1 1 25 TYR CE2 C 0.055 7.398 1.422 1.00 . A A . 28 TYR CE2 1 1 11 4831 1 1 25 TYR CG C 0.835 5.278 0.555 1.00 . A A . 28 TYR CG 1 1 11 4832 1 1 25 TYR CZ C -0.466 7.720 0.190 1.00 . A A . 28 TYR CZ 1 1 11 4833 1 1 25 TYR H H 2.081 4.175 -1.857 1.00 . A A . 28 TYR H 1 1 11 4834 1 1 25 TYR HA H 1.874 1.957 0.052 1.00 . A A . 28 TYR HA 1 1 11 4835 1 1 25 TYR HB2 H 1.154 3.539 1.709 1.00 . A A . 28 TYR HB2 1 1 11 4836 1 1 25 TYR HB3 H 2.596 4.172 0.957 1.00 . A A . 28 TYR HB3 1 1 11 4837 1 1 25 TYR HD1 H 0.386 4.951 -1.509 1.00 . A A . 28 TYR HD1 1 1 11 4838 1 1 25 TYR HD2 H 1.108 5.938 2.567 1.00 . A A . 28 TYR HD2 1 1 11 4839 1 1 25 TYR HE1 H -0.757 7.096 -1.832 1.00 . A A . 28 TYR HE1 1 1 11 4840 1 1 25 TYR HE2 H -0.037 8.086 2.250 1.00 . A A . 28 TYR HE2 1 1 11 4841 1 1 25 TYR HH H -1.913 8.787 -0.491 1.00 . A A . 28 TYR HH 1 1 11 4842 1 1 25 TYR N N 2.170 3.264 -1.513 1.00 . A A . 28 TYR N 1 1 11 4843 1 1 25 TYR O O -0.525 3.116 -1.639 1.00 . A A . 28 TYR O 1 1 11 4844 1 1 25 TYR OH O -1.107 8.924 0.010 1.00 . A A . 28 TYR OH 1 1 11 4845 1 1 26 TYR C C -2.918 2.366 0.970 1.00 . A A . 29 TYR C 1 1 11 4846 1 1 26 TYR CA C -2.087 1.550 -0.005 1.00 . A A . 29 TYR CA 1 1 11 4847 1 1 26 TYR CB C -2.382 0.058 0.172 1.00 . A A . 29 TYR CB 1 1 11 4848 1 1 26 TYR CD1 C -0.164 -1.080 0.603 1.00 . A A . 29 TYR CD1 1 1 11 4849 1 1 26 TYR CD2 C -1.264 -1.506 -1.468 1.00 . A A . 29 TYR CD2 1 1 11 4850 1 1 26 TYR CE1 C 0.869 -1.918 0.232 1.00 . A A . 29 TYR CE1 1 1 11 4851 1 1 26 TYR CE2 C -0.234 -2.347 -1.845 1.00 . A A . 29 TYR CE2 1 1 11 4852 1 1 26 TYR CG C -1.248 -0.859 -0.239 1.00 . A A . 29 TYR CG 1 1 11 4853 1 1 26 TYR CZ C 0.830 -2.548 -0.993 1.00 . A A . 29 TYR CZ 1 1 11 4854 1 1 26 TYR H H -0.218 1.462 0.974 1.00 . A A . 29 TYR H 1 1 11 4855 1 1 26 TYR HA H -2.343 1.845 -1.012 1.00 . A A . 29 TYR HA 1 1 11 4856 1 1 26 TYR HB2 H -2.603 -0.134 1.204 1.00 . A A . 29 TYR HB2 1 1 11 4857 1 1 26 TYR HB3 H -3.246 -0.200 -0.423 1.00 . A A . 29 TYR HB3 1 1 11 4858 1 1 26 TYR HD1 H -0.136 -0.586 1.562 1.00 . A A . 29 TYR HD1 1 1 11 4859 1 1 26 TYR HD2 H -2.098 -1.345 -2.135 1.00 . A A . 29 TYR HD2 1 1 11 4860 1 1 26 TYR HE1 H 1.702 -2.075 0.901 1.00 . A A . 29 TYR HE1 1 1 11 4861 1 1 26 TYR HE2 H -0.266 -2.841 -2.805 1.00 . A A . 29 TYR HE2 1 1 11 4862 1 1 26 TYR HH H 2.071 -3.974 -0.637 1.00 . A A . 29 TYR HH 1 1 11 4863 1 1 26 TYR N N -0.681 1.844 0.201 1.00 . A A . 29 TYR N 1 1 11 4864 1 1 26 TYR O O -2.840 2.176 2.187 1.00 . A A . 29 TYR O 1 1 11 4865 1 1 26 TYR OH O 1.856 -3.385 -1.366 1.00 . A A . 29 TYR OH 1 1 11 4866 1 1 27 TYR C C -5.990 3.694 1.159 1.00 . A A . 30 TYR C 1 1 11 4867 1 1 27 TYR CA C -4.543 4.149 1.226 1.00 . A A . 30 TYR CA 1 1 11 4868 1 1 27 TYR CB C -4.416 5.598 0.744 1.00 . A A . 30 TYR CB 1 1 11 4869 1 1 27 TYR CD1 C -5.829 6.742 2.506 1.00 . A A . 30 TYR CD1 1 1 11 4870 1 1 27 TYR CD2 C -6.383 7.092 0.214 1.00 . A A . 30 TYR CD2 1 1 11 4871 1 1 27 TYR CE1 C -6.877 7.558 2.888 1.00 . A A . 30 TYR CE1 1 1 11 4872 1 1 27 TYR CE2 C -7.432 7.911 0.589 1.00 . A A . 30 TYR CE2 1 1 11 4873 1 1 27 TYR CG C -5.564 6.495 1.164 1.00 . A A . 30 TYR CG 1 1 11 4874 1 1 27 TYR CZ C -7.674 8.140 1.926 1.00 . A A . 30 TYR CZ 1 1 11 4875 1 1 27 TYR H H -3.707 3.383 -0.548 1.00 . A A . 30 TYR H 1 1 11 4876 1 1 27 TYR HA H -4.205 4.087 2.249 1.00 . A A . 30 TYR HA 1 1 11 4877 1 1 27 TYR HB2 H -3.506 6.022 1.141 1.00 . A A . 30 TYR HB2 1 1 11 4878 1 1 27 TYR HB3 H -4.366 5.606 -0.337 1.00 . A A . 30 TYR HB3 1 1 11 4879 1 1 27 TYR HD1 H -5.202 6.285 3.258 1.00 . A A . 30 TYR HD1 1 1 11 4880 1 1 27 TYR HD2 H -6.191 6.910 -0.833 1.00 . A A . 30 TYR HD2 1 1 11 4881 1 1 27 TYR HE1 H -7.066 7.739 3.936 1.00 . A A . 30 TYR HE1 1 1 11 4882 1 1 27 TYR HE2 H -8.057 8.365 -0.165 1.00 . A A . 30 TYR HE2 1 1 11 4883 1 1 27 TYR HH H -9.488 8.757 1.764 1.00 . A A . 30 TYR HH 1 1 11 4884 1 1 27 TYR N N -3.699 3.284 0.423 1.00 . A A . 30 TYR N 1 1 11 4885 1 1 27 TYR O O -6.658 3.856 0.137 1.00 . A A . 30 TYR O 1 1 11 4886 1 1 27 TYR OH O -8.718 8.954 2.302 1.00 . A A . 30 TYR OH 1 1 11 4887 1 1 28 ASN C C -8.753 3.854 2.300 1.00 . A A . 31 ASN C 1 1 11 4888 1 1 28 ASN CA C -7.833 2.654 2.326 1.00 . A A . 31 ASN CA 1 1 11 4889 1 1 28 ASN CB C -8.053 1.840 3.605 1.00 . A A . 31 ASN CB 1 1 11 4890 1 1 28 ASN CG C -9.321 1.007 3.570 1.00 . A A . 31 ASN CG 1 1 11 4891 1 1 28 ASN H H -5.894 3.045 3.044 1.00 . A A . 31 ASN H 1 1 11 4892 1 1 28 ASN HA H -8.026 2.034 1.464 1.00 . A A . 31 ASN HA 1 1 11 4893 1 1 28 ASN HB2 H -7.214 1.174 3.747 1.00 . A A . 31 ASN HB2 1 1 11 4894 1 1 28 ASN HB3 H -8.113 2.518 4.445 1.00 . A A . 31 ASN HB3 1 1 11 4895 1 1 28 ASN HD21 H -10.249 2.388 2.481 1.00 . A A . 31 ASN HD21 1 1 11 4896 1 1 28 ASN HD22 H -11.183 0.998 2.885 1.00 . A A . 31 ASN HD22 1 1 11 4897 1 1 28 ASN N N -6.467 3.124 2.256 1.00 . A A . 31 ASN N 1 1 11 4898 1 1 28 ASN ND2 N -10.355 1.515 2.909 1.00 . A A . 31 ASN ND2 1 1 11 4899 1 1 28 ASN O O -8.710 4.677 3.206 1.00 . A A . 31 ASN O 1 1 11 4900 1 1 28 ASN OD1 O -9.374 -0.084 4.139 1.00 . A A . 31 ASN OD1 1 1 11 4901 1 1 29 THR C C -11.626 5.013 2.085 1.00 . A A . 32 THR C 1 1 11 4902 1 1 29 THR CA C -10.477 5.077 1.083 1.00 . A A . 32 THR CA 1 1 11 4903 1 1 29 THR CB C -11.059 5.114 -0.342 1.00 . A A . 32 THR CB 1 1 11 4904 1 1 29 THR CG2 C -9.989 5.497 -1.353 1.00 . A A . 32 THR CG2 1 1 11 4905 1 1 29 THR H H -9.506 3.276 0.540 1.00 . A A . 32 THR H 1 1 11 4906 1 1 29 THR HA H -9.926 5.991 1.243 1.00 . A A . 32 THR HA 1 1 11 4907 1 1 29 THR HB H -11.846 5.853 -0.375 1.00 . A A . 32 THR HB 1 1 11 4908 1 1 29 THR HG1 H -11.693 3.300 0.112 1.00 . A A . 32 THR HG1 1 1 11 4909 1 1 29 THR HG21 H -9.206 4.752 -1.347 1.00 . A A . 32 THR HG21 1 1 11 4910 1 1 29 THR HG22 H -9.573 6.458 -1.089 1.00 . A A . 32 THR HG22 1 1 11 4911 1 1 29 THR HG23 H -10.426 5.552 -2.338 1.00 . A A . 32 THR HG23 1 1 11 4912 1 1 29 THR N N -9.550 3.962 1.241 1.00 . A A . 32 THR N 1 1 11 4913 1 1 29 THR O O -11.987 6.023 2.691 1.00 . A A . 32 THR O 1 1 11 4914 1 1 29 THR OG1 O -11.610 3.834 -0.682 1.00 . A A . 32 THR OG1 1 1 11 4915 1 1 30 GLU C C -12.868 3.776 4.627 1.00 . A A . 33 GLU C 1 1 11 4916 1 1 30 GLU CA C -13.311 3.639 3.176 1.00 . A A . 33 GLU CA 1 1 11 4917 1 1 30 GLU CB C -13.938 2.264 2.944 1.00 . A A . 33 GLU CB 1 1 11 4918 1 1 30 GLU CD C -16.137 2.718 4.103 1.00 . A A . 33 GLU CD 1 1 11 4919 1 1 30 GLU CG C -14.907 1.835 4.035 1.00 . A A . 33 GLU CG 1 1 11 4920 1 1 30 GLU H H -11.864 3.055 1.753 1.00 . A A . 33 GLU H 1 1 11 4921 1 1 30 GLU HA H -14.043 4.397 2.968 1.00 . A A . 33 GLU HA 1 1 11 4922 1 1 30 GLU HB2 H -14.473 2.282 2.007 1.00 . A A . 33 GLU HB2 1 1 11 4923 1 1 30 GLU HB3 H -13.147 1.533 2.881 1.00 . A A . 33 GLU HB3 1 1 11 4924 1 1 30 GLU HG2 H -15.220 0.820 3.842 1.00 . A A . 33 GLU HG2 1 1 11 4925 1 1 30 GLU HG3 H -14.398 1.876 4.987 1.00 . A A . 33 GLU HG3 1 1 11 4926 1 1 30 GLU N N -12.198 3.827 2.257 1.00 . A A . 33 GLU N 1 1 11 4927 1 1 30 GLU O O -13.498 4.475 5.421 1.00 . A A . 33 GLU O 1 1 11 4928 1 1 30 GLU OE1 O -17.121 2.420 3.394 1.00 . A A . 33 GLU OE1 1 1 11 4929 1 1 30 GLU OE2 O -16.116 3.708 4.864 1.00 . A A . 33 GLU OE2 1 1 11 4930 1 1 31 THR C C -10.394 4.365 6.573 1.00 . A A . 34 THR C 1 1 11 4931 1 1 31 THR CA C -11.246 3.124 6.317 1.00 . A A . 34 THR CA 1 1 11 4932 1 1 31 THR CB C -10.403 1.864 6.599 1.00 . A A . 34 THR CB 1 1 11 4933 1 1 31 THR CG2 C -9.792 1.914 7.992 1.00 . A A . 34 THR CG2 1 1 11 4934 1 1 31 THR H H -11.323 2.580 4.274 1.00 . A A . 34 THR H 1 1 11 4935 1 1 31 THR HA H -12.082 3.127 7.000 1.00 . A A . 34 THR HA 1 1 11 4936 1 1 31 THR HB H -9.603 1.817 5.875 1.00 . A A . 34 THR HB 1 1 11 4937 1 1 31 THR HG1 H -12.084 0.862 6.844 1.00 . A A . 34 THR HG1 1 1 11 4938 1 1 31 THR HG21 H -10.563 2.135 8.715 1.00 . A A . 34 THR HG21 1 1 11 4939 1 1 31 THR HG22 H -9.033 2.681 8.024 1.00 . A A . 34 THR HG22 1 1 11 4940 1 1 31 THR HG23 H -9.346 0.957 8.222 1.00 . A A . 34 THR HG23 1 1 11 4941 1 1 31 THR N N -11.780 3.103 4.961 1.00 . A A . 34 THR N 1 1 11 4942 1 1 31 THR O O -10.410 4.917 7.673 1.00 . A A . 34 THR O 1 1 11 4943 1 1 31 THR OG1 O -11.216 0.692 6.473 1.00 . A A . 34 THR OG1 1 1 11 4944 1 1 32 LYS C C -7.485 5.520 6.310 1.00 . A A . 35 LYS C 1 1 11 4945 1 1 32 LYS CA C -8.756 5.939 5.630 1.00 . A A . 35 LYS CA 1 1 11 4946 1 1 32 LYS CB C -9.409 7.125 6.350 1.00 . A A . 35 LYS CB 1 1 11 4947 1 1 32 LYS CD C -11.332 8.724 6.497 1.00 . A A . 35 LYS CD 1 1 11 4948 1 1 32 LYS CE C -12.652 9.164 5.885 1.00 . A A . 35 LYS CE 1 1 11 4949 1 1 32 LYS CG C -10.699 7.597 5.702 1.00 . A A . 35 LYS CG 1 1 11 4950 1 1 32 LYS H H -9.633 4.249 4.729 1.00 . A A . 35 LYS H 1 1 11 4951 1 1 32 LYS HA H -8.506 6.227 4.616 1.00 . A A . 35 LYS HA 1 1 11 4952 1 1 32 LYS HB2 H -9.628 6.842 7.368 1.00 . A A . 35 LYS HB2 1 1 11 4953 1 1 32 LYS HB3 H -8.715 7.951 6.359 1.00 . A A . 35 LYS HB3 1 1 11 4954 1 1 32 LYS HD2 H -11.509 8.383 7.505 1.00 . A A . 35 LYS HD2 1 1 11 4955 1 1 32 LYS HD3 H -10.654 9.565 6.513 1.00 . A A . 35 LYS HD3 1 1 11 4956 1 1 32 LYS HE2 H -12.474 9.485 4.869 1.00 . A A . 35 LYS HE2 1 1 11 4957 1 1 32 LYS HE3 H -13.330 8.324 5.882 1.00 . A A . 35 LYS HE3 1 1 11 4958 1 1 32 LYS HG2 H -10.482 7.949 4.704 1.00 . A A . 35 LYS HG2 1 1 11 4959 1 1 32 LYS HG3 H -11.391 6.768 5.653 1.00 . A A . 35 LYS HG3 1 1 11 4960 1 1 32 LYS HZ1 H -14.168 10.564 6.203 1.00 . A A . 35 LYS HZ1 1 1 11 4961 1 1 32 LYS HZ2 H -12.632 11.106 6.653 1.00 . A A . 35 LYS HZ2 1 1 11 4962 1 1 32 LYS HZ3 H -13.454 9.993 7.626 1.00 . A A . 35 LYS HZ3 1 1 11 4963 1 1 32 LYS N N -9.638 4.776 5.551 1.00 . A A . 35 LYS N 1 1 11 4964 1 1 32 LYS NZ N -13.269 10.285 6.645 1.00 . A A . 35 LYS NZ 1 1 11 4965 1 1 32 LYS O O -7.012 6.152 7.255 1.00 . A A . 35 LYS O 1 1 11 4966 1 1 33 GLN C C -4.661 3.734 5.251 1.00 . A A . 36 GLN C 1 1 11 4967 1 1 33 GLN CA C -5.713 3.872 6.343 1.00 . A A . 36 GLN CA 1 1 11 4968 1 1 33 GLN CB C -6.007 2.515 6.990 1.00 . A A . 36 GLN CB 1 1 11 4969 1 1 33 GLN CD C -3.658 1.755 7.525 1.00 . A A . 36 GLN CD 1 1 11 4970 1 1 33 GLN CG C -5.020 2.122 8.076 1.00 . A A . 36 GLN CG 1 1 11 4971 1 1 33 GLN H H -7.376 4.000 5.022 1.00 . A A . 36 GLN H 1 1 11 4972 1 1 33 GLN HA H -5.345 4.550 7.099 1.00 . A A . 36 GLN HA 1 1 11 4973 1 1 33 GLN HB2 H -6.994 2.547 7.428 1.00 . A A . 36 GLN HB2 1 1 11 4974 1 1 33 GLN HB3 H -5.991 1.753 6.226 1.00 . A A . 36 GLN HB3 1 1 11 4975 1 1 33 GLN HE21 H -3.050 3.639 7.709 1.00 . A A . 36 GLN HE21 1 1 11 4976 1 1 33 GLN HE22 H -1.887 2.532 7.073 1.00 . A A . 36 GLN HE22 1 1 11 4977 1 1 33 GLN HG2 H -4.903 2.953 8.756 1.00 . A A . 36 GLN HG2 1 1 11 4978 1 1 33 GLN HG3 H -5.416 1.273 8.613 1.00 . A A . 36 GLN HG3 1 1 11 4979 1 1 33 GLN N N -6.940 4.431 5.800 1.00 . A A . 36 GLN N 1 1 11 4980 1 1 33 GLN NE2 N -2.776 2.741 7.425 1.00 . A A . 36 GLN NE2 1 1 11 4981 1 1 33 GLN O O -4.694 2.802 4.448 1.00 . A A . 36 GLN O 1 1 11 4982 1 1 33 GLN OE1 O -3.403 0.597 7.197 1.00 . A A . 36 GLN OE1 1 1 11 4983 1 1 34 SER C C -1.324 4.198 4.866 1.00 . A A . 37 SER C 1 1 11 4984 1 1 34 SER CA C -2.642 4.676 4.256 1.00 . A A . 37 SER CA 1 1 11 4985 1 1 34 SER CB C -2.465 6.083 3.683 1.00 . A A . 37 SER CB 1 1 11 4986 1 1 34 SER H H -3.762 5.382 5.911 1.00 . A A . 37 SER H 1 1 11 4987 1 1 34 SER HA H -2.924 4.006 3.458 1.00 . A A . 37 SER HA 1 1 11 4988 1 1 34 SER HB2 H -1.654 6.079 2.971 1.00 . A A . 37 SER HB2 1 1 11 4989 1 1 34 SER HB3 H -3.375 6.384 3.189 1.00 . A A . 37 SER HB3 1 1 11 4990 1 1 34 SER HG H -2.765 6.881 5.446 1.00 . A A . 37 SER HG 1 1 11 4991 1 1 34 SER N N -3.718 4.667 5.244 1.00 . A A . 37 SER N 1 1 11 4992 1 1 34 SER O O -0.775 4.839 5.761 1.00 . A A . 37 SER O 1 1 11 4993 1 1 34 SER OG O -2.169 7.017 4.707 1.00 . A A . 37 SER OG 1 1 11 4994 1 1 35 THR C C 0.931 1.431 3.896 1.00 . A A . 38 THR C 1 1 11 4995 1 1 35 THR CA C 0.425 2.494 4.861 1.00 . A A . 38 THR CA 1 1 11 4996 1 1 35 THR CB C 0.259 1.868 6.259 1.00 . A A . 38 THR CB 1 1 11 4997 1 1 35 THR CG2 C -0.608 0.619 6.198 1.00 . A A . 38 THR CG2 1 1 11 4998 1 1 35 THR H H -1.317 2.595 3.665 1.00 . A A . 38 THR H 1 1 11 4999 1 1 35 THR HA H 1.156 3.289 4.925 1.00 . A A . 38 THR HA 1 1 11 5000 1 1 35 THR HB H -0.219 2.588 6.907 1.00 . A A . 38 THR HB 1 1 11 5001 1 1 35 THR HG1 H 1.454 1.329 7.734 1.00 . A A . 38 THR HG1 1 1 11 5002 1 1 35 THR HG21 H -0.746 0.226 7.195 1.00 . A A . 38 THR HG21 1 1 11 5003 1 1 35 THR HG22 H -0.126 -0.126 5.581 1.00 . A A . 38 THR HG22 1 1 11 5004 1 1 35 THR HG23 H -1.570 0.868 5.773 1.00 . A A . 38 THR HG23 1 1 11 5005 1 1 35 THR N N -0.825 3.068 4.372 1.00 . A A . 38 THR N 1 1 11 5006 1 1 35 THR O O 0.216 1.039 2.975 1.00 . A A . 38 THR O 1 1 11 5007 1 1 35 THR OG1 O 1.542 1.531 6.801 1.00 . A A . 38 THR OG1 1 1 11 5008 1 1 36 TRP C C 2.550 -1.415 3.920 1.00 . A A . 39 TRP C 1 1 11 5009 1 1 36 TRP CA C 2.710 -0.067 3.231 1.00 . A A . 39 TRP CA 1 1 11 5010 1 1 36 TRP CB C 4.204 0.165 2.949 1.00 . A A . 39 TRP CB 1 1 11 5011 1 1 36 TRP CD1 C 5.094 2.128 4.281 1.00 . A A . 39 TRP CD1 1 1 11 5012 1 1 36 TRP CD2 C 4.834 2.559 2.111 1.00 . A A . 39 TRP CD2 1 1 11 5013 1 1 36 TRP CE2 C 5.330 3.714 2.740 1.00 . A A . 39 TRP CE2 1 1 11 5014 1 1 36 TRP CE3 C 4.594 2.589 0.738 1.00 . A A . 39 TRP CE3 1 1 11 5015 1 1 36 TRP CG C 4.679 1.565 3.123 1.00 . A A . 39 TRP CG 1 1 11 5016 1 1 36 TRP CH2 C 5.352 4.887 0.699 1.00 . A A . 39 TRP CH2 1 1 11 5017 1 1 36 TRP CZ2 C 5.594 4.884 2.041 1.00 . A A . 39 TRP CZ2 1 1 11 5018 1 1 36 TRP CZ3 C 4.856 3.755 0.046 1.00 . A A . 39 TRP CZ3 1 1 11 5019 1 1 36 TRP H H 2.698 1.316 4.840 1.00 . A A . 39 TRP H 1 1 11 5020 1 1 36 TRP HA H 2.158 -0.067 2.303 1.00 . A A . 39 TRP HA 1 1 11 5021 1 1 36 TRP HB2 H 4.782 -0.438 3.631 1.00 . A A . 39 TRP HB2 1 1 11 5022 1 1 36 TRP HB3 H 4.425 -0.132 1.935 1.00 . A A . 39 TRP HB3 1 1 11 5023 1 1 36 TRP HD1 H 5.103 1.610 5.222 1.00 . A A . 39 TRP HD1 1 1 11 5024 1 1 36 TRP HE1 H 5.811 4.047 4.753 1.00 . A A . 39 TRP HE1 1 1 11 5025 1 1 36 TRP HE3 H 4.211 1.724 0.217 1.00 . A A . 39 TRP HE3 1 1 11 5026 1 1 36 TRP HH2 H 5.543 5.776 0.118 1.00 . A A . 39 TRP HH2 1 1 11 5027 1 1 36 TRP HZ2 H 5.979 5.760 2.527 1.00 . A A . 39 TRP HZ2 1 1 11 5028 1 1 36 TRP HZ3 H 4.676 3.799 -1.016 1.00 . A A . 39 TRP HZ3 1 1 11 5029 1 1 36 TRP N N 2.160 0.964 4.099 1.00 . A A . 39 TRP N 1 1 11 5030 1 1 36 TRP NE1 N 5.480 3.427 4.069 1.00 . A A . 39 TRP NE1 1 1 11 5031 1 1 36 TRP O O 3.315 -1.759 4.822 1.00 . A A . 39 TRP O 1 1 11 5032 1 1 37 GLU C C 0.331 -4.271 3.175 1.00 . A A . 40 GLU C 1 1 11 5033 1 1 37 GLU CA C 1.277 -3.480 4.069 1.00 . A A . 40 GLU CA 1 1 11 5034 1 1 37 GLU CB C 0.668 -3.296 5.465 1.00 . A A . 40 GLU CB 1 1 11 5035 1 1 37 GLU CD C -1.671 -4.178 5.855 1.00 . A A . 40 GLU CD 1 1 11 5036 1 1 37 GLU CG C -0.821 -2.987 5.455 1.00 . A A . 40 GLU CG 1 1 11 5037 1 1 37 GLU H H 0.972 -1.857 2.759 1.00 . A A . 40 GLU H 1 1 11 5038 1 1 37 GLU HA H 2.212 -4.013 4.156 1.00 . A A . 40 GLU HA 1 1 11 5039 1 1 37 GLU HB2 H 0.823 -4.199 6.036 1.00 . A A . 40 GLU HB2 1 1 11 5040 1 1 37 GLU HB3 H 1.174 -2.475 5.955 1.00 . A A . 40 GLU HB3 1 1 11 5041 1 1 37 GLU HG2 H -1.014 -2.180 6.146 1.00 . A A . 40 GLU HG2 1 1 11 5042 1 1 37 GLU HG3 H -1.105 -2.682 4.459 1.00 . A A . 40 GLU HG3 1 1 11 5043 1 1 37 GLU N N 1.549 -2.180 3.486 1.00 . A A . 40 GLU N 1 1 11 5044 1 1 37 GLU O O -0.555 -3.698 2.543 1.00 . A A . 40 GLU O 1 1 11 5045 1 1 37 GLU OE1 O -1.463 -4.709 6.967 1.00 . A A . 40 GLU OE1 1 1 11 5046 1 1 37 GLU OE2 O -2.548 -4.575 5.061 1.00 . A A . 40 GLU OE2 1 1 11 5047 1 1 38 LYS C C -1.771 -6.316 2.725 1.00 . A A . 41 LYS C 1 1 11 5048 1 1 38 LYS CA C -0.304 -6.454 2.318 1.00 . A A . 41 LYS CA 1 1 11 5049 1 1 38 LYS CB C 0.155 -7.899 2.498 1.00 . A A . 41 LYS CB 1 1 11 5050 1 1 38 LYS CD C 1.074 -9.611 4.101 1.00 . A A . 41 LYS CD 1 1 11 5051 1 1 38 LYS CE C 1.884 -10.395 3.079 1.00 . A A . 41 LYS CE 1 1 11 5052 1 1 38 LYS CG C 0.998 -8.135 3.742 1.00 . A A . 41 LYS CG 1 1 11 5053 1 1 38 LYS H H 1.246 -5.979 3.642 1.00 . A A . 41 LYS H 1 1 11 5054 1 1 38 LYS HA H -0.190 -6.170 1.285 1.00 . A A . 41 LYS HA 1 1 11 5055 1 1 38 LYS HB2 H -0.710 -8.518 2.570 1.00 . A A . 41 LYS HB2 1 1 11 5056 1 1 38 LYS HB3 H 0.734 -8.190 1.637 1.00 . A A . 41 LYS HB3 1 1 11 5057 1 1 38 LYS HD2 H 1.540 -9.714 5.069 1.00 . A A . 41 LYS HD2 1 1 11 5058 1 1 38 LYS HD3 H 0.071 -10.014 4.137 1.00 . A A . 41 LYS HD3 1 1 11 5059 1 1 38 LYS HE2 H 1.383 -10.342 2.124 1.00 . A A . 41 LYS HE2 1 1 11 5060 1 1 38 LYS HE3 H 2.863 -9.949 2.997 1.00 . A A . 41 LYS HE3 1 1 11 5061 1 1 38 LYS HG2 H 1.998 -7.770 3.563 1.00 . A A . 41 LYS HG2 1 1 11 5062 1 1 38 LYS HG3 H 0.556 -7.595 4.567 1.00 . A A . 41 LYS HG3 1 1 11 5063 1 1 38 LYS HZ1 H 2.500 -11.896 4.395 1.00 . A A . 41 LYS HZ1 1 1 11 5064 1 1 38 LYS HZ2 H 2.606 -12.329 2.763 1.00 . A A . 41 LYS HZ2 1 1 11 5065 1 1 38 LYS HZ3 H 1.098 -12.278 3.528 1.00 . A A . 41 LYS HZ3 1 1 11 5066 1 1 38 LYS N N 0.527 -5.582 3.123 1.00 . A A . 41 LYS N 1 1 11 5067 1 1 38 LYS NZ N 2.033 -11.825 3.468 1.00 . A A . 41 LYS NZ 1 1 11 5068 1 1 38 LYS O O -2.178 -6.837 3.763 1.00 . A A . 41 LYS O 1 1 11 5069 1 1 39 PRO C C -4.850 -6.645 1.925 1.00 . A A . 42 PRO C 1 1 11 5070 1 1 39 PRO CA C -4.005 -5.411 2.219 1.00 . A A . 42 PRO CA 1 1 11 5071 1 1 39 PRO CB C -4.420 -4.248 1.302 1.00 . A A . 42 PRO CB 1 1 11 5072 1 1 39 PRO CD C -2.234 -4.997 0.635 1.00 . A A . 42 PRO CD 1 1 11 5073 1 1 39 PRO CG C -3.188 -3.839 0.560 1.00 . A A . 42 PRO CG 1 1 11 5074 1 1 39 PRO HA H -4.139 -5.120 3.250 1.00 . A A . 42 PRO HA 1 1 11 5075 1 1 39 PRO HB2 H -5.193 -4.581 0.625 1.00 . A A . 42 PRO HB2 1 1 11 5076 1 1 39 PRO HB3 H -4.795 -3.435 1.906 1.00 . A A . 42 PRO HB3 1 1 11 5077 1 1 39 PRO HD2 H -2.397 -5.677 -0.188 1.00 . A A . 42 PRO HD2 1 1 11 5078 1 1 39 PRO HD3 H -1.212 -4.649 0.647 1.00 . A A . 42 PRO HD3 1 1 11 5079 1 1 39 PRO HG2 H -3.434 -3.626 -0.470 1.00 . A A . 42 PRO HG2 1 1 11 5080 1 1 39 PRO HG3 H -2.757 -2.967 1.028 1.00 . A A . 42 PRO HG3 1 1 11 5081 1 1 39 PRO N N -2.593 -5.619 1.912 1.00 . A A . 42 PRO N 1 1 11 5082 1 1 39 PRO O O -5.177 -6.927 0.772 1.00 . A A . 42 PRO O 1 1 12 5083 1 1 12 SER C C -10.426 -1.414 -3.136 1.00 . A A . 15 SER C 1 1 12 5084 1 1 12 SER CA C -10.205 -2.636 -4.017 1.00 . A A . 15 SER CA 1 1 12 5085 1 1 12 SER CB C -11.407 -3.570 -3.915 1.00 . A A . 15 SER CB 1 1 12 5086 1 1 12 SER H H -8.579 -3.130 -2.765 1.00 . A A . 15 SER H 1 1 12 5087 1 1 12 SER HA H -10.089 -2.318 -5.043 1.00 . A A . 15 SER HA 1 1 12 5088 1 1 12 SER HB2 H -11.305 -4.364 -4.637 1.00 . A A . 15 SER HB2 1 1 12 5089 1 1 12 SER HB3 H -11.440 -3.991 -2.920 1.00 . A A . 15 SER HB3 1 1 12 5090 1 1 12 SER HG H -13.124 -3.347 -4.830 1.00 . A A . 15 SER HG 1 1 12 5091 1 1 12 SER N N -8.999 -3.348 -3.622 1.00 . A A . 15 SER N 1 1 12 5092 1 1 12 SER O O -10.319 -0.276 -3.593 1.00 . A A . 