NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
651351 | 6vpn | 30720 | cing | 4-filtered-FRED | STAR | entry | full | 676 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6vpn # This FRED archive file contains, for PDB entry <6vpn>: # # - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. 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.PDB_coordinate_file_version . _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_6vpn _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6vpn _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5442.03 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 $Knot1_domain_containing_protein A . 1 1 stop_ save_ save_Knot1_domain_containing_protein _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Knot1 domain containing protein" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KTCENLADTYKGPCFTTGSCDDHCKNKEHLRSGRCRDDFRCWCTKNC _Entity.Number_of_monomers 47 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 LYS . 1 1 2 THR . 1 1 3 CYS . 1 1 4 GLU . 1 1 5 ASN . 1 1 6 LEU . 1 1 7 ALA . 1 1 8 ASP . 1 1 9 THR . 1 1 10 TYR . 1 1 11 LYS . 1 1 12 GLY . 1 1 13 PRO . 1 1 14 CYS . 1 1 15 PHE . 1 1 16 THR . 1 1 17 THR . 1 1 18 GLY . 1 1 19 SER . 1 1 20 CYS . 1 1 21 ASP . 1 1 22 ASP . 1 1 23 HIS . 1 1 24 CYS . 1 1 25 LYS . 1 1 26 ASN . 1 1 27 LYS . 1 1 28 GLU . 1 1 29 HIS . 1 1 30 LEU . 1 1 31 ARG . 1 1 32 SER . 1 1 33 GLY . 1 1 34 ARG . 1 1 35 CYS . 1 1 36 ARG . 1 1 37 ASP . 1 1 38 ASP . 1 1 39 PHE . 1 1 40 ARG . 1 1 41 CYS . 1 1 42 TRP . 1 1 43 CYS . 1 1 44 THR . 1 1 45 LYS . 1 1 46 ASN . 1 1 47 CYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID LYS 1 1 1 1 THR 2 2 1 1 CYS 3 3 1 1 GLU 4 4 1 1 ASN 5 5 1 1 LEU 6 6 1 1 ALA 7 7 1 1 ASP 8 8 1 1 THR 9 9 1 1 TYR 10 10 1 1 LYS 11 11 1 1 GLY 12 12 1 1 PRO 13 13 1 1 CYS 14 14 1 1 PHE 15 15 1 1 THR 16 16 1 1 THR 17 17 1 1 GLY 18 18 1 1 SER 19 19 1 1 CYS 20 20 1 1 ASP 21 21 1 1 ASP 22 22 1 1 HIS 23 23 1 1 CYS 24 24 1 1 LYS 25 25 1 1 ASN 26 26 1 1 LYS 27 27 1 1 GLU 28 28 1 1 HIS 29 29 1 1 LEU 30 30 1 1 ARG 31 31 1 1 SER 32 32 1 1 GLY 33 33 1 1 ARG 34 34 1 1 CYS 35 35 1 1 ARG 36 36 1 1 ASP 37 37 1 1 ASP 38 38 1 1 PHE 39 39 1 1 ARG 40 40 1 1 CYS 41 41 1 1 TRP 42 42 1 1 CYS 43 43 1 1 THR 44 44 1 1 LYS 45 45 1 1 ASN 46 46 1 1 CYS 47 47 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 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 12 GLY H . 12 . HN 1 1 1 1 2 1 1 13 PRO HD2 . 13 . HD2 1 1 2 1 1 1 1 12 GLY H . 12 . HN 1 1 2 1 2 1 1 13 PRO HD3 . 13 . HD1 1 1 3 1 1 1 1 11 LYS HA . 11 . HA 1 1 3 1 2 1 1 12 GLY H . 12 . HN 1 1 4 1 1 1 1 11 LYS H . 11 . HN 1 1 4 1 2 1 1 12 GLY H . 12 . HN 1 1 5 1 1 1 1 11 LYS H . 11 . HN 1 1 5 1 2 1 1 11 LYS HG3 . 11 . HG1 1 1 6 1 1 1 1 11 LYS H . 11 . HN 1 1 6 1 2 1 1 11 LYS HG2 . 11 . HG2 1 1 7 1 1 1 1 10 TYR HA . 10 . HA 1 1 7 1 2 1 1 11 LYS H . 11 . HN 1 1 8 1 1 1 1 7 ALA MB . 7 . HB# 1 1 8 1 2 1 1 10 TYR H . 10 . HN 1 1 9 1 1 1 1 23 HIS H . 23 . HN 1 1 9 1 2 1 1 23 HIS HB3 . 23 . HB1 1 1 10 1 1 1 1 33 GLY HA3 . 33 . HA1 1 1 10 1 2 1 1 34 ARG H . 34 . HN 1 1 11 1 1 1 1 33 GLY HA2 . 33 . HA2 1 1 11 1 2 1 1 34 ARG H . 34 . HN 1 1 12 1 1 1 1 33 GLY H . 33 . HN 1 1 12 1 2 1 1 34 ARG H . 34 . HN 1 1 13 1 1 1 1 32 SER HA . 32 . HA 1 1 13 1 2 1 1 33 GLY H . 33 . HN 1 1 14 1 1 1 1 32 SER H . 32 . HN 1 1 14 1 2 1 1 33 GLY H . 33 . HN 1 1 15 1 1 1 1 23 HIS HB2 . 23 . HB2 1 1 15 1 2 1 1 24 CYS H . 24 . HN 1 1 16 1 1 1 1 23 HIS HB3 . 23 . HB1 1 1 16 1 2 1 1 24 CYS H . 24 . HN 1 1 17 1 1 1 1 23 HIS H . 23 . HN 1 1 17 1 2 1 1 24 CYS H . 24 . HN 1 1 18 1 1 1 1 24 CYS H . 24 . HN 1 1 18 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 19 1 1 1 1 24 CYS H . 24 . HN 1 1 19 1 2 1 1 24 CYS HB3 . 24 . HB1 1 1 20 1 1 1 1 1 LYS HA . 1 . HA 1 1 20 1 2 1 1 2 THR H . 2 . HN 1 1 21 1 1 1 1 2 THR HA . 2 . HA 1 1 21 1 2 1 1 47 CYS H . 47 . HN 1 1 22 1 1 1 1 44 THR HA . 44 . HA 1 1 22 1 2 1 1 45 LYS H . 45 . HN 1 1 23 1 1 1 1 3 CYS H . 3 . HN 1 1 23 1 2 1 1 45 LYS H . 45 . HN 1 1 24 1 1 1 1 43 CYS HA . 43 . HA 1 1 24 1 2 1 1 44 THR H . 44 . HN 1 1 25 1 1 1 1 43 CYS HB3 . 43 . HB1 1 1 25 1 2 1 1 44 THR H . 44 . HN 1 1 26 1 1 1 1 43 CYS HB2 . 43 . HB2 1 1 26 1 2 1 1 44 THR H . 44 . HN 1 1 27 1 1 1 1 18 GLY H . 18 . HN 1 1 27 1 2 1 1 19 SER H . 19 . HN 1 1 28 1 1 1 1 28 GLU H . 28 . HN 1 1 28 1 2 1 1 29 HIS H . 29 . HN 1 1 29 1 1 1 1 29 HIS HB2 . 29 . HB2 1 1 29 1 2 1 1 30 LEU H . 30 . HN 1 1 30 1 1 1 1 29 HIS HB3 . 29 . HB1 1 1 30 1 2 1 1 30 LEU H . 30 . HN 1 1 31 1 1 1 1 29 HIS H . 29 . HN 1 1 31 1 2 1 1 30 LEU H . 30 . HN 1 1 32 1 1 1 1 27 LYS H . 27 . HN 1 1 32 1 2 1 1 28 GLU H . 28 . HN 1 1 33 1 1 1 1 26 ASN H . 26 . HN 1 1 33 1 2 1 1 27 LYS H . 27 . HN 1 1 34 1 1 1 1 26 ASN HB2 . 26 . HB2 1 1 34 1 2 1 1 27 LYS H . 27 . HN 1 1 35 1 1 1 1 26 ASN HB3 . 26 . HB1 1 1 35 1 2 1 1 27 LYS H . 27 . HN 1 1 36 1 1 1 1 25 LYS H . 25 . HN 1 1 36 1 2 1 1 26 ASN H . 26 . HN 1 1 37 1 1 1 1 1 LYS HG2 . 1 . HG2 1 1 37 1 2 1 1 2 THR H . 2 . HN 1 1 38 1 1 1 1 1 LYS HG3 . 1 . HG1 1 1 38 1 2 1 1 2 THR H . 2 . HN 1 1 39 1 1 1 1 1 LYS HB2 . 1 . HB2 1 1 39 1 2 1 1 2 THR H . 2 . HN 1 1 40 1 1 1 1 1 LYS HB3 . 1 . HB1 1 1 40 1 2 1 1 2 THR H . 2 . HN 1 1 41 1 1 1 1 2 THR HA . 2 . HA 1 1 41 1 2 1 1 2 THR MG . 2 . HG2# 1 1 42 1 1 1 1 2 THR H . 2 . HN 1 1 42 1 2 1 1 2 THR MG . 2 . HG2# 1 1 43 1 1 1 1 2 THR H . 2 . HN 1 1 43 1 2 1 1 2 THR HB . 2 . HB 1 1 44 1 1 1 1 2 THR MG . 2 . HG2# 1 1 44 1 2 1 1 47 CYS H . 47 . HN 1 1 45 1 1 1 1 47 CYS H . 47 . HN 1 1 45 1 2 1 1 47 CYS HB3 . 47 . HB1 1 1 46 1 1 1 1 47 CYS H . 47 . HN 1 1 46 1 2 1 1 47 CYS HB2 . 47 . HB2 1 1 47 1 1 1 1 36 ARG HA . 36 . HA 1 1 47 1 2 1 1 37 ASP H . 37 . HN 1 1 48 1 1 1 1 46 ASN HA . 46 . HA 1 1 48 1 2 1 1 47 CYS H . 47 . HN 1 1 49 1 1 1 1 3 CYS H . 3 . HN 1 1 49 1 2 1 1 47 CYS H . 47 . HN 1 1 50 1 1 1 1 6 LEU HA . 6 . HA 1 1 50 1 2 1 1 7 ALA HA . 7 . HA 1 1 51 1 1 1 1 7 ALA H . 7 . HN 1 1 51 1 2 1 1 7 ALA MB . 7 . HB# 1 1 52 1 1 1 1 6 LEU HB3 . 6 . HB1 1 1 52 1 2 1 1 7 ALA H . 7 . HN 1 1 53 1 1 1 1 26 ASN H . 26 . HN 1 1 53 1 2 1 1 26 ASN HB3 . 26 . HB1 1 1 54 1 1 1 1 6 LEU HA . 6 . HA 1 1 54 1 2 1 1 7 ALA H . 7 . HN 1 1 55 1 1 1 1 7 ALA H . 7 . HN 1 1 55 1 2 1 1 42 TRP HA . 42 . HA 1 1 56 1 1 1 1 6 LEU HA . 6 . HA 1 1 56 1 2 1 1 6 LEU MD1 . 6 . HD1# 1 1 57 1 1 1 1 6 LEU HA . 6 . HA 1 1 57 1 2 1 1 6 LEU HG . 6 . HG 1 1 58 1 1 1 1 6 LEU HA . 6 . HA 1 1 58 1 2 1 1 6 LEU MD2 . 6 . HD2# 1 1 59 1 1 1 1 6 LEU HB2 . 6 . HB2 1 1 59 1 2 1 1 6 LEU MD2 . 6 . HD2# 1 1 60 1 1 1 1 6 LEU HB2 . 6 . HB2 1 1 60 1 2 1 1 6 LEU MD1 . 6 . HD1# 1 1 61 1 1 1 1 6 LEU HB3 . 6 . HB1 1 1 61 1 2 1 1 6 LEU MD1 . 6 . HD1# 1 1 62 1 1 1 1 6 LEU HB3 . 6 . HB1 1 1 62 1 2 1 1 6 LEU MD2 . 6 . HD2# 1 1 63 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 63 1 2 1 1 40 ARG HB2 . 40 . HB2 1 1 64 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 64 1 2 1 1 40 ARG HG2 . 40 . HG2 1 1 65 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 65 1 2 1 1 40 ARG HG3 . 40 . HG1 1 1 66 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 66 1 2 1 1 40 ARG HB3 . 40 . HB1 1 1 67 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 67 1 2 1 1 7 ALA MB . 7 . HB# 1 1 68 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 68 1 2 1 1 40 ARG HB2 . 40 . HB2 1 1 69 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 69 1 2 1 1 40 ARG HG2 . 40 . HG2 1 1 70 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 70 1 2 1 1 40 ARG HG3 . 40 . HG1 1 1 71 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 71 1 2 1 1 40 ARG HB3 . 40 . HB1 1 1 72 1 1 1 1 6 LEU HG . 6 . HG 1 1 72 1 2 1 1 7 ALA H . 7 . HN 1 1 73 1 1 1 1 6 LEU H . 6 . HN 1 1 73 1 2 1 1 6 LEU HG . 6 . HG 1 1 74 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 74 1 2 1 1 7 ALA H . 7 . HN 1 1 75 1 1 1 1 6 LEU H . 6 . HN 1 1 75 1 2 1 1 6 LEU MD1 . 6 . HD1# 1 1 76 1 1 1 1 6 LEU H . 6 . HN 1 1 76 1 2 1 1 6 LEU HB3 . 6 . HB1 1 1 77 1 1 1 1 6 LEU H . 6 . HN 1 1 77 1 2 1 1 6 LEU HB2 . 6 . HB2 1 1 78 1 1 1 1 30 LEU MD2 . 30 . HD2# 1 1 78 1 2 1 1 31 ARG H . 31 . HN 1 1 79 1 1 1 1 30 LEU MD1 . 30 . HD1# 1 1 79 1 2 1 1 31 ARG H . 31 . HN 1 1 80 1 1 1 1 22 ASP H . 22 . HN 1 1 80 1 2 1 1 22 ASP HB2 . 22 . HB2 1 1 81 1 1 1 1 22 ASP H . 22 . HN 1 1 81 1 2 1 1 22 ASP HB3 . 22 . HB1 1 1 82 1 1 1 1 6 LEU H . 6 . HN 1 1 82 1 2 1 1 7 ALA H . 7 . HN 1 1 83 1 1 1 1 9 THR MG . 9 . HG2# 1 1 83 1 2 1 1 10 TYR H . 10 . HN 1 1 84 1 1 1 1 10 TYR H . 10 . HN 1 1 84 1 2 1 1 10 TYR HB3 . 10 . HB1 1 1 85 1 1 1 1 10 TYR H . 10 . HN 1 1 85 1 2 1 1 10 TYR HB2 . 10 . HB2 1 1 86 1 1 1 1 8 ASP HA . 8 . HA 1 1 86 1 2 1 1 10 TYR H . 10 . HN 1 1 87 1 1 1 1 10 TYR H . 10 . HN 1 1 87 1 2 1 1 10 TYR QD . 10 . HD# 1 1 88 1 1 1 1 10 TYR H . 10 . HN 1 1 88 1 2 1 1 11 LYS H . 11 . HN 1 1 89 1 1 1 1 10 TYR QD . 10 . HD# 1 1 89 1 2 1 1 11 LYS H . 11 . HN 1 1 90 1 1 1 1 9 THR H . 9 . HN 1 1 90 1 2 1 1 10 TYR H . 10 . HN 1 1 91 1 1 1 1 10 TYR QD . 10 . HD# 1 1 91 1 2 1 1 23 HIS HE1 . 23 . HE1 1 1 92 1 1 1 1 10 TYR QE . 10 . HE# 1 1 92 1 2 1 1 41 CYS HB3 . 41 . HB1 1 1 93 1 1 1 1 10 TYR QD . 10 . HD# 1 1 93 1 2 1 1 41 CYS HB2 . 41 . HB2 1 1 94 1 1 1 1 10 TYR QE . 10 . HE# 1 1 94 1 2 1 1 14 CYS HB2 . 14 . HB2 1 1 95 1 1 1 1 10 TYR QD . 10 . HD# 1 1 95 1 2 1 1 14 CYS HB2 . 14 . HB2 1 1 96 1 1 1 1 10 TYR QE . 10 . HE# 1 1 96 1 2 1 1 20 CYS HB3 . 20 . HB1 1 1 97 1 1 1 1 10 TYR QE . 10 . HE# 1 1 97 1 2 1 1 14 CYS HB3 . 14 . HB1 1 1 98 1 1 1 1 10 TYR QE . 10 . HE# 1 1 98 1 2 1 1 20 CYS HB2 . 20 . HB2 1 1 99 1 1 1 1 10 TYR QD . 10 . HD# 1 1 99 1 2 1 1 23 HIS HB2 . 23 . HB2 1 1 100 1 1 1 1 10 TYR HA . 10 . HA 1 1 100 1 2 1 1 10 TYR QD . 10 . HD# 1 1 101 1 1 1 1 10 TYR QD . 10 . HD# 1 1 101 1 2 1 1 23 HIS HB3 . 23 . HB1 1 1 102 1 1 1 1 10 TYR QE . 10 . HE# 1 1 102 1 2 1 1 23 HIS HB2 . 23 . HB2 1 1 103 1 1 1 1 10 TYR QE . 10 . HE# 1 1 103 1 2 1 1 23 HIS HB3 . 23 . HB1 1 1 104 1 1 1 1 25 LYS HA . 25 . HA 1 1 104 1 2 1 1 29 HIS H . 29 . HN 1 1 105 1 1 1 1 10 TYR QD . 10 . HD# 1 1 105 1 2 1 1 20 CYS HA . 20 . HA 1 1 106 1 1 1 1 10 TYR QE . 10 . HE# 1 1 106 1 2 1 1 20 CYS HA . 20 . HA 1 1 107 1 1 1 1 9 THR HA . 9 . HA 1 1 107 1 2 1 1 9 THR MG . 9 . HG2# 1 1 108 1 1 1 1 19 SER HA . 19 . HA 1 1 108 1 2 1 1 22 ASP HB2 . 22 . HB2 1 1 109 1 1 1 1 9 THR H . 9 . HN 1 1 109 1 2 1 1 9 THR MG . 9 . HG2# 1 1 110 1 1 1 1 7 ALA MB . 7 . HB# 1 1 110 1 2 1 1 9 THR H . 9 . HN 1 1 111 1 1 1 1 8 ASP HB2 . 8 . HB2 1 1 111 1 2 1 1 9 THR H . 9 . HN 1 1 112 1 1 1 1 8 ASP HB3 . 8 . HB1 1 1 112 1 2 1 1 9 THR H . 9 . HN 1 1 113 1 1 1 1 10 TYR HA . 10 . HA 1 1 113 1 2 1 1 23 HIS HE1 . 23 . HE1 1 1 114 1 1 1 1 9 THR H . 9 . HN 1 1 114 1 2 1 1 9 THR HB . 9 . HB 1 1 115 1 1 1 1 8 ASP H . 8 . HN 1 1 115 1 2 1 1 9 THR H . 9 . HN 1 1 116 1 1 1 1 7 ALA HA . 7 . HA 1 1 116 1 2 1 1 8 ASP H . 8 . HN 1 1 117 1 1 1 1 7 ALA MB . 7 . HB# 1 1 117 1 2 1 1 8 ASP H . 8 . HN 1 1 118 1 1 1 1 4 GLU HG2 . 4 . HG2 1 1 118 1 2 1 1 5 ASN H . 5 . HN 1 1 119 1 1 1 1 4 GLU HG3 . 4 . HG1 1 1 119 1 2 1 1 5 ASN H . 5 . HN 1 1 120 1 1 1 1 5 ASN H . 5 . HN 1 1 120 1 2 1 1 42 TRP HB3 . 42 . HB1 1 1 121 1 1 1 1 4 GLU HA . 4 . HA 1 1 121 1 2 1 1 5 ASN H . 5 . HN 1 1 122 1 1 1 1 5 ASN H . 5 . HN 1 1 122 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 123 1 1 1 1 4 GLU H . 4 . HN 1 1 123 1 2 1 1 5 ASN H . 5 . HN 1 1 124 1 1 1 1 11 LYS H . 11 . HN 1 1 124 1 2 1 1 11 LYS HE2 . 11 . HE2 1 1 125 1 1 1 1 11 LYS H . 11 . HN 1 1 125 1 2 1 1 11 LYS HE3 . 11 . HE1 1 1 126 1 1 1 1 11 LYS H . 11 . HN 1 1 126 1 2 1 1 23 HIS HE1 . 23 . HE1 1 1 127 1 1 1 1 29 HIS H . 29 . HN 1 1 127 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 128 1 1 1 1 29 HIS H . 29 . HN 1 1 128 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 129 1 1 1 1 29 HIS H . 29 . HN 1 1 129 1 2 1 1 30 LEU HG . 30 . HG 1 1 130 1 1 1 1 28 GLU HB3 . 28 . HB1 1 1 130 1 2 1 1 29 HIS H . 29 . HN 1 1 131 1 1 1 1 28 GLU HB2 . 28 . HB2 1 1 131 1 2 1 1 29 HIS H . 29 . HN 1 1 132 1 1 1 1 24 CYS HA . 24 . HA 1 1 132 1 2 1 1 29 HIS H . 29 . HN 1 1 133 1 1 1 1 29 HIS H . 29 . HN 1 1 133 1 2 1 1 29 HIS HA . 29 . HA 1 1 134 1 1 1 1 27 LYS H . 27 . HN 1 1 134 1 2 1 1 29 HIS H . 29 . HN 1 1 135 1 1 1 1 29 HIS HA . 29 . HA 1 1 135 1 2 1 1 29 HIS HD2 . 29 . HD2 1 1 136 1 1 1 1 39 PHE H . 39 . HN 1 1 136 1 2 1 1 39 PHE QD . 39 . HD# 1 1 137 1 1 1 1 28 GLU HA . 28 . HA 1 1 137 1 2 1 1 28 GLU HG3 . 28 . HG1 1 1 138 1 1 1 1 24 CYS HA . 24 . HA 1 1 138 1 2 1 1 28 GLU HB3 . 28 . HB1 1 1 139 1 1 1 1 24 CYS HA . 24 . HA 1 1 139 1 2 1 1 28 GLU HG3 . 28 . HG1 1 1 140 1 1 1 1 24 CYS HA . 24 . HA 1 1 140 1 2 1 1 28 GLU HB2 . 28 . HB2 1 1 141 1 1 1 1 27 LYS HB2 . 27 . HB2 1 1 141 1 2 1 1 28 GLU H . 28 . HN 1 1 142 1 1 1 1 27 LYS HB3 . 27 . HB1 1 1 142 1 2 1 1 28 GLU H . 28 . HN 1 1 143 1 1 1 1 28 GLU H . 28 . HN 1 1 143 1 2 1 1 28 GLU HB3 . 28 . HB1 1 1 144 1 1 1 1 28 GLU H . 28 . HN 1 1 144 1 2 1 1 28 GLU HB2 . 28 . HB2 1 1 145 1 1 1 1 24 CYS HA . 24 . HA 1 1 145 1 2 1 1 28 GLU H . 28 . HN 1 1 146 1 1 1 1 23 HIS HA . 23 . HA 1 1 146 1 2 1 1 28 GLU H . 28 . HN 1 1 147 1 1 1 1 26 ASN HA . 26 . HA 1 1 147 1 2 1 1 28 GLU H . 28 . HN 1 1 148 1 1 1 1 28 GLU H . 28 . HN 1 1 148 1 2 1 1 29 HIS HA . 29 . HA 1 1 149 1 1 1 1 27 LYS HA . 27 . HA 1 1 149 1 2 1 1 27 LYS HD2 . 27 . HD2 1 1 150 1 1 1 1 27 LYS HA . 27 . HA 1 1 150 1 2 1 1 27 LYS HD3 . 27 . HD1 1 1 151 1 1 1 1 27 LYS H . 27 . HN 1 1 151 1 2 1 1 27 LYS HB2 . 27 . HB2 1 1 152 1 1 1 1 27 LYS H . 27 . HN 1 1 152 1 2 1 1 27 LYS HB3 . 27 . HB1 1 1 153 1 1 1 1 27 LYS H . 27 . HN 1 1 153 1 2 1 1 27 LYS HG2 . 27 . HG2 1 1 154 1 1 1 1 27 LYS H . 27 . HN 1 1 154 1 2 1 1 27 LYS HG3 . 27 . HG1 1 1 155 1 1 1 1 23 HIS HA . 23 . HA 1 1 155 1 2 1 1 27 LYS H . 27 . HN 1 1 156 1 1 1 1 24 CYS HA . 24 . HA 1 1 156 1 2 1 1 27 LYS H . 27 . HN 1 1 157 1 1 1 1 26 ASN H . 26 . HN 1 1 157 1 2 1 1 26 ASN HB2 . 26 . HB2 1 1 158 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 158 1 2 1 1 7 ALA H . 7 . HN 1 1 159 1 1 1 1 6 LEU H . 6 . HN 1 1 159 1 2 1 1 6 LEU MD2 . 6 . HD2# 1 1 160 1 1 1 1 30 LEU HB2 . 30 . HB2 1 1 160 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 161 1 1 1 1 30 LEU HA . 30 . HA 1 1 161 1 2 1 1 30 LEU HG . 30 . HG 1 1 162 1 1 1 1 30 LEU HA . 30 . HA 1 1 162 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 163 1 1 1 1 30 LEU H . 30 . HN 1 1 163 1 2 1 1 30 LEU HB3 . 30 . HB1 1 1 164 1 1 1 1 30 LEU H . 30 . HN 1 1 164 1 2 1 1 30 LEU HG . 30 . HG 1 1 165 1 1 1 1 30 LEU H . 30 . HN 1 1 165 1 2 1 1 30 LEU HB2 . 30 . HB2 1 1 166 1 1 1 1 28 GLU HB3 . 28 . HB1 1 1 166 1 2 1 1 30 LEU H . 30 . HN 1 1 167 1 1 1 1 28 GLU HB2 . 28 . HB2 1 1 167 1 2 1 1 30 LEU H . 30 . HN 1 1 168 1 1 1 1 24 CYS HA . 24 . HA 1 1 168 1 2 1 1 30 LEU H . 30 . HN 1 1 169 1 1 1 1 25 LYS HA . 25 . HA 1 1 169 1 2 1 1 30 LEU H . 30 . HN 1 1 170 1 1 1 1 29 HIS HA . 29 . HA 1 1 170 1 2 1 1 30 LEU H . 30 . HN 1 1 171 1 1 1 1 31 ARG HA . 31 . HA 1 1 171 1 2 1 1 31 ARG HG2 . 31 . HG2 1 1 172 1 1 1 1 31 ARG HA . 31 . HA 1 1 172 1 2 1 1 31 ARG HG3 . 31 . HG1 1 1 173 1 1 1 1 30 LEU HB3 . 30 . HB1 1 1 173 1 2 1 1 31 ARG H . 31 . HN 1 1 174 1 1 1 1 30 LEU HB2 . 30 . HB2 1 1 174 1 2 1 1 31 ARG H . 31 . HN 1 1 175 1 1 1 1 31 ARG H . 31 . HN 1 1 175 1 2 1 1 31 ARG HB2 . 31 . HB2 1 1 176 1 1 1 1 31 ARG H . 31 . HN 1 1 176 1 2 1 1 31 ARG HB3 . 31 . HB1 1 1 177 1 1 1 1 31 ARG HE . 31 . HE 1 1 177 1 2 1 1 31 ARG HG2 . 31 . HG2 1 1 178 1 1 1 1 31 ARG HE . 31 . HE 1 1 178 1 2 1 1 44 THR MG . 44 . HG2# 1 1 179 1 1 1 1 31 ARG HE . 31 . HE 1 1 179 1 2 1 1 31 ARG HG3 . 31 . HG1 1 1 180 1 1 1 1 31 ARG H . 31 . HN 1 1 180 1 2 1 1 31 ARG HD2 . 31 . HD2 1 1 181 1 1 1 1 30 LEU HA . 30 . HA 1 1 181 1 2 1 1 31 ARG H . 31 . HN 1 1 182 1 1 1 1 30 LEU H . 30 . HN 1 1 182 1 2 1 1 31 ARG H . 31 . HN 1 1 183 1 1 1 1 35 CYS H . 35 . HN 1 1 183 1 2 1 1 42 TRP H . 42 . HN 1 1 184 1 1 1 1 31 ARG H . 31 . HN 1 1 184 1 2 1 1 46 ASN H . 46 . HN 1 1 185 1 1 1 1 31 ARG H . 31 . HN 1 1 185 1 2 1 1 44 THR H . 44 . HN 1 1 186 1 1 1 1 31 ARG H . 31 . HN 1 1 186 1 2 1 1 32 SER H . 32 . HN 1 1 187 1 1 1 1 32 SER H . 32 . HN 1 1 187 1 2 1 1 44 THR MG . 44 . HG2# 1 1 188 1 1 1 1 30 LEU HB3 . 30 . HB1 1 1 188 1 2 1 1 32 SER H . 32 . HN 1 1 189 1 1 1 1 30 LEU HB2 . 30 . HB2 1 1 189 1 2 1 1 32 SER H . 32 . HN 1 1 190 1 1 1 1 31 ARG HB2 . 31 . HB2 1 1 190 1 2 1 1 32 SER H . 32 . HN 1 1 191 1 1 1 1 31 ARG HB3 . 31 . HB1 1 1 191 1 2 1 1 32 SER H . 32 . HN 1 1 192 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 192 1 2 1 1 32 SER H . 32 . HN 1 1 193 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 193 1 2 1 1 32 SER H . 32 . HN 1 1 194 1 1 1 1 32 SER H . 32 . HN 1 1 194 1 2 1 1 44 THR HB . 44 . HB 1 1 195 1 1 1 1 32 SER H . 32 . HN 1 1 195 1 2 1 1 43 CYS HA . 43 . HA 1 1 196 1 1 1 1 32 SER H . 32 . HN 1 1 196 1 2 1 1 44 THR H . 44 . HN 1 1 197 1 1 1 1 21 ASP HB2 . 21 . HB2 1 1 197 1 2 1 1 33 GLY H . 33 . HN 1 1 198 1 1 1 1 21 ASP HB3 . 21 . HB1 1 1 198 1 2 1 1 33 GLY H . 33 . HN 1 1 199 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 199 1 2 1 1 33 GLY H . 33 . HN 1 1 200 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 200 1 2 1 1 33 GLY H . 33 . HN 1 1 201 1 1 1 1 21 ASP H . 21 . HN 1 1 201 1 2 1 1 33 GLY H . 33 . HN 1 1 202 1 1 1 1 34 ARG H . 34 . HN 1 1 202 1 2 1 1 43 CYS HA . 43 . HA 1 1 203 1 1 1 1 34 ARG H . 34 . HN 1 1 203 1 2 1 1 35 CYS H . 35 . HN 1 1 204 1 1 1 1 34 ARG H . 34 . HN 1 1 204 1 2 1 1 42 TRP H . 42 . HN 1 1 205 1 1 1 1 46 ASN H . 46 . HN 1 1 205 1 2 1 1 47 CYS H . 47 . HN 1 1 206 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 206 1 2 1 1 43 CYS HA . 43 . HA 1 1 207 1 1 1 1 30 LEU MD1 . 30 . HD1# 1 1 207 1 2 1 1 43 CYS HA . 43 . HA 1 1 208 1 1 1 1 7 ALA MB . 7 . HB# 1 1 208 1 2 1 1 43 CYS H . 43 . HN 1 1 209 1 1 1 1 42 TRP HB3 . 42 . HB1 1 1 209 1 2 1 1 43 CYS H . 43 . HN 1 1 210 1 1 1 1 6 LEU HA . 6 . HA 1 1 210 1 2 1 1 43 CYS H . 43 . HN 1 1 211 1 1 1 1 42 TRP HA . 42 . HA 1 1 211 1 2 1 1 43 CYS H . 43 . HN 1 1 212 1 1 1 1 5 ASN H . 5 . HN 1 1 212 1 2 1 1 43 CYS H . 43 . HN 1 1 213 1 1 1 1 42 TRP H . 42 . HN 1 1 213 1 2 1 1 43 CYS H . 43 . HN 1 1 214 1 1 1 1 7 ALA H . 7 . HN 1 1 214 1 2 1 1 43 CYS H . 43 . HN 1 1 215 1 1 1 1 6 LEU HA . 6 . HA 1 1 215 1 2 1 1 42 TRP HA . 42 . HA 1 1 216 1 1 1 1 2 THR MG . 2 . HG2# 1 1 216 1 2 1 1 46 ASN H . 46 . HN 1 1 217 1 1 1 1 30 LEU MD2 . 30 . HD2# 1 1 217 1 2 1 1 46 ASN H . 46 . HN 1 1 218 1 1 1 1 45 LYS HB2 . 45 . HB2 1 1 218 1 2 1 1 46 ASN H . 46 . HN 1 1 219 1 1 1 1 45 LYS HB3 . 45 . HB1 1 1 219 1 2 1 1 46 ASN H . 46 . HN 1 1 220 1 1 1 1 41 CYS HB3 . 41 . HB1 1 1 220 1 2 1 1 42 TRP H . 42 . HN 1 1 221 1 1 1 1 42 TRP H . 42 . HN 1 1 221 1 2 1 1 42 TRP HB2 . 42 . HB2 1 1 222 1 1 1 1 41 CYS HA . 41 . HA 1 1 222 1 2 1 1 42 TRP H . 42 . HN 1 1 223 1 1 1 1 45 LYS HA . 45 . HA 1 1 223 1 2 1 1 46 ASN H . 46 . HN 1 1 224 1 1 1 1 35 CYS HA . 35 . HA 1 1 224 1 2 1 1 42 TRP H . 42 . HN 1 1 225 1 1 1 1 44 THR HA . 44 . HA 1 1 225 1 2 1 1 44 THR MG . 44 . HG2# 1 1 226 1 1 1 1 44 THR H . 44 . HN 1 1 226 1 2 1 1 44 THR MG . 44 . HG2# 1 1 227 1 1 1 1 44 THR H . 44 . HN 1 1 227 1 2 1 1 44 THR HB . 44 . HB 1 1 228 1 1 1 1 44 THR MG . 44 . HG2# 1 1 228 1 2 1 1 45 LYS H . 45 . HN 1 1 229 1 1 1 1 45 LYS H . 45 . HN 1 1 229 1 2 1 1 45 LYS HD2 . 45 . HD2 1 1 230 1 1 1 1 45 LYS H . 45 . HN 1 1 230 1 2 1 1 45 LYS HD3 . 45 . HD1 1 1 231 1 1 1 1 16 THR HB . 16 . HB 1 1 231 1 2 1 1 19 SER H . 19 . HN 1 1 232 1 1 1 1 19 SER H . 19 . HN 1 1 232 1 2 1 1 19 SER HB2 . 19 . HB2 1 1 233 1 1 1 1 19 SER H . 19 . HN 1 1 233 1 2 1 1 19 SER HB3 . 19 . HB1 1 1 234 1 1 1 1 19 SER H . 19 . HN 1 1 234 1 2 1 1 20 CYS H . 20 . HN 1 1 235 1 1 1 1 17 THR MG . 17 . HG2# 1 1 235 1 2 1 1 18 GLY H . 18 . HN 1 1 236 1 1 1 1 16 THR MG . 16 . HG2# 1 1 236 1 2 1 1 18 GLY H . 18 . HN 1 1 237 1 1 1 1 18 GLY H . 18 . HN 1 1 237 1 2 1 1 21 ASP HB3 . 21 . HB1 1 1 238 1 1 1 1 16 THR HB . 16 . HB 1 1 238 1 2 1 1 18 GLY H . 18 . HN 1 1 239 1 1 1 1 17 THR HB . 17 . HB 1 1 239 1 2 1 1 18 GLY H . 18 . HN 1 1 240 1 1 1 1 16 THR MG . 16 . HG2# 1 1 240 1 2 1 1 17 THR HA . 17 . HA 1 1 241 1 1 1 1 16 THR MG . 16 . HG2# 1 1 241 1 2 1 1 17 THR HB . 17 . HB 1 1 242 1 1 1 1 17 THR HA . 17 . HA 1 1 242 1 2 1 1 18 GLY HA2 . 18 . HA2 1 1 243 1 1 1 1 16 THR HB . 16 . HB 1 1 243 1 2 1 1 17 THR H . 17 . HN 1 1 244 1 1 1 1 17 THR H . 17 . HN 1 1 244 1 2 1 1 17 THR HB . 17 . HB 1 1 245 1 1 1 1 16 THR HA . 16 . HA 1 1 245 1 2 1 1 17 THR H . 17 . HN 1 1 246 1 1 1 1 17 THR H . 17 . HN 1 1 246 1 2 1 1 17 THR MG . 17 . HG2# 1 1 247 1 1 1 1 16 THR MG . 16 . HG2# 1 1 247 1 2 1 1 17 THR H . 17 . HN 1 1 248 1 1 1 1 17 THR H . 17 . HN 1 1 248 1 2 1 1 18 GLY H . 18 . HN 1 1 249 1 1 1 1 16 THR H . 16 . HN 1 1 249 1 2 1 1 17 THR H . 17 . HN 1 1 250 1 1 1 1 16 THR H . 16 . HN 1 1 250 1 2 1 1 16 THR MG . 16 . HG2# 1 1 251 1 1 1 1 16 THR H . 16 . HN 1 1 251 1 2 1 1 16 THR HB . 16 . HB 1 1 252 1 1 1 1 15 PHE HB2 . 15 . HB2 1 1 252 1 2 1 1 16 THR H . 16 . HN 1 1 253 1 1 1 1 15 PHE HB3 . 15 . HB1 1 1 253 1 2 1 1 16 THR H . 16 . HN 1 1 254 1 1 1 1 15 PHE H . 15 . HN 1 1 254 1 2 1 1 16 THR H . 16 . HN 1 1 255 1 1 1 1 15 PHE H . 15 . HN 1 1 255 1 2 1 1 15 PHE HB3 . 15 . HB1 1 1 256 1 1 1 1 15 PHE H . 15 . HN 1 1 256 1 2 1 1 15 PHE HB2 . 15 . HB2 1 1 257 1 1 1 1 15 PHE H . 15 . HN 1 1 257 1 2 1 1 15 PHE QD . 15 . HD# 1 1 258 1 1 1 1 10 TYR QE . 10 . HE# 1 1 258 1 2 1 1 15 PHE H . 15 . HN 1 1 259 1 1 1 1 15 PHE HA . 15 . HA 1 1 259 1 2 1 1 15 PHE QD . 15 . HD# 1 1 260 1 1 1 1 39 PHE HA . 39 . HA 1 1 260 1 2 1 1 39 PHE QD . 39 . HD# 1 1 261 1 1 1 1 13 PRO HB2 . 13 . HB2 1 1 261 1 2 1 1 15 PHE QD . 15 . HD# 1 1 262 1 1 1 1 23 HIS HA . 23 . HA 1 1 262 1 2 1 1 23 HIS HD2 . 23 . HD2 1 1 263 1 1 1 1 22 ASP HB2 . 22 . HB2 1 1 263 1 2 1 1 23 HIS H . 23 . HN 1 1 264 1 1 1 1 22 ASP HB3 . 22 . HB1 1 1 264 1 2 1 1 23 HIS H . 23 . HN 1 1 265 1 1 1 1 22 ASP H . 22 . HN 1 1 265 1 2 1 1 23 HIS H . 23 . HN 1 1 266 1 1 1 1 6 LEU H . 6 . HN 1 1 266 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 267 1 1 1 1 20 CYS H . 20 . HN 1 1 267 1 2 1 1 22 ASP H . 22 . HN 1 1 268 1 1 1 1 14 CYS H . 14 . HN 1 1 268 1 2 1 1 39 PHE QD . 39 . HD# 1 1 269 1 1 1 1 5 ASN HA . 5 . HA 1 1 269 1 2 1 1 6 LEU HB2 . 6 . HB2 1 1 270 1 1 1 1 5 ASN HA . 5 . HA 1 1 270 1 2 1 1 6 LEU H . 6 . HN 1 1 271 1 1 1 1 4 GLU HA . 4 . HA 1 1 271 1 2 1 1 44 THR HA . 44 . HA 1 1 272 1 1 1 1 4 GLU HA . 4 . HA 1 1 272 1 2 1 1 4 GLU HG2 . 4 . HG2 1 1 273 1 1 1 1 4 GLU HA . 4 . HA 1 1 273 1 2 1 1 4 GLU HG3 . 4 . HG1 1 1 274 1 1 1 1 4 GLU HA . 4 . HA 1 1 274 1 2 1 1 44 THR MG . 44 . HG2# 1 1 275 1 1 1 1 4 GLU H . 4 . HN 1 1 275 1 2 1 1 44 THR MG . 44 . HG2# 1 1 276 1 1 1 1 4 GLU H . 4 . HN 1 1 276 1 2 1 1 4 GLU HB3 . 4 . HB1 1 1 277 1 1 1 1 4 GLU H . 4 . HN 1 1 277 1 2 1 1 4 GLU HB2 . 4 . HB2 1 1 278 1 1 1 1 3 CYS HA . 3 . HA 1 1 278 1 2 1 1 4 GLU H . 4 . HN 1 1 279 1 1 1 1 3 CYS H . 3 . HN 1 1 279 1 2 1 1 4 GLU H . 4 . HN 1 1 280 1 1 1 1 2 THR H . 2 . HN 1 1 280 1 2 1 1 3 CYS H . 3 . HN 1 1 281 1 1 1 1 21 ASP H . 21 . HN 1 1 281 1 2 1 1 22 ASP H . 22 . HN 1 1 282 1 1 1 1 2 THR HA . 2 . HA 1 1 282 1 2 1 1 3 CYS H . 3 . HN 1 1 283 1 1 1 1 2 THR HB . 2 . HB 1 1 283 1 2 1 1 3 CYS H . 3 . HN 1 1 284 1 1 1 1 17 THR HA . 17 . HA 1 1 284 1 2 1 1 21 ASP H . 21 . HN 1 1 285 1 1 1 1 3 CYS H . 3 . HN 1 1 285 1 2 1 1 45 LYS HG3 . 45 . HG1 1 1 286 1 1 1 1 2 THR MG . 2 . HG2# 1 1 286 1 2 1 1 3 CYS H . 3 . HN 1 1 287 1 1 1 1 20 CYS HA . 20 . HA 1 1 287 1 2 1 1 23 HIS HB2 . 23 . HB2 1 1 288 1 1 1 1 20 CYS HA . 20 . HA 1 1 288 1 2 1 1 23 HIS HB3 . 23 . HB1 1 1 289 1 1 1 1 20 CYS H . 20 . HN 1 1 289 1 2 1 1 20 CYS HB2 . 20 . HB2 1 1 290 1 1 1 1 42 TRP HB2 . 42 . HB2 1 1 290 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 291 1 1 1 1 20 CYS H . 20 . HN 1 1 291 1 2 1 1 21 ASP HB3 . 21 . HB1 1 1 292 1 1 1 1 20 CYS H . 20 . HN 1 1 292 1 2 1 1 20 CYS HB3 . 20 . HB1 1 1 293 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 293 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 294 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 294 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 295 1 1 1 1 36 ARG HG3 . 36 . HG1 1 1 295 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 296 1 1 1 1 36 ARG HG2 . 36 . HG2 1 1 296 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 297 1 1 1 1 40 ARG HG2 . 40 . HG2 1 1 297 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 298 1 1 1 1 40 ARG HG3 . 40 . HG1 1 1 298 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 299 1 1 1 1 36 ARG HB2 . 36 . HB2 1 1 299 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 300 1 1 1 1 36 ARG HB3 . 36 . HB1 1 1 300 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 301 1 1 1 1 19 SER HB2 . 19 . HB2 1 1 301 1 2 1 1 20 CYS H . 20 . HN 1 1 302 1 1 1 1 19 SER HB3 . 19 . HB1 1 1 302 1 2 1 1 20 CYS H . 20 . HN 1 1 303 1 1 1 1 42 TRP HA . 42 . HA 1 1 303 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 304 1 1 1 1 35 CYS HA . 35 . HA 1 1 304 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 305 1 1 1 1 20 CYS H . 20 . HN 1 1 305 1 2 1 1 21 ASP H . 21 . HN 1 1 306 1 1 1 1 42 TRP H . 42 . HN 1 1 306 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 307 1 1 1 1 36 ARG H . 36 . HN 1 1 307 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 308 1 1 1 1 19 SER HA . 19 . HA 1 1 308 1 2 1 1 21 ASP H . 21 . HN 1 1 309 1 1 1 1 21 ASP H . 21 . HN 1 1 309 1 2 1 1 22 ASP HB2 . 22 . HB2 1 1 310 1 1 1 1 21 ASP H . 21 . HN 1 1 310 1 2 1 1 21 ASP HB2 . 21 . HB2 1 1 311 1 1 1 1 19 SER HA . 19 . HA 1 1 311 1 2 1 1 23 HIS H . 23 . HN 1 1 312 1 1 1 1 20 CYS HA . 20 . HA 1 1 312 1 2 1 1 23 HIS H . 23 . HN 1 1 313 1 1 1 1 21 ASP HA . 21 . HA 1 1 313 1 2 1 1 24 CYS H . 24 . HN 1 1 314 1 1 1 1 20 CYS HA . 20 . HA 1 1 314 1 2 1 1 24 CYS H . 