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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
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373521 |
1dum ![]() ![]() |
cing | 4-filtered-FRED | STAR | entry | full | 848 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1dum # This FRED archive file contains, for PDB entry <1dum>: # # - 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_1dum _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1dum _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 5049.91 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 $MAGAININ_2 A . 1 1 2 . 1 $MAGAININ_2 B . 1 1 stop_ save_ save_MAGAININ_2 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "MAGAININ 2" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GIGKYLHSAKKFGKAWVGEIMNS _Entity.Number_of_monomers 23 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 ILE . 1 1 3 GLY . 1 1 4 LYS . 1 1 5 TYR . 1 1 6 LEU . 1 1 7 HIS . 1 1 8 SER . 1 1 9 ALA . 1 1 10 LYS . 1 1 11 LYS . 1 1 12 PHE . 1 1 13 GLY . 1 1 14 LYS . 1 1 15 ALA . 1 1 16 TRP . 1 1 17 VAL . 1 1 18 GLY . 1 1 19 GLU . 1 1 20 ILE . 1 1 21 MET . 1 1 22 ASN . 1 1 23 SER . 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 ILE 2 2 1 1 GLY 3 3 1 1 LYS 4 4 1 1 TYR 5 5 1 1 LEU 6 6 1 1 HIS 7 7 1 1 SER 8 8 1 1 ALA 9 9 1 1 LYS 10 10 1 1 LYS 11 11 1 1 PHE 12 12 1 1 GLY 13 13 1 1 LYS 14 14 1 1 ALA 15 15 1 1 TRP 16 16 1 1 VAL 17 17 1 1 GLY 18 18 1 1 GLU 19 19 1 1 ILE 20 20 1 1 MET 21 21 1 1 ASN 22 22 1 1 SER 23 23 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 . . . 1 1 557 1 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 565 1 . . . 1 1 566 1 . . . 1 1 567 1 . . . 1 1 568 1 . . . 1 1 569 1 . . . 1 1 570 1 . . . 1 1 571 1 . . . 1 1 572 1 . . . 1 1 573 1 . . . 1 1 574 1 . . . 1 1 575 1 . . . 1 1 576 1 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 . . . 1 1 581 1 . . . 1 1 582 1 . . . 1 1 583 1 . . . 1 1 584 1 . . . 1 1 585 1 . . . 1 1 586 1 . . . 1 1 587 1 . . . 1 1 588 1 . . . 1 1 589 1 . . . 1 1 590 1 . . . 1 1 591 1 . . . 1 1 592 1 . . . 1 1 593 1 . . . 1 1 594 1 . . . 1 1 595 1 . . . 1 1 596 1 . . . 1 1 597 1 . . . 1 1 598 1 . . . 1 1 599 1 . . . 1 1 600 1 . . . 1 1 601 1 . . . 1 1 602 1 . . . 1 1 603 1 . . . 1 1 604 1 . . . 1 1 605 1 . . . 1 1 606 1 . . . 1 1 607 1 . . . 1 1 608 1 . . . 1 1 609 1 . . . 1 1 610 1 . . . 1 1 611 1 . . . 1 1 612 1 . . . 1 1 613 1 . . . 1 1 614 1 . . . 1 1 615 1 . . . 1 1 616 1 . . . 1 1 617 1 . . . 1 1 618 1 . . . 1 1 619 1 . . . 1 1 620 1 . . . 1 1 621 1 . . . 1 1 622 1 . . . 1 1 623 1 . . . 1 1 624 1 . . . 1 1 625 1 . . . 1 1 626 1 . . . 1 1 627 1 . . . 1 1 628 1 . . . 1 1 629 1 . . . 1 1 630 1 . . . 1 1 631 1 . . . 1 1 632 1 . . . 1 1 633 1 . . . 1 1 634 1 . . . 1 1 635 1 . . . 1 1 636 1 . . . 1 1 637 1 . . . 1 1 638 1 . . . 1 1 639 1 . . . 1 1 640 1 . . . 1 1 641 1 . . . 1 1 642 1 . . . 1 1 643 1 . . . 1 1 644 1 . . . 1 1 645 1 . . . 1 1 646 1 . . . 1 1 647 1 . . . 1 1 648 1 . . . 1 1 649 1 . . . 1 1 650 1 . . . 1 1 651 1 . . . 1 1 652 1 . . . 1 1 653 1 . . . 1 1 654 1 . . . 1 1 655 1 . . . 1 1 656 1 . . . 1 1 657 1 . . . 1 1 658 1 . . . 1 1 659 1 . . . 1 1 660 1 . . . 1 1 661 1 . . . 1 1 662 1 . . . 1 1 663 1 . . . 1 1 664 1 . . . 1 1 665 1 . . . 1 1 666 1 . . . 1 1 667 1 . . . 1 1 668 1 . . . 1 1 669 1 . . . 1 1 670 1 . . . 1 1 671 1 . . . 1 1 672 1 . . . 1 1 673 1 . . . 1 1 674 1 . . . 1 1 675 1 . . . 1 1 676 1 . . . 1 1 677 1 . . . 1 1 678 1 . . . 1 1 679 1 . . . 1 1 680 1 . . . 1 1 681 1 . . . 1 1 682 1 . . . 1 1 683 1 . . . 1 1 684 1 . . . 1 1 685 1 . . . 1 1 686 1 . . . 1 1 687 1 . . . 1 1 688 1 . . . 1 1 689 1 . . . 1 1 690 1 . . . 1 1 691 1 . . . 1 1 692 1 . . . 1 1 693 1 . . . 1 1 694 1 . . . 1 1 695 1 . . . 1 1 696 1 . . . 1 1 697 1 . . . 1 1 698 1 . . . 1 1 699 1 . . . 1 1 700 1 . . . 1 1 701 1 . . . 1 1 702 1 . . . 1 1 703 1 . . . 1 1 704 1 . . . 1 1 705 1 . . . 1 1 706 1 . . . 1 1 707 1 . . . 1 1 708 1 . . . 1 1 709 1 . . . 1 1 710 1 . . . 1 1 711 1 . . . 1 1 712 1 . . . 1 1 713 1 . . . 1 1 714 1 . . . 1 1 715 1 . . . 1 1 716 1 . . . 1 1 717 1 . . . 1 1 718 1 . . . 1 1 719 1 . . . 1 1 720 1 . . . 1 1 721 1 . . . 1 1 722 1 . . . 1 1 723 1 . . . 1 1 724 1 . . . 1 1 725 1 . . . 1 1 726 1 . . . 1 1 727 1 . . . 1 1 728 1 . . . 1 1 729 1 . . . 1 1 730 1 . . . 1 1 731 1 . . . 1 1 732 1 . . . 1 1 733 1 . . . 1 1 734 1 . . . 1 1 735 1 . . . 1 1 736 1 . . . 1 1 737 1 . . . 1 1 738 1 . . . 1 1 739 1 . . . 1 1 740 1 . . . 1 1 741 1 . . . 1 1 742 1 . . . 1 1 743 1 . . . 1 1 744 1 . . . 1 1 745 1 . . . 1 1 746 1 . . . 1 1 747 1 . . . 1 1 748 1 . . . 1 1 749 1 . . . 1 1 750 1 . . . 1 1 751 1 . . . 1 1 752 1 . . . 1 1 753 1 . . . 1 1 754 1 . . . 1 1 755 1 . . . 1 1 756 1 . . . 1 1 757 1 . . . 1 1 758 1 . . . 1 1 759 1 . . . 1 1 760 1 . . . 1 1 761 1 . . . 1 1 762 1 . . . 1 1 763 1 . . . 1 1 764 1 . . . 1 1 765 1 . . . 1 1 766 1 . . . 1 1 767 1 . . . 1 1 768 1 . . . 1 1 769 1 . . . 1 1 770 1 . . . 1 1 771 1 . . . 1 1 772 1 . . . 1 1 773 1 . . . 1 1 774 1 . . . 1 1 775 1 . . . 1 1 776 1 . . . 1 1 777 1 . . . 1 1 778 1 . . . 1 1 779 1 . . . 1 1 780 1 . . . 1 1 781 1 . . . 1 1 782 1 . . . 1 1 783 1 . . . 1 1 784 1 . . . 1 1 785 1 . . . 1 1 786 1 . . . 1 1 787 1 . . . 1 1 788 1 . . . 1 1 789 1 . . . 1 1 790 1 . . . 1 1 791 1 . . . 1 1 792 1 . . . 1 1 793 1 . . . 1 1 794 1 . . . 1 1 795 1 . . . 1 1 796 1 . . . 1 1 797 1 . . . 1 1 798 1 . . . 1 1 799 1 . . . 1 1 800 1 . . . 1 1 801 1 . . . 1 1 802 1 . . . 1 1 803 1 . . . 1 1 804 1 . . . 1 1 805 1 . . . 1 1 806 1 . . . 1 1 807 1 . . . 1 1 808 1 . . . 1 1 809 1 . . . 1 1 810 1 . . . 1 1 811 1 . . . 1 1 812 1 . . . 1 1 813 1 . . . 1 1 814 1 . . . 1 1 815 1 . . . 1 1 816 1 . . . 1 1 817 1 . . . 1 1 818 1 . . . 1 1 819 1 . . . 1 1 820 1 . . . 1 1 821 1 . . . 1 1 822 1 . . . 1 1 823 1 . . . 1 1 824 1 . . . 1 1 825 1 . . . 1 1 826 1 . . . 1 1 827 1 . . . 1 1 828 1 . . . 1 1 829 1 . . . 1 1 830 1 . . . 1 1 831 1 . . . 1 1 832 1 . . . 1 1 833 1 . . . 1 1 834 1 . . . 1 1 835 1 . . . 1 1 836 1 . . . 1 1 837 1 . . . 1 1 838 1 . . . 1 1 839 1 . . . 1 1 840 1 . . . 1 1 841 1 . . . 1 1 842 1 . . . 1 1 843 1 . . . 1 1 844 1 . . . 1 1 845 1 . . . 1 1 846 1 . . . 1 1 847 1 . . . 1 1 848 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 2 ILE H A 2 . HN 1 1 1 1 2 1 1 3 GLY QA A 3 . HA# 1 1 2 1 1 1 1 2 ILE HA A 2 . HA 1 1 2 1 2 1 1 2 ILE MD A 2 . HD# 1 1 3 1 1 1 1 2 ILE HA A 2 . HA 1 1 3 1 2 1 1 2 ILE QG A 2 . HG1# 1 1 4 1 1 1 1 2 ILE HA A 2 . HA 1 1 4 1 2 1 1 2 ILE MG A 2 . HG2# 1 1 5 1 1 1 1 2 ILE HA A 2 . HA 1 1 5 1 2 1 1 3 GLY H A 3 . HN 1 1 6 1 1 1 1 2 ILE HA A 2 . HA 1 1 6 1 2 1 1 4 LYS H A 4 . HN 1 1 7 1 1 1 1 2 ILE HA A 2 . HA 1 1 7 1 2 1 1 5 TYR H A 5 . HN 1 1 8 1 1 1 1 2 ILE HA A 2 . HA 1 1 8 1 2 1 1 5 TYR QB A 5 . HB# 1 1 9 1 1 1 1 2 ILE HA A 2 . HA 1 1 9 1 2 1 1 6 LEU H A 6 . HN 1 1 10 1 1 1 1 2 ILE HA A 2 . HA 1 1 10 1 2 1 1 6 LEU QD A 6 . HD## 1 1 11 1 1 1 1 2 ILE HB A 2 . HB 1 1 11 1 2 1 1 2 ILE MD A 2 . HD# 1 1 12 1 1 1 1 2 ILE HB A 2 . HB 1 1 12 1 2 1 1 2 ILE QG A 2 . HG1# 1 1 13 1 1 1 1 2 ILE HB A 2 . HB 1 1 13 1 2 1 1 2 ILE MG A 2 . HG2# 1 1 14 1 1 1 1 2 ILE HB A 2 . HB 1 1 14 1 2 1 1 3 GLY H A 3 . HN 1 1 15 1 1 1 1 2 ILE HB A 2 . HB 1 1 15 1 2 1 1 5 TYR QD A 5 . HD# 1 1 16 1 1 1 1 2 ILE HB A 2 . HB 1 1 16 1 2 1 1 6 LEU QD A 6 . HD## 1 1 17 1 1 1 1 2 ILE MD A 2 . HD# 1 1 17 1 2 1 1 5 TYR QD A 5 . HD# 1 1 18 1 1 1 1 2 ILE QG A 2 . HG1# 1 1 18 1 2 1 1 2 ILE MG A 2 . HG2# 1 1 19 1 1 1 1 2 ILE QG A 2 . HG## 1 1 19 1 1 1 1 2 ILE MG A 2 . HG## 1 1 19 1 2 1 1 5 TYR QD A 5 . HD# 1 1 20 1 1 1 1 2 ILE QG A 2 . HG## 1 1 20 1 1 1 1 2 ILE MG A 2 . HG## 1 1 20 1 2 1 1 5 TYR QE A 5 . HE# 1 1 21 1 1 1 1 2 ILE QG A 2 . HG1# 1 1 21 1 2 1 1 3 GLY QA A 3 . HA# 1 1 22 1 1 1 1 2 ILE QG A 2 . HG1# 1 1 22 1 2 1 1 6 LEU QD A 6 . HD## 1 1 23 1 1 1 1 2 ILE MG A 2 . HG2# 1 1 23 1 2 1 1 3 GLY H A 3 . HN 1 1 24 1 1 1 1 2 ILE MG A 2 . HG2# 1 1 24 1 2 1 1 3 GLY QA A 3 . HA# 1 1 25 1 1 1 1 2 ILE MG A 2 . HG2# 1 1 25 1 2 1 1 4 LYS H A 4 . HN 1 1 26 1 1 1 1 2 ILE MG A 2 . HG2# 1 1 26 1 2 1 1 5 TYR QB A 5 . HB# 1 1 27 1 1 1 1 2 ILE MG A 2 . HG2# 1 1 27 1 2 1 1 5 TYR QD A 5 . HD# 1 1 28 1 1 1 1 2 ILE MG A 2 . HG2# 1 1 28 1 2 1 1 5 TYR QE A 5 . HE# 1 1 29 1 1 1 1 2 ILE MG A 2 . HG2# 1 1 29 1 2 1 1 6 LEU H A 6 . HN 1 1 30 1 1 1 1 3 GLY H A 3 . HN 1 1 30 1 2 1 1 4 LYS H A 4 . HN 1 1 31 1 1 1 1 3 GLY H A 3 . HN 1 1 31 1 2 1 1 4 LYS HA A 4 . HA 1 1 32 1 1 1 1 3 GLY H A 3 . HN 1 1 32 1 2 1 1 4 LYS QB A 4 . HB# 1 1 33 1 1 1 1 3 GLY H A 3 . HN 1 1 33 1 2 1 1 5 TYR H A 5 . HN 1 1 34 1 1 1 1 3 GLY H A 3 . HN 1 1 34 1 2 1 1 6 LEU QB A 6 . HB# 1 1 35 1 1 1 1 3 GLY H A 3 . HN 1 1 35 1 2 1 1 6 LEU QD A 6 . HD## 1 1 36 1 1 1 1 3 GLY H A 3 . HN 1 1 36 1 2 1 1 6 LEU MD2 A 6 . HD2# 1 1 37 1 1 1 1 3 GLY QA A 3 . HA# 1 1 37 1 2 1 1 4 LYS H A 4 . HN 1 1 38 1 1 1 1 3 GLY QA A 3 . HA# 1 1 38 1 2 1 1 4 LYS QB A 4 . HB# 1 1 39 1 1 1 1 3 GLY QA A 3 . HA# 1 1 39 1 2 1 1 5 TYR H A 5 . HN 1 1 40 1 1 1 1 3 GLY QA A 3 . HA# 1 1 40 1 2 1 1 6 LEU H A 6 . HN 1 1 41 1 1 1 1 3 GLY QA A 3 . HA# 1 1 41 1 2 1 1 6 LEU QB A 6 . HB# 1 1 42 1 1 1 1 3 GLY QA A 3 . HA# 1 1 42 1 2 1 1 6 LEU QD A 6 . HD## 1 1 43 1 1 1 1 3 GLY QA A 3 . HA# 1 1 43 1 2 1 1 6 LEU HG A 6 . HG 1 1 44 1 1 1 1 3 GLY QA A 3 . HA# 1 1 44 1 2 1 1 7 HIS H A 7 . HN 1 1 45 1 1 1 1 4 LYS H A 4 . HN 1 1 45 1 2 1 1 4 LYS QB A 4 . HB# 1 1 46 1 1 1 1 4 LYS H A 4 . HN 1 1 46 1 2 1 1 4 LYS QG A 4 . HG# 1 1 47 1 1 1 1 4 LYS H A 4 . HN 1 1 47 1 2 1 1 5 TYR H A 5 . HN 1 1 48 1 1 1 1 4 LYS H A 4 . HN 1 1 48 1 2 1 1 5 TYR HA A 5 . HA 1 1 49 1 1 1 1 4 LYS H A 4 . HN 1 1 49 1 2 1 1 5 TYR QD A 5 . HD# 1 1 50 1 1 1 1 4 LYS H A 4 . HN 1 1 50 1 2 1 1 5 TYR QE A 5 . HE# 1 1 51 1 1 1 1 4 LYS H A 4 . HN 1 1 51 1 2 1 1 6 LEU H A 6 . HN 1 1 52 1 1 1 1 4 LYS HA A 4 . HA 1 1 52 1 2 1 1 4 LYS QB A 4 . HB# 1 1 53 1 1 1 1 4 LYS HA A 4 . HA 1 1 53 1 2 1 1 4 LYS QE A 4 . HE# 1 1 54 1 1 1 1 4 LYS HA A 4 . HA 1 1 54 1 2 1 1 4 LYS QG A 4 . HG# 1 1 55 1 1 1 1 4 LYS HA A 4 . HA 1 1 55 1 2 1 1 5 TYR H A 5 . HN 1 1 56 1 1 1 1 4 LYS HA A 4 . HA 1 1 56 1 2 1 1 6 LEU H A 6 . HN 1 1 57 1 1 1 1 4 LYS HA A 4 . HA 1 1 57 1 2 1 1 7 HIS H A 7 . HN 1 1 58 1 1 1 1 4 LYS HA A 4 . HA 1 1 58 1 2 1 1 7 HIS QB A 7 . HB# 1 1 59 1 1 1 1 4 LYS HA A 4 . HA 1 1 59 1 2 1 1 7 HIS HD2 A 7 . HD2 1 1 60 1 1 1 1 4 LYS QB A 4 . HB# 1 1 60 1 2 1 1 4 LYS QE A 4 . HE# 1 1 61 1 1 1 1 4 LYS QB A 4 . HB# 1 1 61 1 2 1 1 4 LYS QG A 4 . HG# 1 1 62 1 1 1 1 4 LYS QB A 4 . HB# 1 1 62 1 2 1 1 5 TYR H A 5 . HN 1 1 63 1 1 1 1 4 LYS QB A 4 . HB# 1 1 63 1 2 1 1 5 TYR HA A 5 . HA 1 1 64 1 1 1 1 4 LYS QB A 4 . HB# 1 1 64 1 2 1 1 5 TYR QB A 5 . HB# 1 1 65 1 1 1 1 4 LYS QB A 4 . HB# 1 1 65 1 2 1 1 5 TYR QD A 5 . HD# 1 1 66 1 1 1 1 4 LYS QB A 4 . HB# 1 1 66 1 2 1 1 5 TYR QE A 5 . HE# 1 1 67 1 1 1 1 4 LYS QB A 4 . HB# 1 1 67 1 2 1 1 7 HIS H A 7 . HN 1 1 68 1 1 1 1 4 LYS QB A 4 . HB# 1 1 68 1 2 1 1 7 HIS QB A 7 . HB# 1 1 69 1 1 1 1 4 LYS QB A 4 . HB# 1 1 69 1 2 1 1 7 HIS HD2 A 7 . HD2 1 1 70 1 1 1 1 4 LYS QB A 4 . HB# 1 1 70 1 2 2 1 12 PHE QB B 12 . HB# 1 1 71 1 1 1 1 4 LYS QE A 4 . HE# 1 1 71 1 2 1 1 4 LYS QG A 4 . HG# 1 1 72 1 1 1 1 4 LYS QG A 4 . HG# 1 1 72 1 2 1 1 5 TYR H A 5 . HN 1 1 73 1 1 1 1 4 LYS QG A 4 . HG# 1 1 73 1 2 1 1 5 TYR HA A 5 . HA 1 1 74 1 1 1 1 4 LYS QG A 4 . HG# 1 1 74 1 2 1 1 5 TYR QB A 5 . HB# 1 1 75 1 1 1 1 4 LYS QG A 4 . HG# 1 1 75 1 2 1 1 5 TYR QD A 5 . HD# 1 1 76 1 1 1 1 4 LYS QG A 4 . HG# 1 1 76 1 2 1 1 5 TYR QE A 5 . HE# 1 1 77 1 1 1 1 4 LYS QG A 4 . HG# 1 1 77 1 2 1 1 6 LEU H A 6 . HN 1 1 78 1 1 1 1 4 LYS QG A 4 . HG# 1 1 78 1 2 1 1 7 HIS HD2 A 7 . HD2 1 1 79 1 1 1 1 5 TYR H A 5 . HN 1 1 79 1 2 1 1 5 TYR QB A 5 . HB# 1 1 80 1 1 1 1 5 TYR H A 5 . HN 1 1 80 1 2 1 1 6 LEU H A 6 . HN 1 1 81 1 1 1 1 5 TYR H A 5 . HN 1 1 81 1 2 1 1 7 HIS H A 7 . HN 1 1 82 1 1 1 1 5 TYR H A 5 . HN 1 1 82 1 2 2 1 12 PHE QB B 12 . HB# 1 1 83 1 1 1 1 5 TYR H A 5 . HN 1 1 83 1 2 2 1 16 TRP HA B 16 . HA 1 1 84 1 1 1 1 5 TYR H A 5 . HN 1 1 84 1 2 2 1 16 TRP QB B 16 . HB# 1 1 85 1 1 1 1 5 TYR HA A 5 . HA 1 1 85 1 2 1 1 5 TYR QB A 5 . HB# 1 1 86 1 1 1 1 5 TYR HA A 5 . HA 1 1 86 1 2 1 1 5 TYR QD A 5 . HD# 1 1 87 1 1 1 1 5 TYR HA A 5 . HA 1 1 87 1 2 1 1 6 LEU H A 6 . HN 1 1 88 1 1 1 1 5 TYR HA A 5 . HA 1 1 88 1 2 1 1 6 LEU QD A 6 . HD## 1 1 89 1 1 1 1 5 TYR HA A 5 . HA 1 1 89 1 2 1 1 7 HIS H A 7 . HN 1 1 90 1 1 1 1 5 TYR HA A 5 . HA 1 1 90 1 2 1 1 8 SER H A 8 . HN 1 1 91 1 1 1 1 5 TYR HA A 5 . HA 1 1 91 1 2 1 1 8 SER QB A 8 . HB# 1 1 92 1 1 1 1 5 TYR HA A 5 . HA 1 1 92 1 2 1 1 9 ALA H A 9 . HN 1 1 93 1 1 1 1 5 TYR HA A 5 . HA 1 1 93 1 2 2 1 12 PHE QB B 12 . HB# 1 1 94 1 1 1 1 5 TYR HA A 5 . HA 1 1 94 1 2 2 1 16 TRP H B 16 . HN 1 1 95 1 1 1 1 5 TYR HA A 5 . HA 1 1 95 1 2 2 1 16 TRP QB B 16 . HB# 1 1 96 1 1 1 1 5 TYR HA A 5 . HA 1 1 96 1 2 2 1 16 TRP HE3 B 16 . HE3 1 1 97 1 1 1 1 5 TYR HA A 5 . HA 1 1 97 1 2 2 1 20 ILE MD B 20 . HD# 1 1 98 1 1 1 1 5 TYR QB A 5 . HB# 1 1 98 1 2 1 1 5 TYR QD A 5 . HD# 1 1 99 1 1 1 1 5 TYR QB A 5 . HB# 1 1 99 1 2 1 1 6 LEU H A 6 . HN 1 1 100 1 1 1 1 5 TYR QB A 5 . HB# 1 1 100 1 2 1 1 6 LEU QB A 6 . HB# 1 1 101 1 1 1 1 5 TYR QB A 5 . HB# 1 1 101 1 2 1 1 6 LEU QD A 6 . HD## 1 1 102 1 1 1 1 5 TYR QB A 5 . HB# 1 1 102 1 2 1 1 9 ALA MB A 9 . HB# 1 1 103 1 1 1 1 5 TYR QB A 5 . HB# 1 1 103 1 2 2 1 12 PHE HA B 12 . HA 1 1 104 1 1 1 1 5 TYR QB A 5 . HB# 1 1 104 1 2 2 1 16 TRP H B 16 . HN 1 1 105 1 1 1 1 5 TYR QB A 5 . HB# 1 1 105 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 106 1 1 1 1 5 TYR QD A 5 . HD# 1 1 106 1 2 1 1 6 LEU H A 6 . HN 1 1 107 1 1 1 1 5 TYR QD A 5 . HD# 1 1 107 1 2 1 1 6 LEU QB A 6 . HB# 1 1 108 1 1 1 1 5 TYR QD A 5 . HD# 1 1 108 1 2 1 1 6 LEU QD A 6 . HD## 1 1 109 1 1 1 1 5 TYR QD A 5 . HD# 1 1 109 1 2 1 1 8 SER QB A 8 . HB# 1 1 110 1 1 1 1 5 TYR QD A 5 . HD# 1 1 110 1 2 2 1 12 PHE H B 12 . HN 1 1 111 1 1 1 1 5 TYR QD A 5 . HD# 1 1 111 1 2 2 1 12 PHE HA B 12 . HA 1 1 112 1 1 1 1 5 TYR QD A 5 . HD# 1 1 112 1 2 2 1 16 TRP QB B 16 . HB# 1 1 113 1 1 1 1 5 TYR QD A 5 . HD# 1 1 113 1 2 2 1 19 GLU QB B 19 . HB# 1 1 114 1 1 1 1 5 TYR QE A 5 . HE# 1 1 114 1 2 2 1 12 PHE H B 12 . HN 1 1 115 1 1 1 1 5 TYR QE A 5 . HE# 1 1 115 1 2 2 1 12 PHE HA B 12 . HA 1 1 116 1 1 1 1 6 LEU H A 6 . HN 1 1 116 1 2 1 1 6 LEU QB A 6 . HB# 1 1 117 1 1 1 1 6 LEU H A 6 . HN 1 1 117 1 2 1 1 6 LEU QD A 6 . HD## 1 1 118 1 1 1 1 6 LEU H A 6 . HN 1 1 118 1 2 1 1 6 LEU HG A 6 . HG 1 1 119 1 1 1 1 6 LEU H A 6 . HN 1 1 119 1 2 1 1 7 HIS H A 7 . HN 1 1 120 1 1 1 1 6 LEU H A 6 . HN 1 1 120 1 2 2 1 19 GLU QG B 19 . HG# 1 1 121 1 1 1 1 6 LEU HA A 6 . HA 1 1 121 1 2 1 1 6 LEU QB A 6 . HB# 1 1 122 1 1 1 1 6 LEU HA A 6 . HA 1 1 122 1 2 1 1 6 LEU QD A 6 . HD## 1 1 123 1 1 1 1 6 LEU HA A 6 . HA 1 1 123 1 2 1 1 6 LEU HG A 6 . HG 1 1 124 1 1 1 1 6 LEU HA A 6 . HA 1 1 124 1 2 1 1 7 HIS H A 7 . HN 1 1 125 1 1 1 1 6 LEU HA A 6 . HA 1 1 125 1 2 1 1 8 SER H A 8 . HN 1 1 126 1 1 1 1 6 LEU HA A 6 . HA 1 1 126 1 2 1 1 9 ALA H A 9 . HN 1 1 127 1 1 1 1 6 LEU HA A 6 . HA 1 1 127 1 2 1 1 9 ALA MB A 9 . HB# 1 1 128 1 1 1 1 6 LEU HA A 6 . HA 1 1 128 1 2 1 1 10 LYS H A 10 . HN 1 1 129 1 1 1 1 6 LEU QB A 6 . HB# 1 1 129 1 2 1 1 6 LEU QD A 6 . HD## 1 1 130 1 1 1 1 6 LEU QB A 6 . HB# 1 1 130 1 2 1 1 7 HIS HD2 A 7 . HD2 1 1 131 1 1 1 1 6 LEU MD1 A 6 . HD1# 1 1 131 1 2 1 1 6 LEU MD2 A 6 . HD2# 1 1 132 1 1 1 1 6 LEU QD A 6 . HD## 1 1 132 1 2 1 1 7 HIS HD2 A 7 . HD2 1 1 133 1 1 1 1 6 LEU QD A 6 . HD## 1 1 133 1 2 1 1 9 ALA MB A 9 . HB# 1 1 134 1 1 1 1 6 LEU QD A 6 . HD## 1 1 134 1 2 1 1 10 LYS H A 10 . HN 1 1 135 1 1 1 1 6 LEU QD A 6 . HD## 1 1 135 1 2 1 1 10 LYS QB A 10 . HB# 1 1 136 1 1 1 1 6 LEU QD A 6 . HD## 1 1 136 1 2 1 1 10 LYS QE A 10 . HE# 1 1 137 1 1 1 1 6 LEU MD1 A 6 . HD1# 1 1 137 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 138 1 1 1 1 6 LEU HG A 6 . HG 1 1 138 1 2 1 1 7 HIS HE1 A 7 . HE1 1 1 139 1 1 1 1 7 HIS H A 7 . HN 1 1 139 1 2 1 1 7 HIS QB A 7 . HB# 1 1 140 1 1 1 1 7 HIS H A 7 . HN 1 1 140 1 2 1 1 8 SER H A 8 . HN 1 1 141 1 1 1 1 7 HIS H A 7 . HN 1 1 141 1 2 1 1 8 SER QB A 8 . HB# 1 1 142 1 1 1 1 7 HIS H A 7 . HN 1 1 142 1 2 1 1 9 ALA H A 9 . HN 1 1 143 1 1 1 1 7 HIS HA A 7 . HA 1 1 143 1 2 1 1 8 SER H A 8 . HN 1 1 144 1 1 1 1 7 HIS HA A 7 . HA 1 1 144 1 2 1 1 9 ALA H A 9 . HN 1 1 145 1 1 1 1 7 HIS HA A 7 . HA 1 1 145 1 2 1 1 10 LYS QB A 10 . HB# 1 1 146 1 1 1 1 7 HIS QB A 7 . HB# 1 1 146 1 2 1 1 11 LYS QG A 11 . HG# 1 1 147 1 1 1 1 8 SER H A 8 . HN 1 1 147 1 2 1 1 8 SER QB A 8 . HB# 1 1 148 1 1 1 1 8 SER H A 8 . HN 1 1 148 1 2 1 1 9 ALA H A 9 . HN 1 1 149 1 1 1 1 8 SER HA A 8 . HA 1 1 149 1 2 1 1 8 SER QB A 8 . HB# 1 1 150 1 1 1 1 8 SER HA A 8 . HA 1 1 150 1 2 1 1 9 ALA H A 9 . HN 1 1 151 1 1 1 1 8 SER HA A 8 . HA 1 1 151 1 2 1 1 10 LYS H A 10 . HN 1 1 152 1 1 1 1 8 SER HA A 8 . HA 1 1 152 1 2 1 1 11 LYS H A 11 . HN 1 1 153 1 1 1 1 8 SER HA A 8 . HA 1 1 153 1 2 1 1 11 LYS QB A 11 . HB# 1 1 154 1 1 1 1 8 SER HA A 8 . HA 1 1 154 1 2 1 1 12 PHE H A 12 . HN 1 1 155 1 1 1 1 9 ALA H A 9 . HN 1 1 155 1 2 1 1 9 ALA MB A 9 . HB# 1 1 156 1 1 1 1 9 ALA H A 9 . HN 1 1 156 1 2 1 1 10 LYS H A 10 . HN 1 1 157 1 1 1 1 9 ALA H A 9 . HN 1 1 157 1 2 1 1 10 LYS QB A 10 . HB# 1 1 158 1 1 1 1 9 ALA H A 9 . HN 1 1 158 1 2 1 1 11 LYS H A 11 . HN 1 1 159 1 1 1 1 9 ALA HA A 9 . HA 1 1 159 1 2 1 1 9 ALA MB A 9 . HB# 1 1 160 1 1 1 1 9 ALA HA A 9 . HA 1 1 160 1 2 1 1 10 LYS H A 10 . HN 1 1 161 1 1 1 1 9 ALA HA A 9 . HA 1 1 161 1 2 1 1 11 LYS H A 11 . HN 1 1 162 1 1 1 1 9 ALA HA A 9 . HA 1 1 162 1 2 1 1 12 PHE H A 12 . HN 1 1 163 1 1 1 1 9 ALA HA A 9 . HA 1 1 163 1 2 1 1 12 PHE QB A 12 . HB# 1 1 164 1 1 1 1 9 ALA HA A 9 . HA 1 1 164 1 2 1 1 12 PHE QD A 12 . HD# 1 1 165 1 1 1 1 9 ALA HA A 9 . HA 1 1 165 1 2 1 1 13 GLY H A 13 . HN 1 1 166 1 1 1 1 9 ALA HA A 9 . HA 1 1 166 1 2 2 1 12 PHE QD B 12 . HD# 1 1 167 1 1 1 1 9 ALA HA A 9 . HA 1 1 167 1 2 2 1 16 TRP HD1 B 16 . HD1 1 1 168 1 1 1 1 9 ALA MB A 9 . HB# 1 1 168 1 2 1 1 10 LYS H A 10 . HN 1 1 169 1 1 1 1 9 ALA MB A 9 . HB# 1 1 169 1 2 1 1 12 PHE QB A 12 . HB# 1 1 170 1 1 1 1 9 ALA MB A 9 . HB# 1 1 170 1 2 1 1 13 GLY H A 13 . HN 1 1 171 1 1 1 1 9 ALA MB A 9 . HB# 1 1 171 1 2 2 1 12 PHE QB B 12 . HB# 1 1 172 1 1 1 1 9 ALA MB A 9 . HB# 1 1 172 1 2 2 1 16 TRP HA B 16 . HA 1 1 173 1 1 1 1 9 ALA MB A 9 . HB# 1 1 173 1 2 2 1 16 TRP HE3 B 16 . HE3 1 1 174 1 1 1 1 9 ALA MB A 9 . HB# 1 1 174 1 2 2 1 20 ILE H B 20 . HN 1 1 175 1 1 1 1 10 LYS H A 10 . HN 1 1 175 1 2 1 1 10 LYS QB A 10 . HB# 1 1 176 1 1 1 1 10 LYS H A 10 . HN 1 1 176 1 2 1 1 11 LYS H A 11 . HN 1 1 177 1 1 1 1 10 LYS H A 10 . HN 1 1 177 1 2 1 1 12 PHE H A 12 . HN 1 1 178 1 1 1 1 10 LYS H A 10 . HN 1 1 178 1 2 2 1 16 TRP HA B 16 . HA 1 1 179 1 1 1 1 10 LYS H A 10 . HN 1 1 179 1 2 2 1 16 TRP HD1 B 16 . HD1 1 1 180 1 1 1 1 10 LYS H A 10 . HN 1 1 180 1 2 2 1 16 TRP HE3 B 16 . HE3 1 1 181 1 1 1 1 10 LYS HA A 10 . HA 1 1 181 1 2 1 1 10 LYS QB A 10 . HB# 1 1 182 1 1 1 1 10 LYS HA A 10 . HA 1 1 182 1 2 1 1 10 LYS QG A 10 . HG# 1 1 183 1 1 1 1 10 LYS HA A 10 . HA 1 1 183 1 2 1 1 11 LYS H A 11 . HN 1 1 184 1 1 1 1 10 LYS HA A 10 . HA 1 1 184 1 2 1 1 12 PHE H A 12 . HN 1 1 185 1 1 1 1 10 LYS HA A 10 . HA 1 1 185 1 2 1 1 13 GLY H A 13 . HN 1 1 186 1 1 1 1 10 LYS HA A 10 . HA 1 1 186 1 2 1 1 14 LYS H A 14 . HN 1 1 187 1 1 1 1 10 LYS HA A 10 . HA 1 1 187 1 2 1 1 14 LYS QG A 14 . HG# 1 1 188 1 1 1 1 10 LYS HA A 10 . HA 1 1 188 1 2 2 1 16 TRP HH2 B 16 . HH2 1 1 189 1 1 1 1 10 LYS QB A 10 . HB# 1 1 189 1 2 1 1 10 LYS QE A 10 . HE# 1 1 190 1 1 1 1 10 LYS QB A 10 . HB# 1 1 190 1 2 1 1 10 LYS QG A 10 . HG# 1 1 191 1 1 1 1 10 LYS QB A 10 . HB# 1 1 191 1 2 1 1 11 LYS H A 11 . HN 1 1 192 1 1 1 1 10 LYS QB A 10 . HB# 1 1 192 1 2 1 1 13 GLY H A 13 . HN 1 1 193 1 1 1 1 10 LYS QB A 10 . HB# 1 1 193 1 2 1 1 13 GLY QA A 13 . HA# 1 1 194 1 1 1 1 10 LYS QB A 10 . HB# 1 1 194 1 2 1 1 14 LYS H A 14 . HN 1 1 195 1 1 1 1 10 LYS QB A 10 . HB# 1 1 195 1 2 1 1 14 LYS QB A 14 . HB# 1 1 196 1 1 1 1 10 LYS QB A 10 . HB# 1 1 196 1 2 1 1 14 LYS QG A 14 . HG# 1 1 197 1 1 1 1 10 LYS QE A 10 . HE# 1 1 197 1 2 1 1 10 LYS QG A 10 . HG# 1 1 198 1 1 1 1 10 LYS QE A 10 . HE# 1 1 198 1 2 1 1 11 LYS QG A 11 . HG# 1 1 199 1 1 1 1 10 LYS HG3 A 10 . HG1 1 1 199 1 2 1 1 13 GLY QA A 13 . HA# 1 1 200 1 1 1 1 11 LYS H A 11 . HN 1 1 200 1 2 1 1 11 LYS QB A 11 . HB# 1 1 201 1 1 1 1 11 LYS H A 11 . HN 1 1 201 1 2 1 1 11 LYS QE A 11 . HE# 1 1 202 1 1 1 1 11 LYS H A 11 . HN 1 1 202 1 2 1 1 11 LYS QG A 11 . HG# 1 1 203 1 1 1 1 11 LYS H A 11 . HN 1 1 203 1 2 1 1 12 PHE H A 12 . HN 1 1 204 1 1 1 1 11 LYS H A 11 . HN 1 1 204 1 2 1 1 12 PHE QB A 12 . HB# 1 1 205 1 1 1 1 11 LYS H A 11 . HN 1 1 205 1 2 1 1 13 GLY H A 13 . HN 1 1 206 1 1 1 1 11 LYS HA A 11 . HA 1 1 206 1 2 1 1 11 LYS QB A 11 . HB# 1 1 207 1 1 1 1 11 LYS HA A 11 . HA 1 1 207 1 2 1 1 11 LYS QE A 11 . HE# 1 1 208 1 1 1 1 11 LYS HA A 11 . HA 1 1 208 1 2 1 1 11 LYS QG A 11 . HG# 1 1 209 1 1 1 1 11 LYS HA A 11 . HA 1 1 209 1 2 1 1 12 PHE H A 12 . HN 1 1 210 1 1 1 1 11 LYS HA A 11 . HA 1 1 210 1 2 1 1 13 GLY H A 13 . HN 1 1 211 1 1 1 1 11 LYS HA A 11 . HA 1 1 211 1 2 1 1 14 LYS H A 14 . HN 1 1 212 1 1 1 1 11 LYS HA A 11 . HA 1 1 212 1 2 1 1 14 LYS QB A 14 . HB# 1 1 213 1 1 1 1 11 LYS HA A 11 . HA 1 1 213 1 2 1 1 14 LYS QE A 14 . HE# 1 1 214 1 1 1 1 11 LYS HA A 11 . HA 1 1 214 1 2 1 1 15 ALA H A 15 . HN 1 1 215 1 1 1 1 11 LYS HA A 11 . HA 1 1 215 1 2 1 1 15 ALA MB A 15 . HB# 1 1 216 1 1 1 1 11 LYS QB A 11 . HB# 1 1 216 1 2 1 1 11 LYS QE A 11 . HE# 1 1 217 1 1 1 1 11 LYS QB A 11 . HB# 1 1 217 1 2 1 1 11 LYS QG A 11 . HG# 1 1 218 1 1 1 1 11 LYS QB A 11 . HB# 1 1 218 1 2 1 1 12 PHE H A 12 . HN 1 1 219 1 1 1 1 11 LYS QB A 11 . HB# 1 1 219 1 2 1 1 14 LYS HB2 A 14 . HB2 1 1 220 1 1 1 1 11 LYS QD A 11 . HD# 1 1 220 1 2 1 1 11 LYS QG A 11 . HG# 1 1 221 1 1 1 1 11 LYS QE A 11 . HE# 1 1 221 1 2 1 1 11 LYS QG A 11 . HG# 1 1 222 1 1 1 1 11 LYS QE A 11 . HE# 1 1 222 1 2 1 1 15 ALA MB A 15 . HB# 1 1 223 1 1 1 1 11 LYS QG A 11 . HG# 1 1 223 1 2 1 1 12 PHE H A 12 . HN 1 1 224 1 1 1 1 12 PHE H A 12 . HN 1 1 224 1 2 1 1 12 PHE QB A 12 . HB# 1 1 225 1 1 1 1 12 PHE H A 12 . HN 1 1 225 1 2 1 1 13 GLY H A 13 . HN 1 1 226 1 1 1 1 12 PHE H A 12 . HN 1 1 226 1 2 1 1 14 LYS H A 14 . HN 1 1 227 1 1 1 1 12 PHE H A 12 . HN 1 1 227 1 2 1 1 16 TRP HD1 A 16 . HD1 1 1 228 1 1 1 1 12 PHE H A 12 . HN 1 1 228 1 2 2 1 5 TYR QD B 5 . HD# 1 1 229 1 1 1 1 12 PHE H A 12 . HN 1 1 229 1 2 2 1 5 TYR QE B 5 . HE# 1 1 230 1 1 1 1 12 PHE HA A 12 . HA 1 1 230 1 2 1 1 12 PHE QB A 12 . HB# 1 1 231 1 1 1 1 12 PHE HA A 12 . HA 1 1 231 1 2 1 1 12 PHE QD A 12 . HD# 1 1 232 1 1 1 1 12 PHE HA A 12 . HA 1 1 232 1 2 1 1 13 GLY H A 13 . HN 1 1 233 1 1 1 1 12 PHE HA A 12 . HA 1 1 233 1 2 1 1 14 LYS H A 14 . HN 1 1 234 1 1 1 1 12 PHE HA A 12 . HA 1 1 234 1 2 1 1 15 ALA H A 15 . HN 1 1 235 1 1 1 1 12 PHE HA A 12 . HA 1 1 235 1 2 1 1 15 ALA MB A 15 . HB# 1 1 236 1 1 1 1 12 PHE HA A 12 . HA 1 1 236 1 2 1 1 16 TRP H A 16 . HN 1 1 237 1 1 1 1 12 PHE HA A 12 . HA 1 1 237 1 2 2 1 5 TYR QB B 5 . HB# 1 1 238 1 1 1 1 12 PHE HA A 12 . HA 1 1 238 1 2 2 1 5 TYR QD B 5 . HD# 1 1 239 1 1 1 1 12 PHE HA A 12 . HA 1 1 239 1 2 2 1 5 TYR QE B 5 . HE# 1 1 240 1 1 1 1 12 PHE QB A 12 . HB# 1 1 240 1 2 1 1 12 PHE QD A 12 . HD# 1 1 241 1 1 1 1 12 PHE QB A 12 . HB# 1 1 241 1 2 1 1 13 GLY H A 13 . HN 1 1 242 1 1 1 1 12 PHE QB A 12 . HB# 1 1 242 1 2 1 1 13 GLY QA A 13 . HA# 1 1 243 1 1 1 1 12 PHE QB A 12 . HB# 1 1 243 1 2 1 1 16 TRP HA A 16 . HA 1 1 244 1 1 1 1 12 PHE QB A 12 . HB# 1 1 244 1 2 1 1 16 TRP HD1 A 16 . HD1 1 1 245 1 1 1 1 12 PHE QB A 12 . HB# 1 1 245 1 2 2 1 4 LYS QB B 4 . HB# 1 1 246 1 1 1 1 12 PHE QB A 12 . HB# 1 1 246 1 2 2 1 5 TYR H B 5 . HN 1 1 247 1 1 1 1 12 PHE QB A 12 . HB# 1 1 247 1 2 2 1 5 TYR HA B 5 . HA 1 1 248 1 1 1 1 12 PHE QB A 12 . HB# 1 1 248 1 2 2 1 9 ALA MB B 9 . HB# 1 1 249 1 1 1 1 12 PHE QB A 12 . HB# 1 1 249 1 2 2 1 12 PHE QD B 12 . HD# 1 1 250 1 1 1 1 12 PHE QD A 12 . HD# 1 1 250 1 2 2 1 9 ALA HA B 9 . HA 1 1 251 1 1 1 1 12 PHE QD A 12 . HD# 1 1 251 1 2 2 1 12 PHE QB B 12 . HB# 1 1 252 1 1 1 1 13 GLY H A 13 . HN 1 1 252 1 2 1 1 14 LYS H A 14 . HN 1 1 253 1 1 1 1 13 GLY QA A 13 . HA# 1 1 253 1 2 1 1 14 LYS H A 14 . HN 1 1 254 1 1 1 1 13 GLY QA A 13 . HA# 1 1 254 1 2 1 1 14 LYS QB A 14 . HB# 1 1 255 1 1 1 1 13 GLY QA A 13 . HA# 1 1 255 1 2 1 1 15 ALA H A 15 . HN 1 1 256 1 1 1 1 13 GLY QA A 13 . HA# 1 1 256 1 2 1 1 16 TRP H A 16 . HN 1 1 257 1 1 1 1 13 GLY QA A 13 . HA# 1 1 257 1 2 1 1 16 TRP QB A 16 . HB# 1 1 258 1 1 1 1 13 GLY QA A 13 . HA# 1 1 258 1 2 1 1 16 TRP HD1 A 16 . HD1 1 1 259 1 1 1 1 13 GLY QA A 13 . HA# 1 1 259 1 2 1 1 16 TRP HE3 A 16 . HE3 1 1 260 1 1 1 1 13 GLY QA A 13 . HA# 1 1 260 1 2 1 1 17 VAL H A 17 . HN 1 1 261 1 1 1 1 13 GLY QA A 13 . HA# 1 1 261 1 2 1 1 17 VAL QG A 17 . HG## 1 1 262 1 1 1 1 13 GLY QA A 13 . HA# 1 1 262 1 2 2 1 16 TRP HD1 B 16 . HD1 1 1 263 1 1 1 1 14 LYS H A 14 . HN 1 1 263 1 2 1 1 14 LYS QB A 14 . HB# 1 1 264 1 1 1 1 14 LYS H A 14 . HN 1 1 264 1 2 1 1 14 LYS QD A 14 . HD# 1 1 265 1 1 1 1 14 LYS H A 14 . HN 1 1 265 1 2 1 1 14 LYS QG A 14 . HG# 1 1 266 1 1 1 1 14 LYS H A 14 . HN 1 1 266 1 2 1 1 15 ALA H A 15 . HN 1 1 267 1 1 1 1 14 LYS H A 14 . HN 1 1 267 1 2 1 1 17 VAL QG A 17 . HG## 1 1 268 1 1 1 1 14 LYS HA A 14 . HA 1 1 268 1 2 1 1 14 LYS QB A 14 . HB# 1 1 269 1 1 1 1 14 LYS HA A 14 . HA 1 1 269 1 2 1 1 14 LYS QG A 14 . HG# 1 1 270 1 1 1 1 14 LYS HA A 14 . HA 1 1 270 1 2 1 1 15 ALA H A 15 . HN 1 1 271 1 1 1 1 14 LYS HA A 14 . HA 1 1 271 1 2 1 1 16 TRP H A 16 . HN 1 1 272 1 1 1 1 14 LYS HA A 14 . HA 1 1 272 1 2 1 1 17 VAL H A 17 . HN 1 1 273 1 1 1 1 14 LYS HA A 14 . HA 1 1 273 1 2 1 1 17 VAL HB A 17 . HB 1 1 274 1 1 1 1 14 LYS HA A 14 . HA 1 1 274 1 2 1 1 17 VAL QG A 17 . HG# 1 1 275 1 1 1 1 14 LYS HA A 14 . HA 1 1 275 1 2 1 1 18 GLY H A 18 . HN 1 1 276 1 1 1 1 14 LYS QB A 14 . HB# 1 1 276 1 2 1 1 14 LYS QE A 14 . HE# 1 1 277 1 1 1 1 14 LYS QB A 14 . HB# 1 1 277 1 2 1 1 14 LYS QG A 14 . HG# 1 1 278 1 1 1 1 14 LYS QB A 14 . HB# 1 1 278 1 2 1 1 15 ALA H A 15 . HN 1 1 279 1 1 1 1 14 LYS QB A 14 . HB# 1 1 279 1 2 1 1 15 ALA HA A 15 . HA 1 1 280 1 1 1 1 14 LYS QB A 14 . HB# 1 1 280 1 2 1 1 17 VAL QG A 17 . HG## 1 1 281 1 1 1 1 14 LYS QE A 14 . HE# 1 1 281 1 2 1 1 14 LYS QG A 14 . HG# 1 1 282 1 1 1 1 14 LYS QE A 14 . HE# 1 1 282 1 2 1 1 17 VAL HB A 17 . HB 1 1 283 1 1 1 1 14 LYS QE A 14 . HE# 1 1 283 1 2 1 1 17 VAL QG A 17 . HG# 1 1 284 1 1 1 1 15 ALA H A 15 . HN 1 1 284 1 2 1 1 15 ALA MB A 15 . HB# 1 1 285 1 1 1 1 15 ALA H A 15 . HN 1 1 285 1 2 1 1 16 TRP H A 16 . HN 1 1 286 1 1 1 1 15 ALA H A 15 . HN 1 1 286 1 2 1 1 16 TRP QB A 16 . HB# 1 1 287 1 1 1 1 15 ALA H A 15 . HN 1 1 287 1 2 1 1 17 VAL H A 17 . HN 1 1 288 1 1 1 1 15 ALA HA A 15 . HA 1 1 288 1 2 1 1 15 ALA MB A 15 . HB# 1 1 289 1 1 1 1 15 ALA HA A 15 . HA 1 1 289 1 2 1 1 16 TRP H A 16 . HN 1 1 290 1 1 1 1 15 ALA HA A 15 . HA 1 1 290 1 2 1 1 17 VAL H A 17 . HN 1 1 291 1 1 1 1 15 ALA HA A 15 . HA 1 1 291 1 2 1 1 18 GLY H A 18 . HN 1 1 292 1 1 1 1 15 ALA HA A 15 . HA 1 1 292 1 2 1 1 19 GLU H A 19 . HN 1 1 293 1 1 1 1 15 ALA MB A 15 . HB# 1 1 293 1 2 1 1 16 TRP H A 16 . HN 1 1 294 1 1 1 1 15 ALA MB A 15 . HB# 1 1 294 1 2 1 1 16 TRP HA A 16 . HA 1 1 295 1 1 1 1 15 ALA MB A 15 . HB# 1 1 295 1 2 1 1 16 TRP QB A 16 . HB# 1 1 296 1 1 1 1 15 ALA MB A 15 . HB# 1 1 296 1 2 1 1 16 TRP HD1 A 16 . HD1 1 1 297 1 1 1 1 15 ALA MB A 15 . HB# 1 1 297 1 2 1 1 19 GLU QB A 19 . HB# 1 1 298 1 1 1 1 15 ALA MB A 15 . HB# 1 1 298 1 2 1 1 19 GLU QG A 19 . HG# 1 1 299 1 1 1 1 16 TRP H A 16 . HN 1 1 299 1 2 1 1 16 TRP QB A 16 . HB# 1 1 300 1 1 1 1 16 TRP H A 16 . HN 1 1 300 1 2 1 1 16 TRP HE3 A 16 . HE3 1 1 301 1 1 1 1 16 TRP H A 16 . HN 1 1 301 1 2 1 1 17 VAL H A 17 . HN 1 1 302 1 1 1 1 16 TRP H A 16 . HN 1 1 302 1 2 1 1 17 VAL HB A 17 . HB 1 1 303 1 1 1 1 16 TRP H A 16 . HN 1 1 303 1 2 1 1 17 VAL QG A 17 . HG## 1 1 304 1 1 1 1 16 TRP H A 16 . HN 1 1 304 1 2 1 1 18 GLY H A 18 . HN 1 1 305 1 1 1 1 16 TRP H A 16 . HN 1 1 305 1 2 1 1 19 GLU QB A 19 . HB# 1 1 306 1 1 1 1 16 TRP H A 16 . HN 1 1 306 1 2 2 1 5 TYR HA B 5 . HA 1 1 307 1 1 1 1 16 TRP H A 16 . HN 1 1 307 1 2 2 1 5 TYR QB B 5 . HB# 1 1 308 1 1 1 1 16 TRP HA A 16 . HA 1 1 308 1 2 1 1 16 TRP QB A 16 . HB# 1 1 309 1 1 1 1 16 TRP HA A 16 . HA 1 1 309 1 2 1 1 16 TRP HE3 A 16 . HE3 1 1 310 1 1 1 1 16 TRP HA A 16 . HA 1 1 310 1 2 1 1 17 VAL H A 17 . HN 1 1 311 1 1 1 1 16 TRP HA A 16 . HA 1 1 311 1 2 1 1 18 GLY H A 18 . HN 1 1 312 1 1 1 1 16 TRP HA A 16 . HA 1 1 312 1 2 1 1 19 GLU H A 19 . HN 1 1 313 1 1 1 1 16 TRP HA A 16 . HA 1 1 313 1 2 1 1 19 GLU QB A 19 . HB# 1 1 314 1 1 1 1 16 TRP HA A 16 . HA 1 1 314 1 2 1 1 19 GLU QG A 19 . HG# 1 1 315 1 1 1 1 16 TRP HA A 16 . HA 1 1 315 1 2 2 1 5 TYR H B 5 . HN 1 1 316 1 1 1 1 16 TRP HA A 16 . HA 1 1 316 1 2 2 1 9 ALA MB B 9 . HB# 1 1 317 1 1 1 1 16 TRP HA A 16 . HA 1 1 317 1 2 2 1 10 LYS H B 10 . HN 1 1 318 1 1 1 1 16 TRP QB A 16 . HB# 1 1 318 1 2 1 1 17 VAL H A 17 . HN 1 1 319 1 1 1 1 16 TRP QB A 16 . HB# 1 1 319 1 2 1 1 17 VAL HB A 17 . HB 1 1 320 1 1 1 1 16 TRP QB A 16 . HB# 1 1 320 1 2 1 1 17 VAL QG A 17 . HG## 1 1 321 1 1 1 1 16 TRP QB A 16 . HB# 1 1 321 1 2 1 1 19 GLU QG A 19 . HG# 1 1 322 1 1 1 1 16 TRP QB A 16 . HB# 1 1 322 1 2 1 1 20 ILE QG A 20 . HG## 1 1 322 1 2 1 1 20 ILE MG A 20 . HG## 1 1 323 1 1 1 1 16 TRP QB A 16 . HB# 1 1 323 1 2 2 1 5 TYR H B 5 . HN 1 1 324 1 1 1 1 16 TRP QB A 16 . HB# 1 1 324 1 2 2 1 5 TYR HA B 5 . HA 1 1 325 1 1 1 1 16 TRP QB A 16 . HB# 1 1 325 1 2 2 1 5 TYR QD B 5 . HD# 1 1 326 1 1 1 1 16 TRP HD1 A 16 . HD1 1 1 326 1 2 2 1 9 ALA HA B 9 . HA 1 1 327 1 1 1 1 16 TRP HD1 A 16 . HD1 1 1 327 1 2 2 1 10 LYS H B 10 . HN 1 1 328 1 1 1 1 16 TRP HD1 A 16 . HD1 1 1 328 1 2 2 1 13 GLY QA B 13 . HA# 1 1 329 1 1 1 1 16 TRP HE3 A 16 . HE3 1 1 329 1 2 1 1 17 VAL HA A 17 . HA 1 1 330 1 1 1 1 16 TRP HE3 A 16 . HE3 1 1 330 1 2 1 1 17 VAL QG A 17 . HG## 1 1 331 1 1 1 1 16 TRP HE3 A 16 . HE3 1 1 331 1 2 1 1 19 GLU QG A 19 . HG# 1 1 332 1 1 1 1 16 TRP HE3 A 16 . HE3 1 1 332 1 2 1 1 20 ILE HA A 20 . HA 1 1 333 1 1 1 1 16 TRP HE3 A 16 . HE3 1 1 333 1 2 1 1 21 MET H A 21 . HN 1 1 334 1 1 1 1 16 TRP HE3 A 16 . HE3 1 1 334 1 2 2 1 5 TYR HA B 5 . HA 1 1 335 1 1 1 1 16 TRP HE3 A 16 . HE3 1 1 335 1 2 2 1 9 ALA MB B 9 . HB# 1 1 336 1 1 1 1 16 TRP HE3 A 16 . HE3 1 1 336 1 2 2 1 10 LYS H B 10 . HN 1 1 337 1 1 1 1 16 TRP HH2 A 16 . HH2 1 1 337 1 2 1 1 17 VAL HB A 17 . HB 1 1 338 1 1 1 1 16 TRP HH2 A 16 . HH2 1 1 338 1 2 1 1 20 ILE MG A 20 . HG2# 1 1 339 1 1 1 1 16 TRP HH2 A 16 . HH2 1 1 339 1 2 1 1 21 MET HA A 21 . HA 1 1 340 1 1 1 1 16 TRP HH2 A 16 . HH2 1 1 340 1 2 2 1 10 LYS HA B 10 . HA 1 1 341 1 1 1 1 16 TRP HZ3 A 16 . HZ3 1 1 341 1 2 1 1 17 VAL QG A 17 . HG## 1 1 342 1 1 1 1 16 TRP HZ3 A 16 . HZ3 1 1 342 1 2 1 1 19 GLU QB A 19 . HB# 1 1 343 1 1 1 1 16 TRP HZ3 A 16 . HZ3 1 1 343 1 2 1 1 20 ILE MD A 20 . HD# 1 1 344 1 1 1 1 16 TRP HZ3 A 16 . HZ3 1 1 344 1 2 1 1 20 ILE MG A 20 . HG2# 1 1 345 1 1 1 1 16 TRP HZ3 A 16 . HZ3 1 1 345 1 2 1 1 21 MET HA A 21 . HA 1 1 346 1 1 1 1 17 VAL H A 17 . HN 1 1 346 1 2 1 1 17 VAL HB A 17 . HB 1 1 347 1 1 1 1 17 VAL H A 17 . HN 1 1 347 1 2 1 1 17 VAL QG A 17 . HG## 1 1 348 1 1 1 1 17 VAL H A 17 . HN 1 1 348 1 2 1 1 18 GLY H A 18 . HN 1 1 349 1 1 1 1 17 VAL H A 17 . HN 1 1 349 1 2 1 1 19 GLU H A 19 . HN 1 1 350 1 1 1 1 17 VAL H A 17 . HN 1 1 350 1 2 1 1 19 GLU QB A 19 . HB# 1 1 351 1 1 1 1 17 VAL HA A 17 . HA 1 1 351 1 2 1 1 17 VAL QG A 17 . HG## 1 1 352 1 1 1 1 17 VAL HA A 17 . HA 1 1 352 1 2 1 1 18 GLY H A 18 . HN 1 1 353 1 1 1 1 17 VAL HA A 17 . HA 1 1 353 1 2 1 1 19 GLU H A 19 . HN 1 1 354 1 1 1 1 17 VAL HA A 17 . HA 1 1 354 1 2 1 1 19 GLU QG A 19 . HG# 1 1 355 1 1 1 1 17 VAL HA A 17 . HA 1 1 355 1 2 1 1 20 ILE H A 20 . HN 1 1 356 1 1 1 1 17 VAL HA A 17 . HA 1 1 356 1 2 1 1 20 ILE HB A 20 . HB 1 1 357 1 1 1 1 17 VAL HA A 17 . HA 1 1 357 1 2 1 1 20 ILE MD A 20 . HD# 1 1 358 1 1 1 1 17 VAL HA A 17 . HA 1 1 358 1 2 1 1 20 ILE QG A 20 . HG1# 1 1 359 1 1 1 1 17 VAL HA A 17 . HA 1 1 359 1 2 1 1 20 ILE MG A 20 . HG2# 1 1 360 1 1 1 1 17 VAL HA A 17 . HA 1 1 360 1 2 1 1 21 MET H A 21 . HN 1 1 361 1 1 1 1 17 VAL HA A 17 . HA 1 1 361 1 2 1 1 21 MET QB A 21 . HB# 1 1 362 1 1 1 1 17 VAL HA A 17 . HA 1 1 362 1 2 1 1 21 MET QG A 21 . HG# 1 1 363 1 1 1 1 17 VAL HB A 17 . HB 1 1 363 1 2 1 1 17 VAL QG A 17 . HG## 1 1 364 1 1 1 1 17 VAL HB A 17 . HB 1 1 364 1 2 1 1 18 GLY H A 18 . HN 1 1 365 1 1 1 1 17 VAL HB A 17 . HB 1 1 365 1 2 1 1 18 GLY QA A 18 . HA# 1 1 366 1 1 1 1 17 VAL QG A 17 . HG## 1 1 366 1 2 1 1 18 GLY H A 18 . HN 1 1 367 1 1 1 1 17 VAL QG A 17 . HG## 1 1 367 1 2 1 1 18 GLY QA A 18 . HA# 1 1 368 1 1 1 1 17 VAL QG A 17 . HG## 1 1 368 1 2 1 1 20 ILE H A 20 . HN 1 1 369 1 1 1 1 17 VAL QG A 17 . HG## 1 1 369 1 2 1 1 20 ILE HB A 20 . HB 1 1 370 1 1 1 1 17 VAL QG A 17 . HG## 1 1 370 1 2 1 1 20 ILE QG A 20 . HG1# 1 1 371 1 1 1 1 17 VAL QG A 17 . HG## 1 1 371 1 2 1 1 21 MET H A 21 . HN 1 1 372 1 1 1 1 17 VAL QG A 17 . HG## 1 1 372 1 2 1 1 21 MET HA A 21 . HA 1 1 373 1 1 1 1 17 VAL QG A 17 . HG## 1 1 373 1 2 1 1 21 MET QB A 21 . HB# 1 1 374 1 1 1 1 17 VAL QG A 17 . HG## 1 1 374 1 2 1 1 21 MET QG A 21 . HG# 1 1 375 1 1 1 1 18 GLY H A 18 . HN 1 1 375 1 2 1 1 19 GLU H A 19 . HN 1 1 376 1 1 1 1 18 GLY H A 18 . HN 1 1 376 1 2 1 1 19 GLU QB A 19 . HB# 1 1 377 1 1 1 1 18 GLY H A 18 . HN 1 1 377 1 2 1 1 20 ILE H A 20 . HN 1 1 378 1 1 1 1 18 GLY H A 18 . HN 1 1 378 1 2 1 1 21 MET QB A 21 . HB# 1 1 379 1 1 1 1 18 GLY QA A 18 . HA# 1 1 379 1 2 1 1 19 GLU H A 19 . HN 1 1 380 1 1 1 1 18 GLY QA A 18 . HA# 1 1 380 1 2 1 1 20 ILE H A 20 . HN 1 1 381 1 1 1 1 18 GLY QA A 18 . HA# 1 1 381 1 2 1 1 21 MET H A 21 . HN 1 1 382 1 1 1 1 18 GLY QA A 18 . HA# 1 1 382 1 2 1 1 21 MET QB A 21 . HB# 1 1 383 1 1 1 1 18 GLY QA A 18 . HA# 1 1 383 1 2 1 1 21 MET QG A 21 . HG# 1 1 384 1 1 1 1 18 GLY QA A 18 . HA# 1 1 384 1 2 1 1 22 ASN H A 22 . HN 1 1 385 1 1 1 1 18 GLY QA A 18 . HA# 1 1 385 1 2 1 1 22 ASN QD A 22 . HD2# 1 1 386 1 1 1 1 19 GLU H A 19 . HN 1 1 386 1 2 1 1 19 GLU QB A 19 . HB# 1 1 387 1 1 1 1 19 GLU H A 19 . HN 1 1 387 1 2 1 1 19 GLU QG A 19 . HG# 1 1 388 1 1 1 1 19 GLU H A 19 . HN 1 1 388 1 2 1 1 20 ILE H A 20 . HN 1 1 389 1 1 1 1 19 GLU H A 19 . HN 1 1 389 1 2 1 1 20 ILE HA A 20 . HA 1 1 390 1 1 1 1 19 GLU H A 19 . HN 1 1 390 1 2 1 1 20 ILE QG A 20 . HG1# 1 1 391 1 1 1 1 19 GLU H A 19 . HN 1 1 391 1 2 1 1 21 MET H A 21 . HN 1 1 392 1 1 1 1 19 GLU HA A 19 . HA 1 1 392 1 2 1 1 19 GLU QB A 19 . HB# 1 1 393 1 1 1 1 19 GLU HA A 19 . HA 1 1 393 1 2 1 1 19 GLU QG A 19 . HG# 1 1 394 1 1 1 1 19 GLU HA A 19 . HA 1 1 394 1 2 1 1 20 ILE H A 20 . HN 1 1 395 1 1 1 1 19 GLU HA A 19 . HA 1 1 395 1 2 1 1 21 MET H A 21 . HN 1 1 396 1 1 1 1 19 GLU HA A 19 . HA 1 1 396 1 2 1 1 22 ASN H A 22 . HN 1 1 397 1 1 1 1 19 GLU HA A 19 . HA 1 1 397 1 2 1 1 22 ASN QB A 22 . HB# 1 1 398 1 1 1 1 19 GLU HA A 19 . HA 1 1 398 1 2 1 1 22 ASN QD A 22 . HD2# 1 1 399 1 1 1 1 19 GLU HA A 19 . HA 1 1 399 1 2 1 1 23 SER H A 23 . HN 1 1 400 1 1 1 1 19 GLU QB A 19 . HB# 1 1 400 1 2 1 1 19 GLU QG A 19 . HG# 1 1 401 1 1 1 1 19 GLU QB A 19 . HB# 1 1 401 1 2 1 1 20 ILE H A 20 . HN 1 1 402 1 1 1 1 19 GLU QB A 19 . HB# 1 1 402 1 2 1 1 20 ILE QG A 20 . HG1# 1 1 403 1 1 1 1 19 GLU QB A 19 . HB# 1 1 403 1 2 2 1 5 TYR QD B 5 . HD# 1 1 404 1 1 1 1 19 GLU QG A 19 . HG# 1 1 404 1 2 1 1 20 ILE H A 20 . HN 1 1 405 1 1 1 1 19 GLU QG A 19 . HG# 1 1 405 1 2 1 1 20 ILE HB A 20 . HB 1 1 406 1 1 1 1 19 GLU QG A 19 . HG# 1 1 406 1 2 1 1 20 ILE QG A 20 . HG1# 1 1 407 1 1 1 1 19 GLU QG A 19 . HG# 1 1 407 1 2 1 1 23 SER QB A 23 . HB# 1 1 408 1 1 1 1 19 GLU QG A 19 . HG# 1 1 408 1 2 2 1 6 LEU H B 6 . HN 1 1 409 1 1 1 1 20 ILE H A 20 . HN 1 1 409 1 2 1 1 20 ILE HB A 20 . HB 1 1 410 1 1 1 1 20 ILE H A 20 . HN 1 1 410 1 2 1 1 20 ILE MD A 20 . HD# 1 1 411 1 1 1 1 20 ILE H A 20 . HN 1 1 411 1 2 1 1 20 ILE QG A 20 . HG## 1 1 411 1 2 1 1 20 ILE MG A 20 . HG## 1 1 412 1 1 1 1 20 ILE H A 20 . HN 1 1 412 1 2 1 1 21 MET H A 21 . HN 1 1 413 1 1 1 1 20 ILE H A 20 . HN 1 1 413 1 2 1 1 22 ASN H A 22 . HN 1 1 414 1 1 1 1 20 ILE H A 20 . HN 1 1 414 1 2 2 1 9 ALA MB B 9 . HB# 1 1 415 1 1 1 1 20 ILE HA A 20 . HA 1 1 415 1 2 1 1 20 ILE MD A 20 . HD# 1 1 416 1 1 1 1 20 ILE HA A 20 . HA 1 1 416 1 2 1 1 20 ILE QG A 20 . HG1# 1 1 417 1 1 1 1 20 ILE HA A 20 . HA 1 1 417 1 2 1 1 20 ILE MG A 20 . HG2# 1 1 418 1 1 1 1 20 ILE HA A 20 . HA 1 1 418 1 2 1 1 21 MET H A 21 . HN 1 1 419 1 1 1 1 20 ILE HA A 20 . HA 1 1 419 1 2 1 1 22 ASN H A 22 . HN 1 1 420 1 1 1 1 20 ILE HA A 20 . HA 1 1 420 1 2 1 1 23 SER H A 23 . HN 1 1 421 1 1 1 1 20 ILE HB A 20 . HB 1 1 421 1 2 1 1 20 ILE MD A 20 . HD# 1 1 422 1 1 1 1 20 ILE HB A 20 . HB 1 1 422 1 2 1 1 20 ILE QG A 20 . HG1# 1 1 423 1 1 1 1 20 ILE HB A 20 . HB 1 1 423 1 2 1 1 20 ILE MG A 20 . HG2# 1 1 424 1 1 1 1 20 ILE HB A 20 . HB 1 1 424 1 2 1 1 21 MET H A 21 . HN 1 1 425 1 1 1 1 20 ILE HB A 20 . HB 1 1 425 1 2 1 1 21 MET HA A 21 . HA 1 1 426 1 1 1 1 20 ILE HB A 20 . HB 1 1 426 1 2 1 1 21 MET QG A 21 . HG# 1 1 427 1 1 1 1 20 ILE HB A 20 . HB 1 1 427 1 2 1 1 22 ASN H A 22 . HN 1 1 428 1 1 1 1 20 ILE MD A 20 . HD# 1 1 428 1 2 1 1 20 ILE QG A 20 . HG1# 1 1 429 1 1 1 1 20 ILE MD A 20 . HD# 1 1 429 1 2 1 1 21 MET H A 21 . HN 1 1 430 1 1 1 1 20 ILE MD A 20 . HD# 1 1 430 1 2 2 1 5 TYR HA B 5 . HA 1 1 431 1 1 1 1 20 ILE QG A 20 . HG1# 1 1 431 1 2 1 1 20 ILE MG A 20 . HG2# 1 1 432 1 1 1 1 20 ILE QG A 20 . HG1# 1 1 432 1 2 1 1 21 MET H A 21 . HN 1 1 433 1 1 1 1 20 ILE QG A 20 . HG1# 1 1 433 1 2 1 1 21 MET QB A 21 . HB# 1 1 434 1 1 1 1 20 ILE QG A 20 . HG1# 1 1 434 1 2 2 1 5 TYR QB B 5 . HB# 1 1 435 1 1 1 1 20 ILE QG A 20 . HG1# 1 1 435 1 2 2 1 6 LEU MD1 B 6 . HD1# 1 1 436 1 1 1 1 20 ILE MG A 20 . HG2# 1 1 436 1 2 1 1 21 MET H A 21 . HN 1 1 437 1 1 1 1 20 ILE MG A 20 . HG2# 1 1 437 1 2 1 1 21 MET HA A 21 . HA 1 1 438 1 1 1 1 20 ILE MG A 20 . HG2# 1 1 438 1 2 1 1 21 MET QG A 21 . HG# 1 1 439 1 1 1 1 21 MET H A 21 . HN 1 1 439 1 2 1 1 21 MET QB A 21 . HB# 1 1 440 1 1 1 1 21 MET H A 21 . HN 1 1 440 1 2 1 1 21 MET QG A 21 . HG# 1 1 441 1 1 1 1 21 MET H A 21 . HN 1 1 441 1 2 1 1 22 ASN H A 22 . HN 1 1 442 1 1 1 1 21 MET H A 21 . HN 1 1 442 1 2 1 1 23 SER H A 23 . HN 1 1 443 1 1 1 1 21 MET HA A 21 . HA 1 1 443 1 2 1 1 21 MET QB A 21 . HB# 1 1 444 1 1 1 1 21 MET HA A 21 . HA 1 1 444 1 2 1 1 21 MET QG A 21 . HG# 1 1 445 1 1 1 1 21 MET HA A 21 . HA 1 1 445 1 2 1 1 22 ASN H A 22 . HN 1 1 446 1 1 1 1 21 MET HA A 21 . HA 1 1 446 1 2 1 1 23 SER H A 23 . HN 1 1 447 1 1 1 1 21 MET QB A 21 . HB# 1 1 447 1 2 1 1 21 MET QG A 21 . HG# 1 1 448 1 1 1 1 21 MET QB A 21 . HB# 1 1 448 1 2 1 1 22 ASN H A 22 . HN 1 1 449 1 1 1 1 22 ASN H A 22 . HN 1 1 449 1 2 1 1 22 ASN QB A 22 . HB# 1 1 450 1 1 1 1 22 ASN H A 22 . HN 1 1 450 1 2 1 1 22 ASN QD A 22 . HD2# 1 1 451 1 1 1 1 22 ASN H A 22 . HN 1 1 451 1 2 1 1 23 SER H A 23 . HN 1 1 452 1 1 1 1 22 ASN HA A 22 . HA 1 1 452 1 2 1 1 22 ASN QB A 22 . HB# 1 1 453 1 1 1 1 22 ASN HA A 22 . HA 1 1 453 1 2 1 1 22 ASN QD A 22 . HD2# 1 1 454 1 1 1 1 22 ASN QB A 22 . HB# 1 1 454 1 2 1 1 22 ASN QD A 22 . HD2# 1 1 455 1 1 1 1 23 SER H A 23 . HN 1 1 455 1 2 1 1 23 SER QB A 23 . HB# 1 1 456 1 1 1 1 23 SER HA A 23 . HA 1 1 456 1 2 1 1 23 SER QB A 23 . HB# 1 1 457 1 1 2 1 2 ILE H B 2 . HN 1 1 457 1 2 2 1 3 GLY QA B 3 . HA# 1 1 458 1 1 2 1 2 ILE HA B 2 . HA 1 1 458 1 2 2 1 2 ILE MD B 2 . HD# 1 1 459 1 1 2 1 2 ILE HA B 2 . HA 1 1 459 1 2 2 1 2 ILE QG B 2 . HG1# 1 1 460 1 1 2 1 2 ILE HA B 2 . HA 1 1 460 1 2 2 1 2 ILE MG B 2 . HG2# 1 1 461 1 1 2 1 2 ILE HA B 2 . HA 1 1 461 1 2 2 1 3 GLY H B 3 . HN 1 1 462 1 1 2 1 2 ILE HA B 2 . HA 1 1 462 1 2 2 1 4 LYS H B 4 . HN 1 1 463 1 1 2 1 2 ILE HA B 2 . HA 1 1 463 1 2 2 1 5 TYR H B 5 . HN 1 1 464 1 1 2 1 2 ILE HA B 2 . HA 1 1 464 1 2 2 1 5 TYR QB B 5 . HB# 1 1 465 1 1 2 1 2 ILE HA B 2 . HA 1 1 465 1 2 2 1 6 LEU H B 6 . HN 1 1 466 1 1 2 1 2 ILE HA B 2 . HA 1 1 466 1 2 2 1 6 LEU QD B 6 . HD## 1 1 467 1 1 2 1 2 ILE HB B 2 . HB 1 1 467 1 2 2 1 2 ILE MD B 2 . HD# 1 1 468 1 1 2 1 2 ILE HB B 2 . HB 1 1 468 1 2 2 1 2 ILE QG B 2 . HG1# 1 1 469 1 1 2 1 2 ILE HB B 2 . HB 1 1 469 1 2 2 1 2 ILE MG B 2 . HG2# 1 1 470 1 1 2 1 2 ILE HB B 2 . HB 1 1 470 1 2 2 1 3 GLY H B 3 . HN 1 1 471 1 1 2 1 2 ILE HB B 2 . HB 1 1 471 1 2 2 1 5 TYR QD B 5 . HD# 1 1 472 1 1 2 1 2 ILE HB B 2 . HB 1 1 472 1 2 2 1 6 LEU QD B 6 . HD## 1 1 473 1 1 2 1 2 ILE MD B 2 . HD# 1 1 473 1 2 2 1 5 TYR QD B 5 . HD# 1 1 474 1 1 2 1 2 ILE QG B 2 . HG1# 1 1 474 1 2 2 1 2 ILE MG B 2 . HG2# 1 1 475 1 1 2 1 2 ILE QG B 2 . HG## 1 1 475 1 1 2 1 2 ILE MG B 2 . HG## 1 1 475 1 2 2 1 5 TYR QD B 5 . HD# 1 1 476 1 1 2 1 2 ILE QG B 2 . HG## 1 1 476 1 1 2 1 2 ILE MG B 2 . HG## 1 1 476 1 2 2 1 5 TYR QE B 5 . HE# 1 1 477 1 1 2 1 2 ILE QG B 2 . HG1# 1 1 477 1 2 2 1 3 GLY QA B 3 . HA# 1 1 478 1 1 2 1 2 ILE QG B 2 . HG1# 1 1 478 1 2 2 1 6 LEU QD B 6 . HD## 1 1 479 1 1 2 1 2 ILE MG B 2 . HG2# 1 1 479 1 2 2 1 3 GLY H B 3 . HN 1 1 480 1 1 2 1 2 ILE MG B 2 . HG2# 1 1 480 1 2 2 1 3 GLY QA B 3 . HA# 1 1 481 1 1 2 1 2 ILE MG B 2 . HG2# 1 1 481 1 2 2 1 4 LYS H B 4 . HN 1 1 482 1 1 2 1 2 ILE MG B 2 . HG2# 1 1 482 1 2 2 1 5 TYR QB B 5 . HB# 1 1 483 1 1 2 1 2 ILE MG B 2 . HG2# 1 1 483 1 2 2 1 5 TYR QD B 5 . HD# 1 1 484 1 1 2 1 2 ILE MG B 2 . HG2# 1 1 484 1 2 2 1 5 TYR QE B 5 . HE# 1 1 485 1 1 2 1 2 ILE MG B 2 . HG2# 1 1 485 1 2 2 1 6 LEU H B 6 . HN 1 1 486 1 1 2 1 3 GLY H B 3 . HN 1 1 486 1 2 2 1 4 LYS H B 4 . HN 1 1 487 1 1 2 1 3 GLY H B 3 . HN 1 1 487 1 2 2 1 4 LYS HA B 4 . HA 1 1 488 1 1 2 1 3 GLY H B 3 . HN 1 1 488 1 2 2 1 4 LYS QB B 4 . HB# 1 1 489 1 1 2 1 3 GLY H B 3 . HN 1 1 489 1 2 2 1 5 TYR H B 5 . HN 1 1 490 1 1 2 1 3 GLY H B 3 . HN 1 1 490 1 2 2 1 6 LEU QB B 6 . HB# 1 1 491 1 1 2 1 3 GLY H B 3 . HN 1 1 491 1 2 2 1 6 LEU QD B 6 . HD## 1 1 492 1 1 2 1 3 GLY H B 3 . HN 1 1 492 1 2 2 1 6 LEU MD2 B 6 . HD2# 1 1 493 1 1 2 1 3 GLY QA B 3 . HA# 1 1 493 1 2 2 1 4 LYS H B 4 . HN 1 1 494 1 1 2 1 3 GLY QA B 3 . HA# 1 1 494 1 2 2 1 4 LYS QB B 4 . HB# 1 1 495 1 1 2 1 3 GLY QA B 3 . HA# 1 1 495 1 2 2 1 5 TYR H B 5 . HN 1 1 496 1 1 2 1 3 GLY QA B 3 . HA# 1 1 496 1 2 2 1 6 LEU H B 6 . HN 1 1 497 1 1 2 1 3 GLY QA B 3 . HA# 1 1 497 1 2 2 1 6 LEU QB B 6 . HB# 1 1 498 1 1 2 1 3 GLY QA B 3 . HA# 1 1 498 1 2 2 1 6 LEU QD B 6 . HD## 1 1 499 1 1 2 1 3 GLY QA B 3 . HA# 1 1 499 1 2 2 1 6 LEU HG B 6 . HG 1 1 500 1 1 2 1 3 GLY QA B 3 . HA# 1 1 500 1 2 2 1 7 HIS H B 7 . HN 1 1 501 1 1 2 1 4 LYS H B 4 . HN 1 1 501 1 2 2 1 4 LYS QB B 4 . HB# 1 1 502 1 1 2 1 4 LYS H B 4 . HN 1 1 502 1 2 2 1 4 LYS QG B 4 . HG# 1 1 503 1 1 2 1 4 LYS H B 4 . HN 1 1 503 1 2 2 1 5 TYR H B 5 . HN 1 1 504 1 1 2 1 4 LYS H B 4 . HN 1 1 504 1 2 2 1 5 TYR HA B 5 . HA 1 1 505 1 1 2 1 4 LYS H B 4 . HN 1 1 505 1 2 2 1 5 TYR QD B 5 . HD# 1 1 506 1 1 2 1 4 LYS H B 4 . HN 1 1 506 1 2 2 1 5 TYR QE B 5 . HE# 1 1 507 1 1 2 1 4 LYS H B 4 . HN 1 1 507 1 2 2 1 6 LEU H B 6 . HN 1 1 508 1 1 2 1 4 LYS HA B 4 . HA 1 1 508 1 2 2 1 4 LYS QB B 4 . HB# 1 1 509 1 1 2 1 4 LYS HA B 4 . HA 1 1 509 1 2 2 1 4 LYS QE B 4 . HE# 1 1 510 1 1 2 1 4 LYS HA B 4 . HA 1 1 510 1 2 2 1 4 LYS QG B 4 . HG# 1 1 511 1 1 2 1 4 LYS HA B 4 . HA 1 1 511 1 2 2 1 5 TYR H B 5 . HN 1 1 512 1 1 2 1 4 LYS HA B 4 . HA 1 1 512 1 2 2 1 6 LEU H B 6 . HN 1 1 513 1 1 2 1 4 LYS HA B 4 . HA 1 1 513 1 2 2 1 7 HIS H B 7 . HN 1 1 514 1 1 2 1 4 LYS HA B 4 . HA 1 1 514 1 2 2 1 7 HIS QB B 7 . HB# 1 1 515 1 1 2 1 4 LYS HA B 4 . HA 1 1 515 1 2 2 1 7 HIS HD2 B 7 . HD2 1 1 516 1 1 2 1 4 LYS QB B 4 . HB# 1 1 516 1 2 2 1 4 LYS QE B 4 . HE# 1 1 517 1 1 2 1 4 LYS QB B 4 . HB# 1 1 517 1 2 2 1 4 LYS QG B 4 . HG# 1 1 518 1 1 2 1 4 LYS QB B 4 . HB# 1 1 518 1 2 2 1 5 TYR H B 5 . HN 1 1 519 1 1 2 1 4 LYS QB B 4 . HB# 1 1 519 1 2 2 1 5 TYR HA B 5 . HA 1 1 520 1 1 2 1 4 LYS QB B 4 . HB# 1 1 520 1 2 2 1 5 TYR QB B 5 . HB# 1 1 521 1 1 2 1 4 LYS QB B 4 . HB# 1 1 521 1 2 2 1 5 TYR QD B 5 . HD# 1 1 522 1 1 2 1 4 LYS QB B 4 . HB# 1 1 522 1 2 2 1 5 TYR QE B 5 . HE# 1 1 523 1 1 2 1 4 LYS QB B 4 . HB# 1 1 523 1 2 2 1 7 HIS H B 7 . HN 1 1 524 1 1 2 1 4 LYS QB B 4 . HB# 1 1 524 1 2 2 1 7 HIS QB B 7 . HB# 1 1 525 1 1 2 1 4 LYS QB B 4 . HB# 1 1 525 1 2 2 1 7 HIS HD2 B 7 . HD2 1 1 526 1 1 2 1 4 LYS QE B 4 . HE# 1 1 526 1 2 2 1 4 LYS QG B 4 . HG# 1 1 527 1 1 2 1 4 LYS QG B 4 . HG# 1 1 527 1 2 2 1 5 TYR H B 5 . HN 1 1 528 1 1 2 1 4 LYS QG B 4 . HG# 1 1 528 1 2 2 1 5 TYR HA B 5 . HA 1 1 529 1 1 2 1 4 LYS QG B 4 . HG# 1 1 529 1 2 2 1 5 TYR QB B 5 . HB# 1 1 530 1 1 2 1 4 LYS QG B 4 . HG# 1 1 530 1 2 2 1 5 TYR QD B 5 . HD# 1 1 531 1 1 2 1 4 LYS QG B 4 . HG# 1 1 531 1 2 2 1 5 TYR QE B 5 . HE# 1 1 532 1 1 2 1 4 LYS QG B 4 . HG# 1 1 532 1 2 2 1 6 LEU H B 6 . HN 1 1 533 1 1 2 1 4 LYS QG B 4 . HG# 1 1 533 1 2 2 1 7 HIS HD2 B 7 . HD2 1 1 534 1 1 2 1 5 TYR H B 5 . HN 1 1 534 1 2 2 1 5 TYR QB B 5 . HB# 1 1 535 1 1 2 1 5 TYR H B 5 . HN 1 1 535 1 2 2 1 6 LEU H B 6 . HN 1 1 536 1 1 2 1 5 TYR H B 5 . HN 1 1 536 1 2 2 1 7 HIS H B 7 . HN 1 1 537 1 1 2 1 5 TYR HA B 5 . HA 1 1 537 1 2 2 1 5 TYR QB B 5 . HB# 1 1 538 1 1 2 1 5 TYR HA B 5 . HA 1 1 538 1 2 2 1 5 TYR QD B 5 . HD# 1 1 539 1 1 2 1 5 TYR HA B 5 . HA 1 1 539 1 2 2 1 6 LEU H B 6 . HN 1 1 540 1 1 2 1 5 TYR HA B 5 . HA 1 1 540 1 2 2 1 6 LEU QD B 6 . HD## 1 1 541 1 1 2 1 5 TYR HA B 5 . HA 1 1 541 1 2 2 1 7 HIS H B 7 . HN 1 1 542 1 1 2 1 5 TYR HA B 5 . HA 1 1 542 1 2 2 1 8 SER H B 8 . HN 1 1 543 1 1 2 1 5 TYR HA B 5 . HA 1 1 543 1 2 2 1 8 SER QB B 8 . HB# 1 1 544 1 1 2 1 5 TYR HA B 5 . HA 1 1 544 1 2 2 1 9 ALA H B 9 . HN 1 1 545 1 1 2 1 5 TYR QB B 5 . HB# 1 1 545 1 2 2 1 5 TYR QD B 5 . HD# 1 1 546 1 1 2 1 5 TYR QB B 5 . HB# 1 1 546 1 2 2 1 6 LEU H B 6 . HN 1 1 547 1 1 2 1 5 TYR QB B 5 . HB# 1 1 547 1 2 2 1 6 LEU QB B 6 . HB# 1 1 548 1 1 2 1 5 TYR QB B 5 . HB# 1 1 548 1 2 2 1 6 LEU QD B 6 . HD## 1 1 549 1 1 2 1 5 TYR QB B 5 . HB# 1 1 549 1 2 2 1 9 ALA MB B 9 . HB# 1 1 550 1 1 2 1 5 TYR QD B 5 . HD# 1 1 550 1 2 2 1 6 LEU H B 6 . HN 1 1 551 1 1 2 1 5 TYR QD B 5 . HD# 1 1 551 1 2 2 1 6 LEU QB B 6 . HB# 1 1 552 1 1 2 1 5 TYR QD B 5 . HD# 1 1 552 1 2 2 1 6 LEU QD B 6 . HD## 1 1 553 1 1 2 1 5 TYR QD B 5 . HD# 1 1 553 1 2 2 1 8 SER QB B 8 . HB# 1 1 554 1 1 2 1 6 LEU H B 6 . HN 1 1 554 1 2 2 1 6 LEU QB B 6 . HB# 1 1 555 1 1 2 1 6 LEU H B 6 . HN 1 1 555 1 2 2 1 6 LEU QD B 6 . HD## 1 1 556 1 1 2 1 6 LEU H B 6 . HN 1 1 556 1 2 2 1 6 LEU HG B 6 . HG 1 1 557 1 1 2 1 6 LEU H B 6 . HN 1 1 557 1 2 2 1 7 HIS H B 7 . HN 1 1 558 1 1 2 1 6 LEU HA B 6 . HA 1 1 558 1 2 2 1 6 LEU QB B 6 . HB# 1 1 559 1 1 2 1 6 LEU HA B 6 . HA 1 1 559 1 2 2 1 6 LEU QD B 6 . HD## 1 1 560 1 1 2 1 6 LEU HA B 6 . HA 1 1 560 1 2 2 1 6 LEU HG B 6 . HG 1 1 561 1 1 2 1 6 LEU HA B 6 . HA 1 1 561 1 2 2 1 7 HIS H B 7 . HN 1 1 562 1 1 2 1 6 LEU HA B 6 . HA 1 1 562 1 2 2 1 8 SER H B 8 . HN 1 1 563 1 1 2 1 6 LEU HA B 6 . HA 1 1 563 1 2 2 1 9 ALA H B 9 . HN 1 1 564 1 1 2 1 6 LEU HA B 6 . HA 1 1 564 1 2 2 1 9 ALA MB B 9 . HB# 1 1 565 1 1 2 1 6 LEU HA B 6 . HA 1 1 565 1 2 2 1 10 LYS H B 10 . HN 1 1 566 1 1 2 1 6 LEU QB B 6 . HB# 1 1 566 1 2 2 1 6 LEU QD B 6 . HD## 1 1 567 1 1 2 1 6 LEU QB B 6 . HB# 1 1 567 1 2 2 1 7 HIS HD2 B 7 . HD2 1 1 568 1 1 2 1 6 LEU MD1 B 6 . HD1# 1 1 568 1 2 2 1 6 LEU MD2 B 6 . HD2# 1 1 569 1 1 2 1 6 LEU QD B 6 . HD## 1 1 569 1 2 2 1 7 HIS HD2 B 7 . HD2 1 1 570 1 1 2 1 6 LEU QD B 6 . HD## 1 1 570 1 2 2 1 9 ALA MB B 9 . HB# 1 1 571 1 1 2 1 6 LEU QD B 6 . HD## 1 1 571 1 2 2 1 10 LYS H B 10 . HN 1 1 572 1 1 2 1 6 LEU QD B 6 . HD## 1 1 572 1 2 2 1 10 LYS QB B 10 . HB# 1 1 573 1 1 2 1 6 LEU QD B 6 . HD## 1 1 573 1 2 2 1 10 LYS QE B 10 . HE# 1 1 574 1 1 2 1 6 LEU HG B 6 . HG 1 1 574 1 2 2 1 7 HIS HE1 B 7 . HE1 1 1 575 1 1 2 1 7 HIS H B 7 . HN 1 1 575 1 2 2 1 7 HIS QB B 7 . HB# 1 1 576 1 1 2 1 7 HIS H B 7 . HN 1 1 576 1 2 2 1 8 SER H B 8 . HN 1 1 577 1 1 2 1 7 HIS H B 7 . HN 1 1 577 1 2 2 1 8 SER QB B 8 . HB# 1 1 578 1 1 2 1 7 HIS H B 7 . HN 1 1 578 1 2 2 1 9 ALA H B 9 . HN 1 1 579 1 1 2 1 7 HIS HA B 7 . HA 1 1 579 1 2 2 1 8 SER H B 8 . HN 1 1 580 1 1 2 1 7 HIS HA B 7 . HA 1 1 580 1 2 2 1 9 ALA H B 9 . HN 1 1 581 1 1 2 1 7 HIS HA B 7 . HA 1 1 581 1 2 2 1 10 LYS QB B 10 . HB# 1 1 582 1 1 2 1 7 HIS QB B 7 . HB# 1 1 582 1 2 2 1 11 LYS QG B 11 . HG# 1 1 583 1 1 2 1 8 SER H B 8 . HN 1 1 583 1 2 2 1 8 SER QB B 8 . HB# 1 1 584 1 1 2 1 8 SER H B 8 . HN 1 1 584 1 2 2 1 9 ALA H B 9 . HN 1 1 585 1 1 2 1 8 SER HA B 8 . HA 1 1 585 1 2 2 1 8 SER QB B 8 . HB# 1 1 586 1 1 2 1 8 SER HA B 8 . HA 1 1 586 1 2 2 1 9 ALA H B 9 . HN 1 1 587 1 1 2 1 8 SER HA B 8 . HA 1 1 587 1 2 2 1 10 LYS H B 10 . HN 1 1 588 1 1 2 1 8 SER HA B 8 . HA 1 1 588 1 2 2 1 11 LYS H B 11 . HN 1 1 589 1 1 2 1 8 SER HA B 8 . HA 1 1 589 1 2 2 1 11 LYS QB B 11 . HB# 1 1 590 1 1 2 1 8 SER HA B 8 . HA 1 1 590 1 2 2 1 12 PHE H B 12 . HN 1 1 591 1 1 2 1 9 ALA H B 9 . HN 1 1 591 1 2 2 1 9 ALA MB B 9 . HB# 1 1 592 1 1 2 1 9 ALA H B 9 . HN 1 1 592 1 2 2 1 10 LYS H B 10 . HN 1 1 593 1 1 2 1 9 ALA H B 9 . HN 1 1 593 1 2 2 1 10 LYS QB B 10 . HB# 1 1 594 1 1 2 1 9 ALA H B 9 . HN 1 1 594 1 2 2 1 11 LYS H B 11 . HN 1 1 595 1 1 2 1 9 ALA HA B 9 . HA 1 1 595 1 2 2 1 9 ALA MB B 9 . HB# 1 1 596 1 1 2 1 9 ALA HA B 9 . HA 1 1 596 1 2 2 1 10 LYS H B 10 . HN 1 1 597 1 1 2 1 9 ALA HA B 9 . HA 1 1 597 1 2 2 1 11 LYS H B 11 . HN 1 1 598 1 1 2 1 9 ALA HA B 9 . HA 1 1 598 1 2 2 1 12 PHE H B 12 . HN 1 1 599 1 1 2 1 9 ALA HA B 9 . HA 1 1 599 1 2 2 1 12 PHE QB B 12 . HB# 1 1 600 1 1 2 1 9 ALA HA B 9 . HA 1 1 600 1 2 2 1 12 PHE QD B 12 . HD# 1 1 601 1 1 2 1 9 ALA HA B 9 . HA 1 1 601 1 2 2 1 13 GLY H B 13 . HN 1 1 602 1 1 2 1 9 ALA MB B 9 . HB# 1 1 602 1 2 2 1 10 LYS H B 10 . HN 1 1 603 1 1 2 1 9 ALA MB B 9 . HB# 1 1 603 1 2 2 1 12 PHE QB B 12 . HB# 1 1 604 1 1 2 1 9 ALA MB B 9 . HB# 1 1 604 1 2 2 1 13 GLY H B 13 . HN 1 1 605 1 1 2 1 10 LYS H B 10 . HN 1 1 605 1 2 2 1 10 LYS QB B 10 . HB# 1 1 606 1 1 2 1 10 LYS H B 10 . HN 1 1 606 1 2 2 1 11 LYS H B 11 . HN 1 1 607 1 1 2 1 10 LYS H B 10 . HN 1 1 607 1 2 2 1 12 PHE H B 12 . HN 1 1 608 1 1 2 1 10 LYS HA B 10 . HA 1 1 608 1 2 2 1 10 LYS QB B 10 . HB# 1 1 609 1 1 2 1 10 LYS HA B 10 . HA 1 1 609 1 2 2 1 10 LYS QG B 10 . HG# 1 1 610 1 1 2 1 10 LYS HA B 10 . HA 1 1 610 1 2 2 1 11 LYS H B 11 . HN 1 1 611 1 1 2 1 10 LYS HA B 10 . HA 1 1 611 1 2 2 1 12 PHE H B 12 . HN 1 1 612 1 1 2 1 10 LYS HA B 10 . HA 1 1 612 1 2 2 1 13 GLY H B 13 . HN 1 1 613 1 1 2 1 10 LYS HA B 10 . HA 1 1 613 1 2 2 1 14 LYS H B 14 . HN 1 1 614 1 1 2 1 10 LYS HA B 10 . HA 1 1 614 1 2 2 1 14 LYS QG B 14 . HG# 1 1 615 1 1 2 1 10 LYS QB B 10 . HB# 1 1 615 1 2 2 1 10 LYS QE B 10 . HE# 1 1 616 1 1 2 1 10 LYS QB B 10 . HB# 1 1 616 1 2 2 1 10 LYS QG B 10 . HG# 1 1 617 1 1 2 1 10 LYS QB B 10 . HB# 1 1 617 1 2 2 1 11 LYS H B 11 . HN 1 1 618 1 1 2 1 10 LYS QB B 10 . HB# 1 1 618 1 2 2 1 13 GLY H B 13 . HN 1 1 619 1 1 2 1 10 LYS QB B 10 . HB# 1 1 619 1 2 2 1 13 GLY QA B 13 . HA# 1 1 620 1 1 2 1 10 LYS QB B 10 . HB# 1 1 620 1 2 2 1 14 LYS H B 14 . HN 1 1 621 1 1 2 1 10 LYS QB B 10 . HB# 1 1 621 1 2 2 1 14 LYS QB B 14 . HB# 1 1 622 1 1 2 1 10 LYS QB B 10 . HB# 1 1 622 1 2 2 1 14 LYS QG B 14 . HG# 1 1 623 1 1 2 1 10 LYS QE B 10 . HE# 1 1 623 1 2 2 1 10 LYS QG B 10 . HG# 1 1 624 1 1 2 1 10 LYS QE B 10 . HE# 1 1 624 1 2 2 1 11 LYS QG B 11 . HG# 1 1 625 1 1 2 1 10 LYS HG3 B 10 . HG1 1 1 625 1 2 2 1 13 GLY QA B 13 . HA# 1 1 626 1 1 2 1 11 LYS H B 11 . HN 1 1 626 1 2 2 1 11 LYS QB B 11 . HB# 1 1 627 1 1 2 1 11 LYS H B 11 . HN 1 1 627 1 2 2 1 11 LYS QE B 11 . HE# 1 1 628 1 1 2 1 11 LYS H B 11 . HN 1 1 628 1 2 2 1 11 LYS QG B 11 . HG# 1 1 629 1 1 2 1 11 LYS H B 11 . HN 1 1 629 1 2 2 1 12 PHE H B 12 . HN 1 1 630 1 1 2 1 11 LYS H B 11 . HN 1 1 630 1 2 2 1 12 PHE QB B 12 . HB# 1 1 631 1 1 2 1 11 LYS H B 11 . HN 1 1 631 1 2 2 1 13 GLY H B 13 . HN 1 1 632 1 1 2 1 11 LYS HA B 11 . HA 1 1 632 1 2 2 1 11 LYS QB B 11 . HB# 1 1 633 1 1 2 1 11 LYS HA B 11 . HA 1 1 633 1 2 2 1 11 LYS QE B 11 . HE# 1 1 634 1 1 2 1 11 LYS HA B 11 . HA 1 1 634 1 2 2 1 11 LYS QG B 11 . HG# 1 1 635 1 1 2 1 11 LYS HA B 11 . HA 1 1 635 1 2 2 1 12 PHE H B 12 . HN 1 1 636 1 1 2 1 11 LYS HA B 11 . HA 1 1 636 1 2 2 1 13 GLY H B 13 . HN 1 1 637 1 1 2 1 11 LYS HA B 11 . HA 1 1 637 1 2 2 1 14 LYS H B 14 . HN 1 1 638 1 1 2 1 11 LYS HA B 11 . HA 1 1 638 1 2 2 1 14 LYS QB B 14 . HB# 1 1 639 1 1 2 1 11 LYS HA B 11 . HA 1 1 639 1 2 2 1 14 LYS QE B 14 . HE# 1 1 640 1 1 2 1 11 LYS HA B 11 . HA 1 1 640 1 2 2 1 15 ALA H B 15 . HN 1 1 641 1 1 2 1 11 LYS HA B 11 . HA 1 1 641 1 2 2 1 15 ALA MB B 15 . HB# 1 1 642 1 1 2 1 11 LYS QB B 11 . HB# 1 1 642 1 2 2 1 11 LYS QE B 11 . HE# 1 1 643 1 1 2 1 11 LYS QB B 11 . HB# 1 1 643 1 2 2 1 11 LYS QG B 11 . HG# 1 1 644 1 1 2 1 11 LYS QB B 11 . HB# 1 1 644 1 2 2 1 12 PHE H B 12 . HN 1 1 645 1 1 2 1 11 LYS QB B 11 . HB# 1 1 645 1 2 2 1 14 LYS HB2 B 14 . HB2 1 1 646 1 1 2 1 11 LYS QD B 11 . HD# 1 1 646 1 2 2 1 11 LYS QG B 11 . HG# 1 1 647 1 1 2 1 11 LYS QE B 11 . HE# 1 1 647 1 2 2 1 11 LYS QG B 11 . HG# 1 1 648 1 1 2 1 11 LYS QE B 11 . HE# 1 1 648 1 2 2 1 15 ALA MB B 15 . HB# 1 1 649 1 1 2 1 11 LYS QG B 11 . HG# 1 1 649 1 2 2 1 12 PHE H B 12 . HN 1 1 650 1 1 2 1 12 PHE H B 12 . HN 1 1 650 1 2 2 1 12 PHE QB B 12 . HB# 1 1 651 1 1 2 1 12 PHE H B 12 . HN 1 1 651 1 2 2 1 13 GLY H B 13 . HN 1 1 652 1 1 2 1 12 PHE H B 12 . HN 1 1 652 1 2 2 1 14 LYS H B 14 . HN 1 1 653 1 1 2 1 12 PHE H B 12 . HN 1 1 653 1 2 2 1 16 TRP HD1 B 16 . HD1 1 1 654 1 1 2 1 12 PHE HA B 12 . HA 1 1 654 1 2 2 1 12 PHE QB B 12 . HB# 1 1 655 1 1 2 1 12 PHE HA B 12 . HA 1 1 655 1 2 2 1 12 PHE QD B 12 . HD# 1 1 656 1 1 2 1 12 PHE HA B 12 . HA 1 1 656 1 2 2 1 13 GLY H B 13 . HN 1 1 657 1 1 2 1 12 PHE HA B 12 . HA 1 1 657 1 2 2 1 14 LYS H B 14 . HN 1 1 658 1 1 2 1 12 PHE HA B 12 . HA 1 1 658 1 2 2 1 15 ALA H B 15 . HN 1 1 659 1 1 2 1 12 PHE HA B 12 . HA 1 1 659 1 2 2 1 15 ALA MB B 15 . HB# 1 1 660 1 1 2 1 12 PHE HA B 12 . HA 1 1 660 1 2 2 1 16 TRP H B 16 . HN 1 1 661 1 1 2 1 12 PHE QB B 12 . HB# 1 1 661 1 2 2 1 12 PHE QD B 12 . HD# 1 1 662 1 1 2 1 12 PHE QB B 12 . HB# 1 1 662 1 2 2 1 13 GLY H B 13 . HN 1 1 663 1 1 2 1 12 PHE QB B 12 . HB# 1 1 663 1 2 2 1 13 GLY QA B 13 . HA# 1 1 664 1 1 2 1 12 PHE QB B 12 . HB# 1 1 664 1 2 2 1 16 TRP HA B 16 . HA 1 1 665 1 1 2 1 12 PHE QB B 12 . HB# 1 1 665 1 2 2 1 16 TRP HD1 B 16 . HD1 1 1 666 1 1 2 1 13 GLY H B 13 . HN 1 1 666 1 2 2 1 14 LYS H B 14 . HN 1 1 667 1 1 2 1 13 GLY QA B 13 . HA# 1 1 667 1 2 2 1 14 LYS H B 14 . HN 1 1 668 1 1 2 1 13 GLY QA B 13 . HA# 1 1 668 1 2 2 1 14 LYS QB B 14 . HB# 1 1 669 1 1 2 1 13 GLY QA B 13 . HA# 1 1 669 1 2 2 1 15 ALA H B 15 . HN 1 1 670 1 1 2 1 13 GLY QA B 13 . HA# 1 1 670 1 2 2 1 16 TRP H B 16 . HN 1 1 671 1 1 2 1 13 GLY QA B 13 . HA# 1 1 671 1 2 2 1 16 TRP QB B 16 . HB# 1 1 672 1 1 2 1 13 GLY QA B 13 . HA# 1 1 672 1 2 2 1 16 TRP HD1 B 16 . HD1 1 1 673 1 1 2 1 13 GLY QA B 13 . HA# 1 1 673 1 2 2 1 16 TRP HE3 B 16 . HE3 1 1 674 1 1 2 1 13 GLY QA B 13 . HA# 1 1 674 1 2 2 1 17 VAL H B 17 . HN 1 1 675 1 1 2 1 13 GLY QA B 13 . HA# 1 1 675 1 2 2 1 17 VAL QG B 17 . HG## 1 1 676 1 1 2 1 14 LYS H B 14 . HN 1 1 676 1 2 2 1 14 LYS QB B 14 . HB# 1 1 677 1 1 2 1 14 LYS H B 14 . HN 1 1 677 1 2 2 1 14 LYS QD B 14 . HD# 1 1 678 1 1 2 1 14 LYS H B 14 . HN 1 1 678 1 2 2 1 14 LYS QG B 14 . HG# 1 1 679 1 1 2 1 14 LYS H B 14 . HN 1 1 679 1 2 2 1 15 ALA H B 15 . HN 1 1 680 1 1 2 1 14 LYS H B 14 . HN 1 1 680 1 2 2 1 17 VAL QG B 17 . HG## 1 1 681 1 1 2 1 14 LYS HA B 14 . HA 1 1 681 1 2 2 1 14 LYS QB B 14 . HB# 1 1 682 1 1 2 1 14 LYS HA B 14 . HA 1 1 682 1 2 2 1 14 LYS QG B 14 . HG# 1 1 683 1 1 2 1 14 LYS HA B 14 . HA 1 1 683 1 2 2 1 15 ALA H B 15 . HN 1 1 684 1 1 2 1 14 LYS HA B 14 . HA 1 1 684 1 2 2 1 16 TRP H B 16 . HN 1 1 685 1 1 2 1 14 LYS HA B 14 . HA 1 1 685 1 2 2 1 17 VAL H B 17 . HN 1 1 686 1 1 2 1 14 LYS HA B 14 . HA 1 1 686 1 2 2 1 17 VAL HB B 17 . HB 1 1 687 1 1 2 1 14 LYS HA B 14 . HA 1 1 687 1 2 2 1 17 VAL QG B 17 . HG# 1 1 688 1 1 2 1 14 LYS HA B 14 . HA 1 1 688 1 2 2 1 18 GLY H B 18 . HN 1 1 689 1 1 2 1 14 LYS QB B 14 . HB# 1 1 689 1 2 2 1 14 LYS QE B 14 . HE# 1 1 690 1 1 2 1 14 LYS QB B 14 . HB# 1 1 690 1 2 2 1 14 LYS QG B 14 . HG# 1 1 691 1 1 2 1 14 LYS QB B 14 . HB# 1 1 691 1 2 2 1 15 ALA H B 15 . HN 1 1 692 1 1 2 1 14 LYS QB B 14 . HB# 1 1 692 1 2 2 1 15 ALA HA B 15 . HA 1 1 693 1 1 2 1 14 LYS QB B 14 . HB# 1 1 693 1 2 2 1 17 VAL QG B 17 . HG## 1 1 694 1 1 2 1 14 LYS QE B 14 . HE# 1 1 694 1 2 2 1 14 LYS QG B 14 . HG# 1 1 695 1 1 2 1 14 LYS QE B 14 . HE# 1 1 695 1 2 2 1 17 VAL HB B 17 . HB 1 1 696 1 1 2 1 14 LYS QE B 14 . HE# 1 1 696 1 2 2 1 17 VAL QG B 17 . HG# 1 1 697 1 1 2 1 15 ALA H B 15 . HN 1 1 697 1 2 2 1 15 ALA MB B 15 . HB# 1 1 698 1 1 2 1 15 ALA H B 15 . HN 1 1 698 1 2 2 1 16 TRP H B 16 . HN 1 1 699 1 1 2 1 15 ALA H B 15 . HN 1 1 699 1 2 2 1 16 TRP QB B 16 . HB# 1 1 700 1 1 2 1 15 ALA H B 15 . HN 1 1 700 1 2 2 1 17 VAL H B 17 . HN 1 1 701 1 1 2 1 15 ALA HA B 15 . HA 1 1 701 1 2 2 1 15 ALA MB B 15 . HB# 1 1 702 1 1 2 1 15 ALA HA B 15 . HA 1 1 702 1 2 2 1 16 TRP H B 16 . HN 1 1 703 1 1 2 1 15 ALA HA B 15 . HA 1 1 703 1 2 2 1 17 VAL H B 17 . HN 1 1 704 1 1 2 1 15 ALA HA B 15 . HA 1 1 704 1 2 2 1 18 GLY H B 18 . HN 1 1 705 1 1 2 1 15 ALA HA B 15 . HA 1 1 705 1 2 2 1 19 GLU H B 19 . HN 1 1 706 1 1 2 1 15 ALA MB B 15 . HB# 1 1 706 1 2 2 1 16 TRP H B 16 . HN 1 1 707 1 1 2 1 15 ALA MB B 15 . HB# 1 1 707 1 2 2 1 16 TRP HA B 16 . HA 1 1 708 1 1 2 1 15 ALA MB B 15 . HB# 1 1 708 1 2 2 1 16 TRP QB B 16 . HB# 1 1 709 1 1 2 1 15 ALA MB B 15 . HB# 1 1 709 1 2 2 1 16 TRP HD1 B 16 . HD1 1 1 710 1 1 2 1 15 ALA MB B 15 . HB# 1 1 710 1 2 2 1 19 GLU QB B 19 . HB# 1 1 711 1 1 2 1 15 ALA MB B 15 . HB# 1 1 711 1 2 2 1 19 GLU QG B 19 . HG# 1 1 712 1 1 2 1 16 TRP H B 16 . HN 1 1 712 1 2 2 1 16 TRP QB B 16 . HB# 1 1 713 1 1 2 1 16 TRP H B 16 . HN 1 1 713 1 2 2 1 16 TRP HE3 B 16 . HE3 1 1 714 1 1 2 1 16 TRP H B 16 . HN 1 1 714 1 2 2 1 17 VAL H B 17 . HN 1 1 715 1 1 2 1 16 TRP H B 16 . HN 1 1 715 1 2 2 1 17 VAL HB B 17 . HB 1 1 716 1 1 2 1 16 TRP H B 16 . HN 1 1 716 1 2 2 1 17 VAL QG B 17 . HG## 1 1 717 1 1 2 1 16 TRP H B 16 . HN 1 1 717 1 2 2 1 18 GLY H B 18 . HN 1 1 718 1 1 2 1 16 TRP H B 16 . HN 1 1 718 1 2 2 1 19 GLU QB B 19 . HB# 1 1 719 1 1 2 1 16 TRP HA B 16 . HA 1 1 719 1 2 2 1 16 TRP QB B 16 . HB# 1 1 720 1 1 2 1 16 TRP HA B 16 . HA 1 1 720 1 2 2 1 16 TRP HE3 B 16 . HE3 1 1 721 1 1 2 1 16 TRP HA B 16 . HA 1 1 721 1 2 2 1 17 VAL H B 17 . HN 1 1 722 1 1 2 1 16 TRP HA B 16 . HA 1 1 722 1 2 2 1 18 GLY H B 18 . HN 1 1 723 1 1 2 1 16 TRP HA B 16 . HA 1 1 723 1 2 2 1 19 GLU H B 19 . HN 1 1 724 1 1 2 1 16 TRP HA B 16 . HA 1 1 724 1 2 2 1 19 GLU QB B 19 . HB# 1 1 725 1 1 2 1 16 TRP HA B 16 . HA 1 1 725 1 2 2 1 19 GLU QG B 19 . HG# 1 1 726 1 1 2 1 16 TRP QB B 16 . HB# 1 1 726 1 2 2 1 17 VAL H B 17 . HN 1 1 727 1 1 2 1 16 TRP QB B 16 . HB# 1 1 727 1 2 2 1 17 VAL HB B 17 . HB 1 1 728 1 1 2 1 16 TRP QB B 16 . HB# 1 1 728 1 2 2 1 17 VAL QG B 17 . HG## 1 1 729 1 1 2 1 16 TRP QB B 16 . HB# 1 1 729 1 2 2 1 19 GLU QG B 19 . HG# 1 1 730 1 1 2 1 16 TRP QB B 16 . HB# 1 1 730 1 2 2 1 20 ILE QG B 20 . HG## 1 1 730 1 2 2 1 20 ILE MG B 20 . HG## 1 1 731 1 1 2 1 16 TRP HE3 B 16 . HE3 1 1 731 1 2 2 1 17 VAL HA B 17 . HA 1 1 732 1 1 2 1 16 TRP HE3 B 16 . HE3 1 1 732 1 2 2 1 17 VAL QG B 17 . HG## 1 1 733 1 1 2 1 16 TRP HE3 B 16 . HE3 1 1 733 1 2 2 1 19 GLU QG B 19 . HG# 1 1 734 1 1 2 1 16 TRP HE3 B 16 . HE3 1 1 734 1 2 2 1 20 ILE HA B 20 . HA 1 1 735 1 1 2 1 16 TRP HE3 B 16 . HE3 1 1 735 1 2 2 1 21 MET H B 21 . HN 1 1 736 1 1 2 1 16 TRP HH2 B 16 . HH2 1 1 736 1 2 2 1 17 VAL HB B 17 . HB 1 1 737 1 1 2 1 16 TRP HH2 B 16 . HH2 1 1 737 1 2 2 1 20 ILE MG B 20 . HG2# 1 1 738 1 1 2 1 16 TRP HH2 B 16 . HH2 1 1 738 1 2 2 1 21 MET HA B 21 . HA 1 1 739 1 1 2 1 16 TRP HZ3 B 16 . HZ3 1 1 739 1 2 2 1 17 VAL QG B 17 . HG## 1 1 740 1 1 2 1 16 TRP HZ3 B 16 . HZ3 1 1 740 1 2 2 1 19 GLU QB B 19 . HB# 1 1 741 1 1 2 1 16 TRP HZ3 B 16 . HZ3 1 1 741 1 2 2 1 20 ILE MD B 20 . HD# 1 1 742 1 1 2 1 16 TRP HZ3 B 16 . HZ3 1 1 742 1 2 2 1 20 ILE MG B 20 . HG2# 1 1 743 1 1 2 1 16 TRP HZ3 B 16 . HZ3 1 1 743 1 2 2 1 21 MET HA B 21 . HA 1 1 744 1 1 2 1 17 VAL H B 17 . HN 1 1 744 1 2 2 1 17 VAL HB B 17 . HB 1 1 745 1 1 2 1 17 VAL H B 17 . HN 1 1 745 1 2 2 1 17 VAL QG B 17 . HG## 1 1 746 1 1 2 1 17 VAL H B 17 . HN 1 1 746 1 2 2 1 18 GLY H B 18 . HN 1 1 747 1 1 2 1 17 VAL H B 17 . HN 1 1 747 1 2 2 1 19 GLU H B 19 . HN 1 1 748 1 1 2 1 17 VAL H B 17 . HN 1 1 748 1 2 2 1 19 GLU QB B 19 . HB# 1 1 749 1 1 2 1 17 VAL HA B 17 . HA 1 1 749 1 2 2 1 17 VAL QG B 17 . HG## 1 1 750 1 1 2 1 17 VAL HA B 17 . HA 1 1 750 1 2 2 1 18 GLY H B 18 . HN 1 1 751 1 1 2 1 17 VAL HA B 17 . HA 1 1 751 1 2 2 1 19 GLU H B 19 . HN 1 1 752 1 1 2 1 17 VAL HA B 17 . HA 1 1 752 1 2 2 1 19 GLU QG B 19 . HG# 1 1 753 1 1 2 1 17 VAL HA B 17 . HA 1 1 753 1 2 2 1 20 ILE H B 20 . HN 1 1 754 1 1 2 1 17 VAL HA B 17 . HA 1 1 754 1 2 2 1 20 ILE HB B 20 . HB 1 1 755 1 1 2 1 17 VAL HA B 17 . HA 1 1 755 1 2 2 1 20 ILE MD B 20 . HD# 1 1 756 1 1 2 1 17 VAL HA B 17 . HA 1 1 756 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 757 1 1 2 1 17 VAL HA B 17 . HA 1 1 757 1 2 2 1 20 ILE MG B 20 . HG2# 1 1 758 1 1 2 1 17 VAL HA B 17 . HA 1 1 758 1 2 2 1 21 MET H B 21 . HN 1 1 759 1 1 2 1 17 VAL HA B 17 . HA 1 1 759 1 2 2 1 21 MET QB B 21 . HB# 1 1 760 1 1 2 1 17 VAL HA B 17 . HA 1 1 760 1 2 2 1 21 MET QG B 21 . HG# 1 1 761 1 1 2 1 17 VAL HB B 17 . HB 1 1 761 1 2 2 1 17 VAL QG B 17 . HG## 1 1 762 1 1 2 1 17 VAL HB B 17 . HB 1 1 762 1 2 2 1 18 GLY H B 18 . HN 1 1 763 1 1 2 1 17 VAL HB B 17 . HB 1 1 763 1 2 2 1 18 GLY QA B 18 . HA# 1 1 764 1 1 2 1 17 VAL QG B 17 . HG## 1 1 764 1 2 2 1 18 GLY H B 18 . HN 1 1 765 1 1 2 1 17 VAL QG B 17 . HG## 1 1 765 1 2 2 1 18 GLY QA B 18 . HA# 1 1 766 1 1 2 1 17 VAL QG B 17 . HG## 1 1 766 1 2 2 1 20 ILE H B 20 . HN 1 1 767 1 1 2 1 17 VAL QG B 17 . HG## 1 1 767 1 2 2 1 20 ILE HB B 20 . HB 1 1 768 1 1 2 1 17 VAL QG B 17 . HG## 1 1 768 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 769 1 1 2 1 17 VAL QG B 17 . HG## 1 1 769 1 2 2 1 21 MET H B 21 . HN 1 1 770 1 1 2 1 17 VAL QG B 17 . HG## 1 1 770 1 2 2 1 21 MET HA B 21 . HA 1 1 771 1 1 2 1 17 VAL QG B 17 . HG## 1 1 771 1 2 2 1 21 MET QB B 21 . HB# 1 1 772 1 1 2 1 17 VAL QG B 17 . HG## 1 1 772 1 2 2 1 21 MET QG B 21 . HG# 1 1 773 1 1 2 1 18 GLY H B 18 . HN 1 1 773 1 2 2 1 19 GLU H B 19 . HN 1 1 774 1 1 2 1 18 GLY H B 18 . HN 1 1 774 1 2 2 1 19 GLU QB B 19 . HB# 1 1 775 1 1 2 1 18 GLY H B 18 . HN 1 1 775 1 2 2 1 20 ILE H B 20 . HN 1 1 776 1 1 2 1 18 GLY H B 18 . HN 1 1 776 1 2 2 1 21 MET QB B 21 . HB# 1 1 777 1 1 2 1 18 GLY QA B 18 . HA# 1 1 777 1 2 2 1 19 GLU H B 19 . HN 1 1 778 1 1 2 1 18 GLY QA B 18 . HA# 1 1 778 1 2 2 1 20 ILE H B 20 . HN 1 1 779 1 1 2 1 18 GLY QA B 18 . HA# 1 1 779 1 2 2 1 21 MET H B 21 . HN 1 1 780 1 1 2 1 18 GLY QA B 18 . HA# 1 1 780 1 2 2 1 21 MET QB B 21 . HB# 1 1 781 1 1 2 1 18 GLY QA B 18 . HA# 1 1 781 1 2 2 1 21 MET QG B 21 . HG# 1 1 782 1 1 2 1 18 GLY QA B 18 . HA# 1 1 782 1 2 2 1 22 ASN H B 22 . HN 1 1 783 1 1 2 1 18 GLY QA B 18 . HA# 1 1 783 1 2 2 1 22 ASN QD B 22 . HD2# 1 1 784 1 1 2 1 19 GLU H B 19 . HN 1 1 784 1 2 2 1 19 GLU QB B 19 . HB# 1 1 785 1 1 2 1 19 GLU H B 19 . HN 1 1 785 1 2 2 1 19 GLU QG B 19 . HG# 1 1 786 1 1 2 1 19 GLU H B 19 . HN 1 1 786 1 2 2 1 20 ILE H B 20 . HN 1 1 787 1 1 2 1 19 GLU H B 19 . HN 1 1 787 1 2 2 1 20 ILE HA B 20 . HA 1 1 788 1 1 2 1 19 GLU H B 19 . HN 1 1 788 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 789 1 1 2 1 19 GLU H B 19 . HN 1 1 789 1 2 2 1 21 MET H B 21 . HN 1 1 790 1 1 2 1 19 GLU HA B 19 . HA 1 1 790 1 2 2 1 19 GLU QB B 19 . HB# 1 1 791 1 1 2 1 19 GLU HA B 19 . HA 1 1 791 1 2 2 1 19 GLU QG B 19 . HG# 1 1 792 1 1 2 1 19 GLU HA B 19 . HA 1 1 792 1 2 2 1 20 ILE H B 20 . HN 1 1 793 1 1 2 1 19 GLU HA B 19 . HA 1 1 793 1 2 2 1 21 MET H B 21 . HN 1 1 794 1 1 2 1 19 GLU HA B 19 . HA 1 1 794 1 2 2 1 22 ASN H B 22 . HN 1 1 795 1 1 2 1 19 GLU HA B 19 . HA 1 1 795 1 2 2 1 22 ASN QB B 22 . HB# 1 1 796 1 1 2 1 19 GLU HA B 19 . HA 1 1 796 1 2 2 1 22 ASN QD B 22 . HD2# 1 1 797 1 1 2 1 19 GLU HA B 19 . HA 1 1 797 1 2 2 1 23 SER H B 23 . HN 1 1 798 1 1 2 1 19 GLU QB B 19 . HB# 1 1 798 1 2 2 1 19 GLU QG B 19 . HG# 1 1 799 1 1 2 1 19 GLU QB B 19 . HB# 1 1 799 1 2 2 1 20 ILE H B 20 . HN 1 1 800 1 1 2 1 19 GLU QB B 19 . HB# 1 1 800 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 801 1 1 2 1 19 GLU QG B 19 . HG# 1 1 801 1 2 2 1 20 ILE H B 20 . HN 1 1 802 1 1 2 1 19 GLU QG B 19 . HG# 1 1 802 1 2 2 1 20 ILE HB B 20 . HB 1 1 803 1 1 2 1 19 GLU QG B 19 . HG# 1 1 803 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 804 1 1 2 1 19 GLU QG B 19 . HG# 1 1 804 1 2 2 1 23 SER QB B 23 . HB# 1 1 805 1 1 2 1 20 ILE H B 20 . HN 1 1 805 1 2 2 1 20 ILE HB B 20 . HB 1 1 806 1 1 2 1 20 ILE H B 20 . HN 1 1 806 1 2 2 1 20 ILE MD B 20 . HD# 1 1 807 1 1 2 1 20 ILE H B 20 . HN 1 1 807 1 2 2 1 20 ILE QG B 20 . HG## 1 1 807 1 2 2 1 20 ILE MG B 20 . HG## 1 1 808 1 1 2 1 20 ILE H B 20 . HN 1 1 808 1 2 2 1 21 MET H B 21 . HN 1 1 809 1 1 2 1 20 ILE H B 20 . HN 1 1 809 1 2 2 1 22 ASN H B 22 . HN 1 1 810 1 1 2 1 20 ILE HA B 20 . HA 1 1 810 1 2 2 1 20 ILE MD B 20 . HD# 1 1 811 1 1 2 1 20 ILE HA B 20 . HA 1 1 811 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 812 1 1 2 1 20 ILE HA B 20 . HA 1 1 812 1 2 2 1 20 ILE MG B 20 . HG2# 1 1 813 1 1 2 1 20 ILE HA B 20 . HA 1 1 813 1 2 2 1 21 MET H B 21 . HN 1 1 814 1 1 2 1 20 ILE HA B 20 . HA 1 1 814 1 2 2 1 22 ASN H B 22 . HN 1 1 815 1 1 2 1 20 ILE HA B 20 . HA 1 1 815 1 2 2 1 23 SER H B 23 . HN 1 1 816 1 1 2 1 20 ILE HB B 20 . HB 1 1 816 1 2 2 1 20 ILE MD B 20 . HD# 1 1 817 1 1 2 1 20 ILE HB B 20 . HB 1 1 817 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 818 1 1 2 1 20 ILE HB B 20 . HB 1 1 818 1 2 2 1 20 ILE MG B 20 . HG2# 1 1 819 1 1 2 1 20 ILE HB B 20 . HB 1 1 819 1 2 2 1 21 MET H B 21 . HN 1 1 820 1 1 2 1 20 ILE HB B 20 . HB 1 1 820 1 2 2 1 21 MET HA B 21 . HA 1 1 821 1 1 2 1 20 ILE HB B 20 . HB 1 1 821 1 2 2 1 21 MET QG B 21 . HG# 1 1 822 1 1 2 1 20 ILE HB B 20 . HB 1 1 822 1 2 2 1 22 ASN H B 22 . HN 1 1 823 1 1 2 1 20 ILE MD B 20 . HD# 1 1 823 1 2 2 1 20 ILE QG B 20 . HG1# 1 1 824 1 1 2 1 20 ILE MD B 20 . HD# 1 1 824 1 2 2 1 21 MET H B 21 . HN 1 1 825 1 1 2 1 20 ILE QG B 20 . HG1# 1 1 825 1 2 2 1 20 ILE MG B 20 . HG2# 1 1 826 1 1 2 1 20 ILE QG B 20 . HG1# 1 1 826 1 2 2 1 21 MET H B 21 . HN 1 1 827 1 1 2 1 20 ILE QG B 20 . HG1# 1 1 827 1 2 2 1 21 MET QB B 21 . HB# 1 1 828 1 1 2 1 20 ILE MG B 20 . HG2# 1 1 828 1 2 2 1 21 MET H B 21 . HN 1 1 829 1 1 2 1 20 ILE MG B 20 . HG2# 1 1 829 1 2 2 1 21 MET HA B 21 . HA 1 1 830 1 1 2 1 20 ILE MG B 20 . HG2# 1 1 830 1 2 2 1 21 MET QG B 21 . HG# 1 1 831 1 1 2 1 21 MET H B 21 . HN 1 1 831 1 2 2 1 21 MET QB B 21 . HB# 1 1 832 1 1 2 1 21 MET H B 21 . HN 1 1 832 1 2 2 1 21 MET QG B 21 . HG# 1 1 833 1 1 2 1 21 MET H B 21 . HN 1 1 833 1 2 2 1 22 ASN H B 22 . HN 1 1 834 1 1 2 1 21 MET H B 21 . HN 1 1 834 1 2 2 1 23 SER H B 23 . HN 1 1 835 1 1 2 1 21 MET HA B 21 . HA 1 1 835 1 2 2 1 21 MET QB B 21 . HB# 1 1 836 1 1 2 1 21 MET HA B 21 . HA 1 1 836 1 2 2 1 21 MET QG B 21 . HG# 1 1 837 1 1 2 1 21 MET HA B 21 . HA 1 1 837 1 2 2 1 22 ASN H B 22 . HN 1 1 838 1 1 2 1 21 MET HA B 21 . HA 1 1 838 1 2 2 1 23 SER H B 23 . HN 1 1 839 1 1 2 1 21 MET QB B 21 . HB# 1 1 839 1 2 2 1 21 MET QG B 21 . HG# 1 1 840 1 1 2 1 21 MET QB B 21 . HB# 1 1 840 1 2 2 1 22 ASN H B 22 . HN 1 1 841 1 1 2 1 22 ASN H B 22 . HN 1 1 841 1 2 2 1 22 ASN QB B 22 . HB# 1 1 842 1 1 2 1 22 ASN H B 22 . HN 1 1 842 1 2 2 1 22 ASN QD B 22 . HD2# 1 1 843 1 1 2 1 22 ASN H B 22 . HN 1 1 843 1 2 2 1 23 SER H B 23 . HN 1 1 844 1 1 2 1 22 ASN HA B 22 . HA 1 1 844 1 2 2 1 22 ASN QB B 22 . HB# 1 1 845 1 1 2 1 22 ASN HA B 22 . HA 1 1 845 1 2 2 1 22 ASN QD B 22 . HD2# 1 1 846 1 1 2 1 22 ASN QB B 22 . HB# 1 1 846 1 2 2 1 22 ASN QD B 22 . HD2# 1 1 847 1 1 2 1 23 SER H B 23 . HN 1 1 847 1 2 2 1 23 SER QB B 23 . HB# 1 1 848 1 1 2 1 23 SER HA B 23 . HA 1 1 848 1 2 2 1 23 SER QB B 23 . HB# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.0 1.8 5.0 1 1 2 1 . . . . . 2.0 1.8 6.0 1 1 3 1 . . . . . 2.0 1.8 5.5 1 1 4 1 . . . . . 2.0 1.8 4.5 1 1 5 1 . . . . . 2.0 1.8 5.0 1 1 6 1 . . . . . 2.0 1.8 5.0 1 1 7 1 . . . . . 2.0 1.8 4.0 1 1 8 1 . . . . . 2.0 1.8 5.0 1 1 9 1 . . . . . 2.0 1.8 5.0 1 1 10 1 . . . . . 2.0 1.8 5.0 1 1 11 1 . . . . . 2.0 1.8 4.0 1 1 12 1 . . . . . 2.0 1.8 5.0 1 1 13 1 . . . . . 2.0 1.8 4.5 1 1 14 1 . . . . . 2.0 1.8 5.0 1 1 15 1 . . . . . 2.0 1.8 8.4 1 1 16 1 . . . . . 2.0 1.8 5.5 1 1 17 1 . . . . . 2.0 1.8 8.4 1 1 18 1 . . . . . 2.0 1.8 5.0 1 1 19 1 . . . . . 2.0 1.8 9.9 1 1 20 1 . . . . . 2.0 1.8 9.9 1 1 21 1 . . . . . 2.0 1.8 5.5 1 1 22 1 . . . . . 2.0 1.8 4.5 1 1 23 1 . . . . . 2.0 1.8 4.5 1 1 24 1 . . . . . 2.0 1.8 5.5 1 1 25 1 . . . . . 2.0 1.8 5.5 1 1 26 1 . . . . . 2.0 1.8 5.5 1 1 27 1 . . . . . 2.0 1.8 5.5 1 1 28 1 . . . . . 2.0 1.8 5.5 1 1 29 1 . . . . . 2.0 1.8 5.5 1 1 30 1 . . . . . 2.0 1.8 5.0 1 1 31 1 . . . . . 2.0 1.8 5.0 1 1 32 1 . . . . . 2.0 1.8 5.0 1 1 33 1 . . . . . 2.0 1.8 5.0 1 1 34 1 . . . . . 2.0 1.8 5.0 1 1 35 1 . . . . . 2.0 1.8 7.4 1 1 36 1 . . . . . 2.0 1.8 5.5 1 1 37 1 . . . . . 2.0 1.8 4.0 1 1 38 1 . . . . . 2.0 1.8 5.0 1 1 39 1 . . . . . 2.0 1.8 5.0 1 1 40 1 . . . . . 2.0 1.8 4.0 1 1 41 1 . . . . . 2.0 1.8 5.0 1 1 42 1 . . . . . 2.0 1.8 5.0 1 1 43 1 . . . . . 2.0 1.8 6.0 1 1 44 1 . . . . . 2.0 1.8 5.0 1 1 45 1 . . . . . 2.0 1.8 4.0 1 1 46 1 . . . . . 2.0 1.8 5.0 1 1 47 1 . . . . . 2.0 1.8 5.0 1 1 48 1 . . . . . 2.0 1.8 5.0 1 1 49 1 . . . . . 2.0 1.8 5.0 1 1 50 1 . . . . . 2.0 1.8 5.0 1 1 51 1 . . . . . 2.0 1.8 5.0 1 1 52 1 . . . . . 2.0 1.8 3.0 1 1 53 1 . . . . . 2.0 1.8 5.0 1 1 54 1 . . . . . 2.0 1.8 4.0 1 1 55 1 . . . . . 2.0 1.8 4.0 1 1 56 1 . . . . . 2.0 1.8 5.0 1 1 57 1 . . . . . 2.0 1.8 5.0 1 1 58 1 . . . . . 2.0 1.8 5.0 1 1 59 1 . . . . . 2.0 1.8 4.0 1 1 60 1 . . . . . 2.0 1.8 4.0 1 1 61 1 . . . . . 2.0 1.8 4.0 1 1 62 1 . . . . . 2.0 1.8 5.0 1 1 63 1 . . . . . 2.0 1.8 4.0 1 1 64 1 . . . . . 2.0 1.8 5.0 1 1 65 1 . . . . . 2.0 1.8 5.0 1 1 66 1 . . . . . 2.0 1.8 5.0 1 1 67 1 . . . . . 2.0 1.8 5.0 1 1 68 1 . . . . . 2.0 1.8 5.0 1 1 69 1 . . . . . 2.0 1.8 5.0 1 1 70 1 . . . . . 2.0 1.8 5.0 1 1 71 1 . . . . . 2.0 1.8 5.0 1 1 72 1 . . . . . 2.0 1.8 5.0 1 1 73 1 . . . . . 2.0 1.8 5.0 1 1 74 1 . . . . . 2.0 1.8 5.0 1 1 75 1 . . . . . 2.0 1.8 5.0 1 1 76 1 . . . . . 2.0 1.8 5.0 1 1 77 1 . . . . . 2.0 1.8 5.0 1 1 78 1 . . . . . 2.0 1.8 5.0 1 1 79 1 . . . . . 2.0 1.8 4.0 1 1 80 1 . . . . . 2.0 1.8 5.0 1 1 81 1 . . . . . 2.0 1.8 4.0 1 1 82 1 . . . . . 2.0 1.8 5.0 1 1 83 1 . . . . . 2.0 1.8 5.0 1 1 84 1 . . . . . 2.0 1.8 5.0 1 1 85 1 . . . . . 2.0 1.8 4.0 1 1 86 1 . . . . . 2.0 1.8 4.0 1 1 87 1 . . . . . 2.0 1.8 4.0 1 1 88 1 . . . . . 2.0 1.8 4.5 1 1 89 1 . . . . . 2.0 1.8 5.0 1 1 90 1 . . . . . 2.0 1.8 4.0 1 1 91 1 . . . . . 2.0 1.8 5.0 1 1 92 1 . . . . . 2.0 1.8 5.0 1 1 93 1 . . . . . 2.0 1.8 5.0 1 1 94 1 . . . . . 2.0 1.8 5.0 1 1 95 1 . . . . . 2.0 1.8 5.0 1 1 96 1 . . . . . 2.0 1.8 5.0 1 1 97 1 . . . . . 2.0 1.8 5.0 1 1 98 1 . . . . . 2.0 1.8 4.0 1 1 99 1 . . . . . 2.0 1.8 5.0 1 1 100 1 . . . . . 2.0 1.8 7.0 1 1 101 1 . . . . . 2.0 1.8 5.0 1 1 102 1 . . . . . 2.0 1.8 6.5 1 1 103 1 . . . . . 2.0 1.8 5.0 1 1 104 1 . . . . . 2.0 1.8 5.0 1 1 105 1 . . . . . 2.0 1.8 5.5 1 1 106 1 . . . . . 2.0 1.8 4.0 1 1 107 1 . . . . . 2.0 1.8 5.0 1 1 108 1 . . . . . 2.0 1.8 5.5 1 1 109 1 . . . . . 2.0 1.8 9.4 1 1 110 1 . . . . . 2.0 1.8 5.0 1 1 111 1 . . . . . 2.0 1.8 5.0 1 1 112 1 . . . . . 2.0 1.8 5.0 1 1 113 1 . . . . . 2.0 1.8 5.5 1 1 114 1 . . . . . 2.0 1.8 5.0 1 1 115 1 . . . . . 2.0 1.8 5.0 1 1 116 1 . . . . . 2.0 1.8 4.0 1 1 117 1 . . . . . 2.0 1.8 4.0 1 1 118 1 . . . . . 2.0 1.8 4.0 1 1 119 1 . . . . . 2.0 1.8 5.0 1 1 120 1 . . . . . 2.0 1.8 5.5 1 1 121 1 . . . . . 2.0 1.8 4.0 1 1 122 1 . . . . . 2.0 1.8 4.0 1 1 123 1 . . . . . 2.0 1.8 4.0 1 1 124 1 . . . . . 2.0 1.8 4.0 1 1 125 1 . . . . . 2.0 1.8 5.0 1 1 126 1 . . . . . 2.0 1.8 5.0 1 1 127 1 . . . . . 2.0 1.8 4.0 1 1 128 1 . . . . . 2.0 1.8 5.0 1 1 129 1 . . . . . 2.0 1.8 4.0 1 1 130 1 . . . . . 2.0 1.8 5.0 1 1 131 1 . . . . . 2.0 1.8 4.0 1 1 132 1 . . . . . 2.0 1.8 5.5 1 1 133 1 . . . . . 2.0 1.8 4.5 1 1 134 1 . . . . . 2.0 1.8 4.0 1 1 135 1 . . . . . 2.0 1.8 6.5 1 1 136 1 . . . . . 2.0 1.8 8.5 1 1 137 1 . . . . . 2.0 1.8 5.5 1 1 138 1 . . . . . 2.0 1.8 5.0 1 1 139 1 . . . . . 2.0 1.8 5.0 1 1 140 1 . . . . . 2.0 1.8 4.0 1 1 141 1 . . . . . 2.0 1.8 5.0 1 1 142 1 . . . . . 2.0 1.8 5.0 1 1 143 1 . . . . . 2.0 1.8 4.0 1 1 144 1 . . . . . 2.0 1.8 5.0 1 1 145 1 . . . . . 2.0 1.8 5.0 1 1 146 1 . . . . . 2.0 1.8 6.0 1 1 147 1 . . . . . 2.0 1.8 4.0 1 1 148 1 . . . . . 2.0 1.8 4.0 1 1 149 1 . . . . . 2.0 1.8 4.0 1 1 150 1 . . . . . 2.0 1.8 4.0 1 1 151 1 . . . . . 2.0 1.8 5.0 1 1 152 1 . . . . . 2.0 1.8 4.0 1 1 153 1 . . . . . 2.0 1.8 4.0 1 1 154 1 . . . . . 2.0 1.8 5.0 1 1 155 1 . . . . . 2.0 1.8 4.5 1 1 156 1 . . . . . 2.0 1.8 4.0 1 1 157 1 . . . . . 2.0 1.8 5.0 1 1 158 1 . . . . . 2.0 1.8 5.0 1 1 159 1 . . . . . 2.0 1.8 3.5 1 1 160 1 . . . . . 2.0 1.8 4.0 1 1 161 1 . . . . . 2.0 1.8 5.0 1 1 162 1 . . . . . 2.0 1.8 4.0 1 1 163 1 . . . . . 2.0 1.8 5.0 1 1 164 1 . . . . . 2.0 1.8 4.0 1 1 165 1 . . . . . 2.0 1.8 5.0 1 1 166 1 . . . . . 2.0 1.8 5.0 1 1 167 1 . . . . . 2.0 1.8 5.0 1 1 168 1 . . . . . 2.0 1.8 4.5 1 1 169 1 . . . . . 2.0 1.8 6.5 1 1 170 1 . . . . . 2.0 1.8 5.5 1 1 171 1 . . . . . 2.0 1.8 4.5 1 1 172 1 . . . . . 2.0 1.8 5.5 1 1 173 1 . . . . . 2.0 1.8 5.5 1 1 174 1 . . . . . 2.0 1.8 5.5 1 1 175 1 . . . . . 2.0 1.8 4.0 1 1 176 1 . . . . . 2.0 1.8 5.0 1 1 177 1 . . . . . 2.0 1.8 5.0 1 1 178 1 . . . . . 2.0 1.8 5.5 1 1 179 1 . . . . . 2.0 1.8 5.0 1 1 180 1 . . . . . 2.0 1.8 5.0 1 1 181 1 . . . . . 2.0 1.8 4.0 1 1 182 1 . . . . . 2.0 1.8 4.0 1 1 183 1 . . . . . 2.0 1.8 4.0 1 1 184 1 . . . . . 2.0 1.8 5.0 1 1 185 1 . . . . . 2.0 1.8 5.0 1 1 186 1 . . . . . 2.0 1.8 5.0 1 1 187 1 . . . . . 2.0 1.8 5.0 1 1 188 1 . . . . . 2.0 1.8 5.0 1 1 189 1 . . . . . 2.0 1.8 4.0 1 1 190 1 . . . . . 2.0 1.8 5.0 1 1 191 1 . . . . . 2.0 1.8 4.0 1 1 192 1 . . . . . 2.0 1.8 5.0 1 1 193 1 . . . . . 2.0 1.8 7.0 1 1 194 1 . . . . . 2.0 1.8 5.0 1 1 195 1 . . . . . 2.0 1.8 6.0 1 1 196 1 . . . . . 2.0 1.8 5.0 1 1 197 1 . . . . . 2.0 1.8 5.0 1 1 198 1 . . . . . 2.0 1.8 5.0 1 1 199 1 . . . . . 2.0 1.8 6.0 1 1 200 1 . . . . . 2.0 1.8 5.0 1 1 201 1 . . . . . 2.0 1.8 5.0 1 1 202 1 . . . . . 2.0 1.8 5.0 1 1 203 1 . . . . . 2.0 1.8 5.0 1 1 204 1 . . . . . 2.0 1.8 7.0 1 1 205 1 . . . . . 2.0 1.8 5.0 1 1 206 1 . . . . . 2.0 1.8 4.0 1 1 207 1 . . . . . 2.0 1.8 5.0 1 1 208 1 . . . . . 2.0 1.8 5.0 1 1 209 1 . . . . . 2.0 1.8 4.0 1 1 210 1 . . . . . 2.0 1.8 5.0 1 1 211 1 . . . . . 2.0 1.8 4.0 1 1 212 1 . . . . . 2.0 1.8 4.0 1 1 213 1 . . . . . 2.0 1.8 7.0 1 1 214 1 . . . . . 2.0 1.8 5.0 1 1 215 1 . . . . . 2.0 1.8 5.5 1 1 216 1 . . . . . 2.0 1.8 4.0 1 1 217 1 . . . . . 2.0 1.8 4.0 1 1 218 1 . . . . . 2.0 1.8 5.0 1 1 219 1 . . . . . 2.0 1.8 6.0 1 1 220 1 . . . . . 2.0 1.8 7.0 1 1 221 1 . . . . . 2.0 1.8 5.0 1 1 222 1 . . . . . 