15 SER O 1 1 12 5093 1 1 12 SER OG O -12.619 -2.878 -4.162 1.00 . A A . 15 SER OG 1 1 12 5094 1 1 13 MET C C -9.699 0.204 -0.655 1.00 . A A . 16 MET C 1 1 12 5095 1 1 13 MET CA C -10.972 -0.593 -0.910 1.00 . A A . 16 MET CA 1 1 12 5096 1 1 13 MET CB C -11.490 -1.171 0.407 1.00 . A A . 16 MET CB 1 1 12 5097 1 1 13 MET CE C -13.180 -1.516 3.004 1.00 . A A . 16 MET CE 1 1 12 5098 1 1 13 MET CG C -12.821 -1.894 0.277 1.00 . A A . 16 MET CG 1 1 12 5099 1 1 13 MET H H -10.800 -2.594 -1.569 1.00 . A A . 16 MET H 1 1 12 5100 1 1 13 MET HA H -11.720 0.065 -1.325 1.00 . A A . 16 MET HA 1 1 12 5101 1 1 13 MET HB2 H -10.762 -1.869 0.792 1.00 . A A . 16 MET HB2 1 1 12 5102 1 1 13 MET HB3 H -11.612 -0.366 1.117 1.00 . A A . 16 MET HB3 1 1 12 5103 1 1 13 MET HE1 H -13.434 -1.927 3.970 1.00 . A A . 16 MET HE1 1 1 12 5104 1 1 13 MET HE2 H -13.878 -0.732 2.751 1.00 . A A . 16 MET HE2 1 1 12 5105 1 1 13 MET HE3 H -12.180 -1.112 3.037 1.00 . A A . 16 MET HE3 1 1 12 5106 1 1 13 MET HG2 H -13.593 -1.166 0.077 1.00 . A A . 16 MET HG2 1 1 12 5107 1 1 13 MET HG3 H -12.758 -2.587 -0.550 1.00 . A A . 16 MET HG3 1 1 12 5108 1 1 13 MET N N -10.733 -1.663 -1.868 1.00 . A A . 16 MET N 1 1 12 5109 1 1 13 MET O O -9.742 1.288 -0.077 1.00 . A A . 16 MET O 1 1 12 5110 1 1 13 MET SD S -13.263 -2.810 1.767 1.00 . A A . 16 MET SD 1 1 12 5111 1 1 14 TRP C C -6.727 0.847 -2.212 1.00 . A A . 17 TRP C 1 1 12 5112 1 1 14 TRP CA C -7.282 0.326 -0.896 1.00 . A A . 17 TRP CA 1 1 12 5113 1 1 14 TRP CB C -6.269 -0.626 -0.258 1.00 . A A . 17 TRP CB 1 1 12 5114 1 1 14 TRP CD1 C -7.773 -2.165 1.129 1.00 . A A . 17 TRP CD1 1 1 12 5115 1 1 14 TRP CD2 C -6.241 -1.043 2.309 1.00 . A A . 17 TRP CD2 1 1 12 5116 1 1 14 TRP CE2 C -6.991 -1.836 3.193 1.00 . A A . 17 TRP CE2 1 1 12 5117 1 1 14 TRP CE3 C -5.215 -0.248 2.816 1.00 . A A . 17 TRP CE3 1 1 12 5118 1 1 14 TRP CG C -6.758 -1.262 0.999 1.00 . A A . 17 TRP CG 1 1 12 5119 1 1 14 TRP CH2 C -5.734 -1.066 5.035 1.00 . A A . 17 TRP CH2 1 1 12 5120 1 1 14 TRP CZ2 C -6.747 -1.855 4.562 1.00 . A A . 17 TRP CZ2 1 1 12 5121 1 1 14 TRP CZ3 C -4.971 -0.268 4.172 1.00 . A A . 17 TRP CZ3 1 1 12 5122 1 1 14 TRP H H -8.592 -1.204 -1.551 1.00 . A A . 17 TRP H 1 1 12 5123 1 1 14 TRP HA H -7.440 1.160 -0.232 1.00 . A A . 17 TRP HA 1 1 12 5124 1 1 14 TRP HB2 H -6.027 -1.411 -0.954 1.00 . A A . 17 TRP HB2 1 1 12 5125 1 1 14 TRP HB3 H -5.369 -0.073 -0.020 1.00 . A A . 17 TRP HB3 1 1 12 5126 1 1 14 TRP HD1 H -8.366 -2.538 0.307 1.00 . A A . 17 TRP HD1 1 1 12 5127 1 1 14 TRP HE1 H -8.583 -3.144 2.798 1.00 . A A . 17 TRP HE1 1 1 12 5128 1 1 14 TRP HE3 H -4.616 0.372 2.165 1.00 . A A . 17 TRP HE3 1 1 12 5129 1 1 14 TRP HH2 H -5.507 -1.050 6.090 1.00 . A A . 17 TRP HH2 1 1 12 5130 1 1 14 TRP HZ2 H -7.329 -2.462 5.237 1.00 . A A . 17 TRP HZ2 1 1 12 5131 1 1 14 TRP HZ3 H -4.181 0.340 4.579 1.00 . A A . 17 TRP HZ3 1 1 12 5132 1 1 14 TRP N N -8.566 -0.339 -1.090 1.00 . A A . 17 TRP N 1 1 12 5133 1 1 14 TRP NE1 N -7.922 -2.513 2.449 1.00 . A A . 17 TRP NE1 1 1 12 5134 1 1 14 TRP O O -6.686 0.128 -3.212 1.00 . A A . 17 TRP O 1 1 12 5135 1 1 15 THR C C -4.212 2.816 -3.238 1.00 . A A . 18 THR C 1 1 12 5136 1 1 15 THR CA C -5.727 2.721 -3.383 1.00 . A A . 18 THR CA 1 1 12 5137 1 1 15 THR CB C -6.304 4.129 -3.611 1.00 . A A . 18 THR CB 1 1 12 5138 1 1 15 THR CG2 C -7.768 4.055 -4.020 1.00 . A A . 18 THR CG2 1 1 12 5139 1 1 15 THR H H -6.372 2.626 -1.381 1.00 . A A . 18 THR H 1 1 12 5140 1 1 15 THR HA H -5.972 2.104 -4.232 1.00 . A A . 18 THR HA 1 1 12 5141 1 1 15 THR HB H -5.749 4.603 -4.402 1.00 . A A . 18 THR HB 1 1 12 5142 1 1 15 THR HG1 H -6.843 4.639 -1.782 1.00 . A A . 18 THR HG1 1 1 12 5143 1 1 15 THR HG21 H -8.331 3.545 -3.252 1.00 . A A . 18 THR HG21 1 1 12 5144 1 1 15 THR HG22 H -7.856 3.514 -4.951 1.00 . A A . 18 THR HG22 1 1 12 5145 1 1 15 THR HG23 H -8.156 5.054 -4.147 1.00 . A A . 18 THR HG23 1 1 12 5146 1 1 15 THR N N -6.299 2.101 -2.203 1.00 . A A . 18 THR N 1 1 12 5147 1 1 15 THR O O -3.714 3.332 -2.239 1.00 . A A . 18 THR O 1 1 12 5148 1 1 15 THR OG1 O -6.176 4.911 -2.418 1.00 . A A . 18 THR OG1 1 1 12 5149 1 1 16 GLU C C -1.434 3.475 -5.030 1.00 . A A . 19 GLU C 1 1 12 5150 1 1 16 GLU CA C -2.023 2.360 -4.167 1.00 . A A . 19 GLU CA 1 1 12 5151 1 1 16 GLU CB C -1.450 0.998 -4.574 1.00 . A A . 19 GLU CB 1 1 12 5152 1 1 16 GLU CD C -2.686 0.946 -6.785 1.00 . A A . 19 GLU CD 1 1 12 5153 1 1 16 GLU CG C -1.358 0.771 -6.075 1.00 . A A . 19 GLU CG 1 1 12 5154 1 1 16 GLU H H -3.912 1.932 -5.009 1.00 . A A . 19 GLU H 1 1 12 5155 1 1 16 GLU HA H -1.755 2.548 -3.142 1.00 . A A . 19 GLU HA 1 1 12 5156 1 1 16 GLU HB2 H -0.462 0.906 -4.162 1.00 . A A . 19 GLU HB2 1 1 12 5157 1 1 16 GLU HB3 H -2.075 0.222 -4.155 1.00 . A A . 19 GLU HB3 1 1 12 5158 1 1 16 GLU HG2 H -0.651 1.476 -6.485 1.00 . A A . 19 GLU HG2 1 1 12 5159 1 1 16 GLU HG3 H -1.002 -0.234 -6.252 1.00 . A A . 19 GLU HG3 1 1 12 5160 1 1 16 GLU N N -3.476 2.330 -4.232 1.00 . A A . 19 GLU N 1 1 12 5161 1 1 16 GLU O O -1.784 3.631 -6.200 1.00 . A A . 19 GLU O 1 1 12 5162 1 1 16 GLU OE1 O -3.663 0.275 -6.391 1.00 . A A . 19 GLU OE1 1 1 12 5163 1 1 16 GLU OE2 O -2.749 1.750 -7.739 1.00 . A A . 19 GLU OE2 1 1 12 5164 1 1 17 HIS C C 1.494 5.629 -4.512 1.00 . A A . 20 HIS C 1 1 12 5165 1 1 17 HIS CA C 0.116 5.371 -5.113 1.00 . A A . 20 HIS CA 1 1 12 5166 1 1 17 HIS CB C -0.721 6.648 -5.004 1.00 . A A . 20 HIS CB 1 1 12 5167 1 1 17 HIS CD2 C -3.294 6.321 -4.958 1.00 . A A . 20 HIS CD2 1 1 12 5168 1 1 17 HIS CE1 C -3.674 6.470 -7.113 1.00 . A A . 20 HIS CE1 1 1 12 5169 1 1 17 HIS CG C -2.102 6.526 -5.569 1.00 . A A . 20 HIS CG 1 1 12 5170 1 1 17 HIS H H -0.317 4.084 -3.484 1.00 . A A . 20 HIS H 1 1 12 5171 1 1 17 HIS HA H 0.228 5.105 -6.153 1.00 . A A . 20 HIS HA 1 1 12 5172 1 1 17 HIS HB2 H -0.814 6.919 -3.964 1.00 . A A . 20 HIS HB2 1 1 12 5173 1 1 17 HIS HB3 H -0.212 7.442 -5.532 1.00 . A A . 20 HIS HB3 1 1 12 5174 1 1 17 HIS HD1 H -1.715 6.761 -7.627 1.00 . A A . 20 HIS HD1 1 1 12 5175 1 1 17 HIS HD2 H -3.459 6.204 -3.895 1.00 . A A . 20 HIS HD2 1 1 12 5176 1 1 17 HIS HE1 H -4.176 6.493 -8.069 1.00 . A A . 20 HIS HE1 1 1 12 5177 1 1 17 HIS HE2 H -5.222 6.268 -5.787 1.00 . A A . 20 HIS HE2 1 1 12 5178 1 1 17 HIS N N -0.542 4.260 -4.424 1.00 . A A . 20 HIS N 1 1 12 5179 1 1 17 HIS ND1 N -2.375 6.614 -6.917 1.00 . A A . 20 HIS ND1 1 1 12 5180 1 1 17 HIS NE2 N -4.254 6.291 -5.939 1.00 . A A . 20 HIS NE2 1 1 12 5181 1 1 17 HIS O O 1.655 5.606 -3.294 1.00 . A A . 20 HIS O 1 1 12 5182 1 1 18 LYS C C 3.872 7.233 -3.839 1.00 . A A . 21 LYS C 1 1 12 5183 1 1 18 LYS CA C 3.840 6.138 -4.892 1.00 . A A . 21 LYS CA 1 1 12 5184 1 1 18 LYS CB C 4.767 6.523 -6.042 1.00 . A A . 21 LYS CB 1 1 12 5185 1 1 18 LYS CD C 5.303 4.111 -6.470 1.00 . A A . 21 LYS CD 1 1 12 5186 1 1 18 LYS CE C 5.608 3.072 -7.536 1.00 . A A . 21 LYS CE 1 1 12 5187 1 1 18 LYS CG C 4.909 5.438 -7.086 1.00 . A A . 21 LYS CG 1 1 12 5188 1 1 18 LYS H H 2.317 5.841 -6.326 1.00 . A A . 21 LYS H 1 1 12 5189 1 1 18 LYS HA H 4.207 5.231 -4.445 1.00 . A A . 21 LYS HA 1 1 12 5190 1 1 18 LYS HB2 H 4.377 7.408 -6.523 1.00 . A A . 21 LYS HB2 1 1 12 5191 1 1 18 LYS HB3 H 5.747 6.742 -5.644 1.00 . A A . 21 LYS HB3 1 1 12 5192 1 1 18 LYS HD2 H 6.178 4.252 -5.854 1.00 . A A . 21 LYS HD2 1 1 12 5193 1 1 18 LYS HD3 H 4.481 3.761 -5.862 1.00 . A A . 21 LYS HD3 1 1 12 5194 1 1 18 LYS HE2 H 6.458 3.405 -8.111 1.00 . A A . 21 LYS HE2 1 1 12 5195 1 1 18 LYS HE3 H 5.845 2.135 -7.051 1.00 . A A . 21 LYS HE3 1 1 12 5196 1 1 18 LYS HG2 H 3.964 5.318 -7.571 1.00 . A A . 21 LYS HG2 1 1 12 5197 1 1 18 LYS HG3 H 5.658 5.732 -7.806 1.00 . A A . 21 LYS HG3 1 1 12 5198 1 1 18 LYS HZ1 H 3.630 2.519 -7.922 1.00 . A A . 21 LYS HZ1 1 1 12 5199 1 1 18 LYS HZ2 H 4.699 2.162 -9.183 1.00 . A A . 21 LYS HZ2 1 1 12 5200 1 1 18 LYS HZ3 H 4.202 3.758 -8.922 1.00 . A A . 21 LYS HZ3 1 1 12 5201 1 1 18 LYS N N 2.489 5.871 -5.364 1.00 . A A . 21 LYS N 1 1 12 5202 1 1 18 LYS NZ N 4.454 2.863 -8.455 1.00 . A A . 21 LYS NZ 1 1 12 5203 1 1 18 LYS O O 2.954 8.045 -3.727 1.00 . A A . 21 LYS O 1 1 12 5204 1 1 19 SER C C 6.615 8.139 -1.542 1.00 . A A . 22 SER C 1 1 12 5205 1 1 19 SER CA C 5.164 8.205 -2.021 1.00 . A A . 22 SER CA 1 1 12 5206 1 1 19 SER CB C 4.196 7.923 -0.874 1.00 . A A . 22 SER CB 1 1 12 5207 1 1 19 SER H H 5.637 6.552 -3.237 1.00 . A A . 22 SER H 1 1 12 5208 1 1 19 SER HA H 4.969 9.188 -2.422 1.00 . A A . 22 SER HA 1 1 12 5209 1 1 19 SER HB2 H 3.807 6.921 -0.974 1.00 . A A . 22 SER HB2 1 1 12 5210 1 1 19 SER HB3 H 4.717 8.013 0.067 1.00 . A A . 22 SER HB3 1 1 12 5211 1 1 19 SER HG H 2.725 8.885 -0.012 1.00 . A A . 22 SER HG 1 1 12 5212 1 1 19 SER N N 4.955 7.236 -3.082 1.00 . A A . 22 SER N 1 1 12 5213 1 1 19 SER O O 7.375 7.283 -2.014 1.00 . A A . 22 SER O 1 1 12 5214 1 1 19 SER OG O 3.114 8.837 -0.888 1.00 . A A . 22 SER OG 1 1 12 5215 1 1 20 PRO C C 9.080 7.740 -0.061 1.00 . A A . 23 PRO C 1 1 12 5216 1 1 20 PRO CA C 8.378 9.092 -0.067 1.00 . A A . 23 PRO CA 1 1 12 5217 1 1 20 PRO CB C 8.159 9.591 1.367 1.00 . A A . 23 PRO CB 1 1 12 5218 1 1 20 PRO CD C 6.213 10.096 0.005 1.00 . A A . 23 PRO CD 1 1 12 5219 1 1 20 PRO CG C 6.773 10.174 1.403 1.00 . A A . 23 PRO CG 1 1 12 5220 1 1 20 PRO HA H 8.987 9.804 -0.603 1.00 . A A . 23 PRO HA 1 1 12 5221 1 1 20 PRO HB2 H 8.251 8.763 2.053 1.00 . A A . 23 PRO HB2 1 1 12 5222 1 1 20 PRO HB3 H 8.901 10.339 1.602 1.00 . A A . 23 PRO HB3 1 1 12 5223 1 1 20 PRO HD2 H 5.171 9.823 0.033 1.00 . A A . 23 PRO HD2 1 1 12 5224 1 1 20 PRO HD3 H 6.342 11.032 -0.512 1.00 . A A . 23 PRO HD3 1 1 12 5225 1 1 20 PRO HG2 H 6.157 9.599 2.080 1.00 . A A . 23 PRO HG2 1 1 12 5226 1 1 20 PRO HG3 H 6.820 11.203 1.728 1.00 . A A . 23 PRO HG3 1 1 12 5227 1 1 20 PRO N N 7.024 9.039 -0.608 1.00 . A A . 23 PRO N 1 1 12 5228 1 1 20 PRO O O 8.448 6.699 0.126 1.00 . A A . 23 PRO O 1 1 12 5229 1 1 21 ASP C C 11.110 5.893 -1.667 1.00 . A A . 24 ASP C 1 1 12 5230 1 1 21 ASP CA C 11.230 6.581 -0.304 1.00 . A A . 24 ASP CA 1 1 12 5231 1 1 21 ASP CB C 10.869 5.619 0.836 1.00 . A A . 24 ASP CB 1 1 12 5232 1 1 21 ASP CG C 11.894 4.513 1.008 1.00 . A A . 24 ASP CG 1 1 12 5233 1 1 21 ASP H H 10.826 8.653 -0.387 1.00 . A A . 24 ASP H 1 1 12 5234 1 1 21 ASP HA H 12.254 6.899 -0.176 1.00 . A A . 24 ASP HA 1 1 12 5235 1 1 21 ASP HB2 H 10.811 6.174 1.761 1.00 . A A . 24 ASP HB2 1 1 12 5236 1 1 21 ASP HB3 H 9.907 5.170 0.634 1.00 . A A . 24 ASP HB3 1 1 12 5237 1 1 21 ASP N N 10.397 7.781 -0.263 1.00 . A A . 24 ASP N 1 1 12 5238 1 1 21 ASP O O 11.871 4.977 -1.981 1.00 . A A . 24 ASP O 1 1 12 5239 1 1 21 ASP OD1 O 11.909 3.578 0.180 1.00 . A A . 24 ASP OD1 1 1 12 5240 1 1 21 ASP OD2 O 12.686 4.584 1.972 1.00 . A A . 24 ASP OD2 1 1 12 5241 1 1 22 GLY C C 9.265 4.456 -3.780 1.00 . A A . 25 GLY C 1 1 12 5242 1 1 22 GLY CA C 9.950 5.799 -3.799 1.00 . A A . 25 GLY CA 1 1 12 5243 1 1 22 GLY H H 9.564 7.060 -2.160 1.00 . A A . 25 GLY H 1 1 12 5244 1 1 22 GLY HA2 H 9.334 6.482 -4.377 1.00 . A A . 25 GLY HA2 1 1 12 5245 1 1 22 GLY HA3 H 10.907 5.701 -4.276 1.00 . A A . 25 GLY HA3 1 1 12 5246 1 1 22 GLY N N 10.149 6.350 -2.473 1.00 . A A . 25 GLY N 1 1 12 5247 1 1 22 GLY O O 9.805 3.461 -4.264 1.00 . A A . 25 GLY O 1 1 12 5248 1 1 23 ARG C C 5.808 3.597 -3.085 1.00 . A A . 26 ARG C 1 1 12 5249 1 1 23 ARG CA C 7.278 3.222 -3.145 1.00 . A A . 26 ARG CA 1 1 12 5250 1 1 23 ARG CB C 7.688 2.382 -1.936 1.00 . A A . 26 ARG CB 1 1 12 5251 1 1 23 ARG CD C 8.957 2.896 0.157 1.00 . A A . 26 ARG CD 1 1 12 5252 1 1 23 ARG CG C 7.687 3.144 -0.631 1.00 . A A . 26 ARG CG 1 1 12 5253 1 1 23 ARG CZ C 10.253 0.979 0.994 1.00 . A A . 26 ARG CZ 1 1 12 5254 1 1 23 ARG H H 7.706 5.264 -2.837 1.00 . A A . 26 ARG H 1 1 12 5255 1 1 23 ARG HA H 7.455 2.655 -4.048 1.00 . A A . 26 ARG HA 1 1 12 5256 1 1 23 ARG HB2 H 7.006 1.558 -1.838 1.00 . A A . 26 ARG HB2 1 1 12 5257 1 1 23 ARG HB3 H 8.683 1.996 -2.103 1.00 . A A . 26 ARG HB3 1 1 12 5258 1 1 23 ARG HD2 H 9.755 3.477 -0.280 1.00 . A A . 26 ARG HD2 1 1 12 5259 1 1 23 ARG HD3 H 8.794 3.217 1.171 1.00 . A A . 26 ARG HD3 1 1 12 5260 1 1 23 ARG HE H 8.923 0.895 -0.491 1.00 . A A . 26 ARG HE 1 1 12 5261 1 1 23 ARG HG2 H 7.605 4.199 -0.840 1.00 . A A . 26 ARG HG2 1 1 12 5262 1 1 23 ARG HG3 H 6.843 2.824 -0.042 1.00 . A A . 26 ARG HG3 1 1 12 5263 1 1 23 ARG HH11 H 10.589 2.719 1.968 1.00 . A A . 26 ARG HH11 1 1 12 5264 1 1 23 ARG HH12 H 11.514 1.366 2.526 1.00 . A A . 26 ARG HH12 1 1 12 5265 1 1 23 ARG HH21 H 10.144 -0.889 0.235 1.00 . A A . 26 ARG HH21 1 1 12 5266 1 1 23 ARG HH22 H 11.259 -0.684 1.545 1.00 . A A . 26 ARG HH22 1 1 12 5267 1 1 23 ARG N N 8.070 4.435 -3.219 1.00 . A A . 26 ARG N 1 1 12 5268 1 1 23 ARG NE N 9.347 1.488 0.164 1.00 . A A . 26 ARG NE 1 1 12 5269 1 1 23 ARG NH1 N 10.832 1.751 1.904 1.00 . A A . 26 ARG NH1 1 1 12 5270 1 1 23 ARG NH2 N 10.578 -0.303 0.919 1.00 . A A . 26 ARG NH2 1 1 12 5271 1 1 23 ARG O O 5.479 4.747 -2.813 1.00 . A A . 26 ARG O 1 1 12 5272 1 1 24 THR C C 2.831 2.517 -2.014 1.00 . A A . 27 THR C 1 1 12 5273 1 1 24 THR CA C 3.501 2.939 -3.311 1.00 . A A . 27 THR CA 1 1 12 5274 1 1 24 THR CB C 2.784 2.261 -4.495 1.00 . A A . 27 THR CB 1 1 12 5275 1 1 24 THR CG2 C 2.992 0.754 -4.476 1.00 . A A . 27 THR CG2 1 1 12 5276 1 1 24 THR H H 5.231 1.722 -3.464 1.00 . A A . 27 THR H 1 1 12 5277 1 1 24 THR HA H 3.396 4.010 -3.423 1.00 . A A . 27 THR HA 1 1 12 5278 1 1 24 THR HB H 3.193 2.652 -5.415 1.00 . A A . 27 THR HB 1 1 12 5279 1 1 24 THR HG1 H 1.131 3.040 -5.235 1.00 . A A . 27 THR HG1 1 1 12 5280 1 1 24 THR HG21 H 2.715 0.364 -3.508 1.00 . A A . 27 THR HG21 1 1 12 5281 1 1 24 THR HG22 H 4.031 0.530 -4.671 1.00 . A A . 27 THR HG22 1 1 12 5282 1 1 24 THR HG23 H 2.375 0.296 -5.238 1.00 . A A . 27 THR HG23 1 1 12 5283 1 1 24 THR N N 4.925 2.639 -3.307 1.00 . A A . 27 THR N 1 1 12 5284 1 1 24 THR O O 3.064 1.422 -1.504 1.00 . A A . 27 THR O 1 1 12 5285 1 1 24 THR OG1 O 1.383 2.548 -4.450 1.00 . A A . 27 THR OG1 1 1 12 5286 1 1 25 TYR C C -0.169 2.766 -0.524 1.00 . A A . 28 TYR C 1 1 12 5287 1 1 25 TYR CA C 1.272 3.143 -0.251 1.00 . A A . 28 TYR CA 1 1 12 5288 1 1 25 TYR CB C 1.305 4.371 0.666 1.00 . A A . 28 TYR CB 1 1 12 5289 1 1 25 TYR CD1 C -0.847 5.668 0.356 1.00 . A A . 28 TYR CD1 1 1 12 5290 1 1 25 TYR CD2 C 1.149 6.565 -0.582 1.00 . A A . 28 TYR CD2 1 1 12 5291 1 1 25 TYR CE1 C -1.563 6.747 -0.127 1.00 . A A . 28 TYR CE1 1 1 12 5292 1 1 25 TYR CE2 C 0.439 7.647 -1.067 1.00 . A A . 28 TYR CE2 1 1 12 5293 1 1 25 TYR CG C 0.522 5.557 0.136 1.00 . A A . 28 TYR CG 1 1 12 5294 1 1 25 TYR CZ C -0.916 7.733 -0.837 1.00 . A A . 28 TYR CZ 1 1 12 5295 1 1 25 TYR H H 1.833 4.246 -1.969 1.00 . A A . 28 TYR H 1 1 12 5296 1 1 25 TYR HA H 1.760 2.319 0.248 1.00 . A A . 28 TYR HA 1 1 12 5297 1 1 25 TYR HB2 H 0.886 4.103 1.625 1.00 . A A . 28 TYR HB2 1 1 12 5298 1 1 25 TYR HB3 H 2.328 4.681 0.803 1.00 . A A . 28 TYR HB3 1 1 12 5299 1 1 25 TYR HD1 H -1.354 4.893 0.912 1.00 . A A . 28 TYR HD1 1 1 12 5300 1 1 25 TYR HD2 H 2.210 6.498 -0.763 1.00 . A A . 28 TYR HD2 1 1 12 5301 1 1 25 TYR HE1 H -2.624 6.815 0.055 1.00 . A A . 28 TYR HE1 1 1 12 5302 1 1 25 TYR HE2 H 0.947 8.420 -1.624 1.00 . A A . 28 TYR HE2 1 1 12 5303 1 1 25 TYR HH H -2.190 9.156 -0.624 1.00 . A A . 28 TYR HH 1 1 12 5304 1 1 25 TYR N N 1.984 3.400 -1.496 1.00 . A A . 28 TYR N 1 1 12 5305 1 1 25 TYR O O -0.732 3.135 -1.555 1.00 . A A . 28 TYR O 1 1 12 5306 1 1 25 TYR OH O -1.625 8.809 -1.318 1.00 . A A . 28 TYR OH 1 1 12 5307 1 1 26 TYR C C -3.043 2.429 1.201 1.00 . A A . 29 TYR C 1 1 12 5308 1 1 26 TYR CA C -2.137 1.607 0.298 1.00 . A A . 29 TYR CA 1 1 12 5309 1 1 26 TYR CB C -2.251 0.134 0.668 1.00 . A A . 29 TYR CB 1 1 12 5310 1 1 26 TYR CD1 C -1.840 -0.918 -1.592 1.00 . A A . 29 TYR CD1 1 1 12 5311 1 1 26 TYR CD2 C -0.397 -1.513 0.210 1.00 . A A . 29 TYR CD2 1 1 12 5312 1 1 26 TYR CE1 C -1.134 -1.755 -2.437 1.00 . A A . 29 TYR CE1 1 1 12 5313 1 1 26 TYR CE2 C 0.313 -2.350 -0.629 1.00 . A A . 29 TYR CE2 1 1 12 5314 1 1 26 TYR CG C -1.483 -0.784 -0.256 1.00 . A A . 29 TYR CG 1 1 12 5315 1 1 26 TYR CZ C -0.060 -2.468 -1.950 1.00 . A A . 29 TYR CZ 1 1 12 5316 1 1 26 TYR H H -0.251 1.803 1.217 1.00 . A A . 29 TYR H 1 1 12 5317 1 1 26 TYR HA H -2.445 1.740 -0.728 1.00 . A A . 29 TYR HA 1 1 12 5318 1 1 26 TYR HB2 H -1.871 -0.007 1.667 1.00 . A A . 29 TYR HB2 1 1 12 5319 1 1 26 TYR HB3 H -3.288 -0.150 0.641 1.00 . A A . 29 TYR HB3 1 1 12 5320 1 1 26 TYR HD1 H -2.681 -0.356 -1.970 1.00 . A A . 29 TYR HD1 1 1 12 5321 1 1 26 TYR HD2 H -0.107 -1.419 1.246 1.00 . A A . 29 TYR HD2 1 1 12 5322 1 1 26 TYR HE1 H -1.426 -1.846 -3.473 1.00 . A A . 29 TYR HE1 1 1 12 5323 1 1 26 TYR HE2 H 1.155 -2.909 -0.247 1.00 . A A . 29 TYR HE2 1 1 12 5324 1 1 26 TYR HH H 0.793 -4.143 -2.350 1.00 . A A . 29 TYR HH 1 1 12 5325 1 1 26 TYR N N -0.759 2.045 0.416 1.00 . A A . 29 TYR N 1 1 12 5326 1 1 26 TYR O O -3.001 2.294 2.424 1.00 . A A . 29 TYR O 1 1 12 5327 1 1 26 TYR OH O 0.645 -3.302 -2.788 1.00 . A A . 29 TYR OH 1 1 12 5328 1 1 27 TYR C C -6.200 3.589 1.237 1.00 . A A . 30 TYR C 1 1 12 5329 1 1 27 TYR CA C -4.778 4.115 1.345 1.00 . A A . 30 TYR CA 1 1 12 5330 1 1 27 TYR CB C -4.712 5.560 0.844 1.00 . A A . 30 TYR CB 1 1 12 5331 1 1 27 TYR CD1 C -6.038 6.667 2.692 1.00 . A A . 30 TYR CD1 1 1 12 5332 1 1 27 TYR CD2 C -6.734 7.021 0.441 1.00 . A A . 30 TYR CD2 1 1 12 5333 1 1 27 TYR CE1 C -7.075 7.460 3.143 1.00 . A A . 30 TYR CE1 1 1 12 5334 1 1 27 TYR CE2 C -7.774 7.817 0.883 1.00 . A A . 30 TYR CE2 1 1 12 5335 1 1 27 TYR CG C -5.849 6.433 1.336 1.00 . A A . 30 TYR CG 1 1 12 5336 1 1 27 TYR CZ C -7.940 8.033 2.235 1.00 . A A . 30 TYR CZ 1 1 12 5337 1 1 27 TYR H H -3.842 3.340 -0.381 1.00 . A A . 30 TYR H 1 1 12 5338 1 1 27 TYR HA H -4.478 4.090 2.381 1.00 . A A . 30 TYR HA 1 1 12 5339 1 1 27 TYR HB2 H -3.786 6.005 1.180 1.00 . A A . 30 TYR HB2 1 1 12 5340 1 1 27 TYR HB3 H -4.732 5.560 -0.236 1.00 . A A . 30 TYR HB3 1 1 12 5341 1 1 27 TYR HD1 H -5.360 6.217 3.403 1.00 . A A . 30 TYR HD1 1 1 12 5342 1 1 27 TYR HD2 H -6.601 6.851 -0.617 1.00 . A A . 30 TYR HD2 1 1 12 5343 1 1 27 TYR HE1 H -7.205 7.630 4.201 1.00 . A A . 30 TYR HE1 1 1 12 5344 1 1 27 TYR HE2 H -8.451 8.265 0.171 1.00 . A A . 30 TYR HE2 1 1 12 5345 1 1 27 TYR HH H -9.775 8.608 2.195 1.00 . A A . 30 TYR HH 1 1 12 5346 1 1 27 TYR N N -3.859 3.276 0.595 1.00 . A A . 30 TYR N 1 1 12 5347 1 1 27 TYR O O -6.848 3.727 0.199 1.00 . A A . 30 TYR O 1 1 12 5348 1 1 27 TYR OH O -8.975 8.824 2.680 1.00 . A A . 30 TYR OH 1 1 12 5349 1 1 28 ASN C C -8.985 3.633 2.350 1.00 . A A . 31 ASN C 1 1 12 5350 1 1 28 ASN CA C -8.028 2.460 2.347 1.00 . A A . 31 ASN CA 1 1 12 5351 1 1 28 ASN CB C -8.239 1.595 3.595 1.00 . A A . 31 ASN CB 1 1 12 5352 1 1 28 ASN CG C -9.418 0.644 3.471 1.00 . A A . 31 ASN CG 1 1 12 5353 1 1 28 ASN H H -6.127 2.924 3.119 1.00 . A A . 31 ASN H 1 1 12 5354 1 1 28 ASN HA H -8.186 1.866 1.458 1.00 . A A . 31 ASN HA 1 1 12 5355 1 1 28 ASN HB2 H -7.350 1.009 3.772 1.00 . A A . 