24 . HN 1 1 315 1 1 1 1 23 HIS HD2 . 23 . HD2 1 1 315 1 2 1 1 24 CYS H . 24 . HN 1 1 316 1 1 1 1 22 ASP H . 22 . HN 1 1 316 1 2 1 1 24 CYS H . 24 . HN 1 1 317 1 1 1 1 24 CYS H . 24 . HN 1 1 317 1 2 1 1 25 LYS H . 25 . HN 1 1 318 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 318 1 2 1 1 25 LYS H . 25 . HN 1 1 319 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 319 1 2 1 1 25 LYS H . 25 . HN 1 1 320 1 1 1 1 13 PRO HB3 . 13 . HB1 1 1 320 1 2 1 1 14 CYS H . 14 . HN 1 1 321 1 1 1 1 14 CYS H . 14 . HN 1 1 321 1 2 1 1 39 PHE HA . 39 . HA 1 1 322 1 1 1 1 13 PRO HA . 13 . HA 1 1 322 1 2 1 1 14 CYS H . 14 . HN 1 1 323 1 1 1 1 10 TYR QE . 10 . HE# 1 1 323 1 2 1 1 14 CYS H . 14 . HN 1 1 324 1 1 1 1 14 CYS H . 14 . HN 1 1 324 1 2 1 1 14 CYS HB2 . 14 . HB2 1 1 325 1 1 1 1 36 ARG HB3 . 36 . HB1 1 1 325 1 2 1 1 37 ASP H . 37 . HN 1 1 326 1 1 1 1 36 ARG HB2 . 36 . HB2 1 1 326 1 2 1 1 37 ASP H . 37 . HN 1 1 327 1 1 1 1 37 ASP H . 37 . HN 1 1 327 1 2 1 1 37 ASP HB2 . 37 . HB2 1 1 328 1 1 1 1 37 ASP H . 37 . HN 1 1 328 1 2 1 1 37 ASP HB3 . 37 . HB1 1 1 329 1 1 1 1 46 ASN H . 46 . HN 1 1 329 1 2 1 1 46 ASN HD21 . 46 . HD21 1 1 330 1 1 1 1 6 LEU HA . 6 . HA 1 1 330 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 331 1 1 1 1 42 TRP HB3 . 42 . HB1 1 1 331 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 332 1 1 1 1 42 TRP HA . 42 . HA 1 1 332 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 333 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 333 1 2 1 1 41 CYS H . 41 . HN 1 1 334 1 1 1 1 7 ALA MB . 7 . HB# 1 1 334 1 2 1 1 41 CYS H . 41 . HN 1 1 335 1 1 1 1 41 CYS H . 41 . HN 1 1 335 1 2 1 1 41 CYS HB3 . 41 . HB1 1 1 336 1 1 1 1 41 CYS H . 41 . HN 1 1 336 1 2 1 1 41 CYS HB2 . 41 . HB2 1 1 337 1 1 1 1 6 LEU HA . 6 . HA 1 1 337 1 2 1 1 41 CYS H . 41 . HN 1 1 338 1 1 1 1 40 ARG HA . 40 . HA 1 1 338 1 2 1 1 41 CYS H . 41 . HN 1 1 339 1 1 1 1 40 ARG H . 40 . HN 1 1 339 1 2 1 1 40 ARG HG2 . 40 . HG2 1 1 340 1 1 1 1 40 ARG H . 40 . HN 1 1 340 1 2 1 1 40 ARG HG3 . 40 . HG1 1 1 341 1 1 1 1 38 ASP H . 38 . HN 1 1 341 1 2 1 1 39 PHE H . 39 . HN 1 1 342 1 1 1 1 3 CYS H . 3 . HN 1 1 342 1 2 1 1 45 LYS HG2 . 45 . HG2 1 1 343 1 1 1 1 17 THR MG . 17 . HG2# 1 1 343 1 2 1 1 21 ASP H . 21 . HN 1 1 344 1 1 1 1 18 GLY HA2 . 18 . HA2 1 1 344 1 2 1 1 21 ASP H . 21 . HN 1 1 345 1 1 1 1 5 ASN HA . 5 . HA 1 1 345 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 346 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 346 1 2 1 1 41 CYS H . 41 . HN 1 1 347 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 347 1 2 1 1 40 ARG HE . 40 . HE 1 1 348 1 1 1 1 6 LEU HG . 6 . HG 1 1 348 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 349 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 349 1 2 1 1 40 ARG HE . 40 . HE 1 1 350 1 1 1 1 19 SER HA . 19 . HA 1 1 350 1 2 1 1 22 ASP H . 22 . HN 1 1 351 1 1 1 1 16 THR MG . 16 . HG2# 1 1 351 1 2 1 1 19 SER H . 19 . HN 1 1 352 1 1 1 1 40 ARG H . 40 . HN 1 1 352 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 353 1 1 1 1 19 SER H . 19 . HN 1 1 353 1 2 1 1 21 ASP H . 21 . HN 1 1 354 1 1 1 1 23 HIS H . 23 . HN 1 1 354 1 2 1 1 23 HIS HB2 . 23 . HB2 1 1 355 1 1 1 1 10 TYR QE . 10 . HE# 1 1 355 1 2 1 1 23 HIS H . 23 . HN 1 1 356 1 1 1 1 10 TYR QD . 10 . HD# 1 1 356 1 2 1 1 23 HIS H . 23 . HN 1 1 357 1 1 1 1 23 HIS H . 23 . HN 1 1 357 1 2 1 1 23 HIS HD2 . 23 . HD2 1 1 358 1 1 1 1 23 HIS HD2 . 23 . HD2 1 1 358 1 2 1 1 24 CYS HA . 24 . HA 1 1 359 1 1 1 1 7 ALA MB . 7 . HB# 1 1 359 1 2 1 1 23 HIS HD2 . 23 . HD2 1 1 360 1 1 1 1 23 HIS H . 23 . HN 1 1 360 1 2 1 1 25 LYS H . 25 . HN 1 1 361 1 1 1 1 25 LYS H . 25 . HN 1 1 361 1 2 1 1 27 LYS H . 27 . HN 1 1 362 1 1 1 1 25 LYS HB2 . 25 . HB2 1 1 362 1 2 1 1 32 SER HA . 32 . HA 1 1 363 1 1 1 1 22 ASP HA . 22 . HA 1 1 363 1 2 1 1 26 ASN HD22 . 26 . HD22 1 1 364 1 1 1 1 22 ASP HA . 22 . HA 1 1 364 1 2 1 1 26 ASN HD21 . 26 . HD21 1 1 365 1 1 1 1 28 GLU H . 28 . HN 1 1 365 1 2 1 1 30 LEU H . 30 . HN 1 1 366 1 1 1 1 31 ARG H . 31 . HN 1 1 366 1 2 1 1 31 ARG HD3 . 31 . HD1 1 1 367 1 1 1 1 34 ARG H . 34 . HN 1 1 367 1 2 1 1 42 TRP HB2 . 42 . HB2 1 1 368 1 1 1 1 34 ARG H . 34 . HN 1 1 368 1 2 1 1 42 TRP HB3 . 42 . HB1 1 1 369 1 1 1 1 34 ARG H . 34 . HN 1 1 369 1 2 1 1 34 ARG HG2 . 34 . HG2 1 1 370 1 1 1 1 34 ARG H . 34 . HN 1 1 370 1 2 1 1 34 ARG HG3 . 34 . HG1 1 1 371 1 1 1 1 2 THR MG . 2 . HG2# 1 1 371 1 2 1 1 46 ASN HA . 46 . HA 1 1 372 1 1 1 1 46 ASN H . 46 . HN 1 1 372 1 2 1 1 46 ASN HD22 . 46 . HD22 1 1 373 1 1 1 1 35 CYS HA . 35 . HA 1 1 373 1 2 1 1 41 CYS HB3 . 41 . HB1 1 1 374 1 1 1 1 35 CYS HA . 35 . HA 1 1 374 1 2 1 1 36 ARG HB2 . 36 . HB2 1 1 375 1 1 1 1 35 CYS HA . 35 . HA 1 1 375 1 2 1 1 42 TRP HB2 . 42 . HB2 1 1 376 1 1 1 1 35 CYS H . 35 . HN 1 1 376 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 377 1 1 1 1 35 CYS H . 35 . HN 1 1 377 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 378 1 1 1 1 35 CYS HA . 35 . HA 1 1 378 1 2 1 1 36 ARG H . 36 . HN 1 1 379 1 1 1 1 36 ARG H . 36 . HN 1 1 379 1 2 1 1 36 ARG HB2 . 36 . HB2 1 1 380 1 1 1 1 36 ARG H . 36 . HN 1 1 380 1 2 1 1 36 ARG HB3 . 36 . HB1 1 1 381 1 1 1 1 35 CYS HB3 . 35 . HB1 1 1 381 1 2 1 1 36 ARG H . 36 . HN 1 1 382 1 1 1 1 35 CYS HB2 . 35 . HB2 1 1 382 1 2 1 1 36 ARG H . 36 . HN 1 1 383 1 1 1 1 38 ASP H . 38 . HN 1 1 383 1 2 1 1 38 ASP HB3 . 38 . HB1 1 1 384 1 1 1 1 38 ASP H . 38 . HN 1 1 384 1 2 1 1 38 ASP HB2 . 38 . HB2 1 1 385 1 1 1 1 33 GLY HA2 . 33 . HA2 1 1 385 1 2 1 1 43 CYS HA . 43 . HA 1 1 386 1 1 1 1 33 GLY HA3 . 33 . HA1 1 1 386 1 2 1 1 43 CYS HA . 43 . HA 1 1 387 1 1 1 1 30 LEU MD1 . 30 . HD1# 1 1 387 1 2 1 1 44 THR H . 44 . HN 1 1 388 1 1 1 1 7 ALA MB . 7 . HB# 1 1 388 1 2 1 1 10 TYR QD . 10 . HD# 1 1 389 1 1 1 1 25 LYS HE2 . 25 . HE2 1 1 389 1 2 1 1 32 SER HA . 32 . HA 1 1 390 1 1 1 1 25 LYS HE3 . 25 . HE1 1 1 390 1 2 1 1 32 SER HA . 32 . HA 1 1 391 1 1 1 1 7 ALA MB . 7 . HB# 1 1 391 1 2 1 1 42 TRP HA . 42 . HA 1 1 392 1 1 1 1 17 THR MG . 17 . HG2# 1 1 392 1 2 1 1 18 GLY HA3 . 18 . HA1 1 1 393 1 1 1 1 17 THR MG . 17 . HG2# 1 1 393 1 2 1 1 18 GLY HA2 . 18 . HA2 1 1 394 1 1 1 1 18 GLY HA2 . 18 . HA2 1 1 394 1 2 1 1 21 ASP HB3 . 21 . HB1 1 1 395 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 395 1 2 1 1 39 PHE HA . 39 . HA 1 1 396 1 1 1 1 18 GLY HA2 . 18 . HA2 1 1 396 1 2 1 1 21 ASP HB2 . 21 . HB2 1 1 397 1 1 1 1 31 ARG HD2 . 31 . HD2 1 1 397 1 2 1 1 44 THR MG . 44 . HG2# 1 1 398 1 1 1 1 31 ARG HD3 . 31 . HD1 1 1 398 1 2 1 1 44 THR MG . 44 . HG2# 1 1 399 1 1 1 1 4 GLU HG3 . 4 . HG1 1 1 399 1 2 1 1 42 TRP HB3 . 42 . HB1 1 1 400 1 1 1 1 7 ALA MB . 7 . HB# 1 1 400 1 2 1 1 41 CYS HB2 . 41 . HB2 1 1 401 1 1 1 1 2 THR HA . 2 . HA 1 1 401 1 2 1 1 46 ASN HA . 46 . HA 1 1 402 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 402 1 2 1 1 43 CYS HB3 . 43 . HB1 1 1 403 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 403 1 2 1 1 43 CYS HB3 . 43 . HB1 1 1 404 1 1 1 1 10 TYR QD . 10 . HD# 1 1 404 1 2 1 1 14 CYS HA . 14 . HA 1 1 405 1 1 1 1 10 TYR QE . 10 . HE# 1 1 405 1 2 1 1 14 CYS HA . 14 . HA 1 1 406 1 1 1 1 10 TYR QE . 10 . HE# 1 1 406 1 2 1 1 41 CYS HB2 . 41 . HB2 1 1 407 1 1 1 1 7 ALA MB . 7 . HB# 1 1 407 1 2 1 1 10 TYR QE . 10 . HE# 1 1 408 1 1 1 1 19 SER HA . 19 . HA 1 1 408 1 2 1 1 22 ASP HB3 . 22 . HB1 1 1 409 1 1 1 1 28 GLU HA . 28 . HA 1 1 409 1 2 1 1 28 GLU HG2 . 28 . HG2 1 1 410 1 1 1 1 24 CYS HA . 24 . HA 1 1 410 1 2 1 1 28 GLU HG2 . 28 . HG2 1 1 411 1 1 1 1 30 LEU HB3 . 30 . HB1 1 1 411 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 412 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 412 1 2 1 1 43 CYS HA . 43 . HA 1 1 413 1 1 1 1 16 THR HA . 16 . HA 1 1 413 1 2 1 1 16 THR MG . 16 . HG2# 1 1 414 1 1 1 1 13 PRO HB3 . 13 . HB1 1 1 414 1 2 1 1 39 PHE QD . 39 . HD# 1 1 415 1 1 1 1 13 PRO HB2 . 13 . HB2 1 1 415 1 2 1 1 15 PHE QE . 15 . HE# 1 1 416 1 1 1 1 13 PRO HB2 . 13 . HB2 1 1 416 1 2 1 1 39 PHE QD . 39 . HD# 1 1 417 1 1 1 1 15 PHE HA . 15 . HA 1 1 417 1 2 1 1 15 PHE QE . 15 . HE# 1 1 418 1 1 1 1 28 GLU HB3 . 28 . HB1 1 1 418 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 419 1 1 1 1 28 GLU HB2 . 28 . HB2 1 1 419 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 420 1 1 1 1 30 LEU MD1 . 30 . HD1# 1 1 420 1 2 1 1 43 CYS HB2 . 43 . HB2 1 1 421 1 1 1 1 30 LEU MD1 . 30 . HD1# 1 1 421 1 2 1 1 43 CYS HB3 . 43 . HB1 1 1 422 1 1 1 1 4 GLU HG2 . 4 . HG2 1 1 422 1 2 1 1 42 TRP HB3 . 42 . HB1 1 1 423 1 1 1 1 25 LYS HB3 . 25 . HB1 1 1 423 1 2 1 1 32 SER HA . 32 . HA 1 1 424 1 1 1 1 25 LYS HD2 . 25 . HD2 1 1 424 1 2 1 1 32 SER HA . 32 . HA 1 1 425 1 1 1 1 25 LYS HD3 . 25 . HD1 1 1 425 1 2 1 1 32 SER HA . 32 . HA 1 1 426 1 1 1 1 1 LYS QG . 1 . HG# 1 1 426 1 2 1 1 2 THR H . 2 . HN 1 1 427 1 1 1 1 3 CYS H . 3 . HN 1 1 427 1 2 1 1 45 LYS QG . 45 . HG# 1 1 428 1 1 1 1 3 CYS QB . 3 . HB# 1 1 428 1 2 1 1 4 GLU H . 4 . HN 1 1 429 1 1 1 1 3 CYS QB . 3 . HB# 1 1 429 1 2 1 1 47 CYS QB . 47 . HB# 1 1 430 1 1 1 1 4 GLU H . 4 . HN 1 1 430 1 2 1 1 4 GLU QB . 4 . HB# 1 1 431 1 1 1 1 4 GLU H . 4 . HN 1 1 431 1 2 1 1 4 GLU QG . 4 . HG# 1 1 432 1 1 1 1 4 GLU HA . 4 . HA 1 1 432 1 2 1 1 4 GLU QG . 4 . HG# 1 1 433 1 1 1 1 4 GLU QB . 4 . HB# 1 1 433 1 2 1 1 5 ASN H . 5 . HN 1 1 434 1 1 1 1 4 GLU QB . 4 . HB# 1 1 434 1 2 1 1 42 TRP HB3 . 42 . HB1 1 1 435 1 1 1 1 4 GLU QB . 4 . HB# 1 1 435 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 436 1 1 1 1 4 GLU QB . 4 . HB# 1 1 436 1 2 1 1 44 THR HA . 44 . HA 1 1 437 1 1 1 1 4 GLU QG . 4 . HG# 1 1 437 1 2 1 1 5 ASN H . 5 . HN 1 1 438 1 1 1 1 4 GLU QG . 4 . HG# 1 1 438 1 2 1 1 42 TRP HB3 . 42 . HB1 1 1 439 1 1 1 1 4 GLU QG . 4 . HG# 1 1 439 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 440 1 1 1 1 4 GLU QG . 4 . HG# 1 1 440 1 2 1 1 44 THR HA . 44 . HA 1 1 441 1 1 1 1 5 ASN H . 5 . HN 1 1 441 1 2 1 1 5 ASN QB . 5 . HB# 1 1 442 1 1 1 1 5 ASN QB . 5 . HB# 1 1 442 1 2 1 1 6 LEU H . 6 . HN 1 1 443 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 443 1 2 1 1 40 ARG QB . 40 . HB# 1 1 444 1 1 1 1 6 LEU MD1 . 6 . HD1# 1 1 444 1 2 1 1 40 ARG QG . 40 . HG# 1 1 445 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 445 1 2 1 1 40 ARG QB . 40 . HB# 1 1 446 1 1 1 1 6 LEU MD2 . 6 . HD2# 1 1 446 1 2 1 1 40 ARG QG . 40 . HG# 1 1 447 1 1 1 1 7 ALA MB . 7 . HB# 1 1 447 1 2 1 1 10 TYR QB . 10 . HB# 1 1 448 1 1 1 1 8 ASP H . 8 . HN 1 1 448 1 2 1 1 8 ASP QB . 8 . HB# 1 1 449 1 1 1 1 8 ASP QB . 8 . HB# 1 1 449 1 2 1 1 9 THR H . 9 . HN 1 1 450 1 1 1 1 10 TYR QB . 10 . HB# 1 1 450 1 2 1 1 23 HIS HD2 . 23 . HD2 1 1 451 1 1 1 1 10 TYR QD . 10 . HD# 1 1 451 1 2 1 1 20 CYS QB . 20 . HB# 1 1 452 1 1 1 1 10 TYR QD . 10 . HD# 1 1 452 1 2 1 1 23 HIS QB . 23 . HB# 1 1 453 1 1 1 1 10 TYR QE . 10 . HE# 1 1 453 1 2 1 1 20 CYS QB . 20 . HB# 1 1 454 1 1 1 1 11 LYS H . 11 . HN 1 1 454 1 2 1 1 11 LYS QB . 11 . HB# 1 1 455 1 1 1 1 11 LYS H . 11 . HN 1 1 455 1 2 1 1 11 LYS QG . 11 . HG# 1 1 456 1 1 1 1 11 LYS QB . 11 . HB# 1 1 456 1 2 1 1 11 LYS QZ . 11 . HZ# 1 1 457 1 1 1 1 11 LYS QB . 11 . HB# 1 1 457 1 2 1 1 12 GLY H . 12 . HN 1 1 458 1 1 1 1 11 LYS QG . 11 . HG# 1 1 458 1 2 1 1 12 GLY H . 12 . HN 1 1 459 1 1 1 1 12 GLY H . 12 . HN 1 1 459 1 2 1 1 13 PRO QD . 13 . HD# 1 1 460 1 1 1 1 12 GLY QA . 12 . HA# 1 1 460 1 2 1 1 13 PRO QG . 13 . HG# 1 1 461 1 1 1 1 12 GLY QA . 12 . HA# 1 1 461 1 2 1 1 13 PRO QD . 13 . HD# 1 1 462 1 1 1 1 13 PRO QG . 13 . HG# 1 1 462 1 2 1 1 15 PHE QE . 15 . HE# 1 1 463 1 1 1 1 14 CYS H . 14 . HN 1 1 463 1 2 1 1 39 PHE QB . 39 . HB# 1 1 464 1 1 1 1 15 PHE H . 15 . HN 1 1 464 1 2 1 1 15 PHE QB . 15 . HB# 1 1 465 1 1 1 1 15 PHE QB . 15 . HB# 1 1 465 1 2 1 1 16 THR H . 16 . HN 1 1 466 1 1 1 1 15 PHE QB . 15 . HB# 1 1 466 1 2 1 1 16 THR HB . 16 . HB 1 1 467 1 1 1 1 16 THR MG . 16 . HG2# 1 1 467 1 2 1 1 19 SER QB . 19 . HB# 1 1 468 1 1 1 1 17 THR HA . 17 . HA 1 1 468 1 2 1 1 20 CYS QB . 20 . HB# 1 1 469 1 1 1 1 19 SER H . 19 . HN 1 1 469 1 2 1 1 19 SER QB . 19 . HB# 1 1 470 1 1 1 1 19 SER H . 19 . HN 1 1 470 1 2 1 1 20 CYS QB . 20 . HB# 1 1 471 1 1 1 1 19 SER HA . 19 . HA 1 1 471 1 2 1 1 23 HIS QB . 23 . HB# 1 1 472 1 1 1 1 19 SER QB . 19 . HB# 1 1 472 1 2 1 1 20 CYS H . 20 . HN 1 1 473 1 1 1 1 20 CYS H . 20 . HN 1 1 473 1 2 1 1 20 CYS QB . 20 . HB# 1 1 474 1 1 1 1 20 CYS QB . 20 . HB# 1 1 474 1 2 1 1 21 ASP H . 21 . HN 1 1 475 1 1 1 1 20 CYS QB . 20 . HB# 1 1 475 1 2 1 1 34 ARG H . 34 . HN 1 1 476 1 1 1 1 20 CYS QB . 20 . HB# 1 1 476 1 2 1 1 34 ARG HA . 34 . HA 1 1 477 1 1 1 1 22 ASP HA . 22 . HA 1 1 477 1 2 1 1 26 ASN QD . 26 . HD2# 1 1 478 1 1 1 1 22 ASP HB3 . 22 . HB1 1 1 478 1 2 1 1 26 ASN QD . 26 . HD2# 1 1 479 1 1 1 1 23 HIS QB . 23 . HB# 1 1 479 1 2 1 1 23 HIS HD2 . 23 . HD2 1 1 480 1 1 1 1 23 HIS QB . 23 . HB# 1 1 480 1 2 1 1 24 CYS H . 24 . HN 1 1 481 1 1 1 1 23 HIS HD2 . 23 . HD2 1 1 481 1 2 1 1 28 GLU QB . 28 . HB# 1 1 482 1 1 1 1 23 HIS HD2 . 23 . HD2 1 1 482 1 2 1 1 28 GLU QG . 28 . HG# 1 1 483 1 1 1 1 24 CYS H . 24 . HN 1 1 483 1 2 1 1 24 CYS QB . 24 . HB# 1 1 484 1 1 1 1 24 CYS H . 24 . HN 1 1 484 1 2 1 1 25 LYS QB . 25 . HB# 1 1 485 1 1 1 1 24 CYS HA . 24 . HA 1 1 485 1 2 1 1 28 GLU QB . 28 . HB# 1 1 486 1 1 1 1 24 CYS HA . 24 . HA 1 1 486 1 2 1 1 28 GLU QG . 28 . HG# 1 1 487 1 1 1 1 24 CYS QB . 24 . HB# 1 1 487 1 2 1 1 25 LYS H . 25 . HN 1 1 488 1 1 1 1 24 CYS QB . 24 . HB# 1 1 488 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 489 1 1 1 1 24 CYS QB . 24 . HB# 1 1 489 1 2 1 1 32 SER H . 32 . HN 1 1 490 1 1 1 1 24 CYS QB . 24 . HB# 1 1 490 1 2 1 1 33 GLY H . 33 . HN 1 1 491 1 1 1 1 24 CYS QB . 24 . HB# 1 1 491 1 2 1 1 43 CYS HA . 43 . HA 1 1 492 1 1 1 1 24 CYS QB . 24 . HB# 1 1 492 1 2 1 1 43 CYS HB3 . 43 . HB1 1 1 493 1 1 1 1 25 LYS H . 25 . HN 1 1 493 1 2 1 1 25 LYS QB . 25 . HB# 1 1 494 1 1 1 1 25 LYS H . 25 . HN 1 1 494 1 2 1 1 25 LYS QG . 25 . HG# 1 1 495 1 1 1 1 25 LYS HA . 25 . HA 1 1 495 1 2 1 1 25 LYS QG . 25 . HG# 1 1 496 1 1 1 1 25 LYS QB . 25 . HB# 1 1 496 1 2 1 1 26 ASN H . 26 . HN 1 1 497 1 1 1 1 25 LYS QB . 25 . HB# 1 1 497 1 2 1 1 26 ASN HA . 26 . HA 1 1 498 1 1 1 1 25 LYS QB . 25 . HB# 1 1 498 1 2 1 1 32 SER HA . 32 . HA 1 1 499 1 1 1 1 25 LYS QE . 25 . HE# 1 1 499 1 2 1 1 25 LYS QG . 25 . HG# 1 1 500 1 1 1 1 25 LYS QE . 25 . HE# 1 1 500 1 2 1 1 32 SER HA . 32 . HA 1 1 501 1 1 1 1 26 ASN H . 26 . HN 1 1 501 1 2 1 1 26 ASN QB . 26 . HB# 1 1 502 1 1 1 1 26 ASN H . 26 . HN 1 1 502 1 2 1 1 26 ASN QD . 26 . HD2# 1 1 503 1 1 1 1 26 ASN QB . 26 . HB# 1 1 503 1 2 1 1 26 ASN QD . 26 . HD2# 1 1 504 1 1 1 1 26 ASN QB . 26 . HB# 1 1 504 1 2 1 1 27 LYS H . 27 . HN 1 1 505 1 1 1 1 27 LYS H . 27 . HN 1 1 505 1 2 1 1 27 LYS QB . 27 . HB# 1 1 506 1 1 1 1 27 LYS H . 27 . HN 1 1 506 1 2 1 1 27 LYS QG . 27 . HG# 1 1 507 1 1 1 1 27 LYS H . 27 . HN 1 1 507 1 2 1 1 27 LYS QD . 27 . HD# 1 1 508 1 1 1 1 27 LYS H . 27 . HN 1 1 508 1 2 1 1 28 GLU QG . 28 . HG# 1 1 509 1 1 1 1 27 LYS HA . 27 . HA 1 1 509 1 2 1 1 27 LYS QD . 27 . HD# 1 1 510 1 1 1 1 27 LYS QB . 27 . HB# 1 1 510 1 2 1 1 28 GLU H . 28 . HN 1 1 511 1 1 1 1 28 GLU H . 28 . HN 1 1 511 1 2 1 1 28 GLU QB . 28 . HB# 1 1 512 1 1 1 1 28 GLU H . 28 . HN 1 1 512 1 2 1 1 28 GLU QG . 28 . HG# 1 1 513 1 1 1 1 28 GLU HA . 28 . HA 1 1 513 1 2 1 1 28 GLU QG . 28 . HG# 1 1 514 1 1 1 1 28 GLU QB . 28 . HB# 1 1 514 1 2 1 1 29 HIS H . 29 . HN 1 1 515 1 1 1 1 28 GLU QB . 28 . HB# 1 1 515 1 2 1 1 30 LEU H . 30 . HN 1 1 516 1 1 1 1 28 GLU QB . 28 . HB# 1 1 516 1 2 1 1 30 LEU QB . 30 . HB# 1 1 517 1 1 1 1 28 GLU QB . 28 . HB# 1 1 517 1 2 1 1 30 LEU HG . 30 . HG 1 1 518 1 1 1 1 28 GLU QB . 28 . HB# 1 1 518 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 519 1 1 1 1 28 GLU QG . 28 . HG# 1 1 519 1 2 1 1 29 HIS H . 29 . HN 1 1 520 1 1 1 1 29 HIS QB . 29 . HB# 1 1 520 1 2 1 1 29 HIS HE1 . 29 . HE1 1 1 521 1 1 1 1 30 LEU H . 30 . HN 1 1 521 1 2 1 1 30 LEU QB . 30 . HB# 1 1 522 1 1 1 1 30 LEU QB . 30 . HB# 1 1 522 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 523 1 1 1 1 30 LEU QB . 30 . HB# 1 1 523 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 524 1 1 1 1 30 LEU QB . 30 . HB# 1 1 524 1 2 1 1 31 ARG H . 31 . HN 1 1 525 1 1 1 1 30 LEU QB . 30 . HB# 1 1 525 1 2 1 1 43 CYS HB3 . 43 . HB1 1 1 526 1 1 1 1 30 LEU QB . 30 . HB# 1 1 526 1 2 1 1 44 THR H . 44 . HN 1 1 527 1 1 1 1 30 LEU MD2 . 30 . HD2# 1 1 527 1 2 1 1 45 LYS QB . 45 . HB# 1 1 528 1 1 1 1 31 ARG H . 31 . HN 1 1 528 1 2 1 1 31 ARG QB . 31 . HB# 1 1 529 1 1 1 1 31 ARG H . 31 . HN 1 1 529 1 2 1 1 31 ARG QD . 31 . HD# 1 1 530 1 1 1 1 31 ARG HA . 31 . HA 1 1 530 1 2 1 1 31 ARG QG . 31 . HG# 1 1 531 1 1 1 1 31 ARG QB . 31 . HB# 1 1 531 1 2 1 1 31 ARG QD . 31 . HD# 1 1 532 1 1 1 1 31 ARG QB . 31 . HB# 1 1 532 1 2 1 1 31 ARG HE . 31 . HE 1 1 533 1 1 1 1 31 ARG QB . 31 . HB# 1 1 533 1 2 1 1 32 SER H . 32 . HN 1 1 534 1 1 1 1 31 ARG QB . 31 . HB# 1 1 534 1 2 1 1 44 THR H . 44 . HN 1 1 535 1 1 1 1 31 ARG HE . 31 . HE 1 1 535 1 2 1 1 31 ARG QG . 31 . HG# 1 1 536 1 1 1 1 31 ARG QG . 31 . HG# 1 1 536 1 2 1 1 32 SER H . 32 . HN 1 1 537 1 1 1 1 31 ARG QD . 31 . HD# 1 1 537 1 2 1 1 32 SER H . 32 . HN 1 1 538 1 1 1 1 31 ARG QD . 31 . HD# 1 1 538 1 2 1 1 44 THR MG . 44 . HG2# 1 1 539 1 1 1 1 33 GLY H . 33 . HN 1 1 539 1 2 1 1 34 ARG QG . 34 . HG# 1 1 540 1 1 1 1 33 GLY QA . 33 . HA# 1 1 540 1 2 1 1 34 ARG H . 34 . HN 1 1 541 1 1 1 1 33 GLY QA . 33 . HA# 1 1 541 1 2 1 1 43 CYS HA . 43 . HA 1 1 542 1 1 1 1 33 GLY QA . 33 . HA# 1 1 542 1 2 1 1 44 THR H . 44 . HN 1 1 543 1 1 1 1 34 ARG H . 34 . HN 1 1 543 1 2 1 1 34 ARG QG . 34 . HG# 1 1 544 1 1 1 1 34 ARG HA . 34 . HA 1 1 544 1 2 1 1 34 ARG QG . 34 . HG# 1 1 545 1 1 1 1 34 ARG QG . 34 . HG# 1 1 545 1 2 1 1 35 CYS H . 35 . HN 1 1 546 1 1 1 1 35 CYS H . 35 . HN 1 1 546 1 2 1 1 35 CYS QB . 35 . HB# 1 1 547 1 1 1 1 35 CYS QB . 35 . HB# 1 1 547 1 2 1 1 36 ARG H . 36 . HN 1 1 548 1 1 1 1 36 ARG H . 36 . HN 1 1 548 1 2 1 1 36 ARG QG . 36 . HG# 1 1 549 1 1 1 1 36 ARG HA . 36 . HA 1 1 549 1 2 1 1 36 ARG QG . 36 . HG# 1 1 550 1 1 1 1 36 ARG QG . 36 . HG# 1 1 550 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 551 1 1 1 1 37 ASP H . 37 . HN 1 1 551 1 2 1 1 37 ASP QB . 37 . HB# 1 1 552 1 1 1 1 38 ASP H . 38 . HN 1 1 552 1 2 1 1 38 ASP QB . 38 . HB# 1 1 553 1 1 1 1 39 PHE H . 39 . HN 1 1 553 1 2 1 1 39 PHE QB . 39 . HB# 1 1 554 1 1 1 1 40 ARG H . 40 . HN 1 1 554 1 2 1 1 40 ARG QB . 40 . HB# 1 1 555 1 1 1 1 40 ARG H . 40 . HN 1 1 555 1 2 1 1 40 ARG QG . 40 . HG# 1 1 556 1 1 1 1 40 ARG HA . 40 . HA 1 1 556 1 2 1 1 40 ARG QG . 40 . HG# 1 1 557 1 1 1 1 40 ARG QB . 40 . HB# 1 1 557 1 2 1 1 40 ARG HE . 40 . HE 1 1 558 1 1 1 1 40 ARG QB . 40 . HB# 1 1 558 1 2 1 1 41 CYS H . 41 . HN 1 1 559 1 1 1 1 40 ARG QG . 40 . HG# 1 1 559 1 2 1 1 41 CYS H . 41 . HN 1 1 560 1 1 1 1 45 LYS H . 45 . HN 1 1 560 1 2 1 1 45 LYS QG . 45 . HG# 1 1 561 1 1 1 1 45 LYS HA . 45 . HA 1 1 561 1 2 1 1 45 LYS QG . 45 . HG# 1 1 562 1 1 1 1 45 LYS QB . 45 . HB# 1 1 562 1 2 1 1 46 ASN H . 46 . HN 1 1 563 1 1 1 1 45 LYS QG . 45 . HG# 1 1 563 1 2 1 1 46 ASN H . 46 . HN 1 1 564 1 1 1 1 46 ASN H . 46 . HN 1 1 564 1 2 1 1 46 ASN QB . 46 . HB# 1 1 565 1 1 1 1 46 ASN H . 46 . HN 1 1 565 1 2 1 1 46 ASN QD . 46 . HD2# 1 1 566 1 1 1 1 46 ASN QB . 46 . HB# 1 1 566 1 2 1 1 46 ASN QD . 46 . HD2# 1 1 567 1 1 1 1 46 ASN QB . 46 . HB# 1 1 567 1 2 1 1 47 CYS H . 47 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.65 1.8 5.5 1 1 2 1 . . . . . 3.65 1.8 5.5 1 1 3 1 . . . . . 2.36 1.8 2.92 1 1 4 1 . . . . . 3.235 1.8 4.67 1 1 5 1 . . . . . 3.27 1.8 4.74 1 1 6 1 . . . . . 3.27 1.8 4.74 1 1 7 1 . . . . . 2.365 1.8 2.93 1 1 8 1 . . . . . 2.745 1.8 3.69 1 1 9 1 . . . . . 2.58 1.8 3.36 1 1 10 1 . . . . . 2.635 1.8 3.47 1 1 11 1 . . . . . 2.635 1.8 3.47 1 1 12 1 . . . . . 3.4 1.8 5.0 1 1 13 1 . . . . . 2.5 1.8 3.2 1 1 14 1 . . . . . 3.415 1.8 5.03 1 1 15 1 . . . . . 2.94 1.8 4.08 1 1 16 1 . . . . . 2.94 1.8 4.08 1 1 17 1 . . . . . 2.71 1.8 3.62 1 1 18 1 . . . . . 2.765 1.8 3.73 1 1 19 1 . . . . . 2.765 1.8 3.73 1 1 20 1 . . . . . 2.365 1.8 2.93 1 1 21 1 . . . . . 2.75 1.8 3.7 1 1 22 1 . . . . . 2.34 1.8 2.88 1 1 23 1 . . . . . 2.905 1.8 4.01 1 1 24 1 . . . . . 2.44 1.8 3.08 1 1 25 1 . . . . . 2.73 1.8 3.66 1 1 26 1 . . . . . 2.985 1.8 4.17 1 1 27 1 . . . . . 2.8 1.8 3.8 1 1 28 1 . . . . . 2.545 1.8 3.29 1 1 29 1 . . . . . 3.65 1.8 5.5 1 1 30 1 . . . . . 3.65 1.8 5.5 1 1 31 1 . . . . . 2.665 1.8 3.53 1 1 32 1 . . . . . 2.49 1.8 3.18 1 1 33 1 . . . . . 2.565 1.8 3.33 1 1 34 1 . . . . . 3.05 1.8 4.3 1 1 35 1 . . . . . 3.05 1.8 4.3 1 1 36 1 . . . . . 2.7 1.8 3.6 1 1 37 1 . . . . . 3.11 1.8 4.42 1 1 38 1 . . . . . 3.11 1.8 4.42 1 1 39 1 . . . . . 3.505 1.8 5.21 1 1 40 1 . . . . . 3.505 1.8 5.21 1 1 41 1 . . . . . 2.51 1.8 3.22 1 1 42 1 . . . . . 2.765 1.8 3.73 1 1 43 1 . . . . . 2.925 1.8 4.05 1 1 44 1 . . . . . 2.905 1.8 4.01 1 1 45 1 . . . . . 2.865 1.8 3.93 1 1 46 1 . . . . . 2.865 1.8 3.93 1 1 47 1 . . . . . 2.62 1.8 3.44 1 1 48 1 . . . . . 2.3 1.8 2.8 1 1 49 1 . . . . . 3.325 1.8 4.85 1 1 50 1 . . . . . 3.14 1.8 4.48 1 1 51 1 . . . . . 2.435 1.8 3.07 1 1 52 1 . . . . . 3.155 1.8 4.51 1 1 53 1 . . . . . 2.79 1.8 3.78 1 1 54 1 . . . . . 2.33 1.8 2.86 1 1 55 1 . . . . . 2.66 1.8 3.52 1 1 56 1 . . . . . 2.855 1.8 3.91 1 1 57 1 . . . . . 2.955 1.8 4.11 1 1 58 1 . . . . . 2.535 1.8 3.27 1 1 59 1 . . . . . 2.645 1.8 3.49 1 1 60 1 . . . . . 2.7 1.8 3.6 1 1 61 1 . . . . . 2.61 1.8 3.42 1 1 62 1 . . . . . 2.85 1.8 3.9 1 1 63 1 . . . . . 3.51 1.8 5.22 1 1 64 1 . . . . . 3.255 1.8 4.71 1 1 65 1 . . . . . 3.255 1.8 4.71 1 1 66 1 . . . . . 3.51 1.8 5.22 1 1 67 1 . . . . . 3.65 1.8 5.5 1 1 68 1 . . . . . 3.14 1.8 4.48 1 1 69 1 . . . . . 2.935 1.8 4.07 1 1 70 1 . . . . . 2.935 1.8 4.07 1 1 71 1 . . . . . 3.14 1.8 4.48 1 1 72 1 . . . . . 3.32 1.8 4.84 1 1 73 1 . . . . . 2.615 1.8 3.43 1 1 74 1 . . . . . 3.315 1.8 4.83 1 1 75 1 . . . . . 2.955 1.8 4.11 1 1 76 1 . . . . . 2.695 1.8 3.59 1 1 77 1 . . . . . 2.67 1.8 3.54 1 1 78 1 . . . . . 2.88 1.8 3.96 1 1 79 1 . . . . . 3.175 1.8 4.55 1 1 80 1 . . . . . 2.505 1.8 3.21 1 1 81 1 . . . . . 2.685 1.8 3.57 1 1 82 1 . . . . . 3.33 1.8 4.86 1 1 83 1 . . . . . 3.325 1.8 4.85 1 1 84 1 . . . . . 2.64 1.8 3.48 1 1 85 1 . . . . . 2.64 1.8 3.48 1 1 86 1 . . . . . 3.37 1.8 4.94 1 1 87 1 . . . . . 3.13 1.8 4.46 1 1 88 1 . . . . . 3.325 1.8 4.85 1 1 89 1 . . . . . 3.05 1.8 4.3 1 1 90 1 . . . . . 2.625 1.8 3.45 1 1 91 1 . . . . . 3.325 1.8 4.85 1 1 92 1 . . . . . 3.49 1.8 5.18 1 1 93 1 . . . . . 2.88 1.8 3.96 1 1 94 1 . . . . . 2.99 1.8 4.18 1 1 95 1 . . . . . 3.515 1.8 5.23 1 1 96 1 . . . . . 3.415 1.8 5.03 1 1 97 1 . . . . . 3.47 1.8 5.14 1 1 98 1 . . . . . 3.415 1.8 5.03 1 1 99 1 . . . . . 2.735 1.8 3.67 1 1 100 1 . . . . . 2.67 1.8 3.54 1 1 101 1 . . . . . 2.735 1.8 3.67 1 1 102 1 . . . . . 2.93 1.8 4.06 1 1 103 1 . . . . . 2.93 1.8 4.06 1 1 104 1 . . . . . 3.22 1.8 4.64 1 1 105 1 . . . . . 2.87 1.8 3.94 1 1 106 1 . . . . . 2.65 1.8 3.5 1 1 107 1 . . . . . 2.495 1.8 3.19 1 1 108 1 . . . . . 2.84 1.8 3.88 1 1 109 1 . . . . . 2.675 1.8 3.55 1 1 110 1 . . . . . 2.855 1.8 3.91 1 1 111 1 . . . . . 3.2 1.8 4.6 1 1 112 1 . . . . . 3.2 1.8 4.6 1 1 113 1 . . . . . 2.94 1.8 4.08 1 1 114 1 . . . . . 2.8 1.8 3.8 1 1 115 1 . . . . . 2.93 1.8 4.06 1 1 116 1 . . . . . 2.645 1.8 3.49 1 1 117 1 . . . . . 2.925 1.8 4.05 1 1 118 1 . . . . . 3.16 1.8 4.52 1 1 119 1 . . . . . 3.16 1.8 4.52 1 1 120 1 . . . . . 3.58 1.8 5.36 1 1 121 1 . . . . . 2.365 1.8 2.93 1 1 122 1 . . . . . 2.98 1.8 4.16 1 1 123 1 . . . . . 3.32 1.8 4.84 1 1 124 1 . . . . . 3.65 1.8 5.5 1 1 125 1 . . . . . 3.65 1.8 5.5 1 1 126 1 . . . . . 3.65 1.8 5.5 1 1 127 1 . . . . . 3.65 1.8 5.5 1 1 128 1 . . . . . 3.65 1.8 5.5 1 1 129 1 . . . . . 3.345 1.8 4.89 1 1 130 1 . . . . . 3.22 1.8 4.64 1 1 131 1 . . . . . 3.22 1.8 4.64 1 1 132 1 . . . . . 3.46 1.8 5.12 1 1 133 1 . . . . . 2.36 1.8 2.92 1 1 134 1 . . . . . 3.115 1.8 4.43 1 1 135 1 . . . . . 3.175 1.8 4.55 1 1 136 1 . . . . . 3.235 1.8 4.67 1 1 137 1 . . . . . 2.79 1.8 3.78 1 1 138 1 . . . . . 2.96 1.8 4.12 1 1 139 1 . . . . . 3.03 1.8 4.26 1 1 140 1 . . . . . 2.96 1.8 4.12 1 1 141 1 . . . . . 2.845 1.8 3.89 1 1 142 1 . . . . . 2.845 1.8 3.89 1 1 143 1 . . . . . 2.93 1.8 4.06 1 1 144 1 . . . . . 2.93 1.8 4.06 1 1 145 1 . . . . . 3.035 1.8 4.27 1 1 146 1 . . . . . 3.57 1.8 5.34 1 1 147 1 . . . . . 3.595 1.8 5.39 1 1 148 1 . . . . . 3.65 1.8 5.5 1 1 149 1 . . . . . 2.79 1.8 3.78 1 1 150 1 . . . . . 2.79 1.8 3.78 1 1 151 1 . . . . . 2.855 1.8 3.91 1 1 152 1 . . . . . 2.855 1.8 3.91 1 1 153 1 . . . . . 3.65 1.8 5.5 1 1 154 1 . . . . . 3.65 1.8 5.5 1 1 155 1 . . . . . 2.9 1.8 4.0 1 1 156 1 . . . . . 3.565 1.8 5.33 1 1 157 1 . . . . . 2.79 1.8 3.78 1 1 158 1 . . . . . 2.905 1.8 4.01 1 1 159 1 . . . . . 3.095 1.8 4.39 1 1 160 1 . . . . . 2.72 1.8 3.64 1 1 161 1 . . . . . 2.88 1.8 3.96 1 1 162 1 . . . . . 2.365 1.8 2.93 1 1 163 1 . . . . . 2.87 1.8 3.94 1 1 164 1 . . . . . 2.655 1.8 3.51 1 1 165 1 . . . . . 2.87 1.8 3.94 1 1 166 1 . . . . . 3.18 1.8 4.56 1 1 167 1 . . . . . 3.18 1.8 4.56 1 1 168 1 . . . . . 3.31 1.8 4.82 1 1 169 1 . . . . . 2.615 1.8 3.43 1 1 170 1 . . . . . 2.58 1.8 3.36 1 1 171 1 . . . . . 2.825 1.8 3.85 1 1 172 1 . . . . . 2.825 1.8 3.85 1 1 173 1 . . . . . 2.63 1.8 3.46 1 1 174 1 . . . . . 2.63 1.8 3.46 1 1 175 1 . . . . . 2.72 1.8 3.64 1 1 176 1 . . . . . 2.72 1.8 3.64 1 1 177 1 . . . . . 2.96 1.8 4.12 1 1 178 1 . . . . . 3.315 1.8 4.83 1 1 179 1 . . . . . 2.96 1.8 4.12 1 1 180 1 . . . . . 3.595 1.8 5.39 1 1 181 1 . . . . . 2.655 1.8 3.51 1 1 182 1 . . . . . 3.31 1.8 4.82 1 1 183 1 . . . . . 3.6 1.8 5.4 1 1 184 1 . . . . . 3.65 1.8 5.5 1 1 185 1 . . . . . 3.5 1.8 5.2 1 1 186 1 . . . . . 2.64 1.8 3.48 1 1 187 1 . . . . . 3.135 1.8 4.47 1 1 188 1 . . . . . 3.125 1.8 4.45 1 1 189 1 . . . . . 3.125 1.8 4.45 1 1 190 1 . . . . . 