2.0 1.8 8.5 1 1 223 1 . . . . . 2.0 1.8 5.0 1 1 224 1 . . . . . 2.0 1.8 4.0 1 1 225 1 . . . . . 2.0 1.8 4.0 1 1 226 1 . . . . . 2.0 1.8 5.0 1 1 227 1 . . . . . 2.0 1.8 5.0 1 1 228 1 . . . . . 2.0 1.8 5.0 1 1 229 1 . . . . . 2.0 1.8 5.0 1 1 230 1 . . . . . 2.0 1.8 4.0 1 1 231 1 . . . . . 2.0 1.8 3.0 1 1 232 1 . . . . . 2.0 1.8 4.0 1 1 233 1 . . . . . 2.0 1.8 5.0 1 1 234 1 . . . . . 2.0 1.8 5.0 1 1 235 1 . . . . . 2.0 1.8 4.5 1 1 236 1 . . . . . 2.0 1.8 5.0 1 1 237 1 . . . . . 2.0 1.8 5.0 1 1 238 1 . . . . . 2.0 1.8 5.0 1 1 239 1 . . . . . 2.0 1.8 5.0 1 1 240 1 . . . . . 2.0 1.8 4.0 1 1 241 1 . . . . . 2.0 1.8 4.0 1 1 242 1 . . . . . 2.0 1.8 5.0 1 1 243 1 . . . . . 2.0 1.8 5.0 1 1 244 1 . . . . . 2.0 1.8 5.0 1 1 245 1 . . . . . 2.0 1.8 5.0 1 1 246 1 . . . . . 2.0 1.8 5.0 1 1 247 1 . . . . . 2.0 1.8 5.0 1 1 248 1 . . . . . 2.0 1.8 4.5 1 1 249 1 . . . . . 2.0 1.8 5.0 1 1 250 1 . . . . . 2.0 1.8 5.0 1 1 251 1 . . . . . 2.0 1.8 5.0 1 1 252 1 . . . . . 2.0 1.8 4.0 1 1 253 1 . . . . . 2.0 1.8 4.0 1 1 254 1 . . . . . 2.0 1.8 5.5 1 1 255 1 . . . . . 2.0 1.8 5.0 1 1 256 1 . . . . . 2.0 1.8 5.0 1 1 257 1 . . . . . 2.0 1.8 6.0 1 1 258 1 . . . . . 2.0 1.8 5.0 1 1 259 1 . . . . . 2.0 1.8 6.0 1 1 260 1 . . . . . 2.0 1.8 5.0 1 1 261 1 . . . . . 2.0 1.8 6.0 1 1 262 1 . . . . . 2.0 1.8 5.0 1 1 263 1 . . . . . 2.0 1.8 4.0 1 1 264 1 . . . . . 2.0 1.8 5.0 1 1 265 1 . . . . . 2.0 1.8 4.0 1 1 266 1 . . . . . 2.0 1.8 4.0 1 1 267 1 . . . . . 2.0 1.8 6.4 1 1 268 1 . . . . . 2.0 1.8 4.0 1 1 269 1 . . . . . 2.0 1.8 4.0 1 1 270 1 . . . . . 2.0 1.8 4.0 1 1 271 1 . . . . . 2.0 1.8 5.0 1 1 272 1 . . . . . 2.0 1.8 5.0 1 1 273 1 . . . . . 2.0 1.8 4.0 1 1 274 1 . . . . . 2.0 1.8 4.0 1 1 275 1 . . . . . 2.0 1.8 5.0 1 1 276 1 . . . . . 2.0 1.8 4.0 1 1 277 1 . . . . . 2.0 1.8 4.0 1 1 278 1 . . . . . 2.0 1.8 5.0 1 1 279 1 . . . . . 2.0 1.8 4.0 1 1 280 1 . . . . . 2.0 1.8 8.4 1 1 281 1 . . . . . 2.0 1.8 4.0 1 1 282 1 . . . . . 2.0 1.8 7.0 1 1 283 1 . . . . . 2.0 1.8 5.0 1 1 284 1 . . . . . 2.0 1.8 4.5 1 1 285 1 . . . . . 2.0 1.8 4.0 1 1 286 1 . . . . . 2.0 1.8 5.0 1 1 287 1 . . . . . 2.0 1.8 5.0 1 1 288 1 . . . . . 2.0 1.8 3.5 1 1 289 1 . . . . . 2.0 1.8 4.0 1 1 290 1 . . . . . 2.0 1.8 5.0 1 1 291 1 . . . . . 2.0 1.8 5.0 1 1 292 1 . . . . . 2.0 1.8 5.0 1 1 293 1 . . . . . 2.0 1.8 4.5 1 1 294 1 . . . . . 2.0 1.8 4.5 1 1 295 1 . . . . . 2.0 1.8 5.5 1 1 296 1 . . . . . 2.0 1.8 5.5 1 1 297 1 . . . . . 2.0 1.8 5.5 1 1 298 1 . . . . . 2.0 1.8 5.5 1 1 299 1 . . . . . 2.0 1.8 4.0 1 1 300 1 . . . . . 2.0 1.8 5.0 1 1 301 1 . . . . . 2.0 1.8 4.0 1 1 302 1 . . . . . 2.0 1.8 5.0 1 1 303 1 . . . . . 2.0 1.8 5.0 1 1 304 1 . . . . . 2.0 1.8 5.0 1 1 305 1 . . . . . 2.0 1.8 5.0 1 1 306 1 . . . . . 2.0 1.8 5.0 1 1 307 1 . . . . . 2.0 1.8 5.0 1 1 308 1 . . . . . 2.0 1.8 5.0 1 1 309 1 . . . . . 2.0 1.8 5.0 1 1 310 1 . . . . . 2.0 1.8 4.0 1 1 311 1 . . . . . 2.0 1.8 5.0 1 1 312 1 . . . . . 2.0 1.8 4.0 1 1 313 1 . . . . . 2.0 1.8 5.0 1 1 314 1 . . . . . 2.0 1.8 5.0 1 1 315 1 . . . . . 2.0 1.8 5.0 1 1 316 1 . . . . . 2.0 1.8 5.5 1 1 317 1 . . . . . 2.0 1.8 5.5 1 1 318 1 . . . . . 2.0 1.8 4.0 1 1 319 1 . . . . . 2.0 1.8 5.0 1 1 320 1 . . . . . 2.0 1.8 5.0 1 1 321 1 . . . . . 2.0 1.8 5.0 1 1 322 1 . . . . . 2.0 1.8 6.5 1 1 323 1 . . . . . 2.0 1.8 5.0 1 1 324 1 . . . . . 2.0 1.8 5.0 1 1 325 1 . . . . . 2.0 1.8 5.0 1 1 326 1 . . . . . 2.0 1.8 5.0 1 1 327 1 . . . . . 2.0 1.8 5.0 1 1 328 1 . . . . . 2.0 1.8 5.0 1 1 329 1 . . . . . 2.0 1.8 4.0 1 1 330 1 . . . . . 2.0 1.8 4.0 1 1 331 1 . . . . . 2.0 1.8 5.0 1 1 332 1 . . . . . 2.0 1.8 5.0 1 1 333 1 . . . . . 2.0 1.8 5.0 1 1 334 1 . . . . . 2.0 1.8 5.0 1 1 335 1 . . . . . 2.0 1.8 5.5 1 1 336 1 . . . . . 2.0 1.8 5.0 1 1 337 1 . . . . . 2.0 1.8 5.0 1 1 338 1 . . . . . 2.0 1.8 4.5 1 1 339 1 . . . . . 2.0 1.8 5.0 1 1 340 1 . . . . . 2.0 1.8 5.0 1 1 341 1 . . . . . 2.0 1.8 4.5 1 1 342 1 . . . . . 2.0 1.8 5.0 1 1 343 1 . . . . . 2.0 1.8 5.0 1 1 344 1 . . . . . 2.0 1.8 4.5 1 1 345 1 . . . . . 2.0 1.8 5.0 1 1 346 1 . . . . . 2.0 1.8 4.0 1 1 347 1 . . . . . 2.0 1.8 4.0 1 1 348 1 . . . . . 2.0 1.8 4.0 1 1 349 1 . . . . . 2.0 1.8 5.0 1 1 350 1 . . . . . 2.0 1.8 5.0 1 1 351 1 . . . . . 2.0 1.8 4.0 1 1 352 1 . . . . . 2.0 1.8 4.0 1 1 353 1 . . . . . 2.0 1.8 5.0 1 1 354 1 . . . . . 2.0 1.8 5.0 1 1 355 1 . . . . . 2.0 1.8 4.0 1 1 356 1 . . . . . 2.0 1.8 4.0 1 1 357 1 . . . . . 2.0 1.8 5.0 1 1 358 1 . . . . . 2.0 1.8 5.5 1 1 359 1 . . . . . 2.0 1.8 4.5 1 1 360 1 . . . . . 2.0 1.8 5.0 1 1 361 1 . . . . . 2.0 1.8 5.0 1 1 362 1 . . . . . 2.0 1.8 6.0 1 1 363 1 . . . . . 2.0 1.8 4.0 1 1 364 1 . . . . . 2.0 1.8 4.0 1 1 365 1 . . . . . 2.0 1.8 5.0 1 1 366 1 . . . . . 2.0 1.8 4.0 1 1 367 1 . . . . . 2.0 1.8 5.0 1 1 368 1 . . . . . 2.0 1.8 6.4 1 1 369 1 . . . . . 2.0 1.8 5.0 1 1 370 1 . . . . . 2.0 1.8 5.4 1 1 371 1 . . . . . 2.0 1.8 6.4 1 1 372 1 . . . . . 2.0 1.8 4.0 1 1 373 1 . . . . . 2.0 1.8 5.4 1 1 374 1 . . . . . 2.0 1.8 5.0 1 1 375 1 . . . . . 2.0 1.8 4.0 1 1 376 1 . . . . . 2.0 1.8 5.0 1 1 377 1 . . . . . 2.0 1.8 5.0 1 1 378 1 . . . . . 2.0 1.8 5.0 1 1 379 1 . . . . . 2.0 1.8 4.0 1 1 380 1 . . . . . 2.0 1.8 5.0 1 1 381 1 . . . . . 2.0 1.8 5.0 1 1 382 1 . . . . . 2.0 1.8 5.0 1 1 383 1 . . . . . 2.0 1.8 5.0 1 1 384 1 . . . . . 2.0 1.8 5.0 1 1 385 1 . . . . . 2.0 1.8 6.0 1 1 386 1 . . . . . 2.0 1.8 4.0 1 1 387 1 . . . . . 2.0 1.8 4.0 1 1 388 1 . . . . . 2.0 1.8 5.0 1 1 389 1 . . . . . 2.0 1.8 5.0 1 1 390 1 . . . . . 2.0 1.8 5.5 1 1 391 1 . . . . . 2.0 1.8 5.0 1 1 392 1 . . . . . 2.0 1.8 4.0 1 1 393 1 . . . . . 2.0 1.8 4.0 1 1 394 1 . . . . . 2.0 1.8 4.0 1 1 395 1 . . . . . 2.0 1.8 5.0 1 1 396 1 . . . . . 2.0 1.8 4.0 1 1 397 1 . . . . . 2.0 1.8 5.0 1 1 398 1 . . . . . 2.0 1.8 5.0 1 1 399 1 . . . . . 2.0 1.8 5.0 1 1 400 1 . . . . . 2.0 1.8 4.0 1 1 401 1 . . . . . 2.0 1.8 5.0 1 1 402 1 . . . . . 2.0 1.8 5.5 1 1 403 1 . . . . . 2.0 1.8 5.5 1 1 404 1 . . . . . 2.0 1.8 4.0 1 1 405 1 . . . . . 2.0 1.8 5.0 1 1 406 1 . . . . . 2.0 1.8 5.5 1 1 407 1 . . . . . 2.0 1.8 6.0 1 1 408 1 . . . . . 2.0 1.8 5.5 1 1 409 1 . . . . . 2.0 1.8 4.0 1 1 410 1 . . . . . 2.0 1.8 5.0 1 1 411 1 . . . . . 2.0 1.8 4.5 1 1 412 1 . . . . . 2.0 1.8 4.0 1 1 413 1 . . . . . 2.0 1.8 4.0 1 1 414 1 . . . . . 2.0 1.8 5.5 1 1 415 1 . . . . . 2.0 1.8 4.0 1 1 416 1 . . . . . 2.0 1.8 5.5 1 1 417 1 . . . . . 2.0 1.8 4.5 1 1 418 1 . . . . . 2.0 1.8 4.0 1 1 419 1 . . . . . 2.0 1.8 5.0 1 1 420 1 . . . . . 2.0 1.8 5.0 1 1 421 1 . . . . . 2.0 1.8 5.0 1 1 422 1 . . . . . 2.0 1.8 5.0 1 1 423 1 . . . . . 2.0 1.8 4.5 1 1 424 1 . . . . . 2.0 1.8 4.0 1 1 425 1 . . . . . 2.0 1.8 5.0 1 1 426 1 . . . . . 2.0 1.8 5.0 1 1 427 1 . . . . . 2.0 1.8 5.0 1 1 428 1 . . . . . 2.0 1.8 5.0 1 1 429 1 . . . . . 2.0 1.8 5.0 1 1 430 1 . . . . . 2.0 1.8 5.0 1 1 431 1 . . . . . 2.0 1.8 7.0 1 1 432 1 . . . . . 2.0 1.8 5.5 1 1 433 1 . . . . . 2.0 1.8 5.5 1 1 434 1 . . . . . 2.0 1.8 5.5 1 1 435 1 . . . . . 2.0 1.8 5.5 1 1 436 1 . . . . . 2.0 1.8 4.5 1 1 437 1 . . . . . 2.0 1.8 4.5 1 1 438 1 . . . . . 2.0 1.8 4.5 1 1 439 1 . . . . . 2.0 1.8 4.0 1 1 440 1 . . . . . 2.0 1.8 4.0 1 1 441 1 . . . . . 2.0 1.8 5.0 1 1 442 1 . . . . . 2.0 1.8 5.0 1 1 443 1 . . . . . 2.0 1.8 4.0 1 1 444 1 . . . . . 2.0 1.8 4.0 1 1 445 1 . . . . . 2.0 1.8 4.0 1 1 446 1 . . . . . 2.0 1.8 5.0 1 1 447 1 . . . . . 2.0 1.8 4.0 1 1 448 1 . . . . . 2.0 1.8 4.0 1 1 449 1 . . . . . 2.0 1.8 4.0 1 1 450 1 . . . . . 2.0 1.8 5.0 1 1 451 1 . . . . . 2.0 1.8 5.0 1 1 452 1 . . . . . 2.0 1.8 4.0 1 1 453 1 . . . . . 2.0 1.8 5.0 1 1 454 1 . . . . . 2.0 1.8 5.0 1 1 455 1 . . . . . 2.0 1.8 5.0 1 1 456 1 . . . . . 2.0 1.8 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613 1 . . . . . 2.0 1.8 5.0 1 1 614 1 . . . . . 2.0 1.8 5.0 1 1 615 1 . . . . . 2.0 1.8 4.0 1 1 616 1 . . . . . 2.0 1.8 5.0 1 1 617 1 . . . . . 2.0 1.8 4.0 1 1 618 1 . . . . . 2.0 1.8 5.0 1 1 619 1 . . . . . 2.0 1.8 7.0 1 1 620 1 . . . . . 2.0 1.8 5.0 1 1 621 1 . . . . . 2.0 1.8 6.0 1 1 622 1 . . . . . 2.0 1.8 5.0 1 1 623 1 . . . . . 2.0 1.8 5.0 1 1 624 1 . . . . . 2.0 1.8 5.0 1 1 625 1 . . . . . 2.0 1.8 6.0 1 1 626 1 . . . . . 2.0 1.8 5.0 1 1 627 1 . . . . . 2.0 1.8 5.0 1 1 628 1 . . . . . 2.0 1.8 5.0 1 1 629 1 . . . . . 2.0 1.8 5.0 1 1 630 1 . . . . . 2.0 1.8 7.0 1 1 631 1 . . . . . 2.0 1.8 5.0 1 1 632 1 . . . . . 2.0 1.8 4.0 1 1 633 1 . . . . . 2.0 1.8 5.0 1 1 634 1 . . . . . 2.0 1.8 5.0 1 1 635 1 . . . . . 2.0 1.8 4.0 1 1 636 1 . . . . . 2.0 1.8 5.0 1 1 637 1 . . . . . 2.0 1.8 4.0 1 1 638 1 . . . . . 2.0 1.8 4.0 1 1 639 1 . . . . . 2.0 1.8 7.0 1 1 640 1 . . . . . 2.0 1.8 5.0 1 1 641 1 . . . . . 2.0 1.8 5.5 1 1 642 1 . . . . . 2.0 1.8 4.0 1 1 643 1 . . . . . 2.0 1.8 4.0 1 1 644 1 . . . . . 2.0 1.8 5.0 1 1 645 1 . . . . . 2.0 1.8 6.0 1 1 646 1 . . . . . 2.0 1.8 7.0 1 1 647 1 . . . . . 2.0 1.8 5.0 1 1 648 1 . . . . . 2.0 1.8 8.5 1 1 649 1 . . . . . 2.0 1.8 5.0 1 1 650 1 . . . . . 2.0 1.8 4.0 1 1 651 1 . . . . . 2.0 1.8 4.0 1 1 652 1 . . . . . 2.0 1.8 5.0 1 1 653 1 . . . . . 2.0 1.8 5.0 1 1 654 1 . . . . . 2.0 1.8 4.0 1 1 655 1 . . . . . 2.0 1.8 3.0 1 1 656 1 . . . . . 2.0 1.8 4.0 1 1 657 1 . . . . . 2.0 1.8 5.0 1 1 658 1 . . . . . 2.0 1.8 5.0 1 1 659 1 . . . . . 2.0 1.8 4.5 1 1 660 1 . . . . . 2.0 1.8 5.0 1 1 661 1 . . . . . 2.0 1.8 4.0 1 1 662 1 . . . . . 2.0 1.8 4.0 1 1 663 1 . . . . . 2.0 1.8 5.0 1 1 664 1 . . . . . 2.0 1.8 5.0 1 1 665 1 . . . . . 2.0 1.8 5.0 1 1 666 1 . . . . . 2.0 1.8 4.0 1 1 667 1 . . . . . 2.0 1.8 4.0 1 1 668 1 . . . . . 2.0 1.8 5.5 1 1 669 1 . . . . . 2.0 1.8 5.0 1 1 670 1 . . . . . 2.0 1.8 5.0 1 1 671 1 . . . . . 2.0 1.8 6.0 1 1 672 1 . . . . . 2.0 1.8 5.0 1 1 673 1 . . . . . 2.0 1.8 6.0 1 1 674 1 . . . . . 2.0 1.8 5.0 1 1 675 1 . . . . . 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4.5 1 1 707 1 . . . . . 2.0 1.8 4.5 1 1 708 1 . . . . . 2.0 1.8 5.5 1 1 709 1 . . . . . 2.0 1.8 5.5 1 1 710 1 . . . . . 2.0 1.8 5.5 1 1 711 1 . . . . . 2.0 1.8 5.5 1 1 712 1 . . . . . 2.0 1.8 4.0 1 1 713 1 . . . . . 2.0 1.8 5.0 1 1 714 1 . . . . . 2.0 1.8 4.0 1 1 715 1 . . . . . 2.0 1.8 5.0 1 1 716 1 . . . . . 2.0 1.8 5.0 1 1 717 1 . . . . . 2.0 1.8 5.0 1 1 718 1 . . . . . 2.0 1.8 5.0 1 1 719 1 . . . . . 2.0 1.8 5.0 1 1 720 1 . . . . . 2.0 1.8 5.0 1 1 721 1 . . . . . 2.0 1.8 4.0 1 1 722 1 . . . . . 2.0 1.8 5.0 1 1 723 1 . . . . . 2.0 1.8 4.0 1 1 724 1 . . . . . 2.0 1.8 5.0 1 1 725 1 . . . . . 2.0 1.8 5.0 1 1 726 1 . . . . . 2.0 1.8 4.0 1 1 727 1 . . . . . 2.0 1.8 5.0 1 1 728 1 . . . . . 2.0 1.8 5.0 1 1 729 1 . . . . . 2.0 1.8 5.0 1 1 730 1 . . . . . 2.0 1.8 6.5 1 1 731 1 . . . . . 2.0 1.8 4.0 1 1 732 1 . . . . . 2.0 1.8 4.0 1 1 733 1 . . . . . 2.0 1.8 5.0 1 1 734 1 . . . . . 2.0 1.8 5.0 1 1 735 1 . . . . . 2.0 1.8 5.0 1 1 736 1 . . . . . 2.0 1.8 5.0 1 1 737 1 . . . . . 2.0 1.8 4.5 1 1 738 1 . . . . . 2.0 1.8 5.0 1 1 739 1 . . . . . 2.0 1.8 4.5 1 1 740 1 . . . . . 2.0 1.8 5.0 1 1 741 1 . . . . . 2.0 1.8 5.0 1 1 742 1 . . . . . 2.0 1.8 4.5 1 1 743 1 . . . . . 2.0 1.8 5.0 1 1 744 1 . . . . . 2.0 1.8 4.0 1 1 745 1 . . . . . 2.0 1.8 4.0 1 1 746 1 . . . . . 2.0 1.8 4.0 1 1 747 1 . . . . . 2.0 1.8 5.0 1 1 748 1 . . . . . 2.0 1.8 5.0 1 1 749 1 . . . . . 2.0 1.8 4.0 1 1 750 1 . . . . . 2.0 1.8 4.0 1 1 751 1 . . . . . 2.0 1.8 5.0 1 1 752 1 . . . . . 2.0 1.8 5.0 1 1 753 1 . . . . . 2.0 1.8 4.0 1 1 754 1 . . . . . 2.0 1.8 4.0 1 1 755 1 . . . . . 2.0 1.8 5.0 1 1 756 1 . . . . . 2.0 1.8 5.5 1 1 757 1 . . . . . 2.0 1.8 4.5 1 1 758 1 . . . . . 2.0 1.8 5.0 1 1 759 1 . . . . . 2.0 1.8 5.0 1 1 760 1 . . . . . 2.0 1.8 6.0 1 1 761 1 . . . . . 2.0 1.8 4.0 1 1 762 1 . . . . . 2.0 1.8 4.0 1 1 763 1 . . . . . 2.0 1.8 5.0 1 1 764 1 . . . . . 2.0 1.8 4.0 1 1 765 1 . . . . . 2.0 1.8 5.0 1 1 766 1 . . . . . 2.0 1.8 6.4 1 1 767 1 . . . . . 2.0 1.8 5.0 1 1 768 1 . . . . . 2.0 1.8 5.4 1 1 769 1 . . . . . 2.0 1.8 6.4 1 1 770 1 . . . . . 2.0 1.8 4.0 1 1 771 1 . . . . . 2.0 1.8 5.4 1 1 772 1 . . . . . 2.0 1.8 5.0 1 1 773 1 . . . . . 2.0 1.8 4.0 1 1 774 1 . . . . . 2.0 1.8 5.0 1 1 775 1 . . . . . 2.0 1.8 5.0 1 1 776 1 . . . . . 2.0 1.8 5.0 1 1 777 1 . . . . . 2.0 1.8 4.0 1 1 778 1 . . . . . 2.0 1.8 5.0 1 1 779 1 . . . . . 2.0 1.8 5.0 1 1 780 1 . . . . . 2.0 1.8 5.0 1 1 781 1 . . . . . 2.0 1.8 5.0 1 1 782 1 . . . . . 2.0 1.8 5.0 1 1 783 1 . . . . . 2.0 1.8 6.0 1 1 784 1 . . . . . 2.0 1.8 4.0 1 1 785 1 . . . . . 2.0 1.8 4.0 1 1 786 1 . . . . . 2.0 1.8 5.0 1 1 787 1 . . . . . 2.0 1.8 5.0 1 1 788 1 . . . . . 2.0 1.8 5.5 1 1 789 1 . . . . . 2.0 1.8 5.0 1 1 790 1 . . . . . 2.0 1.8 4.0 1 1 791 1 . . . . . 2.0 1.8 4.0 1 1 792 1 . . . . . 2.0 1.8 4.0 1 1 793 1 . . . . . 2.0 1.8 5.0 1 1 794 1 . . . . . 2.0 1.8 4.0 1 1 795 1 . . . . . 2.0 1.8 5.0 1 1 796 1 . . . . . 2.0 1.8 5.0 1 1 797 1 . . . . . 2.0 1.8 5.0 1 1 798 1 . . . . . 2.0 1.8 4.0 1 1 799 1 . . . . . 2.0 1.8 5.0 1 1 800 1 . . . . . 2.0 1.8 5.5 1 1 801 1 . . . . . 2.0 1.8 4.0 1 1 802 1 . . . . . 2.0 1.8 5.0 1 1 803 1 . . . . . 2.0 1.8 5.5 1 1 804 1 . . . . . 2.0 1.8 6.0 1 1 805 1 . . . . . 2.0 1.8 4.0 1 1 806 1 . . . . . 2.0 1.8 5.0 1 1 807 1 . . . . . 2.0 1.8 4.5 1 1 808 1 . . . . . 2.0 1.8 4.0 1 1 809 1 . . . . . 2.0 1.8 4.0 1 1 810 1 . . . . . 2.0 1.8 4.0 1 1 811 1 . . . . . 2.0 1.8 5.5 1 1 812 1 . . . . . 2.0 1.8 4.5 1 1 813 1 . . . . . 2.0 1.8 4.0 1 1 814 1 . . . . . 2.0 1.8 5.0 1 1 815 1 . . . . . 2.0 1.8 5.0 1 1 816 1 . . . . . 2.0 1.8 5.0 1 1 817 1 . . . . . 2.0 1.8 5.0 1 1 818 1 . . . . . 2.0 1.8 4.5 1 1 819 1 . . . . . 2.0 1.8 4.0 1 1 820 1 . . . . . 2.0 1.8 5.0 1 1 821 1 . . . . . 2.0 1.8 5.0 1 1 822 1 . . . . . 2.0 1.8 5.0 1 1 823 1 . . . . . 2.0 1.8 5.0 1 1 824 1 . . . . . 2.0 1.8 5.0 1 1 825 1 . . . . . 2.0 1.8 7.0 1 1 826 1 . . . . . 2.0 1.8 5.5 1 1 827 1 . . . . . 2.0 1.8 5.5 1 1 828 1 . . . . . 2.0 1.8 4.5 1 1 829 1 . . . . . 2.0 1.8 4.5 1 1 830 1 . . . . . 2.0 1.8 4.5 1 1 831 1 . . . . . 2.0 1.8 4.0 1 1 832 1 . . . . . 2.0 1.8 4.0 1 1 833 1 . . . . . 2.0 1.8 5.0 1 1 834 1 . . . . . 2.0 1.8 5.0 1 1 835 1 . . . . . 2.0 1.8 4.0 1 1 836 1 . . . . . 2.0 1.8 4.0 1 1 837 1 . . . . . 2.0 1.8 4.0 1 1 838 1 . . . . . 2.0 1.8 5.0 1 1 839 1 . . . . . 2.0 1.8 4.0 1 1 840 1 . . . . . 2.0 1.8 4.0 1 1 841 1 . . . . . 2.0 1.8 4.0 1 1 842 1 . . . . . 2.0 1.8 5.0 1 1 843 1 . . . . . 2.0 1.8 5.0 1 1 844 1 . . . . . 2.0 1.8 4.0 1 1 845 1 . . . . . 2.0 1.8 5.0 1 1 846 1 . . . . . 2.0 1.8 5.0 1 1 847 1 . . . . . 2.0 1.8 5.0 1 1 848 1 . . . . . 2.0 1.8 4.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C -7.600 12.295 5.000 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -9.082 12.100 5.326 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -8.573 10.836 6.901 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -10.206 11.305 6.888 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -9.009 12.402 7.385 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -9.508 11.370 4.653 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -9.598 13.041 5.208 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -9.228 11.625 6.731 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -6.970 13.225 5.463 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 ILE C C -4.739 11.403 5.109 1.00 . A A . 2 ILE C 1 1 1 11 1 1 2 ILE CA C -5.594 11.565 3.852 1.00 . A A . 2 ILE CA 1 1 1 12 1 1 2 ILE CB C -5.351 12.950 3.250 1.00 . A A . 2 ILE CB 1 1 1 13 1 1 2 ILE CD1 C -6.906 14.568 2.154 1.00 . A A . 2 ILE CD1 1 1 1 14 1 1 2 ILE CG1 C -6.298 13.167 2.068 1.00 . A A . 2 ILE CG1 1 1 1 15 1 1 2 ILE CG2 C -3.904 13.053 2.765 1.00 . A A . 2 ILE CG2 1 1 1 16 1 1 2 ILE H H -7.560 10.682 3.841 1.00 . A A . 2 ILE H 1 1 1 17 1 1 2 ILE HA H -5.325 10.807 3.131 1.00 . A A . 2 ILE HA 1 1 1 18 1 1 2 ILE HB H -5.532 13.705 4.001 1.00 . A A . 2 ILE HB 1 1 1 19 1 1 2 ILE HD11 H -6.401 15.131 2.925 1.00 . A A . 2 ILE HD11 1 1 1 20 1 1 2 ILE HD12 H -7.956 14.491 2.394 1.00 . A A . 2 ILE HD12 1 1 1 21 1 1 2 ILE HD13 H -6.789 15.071 1.205 1.00 . A A . 2 ILE HD13 1 1 1 22 1 1 2 ILE HG12 H -5.747 13.068 1.142 1.00 . A A . 2 ILE HG12 1 1 1 23 1 1 2 ILE HG13 H -7.089 12.430 2.099 1.00 . A A . 2 ILE HG13 1 1 1 24 1 1 2 ILE HG21 H -3.531 14.050 2.954 1.00 . A A . 2 ILE HG21 1 1 1 25 1 1 2 ILE HG22 H -3.864 12.849 1.705 1.00 . A A . 2 ILE HG22 1 1 1 26 1 1 2 ILE HG23 H -3.294 12.336 3.294 1.00 . A A . 2 ILE HG23 1 1 1 27 1 1 2 ILE N N -7.036 11.425 4.206 1.00 . A A . 2 ILE N 1 1 1 28 1 1 2 ILE O O -4.994 12.011 6.129 1.00 . A A . 2 ILE O 1 1 1 29 1 1 3 GLY C C -2.332 8.957 6.270 1.00 . A A . 3 GLY C 1 1 1 30 1 1 3 GLY CA C -2.849 10.395 6.235 1.00 . A A . 3 GLY CA 1 1 1 31 1 1 3 GLY H H -3.529 10.109 4.211 1.00 . A A . 3 GLY H 1 1 1 32 1 1 3 GLY HA2 H -2.014 11.077 6.182 1.00 . A A . 3 GLY HA2 1 1 1 33 1 1 3 GLY HA3 H -3.417 10.590 7.132 1.00 . A A . 3 GLY HA3 1 1 1 34 1 1 3 GLY N N -3.721 10.589 5.044 1.00 . A A . 3 GLY N 1 1 1 35 1 1 3 GLY O O -1.410 8.637 6.995 1.00 . A A . 3 GLY O 1 1 1 36 1 1 4 LYS C C -1.941 6.304 4.095 1.00 . A A . 4 LYS C 1 1 1 37 1 1 4 LYS CA C -2.450 6.668 5.489 1.00 . A A . 4 LYS CA 1 1 1 38 1 1 4 LYS CB C -3.597 5.714 5.864 1.00 . A A . 4 LYS CB 1 1 1 39 1 1 4 LYS CD C -4.709 7.139 7.606 1.00 . A A . 4 LYS CD 1 1 1 40 1 1 4 LYS CE C -4.268 6.082 8.621 1.00 . A A . 4 LYS CE 1 1 1 41 1 1 4 LYS CG C -4.865 6.499 6.223 1.00 . A A . 4 LYS CG 1 1 1 42 1 1 4 LYS H H -3.656 8.363 4.915 1.00 . A A . 4 LYS H 1 1 1 43 1 1 4 LYS HA H -1.646 6.556 6.201 1.00 . A A . 4 LYS HA 1 1 1 44 1 1 4 LYS HB2 H -3.807 5.067 5.025 1.00 . A A . 4 LYS HB2 1 1 1 45 1 1 4 LYS HB3 H -3.298 5.113 6.709 1.00 . A A . 4 LYS HB3 1 1 1 46 1 1 4 LYS HD2 H -3.969 7.923 7.559 1.00 . A A . 4 LYS HD2 1 1 1 47 1 1 4 LYS HD3 H -5.655 7.557 7.915 1.00 . A A . 4 LYS HD3 1 1 1 48 1 1 4 LYS HE2 H -4.897 5.208 8.530 1.00 . A A . 4 LYS HE2 1 1 1 49 1 1 4 LYS HE3 H -3.241 5.808 8.433 1.00 . A A . 4 LYS HE3 1 1 1 50 1 1 4 LYS HG2 H -5.031 7.270 5.486 1.00 . A A . 4 LYS HG2 1 1 1 51 1 1 4 LYS HG3 H -5.709 5.827 6.235 1.00 . A A . 4 LYS HG3 1 1 1 52 1 1 4 LYS HZ1 H -4.223 5.885 10.694 1.00 . A A . 4 LYS HZ1 1 1 1 53 1 1 4 LYS HZ2 H -5.342 7.033 10.131 1.00 . A A . 4 LYS HZ2 1 1 1 54 1 1 4 LYS HZ3 H -3.681 7.390 10.131 1.00 . A A . 4 LYS HZ3 1 1 1 55 1 1 4 LYS N N -2.916 8.086 5.494 1.00 . A A . 4 LYS N 1 1 1 56 1 1 4 LYS NZ N -4.388 6.639 9.998 1.00 . A A . 4 LYS NZ 1 1 1 57 1 1 4 LYS O O -1.205 5.355 3.924 1.00 . A A . 4 LYS O 1 1 1 58 1 1 5 TYR C C -0.561 7.439 1.433 1.00 . A A . 5 TYR C 1 1 1 59 1 1 5 TYR CA C -1.881 6.727 1.717 1.00 . A A . 5 TYR CA 1 1 1 60 1 1 5 TYR CB C -2.955 7.175 0.726 1.00 . A A . 5 TYR CB 1 1 1 61 1 1 5 TYR CD1 C -4.971 5.799 1.346 1.00 . A A . 5 TYR CD1 1 1 1 62 1 1 5 TYR CD2 C -4.930 8.143 1.968 1.00 . A A . 5 TYR CD2 1 1 1 63 1 1 5 TYR CE1 C -6.233 5.662 1.934 1.00 . A A . 5 TYR CE1 1 1 1 64 1 1 5 TYR CE2 C -6.194 8.006 2.558 1.00 . A A . 5 TYR CE2 1 1 1 65 1 1 5 TYR CG C -4.319 7.038 1.362 1.00 . A A . 5 TYR CG 1 1 1 66 1 1 5 TYR CZ C -6.845 6.766 2.541 1.00 . A A . 5 TYR CZ 1 1 1 67 1 1 5 TYR H H -2.935 7.797 3.244 1.00 . A A . 5 TYR H 1 1 1 68 1 1 5 TYR HA H -1.730 5.668 1.624 1.00 . A A . 5 TYR HA 1 1 1 69 1 1 5 TYR HB2 H -2.785 8.204 0.444 1.00 . A A . 5 TYR HB2 1 1 1 70 1 1 5 TYR HB3 H -2.910 6.547 -0.144 1.00 . A A . 5 TYR HB3 1 1 1 71 1 1 5 TYR HD1 H -4.499 4.949 0.878 1.00 . A A . 5 TYR HD1 1 1 1 72 1 1 5 TYR HD2 H -4.427 9.099 1.981 1.00 . A A . 5 TYR HD2 1 1 1 73 1 1 5 TYR HE1 H -6.733 4.704 1.919 1.00 . A A . 5 TYR HE1 1 1 1 74 1 1 5 TYR HE2 H -6.666 8.858 3.026 1.00 . A A . 5 TYR HE2 1 1 1 75 1 1 5 TYR HH H -8.468 7.508 3.220 1.00 . A A . 5 TYR HH 1 1 1 76 1 1 5 TYR N N -2.334 7.041 3.094 1.00 . A A . 5 TYR N 1 1 1 77 1 1 5 TYR O O 0.222 7.008 0.611 1.00 . A A . 5 TYR O 1 1 1 78 1 1 5 TYR OH O -8.090 6.631 3.123 1.00 . A A . 5 TYR OH 1 1 1 79 1 1 6 LEU C C 1.798 9.226 3.172 1.00 . A A . 6 LEU C 1 1 1 80 1 1 6 LEU CA C 0.987 9.234 1.880 1.00 . A A . 6 LEU CA 1 1 1 81 1 1 6 LEU CB C 0.694 10.670 1.446 1.00 . A A . 6 LEU CB 1 1 1 82 1 1 6 LEU CD1 C -0.551 12.009 -0.259 1.00 . A A . 6 LEU CD1 1 1 1 83 1 1 6 LEU CD2 C -0.392 9.529 -0.514 1.00 . A A . 6 LEU CD2 1 1 1 84 1 1 6 LEU CG C -0.509 10.680 0.497 1.00 . A A . 6 LEU CG 1 1 1 85 1 1 6 LEU H H -0.932 8.848 2.780 1.00 . A A . 6 LEU H 1 1 1 86 1 1 6 LEU HA H 1.547 8.730 1.106 1.00 . A A . 6 LEU HA 1 1 1 87 1 1 6 LEU HB2 H 0.470 11.269 2.318 1.00 . A A . 6 LEU HB2 1 1 1 88 1 1 6 LEU HB3 H 1.555 11.078 0.939 1.00 . A A . 6 LEU HB3 1 1 1 89 1 1 6 LEU HD11 H -0.654 11.818 -1.317 1.00 . A A . 6 LEU HD11 1 1 1 90 1 1 6 LEU HD12 H 0.364 12.554 -0.078 1.00 . A A . 6 LEU HD12 1 1 1 91 1 1 6 LEU HD13 H -1.392 12.592 0.085 1.00 . A A . 6 LEU HD13 1 1 1 92 1 1 6 LEU HD21 H -1.176 8.810 -0.336 1.00 . A A . 6 LEU HD21 1 1 1 93 1 1 6 LEU HD22 H 0.570 9.044 -0.406 1.00 . A A . 6 LEU HD22 1 1 1 94 1 1 6 LEU HD23 H -0.485 9.922 -1.515 1.00 . A A . 6 LEU HD23 1 1 1 95 1 1 6 LEU HG H -1.417 10.567 1.072 1.00 . A A . 6 LEU HG 1 1 1 96 1 1 6 LEU N N -0.295 8.516 2.112 1.00 . A A . 6 LEU N 1 1 1 97 1 1 6 LEU O O 2.741 9.974 3.336 1.00 . A A . 6 LEU O 1 1 1 98 1 1 7 HIS C C 2.096 6.864 5.903 1.00 . A A . 7 HIS C 1 1 1 99 1 1 7 HIS CA C 2.168 8.299 5.379 1.00 . A A . 7 HIS CA 1 1 1 100 1 1 7 HIS CB C 1.531 9.257 6.397 1.00 . A A . 7 HIS CB 1 1 1 101 1 1 7 HIS CD2 C -0.293 10.302 4.826 1.00 . A A . 7 HIS CD2 1 1 1 102 1 1 7 HIS CE1 C 0.311 12.376 4.963 1.00 . A A . 7 HIS CE1 1 1 1 103 1 1 7 HIS CG C 0.789 10.345 5.667 1.00 . A A . 7 HIS CG 1 1 1 104 1 1 7 HIS H H 0.666 7.788 3.928 1.00 . A A . 7 HIS H 1 1 1 105 1 1 7 HIS HA H 3.200 8.573 5.222 1.00 . A A . 7 HIS HA 1 1 1 106 1 1 7 HIS HB2 H 0.843 8.709 7.024 1.00 . A A . 7 HIS HB2 1 1 1 107 1 1 7 HIS HB3 H 2.304 9.697 7.010 1.00 . A A . 7 HIS HB3 1 1 1 108 1 1 7 HIS HD1 H 1.899 12.046 6.268 1.00 . A A . 7 HIS HD1 1 1 1 109 1 1 7 HIS HD2 H -0.829 9.407 4.549 1.00 . A A . 7 HIS HD2 1 1 1 110 1 1 7 HIS HE1 H 0.362 13.444 4.816 1.00 . A A . 7 HIS HE1 1 1 1 111 1 1 7 HIS N N 1.431 8.377 4.089 1.00 . A A . 7 HIS N 1 1 1 112 1 1 7 HIS ND1 N 1.158 11.678 5.742 1.00 . A A . 7 HIS ND1 1 1 1 113 1 1 7 HIS NE2 N -0.594 11.585 4.382 1.00 . A A . 7 HIS NE2 1 1 1 114 1 1 7 HIS O O 2.410 6.594 7.046 1.00 . A A . 7 HIS O 1 1 1 115 1 1 8 SER C C 1.453 3.612 4.305 1.00 . A A . 8 SER C 1 1 1 116 1 1 8 SER CA C 1.597 4.523 5.523 1.00 . A A . 8 SER CA 1 1 1 117 1 1 8 SER CB C 0.384 4.354 6.436 1.00 . A A . 8 SER CB 1 1 1 118 1 1 8 SER H H 1.438 6.174 4.154 1.00 . A A . 8 SER H 1 1 1 119 1 1 8 SER HA H 2.494 4.261 6.060 1.00 . A A . 8 SER HA 1 1 1 120 1 1 8 SER HB2 H -0.228 5.239 6.392 1.00 . A A . 8 SER HB2 1 1 1 121 1 1 8 SER HB3 H -0.195 3.501 6.109 1.00 . A A . 8 SER HB3 1 1 1 122 1 1 8 SER HG H 0.591 3.265 8.033 1.00 . A A . 8 SER HG 1 1 1 123 1 1 8 SER N N 1.686 5.938 5.074 1.00 . A A . 8 SER N 1 1 1 124 1 1 8 SER O O 2.001 2.528 4.262 1.00 . A A . 8 SER O 1 1 1 125 1 1 8 SER OG O 0.827 4.157 7.772 1.00 . A A . 8 SER OG 1 1 1 126 1 1 9 ALA C C 1.909 3.013 1.429 1.00 . A A . 9 ALA C 1 1 1 127 1 1 9 ALA CA C 0.555 3.195 2.101 1.00 . A A . 9 ALA CA 1 1 1 128 1 1 9 ALA CB C -0.404 3.868 1.125 1.00 . A A . 9 ALA CB 1 1 1 129 1 1 9 ALA H H 0.292 4.920 3.365 1.00 . A A . 9 ALA H 1 1 1 130 1 1 9 ALA HA H 0.161 2.230 2.387 1.00 . A A . 9 ALA HA 1 1 1 131 1 1 9 ALA HB1 H -1.403 3.854 1.534 1.00 . A A . 9 ALA HB1 1 1 1 132 1 1 9 ALA HB2 H -0.393 3.334 0.185 1.00 . A A . 9 ALA HB2 1 1 1 133 1 1 9 ALA HB3 H -0.095 4.892 0.960 1.00 . A A . 9 ALA HB3 1 1 1 134 1 1 9 ALA N N 0.724 4.041 3.313 1.00 . A A . 9 ALA N 1 1 1 135 1 1 9 ALA O O 2.406 1.911 1.325 1.00 . A A . 9 ALA O 1 1 1 136 1 1 10 LYS C C 4.684 2.904 1.012 1.00 . A A . 10 LYS C 1 1 1 137 1 1 10 LYS CA C 3.841 3.966 0.302 1.00 . A A . 10 LYS CA 1 1 1 138 1 1 10 LYS CB C 4.576 5.301 0.364 1.00 . A A . 10 LYS CB 1 1 1 139 1 1 10 LYS CD C 5.706 6.941 -1.142 1.00 . A A . 10 LYS CD 1 1 1 140 1 1 10 LYS CE C 6.995 6.145 -1.348 1.00 . A A . 10 LYS CE 1 1 1 141 1 1 10 LYS CG C 4.527 5.975 -1.006 1.00 . A A . 10 LYS CG 1 1 1 142 1 1 10 LYS H H 2.076 4.970 1.063 1.00 . A A . 10 LYS H 1 1 1 143 1 1 10 LYS HA H 3.700 3.681 -0.730 1.00 . A A . 10 LYS HA 1 1 1 144 1 1 10 LYS HB2 H 4.106 5.938 1.099 1.00 . A A . 10 LYS HB2 1 1 1 145 1 1 10 LYS HB3 H 5.606 5.127 0.641 1.00 . A A . 10 LYS HB3 1 1 1 146 1 1 10 LYS HD2 H 5.543 7.591 -1.989 1.00 . A A . 10 LYS HD2 1 1 1 147 1 1 10 LYS HD3 H 5.791 7.534 -0.244 1.00 . A A . 10 LYS HD3 1 1 1 148 1 1 10 LYS HE2 H 7.684 6.359 -0.544 1.00 . A A . 10 LYS HE2 1 1 1 149 1 1 10 LYS HE3 H 6.768 5.089 -1.355 1.00 . A A . 10 LYS HE3 1 1 1 150 1 1 10 LYS HG2 H 4.586 5.222 -1.779 1.00 . A A . 10 LYS HG2 1 1 1 151 1 1 10 LYS HG3 H 3.603 6.519 -1.105 1.00 . A A . 10 LYS HG3 1 1 1 152 1 1 10 LYS HZ1 H 8.600 6.197 -2.674 1.00 . A A . 10 LYS HZ1 1 1 1 153 1 1 10 LYS HZ2 H 7.593 7.563 -2.750 1.00 . A A . 10 LYS HZ2 1 1 1 154 1 1 10 LYS HZ3 H 7.084 6.091 -3.428 1.00 . A A . 10 LYS HZ3 1 1 1 155 1 1 10 LYS N N 2.508 4.085 0.971 1.00 . A A . 10 LYS N 1 1 1 156 1 1 10 LYS NZ N 7.615 6.528 -2.648 1.00 . A A . 10 LYS NZ 1 1 1 157 1 1 10 LYS O O 5.158 1.968 0.400 1.00 . A A . 10 LYS O 1 1 1 158 1 1 11 LYS C C 5.238 0.631 2.578 1.00 . A A . 11 LYS C 1 1 1 159 1 1 11 LYS CA C 5.665 2.021 3.043 1.00 . A A . 11 LYS CA 1 1 1 160 1 1 11 LYS CB C 5.407 2.162 4.546 1.00 . A A . 11 LYS CB 1 1 1 161 1 1 11 LYS CD C 7.651 2.504 5.592 1.00 . A A . 11 LYS CD 1 1 1 162 1 1 11 LYS CE C 8.682 3.555 6.009 1.00 . A A . 11 LYS CE 1 1 1 163 1 1 11 LYS CG C 6.366 3.198 5.136 1.00 . A A . 11 LYS CG 1 1 1 164 1 1 11 LYS H H 4.467 3.793 2.778 1.00 . A A . 11 LYS H 1 1 1 165 1 1 11 LYS HA H 6.717 2.165 2.838 1.00 . A A . 11 LYS HA 1 1 1 166 1 1 11 LYS HB2 H 4.387 2.481 4.706 1.00 . A A . 11 LYS HB2 1 1 1 167 1 1 11 LYS HB3 H 5.567 1.210 5.029 1.00 . A A . 11 LYS HB3 1 1 1 168 1 1 11 LYS HD2 H 7.433 1.860 6.432 1.00 . A A . 11 LYS HD2 1 1 1 169 1 1 11 LYS HD3 H 8.049 1.914 4.780 1.00 . A A . 11 LYS HD3 1 1 1 170 1 1 11 LYS HE2 H 9.242 3.873 5.143 1.00 . A A . 11 LYS HE2 1 1 1 171 1 1 11 LYS HE3 H 8.175 4.404 6.442 1.00 . A A . 11 LYS HE3 1 1 1 172 1 1 11 LYS HG2 H 6.602 3.939 4.386 1.00 . A A . 11 LYS HG2 1 1 1 173 1 1 11 LYS HG3 H 5.898 3.679 5.983 1.00 . A A . 11 LYS HG3 1 1 1 174 1 1 11 LYS HZ1 H 10.165 2.206 6.572 1.00 . A A . 11 LYS HZ1 1 1 1 175 1 1 11 LYS HZ2 H 9.064 2.581 7.810 1.00 . A A . 11 LYS HZ2 1 1 1 176 1 1 11 LYS HZ3 H 10.258 3.704 7.363 1.00 . A A . 11 LYS HZ3 1 1 1 177 1 1 11 LYS N N 4.865 3.035 2.301 1.00 . A A . 11 LYS N 1 1 1 178 1 1 11 LYS NZ N 9.612 2.967 7.015 1.00 . A A . 11 LYS NZ 1 1 1 179 1 1 11 LYS O O 5.987 -0.074 1.931 1.00 . A A . 11 LYS O 1 1 1 180 1 1 12 PHE C C 3.625 -1.139 0.904 1.00 . A A . 12 PHE C 1 1 1 181 1 1 12 PHE CA C 3.556 -1.095 2.430 1.00 . A A . 12 PHE CA 1 1 1 182 1 1 12 PHE CB C 2.110 -1.313 2.886 1.00 . A A . 12 PHE CB 1 1 1 183 1 1 12 PHE CD1 C 2.888 -1.233 5.283 1.00 . A A . 12 PHE CD1 1 1 1 184 1 1 12 PHE CD2 C 0.873 -0.032 4.671 1.00 . A A . 12 PHE CD2 1 1 1 185 1 1 12 PHE CE1 C 2.743 -0.802 6.607 1.00 . A A . 12 PHE CE1 1 1 1 186 1 1 12 PHE CE2 C 0.728 0.399 5.996 1.00 . A A . 12 PHE CE2 1 1 1 187 1 1 12 PHE CG C 1.954 -0.848 4.314 1.00 . A A . 12 PHE CG 1 1 1 188 1 1 12 PHE CZ C 1.663 0.014 6.964 1.00 . A A . 12 PHE CZ 1 1 1 189 1 1 12 PHE H H 3.434 0.826 3.388 1.00 . A A . 12 PHE H 1 1 1 190 1 1 12 PHE HA H 4.189 -1.866 2.845 1.00 . A A . 12 PHE HA 1 1 1 191 1 1 12 PHE HB2 H 1.443 -0.748 2.249 1.00 . A A . 12 PHE HB2 1 1 1 192 1 1 12 PHE HB3 H 1.868 -2.365 2.822 1.00 . A A . 12 PHE HB3 1 1 1 193 1 1 12 PHE HD1 H 3.722 -1.863 5.008 1.00 . A A . 12 PHE HD1 1 1 1 194 1 1 12 PHE HD2 H 0.151 0.265 3.926 1.00 . A A . 12 PHE HD2 1 1 1 195 1 1 12 PHE HE1 H 3.465 -1.099 7.354 1.00 . A A . 12 PHE HE1 1 1 1 196 1 1 12 PHE HE2 H -0.105 1.029 6.270 1.00 . A A . 12 PHE HE2 1 1 1 197 1 1 12 PHE HZ H 1.551 0.347 7.985 1.00 . A A . 12 PHE HZ 1 1 1 198 1 1 12 PHE N N 4.031 0.238 2.881 1.00 . A A . 12 PHE N 1 1 1 199 1 1 12 PHE O O 3.898 -2.160 0.312 1.00 . A A . 12 PHE O 1 1 1 200 1 1 13 GLY C C 4.685 -0.765 -1.687 1.00 . A A . 13 GLY C 1 1 1 201 1 1 13 GLY CA C 3.445 -0.001 -1.227 1.00 . A A . 13 GLY CA 1 1 1 202 1 1 13 GLY H H 3.172 0.790 0.757 1.00 . A A . 13 GLY H 1 1 1 203 1 1 13 GLY HA2 H 2.558 -0.465 -1.634 1.00 . A A . 13 GLY HA2 1 1 1 204 1 1 13 GLY HA3 H 3.509 1.021 -1.569 1.00 . A A . 13 GLY HA3 1 1 1 205 1 1 13 GLY N N 3.385 -0.028 0.261 1.00 . A A . 13 GLY N 1 1 1 206 1 1 13 GLY O O 4.681 -1.423 -2.709 1.00 . A A . 13 GLY O 1 1 1 207 1 1 14 LYS C C 7.051 -2.762 -0.612 1.00 . A A . 14 LYS C 1 1 1 208 1 1 14 LYS CA C 6.992 -1.404 -1.321 1.00 . A A . 14 LYS CA 1 1 1 209 1 1 14 LYS CB C 8.208 -0.571 -0.909 1.00 . A A . 14 LYS CB 1 1 1 210 1 1 14 LYS CD C 8.471 0.918 -2.898 1.00 . A A . 14 LYS CD 1 1 1 211 1 1 14 LYS CE C 7.223 0.979 -3.780 1.00 . A A . 14 LYS CE 1 1 1 212 1 1 14 LYS CG C 8.053 0.859 -1.428 1.00 . A A . 14 LYS CG 1 1 1 213 1 1 14 LYS H H 5.726 -0.143 -0.114 1.00 . A A . 14 LYS H 1 1 1 214 1 1 14 LYS HA H 7.002 -1.557 -2.390 1.00 . A A . 14 LYS HA 1 1 1 215 1 1 14 LYS HB2 H 8.283 -0.556 0.170 1.00 . A A . 14 LYS HB2 1 1 1 216 1 1 14 LYS HB3 H 9.103 -1.009 -1.326 1.00 . A A . 14 LYS HB3 1 1 1 217 1 1 14 LYS HD2 H 9.075 1.799 -3.066 1.00 . A A . 14 LYS HD2 1 1 1 218 1 1 14 LYS HD3 H 9.042 0.037 -3.147 1.00 . A A . 14 LYS HD3 1 1 1 219 1 1 14 LYS HE2 H 6.746 0.011 -3.796 1.00 . A A . 14 LYS HE2 1 1 1 220 1 1 14 LYS HE3 H 6.536 1.712 -3.381 1.00 . A A . 14 LYS HE3 1 1 1 221 1 1 14 LYS HG2 H 7.022 1.167 -1.333 1.00 . A A . 14 LYS HG2 1 1 1 222 1 1 14 LYS HG3 H 8.682 1.521 -0.851 1.00 . A A . 14 LYS HG3 1 1 1 223 1 1 14 LYS HZ1 H 7.792 0.511 -5.727 1.00 . A A . 14 LYS HZ1 1 1 1 224 1 1 14 LYS HZ2 H 8.473 1.950 -5.133 1.00 . A A . 14 LYS HZ2 1 1 1 225 1 1 14 LYS HZ3 H 6.841 1.909 -5.603 1.00 . A A . 14 LYS HZ3 1 1 1 226 1 1 14 LYS N N 5.747 -0.683 -0.934 1.00 . A A . 14 LYS N 1 1 1 227 1 1 14 LYS NZ N 7.612 1.366 -5.166 1.00 . A A . 14 LYS NZ 1 1 1 228 1 1 14 LYS O O 7.689 -3.685 -1.076 1.00 . A A . 14 LYS O 1 1 1 229 1 1 15 ALA C C 5.234 -5.048 0.860 1.00 . A A . 15 ALA C 1 1 1 230 1 1 15 ALA CA C 6.437 -4.186 1.253 1.00 . A A . 15 ALA CA 1 1 1 231 1 1 15 ALA CB C 6.389 -3.914 2.757 1.00 . A A . 15 ALA CB 1 1 1 232 1 1 15 ALA H H 5.900 -2.131 0.879 1.00 . A A . 15 ALA H 1 1 1 233 1 1 15 ALA HA H 7.350 -4.711 1.013 1.00 . A A . 15 ALA HA 1 1 1 234 1 1 15 ALA HB1 H 6.911 -4.700 3.282 1.00 . A A . 15 ALA HB1 1 1 1 235 1 1 15 ALA HB2 H 5.360 -3.885 3.084 1.00 . A A . 15 ALA HB2 1 1 1 236 1 1 15 ALA HB3 H 6.861 -2.966 2.966 1.00 . A A . 15 ALA HB3 1 1 1 237 1 1 15 ALA N N 6.402 -2.889 0.514 1.00 . A A . 15 ALA N 1 1 1 238 1 1 15 ALA O O 5.367 -6.222 0.572 1.00 . A A . 15 ALA O 1 1 1 239 1 1 16 TRP C C 3.014 -5.824 -0.924 1.00 . A A . 16 TRP C 1 1 1 240 1 1 16 TRP CA C 2.853 -5.262 0.490 1.00 . A A . 16 TRP CA 1 1 1 241 1 1 16 TRP CB C 1.611 -4.359 0.593 1.00 . A A . 16 TRP CB 1 1 1 242 1 1 16 TRP CD1 C 1.377 -2.352 -0.941 1.00 . A A . 16 TRP CD1 1 1 1 243 1 1 16 TRP CD2 C 0.909 -4.291 -1.961 1.00 . A A . 16 TRP CD2 1 1 1 244 1 1 16 TRP CE2 C 0.752 -3.280 -2.935 1.00 . A A . 16 TRP CE2 1 1 1 245 1 1 16 TRP CE3 C 0.672 -5.615 -2.334 1.00 . A A . 16 TRP CE3 1 1 1 246 1 1 16 TRP CG C 1.318 -3.683 -0.713 1.00 . A A . 16 TRP CG 1 1 1 247 1 1 16 TRP CH2 C 0.143 -4.915 -4.599 1.00 . A A . 16 TRP CH2 1 1 1 248 1 1 16 TRP CZ2 C 0.372 -3.582 -4.243 1.00 . A A . 16 TRP CZ2 1 1 1 249 1 1 16 TRP CZ3 C 0.292 -5.927 -3.641 1.00 . A A . 16 TRP CZ3 1 1 1 250 1 1 16 TRP H H 3.975 -3.534 1.091 1.00 . A A . 16 TRP H 1 1 1 251 1 1 16 TRP HA H 2.741 -6.082 1.179 1.00 . A A . 16 TRP HA 1 1 1 252 1 1 16 TRP HB2 H 0.760 -4.959 0.876 1.00 . A A . 16 TRP HB2 1 1 1 253 1 1 16 TRP HB3 H 1.782 -3.609 1.351 1.00 . A A . 16 TRP HB3 1 1 1 254 1 1 16 TRP HD1 H 1.642 -1.602 -0.213 1.00 . A A . 16 TRP HD1 1 1 1 255 1 1 16 TRP HE1 H 1.024 -1.229 -2.691 1.00 . A A . 16 TRP HE1 1 1 1 256 1 1 16 TRP HE3 H 0.778 -6.398 -1.597 1.00 . A A . 16 TRP HE3 1 1 1 257 1 1 16 TRP HH2 H -0.148 -5.166 -5.609 1.00 . A A . 16 TRP HH2 1 1 1 258 1 1 16 TRP HZ2 H 0.260 -2.794 -4.974 1.00 . A A . 16 TRP HZ2 1 1 1 259 1 1 16 TRP HZ3 H 0.124 -6.952 -3.911 1.00 . A A . 16 TRP HZ3 1 1 1 260 1 1 16 TRP N N 4.062 -4.479 0.854 1.00 . A A . 16 TRP N 1 1 1 261 1 1 16 TRP NE1 N 1.048 -2.111 -2.264 1.00 . A A . 16 TRP NE1 1 1 1 262 1 1 16 TRP O O 2.703 -6.966 -1.189 1.00 . A A . 16 TRP O 1 1 1 263 1 1 17 VAL C C 4.668 -6.698 -3.206 1.00 . A A . 17 VAL C 1 1 1 264 1 1 17 VAL CA C 3.640 -5.567 -3.226 1.00 . A A . 17 VAL CA 1 1 1 265 1 1 17 VAL CB C 4.074 -4.434 -4.173 1.00 . A A . 17 VAL CB 1 1 1 266 1 1 17 VAL CG1 C 5.602 -4.389 -4.304 1.00 . A A . 17 VAL CG1 1 1 1 267 1 1 17 VAL CG2 C 3.452 -4.666 -5.551 1.00 . A A . 17 VAL CG2 1 1 1 268 1 1 17 VAL H H 3.730 -4.113 -1.636 1.00 . A A . 17 VAL H 1 1 1 269 1 1 17 VAL HA H 2.688 -5.972 -3.547 1.00 . A A . 17 VAL HA 1 1 1 270 1 1 17 VAL HB H 3.728 -3.490 -3.778 1.00 . A A . 17 VAL HB 1 1 1 271 1 1 17 VAL HG11 H 6.037 -4.129 -3.350 1.00 . A A . 17 VAL HG11 1 1 1 272 1 1 17 VAL HG12 H 5.878 -3.649 -5.039 1.00 . A A . 17 VAL HG12 1 1 1 273 1 1 17 VAL HG13 H 5.966 -5.357 -4.614 1.00 . A A . 17 VAL HG13 1 1 1 274 1 1 17 VAL HG21 H 2.600 -5.324 -5.454 1.00 . A A . 17 VAL HG21 1 1 1 275 1 1 17 VAL HG22 H 4.183 -5.118 -6.205 1.00 . A A . 17 VAL HG22 1 1 1 276 1 1 17 VAL HG23 H 3.132 -3.722 -5.965 1.00 . A A . 17 VAL HG23 1 1 1 277 1 1 17 VAL N N 3.486 -5.039 -1.846 1.00 . A A . 17 VAL N 1 1 1 278 1 1 17 VAL O O 4.420 -7.783 -3.691 1.00 . A A . 17 VAL O 1 1 1 279 1 1 18 GLY C C 6.187 -8.741 -1.795 1.00 . A A . 18 GLY C 1 1 1 280 1 1 18 GLY CA C 6.818 -7.559 -2.534 1.00 . A A . 18 GLY CA 1 1 1 281 1 1 18 GLY H H 5.985 -5.602 -2.198 1.00 . A A . 18 GLY H 1 1 1 282 1 1 18 GLY HA2 H 7.106 -7.860 -3.533 1.00 . A A . 18 GLY HA2 1 1 1 283 1 1 18 GLY HA3 H 7.685 -7.216 -1.991 1.00 . A A . 18 GLY HA3 1 1 1 284 1 1 18 GLY N N 5.808 -6.471 -2.613 1.00 . A A . 18 GLY N 1 1 1 285 1 1 18 GLY O O 6.697 -9.844 -1.804 1.00 . A A . 18 GLY O 1 1 1 286 1 1 19 GLU C C 3.409 -10.281 -1.390 1.00 . A A . 19 GLU C 1 1 1 287 1 1 19 GLU CA C 4.370 -9.590 -0.426 1.00 . A A . 19 GLU CA 1 1 1 288 1 1 19 GLU CB C 3.587 -8.953 0.732 1.00 . A A . 19 GLU CB 1 1 1 289 1 1 19 GLU CD C 2.841 -11.207 1.515 1.00 . A A . 19 GLU CD 1 1 1 290 1 1 19 GLU CG C 2.379 -9.810 1.099 1.00 . A A . 19 GLU CG 1 1 1 291 1 1 19 GLU H H 4.671 -7.622 -1.170 1.00 . A A . 19 GLU H 1 1 1 292 1 1 19 GLU HA H 5.086 -10.300 -0.045 1.00 . A A . 19 GLU HA 1 1 1 293 1 1 19 GLU HB2 H 4.232 -8.855 1.592 1.00 . A A . 19 GLU HB2 1 1 1 294 1 1 19 GLU HB3 H 3.240 -7.974 0.427 1.00 . A A . 19 GLU HB3 1 1 1 295 1 1 19 GLU HG2 H 1.846 -9.344 1.915 1.00 . A A . 19 GLU HG2 1 1 1 296 1 1 19 GLU HG3 H 1.727 -9.884 0.241 1.00 . A A . 19 GLU HG3 1 1 1 297 1 1 19 GLU N N 5.065 -8.511 -1.160 1.00 . A A . 19 GLU N 1 1 1 298 1 1 19 GLU O O 3.592 -11.425 -1.756 1.00 . A A . 19 GLU O 1 1 1 299 1 1 19 GLU OE1 O 3.192 -11.374 2.671 1.00 . A A . 19 GLU OE1 1 1 1 300 1 1 19 GLU OE2 O 2.834 -12.088 0.671 1.00 . A A . 19 GLU OE2 1 1 1 301 1 1 20 ILE C C 2.021 -10.268 -4.136 1.00 . A A . 20 ILE C 1 1 1 302 1 1 20 ILE CA C 1.413 -10.209 -2.735 1.00 . A A . 20 ILE CA 1 1 1 303 1 1 20 ILE CB C 0.141 -9.367 -2.777 1.00 . A A . 20 ILE CB 1 1 1 304 1 1 20 ILE CD1 C -1.505 -8.206 -1.306 1.00 . A A . 20 ILE CD1 1 1 1 305 1 1 20 ILE CG1 C -0.550 -9.398 -1.416 1.00 . A A . 20 ILE CG1 1 1 1 306 1 1 20 ILE CG2 C -0.806 -9.915 -3.844 1.00 . A A . 20 ILE CG2 1 1 1 307 1 1 20 ILE H H 2.251 -8.667 -1.489 1.00 . A A . 20 ILE H 1 1 1 308 1 1 20 ILE HA H 1.180 -11.203 -2.398 1.00 . A A . 20 ILE HA 1 1 1 309 1 1 20 ILE HB H 0.404 -8.355 -3.020 1.00 . A A . 20 ILE HB 1 1 1 310 1 1 20 ILE HD11 H -2.163 -8.347 -0.462 1.00 . A A . 20 ILE HD11 1 1 1 311 1 1 20 ILE HD12 H -2.091 -8.129 -2.209 1.00 . A A . 20 ILE HD12 1 1 1 312 1 1 20 ILE HD13 H -0.934 -7.300 -1.169 1.00 . A A . 20 ILE HD13 1 1 1 313 1 1 20 ILE HG12 H -1.107 -10.318 -1.317 1.00 . A A . 20 ILE HG12 1 1 1 314 1 1 20 ILE HG13 H 0.192 -9.335 -0.634 1.00 . A A . 20 ILE HG13 1 1 1 315 1 1 20 ILE HG21 H -0.917 -9.188 -4.635 1.00 . A A . 20 ILE HG21 1 1 1 316 1 1 20 ILE HG22 H -1.771 -10.115 -3.401 1.00 . A A . 20 ILE HG22 1 1 1 317 1 1 20 ILE HG23 H -0.401 -10.829 -4.251 1.00 . A A . 20 ILE HG23 1 1 1 318 1 1 20 ILE N N 2.384 -9.592 -1.801 1.00 . A A . 20 ILE N 1 1 1 319 1 1 20 ILE O O 1.942 -11.269 -4.819 1.00 . A A . 20 ILE O 1 1 1 320 1 1 21 MET C C 4.303 -10.270 -6.028 1.00 . A A . 21 MET C 1 1 1 321 1 1 21 MET CA C 3.231 -9.180 -5.928 1.00 . A A . 21 MET CA 1 1 1 322 1 1 21 MET CB C 3.869 -7.814 -6.183 1.00 . A A . 21 MET CB 1 1 1 323 1 1 21 MET CE C 5.952 -7.211 -8.914 1.00 . A A . 21 MET CE 1 1 1 324 1 1 21 MET CG C 3.571 -7.374 -7.616 1.00 . A A . 21 MET CG 1 1 1 325 1 1 21 MET H H 2.671 -8.398 -4.002 1.00 . A A . 21 MET H 1 1 1 326 1 1 21 MET HA H 2.463 -9.358 -6.665 1.00 . A A . 21 MET HA 1 1 1 327 1 1 21 MET HB2 H 3.458 -7.092 -5.490 1.00 . A A . 21 MET HB2 1 1 1 328 1 1 21 MET HB3 H 4.938 -7.883 -6.043 1.00 . A A . 21 MET HB3 1 1 1 329 1 1 21 MET HE1 H 6.881 -7.755 -8.809 1.00 . A A . 21 MET HE1 1 1 1 330 1 1 21 MET HE2 H 5.887 -6.463 -8.141 1.00 . A A . 21 MET HE2 1 1 1 331 1 1 21 MET HE3 H 5.917 -6.731 -9.882 1.00 . A A . 21 MET HE3 1 1 1 332 1 1 21 MET HG2 H 2.521 -7.522 -7.827 1.00 . A A . 21 MET HG2 1 1 1 333 1 1 21 MET HG3 H 3.820 -6.328 -7.731 1.00 . A A . 21 MET HG3 1 1 1 334 1 1 21 MET N N 2.623 -9.196 -4.570 1.00 . A A . 21 MET N 1 1 1 335 1 1 21 MET O O 4.643 -10.717 -7.106 1.00 . A A . 21 MET O 1 1 1 336 1 1 21 MET SD S 4.562 -8.361 -8.764 1.00 . A A . 21 MET SD 1 1 1 337 1 1 22 ASN C C 5.228 -13.133 -5.111 1.00 . A A . 22 ASN C 1 1 1 338 1 1 22 ASN CA C 5.889 -11.760 -4.962 1.00 . A A . 22 ASN CA 1 1 1 339 1 1 22 ASN CB C 6.707 -11.723 -3.670 1.00 . A A . 22 ASN CB 1 1 1 340 1 1 22 ASN CG C 7.724 -12.865 -3.674 1.00 . A A . 22 ASN CG 1 1 1 341 1 1 22 ASN H H 4.554 -10.329 -4.055 1.00 . A A . 22 ASN H 1 1 1 342 1 1 22 ASN HA H 6.541 -11.583 -5.805 1.00 . A A . 22 ASN HA 1 1 1 343 1 1 22 ASN HB2 H 7.228 -10.778 -3.603 1.00 . A A . 22 ASN HB2 1 1 1 344 1 1 22 ASN HB3 H 6.046 -11.834 -2.822 1.00 . A A . 22 ASN HB3 1 1 1 345 1 1 22 ASN HD21 H 7.994 -12.815 -1.705 1.00 . A A . 22 ASN HD21 1 1 1 346 1 1 22 ASN HD22 H 8.906 -13.991 -2.539 1.00 . A A . 22 ASN HD22 1 1 1 347 1 1 22 ASN N N 4.839 -10.702 -4.917 1.00 . A A . 22 ASN N 1 1 1 348 1 1 22 ASN ND2 N 8.252 -13.256 -2.546 1.00 . A A . 22 ASN ND2 1 1 1 349 1 1 22 ASN O O 5.765 -14.027 -5.734 1.00 . A A . 22 ASN O 1 1 1 350 1 1 22 ASN OD1 O 8.042 -13.407 -4.714 1.00 . A A . 22 ASN OD1 1 1 1 351 1 1 23 SER C C 1.859 -14.404 -4.668 1.00 . A A . 23 SER C 1 1 1 352 1 1 23 SER CA C 3.373 -14.624 -4.656 1.00 . A A . 23 SER CA 1 1 1 353 1 1 23 SER CB C 3.752 -15.503 -3.464 1.00 . A A . 23 SER CB 1 1 1 354 1 1 23 SER H H 3.647 -12.575 -4.047 1.00 . A A . 23 SER H 1 1 1 355 1 1 23 SER HA H 3.673 -15.111 -5.572 1.00 . A A . 23 SER HA 1 1 1 356 1 1 23 SER HB2 H 3.099 -15.289 -2.634 1.00 . A A . 23 SER HB2 1 1 1 357 1 1 23 SER HB3 H 3.650 -16.545 -3.740 1.00 . A A . 23 SER HB3 1 1 1 358 1 1 23 SER HG H 5.523 -16.065 -2.887 1.00 . A A . 23 SER HG 1 1 1 359 1 1 23 SER N N 4.065 -13.308 -4.545 1.00 . A A . 23 SER N 1 1 1 360 1 1 23 SER O O 1.172 -15.110 -3.947 1.00 . A A . 23 SER O 1 1 1 361 1 1 23 SER OXT O 1.411 -13.534 -5.397 1.00 . A A . 23 SER OXT 1 1 1 362 1 1 23 SER OG O 5.095 -15.229 -3.086 1.00 . A A . 23 SER OG 1 1 1 363 2 1 1 GLY C C 1.404 -11.796 9.706 1.00 . B B . 1 GLY C 1 1 1 364 2 1 1 GLY CA C 2.222 -11.993 10.984 1.00 . B B . 1 GLY CA 1 1 1 365 2 1 1 GLY H1 H 1.880 -13.832 11.898 1.00 . B B . 1 GLY H1 1 1 1 366 2 1 1 GLY H2 H 0.474 -12.916 11.637 1.00 . B B . 1 GLY H2 1 1 1 367 2 1 1 GLY H3 H 1.544 -12.495 12.887 1.00 . B B . 1 GLY H3 1 1 1 368 2 1 1 GLY HA2 H 2.397 -11.035 11.453 1.00 . B B . 1 GLY HA2 1 1 1 369 2 1 1 GLY HA3 H 3.167 -12.451 10.735 1.00 . B B . 1 GLY HA3 1 1 1 370 2 1 1 GLY N N 1.473 -12.876 11.922 1.00 . B B . 1 GLY N 1 1 1 371 2 1 1 GLY O O 0.502 -12.554 9.412 1.00 . B B . 1 GLY O 1 1 1 372 2 1 2 ILE C C -0.508 -10.247 8.005 1.00 . B B . 2 ILE C 1 1 1 373 2 1 2 ILE CA C 0.961 -10.535 7.681 1.00 . B B . 2 ILE CA 1 1 1 374 2 1 2 ILE CB C 1.055 -11.767 6.775 1.00 . B B . 2 ILE CB 1 1 1 375 2 1 2 ILE CD1 C 3.271 -12.919 6.864 1.00 . B B . 2 ILE CD1 1 1 1 376 2 1 2 ILE CG1 C 2.453 -11.837 6.157 1.00 . B B . 2 ILE CG1 1 1 1 377 2 1 2 ILE CG2 C 0.013 -11.667 5.659 1.00 . B B . 2 ILE CG2 1 1 1 378 2 1 2 ILE H H 2.449 -10.185 9.200 1.00 . B B . 2 ILE H 1 1 1 379 2 1 2 ILE HA H 1.387 -9.683 7.171 1.00 . B B . 2 ILE HA 1 1 1 380 2 1 2 ILE HB H 0.873 -12.658 7.358 1.00 . B B . 2 ILE HB 1 1 1 381 2 1 2 ILE HD11 H 4.251 -12.981 6.413 1.00 . B B . 2 ILE HD11 1 1 1 382 2 1 2 ILE HD12 H 2.769 -13.870 6.768 1.00 . B B . 2 ILE HD12 1 1 1 383 2 1 2 ILE HD13 H 3.371 -12.669 7.910 1.00 . B B . 2 ILE HD13 1 1 1 384 2 1 2 ILE HG12 H 2.369 -12.077 5.105 1.00 . B B . 2 ILE HG12 1 1 1 385 2 1 2 ILE HG13 H 2.946 -10.882 6.272 1.00 . B B . 2 ILE HG13 1 1 1 386 2 1 2 ILE HG21 H 0.382 -12.166 4.776 1.00 . B B . 2 ILE HG21 1 1 1 387 2 1 2 ILE HG22 H -0.175 -10.628 5.434 1.00 . B B . 2 ILE HG22 1 1 1 388 2 1 2 ILE HG23 H -0.905 -12.137 5.981 1.00 . B B . 2 ILE HG23 1 1 1 389 2 1 2 ILE N N 1.716 -10.783 8.943 1.00 . B B . 2 ILE N 1 1 1 390 2 1 2 ILE O O -1.323 -11.143 8.089 1.00 . B B . 2 ILE O 1 1 1 391 2 1 3 GLY C C -2.503 -7.180 8.128 1.00 . B B . 3 GLY C 1 1 1 392 2 1 3 GLY CA C -2.265 -8.646 8.483 1.00 . B B . 3 GLY CA 1 1 1 393 2 1 3 GLY H H -0.176 -8.294 8.096 1.00 . B B . 3 GLY H 1 1 1 394 2 1 3 GLY HA2 H -2.924 -9.268 7.894 1.00 . B B . 3 GLY HA2 1 1 1 395 2 1 3 GLY HA3 H -2.460 -8.798 9.533 1.00 . B B . 3 GLY HA3 1 1 1 396 2 1 3 GLY N N -0.850 -9.000 8.177 1.00 . B B . 3 GLY N 1 1 1 397 2 1 3 GLY O O -3.387 -6.533 8.652 1.00 . B B . 3 GLY O 1 1 1 398 2 1 4 LYS C C -1.511 -5.136 5.335 1.00 . B B . 4 LYS C 1 1 1 399 2 1 4 LYS CA C -1.876 -5.242 6.814 1.00 . B B . 4 LYS CA 1 1 1 400 2 1 4 LYS CB C -0.948 -4.345 7.643 1.00 . B B . 4 LYS CB 1 1 1 401 2 1 4 LYS CD C 1.023 -4.366 9.186 1.00 . B B . 4 LYS CD 1 1 1 402 2 1 4 LYS CE C 1.022 -5.191 10.476 1.00 . B B . 4 LYS CE 1 1 1 403 2 1 4 LYS CG C 0.287 -5.136 8.087 1.00 . B B . 4 LYS CG 1 1 1 404 2 1 4 LYS H H -1.017 -7.212 6.824 1.00 . B B . 4 LYS H 1 1 1 405 2 1 4 LYS HA H -2.902 -4.936 6.956 1.00 . B B . 4 LYS HA 1 1 1 406 2 1 4 LYS HB2 H -0.638 -3.501 7.044 1.00 . B B . 4 LYS HB2 1 1 1 407 2 1 4 LYS HB3 H -1.478 -3.991 8.515 1.00 . B B . 4 LYS HB3 1 1 1 408 2 1 4 LYS HD2 H 2.041 -4.181 8.877 1.00 . B B . 4 LYS HD2 1 1 1 409 2 1 4 LYS HD3 H 0.524 -3.425 9.363 1.00 . B B . 4 LYS HD3 1 1 1 410 2 1 4 LYS HE2 H 0.034 -5.179 10.911 1.00 . B B . 4 LYS HE2 1 1 1 411 2 1 4 LYS HE3 H 1.306 -6.209 10.252 1.00 . B B . 4 LYS HE3 1 1 1 412 2 1 4 LYS HG2 H -0.018 -6.100 8.468 1.00 . B B . 4 LYS HG2 1 1 1 413 2 1 4 LYS HG3 H 0.948 -5.275 7.245 1.00 . B B . 4 LYS HG3 1 1 1 414 2 1 4 LYS HZ1 H 1.481 -4.110 12.196 1.00 . B B . 4 LYS HZ1 1 1 1 415 2 1 4 LYS HZ2 H 2.614 -3.933 10.942 1.00 . B B . 4 LYS HZ2 1 1 1 416 2 1 4 LYS HZ3 H 2.571 -5.364 11.856 1.00 . B B . 4 LYS HZ3 1 1 1 417 2 1 4 LYS N N -1.717 -6.661 7.232 1.00 . B B . 4 LYS N 1 1 1 418 2 1 4 LYS NZ N 1.996 -4.605 11.440 1.00 . B B . 4 LYS NZ 1 1 1 419 2 1 4 LYS O O -2.164 -4.460 4.565 1.00 . B B . 4 LYS O 1 1 1 420 2 1 5 TYR C C -1.094 -6.487 2.655 1.00 . B B . 5 TYR C 1 1 1 421 2 1 5 TYR CA C -0.049 -5.784 3.519 1.00 . B B . 5 TYR CA 1 1 1 422 2 1 5 TYR CB C 1.286 -6.508 3.405 1.00 . B B . 5 TYR CB 1 1 1 423 2 1 5 TYR CD1 C 2.742 -4.867 4.649 1.00 . B B . 5 TYR CD1 1 1 1 424 2 1 5 TYR CD2 C 2.354 -7.057 5.619 1.00 . B B . 5 TYR CD2 1 1 1 425 2 1 5 TYR CE1 C 3.538 -4.522 5.747 1.00 . B B . 5 TYR CE1 1 1 1 426 2 1 5 TYR CE2 C 3.151 -6.711 6.717 1.00 . B B . 5 TYR CE2 1 1 1 427 2 1 5 TYR CG C 2.150 -6.136 4.585 1.00 . B B . 5 TYR CG 1 1 1 428 2 1 5 TYR CZ C 3.742 -5.444 6.781 1.00 . B B . 5 TYR CZ 1 1 1 429 2 1 5 TYR H H 0.036 -6.355 5.571 1.00 . B B . 5 TYR H 1 1 1 430 2 1 5 TYR HA H 0.066 -4.768 3.192 1.00 . B B . 5 TYR HA 1 1 1 431 2 1 5 TYR HB2 H 1.121 -7.577 3.398 1.00 . B B . 5 TYR HB2 1 1 1 432 2 1 5 TYR HB3 H 1.773 -6.211 2.499 1.00 . B B . 5 TYR HB3 1 1 1 433 2 1 5 TYR HD1 H 2.585 -4.155 3.851 1.00 . B B . 5 TYR HD1 1 1 1 434 2 1 5 TYR HD2 H 1.897 -8.035 5.569 1.00 . B B . 5 TYR HD2 1 1 1 435 2 1 5 TYR HE1 H 3.994 -3.544 5.797 1.00 . B B . 5 TYR HE1 1 1 1 436 2 1 5 TYR HE2 H 3.309 -7.422 7.515 1.00 . B B . 5 TYR HE2 1 1 1 437 2 1 5 TYR HH H 5.015 -5.883 8.134 1.00 . B B . 5 TYR HH 1 1 1 438 2 1 5 TYR N N -0.471 -5.814 4.935 1.00 . B B . 5 TYR N 1 1 1 439 2 1 5 TYR O O -1.103 -6.350 1.448 1.00 . B B . 5 TYR O 1 1 1 440 2 1 5 TYR OH O 4.526 -5.103 7.864 1.00 . B B . 5 TYR OH 1 1 1 441 2 1 6 LEU C C -4.388 -7.384 2.723 1.00 . B B . 6 LEU C 1 1 1 442 2 1 6 LEU CA C -2.998 -7.954 2.442 1.00 . B B . 6 LEU CA 1 1 1 443 2 1 6 LEU CB C -2.982 -9.446 2.799 1.00 . B B . 6 LEU CB 1 1 1 444 2 1 6 LEU CD1 C -2.456 -10.765 0.735 1.00 . B B . 6 LEU CD1 1 1 1 445 2 1 6 LEU CD2 C -0.717 -9.242 1.689 1.00 . B B . 6 LEU CD2 1 1 1 446 2 1 6 LEU CG C -1.877 -10.189 2.027 1.00 . B B . 6 LEU CG 1 1 1 447 2 1 6 LEU H H -1.949 -7.356 4.234 1.00 . B B . 6 LEU H 1 1 1 448 2 1 6 LEU HA H -2.768 -7.829 1.396 1.00 . B B . 6 LEU HA 1 1 1 449 2 1 6 LEU HB2 H -2.808 -9.555 3.859 1.00 . B B . 6 LEU HB2 1 1 1 450 2 1 6 LEU HB3 H -3.940 -9.879 2.550 1.00 . B B . 6 LEU HB3 1 1 1 451 2 1 6 LEU HD11 H -1.682 -11.293 0.198 1.00 . B B . 6 LEU HD11 1 1 1 452 2 1 6 LEU HD12 H -2.839 -9.964 0.122 1.00 . B B . 6 LEU HD12 1 1 1 453 2 1 6 LEU HD13 H -3.257 -11.449 0.974 1.00 . B B . 6 LEU HD13 1 1 1 454 2 1 6 LEU HD21 H -1.068 -8.451 1.041 1.00 . B B . 6 LEU HD21 1 1 1 455 2 1 6 LEU HD22 H 0.061 -9.795 1.187 1.00 . B B . 6 LEU HD22 1 1 1 456 2 1 6 LEU HD23 H -0.324 -8.813 2.599 1.00 . B B . 6 LEU HD23 1 1 1 457 2 1 6 LEU HG H -1.508 -11.000 2.638 1.00 . B B . 6 LEU HG 1 1 1 458 2 1 6 LEU N N -1.971 -7.245 3.255 1.00 . B B . 6 LEU N 1 1 1 459 2 1 6 LEU O O -5.336 -7.675 2.023 1.00 . B B . 6 LEU O 1 1 1 460 2 1 7 HIS C C -5.792 -4.504 4.198 1.00 . B B . 7 HIS C 1 1 1 461 2 1 7 HIS CA C -5.875 -6.022 4.043 1.00 . B B . 7 HIS CA 1 1 1 462 2 1 7 HIS CB C -6.410 -6.636 5.341 1.00 . B B . 7 HIS CB 1 1 1 463 2 1 7 HIS CD2 C -5.023 -8.580 6.440 1.00 . B B . 7 HIS CD2 1 1 1 464 2 1 7 HIS CE1 C -5.528 -10.157 5.042 1.00 . B B . 7 HIS CE1 1 1 1 465 2 1 7 HIS CG C -5.865 -8.029 5.506 1.00 . B B . 7 HIS CG 1 1 1 466 2 1 7 HIS H H -3.760 -6.360 4.305 1.00 . B B . 7 HIS H 1 1 1 467 2 1 7 HIS HA H -6.549 -6.260 3.232 1.00 . B B . 7 HIS HA 1 1 1 468 2 1 7 HIS HB2 H -6.101 -6.028 6.179 1.00 . B B . 7 HIS HB2 1 1 1 469 2 1 7 HIS HB3 H -7.488 -6.675 5.304 1.00 . B B . 7 HIS HB3 1 1 1 470 2 1 7 HIS HD1 H -6.762 -8.987 3.843 1.00 . B B . 7 HIS HD1 1 1 1 471 2 1 7 HIS HD2 H -4.591 -8.052 7.277 1.00 . B B . 7 HIS HD2 1 1 1 472 2 1 7 HIS HE1 H -5.578 -11.114 4.543 1.00 . B B . 7 HIS HE1 1 1 1 473 2 1 7 HIS N N -4.529 -6.583 3.740 1.00 . B B . 7 HIS N 1 1 1 474 2 1 7 HIS ND1 N -6.175 -9.053 4.625 1.00 . B B . 7 HIS ND1 1 1 1 475 2 1 7 HIS NE2 N -4.811 -9.923 6.144 1.00 . B B . 7 HIS NE2 1 1 1 476 2 1 7 HIS O O -6.799 -3.825 4.250 1.00 . B B . 7 HIS O 1 1 1 477 2 1 8 SER C C -3.591 -1.913 3.348 1.00 . B B . 8 SER C 1 1 1 478 2 1 8 SER CA C -4.503 -2.480 4.427 1.00 . B B . 8 SER CA 1 1 1 479 2 1 8 SER CB C -3.942 -2.142 5.809 1.00 . B B . 8 SER CB 1 1 1 480 2 1 8 SER H H -3.804 -4.509 4.233 1.00 . B B . 8 SER H 1 1 1 481 2 1 8 SER HA H -5.480 -2.045 4.317 1.00 . B B . 8 SER HA 1 1 1 482 2 1 8 SER HB2 H -3.875 -3.039 6.402 1.00 . B B . 8 SER HB2 1 1 1 483 2 1 8 SER HB3 H -2.955 -1.710 5.700 1.00 . B B . 8 SER HB3 1 1 1 484 2 1 8 SER HG H -4.273 -0.499 6.797 1.00 . B B . 8 SER HG 1 1 1 485 2 1 8 SER N N -4.611 -3.956 4.275 1.00 . B B . 8 SER N 1 1 1 486 2 1 8 SER O O -3.766 -0.799 2.896 1.00 . B B . 8 SER O 1 1 1 487 2 1 8 SER OG O -4.808 -1.218 6.455 1.00 . B B . 8 SER OG 1 1 1 488 2 1 9 ALA C C -2.432 -2.245 0.520 1.00 . B B . 9 ALA C 1 1 1 489 2 1 9 ALA CA C -1.721 -2.158 1.863 1.00 . B B . 9 ALA CA 1 1 1 490 2 1 9 ALA CB C -0.461 -3.008 1.813 1.00 . B B . 9 ALA CB 1 1 1 491 2 1 9 ALA H H -2.498 -3.566 3.288 1.00 . B B . 9 ALA H 1 1 1 492 2 1 9 ALA HA H -1.459 -1.131 2.070 1.00 . B B . 9 ALA HA 1 1 1 493 2 1 9 ALA HB1 H 0.028 -2.982 2.774 1.00 . B B . 9 ALA HB1 1 1 1 494 2 1 9 ALA HB2 H 0.202 -2.613 1.061 1.00 . B B . 9 ALA HB2 1 1 1 495 2 1 9 ALA HB3 H -0.722 -4.033 1.566 1.00 . B B . 9 ALA HB3 1 1 1 496 2 1 9 ALA N N -2.625 -2.666 2.920 1.00 . B B . 9 ALA N 1 1 1 497 2 1 9 ALA O O -2.658 -1.253 -0.135 1.00 . B B . 9 ALA O 1 1 1 498 2 1 10 LYS C C -4.503 -2.469 -1.399 1.00 . B B . 10 LYS C 1 1 1 499 2 1 10 LYS CA C -3.473 -3.587 -1.208 1.00 . B B . 10 LYS CA 1 1 1 500 2 1 10 LYS CB C -4.182 -4.939 -1.270 1.00 . B B . 10 LYS CB 1 1 1 501 2 1 10 LYS CD C -6.291 -5.484 -0.051 1.00 . B B . 10 LYS CD 1 1 1 502 2 1 10 LYS CE C -6.557 -6.725 -0.906 1.00 . B B . 10 LYS CE 1 1 1 503 2 1 10 LYS CG C -4.782 -5.278 0.096 1.00 . B B . 10 LYS CG 1 1 1 504 2 1 10 LYS H H -2.573 -4.221 0.657 1.00 . B B . 10 LYS H 1 1 1 505 2 1 10 LYS HA H -2.744 -3.532 -2.002 1.00 . B B . 10 LYS HA 1 1 1 506 2 1 10 LYS HB2 H -4.972 -4.890 -2.006 1.00 . B B . 10 LYS HB2 1 1 1 507 2 1 10 LYS HB3 H -3.475 -5.704 -1.551 1.00 . B B . 10 LYS HB3 1 1 1 508 2 1 10 LYS HD2 H -6.733 -5.616 0.926 1.00 . B B . 10 LYS HD2 1 1 1 509 2 1 10 LYS HD3 H -6.727 -4.620 -0.530 1.00 . B B . 10 LYS HD3 1 1 1 510 2 1 10 LYS HE2 H -5.699 -6.922 -1.531 1.00 . B B . 10 LYS HE2 1 1 1 511 2 1 10 LYS HE3 H -6.736 -7.574 -0.262 1.00 . B B . 10 LYS HE3 1 1 1 512 2 1 10 LYS HG2 H -4.329 -6.184 0.472 1.00 . B B . 10 LYS HG2 1 1 1 513 2 1 10 LYS HG3 H -4.595 -4.468 0.784 1.00 . B B . 10 LYS HG3 1 1 1 514 2 1 10 LYS HZ1 H -8.439 -5.904 -1.251 1.00 . B B . 10 LYS HZ1 1 1 1 515 2 1 10 LYS HZ2 H -8.189 -7.406 -2.005 1.00 . B B . 10 LYS HZ2 1 1 1 516 2 1 10 LYS HZ3 H -7.466 -6.004 -2.636 1.00 . B B . 10 LYS HZ3 1 1 1 517 2 1 10 LYS N N -2.779 -3.431 0.105 1.00 . B B . 10 LYS N 1 1 1 518 2 1 10 LYS NZ N -7.753 -6.492 -1.764 1.00 . B B . 10 LYS NZ 1 1 1 519 2 1 10 LYS O O -4.512 -1.791 -2.408 1.00 . B B . 10 LYS O 1 1 1 520 2 1 11 LYS C C -5.699 0.113 -0.994 1.00 . B B . 11 LYS C 1 1 1 521 2 1 11 LYS CA C -6.392 -1.190 -0.596 1.00 . B B . 11 LYS CA 1 1 1 522 2 1 11 LYS CB C -7.132 -0.997 0.731 1.00 . B B . 11 LYS CB 1 1 1 523 2 1 11 LYS CD C -9.290 -1.374 1.937 1.00 . B B . 11 LYS CD 1 1 1 524 2 1 11 LYS CE C -10.397 -2.424 2.061 1.00 . B B . 11 LYS CE 1 1 1 525 2 1 11 LYS CG C -8.547 -1.569 0.614 1.00 . B B . 11 LYS CG 1 1 1 526 2 1 11 LYS H H -5.356 -2.820 0.363 1.00 . B B . 11 LYS H 1 1 1 527 2 1 11 LYS HA H -7.097 -1.465 -1.366 1.00 . B B . 11 LYS HA 1 1 1 528 2 1 11 LYS HB2 H -6.599 -1.511 1.518 1.00 . B B . 11 LYS HB2 1 1 1 529 2 1 11 LYS HB3 H -7.190 0.055 0.963 1.00 . B B . 11 LYS HB3 1 1 1 530 2 1 11 LYS HD2 H -8.597 -1.481 2.758 1.00 . B B . 11 LYS HD2 1 1 1 531 2 1 11 LYS HD3 H -9.729 -0.388 1.963 1.00 . B B . 11 LYS HD3 1 1 1 532 2 1 11 LYS HE2 H -9.958 -3.410 2.065 1.00 . B B . 11 LYS HE2 1 1 1 533 2 1 11 LYS HE3 H -10.940 -2.267 2.981 1.00 . B B . 11 LYS HE3 1 1 1 534 2 1 11 LYS HG2 H -9.077 -1.056 -0.177 1.00 . B B . 11 LYS HG2 1 1 1 535 2 1 11 LYS HG3 H -8.493 -2.623 0.386 1.00 . B B . 11 LYS HG3 1 1 1 536 2 1 11 LYS HZ1 H -11.335 -3.189 0.367 1.00 . B B . 11 LYS HZ1 1 1 1 537 2 1 11 LYS HZ2 H -11.019 -1.521 0.291 1.00 . B B . 11 LYS HZ2 1 1 1 538 2 1 11 LYS HZ3 H -12.290 -2.105 1.256 1.00 . B B . 11 LYS HZ3 1 1 1 539 2 1 11 LYS N N -5.373 -2.267 -0.447 1.00 . B B . 11 LYS N 1 1 1 540 2 1 11 LYS NZ N -11.331 -2.300 0.907 1.00 . B B . 11 LYS NZ 1 1 1 541 2 1 11 LYS O O -5.905 0.630 -2.073 1.00 . B B . 11 LYS O 1 1 1 542 2 1 12 PHE C C -3.241 1.665 -1.666 1.00 . B B . 12 PHE C 1 1 1 543 2 1 12 PHE CA C -4.169 1.912 -0.476 1.00 . B B . 12 PHE CA 1 1 1 544 2 1 12 PHE CB C -3.352 2.383 0.727 1.00 . B B . 12 PHE CB 1 1 1 545 2 1 12 PHE CD1 C -5.600 2.471 1.869 1.00 . B B . 12 PHE CD1 1 1 1 546 2 1 12 PHE CD2 C -3.614 2.150 3.223 1.00 . B B . 12 PHE CD2 1 1 1 547 2 1 12 PHE CE1 C -6.394 2.425 3.021 1.00 . B B . 12 PHE CE1 1 1 1 548 2 1 12 PHE CE2 C -4.407 2.104 4.375 1.00 . B B . 12 PHE CE2 1 1 1 549 2 1 12 PHE CG C -4.210 2.333 1.969 1.00 . B B . 12 PHE CG 1 1 1 550 2 1 12 PHE CZ C -5.797 2.242 4.274 1.00 . B B . 12 PHE CZ 1 1 1 551 2 1 12 PHE H H -4.718 0.214 0.728 1.00 . B B . 12 PHE H 1 1 1 552 2 1 12 PHE HA H -4.895 2.668 -0.738 1.00 . B B . 12 PHE HA 1 1 1 553 2 1 12 PHE HB2 H -2.494 1.737 0.854 1.00 . B B . 12 PHE HB2 1 1 1 554 2 1 12 PHE HB3 H -3.019 3.398 0.560 1.00 . B B . 12 PHE HB3 1 1 1 555 2 1 12 PHE HD1 H -6.060 2.612 0.902 1.00 . B B . 12 PHE HD1 1 1 1 556 2 1 12 PHE HD2 H -2.542 2.043 3.301 1.00 . B B . 12 PHE HD2 1 1 1 557 2 1 12 PHE HE1 H -7.465 2.531 2.944 1.00 . B B . 12 PHE HE1 1 1 1 558 2 1 12 PHE HE2 H -3.947 1.962 5.342 1.00 . B B . 12 PHE HE2 1 1 1 559 2 1 12 PHE HZ H -6.410 2.207 5.164 1.00 . B B . 12 PHE HZ 1 1 1 560 2 1 12 PHE N N -4.875 0.646 -0.136 1.00 . B B . 12 PHE N 1 1 1 561 2 1 12 PHE O O -3.046 2.525 -2.499 1.00 . B B . 12 PHE O 1 1 1 562 2 1 13 GLY C C -2.383 0.735 -4.179 1.00 . B B . 13 GLY C 1 1 1 563 2 1 13 GLY CA C -1.768 0.183 -2.898 1.00 . B B . 13 GLY CA 1 1 1 564 2 1 13 GLY H H -2.852 -0.190 -1.075 1.00 . B B . 13 GLY H 1 1 1 565 2 1 13 GLY HA2 H -0.802 0.636 -2.732 1.00 . B B . 13 GLY HA2 1 1 1 566 2 1 13 GLY HA3 H -1.654 -0.886 -2.990 1.00 . B B . 13 GLY HA3 1 1 1 567 2 1 13 GLY N N -2.675 0.492 -1.756 1.00 . B B . 13 GLY N 1 1 1 568 2 1 13 GLY O O -1.697 1.241 -5.045 1.00 . B B . 13 GLY O 1 1 1 569 2 1 14 LYS C C -4.798 2.605 -5.321 1.00 . B B . 14 LYS C 1 1 1 570 2 1 14 LYS CA C -4.344 1.157 -5.532 1.00 . B B . 14 LYS CA 1 1 1 571 2 1 14 LYS CB C -5.567 0.296 -5.845 1.00 . B B . 14 LYS CB 1 1 1 572 2 1 14 LYS CD C -5.316 -1.386 -7.673 1.00 . B B . 14 LYS CD 1 1 1 573 2 1 14 LYS CE C -4.250 -0.624 -8.464 1.00 . B B . 14 LYS CE 1 1 1 574 2 1 14 LYS CG C -5.123 -1.128 -6.178 1.00 . B B . 14 LYS CG 1 1 1 575 2 1 14 LYS H H -4.211 0.219 -3.593 1.00 . B B . 14 LYS H 1 1 1 576 2 1 14 LYS HA H -3.652 1.116 -6.359 1.00 . B B . 14 LYS HA 1 1 1 577 2 1 14 LYS HB2 H -6.222 0.278 -4.983 1.00 . B B . 14 LYS HB2 1 1 1 578 2 1 14 LYS HB3 H -6.095 0.715 -6.688 1.00 . B B . 14 LYS HB3 1 1 1 579 2 1 14 LYS HD2 H -5.225 -2.444 -7.871 1.00 . B B . 14 LYS HD2 1 1 1 580 2 1 14 LYS HD3 H -6.296 -1.046 -7.974 1.00 . B B . 14 LYS HD3 1 1 1 581 2 1 14 LYS HE2 H -4.683 0.275 -8.878 1.00 . B B . 14 LYS HE2 1 1 1 582 2 1 14 LYS HE3 H -3.434 -0.361 -7.807 1.00 . B B . 14 LYS HE3 1 1 1 583 2 1 14 LYS HG2 H -4.080 -1.249 -5.922 1.00 . B B . 14 LYS HG2 1 1 1 584 2 1 14 LYS HG3 H -5.716 -1.832 -5.614 1.00 . B B . 14 LYS HG3 1 1 1 585 2 1 14 LYS HZ1 H -3.815 -2.483 -9.292 1.00 . B B . 14 LYS HZ1 1 1 1 586 2 1 14 LYS HZ2 H -2.744 -1.250 -9.758 1.00 . B B . 14 LYS HZ2 1 1 1 587 2 1 14 LYS HZ3 H -4.306 -1.320 -10.425 1.00 . B B . 14 LYS HZ3 1 1 1 588 2 1 14 LYS N N -3.677 0.639 -4.305 1.00 . B B . 14 LYS N 1 1 1 589 2 1 14 LYS NZ N -3.741 -1.484 -9.568 1.00 . B B . 14 LYS NZ 1 1 1 590 2 1 14 LYS O O -5.085 3.312 -6.267 1.00 . B B . 14 LYS O 1 1 1 591 2 1 15 ALA C C -4.160 5.358 -3.510 1.00 . B B . 15 ALA C 1 1 1 592 2 1 15 ALA CA C -5.347 4.453 -3.862 1.00 . B B . 15 ALA CA 1 1 1 593 2 1 15 ALA CB C -6.354 4.468 -2.712 1.00 . B B . 15 ALA CB 1 1 1 594 2 1 15 ALA H H -4.667 2.470 -3.341 1.00 . B B . 15 ALA H 1 1 1 595 2 1 15 ALA HA H -5.825 4.822 -4.757 1.00 . B B . 15 ALA HA 1 1 1 596 2 1 15 ALA HB1 H -7.348 4.621 -3.106 1.00 . B B . 15 ALA HB1 1 1 1 597 2 1 15 ALA HB2 H -6.111 5.270 -2.030 1.00 . B B . 15 ALA HB2 1 1 1 598 2 1 15 ALA HB3 H -6.316 3.525 -2.187 1.00 . B B . 15 ALA HB3 1 1 1 599 2 1 15 ALA N N -4.886 3.053 -4.098 1.00 . B B . 15 ALA N 1 1 1 600 2 1 15 ALA O O -4.033 6.455 -4.016 1.00 . B B . 15 ALA O 1 1 1 601 2 1 16 TRP C C -1.344 6.147 -3.500 1.00 . B B . 16 TRP C 1 1 1 602 2 1 16 TRP CA C -2.123 5.738 -2.251 1.00 . B B . 16 TRP CA 1 1 1 603 2 1 16 TRP CB C -1.246 4.933 -1.283 1.00 . B B . 16 TRP CB 1 1 1 604 2 1 16 TRP CD1 C -0.233 2.759 -2.087 1.00 . B B . 16 TRP CD1 1 1 1 605 2 1 16 TRP CD2 C 0.898 4.560 -2.788 1.00 . B B . 16 TRP CD2 1 1 1 606 2 1 16 TRP CE2 C 1.574 3.438 -3.314 1.00 . B B . 16 TRP CE2 1 1 1 607 2 1 16 TRP CE3 C 1.397 5.832 -3.073 1.00 . B B . 16 TRP CE3 1 1 1 608 2 1 16 TRP CG C -0.244 4.107 -2.023 1.00 . B B . 16 TRP CG 1 1 1 609 2 1 16 TRP CH2 C 3.207 4.859 -4.380 1.00 . B B . 16 TRP CH2 1 1 1 610 2 1 16 TRP CZ2 C 2.718 3.578 -4.102 1.00 . B B . 16 TRP CZ2 1 1 1 611 2 1 16 TRP CZ3 C 2.548 5.984 -3.865 1.00 . B B . 16 TRP CZ3 1 1 1 612 2 1 16 TRP H H -3.414 4.030 -2.248 1.00 . B B . 16 TRP H 1 1 1 613 2 1 16 TRP HA H -2.465 6.629 -1.749 1.00 . B B . 16 TRP HA 1 1 1 614 2 1 16 TRP HB2 H -0.727 5.613 -0.629 1.00 . B B . 16 TRP HB2 1 1 1 615 2 1 16 TRP HB3 H -1.876 4.283 -0.692 1.00 . B B . 16 TRP HB3 1 1 1 616 2 1 16 TRP HD1 H -0.950 2.104 -1.616 1.00 . B B . 16 TRP HD1 1 1 1 617 2 1 16 TRP HE1 H 1.078 1.427 -3.065 1.00 . B B . 16 TRP HE1 1 1 1 618 2 1 16 TRP HE3 H 0.888 6.696 -2.674 1.00 . B B . 16 TRP HE3 1 1 1 619 2 1 16 TRP HH2 H 4.090 4.983 -4.990 1.00 . B B . 16 TRP HH2 1 1 1 620 2 1 16 TRP HZ2 H 3.220 2.706 -4.494 1.00 . B B . 16 TRP HZ2 1 1 1 621 2 1 16 TRP HZ3 H 2.926 6.971 -4.079 1.00 . B B . 16 TRP HZ3 1 1 1 622 2 1 16 TRP N N -3.294 4.911 -2.643 1.00 . B B . 16 TRP N 1 1 1 623 2 1 16 TRP NE1 N 0.845 2.357 -2.858 1.00 . B B . 16 TRP NE1 1 1 1 624 2 1 16 TRP O O -0.940 7.283 -3.644 1.00 . B B . 16 TRP O 1 1 1 625 2 1 17 VAL C C -1.148 6.718 -6.363 1.00 . B B . 17 VAL C 1 1 1 626 2 1 17 VAL CA C -0.389 5.600 -5.642 1.00 . B B . 17 VAL CA 1 1 1 627 2 1 17 VAL CB C -0.231 4.354 -6.539 1.00 . B B . 17 VAL CB 1 1 1 628 2 1 17 VAL CG1 C -1.228 4.372 -7.705 1.00 . B B . 17 VAL CG1 1 1 1 629 2 1 17 VAL CG2 C 1.192 4.328 -7.099 1.00 . B B . 17 VAL CG2 1 1 1 630 2 1 17 VAL H H -1.472 4.326 -4.285 1.00 . B B . 17 VAL H 1 1 1 631 2 1 17 VAL HA H 0.589 5.965 -5.363 1.00 . B B . 17 VAL HA 1 1 1 632 2 1 17 VAL HB H -0.397 3.466 -5.945 1.00 . B B . 17 VAL HB 1 1 1 633 2 1 17 VAL HG11 H -0.997 3.569 -8.388 1.00 . B B . 17 VAL HG11 1 1 1 634 2 1 17 VAL HG12 H -1.158 5.316 -8.225 1.00 . B B . 17 VAL HG12 1 1 1 635 2 1 17 VAL HG13 H -2.230 4.243 -7.325 1.00 . B B . 17 VAL HG13 1 1 1 636 2 1 17 VAL HG21 H 1.163 4.507 -8.163 1.00 . B B . 17 VAL HG21 1 1 1 637 2 1 17 VAL HG22 H 1.637 3.363 -6.907 1.00 . B B . 17 VAL HG22 1 1 1 638 2 1 17 VAL HG23 H 1.780 5.098 -6.620 1.00 . B B . 17 VAL HG23 1 1 1 639 2 1 17 VAL N N -1.135 5.238 -4.410 1.00 . B B . 17 VAL N 1 1 1 640 2 1 17 VAL O O -0.606 7.758 -6.664 1.00 . B B . 17 VAL O 1 1 1 641 2 1 18 GLY C C -3.013 8.906 -6.521 1.00 . B B . 18 GLY C 1 1 1 642 2 1 18 GLY CA C -3.175 7.603 -7.308 1.00 . B B . 18 GLY CA 1 1 1 643 2 1 18 GLY H H -2.849 5.694 -6.363 1.00 . B B . 18 GLY H 1 1 1 644 2 1 18 GLY HA2 H -2.788 7.733 -8.311 1.00 . B B . 18 GLY HA2 1 1 1 645 2 1 18 GLY HA3 H -4.218 7.336 -7.352 1.00 . B B . 18 GLY HA3 1 1 1 646 2 1 18 GLY N N -2.408 6.529 -6.625 1.00 . B B . 18 GLY N 1 1 1 647 2 1 18 GLY O O -3.247 9.985 -7.029 1.00 . B B . 18 GLY O 1 1 1 648 2 1 19 GLU C C -0.996 10.545 -4.697 1.00 . B B . 19 GLU C 1 1 1 649 2 1 19 GLU CA C -2.403 10.027 -4.457 1.00 . B B . 19 GLU CA 1 1 1 650 2 1 19 GLU CB C -2.543 9.651 -2.982 1.00 . B B . 19 GLU CB 1 1 1 651 2 1 19 GLU CD C -4.866 9.695 -2.070 1.00 . B B . 19 GLU CD 1 1 1 652 2 1 19 GLU CG C -3.818 8.840 -2.786 1.00 . B B . 19 GLU CG 1 1 1 653 2 1 19 GLU H H -2.406 7.936 -4.899 1.00 . B B . 19 GLU H 1 1 1 654 2 1 19 GLU HA H -3.127 10.780 -4.720 1.00 . B B . 19 GLU HA 1 1 1 655 2 1 19 GLU HB2 H -1.689 9.051 -2.682 1.00 . B B . 19 GLU HB2 1 1 1 656 2 1 19 GLU HB3 H -2.588 10.547 -2.380 1.00 . B B . 19 GLU HB3 1 1 1 657 2 1 19 GLU HG2 H -4.195 8.532 -3.749 1.00 . B B . 19 GLU HG2 1 1 1 658 2 1 19 GLU HG3 H -3.597 7.971 -2.190 1.00 . B B . 19 GLU HG3 1 1 1 659 2 1 19 GLU N N -2.600 8.811 -5.284 1.00 . B B . 19 GLU N 1 1 1 660 2 1 19 GLU O O -0.787 11.615 -5.236 1.00 . B B . 19 GLU O 1 1 1 661 2 1 19 GLU OE1 O -4.748 10.908 -2.121 1.00 . B B . 19 GLU OE1 1 1 1 662 2 1 19 GLU OE2 O -5.770 9.121 -1.485 1.00 . B B . 19 GLU OE2 1 1 1 663 2 1 20 ILE C C 1.750 10.060 -5.963 1.00 . B B . 20 ILE C 1 1 1 664 2 1 20 ILE CA C 1.381 10.187 -4.485 1.00 . B B . 20 ILE CA 1 1 1 665 2 1 20 ILE CB C 2.252 9.255 -3.645 1.00 . B B . 20 ILE CB 1 1 1 666 2 1 20 ILE CD1 C 2.755 8.659 -1.279 1.00 . B B . 20 ILE CD1 1 1 1 667 2 1 20 ILE CG1 C 2.305 9.778 -2.216 1.00 . B B . 20 ILE CG1 1 1 1 668 2 1 20 ILE CG2 C 3.676 9.187 -4.210 1.00 . B B . 20 ILE CG2 1 1 1 669 2 1 20 ILE H H -0.234 8.917 -3.862 1.00 . B B . 20 ILE H 1 1 1 670 2 1 20 ILE HA H 1.508 11.202 -4.158 1.00 . B B . 20 ILE HA 1 1 1 671 2 1 20 ILE HB H 1.806 8.269 -3.648 1.00 . B B . 20 ILE HB 1 1 1 672 2 1 20 ILE HD11 H 3.742 8.325 -1.566 1.00 . B B . 20 ILE HD11 1 1 1 673 2 1 20 ILE HD12 H 2.062 7.833 -1.345 1.00 . B B . 20 ILE HD12 1 1 1 674 2 1 20 ILE HD13 H 2.781 9.027 -0.264 1.00 . B B . 20 ILE HD13 1 1 1 675 2 1 20 ILE HG12 H 3.003 10.601 -2.162 1.00 . B B . 20 ILE HG12 1 1 1 676 2 1 20 ILE HG13 H 1.323 10.115 -1.929 1.00 . B B . 20 ILE HG13 1 1 1 677 2 1 20 ILE HG21 H 4.347 8.815 -3.450 1.00 . B B . 20 ILE HG21 1 1 1 678 2 1 20 ILE HG22 H 3.989 10.174 -4.515 1.00 . B B . 20 ILE HG22 1 1 1 679 2 1 20 ILE HG23 H 3.694 8.524 -5.062 1.00 . B B . 20 ILE HG23 1 1 1 680 2 1 20 ILE N N -0.029 9.778 -4.296 1.00 . B B . 20 ILE N 1 1 1 681 2 1 20 ILE O O 2.292 10.964 -6.567 1.00 . B B . 20 ILE O 1 1 1 682 2 1 21 MET C C 1.101 9.769 -8.832 1.00 . B B . 21 MET C 1 1 1 683 2 1 21 MET CA C 1.780 8.702 -7.969 1.00 . B B . 21 MET CA 1 1 1 684 2 1 21 MET CB C 1.264 7.322 -8.367 1.00 . B B . 21 MET CB 1 1 1 685 2 1 21 MET CE C 2.449 6.835 -11.812 1.00 . B B . 21 MET CE 1 1 1 686 2 1 21 MET CG C 2.358 6.562 -9.106 1.00 . B B . 21 MET CG 1 1 1 687 2 1 21 MET H H 1.024 8.225 -6.017 1.00 . B B . 21 MET H 1 1 1 688 2 1 21 MET HA H 2.850 8.742 -8.112 1.00 . B B . 21 MET HA 1 1 1 689 2 1 21 MET HB2 H 0.990 6.773 -7.476 1.00 . B B . 21 MET HB2 1 1 1 690 2 1 21 MET HB3 H 0.403 7.429 -9.009 1.00 . B B . 21 MET HB3 1 1 1 691 2 1 21 MET HE1 H 2.427 6.344 -12.776 1.00 . B B . 21 MET HE1 1 1 1 692 2 1 21 MET HE2 H 3.473 7.019 -11.529 1.00 . B B . 21 MET HE2 1 1 1 693 2 1 21 MET HE3 H 1.919 7.776 -11.869 1.00 . B B . 21 MET HE3 1 1 1 694 2 1 21 MET HG2 H 3.137 7.249 -9.399 1.00 . B B . 21 MET HG2 1 1 1 695 2 1 21 MET HG3 H 2.767 5.806 -8.451 1.00 . B B . 21 MET HG3 1 1 1 696 2 1 21 MET N N 1.459 8.932 -6.536 1.00 . B B . 21 MET N 1 1 1 697 2 1 21 MET O O 1.530 10.055 -9.932 1.00 . B B . 21 MET O 1 1 1 698 2 1 21 MET SD S 1.658 5.773 -10.579 1.00 . B B . 21 MET SD 1 1 1 699 2 1 22 ASN C C -0.289 12.787 -8.620 1.00 . B B . 22 ASN C 1 1 1 700 2 1 22 ASN CA C -0.665 11.401 -9.144 1.00 . B B . 22 ASN CA 1 1 1 701 2 1 22 ASN CB C -2.177 11.202 -9.020 1.00 . B B . 22 ASN CB 1 1 1 702 2 1 22 ASN CG C -2.882 11.876 -10.200 1.00 . B B . 22 ASN CG 1 1 1 703 2 1 22 ASN H H -0.292 10.110 -7.458 1.00 . B B . 22 ASN H 1 1 1 704 2 1 22 ASN HA H -0.375 11.318 -10.180 1.00 . B B . 22 ASN HA 1 1 1 705 2 1 22 ASN HB2 H -2.403 10.144 -9.021 1.00 . B B . 22 ASN HB2 1 1 1 706 2 1 22 ASN HB3 H -2.523 11.645 -8.096 1.00 . B B . 22 ASN HB3 1 1 1 707 2 1 22 ASN HD21 H -3.774 13.244 -9.064 1.00 . B B . 22 ASN HD21 1 1 1 708 2 1 22 ASN HD22 H -4.109 13.347 -10.734 1.00 . B B . 22 ASN HD22 1 1 1 709 2 1 22 ASN N N 0.041 10.357 -8.346 1.00 . B B . 22 ASN N 1 1 1 710 2 1 22 ASN ND2 N -3.652 12.908 -9.981 1.00 . B B . 22 ASN ND2 1 1 1 711 2 1 22 ASN O O -0.190 13.738 -9.370 1.00 . B B . 22 ASN O 1 1 1 712 2 1 22 ASN OD1 O -2.731 11.460 -11.331 1.00 . B B . 22 ASN OD1 1 1 1 713 2 1 23 SER C C 1.607 14.127 -6.013 1.00 . B B . 23 SER C 1 1 1 714 2 1 23 SER CA C 0.285 14.243 -6.775 1.00 . B B . 23 SER CA 1 1 1 715 2 1 23 SER CB C -0.815 14.713 -5.822 1.00 . B B . 23 SER CB 1 1 1 716 2 1 23 SER H H -0.168 12.136 -6.747 1.00 . B B . 23 SER H 1 1 1 717 2 1 23 SER HA H 0.394 14.956 -7.578 1.00 . B B . 23 SER HA 1 1 1 718 2 1 23 SER HB2 H -1.780 14.502 -6.252 1.00 . B B . 23 SER HB2 1 1 1 719 2 1 23 SER HB3 H -0.722 14.190 -4.880 1.00 . B B . 23 SER HB3 1 1 1 720 2 1 23 SER HG H -0.443 16.258 -4.701 1.00 . B B . 23 SER HG 1 1 1 721 2 1 23 SER N N -0.082 12.914 -7.338 1.00 . B B . 23 SER N 1 1 1 722 2 1 23 SER O O 1.847 13.078 -5.439 1.00 . B B . 23 SER O 1 1 1 723 2 1 23 SER OXT O 2.357 15.089 -6.019 1.00 . B B . 23 SER OXT 1 1 1 724 2 1 23 SER OG O -0.691 16.113 -5.617 1.00 . B B . 23 SER OG 1 1 2 725 1 1 1 GLY C C -7.557 11.629 1.760 1.00 . A A . 1 GLY C 1 1 2 726 1 1 1 GLY CA C -9.080 11.500 1.843 1.00 . A A . 1 GLY CA 1 1 2 727 1 1 1 GLY H1 H -9.377 9.754 0.746 1.00 . A A . 1 GLY H1 1 1 2 728 1 1 1 GLY H2 H -9.116 11.136 -0.207 1.00 . A A . 1 GLY H2 1 1 2 729 1 1 1 GLY H3 H -10.612 10.902 0.564 1.00 . A A . 1 GLY H3 1 1 2 730 1 1 1 GLY HA2 H -9.527 12.483 1.877 1.00 . A A . 1 GLY HA2 1 1 2 731 1 1 1 GLY HA3 H -9.342 10.953 2.736 1.00 . A A . 1 GLY HA3 1 1 2 732 1 1 1 GLY N N -9.584 10.768 0.646 1.00 . A A . 1 GLY N 1 1 2 733 1 1 1 GLY O O -6.916 11.012 0.933 1.00 . A A . 1 GLY O 1 1 2 734 1 1 2 ILE C C -4.954 12.554 4.019 1.00 . A A . 2 ILE C 1 1 2 735 1 1 2 ILE CA C -5.494 12.592 2.587 1.00 . A A . 2 ILE CA 1 1 2 736 1 1 2 ILE CB C -5.139 13.937 1.946 1.00 . A A . 2 ILE CB 1 1 2 737 1 1 2 ILE CD1 C -5.811 15.550 0.158 1.00 . A A . 2 ILE CD1 1 1 2 738 1 1 2 ILE CG1 C -5.909 14.098 0.633 1.00 . A A . 2 ILE CG1 1 1 2 739 1 1 2 ILE CG2 C -3.636 13.985 1.662 1.00 . A A . 2 ILE CG2 1 1 2 740 1 1 2 ILE H H -7.509 12.912 3.274 1.00 . A A . 2 ILE H 1 1 2 741 1 1 2 ILE HA H -5.050 11.791 2.014 1.00 . A A . 2 ILE HA 1 1 2 742 1 1 2 ILE HB H -5.402 14.737 2.622 1.00 . A A . 2 ILE HB 1 1 2 743 1 1 2 ILE HD11 H -6.042 15.601 -0.896 1.00 . A A . 2 ILE HD11 1 1 2 744 1 1 2 ILE HD12 H -4.808 15.916 0.324 1.00 . A A . 2 ILE HD12 1 1 2 745 1 1 2 ILE HD13 H -6.512 16.159 0.710 1.00 . A A . 2 ILE HD13 1 1 2 746 1 1 2 ILE HG12 H -5.484 13.445 -0.117 1.00 . A A . 2 ILE HG12 1 1 2 747 1 1 2 ILE HG13 H -6.948 13.843 0.791 1.00 . A A . 2 ILE HG13 1 1 2 748 1 1 2 ILE HG21 H -3.092 13.938 2.594 1.00 . A A . 2 ILE HG21 1 1 2 749 1 1 2 ILE HG22 H -3.396 14.905 1.150 1.00 . A A . 2 ILE HG22 1 1 2 750 1 1 2 ILE HG23 H -3.360 13.145 1.041 1.00 . A A . 2 ILE HG23 1 1 2 751 1 1 2 ILE N N -6.974 12.425 2.614 1.00 . A A . 2 ILE N 1 1 2 752 1 1 2 ILE O O -5.551 13.090 4.932 1.00 . A A . 2 ILE O 1 1 2 753 1 1 3 GLY C C -3.168 10.387 6.030 1.00 . A A . 3 GLY C 1 1 2 754 1 1 3 GLY CA C -3.253 11.849 5.595 1.00 . A A . 3 GLY CA 1 1 2 755 1 1 3 GLY H H -3.366 11.497 3.472 1.00 . A A . 3 GLY H 1 1 2 756 1 1 3 GLY HA2 H -2.262 12.279 5.587 1.00 . A A . 3 GLY HA2 1 1 2 757 1 1 3 GLY HA3 H -3.880 12.392 6.283 1.00 . A A . 3 GLY HA3 1 1 2 758 1 1 3 GLY N N -3.831 11.924 4.223 1.00 . A A . 3 GLY N 1 1 2 759 1 1 3 GLY O O -3.285 10.063 7.196 1.00 . A A . 3 GLY O 1 1 2 760 1 1 4 LYS C C -2.118 7.365 4.288 1.00 . A A . 4 LYS C 1 1 2 761 1 1 4 LYS CA C -2.861 8.060 5.425 1.00 . A A . 4 LYS CA 1 1 2 762 1 1 4 LYS CB C -4.264 7.457 5.566 1.00 . A A . 4 LYS CB 1 1 2 763 1 1 4 LYS CD C -6.027 9.230 5.615 1.00 . A A . 4 LYS CD 1 1 2 764 1 1 4 LYS CE C -7.408 8.650 5.924 1.00 . A A . 4 LYS CE 1 1 2 765 1 1 4 LYS CG C -5.256 8.257 4.719 1.00 . A A . 4 LYS CG 1 1 2 766 1 1 4 LYS H H -2.869 9.801 4.165 1.00 . A A . 4 LYS H 1 1 2 767 1 1 4 LYS HA H -2.314 7.933 6.349 1.00 . A A . 4 LYS HA 1 1 2 768 1 1 4 LYS HB2 H -4.247 6.431 5.229 1.00 . A A . 4 LYS HB2 1 1 2 769 1 1 4 LYS HB3 H -4.567 7.490 6.602 1.00 . A A . 4 LYS HB3 1 1 2 770 1 1 4 LYS HD2 H -5.483 9.380 6.537 1.00 . A A . 4 LYS HD2 1 1 2 771 1 1 4 LYS HD3 H -6.141 10.175 5.105 1.00 . A A . 4 LYS HD3 1 1 2 772 1 1 4 LYS HE2 H -8.064 8.816 5.082 1.00 . A A . 4 LYS HE2 1 1 2 773 1 1 4 LYS HE3 H -7.321 7.590 6.109 1.00 . A A . 4 LYS HE3 1 1 2 774 1 1 4 LYS HG2 H -4.719 8.812 3.965 1.00 . A A . 4 LYS HG2 1 1 2 775 1 1 4 LYS HG3 H -5.951 7.581 4.244 1.00 . A A . 4 LYS HG3 1 1 2 776 1 1 4 LYS HZ1 H -7.201 9.541 7.795 1.00 . A A . 4 LYS HZ1 1 1 2 777 1 1 4 LYS HZ2 H -8.656 8.688 7.589 1.00 . A A . 4 LYS HZ2 1 1 2 778 1 1 4 LYS HZ3 H -8.443 10.203 6.849 1.00 . A A . 4 LYS HZ3 1 1 2 779 1 1 4 LYS N N -2.962 9.507 5.095 1.00 . A A . 4 LYS N 1 1 2 780 1 1 4 LYS NZ N -7.969 9.321 7.130 1.00 . A A . 4 LYS NZ 1 1 2 781 1 1 4 LYS O O -1.275 6.517 4.505 1.00 . A A . 4 LYS O 1 1 2 782 1 1 5 TYR C C -0.396 7.821 1.698 1.00 . A A . 5 TYR C 1 1 2 783 1 1 5 TYR CA C -1.740 7.119 1.914 1.00 . A A . 5 TYR CA 1 1 2 784 1 1 5 TYR CB C -2.621 7.266 0.675 1.00 . A A . 5 TYR CB 1 1 2 785 1 1 5 TYR CD1 C -4.678 5.889 1.124 1.00 . A A . 5 TYR CD1 1 1 2 786 1 1 5 TYR CD2 C -4.815 8.295 1.386 1.00 . A A . 5 TYR CD2 1 1 2 787 1 1 5 TYR CE1 C -6.024 5.771 1.491 1.00 . A A . 5 TYR CE1 1 1 2 788 1 1 5 TYR CE2 C -6.162 8.179 1.753 1.00 . A A . 5 TYR CE2 1 1 2 789 1 1 5 TYR CG C -4.074 7.149 1.072 1.00 . A A . 5 TYR CG 1 1 2 790 1 1 5 TYR CZ C -6.766 6.917 1.805 1.00 . A A . 5 TYR CZ 1 1 2 791 1 1 5 TYR H H -3.097 8.418 2.925 1.00 . A A . 5 TYR H 1 1 2 792 1 1 5 TYR HA H -1.572 6.076 2.107 1.00 . A A . 5 TYR HA 1 1 2 793 1 1 5 TYR HB2 H -2.448 8.225 0.211 1.00 . A A . 5 TYR HB2 1 1 2 794 1 1 5 TYR HB3 H -2.382 6.480 -0.017 1.00 . A A . 5 TYR HB3 1 1 2 795 1 1 5 TYR HD1 H -4.105 5.006 0.881 1.00 . A A . 5 TYR HD1 1 1 2 796 1 1 5 TYR HD2 H -4.346 9.270 1.346 1.00 . A A . 5 TYR HD2 1 1 2 797 1 1 5 TYR HE1 H -6.488 4.795 1.530 1.00 . A A . 5 TYR HE1 1 1 2 798 1 1 5 TYR HE2 H -6.734 9.062 1.997 1.00 . A A . 5 TYR HE2 1 1 2 799 1 1 5 TYR HH H -8.138 6.241 2.947 1.00 . A A . 5 TYR HH 1 1 2 800 1 1 5 TYR N N -2.421 7.731 3.074 1.00 . A A . 5 TYR N 1 1 2 801 1 1 5 TYR O O 0.435 7.371 0.934 1.00 . A A . 5 TYR O 1 1 2 802 1 1 5 TYR OH O -8.092 6.800 2.167 1.00 . A A . 5 TYR OH 1 1 2 803 1 1 6 LEU C C 1.900 9.602 3.517 1.00 . A A . 6 LEU C 1 1 2 804 1 1 6 LEU CA C 1.113 9.650 2.208 1.00 . A A . 6 LEU CA 1 1 2 805 1 1 6 LEU CB C 0.821 11.106 1.848 1.00 . A A . 6 LEU CB 1 1 2 806 1 1 6 LEU CD1 C 0.467 10.189 -0.450 1.00 . A A . 6 LEU CD1 1 1 2 807 1 1 6 LEU CD2 C -1.494 10.770 0.993 1.00 . A A . 6 LEU CD2 1 1 2 808 1 1 6 LEU CG C -0.066 11.158 0.609 1.00 . A A . 6 LEU CG 1 1 2 809 1 1 6 LEU H H -0.859 9.273 2.982 1.00 . A A . 6 LEU H 1 1 2 810 1 1 6 LEU HA H 1.693 9.191 1.421 1.00 . A A . 6 LEU HA 1 1 2 811 1 1 6 LEU HB2 H 0.314 11.584 2.672 1.00 . A A . 6 LEU HB2 1 1 2 812 1 1 6 LEU HB3 H 1.748 11.620 1.646 1.00 . A A . 6 LEU HB3 1 1 2 813 1 1 6 LEU HD11 H 1.449 10.511 -0.764 1.00 . A A . 6 LEU HD11 1 1 2 814 1 1 6 LEU HD12 H -0.199 10.179 -1.299 1.00 . A A . 6 LEU HD12 1 1 2 815 1 1 6 LEU HD13 H 0.532 9.194 -0.030 1.00 . A A . 6 LEU HD13 1 1 2 816 1 1 6 LEU HD21 H -2.193 11.265 0.337 1.00 . A A . 6 LEU HD21 1 1 2 817 1 1 6 LEU HD22 H -1.683 11.066 2.014 1.00 . A A . 6 LEU HD22 1 1 2 818 1 1 6 LEU HD23 H -1.610 9.702 0.903 1.00 . A A . 6 LEU HD23 1 1 2 819 1 1 6 LEU HG H -0.063 12.160 0.213 1.00 . A A . 6 LEU HG 1 1 2 820 1 1 6 LEU N N -0.175 8.922 2.371 1.00 . A A . 6 LEU N 1 1 2 821 1 1 6 LEU O O 2.893 10.284 3.677 1.00 . A A . 6 LEU O 1 1 2 822 1 1 7 HIS C C 2.447 7.276 6.133 1.00 . A A . 7 HIS C 1 1 2 823 1 1 7 HIS CA C 2.200 8.737 5.751 1.00 . A A . 7 HIS CA 1 1 2 824 1 1 7 HIS CB C 1.376 9.426 6.841 1.00 . A A . 7 HIS CB 1 1 2 825 1 1 7 HIS CD2 C -0.242 11.466 6.472 1.00 . A A . 7 HIS CD2 1 1 2 826 1 1 7 HIS CE1 C 1.107 12.734 5.345 1.00 . A A . 7 HIS CE1 1 1 2 827 1 1 7 HIS CG C 0.943 10.780 6.352 1.00 . A A . 7 HIS CG 1 1 2 828 1 1 7 HIS H H 0.662 8.269 4.315 1.00 . A A . 7 HIS H 1 1 2 829 1 1 7 HIS HA H 3.148 9.240 5.649 1.00 . A A . 7 HIS HA 1 1 2 830 1 1 7 HIS HB2 H 0.505 8.827 7.067 1.00 . A A . 7 HIS HB2 1 1 2 831 1 1 7 HIS HB3 H 1.977 9.540 7.730 1.00 . A A . 7 HIS HB3 1 1 2 832 1 1 7 HIS HD1 H 2.712 11.411 5.373 1.00 . A A . 7 HIS HD1 1 1 2 833 1 1 7 HIS HD2 H -1.124 11.098 6.976 1.00 . A A . 7 HIS HD2 1 1 2 834 1 1 7 HIS HE1 H 1.512 13.562 4.781 1.00 . A A . 7 HIS HE1 1 1 2 835 1 1 7 HIS N N 1.468 8.810 4.458 1.00 . A A . 7 HIS N 1 1 2 836 1 1 7 HIS ND1 N 1.787 11.609 5.629 1.00 . A A . 7 HIS ND1 1 1 2 837 1 1 7 HIS NE2 N -0.135 12.700 5.836 1.00 . A A . 7 HIS NE2 1 1 2 838 1 1 7 HIS O O 3.435 6.952 6.762 1.00 . A A . 7 HIS O 1 1 2 839 1 1 8 SER C C 1.660 4.092 4.868 1.00 . A A . 8 SER C 1 1 2 840 1 1 8 SER CA C 1.772 4.958 6.120 1.00 . A A . 8 SER CA 1 1 2 841 1 1 8 SER CB C 0.718 4.525 7.138 1.00 . A A . 8 SER CB 1 1 2 842 1 1 8 SER H H 0.772 6.664 5.259 1.00 . A A . 8 SER H 1 1 2 843 1 1 8 SER HA H 2.754 4.836 6.541 1.00 . A A . 8 SER HA 1 1 2 844 1 1 8 SER HB2 H -0.059 5.268 7.193 1.00 . A A . 8 SER HB2 1 1 2 845 1 1 8 SER HB3 H 0.289 3.581 6.831 1.00 . A A . 8 SER HB3 1 1 2 846 1 1 8 SER HG H 1.538 5.269 8.737 1.00 . A A . 8 SER HG 1 1 2 847 1 1 8 SER N N 1.564 6.390 5.765 1.00 . A A . 8 SER N 1 1 2 848 1 1 8 SER O O 2.286 3.057 4.762 1.00 . A A . 8 SER O 1 1 2 849 1 1 8 SER OG O 1.327 4.390 8.415 1.00 . A A . 8 SER OG 1 1 2 850 1 1 9 ALA C C 2.140 3.387 2.142 1.00 . A A . 9 ALA C 1 1 2 851 1 1 9 ALA CA C 0.749 3.694 2.675 1.00 . A A . 9 ALA CA 1 1 2 852 1 1 9 ALA CB C 0.002 4.493 1.623 1.00 . A A . 9 ALA CB 1 1 2 853 1 1 9 ALA H H 0.384 5.345 4.010 1.00 . A A . 9 ALA H 1 1 2 854 1 1 9 ALA HA H 0.222 2.776 2.885 1.00 . A A . 9 ALA HA 1 1 2 855 1 1 9 ALA HB1 H -1.043 4.224 1.632 1.00 . A A . 9 ALA HB1 1 1 2 856 1 1 9 ALA HB2 H 0.422 4.281 0.655 1.00 . A A . 9 ALA HB2 1 1 2 857 1 1 9 ALA HB3 H 0.108 5.543 1.832 1.00 . A A . 9 ALA HB3 1 1 2 858 1 1 9 ALA N N 0.878 4.503 3.916 1.00 . A A . 9 ALA N 1 1 2 859 1 1 9 ALA O O 2.630 2.283 2.263 1.00 . A A . 9 ALA O 1 1 2 860 1 1 10 LYS C C 4.907 3.123 1.751 1.00 . A A . 10 LYS C 1 1 2 861 1 1 10 LYS CA C 4.132 4.187 0.966 1.00 . A A . 10 LYS CA 1 1 2 862 1 1 10 LYS CB C 4.893 5.509 1.034 1.00 . A A . 10 LYS CB 1 1 2 863 1 1 10 LYS CD C 6.780 6.813 0.039 1.00 . A A . 10 LYS CD 1 1 2 864 1 1 10 LYS CE C 8.301 6.662 0.045 1.00 . A A . 10 LYS CE 1 1 2 865 1 1 10 LYS CG C 6.130 5.431 0.137 1.00 . A A . 10 LYS CG 1 1 2 866 1 1 10 LYS H H 2.307 5.247 1.457 1.00 . A A . 10 LYS H 1 1 2 867 1 1 10 LYS HA H 4.048 3.878 -0.064 1.00 . A A . 10 LYS HA 1 1 2 868 1 1 10 LYS HB2 H 4.254 6.311 0.699 1.00 . A A . 10 LYS HB2 1 1 2 869 1 1 10 LYS HB3 H 5.201 5.693 2.051 1.00 . A A . 10 LYS HB3 1 1 2 870 1 1 10 LYS HD2 H 6.469 7.292 -0.879 1.00 . A A . 10 LYS HD2 1 1 2 871 1 1 10 LYS HD3 H 6.475 7.414 0.882 1.00 . A A . 10 LYS HD3 1 1 2 872 1 1 10 LYS HE2 H 8.755 7.559 -0.348 1.00 . A A . 10 LYS HE2 1 1 2 873 1 1 10 LYS HE3 H 8.642 6.500 1.058 1.00 . A A . 10 LYS HE3 1 1 2 874 1 1 10 LYS HG2 H 6.836 4.729 0.558 1.00 . A A . 10 LYS HG2 1 1 2 875 1 1 10 LYS HG3 H 5.839 5.102 -0.849 1.00 . A A . 