31 ASN HB2 1 1 12 5356 1 1 28 ASN HB3 H -8.410 2.242 4.444 1.00 . A A . 31 ASN HB3 1 1 12 5357 1 1 28 ASN HD21 H -10.285 1.831 2.139 1.00 . A A . 31 ASN HD21 1 1 12 5358 1 1 28 ASN HD22 H -11.154 0.395 2.537 1.00 . A A . 31 ASN HD22 1 1 12 5359 1 1 28 ASN N N -6.680 2.987 2.317 1.00 . A A . 31 ASN N 1 1 12 5360 1 1 28 ASN ND2 N -10.382 0.992 2.630 1.00 . A A . 31 ASN ND2 1 1 12 5361 1 1 28 ASN O O -8.970 4.428 3.283 1.00 . A A . 31 ASN O 1 1 12 5362 1 1 28 ASN OD1 O -9.458 -0.397 4.126 1.00 . A A . 31 ASN OD1 1 1 12 5363 1 1 29 THR C C -11.890 4.733 2.140 1.00 . A A . 32 THR C 1 1 12 5364 1 1 29 THR CA C -10.721 4.866 1.166 1.00 . A A . 32 THR CA 1 1 12 5365 1 1 29 THR CB C -11.276 4.972 -0.266 1.00 . A A . 32 THR CB 1 1 12 5366 1 1 29 THR CG2 C -10.166 5.301 -1.253 1.00 . A A . 32 THR CG2 1 1 12 5367 1 1 29 THR H H -9.686 3.122 0.547 1.00 . A A . 32 THR H 1 1 12 5368 1 1 29 THR HA H -10.192 5.783 1.388 1.00 . A A . 32 THR HA 1 1 12 5369 1 1 29 THR HB H -12.009 5.765 -0.294 1.00 . A A . 32 THR HB 1 1 12 5370 1 1 29 THR HG1 H -12.858 3.835 -0.575 1.00 . A A . 32 THR HG1 1 1 12 5371 1 1 29 THR HG21 H -10.585 5.416 -2.241 1.00 . A A . 32 THR HG21 1 1 12 5372 1 1 29 THR HG22 H -9.441 4.501 -1.260 1.00 . A A . 32 THR HG22 1 1 12 5373 1 1 29 THR HG23 H -9.682 6.221 -0.957 1.00 . A A . 32 THR HG23 1 1 12 5374 1 1 29 THR N N -9.768 3.766 1.284 1.00 . A A . 32 THR N 1 1 12 5375 1 1 29 THR O O -12.338 5.726 2.715 1.00 . A A . 32 THR O 1 1 12 5376 1 1 29 THR OG1 O -11.905 3.741 -0.642 1.00 . A A . 32 THR OG1 1 1 12 5377 1 1 30 GLU C C -13.090 3.297 4.684 1.00 . A A . 33 GLU C 1 1 12 5378 1 1 30 GLU CA C -13.515 3.279 3.218 1.00 . A A . 33 GLU CA 1 1 12 5379 1 1 30 GLU CB C -14.178 1.947 2.873 1.00 . A A . 33 GLU CB 1 1 12 5380 1 1 30 GLU CD C -16.084 0.370 3.407 1.00 . A A . 33 GLU CD 1 1 12 5381 1 1 30 GLU CG C -15.169 1.464 3.923 1.00 . A A . 33 GLU CG 1 1 12 5382 1 1 30 GLU H H -11.988 2.753 1.852 1.00 . A A . 33 GLU H 1 1 12 5383 1 1 30 GLU HA H -14.225 4.072 3.059 1.00 . A A . 33 GLU HA 1 1 12 5384 1 1 30 GLU HB2 H -14.704 2.053 1.936 1.00 . A A . 33 GLU HB2 1 1 12 5385 1 1 30 GLU HB3 H -13.407 1.199 2.759 1.00 . A A . 33 GLU HB3 1 1 12 5386 1 1 30 GLU HG2 H -14.617 1.078 4.767 1.00 . A A . 33 GLU HG2 1 1 12 5387 1 1 30 GLU HG3 H -15.772 2.300 4.242 1.00 . A A . 33 GLU HG3 1 1 12 5388 1 1 30 GLU N N -12.387 3.513 2.325 1.00 . A A . 33 GLU N 1 1 12 5389 1 1 30 GLU O O -13.854 3.716 5.554 1.00 . A A . 33 GLU O 1 1 12 5390 1 1 30 GLU OE1 O -16.885 0.652 2.490 1.00 . A A . 33 GLU OE1 1 1 12 5391 1 1 30 GLU OE2 O -16.001 -0.765 3.918 1.00 . A A . 33 GLU OE2 1 1 12 5392 1 1 31 THR C C -10.535 4.046 6.636 1.00 . A A . 34 THR C 1 1 12 5393 1 1 31 THR CA C -11.356 2.802 6.311 1.00 . A A . 34 THR CA 1 1 12 5394 1 1 31 THR CB C -10.484 1.550 6.536 1.00 . A A . 34 THR CB 1 1 12 5395 1 1 31 THR CG2 C -9.925 1.517 7.949 1.00 . A A . 34 THR CG2 1 1 12 5396 1 1 31 THR H H -11.312 2.538 4.209 1.00 . A A . 34 THR H 1 1 12 5397 1 1 31 THR HA H -12.198 2.752 6.985 1.00 . A A . 34 THR HA 1 1 12 5398 1 1 31 THR HB H -9.659 1.577 5.839 1.00 . A A . 34 THR HB 1 1 12 5399 1 1 31 THR HG1 H -10.681 -0.401 6.323 1.00 . A A . 34 THR HG1 1 1 12 5400 1 1 31 THR HG21 H -9.377 0.598 8.098 1.00 . A A . 34 THR HG21 1 1 12 5401 1 1 31 THR HG22 H -10.738 1.571 8.659 1.00 . A A . 34 THR HG22 1 1 12 5402 1 1 31 THR HG23 H -9.263 2.357 8.094 1.00 . A A . 34 THR HG23 1 1 12 5403 1 1 31 THR N N -11.874 2.846 4.948 1.00 . A A . 34 THR N 1 1 12 5404 1 1 31 THR O O -10.559 4.536 7.767 1.00 . A A . 34 THR O 1 1 12 5405 1 1 31 THR OG1 O -11.256 0.366 6.297 1.00 . A A . 34 THR OG1 1 1 12 5406 1 1 32 LYS C C -7.637 5.304 6.358 1.00 . A A . 35 LYS C 1 1 12 5407 1 1 32 LYS CA C -8.953 5.712 5.753 1.00 . A A . 35 LYS CA 1 1 12 5408 1 1 32 LYS CB C -9.614 6.828 6.570 1.00 . A A . 35 LYS CB 1 1 12 5409 1 1 32 LYS CD C -11.600 8.319 6.924 1.00 . A A . 35 LYS CD 1 1 12 5410 1 1 32 LYS CE C -13.028 8.626 6.501 1.00 . A A . 35 LYS CE 1 1 12 5411 1 1 32 LYS CG C -10.975 7.250 6.043 1.00 . A A . 35 LYS CG 1 1 12 5412 1 1 32 LYS H H -9.799 4.048 4.786 1.00 . A A . 35 LYS H 1 1 12 5413 1 1 32 LYS HA H -8.754 6.071 4.750 1.00 . A A . 35 LYS HA 1 1 12 5414 1 1 32 LYS HB2 H -9.737 6.490 7.587 1.00 . A A . 35 LYS HB2 1 1 12 5415 1 1 32 LYS HB3 H -8.967 7.693 6.565 1.00 . A A . 35 LYS HB3 1 1 12 5416 1 1 32 LYS HD2 H -11.604 7.972 7.945 1.00 . A A . 35 LYS HD2 1 1 12 5417 1 1 32 LYS HD3 H -11.011 9.222 6.850 1.00 . A A . 35 LYS HD3 1 1 12 5418 1 1 32 LYS HE2 H -13.401 9.439 7.105 1.00 . A A . 35 LYS HE2 1 1 12 5419 1 1 32 LYS HE3 H -13.027 8.920 5.462 1.00 . A A . 35 LYS HE3 1 1 12 5420 1 1 32 LYS HG2 H -10.858 7.643 5.044 1.00 . A A . 35 LYS HG2 1 1 12 5421 1 1 32 LYS HG3 H -11.625 6.388 6.021 1.00 . A A . 35 LYS HG3 1 1 12 5422 1 1 32 LYS HZ1 H -13.963 7.169 7.672 1.00 . A A . 35 LYS HZ1 1 1 12 5423 1 1 32 LYS HZ2 H -13.564 6.643 6.115 1.00 . A A . 35 LYS HZ2 1 1 12 5424 1 1 32 LYS HZ3 H -14.883 7.676 6.345 1.00 . A A . 35 LYS HZ3 1 1 12 5425 1 1 32 LYS N N -9.803 4.531 5.633 1.00 . A A . 35 LYS N 1 1 12 5426 1 1 32 LYS NZ N -13.922 7.446 6.671 1.00 . A A . 35 LYS NZ 1 1 12 5427 1 1 32 LYS O O -7.138 5.922 7.299 1.00 . A A . 35 LYS O 1 1 12 5428 1 1 33 GLN C C -4.761 3.761 5.164 1.00 . A A . 36 GLN C 1 1 12 5429 1 1 33 GLN CA C -5.810 3.722 6.264 1.00 . A A . 36 GLN CA 1 1 12 5430 1 1 33 GLN CB C -5.984 2.292 6.770 1.00 . A A . 36 GLN CB 1 1 12 5431 1 1 33 GLN CD C -4.128 2.502 8.474 1.00 . A A . 36 GLN CD 1 1 12 5432 1 1 33 GLN CG C -4.710 1.685 7.336 1.00 . A A . 36 GLN CG 1 1 12 5433 1 1 33 GLN H H -7.538 3.820 5.023 1.00 . A A . 36 GLN H 1 1 12 5434 1 1 33 GLN HA H -5.479 4.344 7.082 1.00 . A A . 36 GLN HA 1 1 12 5435 1 1 33 GLN HB2 H -6.736 2.285 7.545 1.00 . A A . 36 GLN HB2 1 1 12 5436 1 1 33 GLN HB3 H -6.317 1.676 5.952 1.00 . A A . 36 GLN HB3 1 1 12 5437 1 1 33 GLN HE21 H -3.031 3.552 7.191 1.00 . A A . 36 GLN HE21 1 1 12 5438 1 1 33 GLN HE22 H -2.859 3.985 8.854 1.00 . A A . 36 GLN HE22 1 1 12 5439 1 1 33 GLN HG2 H -4.930 0.693 7.702 1.00 . A A . 36 GLN HG2 1 1 12 5440 1 1 33 GLN HG3 H -3.976 1.621 6.547 1.00 . A A . 36 GLN HG3 1 1 12 5441 1 1 33 GLN N N -7.080 4.248 5.791 1.00 . A A . 36 GLN N 1 1 12 5442 1 1 33 GLN NE2 N -3.251 3.441 8.139 1.00 . A A . 36 GLN NE2 1 1 12 5443 1 1 33 GLN O O -4.735 2.912 4.277 1.00 . A A . 36 GLN O 1 1 12 5444 1 1 33 GLN OE1 O -4.464 2.292 9.639 1.00 . A A . 36 GLN OE1 1 1 12 5445 1 1 34 SER C C -1.469 4.469 4.860 1.00 . A A . 37 SER C 1 1 12 5446 1 1 34 SER CA C -2.811 4.919 4.281 1.00 . A A . 37 SER CA 1 1 12 5447 1 1 34 SER CB C -2.720 6.385 3.854 1.00 . A A . 37 SER CB 1 1 12 5448 1 1 34 SER H H -3.975 5.381 5.991 1.00 . A A . 37 SER H 1 1 12 5449 1 1 34 SER HA H -3.051 4.314 3.420 1.00 . A A . 37 SER HA 1 1 12 5450 1 1 34 SER HB2 H -3.578 6.636 3.250 1.00 . A A . 37 SER HB2 1 1 12 5451 1 1 34 SER HB3 H -2.702 7.014 4.732 1.00 . A A . 37 SER HB3 1 1 12 5452 1 1 34 SER HG H -1.025 7.308 3.521 1.00 . A A . 37 SER HG 1 1 12 5453 1 1 34 SER N N -3.884 4.745 5.256 1.00 . A A . 37 SER N 1 1 12 5454 1 1 34 SER O O -0.904 5.141 5.723 1.00 . A A . 37 SER O 1 1 12 5455 1 1 34 SER OG O -1.548 6.624 3.096 1.00 . A A . 37 SER OG 1 1 12 5456 1 1 35 THR C C 0.829 1.714 3.942 1.00 . A A . 38 THR C 1 1 12 5457 1 1 35 THR CA C 0.308 2.800 4.871 1.00 . A A . 38 THR CA 1 1 12 5458 1 1 35 THR CB C 0.163 2.224 6.293 1.00 . A A . 38 THR CB 1 1 12 5459 1 1 35 THR CG2 C -0.916 1.152 6.334 1.00 . A A . 38 THR CG2 1 1 12 5460 1 1 35 THR H H -1.460 2.829 3.696 1.00 . A A . 38 THR H 1 1 12 5461 1 1 35 THR HA H 1.021 3.611 4.902 1.00 . A A . 38 THR HA 1 1 12 5462 1 1 35 THR HB H -0.119 3.024 6.962 1.00 . A A . 38 THR HB 1 1 12 5463 1 1 35 THR HG1 H 1.590 1.950 7.628 1.00 . A A . 38 THR HG1 1 1 12 5464 1 1 35 THR HG21 H -1.865 1.586 6.055 1.00 . A A . 38 THR HG21 1 1 12 5465 1 1 35 THR HG22 H -0.985 0.749 7.334 1.00 . A A . 38 THR HG22 1 1 12 5466 1 1 35 THR HG23 H -0.665 0.362 5.643 1.00 . A A . 38 THR HG23 1 1 12 5467 1 1 35 THR N N -0.963 3.331 4.384 1.00 . A A . 38 THR N 1 1 12 5468 1 1 35 THR O O 0.106 1.251 3.060 1.00 . A A . 38 THR O 1 1 12 5469 1 1 35 THR OG1 O 1.412 1.669 6.728 1.00 . A A . 38 THR OG1 1 1 12 5470 1 1 36 TRP C C 2.539 -1.087 4.027 1.00 . A A . 39 TRP C 1 1 12 5471 1 1 36 TRP CA C 2.635 0.245 3.293 1.00 . A A . 39 TRP CA 1 1 12 5472 1 1 36 TRP CB C 4.116 0.483 2.952 1.00 . A A . 39 TRP CB 1 1 12 5473 1 1 36 TRP CD1 C 5.155 2.350 4.322 1.00 . A A . 39 TRP CD1 1 1 12 5474 1 1 36 TRP CD2 C 4.771 2.894 2.190 1.00 . A A . 39 TRP CD2 1 1 12 5475 1 1 36 TRP CE2 C 5.365 3.996 2.831 1.00 . A A . 39 TRP CE2 1 1 12 5476 1 1 36 TRP CE3 C 4.438 3.000 0.841 1.00 . A A . 39 TRP CE3 1 1 12 5477 1 1 36 TRP CG C 4.641 1.861 3.166 1.00 . A A . 39 TRP CG 1 1 12 5478 1 1 36 TRP CH2 C 5.307 5.257 0.841 1.00 . A A . 39 TRP CH2 1 1 12 5479 1 1 36 TRP CZ2 C 5.640 5.182 2.162 1.00 . A A . 39 TRP CZ2 1 1 12 5480 1 1 36 TRP CZ3 C 4.709 4.181 0.179 1.00 . A A . 39 TRP CZ3 1 1 12 5481 1 1 36 TRP H H 2.626 1.692 4.845 1.00 . A A . 39 TRP H 1 1 12 5482 1 1 36 TRP HA H 2.057 0.200 2.381 1.00 . A A . 39 TRP HA 1 1 12 5483 1 1 36 TRP HB2 H 4.715 -0.165 3.569 1.00 . A A . 39 TRP HB2 1 1 12 5484 1 1 36 TRP HB3 H 4.279 0.231 1.915 1.00 . A A . 39 TRP HB3 1 1 12 5485 1 1 36 TRP HD1 H 5.201 1.788 5.241 1.00 . A A . 39 TRP HD1 1 1 12 5486 1 1 36 TRP HE1 H 6.001 4.213 4.818 1.00 . A A . 39 TRP HE1 1 1 12 5487 1 1 36 TRP HE3 H 3.976 2.178 0.314 1.00 . A A . 39 TRP HE3 1 1 12 5488 1 1 36 TRP HH2 H 5.502 6.162 0.286 1.00 . A A . 39 TRP HH2 1 1 12 5489 1 1 36 TRP HZ2 H 6.108 6.015 2.655 1.00 . A A . 39 TRP HZ2 1 1 12 5490 1 1 36 TRP HZ3 H 4.460 4.281 -0.867 1.00 . A A . 39 TRP HZ3 1 1 12 5491 1 1 36 TRP N N 2.079 1.294 4.136 1.00 . A A . 39 TRP N 1 1 12 5492 1 1 36 TRP NE1 N 5.593 3.640 4.133 1.00 . A A . 39 TRP NE1 1 1 12 5493 1 1 36 TRP O O 3.335 -1.375 4.920 1.00 . A A . 39 TRP O 1 1 12 5494 1 1 37 GLU C C 0.391 -4.028 3.420 1.00 . A A . 40 GLU C 1 1 12 5495 1 1 37 GLU CA C 1.348 -3.193 4.261 1.00 . A A . 40 GLU CA 1 1 12 5496 1 1 37 GLU CB C 0.791 -3.017 5.679 1.00 . A A . 40 GLU CB 1 1 12 5497 1 1 37 GLU CD C -1.244 -2.802 7.163 1.00 . A A . 40 GLU CD 1 1 12 5498 1 1 37 GLU CG C -0.728 -2.992 5.750 1.00 . A A . 40 GLU CG 1 1 12 5499 1 1 37 GLU H H 0.949 -1.609 2.928 1.00 . A A . 40 GLU H 1 1 12 5500 1 1 37 GLU HA H 2.300 -3.695 4.314 1.00 . A A . 40 GLU HA 1 1 12 5501 1 1 37 GLU HB2 H 1.145 -3.829 6.296 1.00 . A A . 40 GLU HB2 1 1 12 5502 1 1 37 GLU HB3 H 1.160 -2.082 6.080 1.00 . A A . 40 GLU HB3 1 1 12 5503 1 1 37 GLU HG2 H -1.092 -2.180 5.138 1.00 . A A . 40 GLU HG2 1 1 12 5504 1 1 37 GLU HG3 H -1.109 -3.927 5.367 1.00 . A A . 40 GLU HG3 1 1 12 5505 1 1 37 GLU N N 1.555 -1.894 3.642 1.00 . A A . 40 GLU N 1 1 12 5506 1 1 37 GLU O O -0.315 -3.499 2.563 1.00 . A A . 40 GLU O 1 1 12 5507 1 1 37 GLU OE1 O -1.429 -1.637 7.577 1.00 . A A . 40 GLU OE1 1 1 12 5508 1 1 37 GLU OE2 O -1.464 -3.817 7.855 1.00 . A A . 40 GLU OE2 1 1 12 5509 1 1 38 LYS C C -1.957 -5.948 3.306 1.00 . A A . 41 LYS C 1 1 12 5510 1 1 38 LYS CA C -0.496 -6.240 2.967 1.00 . A A . 41 LYS CA 1 1 12 5511 1 1 38 LYS CB C -0.148 -7.672 3.365 1.00 . A A . 41 LYS CB 1 1 12 5512 1 1 38 LYS CD C 0.393 -9.183 5.299 1.00 . A A . 41 LYS CD 1 1 12 5513 1 1 38 LYS CE C 1.245 -10.188 4.541 1.00 . A A . 41 LYS CE 1 1 12 5514 1 1 38 LYS CG C 0.528 -7.784 4.720 1.00 . A A . 41 LYS CG 1 1 12 5515 1 1 38 LYS H H 0.964 -5.689 4.356 1.00 . A A . 41 LYS H 1 1 12 5516 1 1 38 LYS HA H -0.336 -6.115 1.907 1.00 . A A . 41 LYS HA 1 1 12 5517 1 1 38 LYS HB2 H -1.053 -8.234 3.408 1.00 . A A . 41 LYS HB2 1 1 12 5518 1 1 38 LYS HB3 H 0.505 -8.099 2.620 1.00 . A A . 41 LYS HB3 1 1 12 5519 1 1 38 LYS HD2 H 0.708 -9.165 6.332 1.00 . A A . 41 LYS HD2 1 1 12 5520 1 1 38 LYS HD3 H -0.642 -9.486 5.242 1.00 . A A . 41 LYS HD3 1 1 12 5521 1 1 38 LYS HE2 H 1.109 -11.163 4.985 1.00 . A A . 41 LYS HE2 1 1 12 5522 1 1 38 LYS HE3 H 0.919 -10.213 3.511 1.00 . A A . 41 LYS HE3 1 1 12 5523 1 1 38 LYS HG2 H 1.576 -7.551 4.608 1.00 . A A . 41 LYS HG2 1 1 12 5524 1 1 38 LYS HG3 H 0.069 -7.076 5.393 1.00 . A A . 41 LYS HG3 1 1 12 5525 1 1 38 LYS HZ1 H 2.848 -8.916 4.123 1.00 . A A . 41 LYS HZ1 1 1 12 5526 1 1 38 LYS HZ2 H 3.251 -10.557 4.092 1.00 . A A . 41 LYS HZ2 1 1 12 5527 1 1 38 LYS HZ3 H 3.014 -9.774 5.572 1.00 . A A . 41 LYS HZ3 1 1 12 5528 1 1 38 LYS N N 0.375 -5.328 3.673 1.00 . A A . 41 LYS N 1 1 12 5529 1 1 38 LYS NZ N 2.690 -9.834 4.585 1.00 . A A . 41 LYS NZ 1 1 12 5530 1 1 38 LYS O O -2.408 -6.247 4.412 1.00 . A A . 41 LYS O 1 1 12 5531 1 1 39 PRO C C -5.030 -6.252 2.442 1.00 . A A . 42 PRO C 1 1 12 5532 1 1 39 PRO CA C -4.127 -5.034 2.597 1.00 . A A . 42 PRO CA 1 1 12 5533 1 1 39 PRO CB C -4.451 -3.988 1.520 1.00 . A A . 42 PRO CB 1 1 12 5534 1 1 39 PRO CD C -2.304 -4.977 1.017 1.00 . A A . 42 PRO CD 1 1 12 5535 1 1 39 PRO CG C -3.207 -3.816 0.702 1.00 . A A . 42 PRO CG 1 1 12 5536 1 1 39 PRO HA H -4.272 -4.600 3.576 1.00 . A A . 42 PRO HA 1 1 12 5537 1 1 39 PRO HB2 H -5.271 -4.340 0.913 1.00 . A A . 42 PRO HB2 1 1 12 5538 1 1 39 PRO HB3 H -4.733 -3.061 1.998 1.00 . A A . 42 PRO HB3 1 1 12 5539 1 1 39 PRO HD2 H -2.464 -5.784 0.318 1.00 . A A . 42 PRO HD2 1 1 12 5540 1 1 39 PRO HD3 H -1.270 -4.666 1.007 1.00 . A A . 42 PRO HD3 1 1 12 5541 1 1 39 PRO HG2 H -3.463 -3.818 -0.346 1.00 . A A . 42 PRO HG2 1 1 12 5542 1 1 39 PRO HG3 H -2.724 -2.887 0.966 1.00 . A A . 42 PRO HG3 1 1 12 5543 1 1 39 PRO N N -2.724 -5.360 2.368 1.00 . A A . 42 PRO N 1 1 12 5544 1 1 39 PRO O O -5.619 -6.724 3.416 1.00 . A A . 42 PRO O 1 1 13 5545 1 1 12 SER C C -10.447 -1.195 -3.273 1.00 . A A . 15 SER C 1 1 13 5546 1 1 12 SER CA C -10.205 -2.353 -4.232 1.00 . A A . 15 SER CA 1 1 13 5547 1 1 12 SER CB C -11.390 -3.315 -4.190 1.00 . A A . 15 SER CB 1 1 13 5548 1 1 12 SER H H -8.601 -2.933 -2.987 1.00 . A A . 15 SER H 1 1 13 5549 1 1 12 SER HA H -10.097 -1.966 -5.233 1.00 . A A . 15 SER HA 1 1 13 5550 1 1 12 SER HB2 H -11.403 -3.819 -3.236 1.00 . A A . 15 SER HB2 1 1 13 5551 1 1 12 SER HB3 H -12.308 -2.761 -4.317 1.00 . A A . 15 SER HB3 1 1 13 5552 1 1 12 SER HG H -11.760 -5.086 -4.944 1.00 . A A . 15 SER HG 1 1 13 5553 1 1 12 SER N N -8.976 -3.055 -3.883 1.00 . A A . 15 SER N 1 1 13 5554 1 1 12 SER O O -10.467 -0.033 -3.677 1.00 . A A . 15 SER O 1 1 13 5555 1 1 12 SER OG O -11.298 -4.289 -5.216 1.00 . A A . 15 SER OG 1 1 13 5556 1 1 13 MET C C -9.587 0.263 -0.690 1.00 . A A . 16 MET C 1 1 13 5557 1 1 13 MET CA C -10.865 -0.518 -0.973 1.00 . A A . 16 MET CA 1 1 13 5558 1 1 13 MET CB C -11.365 -1.175 0.316 1.00 . A A . 16 MET CB 1 1 13 5559 1 1 13 MET CE C -13.286 -1.434 2.815 1.00 . A A . 16 MET CE 1 1 13 5560 1 1 13 MET CG C -12.673 -1.929 0.152 1.00 . A A . 16 MET CG 1 1 13 5561 1 1 13 MET H H -10.609 -2.471 -1.742 1.00 . A A . 16 MET H 1 1 13 5562 1 1 13 MET HA H -11.618 0.163 -1.338 1.00 . A A . 16 MET HA 1 1 13 5563 1 1 13 MET HB2 H -10.615 -1.869 0.666 1.00 . A A . 16 MET HB2 1 1 13 5564 1 1 13 MET HB3 H -11.508 -0.408 1.064 1.00 . A A . 16 MET HB3 1 1 13 5565 1 1 13 MET HE1 H -14.040 -0.738 2.478 1.00 . A A . 16 MET HE1 1 1 13 5566 1 1 13 MET HE2 H -12.333 -0.929 2.877 1.00 . A A . 16 MET HE2 1 1 13 5567 1 1 13 MET HE3 H -13.555 -1.813 3.790 1.00 . A A . 16 MET HE3 1 1 13 5568 1 1 13 MET HG2 H -13.448 -1.226 -0.112 1.00 . A A . 16 MET HG2 1 1 13 5569 1 1 13 MET HG3 H -12.559 -2.652 -0.642 1.00 . A A . 16 MET HG3 1 1 13 5570 1 1 13 MET N N -10.631 -1.525 -1.998 1.00 . A A . 16 MET N 1 1 13 5571 1 1 13 MET O O -9.616 1.298 -0.028 1.00 . A A . 16 MET O 1 1 13 5572 1 1 13 MET SD S -13.167 -2.796 1.656 1.00 . A A . 16 MET SD 1 1 13 5573 1 1 14 TRP C C -6.641 0.990 -2.290 1.00 . A A . 17 TRP C 1 1 13 5574 1 1 14 TRP CA C -7.177 0.405 -0.995 1.00 . A A . 17 TRP CA 1 1 13 5575 1 1 14 TRP CB C -6.157 -0.585 -0.434 1.00 . A A . 17 TRP CB 1 1 13 5576 1 1 14 TRP CD1 C -7.630 -2.195 0.902 1.00 . A A . 17 TRP CD1 1 1 13 5577 1 1 14 TRP CD2 C -6.074 -1.134 2.102 1.00 . A A . 17 TRP CD2 1 1 13 5578 1 1 14 TRP CE2 C -6.802 -1.974 2.962 1.00 . A A . 17 TRP CE2 1 1 13 5579 1 1 14 TRP CE3 C -5.038 -0.363 2.624 1.00 . A A . 17 TRP CE3 1 1 13 5580 1 1 14 TRP CG C -6.619 -1.286 0.798 1.00 . A A . 17 TRP CG 1 1 13 5581 1 1 14 TRP CH2 C -5.502 -1.294 4.809 1.00 . A A . 17 TRP CH2 1 1 13 5582 1 1 14 TRP CZ2 C -6.525 -2.062 4.322 1.00 . A A . 17 TRP CZ2 1 1 13 5583 1 1 14 TRP CZ3 C -4.760 -0.451 3.970 1.00 . A A . 17 TRP CZ3 1 1 13 5584 1 1 14 TRP H H -8.509 -1.069 -1.724 1.00 . A A . 17 TRP H 1 1 13 5585 1 1 14 TRP HA H -7.317 1.204 -0.284 1.00 . A A . 17 TRP HA 1 1 13 5586 1 1 14 TRP HB2 H -5.936 -1.332 -1.177 1.00 . A A . 17 TRP HB2 1 1 13 5587 1 1 14 TRP HB3 H -5.249 -0.049 -0.187 1.00 . A A . 17 TRP HB3 1 1 13 5588 1 1 14 TRP HD1 H -8.241 -2.525 0.075 1.00 . A A . 17 TRP HD1 1 1 13 5589 1 1 14 TRP HE1 H -8.401 -3.264 2.531 1.00 . A A . 17 TRP HE1 1 1 13 5590 1 1 14 TRP HE3 H -4.456 0.290 1.988 1.00 . A A . 17 TRP HE3 1 1 13 5591 1 1 14 TRP HH2 H -5.249 -1.331 5.859 1.00 . A A . 17 TRP HH2 1 1 13 5592 1 1 14 TRP HZ2 H -7.089 -2.705 4.980 1.00 . A A . 17 TRP HZ2 1 1 13 5593 1 1 14 TRP HZ3 H -3.962 0.138 4.389 1.00 . A A . 17 TRP HZ3 1 1 13 5594 1 1 14 TRP N N -8.467 -0.243 -1.200 1.00 . A A . 17 TRP N 1 1 13 5595 1 1 14 TRP NE1 N -7.749 -2.613 2.202 1.00 . A A . 17 TRP NE1 1 1 13 5596 1 1 14 TRP O O -6.643 0.332 -3.331 1.00 . A A . 17 TRP O 1 1 13 5597 1 1 15 THR C C -4.113 3.063 -3.194 1.00 . A A . 18 THR C 1 1 13 5598 1 1 15 THR CA C -5.619 2.902 -3.370 1.00 . A A . 18 THR CA 1 1 13 5599 1 1 15 THR CB C -6.258 4.284 -3.582 1.00 . A A . 18 THR CB 1 1 13 5600 1 1 15 THR CG2 C -7.692 4.150 -4.072 1.00 . A A . 18 THR CG2 1 1 13 5601 1 1 15 THR H H -6.228 2.709 -1.365 1.00 . A A . 18 THR H 1 1 13 5602 1 1 15 THR HA H -5.817 2.293 -4.239 1.00 . A A . 18 THR HA 1 1 13 5603 1 1 15 THR HB H -5.688 4.814 -4.327 1.00 . A A . 18 THR HB 1 1 13 5604 1 1 15 THR HG1 H -7.088 5.443 -2.218 1.00 . A A . 18 THR HG1 1 1 13 5605 1 1 15 THR HG21 H -7.703 3.625 -5.016 1.00 . A A . 18 THR HG21 1 1 13 5606 1 1 15 THR HG22 H -8.123 5.132 -4.202 1.00 . A A . 18 THR HG22 1 1 13 5607 1 1 15 THR HG23 H -8.271 3.596 -3.346 1.00 . A A . 18 THR HG23 1 1 13 5608 1 1 15 THR N N -6.183 2.231 -2.218 1.00 . A A . 18 THR N 1 1 13 5609 1 1 15 THR O O -3.662 3.779 -2.301 1.00 . A A . 18 THR O 1 1 13 5610 1 1 15 THR OG1 O -6.233 5.031 -2.359 1.00 . A A . 18 THR OG1 1 1 13 5611 1 1 16 GLU C C -1.284 3.451 -4.960 1.00 . A A . 19 GLU C 1 1 13 5612 1 1 16 GLU CA C -1.889 2.478 -3.952 1.00 . A A . 19 GLU CA 1 1 13 5613 1 1 16 GLU CB C -1.284 1.085 -4.144 1.00 . A A . 19 GLU CB 1 1 13 5614 1 1 16 GLU CD C -2.668 0.474 -6.174 1.00 . A A . 19 GLU CD 1 1 13 5615 1 1 16 GLU CG C -1.275 0.596 -5.586 1.00 . A A . 19 GLU CG 1 1 13 5616 1 1 16 GLU H H -3.742 1.843 -4.730 1.00 . A A . 19 GLU H 1 1 13 5617 1 1 16 GLU HA H -1.652 2.820 -2.962 1.00 . A A . 