2.915 1.8 4.03 1 1 191 1 . . . . . 2.915 1.8 4.03 1 1 192 1 . . . . . 3.65 1.8 5.5 1 1 193 1 . . . . . 3.65 1.8 5.5 1 1 194 1 . . . . . 2.585 1.8 3.37 1 1 195 1 . . . . . 3.45 1.8 5.1 1 1 196 1 . . . . . 2.77 1.8 3.74 1 1 197 1 . . . . . 2.945 1.8 4.09 1 1 198 1 . . . . . 3.46 1.8 5.12 1 1 199 1 . . . . . 3.45 1.8 5.1 1 1 200 1 . . . . . 3.45 1.8 5.1 1 1 201 1 . . . . . 3.65 1.8 5.5 1 1 202 1 . . . . . 3.09 1.8 4.38 1 1 203 1 . . . . . 3.485 1.8 5.17 1 1 204 1 . . . . . 3.11 1.8 4.42 1 1 205 1 . . . . . 3.415 1.8 5.03 1 1 206 1 . . . . . 3.46 1.8 5.12 1 1 207 1 . . . . . 3.385 1.8 4.97 1 1 208 1 . . . . . 3.11 1.8 4.42 1 1 209 1 . . . . . 2.84 1.8 3.88 1 1 210 1 . . . . . 3.005 1.8 4.21 1 1 211 1 . . . . . 2.47 1.8 3.14 1 1 212 1 . . . . . 2.99 1.8 4.18 1 1 213 1 . . . . . 3.475 1.8 5.15 1 1 214 1 . . . . . 3.045 1.8 4.29 1 1 215 1 . . . . . 2.54 1.8 3.28 1 1 216 1 . . . . . 3.15 1.8 4.5 1 1 217 1 . . . . . 3.14 1.8 4.48 1 1 218 1 . . . . . 2.93 1.8 4.06 1 1 219 1 . . . . . 2.93 1.8 4.06 1 1 220 1 . . . . . 2.855 1.8 3.91 1 1 221 1 . . . . . 2.455 1.8 3.11 1 1 222 1 . . . . . 2.27 1.8 2.74 1 1 223 1 . . . . . 2.435 1.8 3.07 1 1 224 1 . . . . . 2.97 1.8 4.14 1 1 225 1 . . . . . 2.58 1.8 3.36 1 1 226 1 . . . . . 2.975 1.8 4.15 1 1 227 1 . . . . . 2.5 1.8 3.2 1 1 228 1 . . . . . 2.59 1.8 3.38 1 1 229 1 . . . . . 3.65 1.8 5.5 1 1 230 1 . . . . . 3.65 1.8 5.5 1 1 231 1 . . . . . 3.065 1.8 4.33 1 1 232 1 . . . . . 2.745 1.8 3.69 1 1 233 1 . . . . . 2.745 1.8 3.69 1 1 234 1 . . . . . 2.675 1.8 3.55 1 1 235 1 . . . . . 2.83 1.8 3.86 1 1 236 1 . . . . . 2.775 1.8 3.75 1 1 237 1 . . . . . 3.395 1.8 4.99 1 1 238 1 . . . . . 2.99 1.8 4.18 1 1 239 1 . . . . . 3.045 1.8 4.29 1 1 240 1 . . . . . 3.535 1.8 5.27 1 1 241 1 . . . . . 3.65 1.8 5.5 1 1 242 1 . . . . . 3.43 1.8 5.06 1 1 243 1 . . . . . 3.0 1.8 4.2 1 1 244 1 . . . . . 2.645 1.8 3.49 1 1 245 1 . . . . . 2.625 1.8 3.45 1 1 246 1 . . . . . 2.975 1.8 4.15 1 1 247 1 . . . . . 2.95 1.8 4.1 1 1 248 1 . . . . . 2.995 1.8 4.19 1 1 249 1 . . . . . 3.335 1.8 4.87 1 1 250 1 . . . . . 2.945 1.8 4.09 1 1 251 1 . . . . . 2.85 1.8 3.9 1 1 252 1 . . . . . 3.02 1.8 4.24 1 1 253 1 . . . . . 3.02 1.8 4.24 1 1 254 1 . . . . . 2.465 1.8 3.13 1 1 255 1 . . . . . 2.905 1.8 4.01 1 1 256 1 . . . . . 2.905 1.8 4.01 1 1 257 1 . . . . . 3.24 1.8 4.68 1 1 258 1 . . . . . 3.465 1.8 5.13 1 1 259 1 . . . . . 2.655 1.8 3.51 1 1 260 1 . . . . . 2.755 1.8 3.71 1 1 261 1 . . . . . 3.265 1.8 4.73 1 1 262 1 . . . . . 3.365 1.8 4.93 1 1 263 1 . . . . . 2.845 1.8 3.89 1 1 264 1 . . . . . 2.69 1.8 3.58 1 1 265 1 . . . . . 2.8 1.8 3.8 1 1 266 1 . . . . . 3.125 1.8 4.45 1 1 267 1 . . . . . 3.34 1.8 4.88 1 1 268 1 . . . . . 3.32 1.8 4.84 1 1 269 1 . . . . . 3.29 1.8 4.78 1 1 270 1 . . . . . 2.415 1.8 3.03 1 1 271 1 . . . . . 2.96 1.8 4.12 1 1 272 1 . . . . . 3.02 1.8 4.24 1 1 273 1 . . . . . 3.02 1.8 4.24 1 1 274 1 . . . . . 3.175 1.8 4.55 1 1 275 1 . . . . . 3.63 1.8 5.46 1 1 276 1 . . . . . 2.805 1.8 3.81 1 1 277 1 . . . . . 2.805 1.8 3.81 1 1 278 1 . . . . . 2.365 1.8 2.93 1 1 279 1 . . . . . 3.405 1.8 5.01 1 1 280 1 . . . . . 3.53 1.8 5.26 1 1 281 1 . . . . . 2.715 1.8 3.63 1 1 282 1 . . . . . 2.36 1.8 2.92 1 1 283 1 . . . . . 2.475 1.8 3.15 1 1 284 1 . . . . . 3.165 1.8 4.53 1 1 285 1 . . . . . 3.315 1.8 4.83 1 1 286 1 . . . . . 2.65 1.8 3.5 1 1 287 1 . . . . . 2.935 1.8 4.07 1 1 288 1 . . . . . 2.935 1.8 4.07 1 1 289 1 . . . . . 2.705 1.8 3.61 1 1 290 1 . . . . . 2.775 1.8 3.75 1 1 291 1 . . . . . 3.45 1.8 5.1 1 1 292 1 . . . . . 2.705 1.8 3.61 1 1 293 1 . . . . . 3.5 1.8 5.2 1 1 294 1 . . . . . 3.09 1.8 4.38 1 1 295 1 . . . . . 2.96 1.8 4.12 1 1 296 1 . . . . . 2.96 1.8 4.12 1 1 297 1 . . . . . 3.65 1.8 5.5 1 1 298 1 . . . . . 3.65 1.8 5.5 1 1 299 1 . . . . . 2.62 1.8 3.44 1 1 300 1 . . . . . 3.08 1.8 4.36 1 1 301 1 . . . . . 2.95 1.8 4.1 1 1 302 1 . . . . . 2.95 1.8 4.1 1 1 303 1 . . . . . 3.215 1.8 4.63 1 1 304 1 . . . . . 3.46 1.8 5.12 1 1 305 1 . . . . . 2.625 1.8 3.45 1 1 306 1 . . . . . 2.85 1.8 3.9 1 1 307 1 . . . . . 3.095 1.8 4.39 1 1 308 1 . . . . . 3.285 1.8 4.77 1 1 309 1 . . . . . 3.41 1.8 5.02 1 1 310 1 . . . . . 2.47 1.8 3.14 1 1 311 1 . . . . . 3.24 1.8 4.68 1 1 312 1 . . . . . 3.1 1.8 4.4 1 1 313 1 . . . . . 3.02 1.8 4.24 1 1 314 1 . . . . . 3.26 1.8 4.72 1 1 315 1 . . . . . 3.05 1.8 4.3 1 1 316 1 . . . . . 3.445 1.8 5.09 1 1 317 1 . . . . . 2.73 1.8 3.66 1 1 318 1 . . . . . 2.99 1.8 4.18 1 1 319 1 . . . . . 2.99 1.8 4.18 1 1 320 1 . . . . . 2.855 1.8 3.91 1 1 321 1 . . . . . 3.035 1.8 4.27 1 1 322 1 . . . . . 2.385 1.8 2.97 1 1 323 1 . . . . . 3.25 1.8 4.7 1 1 324 1 . . . . . 2.645 1.8 3.49 1 1 325 1 . . . . . 2.445 1.8 3.09 1 1 326 1 . . . . . 2.765 1.8 3.73 1 1 327 1 . . . . . 2.775 1.8 3.75 1 1 328 1 . . . . . 2.775 1.8 3.75 1 1 329 1 . . . . . 3.44 1.8 5.08 1 1 330 1 . . . . . 3.14 1.8 4.48 1 1 331 1 . . . . . 2.44 1.8 3.08 1 1 332 1 . . . . . 3.175 1.8 4.55 1 1 333 1 . . . . . 3.65 1.8 5.5 1 1 334 1 . . . . . 3.235 1.8 4.67 1 1 335 1 . . . . . 2.785 1.8 3.77 1 1 336 1 . . . . . 2.585 1.8 3.37 1 1 337 1 . . . . . 3.65 1.8 5.5 1 1 338 1 . . . . . 2.6 1.8 3.4 1 1 339 1 . . . . . 3.65 1.8 5.5 1 1 340 1 . . . . . 3.65 1.8 5.5 1 1 341 1 . . . . . 2.515 1.8 3.23 1 1 342 1 . . . . . 3.315 1.8 4.83 1 1 343 1 . . . . . 3.37 1.8 4.94 1 1 344 1 . . . . . 3.06 1.8 4.32 1 1 345 1 . . . . . 2.675 1.8 3.55 1 1 346 1 . . . . . 3.32 1.8 4.84 1 1 347 1 . . . . . 3.16 1.8 4.52 1 1 348 1 . . . . . 3.26 1.8 4.72 1 1 349 1 . . . . . 3.335 1.8 4.87 1 1 350 1 . . . . . 3.0 1.8 4.2 1 1 351 1 . . . . . 2.74 1.8 3.68 1 1 352 1 . . . . . 3.42 1.8 5.04 1 1 353 1 . . . . . 3.325 1.8 4.85 1 1 354 1 . . . . . 2.58 1.8 3.36 1 1 355 1 . . . . . 3.46 1.8 5.12 1 1 356 1 . . . . . 3.535 1.8 5.27 1 1 357 1 . . . . . 3.425 1.8 5.05 1 1 358 1 . . . . . 2.745 1.8 3.69 1 1 359 1 . . . . . 2.77 1.8 3.74 1 1 360 1 . . . . . 3.425 1.8 5.05 1 1 361 1 . . . . . 3.45 1.8 5.1 1 1 362 1 . . . . . 3.65 1.8 5.5 1 1 363 1 . . . . . 2.975 1.8 4.15 1 1 364 1 . . . . . 2.975 1.8 4.15 1 1 365 1 . . . . . 3.07 1.8 4.34 1 1 366 1 . . . . . 3.595 1.8 5.39 1 1 367 1 . . . . . 3.245 1.8 4.69 1 1 368 1 . . . . . 3.41 1.8 5.02 1 1 369 1 . . . . . 3.065 1.8 4.33 1 1 370 1 . . . . . 3.065 1.8 4.33 1 1 371 1 . . . . . 2.715 1.8 3.63 1 1 372 1 . . . . . 3.44 1.8 5.08 1 1 373 1 . . . . . 3.435 1.8 5.07 1 1 374 1 . . . . . 3.085 1.8 4.37 1 1 375 1 . . . . . 3.36 1.8 4.92 1 1 376 1 . . . . . 2.905 1.8 4.01 1 1 377 1 . . . . . 2.905 1.8 4.01 1 1 378 1 . . . . . 2.505 1.8 3.21 1 1 379 1 . . . . . 2.72 1.8 3.64 1 1 380 1 . . . . . 2.87 1.8 3.94 1 1 381 1 . . . . . 3.175 1.8 4.55 1 1 382 1 . . . . . 3.175 1.8 4.55 1 1 383 1 . . . . . 2.94 1.8 4.08 1 1 384 1 . . . . . 2.94 1.8 4.08 1 1 385 1 . . . . . 2.775 1.8 3.75 1 1 386 1 . . . . . 2.775 1.8 3.75 1 1 387 1 . . . . . 3.155 1.8 4.51 1 1 388 1 . . . . . 2.875 1.8 3.95 1 1 389 1 . . . . . 3.365 1.8 4.93 1 1 390 1 . . . . . 3.365 1.8 4.93 1 1 391 1 . . . . . 3.03 1.8 4.26 1 1 392 1 . . . . . 3.35 1.8 4.9 1 1 393 1 . . . . . 3.08 1.8 4.36 1 1 394 1 . . . . . 2.86 1.8 3.92 1 1 395 1 . . . . . 2.93 1.8 4.06 1 1 396 1 . . . . . 2.98 1.8 4.16 1 1 397 1 . . . . . 2.9 1.8 4.0 1 1 398 1 . . . . . 2.9 1.8 4.0 1 1 399 1 . . . . . 3.115 1.8 4.43 1 1 400 1 . . . . . 2.56 1.8 3.32 1 1 401 1 . . . . . 3.19 1.8 4.58 1 1 402 1 . . . . . 3.1 1.8 4.4 1 1 403 1 . . . . . 3.1 1.8 4.4 1 1 404 1 . . . . . 3.65 1.8 5.5 1 1 405 1 . . . . . 2.835 1.8 3.87 1 1 406 1 . . . . . 3.47 1.8 5.14 1 1 407 1 . . . . . 3.495 1.8 5.19 1 1 408 1 . . . . . 3.01 1.8 4.22 1 1 409 1 . . . . . 2.79 1.8 3.78 1 1 410 1 . . . . . 3.03 1.8 4.26 1 1 411 1 . . . . . 2.72 1.8 3.64 1 1 412 1 . . . . . 3.46 1.8 5.12 1 1 413 1 . . . . . 2.665 1.8 3.53 1 1 414 1 . . . . . 3.36 1.8 4.92 1 1 415 1 . . . . . 3.16 1.8 4.52 1 1 416 1 . . . . . 3.33 1.8 4.86 1 1 417 1 . . . . . 3.175 1.8 4.55 1 1 418 1 . . . . . 2.975 1.8 4.15 1 1 419 1 . . . . . 2.975 1.8 4.15 1 1 420 1 . . . . . 2.71 1.8 3.62 1 1 421 1 . . . . . 2.73 1.8 3.66 1 1 422 1 . . . . . 3.115 1.8 4.43 1 1 423 1 . . . . . 3.65 1.8 5.5 1 1 424 1 . . . . . 3.65 1.8 5.5 1 1 425 1 . . . . . 3.65 1.8 5.5 1 1 426 1 . . . . . 2.78 1.8 3.76 1 1 427 1 . . . . . 2.945 1.8 4.09 1 1 428 1 . . . . . 3.03 1.8 4.26 1 1 429 1 . . . . . 2.88 1.8 3.96 1 1 430 1 . . . . . 2.57 1.8 3.34 1 1 431 1 . . . . . 3.235 1.8 4.67 1 1 432 1 . . . . . 2.73 1.8 3.66 1 1 433 1 . . . . . 2.975 1.8 4.15 1 1 434 1 . . . . . 3.1 1.8 4.4 1 1 435 1 . . . . . 2.68 1.8 3.56 1 1 436 1 . . . . . 3.275 1.8 4.75 1 1 437 1 . . . . . 2.88 1.8 3.96 1 1 438 1 . . . . . 2.74 1.8 3.68 1 1 439 1 . . . . . 2.56 1.8 3.32 1 1 440 1 . . . . . 3.18 1.8 4.56 1 1 441 1 . . . . . 2.655 1.8 3.51 1 1 442 1 . . . . . 2.855 1.8 3.91 1 1 443 1 . . . . . 3.12 1.8 4.44 1 1 444 1 . . . . . 2.9 1.8 4.0 1 1 445 1 . . . . . 2.775 1.8 3.75 1 1 446 1 . . . . . 2.66 1.8 3.52 1 1 447 1 . . . . . 2.63 1.8 3.46 1 1 448 1 . . . . . 2.68 1.8 3.56 1 1 449 1 . . . . . 2.86 1.8 3.92 1 1 450 1 . . . . . 2.885 1.8 3.97 1 1 451 1 . . . . . 3.345 1.8 4.89 1 1 452 1 . . . . . 2.5 1.8 3.2 1 1 453 1 . . . . . 3.06 1.8 4.32 1 1 454 1 . . . . . 2.515 1.8 3.23 1 1 455 1 . . . . . 2.86 1.8 3.92 1 1 456 1 . . . . . 3.4 1.8 5.0 1 1 457 1 . . . . . 2.945 1.8 4.09 1 1 458 1 . . . . . 3.28 1.8 4.76 1 1 459 1 . . . . . 3.27 1.8 4.74 1 1 460 1 . . . . . 3.135 1.8 4.47 1 1 461 1 . . . . . 2.34 1.8 2.88 1 1 462 1 . . . . . 3.055 1.8 4.31 1 1 463 1 . . . . . 3.105 1.8 4.41 1 1 464 1 . . . . . 2.485 1.8 3.17 1 1 465 1 . . . . . 2.685 1.8 3.57 1 1 466 1 . . . . . 3.155 1.8 4.51 1 1 467 1 . . . . . 3.57 1.8 5.34 1 1 468 1 . . . . . 2.83 1.8 3.86 1 1 469 1 . . . . . 2.415 1.8 3.03 1 1 470 1 . . . . . 3.435 1.8 5.07 1 1 471 1 . . . . . 3.57 1.8 5.34 1 1 472 1 . . . . . 2.62 1.8 3.44 1 1 473 1 . . . . . 2.45 1.8 3.1 1 1 474 1 . . . . . 2.705 1.8 3.61 1 1 475 1 . . . . . 3.57 1.8 5.34 1 1 476 1 . . . . . 3.28 1.8 4.76 1 1 477 1 . . . . . 2.64 1.8 3.48 1 1 478 1 . . . . . 2.97 1.8 4.14 1 1 479 1 . . . . . 2.64 1.8 3.48 1 1 480 1 . . . . . 2.55 1.8 3.3 1 1 481 1 . . . . . 3.365 1.8 4.93 1 1 482 1 . . . . . 3.145 1.8 4.49 1 1 483 1 . . . . . 2.475 1.8 3.15 1 1 484 1 . . . . . 3.39 1.8 4.98 1 1 485 1 . . . . . 2.695 1.8 3.59 1 1 486 1 . . . . . 2.735 1.8 3.67 1 1 487 1 . . . . . 2.65 1.8 3.5 1 1 488 1 . . . . . 3.18 1.8 4.56 1 1 489 1 . . . . . 3.21 1.8 4.62 1 1 490 1 . . . . . 3.105 1.8 4.41 1 1 491 1 . . . . . 3.03 1.8 4.26 1 1 492 1 . . . . . 2.76 1.8 3.72 1 1 493 1 . . . . . 2.485 1.8 3.17 1 1 494 1 . . . . . 2.6 1.8 3.4 1 1 495 1 . . . . . 2.695 1.8 3.59 1 1 496 1 . . . . . 2.575 1.8 3.35 1 1 497 1 . . . . . 3.52 1.8 5.24 1 1 498 1 . . . . . 3.22 1.8 4.64 1 1 499 1 . . . . . 2.48 1.8 3.16 1 1 500 1 . . . . . 2.93 1.8 4.06 1 1 501 1 . . . . . 2.455 1.8 3.11 1 1 502 1 . . . . . 3.125 1.8 4.45 1 1 503 1 . . . . . 2.39 1.8 2.98 1 1 504 1 . . . . . 2.775 1.8 3.75 1 1 505 1 . . . . . 2.53 1.8 3.26 1 1 506 1 . . . . . 3.22 1.8 4.64 1 1 507 1 . . . . . 3.09 1.8 4.38 1 1 508 1 . . . . . 3.57 1.8 5.34 1 1 509 1 . . . . . 2.56 1.8 3.32 1 1 510 1 . . . . . 2.595 1.8 3.39 1 1 511 1 . . . . . 2.595 1.8 3.39 1 1 512 1 . . . . . 2.93 1.8 4.06 1 1 513 1 . . . . . 2.52 1.8 3.24 1 1 514 1 . . . . . 2.94 1.8 4.08 1 1 515 1 . . . . . 2.88 1.8 3.96 1 1 516 1 . . . . . 3.345 1.8 4.89 1 1 517 1 . . . . . 2.81 1.8 3.82 1 1 518 1 . . . . . 2.71 1.8 3.62 1 1 519 1 . . . . . 3.57 1.8 5.34 1 1 520 1 . . . . . 3.25 1.8 4.7 1 1 521 1 . . . . . 2.535 1.8 3.27 1 1 522 1 . . . . . 2.46 1.8 3.12 1 1 523 1 . . . . . 2.39 1.8 2.98 1 1 524 1 . . . . . 2.315 1.8 2.83 1 1 525 1 . . . . . 2.91 1.8 4.02 1 1 526 1 . . . . . 3.365 1.8 4.93 1 1 527 1 . . . . . 2.68 1.8 3.56 1 1 528 1 . . . . . 2.405 1.8 3.01 1 1 529 1 . . . . . 3.27 1.8 4.74 1 1 530 1 . . . . . 2.57 1.8 3.34 1 1 531 1 . . . . . 2.565 1.8 3.33 1 1 532 1 . . . . . 3.005 1.8 4.21 1 1 533 1 . . . . . 2.62 1.8 3.44 1 1 534 1 . . . . . 3.325 1.8 4.85 1 1 535 1 . . . . . 2.71 1.8 3.62 1 1 536 1 . . . . . 3.04 1.8 4.28 1 1 537 1 . . . . . 3.355 1.8 4.91 1 1 538 1 . . . . . 2.55 1.8 3.3 1 1 539 1 . . . . . 3.39 1.8 4.98 1 1 540 1 . . . . . 2.395 1.8 2.99 1 1 541 1 . . . . . 2.52 1.8 3.24 1 1 542 1 . . . . . 2.99 1.8 4.18 1 1 543 1 . . . . . 2.78 1.8 3.76 1 1 544 1 . . . . . 2.765 1.8 3.73 1 1 545 1 . . . . . 3.14 1.8 4.48 1 1 546 1 . . . . . 2.565 1.8 3.33 1 1 547 1 . . . . . 2.74 1.8 3.68 1 1 548 1 . . . . . 2.89 1.8 3.98 1 1 549 1 . . . . . 2.68 1.8 3.56 1 1 550 1 . . . . . 2.585 1.8 3.37 1 1 551 1 . . . . . 2.475 1.8 3.15 1 1 552 1 . . . . . 2.63 1.8 3.46 1 1 553 1 . . . . . 2.725 1.8 3.65 1 1 554 1 . . . . . 2.645 1.8 3.49 1 1 555 1 . . . . . 3.265 1.8 4.73 1 1 556 1 . . . . . 2.685 1.8 3.57 1 1 557 1 . . . . . 2.87 1.8 3.94 1 1 558 1 . . . . . 3.07 1.8 4.34 1 1 559 1 . . . . . 2.575 1.8 3.35 1 1 560 1 . . . . . 2.685 1.8 3.57 1 1 561 1 . . . . . 2.765 1.8 3.73 1 1 562 1 . . . . . 2.52 1.8 3.24 1 1 563 1 . . . . . 2.965 1.8 4.13 1 1 564 1 . . . . . 2.46 1.8 3.12 1 1 565 1 . . . . . 3.135 1.8 4.47 1 1 566 1 . . . . . 2.465 1.8 3.13 1 1 567 1 . . . . . 2.71 1.8 3.62 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 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 3 CYS H . 3 . HN 1 2 1 1 2 1 1 45 LYS O . 45 . O 1 2 2 1 1 1 1 3 CYS N . 3 . N 1 2 2 1 2 1 1 45 LYS O . 45 . O 1 2 3 1 1 1 1 5 ASN H . 5 . HN 1 2 3 1 2 1 1 43 CYS O . 43 . O 1 2 4 1 1 1 1 5 ASN N . 5 . N 1 2 4 1 2 1 1 43 CYS O . 43 . O 1 2 5 1 1 1 1 7 ALA H . 7 . HN 1 2 5 1 2 1 1 41 CYS O . 41 . O 1 2 6 1 1 1 1 7 ALA N . 7 . N 1 2 6 1 2 1 1 41 CYS O . 41 . O 1 2 7 1 1 1 1 17 THR O . 17 . O 1 2 7 1 2 1 1 21 ASP H . 21 . HN 1 2 8 1 1 1 1 17 THR O . 17 . O 1 2 8 1 2 1 1 21 ASP N . 21 . N 1 2 9 1 1 1 1 18 GLY O . 18 . O 1 2 9 1 2 1 1 22 ASP H . 22 . HN 1 2 10 1 1 1 1 18 GLY O . 18 . O 1 2 10 1 2 1 1 22 ASP N . 22 . N 1 2 11 1 1 1 1 19 SER O . 19 . O 1 2 11 1 2 1 1 23 HIS H . 23 . HN 1 2 12 1 1 1 1 19 SER O . 19 . O 1 2 12 1 2 1 1 23 HIS N . 23 . N 1 2 13 1 1 1 1 20 CYS O . 20 . O 1 2 13 1 2 1 1 24 CYS H . 24 . HN 1 2 14 1 1 1 1 20 CYS O . 20 . O 1 2 14 1 2 1 1 24 CYS N . 24 . N 1 2 15 1 1 1 1 34 ARG O . 34 . O 1 2 15 1 2 1 1 42 TRP H . 42 . HN 1 2 16 1 1 1 1 34 ARG O . 34 . O 1 2 16 1 2 1 1 42 TRP N . 42 . N 1 2 17 1 1 1 1 5 ASN O . 5 . O 1 2 17 1 2 1 1 43 CYS H . 43 . HN 1 2 18 1 1 1 1 5 ASN O . 5 . O 1 2 18 1 2 1 1 43 CYS N . 43 . N 1 2 19 1 1 1 1 32 SER O . 32 . O 1 2 19 1 2 1 1 44 THR H . 44 . HN 1 2 20 1 1 1 1 32 SER O . 32 . O 1 2 20 1 2 1 1 44 THR N . 44 . N 1 2 21 1 1 1 1 3 CYS O . 3 . O 1 2 21 1 2 1 1 45 LYS H . 45 . HN 1 2 22 1 1 1 1 3 CYS O . 3 . O 1 2 22 1 2 1 1 45 LYS N . 45 . N 1 2 23 1 1 1 1 36 ARG H . 36 . HN 1 2 23 1 2 1 1 40 ARG O . 40 . O 1 2 24 1 1 1 1 36 ARG N . 36 . N 1 2 24 1 2 1 1 40 ARG O . 40 . O 1 2 25 1 1 1 1 34 ARG H . 34 . HN 1 2 25 1 2 1 1 42 TRP O . 42 . O 1 2 26 1 1 1 1 34 ARG N . 34 . N 1 2 26 1 2 1 1 42 TRP O . 42 . O 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 0.0 0.0 2.0 1 2 2 1 . . . . . 0.0 0.0 3.0 1 2 3 1 . . . . . 0.0 0.0 2.0 1 2 4 1 . . . . . 0.0 0.0 3.0 1 2 5 1 . . . . . 0.0 0.0 2.0 1 2 6 1 . . . . . 0.0 0.0 3.0 1 2 7 1 . . . . . 0.0 0.0 2.0 1 2 8 1 . . . . . 0.0 0.0 3.0 1 2 9 1 . . . . . 0.0 0.0 2.0 1 2 10 1 . . . . . 0.0 0.0 3.0 1 2 11 1 . . . . . 0.0 0.0 2.0 1 2 12 1 . . . . . 0.0 0.0 3.0 1 2 13 1 . . . . . 0.0 0.0 2.0 1 2 14 1 . . . . . 0.0 0.0 3.0 1 2 15 1 . . . . . 0.0 0.0 2.0 1 2 16 1 . . . . . 0.0 0.0 3.0 1 2 17 1 . . . . . 0.0 0.0 2.0 1 2 18 1 . . . . . 0.0 0.0 3.0 1 2 19 1 . . . . . 0.0 0.0 2.0 1 2 20 1 . . . . . 0.0 0.0 3.0 1 2 21 1 . . . . . 0.0 0.0 2.0 1 2 22 1 . . . . . 0.0 0.0 3.0 1 2 23 1 . . . . . 0.0 0.0 2.0 1 2 24 1 . . . . . 0.0 0.0 3.0 1 2 25 1 . . . . . 0.0 0.0 2.0 1 2 26 1 . . . . . 0.0 0.0 3.0 1 2 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 LYS C 1 1 2 THR N 1 1 2 THR CA 1 1 2 THR C -140.0 -80.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 2 THR N 1 1 2 THR CA 1 1 2 THR C 1 1 3 CYS N 110.0 170.0 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1 3 . 1 1 2 THR C 1 1 3 CYS N 1 1 3 CYS CA 1 1 3 CYS C -179.99998 -20.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 4 . 1 1 3 CYS C 1 1 4 GLU N 1 1 4 GLU CA 1 1 4 GLU C -150.0 -89.99999 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 5 . 1 1 4 GLU N 1 1 4 GLU CA 1 1 4 GLU C 1 1 5 ASN N 110.0 170.0 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 6 . 1 1 4 GLU C 1 1 5 ASN N 1 1 5 ASN CA 1 1 5 ASN C -160.0 -100.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 7 . 1 1 5 ASN N 1 1 5 ASN CA 1 1 5 ASN C 1 1 6 LEU N 110.0 170.0 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 8 . 1 1 5 ASN C 1 1 6 LEU N 1 1 6 LEU CA 1 1 6 LEU C -100.0 -40.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 9 . 1 1 6 LEU N 1 1 6 LEU CA 1 1 6 LEU C 1 1 7 ALA N 100.0 160.0 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 10 . 1 1 6 LEU C 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C -100.0 -40.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 11 . 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C 1 1 8 ASP N 100.0 179.99998 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 12 . 1 1 7 ALA C 1 1 8 ASP N 1 1 8 ASP CA 1 1 8 ASP C -110.0 -30.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 13 . 1 1 8 ASP N 1 1 8 ASP CA 1 1 8 ASP C 1 1 9 THR N -50.0 10.0 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 14 . 1 1 8 ASP C 1 1 9 THR N 1 1 9 THR CA 1 1 9 THR C -130.0 -70.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 15 . 1 1 9 THR C 1 1 10 TYR N 1 1 10 TYR CA 1 1 10 TYR C -100.0 -40.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 16 . 1 1 13 PRO N 1 1 13 PRO CA 1 1 13 PRO C 1 1 14 CYS N 120.0 179.99998 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 17 . 1 1 15 PHE C 1 1 16 THR N 1 1 16 THR CA 1 1 16 THR C -140.0 -80.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 18 . 1 1 16 THR N 1 1 16 THR CA 1 1 16 THR C 1 1 17 THR N 89.99999 170.0 . 16 . N . 16 . CA . 16 . C . 17 . N 1 1 19 . 1 1 16 THR C 1 1 17 THR N 1 1 17 THR CA 1 1 17 THR C -89.99999 -30.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 20 . 1 1 17 THR N 1 1 17 THR CA 1 1 17 THR C 1 1 18 GLY N -60.0 0.0 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 21 . 1 1 17 THR C 1 1 18 GLY N 1 1 18 GLY CA 1 1 18 GLY C -80.0 -40.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 22 . 1 1 18 GLY N 1 1 18 GLY CA 1 1 18 GLY C 1 1 19 SER N -70.0 -10.0 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 23 . 1 1 18 GLY C 1 1 19 SER N 1 1 19 SER CA 1 1 19 SER C -89.99999 -50.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 24 . 1 1 19 SER N 1 1 19 SER CA 1 1 19 SER C 1 1 20 CYS N -60.0 -20.0 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 25 . 1 1 19 SER C 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS C -89.99999 -50.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 26 . 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS C 1 1 21 ASP N -60.0 -20.0 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 27 . 1 1 20 CYS C 1 1 21 ASP N 1 1 21 ASP CA 1 1 21 ASP C -80.0 -40.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 28 . 1 1 21 ASP N 1 1 21 ASP CA 1 1 21 ASP C 1 1 22 ASP N -60.0 -20.0 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 29 . 1 1 21 ASP C 1 1 22 ASP N 1 1 22 ASP CA 1 1 22 ASP C -89.99999 -60.0 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 30 . 1 1 22 ASP N 1 1 22 ASP CA 1 1 22 ASP C 1 1 23 HIS N -60.0 -20.0 . 22 . N . 22 . CA . 22 . C . 23 . N 1 1 31 . 1 1 22 ASP C 1 1 23 HIS N 1 1 23 HIS CA 1 1 23 HIS C -89.99999 -50.0 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 32 . 1 1 23 HIS N 1 1 23 HIS CA 1 1 23 HIS C 1 1 24 CYS N -60.0 -20.0 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 33 . 1 1 23 HIS C 1 1 24 CYS N 1 1 24 CYS CA 1 1 24 CYS C -89.99999 -50.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 34 . 1 1 24 CYS N 1 1 24 CYS CA 1 1 24 CYS C 1 1 25 LYS N -60.0 -20.0 . 24 . N . 24 . CA . 24 . C . 25 . N 1 1 35 . 1 1 24 CYS C 1 1 25 LYS N 1 1 25 LYS CA 1 1 25 LYS C -80.0 -40.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 36 . 1 1 25 LYS N 1 1 25 LYS CA 1 1 25 LYS C 1 1 26 ASN N -70.0 -10.0 . 25 . N . 25 . CA . 25 . C . 26 . N 1 1 37 . 1 1 25 LYS C 1 1 26 ASN N 1 1 26 ASN CA 1 1 26 ASN C -89.99999 -50.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 38 . 1 1 26 ASN N 1 1 26 ASN CA 1 1 26 ASN C 1 1 27 LYS N -60.0 0.0 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 39 . 1 1 26 ASN C 1 1 27 LYS N 1 1 27 LYS CA 1 1 27 LYS C -89.99999 -50.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 40 . 1 1 27 LYS N 1 1 27 LYS CA 1 1 27 LYS C 1 1 28 GLU N -50.0 10.0 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 41 . 1 1 27 LYS C 1 1 28 GLU N 1 1 28 GLU CA 1 1 28 GLU C -120.0 -60.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 42 . 1 1 28 GLU N 1 1 28 GLU CA 1 1 28 GLU C 1 1 29 HIS N -40.0 20.0 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 43 . 1 1 30 LEU C 1 1 31 ARG N 1 1 31 ARG CA 1 1 31 ARG C -100.0 -40.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 44 . 1 1 31 ARG N 1 1 31 ARG CA 1 1 31 ARG C 1 1 32 SER N -60.0 0.0 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 45 . 1 1 33 GLY C 1 1 34 ARG N 1 1 34 ARG CA 1 1 34 ARG C -160.0 -80.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 46 . 1 1 34 ARG N 1 1 34 ARG CA 1 1 34 ARG C 1 1 35 CYS N 120.0 179.99998 . 34 . N . 34 . CA . 34 . C . 35 . N 1 1 47 . 1 1 34 ARG C 1 1 35 CYS N 1 1 35 CYS CA 1 1 35 CYS C -120.0 -60.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 48 . 1 1 35 CYS N 1 1 35 CYS CA 1 1 35 CYS C 1 1 36 ARG N 80.0 160.0 . 35 . N . 35 . CA . 35 . C . 36 . N 1 1 49 . 1 1 35 CYS C 1 1 36 ARG N 1 1 36 ARG CA 1 1 36 ARG C -110.0 -50.0 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 50 . 1 1 36 ARG N 1 1 36 ARG CA 1 1 36 ARG C 1 1 37 ASP N 140.0 179.99998 . 36 . N . 36 . CA . 36 . C . 37 . N 1 1 51 . 1 1 36 ARG C 1 1 37 ASP N 1 1 37 ASP CA 1 1 37 ASP C -100.0 -40.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 52 . 1 1 37 ASP N 1 1 37 ASP CA 1 1 37 ASP C 1 1 38 ASP N -50.0 10.0 . 37 . N . 37 . CA . 37 . C . 38 . N 1 1 53 . 1 1 37 ASP C 1 1 38 ASP N 1 1 38 ASP CA 1 1 38 ASP C -120.0 -60.0 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 54 . 1 1 38 ASP C 1 1 39 PHE N 1 1 39 PHE CA 1 1 39 PHE C 30.0 89.99999 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 55 . 1 1 39 PHE N 1 1 39 PHE CA 1 1 39 PHE C 1 1 40 ARG N 0.0 60.0 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 56 . 1 1 39 PHE C 1 1 40 ARG N 1 1 40 ARG CA 1 1 40 ARG C -130.0 -70.0 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 57 . 1 1 40 ARG N 1 1 40 ARG CA 1 1 40 ARG C 1 1 41 CYS N 120.0 179.99998 . 40 . N . 40 . CA . 40 . C . 41 . N 1 1 58 . 1 1 40 ARG C 1 1 41 CYS N 1 1 41 CYS CA 1 1 41 CYS C -110.0 -50.0 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 59 . 1 1 41 CYS N 1 1 41 CYS CA 1 1 41 CYS C 1 1 42 TRP N 80.0 160.0 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 60 . 1 1 41 CYS C 1 1 42 TRP N 1 1 42 TRP CA 1 1 42 TRP C -160.0 -80.0 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 61 . 1 1 42 TRP N 1 1 42 TRP CA 1 1 42 TRP C 1 1 43 CYS N 100.0 170.0 . 42 . N . 42 . CA . 42 . C . 43 . N 1 1 62 . 1 1 42 TRP C 1 1 43 CYS N 1 1 43 CYS CA 1 1 43 CYS C -130.0 -70.0 . 42 . C . 43 . N . 43 . CA . 43 . C 1 1 63 . 1 1 43 CYS N 1 1 43 CYS CA 1 1 43 CYS C 1 1 44 THR N 89.99999 150.0 . 43 . N . 43 . CA . 43 . C . 44 . N 1 1 64 . 1 1 43 CYS C 1 1 44 THR N 1 1 44 THR CA 1 1 44 THR C -140.0 -80.0 . 43 . C . 44 . N . 44 . CA . 44 . C 1 1 65 . 1 1 44 THR N 1 1 44 THR CA 1 1 44 THR C 1 1 45 LYS N 100.0 160.0 . 44 . N . 44 . CA . 44 . C . 45 . N 1 1 66 . 1 1 44 THR C 1 1 45 LYS N 1 1 45 LYS CA 1 1 45 LYS C -170.0 -110.0 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1 67 . 1 1 45 LYS N 1 1 45 LYS CA 1 1 45 LYS C 1 1 46 ASN N 120.0 179.99998 . 45 . N . 45 . CA . 45 . C . 46 . N 1 1 68 . 1 1 45 LYS C 1 1 46 ASN N 1 1 46 ASN CA 1 1 46 ASN C -100.0 -40.0 . 45 . C . 46 . N . 46 . CA . 46 . C 1 1 69 . 1 1 46 ASN N 1 1 46 ASN CA 1 1 46 ASN C 1 1 47 CYS N 110.0 170.0 . 46 . N . 46 . CA . 46 . C . 47 . N 1 1 70 . 1 1 4 GLU N 1 1 4 GLU CA 1 1 4 GLU CB 1 1 4 GLU CG 150.0 210.0 . 4 . N . 4 . CA . 4 . CB . 4 . CG 1 1 71 . 1 1 6 LEU N 1 1 6 LEU CA 1 1 6 LEU CB 1 1 6 LEU CG -89.99999 -30.0 . 6 . N . 6 . CA . 6 . CB . 6 . CG 1 1 72 . 1 1 10 TYR N 1 1 10 TYR CA 1 1 10 TYR CB 1 1 10 TYR CG 150.0 210.0 . 10 . N . 10 . CA . 10 . CB . 10 . CG 1 1 73 . 1 1 15 PHE N 1 1 15 PHE CA 1 1 15 PHE CB 1 1 15 PHE CG -89.99999 -30.0 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1 74 . 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS CB 1 1 20 CYS SG -210.0 -30.0 . 20 . N . 20 . CA . 20 . CB . 20 . SG 1 1 75 . 1 1 23 HIS N 1 1 23 HIS CA 1 1 23 HIS CB 1 1 23 HIS CG 150.0 210.0 . 23 . N . 23 . CA . 23 . CB . 23 . CG 1 1 76 . 1 1 24 CYS N 1 1 24 CYS CA 1 1 24 CYS CB 1 1 24 CYS SG -89.99999 -30.0 . 24 . N . 24 . CA . 24 . CB . 24 . SG 1 1 77 . 1 1 26 ASN N 1 1 26 ASN CA 1 1 26 ASN CB 1 1 26 ASN CG -89.99999 -30.0 . 26 . N . 26 . CA . 26 . CB . 26 . CG 1 1 78 . 1 1 30 LEU N 1 1 30 LEU CA 1 1 30 LEU CB 1 1 30 LEU CG -89.99999 -30.0 . 30 . N . 30 . CA . 30 . CB . 30 . CG 1 1 79 . 1 1 31 ARG N 1 1 31 ARG CA 1 1 31 ARG CB 1 1 31 ARG CG 150.0 210.0 . 31 . N . 31 . CA . 31 . CB . 31 . CG 1 1 80 . 1 1 35 CYS N 1 1 35 CYS CA 1 1 35 CYS CB 1 1 35 CYS SG -89.99999 -30.0 . 35 . N . 35 . CA . 35 . CB . 35 . SG 1 1 81 . 1 1 41 CYS N 1 1 41 CYS CA 1 1 41 CYS CB 1 1 41 CYS SG -89.99999 -30.0 . 41 . N . 41 . CA . 41 . CB . 41 . SG 1 1 82 . 1 1 43 CYS N 1 1 43 CYS CA 1 1 43 CYS CB 1 1 43 CYS SG -89.99999 -30.0 . 