10 LYS HG3 1 1 2 876 1 1 10 LYS HZ1 H 8.887 4.679 -0.193 1.00 . A A . 10 LYS HZ1 1 1 2 877 1 1 10 LYS HZ2 H 9.533 5.737 -1.355 1.00 . A A . 10 LYS HZ2 1 1 2 878 1 1 10 LYS HZ3 H 7.904 5.264 -1.444 1.00 . A A . 10 LYS HZ3 1 1 2 879 1 1 10 LYS N N 2.760 4.372 1.540 1.00 . A A . 10 LYS N 1 1 2 880 1 1 10 LYS NZ N 8.685 5.497 -0.801 1.00 . A A . 10 LYS NZ 1 1 2 881 1 1 10 LYS O O 5.570 2.283 1.177 1.00 . A A . 10 LYS O 1 1 2 882 1 1 11 LYS C C 5.117 0.730 3.362 1.00 . A A . 11 LYS C 1 1 2 883 1 1 11 LYS CA C 5.554 2.109 3.849 1.00 . A A . 11 LYS CA 1 1 2 884 1 1 11 LYS CB C 5.221 2.262 5.333 1.00 . A A . 11 LYS CB 1 1 2 885 1 1 11 LYS CD C 5.877 3.410 7.450 1.00 . A A . 11 LYS CD 1 1 2 886 1 1 11 LYS CE C 6.119 4.823 7.980 1.00 . A A . 11 LYS CE 1 1 2 887 1 1 11 LYS CG C 6.054 3.397 5.931 1.00 . A A . 11 LYS CG 1 1 2 888 1 1 11 LYS H H 4.281 3.816 3.510 1.00 . A A . 11 LYS H 1 1 2 889 1 1 11 LYS HA H 6.618 2.223 3.700 1.00 . A A . 11 LYS HA 1 1 2 890 1 1 11 LYS HB2 H 4.172 2.486 5.445 1.00 . A A . 11 LYS HB2 1 1 2 891 1 1 11 LYS HB3 H 5.449 1.341 5.850 1.00 . A A . 11 LYS HB3 1 1 2 892 1 1 11 LYS HD2 H 4.873 3.097 7.698 1.00 . A A . 11 LYS HD2 1 1 2 893 1 1 11 LYS HD3 H 6.588 2.732 7.900 1.00 . A A . 11 LYS HD3 1 1 2 894 1 1 11 LYS HE2 H 6.308 5.492 7.154 1.00 . A A . 11 LYS HE2 1 1 2 895 1 1 11 LYS HE3 H 5.248 5.158 8.523 1.00 . A A . 11 LYS HE3 1 1 2 896 1 1 11 LYS HG2 H 7.096 3.244 5.688 1.00 . A A . 11 LYS HG2 1 1 2 897 1 1 11 LYS HG3 H 5.722 4.339 5.524 1.00 . A A . 11 LYS HG3 1 1 2 898 1 1 11 LYS HZ1 H 6.978 4.886 9.877 1.00 . A A . 11 LYS HZ1 1 1 2 899 1 1 11 LYS HZ2 H 7.915 5.621 8.666 1.00 . A A . 11 LYS HZ2 1 1 2 900 1 1 11 LYS HZ3 H 7.828 3.929 8.765 1.00 . A A . 11 LYS HZ3 1 1 2 901 1 1 11 LYS N N 4.825 3.139 3.056 1.00 . A A . 11 LYS N 1 1 2 902 1 1 11 LYS NZ N 7.299 4.814 8.891 1.00 . A A . 11 LYS NZ 1 1 2 903 1 1 11 LYS O O 5.898 -0.023 2.816 1.00 . A A . 11 LYS O 1 1 2 904 1 1 12 PHE C C 3.331 -0.874 1.529 1.00 . A A . 12 PHE C 1 1 2 905 1 1 12 PHE CA C 3.381 -0.919 3.055 1.00 . A A . 12 PHE CA 1 1 2 906 1 1 12 PHE CB C 1.976 -1.195 3.607 1.00 . A A . 12 PHE CB 1 1 2 907 1 1 12 PHE CD1 C 2.676 -0.818 6.000 1.00 . A A . 12 PHE CD1 1 1 2 908 1 1 12 PHE CD2 C 0.794 0.436 5.126 1.00 . A A . 12 PHE CD2 1 1 2 909 1 1 12 PHE CE1 C 2.525 -0.181 7.237 1.00 . A A . 12 PHE CE1 1 1 2 910 1 1 12 PHE CE2 C 0.644 1.073 6.363 1.00 . A A . 12 PHE CE2 1 1 2 911 1 1 12 PHE CG C 1.811 -0.510 4.944 1.00 . A A . 12 PHE CG 1 1 2 912 1 1 12 PHE CZ C 1.508 0.764 7.419 1.00 . A A . 12 PHE CZ 1 1 2 913 1 1 12 PHE H H 3.248 1.028 3.961 1.00 . A A . 12 PHE H 1 1 2 914 1 1 12 PHE HA H 4.059 -1.696 3.374 1.00 . A A . 12 PHE HA 1 1 2 915 1 1 12 PHE HB2 H 1.237 -0.815 2.916 1.00 . A A . 12 PHE HB2 1 1 2 916 1 1 12 PHE HB3 H 1.842 -2.261 3.732 1.00 . A A . 12 PHE HB3 1 1 2 917 1 1 12 PHE HD1 H 3.460 -1.548 5.859 1.00 . A A . 12 PHE HD1 1 1 2 918 1 1 12 PHE HD2 H 0.126 0.674 4.311 1.00 . A A . 12 PHE HD2 1 1 2 919 1 1 12 PHE HE1 H 3.193 -0.420 8.052 1.00 . A A . 12 PHE HE1 1 1 2 920 1 1 12 PHE HE2 H -0.142 1.801 6.502 1.00 . A A . 12 PHE HE2 1 1 2 921 1 1 12 PHE HZ H 1.392 1.256 8.373 1.00 . A A . 12 PHE HZ 1 1 2 922 1 1 12 PHE N N 3.868 0.401 3.535 1.00 . A A . 12 PHE N 1 1 2 923 1 1 12 PHE O O 3.455 -1.879 0.860 1.00 . A A . 12 PHE O 1 1 2 924 1 1 13 GLY C C 4.319 -0.270 -1.118 1.00 . A A . 13 GLY C 1 1 2 925 1 1 13 GLY CA C 3.105 0.427 -0.507 1.00 . A A . 13 GLY CA 1 1 2 926 1 1 13 GLY H H 3.065 1.093 1.539 1.00 . A A . 13 GLY H 1 1 2 927 1 1 13 GLY HA2 H 2.200 -0.026 -0.879 1.00 . A A . 13 GLY HA2 1 1 2 928 1 1 13 GLY HA3 H 3.122 1.472 -0.776 1.00 . A A . 13 GLY HA3 1 1 2 929 1 1 13 GLY N N 3.157 0.297 0.975 1.00 . A A . 13 GLY N 1 1 2 930 1 1 13 GLY O O 4.211 -0.991 -2.090 1.00 . A A . 13 GLY O 1 1 2 931 1 1 14 LYS C C 6.867 -2.104 -0.518 1.00 . A A . 14 LYS C 1 1 2 932 1 1 14 LYS CA C 6.702 -0.702 -1.108 1.00 . A A . 14 LYS CA 1 1 2 933 1 1 14 LYS CB C 7.926 0.139 -0.747 1.00 . A A . 14 LYS CB 1 1 2 934 1 1 14 LYS CD C 8.962 0.540 -2.984 1.00 . A A . 14 LYS CD 1 1 2 935 1 1 14 LYS CE C 10.366 0.179 -2.495 1.00 . A A . 14 LYS CE 1 1 2 936 1 1 14 LYS CG C 8.172 1.180 -1.839 1.00 . A A . 14 LYS CG 1 1 2 937 1 1 14 LYS H H 5.543 0.536 0.225 1.00 . A A . 14 LYS H 1 1 2 938 1 1 14 LYS HA H 6.617 -0.773 -2.180 1.00 . A A . 14 LYS HA 1 1 2 939 1 1 14 LYS HB2 H 7.754 0.638 0.196 1.00 . A A . 14 LYS HB2 1 1 2 940 1 1 14 LYS HB3 H 8.790 -0.503 -0.662 1.00 . A A . 14 LYS HB3 1 1 2 941 1 1 14 LYS HD2 H 8.454 -0.354 -3.314 1.00 . A A . 14 LYS HD2 1 1 2 942 1 1 14 LYS HD3 H 9.036 1.236 -3.805 1.00 . A A . 14 LYS HD3 1 1 2 943 1 1 14 LYS HE2 H 10.802 1.028 -1.993 1.00 . A A . 14 LYS HE2 1 1 2 944 1 1 14 LYS HE3 H 10.305 -0.653 -1.809 1.00 . A A . 14 LYS HE3 1 1 2 945 1 1 14 LYS HG2 H 7.225 1.542 -2.212 1.00 . A A . 14 LYS HG2 1 1 2 946 1 1 14 LYS HG3 H 8.738 2.004 -1.432 1.00 . A A . 14 LYS HG3 1 1 2 947 1 1 14 LYS HZ1 H 10.895 -1.113 -4.041 1.00 . A A . 14 LYS HZ1 1 1 2 948 1 1 14 LYS HZ2 H 12.208 -0.281 -3.352 1.00 . A A . 14 LYS HZ2 1 1 2 949 1 1 14 LYS HZ3 H 11.140 0.527 -4.397 1.00 . A A . 14 LYS HZ3 1 1 2 950 1 1 14 LYS N N 5.478 -0.056 -0.557 1.00 . A A . 14 LYS N 1 1 2 951 1 1 14 LYS NZ N 11.217 -0.200 -3.659 1.00 . A A . 14 LYS NZ 1 1 2 952 1 1 14 LYS O O 7.660 -2.894 -0.993 1.00 . A A . 14 LYS O 1 1 2 953 1 1 15 ALA C C 5.152 -4.694 0.653 1.00 . A A . 15 ALA C 1 1 2 954 1 1 15 ALA CA C 6.286 -3.775 1.124 1.00 . A A . 15 ALA CA 1 1 2 955 1 1 15 ALA CB C 6.245 -3.654 2.648 1.00 . A A . 15 ALA CB 1 1 2 956 1 1 15 ALA H H 5.511 -1.776 0.898 1.00 . A A . 15 ALA H 1 1 2 957 1 1 15 ALA HA H 7.234 -4.198 0.827 1.00 . A A . 15 ALA HA 1 1 2 958 1 1 15 ALA HB1 H 6.698 -4.529 3.091 1.00 . A A . 15 ALA HB1 1 1 2 959 1 1 15 ALA HB2 H 5.219 -3.575 2.977 1.00 . A A . 15 ALA HB2 1 1 2 960 1 1 15 ALA HB3 H 6.790 -2.774 2.954 1.00 . A A . 15 ALA HB3 1 1 2 961 1 1 15 ALA N N 6.141 -2.424 0.516 1.00 . A A . 15 ALA N 1 1 2 962 1 1 15 ALA O O 5.382 -5.803 0.228 1.00 . A A . 15 ALA O 1 1 2 963 1 1 16 TRP C C 2.904 -5.448 -1.166 1.00 . A A . 16 TRP C 1 1 2 964 1 1 16 TRP CA C 2.780 -5.083 0.313 1.00 . A A . 16 TRP CA 1 1 2 965 1 1 16 TRP CB C 1.477 -4.313 0.584 1.00 . A A . 16 TRP CB 1 1 2 966 1 1 16 TRP CD1 C 1.193 -2.077 -0.572 1.00 . A A . 16 TRP CD1 1 1 2 967 1 1 16 TRP CD2 C 0.694 -3.818 -1.887 1.00 . A A . 16 TRP CD2 1 1 2 968 1 1 16 TRP CE2 C 0.502 -2.661 -2.672 1.00 . A A . 16 TRP CE2 1 1 2 969 1 1 16 TRP CE3 C 0.448 -5.064 -2.462 1.00 . A A . 16 TRP CE3 1 1 2 970 1 1 16 TRP CG C 1.141 -3.427 -0.572 1.00 . A A . 16 TRP CG 1 1 2 971 1 1 16 TRP CH2 C -0.165 -3.996 -4.564 1.00 . A A . 16 TRP CH2 1 1 2 972 1 1 16 TRP CZ2 C 0.077 -2.741 -3.998 1.00 . A A . 16 TRP CZ2 1 1 2 973 1 1 16 TRP CZ3 C 0.019 -5.157 -3.797 1.00 . A A . 16 TRP CZ3 1 1 2 974 1 1 16 TRP H H 3.769 -3.349 1.087 1.00 . A A . 16 TRP H 1 1 2 975 1 1 16 TRP HA H 2.773 -5.992 0.892 1.00 . A A . 16 TRP HA 1 1 2 976 1 1 16 TRP HB2 H 0.673 -5.016 0.737 1.00 . A A . 16 TRP HB2 1 1 2 977 1 1 16 TRP HB3 H 1.598 -3.710 1.472 1.00 . A A . 16 TRP HB3 1 1 2 978 1 1 16 TRP HD1 H 1.483 -1.461 0.262 1.00 . A A . 16 TRP HD1 1 1 2 979 1 1 16 TRP HE1 H 0.783 -0.677 -2.094 1.00 . A A . 16 TRP HE1 1 1 2 980 1 1 16 TRP HE3 H 0.586 -5.957 -1.863 1.00 . A A . 16 TRP HE3 1 1 2 981 1 1 16 TRP HH2 H -0.495 -4.074 -5.591 1.00 . A A . 16 TRP HH2 1 1 2 982 1 1 16 TRP HZ2 H -0.062 -1.843 -4.582 1.00 . A A . 16 TRP HZ2 1 1 2 983 1 1 16 TRP HZ3 H -0.169 -6.121 -4.237 1.00 . A A . 16 TRP HZ3 1 1 2 984 1 1 16 TRP N N 3.932 -4.241 0.737 1.00 . A A . 16 TRP N 1 1 2 985 1 1 16 TRP NE1 N 0.822 -1.619 -1.824 1.00 . A A . 16 TRP NE1 1 1 2 986 1 1 16 TRP O O 2.642 -6.568 -1.558 1.00 . A A . 16 TRP O 1 1 2 987 1 1 17 VAL C C 4.417 -6.009 -3.596 1.00 . A A . 17 VAL C 1 1 2 988 1 1 17 VAL CA C 3.427 -4.848 -3.436 1.00 . A A . 17 VAL CA 1 1 2 989 1 1 17 VAL CB C 3.886 -3.590 -4.200 1.00 . A A . 17 VAL CB 1 1 2 990 1 1 17 VAL CG1 C 5.379 -3.658 -4.550 1.00 . A A . 17 VAL CG1 1 1 2 991 1 1 17 VAL CG2 C 3.069 -3.463 -5.487 1.00 . A A . 17 VAL CG2 1 1 2 992 1 1 17 VAL H H 3.505 -3.624 -1.668 1.00 . A A . 17 VAL H 1 1 2 993 1 1 17 VAL HA H 2.462 -5.158 -3.811 1.00 . A A . 17 VAL HA 1 1 2 994 1 1 17 VAL HB H 3.708 -2.722 -3.581 1.00 . A A . 17 VAL HB 1 1 2 995 1 1 17 VAL HG11 H 5.595 -4.602 -5.027 1.00 . A A . 17 VAL HG11 1 1 2 996 1 1 17 VAL HG12 H 5.965 -3.569 -3.647 1.00 . A A . 17 VAL HG12 1 1 2 997 1 1 17 VAL HG13 H 5.629 -2.851 -5.222 1.00 . A A . 17 VAL HG13 1 1 2 998 1 1 17 VAL HG21 H 3.716 -3.165 -6.299 1.00 . A A . 17 VAL HG21 1 1 2 999 1 1 17 VAL HG22 H 2.297 -2.719 -5.350 1.00 . A A . 17 VAL HG22 1 1 2 1000 1 1 17 VAL HG23 H 2.613 -4.414 -5.719 1.00 . A A . 17 VAL HG23 1 1 2 1001 1 1 17 VAL N N 3.297 -4.524 -1.993 1.00 . A A . 17 VAL N 1 1 2 1002 1 1 17 VAL O O 4.111 -7.020 -4.193 1.00 . A A . 17 VAL O 1 1 2 1003 1 1 18 GLY C C 5.937 -8.293 -2.649 1.00 . A A . 18 GLY C 1 1 2 1004 1 1 18 GLY CA C 6.578 -6.998 -3.158 1.00 . A A . 18 GLY CA 1 1 2 1005 1 1 18 GLY H H 5.822 -5.072 -2.550 1.00 . A A . 18 GLY H 1 1 2 1006 1 1 18 GLY HA2 H 6.866 -7.118 -4.194 1.00 . A A . 18 GLY HA2 1 1 2 1007 1 1 18 GLY HA3 H 7.449 -6.772 -2.564 1.00 . A A . 18 GLY HA3 1 1 2 1008 1 1 18 GLY N N 5.592 -5.886 -3.046 1.00 . A A . 18 GLY N 1 1 2 1009 1 1 18 GLY O O 6.406 -9.380 -2.922 1.00 . A A . 18 GLY O 1 1 2 1010 1 1 19 GLU C C 3.157 -9.845 -2.420 1.00 . A A . 19 GLU C 1 1 2 1011 1 1 19 GLU CA C 4.175 -9.388 -1.392 1.00 . A A . 19 GLU CA 1 1 2 1012 1 1 19 GLU CB C 3.433 -9.016 -0.107 1.00 . A A . 19 GLU CB 1 1 2 1013 1 1 19 GLU CD C 4.935 -9.194 1.881 1.00 . A A . 19 GLU CD 1 1 2 1014 1 1 19 GLU CG C 4.369 -8.250 0.817 1.00 . A A . 19 GLU CG 1 1 2 1015 1 1 19 GLU H H 4.496 -7.299 -1.714 1.00 . A A . 19 GLU H 1 1 2 1016 1 1 19 GLU HA H 4.888 -10.171 -1.199 1.00 . A A . 19 GLU HA 1 1 2 1017 1 1 19 GLU HB2 H 2.585 -8.381 -0.353 1.00 . A A . 19 GLU HB2 1 1 2 1018 1 1 19 GLU HB3 H 3.087 -9.911 0.388 1.00 . A A . 19 GLU HB3 1 1 2 1019 1 1 19 GLU HG2 H 5.176 -7.835 0.236 1.00 . A A . 19 GLU HG2 1 1 2 1020 1 1 19 GLU HG3 H 3.819 -7.455 1.298 1.00 . A A . 19 GLU HG3 1 1 2 1021 1 1 19 GLU N N 4.862 -8.181 -1.916 1.00 . A A . 19 GLU N 1 1 2 1022 1 1 19 GLU O O 3.257 -10.909 -2.999 1.00 . A A . 19 GLU O 1 1 2 1023 1 1 19 GLU OE1 O 4.607 -10.369 1.837 1.00 . A A . 19 GLU OE1 1 1 2 1024 1 1 19 GLU OE2 O 5.686 -8.726 2.721 1.00 . A A . 19 GLU OE2 1 1 2 1025 1 1 20 ILE C C 1.676 -9.272 -5.034 1.00 . A A . 20 ILE C 1 1 2 1026 1 1 20 ILE CA C 1.116 -9.371 -3.615 1.00 . A A . 20 ILE CA 1 1 2 1027 1 1 20 ILE CB C -0.014 -8.366 -3.431 1.00 . A A . 20 ILE CB 1 1 2 1028 1 1 20 ILE CD1 C -1.973 -7.758 -2.010 1.00 . A A . 20 ILE CD1 1 1 2 1029 1 1 20 ILE CG1 C -0.870 -8.791 -2.244 1.00 . A A . 20 ILE CG1 1 1 2 1030 1 1 20 ILE CG2 C -0.884 -8.296 -4.689 1.00 . A A . 20 ILE CG2 1 1 2 1031 1 1 20 ILE H H 2.124 -8.183 -2.147 1.00 . A A . 20 ILE H 1 1 2 1032 1 1 20 ILE HA H 0.755 -10.365 -3.428 1.00 . A A . 20 ILE HA 1 1 2 1033 1 1 20 ILE HB H 0.419 -7.397 -3.227 1.00 . A A . 20 ILE HB 1 1 2 1034 1 1 20 ILE HD11 H -1.528 -6.790 -1.834 1.00 . A A . 20 ILE HD11 1 1 2 1035 1 1 20 ILE HD12 H -2.559 -8.047 -1.150 1.00 . A A . 20 ILE HD12 1 1 2 1036 1 1 20 ILE HD13 H -2.610 -7.708 -2.880 1.00 . A A . 20 ILE HD13 1 1 2 1037 1 1 20 ILE HG12 H -1.312 -9.754 -2.452 1.00 . A A . 20 ILE HG12 1 1 2 1038 1 1 20 ILE HG13 H -0.247 -8.856 -1.363 1.00 . A A . 20 ILE HG13 1 1 2 1039 1 1 20 ILE HG21 H -1.881 -7.976 -4.422 1.00 . A A . 20 ILE HG21 1 1 2 1040 1 1 20 ILE HG22 H -0.932 -9.273 -5.149 1.00 . A A . 20 ILE HG22 1 1 2 1041 1 1 20 ILE HG23 H -0.454 -7.592 -5.385 1.00 . A A . 20 ILE HG23 1 1 2 1042 1 1 20 ILE N N 2.172 -9.034 -2.639 1.00 . A A . 20 ILE N 1 1 2 1043 1 1 20 ILE O O 1.515 -10.162 -5.844 1.00 . A A . 20 ILE O 1 1 2 1044 1 1 21 MET C C 3.827 -9.171 -7.027 1.00 . A A . 21 MET C 1 1 2 1045 1 1 21 MET CA C 2.883 -8.010 -6.701 1.00 . A A . 21 MET CA 1 1 2 1046 1 1 21 MET CB C 3.646 -6.689 -6.758 1.00 . A A . 21 MET CB 1 1 2 1047 1 1 21 MET CE C 3.582 -5.349 -10.644 1.00 . A A . 21 MET CE 1 1 2 1048 1 1 21 MET CG C 3.235 -5.919 -8.010 1.00 . A A . 21 MET CG 1 1 2 1049 1 1 21 MET H H 2.431 -7.478 -4.669 1.00 . A A . 21 MET H 1 1 2 1050 1 1 21 MET HA H 2.077 -7.989 -7.420 1.00 . A A . 21 MET HA 1 1 2 1051 1 1 21 MET HB2 H 3.405 -6.101 -5.883 1.00 . A A . 21 MET HB2 1 1 2 1052 1 1 21 MET HB3 H 4.707 -6.884 -6.786 1.00 . A A . 21 MET HB3 1 1 2 1053 1 1 21 MET HE1 H 3.424 -6.062 -11.441 1.00 . A A . 21 MET HE1 1 1 2 1054 1 1 21 MET HE2 H 4.152 -4.514 -11.020 1.00 . A A . 21 MET HE2 1 1 2 1055 1 1 21 MET HE3 H 2.630 -4.995 -10.275 1.00 . A A . 21 MET HE3 1 1 2 1056 1 1 21 MET HG2 H 2.283 -6.291 -8.363 1.00 . A A . 21 MET HG2 1 1 2 1057 1 1 21 MET HG3 H 3.147 -4.869 -7.770 1.00 . A A . 21 MET HG3 1 1 2 1058 1 1 21 MET N N 2.321 -8.186 -5.339 1.00 . A A . 21 MET N 1 1 2 1059 1 1 21 MET O O 4.112 -9.445 -8.175 1.00 . A A . 21 MET O 1 1 2 1060 1 1 21 MET SD S 4.490 -6.144 -9.296 1.00 . A A . 21 MET SD 1 1 2 1061 1 1 22 ASN C C 4.474 -12.318 -6.147 1.00 . A A . 22 ASN C 1 1 2 1062 1 1 22 ASN CA C 5.235 -10.999 -6.292 1.00 . A A . 22 ASN CA 1 1 2 1063 1 1 22 ASN CB C 6.394 -10.962 -5.293 1.00 . A A . 22 ASN CB 1 1 2 1064 1 1 22 ASN CG C 7.676 -11.432 -5.982 1.00 . A A . 22 ASN CG 1 1 2 1065 1 1 22 ASN H H 4.072 -9.625 -5.104 1.00 . A A . 22 ASN H 1 1 2 1066 1 1 22 ASN HA H 5.625 -10.918 -7.296 1.00 . A A . 22 ASN HA 1 1 2 1067 1 1 22 ASN HB2 H 6.526 -9.951 -4.935 1.00 . A A . 22 ASN HB2 1 1 2 1068 1 1 22 ASN HB3 H 6.173 -11.617 -4.461 1.00 . A A . 22 ASN HB3 1 1 2 1069 1 1 22 ASN HD21 H 8.704 -11.564 -4.285 1.00 . A A . 22 ASN HD21 1 1 2 1070 1 1 22 ASN HD22 H 9.566 -11.981 -5.698 1.00 . A A . 22 ASN HD22 1 1 2 1071 1 1 22 ASN N N 4.314 -9.858 -6.027 1.00 . A A . 22 ASN N 1 1 2 1072 1 1 22 ASN ND2 N 8.736 -11.680 -5.262 1.00 . A A . 22 ASN ND2 1 1 2 1073 1 1 22 ASN O O 4.704 -13.261 -6.877 1.00 . A A . 22 ASN O 1 1 2 1074 1 1 22 ASN OD1 O 7.714 -11.574 -7.188 1.00 . A A . 22 ASN OD1 1 1 2 1075 1 1 23 SER C C 1.331 -13.414 -5.406 1.00 . A A . 23 SER C 1 1 2 1076 1 1 23 SER CA C 2.794 -13.652 -5.023 1.00 . A A . 23 SER CA 1 1 2 1077 1 1 23 SER CB C 2.871 -14.089 -3.560 1.00 . A A . 23 SER CB 1 1 2 1078 1 1 23 SER H H 3.396 -11.622 -4.630 1.00 . A A . 23 SER H 1 1 2 1079 1 1 23 SER HA H 3.209 -14.426 -5.652 1.00 . A A . 23 SER HA 1 1 2 1080 1 1 23 SER HB2 H 2.684 -13.243 -2.919 1.00 . A A . 23 SER HB2 1 1 2 1081 1 1 23 SER HB3 H 2.127 -14.851 -3.373 1.00 . A A . 23 SER HB3 1 1 2 1082 1 1 23 SER HG H 4.497 -15.014 -4.094 1.00 . A A . 23 SER HG 1 1 2 1083 1 1 23 SER N N 3.568 -12.393 -5.210 1.00 . A A . 23 SER N 1 1 2 1084 1 1 23 SER O O 0.766 -14.268 -6.068 1.00 . A A . 23 SER O 1 1 2 1085 1 1 23 SER OXT O 0.802 -12.380 -5.031 1.00 . A A . 23 SER OXT 1 1 2 1086 1 1 23 SER OG O 4.170 -14.601 -3.292 1.00 . A A . 23 SER OG 1 1 2 1087 2 1 1 GLY C C 3.393 -12.170 7.499 1.00 . B B . 1 GLY C 1 1 2 1088 2 1 1 GLY CA C 4.045 -13.351 8.219 1.00 . B B . 1 GLY CA 1 1 2 1089 2 1 1 GLY H1 H 3.321 -15.110 7.371 1.00 . B B . 1 GLY H1 1 1 2 1090 2 1 1 GLY H2 H 5.013 -15.054 7.512 1.00 . B B . 1 GLY H2 1 1 2 1091 2 1 1 GLY H3 H 4.228 -14.152 6.305 1.00 . B B . 1 GLY H3 1 1 2 1092 2 1 1 GLY HA2 H 3.439 -13.637 9.067 1.00 . B B . 1 GLY HA2 1 1 2 1093 2 1 1 GLY HA3 H 5.027 -13.062 8.559 1.00 . B B . 1 GLY HA3 1 1 2 1094 2 1 1 GLY N N 4.160 -14.504 7.281 1.00 . B B . 1 GLY N 1 1 2 1095 2 1 1 GLY O O 3.725 -11.025 7.733 1.00 . B B . 1 GLY O 1 1 2 1096 2 1 2 ILE C C 0.333 -11.243 6.328 1.00 . B B . 2 ILE C 1 1 2 1097 2 1 2 ILE CA C 1.793 -11.339 5.881 1.00 . B B . 2 ILE CA 1 1 2 1098 2 1 2 ILE CB C 1.851 -11.631 4.381 1.00 . B B . 2 ILE CB 1 1 2 1099 2 1 2 ILE CD1 C 1.255 -13.352 2.668 1.00 . B B . 2 ILE CD1 1 1 2 1100 2 1 2 ILE CG1 C 1.573 -13.118 4.145 1.00 . B B . 2 ILE CG1 1 1 2 1101 2 1 2 ILE CG2 C 3.243 -11.286 3.848 1.00 . B B . 2 ILE CG2 1 1 2 1102 2 1 2 ILE H H 2.217 -13.372 6.447 1.00 . B B . 2 ILE H 1 1 2 1103 2 1 2 ILE HA H 2.296 -10.405 6.087 1.00 . B B . 2 ILE HA 1 1 2 1104 2 1 2 ILE HB H 1.109 -11.036 3.868 1.00 . B B . 2 ILE HB 1 1 2 1105 2 1 2 ILE HD11 H 1.987 -12.846 2.057 1.00 . B B . 2 ILE HD11 1 1 2 1106 2 1 2 ILE HD12 H 0.271 -12.966 2.445 1.00 . B B . 2 ILE HD12 1 1 2 1107 2 1 2 ILE HD13 H 1.280 -14.412 2.458 1.00 . B B . 2 ILE HD13 1 1 2 1108 2 1 2 ILE HG12 H 2.445 -13.695 4.422 1.00 . B B . 2 ILE HG12 1 1 2 1109 2 1 2 ILE HG13 H 0.728 -13.426 4.747 1.00 . B B . 2 ILE HG13 1 1 2 1110 2 1 2 ILE HG21 H 3.244 -10.272 3.475 1.00 . B B . 2 ILE HG21 1 1 2 1111 2 1 2 ILE HG22 H 3.503 -11.964 3.049 1.00 . B B . 2 ILE HG22 1 1 2 1112 2 1 2 ILE HG23 H 3.966 -11.376 4.645 1.00 . B B . 2 ILE HG23 1 1 2 1113 2 1 2 ILE N N 2.468 -12.441 6.621 1.00 . B B . 2 ILE N 1 1 2 1114 2 1 2 ILE O O -0.532 -11.911 5.799 1.00 . B B . 2 ILE O 1 1 2 1115 2 1 3 GLY C C -1.781 -8.820 7.744 1.00 . B B . 3 GLY C 1 1 2 1116 2 1 3 GLY CA C -1.357 -10.288 7.773 1.00 . B B . 3 GLY CA 1 1 2 1117 2 1 3 GLY H H 0.759 -9.886 7.717 1.00 . B B . 3 GLY H 1 1 2 1118 2 1 3 GLY HA2 H -2.002 -10.859 7.119 1.00 . B B . 3 GLY HA2 1 1 2 1119 2 1 3 GLY HA3 H -1.438 -10.665 8.780 1.00 . B B . 3 GLY HA3 1 1 2 1120 2 1 3 GLY N N 0.049 -10.417 7.300 1.00 . B B . 3 GLY N 1 1 2 1121 2 1 3 GLY O O -2.671 -8.403 8.460 1.00 . B B . 3 GLY O 1 1 2 1122 2 1 4 LYS C C -1.283 -6.139 5.377 1.00 . B B . 4 LYS C 1 1 2 1123 2 1 4 LYS CA C -1.523 -6.597 6.813 1.00 . B B . 4 LYS CA 1 1 2 1124 2 1 4 LYS CB C -0.667 -5.761 7.774 1.00 . B B . 4 LYS CB 1 1 2 1125 2 1 4 LYS CD C 1.264 -5.843 9.355 1.00 . B B . 4 LYS CD 1 1 2 1126 2 1 4 LYS CE C 0.357 -5.989 10.578 1.00 . B B . 4 LYS CE 1 1 2 1127 2 1 4 LYS CG C 0.607 -6.523 8.152 1.00 . B B . 4 LYS CG 1 1 2 1128 2 1 4 LYS H H -0.451 -8.400 6.339 1.00 . B B . 4 LYS H 1 1 2 1129 2 1 4 LYS HA H -2.568 -6.475 7.060 1.00 . B B . 4 LYS HA 1 1 2 1130 2 1 4 LYS HB2 H -0.399 -4.831 7.297 1.00 . B B . 4 LYS HB2 1 1 2 1131 2 1 4 LYS HB3 H -1.235 -5.554 8.668 1.00 . B B . 4 LYS HB3 1 1 2 1132 2 1 4 LYS HD2 H 2.219 -6.308 9.555 1.00 . B B . 4 LYS HD2 1 1 2 1133 2 1 4 LYS HD3 H 1.410 -4.795 9.140 1.00 . B B . 4 LYS HD3 1 1 2 1134 2 1 4 LYS HE2 H -0.222 -5.086 10.707 1.00 . B B . 4 LYS HE2 1 1 2 1135 2 1 4 LYS HE3 H -0.309 -6.826 10.434 1.00 . B B . 4 LYS HE3 1 1 2 1136 2 1 4 LYS HG2 H 0.356 -7.543 8.408 1.00 . B B . 4 LYS HG2 1 1 2 1137 2 1 4 LYS HG3 H 1.293 -6.518 7.318 1.00 . B B . 4 LYS HG3 1 1 2 1138 2 1 4 LYS HZ1 H 0.773 -6.984 12.359 1.00 . B B . 4 LYS HZ1 1 1 2 1139 2 1 4 LYS HZ2 H 1.231 -5.347 12.357 1.00 . B B . 4 LYS HZ2 1 1 2 1140 2 1 4 LYS HZ3 H 2.152 -6.492 11.505 1.00 . B B . 4 LYS HZ3 1 1 2 1141 2 1 4 LYS N N -1.158 -8.038 6.911 1.00 . B B . 4 LYS N 1 1 2 1142 2 1 4 LYS NZ N 1.191 -6.221 11.792 1.00 . B B . 4 LYS NZ 1 1 2 1143 2 1 4 LYS O O -2.114 -5.491 4.770 1.00 . B B . 4 LYS O 1 1 2 1144 2 1 5 TYR C C -0.759 -6.896 2.487 1.00 . B B . 5 TYR C 1 1 2 1145 2 1 5 TYR CA C 0.146 -6.108 3.425 1.00 . B B . 5 TYR CA 1 1 2 1146 2 1 5 TYR CB C 1.609 -6.418 3.138 1.00 . B B . 5 TYR CB 1 1 2 1147 2 1 5 TYR CD1 C 2.794 -4.780 4.641 1.00 . B B . 5 TYR CD1 1 1 2 1148 2 1 5 TYR CD2 C 2.853 -7.136 5.212 1.00 . B B . 5 TYR CD2 1 1 2 1149 2 1 5 TYR CE1 C 3.562 -4.486 5.772 1.00 . B B . 5 TYR CE1 1 1 2 1150 2 1 5 TYR CE2 C 3.622 -6.841 6.344 1.00 . B B . 5 TYR CE2 1 1 2 1151 2 1 5 TYR CG C 2.439 -6.105 4.361 1.00 . B B . 5 TYR CG 1 1 2 1152 2 1 5 TYR CZ C 3.977 -5.516 6.624 1.00 . B B . 5 TYR CZ 1 1 2 1153 2 1 5 TYR H H 0.491 -7.024 5.328 1.00 . B B . 5 TYR H 1 1 2 1154 2 1 5 TYR HA H -0.029 -5.059 3.280 1.00 . B B . 5 TYR HA 1 1 2 1155 2 1 5 TYR HB2 H 1.718 -7.463 2.880 1.00 . B B . 5 TYR HB2 1 1 2 1156 2 1 5 TYR HB3 H 1.940 -5.806 2.325 1.00 . B B . 5 TYR HB3 1 1 2 1157 2 1 5 TYR HD1 H 2.475 -3.984 3.983 1.00 . B B . 5 TYR HD1 1 1 2 1158 2 1 5 TYR HD2 H 2.580 -8.158 4.995 1.00 . B B . 5 TYR HD2 1 1 2 1159 2 1 5 TYR HE1 H 3.836 -3.462 5.988 1.00 . B B . 5 TYR HE1 1 1 2 1160 2 1 5 TYR HE2 H 3.942 -7.636 7.001 1.00 . B B . 5 TYR HE2 1 1 2 1161 2 1 5 TYR HH H 5.589 -4.902 7.441 1.00 . B B . 5 TYR HH 1 1 2 1162 2 1 5 TYR N N -0.156 -6.491 4.824 1.00 . B B . 5 TYR N 1 1 2 1163 2 1 5 TYR O O -0.904 -6.567 1.327 1.00 . B B . 5 TYR O 1 1 2 1164 2 1 5 TYR OH O 4.735 -5.225 7.739 1.00 . B B . 5 TYR OH 1 1 2 1165 2 1 6 LEU C C -3.723 -8.602 2.583 1.00 . B B . 6 LEU C 1 1 2 1166 2 1 6 LEU CA C -2.273 -8.732 2.107 1.00 . B B . 6 LEU CA 1 1 2 1167 2 1 6 LEU CB C -1.840 -10.198 2.160 1.00 . B B . 6 LEU CB 1 1 2 1168 2 1 6 LEU CD1 C -1.276 -10.879 -0.174 1.00 . B B . 6 LEU CD1 1 1 2 1169 2 1 6 LEU CD2 C 0.157 -9.188 0.984 1.00 . B B . 6 LEU CD2 1 1 2 1170 2 1 6 LEU CG C -0.693 -10.456 1.172 1.00 . B B . 6 LEU CG 1 1 2 1171 2 1 6 LEU H H -1.247 -8.188 3.918 1.00 . B B . 6 LEU H 1 1 2 1172 2 1 6 LEU HA H -2.196 -8.368 1.093 1.00 . B B . 6 LEU HA 1 1 2 1173 2 1 6 LEU HB2 H -1.508 -10.435 3.161 1.00 . B B . 6 LEU HB2 1 1 2 1174 2 1 6 LEU HB3 H -2.679 -10.828 1.903 1.00 . B B . 6 LEU HB3 1 1 2 1175 2 1 6 LEU HD11 H -1.898 -11.751 -0.039 1.00 . B B . 6 LEU HD11 1 1 2 1176 2 1 6 LEU HD12 H -0.474 -11.112 -0.859 1.00 . B B . 6 LEU HD12 1 1 2 1177 2 1 6 LEU HD13 H -1.873 -10.072 -0.574 1.00 . B B . 6 LEU HD13 1 1 2 1178 2 1 6 LEU HD21 H 0.469 -8.818 1.950 1.00 . B B . 6 LEU HD21 1 1 2 1179 2 1 6 LEU HD22 H -0.429 -8.431 0.483 1.00 . B B . 6 LEU HD22 1 1 2 1180 2 1 6 LEU HD23 H 1.028 -9.422 0.390 1.00 . B B . 6 LEU HD23 1 1 2 1181 2 1 6 LEU HG H -0.070 -11.251 1.556 1.00 . B B . 6 LEU HG 1 1 2 1182 2 1 6 LEU N N -1.376 -7.933 2.979 1.00 . B B . 6 LEU N 1 1 2 1183 2 1 6 LEU O O -4.609 -9.264 2.080 1.00 . B B . 6 LEU O 1 1 2 1184 2 1 7 HIS C C -5.663 -6.123 4.327 1.00 . B B . 7 HIS C 1 1 2 1185 2 1 7 HIS CA C -5.380 -7.595 4.027 1.00 . B B . 7 HIS CA 1 1 2 1186 2 1 7 HIS CB C -5.584 -8.415 5.302 1.00 . B B . 7 HIS CB 1 1 2 1187 2 1 7 HIS CD2 C -3.998 -10.385 5.996 1.00 . B B . 7 HIS CD2 1 1 2 1188 2 1 7 HIS CE1 C -4.317 -11.674 4.285 1.00 . B B . 7 HIS CE1 1 1 2 1189 2 1 7 HIS CG C -4.884 -9.740 5.173 1.00 . B B . 7 HIS CG 1 1 2 1190 2 1 7 HIS H H -3.256 -7.222 3.936 1.00 . B B . 7 HIS H 1 1 2 1191 2 1 7 HIS HA H -6.062 -7.940 3.265 1.00 . B B . 7 HIS HA 1 1 2 1192 2 1 7 HIS HB2 H -5.178 -7.875 6.145 1.00 . B B . 7 HIS HB2 1 1 2 1193 2 1 7 HIS HB3 H -6.640 -8.581 5.456 1.00 . B B . 7 HIS HB3 1 1 2 1194 2 1 7 HIS HD1 H -5.651 -10.405 3.315 1.00 . B B . 7 HIS HD1 1 1 2 1195 2 1 7 HIS HD2 H -3.634 -10.002 6.938 1.00 . B B . 7 HIS HD2 1 1 2 1196 2 1 7 HIS HE1 H -4.265 -12.507 3.599 1.00 . B B . 7 HIS HE1 1 1 2 1197 2 1 7 HIS N N -3.979 -7.754 3.541 1.00 . B B . 7 HIS N 1 1 2 1198 2 1 7 HIS ND1 N -5.073 -10.579 4.087 1.00 . B B . 7 HIS ND1 1 1 2 1199 2 1 7 HIS NE2 N -3.641 -11.608 5.435 1.00 . B B . 7 HIS NE2 1 1 2 1200 2 1 7 HIS O O -6.652 -5.789 4.949 1.00 . B B . 7 HIS O 1 1 2 1201 2 1 8 SER C C -4.153 -2.938 3.268 1.00 . B B . 8 SER C 1 1 2 1202 2 1 8 SER CA C -5.049 -3.791 4.166 1.00 . B B . 8 SER CA 1 1 2 1203 2 1 8 SER CB C -4.739 -3.486 5.633 1.00 . B B . 8 SER CB 1 1 2 1204 2 1 8 SER H H -4.015 -5.519 3.395 1.00 . B B . 8 SER H 1 1 2 1205 2 1 8 SER HA H -6.083 -3.556 3.961 1.00 . B B . 8 SER HA 1 1 2 1206 2 1 8 SER HB2 H -3.913 -2.799 5.694 1.00 . B B . 8 SER HB2 1 1 2 1207 2 1 8 SER HB3 H -5.609 -3.041 6.099 1.00 . B B . 8 SER HB3 1 1 2 1208 2 1 8 SER HG H -4.623 -4.595 7.228 1.00 . B B . 8 SER HG 1 1 2 1209 2 1 8 SER N N -4.809 -5.236 3.895 1.00 . B B . 8 SER N 1 1 2 1210 2 1 8 SER O O -4.541 -1.879 2.816 1.00 . B B . 8 SER O 1 1 2 1211 2 1 8 SER OG O -4.394 -4.693 6.301 1.00 . B B . 8 SER OG 1 1 2 1212 2 1 9 ALA C C -2.673 -2.450 0.749 1.00 . B B . 9 ALA C 1 1 2 1213 2 1 9 ALA CA C -2.051 -2.587 2.132 1.00 . B B . 9 ALA CA 1 1 2 1214 2 1 9 ALA CB C -0.704 -3.287 2.005 1.00 . B B . 9 ALA CB 1 1 2 1215 2 1 9 ALA H H -2.658 -4.241 3.375 1.00 . B B . 9 ALA H 1 1 2 1216 2 1 9 ALA HA H -1.909 -1.606 2.563 1.00 . B B . 9 ALA HA 1 1 2 1217 2 1 9 ALA HB1 H -0.856 -4.318 1.700 1.00 . B B . 9 ALA HB1 1 1 2 1218 2 1 9 ALA HB2 H -0.195 -3.262 2.957 1.00 . B B . 9 ALA HB2 1 1 2 1219 2 1 9 ALA HB3 H -0.109 -2.777 1.267 1.00 . B B . 9 ALA HB3 1 1 2 1220 2 1 9 ALA N N -2.958 -3.385 3.003 1.00 . B B . 9 ALA N 1 1 2 1221 2 1 9 ALA O O -2.983 -1.360 0.312 1.00 . B B . 9 ALA O 1 1 2 1222 2 1 10 LYS C C -4.483 -2.375 -1.390 1.00 . B B . 10 LYS C 1 1 2 1223 2 1 10 LYS CA C -3.452 -3.504 -1.310 1.00 . B B . 10 LYS CA 1 1 2 1224 2 1 10 LYS CB C -4.147 -4.834 -1.605 1.00 . B B . 10 LYS CB 1 1 2 1225 2 1 10 LYS CD C -4.630 -6.494 -3.404 1.00 . B B . 10 LYS CD 1 1 2 1226 2 1 10 LYS CE C -6.026 -5.943 -3.702 1.00 . B B . 10 LYS CE 1 1 2 1227 2 1 10 LYS CG C -3.711 -5.348 -2.978 1.00 . B B . 10 LYS CG 1 1 2 1228 2 1 10 LYS H H -2.574 -4.416 0.443 1.00 . B B . 10 LYS H 1 1 2 1229 2 1 10 LYS HA H -2.676 -3.333 -2.039 1.00 . B B . 10 LYS HA 1 1 2 1230 2 1 10 LYS HB2 H -3.879 -5.555 -0.847 1.00 . B B . 10 LYS HB2 1 1 2 1231 2 1 10 LYS HB3 H -5.216 -4.685 -1.602 1.00 . B B . 10 LYS HB3 1 1 2 1232 2 1 10 LYS HD2 H -4.230 -6.966 -4.290 1.00 . B B . 10 LYS HD2 1 1 2 1233 2 1 10 LYS HD3 H -4.695 -7.220 -2.607 1.00 . B B . 10 LYS HD3 1 1 2 1234 2 1 10 LYS HE2 H -6.505 -5.658 -2.778 1.00 . B B . 10 LYS HE2 1 1 2 1235 2 1 10 LYS HE3 H -5.941 -5.080 -4.346 1.00 . B B . 10 LYS HE3 1 1 2 1236 2 1 10 LYS HG2 H -3.774 -4.547 -3.700 1.00 . B B . 10 LYS HG2 1 1 2 1237 2 1 10 LYS HG3 H -2.694 -5.705 -2.922 1.00 . B B . 10 LYS HG3 1 1 2 1238 2 1 10 LYS HZ1 H -6.646 -7.916 -3.948 1.00 . B B . 10 LYS HZ1 1 1 2 1239 2 1 10 LYS HZ2 H -6.592 -7.022 -5.392 1.00 . B B . 10 LYS HZ2 1 1 2 1240 2 1 10 LYS HZ3 H -7.849 -6.767 -4.278 1.00 . B B . 10 LYS HZ3 1 1 2 1241 2 1 10 LYS N N -2.848 -3.551 0.058 1.00 . B B . 10 LYS N 1 1 2 1242 2 1 10 LYS NZ N -6.839 -6.992 -4.382 1.00 . B B . 10 LYS NZ 1 1 2 1243 2 1 10 LYS O O -4.512 -1.614 -2.337 1.00 . B B . 10 LYS O 1 1 2 1244 2 1 11 LYS C C -5.618 0.164 -0.675 1.00 . B B . 11 LYS C 1 1 2 1245 2 1 11 LYS CA C -6.333 -1.162 -0.417 1.00 . B B . 11 LYS CA 1 1 2 1246 2 1 11 LYS CB C -7.052 -1.104 0.935 1.00 . B B . 11 LYS CB 1 1 2 1247 2 1 11 LYS CD C -8.609 -2.312 2.473 1.00 . B B . 11 LYS CD 1 1 2 1248 2 1 11 LYS CE C -10.109 -2.290 2.169 1.00 . B B . 11 LYS CE 1 1 2 1249 2 1 11 LYS CG C -7.822 -2.406 1.165 1.00 . B B . 11 LYS CG 1 1 2 1250 2 1 11 LYS H H -5.276 -2.870 0.363 1.00 . B B . 11 LYS H 1 1 2 1251 2 1 11 LYS HA H -7.049 -1.346 -1.205 1.00 . B B . 11 LYS HA 1 1 2 1252 2 1 11 LYS HB2 H -6.324 -0.972 1.723 1.00 . B B . 11 LYS HB2 1 1 2 1253 2 1 11 LYS HB3 H -7.743 -0.274 0.941 1.00 . B B . 11 LYS HB3 1 1 2 1254 2 1 11 LYS HD2 H -8.379 -3.165 3.094 1.00 . B B . 11 LYS HD2 1 1 2 1255 2 1 11 LYS HD3 H -8.336 -1.405 2.992 1.00 . B B . 11 LYS HD3 1 1 2 1256 2 1 11 LYS HE2 H -10.655 -2.060 3.072 1.00 . B B . 11 LYS HE2 1 1 2 1257 2 1 11 LYS HE3 H -10.314 -1.537 1.423 1.00 . B B . 11 LYS HE3 1 1 2 1258 2 1 11 LYS HG2 H -8.504 -2.570 0.343 1.00 . B B . 11 LYS HG2 1 1 2 1259 2 1 11 LYS HG3 H -7.126 -3.230 1.225 1.00 . B B . 11 LYS HG3 1 1 2 1260 2 1 11 LYS HZ1 H -11.521 -3.574 1.336 1.00 . B B . 11 LYS HZ1 1 1 2 1261 2 1 11 LYS HZ2 H -10.453 -4.329 2.420 1.00 . B B . 11 LYS HZ2 1 1 2 1262 2 1 11 LYS HZ3 H -9.927 -3.902 0.861 1.00 . B B . 11 LYS HZ3 1 1 2 1263 2 1 11 LYS N N -5.321 -2.252 -0.397 1.00 . B B . 11 LYS N 1 1 2 1264 2 1 11 LYS NZ N -10.533 -3.624 1.658 1.00 . B B . 11 LYS NZ 1 1 2 1265 2 1 11 LYS O O -5.783 0.778 -1.710 1.00 . B B . 11 LYS O 1 1 2 1266 2 1 12 PHE C C -3.029 1.648 -1.064 1.00 . B B . 12 PHE C 1 1 2 1267 2 1 12 PHE CA C -4.064 1.877 0.036 1.00 . B B . 12 PHE CA 1 1 2 1268 2 1 12 PHE CB C -3.362 2.305 1.334 1.00 . B B . 12 PHE CB 1 1 2 1269 2 1 12 PHE CD1 C -5.365 2.441 2.860 1.00 . B B . 12 PHE CD1 1 1 2 1270 2 1 12 PHE CD2 C -3.683 0.748 3.293 1.00 . B B . 12 PHE CD2 1 1 2 1271 2 1 12 PHE CE1 C -6.101 1.991 3.962 1.00 . B B . 12 PHE CE1 1 1 2 1272 2 1 12 PHE CE2 C -4.420 0.299 4.396 1.00 . B B . 12 PHE CE2 1 1 2 1273 2 1 12 PHE CG C -4.155 1.820 2.525 1.00 . B B . 12 PHE CG 1 1 2 1274 2 1 12 PHE CZ C -5.629 0.919 4.729 1.00 . B B . 12 PHE CZ 1 1 2 1275 2 1 12 PHE H H -4.671 0.085 1.069 1.00 . B B . 12 PHE H 1 1 2 1276 2 1 12 PHE HA H -4.755 2.647 -0.274 1.00 . B B . 12 PHE HA 1 1 2 1277 2 1 12 PHE HB2 H -2.369 1.878 1.363 1.00 . B B . 12 PHE HB2 1 1 2 1278 2 1 12 PHE HB3 H -3.293 3.388 1.366 1.00 . B B . 12 PHE HB3 1 1 2 1279 2 1 12 PHE HD1 H -5.729 3.266 2.269 1.00 . B B . 12 PHE HD1 1 1 2 1280 2 1 12 PHE HD2 H -2.750 0.269 3.035 1.00 . B B . 12 PHE HD2 1 1 2 1281 2 1 12 PHE HE1 H -7.035 2.470 4.220 1.00 . B B . 12 PHE HE1 1 1 2 1282 2 1 12 PHE HE2 H -4.056 -0.527 4.988 1.00 . B B . 12 PHE HE2 1 1 2 1283 2 1 12 PHE HZ H -6.198 0.573 5.580 1.00 . B B . 12 PHE HZ 1 1 2 1284 2 1 12 PHE N N -4.804 0.602 0.249 1.00 . B B . 12 PHE N 1 1 2 1285 2 1 12 PHE O O -2.527 2.575 -1.665 1.00 . B B . 12 PHE O 1 1 2 1286 2 1 13 GLY C C -2.206 0.742 -3.719 1.00 . B B . 13 GLY C 1 1 2 1287 2 1 13 GLY CA C -1.725 0.114 -2.415 1.00 . B B . 13 GLY CA 1 1 2 1288 2 1 13 GLY H H -3.142 -0.324 -0.853 1.00 . B B . 13 GLY H 1 1 2 1289 2 1 13 GLY HA2 H -0.763 0.523 -2.147 1.00 . B B . 13 GLY HA2 1 1 2 1290 2 1 13 GLY HA3 H -1.641 -0.953 -2.544 1.00 . B B . 13 GLY HA3 1 1 2 1291 2 1 13 GLY N N -2.716 0.410 -1.343 1.00 . B B . 13 GLY N 1 1 2 1292 2 1 13 GLY O O -1.433 1.282 -4.486 1.00 . B B . 13 GLY O 1 1 2 1293 2 1 14 LYS C C -4.376 2.739 -5.007 1.00 . B B . 14 LYS C 1 1 2 1294 2 1 14 LYS CA C -4.025 1.265 -5.231 1.00 . B B . 14 LYS CA 1 1 2 1295 2 1 14 LYS CB C -5.281 0.500 -5.643 1.00 . B B . 14 LYS CB 1 1 2 1296 2 1 14 LYS CD C -4.233 -0.463 -7.686 1.00 . B B . 14 LYS CD 1 1 2 1297 2 1 14 LYS CE C -5.044 -1.116 -8.799 1.00 . B B . 14 LYS CE 1 1 2 1298 2 1 14 LYS CG C -4.870 -0.796 -6.339 1.00 . B B . 14 LYS CG 1 1 2 1299 2 1 14 LYS H H -4.087 0.231 -3.342 1.00 . B B . 14 LYS H 1 1 2 1300 2 1 14 LYS HA H -3.284 1.188 -6.013 1.00 . B B . 14 LYS HA 1 1 2 1301 2 1 14 LYS HB2 H -5.868 0.269 -4.765 1.00 . B B . 14 LYS HB2 1 1 2 1302 2 1 14 LYS HB3 H -5.866 1.102 -6.322 1.00 . B B . 14 LYS HB3 1 1 2 1303 2 1 14 LYS HD2 H -4.221 0.609 -7.826 1.00 . B B . 14 LYS HD2 1 1 2 1304 2 1 14 LYS HD3 H -3.221 -0.840 -7.710 1.00 . B B . 14 LYS HD3 1 1 2 1305 2 1 14 LYS HE2 H -4.397 -1.326 -9.638 1.00 . B B . 14 LYS HE2 1 1 2 1306 2 1 14 LYS HE3 H -5.473 -2.037 -8.434 1.00 . B B . 14 LYS HE3 1 1 2 1307 2 1 14 LYS HG2 H -4.159 -1.327 -5.722 1.00 . B B . 14 LYS HG2 1 1 2 1308 2 1 14 LYS HG3 H -5.742 -1.413 -6.498 1.00 . B B . 14 LYS HG3 1 1 2 1309 2 1 14 LYS HZ1 H -6.503 -0.498 -10.152 1.00 . B B . 14 LYS HZ1 1 1 2 1310 2 1 14 LYS HZ2 H -5.760 0.774 -9.305 1.00 . B B . 14 LYS HZ2 1 1 2 1311 2 1 14 LYS HZ3 H -6.902 -0.215 -8.527 1.00 . B B . 14 LYS HZ3 1 1 2 1312 2 1 14 LYS N N -3.483 0.675 -3.976 1.00 . B B . 14 LYS N 1 1 2 1313 2 1 14 LYS NZ N -6.135 -0.194 -9.228 1.00 . B B . 14 LYS NZ 1 1 2 1314 2 1 14 LYS O O -4.181 3.569 -5.872 1.00 . B B . 14 LYS O 1 1 2 1315 2 1 15 ALA C C -3.994 5.295 -3.281 1.00 . B B . 15 ALA C 1 1 2 1316 2 1 15 ALA CA C -5.258 4.491 -3.586 1.00 . B B . 15 ALA CA 1 1 2 1317 2 1 15 ALA CB C -6.202 4.552 -2.384 1.00 . B B . 15 ALA CB 1 1 2 1318 2 1 15 ALA H H -5.045 2.387 -3.171 1.00 . B B . 15 ALA H 1 1 2 1319 2 1 15 ALA HA H -5.750 4.907 -4.452 1.00 . B B . 15 ALA HA 1 1 2 1320 2 1 15 ALA HB1 H -7.218 4.672 -2.729 1.00 . B B . 15 ALA HB1 1 1 2 1321 2 1 15 ALA HB2 H -5.933 5.390 -1.757 1.00 . B B . 15 ALA HB2 1 1 2 1322 2 1 15 ALA HB3 H -6.120 3.637 -1.815 1.00 . B B . 15 ALA HB3 1 1 2 1323 2 1 15 ALA N N -4.893 3.071 -3.856 1.00 . B B . 15 ALA N 1 1 2 1324 2 1 15 ALA O O -3.786 6.369 -3.808 1.00 . B B . 15 ALA O 1 1 2 1325 2 1 16 TRP C C -1.045 5.660 -3.349 1.00 . B B . 16 TRP C 1 1 2 1326 2 1 16 TRP CA C -1.903 5.516 -2.091 1.00 . B B . 16 TRP CA 1 1 2 1327 2 1 16 TRP CB C -1.154 4.758 -0.979 1.00 . B B . 16 TRP CB 1 1 2 1328 2 1 16 TRP CD1 C 0.057 2.579 -1.444 1.00 . B B . 16 TRP CD1 1 1 2 1329 2 1 16 TRP CD2 C 1.153 4.371 -2.228 1.00 . B B . 16 TRP CD2 1 1 2 1330 2 1 16 TRP CE2 C 1.934 3.245 -2.571 1.00 . B B . 16 TRP CE2 1 1 2 1331 2 1 16 TRP CE3 C 1.611 5.638 -2.598 1.00 . B B . 16 TRP CE3 1 1 2 1332 2 1 16 TRP CG C -0.037 3.924 -1.533 1.00 . B B . 16 TRP CG 1 1 2 1333 2 1 16 TRP CH2 C 3.585 4.653 -3.622 1.00 . B B . 16 TRP CH2 1 1 2 1334 2 1 16 TRP CZ2 C 3.139 3.378 -3.260 1.00 . B B . 16 TRP CZ2 1 1 2 1335 2 1 16 TRP CZ3 C 2.819 5.778 -3.288 1.00 . B B . 16 TRP CZ3 1 1 2 1336 2 1 16 TRP H H -3.331 3.918 -2.016 1.00 . B B . 16 TRP H 1 1 2 1337 2 1 16 TRP HA H -2.157 6.503 -1.730 1.00 . B B . 16 TRP HA 1 1 2 1338 2 1 16 TRP HB2 H -0.745 5.478 -0.290 1.00 . B B . 16 TRP HB2 1 1 2 1339 2 1 16 TRP HB3 H -1.851 4.121 -0.452 1.00 . B B . 16 TRP HB3 1 1 2 1340 2 1 16 TRP HD1 H -0.662 1.932 -0.972 1.00 . B B . 16 TRP HD1 1 1 2 1341 2 1 16 TRP HE1 H 1.524 1.243 -2.162 1.00 . B B . 16 TRP HE1 1 1 2 1342 2 1 16 TRP HE3 H 1.022 6.512 -2.345 1.00 . B B . 16 TRP HE3 1 1 2 1343 2 1 16 TRP HH2 H 4.514 4.773 -4.159 1.00 . B B . 16 TRP HH2 1 1 2 1344 2 1 16 TRP HZ2 H 3.722 2.504 -3.513 1.00 . B B . 16 TRP HZ2 1 1 2 1345 2 1 16 TRP HZ3 H 3.162 6.757 -3.560 1.00 . B B . 16 TRP HZ3 1 1 2 1346 2 1 16 TRP N N -3.148 4.784 -2.431 1.00 . B B . 16 TRP N 1 1 2 1347 2 1 16 TRP NE1 N 1.223 2.172 -2.073 1.00 . B B . 16 TRP NE1 1 1 2 1348 2 1 16 TRP O O -0.593 6.735 -3.682 1.00 . B B . 16 TRP O 1 1 2 1349 2 1 17 VAL C C -0.768 5.501 -6.314 1.00 . B B . 17 VAL C 1 1 2 1350 2 1 17 VAL CA C 0.026 4.709 -5.278 1.00 . B B . 17 VAL CA 1 1 2 1351 2 1 17 VAL CB C 0.403 3.307 -5.797 1.00 . B B . 17 VAL CB 1 1 2 1352 2 1 17 VAL CG1 C -0.543 2.858 -6.918 1.00 . B B . 17 VAL CG1 1 1 2 1353 2 1 17 VAL CG2 C 1.838 3.344 -6.326 1.00 . B B . 17 VAL CG2 1 1 2 1354 2 1 17 VAL H H -1.169 3.722 -3.779 1.00 . B B . 17 VAL H 1 1 2 1355 2 1 17 VAL HA H 0.923 5.264 -5.033 1.00 . B B . 17 VAL HA 1 1 2 1356 2 1 17 VAL HB H 0.341 2.597 -4.986 1.00 . B B . 17 VAL HB 1 1 2 1357 2 1 17 VAL HG11 H -0.219 1.901 -7.299 1.00 . B B . 17 VAL HG11 1 1 2 1358 2 1 17 VAL HG12 H -0.530 3.586 -7.716 1.00 . B B . 17 VAL HG12 1 1 2 1359 2 1 17 VAL HG13 H -1.546 2.769 -6.529 1.00 . B B . 17 VAL HG13 1 1 2 1360 2 1 17 VAL HG21 H 2.345 4.208 -5.922 1.00 . B B . 17 VAL HG21 1 1 2 1361 2 1 17 VAL HG22 H 1.823 3.406 -7.403 1.00 . B B . 17 VAL HG22 1 1 2 1362 2 1 17 VAL HG23 H 2.357 2.448 -6.024 1.00 . B B . 17 VAL HG23 1 1 2 1363 2 1 17 VAL N N -0.806 4.590 -4.053 1.00 . B B . 17 VAL N 1 1 2 1364 2 1 17 VAL O O -0.260 6.408 -6.942 1.00 . B B . 17 VAL O 1 1 2 1365 2 1 18 GLY C C -2.812 7.451 -6.989 1.00 . B B . 18 GLY C 1 1 2 1366 2 1 18 GLY CA C -2.856 5.983 -7.418 1.00 . B B . 18 GLY CA 1 1 2 1367 2 1 18 GLY H H -2.436 4.494 -5.920 1.00 . B B . 18 GLY H 1 1 2 1368 2 1 18 GLY HA2 H -2.453 5.878 -8.418 1.00 . B B . 18 GLY HA2 1 1 2 1369 2 1 18 GLY HA3 H -3.875 5.631 -7.396 1.00 . B B . 18 GLY HA3 1 1 2 1370 2 1 18 GLY N N -2.030 5.202 -6.461 1.00 . B B . 18 GLY N 1 1 2 1371 2 1 18 GLY O O -3.191 8.341 -7.726 1.00 . B B . 18 GLY O 1 1 2 1372 2 1 19 GLU C C -0.865 9.636 -5.640 1.00 . B B . 19 GLU C 1 1 2 1373 2 1 19 GLU CA C -2.246 9.093 -5.294 1.00 . B B . 19 GLU CA 1 1 2 1374 2 1 19 GLU CB C -2.434 9.075 -3.769 1.00 . B B . 19 GLU CB 1 1 2 1375 2 1 19 GLU CD C -2.310 11.577 -3.713 1.00 . B B . 19 GLU CD 1 1 2 1376 2 1 19 GLU CG C -1.741 10.281 -3.130 1.00 . B B . 19 GLU CG 1 1 2 1377 2 1 19 GLU H H -2.040 6.978 -5.221 1.00 . B B . 19 GLU H 1 1 2 1378 2 1 19 GLU HA H -3.004 9.701 -5.755 1.00 . B B . 19 GLU HA 1 1 2 1379 2 1 19 GLU HB2 H -3.486 9.100 -3.535 1.00 . B B . 19 GLU HB2 1 1 2 1380 2 1 19 GLU HB3 H -1.995 8.170 -3.370 1.00 . B B . 19 GLU HB3 1 1 2 1381 2 1 19 GLU HG2 H -1.904 10.261 -2.063 1.00 . B B . 19 GLU HG2 1 1 2 1382 2 1 19 GLU HG3 H -0.681 10.227 -3.333 1.00 . B B . 19 GLU HG3 1 1 2 1383 2 1 19 GLU N N -2.340 7.705 -5.795 1.00 . B B . 19 GLU N 1 1 2 1384 2 1 19 GLU O O -0.719 10.523 -6.458 1.00 . B B . 19 GLU O 1 1 2 1385 2 1 19 GLU OE1 O -2.602 11.596 -4.897 1.00 . B B . 19 GLU OE1 1 1 2 1386 2 1 19 GLU OE2 O -2.444 12.531 -2.964 1.00 . B B . 19 GLU OE2 1 1 2 1387 2 1 20 ILE C C 1.968 9.121 -6.673 1.00 . B B . 20 ILE C 1 1 2 1388 2 1 20 ILE CA C 1.514 9.616 -5.302 1.00 . B B . 20 ILE CA 1 1 2 1389 2 1 20 ILE CB C 2.477 9.103 -4.245 1.00 . B B . 20 ILE CB 1 1 2 1390 2 1 20 ILE CD1 C 2.699 8.826 -1.775 1.00 . B B . 20 ILE CD1 1 1 2 1391 2 1 20 ILE CG1 C 2.108 9.694 -2.887 1.00 . B B . 20 ILE CG1 1 1 2 1392 2 1 20 ILE CG2 C 3.906 9.509 -4.610 1.00 . B B . 20 ILE CG2 1 1 2 1393 2 1 20 ILE H H 0.014 8.403 -4.344 1.00 . B B . 20 ILE H 1 1 2 1394 2 1 20 ILE HA H 1.504 10.686 -5.286 1.00 . B B . 20 ILE HA 1 1 2 1395 2 1 20 ILE HB H 2.405 8.034 -4.205 1.00 . B B . 20 ILE HB 1 1 2 1396 2 1 20 ILE HD11 H 3.559 8.295 -2.153 1.00 . B B . 20 ILE HD11 1 1 2 1397 2 1 20 ILE HD12 H 1.957 8.116 -1.439 1.00 . B B . 20 ILE HD12 1 1 2 1398 2 1 20 ILE HD13 H 2.998 9.453 -0.949 1.00 . B B . 20 ILE HD13 1 1 2 1399 2 1 20 ILE HG12 H 2.503 10.698 -2.813 1.00 . B B . 20 ILE HG12 1 1 2 1400 2 1 20 ILE HG13 H 1.032 9.719 -2.789 1.00 . B B . 20 ILE HG13 1 1 2 1401 2 1 20 ILE HG21 H 4.593 9.089 -3.892 1.00 . B B . 20 ILE HG21 1 1 2 1402 2 1 20 ILE HG22 H 3.987 10.586 -4.599 1.00 . B B . 20 ILE HG22 1 1 2 1403 2 1 20 ILE HG23 H 4.144 9.140 -5.596 1.00 . B B . 20 ILE HG23 1 1 2 1404 2 1 20 ILE N N 0.151 9.116 -5.012 1.00 . B B . 20 ILE N 1 1 2 1405 2 1 20 ILE O O 2.477 9.873 -7.480 1.00 . B B . 20 ILE O 1 1 2 1406 2 1 21 MET C C 1.587 8.143 -9.379 1.00 . B B . 21 MET C 1 1 2 1407 2 1 21 MET CA C 2.221 7.316 -8.258 1.00 . B B . 21 MET CA 1 1 2 1408 2 1 21 MET CB C 1.781 5.856 -8.382 1.00 . B B . 21 MET CB 1 1 2 1409 2 1 21 MET CE C 1.886 4.538 -11.456 1.00 . B B . 21 MET CE 1 1 2 1410 2 1 21 MET CG C 2.916 5.031 -8.993 1.00 . B B . 21 MET CG 1 1 2 1411 2 1 21 MET H H 1.382 7.266 -6.276 1.00 . B B . 21 MET H 1 1 2 1412 2 1 21 MET HA H 3.298 7.372 -8.331 1.00 . B B . 21 MET HA 1 1 2 1413 2 1 21 MET HB2 H 1.544 5.470 -7.400 1.00 . B B . 21 MET HB2 1 1 2 1414 2 1 21 MET HB3 H 0.910 5.795 -9.017 1.00 . B B . 21 MET HB3 1 1 2 1415 2 1 21 MET HE1 H 2.220 4.182 -12.422 1.00 . B B . 21 MET HE1 1 1 2 1416 2 1 21 MET HE2 H 0.995 5.130 -11.582 1.00 . B B . 21 MET HE2 1 1 2 1417 2 1 21 MET HE3 H 1.670 3.696 -10.812 1.00 . B B . 21 MET HE3 1 1 2 1418 2 1 21 MET HG2 H 3.820 5.187 -8.422 1.00 . B B . 21 MET HG2 1 1 2 1419 2 1 21 MET HG3 H 2.651 3.983 -8.971 1.00 . B B . 21 MET HG3 1 1 2 1420 2 1 21 MET N N 1.792 7.858 -6.942 1.00 . B B . 21 MET N 1 1 2 1421 2 1 21 MET O O 2.097 8.207 -10.480 1.00 . B B . 21 MET O 1 1 2 1422 2 1 21 MET SD S 3.186 5.549 -10.706 1.00 . B B . 21 MET SD 1 1 2 1423 2 1 22 ASN C C 0.643 10.869 -10.413 1.00 . B B . 22 ASN C 1 1 2 1424 2 1 22 ASN CA C -0.179 9.603 -10.167 1.00 . B B . 22 ASN CA 1 1 2 1425 2 1 22 ASN CB C -1.587 9.996 -9.711 1.00 . B B . 22 ASN CB 1 1 2 1426 2 1 22 ASN CG C -2.606 9.557 -10.766 1.00 . B B . 22 ASN CG 1 1 2 1427 2 1 22 ASN H H 0.078 8.723 -8.213 1.00 . B B . 22 ASN H 1 1 2 1428 2 1 22 ASN HA H -0.243 9.031 -11.080 1.00 . B B . 22 ASN HA 1 1 2 1429 2 1 22 ASN HB2 H -1.808 9.510 -8.771 1.00 . B B . 22 ASN HB2 1 1 2 1430 2 1 22 ASN HB3 H -1.639 11.069 -9.587 1.00 . B B . 22 ASN HB3 1 1 2 1431 2 1 22 ASN HD21 H -4.165 10.262 -9.752 1.00 . B B . 22 ASN HD21 1 1 2 1432 2 1 22 ASN HD22 H -4.537 9.519 -11.242 1.00 . B B . 22 ASN HD22 1 1 2 1433 2 1 22 ASN N N 0.478 8.782 -9.110 1.00 . B B . 22 ASN N 1 1 2 1434 2 1 22 ASN ND2 N -3.874 9.800 -10.571 1.00 . B B . 22 ASN ND2 1 1 2 1435 2 1 22 ASN O O 1.120 11.110 -11.505 1.00 . B B . 22 ASN O 1 1 2 1436 2 1 22 ASN OD1 O -2.244 8.988 -11.777 1.00 . B B . 22 ASN OD1 1 1 2 1437 2 1 23 SER C C 3.079 12.646 -9.328 1.00 . B B . 23 SER C 1 1 2 1438 2 1 23 SER CA C 1.597 12.933 -9.579 1.00 . B B . 23 SER CA 1 1 2 1439 2 1 23 SER CB C 1.104 13.982 -8.583 1.00 . B B . 23 SER CB 1 1 2 1440 2 1 23 SER H H 0.414 11.467 -8.536 1.00 . B B . 23 SER H 1 1 2 1441 2 1 23 SER HA H 1.468 13.304 -10.585 1.00 . B B . 23 SER HA 1 1 2 1442 2 1 23 SER HB2 H 1.367 13.683 -7.582 1.00 . B B . 23 SER HB2 1 1 2 1443 2 1 23 SER HB3 H 1.567 14.934 -8.804 1.00 . B B . 23 SER HB3 1 1 2 1444 2 1 23 SER HG H -0.695 13.286 -8.328 1.00 . B B . 23 SER HG 1 1 2 1445 2 1 23 SER N N 0.810 11.680 -9.407 1.00 . B B . 23 SER N 1 1 2 1446 2 1 23 SER O O 3.614 13.188 -8.376 1.00 . B B . 23 SER O 1 1 2 1447 2 1 23 SER OXT O 3.653 11.888 -10.093 1.00 . B B . 23 SER OXT 1 1 2 1448 2 1 23 SER OG O -0.310 14.093 -8.679 1.00 . B B . 23 SER OG 1 1 3 1449 1 1 1 GLY C C -6.841 12.958 1.207 1.00 . A A . 1 GLY C 1 1 3 1450 1 1 1 GLY CA C -8.052 13.890 1.287 1.00 . A A . 1 GLY CA 1 1 3 1451 1 1 1 GLY H1 H -7.639 15.124 2.914 1.00 . A A . 1 GLY H1 1 1 3 1452 1 1 1 GLY H2 H -8.034 13.528 3.339 1.00 . A A . 1 GLY H2 1 1 3 1453 1 1 1 GLY H3 H -9.250 14.602 2.836 1.00 . A A . 1 GLY H3 1 1 3 1454 1 1 1 GLY HA2 H -8.932 13.370 0.937 1.00 . A A . 1 GLY HA2 1 1 3 1455 1 1 1 GLY HA3 H -7.874 14.758 0.670 1.00 . A A . 1 GLY HA3 1 1 3 1456 1 1 1 GLY N N -8.259 14.318 2.700 1.00 . A A . 1 GLY N 1 1 3 1457 1 1 1 GLY O O -6.922 11.864 0.686 1.00 . A A . 1 GLY O 1 1 3 1458 1 1 2 ILE C C -3.804 12.548 3.038 1.00 . A A . 2 ILE C 1 1 3 1459 1 1 2 ILE CA C -4.505 12.516 1.679 1.00 . A A . 2 ILE CA 1 1 3 1460 1 1 2 ILE CB C -3.532 13.007 0.597 1.00 . A A . 2 ILE CB 1 1 3 1461 1 1 2 ILE CD1 C -3.466 15.397 1.331 1.00 . A A . 2 ILE CD1 1 1 3 1462 1 1 2 ILE CG1 C -3.865 14.448 0.199 1.00 . A A . 2 ILE CG1 1 1 3 1463 1 1 2 ILE CG2 C -3.647 12.105 -0.633 1.00 . A A . 2 ILE CG2 1 1 3 1464 1 1 2 ILE H H -5.675 14.267 2.141 1.00 . A A . 2 ILE H 1 1 3 1465 1 1 2 ILE HA H -4.801 11.501 1.458 1.00 . A A . 2 ILE HA 1 1 3 1466 1 1 2 ILE HB H -2.522 12.962 0.980 1.00 . A A . 2 ILE HB 1 1 3 1467 1 1 2 ILE HD11 H -3.902 16.369 1.157 1.00 . A A . 2 ILE HD11 1 1 3 1468 1 1 2 ILE HD12 H -2.389 15.485 1.365 1.00 . A A . 2 ILE HD12 1 1 3 1469 1 1 2 ILE HD13 H -3.824 15.005 2.272 1.00 . A A . 2 ILE HD13 1 1 3 1470 1 1 2 ILE HG12 H -3.320 14.709 -0.699 1.00 . A A . 2 ILE HG12 1 1 3 1471 1 1 2 ILE HG13 H -4.927 14.535 0.017 1.00 . A A . 2 ILE HG13 1 1 3 1472 1 1 2 ILE HG21 H -2.868 12.356 -1.338 1.00 . A A . 2 ILE HG21 1 1 3 1473 1 1 2 ILE HG22 H -4.612 12.245 -1.096 1.00 . A A . 2 ILE HG22 1 1 3 1474 1 1 2 ILE HG23 H -3.540 11.071 -0.333 1.00 . A A . 2 ILE HG23 1 1 3 1475 1 1 2 ILE N N -5.719 13.383 1.723 1.00 . A A . 2 ILE N 1 1 3 1476 1 1 2 ILE O O -2.862 13.287 3.246 1.00 . A A . 2 ILE O 1 1 3 1477 1 1 3 GLY C C -3.473 10.257 5.749 1.00 . A A . 3 GLY C 1 1 3 1478 1 1 3 GLY CA C -3.612 11.711 5.307 1.00 . A A . 3 GLY CA 1 1 3 1479 1 1 3 GLY H H -5.007 11.151 3.767 1.00 . A A . 3 GLY H 1 1 3 1480 1 1 3 GLY HA2 H -2.631 12.164 5.246 1.00 . A A . 3 GLY HA2 1 1 3 1481 1 1 3 GLY HA3 H -4.220 12.249 6.016 1.00 . A A . 3 GLY HA3 1 1 3 1482 1 1 3 GLY N N -4.252 11.743 3.962 1.00 . A A . 3 GLY N 1 1 3 1483 1 1 3 GLY O O -3.943 9.858 6.796 1.00 . A A . 3 GLY O 1 1 3 1484 1 1 4 LYS C C -1.941 7.388 4.072 1.00 . A A . 4 LYS C 1 1 3 1485 1 1 4 LYS CA C -2.635 8.033 5.263 1.00 . A A . 4 LYS CA 1 1 3 1486 1 1 4 LYS CB C -3.991 7.361 5.486 1.00 . A A . 4 LYS CB 1 1 3 1487 1 1 4 LYS CD C -5.091 5.424 6.622 1.00 . A A . 4 LYS CD 1 1 3 1488 1 1 4 LYS CE C -4.859 4.843 8.017 1.00 . A A . 4 LYS CE 1 1 3 1489 1 1 4 LYS CG C -3.771 5.965 6.068 1.00 . A A . 4 LYS CG 1 1 3 1490 1 1 4 LYS H H -2.468 9.830 4.105 1.00 . A A . 4 LYS H 1 1 3 1491 1 1 4 LYS HA H -2.022 7.933 6.146 1.00 . A A . 4 LYS HA 1 1 3 1492 1 1 4 LYS HB2 H -4.579 7.953 6.171 1.00 . A A . 4 LYS HB2 1 1 3 1493 1 1 4 LYS HB3 H -4.509 7.278 4.542 1.00 . A A . 4 LYS HB3 1 1 3 1494 1 1 4 LYS HD2 H -5.813 6.226 6.680 1.00 . A A . 4 LYS HD2 1 1 3 1495 1 1 4 LYS HD3 H -5.465 4.649 5.969 1.00 . A A . 4 LYS HD3 1 1 3 1496 1 1 4 LYS HE2 H -3.798 4.781 8.209 1.00 . A A . 4 LYS HE2 1 1 3 1497 1 1 4 LYS HE3 H -5.321 5.482 8.755 1.00 . A A . 4 LYS HE3 1 1 3 1498 1 1 4 LYS HG2 H -3.408 5.307 5.293 1.00 . A A . 4 LYS HG2 1 1 3 1499 1 1 4 LYS HG3 H -3.044 6.018 6.865 1.00 . A A . 4 LYS HG3 1 1 3 1500 1 1 4 LYS HZ1 H -5.565 3.093 7.136 1.00 . A A . 4 LYS HZ1 1 1 3 1501 1 1 4 LYS HZ2 H -6.392 3.539 8.553 1.00 . A A . 4 LYS HZ2 1 1 3 1502 1 1 4 LYS HZ3 H -4.837 2.859 8.649 1.00 . A A . 4 LYS HZ3 1 1 3 1503 1 1 4 LYS N N -2.829 9.471 4.941 1.00 . A A . 4 LYS N 1 1 3 1504 1 1 4 LYS NZ N -5.459 3.481 8.095 1.00 . A A . 4 LYS NZ 1 1 3 1505 1 1 4 LYS O O -0.950 6.695 4.208 1.00 . A A . 4 LYS O 1 1 3 1506 1 1 5 TYR C C -0.484 7.768 1.453 1.00 . A A . 5 TYR C 1 1 3 1507 1 1 5 TYR CA C -1.823 7.076 1.682 1.00 . A A . 5 TYR CA 1 1 3 1508 1 1 5 TYR CB C -2.751 7.310 0.498 1.00 . A A . 5 TYR CB 1 1 3 1509 1 1 5 TYR CD1 C -4.725 5.846 1.057 1.00 . A A . 5 TYR CD1 1 1 3 1510 1 1 5 TYR CD2 C -4.981 8.254 1.203 1.00 . A A . 5 TYR CD2 1 1 3 1511 1 1 5 TYR CE1 C -6.057 5.679 1.453 1.00 . A A . 5 TYR CE1 1 1 3 1512 1 1 5 TYR CE2 C -6.314 8.085 1.600 1.00 . A A . 5 TYR CE2 1 1 3 1513 1 1 5 TYR CG C -4.187 7.134 0.932 1.00 . A A . 5 TYR CG 1 1 3 1514 1 1 5 TYR CZ C -6.851 6.799 1.725 1.00 . A A . 5 TYR CZ 1 1 3 1515 1 1 5 TYR H H -3.233 8.212 2.814 1.00 . A A . 5 TYR H 1 1 3 1516 1 1 5 TYR HA H -1.661 6.025 1.803 1.00 . A A . 5 TYR HA 1 1 3 1517 1 1 5 TYR HB2 H -2.609 8.310 0.113 1.00 . A A . 5 TYR HB2 1 1 3 1518 1 1 5 TYR HB3 H -2.526 6.591 -0.263 1.00 . A A . 5 TYR HB3 1 1 3 1519 1 1 5 TYR HD1 H -4.113 4.980 0.847 1.00 . A A . 5 TYR HD1 1 1 3 1520 1 1 5 TYR HD2 H -4.567 9.245 1.107 1.00 . A A . 5 TYR HD2 1 1 3 1521 1 1 5 TYR HE1 H -6.471 4.685 1.548 1.00 . A A . 5 TYR HE1 1 1 3 1522 1 1 5 TYR HE2 H -6.928 8.949 1.810 1.00 . A A . 5 TYR HE2 1 1 3 1523 1 1 5 TYR HH H -8.263 7.010 2.993 1.00 . A A . 5 TYR HH 1 1 3 1524 1 1 5 TYR N N -2.446 7.638 2.898 1.00 . A A . 5 TYR N 1 1 3 1525 1 1 5 TYR O O 0.336 7.314 0.678 1.00 . A A . 5 TYR O 1 1 3 1526 1 1 5 TYR OH O -8.165 6.634 2.115 1.00 . A A . 5 TYR OH 1 1 3 1527 1 1 6 LEU C C 1.847 9.535 3.240 1.00 . A A . 6 LEU C 1 1 3 1528 1 1 6 LEU CA C 1.037 9.578 1.942 1.00 . A A . 6 LEU CA 1 1 3 1529 1 1 6 LEU CB C 0.747 11.033 1.567 1.00 . A A . 6 LEU CB 1 1 3 1530 1 1 6 LEU CD1 C 1.855 11.379 -0.646 1.00 . A A . 6 LEU CD1 1 1 3 1531 1 1 6 LEU CD2 C -0.140 9.880 -0.495 1.00 . A A . 6 LEU CD2 1 1 3 1532 1 1 6 LEU CG C 0.514 11.156 0.055 1.00 . A A . 6 LEU CG 1 1 3 1533 1 1 6 LEU H H -0.926 9.219 2.743 1.00 . A A . 6 LEU H 1 1 3 1534 1 1 6 LEU HA H 1.599 9.107 1.151 1.00 . A A . 6 LEU HA 1 1 3 1535 1 1 6 LEU HB2 H -0.134 11.369 2.093 1.00 . A A . 6 LEU HB2 1 1 3 1536 1 1 6 LEU HB3 H 1.587 11.648 1.848 1.00 . A A . 6 LEU HB3 1 1 3 1537 1 1 6 LEU HD11 H 2.332 12.256 -0.238 1.00 . A A . 6 LEU HD11 1 1 3 1538 1 1 6 LEU HD12 H 1.688 11.519 -1.703 1.00 . A A . 6 LEU HD12 1 1 3 1539 1 1 6 LEU HD13 H 2.489 10.518 -0.490 1.00 . A A . 6 LEU HD13 1 1 3 1540 1 1 6 LEU HD21 H -0.449 10.045 -1.516 1.00 . A A . 6 LEU HD21 1 1 3 1541 1 1 6 LEU HD22 H -1.002 9.630 0.104 1.00 . A A . 6 LEU HD22 1 1 3 1542 1 1 6 LEU HD23 H 0.571 9.066 -0.461 1.00 . A A . 6 LEU HD23 1 1 3 1543 1 1 6 LEU HG H -0.131 11.999 -0.132 1.00 . A A . 6 LEU HG 1 1 3 1544 1 1 6 LEU N N -0.252 8.864 2.123 1.00 . A A . 6 LEU N 1 1 3 1545 1 1 6 LEU O O 2.951 10.036 3.308 1.00 . A A . 6 LEU O 1 1 3 1546 1 1 7 HIS C C 1.981 7.464 6.139 1.00 . A A . 7 HIS C 1 1 3 1547 1 1 7 HIS CA C 2.068 8.875 5.557 1.00 . A A . 7 HIS CA 1 1 3 1548 1 1 7 HIS CB C 1.476 9.870 6.559 1.00 . A A . 7 HIS CB 1 1 3 1549 1 1 7 HIS CD2 C -0.337 11.466 5.527 1.00 . A A . 7 HIS CD2 1 1 3 1550 1 1 7 HIS CE1 C 0.991 12.979 4.727 1.00 . A A . 7 HIS CE1 1 1 3 1551 1 1 7 HIS CG C 0.942 11.071 5.828 1.00 . A A . 7 HIS CG 1 1 3 1552 1 1 7 HIS H H 0.422 8.540 4.205 1.00 . A A . 7 HIS H 1 1 3 1553 1 1 7 HIS HA H 3.102 9.121 5.375 1.00 . A A . 7 HIS HA 1 1 3 1554 1 1 7 HIS HB2 H 0.673 9.395 7.104 1.00 . A A . 7 HIS HB2 1 1 3 1555 1 1 7 HIS HB3 H 2.244 10.182 7.250 1.00 . A A . 7 HIS HB3 1 1 3 1556 1 1 7 HIS HD1 H 2.751 12.066 5.355 1.00 . A A . 7 HIS HD1 1 1 3 1557 1 1 7 HIS HD2 H -1.233 10.924 5.790 1.00 . A A . 7 HIS HD2 1 1 3 1558 1 1 7 HIS HE1 H 1.364 13.865 4.236 1.00 . A A . 7 HIS HE1 1 1 3 1559 1 1 7 HIS N N 1.314 8.941 4.273 1.00 . A A . 7 HIS N 1 1 3 1560 1 1 7 HIS ND1 N 1.773 12.051 5.308 1.00 . A A . 7 HIS ND1 1 1 3 1561 1 1 7 HIS NE2 N -0.305 12.670 4.832 1.00 . A A . 7 HIS NE2 1 1 3 1562 1 1 7 HIS O O 2.363 7.226 7.268 1.00 . A A . 7 HIS O 1 1 3 1563 1 1 8 SER C C 1.308 4.153 4.745 1.00 . A A . 8 SER C 1 1 3 1564 1 1 8 SER CA C 1.382 5.136 5.909 1.00 . A A . 8 SER CA 1 1 3 1565 1 1 8 SER CB C 0.126 5.003 6.770 1.00 . A A . 8 SER CB 1 1 3 1566 1 1 8 SER H H 1.182 6.733 4.476 1.00 . A A . 8 SER H 1 1 3 1567 1 1 8 SER HA H 2.252 4.915 6.503 1.00 . A A . 8 SER HA 1 1 3 1568 1 1 8 SER HB2 H -0.010 5.900 7.352 1.00 . A A . 8 SER HB2 1 1 3 1569 1 1 8 SER HB3 H -0.735 4.858 6.131 1.00 . A A . 8 SER HB3 1 1 3 1570 1 1 8 SER HG H -0.591 3.488 7.760 1.00 . A A . 8 SER HG 1 1 3 1571 1 1 8 SER N N 1.485 6.526 5.384 1.00 . A A . 8 SER N 1 1 3 1572 1 1 8 SER O O 1.866 3.075 4.796 1.00 . A A . 8 SER O 1 1 3 1573 1 1 8 SER OG O 0.272 3.894 7.649 1.00 . A A . 8 SER OG 1 1 3 1574 1 1 9 ALA C C 1.929 3.362 1.964 1.00 . A A . 9 ALA C 1 1 3 1575 1 1 9 ALA CA C 0.535 3.580 2.536 1.00 . A A . 9 ALA CA 1 1 3 1576 1 1 9 ALA CB C -0.361 4.178 1.458 1.00 . A A . 9 ALA CB 1 1 3 1577 1 1 9 ALA H H 0.186 5.383 3.664 1.00 . A A . 9 ALA H 1 1 3 1578 1 1 9 ALA HA H 0.127 2.635 2.864 1.00 . A A . 9 ALA HA 1 1 3 1579 1 1 9 ALA HB1 H -0.013 5.172 1.203 1.00 . A A . 9 ALA HB1 1 1 3 1580 1 1 9 ALA HB2 H -1.375 4.231 1.824 1.00 . A A . 9 ALA HB2 1 1 3 1581 1 1 9 ALA HB3 H -0.330 3.551 0.585 1.00 . A A . 9 ALA HB3 1 1 3 1582 1 1 9 ALA N N 0.628 4.508 3.693 1.00 . A A . 9 ALA N 1 1 3 1583 1 1 9 ALA O O 2.445 2.264 1.988 1.00 . A A . 9 ALA O 1 1 3 1584 1 1 10 LYS C C 4.698 3.192 1.574 1.00 . A A . 10 LYS C 1 1 3 1585 1 1 10 LYS CA C 3.905 4.290 0.859 1.00 . A A . 10 LYS CA 1 1 3 1586 1 1 10 LYS CB C 4.641 5.621 1.017 1.00 . A A . 10 LYS CB 1 1 3 1587 1 1 10 LYS CD C 6.539 6.837 -0.061 1.00 . A A . 10 LYS CD 1 1 3 1588 1 1 10 LYS CE C 7.761 6.048 -0.533 1.00 . A A . 10 LYS CE 1 1 3 1589 1 1 10 LYS CG C 5.271 6.021 -0.319 1.00 . A A . 10 LYS CG 1 1 3 1590 1 1 10 LYS H H 2.068 5.275 1.442 1.00 . A A . 10 LYS H 1 1 3 1591 1 1 10 LYS HA H 3.825 4.047 -0.189 1.00 . A A . 10 LYS HA 1 1 3 1592 1 1 10 LYS HB2 H 3.941 6.383 1.329 1.00 . A A . 10 LYS HB2 1 1 3 1593 1 1 10 LYS HB3 H 5.415 5.516 1.761 1.00 . A A . 10 LYS HB3 1 1 3 1594 1 1 10 LYS HD2 H 6.482 7.771 -0.603 1.00 . A A . 10 LYS HD2 1 1 3 1595 1 1 10 LYS HD3 H 6.629 7.039 0.995 1.00 . A A . 10 LYS HD3 1 1 3 1596 1 1 10 LYS HE2 H 8.602 6.269 0.108 1.00 . A A . 10 LYS HE2 1 1 3 1597 1 1 10 LYS HE3 H 7.545 4.991 -0.491 1.00 . A A . 10 LYS HE3 1 1 3 1598 1 1 10 LYS HG2 H 5.522 5.130 -0.878 1.00 . A A . 10 LYS HG2 1 1 3 1599 1 1 10 LYS HG3 H 4.571 6.615 -0.884 1.00 . A A . 10 LYS HG3 1 1 3 1600 1 1 10 LYS HZ1 H 8.478 7.397 -1.948 1.00 . A A . 10 LYS HZ1 1 1 3 1601 1 1 10 LYS HZ2 H 7.226 6.397 -2.515 1.00 . A A . 10 LYS HZ2 1 1 3 1602 1 1 10 LYS HZ3 H 8.795 5.772 -2.320 1.00 . A A . 10 LYS HZ3 1 1 3 1603 1 1 10 LYS N N 2.530 4.406 1.448 1.00 . A A . 10 LYS N 1 1 3 1604 1 1 10 LYS NZ N 8.090 6.432 -1.935 1.00 . A A . 10 LYS NZ 1 1 3 1605 1 1 10 LYS O O 5.238 2.300 0.950 1.00 . A A . 10 LYS O 1 1 3 1606 1 1 11 LYS C C 5.092 0.817 3.067 1.00 . A A . 11 LYS C 1 1 3 1607 1 1 11 LYS CA C 5.509 2.182 3.616 1.00 . A A . 11 LYS CA 1 1 3 1608 1 1 11 LYS CB C 5.172 2.264 5.107 1.00 . A A . 11 LYS CB 1 1 3 1609 1 1 11 LYS CD C 5.963 3.721 6.979 1.00 . A A . 11 LYS CD 1 1 3 1610 1 1 11 LYS CE C 7.239 4.566 6.954 1.00 . A A . 11 LYS CE 1 1 3 1611 1 1 11 LYS CG C 5.330 3.709 5.586 1.00 . A A . 11 LYS CG 1 1 3 1612 1 1 11 LYS H H 4.313 3.957 3.368 1.00 . A A . 11 LYS H 1 1 3 1613 1 1 11 LYS HA H 6.571 2.321 3.475 1.00 . A A . 11 LYS HA 1 1 3 1614 1 1 11 LYS HB2 H 4.153 1.941 5.265 1.00 . A A . 11 LYS HB2 1 1 3 1615 1 1 11 LYS HB3 H 5.843 1.627 5.664 1.00 . A A . 11 LYS HB3 1 1 3 1616 1 1 11 LYS HD2 H 5.265 4.142 7.688 1.00 . A A . 11 LYS HD2 1 1 3 1617 1 1 11 LYS HD3 H 6.208 2.711 7.271 1.00 . A A . 11 LYS HD3 1 1 3 1618 1 1 11 LYS HE2 H 7.715 4.469 5.991 1.00 . A A . 11 LYS HE2 1 1 3 1619 1 1 11 LYS HE3 H 6.987 5.602 7.129 1.00 . A A . 11 LYS HE3 1 1 3 1620 1 1 11 LYS HG2 H 5.964 4.248 4.897 1.00 . A A . 11 LYS HG2 1 1 3 1621 1 1 11 LYS HG3 H 4.360 4.182 5.630 1.00 . A A . 11 LYS HG3 1 1 3 1622 1 1 11 LYS HZ1 H 7.982 4.615 8.899 1.00 . A A . 11 LYS HZ1 1 1 3 1623 1 1 11 LYS HZ2 H 9.151 4.259 7.718 1.00 . A A . 11 LYS HZ2 1 1 3 1624 1 1 11 LYS HZ3 H 8.020 3.078 8.183 1.00 . A A . 11 LYS HZ3 1 1 3 1625 1 1 11 LYS N N 4.762 3.238 2.877 1.00 . A A . 11 LYS N 1 1 3 1626 1 1 11 LYS NZ N 8.168 4.094 8.019 1.00 . A A . 11 LYS NZ 1 1 3 1627 1 1 11 LYS O O 5.869 0.125 2.439 1.00 . A A . 11 LYS O 1 1 3 1628 1 1 12 PHE C C 3.382 -0.807 1.228 1.00 . A A . 12 PHE C 1 1 3 1629 1 1 12 PHE CA C 3.388 -0.876 2.754 1.00 . A A . 12 PHE CA 1 1 3 1630 1 1 12 PHE CB C 1.969 -1.156 3.259 1.00 . A A . 12 PHE CB 1 1 3 1631 1 1 12 PHE CD1 C 2.453 -1.196 5.729 1.00 . A A . 12 PHE CD1 1 1 3 1632 1 1 12 PHE CD2 C 1.017 0.549 4.854 1.00 . A A . 12 PHE CD2 1 1 3 1633 1 1 12 PHE CE1 C 2.309 -0.670 7.018 1.00 . A A . 12 PHE CE1 1 1 3 1634 1 1 12 PHE CE2 C 0.872 1.076 6.142 1.00 . A A . 12 PHE CE2 1 1 3 1635 1 1 12 PHE CG C 1.808 -0.588 4.648 1.00 . A A . 12 PHE CG 1 1 3 1636 1 1 12 PHE CZ C 1.517 0.466 7.224 1.00 . A A . 12 PHE CZ 1 1 3 1637 1 1 12 PHE H H 3.250 1.013 3.778 1.00 . A A . 12 PHE H 1 1 3 1638 1 1 12 PHE HA H 4.054 -1.663 3.080 1.00 . A A . 12 PHE HA 1 1 3 1639 1 1 12 PHE HB2 H 1.252 -0.693 2.595 1.00 . A A . 12 PHE HB2 1 1 3 1640 1 1 12 PHE HB3 H 1.800 -2.226 3.288 1.00 . A A . 12 PHE HB3 1 1 3 1641 1 1 12 PHE HD1 H 3.062 -2.071 5.569 1.00 . A A . 12 PHE HD1 1 1 3 1642 1 1 12 PHE HD2 H 0.519 1.018 4.018 1.00 . A A . 12 PHE HD2 1 1 3 1643 1 1 12 PHE HE1 H 2.807 -1.140 7.852 1.00 . A A . 12 PHE HE1 1 1 3 1644 1 1 12 PHE HE2 H 0.261 1.952 6.302 1.00 . A A . 12 PHE HE2 1 1 3 1645 1 1 12 PHE HZ H 1.407 0.872 8.219 1.00 . A A . 12 PHE HZ 1 1 3 1646 1 1 12 PHE N N 3.862 0.434 3.283 1.00 . A A . 12 PHE N 1 1 3 1647 1 1 12 PHE O O 3.736 -1.751 0.549 1.00 . A A . 12 PHE O 1 1 3 1648 1 1 13 GLY C C 4.248 -0.122 -1.379 1.00 . A A . 13 GLY C 1 1 3 1649 1 1 13 GLY CA C 2.965 0.462 -0.795 1.00 . A A . 13 GLY CA 1 1 3 1650 1 1 13 GLY H H 2.714 1.062 1.256 1.00 . A A . 13 GLY H 1 1 3 1651 1 1 13 GLY HA2 H 2.111 -0.061 -1.198 1.00 . A A . 13 GLY HA2 1 1 3 1652 1 1 13 GLY HA3 H 2.901 1.508 -1.052 1.00 . A A . 13 GLY HA3 1 1 3 1653 1 1 13 GLY N N 2.989 0.313 0.686 1.00 . A A . 13 GLY N 1 1 3 1654 1 1 13 GLY O O 4.260 -0.654 -2.471 1.00 . A A . 13 GLY O 1 1 3 1655 1 1 14 LYS C C 6.852 -1.973 -0.613 1.00 . A A . 14 LYS C 1 1 3 1656 1 1 14 LYS CA C 6.616 -0.573 -1.179 1.00 . A A . 14 LYS CA 1 1 3 1657 1 1 14 LYS CB C 7.765 0.343 -0.755 1.00 . A A . 14 LYS CB 1 1 3 1658 1 1 14 LYS CD C 9.675 1.469 -1.903 1.00 . A A . 14 LYS CD 1 1 3 1659 1 1 14 LYS CE C 10.135 1.993 -3.265 1.00 . A A . 14 LYS CE 1 1 3 1660 1 1 14 LYS CG C 8.164 1.243 -1.927 1.00 . A A . 14 LYS CG 1 1 3 1661 1 1 14 LYS H H 5.303 0.412 0.218 1.00 . A A . 14 LYS H 1 1 3 1662 1 1 14 LYS HA H 6.573 -0.625 -2.255 1.00 . A A . 14 LYS HA 1 1 3 1663 1 1 14 LYS HB2 H 7.450 0.954 0.078 1.00 . A A . 14 LYS HB2 1 1 3 1664 1 1 14 LYS HB3 H 8.613 -0.257 -0.460 1.00 . A A . 14 LYS HB3 1 1 3 1665 1 1 14 LYS HD2 H 9.920 2.191 -1.138 1.00 . A A . 14 LYS HD2 1 1 3 1666 1 1 14 LYS HD3 H 10.176 0.537 -1.692 1.00 . A A . 14 LYS HD3 1 1 3 1667 1 1 14 LYS HE2 H 9.583 1.494 -4.048 1.00 . A A . 14 LYS HE2 1 1 3 1668 1 1 14 LYS HE3 H 9.958 3.056 -3.319 1.00 . A A . 14 LYS HE3 1 1 3 1669 1 1 14 LYS HG2 H 7.884 0.767 -2.857 1.00 . A A . 14 LYS HG2 1 1 3 1670 1 1 14 LYS HG3 H 7.658 2.193 -1.841 1.00 . A A . 14 LYS HG3 1 1 3 1671 1 1 14 LYS HZ1 H 12.140 2.482 -2.986 1.00 . A A . 14 LYS HZ1 1 1 3 1672 1 1 14 LYS HZ2 H 11.820 1.675 -4.446 1.00 . A A . 14 LYS HZ2 1 1 3 1673 1 1 14 LYS HZ3 H 11.829 0.815 -2.982 1.00 . A A . 14 LYS HZ3 1 1 3 1674 1 1 14 LYS N N 5.332 -0.025 -0.660 1.00 . A A . 14 LYS N 1 1 3 1675 1 1 14 LYS NZ N 11.591 1.720 -3.433 1.00 . A A . 14 LYS NZ 1 1 3 1676 1 1 14 LYS O O 7.680 -2.717 -1.100 1.00 . A A . 14 LYS O 1 1 3 1677 1 1 15 ALA C C 5.196 -4.619 0.579 1.00 . A A . 15 ALA C 1 1 3 1678 1 1 15 ALA CA C 6.335 -3.691 1.007 1.00 . A A . 15 ALA CA 1 1 3 1679 1 1 15 ALA CB C 6.355 -3.580 2.532 1.00 . A A . 15 ALA CB 1 1 3 1680 1 1 15 ALA H H 5.478 -1.727 0.798 1.00 . A A . 15 ALA H 1 1 3 1681 1 1 15 ALA HA H 7.276 -4.096 0.665 1.00 . A A . 15 ALA HA 1 1 3 1682 1 1 15 ALA HB1 H 6.247 -4.563 2.965 1.00 . A A . 15 ALA HB1 1 1 3 1683 1 1 15 ALA HB2 H 5.540 -2.951 2.859 1.00 . A A . 15 ALA HB2 1 1 3 1684 1 1 15 ALA HB3 H 7.293 -3.148 2.850 1.00 . A A . 15 ALA HB3 1 1 3 1685 1 1 15 ALA N N 6.138 -2.340 0.414 1.00 . A A . 15 ALA N 1 1 3 1686 1 1 15 ALA O O 5.420 -5.731 0.153 1.00 . A A . 15 ALA O 1 1 3 1687 1 1 16 TRP C C 2.953 -5.436 -1.158 1.00 . A A . 16 TRP C 1 1 3 1688 1 1 16 TRP CA C 2.828 -5.036 0.307 1.00 . A A . 16 TRP CA 1 1 3 1689 1 1 16 TRP CB C 1.512 -4.277 0.564 1.00 . A A . 16 TRP CB 1 1 3 1690 1 1 16 TRP CD1 C 1.148 -2.085 -0.649 1.00 . A A . 16 TRP CD1 1 1 3 1691 1 1 16 TRP CD2 C 0.731 -3.875 -1.929 1.00 . A A . 16 TRP CD2 1 1 3 1692 1 1 16 TRP CE2 C 0.504 -2.744 -2.743 1.00 . A A . 16 TRP CE2 1 1 3 1693 1 1 16 TRP CE3 C 0.541 -5.141 -2.479 1.00 . A A . 16 TRP CE3 1 1 3 1694 1 1 16 TRP CG C 1.150 -3.435 -0.617 1.00 . A A . 16 TRP CG 1 1 3 1695 1 1 16 TRP CH2 C -0.086 -4.149 -4.612 1.00 . A A . 16 TRP CH2 1 1 3 1696 1 1 16 TRP CZ2 C 0.098 -2.872 -4.072 1.00 . A A . 16 TRP CZ2 1 1 3 1697 1 1 16 TRP CZ3 C 0.133 -5.281 -3.815 1.00 . A A . 16 TRP CZ3 1 1 3 1698 1 1 16 TRP H H 3.813 -3.279 1.041 1.00 . A A . 16 TRP H 1 1 3 1699 1 1 16 TRP HA H 2.838 -5.931 0.906 1.00 . A A . 16 TRP HA 1 1 3 1700 1 1 16 TRP HB2 H 0.721 -4.988 0.747 1.00 . A A . 16 TRP HB2 1 1 3 1701 1 1 16 TRP HB3 H 1.629 -3.644 1.431 1.00 . A A . 16 TRP HB3 1 1 3 1702 1 1 16 TRP HD1 H 1.404 -1.439 0.174 1.00 . A A . 16 TRP HD1 1 1 3 1703 1 1 16 TRP HE1 H 0.698 -0.739 -2.209 1.00 . A A . 16 TRP HE1 1 1 3 1704 1 1 16 TRP HE3 H 0.706 -6.014 -1.858 1.00 . A A . 16 TRP HE3 1 1 3 1705 1 1 16 TRP HH2 H -0.395 -4.267 -5.641 1.00 . A A . 16 TRP HH2 1 1 3 1706 1 1 16 TRP HZ2 H -0.068 -1.994 -4.679 1.00 . A A . 16 TRP HZ2 1 1 3 1707 1 1 16 TRP HZ3 H -0.005 -6.259 -4.234 1.00 . A A . 16 TRP HZ3 1 1 3 1708 1 1 16 TRP N N 3.975 -4.175 0.695 1.00 . A A . 16 TRP N 1 1 3 1709 1 1 16 TRP NE1 N 0.772 -1.671 -1.916 1.00 . A A . 16 TRP NE1 1 1 3 1710 1 1 16 TRP O O 2.721 -6.573 -1.519 1.00 . A A . 16 TRP O 1 1 3 1711 1 1 17 VAL C C 4.429 -6.030 -3.588 1.00 . A A . 17 VAL C 1 1 3 1712 1 1 17 VAL CA C 3.432 -4.879 -3.443 1.00 . A A . 17 VAL CA 1 1 3 1713 1 1 17 VAL CB C 3.878 -3.647 -4.248 1.00 . A A . 17 VAL CB 1 1 3 1714 1 1 17 VAL CG1 C 5.405 -3.576 -4.346 1.00 . A A . 17 VAL CG1 1 1 3 1715 1 1 17 VAL CG2 C 3.278 -3.734 -5.651 1.00 . A A . 17 VAL CG2 1 1 3 1716 1 1 17 VAL H H 3.490 -3.607 -1.709 1.00 . A A . 17 VAL H 1 1 3 1717 1 1 17 VAL HA H 2.470 -5.207 -3.803 1.00 . A A . 17 VAL HA 1 1 3 1718 1 1 17 VAL HB H 3.514 -2.756 -3.757 1.00 . A A . 17 VAL HB 1 1 3 1719 1 1 17 VAL HG11 H 5.820 -3.397 -3.366 1.00 . A A . 17 VAL HG11 1 1 3 1720 1 1 17 VAL HG12 H 5.684 -2.771 -5.008 1.00 . A A . 17 VAL HG12 1 1 3 1721 1 1 17 VAL HG13 H 5.785 -4.510 -4.734 1.00 . A A . 17 VAL HG13 1 1 3 1722 1 1 17 VAL HG21 H 2.371 -4.321 -5.618 1.00 . A A . 17 VAL HG21 1 1 3 1723 1 1 17 VAL HG22 H 3.987 -4.204 -6.318 1.00 . A A . 17 VAL HG22 1 1 3 1724 1 1 17 VAL HG23 H 3.051 -2.740 -6.009 1.00 . A A . 17 VAL HG23 1 1 3 1725 1 1 17 VAL N N 3.310 -4.521 -2.011 1.00 . A A . 17 VAL N 1 1 3 1726 1 1 17 VAL O O 4.129 -7.048 -4.175 1.00 . A A . 17 VAL O 1 1 3 1727 1 1 18 GLY C C 5.995 -8.276 -2.564 1.00 . A A . 18 GLY C 1 1 3 1728 1 1 18 GLY CA C 6.604 -6.990 -3.126 1.00 . A A . 18 GLY CA 1 1 3 1729 1 1 18 GLY H H 5.819 -5.071 -2.543 1.00 . A A . 18 GLY H 1 1 3 1730 1 1 18 GLY HA2 H 6.877 -7.139 -4.161 1.00 . A A . 18 GLY HA2 1 1 3 1731 1 1 18 GLY HA3 H 7.480 -6.729 -2.553 1.00 . A A . 18 GLY HA3 1 1 3 1732 1 1 18 GLY N N 5.602 -5.890 -3.033 1.00 . A A . 18 GLY N 1 1 3 1733 1 1 18 GLY O O 6.495 -9.362 -2.783 1.00 . A A . 18 GLY O 1 1 3 1734 1 1 19 GLU C C 3.217 -9.862 -2.251 1.00 . A A . 19 GLU C 1 1 3 1735 1 1 19 GLU CA C 4.256 -9.357 -1.269 1.00 . A A . 19 GLU CA 1 1 3 1736 1 1 19 GLU CB C 3.546 -8.955 0.022 1.00 . A A . 19 GLU CB 1 1 3 1737 1 1 19 GLU CD C 5.060 -9.045 2.005 1.00 . A A . 19 GLU CD 1 1 3 1738 1 1 19 GLU CG C 4.501 -8.152 0.895 1.00 . A A . 19 GLU CG 1 1 3 1739 1 1 19 GLU H H 4.524 -7.277 -1.685 1.00 . A A . 19 GLU H 1 1 3 1740 1 1 19 GLU HA H 4.984 -10.124 -1.070 1.00 . A A . 19 GLU HA 1 1 3 1741 1 1 19 GLU HB2 H 2.684 -8.341 -0.220 1.00 . A A . 19 GLU HB2 1 1 3 1742 1 1 19 GLU HB3 H 3.226 -9.839 0.554 1.00 . A A . 19 GLU HB3 1 1 3 1743 1 1 19 GLU HG2 H 5.311 -7.782 0.285 1.00 . A A . 19 GLU HG2 1 1 3 1744 1 1 19 GLU HG3 H 3.968 -7.323 1.334 1.00 . A A . 19 GLU HG3 1 1 3 1745 1 1 19 GLU N N 4.912 -8.159 -1.845 1.00 . A A . 19 GLU N 1 1 3 1746 1 1 19 GLU O O 3.302 -10.955 -2.776 1.00 . A A . 19 GLU O 1 1 3 1747 1 1 19 GLU OE1 O 4.273 -9.723 2.645 1.00 . A A . 19 GLU OE1 1 1 3 1748 1 1 19 GLU OE2 O 6.266 -9.037 2.194 1.00 . A A . 19 GLU OE2 1 1 3 1749 1 1 20 ILE C C 1.665 -9.444 -4.859 1.00 . A A . 20 ILE C 1 1 3 1750 1 1 20 ILE CA C 1.148 -9.456 -3.420 1.00 . A A . 20 ILE CA 1 1 3 1751 1 1 20 ILE CB C 0.013 -8.445 -3.270 1.00 . A A . 20 ILE CB 1 1 3 1752 1 1 20 ILE CD1 C -2.026 -7.863 -1.958 1.00 . A A . 20 ILE CD1 1 1 3 1753 1 1 20 ILE CG1 C -0.881 -8.866 -2.115 1.00 . A A . 20 ILE CG1 1 1 3 1754 1 1 20 ILE CG2 C -0.816 -8.374 -4.559 1.00 . A A . 20 ILE CG2 1 1 3 1755 1 1 20 ILE H H 2.186 -8.191 -2.039 1.00 . A A . 20 ILE H 1 1 3 1756 1 1 20 ILE HA H 0.794 -10.439 -3.166 1.00 . A A . 20 ILE HA 1 1 3 1757 1 1 20 ILE HB H 0.441 -7.476 -3.051 1.00 . A A . 20 ILE HB 1 1 3 1758 1 1 20 ILE HD11 H -1.924 -7.344 -1.015 1.00 . A A . 20 ILE HD11 1 1 3 1759 1 1 20 ILE HD12 H -2.970 -8.388 -1.978 1.00 . A A . 20 ILE HD12 1 1 3 1760 1 1 20 ILE HD13 H -1.993 -7.149 -2.768 1.00 . A A . 20 ILE HD13 1 1 3 1761 1 1 20 ILE HG12 H -1.284 -9.848 -2.317 1.00 . A A . 20 ILE HG12 1 1 3 1762 1 1 20 ILE HG13 H -0.296 -8.887 -1.208 1.00 . A A . 20 ILE HG13 1 1 3 1763 1 1 20 ILE HG21 H -1.598 -7.638 -4.445 1.00 . A A . 20 ILE HG21 1 1 3 1764 1 1 20 ILE HG22 H -1.255 -9.339 -4.758 1.00 . A A . 20 ILE HG22 1 1 3 1765 1 1 20 ILE HG23 H -0.173 -8.092 -5.382 1.00 . A A . 20 ILE HG23 1 1 3 1766 1 1 20 ILE N N 2.226 -9.063 -2.489 1.00 . A A . 20 ILE N 1 1 3 1767 1 1 20 ILE O O 1.482 -10.383 -5.607 1.00 . A A . 20 ILE O 1 1 3 1768 1 1 21 MET C C 3.853 -9.355 -6.892 1.00 . A A . 21 MET C 1 1 3 1769 1 1 21 MET CA C 2.785 -8.280 -6.652 1.00 . A A . 21 MET CA 1 1 3 1770 1 1 21 MET CB C 3.355 -6.873 -6.884 1.00 . A A . 21 MET CB 1 1 3 1771 1 1 21 MET CE C 6.767 -5.548 -8.024 1.00 . A A . 21 MET CE 1 1 3 1772 1 1 21 MET CG C 4.858 -6.844 -6.596 1.00 . A A . 21 MET CG 1 1 3 1773 1 1 21 MET H H 2.405 -7.620 -4.639 1.00 . A A . 21 MET H 1 1 3 1774 1 1 21 MET HA H 1.959 -8.440 -7.329 1.00 . A A . 21 MET HA 1 1 3 1775 1 1 21 MET HB2 H 3.182 -6.584 -7.912 1.00 . A A . 21 MET HB2 1 1 3 1776 1 1 21 MET HB3 H 2.852 -6.178 -6.225 1.00 . A A . 21 MET HB3 1 1 3 1777 1 1 21 MET HE1 H 7.792 -5.811 -7.803 1.00 . A A . 21 MET HE1 1 1 3 1778 1 1 21 MET HE2 H 6.379 -4.922 -7.236 1.00 . A A . 21 MET HE2 1 1 3 1779 1 1 21 MET HE3 H 6.720 -5.012 -8.962 1.00 . A A . 21 MET HE3 1 1 3 1780 1 1 21 MET HG2 H 5.119 -5.896 -6.147 1.00 . A A . 21 MET HG2 1 1 3 1781 1 1 21 MET HG3 H 5.107 -7.647 -5.917 1.00 . A A . 21 MET HG3 1 1 3 1782 1 1 21 MET N N 2.284 -8.373 -5.256 1.00 . A A . 21 MET N 1 1 3 1783 1 1 21 MET O O 4.151 -9.708 -8.016 1.00 . A A . 21 MET O 1 1 3 1784 1 1 21 MET SD S 5.774 -7.056 -8.143 1.00 . A A . 21 MET SD 1 1 3 1785 1 1 22 ASN C C 4.927 -12.273 -5.545 1.00 . A A . 22 ASN C 1 1 3 1786 1 1 22 ASN CA C 5.478 -10.923 -6.009 1.00 . A A . 22 ASN CA 1 1 3 1787 1 1 22 ASN CB C 6.702 -10.557 -5.166 1.00 . A A . 22 ASN CB 1 1 3 1788 1 1 22 ASN CG C 7.956 -11.167 -5.795 1.00 . A A . 22 ASN CG 1 1 3 1789 1 1 22 ASN H H 4.175 -9.575 -4.946 1.00 . A A . 22 ASN H 1 1 3 1790 1 1 22 ASN HA H 5.762 -10.987 -7.049 1.00 . A A . 22 ASN HA 1 1 3 1791 1 1 22 ASN HB2 H 6.804 -9.481 -5.129 1.00 . A A . 22 ASN HB2 1 1 3 1792 1 1 22 ASN HB3 H 6.579 -10.945 -4.165 1.00 . A A . 22 ASN HB3 1 1 3 1793 1 1 22 ASN HD21 H 8.952 -11.232 -4.075 1.00 . A A . 22 ASN HD21 1 1 3 1794 1 1 22 ASN HD22 H 9.799 -11.820 -5.435 1.00 . A A . 22 ASN HD22 1 1 3 1795 1 1 22 ASN N N 4.431 -9.875 -5.844 1.00 . A A . 22 ASN N 1 1 3 1796 1 1 22 ASN ND2 N 8.988 -11.429 -5.039 1.00 . A A . 22 ASN ND2 1 1 3 1797 1 1 22 ASN O O 5.651 -13.243 -5.429 1.00 . A A . 22 ASN O 1 1 3 1798 1 1 22 ASN OD1 O 7.999 -11.407 -6.984 1.00 . A A . 22 ASN OD1 1 1 3 1799 1 1 23 SER C C 1.617 -13.738 -5.317 1.00 . A A . 23 SER C 1 1 3 1800 1 1 23 SER CA C 3.059 -13.632 -4.819 1.00 . A A . 23 SER CA 1 1 3 1801 1 1 23 SER CB C 3.076 -13.687 -3.292 1.00 . A A . 23 SER CB 1 1 3 1802 1 1 23 SER H H 3.084 -11.552 -5.376 1.00 . A A . 23 SER H 1 1 3 1803 1 1 23 SER HA H 3.637 -14.455 -5.214 1.00 . A A . 23 SER HA 1 1 3 1804 1 1 23 SER HB2 H 4.079 -13.522 -2.934 1.00 . A A . 23 SER HB2 1 1 3 1805 1 1 23 SER HB3 H 2.425 -12.915 -2.898 1.00 . A A . 23 SER HB3 1 1 3 1806 1 1 23 SER HG H 1.725 -15.080 -3.161 1.00 . A A . 23 SER HG 1 1 3 1807 1 1 23 SER N N 3.652 -12.345 -5.277 1.00 . A A . 23 SER N 1 1 3 1808 1 1 23 SER O O 0.737 -13.237 -4.636 1.00 . A A . 23 SER O 1 1 3 1809 1 1 23 SER OXT O 1.416 -14.322 -6.369 1.00 . A A . 23 SER OXT 1 1 3 1810 1 1 23 SER OG O 2.630 -14.966 -2.862 1.00 . A A . 23 SER OG 1 1 3 1811 2 1 1 GLY C C 3.704 -11.410 8.080 1.00 . B B . 1 GLY C 1 1 3 1812 2 1 1 GLY CA C 4.523 -12.242 9.066 1.00 . B B . 1 GLY CA 1 1 3 1813 2 1 1 GLY H1 H 6.257 -11.144 9.426 1.00 . B B . 1 GLY H1 1 1 3 1814 2 1 1 GLY H2 H 5.544 -11.795 10.826 1.00 . B B . 1 GLY H2 1 1 3 1815 2 1 1 GLY H3 H 4.849 -10.444 10.065 1.00 . B B . 1 GLY H3 1 1 3 1816 2 1 1 GLY HA2 H 5.166 -12.920 8.521 1.00 . B B . 1 GLY HA2 1 1 3 1817 2 1 1 GLY HA3 H 3.855 -12.808 9.696 1.00 . B B . 1 GLY HA3 1 1 3 1818 2 1 1 GLY N N 5.356 -11.338 9.909 1.00 . B B . 1 GLY N 1 1 3 1819 2 1 1 GLY O O 3.782 -10.198 8.060 1.00 . B B . 1 GLY O 1 1 3 1820 2 1 2 ILE C C 0.692 -11.071 6.840 1.00 . B B . 2 ILE C 1 1 3 1821 2 1 2 ILE CA C 2.093 -11.297 6.272 1.00 . B B . 2 ILE CA 1 1 3 1822 2 1 2 ILE CB C 1.992 -12.100 4.976 1.00 . B B . 2 ILE CB 1 1 3 1823 2 1 2 ILE CD1 C 3.593 -13.943 4.438 1.00 . B B . 2 ILE CD1 1 1 3 1824 2 1 2 ILE CG1 C 3.398 -12.426 4.466 1.00 . B B . 2 ILE CG1 1 1 3 1825 2 1 2 ILE CG2 C 1.246 -11.279 3.923 1.00 . B B . 2 ILE CG2 1 1 3 1826 2 1 2 ILE H H 2.870 -13.030 7.291 1.00 . B B . 2 ILE H 1 1 3 1827 2 1 2 ILE HA H 2.557 -10.342 6.068 1.00 . B B . 2 ILE HA 1 1 3 1828 2 1 2 ILE HB H 1.454 -13.018 5.164 1.00 . B B . 2 ILE HB 1 1 3 1829 2 1 2 ILE HD11 H 3.565 -14.327 5.446 1.00 . B B . 2 ILE HD11 1 1 3 1830 2 1 2 ILE HD12 H 4.548 -14.175 3.991 1.00 . B B . 2 ILE HD12 1 1 3 1831 2 1 2 ILE HD13 H 2.804 -14.397 3.857 1.00 . B B . 2 ILE HD13 1 1 3 1832 2 1 2 ILE HG12 H 3.520 -12.027 3.468 1.00 . B B . 2 ILE HG12 1 1 3 1833 2 1 2 ILE HG13 H 4.131 -11.982 5.125 1.00 . B B . 2 ILE HG13 1 1 3 1834 2 1 2 ILE HG21 H 1.805 -11.286 2.999 1.00 . B B . 2 ILE HG21 1 1 3 1835 2 1 2 ILE HG22 H 1.137 -10.262 4.271 1.00 . B B . 2 ILE HG22 1 1 3 1836 2 1 2 ILE HG23 H 0.269 -11.709 3.757 1.00 . B B . 2 ILE HG23 1 1 3 1837 2 1 2 ILE N N 2.918 -12.052 7.259 1.00 . B B . 2 ILE N 1 1 3 1838 2 1 2 ILE O O -0.223 -11.828 6.583 1.00 . B B . 2 ILE O 1 1 3 1839 2 1 3 GLY C C -1.075 -8.240 8.177 1.00 . B B . 3 GLY C 1 1 3 1840 2 1 3 GLY CA C -0.832 -9.748 8.180 1.00 . B B . 3 GLY CA 1 1 3 1841 2 1 3 GLY H H 1.263 -9.425 7.793 1.00 . B B . 3 GLY H 1 1 3 1842 2 1 3 GLY HA2 H -1.586 -10.231 7.574 1.00 . B B . 3 GLY HA2 1 1 3 1843 2 1 3 GLY HA3 H -0.882 -10.118 9.191 1.00 . B B . 3 GLY HA3 1 1 3 1844 2 1 3 GLY N N 0.513 -10.027 7.604 1.00 . B B . 3 GLY N 1 1 3 1845 2 1 3 GLY O O -1.290 -7.626 9.204 1.00 . B B . 3 GLY O 1 1 3 1846 2 1 4 LYS C C -1.043 -5.797 5.442 1.00 . B B . 4 LYS C 1 1 3 1847 2 1 4 LYS CA C -1.264 -6.185 6.899 1.00 . B B . 4 LYS CA 1 1 3 1848 2 1 4 LYS CB C -0.266 -5.430 7.776 1.00 . B B . 4 LYS CB 1 1 3 1849 2 1 4 LYS CD C -0.344 -3.423 9.269 1.00 . B B . 4 LYS CD 1 1 3 1850 2 1 4 LYS CE C -1.207 -2.194 9.569 1.00 . B B . 4 LYS CE 1 1 3 1851 2 1 4 LYS CG C -0.694 -3.965 7.880 1.00 . B B . 4 LYS CG 1 1 3 1852 2 1 4 LYS H H -0.865 -8.179 6.213 1.00 . B B . 4 LYS H 1 1 3 1853 2 1 4 LYS HA H -2.273 -5.941 7.195 1.00 . B B . 4 LYS HA 1 1 3 1854 2 1 4 LYS HB2 H -0.243 -5.872 8.762 1.00 . B B . 4 LYS HB2 1 1 3 1855 2 1 4 LYS HB3 H 0.716 -5.484 7.330 1.00 . B B . 4 LYS HB3 1 1 3 1856 2 1 4 LYS HD2 H -0.530 -4.187 10.010 1.00 . B B . 4 LYS HD2 1 1 3 1857 2 1 4 LYS HD3 H 0.698 -3.144 9.294 1.00 . B B . 4 LYS HD3 1 1 3 1858 2 1 4 LYS HE2 H -0.908 -1.378 8.928 1.00 . B B . 4 LYS HE2 1 1 3 1859 2 1 4 LYS HE3 H -2.246 -2.430 9.390 1.00 . B B . 4 LYS HE3 1 1 3 1860 2 1 4 LYS HG2 H -0.179 -3.387 7.126 1.00 . B B . 4 LYS HG2 1 1 3 1861 2 1 4 LYS HG3 H -1.760 -3.892 7.725 1.00 . B B . 4 LYS HG3 1 1 3 1862 2 1 4 LYS HZ1 H -1.281 -2.591 11.613 1.00 . B B . 4 LYS HZ1 1 1 3 1863 2 1 4 LYS HZ2 H -1.641 -0.982 11.206 1.00 . B B . 4 LYS HZ2 1 1 3 1864 2 1 4 LYS HZ3 H -0.035 -1.534 11.160 1.00 . B B . 4 LYS HZ3 1 1 3 1865 2 1 4 LYS N N -1.041 -7.650 7.020 1.00 . B B . 4 LYS N 1 1 3 1866 2 1 4 LYS NZ N -1.027 -1.796 10.995 1.00 . B B . 4 LYS NZ 1 1 3 1867 2 1 4 LYS O O -1.824 -5.084 4.845 1.00 . B B . 4 LYS O 1 1 3 1868 2 1 5 TYR C C -0.595 -6.805 2.561 1.00 . B B . 5 TYR C 1 1 3 1869 2 1 5 TYR CA C 0.320 -5.975 3.453 1.00 . B B . 5 TYR CA 1 1 3 1870 2 1 5 TYR CB C 1.781 -6.309 3.170 1.00 . B B . 5 TYR CB 1 1 3 1871 2 1 5 TYR CD1 C 3.078 -4.727 4.638 1.00 . B B . 5 TYR CD1 1 1 3 1872 2 1 5 TYR CD2 C 2.945 -7.062 5.280 1.00 . B B . 5 TYR CD2 1 1 3 1873 2 1 5 TYR CE1 C 3.861 -4.460 5.767 1.00 . B B . 5 TYR CE1 1 1 3 1874 2 1 5 TYR CE2 C 3.727 -6.795 6.410 1.00 . B B . 5 TYR CE2 1 1 3 1875 2 1 5 TYR CG C 2.620 -6.028 4.395 1.00 . B B . 5 TYR CG 1 1 3 1876 2 1 5 TYR CZ C 4.186 -5.493 6.653 1.00 . B B . 5 TYR CZ 1 1 3 1877 2 1 5 TYR H H 0.628 -6.859 5.375 1.00 . B B . 5 TYR H 1 1 3 1878 2 1 5 TYR HA H 0.148 -4.935 3.256 1.00 . B B . 5 TYR HA 1 1 3 1879 2 1 5 TYR HB2 H 1.873 -7.350 2.897 1.00 . B B . 5 TYR HB2 1 1 3 1880 2 1 5 TYR HB3 H 2.122 -5.691 2.368 1.00 . B B . 5 TYR HB3 1 1 3 1881 2 1 5 TYR HD1 H 2.828 -3.930 3.953 1.00 . B B . 5 TYR HD1 1 1 3 1882 2 1 5 TYR HD2 H 2.592 -8.065 5.094 1.00 . B B . 5 TYR HD2 1 1 3 1883 2 1 5 TYR HE1 H 4.215 -3.456 5.954 1.00 . B B . 5 TYR HE1 1 1 3 1884 2 1 5 TYR HE2 H 3.978 -7.591 7.094 1.00 . B B . 5 TYR HE2 1 1 3 1885 2 1 5 TYR HH H 5.181 -6.070 8.177 1.00 . B B . 5 TYR HH 1 1 3 1886 2 1 5 TYR N N 0.021 -6.281 4.868 1.00 . B B . 5 TYR N 1 1 3 1887 2 1 5 TYR O O -0.768 -6.520 1.392 1.00 . B B . 5 TYR O 1 1 3 1888 2 1 5 TYR OH O 4.956 -5.232 7.767 1.00 . B B . 5 TYR OH 1 1 3 1889 2 1 6 LEU C C -3.531 -8.520 2.792 1.00 . B B . 6 LEU C 1 1 3 1890 2 1 6 LEU CA C -2.096 -8.676 2.293 1.00 . B B . 6 LEU CA 1 1 3 1891 2 1 6 LEU CB C -1.658 -10.134 2.423 1.00 . B B . 6 LEU CB 1 1 3 1892 2 1 6 LEU CD1 C -1.135 -10.880 0.103 1.00 . B B . 6 LEU CD1 1 1 3 1893 2 1 6 LEU CD2 C 0.344 -9.195 1.210 1.00 . B B . 6 LEU CD2 1 1 3 1894 2 1 6 LEU CG C -0.528 -10.441 1.433 1.00 . B B . 6 LEU CG 1 1 3 1895 2 1 6 LEU H H -1.033 -8.042 4.050 1.00 . B B . 6 LEU H 1 1 3 1896 2 1 6 LEU HA H -2.039 -8.370 1.258 1.00 . B B . 6 LEU HA 1 1 3 1897 2 1 6 LEU HB2 H -1.311 -10.313 3.430 1.00 . B B . 6 LEU HB2 1 1 3 1898 2 1 6 LEU HB3 H -2.499 -10.780 2.214 1.00 . B B . 6 LEU HB3 1 1 3 1899 2 1 6 LEU HD11 H -0.345 -11.136 -0.586 1.00 . B B . 6 LEU HD11 1 1 3 1900 2 1 6 LEU HD12 H -1.726 -10.074 -0.304 1.00 . B B . 6 LEU HD12 1 1 3 1901 2 1 6 LEU HD13 H -1.767 -11.740 0.264 1.00 . B B . 6 LEU HD13 1 1 3 1902 2 1 6 LEU HD21 H 1.192 -9.454 0.593 1.00 . B B . 6 LEU HD21 1 1 3 1903 2 1 6 LEU HD22 H 0.691 -8.824 2.162 1.00 . B B . 6 LEU HD22 1 1 3 1904 2 1 6 LEU HD23 H -0.240 -8.429 0.717 1.00 . B B . 6 LEU HD23 1 1 3 1905 2 1 6 LEU HG H 0.082 -11.239 1.829 1.00 . B B . 6 LEU HG 1 1 3 1906 2 1 6 LEU N N -1.187 -7.829 3.105 1.00 . B B . 6 LEU N 1 1 3 1907 2 1 6 LEU O O -4.402 -9.299 2.457 1.00 . B B . 6 LEU O 1 1 3 1908 2 1 7 HIS C C -5.508 -5.838 4.169 1.00 . B B . 7 HIS C 1 1 3 1909 2 1 7 HIS CA C -5.172 -7.328 4.101 1.00 . B B . 7 HIS CA 1 1 3 1910 2 1 7 HIS CB C -5.289 -7.943 5.496 1.00 . B B . 7 HIS CB 1 1 3 1911 2 1 7 HIS CD2 C -3.431 -9.628 6.264 1.00 . B B . 7 HIS CD2 1 1 3 1912 2 1 7 HIS CE1 C -3.986 -11.305 5.009 1.00 . B B . 7 HIS CE1 1 1 3 1913 2 1 7 HIS CG C -4.523 -9.234 5.536 1.00 . B B . 7 HIS CG 1 1 3 1914 2 1 7 HIS H H -3.074 -6.905 3.850 1.00 . B B . 7 HIS H 1 1 3 1915 2 1 7 HIS HA H -5.866 -7.818 3.437 1.00 . B B . 7 HIS HA 1 1 3 1916 2 1 7 HIS HB2 H -4.883 -7.260 6.227 1.00 . B B . 7 HIS HB2 1 1 3 1917 2 1 7 HIS HB3 H -6.328 -8.134 5.719 1.00 . B B . 7 HIS HB3 1 1 3 1918 2 1 7 HIS HD1 H -5.605 -10.360 4.105 1.00 . B B . 7 HIS HD1 1 1 3 1919 2 1 7 HIS HD2 H -2.912 -9.016 6.985 1.00 . B B . 7 HIS HD2 1 1 3 1920 2 1 7 HIS HE1 H -4.002 -12.274 4.533 1.00 . B B . 7 HIS HE1 1 1 3 1921 2 1 7 HIS N N -3.788 -7.522 3.589 1.00 . B B . 7 HIS N 1 1 3 1922 2 1 7 HIS ND1 N -4.862 -10.319 4.742 1.00 . B B . 7 HIS ND1 1 1 3 1923 2 1 7 HIS NE2 N -3.091 -10.937 5.930 1.00 . B B . 7 HIS NE2 1 1 3 1924 2 1 7 HIS O O -6.642 -5.444 3.976 1.00 . B B . 7 HIS O 1 1 3 1925 2 1 8 SER C C -4.036 -2.786 3.476 1.00 . B B . 8 SER C 1 1 3 1926 2 1 8 SER CA C -4.850 -3.543 4.522 1.00 . B B . 8 SER CA 1 1 3 1927 2 1 8 SER CB C -4.507 -3.017 5.917 1.00 . B B . 8 SER CB 1 1 3 1928 2 1 8 SER H H -3.635 -5.321 4.602 1.00 . B B . 8 SER H 1 1 3 1929 2 1 8 SER HA H -5.899 -3.390 4.328 1.00 . B B . 8 SER HA 1 1 3 1930 2 1 8 SER HB2 H -3.442 -2.870 5.997 1.00 . B B . 8 SER HB2 1 1 3 1931 2 1 8 SER HB3 H -5.011 -2.073 6.079 1.00 . B B . 8 SER HB3 1 1 3 1932 2 1 8 SER HG H -5.689 -4.428 6.548 1.00 . B B . 8 SER HG 1 1 3 1933 2 1 8 SER N N -4.547 -4.998 4.444 1.00 . B B . 8 SER N 1 1 3 1934 2 1 8 SER O O -4.475 -1.785 2.942 1.00 . B B . 8 SER O 1 1 3 1935 2 1 8 SER OG O -4.922 -3.965 6.892 1.00 . B B . 8 SER OG 1 1 3 1936 2 1 9 ALA C C -2.771 -2.530 0.825 1.00 . B B . 9 ALA C 1 1 3 1937 2 1 9 ALA CA C -2.035 -2.536 2.158 1.00 . B B . 9 ALA CA 1 1 3 1938 2 1 9 ALA CB C -0.694 -3.242 1.983 1.00 . B B . 9 ALA CB 1 1 3 1939 2 1 9 ALA H H -2.517 -4.057 3.609 1.00 . B B . 