19 GLU HA 1 1 13 5618 1 1 16 GLU HB2 H -0.268 1.100 -3.789 1.00 . A A . 19 GLU HB2 1 1 13 5619 1 1 16 GLU HB3 H -1.850 0.380 -3.554 1.00 . A A . 19 GLU HB3 1 1 13 5620 1 1 16 GLU HG2 H -0.708 1.293 -6.185 1.00 . A A . 19 GLU HG2 1 1 13 5621 1 1 16 GLU HG3 H -0.799 -0.373 -5.619 1.00 . A A . 19 GLU HG3 1 1 13 5622 1 1 16 GLU N N -3.337 2.410 -4.051 1.00 . A A . 19 GLU N 1 1 13 5623 1 1 16 GLU O O -1.610 3.433 -6.146 1.00 . A A . 19 GLU O 1 1 13 5624 1 1 16 GLU OE1 O -3.370 -0.501 -5.836 1.00 . A A . 19 GLU OE1 1 1 13 5625 1 1 16 GLU OE2 O -3.054 1.351 -6.974 1.00 . A A . 19 GLU OE2 1 1 13 5626 1 1 17 HIS C C 1.679 5.585 -4.743 1.00 . A A . 20 HIS C 1 1 13 5627 1 1 17 HIS CA C 0.279 5.308 -5.282 1.00 . A A . 20 HIS CA 1 1 13 5628 1 1 17 HIS CB C -0.506 6.620 -5.311 1.00 . A A . 20 HIS CB 1 1 13 5629 1 1 17 HIS CD2 C -3.052 6.293 -4.922 1.00 . A A . 20 HIS CD2 1 1 13 5630 1 1 17 HIS CE1 C -3.702 6.330 -7.016 1.00 . A A . 20 HIS CE1 1 1 13 5631 1 1 17 HIS CG C -1.947 6.466 -5.690 1.00 . A A . 20 HIS CG 1 1 13 5632 1 1 17 HIS H H -0.205 4.281 -3.494 1.00 . A A . 20 HIS H 1 1 13 5633 1 1 17 HIS HA H 0.356 4.917 -6.285 1.00 . A A . 20 HIS HA 1 1 13 5634 1 1 17 HIS HB2 H -0.470 7.073 -4.331 1.00 . A A . 20 HIS HB2 1 1 13 5635 1 1 17 HIS HB3 H -0.041 7.285 -6.023 1.00 . A A . 20 HIS HB3 1 1 13 5636 1 1 17 HIS HD1 H -1.826 6.594 -7.789 1.00 . A A . 20 HIS HD1 1 1 13 5637 1 1 17 HIS HD2 H -3.080 6.232 -3.840 1.00 . A A . 20 HIS HD2 1 1 13 5638 1 1 17 HIS HE1 H -4.321 6.304 -7.901 1.00 . A A . 20 HIS HE1 1 1 13 5639 1 1 17 HIS HE2 H -5.068 6.191 -5.497 1.00 . A A . 20 HIS HE2 1 1 13 5640 1 1 17 HIS N N -0.402 4.315 -4.456 1.00 . A A . 20 HIS N 1 1 13 5641 1 1 17 HIS ND1 N -2.390 6.484 -6.996 1.00 . A A . 20 HIS ND1 1 1 13 5642 1 1 17 HIS NE2 N -4.128 6.212 -5.771 1.00 . A A . 20 HIS NE2 1 1 13 5643 1 1 17 HIS O O 1.886 5.601 -3.529 1.00 . A A . 20 HIS O 1 1 13 5644 1 1 18 LYS C C 4.055 7.147 -4.160 1.00 . A A . 21 LYS C 1 1 13 5645 1 1 18 LYS CA C 4.011 6.086 -5.249 1.00 . A A . 21 LYS CA 1 1 13 5646 1 1 18 LYS CB C 4.830 6.547 -6.453 1.00 . A A . 21 LYS CB 1 1 13 5647 1 1 18 LYS CD C 3.959 6.102 -8.807 1.00 . A A . 21 LYS CD 1 1 13 5648 1 1 18 LYS CE C 2.784 6.991 -8.414 1.00 . A A . 21 LYS CE 1 1 13 5649 1 1 18 LYS CG C 4.759 5.572 -7.613 1.00 . A A . 21 LYS CG 1 1 13 5650 1 1 18 LYS H H 2.424 5.715 -6.601 1.00 . A A . 21 LYS H 1 1 13 5651 1 1 18 LYS HA H 4.438 5.177 -4.863 1.00 . A A . 21 LYS HA 1 1 13 5652 1 1 18 LYS HB2 H 4.468 7.508 -6.782 1.00 . A A . 21 LYS HB2 1 1 13 5653 1 1 18 LYS HB3 H 5.864 6.644 -6.155 1.00 . A A . 21 LYS HB3 1 1 13 5654 1 1 18 LYS HD2 H 4.619 6.667 -9.446 1.00 . A A . 21 LYS HD2 1 1 13 5655 1 1 18 LYS HD3 H 3.575 5.253 -9.352 1.00 . A A . 21 LYS HD3 1 1 13 5656 1 1 18 LYS HE2 H 2.102 6.418 -7.806 1.00 . A A . 21 LYS HE2 1 1 13 5657 1 1 18 LYS HE3 H 3.154 7.831 -7.846 1.00 . A A . 21 LYS HE3 1 1 13 5658 1 1 18 LYS HG2 H 5.764 5.357 -7.944 1.00 . A A . 21 LYS HG2 1 1 13 5659 1 1 18 LYS HG3 H 4.300 4.663 -7.259 1.00 . A A . 21 LYS HG3 1 1 13 5660 1 1 18 LYS HZ1 H 1.719 6.704 -10.188 1.00 . A A . 21 LYS HZ1 1 1 13 5661 1 1 18 LYS HZ2 H 2.677 8.097 -10.182 1.00 . A A . 21 LYS HZ2 1 1 13 5662 1 1 18 LYS HZ3 H 1.230 8.065 -9.307 1.00 . A A . 21 LYS HZ3 1 1 13 5663 1 1 18 LYS N N 2.638 5.792 -5.646 1.00 . A A . 21 LYS N 1 1 13 5664 1 1 18 LYS NZ N 2.051 7.500 -9.606 1.00 . A A . 21 LYS NZ 1 1 13 5665 1 1 18 LYS O O 3.160 7.987 -4.057 1.00 . A A . 21 LYS O 1 1 13 5666 1 1 19 SER C C 6.728 8.181 -1.819 1.00 . A A . 22 SER C 1 1 13 5667 1 1 19 SER CA C 5.261 8.054 -2.261 1.00 . A A . 22 SER CA 1 1 13 5668 1 1 19 SER CB C 4.372 7.632 -1.093 1.00 . A A . 22 SER CB 1 1 13 5669 1 1 19 SER H H 5.789 6.418 -3.491 1.00 . A A . 22 SER H 1 1 13 5670 1 1 19 SER HA H 4.928 9.016 -2.618 1.00 . A A . 22 SER HA 1 1 13 5671 1 1 19 SER HB2 H 3.991 6.637 -1.272 1.00 . A A . 22 SER HB2 1 1 13 5672 1 1 19 SER HB3 H 4.951 7.638 -0.181 1.00 . A A . 22 SER HB3 1 1 13 5673 1 1 19 SER HG H 3.393 9.269 -1.535 1.00 . A A . 22 SER HG 1 1 13 5674 1 1 19 SER N N 5.106 7.105 -3.352 1.00 . A A . 22 SER N 1 1 13 5675 1 1 19 SER O O 7.568 7.349 -2.192 1.00 . A A . 22 SER O 1 1 13 5676 1 1 19 SER OG O 3.279 8.520 -0.944 1.00 . A A . 22 SER OG 1 1 13 5677 1 1 20 PRO C C 9.418 8.471 -0.563 1.00 . A A . 23 PRO C 1 1 13 5678 1 1 20 PRO CA C 8.350 9.557 -0.466 1.00 . A A . 23 PRO CA 1 1 13 5679 1 1 20 PRO CB C 8.033 9.873 0.996 1.00 . A A . 23 PRO CB 1 1 13 5680 1 1 20 PRO CD C 6.056 10.151 -0.392 1.00 . A A . 23 PRO CD 1 1 13 5681 1 1 20 PRO CG C 6.612 10.368 0.999 1.00 . A A . 23 PRO CG 1 1 13 5682 1 1 20 PRO HA H 8.725 10.453 -0.937 1.00 . A A . 23 PRO HA 1 1 13 5683 1 1 20 PRO HB2 H 8.136 8.975 1.588 1.00 . A A . 23 PRO HB2 1 1 13 5684 1 1 20 PRO HB3 H 8.713 10.628 1.359 1.00 . A A . 23 PRO HB3 1 1 13 5685 1 1 20 PRO HD2 H 5.072 9.717 -0.338 1.00 . A A . 23 PRO HD2 1 1 13 5686 1 1 20 PRO HD3 H 6.029 11.077 -0.942 1.00 . A A . 23 PRO HD3 1 1 13 5687 1 1 20 PRO HG2 H 6.035 9.805 1.720 1.00 . A A . 23 PRO HG2 1 1 13 5688 1 1 20 PRO HG3 H 6.594 11.420 1.248 1.00 . A A . 23 PRO HG3 1 1 13 5689 1 1 20 PRO N N 7.024 9.215 -0.981 1.00 . A A . 23 PRO N 1 1 13 5690 1 1 20 PRO O O 10.446 8.669 -1.214 1.00 . A A . 23 PRO O 1 1 13 5691 1 1 21 ASP C C 10.275 5.569 -1.281 1.00 . A A . 24 ASP C 1 1 13 5692 1 1 21 ASP CA C 10.176 6.254 0.086 1.00 . A A . 24 ASP CA 1 1 13 5693 1 1 21 ASP CB C 9.832 5.233 1.172 1.00 . A A . 24 ASP CB 1 1 13 5694 1 1 21 ASP CG C 11.023 4.384 1.570 1.00 . A A . 24 ASP CG 1 1 13 5695 1 1 21 ASP H H 8.356 7.225 0.582 1.00 . A A . 24 ASP H 1 1 13 5696 1 1 21 ASP HA H 11.137 6.690 0.317 1.00 . A A . 24 ASP HA 1 1 13 5697 1 1 21 ASP HB2 H 9.477 5.755 2.048 1.00 . A A . 24 ASP HB2 1 1 13 5698 1 1 21 ASP HB3 H 9.052 4.581 0.810 1.00 . A A . 24 ASP HB3 1 1 13 5699 1 1 21 ASP N N 9.194 7.338 0.089 1.00 . A A . 24 ASP N 1 1 13 5700 1 1 21 ASP O O 10.659 4.404 -1.371 1.00 . A A . 24 ASP O 1 1 13 5701 1 1 21 ASP OD1 O 11.759 4.791 2.493 1.00 . A A . 24 ASP OD1 1 1 13 5702 1 1 21 ASP OD2 O 11.221 3.312 0.961 1.00 . A A . 24 ASP OD2 1 1 13 5703 1 1 22 GLY C C 9.255 4.448 -3.803 1.00 . A A . 25 GLY C 1 1 13 5704 1 1 22 GLY CA C 10.002 5.752 -3.683 1.00 . A A . 25 GLY CA 1 1 13 5705 1 1 22 GLY H H 9.637 7.221 -2.212 1.00 . A A . 25 GLY H 1 1 13 5706 1 1 22 GLY HA2 H 9.566 6.462 -4.376 1.00 . A A . 25 GLY HA2 1 1 13 5707 1 1 22 GLY HA3 H 11.035 5.593 -3.946 1.00 . A A . 25 GLY HA3 1 1 13 5708 1 1 22 GLY N N 9.937 6.303 -2.342 1.00 . A A . 25 GLY N 1 1 13 5709 1 1 22 GLY O O 9.660 3.549 -4.539 1.00 . A A . 25 GLY O 1 1 13 5710 1 1 23 ARG C C 5.863 3.546 -3.064 1.00 . A A . 26 ARG C 1 1 13 5711 1 1 23 ARG CA C 7.326 3.152 -3.095 1.00 . A A . 26 ARG CA 1 1 13 5712 1 1 23 ARG CB C 7.668 2.198 -1.942 1.00 . A A . 26 ARG CB 1 1 13 5713 1 1 23 ARG CD C 8.609 1.918 0.364 1.00 . A A . 26 ARG CD 1 1 13 5714 1 1 23 ARG CG C 7.979 2.883 -0.628 1.00 . A A . 26 ARG CG 1 1 13 5715 1 1 23 ARG CZ C 7.906 0.015 1.756 1.00 . A A . 26 ARG CZ 1 1 13 5716 1 1 23 ARG H H 7.884 5.116 -2.511 1.00 . A A . 26 ARG H 1 1 13 5717 1 1 23 ARG HA H 7.518 2.646 -4.032 1.00 . A A . 26 ARG HA 1 1 13 5718 1 1 23 ARG HB2 H 6.834 1.532 -1.783 1.00 . A A . 26 ARG HB2 1 1 13 5719 1 1 23 ARG HB3 H 8.529 1.615 -2.224 1.00 . A A . 26 ARG HB3 1 1 13 5720 1 1 23 ARG HD2 H 9.497 1.494 -0.081 1.00 . A A . 26 ARG HD2 1 1 13 5721 1 1 23 ARG HD3 H 8.881 2.466 1.254 1.00 . A A . 26 ARG HD3 1 1 13 5722 1 1 23 ARG HE H 6.894 0.716 0.185 1.00 . A A . 26 ARG HE 1 1 13 5723 1 1 23 ARG HG2 H 8.663 3.690 -0.815 1.00 . A A . 26 ARG HG2 1 1 13 5724 1 1 23 ARG HG3 H 7.068 3.269 -0.205 1.00 . A A . 26 ARG HG3 1 1 13 5725 1 1 23 ARG HH11 H 9.652 0.869 2.313 1.00 . A A . 26 ARG HH11 1 1 13 5726 1 1 23 ARG HH12 H 9.139 -0.470 3.283 1.00 . A A . 26 ARG HH12 1 1 13 5727 1 1 23 ARG HH21 H 6.213 -1.048 1.461 1.00 . A A . 26 ARG HH21 1 1 13 5728 1 1 23 ARG HH22 H 7.187 -1.559 2.799 1.00 . A A . 26 ARG HH22 1 1 13 5729 1 1 23 ARG N N 8.155 4.351 -3.072 1.00 . A A . 26 ARG N 1 1 13 5730 1 1 23 ARG NE N 7.700 0.836 0.731 1.00 . A A . 26 ARG NE 1 1 13 5731 1 1 23 ARG NH1 N 8.988 0.149 2.512 1.00 . A A . 26 ARG NH1 1 1 13 5732 1 1 23 ARG NH2 N 7.030 -0.942 2.028 1.00 . A A . 26 ARG NH2 1 1 13 5733 1 1 23 ARG O O 5.537 4.696 -2.791 1.00 . A A . 26 ARG O 1 1 13 5734 1 1 24 THR C C 2.861 2.466 -2.077 1.00 . A A . 27 THR C 1 1 13 5735 1 1 24 THR CA C 3.560 2.904 -3.359 1.00 . A A . 27 THR CA 1 1 13 5736 1 1 24 THR CB C 2.868 2.233 -4.561 1.00 . A A . 27 THR CB 1 1 13 5737 1 1 24 THR CG2 C 3.044 0.721 -4.520 1.00 . A A . 27 THR CG2 1 1 13 5738 1 1 24 THR H H 5.285 1.684 -3.505 1.00 . A A . 27 THR H 1 1 13 5739 1 1 24 THR HA H 3.460 3.976 -3.465 1.00 . A A . 27 THR HA 1 1 13 5740 1 1 24 THR HB H 3.314 2.607 -5.470 1.00 . A A . 27 THR HB 1 1 13 5741 1 1 24 THR HG1 H 1.261 3.069 -3.785 1.00 . A A . 27 THR HG1 1 1 13 5742 1 1 24 THR HG21 H 2.537 0.277 -5.364 1.00 . A A . 27 THR HG21 1 1 13 5743 1 1 24 THR HG22 H 2.623 0.335 -3.603 1.00 . A A . 27 THR HG22 1 1 13 5744 1 1 24 THR HG23 H 4.096 0.480 -4.562 1.00 . A A . 27 THR HG23 1 1 13 5745 1 1 24 THR N N 4.980 2.598 -3.329 1.00 . A A . 27 THR N 1 1 13 5746 1 1 24 THR O O 3.005 1.328 -1.629 1.00 . A A . 27 THR O 1 1 13 5747 1 1 24 THR OG1 O 1.472 2.548 -4.562 1.00 . A A . 27 THR OG1 1 1 13 5748 1 1 25 TYR C C -0.092 2.922 -0.576 1.00 . A A . 28 TYR C 1 1 13 5749 1 1 25 TYR CA C 1.375 3.121 -0.260 1.00 . A A . 28 TYR CA 1 1 13 5750 1 1 25 TYR CB C 1.535 4.274 0.738 1.00 . A A . 28 TYR CB 1 1 13 5751 1 1 25 TYR CD1 C 1.194 6.448 -0.513 1.00 . A A . 28 TYR CD1 1 1 13 5752 1 1 25 TYR CD2 C -0.525 5.719 0.969 1.00 . A A . 28 TYR CD2 1 1 13 5753 1 1 25 TYR CE1 C 0.449 7.567 -0.831 1.00 . A A . 28 TYR CE1 1 1 13 5754 1 1 25 TYR CE2 C -1.275 6.838 0.656 1.00 . A A . 28 TYR CE2 1 1 13 5755 1 1 25 TYR CG C 0.720 5.504 0.391 1.00 . A A . 28 TYR CG 1 1 13 5756 1 1 25 TYR CZ C -0.782 7.758 -0.244 1.00 . A A . 28 TYR CZ 1 1 13 5757 1 1 25 TYR H H 2.044 4.281 -1.893 1.00 . A A . 28 TYR H 1 1 13 5758 1 1 25 TYR HA H 1.770 2.214 0.175 1.00 . A A . 28 TYR HA 1 1 13 5759 1 1 25 TYR HB2 H 1.224 3.937 1.713 1.00 . A A . 28 TYR HB2 1 1 13 5760 1 1 25 TYR HB3 H 2.573 4.564 0.777 1.00 . A A . 28 TYR HB3 1 1 13 5761 1 1 25 TYR HD1 H 2.163 6.300 -0.971 1.00 . A A . 28 TYR HD1 1 1 13 5762 1 1 25 TYR HD2 H -0.907 4.997 1.674 1.00 . A A . 28 TYR HD2 1 1 13 5763 1 1 25 TYR HE1 H 0.835 8.289 -1.537 1.00 . A A . 28 TYR HE1 1 1 13 5764 1 1 25 TYR HE2 H -2.240 6.987 1.116 1.00 . A A . 28 TYR HE2 1 1 13 5765 1 1 25 TYR HH H -1.556 8.979 -1.512 1.00 . A A . 28 TYR HH 1 1 13 5766 1 1 25 TYR N N 2.108 3.392 -1.488 1.00 . A A . 28 TYR N 1 1 13 5767 1 1 25 TYR O O -0.612 3.522 -1.514 1.00 . A A . 28 TYR O 1 1 13 5768 1 1 25 TYR OH O -1.526 8.872 -0.559 1.00 . A A . 28 TYR OH 1 1 13 5769 1 1 26 TYR C C -3.024 2.589 1.002 1.00 . A A . 29 TYR C 1 1 13 5770 1 1 26 TYR CA C -2.173 1.829 0.002 1.00 . A A . 29 TYR CA 1 1 13 5771 1 1 26 TYR CB C -2.451 0.329 0.105 1.00 . A A . 29 TYR CB 1 1 13 5772 1 1 26 TYR CD1 C -0.322 -0.861 0.768 1.00 . A A . 29 TYR CD1 1 1 13 5773 1 1 26 TYR CD2 C -1.040 -1.014 -1.499 1.00 . A A . 29 TYR CD2 1 1 13 5774 1 1 26 TYR CE1 C 0.780 -1.642 0.476 1.00 . A A . 29 TYR CE1 1 1 13 5775 1 1 26 TYR CE2 C 0.058 -1.796 -1.798 1.00 . A A . 29 TYR CE2 1 1 13 5776 1 1 26 TYR CG C -1.250 -0.534 -0.214 1.00 . A A . 29 TYR CG 1 1 13 5777 1 1 26 TYR CZ C 0.966 -2.106 -0.809 1.00 . A A . 29 TYR CZ 1 1 13 5778 1 1 26 TYR H H -0.308 1.694 0.989 1.00 . A A . 29 TYR H 1 1 13 5779 1 1 26 TYR HA H -2.423 2.164 -0.994 1.00 . A A . 29 TYR HA 1 1 13 5780 1 1 26 TYR HB2 H -2.770 0.100 1.104 1.00 . A A . 29 TYR HB2 1 1 13 5781 1 1 26 TYR HB3 H -3.242 0.069 -0.582 1.00 . A A . 29 TYR HB3 1 1 13 5782 1 1 26 TYR HD1 H -0.471 -0.496 1.774 1.00 . A A . 29 TYR HD1 1 1 13 5783 1 1 26 TYR HD2 H -1.753 -0.770 -2.272 1.00 . A A . 29 TYR HD2 1 1 13 5784 1 1 26 TYR HE1 H 1.490 -1.886 1.252 1.00 . A A . 29 TYR HE1 1 1 13 5785 1 1 26 TYR HE2 H 0.203 -2.159 -2.805 1.00 . A A . 29 TYR HE2 1 1 13 5786 1 1 26 TYR HH H 2.154 -3.571 -0.441 1.00 . A A . 29 TYR HH 1 1 13 5787 1 1 26 TYR N N -0.764 2.106 0.224 1.00 . A A . 29 TYR N 1 1 13 5788 1 1 26 TYR O O -2.913 2.392 2.213 1.00 . A A . 29 TYR O 1 1 13 5789 1 1 26 TYR OH O 2.061 -2.883 -1.104 1.00 . A A . 29 TYR OH 1 1 13 5790 1 1 27 TYR C C -6.165 3.723 1.241 1.00 . A A . 30 TYR C 1 1 13 5791 1 1 27 TYR CA C -4.747 4.267 1.303 1.00 . A A . 30 TYR CA 1 1 13 5792 1 1 27 TYR CB C -4.703 5.727 0.838 1.00 . A A . 30 TYR CB 1 1 13 5793 1 1 27 TYR CD1 C -6.183 6.799 2.586 1.00 . A A . 30 TYR CD1 1 1 13 5794 1 1 27 TYR CD2 C -6.772 7.069 0.292 1.00 . A A . 30 TYR CD2 1 1 13 5795 1 1 27 TYR CE1 C -7.282 7.548 2.961 1.00 . A A . 30 TYR CE1 1 1 13 5796 1 1 27 TYR CE2 C -7.873 7.820 0.659 1.00 . A A . 30 TYR CE2 1 1 13 5797 1 1 27 TYR CG C -5.909 6.546 1.247 1.00 . A A . 30 TYR CG 1 1 13 5798 1 1 27 TYR CZ C -8.123 8.056 1.995 1.00 . A A . 30 TYR CZ 1 1 13 5799 1 1 27 TYR H H -3.900 3.568 -0.491 1.00 . A A . 30 TYR H 1 1 13 5800 1 1 27 TYR HA H -4.395 4.210 2.321 1.00 . A A . 30 TYR HA 1 1 13 5801 1 1 27 TYR HB2 H -3.828 6.200 1.259 1.00 . A A . 30 TYR HB2 1 1 13 5802 1 1 27 TYR HB3 H -4.631 5.750 -0.241 1.00 . A A . 30 TYR HB3 1 1 13 5803 1 1 27 TYR HD1 H -5.522 6.400 3.340 1.00 . A A . 30 TYR HD1 1 1 13 5804 1 1 27 TYR HD2 H -6.575 6.882 -0.753 1.00 . A A . 30 TYR HD2 1 1 13 5805 1 1 27 TYR HE1 H -7.478 7.732 4.007 1.00 . A A . 30 TYR HE1 1 1 13 5806 1 1 27 TYR HE2 H -8.532 8.217 -0.099 1.00 . A A . 30 TYR HE2 1 1 13 5807 1 1 27 TYR HH H -9.979 8.537 1.841 1.00 . A A . 30 TYR HH 1 1 13 5808 1 1 27 TYR N N -3.867 3.462 0.479 1.00 . A A . 30 TYR N 1 1 13 5809 1 1 27 TYR O O -6.858 3.868 0.233 1.00 . A A . 30 TYR O 1 1 13 5810 1 1 27 TYR OH O -9.219 8.802 2.365 1.00 . A A . 30 TYR OH 1 1 13 5811 1 1 28 ASN C C -8.920 3.662 2.415 1.00 . A A . 31 ASN C 1 1 13 5812 1 1 28 ASN CA C -7.919 2.527 2.404 1.00 . A A . 31 ASN CA 1 1 13 5813 1 1 28 ASN CB C -8.065 1.675 3.670 1.00 . A A . 31 ASN CB 1 1 13 5814 1 1 28 ASN CG C -9.171 0.639 3.563 1.00 . A A . 31 ASN CG 1 1 13 5815 1 1 28 ASN H H -6.004 3.035 3.107 1.00 . A A . 31 ASN H 1 1 13 5816 1 1 28 ASN HA H -8.081 1.913 1.530 1.00 . A A . 31 ASN HA 1 1 13 5817 1 1 28 ASN HB2 H -7.135 1.160 3.855 1.00 . A A . 31 ASN HB2 1 1 13 5818 1 1 28 ASN HB3 H -8.284 2.323 4.505 1.00 . A A . 31 ASN HB3 1 1 13 5819 1 1 28 ASN HD21 H -10.118 1.736 2.207 1.00 . A A . 31 ASN HD21 1 1 13 5820 1 1 28 ASN HD22 H -10.879 0.246 2.628 1.00 . A A . 31 ASN HD22 1 1 13 5821 1 1 28 ASN N N -6.589 3.092 2.328 1.00 . A A . 31 ASN N 1 1 13 5822 1 1 28 ASN ND2 N -10.155 0.902 2.713 1.00 . A A . 31 ASN ND2 1 1 13 5823 1 1 28 ASN O O -9.014 4.385 3.399 1.00 . A A . 31 ASN O 1 1 13 5824 1 1 28 ASN OD1 O -9.136 -0.391 4.236 1.00 . A A . 31 ASN OD1 1 1 13 5825 1 1 29 THR C C -11.712 4.804 2.220 1.00 . A A . 32 THR C 1 1 13 5826 1 1 29 THR CA C -10.615 4.899 1.165 1.00 . A A . 32 THR CA 1 1 13 5827 1 1 29 THR CB C -11.265 4.879 -0.230 1.00 . A A . 32 THR CB 1 1 13 5828 1 1 29 THR CG2 C -10.227 5.133 -1.313 1.00 . A A . 32 THR CG2 1 1 13 5829 1 1 29 THR H H -9.468 3.232 0.541 1.00 . A A . 32 THR H 1 1 13 5830 1 1 29 THR HA H -10.102 5.843 1.281 1.00 . A A . 32 THR HA 1 1 13 5831 1 1 29 THR HB H -12.011 5.660 -0.276 1.00 . A A . 32 THR HB 1 1 13 5832 1 1 29 THR HG1 H -12.851 3.718 -0.405 1.00 . A A . 32 THR HG1 1 1 13 5833 1 1 29 THR HG21 H -9.773 6.100 -1.157 1.00 . A A . 32 THR HG21 1 1 13 5834 1 1 29 THR HG22 H -10.706 5.113 -2.282 1.00 . A A . 32 THR HG22 1 1 13 5835 1 1 29 THR HG23 H -9.468 4.367 -1.272 1.00 . A A . 32 THR HG23 1 1 13 5836 1 1 29 THR N N -9.626 3.834 1.300 1.00 . A A . 32 THR N 1 1 13 5837 1 1 29 THR O O -12.019 5.787 2.895 1.00 . A A . 32 THR O 1 1 13 5838 1 1 29 THR OG1 O -11.898 3.613 -0.458 1.00 . A A . 32 THR OG1 1 1 13 5839 1 1 30 GLU C C -12.868 3.505 4.751 1.00 . A A . 33 GLU C 1 1 13 5840 1 1 30 GLU CA C -13.376 3.412 3.317 1.00 . A A . 33 GLU CA 1 1 13 5841 1 1 30 GLU CB C -14.018 2.049 3.068 1.00 . A A . 33 GLU CB 1 1 13 5842 1 1 30 GLU CD C -16.175 2.516 4.300 1.00 . A A . 33 GLU CD 1 1 13 5843 1 1 30 GLU CG C -14.972 1.603 4.166 1.00 . A A . 33 GLU CG 1 1 13 5844 1 1 30 GLU H H -12.013 2.872 1.798 1.00 . A A . 33 GLU H 1 1 13 5845 1 1 30 GLU HA H -14.112 4.177 3.164 1.00 . A A . 33 GLU HA 1 1 13 5846 1 1 30 GLU HB2 H -14.570 2.092 2.139 1.00 . A A . 33 GLU HB2 1 1 13 5847 1 1 30 GLU HB3 H -13.234 1.313 2.974 1.00 . A A . 33 GLU HB3 1 1 13 5848 1 1 30 GLU HG2 H -15.319 0.606 3.940 1.00 . A A . 33 GLU HG2 1 1 13 5849 1 1 30 GLU HG3 H -14.439 1.593 5.105 1.00 . A A . 33 GLU HG3 1 1 13 5850 1 1 30 GLU N N -12.304 3.624 2.356 1.00 . A A . 33 GLU N 1 1 13 5851 1 1 30 GLU O O -13.285 4.373 5.518 1.00 . A A . 33 GLU O 1 1 13 5852 1 1 30 GLU OE1 O -16.087 3.507 5.055 1.00 . A A . 33 GLU OE1 1 1 13 5853 1 1 30 GLU OE2 O -17.205 2.240 3.650 1.00 . A A . 33 GLU OE2 1 1 13 5854 1 1 31 THR C C -10.610 3.829 6.765 1.00 . A A . 34 THR C 1 1 13 5855 1 1 31 THR CA C -11.395 2.559 6.442 1.00 . A A . 34 THR CA 1 1 13 5856 1 1 31 THR CB C -10.469 1.339 6.612 1.00 . A A . 34 THR CB 1 1 13 5857 1 1 31 THR CG2 C -9.875 1.294 8.013 1.00 . A A . 34 THR CG2 1 1 13 5858 1 1 31 THR H H -11.677 1.949 4.434 1.00 . A A . 34 THR H 1 1 13 5859 1 1 31 THR HA H -12.209 2.463 7.145 1.00 . A A . 34 THR HA 1 1 13 5860 1 1 31 THR HB H -9.661 1.418 5.899 1.00 . A A . 34 THR HB 1 1 13 5861 1 1 31 THR HG1 H -11.487 -0.248 7.192 1.00 . A A . 34 THR HG1 1 1 13 5862 1 1 31 THR HG21 H -9.210 0.447 8.094 1.00 . A A . 34 THR HG21 1 1 13 5863 1 1 31 THR HG22 H -10.670 1.200 8.738 1.00 . A A . 34 THR HG22 1 1 13 5864 1 1 31 THR HG23 H -9.322 2.203 8.200 1.00 . A A . 34 THR HG23 1 1 13 5865 1 1 31 THR N N -11.966 2.603 5.099 1.00 . A A . 34 THR N 1 1 13 5866 1 1 31 THR O O -10.663 4.327 7.890 1.00 . A A . 34 THR O 1 1 13 5867 1 1 31 THR OG1 O -11.197 0.131 6.359 1.00 . A A . 34 THR OG1 1 1 13 5868 1 1 32 LYS C C -7.732 5.147 6.511 1.00 . A A . 35 LYS C 1 1 13 5869 1 1 32 LYS CA C -9.051 5.529 5.898 1.00 . A A . 35 LYS CA 1 1 13 5870 1 1 32 LYS CB C -9.743 6.627 6.716 1.00 . A A . 35 LYS CB 1 1 13 5871 1 1 32 LYS CD C -11.738 8.120 7.022 1.00 . A A . 35 LYS CD 1 1 13 5872 1 1 32 LYS CE C -12.124 7.611 8.402 1.00 . A A . 35 LYS CE 1 1 13 5873 1 1 32 LYS CG C -11.108 7.024 6.177 1.00 . A A . 35 LYS CG 1 1 13 5874 1 1 32 LYS H H -9.836 3.837 4.924 1.00 . A A . 35 LYS H 1 1 13 5875 1 1 32 LYS HA H -8.852 5.895 4.897 1.00 . A A . 35 LYS HA 1 1 13 5876 1 1 32 LYS HB2 H -9.867 6.281 7.731 1.00 . A A . 35 LYS HB2 1 1 13 5877 1 1 32 LYS HB3 H -9.115 7.506 6.721 1.00 . A A . 35 LYS HB3 1 1 13 5878 1 1 32 LYS HD2 H -11.029 8.925 7.133 1.00 . A A . 35 LYS HD2 1 1 13 5879 1 1 32 LYS HD3 H -12.624 8.483 6.520 1.00 . A A . 35 LYS HD3 1 1 13 5880 1 1 32 LYS HE2 H -12.869 6.837 8.291 1.00 . A A . 