43 . N . 43 . CA . 43 . CB . 43 . SG 1 1 83 . 1 1 46 ASN N 1 1 46 ASN CA 1 1 46 ASN CB 1 1 46 ASN CG -89.99999 -30.0 . 46 . N . 46 . CA . 46 . CB . 46 . CG 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 LYS C C 9.979 11.491 2.425 1.00 . A A . 1 LYS C 1 1 1 2 1 1 1 LYS CA C 10.248 12.825 3.128 1.00 . A A . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C 11.738 12.943 3.503 1.00 . A A . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C 13.708 12.063 4.844 1.00 . A A . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C 14.588 11.768 3.632 1.00 . A A . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C 12.222 11.917 4.530 1.00 . A A . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H 9.613 13.915 4.772 1.00 . A A . 1 LYS H1 1 1 1 8 1 1 1 LYS H2 H 9.464 12.250 5.013 1.00 . A A . 1 LYS H2 1 1 1 9 1 1 1 LYS H3 H 8.385 13.075 4.023 1.00 . A A . 1 LYS H3 1 1 1 10 1 1 1 LYS HA H 9.999 13.604 2.426 1.00 . A A . 1 LYS HA 1 1 1 11 1 1 1 LYS HB2 H 12.318 12.814 2.601 1.00 . A A . 1 LYS HB2 1 1 1 12 1 1 1 LYS HB3 H 11.921 13.932 3.895 1.00 . A A . 1 LYS HB3 1 1 1 13 1 1 1 LYS HD2 H 13.901 13.071 5.177 1.00 . A A . 1 LYS HD2 1 1 1 14 1 1 1 LYS HD3 H 13.959 11.373 5.637 1.00 . A A . 1 LYS HD3 1 1 1 15 1 1 1 LYS HE2 H 14.423 10.747 3.325 1.00 . A A . 1 LYS HE2 1 1 1 16 1 1 1 LYS HE3 H 14.310 12.427 2.826 1.00 . A A . 1 LYS HE3 1 1 1 17 1 1 1 LYS HG2 H 11.669 12.063 5.444 1.00 . A A . 1 LYS HG2 1 1 1 18 1 1 1 LYS HG3 H 12.034 10.924 4.149 1.00 . A A . 1 LYS HG3 1 1 1 19 1 1 1 LYS HZ1 H 16.604 11.753 3.094 1.00 . A A . 1 LYS HZ1 1 1 1 20 1 1 1 LYS HZ2 H 16.335 11.306 4.685 1.00 . A A . 1 LYS HZ2 1 1 1 21 1 1 1 LYS HZ3 H 16.218 12.927 4.240 1.00 . A A . 1 LYS HZ3 1 1 1 22 1 1 1 LYS N N 9.383 13.011 4.309 1.00 . A A . 1 LYS N 1 1 1 23 1 1 1 LYS NZ N 16.023 11.952 3.932 1.00 . A A . 1 LYS NZ 1 1 1 24 1 1 1 LYS O O 10.847 10.962 1.710 1.00 . A A . 1 LYS O 1 1 1 25 1 1 2 THR C C 7.439 10.015 0.837 1.00 . A A . 2 THR C 1 1 1 26 1 1 2 THR CA C 8.439 9.729 1.939 1.00 . A A . 2 THR CA 1 1 1 27 1 1 2 THR CB C 7.858 8.717 2.953 1.00 . A A . 2 THR CB 1 1 1 28 1 1 2 THR CG2 C 8.961 8.089 3.790 1.00 . A A . 2 THR CG2 1 1 1 29 1 1 2 THR H H 8.102 11.410 3.110 1.00 . A A . 2 THR H 1 1 1 30 1 1 2 THR HA H 9.333 9.313 1.498 1.00 . A A . 2 THR HA 1 1 1 31 1 1 2 THR HB H 7.344 7.942 2.403 1.00 . A A . 2 THR HB 1 1 1 32 1 1 2 THR HG1 H 6.123 9.589 3.300 1.00 . A A . 2 THR HG1 1 1 1 33 1 1 2 THR HG21 H 9.648 7.570 3.138 1.00 . A A . 2 THR HG21 1 1 1 34 1 1 2 THR HG22 H 8.529 7.391 4.491 1.00 . A A . 2 THR HG22 1 1 1 35 1 1 2 THR HG23 H 9.489 8.864 4.327 1.00 . A A . 2 THR HG23 1 1 1 36 1 1 2 THR N N 8.802 10.963 2.587 1.00 . A A . 2 THR N 1 1 1 37 1 1 2 THR O O 6.756 11.029 0.873 1.00 . A A . 2 THR O 1 1 1 38 1 1 2 THR OG1 O 6.917 9.376 3.810 1.00 . A A . 2 THR OG1 1 1 1 39 1 1 3 CYS C C 5.327 8.358 -1.024 1.00 . A A . 3 CYS C 1 1 1 40 1 1 3 CYS CA C 6.430 9.359 -1.212 1.00 . A A . 3 CYS CA 1 1 1 41 1 1 3 CYS CB C 7.128 9.117 -2.543 1.00 . A A . 3 CYS CB 1 1 1 42 1 1 3 CYS H H 7.905 8.346 -0.108 1.00 . A A . 3 CYS H 1 1 1 43 1 1 3 CYS HA H 6.039 10.364 -1.173 1.00 . A A . 3 CYS HA 1 1 1 44 1 1 3 CYS HB2 H 7.310 8.060 -2.658 1.00 . A A . 3 CYS HB2 1 1 1 45 1 1 3 CYS HB3 H 6.492 9.456 -3.348 1.00 . A A . 3 CYS HB3 1 1 1 46 1 1 3 CYS N N 7.363 9.164 -0.127 1.00 . A A . 3 CYS N 1 1 1 47 1 1 3 CYS O O 5.518 7.372 -0.306 1.00 . A A . 3 CYS O 1 1 1 48 1 1 3 CYS SG S 8.725 9.961 -2.702 1.00 . A A . 3 CYS SG 1 1 1 49 1 1 4 GLU C C 2.304 7.594 -2.747 1.00 . A A . 4 GLU C 1 1 1 50 1 1 4 GLU CA C 3.115 7.649 -1.464 1.00 . A A . 4 GLU CA 1 1 1 51 1 1 4 GLU CB C 2.278 8.049 -0.246 1.00 . A A . 4 GLU CB 1 1 1 52 1 1 4 GLU CD C 0.578 7.398 1.447 1.00 . A A . 4 GLU CD 1 1 1 53 1 1 4 GLU CG C 1.197 7.072 0.123 1.00 . A A . 4 GLU CG 1 1 1 54 1 1 4 GLU H H 4.053 9.374 -2.170 1.00 . A A . 4 GLU H 1 1 1 55 1 1 4 GLU HA H 3.546 6.674 -1.290 1.00 . A A . 4 GLU HA 1 1 1 56 1 1 4 GLU HB2 H 2.935 8.154 0.604 1.00 . A A . 4 GLU HB2 1 1 1 57 1 1 4 GLU HB3 H 1.819 9.005 -0.447 1.00 . A A . 4 GLU HB3 1 1 1 58 1 1 4 GLU HG2 H 0.435 7.116 -0.639 1.00 . A A . 4 GLU HG2 1 1 1 59 1 1 4 GLU HG3 H 1.615 6.077 0.164 1.00 . A A . 4 GLU HG3 1 1 1 60 1 1 4 GLU N N 4.196 8.575 -1.619 1.00 . A A . 4 GLU N 1 1 1 61 1 1 4 GLU O O 1.785 8.610 -3.205 1.00 . A A . 4 GLU O 1 1 1 62 1 1 4 GLU OE1 O -0.269 8.322 1.519 1.00 . A A . 4 GLU OE1 1 1 1 63 1 1 4 GLU OE2 O 0.930 6.761 2.453 1.00 . A A . 4 GLU OE2 1 1 1 64 1 1 5 ASN C C 0.552 5.092 -4.541 1.00 . A A . 5 ASN C 1 1 1 65 1 1 5 ASN CA C 1.542 6.240 -4.618 1.00 . A A . 5 ASN CA 1 1 1 66 1 1 5 ASN CB C 2.565 5.979 -5.750 1.00 . A A . 5 ASN CB 1 1 1 67 1 1 5 ASN CG C 3.343 4.667 -5.605 1.00 . A A . 5 ASN CG 1 1 1 68 1 1 5 ASN H H 2.597 5.635 -2.879 1.00 . A A . 5 ASN H 1 1 1 69 1 1 5 ASN HA H 1.002 7.148 -4.838 1.00 . A A . 5 ASN HA 1 1 1 70 1 1 5 ASN HB2 H 2.044 5.947 -6.694 1.00 . A A . 5 ASN HB2 1 1 1 71 1 1 5 ASN HB3 H 3.273 6.794 -5.771 1.00 . A A . 5 ASN HB3 1 1 1 72 1 1 5 ASN HD21 H 2.034 3.704 -6.731 1.00 . A A . 5 ASN HD21 1 1 1 73 1 1 5 ASN HD22 H 3.347 2.763 -6.144 1.00 . A A . 5 ASN HD22 1 1 1 74 1 1 5 ASN N N 2.217 6.422 -3.330 1.00 . A A . 5 ASN N 1 1 1 75 1 1 5 ASN ND2 N 2.864 3.613 -6.215 1.00 . A A . 5 ASN ND2 1 1 1 76 1 1 5 ASN O O 0.608 4.291 -3.619 1.00 . A A . 5 ASN O 1 1 1 77 1 1 5 ASN OD1 O 4.390 4.621 -4.966 1.00 . A A . 5 ASN OD1 1 1 1 78 1 1 6 LEU C C -0.775 2.612 -5.825 1.00 . A A . 6 LEU C 1 1 1 79 1 1 6 LEU CA C -1.352 3.970 -5.544 1.00 . A A . 6 LEU CA 1 1 1 80 1 1 6 LEU CB C -2.441 4.277 -6.578 1.00 . A A . 6 LEU CB 1 1 1 81 1 1 6 LEU CD1 C -4.450 5.559 -7.301 1.00 . A A . 6 LEU CD1 1 1 1 82 1 1 6 LEU CD2 C -4.183 4.885 -4.967 1.00 . A A . 6 LEU CD2 1 1 1 83 1 1 6 LEU CG C -3.456 5.334 -6.188 1.00 . A A . 6 LEU CG 1 1 1 84 1 1 6 LEU H H -0.337 5.679 -6.228 1.00 . A A . 6 LEU H 1 1 1 85 1 1 6 LEU HA H -1.822 3.936 -4.574 1.00 . A A . 6 LEU HA 1 1 1 86 1 1 6 LEU HB2 H -1.955 4.598 -7.488 1.00 . A A . 6 LEU HB2 1 1 1 87 1 1 6 LEU HB3 H -2.971 3.360 -6.786 1.00 . A A . 6 LEU HB3 1 1 1 88 1 1 6 LEU HD11 H -5.166 6.301 -6.979 1.00 . A A . 6 LEU HD11 1 1 1 89 1 1 6 LEU HD12 H -4.970 4.635 -7.513 1.00 . A A . 6 LEU HD12 1 1 1 90 1 1 6 LEU HD13 H -3.935 5.912 -8.180 1.00 . A A . 6 LEU HD13 1 1 1 91 1 1 6 LEU HD21 H -4.602 3.908 -5.156 1.00 . A A . 6 LEU HD21 1 1 1 92 1 1 6 LEU HD22 H -4.982 5.582 -4.759 1.00 . A A . 6 LEU HD22 1 1 1 93 1 1 6 LEU HD23 H -3.521 4.842 -4.116 1.00 . A A . 6 LEU HD23 1 1 1 94 1 1 6 LEU HG H -2.960 6.265 -5.960 1.00 . A A . 6 LEU HG 1 1 1 95 1 1 6 LEU N N -0.344 5.017 -5.504 1.00 . A A . 6 LEU N 1 1 1 96 1 1 6 LEU O O 0.125 2.469 -6.657 1.00 . A A . 6 LEU O 1 1 1 97 1 1 7 ALA C C -1.608 -0.131 -6.659 1.00 . A A . 7 ALA C 1 1 1 98 1 1 7 ALA CA C -0.946 0.247 -5.358 1.00 . A A . 7 ALA CA 1 1 1 99 1 1 7 ALA CB C -1.463 -0.623 -4.229 1.00 . A A . 7 ALA CB 1 1 1 100 1 1 7 ALA H H -1.897 1.847 -4.380 1.00 . A A . 7 ALA H 1 1 1 101 1 1 7 ALA HA H 0.125 0.147 -5.443 1.00 . A A . 7 ALA HA 1 1 1 102 1 1 7 ALA HB1 H -1.242 -1.659 -4.437 1.00 . A A . 7 ALA HB1 1 1 1 103 1 1 7 ALA HB2 H -2.530 -0.486 -4.138 1.00 . A A . 7 ALA HB2 1 1 1 104 1 1 7 ALA HB3 H -0.987 -0.324 -3.307 1.00 . A A . 7 ALA HB3 1 1 1 105 1 1 7 ALA N N -1.276 1.629 -5.109 1.00 . A A . 7 ALA N 1 1 1 106 1 1 7 ALA O O -2.843 -0.124 -6.754 1.00 . A A . 7 ALA O 1 1 1 107 1 1 8 ASP C C -2.006 -1.971 -9.163 1.00 . A A . 8 ASP C 1 1 1 108 1 1 8 ASP CA C -1.369 -0.621 -8.979 1.00 . A A . 8 ASP CA 1 1 1 109 1 1 8 ASP CB C -0.343 -0.350 -10.069 1.00 . A A . 8 ASP CB 1 1 1 110 1 1 8 ASP CG C -0.956 -0.463 -11.436 1.00 . A A . 8 ASP CG 1 1 1 111 1 1 8 ASP H H 0.135 -0.600 -7.496 1.00 . A A . 8 ASP H 1 1 1 112 1 1 8 ASP HA H -2.154 0.115 -9.072 1.00 . A A . 8 ASP HA 1 1 1 113 1 1 8 ASP HB2 H 0.043 0.651 -9.952 1.00 . A A . 8 ASP HB2 1 1 1 114 1 1 8 ASP HB3 H 0.463 -1.063 -9.991 1.00 . A A . 8 ASP HB3 1 1 1 115 1 1 8 ASP N N -0.824 -0.444 -7.656 1.00 . A A . 8 ASP N 1 1 1 116 1 1 8 ASP O O -3.081 -2.082 -9.750 1.00 . A A . 8 ASP O 1 1 1 117 1 1 8 ASP OD1 O -1.905 0.287 -11.734 1.00 . A A . 8 ASP OD1 1 1 1 118 1 1 8 ASP OD2 O -0.497 -1.285 -12.251 1.00 . A A . 8 ASP OD2 1 1 1 119 1 1 9 THR C C -2.992 -4.625 -7.675 1.00 . A A . 9 THR C 1 1 1 120 1 1 9 THR CA C -1.935 -4.321 -8.764 1.00 . A A . 9 THR CA 1 1 1 121 1 1 9 THR CB C -0.787 -5.390 -8.810 1.00 . A A . 9 THR CB 1 1 1 122 1 1 9 THR CG2 C 0.081 -5.319 -7.577 1.00 . A A . 9 THR CG2 1 1 1 123 1 1 9 THR H H -0.584 -2.840 -8.089 1.00 . A A . 9 THR H 1 1 1 124 1 1 9 THR HA H -2.451 -4.330 -9.714 1.00 . A A . 9 THR HA 1 1 1 125 1 1 9 THR HB H -0.178 -5.166 -9.675 1.00 . A A . 9 THR HB 1 1 1 126 1 1 9 THR HG1 H -2.208 -6.727 -8.636 1.00 . A A . 9 THR HG1 1 1 1 127 1 1 9 THR HG21 H -0.519 -5.529 -6.705 1.00 . A A . 9 THR HG21 1 1 1 128 1 1 9 THR HG22 H 0.497 -4.325 -7.495 1.00 . A A . 9 THR HG22 1 1 1 129 1 1 9 THR HG23 H 0.879 -6.040 -7.655 1.00 . A A . 9 THR HG23 1 1 1 130 1 1 9 THR N N -1.405 -2.986 -8.613 1.00 . A A . 9 THR N 1 1 1 131 1 1 9 THR O O -3.423 -5.772 -7.500 1.00 . A A . 9 THR O 1 1 1 132 1 1 9 THR OG1 O -1.300 -6.733 -8.973 1.00 . A A . 9 THR OG1 1 1 1 133 1 1 10 TYR C C -5.764 -3.255 -6.521 1.00 . A A . 10 TYR C 1 1 1 134 1 1 10 TYR CA C -4.436 -3.734 -5.960 1.00 . A A . 10 TYR CA 1 1 1 135 1 1 10 TYR CB C -4.082 -2.941 -4.692 1.00 . A A . 10 TYR CB 1 1 1 136 1 1 10 TYR CD1 C -6.178 -2.559 -3.316 1.00 . A A . 10 TYR CD1 1 1 1 137 1 1 10 TYR CD2 C -4.608 -4.169 -2.547 1.00 . A A . 10 TYR CD2 1 1 1 138 1 1 10 TYR CE1 C -6.983 -2.822 -2.231 1.00 . A A . 10 TYR CE1 1 1 1 139 1 1 10 TYR CE2 C -5.407 -4.438 -1.457 1.00 . A A . 10 TYR CE2 1 1 1 140 1 1 10 TYR CG C -4.977 -3.227 -3.495 1.00 . A A . 10 TYR CG 1 1 1 141 1 1 10 TYR CZ C -6.596 -3.760 -1.305 1.00 . A A . 10 TYR CZ 1 1 1 142 1 1 10 TYR H H -3.038 -2.703 -7.131 1.00 . A A . 10 TYR H 1 1 1 143 1 1 10 TYR HA H -4.513 -4.780 -5.712 1.00 . A A . 10 TYR HA 1 1 1 144 1 1 10 TYR HB2 H -3.069 -3.175 -4.405 1.00 . A A . 10 TYR HB2 1 1 1 145 1 1 10 TYR HB3 H -4.151 -1.886 -4.914 1.00 . A A . 10 TYR HB3 1 1 1 146 1 1 10 TYR HD1 H -6.485 -1.823 -4.044 1.00 . A A . 10 TYR HD1 1 1 1 147 1 1 10 TYR HD2 H -3.674 -4.698 -2.673 1.00 . A A . 10 TYR HD2 1 1 1 148 1 1 10 TYR HE1 H -7.913 -2.283 -2.125 1.00 . A A . 10 TYR HE1 1 1 1 149 1 1 10 TYR HE2 H -5.090 -5.174 -0.733 1.00 . A A . 10 TYR HE2 1 1 1 150 1 1 10 TYR HH H -8.318 -4.068 -0.541 1.00 . A A . 10 TYR HH 1 1 1 151 1 1 10 TYR N N -3.415 -3.592 -6.963 1.00 . A A . 10 TYR N 1 1 1 152 1 1 10 TYR O O -6.018 -2.048 -6.598 1.00 . A A . 10 TYR O 1 1 1 153 1 1 10 TYR OH O -7.403 -4.026 -0.232 1.00 . A A . 10 TYR OH 1 1 1 154 1 1 11 LYS C C -8.897 -4.227 -6.417 1.00 . A A . 11 LYS C 1 1 1 155 1 1 11 LYS CA C -7.888 -3.802 -7.441 1.00 . A A . 11 LYS CA 1 1 1 156 1 1 11 LYS CB C -8.246 -4.397 -8.826 1.00 . A A . 11 LYS CB 1 1 1 157 1 1 11 LYS CD C -6.021 -4.178 -10.051 1.00 . A A . 11 LYS CD 1 1 1 158 1 1 11 LYS CE C -5.335 -3.680 -11.314 1.00 . A A . 11 LYS CE 1 1 1 159 1 1 11 LYS CG C -7.496 -3.821 -10.039 1.00 . A A . 11 LYS CG 1 1 1 160 1 1 11 LYS H H -6.319 -5.114 -6.979 1.00 . A A . 11 LYS H 1 1 1 161 1 1 11 LYS HA H -7.908 -2.723 -7.500 1.00 . A A . 11 LYS HA 1 1 1 162 1 1 11 LYS HB2 H -8.050 -5.457 -8.801 1.00 . A A . 11 LYS HB2 1 1 1 163 1 1 11 LYS HB3 H -9.304 -4.256 -8.987 1.00 . A A . 11 LYS HB3 1 1 1 164 1 1 11 LYS HD2 H -5.544 -3.729 -9.193 1.00 . A A . 11 LYS HD2 1 1 1 165 1 1 11 LYS HD3 H -5.924 -5.252 -9.997 1.00 . A A . 11 LYS HD3 1 1 1 166 1 1 11 LYS HE2 H -4.312 -4.024 -11.302 1.00 . A A . 11 LYS HE2 1 1 1 167 1 1 11 LYS HE3 H -5.839 -4.104 -12.169 1.00 . A A . 11 LYS HE3 1 1 1 168 1 1 11 LYS HG2 H -7.948 -4.203 -10.942 1.00 . A A . 11 LYS HG2 1 1 1 169 1 1 11 LYS HG3 H -7.599 -2.746 -10.020 1.00 . A A . 11 LYS HG3 1 1 1 170 1 1 11 LYS HZ1 H -4.911 -1.917 -12.340 1.00 . A A . 11 LYS HZ1 1 1 1 171 1 1 11 LYS HZ2 H -4.745 -1.766 -10.690 1.00 . A A . 11 LYS HZ2 1 1 1 172 1 1 11 LYS HZ3 H -6.295 -1.792 -11.382 1.00 . A A . 11 LYS HZ3 1 1 1 173 1 1 11 LYS N N -6.577 -4.167 -6.973 1.00 . A A . 11 LYS N 1 1 1 174 1 1 11 LYS NZ N -5.338 -2.195 -11.432 1.00 . A A . 11 LYS NZ 1 1 1 175 1 1 11 LYS O O -8.985 -5.414 -6.070 1.00 . A A . 11 LYS O 1 1 1 176 1 1 12 GLY C C -10.478 -2.658 -3.736 1.00 . A A . 12 GLY C 1 1 1 177 1 1 12 GLY CA C -10.610 -3.568 -4.922 1.00 . A A . 12 GLY CA 1 1 1 178 1 1 12 GLY H H -9.461 -2.347 -6.151 1.00 . A A . 12 GLY H 1 1 1 179 1 1 12 GLY HA2 H -11.581 -3.437 -5.374 1.00 . A A . 12 GLY HA2 1 1 1 180 1 1 12 GLY HA3 H -10.503 -4.591 -4.594 1.00 . A A . 12 GLY HA3 1 1 1 181 1 1 12 GLY N N -9.613 -3.280 -5.897 1.00 . A A . 12 GLY N 1 1 1 182 1 1 12 GLY O O -9.546 -1.853 -3.682 1.00 . A A . 12 GLY O 1 1 1 183 1 1 13 PRO C C -10.479 -2.558 -0.497 1.00 . A A . 13 PRO C 1 1 1 184 1 1 13 PRO CA C -11.349 -1.918 -1.590 1.00 . A A . 13 PRO CA 1 1 1 185 1 1 13 PRO CB C -12.824 -1.860 -1.132 1.00 . A A . 13 PRO CB 1 1 1 186 1 1 13 PRO CD C -12.608 -3.540 -2.817 1.00 . A A . 13 PRO CD 1 1 1 187 1 1 13 PRO CG C -13.596 -2.634 -2.158 1.00 . A A . 13 PRO CG 1 1 1 188 1 1 13 PRO HA H -10.996 -0.917 -1.796 1.00 . A A . 13 PRO HA 1 1 1 189 1 1 13 PRO HB2 H -12.913 -2.308 -0.154 1.00 . A A . 13 PRO HB2 1 1 1 190 1 1 13 PRO HB3 H -13.153 -0.832 -1.089 1.00 . A A . 13 PRO HB3 1 1 1 191 1 1 13 PRO HD2 H -12.488 -4.445 -2.243 1.00 . A A . 13 PRO HD2 1 1 1 192 1 1 13 PRO HD3 H -12.905 -3.762 -3.831 1.00 . A A . 13 PRO HD3 1 1 1 193 1 1 13 PRO HG2 H -14.368 -3.213 -1.673 1.00 . A A . 13 PRO HG2 1 1 1 194 1 1 13 PRO HG3 H -14.031 -1.959 -2.880 1.00 . A A . 13 PRO HG3 1 1 1 195 1 1 13 PRO N N -11.401 -2.723 -2.788 1.00 . A A . 13 PRO N 1 1 1 196 1 1 13 PRO O O -10.209 -3.781 -0.510 1.00 . A A . 13 PRO O 1 1 1 197 1 1 14 CYS C C -10.189 -2.560 2.672 1.00 . A A . 14 CYS C 1 1 1 198 1 1 14 CYS CA C -9.252 -2.182 1.541 1.00 . A A . 14 CYS CA 1 1 1 199 1 1 14 CYS CB C -8.274 -1.097 2.010 1.00 . A A . 14 CYS CB 1 1 1 200 1 1 14 CYS H H -10.136 -0.772 0.270 1.00 . A A . 14 CYS H 1 1 1 201 1 1 14 CYS HA H -8.687 -3.053 1.245 1.00 . A A . 14 CYS HA 1 1 1 202 1 1 14 CYS HB2 H -7.502 -0.968 1.266 1.00 . A A . 14 CYS HB2 1 1 1 203 1 1 14 CYS HB3 H -8.815 -0.170 2.127 1.00 . A A . 14 CYS HB3 1 1 1 204 1 1 14 CYS N N -10.006 -1.736 0.399 1.00 . A A . 14 CYS N 1 1 1 205 1 1 14 CYS O O -10.868 -1.700 3.253 1.00 . A A . 14 CYS O 1 1 1 206 1 1 14 CYS SG S -7.459 -1.479 3.607 1.00 . A A . 14 CYS SG 1 1 1 207 1 1 15 PHE C C -10.230 -4.516 5.281 1.00 . A A . 15 PHE C 1 1 1 208 1 1 15 PHE CA C -11.084 -4.297 4.057 1.00 . A A . 15 PHE CA 1 1 1 209 1 1 15 PHE CB C -11.843 -5.566 3.684 1.00 . A A . 15 PHE CB 1 1 1 210 1 1 15 PHE CD1 C -12.522 -5.837 1.289 1.00 . A A . 15 PHE CD1 1 1 1 211 1 1 15 PHE CD2 C -13.973 -4.652 2.758 1.00 . A A . 15 PHE CD2 1 1 1 212 1 1 15 PHE CE1 C -13.398 -5.621 0.251 1.00 . A A . 15 PHE CE1 1 1 1 213 1 1 15 PHE CE2 C -14.851 -4.435 1.725 1.00 . A A . 15 PHE CE2 1 1 1 214 1 1 15 PHE CG C -12.800 -5.356 2.554 1.00 . A A . 15 PHE CG 1 1 1 215 1 1 15 PHE CZ C -14.564 -4.918 0.471 1.00 . A A . 15 PHE CZ 1 1 1 216 1 1 15 PHE H H -9.771 -4.486 2.414 1.00 . A A . 15 PHE H 1 1 1 217 1 1 15 PHE HA H -11.795 -3.514 4.277 1.00 . A A . 15 PHE HA 1 1 1 218 1 1 15 PHE HB2 H -11.139 -6.331 3.392 1.00 . A A . 15 PHE HB2 1 1 1 219 1 1 15 PHE HB3 H -12.405 -5.906 4.541 1.00 . A A . 15 PHE HB3 1 1 1 220 1 1 15 PHE HD1 H -11.610 -6.389 1.114 1.00 . A A . 15 PHE HD1 1 1 1 221 1 1 15 PHE HD2 H -14.202 -4.272 3.743 1.00 . A A . 15 PHE HD2 1 1 1 222 1 1 15 PHE HE1 H -13.173 -6.001 -0.734 1.00 . A A . 15 PHE HE1 1 1 1 223 1 1 15 PHE HE2 H -15.765 -3.886 1.898 1.00 . A A . 15 PHE HE2 1 1 1 224 1 1 15 PHE HZ H -15.255 -4.746 -0.341 1.00 . A A . 15 PHE HZ 1 1 1 225 1 1 15 PHE N N -10.267 -3.833 2.959 1.00 . A A . 15 PHE N 1 1 1 226 1 1 15 PHE O O -10.714 -4.521 6.407 1.00 . A A . 15 PHE O 1 1 1 227 1 1 16 THR C C -6.720 -4.218 5.743 1.00 . A A . 16 THR C 1 1 1 228 1 1 16 THR CA C -8.031 -4.895 6.131 1.00 . A A . 16 THR CA 1 1 1 229 1 1 16 THR CB C -7.818 -6.387 6.460 1.00 . A A . 16 THR CB 1 1 1 230 1 1 16 THR CG2 C -6.944 -6.556 7.696 1.00 . A A . 16 THR CG2 1 1 1 231 1 1 16 THR H H -8.633 -4.830 4.142 1.00 . A A . 16 THR H 1 1 1 232 1 1 16 THR HA H -8.439 -4.396 6.998 1.00 . A A . 16 THR HA 1 1 1 233 1 1 16 THR HB H -7.348 -6.858 5.611 1.00 . A A . 16 THR HB 1 1 1 234 1 1 16 THR HG1 H -9.729 -6.251 6.809 1.00 . A A . 16 THR HG1 1 1 1 235 1 1 16 THR HG21 H -5.973 -6.122 7.512 1.00 . A A . 16 THR HG21 1 1 1 236 1 1 16 THR HG22 H -6.837 -7.606 7.924 1.00 . A A . 16 THR HG22 1 1 1 237 1 1 16 THR HG23 H -7.408 -6.056 8.533 1.00 . A A . 16 THR HG23 1 1 1 238 1 1 16 THR N N -8.967 -4.747 5.062 1.00 . A A . 16 THR N 1 1 1 239 1 1 16 THR O O -6.118 -4.559 4.709 1.00 . A A . 16 THR O 1 1 1 240 1 1 16 THR OG1 O -9.106 -6.983 6.717 1.00 . A A . 16 THR OG1 1 1 1 241 1 1 17 THR C C -3.871 -3.453 6.245 1.00 . A A . 17 THR C 1 1 1 242 1 1 17 THR CA C -5.075 -2.515 6.291 1.00 . A A . 17 THR CA 1 1 1 243 1 1 17 THR CB C -4.851 -1.417 7.355 1.00 . A A . 17 THR CB 1 1 1 244 1 1 17 THR CG2 C -3.665 -0.529 6.983 1.00 . A A . 17 THR CG2 1 1 1 245 1 1 17 THR H H -6.816 -3.036 7.347 1.00 . A A . 17 THR H 1 1 1 246 1 1 17 THR HA H -5.180 -2.044 5.325 1.00 . A A . 17 THR HA 1 1 1 247 1 1 17 THR HB H -4.662 -1.886 8.308 1.00 . A A . 17 THR HB 1 1 1 248 1 1 17 THR HG1 H -5.907 0.159 6.870 1.00 . A A . 17 THR HG1 1 1 1 249 1 1 17 THR HG21 H -3.522 0.225 7.743 1.00 . A A . 17 THR HG21 1 1 1 250 1 1 17 THR HG22 H -3.856 -0.052 6.033 1.00 . A A . 17 THR HG22 1 1 1 251 1 1 17 THR HG23 H -2.774 -1.135 6.902 1.00 . A A . 17 THR HG23 1 1 1 252 1 1 17 THR N N -6.295 -3.259 6.548 1.00 . A A . 17 THR N 1 1 1 253 1 1 17 THR O O -2.982 -3.259 5.449 1.00 . A A . 17 THR O 1 1 1 254 1 1 17 THR OG1 O -6.039 -0.601 7.454 1.00 . A A . 17 THR OG1 1 1 1 255 1 1 18 GLY C C -2.607 -6.115 5.727 1.00 . A A . 18 GLY C 1 1 1 256 1 1 18 GLY CA C -2.831 -5.485 7.093 1.00 . A A . 18 GLY CA 1 1 1 257 1 1 18 GLY H H -4.638 -4.567 7.713 1.00 . A A . 18 GLY H 1 1 1 258 1 1 18 GLY HA2 H -1.916 -5.012 7.417 1.00 . A A . 18 GLY HA2 1 1 1 259 1 1 18 GLY HA3 H -3.095 -6.260 7.796 1.00 . A A . 18 GLY HA3 1 1 1 260 1 1 18 GLY N N -3.894 -4.495 7.076 1.00 . A A . 18 GLY N 1 1 1 261 1 1 18 GLY O O -1.461 -6.259 5.285 1.00 . A A . 18 GLY O 1 1 1 262 1 1 19 SER C C -3.066 -6.005 2.734 1.00 . A A . 19 SER C 1 1 1 263 1 1 19 SER CA C -3.653 -7.023 3.724 1.00 . A A . 19 SER CA 1 1 1 264 1 1 19 SER CB C -5.075 -7.418 3.316 1.00 . A A . 19 SER CB 1 1 1 265 1 1 19 SER H H -4.580 -6.294 5.447 1.00 . A A . 19 SER H 1 1 1 266 1 1 19 SER HA H -3.032 -7.905 3.752 1.00 . A A . 19 SER HA 1 1 1 267 1 1 19 SER HB2 H -5.660 -6.528 3.144 1.00 . A A . 19 SER HB2 1 1 1 268 1 1 19 SER HB3 H -5.042 -8.013 2.415 1.00 . A A . 19 SER HB3 1 1 1 269 1 1 19 SER HG H -5.028 -8.832 4.632 1.00 . A A . 19 SER HG 1 1 1 270 1 1 19 SER N N -3.698 -6.442 5.048 1.00 . A A . 19 SER N 1 1 1 271 1 1 19 SER O O -2.172 -6.322 1.956 1.00 . A A . 19 SER O 1 1 1 272 1 1 19 SER OG O -5.686 -8.184 4.351 1.00 . A A . 19 SER OG 1 1 1 273 1 1 20 CYS C C -1.580 -3.406 2.211 1.00 . A A . 20 CYS C 1 1 1 274 1 1 20 CYS CA C -3.077 -3.683 1.971 1.00 . A A . 20 CYS CA 1 1 1 275 1 1 20 CYS CB C -3.906 -2.445 2.293 1.00 . A A . 20 CYS CB 1 1 1 276 1 1 20 CYS H H -4.238 -4.590 3.485 1.00 . A A . 20 CYS H 1 1 1 277 1 1 20 CYS HA H -3.234 -3.955 0.938 1.00 . A A . 20 CYS HA 1 1 1 278 1 1 20 CYS HB2 H -4.939 -2.643 2.053 1.00 . A A . 20 CYS HB2 1 1 1 279 1 1 20 CYS HB3 H -3.827 -2.244 3.351 1.00 . A A . 20 CYS HB3 1 1 1 280 1 1 20 CYS N N -3.539 -4.781 2.821 1.00 . A A . 20 CYS N 1 1 1 281 1 1 20 CYS O O -0.786 -3.247 1.273 1.00 . A A . 20 CYS O 1 1 1 282 1 1 20 CYS SG S -3.431 -0.948 1.409 1.00 . A A . 20 CYS SG 1 1 1 283 1 1 21 ASP C C 1.062 -4.255 3.361 1.00 . A A . 21 ASP C 1 1 1 284 1 1 21 ASP CA C 0.148 -3.197 3.939 1.00 . A A . 21 ASP CA 1 1 1 285 1 1 21 ASP CB C 0.149 -3.273 5.468 1.00 . A A . 21 ASP CB 1 1 1 286 1 1 21 ASP CG C 1.498 -3.091 6.089 1.00 . A A . 21 ASP CG 1 1 1 287 1 1 21 ASP H H -1.905 -3.569 4.153 1.00 . A A . 21 ASP H 1 1 1 288 1 1 21 ASP HA H 0.477 -2.214 3.636 1.00 . A A . 21 ASP HA 1 1 1 289 1 1 21 ASP HB2 H -0.506 -2.509 5.857 1.00 . A A . 21 ASP HB2 1 1 1 290 1 1 21 ASP HB3 H -0.237 -4.238 5.761 1.00 . A A . 21 ASP HB3 1 1 1 291 1 1 21 ASP N N -1.211 -3.415 3.473 1.00 . A A . 21 ASP N 1 1 1 292 1 1 21 ASP O O 2.120 -3.953 2.804 1.00 . A A . 21 ASP O 1 1 1 293 1 1 21 ASP OD1 O 1.965 -1.942 6.178 1.00 . A A . 21 ASP OD1 1 1 1 294 1 1 21 ASP OD2 O 2.097 -4.101 6.546 1.00 . A A . 21 ASP OD2 1 1 1 295 1 1 22 ASP C C 1.480 -6.535 1.415 1.00 . A A . 22 ASP C 1 1 1 296 1 1 22 ASP CA C 1.304 -6.657 2.919 1.00 . A A . 22 ASP CA 1 1 1 297 1 1 22 ASP CB C 0.494 -7.921 3.237 1.00 . A A . 22 ASP CB 1 1 1 298 1 1 22 ASP CG C 1.057 -9.186 2.620 1.00 . A A . 22 ASP CG 1 1 1 299 1 1 22 ASP H H -0.262 -5.622 3.896 1.00 . A A . 22 ASP H 1 1 1 300 1 1 22 ASP HA H 2.270 -6.734 3.394 1.00 . A A . 22 ASP HA 1 1 1 301 1 1 22 ASP HB2 H 0.431 -8.044 4.307 1.00 . A A . 22 ASP HB2 1 1 1 302 1 1 22 ASP HB3 H -0.505 -7.774 2.854 1.00 . A A . 22 ASP HB3 1 1 1 303 1 1 22 ASP N N 0.602 -5.487 3.449 1.00 . A A . 22 ASP N 1 1 1 304 1 1 22 ASP O O 2.552 -6.825 0.872 1.00 . A A . 22 ASP O 1 1 1 305 1 1 22 ASP OD1 O 0.683 -9.512 1.468 1.00 . A A . 22 ASP OD1 1 1 1 306 1 1 22 ASP OD2 O 1.857 -9.884 3.281 1.00 . A A . 22 ASP OD2 1 1 1 307 1 1 23 HIS C C 1.429 -4.916 -1.157 1.00 . A A . 23 HIS C 1 1 1 308 1 1 23 HIS CA C 0.395 -5.932 -0.673 1.00 . A A . 23 HIS CA 1 1 1 309 1 1 23 HIS CB C -1.019 -5.528 -1.110 1.00 . A A . 23 HIS CB 1 1 1 310 1 1 23 HIS CD2 C -1.013 -4.507 -3.477 1.00 . A A . 23 HIS CD2 1 1 1 311 1 1 23 HIS CE1 C -1.814 -6.185 -4.573 1.00 . A A . 23 HIS CE1 1 1 1 312 1 1 23 HIS CG C -1.228 -5.500 -2.585 1.00 . A A . 23 HIS CG 1 1 1 313 1 1 23 HIS H H -0.360 -5.788 1.271 1.00 . A A . 23 HIS H 1 1 1 314 1 1 23 HIS HA H 0.626 -6.894 -1.105 1.00 . A A . 23 HIS HA 1 1 1 315 1 1 23 HIS HB2 H -1.732 -6.224 -0.694 1.00 . A A . 23 HIS HB2 1 1 1 316 1 1 23 HIS HB3 H -1.231 -4.542 -0.723 1.00 . A A . 23 HIS HB3 1 1 1 317 1 1 23 HIS HD1 H -1.959 -7.447 -2.954 1.00 . A A . 23 HIS HD1 1 1 1 318 1 1 23 HIS HD2 H -0.616 -3.528 -3.249 1.00 . A A . 23 HIS HD2 1 1 1 319 1 1 23 HIS HE1 H -2.186 -6.815 -5.370 1.00 . A A . 23 HIS HE1 1 1 1 320 1 1 23 HIS N N 0.437 -6.064 0.765 1.00 . A A . 23 HIS N 1 1 1 321 1 1 23 HIS ND1 N -1.734 -6.555 -3.302 1.00 . A A . 23 HIS ND1 1 1 1 322 1 1 23 HIS NE2 N -1.384 -4.946 -4.736 1.00 . A A . 23 HIS NE2 1 1 1 323 1 1 23 HIS O O 2.196 -5.191 -2.078 1.00 . A A . 23 HIS O 1 1 1 324 1 1 24 CYS C C 3.862 -3.181 -0.705 1.00 . A A . 24 CYS C 1 1 1 325 1 1 24 CYS CA C 2.415 -2.731 -0.910 1.00 . A A . 24 CYS CA 1 1 1 326 1 1 24 CYS CB C 2.144 -1.433 -0.165 1.00 . A A . 24 CYS CB 1 1 1 327 1 1 24 CYS H H 0.826 -3.587 0.197 1.00 . A A . 24 CYS H 1 1 1 328 1 1 24 CYS HA H 2.267 -2.558 -1.966 1.00 . A A . 24 CYS HA 1 1 1 329 1 1 24 CYS HB2 H 2.171 -1.628 0.897 1.00 . A A . 24 CYS HB2 1 1 1 330 1 1 24 CYS HB3 H 2.915 -0.719 -0.413 1.00 . A A . 24 CYS HB3 1 1 1 331 1 1 24 CYS N N 1.469 -3.764 -0.527 1.00 . A A . 24 CYS N 1 1 1 332 1 1 24 CYS O O 4.743 -2.828 -1.482 1.00 . A A . 24 CYS O 1 1 1 333 1 1 24 CYS SG S 0.530 -0.677 -0.544 1.00 . A A . 24 CYS SG 1 1 1 334 1 1 25 LYS C C 5.839 -5.591 -0.366 1.00 . A A . 25 LYS C 1 1 1 335 1 1 25 LYS CA C 5.424 -4.487 0.603 1.00 . A A . 25 LYS CA 1 1 1 336 1 1 25 LYS CB C 5.489 -4.984 2.041 1.00 . A A . 25 LYS CB 1 1 1 337 1 1 25 LYS CD C 5.172 -4.429 4.459 1.00 . A A . 25 LYS CD 1 1 1 338 1 1 25 LYS CE C 5.088 -3.308 5.472 1.00 . A A . 25 LYS CE 1 1 1 339 1 1 25 LYS CG C 5.333 -3.880 3.061 1.00 . A A . 25 LYS CG 1 1 1 340 1 1 25 LYS H H 3.344 -4.253 0.887 1.00 . A A . 25 LYS H 1 1 1 341 1 1 25 LYS HA H 6.112 -3.661 0.497 1.00 . A A . 25 LYS HA 1 1 1 342 1 1 25 LYS HB2 H 4.701 -5.706 2.195 1.00 . A A . 25 LYS HB2 1 1 1 343 1 1 25 LYS HB3 H 6.442 -5.464 2.202 1.00 . A A . 25 LYS HB3 1 1 1 344 1 1 25 LYS HD2 H 4.260 -5.006 4.502 1.00 . A A . 25 LYS HD2 1 1 1 345 1 1 25 LYS HD3 H 6.016 -5.060 4.695 1.00 . A A . 25 LYS HD3 1 1 1 346 1 1 25 LYS HE2 H 6.038 -2.798 5.512 1.00 . A A . 25 LYS HE2 1 1 1 347 1 1 25 LYS HE3 H 4.327 -2.613 5.150 1.00 . A A . 25 LYS HE3 1 1 1 348 1 1 25 LYS HG2 H 6.208 -3.248 3.033 1.00 . A A . 25 LYS HG2 1 1 1 349 1 1 25 LYS HG3 H 4.459 -3.297 2.808 1.00 . A A . 25 LYS HG3 1 1 1 350 1 1 25 LYS HZ1 H 3.764 -4.161 6.773 1.00 . A A . 25 LYS HZ1 1 1 1 351 1 1 25 LYS HZ2 H 4.770 -3.036 7.514 1.00 . A A . 25 LYS HZ2 1 1 1 352 1 1 25 LYS HZ3 H 5.366 -4.579 7.108 1.00 . A A . 25 LYS HZ3 1 1 1 353 1 1 25 LYS N N 4.092 -3.986 0.310 1.00 . A A . 25 LYS N 1 1 1 354 1 1 25 LYS NZ N 4.743 -3.801 6.811 1.00 . A A . 25 LYS NZ 1 1 1 355 1 1 25 LYS O O 6.935 -5.564 -0.910 1.00 . A A . 25 LYS O 1 1 1 356 1 1 26 ASN C C 5.094 -7.383 -2.938 1.00 . A A . 26 ASN C 1 1 1 357 1 1 26 ASN CA C 5.282 -7.674 -1.462 1.00 . A A . 26 ASN CA 1 1 1 358 1 1 26 ASN CB C 4.494 -8.940 -1.079 1.00 . A A . 26 ASN CB 1 1 1 359 1 1 26 ASN CG C 4.877 -9.516 0.273 1.00 . A A . 26 ASN CG 1 1 1 360 1 1 26 ASN H H 4.063 -6.467 -0.191 1.00 . A A . 26 ASN H 1 1 1 361 1 1 26 ASN HA H 6.331 -7.880 -1.304 1.00 . A A . 26 ASN HA 1 1 1 362 1 1 26 ASN HB2 H 3.444 -8.693 -1.048 1.00 . A A . 26 ASN HB2 1 1 1 363 1 1 26 ASN HB3 H 4.656 -9.695 -1.834 1.00 . A A . 26 ASN HB3 1 1 1 364 1 1 26 ASN HD21 H 3.459 -8.472 1.156 1.00 . A A . 26 ASN HD21 1 1 1 365 1 1 26 ASN HD22 H 4.404 -9.477 2.186 1.00 . A A . 26 ASN HD22 1 1 1 366 1 1 26 ASN N N 4.953 -6.534 -0.606 1.00 . A A . 26 ASN N 1 1 1 367 1 1 26 ASN ND2 N 4.187 -9.117 1.300 1.00 . A A . 