9 ALA H 1 1 3 1940 2 1 9 ALA HA H -1.866 -1.519 2.479 1.00 . B B . 9 ALA HA 1 1 3 1941 2 1 9 ALA HB1 H -0.152 -2.777 1.178 1.00 . B B . 9 ALA HB1 1 1 3 1942 2 1 9 ALA HB2 H -0.861 -4.288 1.752 1.00 . B B . 9 ALA HB2 1 1 3 1943 2 1 9 ALA HB3 H -0.124 -3.159 2.895 1.00 . B B . 9 ALA HB3 1 1 3 1944 2 1 9 ALA N N -2.858 -3.247 3.172 1.00 . B B . 9 ALA N 1 1 3 1945 2 1 9 ALA O O -3.177 -1.496 0.344 1.00 . B B . 9 ALA O 1 1 3 1946 2 1 10 LYS C C -4.696 -2.680 -1.222 1.00 . B B . 10 LYS C 1 1 3 1947 2 1 10 LYS CA C -3.627 -3.773 -1.095 1.00 . B B . 10 LYS CA 1 1 3 1948 2 1 10 LYS CB C -4.287 -5.146 -1.234 1.00 . B B . 10 LYS CB 1 1 3 1949 2 1 10 LYS CD C -6.275 -6.529 -0.619 1.00 . B B . 10 LYS CD 1 1 3 1950 2 1 10 LYS CE C -6.894 -6.515 -2.018 1.00 . B B . 10 LYS CE 1 1 3 1951 2 1 10 LYS CG C -5.547 -5.207 -0.369 1.00 . B B . 10 LYS CG 1 1 3 1952 2 1 10 LYS H H -2.567 -4.501 0.646 1.00 . B B . 10 LYS H 1 1 3 1953 2 1 10 LYS HA H -2.904 -3.647 -1.884 1.00 . B B . 10 LYS HA 1 1 3 1954 2 1 10 LYS HB2 H -4.551 -5.310 -2.269 1.00 . B B . 10 LYS HB2 1 1 3 1955 2 1 10 LYS HB3 H -3.597 -5.912 -0.913 1.00 . B B . 10 LYS HB3 1 1 3 1956 2 1 10 LYS HD2 H -5.574 -7.346 -0.542 1.00 . B B . 10 LYS HD2 1 1 3 1957 2 1 10 LYS HD3 H -7.056 -6.654 0.116 1.00 . B B . 10 LYS HD3 1 1 3 1958 2 1 10 LYS HE2 H -6.218 -6.031 -2.706 1.00 . B B . 10 LYS HE2 1 1 3 1959 2 1 10 LYS HE3 H -7.073 -7.529 -2.344 1.00 . B B . 10 LYS HE3 1 1 3 1960 2 1 10 LYS HG2 H -5.271 -5.138 0.674 1.00 . B B . 10 LYS HG2 1 1 3 1961 2 1 10 LYS HG3 H -6.199 -4.385 -0.625 1.00 . B B . 10 LYS HG3 1 1 3 1962 2 1 10 LYS HZ1 H -8.934 -6.392 -1.620 1.00 . B B . 10 LYS HZ1 1 1 3 1963 2 1 10 LYS HZ2 H -8.429 -5.452 -2.942 1.00 . B B . 10 LYS HZ2 1 1 3 1964 2 1 10 LYS HZ3 H -8.092 -4.946 -1.356 1.00 . B B . 10 LYS HZ3 1 1 3 1965 2 1 10 LYS N N -2.927 -3.684 0.226 1.00 . B B . 10 LYS N 1 1 3 1966 2 1 10 LYS NZ N -8.185 -5.770 -1.982 1.00 . B B . 10 LYS NZ 1 1 3 1967 2 1 10 LYS O O -4.867 -2.094 -2.272 1.00 . B B . 10 LYS O 1 1 3 1968 2 1 11 LYS C C -5.769 -0.001 -0.589 1.00 . B B . 11 LYS C 1 1 3 1969 2 1 11 LYS CA C -6.449 -1.326 -0.254 1.00 . B B . 11 LYS CA 1 1 3 1970 2 1 11 LYS CB C -7.177 -1.198 1.086 1.00 . B B . 11 LYS CB 1 1 3 1971 2 1 11 LYS CD C -8.188 -2.535 2.937 1.00 . B B . 11 LYS CD 1 1 3 1972 2 1 11 LYS CE C -9.633 -2.063 3.116 1.00 . B B . 11 LYS CE 1 1 3 1973 2 1 11 LYS CG C -7.830 -2.533 1.450 1.00 . B B . 11 LYS CG 1 1 3 1974 2 1 11 LYS H H -5.257 -2.865 0.677 1.00 . B B . 11 LYS H 1 1 3 1975 2 1 11 LYS HA H -7.156 -1.574 -1.032 1.00 . B B . 11 LYS HA 1 1 3 1976 2 1 11 LYS HB2 H -6.469 -0.922 1.855 1.00 . B B . 11 LYS HB2 1 1 3 1977 2 1 11 LYS HB3 H -7.939 -0.436 1.009 1.00 . B B . 11 LYS HB3 1 1 3 1978 2 1 11 LYS HD2 H -8.084 -3.536 3.330 1.00 . B B . 11 LYS HD2 1 1 3 1979 2 1 11 LYS HD3 H -7.526 -1.869 3.468 1.00 . B B . 11 LYS HD3 1 1 3 1980 2 1 11 LYS HE2 H -10.076 -1.886 2.148 1.00 . B B . 11 LYS HE2 1 1 3 1981 2 1 11 LYS HE3 H -10.197 -2.823 3.637 1.00 . B B . 11 LYS HE3 1 1 3 1982 2 1 11 LYS HG2 H -8.725 -2.667 0.860 1.00 . B B . 11 LYS HG2 1 1 3 1983 2 1 11 LYS HG3 H -7.140 -3.337 1.246 1.00 . B B . 11 LYS HG3 1 1 3 1984 2 1 11 LYS HZ1 H -8.949 -0.138 3.523 1.00 . B B . 11 LYS HZ1 1 1 3 1985 2 1 11 LYS HZ2 H -9.418 -1.012 4.902 1.00 . B B . 11 LYS HZ2 1 1 3 1986 2 1 11 LYS HZ3 H -10.594 -0.370 3.857 1.00 . B B . 11 LYS HZ3 1 1 3 1987 2 1 11 LYS N N -5.409 -2.391 -0.167 1.00 . B B . 11 LYS N 1 1 3 1988 2 1 11 LYS NZ N -9.650 -0.801 3.909 1.00 . B B . 11 LYS NZ 1 1 3 1989 2 1 11 LYS O O -5.999 0.584 -1.628 1.00 . B B . 11 LYS O 1 1 3 1990 2 1 12 PHE C C -3.186 1.498 -1.093 1.00 . B B . 12 PHE C 1 1 3 1991 2 1 12 PHE CA C -4.207 1.742 0.017 1.00 . B B . 12 PHE CA 1 1 3 1992 2 1 12 PHE CB C -3.489 2.198 1.291 1.00 . B B . 12 PHE CB 1 1 3 1993 2 1 12 PHE CD1 C -5.681 2.049 2.526 1.00 . B B . 12 PHE CD1 1 1 3 1994 2 1 12 PHE CD2 C -3.689 1.158 3.584 1.00 . B B . 12 PHE CD2 1 1 3 1995 2 1 12 PHE CE1 C -6.442 1.672 3.639 1.00 . B B . 12 PHE CE1 1 1 3 1996 2 1 12 PHE CE2 C -4.450 0.781 4.698 1.00 . B B . 12 PHE CE2 1 1 3 1997 2 1 12 PHE CG C -4.305 1.793 2.499 1.00 . B B . 12 PHE CG 1 1 3 1998 2 1 12 PHE CZ C -5.826 1.037 4.725 1.00 . B B . 12 PHE CZ 1 1 3 1999 2 1 12 PHE H H -4.743 -0.031 1.106 1.00 . B B . 12 PHE H 1 1 3 2000 2 1 12 PHE HA H -4.914 2.497 -0.296 1.00 . B B . 12 PHE HA 1 1 3 2001 2 1 12 PHE HB2 H -2.516 1.730 1.342 1.00 . B B . 12 PHE HB2 1 1 3 2002 2 1 12 PHE HB3 H -3.375 3.273 1.278 1.00 . B B . 12 PHE HB3 1 1 3 2003 2 1 12 PHE HD1 H -6.156 2.539 1.690 1.00 . B B . 12 PHE HD1 1 1 3 2004 2 1 12 PHE HD2 H -2.628 0.960 3.563 1.00 . B B . 12 PHE HD2 1 1 3 2005 2 1 12 PHE HE1 H -7.503 1.869 3.661 1.00 . B B . 12 PHE HE1 1 1 3 2006 2 1 12 PHE HE2 H -3.975 0.291 5.535 1.00 . B B . 12 PHE HE2 1 1 3 2007 2 1 12 PHE HZ H -6.413 0.746 5.584 1.00 . B B . 12 PHE HZ 1 1 3 2008 2 1 12 PHE N N -4.921 0.466 0.282 1.00 . B B . 12 PHE N 1 1 3 2009 2 1 12 PHE O O -2.890 2.368 -1.888 1.00 . B B . 12 PHE O 1 1 3 2010 2 1 13 GLY C C -2.166 0.454 -3.559 1.00 . B B . 13 GLY C 1 1 3 2011 2 1 13 GLY CA C -1.655 -0.026 -2.203 1.00 . B B . 13 GLY CA 1 1 3 2012 2 1 13 GLY H H -2.915 -0.375 -0.498 1.00 . B B . 13 GLY H 1 1 3 2013 2 1 13 GLY HA2 H -0.716 0.453 -1.978 1.00 . B B . 13 GLY HA2 1 1 3 2014 2 1 13 GLY HA3 H -1.513 -1.095 -2.236 1.00 . B B . 13 GLY HA3 1 1 3 2015 2 1 13 GLY N N -2.653 0.307 -1.150 1.00 . B B . 13 GLY N 1 1 3 2016 2 1 13 GLY O O -1.410 0.919 -4.388 1.00 . B B . 13 GLY O 1 1 3 2017 2 1 14 LYS C C -4.441 2.229 -5.038 1.00 . B B . 14 LYS C 1 1 3 2018 2 1 14 LYS CA C -3.987 0.774 -5.114 1.00 . B B . 14 LYS CA 1 1 3 2019 2 1 14 LYS CB C -5.174 -0.110 -5.500 1.00 . B B . 14 LYS CB 1 1 3 2020 2 1 14 LYS CD C -5.258 -1.820 -7.320 1.00 . B B . 14 LYS CD 1 1 3 2021 2 1 14 LYS CE C -4.711 -3.167 -7.792 1.00 . B B . 14 LYS CE 1 1 3 2022 2 1 14 LYS CG C -4.665 -1.480 -5.953 1.00 . B B . 14 LYS CG 1 1 3 2023 2 1 14 LYS H H -4.040 -0.059 -3.121 1.00 . B B . 14 LYS H 1 1 3 2024 2 1 14 LYS HA H -3.217 0.687 -5.859 1.00 . B B . 14 LYS HA 1 1 3 2025 2 1 14 LYS HB2 H -5.826 -0.230 -4.647 1.00 . B B . 14 LYS HB2 1 1 3 2026 2 1 14 LYS HB3 H -5.720 0.355 -6.308 1.00 . B B . 14 LYS HB3 1 1 3 2027 2 1 14 LYS HD2 H -6.334 -1.876 -7.243 1.00 . B B . 14 LYS HD2 1 1 3 2028 2 1 14 LYS HD3 H -4.986 -1.054 -8.032 1.00 . B B . 14 LYS HD3 1 1 3 2029 2 1 14 LYS HE2 H -4.799 -3.234 -8.866 1.00 . B B . 14 LYS HE2 1 1 3 2030 2 1 14 LYS HE3 H -3.671 -3.250 -7.510 1.00 . B B . 14 LYS HE3 1 1 3 2031 2 1 14 LYS HG2 H -3.587 -1.458 -6.022 1.00 . B B . 14 LYS HG2 1 1 3 2032 2 1 14 LYS HG3 H -4.964 -2.230 -5.237 1.00 . B B . 14 LYS HG3 1 1 3 2033 2 1 14 LYS HZ1 H -6.340 -3.878 -6.708 1.00 . B B . 14 LYS HZ1 1 1 3 2034 2 1 14 LYS HZ2 H -4.901 -4.738 -6.440 1.00 . B B . 14 LYS HZ2 1 1 3 2035 2 1 14 LYS HZ3 H -5.769 -4.959 -7.883 1.00 . B B . 14 LYS HZ3 1 1 3 2036 2 1 14 LYS N N -3.442 0.332 -3.799 1.00 . B B . 14 LYS N 1 1 3 2037 2 1 14 LYS NZ N -5.488 -4.268 -7.158 1.00 . B B . 14 LYS NZ 1 1 3 2038 2 1 14 LYS O O -4.568 2.899 -6.043 1.00 . B B . 14 LYS O 1 1 3 2039 2 1 15 ALA C C -3.910 5.044 -3.549 1.00 . B B . 15 ALA C 1 1 3 2040 2 1 15 ALA CA C -5.128 4.143 -3.749 1.00 . B B . 15 ALA CA 1 1 3 2041 2 1 15 ALA CB C -6.069 4.288 -2.552 1.00 . B B . 15 ALA CB 1 1 3 2042 2 1 15 ALA H H -4.578 2.178 -3.060 1.00 . B B . 15 ALA H 1 1 3 2043 2 1 15 ALA HA H -5.646 4.430 -4.652 1.00 . B B . 15 ALA HA 1 1 3 2044 2 1 15 ALA HB1 H -6.949 4.840 -2.851 1.00 . B B . 15 ALA HB1 1 1 3 2045 2 1 15 ALA HB2 H -5.564 4.819 -1.759 1.00 . B B . 15 ALA HB2 1 1 3 2046 2 1 15 ALA HB3 H -6.361 3.309 -2.201 1.00 . B B . 15 ALA HB3 1 1 3 2047 2 1 15 ALA N N -4.685 2.728 -3.864 1.00 . B B . 15 ALA N 1 1 3 2048 2 1 15 ALA O O -3.674 5.960 -4.309 1.00 . B B . 15 ALA O 1 1 3 2049 2 1 16 TRP C C -1.101 5.749 -3.515 1.00 . B B . 16 TRP C 1 1 3 2050 2 1 16 TRP CA C -1.933 5.603 -2.246 1.00 . B B . 16 TRP CA 1 1 3 2051 2 1 16 TRP CB C -1.127 4.934 -1.119 1.00 . B B . 16 TRP CB 1 1 3 2052 2 1 16 TRP CD1 C -0.183 2.625 -1.543 1.00 . B B . 16 TRP CD1 1 1 3 2053 2 1 16 TRP CD2 C 1.064 4.256 -2.425 1.00 . B B . 16 TRP CD2 1 1 3 2054 2 1 16 TRP CE2 C 1.710 3.043 -2.749 1.00 . B B . 16 TRP CE2 1 1 3 2055 2 1 16 TRP CE3 C 1.634 5.451 -2.854 1.00 . B B . 16 TRP CE3 1 1 3 2056 2 1 16 TRP CG C -0.132 3.966 -1.673 1.00 . B B . 16 TRP CG 1 1 3 2057 2 1 16 TRP CH2 C 3.460 4.228 -3.907 1.00 . B B . 16 TRP CH2 1 1 3 2058 2 1 16 TRP CZ2 C 2.896 3.022 -3.481 1.00 . B B . 16 TRP CZ2 1 1 3 2059 2 1 16 TRP CZ3 C 2.831 5.442 -3.592 1.00 . B B . 16 TRP CZ3 1 1 3 2060 2 1 16 TRP H H -3.350 4.032 -1.948 1.00 . B B . 16 TRP H 1 1 3 2061 2 1 16 TRP HA H -2.240 6.585 -1.921 1.00 . B B . 16 TRP HA 1 1 3 2062 2 1 16 TRP HB2 H -0.607 5.693 -0.555 1.00 . B B . 16 TRP HB2 1 1 3 2063 2 1 16 TRP HB3 H -1.807 4.409 -0.462 1.00 . B B . 16 TRP HB3 1 1 3 2064 2 1 16 TRP HD1 H -0.949 2.074 -1.025 1.00 . B B . 16 TRP HD1 1 1 3 2065 2 1 16 TRP HE1 H 1.106 1.114 -2.249 1.00 . B B . 16 TRP HE1 1 1 3 2066 2 1 16 TRP HE3 H 1.142 6.383 -2.607 1.00 . B B . 16 TRP HE3 1 1 3 2067 2 1 16 TRP HH2 H 4.378 4.227 -4.475 1.00 . B B . 16 TRP HH2 1 1 3 2068 2 1 16 TRP HZ2 H 3.374 2.083 -3.719 1.00 . B B . 16 TRP HZ2 1 1 3 2069 2 1 16 TRP HZ3 H 3.269 6.370 -3.919 1.00 . B B . 16 TRP HZ3 1 1 3 2070 2 1 16 TRP N N -3.138 4.780 -2.530 1.00 . B B . 16 TRP N 1 1 3 2071 2 1 16 TRP NE1 N 0.909 2.071 -2.188 1.00 . B B . 16 TRP NE1 1 1 3 2072 2 1 16 TRP O O -0.669 6.830 -3.862 1.00 . B B . 16 TRP O 1 1 3 2073 2 1 17 VAL C C -0.779 5.813 -6.380 1.00 . B B . 17 VAL C 1 1 3 2074 2 1 17 VAL CA C -0.093 4.790 -5.466 1.00 . B B . 17 VAL CA 1 1 3 2075 2 1 17 VAL CB C 0.015 3.404 -6.131 1.00 . B B . 17 VAL CB 1 1 3 2076 2 1 17 VAL CG1 C -0.959 3.269 -7.310 1.00 . B B . 17 VAL CG1 1 1 3 2077 2 1 17 VAL CG2 C 1.447 3.210 -6.629 1.00 . B B . 17 VAL CG2 1 1 3 2078 2 1 17 VAL H H -1.245 3.815 -3.936 1.00 . B B . 17 VAL H 1 1 3 2079 2 1 17 VAL HA H 0.898 5.146 -5.223 1.00 . B B . 17 VAL HA 1 1 3 2080 2 1 17 VAL HB H -0.211 2.642 -5.399 1.00 . B B . 17 VAL HB 1 1 3 2081 2 1 17 VAL HG11 H -1.972 3.237 -6.938 1.00 . B B . 17 VAL HG11 1 1 3 2082 2 1 17 VAL HG12 H -0.746 2.358 -7.850 1.00 . B B . 17 VAL HG12 1 1 3 2083 2 1 17 VAL HG13 H -0.844 4.114 -7.972 1.00 . B B . 17 VAL HG13 1 1 3 2084 2 1 17 VAL HG21 H 1.997 4.131 -6.497 1.00 . B B . 17 VAL HG21 1 1 3 2085 2 1 17 VAL HG22 H 1.433 2.943 -7.674 1.00 . B B . 17 VAL HG22 1 1 3 2086 2 1 17 VAL HG23 H 1.922 2.424 -6.061 1.00 . B B . 17 VAL HG23 1 1 3 2087 2 1 17 VAL N N -0.882 4.680 -4.220 1.00 . B B . 17 VAL N 1 1 3 2088 2 1 17 VAL O O -0.180 6.772 -6.817 1.00 . B B . 17 VAL O 1 1 3 2089 2 1 18 GLY C C -2.559 8.030 -6.933 1.00 . B B . 18 GLY C 1 1 3 2090 2 1 18 GLY CA C -2.749 6.623 -7.510 1.00 . B B . 18 GLY CA 1 1 3 2091 2 1 18 GLY H H -2.525 4.875 -6.270 1.00 . B B . 18 GLY H 1 1 3 2092 2 1 18 GLY HA2 H -2.335 6.582 -8.510 1.00 . B B . 18 GLY HA2 1 1 3 2093 2 1 18 GLY HA3 H -3.801 6.387 -7.543 1.00 . B B . 18 GLY HA3 1 1 3 2094 2 1 18 GLY N N -2.041 5.639 -6.646 1.00 . B B . 18 GLY N 1 1 3 2095 2 1 18 GLY O O -2.744 9.019 -7.614 1.00 . B B . 18 GLY O 1 1 3 2096 2 1 19 GLU C C -0.516 9.880 -5.337 1.00 . B B . 19 GLU C 1 1 3 2097 2 1 19 GLU CA C -1.951 9.466 -5.073 1.00 . B B . 19 GLU CA 1 1 3 2098 2 1 19 GLU CB C -2.149 9.380 -3.553 1.00 . B B . 19 GLU CB 1 1 3 2099 2 1 19 GLU CD C -4.517 8.893 -4.254 1.00 . B B . 19 GLU CD 1 1 3 2100 2 1 19 GLU CG C -3.428 8.615 -3.212 1.00 . B B . 19 GLU CG 1 1 3 2101 2 1 19 GLU H H -2.011 7.325 -5.156 1.00 . B B . 19 GLU H 1 1 3 2102 2 1 19 GLU HA H -2.630 10.188 -5.497 1.00 . B B . 19 GLU HA 1 1 3 2103 2 1 19 GLU HB2 H -1.305 8.857 -3.116 1.00 . B B . 19 GLU HB2 1 1 3 2104 2 1 19 GLU HB3 H -2.208 10.377 -3.142 1.00 . B B . 19 GLU HB3 1 1 3 2105 2 1 19 GLU HG2 H -3.206 7.562 -3.189 1.00 . B B . 19 GLU HG2 1 1 3 2106 2 1 19 GLU HG3 H -3.776 8.925 -2.239 1.00 . B B . 19 GLU HG3 1 1 3 2107 2 1 19 GLU N N -2.172 8.129 -5.687 1.00 . B B . 19 GLU N 1 1 3 2108 2 1 19 GLU O O -0.238 10.824 -6.049 1.00 . B B . 19 GLU O 1 1 3 2109 2 1 19 GLU OE1 O -4.683 10.047 -4.613 1.00 . B B . 19 GLU OE1 1 1 3 2110 2 1 19 GLU OE2 O -5.164 7.948 -4.671 1.00 . B B . 19 GLU OE2 1 1 3 2111 2 1 20 ILE C C 2.253 9.120 -6.357 1.00 . B B . 20 ILE C 1 1 3 2112 2 1 20 ILE CA C 1.826 9.483 -4.936 1.00 . B B . 20 ILE CA 1 1 3 2113 2 1 20 ILE CB C 2.611 8.648 -3.933 1.00 . B B . 20 ILE CB 1 1 3 2114 2 1 20 ILE CD1 C 3.134 8.376 -1.507 1.00 . B B . 20 ILE CD1 1 1 3 2115 2 1 20 ILE CG1 C 2.518 9.301 -2.558 1.00 . B B . 20 ILE CG1 1 1 3 2116 2 1 20 ILE CG2 C 4.080 8.545 -4.355 1.00 . B B . 20 ILE CG2 1 1 3 2117 2 1 20 ILE H H 0.135 8.411 -4.181 1.00 . B B . 20 ILE H 1 1 3 2118 2 1 20 ILE HA H 1.992 10.528 -4.754 1.00 . B B . 20 ILE HA 1 1 3 2119 2 1 20 ILE HB H 2.169 7.664 -3.891 1.00 . B B . 20 ILE HB 1 1 3 2120 2 1 20 ILE HD11 H 4.187 8.591 -1.411 1.00 . B B . 20 ILE HD11 1 1 3 2121 2 1 20 ILE HD12 H 3.003 7.348 -1.810 1.00 . B B . 20 ILE HD12 1 1 3 2122 2 1 20 ILE HD13 H 2.646 8.536 -0.557 1.00 . B B . 20 ILE HD13 1 1 3 2123 2 1 20 ILE HG12 H 3.053 10.239 -2.574 1.00 . B B . 20 ILE HG12 1 1 3 2124 2 1 20 ILE HG13 H 1.479 9.475 -2.319 1.00 . B B . 20 ILE HG13 1 1 3 2125 2 1 20 ILE HG21 H 4.140 8.130 -5.350 1.00 . B B . 20 ILE HG21 1 1 3 2126 2 1 20 ILE HG22 H 4.609 7.906 -3.665 1.00 . B B . 20 ILE HG22 1 1 3 2127 2 1 20 ILE HG23 H 4.525 9.529 -4.349 1.00 . B B . 20 ILE HG23 1 1 3 2128 2 1 20 ILE N N 0.396 9.167 -4.754 1.00 . B B . 20 ILE N 1 1 3 2129 2 1 20 ILE O O 2.876 9.897 -7.053 1.00 . B B . 20 ILE O 1 1 3 2130 2 1 21 MET C C 1.791 8.505 -9.179 1.00 . B B . 21 MET C 1 1 3 2131 2 1 21 MET CA C 2.308 7.498 -8.147 1.00 . B B . 21 MET CA 1 1 3 2132 2 1 21 MET CB C 1.705 6.120 -8.412 1.00 . B B . 21 MET CB 1 1 3 2133 2 1 21 MET CE C 1.956 4.610 -11.604 1.00 . B B . 21 MET CE 1 1 3 2134 2 1 21 MET CG C 2.748 5.235 -9.081 1.00 . B B . 21 MET CG 1 1 3 2135 2 1 21 MET H H 1.428 7.330 -6.196 1.00 . B B . 21 MET H 1 1 3 2136 2 1 21 MET HA H 3.385 7.436 -8.214 1.00 . B B . 21 MET HA 1 1 3 2137 2 1 21 MET HB2 H 1.412 5.673 -7.471 1.00 . B B . 21 MET HB2 1 1 3 2138 2 1 21 MET HB3 H 0.844 6.216 -9.055 1.00 . B B . 21 MET HB3 1 1 3 2139 2 1 21 MET HE1 H 2.138 3.835 -12.336 1.00 . B B . 21 MET HE1 1 1 3 2140 2 1 21 MET HE2 H 2.743 5.345 -11.660 1.00 . B B . 21 MET HE2 1 1 3 2141 2 1 21 MET HE3 H 1.006 5.086 -11.805 1.00 . B B . 21 MET HE3 1 1 3 2142 2 1 21 MET HG2 H 3.317 5.824 -9.786 1.00 . B B . 21 MET HG2 1 1 3 2143 2 1 21 MET HG3 H 3.408 4.834 -8.325 1.00 . B B . 21 MET HG3 1 1 3 2144 2 1 21 MET N N 1.926 7.938 -6.782 1.00 . B B . 21 MET N 1 1 3 2145 2 1 21 MET O O 2.265 8.560 -10.297 1.00 . B B . 21 MET O 1 1 3 2146 2 1 21 MET SD S 1.924 3.877 -9.951 1.00 . B B . 21 MET SD 1 1 3 2147 2 1 22 ASN C C 0.866 11.692 -9.433 1.00 . B B . 22 ASN C 1 1 3 2148 2 1 22 ASN CA C 0.299 10.314 -9.778 1.00 . B B . 22 ASN CA 1 1 3 2149 2 1 22 ASN CB C -1.228 10.357 -9.693 1.00 . B B . 22 ASN CB 1 1 3 2150 2 1 22 ASN CG C -1.801 10.728 -11.062 1.00 . B B . 22 ASN CG 1 1 3 2151 2 1 22 ASN H H 0.462 9.258 -7.905 1.00 . B B . 22 ASN H 1 1 3 2152 2 1 22 ASN HA H 0.597 10.043 -10.780 1.00 . B B . 22 ASN HA 1 1 3 2153 2 1 22 ASN HB2 H -1.599 9.385 -9.397 1.00 . B B . 22 ASN HB2 1 1 3 2154 2 1 22 ASN HB3 H -1.527 11.097 -8.966 1.00 . B B . 22 ASN HB3 1 1 3 2155 2 1 22 ASN HD21 H -3.392 11.648 -10.303 1.00 . B B . 22 ASN HD21 1 1 3 2156 2 1 22 ASN HD22 H -3.298 11.633 -12.007 1.00 . B B . 22 ASN HD22 1 1 3 2157 2 1 22 ASN N N 0.830 9.310 -8.814 1.00 . B B . 22 ASN N 1 1 3 2158 2 1 22 ASN ND2 N -2.923 11.391 -11.130 1.00 . B B . 22 ASN ND2 1 1 3 2159 2 1 22 ASN O O 0.914 12.581 -10.260 1.00 . B B . 22 ASN O 1 1 3 2160 2 1 22 ASN OD1 O -1.220 10.413 -12.082 1.00 . B B . 22 ASN OD1 1 1 3 2161 2 1 23 SER C C 3.388 13.134 -7.889 1.00 . B B . 23 SER C 1 1 3 2162 2 1 23 SER CA C 1.862 13.192 -7.811 1.00 . B B . 23 SER CA 1 1 3 2163 2 1 23 SER CB C 1.437 13.512 -6.378 1.00 . B B . 23 SER CB 1 1 3 2164 2 1 23 SER H H 1.249 11.144 -7.564 1.00 . B B . 23 SER H 1 1 3 2165 2 1 23 SER HA H 1.495 13.962 -8.475 1.00 . B B . 23 SER HA 1 1 3 2166 2 1 23 SER HB2 H 0.363 13.480 -6.302 1.00 . B B . 23 SER HB2 1 1 3 2167 2 1 23 SER HB3 H 1.864 12.779 -5.705 1.00 . B B . 23 SER HB3 1 1 3 2168 2 1 23 SER HG H 2.818 14.879 -6.275 1.00 . B B . 23 SER HG 1 1 3 2169 2 1 23 SER N N 1.297 11.875 -8.214 1.00 . B B . 23 SER N 1 1 3 2170 2 1 23 SER O O 4.002 14.189 -7.910 1.00 . B B . 23 SER O 1 1 3 2171 2 1 23 SER OXT O 3.918 12.036 -7.927 1.00 . B B . 23 SER OXT 1 1 3 2172 2 1 23 SER OG O 1.891 14.813 -6.031 1.00 . B B . 23 SER OG 1 1 4 2173 1 1 1 GLY C C -7.411 12.845 3.278 1.00 . A A . 1 GLY C 1 1 4 2174 1 1 1 GLY CA C -8.575 13.814 3.495 1.00 . A A . 1 GLY CA 1 1 4 2175 1 1 1 GLY H1 H -10.507 13.658 4.258 1.00 . A A . 1 GLY H1 1 1 4 2176 1 1 1 GLY H2 H -9.594 12.231 4.385 1.00 . A A . 1 GLY H2 1 1 4 2177 1 1 1 GLY H3 H -10.229 12.705 2.882 1.00 . A A . 1 GLY H3 1 1 4 2178 1 1 1 GLY HA2 H -8.716 14.414 2.607 1.00 . A A . 1 GLY HA2 1 1 4 2179 1 1 1 GLY HA3 H -8.351 14.457 4.332 1.00 . A A . 1 GLY HA3 1 1 4 2180 1 1 1 GLY N N -9.820 13.044 3.776 1.00 . A A . 1 GLY N 1 1 4 2181 1 1 1 GLY O O -7.458 11.701 3.687 1.00 . A A . 1 GLY O 1 1 4 2182 1 1 2 ILE C C -4.283 12.409 3.615 1.00 . A A . 2 ILE C 1 1 4 2183 1 1 2 ILE CA C -5.201 12.397 2.391 1.00 . A A . 2 ILE CA 1 1 4 2184 1 1 2 ILE CB C -4.425 12.891 1.170 1.00 . A A . 2 ILE CB 1 1 4 2185 1 1 2 ILE CD1 C -2.587 12.178 -0.367 1.00 . A A . 2 ILE CD1 1 1 4 2186 1 1 2 ILE CG1 C -3.092 12.148 1.077 1.00 . A A . 2 ILE CG1 1 1 4 2187 1 1 2 ILE CG2 C -4.165 14.391 1.308 1.00 . A A . 2 ILE CG2 1 1 4 2188 1 1 2 ILE H H -6.348 14.218 2.313 1.00 . A A . 2 ILE H 1 1 4 2189 1 1 2 ILE HA H -5.549 11.390 2.213 1.00 . A A . 2 ILE HA 1 1 4 2190 1 1 2 ILE HB H -5.006 12.708 0.276 1.00 . A A . 2 ILE HB 1 1 4 2191 1 1 2 ILE HD11 H -3.391 12.476 -1.023 1.00 . A A . 2 ILE HD11 1 1 4 2192 1 1 2 ILE HD12 H -2.239 11.195 -0.647 1.00 . A A . 2 ILE HD12 1 1 4 2193 1 1 2 ILE HD13 H -1.775 12.885 -0.449 1.00 . A A . 2 ILE HD13 1 1 4 2194 1 1 2 ILE HG12 H -2.368 12.626 1.721 1.00 . A A . 2 ILE HG12 1 1 4 2195 1 1 2 ILE HG13 H -3.229 11.122 1.386 1.00 . A A . 2 ILE HG13 1 1 4 2196 1 1 2 ILE HG21 H -4.827 14.934 0.650 1.00 . A A . 2 ILE HG21 1 1 4 2197 1 1 2 ILE HG22 H -3.139 14.604 1.042 1.00 . A A . 2 ILE HG22 1 1 4 2198 1 1 2 ILE HG23 H -4.342 14.695 2.329 1.00 . A A . 2 ILE HG23 1 1 4 2199 1 1 2 ILE N N -6.366 13.293 2.635 1.00 . A A . 2 ILE N 1 1 4 2200 1 1 2 ILE O O -3.573 13.364 3.864 1.00 . A A . 2 ILE O 1 1 4 2201 1 1 3 GLY C C -3.038 9.840 5.867 1.00 . A A . 3 GLY C 1 1 4 2202 1 1 3 GLY CA C -3.417 11.293 5.588 1.00 . A A . 3 GLY CA 1 1 4 2203 1 1 3 GLY H H -4.866 10.593 4.157 1.00 . A A . 3 GLY H 1 1 4 2204 1 1 3 GLY HA2 H -2.521 11.872 5.410 1.00 . A A . 3 GLY HA2 1 1 4 2205 1 1 3 GLY HA3 H -3.946 11.696 6.437 1.00 . A A . 3 GLY HA3 1 1 4 2206 1 1 3 GLY N N -4.289 11.352 4.379 1.00 . A A . 3 GLY N 1 1 4 2207 1 1 3 GLY O O -2.609 9.491 6.949 1.00 . A A . 3 GLY O 1 1 4 2208 1 1 4 LYS C C -2.091 7.084 3.829 1.00 . A A . 4 LYS C 1 1 4 2209 1 1 4 LYS CA C -2.847 7.556 5.068 1.00 . A A . 4 LYS CA 1 1 4 2210 1 1 4 LYS CB C -4.131 6.740 5.208 1.00 . A A . 4 LYS CB 1 1 4 2211 1 1 4 LYS CD C -4.021 5.049 7.039 1.00 . A A . 4 LYS CD 1 1 4 2212 1 1 4 LYS CE C -5.336 4.290 7.227 1.00 . A A . 4 LYS CE 1 1 4 2213 1 1 4 LYS CG C -3.782 5.293 5.548 1.00 . A A . 4 LYS CG 1 1 4 2214 1 1 4 LYS H H -3.538 9.305 4.028 1.00 . A A . 4 LYS H 1 1 4 2215 1 1 4 LYS HA H -2.233 7.430 5.946 1.00 . A A . 4 LYS HA 1 1 4 2216 1 1 4 LYS HB2 H -4.742 7.161 5.992 1.00 . A A . 4 LYS HB2 1 1 4 2217 1 1 4 LYS HB3 H -4.672 6.765 4.272 1.00 . A A . 4 LYS HB3 1 1 4 2218 1 1 4 LYS HD2 H -3.206 4.467 7.445 1.00 . A A . 4 LYS HD2 1 1 4 2219 1 1 4 LYS HD3 H -4.079 5.997 7.554 1.00 . A A . 4 LYS HD3 1 1 4 2220 1 1 4 LYS HE2 H -6.141 4.844 6.767 1.00 . A A . 4 LYS HE2 1 1 4 2221 1 1 4 LYS HE3 H -5.259 3.317 6.765 1.00 . A A . 4 LYS HE3 1 1 4 2222 1 1 4 LYS HG2 H -4.404 4.628 4.968 1.00 . A A . 4 LYS HG2 1 1 4 2223 1 1 4 LYS HG3 H -2.744 5.108 5.317 1.00 . A A . 4 LYS HG3 1 1 4 2224 1 1 4 LYS HZ1 H -4.721 4.189 9.213 1.00 . A A . 4 LYS HZ1 1 1 4 2225 1 1 4 LYS HZ2 H -6.055 3.201 8.849 1.00 . A A . 4 LYS HZ2 1 1 4 2226 1 1 4 LYS HZ3 H -6.255 4.881 8.999 1.00 . A A . 4 LYS HZ3 1 1 4 2227 1 1 4 LYS N N -3.194 8.992 4.890 1.00 . A A . 4 LYS N 1 1 4 2228 1 1 4 LYS NZ N -5.612 4.129 8.682 1.00 . A A . 4 LYS NZ 1 1 4 2229 1 1 4 LYS O O -1.118 6.359 3.911 1.00 . A A . 4 LYS O 1 1 4 2230 1 1 5 TYR C C -0.523 7.779 1.305 1.00 . A A . 5 TYR C 1 1 4 2231 1 1 5 TYR CA C -1.883 7.100 1.416 1.00 . A A . 5 TYR CA 1 1 4 2232 1 1 5 TYR CB C -2.769 7.537 0.260 1.00 . A A . 5 TYR CB 1 1 4 2233 1 1 5 TYR CD1 C -4.639 5.909 0.737 1.00 . A A . 5 TYR CD1 1 1 4 2234 1 1 5 TYR CD2 C -5.116 8.289 0.759 1.00 . A A . 5 TYR CD2 1 1 4 2235 1 1 5 TYR CE1 C -5.977 5.640 1.047 1.00 . A A . 5 TYR CE1 1 1 4 2236 1 1 5 TYR CE2 C -6.453 8.018 1.070 1.00 . A A . 5 TYR CE2 1 1 4 2237 1 1 5 TYR CG C -4.209 7.237 0.593 1.00 . A A . 5 TYR CG 1 1 4 2238 1 1 5 TYR CZ C -6.883 6.694 1.214 1.00 . A A . 5 TYR CZ 1 1 4 2239 1 1 5 TYR H H -3.327 8.080 2.649 1.00 . A A . 5 TYR H 1 1 4 2240 1 1 5 TYR HA H -1.757 6.035 1.384 1.00 . A A . 5 TYR HA 1 1 4 2241 1 1 5 TYR HB2 H -2.649 8.598 0.095 1.00 . A A . 5 TYR HB2 1 1 4 2242 1 1 5 TYR HB3 H -2.488 7.000 -0.619 1.00 . A A . 5 TYR HB3 1 1 4 2243 1 1 5 TYR HD1 H -3.940 5.091 0.609 1.00 . A A . 5 TYR HD1 1 1 4 2244 1 1 5 TYR HD2 H -4.783 9.310 0.648 1.00 . A A . 5 TYR HD2 1 1 4 2245 1 1 5 TYR HE1 H -6.310 4.618 1.159 1.00 . A A . 5 TYR HE1 1 1 4 2246 1 1 5 TYR HE2 H -7.151 8.832 1.199 1.00 . A A . 5 TYR HE2 1 1 4 2247 1 1 5 TYR HH H -8.583 5.935 0.789 1.00 . A A . 5 TYR HH 1 1 4 2248 1 1 5 TYR N N -2.541 7.498 2.681 1.00 . A A . 5 TYR N 1 1 4 2249 1 1 5 TYR O O 0.368 7.304 0.630 1.00 . A A . 5 TYR O 1 1 4 2250 1 1 5 TYR OH O -8.203 6.427 1.520 1.00 . A A . 5 TYR OH 1 1 4 2251 1 1 6 LEU C C 1.630 9.533 3.247 1.00 . A A . 6 LEU C 1 1 4 2252 1 1 6 LEU CA C 0.945 9.603 1.892 1.00 . A A . 6 LEU CA 1 1 4 2253 1 1 6 LEU CB C 0.687 11.067 1.534 1.00 . A A . 6 LEU CB 1 1 4 2254 1 1 6 LEU CD1 C 1.909 11.439 -0.609 1.00 . A A . 6 LEU CD1 1 1 4 2255 1 1 6 LEU CD2 C -0.123 9.977 -0.586 1.00 . A A . 6 LEU CD2 1 1 4 2256 1 1 6 LEU CG C 0.531 11.229 0.019 1.00 . A A . 6 LEU CG 1 1 4 2257 1 1 6 LEU H H -1.089 9.258 2.500 1.00 . A A . 6 LEU H 1 1 4 2258 1 1 6 LEU HA H 1.570 9.144 1.141 1.00 . A A . 6 LEU HA 1 1 4 2259 1 1 6 LEU HB2 H -0.219 11.398 2.023 1.00 . A A . 6 LEU HB2 1 1 4 2260 1 1 6 LEU HB3 H 1.516 11.670 1.873 1.00 . A A . 6 LEU HB3 1 1 4 2261 1 1 6 LEU HD11 H 2.446 12.191 -0.052 1.00 . A A . 6 LEU HD11 1 1 4 2262 1 1 6 LEU HD12 H 1.791 11.765 -1.633 1.00 . A A . 6 LEU HD12 1 1 4 2263 1 1 6 LEU HD13 H 2.459 10.512 -0.584 1.00 . A A . 6 LEU HD13 1 1 4 2264 1 1 6 LEU HD21 H -0.251 10.116 -1.649 1.00 . A A . 6 LEU HD21 1 1 4 2265 1 1 6 LEU HD22 H -1.086 9.817 -0.124 1.00 . A A . 6 LEU HD22 1 1 4 2266 1 1 6 LEU HD23 H 0.510 9.118 -0.407 1.00 . A A . 6 LEU HD23 1 1 4 2267 1 1 6 LEU HG H -0.087 12.092 -0.179 1.00 . A A . 6 LEU HG 1 1 4 2268 1 1 6 LEU N N -0.356 8.890 1.961 1.00 . A A . 6 LEU N 1 1 4 2269 1 1 6 LEU O O 2.482 10.337 3.568 1.00 . A A . 6 LEU O 1 1 4 2270 1 1 7 HIS C C 1.851 7.049 5.903 1.00 . A A . 7 HIS C 1 1 4 2271 1 1 7 HIS CA C 1.868 8.499 5.409 1.00 . A A . 7 HIS CA 1 1 4 2272 1 1 7 HIS CB C 1.084 9.396 6.376 1.00 . A A . 7 HIS CB 1 1 4 2273 1 1 7 HIS CD2 C -0.565 10.593 4.719 1.00 . A A . 7 HIS CD2 1 1 4 2274 1 1 7 HIS CE1 C 0.278 12.585 4.801 1.00 . A A . 7 HIS CE1 1 1 4 2275 1 1 7 HIS CG C 0.485 10.542 5.601 1.00 . A A . 7 HIS CG 1 1 4 2276 1 1 7 HIS H H 0.544 7.969 3.788 1.00 . A A . 7 HIS H 1 1 4 2277 1 1 7 HIS HA H 2.889 8.844 5.356 1.00 . A A . 7 HIS HA 1 1 4 2278 1 1 7 HIS HB2 H 0.296 8.823 6.844 1.00 . A A . 7 HIS HB2 1 1 4 2279 1 1 7 HIS HB3 H 1.750 9.782 7.134 1.00 . A A . 7 HIS HB3 1 1 4 2280 1 1 7 HIS HD1 H 1.770 12.124 6.182 1.00 . A A . 7 HIS HD1 1 1 4 2281 1 1 7 HIS HD2 H -1.188 9.755 4.447 1.00 . A A . 7 HIS HD2 1 1 4 2282 1 1 7 HIS HE1 H 0.466 13.631 4.611 1.00 . A A . 7 HIS HE1 1 1 4 2283 1 1 7 HIS N N 1.248 8.593 4.059 1.00 . A A . 7 HIS N 1 1 4 2284 1 1 7 HIS ND1 N 1.008 11.825 5.642 1.00 . A A . 7 HIS ND1 1 1 4 2285 1 1 7 HIS NE2 N -0.693 11.883 4.215 1.00 . A A . 7 HIS NE2 1 1 4 2286 1 1 7 HIS O O 2.699 6.645 6.673 1.00 . A A . 7 HIS O 1 1 4 2287 1 1 8 SER C C 0.719 3.895 4.763 1.00 . A A . 8 SER C 1 1 4 2288 1 1 8 SER CA C 0.871 4.843 5.948 1.00 . A A . 8 SER CA 1 1 4 2289 1 1 8 SER CB C -0.301 4.653 6.910 1.00 . A A . 8 SER CB 1 1 4 2290 1 1 8 SER H H 0.217 6.582 4.859 1.00 . A A . 8 SER H 1 1 4 2291 1 1 8 SER HA H 1.795 4.622 6.454 1.00 . A A . 8 SER HA 1 1 4 2292 1 1 8 SER HB2 H -0.964 5.499 6.843 1.00 . A A . 8 SER HB2 1 1 4 2293 1 1 8 SER HB3 H -0.841 3.755 6.642 1.00 . A A . 8 SER HB3 1 1 4 2294 1 1 8 SER HG H 1.075 4.169 8.197 1.00 . A A . 8 SER HG 1 1 4 2295 1 1 8 SER N N 0.902 6.255 5.478 1.00 . A A . 8 SER N 1 1 4 2296 1 1 8 SER O O 0.728 2.690 4.919 1.00 . A A . 8 SER O 1 1 4 2297 1 1 8 SER OG O 0.194 4.547 8.238 1.00 . A A . 8 SER OG 1 1 4 2298 1 1 9 ALA C C 1.829 3.257 1.814 1.00 . A A . 9 ALA C 1 1 4 2299 1 1 9 ALA CA C 0.452 3.521 2.401 1.00 . A A . 9 ALA CA 1 1 4 2300 1 1 9 ALA CB C -0.416 4.183 1.339 1.00 . A A . 9 ALA CB 1 1 4 2301 1 1 9 ALA H H 0.592 5.389 3.464 1.00 . A A . 9 ALA H 1 1 4 2302 1 1 9 ALA HA H 0.003 2.588 2.706 1.00 . A A . 9 ALA HA 1 1 4 2303 1 1 9 ALA HB1 H -0.402 3.576 0.448 1.00 . A A . 9 ALA HB1 1 1 4 2304 1 1 9 ALA HB2 H -0.028 5.171 1.112 1.00 . A A . 9 ALA HB2 1 1 4 2305 1 1 9 ALA HB3 H -1.428 4.265 1.702 1.00 . A A . 9 ALA HB3 1 1 4 2306 1 1 9 ALA N N 0.590 4.416 3.579 1.00 . A A . 9 ALA N 1 1 4 2307 1 1 9 ALA O O 2.299 2.140 1.794 1.00 . A A . 9 ALA O 1 1 4 2308 1 1 10 LYS C C 4.627 3.051 1.493 1.00 . A A . 10 LYS C 1 1 4 2309 1 1 10 LYS CA C 3.829 4.108 0.722 1.00 . A A . 10 LYS CA 1 1 4 2310 1 1 10 LYS CB C 4.587 5.433 0.768 1.00 . A A . 10 LYS CB 1 1 4 2311 1 1 10 LYS CD C 6.364 6.530 -0.602 1.00 . A A . 10 LYS CD 1 1 4 2312 1 1 10 LYS CE C 6.271 7.765 0.296 1.00 . A A . 10 LYS CE 1 1 4 2313 1 1 10 LYS CG C 5.003 5.831 -0.648 1.00 . A A . 10 LYS CG 1 1 4 2314 1 1 10 LYS H H 2.052 5.179 1.351 1.00 . A A . 10 LYS H 1 1 4 2315 1 1 10 LYS HA H 3.723 3.795 -0.304 1.00 . A A . 10 LYS HA 1 1 4 2316 1 1 10 LYS HB2 H 3.950 6.199 1.188 1.00 . A A . 10 LYS HB2 1 1 4 2317 1 1 10 LYS HB3 H 5.467 5.319 1.381 1.00 . A A . 10 LYS HB3 1 1 4 2318 1 1 10 LYS HD2 H 7.103 5.850 -0.206 1.00 . A A . 10 LYS HD2 1 1 4 2319 1 1 10 LYS HD3 H 6.647 6.832 -1.599 1.00 . A A . 10 LYS HD3 1 1 4 2320 1 1 10 LYS HE2 H 5.425 8.365 -0.003 1.00 . A A . 10 LYS HE2 1 1 4 2321 1 1 10 LYS HE3 H 6.148 7.454 1.323 1.00 . A A . 10 LYS HE3 1 1 4 2322 1 1 10 LYS HG2 H 5.072 4.947 -1.264 1.00 . A A . 10 LYS HG2 1 1 4 2323 1 1 10 LYS HG3 H 4.269 6.503 -1.064 1.00 . A A . 10 LYS HG3 1 1 4 2324 1 1 10 LYS HZ1 H 7.714 9.055 1.062 1.00 . A A . 10 LYS HZ1 1 1 4 2325 1 1 10 LYS HZ2 H 7.402 9.269 -0.594 1.00 . A A . 10 LYS HZ2 1 1 4 2326 1 1 10 LYS HZ3 H 8.315 7.937 -0.064 1.00 . A A . 10 LYS HZ3 1 1 4 2327 1 1 10 LYS N N 2.472 4.284 1.327 1.00 . A A . 10 LYS N 1 1 4 2328 1 1 10 LYS NZ N 7.520 8.567 0.165 1.00 . A A . 10 LYS NZ 1 1 4 2329 1 1 10 LYS O O 5.240 2.181 0.909 1.00 . A A . 10 LYS O 1 1 4 2330 1 1 11 LYS C C 5.010 0.705 3.111 1.00 . A A . 11 LYS C 1 1 4 2331 1 1 11 LYS CA C 5.394 2.105 3.584 1.00 . A A . 11 LYS CA 1 1 4 2332 1 1 11 LYS CB C 5.064 2.250 5.071 1.00 . A A . 11 LYS CB 1 1 4 2333 1 1 11 LYS CD C 4.757 3.988 6.839 1.00 . A A . 11 LYS CD 1 1 4 2334 1 1 11 LYS CE C 5.595 3.636 8.068 1.00 . A A . 11 LYS CE 1 1 4 2335 1 1 11 LYS CG C 5.528 3.620 5.569 1.00 . A A . 11 LYS CG 1 1 4 2336 1 1 11 LYS H H 4.128 3.823 3.259 1.00 . A A . 11 LYS H 1 1 4 2337 1 1 11 LYS HA H 6.453 2.256 3.429 1.00 . A A . 11 LYS HA 1 1 4 2338 1 1 11 LYS HB2 H 3.996 2.158 5.211 1.00 . A A . 11 LYS HB2 1 1 4 2339 1 1 11 LYS HB3 H 5.569 1.476 5.628 1.00 . A A . 11 LYS HB3 1 1 4 2340 1 1 11 LYS HD2 H 4.547 5.049 6.836 1.00 . A A . 11 LYS HD2 1 1 4 2341 1 1 11 LYS HD3 H 3.828 3.438 6.868 1.00 . A A . 11 LYS HD3 1 1 4 2342 1 1 11 LYS HE2 H 5.176 2.766 8.553 1.00 . A A . 11 LYS HE2 1 1 4 2343 1 1 11 LYS HE3 H 6.610 3.424 7.765 1.00 . A A . 11 LYS HE3 1 1 4 2344 1 1 11 LYS HG2 H 6.585 3.584 5.787 1.00 . A A . 11 LYS HG2 1 1 4 2345 1 1 11 LYS HG3 H 5.343 4.363 4.809 1.00 . A A . 11 LYS HG3 1 1 4 2346 1 1 11 LYS HZ1 H 6.407 5.397 8.828 1.00 . A A . 11 LYS HZ1 1 1 4 2347 1 1 11 LYS HZ2 H 5.644 4.425 9.995 1.00 . A A . 11 LYS HZ2 1 1 4 2348 1 1 11 LYS HZ3 H 4.714 5.331 8.898 1.00 . A A . 11 LYS HZ3 1 1 4 2349 1 1 11 LYS N N 4.628 3.115 2.798 1.00 . A A . 11 LYS N 1 1 4 2350 1 1 11 LYS NZ N 5.590 4.784 9.019 1.00 . A A . 11 LYS NZ 1 1 4 2351 1 1 11 LYS O O 5.814 -0.014 2.552 1.00 . A A . 11 LYS O 1 1 4 2352 1 1 12 PHE C C 3.277 -1.026 1.341 1.00 . A A . 12 PHE C 1 1 4 2353 1 1 12 PHE CA C 3.354 -1.034 2.866 1.00 . A A . 12 PHE CA 1 1 4 2354 1 1 12 PHE CB C 1.978 -1.359 3.454 1.00 . A A . 12 PHE CB 1 1 4 2355 1 1 12 PHE CD1 C 3.081 -1.003 5.691 1.00 . A A . 12 PHE CD1 1 1 4 2356 1 1 12 PHE CD2 C 0.741 -0.417 5.438 1.00 . A A . 12 PHE CD2 1 1 4 2357 1 1 12 PHE CE1 C 3.039 -0.593 7.029 1.00 . A A . 12 PHE CE1 1 1 4 2358 1 1 12 PHE CE2 C 0.699 -0.006 6.776 1.00 . A A . 12 PHE CE2 1 1 4 2359 1 1 12 PHE CG C 1.932 -0.916 4.896 1.00 . A A . 12 PHE CG 1 1 4 2360 1 1 12 PHE CZ C 1.848 -0.094 7.571 1.00 . A A . 12 PHE CZ 1 1 4 2361 1 1 12 PHE H H 3.146 0.912 3.762 1.00 . A A . 12 PHE H 1 1 4 2362 1 1 12 PHE HA H 4.072 -1.772 3.190 1.00 . A A . 12 PHE HA 1 1 4 2363 1 1 12 PHE HB2 H 1.213 -0.840 2.891 1.00 . A A . 12 PHE HB2 1 1 4 2364 1 1 12 PHE HB3 H 1.805 -2.427 3.401 1.00 . A A . 12 PHE HB3 1 1 4 2365 1 1 12 PHE HD1 H 3.999 -1.388 5.273 1.00 . A A . 12 PHE HD1 1 1 4 2366 1 1 12 PHE HD2 H -0.146 -0.349 4.824 1.00 . A A . 12 PHE HD2 1 1 4 2367 1 1 12 PHE HE1 H 3.925 -0.659 7.642 1.00 . A A . 12 PHE HE1 1 1 4 2368 1 1 12 PHE HE2 H -0.219 0.379 7.194 1.00 . A A . 12 PHE HE2 1 1 4 2369 1 1 12 PHE HZ H 1.817 0.223 8.603 1.00 . A A . 12 PHE HZ 1 1 4 2370 1 1 12 PHE N N 3.784 0.315 3.319 1.00 . A A . 12 PHE N 1 1 4 2371 1 1 12 PHE O O 3.360 -2.050 0.696 1.00 . A A . 12 PHE O 1 1 4 2372 1 1 13 GLY C C 4.264 -0.475 -1.328 1.00 . A A . 13 GLY C 1 1 4 2373 1 1 13 GLY CA C 3.048 0.222 -0.723 1.00 . A A . 13 GLY CA 1 1 4 2374 1 1 13 GLY H H 3.064 0.947 1.302 1.00 . A A . 13 GLY H 1 1 4 2375 1 1 13 GLY HA2 H 2.145 -0.253 -1.071 1.00 . A A . 13 GLY HA2 1 1 4 2376 1 1 13 GLY HA3 H 3.048 1.259 -1.022 1.00 . A A . 13 GLY HA3 1 1 4 2377 1 1 13 GLY N N 3.125 0.132 0.760 1.00 . A A . 13 GLY N 1 1 4 2378 1 1 13 GLY O O 4.186 -1.085 -2.377 1.00 . A A . 13 GLY O 1 1 4 2379 1 1 14 LYS C C 6.751 -2.451 -0.664 1.00 . A A . 14 LYS C 1 1 4 2380 1 1 14 LYS CA C 6.614 -1.030 -1.219 1.00 . A A . 14 LYS CA 1 1 4 2381 1 1 14 LYS CB C 7.838 -0.208 -0.815 1.00 . A A . 14 LYS CB 1 1 4 2382 1 1 14 LYS CD C 9.252 1.728 -1.519 1.00 . A A . 14 LYS CD 1 1 4 2383 1 1 14 LYS CE C 9.954 1.629 -2.874 1.00 . A A . 14 LYS CE 1 1 4 2384 1 1 14 LYS CG C 7.864 1.095 -1.616 1.00 . A A . 14 LYS CG 1 1 4 2385 1 1 14 LYS H H 5.430 0.126 0.164 1.00 . A A . 14 LYS H 1 1 4 2386 1 1 14 LYS HA H 6.548 -1.072 -2.296 1.00 . A A . 14 LYS HA 1 1 4 2387 1 1 14 LYS HB2 H 7.786 0.019 0.242 1.00 . A A . 14 LYS HB2 1 1 4 2388 1 1 14 LYS HB3 H 8.736 -0.773 -1.019 1.00 . A A . 14 LYS HB3 1 1 4 2389 1 1 14 LYS HD2 H 9.155 2.767 -1.237 1.00 . A A . 14 LYS HD2 1 1 4 2390 1 1 14 LYS HD3 H 9.835 1.206 -0.774 1.00 . A A . 14 LYS HD3 1 1 4 2391 1 1 14 LYS HE2 H 10.049 0.590 -3.154 1.00 . A A . 14 LYS HE2 1 1 4 2392 1 1 14 LYS HE3 H 9.373 2.153 -3.619 1.00 . A A . 14 LYS HE3 1 1 4 2393 1 1 14 LYS HG2 H 7.634 0.884 -2.651 1.00 . A A . 14 LYS HG2 1 1 4 2394 1 1 14 LYS HG3 H 7.129 1.777 -1.216 1.00 . A A . 14 LYS HG3 1 1 4 2395 1 1 14 LYS HZ1 H 12.016 1.585 -3.160 1.00 . A A . 14 LYS HZ1 1 1 4 2396 1 1 14 LYS HZ2 H 11.527 2.448 -1.781 1.00 . A A . 14 LYS HZ2 1 1 4 2397 1 1 14 LYS HZ3 H 11.328 3.127 -3.327 1.00 . A A . 14 LYS HZ3 1 1 4 2398 1 1 14 LYS N N 5.389 -0.381 -0.678 1.00 . A A . 14 LYS N 1 1 4 2399 1 1 14 LYS NZ N 11.308 2.243 -2.778 1.00 . A A . 14 LYS NZ 1 1 4 2400 1 1 14 LYS O O 7.338 -3.313 -1.287 1.00 . A A . 14 LYS O 1 1 4 2401 1 1 15 ALA C C 5.126 -4.918 0.687 1.00 . A A . 15 ALA C 1 1 4 2402 1 1 15 ALA CA C 6.340 -4.075 1.085 1.00 . A A . 15 ALA CA 1 1 4 2403 1 1 15 ALA CB C 6.408 -3.976 2.608 1.00 . A A . 15 ALA CB 1 1 4 2404 1 1 15 ALA H H 5.757 -1.999 0.996 1.00 . A A . 15 ALA H 1 1 4 2405 1 1 15 ALA HA H 7.240 -4.544 0.716 1.00 . A A . 15 ALA HA 1 1 4 2406 1 1 15 ALA HB1 H 6.896 -3.055 2.889 1.00 . A A . 15 ALA HB1 1 1 4 2407 1 1 15 ALA HB2 H 6.966 -4.814 2.998 1.00 . A A . 15 ALA HB2 1 1 4 2408 1 1 15 ALA HB3 H 5.406 -3.991 3.014 1.00 . A A . 15 ALA HB3 1 1 4 2409 1 1 15 ALA N N 6.223 -2.707 0.502 1.00 . A A . 15 ALA N 1 1 4 2410 1 1 15 ALA O O 5.257 -6.045 0.254 1.00 . A A . 15 ALA O 1 1 4 2411 1 1 16 TRP C C 2.780 -5.525 -1.008 1.00 . A A . 16 TRP C 1 1 4 2412 1 1 16 TRP CA C 2.726 -5.150 0.474 1.00 . A A . 16 TRP CA 1 1 4 2413 1 1 16 TRP CB C 1.487 -4.292 0.787 1.00 . A A . 16 TRP CB 1 1 4 2414 1 1 16 TRP CD1 C 1.017 -2.205 -0.572 1.00 . A A . 16 TRP CD1 1 1 4 2415 1 1 16 TRP CD2 C 0.468 -4.088 -1.649 1.00 . A A . 16 TRP CD2 1 1 4 2416 1 1 16 TRP CE2 C 0.166 -3.024 -2.528 1.00 . A A . 16 TRP CE2 1 1 4 2417 1 1 16 TRP CE3 C 0.217 -5.392 -2.074 1.00 . A A . 16 TRP CE3 1 1 4 2418 1 1 16 TRP CG C 1.018 -3.547 -0.427 1.00 . A A . 16 TRP CG 1 1 4 2419 1 1 16 TRP CH2 C -0.619 -4.566 -4.203 1.00 . A A . 16 TRP CH2 1 1 4 2420 1 1 16 TRP CZ2 C -0.373 -3.254 -3.793 1.00 . A A . 16 TRP CZ2 1 1 4 2421 1 1 16 TRP CZ3 C -0.325 -5.633 -3.341 1.00 . A A . 16 TRP CZ3 1 1 4 2422 1 1 16 TRP H H 3.861 -3.475 1.187 1.00 . A A . 16 TRP H 1 1 4 2423 1 1 16 TRP HA H 2.687 -6.054 1.064 1.00 . A A . 16 TRP HA 1 1 4 2424 1 1 16 TRP HB2 H 0.691 -4.933 1.135 1.00 . A A . 16 TRP HB2 1 1 4 2425 1 1 16 TRP HB3 H 1.734 -3.584 1.565 1.00 . A A . 16 TRP HB3 1 1 4 2426 1 1 16 TRP HD1 H 1.355 -1.494 0.162 1.00 . A A . 16 TRP HD1 1 1 4 2427 1 1 16 TRP HE1 H 0.423 -0.987 -2.186 1.00 . A A . 16 TRP HE1 1 1 4 2428 1 1 16 TRP HE3 H 0.439 -6.216 -1.411 1.00 . A A . 16 TRP HE3 1 1 4 2429 1 1 16 TRP HH2 H -1.036 -4.760 -5.181 1.00 . A A . 16 TRP HH2 1 1 4 2430 1 1 16 TRP HZ2 H -0.596 -2.425 -4.449 1.00 . A A . 16 TRP HZ2 1 1 4 2431 1 1 16 TRP HZ3 H -0.512 -6.642 -3.654 1.00 . A A . 16 TRP HZ3 1 1 4 2432 1 1 16 TRP N N 3.946 -4.383 0.835 1.00 . A A . 16 TRP N 1 1 4 2433 1 1 16 TRP NE1 N 0.521 -1.892 -1.826 1.00 . A A . 16 TRP NE1 1 1 4 2434 1 1 16 TRP O O 2.464 -6.633 -1.391 1.00 . A A . 16 TRP O 1 1 4 2435 1 1 17 VAL C C 4.352 -5.968 -3.509 1.00 . A A . 17 VAL C 1 1 4 2436 1 1 17 VAL CA C 3.228 -4.954 -3.296 1.00 . A A . 17 VAL CA 1 1 4 2437 1 1 17 VAL CB C 3.454 -3.670 -4.118 1.00 . A A . 17 VAL CB 1 1 4 2438 1 1 17 VAL CG1 C 4.937 -3.483 -4.465 1.00 . A A . 17 VAL CG1 1 1 4 2439 1 1 17 VAL CG2 C 2.635 -3.757 -5.407 1.00 . A A . 17 VAL CG2 1 1 4 2440 1 1 17 VAL H H 3.419 -3.722 -1.540 1.00 . A A . 17 VAL H 1 1 4 2441 1 1 17 VAL HA H 2.291 -5.410 -3.583 1.00 . A A . 17 VAL HA 1 1 4 2442 1 1 17 VAL HB H 3.120 -2.819 -3.542 1.00 . A A . 17 VAL HB 1 1 4 2443 1 1 17 VAL HG11 H 5.043 -2.660 -5.156 1.00 . A A . 17 VAL HG11 1 1 4 2444 1 1 17 VAL HG12 H 5.319 -4.386 -4.919 1.00 . A A . 17 VAL HG12 1 1 4 2445 1 1 17 VAL HG13 H 5.493 -3.271 -3.565 1.00 . A A . 17 VAL HG13 1 1 4 2446 1 1 17 VAL HG21 H 1.819 -4.452 -5.265 1.00 . A A . 17 VAL HG21 1 1 4 2447 1 1 17 VAL HG22 H 3.268 -4.100 -6.212 1.00 . A A . 17 VAL HG22 1 1 4 2448 1 1 17 VAL HG23 H 2.240 -2.782 -5.649 1.00 . A A . 17 VAL HG23 1 1 4 2449 1 1 17 VAL N N 3.169 -4.617 -1.852 1.00 . A A . 17 VAL N 1 1 4 2450 1 1 17 VAL O O 4.147 -7.032 -4.058 1.00 . A A . 17 VAL O 1 1 4 2451 1 1 18 GLY C C 6.165 -7.997 -2.618 1.00 . A A . 18 GLY C 1 1 4 2452 1 1 18 GLY CA C 6.637 -6.656 -3.185 1.00 . A A . 18 GLY CA 1 1 4 2453 1 1 18 GLY H H 5.678 -4.831 -2.563 1.00 . A A . 18 GLY H 1 1 4 2454 1 1 18 GLY HA2 H 6.885 -6.767 -4.233 1.00 . A A . 18 GLY HA2 1 1 4 2455 1 1 18 GLY HA3 H 7.503 -6.319 -2.638 1.00 . A A . 18 GLY HA3 1 1 4 2456 1 1 18 GLY N N 5.531 -5.675 -3.038 1.00 . A A . 18 GLY N 1 1 4 2457 1 1 18 GLY O O 6.734 -9.035 -2.884 1.00 . A A . 18 GLY O 1 1 4 2458 1 1 19 GLU C C 3.601 -9.827 -2.264 1.00 . A A . 19 GLU C 1 1 4 2459 1 1 19 GLU CA C 4.566 -9.215 -1.260 1.00 . A A . 19 GLU CA 1 1 4 2460 1 1 19 GLU CB C 3.817 -8.853 0.031 1.00 . A A . 19 GLU CB 1 1 4 2461 1 1 19 GLU CD C 3.287 -11.294 0.150 1.00 . A A . 19 GLU CD 1 1 4 2462 1 1 19 GLU CG C 2.726 -9.881 0.324 1.00 . A A . 19 GLU CG 1 1 4 2463 1 1 19 GLU H H 4.663 -7.131 -1.650 1.00 . A A . 19 GLU H 1 1 4 2464 1 1 19 GLU HA H 5.363 -9.907 -1.048 1.00 . A A . 19 GLU HA 1 1 4 2465 1 1 19 GLU HB2 H 4.513 -8.824 0.855 1.00 . A A . 19 GLU HB2 1 1 4 2466 1 1 19 GLU HB3 H 3.357 -7.881 -0.090 1.00 . A A . 19 GLU HB3 1 1 4 2467 1 1 19 GLU HG2 H 2.374 -9.751 1.336 1.00 . A A . 19 GLU HG2 1 1 4 2468 1 1 19 GLU HG3 H 1.908 -9.731 -0.365 1.00 . A A . 19 GLU HG3 1 1 4 2469 1 1 19 GLU N N 5.110 -7.973 -1.843 1.00 . A A . 19 GLU N 1 1 4 2470 1 1 19 GLU O O 3.882 -10.832 -2.885 1.00 . A A . 19 GLU O 1 1 4 2471 1 1 19 GLU OE1 O 4.385 -11.536 0.622 1.00 . A A . 19 GLU OE1 1 1 4 2472 1 1 19 GLU OE2 O 2.609 -12.108 -0.456 1.00 . A A . 19 GLU OE2 1 1 4 2473 1 1 20 ILE C C 1.982 -9.566 -4.813 1.00 . A A . 20 ILE C 1 1 4 2474 1 1 20 ILE CA C 1.478 -9.778 -3.389 1.00 . A A . 20 ILE CA 1 1 4 2475 1 1 20 ILE CB C 0.148 -9.063 -3.220 1.00 . A A . 20 ILE CB 1 1 4 2476 1 1 20 ILE CD1 C -1.650 -8.534 -1.575 1.00 . A A . 20 ILE CD1 1 1 4 2477 1 1 20 ILE CG1 C -0.489 -9.477 -1.896 1.00 . A A . 20 ILE CG1 1 1 4 2478 1 1 20 ILE CG2 C -0.789 -9.427 -4.373 1.00 . A A . 20 ILE CG2 1 1 4 2479 1 1 20 ILE H H 2.242 -8.410 -1.909 1.00 . A A . 20 ILE H 1 1 4 2480 1 1 20 ILE HA H 1.354 -10.825 -3.199 1.00 . A A . 20 ILE HA 1 1 4 2481 1 1 20 ILE HB H 0.324 -8.004 -3.218 1.00 . A A . 20 ILE HB 1 1 4 2482 1 1 20 ILE HD11 H -2.587 -9.056 -1.713 1.00 . A A . 20 ILE HD11 1 1 4 2483 1 1 20 ILE HD12 H -1.613 -7.680 -2.236 1.00 . A A . 20 ILE HD12 1 1 4 2484 1 1 20 ILE HD13 H -1.571 -8.200 -0.550 1.00 . A A . 20 ILE HD13 1 1 4 2485 1 1 20 ILE HG12 H -0.856 -10.491 -1.977 1.00 . A A . 20 ILE HG12 1 1 4 2486 1 1 20 ILE HG13 H 0.248 -9.418 -1.111 1.00 . A A . 20 ILE HG13 1 1 4 2487 1 1 20 ILE HG21 H -0.697 -10.482 -4.592 1.00 . A A . 20 ILE HG21 1 1 4 2488 1 1 20 ILE HG22 H -0.522 -8.853 -5.248 1.00 . A A . 20 ILE HG22 1 1 4 2489 1 1 20 ILE HG23 H -1.808 -9.205 -4.094 1.00 . A A . 20 ILE HG23 1 1 4 2490 1 1 20 ILE N N 2.457 -9.225 -2.426 1.00 . A A . 20 ILE N 1 1 4 2491 1 1 20 ILE O O 1.965 -10.463 -5.632 1.00 . A A . 20 ILE O 1 1 4 2492 1 1 21 MET C C 3.961 -9.149 -6.883 1.00 . A A . 21 MET C 1 1 4 2493 1 1 21 MET CA C 2.919 -8.099 -6.487 1.00 . A A . 21 MET CA 1 1 4 2494 1 1 21 MET CB C 3.545 -6.705 -6.521 1.00 . A A . 21 MET CB 1 1 4 2495 1 1 21 MET CE C 4.828 -6.455 -9.836 1.00 . A A . 21 MET CE 1 1 4 2496 1 1 21 MET CG C 3.106 -5.984 -7.790 1.00 . A A . 21 MET CG 1 1 4 2497 1 1 21 MET H H 2.421 -7.669 -4.440 1.00 . A A . 21 MET H 1 1 4 2498 1 1 21 MET HA H 2.092 -8.135 -7.181 1.00 . A A . 21 MET HA 1 1 4 2499 1 1 21 MET HB2 H 3.214 -6.144 -5.657 1.00 . A A . 21 MET HB2 1 1 4 2500 1 1 21 MET HB3 H 4.623 -6.791 -6.510 1.00 . A A . 21 MET HB3 1 1 4 2501 1 1 21 MET HE1 H 5.617 -6.124 -10.496 1.00 . A A . 21 MET HE1 1 1 4 2502 1 1 21 MET HE2 H 3.925 -6.605 -10.406 1.00 . A A . 21 MET HE2 1 1 4 2503 1 1 21 MET HE3 H 5.112 -7.385 -9.363 1.00 . A A . 21 MET HE3 1 1 4 2504 1 1 21 MET HG2 H 2.668 -6.696 -8.475 1.00 . A A . 21 MET HG2 1 1 4 2505 1 1 21 MET HG3 H 2.374 -5.229 -7.535 1.00 . A A . 21 MET HG3 1 1 4 2506 1 1 21 MET N N 2.423 -8.379 -5.116 1.00 . A A . 21 MET N 1 1 4 2507 1 1 21 MET O O 4.203 -9.382 -8.050 1.00 . A A . 21 MET O 1 1 4 2508 1 1 21 MET SD S 4.540 -5.197 -8.566 1.00 . A A . 21 MET SD 1 1 4 2509 1 1 22 ASN C C 4.969 -12.216 -6.140 1.00 . A A . 22 ASN C 1 1 4 2510 1 1 22 ASN CA C 5.594 -10.826 -6.267 1.00 . A A . 22 ASN CA 1 1 4 2511 1 1 22 ASN CB C 6.786 -10.711 -5.315 1.00 . A A . 22 ASN CB 1 1 4 2512 1 1 22 ASN CG C 7.689 -9.560 -5.764 1.00 . A A . 22 ASN CG 1 1 4 2513 1 1 22 ASN H H 4.371 -9.595 -4.984 1.00 . A A . 22 ASN H 1 1 4 2514 1 1 22 ASN HA H 5.931 -10.677 -7.283 1.00 . A A . 22 ASN HA 1 1 4 2515 1 1 22 ASN HB2 H 6.429 -10.523 -4.312 1.00 . A A . 22 ASN HB2 1 1 4 2516 1 1 22 ASN HB3 H 7.350 -11.634 -5.330 1.00 . A A . 22 ASN HB3 1 1 4 2517 1 1 22 ASN HD21 H 6.278 -8.178 -5.533 1.00 . A A . 22 ASN HD21 1 1 4 2518 1 1 22 ASN HD22 H 7.785 -7.599 -6.084 1.00 . A A . 22 ASN HD22 1 1 4 2519 1 1 22 ASN N N 4.577 -9.790 -5.925 1.00 . A A . 22 ASN N 1 1 4 2520 1 1 22 ASN ND2 N 7.211 -8.345 -5.796 1.00 . A A . 22 ASN ND2 1 1 4 2521 1 1 22 ASN O O 5.417 -13.167 -6.748 1.00 . A A . 22 ASN O 1 1 4 2522 1 1 22 ASN OD1 O 8.841 -9.766 -6.088 1.00 . A A . 22 ASN OD1 1 1 4 2523 1 1 23 SER C C 3.017 -14.286 -6.563 1.00 . A A . 23 SER C 1 1 4 2524 1 1 23 SER CA C 3.280 -13.670 -5.187 1.00 . A A . 23 SER CA 1 1 4 2525 1 1 23 SER CB C 1.953 -13.494 -4.447 1.00 . A A . 23 SER CB 1 1 4 2526 1 1 23 SER H H 3.589 -11.561 -4.872 1.00 . A A . 23 SER H 1 1 4 2527 1 1 23 SER HA H 3.926 -14.322 -4.618 1.00 . A A . 23 SER HA 1 1 4 2528 1 1 23 SER HB2 H 2.141 -13.130 -3.449 1.00 . A A . 23 SER HB2 1 1 4 2529 1 1 23 SER HB3 H 1.339 -12.779 -4.978 1.00 . A A . 23 SER HB3 1 1 4 2530 1 1 23 SER HG H 1.792 -15.317 -3.784 1.00 . A A . 23 SER HG 1 1 4 2531 1 1 23 SER N N 3.935 -12.342 -5.353 1.00 . A A . 23 SER N 1 1 4 2532 1 1 23 SER O O 2.815 -15.488 -6.623 1.00 . A A . 23 SER O 1 1 4 2533 1 1 23 SER OXT O 3.022 -13.546 -7.532 1.00 . A A . 23 SER OXT 1 1 4 2534 1 1 23 SER OG O 1.288 -14.747 -4.370 1.00 . A A . 23 SER OG 1 1 4 2535 2 1 1 GLY C C 4.131 -10.449 8.631 1.00 . B B . 1 GLY C 1 1 4 2536 2 1 1 GLY CA C 5.202 -10.840 9.650 1.00 . B B . 1 GLY CA 1 1 4 2537 2 1 1 GLY H1 H 5.690 -12.815 9.207 1.00 . B B . 1 GLY H1 1 1 4 2538 2 1 1 GLY H2 H 7.032 -11.821 9.515 1.00 . B B . 1 GLY H2 1 1 4 2539 2 1 1 GLY H3 H 6.202 -11.698 8.037 1.00 . B B . 1 GLY H3 1 1 4 2540 2 1 1 GLY HA2 H 4.729 -11.241 10.535 1.00 . B B . 1 GLY HA2 1 1 4 2541 2 1 1 GLY HA3 H 5.779 -9.967 9.913 1.00 . B B . 1 GLY HA3 1 1 4 2542 2 1 1 GLY N N 6.099 -11.872 9.058 1.00 . B B . 1 GLY N 1 1 4 2543 2 1 1 GLY O O 4.219 -9.425 7.984 1.00 . B B . 1 GLY O 1 1 4 2544 2 1 2 ILE C C 0.739 -10.654 8.267 1.00 . B B . 2 ILE C 1 1 4 2545 2 1 2 ILE CA C 2.038 -10.933 7.511 1.00 . B B . 2 ILE CA 1 1 4 2546 2 1 2 ILE CB C 1.831 -12.116 6.566 1.00 . B B . 2 ILE CB 1 1 4 2547 2 1 2 ILE CD1 C 3.675 -13.662 7.244 1.00 . B B . 2 ILE CD1 1 1 4 2548 2 1 2 ILE CG1 C 3.192 -12.691 6.165 1.00 . B B . 2 ILE CG1 1 1 4 2549 2 1 2 ILE CG2 C 1.089 -11.645 5.314 1.00 . B B . 2 ILE CG2 1 1 4 2550 2 1 2 ILE H H 3.065 -12.077 9.019 1.00 . B B . 2 ILE H 1 1 4 2551 2 1 2 ILE HA H 2.315 -10.058 6.939 1.00 . B B . 2 ILE HA 1 1 4 2552 2 1 2 ILE HB H 1.249 -12.877 7.064 1.00 . B B . 2 ILE HB 1 1 4 2553 2 1 2 ILE HD11 H 2.823 -14.139 7.707 1.00 . B B . 2 ILE HD11 1 1 4 2554 2 1 2 ILE HD12 H 4.234 -13.120 7.993 1.00 . B B . 2 ILE HD12 1 1 4 2555 2 1 2 ILE HD13 H 4.309 -14.413 6.797 1.00 . B B . 2 ILE HD13 1 1 4 2556 2 1 2 ILE HG12 H 3.099 -13.216 5.224 1.00 . B B . 2 ILE HG12 1 1 4 2557 2 1 2 ILE HG13 H 3.907 -11.886 6.061 1.00 . B B . 2 ILE HG13 1 1 4 2558 2 1 2 ILE HG21 H 1.137 -10.567 5.251 1.00 . B B . 2 ILE HG21 1 1 4 2559 2 1 2 ILE HG22 H 0.055 -11.956 5.369 1.00 . B B . 2 ILE HG22 1 1 4 2560 2 1 2 ILE HG23 H 1.549 -12.077 4.437 1.00 . B B . 2 ILE HG23 1 1 4 2561 2 1 2 ILE N N 3.117 -11.257 8.485 1.00 . B B . 2 ILE N 1 1 4 2562 2 1 2 ILE O O 0.664 -10.804 9.470 1.00 . B B . 2 ILE O 1 1 4 2563 2 1 3 GLY C C -1.861 -8.459 8.180 1.00 . B B . 3 GLY C 1 1 4 2564 2 1 3 GLY CA C -1.579 -9.959 8.243 1.00 . B B . 3 GLY CA 1 1 4 2565 2 1 3 GLY H H -0.200 -10.134 6.600 1.00 . B B . 3 GLY H 1 1 4 2566 2 1 3 GLY HA2 H -2.369 -10.494 7.736 1.00 . B B . 3 GLY HA2 1 1 4 2567 2 1 3 GLY HA3 H -1.531 -10.272 9.273 1.00 . B B . 3 GLY HA3 1 1 4 2568 2 1 3 GLY N N -0.283 -10.249 7.569 1.00 . B B . 3 GLY N 1 1 4 2569 2 1 3 GLY O O -2.764 -7.958 8.820 1.00 . B B . 3 GLY O 1 1 4 2570 2 1 4 LYS C C -1.217 -5.891 5.808 1.00 . B B . 4 LYS C 1 1 4 2571 2 1 4 LYS CA C -1.330 -6.277 7.280 1.00 . B B . 4 LYS CA 1 1 4 2572 2 1 4 LYS CB C -0.282 -5.522 8.094 1.00 . B B . 4 LYS CB 1 1 4 2573 2 1 4 LYS CD C 1.990 -5.691 9.120 1.00 . B B . 4 LYS CD 1 1 4 2574 2 1 4 LYS CE C 1.553 -6.102 10.527 1.00 . B B . 4 LYS CE 1 1 4 2575 2 1 4 LYS CG C 1.036 -6.299 8.089 1.00 . B B . 4 LYS CG 1 1 4 2576 2 1 4 LYS H H -0.387 -8.169 6.886 1.00 . B B . 4 LYS H 1 1 4 2577 2 1 4 LYS HA H -2.319 -6.033 7.643 1.00 . B B . 4 LYS HA 1 1 4 2578 2 1 4 LYS HB2 H -0.126 -4.545 7.659 1.00 . B B . 4 LYS HB2 1 1 4 2579 2 1 4 LYS HB3 H -0.630 -5.413 9.110 1.00 . B B . 4 LYS HB3 1 1 4 2580 2 1 4 LYS HD2 H 2.993 -6.046 8.935 1.00 . B B . 4 LYS HD2 1 1 4 2581 2 1 4 LYS HD3 H 1.968 -4.614 9.039 1.00 . B B . 4 LYS HD3 1 1 4 2582 2 1 4 LYS HE2 H 0.703 -6.766 10.461 1.00 . B B . 4 LYS HE2 1 1 4 2583 2 1 4 LYS HE3 H 2.368 -6.609 11.024 1.00 . B B . 4 LYS HE3 1 1 4 2584 2 1 4 LYS HG2 H 0.845 -7.332 8.339 1.00 . B B . 4 LYS HG2 1 1 4 2585 2 1 4 LYS HG3 H 1.484 -6.242 7.109 1.00 . B B . 4 LYS HG3 1 1 4 2586 2 1 4 LYS HZ1 H 0.881 -5.165 12.261 1.00 . B B . 4 LYS HZ1 1 1 4 2587 2 1 4 LYS HZ2 H 0.390 -4.402 10.826 1.00 . B B . 4 LYS HZ2 1 1 4 2588 2 1 4 LYS HZ3 H 1.992 -4.248 11.367 1.00 . B B . 4 LYS HZ3 1 1 4 2589 2 1 4 LYS N N -1.104 -7.742 7.401 1.00 . B B . 4 LYS N 1 1 4 2590 2 1 4 LYS NZ N 1.175 -4.888 11.304 1.00 . B B . 4 LYS NZ 1 1 4 2591 2 1 4 LYS O O -2.038 -5.172 5.275 1.00 . B B . 4 LYS O 1 1 4 2592 2 1 5 TYR C C -1.085 -6.807 2.898 1.00 . B B . 5 TYR C 1 1 4 2593 2 1 5 TYR CA C -0.033 -6.063 3.713 1.00 . B B . 5 TYR CA 1 1 4 2594 2 1 5 TYR CB C 1.361 -6.498 3.277 1.00 . B B . 5 TYR CB 1 1 4 2595 2 1 5 TYR CD1 C 2.875 -4.847 4.436 1.00 . B B . 5 TYR CD1 1 1 4 2596 2 1 5 TYR CD2 C 2.769 -7.119 5.275 1.00 . B B . 5 TYR CD2 1 1 4 2597 2 1 5 TYR CE1 C 3.800 -4.521 5.434 1.00 . B B . 5 TYR CE1 1 1 4 2598 2 1 5 TYR CE2 C 3.694 -6.793 6.274 1.00 . B B . 5 TYR CE2 1 1 4 2599 2 1 5 TYR CG C 2.359 -6.146 4.356 1.00 . B B . 5 TYR CG 1 1 4 2600 2 1 5 TYR CZ C 4.209 -5.494 6.353 1.00 . B B . 5 TYR CZ 1 1 4 2601 2 1 5 TYR H H 0.440 -6.959 5.591 1.00 . B B . 5 TYR H 1 1 4 2602 2 1 5 TYR HA H -0.144 -5.009 3.553 1.00 . B B . 5 TYR HA 1 1 4 2603 2 1 5 TYR HB2 H 1.372 -7.565 3.107 1.00 . B B . 5 TYR HB2 1 1 4 2604 2 1 5 TYR HB3 H 1.620 -5.985 2.372 1.00 . B B . 5 TYR HB3 1 1 4 2605 2 1 5 TYR HD1 H 2.559 -4.096 3.728 1.00 . B B . 5 TYR HD1 1 1 4 2606 2 1 5 TYR HD2 H 2.371 -8.122 5.214 1.00 . B B . 5 TYR HD2 1 1 4 2607 2 1 5 TYR HE1 H 4.197 -3.519 5.496 1.00 . B B . 5 TYR HE1 1 1 4 2608 2 1 5 TYR HE2 H 4.012 -7.543 6.982 1.00 . B B . 5 TYR HE2 1 1 4 2609 2 1 5 TYR HH H 4.927 -5.711 8.106 1.00 . B B . 5 TYR HH 1 1 4 2610 2 1 5 TYR N N -0.206 -6.378 5.146 1.00 . B B . 5 TYR N 1 1 4 2611 2 1 5 TYR O O -1.310 -6.510 1.742 1.00 . B B . 5 TYR O 1 1 4 2612 2 1 5 TYR OH O 5.121 -5.173 7.337 1.00 . B B . 5 TYR OH 1 1 4 2613 2 1 6 LEU C C -4.156 -8.221 3.282 1.00 . B B . 6 LEU C 1 1 4 2614 2 1 6 LEU CA C -2.765 -8.524 2.724 1.00 . B B . 6 LEU CA 1 1 4 2615 2 1 6 LEU CB C -2.483 -10.024 2.839 1.00 . B B . 6 LEU CB 1 1 4 2616 2 1 6 LEU CD1 C -2.010 -10.718 0.493 1.00 . B B . 6 LEU CD1 1 1 4 2617 2 1 6 LEU CD2 C -0.344 -9.309 1.719 1.00 . B B . 6 LEU CD2 1 1 4 2618 2 1 6 LEU CG C -1.381 -10.433 1.856 1.00 . B B . 6 LEU CG 1 1 4 2619 2 1 6 LEU H H -1.539 -8.009 4.421 1.00 . B B . 6 LEU H 1 1 4 2620 2 1 6 LEU HA H -2.719 -8.225 1.686 1.00 . B B . 6 LEU HA 1 1 4 2621 2 1 6 LEU HB2 H -2.168 -10.253 3.846 1.00 . B B . 6 LEU HB2 1 1 4 2622 2 1 6 LEU HB3 H -3.383 -10.574 2.613 1.00 . B B . 6 LEU HB3 1 1 4 2623 2 1 6 LEU HD11 H -2.512 -9.831 0.139 1.00 . B B . 6 LEU HD11 1 1 4 2624 2 1 6 LEU HD12 H -2.725 -11.521 0.588 1.00 . B B . 6 LEU HD12 1 1 4 2625 2 1 6 LEU HD13 H -1.240 -11.001 -0.207 1.00 . B B . 6 LEU HD13 1 1 4 2626 2 1 6 LEU HD21 H -0.788 -8.469 1.204 1.00 . B B . 6 LEU HD21 1 1 4 2627 2 1 6 LEU HD22 H 0.506 -9.668 1.157 1.00 . B B . 6 LEU HD22 1 1 4 2628 2 1 6 LEU HD23 H -0.020 -8.997 2.702 1.00 . B B . 6 LEU HD23 1 1 4 2629 2 1 6 LEU HG H -0.896 -11.328 2.219 1.00 . B B . 6 LEU HG 1 1 4 2630 2 1 6 LEU N N -1.733 -7.774 3.486 1.00 . B B . 6 LEU N 1 1 4 2631 2 1 6 LEU O O -5.137 -8.804 2.866 1.00 . B B . 6 LEU O 1 1 4 2632 2 1 7 HIS C C -5.734 -5.480 4.969 1.00 . B B . 7 HIS C 1 1 4 2633 2 1 7 HIS CA C -5.596 -6.991 4.785 1.00 . B B . 7 HIS CA 1 1 4 2634 2 1 7 HIS CB C -5.768 -7.676 6.140 1.00 . B B . 7 HIS CB 1 1 4 2635 2 1 7 HIS CD2 C -4.414 -9.804 6.864 1.00 . B B . 7 HIS CD2 1 1 4 2636 2 1 7 HIS CE1 C -5.027 -11.132 5.266 1.00 . B B . 7 HIS CE1 1 1 4 2637 2 1 7 HIS CG C -5.266 -9.091 6.060 1.00 . B B . 7 HIS CG 1 1 4 2638 2 1 7 HIS H H -3.455 -6.852 4.542 1.00 . B B . 7 HIS H 1 1 4 2639 2 1 7 HIS HA H -6.363 -7.338 4.109 1.00 . B B . 7 HIS HA 1 1 4 2640 2 1 7 HIS HB2 H -5.206 -7.137 6.889 1.00 . B B . 7 HIS HB2 1 1 4 2641 2 1 7 HIS HB3 H -6.814 -7.681 6.409 1.00 . B B . 7 HIS HB3 1 1 4 2642 2 1 7 HIS HD1 H -6.255 -9.752 4.307 1.00 . B B . 7 HIS HD1 1 1 4 2643 2 1 7 HIS HD2 H -3.932 -9.421 7.752 1.00 . B B . 7 HIS HD2 1 1 4 2644 2 1 7 HIS HE1 H -5.135 -12.000 4.634 1.00 . B B . 7 HIS HE1 1 1 4 2645 2 1 7 HIS N N -4.256 -7.316 4.216 1.00 . B B . 7 HIS N 1 1 4 2646 2 1 7 HIS ND1 N -5.646 -9.957 5.047 1.00 . B B . 7 HIS ND1 1 1 4 2647 2 1 7 HIS NE2 N -4.264 -11.093 6.361 1.00 . B B . 7 HIS NE2 1 1 4 2648 2 1 7 HIS O O -6.614 -5.011 5.662 1.00 . B B . 7 HIS O 1 1 4 2649 2 1 8 SER C C -4.068 -2.541 3.511 1.00 . B B . 8 SER C 1 1 4 2650 2 1 8 SER CA C -4.983 -3.233 4.514 1.00 . B B . 8 SER CA 1 1 4 2651 2 1 8 SER CB C -4.576 -2.838 5.934 1.00 . B B . 8 SER CB 1 1 4 2652 2 1 8 SER H H -4.170 -5.099 3.802 1.00 . B B . 8 SER H 1 1 4 2653 2 1 8 SER HA H -6.000 -2.928 4.335 1.00 . B B . 8 SER HA 1 1 4 2654 2 1 8 SER HB2 H -4.484 -3.722 6.544 1.00 . B B . 8 SER HB2 1 1 4 2655 2 1 8 SER HB3 H -3.623 -2.324 5.904 1.00 . B B . 8 SER HB3 1 1 4 2656 2 1 8 SER HG H -6.363 -2.514 6.634 1.00 . B B . 8 SER HG 1 1 4 2657 2 1 8 SER N N -4.877 -4.710 4.359 1.00 . B B . 8 SER N 1 1 4 2658 2 1 8 SER O O -4.388 -1.491 2.989 1.00 . B B . 8 SER O 1 1 4 2659 2 1 8 SER OG O -5.571 -1.989 6.489 1.00 . B B . 8 SER OG 1 1 4 2660 2 1 9 ALA C C -2.681 -2.444 0.881 1.00 . B B . 9 ALA C 1 1 4 2661 2 1 9 ALA CA C -2.016 -2.472 2.251 1.00 . B B . 9 ALA CA 1 1 4 2662 2 1 9 ALA CB C -0.716 -3.261 2.159 1.00 . B B . 9 ALA CB 1 1 4 2663 2 1 9 ALA H H -2.689 -3.962 3.654 1.00 . B B . 9 ALA H 1 1 4 2664 2 1 9 ALA HA H -1.802 -1.461 2.569 1.00 . B B . 9 ALA HA 1 1 4 2665 2 1 9 ALA HB1 H -0.231 -3.269 3.121 1.00 . B B . 9 ALA HB1 1 1 4 2666 2 1 9 ALA HB2 H -0.074 -2.786 1.439 1.00 . B B . 9 ALA HB2 1 1 4 2667 2 1 9 ALA HB3 H -0.924 -4.282 1.846 1.00 . B B . 9 ALA HB3 1 1 4 2668 2 1 9 ALA N N -2.934 -3.114 3.228 1.00 . B B . 9 ALA N 1 1 4 2669 2 1 9 ALA O O -2.952 -1.392 0.341 1.00 . B B . 9 ALA O 1 1 4 2670 2 1 10 LYS C C -4.568 -2.508 -1.195 1.00 . B B . 10 LYS C 1 1 4 2671 2 1 10 LYS CA C -3.585 -3.668 -1.028 1.00 . B B . 10 LYS CA 1 1 4 2672 2 1 10 LYS CB C -4.344 -4.988 -1.161 1.00 . B B . 10 LYS CB 1 1 4 2673 2 1 10 LYS CD C -4.569 -6.806 -2.859 1.00 . B B . 10 LYS CD 1 1 4 2674 2 1 10 LYS CE C -5.259 -5.960 -3.930 1.00 . B B . 10 LYS CE 1 1 4 2675 2 1 10 LYS CG C -3.576 -5.937 -2.083 1.00 . B B . 10 LYS CG 1 1 4 2676 2 1 10 LYS H H -2.689 -4.428 0.787 1.00 . B B . 10 LYS H 1 1 4 2677 2 1 10 LYS HA H -2.828 -3.609 -1.796 1.00 . B B . 10 LYS HA 1 1 4 2678 2 1 10 LYS HB2 H -4.453 -5.441 -0.187 1.00 . B B . 10 LYS HB2 1 1 4 2679 2 1 10 LYS HB3 H -5.321 -4.797 -1.581 1.00 . B B . 10 LYS HB3 1 1 4 2680 2 1 10 LYS HD2 H -4.042 -7.624 -3.328 1.00 . B B . 10 LYS HD2 1 1 4 2681 2 1 10 LYS HD3 H -5.311 -7.198 -2.180 1.00 . B B . 10 LYS HD3 1 1 4 2682 2 1 10 LYS HE2 H -6.089 -6.512 -4.346 1.00 . B B . 10 LYS HE2 1 1 4 2683 2 1 10 LYS HE3 H -5.623 -5.044 -3.487 1.00 . B B . 10 LYS HE3 1 1 4 2684 2 1 10 LYS HG2 H -2.980 -5.361 -2.776 1.00 . B B . 10 LYS HG2 1 1 4 2685 2 1 10 LYS HG3 H -2.932 -6.571 -1.492 1.00 . B B . 10 LYS HG3 1 1 4 2686 2 1 10 LYS HZ1 H -4.795 -5.458 -5.897 1.00 . B B . 10 LYS HZ1 1 1 4 2687 2 1 10 LYS HZ2 H -3.632 -6.438 -5.138 1.00 . B B . 10 LYS HZ2 1 1 4 2688 2 1 10 LYS HZ3 H -3.745 -4.788 -4.747 1.00 . B B . 10 LYS HZ3 1 1 4 2689 2 1 10 LYS N N -2.934 -3.599 0.319 1.00 . B B . 10 LYS N 1 1 4 2690 2 1 10 LYS NZ N -4.285 -5.636 -5.010 1.00 . B B . 10 LYS NZ 1 1 4 2691 2 1 10 LYS O O -4.555 -1.811 -2.190 1.00 . B B . 10 LYS O 1 1 4 2692 2 1 11 LYS C C -5.613 0.121 -0.636 1.00 . B B . 11 LYS C 1 1 4 2693 2 1 11 LYS CA C -6.384 -1.165 -0.337 1.00 . B B . 11 LYS CA 1 1 4 2694 2 1 11 LYS CB C -7.149 -1.014 0.979 1.00 . B B . 11 LYS CB 1 1 4 2695 2 1 11 LYS CD C -9.512 -1.469 0.304 1.00 . B B . 11 LYS CD 1 1 4 2696 2 1 11 LYS CE C -9.899 -2.400 -0.847 1.00 . B B . 11 LYS CE 1 1 4 2697 2 1 11 LYS CG C -8.288 -2.036 1.028 1.00 . B B . 11 LYS CG 1 1 4 2698 2 1 11 LYS H H -5.407 -2.855 0.572 1.00 . B B . 11 LYS H 1 1 4 2699 2 1 11 LYS HA H -7.079 -1.363 -1.141 1.00 . B B . 11 LYS HA 1 1 4 2700 2 1 11 LYS HB2 H -6.476 -1.183 1.807 1.00 . B B . 11 LYS HB2 1 1 4 2701 2 1 11 LYS HB3 H -7.559 -0.017 1.045 1.00 . B B . 11 LYS HB3 1 1 4 2702 2 1 11 LYS HD2 H -10.335 -1.391 0.999 1.00 . B B . 11 LYS HD2 1 1 4 2703 2 1 11 LYS HD3 H -9.277 -0.493 -0.090 1.00 . B B . 11 LYS HD3 1 1 4 2704 2 1 11 LYS HE2 H -10.566 -1.881 -1.520 1.00 . B B . 11 LYS HE2 1 1 4 2705 2 1 11 LYS HE3 H -9.011 -2.702 -1.380 1.00 . B B . 11 LYS HE3 1 1 4 2706 2 1 11 LYS HG2 H -7.972 -2.949 0.545 1.00 . B B . 11 LYS HG2 1 1 4 2707 2 1 11 LYS HG3 H -8.543 -2.242 2.056 1.00 . B B . 11 LYS HG3 1 1 4 2708 2 1 11 LYS HZ1 H -9.879 -4.330 -0.066 1.00 . B B . 11 LYS HZ1 1 1 4 2709 2 1 11 LYS HZ2 H -11.244 -3.980 -1.015 1.00 . B B . 11 LYS HZ2 1 1 4 2710 2 1 11 LYS HZ3 H -11.113 -3.346 0.556 1.00 . B B . 11 LYS HZ3 1 1 4 2711 2 1 11 LYS N N -5.415 -2.288 -0.227 1.00 . B B . 11 LYS N 1 1 4 2712 2 1 11 LYS NZ N -10.585 -3.605 -0.302 1.00 . B B . 11 LYS NZ 1 1 4 2713 2 1 11 LYS O O -5.756 0.712 -1.688 1.00 . B B . 11 LYS O 1 1 4 2714 2 1 12 PHE C C -3.052 1.542 -1.141 1.00 . B B . 12 PHE C 1 1 4 2715 2 1 12 PHE CA C -3.994 1.784 0.037 1.00 . B B . 12 PHE CA 1 1 4 2716 2 1 12 PHE CB C -3.179 2.122 1.286 1.00 . B B . 12 PHE CB 1 1 4 2717 2 1 12 PHE CD1 C -5.367 2.334 2.520 1.00 . B B . 12 PHE CD1 1 1 4 2718 2 1 12 PHE CD2 C -3.486 1.303 3.650 1.00 . B B . 12 PHE CD2 1 1 4 2719 2 1 12 PHE CE1 C -6.158 2.141 3.659 1.00 . B B . 12 PHE CE1 1 1 4 2720 2 1 12 PHE CE2 C -4.276 1.109 4.790 1.00 . B B . 12 PHE CE2 1 1 4 2721 2 1 12 PHE CG C -4.031 1.914 2.515 1.00 . B B . 12 PHE CG 1 1 4 2722 2 1 12 PHE CZ C -5.612 1.528 4.794 1.00 . B B . 12 PHE CZ 1 1 4 2723 2 1 12 PHE H H -4.675 0.057 1.113 1.00 . B B . 12 PHE H 1 1 4 2724 2 1 12 PHE HA H -4.661 2.603 -0.194 1.00 . B B . 12 PHE HA 1 1 4 2725 2 1 12 PHE HB2 H -2.311 1.478 1.335 1.00 . B B . 12 PHE HB2 1 1 4 2726 2 1 12 PHE HB3 H -2.861 3.154 1.240 1.00 . B B . 12 PHE HB3 1 1 4 2727 2 1 12 PHE HD1 H -5.788 2.806 1.644 1.00 . B B . 12 PHE HD1 1 1 4 2728 2 1 12 PHE HD2 H -2.455 0.979 3.647 1.00 . B B . 12 PHE HD2 1 1 4 2729 2 1 12 PHE HE1 H -7.188 2.464 3.662 1.00 . B B . 12 PHE HE1 1 1 4 2730 2 1 12 PHE HE2 H -3.856 0.636 5.666 1.00 . B B . 12 PHE HE2 1 1 4 2731 2 1 12 PHE HZ H -6.223 1.380 5.672 1.00 . B B . 12 PHE HZ 1 1 4 2732 2 1 12 PHE N N -4.785 0.551 0.276 1.00 . B B . 12 PHE N 1 1 4 2733 2 1 12 PHE O O -2.718 2.446 -1.876 1.00 . B B . 12 PHE O 1 1 4 2734 2 1 13 GLY C C -2.300 0.649 -3.740 1.00 . B B . 13 GLY C 1 1 4 2735 2 1 13 GLY CA C -1.712 0.033 -2.473 1.00 . B B . 13 GLY CA 1 1 4 2736 2 1 13 GLY H H -2.909 -0.397 -0.733 1.00 . B B . 13 GLY H 1 1 4 2737 2 1 13 GLY HA2 H -0.739 0.459 -2.277 1.00 . B B . 13 GLY HA2 1 1 4 2738 2 1 13 GLY HA3 H -1.623 -1.034 -2.603 1.00 . B B . 13 GLY HA3 1 1 4 2739 2 1 13 GLY N N -2.625 0.324 -1.333 1.00 . B B . 13 GLY N 1 1 4 2740 2 1 13 GLY O O -1.597 1.214 -4.554 1.00 . B B . 13 GLY O 1 1 4 2741 2 1 14 LYS C C -4.806 2.508 -4.769 1.00 . B B . 14 LYS C 1 1 4 2742 2 1 14 LYS CA C -4.236 1.133 -5.112 1.00 . B B . 14 LYS CA 1 1 4 2743 2 1 14 LYS CB C -5.375 0.222 -5.569 1.00 . B B . 14 LYS CB 1 1 4 2744 2 1 14 LYS CD C -4.176 -1.280 -7.165 1.00 . B B . 14 LYS CD 1 1 4 2745 2 1 14 LYS CE C -5.204 -0.972 -8.255 1.00 . B B . 14 LYS CE 1 1 4 2746 2 1 14 LYS CG C -4.843 -1.195 -5.791 1.00 . B B . 14 LYS CG 1 1 4 2747 2 1 14 LYS H H -4.135 0.092 -3.230 1.00 . B B . 14 LYS H 1 1 4 2748 2 1 14 LYS HA H -3.510 1.228 -5.905 1.00 . B B . 14 LYS HA 1 1 4 2749 2 1 14 LYS HB2 H -6.145 0.206 -4.809 1.00 . B B . 14 LYS HB2 1 1 4 2750 2 1 14 LYS HB3 H -5.790 0.600 -6.491 1.00 . B B . 14 LYS HB3 1 1 4 2751 2 1 14 LYS HD2 H -3.368 -0.565 -7.218 1.00 . B B . 14 LYS HD2 1 1 4 2752 2 1 14 LYS HD3 H -3.784 -2.276 -7.314 1.00 . B B . 14 LYS HD3 1 1 4 2753 2 1 14 LYS HE2 H -6.199 -1.120 -7.864 1.00 . B B . 14 LYS HE2 1 1 4 2754 2 1 14 LYS HE3 H -5.091 0.054 -8.574 1.00 . B B . 14 LYS HE3 1 1 4 2755 2 1 14 LYS HG2 H -4.121 -1.432 -5.024 1.00 . B B . 14 LYS HG2 1 1 4 2756 2 1 14 LYS HG3 H -5.661 -1.898 -5.747 1.00 . B B . 14 LYS HG3 1 1 4 2757 2 1 14 LYS HZ1 H -4.430 -1.387 -10.144 1.00 . B B . 14 LYS HZ1 1 1 4 2758 2 1 14 LYS HZ2 H -5.907 -2.160 -9.815 1.00 . B B . 14 LYS HZ2 1 1 4 2759 2 1 14 LYS HZ3 H -4.471 -2.726 -9.105 1.00 . B B . 14 LYS HZ3 1 1 4 2760 2 1 14 LYS N N -3.589 0.550 -3.906 1.00 . B B . 14 LYS N 1 1 4 2761 2 1 14 LYS NZ N -4.986 -1.880 -9.417 1.00 . B B . 14 LYS NZ 1 1 4 2762 2 1 14 LYS O O -5.203 3.261 -5.636 1.00 . B B . 14 LYS O 1 1 4 2763 2 1 15 ALA C C -4.282 5.126 -2.762 1.00 . B B . 15 ALA C 1 1 4 2764 2 1 15 ALA CA C -5.420 4.164 -3.116 1.00 . B B . 15 ALA CA 1 1 4 2765 2 1 15 ALA CB C -6.337 3.988 -1.903 1.00 . B B . 15 ALA CB 1 1 4 2766 2 1 15 ALA H H -4.545 2.218 -2.822 1.00 . B B . 15 ALA H 1 1 4 2767 2 1 15 ALA HA H -5.989 4.567 -3.941 1.00 . B B . 15 ALA HA 1 1 4 2768 2 1 15 ALA HB1 H -6.903 3.074 -2.009 1.00 . B B . 15 ALA HB1 1 1 4 2769 2 1 15 ALA HB2 H -7.016 4.826 -1.840 1.00 . B B . 15 ALA HB2 1 1 4 2770 2 1 15 ALA HB3 H -5.740 3.940 -1.005 1.00 . B B . 15 ALA HB3 1 1 4 2771 2 1 15 ALA N N -4.862 2.840 -3.508 1.00 . B B . 15 ALA N 1 1 4 2772 2 1 15 ALA O O -4.501 6.292 -2.506 1.00 . B B . 15 ALA O 1 1 4 2773 2 1 16 TRP C C -1.076 5.750 -3.662 1.00 . B B . 16 TRP C 1 1 4 2774 2 1 16 TRP CA C -1.915 5.522 -2.409 1.00 . B B . 16 TRP CA 1 1 4 2775 2 1 16 TRP CB C -1.075 4.864 -1.299 1.00 . B B . 16 TRP CB 1 1 4 2776 2 1 16 TRP CD1 C -0.045 2.592 -1.756 1.00 . B B . 16 TRP CD1 1 1 4 2777 2 1 16 TRP CD2 C 1.116 4.274 -2.677 1.00 . B B . 16 TRP CD2 1 1 4 2778 2 1 16 TRP CE2 C 1.794 3.085 -3.025 1.00 . B B . 16 TRP CE2 1 1 4 2779 2 1 16 TRP CE3 C 1.637 5.491 -3.126 1.00 . B B . 16 TRP CE3 1 1 4 2780 2 1 16 TRP CG C -0.051 3.938 -1.883 1.00 . B B . 16 TRP CG 1 1 4 2781 2 1 16 TRP CH2 C 3.461 4.332 -4.245 1.00 . B B . 16 TRP CH2 1 1 4 2782 2 1 16 TRP CZ2 C 2.955 3.106 -3.801 1.00 . B B . 16 TRP CZ2 1 1 4 2783 2 1 16 TRP CZ3 C 2.802 5.520 -3.908 1.00 . B B . 16 TRP CZ3 1 1 4 2784 2 1 16 TRP H H -2.915 3.705 -2.950 1.00 . B B . 16 TRP H 1 1 4 2785 2 1 16 TRP HA H -2.278 6.469 -2.061 1.00 . B B . 16 TRP HA 1 1 4 2786 2 1 16 TRP HB2 H -0.575 5.632 -0.729 1.00 . B B . 16 TRP HB2 1 1 4 2787 2 1 16 TRP HB3 H -1.729 4.306 -0.644 1.00 . B B . 16 TRP HB3 1 1 4 2788 2 1 16 TRP HD1 H -0.774 2.009 -1.216 1.00 . B B . 16 TRP HD1 1 1 4 2789 2 1 16 TRP HE1 H 1.277 1.132 -2.511 1.00 . B B . 16 TRP HE1 1 1 4 2790 2 1 16 TRP HE3 H 1.133 6.411 -2.864 1.00 . B B . 16 TRP HE3 1 1 4 2791 2 1 16 TRP HH2 H 4.356 4.366 -4.851 1.00 . B B . 16 TRP HH2 1 1 4 2792 2 1 16 TRP HZ2 H 3.457 2.184 -4.056 1.00 . B B . 16 TRP HZ2 1 1 4 2793 2 1 16 TRP HZ3 H 3.191 6.461 -4.251 1.00 . B B . 16 TRP HZ3 1 1 4 2794 2 1 16 TRP N N -3.068 4.645 -2.743 1.00 . B B . 16 TRP N 1 1 4 2795 2 1 16 TRP NE1 N 1.046 2.083 -2.439 1.00 . B B . 16 TRP NE1 1 1 4 2796 2 1 16 TRP O O -0.659 6.856 -3.947 1.00 . B B . 16 TRP O 1 1 4 2797 2 1 17 VAL C C -0.712 5.913 -6.545 1.00 . B B . 17 VAL C 1 1 4 2798 2 1 17 VAL CA C -0.005 4.903 -5.642 1.00 . B B . 17 VAL CA 1 1 4 2799 2 1 17 VAL CB C 0.183 3.549 -6.352 1.00 . B B . 17 VAL CB 1 1 4 2800 2 1 17 VAL CG1 C -0.935 3.295 -7.368 1.00 . B B . 17 VAL CG1 1 1 4 2801 2 1 17 VAL CG2 C 1.532 3.548 -7.073 1.00 . B B . 17 VAL CG2 1 1 4 2802 2 1 17 VAL H H -1.160 3.832 -4.176 1.00 . B B . 17 VAL H 1 1 4 2803 2 1 17 VAL HA H 0.962 5.296 -5.365 1.00 . B B . 17 VAL HA 1 1 4 2804 2 1 17 VAL HB H 0.175 2.761 -5.613 1.00 . B B . 17 VAL HB 1 1 4 2805 2 1 17 VAL HG11 H -0.704 2.410 -7.941 1.00 . B B . 17 VAL HG11 1 1 4 2806 2 1 17 VAL HG12 H -1.018 4.142 -8.034 1.00 . B B . 17 VAL HG12 1 1 4 2807 2 1 17 VAL HG13 H -1.870 3.152 -6.847 1.00 . B B . 17 VAL HG13 1 1 4 2808 2 1 17 VAL HG21 H 2.204 4.235 -6.577 1.00 . B B . 17 VAL HG21 1 1 4 2809 2 1 17 VAL HG22 H 1.393 3.857 -8.098 1.00 . B B . 17 VAL HG22 1 1 4 2810 2 1 17 VAL HG23 H 1.953 2.554 -7.050 1.00 . B B . 17 VAL HG23 1 1 4 2811 2 1 17 VAL N N -0.820 4.719 -4.416 1.00 . B B . 17 VAL N 1 1 4 2812 2 1 17 VAL O O -0.137 6.901 -6.953 1.00 . B B . 17 VAL O 1 1 4 2813 2 1 18 GLY C C -2.579 8.058 -7.082 1.00 . B B . 18 GLY C 1 1 4 2814 2 1 18 GLY CA C -2.714 6.659 -7.683 1.00 . B B . 18 GLY CA 1 1 4 2815 2 1 18 GLY H H -2.423 4.905 -6.468 1.00 . B B . 18 GLY H 1 1 4 2816 2 1 18 GLY HA2 H -2.302 6.650 -8.682 1.00 . B B . 18 GLY HA2 1 1 4 2817 2 1 18 GLY HA3 H -3.756 6.382 -7.717 1.00 . B B . 18 GLY HA3 1 1 4 2818 2 1 18 GLY N N -1.968 5.694 -6.830 1.00 . B B . 18 GLY N 1 1 4 2819 2 1 18 GLY O O -2.796 9.055 -7.742 1.00 . B B . 18 GLY O 1 1 4 2820 2 1 19 GLU C C -0.626 9.934 -5.400 1.00 . B B . 19 GLU C 1 1 4 2821 2 1 19 GLU CA C -2.048 9.456 -5.179 1.00 . B B . 19 GLU CA 1 1 4 2822 2 1 19 GLU CB C -2.274 9.300 -3.676 1.00 . B B . 19 GLU CB 1 1 4 2823 2 1 19 GLU CD C -4.769 9.373 -3.667 1.00 . B B . 19 GLU CD 1 1 4 2824 2 1 19 GLU CG C -3.542 8.492 -3.428 1.00 . B B . 19 GLU CG 1 1 4 2825 2 1 19 GLU H H -2.033 7.324 -5.321 1.00 . B B . 19 GLU H 1 1 4 2826 2 1 19 GLU HA H -2.746 10.164 -5.589 1.00 . B B . 19 GLU HA 1 1 4 2827 2 1 19 GLU HB2 H -1.428 8.776 -3.242 1.00 . B B . 19 GLU HB2 1 1 4 2828 2 1 19 GLU HB3 H -2.372 10.274 -3.221 1.00 . B B . 19 GLU HB3 1 1 4 2829 2 1 19 GLU HG2 H -3.563 7.645 -4.100 1.00 . B B . 19 GLU HG2 1 1 4 2830 2 1 19 GLU HG3 H -3.546 8.141 -2.408 1.00 . B B . 19 GLU HG3 1 1 4 2831 2 1 19 GLU N N -2.211 8.137 -5.832 1.00 . B B . 19 GLU N 1 1 4 2832 2 1 19 GLU O O -0.376 10.926 -6.054 1.00 . B B . 19 GLU O 1 1 4 2833 2 1 19 GLU OE1 O -4.698 10.551 -3.355 1.00 . B B . 19 GLU OE1 1 1 4 2834 2 1 19 GLU OE2 O -5.759 8.857 -4.158 1.00 . B B . 19 GLU OE2 1 1 4 2835 2 1 20 ILE C C 2.196 9.369 -6.414 1.00 . B B . 20 ILE C 1 1 4 2836 2 1 20 ILE CA C 1.723 9.615 -4.982 1.00 . B B . 20 ILE CA 1 1 4 2837 2 1 20 ILE CB C 2.541 8.763 -4.013 1.00 . B B . 20 ILE CB 1 1 4 2838 2 1 20 ILE CD1 C 3.272 8.544 -1.640 1.00 . B B . 20 ILE CD1 1 1 4 2839 2 1 20 ILE CG1 C 2.548 9.435 -2.650 1.00 . B B . 20 ILE CG1 1 1 4 2840 2 1 20 ILE CG2 C 3.982 8.610 -4.515 1.00 . B B . 20 ILE CG2 1 1 4 2841 2 1 20 ILE H H 0.065 8.435 -4.307 1.00 . B B . 20 ILE H 1 1 4 2842 2 1 20 ILE HA H 1.835 10.653 -4.732 1.00 . B B . 20 ILE HA 1 1 4 2843 2 1 20 ILE HB H 2.075 7.791 -3.928 1.00 . B B . 20 ILE HB 1 1 4 2844 2 1 20 ILE HD11 H 3.697 9.155 -0.859 1.00 . B B . 20 ILE HD11 1 1 4 2845 2 1 20 ILE HD12 H 4.059 8.001 -2.140 1.00 . B B . 20 ILE HD12 1 1 4 2846 2 1 20 ILE HD13 H 2.569 7.845 -1.208 1.00 . B B . 20 ILE HD13 1 1 4 2847 2 1 20 ILE HG12 H 3.055 10.385 -2.726 1.00 . B B . 20 ILE HG12 1 1 4 2848 2 1 20 ILE HG13 H 1.529 9.589 -2.328 1.00 . B B . 20 ILE HG13 1 1 4 2849 2 1 20 ILE HG21 H 3.988 7.994 -5.405 1.00 . B B . 20 ILE HG21 1 1 4 2850 2 1 20 ILE HG22 H 4.584 8.143 -3.749 1.00 . B B . 20 ILE HG22 1 1 4 2851 2 1 20 ILE HG23 H 4.387 9.584 -4.748 1.00 . B B . 20 ILE HG23 1 1 4 2852 2 1 20 ILE N N 0.304 9.228 -4.840 1.00 . B B . 20 ILE N 1 1 4 2853 2 1 20 ILE O O 2.788 10.225 -7.042 1.00 . B B . 20 ILE O 1 1 4 2854 2 1 21 MET C C 1.789 8.848 -9.297 1.00 . B B . 21 MET C 1 1 4 2855 2 1 21 MET CA C 2.429 7.879 -8.292 1.00 . B B . 21 MET CA 1 1 4 2856 2 1 21 MET CB C 2.061 6.423 -8.614 1.00 . B B . 21 MET CB 1 1 4 2857 2 1 21 MET CE C -0.833 6.611 -11.515 1.00 . B B . 21 MET CE 1 1 4 2858 2 1 21 MET CG C 0.681 6.347 -9.274 1.00 . B B . 21 MET CG 1 1 4 2859 2 1 21 MET H H 1.503 7.516 -6.386 1.00 . B B . 21 MET H 1 1 4 2860 2 1 21 MET HA H 3.503 7.983 -8.330 1.00 . B B . 21 MET HA 1 1 4 2861 2 1 21 MET HB2 H 2.802 6.007 -9.281 1.00 . B B . 21 MET HB2 1 1 4 2862 2 1 21 MET HB3 H 2.045 5.857 -7.692 1.00 . B B . 21 MET HB3 1 1 4 2863 2 1 21 MET HE1 H -1.146 5.979 -12.335 1.00 . B B . 21 MET HE1 1 1 4 2864 2 1 21 MET HE2 H -0.898 7.643 -11.816 1.00 . B B . 21 MET HE2 1 1 4 2865 2 1 21 MET HE3 H -1.475 6.445 -10.660 1.00 . B B . 21 MET HE3 1 1 4 2866 2 1 21 MET HG2 H 0.155 5.479 -8.902 1.00 . B B . 21 MET HG2 1 1 4 2867 2 1 21 MET HG3 H 0.121 7.240 -9.034 1.00 . B B . 21 MET HG3 1 1 4 2868 2 1 21 MET N N 1.966 8.197 -6.919 1.00 . B B . 21 MET N 1 1 4 2869 2 1 21 MET O O 2.325 9.098 -10.358 1.00 . B B . 21 MET O 1 1 4 2870 2 1 21 MET SD S 0.875 6.214 -11.069 1.00 . B B . 21 MET SD 1 1 4 2871 2 1 22 ASN C C 0.313 11.778 -9.510 1.00 . B B . 22 ASN C 1 1 4 2872 2 1 22 ASN CA C -0.023 10.338 -9.907 1.00 . B B . 22 ASN CA 1 1 4 2873 2 1 22 ASN CB C -1.539 10.136 -9.841 1.00 . B B . 22 ASN CB 1 1 4 2874 2 1 22 ASN CG C -2.186 10.734 -11.091 1.00 . B B . 22 ASN CG 1 1 4 2875 2 1 22 ASN H H 0.229 9.177 -8.109 1.00 . B B . 22 ASN H 1 1 4 2876 2 1 22 ASN HA H 0.321 10.154 -10.914 1.00 . B B . 22 ASN HA 1 1 4 2877 2 1 22 ASN HB2 H -1.759 9.079 -9.791 1.00 . B B . 22 ASN HB2 1 1 4 2878 2 1 22 ASN HB3 H -1.931 10.630 -8.962 1.00 . B B . 22 ASN HB3 1 1 4 2879 2 1 22 ASN HD21 H -3.405 11.922 -10.062 1.00 . B B . 22 ASN HD21 1 1 4 2880 2 1 22 ASN HD22 H -3.545 12.023 -11.760 1.00 . B B . 22 ASN HD22 1 1 4 2881 2 1 22 ASN N N 0.647 9.391 -8.971 1.00 . B B . 22 ASN N 1 1 4 2882 2 1 22 ASN ND2 N -3.123 11.635 -10.960 1.00 . B B . 22 ASN ND2 1 1 4 2883 2 1 22 ASN O O 0.655 12.597 -10.340 1.00 . B B . 22 ASN O 1 1 4 2884 2 1 22 ASN OD1 O -1.836 10.381 -12.199 1.00 . B B . 22 ASN OD1 1 1 4 2885 2 1 23 SER C C 1.971 13.826 -8.178 1.00 . B B . 23 SER C 1 1 4 2886 2 1 23 SER CA C 0.529 13.479 -7.802 1.00 . B B . 23 SER CA 1 1 4 2887 2 1 23 SER CB C 0.360 13.576 -6.284 1.00 . B B . 23 SER CB 1 1 4 2888 2 1 23 SER H H -0.062 11.418 -7.594 1.00 . B B . 23 SER H 1 1 4 2889 2 1 23 SER HA H -0.145 14.171 -8.283 1.00 . B B . 23 SER HA 1 1 4 2890 2 1 23 SER HB2 H -0.575 13.126 -5.996 1.00 . B B . 23 SER HB2 1 1 4 2891 2 1 23 SER HB3 H 1.174 13.052 -5.799 1.00 . B B . 23 SER HB3 1 1 4 2892 2 1 23 SER HG H -0.002 15.457 -6.624 1.00 . B B . 23 SER HG 1 1 4 2893 2 1 23 SER N N 0.217 12.092 -8.248 1.00 . B B . 23 SER N 1 1 4 2894 2 1 23 SER O O 2.814 13.806 -7.297 1.00 . B B . 23 SER O 1 1 4 2895 2 1 23 SER OXT O 2.206 14.104 -9.342 1.00 . B B . 23 SER OXT 1 1 4 2896 2 1 23 SER OG O 0.361 14.944 -5.898 1.00 . B B . 23 SER OG 1 1 5 2897 1 1 1 GLY C C -7.058 12.394 2.972 1.00 . A A . 1 GLY C 1 1 5 2898 1 1 1 GLY CA C -8.453 12.965 3.230 1.00 . A A . 1 GLY CA 1 1 5 2899 1 1 1 GLY H1 H -8.352 12.715 5.295 1.00 . A A . 1 GLY H1 1 1 5 2900 1 1 1 GLY H2 H -9.022 11.390 4.469 1.00 . A A . 1 GLY H2 1 1 5 2901 1 1 1 GLY H3 H -9.933 12.807 4.687 1.00 . A A . 1 GLY H3 1 1 5 2902 1 1 1 GLY HA2 H -9.116 12.681 2.425 1.00 . A A . 1 GLY HA2 1 1 5 2903 1 1 1 GLY HA3 H -8.394 14.040 3.285 1.00 . A A . 1 GLY HA3 1 1 5 2904 1 1 1 GLY N N -8.980 12.429 4.518 1.00 . A A . 1 GLY N 1 1 5 2905 1 1 1 GLY O O -6.810 11.220 3.165 1.00 . A A . 1 GLY O 1 1 5 2906 1 1 2 ILE C C -3.949 12.743 3.559 1.00 . A A . 2 ILE C 1 1 5 2907 1 1 2 ILE CA C -4.764 12.720 2.263 1.00 . A A . 2 ILE CA 1 1 5 2908 1 1 2 ILE CB C -4.093 13.620 1.223 1.00 . A A . 2 ILE CB 1 1 5 2909 1 1 2 ILE CD1 C -5.158 15.098 -0.487 1.00 . A A . 2 ILE CD1 1 1 5 2910 1 1 2 ILE CG1 C -4.945 13.649 -0.049 1.00 . A A . 2 ILE CG1 1 1 5 2911 1 1 2 ILE CG2 C -2.704 13.072 0.893 1.00 . A A . 2 ILE CG2 1 1 5 2912 1 1 2 ILE H H -6.362 14.159 2.385 1.00 . A A . 2 ILE H 1 1 5 2913 1 1 2 ILE HA H -4.812 11.708 1.888 1.00 . A A . 2 ILE HA 1 1 5 2914 1 1 2 ILE HB H -4.000 14.620 1.620 1.00 . A A . 2 ILE HB 1 1 5 2915 1 1 2 ILE HD11 H -6.178 15.391 -0.282 1.00 . A A . 2 ILE HD11 1 1 5 2916 1 1 2 ILE HD12 H -4.964 15.187 -1.545 1.00 . A A . 2 ILE HD12 1 1 5 2917 1 1 2 ILE HD13 H -4.483 15.742 0.058 1.00 . A A . 2 ILE HD13 1 1 5 2918 1 1 2 ILE HG12 H -4.437 13.105 -0.834 1.00 . A A . 2 ILE HG12 1 1 5 2919 1 1 2 ILE HG13 H -5.903 13.189 0.149 1.00 . A A . 2 ILE HG13 1 1 5 2920 1 1 2 ILE HG21 H -2.619 12.059 1.258 1.00 . A A . 2 ILE HG21 1 1 5 2921 1 1 2 ILE HG22 H -1.953 13.688 1.364 1.00 . A A . 2 ILE HG22 1 1 5 2922 1 1 2 ILE HG23 H -2.558 13.082 -0.177 1.00 . A A . 2 ILE HG23 1 1 5 2923 1 1 2 ILE N N -6.142 13.216 2.535 1.00 . A A . 2 ILE N 1 1 5 2924 1 1 2 ILE O O -3.260 13.700 3.854 1.00 . A A . 2 ILE O 1 1 5 2925 1 1 3 GLY C C -2.988 10.199 5.994 1.00 . A A . 3 GLY C 1 1 5 2926 1 1 3 GLY CA C -3.250 11.653 5.608 1.00 . A A . 3 GLY CA 1 1 5 2927 1 1 3 GLY H H -4.581 10.935 4.075 1.00 . A A . 3 GLY H 1 1 5 2928 1 1 3 GLY HA2 H -2.307 12.163 5.471 1.00 . A A . 3 GLY HA2 1 1 5 2929 1 1 3 GLY HA3 H -3.815 12.136 6.390 1.00 . A A . 3 GLY HA3 1 1 5 2930 1 1 3 GLY N N -4.021 11.696 4.333 1.00 . A A . 3 GLY N 1 1 5 2931 1 1 3 GLY O O -2.837 9.867 7.154 1.00 . A A . 3 GLY O 1 1 5 2932 1 1 4 LYS C C -1.860 7.314 4.153 1.00 . A A . 4 LYS C 1 1 5 2933 1 1 4 LYS CA C -2.659 7.897 5.315 1.00 . A A . 4 LYS CA 1 1 5 2934 1 1 4 LYS CB C -3.977 7.125 5.473 1.00 . A A . 4 LYS CB 1 1 5 2935 1 1 4 LYS CD C -5.824 8.724 6.005 1.00 . A A . 4 LYS CD 1 1 5 2936 1 1 4 LYS CE C -6.468 7.758 7.000 1.00 . A A . 4 LYS CE 1 1 5 2937 1 1 4 LYS CG C -5.141 7.931 4.889 1.00 . A A . 4 LYS CG 1 1 5 2938 1 1 4 LYS H H -3.041 9.630 4.100 1.00 . A A . 4 LYS H 1 1 5 2939 1 1 4 LYS HA H -2.080 7.814 6.224 1.00 . A A . 4 LYS HA 1 1 5 2940 1 1 4 LYS HB2 H -3.901 6.180 4.956 1.00 . A A . 4 LYS HB2 1 1 5 2941 1 1 4 LYS HB3 H -4.160 6.944 6.522 1.00 . A A . 4 LYS HB3 1 1 5 2942 1 1 4 LYS HD2 H -5.091 9.331 6.515 1.00 . A A . 4 LYS HD2 1 1 5 2943 1 1 4 LYS HD3 H -6.585 9.361 5.580 1.00 . A A . 4 LYS HD3 1 1 5 2944 1 1 4 LYS HE2 H -7.481 8.072 7.205 1.00 . A A . 4 LYS HE2 1 1 5 2945 1 1 4 LYS HE3 H -6.478 6.763 6.581 1.00 . A A . 4 LYS HE3 1 1 5 2946 1 1 4 LYS HG2 H -4.769 8.611 4.137 1.00 . A A . 4 LYS HG2 1 1 5 2947 1 1 4 LYS HG3 H -5.856 7.257 4.441 1.00 . A A . 4 LYS HG3 1 1 5 2948 1 1 4 LYS HZ1 H -4.984 6.987 8.240 1.00 . A A . 4 LYS HZ1 1 1 5 2949 1 1 4 LYS HZ2 H -6.329 7.608 9.073 1.00 . A A . 4 LYS HZ2 1 1 5 2950 1 1 4 LYS HZ3 H -5.195 8.664 8.376 1.00 . A A . 4 LYS HZ3 1 1 5 2951 1 1 4 LYS N N -2.923 9.334 5.026 1.00 . A A . 4 LYS N 1 1 5 2952 1 1 4 LYS NZ N -5.685 7.754 8.268 1.00 . A A . 4 LYS NZ 1 1 5 2953 1 1 4 LYS O O -0.921 6.567 4.342 1.00 . A A . 4 LYS O 1 1 5 2954 1 1 5 TYR C C -0.081 7.769 1.758 1.00 . A A . 5 TYR C 1 1 5 2955 1 1 5 TYR CA C -1.477 7.154 1.772 1.00 . A A . 5 TYR CA 1 1 5 2956 1 1 5 TYR CB C -2.217 7.552 0.503 1.00 . A A . 5 TYR CB 1 1 5 2957 1 1 5 TYR CD1 C -4.217 6.004 0.499 1.00 . A A . 5 TYR CD1 1 1 5 2958 1 1 5 TYR CD2 C -4.550 8.353 1.014 1.00 . A A . 5 TYR CD2 1 1 5 2959 1 1 5 TYR CE1 C -5.591 5.777 0.662 1.00 . A A . 5 TYR CE1 1 1 5 2960 1 1 5 TYR CE2 C -5.921 8.123 1.177 1.00 . A A . 5 TYR CE2 1 1 5 2961 1 1 5 TYR CG C -3.697 7.295 0.677 1.00 . A A . 5 TYR CG 1 1 5 2962 1 1 5 TYR CZ C -6.442 6.836 1.000 1.00 . A A . 5 TYR CZ 1 1 5 2963 1 1 5 TYR H H -2.972 8.277 2.817 1.00 . A A . 5 TYR H 1 1 5 2964 1 1 5 TYR HA H -1.401 6.084 1.821 1.00 . A A . 5 TYR HA 1 1 5 2965 1 1 5 TYR HB2 H -2.053 8.603 0.304 1.00 . A A . 5 TYR HB2 1 1 5 2966 1 1 5 TYR HB3 H -1.843 6.968 -0.316 1.00 . A A . 5 TYR HB3 1 1 5 2967 1 1 5 TYR HD1 H -3.562 5.183 0.240 1.00 . A A . 5 TYR HD1 1 1 5 2968 1 1 5 TYR HD2 H -4.150 9.346 1.149 1.00 . A A . 5 TYR HD2 1 1 5 2969 1 1 5 TYR HE1 H -5.993 4.784 0.524 1.00 . A A . 5 TYR HE1 1 1 5 2970 1 1 5 TYR HE2 H -6.577 8.940 1.438 1.00 . A A . 5 TYR HE2 1 1 5 2971 1 1 5 TYR HH H -8.018 5.799 0.706 1.00 . A A . 5 TYR HH 1 1 5 2972 1 1 5 TYR N N -2.220 7.665 2.949 1.00 . A A . 5 TYR N 1 1 5 2973 1 1 5 TYR O O 0.837 7.239 1.163 1.00 . A A . 5 TYR O 1 1 5 2974 1 1 5 TYR OH O -7.794 6.612 1.162 1.00 . A A . 5 TYR OH 1 1 5 2975 1 1 6 LEU C C 2.044 9.409 3.807 1.00 . A A . 6 LEU C 1 1 5 2976 1 1 6 LEU CA C 1.419 9.540 2.419 1.00 . A A . 6 LEU CA 1 1 5 2977 1 1 6 LEU CB C 1.250 11.020 2.070 1.00 . A A . 6 LEU CB 1 1 5 2978 1 1 6 LEU CD1 C 2.619 11.179 -0.016 1.00 . A A . 6 LEU CD1 1 1 5 2979 1 1 6 LEU CD2 C 0.383 10.065 -0.086 1.00 . A A . 6 LEU CD2 1 1 5 2980 1 1 6 LEU CG C 1.198 11.198 0.550 1.00 . A A . 6 LEU CG 1 1 5 2981 1 1 6 LEU H H -0.670 9.309 2.870 1.00 . A A . 6 LEU H 1 1 5 2982 1 1 6 LEU HA H 2.056 9.067 1.687 1.00 . A A . 6 LEU HA 1 1 5 2983 1 1 6 LEU HB2 H 0.330 11.387 2.506 1.00 . A A . 6 LEU HB2 1 1 5 2984 1 1 6 LEU HB3 H 2.083 11.579 2.468 1.00 . A A . 6 LEU HB3 1 1 5 2985 1 1 6 LEU HD11 H 3.000 10.169 0.005 1.00 . A A . 6 LEU HD11 1 1 5 2986 1 1 6 LEU HD12 H 3.253 11.816 0.582 1.00 . A A . 6 LEU HD12 1 1 5 2987 1 1 6 LEU HD13 H 2.605 11.537 -1.035 1.00 . A A . 6 LEU HD13 1 1 5 2988 1 1 6 LEU HD21 H -0.607 10.048 0.346 1.00 . A A . 6 LEU HD21 1 1 5 2989 1 1 6 LEU HD22 H 0.873 9.120 0.100 1.00 . A A . 6 LEU HD22 1 1 5 2990 1 1 6 LEU HD23 H 0.309 10.228 -1.151 1.00 . A A . 6 LEU HD23 1 1 5 2991 1 1 6 LEU HG H 0.733 12.145 0.321 1.00 . A A . 6 LEU HG 1 1 5 2992 1 1 6 LEU N N 0.085 8.890 2.402 1.00 . A A . 6 LEU N 1 1 5 2993 1 1 6 LEU O O 3.081 9.977 4.085 1.00 . A A . 6 LEU O 1 1 5 2994 1 1 7 HIS C C 1.836 7.065 6.518 1.00 . A A . 7 HIS C 1 1 5 2995 1 1 7 HIS CA C 2.002 8.510 6.049 1.00 . A A . 7 HIS CA 1 1 5 2996 1 1 7 HIS CB C 1.282 9.446 7.020 1.00 . A A . 7 HIS CB 1 1 5 2997 1 1 7 HIS CD2 C -0.058 11.556 6.217 1.00 . A A . 7 HIS CD2 1 1 5 2998 1 1 7 HIS CE1 C 1.571 12.627 5.270 1.00 . A A . 7 HIS CE1 1 1 5 2999 1 1 7 HIS CG C 1.065 10.782 6.363 1.00 . A A . 7 HIS CG 1 1 5 3000 1 1 7 HIS H H 0.592 8.213 4.446 1.00 . A A . 7 HIS H 1 1 5 3001 1 1 7 HIS HA H 3.051 8.755 6.024 1.00 . A A . 