35 LYS HE2 1 1 13 5881 1 1 32 LYS HE3 H -11.246 7.198 8.878 1.00 . A A . 35 LYS HE3 1 1 13 5882 1 1 32 LYS HG2 H -10.994 7.382 5.165 1.00 . A A . 35 LYS HG2 1 1 13 5883 1 1 32 LYS HG3 H -11.754 6.158 6.186 1.00 . A A . 35 LYS HG3 1 1 13 5884 1 1 32 LYS HZ1 H -11.970 9.447 9.387 1.00 . A A . 35 LYS HZ1 1 1 13 5885 1 1 32 LYS HZ2 H -12.932 8.316 10.195 1.00 . A A . 35 LYS HZ2 1 1 13 5886 1 1 32 LYS HZ3 H -13.526 9.102 8.821 1.00 . A A . 35 LYS HZ3 1 1 13 5887 1 1 32 LYS N N -9.871 4.325 5.768 1.00 . A A . 35 LYS N 1 1 13 5888 1 1 32 LYS NZ N -12.676 8.695 9.261 1.00 . A A . 35 LYS NZ 1 1 13 5889 1 1 32 LYS O O -7.276 5.741 7.489 1.00 . A A . 35 LYS O 1 1 13 5890 1 1 33 GLN C C -4.806 3.678 5.277 1.00 . A A . 36 GLN C 1 1 13 5891 1 1 33 GLN CA C -5.846 3.641 6.383 1.00 . A A . 36 GLN CA 1 1 13 5892 1 1 33 GLN CB C -5.994 2.214 6.913 1.00 . A A . 36 GLN CB 1 1 13 5893 1 1 33 GLN CD C -4.317 2.527 8.773 1.00 . A A . 36 GLN CD 1 1 13 5894 1 1 33 GLN CG C -4.740 1.682 7.588 1.00 . A A . 36 GLN CG 1 1 13 5895 1 1 33 GLN H H -7.555 3.729 5.116 1.00 . A A . 36 GLN H 1 1 13 5896 1 1 33 GLN HA H -5.521 4.281 7.188 1.00 . A A . 36 GLN HA 1 1 13 5897 1 1 33 GLN HB2 H -6.802 2.190 7.629 1.00 . A A . 36 GLN HB2 1 1 13 5898 1 1 33 GLN HB3 H -6.236 1.564 6.089 1.00 . A A . 36 GLN HB3 1 1 13 5899 1 1 33 GLN HE21 H -3.202 3.672 7.589 1.00 . A A . 36 GLN HE21 1 1 13 5900 1 1 33 GLN HE22 H -3.201 4.098 9.264 1.00 . A A . 36 GLN HE22 1 1 13 5901 1 1 33 GLN HG2 H -4.930 0.677 7.933 1.00 . A A . 36 GLN HG2 1 1 13 5902 1 1 33 GLN HG3 H -3.937 1.670 6.867 1.00 . A A . 36 GLN HG3 1 1 13 5903 1 1 33 GLN N N -7.127 4.138 5.910 1.00 . A A . 36 GLN N 1 1 13 5904 1 1 33 GLN NE2 N -3.490 3.534 8.516 1.00 . A A . 36 GLN NE2 1 1 13 5905 1 1 33 GLN O O -4.770 2.812 4.404 1.00 . A A . 36 GLN O 1 1 13 5906 1 1 33 GLN OE1 O -4.730 2.281 9.906 1.00 . A A . 36 GLN OE1 1 1 13 5907 1 1 34 SER C C -1.538 4.407 4.950 1.00 . A A . 37 SER C 1 1 13 5908 1 1 34 SER CA C -2.879 4.843 4.362 1.00 . A A . 37 SER CA 1 1 13 5909 1 1 34 SER CB C -2.798 6.302 3.906 1.00 . A A . 37 SER CB 1 1 13 5910 1 1 34 SER H H -4.039 5.328 6.067 1.00 . A A . 37 SER H 1 1 13 5911 1 1 34 SER HA H -3.119 4.220 3.514 1.00 . A A . 37 SER HA 1 1 13 5912 1 1 34 SER HB2 H -1.977 6.414 3.212 1.00 . A A . 37 SER HB2 1 1 13 5913 1 1 34 SER HB3 H -3.721 6.576 3.418 1.00 . A A . 37 SER HB3 1 1 13 5914 1 1 34 SER HG H -1.858 7.763 4.810 1.00 . A A . 37 SER HG 1 1 13 5915 1 1 34 SER N N -3.942 4.677 5.345 1.00 . A A . 37 SER N 1 1 13 5916 1 1 34 SER O O -0.987 5.076 5.825 1.00 . A A . 37 SER O 1 1 13 5917 1 1 34 SER OG O -2.587 7.171 5.006 1.00 . A A . 37 SER OG 1 1 13 5918 1 1 35 THR C C 0.790 1.672 4.024 1.00 . A A . 38 THR C 1 1 13 5919 1 1 35 THR CA C 0.243 2.743 4.963 1.00 . A A . 38 THR CA 1 1 13 5920 1 1 35 THR CB C 0.077 2.143 6.371 1.00 . A A . 38 THR CB 1 1 13 5921 1 1 35 THR CG2 C -0.956 1.027 6.366 1.00 . A A . 38 THR CG2 1 1 13 5922 1 1 35 THR H H -1.497 2.798 3.759 1.00 . A A . 38 THR H 1 1 13 5923 1 1 35 THR HA H 0.954 3.555 5.020 1.00 . A A . 38 THR HA 1 1 13 5924 1 1 35 THR HB H -0.261 2.922 7.040 1.00 . A A . 38 THR HB 1 1 13 5925 1 1 35 THR HG1 H 1.249 0.699 7.031 1.00 . A A . 38 THR HG1 1 1 13 5926 1 1 35 THR HG21 H -1.909 1.421 6.046 1.00 . A A . 38 THR HG21 1 1 13 5927 1 1 35 THR HG22 H -1.051 0.620 7.362 1.00 . A A . 38 THR HG22 1 1 13 5928 1 1 35 THR HG23 H -0.641 0.248 5.687 1.00 . A A . 38 THR HG23 1 1 13 5929 1 1 35 THR N N -1.018 3.282 4.464 1.00 . A A . 38 THR N 1 1 13 5930 1 1 35 THR O O 0.113 1.261 3.078 1.00 . A A . 38 THR O 1 1 13 5931 1 1 35 THR OG1 O 1.332 1.637 6.843 1.00 . A A . 38 THR OG1 1 1 13 5932 1 1 36 TRP C C 2.508 -1.141 4.161 1.00 . A A . 39 TRP C 1 1 13 5933 1 1 36 TRP CA C 2.633 0.202 3.448 1.00 . A A . 39 TRP CA 1 1 13 5934 1 1 36 TRP CB C 4.128 0.468 3.211 1.00 . A A . 39 TRP CB 1 1 13 5935 1 1 36 TRP CD1 C 4.916 2.569 4.392 1.00 . A A . 39 TRP CD1 1 1 13 5936 1 1 36 TRP CD2 C 4.729 2.788 2.183 1.00 . A A . 39 TRP CD2 1 1 13 5937 1 1 36 TRP CE2 C 5.184 4.008 2.714 1.00 . A A . 39 TRP CE2 1 1 13 5938 1 1 36 TRP CE3 C 4.539 2.681 0.808 1.00 . A A . 39 TRP CE3 1 1 13 5939 1 1 36 TRP CG C 4.556 1.891 3.276 1.00 . A A . 39 TRP CG 1 1 13 5940 1 1 36 TRP CH2 C 5.264 4.974 0.571 1.00 . A A . 39 TRP CH2 1 1 13 5941 1 1 36 TRP CZ2 C 5.456 5.108 1.914 1.00 . A A . 39 TRP CZ2 1 1 13 5942 1 1 36 TRP CZ3 C 4.808 3.777 0.017 1.00 . A A . 39 TRP CZ3 1 1 13 5943 1 1 36 TRP H H 2.531 1.620 5.020 1.00 . A A . 39 TRP H 1 1 13 5944 1 1 36 TRP HA H 2.114 0.162 2.501 1.00 . A A . 39 TRP HA 1 1 13 5945 1 1 36 TRP HB2 H 4.694 -0.052 3.967 1.00 . A A . 39 TRP HB2 1 1 13 5946 1 1 36 TRP HB3 H 4.403 0.089 2.239 1.00 . A A . 39 TRP HB3 1 1 13 5947 1 1 36 TRP HD1 H 4.899 2.143 5.377 1.00 . A A . 39 TRP HD1 1 1 13 5948 1 1 36 TRP HE1 H 5.585 4.541 4.701 1.00 . A A . 39 TRP HE1 1 1 13 5949 1 1 36 TRP HE3 H 4.186 1.762 0.361 1.00 . A A . 39 TRP HE3 1 1 13 5950 1 1 36 TRP HH2 H 5.466 5.802 -0.087 1.00 . A A . 39 TRP HH2 1 1 13 5951 1 1 36 TRP HZ2 H 5.813 6.037 2.324 1.00 . A A . 39 TRP HZ2 1 1 13 5952 1 1 36 TRP HZ3 H 4.668 3.715 -1.050 1.00 . A A . 39 TRP HZ3 1 1 13 5953 1 1 36 TRP N N 2.025 1.238 4.273 1.00 . A A . 39 TRP N 1 1 13 5954 1 1 36 TRP NE1 N 5.290 3.852 4.068 1.00 . A A . 39 TRP NE1 1 1 13 5955 1 1 36 TRP O O 3.262 -1.430 5.091 1.00 . A A . 39 TRP O 1 1 13 5956 1 1 37 GLU C C 0.429 -4.109 3.448 1.00 . A A . 40 GLU C 1 1 13 5957 1 1 37 GLU CA C 1.337 -3.263 4.328 1.00 . A A . 40 GLU CA 1 1 13 5958 1 1 37 GLU CB C 0.722 -3.100 5.724 1.00 . A A . 40 GLU CB 1 1 13 5959 1 1 37 GLU CD C -1.371 -2.924 7.130 1.00 . A A . 40 GLU CD 1 1 13 5960 1 1 37 GLU CG C -0.799 -3.117 5.739 1.00 . A A . 40 GLU CG 1 1 13 5961 1 1 37 GLU H H 0.980 -1.682 2.977 1.00 . A A . 40 GLU H 1 1 13 5962 1 1 37 GLU HA H 2.295 -3.752 4.418 1.00 . A A . 40 GLU HA 1 1 13 5963 1 1 37 GLU HB2 H 1.075 -3.901 6.355 1.00 . A A . 40 GLU HB2 1 1 13 5964 1 1 37 GLU HB3 H 1.050 -2.156 6.136 1.00 . A A . 40 GLU HB3 1 1 13 5965 1 1 37 GLU HG2 H -1.162 -2.325 5.102 1.00 . A A . 40 GLU HG2 1 1 13 5966 1 1 37 GLU HG3 H -1.139 -4.068 5.354 1.00 . A A . 40 GLU HG3 1 1 13 5967 1 1 37 GLU N N 1.553 -1.959 3.723 1.00 . A A . 40 GLU N 1 1 13 5968 1 1 37 GLU O O -0.276 -3.584 2.589 1.00 . A A . 40 GLU O 1 1 13 5969 1 1 37 GLU OE1 O -1.565 -1.758 7.535 1.00 . A A . 40 GLU OE1 1 1 13 5970 1 1 37 GLU OE2 O -1.622 -3.937 7.814 1.00 . A A . 40 GLU OE2 1 1 13 5971 1 1 38 LYS C C -1.856 -6.026 3.157 1.00 . A A . 41 LYS C 1 1 13 5972 1 1 38 LYS CA C -0.378 -6.334 2.921 1.00 . A A . 41 LYS CA 1 1 13 5973 1 1 38 LYS CB C -0.065 -7.763 3.354 1.00 . A A . 41 LYS CB 1 1 13 5974 1 1 38 LYS CD C 0.510 -9.269 5.288 1.00 . A A . 41 LYS CD 1 1 13 5975 1 1 38 LYS CE C 1.194 -10.301 4.403 1.00 . A A . 41 LYS CE 1 1 13 5976 1 1 38 LYS CG C 0.621 -7.868 4.707 1.00 . A A . 41 LYS CG 1 1 13 5977 1 1 38 LYS H H 1.032 -5.776 4.362 1.00 . A A . 41 LYS H 1 1 13 5978 1 1 38 LYS HA H -0.147 -6.220 1.874 1.00 . A A . 41 LYS HA 1 1 13 5979 1 1 38 LYS HB2 H -0.982 -8.303 3.414 1.00 . A A . 41 LYS HB2 1 1 13 5980 1 1 38 LYS HB3 H 0.573 -8.219 2.616 1.00 . A A . 41 LYS HB3 1 1 13 5981 1 1 38 LYS HD2 H 0.975 -9.283 6.261 1.00 . A A . 41 LYS HD2 1 1 13 5982 1 1 38 LYS HD3 H -0.535 -9.527 5.383 1.00 . A A . 41 LYS HD3 1 1 13 5983 1 1 38 LYS HE2 H 0.701 -10.318 3.442 1.00 . A A . 41 LYS HE2 1 1 13 5984 1 1 38 LYS HE3 H 2.227 -10.014 4.271 1.00 . A A . 41 LYS HE3 1 1 13 5985 1 1 38 LYS HG2 H 1.666 -7.620 4.591 1.00 . A A . 41 LYS HG2 1 1 13 5986 1 1 38 LYS HG3 H 0.157 -7.167 5.385 1.00 . A A . 41 LYS HG3 1 1 13 5987 1 1 38 LYS HZ1 H 1.556 -12.357 4.342 1.00 . A A . 41 LYS HZ1 1 1 13 5988 1 1 38 LYS HZ2 H 0.155 -11.933 5.190 1.00 . A A . 41 LYS HZ2 1 1 13 5989 1 1 38 LYS HZ3 H 1.674 -11.685 5.891 1.00 . A A . 41 LYS HZ3 1 1 13 5990 1 1 38 LYS N N 0.449 -5.417 3.672 1.00 . A A . 41 LYS N 1 1 13 5991 1 1 38 LYS NZ N 1.141 -11.665 4.998 1.00 . A A . 41 LYS NZ 1 1 13 5992 1 1 38 LYS O O -2.386 -6.317 4.230 1.00 . A A . 41 LYS O 1 1 13 5993 1 1 39 PRO C C -4.875 -6.197 1.807 1.00 . A A . 42 PRO C 1 1 13 5994 1 1 39 PRO CA C -3.950 -5.082 2.287 1.00 . A A . 42 PRO CA 1 1 13 5995 1 1 39 PRO CB C -4.072 -3.851 1.385 1.00 . A A . 42 PRO CB 1 1 13 5996 1 1 39 PRO CD C -2.034 -5.068 0.840 1.00 . A A . 42 PRO CD 1 1 13 5997 1 1 39 PRO CG C -2.914 -3.910 0.430 1.00 . A A . 42 PRO CG 1 1 13 5998 1 1 39 PRO HA H -4.200 -4.812 3.301 1.00 . A A . 42 PRO HA 1 1 13 5999 1 1 39 PRO HB2 H -5.014 -3.887 0.857 1.00 . A A . 42 PRO HB2 1 1 13 6000 1 1 39 PRO HB3 H -4.033 -2.959 1.990 1.00 . A A . 42 PRO HB3 1 1 13 6001 1 1 39 PRO HD2 H -2.144 -5.889 0.145 1.00 . A A . 42 PRO HD2 1 1 13 6002 1 1 39 PRO HD3 H -1.002 -4.757 0.897 1.00 . A A . 42 PRO HD3 1 1 13 6003 1 1 39 PRO HG2 H -3.280 -4.063 -0.570 1.00 . A A . 42 PRO HG2 1 1 13 6004 1 1 39 PRO HG3 H -2.357 -2.985 0.482 1.00 . A A . 42 PRO HG3 1 1 13 6005 1 1 39 PRO N N -2.547 -5.434 2.163 1.00 . A A . 42 PRO N 1 1 13 6006 1 1 39 PRO O O -5.332 -6.189 0.664 1.00 . A A . 42 PRO O 1 1 14 6007 1 1 12 SER C C -10.435 -1.251 -2.944 1.00 . A A . 15 SER C 1 1 14 6008 1 1 12 SER CA C -10.311 -2.471 -3.847 1.00 . A A . 15 SER CA 1 1 14 6009 1 1 12 SER CB C -11.616 -3.262 -3.817 1.00 . A A . 15 SER CB 1 1 14 6010 1 1 12 SER H H -8.811 -3.155 -2.528 1.00 . A A . 15 SER H 1 1 14 6011 1 1 12 SER HA H -10.110 -2.147 -4.856 1.00 . A A . 15 SER HA 1 1 14 6012 1 1 12 SER HB2 H -11.686 -3.787 -2.877 1.00 . A A . 15 SER HB2 1 1 14 6013 1 1 12 SER HB3 H -12.450 -2.582 -3.913 1.00 . A A . 15 SER HB3 1 1 14 6014 1 1 12 SER HG H -12.110 -5.003 -4.564 1.00 . A A . 15 SER HG 1 1 14 6015 1 1 12 SER N N -9.206 -3.314 -3.409 1.00 . A A . 15 SER N 1 1 14 6016 1 1 12 SER O O -10.307 -0.112 -3.394 1.00 . A A . 15 SER O 1 1 14 6017 1 1 12 SER OG O -11.669 -4.208 -4.871 1.00 . A A . 15 SER OG 1 1 14 6018 1 1 13 MET C C -9.503 0.280 -0.489 1.00 . A A . 16 MET C 1 1 14 6019 1 1 13 MET CA C -10.830 -0.439 -0.685 1.00 . A A . 16 MET CA 1 1 14 6020 1 1 13 MET CB C -11.317 -1.008 0.650 1.00 . A A . 16 MET CB 1 1 14 6021 1 1 13 MET CE C -13.162 -1.206 3.232 1.00 . A A . 16 MET CE 1 1 14 6022 1 1 13 MET CG C -12.650 -1.733 0.556 1.00 . A A . 16 MET CG 1 1 14 6023 1 1 13 MET H H -10.787 -2.436 -1.373 1.00 . A A . 16 MET H 1 1 14 6024 1 1 13 MET HA H -11.560 0.265 -1.057 1.00 . A A . 16 MET HA 1 1 14 6025 1 1 13 MET HB2 H -10.580 -1.702 1.023 1.00 . A A . 16 MET HB2 1 1 14 6026 1 1 13 MET HB3 H -11.423 -0.196 1.355 1.00 . A A . 16 MET HB3 1 1 14 6027 1 1 13 MET HE1 H -12.209 -0.697 3.243 1.00 . A A . 16 MET HE1 1 1 14 6028 1 1 13 MET HE2 H -13.383 -1.574 4.223 1.00 . A A . 16 MET HE2 1 1 14 6029 1 1 13 MET HE3 H -13.934 -0.518 2.923 1.00 . A A . 16 MET HE3 1 1 14 6030 1 1 13 MET HG2 H -13.421 -1.012 0.327 1.00 . A A . 16 MET HG2 1 1 14 6031 1 1 13 MET HG3 H -12.593 -2.462 -0.240 1.00 . A A . 16 MET HG3 1 1 14 6032 1 1 13 MET N N -10.691 -1.506 -1.665 1.00 . A A . 16 MET N 1 1 14 6033 1 1 13 MET O O -9.453 1.368 0.082 1.00 . A A . 16 MET O 1 1 14 6034 1 1 13 MET SD S -13.090 -2.581 2.086 1.00 . A A . 16 MET SD 1 1 14 6035 1 1 14 TRP C C -6.572 0.701 -2.204 1.00 . A A . 17 TRP C 1 1 14 6036 1 1 14 TRP CA C -7.096 0.241 -0.853 1.00 . A A . 17 TRP CA 1 1 14 6037 1 1 14 TRP CB C -6.112 -0.769 -0.259 1.00 . A A . 17 TRP CB 1 1 14 6038 1 1 14 TRP CD1 C -7.584 -2.321 1.151 1.00 . A A . 17 TRP CD1 1 1 14 6039 1 1 14 TRP CD2 C -6.041 -1.190 2.303 1.00 . A A . 17 TRP CD2 1 1 14 6040 1 1 14 TRP CE2 C -6.764 -1.993 3.201 1.00 . A A . 17 TRP CE2 1 1 14 6041 1 1 14 TRP CE3 C -5.014 -0.386 2.791 1.00 . A A . 17 TRP CE3 1 1 14 6042 1 1 14 TRP CG C -6.580 -1.409 1.004 1.00 . A A . 17 TRP CG 1 1 14 6043 1 1 14 TRP CH2 C -5.473 -1.217 5.017 1.00 . A A . 17 TRP CH2 1 1 14 6044 1 1 14 TRP CZ2 C -6.488 -2.015 4.564 1.00 . A A . 17 TRP CZ2 1 1 14 6045 1 1 14 TRP CZ3 C -4.739 -0.407 4.140 1.00 . A A . 17 TRP CZ3 1 1 14 6046 1 1 14 TRP H H -8.534 -1.203 -1.421 1.00 . A A . 17 TRP H 1 1 14 6047 1 1 14 TRP HA H -7.162 1.094 -0.194 1.00 . A A . 17 TRP HA 1 1 14 6048 1 1 14 TRP HB2 H -5.928 -1.551 -0.974 1.00 . A A . 17 TRP HB2 1 1 14 6049 1 1 14 TRP HB3 H -5.181 -0.262 -0.045 1.00 . A A . 17 TRP HB3 1 1 14 6050 1 1 14 TRP HD1 H -8.191 -2.697 0.339 1.00 . A A . 17 TRP HD1 1 1 14 6051 1 1 14 TRP HE1 H -8.346 -3.317 2.834 1.00 . A A . 17 TRP HE1 1 1 14 6052 1 1 14 TRP HE3 H -4.437 0.244 2.129 1.00 . A A . 17 TRP HE3 1 1 14 6053 1 1 14 TRP HH2 H -5.224 -1.200 6.068 1.00 . A A . 17 TRP HH2 1 1 14 6054 1 1 14 TRP HZ2 H -7.047 -2.633 5.250 1.00 . A A . 17 TRP HZ2 1 1 14 6055 1 1 14 TRP HZ3 H -3.948 0.209 4.531 1.00 . A A . 17 TRP HZ3 1 1 14 6056 1 1 14 TRP N N -8.428 -0.338 -0.972 1.00 . A A . 17 TRP N 1 1 14 6057 1 1 14 TRP NE1 N -7.701 -2.679 2.472 1.00 . A A . 17 TRP NE1 1 1 14 6058 1 1 14 TRP O O -6.528 -0.073 -3.160 1.00 . A A . 17 TRP O 1 1 14 6059 1 1 15 THR C C -4.119 2.689 -3.350 1.00 . A A . 18 THR C 1 1 14 6060 1 1 15 THR CA C -5.626 2.517 -3.500 1.00 . A A . 18 THR CA 1 1 14 6061 1 1 15 THR CB C -6.263 3.876 -3.838 1.00 . A A . 18 THR CB 1 1 14 6062 1 1 15 THR CG2 C -7.722 3.709 -4.234 1.00 . A A . 18 THR CG2 1 1 14 6063 1 1 15 THR H H -6.262 2.540 -1.493 1.00 . A A . 18 THR H 1 1 14 6064 1 1 15 THR HA H -5.836 1.825 -4.302 1.00 . A A . 18 THR HA 1 1 14 6065 1 1 15 THR HB H -5.728 4.307 -4.667 1.00 . A A . 18 THR HB 1 1 14 6066 1 1 15 THR HG1 H -6.971 5.274 -2.639 1.00 . A A . 18 THR HG1 1 1 14 6067 1 1 15 THR HG21 H -8.151 4.678 -4.442 1.00 . A A . 18 THR HG21 1 1 14 6068 1 1 15 THR HG22 H -8.263 3.241 -3.425 1.00 . A A . 18 THR HG22 1 1 14 6069 1 1 15 THR HG23 H -7.787 3.089 -5.116 1.00 . A A . 18 THR HG23 1 1 14 6070 1 1 15 THR N N -6.177 1.964 -2.279 1.00 . A A . 18 THR N 1 1 14 6071 1 1 15 THR O O -3.658 3.276 -2.374 1.00 . A A . 18 THR O 1 1 14 6072 1 1 15 THR OG1 O -6.165 4.757 -2.711 1.00 . A A . 18 THR OG1 1 1 14 6073 1 1 16 GLU C C -1.334 3.383 -5.126 1.00 . A A . 19 GLU C 1 1 14 6074 1 1 16 GLU CA C -1.897 2.291 -4.221 1.00 . A A . 19 GLU CA 1 1 14 6075 1 1 16 GLU CB C -1.252 0.940 -4.537 1.00 . A A . 19 GLU CB 1 1 14 6076 1 1 16 GLU CD C -2.573 0.522 -6.655 1.00 . A A . 19 GLU CD 1 1 14 6077 1 1 16 GLU CG C -1.198 0.596 -6.019 1.00 . A A . 19 GLU CG 1 1 14 6078 1 1 16 GLU H H -3.750 1.749 -5.084 1.00 . A A . 19 GLU H 1 1 14 6079 1 1 16 GLU HA H -1.665 2.547 -3.203 1.00 . A A . 19 GLU HA 1 1 14 6080 1 1 16 GLU HB2 H -0.246 0.946 -4.157 1.00 . A A . 19 GLU HB2 1 1 14 6081 1 1 16 GLU HB3 H -1.810 0.164 -4.032 1.00 . A A . 19 GLU HB3 1 1 14 6082 1 1 16 GLU HG2 H -0.621 1.352 -6.530 1.00 . A A . 19 GLU HG2 1 1 14 6083 1 1 16 GLU HG3 H -0.713 -0.363 -6.134 1.00 . A A . 19 GLU HG3 1 1 14 6084 1 1 16 GLU N N -3.345 2.193 -4.312 1.00 . A A . 19 GLU N 1 1 14 6085 1 1 16 GLU O O -1.667 3.470 -6.307 1.00 . A A . 19 GLU O 1 1 14 6086 1 1 16 GLU OE1 O -3.287 -0.472 -6.411 1.00 . A A . 19 GLU OE1 1 1 14 6087 1 1 16 GLU OE2 O -2.935 1.457 -7.401 1.00 . A A . 19 GLU OE2 1 1 14 6088 1 1 17 HIS C C 1.545 5.613 -4.709 1.00 . A A . 20 HIS C 1 1 14 6089 1 1 17 HIS CA C 0.156 5.318 -5.274 1.00 . A A . 20 HIS CA 1 1 14 6090 1 1 17 HIS CB C -0.703 6.585 -5.190 1.00 . A A . 20 HIS CB 1 1 14 6091 1 1 17 HIS CD2 C -3.243 6.066 -5.290 1.00 . A A . 20 HIS CD2 1 1 14 6092 1 1 17 HIS CE1 C -3.582 6.530 -7.405 1.00 . A A . 20 HIS CE1 1 1 14 6093 1 1 17 HIS CG C -2.056 6.450 -5.818 1.00 . A A . 20 HIS CG 1 1 14 6094 1 1 17 HIS H H -0.267 4.096 -3.590 1.00 . A A . 20 HIS H 1 1 14 6095 1 1 17 HIS HA H 0.251 5.023 -6.308 1.00 . A A . 20 HIS HA 1 1 14 6096 1 1 17 HIS HB2 H -0.846 6.844 -4.152 1.00 . A A . 20 HIS HB2 1 1 14 6097 1 1 17 HIS HB3 H -0.185 7.393 -5.686 1.00 . A A . 20 HIS HB3 1 1 14 6098 1 1 17 HIS HD1 H -1.639 7.038 -7.798 1.00 . A A . 20 HIS HD1 1 1 14 6099 1 1 17 HIS HD2 H -3.424 5.769 -4.267 1.00 . A A . 20 HIS HD2 1 1 14 6100 1 1 17 HIS HE1 H -4.063 6.673 -8.363 1.00 . A A . 20 HIS HE1 1 1 14 6101 1 1 17 HIS HE2 H -5.101 5.812 -6.235 1.00 . A A . 20 HIS HE2 1 1 14 6102 1 1 17 HIS N N -0.478 4.221 -4.543 1.00 . A A . 20 HIS N 1 1 14 6103 1 1 17 HIS ND1 N -2.303 6.733 -7.145 1.00 . A A . 20 HIS ND1 1 1 14 6104 1 1 17 HIS NE2 N -4.174 6.123 -6.298 1.00 . A A . 20 HIS NE2 1 1 14 6105 1 1 17 HIS O O 1.761 5.505 -3.503 1.00 . A A . 20 HIS O 1 1 14 6106 1 1 18 LYS C C 3.848 7.234 -3.963 1.00 . A A . 21 LYS C 1 1 14 6107 1 1 18 LYS CA C 3.846 6.296 -5.164 1.00 . A A . 21 LYS CA 1 1 14 6108 1 1 18 LYS CB C 4.621 6.933 -6.316 1.00 . A A . 21 LYS CB 1 1 14 6109 1 1 18 LYS CD C 3.535 6.684 -8.565 1.00 . A A . 21 LYS CD 1 1 14 6110 1 1 18 LYS CE C 3.559 5.939 -9.890 1.00 . A A . 21 LYS CE 1 1 14 6111 1 1 18 LYS CG C 4.559 6.121 -7.592 1.00 . A A . 21 LYS CG 1 1 14 6112 1 1 18 LYS H H 2.267 6.005 -6.542 1.00 . A A . 21 LYS H 1 1 14 6113 1 1 18 LYS HA H 4.331 5.373 -4.885 1.00 . A A . 21 LYS HA 1 1 14 6114 1 1 18 LYS HB2 H 4.212 7.913 -6.514 1.00 . A A . 21 LYS HB2 1 1 14 6115 1 1 18 LYS HB3 H 5.656 7.035 -6.027 1.00 . A A . 21 LYS HB3 1 1 14 6116 1 1 18 LYS HD2 H 2.551 6.591 -8.130 1.00 . A A . 21 LYS HD2 1 1 14 6117 1 1 18 LYS HD3 H 3.755 7.726 -8.743 1.00 . A A . 21 LYS HD3 1 1 14 6118 1 1 18 LYS HE2 H 3.344 4.897 -9.706 1.00 . A A . 21 LYS HE2 1 1 14 6119 1 1 18 LYS HE3 H 2.801 6.355 -10.536 1.00 . A A . 21 LYS HE3 1 1 14 6120 1 1 18 LYS HG2 H 5.531 6.125 -8.063 1.00 . A A . 21 LYS HG2 1 1 14 6121 1 1 18 LYS HG3 H 4.280 5.112 -7.337 1.00 . A A . 21 LYS HG3 1 1 14 6122 1 1 18 LYS HZ1 H 5.107 7.045 -10.752 1.00 . A A . 21 LYS HZ1 1 1 14 6123 1 1 18 LYS HZ2 H 4.870 5.530 -11.466 1.00 . A A . 21 LYS HZ2 1 1 14 6124 1 1 18 LYS HZ3 H 5.627 5.645 -9.957 1.00 . A A . 21 LYS HZ3 1 1 14 6125 1 1 18 LYS N N 2.485 5.975 -5.586 1.00 . A A . 21 LYS N 1 1 14 6126 1 1 18 LYS NZ N 4.884 6.047 -10.563 1.00 . A A . 21 LYS NZ 1 1 14 6127 1 1 18 LYS O O 2.902 7.992 -3.752 1.00 . A A . 21 LYS O 1 1 14 6128 1 1 19 SER C C 6.513 8.218 -1.600 1.00 . A A . 22 SER C 1 1 14 6129 1 1 19 SER CA C 5.044 8.009 -1.995 1.00 . A A . 22 SER CA 1 1 14 6130 1 1 19 SER CB C 4.268 7.377 -0.841 1.00 . A A . 22 SER CB 1 1 14 6131 1 1 19 SER H H 5.640 6.551 -3.407 1.00 . A A . 22 SER H 1 1 14 6132 1 1 19 SER HA H 4.606 8.969 -2.222 1.00 . A A . 22 SER HA 1 1 14 6133 1 1 19 SER HB2 H 3.820 6.452 -1.174 1.00 . A A . 22 SER HB2 1 1 14 6134 1 1 19 SER HB3 H 4.944 7.174 -0.024 1.00 . A A . 22 SER HB3 1 1 14 6135 1 1 19 SER HG H 2.801 8.641 -1.133 1.00 . A A . 22 SER HG 1 1 14 6136 1 1 19 SER N N 4.919 7.175 -3.182 1.00 . A A . 22 SER N 1 1 14 6137 1 1 19 SER O O 7.395 7.480 -2.060 1.00 . A A . 22 SER O 1 1 14 6138 1 1 19 SER OG O 3.242 8.240 -0.382 1.00 . A A . 22 SER OG 1 1 14 6139 1 1 20 PRO C C 9.194 8.570 -0.376 1.00 . A A . 23 PRO C 1 1 14 6140 1 1 20 PRO CA C 8.089 9.610 -0.221 1.00 . A A . 23 PRO CA 1 1 14 6141 1 1 20 PRO CB C 7.785 9.853 1.254 1.00 . A A . 23 PRO CB 1 1 14 6142 1 1 20 PRO CD C 5.758 10.072 -0.066 1.00 . A A . 