26 ASN ND2 1 1 1 368 1 1 26 ASN O O 6.015 -7.561 -3.726 1.00 . A A . 26 ASN O 1 1 1 369 1 1 26 ASN OD1 O 5.790 -10.339 0.378 1.00 . A A . 26 ASN OD1 1 1 1 370 1 1 27 LYS C C 4.180 -5.447 -5.287 1.00 . A A . 27 LYS C 1 1 1 371 1 1 27 LYS CA C 3.586 -6.726 -4.718 1.00 . A A . 27 LYS CA 1 1 1 372 1 1 27 LYS CB C 2.070 -6.717 -4.901 1.00 . A A . 27 LYS CB 1 1 1 373 1 1 27 LYS CD C 1.769 -9.216 -5.137 1.00 . A A . 27 LYS CD 1 1 1 374 1 1 27 LYS CE C 0.960 -10.419 -4.673 1.00 . A A . 27 LYS CE 1 1 1 375 1 1 27 LYS CG C 1.347 -7.961 -4.396 1.00 . A A . 27 LYS CG 1 1 1 376 1 1 27 LYS H H 3.266 -6.636 -2.634 1.00 . A A . 27 LYS H 1 1 1 377 1 1 27 LYS HA H 3.989 -7.563 -5.267 1.00 . A A . 27 LYS HA 1 1 1 378 1 1 27 LYS HB2 H 1.665 -5.863 -4.379 1.00 . A A . 27 LYS HB2 1 1 1 379 1 1 27 LYS HB3 H 1.858 -6.609 -5.954 1.00 . A A . 27 LYS HB3 1 1 1 380 1 1 27 LYS HD2 H 1.619 -9.070 -6.196 1.00 . A A . 27 LYS HD2 1 1 1 381 1 1 27 LYS HD3 H 2.816 -9.404 -4.942 1.00 . A A . 27 LYS HD3 1 1 1 382 1 1 27 LYS HE2 H 1.117 -10.564 -3.616 1.00 . A A . 27 LYS HE2 1 1 1 383 1 1 27 LYS HE3 H -0.086 -10.218 -4.854 1.00 . A A . 27 LYS HE3 1 1 1 384 1 1 27 LYS HG2 H 1.575 -8.086 -3.348 1.00 . A A . 27 LYS HG2 1 1 1 385 1 1 27 LYS HG3 H 0.283 -7.819 -4.516 1.00 . A A . 27 LYS HG3 1 1 1 386 1 1 27 LYS HZ1 H 2.346 -11.862 -5.225 1.00 . A A . 27 LYS HZ1 1 1 1 387 1 1 27 LYS HZ2 H 1.209 -11.535 -6.411 1.00 . A A . 27 LYS HZ2 1 1 1 388 1 1 27 LYS HZ3 H 0.776 -12.458 -5.060 1.00 . A A . 27 LYS HZ3 1 1 1 389 1 1 27 LYS N N 3.929 -6.906 -3.308 1.00 . A A . 27 LYS N 1 1 1 390 1 1 27 LYS NZ N 1.341 -11.650 -5.386 1.00 . A A . 27 LYS NZ 1 1 1 391 1 1 27 LYS O O 4.838 -5.469 -6.326 1.00 . A A . 27 LYS O 1 1 1 392 1 1 28 GLU C C 5.961 -2.891 -4.733 1.00 . A A . 28 GLU C 1 1 1 393 1 1 28 GLU CA C 4.483 -3.056 -5.076 1.00 . A A . 28 GLU CA 1 1 1 394 1 1 28 GLU CB C 3.665 -1.884 -4.530 1.00 . A A . 28 GLU CB 1 1 1 395 1 1 28 GLU CD C 2.099 -1.586 -6.528 1.00 . A A . 28 GLU CD 1 1 1 396 1 1 28 GLU CG C 2.220 -1.818 -5.025 1.00 . A A . 28 GLU CG 1 1 1 397 1 1 28 GLU H H 3.441 -4.389 -3.774 1.00 . A A . 28 GLU H 1 1 1 398 1 1 28 GLU HA H 4.396 -3.068 -6.153 1.00 . A A . 28 GLU HA 1 1 1 399 1 1 28 GLU HB2 H 3.652 -1.944 -3.452 1.00 . A A . 28 GLU HB2 1 1 1 400 1 1 28 GLU HB3 H 4.159 -0.965 -4.815 1.00 . A A . 28 GLU HB3 1 1 1 401 1 1 28 GLU HG2 H 1.732 -2.752 -4.787 1.00 . A A . 28 GLU HG2 1 1 1 402 1 1 28 GLU HG3 H 1.717 -1.014 -4.508 1.00 . A A . 28 GLU HG3 1 1 1 403 1 1 28 GLU N N 3.969 -4.338 -4.601 1.00 . A A . 28 GLU N 1 1 1 404 1 1 28 GLU O O 6.639 -2.035 -5.305 1.00 . A A . 28 GLU O 1 1 1 405 1 1 28 GLU OE1 O 1.374 -2.338 -7.208 1.00 . A A . 28 GLU OE1 1 1 1 406 1 1 28 GLU OE2 O 2.720 -0.624 -7.057 1.00 . A A . 28 GLU OE2 1 1 1 407 1 1 29 HIS C C 8.240 -2.419 -2.645 1.00 . A A . 29 HIS C 1 1 1 408 1 1 29 HIS CA C 7.863 -3.748 -3.362 1.00 . A A . 29 HIS CA 1 1 1 409 1 1 29 HIS CB C 8.758 -4.056 -4.611 1.00 . A A . 29 HIS CB 1 1 1 410 1 1 29 HIS CD2 C 11.270 -3.427 -4.612 1.00 . A A . 29 HIS CD2 1 1 1 411 1 1 29 HIS CE1 C 12.102 -5.225 -3.738 1.00 . A A . 29 HIS CE1 1 1 1 412 1 1 29 HIS CG C 10.230 -4.253 -4.355 1.00 . A A . 29 HIS CG 1 1 1 413 1 1 29 HIS H H 5.811 -4.333 -3.359 1.00 . A A . 29 HIS H 1 1 1 414 1 1 29 HIS HA H 7.961 -4.550 -2.644 1.00 . A A . 29 HIS HA 1 1 1 415 1 1 29 HIS HB2 H 8.398 -4.959 -5.081 1.00 . A A . 29 HIS HB2 1 1 1 416 1 1 29 HIS HB3 H 8.648 -3.242 -5.313 1.00 . A A . 29 HIS HB3 1 1 1 417 1 1 29 HIS HD1 H 10.279 -6.185 -3.503 1.00 . A A . 29 HIS HD1 1 1 1 418 1 1 29 HIS HD2 H 11.196 -2.445 -5.056 1.00 . A A . 29 HIS HD2 1 1 1 419 1 1 29 HIS HE1 H 12.792 -5.960 -3.349 1.00 . A A . 29 HIS HE1 1 1 1 420 1 1 29 HIS N N 6.443 -3.719 -3.785 1.00 . A A . 29 HIS N 1 1 1 421 1 1 29 HIS ND1 N 10.774 -5.388 -3.802 1.00 . A A . 29 HIS ND1 1 1 1 422 1 1 29 HIS NE2 N 12.455 -4.043 -4.219 1.00 . A A . 29 HIS NE2 1 1 1 423 1 1 29 HIS O O 9.395 -1.973 -2.640 1.00 . A A . 29 HIS O 1 1 1 424 1 1 30 LEU C C 7.560 -0.725 0.207 1.00 . A A . 30 LEU C 1 1 1 425 1 1 30 LEU CA C 7.448 -0.566 -1.311 1.00 . A A . 30 LEU CA 1 1 1 426 1 1 30 LEU CB C 6.310 0.385 -1.684 1.00 . A A . 30 LEU CB 1 1 1 427 1 1 30 LEU CD1 C 5.054 1.669 -3.427 1.00 . A A . 30 LEU CD1 1 1 1 428 1 1 30 LEU CD2 C 7.500 1.279 -3.707 1.00 . A A . 30 LEU CD2 1 1 1 429 1 1 30 LEU CG C 6.195 0.713 -3.174 1.00 . A A . 30 LEU CG 1 1 1 430 1 1 30 LEU H H 6.397 -2.290 -1.918 1.00 . A A . 30 LEU H 1 1 1 431 1 1 30 LEU HA H 8.375 -0.143 -1.669 1.00 . A A . 30 LEU HA 1 1 1 432 1 1 30 LEU HB2 H 5.381 -0.061 -1.361 1.00 . A A . 30 LEU HB2 1 1 1 433 1 1 30 LEU HB3 H 6.449 1.312 -1.147 1.00 . A A . 30 LEU HB3 1 1 1 434 1 1 30 LEU HD11 H 5.019 1.927 -4.474 1.00 . A A . 30 LEU HD11 1 1 1 435 1 1 30 LEU HD12 H 5.178 2.562 -2.831 1.00 . A A . 30 LEU HD12 1 1 1 436 1 1 30 LEU HD13 H 4.129 1.185 -3.151 1.00 . A A . 30 LEU HD13 1 1 1 437 1 1 30 LEU HD21 H 8.276 0.532 -3.647 1.00 . A A . 30 LEU HD21 1 1 1 438 1 1 30 LEU HD22 H 7.784 2.134 -3.114 1.00 . A A . 30 LEU HD22 1 1 1 439 1 1 30 LEU HD23 H 7.366 1.582 -4.734 1.00 . A A . 30 LEU HD23 1 1 1 440 1 1 30 LEU HG H 5.980 -0.199 -3.710 1.00 . A A . 30 LEU HG 1 1 1 441 1 1 30 LEU N N 7.269 -1.840 -1.980 1.00 . A A . 30 LEU N 1 1 1 442 1 1 30 LEU O O 7.655 -1.847 0.721 1.00 . A A . 30 LEU O 1 1 1 443 1 1 31 ARG C C 6.517 -0.093 3.110 1.00 . A A . 31 ARG C 1 1 1 444 1 1 31 ARG CA C 7.729 0.442 2.347 1.00 . A A . 31 ARG CA 1 1 1 445 1 1 31 ARG CB C 8.077 1.870 2.806 1.00 . A A . 31 ARG CB 1 1 1 446 1 1 31 ARG CD C 8.489 3.477 4.691 1.00 . A A . 31 ARG CD 1 1 1 447 1 1 31 ARG CG C 8.103 2.061 4.313 1.00 . A A . 31 ARG CG 1 1 1 448 1 1 31 ARG CZ C 9.218 4.555 6.822 1.00 . A A . 31 ARG CZ 1 1 1 449 1 1 31 ARG H H 7.419 1.251 0.436 1.00 . A A . 31 ARG H 1 1 1 450 1 1 31 ARG HA H 8.576 -0.190 2.572 1.00 . A A . 31 ARG HA 1 1 1 451 1 1 31 ARG HB2 H 9.049 2.133 2.419 1.00 . A A . 31 ARG HB2 1 1 1 452 1 1 31 ARG HB3 H 7.343 2.547 2.392 1.00 . A A . 31 ARG HB3 1 1 1 453 1 1 31 ARG HD2 H 9.479 3.691 4.317 1.00 . A A . 31 ARG HD2 1 1 1 454 1 1 31 ARG HD3 H 7.786 4.157 4.233 1.00 . A A . 31 ARG HD3 1 1 1 455 1 1 31 ARG HE H 7.790 3.141 6.623 1.00 . A A . 31 ARG HE 1 1 1 456 1 1 31 ARG HG2 H 7.115 1.855 4.700 1.00 . A A . 31 ARG HG2 1 1 1 457 1 1 31 ARG HG3 H 8.805 1.367 4.745 1.00 . A A . 31 ARG HG3 1 1 1 458 1 1 31 ARG HH11 H 10.491 5.050 5.262 1.00 . A A . 31 ARG HH11 1 1 1 459 1 1 31 ARG HH12 H 10.795 5.842 6.734 1.00 . A A . 31 ARG HH12 1 1 1 460 1 1 31 ARG HH21 H 8.305 4.252 8.637 1.00 . A A . 31 ARG HH21 1 1 1 461 1 1 31 ARG HH22 H 9.571 5.394 8.636 1.00 . A A . 31 ARG HH22 1 1 1 462 1 1 31 ARG N N 7.552 0.402 0.908 1.00 . A A . 31 ARG N 1 1 1 463 1 1 31 ARG NE N 8.459 3.681 6.143 1.00 . A A . 31 ARG NE 1 1 1 464 1 1 31 ARG NH1 N 10.228 5.186 6.224 1.00 . A A . 31 ARG NH1 1 1 1 465 1 1 31 ARG NH2 N 9.012 4.743 8.119 1.00 . A A . 31 ARG NH2 1 1 1 466 1 1 31 ARG O O 6.646 -1.010 3.918 1.00 . A A . 31 ARG O 1 1 1 467 1 1 32 SER C C 2.918 0.496 2.789 1.00 . A A . 32 SER C 1 1 1 468 1 1 32 SER CA C 4.139 0.105 3.607 1.00 . A A . 32 SER CA 1 1 1 469 1 1 32 SER CB C 4.093 0.804 4.979 1.00 . A A . 32 SER CB 1 1 1 470 1 1 32 SER H H 5.283 1.204 2.211 1.00 . A A . 32 SER H 1 1 1 471 1 1 32 SER HA H 4.151 -0.964 3.751 1.00 . A A . 32 SER HA 1 1 1 472 1 1 32 SER HB2 H 4.037 1.873 4.836 1.00 . A A . 32 SER HB2 1 1 1 473 1 1 32 SER HB3 H 3.224 0.468 5.523 1.00 . A A . 32 SER HB3 1 1 1 474 1 1 32 SER HG H 5.727 -0.197 5.272 1.00 . A A . 32 SER HG 1 1 1 475 1 1 32 SER N N 5.357 0.493 2.889 1.00 . A A . 32 SER N 1 1 1 476 1 1 32 SER O O 3.064 1.064 1.711 1.00 . A A . 32 SER O 1 1 1 477 1 1 32 SER OG O 5.256 0.507 5.740 1.00 . A A . 32 SER OG 1 1 1 478 1 1 33 GLY C C -0.521 1.058 3.537 1.00 . A A . 33 GLY C 1 1 1 479 1 1 33 GLY CA C 0.522 0.547 2.593 1.00 . A A . 33 GLY CA 1 1 1 480 1 1 33 GLY H H 1.650 -0.274 4.149 1.00 . A A . 33 GLY H 1 1 1 481 1 1 33 GLY HA2 H 0.746 1.322 1.876 1.00 . A A . 33 GLY HA2 1 1 1 482 1 1 33 GLY HA3 H 0.137 -0.319 2.077 1.00 . A A . 33 GLY HA3 1 1 1 483 1 1 33 GLY N N 1.736 0.195 3.289 1.00 . A A . 33 GLY N 1 1 1 484 1 1 33 GLY O O -0.696 0.500 4.623 1.00 . A A . 33 GLY O 1 1 1 485 1 1 34 ARG C C -3.478 2.846 3.164 1.00 . A A . 34 ARG C 1 1 1 486 1 1 34 ARG CA C -2.214 2.713 3.986 1.00 . A A . 34 ARG CA 1 1 1 487 1 1 34 ARG CB C -1.797 4.085 4.516 1.00 . A A . 34 ARG CB 1 1 1 488 1 1 34 ARG CD C -0.227 5.467 5.885 1.00 . A A . 34 ARG CD 1 1 1 489 1 1 34 ARG CG C -0.484 4.103 5.282 1.00 . A A . 34 ARG CG 1 1 1 490 1 1 34 ARG CZ C -0.808 7.753 5.089 1.00 . A A . 34 ARG CZ 1 1 1 491 1 1 34 ARG H H -0.992 2.551 2.293 1.00 . A A . 34 ARG H 1 1 1 492 1 1 34 ARG HA H -2.398 2.048 4.817 1.00 . A A . 34 ARG HA 1 1 1 493 1 1 34 ARG HB2 H -1.697 4.759 3.679 1.00 . A A . 34 ARG HB2 1 1 1 494 1 1 34 ARG HB3 H -2.575 4.455 5.168 1.00 . A A . 34 ARG HB3 1 1 1 495 1 1 34 ARG HD2 H -0.978 5.660 6.638 1.00 . A A . 34 ARG HD2 1 1 1 496 1 1 34 ARG HD3 H 0.749 5.461 6.347 1.00 . A A . 34 ARG HD3 1 1 1 497 1 1 34 ARG HE H 0.117 6.347 3.992 1.00 . A A . 34 ARG HE 1 1 1 498 1 1 34 ARG HG2 H -0.526 3.368 6.072 1.00 . A A . 34 ARG HG2 1 1 1 499 1 1 34 ARG HG3 H 0.322 3.859 4.604 1.00 . A A . 34 ARG HG3 1 1 1 500 1 1 34 ARG HH11 H -1.294 7.467 7.063 1.00 . A A . 34 ARG HH11 1 1 1 501 1 1 34 ARG HH12 H -1.708 8.997 6.407 1.00 . A A . 34 ARG HH12 1 1 1 502 1 1 34 ARG HH21 H -0.497 8.408 3.181 1.00 . A A . 34 ARG HH21 1 1 1 503 1 1 34 ARG HH22 H -1.221 9.551 4.245 1.00 . A A . 34 ARG HH22 1 1 1 504 1 1 34 ARG N N -1.179 2.130 3.165 1.00 . A A . 34 ARG N 1 1 1 505 1 1 34 ARG NE N -0.271 6.543 4.885 1.00 . A A . 34 ARG NE 1 1 1 506 1 1 34 ARG NH1 N -1.301 8.086 6.278 1.00 . A A . 34 ARG NH1 1 1 1 507 1 1 34 ARG NH2 N -0.852 8.627 4.103 1.00 . A A . 34 ARG NH2 1 1 1 508 1 1 34 ARG O O -3.428 3.227 1.978 1.00 . A A . 34 ARG O 1 1 1 509 1 1 35 CYS C C -6.512 3.941 3.263 1.00 . A A . 35 CYS C 1 1 1 510 1 1 35 CYS CA C -5.849 2.586 3.084 1.00 . A A . 35 CYS CA 1 1 1 511 1 1 35 CYS CB C -6.749 1.497 3.643 1.00 . A A . 35 CYS CB 1 1 1 512 1 1 35 CYS H H -4.589 2.321 4.721 1.00 . A A . 35 CYS H 1 1 1 513 1 1 35 CYS HA H -5.682 2.393 2.034 1.00 . A A . 35 CYS HA 1 1 1 514 1 1 35 CYS HB2 H -7.070 1.781 4.635 1.00 . A A . 35 CYS HB2 1 1 1 515 1 1 35 CYS HB3 H -7.613 1.398 3.004 1.00 . A A . 35 CYS HB3 1 1 1 516 1 1 35 CYS N N -4.588 2.558 3.768 1.00 . A A . 35 CYS N 1 1 1 517 1 1 35 CYS O O -6.489 4.516 4.354 1.00 . A A . 35 CYS O 1 1 1 518 1 1 35 CYS SG S -5.948 -0.138 3.756 1.00 . A A . 35 CYS SG 1 1 1 519 1 1 36 ARG C C -9.243 5.518 2.549 1.00 . A A . 36 ARG C 1 1 1 520 1 1 36 ARG CA C -7.771 5.719 2.211 1.00 . A A . 36 ARG CA 1 1 1 521 1 1 36 ARG CB C -7.655 6.371 0.853 1.00 . A A . 36 ARG CB 1 1 1 522 1 1 36 ARG CD C -6.886 8.644 1.435 1.00 . A A . 36 ARG CD 1 1 1 523 1 1 36 ARG CG C -6.534 7.374 0.713 1.00 . A A . 36 ARG CG 1 1 1 524 1 1 36 ARG CZ C -9.055 9.810 1.718 1.00 . A A . 36 ARG CZ 1 1 1 525 1 1 36 ARG H H -6.951 3.985 1.340 1.00 . A A . 36 ARG H 1 1 1 526 1 1 36 ARG HA H -7.314 6.368 2.941 1.00 . A A . 36 ARG HA 1 1 1 527 1 1 36 ARG HB2 H -7.523 5.599 0.112 1.00 . A A . 36 ARG HB2 1 1 1 528 1 1 36 ARG HB3 H -8.587 6.879 0.645 1.00 . A A . 36 ARG HB3 1 1 1 529 1 1 36 ARG HD2 H -6.942 8.434 2.491 1.00 . A A . 36 ARG HD2 1 1 1 530 1 1 36 ARG HD3 H -6.132 9.394 1.247 1.00 . A A . 36 ARG HD3 1 1 1 531 1 1 36 ARG HE H -8.416 8.924 0.034 1.00 . A A . 36 ARG HE 1 1 1 532 1 1 36 ARG HG2 H -5.630 6.960 1.135 1.00 . A A . 36 ARG HG2 1 1 1 533 1 1 36 ARG HG3 H -6.382 7.595 -0.333 1.00 . A A . 36 ARG HG3 1 1 1 534 1 1 36 ARG HH11 H -7.871 9.883 3.403 1.00 . A A . 36 ARG HH11 1 1 1 535 1 1 36 ARG HH12 H -9.415 10.548 3.596 1.00 . A A . 36 ARG HH12 1 1 1 536 1 1 36 ARG HH21 H -10.483 9.931 0.257 1.00 . A A . 36 ARG HH21 1 1 1 537 1 1 36 ARG HH22 H -10.923 10.663 1.723 1.00 . A A . 36 ARG HH22 1 1 1 538 1 1 36 ARG N N -7.051 4.461 2.195 1.00 . A A . 36 ARG N 1 1 1 539 1 1 36 ARG NE N -8.188 9.148 0.973 1.00 . A A . 36 ARG NE 1 1 1 540 1 1 36 ARG NH1 N -8.751 10.117 2.976 1.00 . A A . 36 ARG NH1 1 1 1 541 1 1 36 ARG NH2 N -10.228 10.157 1.205 1.00 . A A . 36 ARG NH2 1 1 1 542 1 1 36 ARG O O -9.729 4.383 2.578 1.00 . A A . 36 ARG O 1 1 1 543 1 1 37 ASP C C -12.176 6.115 1.857 1.00 . A A . 37 ASP C 1 1 1 544 1 1 37 ASP CA C -11.417 6.616 3.060 1.00 . A A . 37 ASP CA 1 1 1 545 1 1 37 ASP CB C -11.963 8.013 3.451 1.00 . A A . 37 ASP CB 1 1 1 546 1 1 37 ASP CG C -11.490 8.537 4.794 1.00 . A A . 37 ASP CG 1 1 1 547 1 1 37 ASP H H -9.483 7.487 2.722 1.00 . A A . 37 ASP H 1 1 1 548 1 1 37 ASP HA H -11.579 5.925 3.875 1.00 . A A . 37 ASP HA 1 1 1 549 1 1 37 ASP HB2 H -11.653 8.725 2.699 1.00 . A A . 37 ASP HB2 1 1 1 550 1 1 37 ASP HB3 H -13.042 7.969 3.460 1.00 . A A . 37 ASP HB3 1 1 1 551 1 1 37 ASP N N -9.958 6.631 2.761 1.00 . A A . 37 ASP N 1 1 1 552 1 1 37 ASP O O -13.247 5.527 1.970 1.00 . A A . 37 ASP O 1 1 1 553 1 1 37 ASP OD1 O -10.610 9.410 4.836 1.00 . A A . 37 ASP OD1 1 1 1 554 1 1 37 ASP OD2 O -12.015 8.098 5.843 1.00 . A A . 37 ASP OD2 1 1 1 555 1 1 38 ASP C C -11.733 4.411 -0.836 1.00 . A A . 38 ASP C 1 1 1 556 1 1 38 ASP CA C -12.104 5.880 -0.587 1.00 . A A . 38 ASP CA 1 1 1 557 1 1 38 ASP CB C -11.588 6.781 -1.718 1.00 . A A . 38 ASP CB 1 1 1 558 1 1 38 ASP CG C -10.091 6.950 -1.694 1.00 . A A . 38 ASP CG 1 1 1 559 1 1 38 ASP H H -10.756 6.862 0.701 1.00 . A A . 38 ASP H 1 1 1 560 1 1 38 ASP HA H -13.180 5.950 -0.548 1.00 . A A . 38 ASP HA 1 1 1 561 1 1 38 ASP HB2 H -11.863 6.349 -2.668 1.00 . A A . 38 ASP HB2 1 1 1 562 1 1 38 ASP HB3 H -12.046 7.756 -1.630 1.00 . A A . 38 ASP HB3 1 1 1 563 1 1 38 ASP N N -11.586 6.339 0.703 1.00 . A A . 38 ASP N 1 1 1 564 1 1 38 ASP O O -11.938 3.867 -1.936 1.00 . A A . 38 ASP O 1 1 1 565 1 1 38 ASP OD1 O -9.603 7.951 -1.109 1.00 . A A . 38 ASP OD1 1 1 1 566 1 1 38 ASP OD2 O -9.376 6.092 -2.225 1.00 . A A . 38 ASP OD2 1 1 1 567 1 1 39 PHE C C -9.669 1.948 -0.611 1.00 . A A . 39 PHE C 1 1 1 568 1 1 39 PHE CA C -10.835 2.358 0.270 1.00 . A A . 39 PHE CA 1 1 1 569 1 1 39 PHE CB C -12.052 1.455 0.002 1.00 . A A . 39 PHE CB 1 1 1 570 1 1 39 PHE CD1 C -13.110 0.852 2.194 1.00 . A A . 39 PHE CD1 1 1 1 571 1 1 39 PHE CD2 C -14.252 2.387 0.775 1.00 . A A . 39 PHE CD2 1 1 1 572 1 1 39 PHE CE1 C -14.128 0.946 3.118 1.00 . A A . 39 PHE CE1 1 1 1 573 1 1 39 PHE CE2 C -15.274 2.486 1.695 1.00 . A A . 39 PHE CE2 1 1 1 574 1 1 39 PHE CG C -13.157 1.571 1.013 1.00 . A A . 39 PHE CG 1 1 1 575 1 1 39 PHE CZ C -15.212 1.764 2.869 1.00 . A A . 39 PHE CZ 1 1 1 576 1 1 39 PHE H H -10.982 4.323 1.003 1.00 . A A . 39 PHE H 1 1 1 577 1 1 39 PHE HA H -10.526 2.181 1.289 1.00 . A A . 39 PHE HA 1 1 1 578 1 1 39 PHE HB2 H -12.465 1.703 -0.965 1.00 . A A . 39 PHE HB2 1 1 1 579 1 1 39 PHE HB3 H -11.719 0.428 -0.014 1.00 . A A . 39 PHE HB3 1 1 1 580 1 1 39 PHE HD1 H -12.262 0.211 2.398 1.00 . A A . 39 PHE HD1 1 1 1 581 1 1 39 PHE HD2 H -14.300 2.954 -0.143 1.00 . A A . 39 PHE HD2 1 1 1 582 1 1 39 PHE HE1 H -14.080 0.381 4.038 1.00 . A A . 39 PHE HE1 1 1 1 583 1 1 39 PHE HE2 H -16.120 3.128 1.496 1.00 . A A . 39 PHE HE2 1 1 1 584 1 1 39 PHE HZ H -16.011 1.838 3.593 1.00 . A A . 39 PHE HZ 1 1 1 585 1 1 39 PHE N N -11.176 3.786 0.205 1.00 . A A . 39 PHE N 1 1 1 586 1 1 39 PHE O O -9.319 0.774 -0.648 1.00 . A A . 39 PHE O 1 1 1 587 1 1 40 ARG C C -6.646 2.583 -1.387 1.00 . A A . 40 ARG C 1 1 1 588 1 1 40 ARG CA C -7.966 2.544 -2.167 1.00 . A A . 40 ARG CA 1 1 1 589 1 1 40 ARG CB C -7.945 3.494 -3.361 1.00 . A A . 40 ARG CB 1 1 1 590 1 1 40 ARG CD C -7.292 1.782 -5.120 1.00 . A A . 40 ARG CD 1 1 1 591 1 1 40 ARG CG C -6.973 3.126 -4.473 1.00 . A A . 40 ARG CG 1 1 1 592 1 1 40 ARG CZ C -9.079 0.881 -6.590 1.00 . A A . 40 ARG CZ 1 1 1 593 1 1 40 ARG H H -9.344 3.816 -1.217 1.00 . A A . 40 ARG H 1 1 1 594 1 1 40 ARG HA H -8.129 1.535 -2.517 1.00 . A A . 40 ARG HA 1 1 1 595 1 1 40 ARG HB2 H -8.938 3.531 -3.781 1.00 . A A . 40 ARG HB2 1 1 1 596 1 1 40 ARG HB3 H -7.690 4.481 -3.002 1.00 . A A . 40 ARG HB3 1 1 1 597 1 1 40 ARG HD2 H -6.596 1.625 -5.930 1.00 . A A . 40 ARG HD2 1 1 1 598 1 1 40 ARG HD3 H -7.169 0.998 -4.388 1.00 . A A . 40 ARG HD3 1 1 1 599 1 1 40 ARG HE H -9.281 2.357 -5.230 1.00 . A A . 40 ARG HE 1 1 1 600 1 1 40 ARG HG2 H -6.988 3.893 -5.233 1.00 . A A . 40 ARG HG2 1 1 1 601 1 1 40 ARG HG3 H -5.990 3.072 -4.031 1.00 . A A . 40 ARG HG3 1 1 1 602 1 1 40 ARG HH11 H -7.228 0.107 -7.090 1.00 . A A . 40 ARG HH11 1 1 1 603 1 1 40 ARG HH12 H -8.540 -0.541 -7.959 1.00 . A A . 40 ARG HH12 1 1 1 604 1 1 40 ARG HH21 H -11.036 1.427 -6.412 1.00 . A A . 40 ARG HH21 1 1 1 605 1 1 40 ARG HH22 H -10.740 0.211 -7.574 1.00 . A A . 40 ARG HH22 1 1 1 606 1 1 40 ARG N N -9.059 2.880 -1.292 1.00 . A A . 40 ARG N 1 1 1 607 1 1 40 ARG NE N -8.647 1.733 -5.655 1.00 . A A . 40 ARG NE 1 1 1 608 1 1 40 ARG NH1 N -8.221 0.097 -7.253 1.00 . A A . 40 ARG NH1 1 1 1 609 1 1 40 ARG NH2 N -10.373 0.837 -6.881 1.00 . A A . 40 ARG NH2 1 1 1 610 1 1 40 ARG O O -6.519 3.316 -0.390 1.00 . A A . 40 ARG O 1 1 1 611 1 1 41 CYS C C -3.374 2.603 -1.717 1.00 . A A . 41 CYS C 1 1 1 612 1 1 41 CYS CA C -4.417 1.670 -1.167 1.00 . A A . 41 CYS CA 1 1 1 613 1 1 41 CYS CB C -3.904 0.248 -1.239 1.00 . A A . 41 CYS CB 1 1 1 614 1 1 41 CYS H H -5.851 1.230 -2.609 1.00 . A A . 41 CYS H 1 1 1 615 1 1 41 CYS HA H -4.564 1.903 -0.123 1.00 . A A . 41 CYS HA 1 1 1 616 1 1 41 CYS HB2 H -4.040 -0.128 -2.242 1.00 . A A . 41 CYS HB2 1 1 1 617 1 1 41 CYS HB3 H -2.853 0.236 -0.992 1.00 . A A . 41 CYS HB3 1 1 1 618 1 1 41 CYS N N -5.700 1.784 -1.817 1.00 . A A . 41 CYS N 1 1 1 619 1 1 41 CYS O O -3.049 2.576 -2.916 1.00 . A A . 41 CYS O 1 1 1 620 1 1 41 CYS SG S -4.746 -0.870 -0.118 1.00 . A A . 41 CYS SG 1 1 1 621 1 1 42 TRP C C -0.553 3.711 -0.400 1.00 . A A . 42 TRP C 1 1 1 622 1 1 42 TRP CA C -1.751 4.264 -1.131 1.00 . A A . 42 TRP CA 1 1 1 623 1 1 42 TRP CB C -2.027 5.708 -0.718 1.00 . A A . 42 TRP CB 1 1 1 624 1 1 42 TRP CD1 C -1.401 7.308 -2.625 1.00 . A A . 42 TRP CD1 1 1 1 625 1 1 42 TRP CD2 C -3.598 7.022 -2.368 1.00 . A A . 42 TRP CD2 1 1 1 626 1 1 42 TRP CE2 C -3.381 7.923 -3.433 1.00 . A A . 42 TRP CE2 1 1 1 627 1 1 42 TRP CE3 C -4.903 6.692 -2.030 1.00 . A A . 42 TRP CE3 1 1 1 628 1 1 42 TRP CG C -2.316 6.639 -1.865 1.00 . A A . 42 TRP CG 1 1 1 629 1 1 42 TRP CH2 C -5.693 8.152 -3.790 1.00 . A A . 42 TRP CH2 1 1 1 630 1 1 42 TRP CZ2 C -4.424 8.492 -4.148 1.00 . A A . 42 TRP CZ2 1 1 1 631 1 1 42 TRP CZ3 C -5.942 7.259 -2.743 1.00 . A A . 42 TRP CZ3 1 1 1 632 1 1 42 TRP H H -3.199 3.415 0.081 1.00 . A A . 42 TRP H 1 1 1 633 1 1 42 TRP HA H -1.567 4.210 -2.195 1.00 . A A . 42 TRP HA 1 1 1 634 1 1 42 TRP HB2 H -2.893 5.714 -0.072 1.00 . A A . 42 TRP HB2 1 1 1 635 1 1 42 TRP HB3 H -1.182 6.090 -0.168 1.00 . A A . 42 TRP HB3 1 1 1 636 1 1 42 TRP HD1 H -0.331 7.234 -2.500 1.00 . A A . 42 TRP HD1 1 1 1 637 1 1 42 TRP HE1 H -1.600 8.644 -4.246 1.00 . A A . 42 TRP HE1 1 1 1 638 1 1 42 TRP HE3 H -5.112 6.001 -1.227 1.00 . A A . 42 TRP HE3 1 1 1 639 1 1 42 TRP HH2 H -6.529 8.578 -4.323 1.00 . A A . 42 TRP HH2 1 1 1 640 1 1 42 TRP HZ2 H -4.257 9.185 -4.960 1.00 . A A . 42 TRP HZ2 1 1 1 641 1 1 42 TRP HZ3 H -6.964 7.016 -2.486 1.00 . A A . 42 TRP HZ3 1 1 1 642 1 1 42 TRP N N -2.855 3.412 -0.841 1.00 . A A . 42 TRP N 1 1 1 643 1 1 42 TRP NE1 N -2.037 8.076 -3.571 1.00 . A A . 42 TRP NE1 1 1 1 644 1 1 42 TRP O O -0.561 3.579 0.831 1.00 . A A . 42 TRP O 1 1 1 645 1 1 43 CYS C C 2.651 3.761 -0.310 1.00 . A A . 43 CYS C 1 1 1 646 1 1 43 CYS CA C 1.593 2.732 -0.613 1.00 . A A . 43 CYS CA 1 1 1 647 1 1 43 CYS CB C 2.125 1.723 -1.608 1.00 . A A . 43 CYS CB 1 1 1 648 1 1 43 CYS H H 0.398 3.528 -2.105 1.00 . A A . 43 CYS H 1 1 1 649 1 1 43 CYS HA H 1.329 2.209 0.292 1.00 . A A . 43 CYS HA 1 1 1 650 1 1 43 CYS HB2 H 2.460 2.261 -2.483 1.00 . A A . 43 CYS HB2 1 1 1 651 1 1 43 CYS HB3 H 2.962 1.198 -1.171 1.00 . A A . 43 CYS HB3 1 1 1 652 1 1 43 CYS N N 0.429 3.352 -1.137 1.00 . A A . 43 CYS N 1 1 1 653 1 1 43 CYS O O 3.078 4.520 -1.196 1.00 . A A . 43 CYS O 1 1 1 654 1 1 43 CYS SG S 0.904 0.490 -2.165 1.00 . A A . 43 CYS SG 1 1 1 655 1 1 44 THR C C 5.418 4.076 0.966 1.00 . A A . 44 THR C 1 1 1 656 1 1 44 THR CA C 4.073 4.677 1.378 1.00 . A A . 44 THR CA 1 1 1 657 1 1 44 THR CB C 4.016 4.770 2.917 1.00 . A A . 44 THR CB 1 1 1 658 1 1 44 THR CG2 C 4.884 5.916 3.431 1.00 . A A . 44 THR CG2 1 1 1 659 1 1 44 THR H H 2.689 3.145 1.558 1.00 . A A . 44 THR H 1 1 1 660 1 1 44 THR HA H 3.933 5.658 0.946 1.00 . A A . 44 THR HA 1 1 1 661 1 1 44 THR HB H 4.385 3.840 3.325 1.00 . A A . 44 THR HB 1 1 1 662 1 1 44 THR HG1 H 2.167 5.592 2.792 1.00 . A A . 44 THR HG1 1 1 1 663 1 1 44 THR HG21 H 4.543 6.849 3.006 1.00 . A A . 44 THR HG21 1 1 1 664 1 1 44 THR HG22 H 5.913 5.743 3.151 1.00 . A A . 44 THR HG22 1 1 1 665 1 1 44 THR HG23 H 4.813 5.965 4.508 1.00 . A A . 44 THR HG23 1 1 1 666 1 1 44 THR N N 3.064 3.789 0.922 1.00 . A A . 44 THR N 1 1 1 667 1 1 44 THR O O 5.656 2.878 1.180 1.00 . A A . 44 THR O 1 1 1 668 1 1 44 THR OG1 O 2.653 4.963 3.356 1.00 . A A . 44 THR OG1 1 1 1 669 1 1 45 LYS C C 8.616 5.345 0.364 1.00 . A A . 45 LYS C 1 1 1 670 1 1 45 LYS CA C 7.542 4.386 -0.081 1.00 . A A . 45 LYS CA 1 1 1 671 1 1 45 LYS CB C 7.574 4.255 -1.609 1.00 . A A . 45 LYS CB 1 1 1 672 1 1 45 LYS CD C 7.450 5.413 -3.863 1.00 . A A . 45 LYS CD 1 1 1 673 1 1 45 LYS CE C 8.746 4.797 -4.391 1.00 . A A . 45 LYS CE 1 1 1 674 1 1 45 LYS CG C 7.445 5.579 -2.351 1.00 . A A . 45 LYS CG 1 1 1 675 1 1 45 LYS H H 6.019 5.802 0.200 1.00 . A A . 45 LYS H 1 1 1 676 1 1 45 LYS HA H 7.716 3.414 0.356 1.00 . A A . 45 LYS HA 1 1 1 677 1 1 45 LYS HB2 H 8.513 3.804 -1.892 1.00 . A A . 45 LYS HB2 1 1 1 678 1 1 45 LYS HB3 H 6.764 3.612 -1.916 1.00 . A A . 45 LYS HB3 1 1 1 679 1 1 45 LYS HD2 H 6.627 4.772 -4.141 1.00 . A A . 45 LYS HD2 1 1 1 680 1 1 45 LYS HD3 H 7.311 6.383 -4.317 1.00 . A A . 45 LYS HD3 1 1 1 681 1 1 45 LYS HE2 H 8.875 3.813 -3.966 1.00 . A A . 45 LYS HE2 1 1 1 682 1 1 45 LYS HE3 H 8.650 4.704 -5.463 1.00 . A A . 45 LYS HE3 1 1 1 683 1 1 45 LYS HG2 H 6.518 6.050 -2.058 1.00 . A A . 45 LYS HG2 1 1 1 684 1 1 45 LYS HG3 H 8.273 6.210 -2.062 1.00 . A A . 45 LYS HG3 1 1 1 685 1 1 45 LYS HZ1 H 9.843 6.580 -4.457 1.00 . A A . 45 LYS HZ1 1 1 1 686 1 1 45 LYS HZ2 H 10.768 5.190 -4.585 1.00 . A A . 45 LYS HZ2 1 1 1 687 1 1 45 LYS HZ3 H 10.191 5.647 -3.080 1.00 . A A . 45 LYS HZ3 1 1 1 688 1 1 45 LYS N N 6.258 4.859 0.362 1.00 . A A . 45 LYS N 1 1 1 689 1 1 45 LYS NZ N 9.954 5.612 -4.093 1.00 . A A . 45 LYS NZ 1 1 1 690 1 1 45 LYS O O 8.340 6.519 0.649 1.00 . A A . 45 LYS O 1 1 1 691 1 1 46 ASN C C 11.454 6.309 -0.509 1.00 . A A . 46 ASN C 1 1 1 692 1 1 46 ASN CA C 10.931 5.704 0.768 1.00 . A A . 46 ASN CA 1 1 1 693 1 1 46 ASN CB C 12.059 4.928 1.478 1.00 . A A . 46 ASN CB 1 1 1 694 1 1 46 ASN CG C 11.609 4.181 2.720 1.00 . A A . 46 ASN CG 1 1 1 695 1 1 46 ASN H H 9.967 3.920 0.218 1.00 . A A . 46 ASN H 1 1 1 696 1 1 46 ASN HA H 10.571 6.495 1.410 1.00 . A A . 46 ASN HA 1 1 1 697 1 1 46 ASN HB2 H 12.474 4.208 0.789 1.00 . A A . 46 ASN HB2 1 1 1 698 1 1 46 ASN HB3 H 12.832 5.624 1.761 1.00 . A A . 46 ASN HB3 1 1 1 699 1 1 46 ASN HD21 H 11.604 2.462 1.729 1.00 . A A . 46 ASN HD21 1 1 1 700 1 1 46 ASN HD22 H 11.201 2.361 3.400 1.00 . A A . 46 ASN HD22 1 1 1 701 1 1 46 ASN N N 9.817 4.867 0.428 1.00 . A A . 46 ASN N 1 1 1 702 1 1 46 ASN ND2 N 11.440 2.881 2.602 1.00 . A A . 46 ASN ND2 1 1 1 703 1 1 46 ASN O O 11.283 5.724 -1.598 1.00 . A A . 46 ASN O 1 1 1 704 1 1 46 ASN OD1 O 11.470 4.761 3.796 1.00 . A A . 46 ASN OD1 1 1 1 705 1 1 47 CYS C C 13.853 8.826 -1.132 1.00 . A A . 47 CYS C 1 1 1 706 1 1 47 CYS CA C 12.581 8.137 -1.555 1.00 . A A . 47 CYS CA 1 1 1 707 1 1 47 CYS CB C 11.582 9.152 -2.131 1.00 . A A . 47 CYS CB 1 1 1 708 1 1 47 CYS H H 12.122 7.895 0.464 1.00 . A A . 47 CYS H 1 1 1 709 1 1 47 CYS HA H 12.811 7.395 -2.304 1.00 . A A . 47 CYS HA 1 1 1 710 1 1 47 CYS HB2 H 11.302 9.841 -1.349 1.00 . A A . 47 CYS HB2 1 1 1 711 1 1 47 CYS HB3 H 12.049 9.700 -2.937 1.00 . A A . 47 CYS HB3 1 1 1 712 1 1 47 CYS N N 12.028 7.463 -0.412 1.00 . A A . 47 CYS N 1 1 1 713 1 1 47 CYS O O 13.876 10.067 -1.016 1.00 . A A . 47 CYS O 1 1 1 714 1 1 47 CYS OXT O 14.841 8.112 -0.835 1.00 . A A . 47 CYS OXT 1 1 1 715 1 1 47 CYS SG S 10.039 8.428 -2.762 1.00 . A A . 47 CYS SG 1 1 2 716 1 1 1 LYS C C 11.235 9.407 1.100 1.00 . A A . 1 LYS C 1 1 2 717 1 1 1 LYS CA C 12.371 10.391 1.234 1.00 . A A . 1 LYS CA 1 1 2 718 1 1 1 LYS CB C 12.146 11.584 0.291 1.00 . A A . 1 LYS CB 1 1 2 719 1 1 1 LYS CD C 10.859 13.572 -0.441 1.00 . A A . 1 LYS CD 1 1 2 720 1 1 1 LYS CE C 9.722 14.533 -0.165 1.00 . A A . 1 LYS CE 1 1 2 721 1 1 1 LYS CG C 10.979 12.500 0.619 1.00 . A A . 1 LYS CG 1 1 2 722 1 1 1 LYS H1 H 13.754 8.849 1.385 1.00 . A A . 1 LYS H1 1 1 2 723 1 1 1 LYS H2 H 14.401 10.356 0.942 1.00 . A A . 1 LYS H2 1 1 2 724 1 1 1 LYS H3 H 13.490 9.464 -0.173 1.00 . A A . 1 LYS H3 1 1 2 725 1 1 1 LYS HA H 12.442 10.737 2.255 1.00 . A A . 1 LYS HA 1 1 2 726 1 1 1 LYS HB2 H 13.041 12.186 0.277 1.00 . A A . 1 LYS HB2 1 1 2 727 1 1 1 LYS HB3 H 11.994 11.191 -0.704 1.00 . A A . 1 LYS HB3 1 1 2 728 1 1 1 LYS HD2 H 11.782 14.130 -0.480 1.00 . A A . 1 LYS HD2 1 1 2 729 1 1 1 LYS HD3 H 10.692 13.093 -1.395 1.00 . A A . 1 LYS HD3 1 1 2 730 1 1 1 LYS HE2 H 8.801 13.974 -0.097 1.00 . A A . 1 LYS HE2 1 1 2 731 1 1 1 LYS HE3 H 9.911 15.036 0.771 1.00 . A A . 1 LYS HE3 1 1 2 732 1 1 1 LYS HG2 H 10.069 11.919 0.649 1.00 . A A . 1 LYS HG2 1 1 2 733 1 1 1 LYS HG3 H 11.151 12.966 1.578 1.00 . A A . 1 LYS HG3 1 1 2 734 1 1 1 LYS HZ1 H 9.413 15.070 -2.149 1.00 . A A . 1 LYS HZ1 1 1 2 735 1 1 1 LYS HZ2 H 10.498 16.060 -1.343 1.00 . A A . 1 LYS HZ2 1 1 2 736 1 1 1 LYS HZ3 H 8.841 16.212 -1.050 1.00 . A A . 