7 HIS HA 1 1 5 3002 1 1 7 HIS HB2 H 0.328 9.019 7.291 1.00 . A A . 7 HIS HB2 1 1 5 3003 1 1 7 HIS HB3 H 1.885 9.576 7.906 1.00 . A A . 7 HIS HB3 1 1 5 3004 1 1 7 HIS HD1 H 3.027 11.199 5.683 1.00 . A A . 7 HIS HD1 1 1 5 3005 1 1 7 HIS HD2 H -1.041 11.301 6.583 1.00 . A A . 7 HIS HD2 1 1 5 3006 1 1 7 HIS HE1 H 2.140 13.377 4.742 1.00 . A A . 7 HIS HE1 1 1 5 3007 1 1 7 HIS N N 1.428 8.665 4.685 1.00 . A A . 7 HIS N 1 1 5 3008 1 1 7 HIS ND1 N 2.091 11.483 5.752 1.00 . A A . 7 HIS ND1 1 1 5 3009 1 1 7 HIS NE2 N 0.263 12.721 5.526 1.00 . A A . 7 HIS NE2 1 1 5 3010 1 1 7 HIS O O 2.029 6.754 7.676 1.00 . A A . 7 HIS O 1 1 5 3011 1 1 8 SER C C 1.260 3.864 4.809 1.00 . A A . 8 SER C 1 1 5 3012 1 1 8 SER CA C 1.321 4.756 6.043 1.00 . A A . 8 SER CA 1 1 5 3013 1 1 8 SER CB C 0.038 4.604 6.864 1.00 . A A . 8 SER CB 1 1 5 3014 1 1 8 SER H H 1.339 6.439 4.699 1.00 . A A . 8 SER H 1 1 5 3015 1 1 8 SER HA H 2.167 4.463 6.638 1.00 . A A . 8 SER HA 1 1 5 3016 1 1 8 SER HB2 H 0.288 4.463 7.902 1.00 . A A . 8 SER HB2 1 1 5 3017 1 1 8 SER HB3 H -0.561 5.500 6.760 1.00 . A A . 8 SER HB3 1 1 5 3018 1 1 8 SER HG H -1.562 3.777 6.128 1.00 . A A . 8 SER HG 1 1 5 3019 1 1 8 SER N N 1.486 6.175 5.631 1.00 . A A . 8 SER N 1 1 5 3020 1 1 8 SER O O 1.775 2.762 4.805 1.00 . A A . 8 SER O 1 1 5 3021 1 1 8 SER OG O -0.693 3.475 6.403 1.00 . A A . 8 SER OG 1 1 5 3022 1 1 9 ALA C C 2.001 3.197 2.065 1.00 . A A . 9 ALA C 1 1 5 3023 1 1 9 ALA CA C 0.585 3.485 2.537 1.00 . A A . 9 ALA CA 1 1 5 3024 1 1 9 ALA CB C -0.147 4.230 1.431 1.00 . A A . 9 ALA CB 1 1 5 3025 1 1 9 ALA H H 0.248 5.218 3.772 1.00 . A A . 9 ALA H 1 1 5 3026 1 1 9 ALA HA H 0.074 2.558 2.754 1.00 . A A . 9 ALA HA 1 1 5 3027 1 1 9 ALA HB1 H 0.052 3.740 0.498 1.00 . A A . 9 ALA HB1 1 1 5 3028 1 1 9 ALA HB2 H 0.208 5.252 1.383 1.00 . A A . 9 ALA HB2 1 1 5 3029 1 1 9 ALA HB3 H -1.208 4.223 1.626 1.00 . A A . 9 ALA HB3 1 1 5 3030 1 1 9 ALA N N 0.652 4.324 3.759 1.00 . A A . 9 ALA N 1 1 5 3031 1 1 9 ALA O O 2.482 2.088 2.158 1.00 . A A . 9 ALA O 1 1 5 3032 1 1 10 LYS C C 4.791 2.963 1.849 1.00 . A A . 10 LYS C 1 1 5 3033 1 1 10 LYS CA C 4.059 4.042 1.049 1.00 . A A . 10 LYS CA 1 1 5 3034 1 1 10 LYS CB C 4.814 5.361 1.201 1.00 . A A . 10 LYS CB 1 1 5 3035 1 1 10 LYS CD C 5.142 7.404 -0.191 1.00 . A A . 10 LYS CD 1 1 5 3036 1 1 10 LYS CE C 5.968 7.972 0.963 1.00 . A A . 10 LYS CE 1 1 5 3037 1 1 10 LYS CG C 5.230 5.878 -0.177 1.00 . A A . 10 LYS CG 1 1 5 3038 1 1 10 LYS H H 2.211 5.082 1.494 1.00 . A A . 10 LYS H 1 1 5 3039 1 1 10 LYS HA H 4.036 3.762 0.007 1.00 . A A . 10 LYS HA 1 1 5 3040 1 1 10 LYS HB2 H 4.177 6.087 1.683 1.00 . A A . 10 LYS HB2 1 1 5 3041 1 1 10 LYS HB3 H 5.696 5.198 1.803 1.00 . A A . 10 LYS HB3 1 1 5 3042 1 1 10 LYS HD2 H 5.524 7.779 -1.129 1.00 . A A . 10 LYS HD2 1 1 5 3043 1 1 10 LYS HD3 H 4.112 7.704 -0.074 1.00 . A A . 10 LYS HD3 1 1 5 3044 1 1 10 LYS HE2 H 5.429 7.840 1.889 1.00 . A A . 10 LYS HE2 1 1 5 3045 1 1 10 LYS HE3 H 6.914 7.452 1.018 1.00 . A A . 10 LYS HE3 1 1 5 3046 1 1 10 LYS HG2 H 6.246 5.572 -0.385 1.00 . A A . 10 LYS HG2 1 1 5 3047 1 1 10 LYS HG3 H 4.570 5.472 -0.929 1.00 . A A . 10 LYS HG3 1 1 5 3048 1 1 10 LYS HZ1 H 5.911 9.961 1.570 1.00 . A A . 10 LYS HZ1 1 1 5 3049 1 1 10 LYS HZ2 H 5.665 9.739 -0.096 1.00 . A A . 10 LYS HZ2 1 1 5 3050 1 1 10 LYS HZ3 H 7.223 9.585 0.563 1.00 . A A . 10 LYS HZ3 1 1 5 3051 1 1 10 LYS N N 2.656 4.205 1.553 1.00 . A A . 10 LYS N 1 1 5 3052 1 1 10 LYS NZ N 6.210 9.424 0.733 1.00 . A A . 10 LYS NZ 1 1 5 3053 1 1 10 LYS O O 5.324 2.023 1.293 1.00 . A A . 10 LYS O 1 1 5 3054 1 1 11 LYS C C 5.090 0.672 3.461 1.00 . A A . 11 LYS C 1 1 5 3055 1 1 11 LYS CA C 5.506 2.049 3.971 1.00 . A A . 11 LYS CA 1 1 5 3056 1 1 11 LYS CB C 5.099 2.195 5.439 1.00 . A A . 11 LYS CB 1 1 5 3057 1 1 11 LYS CD C 5.837 3.807 7.194 1.00 . A A . 11 LYS CD 1 1 5 3058 1 1 11 LYS CE C 5.638 5.223 7.738 1.00 . A A . 11 LYS CE 1 1 5 3059 1 1 11 LYS CG C 5.138 3.671 5.840 1.00 . A A . 11 LYS CG 1 1 5 3060 1 1 11 LYS H H 4.376 3.843 3.584 1.00 . A A . 11 LYS H 1 1 5 3061 1 1 11 LYS HA H 6.576 2.162 3.874 1.00 . A A . 11 LYS HA 1 1 5 3062 1 1 11 LYS HB2 H 4.098 1.812 5.574 1.00 . A A . 11 LYS HB2 1 1 5 3063 1 1 11 LYS HB3 H 5.785 1.638 6.060 1.00 . A A . 11 LYS HB3 1 1 5 3064 1 1 11 LYS HD2 H 5.417 3.093 7.887 1.00 . A A . 11 LYS HD2 1 1 5 3065 1 1 11 LYS HD3 H 6.893 3.615 7.075 1.00 . A A . 11 LYS HD3 1 1 5 3066 1 1 11 LYS HE2 H 5.528 5.914 6.914 1.00 . A A . 11 LYS HE2 1 1 5 3067 1 1 11 LYS HE3 H 4.750 5.251 8.352 1.00 . A A . 11 LYS HE3 1 1 5 3068 1 1 11 LYS HG2 H 5.681 4.233 5.093 1.00 . A A . 11 LYS HG2 1 1 5 3069 1 1 11 LYS HG3 H 4.130 4.050 5.917 1.00 . A A . 11 LYS HG3 1 1 5 3070 1 1 11 LYS HZ1 H 6.525 6.262 9.310 1.00 . A A . 11 LYS HZ1 1 1 5 3071 1 1 11 LYS HZ2 H 7.525 6.076 7.949 1.00 . A A . 11 LYS HZ2 1 1 5 3072 1 1 11 LYS HZ3 H 7.240 4.759 8.983 1.00 . A A . 11 LYS HZ3 1 1 5 3073 1 1 11 LYS N N 4.816 3.082 3.150 1.00 . A A . 11 LYS N 1 1 5 3074 1 1 11 LYS NZ N 6.821 5.609 8.557 1.00 . A A . 11 LYS NZ 1 1 5 3075 1 1 11 LYS O O 5.885 -0.069 2.921 1.00 . A A . 11 LYS O 1 1 5 3076 1 1 12 PHE C C 3.472 -0.984 1.585 1.00 . A A . 12 PHE C 1 1 5 3077 1 1 12 PHE CA C 3.371 -0.986 3.110 1.00 . A A . 12 PHE CA 1 1 5 3078 1 1 12 PHE CB C 1.917 -1.208 3.531 1.00 . A A . 12 PHE CB 1 1 5 3079 1 1 12 PHE CD1 C 2.523 -1.304 5.975 1.00 . A A . 12 PHE CD1 1 1 5 3080 1 1 12 PHE CD2 C 0.766 0.211 5.269 1.00 . A A . 12 PHE CD2 1 1 5 3081 1 1 12 PHE CE1 C 2.351 -0.885 7.300 1.00 . A A . 12 PHE CE1 1 1 5 3082 1 1 12 PHE CE2 C 0.595 0.630 6.594 1.00 . A A . 12 PHE CE2 1 1 5 3083 1 1 12 PHE CG C 1.730 -0.755 4.960 1.00 . A A . 12 PHE CG 1 1 5 3084 1 1 12 PHE CZ C 1.387 0.081 7.609 1.00 . A A . 12 PHE CZ 1 1 5 3085 1 1 12 PHE H H 3.208 0.949 4.033 1.00 . A A . 12 PHE H 1 1 5 3086 1 1 12 PHE HA H 3.993 -1.770 3.515 1.00 . A A . 12 PHE HA 1 1 5 3087 1 1 12 PHE HB2 H 1.264 -0.639 2.884 1.00 . A A . 12 PHE HB2 1 1 5 3088 1 1 12 PHE HB3 H 1.678 -2.259 3.453 1.00 . A A . 12 PHE HB3 1 1 5 3089 1 1 12 PHE HD1 H 3.267 -2.049 5.737 1.00 . A A . 12 PHE HD1 1 1 5 3090 1 1 12 PHE HD2 H 0.155 0.633 4.486 1.00 . A A . 12 PHE HD2 1 1 5 3091 1 1 12 PHE HE1 H 2.962 -1.308 8.083 1.00 . A A . 12 PHE HE1 1 1 5 3092 1 1 12 PHE HE2 H -0.150 1.375 6.833 1.00 . A A . 12 PHE HE2 1 1 5 3093 1 1 12 PHE HZ H 1.255 0.405 8.631 1.00 . A A . 12 PHE HZ 1 1 5 3094 1 1 12 PHE N N 3.839 0.333 3.610 1.00 . A A . 12 PHE N 1 1 5 3095 1 1 12 PHE O O 3.691 -2.003 0.965 1.00 . A A . 12 PHE O 1 1 5 3096 1 1 13 GLY C C 4.623 -0.578 -0.963 1.00 . A A . 13 GLY C 1 1 5 3097 1 1 13 GLY CA C 3.418 0.237 -0.506 1.00 . A A . 13 GLY CA 1 1 5 3098 1 1 13 GLY H H 3.151 0.974 1.498 1.00 . A A . 13 GLY H 1 1 5 3099 1 1 13 GLY HA2 H 2.518 -0.159 -0.950 1.00 . A A . 13 GLY HA2 1 1 5 3100 1 1 13 GLY HA3 H 3.547 1.265 -0.808 1.00 . A A . 13 GLY HA3 1 1 5 3101 1 1 13 GLY N N 3.321 0.162 0.976 1.00 . A A . 13 GLY N 1 1 5 3102 1 1 13 GLY O O 4.588 -1.249 -1.976 1.00 . A A . 13 GLY O 1 1 5 3103 1 1 14 LYS C C 6.911 -2.648 0.114 1.00 . A A . 14 LYS C 1 1 5 3104 1 1 14 LYS CA C 6.906 -1.296 -0.602 1.00 . A A . 14 LYS CA 1 1 5 3105 1 1 14 LYS CB C 8.154 -0.513 -0.194 1.00 . A A . 14 LYS CB 1 1 5 3106 1 1 14 LYS CD C 9.818 0.854 -1.464 1.00 . A A . 14 LYS CD 1 1 5 3107 1 1 14 LYS CE C 9.964 1.764 -2.686 1.00 . A A . 14 LYS CE 1 1 5 3108 1 1 14 LYS CG C 8.334 0.683 -1.129 1.00 . A A . 14 LYS CG 1 1 5 3109 1 1 14 LYS H H 5.697 0.027 0.594 1.00 . A A . 14 LYS H 1 1 5 3110 1 1 14 LYS HA H 6.913 -1.453 -1.671 1.00 . A A . 14 LYS HA 1 1 5 3111 1 1 14 LYS HB2 H 8.041 -0.165 0.823 1.00 . A A . 14 LYS HB2 1 1 5 3112 1 1 14 LYS HB3 H 9.019 -1.156 -0.260 1.00 . A A . 14 LYS HB3 1 1 5 3113 1 1 14 LYS HD2 H 10.327 1.298 -0.621 1.00 . A A . 14 LYS HD2 1 1 5 3114 1 1 14 LYS HD3 H 10.251 -0.110 -1.680 1.00 . A A . 14 LYS HD3 1 1 5 3115 1 1 14 LYS HE2 H 9.213 1.506 -3.418 1.00 . A A . 14 LYS HE2 1 1 5 3116 1 1 14 LYS HE3 H 9.836 2.793 -2.386 1.00 . A A . 14 LYS HE3 1 1 5 3117 1 1 14 LYS HG2 H 7.777 0.515 -2.039 1.00 . A A . 14 LYS HG2 1 1 5 3118 1 1 14 LYS HG3 H 7.971 1.576 -0.645 1.00 . A A . 14 LYS HG3 1 1 5 3119 1 1 14 LYS HZ1 H 11.252 1.621 -4.317 1.00 . A A . 14 LYS HZ1 1 1 5 3120 1 1 14 LYS HZ2 H 11.708 0.664 -2.988 1.00 . A A . 14 LYS HZ2 1 1 5 3121 1 1 14 LYS HZ3 H 11.947 2.345 -2.950 1.00 . A A . 14 LYS HZ3 1 1 5 3122 1 1 14 LYS N N 5.693 -0.525 -0.219 1.00 . A A . 14 LYS N 1 1 5 3123 1 1 14 LYS NZ N 11.320 1.585 -3.279 1.00 . A A . 14 LYS NZ 1 1 5 3124 1 1 14 LYS O O 7.611 -3.562 -0.275 1.00 . A A . 14 LYS O 1 1 5 3125 1 1 15 ALA C C 4.873 -4.873 1.540 1.00 . A A . 15 ALA C 1 1 5 3126 1 1 15 ALA CA C 6.132 -4.079 1.900 1.00 . A A . 15 ALA CA 1 1 5 3127 1 1 15 ALA CB C 6.154 -3.811 3.406 1.00 . A A . 15 ALA CB 1 1 5 3128 1 1 15 ALA H H 5.595 -2.035 1.473 1.00 . A A . 15 ALA H 1 1 5 3129 1 1 15 ALA HA H 7.005 -4.650 1.625 1.00 . A A . 15 ALA HA 1 1 5 3130 1 1 15 ALA HB1 H 5.489 -2.992 3.635 1.00 . A A . 15 ALA HB1 1 1 5 3131 1 1 15 ALA HB2 H 7.158 -3.557 3.711 1.00 . A A . 15 ALA HB2 1 1 5 3132 1 1 15 ALA HB3 H 5.830 -4.697 3.933 1.00 . A A . 15 ALA HB3 1 1 5 3133 1 1 15 ALA N N 6.148 -2.784 1.164 1.00 . A A . 15 ALA N 1 1 5 3134 1 1 15 ALA O O 4.633 -5.942 2.064 1.00 . A A . 15 ALA O 1 1 5 3135 1 1 16 TRP C C 2.859 -5.358 -1.246 1.00 . A A . 16 TRP C 1 1 5 3136 1 1 16 TRP CA C 2.829 -5.086 0.260 1.00 . A A . 16 TRP CA 1 1 5 3137 1 1 16 TRP CB C 1.601 -4.241 0.647 1.00 . A A . 16 TRP CB 1 1 5 3138 1 1 16 TRP CD1 C 1.215 -2.022 -0.504 1.00 . A A . 16 TRP CD1 1 1 5 3139 1 1 16 TRP CD2 C 0.593 -3.769 -1.763 1.00 . A A . 16 TRP CD2 1 1 5 3140 1 1 16 TRP CE2 C 0.330 -2.608 -2.527 1.00 . A A . 16 TRP CE2 1 1 5 3141 1 1 16 TRP CE3 C 0.288 -5.015 -2.324 1.00 . A A . 16 TRP CE3 1 1 5 3142 1 1 16 TRP CG C 1.161 -3.371 -0.489 1.00 . A A . 16 TRP CG 1 1 5 3143 1 1 16 TRP CH2 C -0.516 -3.932 -4.354 1.00 . A A . 16 TRP CH2 1 1 5 3144 1 1 16 TRP CZ2 C -0.217 -2.682 -3.807 1.00 . A A . 16 TRP CZ2 1 1 5 3145 1 1 16 TRP CZ3 C -0.264 -5.097 -3.614 1.00 . A A . 16 TRP CZ3 1 1 5 3146 1 1 16 TRP H H 4.277 -3.497 0.241 1.00 . A A . 16 TRP H 1 1 5 3147 1 1 16 TRP HA H 2.787 -6.031 0.785 1.00 . A A . 16 TRP HA 1 1 5 3148 1 1 16 TRP HB2 H 0.795 -4.897 0.917 1.00 . A A . 16 TRP HB2 1 1 5 3149 1 1 16 TRP HB3 H 1.853 -3.621 1.495 1.00 . A A . 16 TRP HB3 1 1 5 3150 1 1 16 TRP HD1 H 1.580 -1.402 0.299 1.00 . A A . 16 TRP HD1 1 1 5 3151 1 1 16 TRP HE1 H 0.665 -0.627 -1.980 1.00 . A A . 16 TRP HE1 1 1 5 3152 1 1 16 TRP HE3 H 0.477 -5.916 -1.756 1.00 . A A . 16 TRP HE3 1 1 5 3153 1 1 16 TRP HH2 H -0.939 -4.002 -5.344 1.00 . A A . 16 TRP HH2 1 1 5 3154 1 1 16 TRP HZ2 H -0.409 -1.780 -4.371 1.00 . A A . 16 TRP HZ2 1 1 5 3155 1 1 16 TRP HZ3 H -0.496 -6.059 -4.038 1.00 . A A . 16 TRP HZ3 1 1 5 3156 1 1 16 TRP N N 4.068 -4.360 0.651 1.00 . A A . 16 TRP N 1 1 5 3157 1 1 16 TRP NE1 N 0.728 -1.567 -1.714 1.00 . A A . 16 TRP NE1 1 1 5 3158 1 1 16 TRP O O 2.600 -6.458 -1.693 1.00 . A A . 16 TRP O 1 1 5 3159 1 1 17 VAL C C 4.294 -5.658 -3.788 1.00 . A A . 17 VAL C 1 1 5 3160 1 1 17 VAL CA C 3.239 -4.585 -3.501 1.00 . A A . 17 VAL CA 1 1 5 3161 1 1 17 VAL CB C 3.573 -3.254 -4.205 1.00 . A A . 17 VAL CB 1 1 5 3162 1 1 17 VAL CG1 C 5.006 -3.252 -4.752 1.00 . A A . 17 VAL CG1 1 1 5 3163 1 1 17 VAL CG2 C 2.591 -3.044 -5.359 1.00 . A A . 17 VAL CG2 1 1 5 3164 1 1 17 VAL H H 3.397 -3.489 -1.653 1.00 . A A . 17 VAL H 1 1 5 3165 1 1 17 VAL HA H 2.275 -4.938 -3.843 1.00 . A A . 17 VAL HA 1 1 5 3166 1 1 17 VAL HB H 3.464 -2.444 -3.498 1.00 . A A . 17 VAL HB 1 1 5 3167 1 1 17 VAL HG11 H 5.706 -3.236 -3.929 1.00 . A A . 17 VAL HG11 1 1 5 3168 1 1 17 VAL HG12 H 5.156 -2.378 -5.369 1.00 . A A . 17 VAL HG12 1 1 5 3169 1 1 17 VAL HG13 H 5.166 -4.142 -5.344 1.00 . A A . 17 VAL HG13 1 1 5 3170 1 1 17 VAL HG21 H 3.139 -2.853 -6.269 1.00 . A A . 17 VAL HG21 1 1 5 3171 1 1 17 VAL HG22 H 1.952 -2.201 -5.139 1.00 . A A . 17 VAL HG22 1 1 5 3172 1 1 17 VAL HG23 H 1.986 -3.931 -5.482 1.00 . A A . 17 VAL HG23 1 1 5 3173 1 1 17 VAL N N 3.183 -4.368 -2.031 1.00 . A A . 17 VAL N 1 1 5 3174 1 1 17 VAL O O 4.038 -6.635 -4.463 1.00 . A A . 17 VAL O 1 1 5 3175 1 1 18 GLY C C 6.005 -7.879 -2.998 1.00 . A A . 18 GLY C 1 1 5 3176 1 1 18 GLY CA C 6.531 -6.524 -3.474 1.00 . A A . 18 GLY CA 1 1 5 3177 1 1 18 GLY H H 5.659 -4.715 -2.693 1.00 . A A . 18 GLY H 1 1 5 3178 1 1 18 GLY HA2 H 6.769 -6.574 -4.528 1.00 . A A . 18 GLY HA2 1 1 5 3179 1 1 18 GLY HA3 H 7.413 -6.264 -2.913 1.00 . A A . 18 GLY HA3 1 1 5 3180 1 1 18 GLY N N 5.474 -5.498 -3.253 1.00 . A A . 18 GLY N 1 1 5 3181 1 1 18 GLY O O 6.543 -8.916 -3.326 1.00 . A A . 18 GLY O 1 1 5 3182 1 1 19 GLU C C 3.308 -9.607 -2.723 1.00 . A A . 19 GLU C 1 1 5 3183 1 1 19 GLU CA C 4.366 -9.144 -1.736 1.00 . A A . 19 GLU CA 1 1 5 3184 1 1 19 GLU CB C 3.691 -8.896 -0.387 1.00 . A A . 19 GLU CB 1 1 5 3185 1 1 19 GLU CD C 5.977 -8.484 0.530 1.00 . A A . 19 GLU CD 1 1 5 3186 1 1 19 GLU CG C 4.546 -7.947 0.448 1.00 . A A . 19 GLU CG 1 1 5 3187 1 1 19 GLU H H 4.526 -7.028 -1.985 1.00 . A A . 19 GLU H 1 1 5 3188 1 1 19 GLU HA H 5.135 -9.893 -1.634 1.00 . A A . 19 GLU HA 1 1 5 3189 1 1 19 GLU HB2 H 2.715 -8.448 -0.556 1.00 . A A . 19 GLU HB2 1 1 5 3190 1 1 19 GLU HB3 H 3.574 -9.833 0.137 1.00 . A A . 19 GLU HB3 1 1 5 3191 1 1 19 GLU HG2 H 4.551 -6.970 -0.013 1.00 . A A . 19 GLU HG2 1 1 5 3192 1 1 19 GLU HG3 H 4.134 -7.875 1.442 1.00 . A A . 19 GLU HG3 1 1 5 3193 1 1 19 GLU N N 4.947 -7.873 -2.230 1.00 . A A . 19 GLU N 1 1 5 3194 1 1 19 GLU O O 3.437 -10.628 -3.370 1.00 . A A . 19 GLU O 1 1 5 3195 1 1 19 GLU OE1 O 6.607 -8.598 -0.509 1.00 . A A . 19 GLU OE1 1 1 5 3196 1 1 19 GLU OE2 O 6.419 -8.771 1.630 1.00 . A A . 19 GLU OE2 1 1 5 3197 1 1 20 ILE C C 1.621 -8.982 -5.208 1.00 . A A . 20 ILE C 1 1 5 3198 1 1 20 ILE CA C 1.168 -9.225 -3.768 1.00 . A A . 20 ILE CA 1 1 5 3199 1 1 20 ILE CB C -0.043 -8.355 -3.450 1.00 . A A . 20 ILE CB 1 1 5 3200 1 1 20 ILE CD1 C -1.794 -7.900 -1.728 1.00 . A A . 20 ILE CD1 1 1 5 3201 1 1 20 ILE CG1 C -0.727 -8.892 -2.197 1.00 . A A . 20 ILE CG1 1 1 5 3202 1 1 20 ILE CG2 C -1.030 -8.370 -4.621 1.00 . A A . 20 ILE CG2 1 1 5 3203 1 1 20 ILE H H 2.176 -8.033 -2.292 1.00 . A A . 20 ILE H 1 1 5 3204 1 1 20 ILE HA H 0.918 -10.261 -3.633 1.00 . A A . 20 ILE HA 1 1 5 3205 1 1 20 ILE HB H 0.294 -7.349 -3.268 1.00 . A A . 20 ILE HB 1 1 5 3206 1 1 20 ILE HD11 H -2.686 -8.439 -1.444 1.00 . A A . 20 ILE HD11 1 1 5 3207 1 1 20 ILE HD12 H -2.028 -7.215 -2.530 1.00 . A A . 20 ILE HD12 1 1 5 3208 1 1 20 ILE HD13 H -1.423 -7.347 -0.879 1.00 . A A . 20 ILE HD13 1 1 5 3209 1 1 20 ILE HG12 H -1.189 -9.843 -2.422 1.00 . A A . 20 ILE HG12 1 1 5 3210 1 1 20 ILE HG13 H 0.011 -9.019 -1.419 1.00 . A A . 20 ILE HG13 1 1 5 3211 1 1 20 ILE HG21 H -1.092 -9.368 -5.027 1.00 . A A . 20 ILE HG21 1 1 5 3212 1 1 20 ILE HG22 H -0.690 -7.689 -5.386 1.00 . A A . 20 ILE HG22 1 1 5 3213 1 1 20 ILE HG23 H -2.005 -8.061 -4.272 1.00 . A A . 20 ILE HG23 1 1 5 3214 1 1 20 ILE N N 2.255 -8.854 -2.835 1.00 . A A . 20 ILE N 1 1 5 3215 1 1 20 ILE O O 1.463 -9.820 -6.073 1.00 . A A . 20 ILE O 1 1 5 3216 1 1 21 MET C C 3.676 -8.561 -7.291 1.00 . A A . 21 MET C 1 1 5 3217 1 1 21 MET CA C 2.641 -7.525 -6.847 1.00 . A A . 21 MET CA 1 1 5 3218 1 1 21 MET CB C 3.260 -6.129 -6.863 1.00 . A A . 21 MET CB 1 1 5 3219 1 1 21 MET CE C 3.694 -4.553 -10.452 1.00 . A A . 21 MET CE 1 1 5 3220 1 1 21 MET CG C 2.708 -5.336 -8.047 1.00 . A A . 21 MET CG 1 1 5 3221 1 1 21 MET H H 2.293 -7.175 -4.754 1.00 . A A . 21 MET H 1 1 5 3222 1 1 21 MET HA H 1.798 -7.550 -7.523 1.00 . A A . 21 MET HA 1 1 5 3223 1 1 21 MET HB2 H 3.008 -5.618 -5.942 1.00 . A A . 21 MET HB2 1 1 5 3224 1 1 21 MET HB3 H 4.334 -6.210 -6.952 1.00 . A A . 21 MET HB3 1 1 5 3225 1 1 21 MET HE1 H 4.171 -4.788 -11.394 1.00 . A A . 21 MET HE1 1 1 5 3226 1 1 21 MET HE2 H 4.370 -3.974 -9.844 1.00 . A A . 21 MET HE2 1 1 5 3227 1 1 21 MET HE3 H 2.795 -3.981 -10.631 1.00 . A A . 21 MET HE3 1 1 5 3228 1 1 21 MET HG2 H 1.627 -5.348 -8.011 1.00 . A A . 21 MET HG2 1 1 5 3229 1 1 21 MET HG3 H 3.062 -4.316 -7.992 1.00 . A A . 21 MET HG3 1 1 5 3230 1 1 21 MET N N 2.179 -7.836 -5.469 1.00 . A A . 21 MET N 1 1 5 3231 1 1 21 MET O O 3.944 -8.720 -8.465 1.00 . A A . 21 MET O 1 1 5 3232 1 1 21 MET SD S 3.270 -6.089 -9.594 1.00 . A A . 21 MET SD 1 1 5 3233 1 1 22 ASN C C 4.632 -11.690 -6.638 1.00 . A A . 22 ASN C 1 1 5 3234 1 1 22 ASN CA C 5.267 -10.302 -6.738 1.00 . A A . 22 ASN CA 1 1 5 3235 1 1 22 ASN CB C 6.462 -10.224 -5.787 1.00 . A A . 22 ASN CB 1 1 5 3236 1 1 22 ASN CG C 7.154 -8.868 -5.949 1.00 . A A . 22 ASN CG 1 1 5 3237 1 1 22 ASN H H 4.025 -9.134 -5.419 1.00 . A A . 22 ASN H 1 1 5 3238 1 1 22 ASN HA H 5.599 -10.129 -7.751 1.00 . A A . 22 ASN HA 1 1 5 3239 1 1 22 ASN HB2 H 6.118 -10.338 -4.769 1.00 . A A . 22 ASN HB2 1 1 5 3240 1 1 22 ASN HB3 H 7.162 -11.013 -6.023 1.00 . A A . 22 ASN HB3 1 1 5 3241 1 1 22 ASN HD21 H 8.643 -9.322 -4.712 1.00 . A A . 22 ASN HD21 1 1 5 3242 1 1 22 ASN HD22 H 8.713 -7.762 -5.401 1.00 . A A . 22 ASN HD22 1 1 5 3243 1 1 22 ASN N N 4.257 -9.272 -6.362 1.00 . A A . 22 ASN N 1 1 5 3244 1 1 22 ASN ND2 N 8.261 -8.631 -5.299 1.00 . A A . 22 ASN ND2 1 1 5 3245 1 1 22 ASN O O 4.936 -12.581 -7.406 1.00 . A A . 22 ASN O 1 1 5 3246 1 1 22 ASN OD1 O 6.681 -8.015 -6.673 1.00 . A A . 22 ASN OD1 1 1 5 3247 1 1 23 SER C C 2.477 -13.626 -6.877 1.00 . A A . 23 SER C 1 1 5 3248 1 1 23 SER CA C 3.092 -13.204 -5.541 1.00 . A A . 23 SER CA 1 1 5 3249 1 1 23 SER CB C 1.993 -13.104 -4.484 1.00 . A A . 23 SER CB 1 1 5 3250 1 1 23 SER H H 3.521 -11.143 -5.087 1.00 . A A . 23 SER H 1 1 5 3251 1 1 23 SER HA H 3.823 -13.936 -5.233 1.00 . A A . 23 SER HA 1 1 5 3252 1 1 23 SER HB2 H 1.753 -14.087 -4.118 1.00 . A A . 23 SER HB2 1 1 5 3253 1 1 23 SER HB3 H 2.341 -12.490 -3.662 1.00 . A A . 23 SER HB3 1 1 5 3254 1 1 23 SER HG H 0.190 -12.384 -4.368 1.00 . A A . 23 SER HG 1 1 5 3255 1 1 23 SER N N 3.750 -11.877 -5.695 1.00 . A A . 23 SER N 1 1 5 3256 1 1 23 SER O O 1.701 -12.856 -7.418 1.00 . A A . 23 SER O 1 1 5 3257 1 1 23 SER OXT O 2.794 -14.712 -7.335 1.00 . A A . 23 SER OXT 1 1 5 3258 1 1 23 SER OG O 0.832 -12.525 -5.067 1.00 . A A . 23 SER OG 1 1 5 3259 2 1 1 GLY C C 4.501 -10.675 7.001 1.00 . B B . 1 GLY C 1 1 5 3260 2 1 1 GLY CA C 5.420 -11.200 8.105 1.00 . B B . 1 GLY CA 1 1 5 3261 2 1 1 GLY H1 H 7.424 -11.749 8.241 1.00 . B B . 1 GLY H1 1 1 5 3262 2 1 1 GLY H2 H 7.006 -11.010 6.769 1.00 . B B . 1 GLY H2 1 1 5 3263 2 1 1 GLY H3 H 6.549 -12.617 7.077 1.00 . B B . 1 GLY H3 1 1 5 3264 2 1 1 GLY HA2 H 4.936 -12.017 8.621 1.00 . B B . 1 GLY HA2 1 1 5 3265 2 1 1 GLY HA3 H 5.629 -10.404 8.804 1.00 . B B . 1 GLY HA3 1 1 5 3266 2 1 1 GLY N N 6.696 -11.680 7.503 1.00 . B B . 1 GLY N 1 1 5 3267 2 1 1 GLY O O 4.917 -9.932 6.135 1.00 . B B . 1 GLY O 1 1 5 3268 2 1 2 ILE C C 0.898 -10.471 6.557 1.00 . B B . 2 ILE C 1 1 5 3269 2 1 2 ILE CA C 2.310 -10.577 5.973 1.00 . B B . 2 ILE CA 1 1 5 3270 2 1 2 ILE CB C 2.311 -11.563 4.804 1.00 . B B . 2 ILE CB 1 1 5 3271 2 1 2 ILE CD1 C 2.472 -13.981 4.196 1.00 . B B . 2 ILE CD1 1 1 5 3272 2 1 2 ILE CG1 C 2.239 -12.994 5.341 1.00 . B B . 2 ILE CG1 1 1 5 3273 2 1 2 ILE CG2 C 3.597 -11.390 3.992 1.00 . B B . 2 ILE CG2 1 1 5 3274 2 1 2 ILE H H 2.935 -11.655 7.730 1.00 . B B . 2 ILE H 1 1 5 3275 2 1 2 ILE HA H 2.627 -9.607 5.623 1.00 . B B . 2 ILE HA 1 1 5 3276 2 1 2 ILE HB H 1.458 -11.370 4.171 1.00 . B B . 2 ILE HB 1 1 5 3277 2 1 2 ILE HD11 H 1.633 -14.659 4.129 1.00 . B B . 2 ILE HD11 1 1 5 3278 2 1 2 ILE HD12 H 3.374 -14.544 4.384 1.00 . B B . 2 ILE HD12 1 1 5 3279 2 1 2 ILE HD13 H 2.572 -13.439 3.267 1.00 . B B . 2 ILE HD13 1 1 5 3280 2 1 2 ILE HG12 H 2.998 -13.133 6.098 1.00 . B B . 2 ILE HG12 1 1 5 3281 2 1 2 ILE HG13 H 1.263 -13.168 5.771 1.00 . B B . 2 ILE HG13 1 1 5 3282 2 1 2 ILE HG21 H 3.627 -10.396 3.571 1.00 . B B . 2 ILE HG21 1 1 5 3283 2 1 2 ILE HG22 H 3.622 -12.120 3.196 1.00 . B B . 2 ILE HG22 1 1 5 3284 2 1 2 ILE HG23 H 4.452 -11.534 4.638 1.00 . B B . 2 ILE HG23 1 1 5 3285 2 1 2 ILE N N 3.252 -11.055 7.023 1.00 . B B . 2 ILE N 1 1 5 3286 2 1 2 ILE O O 0.035 -11.276 6.266 1.00 . B B . 2 ILE O 1 1 5 3287 2 1 3 GLY C C -1.261 -7.944 7.679 1.00 . B B . 3 GLY C 1 1 5 3288 2 1 3 GLY CA C -0.705 -9.337 7.983 1.00 . B B . 3 GLY CA 1 1 5 3289 2 1 3 GLY H H 1.363 -8.850 7.607 1.00 . B B . 3 GLY H 1 1 5 3290 2 1 3 GLY HA2 H -1.365 -10.083 7.565 1.00 . B B . 3 GLY HA2 1 1 5 3291 2 1 3 GLY HA3 H -0.643 -9.469 9.053 1.00 . B B . 3 GLY HA3 1 1 5 3292 2 1 3 GLY N N 0.654 -9.487 7.382 1.00 . B B . 3 GLY N 1 1 5 3293 2 1 3 GLY O O -2.449 -7.708 7.773 1.00 . B B . 3 GLY O 1 1 5 3294 2 1 4 LYS C C -0.582 -5.329 5.532 1.00 . B B . 4 LYS C 1 1 5 3295 2 1 4 LYS CA C -0.911 -5.650 6.990 1.00 . B B . 4 LYS CA 1 1 5 3296 2 1 4 LYS CB C -0.243 -4.608 7.901 1.00 . B B . 4 LYS CB 1 1 5 3297 2 1 4 LYS CD C 0.962 -4.355 10.081 1.00 . B B . 4 LYS CD 1 1 5 3298 2 1 4 LYS CE C -0.042 -4.647 11.198 1.00 . B B . 4 LYS CE 1 1 5 3299 2 1 4 LYS CG C 0.700 -5.291 8.899 1.00 . B B . 4 LYS CG 1 1 5 3300 2 1 4 LYS H H 0.536 -7.228 7.231 1.00 . B B . 4 LYS H 1 1 5 3301 2 1 4 LYS HA H -1.982 -5.613 7.130 1.00 . B B . 4 LYS HA 1 1 5 3302 2 1 4 LYS HB2 H 0.322 -3.916 7.295 1.00 . B B . 4 LYS HB2 1 1 5 3303 2 1 4 LYS HB3 H -1.005 -4.068 8.444 1.00 . B B . 4 LYS HB3 1 1 5 3304 2 1 4 LYS HD2 H 1.966 -4.512 10.448 1.00 . B B . 4 LYS HD2 1 1 5 3305 2 1 4 LYS HD3 H 0.851 -3.330 9.761 1.00 . B B . 4 LYS HD3 1 1 5 3306 2 1 4 LYS HE2 H -0.975 -4.980 10.766 1.00 . B B . 4 LYS HE2 1 1 5 3307 2 1 4 LYS HE3 H 0.351 -5.420 11.841 1.00 . B B . 4 LYS HE3 1 1 5 3308 2 1 4 LYS HG2 H 0.246 -6.204 9.256 1.00 . B B . 4 LYS HG2 1 1 5 3309 2 1 4 LYS HG3 H 1.635 -5.520 8.410 1.00 . B B . 4 LYS HG3 1 1 5 3310 2 1 4 LYS HZ1 H -0.887 -2.761 11.457 1.00 . B B . 4 LYS HZ1 1 1 5 3311 2 1 4 LYS HZ2 H 0.635 -2.946 12.190 1.00 . B B . 4 LYS HZ2 1 1 5 3312 2 1 4 LYS HZ3 H -0.740 -3.655 12.891 1.00 . B B . 4 LYS HZ3 1 1 5 3313 2 1 4 LYS N N -0.419 -7.021 7.308 1.00 . B B . 4 LYS N 1 1 5 3314 2 1 4 LYS NZ N -0.277 -3.409 11.994 1.00 . B B . 4 LYS NZ 1 1 5 3315 2 1 4 LYS O O -1.050 -4.354 4.978 1.00 . B B . 4 LYS O 1 1 5 3316 2 1 5 TYR C C -0.352 -6.694 2.587 1.00 . B B . 5 TYR C 1 1 5 3317 2 1 5 TYR CA C 0.586 -5.900 3.495 1.00 . B B . 5 TYR CA 1 1 5 3318 2 1 5 TYR CB C 2.035 -6.330 3.281 1.00 . B B . 5 TYR CB 1 1 5 3319 2 1 5 TYR CD1 C 2.906 -6.852 5.590 1.00 . B B . 5 TYR CD1 1 1 5 3320 2 1 5 TYR CD2 C 3.546 -4.758 4.550 1.00 . B B . 5 TYR CD2 1 1 5 3321 2 1 5 TYR CE1 C 3.657 -6.521 6.723 1.00 . B B . 5 TYR CE1 1 1 5 3322 2 1 5 TYR CE2 C 4.299 -4.426 5.684 1.00 . B B . 5 TYR CE2 1 1 5 3323 2 1 5 TYR CG C 2.848 -5.972 4.504 1.00 . B B . 5 TYR CG 1 1 5 3324 2 1 5 TYR CZ C 4.355 -5.308 6.770 1.00 . B B . 5 TYR CZ 1 1 5 3325 2 1 5 TYR H H 0.588 -6.923 5.368 1.00 . B B . 5 TYR H 1 1 5 3326 2 1 5 TYR HA H 0.489 -4.857 3.273 1.00 . B B . 5 TYR HA 1 1 5 3327 2 1 5 TYR HB2 H 2.079 -7.396 3.112 1.00 . B B . 5 TYR HB2 1 1 5 3328 2 1 5 TYR HB3 H 2.435 -5.809 2.431 1.00 . B B . 5 TYR HB3 1 1 5 3329 2 1 5 TYR HD1 H 2.367 -7.786 5.554 1.00 . B B . 5 TYR HD1 1 1 5 3330 2 1 5 TYR HD2 H 3.502 -4.078 3.712 1.00 . B B . 5 TYR HD2 1 1 5 3331 2 1 5 TYR HE1 H 3.700 -7.201 7.560 1.00 . B B . 5 TYR HE1 1 1 5 3332 2 1 5 TYR HE2 H 4.836 -3.490 5.719 1.00 . B B . 5 TYR HE2 1 1 5 3333 2 1 5 TYR HH H 4.934 -5.652 8.556 1.00 . B B . 5 TYR HH 1 1 5 3334 2 1 5 TYR N N 0.221 -6.145 4.907 1.00 . B B . 5 TYR N 1 1 5 3335 2 1 5 TYR O O -0.477 -6.422 1.411 1.00 . B B . 5 TYR O 1 1 5 3336 2 1 5 TYR OH O 5.096 -4.981 7.887 1.00 . B B . 5 TYR OH 1 1 5 3337 2 1 6 LEU C C -3.384 -8.260 2.782 1.00 . B B . 6 LEU C 1 1 5 3338 2 1 6 LEU CA C -1.956 -8.472 2.293 1.00 . B B . 6 LEU CA 1 1 5 3339 2 1 6 LEU CB C -1.591 -9.951 2.420 1.00 . B B . 6 LEU CB 1 1 5 3340 2 1 6 LEU CD1 C -1.080 -10.738 0.106 1.00 . B B . 6 LEU CD1 1 1 5 3341 2 1 6 LEU CD2 C 0.449 -9.099 1.206 1.00 . B B . 6 LEU CD2 1 1 5 3342 2 1 6 LEU CG C -0.469 -10.308 1.439 1.00 . B B . 6 LEU CG 1 1 5 3343 2 1 6 LEU H H -0.913 -7.879 4.077 1.00 . B B . 6 LEU H 1 1 5 3344 2 1 6 LEU HA H -1.874 -8.163 1.262 1.00 . B B . 6 LEU HA 1 1 5 3345 2 1 6 LEU HB2 H -1.260 -10.151 3.428 1.00 . B B . 6 LEU HB2 1 1 5 3346 2 1 6 LEU HB3 H -2.460 -10.553 2.203 1.00 . B B . 6 LEU HB3 1 1 5 3347 2 1 6 LEU HD11 H -1.656 -9.921 -0.303 1.00 . B B . 6 LEU HD11 1 1 5 3348 2 1 6 LEU HD12 H -1.726 -11.589 0.264 1.00 . B B . 6 LEU HD12 1 1 5 3349 2 1 6 LEU HD13 H -0.293 -11.005 -0.582 1.00 . B B . 6 LEU HD13 1 1 5 3350 2 1 6 LEU HD21 H 0.771 -8.700 2.156 1.00 . B B . 6 LEU HD21 1 1 5 3351 2 1 6 LEU HD22 H -0.091 -8.337 0.660 1.00 . B B . 6 LEU HD22 1 1 5 3352 2 1 6 LEU HD23 H 1.313 -9.408 0.634 1.00 . B B . 6 LEU HD23 1 1 5 3353 2 1 6 LEU HG H 0.106 -11.124 1.851 1.00 . B B . 6 LEU HG 1 1 5 3354 2 1 6 LEU N N -1.022 -7.672 3.126 1.00 . B B . 6 LEU N 1 1 5 3355 2 1 6 LEU O O -4.274 -9.029 2.479 1.00 . B B . 6 LEU O 1 1 5 3356 2 1 7 HIS C C -5.201 -5.504 4.340 1.00 . B B . 7 HIS C 1 1 5 3357 2 1 7 HIS CA C -4.986 -6.996 4.067 1.00 . B B . 7 HIS CA 1 1 5 3358 2 1 7 HIS CB C -5.182 -7.799 5.360 1.00 . B B . 7 HIS CB 1 1 5 3359 2 1 7 HIS CD2 C -2.908 -9.109 5.451 1.00 . B B . 7 HIS CD2 1 1 5 3360 2 1 7 HIS CE1 C -3.672 -11.110 5.136 1.00 . B B . 7 HIS CE1 1 1 5 3361 2 1 7 HIS CG C -4.272 -8.999 5.340 1.00 . B B . 7 HIS CG 1 1 5 3362 2 1 7 HIS H H -2.876 -6.637 3.796 1.00 . B B . 7 HIS H 1 1 5 3363 2 1 7 HIS HA H -5.703 -7.328 3.331 1.00 . B B . 7 HIS HA 1 1 5 3364 2 1 7 HIS HB2 H -4.940 -7.177 6.212 1.00 . B B . 7 HIS HB2 1 1 5 3365 2 1 7 HIS HB3 H -6.209 -8.126 5.432 1.00 . B B . 7 HIS HB3 1 1 5 3366 2 1 7 HIS HD1 H -5.677 -10.554 5.026 1.00 . B B . 7 HIS HD1 1 1 5 3367 2 1 7 HIS HD2 H -2.230 -8.285 5.601 1.00 . B B . 7 HIS HD2 1 1 5 3368 2 1 7 HIS HE1 H -3.728 -12.177 4.984 1.00 . B B . 7 HIS HE1 1 1 5 3369 2 1 7 HIS N N -3.610 -7.235 3.550 1.00 . B B . 7 HIS N 1 1 5 3370 2 1 7 HIS ND1 N -4.740 -10.289 5.141 1.00 . B B . 7 HIS ND1 1 1 5 3371 2 1 7 HIS NE2 N -2.532 -10.442 5.324 1.00 . B B . 7 HIS NE2 1 1 5 3372 2 1 7 HIS O O -6.303 -5.005 4.230 1.00 . B B . 7 HIS O 1 1 5 3373 2 1 8 SER C C -3.483 -2.511 4.014 1.00 . B B . 8 SER C 1 1 5 3374 2 1 8 SER CA C -4.358 -3.329 4.962 1.00 . B B . 8 SER CA 1 1 5 3375 2 1 8 SER CB C -3.980 -3.017 6.410 1.00 . B B . 8 SER CB 1 1 5 3376 2 1 8 SER H H -3.282 -5.187 4.780 1.00 . B B . 8 SER H 1 1 5 3377 2 1 8 SER HA H -5.392 -3.071 4.797 1.00 . B B . 8 SER HA 1 1 5 3378 2 1 8 SER HB2 H -3.228 -3.712 6.746 1.00 . B B . 8 SER HB2 1 1 5 3379 2 1 8 SER HB3 H -3.590 -2.010 6.469 1.00 . B B . 8 SER HB3 1 1 5 3380 2 1 8 SER HG H -4.864 -3.007 8.144 1.00 . B B . 8 SER HG 1 1 5 3381 2 1 8 SER N N -4.171 -4.781 4.694 1.00 . B B . 8 SER N 1 1 5 3382 2 1 8 SER O O -3.549 -1.299 3.985 1.00 . B B . 8 SER O 1 1 5 3383 2 1 8 SER OG O -5.134 -3.141 7.233 1.00 . B B . 8 SER OG 1 1 5 3384 2 1 9 ALA C C -2.471 -2.379 0.917 1.00 . B B . 9 ALA C 1 1 5 3385 2 1 9 ALA CA C -1.803 -2.413 2.286 1.00 . B B . 9 ALA CA 1 1 5 3386 2 1 9 ALA CB C -0.455 -3.115 2.172 1.00 . B B . 9 ALA CB 1 1 5 3387 2 1 9 ALA H H -2.633 -4.139 3.264 1.00 . B B . 9 ALA H 1 1 5 3388 2 1 9 ALA HA H -1.657 -1.406 2.645 1.00 . B B . 9 ALA HA 1 1 5 3389 2 1 9 ALA HB1 H 0.029 -3.116 3.134 1.00 . B B . 9 ALA HB1 1 1 5 3390 2 1 9 ALA HB2 H 0.162 -2.594 1.461 1.00 . B B . 9 ALA HB2 1 1 5 3391 2 1 9 ALA HB3 H -0.605 -4.137 1.841 1.00 . B B . 9 ALA HB3 1 1 5 3392 2 1 9 ALA N N -2.670 -3.161 3.233 1.00 . B B . 9 ALA N 1 1 5 3393 2 1 9 ALA O O -2.740 -1.327 0.373 1.00 . B B . 9 ALA O 1 1 5 3394 2 1 10 LYS C C -4.462 -2.490 -1.079 1.00 . B B . 10 LYS C 1 1 5 3395 2 1 10 LYS CA C -3.387 -3.576 -0.986 1.00 . B B . 10 LYS CA 1 1 5 3396 2 1 10 LYS CB C -4.027 -4.946 -1.205 1.00 . B B . 10 LYS CB 1 1 5 3397 2 1 10 LYS CD C -6.477 -4.966 -0.723 1.00 . B B . 10 LYS CD 1 1 5 3398 2 1 10 LYS CE C -7.028 -6.284 -1.269 1.00 . B B . 10 LYS CE 1 1 5 3399 2 1 10 LYS CG C -5.086 -5.200 -0.132 1.00 . B B . 10 LYS CG 1 1 5 3400 2 1 10 LYS H H -2.497 -4.365 0.818 1.00 . B B . 10 LYS H 1 1 5 3401 2 1 10 LYS HA H -2.642 -3.402 -1.748 1.00 . B B . 10 LYS HA 1 1 5 3402 2 1 10 LYS HB2 H -4.490 -4.970 -2.181 1.00 . B B . 10 LYS HB2 1 1 5 3403 2 1 10 LYS HB3 H -3.268 -5.712 -1.147 1.00 . B B . 10 LYS HB3 1 1 5 3404 2 1 10 LYS HD2 H -7.137 -4.592 0.046 1.00 . B B . 10 LYS HD2 1 1 5 3405 2 1 10 LYS HD3 H -6.412 -4.246 -1.524 1.00 . B B . 10 LYS HD3 1 1 5 3406 2 1 10 LYS HE2 H -7.199 -6.968 -0.451 1.00 . B B . 10 LYS HE2 1 1 5 3407 2 1 10 LYS HE3 H -7.957 -6.100 -1.786 1.00 . B B . 10 LYS HE3 1 1 5 3408 2 1 10 LYS HG2 H -5.009 -6.221 0.214 1.00 . B B . 10 LYS HG2 1 1 5 3409 2 1 10 LYS HG3 H -4.930 -4.527 0.697 1.00 . B B . 10 LYS HG3 1 1 5 3410 2 1 10 LYS HZ1 H -5.773 -6.170 -2.927 1.00 . B B . 10 LYS HZ1 1 1 5 3411 2 1 10 LYS HZ2 H -6.466 -7.703 -2.687 1.00 . B B . 10 LYS HZ2 1 1 5 3412 2 1 10 LYS HZ3 H -5.195 -7.176 -1.691 1.00 . B B . 10 LYS HZ3 1 1 5 3413 2 1 10 LYS N N -2.735 -3.529 0.356 1.00 . B B . 10 LYS N 1 1 5 3414 2 1 10 LYS NZ N -6.041 -6.878 -2.215 1.00 . B B . 10 LYS NZ 1 1 5 3415 2 1 10 LYS O O -4.669 -1.901 -2.121 1.00 . B B . 10 LYS O 1 1 5 3416 2 1 11 LYS C C -5.515 0.160 -0.468 1.00 . B B . 11 LYS C 1 1 5 3417 2 1 11 LYS CA C -6.180 -1.144 -0.043 1.00 . B B . 11 LYS CA 1 1 5 3418 2 1 11 LYS CB C -6.808 -0.973 1.342 1.00 . B B . 11 LYS CB 1 1 5 3419 2 1 11 LYS CD C -8.835 -2.274 2.014 1.00 . B B . 11 LYS CD 1 1 5 3420 2 1 11 LYS CE C -9.486 -3.335 1.126 1.00 . B B . 11 LYS CE 1 1 5 3421 2 1 11 LYS CG C -7.315 -2.326 1.845 1.00 . B B . 11 LYS CG 1 1 5 3422 2 1 11 LYS H H -4.953 -2.679 0.839 1.00 . B B . 11 LYS H 1 1 5 3423 2 1 11 LYS HA H -6.942 -1.412 -0.762 1.00 . B B . 11 LYS HA 1 1 5 3424 2 1 11 LYS HB2 H -6.066 -0.587 2.026 1.00 . B B . 11 LYS HB2 1 1 5 3425 2 1 11 LYS HB3 H -7.635 -0.281 1.280 1.00 . B B . 11 LYS HB3 1 1 5 3426 2 1 11 LYS HD2 H -9.087 -2.464 3.048 1.00 . B B . 11 LYS HD2 1 1 5 3427 2 1 11 LYS HD3 H -9.196 -1.298 1.729 1.00 . B B . 11 LYS HD3 1 1 5 3428 2 1 11 LYS HE2 H -9.213 -3.160 0.095 1.00 . B B . 11 LYS HE2 1 1 5 3429 2 1 11 LYS HE3 H -9.146 -4.316 1.427 1.00 . B B . 11 LYS HE3 1 1 5 3430 2 1 11 LYS HG2 H -7.057 -3.093 1.130 1.00 . B B . 11 LYS HG2 1 1 5 3431 2 1 11 LYS HG3 H -6.856 -2.551 2.796 1.00 . B B . 11 LYS HG3 1 1 5 3432 2 1 11 LYS HZ1 H -11.237 -3.497 2.242 1.00 . B B . 11 LYS HZ1 1 1 5 3433 2 1 11 LYS HZ2 H -11.414 -3.928 0.607 1.00 . B B . 11 LYS HZ2 1 1 5 3434 2 1 11 LYS HZ3 H -11.286 -2.292 1.049 1.00 . B B . 11 LYS HZ3 1 1 5 3435 2 1 11 LYS N N -5.138 -2.206 0.001 1.00 . B B . 11 LYS N 1 1 5 3436 2 1 11 LYS NZ N -10.967 -3.258 1.266 1.00 . B B . 11 LYS NZ 1 1 5 3437 2 1 11 LYS O O -5.764 0.675 -1.540 1.00 . B B . 11 LYS O 1 1 5 3438 2 1 12 PHE C C -3.033 1.630 -1.202 1.00 . B B . 12 PHE C 1 1 5 3439 2 1 12 PHE CA C -3.952 1.942 -0.026 1.00 . B B . 12 PHE CA 1 1 5 3440 2 1 12 PHE CB C -3.119 2.452 1.152 1.00 . B B . 12 PHE CB 1 1 5 3441 2 1 12 PHE CD1 C -5.068 2.996 2.659 1.00 . B B . 12 PHE CD1 1 1 5 3442 2 1 12 PHE CD2 C -3.421 1.386 3.416 1.00 . B B . 12 PHE CD2 1 1 5 3443 2 1 12 PHE CE1 C -5.778 2.833 3.853 1.00 . B B . 12 PHE CE1 1 1 5 3444 2 1 12 PHE CE2 C -4.131 1.223 4.612 1.00 . B B . 12 PHE CE2 1 1 5 3445 2 1 12 PHE CG C -3.889 2.273 2.439 1.00 . B B . 12 PHE CG 1 1 5 3446 2 1 12 PHE CZ C -5.309 1.947 4.830 1.00 . B B . 12 PHE CZ 1 1 5 3447 2 1 12 PHE H H -4.444 0.250 1.202 1.00 . B B . 12 PHE H 1 1 5 3448 2 1 12 PHE HA H -4.676 2.689 -0.315 1.00 . B B . 12 PHE HA 1 1 5 3449 2 1 12 PHE HB2 H -2.194 1.893 1.206 1.00 . B B . 12 PHE HB2 1 1 5 3450 2 1 12 PHE HB3 H -2.900 3.500 1.008 1.00 . B B . 12 PHE HB3 1 1 5 3451 2 1 12 PHE HD1 H -5.429 3.680 1.906 1.00 . B B . 12 PHE HD1 1 1 5 3452 2 1 12 PHE HD2 H -2.512 0.828 3.246 1.00 . B B . 12 PHE HD2 1 1 5 3453 2 1 12 PHE HE1 H -6.688 3.391 4.022 1.00 . B B . 12 PHE HE1 1 1 5 3454 2 1 12 PHE HE2 H -3.770 0.540 5.365 1.00 . B B . 12 PHE HE2 1 1 5 3455 2 1 12 PHE HZ H -5.856 1.821 5.753 1.00 . B B . 12 PHE HZ 1 1 5 3456 2 1 12 PHE N N -4.649 0.688 0.353 1.00 . B B . 12 PHE N 1 1 5 3457 2 1 12 PHE O O -2.635 2.502 -1.945 1.00 . B B . 12 PHE O 1 1 5 3458 2 1 13 GLY C C -2.374 0.595 -3.797 1.00 . B B . 13 GLY C 1 1 5 3459 2 1 13 GLY CA C -1.803 0.010 -2.510 1.00 . B B . 13 GLY CA 1 1 5 3460 2 1 13 GLY H H -3.026 -0.307 -0.768 1.00 . B B . 13 GLY H 1 1 5 3461 2 1 13 GLY HA2 H -0.815 0.406 -2.338 1.00 . B B . 13 GLY HA2 1 1 5 3462 2 1 13 GLY HA3 H -1.756 -1.064 -2.595 1.00 . B B . 13 GLY HA3 1 1 5 3463 2 1 13 GLY N N -2.693 0.383 -1.377 1.00 . B B . 13 GLY N 1 1 5 3464 2 1 13 GLY O O -1.652 1.031 -4.670 1.00 . B B . 13 GLY O 1 1 5 3465 2 1 14 LYS C C -4.596 2.646 -4.961 1.00 . B B . 14 LYS C 1 1 5 3466 2 1 14 LYS CA C -4.301 1.153 -5.147 1.00 . B B . 14 LYS CA 1 1 5 3467 2 1 14 LYS CB C -5.606 0.403 -5.418 1.00 . B B . 14 LYS CB 1 1 5 3468 2 1 14 LYS CD C -5.003 -0.605 -7.621 1.00 . B B . 14 LYS CD 1 1 5 3469 2 1 14 LYS CE C -3.571 -1.030 -7.949 1.00 . B B . 14 LYS CE 1 1 5 3470 2 1 14 LYS CG C -5.299 -0.902 -6.151 1.00 . B B . 14 LYS CG 1 1 5 3471 2 1 14 LYS H H -4.232 0.239 -3.199 1.00 . B B . 14 LYS H 1 1 5 3472 2 1 14 LYS HA H -3.629 1.021 -5.983 1.00 . B B . 14 LYS HA 1 1 5 3473 2 1 14 LYS HB2 H -6.097 0.185 -4.478 1.00 . B B . 14 LYS HB2 1 1 5 3474 2 1 14 LYS HB3 H -6.252 1.014 -6.029 1.00 . B B . 14 LYS HB3 1 1 5 3475 2 1 14 LYS HD2 H -5.695 -1.151 -8.245 1.00 . B B . 14 LYS HD2 1 1 5 3476 2 1 14 LYS HD3 H -5.111 0.454 -7.803 1.00 . B B . 14 LYS HD3 1 1 5 3477 2 1 14 LYS HE2 H -2.901 -0.658 -7.187 1.00 . B B . 14 LYS HE2 1 1 5 3478 2 1 14 LYS HE3 H -3.514 -2.108 -7.982 1.00 . B B . 14 LYS HE3 1 1 5 3479 2 1 14 LYS HG2 H -4.439 -1.375 -5.698 1.00 . B B . 14 LYS HG2 1 1 5 3480 2 1 14 LYS HG3 H -6.150 -1.563 -6.083 1.00 . B B . 14 LYS HG3 1 1 5 3481 2 1 14 LYS HZ1 H -2.991 -1.248 -9.935 1.00 . B B . 14 LYS HZ1 1 1 5 3482 2 1 14 LYS HZ2 H -2.322 0.109 -9.163 1.00 . B B . 14 LYS HZ2 1 1 5 3483 2 1 14 LYS HZ3 H -3.951 0.118 -9.643 1.00 . B B . 14 LYS HZ3 1 1 5 3484 2 1 14 LYS N N -3.671 0.602 -3.917 1.00 . B B . 14 LYS N 1 1 5 3485 2 1 14 LYS NZ N -3.179 -0.471 -9.272 1.00 . B B . 14 LYS NZ 1 1 5 3486 2 1 14 LYS O O -4.402 3.441 -5.859 1.00 . B B . 14 LYS O 1 1 5 3487 2 1 15 ALA C C -4.093 5.262 -3.339 1.00 . B B . 15 ALA C 1 1 5 3488 2 1 15 ALA CA C -5.385 4.477 -3.580 1.00 . B B . 15 ALA CA 1 1 5 3489 2 1 15 ALA CB C -6.295 4.615 -2.356 1.00 . B B . 15 ALA CB 1 1 5 3490 2 1 15 ALA H H -5.229 2.379 -3.096 1.00 . B B . 15 ALA H 1 1 5 3491 2 1 15 ALA HA H -5.890 4.874 -4.447 1.00 . B B . 15 ALA HA 1 1 5 3492 2 1 15 ALA HB1 H -6.163 5.596 -1.920 1.00 . B B . 15 ALA HB1 1 1 5 3493 2 1 15 ALA HB2 H -6.038 3.860 -1.628 1.00 . B B . 15 ALA HB2 1 1 5 3494 2 1 15 ALA HB3 H -7.324 4.491 -2.658 1.00 . B B . 15 ALA HB3 1 1 5 3495 2 1 15 ALA N N -5.072 3.035 -3.808 1.00 . B B . 15 ALA N 1 1 5 3496 2 1 15 ALA O O -3.896 6.330 -3.884 1.00 . B B . 15 ALA O 1 1 5 3497 2 1 16 TRP C C -1.132 5.598 -3.527 1.00 . B B . 16 TRP C 1 1 5 3498 2 1 16 TRP CA C -1.947 5.465 -2.241 1.00 . B B . 16 TRP CA 1 1 5 3499 2 1 16 TRP CB C -1.157 4.702 -1.157 1.00 . B B . 16 TRP CB 1 1 5 3500 2 1 16 TRP CD1 C -0.039 2.473 -1.635 1.00 . B B . 16 TRP CD1 1 1 5 3501 2 1 16 TRP CD2 C 1.068 4.201 -2.534 1.00 . B B . 16 TRP CD2 1 1 5 3502 2 1 16 TRP CE2 C 1.784 3.038 -2.892 1.00 . B B . 16 TRP CE2 1 1 5 3503 2 1 16 TRP CE3 C 1.551 5.437 -2.966 1.00 . B B . 16 TRP CE3 1 1 5 3504 2 1 16 TRP CG C -0.096 3.817 -1.756 1.00 . B B . 16 TRP CG 1 1 5 3505 2 1 16 TRP CH2 C 3.416 4.349 -4.086 1.00 . B B . 16 TRP CH2 1 1 5 3506 2 1 16 TRP CZ2 C 2.947 3.104 -3.660 1.00 . B B . 16 TRP CZ2 1 1 5 3507 2 1 16 TRP CZ3 C 2.718 5.512 -3.737 1.00 . B B . 16 TRP CZ3 1 1 5 3508 2 1 16 TRP H H -3.394 3.890 -2.090 1.00 . B B . 16 TRP H 1 1 5 3509 2 1 16 TRP HA H -2.174 6.452 -1.873 1.00 . B B . 16 TRP HA 1 1 5 3510 2 1 16 TRP HB2 H -0.687 5.417 -0.500 1.00 . B B . 16 TRP HB2 1 1 5 3511 2 1 16 TRP HB3 H -1.843 4.096 -0.584 1.00 . B B . 16 TRP HB3 1 1 5 3512 2 1 16 TRP HD1 H -0.746 1.864 -1.100 1.00 . B B . 16 TRP HD1 1 1 5 3513 2 1 16 TRP HE1 H 1.329 1.066 -2.401 1.00 . B B . 16 TRP HE1 1 1 5 3514 2 1 16 TRP HE3 H 1.019 6.338 -2.695 1.00 . B B . 16 TRP HE3 1 1 5 3515 2 1 16 TRP HH2 H 4.315 4.416 -4.683 1.00 . B B . 16 TRP HH2 1 1 5 3516 2 1 16 TRP HZ2 H 3.479 2.201 -3.924 1.00 . B B . 16 TRP HZ2 1 1 5 3517 2 1 16 TRP HZ3 H 3.074 6.468 -4.065 1.00 . B B . 16 TRP HZ3 1 1 5 3518 2 1 16 TRP N N -3.216 4.748 -2.523 1.00 . B B . 16 TRP N 1 1 5 3519 2 1 16 TRP NE1 N 1.069 2.007 -2.321 1.00 . B B . 16 TRP NE1 1 1 5 3520 2 1 16 TRP O O -0.655 6.661 -3.865 1.00 . B B . 16 TRP O 1 1 5 3521 2 1 17 VAL C C -0.848 5.524 -6.487 1.00 . B B . 17 VAL C 1 1 5 3522 2 1 17 VAL CA C -0.130 4.626 -5.480 1.00 . B B . 17 VAL CA 1 1 5 3523 2 1 17 VAL CB C 0.114 3.218 -6.052 1.00 . B B . 17 VAL CB 1 1 5 3524 2 1 17 VAL CG1 C -0.937 2.862 -7.112 1.00 . B B . 17 VAL CG1 1 1 5 3525 2 1 17 VAL CG2 C 1.508 3.171 -6.677 1.00 . B B . 17 VAL CG2 1 1 5 3526 2 1 17 VAL H H -1.312 3.667 -3.957 1.00 . B B . 17 VAL H 1 1 5 3527 2 1 17 VAL HA H 0.819 5.082 -5.232 1.00 . B B . 17 VAL HA 1 1 5 3528 2 1 17 VAL HB H 0.059 2.496 -5.250 1.00 . B B . 17 VAL HB 1 1 5 3529 2 1 17 VAL HG11 H -0.665 1.932 -7.588 1.00 . B B . 17 VAL HG11 1 1 5 3530 2 1 17 VAL HG12 H -0.984 3.645 -7.852 1.00 . B B . 17 VAL HG12 1 1 5 3531 2 1 17 VAL HG13 H -1.901 2.755 -6.639 1.00 . B B . 17 VAL HG13 1 1 5 3532 2 1 17 VAL HG21 H 2.009 2.264 -6.372 1.00 . B B . 17 VAL HG21 1 1 5 3533 2 1 17 VAL HG22 H 2.077 4.027 -6.342 1.00 . B B . 17 VAL HG22 1 1 5 3534 2 1 17 VAL HG23 H 1.422 3.192 -7.752 1.00 . B B . 17 VAL HG23 1 1 5 3535 2 1 17 VAL N N -0.941 4.528 -4.241 1.00 . B B . 17 VAL N 1 1 5 3536 2 1 17 VAL O O -0.290 6.484 -6.981 1.00 . B B . 17 VAL O 1 1 5 3537 2 1 18 GLY C C -2.707 7.564 -7.267 1.00 . B B . 18 GLY C 1 1 5 3538 2 1 18 GLY CA C -2.834 6.113 -7.731 1.00 . B B . 18 GLY CA 1 1 5 3539 2 1 18 GLY H H -2.535 4.484 -6.353 1.00 . B B . 18 GLY H 1 1 5 3540 2 1 18 GLY HA2 H -2.415 6.005 -8.720 1.00 . B B . 18 GLY HA2 1 1 5 3541 2 1 18 GLY HA3 H -3.875 5.830 -7.741 1.00 . B B . 18 GLY HA3 1 1 5 3542 2 1 18 GLY N N -2.089 5.246 -6.776 1.00 . B B . 18 GLY N 1 1 5 3543 2 1 18 GLY O O -2.927 8.492 -8.019 1.00 . B B . 18 GLY O 1 1 5 3544 2 1 19 GLU C C -0.769 9.599 -5.777 1.00 . B B . 19 GLU C 1 1 5 3545 2 1 19 GLU CA C -2.185 9.124 -5.486 1.00 . B B . 19 GLU CA 1 1 5 3546 2 1 19 GLU CB C -2.408 9.062 -3.967 1.00 . B B . 19 GLU CB 1 1 5 3547 2 1 19 GLU CD C -1.969 11.524 -3.918 1.00 . B B . 19 GLU CD 1 1 5 3548 2 1 19 GLU CG C -1.639 10.183 -3.261 1.00 . B B . 19 GLU CG 1 1 5 3549 2 1 19 GLU H H -2.167 6.998 -5.445 1.00 . B B . 19 GLU H 1 1 5 3550 2 1 19 GLU HA H -2.900 9.789 -5.940 1.00 . B B . 19 GLU HA 1 1 5 3551 2 1 19 GLU HB2 H -3.462 9.157 -3.753 1.00 . B B . 19 GLU HB2 1 1 5 3552 2 1 19 GLU HB3 H -2.048 8.109 -3.600 1.00 . B B . 19 GLU HB3 1 1 5 3553 2 1 19 GLU HG2 H -1.920 10.209 -2.220 1.00 . B B . 19 GLU HG2 1 1 5 3554 2 1 19 GLU HG3 H -0.579 9.990 -3.344 1.00 . B B . 19 GLU HG3 1 1 5 3555 2 1 19 GLU N N -2.343 7.758 -6.027 1.00 . B B . 19 GLU N 1 1 5 3556 2 1 19 GLU O O -0.544 10.500 -6.561 1.00 . B B . 19 GLU O 1 1 5 3557 2 1 19 GLU OE1 O -2.836 11.545 -4.775 1.00 . B B . 19 GLU OE1 1 1 5 3558 2 1 19 GLU OE2 O -1.349 12.509 -3.551 1.00 . B B . 19 GLU OE2 1 1 5 3559 2 1 20 ILE C C 2.066 9.048 -6.727 1.00 . B B . 20 ILE C 1 1 5 3560 2 1 20 ILE CA C 1.589 9.423 -5.324 1.00 . B B . 20 ILE CA 1 1 5 3561 2 1 20 ILE CB C 2.440 8.717 -4.271 1.00 . B B . 20 ILE CB 1 1 5 3562 2 1 20 ILE CD1 C 3.092 8.766 -1.868 1.00 . B B . 20 ILE CD1 1 1 5 3563 2 1 20 ILE CG1 C 2.459 9.563 -3.007 1.00 . B B . 20 ILE CG1 1 1 5 3564 2 1 20 ILE CG2 C 3.876 8.512 -4.771 1.00 . B B . 20 ILE CG2 1 1 5 3565 2 1 20 ILE H H -0.030 8.290 -4.477 1.00 . B B . 20 ILE H 1 1 5 3566 2 1 20 ILE HA H 1.661 10.485 -5.190 1.00 . B B . 20 ILE HA 1 1 5 3567 2 1 20 ILE HB H 1.992 7.763 -4.050 1.00 . B B . 20 ILE HB 1 1 5 3568 2 1 20 ILE HD11 H 3.927 9.318 -1.463 1.00 . B B . 20 ILE HD11 1 1 5 3569 2 1 20 ILE HD12 H 3.437 7.814 -2.243 1.00 . B B . 20 ILE HD12 1 1 5 3570 2 1 20 ILE HD13 H 2.358 8.602 -1.092 1.00 . B B . 20 ILE HD13 1 1 5 3571 2 1 20 ILE HG12 H 3.032 10.459 -3.187 1.00 . B B . 20 ILE HG12 1 1 5 3572 2 1 20 ILE HG13 H 1.446 9.824 -2.743 1.00 . B B . 20 ILE HG13 1 1 5 3573 2 1 20 ILE HG21 H 3.858 7.952 -5.696 1.00 . B B . 20 ILE HG21 1 1 5 3574 2 1 20 ILE HG22 H 4.441 7.965 -4.030 1.00 . B B . 20 ILE HG22 1 1 5 3575 2 1 20 ILE HG23 H 4.340 9.472 -4.939 1.00 . B B . 20 ILE HG23 1 1 5 3576 2 1 20 ILE N N 0.184 9.007 -5.124 1.00 . B B . 20 ILE N 1 1 5 3577 2 1 20 ILE O O 2.646 9.848 -7.432 1.00 . B B . 20 ILE O 1 1 5 3578 2 1 21 MET C C 1.638 8.230 -9.555 1.00 . B B . 21 MET C 1 1 5 3579 2 1 21 MET CA C 2.321 7.396 -8.462 1.00 . B B . 21 MET CA 1 1 5 3580 2 1 21 MET CB C 2.007 5.906 -8.629 1.00 . B B . 21 MET CB 1 1 5 3581 2 1 21 MET CE C 0.524 3.621 -10.958 1.00 . B B . 21 MET CE 1 1 5 3582 2 1 21 MET CG C 0.614 5.715 -9.233 1.00 . B B . 21 MET CG 1 1 5 3583 2 1 21 MET H H 1.399 7.195 -6.529 1.00 . B B . 21 MET H 1 1 5 3584 2 1 21 MET HA H 3.390 7.540 -8.524 1.00 . B B . 21 MET HA 1 1 5 3585 2 1 21 MET HB2 H 2.746 5.455 -9.276 1.00 . B B . 21 MET HB2 1 1 5 3586 2 1 21 MET HB3 H 2.043 5.432 -7.656 1.00 . B B . 21 MET HB3 1 1 5 3587 2 1 21 MET HE1 H 1.475 3.127 -11.107 1.00 . B B . 21 MET HE1 1 1 5 3588 2 1 21 MET HE2 H -0.159 3.323 -11.737 1.00 . B B . 21 MET HE2 1 1 5 3589 2 1 21 MET HE3 H 0.115 3.342 -9.996 1.00 . B B . 21 MET HE3 1 1 5 3590 2 1 21 MET HG2 H 0.132 4.871 -8.762 1.00 . B B . 21 MET HG2 1 1 5 3591 2 1 21 MET HG3 H 0.027 6.607 -9.064 1.00 . B B . 21 MET HG3 1 1 5 3592 2 1 21 MET N N 1.852 7.831 -7.123 1.00 . B B . 21 MET N 1 1 5 3593 2 1 21 MET O O 2.101 8.298 -10.676 1.00 . B B . 21 MET O 1 1 5 3594 2 1 21 MET SD S 0.761 5.414 -11.011 1.00 . B B . 21 MET SD 1 1 5 3595 2 1 22 ASN C C 0.712 10.888 -10.645 1.00 . B B . 22 ASN C 1 1 5 3596 2 1 22 ASN CA C -0.162 9.691 -10.260 1.00 . B B . 22 ASN CA 1 1 5 3597 2 1 22 ASN CB C -1.490 10.192 -9.688 1.00 . B B . 22 ASN CB 1 1 5 3598 2 1 22 ASN CG C -2.648 9.485 -10.397 1.00 . B B . 22 ASN CG 1 1 5 3599 2 1 22 ASN H H 0.182 8.800 -8.327 1.00 . B B . 22 ASN H 1 1 5 3600 2 1 22 ASN HA H -0.353 9.090 -11.138 1.00 . B B . 22 ASN HA 1 1 5 3601 2 1 22 ASN HB2 H -1.529 9.979 -8.629 1.00 . B B . 22 ASN HB2 1 1 5 3602 2 1 22 ASN HB3 H -1.571 11.259 -9.848 1.00 . B B . 22 ASN HB3 1 1 5 3603 2 1 22 ASN HD21 H -4.034 10.692 -9.637 1.00 . B B . 22 ASN HD21 1 1 5 3604 2 1 22 ASN HD22 H -4.616 9.467 -10.671 1.00 . B B . 22 ASN HD22 1 1 5 3605 2 1 22 ASN N N 0.542 8.866 -9.237 1.00 . B B . 22 ASN N 1 1 5 3606 2 1 22 ASN ND2 N -3.867 9.917 -10.221 1.00 . B B . 22 ASN ND2 1 1 5 3607 2 1 22 ASN O O 1.059 11.070 -11.797 1.00 . B B . 22 ASN O 1 1 5 3608 2 1 22 ASN OD1 O -2.440 8.530 -11.118 1.00 . B B . 22 ASN OD1 1 1 5 3609 2 1 23 SER C C 3.307 12.419 -10.452 1.00 . B B . 23 SER C 1 1 5 3610 2 1 23 SER CA C 1.920 12.889 -10.009 1.00 . B B . 23 SER CA 1 1 5 3611 2 1 23 SER CB C 2.053 13.768 -8.764 1.00 . B B . 23 SER CB 1 1 5 3612 2 1 23 SER H H 0.780 11.543 -8.772 1.00 . B B . 23 SER H 1 1 5 3613 2 1 23 SER HA H 1.462 13.459 -10.804 1.00 . B B . 23 SER HA 1 1 5 3614 2 1 23 SER HB2 H 1.099 13.838 -8.268 1.00 . B B . 23 SER HB2 1 1 5 3615 2 1 23 SER HB3 H 2.774 13.326 -8.088 1.00 . B B . 23 SER HB3 1 1 5 3616 2 1 23 SER HG H 1.851 15.703 -8.793 1.00 . B B . 23 SER HG 1 1 5 3617 2 1 23 SER N N 1.070 11.706 -9.694 1.00 . B B . 23 SER N 1 1 5 3618 2 1 23 SER O O 3.603 12.541 -11.630 1.00 . B B . 23 SER O 1 1 5 3619 2 1 23 SER OXT O 4.047 11.945 -9.607 1.00 . B B . 23 SER OXT 1 1 5 3620 2 1 23 SER OG O 2.477 15.069 -9.150 1.00 . B B . 23 SER OG 1 1 6 3621 1 1 1 GLY C C -6.709 12.637 3.140 1.00 . A A . 1 GLY C 1 1 6 3622 1 1 1 GLY CA C -8.115 12.062 3.327 1.00 . A A . 1 GLY CA 1 1 6 3623 1 1 1 GLY H1 H -9.224 11.435 4.974 1.00 . A A . 1 GLY H1 1 1 6 3624 1 1 1 GLY H2 H -8.881 13.099 4.962 1.00 . A A . 1 GLY H2 1 1 6 3625 1 1 1 GLY H3 H -7.664 11.981 5.359 1.00 . A A . 1 GLY H3 1 1 6 3626 1 1 1 GLY HA2 H -8.127 11.027 3.016 1.00 . A A . 1 GLY HA2 1 1 6 3627 1 1 1 GLY HA3 H -8.814 12.627 2.730 1.00 . A A . 1 GLY HA3 1 1 6 3628 1 1 1 GLY N N -8.500 12.151 4.764 1.00 . A A . 1 GLY N 1 1 6 3629 1 1 1 GLY O O -6.361 13.649 3.716 1.00 . A A . 1 GLY O 1 1 6 3630 1 1 2 ILE C C -3.790 12.625 3.453 1.00 . A A . 2 ILE C 1 1 6 3631 1 1 2 ILE CA C -4.519 12.515 2.113 1.00 . A A . 2 ILE CA 1 1 6 3632 1 1 2 ILE CB C -4.590 13.894 1.454 1.00 . A A . 2 ILE CB 1 1 6 3633 1 1 2 ILE CD1 C -5.811 15.120 -0.348 1.00 . A A . 2 ILE CD1 1 1 6 3634 1 1 2 ILE CG1 C -5.242 13.764 0.076 1.00 . A A . 2 ILE CG1 1 1 6 3635 1 1 2 ILE CG2 C -3.178 14.463 1.297 1.00 . A A . 2 ILE CG2 1 1 6 3636 1 1 2 ILE H H -6.201 11.189 1.881 1.00 . A A . 2 ILE H 1 1 6 3637 1 1 2 ILE HA H -3.983 11.834 1.469 1.00 . A A . 2 ILE HA 1 1 6 3638 1 1 2 ILE HB H -5.177 14.557 2.072 1.00 . A A . 2 ILE HB 1 1 6 3639 1 1 2 ILE HD11 H -6.683 14.967 -0.966 1.00 . A A . 2 ILE HD11 1 1 6 3640 1 1 2 ILE HD12 H -5.064 15.664 -0.906 1.00 . A A . 2 ILE HD12 1 1 6 3641 1 1 2 ILE HD13 H -6.086 15.684 0.531 1.00 . A A . 2 ILE HD13 1 1 6 3642 1 1 2 ILE HG12 H -4.503 13.441 -0.644 1.00 . A A . 2 ILE HG12 1 1 6 3643 1 1 2 ILE HG13 H -6.044 13.039 0.124 1.00 . A A . 2 ILE HG13 1 1 6 3644 1 1 2 ILE HG21 H -3.082 15.354 1.899 1.00 . A A . 2 ILE HG21 1 1 6 3645 1 1 2 ILE HG22 H -3.002 14.707 0.260 1.00 . A A . 2 ILE HG22 1 1 6 3646 1 1 2 ILE HG23 H -2.455 13.729 1.622 1.00 . A A . 2 ILE HG23 1 1 6 3647 1 1 2 ILE N N -5.900 12.003 2.337 1.00 . A A . 2 ILE N 1 1 6 3648 1 1 2 ILE O O -3.081 13.576 3.711 1.00 . A A . 2 ILE O 1 1 6 3649 1 1 3 GLY C C -2.990 10.261 6.080 1.00 . A A . 3 GLY C 1 1 6 3650 1 1 3 GLY CA C -3.271 11.690 5.628 1.00 . A A . 3 GLY CA 1 1 6 3651 1 1 3 GLY H H -4.528 10.892 4.074 1.00 . A A . 3 GLY H 1 1 6 3652 1 1 3 GLY HA2 H -2.337 12.228 5.532 1.00 . A A . 3 GLY HA2 1 1 6 3653 1 1 3 GLY HA3 H -3.902 12.180 6.354 1.00 . A A . 3 GLY HA3 1 1 6 3654 1 1 3 GLY N N -3.957 11.653 4.306 1.00 . A A . 3 GLY N 1 1 6 3655 1 1 3 GLY O O -2.775 9.990 7.245 1.00 . A A . 3 GLY O 1 1 6 3656 1 1 4 LYS C C -1.910 7.317 4.340 1.00 . A A . 4 LYS C 1 1 6 3657 1 1 4 LYS CA C -2.707 7.925 5.491 1.00 . A A . 4 LYS CA 1 1 6 3658 1 1 4 LYS CB C -4.018 7.145 5.681 1.00 . A A . 4 LYS CB 1 1 6 3659 1 1 4 LYS CD C -6.501 7.313 5.926 1.00 . A A . 4 LYS CD 1 1 6 3660 1 1 4 LYS CE C -6.960 7.640 7.348 1.00 . A A . 4 LYS CE 1 1 6 3661 1 1 4 LYS CG C -5.223 8.091 5.608 1.00 . A A . 4 LYS CG 1 1 6 3662 1 1 4 LYS H H -3.154 9.602 4.223 1.00 . A A . 4 LYS H 1 1 6 3663 1 1 4 LYS HA H -2.121 7.878 6.399 1.00 . A A . 4 LYS HA 1 1 6 3664 1 1 4 LYS HB2 H -4.103 6.398 4.905 1.00 . A A . 4 LYS HB2 1 1 6 3665 1 1 4 LYS HB3 H -4.006 6.659 6.645 1.00 . A A . 4 LYS HB3 1 1 6 3666 1 1 4 LYS HD2 H -7.274 7.589 5.224 1.00 . A A . 4 LYS HD2 1 1 6 3667 1 1 4 LYS HD3 H -6.306 6.253 5.848 1.00 . A A . 4 LYS HD3 1 1 6 3668 1 1 4 LYS HE2 H -6.301 7.162 8.058 1.00 . A A . 4 LYS HE2 1 1 6 3669 1 1 4 LYS HE3 H -6.935 8.709 7.498 1.00 . A A . 4 LYS HE3 1 1 6 3670 1 1 4 LYS HG2 H -5.097 8.889 6.327 1.00 . A A . 4 LYS HG2 1 1 6 3671 1 1 4 LYS HG3 H -5.295 8.508 4.615 1.00 . A A . 4 LYS HG3 1 1 6 3672 1 1 4 LYS HZ1 H -8.905 7.305 6.684 1.00 . A A . 4 LYS HZ1 1 1 6 3673 1 1 4 LYS HZ2 H -8.789 7.650 8.343 1.00 . A A . 4 LYS HZ2 1 1 6 3674 1 1 4 LYS HZ3 H -8.329 6.124 7.755 1.00 . A A . 4 LYS HZ3 1 1 6 3675 1 1 4 LYS N N -2.984 9.348 5.153 1.00 . A A . 4 LYS N 1 1 6 3676 1 1 4 LYS NZ N -8.351 7.142 7.548 1.00 . A A . 4 LYS NZ 1 1 6 3677 1 1 4 LYS O O -0.952 6.596 4.543 1.00 . A A . 4 LYS O 1 1 6 3678 1 1 5 TYR C C -0.138 7.678 1.958 1.00 . A A . 5 TYR C 1 1 6 3679 1 1 5 TYR CA C -1.547 7.100 1.958 1.00 . A A . 5 TYR CA 1 1 6 3680 1 1 5 TYR CB C -2.267 7.518 0.682 1.00 . A A . 5 TYR CB 1 1 6 3681 1 1 5 TYR CD1 C -4.353 6.096 0.777 1.00 . A A . 5 TYR CD1 1 1 6 3682 1 1 5 TYR CD2 C -4.550 8.490 1.125 1.00 . A A . 5 TYR CD2 1 1 6 3683 1 1 5 TYR CE1 C -5.736 5.959 0.946 1.00 . A A . 5 TYR CE1 1 1 6 3684 1 1 5 TYR CE2 C -5.933 8.351 1.293 1.00 . A A . 5 TYR CE2 1 1 6 3685 1 1 5 TYR CG C -3.759 7.364 0.867 1.00 . A A . 5 TYR CG 1 1 6 3686 1 1 5 TYR CZ C -6.526 7.086 1.204 1.00 . A A . 5 TYR CZ 1 1 6 3687 1 1 5 TYR H H -3.051 8.225 2.989 1.00 . A A . 5 TYR H 1 1 6 3688 1 1 5 TYR HA H -1.492 6.030 2.001 1.00 . A A . 5 TYR HA 1 1 6 3689 1 1 5 TYR HB2 H -2.035 8.550 0.456 1.00 . A A . 5 TYR HB2 1 1 6 3690 1 1 5 TYR HB3 H -1.940 6.888 -0.123 1.00 . A A . 5 TYR HB3 1 1 6 3691 1 1 5 TYR HD1 H -3.745 5.225 0.579 1.00 . A A . 5 TYR HD1 1 1 6 3692 1 1 5 TYR HD2 H -4.093 9.466 1.194 1.00 . A A . 5 TYR HD2 1 1 6 3693 1 1 5 TYR HE1 H -6.194 4.983 0.878 1.00 . A A . 5 TYR HE1 1 1 6 3694 1 1 5 TYR HE2 H -6.542 9.221 1.492 1.00 . A A . 5 TYR HE2 1 1 6 3695 1 1 5 TYR HH H -8.324 7.518 0.728 1.00 . A A . 5 TYR HH 1 1 6 3696 1 1 5 TYR N N -2.286 7.628 3.129 1.00 . A A . 5 TYR N 1 1 6 3697 1 1 5 TYR O O 0.764 7.142 1.345 1.00 . A A . 5 TYR O 1 1 6 3698 1 1 5 TYR OH O -7.890 6.950 1.369 1.00 . A A . 5 TYR OH 1 1 6 3699 1 1 6 LEU C C 2.051 9.170 4.035 1.00 . A A . 6 LEU C 1 1 6 3700 1 1 6 LEU CA C 1.411 9.380 2.661 1.00 . A A . 6 LEU CA 1 1 6 3701 1 1 6 LEU CB C 1.286 10.877 2.384 1.00 . A A . 6 LEU CB 1 1 6 3702 1 1 6 LEU CD1 C 2.046 10.547 0.033 1.00 . A A . 6 LEU CD1 1 1 6 3703 1 1 6 LEU CD2 C -0.379 10.375 0.584 1.00 . A A . 6 LEU CD2 1 1 6 3704 1 1 6 LEU CG C 0.929 11.099 0.914 1.00 . A A . 6 LEU CG 1 1 6 3705 1 1 6 LEU H H -0.680 9.200 3.118 1.00 . A A . 6 LEU H 1 1 6 3706 1 1 6 LEU HA H 2.023 8.918 1.900 1.00 . A A . 6 LEU HA 1 1 6 3707 1 1 6 LEU HB2 H 0.507 11.294 3.010 1.00 . A A . 6 LEU HB2 1 1 6 3708 1 1 6 LEU HB3 H 2.223 11.365 2.602 1.00 . A A . 6 LEU HB3 1 1 6 3709 1 1 6 LEU HD11 H 2.048 9.469 0.093 1.00 . A A . 6 LEU HD11 1 1 6 3710 1 1 6 LEU HD12 H 2.997 10.929 0.374 1.00 . A A . 6 LEU HD12 1 1 6 3711 1 1 6 LEU HD13 H 1.881 10.852 -0.989 1.00 . A A . 6 LEU HD13 1 1 6 3712 1 1 6 LEU HD21 H -0.899 10.913 -0.194 1.00 . A A . 6 LEU HD21 1 1 6 3713 1 1 6 LEU HD22 H -0.999 10.331 1.467 1.00 . A A . 6 LEU HD22 1 1 6 3714 1 1 6 LEU HD23 H -0.159 9.373 0.246 1.00 . A A . 6 LEU HD23 1 1 6 3715 1 1 6 LEU HG H 0.812 12.154 0.732 1.00 . A A . 6 LEU HG 1 1 6 3716 1 1 6 LEU N N 0.060 8.772 2.636 1.00 . A A . 6 LEU N 1 1 6 3717 1 1 6 LEU O O 3.122 9.674 4.310 1.00 . A A . 6 LEU O 1 1 6 3718 1 1 7 HIS C C 1.839 6.750 6.662 1.00 . A A . 7 HIS C 1 1 6 3719 1 1 7 HIS CA C 1.996 8.215 6.253 1.00 . A A . 7 HIS CA 1 1 6 3720 1 1 7 HIS CB C 1.282 9.105 7.274 1.00 . A A . 7 HIS CB 1 1 6 3721 1 1 7 HIS CD2 C -0.039 11.295 6.675 1.00 . A A . 7 HIS CD2 1 1 6 3722 1 1 7 HIS CE1 C 1.524 12.318 5.580 1.00 . A A . 7 HIS CE1 1 1 6 3723 1 1 7 HIS CG C 1.055 10.467 6.678 1.00 . A A . 7 HIS CG 1 1 6 3724 1 1 7 HIS H H 0.544 8.040 4.668 1.00 . A A . 7 HIS H 1 1 6 3725 1 1 7 HIS HA H 3.043 8.467 6.231 1.00 . A A . 7 HIS HA 1 1 6 3726 1 1 7 HIS HB2 H 0.332 8.662 7.534 1.00 . A A . 7 HIS HB2 1 1 6 3727 1 1 7 HIS HB3 H 1.892 9.197 8.160 1.00 . A A . 7 HIS HB3 1 1 6 3728 1 1 7 HIS HD1 H 2.949 10.816 5.795 1.00 . A A . 7 HIS HD1 1 1 6 3729 1 1 7 HIS HD2 H -0.987 11.072 7.141 1.00 . A A . 7 HIS HD2 1 1 6 3730 1 1 7 HIS HE1 H 2.068 13.057 5.009 1.00 . A A . 7 HIS HE1 1 1 6 3731 1 1 7 HIS N N 1.408 8.437 4.902 1.00 . A A . 7 HIS N 1 1 6 3732 1 1 7 HIS ND1 N 2.041 11.140 5.974 1.00 . A A . 7 HIS ND1 1 1 6 3733 1 1 7 HIS NE2 N 0.260 12.463 5.982 1.00 . A A . 7 HIS NE2 1 1 6 3734 1 1 7 HIS O O 2.093 6.384 7.792 1.00 . A A . 7 HIS O 1 1 6 3735 1 1 8 SER C C 1.200 3.625 4.847 1.00 . A A . 8 SER C 1 1 6 3736 1 1 8 SER CA C 1.274 4.469 6.115 1.00 . A A . 8 SER CA 1 1 6 3737 1 1 8 SER CB C -0.003 4.280 6.935 1.00 . A A . 8 SER CB 1 1 6 3738 1 1 8 SER H H 1.235 6.213 4.848 1.00 . A A . 8 SER H 1 1 6 3739 1 1 8 SER HA H 2.124 4.155 6.694 1.00 . A A . 8 SER HA 1 1 6 3740 1 1 8 SER HB2 H -0.228 5.187 7.472 1.00 . A A . 8 SER HB2 1 1 6 3741 1 1 8 SER HB3 H -0.824 4.045 6.271 1.00 . A A . 8 SER HB3 1 1 6 3742 1 1 8 SER HG H 0.550 3.599 8.672 1.00 . A A . 8 SER HG 1 1 6 3743 1 1 8 SER N N 1.431 5.905 5.757 1.00 . A A . 8 SER N 1 1 6 3744 1 1 8 SER O O 1.711 2.524 4.797 1.00 . A A . 8 SER O 1 1 6 3745 1 1 8 SER OG O 0.190 3.222 7.865 1.00 . A A . 8 SER OG 1 1 6 3746 1 1 9 ALA C C 1.908 3.127 2.032 1.00 . A A . 9 ALA C 1 1 6 3747 1 1 9 ALA CA C 0.498 3.338 2.565 1.00 . A A . 9 ALA CA 1 1 6 3748 1 1 9 ALA CB C -0.317 4.100 1.525 1.00 . A A . 9 ALA CB 1 1 6 3749 1 1 9 ALA H H 0.182 5.023 3.873 1.00 . A A . 9 ALA H 1 1 6 3750 1 1 9 ALA HA H 0.036 2.383 2.764 1.00 . A A . 9 ALA HA 1 1 6 3751 1 1 9 ALA HB1 H -1.328 4.227 1.881 1.00 . A A . 9 ALA HB1 1 1 6 3752 1 1 9 ALA HB2 H -0.329 3.534 0.611 1.00 . A A . 9 ALA HB2 1 1 6 3753 1 1 9 ALA HB3 H 0.130 5.074 1.344 1.00 . A A . 9 ALA HB3 1 1 6 3754 1 1 9 ALA N N 0.581 4.128 3.821 1.00 . A A . 9 ALA N 1 1 6 3755 1 1 9 ALA O O 2.416 2.024 2.008 1.00 . A A . 9 ALA O 1 1 6 3756 1 1 10 LYS C C 4.698 2.973 1.719 1.00 . A A . 10 LYS C 1 1 6 3757 1 1 10 LYS CA C 3.921 4.116 1.059 1.00 . A A . 10 LYS CA 1 1 6 3758 1 1 10 LYS CB C 4.654 5.429 1.338 1.00 . A A . 10 LYS CB 1 1 6 3759 1 1 10 LYS CD C 4.452 7.909 1.206 1.00 . A A . 10 LYS CD 1 1 6 3760 1 1 10 LYS CE C 5.979 7.940 1.130 1.00 . A A . 10 LYS CE 1 1 6 3761 1 1 10 LYS CG C 3.940 6.585 0.637 1.00 . A A . 10 LYS CG 1 1 6 3762 1 1 10 LYS H H 2.064 5.061 1.640 1.00 . A A . 10 LYS H 1 1 6 3763 1 1 10 LYS HA H 3.879 3.951 -0.006 1.00 . A A . 10 LYS HA 1 1 6 3764 1 1 10 LYS HB2 H 4.672 5.610 2.403 1.00 . A A . 10 LYS HB2 1 1 6 3765 1 1 10 LYS HB3 H 5.666 5.358 0.970 1.00 . A A . 10 LYS HB3 1 1 6 3766 1 1 10 LYS HD2 H 4.044 8.730 0.635 1.00 . A A . 10 LYS HD2 1 1 6 3767 1 1 10 LYS HD3 H 4.144 8.002 2.237 1.00 . A A . 10 LYS HD3 1 1 6 3768 1 1 10 LYS HE2 H 6.391 7.836 2.122 1.00 . A A . 10 LYS HE2 1 1 6 3769 1 1 10 LYS HE3 H 6.324 7.127 0.509 1.00 . A A . 10 LYS HE3 1 1 6 3770 1 1 10 LYS HG2 H 4.143 6.544 -0.423 1.00 . A A . 10 LYS HG2 1 1 6 3771 1 1 10 LYS HG3 H 2.877 6.511 0.805 1.00 . A A . 10 LYS HG3 1 1 6 3772 1 1 10 LYS HZ1 H 6.701 9.091 -0.451 1.00 . A A . 10 LYS HZ1 1 1 6 3773 1 1 10 LYS HZ2 H 7.236 9.601 1.079 1.00 . A A . 10 LYS HZ2 1 1 6 3774 1 1 10 LYS HZ3 H 5.643 9.922 0.583 1.00 . A A . 10 LYS HZ3 1 1 6 3775 1 1 10 LYS N N 2.529 4.194 1.605 1.00 . A A . 10 LYS N 1 1 6 3776 1 1 10 LYS NZ N 6.423 9.236 0.541 1.00 . A A . 10 LYS NZ 1 1 6 3777 1 1 10 LYS O O 5.201 2.091 1.052 1.00 . A A . 10 LYS O 1 1 6 3778 1 1 11 LYS C C 5.154 0.548 3.099 1.00 . A A . 11 LYS C 1 1 6 3779 1 1 11 LYS CA C 5.552 1.888 3.711 1.00 . A A . 11 LYS CA 1 1 6 3780 1 1 11 LYS CB C 5.214 1.890 5.204 1.00 . A A . 11 LYS CB 1 1 6 3781 1 1 11 LYS CD C 6.721 2.545 7.088 1.00 . A A . 11 LYS CD 1 1 6 3782 1 1 11 LYS CE C 6.338 3.345 8.334 1.00 . A A . 11 LYS CE 1 1 6 3783 1 1 11 LYS CG C 5.926 3.060 5.886 1.00 . A A . 11 LYS CG 1 1 6 3784 1 1 11 LYS H H 4.393 3.700 3.545 1.00 . A A . 11 LYS H 1 1 6 3785 1 1 11 LYS HA H 6.613 2.041 3.579 1.00 . A A . 11 LYS HA 1 1 6 3786 1 1 11 LYS HB2 H 4.146 1.993 5.332 1.00 . A A . 11 LYS HB2 1 1 6 3787 1 1 11 LYS HB3 H 5.542 0.963 5.649 1.00 . A A . 11 LYS HB3 1 1 6 3788 1 1 11 LYS HD2 H 6.497 1.500 7.247 1.00 . A A . 11 LYS HD2 1 1 6 3789 1 1 11 LYS HD3 H 7.778 2.662 6.898 1.00 . A A . 11 LYS HD3 1 1 6 3790 1 1 11 LYS HE2 H 7.161 3.340 9.034 1.00 . A A . 11 LYS HE2 1 1 6 3791 1 1 11 LYS HE3 H 6.112 4.364 8.052 1.00 . A A . 11 LYS HE3 1 1 6 3792 1 1 11 LYS HG2 H 6.598 3.531 5.184 1.00 . A A . 11 LYS HG2 1 1 6 3793 1 1 11 LYS HG3 H 5.195 3.780 6.223 1.00 . A A . 11 LYS HG3 1 1 6 3794 1 1 11 LYS HZ1 H 4.304 2.903 8.377 1.00 . A A . 11 LYS HZ1 1 1 6 3795 1 1 11 LYS HZ2 H 4.991 3.150 9.910 1.00 . A A . 11 LYS HZ2 1 1 6 3796 1 1 11 LYS HZ3 H 5.286 1.706 9.067 1.00 . A A . 11 LYS HZ3 1 1 6 3797 1 1 11 LYS N N 4.803 2.980 3.023 1.00 . A A . 11 LYS N 1 1 6 3798 1 1 11 LYS NZ N 5.139 2.730 8.970 1.00 . A A . 11 LYS NZ 1 1 6 3799 1 1 11 LYS O O 5.949 -0.111 2.458 1.00 . A A . 11 LYS O 1 1 6 3800 1 1 12 PHE C C 3.515 -1.005 1.159 1.00 . A A . 12 PHE C 1 1 6 3801 1 1 12 PHE CA C 3.486 -1.143 2.679 1.00 . A A . 12 PHE CA 1 1 6 3802 1 1 12 PHE CB C 2.064 -1.466 3.142 1.00 . A A . 12 PHE CB 1 1 6 3803 1 1 12 PHE CD1 C 2.945 -1.316 5.498 1.00 . A A . 12 PHE CD1 1 1 6 3804 1 1 12 PHE CD2 C 0.723 -0.465 5.028 1.00 . A A . 12 PHE CD2 1 1 6 3805 1 1 12 PHE CE1 C 2.801 -0.951 6.842 1.00 . A A . 12 PHE CE1 1 1 6 3806 1 1 12 PHE CE2 C 0.578 -0.101 6.372 1.00 . A A . 12 PHE CE2 1 1 6 3807 1 1 12 PHE CG C 1.907 -1.072 4.591 1.00 . A A . 12 PHE CG 1 1 6 3808 1 1 12 PHE CZ C 1.617 -0.344 7.279 1.00 . A A . 12 PHE CZ 1 1 6 3809 1 1 12 PHE H H 3.294 0.694 3.778 1.00 . A A . 12 PHE H 1 1 6 3810 1 1 12 PHE HA H 4.157 -1.933 2.984 1.00 . A A . 12 PHE HA 1 1 6 3811 1 1 12 PHE HB2 H 1.354 -0.916 2.540 1.00 . A A . 12 PHE HB2 1 1 6 3812 1 1 12 PHE HB3 H 1.882 -2.528 3.038 1.00 . A A . 12 PHE HB3 1 1 6 3813 1 1 12 PHE HD1 H 3.857 -1.784 5.161 1.00 . A A . 12 PHE HD1 1 1 6 3814 1 1 12 PHE HD2 H -0.079 -0.278 4.328 1.00 . A A . 12 PHE HD2 1 1 6 3815 1 1 12 PHE HE1 H 3.602 -1.139 7.541 1.00 . A A . 12 PHE HE1 1 1 6 3816 1 1 12 PHE HE2 H -0.335 0.368 6.710 1.00 . A A . 12 PHE HE2 1 1 6 3817 1 1 12 PHE HZ H 1.505 -0.063 8.316 1.00 . A A . 12 PHE HZ 1 1 6 3818 1 1 12 PHE N N 3.926 0.145 3.272 1.00 . A A . 12 PHE N 1 1 6 3819 1 1 12 PHE O O 3.793 -1.944 0.444 1.00 . A A . 12 PHE O 1 1 6 3820 1 1 13 GLY C C 4.487 -0.311 -1.406 1.00 . A A . 13 GLY C 1 1 6 3821 1 1 13 GLY CA C 3.254 0.373 -0.817 1.00 . A A . 13 GLY CA 1 1 6 3822 1 1 13 GLY H H 3.019 0.915 1.255 1.00 . A A . 13 GLY H 1 1 6 3823 1 1 13 GLY HA2 H 2.360 -0.054 -1.250 1.00 . A A . 13 GLY HA2 1 1 6 3824 1 1 13 GLY HA3 H 3.292 1.429 -1.033 1.00 . A A . 13 GLY HA3 1 1 6 3825 1 1 13 GLY N N 3.236 0.169 0.659 1.00 . A A . 13 GLY N 1 1 6 3826 1 1 13 GLY O O 4.467 -0.797 -2.519 1.00 . A A . 13 GLY O 1 1 6 3827 1 1 14 LYS C C 6.908 -2.424 -0.608 1.00 . A A . 14 LYS C 1 1 6 3828 1 1 14 LYS CA C 6.794 -1.011 -1.187 1.00 . A A . 14 LYS CA 1 1 6 3829 1 1 14 LYS CB C 8.020 -0.190 -0.780 1.00 . A A . 14 LYS CB 1 1 6 3830 1 1 14 LYS CD C 8.862 0.212 -3.099 1.00 . A A . 14 LYS CD 1 1 6 3831 1 1 14 LYS CE C 10.390 0.254 -3.056 1.00 . A A . 14 LYS CE 1 1 6 3832 1 1 14 LYS CG C 8.297 0.877 -1.842 1.00 . A A . 14 LYS CG 1 1 6 3833 1 1 14 LYS H H 5.559 0.044 0.231 1.00 . A A . 14 LYS H 1 1 6 3834 1 1 14 LYS HA H 6.742 -1.067 -2.265 1.00 . A A . 14 LYS HA 1 1 6 3835 1 1 14 LYS HB2 H 7.832 0.287 0.171 1.00 . A A . 14 LYS HB2 1 1 6 3836 1 1 14 LYS HB3 H 8.877 -0.841 -0.695 1.00 . A A . 14 LYS HB3 1 1 6 3837 1 1 14 LYS HD2 H 8.530 -0.815 -3.142 1.00 . A A . 14 LYS HD2 1 1 6 3838 1 1 14 LYS HD3 H 8.513 0.741 -3.974 1.00 . A A . 14 LYS HD3 1 1 6 3839 1 1 14 LYS HE2 H 10.715 0.567 -2.076 1.00 . A A . 14 LYS HE2 1 1 6 3840 1 1 14 LYS HE3 H 10.783 -0.730 -3.269 1.00 . A A . 14 LYS HE3 1 1 6 3841 1 1 14 LYS HG2 H 7.377 1.389 -2.086 1.00 . A A . 14 LYS HG2 1 1 6 3842 1 1 14 LYS HG3 H 9.015 1.587 -1.459 1.00 . A A . 14 LYS HG3 1 1 6 3843 1 1 14 LYS HZ1 H 10.714 0.839 -5.029 1.00 . A A . 14 LYS HZ1 1 1 6 3844 1 1 14 LYS HZ2 H 11.911 1.367 -3.944 1.00 . A A . 14 LYS HZ2 1 1 6 3845 1 1 14 LYS HZ3 H 10.391 2.125 -3.970 1.00 . A A . 14 LYS HZ3 1 1 6 3846 1 1 14 LYS N N 5.563 -0.354 -0.667 1.00 . A A . 14 LYS N 1 1 6 3847 1 1 14 LYS NZ N 10.889 1.219 -4.077 1.00 . A A . 14 LYS NZ 1 1 6 3848 1 1 14 LYS O O 7.504 -3.300 -1.202 1.00 . A A . 14 LYS O 1 1 6 3849 1 1 15 ALA C C 5.233 -4.853 0.726 1.00 . A A . 15 ALA C 1 1 6 3850 1 1 15 ALA CA C 6.431 -4.009 1.163 1.00 . A A . 15 ALA CA 1 1 6 3851 1 1 15 ALA CB C 6.423 -3.881 2.687 1.00 . A A . 15 ALA CB 1 1 6 3852 1 1 15 ALA H H 5.872 -1.931 1.014 1.00 . A A . 15 ALA H 1 1 6 3853 1 1 15 ALA HA H 7.344 -4.490 0.849 1.00 . A A . 15 ALA HA 1 1 6 3854 1 1 15 ALA HB1 H 5.718 -4.589 3.102 1.00 . A A . 15 ALA HB1 1 1 6 3855 1 1 15 ALA HB2 H 6.132 -2.879 2.963 1.00 . A A . 15 ALA HB2 1 1 6 3856 1 1 15 ALA HB3 H 7.411 -4.090 3.071 1.00 . A A . 15 ALA HB3 1 1 6 3857 1 1 15 ALA N N 6.346 -2.651 0.549 1.00 . A A . 15 ALA N 1 1 6 3858 1 1 15 ALA O O 5.374 -5.999 0.349 1.00 . A A . 15 ALA O 1 1 6 3859 1 1 16 TRP C C 2.984 -5.498 -1.087 1.00 . A A . 16 TRP C 1 1 6 3860 1 1 16 TRP CA C 2.850 -5.068 0.375 1.00 . A A . 16 TRP CA 1 1 6 3861 1 1 16 TRP CB C 1.594 -4.204 0.588 1.00 . A A . 16 TRP CB 1 1 6 3862 1 1 16 TRP CD1 C 1.276 -2.065 -0.740 1.00 . A A . 16 TRP CD1 1 1 6 3863 1 1 16 TRP CD2 C 0.834 -3.906 -1.938 1.00 . A A . 16 TRP CD2 1 1 6 3864 1 1 16 TRP CE2 C 0.633 -2.808 -2.803 1.00 . A A . 16 TRP CE2 1 1 6 3865 1 1 16 TRP CE3 C 0.620 -5.192 -2.435 1.00 . A A . 16 TRP CE3 1 1 6 3866 1 1 16 TRP CG C 1.258 -3.413 -0.643 1.00 . A A . 16 TRP CG 1 1 6 3867 1 1 16 TRP CH2 C 0.026 -4.283 -4.610 1.00 . A A . 16 TRP CH2 1 1 6 3868 1 1 16 TRP CZ2 C 0.232 -2.987 -4.127 1.00 . A A . 16 TRP CZ2 1 1 6 3869 1 1 16 TRP CZ3 C 0.218 -5.382 -3.761 1.00 . A A . 16 TRP CZ3 1 1 6 3870 1 1 16 TRP H H 3.961 -3.375 1.090 1.00 . A A . 16 TRP H 1 1 6 3871 1 1 16 TRP HA H 2.773 -5.949 0.992 1.00 . A A . 16 TRP HA 1 1 6 3872 1 1 16 TRP HB2 H 0.760 -4.845 0.831 1.00 . A A . 16 TRP HB2 1 1 6 3873 1 1 16 TRP HB3 H 1.768 -3.524 1.410 1.00 . A A . 16 TRP HB3 1 1 6 3874 1 1 16 TRP HD1 H 1.537 -1.383 0.052 1.00 . A A . 16 TRP HD1 1 1 6 3875 1 1 16 TRP HE1 H 0.862 -0.787 -2.363 1.00 . A A . 16 TRP HE1 1 1 6 3876 1 1 16 TRP HE3 H 0.759 -6.041 -1.783 1.00 . A A . 16 TRP HE3 1 1 6 3877 1 1 16 TRP HH2 H -0.284 -4.438 -5.634 1.00 . A A . 16 TRP HH2 1 1 6 3878 1 1 16 TRP HZ2 H 0.086 -2.134 -4.773 1.00 . A A . 16 TRP HZ2 1 1 6 3879 1 1 16 TRP HZ3 H 0.066 -6.377 -4.130 1.00 . A A . 16 TRP HZ3 1 1 6 3880 1 1 16 TRP N N 4.054 -4.298 0.780 1.00 . A A . 16 TRP N 1 1 6 3881 1 1 16 TRP NE1 N 0.916 -1.704 -2.027 1.00 . A A . 16 TRP NE1 1 1 6 3882 1 1 16 TRP O O 2.698 -6.621 -1.444 1.00 . A A . 16 TRP O 1 1 6 3883 1 1 17 VAL C C 4.581 -6.122 -3.494 1.00 . A A . 17 VAL C 1 1 6 3884 1 1 17 VAL CA C 3.535 -5.014 -3.375 1.00 . A A . 17 VAL CA 1 1 6 3885 1 1 17 VAL CB C 3.927 -3.788 -4.215 1.00 . A A . 17 VAL CB 1 1 6 3886 1 1 17 VAL CG1 C 5.453 -3.645 -4.291 1.00 . A A . 17 VAL CG1 1 1 6 3887 1 1 17 VAL CG2 C 3.359 -3.942 -5.625 1.00 . A A . 17 VAL CG2 1 1 6 3888 1 1 17 VAL H H 3.630 -3.710 -1.660 1.00 . A A . 17 VAL H 1 1 6 3889 1 1 17 VAL HA H 2.582 -5.399 -3.714 1.00 . A A . 17 VAL HA 1 1 6 3890 1 1 17 VAL HB H 3.513 -2.902 -3.760 1.00 . A A . 17 VAL HB 1 1 6 3891 1 1 17 VAL HG11 H 5.706 -2.845 -4.971 1.00 . A A . 17 VAL HG11 1 1 6 3892 1 1 17 VAL HG12 H 5.885 -4.568 -4.647 1.00 . A A . 17 VAL HG12 1 1 6 3893 1 1 17 VAL HG13 H 5.842 -3.420 -3.309 1.00 . A A . 17 VAL HG13 1 1 6 3894 1 1 17 VAL HG21 H 2.526 -4.631 -5.604 1.00 . A A . 17 VAL HG21 1 1 6 3895 1 1 17 VAL HG22 H 4.126 -4.324 -6.283 1.00 . A A . 17 VAL HG22 1 1 6 3896 1 1 17 VAL HG23 H 3.021 -2.982 -5.985 1.00 . A A . 17 VAL HG23 1 1 6 3897 1 1 17 VAL N N 3.407 -4.620 -1.947 1.00 . A A . 17 VAL N 1 1 6 3898 1 1 17 VAL O O 4.336 -7.163 -4.070 1.00 . A A . 17 VAL O 1 1 6 3899 1 1 18 GLY C C 6.175 -8.279 -2.400 1.00 . A A . 18 GLY C 1 1 6 3900 1 1 18 GLY CA C 6.770 -6.996 -2.987 1.00 . A A . 18 GLY CA 1 1 6 3901 1 1 18 GLY H H 5.915 -5.096 -2.438 1.00 . A A . 18 GLY H 1 1 6 3902 1 1 18 GLY HA2 H 7.055 -7.162 -4.018 1.00 . A A . 18 GLY HA2 1 1 6 3903 1 1 18 GLY HA3 H 7.634 -6.703 -2.412 1.00 . A A . 18 GLY HA3 1 1 6 3904 1 1 18 GLY N N 5.737 -5.929 -2.924 1.00 . A A . 18 GLY N 1 1 6 3905 1 1 18 GLY O O 6.694 -9.362 -2.580 1.00 . A A . 18 GLY O 1 1 6 3906 1 1 19 GLU C C 3.449 -9.911 -2.129 1.00 . A A . 19 GLU C 1 1 6 3907 1 1 19 GLU CA C 4.416 -9.333 -1.102 1.00 . A A . 19 GLU CA 1 1 6 3908 1 1 19 GLU CB C 3.648 -8.864 0.143 1.00 . A A . 19 GLU CB 1 1 6 3909 1 1 19 GLU CD C 2.868 -11.226 0.425 1.00 . A A . 19 GLU CD 1 1 6 3910 1 1 19 GLU CG C 2.436 -9.757 0.402 1.00 . A A . 19 GLU CG 1 1 6 3911 1 1 19 GLU H H 4.674 -7.277 -1.577 1.00 . A A . 19 GLU H 1 1 6 3912 1 1 19 GLU HA H 5.152 -10.072 -0.831 1.00 . A A . 19 GLU HA 1 1 6 3913 1 1 19 GLU HB2 H 4.302 -8.891 1.001 1.00 . A A . 19 GLU HB2 1 1 6 3914 1 1 19 GLU HB3 H 3.305 -7.852 -0.018 1.00 . A A . 19 GLU HB3 1 1 6 3915 1 1 19 GLU HG2 H 1.996 -9.493 1.352 1.00 . A A . 19 GLU HG2 1 1 6 3916 1 1 19 GLU HG3 H 1.712 -9.606 -0.385 1.00 . A A . 19 GLU HG3 1 1 6 3917 1 1 19 GLU N N 5.076 -8.154 -1.703 1.00 . A A . 19 GLU N 1 1 6 3918 1 1 19 GLU O O 3.649 -10.987 -2.657 1.00 . A A . 19 GLU O 1 1 6 3919 1 1 19 GLU OE1 O 3.317 -11.674 1.467 1.00 . A A . 19 GLU OE1 1 1 6 3920 1 1 19 GLU OE2 O 2.740 -11.876 -0.600 1.00 . A A . 19 GLU OE2 1 1 6 3921 1 1 20 ILE C C 2.002 -9.612 -4.796 1.00 . A A . 20 ILE C 1 1 6 3922 1 1 20 ILE CA C 1.410 -9.695 -3.392 1.00 . A A . 20 ILE CA 1 1 6 3923 1 1 20 ILE CB C 0.161 -8.825 -3.325 1.00 . A A . 20 ILE CB 1 1 6 3924 1 1 20 ILE CD1 C -1.604 -7.983 -1.778 1.00 . A A . 20 ILE CD1 1 1 6 3925 1 1 20 ILE CG1 C -0.591 -9.103 -2.025 1.00 . A A . 20 ILE CG1 1 1 6 3926 1 1 20 ILE CG2 C -0.748 -9.127 -4.519 1.00 . A A . 20 ILE CG2 1 1 6 3927 1 1 20 ILE H H 2.257 -8.332 -1.962 1.00 . A A . 20 ILE H 1 1 6 3928 1 1 20 ILE HA H 1.158 -10.713 -3.162 1.00 . A A . 20 ILE HA 1 1 6 3929 1 1 20 ILE HB H 0.459 -7.794 -3.352 1.00 . A A . 20 ILE HB 1 1 6 3930 1 1 20 ILE HD11 H -1.465 -7.584 -0.785 1.00 . A A . 20 ILE HD11 1 1 6 3931 1 1 20 ILE HD12 H -2.606 -8.375 -1.871 1.00 . A A . 20 ILE HD12 1 1 6 3932 1 1 20 ILE HD13 H -1.455 -7.198 -2.505 1.00 . A A . 20 ILE HD13 1 1 6 3933 1 1 20 ILE HG12 H -1.107 -10.048 -2.103 1.00 . A A . 20 ILE HG12 1 1 6 3934 1 1 20 ILE HG13 H 0.111 -9.137 -1.206 1.00 . A A . 20 ILE HG13 1 1 6 3935 1 1 20 ILE HG21 H -1.779 -9.108 -4.200 1.00 . A A . 20 ILE HG21 1 1 6 3936 1 1 20 ILE HG22 H -0.511 -10.103 -4.915 1.00 . A A . 20 ILE HG22 1 1 6 3937 1 1 20 ILE HG23 H -0.595 -8.380 -5.286 1.00 . A A . 20 ILE HG23 1 1 6 3938 1 1 20 ILE N N 2.398 -9.198 -2.407 1.00 . A A . 20 ILE N 1 1 6 3939 1 1 20 ILE O O 1.939 -10.549 -5.568 1.00 . A A . 20 ILE O 1 1 6 3940 1 1 21 MET C C 4.171 -9.463 -6.734 1.00 . A A . 21 MET C 1 1 6 3941 1 1 21 MET CA C 3.162 -8.338 -6.489 1.00 . A A . 21 MET CA 1 1 6 3942 1 1 21 MET CB C 3.861 -6.983 -6.588 1.00 . A A . 21 MET CB 1 1 6 3943 1 1 21 MET CE C 4.390 -5.400 -10.327 1.00 . A A . 21 MET CE 1 1 6 3944 1 1 21 MET CG C 3.520 -6.329 -7.927 1.00 . A A . 21 MET CG 1 1 6 3945 1 1 21 MET H H 2.607 -7.748 -4.496 1.00 . A A . 21 MET H 1 1 6 3946 1 1 21 MET HA H 2.376 -8.391 -7.230 1.00 . A A . 21 MET HA 1 1 6 3947 1 1 21 MET HB2 H 3.521 -6.346 -5.782 1.00 . A A . 21 MET HB2 1 1 6 3948 1 1 21 MET HB3 H 4.930 -7.121 -6.517 1.00 . A A . 21 MET HB3 1 1 6 3949 1 1 21 MET HE1 H 5.272 -4.833 -10.594 1.00 . A A . 21 MET HE1 1 1 6 3950 1 1 21 MET HE2 H 3.655 -4.738 -9.899 1.00 . A A . 21 MET HE2 1 1 6 3951 1 1 21 MET HE3 H 3.979 -5.871 -11.209 1.00 . A A . 21 MET HE3 1 1 6 3952 1 1 21 MET HG2 H 2.585 -6.730 -8.294 1.00 . A A . 21 MET HG2 1 1 6 3953 1 1 21 MET HG3 H 3.426 -5.260 -7.791 1.00 . A A . 21 MET HG3 1 1 6 3954 1 1 21 MET N N 2.571 -8.491 -5.135 1.00 . A A . 21 MET N 1 1 6 3955 1 1 21 MET O O 4.519 -9.761 -7.859 1.00 . A A . 21 MET O 1 1 6 3956 1 1 21 MET SD S 4.837 -6.673 -9.121 1.00 . A A . 21 MET SD 1 1 6 3957 1 1 22 ASN C C 4.865 -12.482 -6.250 1.00 . A A . 22 ASN C 1 1 6 3958 1 1 22 ASN CA C 5.618 -11.204 -5.873 1.00 . A A . 22 ASN CA 1 1 6 3959 1 1 22 ASN CB C 6.389 -11.432 -4.572 1.00 . A A . 22 ASN CB 1 1 6 3960 1 1 22 ASN CG C 7.321 -12.634 -4.733 1.00 . A A . 22 ASN CG 1 1 6 3961 1 1 22 ASN H H 4.343 -9.847 -4.788 1.00 . A A . 22 ASN H 1 1 6 3962 1 1 22 ASN HA H 6.309 -10.948 -6.663 1.00 . A A . 22 ASN HA 1 1 6 3963 1 1 22 ASN HB2 H 6.973 -10.550 -4.342 1.00 . A A . 22 ASN HB2 1 1 6 3964 1 1 22 ASN HB3 H 5.692 -11.624 -3.768 1.00 . A A . 22 ASN HB3 1 1 6 3965 1 1 22 ASN HD21 H 8.923 -11.656 -4.078 1.00 . A A . 22 ASN HD21 1 1 6 3966 1 1 22 ASN HD22 H 9.188 -13.283 -4.516 1.00 . A A . 22 ASN HD22 1 1 6 3967 1 1 22 ASN N N 4.638 -10.096 -5.690 1.00 . A A . 22 ASN N 1 1 6 3968 1 1 22 ASN ND2 N 8.582 -12.515 -4.416 1.00 . A A . 22 ASN ND2 1 1 6 3969 1 1 22 ASN O O 5.334 -13.284 -7.032 1.00 . A A . 22 ASN O 1 1 6 3970 1 1 22 ASN OD1 O 6.899 -13.694 -5.150 1.00 . A A . 22 ASN OD1 1 1 6 3971 1 1 23 SER C C 2.559 -13.891 -7.514 1.00 . A A . 23 SER C 1 1 6 3972 1 1 23 SER CA C 2.915 -13.900 -6.026 1.00 . A A . 23 SER CA 1 1 6 3973 1 1 23 SER CB C 1.632 -13.919 -5.194 1.00 . A A . 23 SER CB 1 1 6 3974 1 1 23 SER H H 3.337 -12.015 -5.071 1.00 . A A . 23 SER H 1 1 6 3975 1 1 23 SER HA H 3.505 -14.776 -5.801 1.00 . A A . 23 SER HA 1 1 6 3976 1 1 23 SER HB2 H 0.796 -14.172 -5.824 1.00 . A A . 23 SER HB2 1 1 6 3977 1 1 23 SER HB3 H 1.724 -14.659 -4.409 1.00 . A A . 23 SER HB3 1 1 6 3978 1 1 23 SER HG H 1.177 -12.751 -3.706 1.00 . A A . 23 SER HG 1 1 6 3979 1 1 23 SER N N 3.698 -12.676 -5.699 1.00 . A A . 23 SER N 1 1 6 3980 1 1 23 SER O O 1.575 -14.519 -7.871 1.00 . A A . 23 SER O 1 1 6 3981 1 1 23 SER OXT O 3.275 -13.256 -8.270 1.00 . A A . 23 SER OXT 1 1 6 3982 1 1 23 SER OG O 1.420 -12.633 -4.627 1.00 . A A . 23 SER OG 1 1 6 3983 2 1 1 GLY C C 1.622 -12.536 8.856 1.00 . B B . 1 GLY C 1 1 6 3984 2 1 1 GLY CA C 2.423 -12.752 10.140 1.00 . B B . 1 GLY CA 1 1 6 3985 2 1 1 GLY H1 H 4.048 -13.587 9.141 1.00 . B B . 1 GLY H1 1 1 6 3986 2 1 1 GLY H2 H 4.418 -12.989 10.688 1.00 . B B . 1 GLY H2 1 1 6 3987 2 1 1 GLY H3 H 4.178 -11.914 9.394 1.00 . B B . 1 GLY H3 1 1 6 3988 2 1 1 GLY HA2 H 2.118 -13.679 10.606 1.00 . B B . 1 GLY HA2 1 1 6 3989 2 1 1 GLY HA3 H 2.239 -11.931 10.816 1.00 . B B . 1 GLY HA3 1 1 6 3990 2 1 1 GLY N N 3.876 -12.815 9.817 1.00 . B B . 1 GLY N 1 1 6 3991 2 1 1 GLY O O 0.650 -13.218 8.596 1.00 . B B . 1 GLY O 1 1 6 3992 2 1 2 ILE C C -0.205 -11.163 7.081 1.00 . B B . 2 ILE C 1 1 6 3993 2 1 2 ILE CA C 1.283 -11.336 6.779 1.00 . B B . 2 ILE CA 1 1 6 3994 2 1 2 ILE CB C 1.476 -12.519 5.830 1.00 . B B . 2 ILE CB 1 1 6 3995 2 1 2 ILE CD1 C 3.606 -13.580 6.593 1.00 . B B . 2 ILE CD1 1 1 6 3996 2 1 2 ILE CG1 C 2.966 -12.690 5.526 1.00 . B B . 2 ILE CG1 1 1 6 3997 2 1 2 ILE CG2 C 0.719 -12.261 4.527 1.00 . B B . 2 ILE CG2 1 1 6 3998 2 1 2 ILE H H 2.809 -11.054 8.274 1.00 . B B . 2 ILE H 1 1 6 3999 2 1 2 ILE HA H 1.663 -10.436 6.316 1.00 . B B . 2 ILE HA 1 1 6 4000 2 1 2 ILE HB H 1.097 -13.418 6.295 1.00 . B B . 2 ILE HB 1 1 6 4001 2 1 2 ILE HD11 H 4.203 -14.343 6.114 1.00 . B B . 2 ILE HD11 1 1 6 4002 2 1 2 ILE HD12 H 2.832 -14.048 7.183 1.00 . B B . 2 ILE HD12 1 1 6 4003 2 1 2 ILE HD13 H 4.234 -12.981 7.233 1.00 . B B . 2 ILE HD13 1 1 6 4004 2 1 2 ILE HG12 H 3.085 -13.149 4.553 1.00 . B B . 2 ILE HG12 1 1 6 4005 2 1 2 ILE HG13 H 3.448 -11.722 5.532 1.00 . B B . 2 ILE HG13 1 1 6 4006 2 1 2 ILE HG21 H 0.001 -13.051 4.365 1.00 . B B . 2 ILE HG21 1 1 6 4007 2 1 2 ILE HG22 H 1.418 -12.236 3.704 1.00 . B B . 2 ILE HG22 1 1 6 4008 2 1 2 ILE HG23 H 0.203 -11.314 4.592 1.00 . B B . 2 ILE HG23 1 1 6 4009 2 1 2 ILE N N 2.022 -11.593 8.047 1.00 . B B . 2 ILE N 1 1 6 4010 2 1 2 ILE O O -0.997 -12.065 6.886 1.00 . B B . 2 ILE O 1 1 6 4011 2 1 3 GLY C C -2.368 -8.305 7.692 1.00 . B B . 3 GLY C 1 1 6 4012 2 1 3 GLY CA C -2.034 -9.785 7.867 1.00 . B B . 3 GLY CA 1 1 6 4013 2 1 3 GLY H H 0.058 -9.297 7.706 1.00 . B B . 3 GLY H 1 1 6 4014 2 1 3 GLY HA2 H -2.642 -10.371 7.193 1.00 . B B . 3 GLY HA2 1 1 6 4015 2 1 3 GLY HA3 H -2.236 -10.079 8.885 1.00 . B B . 3 GLY HA3 1 1 6 4016 2 1 3 GLY N N -0.595 -10.013 7.556 1.00 . B B . 3 GLY N 1 1 6 4017 2 1 3 GLY O O -3.368 -7.819 8.182 1.00 . B B . 3 GLY O 1 1 6 4018 2 1 4 LYS C C -1.543 -5.819 5.298 1.00 . B B . 4 LYS C 1 1 6 4019 2 1 4 LYS CA C -1.805 -6.142 6.766 1.00 . B B . 4 LYS CA 1 1 6 4020 2 1 4 LYS CB C -0.878 -5.308 7.651 1.00 . B B . 4 LYS CB 1 1 6 4021 2 1 4 LYS CD C 1.263 -5.370 8.945 1.00 . B B . 4 LYS CD 1 1 6 4022 2 1 4 LYS CE C 1.246 -3.851 8.767 1.00 . B B . 4 LYS CE 1 1 6 4023 2 1 4 LYS CG C 0.463 -6.028 7.816 1.00 . B B . 4 LYS CG 1 1 6 4024 2 1 4 LYS H H -0.744 -8.004 6.598 1.00 . B B . 4 LYS H 1 1 6 4025 2 1 4 LYS HA H -2.835 -5.920 7.008 1.00 . B B . 4 LYS HA 1 1 6 4026 2 1 4 LYS HB2 H -0.717 -4.344 7.191 1.00 . B B . 4 LYS HB2 1 1 6 4027 2 1 4 LYS HB3 H -1.334 -5.175 8.620 1.00 . B B . 4 LYS HB3 1 1 6 4028 2 1 4 LYS HD2 H 0.819 -5.627 9.895 1.00 . B B . 4 LYS HD2 1 1 6 4029 2 1 4 LYS HD3 H 2.282 -5.723 8.915 1.00 . B B . 4 LYS HD3 1 1 6 4030 2 1 4 LYS HE2 H 2.207 -3.446 9.044 1.00 . B B . 4 LYS HE2 1 1 6 4031 2 1 4 LYS HE3 H 1.038 -3.611 7.735 1.00 . B B . 4 LYS HE3 1 1 6 4032 2 1 4 LYS HG2 H 0.289 -7.066 8.058 1.00 . B B . 4 LYS HG2 1 1 6 4033 2 1 4 LYS HG3 H 1.023 -5.961 6.895 1.00 . B B . 4 LYS HG3 1 1 6 4034 2 1 4 LYS HZ1 H -0.320 -2.523 9.112 1.00 . B B . 4 LYS HZ1 1 1 6 4035 2 1 4 LYS HZ2 H 0.629 -2.846 10.483 1.00 . B B . 4 LYS HZ2 1 1 6 4036 2 1 4 LYS HZ3 H -0.480 -4.004 9.922 1.00 . B B . 4 LYS HZ3 1 1 6 4037 2 1 4 LYS N N -1.541 -7.589 6.988 1.00 . B B . 4 LYS N 1 1 6 4038 2 1 4 LYS NZ N 0.189 -3.261 9.637 1.00 . B B . 4 LYS NZ 1 1 6 4039 2 1 4 LYS O O -2.316 -5.141 4.650 1.00 . B B . 4 LYS O 1 1 6 4040 2 1 5 TYR C C -1.209 -6.691 2.463 1.00 . B B . 5 TYR C 1 1 6 4041 2 1 5 TYR CA C -0.144 -6.054 3.342 1.00 . B B . 5 TYR CA 1 1 6 4042 2 1 5 TYR CB C 1.209 -6.667 3.019 1.00 . B B . 5 TYR CB 1 1 6 4043 2 1 5 TYR CD1 C 2.792 -4.986 4.034 1.00 . B B . 5 TYR CD1 1 1 6 4044 2 1 5 TYR CD2 C 2.552 -7.156 5.088 1.00 . B B . 5 TYR CD2 1 1 6 4045 2 1 5 TYR CE1 C 3.719 -4.612 5.015 1.00 . B B . 5 TYR CE1 1 1 6 4046 2 1 5 TYR CE2 C 3.478 -6.783 6.069 1.00 . B B . 5 TYR CE2 1 1 6 4047 2 1 5 TYR CG C 2.210 -6.259 4.071 1.00 . B B . 5 TYR CG 1 1 6 4048 2 1 5 TYR CZ C 4.063 -5.510 6.032 1.00 . B B . 5 TYR CZ 1 1 6 4049 2 1 5 TYR H H 0.147 -6.861 5.301 1.00 . B B . 5 TYR H 1 1 6 4050 2 1 5 TYR HA H -0.111 -4.998 3.160 1.00 . B B . 5 TYR HA 1 1 6 4051 2 1 5 TYR HB2 H 1.121 -7.746 3.002 1.00 . B B . 5 TYR HB2 1 1 6 4052 2 1 5 TYR HB3 H 1.534 -6.317 2.058 1.00 . B B . 5 TYR HB3 1 1 6 4053 2 1 5 TYR HD1 H 2.529 -4.291 3.249 1.00 . B B . 5 TYR HD1 1 1 6 4054 2 1 5 TYR HD2 H 2.098 -8.138 5.116 1.00 . B B . 5 TYR HD2 1 1 6 4055 2 1 5 TYR HE1 H 4.170 -3.631 4.986 1.00 . B B . 5 TYR HE1 1 1 6 4056 2 1 5 TYR HE2 H 3.743 -7.475 6.854 1.00 . B B . 5 TYR HE2 1 1 6 4057 2 1 5 TYR HH H 4.730 -4.272 7.322 1.00 . B B . 5 TYR HH 1 1 6 4058 2 1 5 TYR N N -0.460 -6.312 4.764 1.00 . B B . 5 TYR N 1 1 6 4059 2 1 5 TYR O O -1.343 -6.369 1.298 1.00 . B B . 5 TYR O 1 1 6 4060 2 1 5 TYR OH O 4.976 -5.142 6.999 1.00 . B B . 5 TYR OH 1 1 6 4061 2 1 6 LEU C C -4.398 -7.847 2.640 1.00 . B B . 6 LEU C 1 1 6 4062 2 1 6 LEU CA C -3.002 -8.272 2.181 1.00 . B B . 6 LEU CA 1 1 6 4063 2 1 6 LEU CB C -2.853 -9.787 2.338 1.00 . B B . 6 LEU CB 1 1 6 4064 2 1 6 LEU CD1 C -2.421 -10.561 0.003 1.00 . B B . 6 LEU CD1 1 1 6 4065 2 1 6 LEU CD2 C -0.641 -9.313 1.238 1.00 . B B . 