23 PRO CD 1 1 14 6143 1 1 20 PRO CG C 6.382 10.385 1.279 1.00 . A A . 23 PRO CG 1 1 14 6144 1 1 20 PRO HA H 8.414 10.537 -0.667 1.00 . A A . 23 PRO HA 1 1 14 6145 1 1 20 PRO HB2 H 7.862 8.920 1.797 1.00 . A A . 23 PRO HB2 1 1 14 6146 1 1 20 PRO HB3 H 8.485 10.570 1.656 1.00 . A A . 23 PRO HB3 1 1 14 6147 1 1 20 PRO HD2 H 4.831 9.542 0.067 1.00 . A A . 23 PRO HD2 1 1 14 6148 1 1 20 PRO HD3 H 5.595 10.976 -0.631 1.00 . A A . 23 PRO HD3 1 1 14 6149 1 1 20 PRO HG2 H 5.824 9.898 2.067 1.00 . A A . 23 PRO HG2 1 1 14 6150 1 1 20 PRO HG3 H 6.400 11.453 1.441 1.00 . A A . 23 PRO HG3 1 1 14 6151 1 1 20 PRO N N 6.769 9.220 -0.715 1.00 . A A . 23 PRO N 1 1 14 6152 1 1 20 PRO O O 10.228 8.845 -0.987 1.00 . A A . 23 PRO O 1 1 14 6153 1 1 21 ASP C C 10.142 5.761 -1.292 1.00 . A A . 24 ASP C 1 1 14 6154 1 1 21 ASP CA C 9.991 6.327 0.122 1.00 . A A . 24 ASP CA 1 1 14 6155 1 1 21 ASP CB C 9.629 5.207 1.100 1.00 . A A . 24 ASP CB 1 1 14 6156 1 1 21 ASP CG C 9.648 5.671 2.542 1.00 . A A . 24 ASP CG 1 1 14 6157 1 1 21 ASP H H 8.142 7.218 0.652 1.00 . A A . 24 ASP H 1 1 14 6158 1 1 21 ASP HA H 10.934 6.754 0.423 1.00 . A A . 24 ASP HA 1 1 14 6159 1 1 21 ASP HB2 H 8.637 4.845 0.873 1.00 . A A . 24 ASP HB2 1 1 14 6160 1 1 21 ASP HB3 H 10.335 4.398 0.991 1.00 . A A . 24 ASP HB3 1 1 14 6161 1 1 21 ASP N N 8.987 7.386 0.186 1.00 . A A . 24 ASP N 1 1 14 6162 1 1 21 ASP O O 10.572 4.620 -1.464 1.00 . A A . 24 ASP O 1 1 14 6163 1 1 21 ASP OD1 O 8.603 6.154 3.026 1.00 . A A . 24 ASP OD1 1 1 14 6164 1 1 21 ASP OD2 O 10.710 5.553 3.190 1.00 . A A . 24 ASP OD2 1 1 14 6165 1 1 22 GLY C C 9.215 4.802 -3.894 1.00 . A A . 25 GLY C 1 1 14 6166 1 1 22 GLY CA C 9.912 6.121 -3.677 1.00 . A A . 25 GLY CA 1 1 14 6167 1 1 22 GLY H H 9.493 7.470 -2.110 1.00 . A A . 25 GLY H 1 1 14 6168 1 1 22 GLY HA2 H 9.458 6.862 -4.322 1.00 . A A . 25 GLY HA2 1 1 14 6169 1 1 22 GLY HA3 H 10.954 6.018 -3.935 1.00 . A A . 25 GLY HA3 1 1 14 6170 1 1 22 GLY N N 9.810 6.567 -2.301 1.00 . A A . 25 GLY N 1 1 14 6171 1 1 22 GLY O O 9.652 3.979 -4.699 1.00 . A A . 25 GLY O 1 1 14 6172 1 1 23 ARG C C 5.864 3.683 -3.219 1.00 . A A . 26 ARG C 1 1 14 6173 1 1 23 ARG CA C 7.348 3.374 -3.279 1.00 . A A . 26 ARG CA 1 1 14 6174 1 1 23 ARG CB C 7.747 2.348 -2.209 1.00 . A A . 26 ARG CB 1 1 14 6175 1 1 23 ARG CD C 9.042 1.998 -0.107 1.00 . A A . 26 ARG CD 1 1 14 6176 1 1 23 ARG CG C 8.111 2.929 -0.860 1.00 . A A . 26 ARG CG 1 1 14 6177 1 1 23 ARG CZ C 11.230 0.928 -0.457 1.00 . A A . 26 ARG CZ 1 1 14 6178 1 1 23 ARG H H 7.823 5.312 -2.552 1.00 . A A . 26 ARG H 1 1 14 6179 1 1 23 ARG HA H 7.560 2.954 -4.253 1.00 . A A . 26 ARG HA 1 1 14 6180 1 1 23 ARG HB2 H 6.927 1.662 -2.065 1.00 . A A . 26 ARG HB2 1 1 14 6181 1 1 23 ARG HB3 H 8.599 1.796 -2.569 1.00 . A A . 26 ARG HB3 1 1 14 6182 1 1 23 ARG HD2 H 9.196 2.393 0.881 1.00 . A A . 26 ARG HD2 1 1 14 6183 1 1 23 ARG HD3 H 8.579 1.025 -0.037 1.00 . A A . 26 ARG HD3 1 1 14 6184 1 1 23 ARG HE H 10.546 2.492 -1.492 1.00 . A A . 26 ARG HE 1 1 14 6185 1 1 23 ARG HG2 H 8.600 3.874 -1.008 1.00 . A A . 26 ARG HG2 1 1 14 6186 1 1 23 ARG HG3 H 7.214 3.066 -0.274 1.00 . A A . 26 ARG HG3 1 1 14 6187 1 1 23 ARG HH11 H 10.109 0.104 1.008 1.00 . A A . 26 ARG HH11 1 1 14 6188 1 1 23 ARG HH12 H 11.651 -0.640 0.747 1.00 . A A . 26 ARG HH12 1 1 14 6189 1 1 23 ARG HH21 H 12.577 1.518 -1.844 1.00 . A A . 26 ARG HH21 1 1 14 6190 1 1 23 ARG HH22 H 13.054 0.162 -0.875 1.00 . A A . 26 ARG HH22 1 1 14 6191 1 1 23 ARG N N 8.123 4.603 -3.169 1.00 . A A . 26 ARG N 1 1 14 6192 1 1 23 ARG NE N 10.335 1.859 -0.773 1.00 . A A . 26 ARG NE 1 1 14 6193 1 1 23 ARG NH1 N 10.976 0.060 0.513 1.00 . A A . 26 ARG NH1 1 1 14 6194 1 1 23 ARG NH2 N 12.381 0.864 -1.112 1.00 . A A . 26 ARG NH2 1 1 14 6195 1 1 23 ARG O O 5.473 4.781 -2.841 1.00 . A A . 26 ARG O 1 1 14 6196 1 1 24 THR C C 2.938 2.370 -2.322 1.00 . A A . 27 THR C 1 1 14 6197 1 1 24 THR CA C 3.595 2.930 -3.574 1.00 . A A . 27 THR CA 1 1 14 6198 1 1 24 THR CB C 2.939 2.296 -4.817 1.00 . A A . 27 THR CB 1 1 14 6199 1 1 24 THR CG2 C 3.195 0.796 -4.869 1.00 . A A . 27 THR CG2 1 1 14 6200 1 1 24 THR H H 5.392 1.827 -3.794 1.00 . A A . 27 THR H 1 1 14 6201 1 1 24 THR HA H 3.428 3.999 -3.610 1.00 . A A . 27 THR HA 1 1 14 6202 1 1 24 THR HB H 3.368 2.748 -5.701 1.00 . A A . 27 THR HB 1 1 14 6203 1 1 24 THR HG1 H 1.209 2.614 -5.708 1.00 . A A . 27 THR HG1 1 1 14 6204 1 1 24 THR HG21 H 4.247 0.614 -5.026 1.00 . A A . 27 THR HG21 1 1 14 6205 1 1 24 THR HG22 H 2.628 0.363 -5.680 1.00 . A A . 27 THR HG22 1 1 14 6206 1 1 24 THR HG23 H 2.887 0.345 -3.935 1.00 . A A . 27 THR HG23 1 1 14 6207 1 1 24 THR N N 5.034 2.709 -3.560 1.00 . A A . 27 THR N 1 1 14 6208 1 1 24 THR O O 3.130 1.208 -1.964 1.00 . A A . 27 THR O 1 1 14 6209 1 1 24 THR OG1 O 1.529 2.540 -4.806 1.00 . A A . 27 THR OG1 1 1 14 6210 1 1 25 TYR C C 0.022 2.581 -0.679 1.00 . A A . 28 TYR C 1 1 14 6211 1 1 25 TYR CA C 1.492 2.838 -0.427 1.00 . A A . 28 TYR CA 1 1 14 6212 1 1 25 TYR CB C 1.643 3.933 0.630 1.00 . A A . 28 TYR CB 1 1 14 6213 1 1 25 TYR CD1 C 1.187 6.103 -0.588 1.00 . A A . 28 TYR CD1 1 1 14 6214 1 1 25 TYR CD2 C -0.368 5.392 1.070 1.00 . A A . 28 TYR CD2 1 1 14 6215 1 1 25 TYR CE1 C 0.421 7.228 -0.828 1.00 . A A . 28 TYR CE1 1 1 14 6216 1 1 25 TYR CE2 C -1.138 6.514 0.834 1.00 . A A . 28 TYR CE2 1 1 14 6217 1 1 25 TYR CG C 0.805 5.165 0.365 1.00 . A A . 28 TYR CG 1 1 14 6218 1 1 25 TYR CZ C -0.740 7.428 -0.115 1.00 . A A . 28 TYR CZ 1 1 14 6219 1 1 25 TYR H H 2.056 4.131 -1.993 1.00 . A A . 28 TYR H 1 1 14 6220 1 1 25 TYR HA H 1.949 1.932 -0.062 1.00 . A A . 28 TYR HA 1 1 14 6221 1 1 25 TYR HB2 H 1.350 3.533 1.586 1.00 . A A . 28 TYR HB2 1 1 14 6222 1 1 25 TYR HB3 H 2.678 4.237 0.677 1.00 . A A . 28 TYR HB3 1 1 14 6223 1 1 25 TYR HD1 H 2.099 5.946 -1.146 1.00 . A A . 28 TYR HD1 1 1 14 6224 1 1 25 TYR HD2 H -0.680 4.673 1.814 1.00 . A A . 28 TYR HD2 1 1 14 6225 1 1 25 TYR HE1 H 0.735 7.945 -1.573 1.00 . A A . 28 TYR HE1 1 1 14 6226 1 1 25 TYR HE2 H -2.047 6.671 1.395 1.00 . A A . 28 TYR HE2 1 1 14 6227 1 1 25 TYR HH H -1.611 8.669 -1.297 1.00 . A A . 28 TYR HH 1 1 14 6228 1 1 25 TYR N N 2.168 3.221 -1.653 1.00 . A A . 28 TYR N 1 1 14 6229 1 1 25 TYR O O -0.529 3.008 -1.692 1.00 . A A . 28 TYR O 1 1 14 6230 1 1 25 TYR OH O -1.504 8.548 -0.350 1.00 . A A . 28 TYR OH 1 1 14 6231 1 1 26 TYR C C -2.855 2.442 1.069 1.00 . A A . 29 TYR C 1 1 14 6232 1 1 26 TYR CA C -2.012 1.558 0.169 1.00 . A A . 29 TYR CA 1 1 14 6233 1 1 26 TYR CB C -2.211 0.095 0.545 1.00 . A A . 29 TYR CB 1 1 14 6234 1 1 26 TYR CD1 C -1.925 -1.223 -1.589 1.00 . A A . 29 TYR CD1 1 1 14 6235 1 1 26 TYR CD2 C -0.224 -1.380 0.072 1.00 . A A . 29 TYR CD2 1 1 14 6236 1 1 26 TYR CE1 C -1.217 -2.088 -2.402 1.00 . A A . 29 TYR CE1 1 1 14 6237 1 1 26 TYR CE2 C 0.491 -2.245 -0.734 1.00 . A A . 29 TYR CE2 1 1 14 6238 1 1 26 TYR CG C -1.441 -0.856 -0.340 1.00 . A A . 29 TYR CG 1 1 14 6239 1 1 26 TYR CZ C -0.010 -2.597 -1.969 1.00 . A A . 29 TYR CZ 1 1 14 6240 1 1 26 TYR H H -0.109 1.627 1.066 1.00 . A A . 29 TYR H 1 1 14 6241 1 1 26 TYR HA H -2.320 1.702 -0.854 1.00 . A A . 29 TYR HA 1 1 14 6242 1 1 26 TYR HB2 H -1.878 -0.054 1.562 1.00 . A A . 29 TYR HB2 1 1 14 6243 1 1 26 TYR HB3 H -3.257 -0.149 0.477 1.00 . A A . 29 TYR HB3 1 1 14 6244 1 1 26 TYR HD1 H -2.871 -0.824 -1.925 1.00 . A A . 29 TYR HD1 1 1 14 6245 1 1 26 TYR HD2 H 0.165 -1.104 1.040 1.00 . A A . 29 TYR HD2 1 1 14 6246 1 1 26 TYR HE1 H -1.609 -2.362 -3.369 1.00 . A A . 29 TYR HE1 1 1 14 6247 1 1 26 TYR HE2 H 1.436 -2.643 -0.394 1.00 . A A . 29 TYR HE2 1 1 14 6248 1 1 26 TYR HH H 0.738 -3.104 -3.666 1.00 . A A . 29 TYR HH 1 1 14 6249 1 1 26 TYR N N -0.606 1.900 0.269 1.00 . A A . 29 TYR N 1 1 14 6250 1 1 26 TYR O O -2.749 2.385 2.293 1.00 . A A . 29 TYR O 1 1 14 6251 1 1 26 TYR OH O 0.699 -3.457 -2.774 1.00 . A A . 29 TYR OH 1 1 14 6252 1 1 27 TYR C C -5.992 3.620 1.189 1.00 . A A . 30 TYR C 1 1 14 6253 1 1 27 TYR CA C -4.568 4.156 1.179 1.00 . A A . 30 TYR CA 1 1 14 6254 1 1 27 TYR CB C -4.524 5.548 0.543 1.00 . A A . 30 TYR CB 1 1 14 6255 1 1 27 TYR CD1 C -5.756 7.030 2.179 1.00 . A A . 30 TYR CD1 1 1 14 6256 1 1 27 TYR CD2 C -6.714 6.695 0.021 1.00 . A A . 30 TYR CD2 1 1 14 6257 1 1 27 TYR CE1 C -6.817 7.846 2.527 1.00 . A A . 30 TYR CE1 1 1 14 6258 1 1 27 TYR CE2 C -7.776 7.510 0.361 1.00 . A A . 30 TYR CE2 1 1 14 6259 1 1 27 TYR CG C -5.687 6.442 0.922 1.00 . A A . 30 TYR CG 1 1 14 6260 1 1 27 TYR CZ C -7.824 8.082 1.614 1.00 . A A . 30 TYR CZ 1 1 14 6261 1 1 27 TYR H H -3.736 3.241 -0.526 1.00 . A A . 30 TYR H 1 1 14 6262 1 1 27 TYR HA H -4.211 4.220 2.195 1.00 . A A . 30 TYR HA 1 1 14 6263 1 1 27 TYR HB2 H -3.618 6.044 0.851 1.00 . A A . 30 TYR HB2 1 1 14 6264 1 1 27 TYR HB3 H -4.522 5.442 -0.532 1.00 . A A . 30 TYR HB3 1 1 14 6265 1 1 27 TYR HD1 H -4.966 6.845 2.890 1.00 . A A . 30 TYR HD1 1 1 14 6266 1 1 27 TYR HD2 H -6.674 6.245 -0.959 1.00 . A A . 30 TYR HD2 1 1 14 6267 1 1 27 TYR HE1 H -6.853 8.295 3.508 1.00 . A A . 30 TYR HE1 1 1 14 6268 1 1 27 TYR HE2 H -8.565 7.694 -0.353 1.00 . A A . 30 TYR HE2 1 1 14 6269 1 1 27 TYR HH H -8.550 9.688 2.383 1.00 . A A . 30 TYR HH 1 1 14 6270 1 1 27 TYR N N -3.697 3.253 0.451 1.00 . A A . 30 TYR N 1 1 14 6271 1 1 27 TYR O O -6.672 3.612 0.162 1.00 . A A . 30 TYR O 1 1 14 6272 1 1 27 TYR OH O -8.881 8.894 1.956 1.00 . A A . 30 TYR OH 1 1 14 6273 1 1 28 ASN C C -8.766 3.778 2.431 1.00 . A A . 31 ASN C 1 1 14 6274 1 1 28 ASN CA C -7.776 2.633 2.496 1.00 . A A . 31 ASN CA 1 1 14 6275 1 1 28 ASN CB C -7.917 1.890 3.828 1.00 . A A . 31 ASN CB 1 1 14 6276 1 1 28 ASN CG C -8.992 0.817 3.794 1.00 . A A . 31 ASN CG 1 1 14 6277 1 1 28 ASN H H -5.859 3.225 3.142 1.00 . A A . 31 ASN H 1 1 14 6278 1 1 28 ASN HA H -7.961 1.952 1.679 1.00 . A A . 31 ASN HA 1 1 14 6279 1 1 28 ASN HB2 H -6.977 1.421 4.072 1.00 . A A . 31 ASN HB2 1 1 14 6280 1 1 28 ASN HB3 H -8.170 2.601 4.602 1.00 . A A . 31 ASN HB3 1 1 14 6281 1 1 28 ASN HD21 H -9.956 1.778 2.346 1.00 . A A . 31 ASN HD21 1 1 14 6282 1 1 28 ASN HD22 H -10.680 0.305 2.878 1.00 . A A . 31 ASN HD22 1 1 14 6283 1 1 28 ASN N N -6.436 3.169 2.355 1.00 . A A . 31 ASN N 1 1 14 6284 1 1 28 ASN ND2 N -9.975 0.984 2.917 1.00 . A A . 31 ASN ND2 1 1 14 6285 1 1 28 ASN O O -8.890 4.534 3.386 1.00 . A A . 31 ASN O 1 1 14 6286 1 1 28 ASN OD1 O -8.936 -0.154 4.547 1.00 . A A . 31 ASN OD1 1 1 14 6287 1 1 29 THR C C -11.537 4.956 2.101 1.00 . A A . 32 THR C 1 1 14 6288 1 1 29 THR CA C -10.402 4.988 1.077 1.00 . A A . 32 THR CA 1 1 14 6289 1 1 29 THR CB C -11.014 4.915 -0.334 1.00 . A A . 32 THR CB 1 1 14 6290 1 1 29 THR CG2 C -9.939 5.063 -1.398 1.00 . A A . 32 THR CG2 1 1 14 6291 1 1 29 THR H H -9.250 3.289 0.552 1.00 . A A . 32 THR H 1 1 14 6292 1 1 29 THR HA H -9.882 5.929 1.167 1.00 . A A . 32 THR HA 1 1 14 6293 1 1 29 THR HB H -11.723 5.723 -0.444 1.00 . A A . 32 THR HB 1 1 14 6294 1 1 29 THR HG1 H -11.135 2.951 -0.202 1.00 . A A . 32 THR HG1 1 1 14 6295 1 1 29 THR HG21 H -9.247 4.237 -1.329 1.00 . A A . 32 THR HG21 1 1 14 6296 1 1 29 THR HG22 H -9.408 5.991 -1.249 1.00 . A A . 32 THR HG22 1 1 14 6297 1 1 29 THR HG23 H -10.399 5.066 -2.376 1.00 . A A . 32 THR HG23 1 1 14 6298 1 1 29 THR N N -9.430 3.918 1.286 1.00 . A A . 32 THR N 1 1 14 6299 1 1 29 THR O O -11.854 5.974 2.716 1.00 . A A . 32 THR O 1 1 14 6300 1 1 29 THR OG1 O -11.695 3.668 -0.509 1.00 . A A . 32 THR OG1 1 1 14 6301 1 1 30 GLU C C -12.833 3.867 4.649 1.00 . A A . 33 GLU C 1 1 14 6302 1 1 30 GLU CA C -13.259 3.636 3.204 1.00 . A A . 33 GLU CA 1 1 14 6303 1 1 30 GLU CB C -13.863 2.241 3.045 1.00 . A A . 33 GLU CB 1 1 14 6304 1 1 30 GLU CD C -16.020 2.784 4.246 1.00 . A A . 33 GLU CD 1 1 14 6305 1 1 30 GLU CG C -14.828 1.852 4.155 1.00 . A A . 33 GLU CG 1 1 14 6306 1 1 30 GLU H H -11.838 3.006 1.774 1.00 . A A . 33 GLU H 1 1 14 6307 1 1 30 GLU HA H -14.003 4.365 2.947 1.00 . A A . 33 GLU HA 1 1 14 6308 1 1 30 GLU HB2 H -14.397 2.200 2.107 1.00 . A A . 33 GLU HB2 1 1 14 6309 1 1 30 GLU HB3 H -13.060 1.522 3.021 1.00 . A A . 33 GLU HB3 1 1 14 6310 1 1 30 GLU HG2 H -15.186 0.852 3.969 1.00 . A A . 33 GLU HG2 1 1 14 6311 1 1 30 GLU HG3 H -14.300 1.874 5.097 1.00 . A A . 33 GLU HG3 1 1 14 6312 1 1 30 GLU N N -12.146 3.790 2.276 1.00 . A A . 33 GLU N 1 1 14 6313 1 1 30 GLU O O -13.320 4.780 5.316 1.00 . A A . 33 GLU O 1 1 14 6314 1 1 30 GLU OE1 O -15.929 3.797 4.971 1.00 . A A . 33 GLU OE1 1 1 14 6315 1 1 30 GLU OE2 O -17.047 2.500 3.593 1.00 . A A . 33 GLU OE2 1 1 14 6316 1 1 31 THR C C -10.591 4.372 6.721 1.00 . A A . 34 THR C 1 1 14 6317 1 1 31 THR CA C -11.432 3.118 6.491 1.00 . A A . 34 THR CA 1 1 14 6318 1 1 31 THR CB C -10.593 1.877 6.856 1.00 . A A . 34 THR CB 1 1 14 6319 1 1 31 THR CG2 C -10.032 1.986 8.267 1.00 . A A . 34 THR CG2 1 1 14 6320 1 1 31 THR H H -11.569 2.342 4.526 1.00 . A A . 34 THR H 1 1 14 6321 1 1 31 THR HA H -12.290 3.147 7.149 1.00 . A A . 34 THR HA 1 1 14 6322 1 1 31 THR HB H -9.767 1.805 6.162 1.00 . A A . 34 THR HB 1 1 14 6323 1 1 31 THR HG1 H -11.834 0.682 5.894 1.00 . A A . 34 THR HG1 1 1 14 6324 1 1 31 THR HG21 H -9.502 1.077 8.514 1.00 . A A . 34 THR HG21 1 1 14 6325 1 1 31 THR HG22 H -10.842 2.132 8.966 1.00 . A A . 34 THR HG22 1 1 14 6326 1 1 31 THR HG23 H -9.353 2.824 8.320 1.00 . A A . 34 THR HG23 1 1 14 6327 1 1 31 THR N N -11.923 3.033 5.119 1.00 . A A . 34 THR N 1 1 14 6328 1 1 31 THR O O -10.630 4.958 7.803 1.00 . A A . 34 THR O 1 1 14 6329 1 1 31 THR OG1 O -11.395 0.695 6.747 1.00 . A A . 34 THR OG1 1 1 14 6330 1 1 32 LYS C C -7.674 5.519 6.445 1.00 . A A . 35 LYS C 1 1 14 6331 1 1 32 LYS CA C -8.948 5.924 5.752 1.00 . A A . 35 LYS CA 1 1 14 6332 1 1 32 LYS CB C -9.608 7.121 6.450 1.00 . A A . 35 LYS CB 1 1 14 6333 1 1 32 LYS CD C -11.488 8.788 6.479 1.00 . A A . 35 LYS CD 1 1 14 6334 1 1 32 LYS CE C -12.790 9.223 5.826 1.00 . A A . 35 LYS CE 1 1 14 6335 1 1 32 LYS CG C -10.948 7.515 5.849 1.00 . A A . 35 LYS CG 1 1 14 6336 1 1 32 LYS H H -9.813 4.208 4.891 1.00 . A A . 35 LYS H 1 1 14 6337 1 1 32 LYS HA H -8.698 6.192 4.733 1.00 . A A . 35 LYS HA 1 1 14 6338 1 1 32 LYS HB2 H -9.762 6.879 7.491 1.00 . A A . 35 LYS HB2 1 1 14 6339 1 1 32 LYS HB3 H -8.946 7.972 6.383 1.00 . A A . 35 LYS HB3 1 1 14 6340 1 1 32 LYS HD2 H -11.665 8.611 7.530 1.00 . A A . 35 LYS HD2 1 1 14 6341 1 1 32 LYS HD3 H -10.756 9.573 6.363 1.00 . A A . 35 LYS HD3 1 1 14 6342 1 1 32 LYS HE2 H -12.608 9.404 4.777 1.00 . A A . 35 LYS HE2 1 1 14 6343 1 1 32 LYS HE3 H -13.514 8.429 5.932 1.00 . A A . 35 LYS HE3 1 1 14 6344 1 1 32 LYS HG2 H -10.823 7.676 4.789 1.00 . A A . 35 LYS HG2 1 1 14 6345 1 1 32 LYS HG3 H -11.654 6.714 6.013 1.00 . A A . 35 LYS HG3 1 1 14 6346 1 1 32 LYS HZ1 H -12.676 11.254 6.300 1.00 . A A . 35 LYS HZ1 1 1 14 6347 1 1 32 LYS HZ2 H -13.478 10.324 7.463 1.00 . A A . 35 LYS HZ2 1 1 14 6348 1 1 32 LYS HZ3 H -14.250 10.706 6.007 1.00 . A A . 35 LYS HZ3 1 1 14 6349 1 1 32 LYS N N -9.825 4.756 5.699 1.00 . A A . 35 LYS N 1 1 14 6350 1 1 32 LYS NZ N -13.337 10.464 6.442 1.00 . A A . 35 LYS NZ 1 1 14 6351 1 1 32 LYS O O -7.177 6.197 7.344 1.00 . A A . 35 LYS O 1 1 14 6352 1 1 33 GLN C C -4.872 3.672 5.479 1.00 . A A . 36 GLN C 1 1 14 6353 1 1 33 GLN CA C -5.935 3.833 6.555 1.00 . A A . 36 GLN CA 1 1 14 6354 1 1 33 GLN CB C -6.220 2.483 7.216 1.00 . A A . 36 GLN CB 1 1 14 6355 1 1 33 GLN CD C -4.768 0.585 8.035 1.00 . A A . 36 GLN CD 1 1 14 6356 1 1 33 GLN CG C -5.138 2.046 8.189 1.00 . A A . 36 GLN CG 1 1 14 6357 1 1 33 GLN H H -7.605 3.927 5.243 1.00 . A A . 36 GLN H 1 1 14 6358 1 1 33 GLN HA H -5.571 4.520 7.303 1.00 . A A . 36 GLN HA 1 1 14 6359 1 1 33 GLN HB2 H -7.154 2.549 7.754 1.00 . A A . 36 GLN HB2 1 1 14 6360 1 1 33 GLN HB3 H -6.311 1.731 6.448 1.00 . A A . 36 GLN HB3 1 1 14 6361 1 1 33 GLN HE21 H -3.345 1.064 6.734 1.00 . A A . 36 GLN HE21 1 1 14 6362 1 1 33 GLN HE22 H -3.507 -0.620 7.080 1.00 . A A . 36 GLN HE22 1 1 14 6363 1 1 33 GLN HG2 H -4.256 2.644 8.019 1.00 . A A . 36 GLN HG2 1 1 14 6364 1 1 33 GLN HG3 H -5.493 2.208 9.196 1.00 . A A . 36 GLN HG3 1 1 14 6365 1 1 33 GLN N N -7.155 4.389 5.993 1.00 . A A . 36 GLN N 1 1 14 6366 1 1 33 GLN NE2 N -3.774 0.315 7.198 1.00 . A A . 36 GLN NE2 1 1 14 6367 1 1 33 GLN O O -4.919 2.742 4.675 1.00 . A A . 36 GLN O 1 1 14 6368 1 1 33 GLN OE1 O -5.364 -0.290 8.664 1.00 . A A . 36 GLN OE1 1 1 14 6369 1 1 34 SER C C -1.538 3.988 5.137 1.00 . A A . 37 SER C 1 1 14 6370 1 1 34 SER CA C -2.819 4.547 4.516 1.00 . A A . 37 SER CA 1 1 14 6371 1 1 34 SER CB C -2.560 5.953 3.976 1.00 . A A . 37 SER CB 1 1 14 6372 1 1 34 SER H H -3.939 5.293 6.152 1.00 . A A . 37 SER H 1 1 14 6373 1 1 34 SER HA H -3.128 3.911 3.703 1.00 . A A . 37 SER HA 1 1 14 6374 1 1 34 SER HB2 H -1.709 5.930 3.313 1.00 . A A . 37 SER HB2 1 1 14 6375 1 1 34 SER HB3 H -3.429 6.294 3.435 1.00 . A A . 37 SER HB3 1 1 14 6376 1 1 34 SER HG H -2.691 6.543 5.840 1.00 . A A . 37 SER HG 1 1 14 6377 1 1 34 SER N N -3.905 4.575 5.490 1.00 . A A . 37 SER N 1 1 14 6378 1 1 34 SER O O -1.032 4.525 6.122 1.00 . A A . 37 SER O 1 1 14 6379 1 1 34 SER OG O -2.290 6.863 5.029 1.00 . A A . 37 SER OG 1 1 14 6380 1 1 35 THR C C 0.778 1.306 4.030 1.00 . A A . 38 THR C 1 1 14 6381 1 1 35 THR CA C 0.198 2.270 5.060 1.00 . A A . 38 THR CA 1 1 14 6382 1 1 35 THR CB C -0.072 1.502 6.368 1.00 . A A . 38 THR CB 1 1 14 6383 1 1 35 THR CG2 C -0.990 0.316 6.116 1.00 . A A . 38 THR CG2 1 1 14 6384 1 1 35 THR H H -1.466 2.514 3.772 1.00 . A A . 38 THR H 1 1 14 6385 1 1 35 THR HA H 0.921 3.046 5.264 1.00 . A A . 38 THR HA 1 1 14 6386 1 1 35 THR HB H -0.553 2.169 7.069 1.00 . A A . 38 THR HB 1 1 14 6387 1 1 35 THR HG1 H 1.831 1.722 6.839 1.00 . A A . 38 THR HG1 1 1 14 6388 1 1 35 THR HG21 H -1.202 -0.179 7.053 1.00 . A A . 38 THR HG21 1 1 14 6389 1 1 35 THR HG22 H -0.507 -0.377 5.444 1.00 . A A . 38 THR HG22 1 1 14 6390 1 1 35 THR HG23 H -1.913 0.663 5.674 1.00 . A A . 38 THR HG23 1 1 14 6391 1 1 35 THR N N -1.016 2.905 4.554 1.00 . A A . 38 THR N 1 1 14 6392 1 1 35 THR O O 0.130 0.996 3.031 1.00 . A A . 38 THR O 1 1 14 6393 1 1 35 THR OG1 O 1.162 1.040 6.931 1.00 . A A . 38 THR OG1 1 1 14 6394 1 1 36 TRP C C 2.469 -1.522 3.924 1.00 . A A . 39 TRP C 1 1 14 6395 1 1 36 TRP CA C 2.633 -0.113 3.361 1.00 . A A . 39 TRP CA 1 1 14 6396 1 1 36 TRP CB C 4.140 0.169 3.224 1.00 . A A . 39 TRP CB 1 1 14 6397 1 1 36 TRP CD1 C 4.831 2.365 4.290 1.00 . A A . 39 TRP CD1 1 1 14 6398 1 1 36 TRP CD2 C 4.735 2.433 2.067 1.00 . A A . 39 TRP CD2 1 1 14 6399 1 1 36 TRP CE2 C 5.133 3.697 2.537 1.00 . A A . 39 TRP CE2 1 1 14 6400 1 1 36 TRP CE3 C 4.609 2.233 0.695 1.00 . A A . 39 TRP CE3 1 1 14 6401 1 1 36 TRP CG C 4.534 1.605 3.209 1.00 . A A . 39 TRP CG 1 1 14 6402 1 1 36 TRP CH2 C 5.282 4.529 0.343 1.00 . A A . 39 TRP CH2 1 1 14 6403 1 1 36 TRP CZ2 C 5.409 4.753 1.682 1.00 . A A . 39 TRP CZ2 1 1 14 6404 1 1 36 TRP CZ3 C 4.885 3.284 -0.151 1.00 . A A . 39 TRP CZ3 1 1 14 6405 1 1 36 TRP H H 2.477 1.121 5.077 1.00 . A A . 39 TRP H 1 1 14 6406 1 1 36 TRP HA H 2.155 -0.042 2.393 1.00 . A A . 