1 LYS HZ3 1 1 2 737 1 1 1 LYS N N 13.591 9.716 0.837 1.00 . A A . 1 LYS N 1 1 2 738 1 1 1 LYS NZ N 9.606 15.536 -1.239 1.00 . A A . 1 LYS NZ 1 1 2 739 1 1 1 LYS O O 11.369 8.406 0.417 1.00 . A A . 1 LYS O 1 1 2 740 1 1 2 THR C C 7.893 9.577 0.996 1.00 . A A . 2 THR C 1 1 2 741 1 1 2 THR CA C 9.019 8.822 1.638 1.00 . A A . 2 THR CA 1 1 2 742 1 1 2 THR CB C 8.584 8.227 2.962 1.00 . A A . 2 THR CB 1 1 2 743 1 1 2 THR CG2 C 9.407 7.002 3.295 1.00 . A A . 2 THR CG2 1 1 2 744 1 1 2 THR H H 10.100 10.403 2.391 1.00 . A A . 2 THR H 1 1 2 745 1 1 2 THR HA H 9.296 8.013 0.978 1.00 . A A . 2 THR HA 1 1 2 746 1 1 2 THR HB H 7.551 7.938 2.832 1.00 . A A . 2 THR HB 1 1 2 747 1 1 2 THR HG1 H 8.454 8.804 4.836 1.00 . A A . 2 THR HG1 1 1 2 748 1 1 2 THR HG21 H 9.079 6.588 4.237 1.00 . A A . 2 THR HG21 1 1 2 749 1 1 2 THR HG22 H 10.449 7.277 3.360 1.00 . A A . 2 THR HG22 1 1 2 750 1 1 2 THR HG23 H 9.279 6.267 2.512 1.00 . A A . 2 THR HG23 1 1 2 751 1 1 2 THR N N 10.162 9.645 1.773 1.00 . A A . 2 THR N 1 1 2 752 1 1 2 THR O O 7.443 10.620 1.488 1.00 . A A . 2 THR O 1 1 2 753 1 1 2 THR OG1 O 8.705 9.220 4.003 1.00 . A A . 2 THR OG1 1 1 2 754 1 1 3 CYS C C 5.286 8.621 -0.943 1.00 . A A . 3 CYS C 1 1 2 755 1 1 3 CYS CA C 6.406 9.632 -0.856 1.00 . A A . 3 CYS CA 1 1 2 756 1 1 3 CYS CB C 6.959 10.054 -2.226 1.00 . A A . 3 CYS CB 1 1 2 757 1 1 3 CYS H H 7.833 8.193 -0.354 1.00 . A A . 3 CYS H 1 1 2 758 1 1 3 CYS HA H 6.044 10.500 -0.327 1.00 . A A . 3 CYS HA 1 1 2 759 1 1 3 CYS HB2 H 6.133 10.184 -2.909 1.00 . A A . 3 CYS HB2 1 1 2 760 1 1 3 CYS HB3 H 7.486 10.991 -2.120 1.00 . A A . 3 CYS HB3 1 1 2 761 1 1 3 CYS N N 7.456 9.059 -0.074 1.00 . A A . 3 CYS N 1 1 2 762 1 1 3 CYS O O 5.485 7.468 -0.594 1.00 . A A . 3 CYS O 1 1 2 763 1 1 3 CYS SG S 8.108 8.849 -2.987 1.00 . A A . 3 CYS SG 1 1 2 764 1 1 4 GLU C C 2.301 8.096 -2.659 1.00 . A A . 4 GLU C 1 1 2 765 1 1 4 GLU CA C 3.021 8.089 -1.337 1.00 . A A . 4 GLU CA 1 1 2 766 1 1 4 GLU CB C 2.111 8.447 -0.173 1.00 . A A . 4 GLU CB 1 1 2 767 1 1 4 GLU CD C 0.481 7.692 1.514 1.00 . A A . 4 GLU CD 1 1 2 768 1 1 4 GLU CG C 1.059 7.421 0.166 1.00 . A A . 4 GLU CG 1 1 2 769 1 1 4 GLU H H 3.985 9.913 -1.721 1.00 . A A . 4 GLU H 1 1 2 770 1 1 4 GLU HA H 3.423 7.100 -1.171 1.00 . A A . 4 GLU HA 1 1 2 771 1 1 4 GLU HB2 H 2.727 8.586 0.703 1.00 . A A . 4 GLU HB2 1 1 2 772 1 1 4 GLU HB3 H 1.618 9.380 -0.399 1.00 . A A . 4 GLU HB3 1 1 2 773 1 1 4 GLU HG2 H 0.271 7.459 -0.570 1.00 . A A . 4 GLU HG2 1 1 2 774 1 1 4 GLU HG3 H 1.507 6.438 0.170 1.00 . A A . 4 GLU HG3 1 1 2 775 1 1 4 GLU N N 4.125 9.009 -1.364 1.00 . A A . 4 GLU N 1 1 2 776 1 1 4 GLU O O 2.028 9.159 -3.221 1.00 . A A . 4 GLU O 1 1 2 777 1 1 4 GLU OE1 O 1.193 7.464 2.509 1.00 . A A . 4 GLU OE1 1 1 2 778 1 1 4 GLU OE2 O -0.679 8.170 1.620 1.00 . A A . 4 GLU OE2 1 1 2 779 1 1 5 ASN C C 0.403 5.637 -4.381 1.00 . A A . 5 ASN C 1 1 2 780 1 1 5 ASN CA C 1.404 6.765 -4.464 1.00 . A A . 5 ASN CA 1 1 2 781 1 1 5 ASN CB C 2.509 6.392 -5.482 1.00 . A A . 5 ASN CB 1 1 2 782 1 1 5 ASN CG C 2.079 6.456 -6.948 1.00 . A A . 5 ASN CG 1 1 2 783 1 1 5 ASN H H 2.166 6.110 -2.623 1.00 . A A . 5 ASN H 1 1 2 784 1 1 5 ASN HA H 0.929 7.685 -4.769 1.00 . A A . 5 ASN HA 1 1 2 785 1 1 5 ASN HB2 H 3.341 7.068 -5.353 1.00 . A A . 5 ASN HB2 1 1 2 786 1 1 5 ASN HB3 H 2.846 5.388 -5.268 1.00 . A A . 5 ASN HB3 1 1 2 787 1 1 5 ASN HD21 H 1.466 4.554 -6.950 1.00 . A A . 5 ASN HD21 1 1 2 788 1 1 5 ASN HD22 H 1.284 5.412 -8.424 1.00 . A A . 5 ASN HD22 1 1 2 789 1 1 5 ASN N N 2.007 6.923 -3.154 1.00 . A A . 5 ASN N 1 1 2 790 1 1 5 ASN ND2 N 1.567 5.374 -7.486 1.00 . A A . 5 ASN ND2 1 1 2 791 1 1 5 ASN O O 0.453 4.836 -3.438 1.00 . A A . 5 ASN O 1 1 2 792 1 1 5 ASN OD1 O 2.231 7.487 -7.596 1.00 . A A . 5 ASN OD1 1 1 2 793 1 1 6 LEU C C -0.745 3.191 -5.699 1.00 . A A . 6 LEU C 1 1 2 794 1 1 6 LEU CA C -1.449 4.497 -5.406 1.00 . A A . 6 LEU CA 1 1 2 795 1 1 6 LEU CB C -2.484 4.767 -6.493 1.00 . A A . 6 LEU CB 1 1 2 796 1 1 6 LEU CD1 C -4.402 6.077 -7.356 1.00 . A A . 6 LEU CD1 1 1 2 797 1 1 6 LEU CD2 C -4.483 5.147 -5.094 1.00 . A A . 6 LEU CD2 1 1 2 798 1 1 6 LEU CG C -3.584 5.753 -6.139 1.00 . A A . 6 LEU CG 1 1 2 799 1 1 6 LEU H H -0.553 6.304 -5.982 1.00 . A A . 6 LEU H 1 1 2 800 1 1 6 LEU HA H -1.960 4.413 -4.459 1.00 . A A . 6 LEU HA 1 1 2 801 1 1 6 LEU HB2 H -1.964 5.140 -7.363 1.00 . A A . 6 LEU HB2 1 1 2 802 1 1 6 LEU HB3 H -2.945 3.827 -6.754 1.00 . A A . 6 LEU HB3 1 1 2 803 1 1 6 LEU HD11 H -5.184 6.765 -7.067 1.00 . A A . 6 LEU HD11 1 1 2 804 1 1 6 LEU HD12 H -4.842 5.165 -7.730 1.00 . A A . 6 LEU HD12 1 1 2 805 1 1 6 LEU HD13 H -3.778 6.528 -8.114 1.00 . A A . 6 LEU HD13 1 1 2 806 1 1 6 LEU HD21 H -3.921 4.936 -4.196 1.00 . A A . 6 LEU HD21 1 1 2 807 1 1 6 LEU HD22 H -4.905 4.228 -5.474 1.00 . A A . 6 LEU HD22 1 1 2 808 1 1 6 LEU HD23 H -5.280 5.838 -4.863 1.00 . A A . 6 LEU HD23 1 1 2 809 1 1 6 LEU HG H -3.164 6.662 -5.735 1.00 . A A . 6 LEU HG 1 1 2 810 1 1 6 LEU N N -0.507 5.584 -5.315 1.00 . A A . 6 LEU N 1 1 2 811 1 1 6 LEU O O 0.269 3.155 -6.416 1.00 . A A . 6 LEU O 1 1 2 812 1 1 7 ALA C C -1.188 0.393 -6.762 1.00 . A A . 7 ALA C 1 1 2 813 1 1 7 ALA CA C -0.745 0.822 -5.375 1.00 . A A . 7 ALA CA 1 1 2 814 1 1 7 ALA CB C -1.257 -0.136 -4.326 1.00 . A A . 7 ALA CB 1 1 2 815 1 1 7 ALA H H -2.010 2.264 -4.511 1.00 . A A . 7 ALA H 1 1 2 816 1 1 7 ALA HA H 0.334 0.857 -5.335 1.00 . A A . 7 ALA HA 1 1 2 817 1 1 7 ALA HB1 H -0.879 -1.128 -4.526 1.00 . A A . 7 ALA HB1 1 1 2 818 1 1 7 ALA HB2 H -2.336 -0.140 -4.349 1.00 . A A . 7 ALA HB2 1 1 2 819 1 1 7 ALA HB3 H -0.923 0.188 -3.351 1.00 . A A . 7 ALA HB3 1 1 2 820 1 1 7 ALA N N -1.255 2.139 -5.128 1.00 . A A . 7 ALA N 1 1 2 821 1 1 7 ALA O O -2.384 0.239 -7.025 1.00 . A A . 7 ALA O 1 1 2 822 1 1 8 ASP C C -0.820 -1.567 -9.198 1.00 . A A . 8 ASP C 1 1 2 823 1 1 8 ASP CA C -0.542 -0.084 -9.032 1.00 . A A . 8 ASP CA 1 1 2 824 1 1 8 ASP CB C 0.599 0.356 -9.949 1.00 . A A . 8 ASP CB 1 1 2 825 1 1 8 ASP CG C 0.298 0.118 -11.401 1.00 . A A . 8 ASP CG 1 1 2 826 1 1 8 ASP H H 0.692 0.351 -7.370 1.00 . A A . 8 ASP H 1 1 2 827 1 1 8 ASP HA H -1.433 0.461 -9.305 1.00 . A A . 8 ASP HA 1 1 2 828 1 1 8 ASP HB2 H 0.786 1.410 -9.808 1.00 . A A . 8 ASP HB2 1 1 2 829 1 1 8 ASP HB3 H 1.490 -0.197 -9.696 1.00 . A A . 8 ASP HB3 1 1 2 830 1 1 8 ASP N N -0.244 0.240 -7.648 1.00 . A A . 8 ASP N 1 1 2 831 1 1 8 ASP O O -1.756 -1.962 -9.906 1.00 . A A . 8 ASP O 1 1 2 832 1 1 8 ASP OD1 O -0.434 0.935 -12.006 1.00 . A A . 8 ASP OD1 1 1 2 833 1 1 8 ASP OD2 O 0.810 -0.876 -11.986 1.00 . A A . 8 ASP OD2 1 1 2 834 1 1 9 THR C C -1.455 -4.234 -7.822 1.00 . A A . 9 THR C 1 1 2 835 1 1 9 THR CA C -0.179 -3.805 -8.580 1.00 . A A . 9 THR CA 1 1 2 836 1 1 9 THR CB C 1.055 -4.461 -7.960 1.00 . A A . 9 THR CB 1 1 2 837 1 1 9 THR CG2 C 1.115 -5.926 -8.319 1.00 . A A . 9 THR CG2 1 1 2 838 1 1 9 THR H H 0.743 -2.040 -8.027 1.00 . A A . 9 THR H 1 1 2 839 1 1 9 THR HA H -0.252 -4.110 -9.613 1.00 . A A . 9 THR HA 1 1 2 840 1 1 9 THR HB H 1.026 -4.349 -6.887 1.00 . A A . 9 THR HB 1 1 2 841 1 1 9 THR HG1 H 2.960 -4.038 -7.895 1.00 . A A . 9 THR HG1 1 1 2 842 1 1 9 THR HG21 H 1.993 -6.368 -7.871 1.00 . A A . 9 THR HG21 1 1 2 843 1 1 9 THR HG22 H 1.167 -6.008 -9.393 1.00 . A A . 9 THR HG22 1 1 2 844 1 1 9 THR HG23 H 0.224 -6.415 -7.952 1.00 . A A . 9 THR HG23 1 1 2 845 1 1 9 THR N N -0.023 -2.380 -8.539 1.00 . A A . 9 THR N 1 1 2 846 1 1 9 THR O O -2.146 -5.174 -8.223 1.00 . A A . 9 THR O 1 1 2 847 1 1 9 THR OG1 O 2.224 -3.816 -8.492 1.00 . A A . 9 THR OG1 1 1 2 848 1 1 10 TYR C C -4.168 -3.199 -6.708 1.00 . A A . 10 TYR C 1 1 2 849 1 1 10 TYR CA C -2.968 -3.817 -5.992 1.00 . A A . 10 TYR CA 1 1 2 850 1 1 10 TYR CB C -2.832 -3.290 -4.550 1.00 . A A . 10 TYR CB 1 1 2 851 1 1 10 TYR CD1 C -5.119 -3.011 -3.498 1.00 . A A . 10 TYR CD1 1 1 2 852 1 1 10 TYR CD2 C -3.758 -4.803 -2.736 1.00 . A A . 10 TYR CD2 1 1 2 853 1 1 10 TYR CE1 C -6.104 -3.374 -2.609 1.00 . A A . 10 TYR CE1 1 1 2 854 1 1 10 TYR CE2 C -4.746 -5.175 -1.842 1.00 . A A . 10 TYR CE2 1 1 2 855 1 1 10 TYR CG C -3.931 -3.713 -3.582 1.00 . A A . 10 TYR CG 1 1 2 856 1 1 10 TYR CZ C -5.917 -4.453 -1.782 1.00 . A A . 10 TYR CZ 1 1 2 857 1 1 10 TYR H H -1.208 -2.774 -6.497 1.00 . A A . 10 TYR H 1 1 2 858 1 1 10 TYR HA H -3.091 -4.890 -5.981 1.00 . A A . 10 TYR HA 1 1 2 859 1 1 10 TYR HB2 H -1.893 -3.633 -4.140 1.00 . A A . 10 TYR HB2 1 1 2 860 1 1 10 TYR HB3 H -2.820 -2.212 -4.585 1.00 . A A . 10 TYR HB3 1 1 2 861 1 1 10 TYR HD1 H -5.272 -2.161 -4.148 1.00 . A A . 10 TYR HD1 1 1 2 862 1 1 10 TYR HD2 H -2.838 -5.365 -2.786 1.00 . A A . 10 TYR HD2 1 1 2 863 1 1 10 TYR HE1 H -7.019 -2.801 -2.574 1.00 . A A . 10 TYR HE1 1 1 2 864 1 1 10 TYR HE2 H -4.590 -6.025 -1.194 1.00 . A A . 10 TYR HE2 1 1 2 865 1 1 10 TYR HH H -7.756 -4.702 -1.346 1.00 . A A . 10 TYR HH 1 1 2 866 1 1 10 TYR N N -1.781 -3.521 -6.761 1.00 . A A . 10 TYR N 1 1 2 867 1 1 10 TYR O O -4.468 -2.007 -6.571 1.00 . A A . 10 TYR O 1 1 2 868 1 1 10 TYR OH O -6.908 -4.810 -0.895 1.00 . A A . 10 TYR OH 1 1 2 869 1 1 11 LYS C C -7.221 -3.872 -7.601 1.00 . A A . 11 LYS C 1 1 2 870 1 1 11 LYS CA C -5.908 -3.574 -8.320 1.00 . A A . 11 LYS CA 1 1 2 871 1 1 11 LYS CB C -5.852 -4.227 -9.723 1.00 . A A . 11 LYS CB 1 1 2 872 1 1 11 LYS CD C -5.590 -6.404 -11.011 1.00 . A A . 11 LYS CD 1 1 2 873 1 1 11 LYS CE C -5.198 -7.877 -10.872 1.00 . A A . 11 LYS CE 1 1 2 874 1 1 11 LYS CG C -5.528 -5.715 -9.668 1.00 . A A . 11 LYS CG 1 1 2 875 1 1 11 LYS H H -4.462 -4.917 -7.613 1.00 . A A . 11 LYS H 1 1 2 876 1 1 11 LYS HA H -5.831 -2.504 -8.442 1.00 . A A . 11 LYS HA 1 1 2 877 1 1 11 LYS HB2 H -6.811 -4.103 -10.205 1.00 . A A . 11 LYS HB2 1 1 2 878 1 1 11 LYS HB3 H -5.093 -3.735 -10.312 1.00 . A A . 11 LYS HB3 1 1 2 879 1 1 11 LYS HD2 H -6.595 -6.333 -11.402 1.00 . A A . 11 LYS HD2 1 1 2 880 1 1 11 LYS HD3 H -4.901 -5.919 -11.687 1.00 . A A . 11 LYS HD3 1 1 2 881 1 1 11 LYS HE2 H -5.356 -8.363 -11.823 1.00 . A A . 11 LYS HE2 1 1 2 882 1 1 11 LYS HE3 H -4.152 -7.938 -10.615 1.00 . A A . 11 LYS HE3 1 1 2 883 1 1 11 LYS HG2 H -4.530 -5.836 -9.273 1.00 . A A . 11 LYS HG2 1 1 2 884 1 1 11 LYS HG3 H -6.234 -6.184 -8.998 1.00 . A A . 11 LYS HG3 1 1 2 885 1 1 11 LYS HZ1 H -5.854 -8.161 -8.898 1.00 . A A . 11 LYS HZ1 1 1 2 886 1 1 11 LYS HZ2 H -5.717 -9.584 -9.768 1.00 . A A . 11 LYS HZ2 1 1 2 887 1 1 11 LYS HZ3 H -7.014 -8.550 -10.060 1.00 . A A . 11 LYS HZ3 1 1 2 888 1 1 11 LYS N N -4.781 -3.991 -7.533 1.00 . A A . 11 LYS N 1 1 2 889 1 1 11 LYS NZ N -5.999 -8.585 -9.837 1.00 . A A . 11 LYS NZ 1 1 2 890 1 1 11 LYS O O -7.831 -4.933 -7.787 1.00 . A A . 11 LYS O 1 1 2 891 1 1 12 GLY C C -8.889 -2.285 -4.793 1.00 . A A . 12 GLY C 1 1 2 892 1 1 12 GLY CA C -8.843 -3.138 -6.028 1.00 . A A . 12 GLY CA 1 1 2 893 1 1 12 GLY H H -7.047 -2.205 -6.522 1.00 . A A . 12 GLY H 1 1 2 894 1 1 12 GLY HA2 H -9.660 -2.862 -6.678 1.00 . A A . 12 GLY HA2 1 1 2 895 1 1 12 GLY HA3 H -8.954 -4.173 -5.739 1.00 . A A . 12 GLY HA3 1 1 2 896 1 1 12 GLY N N -7.610 -2.981 -6.733 1.00 . A A . 12 GLY N 1 1 2 897 1 1 12 GLY O O -7.943 -1.531 -4.526 1.00 . A A . 12 GLY O 1 1 2 898 1 1 13 PRO C C -9.507 -2.383 -1.615 1.00 . A A . 13 PRO C 1 1 2 899 1 1 13 PRO CA C -10.117 -1.612 -2.795 1.00 . A A . 13 PRO CA 1 1 2 900 1 1 13 PRO CB C -11.645 -1.476 -2.609 1.00 . A A . 13 PRO CB 1 1 2 901 1 1 13 PRO CD C -11.202 -3.087 -4.341 1.00 . A A . 13 PRO CD 1 1 2 902 1 1 13 PRO CG C -12.270 -2.200 -3.769 1.00 . A A . 13 PRO CG 1 1 2 903 1 1 13 PRO HA H -9.669 -0.631 -2.858 1.00 . A A . 13 PRO HA 1 1 2 904 1 1 13 PRO HB2 H -11.928 -1.923 -1.668 1.00 . A A . 13 PRO HB2 1 1 2 905 1 1 13 PRO HB3 H -11.918 -0.431 -2.604 1.00 . A A . 13 PRO HB3 1 1 2 906 1 1 13 PRO HD2 H -11.203 -4.048 -3.851 1.00 . A A . 13 PRO HD2 1 1 2 907 1 1 13 PRO HD3 H -11.332 -3.198 -5.408 1.00 . A A . 13 PRO HD3 1 1 2 908 1 1 13 PRO HG2 H -13.104 -2.796 -3.427 1.00 . A A . 13 PRO HG2 1 1 2 909 1 1 13 PRO HG3 H -12.602 -1.487 -4.509 1.00 . A A . 13 PRO HG3 1 1 2 910 1 1 13 PRO N N -9.983 -2.339 -4.036 1.00 . A A . 13 PRO N 1 1 2 911 1 1 13 PRO O O -9.302 -3.612 -1.675 1.00 . A A . 13 PRO O 1 1 2 912 1 1 14 CYS C C -9.789 -2.745 1.502 1.00 . A A . 14 CYS C 1 1 2 913 1 1 14 CYS CA C -8.666 -2.249 0.619 1.00 . A A . 14 CYS CA 1 1 2 914 1 1 14 CYS CB C -7.810 -1.237 1.384 1.00 . A A . 14 CYS CB 1 1 2 915 1 1 14 CYS H H -9.372 -0.701 -0.598 1.00 . A A . 14 CYS H 1 1 2 916 1 1 14 CYS HA H -8.046 -3.085 0.334 1.00 . A A . 14 CYS HA 1 1 2 917 1 1 14 CYS HB2 H -6.940 -0.988 0.795 1.00 . A A . 14 CYS HB2 1 1 2 918 1 1 14 CYS HB3 H -8.393 -0.344 1.558 1.00 . A A . 14 CYS HB3 1 1 2 919 1 1 14 CYS N N -9.208 -1.672 -0.572 1.00 . A A . 14 CYS N 1 1 2 920 1 1 14 CYS O O -10.459 -1.957 2.175 1.00 . A A . 14 CYS O 1 1 2 921 1 1 14 CYS SG S -7.234 -1.853 3.000 1.00 . A A . 14 CYS SG 1 1 2 922 1 1 15 PHE C C -10.481 -4.888 3.661 1.00 . A A . 15 PHE C 1 1 2 923 1 1 15 PHE CA C -11.063 -4.632 2.284 1.00 . A A . 15 PHE CA 1 1 2 924 1 1 15 PHE CB C -11.576 -5.934 1.664 1.00 . A A . 15 PHE CB 1 1 2 925 1 1 15 PHE CD1 C -13.435 -5.200 0.156 1.00 . A A . 15 PHE CD1 1 1 2 926 1 1 15 PHE CD2 C -11.477 -6.116 -0.834 1.00 . A A . 15 PHE CD2 1 1 2 927 1 1 15 PHE CE1 C -13.989 -5.023 -1.092 1.00 . A A . 15 PHE CE1 1 1 2 928 1 1 15 PHE CE2 C -12.024 -5.942 -2.084 1.00 . A A . 15 PHE CE2 1 1 2 929 1 1 15 PHE CG C -12.175 -5.748 0.300 1.00 . A A . 15 PHE CG 1 1 2 930 1 1 15 PHE CZ C -13.282 -5.394 -2.214 1.00 . A A . 15 PHE CZ 1 1 2 931 1 1 15 PHE H H -9.576 -4.571 0.777 1.00 . A A . 15 PHE H 1 1 2 932 1 1 15 PHE HA H -11.881 -3.934 2.372 1.00 . A A . 15 PHE HA 1 1 2 933 1 1 15 PHE HB2 H -10.756 -6.632 1.579 1.00 . A A . 15 PHE HB2 1 1 2 934 1 1 15 PHE HB3 H -12.333 -6.356 2.309 1.00 . A A . 15 PHE HB3 1 1 2 935 1 1 15 PHE HD1 H -13.988 -4.907 1.036 1.00 . A A . 15 PHE HD1 1 1 2 936 1 1 15 PHE HD2 H -10.491 -6.549 -0.743 1.00 . A A . 15 PHE HD2 1 1 2 937 1 1 15 PHE HE1 H -14.976 -4.595 -1.188 1.00 . A A . 15 PHE HE1 1 1 2 938 1 1 15 PHE HE2 H -11.462 -6.235 -2.960 1.00 . A A . 15 PHE HE2 1 1 2 939 1 1 15 PHE HZ H -13.712 -5.256 -3.195 1.00 . A A . 15 PHE HZ 1 1 2 940 1 1 15 PHE N N -10.053 -4.027 1.439 1.00 . A A . 15 PHE N 1 1 2 941 1 1 15 PHE O O -11.150 -4.739 4.679 1.00 . A A . 15 PHE O 1 1 2 942 1 1 16 THR C C -7.180 -4.749 4.808 1.00 . A A . 16 THR C 1 1 2 943 1 1 16 THR CA C -8.506 -5.499 4.883 1.00 . A A . 16 THR CA 1 1 2 944 1 1 16 THR CB C -8.267 -7.012 5.044 1.00 . A A . 16 THR CB 1 1 2 945 1 1 16 THR CG2 C -7.663 -7.331 6.402 1.00 . A A . 16 THR CG2 1 1 2 946 1 1 16 THR H H -8.741 -5.341 2.830 1.00 . A A . 16 THR H 1 1 2 947 1 1 16 THR HA H -9.089 -5.134 5.716 1.00 . A A . 16 THR HA 1 1 2 948 1 1 16 THR HB H -7.597 -7.341 4.263 1.00 . A A . 16 THR HB 1 1 2 949 1 1 16 THR HG1 H -10.199 -7.087 5.261 1.00 . A A . 16 THR HG1 1 1 2 950 1 1 16 THR HG21 H -8.333 -7.001 7.182 1.00 . A A . 16 THR HG21 1 1 2 951 1 1 16 THR HG22 H -6.714 -6.826 6.502 1.00 . A A . 16 THR HG22 1 1 2 952 1 1 16 THR HG23 H -7.512 -8.397 6.487 1.00 . A A . 16 THR HG23 1 1 2 953 1 1 16 THR N N -9.225 -5.246 3.675 1.00 . A A . 16 THR N 1 1 2 954 1 1 16 THR O O -6.401 -4.945 3.853 1.00 . A A . 16 THR O 1 1 2 955 1 1 16 THR OG1 O -9.526 -7.691 4.921 1.00 . A A . 16 THR OG1 1 1 2 956 1 1 17 THR C C -4.474 -3.864 5.815 1.00 . A A . 17 THR C 1 1 2 957 1 1 17 THR CA C -5.761 -3.044 5.813 1.00 . A A . 17 THR CA 1 1 2 958 1 1 17 THR CB C -5.823 -2.095 7.024 1.00 . A A . 17 THR CB 1 1 2 959 1 1 17 THR CG2 C -4.675 -1.089 7.004 1.00 . A A . 17 THR CG2 1 1 2 960 1 1 17 THR H H -7.563 -3.818 6.541 1.00 . A A . 17 THR H 1 1 2 961 1 1 17 THR HA H -5.779 -2.444 4.914 1.00 . A A . 17 THR HA 1 1 2 962 1 1 17 THR HB H -5.781 -2.679 7.932 1.00 . A A . 17 THR HB 1 1 2 963 1 1 17 THR HG1 H -7.378 -1.373 6.059 1.00 . A A . 17 THR HG1 1 1 2 964 1 1 17 THR HG21 H -4.739 -0.489 6.107 1.00 . A A . 17 THR HG21 1 1 2 965 1 1 17 THR HG22 H -3.733 -1.619 7.013 1.00 . A A . 17 THR HG22 1 1 2 966 1 1 17 THR HG23 H -4.735 -0.451 7.872 1.00 . A A . 17 THR HG23 1 1 2 967 1 1 17 THR N N -6.935 -3.891 5.786 1.00 . A A . 17 THR N 1 1 2 968 1 1 17 THR O O -3.518 -3.524 5.111 1.00 . A A . 17 THR O 1 1 2 969 1 1 17 THR OG1 O -7.076 -1.380 6.976 1.00 . A A . 17 THR OG1 1 1 2 970 1 1 18 GLY C C -2.950 -6.372 5.261 1.00 . A A . 18 GLY C 1 1 2 971 1 1 18 GLY CA C -3.351 -5.854 6.619 1.00 . A A . 18 GLY CA 1 1 2 972 1 1 18 GLY H H -5.313 -5.189 7.038 1.00 . A A . 18 GLY H 1 1 2 973 1 1 18 GLY HA2 H -2.521 -5.313 7.048 1.00 . A A . 18 GLY HA2 1 1 2 974 1 1 18 GLY HA3 H -3.593 -6.691 7.256 1.00 . A A . 18 GLY HA3 1 1 2 975 1 1 18 GLY N N -4.495 -4.975 6.539 1.00 . A A . 18 GLY N 1 1 2 976 1 1 18 GLY O O -1.774 -6.363 4.920 1.00 . A A . 18 GLY O 1 1 2 977 1 1 19 SER C C -3.104 -6.234 2.208 1.00 . A A . 19 SER C 1 1 2 978 1 1 19 SER CA C -3.746 -7.283 3.139 1.00 . A A . 19 SER CA 1 1 2 979 1 1 19 SER CB C -5.100 -7.724 2.591 1.00 . A A . 19 SER CB 1 1 2 980 1 1 19 SER H H -4.863 -6.682 4.799 1.00 . A A . 19 SER H 1 1 2 981 1 1 19 SER HA H -3.102 -8.147 3.200 1.00 . A A . 19 SER HA 1 1 2 982 1 1 19 SER HB2 H -5.709 -6.852 2.407 1.00 . A A . 19 SER HB2 1 1 2 983 1 1 19 SER HB3 H -4.960 -8.269 1.670 1.00 . A A . 19 SER HB3 1 1 2 984 1 1 19 SER HG H -5.117 -9.172 3.907 1.00 . A A . 19 SER HG 1 1 2 985 1 1 19 SER N N -3.944 -6.752 4.470 1.00 . A A . 19 SER N 1 1 2 986 1 1 19 SER O O -2.151 -6.536 1.478 1.00 . A A . 19 SER O 1 1 2 987 1 1 19 SER OG O -5.768 -8.563 3.531 1.00 . A A . 19 SER OG 1 1 2 988 1 1 20 CYS C C -1.675 -3.568 1.855 1.00 . A A . 20 CYS C 1 1 2 989 1 1 20 CYS CA C -3.100 -3.916 1.437 1.00 . A A . 20 CYS CA 1 1 2 990 1 1 20 CYS CB C -4.001 -2.688 1.596 1.00 . A A . 20 CYS CB 1 1 2 991 1 1 20 CYS H H -4.356 -4.833 2.877 1.00 . A A . 20 CYS H 1 1 2 992 1 1 20 CYS HA H -3.106 -4.229 0.404 1.00 . A A . 20 CYS HA 1 1 2 993 1 1 20 CYS HB2 H -4.993 -2.912 1.237 1.00 . A A . 20 CYS HB2 1 1 2 994 1 1 20 CYS HB3 H -4.053 -2.429 2.645 1.00 . A A . 20 CYS HB3 1 1 2 995 1 1 20 CYS N N -3.614 -5.015 2.260 1.00 . A A . 20 CYS N 1 1 2 996 1 1 20 CYS O O -0.749 -3.489 1.026 1.00 . A A . 20 CYS O 1 1 2 997 1 1 20 CYS SG S -3.430 -1.211 0.716 1.00 . A A . 20 CYS SG 1 1 2 998 1 1 21 ASP C C 0.819 -4.100 3.427 1.00 . A A . 21 ASP C 1 1 2 999 1 1 21 ASP CA C -0.242 -3.079 3.767 1.00 . A A . 21 ASP CA 1 1 2 1000 1 1 21 ASP CB C -0.426 -2.978 5.279 1.00 . A A . 21 ASP CB 1 1 2 1001 1 1 21 ASP CG C 0.838 -2.663 6.016 1.00 . A A . 21 ASP CG 1 1 2 1002 1 1 21 ASP H H -2.280 -3.544 3.750 1.00 . A A . 21 ASP H 1 1 2 1003 1 1 21 ASP HA H 0.065 -2.113 3.396 1.00 . A A . 21 ASP HA 1 1 2 1004 1 1 21 ASP HB2 H -1.144 -2.202 5.494 1.00 . A A . 21 ASP HB2 1 1 2 1005 1 1 21 ASP HB3 H -0.812 -3.918 5.643 1.00 . A A . 21 ASP HB3 1 1 2 1006 1 1 21 ASP N N -1.506 -3.424 3.156 1.00 . A A . 21 ASP N 1 1 2 1007 1 1 21 ASP O O 1.922 -3.744 2.995 1.00 . A A . 21 ASP O 1 1 2 1008 1 1 21 ASP OD1 O 1.247 -3.467 6.885 1.00 . A A . 21 ASP OD1 1 1 2 1009 1 1 21 ASP OD2 O 1.444 -1.610 5.759 1.00 . A A . 21 ASP OD2 1 1 2 1010 1 1 22 ASP C C 1.805 -6.500 1.855 1.00 . A A . 22 ASP C 1 1 2 1011 1 1 22 ASP CA C 1.327 -6.505 3.297 1.00 . A A . 22 ASP CA 1 1 2 1012 1 1 22 ASP CB C 0.572 -7.809 3.563 1.00 . A A . 22 ASP CB 1 1 2 1013 1 1 22 ASP CG C 1.427 -9.046 3.437 1.00 . A A . 22 ASP CG 1 1 2 1014 1 1 22 ASP H H -0.479 -5.547 3.836 1.00 . A A . 22 ASP H 1 1 2 1015 1 1 22 ASP HA H 2.174 -6.453 3.964 1.00 . A A . 22 ASP HA 1 1 2 1016 1 1 22 ASP HB2 H 0.167 -7.783 4.563 1.00 . A A . 22 ASP HB2 1 1 2 1017 1 1 22 ASP HB3 H -0.245 -7.885 2.860 1.00 . A A . 22 ASP HB3 1 1 2 1018 1 1 22 ASP N N 0.446 -5.365 3.554 1.00 . A A . 22 ASP N 1 1 2 1019 1 1 22 ASP O O 3.006 -6.656 1.584 1.00 . A A . 22 ASP O 1 1 2 1020 1 1 22 ASP OD1 O 1.816 -9.611 4.480 1.00 . A A . 22 ASP OD1 1 1 2 1021 1 1 22 ASP OD2 O 1.707 -9.488 2.310 1.00 . A A . 22 ASP OD2 1 1 2 1022 1 1 23 HIS C C 2.179 -5.243 -0.854 1.00 . A A . 23 HIS C 1 1 2 1023 1 1 23 HIS CA C 1.133 -6.292 -0.480 1.00 . A A . 23 HIS CA 1 1 2 1024 1 1 23 HIS CB C -0.184 -6.068 -1.263 1.00 . A A . 23 HIS CB 1 1 2 1025 1 1 23 HIS CD2 C 0.257 -5.076 -3.625 1.00 . A A . 23 HIS CD2 1 1 2 1026 1 1 23 HIS CE1 C -0.086 -6.842 -4.829 1.00 . A A . 23 HIS CE1 1 1 2 1027 1 1 23 HIS CG C -0.050 -6.083 -2.767 1.00 . A A . 23 HIS CG 1 1 2 1028 1 1 23 HIS H H -0.045 -6.089 1.253 1.00 . A A . 23 HIS H 1 1 2 1029 1 1 23 HIS HA H 1.521 -7.267 -0.734 1.00 . A A . 23 HIS HA 1 1 2 1030 1 1 23 HIS HB2 H -0.882 -6.849 -0.999 1.00 . A A . 23 HIS HB2 1 1 2 1031 1 1 23 HIS HB3 H -0.606 -5.118 -0.973 1.00 . A A . 23 HIS HB3 1 1 2 1032 1 1 23 HIS HD1 H -0.498 -8.098 -3.239 1.00 . A A . 23 HIS HD1 1 1 2 1033 1 1 23 HIS HD2 H 0.483 -4.057 -3.344 1.00 . A A . 23 HIS HD2 1 1 2 1034 1 1 23 HIS HE1 H -0.192 -7.513 -5.670 1.00 . A A . 23 HIS HE1 1 1 2 1035 1 1 23 HIS N N 0.869 -6.279 0.949 1.00 . A A . 23 HIS N 1 1 2 1036 1 1 23 HIS ND1 N -0.266 -7.195 -3.551 1.00 . A A . 23 HIS ND1 1 1 2 1037 1 1 23 HIS NE2 N 0.234 -5.562 -4.927 1.00 . A A . 23 HIS NE2 1 1 2 1038 1 1 23 HIS O O 3.180 -5.554 -1.502 1.00 . A A . 23 HIS O 1 1 2 1039 1 1 24 CYS C C 4.259 -3.116 -0.121 1.00 . A A . 24 CYS C 1 1 2 1040 1 1 24 CYS CA C 2.886 -2.968 -0.760 1.00 . A A . 24 CYS CA 1 1 2 1041 1 1 24 CYS CB C 2.266 -1.598 -0.509 1.00 . A A . 24 CYS CB 1 1 2 1042 1 1 24 CYS H H 1.219 -3.842 0.184 1.00 . A A . 24 CYS H 1 1 2 1043 1 1 24 CYS HA H 3.034 -3.074 -1.825 1.00 . A A . 24 CYS HA 1 1 2 1044 1 1 24 CYS HB2 H 1.933 -1.540 0.517 1.00 . A A . 24 CYS HB2 1 1 2 1045 1 1 24 CYS HB3 H 3.007 -0.835 -0.691 1.00 . A A . 24 CYS HB3 1 1 2 1046 1 1 24 CYS N N 1.985 -4.031 -0.402 1.00 . A A . 24 CYS N 1 1 2 1047 1 1 24 CYS O O 5.258 -2.792 -0.738 1.00 . A A . 24 CYS O 1 1 2 1048 1 1 24 CYS SG S 0.833 -1.263 -1.589 1.00 . A A . 24 CYS SG 1 1 2 1049 1 1 25 LYS C C 6.404 -5.011 1.238 1.00 . A A . 25 LYS C 1 1 2 1050 1 1 25 LYS CA C 5.627 -3.801 1.729 1.00 . A A . 25 LYS CA 1 1 2 1051 1 1 25 LYS CB C 5.535 -3.781 3.248 1.00 . A A . 25 LYS CB 1 1 2 1052 1 1 25 LYS CD C 4.587 -4.689 5.411 1.00 . A A . 25 LYS CD 1 1 2 1053 1 1 25 LYS CE C 4.231 -3.259 5.831 1.00 . A A . 25 LYS CE 1 1 2 1054 1 1 25 LYS CG C 4.645 -4.834 3.884 1.00 . A A . 25 LYS CG 1 1 2 1055 1 1 25 LYS H H 3.510 -3.951 1.535 1.00 . A A . 25 LYS H 1 1 2 1056 1 1 25 LYS HA H 6.196 -2.936 1.419 1.00 . A A . 25 LYS HA 1 1 2 1057 1 1 25 LYS HB2 H 6.530 -3.940 3.628 1.00 . A A . 25 LYS HB2 1 1 2 1058 1 1 25 LYS HB3 H 5.165 -2.806 3.523 1.00 . A A . 25 LYS HB3 1 1 2 1059 1 1 25 LYS HD2 H 3.836 -5.361 5.798 1.00 . A A . 25 LYS HD2 1 1 2 1060 1 1 25 LYS HD3 H 5.551 -4.949 5.824 1.00 . A A . 25 LYS HD3 1 1 2 1061 1 1 25 LYS HE2 H 5.073 -2.613 5.630 1.00 . A A . 25 LYS HE2 1 1 2 1062 1 1 25 LYS HE3 H 3.384 -2.931 5.247 1.00 . A A . 25 LYS HE3 1 1 2 1063 1 1 25 LYS HG2 H 3.647 -4.731 3.485 1.00 . A A . 25 LYS HG2 1 1 2 1064 1 1 25 LYS HG3 H 5.030 -5.813 3.637 1.00 . A A . 25 LYS HG3 1 1 2 1065 1 1 25 LYS HZ1 H 3.824 -2.157 7.558 1.00 . A A . 25 LYS HZ1 1 1 2 1066 1 1 25 LYS HZ2 H 4.551 -3.664 7.887 1.00 . A A . 25 LYS HZ2 1 1 2 1067 1 1 25 LYS HZ3 H 2.938 -3.554 7.381 1.00 . A A . 25 LYS HZ3 1 1 2 1068 1 1 25 LYS N N 4.330 -3.653 1.081 1.00 . A A . 25 LYS N 1 1 2 1069 1 1 25 LYS NZ N 3.896 -3.151 7.265 1.00 . A A . 25 LYS NZ 1 1 2 1070 1 1 25 LYS O O 7.625 -4.986 1.182 1.00 . A A . 25 LYS O 1 1 2 1071 1 1 26 ASN C C 6.556 -7.267 -1.099 1.00 . A A . 26 ASN C 1 1 2 1072 1 1 26 ASN CA C 6.395 -7.269 0.404 1.00 . A A . 26 ASN CA 1 1 2 1073 1 1 26 ASN CB C 5.731 -8.573 0.852 1.00 . A A . 26 ASN CB 1 1 2 1074 1 1 26 ASN CG C 5.813 -8.801 2.332 1.00 . A A . 26 ASN CG 1 1 2 1075 1 1 26 ASN H H 4.739 -6.027 1.038 1.00 . A A . 26 ASN H 1 1 2 1076 1 1 26 ASN HA H 7.390 -7.237 0.823 1.00 . A A . 26 ASN HA 1 1 2 1077 1 1 26 ASN HB2 H 4.690 -8.558 0.570 1.00 . A A . 26 ASN HB2 1 1 2 1078 1 1 26 ASN HB3 H 6.223 -9.396 0.355 1.00 . A A . 26 ASN HB3 1 1 2 1079 1 1 26 ASN HD21 H 4.001 -8.064 2.558 1.00 . A A . 26 ASN HD21 1 1 2 1080 1 1 26 ASN HD22 H 4.775 -8.600 4.003 1.00 . A A . 26 ASN HD22 1 1 2 1081 1 1 26 ASN N N 5.712 -6.067 0.904 1.00 . A A . 26 ASN N 1 1 2 1082 1 1 26 ASN ND2 N 4.769 -8.452 3.035 1.00 . A A . 26 ASN ND2 1 1 2 1083 1 1 26 ASN O O 7.678 -7.251 -1.598 1.00 . A A . 26 ASN O 1 1 2 1084 1 1 26 ASN OD1 O 6.805 -9.328 2.831 1.00 . A A . 26 ASN OD1 1 1 2 1085 1 1 27 LYS C C 6.115 -6.067 -3.885 1.00 . A A . 27 LYS C 1 1 2 1086 1 1 27 LYS CA C 5.474 -7.299 -3.277 1.00 . A A . 27 LYS CA 1 1 2 1087 1 1 27 LYS CB C 4.052 -7.526 -3.842 1.00 . A A . 27 LYS CB 1 1 2 1088 1 1 27 LYS CD C 4.853 -8.263 -6.142 1.00 . A A . 27 LYS CD 1 1 2 1089 1 1 27 LYS CE C 4.831 -7.917 -7.624 1.00 . A A . 27 LYS CE 1 1 2 1090 1 1 27 LYS CG C 3.921 -7.349 -5.358 1.00 . A A . 27 LYS CG 1 1 2 1091 1 1 27 LYS H H 4.580 -7.135 -1.373 1.00 . A A . 27 LYS H 1 1 2 1092 1 1 27 LYS HA H 6.082 -8.152 -3.538 1.00 . A A . 27 LYS HA 1 1 2 1093 1 1 27 LYS HB2 H 3.740 -8.528 -3.590 1.00 . A A . 27 LYS HB2 1 1 2 1094 1 1 27 LYS HB3 H 3.382 -6.829 -3.361 1.00 . A A . 27 LYS HB3 1 1 2 1095 1 1 27 LYS HD2 H 5.859 -8.142 -5.771 1.00 . A A . 27 LYS HD2 1 1 2 1096 1 1 27 LYS HD3 H 4.538 -9.288 -6.013 1.00 . A A . 27 LYS HD3 1 1 2 1097 1 1 27 LYS HE2 H 5.485 -8.599 -8.148 1.00 . A A . 27 LYS HE2 1 1 2 1098 1 1 27 LYS HE3 H 3.822 -8.037 -7.989 1.00 . A A . 27 LYS HE3 1 1 2 1099 1 1 27 LYS HG2 H 2.904 -7.564 -5.650 1.00 . A A . 27 LYS HG2 1 1 2 1100 1 1 27 LYS HG3 H 4.150 -6.322 -5.602 1.00 . A A . 27 LYS HG3 1 1 2 1101 1 1 27 LYS HZ1 H 5.220 -6.320 -8.911 1.00 . A A . 27 LYS HZ1 1 1 2 1102 1 1 27 LYS HZ2 H 6.274 -6.367 -7.603 1.00 . A A . 27 LYS HZ2 1 1 2 1103 1 1 27 LYS HZ3 H 4.708 -5.803 -7.393 1.00 . A A . 27 LYS HZ3 1 1 2 1104 1 1 27 LYS N N 5.449 -7.229 -1.821 1.00 . A A . 