6 LEU CD2 1 1 6 4066 2 1 6 LEU CG C -1.789 -10.321 1.374 1.00 . B B . 6 LEU CG 1 1 6 4067 2 1 6 LEU H H -1.830 -7.867 3.938 1.00 . B B . 6 LEU H 1 1 6 4068 2 1 6 LEU HA H -2.862 -7.999 1.146 1.00 . B B . 6 LEU HA 1 1 6 4069 2 1 6 LEU HB2 H -2.558 -10.011 3.354 1.00 . B B . 6 LEU HB2 1 1 6 4070 2 1 6 LEU HB3 H -3.799 -10.262 2.126 1.00 . B B . 6 LEU HB3 1 1 6 4071 2 1 6 LEU HD11 H -1.735 -11.118 -0.619 1.00 . B B . 6 LEU HD11 1 1 6 4072 2 1 6 LEU HD12 H -2.642 -9.612 -0.463 1.00 . B B . 6 LEU HD12 1 1 6 4073 2 1 6 LEU HD13 H -3.336 -11.123 0.123 1.00 . B B . 6 LEU HD13 1 1 6 4074 2 1 6 LEU HD21 H 0.116 -9.716 0.583 1.00 . B B . 6 LEU HD21 1 1 6 4075 2 1 6 LEU HD22 H -0.212 -9.122 2.211 1.00 . B B . 6 LEU HD22 1 1 6 4076 2 1 6 LEU HD23 H -1.018 -8.389 0.826 1.00 . B B . 6 LEU HD23 1 1 6 4077 2 1 6 LEU HG H -1.404 -11.254 1.757 1.00 . B B . 6 LEU HG 1 1 6 4078 2 1 6 LEU N N -1.961 -7.606 3.001 1.00 . B B . 6 LEU N 1 1 6 4079 2 1 6 LEU O O -5.385 -8.142 1.995 1.00 . B B . 6 LEU O 1 1 6 4080 2 1 7 HIS C C -5.857 -5.241 4.510 1.00 . B B . 7 HIS C 1 1 6 4081 2 1 7 HIS CA C -5.846 -6.743 4.224 1.00 . B B . 7 HIS CA 1 1 6 4082 2 1 7 HIS CB C -6.198 -7.508 5.500 1.00 . B B . 7 HIS CB 1 1 6 4083 2 1 7 HIS CD2 C -4.860 -9.682 6.111 1.00 . B B . 7 HIS CD2 1 1 6 4084 2 1 7 HIS CE1 C -5.587 -10.959 4.518 1.00 . B B . 7 HIS CE1 1 1 6 4085 2 1 7 HIS CG C -5.735 -8.932 5.369 1.00 . B B . 7 HIS CG 1 1 6 4086 2 1 7 HIS H H -3.699 -6.936 4.263 1.00 . B B . 7 HIS H 1 1 6 4087 2 1 7 HIS HA H -6.577 -6.963 3.463 1.00 . B B . 7 HIS HA 1 1 6 4088 2 1 7 HIS HB2 H -5.709 -7.047 6.345 1.00 . B B . 7 HIS HB2 1 1 6 4089 2 1 7 HIS HB3 H -7.268 -7.490 5.649 1.00 . B B . 7 HIS HB3 1 1 6 4090 2 1 7 HIS HD1 H -6.827 -9.528 3.654 1.00 . B B . 7 HIS HD1 1 1 6 4091 2 1 7 HIS HD2 H -4.324 -9.332 6.981 1.00 . B B . 7 HIS HD2 1 1 6 4092 2 1 7 HIS HE1 H -5.748 -11.809 3.872 1.00 . B B . 7 HIS HE1 1 1 6 4093 2 1 7 HIS N N -4.499 -7.165 3.747 1.00 . B B . 7 HIS N 1 1 6 4094 2 1 7 HIS ND1 N -6.187 -9.766 4.358 1.00 . B B . 7 HIS ND1 1 1 6 4095 2 1 7 HIS NE2 N -4.767 -10.963 5.573 1.00 . B B . 7 HIS NE2 1 1 6 4096 2 1 7 HIS O O -6.782 -4.725 5.107 1.00 . B B . 7 HIS O 1 1 6 4097 2 1 8 SER C C -3.909 -2.370 3.356 1.00 . B B . 8 SER C 1 1 6 4098 2 1 8 SER CA C -4.834 -3.066 4.346 1.00 . B B . 8 SER CA 1 1 6 4099 2 1 8 SER CB C -4.349 -2.798 5.772 1.00 . B B . 8 SER CB 1 1 6 4100 2 1 8 SER H H -4.110 -4.956 3.605 1.00 . B B . 8 SER H 1 1 6 4101 2 1 8 SER HA H -5.830 -2.678 4.226 1.00 . B B . 8 SER HA 1 1 6 4102 2 1 8 SER HB2 H -4.972 -3.330 6.472 1.00 . B B . 8 SER HB2 1 1 6 4103 2 1 8 SER HB3 H -3.327 -3.138 5.872 1.00 . B B . 8 SER HB3 1 1 6 4104 2 1 8 SER HG H -5.342 -1.191 6.241 1.00 . B B . 8 SER HG 1 1 6 4105 2 1 8 SER N N -4.849 -4.530 4.089 1.00 . B B . 8 SER N 1 1 6 4106 2 1 8 SER O O -4.188 -1.280 2.896 1.00 . B B . 8 SER O 1 1 6 4107 2 1 8 SER OG O -4.427 -1.404 6.041 1.00 . B B . 8 SER OG 1 1 6 4108 2 1 9 ALA C C -2.572 -2.242 0.695 1.00 . B B . 9 ALA C 1 1 6 4109 2 1 9 ALA CA C -1.892 -2.332 2.052 1.00 . B B . 9 ALA CA 1 1 6 4110 2 1 9 ALA CB C -0.623 -3.158 1.914 1.00 . B B . 9 ALA CB 1 1 6 4111 2 1 9 ALA H H -2.604 -3.860 3.393 1.00 . B B . 9 ALA H 1 1 6 4112 2 1 9 ALA HA H -1.643 -1.340 2.399 1.00 . B B . 9 ALA HA 1 1 6 4113 2 1 9 ALA HB1 H -0.873 -4.164 1.590 1.00 . B B . 9 ALA HB1 1 1 6 4114 2 1 9 ALA HB2 H -0.113 -3.197 2.864 1.00 . B B . 9 ALA HB2 1 1 6 4115 2 1 9 ALA HB3 H 0.016 -2.693 1.182 1.00 . B B . 9 ALA HB3 1 1 6 4116 2 1 9 ALA N N -2.815 -2.980 3.018 1.00 . B B . 9 ALA N 1 1 6 4117 2 1 9 ALA O O -2.844 -1.168 0.197 1.00 . B B . 9 ALA O 1 1 6 4118 2 1 10 LYS C C -4.566 -2.261 -1.288 1.00 . B B . 10 LYS C 1 1 6 4119 2 1 10 LYS CA C -3.511 -3.368 -1.241 1.00 . B B . 10 LYS CA 1 1 6 4120 2 1 10 LYS CB C -4.191 -4.713 -1.485 1.00 . B B . 10 LYS CB 1 1 6 4121 2 1 10 LYS CD C -4.819 -5.888 -3.605 1.00 . B B . 10 LYS CD 1 1 6 4122 2 1 10 LYS CE C -5.893 -4.813 -3.788 1.00 . B B . 10 LYS CE 1 1 6 4123 2 1 10 LYS CG C -3.659 -5.323 -2.784 1.00 . B B . 10 LYS CG 1 1 6 4124 2 1 10 LYS H H -2.602 -4.221 0.528 1.00 . B B . 10 LYS H 1 1 6 4125 2 1 10 LYS HA H -2.774 -3.193 -2.012 1.00 . B B . 10 LYS HA 1 1 6 4126 2 1 10 LYS HB2 H -3.982 -5.377 -0.660 1.00 . B B . 10 LYS HB2 1 1 6 4127 2 1 10 LYS HB3 H -5.256 -4.562 -1.569 1.00 . B B . 10 LYS HB3 1 1 6 4128 2 1 10 LYS HD2 H -4.456 -6.202 -4.573 1.00 . B B . 10 LYS HD2 1 1 6 4129 2 1 10 LYS HD3 H -5.247 -6.735 -3.090 1.00 . B B . 10 LYS HD3 1 1 6 4130 2 1 10 LYS HE2 H -5.575 -3.901 -3.303 1.00 . B B . 10 LYS HE2 1 1 6 4131 2 1 10 LYS HE3 H -6.041 -4.627 -4.841 1.00 . B B . 10 LYS HE3 1 1 6 4132 2 1 10 LYS HG2 H -3.151 -4.560 -3.356 1.00 . B B . 10 LYS HG2 1 1 6 4133 2 1 10 LYS HG3 H -2.967 -6.116 -2.551 1.00 . B B . 10 LYS HG3 1 1 6 4134 2 1 10 LYS HZ1 H -7.010 -6.183 -2.689 1.00 . B B . 10 LYS HZ1 1 1 6 4135 2 1 10 LYS HZ2 H -7.881 -5.413 -3.928 1.00 . B B . 10 LYS HZ2 1 1 6 4136 2 1 10 LYS HZ3 H -7.509 -4.573 -2.499 1.00 . B B . 10 LYS HZ3 1 1 6 4137 2 1 10 LYS N N -2.844 -3.369 0.095 1.00 . B B . 10 LYS N 1 1 6 4138 2 1 10 LYS NZ N -7.170 -5.281 -3.180 1.00 . B B . 10 LYS NZ 1 1 6 4139 2 1 10 LYS O O -4.620 -1.486 -2.222 1.00 . B B . 10 LYS O 1 1 6 4140 2 1 11 LYS C C -5.762 0.210 -0.676 1.00 . B B . 11 LYS C 1 1 6 4141 2 1 11 LYS CA C -6.431 -1.102 -0.279 1.00 . B B . 11 LYS CA 1 1 6 4142 2 1 11 LYS CB C -7.035 -0.972 1.121 1.00 . B B . 11 LYS CB 1 1 6 4143 2 1 11 LYS CD C -7.782 -3.354 1.206 1.00 . B B . 11 LYS CD 1 1 6 4144 2 1 11 LYS CE C -8.997 -4.274 1.084 1.00 . B B . 11 LYS CE 1 1 6 4145 2 1 11 LYS CG C -8.248 -1.896 1.241 1.00 . B B . 11 LYS CG 1 1 6 4146 2 1 11 LYS H H -5.334 -2.800 0.467 1.00 . B B . 11 LYS H 1 1 6 4147 2 1 11 LYS HA H -7.207 -1.344 -0.991 1.00 . B B . 11 LYS HA 1 1 6 4148 2 1 11 LYS HB2 H -6.296 -1.247 1.859 1.00 . B B . 11 LYS HB2 1 1 6 4149 2 1 11 LYS HB3 H -7.346 0.049 1.286 1.00 . B B . 11 LYS HB3 1 1 6 4150 2 1 11 LYS HD2 H -7.128 -3.502 0.359 1.00 . B B . 11 LYS HD2 1 1 6 4151 2 1 11 LYS HD3 H -7.249 -3.584 2.117 1.00 . B B . 11 LYS HD3 1 1 6 4152 2 1 11 LYS HE2 H -9.503 -4.080 0.149 1.00 . B B . 11 LYS HE2 1 1 6 4153 2 1 11 LYS HE3 H -8.672 -5.304 1.110 1.00 . B B . 11 LYS HE3 1 1 6 4154 2 1 11 LYS HG2 H -8.757 -1.703 2.174 1.00 . B B . 11 LYS HG2 1 1 6 4155 2 1 11 LYS HG3 H -8.922 -1.717 0.417 1.00 . B B . 11 LYS HG3 1 1 6 4156 2 1 11 LYS HZ1 H -10.560 -3.227 1.975 1.00 . B B . 11 LYS HZ1 1 1 6 4157 2 1 11 LYS HZ2 H -9.384 -3.781 3.068 1.00 . B B . 11 LYS HZ2 1 1 6 4158 2 1 11 LYS HZ3 H -10.501 -4.869 2.394 1.00 . B B . 11 LYS HZ3 1 1 6 4159 2 1 11 LYS N N -5.397 -2.172 -0.284 1.00 . B B . 11 LYS N 1 1 6 4160 2 1 11 LYS NZ N -9.931 -4.018 2.216 1.00 . B B . 11 LYS NZ 1 1 6 4161 2 1 11 LYS O O -5.998 0.740 -1.742 1.00 . B B . 11 LYS O 1 1 6 4162 2 1 12 PHE C C -3.327 1.715 -1.412 1.00 . B B . 12 PHE C 1 1 6 4163 2 1 12 PHE CA C -4.202 1.984 -0.191 1.00 . B B . 12 PHE CA 1 1 6 4164 2 1 12 PHE CB C -3.326 2.431 0.981 1.00 . B B . 12 PHE CB 1 1 6 4165 2 1 12 PHE CD1 C -5.332 2.610 2.497 1.00 . B B . 12 PHE CD1 1 1 6 4166 2 1 12 PHE CD2 C -3.389 1.381 3.269 1.00 . B B . 12 PHE CD2 1 1 6 4167 2 1 12 PHE CE1 C -5.986 2.334 3.705 1.00 . B B . 12 PHE CE1 1 1 6 4168 2 1 12 PHE CE2 C -4.043 1.104 4.475 1.00 . B B . 12 PHE CE2 1 1 6 4169 2 1 12 PHE CG C -4.033 2.134 2.280 1.00 . B B . 12 PHE CG 1 1 6 4170 2 1 12 PHE CZ C -5.341 1.581 4.693 1.00 . B B . 12 PHE CZ 1 1 6 4171 2 1 12 PHE H H -4.712 0.276 1.009 1.00 . B B . 12 PHE H 1 1 6 4172 2 1 12 PHE HA H -4.925 2.753 -0.422 1.00 . B B . 12 PHE HA 1 1 6 4173 2 1 12 PHE HB2 H -2.387 1.895 0.951 1.00 . B B . 12 PHE HB2 1 1 6 4174 2 1 12 PHE HB3 H -3.141 3.493 0.907 1.00 . B B . 12 PHE HB3 1 1 6 4175 2 1 12 PHE HD1 H -5.829 3.191 1.735 1.00 . B B . 12 PHE HD1 1 1 6 4176 2 1 12 PHE HD2 H -2.387 1.013 3.100 1.00 . B B . 12 PHE HD2 1 1 6 4177 2 1 12 PHE HE1 H -6.988 2.700 3.873 1.00 . B B . 12 PHE HE1 1 1 6 4178 2 1 12 PHE HE2 H -3.545 0.523 5.238 1.00 . B B . 12 PHE HE2 1 1 6 4179 2 1 12 PHE HZ H -5.845 1.367 5.624 1.00 . B B . 12 PHE HZ 1 1 6 4180 2 1 12 PHE N N -4.905 0.726 0.162 1.00 . B B . 12 PHE N 1 1 6 4181 2 1 12 PHE O O -3.080 2.586 -2.217 1.00 . B B . 12 PHE O 1 1 6 4182 2 1 13 GLY C C -2.627 0.797 -3.986 1.00 . B B . 13 GLY C 1 1 6 4183 2 1 13 GLY CA C -2.006 0.179 -2.735 1.00 . B B . 13 GLY CA 1 1 6 4184 2 1 13 GLY H H -3.074 -0.187 -0.900 1.00 . B B . 13 GLY H 1 1 6 4185 2 1 13 GLY HA2 H -1.013 0.580 -2.584 1.00 . B B . 13 GLY HA2 1 1 6 4186 2 1 13 GLY HA3 H -1.949 -0.892 -2.855 1.00 . B B . 13 GLY HA3 1 1 6 4187 2 1 13 GLY N N -2.858 0.506 -1.559 1.00 . B B . 13 GLY N 1 1 6 4188 2 1 13 GLY O O -1.937 1.261 -4.871 1.00 . B B . 13 GLY O 1 1 6 4189 2 1 14 LYS C C -4.884 2.882 -5.024 1.00 . B B . 14 LYS C 1 1 6 4190 2 1 14 LYS CA C -4.599 1.393 -5.259 1.00 . B B . 14 LYS CA 1 1 6 4191 2 1 14 LYS CB C -5.918 0.662 -5.515 1.00 . B B . 14 LYS CB 1 1 6 4192 2 1 14 LYS CD C -6.792 -0.812 -7.336 1.00 . B B . 14 LYS CD 1 1 6 4193 2 1 14 LYS CE C -6.291 -1.653 -8.511 1.00 . B B . 14 LYS CE 1 1 6 4194 2 1 14 LYS CG C -5.654 -0.604 -6.334 1.00 . B B . 14 LYS CG 1 1 6 4195 2 1 14 LYS H H -4.469 0.420 -3.337 1.00 . B B . 14 LYS H 1 1 6 4196 2 1 14 LYS HA H -3.955 1.285 -6.118 1.00 . B B . 14 LYS HA 1 1 6 4197 2 1 14 LYS HB2 H -6.369 0.391 -4.571 1.00 . B B . 14 LYS HB2 1 1 6 4198 2 1 14 LYS HB3 H -6.589 1.308 -6.061 1.00 . B B . 14 LYS HB3 1 1 6 4199 2 1 14 LYS HD2 H -7.609 -1.325 -6.849 1.00 . B B . 14 LYS HD2 1 1 6 4200 2 1 14 LYS HD3 H -7.132 0.145 -7.700 1.00 . B B . 14 LYS HD3 1 1 6 4201 2 1 14 LYS HE2 H -5.212 -1.685 -8.496 1.00 . B B . 14 LYS HE2 1 1 6 4202 2 1 14 LYS HE3 H -6.681 -2.656 -8.429 1.00 . B B . 14 LYS HE3 1 1 6 4203 2 1 14 LYS HG2 H -4.719 -0.498 -6.867 1.00 . B B . 14 LYS HG2 1 1 6 4204 2 1 14 LYS HG3 H -5.598 -1.455 -5.674 1.00 . B B . 14 LYS HG3 1 1 6 4205 2 1 14 LYS HZ1 H -5.930 -0.802 -10.377 1.00 . B B . 14 LYS HZ1 1 1 6 4206 2 1 14 LYS HZ2 H -7.300 -0.182 -9.586 1.00 . B B . 14 LYS HZ2 1 1 6 4207 2 1 14 LYS HZ3 H -7.352 -1.722 -10.301 1.00 . B B . 14 LYS HZ3 1 1 6 4208 2 1 14 LYS N N -3.930 0.805 -4.065 1.00 . B B . 14 LYS N 1 1 6 4209 2 1 14 LYS NZ N -6.753 -1.044 -9.790 1.00 . B B . 14 LYS NZ 1 1 6 4210 2 1 14 LYS O O -4.915 3.667 -5.950 1.00 . B B . 14 LYS O 1 1 6 4211 2 1 15 ALA C C -4.093 5.475 -3.259 1.00 . B B . 15 ALA C 1 1 6 4212 2 1 15 ALA CA C -5.396 4.715 -3.522 1.00 . B B . 15 ALA CA 1 1 6 4213 2 1 15 ALA CB C -6.299 4.823 -2.290 1.00 . B B . 15 ALA CB 1 1 6 4214 2 1 15 ALA H H -5.081 2.630 -3.062 1.00 . B B . 15 ALA H 1 1 6 4215 2 1 15 ALA HA H -5.897 5.149 -4.373 1.00 . B B . 15 ALA HA 1 1 6 4216 2 1 15 ALA HB1 H -7.282 5.155 -2.594 1.00 . B B . 15 ALA HB1 1 1 6 4217 2 1 15 ALA HB2 H -5.878 5.536 -1.597 1.00 . B B . 15 ALA HB2 1 1 6 4218 2 1 15 ALA HB3 H -6.376 3.858 -1.813 1.00 . B B . 15 ALA HB3 1 1 6 4219 2 1 15 ALA N N -5.102 3.277 -3.798 1.00 . B B . 15 ALA N 1 1 6 4220 2 1 15 ALA O O -3.858 6.532 -3.811 1.00 . B B . 15 ALA O 1 1 6 4221 2 1 16 TRP C C -1.138 5.750 -3.400 1.00 . B B . 16 TRP C 1 1 6 4222 2 1 16 TRP CA C -1.967 5.637 -2.118 1.00 . B B . 16 TRP CA 1 1 6 4223 2 1 16 TRP CB C -1.212 4.849 -1.028 1.00 . B B . 16 TRP CB 1 1 6 4224 2 1 16 TRP CD1 C -0.279 2.552 -1.554 1.00 . B B . 16 TRP CD1 1 1 6 4225 2 1 16 TRP CD2 C 0.962 4.211 -2.399 1.00 . B B . 16 TRP CD2 1 1 6 4226 2 1 16 TRP CE2 C 1.588 3.008 -2.790 1.00 . B B . 16 TRP CE2 1 1 6 4227 2 1 16 TRP CE3 C 1.536 5.419 -2.791 1.00 . B B . 16 TRP CE3 1 1 6 4228 2 1 16 TRP CG C -0.226 3.898 -1.637 1.00 . B B . 16 TRP CG 1 1 6 4229 2 1 16 TRP CH2 C 3.318 4.231 -3.940 1.00 . B B . 16 TRP CH2 1 1 6 4230 2 1 16 TRP CZ2 C 2.757 3.010 -3.555 1.00 . B B . 16 TRP CZ2 1 1 6 4231 2 1 16 TRP CZ3 C 2.707 5.433 -3.557 1.00 . B B . 16 TRP CZ3 1 1 6 4232 2 1 16 TRP H H -3.455 4.097 -1.986 1.00 . B B . 16 TRP H 1 1 6 4233 2 1 16 TRP HA H -2.177 6.629 -1.753 1.00 . B B . 16 TRP HA 1 1 6 4234 2 1 16 TRP HB2 H -0.685 5.541 -0.390 1.00 . B B . 16 TRP HB2 1 1 6 4235 2 1 16 TRP HB3 H -1.924 4.293 -0.438 1.00 . B B . 16 TRP HB3 1 1 6 4236 2 1 16 TRP HD1 H -1.037 1.987 -1.036 1.00 . B B . 16 TRP HD1 1 1 6 4237 2 1 16 TRP HE1 H 0.980 1.064 -2.356 1.00 . B B . 16 TRP HE1 1 1 6 4238 2 1 16 TRP HE3 H 1.070 6.349 -2.490 1.00 . B B . 16 TRP HE3 1 1 6 4239 2 1 16 TRP HH2 H 4.220 4.252 -4.537 1.00 . B B . 16 TRP HH2 1 1 6 4240 2 1 16 TRP HZ2 H 3.220 2.079 -3.847 1.00 . B B . 16 TRP HZ2 1 1 6 4241 2 1 16 TRP HZ3 H 3.135 6.370 -3.851 1.00 . B B . 16 TRP HZ3 1 1 6 4242 2 1 16 TRP N N -3.247 4.948 -2.420 1.00 . B B . 16 TRP N 1 1 6 4243 2 1 16 TRP NE1 N 0.792 2.019 -2.249 1.00 . B B . 16 TRP NE1 1 1 6 4244 2 1 16 TRP O O -0.567 6.778 -3.694 1.00 . B B . 16 TRP O 1 1 6 4245 2 1 17 VAL C C -0.936 5.760 -6.372 1.00 . B B . 17 VAL C 1 1 6 4246 2 1 17 VAL CA C -0.249 4.786 -5.412 1.00 . B B . 17 VAL CA 1 1 6 4247 2 1 17 VAL CB C -0.102 3.384 -6.031 1.00 . B B . 17 VAL CB 1 1 6 4248 2 1 17 VAL CG1 C -1.120 3.169 -7.159 1.00 . B B . 17 VAL CG1 1 1 6 4249 2 1 17 VAL CG2 C 1.315 3.230 -6.586 1.00 . B B . 17 VAL CG2 1 1 6 4250 2 1 17 VAL H H -1.508 3.869 -3.924 1.00 . B B . 17 VAL H 1 1 6 4251 2 1 17 VAL HA H 0.729 5.179 -5.164 1.00 . B B . 17 VAL HA 1 1 6 4252 2 1 17 VAL HB H -0.266 2.640 -5.264 1.00 . B B . 17 VAL HB 1 1 6 4253 2 1 17 VAL HG11 H -1.000 3.942 -7.904 1.00 . B B . 17 VAL HG11 1 1 6 4254 2 1 17 VAL HG12 H -2.120 3.213 -6.754 1.00 . B B . 17 VAL HG12 1 1 6 4255 2 1 17 VAL HG13 H -0.957 2.204 -7.613 1.00 . B B . 17 VAL HG13 1 1 6 4256 2 1 17 VAL HG21 H 1.578 2.183 -6.618 1.00 . B B . 17 VAL HG21 1 1 6 4257 2 1 17 VAL HG22 H 2.009 3.757 -5.947 1.00 . B B . 17 VAL HG22 1 1 6 4258 2 1 17 VAL HG23 H 1.358 3.643 -7.583 1.00 . B B . 17 VAL HG23 1 1 6 4259 2 1 17 VAL N N -1.052 4.702 -4.167 1.00 . B B . 17 VAL N 1 1 6 4260 2 1 17 VAL O O -0.324 6.673 -6.886 1.00 . B B . 17 VAL O 1 1 6 4261 2 1 18 GLY C C -2.729 7.967 -6.920 1.00 . B B . 18 GLY C 1 1 6 4262 2 1 18 GLY CA C -2.928 6.556 -7.477 1.00 . B B . 18 GLY CA 1 1 6 4263 2 1 18 GLY H H -2.704 4.882 -6.137 1.00 . B B . 18 GLY H 1 1 6 4264 2 1 18 GLY HA2 H -2.521 6.494 -8.476 1.00 . B B . 18 GLY HA2 1 1 6 4265 2 1 18 GLY HA3 H -3.981 6.322 -7.495 1.00 . B B . 18 GLY HA3 1 1 6 4266 2 1 18 GLY N N -2.214 5.603 -6.584 1.00 . B B . 18 GLY N 1 1 6 4267 2 1 18 GLY O O -2.955 8.954 -7.592 1.00 . B B . 18 GLY O 1 1 6 4268 2 1 19 GLU C C -0.638 9.812 -5.420 1.00 . B B . 19 GLU C 1 1 6 4269 2 1 19 GLU CA C -2.054 9.377 -5.070 1.00 . B B . 19 GLU CA 1 1 6 4270 2 1 19 GLU CB C -2.202 9.230 -3.547 1.00 . B B . 19 GLU CB 1 1 6 4271 2 1 19 GLU CD C -1.535 11.637 -3.480 1.00 . B B . 19 GLU CD 1 1 6 4272 2 1 19 GLU CG C -1.349 10.269 -2.823 1.00 . B B . 19 GLU CG 1 1 6 4273 2 1 19 GLU H H -2.109 7.258 -5.174 1.00 . B B . 19 GLU H 1 1 6 4274 2 1 19 GLU HA H -2.764 10.097 -5.444 1.00 . B B . 19 GLU HA 1 1 6 4275 2 1 19 GLU HB2 H -3.238 9.359 -3.272 1.00 . B B . 19 GLU HB2 1 1 6 4276 2 1 19 GLU HB3 H -1.872 8.241 -3.256 1.00 . B B . 19 GLU HB3 1 1 6 4277 2 1 19 GLU HG2 H -1.648 10.318 -1.787 1.00 . B B . 19 GLU HG2 1 1 6 4278 2 1 19 GLU HG3 H -0.311 9.977 -2.886 1.00 . B B . 19 GLU HG3 1 1 6 4279 2 1 19 GLU N N -2.294 8.061 -5.691 1.00 . B B . 19 GLU N 1 1 6 4280 2 1 19 GLU O O -0.427 10.702 -6.220 1.00 . B B . 19 GLU O 1 1 6 4281 2 1 19 GLU OE1 O -2.671 12.071 -3.591 1.00 . B B . 19 GLU OE1 1 1 6 4282 2 1 19 GLU OE2 O -0.539 12.231 -3.861 1.00 . B B . 19 GLU OE2 1 1 6 4283 2 1 20 ILE C C 2.095 9.138 -6.550 1.00 . B B . 20 ILE C 1 1 6 4284 2 1 20 ILE CA C 1.735 9.570 -5.130 1.00 . B B . 20 ILE CA 1 1 6 4285 2 1 20 ILE CB C 2.675 8.878 -4.157 1.00 . B B . 20 ILE CB 1 1 6 4286 2 1 20 ILE CD1 C 3.133 8.491 -1.741 1.00 . B B . 20 ILE CD1 1 1 6 4287 2 1 20 ILE CG1 C 2.473 9.433 -2.749 1.00 . B B . 20 ILE CG1 1 1 6 4288 2 1 20 ILE CG2 C 4.124 9.104 -4.593 1.00 . B B . 20 ILE CG2 1 1 6 4289 2 1 20 ILE H H 0.148 8.467 -4.174 1.00 . B B . 20 ILE H 1 1 6 4290 2 1 20 ILE HA H 1.835 10.633 -5.036 1.00 . B B . 20 ILE HA 1 1 6 4291 2 1 20 ILE HB H 2.459 7.828 -4.161 1.00 . B B . 20 ILE HB 1 1 6 4292 2 1 20 ILE HD11 H 3.606 7.677 -2.268 1.00 . B B . 20 ILE HD11 1 1 6 4293 2 1 20 ILE HD12 H 2.383 8.096 -1.071 1.00 . B B . 20 ILE HD12 1 1 6 4294 2 1 20 ILE HD13 H 3.875 9.033 -1.175 1.00 . B B . 20 ILE HD13 1 1 6 4295 2 1 20 ILE HG12 H 2.923 10.414 -2.678 1.00 . B B . 20 ILE HG12 1 1 6 4296 2 1 20 ILE HG13 H 1.418 9.500 -2.537 1.00 . B B . 20 ILE HG13 1 1 6 4297 2 1 20 ILE HG21 H 4.433 8.301 -5.245 1.00 . B B . 20 ILE HG21 1 1 6 4298 2 1 20 ILE HG22 H 4.763 9.129 -3.723 1.00 . B B . 20 ILE HG22 1 1 6 4299 2 1 20 ILE HG23 H 4.198 10.044 -5.122 1.00 . B B . 20 ILE HG23 1 1 6 4300 2 1 20 ILE N N 0.337 9.187 -4.825 1.00 . B B . 20 ILE N 1 1 6 4301 2 1 20 ILE O O 2.642 9.898 -7.324 1.00 . B B . 20 ILE O 1 1 6 4302 2 1 21 MET C C 1.518 8.356 -9.305 1.00 . B B . 21 MET C 1 1 6 4303 2 1 21 MET CA C 2.137 7.426 -8.257 1.00 . B B . 21 MET CA 1 1 6 4304 2 1 21 MET CB C 1.592 6.009 -8.441 1.00 . B B . 21 MET CB 1 1 6 4305 2 1 21 MET CE C 2.299 4.797 -11.815 1.00 . B B . 21 MET CE 1 1 6 4306 2 1 21 MET CG C 2.643 5.148 -9.144 1.00 . B B . 21 MET CG 1 1 6 4307 2 1 21 MET H H 1.364 7.317 -6.251 1.00 . B B . 21 MET H 1 1 6 4308 2 1 21 MET HA H 3.210 7.412 -8.374 1.00 . B B . 21 MET HA 1 1 6 4309 2 1 21 MET HB2 H 1.366 5.584 -7.472 1.00 . B B . 21 MET HB2 1 1 6 4310 2 1 21 MET HB3 H 0.695 6.043 -9.041 1.00 . B B . 21 MET HB3 1 1 6 4311 2 1 21 MET HE1 H 1.562 4.228 -11.264 1.00 . B B . 21 MET HE1 1 1 6 4312 2 1 21 MET HE2 H 3.020 4.123 -12.248 1.00 . B B . 21 MET HE2 1 1 6 4313 2 1 21 MET HE3 H 1.813 5.355 -12.604 1.00 . B B . 21 MET HE3 1 1 6 4314 2 1 21 MET HG2 H 3.507 5.042 -8.503 1.00 . B B . 21 MET HG2 1 1 6 4315 2 1 21 MET HG3 H 2.226 4.173 -9.356 1.00 . B B . 21 MET HG3 1 1 6 4316 2 1 21 MET N N 1.800 7.916 -6.893 1.00 . B B . 21 MET N 1 1 6 4317 2 1 21 MET O O 1.985 8.444 -10.423 1.00 . B B . 21 MET O 1 1 6 4318 2 1 21 MET SD S 3.136 5.944 -10.693 1.00 . B B . 21 MET SD 1 1 6 4319 2 1 22 ASN C C 0.571 11.313 -9.942 1.00 . B B . 22 ASN C 1 1 6 4320 2 1 22 ASN CA C -0.173 9.975 -9.934 1.00 . B B . 22 ASN CA 1 1 6 4321 2 1 22 ASN CB C -1.633 10.206 -9.540 1.00 . B B . 22 ASN CB 1 1 6 4322 2 1 22 ASN CG C -2.310 11.104 -10.576 1.00 . B B . 22 ASN CG 1 1 6 4323 2 1 22 ASN H H 0.104 8.971 -8.047 1.00 . B B . 22 ASN H 1 1 6 4324 2 1 22 ASN HA H -0.133 9.536 -10.921 1.00 . B B . 22 ASN HA 1 1 6 4325 2 1 22 ASN HB2 H -2.147 9.256 -9.498 1.00 . B B . 22 ASN HB2 1 1 6 4326 2 1 22 ASN HB3 H -1.673 10.683 -8.570 1.00 . B B . 22 ASN HB3 1 1 6 4327 2 1 22 ASN HD21 H -3.898 11.461 -9.433 1.00 . B B . 22 ASN HD21 1 1 6 4328 2 1 22 ASN HD22 H -3.912 12.215 -10.963 1.00 . B B . 22 ASN HD22 1 1 6 4329 2 1 22 ASN N N 0.469 9.053 -8.953 1.00 . B B . 22 ASN N 1 1 6 4330 2 1 22 ASN ND2 N -3.469 11.638 -10.302 1.00 . B B . 22 ASN ND2 1 1 6 4331 2 1 22 ASN O O 0.641 11.988 -10.949 1.00 . B B . 22 ASN O 1 1 6 4332 2 1 22 ASN OD1 O -1.779 11.324 -11.647 1.00 . B B . 22 ASN OD1 1 1 6 4333 2 1 23 SER C C 3.313 12.774 -9.223 1.00 . B B . 23 SER C 1 1 6 4334 2 1 23 SER CA C 1.867 12.996 -8.776 1.00 . B B . 23 SER CA 1 1 6 4335 2 1 23 SER CB C 1.852 13.534 -7.344 1.00 . B B . 23 SER CB 1 1 6 4336 2 1 23 SER H H 1.061 11.142 -8.025 1.00 . B B . 23 SER H 1 1 6 4337 2 1 23 SER HA H 1.392 13.707 -9.435 1.00 . B B . 23 SER HA 1 1 6 4338 2 1 23 SER HB2 H 0.853 13.838 -7.082 1.00 . B B . 23 SER HB2 1 1 6 4339 2 1 23 SER HB3 H 2.181 12.757 -6.665 1.00 . B B . 23 SER HB3 1 1 6 4340 2 1 23 SER HG H 3.621 14.331 -7.181 1.00 . B B . 23 SER HG 1 1 6 4341 2 1 23 SER N N 1.129 11.701 -8.827 1.00 . B B . 23 SER N 1 1 6 4342 2 1 23 SER O O 4.120 12.400 -8.388 1.00 . B B . 23 SER O 1 1 6 4343 2 1 23 SER OXT O 3.587 12.981 -10.394 1.00 . B B . 23 SER OXT 1 1 6 4344 2 1 23 SER OG O 2.721 14.657 -7.256 1.00 . B B . 23 SER OG 1 1 7 4345 1 1 1 GLY C C -6.434 13.689 2.176 1.00 . A A . 1 GLY C 1 1 7 4346 1 1 1 GLY CA C -7.268 14.941 1.899 1.00 . A A . 1 GLY CA 1 1 7 4347 1 1 1 GLY H1 H -9.022 15.699 2.730 1.00 . A A . 1 GLY H1 1 1 7 4348 1 1 1 GLY H2 H -8.576 14.172 3.327 1.00 . A A . 1 GLY H2 1 1 7 4349 1 1 1 GLY H3 H -9.251 14.317 1.774 1.00 . A A . 1 GLY H3 1 1 7 4350 1 1 1 GLY HA2 H -7.345 15.096 0.832 1.00 . A A . 1 GLY HA2 1 1 7 4351 1 1 1 GLY HA3 H -6.790 15.795 2.354 1.00 . A A . 1 GLY HA3 1 1 7 4352 1 1 1 GLY N N -8.632 14.769 2.476 1.00 . A A . 1 GLY N 1 1 7 4353 1 1 1 GLY O O -6.822 12.830 2.943 1.00 . A A . 1 GLY O 1 1 7 4354 1 1 2 ILE C C -3.669 12.551 3.102 1.00 . A A . 2 ILE C 1 1 7 4355 1 1 2 ILE CA C -4.433 12.382 1.787 1.00 . A A . 2 ILE CA 1 1 7 4356 1 1 2 ILE CB C -3.441 12.236 0.630 1.00 . A A . 2 ILE CB 1 1 7 4357 1 1 2 ILE CD1 C -1.657 13.455 -0.636 1.00 . A A . 2 ILE CD1 1 1 7 4358 1 1 2 ILE CG1 C -2.421 13.377 0.688 1.00 . A A . 2 ILE CG1 1 1 7 4359 1 1 2 ILE CG2 C -4.200 12.291 -0.698 1.00 . A A . 2 ILE CG2 1 1 7 4360 1 1 2 ILE H H -4.995 14.282 0.944 1.00 . A A . 2 ILE H 1 1 7 4361 1 1 2 ILE HA H -5.054 11.500 1.842 1.00 . A A . 2 ILE HA 1 1 7 4362 1 1 2 ILE HB H -2.930 11.288 0.713 1.00 . A A . 2 ILE HB 1 1 7 4363 1 1 2 ILE HD11 H -1.679 12.491 -1.122 1.00 . A A . 2 ILE HD11 1 1 7 4364 1 1 2 ILE HD12 H -0.632 13.739 -0.445 1.00 . A A . 2 ILE HD12 1 1 7 4365 1 1 2 ILE HD13 H -2.121 14.191 -1.276 1.00 . A A . 2 ILE HD13 1 1 7 4366 1 1 2 ILE HG12 H -2.936 14.312 0.862 1.00 . A A . 2 ILE HG12 1 1 7 4367 1 1 2 ILE HG13 H -1.722 13.195 1.492 1.00 . A A . 2 ILE HG13 1 1 7 4368 1 1 2 ILE HG21 H -5.174 11.841 -0.576 1.00 . A A . 2 ILE HG21 1 1 7 4369 1 1 2 ILE HG22 H -3.646 11.750 -1.452 1.00 . A A . 2 ILE HG22 1 1 7 4370 1 1 2 ILE HG23 H -4.315 13.321 -1.006 1.00 . A A . 2 ILE HG23 1 1 7 4371 1 1 2 ILE N N -5.290 13.578 1.558 1.00 . A A . 2 ILE N 1 1 7 4372 1 1 2 ILE O O -2.842 13.429 3.244 1.00 . A A . 2 ILE O 1 1 7 4373 1 1 3 GLY C C -2.848 10.426 5.860 1.00 . A A . 3 GLY C 1 1 7 4374 1 1 3 GLY CA C -3.222 11.823 5.368 1.00 . A A . 3 GLY CA 1 1 7 4375 1 1 3 GLY H H -4.603 11.009 3.929 1.00 . A A . 3 GLY H 1 1 7 4376 1 1 3 GLY HA2 H -2.324 12.409 5.235 1.00 . A A . 3 GLY HA2 1 1 7 4377 1 1 3 GLY HA3 H -3.863 12.299 6.093 1.00 . A A . 3 GLY HA3 1 1 7 4378 1 1 3 GLY N N -3.936 11.712 4.065 1.00 . A A . 3 GLY N 1 1 7 4379 1 1 3 GLY O O -2.444 10.237 6.990 1.00 . A A . 3 GLY O 1 1 7 4380 1 1 4 LYS C C -1.842 7.420 4.255 1.00 . A A . 4 LYS C 1 1 7 4381 1 1 4 LYS CA C -2.620 8.057 5.403 1.00 . A A . 4 LYS CA 1 1 7 4382 1 1 4 LYS CB C -3.892 7.249 5.676 1.00 . A A . 4 LYS CB 1 1 7 4383 1 1 4 LYS CD C -6.355 7.121 5.252 1.00 . A A . 4 LYS CD 1 1 7 4384 1 1 4 LYS CE C -6.708 7.500 6.692 1.00 . A A . 4 LYS CE 1 1 7 4385 1 1 4 LYS CG C -5.050 7.809 4.845 1.00 . A A . 4 LYS CG 1 1 7 4386 1 1 4 LYS H H -3.297 9.630 4.106 1.00 . A A . 4 LYS H 1 1 7 4387 1 1 4 LYS HA H -2.004 8.077 6.291 1.00 . A A . 4 LYS HA 1 1 7 4388 1 1 4 LYS HB2 H -3.724 6.215 5.408 1.00 . A A . 4 LYS HB2 1 1 7 4389 1 1 4 LYS HB3 H -4.139 7.314 6.724 1.00 . A A . 4 LYS HB3 1 1 7 4390 1 1 4 LYS HD2 H -7.149 7.437 4.591 1.00 . A A . 4 LYS HD2 1 1 7 4391 1 1 4 LYS HD3 H -6.233 6.051 5.184 1.00 . A A . 4 LYS HD3 1 1 7 4392 1 1 4 LYS HE2 H -7.025 6.618 7.228 1.00 . A A . 4 LYS HE2 1 1 7 4393 1 1 4 LYS HE3 H -5.840 7.923 7.176 1.00 . A A . 4 LYS HE3 1 1 7 4394 1 1 4 LYS HG2 H -5.133 8.873 5.017 1.00 . A A . 4 LYS HG2 1 1 7 4395 1 1 4 LYS HG3 H -4.861 7.628 3.797 1.00 . A A . 4 LYS HG3 1 1 7 4396 1 1 4 LYS HZ1 H -7.432 9.436 6.947 1.00 . A A . 4 LYS HZ1 1 1 7 4397 1 1 4 LYS HZ2 H -8.538 8.219 7.379 1.00 . A A . 4 LYS HZ2 1 1 7 4398 1 1 4 LYS HZ3 H -8.232 8.553 5.741 1.00 . A A . 4 LYS HZ3 1 1 7 4399 1 1 4 LYS N N -2.974 9.448 5.011 1.00 . A A . 4 LYS N 1 1 7 4400 1 1 4 LYS NZ N -7.811 8.503 6.689 1.00 . A A . 4 LYS NZ 1 1 7 4401 1 1 4 LYS O O -0.878 6.709 4.460 1.00 . A A . 4 LYS O 1 1 7 4402 1 1 5 TYR C C -0.143 7.725 1.794 1.00 . A A . 5 TYR C 1 1 7 4403 1 1 5 TYR CA C -1.539 7.119 1.878 1.00 . A A . 5 TYR CA 1 1 7 4404 1 1 5 TYR CB C -2.319 7.452 0.614 1.00 . A A . 5 TYR CB 1 1 7 4405 1 1 5 TYR CD1 C -4.273 5.860 0.635 1.00 . A A . 5 TYR CD1 1 1 7 4406 1 1 5 TYR CD2 C -4.654 8.182 1.222 1.00 . A A . 5 TYR CD2 1 1 7 4407 1 1 5 TYR CE1 C -5.632 5.587 0.833 1.00 . A A . 5 TYR CE1 1 1 7 4408 1 1 5 TYR CE2 C -6.013 7.910 1.420 1.00 . A A . 5 TYR CE2 1 1 7 4409 1 1 5 TYR CG C -3.784 7.157 0.830 1.00 . A A . 5 TYR CG 1 1 7 4410 1 1 5 TYR CZ C -6.502 6.612 1.226 1.00 . A A . 5 TYR CZ 1 1 7 4411 1 1 5 TYR H H -3.023 8.265 2.901 1.00 . A A . 5 TYR H 1 1 7 4412 1 1 5 TYR HA H -1.460 6.054 1.981 1.00 . A A . 5 TYR HA 1 1 7 4413 1 1 5 TYR HB2 H -2.190 8.499 0.375 1.00 . A A . 5 TYR HB2 1 1 7 4414 1 1 5 TYR HB3 H -1.948 6.850 -0.194 1.00 . A A . 5 TYR HB3 1 1 7 4415 1 1 5 TYR HD1 H -3.602 5.071 0.332 1.00 . A A . 5 TYR HD1 1 1 7 4416 1 1 5 TYR HD2 H -4.277 9.183 1.372 1.00 . A A . 5 TYR HD2 1 1 7 4417 1 1 5 TYR HE1 H -6.009 4.586 0.684 1.00 . A A . 5 TYR HE1 1 1 7 4418 1 1 5 TYR HE2 H -6.684 8.699 1.723 1.00 . A A . 5 TYR HE2 1 1 7 4419 1 1 5 TYR HH H -7.917 5.722 2.148 1.00 . A A . 5 TYR HH 1 1 7 4420 1 1 5 TYR N N -2.249 7.685 3.044 1.00 . A A . 5 TYR N 1 1 7 4421 1 1 5 TYR O O 0.752 7.169 1.190 1.00 . A A . 5 TYR O 1 1 7 4422 1 1 5 TYR OH O -7.842 6.344 1.420 1.00 . A A . 5 TYR OH 1 1 7 4423 1 1 6 LEU C C 2.077 9.401 3.695 1.00 . A A . 6 LEU C 1 1 7 4424 1 1 6 LEU CA C 1.391 9.508 2.334 1.00 . A A . 6 LEU CA 1 1 7 4425 1 1 6 LEU CB C 1.216 10.980 1.963 1.00 . A A . 6 LEU CB 1 1 7 4426 1 1 6 LEU CD1 C 2.477 11.061 -0.189 1.00 . A A . 6 LEU CD1 1 1 7 4427 1 1 6 LEU CD2 C 0.223 9.984 -0.116 1.00 . A A . 6 LEU CD2 1 1 7 4428 1 1 6 LEU CG C 1.087 11.122 0.444 1.00 . A A . 6 LEU CG 1 1 7 4429 1 1 6 LEU H H -0.684 9.310 2.870 1.00 . A A . 6 LEU H 1 1 7 4430 1 1 6 LEU HA H 1.992 9.014 1.585 1.00 . A A . 6 LEU HA 1 1 7 4431 1 1 6 LEU HB2 H 0.322 11.364 2.437 1.00 . A A . 6 LEU HB2 1 1 7 4432 1 1 6 LEU HB3 H 2.072 11.542 2.305 1.00 . A A . 6 LEU HB3 1 1 7 4433 1 1 6 LEU HD11 H 3.091 11.855 0.212 1.00 . A A . 6 LEU HD11 1 1 7 4434 1 1 6 LEU HD12 H 2.392 11.179 -1.258 1.00 . A A . 6 LEU HD12 1 1 7 4435 1 1 6 LEU HD13 H 2.933 10.107 0.034 1.00 . A A . 6 LEU HD13 1 1 7 4436 1 1 6 LEU HD21 H -0.728 9.970 0.394 1.00 . A A . 6 LEU HD21 1 1 7 4437 1 1 6 LEU HD22 H 0.728 9.041 0.039 1.00 . A A . 6 LEU HD22 1 1 7 4438 1 1 6 LEU HD23 H 0.064 10.138 -1.173 1.00 . A A . 6 LEU HD23 1 1 7 4439 1 1 6 LEU HG H 0.627 12.070 0.213 1.00 . A A . 6 LEU HG 1 1 7 4440 1 1 6 LEU N N 0.052 8.869 2.391 1.00 . A A . 6 LEU N 1 1 7 4441 1 1 6 LEU O O 3.169 9.898 3.890 1.00 . A A . 6 LEU O 1 1 7 4442 1 1 7 HIS C C 1.885 7.208 6.506 1.00 . A A . 7 HIS C 1 1 7 4443 1 1 7 HIS CA C 2.076 8.630 5.984 1.00 . A A . 7 HIS CA 1 1 7 4444 1 1 7 HIS CB C 1.423 9.623 6.947 1.00 . A A . 7 HIS CB 1 1 7 4445 1 1 7 HIS CD2 C 0.104 11.731 6.097 1.00 . A A . 7 HIS CD2 1 1 7 4446 1 1 7 HIS CE1 C 1.726 12.714 5.049 1.00 . A A . 7 HIS CE1 1 1 7 4447 1 1 7 HIS CG C 1.213 10.934 6.243 1.00 . A A . 7 HIS CG 1 1 7 4448 1 1 7 HIS H H 0.570 8.366 4.468 1.00 . A A . 7 HIS H 1 1 7 4449 1 1 7 HIS HA H 3.131 8.844 5.909 1.00 . A A . 7 HIS HA 1 1 7 4450 1 1 7 HIS HB2 H 0.471 9.232 7.276 1.00 . A A . 7 HIS HB2 1 1 7 4451 1 1 7 HIS HB3 H 2.066 9.771 7.802 1.00 . A A . 7 HIS HB3 1 1 7 4452 1 1 7 HIS HD1 H 3.161 11.272 5.483 1.00 . A A . 7 HIS HD1 1 1 7 4453 1 1 7 HIS HD2 H -0.872 11.518 6.503 1.00 . A A . 7 HIS HD2 1 1 7 4454 1 1 7 HIS HE1 H 2.295 13.423 4.466 1.00 . A A . 7 HIS HE1 1 1 7 4455 1 1 7 HIS N N 1.450 8.759 4.641 1.00 . A A . 7 HIS N 1 1 7 4456 1 1 7 HIS ND1 N 2.236 11.582 5.568 1.00 . A A . 7 HIS ND1 1 1 7 4457 1 1 7 HIS NE2 N 0.431 12.855 5.343 1.00 . A A . 7 HIS NE2 1 1 7 4458 1 1 7 HIS O O 2.019 6.948 7.685 1.00 . A A . 7 HIS O 1 1 7 4459 1 1 8 SER C C 1.294 3.945 4.904 1.00 . A A . 8 SER C 1 1 7 4460 1 1 8 SER CA C 1.387 4.882 6.104 1.00 . A A . 8 SER CA 1 1 7 4461 1 1 8 SER CB C 0.103 4.785 6.927 1.00 . A A . 8 SER CB 1 1 7 4462 1 1 8 SER H H 1.475 6.507 4.692 1.00 . A A . 8 SER H 1 1 7 4463 1 1 8 SER HA H 2.228 4.592 6.710 1.00 . A A . 8 SER HA 1 1 7 4464 1 1 8 SER HB2 H -0.015 5.679 7.517 1.00 . A A . 8 SER HB2 1 1 7 4465 1 1 8 SER HB3 H -0.742 4.681 6.261 1.00 . A A . 8 SER HB3 1 1 7 4466 1 1 8 SER HG H 0.902 3.815 8.412 1.00 . A A . 8 SER HG 1 1 7 4467 1 1 8 SER N N 1.577 6.282 5.641 1.00 . A A . 8 SER N 1 1 7 4468 1 1 8 SER O O 1.802 2.842 4.929 1.00 . A A . 8 SER O 1 1 7 4469 1 1 8 SER OG O 0.185 3.661 7.793 1.00 . A A . 8 SER OG 1 1 7 4470 1 1 9 ALA C C 1.955 3.193 2.139 1.00 . A A . 9 ALA C 1 1 7 4471 1 1 9 ALA CA C 0.555 3.482 2.662 1.00 . A A . 9 ALA CA 1 1 7 4472 1 1 9 ALA CB C -0.247 4.165 1.561 1.00 . A A . 9 ALA CB 1 1 7 4473 1 1 9 ALA H H 0.259 5.264 3.839 1.00 . A A . 9 ALA H 1 1 7 4474 1 1 9 ALA HA H 0.074 2.556 2.940 1.00 . A A . 9 ALA HA 1 1 7 4475 1 1 9 ALA HB1 H 0.162 5.150 1.361 1.00 . A A . 9 ALA HB1 1 1 7 4476 1 1 9 ALA HB2 H -1.277 4.253 1.866 1.00 . A A . 9 ALA HB2 1 1 7 4477 1 1 9 ALA HB3 H -0.189 3.567 0.670 1.00 . A A . 9 ALA HB3 1 1 7 4478 1 1 9 ALA N N 0.659 4.368 3.850 1.00 . A A . 9 ALA N 1 1 7 4479 1 1 9 ALA O O 2.423 2.074 2.186 1.00 . A A . 9 ALA O 1 1 7 4480 1 1 10 LYS C C 4.730 2.920 1.834 1.00 . A A . 10 LYS C 1 1 7 4481 1 1 10 LYS CA C 3.997 4.039 1.090 1.00 . A A . 10 LYS CA 1 1 7 4482 1 1 10 LYS CB C 4.776 5.343 1.259 1.00 . A A . 10 LYS CB 1 1 7 4483 1 1 10 LYS CD C 6.352 6.797 -0.026 1.00 . A A . 10 LYS CD 1 1 7 4484 1 1 10 LYS CE C 7.503 5.949 0.519 1.00 . A A . 10 LYS CE 1 1 7 4485 1 1 10 LYS CG C 5.085 5.943 -0.114 1.00 . A A . 10 LYS CG 1 1 7 4486 1 1 10 LYS H H 2.182 5.091 1.613 1.00 . A A . 10 LYS H 1 1 7 4487 1 1 10 LYS HA H 3.940 3.791 0.040 1.00 . A A . 10 LYS HA 1 1 7 4488 1 1 10 LYS HB2 H 4.187 6.041 1.835 1.00 . A A . 10 LYS HB2 1 1 7 4489 1 1 10 LYS HB3 H 5.701 5.141 1.778 1.00 . A A . 10 LYS HB3 1 1 7 4490 1 1 10 LYS HD2 H 6.608 7.165 -1.009 1.00 . A A . 10 LYS HD2 1 1 7 4491 1 1 10 LYS HD3 H 6.178 7.632 0.636 1.00 . A A . 10 LYS HD3 1 1 7 4492 1 1 10 LYS HE2 H 7.650 6.171 1.566 1.00 . A A . 10 LYS HE2 1 1 7 4493 1 1 10 LYS HE3 H 7.264 4.903 0.403 1.00 . A A . 10 LYS HE3 1 1 7 4494 1 1 10 LYS HG2 H 5.237 5.146 -0.828 1.00 . A A . 10 LYS HG2 1 1 7 4495 1 1 10 LYS HG3 H 4.259 6.560 -0.433 1.00 . A A . 10 LYS HG3 1 1 7 4496 1 1 10 LYS HZ1 H 9.465 6.639 0.419 1.00 . A A . 10 LYS HZ1 1 1 7 4497 1 1 10 LYS HZ2 H 8.546 6.962 -0.973 1.00 . A A . 10 LYS HZ2 1 1 7 4498 1 1 10 LYS HZ3 H 9.117 5.390 -0.674 1.00 . A A . 10 LYS HZ3 1 1 7 4499 1 1 10 LYS N N 2.611 4.207 1.636 1.00 . A A . 10 LYS N 1 1 7 4500 1 1 10 LYS NZ N 8.752 6.258 -0.234 1.00 . A A . 10 LYS NZ 1 1 7 4501 1 1 10 LYS O O 5.255 2.006 1.231 1.00 . A A . 10 LYS O 1 1 7 4502 1 1 11 LYS C C 5.047 0.551 3.324 1.00 . A A . 11 LYS C 1 1 7 4503 1 1 11 LYS CA C 5.448 1.902 3.910 1.00 . A A . 11 LYS CA 1 1 7 4504 1 1 11 LYS CB C 5.023 1.972 5.379 1.00 . A A . 11 LYS CB 1 1 7 4505 1 1 11 LYS CD C 6.759 2.229 7.155 1.00 . A A . 11 LYS CD 1 1 7 4506 1 1 11 LYS CE C 8.017 3.044 7.460 1.00 . A A . 11 LYS CE 1 1 7 4507 1 1 11 LYS CG C 5.908 2.973 6.124 1.00 . A A . 11 LYS CG 1 1 7 4508 1 1 11 LYS H H 4.323 3.716 3.611 1.00 . A A . 11 LYS H 1 1 7 4509 1 1 11 LYS HA H 6.518 2.026 3.831 1.00 . A A . 11 LYS HA 1 1 7 4510 1 1 11 LYS HB2 H 3.992 2.289 5.439 1.00 . A A . 11 LYS HB2 1 1 7 4511 1 1 11 LYS HB3 H 5.126 0.997 5.831 1.00 . A A . 11 LYS HB3 1 1 7 4512 1 1 11 LYS HD2 H 6.187 2.094 8.062 1.00 . A A . 11 LYS HD2 1 1 7 4513 1 1 11 LYS HD3 H 7.044 1.266 6.761 1.00 . A A . 11 LYS HD3 1 1 7 4514 1 1 11 LYS HE2 H 8.693 2.452 8.057 1.00 . A A . 11 LYS HE2 1 1 7 4515 1 1 11 LYS HE3 H 8.500 3.320 6.535 1.00 . A A . 11 LYS HE3 1 1 7 4516 1 1 11 LYS HG2 H 6.553 3.478 5.419 1.00 . A A . 11 LYS HG2 1 1 7 4517 1 1 11 LYS HG3 H 5.286 3.698 6.627 1.00 . A A . 11 LYS HG3 1 1 7 4518 1 1 11 LYS HZ1 H 6.614 4.428 8.133 1.00 . A A . 11 LYS HZ1 1 1 7 4519 1 1 11 LYS HZ2 H 8.145 5.094 7.809 1.00 . A A . 11 LYS HZ2 1 1 7 4520 1 1 11 LYS HZ3 H 7.898 4.165 9.210 1.00 . A A . 11 LYS HZ3 1 1 7 4521 1 1 11 LYS N N 4.759 2.976 3.141 1.00 . A A . 11 LYS N 1 1 7 4522 1 1 11 LYS NZ N 7.640 4.276 8.209 1.00 . A A . 11 LYS NZ 1 1 7 4523 1 1 11 LYS O O 5.847 -0.140 2.724 1.00 . A A . 11 LYS O 1 1 7 4524 1 1 12 PHE C C 3.411 -0.988 1.370 1.00 . A A . 12 PHE C 1 1 7 4525 1 1 12 PHE CA C 3.355 -1.111 2.891 1.00 . A A . 12 PHE CA 1 1 7 4526 1 1 12 PHE CB C 1.918 -1.406 3.333 1.00 . A A . 12 PHE CB 1 1 7 4527 1 1 12 PHE CD1 C 2.324 -1.490 5.821 1.00 . A A . 12 PHE CD1 1 1 7 4528 1 1 12 PHE CD2 C 0.855 0.225 4.936 1.00 . A A . 12 PHE CD2 1 1 7 4529 1 1 12 PHE CE1 C 2.114 -1.001 7.116 1.00 . A A . 12 PHE CE1 1 1 7 4530 1 1 12 PHE CE2 C 0.644 0.712 6.230 1.00 . A A . 12 PHE CE2 1 1 7 4531 1 1 12 PHE CG C 1.695 -0.876 4.730 1.00 . A A . 12 PHE CG 1 1 7 4532 1 1 12 PHE CZ C 1.274 0.100 7.320 1.00 . A A . 12 PHE CZ 1 1 7 4533 1 1 12 PHE H H 3.169 0.756 3.936 1.00 . A A . 12 PHE H 1 1 7 4534 1 1 12 PHE HA H 4.010 -1.906 3.218 1.00 . A A . 12 PHE HA 1 1 7 4535 1 1 12 PHE HB2 H 1.228 -0.925 2.653 1.00 . A A . 12 PHE HB2 1 1 7 4536 1 1 12 PHE HB3 H 1.749 -2.474 3.323 1.00 . A A . 12 PHE HB3 1 1 7 4537 1 1 12 PHE HD1 H 2.972 -2.339 5.662 1.00 . A A . 12 PHE HD1 1 1 7 4538 1 1 12 PHE HD2 H 0.371 0.699 4.094 1.00 . A A . 12 PHE HD2 1 1 7 4539 1 1 12 PHE HE1 H 2.598 -1.474 7.956 1.00 . A A . 12 PHE HE1 1 1 7 4540 1 1 12 PHE HE2 H -0.004 1.561 6.388 1.00 . A A . 12 PHE HE2 1 1 7 4541 1 1 12 PHE HZ H 1.110 0.476 8.319 1.00 . A A . 12 PHE HZ 1 1 7 4542 1 1 12 PHE N N 3.806 0.179 3.468 1.00 . A A . 12 PHE N 1 1 7 4543 1 1 12 PHE O O 3.695 -1.931 0.667 1.00 . A A . 12 PHE O 1 1 7 4544 1 1 13 GLY C C 4.429 -0.311 -1.180 1.00 . A A . 13 GLY C 1 1 7 4545 1 1 13 GLY CA C 3.191 0.382 -0.615 1.00 . A A . 13 GLY CA 1 1 7 4546 1 1 13 GLY H H 2.927 0.936 1.448 1.00 . A A . 13 GLY H 1 1 7 4547 1 1 13 GLY HA2 H 2.304 -0.041 -1.061 1.00 . A A . 13 GLY HA2 1 1 7 4548 1 1 13 GLY HA3 H 3.240 1.437 -0.838 1.00 . A A . 13 GLY HA3 1 1 7 4549 1 1 13 GLY N N 3.148 0.184 0.859 1.00 . A A . 13 GLY N 1 1 7 4550 1 1 13 GLY O O 4.437 -0.771 -2.305 1.00 . A A . 13 GLY O 1 1 7 4551 1 1 14 LYS C C 6.780 -2.494 -0.403 1.00 . A A . 14 LYS C 1 1 7 4552 1 1 14 LYS CA C 6.718 -1.047 -0.904 1.00 . A A . 14 LYS CA 1 1 7 4553 1 1 14 LYS CB C 7.937 -0.280 -0.390 1.00 . A A . 14 LYS CB 1 1 7 4554 1 1 14 LYS CD C 8.141 0.990 -2.530 1.00 . A A . 14 LYS CD 1 1 7 4555 1 1 14 LYS CE C 8.540 2.348 -3.108 1.00 . A A . 14 LYS CE 1 1 7 4556 1 1 14 LYS CG C 7.957 1.114 -1.016 1.00 . A A . 14 LYS CG 1 1 7 4557 1 1 14 LYS H H 5.453 -0.003 0.497 1.00 . A A . 14 LYS H 1 1 7 4558 1 1 14 LYS HA H 6.720 -1.042 -1.984 1.00 . A A . 14 LYS HA 1 1 7 4559 1 1 14 LYS HB2 H 7.879 -0.193 0.686 1.00 . A A . 14 LYS HB2 1 1 7 4560 1 1 14 LYS HB3 H 8.837 -0.810 -0.662 1.00 . A A . 14 LYS HB3 1 1 7 4561 1 1 14 LYS HD2 H 8.916 0.266 -2.741 1.00 . A A . 14 LYS HD2 1 1 7 4562 1 1 14 LYS HD3 H 7.214 0.667 -2.981 1.00 . A A . 14 LYS HD3 1 1 7 4563 1 1 14 LYS HE2 H 9.582 2.537 -2.896 1.00 . A A . 14 LYS HE2 1 1 7 4564 1 1 14 LYS HE3 H 8.383 2.346 -4.176 1.00 . A A . 14 LYS HE3 1 1 7 4565 1 1 14 LYS HG2 H 7.024 1.616 -0.806 1.00 . A A . 14 LYS HG2 1 1 7 4566 1 1 14 LYS HG3 H 8.775 1.683 -0.602 1.00 . A A . 14 LYS HG3 1 1 7 4567 1 1 14 LYS HZ1 H 6.701 3.169 -2.583 1.00 . A A . 14 LYS HZ1 1 1 7 4568 1 1 14 LYS HZ2 H 7.891 4.321 -2.961 1.00 . A A . 14 LYS HZ2 1 1 7 4569 1 1 14 LYS HZ3 H 7.944 3.498 -1.477 1.00 . A A . 14 LYS HZ3 1 1 7 4570 1 1 14 LYS N N 5.478 -0.387 -0.409 1.00 . A A . 14 LYS N 1 1 7 4571 1 1 14 LYS NZ N 7.706 3.415 -2.485 1.00 . A A . 14 LYS NZ 1 1 7 4572 1 1 14 LYS O O 7.275 -3.371 -1.082 1.00 . A A . 14 LYS O 1 1 7 4573 1 1 15 ALA C C 5.110 -4.926 0.838 1.00 . A A . 15 ALA C 1 1 7 4574 1 1 15 ALA CA C 6.337 -4.145 1.314 1.00 . A A . 15 ALA CA 1 1 7 4575 1 1 15 ALA CB C 6.349 -4.105 2.843 1.00 . A A . 15 ALA CB 1 1 7 4576 1 1 15 ALA H H 5.900 -2.032 1.318 1.00 . A A . 15 ALA H 1 1 7 4577 1 1 15 ALA HA H 7.233 -4.634 0.962 1.00 . A A . 15 ALA HA 1 1 7 4578 1 1 15 ALA HB1 H 5.806 -3.236 3.185 1.00 . A A . 15 ALA HB1 1 1 7 4579 1 1 15 ALA HB2 H 7.369 -4.053 3.194 1.00 . A A . 15 ALA HB2 1 1 7 4580 1 1 15 ALA HB3 H 5.880 -4.998 3.229 1.00 . A A . 15 ALA HB3 1 1 7 4581 1 1 15 ALA N N 6.291 -2.752 0.780 1.00 . A A . 15 ALA N 1 1 7 4582 1 1 15 ALA O O 5.191 -6.099 0.530 1.00 . A A . 15 ALA O 1 1 7 4583 1 1 16 TRP C C 2.825 -5.282 -1.168 1.00 . A A . 16 TRP C 1 1 7 4584 1 1 16 TRP CA C 2.743 -4.999 0.335 1.00 . A A . 16 TRP CA 1 1 7 4585 1 1 16 TRP CB C 1.505 -4.142 0.677 1.00 . A A . 16 TRP CB 1 1 7 4586 1 1 16 TRP CD1 C 1.082 -1.948 -0.525 1.00 . A A . 16 TRP CD1 1 1 7 4587 1 1 16 TRP CD2 C 0.567 -3.736 -1.771 1.00 . A A . 16 TRP CD2 1 1 7 4588 1 1 16 TRP CE2 C 0.301 -2.603 -2.571 1.00 . A A . 16 TRP CE2 1 1 7 4589 1 1 16 TRP CE3 C 0.326 -5.001 -2.307 1.00 . A A . 16 TRP CE3 1 1 7 4590 1 1 16 TRP CG C 1.080 -3.299 -0.490 1.00 . A A . 16 TRP CG 1 1 7 4591 1 1 16 TRP CH2 C -0.427 -4.004 -4.394 1.00 . A A . 16 TRP CH2 1 1 7 4592 1 1 16 TRP CZ2 C -0.194 -2.728 -3.871 1.00 . A A . 16 TRP CZ2 1 1 7 4593 1 1 16 TRP CZ3 C -0.169 -5.137 -3.608 1.00 . A A . 16 TRP CZ3 1 1 7 4594 1 1 16 TRP H H 3.925 -3.347 1.037 1.00 . A A . 16 TRP H 1 1 7 4595 1 1 16 TRP HA H 2.672 -5.938 0.859 1.00 . A A . 16 TRP HA 1 1 7 4596 1 1 16 TRP HB2 H 0.690 -4.793 0.953 1.00 . A A . 16 TRP HB2 1 1 7 4597 1 1 16 TRP HB3 H 1.741 -3.500 1.513 1.00 . A A . 16 TRP HB3 1 1 7 4598 1 1 16 TRP HD1 H 1.392 -1.304 0.278 1.00 . A A . 16 TRP HD1 1 1 7 4599 1 1 16 TRP HE1 H 0.550 -0.601 -2.056 1.00 . A A . 16 TRP HE1 1 1 7 4600 1 1 16 TRP HE3 H 0.518 -5.876 -1.702 1.00 . A A . 16 TRP HE3 1 1 7 4601 1 1 16 TRP HH2 H -0.807 -4.118 -5.399 1.00 . A A . 16 TRP HH2 1 1 7 4602 1 1 16 TRP HZ2 H -0.390 -1.850 -4.468 1.00 . A A . 16 TRP HZ2 1 1 7 4603 1 1 16 TRP HZ3 H -0.343 -6.117 -4.008 1.00 . A A . 16 TRP HZ3 1 1 7 4604 1 1 16 TRP N N 3.972 -4.291 0.782 1.00 . A A . 16 TRP N 1 1 7 4605 1 1 16 TRP NE1 N 0.632 -1.532 -1.767 1.00 . A A . 16 TRP NE1 1 1 7 4606 1 1 16 TRP O O 2.526 -6.366 -1.623 1.00 . A A . 16 TRP O 1 1 7 4607 1 1 17 VAL C C 4.386 -5.616 -3.679 1.00 . A A . 17 VAL C 1 1 7 4608 1 1 17 VAL CA C 3.295 -4.576 -3.418 1.00 . A A . 17 VAL CA 1 1 7 4609 1 1 17 VAL CB C 3.579 -3.257 -4.162 1.00 . A A . 17 VAL CB 1 1 7 4610 1 1 17 VAL CG1 C 5.070 -3.118 -4.491 1.00 . A A . 17 VAL CG1 1 1 7 4611 1 1 17 VAL CG2 C 2.774 -3.233 -5.460 1.00 . A A . 17 VAL CG2 1 1 7 4612 1 1 17 VAL H H 3.450 -3.443 -1.590 1.00 . A A . 17 VAL H 1 1 7 4613 1 1 17 VAL HA H 2.347 -4.982 -3.746 1.00 . A A . 17 VAL HA 1 1 7 4614 1 1 17 VAL HB H 3.278 -2.428 -3.539 1.00 . A A . 17 VAL HB 1 1 7 4615 1 1 17 VAL HG11 H 5.406 -3.999 -5.018 1.00 . A A . 17 VAL HG11 1 1 7 4616 1 1 17 VAL HG12 H 5.633 -3.008 -3.576 1.00 . A A . 17 VAL HG12 1 1 7 4617 1 1 17 VAL HG13 H 5.220 -2.248 -5.113 1.00 . A A . 17 VAL HG13 1 1 7 4618 1 1 17 VAL HG21 H 3.426 -3.464 -6.288 1.00 . A A . 17 VAL HG21 1 1 7 4619 1 1 17 VAL HG22 H 2.347 -2.251 -5.600 1.00 . A A . 17 VAL HG22 1 1 7 4620 1 1 17 VAL HG23 H 1.984 -3.967 -5.406 1.00 . A A . 17 VAL HG23 1 1 7 4621 1 1 17 VAL N N 3.216 -4.321 -1.955 1.00 . A A . 17 VAL N 1 1 7 4622 1 1 17 VAL O O 4.157 -6.620 -4.324 1.00 . A A . 17 VAL O 1 1 7 4623 1 1 18 GLY C C 6.127 -7.768 -2.848 1.00 . A A . 18 GLY C 1 1 7 4624 1 1 18 GLY CA C 6.640 -6.416 -3.349 1.00 . A A . 18 GLY CA 1 1 7 4625 1 1 18 GLY H H 5.726 -4.609 -2.610 1.00 . A A . 18 GLY H 1 1 7 4626 1 1 18 GLY HA2 H 6.887 -6.482 -4.400 1.00 . A A . 18 GLY HA2 1 1 7 4627 1 1 18 GLY HA3 H 7.514 -6.130 -2.784 1.00 . A A . 18 GLY HA3 1 1 7 4628 1 1 18 GLY N N 5.562 -5.408 -3.152 1.00 . A A . 18 GLY N 1 1 7 4629 1 1 18 GLY O O 6.681 -8.807 -3.146 1.00 . A A . 18 GLY O 1 1 7 4630 1 1 19 GLU C C 3.505 -9.549 -2.610 1.00 . A A . 19 GLU C 1 1 7 4631 1 1 19 GLU CA C 4.474 -9.007 -1.569 1.00 . A A . 19 GLU CA 1 1 7 4632 1 1 19 GLU CB C 3.723 -8.685 -0.269 1.00 . A A . 19 GLU CB 1 1 7 4633 1 1 19 GLU CD C 3.086 -11.103 -0.285 1.00 . A A . 19 GLU CD 1 1 7 4634 1 1 19 GLU CG C 2.581 -9.679 -0.048 1.00 . A A . 19 GLU CG 1 1 7 4635 1 1 19 GLU H H 4.626 -6.909 -1.873 1.00 . A A . 19 GLU H 1 1 7 4636 1 1 19 GLU HA H 5.253 -9.727 -1.381 1.00 . A A . 19 GLU HA 1 1 7 4637 1 1 19 GLU HB2 H 4.407 -8.734 0.564 1.00 . A A . 19 GLU HB2 1 1 7 4638 1 1 19 GLU HB3 H 3.308 -7.687 -0.338 1.00 . A A . 19 GLU HB3 1 1 7 4639 1 1 19 GLU HG2 H 2.213 -9.585 0.963 1.00 . A A . 19 GLU HG2 1 1 7 4640 1 1 19 GLU HG3 H 1.785 -9.458 -0.744 1.00 . A A . 19 GLU HG3 1 1 7 4641 1 1 19 GLU N N 5.057 -7.753 -2.092 1.00 . A A . 19 GLU N 1 1 7 4642 1 1 19 GLU O O 3.758 -10.545 -3.257 1.00 . A A . 19 GLU O 1 1 7 4643 1 1 19 GLU OE1 O 3.816 -11.599 0.557 1.00 . A A . 19 GLU OE1 1 1 7 4644 1 1 19 GLU OE2 O 2.734 -11.673 -1.304 1.00 . A A . 19 GLU OE2 1 1 7 4645 1 1 20 ILE C C 1.929 -9.126 -5.176 1.00 . A A . 20 ILE C 1 1 7 4646 1 1 20 ILE CA C 1.404 -9.381 -3.768 1.00 . A A . 20 ILE CA 1 1 7 4647 1 1 20 ILE CB C 0.090 -8.634 -3.583 1.00 . A A . 20 ILE CB 1 1 7 4648 1 1 20 ILE CD1 C -1.722 -8.134 -1.949 1.00 . A A . 20 ILE CD1 1 1 7 4649 1 1 20 ILE CG1 C -0.576 -9.085 -2.292 1.00 . A A . 20 ILE CG1 1 1 7 4650 1 1 20 ILE CG2 C -0.842 -8.924 -4.761 1.00 . A A . 20 ILE CG2 1 1 7 4651 1 1 20 ILE H H 2.198 -8.093 -2.234 1.00 . A A . 20 ILE H 1 1 7 4652 1 1 20 ILE HA H 1.247 -10.433 -3.625 1.00 . A A . 20 ILE HA 1 1 7 4653 1 1 20 ILE HB H 0.293 -7.580 -3.533 1.00 . A A . 20 ILE HB 1 1 7 4654 1 1 20 ILE HD11 H -1.753 -7.330 -2.671 1.00 . A A . 20 ILE HD11 1 1 7 4655 1 1 20 ILE HD12 H -1.567 -7.723 -0.961 1.00 . A A . 20 ILE HD12 1 1 7 4656 1 1 20 ILE HD13 H -2.657 -8.674 -1.972 1.00 . A A . 20 ILE HD13 1 1 7 4657 1 1 20 ILE HG12 H -0.961 -10.086 -2.424 1.00 . A A . 20 ILE HG12 1 1 7 4658 1 1 20 ILE HG13 H 0.150 -9.076 -1.492 1.00 . A A . 20 ILE HG13 1 1 7 4659 1 1 20 ILE HG21 H -1.868 -8.809 -4.445 1.00 . A A . 20 ILE HG21 1 1 7 4660 1 1 20 ILE HG22 H -0.682 -9.935 -5.105 1.00 . A A . 20 ILE HG22 1 1 7 4661 1 1 20 ILE HG23 H -0.633 -8.233 -5.564 1.00 . A A . 20 ILE HG23 1 1 7 4662 1 1 20 ILE N N 2.389 -8.898 -2.773 1.00 . A A . 20 ILE N 1 1 7 4663 1 1 20 ILE O O 1.899 -9.989 -6.031 1.00 . A A . 20 ILE O 1 1 7 4664 1 1 21 MET C C 4.005 -8.635 -7.169 1.00 . A A . 21 MET C 1 1 7 4665 1 1 21 MET CA C 2.925 -7.620 -6.780 1.00 . A A . 21 MET CA 1 1 7 4666 1 1 21 MET CB C 3.512 -6.210 -6.777 1.00 . A A . 21 MET CB 1 1 7 4667 1 1 21 MET CE C 5.241 -4.191 -9.004 1.00 . A A . 21 MET CE 1 1 7 4668 1 1 21 MET CG C 3.050 -5.470 -8.032 1.00 . A A . 21 MET CG 1 1 7 4669 1 1 21 MET H H 2.415 -7.259 -4.723 1.00 . A A . 21 MET H 1 1 7 4670 1 1 21 MET HA H 2.114 -7.668 -7.493 1.00 . A A . 21 MET HA 1 1 7 4671 1 1 21 MET HB2 H 3.166 -5.680 -5.898 1.00 . A A . 21 MET HB2 1 1 7 4672 1 1 21 MET HB3 H 4.590 -6.266 -6.768 1.00 . A A . 21 MET HB3 1 1 7 4673 1 1 21 MET HE1 H 6.225 -4.292 -9.438 1.00 . A A . 21 MET HE1 1 1 7 4674 1 1 21 MET HE2 H 5.332 -4.055 -7.938 1.00 . A A . 21 MET HE2 1 1 7 4675 1 1 21 MET HE3 H 4.738 -3.334 -9.432 1.00 . A A . 21 MET HE3 1 1 7 4676 1 1 21 MET HG2 H 2.100 -5.873 -8.355 1.00 . A A . 21 MET HG2 1 1 7 4677 1 1 21 MET HG3 H 2.940 -4.419 -7.809 1.00 . A A . 21 MET HG3 1 1 7 4678 1 1 21 MET N N 2.404 -7.941 -5.426 1.00 . A A . 21 MET N 1 1 7 4679 1 1 21 MET O O 4.324 -8.800 -8.329 1.00 . A A . 21 MET O 1 1 7 4680 1 1 21 MET SD S 4.277 -5.685 -9.345 1.00 . A A . 21 MET SD 1 1 7 4681 1 1 22 ASN C C 4.969 -11.605 -7.044 1.00 . A A . 22 ASN C 1 1 7 4682 1 1 22 ASN CA C 5.626 -10.322 -6.531 1.00 . A A . 22 ASN CA 1 1 7 4683 1 1 22 ASN CB C 6.435 -10.640 -5.272 1.00 . A A . 22 ASN CB 1 1 7 4684 1 1 22 ASN CG C 7.796 -9.945 -5.345 1.00 . A A . 22 ASN CG 1 1 7 4685 1 1 22 ASN H H 4.302 -9.173 -5.275 1.00 . A A . 22 ASN H 1 1 7 4686 1 1 22 ASN HA H 6.283 -9.923 -7.291 1.00 . A A . 22 ASN HA 1 1 7 4687 1 1 22 ASN HB2 H 5.896 -10.288 -4.403 1.00 . A A . 22 ASN HB2 1 1 7 4688 1 1 22 ASN HB3 H 6.581 -11.708 -5.200 1.00 . A A . 22 ASN HB3 1 1 7 4689 1 1 22 ASN HD21 H 7.045 -8.245 -6.049 1.00 . A A . 22 ASN HD21 1 1 7 4690 1 1 22 ASN HD22 H 8.737 -8.262 -5.825 1.00 . A A . 22 ASN HD22 1 1 7 4691 1 1 22 ASN N N 4.571 -9.318 -6.208 1.00 . A A . 22 ASN N 1 1 7 4692 1 1 22 ASN ND2 N 7.864 -8.716 -5.776 1.00 . A A . 22 ASN ND2 1 1 7 4693 1 1 22 ASN O O 5.383 -12.173 -8.035 1.00 . A A . 22 ASN O 1 1 7 4694 1 1 22 ASN OD1 O 8.806 -10.528 -5.006 1.00 . A A . 22 ASN OD1 1 1 7 4695 1 1 23 SER C C 2.832 -13.170 -8.274 1.00 . A A . 23 SER C 1 1 7 4696 1 1 23 SER CA C 3.264 -13.313 -6.813 1.00 . A A . 23 SER CA 1 1 7 4697 1 1 23 SER CB C 2.034 -13.553 -5.937 1.00 . A A . 23 SER CB 1 1 7 4698 1 1 23 SER H H 3.635 -11.591 -5.575 1.00 . A A . 23 SER H 1 1 7 4699 1 1 23 SER HA H 3.942 -14.148 -6.719 1.00 . A A . 23 SER HA 1 1 7 4700 1 1 23 SER HB2 H 2.204 -13.142 -4.956 1.00 . A A . 23 SER HB2 1 1 7 4701 1 1 23 SER HB3 H 1.176 -13.068 -6.384 1.00 . A A . 23 SER HB3 1 1 7 4702 1 1 23 SER HG H 2.403 -15.298 -5.161 1.00 . A A . 23 SER HG 1 1 7 4703 1 1 23 SER N N 3.950 -12.065 -6.372 1.00 . A A . 23 SER N 1 1 7 4704 1 1 23 SER O O 1.694 -12.797 -8.501 1.00 . A A . 23 SER O 1 1 7 4705 1 1 23 SER OXT O 3.648 -13.439 -9.141 1.00 . A A . 23 SER OXT 1 1 7 4706 1 1 23 SER OG O 1.803 -14.950 -5.826 1.00 . A A . 23 SER OG 1 1 7 4707 2 1 1 GLY C C 3.949 -11.241 6.264 1.00 . B B . 1 GLY C 1 1 7 4708 2 1 1 GLY CA C 5.011 -11.734 7.247 1.00 . B B . 1 GLY CA 1 1 7 4709 2 1 1 GLY H1 H 5.306 -13.417 6.057 1.00 . B B . 1 GLY H1 1 1 7 4710 2 1 1 GLY H2 H 4.396 -13.711 7.462 1.00 . B B . 1 GLY H2 1 1 7 4711 2 1 1 GLY H3 H 6.077 -13.493 7.566 1.00 . B B . 1 GLY H3 1 1 7 4712 2 1 1 GLY HA2 H 4.687 -11.535 8.258 1.00 . B B . 1 GLY HA2 1 1 7 4713 2 1 1 GLY HA3 H 5.938 -11.217 7.056 1.00 . B B . 1 GLY HA3 1 1 7 4714 2 1 1 GLY N N 5.213 -13.200 7.070 1.00 . B B . 1 GLY N 1 1 7 4715 2 1 1 GLY O O 4.217 -10.429 5.402 1.00 . B B . 1 GLY O 1 1 7 4716 2 1 2 ILE C C 0.338 -11.195 6.207 1.00 . B B . 2 ILE C 1 1 7 4717 2 1 2 ILE CA C 1.668 -11.280 5.456 1.00 . B B . 2 ILE CA 1 1 7 4718 2 1 2 ILE CB C 1.541 -12.276 4.302 1.00 . B B . 2 ILE CB 1 1 7 4719 2 1 2 ILE CD1 C 1.742 -14.683 3.664 1.00 . B B . 2 ILE CD1 1 1 7 4720 2 1 2 ILE CG1 C 1.711 -13.700 4.836 1.00 . B B . 2 ILE CG1 1 1 7 4721 2 1 2 ILE CG2 C 2.626 -11.991 3.261 1.00 . B B . 2 ILE CG2 1 1 7 4722 2 1 2 ILE H H 2.545 -12.379 7.087 1.00 . B B . 2 ILE H 1 1 7 4723 2 1 2 ILE HA H 1.918 -10.305 5.061 1.00 . B B . 2 ILE HA 1 1 7 4724 2 1 2 ILE HB H 0.568 -12.174 3.843 1.00 . B B . 2 ILE HB 1 1 7 4725 2 1 2 ILE HD11 H 2.658 -15.253 3.696 1.00 . B B . 2 ILE HD11 1 1 7 4726 2 1 2 ILE HD12 H 1.691 -14.136 2.734 1.00 . B B . 2 ILE HD12 1 1 7 4727 2 1 2 ILE HD13 H 0.898 -15.353 3.733 1.00 . B B . 2 ILE HD13 1 1 7 4728 2 1 2 ILE HG12 H 2.638 -13.769 5.390 1.00 . B B . 2 ILE HG12 1 1 7 4729 2 1 2 ILE HG13 H 0.882 -13.942 5.485 1.00 . B B . 2 ILE HG13 1 1 7 4730 2 1 2 ILE HG21 H 2.448 -12.591 2.381 1.00 . B B . 2 ILE HG21 1 1 7 4731 2 1 2 ILE HG22 H 3.594 -12.235 3.673 1.00 . B B . 2 ILE HG22 1 1 7 4732 2 1 2 ILE HG23 H 2.602 -10.945 2.994 1.00 . B B . 2 ILE HG23 1 1 7 4733 2 1 2 ILE N N 2.743 -11.725 6.385 1.00 . B B . 2 ILE N 1 1 7 4734 2 1 2 ILE O O -0.598 -11.915 5.916 1.00 . B B . 2 ILE O 1 1 7 4735 2 1 3 GLY C C -1.455 -8.709 7.946 1.00 . B B . 3 GLY C 1 1 7 4736 2 1 3 GLY CA C -1.032 -10.177 7.927 1.00 . B B . 3 GLY CA 1 1 7 4737 2 1 3 GLY H H 1.006 -9.740 7.381 1.00 . B B . 3 GLY H 1 1 7 4738 2 1 3 GLY HA2 H -1.799 -10.762 7.441 1.00 . B B . 3 GLY HA2 1 1 7 4739 2 1 3 GLY HA3 H -0.892 -10.526 8.938 1.00 . B B . 3 GLY HA3 1 1 7 4740 2 1 3 GLY N N 0.243 -10.316 7.166 1.00 . B B . 3 GLY N 1 1 7 4741 2 1 3 GLY O O -2.373 -8.321 8.642 1.00 . B B . 3 GLY O 1 1 7 4742 2 1 4 LYS C C -1.134 -6.005 5.661 1.00 . B B . 4 LYS C 1 1 7 4743 2 1 4 LYS CA C -1.158 -6.449 7.124 1.00 . B B . 4 LYS CA 1 1 7 4744 2 1 4 LYS CB C -0.159 -5.619 7.941 1.00 . B B . 4 LYS CB 1 1 7 4745 2 1 4 LYS CD C 2.046 -5.694 9.119 1.00 . B B . 4 LYS CD 1 1 7 4746 2 1 4 LYS CE C 1.567 -6.140 10.503 1.00 . B B . 4 LYS CE 1 1 7 4747 2 1 4 LYS CG C 1.181 -6.354 8.042 1.00 . B B . 4 LYS CG 1 1 7 4748 2 1 4 LYS H H -0.066 -8.230 6.620 1.00 . B B . 4 LYS H 1 1 7 4749 2 1 4 LYS HA H -2.152 -6.315 7.523 1.00 . B B . 4 LYS HA 1 1 7 4750 2 1 4 LYS HB2 H -0.009 -4.665 7.457 1.00 . B B . 4 LYS HB2 1 1 7 4751 2 1 4 LYS HB3 H -0.555 -5.460 8.933 1.00 . B B . 4 LYS HB3 1 1 7 4752 2 1 4 LYS HD2 H 3.077 -5.988 8.982 1.00 . B B . 4 LYS HD2 1 1 7 4753 2 1 4 LYS HD3 H 1.963 -4.621 9.040 1.00 . B B . 4 LYS HD3 1 1 7 4754 2 1 4 LYS HE2 H 0.866 -6.954 10.396 1.00 . B B . 4 LYS HE2 1 1 7 4755 2 1 4 LYS HE3 H 2.413 -6.468 11.089 1.00 . B B . 4 LYS HE3 1 1 7 4756 2 1 4 LYS HG2 H 1.007 -7.388 8.305 1.00 . B B . 4 LYS HG2 1 1 7 4757 2 1 4 LYS HG3 H 1.692 -6.305 7.093 1.00 . B B . 4 LYS HG3 1 1 7 4758 2 1 4 LYS HZ1 H 1.587 -4.508 11.798 1.00 . B B . 4 LYS HZ1 1 1 7 4759 2 1 4 LYS HZ2 H 0.115 -5.354 11.772 1.00 . B B . 4 LYS HZ2 1 1 7 4760 2 1 4 LYS HZ3 H 0.533 -4.332 10.481 1.00 . B B . 4 LYS HZ3 1 1 7 4761 2 1 4 LYS N N -0.796 -7.891 7.176 1.00 . B B . 4 LYS N 1 1 7 4762 2 1 4 LYS NZ N 0.900 -4.997 11.190 1.00 . B B . 4 LYS NZ 1 1 7 4763 2 1 4 LYS O O -1.979 -5.255 5.213 1.00 . B B . 4 LYS O 1 1 7 4764 2 1 5 TYR C C -1.260 -6.747 2.723 1.00 . B B . 5 TYR C 1 1 7 4765 2 1 5 TYR CA C -0.098 -6.116 3.474 1.00 . B B . 5 TYR CA 1 1 7 4766 2 1 5 TYR CB C 1.206 -6.649 2.900 1.00 . B B . 5 TYR CB 1 1 7 4767 2 1 5 TYR CD1 C 2.826 -4.985 3.888 1.00 . B B . 5 TYR CD1 1 1 7 4768 2 1 5 TYR CD2 C 2.913 -7.294 4.629 1.00 . B B . 5 TYR CD2 1 1 7 4769 2 1 5 TYR CE1 C 3.880 -4.668 4.752 1.00 . B B . 5 TYR CE1 1 1 7 4770 2 1 5 TYR CE2 C 3.967 -6.977 5.493 1.00 . B B . 5 TYR CE2 1 1 7 4771 2 1 5 TYR CG C 2.343 -6.299 3.827 1.00 . B B . 5 TYR CG 1 1 7 4772 2 1 5 TYR CZ C 4.451 -5.664 5.555 1.00 . B B . 5 TYR CZ 1 1 7 4773 2 1 5 TYR H H 0.484 -7.092 5.288 1.00 . B B . 5 TYR H 1 1 7 4774 2 1 5 TYR HA H -0.131 -5.051 3.360 1.00 . B B . 5 TYR HA 1 1 7 4775 2 1 5 TYR HB2 H 1.141 -7.723 2.797 1.00 . B B . 5 TYR HB2 1 1 7 4776 2 1 5 TYR HB3 H 1.374 -6.203 1.937 1.00 . B B . 5 TYR HB3 1 1 7 4777 2 1 5 TYR HD1 H 2.385 -4.218 3.268 1.00 . B B . 5 TYR HD1 1 1 7 4778 2 1 5 TYR HD2 H 2.538 -8.307 4.581 1.00 . B B . 5 TYR HD2 1 1 7 4779 2 1 5 TYR HE1 H 4.254 -3.656 4.800 1.00 . B B . 5 TYR HE1 1 1 7 4780 2 1 5 TYR HE2 H 4.408 -7.744 6.112 1.00 . B B . 5 TYR HE2 1 1 7 4781 2 1 5 TYR HH H 5.616 -4.399 6.385 1.00 . B B . 5 TYR HH 1 1 7 4782 2 1 5 TYR N N -0.179 -6.482 4.909 1.00 . B B . 5 TYR N 1 1 7 4783 2 1 5 TYR O O -1.676 -6.267 1.687 1.00 . B B . 5 TYR O 1 1 7 4784 2 1 5 TYR OH O 5.492 -5.351 6.406 1.00 . B B . 5 TYR OH 1 1 7 4785 2 1 6 LEU C C -4.219 -8.191 3.225 1.00 . B B . 6 LEU C 1 1 7 4786 2 1 6 LEU CA C -2.902 -8.486 2.511 1.00 . B B . 6 LEU CA 1 1 7 4787 2 1 6 LEU CB C -2.658 -9.994 2.487 1.00 . B B . 6 LEU CB 1 1 7 4788 2 1 6 LEU CD1 C -2.341 -10.202 0.028 1.00 . B B . 6 LEU CD1 1 1 7 4789 2 1 6 LEU CD2 C -0.465 -9.373 1.457 1.00 . B B . 6 LEU CD2 1 1 7 4790 2 1 6 LEU CG C -1.657 -10.334 1.386 1.00 . B B . 6 LEU CG 1 1 7 4791 2 1 6 LEU H H -1.429 -8.216 4.055 1.00 . B B . 6 LEU H 1 1 7 4792 2 1 6 LEU HA H -2.945 -8.107 1.500 1.00 . B B . 6 LEU HA 1 1 7 4793 2 1 6 LEU HB2 H -2.260 -10.308 3.442 1.00 . B B . 6 LEU HB2 1 1 7 4794 2 1 6 LEU HB3 H -3.589 -10.507 2.297 1.00 . B B . 6 LEU HB3 1 1 7 4795 2 1 6 LEU HD11 H -3.185 -10.874 -0.017 1.00 . B B . 6 LEU HD11 1 1 7 4796 2 1 6 LEU HD12 H -1.641 -10.455 -0.748 1.00 . B B . 6 LEU HD12 1 1 7 4797 2 1 6 LEU HD13 H -2.681 -9.186 -0.106 1.00 . B B . 6 LEU HD13 1 1 7 4798 2 1 6 LEU HD21 H -0.108 -9.317 2.477 1.00 . B B . 6 LEU HD21 1 1 7 4799 2 1 6 LEU HD22 H -0.771 -8.391 1.129 1.00 . B B . 6 LEU HD22 1 1 7 4800 2 1 6 LEU HD23 H 0.330 -9.734 0.819 1.00 . B B . 6 LEU HD23 1 1 7 4801 2 1 6 LEU HG H -1.312 -11.349 1.518 1.00 . B B . 6 LEU HG 1 1 7 4802 2 1 6 LEU N N -1.782 -7.829 3.222 1.00 . B B . 6 LEU N 1 1 7 4803 2 1 6 LEU O O -5.242 -8.770 2.919 1.00 . B B . 6 LEU O 1 1 7 4804 2 1 7 HIS C C -5.598 -5.482 5.120 1.00 . B B . 7 HIS C 1 1 7 4805 2 1 7 HIS CA C -5.476 -6.989 4.895 1.00 . B B . 7 HIS CA 1 1 7 4806 2 1 7 HIS CB C -5.486 -7.708 6.246 1.00 . B B . 7 HIS CB 1 1 7 4807 2 1 7 HIS CD2 C -4.192 -9.937 6.752 1.00 . B B . 7 HIS CD2 1 1 7 4808 2 1 7 HIS CE1 C -5.009 -11.151 5.154 1.00 . B B . 7 HIS CE1 1 1 7 4809 2 1 7 HIS CG C -5.069 -9.142 6.058 1.00 . B B . 7 HIS CG 1 1 7 4810 2 1 7 HIS H H -3.380 -6.839 4.415 1.00 . B B . 7 HIS H 1 1 7 4811 2 1 7 HIS HA H -6.312 -7.327 4.305 1.00 . B B . 7 HIS HA 1 1 7 4812 2 1 7 HIS HB2 H -4.797 -7.219 6.918 1.00 . B B . 7 HIS HB2 1 1 7 4813 2 1 7 HIS HB3 H -6.481 -7.674 6.663 1.00 . B B . 7 HIS HB3 1 1 7 4814 2 1 7 HIS HD1 H -6.233 -9.664 4.368 1.00 . B B . 7 HIS HD1 1 1 7 4815 2 1 7 HIS HD2 H -3.619 -9.626 7.612 1.00 . B B . 7 HIS HD2 1 1 7 4816 2 1 7 HIS HE1 H -5.216 -11.981 4.496 1.00 . B B . 7 HIS HE1 1 1 7 4817 2 1 7 HIS N N -4.212 -7.299 4.176 1.00 . B B . 7 HIS N 1 1 7 4818 2 1 7 HIS ND1 N -5.579 -9.936 5.043 1.00 . B B . 7 HIS ND1 1 1 7 4819 2 1 7 HIS NE2 N -4.155 -11.205 6.180 1.00 . B B . 7 HIS NE2 1 1 7 4820 2 1 7 HIS O O -6.424 -5.029 5.886 1.00 . B B . 7 HIS O 1 1 7 4821 2 1 8 SER C C -4.011 -2.497 3.634 1.00 . B B . 8 SER C 1 1 7 4822 2 1 8 SER CA C -4.887 -3.220 4.654 1.00 . B B . 8 SER CA 1 1 7 4823 2 1 8 SER CB C -4.429 -2.857 6.067 1.00 . B B . 8 SER CB 1 1 7 4824 2 1 8 SER H H -4.128 -5.070 3.843 1.00 . B B . 8 SER H 1 1 7 4825 2 1 8 SER HA H -5.909 -2.913 4.518 1.00 . B B . 8 SER HA 1 1 7 4826 2 1 8 SER HB2 H -5.286 -2.761 6.712 1.00 . B B . 8 SER HB2 1 1 7 4827 2 1 8 SER HB3 H -3.782 -3.638 6.446 1.00 . B B . 8 SER HB3 1 1 7 4828 2 1 8 SER HG H -2.806 -1.795 6.233 1.00 . B B . 8 SER HG 1 1 7 4829 2 1 8 SER N N -4.791 -4.694 4.461 1.00 . B B . 8 SER N 1 1 7 4830 2 1 8 SER O O -4.340 -1.422 3.172 1.00 . B B . 8 SER O 1 1 7 4831 2 1 8 SER OG O -3.728 -1.620 6.032 1.00 . B B . 8 SER OG 1 1 7 4832 2 1 9 ALA C C -2.742 -2.307 0.950 1.00 . B B . 9 ALA C 1 1 7 4833 2 1 9 ALA CA C -2.015 -2.401 2.286 1.00 . B B . 9 ALA CA 1 1 7 4834 2 1 9 ALA CB C -0.739 -3.214 2.101 1.00 . B B . 9 ALA CB 1 1 7 4835 2 1 9 ALA H H -2.648 -3.938 3.658 1.00 . B B . 9 ALA H 1 1 7 4836 2 1 9 ALA HA H -1.766 -1.411 2.635 1.00 . B B . 9 ALA HA 1 1 7 4837 2 1 9 ALA HB1 H -0.217 -3.282 3.042 1.00 . B B . 9 ALA HB1 1 1 7 4838 2 1 9 ALA HB2 H -0.114 -2.721 1.380 1.00 . B B . 9 ALA HB2 1 1 7 4839 2 1 9 ALA HB3 H -0.986 -4.213 1.748 1.00 . B B . 9 ALA HB3 1 1 7 4840 2 1 9 ALA N N -2.899 -3.070 3.277 1.00 . B B . 9 ALA N 1 1 7 4841 2 1 9 ALA O O -3.055 -1.231 0.479 1.00 . B B . 9 ALA O 1 1 7 4842 2 1 10 LYS C C -4.681 -2.289 -1.080 1.00 . B B . 10 LYS C 1 1 7 4843 2 1 10 LYS CA C -3.704 -3.463 -0.976 1.00 . B B . 10 LYS CA 1 1 7 4844 2 1 10 LYS CB C -4.485 -4.772 -1.108 1.00 . B B . 10 LYS CB 1 1 7 4845 2 1 10 LYS CD C -4.660 -6.928 -2.364 1.00 . B B . 10 LYS CD 1 1 7 4846 2 1 10 LYS CE C -5.955 -6.572 -3.098 1.00 . B B . 10 LYS CE 1 1 7 4847 2 1 10 LYS CG C -3.821 -5.664 -2.160 1.00 . B B . 10 LYS CG 1 1 7 4848 2 1 10 LYS H H -2.712 -4.276 0.763 1.00 . B B . 10 LYS H 1 1 7 4849 2 1 10 LYS HA H -2.978 -3.398 -1.773 1.00 . B B . 10 LYS HA 1 1 7 4850 2 1 10 LYS HB2 H -4.496 -5.282 -0.156 1.00 . B B . 10 LYS HB2 1 1 7 4851 2 1 10 LYS HB3 H -5.498 -4.554 -1.412 1.00 . B B . 10 LYS HB3 1 1 7 4852 2 1 10 LYS HD2 H -4.099 -7.641 -2.952 1.00 . B B . 10 LYS HD2 1 1 7 4853 2 1 10 LYS HD3 H -4.900 -7.362 -1.405 1.00 . B B . 10 LYS HD3 1 1 7 4854 2 1 10 LYS HE2 H -6.407 -5.709 -2.631 1.00 . B B . 10 LYS HE2 1 1 7 4855 2 1 10 LYS HE3 H -5.734 -6.349 -4.131 1.00 . B B . 10 LYS HE3 1 1 7 4856 2 1 10 LYS HG2 H -3.747 -5.125 -3.093 1.00 . B B . 10 LYS HG2 1 1 7 4857 2 1 10 LYS HG3 H -2.833 -5.941 -1.824 1.00 . B B . 10 LYS HG3 1 1 7 4858 2 1 10 LYS HZ1 H -7.340 -7.869 -3.959 1.00 . B B . 10 LYS HZ1 1 1 7 4859 2 1 10 LYS HZ2 H -7.634 -7.529 -2.321 1.00 . B B . 10 LYS HZ2 1 1 7 4860 2 1 10 LYS HZ3 H -6.378 -8.585 -2.759 1.00 . B B . 10 LYS HZ3 1 1 7 4861 2 1 10 LYS N N -2.997 -3.435 0.344 1.00 . B B . 10 LYS N 1 1 7 4862 2 1 10 LYS NZ N -6.898 -7.725 -3.028 1.00 . B B . 10 LYS NZ 1 1 7 4863 2 1 10 LYS O O -4.674 -1.549 -2.044 1.00 . B B . 10 LYS O 1 1 7 4864 2 1 11 LYS C C -5.725 0.305 -0.501 1.00 . B B . 11 LYS C 1 1 7 4865 2 1 11 LYS CA C -6.484 -0.973 -0.147 1.00 . B B . 11 LYS CA 1 1 7 4866 2 1 11 LYS CB C -7.155 -0.806 1.217 1.00 . B B . 11 LYS CB 1 1 7 4867 2 1 11 LYS CD C -9.462 -1.709 1.533 1.00 . B B . 11 LYS CD 1 1 7 4868 2 1 11 LYS CE C -10.112 -2.209 2.825 1.00 . B B . 11 LYS CE 1 1 7 4869 2 1 11 LYS CG C -7.972 -2.057 1.543 1.00 . B B . 11 LYS CG 1 1 7 4870 2 1 11 LYS H H -5.509 -2.710 0.678 1.00 . B B . 11 LYS H 1 1 7 4871 2 1 11 LYS HA H -7.233 -1.169 -0.900 1.00 . B B . 11 LYS HA 1 1 7 4872 2 1 11 LYS HB2 H -6.399 -0.659 1.975 1.00 . B B . 11 LYS HB2 1 1 7 4873 2 1 11 LYS HB3 H -7.811 0.053 1.193 1.00 . B B . 11 LYS HB3 1 1 7 4874 2 1 11 LYS HD2 H -9.581 -0.638 1.461 1.00 . B B . 11 LYS HD2 1 1 7 4875 2 1 11 LYS HD3 H -9.936 -2.184 0.687 1.00 . B B . 11 LYS HD3 1 1 7 4876 2 1 11 LYS HE2 H -9.348 -2.391 3.566 1.00 . B B . 11 LYS HE2 1 1 7 4877 2 1 11 LYS HE3 H -10.801 -1.465 3.193 1.00 . B B . 11 LYS HE3 1 1 7 4878 2 1 11 LYS HG2 H -7.774 -2.820 0.805 1.00 . B B . 11 LYS HG2 1 1 7 4879 2 1 11 LYS HG3 H -7.697 -2.422 2.521 1.00 . B B . 11 LYS HG3 1 1 7 4880 2 1 11 LYS HZ1 H -11.748 -3.259 2.077 1.00 . B B . 11 LYS HZ1 1 1 7 4881 2 1 11 LYS HZ2 H -11.039 -3.965 3.450 1.00 . B B . 11 LYS HZ2 1 1 7 4882 2 1 11 LYS HZ3 H -10.274 -4.088 1.939 1.00 . B B . 11 LYS HZ3 1 1 7 4883 2 1 11 LYS N N -5.519 -2.107 -0.096 1.00 . B B . 11 LYS N 1 1 7 4884 2 1 11 LYS NZ N -10.849 -3.476 2.552 1.00 . B B . 11 LYS NZ 1 1 7 4885 2 1 11 LYS O O -5.935 0.896 -1.541 1.00 . B B . 11 LYS O 1 1 7 4886 2 1 12 PHE C C -3.116 1.677 -1.114 1.00 . B B . 12 PHE C 1 1 7 4887 2 1 12 PHE CA C -4.056 1.959 0.059 1.00 . B B . 12 PHE CA 1 1 7 4888 2 1 12 PHE CB C -3.235 2.351 1.290 1.00 . B B . 12 PHE CB 1 1 7 4889 2 1 12 PHE CD1 C -5.340 2.561 2.667 1.00 . B B . 12 PHE CD1 1 1 7 4890 2 1 12 PHE CD2 C -3.470 1.311 3.574 1.00 . B B . 12 PHE CD2 1 1 7 4891 2 1 12 PHE CE1 C -6.078 2.297 3.828 1.00 . B B . 12 PHE CE1 1 1 7 4892 2 1 12 PHE CE2 C -4.208 1.047 4.734 1.00 . B B . 12 PHE CE2 1 1 7 4893 2 1 12 PHE CG C -4.036 2.068 2.541 1.00 . B B . 12 PHE CG 1 1 7 4894 2 1 12 PHE CZ C -5.512 1.540 4.861 1.00 . B B . 12 PHE CZ 1 1 7 4895 2 1 12 PHE H H -4.676 0.232 1.183 1.00 . B B . 12 PHE H 1 1 7 4896 2 1 12 PHE HA H -4.730 2.763 -0.200 1.00 . B B . 12 PHE HA 1 1 7 4897 2 1 12 PHE HB2 H -2.320 1.775 1.311 1.00 . B B . 12 PHE HB2 1 1 7 4898 2 1 12 PHE HB3 H -2.999 3.405 1.245 1.00 . B B . 12 PHE HB3 1 1 7 4899 2 1 12 PHE HD1 H -5.776 3.146 1.870 1.00 . B B . 12 PHE HD1 1 1 7 4900 2 1 12 PHE HD2 H -2.464 0.931 3.475 1.00 . B B . 12 PHE HD2 1 1 7 4901 2 1 12 PHE HE1 H -7.084 2.677 3.926 1.00 . B B . 12 PHE HE1 1 1 7 4902 2 1 12 PHE HE2 H -3.772 0.462 5.529 1.00 . B B . 12 PHE HE2 1 1 7 4903 2 1 12 PHE HZ H -6.082 1.335 5.755 1.00 . B B . 12 PHE HZ 1 1 7 4904 2 1 12 PHE N N -4.835 0.728 0.353 1.00 . B B . 12 PHE N 1 1 7 4905 2 1 12 PHE O O -2.678 2.572 -1.803 1.00 . B B . 12 PHE O 1 1 7 4906 2 1 13 GLY C C -2.476 0.655 -3.777 1.00 . B B . 13 GLY C 1 1 7 4907 2 1 13 GLY CA C -1.899 0.091 -2.480 1.00 . B B . 13 GLY CA 1 1 7 4908 2 1 13 GLY H H -3.172 -0.280 -0.783 1.00 . B B . 13 GLY H 1 1 7 4909 2 1 13 GLY HA2 H -0.924 0.519 -2.300 1.00 . B B . 13 GLY HA2 1 1 7 4910 2 1 13 GLY HA3 H -1.814 -0.982 -2.565 1.00 . B B . 13 GLY HA3 1 1 7 4911 2 1 13 GLY N N -2.806 0.431 -1.349 1.00 . B B . 13 GLY N 1 1 7 4912 2 1 13 GLY O O -1.754 1.079 -4.658 1.00 . B B . 13 GLY O 1 1 7 4913 2 1 14 LYS C C -4.694 2.685 -4.994 1.00 . B B . 14 LYS C 1 1 7 4914 2 1 14 LYS CA C -4.398 1.190 -5.150 1.00 . B B . 14 LYS CA 1 1 7 4915 2 1 14 LYS CB C -5.707 0.440 -5.415 1.00 . B B . 14 LYS CB 1 1 7 4916 2 1 14 LYS CD C -5.081 -1.174 -7.220 1.00 . B B . 14 LYS CD 1 1 7 4917 2 1 14 LYS CE C -5.029 -2.659 -7.589 1.00 . B B . 14 LYS CE 1 1 7 4918 2 1 14 LYS CG C -5.403 -1.025 -5.731 1.00 . B B . 14 LYS CG 1 1 7 4919 2 1 14 LYS H H -4.340 0.307 -3.184 1.00 . B B . 14 LYS H 1 1 7 4920 2 1 14 LYS HA H -3.724 1.041 -5.979 1.00 . B B . 14 LYS HA 1 1 7 4921 2 1 14 LYS HB2 H -6.337 0.498 -4.538 1.00 . B B . 14 LYS HB2 1 1 7 4922 2 1 14 LYS HB3 H -6.215 0.890 -6.254 1.00 . B B . 14 LYS HB3 1 1 7 4923 2 1 14 LYS HD2 H -5.846 -0.683 -7.803 1.00 . B B . 14 LYS HD2 1 1 7 4924 2 1 14 LYS HD3 H -4.122 -0.721 -7.426 1.00 . B B . 14 LYS HD3 1 1 7 4925 2 1 14 LYS HE2 H -4.573 -2.773 -8.562 1.00 . B B . 14 LYS HE2 1 1 7 4926 2 1 14 LYS HE3 H -4.444 -3.192 -6.854 1.00 . B B . 14 LYS HE3 1 1 7 4927 2 1 14 LYS HG2 H -4.555 -1.351 -5.144 1.00 . B B . 14 LYS HG2 1 1 7 4928 2 1 14 LYS HG3 H -6.262 -1.631 -5.487 1.00 . B B . 14 LYS HG3 1 1 7 4929 2 1 14 LYS HZ1 H -6.581 -3.670 -8.541 1.00 . B B . 14 LYS HZ1 1 1 7 4930 2 1 14 LYS HZ2 H -7.099 -2.447 -7.482 1.00 . B B . 14 LYS HZ2 1 1 7 4931 2 1 14 LYS HZ3 H -6.521 -3.920 -6.866 1.00 . B B . 14 LYS HZ3 1 1 7 4932 2 1 14 LYS N N -3.774 0.659 -3.905 1.00 . B B . 14 LYS N 1 1 7 4933 2 1 14 LYS NZ N -6.412 -3.216 -7.621 1.00 . B B . 14 LYS NZ 1 1 7 4934 2 1 14 LYS O O -4.703 3.427 -5.957 1.00 . B B . 14 LYS O 1 1 7 4935 2 1 15 ALA C C -3.945 5.352 -3.329 1.00 . B B . 15 ALA C 1 1 7 4936 2 1 15 ALA CA C -5.242 4.583 -3.594 1.00 . B B . 15 ALA CA 1 1 7 4937 2 1 15 ALA CB C -6.180 4.748 -2.396 1.00 . B B . 15 ALA CB 1 1 7 4938 2 1 15 ALA H H -4.936 2.525 -3.030 1.00 . B B . 15 ALA H 1 1 7 4939 2 1 15 ALA HA H -5.720 4.977 -4.479 1.00 . B B . 15 ALA HA 1 1 7 4940 2 1 15 ALA HB1 H -6.375 5.797 -2.234 1.00 . B B . 15 ALA HB1 1 1 7 4941 2 1 15 ALA HB2 H -5.715 4.329 -1.516 1.00 . B B . 15 ALA HB2 1 1 7 4942 2 1 15 ALA HB3 H -7.109 4.233 -2.593 1.00 . B B . 15 ALA HB3 1 1 7 4943 2 1 15 ALA N N -4.941 3.136 -3.795 1.00 . B B . 15 ALA N 1 1 7 4944 2 1 15 ALA O O -3.706 6.400 -3.894 1.00 . B B . 15 ALA O 1 1 7 4945 2 1 16 TRP C C -0.972 5.604 -3.428 1.00 . B B . 16 TRP C 1 1 7 4946 2 1 16 TRP CA C -1.832 5.531 -2.162 1.00 . B B . 16 TRP CA 1 1 7 4947 2 1 16 TRP CB C -1.114 4.769 -1.033 1.00 . B B . 16 TRP CB 1 1 7 4948 2 1 16 TRP CD1 C -0.043 2.514 -1.475 1.00 . B B . 16 TRP CD1 1 1 7 4949 2 1 16 TRP CD2 C 1.159 4.225 -2.278 1.00 . B B . 16 TRP CD2 1 1 7 4950 2 1 16 TRP CE2 C 1.870 3.050 -2.608 1.00 . B B . 16 TRP CE2 1 1 7 4951 2 1 16 TRP CE3 C 1.693 5.456 -2.663 1.00 . B B . 16 TRP CE3 1 1 7 4952 2 1 16 TRP CG C -0.052 3.861 -1.576 1.00 . B B . 16 TRP CG 1 1 7 4953 2 1 16 TRP CH2 C 3.599 4.341 -3.679 1.00 . B B . 16 TRP CH2 1 1 7 4954 2 1 16 TRP CZ2 C 3.079 3.100 -3.301 1.00 . B B . 16 TRP CZ2 1 1 7 4955 2 1 16 TRP CZ3 C 2.905 5.516 -3.358 1.00 . B B . 16 TRP CZ3 1 1 7 4956 2 1 16 TRP H H -3.320 3.993 -2.027 1.00 . B B . 16 TRP H 1 1 7 4957 2 1 16 TRP HA H -2.044 6.534 -1.827 1.00 . B B . 16 TRP HA 1 1 7 4958 2 1 16 TRP HB2 H -0.659 5.479 -0.361 1.00 . B B . 16 TRP HB2 1 1 7 4959 2 1 16 TRP HB3 H -1.839 4.181 -0.488 1.00 . B B . 16 TRP HB3 1 1 7 4960 2 1 16 TRP HD1 H -0.800 1.918 -0.995 1.00 . B B . 16 TRP HD1 1 1 7 4961 2 1 16 TRP HE1 H 1.337 1.084 -2.174 1.00 . B B . 16 TRP HE1 1 1 7 4962 2 1 16 TRP HE3 H 1.159 6.365 -2.416 1.00 . B B . 16 TRP HE3 1 1 7 4963 2 1 16 TRP HH2 H 4.532 4.395 -4.220 1.00 . B B . 16 TRP HH2 1 1 7 4964 2 1 16 TRP HZ2 H 3.607 2.190 -3.544 1.00 . B B . 16 TRP HZ2 1 1 7 4965 2 1 16 TRP HZ3 H 3.304 6.469 -3.647 1.00 . B B . 16 TRP HZ3 1 1 7 4966 2 1 16 TRP N N -3.109 4.838 -2.472 1.00 . B B . 16 TRP N 1 1 7 4967 2 1 16 TRP NE1 N 1.095 2.028 -2.097 1.00 . B B . 16 TRP NE1 1 1 7 4968 2 1 16 TRP O O -0.437 6.640 -3.765 1.00 . B B . 16 TRP O 1 1 7 4969 2 1 17 VAL C C -0.737 5.412 -6.400 1.00 . B B . 17 VAL C 1 1 7 4970 2 1 17 VAL CA C 0.005 4.567 -5.362 1.00 . B B . 17 VAL CA 1 1 7 4971 2 1 17 VAL CB C 0.271 3.133 -5.866 1.00 . B B . 17 VAL CB 1 1 7 4972 2 1 17 VAL CG1 C -0.516 2.835 -7.152 1.00 . B B . 17 VAL CG1 1 1 7 4973 2 1 17 VAL CG2 C 1.768 2.973 -6.142 1.00 . B B . 17 VAL CG2 1 1 7 4974 2 1 17 VAL H H -1.253 3.683 -3.852 1.00 . B B . 17 VAL H 1 1 7 4975 2 1 17 VAL HA H 0.944 5.052 -5.129 1.00 . B B . 17 VAL HA 1 1 7 4976 2 1 17 VAL HB H -0.025 2.430 -5.103 1.00 . B B . 17 VAL HB 1 1 7 4977 2 1 17 VAL HG11 H -0.205 3.517 -7.929 1.00 . B B . 17 VAL HG11 1 1 7 4978 2 1 17 VAL HG12 H -1.571 2.961 -6.964 1.00 . B B . 17 VAL HG12 1 1 7 4979 2 1 17 VAL HG13 H -0.323 1.819 -7.464 1.00 . B B . 17 VAL HG13 1 1 7 4980 2 1 17 VAL HG21 H 2.180 2.235 -5.469 1.00 . B B . 17 VAL HG21 1 1 7 4981 2 1 17 VAL HG22 H 2.266 3.919 -5.987 1.00 . B B . 17 VAL HG22 1 1 7 4982 2 1 17 VAL HG23 H 1.915 2.651 -7.163 1.00 . B B . 17 VAL HG23 1 1 7 4983 2 1 17 VAL N N -0.824 4.519 -4.131 1.00 . B B . 17 VAL N 1 1 7 4984 2 1 17 VAL O O -0.186 6.323 -6.983 1.00 . B B . 17 VAL O 1 1 7 4985 2 1 18 GLY C C -2.636 7.445 -7.132 1.00 . B B . 18 GLY C 1 1 7 4986 2 1 18 GLY CA C -2.766 5.983 -7.566 1.00 . B B . 18 GLY CA 1 1 7 4987 2 1 18 GLY H H -2.443 4.438 -6.100 1.00 . B B . 18 GLY H 1 1 7 4988 2 1 18 GLY HA2 H -2.361 5.855 -8.562 1.00 . B B . 18 GLY HA2 1 1 7 4989 2 1 18 GLY HA3 H -3.806 5.694 -7.553 1.00 . B B . 18 GLY HA3 1 1 7 4990 2 1 18 GLY N N -1.998 5.152 -6.602 1.00 . B B . 18 GLY N 1 1 7 4991 2 1 18 GLY O O -2.888 8.360 -7.891 1.00 . B B . 18 GLY O 1 1 7 4992 2 1 19 GLU C C -0.634 9.487 -5.738 1.00 . B B . 19 GLU C 1 1 7 4993 2 1 19 GLU CA C -2.046 9.035 -5.391 1.00 . B B . 19 GLU CA 1 1 7 4994 2 1 19 GLU CB C -2.221 9.007 -3.864 1.00 . B B . 19 GLU CB 1 1 7 4995 2 1 19 GLU CD C -1.739 11.460 -3.942 1.00 . B B . 19 GLU CD 1 1 7 4996 2 1 19 GLU CG C -1.442 10.150 -3.212 1.00 . B B . 19 GLU CG 1 1 7 4997 2 1 19 GLU H H -2.017 6.912 -5.322 1.00 . B B . 19 GLU H 1 1 7 4998 2 1 19 GLU HA H -2.767 9.698 -5.838 1.00 . B B . 19 GLU HA 1 1 7 4999 2 1 19 GLU HB2 H -3.269 9.100 -3.620 1.00 . B B . 19 GLU HB2 1 1 7 5000 2 1 19 GLU HB3 H -1.843 8.066 -3.484 1.00 . B B . 19 GLU HB3 1 1 7 5001 2 1 19 GLU HG2 H -1.732 10.237 -2.176 1.00 . B B . 19 GLU HG2 1 1 7 5002 2 1 19 GLU HG3 H -0.385 9.935 -3.272 1.00 . B B . 19 GLU HG3 1 1 7 5003 2 1 19 GLU N N -2.225 7.662 -5.908 1.00 . B B . 19 GLU N 1 1 7 5004 2 1 19 GLU O O -0.425 10.327 -6.590 1.00 . B B . 19 GLU O 1 1 7 5005 2 1 19 GLU OE1 O -2.905 11.740 -4.167 1.00 . B B . 19 GLU OE1 1 1 7 5006 2 1 19 GLU OE2 O -0.795 12.165 -4.262 1.00 . B B . 19 GLU OE2 1 1 7 5007 2 1 20 ILE C C 2.157 8.800 -6.723 1.00 . B B . 20 ILE C 1 1 7 5008 2 1 20 ILE CA C 1.735 9.333 -5.354 1.00 . B B . 20 ILE CA 1 1 7 5009 2 1 20 ILE CB C 2.640 8.744 -4.282 1.00 . B B . 20 ILE CB 1 1 7 5010 2 1 20 ILE CD1 C 2.962 8.659 -1.809 1.00 . B B . 20 ILE CD1 1 1 7 5011 2 1 20 ILE CG1 C 2.445 9.505 -2.973 1.00 . B B . 20 ILE CG1 1 1 7 5012 2 1 20 ILE CG2 C 4.104 8.846 -4.720 1.00 . B B . 20 ILE CG2 1 1 7 5013 2 1 20 ILE H H 0.144 8.256 -4.376 1.00 . B B . 20 ILE H 1 1 7 5014 2 1 20 ILE HA H 1.805 10.402 -5.342 1.00 . B B . 20 ILE HA 1 1 7 5015 2 1 20 ILE HB H 2.375 7.714 -4.140 1.00 . B B . 20 ILE HB 1 1 7 5016 2 1 20 ILE HD11 H 3.876 9.089 -1.430 1.00 . B B . 20 ILE HD11 1 1 7 5017 2 1 20 ILE HD12 H 3.154 7.653 -2.153 1.00 . B B . 20 ILE HD12 1 1 7 5018 2 1 20 ILE HD13 H 2.221 8.633 -1.023 1.00 . B B . 20 ILE HD13 1 1 7 5019 2 1 20 ILE HG12 H 2.991 10.437 -3.015 1.00 . B B . 20 ILE HG12 1 1 7 5020 2 1 20 ILE HG13 H 1.394 9.705 -2.831 1.00 . B B . 20 ILE HG13 1 1 7 5021 2 1 20 ILE HG21 H 4.299 9.838 -5.099 1.00 . B B . 20 ILE HG21 1 1 7 5022 2 1 20 ILE HG22 H 4.298 8.119 -5.495 1.00 . B B . 20 ILE HG22 1 1 7 5023 2 1 20 ILE HG23 H 4.747 8.650 -3.874 1.00 . B B . 20 ILE HG23 1 1 7 5024 2 1 20 ILE N N 0.337 8.934 -5.072 1.00 . B B . 20 ILE N 1 1 7 5025 2 1 20 ILE O O 2.713 9.509 -7.537 1.00 . B B . 20 ILE O 1 1 7 5026 2 1 21 MET C C 1.652 7.749 -9.419 1.00 . B B . 21 MET C 1 1 7 5027 2 1 21 MET CA C 2.293 6.952 -8.282 1.00 . B B . 21 MET CA 1 1 7 5028 2 1 21 MET CB C 1.812 5.503 -8.337 1.00 . B B . 21 MET CB 1 1 7 5029 2 1 21 MET CE C 1.841 3.491 -11.101 1.00 . B B . 21 MET CE 1 1 7 5030 2 1 21 MET CG C 2.930 4.611 -8.875 1.00 . B B . 21 MET CG 1 1 7 5031 2 1 21 MET H H 1.457 6.994 -6.300 1.00 . B B . 21 MET H 1 1 7 5032 2 1 21 MET HA H 3.368 6.978 -8.383 1.00 . B B . 21 MET HA 1 1 7 5033 2 1 21 MET HB2 H 1.541 5.182 -7.340 1.00 . B B . 21 MET HB2 1 1 7 5034 2 1 21 MET HB3 H 0.952 5.434 -8.987 1.00 . B B . 21 MET HB3 1 1 7 5035 2 1 21 MET HE1 H 2.368 2.646 -11.522 1.00 . B B . 21 MET HE1 1 1 7 5036 2 1 21 MET HE2 H 1.138 3.871 -11.827 1.00 . B B . 21 MET HE2 1 1 7 5037 2 1 21 MET HE3 H 1.309 3.185 -10.212 1.00 . B B . 21 MET HE3 1 1 7 5038 2 1 21 MET HG2 H 3.871 4.903 -8.430 1.00 . B B . 21 MET HG2 1 1 7 5039 2 1 21 MET HG3 H 2.717 3.579 -8.627 1.00 . B B . 21 MET HG3 1 1 7 5040 2 1 21 MET N N 1.903 7.547 -6.975 1.00 . B B . 21 MET N 1 1 7 5041 2 1 21 MET O O 2.082 7.683 -10.554 1.00 . B B . 21 MET O 1 1 7 5042 2 1 21 MET SD S 3.030 4.788 -10.674 1.00 . B B . 21 MET SD 1 1 7 5043 2 1 22 ASN C C 0.908 10.420 -10.648 1.00 . B B . 22 ASN C 1 1 7 5044 2 1 22 ASN CA C -0.033 9.300 -10.200 1.00 . B B . 22 ASN CA 1 1 7 5045 2 1 22 ASN CB C -1.330 9.908 -9.661 1.00 . B B . 22 ASN CB 1 1 7 5046 2 1 22 ASN CG C -2.527 9.231 -10.333 1.00 . B B . 22 ASN CG 1 1 7 5047 2 1 22 ASN H H 0.291 8.544 -8.207 1.00 . B B . 22 ASN H 1 1 7 5048 2 1 22 ASN HA H -0.256 8.659 -11.040 1.00 . B B . 22 ASN HA 1 1 7 5049 2 1 22 ASN HB2 H -1.382 9.755 -8.592 1.00 . B B . 22 ASN HB2 1 1 7 5050 2 1 22 ASN HB3 H -1.349 10.966 -9.878 1.00 . B B . 22 ASN HB3 1 1 7 5051 2 1 22 ASN HD21 H -1.660 7.443 -10.387 1.00 . B B . 22 ASN HD21 1 1 7 5052 2 1 22 ASN HD22 H -3.234 7.514 -11.040 1.00 . B B . 22 ASN HD22 1 1 7 5053 2 1 22 ASN N N 0.626 8.503 -9.129 1.00 . B B . 22 ASN N 1 1 7 5054 2 1 22 ASN ND2 N -2.469 7.957 -10.610 1.00 . B B . 22 ASN ND2 1 1 7 5055 2 1 22 ASN O O 1.299 10.494 -11.797 1.00 . B B . 22 ASN O 1 1 7 5056 2 1 22 ASN OD1 O -3.525 9.867 -10.607 1.00 . B B . 22 ASN OD1 1 1 7 5057 2 1 23 SER C C 3.527 11.831 -10.605 1.00 . B B . 23 SER C 1 1 7 5058 2 1 23 SER CA C 2.194 12.406 -10.123 1.00 . B B . 23 SER CA 1 1 7 5059 2 1 23 SER CB C 2.433 13.296 -8.903 1.00 . B B . 23 SER CB 1 1 7 5060 2 1 23 SER H H 0.951 11.213 -8.828 1.00 . B B . 23 SER H 1 1 7 5061 2 1 23 SER HA H 1.746 12.991 -10.912 1.00 . B B . 23 SER HA 1 1 7 5062 2 1 23 SER HB2 H 2.490 12.686 -8.016 1.00 . B B . 23 SER HB2 1 1 7 5063 2 1 23 SER HB3 H 3.365 13.833 -9.027 1.00 . B B . 23 SER HB3 1 1 7 5064 2 1 23 SER HG H 0.619 13.753 -8.364 1.00 . B B . 23 SER HG 1 1 7 5065 2 1 23 SER N N 1.277 11.291 -9.749 1.00 . B B . 23 SER N 1 1 7 5066 2 1 23 SER O O 4.059 10.970 -9.924 1.00 . B B . 23 SER O 1 1 7 5067 2 1 23 SER OXT O 3.992 12.262 -11.648 1.00 . B B . 23 SER OXT 1 1 7 5068 2 1 23 SER OG O 1.356 14.214 -8.771 1.00 . B B . 23 SER OG 1 1 8 5069 1 1 1 GLY C C -6.975 13.398 3.088 1.00 . A A . 1 GLY C 1 1 8 5070 1 1 1 GLY CA C -8.477 13.557 3.324 1.00 . A A . 1 GLY CA 1 1 8 5071 1 1 1 GLY H1 H -9.011 15.169 2.120 1.00 . A A . 1 GLY H1 1 1 8 5072 1 1 1 GLY H2 H -10.125 13.888 2.096 1.00 . A A . 1 GLY H2 1 1 8 5073 1 1 1 GLY H3 H -8.653 13.753 1.259 1.00 . A A . 1 GLY H3 1 1 8 5074 1 1 1 GLY HA2 H -8.643 14.218 4.164 1.00 . A A . 1 GLY HA2 1 1 8 5075 1 1 1 GLY HA3 H -8.911 12.591 3.533 1.00 . A A . 1 GLY HA3 1 1 8 5076 1 1 1 GLY N N -9.115 14.135 2.108 1.00 . A A . 1 GLY N 1 1 8 5077 1 1 1 GLY O O -6.197 14.293 3.349 1.00 . A A . 1 GLY O 1 1 8 5078 1 1 2 ILE C C -4.333 12.194 3.655 1.00 . A A . 2 ILE C 1 1 8 5079 1 1 2 ILE CA C -5.108 12.043 2.346 1.00 . A A . 2 ILE CA 1 1 8 5080 1 1 2 ILE CB C -4.596 13.069 1.336 1.00 . A A . 2 ILE CB 1 1 8 5081 1 1 2 ILE CD1 C -5.394 11.459 -0.398 1.00 . A A . 2 ILE CD1 1 1 8 5082 1 1 2 ILE CG1 C -5.376 12.928 0.030 1.00 . A A . 2 ILE CG1 1 1 8 5083 1 1 2 ILE CG2 C -3.111 12.823 1.070 1.00 . A A . 2 ILE CG2 1 1 8 5084 1 1 2 ILE H H -7.205 11.551 2.394 1.00 . A A . 2 ILE H 1 1 8 5085 1 1 2 ILE HA H -4.958 11.047 1.953 1.00 . A A . 2 ILE HA 1 1 8 5086 1 1 2 ILE HB H -4.732 14.065 1.735 1.00 . A A . 2 ILE HB 1 1 8 5087 1 1 2 ILE HD11 H -4.512 10.963 -0.021 1.00 . A A . 2 ILE HD11 1 1 8 5088 1 1 2 ILE HD12 H -5.408 11.398 -1.476 1.00 . A A . 2 ILE HD12 1 1 8 5089 1 1 2 ILE HD13 H -6.275 10.978 0.001 1.00 . A A . 2 ILE HD13 1 1 8 5090 1 1 2 ILE HG12 H -6.390 13.273 0.177 1.00 . A A . 2 ILE HG12 1 1 8 5091 1 1 2 ILE HG13 H -4.899 13.518 -0.739 1.00 . A A . 2 ILE HG13 1 1 8 5092 1 1 2 ILE HG21 H -2.801 11.920 1.575 1.00 . A A . 2 ILE HG21 1 1 8 5093 1 1 2 ILE HG22 H -2.535 13.659 1.440 1.00 . A A . 2 ILE HG22 1 1 8 5094 1 1 2 ILE HG23 H -2.949 12.716 0.008 1.00 . A A . 2 ILE HG23 1 1 8 5095 1 1 2 ILE N N -6.561 12.262 2.597 1.00 . A A . 2 ILE N 1 1 8 5096 1 1 2 ILE O O -3.668 13.185 3.884 1.00 . A A . 2 ILE O 1 1 8 5097 1 1 3 GLY C C -3.173 9.905 6.184 1.00 . A A . 3 GLY C 1 1 8 5098 1 1 3 GLY CA C -3.671 11.297 5.801 1.00 . A A . 3 GLY CA 1 1 8 5099 1 1 3 GLY H H -4.947 10.425 4.303 1.00 . A A . 3 GLY H 1 1 8 5100 1 1 3 GLY HA2 H -2.824 11.960 5.686 1.00 . A A . 3 GLY HA2 1 1 8 5101 1 1 3 GLY HA3 H -4.325 11.670 6.572 1.00 . A A . 3 GLY HA3 1 1 8 5102 1 1 3 GLY N N -4.409 11.216 4.511 1.00 . A A . 3 GLY N 1 1 8 5103 1 1 3 GLY O O -2.749 9.665 7.297 1.00 . A A . 3 GLY O 1 1 8 5104 1 1 4 LYS C C -1.916 7.136 4.344 1.00 . A A . 4 LYS C 1 1 8 5105 1 1 4 LYS CA C -2.728 7.612 5.546 1.00 . A A . 4 LYS CA 1 1 8 5106 1 1 4 LYS CB C -3.909 6.659 5.781 1.00 . A A . 4 LYS CB 1 1 8 5107 1 1 4 LYS CD C -6.359 6.505 6.256 1.00 . A A . 4 LYS CD 1 1 8 5108 1 1 4 LYS CE C -6.194 6.211 7.747 1.00 . A A . 4 LYS CE 1 1 8 5109 1 1 4 LYS CG C -5.233 7.432 5.790 1.00 . A A . 4 LYS CG 1 1 8 5110 1 1 4 LYS H H -3.546 9.212 4.368 1.00 . A A . 4 LYS H 1 1 8 5111 1 1 4 LYS HA H -2.096 7.629 6.422 1.00 . A A . 4 LYS HA 1 1 8 5112 1 1 4 LYS HB2 H -3.932 5.921 4.994 1.00 . A A . 4 LYS HB2 1 1 8 5113 1 1 4 LYS HB3 H -3.779 6.165 6.731 1.00 . A A . 4 LYS HB3 1 1 8 5114 1 1 4 LYS HD2 H -7.312 6.984 6.085 1.00 . A A . 4 LYS HD2 1 1 8 5115 1 1 4 LYS HD3 H -6.316 5.579 5.701 1.00 . A A . 4 LYS HD3 1 1 8 5116 1 1 4 LYS HE2 H -6.467 5.185 7.944 1.00 . A A . 4 LYS HE2 1 1 8 5117 1 1 4 LYS HE3 H -5.165 6.373 8.035 1.00 . A A . 4 LYS HE3 1 1 8 5118 1 1 4 LYS HG2 H -5.155 8.273 6.464 1.00 . A A . 4 LYS HG2 1 1 8 5119 1 1 4 LYS HG3 H -5.451 7.786 4.794 1.00 . A A . 4 LYS HG3 1 1 8 5120 1 1 4 LYS HZ1 H -7.412 6.628 9.385 1.00 . A A . 4 LYS HZ1 1 1 8 5121 1 1 4 LYS HZ2 H -7.894 7.397 7.950 1.00 . A A . 4 LYS HZ2 1 1 8 5122 1 1 4 LYS HZ3 H -6.545 7.967 8.810 1.00 . A A . 4 LYS HZ3 1 1 8 5123 1 1 4 LYS N N -3.210 8.990 5.260 1.00 . A A . 4 LYS N 1 1 8 5124 1 1 4 LYS NZ N -7.078 7.119 8.532 1.00 . A A . 4 LYS NZ 1 1 8 5125 1 1 4 LYS O O -0.880 6.517 4.484 1.00 . A A . 4 LYS O 1 1 8 5126 1 1 5 TYR C C -0.289 7.728 1.911 1.00 . A A . 