39 TRP HA 1 1 14 6407 1 1 36 TRP HB2 H 4.649 -0.278 4.064 1.00 . A A . 39 TRP HB2 1 1 14 6408 1 1 36 TRP HB3 H 4.500 -0.279 2.312 1.00 . A A . 39 TRP HB3 1 1 14 6409 1 1 36 TRP HD1 H 4.785 2.003 5.297 1.00 . A A . 39 TRP HD1 1 1 14 6410 1 1 36 TRP HE1 H 5.435 4.369 4.497 1.00 . A A . 39 TRP HE1 1 1 14 6411 1 1 36 TRP HE3 H 4.303 1.278 0.294 1.00 . A A . 39 TRP HE3 1 1 14 6412 1 1 36 TRP HH2 H 5.488 5.319 -0.360 1.00 . A A . 39 TRP HH2 1 1 14 6413 1 1 36 TRP HZ2 H 5.719 5.717 2.049 1.00 . A A . 39 TRP HZ2 1 1 14 6414 1 1 36 TRP HZ3 H 4.796 3.150 -1.215 1.00 . A A . 39 TRP HZ3 1 1 14 6415 1 1 36 TRP N N 1.999 0.832 4.273 1.00 . A A . 39 TRP N 1 1 14 6416 1 1 36 TRP NE1 N 5.185 3.632 3.900 1.00 . A A . 39 TRP NE1 1 1 14 6417 1 1 36 TRP O O 3.189 -1.913 4.843 1.00 . A A . 39 TRP O 1 1 14 6418 1 1 37 GLU C C 0.390 -4.402 2.881 1.00 . A A . 40 GLU C 1 1 14 6419 1 1 37 GLU CA C 1.278 -3.638 3.855 1.00 . A A . 40 GLU CA 1 1 14 6420 1 1 37 GLU CB C 0.626 -3.586 5.243 1.00 . A A . 40 GLU CB 1 1 14 6421 1 1 37 GLU CD C -1.501 -3.532 6.605 1.00 . A A . 40 GLU CD 1 1 14 6422 1 1 37 GLU CG C -0.895 -3.566 5.215 1.00 . A A . 40 GLU CG 1 1 14 6423 1 1 37 GLU H H 0.980 -1.938 2.634 1.00 . A A . 40 GLU H 1 1 14 6424 1 1 37 GLU HA H 2.230 -4.142 3.931 1.00 . A A . 40 GLU HA 1 1 14 6425 1 1 37 GLU HB2 H 0.943 -4.448 5.810 1.00 . A A . 40 GLU HB2 1 1 14 6426 1 1 37 GLU HB3 H 0.964 -2.690 5.746 1.00 . A A . 40 GLU HB3 1 1 14 6427 1 1 37 GLU HG2 H -1.220 -2.690 4.676 1.00 . A A . 40 GLU HG2 1 1 14 6428 1 1 37 GLU HG3 H -1.245 -4.452 4.707 1.00 . A A . 40 GLU HG3 1 1 14 6429 1 1 37 GLU N N 1.523 -2.286 3.375 1.00 . A A . 40 GLU N 1 1 14 6430 1 1 37 GLU O O -0.227 -3.809 2.001 1.00 . A A . 40 GLU O 1 1 14 6431 1 1 37 GLU OE1 O -1.573 -4.601 7.247 1.00 . A A . 40 GLU OE1 1 1 14 6432 1 1 37 GLU OE2 O -1.902 -2.437 7.051 1.00 . A A . 40 GLU OE2 1 1 14 6433 1 1 38 LYS C C -1.955 -6.335 2.528 1.00 . A A . 41 LYS C 1 1 14 6434 1 1 38 LYS CA C -0.477 -6.570 2.218 1.00 . A A . 41 LYS CA 1 1 14 6435 1 1 38 LYS CB C -0.117 -8.030 2.487 1.00 . A A . 41 LYS CB 1 1 14 6436 1 1 38 LYS CD C 1.336 -9.711 3.674 1.00 . A A . 41 LYS CD 1 1 14 6437 1 1 38 LYS CE C 2.123 -10.196 2.468 1.00 . A A . 41 LYS CE 1 1 14 6438 1 1 38 LYS CG C 0.958 -8.242 3.545 1.00 . A A . 41 LYS CG 1 1 14 6439 1 1 38 LYS H H 0.857 -6.134 3.749 1.00 . A A . 41 LYS H 1 1 14 6440 1 1 38 LYS HA H -0.278 -6.335 1.183 1.00 . A A . 41 LYS HA 1 1 14 6441 1 1 38 LYS HB2 H -0.999 -8.529 2.824 1.00 . A A . 41 LYS HB2 1 1 14 6442 1 1 38 LYS HB3 H 0.219 -8.477 1.571 1.00 . A A . 41 LYS HB3 1 1 14 6443 1 1 38 LYS HD2 H 1.940 -9.840 4.560 1.00 . A A . 41 LYS HD2 1 1 14 6444 1 1 38 LYS HD3 H 0.433 -10.297 3.763 1.00 . A A . 41 LYS HD3 1 1 14 6445 1 1 38 LYS HE2 H 1.549 -9.996 1.576 1.00 . A A . 41 LYS HE2 1 1 14 6446 1 1 38 LYS HE3 H 3.057 -9.655 2.423 1.00 . A A . 41 LYS HE3 1 1 14 6447 1 1 38 LYS HG2 H 1.836 -7.677 3.273 1.00 . A A . 41 LYS HG2 1 1 14 6448 1 1 38 LYS HG3 H 0.584 -7.896 4.498 1.00 . A A . 41 LYS HG3 1 1 14 6449 1 1 38 LYS HZ1 H 1.525 -12.197 2.478 1.00 . A A . 41 LYS HZ1 1 1 14 6450 1 1 38 LYS HZ2 H 2.878 -11.882 3.444 1.00 . A A . 41 LYS HZ2 1 1 14 6451 1 1 38 LYS HZ3 H 3.035 -11.937 1.761 1.00 . A A . 41 LYS HZ3 1 1 14 6452 1 1 38 LYS N N 0.336 -5.719 3.047 1.00 . A A . 41 LYS N 1 1 14 6453 1 1 38 LYS NZ N 2.410 -11.655 2.543 1.00 . A A . 41 LYS NZ 1 1 14 6454 1 1 38 LYS O O -2.443 -6.770 3.571 1.00 . A A . 41 LYS O 1 1 14 6455 1 1 39 PRO C C -4.996 -6.576 1.578 1.00 . A A . 42 PRO C 1 1 14 6456 1 1 39 PRO CA C -4.112 -5.364 1.855 1.00 . A A . 42 PRO CA 1 1 14 6457 1 1 39 PRO CB C -4.426 -4.234 0.862 1.00 . A A . 42 PRO CB 1 1 14 6458 1 1 39 PRO CD C -2.245 -5.112 0.351 1.00 . A A . 42 PRO CD 1 1 14 6459 1 1 39 PRO CG C -3.142 -3.923 0.162 1.00 . A A . 42 PRO CG 1 1 14 6460 1 1 39 PRO HA H -4.284 -5.014 2.863 1.00 . A A . 42 PRO HA 1 1 14 6461 1 1 39 PRO HB2 H -5.182 -4.566 0.165 1.00 . A A . 42 PRO HB2 1 1 14 6462 1 1 39 PRO HB3 H -4.789 -3.375 1.405 1.00 . A A . 42 PRO HB3 1 1 14 6463 1 1 39 PRO HD2 H -2.392 -5.829 -0.444 1.00 . A A . 42 PRO HD2 1 1 14 6464 1 1 39 PRO HD3 H -1.211 -4.805 0.401 1.00 . A A . 42 PRO HD3 1 1 14 6465 1 1 39 PRO HG2 H -3.329 -3.759 -0.889 1.00 . A A . 42 PRO HG2 1 1 14 6466 1 1 39 PRO HG3 H -2.699 -3.044 0.604 1.00 . A A . 42 PRO HG3 1 1 14 6467 1 1 39 PRO N N -2.699 -5.650 1.635 1.00 . A A . 42 PRO N 1 1 14 6468 1 1 39 PRO O O -5.052 -7.069 0.452 1.00 . A A . 42 PRO O 1 1 15 6469 1 1 12 SER C C -10.761 -1.713 -2.780 1.00 . A A . 15 SER C 1 1 15 6470 1 1 12 SER CA C -10.591 -3.081 -3.434 1.00 . A A . 15 SER CA 1 1 15 6471 1 1 12 SER CB C -11.593 -4.069 -2.837 1.00 . A A . 15 SER CB 1 1 15 6472 1 1 12 SER H H -8.694 -3.251 -2.511 1.00 . A A . 15 SER H 1 1 15 6473 1 1 12 SER HA H -10.778 -2.988 -4.493 1.00 . A A . 15 SER HA 1 1 15 6474 1 1 12 SER HB2 H -11.522 -5.010 -3.362 1.00 . A A . 15 SER HB2 1 1 15 6475 1 1 12 SER HB3 H -11.363 -4.222 -1.793 1.00 . A A . 15 SER HB3 1 1 15 6476 1 1 12 SER HG H -12.935 -2.647 -2.742 1.00 . A A . 15 SER HG 1 1 15 6477 1 1 12 SER N N -9.232 -3.579 -3.260 1.00 . A A . 15 SER N 1 1 15 6478 1 1 12 SER O O -10.895 -0.699 -3.467 1.00 . A A . 15 SER O 1 1 15 6479 1 1 12 SER OG O -12.919 -3.583 -2.949 1.00 . A A . 15 SER OG 1 1 15 6480 1 1 13 MET C C -9.582 0.276 -0.544 1.00 . A A . 16 MET C 1 1 15 6481 1 1 13 MET CA C -10.915 -0.446 -0.706 1.00 . A A . 16 MET CA 1 1 15 6482 1 1 13 MET CB C -11.520 -0.717 0.673 1.00 . A A . 16 MET CB 1 1 15 6483 1 1 13 MET CE C -12.475 -1.770 3.381 1.00 . A A . 16 MET CE 1 1 15 6484 1 1 13 MET CG C -12.820 -1.504 0.631 1.00 . A A . 16 MET CG 1 1 15 6485 1 1 13 MET H H -10.642 -2.531 -0.958 1.00 . A A . 16 MET H 1 1 15 6486 1 1 13 MET HA H -11.588 0.187 -1.264 1.00 . A A . 16 MET HA 1 1 15 6487 1 1 13 MET HB2 H -10.808 -1.276 1.262 1.00 . A A . 16 MET HB2 1 1 15 6488 1 1 13 MET HB3 H -11.713 0.227 1.161 1.00 . A A . 16 MET HB3 1 1 15 6489 1 1 13 MET HE1 H -11.708 -1.012 3.335 1.00 . A A . 16 MET HE1 1 1 15 6490 1 1 13 MET HE2 H -12.041 -2.735 3.164 1.00 . A A . 16 MET HE2 1 1 15 6491 1 1 13 MET HE3 H -12.909 -1.785 4.370 1.00 . A A . 16 MET HE3 1 1 15 6492 1 1 13 MET HG2 H -13.435 -1.111 -0.165 1.00 . A A . 16 MET HG2 1 1 15 6493 1 1 13 MET HG3 H -12.593 -2.540 0.430 1.00 . A A . 16 MET HG3 1 1 15 6494 1 1 13 MET N N -10.755 -1.690 -1.451 1.00 . A A . 16 MET N 1 1 15 6495 1 1 13 MET O O -9.541 1.412 -0.075 1.00 . A A . 16 MET O 1 1 15 6496 1 1 13 MET SD S -13.749 -1.404 2.175 1.00 . A A . 16 MET SD 1 1 15 6497 1 1 14 TRP C C -6.633 0.673 -2.162 1.00 . A A . 17 TRP C 1 1 15 6498 1 1 14 TRP CA C -7.168 0.216 -0.810 1.00 . A A . 17 TRP CA 1 1 15 6499 1 1 14 TRP CB C -6.177 -0.767 -0.183 1.00 . A A . 17 TRP CB 1 1 15 6500 1 1 14 TRP CD1 C -7.695 -2.303 1.200 1.00 . A A . 17 TRP CD1 1 1 15 6501 1 1 14 TRP CD2 C -6.139 -1.215 2.381 1.00 . A A . 17 TRP CD2 1 1 15 6502 1 1 14 TRP CE2 C -6.887 -2.013 3.262 1.00 . A A . 17 TRP CE2 1 1 15 6503 1 1 14 TRP CE3 C -5.099 -0.438 2.889 1.00 . A A . 17 TRP CE3 1 1 15 6504 1 1 14 TRP CG C -6.669 -1.410 1.073 1.00 . A A . 17 TRP CG 1 1 15 6505 1 1 14 TRP CH2 C -5.601 -1.284 5.100 1.00 . A A . 17 TRP CH2 1 1 15 6506 1 1 14 TRP CZ2 C -6.628 -2.055 4.628 1.00 . A A . 17 TRP CZ2 1 1 15 6507 1 1 14 TRP CZ3 C -4.839 -0.480 4.241 1.00 . A A . 17 TRP CZ3 1 1 15 6508 1 1 14 TRP H H -8.583 -1.283 -1.306 1.00 . A A . 17 TRP H 1 1 15 6509 1 1 14 TRP HA H -7.254 1.075 -0.165 1.00 . A A . 17 TRP HA 1 1 15 6510 1 1 14 TRP HB2 H -5.951 -1.548 -0.888 1.00 . A A . 17 TRP HB2 1 1 15 6511 1 1 14 TRP HB3 H -5.264 -0.234 0.058 1.00 . A A . 17 TRP HB3 1 1 15 6512 1 1 14 TRP HD1 H -8.300 -2.657 0.379 1.00 . A A . 17 TRP HD1 1 1 15 6513 1 1 14 TRP HE1 H -8.499 -3.298 2.865 1.00 . A A . 17 TRP HE1 1 1 15 6514 1 1 14 TRP HE3 H -4.502 0.187 2.240 1.00 . A A . 17 TRP HE3 1 1 15 6515 1 1 14 TRP HH2 H -5.363 -1.285 6.153 1.00 . A A . 17 TRP HH2 1 1 15 6516 1 1 14 TRP HZ2 H -7.207 -2.668 5.301 1.00 . A A . 17 TRP HZ2 1 1 15 6517 1 1 14 TRP HZ3 H -4.039 0.114 4.648 1.00 . A A . 17 TRP HZ3 1 1 15 6518 1 1 14 TRP N N -8.493 -0.382 -0.932 1.00 . A A . 17 TRP N 1 1 15 6519 1 1 14 TRP NE1 N -7.833 -2.669 2.517 1.00 . A A . 17 TRP NE1 1 1 15 6520 1 1 14 TRP O O -6.374 -0.142 -3.047 1.00 . A A . 17 TRP O 1 1 15 6521 1 1 15 THR C C -4.499 2.992 -3.311 1.00 . A A . 18 THR C 1 1 15 6522 1 1 15 THR CA C -5.942 2.557 -3.538 1.00 . A A . 18 THR CA 1 1 15 6523 1 1 15 THR CB C -6.776 3.764 -4.001 1.00 . A A . 18 THR CB 1 1 15 6524 1 1 15 THR CG2 C -8.141 3.319 -4.500 1.00 . A A . 18 THR CG2 1 1 15 6525 1 1 15 THR H H -6.726 2.581 -1.583 1.00 . A A . 18 THR H 1 1 15 6526 1 1 15 THR HA H -5.974 1.799 -4.304 1.00 . A A . 18 THR HA 1 1 15 6527 1 1 15 THR HB H -6.254 4.250 -4.810 1.00 . A A . 18 THR HB 1 1 15 6528 1 1 15 THR HG1 H -6.072 4.949 -2.589 1.00 . A A . 18 THR HG1 1 1 15 6529 1 1 15 THR HG21 H -8.018 2.646 -5.336 1.00 . A A . 18 THR HG21 1 1 15 6530 1 1 15 THR HG22 H -8.709 4.182 -4.816 1.00 . A A . 18 THR HG22 1 1 15 6531 1 1 15 THR HG23 H -8.668 2.812 -3.706 1.00 . A A . 18 THR HG23 1 1 15 6532 1 1 15 THR N N -6.474 1.983 -2.313 1.00 . A A . 18 THR N 1 1 15 6533 1 1 15 THR O O -4.243 3.934 -2.564 1.00 . A A . 18 THR O 1 1 15 6534 1 1 15 THR OG1 O -6.935 4.695 -2.924 1.00 . A A . 18 THR OG1 1 1 15 6535 1 1 16 GLU C C -1.541 3.479 -4.901 1.00 . A A . 19 GLU C 1 1 15 6536 1 1 16 GLU CA C -2.143 2.635 -3.780 1.00 . A A . 19 GLU CA 1 1 15 6537 1 1 16 GLU CB C -1.336 1.344 -3.624 1.00 . A A . 19 GLU CB 1 1 15 6538 1 1 16 GLU CD C -2.402 0.181 -5.606 1.00 . A A . 19 GLU CD 1 1 15 6539 1 1 16 GLU CG C -1.109 0.586 -4.925 1.00 . A A . 19 GLU CG 1 1 15 6540 1 1 16 GLU H H -3.811 1.596 -4.572 1.00 . A A . 19 GLU H 1 1 15 6541 1 1 16 GLU HA H -2.068 3.194 -2.863 1.00 . A A . 19 GLU HA 1 1 15 6542 1 1 16 GLU HB2 H -0.372 1.587 -3.203 1.00 . A A . 19 GLU HB2 1 1 15 6543 1 1 16 GLU HB3 H -1.859 0.694 -2.943 1.00 . A A . 19 GLU HB3 1 1 15 6544 1 1 16 GLU HG2 H -0.547 1.214 -5.600 1.00 . A A . 19 GLU HG2 1 1 15 6545 1 1 16 GLU HG3 H -0.540 -0.306 -4.709 1.00 . A A . 19 GLU HG3 1 1 15 6546 1 1 16 GLU N N -3.556 2.324 -3.974 1.00 . A A . 19 GLU N 1 1 15 6547 1 1 16 GLU O O -1.911 3.361 -6.069 1.00 . A A . 19 GLU O 1 1 15 6548 1 1 16 GLU OE1 O -2.990 -0.846 -5.203 1.00 . A A . 19 GLU OE1 1 1 15 6549 1 1 16 GLU OE2 O -2.828 0.889 -6.542 1.00 . A A . 19 GLU OE2 1 1 15 6550 1 1 17 HIS C C 1.502 5.535 -4.853 1.00 . A A . 20 HIS C 1 1 15 6551 1 1 17 HIS CA C 0.113 5.229 -5.415 1.00 . A A . 20 HIS CA 1 1 15 6552 1 1 17 HIS CB C -0.646 6.547 -5.595 1.00 . A A . 20 HIS CB 1 1 15 6553 1 1 17 HIS CD2 C -3.115 6.336 -4.815 1.00 . A A . 20 HIS CD2 1 1 15 6554 1 1 17 HIS CE1 C -4.058 6.171 -6.788 1.00 . A A . 20 HIS CE1 1 1 15 6555 1 1 17 HIS CG C -2.129 6.393 -5.746 1.00 . A A . 20 HIS CG 1 1 15 6556 1 1 17 HIS H H -0.367 4.366 -3.549 1.00 . A A . 20 HIS H 1 1 15 6557 1 1 17 HIS HA H 0.213 4.734 -6.369 1.00 . A A . 20 HIS HA 1 1 15 6558 1 1 17 HIS HB2 H -0.468 7.174 -4.735 1.00 . A A . 20 HIS HB2 1 1 15 6559 1 1 17 HIS HB3 H -0.271 7.046 -6.476 1.00 . A A . 20 HIS HB3 1 1 15 6560 1 1 17 HIS HD1 H -2.309 6.292 -7.843 1.00 . A A . 20 HIS HD1 1 1 15 6561 1 1 17 HIS HD2 H -2.990 6.387 -3.740 1.00 . A A . 20 HIS HD2 1 1 15 6562 1 1 17 HIS HE1 H -4.798 6.071 -7.569 1.00 . A A . 20 HIS HE1 1 1 15 6563 1 1 17 HIS HE2 H -5.195 6.241 -5.087 1.00 . A A . 20 HIS HE2 1 1 15 6564 1 1 17 HIS N N -0.596 4.336 -4.502 1.00 . A A . 20 HIS N 1 1 15 6565 1 1 17 HIS ND1 N -2.754 6.285 -6.970 1.00 . A A . 20 HIS ND1 1 1 15 6566 1 1 17 HIS NE2 N -4.303 6.198 -5.492 1.00 . A A . 20 HIS NE2 1 1 15 6567 1 1 17 HIS O O 1.731 5.386 -3.655 1.00 . A A . 20 HIS O 1 1 15 6568 1 1 18 LYS C C 3.754 7.222 -4.070 1.00 . A A . 21 LYS C 1 1 15 6569 1 1 18 LYS CA C 3.777 6.288 -5.273 1.00 . A A . 21 LYS CA 1 1 15 6570 1 1 18 LYS CB C 4.561 6.912 -6.420 1.00 . A A . 21 LYS CB 1 1 15 6571 1 1 18 LYS CD C 3.625 6.491 -8.708 1.00 . A A . 21 LYS CD 1 1 15 6572 1 1 18 LYS CE C 3.152 5.335 -9.573 1.00 . A A . 21 LYS CE 1 1 15 6573 1 1 18 LYS CG C 4.587 6.015 -7.634 1.00 . A A . 21 LYS CG 1 1 15 6574 1 1 18 LYS H H 2.218 5.998 -6.671 1.00 . A A . 21 LYS H 1 1 15 6575 1 1 18 LYS HA H 4.261 5.368 -4.984 1.00 . A A . 21 LYS HA 1 1 15 6576 1 1 18 LYS HB2 H 4.102 7.852 -6.693 1.00 . A A . 21 LYS HB2 1 1 15 6577 1 1 18 LYS HB3 H 5.577 7.088 -6.103 1.00 . A A . 21 LYS HB3 1 1 15 6578 1 1 18 LYS HD2 H 2.769 6.948 -8.236 1.00 . A A . 21 LYS HD2 1 1 15 6579 1 1 18 LYS HD3 H 4.126 7.215 -9.333 1.00 . A A . 21 LYS HD3 1 1 15 6580 1 1 18 LYS HE2 H 2.616 5.731 -10.423 1.00 . A A . 21 LYS HE2 1 1 15 6581 1 1 18 LYS HE3 H 4.015 4.783 -9.915 1.00 . A A . 21 LYS HE3 1 1 15 6582 1 1 18 LYS HG2 H 5.588 5.991 -8.039 1.00 . A A . 21 LYS HG2 1 1 15 6583 1 1 18 LYS HG3 H 4.295 5.025 -7.320 1.00 . A A . 21 LYS HG3 1 1 15 6584 1 1 18 LYS HZ1 H 1.445 4.937 -8.435 1.00 . A A . 21 LYS HZ1 1 1 15 6585 1 1 18 LYS HZ2 H 2.775 3.971 -8.036 1.00 . A A . 21 LYS HZ2 1 1 15 6586 1 1 18 LYS HZ3 H 1.903 3.665 -9.452 1.00 . A A . 21 LYS HZ3 1 1 15 6587 1 1 18 LYS N N 2.430 5.949 -5.715 1.00 . A A . 21 LYS N 1 1 15 6588 1 1 18 LYS NZ N 2.256 4.413 -8.821 1.00 . A A . 21 LYS NZ 1 1 15 6589 1 1 18 LYS O O 2.798 7.971 -3.863 1.00 . A A . 21 LYS O 1 1 15 6590 1 1 19 SER C C 6.369 7.954 -1.537 1.00 . A A . 22 SER C 1 1 15 6591 1 1 19 SER CA C 4.932 7.985 -2.079 1.00 . A A . 22 SER CA 1 1 15 6592 1 1 19 SER CB C 3.934 7.470 -1.039 1.00 . A A . 22 SER CB 1 1 15 6593 1 1 19 SER H H 5.559 6.570 -3.518 1.00 . A A . 22 SER H 1 1 15 6594 1 1 19 SER HA H 4.678 9.002 -2.340 1.00 . A A . 22 SER HA 1 1 15 6595 1 1 19 SER HB2 H 3.738 6.423 -1.222 1.00 . A A . 22 SER HB2 1 1 15 6596 1 1 19 SER HB3 H 4.346 7.591 -0.050 1.00 . A A . 22 SER HB3 1 1 15 6597 1 1 19 SER HG H 2.672 8.827 -0.411 1.00 . A A . 22 SER HG 1 1 15 6598 1 1 19 SER N N 4.822 7.172 -3.281 1.00 . A A . 22 SER N 1 1 15 6599 1 1 19 SER O O 7.211 7.234 -2.080 1.00 . A A . 22 SER O 1 1 15 6600 1 1 19 SER OG O 2.711 8.179 -1.118 1.00 . A A . 22 SER OG 1 1 15 6601 1 1 20 PRO C C 8.800 7.502 0.051 1.00 . A A . 23 PRO C 1 1 15 6602 1 1 20 PRO CA C 8.013 8.808 0.130 1.00 . A A . 23 PRO CA 1 1 15 6603 1 1 20 PRO CB C 7.705 9.151 1.582 1.00 . A A . 23 PRO CB 1 1 15 6604 1 1 20 PRO CD C 5.744 9.643 0.247 1.00 . A A . 23 PRO CD 1 1 15 6605 1 1 20 PRO CG C 6.472 9.992 1.527 1.00 . A A . 23 PRO CG 1 1 15 6606 1 1 20 PRO HA H 8.598 9.603 -0.307 1.00 . A A . 23 PRO HA 1 1 15 6607 1 1 20 PRO HB2 H 7.538 8.242 2.141 1.00 . A A . 23 PRO HB2 1 1 15 6608 1 1 20 PRO HB3 H 8.533 9.697 2.008 1.00 . A A . 23 PRO HB3 1 1 15 6609 1 1 20 PRO HD2 H 4.820 9.139 0.474 1.00 . A A . 23 PRO HD2 1 1 15 6610 1 1 20 PRO HD3 H 5.551 10.533 -0.332 1.00 . A A . 23 PRO HD3 1 1 15 6611 1 1 20 PRO HG2 H 5.846 9.771 2.380 1.00 . A A . 23 PRO HG2 1 1 15 6612 1 1 20 PRO HG3 H 6.745 11.037 1.526 1.00 . A A . 23 PRO HG3 1 1 15 6613 1 1 20 PRO N N 6.676 8.741 -0.468 1.00 . A A . 23 PRO N 1 1 15 6614 1 1 20 PRO O O 8.227 6.412 0.024 1.00 . A A . 23 PRO O 1 1 15 6615 1 1 21 ASP C C 10.997 5.850 -1.435 1.00 . A A . 24 ASP C 1 1 15 6616 1 1 21 ASP CA C 11.037 6.496 -0.050 1.00 . A A . 24 ASP CA 1 1 15 6617 1 1 21 ASP CB C 10.705 5.464 1.034 1.00 . A A . 24 ASP CB 1 1 15 6618 1 1 21 ASP CG C 11.778 4.400 1.173 1.00 . A A . 24 ASP CG 1 1 15 6619 1 1 21 ASP H H 10.509 8.540 0.054 1.00 . A A . 24 ASP H 1 1 15 6620 1 1 21 ASP HA H 12.037 6.866 0.122 1.00 . A A . 24 ASP HA 1 1 15 6621 1 1 21 ASP HB2 H 10.604 5.970 1.982 1.00 . A A . 24 ASP HB2 1 1 15 6622 1 1 21 ASP HB3 H 9.771 4.980 0.789 1.00 . A A . 24 ASP HB3 1 1 15 6623 1 1 21 ASP N N 10.128 7.637 0.024 1.00 . A A . 24 ASP N 1 1 15 6624 1 1 21 ASP O O 11.701 4.875 -1.698 1.00 . A A . 24 ASP O 1 1 15 6625 1 1 21 ASP OD1 O 11.689 3.370 0.473 1.00 . A A . 24 ASP OD1 1 1 15 6626 1 1 21 ASP OD2 O 12.707 4.599 1.982 1.00 . A A . 24 ASP OD2 1 1 15 6627 1 1 22 GLY C C 9.376 4.542 -3.703 1.00 . A A . 25 GLY C 1 1 15 6628 1 1 22 GLY CA C 10.060 5.887 -3.666 1.00 . A A . 25 GLY CA 1 1 15 6629 1 1 22 GLY H H 9.630 7.172 -2.051 1.00 . A A . 25 GLY H 1 1 15 6630 1 1 22 GLY HA2 H 9.488 6.583 -4.267 1.00 . A A . 25 GLY HA2 1 1 15 6631 1 1 22 GLY HA3 H 11.046 5.793 -4.082 1.00 . A A . 25 GLY HA3 1 1 15 6632 1 1 22 GLY N N 10.172 6.409 -2.318 1.00 . A A . 25 GLY N 1 1 15 6633 1 1 22 GLY O O 9.838 3.611 -4.360 1.00 . A A . 25 GLY O 1 1 15 6634 1 1 23 ARG C C 6.006 3.578 -2.974 1.00 . A A . 26 ARG C 1 1 15 6635 1 1 23 ARG CA C 7.482 3.232 -2.926 1.00 . A A . 26 ARG CA 1 1 15 6636 1 1 23 ARG CB C 7.817 2.424 -1.670 1.00 . A A . 26 ARG CB 1 1 15 6637 1 1 23 ARG CD C 8.829 2.447 0.621 1.00 . A A . 26 ARG CD 1 1 15 6638 1 1 23 ARG CG C 8.141 3.269 -0.453 1.00 . A A . 26 ARG CG 1 1 15 6639 1 1 23 ARG CZ C 8.354 0.506 2.059 1.00 . A A . 26 ARG CZ 1 1 15 6640 1 1 23 ARG H H 7.946 5.247 -2.508 1.00 . A A . 26 ARG H 1 1 15 6641 1 1 23 ARG HA H 7.723 2.642 -3.798 1.00 . A A . 26 ARG HA 1 1 15 6642 1 1 23 ARG HB2 H 6.973 1.798 -1.426 1.00 . A A . 26 ARG HB2 1 1 15 6643 1 1 23 ARG HB3 H 8.670 1.795 -1.881 1.00 . A A . 26 ARG HB3 1 1 15 6644 1 1 23 ARG HD2 H 9.737 2.029 0.213 1.00 . A A . 26 ARG HD2 1 1 15 6645 1 1 23 ARG HD3 H 9.072 3.096 1.447 1.00 . A A . 26 ARG HD3 1 1 15 6646 1 1 23 ARG HE H 7.096 1.261 0.706 1.00 . A A . 26 ARG HE 1 1 15 6647 1 1 23 ARG HG2 H 8.791 4.077 -0.749 1.00 . A A . 26 ARG HG2 1 1 15 6648 1 1 23 ARG HG3 H 7.227 3.670 -0.049 1.00 . A A . 26 ARG HG3 1 1 15 6649 1 1 23 ARG HH11 H 10.182 1.328 2.321 1.00 . A A . 26 ARG HH11 1 1 15 6650 1 1 23 ARG HH12 H 9.828 -0.032 3.332 1.00 . A A . 26 ARG HH12 1 1 15 6651 1 1 23 ARG HH21 H 6.620 -0.533 2.034 1.00 . A A . 26 ARG HH21 1 1 15 6652 1 1 23 ARG HH22 H 7.803 -1.091 3.168 1.00 . A A . 26 ARG HH22 1 1 15 6653 1 1 23 ARG N N 8.263 4.454 -2.994 1.00 . A A . 26 ARG N 1 1 15 6654 1 1 23 ARG NE N 7.984 1.359 1.107 1.00 . A A . 26 ARG NE 1 1 15 6655 1 1 23 ARG NH1 N 9.553 0.609 2.617 1.00 . A A . 26 ARG NH1 1 1 15 6656 1 1 23 ARG NH2 N 7.523 -0.451 2.453 1.00 . A A . 26 ARG NH2 1 1 15 6657 1 1 23 ARG O O 5.637 4.742 -2.831 1.00 . A A . 26 ARG O 1 1 15 6658 1 1 24 THR C C 2.996 2.457 -1.991 1.00 . A A . 27 THR C 1 1 15 6659 1 1 24 THR CA C 3.733 2.832 -3.269 1.00 . A A . 27 THR CA 1 1 15 6660 1 1 24 THR CB C 3.104 2.073 -4.455 1.00 . A A . 27 THR CB 1 1 15 6661 1 1 24 THR CG2 C 3.261 0.565 -4.290 1.00 . A A . 27 THR CG2 1 1 15 6662 1 1 24 THR H H 5.502 1.665 -3.243 1.00 . A A . 27 THR H 1 1 15 6663 1 1 24 THR HA H 3.603 3.891 -3.443 1.00 . A A . 27 THR HA 1 1 15 6664 1 1 24 THR HB H 3.607 2.375 -5.363 1.00 . A A . 27 THR HB 1 1 15 6665 1 1 24 THR HG1 H 1.529 3.181 -4.032 1.00 . A A . 27 THR HG1 1 1 15 6666 1 1 24 THR HG21 H 2.828 0.064 -5.143 1.00 . A A . 27 THR HG21 1 1 15 6667 1 1 24 THR HG22 H 2.755 0.245 -3.391 1.00 . A A . 27 THR HG22 1 1 15 6668 1 1 24 THR HG23 H 4.309 0.317 -4.220 1.00 . A A . 