27 LYS N 1 1 2 1105 1 1 27 LYS NZ N 5.287 -6.519 -7.891 1.00 . A A . 27 LYS NZ 1 1 2 1106 1 1 27 LYS O O 6.990 -6.171 -4.744 1.00 . A A . 27 LYS O 1 1 2 1107 1 1 28 GLU C C 7.475 -3.226 -3.277 1.00 . A A . 28 GLU C 1 1 2 1108 1 1 28 GLU CA C 6.221 -3.690 -4.004 1.00 . A A . 28 GLU CA 1 1 2 1109 1 1 28 GLU CB C 5.151 -2.612 -4.015 1.00 . A A . 28 GLU CB 1 1 2 1110 1 1 28 GLU CD C 4.330 -3.273 -6.285 1.00 . A A . 28 GLU CD 1 1 2 1111 1 1 28 GLU CG C 3.947 -2.969 -4.861 1.00 . A A . 28 GLU CG 1 1 2 1112 1 1 28 GLU H H 5.001 -4.916 -2.756 1.00 . A A . 28 GLU H 1 1 2 1113 1 1 28 GLU HA H 6.497 -3.906 -5.027 1.00 . A A . 28 GLU HA 1 1 2 1114 1 1 28 GLU HB2 H 4.815 -2.447 -3.003 1.00 . A A . 28 GLU HB2 1 1 2 1115 1 1 28 GLU HB3 H 5.579 -1.700 -4.404 1.00 . A A . 28 GLU HB3 1 1 2 1116 1 1 28 GLU HG2 H 3.472 -3.843 -4.439 1.00 . A A . 28 GLU HG2 1 1 2 1117 1 1 28 GLU HG3 H 3.253 -2.141 -4.857 1.00 . A A . 28 GLU HG3 1 1 2 1118 1 1 28 GLU N N 5.698 -4.923 -3.447 1.00 . A A . 28 GLU N 1 1 2 1119 1 1 28 GLU O O 8.152 -2.307 -3.725 1.00 . A A . 28 GLU O 1 1 2 1120 1 1 28 GLU OE1 O 4.757 -2.355 -7.005 1.00 . A A . 28 GLU OE1 1 1 2 1121 1 1 28 GLU OE2 O 4.172 -4.419 -6.732 1.00 . A A . 28 GLU OE2 1 1 2 1122 1 1 29 HIS C C 8.928 -2.146 -0.794 1.00 . A A . 29 HIS C 1 1 2 1123 1 1 29 HIS CA C 8.950 -3.607 -1.308 1.00 . A A . 29 HIS CA 1 1 2 1124 1 1 29 HIS CB C 10.250 -3.929 -2.099 1.00 . A A . 29 HIS CB 1 1 2 1125 1 1 29 HIS CD2 C 11.987 -5.094 -0.566 1.00 . A A . 29 HIS CD2 1 1 2 1126 1 1 29 HIS CE1 C 13.384 -3.460 -0.279 1.00 . A A . 29 HIS CE1 1 1 2 1127 1 1 29 HIS CG C 11.497 -4.038 -1.256 1.00 . A A . 29 HIS CG 1 1 2 1128 1 1 29 HIS H H 7.148 -4.583 -1.867 1.00 . A A . 29 HIS H 1 1 2 1129 1 1 29 HIS HA H 8.882 -4.262 -0.450 1.00 . A A . 29 HIS HA 1 1 2 1130 1 1 29 HIS HB2 H 10.124 -4.871 -2.612 1.00 . A A . 29 HIS HB2 1 1 2 1131 1 1 29 HIS HB3 H 10.406 -3.152 -2.831 1.00 . A A . 29 HIS HB3 1 1 2 1132 1 1 29 HIS HD1 H 12.316 -2.096 -1.415 1.00 . A A . 29 HIS HD1 1 1 2 1133 1 1 29 HIS HD2 H 11.525 -6.069 -0.499 1.00 . A A . 29 HIS HD2 1 1 2 1134 1 1 29 HIS HE1 H 14.229 -2.867 0.040 1.00 . A A . 29 HIS HE1 1 1 2 1135 1 1 29 HIS N N 7.764 -3.877 -2.147 1.00 . A A . 29 HIS N 1 1 2 1136 1 1 29 HIS ND1 N 12.398 -3.011 -1.060 1.00 . A A . 29 HIS ND1 1 1 2 1137 1 1 29 HIS NE2 N 13.183 -4.729 0.050 1.00 . A A . 29 HIS NE2 1 1 2 1138 1 1 29 HIS O O 9.960 -1.534 -0.519 1.00 . A A . 29 HIS O 1 1 2 1139 1 1 30 LEU C C 7.583 -0.259 1.357 1.00 . A A . 30 LEU C 1 1 2 1140 1 1 30 LEU CA C 7.568 -0.269 -0.157 1.00 . A A . 30 LEU CA 1 1 2 1141 1 1 30 LEU CB C 6.244 0.319 -0.672 1.00 . A A . 30 LEU CB 1 1 2 1142 1 1 30 LEU CD1 C 4.726 0.970 -2.568 1.00 . A A . 30 LEU CD1 1 1 2 1143 1 1 30 LEU CD2 C 7.191 0.909 -2.927 1.00 . A A . 30 LEU CD2 1 1 2 1144 1 1 30 LEU CG C 6.026 0.289 -2.188 1.00 . A A . 30 LEU CG 1 1 2 1145 1 1 30 LEU H H 6.947 -2.169 -0.808 1.00 . A A . 30 LEU H 1 1 2 1146 1 1 30 LEU HA H 8.389 0.329 -0.525 1.00 . A A . 30 LEU HA 1 1 2 1147 1 1 30 LEU HB2 H 5.437 -0.230 -0.209 1.00 . A A . 30 LEU HB2 1 1 2 1148 1 1 30 LEU HB3 H 6.183 1.346 -0.343 1.00 . A A . 30 LEU HB3 1 1 2 1149 1 1 30 LEU HD11 H 4.739 1.993 -2.223 1.00 . A A . 30 LEU HD11 1 1 2 1150 1 1 30 LEU HD12 H 3.898 0.446 -2.116 1.00 . A A . 30 LEU HD12 1 1 2 1151 1 1 30 LEU HD13 H 4.615 0.957 -3.642 1.00 . A A . 30 LEU HD13 1 1 2 1152 1 1 30 LEU HD21 H 7.337 1.924 -2.587 1.00 . A A . 30 LEU HD21 1 1 2 1153 1 1 30 LEU HD22 H 6.966 0.914 -3.983 1.00 . A A . 30 LEU HD22 1 1 2 1154 1 1 30 LEU HD23 H 8.082 0.329 -2.745 1.00 . A A . 30 LEU HD23 1 1 2 1155 1 1 30 LEU HG H 5.948 -0.745 -2.491 1.00 . A A . 30 LEU HG 1 1 2 1156 1 1 30 LEU N N 7.741 -1.621 -0.625 1.00 . A A . 30 LEU N 1 1 2 1157 1 1 30 LEU O O 7.701 -1.319 1.992 1.00 . A A . 30 LEU O 1 1 2 1158 1 1 31 ARG C C 6.225 0.372 3.964 1.00 . A A . 31 ARG C 1 1 2 1159 1 1 31 ARG CA C 7.451 1.047 3.367 1.00 . A A . 31 ARG CA 1 1 2 1160 1 1 31 ARG CB C 7.507 2.526 3.763 1.00 . A A . 31 ARG CB 1 1 2 1161 1 1 31 ARG CD C 7.582 4.258 5.559 1.00 . A A . 31 ARG CD 1 1 2 1162 1 1 31 ARG CG C 7.488 2.778 5.261 1.00 . A A . 31 ARG CG 1 1 2 1163 1 1 31 ARG CZ C 8.485 5.251 7.655 1.00 . A A . 31 ARG CZ 1 1 2 1164 1 1 31 ARG H H 7.313 1.707 1.379 1.00 . A A . 31 ARG H 1 1 2 1165 1 1 31 ARG HA H 8.336 0.552 3.739 1.00 . A A . 31 ARG HA 1 1 2 1166 1 1 31 ARG HB2 H 8.412 2.958 3.360 1.00 . A A . 31 ARG HB2 1 1 2 1167 1 1 31 ARG HB3 H 6.659 3.029 3.322 1.00 . A A . 31 ARG HB3 1 1 2 1168 1 1 31 ARG HD2 H 8.501 4.639 5.141 1.00 . A A . 31 ARG HD2 1 1 2 1169 1 1 31 ARG HD3 H 6.747 4.758 5.090 1.00 . A A . 31 ARG HD3 1 1 2 1170 1 1 31 ARG HE H 6.750 4.196 7.454 1.00 . A A . 31 ARG HE 1 1 2 1171 1 1 31 ARG HG2 H 6.566 2.393 5.671 1.00 . A A . 31 ARG HG2 1 1 2 1172 1 1 31 ARG HG3 H 8.326 2.272 5.715 1.00 . A A . 31 ARG HG3 1 1 2 1173 1 1 31 ARG HH11 H 9.831 5.360 6.101 1.00 . A A . 31 ARG HH11 1 1 2 1174 1 1 31 ARG HH12 H 10.302 6.153 7.535 1.00 . A A . 31 ARG HH12 1 1 2 1175 1 1 31 ARG HH21 H 7.487 5.262 9.431 1.00 . A A . 31 ARG HH21 1 1 2 1176 1 1 31 ARG HH22 H 8.994 6.094 9.434 1.00 . A A . 31 ARG HH22 1 1 2 1177 1 1 31 ARG N N 7.442 0.910 1.936 1.00 . A A . 31 ARG N 1 1 2 1178 1 1 31 ARG NE N 7.554 4.539 6.997 1.00 . A A . 31 ARG NE 1 1 2 1179 1 1 31 ARG NH1 N 9.616 5.606 7.050 1.00 . A A . 31 ARG NH1 1 1 2 1180 1 1 31 ARG NH2 N 8.308 5.557 8.933 1.00 . A A . 31 ARG NH2 1 1 2 1181 1 1 31 ARG O O 6.336 -0.529 4.788 1.00 . A A . 31 ARG O 1 1 2 1182 1 1 32 SER C C 2.700 0.569 3.045 1.00 . A A . 32 SER C 1 1 2 1183 1 1 32 SER CA C 3.808 0.265 4.034 1.00 . A A . 32 SER CA 1 1 2 1184 1 1 32 SER CB C 3.473 0.892 5.402 1.00 . A A . 32 SER CB 1 1 2 1185 1 1 32 SER H H 5.009 1.473 2.827 1.00 . A A . 32 SER H 1 1 2 1186 1 1 32 SER HA H 3.907 -0.804 4.150 1.00 . A A . 32 SER HA 1 1 2 1187 1 1 32 SER HB2 H 3.402 1.964 5.296 1.00 . A A . 32 SER HB2 1 1 2 1188 1 1 32 SER HB3 H 2.528 0.503 5.748 1.00 . A A . 32 SER HB3 1 1 2 1189 1 1 32 SER HG H 5.219 0.179 5.902 1.00 . A A . 32 SER HG 1 1 2 1190 1 1 32 SER N N 5.059 0.792 3.532 1.00 . A A . 32 SER N 1 1 2 1191 1 1 32 SER O O 2.899 1.360 2.108 1.00 . A A . 32 SER O 1 1 2 1192 1 1 32 SER OG O 4.478 0.594 6.368 1.00 . A A . 32 SER OG 1 1 2 1193 1 1 33 GLY C C -0.692 0.721 3.241 1.00 . A A . 33 GLY C 1 1 2 1194 1 1 33 GLY CA C 0.425 0.212 2.399 1.00 . A A . 33 GLY CA 1 1 2 1195 1 1 33 GLY H H 1.465 -0.672 3.994 1.00 . A A . 33 GLY H 1 1 2 1196 1 1 33 GLY HA2 H 0.696 0.959 1.668 1.00 . A A . 33 GLY HA2 1 1 2 1197 1 1 33 GLY HA3 H 0.112 -0.685 1.886 1.00 . A A . 33 GLY HA3 1 1 2 1198 1 1 33 GLY N N 1.563 -0.044 3.240 1.00 . A A . 33 GLY N 1 1 2 1199 1 1 33 GLY O O -1.019 0.110 4.262 1.00 . A A . 33 GLY O 1 1 2 1200 1 1 34 ARG C C -3.580 2.483 2.977 1.00 . A A . 34 ARG C 1 1 2 1201 1 1 34 ARG CA C -2.259 2.448 3.704 1.00 . A A . 34 ARG CA 1 1 2 1202 1 1 34 ARG CB C -1.843 3.855 4.156 1.00 . A A . 34 ARG CB 1 1 2 1203 1 1 34 ARG CD C -0.706 3.314 6.409 1.00 . A A . 34 ARG CD 1 1 2 1204 1 1 34 ARG CG C -0.559 3.932 5.006 1.00 . A A . 34 ARG CG 1 1 2 1205 1 1 34 ARG CZ C -1.181 1.101 7.475 1.00 . A A . 34 ARG CZ 1 1 2 1206 1 1 34 ARG H H -1.010 2.295 2.049 1.00 . A A . 34 ARG H 1 1 2 1207 1 1 34 ARG HA H -2.379 1.826 4.578 1.00 . A A . 34 ARG HA 1 1 2 1208 1 1 34 ARG HB2 H -1.691 4.461 3.275 1.00 . A A . 34 ARG HB2 1 1 2 1209 1 1 34 ARG HB3 H -2.653 4.283 4.728 1.00 . A A . 34 ARG HB3 1 1 2 1210 1 1 34 ARG HD2 H 0.187 3.532 6.976 1.00 . A A . 34 ARG HD2 1 1 2 1211 1 1 34 ARG HD3 H -1.549 3.782 6.894 1.00 . A A . 34 ARG HD3 1 1 2 1212 1 1 34 ARG HE H -0.816 1.412 5.526 1.00 . A A . 34 ARG HE 1 1 2 1213 1 1 34 ARG HG2 H 0.228 3.404 4.487 1.00 . A A . 34 ARG HG2 1 1 2 1214 1 1 34 ARG HG3 H -0.277 4.970 5.108 1.00 . A A . 34 ARG HG3 1 1 2 1215 1 1 34 ARG HH11 H -1.319 2.643 8.811 1.00 . A A . 34 ARG HH11 1 1 2 1216 1 1 34 ARG HH12 H -1.584 1.093 9.466 1.00 . A A . 34 ARG HH12 1 1 2 1217 1 1 34 ARG HH21 H -1.168 -0.643 6.449 1.00 . A A . 34 ARG HH21 1 1 2 1218 1 1 34 ARG HH22 H -1.479 -0.806 8.131 1.00 . A A . 34 ARG HH22 1 1 2 1219 1 1 34 ARG N N -1.242 1.843 2.892 1.00 . A A . 34 ARG N 1 1 2 1220 1 1 34 ARG NE N -0.908 1.853 6.403 1.00 . A A . 34 ARG NE 1 1 2 1221 1 1 34 ARG NH1 N -1.369 1.655 8.661 1.00 . A A . 34 ARG NH1 1 1 2 1222 1 1 34 ARG NH2 N -1.288 -0.209 7.345 1.00 . A A . 34 ARG NH2 1 1 2 1223 1 1 34 ARG O O -3.655 2.738 1.764 1.00 . A A . 34 ARG O 1 1 2 1224 1 1 35 CYS C C -6.602 3.501 3.483 1.00 . A A . 35 CYS C 1 1 2 1225 1 1 35 CYS CA C -5.920 2.203 3.171 1.00 . A A . 35 CYS CA 1 1 2 1226 1 1 35 CYS CB C -6.683 1.036 3.767 1.00 . A A . 35 CYS CB 1 1 2 1227 1 1 35 CYS H H -4.490 2.081 4.669 1.00 . A A . 35 CYS H 1 1 2 1228 1 1 35 CYS HA H -5.856 2.077 2.101 1.00 . A A . 35 CYS HA 1 1 2 1229 1 1 35 CYS HB2 H -6.836 1.212 4.821 1.00 . A A . 35 CYS HB2 1 1 2 1230 1 1 35 CYS HB3 H -7.641 0.943 3.276 1.00 . A A . 35 CYS HB3 1 1 2 1231 1 1 35 CYS N N -4.606 2.234 3.706 1.00 . A A . 35 CYS N 1 1 2 1232 1 1 35 CYS O O -6.796 3.853 4.648 1.00 . A A . 35 CYS O 1 1 2 1233 1 1 35 CYS SG S -5.808 -0.546 3.581 1.00 . A A . 35 CYS SG 1 1 2 1234 1 1 36 ARG C C -9.048 5.313 2.932 1.00 . A A . 36 ARG C 1 1 2 1235 1 1 36 ARG CA C -7.585 5.491 2.584 1.00 . A A . 36 ARG CA 1 1 2 1236 1 1 36 ARG CB C -7.477 6.263 1.281 1.00 . A A . 36 ARG CB 1 1 2 1237 1 1 36 ARG CD C -6.120 8.201 2.020 1.00 . A A . 36 ARG CD 1 1 2 1238 1 1 36 ARG CG C -6.182 7.021 1.088 1.00 . A A . 36 ARG CG 1 1 2 1239 1 1 36 ARG CZ C -7.770 9.865 2.839 1.00 . A A . 36 ARG CZ 1 1 2 1240 1 1 36 ARG H H -6.685 3.896 1.558 1.00 . A A . 36 ARG H 1 1 2 1241 1 1 36 ARG HA H -7.086 6.059 3.353 1.00 . A A . 36 ARG HA 1 1 2 1242 1 1 36 ARG HB2 H -7.590 5.570 0.462 1.00 . A A . 36 ARG HB2 1 1 2 1243 1 1 36 ARG HB3 H -8.291 6.973 1.243 1.00 . A A . 36 ARG HB3 1 1 2 1244 1 1 36 ARG HD2 H -6.020 7.854 3.037 1.00 . A A . 36 ARG HD2 1 1 2 1245 1 1 36 ARG HD3 H -5.261 8.801 1.755 1.00 . A A . 36 ARG HD3 1 1 2 1246 1 1 36 ARG HE H -7.861 8.919 1.070 1.00 . A A . 36 ARG HE 1 1 2 1247 1 1 36 ARG HG2 H -5.351 6.363 1.293 1.00 . A A . 36 ARG HG2 1 1 2 1248 1 1 36 ARG HG3 H -6.128 7.375 0.070 1.00 . A A . 36 ARG HG3 1 1 2 1249 1 1 36 ARG HH11 H -6.141 9.673 4.060 1.00 . A A . 36 ARG HH11 1 1 2 1250 1 1 36 ARG HH12 H -7.361 10.701 4.652 1.00 . A A . 36 ARG HH12 1 1 2 1251 1 1 36 ARG HH21 H -9.484 10.337 1.851 1.00 . A A . 36 ARG HH21 1 1 2 1252 1 1 36 ARG HH22 H -9.323 11.085 3.373 1.00 . A A . 36 ARG HH22 1 1 2 1253 1 1 36 ARG N N -6.914 4.229 2.453 1.00 . A A . 36 ARG N 1 1 2 1254 1 1 36 ARG NE N -7.328 9.034 1.900 1.00 . A A . 36 ARG NE 1 1 2 1255 1 1 36 ARG NH1 N -7.039 10.100 3.918 1.00 . A A . 36 ARG NH1 1 1 2 1256 1 1 36 ARG NH2 N -8.929 10.477 2.678 1.00 . A A . 36 ARG NH2 1 1 2 1257 1 1 36 ARG O O -9.595 4.207 2.850 1.00 . A A . 36 ARG O 1 1 2 1258 1 1 37 ASP C C -11.869 6.380 2.194 1.00 . A A . 37 ASP C 1 1 2 1259 1 1 37 ASP CA C -11.146 6.447 3.511 1.00 . A A . 37 ASP CA 1 1 2 1260 1 1 37 ASP CB C -11.582 7.685 4.295 1.00 . A A . 37 ASP CB 1 1 2 1261 1 1 37 ASP CG C -11.208 7.619 5.746 1.00 . A A . 37 ASP CG 1 1 2 1262 1 1 37 ASP H H -9.160 7.228 3.436 1.00 . A A . 37 ASP H 1 1 2 1263 1 1 37 ASP HA H -11.396 5.558 4.069 1.00 . A A . 37 ASP HA 1 1 2 1264 1 1 37 ASP HB2 H -11.103 8.554 3.869 1.00 . A A . 37 ASP HB2 1 1 2 1265 1 1 37 ASP HB3 H -12.654 7.796 4.217 1.00 . A A . 37 ASP HB3 1 1 2 1266 1 1 37 ASP N N -9.689 6.415 3.280 1.00 . A A . 37 ASP N 1 1 2 1267 1 1 37 ASP O O -13.077 6.224 2.124 1.00 . A A . 37 ASP O 1 1 2 1268 1 1 37 ASP OD1 O -10.146 8.116 6.118 1.00 . A A . 37 ASP OD1 1 1 2 1269 1 1 37 ASP OD2 O -11.990 7.052 6.549 1.00 . A A . 37 ASP OD2 1 1 2 1270 1 1 38 ASP C C -11.546 4.872 -0.556 1.00 . A A . 38 ASP C 1 1 2 1271 1 1 38 ASP CA C -11.538 6.355 -0.229 1.00 . A A . 38 ASP CA 1 1 2 1272 1 1 38 ASP CB C -10.553 7.054 -1.175 1.00 . A A . 38 ASP CB 1 1 2 1273 1 1 38 ASP CG C -10.250 8.472 -0.773 1.00 . A A . 38 ASP CG 1 1 2 1274 1 1 38 ASP H H -10.157 6.756 1.313 1.00 . A A . 38 ASP H 1 1 2 1275 1 1 38 ASP HA H -12.524 6.777 -0.349 1.00 . A A . 38 ASP HA 1 1 2 1276 1 1 38 ASP HB2 H -9.624 6.503 -1.188 1.00 . A A . 38 ASP HB2 1 1 2 1277 1 1 38 ASP HB3 H -10.971 7.061 -2.171 1.00 . A A . 38 ASP HB3 1 1 2 1278 1 1 38 ASP N N -11.089 6.506 1.145 1.00 . A A . 38 ASP N 1 1 2 1279 1 1 38 ASP O O -11.973 4.454 -1.621 1.00 . A A . 38 ASP O 1 1 2 1280 1 1 38 ASP OD1 O -9.255 8.693 -0.036 1.00 . A A . 38 ASP OD1 1 1 2 1281 1 1 38 ASP OD2 O -10.987 9.395 -1.169 1.00 . A A . 38 ASP OD2 1 1 2 1282 1 1 39 PHE C C -9.896 2.141 -0.721 1.00 . A A . 39 PHE C 1 1 2 1283 1 1 39 PHE CA C -10.876 2.634 0.329 1.00 . A A . 39 PHE CA 1 1 2 1284 1 1 39 PHE CB C -12.240 1.924 0.259 1.00 . A A . 39 PHE CB 1 1 2 1285 1 1 39 PHE CD1 C -14.077 3.086 1.520 1.00 . A A . 39 PHE CD1 1 1 2 1286 1 1 39 PHE CD2 C -12.813 1.414 2.649 1.00 . A A . 39 PHE CD2 1 1 2 1287 1 1 39 PHE CE1 C -14.819 3.304 2.665 1.00 . A A . 39 PHE CE1 1 1 2 1288 1 1 39 PHE CE2 C -13.553 1.623 3.795 1.00 . A A . 39 PHE CE2 1 1 2 1289 1 1 39 PHE CG C -13.067 2.141 1.497 1.00 . A A . 39 PHE CG 1 1 2 1290 1 1 39 PHE CZ C -14.557 2.573 3.804 1.00 . A A . 39 PHE CZ 1 1 2 1291 1 1 39 PHE H H -10.664 4.529 1.194 1.00 . A A . 39 PHE H 1 1 2 1292 1 1 39 PHE HA H -10.421 2.378 1.276 1.00 . A A . 39 PHE HA 1 1 2 1293 1 1 39 PHE HB2 H -12.796 2.307 -0.582 1.00 . A A . 39 PHE HB2 1 1 2 1294 1 1 39 PHE HB3 H -12.086 0.862 0.138 1.00 . A A . 39 PHE HB3 1 1 2 1295 1 1 39 PHE HD1 H -14.285 3.659 0.628 1.00 . A A . 39 PHE HD1 1 1 2 1296 1 1 39 PHE HD2 H -12.028 0.672 2.643 1.00 . A A . 39 PHE HD2 1 1 2 1297 1 1 39 PHE HE1 H -15.604 4.045 2.666 1.00 . A A . 39 PHE HE1 1 1 2 1298 1 1 39 PHE HE2 H -13.341 1.047 4.685 1.00 . A A . 39 PHE HE2 1 1 2 1299 1 1 39 PHE HZ H -15.137 2.745 4.699 1.00 . A A . 39 PHE HZ 1 1 2 1300 1 1 39 PHE N N -10.997 4.093 0.380 1.00 . A A . 39 PHE N 1 1 2 1301 1 1 39 PHE O O -9.713 0.948 -0.893 1.00 . A A . 39 PHE O 1 1 2 1302 1 1 40 ARG C C -6.874 2.676 -1.617 1.00 . A A . 40 ARG C 1 1 2 1303 1 1 40 ARG CA C -8.228 2.700 -2.347 1.00 . A A . 40 ARG CA 1 1 2 1304 1 1 40 ARG CB C -8.217 3.714 -3.503 1.00 . A A . 40 ARG CB 1 1 2 1305 1 1 40 ARG CD C -8.126 2.098 -5.420 1.00 . A A . 40 ARG CD 1 1 2 1306 1 1 40 ARG CG C -7.441 3.264 -4.727 1.00 . A A . 40 ARG CG 1 1 2 1307 1 1 40 ARG CZ C -7.810 0.777 -7.497 1.00 . A A . 40 ARG CZ 1 1 2 1308 1 1 40 ARG H H -9.438 3.993 -1.203 1.00 . A A . 40 ARG H 1 1 2 1309 1 1 40 ARG HA H -8.454 1.710 -2.717 1.00 . A A . 40 ARG HA 1 1 2 1310 1 1 40 ARG HB2 H -9.233 3.895 -3.820 1.00 . A A . 40 ARG HB2 1 1 2 1311 1 1 40 ARG HB3 H -7.782 4.638 -3.155 1.00 . A A . 40 ARG HB3 1 1 2 1312 1 1 40 ARG HD2 H -8.249 1.284 -4.721 1.00 . A A . 40 ARG HD2 1 1 2 1313 1 1 40 ARG HD3 H -9.095 2.423 -5.769 1.00 . A A . 40 ARG HD3 1 1 2 1314 1 1 40 ARG HE H -6.429 1.944 -6.591 1.00 . A A . 40 ARG HE 1 1 2 1315 1 1 40 ARG HG2 H -7.358 4.088 -5.418 1.00 . A A . 40 ARG HG2 1 1 2 1316 1 1 40 ARG HG3 H -6.455 2.953 -4.414 1.00 . A A . 40 ARG HG3 1 1 2 1317 1 1 40 ARG HH11 H -9.744 0.690 -6.802 1.00 . A A . 40 ARG HH11 1 1 2 1318 1 1 40 ARG HH12 H -9.443 -0.261 -8.175 1.00 . A A . 40 ARG HH12 1 1 2 1319 1 1 40 ARG HH21 H -6.025 0.622 -8.496 1.00 . A A . 40 ARG HH21 1 1 2 1320 1 1 40 ARG HH22 H -7.300 -0.273 -9.178 1.00 . A A . 40 ARG HH22 1 1 2 1321 1 1 40 ARG N N -9.235 3.054 -1.380 1.00 . A A . 40 ARG N 1 1 2 1322 1 1 40 ARG NE N -7.357 1.618 -6.559 1.00 . A A . 40 ARG NE 1 1 2 1323 1 1 40 ARG NH1 N -9.082 0.380 -7.490 1.00 . A A . 40 ARG NH1 1 1 2 1324 1 1 40 ARG NH2 N -6.990 0.343 -8.451 1.00 . A A . 40 ARG NH2 1 1 2 1325 1 1 40 ARG O O -6.726 3.321 -0.557 1.00 . A A . 40 ARG O 1 1 2 1326 1 1 41 CYS C C -3.601 2.820 -1.930 1.00 . A A . 41 CYS C 1 1 2 1327 1 1 41 CYS CA C -4.630 1.801 -1.503 1.00 . A A . 41 CYS CA 1 1 2 1328 1 1 41 CYS CB C -4.083 0.397 -1.683 1.00 . A A . 41 CYS CB 1 1 2 1329 1 1 41 CYS H H -6.057 1.495 -3.001 1.00 . A A . 41 CYS H 1 1 2 1330 1 1 41 CYS HA H -4.801 1.941 -0.446 1.00 . A A . 41 CYS HA 1 1 2 1331 1 1 41 CYS HB2 H -4.218 0.093 -2.711 1.00 . A A . 41 CYS HB2 1 1 2 1332 1 1 41 CYS HB3 H -3.028 0.396 -1.448 1.00 . A A . 41 CYS HB3 1 1 2 1333 1 1 41 CYS N N -5.921 1.951 -2.146 1.00 . A A . 41 CYS N 1 1 2 1334 1 1 41 CYS O O -3.214 2.895 -3.103 1.00 . A A . 41 CYS O 1 1 2 1335 1 1 41 CYS SG S -4.885 -0.834 -0.636 1.00 . A A . 41 CYS SG 1 1 2 1336 1 1 42 TRP C C -0.937 4.000 -0.321 1.00 . A A . 42 TRP C 1 1 2 1337 1 1 42 TRP CA C -2.097 4.525 -1.119 1.00 . A A . 42 TRP CA 1 1 2 1338 1 1 42 TRP CB C -2.500 5.906 -0.613 1.00 . A A . 42 TRP CB 1 1 2 1339 1 1 42 TRP CD1 C -1.965 7.734 -2.322 1.00 . A A . 42 TRP CD1 1 1 2 1340 1 1 42 TRP CD2 C -4.131 7.179 -2.254 1.00 . A A . 42 TRP CD2 1 1 2 1341 1 1 42 TRP CE2 C -3.955 8.206 -3.199 1.00 . A A . 42 TRP CE2 1 1 2 1342 1 1 42 TRP CE3 C -5.415 6.668 -2.054 1.00 . A A . 42 TRP CE3 1 1 2 1343 1 1 42 TRP CG C -2.840 6.897 -1.691 1.00 . A A . 42 TRP CG 1 1 2 1344 1 1 42 TRP CH2 C -6.253 8.217 -3.712 1.00 . A A . 42 TRP CH2 1 1 2 1345 1 1 42 TRP CZ2 C -5.009 8.734 -3.932 1.00 . A A . 42 TRP CZ2 1 1 2 1346 1 1 42 TRP CZ3 C -6.463 7.193 -2.786 1.00 . A A . 42 TRP CZ3 1 1 2 1347 1 1 42 TRP H H -3.536 3.472 -0.063 1.00 . A A . 42 TRP H 1 1 2 1348 1 1 42 TRP HA H -1.826 4.575 -2.162 1.00 . A A . 42 TRP HA 1 1 2 1349 1 1 42 TRP HB2 H -3.372 5.796 0.016 1.00 . A A . 42 TRP HB2 1 1 2 1350 1 1 42 TRP HB3 H -1.692 6.312 -0.023 1.00 . A A . 42 TRP HB3 1 1 2 1351 1 1 42 TRP HD1 H -0.904 7.771 -2.131 1.00 . A A . 42 TRP HD1 1 1 2 1352 1 1 42 TRP HE1 H -2.230 9.217 -3.791 1.00 . A A . 42 TRP HE1 1 1 2 1353 1 1 42 TRP HE3 H -5.589 5.871 -1.348 1.00 . A A . 42 TRP HE3 1 1 2 1354 1 1 42 TRP HH2 H -7.101 8.596 -4.261 1.00 . A A . 42 TRP HH2 1 1 2 1355 1 1 42 TRP HZ2 H -4.863 9.526 -4.651 1.00 . A A . 42 TRP HZ2 1 1 2 1356 1 1 42 TRP HZ3 H -7.467 6.819 -2.647 1.00 . A A . 42 TRP HZ3 1 1 2 1357 1 1 42 TRP N N -3.163 3.582 -0.967 1.00 . A A . 42 TRP N 1 1 2 1358 1 1 42 TRP NE1 N -2.632 8.529 -3.213 1.00 . A A . 42 TRP NE1 1 1 2 1359 1 1 42 TRP O O -1.001 3.906 0.905 1.00 . A A . 42 TRP O 1 1 2 1360 1 1 43 CYS C C 2.371 3.946 -0.292 1.00 . A A . 43 CYS C 1 1 2 1361 1 1 43 CYS CA C 1.186 3.013 -0.335 1.00 . A A . 43 CYS CA 1 1 2 1362 1 1 43 CYS CB C 1.505 1.682 -1.006 1.00 . A A . 43 CYS CB 1 1 2 1363 1 1 43 CYS H H 0.127 3.795 -1.952 1.00 . A A . 43 CYS H 1 1 2 1364 1 1 43 CYS HA H 0.879 2.812 0.681 1.00 . A A . 43 CYS HA 1 1 2 1365 1 1 43 CYS HB2 H 1.762 1.854 -2.041 1.00 . A A . 43 CYS HB2 1 1 2 1366 1 1 43 CYS HB3 H 2.338 1.219 -0.497 1.00 . A A . 43 CYS HB3 1 1 2 1367 1 1 43 CYS N N 0.083 3.626 -0.984 1.00 . A A . 43 CYS N 1 1 2 1368 1 1 43 CYS O O 2.707 4.609 -1.287 1.00 . A A . 43 CYS O 1 1 2 1369 1 1 43 CYS SG S 0.093 0.518 -0.951 1.00 . A A . 43 CYS SG 1 1 2 1370 1 1 44 THR C C 5.343 4.211 0.526 1.00 . A A . 44 THR C 1 1 2 1371 1 1 44 THR CA C 4.082 4.879 1.089 1.00 . A A . 44 THR CA 1 1 2 1372 1 1 44 THR CB C 4.230 5.111 2.599 1.00 . A A . 44 THR CB 1 1 2 1373 1 1 44 THR CG2 C 5.171 6.271 2.871 1.00 . A A . 44 THR CG2 1 1 2 1374 1 1 44 THR H H 2.668 3.466 1.606 1.00 . A A . 44 THR H 1 1 2 1375 1 1 44 THR HA H 3.909 5.824 0.599 1.00 . A A . 44 THR HA 1 1 2 1376 1 1 44 THR HB H 4.621 4.214 3.056 1.00 . A A . 44 THR HB 1 1 2 1377 1 1 44 THR HG1 H 2.477 6.132 2.692 1.00 . A A . 44 THR HG1 1 1 2 1378 1 1 44 THR HG21 H 5.267 6.403 3.937 1.00 . A A . 44 THR HG21 1 1 2 1379 1 1 44 THR HG22 H 4.773 7.172 2.428 1.00 . A A . 44 THR HG22 1 1 2 1380 1 1 44 THR HG23 H 6.141 6.056 2.445 1.00 . A A . 44 THR HG23 1 1 2 1381 1 1 44 THR N N 2.973 4.024 0.859 1.00 . A A . 44 THR N 1 1 2 1382 1 1 44 THR O O 5.739 3.115 0.964 1.00 . A A . 44 THR O 1 1 2 1383 1 1 44 THR OG1 O 2.925 5.411 3.169 1.00 . A A . 44 THR OG1 1 1 2 1384 1 1 45 LYS C C 8.326 5.120 -0.786 1.00 . A A . 45 LYS C 1 1 2 1385 1 1 45 LYS CA C 7.067 4.339 -1.148 1.00 . A A . 45 LYS CA 1 1 2 1386 1 1 45 LYS CB C 6.787 4.388 -2.666 1.00 . A A . 45 LYS CB 1 1 2 1387 1 1 45 LYS CD C 6.107 5.804 -4.705 1.00 . A A . 45 LYS CD 1 1 2 1388 1 1 45 LYS CE C 7.184 5.318 -5.699 1.00 . A A . 45 LYS CE 1 1 2 1389 1 1 45 LYS CG C 6.532 5.781 -3.221 1.00 . A A . 45 LYS CG 1 1 2 1390 1 1 45 LYS H H 5.635 5.767 -0.653 1.00 . A A . 45 LYS H 1 1 2 1391 1 1 45 LYS HA H 7.201 3.308 -0.856 1.00 . A A . 45 LYS HA 1 1 2 1392 1 1 45 LYS HB2 H 7.636 3.978 -3.186 1.00 . A A . 45 LYS HB2 1 1 2 1393 1 1 45 LYS HB3 H 5.923 3.778 -2.880 1.00 . A A . 45 LYS HB3 1 1 2 1394 1 1 45 LYS HD2 H 5.241 5.171 -4.820 1.00 . A A . 45 LYS HD2 1 1 2 1395 1 1 45 LYS HD3 H 5.830 6.818 -4.958 1.00 . A A . 45 LYS HD3 1 1 2 1396 1 1 45 LYS HE2 H 6.897 5.636 -6.689 1.00 . A A . 45 LYS HE2 1 1 2 1397 1 1 45 LYS HE3 H 8.120 5.791 -5.441 1.00 . A A . 45 LYS HE3 1 1 2 1398 1 1 45 LYS HG2 H 5.750 6.244 -2.637 1.00 . A A . 45 LYS HG2 1 1 2 1399 1 1 45 LYS HG3 H 7.437 6.361 -3.108 1.00 . A A . 45 LYS HG3 1 1 2 1400 1 1 45 LYS HZ1 H 6.462 3.354 -5.836 1.00 . A A . 45 LYS HZ1 1 1 2 1401 1 1 45 LYS HZ2 H 7.876 3.463 -4.891 1.00 . A A . 45 LYS HZ2 1 1 2 1402 1 1 45 LYS HZ3 H 7.944 3.565 -6.539 1.00 . A A . 45 LYS HZ3 1 1 2 1403 1 1 45 LYS N N 5.939 4.856 -0.433 1.00 . A A . 45 LYS N 1 1 2 1404 1 1 45 LYS NZ N 7.371 3.845 -5.715 1.00 . A A . 45 LYS NZ 1 1 2 1405 1 1 45 LYS O O 8.251 6.239 -0.257 1.00 . A A . 45 LYS O 1 1 2 1406 1 1 46 ASN C C 11.323 5.766 -1.978 1.00 . A A . 46 ASN C 1 1 2 1407 1 1 46 ASN CA C 10.740 5.130 -0.741 1.00 . A A . 46 ASN CA 1 1 2 1408 1 1 46 ASN CB C 11.710 4.072 -0.208 1.00 . A A . 46 ASN CB 1 1 2 1409 1 1 46 ASN CG C 11.251 3.422 1.083 1.00 . A A . 46 ASN CG 1 1 2 1410 1 1 46 ASN H H 9.459 3.664 -1.510 1.00 . A A . 46 ASN H 1 1 2 1411 1 1 46 ASN HA H 10.589 5.884 0.018 1.00 . A A . 46 ASN HA 1 1 2 1412 1 1 46 ASN HB2 H 11.828 3.298 -0.951 1.00 . A A . 46 ASN HB2 1 1 2 1413 1 1 46 ASN HB3 H 12.670 4.536 -0.034 1.00 . A A . 46 ASN HB3 1 1 2 1414 1 1 46 ASN HD21 H 12.014 1.701 0.501 1.00 . A A . 46 ASN HD21 1 1 2 1415 1 1 46 ASN HD22 H 11.263 1.696 2.042 1.00 . A A . 46 ASN HD22 1 1 2 1416 1 1 46 ASN N N 9.457 4.534 -1.058 1.00 . A A . 46 ASN N 1 1 2 1417 1 1 46 ASN ND2 N 11.534 2.161 1.223 1.00 . A A . 46 ASN ND2 1 1 2 1418 1 1 46 ASN O O 11.520 5.101 -3.002 1.00 . A A . 46 ASN O 1 1 2 1419 1 1 46 ASN OD1 O 10.613 4.049 1.936 1.00 . A A . 46 ASN OD1 1 1 2 1420 1 1 47 CYS C C 13.377 8.506 -2.516 1.00 . A A . 47 CYS C 1 1 2 1421 1 1 47 CYS CA C 12.140 7.755 -2.981 1.00 . A A . 47 CYS CA 1 1 2 1422 1 1 47 CYS CB C 11.079 8.658 -3.639 1.00 . A A . 47 CYS CB 1 1 2 1423 1 1 47 CYS H H 11.402 7.513 -1.067 1.00 . A A . 47 CYS H 1 1 2 1424 1 1 47 CYS HA H 12.469 7.024 -3.705 1.00 . A A . 47 CYS HA 1 1 2 1425 1 1 47 CYS HB2 H 11.581 9.412 -4.226 1.00 . A A . 47 CYS HB2 1 1 2 1426 1 1 47 CYS HB3 H 10.466 8.055 -4.294 1.00 . A A . 47 CYS HB3 1 1 2 1427 1 1 47 CYS N N 11.581 7.018 -1.900 1.00 . A A . 47 CYS N 1 1 2 1428 1 1 47 CYS O O 13.261 9.518 -1.812 1.00 . A A . 47 CYS O 1 1 2 1429 1 1 47 CYS OXT O 14.496 8.049 -2.815 1.00 . A A . 47 CYS OXT 1 1 2 1430 1 1 47 CYS SG S 9.963 9.530 -2.474 1.00 . A A . 47 CYS SG 1 1 3 1431 1 1 1 LYS C C 10.893 10.050 1.467 1.00 . A A . 1 LYS C 1 1 3 1432 1 1 1 LYS CA C 11.803 11.238 1.647 1.00 . A A . 1 LYS CA 1 1 3 1433 1 1 1 LYS CB C 11.103 12.533 1.174 1.00 . A A . 1 LYS CB 1 1 3 1434 1 1 1 LYS CD C 9.968 13.800 -0.708 1.00 . A A . 1 LYS CD 1 1 3 1435 1 1 1 LYS CE C 8.561 13.816 -0.120 1.00 . A A . 1 LYS CE 1 1 3 1436 1 1 1 LYS CG C 10.742 12.552 -0.306 1.00 . A A . 1 LYS CG 1 1 3 1437 1 1 1 LYS H1 H 13.514 10.180 1.287 1.00 . A A . 1 LYS H1 1 1 3 1438 1 1 1 LYS H2 H 13.657 11.819 0.904 1.00 . A A . 1 LYS H2 1 1 3 1439 1 1 1 LYS H3 H 12.771 10.765 -0.096 1.00 . A A . 1 LYS H3 1 1 3 1440 1 1 1 LYS HA H 12.058 11.324 2.692 1.00 . A A . 1 LYS HA 1 1 3 1441 1 1 1 LYS HB2 H 10.195 12.663 1.741 1.00 . A A . 1 LYS HB2 1 1 3 1442 1 1 1 LYS HB3 H 11.756 13.369 1.371 1.00 . A A . 1 LYS HB3 1 1 3 1443 1 1 1 LYS HD2 H 10.501 14.672 -0.361 1.00 . A A . 1 LYS HD2 1 1 3 1444 1 1 1 LYS HD3 H 9.901 13.822 -1.785 1.00 . A A . 1 LYS HD3 1 1 3 1445 1 1 1 LYS HE2 H 8.032 12.936 -0.453 1.00 . A A . 1 LYS HE2 1 1 3 1446 1 1 1 LYS HE3 H 8.630 13.804 0.957 1.00 . A A . 1 LYS HE3 1 1 3 1447 1 1 1 LYS HG2 H 11.651 12.507 -0.885 1.00 . A A . 1 LYS HG2 1 1 3 1448 1 1 1 LYS HG3 H 10.142 11.679 -0.524 1.00 . A A . 1 LYS HG3 1 1 3 1449 1 1 1 LYS HZ1 H 7.766 15.122 -1.571 1.00 . A A . 1 LYS HZ1 1 1 3 1450 1 1 1 LYS HZ2 H 8.203 15.878 -0.120 1.00 . A A . 1 LYS HZ2 1 1 3 1451 1 1 1 LYS HZ3 H 6.823 14.938 -0.191 1.00 . A A . 1 LYS HZ3 1 1 3 1452 1 1 1 LYS N N 13.018 11.002 0.891 1.00 . A A . 1 LYS N 1 1 3 1453 1 1 1 LYS NZ N 7.801 15.015 -0.537 1.00 . A A . 1 LYS NZ 1 1 3 1454 1 1 1 LYS O O 11.270 9.066 0.820 1.00 . A A . 1 LYS O 1 1 3 1455 1 1 2 THR C C 7.531 9.685 1.214 1.00 . A A . 2 THR C 1 1 3 1456 1 1 2 THR CA C 8.764 9.098 1.833 1.00 . A A . 2 THR CA 1 1 3 1457 1 1 2 THR CB C 8.432 8.344 3.123 1.00 . A A . 2 THR CB 1 1 3 1458 1 1 2 THR CG2 C 9.470 7.277 3.409 1.00 . A A . 2 THR CG2 1 1 3 1459 1 1 2 THR H H 9.475 10.871 2.599 1.00 . A A . 2 THR H 1 1 3 1460 1 1 2 THR HA H 9.187 8.398 1.126 1.00 . A A . 2 THR HA 1 1 3 1461 1 1 2 THR HB H 7.474 7.873 2.956 1.00 . A A . 2 THR HB 1 1 3 1462 1 1 2 THR HG1 H 7.604 9.862 4.011 1.00 . A A . 2 THR HG1 1 1 3 1463 1 1 2 THR HG21 H 9.211 6.742 4.310 1.00 . A A . 2 THR HG21 1 1 3 1464 1 1 2 THR HG22 H 10.436 7.745 3.526 1.00 . A A . 2 THR HG22 1 1 3 1465 1 1 2 THR HG23 H 9.497 6.593 2.573 1.00 . A A . 2 THR HG23 1 1 3 1466 1 1 2 THR N N 9.730 10.111 2.029 1.00 . A A . 2 THR N 1 1 3 1467 1 1 2 THR O O 6.950 10.637 1.732 1.00 . A A . 2 THR O 1 1 3 1468 1 1 2 THR OG1 O 8.336 9.269 4.230 1.00 . A A . 2 THR OG1 1 1 3 1469 1 1 3 CYS C C 4.991 8.533 -0.636 1.00 . A A . 