5 TYR C 1 1 8 5127 1 1 5 TYR CA C -1.641 7.028 1.943 1.00 . A A . 5 TYR CA 1 1 8 5128 1 1 5 TYR CB C -2.447 7.430 0.716 1.00 . A A . 5 TYR CB 1 1 8 5129 1 1 5 TYR CD1 C -4.232 5.645 0.669 1.00 . A A . 5 TYR CD1 1 1 8 5130 1 1 5 TYR CD2 C -4.859 7.912 1.262 1.00 . A A . 5 TYR CD2 1 1 8 5131 1 1 5 TYR CE1 C -5.562 5.237 0.827 1.00 . A A . 5 TYR CE1 1 1 8 5132 1 1 5 TYR CE2 C -6.189 7.502 1.421 1.00 . A A . 5 TYR CE2 1 1 8 5133 1 1 5 TYR CG C -3.881 6.985 0.886 1.00 . A A . 5 TYR CG 1 1 8 5134 1 1 5 TYR CZ C -6.540 6.165 1.203 1.00 . A A . 5 TYR CZ 1 1 8 5135 1 1 5 TYR H H -3.209 7.944 3.071 1.00 . A A . 5 TYR H 1 1 8 5136 1 1 5 TYR HA H -1.494 5.966 1.941 1.00 . A A . 5 TYR HA 1 1 8 5137 1 1 5 TYR HB2 H -2.414 8.506 0.601 1.00 . A A . 5 TYR HB2 1 1 8 5138 1 1 5 TYR HB3 H -2.022 6.962 -0.150 1.00 . A A . 5 TYR HB3 1 1 8 5139 1 1 5 TYR HD1 H -3.478 4.927 0.378 1.00 . A A . 5 TYR HD1 1 1 8 5140 1 1 5 TYR HD2 H -4.588 8.945 1.431 1.00 . A A . 5 TYR HD2 1 1 8 5141 1 1 5 TYR HE1 H -5.833 4.205 0.659 1.00 . A A . 5 TYR HE1 1 1 8 5142 1 1 5 TYR HE2 H -6.944 8.218 1.711 1.00 . A A . 5 TYR HE2 1 1 8 5143 1 1 5 TYR HH H -8.046 5.752 2.300 1.00 . A A . 5 TYR HH 1 1 8 5144 1 1 5 TYR N N -2.378 7.437 3.160 1.00 . A A . 5 TYR N 1 1 8 5145 1 1 5 TYR O O 0.625 7.304 1.231 1.00 . A A . 5 TYR O 1 1 8 5146 1 1 5 TYR OH O -7.849 5.761 1.360 1.00 . A A . 5 TYR OH 1 1 8 5147 1 1 6 LEU C C 1.844 9.370 3.962 1.00 . A A . 6 LEU C 1 1 8 5148 1 1 6 LEU CA C 1.137 9.532 2.616 1.00 . A A . 6 LEU CA 1 1 8 5149 1 1 6 LEU CB C 0.861 11.014 2.358 1.00 . A A . 6 LEU CB 1 1 8 5150 1 1 6 LEU CD1 C 2.146 11.466 0.264 1.00 . A A . 6 LEU CD1 1 1 8 5151 1 1 6 LEU CD2 C 0.049 10.105 0.155 1.00 . A A . 6 LEU CD2 1 1 8 5152 1 1 6 LEU CG C 0.747 11.280 0.853 1.00 . A A . 6 LEU CG 1 1 8 5153 1 1 6 LEU H H -0.906 9.146 3.161 1.00 . A A . 6 LEU H 1 1 8 5154 1 1 6 LEU HA H 1.760 9.135 1.829 1.00 . A A . 6 LEU HA 1 1 8 5155 1 1 6 LEU HB2 H -0.067 11.292 2.840 1.00 . A A . 6 LEU HB2 1 1 8 5156 1 1 6 LEU HB3 H 1.666 11.605 2.765 1.00 . A A . 6 LEU HB3 1 1 8 5157 1 1 6 LEU HD11 H 2.652 12.266 0.786 1.00 . A A . 6 LEU HD11 1 1 8 5158 1 1 6 LEU HD12 H 2.066 11.714 -0.783 1.00 . A A . 6 LEU HD12 1 1 8 5159 1 1 6 LEU HD13 H 2.709 10.551 0.377 1.00 . A A . 6 LEU HD13 1 1 8 5160 1 1 6 LEU HD21 H -0.947 9.988 0.556 1.00 . A A . 6 LEU HD21 1 1 8 5161 1 1 6 LEU HD22 H 0.613 9.197 0.322 1.00 . A A . 6 LEU HD22 1 1 8 5162 1 1 6 LEU HD23 H -0.010 10.301 -0.905 1.00 . A A . 6 LEU HD23 1 1 8 5163 1 1 6 LEU HG H 0.173 12.180 0.698 1.00 . A A . 6 LEU HG 1 1 8 5164 1 1 6 LEU N N -0.155 8.806 2.627 1.00 . A A . 6 LEU N 1 1 8 5165 1 1 6 LEU O O 2.902 9.923 4.186 1.00 . A A . 6 LEU O 1 1 8 5166 1 1 7 HIS C C 1.842 6.973 6.610 1.00 . A A . 7 HIS C 1 1 8 5167 1 1 7 HIS CA C 1.928 8.437 6.185 1.00 . A A . 7 HIS CA 1 1 8 5168 1 1 7 HIS CB C 1.230 9.313 7.227 1.00 . A A . 7 HIS CB 1 1 8 5169 1 1 7 HIS CD2 C -0.241 11.350 6.469 1.00 . A A . 7 HIS CD2 1 1 8 5170 1 1 7 HIS CE1 C 1.336 12.597 5.663 1.00 . A A . 7 HIS CE1 1 1 8 5171 1 1 7 HIS CG C 0.933 10.660 6.631 1.00 . A A . 7 HIS CG 1 1 8 5172 1 1 7 HIS H H 0.419 8.181 4.669 1.00 . A A . 7 HIS H 1 1 8 5173 1 1 7 HIS HA H 2.965 8.726 6.112 1.00 . A A . 7 HIS HA 1 1 8 5174 1 1 7 HIS HB2 H 0.307 8.841 7.531 1.00 . A A . 7 HIS HB2 1 1 8 5175 1 1 7 HIS HB3 H 1.874 9.433 8.085 1.00 . A A . 7 HIS HB3 1 1 8 5176 1 1 7 HIS HD1 H 2.883 11.268 6.072 1.00 . A A . 7 HIS HD1 1 1 8 5177 1 1 7 HIS HD2 H -1.216 10.993 6.768 1.00 . A A . 7 HIS HD2 1 1 8 5178 1 1 7 HIS HE1 H 1.866 13.418 5.201 1.00 . A A . 7 HIS HE1 1 1 8 5179 1 1 7 HIS N N 1.273 8.621 4.861 1.00 . A A . 7 HIS N 1 1 8 5180 1 1 7 HIS ND1 N 1.926 11.473 6.109 1.00 . A A . 7 HIS ND1 1 1 8 5181 1 1 7 HIS NE2 N 0.014 12.573 5.858 1.00 . A A . 7 HIS NE2 1 1 8 5182 1 1 7 HIS O O 2.091 6.636 7.751 1.00 . A A . 7 HIS O 1 1 8 5183 1 1 8 SER C C 1.352 3.792 4.834 1.00 . A A . 8 SER C 1 1 8 5184 1 1 8 SER CA C 1.407 4.659 6.085 1.00 . A A . 8 SER CA 1 1 8 5185 1 1 8 SER CB C 0.152 4.426 6.925 1.00 . A A . 8 SER CB 1 1 8 5186 1 1 8 SER H H 1.301 6.379 4.791 1.00 . A A . 8 SER H 1 1 8 5187 1 1 8 SER HA H 2.278 4.391 6.655 1.00 . A A . 8 SER HA 1 1 8 5188 1 1 8 SER HB2 H -0.713 4.779 6.390 1.00 . A A . 8 SER HB2 1 1 8 5189 1 1 8 SER HB3 H 0.044 3.367 7.123 1.00 . A A . 8 SER HB3 1 1 8 5190 1 1 8 SER HG H -0.247 5.947 8.071 1.00 . A A . 8 SER HG 1 1 8 5191 1 1 8 SER N N 1.497 6.096 5.709 1.00 . A A . 8 SER N 1 1 8 5192 1 1 8 SER O O 1.908 2.713 4.795 1.00 . A A . 8 SER O 1 1 8 5193 1 1 8 SER OG O 0.267 5.139 8.150 1.00 . A A . 8 SER OG 1 1 8 5194 1 1 9 ALA C C 2.044 3.272 2.016 1.00 . A A . 9 ALA C 1 1 8 5195 1 1 9 ALA CA C 0.637 3.428 2.570 1.00 . A A . 9 ALA CA 1 1 8 5196 1 1 9 ALA CB C -0.229 4.121 1.527 1.00 . A A . 9 ALA CB 1 1 8 5197 1 1 9 ALA H H 0.262 5.124 3.846 1.00 . A A . 9 ALA H 1 1 8 5198 1 1 9 ALA HA H 0.225 2.456 2.798 1.00 . A A . 9 ALA HA 1 1 8 5199 1 1 9 ALA HB1 H -0.187 3.559 0.612 1.00 . A A . 9 ALA HB1 1 1 8 5200 1 1 9 ALA HB2 H 0.141 5.128 1.352 1.00 . A A . 9 ALA HB2 1 1 8 5201 1 1 9 ALA HB3 H -1.249 4.164 1.876 1.00 . A A . 9 ALA HB3 1 1 8 5202 1 1 9 ALA N N 0.700 4.247 3.807 1.00 . A A . 9 ALA N 1 1 8 5203 1 1 9 ALA O O 2.603 2.197 2.019 1.00 . A A . 9 ALA O 1 1 8 5204 1 1 10 LYS C C 4.822 3.219 1.627 1.00 . A A . 10 LYS C 1 1 8 5205 1 1 10 LYS CA C 3.992 4.324 0.968 1.00 . A A . 10 LYS CA 1 1 8 5206 1 1 10 LYS CB C 4.671 5.671 1.216 1.00 . A A . 10 LYS CB 1 1 8 5207 1 1 10 LYS CD C 6.549 6.208 -0.340 1.00 . A A . 10 LYS CD 1 1 8 5208 1 1 10 LYS CE C 7.257 7.303 0.461 1.00 . A A . 10 LYS CE 1 1 8 5209 1 1 10 LYS CG C 5.038 6.313 -0.123 1.00 . A A . 10 LYS CG 1 1 8 5210 1 1 10 LYS H H 2.102 5.199 1.559 1.00 . A A . 10 LYS H 1 1 8 5211 1 1 10 LYS HA H 3.935 4.143 -0.095 1.00 . A A . 10 LYS HA 1 1 8 5212 1 1 10 LYS HB2 H 3.997 6.320 1.755 1.00 . A A . 10 LYS HB2 1 1 8 5213 1 1 10 LYS HB3 H 5.567 5.518 1.797 1.00 . A A . 10 LYS HB3 1 1 8 5214 1 1 10 LYS HD2 H 6.893 5.239 -0.009 1.00 . A A . 10 LYS HD2 1 1 8 5215 1 1 10 LYS HD3 H 6.771 6.332 -1.388 1.00 . A A . 10 LYS HD3 1 1 8 5216 1 1 10 LYS HE2 H 6.523 7.900 0.982 1.00 . A A . 10 LYS HE2 1 1 8 5217 1 1 10 LYS HE3 H 7.925 6.848 1.178 1.00 . A A . 10 LYS HE3 1 1 8 5218 1 1 10 LYS HG2 H 4.522 5.800 -0.922 1.00 . A A . 10 LYS HG2 1 1 8 5219 1 1 10 LYS HG3 H 4.748 7.352 -0.116 1.00 . A A . 10 LYS HG3 1 1 8 5220 1 1 10 LYS HZ1 H 7.489 9.023 -0.687 1.00 . A A . 10 LYS HZ1 1 1 8 5221 1 1 10 LYS HZ2 H 8.238 7.646 -1.342 1.00 . A A . 10 LYS HZ2 1 1 8 5222 1 1 10 LYS HZ3 H 8.933 8.443 -0.013 1.00 . A A . 10 LYS HZ3 1 1 8 5223 1 1 10 LYS N N 2.606 4.354 1.541 1.00 . A A . 10 LYS N 1 1 8 5224 1 1 10 LYS NZ N 8.038 8.170 -0.465 1.00 . A A . 10 LYS NZ 1 1 8 5225 1 1 10 LYS O O 5.465 2.434 0.960 1.00 . A A . 10 LYS O 1 1 8 5226 1 1 11 LYS C C 5.183 0.723 3.037 1.00 . A A . 11 LYS C 1 1 8 5227 1 1 11 LYS CA C 5.589 2.077 3.616 1.00 . A A . 11 LYS CA 1 1 8 5228 1 1 11 LYS CB C 5.292 2.105 5.117 1.00 . A A . 11 LYS CB 1 1 8 5229 1 1 11 LYS CD C 6.074 3.278 7.181 1.00 . A A . 11 LYS CD 1 1 8 5230 1 1 11 LYS CE C 7.317 2.397 7.317 1.00 . A A . 11 LYS CE 1 1 8 5231 1 1 11 LYS CG C 5.728 3.450 5.700 1.00 . A A . 11 LYS CG 1 1 8 5232 1 1 11 LYS H H 4.277 3.778 3.455 1.00 . A A . 11 LYS H 1 1 8 5233 1 1 11 LYS HA H 6.644 2.237 3.449 1.00 . A A . 11 LYS HA 1 1 8 5234 1 1 11 LYS HB2 H 4.232 1.970 5.277 1.00 . A A . 11 LYS HB2 1 1 8 5235 1 1 11 LYS HB3 H 5.834 1.310 5.607 1.00 . A A . 11 LYS HB3 1 1 8 5236 1 1 11 LYS HD2 H 6.267 4.247 7.619 1.00 . A A . 11 LYS HD2 1 1 8 5237 1 1 11 LYS HD3 H 5.246 2.811 7.692 1.00 . A A . 11 LYS HD3 1 1 8 5238 1 1 11 LYS HE2 H 7.049 1.469 7.798 1.00 . A A . 11 LYS HE2 1 1 8 5239 1 1 11 LYS HE3 H 7.722 2.192 6.337 1.00 . A A . 11 LYS HE3 1 1 8 5240 1 1 11 LYS HG2 H 6.597 3.809 5.167 1.00 . A A . 11 LYS HG2 1 1 8 5241 1 1 11 LYS HG3 H 4.924 4.164 5.600 1.00 . A A . 11 LYS HG3 1 1 8 5242 1 1 11 LYS HZ1 H 8.001 4.062 8.363 1.00 . A A . 11 LYS HZ1 1 1 8 5243 1 1 11 LYS HZ2 H 9.229 3.169 7.601 1.00 . A A . 11 LYS HZ2 1 1 8 5244 1 1 11 LYS HZ3 H 8.501 2.581 9.019 1.00 . A A . 11 LYS HZ3 1 1 8 5245 1 1 11 LYS N N 4.807 3.143 2.931 1.00 . A A . 11 LYS N 1 1 8 5246 1 1 11 LYS NZ N 8.339 3.106 8.137 1.00 . A A . 11 LYS NZ 1 1 8 5247 1 1 11 LYS O O 5.976 0.032 2.429 1.00 . A A . 11 LYS O 1 1 8 5248 1 1 12 PHE C C 3.442 -0.839 1.126 1.00 . A A . 12 PHE C 1 1 8 5249 1 1 12 PHE CA C 3.483 -0.949 2.650 1.00 . A A . 12 PHE CA 1 1 8 5250 1 1 12 PHE CB C 2.080 -1.258 3.178 1.00 . A A . 12 PHE CB 1 1 8 5251 1 1 12 PHE CD1 C 3.232 -1.210 5.423 1.00 . A A . 12 PHE CD1 1 1 8 5252 1 1 12 PHE CD2 C 0.847 -0.780 5.326 1.00 . A A . 12 PHE CD2 1 1 8 5253 1 1 12 PHE CE1 C 3.205 -1.047 6.812 1.00 . A A . 12 PHE CE1 1 1 8 5254 1 1 12 PHE CE2 C 0.820 -0.616 6.716 1.00 . A A . 12 PHE CE2 1 1 8 5255 1 1 12 PHE CG C 2.053 -1.077 4.679 1.00 . A A . 12 PHE CG 1 1 8 5256 1 1 12 PHE CZ C 2.000 -0.749 7.459 1.00 . A A . 12 PHE CZ 1 1 8 5257 1 1 12 PHE H H 3.320 0.924 3.688 1.00 . A A . 12 PHE H 1 1 8 5258 1 1 12 PHE HA H 4.164 -1.735 2.941 1.00 . A A . 12 PHE HA 1 1 8 5259 1 1 12 PHE HB2 H 1.367 -0.585 2.722 1.00 . A A . 12 PHE HB2 1 1 8 5260 1 1 12 PHE HB3 H 1.820 -2.279 2.935 1.00 . A A . 12 PHE HB3 1 1 8 5261 1 1 12 PHE HD1 H 4.162 -1.439 4.924 1.00 . A A . 12 PHE HD1 1 1 8 5262 1 1 12 PHE HD2 H -0.061 -0.678 4.752 1.00 . A A . 12 PHE HD2 1 1 8 5263 1 1 12 PHE HE1 H 4.115 -1.148 7.386 1.00 . A A . 12 PHE HE1 1 1 8 5264 1 1 12 PHE HE2 H -0.109 -0.386 7.214 1.00 . A A . 12 PHE HE2 1 1 8 5265 1 1 12 PHE HZ H 1.979 -0.623 8.532 1.00 . A A . 12 PHE HZ 1 1 8 5266 1 1 12 PHE N N 3.946 0.348 3.206 1.00 . A A . 12 PHE N 1 1 8 5267 1 1 12 PHE O O 3.704 -1.787 0.414 1.00 . A A . 12 PHE O 1 1 8 5268 1 1 13 GLY C C 4.307 -0.119 -1.489 1.00 . A A . 13 GLY C 1 1 8 5269 1 1 13 GLY CA C 3.063 0.498 -0.857 1.00 . A A . 13 GLY CA 1 1 8 5270 1 1 13 GLY H H 2.914 1.071 1.211 1.00 . A A . 13 GLY H 1 1 8 5271 1 1 13 GLY HA2 H 2.182 0.013 -1.246 1.00 . A A . 13 GLY HA2 1 1 8 5272 1 1 13 GLY HA3 H 3.029 1.551 -1.091 1.00 . A A . 13 GLY HA3 1 1 8 5273 1 1 13 GLY N N 3.118 0.318 0.618 1.00 . A A . 13 GLY N 1 1 8 5274 1 1 13 GLY O O 4.247 -0.718 -2.544 1.00 . A A . 13 GLY O 1 1 8 5275 1 1 14 LYS C C 6.938 -1.936 -0.826 1.00 . A A . 14 LYS C 1 1 8 5276 1 1 14 LYS CA C 6.682 -0.559 -1.429 1.00 . A A . 14 LYS CA 1 1 8 5277 1 1 14 LYS CB C 7.868 0.352 -1.117 1.00 . A A . 14 LYS CB 1 1 8 5278 1 1 14 LYS CD C 9.204 2.259 -2.021 1.00 . A A . 14 LYS CD 1 1 8 5279 1 1 14 LYS CE C 10.073 1.722 -3.159 1.00 . A A . 14 LYS CE 1 1 8 5280 1 1 14 LYS CG C 7.841 1.565 -2.047 1.00 . A A . 14 LYS CG 1 1 8 5281 1 1 14 LYS H H 5.470 0.512 -0.002 1.00 . A A . 14 LYS H 1 1 8 5282 1 1 14 LYS HA H 6.569 -0.655 -2.494 1.00 . A A . 14 LYS HA 1 1 8 5283 1 1 14 LYS HB2 H 7.806 0.680 -0.089 1.00 . A A . 14 LYS HB2 1 1 8 5284 1 1 14 LYS HB3 H 8.787 -0.195 -1.265 1.00 . A A . 14 LYS HB3 1 1 8 5285 1 1 14 LYS HD2 H 9.068 3.324 -2.141 1.00 . A A . 14 LYS HD2 1 1 8 5286 1 1 14 LYS HD3 H 9.690 2.063 -1.077 1.00 . A A . 14 LYS HD3 1 1 8 5287 1 1 14 LYS HE2 H 10.354 0.701 -2.947 1.00 . A A . 14 LYS HE2 1 1 8 5288 1 1 14 LYS HE3 H 9.515 1.757 -4.084 1.00 . A A . 14 LYS HE3 1 1 8 5289 1 1 14 LYS HG2 H 7.621 1.242 -3.054 1.00 . A A . 14 LYS HG2 1 1 8 5290 1 1 14 LYS HG3 H 7.081 2.256 -1.714 1.00 . A A . 14 LYS HG3 1 1 8 5291 1 1 14 LYS HZ1 H 11.421 3.128 -2.425 1.00 . A A . 14 LYS HZ1 1 1 8 5292 1 1 14 LYS HZ2 H 11.203 3.191 -4.108 1.00 . A A . 14 LYS HZ2 1 1 8 5293 1 1 14 LYS HZ3 H 12.127 1.946 -3.415 1.00 . A A . 14 LYS HZ3 1 1 8 5294 1 1 14 LYS N N 5.439 0.022 -0.854 1.00 . A A . 14 LYS N 1 1 8 5295 1 1 14 LYS NZ N 11.298 2.560 -3.287 1.00 . A A . 14 LYS NZ 1 1 8 5296 1 1 14 LYS O O 7.782 -2.678 -1.289 1.00 . A A . 14 LYS O 1 1 8 5297 1 1 15 ALA C C 5.308 -4.561 0.442 1.00 . A A . 15 ALA C 1 1 8 5298 1 1 15 ALA CA C 6.446 -3.613 0.827 1.00 . A A . 15 ALA CA 1 1 8 5299 1 1 15 ALA CB C 6.491 -3.462 2.348 1.00 . A A . 15 ALA CB 1 1 8 5300 1 1 15 ALA H H 5.553 -1.674 0.569 1.00 . A A . 15 ALA H 1 1 8 5301 1 1 15 ALA HA H 7.386 -4.016 0.479 1.00 . A A . 15 ALA HA 1 1 8 5302 1 1 15 ALA HB1 H 6.306 -2.431 2.612 1.00 . A A . 15 ALA HB1 1 1 8 5303 1 1 15 ALA HB2 H 7.465 -3.757 2.710 1.00 . A A . 15 ALA HB2 1 1 8 5304 1 1 15 ALA HB3 H 5.736 -4.089 2.794 1.00 . A A . 15 ALA HB3 1 1 8 5305 1 1 15 ALA N N 6.227 -2.284 0.204 1.00 . A A . 15 ALA N 1 1 8 5306 1 1 15 ALA O O 5.538 -5.651 -0.037 1.00 . A A . 15 ALA O 1 1 8 5307 1 1 16 TRP C C 3.084 -5.535 -1.124 1.00 . A A . 16 TRP C 1 1 8 5308 1 1 16 TRP CA C 2.925 -5.017 0.301 1.00 . A A . 16 TRP CA 1 1 8 5309 1 1 16 TRP CB C 1.618 -4.218 0.453 1.00 . A A . 16 TRP CB 1 1 8 5310 1 1 16 TRP CD1 C 1.309 -2.088 -0.880 1.00 . A A . 16 TRP CD1 1 1 8 5311 1 1 16 TRP CD2 C 0.933 -3.932 -2.093 1.00 . A A . 16 TRP CD2 1 1 8 5312 1 1 16 TRP CE2 C 0.737 -2.837 -2.964 1.00 . A A . 16 TRP CE2 1 1 8 5313 1 1 16 TRP CE3 C 0.759 -5.221 -2.596 1.00 . A A . 16 TRP CE3 1 1 8 5314 1 1 16 TRP CG C 1.309 -3.434 -0.785 1.00 . A A . 16 TRP CG 1 1 8 5315 1 1 16 TRP CH2 C 0.207 -4.323 -4.790 1.00 . A A . 16 TRP CH2 1 1 8 5316 1 1 16 TRP CZ2 C 0.375 -3.023 -4.301 1.00 . A A . 16 TRP CZ2 1 1 8 5317 1 1 16 TRP CZ3 C 0.396 -5.417 -3.939 1.00 . A A . 16 TRP CZ3 1 1 8 5318 1 1 16 TRP H H 3.927 -3.266 1.024 1.00 . A A . 16 TRP H 1 1 8 5319 1 1 16 TRP HA H 2.899 -5.856 0.978 1.00 . A A . 16 TRP HA 1 1 8 5320 1 1 16 TRP HB2 H 0.806 -4.901 0.645 1.00 . A A . 16 TRP HB2 1 1 8 5321 1 1 16 TRP HB3 H 1.715 -3.540 1.287 1.00 . A A . 16 TRP HB3 1 1 8 5322 1 1 16 TRP HD1 H 1.536 -1.403 -0.079 1.00 . A A . 16 TRP HD1 1 1 8 5323 1 1 16 TRP HE1 H 0.916 -0.811 -2.512 1.00 . A A . 16 TRP HE1 1 1 8 5324 1 1 16 TRP HE3 H 0.904 -6.066 -1.937 1.00 . A A . 16 TRP HE3 1 1 8 5325 1 1 16 TRP HH2 H -0.069 -4.484 -5.823 1.00 . A A . 16 TRP HH2 1 1 8 5326 1 1 16 TRP HZ2 H 0.231 -2.172 -4.950 1.00 . A A . 16 TRP HZ2 1 1 8 5327 1 1 16 TRP HZ3 H 0.271 -6.414 -4.319 1.00 . A A . 16 TRP HZ3 1 1 8 5328 1 1 16 TRP N N 4.085 -4.149 0.645 1.00 . A A . 16 TRP N 1 1 8 5329 1 1 16 TRP NE1 N 0.978 -1.729 -2.177 1.00 . A A . 16 TRP NE1 1 1 8 5330 1 1 16 TRP O O 2.842 -6.693 -1.403 1.00 . A A . 16 TRP O 1 1 8 5331 1 1 17 VAL C C 4.586 -6.372 -3.448 1.00 . A A . 17 VAL C 1 1 8 5332 1 1 17 VAL CA C 3.662 -5.155 -3.432 1.00 . A A . 17 VAL CA 1 1 8 5333 1 1 17 VAL CB C 4.228 -4.009 -4.278 1.00 . A A . 17 VAL CB 1 1 8 5334 1 1 17 VAL CG1 C 5.760 -4.019 -4.256 1.00 . A A . 17 VAL CG1 1 1 8 5335 1 1 17 VAL CG2 C 3.733 -4.165 -5.717 1.00 . A A . 17 VAL CG2 1 1 8 5336 1 1 17 VAL H H 3.683 -3.764 -1.791 1.00 . A A . 17 VAL H 1 1 8 5337 1 1 17 VAL HA H 2.703 -5.445 -3.827 1.00 . A A . 17 VAL HA 1 1 8 5338 1 1 17 VAL HB H 3.874 -3.071 -3.878 1.00 . A A . 17 VAL HB 1 1 8 5339 1 1 17 VAL HG11 H 6.107 -3.809 -3.255 1.00 . A A . 17 VAL HG11 1 1 8 5340 1 1 17 VAL HG12 H 6.135 -3.265 -4.931 1.00 . A A . 17 VAL HG12 1 1 8 5341 1 1 17 VAL HG13 H 6.120 -4.990 -4.566 1.00 . A A . 17 VAL HG13 1 1 8 5342 1 1 17 VAL HG21 H 3.451 -3.199 -6.108 1.00 . A A . 17 VAL HG21 1 1 8 5343 1 1 17 VAL HG22 H 2.875 -4.822 -5.730 1.00 . A A . 17 VAL HG22 1 1 8 5344 1 1 17 VAL HG23 H 4.519 -4.586 -6.326 1.00 . A A . 17 VAL HG23 1 1 8 5345 1 1 17 VAL N N 3.490 -4.694 -2.030 1.00 . A A . 17 VAL N 1 1 8 5346 1 1 17 VAL O O 4.256 -7.402 -3.997 1.00 . A A . 17 VAL O 1 1 8 5347 1 1 18 GLY C C 5.939 -8.636 -2.161 1.00 . A A . 18 GLY C 1 1 8 5348 1 1 18 GLY CA C 6.655 -7.439 -2.792 1.00 . A A . 18 GLY CA 1 1 8 5349 1 1 18 GLY H H 5.968 -5.443 -2.366 1.00 . A A . 18 GLY H 1 1 8 5350 1 1 18 GLY HA2 H 6.957 -7.686 -3.801 1.00 . A A . 18 GLY HA2 1 1 8 5351 1 1 18 GLY HA3 H 7.525 -7.193 -2.204 1.00 . A A . 18 GLY HA3 1 1 8 5352 1 1 18 GLY N N 5.728 -6.275 -2.826 1.00 . A A . 18 GLY N 1 1 8 5353 1 1 18 GLY O O 6.389 -9.761 -2.250 1.00 . A A . 18 GLY O 1 1 8 5354 1 1 19 GLU C C 3.029 -10.032 -1.867 1.00 . A A . 19 GLU C 1 1 8 5355 1 1 19 GLU CA C 4.068 -9.509 -0.888 1.00 . A A . 19 GLU CA 1 1 8 5356 1 1 19 GLU CB C 3.339 -8.970 0.345 1.00 . A A . 19 GLU CB 1 1 8 5357 1 1 19 GLU CD C 5.623 -8.917 1.362 1.00 . A A . 19 GLU CD 1 1 8 5358 1 1 19 GLU CG C 4.302 -8.159 1.202 1.00 . A A . 19 GLU CG 1 1 8 5359 1 1 19 GLU H H 4.476 -7.489 -1.465 1.00 . A A . 19 GLU H 1 1 8 5360 1 1 19 GLU HA H 4.739 -10.300 -0.607 1.00 . A A . 19 GLU HA 1 1 8 5361 1 1 19 GLU HB2 H 2.525 -8.327 0.025 1.00 . A A . 19 GLU HB2 1 1 8 5362 1 1 19 GLU HB3 H 2.947 -9.794 0.924 1.00 . A A . 19 GLU HB3 1 1 8 5363 1 1 19 GLU HG2 H 4.482 -7.211 0.723 1.00 . A A . 19 GLU HG2 1 1 8 5364 1 1 19 GLU HG3 H 3.864 -7.992 2.173 1.00 . A A . 19 GLU HG3 1 1 8 5365 1 1 19 GLU N N 4.823 -8.400 -1.525 1.00 . A A . 19 GLU N 1 1 8 5366 1 1 19 GLU O O 3.033 -11.182 -2.257 1.00 . A A . 19 GLU O 1 1 8 5367 1 1 19 GLU OE1 O 5.589 -10.024 1.873 1.00 . A A . 19 GLU OE1 1 1 8 5368 1 1 19 GLU OE2 O 6.644 -8.377 0.970 1.00 . A A . 19 GLU OE2 1 1 8 5369 1 1 20 ILE C C 1.608 -9.706 -4.596 1.00 . A A . 20 ILE C 1 1 8 5370 1 1 20 ILE CA C 1.051 -9.578 -3.178 1.00 . A A . 20 ILE CA 1 1 8 5371 1 1 20 ILE CB C -0.020 -8.488 -3.137 1.00 . A A . 20 ILE CB 1 1 8 5372 1 1 20 ILE CD1 C -2.133 -7.768 -2.026 1.00 . A A . 20 ILE CD1 1 1 8 5373 1 1 20 ILE CG1 C -0.976 -8.768 -1.987 1.00 . A A . 20 ILE CG1 1 1 8 5374 1 1 20 ILE CG2 C -0.802 -8.446 -4.455 1.00 . A A . 20 ILE CG2 1 1 8 5375 1 1 20 ILE H H 2.152 -8.266 -1.894 1.00 . A A . 20 ILE H 1 1 8 5376 1 1 20 ILE HA H 0.627 -10.515 -2.863 1.00 . A A . 20 ILE HA 1 1 8 5377 1 1 20 ILE HB H 0.465 -7.538 -2.969 1.00 . A A . 20 ILE HB 1 1 8 5378 1 1 20 ILE HD11 H -3.058 -8.294 -2.216 1.00 . A A . 20 ILE HD11 1 1 8 5379 1 1 20 ILE HD12 H -1.961 -7.049 -2.813 1.00 . A A . 20 ILE HD12 1 1 8 5380 1 1 20 ILE HD13 H -2.199 -7.255 -1.078 1.00 . A A . 20 ILE HD13 1 1 8 5381 1 1 20 ILE HG12 H -1.359 -9.771 -2.081 1.00 . A A . 20 ILE HG12 1 1 8 5382 1 1 20 ILE HG13 H -0.444 -8.663 -1.054 1.00 . A A . 20 ILE HG13 1 1 8 5383 1 1 20 ILE HG21 H -0.123 -8.213 -5.266 1.00 . A A . 20 ILE HG21 1 1 8 5384 1 1 20 ILE HG22 H -1.567 -7.687 -4.397 1.00 . A A . 20 ILE HG22 1 1 8 5385 1 1 20 ILE HG23 H -1.260 -9.408 -4.634 1.00 . A A . 20 ILE HG23 1 1 8 5386 1 1 20 ILE N N 2.128 -9.181 -2.243 1.00 . A A . 20 ILE N 1 1 8 5387 1 1 20 ILE O O 1.377 -10.682 -5.282 1.00 . A A . 20 ILE O 1 1 8 5388 1 1 21 MET C C 3.866 -9.912 -6.544 1.00 . A A . 21 MET C 1 1 8 5389 1 1 21 MET CA C 2.859 -8.761 -6.427 1.00 . A A . 21 MET CA 1 1 8 5390 1 1 21 MET CB C 3.515 -7.412 -6.753 1.00 . A A . 21 MET CB 1 1 8 5391 1 1 21 MET CE C 5.726 -6.188 -8.719 1.00 . A A . 21 MET CE 1 1 8 5392 1 1 21 MET CG C 5.008 -7.437 -6.418 1.00 . A A . 21 MET CG 1 1 8 5393 1 1 21 MET H H 2.476 -7.930 -4.480 1.00 . A A . 21 MET H 1 1 8 5394 1 1 21 MET HA H 2.044 -8.930 -7.116 1.00 . A A . 21 MET HA 1 1 8 5395 1 1 21 MET HB2 H 3.388 -7.198 -7.805 1.00 . A A . 21 MET HB2 1 1 8 5396 1 1 21 MET HB3 H 3.033 -6.639 -6.168 1.00 . A A . 21 MET HB3 1 1 8 5397 1 1 21 MET HE1 H 5.041 -5.591 -8.134 1.00 . A A . 21 MET HE1 1 1 8 5398 1 1 21 MET HE2 H 5.320 -6.334 -9.707 1.00 . A A . 21 MET HE2 1 1 8 5399 1 1 21 MET HE3 H 6.680 -5.683 -8.795 1.00 . A A . 21 MET HE3 1 1 8 5400 1 1 21 MET HG2 H 5.303 -6.476 -6.022 1.00 . A A . 21 MET HG2 1 1 8 5401 1 1 21 MET HG3 H 5.195 -8.205 -5.680 1.00 . A A . 21 MET HG3 1 1 8 5402 1 1 21 MET N N 2.315 -8.713 -5.046 1.00 . A A . 21 MET N 1 1 8 5403 1 1 21 MET O O 4.224 -10.330 -7.628 1.00 . A A . 21 MET O 1 1 8 5404 1 1 21 MET SD S 5.959 -7.793 -7.916 1.00 . A A . 21 MET SD 1 1 8 5405 1 1 22 ASN C C 4.596 -12.852 -5.077 1.00 . A A . 22 ASN C 1 1 8 5406 1 1 22 ASN CA C 5.297 -11.554 -5.482 1.00 . A A . 22 ASN CA 1 1 8 5407 1 1 22 ASN CB C 6.446 -11.272 -4.512 1.00 . A A . 22 ASN CB 1 1 8 5408 1 1 22 ASN CG C 7.609 -12.220 -4.806 1.00 . A A . 22 ASN CG 1 1 8 5409 1 1 22 ASN H H 4.018 -10.082 -4.569 1.00 . A A . 22 ASN H 1 1 8 5410 1 1 22 ASN HA H 5.688 -11.651 -6.484 1.00 . A A . 22 ASN HA 1 1 8 5411 1 1 22 ASN HB2 H 6.774 -10.249 -4.632 1.00 . A A . 22 ASN HB2 1 1 8 5412 1 1 22 ASN HB3 H 6.105 -11.427 -3.497 1.00 . A A . 22 ASN HB3 1 1 8 5413 1 1 22 ASN HD21 H 7.926 -12.646 -2.890 1.00 . A A . 22 ASN HD21 1 1 8 5414 1 1 22 ASN HD22 H 8.968 -13.424 -3.995 1.00 . A A . 22 ASN HD22 1 1 8 5415 1 1 22 ASN N N 4.321 -10.430 -5.434 1.00 . A A . 22 ASN N 1 1 8 5416 1 1 22 ASN ND2 N 8.218 -12.812 -3.815 1.00 . A A . 22 ASN ND2 1 1 8 5417 1 1 22 ASN O O 4.950 -13.926 -5.522 1.00 . A A . 22 ASN O 1 1 8 5418 1 1 22 ASN OD1 O 7.968 -12.424 -5.948 1.00 . A A . 22 ASN OD1 1 1 8 5419 1 1 23 SER C C 1.758 -14.299 -4.790 1.00 . A A . 23 SER C 1 1 8 5420 1 1 23 SER CA C 2.879 -13.987 -3.798 1.00 . A A . 23 SER CA 1 1 8 5421 1 1 23 SER CB C 2.280 -13.756 -2.410 1.00 . A A . 23 SER CB 1 1 8 5422 1 1 23 SER H H 3.336 -11.884 -3.888 1.00 . A A . 23 SER H 1 1 8 5423 1 1 23 SER HA H 3.567 -14.819 -3.759 1.00 . A A . 23 SER HA 1 1 8 5424 1 1 23 SER HB2 H 1.647 -12.884 -2.429 1.00 . A A . 23 SER HB2 1 1 8 5425 1 1 23 SER HB3 H 1.691 -14.618 -2.126 1.00 . A A . 23 SER HB3 1 1 8 5426 1 1 23 SER HG H 3.142 -12.746 -0.989 1.00 . A A . 23 SER HG 1 1 8 5427 1 1 23 SER N N 3.603 -12.761 -4.234 1.00 . A A . 23 SER N 1 1 8 5428 1 1 23 SER O O 1.494 -13.463 -5.639 1.00 . A A . 23 SER O 1 1 8 5429 1 1 23 SER OXT O 1.180 -15.370 -4.685 1.00 . A A . 23 SER OXT 1 1 8 5430 1 1 23 SER OG O 3.329 -13.552 -1.474 1.00 . A A . 23 SER OG 1 1 8 5431 2 1 1 GLY C C 4.403 -10.202 8.265 1.00 . B B . 1 GLY C 1 1 8 5432 2 1 1 GLY CA C 5.447 -10.389 9.367 1.00 . B B . 1 GLY CA 1 1 8 5433 2 1 1 GLY H1 H 6.825 -10.438 7.807 1.00 . B B . 1 GLY H1 1 1 8 5434 2 1 1 GLY H2 H 7.503 -10.722 9.339 1.00 . B B . 1 GLY H2 1 1 8 5435 2 1 1 GLY H3 H 7.048 -9.148 8.886 1.00 . B B . 1 GLY H3 1 1 8 5436 2 1 1 GLY HA2 H 5.386 -11.396 9.757 1.00 . B B . 1 GLY HA2 1 1 8 5437 2 1 1 GLY HA3 H 5.258 -9.683 10.160 1.00 . B B . 1 GLY HA3 1 1 8 5438 2 1 1 GLY N N 6.809 -10.156 8.807 1.00 . B B . 1 GLY N 1 1 8 5439 2 1 1 GLY O O 4.727 -10.132 7.097 1.00 . B B . 1 GLY O 1 1 8 5440 2 1 2 ILE C C 0.734 -9.747 8.273 1.00 . B B . 2 ILE C 1 1 8 5441 2 1 2 ILE CA C 2.092 -9.938 7.593 1.00 . B B . 2 ILE CA 1 1 8 5442 2 1 2 ILE CB C 2.043 -11.175 6.692 1.00 . B B . 2 ILE CB 1 1 8 5443 2 1 2 ILE CD1 C 1.916 -11.394 4.208 1.00 . B B . 2 ILE CD1 1 1 8 5444 2 1 2 ILE CG1 C 1.199 -10.869 5.453 1.00 . B B . 2 ILE CG1 1 1 8 5445 2 1 2 ILE CG2 C 1.418 -12.344 7.455 1.00 . B B . 2 ILE CG2 1 1 8 5446 2 1 2 ILE H H 2.908 -10.180 9.574 1.00 . B B . 2 ILE H 1 1 8 5447 2 1 2 ILE HA H 2.321 -9.069 6.996 1.00 . B B . 2 ILE HA 1 1 8 5448 2 1 2 ILE HB H 3.047 -11.439 6.390 1.00 . B B . 2 ILE HB 1 1 8 5449 2 1 2 ILE HD11 H 1.580 -12.397 3.996 1.00 . B B . 2 ILE HD11 1 1 8 5450 2 1 2 ILE HD12 H 2.982 -11.400 4.382 1.00 . B B . 2 ILE HD12 1 1 8 5451 2 1 2 ILE HD13 H 1.693 -10.753 3.367 1.00 . B B . 2 ILE HD13 1 1 8 5452 2 1 2 ILE HG12 H 0.236 -11.353 5.546 1.00 . B B . 2 ILE HG12 1 1 8 5453 2 1 2 ILE HG13 H 1.062 -9.801 5.364 1.00 . B B . 2 ILE HG13 1 1 8 5454 2 1 2 ILE HG21 H 1.848 -13.271 7.108 1.00 . B B . 2 ILE HG21 1 1 8 5455 2 1 2 ILE HG22 H 0.351 -12.355 7.283 1.00 . B B . 2 ILE HG22 1 1 8 5456 2 1 2 ILE HG23 H 1.611 -12.228 8.511 1.00 . B B . 2 ILE HG23 1 1 8 5457 2 1 2 ILE N N 3.151 -10.121 8.626 1.00 . B B . 2 ILE N 1 1 8 5458 2 1 2 ILE O O 0.555 -10.071 9.430 1.00 . B B . 2 ILE O 1 1 8 5459 2 1 3 GLY C C -2.122 -7.657 7.703 1.00 . B B . 3 GLY C 1 1 8 5460 2 1 3 GLY CA C -1.575 -9.010 8.151 1.00 . B B . 3 GLY CA 1 1 8 5461 2 1 3 GLY H H -0.055 -8.973 6.626 1.00 . B B . 3 GLY H 1 1 8 5462 2 1 3 GLY HA2 H -2.236 -9.790 7.804 1.00 . B B . 3 GLY HA2 1 1 8 5463 2 1 3 GLY HA3 H -1.510 -9.035 9.225 1.00 . B B . 3 GLY HA3 1 1 8 5464 2 1 3 GLY N N -0.223 -9.224 7.558 1.00 . B B . 3 GLY N 1 1 8 5465 2 1 3 GLY O O -3.278 -7.341 7.908 1.00 . B B . 3 GLY O 1 1 8 5466 2 1 4 LYS C C -1.395 -5.438 5.110 1.00 . B B . 4 LYS C 1 1 8 5467 2 1 4 LYS CA C -1.782 -5.549 6.580 1.00 . B B . 4 LYS CA 1 1 8 5468 2 1 4 LYS CB C -1.136 -4.419 7.383 1.00 . B B . 4 LYS CB 1 1 8 5469 2 1 4 LYS CD C 0.672 -3.891 9.028 1.00 . B B . 4 LYS CD 1 1 8 5470 2 1 4 LYS CE C -0.113 -4.144 10.317 1.00 . B B . 4 LYS CE 1 1 8 5471 2 1 4 LYS CG C 0.213 -4.874 7.948 1.00 . B B . 4 LYS CG 1 1 8 5472 2 1 4 LYS H H -0.387 -7.149 6.905 1.00 . B B . 4 LYS H 1 1 8 5473 2 1 4 LYS HA H -2.857 -5.495 6.674 1.00 . B B . 4 LYS HA 1 1 8 5474 2 1 4 LYS HB2 H -0.987 -3.566 6.738 1.00 . B B . 4 LYS HB2 1 1 8 5475 2 1 4 LYS HB3 H -1.791 -4.146 8.196 1.00 . B B . 4 LYS HB3 1 1 8 5476 2 1 4 LYS HD2 H 1.727 -4.028 9.214 1.00 . B B . 4 LYS HD2 1 1 8 5477 2 1 4 LYS HD3 H 0.493 -2.880 8.694 1.00 . B B . 4 LYS HD3 1 1 8 5478 2 1 4 LYS HE2 H -0.530 -5.140 10.293 1.00 . B B . 4 LYS HE2 1 1 8 5479 2 1 4 LYS HE3 H 0.549 -4.052 11.165 1.00 . B B . 4 LYS HE3 1 1 8 5480 2 1 4 LYS HG2 H 0.109 -5.859 8.380 1.00 . B B . 4 LYS HG2 1 1 8 5481 2 1 4 LYS HG3 H 0.945 -4.902 7.156 1.00 . B B . 4 LYS HG3 1 1 8 5482 2 1 4 LYS HZ1 H -1.442 -2.770 9.494 1.00 . B B . 4 LYS HZ1 1 1 8 5483 2 1 4 LYS HZ2 H -0.910 -2.369 11.057 1.00 . B B . 4 LYS HZ2 1 1 8 5484 2 1 4 LYS HZ3 H -2.056 -3.605 10.835 1.00 . B B . 4 LYS HZ3 1 1 8 5485 2 1 4 LYS N N -1.310 -6.868 7.072 1.00 . B B . 4 LYS N 1 1 8 5486 2 1 4 LYS NZ N -1.214 -3.147 10.434 1.00 . B B . 4 LYS NZ 1 1 8 5487 2 1 4 LYS O O -2.146 -4.953 4.290 1.00 . B B . 4 LYS O 1 1 8 5488 2 1 5 TYR C C -0.762 -6.650 2.504 1.00 . B B . 5 TYR C 1 1 8 5489 2 1 5 TYR CA C 0.221 -5.870 3.370 1.00 . B B . 5 TYR CA 1 1 8 5490 2 1 5 TYR CB C 1.600 -6.516 3.295 1.00 . B B . 5 TYR CB 1 1 8 5491 2 1 5 TYR CD1 C 3.033 -4.738 4.370 1.00 . B B . 5 TYR CD1 1 1 8 5492 2 1 5 TYR CD2 C 2.660 -6.818 5.561 1.00 . B B . 5 TYR CD2 1 1 8 5493 2 1 5 TYR CE1 C 3.823 -4.274 5.428 1.00 . B B . 5 TYR CE1 1 1 8 5494 2 1 5 TYR CE2 C 3.450 -6.352 6.619 1.00 . B B . 5 TYR CE2 1 1 8 5495 2 1 5 TYR CG C 2.452 -6.011 4.435 1.00 . B B . 5 TYR CG 1 1 8 5496 2 1 5 TYR CZ C 4.030 -5.080 6.553 1.00 . B B . 5 TYR CZ 1 1 8 5497 2 1 5 TYR H H 0.351 -6.309 5.449 1.00 . B B . 5 TYR H 1 1 8 5498 2 1 5 TYR HA H 0.276 -4.854 3.024 1.00 . B B . 5 TYR HA 1 1 8 5499 2 1 5 TYR HB2 H 1.498 -7.591 3.370 1.00 . B B . 5 TYR HB2 1 1 8 5500 2 1 5 TYR HB3 H 2.064 -6.262 2.363 1.00 . B B . 5 TYR HB3 1 1 8 5501 2 1 5 TYR HD1 H 2.872 -4.114 3.502 1.00 . B B . 5 TYR HD1 1 1 8 5502 2 1 5 TYR HD2 H 2.213 -7.799 5.613 1.00 . B B . 5 TYR HD2 1 1 8 5503 2 1 5 TYR HE1 H 4.272 -3.294 5.376 1.00 . B B . 5 TYR HE1 1 1 8 5504 2 1 5 TYR HE2 H 3.610 -6.974 7.488 1.00 . B B . 5 TYR HE2 1 1 8 5505 2 1 5 TYR HH H 4.304 -3.960 8.075 1.00 . B B . 5 TYR HH 1 1 8 5506 2 1 5 TYR N N -0.230 -5.910 4.774 1.00 . B B . 5 TYR N 1 1 8 5507 2 1 5 TYR O O -0.849 -6.436 1.311 1.00 . B B . 5 TYR O 1 1 8 5508 2 1 5 TYR OH O 4.809 -4.622 7.597 1.00 . B B . 5 TYR OH 1 1 8 5509 2 1 6 LEU C C -3.895 -8.019 2.654 1.00 . B B . 6 LEU C 1 1 8 5510 2 1 6 LEU CA C -2.453 -8.347 2.262 1.00 . B B . 6 LEU CA 1 1 8 5511 2 1 6 LEU CB C -2.189 -9.837 2.483 1.00 . B B . 6 LEU CB 1 1 8 5512 2 1 6 LEU CD1 C -1.537 -10.709 0.235 1.00 . B B . 6 LEU CD1 1 1 8 5513 2 1 6 LEU CD2 C 0.017 -9.180 1.456 1.00 . B B . 6 LEU CD2 1 1 8 5514 2 1 6 LEU CG C -1.015 -10.305 1.612 1.00 . B B . 6 LEU CG 1 1 8 5515 2 1 6 LEU H H -1.413 -7.735 4.051 1.00 . B B . 6 LEU H 1 1 8 5516 2 1 6 LEU HA H -2.302 -8.104 1.221 1.00 . B B . 6 LEU HA 1 1 8 5517 2 1 6 LEU HB2 H -1.952 -10.007 3.523 1.00 . B B . 6 LEU HB2 1 1 8 5518 2 1 6 LEU HB3 H -3.073 -10.400 2.221 1.00 . B B . 6 LEU HB3 1 1 8 5519 2 1 6 LEU HD11 H -0.704 -10.854 -0.437 1.00 . B B . 6 LEU HD11 1 1 8 5520 2 1 6 LEU HD12 H -2.180 -9.930 -0.148 1.00 . B B . 6 LEU HD12 1 1 8 5521 2 1 6 LEU HD13 H -2.097 -11.629 0.317 1.00 . B B . 6 LEU HD13 1 1 8 5522 2 1 6 LEU HD21 H 0.240 -8.759 2.424 1.00 . B B . 6 LEU HD21 1 1 8 5523 2 1 6 LEU HD22 H -0.386 -8.409 0.812 1.00 . B B . 6 LEU HD22 1 1 8 5524 2 1 6 LEU HD23 H 0.921 -9.578 1.017 1.00 . B B . 6 LEU HD23 1 1 8 5525 2 1 6 LEU HG H -0.546 -11.158 2.081 1.00 . B B . 6 LEU HG 1 1 8 5526 2 1 6 LEU N N -1.497 -7.560 3.083 1.00 . B B . 6 LEU N 1 1 8 5527 2 1 6 LEU O O -4.831 -8.493 2.042 1.00 . B B . 6 LEU O 1 1 8 5528 2 1 7 HIS C C -5.610 -5.382 4.326 1.00 . B B . 7 HIS C 1 1 8 5529 2 1 7 HIS CA C -5.485 -6.883 4.067 1.00 . B B . 7 HIS CA 1 1 8 5530 2 1 7 HIS CB C -5.852 -7.652 5.336 1.00 . B B . 7 HIS CB 1 1 8 5531 2 1 7 HIS CD2 C -4.232 -9.580 6.069 1.00 . B B . 7 HIS CD2 1 1 8 5532 2 1 7 HIS CE1 C -4.830 -11.068 4.612 1.00 . B B . 7 HIS CE1 1 1 8 5533 2 1 7 HIS CG C -5.215 -9.011 5.301 1.00 . B B . 7 HIS CG 1 1 8 5534 2 1 7 HIS H H -3.330 -6.842 4.153 1.00 . B B . 7 HIS H 1 1 8 5535 2 1 7 HIS HA H -6.160 -7.162 3.272 1.00 . B B . 7 HIS HA 1 1 8 5536 2 1 7 HIS HB2 H -5.498 -7.109 6.201 1.00 . B B . 7 HIS HB2 1 1 8 5537 2 1 7 HIS HB3 H -6.925 -7.759 5.394 1.00 . B B . 7 HIS HB3 1 1 8 5538 2 1 7 HIS HD1 H -6.267 -9.885 3.683 1.00 . B B . 7 HIS HD1 1 1 8 5539 2 1 7 HIS HD2 H -3.725 -9.093 6.887 1.00 . B B . 7 HIS HD2 1 1 8 5540 2 1 7 HIS HE1 H -4.897 -11.984 4.043 1.00 . B B . 7 HIS HE1 1 1 8 5541 2 1 7 HIS N N -4.091 -7.219 3.664 1.00 . B B . 7 HIS N 1 1 8 5542 2 1 7 HIS ND1 N -5.583 -9.978 4.379 1.00 . B B . 7 HIS ND1 1 1 8 5543 2 1 7 HIS NE2 N -3.989 -10.879 5.633 1.00 . B B . 7 HIS NE2 1 1 8 5544 2 1 7 HIS O O -6.663 -4.893 4.683 1.00 . B B . 7 HIS O 1 1 8 5545 2 1 8 SER C C -3.804 -2.444 3.335 1.00 . B B . 8 SER C 1 1 8 5546 2 1 8 SER CA C -4.635 -3.174 4.382 1.00 . B B . 8 SER CA 1 1 8 5547 2 1 8 SER CB C -4.112 -2.845 5.780 1.00 . B B . 8 SER CB 1 1 8 5548 2 1 8 SER H H -3.707 -5.047 3.852 1.00 . B B . 8 SER H 1 1 8 5549 2 1 8 SER HA H -5.662 -2.860 4.297 1.00 . B B . 8 SER HA 1 1 8 5550 2 1 8 SER HB2 H -3.221 -3.416 5.978 1.00 . B B . 8 SER HB2 1 1 8 5551 2 1 8 SER HB3 H -3.880 -1.789 5.837 1.00 . B B . 8 SER HB3 1 1 8 5552 2 1 8 SER HG H -4.693 -3.168 7.609 1.00 . B B . 8 SER HG 1 1 8 5553 2 1 8 SER N N -4.552 -4.642 4.146 1.00 . B B . 8 SER N 1 1 8 5554 2 1 8 SER O O -4.181 -1.398 2.846 1.00 . B B . 8 SER O 1 1 8 5555 2 1 8 SER OG O -5.105 -3.178 6.742 1.00 . B B . 8 SER OG 1 1 8 5556 2 1 9 ALA C C -2.557 -2.368 0.616 1.00 . B B . 9 ALA C 1 1 8 5557 2 1 9 ALA CA C -1.835 -2.326 1.955 1.00 . B B . 9 ALA CA 1 1 8 5558 2 1 9 ALA CB C -0.512 -3.068 1.828 1.00 . B B . 9 ALA CB 1 1 8 5559 2 1 9 ALA H H -2.394 -3.836 3.378 1.00 . B B . 9 ALA H 1 1 8 5560 2 1 9 ALA HA H -1.653 -1.301 2.241 1.00 . B B . 9 ALA HA 1 1 8 5561 2 1 9 ALA HB1 H 0.018 -3.022 2.767 1.00 . B B . 9 ALA HB1 1 1 8 5562 2 1 9 ALA HB2 H 0.082 -2.605 1.056 1.00 . B B . 9 ALA HB2 1 1 8 5563 2 1 9 ALA HB3 H -0.703 -4.103 1.570 1.00 . B B . 9 ALA HB3 1 1 8 5564 2 1 9 ALA N N -2.679 -2.988 2.978 1.00 . B B . 9 ALA N 1 1 8 5565 2 1 9 ALA O O -2.893 -1.345 0.059 1.00 . B B . 9 ALA O 1 1 8 5566 2 1 10 LYS C C -4.517 -2.563 -1.394 1.00 . B B . 10 LYS C 1 1 8 5567 2 1 10 LYS CA C -3.486 -3.681 -1.219 1.00 . B B . 10 LYS CA 1 1 8 5568 2 1 10 LYS CB C -4.200 -5.031 -1.291 1.00 . B B . 10 LYS CB 1 1 8 5569 2 1 10 LYS CD C -5.641 -6.594 0.029 1.00 . B B . 10 LYS CD 1 1 8 5570 2 1 10 LYS CE C -7.035 -6.810 -0.565 1.00 . B B . 10 LYS CE 1 1 8 5571 2 1 10 LYS CG C -5.225 -5.132 -0.159 1.00 . B B . 10 LYS CG 1 1 8 5572 2 1 10 LYS H H -2.490 -4.354 0.580 1.00 . B B . 10 LYS H 1 1 8 5573 2 1 10 LYS HA H -2.760 -3.621 -2.016 1.00 . B B . 10 LYS HA 1 1 8 5574 2 1 10 LYS HB2 H -4.705 -5.114 -2.243 1.00 . B B . 10 LYS HB2 1 1 8 5575 2 1 10 LYS HB3 H -3.478 -5.826 -1.194 1.00 . B B . 10 LYS HB3 1 1 8 5576 2 1 10 LYS HD2 H -4.932 -7.236 -0.472 1.00 . B B . 10 LYS HD2 1 1 8 5577 2 1 10 LYS HD3 H -5.661 -6.828 1.082 1.00 . B B . 10 LYS HD3 1 1 8 5578 2 1 10 LYS HE2 H -7.637 -5.930 -0.400 1.00 . B B . 10 LYS HE2 1 1 8 5579 2 1 10 LYS HE3 H -6.951 -6.996 -1.625 1.00 . B B . 10 LYS HE3 1 1 8 5580 2 1 10 LYS HG2 H -4.787 -4.763 0.756 1.00 . B B . 10 LYS HG2 1 1 8 5581 2 1 10 LYS HG3 H -6.095 -4.542 -0.406 1.00 . B B . 10 LYS HG3 1 1 8 5582 2 1 10 LYS HZ1 H -8.346 -7.652 0.819 1.00 . B B . 10 LYS HZ1 1 1 8 5583 2 1 10 LYS HZ2 H -6.946 -8.574 0.539 1.00 . B B . 10 LYS HZ2 1 1 8 5584 2 1 10 LYS HZ3 H -8.190 -8.542 -0.616 1.00 . B B . 10 LYS HZ3 1 1 8 5585 2 1 10 LYS N N -2.787 -3.547 0.099 1.00 . B B . 10 LYS N 1 1 8 5586 2 1 10 LYS NZ N -7.678 -7.983 0.094 1.00 . B B . 10 LYS NZ 1 1 8 5587 2 1 10 LYS O O -4.561 -1.903 -2.414 1.00 . B B . 10 LYS O 1 1 8 5588 2 1 11 LYS C C -5.645 0.063 -0.845 1.00 . B B . 11 LYS C 1 1 8 5589 2 1 11 LYS CA C -6.361 -1.251 -0.536 1.00 . B B . 11 LYS CA 1 1 8 5590 2 1 11 LYS CB C -7.140 -1.121 0.776 1.00 . B B . 11 LYS CB 1 1 8 5591 2 1 11 LYS CD C -8.978 -2.618 -0.031 1.00 . B B . 11 LYS CD 1 1 8 5592 2 1 11 LYS CE C -9.622 -3.995 0.134 1.00 . B B . 11 LYS CE 1 1 8 5593 2 1 11 LYS CG C -7.908 -2.418 1.048 1.00 . B B . 11 LYS CG 1 1 8 5594 2 1 11 LYS H H -5.296 -2.871 0.408 1.00 . B B . 11 LYS H 1 1 8 5595 2 1 11 LYS HA H -7.041 -1.486 -1.342 1.00 . B B . 11 LYS HA 1 1 8 5596 2 1 11 LYS HB2 H -6.450 -0.935 1.587 1.00 . B B . 11 LYS HB2 1 1 8 5597 2 1 11 LYS HB3 H -7.837 -0.301 0.700 1.00 . B B . 11 LYS HB3 1 1 8 5598 2 1 11 LYS HD2 H -9.733 -1.852 0.067 1.00 . B B . 11 LYS HD2 1 1 8 5599 2 1 11 LYS HD3 H -8.521 -2.551 -1.007 1.00 . B B . 11 LYS HD3 1 1 8 5600 2 1 11 LYS HE2 H -9.202 -4.678 -0.589 1.00 . B B . 11 LYS HE2 1 1 8 5601 2 1 11 LYS HE3 H -9.432 -4.365 1.131 1.00 . B B . 11 LYS HE3 1 1 8 5602 2 1 11 LYS HG2 H -7.222 -3.253 1.034 1.00 . B B . 11 LYS HG2 1 1 8 5603 2 1 11 LYS HG3 H -8.384 -2.359 2.015 1.00 . B B . 11 LYS HG3 1 1 8 5604 2 1 11 LYS HZ1 H -11.537 -4.811 0.069 1.00 . B B . 11 LYS HZ1 1 1 8 5605 2 1 11 LYS HZ2 H -11.275 -3.566 -1.058 1.00 . B B . 11 LYS HZ2 1 1 8 5606 2 1 11 LYS HZ3 H -11.492 -3.197 0.587 1.00 . B B . 11 LYS HZ3 1 1 8 5607 2 1 11 LYS N N -5.345 -2.335 -0.411 1.00 . B B . 11 LYS N 1 1 8 5608 2 1 11 LYS NZ N -11.092 -3.884 -0.083 1.00 . B B . 11 LYS NZ 1 1 8 5609 2 1 11 LYS O O -5.856 0.665 -1.880 1.00 . B B . 11 LYS O 1 1 8 5610 2 1 12 PHE C C -3.100 1.556 -1.399 1.00 . B B . 12 PHE C 1 1 8 5611 2 1 12 PHE CA C -4.055 1.773 -0.225 1.00 . B B . 12 PHE CA 1 1 8 5612 2 1 12 PHE CB C -3.258 2.164 1.021 1.00 . B B . 12 PHE CB 1 1 8 5613 2 1 12 PHE CD1 C -5.446 2.072 2.269 1.00 . B B . 12 PHE CD1 1 1 8 5614 2 1 12 PHE CD2 C -3.430 1.323 3.388 1.00 . B B . 12 PHE CD2 1 1 8 5615 2 1 12 PHE CE1 C -6.193 1.776 3.415 1.00 . B B . 12 PHE CE1 1 1 8 5616 2 1 12 PHE CE2 C -4.177 1.027 4.535 1.00 . B B . 12 PHE CE2 1 1 8 5617 2 1 12 PHE CG C -4.064 1.846 2.256 1.00 . B B . 12 PHE CG 1 1 8 5618 2 1 12 PHE CZ C -5.557 1.253 4.548 1.00 . B B . 12 PHE CZ 1 1 8 5619 2 1 12 PHE H H -4.626 0.006 0.858 1.00 . B B . 12 PHE H 1 1 8 5620 2 1 12 PHE HA H -4.757 2.557 -0.468 1.00 . B B . 12 PHE HA 1 1 8 5621 2 1 12 PHE HB2 H -2.330 1.608 1.042 1.00 . B B . 12 PHE HB2 1 1 8 5622 2 1 12 PHE HB3 H -3.044 3.224 0.995 1.00 . B B . 12 PHE HB3 1 1 8 5623 2 1 12 PHE HD1 H -5.935 2.475 1.394 1.00 . B B . 12 PHE HD1 1 1 8 5624 2 1 12 PHE HD2 H -2.364 1.148 3.378 1.00 . B B . 12 PHE HD2 1 1 8 5625 2 1 12 PHE HE1 H -7.258 1.951 3.425 1.00 . B B . 12 PHE HE1 1 1 8 5626 2 1 12 PHE HE2 H -3.686 0.624 5.409 1.00 . B B . 12 PHE HE2 1 1 8 5627 2 1 12 PHE HZ H -6.133 1.025 5.434 1.00 . B B . 12 PHE HZ 1 1 8 5628 2 1 12 PHE N N -4.791 0.508 0.034 1.00 . B B . 12 PHE N 1 1 8 5629 2 1 12 PHE O O -2.758 2.470 -2.112 1.00 . B B . 12 PHE O 1 1 8 5630 2 1 13 GLY C C -2.316 0.712 -4.006 1.00 . B B . 13 GLY C 1 1 8 5631 2 1 13 GLY CA C -1.740 0.081 -2.741 1.00 . B B . 13 GLY CA 1 1 8 5632 2 1 13 GLY H H -2.954 -0.387 -1.025 1.00 . B B . 13 GLY H 1 1 8 5633 2 1 13 GLY HA2 H -0.773 0.514 -2.525 1.00 . B B . 13 GLY HA2 1 1 8 5634 2 1 13 GLY HA3 H -1.639 -0.982 -2.886 1.00 . B B . 13 GLY HA3 1 1 8 5635 2 1 13 GLY N N -2.667 0.347 -1.608 1.00 . B B . 13 GLY N 1 1 8 5636 2 1 13 GLY O O -1.613 1.330 -4.782 1.00 . B B . 13 GLY O 1 1 8 5637 2 1 14 LYS C C -4.656 2.589 -5.165 1.00 . B B . 14 LYS C 1 1 8 5638 2 1 14 LYS CA C -4.223 1.144 -5.436 1.00 . B B . 14 LYS CA 1 1 8 5639 2 1 14 LYS CB C -5.454 0.317 -5.815 1.00 . B B . 14 LYS CB 1 1 8 5640 2 1 14 LYS CD C -5.220 -1.296 -7.709 1.00 . B B . 14 LYS CD 1 1 8 5641 2 1 14 LYS CE C -3.928 -0.940 -8.445 1.00 . B B . 14 LYS CE 1 1 8 5642 2 1 14 LYS CG C -5.021 -1.097 -6.205 1.00 . B B . 14 LYS CG 1 1 8 5643 2 1 14 LYS H H -4.139 0.049 -3.580 1.00 . B B . 14 LYS H 1 1 8 5644 2 1 14 LYS HA H -3.514 1.129 -6.249 1.00 . B B . 14 LYS HA 1 1 8 5645 2 1 14 LYS HB2 H -6.126 0.267 -4.968 1.00 . B B . 14 LYS HB2 1 1 8 5646 2 1 14 LYS HB3 H -5.958 0.782 -6.648 1.00 . B B . 14 LYS HB3 1 1 8 5647 2 1 14 LYS HD2 H -5.475 -2.328 -7.905 1.00 . B B . 14 LYS HD2 1 1 8 5648 2 1 14 LYS HD3 H -6.018 -0.656 -8.056 1.00 . B B . 14 LYS HD3 1 1 8 5649 2 1 14 LYS HE2 H -3.254 -0.436 -7.767 1.00 . B B . 14 LYS HE2 1 1 8 5650 2 1 14 LYS HE3 H -3.462 -1.843 -8.811 1.00 . B B . 14 LYS HE3 1 1 8 5651 2 1 14 LYS HG2 H -3.979 -1.236 -5.958 1.00 . B B . 14 LYS HG2 1 1 8 5652 2 1 14 LYS HG3 H -5.618 -1.818 -5.668 1.00 . B B . 14 LYS HG3 1 1 8 5653 2 1 14 LYS HZ1 H -4.204 0.949 -9.278 1.00 . B B . 14 LYS HZ1 1 1 8 5654 2 1 14 LYS HZ2 H -5.192 -0.257 -9.952 1.00 . B B . 14 LYS HZ2 1 1 8 5655 2 1 14 LYS HZ3 H -3.542 -0.189 -10.348 1.00 . B B . 14 LYS HZ3 1 1 8 5656 2 1 14 LYS N N -3.594 0.558 -4.220 1.00 . B B . 14 LYS N 1 1 8 5657 2 1 14 LYS NZ N -4.240 -0.041 -9.593 1.00 . B B . 14 LYS NZ 1 1 8 5658 2 1 14 LYS O O -4.822 3.375 -6.077 1.00 . B B . 14 LYS O 1 1 8 5659 2 1 15 ALA C C -4.066 5.214 -3.318 1.00 . B B . 15 ALA C 1 1 8 5660 2 1 15 ALA CA C -5.286 4.341 -3.616 1.00 . B B . 15 ALA CA 1 1 8 5661 2 1 15 ALA CB C -6.204 4.332 -2.394 1.00 . B B . 15 ALA CB 1 1 8 5662 2 1 15 ALA H H -4.722 2.300 -3.200 1.00 . B B . 15 ALA H 1 1 8 5663 2 1 15 ALA HA H -5.820 4.746 -4.463 1.00 . B B . 15 ALA HA 1 1 8 5664 2 1 15 ALA HB1 H -6.021 3.440 -1.811 1.00 . B B . 15 ALA HB1 1 1 8 5665 2 1 15 ALA HB2 H -7.234 4.344 -2.718 1.00 . B B . 15 ALA HB2 1 1 8 5666 2 1 15 ALA HB3 H -6.005 5.204 -1.788 1.00 . B B . 15 ALA HB3 1 1 8 5667 2 1 15 ALA N N -4.852 2.947 -3.925 1.00 . B B . 15 ALA N 1 1 8 5668 2 1 15 ALA O O -3.912 6.291 -3.857 1.00 . B B . 15 ALA O 1 1 8 5669 2 1 16 TRP C C -1.151 5.760 -3.379 1.00 . B B . 16 TRP C 1 1 8 5670 2 1 16 TRP CA C -1.992 5.547 -2.118 1.00 . B B . 16 TRP CA 1 1 8 5671 2 1 16 TRP CB C -1.188 4.807 -1.029 1.00 . B B . 16 TRP CB 1 1 8 5672 2 1 16 TRP CD1 C -0.118 2.567 -1.550 1.00 . B B . 16 TRP CD1 1 1 8 5673 2 1 16 TRP CD2 C 1.022 4.299 -2.400 1.00 . B B . 16 TRP CD2 1 1 8 5674 2 1 16 TRP CE2 C 1.724 3.133 -2.780 1.00 . B B . 16 TRP CE2 1 1 8 5675 2 1 16 TRP CE3 C 1.525 5.538 -2.797 1.00 . B B . 16 TRP CE3 1 1 8 5676 2 1 16 TRP CG C -0.146 3.916 -1.636 1.00 . B B . 16 TRP CG 1 1 8 5677 2 1 16 TRP CH2 C 3.380 4.455 -3.932 1.00 . B B . 16 TRP CH2 1 1 8 5678 2 1 16 TRP CZ2 C 2.894 3.203 -3.539 1.00 . B B . 16 TRP CZ2 1 1 8 5679 2 1 16 TRP CZ3 C 2.693 5.618 -3.557 1.00 . B B . 16 TRP CZ3 1 1 8 5680 2 1 16 TRP H H -3.344 3.883 -2.039 1.00 . B B . 16 TRP H 1 1 8 5681 2 1 16 TRP HA H -2.295 6.508 -1.736 1.00 . B B . 16 TRP HA 1 1 8 5682 2 1 16 TRP HB2 H -0.704 5.531 -0.392 1.00 . B B . 16 TRP HB2 1 1 8 5683 2 1 16 TRP HB3 H -1.865 4.210 -0.434 1.00 . B B . 16 TRP HB3 1 1 8 5684 2 1 16 TRP HD1 H -0.842 1.959 -1.035 1.00 . B B . 16 TRP HD1 1 1 8 5685 2 1 16 TRP HE1 H 1.234 1.157 -2.342 1.00 . B B . 16 TRP HE1 1 1 8 5686 2 1 16 TRP HE3 H 1.001 6.438 -2.506 1.00 . B B . 16 TRP HE3 1 1 8 5687 2 1 16 TRP HH2 H 4.283 4.525 -4.520 1.00 . B B . 16 TRP HH2 1 1 8 5688 2 1 16 TRP HZ2 H 3.415 2.301 -3.822 1.00 . B B . 16 TRP HZ2 1 1 8 5689 2 1 16 TRP HZ3 H 3.060 6.580 -3.861 1.00 . B B . 16 TRP HZ3 1 1 8 5690 2 1 16 TRP N N -3.200 4.755 -2.460 1.00 . B B . 16 TRP N 1 1 8 5691 2 1 16 TRP NE1 N 0.988 2.100 -2.239 1.00 . B B . 16 TRP NE1 1 1 8 5692 2 1 16 TRP O O -0.684 6.846 -3.651 1.00 . B B . 16 TRP O 1 1 8 5693 2 1 17 VAL C C -0.843 5.885 -6.311 1.00 . B B . 17 VAL C 1 1 8 5694 2 1 17 VAL CA C -0.117 4.916 -5.377 1.00 . B B . 17 VAL CA 1 1 8 5695 2 1 17 VAL CB C 0.115 3.555 -6.057 1.00 . B B . 17 VAL CB 1 1 8 5696 2 1 17 VAL CG1 C -0.955 3.288 -7.122 1.00 . B B . 17 VAL CG1 1 1 8 5697 2 1 17 VAL CG2 C 1.497 3.552 -6.711 1.00 . B B . 17 VAL CG2 1 1 8 5698 2 1 17 VAL H H -1.306 3.855 -3.926 1.00 . B B . 17 VAL H 1 1 8 5699 2 1 17 VAL HA H 0.834 5.351 -5.097 1.00 . B B . 17 VAL HA 1 1 8 5700 2 1 17 VAL HB H 0.069 2.773 -5.311 1.00 . B B . 17 VAL HB 1 1 8 5701 2 1 17 VAL HG11 H -0.967 4.102 -7.831 1.00 . B B . 17 VAL HG11 1 1 8 5702 2 1 17 VAL HG12 H -1.922 3.209 -6.648 1.00 . B B . 17 VAL HG12 1 1 8 5703 2 1 17 VAL HG13 H -0.730 2.365 -7.636 1.00 . B B . 17 VAL HG13 1 1 8 5704 2 1 17 VAL HG21 H 1.925 2.563 -6.646 1.00 . B B . 17 VAL HG21 1 1 8 5705 2 1 17 VAL HG22 H 2.137 4.257 -6.198 1.00 . B B . 17 VAL HG22 1 1 8 5706 2 1 17 VAL HG23 H 1.404 3.838 -7.748 1.00 . B B . 17 VAL HG23 1 1 8 5707 2 1 17 VAL N N -0.937 4.734 -4.152 1.00 . B B . 17 VAL N 1 1 8 5708 2 1 17 VAL O O -0.277 6.849 -6.786 1.00 . B B . 17 VAL O 1 1 8 5709 2 1 18 GLY C C -2.780 8.001 -6.803 1.00 . B B . 18 GLY C 1 1 8 5710 2 1 18 GLY CA C -2.864 6.601 -7.416 1.00 . B B . 18 GLY CA 1 1 8 5711 2 1 18 GLY H H -2.558 4.898 -6.132 1.00 . B B . 18 GLY H 1 1 8 5712 2 1 18 GLY HA2 H -2.432 6.606 -8.407 1.00 . B B . 18 GLY HA2 1 1 8 5713 2 1 18 GLY HA3 H -3.897 6.294 -7.470 1.00 . B B . 18 GLY HA3 1 1 8 5714 2 1 18 GLY N N -2.106 5.663 -6.547 1.00 . B B . 18 GLY N 1 1 8 5715 2 1 18 GLY O O -3.102 8.989 -7.431 1.00 . B B . 18 GLY O 1 1 8 5716 2 1 19 GLU C C -0.818 9.944 -5.150 1.00 . B B . 19 GLU C 1 1 8 5717 2 1 19 GLU CA C -2.218 9.392 -4.895 1.00 . B B . 19 GLU CA 1 1 8 5718 2 1 19 GLU CB C -2.429 9.169 -3.390 1.00 . B B . 19 GLU CB 1 1 8 5719 2 1 19 GLU CD C -1.923 11.602 -3.107 1.00 . B B . 19 GLU CD 1 1 8 5720 2 1 19 GLU CG C -1.644 10.196 -2.574 1.00 . B B . 19 GLU CG 1 1 8 5721 2 1 19 GLU H H -2.087 7.279 -5.089 1.00 . B B . 19 GLU H 1 1 8 5722 2 1 19 GLU HA H -2.957 10.078 -5.276 1.00 . B B . 19 GLU HA 1 1 8 5723 2 1 19 GLU HB2 H -3.479 9.254 -3.158 1.00 . B B . 19 GLU HB2 1 1 8 5724 2 1 19 GLU HB3 H -2.080 8.178 -3.130 1.00 . B B . 19 GLU HB3 1 1 8 5725 2 1 19 GLU HG2 H -1.942 10.132 -1.538 1.00 . B B . 19 GLU HG2 1 1 8 5726 2 1 19 GLU HG3 H -0.590 9.980 -2.661 1.00 . B B . 19 GLU HG3 1 1 8 5727 2 1 19 GLU N N -2.341 8.084 -5.573 1.00 . B B . 19 GLU N 1 1 8 5728 2 1 19 GLU O O -0.640 10.938 -5.825 1.00 . B B . 19 GLU O 1 1 8 5729 2 1 19 GLU OE1 O -2.956 11.783 -3.732 1.00 . B B . 19 GLU OE1 1 1 8 5730 2 1 19 GLU OE2 O -1.101 12.474 -2.881 1.00 . B B . 19 GLU OE2 1 1 8 5731 2 1 20 ILE C C 2.046 9.448 -6.199 1.00 . B B . 20 ILE C 1 1 8 5732 2 1 20 ILE CA C 1.559 9.806 -4.797 1.00 . B B . 20 ILE CA 1 1 8 5733 2 1 20 ILE CB C 2.474 9.156 -3.770 1.00 . B B . 20 ILE CB 1 1 8 5734 2 1 20 ILE CD1 C 3.042 9.012 -1.345 1.00 . B B . 20 ILE CD1 1 1 8 5735 2 1 20 ILE CG1 C 2.151 9.700 -2.382 1.00 . B B . 20 ILE CG1 1 1 8 5736 2 1 20 ILE CG2 C 3.933 9.457 -4.114 1.00 . B B . 20 ILE CG2 1 1 8 5737 2 1 20 ILE H H 0.010 8.513 -4.044 1.00 . B B . 20 ILE H 1 1 8 5738 2 1 20 ILE HA H 1.572 10.872 -4.670 1.00 . B B . 20 ILE HA 1 1 8 5739 2 1 20 ILE HB H 2.313 8.094 -3.783 1.00 . B B . 20 ILE HB 1 1 8 5740 2 1 20 ILE HD11 H 3.767 9.718 -0.968 1.00 . B B . 20 ILE HD11 1 1 8 5741 2 1 20 ILE HD12 H 3.553 8.180 -1.806 1.00 . B B . 20 ILE HD12 1 1 8 5742 2 1 20 ILE HD13 H 2.431 8.652 -0.529 1.00 . B B . 20 ILE HD13 1 1 8 5743 2 1 20 ILE HG12 H 2.328 10.765 -2.362 1.00 . B B . 20 ILE HG12 1 1 8 5744 2 1 20 ILE HG13 H 1.117 9.498 -2.152 1.00 . B B . 20 ILE HG13 1 1 8 5745 2 1 20 ILE HG21 H 4.581 8.934 -3.426 1.00 . B B . 20 ILE HG21 1 1 8 5746 2 1 20 ILE HG22 H 4.109 10.520 -4.039 1.00 . B B . 20 ILE HG22 1 1 8 5747 2 1 20 ILE HG23 H 4.139 9.128 -5.122 1.00 . B B . 20 ILE HG23 1 1 8 5748 2 1 20 ILE N N 0.176 9.310 -4.599 1.00 . B B . 20 ILE N 1 1 8 5749 2 1 20 ILE O O 2.714 10.226 -6.852 1.00 . B B . 20 ILE O 1 1 8 5750 2 1 21 MET C C 1.575 8.786 -9.075 1.00 . B B . 21 MET C 1 1 8 5751 2 1 21 MET CA C 2.188 7.864 -8.015 1.00 . B B . 21 MET CA 1 1 8 5752 2 1 21 MET CB C 1.768 6.418 -8.278 1.00 . B B . 21 MET CB 1 1 8 5753 2 1 21 MET CE C 2.301 4.904 -11.454 1.00 . B B . 21 MET CE 1 1 8 5754 2 1 21 MET CG C 2.929 5.663 -8.923 1.00 . B B . 21 MET CG 1 1 8 5755 2 1 21 MET H H 1.199 7.657 -6.116 1.00 . B B . 21 MET H 1 1 8 5756 2 1 21 MET HA H 3.265 7.934 -8.061 1.00 . B B . 21 MET HA 1 1 8 5757 2 1 21 MET HB2 H 1.509 5.945 -7.341 1.00 . B B . 21 MET HB2 1 1 8 5758 2 1 21 MET HB3 H 0.915 6.403 -8.942 1.00 . B B . 21 MET HB3 1 1 8 5759 2 1 21 MET HE1 H 1.483 4.563 -10.833 1.00 . B B . 21 MET HE1 1 1 8 5760 2 1 21 MET HE2 H 2.983 4.087 -11.626 1.00 . B B . 21 MET HE2 1 1 8 5761 2 1 21 MET HE3 H 1.917 5.257 -12.401 1.00 . B B . 21 MET HE3 1 1 8 5762 2 1 21 MET HG2 H 3.831 5.837 -8.351 1.00 . B B . 21 MET HG2 1 1 8 5763 2 1 21 MET HG3 H 2.708 4.606 -8.937 1.00 . B B . 21 MET HG3 1 1 8 5764 2 1 21 MET N N 1.730 8.273 -6.662 1.00 . B B . 21 MET N 1 1 8 5765 2 1 21 MET O O 2.071 8.882 -10.180 1.00 . B B . 21 MET O 1 1 8 5766 2 1 21 MET SD S 3.168 6.255 -10.617 1.00 . B B . 21 MET SD 1 1 8 5767 2 1 22 ASN C C 0.186 11.839 -9.389 1.00 . B B . 22 ASN C 1 1 8 5768 2 1 22 ASN CA C -0.106 10.380 -9.765 1.00 . B B . 22 ASN CA 1 1 8 5769 2 1 22 ASN CB C -1.624 10.134 -9.832 1.00 . B B . 22 ASN CB 1 1 8 5770 2 1 22 ASN CG C -2.359 11.013 -8.813 1.00 . B B . 22 ASN CG 1 1 8 5771 2 1 22 ASN H H 0.115 9.391 -7.858 1.00 . B B . 22 ASN H 1 1 8 5772 2 1 22 ASN HA H 0.329 10.174 -10.733 1.00 . B B . 22 ASN HA 1 1 8 5773 2 1 22 ASN HB2 H -1.980 10.369 -10.826 1.00 . B B . 22 ASN HB2 1 1 8 5774 2 1 22 ASN HB3 H -1.826 9.094 -9.615 1.00 . B B . 22 ASN HB3 1 1 8 5775 2 1 22 ASN HD21 H -4.016 11.132 -9.905 1.00 . B B . 22 ASN HD21 1 1 8 5776 2 1 22 ASN HD22 H -4.058 11.967 -8.418 1.00 . B B . 22 ASN HD22 1 1 8 5777 2 1 22 ASN N N 0.508 9.471 -8.755 1.00 . B B . 22 ASN N 1 1 8 5778 2 1 22 ASN ND2 N -3.579 11.403 -9.066 1.00 . B B . 22 ASN ND2 1 1 8 5779 2 1 22 ASN O O 0.095 12.732 -10.208 1.00 . B B . 22 ASN O 1 1 8 5780 2 1 22 ASN OD1 O -1.817 11.350 -7.781 1.00 . B B . 22 ASN OD1 1 1 8 5781 2 1 23 SER C C 2.284 13.578 -7.261 1.00 . B B . 23 SER C 1 1 8 5782 2 1 23 SER CA C 0.830 13.482 -7.726 1.00 . B B . 23 SER CA 1 1 8 5783 2 1 23 SER CB C -0.100 13.867 -6.574 1.00 . B B . 23 SER CB 1 1 8 5784 2 1 23 SER H H 0.600 11.351 -7.510 1.00 . B B . 23 SER H 1 1 8 5785 2 1 23 SER HA H 0.672 14.155 -8.556 1.00 . B B . 23 SER HA 1 1 8 5786 2 1 23 SER HB2 H 0.080 13.218 -5.734 1.00 . B B . 23 SER HB2 1 1 8 5787 2 1 23 SER HB3 H 0.095 14.891 -6.283 1.00 . B B . 23 SER HB3 1 1 8 5788 2 1 23 SER HG H -1.686 14.510 -7.499 1.00 . B B . 23 SER HG 1 1 8 5789 2 1 23 SER N N 0.535 12.085 -8.155 1.00 . B B . 23 SER N 1 1 8 5790 2 1 23 SER O O 3.054 14.252 -7.925 1.00 . B B . 23 SER O 1 1 8 5791 2 1 23 SER OXT O 2.601 12.980 -6.247 1.00 . B B . 23 SER OXT 1 1 8 5792 2 1 23 SER OG O -1.450 13.728 -6.993 1.00 . B B . 23 SER OG 1 1 9 5793 1 1 1 GLY C C -7.029 11.829 1.084 1.00 . A A . 1 GLY C 1 1 9 5794 1 1 1 GLY CA C -8.395 12.489 1.266 1.00 . A A . 1 GLY CA 1 1 9 5795 1 1 1 GLY H1 H -9.450 11.187 0.030 1.00 . A A . 1 GLY H1 1 1 9 5796 1 1 1 GLY H2 H -10.397 11.910 1.241 1.00 . A A . 1 GLY H2 1 1 9 5797 1 1 1 GLY H3 H -9.317 10.659 1.636 1.00 . A A . 1 GLY H3 1 1 9 5798 1 1 1 GLY HA2 H -8.500 13.305 0.563 1.00 . A A . 1 GLY HA2 1 1 9 5799 1 1 1 GLY HA3 H -8.477 12.869 2.274 1.00 . A A . 1 GLY HA3 1 1 9 5800 1 1 1 GLY N N -9.471 11.485 1.025 1.00 . A A . 1 GLY N 1 1 9 5801 1 1 1 GLY O O -6.853 10.968 0.245 1.00 . A A . 1 GLY O 1 1 9 5802 1 1 2 ILE C C -3.963 11.702 3.066 1.00 . A A . 2 ILE C 1 1 9 5803 1 1 2 ILE CA C -4.705 11.609 1.731 1.00 . A A . 2 ILE CA 1 1 9 5804 1 1 2 ILE CB C -3.895 12.336 0.648 1.00 . A A . 2 ILE CB 1 1 9 5805 1 1 2 ILE CD1 C -3.717 14.403 -0.748 1.00 . A A . 2 ILE CD1 1 1 9 5806 1 1 2 ILE CG1 C -4.496 13.720 0.378 1.00 . A A . 2 ILE CG1 1 1 9 5807 1 1 2 ILE CG2 C -3.919 11.516 -0.644 1.00 . A A . 2 ILE CG2 1 1 9 5808 1 1 2 ILE H H -6.219 12.916 2.536 1.00 . A A . 2 ILE H 1 1 9 5809 1 1 2 ILE HA H -4.811 10.571 1.458 1.00 . A A . 2 ILE HA 1 1 9 5810 1 1 2 ILE HB H -2.872 12.447 0.981 1.00 . A A . 2 ILE HB 1 1 9 5811 1 1 2 ILE HD11 H -2.668 14.429 -0.495 1.00 . A A . 2 ILE HD11 1 1 9 5812 1 1 2 ILE HD12 H -4.082 15.410 -0.878 1.00 . A A . 2 ILE HD12 1 1 9 5813 1 1 2 ILE HD13 H -3.852 13.849 -1.666 1.00 . A A . 2 ILE HD13 1 1 9 5814 1 1 2 ILE HG12 H -5.532 13.612 0.086 1.00 . A A . 2 ILE HG12 1 1 9 5815 1 1 2 ILE HG13 H -4.432 14.321 1.274 1.00 . A A . 2 ILE HG13 1 1 9 5816 1 1 2 ILE HG21 H -3.293 11.991 -1.384 1.00 . A A . 2 ILE HG21 1 1 9 5817 1 1 2 ILE HG22 H -4.932 11.457 -1.014 1.00 . A A . 2 ILE HG22 1 1 9 5818 1 1 2 ILE HG23 H -3.550 10.521 -0.445 1.00 . A A . 2 ILE HG23 1 1 9 5819 1 1 2 ILE N N -6.058 12.222 1.863 1.00 . A A . 2 ILE N 1 1 9 5820 1 1 2 ILE O O -3.012 12.445 3.208 1.00 . A A . 2 ILE O 1 1 9 5821 1 1 3 GLY C C -3.176 9.591 5.714 1.00 . A A . 3 GLY C 1 1 9 5822 1 1 3 GLY CA C -3.698 10.987 5.366 1.00 . A A . 3 GLY CA 1 1 9 5823 1 1 3 GLY H H -5.152 10.351 3.907 1.00 . A A . 3 GLY H 1 1 9 5824 1 1 3 GLY HA2 H -2.867 11.675 5.313 1.00 . A A . 3 GLY HA2 1 1 9 5825 1 1 3 GLY HA3 H -4.391 11.310 6.127 1.00 . A A . 3 GLY HA3 1 1 9 5826 1 1 3 GLY N N -4.387 10.947 4.044 1.00 . A A . 3 GLY N 1 1 9 5827 1 1 3 GLY O O -2.612 9.371 6.768 1.00 . A A . 3 GLY O 1 1 9 5828 1 1 4 LYS C C -2.112 6.779 3.838 1.00 . A A . 4 LYS C 1 1 9 5829 1 1 4 LYS CA C -2.851 7.270 5.084 1.00 . A A . 4 LYS CA 1 1 9 5830 1 1 4 LYS CB C -4.023 6.322 5.389 1.00 . A A . 4 LYS CB 1 1 9 5831 1 1 4 LYS CD C -6.410 6.288 6.133 1.00 . A A . 4 LYS CD 1 1 9 5832 1 1 4 LYS CE C -6.183 6.446 7.637 1.00 . A A . 4 LYS CE 1 1 9 5833 1 1 4 LYS CG C -5.351 7.086 5.371 1.00 . A A . 4 LYS CG 1 1 9 5834 1 1 4 LYS H H -3.797 8.859 3.984 1.00 . A A . 4 LYS H 1 1 9 5835 1 1 4 LYS HA H -2.170 7.283 5.923 1.00 . A A . 4 LYS HA 1 1 9 5836 1 1 4 LYS HB2 H -4.051 5.539 4.645 1.00 . A A . 4 LYS HB2 1 1 9 5837 1 1 4 LYS HB3 H -3.880 5.880 6.365 1.00 . A A . 4 LYS HB3 1 1 9 5838 1 1 4 LYS HD2 H -7.393 6.658 5.877 1.00 . A A . 4 LYS HD2 1 1 9 5839 1 1 4 LYS HD3 H -6.336 5.245 5.868 1.00 . A A . 4 LYS HD3 1 1 9 5840 1 1 4 LYS HE2 H -5.519 7.279 7.816 1.00 . A A . 4 LYS HE2 1 1 9 5841 1 1 4 LYS HE3 H -7.127 6.627 8.127 1.00 . A A . 4 LYS HE3 1 1 9 5842 1 1 4 LYS HG2 H -5.217 8.050 5.840 1.00 . A A . 4 LYS HG2 1 1 9 5843 1 1 4 LYS HG3 H -5.673 7.224 4.349 1.00 . A A . 4 LYS HG3 1 1 9 5844 1 1 4 LYS HZ1 H -6.325 4.536 8.452 1.00 . A A . 4 LYS HZ1 1 1 9 5845 1 1 4 LYS HZ2 H -4.993 5.430 9.012 1.00 . A A . 4 LYS HZ2 1 1 9 5846 1 1 4 LYS HZ3 H -4.976 4.759 7.450 1.00 . A A . 4 LYS HZ3 1 1 9 5847 1 1 4 LYS N N -3.347 8.653 4.827 1.00 . A A . 4 LYS N 1 1 9 5848 1 1 4 LYS NZ N -5.573 5.199 8.179 1.00 . A A . 4 LYS NZ 1 1 9 5849 1 1 4 LYS O O -1.134 6.064 3.922 1.00 . A A . 4 LYS O 1 1 9 5850 1 1 5 TYR C C -0.622 7.533 1.235 1.00 . A A . 5 TYR C 1 1 9 5851 1 1 5 TYR CA C -1.918 6.745 1.420 1.00 . A A . 5 TYR CA 1 1 9 5852 1 1 5 TYR CB C -2.869 7.004 0.250 1.00 . A A . 5 TYR CB 1 1 9 5853 1 1 5 TYR CD1 C -4.797 5.578 1.031 1.00 . A A . 5 TYR CD1 1 1 9 5854 1 1 5 TYR CD2 C -5.129 7.970 0.820 1.00 . A A . 5 TYR CD2 1 1 9 5855 1 1 5 TYR CE1 C -6.121 5.431 1.460 1.00 . A A . 5 TYR CE1 1 1 9 5856 1 1 5 TYR CE2 C -6.454 7.824 1.250 1.00 . A A . 5 TYR CE2 1 1 9 5857 1 1 5 TYR CG C -4.302 6.848 0.711 1.00 . A A . 5 TYR CG 1 1 9 5858 1 1 5 TYR CZ C -6.951 6.553 1.570 1.00 . A A . 5 TYR CZ 1 1 9 5859 1 1 5 TYR H H -3.360 7.746 2.639 1.00 . A A . 5 TYR H 1 1 9 5860 1 1 5 TYR HA H -1.684 5.699 1.459 1.00 . A A . 5 TYR HA 1 1 9 5861 1 1 5 TYR HB2 H -2.717 8.003 -0.131 1.00 . A A . 5 TYR HB2 1 1 9 5862 1 1 5 TYR HB3 H -2.674 6.286 -0.524 1.00 . A A . 5 TYR HB3 1 1 9 5863 1 1 5 TYR HD1 H -4.158 4.712 0.946 1.00 . A A . 5 TYR HD1 1 1 9 5864 1 1 5 TYR HD2 H -4.747 8.948 0.572 1.00 . A A . 5 TYR HD2 1 1 9 5865 1 1 5 TYR HE1 H -6.503 4.450 1.706 1.00 . A A . 5 TYR HE1 1 1 9 5866 1 1 5 TYR HE2 H -7.093 8.691 1.333 1.00 . A A . 5 TYR HE2 1 1 9 5867 1 1 5 TYR HH H -8.412 5.480 2.165 1.00 . A A . 5 TYR HH 1 1 9 5868 1 1 5 TYR N N -2.575 7.168 2.680 1.00 . A A . 5 TYR N 1 1 9 5869 1 1 5 TYR O O 0.262 7.125 0.509 1.00 . A A . 5 TYR O 1 1 9 5870 1 1 5 TYR OH O -8.256 6.411 1.994 1.00 . A A . 5 TYR OH 1 1 9 5871 1 1 6 LEU C C 1.497 9.501 3.074 1.00 . A A . 6 LEU C 1 1 9 5872 1 1 6 LEU CA C 0.751 9.456 1.744 1.00 . A A . 6 LEU CA 1 1 9 5873 1 1 6 LEU CB C 0.382 10.879 1.331 1.00 . A A . 6 LEU CB 1 1 9 5874 1 1 6 LEU CD1 C 1.471 11.129 -0.896 1.00 . A A . 6 LEU CD1 1 1 9 5875 1 1 6 LEU CD2 C -0.523 9.644 -0.663 1.00 . A A . 6 LEU CD2 1 1 9 5876 1 1 6 LEU CG C 0.137 10.941 -0.177 1.00 . A A . 6 LEU CG 1 1 9 5877 1 1 6 LEU H H -1.217 8.975 2.476 1.00 . A A . 6 LEU H 1 1 9 5878 1 1 6 LEU HA H 1.379 9.008 0.989 1.00 . A A . 6 LEU HA 1 1 9 5879 1 1 6 LEU HB2 H -0.516 11.181 1.851 1.00 . A A . 6 LEU HB2 1 1 9 5880 1 1 6 LEU HB3 H 1.188 11.549 1.589 1.00 . A A . 6 LEU HB3 1 1 9 5881 1 1 6 LEU HD11 H 1.922 12.059 -0.583 1.00 . A A . 6 LEU HD11 1 1 9 5882 1 1 6 LEU HD12 H 1.305 11.152 -1.964 1.00 . A A . 6 LEU HD12 1 1 9 5883 1 1 6 LEU HD13 H 2.129 10.309 -0.650 1.00 . A A . 6 LEU HD13 1 1 9 5884 1 1 6 LEU HD21 H 0.207 8.844 -0.653 1.00 . A A . 6 LEU HD21 1 1 9 5885 1 1 6 LEU HD22 H -0.893 9.781 -1.668 1.00 . A A . 6 LEU HD22 1 1 9 5886 1 1 6 LEU HD23 H -1.343 9.390 -0.008 1.00 . A A . 6 LEU HD23 1 1 9 5887 1 1 6 LEU HG H -0.509 11.779 -0.392 1.00 . A A . 6 LEU HG 1 1 9 5888 1 1 6 LEU N N -0.495 8.657 1.889 1.00 . A A . 6 LEU N 1 1 9 5889 1 1 6 LEU O O 2.472 10.210 3.225 1.00 . A A . 6 LEU O 1 1 9 5890 1 1 7 HIS C C 1.609 7.407 6.017 1.00 . A A . 7 HIS C 1 1 9 5891 1 1 7 HIS CA C 1.731 8.782 5.364 1.00 . A A . 7 HIS CA 1 1 9 5892 1 1 7 HIS CB C 1.079 9.846 6.251 1.00 . A A . 7 HIS CB 1 1 9 5893 1 1 7 HIS CD2 C -0.558 11.105 4.627 1.00 . A A . 7 HIS CD2 1 1 9 5894 1 1 7 HIS CE1 C 0.596 12.912 4.341 1.00 . A A . 7 HIS CE1 1 1 9 5895 1 1 7 HIS CG C 0.579 10.971 5.384 1.00 . A A . 7 HIS CG 1 1 9 5896 1 1 7 HIS H H 0.252 8.204 3.909 1.00 . A A . 7 HIS H 1 1 9 5897 1 1 7 HIS HA H 2.773 9.022 5.222 1.00 . A A . 7 HIS HA 1 1 9 5898 1 1 7 HIS HB2 H 0.252 9.408 6.790 1.00 . A A . 7 HIS HB2 1 1 9 5899 1 1 7 HIS HB3 H 1.806 10.226 6.952 1.00 . A A . 7 HIS HB3 1 1 9 5900 1 1 7 HIS HD1 H 2.165 12.360 5.592 1.00 . A A . 7 HIS HD1 1 1 9 5901 1 1 7 HIS HD2 H -1.339 10.366 4.545 1.00 . A A . 7 HIS HD2 1 1 9 5902 1 1 7 HIS HE1 H 0.921 13.880 3.989 1.00 . A A . 7 HIS HE1 1 1 9 5903 1 1 7 HIS N N 1.045 8.763 4.044 1.00 . A A . 7 HIS N 1 1 9 5904 1 1 7 HIS ND1 N 1.301 12.138 5.188 1.00 . A A . 7 HIS ND1 1 1 9 5905 1 1 7 HIS NE2 N -0.546 12.330 3.970 1.00 . A A . 7 HIS NE2 1 1 9 5906 1 1 7 HIS O O 1.860 7.243 7.195 1.00 . A A . 7 HIS O 1 1 9 5907 1 1 8 SER C C 1.154 4.027 4.698 1.00 . A A . 8 SER C 1 1 9 5908 1 1 8 SER CA C 1.107 5.048 5.829 1.00 . A A . 8 SER CA 1 1 9 5909 1 1 8 SER CB C -0.219 4.924 6.582 1.00 . A A . 8 SER CB 1 1 9 5910 1 1 8 SER H H 1.043 6.567 4.308 1.00 . A A . 8 SER H 1 1 9 5911 1 1 8 SER HA H 1.927 4.866 6.503 1.00 . A A . 8 SER HA 1 1 9 5912 1 1 8 SER HB2 H -0.373 5.801 7.189 1.00 . A A . 8 SER HB2 1 1 9 5913 1 1 8 SER HB3 H -1.029 4.836 5.870 1.00 . A A . 8 SER HB3 1 1 9 5914 1 1 8 SER HG H 0.656 3.788 7.896 1.00 . A A . 8 SER HG 1 1 9 5915 1 1 8 SER N N 1.234 6.415 5.257 1.00 . A A . 8 SER N 1 1 9 5916 1 1 8 SER O O 1.756 2.978 4.820 1.00 . A A . 8 SER O 1 1 9 5917 1 1 8 SER OG O -0.177 3.777 7.419 1.00 . A A . 8 SER OG 1 1 9 5918 1 1 9 ALA C C 1.997 3.179 2.005 1.00 . A A . 9 ALA C 1 1 9 5919 1 1 9 ALA CA C 0.557 3.373 2.457 1.00 . A A . 9 ALA CA 1 1 9 5920 1 1 9 ALA CB C -0.258 3.929 1.298 1.00 . A A . 9 ALA CB 1 1 9 5921 1 1 9 ALA H H 0.060 5.180 3.510 1.00 . A A . 9 ALA H 1 1 9 5922 1 1 9 ALA HA H 0.145 2.426 2.770 1.00 . A A . 9 ALA HA 1 1 9 5923 1 1 9 ALA HB1 H -1.305 3.911 1.553 1.00 . A A . 9 ALA HB1 1 1 9 5924 1 1 9 ALA HB2 H -0.092 3.321 0.425 1.00 . A A . 9 ALA HB2 1 1 9 5925 1 1 9 ALA HB3 H 0.048 4.949 1.091 1.00 . A A . 9 ALA HB3 1 1 9 5926 1 1 9 ALA N N 0.533 4.327 3.594 1.00 . A A . 9 ALA N 1 1 9 5927 1 1 9 ALA O O 2.542 2.104 2.123 1.00 . A A . 9 ALA O 1 1 9 5928 1 1 10 LYS C C 4.777 3.018 1.729 1.00 . A A . 10 LYS C 1 1 9 5929 1 1 10 LYS CA C 4.024 4.137 1.003 1.00 . A A . 10 LYS CA 1 1 9 5930 1 1 10 LYS CB C 4.734 5.461 1.274 1.00 . A A . 10 LYS CB 1 1 9 5931 1 1 10 LYS CD C 6.680 6.742 0.375 1.00 . A A . 10 LYS CD 1 1 9 5932 1 1 10 LYS CE C 7.677 5.825 1.086 1.00 . A A . 10 LYS CE 1 1 9 5933 1 1 10 LYS CG C 5.429 5.944 0.000 1.00 . A A . 10 LYS CG 1 1 9 5934 1 1 10 LYS H H 2.112 5.075 1.406 1.00 . A A . 10 LYS H 1 1 9 5935 1 1 10 LYS HA H 4.030 3.941 -0.059 1.00 . A A . 10 LYS HA 1 1 9 5936 1 1 10 LYS HB2 H 4.012 6.198 1.595 1.00 . A A . 10 LYS HB2 1 1 9 5937 1 1 10 LYS HB3 H 5.472 5.317 2.049 1.00 . A A . 10 LYS HB3 1 1 9 5938 1 1 10 LYS HD2 H 7.133 7.142 -0.521 1.00 . A A . 10 LYS HD2 1 1 9 5939 1 1 10 LYS HD3 H 6.406 7.552 1.033 1.00 . A A . 10 LYS HD3 1 1 9 5940 1 1 10 LYS HE2 H 7.622 5.993 2.153 1.00 . A A . 10 LYS HE2 1 1 9 5941 1 1 10 LYS HE3 H 7.435 4.795 0.871 1.00 . A A . 10 LYS HE3 1 1 9 5942 1 1 10 LYS HG2 H 5.712 5.091 -0.601 1.00 . A A . 10 LYS HG2 1 1 9 5943 1 1 10 LYS HG3 H 4.757 6.574 -0.562 1.00 . A A . 10 LYS HG3 1 1 9 5944 1 1 10 LYS HZ1 H 9.007 6.566 -0.332 1.00 . A A . 10 LYS HZ1 1 1 9 5945 1 1 10 LYS HZ2 H 9.599 5.237 0.545 1.00 . A A . 10 LYS HZ2 1 1 9 5946 1 1 10 LYS HZ3 H 9.522 6.772 1.270 1.00 . A A . 10 LYS HZ3 1 1 9 5947 1 1 10 LYS N N 2.603 4.222 1.484 1.00 . A A . 10 LYS N 1 1 9 5948 1 1 10 LYS NZ N 9.055 6.123 0.606 1.00 . A A . 10 LYS NZ 1 1 9 5949 1 1 10 LYS O O 5.343 2.139 1.113 1.00 . A A . 10 LYS O 1 1 9 5950 1 1 11 LYS C C 5.063 0.605 3.217 1.00 . A A . 11 LYS C 1 1 9 5951 1 1 11 LYS CA C 5.487 1.961 3.781 1.00 . A A . 11 LYS CA 1 1 9 5952 1 1 11 LYS CB C 5.122 2.041 5.265 1.00 . A A . 11 LYS CB 1 1 9 5953 1 1 11 LYS CD C 7.046 2.860 6.631 1.00 . A A . 11 LYS CD 1 1 9 5954 1 1 11 LYS CE C 7.728 4.098 7.215 1.00 . A A . 11 LYS CE 1 1 9 5955 1 1 11 LYS CG C 5.776 3.277 5.886 1.00 . A A . 11 LYS CG 1 1 9 5956 1 1 11 LYS H H 4.311 3.747 3.518 1.00 . A A . 11 LYS H 1 1 9 5957 1 1 11 LYS HA H 6.553 2.080 3.660 1.00 . A A . 11 LYS HA 1 1 9 5958 1 1 11 LYS HB2 H 4.049 2.108 5.369 1.00 . A A . 11 LYS HB2 1 1 9 5959 1 1 11 LYS HB3 H 5.478 1.155 5.771 1.00 . A A . 11 LYS HB3 1 1 9 5960 1 1 11 LYS HD2 H 6.788 2.181 7.431 1.00 . A A . 11 LYS HD2 1 1 9 5961 1 1 11 LYS HD3 H 7.721 2.369 5.946 1.00 . A A . 11 LYS HD3 1 1 9 5962 1 1 11 LYS HE2 H 8.381 4.534 6.472 1.00 . A A . 11 LYS HE2 1 1 9 5963 1 1 11 LYS HE3 H 6.978 4.820 7.503 1.00 . A A . 11 LYS HE3 1 1 9 5964 1 1 11 LYS HG2 H 6.029 3.981 5.107 1.00 . A A . 11 LYS HG2 1 1 9 5965 1 1 11 LYS HG3 H 5.089 3.739 6.580 1.00 . A A . 11 LYS HG3 1 1 9 5966 1 1 11 LYS HZ1 H 7.889 3.504 9.203 1.00 . A A . 11 LYS HZ1 1 1 9 5967 1 1 11 LYS HZ2 H 9.167 4.486 8.668 1.00 . A A . 11 LYS HZ2 1 1 9 5968 1 1 11 LYS HZ3 H 9.086 2.857 8.191 1.00 . A A . 11 LYS HZ3 1 1 9 5969 1 1 11 LYS N N 4.778 3.035 3.033 1.00 . A A . 11 LYS N 1 1 9 5970 1 1 11 LYS NZ N 8.528 3.706 8.409 1.00 . A A . 11 LYS NZ 1 1 9 5971 1 1 11 LYS O O 5.858 -0.118 2.653 1.00 . A A . 11 LYS O 1 1 9 5972 1 1 12 PHE C C 3.323 -0.942 1.277 1.00 . A A . 12 PHE C 1 1 9 5973 1 1 12 PHE CA C 3.343 -1.040 2.803 1.00 . A A . 12 PHE CA 1 1 9 5974 1 1 12 PHE CB C 1.934 -1.343 3.322 1.00 . A A . 12 PHE CB 1 1 9 5975 1 1 12 PHE CD1 C 2.852 -0.842 5.616 1.00 . A A . 12 PHE CD1 1 1 9 5976 1 1 12 PHE CD2 C 0.565 -0.211 5.110 1.00 . A A . 12 PHE CD2 1 1 9 5977 1 1 12 PHE CE1 C 2.709 -0.324 6.908 1.00 . A A . 12 PHE CE1 1 1 9 5978 1 1 12 PHE CE2 C 0.423 0.306 6.402 1.00 . A A . 12 PHE CE2 1 1 9 5979 1 1 12 PHE CG C 1.780 -0.786 4.717 1.00 . A A . 12 PHE CG 1 1 9 5980 1 1 12 PHE CZ C 1.495 0.251 7.302 1.00 . A A . 12 PHE CZ 1 1 9 5981 1 1 12 PHE H H 3.180 0.861 3.798 1.00 . A A . 12 PHE H 1 1 9 5982 1 1 12 PHE HA H 4.020 -1.825 3.106 1.00 . A A . 12 PHE HA 1 1 9 5983 1 1 12 PHE HB2 H 1.203 -0.888 2.668 1.00 . A A . 12 PHE HB2 1 1 9 5984 1 1 12 PHE HB3 H 1.780 -2.415 3.346 1.00 . A A . 12 PHE HB3 1 1 9 5985 1 1 12 PHE HD1 H 3.788 -1.286 5.312 1.00 . A A . 12 PHE HD1 1 1 9 5986 1 1 12 PHE HD2 H -0.261 -0.167 4.416 1.00 . A A . 12 PHE HD2 1 1 9 5987 1 1 12 PHE HE1 H 3.536 -0.368 7.602 1.00 . A A . 12 PHE HE1 1 1 9 5988 1 1 12 PHE HE2 H -0.514 0.750 6.706 1.00 . A A . 12 PHE HE2 1 1 9 5989 1 1 12 PHE HZ H 1.385 0.650 8.299 1.00 . A A . 12 PHE HZ 1 1 9 5990 1 1 12 PHE N N 3.812 0.261 3.350 1.00 . A A . 12 PHE N 1 1 9 5991 1 1 12 PHE O O 3.641 -1.879 0.579 1.00 . A A . 12 PHE O 1 1 9 5992 1 1 13 GLY C C 4.192 -0.255 -1.320 1.00 . A A . 13 GLY C 1 1 9 5993 1 1 13 GLY CA C 2.930 0.362 -0.726 1.00 . A A . 13 GLY CA 1 1 9 5994 1 1 13 GLY H H 2.713 0.948 1.333 1.00 . A A . 13 GLY H 1 1 9 5995 1 1 13 GLY HA2 H 2.060 -0.133 -1.128 1.00 . A A . 13 GLY HA2 1 1 9 5996 1 1 13 GLY HA3 H 2.895 1.412 -0.973 1.00 . A A . 13 GLY HA3 1 1 9 5997 1 1 13 GLY N N 2.960 0.197 0.753 1.00 . A A . 13 GLY N 1 1 9 5998 1 1 13 GLY O O 4.181 -0.792 -2.410 1.00 . A A . 13 GLY O 1 1 9 5999 1 1 14 LYS C C 6.726 -2.191 -0.591 1.00 . A A . 14 LYS C 1 1 9 6000 1 1 14 LYS CA C 6.547 -0.771 -1.134 1.00 . A A . 14 LYS CA 1 1 9 6001 1 1 14 LYS CB C 7.729 0.094 -0.692 1.00 . A A . 14 LYS CB 1 1 9 6002 1 1 14 LYS CD C 6.451 1.932 -1.823 1.00 . A A . 14 LYS CD 1 1 9 6003 1 1 14 LYS CE C 6.588 3.272 -2.549 1.00 . A A . 14 LYS CE 1 1 9 6004 1 1 14 LYS CG C 7.839 1.328 -1.596 1.00 . A A . 14 LYS CG 1 1 9 6005 1 1 14 LYS H H 5.273 0.258 0.271 1.00 . A A . 14 LYS H 1 1 9 6006 1 1 14 LYS HA H 6.505 -0.802 -2.212 1.00 . A A . 14 LYS HA 1 1 9 6007 1 1 14 LYS HB2 H 7.578 0.409 0.330 1.00 . A A . 14 LYS HB2 1 1 9 6008 1 1 14 LYS HB3 H 8.639 -0.482 -0.760 1.00 . A A . 14 LYS HB3 1 1 9 6009 1 1 14 LYS HD2 H 5.857 1.256 -2.421 1.00 . A A . 14 LYS HD2 1 1 9 6010 1 1 14 LYS HD3 H 5.968 2.091 -0.872 1.00 . A A . 14 LYS HD3 1 1 9 6011 1 1 14 LYS HE2 H 5.608 3.634 -2.825 1.00 . A A . 14 LYS HE2 1 1 9 6012 1 1 14 LYS HE3 H 7.067 3.987 -1.898 1.00 . A A . 14 LYS HE3 1 1 9 6013 1 1 14 LYS HG2 H 8.478 2.061 -1.125 1.00 . A A . 14 LYS HG2 1 1 9 6014 1 1 14 LYS HG3 H 8.263 1.041 -2.545 1.00 . A A . 14 LYS HG3 1 1 9 6015 1 1 14 LYS HZ1 H 7.369 2.096 -4.078 1.00 . A A . 14 LYS HZ1 1 1 9 6016 1 1 14 LYS HZ2 H 8.399 3.350 -3.575 1.00 . A A . 14 LYS HZ2 1 1 9 6017 1 1 14 LYS HZ3 H 7.041 3.695 -4.537 1.00 . A A . 14 LYS HZ3 1 1 9 6018 1 1 14 LYS N N 5.284 -0.185 -0.609 1.00 . A A . 14 LYS N 1 1 9 6019 1 1 14 LYS NZ N 7.412 3.089 -3.777 1.00 . A A . 14 LYS NZ 1 1 9 6020 1 1 14 LYS O O 7.427 -2.999 -1.166 1.00 . A A . 14 LYS O 1 1 9 6021 1 1 15 ALA C C 5.070 -4.741 0.656 1.00 . A A . 15 ALA C 1 1 9 6022 1 1 15 ALA CA C 6.252 -3.871 1.087 1.00 . A A . 15 ALA CA 1 1 9 6023 1 1 15 ALA CB C 6.286 -3.787 2.615 1.00 . A A . 15 ALA CB 1 1 9 6024 1 1 15 ALA H H 5.547 -1.837 0.968 1.00 . A A . 15 ALA H 1 1 9 6025 1 1 15 ALA HA H 7.171 -4.311 0.731 1.00 . A A . 15 ALA HA 1 1 9 6026 1 1 15 ALA HB1 H 5.522 -4.431 3.027 1.00 . A A . 15 ALA HB1 1 1 9 6027 1 1 15 ALA HB2 H 6.102 -2.769 2.923 1.00 . A A . 15 ALA HB2 1 1 9 6028 1 1 15 ALA HB3 H 7.255 -4.104 2.972 1.00 . A A . 15 ALA HB3 1 1 9 6029 1 1 15 ALA N N 6.106 -2.503 0.514 1.00 . A A . 15 ALA N 1 1 9 6030 1 1 15 ALA O O 5.237 -5.856 0.204 1.00 . A A . 15 ALA O 1 1 9 6031 1 1 16 TRP C C 2.765 -5.318 -1.109 1.00 . A A . 16 TRP C 1 1 9 6032 1 1 16 TRP CA C 2.684 -5.025 0.389 1.00 . A A . 16 TRP CA 1 1 9 6033 1 1 16 TRP CB C 1.406 -4.231 0.733 1.00 . A A . 16 TRP CB 1 1 9 6034 1 1 16 TRP CD1 C 0.944 -2.047 -0.470 1.00 . A A . 16 TRP CD1 1 1 9 6035 1 1 16 TRP CD2 C 0.468 -3.846 -1.712 1.00 . A A . 16 TRP CD2 1 1 9 6036 1 1 16 TRP CE2 C 0.177 -2.724 -2.515 1.00 . A A . 16 TRP CE2 1 1 9 6037 1 1 16 TRP CE3 C 0.257 -5.118 -2.244 1.00 . A A . 16 TRP CE3 1 1 9 6038 1 1 16 TRP CG C 0.965 -3.396 -0.431 1.00 . A A . 16 TRP CG 1 1 9 6039 1 1 16 TRP CH2 C -0.513 -4.148 -4.335 1.00 . A A . 16 TRP CH2 1 1 9 6040 1 1 16 TRP CZ2 C -0.310 -2.865 -3.816 1.00 . A A . 16 TRP CZ2 1 1 9 6041 1 1 16 TRP CZ3 C -0.230 -5.271 -3.544 1.00 . A A . 16 TRP CZ3 1 1 9 6042 1 1 16 TRP H H 3.761 -3.335 1.154 1.00 . A A . 16 TRP H 1 1 9 6043 1 1 16 TRP HA H 2.675 -5.959 0.929 1.00 . A A . 16 TRP HA 1 1 9 6044 1 1 16 TRP HB2 H 0.619 -4.923 0.991 1.00 . A A . 16 TRP HB2 1 1 9 6045 1 1 16 TRP HB3 H 1.606 -3.590 1.579 1.00 . A A . 16 TRP HB3 1 1 9 6046 1 1 16 TRP HD1 H 1.243 -1.391 0.332 1.00 . A A . 16 TRP HD1 1 1 9 6047 1 1 16 TRP HE1 H 0.378 -0.716 -2.004 1.00 . A A . 16 TRP HE1 1 1 9 6048 1 1 16 TRP HE3 H 0.469 -5.986 -1.638 1.00 . A A . 16 TRP HE3 1 1 9 6049 1 1 16 TRP HH2 H -0.885 -4.277 -5.342 1.00 . A A . 16 TRP HH2 1 1 9 6050 1 1 16 TRP HZ2 H -0.525 -1.993 -4.416 1.00 . A A . 16 TRP HZ2 1 1 9 6051 1 1 16 TRP HZ3 H -0.381 -6.256 -3.939 1.00 . A A . 16 TRP HZ3 1 1 9 6052 1 1 16 TRP N N 3.874 -4.237 0.791 1.00 . A A . 16 TRP N 1 1 9 6053 1 1 16 TRP NE1 N 0.482 -1.643 -1.712 1.00 . A A . 16 TRP NE1 1 1 9 6054 1 1 16 TRP O O 2.491 -6.412 -1.558 1.00 . A A . 16 TRP O 1 1 9 6055 1 1 17 VAL C C 4.372 -5.579 -3.604 1.00 . A A . 17 VAL C 1 1 9 6056 1 1 17 VAL CA C 3.224 -4.601 -3.354 1.00 . A A . 17 VAL CA 1 1 9 6057 1 1 17 VAL CB C 3.443 -3.266 -4.092 1.00 . A A . 17 VAL CB 1 1 9 6058 1 1 17 VAL CG1 C 4.935 -3.012 -4.344 1.00 . A A . 17 VAL CG1 1 1 9 6059 1 1 17 VAL CG2 C 2.701 -3.304 -5.428 1.00 . A A . 17 VAL CG2 1 1 9 6060 1 1 17 VAL H H 3.351 -3.468 -1.527 1.00 . A A . 17 VAL H 1 1 9 6061 1 1 17 VAL HA H 2.300 -5.059 -3.685 1.00 . A A . 17 VAL HA 1 1 9 6062 1 1 17 VAL HB H 3.048 -2.462 -3.488 1.00 . A A . 17 VAL HB 1 1 9 6063 1 1 17 VAL HG11 H 5.051 -2.129 -4.955 1.00 . A A . 17 VAL HG11 1 1 9 6064 1 1 17 VAL HG12 H 5.365 -3.862 -4.852 1.00 . A A . 17 VAL HG12 1 1 9 6065 1 1 17 VAL HG13 H 5.439 -2.865 -3.399 1.00 . A A . 17 VAL HG13 1 1 9 6066 1 1 17 VAL HG21 H 3.326 -3.773 -6.173 1.00 . A A . 17 VAL HG21 1 1 9 6067 1 1 17 VAL HG22 H 2.464 -2.298 -5.737 1.00 . A A . 17 VAL HG22 1 1 9 6068 1 1 17 VAL HG23 H 1.788 -3.872 -5.314 1.00 . A A . 17 VAL HG23 1 1 9 6069 1 1 17 VAL N N 3.135 -4.351 -1.895 1.00 . A A . 17 VAL N 1 1 9 6070 1 1 17 VAL O O 4.208 -6.592 -4.253 1.00 . A A . 17 VAL O 1 1 9 6071 1 1 18 GLY C C 6.202 -7.633 -2.715 1.00 . A A . 18 GLY C 1 1 9 6072 1 1 18 GLY CA C 6.653 -6.262 -3.226 1.00 . A A . 18 GLY CA 1 1 9 6073 1 1 18 GLY H H 5.632 -4.510 -2.499 1.00 . A A . 18 GLY H 1 1 9 6074 1 1 18 GLY HA2 H 6.915 -6.328 -4.273 1.00 . A A . 18 GLY HA2 1 1 9 6075 1 1 18 GLY HA3 H 7.505 -5.928 -2.654 1.00 . A A . 18 GLY HA3 1 1 9 6076 1 1 18 GLY N N 5.524 -5.311 -3.052 1.00 . A A . 18 GLY N 1 1 9 6077 1 1 18 GLY O O 6.815 -8.646 -2.985 1.00 . A A . 18 GLY O 1 1 9 6078 1 1 19 GLU C C 3.643 -9.525 -2.490 1.00 . A A . 19 GLU C 1 1 9 6079 1 1 19 GLU CA C 4.586 -8.934 -1.453 1.00 . A A . 19 GLU CA 1 1 9 6080 1 1 19 GLU CB C 3.814 -8.631 -0.162 1.00 . A A . 19 GLU CB 1 1 9 6081 1 1 19 GLU CD C 3.411 -11.082 0.088 1.00 . A A . 19 GLU CD 1 1 9 6082 1 1 19 GLU CG C 2.754 -9.702 0.092 1.00 . A A . 19 GLU CG 1 1 9 6083 1 1 19 GLU H H 4.636 -6.839 -1.786 1.00 . A A . 19 GLU H 1 1 9 6084 1 1 19 GLU HA H 5.393 -9.619 -1.255 1.00 . A A . 19 GLU HA 1 1 9 6085 1 1 19 GLU HB2 H 4.501 -8.601 0.670 1.00 . A A . 19 GLU HB2 1 1 9 6086 1 1 19 GLU HB3 H 3.324 -7.672 -0.261 1.00 . A A . 19 GLU HB3 1 1 9 6087 1 1 19 GLU HG2 H 2.286 -9.523 1.048 1.00 . A A . 19 GLU HG2 1 1 9 6088 1 1 19 GLU HG3 H 2.009 -9.654 -0.687 1.00 . A A . 19 GLU HG3 1 1 9 6089 1 1 19 GLU N N 5.116 -7.661 -1.983 1.00 . A A . 19 GLU N 1 1 9 6090 1 1 19 GLU O O 3.939 -10.515 -3.131 1.00 . A A . 19 GLU O 1 1 9 6091 1 1 19 GLU OE1 O 3.608 -11.621 -0.989 1.00 . A A . 19 GLU OE1 1 1 9 6092 1 1 19 GLU OE2 O 3.708 -11.578 1.163 1.00 . A A . 19 GLU OE2 1 1 9 6093 1 1 20 ILE C C 2.056 -9.215 -5.052 1.00 . A A . 20 ILE C 1 1 9 6094 1 1 20 ILE CA C 1.533 -9.461 -3.640 1.00 . A A . 20 ILE CA 1 1 9 6095 1 1 20 ILE CB C 0.199 -8.748 -3.479 1.00 . A A . 20 ILE CB 1 1 9 6096 1 1 20 ILE CD1 C -1.448 -7.996 -1.768 1.00 . A A . 20 ILE CD1 1 1 9 6097 1 1 20 ILE CG1 C -0.387 -9.047 -2.100 1.00 . A A . 20 ILE CG1 1 1 9 6098 1 1 20 ILE CG2 C -0.771 -9.221 -4.562 1.00 . A A . 20 ILE CG2 1 1 9 6099 1 1 20 ILE H H 2.272 -8.130 -2.118 1.00 . A A . 20 ILE H 1 1 9 6100 1 1 20 ILE HA H 1.407 -10.513 -3.476 1.00 . A A . 20 ILE HA 1 1 9 6101 1 1 20 ILE HB H 0.360 -7.692 -3.578 1.00 . A A . 20 ILE HB 1 1 9 6102 1 1 20 ILE HD11 H -1.274 -7.609 -0.775 1.00 . A A . 20 ILE HD11 1 1 9 6103 1 1 20 ILE HD12 H -2.428 -8.447 -1.812 1.00 . A A . 20 ILE HD12 1 1 9 6104 1 1 20 ILE HD13 H -1.391 -7.189 -2.483 1.00 . A A . 20 ILE HD13 1 1 9 6105 1 1 20 ILE HG12 H -0.838 -10.030 -2.105 1.00 . A A . 20 ILE HG12 1 1 9 6106 1 1 20 ILE HG13 H 0.398 -9.010 -1.358 1.00 . A A . 20 ILE HG13 1 1 9 6107 1 1 20 ILE HG21 H -0.470 -10.196 -4.915 1.00 . A A . 20 ILE HG21 1 1 9 6108 1 1 20 ILE HG22 H -0.759 -8.521 -5.385 1.00 . A A . 20 ILE HG22 1 1 9 6109 1 1 20 ILE HG23 H -1.769 -9.278 -4.153 1.00 . A A . 20 ILE HG23 1 1 9 6110 1 1 20 ILE N N 2.499 -8.927 -2.654 1.00 . A A . 20 ILE N 1 1 9 6111 1 1 20 ILE O O 2.062 -10.099 -5.886 1.00 . A A . 20 ILE O 1 1 9 6112 1 1 21 MET C C 4.063 -8.745 -7.073 1.00 . A A . 21 MET C 1 1 9 6113 1 1 21 MET CA C 2.996 -7.716 -6.692 1.00 . A A . 21 MET CA 1 1 9 6114 1 1 21 MET CB C 3.596 -6.309 -6.721 1.00 . A A . 21 MET CB 1 1 9 6115 1 1 21 MET CE C 5.749 -4.893 -8.612 1.00 . A A . 21 MET CE 1 1 9 6116 1 1 21 MET CG C 3.195 -5.614 -8.022 1.00 . A A . 21 MET CG 1 1 9 6117 1 1 21 MET H H 2.467 -7.317 -4.644 1.00 . A A . 21 MET H 1 1 9 6118 1 1 21 MET HA H 2.177 -7.767 -7.396 1.00 . A A . 21 MET HA 1 1 9 6119 1 1 21 MET HB2 H 3.222 -5.741 -5.880 1.00 . A A . 21 MET HB2 1 1 9 6120 1 1 21 MET HB3 H 4.674 -6.374 -6.666 1.00 . A A . 21 MET HB3 1 1 9 6121 1 1 21 MET HE1 H 5.581 -4.750 -7.554 1.00 . A A . 21 MET HE1 1 1 9 6122 1 1 21 MET HE2 H 5.737 -3.936 -9.108 1.00 . A A . 21 MET HE2 1 1 9 6123 1 1 21 MET HE3 H 6.708 -5.366 -8.770 1.00 . A A . 21 MET HE3 1 1 9 6124 1 1 21 MET HG2 H 2.237 -5.994 -8.351 1.00 . A A . 21 MET HG2 1 1 9 6125 1 1 21 MET HG3 H 3.123 -4.548 -7.856 1.00 . A A . 21 MET HG3 1 1 9 6126 1 1 21 MET N N 2.485 -8.018 -5.330 1.00 . A A . 21 MET N 1 1 9 6127 1 1 21 MET O O 4.359 -8.945 -8.234 1.00 . A A . 21 MET O 1 1 9 6128 1 1 21 MET SD S 4.442 -5.944 -9.293 1.00 . A A . 21 MET SD 1 1 9 6129 1 1 22 ASN C C 5.015 -11.771 -6.699 1.00 . A A . 22 ASN C 1 1 9 6130 1 1 22 ASN CA C 5.685 -10.424 -6.418 1.00 . A A . 22 ASN CA 1 1 9 6131 1 1 22 ASN CB C 6.632 -10.572 -5.227 1.00 . A A . 22 ASN CB 1 1 9 6132 1 1 22 ASN CG C 7.973 -9.916 -5.559 1.00 . A A . 22 ASN CG 1 1 9 6133 1 1 22 ASN H H 4.391 -9.232 -5.169 1.00 . A A . 22 ASN H 1 1 9 6134 1 1 22 ASN HA H 6.245 -10.110 -7.286 1.00 . A A . 22 ASN HA 1 1 9 6135 1 1 22 ASN HB2 H 6.198 -10.092 -4.361 1.00 . A A . 22 ASN HB2 1 1 9 6136 1 1 22 ASN HB3 H 6.789 -11.621 -5.020 1.00 . A A . 22 ASN HB3 1 1 9 6137 1 1 22 ASN HD21 H 7.202 -8.089 -5.696 1.00 . A A . 22 ASN HD21 1 1 9 6138 1 1 22 ASN HD22 H 8.881 -8.198 -5.974 1.00 . A A . 22 ASN HD22 1 1 9 6139 1 1 22 ASN N N 4.643 -9.405 -6.103 1.00 . A A . 22 ASN N 1 1 9 6140 1 1 22 ASN ND2 N 8.023 -8.628 -5.759 1.00 . A A . 22 ASN ND2 1 1 9 6141 1 1 22 ASN O O 5.469 -12.539 -7.525 1.00 . A A . 22 ASN O 1 1 9 6142 1 1 22 ASN OD1 O 8.985 -10.582 -5.638 1.00 . A A . 22 ASN OD1 1 1 9 6143 1 1 23 SER C C 1.933 -13.123 -6.986 1.00 . A A . 23 SER C 1 1 9 6144 1 1 23 SER CA C 3.249 -13.365 -6.245 1.00 . A A . 23 SER CA 1 1 9 6145 1 1 23 SER CB C 2.961 -14.028 -4.898 1.00 . A A . 23 SER CB 1 1 9 6146 1 1 23 SER H H 3.594 -11.434 -5.355 1.00 . A A . 23 SER H 1 1 9 6147 1 1 23 SER HA H 3.881 -14.012 -6.836 1.00 . A A . 23 SER HA 1 1 9 6148 1 1 23 SER HB2 H 2.321 -13.391 -4.310 1.00 . A A . 23 SER HB2 1 1 9 6149 1 1 23 SER HB3 H 2.466 -14.977 -5.063 1.00 . A A . 23 SER HB3 1 1 9 6150 1 1 23 SER HG H 4.583 -15.039 -4.537 1.00 . A A . 23 SER HG 1 1 9 6151 1 1 23 SER N N 3.943 -12.066 -6.018 1.00 . A A . 23 SER N 1 1 9 6152 1 1 23 SER O O 1.841 -13.522 -8.136 1.00 . A A . 23 SER O 1 1 9 6153 1 1 23 SER OXT O 1.039 -12.545 -6.391 1.00 . A A . 23 SER OXT 1 1 9 6154 1 1 23 SER OG O 4.185 -14.231 -4.204 1.00 . A A . 23 SER OG 1 1 9 6155 2 1 1 GLY C C 2.935 -12.453 8.061 1.00 . B B . 1 GLY C 1 1 9 6156 2 1 1 GLY CA C 3.889 -12.474 9.256 1.00 . B B . 1 GLY CA 1 1 9 6157 2 1 1 GLY H1 H 5.264 -13.890 9.922 1.00 . B B . 1 GLY H1 1 1 9 6158 2 1 1 GLY H2 H 5.782 -13.004 8.567 1.00 . B B . 1 GLY H2 1 1 9 6159 2 1 1 GLY H3 H 4.613 -14.225 8.393 1.00 . B B . 1 GLY H3 1 1 9 6160 2 1 1 GLY HA2 H 3.343 -12.742 10.150 1.00 . B B . 1 GLY HA2 1 1 9 6161 2 1 1 GLY HA3 H 4.326 -11.495 9.380 1.00 . B B . 1 GLY HA3 1 1 9 6162 2 1 1 GLY N N 4.968 -13.474 9.016 1.00 . B B . 1 GLY N 1 1 9 6163 2 1 1 GLY O O 2.205 -13.394 7.818 1.00 . B B . 1 GLY O 1 1 9 6164 2 1 2 ILE C C 0.574 -11.356 6.601 1.00 . B B . 2 ILE C 1 1 9 6165 2 1 2 ILE CA C 2.028 -11.298 6.133 1.00 . B B . 2 ILE CA 1 1 9 6166 2 1 2 ILE CB C 2.305 -12.462 5.181 1.00 . B B . 2 ILE CB 1 1 9 6167 2 1 2 ILE CD1 C 4.219 -14.037 4.885 1.00 . B B . 2 ILE CD1 1 1 9 6168 2 1 2 ILE CG1 C 3.810 -12.565 4.930 1.00 . B B . 2 ILE CG1 1 1 9 6169 2 1 2 ILE CG2 C 1.581 -12.217 3.855 1.00 . B B . 2 ILE CG2 1 1 9 6170 2 1 2 ILE H H 3.531 -10.637 7.528 1.00 . B B . 2 ILE H 1 1 9 6171 2 1 2 ILE HA H 2.201 -10.364 5.617 1.00 . B B . 2 ILE HA 1 1 9 6172 2 1 2 ILE HB H 1.947 -13.381 5.622 1.00 . B B . 2 ILE HB 1 1 9 6173 2 1 2 ILE HD11 H 3.835 -14.490 3.983 1.00 . B B . 2 ILE HD11 1 1 9 6174 2 1 2 ILE HD12 H 3.814 -14.550 5.745 1.00 . B B . 2 ILE HD12 1 1 9 6175 2 1 2 ILE HD13 H 5.296 -14.113 4.895 1.00 . B B . 2 ILE HD13 1 1 9 6176 2 1 2 ILE HG12 H 4.050 -12.094 3.986 1.00 . B B . 2 ILE HG12 1 1 9 6177 2 1 2 ILE HG13 H 4.343 -12.069 5.728 1.00 . B B . 2 ILE HG13 1 1 9 6178 2 1 2 ILE HG21 H 2.302 -11.955 3.094 1.00 . B B . 2 ILE HG21 1 1 9 6179 2 1 2 ILE HG22 H 0.874 -11.409 3.975 1.00 . B B . 2 ILE HG22 1 1 9 6180 2 1 2 ILE HG23 H 1.056 -13.114 3.561 1.00 . B B . 2 ILE HG23 1 1 9 6181 2 1 2 ILE N N 2.934 -11.385 7.312 1.00 . B B . 2 ILE N 1 1 9 6182 2 1 2 ILE O O -0.161 -12.264 6.270 1.00 . B B . 2 ILE O 1 1 9 6183 2 1 3 GLY C C -1.770 -8.938 7.830 1.00 . B B . 3 GLY C 1 1 9 6184 2 1 3 GLY CA C -1.254 -10.373 7.847 1.00 . B B . 3 GLY CA 1 1 9 6185 2 1 3 GLY H H 0.762 -9.660 7.610 1.00 . B B . 3 GLY H 1 1 9 6186 2 1 3 GLY HA2 H -1.864 -10.982 7.193 1.00 . B B . 3 GLY HA2 1 1 9 6187 2 1 3 GLY HA3 H -1.298 -10.760 8.854 1.00 . B B . 3 GLY HA3 1 1 9 6188 2 1 3 GLY N N 0.153 -10.386 7.362 1.00 . B B . 3 GLY N 1 1 9 6189 2 1 3 GLY O O -2.713 -8.591 8.512 1.00 . B B . 3 GLY O 1 1 9 6190 2 1 4 LYS C C -1.444 -6.252 5.489 1.00 . B B . 