27 THR HG23 1 1 15 6669 1 1 24 THR N N 5.162 2.582 -3.172 1.00 . A A . 27 THR N 1 1 15 6670 1 1 24 THR O O 3.132 1.347 -1.478 1.00 . A A . 27 THR O 1 1 15 6671 1 1 24 THR OG1 O 1.715 2.402 -4.560 1.00 . A A . 27 THR OG1 1 1 15 6672 1 1 25 TYR C C -0.023 2.931 -0.643 1.00 . A A . 28 TYR C 1 1 15 6673 1 1 25 TYR CA C 1.427 3.187 -0.277 1.00 . A A . 28 TYR CA 1 1 15 6674 1 1 25 TYR CB C 1.547 4.381 0.697 1.00 . A A . 28 TYR CB 1 1 15 6675 1 1 25 TYR CD1 C 0.437 5.928 -1.032 1.00 . A A . 28 TYR CD1 1 1 15 6676 1 1 25 TYR CD2 C 0.827 6.759 1.166 1.00 . A A . 28 TYR CD2 1 1 15 6677 1 1 25 TYR CE1 C -0.122 7.140 -1.393 1.00 . A A . 28 TYR CE1 1 1 15 6678 1 1 25 TYR CE2 C 0.269 7.972 0.810 1.00 . A A . 28 TYR CE2 1 1 15 6679 1 1 25 TYR CG C 0.923 5.709 0.257 1.00 . A A . 28 TYR CG 1 1 15 6680 1 1 25 TYR CZ C -0.203 8.157 -0.469 1.00 . A A . 28 TYR CZ 1 1 15 6681 1 1 25 TYR H H 2.172 4.275 -1.932 1.00 . A A . 28 TYR H 1 1 15 6682 1 1 25 TYR HA H 1.818 2.303 0.207 1.00 . A A . 28 TYR HA 1 1 15 6683 1 1 25 TYR HB2 H 1.078 4.108 1.628 1.00 . A A . 28 TYR HB2 1 1 15 6684 1 1 25 TYR HB3 H 2.594 4.563 0.885 1.00 . A A . 28 TYR HB3 1 1 15 6685 1 1 25 TYR HD1 H 0.495 5.137 -1.757 1.00 . A A . 28 TYR HD1 1 1 15 6686 1 1 25 TYR HD2 H 1.199 6.616 2.169 1.00 . A A . 28 TYR HD2 1 1 15 6687 1 1 25 TYR HE1 H -0.493 7.284 -2.397 1.00 . A A . 28 TYR HE1 1 1 15 6688 1 1 25 TYR HE2 H 0.206 8.770 1.535 1.00 . A A . 28 TYR HE2 1 1 15 6689 1 1 25 TYR HH H -0.210 10.080 -0.499 1.00 . A A . 28 TYR HH 1 1 15 6690 1 1 25 TYR N N 2.211 3.405 -1.486 1.00 . A A . 28 TYR N 1 1 15 6691 1 1 25 TYR O O -0.490 3.388 -1.677 1.00 . A A . 28 TYR O 1 1 15 6692 1 1 25 TYR OH O -0.760 9.365 -0.827 1.00 . A A . 28 TYR OH 1 1 15 6693 1 1 26 TYR C C -3.025 2.755 0.788 1.00 . A A . 29 TYR C 1 1 15 6694 1 1 26 TYR CA C -2.130 1.889 -0.079 1.00 . A A . 29 TYR CA 1 1 15 6695 1 1 26 TYR CB C -2.436 0.408 0.166 1.00 . A A . 29 TYR CB 1 1 15 6696 1 1 26 TYR CD1 C -0.185 -0.653 -0.280 1.00 . A A . 29 TYR CD1 1 1 15 6697 1 1 26 TYR CD2 C -2.038 -1.333 -1.618 1.00 . A A . 29 TYR CD2 1 1 15 6698 1 1 26 TYR CE1 C 0.637 -1.519 -0.973 1.00 . A A . 29 TYR CE1 1 1 15 6699 1 1 26 TYR CE2 C -1.221 -2.202 -2.315 1.00 . A A . 29 TYR CE2 1 1 15 6700 1 1 26 TYR CG C -1.536 -0.543 -0.591 1.00 . A A . 29 TYR CG 1 1 15 6701 1 1 26 TYR CZ C 0.116 -2.289 -1.989 1.00 . A A . 29 TYR CZ 1 1 15 6702 1 1 26 TYR H H -0.313 1.843 1.008 1.00 . A A . 29 TYR H 1 1 15 6703 1 1 26 TYR HA H -2.322 2.122 -1.116 1.00 . A A . 29 TYR HA 1 1 15 6704 1 1 26 TYR HB2 H -2.331 0.198 1.214 1.00 . A A . 29 TYR HB2 1 1 15 6705 1 1 26 TYR HB3 H -3.454 0.209 -0.133 1.00 . A A . 29 TYR HB3 1 1 15 6706 1 1 26 TYR HD1 H 0.220 -0.046 0.516 1.00 . A A . 29 TYR HD1 1 1 15 6707 1 1 26 TYR HD2 H -3.085 -1.261 -1.872 1.00 . A A . 29 TYR HD2 1 1 15 6708 1 1 26 TYR HE1 H 1.685 -1.591 -0.715 1.00 . A A . 29 TYR HE1 1 1 15 6709 1 1 26 TYR HE2 H -1.628 -2.806 -3.111 1.00 . A A . 29 TYR HE2 1 1 15 6710 1 1 26 TYR HH H 1.493 -3.627 -2.065 1.00 . A A . 29 TYR HH 1 1 15 6711 1 1 26 TYR N N -0.733 2.191 0.195 1.00 . A A . 29 TYR N 1 1 15 6712 1 1 26 TYR O O -2.872 2.800 2.008 1.00 . A A . 29 TYR O 1 1 15 6713 1 1 26 TYR OH O 0.932 -3.151 -2.681 1.00 . A A . 29 TYR OH 1 1 15 6714 1 1 27 TYR C C -6.253 3.681 0.960 1.00 . A A . 30 TYR C 1 1 15 6715 1 1 27 TYR CA C -4.880 4.321 0.834 1.00 . A A . 30 TYR CA 1 1 15 6716 1 1 27 TYR CB C -5.003 5.649 0.081 1.00 . A A . 30 TYR CB 1 1 15 6717 1 1 27 TYR CD1 C -5.686 7.368 1.802 1.00 . A A . 30 TYR CD1 1 1 15 6718 1 1 27 TYR CD2 C -7.295 6.706 0.175 1.00 . A A . 30 TYR CD2 1 1 15 6719 1 1 27 TYR CE1 C -6.608 8.224 2.372 1.00 . A A . 30 TYR CE1 1 1 15 6720 1 1 27 TYR CE2 C -8.222 7.561 0.738 1.00 . A A . 30 TYR CE2 1 1 15 6721 1 1 27 TYR CG C -6.011 6.596 0.695 1.00 . A A . 30 TYR CG 1 1 15 6722 1 1 27 TYR CZ C -7.875 8.316 1.837 1.00 . A A . 30 TYR CZ 1 1 15 6723 1 1 27 TYR H H -4.033 3.339 -0.828 1.00 . A A . 30 TYR H 1 1 15 6724 1 1 27 TYR HA H -4.487 4.510 1.822 1.00 . A A . 30 TYR HA 1 1 15 6725 1 1 27 TYR HB2 H -4.043 6.144 0.067 1.00 . A A . 30 TYR HB2 1 1 15 6726 1 1 27 TYR HB3 H -5.313 5.449 -0.934 1.00 . A A . 30 TYR HB3 1 1 15 6727 1 1 27 TYR HD1 H -4.692 7.296 2.218 1.00 . A A . 30 TYR HD1 1 1 15 6728 1 1 27 TYR HD2 H -7.564 6.113 -0.686 1.00 . A A . 30 TYR HD2 1 1 15 6729 1 1 27 TYR HE1 H -6.336 8.816 3.233 1.00 . A A . 30 TYR HE1 1 1 15 6730 1 1 27 TYR HE2 H -9.214 7.631 0.317 1.00 . A A . 30 TYR HE2 1 1 15 6731 1 1 27 TYR HH H -9.634 8.705 2.508 1.00 . A A . 30 TYR HH 1 1 15 6732 1 1 27 TYR N N -3.959 3.437 0.142 1.00 . A A . 30 TYR N 1 1 15 6733 1 1 27 TYR O O -7.009 3.620 -0.008 1.00 . A A . 30 TYR O 1 1 15 6734 1 1 27 TYR OH O -8.799 9.165 2.402 1.00 . A A . 30 TYR OH 1 1 15 6735 1 1 28 ASN C C -8.915 3.690 2.406 1.00 . A A . 31 ASN C 1 1 15 6736 1 1 28 ASN CA C -7.869 2.598 2.391 1.00 . A A . 31 ASN CA 1 1 15 6737 1 1 28 ASN CB C -7.882 1.839 3.722 1.00 . A A . 31 ASN CB 1 1 15 6738 1 1 28 ASN CG C -9.012 0.826 3.814 1.00 . A A . 31 ASN CG 1 1 15 6739 1 1 28 ASN H H -5.948 3.305 2.900 1.00 . A A . 31 ASN H 1 1 15 6740 1 1 28 ASN HA H -8.074 1.915 1.580 1.00 . A A . 31 ASN HA 1 1 15 6741 1 1 28 ASN HB2 H -6.945 1.315 3.839 1.00 . A A . 31 ASN HB2 1 1 15 6742 1 1 28 ASN HB3 H -7.996 2.548 4.529 1.00 . A A . 31 ASN HB3 1 1 15 6743 1 1 28 ASN HD21 H -10.074 1.823 2.461 1.00 . A A . 31 ASN HD21 1 1 15 6744 1 1 28 ASN HD22 H -10.812 0.396 3.088 1.00 . A A . 31 ASN HD22 1 1 15 6745 1 1 28 ASN N N -6.577 3.212 2.157 1.00 . A A . 31 ASN N 1 1 15 6746 1 1 28 ASN ND2 N -10.072 1.037 3.043 1.00 . A A . 31 ASN ND2 1 1 15 6747 1 1 28 ASN O O -9.039 4.406 3.392 1.00 . A A . 31 ASN O 1 1 15 6748 1 1 28 ASN OD1 O -8.930 -0.141 4.570 1.00 . A A . 31 ASN OD1 1 1 15 6749 1 1 29 THR C C -11.745 4.729 2.230 1.00 . A A . 32 THR C 1 1 15 6750 1 1 29 THR CA C -10.662 4.864 1.164 1.00 . A A . 32 THR CA 1 1 15 6751 1 1 29 THR CB C -11.328 4.811 -0.224 1.00 . A A . 32 THR CB 1 1 15 6752 1 1 29 THR CG2 C -10.339 5.183 -1.317 1.00 . A A . 32 THR CG2 1 1 15 6753 1 1 29 THR H H -9.438 3.255 0.525 1.00 . A A . 32 THR H 1 1 15 6754 1 1 29 THR HA H -10.188 5.828 1.269 1.00 . A A . 32 THR HA 1 1 15 6755 1 1 29 THR HB H -12.144 5.519 -0.240 1.00 . A A . 32 THR HB 1 1 15 6756 1 1 29 THR HG1 H -11.448 3.139 -1.265 1.00 . A A . 32 THR HG1 1 1 15 6757 1 1 29 THR HG21 H -9.516 4.484 -1.312 1.00 . A A . 32 THR HG21 1 1 15 6758 1 1 29 THR HG22 H -9.967 6.181 -1.140 1.00 . A A . 32 THR HG22 1 1 15 6759 1 1 29 THR HG23 H -10.834 5.149 -2.277 1.00 . A A . 32 THR HG23 1 1 15 6760 1 1 29 THR N N -9.626 3.840 1.291 1.00 . A A . 32 THR N 1 1 15 6761 1 1 29 THR O O -12.136 5.714 2.855 1.00 . A A . 32 THR O 1 1 15 6762 1 1 29 THR OG1 O -11.847 3.497 -0.469 1.00 . A A . 32 THR OG1 1 1 15 6763 1 1 30 GLU C C -12.791 3.462 4.831 1.00 . A A . 33 GLU C 1 1 15 6764 1 1 30 GLU CA C -13.280 3.250 3.403 1.00 . A A . 33 GLU CA 1 1 15 6765 1 1 30 GLU CB C -13.792 1.822 3.226 1.00 . A A . 33 GLU CB 1 1 15 6766 1 1 30 GLU CD C -15.957 2.162 4.483 1.00 . A A . 33 GLU CD 1 1 15 6767 1 1 30 GLU CG C -14.688 1.343 4.357 1.00 . A A . 33 GLU CG 1 1 15 6768 1 1 30 GLU H H -11.870 2.758 1.911 1.00 . A A . 33 GLU H 1 1 15 6769 1 1 30 GLU HA H -14.084 3.934 3.211 1.00 . A A . 33 GLU HA 1 1 15 6770 1 1 30 GLU HB2 H -14.353 1.767 2.304 1.00 . A A . 33 GLU HB2 1 1 15 6771 1 1 30 GLU HB3 H -12.941 1.160 3.158 1.00 . A A . 33 GLU HB3 1 1 15 6772 1 1 30 GLU HG2 H -14.960 0.313 4.173 1.00 . A A . 33 GLU HG2 1 1 15 6773 1 1 30 GLU HG3 H -14.140 1.408 5.286 1.00 . A A . 33 GLU HG3 1 1 15 6774 1 1 30 GLU N N -12.229 3.509 2.429 1.00 . A A . 33 GLU N 1 1 15 6775 1 1 30 GLU O O -13.291 4.327 5.551 1.00 . A A . 33 GLU O 1 1 15 6776 1 1 30 GLU OE1 O -15.932 3.192 5.190 1.00 . A A . 33 GLU OE1 1 1 15 6777 1 1 30 GLU OE2 O -16.977 1.776 3.872 1.00 . A A . 33 GLU OE2 1 1 15 6778 1 1 31 THR C C -10.478 4.029 6.811 1.00 . A A . 34 THR C 1 1 15 6779 1 1 31 THR CA C -11.257 2.736 6.575 1.00 . A A . 34 THR CA 1 1 15 6780 1 1 31 THR CB C -10.331 1.536 6.858 1.00 . A A . 34 THR CB 1 1 15 6781 1 1 31 THR CG2 C -9.725 1.625 8.251 1.00 . A A . 34 THR CG2 1 1 15 6782 1 1 31 THR H H -11.461 2.009 4.593 1.00 . A A . 34 THR H 1 1 15 6783 1 1 31 THR HA H -12.080 2.694 7.273 1.00 . A A . 34 THR HA 1 1 15 6784 1 1 31 THR HB H -9.528 1.543 6.133 1.00 . A A . 34 THR HB 1 1 15 6785 1 1 31 THR HG1 H -11.146 -0.103 7.591 1.00 . A A . 34 THR HG1 1 1 15 6786 1 1 31 THR HG21 H -10.516 1.665 8.987 1.00 . A A . 34 THR HG21 1 1 15 6787 1 1 31 THR HG22 H -9.121 2.518 8.325 1.00 . A A . 34 THR HG22 1 1 15 6788 1 1 31 THR HG23 H -9.108 0.757 8.432 1.00 . A A . 34 THR HG23 1 1 15 6789 1 1 31 THR N N -11.816 2.666 5.227 1.00 . A A . 34 THR N 1 1 15 6790 1 1 31 THR O O -10.495 4.572 7.916 1.00 . A A . 34 THR O 1 1 15 6791 1 1 31 THR OG1 O -11.062 0.311 6.730 1.00 . A A . 34 THR OG1 1 1 15 6792 1 1 32 LYS C C -7.640 5.353 6.413 1.00 . A A . 35 LYS C 1 1 15 6793 1 1 32 LYS CA C -8.975 5.712 5.824 1.00 . A A . 35 LYS CA 1 1 15 6794 1 1 32 LYS CB C -9.651 6.834 6.624 1.00 . A A . 35 LYS CB 1 1 15 6795 1 1 32 LYS CD C -11.636 8.339 6.923 1.00 . A A . 35 LYS CD 1 1 15 6796 1 1 32 LYS CE C -12.959 8.803 6.336 1.00 . A A . 35 LYS CE 1 1 15 6797 1 1 32 LYS CG C -11.033 7.204 6.113 1.00 . A A . 35 LYS CG 1 1 15 6798 1 1 32 LYS H H -9.787 3.980 4.939 1.00 . A A . 35 LYS H 1 1 15 6799 1 1 32 LYS HA H -8.807 6.044 4.805 1.00 . A A . 35 LYS HA 1 1 15 6800 1 1 32 LYS HB2 H -9.742 6.524 7.654 1.00 . A A . 35 LYS HB2 1 1 15 6801 1 1 32 LYS HB3 H -9.029 7.718 6.580 1.00 . A A . 35 LYS HB3 1 1 15 6802 1 1 32 LYS HD2 H -11.802 8.000 7.935 1.00 . A A . 35 LYS HD2 1 1 15 6803 1 1 32 LYS HD3 H -10.942 9.168 6.930 1.00 . A A . 35 LYS HD3 1 1 15 6804 1 1 32 LYS HE2 H -12.788 9.148 5.327 1.00 . A A . 35 LYS HE2 1 1 15 6805 1 1 32 LYS HE3 H -13.643 7.967 6.318 1.00 . A A . 35 LYS HE3 1 1 15 6806 1 1 32 LYS HG2 H -10.955 7.512 5.082 1.00 . A A . 35 LYS HG2 1 1 15 6807 1 1 32 LYS HG3 H -11.676 6.339 6.187 1.00 . A A . 35 LYS HG3 1 1 15 6808 1 1 32 LYS HZ1 H -14.448 10.227 6.680 1.00 . A A . 35 LYS HZ1 1 1 15 6809 1 1 32 LYS HZ2 H -12.908 10.713 7.181 1.00 . A A . 35 LYS HZ2 1 1 15 6810 1 1 32 LYS HZ3 H -13.776 9.583 8.093 1.00 . A A . 35 LYS HZ3 1 1 15 6811 1 1 32 LYS N N -9.788 4.497 5.767 1.00 . A A . 35 LYS N 1 1 15 6812 1 1 32 LYS NZ N -13.565 9.909 7.127 1.00 . A A . 35 LYS NZ 1 1 15 6813 1 1 32 LYS O O -7.134 6.007 7.326 1.00 . A A . 35 LYS O 1 1 15 6814 1 1 33 GLN C C -4.767 3.803 5.202 1.00 . A A . 36 GLN C 1 1 15 6815 1 1 33 GLN CA C -5.791 3.789 6.323 1.00 . A A . 36 GLN CA 1 1 15 6816 1 1 33 GLN CB C -5.939 2.373 6.877 1.00 . A A . 36 GLN CB 1 1 15 6817 1 1 33 GLN CD C -4.145 2.643 8.637 1.00 . A A . 36 GLN CD 1 1 15 6818 1 1 33 GLN CG C -4.657 1.814 7.475 1.00 . A A . 36 GLN CG 1 1 15 6819 1 1 33 GLN H H -7.540 3.844 5.112 1.00 . A A . 36 GLN H 1 1 15 6820 1 1 33 GLN HA H -5.447 4.439 7.115 1.00 . A A . 36 GLN HA 1 1 15 6821 1 1 33 GLN HB2 H -6.698 2.376 7.644 1.00 . A A . 36 GLN HB2 1 1 15 6822 1 1 33 GLN HB3 H -6.251 1.722 6.077 1.00 . A A . 36 GLN HB3 1 1 15 6823 1 1 33 GLN HE21 H -3.074 3.767 7.394 1.00 . A A . 36 GLN HE21 1 1 15 6824 1 1 33 GLN HE22 H -2.962 4.181 9.068 1.00 . A A . 36 GLN HE22 1 1 15 6825 1 1 33 GLN HG2 H -4.847 0.811 7.826 1.00 . A A . 36 GLN HG2 1 1 15 6826 1 1 33 GLN HG3 H -3.899 1.787 6.707 1.00 . A A . 36 GLN HG3 1 1 15 6827 1 1 33 GLN N N -7.077 4.291 5.864 1.00 . A A . 36 GLN N 1 1 15 6828 1 1 33 GLN NE2 N -3.309 3.630 8.336 1.00 . A A . 36 GLN NE2 1 1 15 6829 1 1 33 GLN O O -4.770 2.944 4.321 1.00 . A A . 36 GLN O 1 1 15 6830 1 1 33 GLN OE1 O -4.494 2.398 9.792 1.00 . A A . 36 GLN OE1 1 1 15 6831 1 1 34 SER C C -1.483 4.469 4.826 1.00 . A A . 37 SER C 1 1 15 6832 1 1 34 SER CA C -2.830 4.932 4.263 1.00 . A A . 37 SER CA 1 1 15 6833 1 1 34 SER CB C -2.729 6.391 3.820 1.00 . A A . 37 SER CB 1 1 15 6834 1 1 34 SER H H -3.955 5.434 5.984 1.00 . A A . 37 SER H 1 1 15 6835 1 1 34 SER HA H -3.096 4.321 3.414 1.00 . A A . 37 SER HA 1 1 15 6836 1 1 34 SER HB2 H -3.693 6.727 3.471 1.00 . A A . 37 SER HB2 1 1 15 6837 1 1 34 SER HB3 H -2.420 6.999 4.659 1.00 . A A . 37 SER HB3 1 1 15 6838 1 1 34 SER HG H -1.212 7.290 2.969 1.00 . A A . 37 SER HG 1 1 15 6839 1 1 34 SER N N -3.882 4.783 5.260 1.00 . A A . 37 SER N 1 1 15 6840 1 1 34 SER O O -0.903 5.133 5.685 1.00 . A A . 37 SER O 1 1 15 6841 1 1 34 SER OG O -1.785 6.546 2.775 1.00 . A A . 37 SER OG 1 1 15 6842 1 1 35 THR C C 0.788 1.686 3.877 1.00 . A A . 38 THR C 1 1 15 6843 1 1 35 THR CA C 0.276 2.778 4.813 1.00 . A A . 38 THR CA 1 1 15 6844 1 1 35 THR CB C 0.136 2.200 6.235 1.00 . A A . 38 THR CB 1 1 15 6845 1 1 35 THR CG2 C -0.985 1.174 6.294 1.00 . A A . 38 THR CG2 1 1 15 6846 1 1 35 THR H H -1.496 2.843 3.652 1.00 . A A . 38 THR H 1 1 15 6847 1 1 35 THR HA H 0.999 3.580 4.843 1.00 . A A . 38 THR HA 1 1 15 6848 1 1 35 THR HB H -0.102 3.007 6.912 1.00 . A A . 38 THR HB 1 1 15 6849 1 1 35 THR HG1 H 1.980 2.276 6.929 1.00 . A A . 38 THR HG1 1 1 15 6850 1 1 35 THR HG21 H -1.054 0.775 7.295 1.00 . A A . 38 THR HG21 1 1 15 6851 1 1 35 THR HG22 H -0.777 0.372 5.600 1.00 . A A . 38 THR HG22 1 1 15 6852 1 1 35 THR HG23 H -1.920 1.645 6.028 1.00 . A A . 38 THR HG23 1 1 15 6853 1 1 35 THR N N -0.992 3.330 4.340 1.00 . A A . 38 THR N 1 1 15 6854 1 1 35 THR O O 0.066 1.240 2.984 1.00 . A A . 38 THR O 1 1 15 6855 1 1 35 THR OG1 O 1.366 1.594 6.647 1.00 . A A . 38 THR OG1 1 1 15 6856 1 1 36 TRP C C 2.517 -1.127 3.981 1.00 . A A . 39 TRP C 1 1 15 6857 1 1 36 TRP CA C 2.608 0.202 3.242 1.00 . A A . 39 TRP CA 1 1 15 6858 1 1 36 TRP CB C 4.089 0.460 2.917 1.00 . A A . 39 TRP CB 1 1 15 6859 1 1 36 TRP CD1 C 4.974 2.371 4.323 1.00 . A A . 39 TRP CD1 1 1 15 6860 1 1 36 TRP CD2 C 4.785 2.858 2.156 1.00 . A A . 39 TRP CD2 1 1 15 6861 1 1 36 TRP CE2 C 5.293 3.986 2.821 1.00 . A A . 39 TRP CE2 1 1 15 6862 1 1 36 TRP CE3 C 4.583 2.921 0.780 1.00 . A A . 39 TRP CE3 1 1 15 6863 1 1 36 TRP CG C 4.578 1.847 3.140 1.00 . A A . 39 TRP CG 1 1 15 6864 1 1 36 TRP CH2 C 5.401 5.197 0.804 1.00 . A A . 39 TRP CH2 1 1 15 6865 1 1 36 TRP CZ2 C 5.606 5.163 2.152 1.00 . A A . 39 TRP CZ2 1 1 15 6866 1 1 36 TRP CZ3 C 4.892 4.091 0.116 1.00 . A A . 39 TRP CZ3 1 1 15 6867 1 1 36 TRP H H 2.573 1.647 4.795 1.00 . A A . 39 TRP H 1 1 15 6868 1 1 36 TRP HA H 2.040 0.144 2.325 1.00 . A A . 39 TRP HA 1 1 15 6869 1 1 36 TRP HB2 H 4.691 -0.175 3.546 1.00 . A A . 39 TRP HB2 1 1 15 6870 1 1 36 TRP HB3 H 4.273 0.211 1.882 1.00 . A A . 39 TRP HB3 1 1 15 6871 1 1 36 TRP HD1 H 4.943 1.830 5.252 1.00 . A A . 39 TRP HD1 1 1 15 6872 1 1 36 TRP HE1 H 5.725 4.262 4.856 1.00 . A A . 39 TRP HE1 1 1 15 6873 1 1 36 TRP HE3 H 4.191 2.076 0.234 1.00 . A A . 39 TRP HE3 1 1 15 6874 1 1 36 TRP HH2 H 5.631 6.092 0.245 1.00 . A A . 39 TRP HH2 1 1 15 6875 1 1 36 TRP HZ2 H 6.004 6.020 2.664 1.00 . A A . 39 TRP HZ2 1 1 15 6876 1 1 36 TRP HZ3 H 4.743 4.159 -0.950 1.00 . A A . 39 TRP HZ3 1 1 15 6877 1 1 36 TRP N N 2.035 1.254 4.077 1.00 . A A . 39 TRP N 1 1 15 6878 1 1 36 TRP NE1 N 5.400 3.667 4.149 1.00 . A A . 39 TRP NE1 1 1 15 6879 1 1 36 TRP O O 3.297 -1.392 4.897 1.00 . A A . 39 TRP O 1 1 15 6880 1 1 37 GLU C C 0.443 -4.114 3.361 1.00 . A A . 40 GLU C 1 1 15 6881 1 1 37 GLU CA C 1.364 -3.251 4.212 1.00 . A A . 40 GLU CA 1 1 15 6882 1 1 37 GLU CB C 0.774 -3.060 5.615 1.00 . A A . 40 GLU CB 1 1 15 6883 1 1 37 GLU CD C -1.290 -2.841 7.053 1.00 . A A . 40 GLU CD 1 1 15 6884 1 1 37 GLU CG C -0.746 -3.069 5.656 1.00 . A A . 40 GLU CG 1 1 15 6885 1 1 37 GLU H H 0.978 -1.709 2.833 1.00 . A A . 40 GLU H 1 1 15 6886 1 1 37 GLU HA H 2.325 -3.734 4.292 1.00 . A A . 40 GLU HA 1 1 15 6887 1 1 37 GLU HB2 H 1.135 -3.851 6.256 1.00 . A A . 40 GLU HB2 1 1 15 6888 1 1 37 GLU HB3 H 1.114 -2.109 6.004 1.00 . A A . 40 GLU HB3 1 1 15 6889 1 1 37 GLU HG2 H -1.116 -2.288 5.009 1.00 . A A . 40 GLU HG2 1 1 15 6890 1 1 37 GLU HG3 H -1.097 -4.026 5.301 1.00 . A A . 40 GLU HG3 1 1 15 6891 1 1 37 GLU N N 1.561 -1.961 3.579 1.00 . A A . 40 GLU N 1 1 15 6892 1 1 37 GLU O O -0.225 -3.615 2.457 1.00 . A A . 40 GLU O 1 1 15 6893 1 1 37 GLU OE1 O -1.338 -1.671 7.488 1.00 . A A . 40 GLU OE1 1 1 15 6894 1 1 37 GLU OE2 O -1.665 -3.833 7.712 1.00 . A A . 40 GLU OE2 1 1 15 6895 1 1 38 LYS C C -1.897 -6.080 3.283 1.00 . A A . 41 LYS C 1 1 15 6896 1 1 38 LYS CA C -0.428 -6.335 2.942 1.00 . A A . 41 LYS CA 1 1 15 6897 1 1 38 LYS CB C -0.043 -7.757 3.334 1.00 . A A . 41 LYS CB 1 1 15 6898 1 1 38 LYS CD C 0.508 -9.260 5.279 1.00 . A A . 41 LYS CD 1 1 15 6899 1 1 38 LYS CE C 1.311 -10.269 4.474 1.00 . A A . 41 LYS CE 1 1 15 6900 1 1 38 LYS CG C 0.619 -7.858 4.697 1.00 . A A . 41 LYS CG 1 1 15 6901 1 1 38 LYS H H 0.974 -5.746 4.376 1.00 . A A . 41 LYS H 1 1 15 6902 1 1 38 LYS HA H -0.270 -6.198 1.884 1.00 . A A . 41 LYS HA 1 1 15 6903 1 1 38 LYS HB2 H -0.930 -8.349 3.362 1.00 . A A . 41 LYS HB2 1 1 15 6904 1 1 38 LYS HB3 H 0.633 -8.157 2.595 1.00 . A A . 41 LYS HB3 1 1 15 6905 1 1 38 LYS HD2 H 0.879 -9.248 6.292 1.00 . A A . 41 LYS HD2 1 1 15 6906 1 1 38 LYS HD3 H -0.530 -9.557 5.278 1.00 . A A . 41 LYS HD3 1 1 15 6907 1 1 38 LYS HE2 H 1.136 -11.255 4.878 1.00 . A A . 41 LYS HE2 1 1 15 6908 1 1 38 LYS HE3 H 0.979 -10.237 3.448 1.00 . A A . 41 LYS HE3 1 1 15 6909 1 1 38 LYS HG2 H 1.664 -7.602 4.599 1.00 . A A . 41 LYS HG2 1 1 15 6910 1 1 38 LYS HG3 H 0.138 -7.159 5.364 1.00 . A A . 41 LYS HG3 1 1 15 6911 1 1 38 LYS HZ1 H 2.961 -9.037 4.122 1.00 . A A . 41 LYS HZ1 1 1 15 6912 1 1 38 LYS HZ2 H 3.293 -10.688 3.967 1.00 . A A . 41 LYS HZ2 1 1 15 6913 1 1 38 LYS HZ3 H 3.109 -10.004 5.503 1.00 . A A . 41 LYS HZ3 1 1 15 6914 1 1 38 LYS N N 0.415 -5.405 3.656 1.00 . A A . 41 LYS N 1 1 15 6915 1 1 38 LYS NZ N 2.771 -9.979 4.520 1.00 . A A . 41 LYS NZ 1 1 15 6916 1 1 38 LYS O O -2.334 -6.387 4.393 1.00 . A A . 41 LYS O 1 1 15 6917 1 1 39 PRO C C -4.971 -6.462 2.432 1.00 . A A . 42 PRO C 1 1 15 6918 1 1 39 PRO CA C -4.091 -5.221 2.582 1.00 . A A . 42 PRO CA 1 1 15 6919 1 1 39 PRO CB C -4.437 -4.172 1.510 1.00 . A A . 42 PRO CB 1 1 15 6920 1 1 39 PRO CD C -2.286 -5.128 0.991 1.00 . A A . 42 PRO CD 1 1 15 6921 1 1 39 PRO CG C -3.194 -3.967 0.700 1.00 . A A . 42 PRO CG 1 1 15 6922 1 1 39 PRO HA H -4.235 -4.794 3.563 1.00 . A A . 42 PRO HA 1 1 15 6923 1 1 39 PRO HB2 H -5.249 -4.534 0.896 1.00 . A A . 42 PRO HB2 1 1 15 6924 1 1 39 PRO HB3 H -4.738 -3.257 1.995 1.00 . A A . 42 PRO HB3 1 1 15 6925 1 1 39 PRO HD2 H -2.461 -5.931 0.291 1.00 . A A . 42 PRO HD2 1 1 15 6926 1 1 39 PRO HD3 H -1.253 -4.817 0.964 1.00 . A A . 42 PRO HD3 1 1 15 6927 1 1 39 PRO HG2 H -3.445 -3.944 -0.350 1.00 . A A . 42 PRO HG2 1 1 15 6928 1 1 39 PRO HG3 H -2.719 -3.040 0.989 1.00 . A A . 42 PRO HG3 1 1 15 6929 1 1 39 PRO N N -2.684 -5.516 2.345 1.00 . A A . 42 PRO N 1 1 15 6930 1 1 39 PRO O O -5.811 -6.536 1.534 1.00 . A A . 42 PRO O 1 1 stop_ save_
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