4 LYS C 1 1 9 6191 2 1 4 LYS CA C -1.595 -6.693 6.941 1.00 . B B . 4 LYS CA 1 1 9 6192 2 1 4 LYS CB C -0.726 -5.812 7.843 1.00 . B B . 4 LYS CB 1 1 9 6193 2 1 4 LYS CD C 1.066 -6.775 9.298 1.00 . B B . 4 LYS CD 1 1 9 6194 2 1 4 LYS CE C 1.644 -5.580 10.060 1.00 . B B . 4 LYS CE 1 1 9 6195 2 1 4 LYS CG C 0.709 -6.347 7.873 1.00 . B B . 4 LYS CG 1 1 9 6196 2 1 4 LYS H H -0.407 -8.425 6.494 1.00 . B B . 4 LYS H 1 1 9 6197 2 1 4 LYS HA H -2.630 -6.613 7.240 1.00 . B B . 4 LYS HA 1 1 9 6198 2 1 4 LYS HB2 H -0.723 -4.802 7.460 1.00 . B B . 4 LYS HB2 1 1 9 6199 2 1 4 LYS HB3 H -1.129 -5.815 8.845 1.00 . B B . 4 LYS HB3 1 1 9 6200 2 1 4 LYS HD2 H 0.176 -7.128 9.801 1.00 . B B . 4 LYS HD2 1 1 9 6201 2 1 4 LYS HD3 H 1.799 -7.567 9.264 1.00 . B B . 4 LYS HD3 1 1 9 6202 2 1 4 LYS HE2 H 2.700 -5.499 9.855 1.00 . B B . 4 LYS HE2 1 1 9 6203 2 1 4 LYS HE3 H 1.145 -4.676 9.742 1.00 . B B . 4 LYS HE3 1 1 9 6204 2 1 4 LYS HG2 H 0.793 -7.195 7.210 1.00 . B B . 4 LYS HG2 1 1 9 6205 2 1 4 LYS HG3 H 1.388 -5.572 7.553 1.00 . B B . 4 LYS HG3 1 1 9 6206 2 1 4 LYS HZ1 H 1.235 -4.857 11.969 1.00 . B B . 4 LYS HZ1 1 1 9 6207 2 1 4 LYS HZ2 H 2.294 -6.186 11.943 1.00 . B B . 4 LYS HZ2 1 1 9 6208 2 1 4 LYS HZ3 H 0.631 -6.414 11.677 1.00 . B B . 4 LYS HZ3 1 1 9 6209 2 1 4 LYS N N -1.157 -8.110 7.039 1.00 . B B . 4 LYS N 1 1 9 6210 2 1 4 LYS NZ N 1.435 -5.774 11.523 1.00 . B B . 4 LYS NZ 1 1 9 6211 2 1 4 LYS O O -2.340 -5.675 4.905 1.00 . B B . 4 LYS O 1 1 9 6212 2 1 5 TYR C C -1.113 -6.867 2.605 1.00 . B B . 5 TYR C 1 1 9 6213 2 1 5 TYR CA C -0.098 -6.154 3.489 1.00 . B B . 5 TYR CA 1 1 9 6214 2 1 5 TYR CB C 1.308 -6.564 3.071 1.00 . B B . 5 TYR CB 1 1 9 6215 2 1 5 TYR CD1 C 2.796 -4.860 4.189 1.00 . B B . 5 TYR CD1 1 1 9 6216 2 1 5 TYR CD2 C 2.711 -7.109 5.092 1.00 . B B . 5 TYR CD2 1 1 9 6217 2 1 5 TYR CE1 C 3.712 -4.496 5.182 1.00 . B B . 5 TYR CE1 1 1 9 6218 2 1 5 TYR CE2 C 3.626 -6.745 6.086 1.00 . B B . 5 TYR CE2 1 1 9 6219 2 1 5 TYR CG C 2.295 -6.167 4.144 1.00 . B B . 5 TYR CG 1 1 9 6220 2 1 5 TYR CZ C 4.127 -5.438 6.131 1.00 . B B . 5 TYR CZ 1 1 9 6221 2 1 5 TYR H H 0.388 -7.007 5.386 1.00 . B B . 5 TYR H 1 1 9 6222 2 1 5 TYR HA H -0.208 -5.095 3.377 1.00 . B B . 5 TYR HA 1 1 9 6223 2 1 5 TYR HB2 H 1.344 -7.635 2.924 1.00 . B B . 5 TYR HB2 1 1 9 6224 2 1 5 TYR HB3 H 1.557 -6.065 2.155 1.00 . B B . 5 TYR HB3 1 1 9 6225 2 1 5 TYR HD1 H 2.476 -4.133 3.456 1.00 . B B . 5 TYR HD1 1 1 9 6226 2 1 5 TYR HD2 H 2.325 -8.117 5.056 1.00 . B B . 5 TYR HD2 1 1 9 6227 2 1 5 TYR HE1 H 4.099 -3.488 5.218 1.00 . B B . 5 TYR HE1 1 1 9 6228 2 1 5 TYR HE2 H 3.948 -7.471 6.817 1.00 . B B . 5 TYR HE2 1 1 9 6229 2 1 5 TYR HH H 4.601 -4.443 7.688 1.00 . B B . 5 TYR HH 1 1 9 6230 2 1 5 TYR N N -0.316 -6.535 4.900 1.00 . B B . 5 TYR N 1 1 9 6231 2 1 5 TYR O O -1.335 -6.488 1.472 1.00 . B B . 5 TYR O 1 1 9 6232 2 1 5 TYR OH O 5.030 -5.080 7.110 1.00 . B B . 5 TYR OH 1 1 9 6233 2 1 6 LEU C C -4.125 -8.391 2.795 1.00 . B B . 6 LEU C 1 1 9 6234 2 1 6 LEU CA C -2.710 -8.633 2.268 1.00 . B B . 6 LEU CA 1 1 9 6235 2 1 6 LEU CB C -2.392 -10.129 2.325 1.00 . B B . 6 LEU CB 1 1 9 6236 2 1 6 LEU CD1 C -1.966 -10.760 -0.056 1.00 . B B . 6 LEU CD1 1 1 9 6237 2 1 6 LEU CD2 C -0.301 -9.339 1.157 1.00 . B B . 6 LEU CD2 1 1 9 6238 2 1 6 LEU CG C -1.311 -10.488 1.298 1.00 . B B . 6 LEU CG 1 1 9 6239 2 1 6 LEU H H -1.529 -8.208 4.016 1.00 . B B . 6 LEU H 1 1 9 6240 2 1 6 LEU HA H -2.638 -8.282 1.249 1.00 . B B . 6 LEU HA 1 1 9 6241 2 1 6 LEU HB2 H -2.040 -10.380 3.316 1.00 . B B . 6 LEU HB2 1 1 9 6242 2 1 6 LEU HB3 H -3.288 -10.692 2.111 1.00 . B B . 6 LEU HB3 1 1 9 6243 2 1 6 LEU HD11 H -1.293 -11.337 -0.671 1.00 . B B . 6 LEU HD11 1 1 9 6244 2 1 6 LEU HD12 H -2.189 -9.823 -0.543 1.00 . B B . 6 LEU HD12 1 1 9 6245 2 1 6 LEU HD13 H -2.881 -11.314 0.094 1.00 . B B . 6 LEU HD13 1 1 9 6246 2 1 6 LEU HD21 H -0.816 -8.443 0.843 1.00 . B B . 6 LEU HD21 1 1 9 6247 2 1 6 LEU HD22 H 0.442 -9.603 0.422 1.00 . B B . 6 LEU HD22 1 1 9 6248 2 1 6 LEU HD23 H 0.178 -9.163 2.109 1.00 . B B . 6 LEU HD23 1 1 9 6249 2 1 6 LEU HG H -0.795 -11.378 1.629 1.00 . B B . 6 LEU HG 1 1 9 6250 2 1 6 LEU N N -1.725 -7.903 3.102 1.00 . B B . 6 LEU N 1 1 9 6251 2 1 6 LEU O O -5.093 -8.866 2.235 1.00 . B B . 6 LEU O 1 1 9 6252 2 1 7 HIS C C -5.751 -5.929 4.783 1.00 . B B . 7 HIS C 1 1 9 6253 2 1 7 HIS CA C -5.616 -7.405 4.414 1.00 . B B . 7 HIS CA 1 1 9 6254 2 1 7 HIS CB C -5.834 -8.267 5.658 1.00 . B B . 7 HIS CB 1 1 9 6255 2 1 7 HIS CD2 C -4.216 -10.292 6.080 1.00 . B B . 7 HIS CD2 1 1 9 6256 2 1 7 HIS CE1 C -4.922 -11.595 4.500 1.00 . B B . 7 HIS CE1 1 1 9 6257 2 1 7 HIS CG C -5.227 -9.625 5.438 1.00 . B B . 7 HIS CG 1 1 9 6258 2 1 7 HIS H H -3.467 -7.287 4.308 1.00 . B B . 7 HIS H 1 1 9 6259 2 1 7 HIS HA H -6.356 -7.657 3.669 1.00 . B B . 7 HIS HA 1 1 9 6260 2 1 7 HIS HB2 H -5.365 -7.796 6.510 1.00 . B B . 7 HIS HB2 1 1 9 6261 2 1 7 HIS HB3 H -6.893 -8.373 5.842 1.00 . B B . 7 HIS HB3 1 1 9 6262 2 1 7 HIS HD1 H -6.380 -10.290 3.791 1.00 . B B . 7 HIS HD1 1 1 9 6263 2 1 7 HIS HD2 H -3.655 -9.911 6.919 1.00 . B B . 7 HIS HD2 1 1 9 6264 2 1 7 HIS HE1 H -5.039 -12.438 3.835 1.00 . B B . 7 HIS HE1 1 1 9 6265 2 1 7 HIS N N -4.258 -7.662 3.865 1.00 . B B . 7 HIS N 1 1 9 6266 2 1 7 HIS ND1 N -5.663 -10.473 4.433 1.00 . B B . 7 HIS ND1 1 1 9 6267 2 1 7 HIS NE2 N -4.025 -11.537 5.487 1.00 . B B . 7 HIS NE2 1 1 9 6268 2 1 7 HIS O O -6.616 -5.549 5.547 1.00 . B B . 7 HIS O 1 1 9 6269 2 1 8 SER C C -4.145 -2.825 3.616 1.00 . B B . 8 SER C 1 1 9 6270 2 1 8 SER CA C -5.005 -3.641 4.578 1.00 . B B . 8 SER CA 1 1 9 6271 2 1 8 SER CB C -4.527 -3.411 6.013 1.00 . B B . 8 SER CB 1 1 9 6272 2 1 8 SER H H -4.213 -5.408 3.632 1.00 . B B . 8 SER H 1 1 9 6273 2 1 8 SER HA H -6.030 -3.325 4.486 1.00 . B B . 8 SER HA 1 1 9 6274 2 1 8 SER HB2 H -4.089 -4.317 6.397 1.00 . B B . 8 SER HB2 1 1 9 6275 2 1 8 SER HB3 H -3.787 -2.623 6.023 1.00 . B B . 8 SER HB3 1 1 9 6276 2 1 8 SER HG H -6.041 -2.267 6.444 1.00 . B B . 8 SER HG 1 1 9 6277 2 1 8 SER N N -4.907 -5.088 4.248 1.00 . B B . 8 SER N 1 1 9 6278 2 1 8 SER O O -4.512 -1.741 3.209 1.00 . B B . 8 SER O 1 1 9 6279 2 1 8 SER OG O -5.637 -3.049 6.826 1.00 . B B . 8 SER OG 1 1 9 6280 2 1 9 ALA C C -2.808 -2.476 0.946 1.00 . B B . 9 ALA C 1 1 9 6281 2 1 9 ALA CA C -2.133 -2.568 2.309 1.00 . B B . 9 ALA CA 1 1 9 6282 2 1 9 ALA CB C -0.798 -3.281 2.151 1.00 . B B . 9 ALA CB 1 1 9 6283 2 1 9 ALA H H -2.719 -4.205 3.582 1.00 . B B . 9 ALA H 1 1 9 6284 2 1 9 ALA HA H -1.967 -1.574 2.698 1.00 . B B . 9 ALA HA 1 1 9 6285 2 1 9 ALA HB1 H -0.289 -3.306 3.101 1.00 . B B . 9 ALA HB1 1 1 9 6286 2 1 9 ALA HB2 H -0.198 -2.746 1.437 1.00 . B B . 9 ALA HB2 1 1 9 6287 2 1 9 ALA HB3 H -0.963 -4.297 1.799 1.00 . B B . 9 ALA HB3 1 1 9 6288 2 1 9 ALA N N -3.003 -3.329 3.245 1.00 . B B . 9 ALA N 1 1 9 6289 2 1 9 ALA O O -3.113 -1.401 0.470 1.00 . B B . 9 ALA O 1 1 9 6290 2 1 10 LYS C C -4.722 -2.482 -1.109 1.00 . B B . 10 LYS C 1 1 9 6291 2 1 10 LYS CA C -3.681 -3.601 -1.032 1.00 . B B . 10 LYS CA 1 1 9 6292 2 1 10 LYS CB C -4.373 -4.943 -1.271 1.00 . B B . 10 LYS CB 1 1 9 6293 2 1 10 LYS CD C -4.213 -5.389 -3.723 1.00 . B B . 10 LYS CD 1 1 9 6294 2 1 10 LYS CE C -5.562 -6.093 -3.877 1.00 . B B . 10 LYS CE 1 1 9 6295 2 1 10 LYS CG C -3.620 -5.719 -2.352 1.00 . B B . 10 LYS CG 1 1 9 6296 2 1 10 LYS H H -2.754 -4.449 0.729 1.00 . B B . 10 LYS H 1 1 9 6297 2 1 10 LYS HA H -2.931 -3.445 -1.793 1.00 . B B . 10 LYS HA 1 1 9 6298 2 1 10 LYS HB2 H -4.381 -5.512 -0.354 1.00 . B B . 10 LYS HB2 1 1 9 6299 2 1 10 LYS HB3 H -5.387 -4.767 -1.598 1.00 . B B . 10 LYS HB3 1 1 9 6300 2 1 10 LYS HD2 H -4.352 -4.321 -3.807 1.00 . B B . 10 LYS HD2 1 1 9 6301 2 1 10 LYS HD3 H -3.542 -5.728 -4.498 1.00 . B B . 10 LYS HD3 1 1 9 6302 2 1 10 LYS HE2 H -6.187 -5.864 -3.027 1.00 . B B . 10 LYS HE2 1 1 9 6303 2 1 10 LYS HE3 H -6.044 -5.752 -4.782 1.00 . B B . 10 LYS HE3 1 1 9 6304 2 1 10 LYS HG2 H -2.575 -5.440 -2.334 1.00 . B B . 10 LYS HG2 1 1 9 6305 2 1 10 LYS HG3 H -3.713 -6.779 -2.167 1.00 . B B . 10 LYS HG3 1 1 9 6306 2 1 10 LYS HZ1 H -5.559 -7.898 -4.916 1.00 . B B . 10 LYS HZ1 1 1 9 6307 2 1 10 LYS HZ2 H -5.977 -8.043 -3.276 1.00 . B B . 10 LYS HZ2 1 1 9 6308 2 1 10 LYS HZ3 H -4.358 -7.785 -3.723 1.00 . B B . 10 LYS HZ3 1 1 9 6309 2 1 10 LYS N N -3.029 -3.601 0.315 1.00 . B B . 10 LYS N 1 1 9 6310 2 1 10 LYS NZ N -5.348 -7.566 -3.954 1.00 . B B . 10 LYS NZ 1 1 9 6311 2 1 10 LYS O O -4.760 -1.723 -2.058 1.00 . B B . 10 LYS O 1 1 9 6312 2 1 11 LYS C C -5.867 0.046 -0.411 1.00 . B B . 11 LYS C 1 1 9 6313 2 1 11 LYS CA C -6.579 -1.276 -0.138 1.00 . B B . 11 LYS CA 1 1 9 6314 2 1 11 LYS CB C -7.293 -1.208 1.214 1.00 . B B . 11 LYS CB 1 1 9 6315 2 1 11 LYS CD C -8.885 -2.624 2.519 1.00 . B B . 11 LYS CD 1 1 9 6316 2 1 11 LYS CE C -9.159 -4.034 3.046 1.00 . B B . 11 LYS CE 1 1 9 6317 2 1 11 LYS CG C -7.586 -2.625 1.710 1.00 . B B . 11 LYS CG 1 1 9 6318 2 1 11 LYS H H -5.511 -2.974 0.648 1.00 . B B . 11 LYS H 1 1 9 6319 2 1 11 LYS HA H -7.298 -1.470 -0.921 1.00 . B B . 11 LYS HA 1 1 9 6320 2 1 11 LYS HB2 H -6.664 -0.699 1.928 1.00 . B B . 11 LYS HB2 1 1 9 6321 2 1 11 LYS HB3 H -8.222 -0.669 1.103 1.00 . B B . 11 LYS HB3 1 1 9 6322 2 1 11 LYS HD2 H -8.790 -1.940 3.349 1.00 . B B . 11 LYS HD2 1 1 9 6323 2 1 11 LYS HD3 H -9.703 -2.314 1.886 1.00 . B B . 11 LYS HD3 1 1 9 6324 2 1 11 LYS HE2 H -9.117 -4.738 2.229 1.00 . B B . 11 LYS HE2 1 1 9 6325 2 1 11 LYS HE3 H -8.415 -4.293 3.784 1.00 . B B . 11 LYS HE3 1 1 9 6326 2 1 11 LYS HG2 H -7.688 -3.289 0.863 1.00 . B B . 11 LYS HG2 1 1 9 6327 2 1 11 LYS HG3 H -6.775 -2.962 2.336 1.00 . B B . 11 LYS HG3 1 1 9 6328 2 1 11 LYS HZ1 H -11.019 -3.193 3.460 1.00 . B B . 11 LYS HZ1 1 1 9 6329 2 1 11 LYS HZ2 H -10.416 -4.187 4.699 1.00 . B B . 11 LYS HZ2 1 1 9 6330 2 1 11 LYS HZ3 H -11.047 -4.879 3.281 1.00 . B B . 11 LYS HZ3 1 1 9 6331 2 1 11 LYS N N -5.560 -2.361 -0.114 1.00 . B B . 11 LYS N 1 1 9 6332 2 1 11 LYS NZ N -10.512 -4.076 3.668 1.00 . B B . 11 LYS NZ 1 1 9 6333 2 1 11 LYS O O -6.169 0.744 -1.359 1.00 . B B . 11 LYS O 1 1 9 6334 2 1 12 PHE C C -3.316 1.497 -1.090 1.00 . B B . 12 PHE C 1 1 9 6335 2 1 12 PHE CA C -4.153 1.649 0.179 1.00 . B B . 12 PHE CA 1 1 9 6336 2 1 12 PHE CB C -3.232 1.918 1.369 1.00 . B B . 12 PHE CB 1 1 9 6337 2 1 12 PHE CD1 C -5.189 2.163 2.938 1.00 . B B . 12 PHE CD1 1 1 9 6338 2 1 12 PHE CD2 C -3.384 0.663 3.548 1.00 . B B . 12 PHE CD2 1 1 9 6339 2 1 12 PHE CE1 C -5.856 1.844 4.125 1.00 . B B . 12 PHE CE1 1 1 9 6340 2 1 12 PHE CE2 C -4.053 0.344 4.736 1.00 . B B . 12 PHE CE2 1 1 9 6341 2 1 12 PHE CG C -3.952 1.574 2.650 1.00 . B B . 12 PHE CG 1 1 9 6342 2 1 12 PHE CZ C -5.289 0.933 5.024 1.00 . B B . 12 PHE CZ 1 1 9 6343 2 1 12 PHE H H -4.666 -0.199 1.152 1.00 . B B . 12 PHE H 1 1 9 6344 2 1 12 PHE HA H -4.847 2.469 0.061 1.00 . B B . 12 PHE HA 1 1 9 6345 2 1 12 PHE HB2 H -2.344 1.308 1.281 1.00 . B B . 12 PHE HB2 1 1 9 6346 2 1 12 PHE HB3 H -2.955 2.963 1.382 1.00 . B B . 12 PHE HB3 1 1 9 6347 2 1 12 PHE HD1 H -5.627 2.865 2.243 1.00 . B B . 12 PHE HD1 1 1 9 6348 2 1 12 PHE HD2 H -2.430 0.209 3.326 1.00 . B B . 12 PHE HD2 1 1 9 6349 2 1 12 PHE HE1 H -6.811 2.299 4.347 1.00 . B B . 12 PHE HE1 1 1 9 6350 2 1 12 PHE HE2 H -3.614 -0.359 5.430 1.00 . B B . 12 PHE HE2 1 1 9 6351 2 1 12 PHE HZ H -5.804 0.686 5.941 1.00 . B B . 12 PHE HZ 1 1 9 6352 2 1 12 PHE N N -4.903 0.385 0.402 1.00 . B B . 12 PHE N 1 1 9 6353 2 1 12 PHE O O -3.069 2.447 -1.804 1.00 . B B . 12 PHE O 1 1 9 6354 2 1 13 GLY C C -2.710 0.825 -3.771 1.00 . B B . 13 GLY C 1 1 9 6355 2 1 13 GLY CA C -2.068 0.077 -2.604 1.00 . B B . 13 GLY CA 1 1 9 6356 2 1 13 GLY H H -3.099 -0.454 -0.791 1.00 . B B . 13 GLY H 1 1 9 6357 2 1 13 GLY HA2 H -1.065 0.440 -2.445 1.00 . B B . 13 GLY HA2 1 1 9 6358 2 1 13 GLY HA3 H -2.038 -0.977 -2.831 1.00 . B B . 13 GLY HA3 1 1 9 6359 2 1 13 GLY N N -2.883 0.299 -1.378 1.00 . B B . 13 GLY N 1 1 9 6360 2 1 13 GLY O O -2.042 1.477 -4.548 1.00 . B B . 13 GLY O 1 1 9 6361 2 1 14 LYS C C -5.041 2.866 -4.598 1.00 . B B . 14 LYS C 1 1 9 6362 2 1 14 LYS CA C -4.694 1.434 -5.016 1.00 . B B . 14 LYS CA 1 1 9 6363 2 1 14 LYS CB C -5.982 0.687 -5.362 1.00 . B B . 14 LYS CB 1 1 9 6364 2 1 14 LYS CD C -6.383 -0.607 -7.460 1.00 . B B . 14 LYS CD 1 1 9 6365 2 1 14 LYS CE C -5.686 -1.570 -8.423 1.00 . B B . 14 LYS CE 1 1 9 6366 2 1 14 LYS CG C -5.642 -0.596 -6.122 1.00 . B B . 14 LYS CG 1 1 9 6367 2 1 14 LYS H H -4.523 0.196 -3.260 1.00 . B B . 14 LYS H 1 1 9 6368 2 1 14 LYS HA H -4.047 1.457 -5.881 1.00 . B B . 14 LYS HA 1 1 9 6369 2 1 14 LYS HB2 H -6.508 0.439 -4.450 1.00 . B B . 14 LYS HB2 1 1 9 6370 2 1 14 LYS HB3 H -6.607 1.315 -5.978 1.00 . B B . 14 LYS HB3 1 1 9 6371 2 1 14 LYS HD2 H -7.403 -0.930 -7.303 1.00 . B B . 14 LYS HD2 1 1 9 6372 2 1 14 LYS HD3 H -6.380 0.386 -7.882 1.00 . B B . 14 LYS HD3 1 1 9 6373 2 1 14 LYS HE2 H -4.640 -1.312 -8.494 1.00 . B B . 14 LYS HE2 1 1 9 6374 2 1 14 LYS HE3 H -5.785 -2.580 -8.057 1.00 . B B . 14 LYS HE3 1 1 9 6375 2 1 14 LYS HG2 H -4.577 -0.639 -6.300 1.00 . B B . 14 LYS HG2 1 1 9 6376 2 1 14 LYS HG3 H -5.946 -1.452 -5.539 1.00 . B B . 14 LYS HG3 1 1 9 6377 2 1 14 LYS HZ1 H -7.307 -1.773 -9.712 1.00 . B B . 14 LYS HZ1 1 1 9 6378 2 1 14 LYS HZ2 H -5.802 -2.070 -10.440 1.00 . B B . 14 LYS HZ2 1 1 9 6379 2 1 14 LYS HZ3 H -6.281 -0.477 -10.093 1.00 . B B . 14 LYS HZ3 1 1 9 6380 2 1 14 LYS N N -4.004 0.732 -3.898 1.00 . B B . 14 LYS N 1 1 9 6381 2 1 14 LYS NZ N -6.317 -1.465 -9.769 1.00 . B B . 14 LYS NZ 1 1 9 6382 2 1 14 LYS O O -5.293 3.718 -5.428 1.00 . B B . 14 LYS O 1 1 9 6383 2 1 15 ALA C C -4.140 5.302 -2.544 1.00 . B B . 15 ALA C 1 1 9 6384 2 1 15 ALA CA C -5.413 4.517 -2.868 1.00 . B B . 15 ALA CA 1 1 9 6385 2 1 15 ALA CB C -6.295 4.437 -1.621 1.00 . B B . 15 ALA CB 1 1 9 6386 2 1 15 ALA H H -4.870 2.440 -2.666 1.00 . B B . 15 ALA H 1 1 9 6387 2 1 15 ALA HA H -5.949 5.025 -3.656 1.00 . B B . 15 ALA HA 1 1 9 6388 2 1 15 ALA HB1 H -7.065 3.695 -1.770 1.00 . B B . 15 ALA HB1 1 1 9 6389 2 1 15 ALA HB2 H -6.753 5.399 -1.440 1.00 . B B . 15 ALA HB2 1 1 9 6390 2 1 15 ALA HB3 H -5.691 4.161 -0.768 1.00 . B B . 15 ALA HB3 1 1 9 6391 2 1 15 ALA N N -5.067 3.139 -3.322 1.00 . B B . 15 ALA N 1 1 9 6392 2 1 15 ALA O O -4.194 6.453 -2.165 1.00 . B B . 15 ALA O 1 1 9 6393 2 1 16 TRP C C -0.898 5.466 -3.693 1.00 . B B . 16 TRP C 1 1 9 6394 2 1 16 TRP CA C -1.730 5.412 -2.411 1.00 . B B . 16 TRP CA 1 1 9 6395 2 1 16 TRP CB C -0.979 4.686 -1.277 1.00 . B B . 16 TRP CB 1 1 9 6396 2 1 16 TRP CD1 C -0.048 2.377 -1.708 1.00 . B B . 16 TRP CD1 1 1 9 6397 2 1 16 TRP CD2 C 1.220 4.003 -2.578 1.00 . B B . 16 TRP CD2 1 1 9 6398 2 1 16 TRP CE2 C 1.852 2.785 -2.908 1.00 . B B . 16 TRP CE2 1 1 9 6399 2 1 16 TRP CE3 C 1.811 5.196 -3.000 1.00 . B B . 16 TRP CE3 1 1 9 6400 2 1 16 TRP CG C 0.015 3.717 -1.832 1.00 . B B . 16 TRP CG 1 1 9 6401 2 1 16 TRP CH2 C 3.618 3.953 -4.056 1.00 . B B . 16 TRP CH2 1 1 9 6402 2 1 16 TRP CZ2 C 3.038 2.753 -3.639 1.00 . B B . 16 TRP CZ2 1 1 9 6403 2 1 16 TRP CZ3 C 3.006 5.173 -3.735 1.00 . B B . 16 TRP CZ3 1 1 9 6404 2 1 16 TRP H H -2.976 3.767 -3.010 1.00 . B B . 16 TRP H 1 1 9 6405 2 1 16 TRP HA H -1.956 6.422 -2.096 1.00 . B B . 16 TRP HA 1 1 9 6406 2 1 16 TRP HB2 H -0.464 5.413 -0.669 1.00 . B B . 16 TRP HB2 1 1 9 6407 2 1 16 TRP HB3 H -1.693 4.153 -0.665 1.00 . B B . 16 TRP HB3 1 1 9 6408 2 1 16 TRP HD1 H -0.823 1.831 -1.194 1.00 . B B . 16 TRP HD1 1 1 9 6409 2 1 16 TRP HE1 H 1.225 0.862 -2.429 1.00 . B B . 16 TRP HE1 1 1 9 6410 2 1 16 TRP HE3 H 1.341 6.138 -2.748 1.00 . B B . 16 TRP HE3 1 1 9 6411 2 1 16 TRP HH2 H 4.537 3.941 -4.621 1.00 . B B . 16 TRP HH2 1 1 9 6412 2 1 16 TRP HZ2 H 3.502 1.809 -3.882 1.00 . B B . 16 TRP HZ2 1 1 9 6413 2 1 16 TRP HZ3 H 3.453 6.098 -4.055 1.00 . B B . 16 TRP HZ3 1 1 9 6414 2 1 16 TRP N N -2.999 4.694 -2.699 1.00 . B B . 16 TRP N 1 1 9 6415 2 1 16 TRP NE1 N 1.038 1.818 -2.359 1.00 . B B . 16 TRP NE1 1 1 9 6416 2 1 16 TRP O O -0.399 6.504 -4.080 1.00 . B B . 16 TRP O 1 1 9 6417 2 1 17 VAL C C -0.718 5.265 -6.631 1.00 . B B . 17 VAL C 1 1 9 6418 2 1 17 VAL CA C 0.013 4.359 -5.636 1.00 . B B . 17 VAL CA 1 1 9 6419 2 1 17 VAL CB C 0.148 2.916 -6.163 1.00 . B B . 17 VAL CB 1 1 9 6420 2 1 17 VAL CG1 C -0.767 2.673 -7.371 1.00 . B B . 17 VAL CG1 1 1 9 6421 2 1 17 VAL CG2 C 1.602 2.675 -6.571 1.00 . B B . 17 VAL CG2 1 1 9 6422 2 1 17 VAL H H -1.188 3.534 -4.052 1.00 . B B . 17 VAL H 1 1 9 6423 2 1 17 VAL HA H 0.997 4.766 -5.446 1.00 . B B . 17 VAL HA 1 1 9 6424 2 1 17 VAL HB H -0.120 2.226 -5.376 1.00 . B B . 17 VAL HB 1 1 9 6425 2 1 17 VAL HG11 H -0.503 3.358 -8.164 1.00 . B B . 17 VAL HG11 1 1 9 6426 2 1 17 VAL HG12 H -1.795 2.835 -7.083 1.00 . B B . 17 VAL HG12 1 1 9 6427 2 1 17 VAL HG13 H -0.645 1.657 -7.717 1.00 . B B . 17 VAL HG13 1 1 9 6428 2 1 17 VAL HG21 H 1.711 2.846 -7.631 1.00 . B B . 17 VAL HG21 1 1 9 6429 2 1 17 VAL HG22 H 1.878 1.657 -6.338 1.00 . B B . 17 VAL HG22 1 1 9 6430 2 1 17 VAL HG23 H 2.244 3.357 -6.028 1.00 . B B . 17 VAL HG23 1 1 9 6431 2 1 17 VAL N N -0.764 4.358 -4.369 1.00 . B B . 17 VAL N 1 1 9 6432 2 1 17 VAL O O -0.124 6.059 -7.327 1.00 . B B . 17 VAL O 1 1 9 6433 2 1 18 GLY C C -2.609 7.518 -7.134 1.00 . B B . 18 GLY C 1 1 9 6434 2 1 18 GLY CA C -2.781 6.065 -7.593 1.00 . B B . 18 GLY CA 1 1 9 6435 2 1 18 GLY H H -2.491 4.556 -6.083 1.00 . B B . 18 GLY H 1 1 9 6436 2 1 18 GLY HA2 H -2.399 5.952 -8.599 1.00 . B B . 18 GLY HA2 1 1 9 6437 2 1 18 GLY HA3 H -3.826 5.803 -7.568 1.00 . B B . 18 GLY HA3 1 1 9 6438 2 1 18 GLY N N -2.018 5.181 -6.673 1.00 . B B . 18 GLY N 1 1 9 6439 2 1 18 GLY O O -3.053 8.442 -7.783 1.00 . B B . 18 GLY O 1 1 9 6440 2 1 19 GLU C C -0.305 9.509 -5.703 1.00 . B B . 19 GLU C 1 1 9 6441 2 1 19 GLU CA C -1.760 9.105 -5.499 1.00 . B B . 19 GLU CA 1 1 9 6442 2 1 19 GLU CB C -2.053 9.125 -4.001 1.00 . B B . 19 GLU CB 1 1 9 6443 2 1 19 GLU CD C -4.461 8.799 -4.567 1.00 . B B . 19 GLU CD 1 1 9 6444 2 1 19 GLU CG C -3.297 8.294 -3.712 1.00 . B B . 19 GLU CG 1 1 9 6445 2 1 19 GLU H H -1.630 6.969 -5.492 1.00 . B B . 19 GLU H 1 1 9 6446 2 1 19 GLU HA H -2.407 9.792 -6.016 1.00 . B B . 19 GLU HA 1 1 9 6447 2 1 19 GLU HB2 H -1.207 8.699 -3.467 1.00 . B B . 19 GLU HB2 1 1 9 6448 2 1 19 GLU HB3 H -2.213 10.142 -3.676 1.00 . B B . 19 GLU HB3 1 1 9 6449 2 1 19 GLU HG2 H -3.096 7.259 -3.947 1.00 . B B . 19 GLU HG2 1 1 9 6450 2 1 19 GLU HG3 H -3.553 8.383 -2.668 1.00 . B B . 19 GLU HG3 1 1 9 6451 2 1 19 GLU N N -1.969 7.724 -6.009 1.00 . B B . 19 GLU N 1 1 9 6452 2 1 19 GLU O O 0.013 10.380 -6.489 1.00 . B B . 19 GLU O 1 1 9 6453 2 1 19 GLU OE1 O -4.574 8.359 -5.700 1.00 . B B . 19 GLU OE1 1 1 9 6454 2 1 19 GLU OE2 O -5.219 9.618 -4.074 1.00 . B B . 19 GLU OE2 1 1 9 6455 2 1 20 ILE C C 2.525 8.870 -6.485 1.00 . B B . 20 ILE C 1 1 9 6456 2 1 20 ILE CA C 2.017 9.213 -5.087 1.00 . B B . 20 ILE CA 1 1 9 6457 2 1 20 ILE CB C 2.758 8.371 -4.059 1.00 . B B . 20 ILE CB 1 1 9 6458 2 1 20 ILE CD1 C 3.287 8.113 -1.633 1.00 . B B . 20 ILE CD1 1 1 9 6459 2 1 20 ILE CG1 C 2.557 8.970 -2.670 1.00 . B B . 20 ILE CG1 1 1 9 6460 2 1 20 ILE CG2 C 4.254 8.325 -4.384 1.00 . B B . 20 ILE CG2 1 1 9 6461 2 1 20 ILE H H 0.285 8.190 -4.346 1.00 . B B . 20 ILE H 1 1 9 6462 2 1 20 ILE HA H 2.171 10.258 -4.883 1.00 . B B . 20 ILE HA 1 1 9 6463 2 1 20 ILE HB H 2.348 7.373 -4.079 1.00 . B B . 20 ILE HB 1 1 9 6464 2 1 20 ILE HD11 H 2.610 7.868 -0.827 1.00 . B B . 20 ILE HD11 1 1 9 6465 2 1 20 ILE HD12 H 4.130 8.662 -1.240 1.00 . B B . 20 ILE HD12 1 1 9 6466 2 1 20 ILE HD13 H 3.636 7.203 -2.099 1.00 . B B . 20 ILE HD13 1 1 9 6467 2 1 20 ILE HG12 H 2.955 9.974 -2.654 1.00 . B B . 20 ILE HG12 1 1 9 6468 2 1 20 ILE HG13 H 1.503 8.990 -2.440 1.00 . B B . 20 ILE HG13 1 1 9 6469 2 1 20 ILE HG21 H 4.412 7.727 -5.269 1.00 . B B . 20 ILE HG21 1 1 9 6470 2 1 20 ILE HG22 H 4.791 7.890 -3.555 1.00 . B B . 20 ILE HG22 1 1 9 6471 2 1 20 ILE HG23 H 4.614 9.328 -4.559 1.00 . B B . 20 ILE HG23 1 1 9 6472 2 1 20 ILE N N 0.576 8.884 -4.979 1.00 . B B . 20 ILE N 1 1 9 6473 2 1 20 ILE O O 3.137 9.678 -7.157 1.00 . B B . 20 ILE O 1 1 9 6474 2 1 21 MET C C 2.399 8.315 -9.298 1.00 . B B . 21 MET C 1 1 9 6475 2 1 21 MET CA C 2.765 7.250 -8.261 1.00 . B B . 21 MET CA 1 1 9 6476 2 1 21 MET CB C 2.118 5.917 -8.623 1.00 . B B . 21 MET CB 1 1 9 6477 2 1 21 MET CE C 3.672 4.031 -11.732 1.00 . B B . 21 MET CE 1 1 9 6478 2 1 21 MET CG C 3.160 5.000 -9.251 1.00 . B B . 21 MET CG 1 1 9 6479 2 1 21 MET H H 1.799 7.034 -6.352 1.00 . B B . 21 MET H 1 1 9 6480 2 1 21 MET HA H 3.837 7.131 -8.237 1.00 . B B . 21 MET HA 1 1 9 6481 2 1 21 MET HB2 H 1.739 5.453 -7.724 1.00 . B B . 21 MET HB2 1 1 9 6482 2 1 21 MET HB3 H 1.310 6.079 -9.321 1.00 . B B . 21 MET HB3 1 1 9 6483 2 1 21 MET HE1 H 2.877 3.983 -12.462 1.00 . B B . 21 MET HE1 1 1 9 6484 2 1 21 MET HE2 H 3.545 3.237 -11.013 1.00 . B B . 21 MET HE2 1 1 9 6485 2 1 21 MET HE3 H 4.629 3.918 -12.224 1.00 . B B . 21 MET HE3 1 1 9 6486 2 1 21 MET HG2 H 4.034 4.971 -8.615 1.00 . B B . 21 MET HG2 1 1 9 6487 2 1 21 MET HG3 H 2.747 4.006 -9.347 1.00 . B B . 21 MET HG3 1 1 9 6488 2 1 21 MET N N 2.287 7.668 -6.918 1.00 . B B . 21 MET N 1 1 9 6489 2 1 21 MET O O 3.022 8.419 -10.336 1.00 . B B . 21 MET O 1 1 9 6490 2 1 21 MET SD S 3.617 5.629 -10.886 1.00 . B B . 21 MET SD 1 1 9 6491 2 1 22 ASN C C 0.858 11.505 -9.264 1.00 . B B . 22 ASN C 1 1 9 6492 2 1 22 ASN CA C 1.023 10.176 -10.002 1.00 . B B . 22 ASN CA 1 1 9 6493 2 1 22 ASN CB C -0.292 9.806 -10.691 1.00 . B B . 22 ASN CB 1 1 9 6494 2 1 22 ASN CG C -1.279 9.259 -9.665 1.00 . B B . 22 ASN CG 1 1 9 6495 2 1 22 ASN H H 0.914 9.025 -8.181 1.00 . B B . 22 ASN H 1 1 9 6496 2 1 22 ASN HA H 1.802 10.273 -10.744 1.00 . B B . 22 ASN HA 1 1 9 6497 2 1 22 ASN HB2 H -0.712 10.686 -11.158 1.00 . B B . 22 ASN HB2 1 1 9 6498 2 1 22 ASN HB3 H -0.103 9.051 -11.443 1.00 . B B . 22 ASN HB3 1 1 9 6499 2 1 22 ASN HD21 H -2.697 8.919 -11.017 1.00 . B B . 22 ASN HD21 1 1 9 6500 2 1 22 ASN HD22 H -3.101 8.507 -9.412 1.00 . B B . 22 ASN HD22 1 1 9 6501 2 1 22 ASN N N 1.404 9.115 -9.027 1.00 . B B . 22 ASN N 1 1 9 6502 2 1 22 ASN ND2 N -2.456 8.862 -10.064 1.00 . B B . 22 ASN ND2 1 1 9 6503 2 1 22 ASN O O 0.128 12.378 -9.690 1.00 . B B . 22 ASN O 1 1 9 6504 2 1 22 ASN OD1 O -0.977 9.193 -8.490 1.00 . B B . 22 ASN OD1 1 1 9 6505 2 1 23 SER C C 2.434 13.947 -7.932 1.00 . B B . 23 SER C 1 1 9 6506 2 1 23 SER CA C 1.418 12.939 -7.393 1.00 . B B . 23 SER CA 1 1 9 6507 2 1 23 SER CB C 1.699 12.675 -5.914 1.00 . B B . 23 SER CB 1 1 9 6508 2 1 23 SER H H 2.117 10.950 -7.832 1.00 . B B . 23 SER H 1 1 9 6509 2 1 23 SER HA H 0.421 13.337 -7.505 1.00 . B B . 23 SER HA 1 1 9 6510 2 1 23 SER HB2 H 1.744 13.609 -5.381 1.00 . B B . 23 SER HB2 1 1 9 6511 2 1 23 SER HB3 H 0.905 12.066 -5.501 1.00 . B B . 23 SER HB3 1 1 9 6512 2 1 23 SER HG H 3.143 11.918 -4.851 1.00 . B B . 23 SER HG 1 1 9 6513 2 1 23 SER N N 1.533 11.666 -8.158 1.00 . B B . 23 SER N 1 1 9 6514 2 1 23 SER O O 2.274 15.125 -7.658 1.00 . B B . 23 SER O 1 1 9 6515 2 1 23 SER OXT O 3.356 13.525 -8.610 1.00 . B B . 23 SER OXT 1 1 9 6516 2 1 23 SER OG O 2.946 12.002 -5.786 1.00 . B B . 23 SER OG 1 1 10 6517 1 1 1 GLY C C -7.208 12.367 2.835 1.00 . A A . 1 GLY C 1 1 10 6518 1 1 1 GLY CA C -8.442 12.475 3.733 1.00 . A A . 1 GLY CA 1 1 10 6519 1 1 1 GLY H1 H -9.548 14.203 3.373 1.00 . A A . 1 GLY H1 1 1 10 6520 1 1 1 GLY H2 H -10.434 12.765 3.197 1.00 . A A . 1 GLY H2 1 1 10 6521 1 1 1 GLY H3 H -9.320 13.232 2.002 1.00 . A A . 1 GLY H3 1 1 10 6522 1 1 1 GLY HA2 H -8.182 12.997 4.643 1.00 . A A . 1 GLY HA2 1 1 10 6523 1 1 1 GLY HA3 H -8.794 11.483 3.974 1.00 . A A . 1 GLY HA3 1 1 10 6524 1 1 1 GLY N N -9.517 13.225 3.022 1.00 . A A . 1 GLY N 1 1 10 6525 1 1 1 GLY O O -7.280 11.901 1.716 1.00 . A A . 1 GLY O 1 1 10 6526 1 1 2 ILE C C -3.612 12.868 3.407 1.00 . A A . 2 ILE C 1 1 10 6527 1 1 2 ILE CA C -4.829 12.709 2.498 1.00 . A A . 2 ILE CA 1 1 10 6528 1 1 2 ILE CB C -4.822 13.816 1.435 1.00 . A A . 2 ILE CB 1 1 10 6529 1 1 2 ILE CD1 C -5.374 15.516 3.189 1.00 . A A . 2 ILE CD1 1 1 10 6530 1 1 2 ILE CG1 C -5.789 14.938 1.835 1.00 . A A . 2 ILE CG1 1 1 10 6531 1 1 2 ILE CG2 C -5.254 13.232 0.091 1.00 . A A . 2 ILE CG2 1 1 10 6532 1 1 2 ILE H H -6.035 13.160 4.227 1.00 . A A . 2 ILE H 1 1 10 6533 1 1 2 ILE HA H -4.785 11.744 2.013 1.00 . A A . 2 ILE HA 1 1 10 6534 1 1 2 ILE HB H -3.822 14.217 1.346 1.00 . A A . 2 ILE HB 1 1 10 6535 1 1 2 ILE HD11 H -4.585 16.240 3.045 1.00 . A A . 2 ILE HD11 1 1 10 6536 1 1 2 ILE HD12 H -5.018 14.720 3.827 1.00 . A A . 2 ILE HD12 1 1 10 6537 1 1 2 ILE HD13 H -6.223 15.996 3.651 1.00 . A A . 2 ILE HD13 1 1 10 6538 1 1 2 ILE HG12 H -5.762 15.717 1.085 1.00 . A A . 2 ILE HG12 1 1 10 6539 1 1 2 ILE HG13 H -6.791 14.539 1.908 1.00 . A A . 2 ILE HG13 1 1 10 6540 1 1 2 ILE HG21 H -6.065 13.819 -0.313 1.00 . A A . 2 ILE HG21 1 1 10 6541 1 1 2 ILE HG22 H -5.582 12.212 0.230 1.00 . A A . 2 ILE HG22 1 1 10 6542 1 1 2 ILE HG23 H -4.419 13.250 -0.594 1.00 . A A . 2 ILE HG23 1 1 10 6543 1 1 2 ILE N N -6.073 12.790 3.321 1.00 . A A . 2 ILE N 1 1 10 6544 1 1 2 ILE O O -2.854 13.810 3.293 1.00 . A A . 2 ILE O 1 1 10 6545 1 1 3 GLY C C -1.907 10.615 5.703 1.00 . A A . 3 GLY C 1 1 10 6546 1 1 3 GLY CA C -2.254 12.024 5.229 1.00 . A A . 3 GLY CA 1 1 10 6547 1 1 3 GLY H H -4.045 11.194 4.375 1.00 . A A . 3 GLY H 1 1 10 6548 1 1 3 GLY HA2 H -1.408 12.448 4.703 1.00 . A A . 3 GLY HA2 1 1 10 6549 1 1 3 GLY HA3 H -2.500 12.639 6.080 1.00 . A A . 3 GLY HA3 1 1 10 6550 1 1 3 GLY N N -3.421 11.946 4.308 1.00 . A A . 3 GLY N 1 1 10 6551 1 1 3 GLY O O -1.297 10.421 6.735 1.00 . A A . 3 GLY O 1 1 10 6552 1 1 4 LYS C C -1.476 7.486 4.095 1.00 . A A . 4 LYS C 1 1 10 6553 1 1 4 LYS CA C -2.000 8.221 5.326 1.00 . A A . 4 LYS CA 1 1 10 6554 1 1 4 LYS CB C -3.270 7.524 5.834 1.00 . A A . 4 LYS CB 1 1 10 6555 1 1 4 LYS CD C -5.737 7.803 6.154 1.00 . A A . 4 LYS CD 1 1 10 6556 1 1 4 LYS CE C -5.910 6.290 6.001 1.00 . A A . 4 LYS CE 1 1 10 6557 1 1 4 LYS CG C -4.520 8.268 5.348 1.00 . A A . 4 LYS CG 1 1 10 6558 1 1 4 LYS H H -2.789 9.814 4.118 1.00 . A A . 4 LYS H 1 1 10 6559 1 1 4 LYS HA H -1.247 8.210 6.102 1.00 . A A . 4 LYS HA 1 1 10 6560 1 1 4 LYS HB2 H -3.288 6.511 5.462 1.00 . A A . 4 LYS HB2 1 1 10 6561 1 1 4 LYS HB3 H -3.260 7.510 6.914 1.00 . A A . 4 LYS HB3 1 1 10 6562 1 1 4 LYS HD2 H -5.592 8.048 7.196 1.00 . A A . 4 LYS HD2 1 1 10 6563 1 1 4 LYS HD3 H -6.622 8.303 5.788 1.00 . A A . 4 LYS HD3 1 1 10 6564 1 1 4 LYS HE2 H -6.497 6.082 5.120 1.00 . A A . 4 LYS HE2 1 1 10 6565 1 1 4 LYS HE3 H -4.942 5.823 5.907 1.00 . A A . 4 LYS HE3 1 1 10 6566 1 1 4 LYS HG2 H -4.385 9.331 5.484 1.00 . A A . 4 LYS HG2 1 1 10 6567 1 1 4 LYS HG3 H -4.682 8.056 4.301 1.00 . A A . 4 LYS HG3 1 1 10 6568 1 1 4 LYS HZ1 H -6.968 6.530 7.779 1.00 . A A . 4 LYS HZ1 1 1 10 6569 1 1 4 LYS HZ2 H -5.936 5.181 7.763 1.00 . A A . 4 LYS HZ2 1 1 10 6570 1 1 4 LYS HZ3 H -7.397 5.145 6.900 1.00 . A A . 4 LYS HZ3 1 1 10 6571 1 1 4 LYS N N -2.298 9.628 4.945 1.00 . A A . 4 LYS N 1 1 10 6572 1 1 4 LYS NZ N -6.605 5.745 7.202 1.00 . A A . 4 LYS NZ 1 1 10 6573 1 1 4 LYS O O -0.510 6.752 4.159 1.00 . A A . 4 LYS O 1 1 10 6574 1 1 5 TYR C C -0.286 7.580 1.326 1.00 . A A . 5 TYR C 1 1 10 6575 1 1 5 TYR CA C -1.646 7.020 1.727 1.00 . A A . 5 TYR CA 1 1 10 6576 1 1 5 TYR CB C -2.665 7.280 0.619 1.00 . A A . 5 TYR CB 1 1 10 6577 1 1 5 TYR CD1 C -4.658 5.887 1.272 1.00 . A A . 5 TYR CD1 1 1 10 6578 1 1 5 TYR CD2 C -4.768 8.288 1.592 1.00 . A A . 5 TYR CD2 1 1 10 6579 1 1 5 TYR CE1 C -5.952 5.756 1.786 1.00 . A A . 5 TYR CE1 1 1 10 6580 1 1 5 TYR CE2 C -6.065 8.159 2.107 1.00 . A A . 5 TYR CE2 1 1 10 6581 1 1 5 TYR CG C -4.064 7.151 1.176 1.00 . A A . 5 TYR CG 1 1 10 6582 1 1 5 TYR CZ C -6.657 6.893 2.203 1.00 . A A . 5 TYR CZ 1 1 10 6583 1 1 5 TYR H H -2.874 8.288 2.935 1.00 . A A . 5 TYR H 1 1 10 6584 1 1 5 TYR HA H -1.561 5.966 1.887 1.00 . A A . 5 TYR HA 1 1 10 6585 1 1 5 TYR HB2 H -2.523 8.276 0.220 1.00 . A A . 5 TYR HB2 1 1 10 6586 1 1 5 TYR HB3 H -2.526 6.554 -0.159 1.00 . A A . 5 TYR HB3 1 1 10 6587 1 1 5 TYR HD1 H -4.115 5.013 0.951 1.00 . A A . 5 TYR HD1 1 1 10 6588 1 1 5 TYR HD2 H -4.310 9.265 1.518 1.00 . A A . 5 TYR HD2 1 1 10 6589 1 1 5 TYR HE1 H -6.407 4.778 1.859 1.00 . A A . 5 TYR HE1 1 1 10 6590 1 1 5 TYR HE2 H -6.608 9.035 2.429 1.00 . A A . 5 TYR HE2 1 1 10 6591 1 1 5 TYR HH H -8.032 5.873 3.049 1.00 . A A . 5 TYR HH 1 1 10 6592 1 1 5 TYR N N -2.103 7.688 2.968 1.00 . A A . 5 TYR N 1 1 10 6593 1 1 5 TYR O O 0.449 6.979 0.568 1.00 . A A . 5 TYR O 1 1 10 6594 1 1 5 TYR OH O -7.935 6.766 2.709 1.00 . A A . 5 TYR OH 1 1 10 6595 1 1 6 LEU C C 2.370 9.138 2.556 1.00 . A A . 6 LEU C 1 1 10 6596 1 1 6 LEU CA C 1.345 9.349 1.440 1.00 . A A . 6 LEU CA 1 1 10 6597 1 1 6 LEU CB C 1.125 10.846 1.221 1.00 . A A . 6 LEU CB 1 1 10 6598 1 1 6 LEU CD1 C -0.581 9.932 -0.414 1.00 . A A . 6 LEU CD1 1 1 10 6599 1 1 6 LEU CD2 C -0.416 12.391 0.000 1.00 . A A . 6 LEU CD2 1 1 10 6600 1 1 6 LEU CG C 0.379 11.088 -0.100 1.00 . A A . 6 LEU CG 1 1 10 6601 1 1 6 LEU H H -0.566 9.219 2.396 1.00 . A A . 6 LEU H 1 1 10 6602 1 1 6 LEU HA H 1.702 8.897 0.529 1.00 . A A . 6 LEU HA 1 1 10 6603 1 1 6 LEU HB2 H 0.541 11.245 2.039 1.00 . A A . 6 LEU HB2 1 1 10 6604 1 1 6 LEU HB3 H 2.081 11.346 1.186 1.00 . A A . 6 LEU HB3 1 1 10 6605 1 1 6 LEU HD11 H -1.068 10.113 -1.361 1.00 . A A . 6 LEU HD11 1 1 10 6606 1 1 6 LEU HD12 H -1.324 9.858 0.366 1.00 . A A . 6 LEU HD12 1 1 10 6607 1 1 6 LEU HD13 H -0.022 9.003 -0.467 1.00 . A A . 6 LEU HD13 1 1 10 6608 1 1 6 LEU HD21 H -0.044 13.096 -0.731 1.00 . A A . 6 LEU HD21 1 1 10 6609 1 1 6 LEU HD22 H -0.304 12.807 0.990 1.00 . A A . 6 LEU HD22 1 1 10 6610 1 1 6 LEU HD23 H -1.460 12.192 -0.193 1.00 . A A . 6 LEU HD23 1 1 10 6611 1 1 6 LEU HG H 1.098 11.171 -0.888 1.00 . A A . 6 LEU HG 1 1 10 6612 1 1 6 LEU N N 0.047 8.738 1.810 1.00 . A A . 6 LEU N 1 1 10 6613 1 1 6 LEU O O 3.510 9.545 2.445 1.00 . A A . 6 LEU O 1 1 10 6614 1 1 7 HIS C C 2.806 6.866 5.285 1.00 . A A . 7 HIS C 1 1 10 6615 1 1 7 HIS CA C 2.945 8.291 4.744 1.00 . A A . 7 HIS CA 1 1 10 6616 1 1 7 HIS CB C 2.666 9.300 5.858 1.00 . A A . 7 HIS CB 1 1 10 6617 1 1 7 HIS CD2 C 1.293 11.483 5.353 1.00 . A A . 7 HIS CD2 1 1 10 6618 1 1 7 HIS CE1 C 2.681 12.417 3.976 1.00 . A A . 7 HIS CE1 1 1 10 6619 1 1 7 HIS CG C 2.369 10.638 5.241 1.00 . A A . 7 HIS CG 1 1 10 6620 1 1 7 HIS H H 1.057 8.197 3.706 1.00 . A A . 7 HIS H 1 1 10 6621 1 1 7 HIS HA H 3.951 8.436 4.377 1.00 . A A . 7 HIS HA 1 1 10 6622 1 1 7 HIS HB2 H 1.817 8.971 6.439 1.00 . A A . 7 HIS HB2 1 1 10 6623 1 1 7 HIS HB3 H 3.533 9.381 6.496 1.00 . A A . 7 HIS HB3 1 1 10 6624 1 1 7 HIS HD1 H 4.113 10.910 4.067 1.00 . A A . 7 HIS HD1 1 1 10 6625 1 1 7 HIS HD2 H 0.423 11.301 5.966 1.00 . A A . 7 HIS HD2 1 1 10 6626 1 1 7 HIS HE1 H 3.132 13.109 3.279 1.00 . A A . 7 HIS HE1 1 1 10 6627 1 1 7 HIS N N 1.980 8.513 3.630 1.00 . A A . 7 HIS N 1 1 10 6628 1 1 7 HIS ND1 N 3.244 11.256 4.358 1.00 . A A . 7 HIS ND1 1 1 10 6629 1 1 7 HIS NE2 N 1.491 12.604 4.554 1.00 . A A . 7 HIS NE2 1 1 10 6630 1 1 7 HIS O O 3.761 6.278 5.751 1.00 . A A . 7 HIS O 1 1 10 6631 1 1 8 SER C C 1.303 3.951 4.572 1.00 . A A . 8 SER C 1 1 10 6632 1 1 8 SER CA C 1.452 4.918 5.744 1.00 . A A . 8 SER CA 1 1 10 6633 1 1 8 SER CB C 0.207 4.853 6.630 1.00 . A A . 8 SER CB 1 1 10 6634 1 1 8 SER H H 0.867 6.787 4.853 1.00 . A A . 8 SER H 1 1 10 6635 1 1 8 SER HA H 2.319 4.640 6.320 1.00 . A A . 8 SER HA 1 1 10 6636 1 1 8 SER HB2 H 0.059 5.804 7.115 1.00 . A A . 8 SER HB2 1 1 10 6637 1 1 8 SER HB3 H -0.657 4.626 6.017 1.00 . A A . 8 SER HB3 1 1 10 6638 1 1 8 SER HG H -0.174 3.101 7.383 1.00 . A A . 8 SER HG 1 1 10 6639 1 1 8 SER N N 1.630 6.303 5.230 1.00 . A A . 8 SER N 1 1 10 6640 1 1 8 SER O O 1.727 2.814 4.636 1.00 . A A . 8 SER O 1 1 10 6641 1 1 8 SER OG O 0.384 3.846 7.617 1.00 . A A . 8 SER OG 1 1 10 6642 1 1 9 ALA C C 1.886 3.364 1.604 1.00 . A A . 9 ALA C 1 1 10 6643 1 1 9 ALA CA C 0.552 3.488 2.326 1.00 . A A . 9 ALA CA 1 1 10 6644 1 1 9 ALA CB C -0.475 4.062 1.362 1.00 . A A . 9 ALA CB 1 1 10 6645 1 1 9 ALA H H 0.381 5.312 3.458 1.00 . A A . 9 ALA H 1 1 10 6646 1 1 9 ALA HA H 0.230 2.513 2.662 1.00 . A A . 9 ALA HA 1 1 10 6647 1 1 9 ALA HB1 H -0.171 5.059 1.067 1.00 . A A . 9 ALA HB1 1 1 10 6648 1 1 9 ALA HB2 H -1.439 4.106 1.845 1.00 . A A . 9 ALA HB2 1 1 10 6649 1 1 9 ALA HB3 H -0.538 3.433 0.487 1.00 . A A . 9 ALA HB3 1 1 10 6650 1 1 9 ALA N N 0.713 4.391 3.498 1.00 . A A . 9 ALA N 1 1 10 6651 1 1 9 ALA O O 2.419 2.284 1.464 1.00 . A A . 9 ALA O 1 1 10 6652 1 1 10 LYS C C 4.657 3.399 1.126 1.00 . A A . 10 LYS C 1 1 10 6653 1 1 10 LYS CA C 3.734 4.392 0.418 1.00 . A A . 10 LYS CA 1 1 10 6654 1 1 10 LYS CB C 4.392 5.771 0.396 1.00 . A A . 10 LYS CB 1 1 10 6655 1 1 10 LYS CD C 5.660 6.516 2.413 1.00 . A A . 10 LYS CD 1 1 10 6656 1 1 10 LYS CE C 6.536 7.461 1.590 1.00 . A A . 10 LYS CE 1 1 10 6657 1 1 10 LYS CG C 4.273 6.421 1.776 1.00 . A A . 10 LYS CG 1 1 10 6658 1 1 10 LYS H H 1.969 5.330 1.261 1.00 . A A . 10 LYS H 1 1 10 6659 1 1 10 LYS HA H 3.564 4.060 -0.595 1.00 . A A . 10 LYS HA 1 1 10 6660 1 1 10 LYS HB2 H 5.436 5.661 0.139 1.00 . A A . 10 LYS HB2 1 1 10 6661 1 1 10 LYS HB3 H 3.903 6.393 -0.338 1.00 . A A . 10 LYS HB3 1 1 10 6662 1 1 10 LYS HD2 H 5.569 6.892 3.422 1.00 . A A . 10 LYS HD2 1 1 10 6663 1 1 10 LYS HD3 H 6.113 5.536 2.433 1.00 . A A . 10 LYS HD3 1 1 10 6664 1 1 10 LYS HE2 H 7.202 6.884 0.965 1.00 . A A . 10 LYS HE2 1 1 10 6665 1 1 10 LYS HE3 H 5.909 8.083 0.968 1.00 . A A . 10 LYS HE3 1 1 10 6666 1 1 10 LYS HG2 H 3.853 7.411 1.672 1.00 . A A . 10 LYS HG2 1 1 10 6667 1 1 10 LYS HG3 H 3.631 5.821 2.403 1.00 . A A . 10 LYS HG3 1 1 10 6668 1 1 10 LYS HZ1 H 6.708 8.755 3.213 1.00 . A A . 10 LYS HZ1 1 1 10 6669 1 1 10 LYS HZ2 H 7.805 9.071 1.955 1.00 . A A . 10 LYS HZ2 1 1 10 6670 1 1 10 LYS HZ3 H 8.053 7.745 2.989 1.00 . A A . 10 LYS HZ3 1 1 10 6671 1 1 10 LYS N N 2.427 4.462 1.140 1.00 . A A . 10 LYS N 1 1 10 6672 1 1 10 LYS NZ N 7.336 8.323 2.506 1.00 . A A . 10 LYS NZ 1 1 10 6673 1 1 10 LYS O O 5.418 2.690 0.499 1.00 . A A . 10 LYS O 1 1 10 6674 1 1 11 LYS C C 5.100 0.950 2.719 1.00 . A A . 11 LYS C 1 1 10 6675 1 1 11 LYS CA C 5.447 2.368 3.169 1.00 . A A . 11 LYS CA 1 1 10 6676 1 1 11 LYS CB C 5.191 2.505 4.672 1.00 . A A . 11 LYS CB 1 1 10 6677 1 1 11 LYS CD C 6.022 4.745 5.407 1.00 . A A . 11 LYS CD 1 1 10 6678 1 1 11 LYS CE C 7.224 5.559 4.927 1.00 . A A . 11 LYS CE 1 1 10 6679 1 1 11 LYS CG C 6.353 3.254 5.326 1.00 . A A . 11 LYS CG 1 1 10 6680 1 1 11 LYS H H 3.955 3.902 2.915 1.00 . A A . 11 LYS H 1 1 10 6681 1 1 11 LYS HA H 6.486 2.572 2.954 1.00 . A A . 11 LYS HA 1 1 10 6682 1 1 11 LYS HB2 H 4.273 3.053 4.831 1.00 . A A . 11 LYS HB2 1 1 10 6683 1 1 11 LYS HB3 H 5.105 1.524 5.113 1.00 . A A . 11 LYS HB3 1 1 10 6684 1 1 11 LYS HD2 H 5.166 4.958 4.780 1.00 . A A . 11 LYS HD2 1 1 10 6685 1 1 11 LYS HD3 H 5.795 5.009 6.428 1.00 . A A . 11 LYS HD3 1 1 10 6686 1 1 11 LYS HE2 H 7.299 5.490 3.852 1.00 . A A . 11 LYS HE2 1 1 10 6687 1 1 11 LYS HE3 H 7.096 6.593 5.212 1.00 . A A . 11 LYS HE3 1 1 10 6688 1 1 11 LYS HG2 H 6.515 2.867 6.321 1.00 . A A . 11 LYS HG2 1 1 10 6689 1 1 11 LYS HG3 H 7.247 3.118 4.737 1.00 . A A . 11 LYS HG3 1 1 10 6690 1 1 11 LYS HZ1 H 9.205 5.753 5.536 1.00 . A A . 11 LYS HZ1 1 1 10 6691 1 1 11 LYS HZ2 H 8.791 4.191 5.009 1.00 . A A . 11 LYS HZ2 1 1 10 6692 1 1 11 LYS HZ3 H 8.272 4.743 6.530 1.00 . A A . 11 LYS HZ3 1 1 10 6693 1 1 11 LYS N N 4.584 3.330 2.428 1.00 . A A . 11 LYS N 1 1 10 6694 1 1 11 LYS NZ N 8.466 5.021 5.547 1.00 . A A . 11 LYS NZ 1 1 10 6695 1 1 11 LYS O O 5.907 0.261 2.127 1.00 . A A . 11 LYS O 1 1 10 6696 1 1 12 PHE C C 3.453 -0.879 1.023 1.00 . A A . 12 PHE C 1 1 10 6697 1 1 12 PHE CA C 3.496 -0.851 2.550 1.00 . A A . 12 PHE CA 1 1 10 6698 1 1 12 PHE CB C 2.107 -1.186 3.108 1.00 . A A . 12 PHE CB 1 1 10 6699 1 1 12 PHE CD1 C 2.971 -0.459 5.363 1.00 . A A . 12 PHE CD1 1 1 10 6700 1 1 12 PHE CD2 C 0.685 0.084 4.760 1.00 . A A . 12 PHE CD2 1 1 10 6701 1 1 12 PHE CE1 C 2.796 0.175 6.599 1.00 . A A . 12 PHE CE1 1 1 10 6702 1 1 12 PHE CE2 C 0.511 0.717 5.996 1.00 . A A . 12 PHE CE2 1 1 10 6703 1 1 12 PHE CG C 1.917 -0.505 4.443 1.00 . A A . 12 PHE CG 1 1 10 6704 1 1 12 PHE CZ C 1.566 0.762 6.916 1.00 . A A . 12 PHE CZ 1 1 10 6705 1 1 12 PHE H H 3.260 1.092 3.446 1.00 . A A . 12 PHE H 1 1 10 6706 1 1 12 PHE HA H 4.216 -1.571 2.906 1.00 . A A . 12 PHE HA 1 1 10 6707 1 1 12 PHE HB2 H 1.350 -0.843 2.418 1.00 . A A . 12 PHE HB2 1 1 10 6708 1 1 12 PHE HB3 H 2.022 -2.256 3.237 1.00 . A A . 12 PHE HB3 1 1 10 6709 1 1 12 PHE HD1 H 3.920 -0.913 5.118 1.00 . A A . 12 PHE HD1 1 1 10 6710 1 1 12 PHE HD2 H -0.128 0.049 4.052 1.00 . A A . 12 PHE HD2 1 1 10 6711 1 1 12 PHE HE1 H 3.609 0.210 7.308 1.00 . A A . 12 PHE HE1 1 1 10 6712 1 1 12 PHE HE2 H -0.439 1.171 6.241 1.00 . A A . 12 PHE HE2 1 1 10 6713 1 1 12 PHE HZ H 1.430 1.251 7.869 1.00 . A A . 12 PHE HZ 1 1 10 6714 1 1 12 PHE N N 3.899 0.515 2.980 1.00 . A A . 12 PHE N 1 1 10 6715 1 1 12 PHE O O 3.761 -1.874 0.398 1.00 . A A . 12 PHE O 1 1 10 6716 1 1 13 GLY C C 4.252 -0.402 -1.641 1.00 . A A . 13 GLY C 1 1 10 6717 1 1 13 GLY CA C 3.017 0.283 -1.064 1.00 . A A . 13 GLY CA 1 1 10 6718 1 1 13 GLY H H 2.839 1.009 0.952 1.00 . A A . 13 GLY H 1 1 10 6719 1 1 13 GLY HA2 H 2.127 -0.214 -1.414 1.00 . A A . 13 GLY HA2 1 1 10 6720 1 1 13 GLY HA3 H 3.003 1.314 -1.380 1.00 . A A . 13 GLY HA3 1 1 10 6721 1 1 13 GLY N N 3.076 0.219 0.422 1.00 . A A . 13 GLY N 1 1 10 6722 1 1 13 GLY O O 4.190 -1.072 -2.653 1.00 . A A . 13 GLY O 1 1 10 6723 1 1 14 LYS C C 6.818 -2.242 -0.876 1.00 . A A . 14 LYS C 1 1 10 6724 1 1 14 LYS CA C 6.619 -0.871 -1.521 1.00 . A A . 14 LYS CA 1 1 10 6725 1 1 14 LYS CB C 7.820 0.017 -1.194 1.00 . A A . 14 LYS CB 1 1 10 6726 1 1 14 LYS CD C 9.143 1.805 -2.332 1.00 . A A . 14 LYS CD 1 1 10 6727 1 1 14 LYS CE C 9.565 1.247 -3.693 1.00 . A A . 14 LYS CE 1 1 10 6728 1 1 14 LYS CG C 7.733 1.315 -1.999 1.00 . A A . 14 LYS CG 1 1 10 6729 1 1 14 LYS H H 5.407 0.317 -0.193 1.00 . A A . 14 LYS H 1 1 10 6730 1 1 14 LYS HA H 6.538 -0.991 -2.587 1.00 . A A . 14 LYS HA 1 1 10 6731 1 1 14 LYS HB2 H 7.819 0.247 -0.137 1.00 . A A . 14 LYS HB2 1 1 10 6732 1 1 14 LYS HB3 H 8.731 -0.502 -1.447 1.00 . A A . 14 LYS HB3 1 1 10 6733 1 1 14 LYS HD2 H 9.150 2.884 -2.366 1.00 . A A . 14 LYS HD2 1 1 10 6734 1 1 14 LYS HD3 H 9.832 1.461 -1.575 1.00 . A A . 14 LYS HD3 1 1 10 6735 1 1 14 LYS HE2 H 8.685 0.983 -4.260 1.00 . A A . 14 LYS HE2 1 1 10 6736 1 1 14 LYS HE3 H 10.127 1.997 -4.229 1.00 . A A . 14 LYS HE3 1 1 10 6737 1 1 14 LYS HG2 H 7.188 1.135 -2.914 1.00 . A A . 14 LYS HG2 1 1 10 6738 1 1 14 LYS HG3 H 7.221 2.066 -1.417 1.00 . A A . 14 LYS HG3 1 1 10 6739 1 1 14 LYS HZ1 H 11.270 0.293 -2.972 1.00 . A A . 14 LYS HZ1 1 1 10 6740 1 1 14 LYS HZ2 H 10.674 -0.357 -4.424 1.00 . A A . 14 LYS HZ2 1 1 10 6741 1 1 14 LYS HZ3 H 9.879 -0.676 -2.956 1.00 . A A . 14 LYS HZ3 1 1 10 6742 1 1 14 LYS N N 5.377 -0.234 -1.006 1.00 . A A . 14 LYS N 1 1 10 6743 1 1 14 LYS NZ N 10.410 0.036 -3.496 1.00 . A A . 14 LYS NZ 1 1 10 6744 1 1 14 LYS O O 7.530 -3.080 -1.393 1.00 . A A . 14 LYS O 1 1 10 6745 1 1 15 ALA C C 5.249 -4.746 0.532 1.00 . A A . 15 ALA C 1 1 10 6746 1 1 15 ALA CA C 6.389 -3.797 0.916 1.00 . A A . 15 ALA CA 1 1 10 6747 1 1 15 ALA CB C 6.392 -3.602 2.432 1.00 . A A . 15 ALA CB 1 1 10 6748 1 1 15 ALA H H 5.645 -1.792 0.659 1.00 . A A . 15 ALA H 1 1 10 6749 1 1 15 ALA HA H 7.331 -4.226 0.610 1.00 . A A . 15 ALA HA 1 1 10 6750 1 1 15 ALA HB1 H 6.372 -4.566 2.919 1.00 . A A . 15 ALA HB1 1 1 10 6751 1 1 15 ALA HB2 H 5.522 -3.033 2.723 1.00 . A A . 15 ALA HB2 1 1 10 6752 1 1 15 ALA HB3 H 7.285 -3.070 2.725 1.00 . A A . 15 ALA HB3 1 1 10 6753 1 1 15 ALA N N 6.210 -2.480 0.249 1.00 . A A . 15 ALA N 1 1 10 6754 1 1 15 ALA O O 5.480 -5.852 0.093 1.00 . A A . 15 ALA O 1 1 10 6755 1 1 16 TRP C C 3.016 -5.738 -1.043 1.00 . A A . 16 TRP C 1 1 10 6756 1 1 16 TRP CA C 2.865 -5.192 0.372 1.00 . A A . 16 TRP CA 1 1 10 6757 1 1 16 TRP CB C 1.565 -4.383 0.518 1.00 . A A . 16 TRP CB 1 1 10 6758 1 1 16 TRP CD1 C 1.293 -2.286 -0.875 1.00 . A A . 16 TRP CD1 1 1 10 6759 1 1 16 TRP CD2 C 0.866 -4.159 -2.026 1.00 . A A . 16 TRP CD2 1 1 10 6760 1 1 16 TRP CE2 C 0.685 -3.087 -2.927 1.00 . A A . 16 TRP CE2 1 1 10 6761 1 1 16 TRP CE3 C 0.658 -5.459 -2.488 1.00 . A A . 16 TRP CE3 1 1 10 6762 1 1 16 TRP CG C 1.261 -3.629 -0.738 1.00 . A A . 16 TRP CG 1 1 10 6763 1 1 16 TRP CH2 C 0.105 -4.611 -4.703 1.00 . A A . 16 TRP CH2 1 1 10 6764 1 1 16 TRP CZ2 C 0.309 -3.303 -4.253 1.00 . A A . 16 TRP CZ2 1 1 10 6765 1 1 16 TRP CZ3 C 0.277 -5.687 -3.823 1.00 . A A . 16 TRP CZ3 1 1 10 6766 1 1 16 TRP H H 3.869 -3.429 1.057 1.00 . A A . 16 TRP H 1 1 10 6767 1 1 16 TRP HA H 2.838 -6.023 1.057 1.00 . A A . 16 TRP HA 1 1 10 6768 1 1 16 TRP HB2 H 0.750 -5.057 0.731 1.00 . A A . 16 TRP HB2 1 1 10 6769 1 1 16 TRP HB3 H 1.673 -3.686 1.334 1.00 . A A . 16 TRP HB3 1 1 10 6770 1 1 16 TRP HD1 H 1.545 -1.582 -0.097 1.00 . A A . 16 TRP HD1 1 1 10 6771 1 1 16 TRP HE1 H 0.912 -1.053 -2.543 1.00 . A A . 16 TRP HE1 1 1 10 6772 1 1 16 TRP HE3 H 0.791 -6.287 -1.802 1.00 . A A . 16 TRP HE3 1 1 10 6773 1 1 16 TRP HH2 H -0.185 -4.795 -5.728 1.00 . A A . 16 TRP HH2 1 1 10 6774 1 1 16 TRP HZ2 H 0.177 -2.469 -4.927 1.00 . A A . 16 TRP HZ2 1 1 10 6775 1 1 16 TRP HZ3 H 0.120 -6.692 -4.175 1.00 . A A . 16 TRP HZ3 1 1 10 6776 1 1 16 TRP N N 4.026 -4.321 0.705 1.00 . A A . 16 TRP N 1 1 10 6777 1 1 16 TRP NE1 N 0.958 -1.961 -2.179 1.00 . A A . 16 TRP NE1 1 1 10 6778 1 1 16 TRP O O 2.767 -6.898 -1.301 1.00 . A A . 16 TRP O 1 1 10 6779 1 1 17 VAL C C 4.546 -6.601 -3.347 1.00 . A A . 17 VAL C 1 1 10 6780 1 1 17 VAL CA C 3.589 -5.406 -3.351 1.00 . A A . 17 VAL CA 1 1 10 6781 1 1 17 VAL CB C 4.126 -4.266 -4.229 1.00 . A A . 17 VAL CB 1 1 10 6782 1 1 17 VAL CG1 C 5.658 -4.230 -4.204 1.00 . A A . 17 VAL CG1 1 1 10 6783 1 1 17 VAL CG2 C 3.645 -4.473 -5.664 1.00 . A A . 17 VAL CG2 1 1 10 6784 1 1 17 VAL H H 3.624 -3.984 -1.740 1.00 . A A . 17 VAL H 1 1 10 6785 1 1 17 VAL HA H 2.628 -5.725 -3.729 1.00 . A A . 17 VAL HA 1 1 10 6786 1 1 17 VAL HB H 3.744 -3.327 -3.856 1.00 . A A . 17 VAL HB 1 1 10 6787 1 1 17 VAL HG11 H 6.010 -3.482 -4.900 1.00 . A A . 17 VAL HG11 1 1 10 6788 1 1 17 VAL HG12 H 6.047 -5.196 -4.490 1.00 . A A . 17 VAL HG12 1 1 10 6789 1 1 17 VAL HG13 H 5.998 -3.984 -3.210 1.00 . A A . 17 VAL HG13 1 1 10 6790 1 1 17 VAL HG21 H 2.749 -5.078 -5.656 1.00 . A A . 17 VAL HG21 1 1 10 6791 1 1 17 VAL HG22 H 4.415 -4.972 -6.232 1.00 . A A . 17 VAL HG22 1 1 10 6792 1 1 17 VAL HG23 H 3.428 -3.515 -6.113 1.00 . A A . 17 VAL HG23 1 1 10 6793 1 1 17 VAL N N 3.424 -4.918 -1.962 1.00 . A A . 17 VAL N 1 1 10 6794 1 1 17 VAL O O 4.247 -7.655 -3.867 1.00 . A A . 17 VAL O 1 1 10 6795 1 1 18 GLY C C 5.952 -8.806 -2.039 1.00 . A A . 18 GLY C 1 1 10 6796 1 1 18 GLY CA C 6.635 -7.604 -2.700 1.00 . A A . 18 GLY CA 1 1 10 6797 1 1 18 GLY H H 5.916 -5.615 -2.303 1.00 . A A . 18 GLY H 1 1 10 6798 1 1 18 GLY HA2 H 6.919 -7.860 -3.714 1.00 . A A . 18 GLY HA2 1 1 10 6799 1 1 18 GLY HA3 H 7.511 -7.331 -2.135 1.00 . A A . 18 GLY HA3 1 1 10 6800 1 1 18 GLY N N 5.688 -6.461 -2.739 1.00 . A A . 18 GLY N 1 1 10 6801 1 1 18 GLY O O 6.415 -9.924 -2.131 1.00 . A A . 18 GLY O 1 1 10 6802 1 1 19 GLU C C 3.124 -10.272 -1.732 1.00 . A A . 19 GLU C 1 1 10 6803 1 1 19 GLU CA C 4.112 -9.702 -0.732 1.00 . A A . 19 GLU CA 1 1 10 6804 1 1 19 GLU CB C 3.321 -9.163 0.462 1.00 . A A . 19 GLU CB 1 1 10 6805 1 1 19 GLU CD C 5.546 -9.058 1.592 1.00 . A A . 19 GLU CD 1 1 10 6806 1 1 19 GLU CG C 4.225 -8.325 1.354 1.00 . A A . 19 GLU CG 1 1 10 6807 1 1 19 GLU H H 4.479 -7.678 -1.332 1.00 . A A . 19 GLU H 1 1 10 6808 1 1 19 GLU HA H 4.802 -10.464 -0.414 1.00 . A A . 19 GLU HA 1 1 10 6809 1 1 19 GLU HB2 H 2.511 -8.538 0.099 1.00 . A A . 19 GLU HB2 1 1 10 6810 1 1 19 GLU HB3 H 2.917 -9.987 1.032 1.00 . A A . 19 GLU HB3 1 1 10 6811 1 1 19 GLU HG2 H 4.413 -7.382 0.869 1.00 . A A . 19 GLU HG2 1 1 10 6812 1 1 19 GLU HG3 H 3.734 -8.151 2.298 1.00 . A A . 19 GLU HG3 1 1 10 6813 1 1 19 GLU N N 4.842 -8.583 -1.385 1.00 . A A . 19 GLU N 1 1 10 6814 1 1 19 GLU O O 3.202 -11.411 -2.147 1.00 . A A . 19 GLU O 1 1 10 6815 1 1 19 GLU OE1 O 5.522 -10.276 1.658 1.00 . A A . 19 GLU OE1 1 1 10 6816 1 1 19 GLU OE2 O 6.560 -8.388 1.709 1.00 . A A . 19 GLU OE2 1 1 10 6817 1 1 20 ILE C C 1.748 -9.943 -4.479 1.00 . A A . 20 ILE C 1 1 10 6818 1 1 20 ILE CA C 1.151 -9.886 -3.076 1.00 . A A . 20 ILE CA 1 1 10 6819 1 1 20 ILE CB C 0.048 -8.837 -3.041 1.00 . A A . 20 ILE CB 1 1 10 6820 1 1 20 ILE CD1 C -1.929 -8.010 -1.767 1.00 . A A . 20 ILE CD1 1 1 10 6821 1 1 20 ILE CG1 C -0.810 -9.049 -1.798 1.00 . A A . 20 ILE CG1 1 1 10 6822 1 1 20 ILE CG2 C -0.829 -8.941 -4.292 1.00 . A A . 20 ILE CG2 1 1 10 6823 1 1 20 ILE H H 2.159 -8.551 -1.743 1.00 . A A . 20 ILE H 1 1 10 6824 1 1 20 ILE HA H 0.756 -10.846 -2.796 1.00 . A A . 20 ILE HA 1 1 10 6825 1 1 20 ILE HB H 0.511 -7.860 -2.996 1.00 . A A . 20 ILE HB 1 1 10 6826 1 1 20 ILE HD11 H -1.565 -7.103 -1.308 1.00 . A A . 20 ILE HD11 1 1 10 6827 1 1 20 ILE HD12 H -2.761 -8.394 -1.196 1.00 . A A . 20 ILE HD12 1 1 10 6828 1 1 20 ILE HD13 H -2.252 -7.798 -2.776 1.00 . A A . 20 ILE HD13 1 1 10 6829 1 1 20 ILE HG12 H -1.238 -10.041 -1.825 1.00 . A A . 20 ILE HG12 1 1 10 6830 1 1 20 ILE HG13 H -0.195 -8.940 -0.916 1.00 . A A . 20 ILE HG13 1 1 10 6831 1 1 20 ILE HG21 H -1.634 -8.223 -4.228 1.00 . A A . 20 ILE HG21 1 1 10 6832 1 1 20 ILE HG22 H -1.239 -9.937 -4.363 1.00 . A A . 20 ILE HG22 1 1 10 6833 1 1 20 ILE HG23 H -0.231 -8.735 -5.169 1.00 . A A . 20 ILE HG23 1 1 10 6834 1 1 20 ILE N N 2.186 -9.461 -2.109 1.00 . A A . 20 ILE N 1 1 10 6835 1 1 20 ILE O O 1.581 -10.901 -5.206 1.00 . A A . 20 ILE O 1 1 10 6836 1 1 21 MET C C 4.133 -9.902 -6.353 1.00 . A A . 21 MET C 1 1 10 6837 1 1 21 MET CA C 3.021 -8.855 -6.222 1.00 . A A . 21 MET CA 1 1 10 6838 1 1 21 MET CB C 3.591 -7.458 -6.457 1.00 . A A . 21 MET CB 1 1 10 6839 1 1 21 MET CE C 0.419 -5.918 -8.580 1.00 . A A . 21 MET CE 1 1 10 6840 1 1 21 MET CG C 2.784 -6.754 -7.540 1.00 . A A . 21 MET CG 1 1 10 6841 1 1 21 MET H H 2.528 -8.139 -4.259 1.00 . A A . 21 MET H 1 1 10 6842 1 1 21 MET HA H 2.254 -9.052 -6.956 1.00 . A A . 21 MET HA 1 1 10 6843 1 1 21 MET HB2 H 3.526 -6.886 -5.546 1.00 . A A . 21 MET HB2 1 1 10 6844 1 1 21 MET HB3 H 4.623 -7.534 -6.768 1.00 . A A . 21 MET HB3 1 1 10 6845 1 1 21 MET HE1 H -0.100 -5.039 -8.222 1.00 . A A . 21 MET HE1 1 1 10 6846 1 1 21 MET HE2 H -0.258 -6.518 -9.166 1.00 . A A . 21 MET HE2 1 1 10 6847 1 1 21 MET HE3 H 1.259 -5.622 -9.194 1.00 . A A . 21 MET HE3 1 1 10 6848 1 1 21 MET HG2 H 3.068 -5.715 -7.568 1.00 . A A . 21 MET HG2 1 1 10 6849 1 1 21 MET HG3 H 2.988 -7.215 -8.492 1.00 . A A . 21 MET HG3 1 1 10 6850 1 1 21 MET N N 2.425 -8.903 -4.864 1.00 . A A . 21 MET N 1 1 10 6851 1 1 21 MET O O 4.611 -10.174 -7.435 1.00 . A A . 21 MET O 1 1 10 6852 1 1 21 MET SD S 1.016 -6.881 -7.169 1.00 . A A . 21 MET SD 1 1 10 6853 1 1 22 ASN C C 5.034 -12.905 -5.062 1.00 . A A . 22 ASN C 1 1 10 6854 1 1 22 ASN CA C 5.624 -11.525 -5.352 1.00 . A A . 22 ASN CA 1 1 10 6855 1 1 22 ASN CB C 6.716 -11.217 -4.326 1.00 . A A . 22 ASN CB 1 1 10 6856 1 1 22 ASN CG C 8.031 -11.855 -4.777 1.00 . A A . 22 ASN CG 1 1 10 6857 1 1 22 ASN H H 4.152 -10.270 -4.397 1.00 . A A . 22 ASN H 1 1 10 6858 1 1 22 ASN HA H 6.050 -11.517 -6.344 1.00 . A A . 22 ASN HA 1 1 10 6859 1 1 22 ASN HB2 H 6.843 -10.146 -4.244 1.00 . A A . 22 ASN HB2 1 1 10 6860 1 1 22 ASN HB3 H 6.432 -11.623 -3.366 1.00 . A A . 22 ASN HB3 1 1 10 6861 1 1 22 ASN HD21 H 8.030 -13.211 -3.323 1.00 . A A . 22 ASN HD21 1 1 10 6862 1 1 22 ASN HD22 H 9.357 -13.286 -4.393 1.00 . A A . 22 ASN HD22 1 1 10 6863 1 1 22 ASN N N 4.548 -10.496 -5.266 1.00 . A A . 22 ASN N 1 1 10 6864 1 1 22 ASN ND2 N 8.512 -12.868 -4.108 1.00 . A A . 22 ASN ND2 1 1 10 6865 1 1 22 ASN O O 5.531 -13.913 -5.524 1.00 . A A . 22 ASN O 1 1 10 6866 1 1 22 ASN OD1 O 8.625 -11.430 -5.747 1.00 . A A . 22 ASN OD1 1 1 10 6867 1 1 23 SER C C 1.892 -14.271 -4.426 1.00 . A A . 23 SER C 1 1 10 6868 1 1 23 SER CA C 3.357 -14.275 -3.981 1.00 . A A . 23 SER CA 1 1 10 6869 1 1 23 SER CB C 3.431 -14.520 -2.475 1.00 . A A . 23 SER CB 1 1 10 6870 1 1 23 SER H H 3.592 -12.134 -3.938 1.00 . A A . 23 SER H 1 1 10 6871 1 1 23 SER HA H 3.889 -15.058 -4.501 1.00 . A A . 23 SER HA 1 1 10 6872 1 1 23 SER HB2 H 3.567 -13.581 -1.962 1.00 . A A . 23 SER HB2 1 1 10 6873 1 1 23 SER HB3 H 2.512 -14.981 -2.140 1.00 . A A . 23 SER HB3 1 1 10 6874 1 1 23 SER HG H 4.718 -15.315 -1.251 1.00 . A A . 23 SER HG 1 1 10 6875 1 1 23 SER N N 3.977 -12.959 -4.300 1.00 . A A . 23 SER N 1 1 10 6876 1 1 23 SER O O 1.146 -13.442 -3.931 1.00 . A A . 23 SER O 1 1 10 6877 1 1 23 SER OXT O 1.543 -15.097 -5.253 1.00 . A A . 23 SER OXT 1 1 10 6878 1 1 23 SER OG O 4.535 -15.370 -2.192 1.00 . A A . 23 SER OG 1 1 10 6879 2 1 1 GLY C C 4.466 -10.728 7.828 1.00 . B B . 1 GLY C 1 1 10 6880 2 1 1 GLY CA C 5.281 -11.684 8.697 1.00 . B B . 1 GLY CA 1 1 10 6881 2 1 1 GLY H1 H 6.069 -10.716 10.365 1.00 . B B . 1 GLY H1 1 1 10 6882 2 1 1 GLY H2 H 5.135 -12.085 10.736 1.00 . B B . 1 GLY H2 1 1 10 6883 2 1 1 GLY H3 H 4.378 -10.640 10.258 1.00 . B B . 1 GLY H3 1 1 10 6884 2 1 1 GLY HA2 H 6.312 -11.681 8.371 1.00 . B B . 1 GLY HA2 1 1 10 6885 2 1 1 GLY HA3 H 4.878 -12.681 8.606 1.00 . B B . 1 GLY HA3 1 1 10 6886 2 1 1 GLY N N 5.210 -11.248 10.121 1.00 . B B . 1 GLY N 1 1 10 6887 2 1 1 GLY O O 4.935 -9.678 7.435 1.00 . B B . 1 GLY O 1 1 10 6888 2 1 2 ILE C C 0.974 -10.167 7.222 1.00 . B B . 2 ILE C 1 1 10 6889 2 1 2 ILE CA C 2.405 -10.192 6.675 1.00 . B B . 2 ILE CA 1 1 10 6890 2 1 2 ILE CB C 2.397 -10.716 5.238 1.00 . B B . 2 ILE CB 1 1 10 6891 2 1 2 ILE CD1 C 0.794 -12.456 4.435 1.00 . B B . 2 ILE CD1 1 1 10 6892 2 1 2 ILE CG1 C 2.067 -12.210 5.246 1.00 . B B . 2 ILE CG1 1 1 10 6893 2 1 2 ILE CG2 C 3.774 -10.504 4.607 1.00 . B B . 2 ILE CG2 1 1 10 6894 2 1 2 ILE H H 2.888 -11.933 7.846 1.00 . B B . 2 ILE H 1 1 10 6895 2 1 2 ILE HA H 2.813 -9.193 6.691 1.00 . B B . 2 ILE HA 1 1 10 6896 2 1 2 ILE HB H 1.652 -10.183 4.664 1.00 . B B . 2 ILE HB 1 1 10 6897 2 1 2 ILE HD11 H 0.320 -11.511 4.214 1.00 . B B . 2 ILE HD11 1 1 10 6898 2 1 2 ILE HD12 H 0.117 -13.074 5.006 1.00 . B B . 2 ILE HD12 1 1 10 6899 2 1 2 ILE HD13 H 1.046 -12.955 3.512 1.00 . B B . 2 ILE HD13 1 1 10 6900 2 1 2 ILE HG12 H 2.888 -12.762 4.807 1.00 . B B . 2 ILE HG12 1 1 10 6901 2 1 2 ILE HG13 H 1.912 -12.539 6.264 1.00 . B B . 2 ILE HG13 1 1 10 6902 2 1 2 ILE HG21 H 4.245 -9.640 5.053 1.00 . B B . 2 ILE HG21 1 1 10 6903 2 1 2 ILE HG22 H 3.663 -10.345 3.544 1.00 . B B . 2 ILE HG22 1 1 10 6904 2 1 2 ILE HG23 H 4.388 -11.376 4.779 1.00 . B B . 2 ILE HG23 1 1 10 6905 2 1 2 ILE N N 3.247 -11.081 7.521 1.00 . B B . 2 ILE N 1 1 10 6906 2 1 2 ILE O O 0.253 -11.141 7.145 1.00 . B B . 2 ILE O 1 1 10 6907 2 1 3 GLY C C -1.499 -7.678 7.875 1.00 . B B . 3 GLY C 1 1 10 6908 2 1 3 GLY CA C -0.819 -8.971 8.338 1.00 . B B . 3 GLY CA 1 1 10 6909 2 1 3 GLY H H 1.164 -8.291 7.834 1.00 . B B . 3 GLY H 1 1 10 6910 2 1 3 GLY HA2 H -1.394 -9.820 7.995 1.00 . B B . 3 GLY HA2 1 1 10 6911 2 1 3 GLY HA3 H -0.771 -8.982 9.415 1.00 . B B . 3 GLY HA3 1 1 10 6912 2 1 3 GLY N N 0.563 -9.060 7.779 1.00 . B B . 3 GLY N 1 1 10 6913 2 1 3 GLY O O -2.709 -7.564 7.899 1.00 . B B . 3 GLY O 1 1 10 6914 2 1 4 LYS C C -1.095 -5.276 5.480 1.00 . B B . 4 LYS C 1 1 10 6915 2 1 4 LYS CA C -1.359 -5.431 6.977 1.00 . B B . 4 LYS CA 1 1 10 6916 2 1 4 LYS CB C -0.755 -4.233 7.730 1.00 . B B . 4 LYS CB 1 1 10 6917 2 1 4 LYS CD C 0.835 -3.596 9.555 1.00 . B B . 4 LYS CD 1 1 10 6918 2 1 4 LYS CE C 1.297 -4.273 10.847 1.00 . B B . 4 LYS CE 1 1 10 6919 2 1 4 LYS CG C 0.487 -4.666 8.518 1.00 . B B . 4 LYS CG 1 1 10 6920 2 1 4 LYS H H 0.230 -6.810 7.426 1.00 . B B . 4 LYS H 1 1 10 6921 2 1 4 LYS HA H -2.425 -5.464 7.151 1.00 . B B . 4 LYS HA 1 1 10 6922 2 1 4 LYS HB2 H -0.477 -3.469 7.018 1.00 . B B . 4 LYS HB2 1 1 10 6923 2 1 4 LYS HB3 H -1.490 -3.834 8.413 1.00 . B B . 4 LYS HB3 1 1 10 6924 2 1 4 LYS HD2 H 1.627 -2.969 9.172 1.00 . B B . 4 LYS HD2 1 1 10 6925 2 1 4 LYS HD3 H -0.036 -2.994 9.758 1.00 . B B . 4 LYS HD3 1 1 10 6926 2 1 4 LYS HE2 H 1.386 -5.337 10.684 1.00 . B B . 4 LYS HE2 1 1 10 6927 2 1 4 LYS HE3 H 2.256 -3.873 11.141 1.00 . B B . 4 LYS HE3 1 1 10 6928 2 1 4 LYS HG2 H 0.286 -5.601 9.023 1.00 . B B . 4 LYS HG2 1 1 10 6929 2 1 4 LYS HG3 H 1.318 -4.793 7.842 1.00 . B B . 4 LYS HG3 1 1 10 6930 2 1 4 LYS HZ1 H 0.398 -4.743 12.665 1.00 . B B . 4 LYS HZ1 1 1 10 6931 2 1 4 LYS HZ2 H -0.660 -4.055 11.526 1.00 . B B . 4 LYS HZ2 1 1 10 6932 2 1 4 LYS HZ3 H 0.469 -3.080 12.339 1.00 . B B . 4 LYS HZ3 1 1 10 6933 2 1 4 LYS N N -0.741 -6.705 7.445 1.00 . B B . 4 LYS N 1 1 10 6934 2 1 4 LYS NZ N 0.300 -4.019 11.926 1.00 . B B . 4 LYS NZ 1 1 10 6935 2 1 4 LYS O O -1.765 -4.532 4.791 1.00 . B B . 4 LYS O 1 1 10 6936 2 1 5 TYR C C -0.774 -6.741 2.729 1.00 . B B . 5 TYR C 1 1 10 6937 2 1 5 TYR CA C 0.203 -5.888 3.529 1.00 . B B . 5 TYR CA 1 1 10 6938 2 1 5 TYR CB C 1.626 -6.388 3.312 1.00 . B B . 5 TYR CB 1 1 10 6939 2 1 5 TYR CD1 C 2.969 -4.650 4.554 1.00 . B B . 5 TYR CD1 1 1 10 6940 2 1 5 TYR CD2 C 2.828 -6.892 5.469 1.00 . B B . 5 TYR CD2 1 1 10 6941 2 1 5 TYR CE1 C 3.776 -4.263 5.631 1.00 . B B . 5 TYR CE1 1 1 10 6942 2 1 5 TYR CE2 C 3.634 -6.504 6.545 1.00 . B B . 5 TYR CE2 1 1 10 6943 2 1 5 TYR CG C 2.494 -5.966 4.474 1.00 . B B . 5 TYR CG 1 1 10 6944 2 1 5 TYR CZ C 4.109 -5.189 6.626 1.00 . B B . 5 TYR CZ 1 1 10 6945 2 1 5 TYR H H 0.408 -6.570 5.547 1.00 . B B . 5 TYR H 1 1 10 6946 2 1 5 TYR HA H 0.130 -4.872 3.197 1.00 . B B . 5 TYR HA 1 1 10 6947 2 1 5 TYR HB2 H 1.624 -7.467 3.233 1.00 . B B . 5 TYR HB2 1 1 10 6948 2 1 5 TYR HB3 H 2.009 -5.958 2.411 1.00 . B B . 5 TYR HB3 1 1 10 6949 2 1 5 TYR HD1 H 2.712 -3.932 3.787 1.00 . B B . 5 TYR HD1 1 1 10 6950 2 1 5 TYR HD2 H 2.462 -7.906 5.405 1.00 . B B . 5 TYR HD2 1 1 10 6951 2 1 5 TYR HE1 H 4.141 -3.248 5.694 1.00 . B B . 5 TYR HE1 1 1 10 6952 2 1 5 TYR HE2 H 3.891 -7.219 7.313 1.00 . B B . 5 TYR HE2 1 1 10 6953 2 1 5 TYR HH H 5.644 -4.303 7.335 1.00 . B B . 5 TYR HH 1 1 10 6954 2 1 5 TYR N N -0.119 -5.978 4.974 1.00 . B B . 5 TYR N 1 1 10 6955 2 1 5 TYR O O -1.008 -6.501 1.562 1.00 . B B . 5 TYR O 1 1 10 6956 2 1 5 TYR OH O 4.905 -4.807 7.686 1.00 . B B . 5 TYR OH 1 1 10 6957 2 1 6 LEU C C -3.710 -8.392 3.132 1.00 . B B . 6 LEU C 1 1 10 6958 2 1 6 LEU CA C -2.295 -8.600 2.600 1.00 . B B . 6 LEU CA 1 1 10 6959 2 1 6 LEU CB C -1.891 -10.059 2.800 1.00 . B B . 6 LEU CB 1 1 10 6960 2 1 6 LEU CD1 C -1.528 -10.903 0.480 1.00 . B B . 6 LEU CD1 1 1 10 6961 2 1 6 LEU CD2 C 0.104 -9.284 1.471 1.00 . B B . 6 LEU CD2 1 1 10 6962 2 1 6 LEU CG C -0.834 -10.464 1.770 1.00 . B B . 6 LEU CG 1 1 10 6963 2 1 6 LEU H H -1.139 -7.925 4.279 1.00 . B B . 6 LEU H 1 1 10 6964 2 1 6 LEU HA H -2.263 -8.350 1.551 1.00 . B B . 6 LEU HA 1 1 10 6965 2 1 6 LEU HB2 H -1.485 -10.183 3.795 1.00 . B B . 6 LEU HB2 1 1 10 6966 2 1 6 LEU HB3 H -2.760 -10.691 2.687 1.00 . B B . 6 LEU HB3 1 1 10 6967 2 1 6 LEU HD11 H -2.222 -11.699 0.698 1.00 . B B . 6 LEU HD11 1 1 10 6968 2 1 6 LEU HD12 H -0.787 -11.254 -0.224 1.00 . B B . 6 LEU HD12 1 1 10 6969 2 1 6 LEU HD13 H -2.062 -10.065 0.057 1.00 . B B . 6 LEU HD13 1 1 10 6970 2 1 6 LEU HD21 H 0.860 -9.593 0.765 1.00 . B B . 6 LEU HD21 1 1 10 6971 2 1 6 LEU HD22 H 0.577 -8.960 2.386 1.00 . B B . 6 LEU HD22 1 1 10 6972 2 1 6 LEU HD23 H -0.466 -8.464 1.051 1.00 . B B . 6 LEU HD23 1 1 10 6973 2 1 6 LEU HG H -0.261 -11.288 2.166 1.00 . B B . 6 LEU HG 1 1 10 6974 2 1 6 LEU N N -1.343 -7.738 3.340 1.00 . B B . 6 LEU N 1 1 10 6975 2 1 6 LEU O O -4.609 -9.158 2.850 1.00 . B B . 6 LEU O 1 1 10 6976 2 1 7 HIS C C -5.461 -5.642 4.739 1.00 . B B . 7 HIS C 1 1 10 6977 2 1 7 HIS CA C -5.275 -7.135 4.465 1.00 . B B . 7 HIS CA 1 1 10 6978 2 1 7 HIS CB C -5.432 -7.937 5.761 1.00 . B B . 7 HIS CB 1 1 10 6979 2 1 7 HIS CD2 C -3.299 -9.471 5.831 1.00 . B B . 7 HIS CD2 1 1 10 6980 2 1 7 HIS CE1 C -4.217 -11.332 5.216 1.00 . B B . 7 HIS CE1 1 1 10 6981 2 1 7 HIS CG C -4.634 -9.211 5.647 1.00 . B B . 7 HIS CG 1 1 10 6982 2 1 7 HIS H H -3.178 -6.768 4.139 1.00 . B B . 7 HIS H 1 1 10 6983 2 1 7 HIS HA H -6.015 -7.462 3.750 1.00 . B B . 7 HIS HA 1 1 10 6984 2 1 7 HIS HB2 H -5.065 -7.354 6.594 1.00 . B B . 7 HIS HB2 1 1 10 6985 2 1 7 HIS HB3 H -6.473 -8.177 5.916 1.00 . B B . 7 HIS HB3 1 1 10 6986 2 1 7 HIS HD1 H -6.147 -10.568 5.047 1.00 . B B . 7 HIS HD1 1 1 10 6987 2 1 7 HIS HD2 H -2.561 -8.744 6.129 1.00 . B B . 7 HIS HD2 1 1 10 6988 2 1 7 HIS HE1 H -4.359 -12.363 4.927 1.00 . B B . 7 HIS HE1 1 1 10 6989 2 1 7 HIS N N -3.916 -7.371 3.911 1.00 . B B . 7 HIS N 1 1 10 6990 2 1 7 HIS ND1 N -5.202 -10.413 5.257 1.00 . B B . 7 HIS ND1 1 1 10 6991 2 1 7 HIS NE2 N -3.038 -10.810 5.559 1.00 . B B . 7 HIS NE2 1 1 10 6992 2 1 7 HIS O O -6.355 -5.237 5.454 1.00 . B B . 7 HIS O 1 1 10 6993 2 1 8 SER C C -3.918 -2.615 3.344 1.00 . B B . 8 SER C 1 1 10 6994 2 1 8 SER CA C -4.758 -3.353 4.380 1.00 . B B . 8 SER CA 1 1 10 6995 2 1 8 SER CB C -4.276 -2.993 5.786 1.00 . B B . 8 SER CB 1 1 10 6996 2 1 8 SER H H -3.912 -5.164 3.583 1.00 . B B . 8 SER H 1 1 10 6997 2 1 8 SER HA H -5.791 -3.069 4.265 1.00 . B B . 8 SER HA 1 1 10 6998 2 1 8 SER HB2 H -3.448 -3.626 6.057 1.00 . B B . 8 SER HB2 1 1 10 6999 2 1 8 SER HB3 H -3.958 -1.960 5.802 1.00 . B B . 8 SER HB3 1 1 10 7000 2 1 8 SER HG H -5.325 -2.461 7.336 1.00 . B B . 8 SER HG 1 1 10 7001 2 1 8 SER N N -4.625 -4.819 4.164 1.00 . B B . 8 SER N 1 1 10 7002 2 1 8 SER O O -4.318 -1.594 2.819 1.00 . B B . 8 SER O 1 1 10 7003 2 1 8 SER OG O -5.338 -3.190 6.712 1.00 . B B . 8 SER OG 1 1 10 7004 2 1 9 ALA C C -2.639 -2.429 0.691 1.00 . B B . 9 ALA C 1 1 10 7005 2 1 9 ALA CA C -1.908 -2.448 2.025 1.00 . B B . 9 ALA CA 1 1 10 7006 2 1 9 ALA CB C -0.599 -3.210 1.856 1.00 . B B . 9 ALA CB 1 1 10 7007 2 1 9 ALA H H -2.456 -3.952 3.463 1.00 . B B . 9 ALA H 1 1 10 7008 2 1 9 ALA HA H -1.701 -1.437 2.341 1.00 . B B . 9 ALA HA 1 1 10 7009 2 1 9 ALA HB1 H -0.066 -2.817 1.004 1.00 . B B . 9 ALA HB1 1 1 10 7010 2 1 9 ALA HB2 H -0.809 -4.264 1.698 1.00 . B B . 9 ALA HB2 1 1 10 7011 2 1 9 ALA HB3 H 0.004 -3.091 2.743 1.00 . B B . 9 ALA HB3 1 1 10 7012 2 1 9 ALA N N -2.760 -3.124 3.036 1.00 . B B . 9 ALA N 1 1 10 7013 2 1 9 ALA O O -2.992 -1.384 0.192 1.00 . B B . 9 ALA O 1 1 10 7014 2 1 10 LYS C C -4.578 -2.523 -1.341 1.00 . B B . 10 LYS C 1 1 10 7015 2 1 10 LYS CA C -3.557 -3.657 -1.208 1.00 . B B . 10 LYS CA 1 1 10 7016 2 1 10 LYS CB C -4.280 -4.998 -1.330 1.00 . B B . 10 LYS CB 1 1 10 7017 2 1 10 LYS CD C -4.835 -5.425 -3.728 1.00 . B B . 10 LYS CD 1 1 10 7018 2 1 10 LYS CE C -4.721 -3.963 -4.164 1.00 . B B . 10 LYS CE 1 1 10 7019 2 1 10 LYS CG C -3.830 -5.703 -2.610 1.00 . B B . 10 LYS CG 1 1 10 7020 2 1 10 LYS H H -2.539 -4.413 0.551 1.00 . B B . 10 LYS H 1 1 10 7021 2 1 10 LYS HA H -2.830 -3.572 -1.998 1.00 . B B . 10 LYS HA 1 1 10 7022 2 1 10 LYS HB2 H -4.045 -5.614 -0.475 1.00 . B B . 10 LYS HB2 1 1 10 7023 2 1 10 LYS HB3 H -5.345 -4.827 -1.371 1.00 . B B . 10 LYS HB3 1 1 10 7024 2 1 10 LYS HD2 H -4.626 -6.070 -4.570 1.00 . B B . 10 LYS HD2 1 1 10 7025 2 1 10 LYS HD3 H -5.836 -5.614 -3.370 1.00 . B B . 10 LYS HD3 1 1 10 7026 2 1 10 LYS HE2 H -3.976 -3.465 -3.562 1.00 . B B . 10 LYS HE2 1 1 10 7027 2 1 10 LYS HE3 H -4.432 -3.920 -5.204 1.00 . B B . 10 LYS HE3 1 1 10 7028 2 1 10 LYS HG2 H -2.856 -5.337 -2.901 1.00 . B B . 10 LYS HG2 1 1 10 7029 2 1 10 LYS HG3 H -3.778 -6.766 -2.435 1.00 . B B . 10 LYS HG3 1 1 10 7030 2 1 10 LYS HZ1 H -6.757 -3.992 -3.728 1.00 . B B . 10 LYS HZ1 1 1 10 7031 2 1 10 LYS HZ2 H -6.310 -2.822 -4.877 1.00 . B B . 10 LYS HZ2 1 1 10 7032 2 1 10 LYS HZ3 H -5.962 -2.577 -3.231 1.00 . B B . 10 LYS HZ3 1 1 10 7033 2 1 10 LYS N N -2.854 -3.585 0.114 1.00 . B B . 10 LYS N 1 1 10 7034 2 1 10 LYS NZ N -6.037 -3.287 -3.987 1.00 . B B . 10 LYS NZ 1 1 10 7035 2 1 10 LYS O O -4.663 -1.874 -2.366 1.00 . B B . 10 LYS O 1 1 10 7036 2 1 11 LYS C C -5.629 0.129 -0.778 1.00 . B B . 11 LYS C 1 1 10 7037 2 1 11 LYS CA C -6.348 -1.167 -0.407 1.00 . B B . 11 LYS CA 1 1 10 7038 2 1 11 LYS CB C -7.048 -0.998 0.944 1.00 . B B . 11 LYS CB 1 1 10 7039 2 1 11 LYS CD C -8.943 -2.218 2.028 1.00 . B B . 11 LYS CD 1 1 10 7040 2 1 11 LYS CE C -9.942 -2.977 1.153 1.00 . B B . 11 LYS CE 1 1 10 7041 2 1 11 LYS CG C -7.536 -2.360 1.442 1.00 . B B . 11 LYS CG 1 1 10 7042 2 1 11 LYS H H -5.266 -2.794 0.504 1.00 . B B . 11 LYS H 1 1 10 7043 2 1 11 LYS HA H -7.077 -1.402 -1.167 1.00 . B B . 11 LYS HA 1 1 10 7044 2 1 11 LYS HB2 H -6.353 -0.581 1.659 1.00 . B B . 11 LYS HB2 1 1 10 7045 2 1 11 LYS HB3 H -7.892 -0.334 0.833 1.00 . B B . 11 LYS HB3 1 1 10 7046 2 1 11 LYS HD2 H -8.957 -2.624 3.029 1.00 . B B . 11 LYS HD2 1 1 10 7047 2 1 11 LYS HD3 H -9.216 -1.173 2.060 1.00 . B B . 11 LYS HD3 1 1 10 7048 2 1 11 LYS HE2 H -9.930 -2.569 0.154 1.00 . B B . 11 LYS HE2 1 1 10 7049 2 1 11 LYS HE3 H -9.668 -4.022 1.118 1.00 . B B . 11 LYS HE3 1 1 10 7050 2 1 11 LYS HG2 H -7.557 -3.058 0.617 1.00 . B B . 11 LYS HG2 1 1 10 7051 2 1 11 LYS HG3 H -6.866 -2.725 2.206 1.00 . B B . 11 LYS HG3 1 1 10 7052 2 1 11 LYS HZ1 H -11.447 -1.873 2.076 1.00 . B B . 11 LYS HZ1 1 1 10 7053 2 1 11 LYS HZ2 H -11.421 -3.513 2.518 1.00 . B B . 11 LYS HZ2 1 1 10 7054 2 1 11 LYS HZ3 H -12.017 -3.050 0.997 1.00 . B B . 11 LYS HZ3 1 1 10 7055 2 1 11 LYS N N -5.348 -2.268 -0.318 1.00 . B B . 11 LYS N 1 1 10 7056 2 1 11 LYS NZ N -11.310 -2.843 1.730 1.00 . B B . 11 LYS NZ 1 1 10 7057 2 1 11 LYS O O -5.839 0.687 -1.836 1.00 . B B . 11 LYS O 1 1 10 7058 2 1 12 PHE C C -3.021 1.548 -1.350 1.00 . B B . 12 PHE C 1 1 10 7059 2 1 12 PHE CA C -4.024 1.856 -0.239 1.00 . B B . 12 PHE CA 1 1 10 7060 2 1 12 PHE CB C -3.277 2.351 1.007 1.00 . B B . 12 PHE CB 1 1 10 7061 2 1 12 PHE CD1 C -5.434 2.148 2.292 1.00 . B B . 12 PHE CD1 1 1 10 7062 2 1 12 PHE CD2 C -3.377 1.417 3.348 1.00 . B B . 12 PHE CD2 1 1 10 7063 2 1 12 PHE CE1 C -6.151 1.788 3.440 1.00 . B B . 12 PHE CE1 1 1 10 7064 2 1 12 PHE CE2 C -4.093 1.057 4.495 1.00 . B B . 12 PHE CE2 1 1 10 7065 2 1 12 PHE CG C -4.047 1.964 2.246 1.00 . B B . 12 PHE CG 1 1 10 7066 2 1 12 PHE CZ C -5.480 1.241 4.541 1.00 . B B . 12 PHE CZ 1 1 10 7067 2 1 12 PHE H H -4.601 0.135 0.919 1.00 . B B . 12 PHE H 1 1 10 7068 2 1 12 PHE HA H -4.716 2.614 -0.576 1.00 . B B . 12 PHE HA 1 1 10 7069 2 1 12 PHE HB2 H -2.294 1.901 1.039 1.00 . B B . 12 PHE HB2 1 1 10 7070 2 1 12 PHE HB3 H -3.179 3.429 0.967 1.00 . B B . 12 PHE HB3 1 1 10 7071 2 1 12 PHE HD1 H -5.951 2.570 1.443 1.00 . B B . 12 PHE HD1 1 1 10 7072 2 1 12 PHE HD2 H -2.307 1.275 3.312 1.00 . B B . 12 PHE HD2 1 1 10 7073 2 1 12 PHE HE1 H -7.221 1.930 3.475 1.00 . B B . 12 PHE HE1 1 1 10 7074 2 1 12 PHE HE2 H -3.576 0.636 5.344 1.00 . B B . 12 PHE HE2 1 1 10 7075 2 1 12 PHE HZ H -6.033 0.963 5.426 1.00 . B B . 12 PHE HZ 1 1 10 7076 2 1 12 PHE N N -4.767 0.606 0.078 1.00 . B B . 12 PHE N 1 1 10 7077 2 1 12 PHE O O -2.793 2.344 -2.237 1.00 . B B . 12 PHE O 1 1 10 7078 2 1 13 GLY C C -1.980 0.413 -3.725 1.00 . B B . 13 GLY C 1 1 10 7079 2 1 13 GLY CA C -1.442 0.007 -2.357 1.00 . B B . 13 GLY CA 1 1 10 7080 2 1 13 GLY H H -2.632 -0.239 -0.583 1.00 . B B . 13 GLY H 1 1 10 7081 2 1 13 GLY HA2 H -0.503 0.508 -2.173 1.00 . B B . 13 GLY HA2 1 1 10 7082 2 1 13 GLY HA3 H -1.289 -1.062 -2.336 1.00 . B B . 13 GLY HA3 1 1 10 7083 2 1 13 GLY N N -2.426 0.387 -1.307 1.00 . B B . 13 GLY N 1 1 10 7084 2 1 13 GLY O O -1.239 0.826 -4.595 1.00 . B B . 13 GLY O 1 1 10 7085 2 1 14 LYS C C -4.406 2.091 -5.185 1.00 . B B . 14 LYS C 1 1 10 7086 2 1 14 LYS CA C -3.834 0.674 -5.249 1.00 . B B . 14 LYS CA 1 1 10 7087 2 1 14 LYS CB C -4.944 -0.305 -5.625 1.00 . B B . 14 LYS CB 1 1 10 7088 2 1 14 LYS CD C -4.139 -0.842 -7.926 1.00 . B B . 14 LYS CD 1 1 10 7089 2 1 14 LYS CE C -5.446 -0.894 -8.717 1.00 . B B . 14 LYS CE 1 1 10 7090 2 1 14 LYS CG C -4.372 -1.403 -6.522 1.00 . B B . 14 LYS CG 1 1 10 7091 2 1 14 LYS H H -3.849 -0.046 -3.215 1.00 . B B . 14 LYS H 1 1 10 7092 2 1 14 LYS HA H -3.057 0.640 -5.994 1.00 . B B . 14 LYS HA 1 1 10 7093 2 1 14 LYS HB2 H -5.353 -0.747 -4.728 1.00 . B B . 14 LYS HB2 1 1 10 7094 2 1 14 LYS HB3 H -5.723 0.222 -6.155 1.00 . B B . 14 LYS HB3 1 1 10 7095 2 1 14 LYS HD2 H -3.802 0.182 -7.852 1.00 . B B . 14 LYS HD2 1 1 10 7096 2 1 14 LYS HD3 H -3.390 -1.433 -8.432 1.00 . B B . 14 LYS HD3 1 1 10 7097 2 1 14 LYS HE2 H -5.824 -1.906 -8.721 1.00 . B B . 14 LYS HE2 1 1 10 7098 2 1 14 LYS HE3 H -6.171 -0.241 -8.256 1.00 . B B . 14 LYS HE3 1 1 10 7099 2 1 14 LYS HG2 H -3.434 -1.751 -6.113 1.00 . B B . 14 LYS HG2 1 1 10 7100 2 1 14 LYS HG3 H -5.069 -2.225 -6.577 1.00 . B B . 14 LYS HG3 1 1 10 7101 2 1 14 LYS HZ1 H -5.488 -1.201 -10.776 1.00 . B B . 14 LYS HZ1 1 1 10 7102 2 1 14 LYS HZ2 H -4.185 -0.250 -10.244 1.00 . B B . 14 LYS HZ2 1 1 10 7103 2 1 14 LYS HZ3 H -5.749 0.410 -10.312 1.00 . B B . 14 LYS HZ3 1 1 10 7104 2 1 14 LYS N N -3.263 0.296 -3.928 1.00 . B B . 14 LYS N 1 1 10 7105 2 1 14 LYS NZ N -5.198 -0.450 -10.119 1.00 . B B . 14 LYS NZ 1 1 10 7106 2 1 14 LYS O O -4.704 2.693 -6.197 1.00 . B B . 14 LYS O 1 1 10 7107 2 1 15 ALA C C -3.989 4.994 -3.596 1.00 . B B . 15 ALA C 1 1 10 7108 2 1 15 ALA CA C -5.119 4.006 -3.900 1.00 . B B . 15 ALA CA 1 1 10 7109 2 1 15 ALA CB C -6.152 4.051 -2.773 1.00 . B B . 15 ALA CB 1 1 10 7110 2 1 15 ALA H H -4.320 2.132 -3.203 1.00 . B B . 15 ALA H 1 1 10 7111 2 1 15 ALA HA H -5.593 4.275 -4.833 1.00 . B B . 15 ALA HA 1 1 10 7112 2 1 15 ALA HB1 H -6.736 4.956 -2.854 1.00 . B B . 15 ALA HB1 1 1 10 7113 2 1 15 ALA HB2 H -5.645 4.035 -1.819 1.00 . B B . 15 ALA HB2 1 1 10 7114 2 1 15 ALA HB3 H -6.805 3.193 -2.848 1.00 . B B . 15 ALA HB3 1 1 10 7115 2 1 15 ALA N N -4.564 2.630 -4.010 1.00 . B B . 15 ALA N 1 1 10 7116 2 1 15 ALA O O -3.851 6.011 -4.243 1.00 . B B . 15 ALA O 1 1 10 7117 2 1 16 TRP C C -1.243 5.937 -3.498 1.00 . B B . 16 TRP C 1 1 10 7118 2 1 16 TRP CA C -2.066 5.607 -2.253 1.00 . B B . 16 TRP CA 1 1 10 7119 2 1 16 TRP CB C -1.197 4.932 -1.177 1.00 . B B . 16 TRP CB 1 1 10 7120 2 1 16 TRP CD1 C -0.086 2.719 -1.729 1.00 . B B . 16 TRP CD1 1 1 10 7121 2 1 16 TRP CD2 C 1.009 4.481 -2.569 1.00 . B B . 16 TRP CD2 1 1 10 7122 2 1 16 TRP CE2 C 1.734 3.336 -2.967 1.00 . B B . 16 TRP CE2 1 1 10 7123 2 1 16 TRP CE3 C 1.475 5.734 -2.957 1.00 . B B . 16 TRP CE3 1 1 10 7124 2 1 16 TRP CG C -0.143 4.067 -1.799 1.00 . B B . 16 TRP CG 1 1 10 7125 2 1 16 TRP CH2 C 3.351 4.705 -4.119 1.00 . B B . 16 TRP CH2 1 1 10 7126 2 1 16 TRP CZ2 C 2.895 3.440 -3.734 1.00 . B B . 16 TRP CZ2 1 1 10 7127 2 1 16 TRP CZ3 C 2.644 5.850 -3.730 1.00 . B B . 16 TRP CZ3 1 1 10 7128 2 1 16 TRP H H -3.313 3.875 -2.113 1.00 . B B . 16 TRP H 1 1 10 7129 2 1 16 TRP HA H -2.470 6.524 -1.853 1.00 . B B . 16 TRP HA 1 1 10 7130 2 1 16 TRP HB2 H -0.721 5.692 -0.581 1.00 . B B . 16 TRP HB2 1 1 10 7131 2 1 16 TRP HB3 H -1.826 4.326 -0.543 1.00 . B B . 16 TRP HB3 1 1 10 7132 2 1 16 TRP HD1 H -0.794 2.088 -1.217 1.00 . B B . 16 TRP HD1 1 1 10 7133 2 1 16 TRP HE1 H 1.291 1.344 -2.541 1.00 . B B . 16 TRP HE1 1 1 10 7134 2 1 16 TRP HE3 H 0.927 6.613 -2.651 1.00 . B B . 16 TRP HE3 1 1 10 7135 2 1 16 TRP HH2 H 4.248 4.802 -4.716 1.00 . B B . 16 TRP HH2 1 1 10 7136 2 1 16 TRP HZ2 H 3.435 2.553 -4.030 1.00 . B B . 16 TRP HZ2 1 1 10 7137 2 1 16 TRP HZ3 H 2.997 6.822 -4.028 1.00 . B B . 16 TRP HZ3 1 1 10 7138 2 1 16 TRP N N -3.183 4.698 -2.615 1.00 . B B . 16 TRP N 1 1 10 7139 2 1 16 TRP NE1 N 1.025 2.281 -2.430 1.00 . B B . 16 TRP NE1 1 1 10 7140 2 1 16 TRP O O -0.875 7.073 -3.723 1.00 . B B . 16 TRP O 1 1 10 7141 2 1 17 VAL C C -0.889 6.289 -6.374 1.00 . B B . 17 VAL C 1 1 10 7142 2 1 17 VAL CA C -0.151 5.246 -5.531 1.00 . B B . 17 VAL CA 1 1 10 7143 2 1 17 VAL CB C 0.059 3.945 -6.320 1.00 . B B . 17 VAL CB 1 1 10 7144 2 1 17 VAL CG1 C -1.072 3.733 -7.332 1.00 . B B . 17 VAL CG1 1 1 10 7145 2 1 17 VAL CG2 C 1.400 4.017 -7.053 1.00 . B B . 17 VAL CG2 1 1 10 7146 2 1 17 VAL H H -1.251 4.050 -4.118 1.00 . B B . 17 VAL H 1 1 10 7147 2 1 17 VAL HA H 0.810 5.645 -5.239 1.00 . B B . 17 VAL HA 1 1 10 7148 2 1 17 VAL HB H 0.074 3.114 -5.630 1.00 . B B . 17 VAL HB 1 1 10 7149 2 1 17 VAL HG11 H -1.152 4.602 -7.970 1.00 . B B . 17 VAL HG11 1 1 10 7150 2 1 17 VAL HG12 H -2.002 3.587 -6.805 1.00 . B B . 17 VAL HG12 1 1 10 7151 2 1 17 VAL HG13 H -0.858 2.863 -7.934 1.00 . B B . 17 VAL HG13 1 1 10 7152 2 1 17 VAL HG21 H 1.256 4.461 -8.026 1.00 . B B . 17 VAL HG21 1 1 10 7153 2 1 17 VAL HG22 H 1.803 3.022 -7.165 1.00 . B B . 17 VAL HG22 1 1 10 7154 2 1 17 VAL HG23 H 2.089 4.623 -6.480 1.00 . B B . 17 VAL HG23 1 1 10 7155 2 1 17 VAL N N -0.949 4.962 -4.310 1.00 . B B . 17 VAL N 1 1 10 7156 2 1 17 VAL O O -0.326 7.283 -6.788 1.00 . B B . 17 VAL O 1 1 10 7157 2 1 18 GLY C C -2.847 8.444 -6.710 1.00 . B B . 18 GLY C 1 1 10 7158 2 1 18 GLY CA C -2.925 7.083 -7.406 1.00 . B B . 18 GLY CA 1 1 10 7159 2 1 18 GLY H H -2.603 5.291 -6.253 1.00 . B B . 18 GLY H 1 1 10 7160 2 1 18 GLY HA2 H -2.500 7.155 -8.398 1.00 . B B . 18 GLY HA2 1 1 10 7161 2 1 18 GLY HA3 H -3.956 6.774 -7.474 1.00 . B B . 18 GLY HA3 1 1 10 7162 2 1 18 GLY N N -2.155 6.087 -6.611 1.00 . B B . 18 GLY N 1 1 10 7163 2 1 18 GLY O O -3.176 9.464 -7.280 1.00 . B B . 18 GLY O 1 1 10 7164 2 1 19 GLU C C -0.872 10.270 -4.890 1.00 . B B . 19 GLU C 1 1 10 7165 2 1 19 GLU CA C -2.288 9.737 -4.728 1.00 . B B . 19 GLU CA 1 1 10 7166 2 1 19 GLU CB C -2.532 9.458 -3.243 1.00 . B B . 19 GLU CB 1 1 10 7167 2 1 19 GLU CD C -4.985 9.499 -2.785 1.00 . B B . 19 GLU CD 1 1 10 7168 2 1 19 GLU CG C -3.783 8.604 -3.083 1.00 . B B . 19 GLU CG 1 1 10 7169 2 1 19 GLU H H -2.143 7.628 -5.043 1.00 . B B . 19 GLU H 1 1 10 7170 2 1 19 GLU HA H -3.003 10.456 -5.094 1.00 . B B . 19 GLU HA 1 1 10 7171 2 1 19 GLU HB2 H -1.681 8.922 -2.836 1.00 . B B . 19 GLU HB2 1 1 10 7172 2 1 19 GLU HB3 H -2.663 10.391 -2.714 1.00 . B B . 19 GLU HB3 1 1 10 7173 2 1 19 GLU HG2 H -3.956 8.055 -3.995 1.00 . B B . 19 GLU HG2 1 1 10 7174 2 1 19 GLU HG3 H -3.637 7.912 -2.268 1.00 . B B . 19 GLU HG3 1 1 10 7175 2 1 19 GLU N N -2.404 8.461 -5.479 1.00 . B B . 19 GLU N 1 1 10 7176 2 1 19 GLU O O -0.638 11.308 -5.476 1.00 . B B . 19 GLU O 1 1 10 7177 2 1 19 GLU OE1 O -5.134 10.502 -3.463 1.00 . B B . 19 GLU OE1 1 1 10 7178 2 1 19 GLU OE2 O -5.739 9.165 -1.885 1.00 . B B . 19 GLU OE2 1 1 10 7179 2 1 20 ILE C C 1.960 9.855 -5.904 1.00 . B B . 20 ILE C 1 1 10 7180 2 1 20 ILE CA C 1.486 9.977 -4.458 1.00 . B B . 20 ILE CA 1 1 10 7181 2 1 20 ILE CB C 2.313 9.056 -3.564 1.00 . B B . 20 ILE CB 1 1 10 7182 2 1 20 ILE CD1 C 3.197 8.749 -1.241 1.00 . B B . 20 ILE CD1 1 1 10 7183 2 1 20 ILE CG1 C 2.251 9.564 -2.128 1.00 . B B . 20 ILE CG1 1 1 10 7184 2 1 20 ILE CG2 C 3.774 9.023 -4.033 1.00 . B B . 20 ILE CG2 1 1 10 7185 2 1 20 ILE H H -0.156 8.719 -3.892 1.00 . B B . 20 ILE H 1 1 10 7186 2 1 20 ILE HA H 1.581 10.994 -4.122 1.00 . B B . 20 ILE HA 1 1 10 7187 2 1 20 ILE HB H 1.888 8.064 -3.609 1.00 . B B . 20 ILE HB 1 1 10 7188 2 1 20 ILE HD11 H 3.584 9.381 -0.454 1.00 . B B . 20 ILE HD11 1 1 10 7189 2 1 20 ILE HD12 H 4.017 8.370 -1.832 1.00 . B B . 20 ILE HD12 1 1 10 7190 2 1 20 ILE HD13 H 2.657 7.922 -0.803 1.00 . B B . 20 ILE HD13 1 1 10 7191 2 1 20 ILE HG12 H 2.538 10.605 -2.104 1.00 . B B . 20 ILE HG12 1 1 10 7192 2 1 20 ILE HG13 H 1.242 9.458 -1.764 1.00 . B B . 20 ILE HG13 1 1 10 7193 2 1 20 ILE HG21 H 3.818 8.640 -5.043 1.00 . B B . 20 ILE HG21 1 1 10 7194 2 1 20 ILE HG22 H 4.348 8.381 -3.380 1.00 . B B . 20 ILE HG22 1 1 10 7195 2 1 20 ILE HG23 H 4.184 10.022 -4.008 1.00 . B B . 20 ILE HG23 1 1 10 7196 2 1 20 ILE N N 0.071 9.552 -4.363 1.00 . B B . 20 ILE N 1 1 10 7197 2 1 20 ILE O O 2.534 10.768 -6.463 1.00 . B B . 20 ILE O 1 1 10 7198 2 1 21 MET C C 1.574 9.600 -8.804 1.00 . B B . 21 MET C 1 1 10 7199 2 1 21 MET CA C 2.185 8.522 -7.904 1.00 . B B . 21 MET CA 1 1 10 7200 2 1 21 MET CB C 1.751 7.134 -8.370 1.00 . B B . 21 MET CB 1 1 10 7201 2 1 21 MET CE C 2.539 5.822 -11.660 1.00 . B B . 21 MET CE 1 1 10 7202 2 1 21 MET CG C 2.929 6.439 -9.046 1.00 . B B . 21 MET CG 1 1 10 7203 2 1 21 MET H H 1.282 7.999 -6.026 1.00 . B B . 21 MET H 1 1 10 7204 2 1 21 MET HA H 3.264 8.587 -7.943 1.00 . B B . 21 MET HA 1 1 10 7205 2 1 21 MET HB2 H 1.438 6.552 -7.514 1.00 . B B . 21 MET HB2 1 1 10 7206 2 1 21 MET HB3 H 0.933 7.224 -9.071 1.00 . B B . 21 MET HB3 1 1 10 7207 2 1 21 MET HE1 H 3.274 5.503 -12.387 1.00 . B B . 21 MET HE1 1 1 10 7208 2 1 21 MET HE2 H 1.653 6.157 -12.174 1.00 . B B . 21 MET HE2 1 1 10 7209 2 1 21 MET HE3 H 2.286 4.997 -11.010 1.00 . B B . 21 MET HE3 1 1 10 7210 2 1 21 MET HG2 H 3.812 6.559 -8.432 1.00 . B B . 21 MET HG2 1 1 10 7211 2 1 21 MET HG3 H 2.707 5.388 -9.160 1.00 . B B . 21 MET HG3 1 1 10 7212 2 1 21 MET N N 1.737 8.723 -6.504 1.00 . B B . 21 MET N 1 1 10 7213 2 1 21 MET O O 2.011 9.811 -9.918 1.00 . B B . 21 MET O 1 1 10 7214 2 1 21 MET SD S 3.218 7.178 -10.673 1.00 . B B . 21 MET SD 1 1 10 7215 2 1 22 ASN C C 0.420 12.728 -8.665 1.00 . B B . 22 ASN C 1 1 10 7216 2 1 22 ASN CA C -0.058 11.358 -9.160 1.00 . B B . 22 ASN CA 1 1 10 7217 2 1 22 ASN CB C -1.592 11.251 -9.060 1.00 . B B . 22 ASN CB 1 1 10 7218 2 1 22 ASN CG C -2.126 12.125 -7.916 1.00 . B B . 22 ASN CG 1 1 10 7219 2 1 22 ASN H H 0.232 10.109 -7.429 1.00 . B B . 22 ASN H 1 1 10 7220 2 1 22 ASN HA H 0.243 11.229 -10.190 1.00 . B B . 22 ASN HA 1 1 10 7221 2 1 22 ASN HB2 H -2.032 11.578 -9.992 1.00 . B B . 22 ASN HB2 1 1 10 7222 2 1 22 ASN HB3 H -1.864 10.220 -8.877 1.00 . B B . 22 ASN HB3 1 1 10 7223 2 1 22 ASN HD21 H -1.924 13.822 -8.932 1.00 . B B . 22 ASN HD21 1 1 10 7224 2 1 22 ASN HD22 H -2.545 13.984 -7.350 1.00 . B B . 22 ASN HD22 1 1 10 7225 2 1 22 ASN N N 0.570 10.289 -8.330 1.00 . B B . 22 ASN N 1 1 10 7226 2 1 22 ASN ND2 N -2.205 13.417 -8.080 1.00 . B B . 22 ASN ND2 1 1 10 7227 2 1 22 ASN O O 0.806 13.582 -9.438 1.00 . B B . 22 ASN O 1 1 10 7228 2 1 22 ASN OD1 O -2.473 11.627 -6.864 1.00 . B B . 22 ASN OD1 1 1 10 7229 2 1 23 SER C C 2.181 14.068 -6.104 1.00 . B B . 23 SER C 1 1 10 7230 2 1 23 SER CA C 0.842 14.250 -6.823 1.00 . B B . 23 SER CA 1 1 10 7231 2 1 23 SER CB C -0.202 14.763 -5.831 1.00 . B B . 23 SER CB 1 1 10 7232 2 1 23 SER H H 0.079 12.237 -6.771 1.00 . B B . 23 SER H 1 1 10 7233 2 1 23 SER HA H 0.958 14.961 -7.627 1.00 . B B . 23 SER HA 1 1 10 7234 2 1 23 SER HB2 H -0.960 15.319 -6.359 1.00 . B B . 23 SER HB2 1 1 10 7235 2 1 23 SER HB3 H -0.660 13.922 -5.327 1.00 . B B . 23 SER HB3 1 1 10 7236 2 1 23 SER HG H -0.242 16.183 -4.501 1.00 . B B . 23 SER HG 1 1 10 7237 2 1 23 SER N N 0.395 12.940 -7.376 1.00 . B B . 23 SER N 1 1 10 7238 2 1 23 SER O O 3.199 14.374 -6.702 1.00 . B B . 23 SER O 1 1 10 7239 2 1 23 SER OXT O 2.165 13.628 -4.966 1.00 . B B . 23 SER OXT 1 1 10 7240 2 1 23 SER OG O 0.429 15.614 -4.883 1.00 . B B . 23 SER OG 1 1 stop_ save_
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