3 CYS C 1 1 3 1470 1 1 3 CYS CA C 6.033 9.612 -0.613 1.00 . A A . 3 CYS CA 1 1 3 1471 1 1 3 CYS CB C 6.465 10.056 -2.017 1.00 . A A . 3 CYS CB 1 1 3 1472 1 1 3 CYS H H 7.654 8.358 -0.199 1.00 . A A . 3 CYS H 1 1 3 1473 1 1 3 CYS HA H 5.635 10.462 -0.080 1.00 . A A . 3 CYS HA 1 1 3 1474 1 1 3 CYS HB2 H 5.592 10.109 -2.652 1.00 . A A . 3 CYS HB2 1 1 3 1475 1 1 3 CYS HB3 H 6.921 11.033 -1.958 1.00 . A A . 3 CYS HB3 1 1 3 1476 1 1 3 CYS N N 7.166 9.149 0.126 1.00 . A A . 3 CYS N 1 1 3 1477 1 1 3 CYS O O 5.252 7.426 -0.171 1.00 . A A . 3 CYS O 1 1 3 1478 1 1 3 CYS SG S 7.655 8.939 -2.828 1.00 . A A . 3 CYS SG 1 1 3 1479 1 1 4 GLU C C 1.975 7.912 -2.371 1.00 . A A . 4 GLU C 1 1 3 1480 1 1 4 GLU CA C 2.788 7.837 -1.111 1.00 . A A . 4 GLU CA 1 1 3 1481 1 1 4 GLU CB C 1.941 8.020 0.130 1.00 . A A . 4 GLU CB 1 1 3 1482 1 1 4 GLU CD C 0.409 7.001 1.754 1.00 . A A . 4 GLU CD 1 1 3 1483 1 1 4 GLU CG C 0.928 6.948 0.363 1.00 . A A . 4 GLU CG 1 1 3 1484 1 1 4 GLU H H 3.627 9.702 -1.506 1.00 . A A . 4 GLU H 1 1 3 1485 1 1 4 GLU HA H 3.259 6.866 -1.063 1.00 . A A . 4 GLU HA 1 1 3 1486 1 1 4 GLU HB2 H 2.589 8.054 0.992 1.00 . A A . 4 GLU HB2 1 1 3 1487 1 1 4 GLU HB3 H 1.419 8.962 0.045 1.00 . A A . 4 GLU HB3 1 1 3 1488 1 1 4 GLU HG2 H 0.112 7.090 -0.330 1.00 . A A . 4 GLU HG2 1 1 3 1489 1 1 4 GLU HG3 H 1.384 5.984 0.194 1.00 . A A . 4 GLU HG3 1 1 3 1490 1 1 4 GLU N N 3.821 8.818 -1.126 1.00 . A A . 4 GLU N 1 1 3 1491 1 1 4 GLU O O 1.459 8.973 -2.735 1.00 . A A . 4 GLU O 1 1 3 1492 1 1 4 GLU OE1 O -0.672 7.579 1.989 1.00 . A A . 4 GLU OE1 1 1 3 1493 1 1 4 GLU OE2 O 1.096 6.506 2.661 1.00 . A A . 4 GLU OE2 1 1 3 1494 1 1 5 ASN C C 0.292 5.486 -4.263 1.00 . A A . 5 ASN C 1 1 3 1495 1 1 5 ASN CA C 1.176 6.695 -4.298 1.00 . A A . 5 ASN CA 1 1 3 1496 1 1 5 ASN CB C 2.165 6.562 -5.482 1.00 . A A . 5 ASN CB 1 1 3 1497 1 1 5 ASN CG C 2.999 7.810 -5.770 1.00 . A A . 5 ASN CG 1 1 3 1498 1 1 5 ASN H H 2.230 5.971 -2.639 1.00 . A A . 5 ASN H 1 1 3 1499 1 1 5 ASN HA H 0.579 7.584 -4.432 1.00 . A A . 5 ASN HA 1 1 3 1500 1 1 5 ASN HB2 H 2.852 5.755 -5.268 1.00 . A A . 5 ASN HB2 1 1 3 1501 1 1 5 ASN HB3 H 1.605 6.312 -6.370 1.00 . A A . 5 ASN HB3 1 1 3 1502 1 1 5 ASN HD21 H 1.492 9.015 -5.283 1.00 . A A . 5 ASN HD21 1 1 3 1503 1 1 5 ASN HD22 H 2.950 9.781 -5.779 1.00 . A A . 5 ASN HD22 1 1 3 1504 1 1 5 ASN N N 1.870 6.798 -3.034 1.00 . A A . 5 ASN N 1 1 3 1505 1 1 5 ASN ND2 N 2.424 8.976 -5.592 1.00 . A A . 5 ASN ND2 1 1 3 1506 1 1 5 ASN O O 0.439 4.637 -3.379 1.00 . A A . 5 ASN O 1 1 3 1507 1 1 5 ASN OD1 O 4.160 7.713 -6.190 1.00 . A A . 5 ASN OD1 1 1 3 1508 1 1 6 LEU C C -0.755 3.011 -5.605 1.00 . A A . 6 LEU C 1 1 3 1509 1 1 6 LEU CA C -1.505 4.278 -5.312 1.00 . A A . 6 LEU CA 1 1 3 1510 1 1 6 LEU CB C -2.556 4.502 -6.397 1.00 . A A . 6 LEU CB 1 1 3 1511 1 1 6 LEU CD1 C -4.627 5.599 -7.200 1.00 . A A . 6 LEU CD1 1 1 3 1512 1 1 6 LEU CD2 C -4.432 4.910 -4.884 1.00 . A A . 6 LEU CD2 1 1 3 1513 1 1 6 LEU CG C -3.682 5.450 -6.047 1.00 . A A . 6 LEU CG 1 1 3 1514 1 1 6 LEU H H -0.740 6.176 -5.793 1.00 . A A . 6 LEU H 1 1 3 1515 1 1 6 LEU HA H -2.020 4.151 -4.373 1.00 . A A . 6 LEU HA 1 1 3 1516 1 1 6 LEU HB2 H -2.052 4.888 -7.270 1.00 . A A . 6 LEU HB2 1 1 3 1517 1 1 6 LEU HB3 H -2.986 3.544 -6.650 1.00 . A A . 6 LEU HB3 1 1 3 1518 1 1 6 LEU HD11 H -5.044 4.631 -7.428 1.00 . A A . 6 LEU HD11 1 1 3 1519 1 1 6 LEU HD12 H -4.110 6.001 -8.059 1.00 . A A . 6 LEU HD12 1 1 3 1520 1 1 6 LEU HD13 H -5.422 6.261 -6.888 1.00 . A A . 6 LEU HD13 1 1 3 1521 1 1 6 LEU HD21 H -5.295 5.529 -4.690 1.00 . A A . 6 LEU HD21 1 1 3 1522 1 1 6 LEU HD22 H -3.803 4.912 -4.006 1.00 . A A . 6 LEU HD22 1 1 3 1523 1 1 6 LEU HD23 H -4.753 3.905 -5.108 1.00 . A A . 6 LEU HD23 1 1 3 1524 1 1 6 LEU HG H -3.293 6.419 -5.772 1.00 . A A . 6 LEU HG 1 1 3 1525 1 1 6 LEU N N -0.627 5.414 -5.184 1.00 . A A . 6 LEU N 1 1 3 1526 1 1 6 LEU O O 0.207 3.010 -6.388 1.00 . A A . 6 LEU O 1 1 3 1527 1 1 7 ALA C C -0.970 0.270 -6.648 1.00 . A A . 7 ALA C 1 1 3 1528 1 1 7 ALA CA C -0.656 0.629 -5.208 1.00 . A A . 7 ALA CA 1 1 3 1529 1 1 7 ALA CB C -1.296 -0.357 -4.257 1.00 . A A . 7 ALA CB 1 1 3 1530 1 1 7 ALA H H -1.881 2.066 -4.279 1.00 . A A . 7 ALA H 1 1 3 1531 1 1 7 ALA HA H 0.413 0.642 -5.055 1.00 . A A . 7 ALA HA 1 1 3 1532 1 1 7 ALA HB1 H -0.896 -1.346 -4.421 1.00 . A A . 7 ALA HB1 1 1 3 1533 1 1 7 ALA HB2 H -2.364 -0.359 -4.421 1.00 . A A . 7 ALA HB2 1 1 3 1534 1 1 7 ALA HB3 H -1.095 -0.040 -3.243 1.00 . A A . 7 ALA HB3 1 1 3 1535 1 1 7 ALA N N -1.181 1.948 -4.958 1.00 . A A . 7 ALA N 1 1 3 1536 1 1 7 ALA O O -2.119 0.469 -7.102 1.00 . A A . 7 ALA O 1 1 3 1537 1 1 8 ASP C C -0.742 -1.792 -9.070 1.00 . A A . 8 ASP C 1 1 3 1538 1 1 8 ASP CA C -0.139 -0.453 -8.781 1.00 . A A . 8 ASP CA 1 1 3 1539 1 1 8 ASP CB C 1.202 -0.323 -9.518 1.00 . A A . 8 ASP CB 1 1 3 1540 1 1 8 ASP CG C 1.062 -0.479 -11.027 1.00 . A A . 8 ASP CG 1 1 3 1541 1 1 8 ASP H H 0.857 -0.488 -6.930 1.00 . A A . 8 ASP H 1 1 3 1542 1 1 8 ASP HA H -0.802 0.307 -9.162 1.00 . A A . 8 ASP HA 1 1 3 1543 1 1 8 ASP HB2 H 1.627 0.649 -9.315 1.00 . A A . 8 ASP HB2 1 1 3 1544 1 1 8 ASP HB3 H 1.872 -1.087 -9.156 1.00 . A A . 8 ASP HB3 1 1 3 1545 1 1 8 ASP N N 0.010 -0.228 -7.359 1.00 . A A . 8 ASP N 1 1 3 1546 1 1 8 ASP O O -1.735 -1.886 -9.804 1.00 . A A . 8 ASP O 1 1 3 1547 1 1 8 ASP OD1 O 1.116 -1.613 -11.542 1.00 . A A . 8 ASP OD1 1 1 3 1548 1 1 8 ASP OD2 O 0.907 0.545 -11.735 1.00 . A A . 8 ASP OD2 1 1 3 1549 1 1 9 THR C C -1.796 -4.609 -7.878 1.00 . A A . 9 THR C 1 1 3 1550 1 1 9 THR CA C -0.700 -4.135 -8.818 1.00 . A A . 9 THR CA 1 1 3 1551 1 1 9 THR CB C 0.403 -5.202 -9.069 1.00 . A A . 9 THR CB 1 1 3 1552 1 1 9 THR CG2 C 1.313 -4.743 -10.186 1.00 . A A . 9 THR CG2 1 1 3 1553 1 1 9 THR H H 0.554 -2.713 -7.860 1.00 . A A . 9 THR H 1 1 3 1554 1 1 9 THR HA H -1.210 -3.971 -9.758 1.00 . A A . 9 THR HA 1 1 3 1555 1 1 9 THR HB H -0.071 -6.118 -9.388 1.00 . A A . 9 THR HB 1 1 3 1556 1 1 9 THR HG1 H 1.704 -4.710 -7.580 1.00 . A A . 9 THR HG1 1 1 3 1557 1 1 9 THR HG21 H 2.077 -5.487 -10.336 1.00 . A A . 9 THR HG21 1 1 3 1558 1 1 9 THR HG22 H 1.769 -3.802 -9.913 1.00 . A A . 9 THR HG22 1 1 3 1559 1 1 9 THR HG23 H 0.745 -4.618 -11.096 1.00 . A A . 9 THR HG23 1 1 3 1560 1 1 9 THR N N -0.195 -2.835 -8.489 1.00 . A A . 9 THR N 1 1 3 1561 1 1 9 THR O O -2.550 -5.536 -8.215 1.00 . A A . 9 THR O 1 1 3 1562 1 1 9 THR OG1 O 1.197 -5.476 -7.904 1.00 . A A . 9 THR OG1 1 1 3 1563 1 1 10 TYR C C -4.237 -3.513 -6.279 1.00 . A A . 10 TYR C 1 1 3 1564 1 1 10 TYR CA C -3.009 -4.262 -5.815 1.00 . A A . 10 TYR CA 1 1 3 1565 1 1 10 TYR CB C -2.664 -3.894 -4.366 1.00 . A A . 10 TYR CB 1 1 3 1566 1 1 10 TYR CD1 C -3.519 -5.794 -2.943 1.00 . A A . 10 TYR CD1 1 1 3 1567 1 1 10 TYR CD2 C -4.631 -3.704 -2.767 1.00 . A A . 10 TYR CD2 1 1 3 1568 1 1 10 TYR CE1 C -4.371 -6.339 -2.013 1.00 . A A . 10 TYR CE1 1 1 3 1569 1 1 10 TYR CE2 C -5.493 -4.242 -1.830 1.00 . A A . 10 TYR CE2 1 1 3 1570 1 1 10 TYR CG C -3.629 -4.472 -3.339 1.00 . A A . 10 TYR CG 1 1 3 1571 1 1 10 TYR CZ C -5.356 -5.563 -1.459 1.00 . A A . 10 TYR CZ 1 1 3 1572 1 1 10 TYR H H -1.303 -3.229 -6.520 1.00 . A A . 10 TYR H 1 1 3 1573 1 1 10 TYR HA H -3.203 -5.322 -5.895 1.00 . A A . 10 TYR HA 1 1 3 1574 1 1 10 TYR HB2 H -1.676 -4.262 -4.135 1.00 . A A . 10 TYR HB2 1 1 3 1575 1 1 10 TYR HB3 H -2.674 -2.819 -4.266 1.00 . A A . 10 TYR HB3 1 1 3 1576 1 1 10 TYR HD1 H -2.741 -6.403 -3.381 1.00 . A A . 10 TYR HD1 1 1 3 1577 1 1 10 TYR HD2 H -4.734 -2.669 -3.061 1.00 . A A . 10 TYR HD2 1 1 3 1578 1 1 10 TYR HE1 H -4.251 -7.374 -1.727 1.00 . A A . 10 TYR HE1 1 1 3 1579 1 1 10 TYR HE2 H -6.263 -3.621 -1.398 1.00 . A A . 10 TYR HE2 1 1 3 1580 1 1 10 TYR HH H -5.699 -6.710 0.029 1.00 . A A . 10 TYR HH 1 1 3 1581 1 1 10 TYR N N -1.933 -3.945 -6.735 1.00 . A A . 10 TYR N 1 1 3 1582 1 1 10 TYR O O -4.431 -2.330 -5.971 1.00 . A A . 10 TYR O 1 1 3 1583 1 1 10 TYR OH O -6.210 -6.110 -0.531 1.00 . A A . 10 TYR OH 1 1 3 1584 1 1 11 LYS C C -7.401 -3.959 -6.947 1.00 . A A . 11 LYS C 1 1 3 1585 1 1 11 LYS CA C -6.150 -3.591 -7.697 1.00 . A A . 11 LYS CA 1 1 3 1586 1 1 11 LYS CB C -6.227 -4.076 -9.139 1.00 . A A . 11 LYS CB 1 1 3 1587 1 1 11 LYS CD C -4.985 -4.424 -11.321 1.00 . A A . 11 LYS CD 1 1 3 1588 1 1 11 LYS CE C -5.085 -5.947 -11.250 1.00 . A A . 11 LYS CE 1 1 3 1589 1 1 11 LYS CG C -4.954 -3.793 -9.938 1.00 . A A . 11 LYS CG 1 1 3 1590 1 1 11 LYS H H -4.818 -5.128 -7.225 1.00 . A A . 11 LYS H 1 1 3 1591 1 1 11 LYS HA H -6.028 -2.517 -7.703 1.00 . A A . 11 LYS HA 1 1 3 1592 1 1 11 LYS HB2 H -6.401 -5.141 -9.126 1.00 . A A . 11 LYS HB2 1 1 3 1593 1 1 11 LYS HB3 H -7.055 -3.587 -9.630 1.00 . A A . 11 LYS HB3 1 1 3 1594 1 1 11 LYS HD2 H -5.842 -4.044 -11.858 1.00 . A A . 11 LYS HD2 1 1 3 1595 1 1 11 LYS HD3 H -4.083 -4.154 -11.848 1.00 . A A . 11 LYS HD3 1 1 3 1596 1 1 11 LYS HE2 H -6.018 -6.226 -10.785 1.00 . A A . 11 LYS HE2 1 1 3 1597 1 1 11 LYS HE3 H -5.073 -6.332 -12.258 1.00 . A A . 11 LYS HE3 1 1 3 1598 1 1 11 LYS HG2 H -4.832 -2.725 -10.045 1.00 . A A . 11 LYS HG2 1 1 3 1599 1 1 11 LYS HG3 H -4.112 -4.190 -9.390 1.00 . A A . 11 LYS HG3 1 1 3 1600 1 1 11 LYS HZ1 H -3.925 -6.247 -9.500 1.00 . A A . 11 LYS HZ1 1 1 3 1601 1 1 11 LYS HZ2 H -3.036 -6.364 -10.918 1.00 . A A . 11 LYS HZ2 1 1 3 1602 1 1 11 LYS HZ3 H -4.068 -7.601 -10.475 1.00 . A A . 11 LYS HZ3 1 1 3 1603 1 1 11 LYS N N -5.014 -4.178 -7.069 1.00 . A A . 11 LYS N 1 1 3 1604 1 1 11 LYS NZ N -3.962 -6.564 -10.492 1.00 . A A . 11 LYS NZ 1 1 3 1605 1 1 11 LYS O O -7.752 -5.146 -6.837 1.00 . A A . 11 LYS O 1 1 3 1606 1 1 12 GLY C C -9.275 -2.379 -4.434 1.00 . A A . 12 GLY C 1 1 3 1607 1 1 12 GLY CA C -9.247 -3.178 -5.699 1.00 . A A . 12 GLY CA 1 1 3 1608 1 1 12 GLY H H -7.639 -2.077 -6.409 1.00 . A A . 12 GLY H 1 1 3 1609 1 1 12 GLY HA2 H -10.063 -2.869 -6.336 1.00 . A A . 12 GLY HA2 1 1 3 1610 1 1 12 GLY HA3 H -9.352 -4.225 -5.457 1.00 . A A . 12 GLY HA3 1 1 3 1611 1 1 12 GLY N N -8.026 -2.976 -6.394 1.00 . A A . 12 GLY N 1 1 3 1612 1 1 12 GLY O O -8.287 -1.692 -4.116 1.00 . A A . 12 GLY O 1 1 3 1613 1 1 13 PRO C C -9.805 -2.431 -1.309 1.00 . A A . 13 PRO C 1 1 3 1614 1 1 13 PRO CA C -10.501 -1.697 -2.449 1.00 . A A . 13 PRO CA 1 1 3 1615 1 1 13 PRO CB C -12.014 -1.643 -2.188 1.00 . A A . 13 PRO CB 1 1 3 1616 1 1 13 PRO CD C -11.626 -3.100 -4.036 1.00 . A A . 13 PRO CD 1 1 3 1617 1 1 13 PRO CG C -12.652 -2.213 -3.414 1.00 . A A . 13 PRO CG 1 1 3 1618 1 1 13 PRO HA H -10.111 -0.693 -2.522 1.00 . A A . 13 PRO HA 1 1 3 1619 1 1 13 PRO HB2 H -12.246 -2.223 -1.306 1.00 . A A . 13 PRO HB2 1 1 3 1620 1 1 13 PRO HB3 H -12.309 -0.618 -2.026 1.00 . A A . 13 PRO HB3 1 1 3 1621 1 1 13 PRO HD2 H -11.659 -4.081 -3.587 1.00 . A A . 13 PRO HD2 1 1 3 1622 1 1 13 PRO HD3 H -11.765 -3.158 -5.105 1.00 . A A . 13 PRO HD3 1 1 3 1623 1 1 13 PRO HG2 H -13.524 -2.788 -3.137 1.00 . A A . 13 PRO HG2 1 1 3 1624 1 1 13 PRO HG3 H -12.926 -1.418 -4.093 1.00 . A A . 13 PRO HG3 1 1 3 1625 1 1 13 PRO N N -10.381 -2.405 -3.700 1.00 . A A . 13 PRO N 1 1 3 1626 1 1 13 PRO O O -9.527 -3.639 -1.381 1.00 . A A . 13 PRO O 1 1 3 1627 1 1 14 CYS C C -9.958 -2.543 1.900 1.00 . A A . 14 CYS C 1 1 3 1628 1 1 14 CYS CA C -8.896 -2.200 0.878 1.00 . A A . 14 CYS CA 1 1 3 1629 1 1 14 CYS CB C -7.944 -1.147 1.433 1.00 . A A . 14 CYS CB 1 1 3 1630 1 1 14 CYS H H -9.737 -0.744 -0.336 1.00 . A A . 14 CYS H 1 1 3 1631 1 1 14 CYS HA H -8.330 -3.084 0.625 1.00 . A A . 14 CYS HA 1 1 3 1632 1 1 14 CYS HB2 H -7.163 -0.962 0.711 1.00 . A A . 14 CYS HB2 1 1 3 1633 1 1 14 CYS HB3 H -8.497 -0.233 1.594 1.00 . A A . 14 CYS HB3 1 1 3 1634 1 1 14 CYS N N -9.519 -1.703 -0.294 1.00 . A A . 14 CYS N 1 1 3 1635 1 1 14 CYS O O -10.703 -1.669 2.366 1.00 . A A . 14 CYS O 1 1 3 1636 1 1 14 CYS SG S -7.147 -1.603 2.998 1.00 . A A . 14 CYS SG 1 1 3 1637 1 1 15 PHE C C -10.280 -4.556 4.476 1.00 . A A . 15 PHE C 1 1 3 1638 1 1 15 PHE CA C -11.011 -4.288 3.175 1.00 . A A . 15 PHE CA 1 1 3 1639 1 1 15 PHE CB C -11.671 -5.563 2.664 1.00 . A A . 15 PHE CB 1 1 3 1640 1 1 15 PHE CD1 C -11.692 -5.934 0.184 1.00 . A A . 15 PHE CD1 1 1 3 1641 1 1 15 PHE CD2 C -13.463 -4.673 1.156 1.00 . A A . 15 PHE CD2 1 1 3 1642 1 1 15 PHE CE1 C -12.247 -5.759 -1.061 1.00 . A A . 15 PHE CE1 1 1 3 1643 1 1 15 PHE CE2 C -14.022 -4.500 -0.087 1.00 . A A . 15 PHE CE2 1 1 3 1644 1 1 15 PHE CG C -12.294 -5.393 1.309 1.00 . A A . 15 PHE CG 1 1 3 1645 1 1 15 PHE CZ C -13.415 -5.040 -1.195 1.00 . A A . 15 PHE CZ 1 1 3 1646 1 1 15 PHE H H -9.507 -4.451 1.722 1.00 . A A . 15 PHE H 1 1 3 1647 1 1 15 PHE HA H -11.767 -3.533 3.327 1.00 . A A . 15 PHE HA 1 1 3 1648 1 1 15 PHE HB2 H -10.925 -6.340 2.597 1.00 . A A . 15 PHE HB2 1 1 3 1649 1 1 15 PHE HB3 H -12.443 -5.867 3.355 1.00 . A A . 15 PHE HB3 1 1 3 1650 1 1 15 PHE HD1 H -10.778 -6.501 0.290 1.00 . A A . 15 PHE HD1 1 1 3 1651 1 1 15 PHE HD2 H -13.944 -4.247 2.026 1.00 . A A . 15 PHE HD2 1 1 3 1652 1 1 15 PHE HE1 H -11.771 -6.183 -1.933 1.00 . A A . 15 PHE HE1 1 1 3 1653 1 1 15 PHE HE2 H -14.937 -3.937 -0.196 1.00 . A A . 15 PHE HE2 1 1 3 1654 1 1 15 PHE HZ H -13.853 -4.899 -2.172 1.00 . A A . 15 PHE HZ 1 1 3 1655 1 1 15 PHE N N -10.070 -3.803 2.196 1.00 . A A . 15 PHE N 1 1 3 1656 1 1 15 PHE O O -10.834 -4.406 5.572 1.00 . A A . 15 PHE O 1 1 3 1657 1 1 16 THR C C -6.851 -4.503 5.159 1.00 . A A . 16 THR C 1 1 3 1658 1 1 16 THR CA C -8.177 -5.194 5.455 1.00 . A A . 16 THR CA 1 1 3 1659 1 1 16 THR CB C -7.949 -6.712 5.626 1.00 . A A . 16 THR CB 1 1 3 1660 1 1 16 THR CG2 C -7.149 -7.011 6.888 1.00 . A A . 16 THR CG2 1 1 3 1661 1 1 16 THR H H -8.660 -5.054 3.445 1.00 . A A . 16 THR H 1 1 3 1662 1 1 16 THR HA H -8.629 -4.788 6.346 1.00 . A A . 16 THR HA 1 1 3 1663 1 1 16 THR HB H -7.392 -7.047 4.765 1.00 . A A . 16 THR HB 1 1 3 1664 1 1 16 THR HG1 H -9.360 -7.854 4.866 1.00 . A A . 16 THR HG1 1 1 3 1665 1 1 16 THR HG21 H -6.188 -6.522 6.826 1.00 . A A . 16 THR HG21 1 1 3 1666 1 1 16 THR HG22 H -7.005 -8.077 6.980 1.00 . A A . 16 THR HG22 1 1 3 1667 1 1 16 THR HG23 H -7.686 -6.644 7.750 1.00 . A A . 16 THR HG23 1 1 3 1668 1 1 16 THR N N -9.038 -4.940 4.343 1.00 . A A . 16 THR N 1 1 3 1669 1 1 16 THR O O -6.140 -4.889 4.212 1.00 . A A . 16 THR O 1 1 3 1670 1 1 16 THR OG1 O -9.221 -7.391 5.703 1.00 . A A . 16 THR OG1 1 1 3 1671 1 1 17 THR C C -4.058 -3.533 5.815 1.00 . A A . 17 THR C 1 1 3 1672 1 1 17 THR CA C -5.343 -2.701 5.669 1.00 . A A . 17 THR CA 1 1 3 1673 1 1 17 THR CB C -5.300 -1.364 6.499 1.00 . A A . 17 THR CB 1 1 3 1674 1 1 17 THR CG2 C -5.098 -1.620 7.978 1.00 . A A . 17 THR CG2 1 1 3 1675 1 1 17 THR H H -7.095 -3.286 6.705 1.00 . A A . 17 THR H 1 1 3 1676 1 1 17 THR HA H -5.414 -2.447 4.620 1.00 . A A . 17 THR HA 1 1 3 1677 1 1 17 THR HB H -6.242 -0.856 6.353 1.00 . A A . 17 THR HB 1 1 3 1678 1 1 17 THR HG1 H -4.171 -0.636 5.071 1.00 . A A . 17 THR HG1 1 1 3 1679 1 1 17 THR HG21 H -5.026 -0.677 8.498 1.00 . A A . 17 THR HG21 1 1 3 1680 1 1 17 THR HG22 H -4.195 -2.191 8.130 1.00 . A A . 17 THR HG22 1 1 3 1681 1 1 17 THR HG23 H -5.945 -2.170 8.360 1.00 . A A . 17 THR HG23 1 1 3 1682 1 1 17 THR N N -6.521 -3.495 5.935 1.00 . A A . 17 THR N 1 1 3 1683 1 1 17 THR O O -3.087 -3.282 5.119 1.00 . A A . 17 THR O 1 1 3 1684 1 1 17 THR OG1 O -4.248 -0.495 6.025 1.00 . A A . 17 THR OG1 1 1 3 1685 1 1 18 GLY C C -2.630 -6.220 5.543 1.00 . A A . 18 GLY C 1 1 3 1686 1 1 18 GLY CA C -2.959 -5.460 6.825 1.00 . A A . 18 GLY CA 1 1 3 1687 1 1 18 GLY H H -4.905 -4.711 7.203 1.00 . A A . 18 GLY H 1 1 3 1688 1 1 18 GLY HA2 H -2.100 -4.876 7.118 1.00 . A A . 18 GLY HA2 1 1 3 1689 1 1 18 GLY HA3 H -3.185 -6.172 7.603 1.00 . A A . 18 GLY HA3 1 1 3 1690 1 1 18 GLY N N -4.099 -4.569 6.658 1.00 . A A . 18 GLY N 1 1 3 1691 1 1 18 GLY O O -1.475 -6.518 5.265 1.00 . A A . 18 GLY O 1 1 3 1692 1 1 19 SER C C -2.871 -6.250 2.477 1.00 . A A . 19 SER C 1 1 3 1693 1 1 19 SER CA C -3.490 -7.200 3.498 1.00 . A A . 19 SER CA 1 1 3 1694 1 1 19 SER CB C -4.862 -7.703 3.024 1.00 . A A . 19 SER CB 1 1 3 1695 1 1 19 SER H H -4.547 -6.246 5.049 1.00 . A A . 19 SER H 1 1 3 1696 1 1 19 SER HA H -2.833 -8.043 3.645 1.00 . A A . 19 SER HA 1 1 3 1697 1 1 19 SER HB2 H -5.231 -8.443 3.717 1.00 . A A . 19 SER HB2 1 1 3 1698 1 1 19 SER HB3 H -5.549 -6.871 2.997 1.00 . A A . 19 SER HB3 1 1 3 1699 1 1 19 SER HG H -4.071 -8.918 1.706 1.00 . A A . 19 SER HG 1 1 3 1700 1 1 19 SER N N -3.650 -6.511 4.762 1.00 . A A . 19 SER N 1 1 3 1701 1 1 19 SER O O -1.955 -6.614 1.737 1.00 . A A . 19 SER O 1 1 3 1702 1 1 19 SER OG O -4.810 -8.292 1.734 1.00 . A A . 19 SER OG 1 1 3 1703 1 1 20 CYS C C -1.418 -3.677 1.910 1.00 . A A . 20 CYS C 1 1 3 1704 1 1 20 CYS CA C -2.886 -3.981 1.608 1.00 . A A . 20 CYS CA 1 1 3 1705 1 1 20 CYS CB C -3.744 -2.739 1.836 1.00 . A A . 20 CYS CB 1 1 3 1706 1 1 20 CYS H H -4.069 -4.812 3.126 1.00 . A A . 20 CYS H 1 1 3 1707 1 1 20 CYS HA H -3.000 -4.305 0.583 1.00 . A A . 20 CYS HA 1 1 3 1708 1 1 20 CYS HB2 H -4.763 -2.951 1.552 1.00 . A A . 20 CYS HB2 1 1 3 1709 1 1 20 CYS HB3 H -3.717 -2.489 2.887 1.00 . A A . 20 CYS HB3 1 1 3 1710 1 1 20 CYS N N -3.358 -5.029 2.486 1.00 . A A . 20 CYS N 1 1 3 1711 1 1 20 CYS O O -0.561 -3.659 1.013 1.00 . A A . 20 CYS O 1 1 3 1712 1 1 20 CYS SG S -3.227 -1.281 0.920 1.00 . A A . 20 CYS SG 1 1 3 1713 1 1 21 ASP C C 1.156 -4.308 3.326 1.00 . A A . 21 ASP C 1 1 3 1714 1 1 21 ASP CA C 0.182 -3.209 3.697 1.00 . A A . 21 ASP CA 1 1 3 1715 1 1 21 ASP CB C 0.119 -3.029 5.212 1.00 . A A . 21 ASP CB 1 1 3 1716 1 1 21 ASP CG C 1.456 -2.779 5.835 1.00 . A A . 21 ASP CG 1 1 3 1717 1 1 21 ASP H H -1.869 -3.560 3.849 1.00 . A A . 21 ASP H 1 1 3 1718 1 1 21 ASP HA H 0.521 -2.284 3.256 1.00 . A A . 21 ASP HA 1 1 3 1719 1 1 21 ASP HB2 H -0.520 -2.188 5.440 1.00 . A A . 21 ASP HB2 1 1 3 1720 1 1 21 ASP HB3 H -0.305 -3.920 5.650 1.00 . A A . 21 ASP HB3 1 1 3 1721 1 1 21 ASP N N -1.142 -3.501 3.190 1.00 . A A . 21 ASP N 1 1 3 1722 1 1 21 ASP O O 2.245 -4.034 2.814 1.00 . A A . 21 ASP O 1 1 3 1723 1 1 21 ASP OD1 O 1.995 -1.655 5.697 1.00 . A A . 21 ASP OD1 1 1 3 1724 1 1 21 ASP OD2 O 1.982 -3.685 6.504 1.00 . A A . 21 ASP OD2 1 1 3 1725 1 1 22 ASP C C 1.891 -6.746 1.735 1.00 . A A . 22 ASP C 1 1 3 1726 1 1 22 ASP CA C 1.541 -6.721 3.210 1.00 . A A . 22 ASP CA 1 1 3 1727 1 1 22 ASP CB C 0.786 -7.997 3.561 1.00 . A A . 22 ASP CB 1 1 3 1728 1 1 22 ASP CG C 1.615 -9.245 3.366 1.00 . A A . 22 ASP CG 1 1 3 1729 1 1 22 ASP H H -0.160 -5.673 3.923 1.00 . A A . 22 ASP H 1 1 3 1730 1 1 22 ASP HA H 2.456 -6.690 3.782 1.00 . A A . 22 ASP HA 1 1 3 1731 1 1 22 ASP HB2 H 0.481 -7.942 4.594 1.00 . A A . 22 ASP HB2 1 1 3 1732 1 1 22 ASP HB3 H -0.093 -8.065 2.938 1.00 . A A . 22 ASP HB3 1 1 3 1733 1 1 22 ASP N N 0.730 -5.546 3.527 1.00 . A A . 22 ASP N 1 1 3 1734 1 1 22 ASP O O 3.059 -6.870 1.373 1.00 . A A . 22 ASP O 1 1 3 1735 1 1 22 ASP OD1 O 1.740 -9.736 2.217 1.00 . A A . 22 ASP OD1 1 1 3 1736 1 1 22 ASP OD2 O 2.139 -9.785 4.373 1.00 . A A . 22 ASP OD2 1 1 3 1737 1 1 23 HIS C C 1.997 -5.470 -0.991 1.00 . A A . 23 HIS C 1 1 3 1738 1 1 23 HIS CA C 1.072 -6.609 -0.550 1.00 . A A . 23 HIS CA 1 1 3 1739 1 1 23 HIS CB C -0.284 -6.542 -1.277 1.00 . A A . 23 HIS CB 1 1 3 1740 1 1 23 HIS CD2 C 0.139 -5.713 -3.700 1.00 . A A . 23 HIS CD2 1 1 3 1741 1 1 23 HIS CE1 C -0.405 -7.489 -4.801 1.00 . A A . 23 HIS CE1 1 1 3 1742 1 1 23 HIS CG C -0.205 -6.644 -2.782 1.00 . A A . 23 HIS CG 1 1 3 1743 1 1 23 HIS H H -0.028 -6.457 1.243 1.00 . A A . 23 HIS H 1 1 3 1744 1 1 23 HIS HA H 1.553 -7.545 -0.795 1.00 . A A . 23 HIS HA 1 1 3 1745 1 1 23 HIS HB2 H -0.908 -7.352 -0.930 1.00 . A A . 23 HIS HB2 1 1 3 1746 1 1 23 HIS HB3 H -0.763 -5.605 -1.031 1.00 . A A . 23 HIS HB3 1 1 3 1747 1 1 23 HIS HD1 H -0.838 -8.639 -3.144 1.00 . A A . 23 HIS HD1 1 1 3 1748 1 1 23 HIS HD2 H 0.461 -4.705 -3.479 1.00 . A A . 23 HIS HD2 1 1 3 1749 1 1 23 HIS HE1 H -0.604 -8.180 -5.608 1.00 . A A . 23 HIS HE1 1 1 3 1750 1 1 23 HIS N N 0.881 -6.587 0.889 1.00 . A A . 23 HIS N 1 1 3 1751 1 1 23 HIS ND1 N -0.548 -7.771 -3.503 1.00 . A A . 23 HIS ND1 1 1 3 1752 1 1 23 HIS NE2 N 0.010 -6.251 -4.972 1.00 . A A . 23 HIS NE2 1 1 3 1753 1 1 23 HIS O O 2.918 -5.680 -1.784 1.00 . A A . 23 HIS O 1 1 3 1754 1 1 24 CYS C C 4.069 -3.320 -0.361 1.00 . A A . 24 CYS C 1 1 3 1755 1 1 24 CYS CA C 2.621 -3.161 -0.821 1.00 . A A . 24 CYS CA 1 1 3 1756 1 1 24 CYS CB C 2.007 -1.820 -0.418 1.00 . A A . 24 CYS CB 1 1 3 1757 1 1 24 CYS H H 1.036 -4.159 0.165 1.00 . A A . 24 CYS H 1 1 3 1758 1 1 24 CYS HA H 2.646 -3.206 -1.899 1.00 . A A . 24 CYS HA 1 1 3 1759 1 1 24 CYS HB2 H 1.709 -1.858 0.619 1.00 . A A . 24 CYS HB2 1 1 3 1760 1 1 24 CYS HB3 H 2.740 -1.039 -0.557 1.00 . A A . 24 CYS HB3 1 1 3 1761 1 1 24 CYS N N 1.785 -4.288 -0.462 1.00 . A A . 24 CYS N 1 1 3 1762 1 1 24 CYS O O 4.973 -2.804 -0.992 1.00 . A A . 24 CYS O 1 1 3 1763 1 1 24 CYS SG S 0.541 -1.398 -1.420 1.00 . A A . 24 CYS SG 1 1 3 1764 1 1 25 LYS C C 6.262 -5.476 0.349 1.00 . A A . 25 LYS C 1 1 3 1765 1 1 25 LYS CA C 5.643 -4.339 1.161 1.00 . A A . 25 LYS CA 1 1 3 1766 1 1 25 LYS CB C 5.647 -4.716 2.637 1.00 . A A . 25 LYS CB 1 1 3 1767 1 1 25 LYS CD C 5.138 -4.106 4.986 1.00 . A A . 25 LYS CD 1 1 3 1768 1 1 25 LYS CE C 4.960 -2.993 5.991 1.00 . A A . 25 LYS CE 1 1 3 1769 1 1 25 LYS CG C 5.336 -3.579 3.584 1.00 . A A . 25 LYS CG 1 1 3 1770 1 1 25 LYS H H 3.525 -4.399 1.218 1.00 . A A . 25 LYS H 1 1 3 1771 1 1 25 LYS HA H 6.237 -3.447 1.027 1.00 . A A . 25 LYS HA 1 1 3 1772 1 1 25 LYS HB2 H 4.911 -5.491 2.794 1.00 . A A . 25 LYS HB2 1 1 3 1773 1 1 25 LYS HB3 H 6.620 -5.111 2.887 1.00 . A A . 25 LYS HB3 1 1 3 1774 1 1 25 LYS HD2 H 4.263 -4.737 5.008 1.00 . A A . 25 LYS HD2 1 1 3 1775 1 1 25 LYS HD3 H 6.007 -4.686 5.257 1.00 . A A . 25 LYS HD3 1 1 3 1776 1 1 25 LYS HE2 H 5.899 -2.475 6.122 1.00 . A A . 25 LYS HE2 1 1 3 1777 1 1 25 LYS HE3 H 4.217 -2.304 5.617 1.00 . A A . 25 LYS HE3 1 1 3 1778 1 1 25 LYS HG2 H 6.156 -2.876 3.577 1.00 . A A . 25 LYS HG2 1 1 3 1779 1 1 25 LYS HG3 H 4.430 -3.089 3.259 1.00 . A A . 25 LYS HG3 1 1 3 1780 1 1 25 LYS HZ1 H 4.492 -2.771 8.014 1.00 . A A . 25 LYS HZ1 1 1 3 1781 1 1 25 LYS HZ2 H 5.091 -4.310 7.635 1.00 . A A . 25 LYS HZ2 1 1 3 1782 1 1 25 LYS HZ3 H 3.525 -3.833 7.156 1.00 . A A . 25 LYS HZ3 1 1 3 1783 1 1 25 LYS N N 4.289 -4.051 0.705 1.00 . A A . 25 LYS N 1 1 3 1784 1 1 25 LYS NZ N 4.513 -3.517 7.289 1.00 . A A . 25 LYS NZ 1 1 3 1785 1 1 25 LYS O O 7.373 -5.360 -0.156 1.00 . A A . 25 LYS O 1 1 3 1786 1 1 26 ASN C C 6.041 -7.729 -1.938 1.00 . A A . 26 ASN C 1 1 3 1787 1 1 26 ASN CA C 6.011 -7.777 -0.420 1.00 . A A . 26 ASN CA 1 1 3 1788 1 1 26 ASN CB C 5.187 -8.967 0.055 1.00 . A A . 26 ASN CB 1 1 3 1789 1 1 26 ASN CG C 5.551 -9.415 1.454 1.00 . A A . 26 ASN CG 1 1 3 1790 1 1 26 ASN H H 4.613 -6.535 0.582 1.00 . A A . 26 ASN H 1 1 3 1791 1 1 26 ASN HA H 7.022 -7.932 -0.074 1.00 . A A . 26 ASN HA 1 1 3 1792 1 1 26 ASN HB2 H 4.140 -8.702 0.041 1.00 . A A . 26 ASN HB2 1 1 3 1793 1 1 26 ASN HB3 H 5.356 -9.788 -0.626 1.00 . A A . 26 ASN HB3 1 1 3 1794 1 1 26 ASN HD21 H 3.644 -9.750 1.922 1.00 . A A . 26 ASN HD21 1 1 3 1795 1 1 26 ASN HD22 H 4.790 -10.068 3.148 1.00 . A A . 26 ASN HD22 1 1 3 1796 1 1 26 ASN N N 5.528 -6.549 0.217 1.00 . A A . 26 ASN N 1 1 3 1797 1 1 26 ASN ND2 N 4.579 -9.777 2.237 1.00 . A A . 26 ASN ND2 1 1 3 1798 1 1 26 ASN O O 7.044 -8.078 -2.549 1.00 . A A . 26 ASN O 1 1 3 1799 1 1 26 ASN OD1 O 6.714 -9.386 1.844 1.00 . A A . 26 ASN OD1 1 1 3 1800 1 1 27 LYS C C 5.354 -5.958 -4.542 1.00 . A A . 27 LYS C 1 1 3 1801 1 1 27 LYS CA C 4.872 -7.286 -3.990 1.00 . A A . 27 LYS CA 1 1 3 1802 1 1 27 LYS CB C 3.426 -7.550 -4.452 1.00 . A A . 27 LYS CB 1 1 3 1803 1 1 27 LYS CD C 3.975 -8.382 -6.778 1.00 . A A . 27 LYS CD 1 1 3 1804 1 1 27 LYS CE C 4.015 -7.977 -8.243 1.00 . A A . 27 LYS CE 1 1 3 1805 1 1 27 LYS CG C 3.207 -7.366 -5.951 1.00 . A A . 27 LYS CG 1 1 3 1806 1 1 27 LYS H H 4.197 -6.989 -2.018 1.00 . A A . 27 LYS H 1 1 3 1807 1 1 27 LYS HA H 5.503 -8.075 -4.370 1.00 . A A . 27 LYS HA 1 1 3 1808 1 1 27 LYS HB2 H 3.153 -8.563 -4.193 1.00 . A A . 27 LYS HB2 1 1 3 1809 1 1 27 LYS HB3 H 2.769 -6.870 -3.929 1.00 . A A . 27 LYS HB3 1 1 3 1810 1 1 27 LYS HD2 H 4.985 -8.445 -6.402 1.00 . A A . 27 LYS HD2 1 1 3 1811 1 1 27 LYS HD3 H 3.494 -9.344 -6.691 1.00 . A A . 27 LYS HD3 1 1 3 1812 1 1 27 LYS HE2 H 4.612 -7.084 -8.344 1.00 . A A . 27 LYS HE2 1 1 3 1813 1 1 27 LYS HE3 H 4.481 -8.773 -8.806 1.00 . A A . 27 LYS HE3 1 1 3 1814 1 1 27 LYS HG2 H 2.154 -7.471 -6.168 1.00 . A A . 27 LYS HG2 1 1 3 1815 1 1 27 LYS HG3 H 3.528 -6.372 -6.226 1.00 . A A . 27 LYS HG3 1 1 3 1816 1 1 27 LYS HZ1 H 2.184 -6.939 -8.303 1.00 . A A . 27 LYS HZ1 1 1 3 1817 1 1 27 LYS HZ2 H 2.089 -8.572 -8.735 1.00 . A A . 27 LYS HZ2 1 1 3 1818 1 1 27 LYS HZ3 H 2.769 -7.471 -9.804 1.00 . A A . 27 LYS HZ3 1 1 3 1819 1 1 27 LYS N N 4.963 -7.311 -2.542 1.00 . A A . 27 LYS N 1 1 3 1820 1 1 27 LYS NZ N 2.675 -7.716 -8.798 1.00 . A A . 27 LYS NZ 1 1 3 1821 1 1 27 LYS O O 6.186 -5.908 -5.452 1.00 . A A . 27 LYS O 1 1 3 1822 1 1 28 GLU C C 6.515 -3.089 -4.013 1.00 . A A . 28 GLU C 1 1 3 1823 1 1 28 GLU CA C 5.155 -3.566 -4.496 1.00 . A A . 28 GLU CA 1 1 3 1824 1 1 28 GLU CB C 4.059 -2.565 -4.126 1.00 . A A . 28 GLU CB 1 1 3 1825 1 1 28 GLU CD C 2.558 -3.007 -6.119 1.00 . A A . 28 GLU CD 1 1 3 1826 1 1 28 GLU CG C 2.664 -2.959 -4.612 1.00 . A A . 28 GLU CG 1 1 3 1827 1 1 28 GLU H H 4.219 -4.991 -3.236 1.00 . A A . 28 GLU H 1 1 3 1828 1 1 28 GLU HA H 5.196 -3.640 -5.572 1.00 . A A . 28 GLU HA 1 1 3 1829 1 1 28 GLU HB2 H 4.044 -2.445 -3.053 1.00 . A A . 28 GLU HB2 1 1 3 1830 1 1 28 GLU HB3 H 4.310 -1.615 -4.572 1.00 . A A . 28 GLU HB3 1 1 3 1831 1 1 28 GLU HG2 H 2.430 -3.940 -4.226 1.00 . A A . 28 GLU HG2 1 1 3 1832 1 1 28 GLU HG3 H 1.947 -2.244 -4.233 1.00 . A A . 28 GLU HG3 1 1 3 1833 1 1 28 GLU N N 4.840 -4.887 -3.990 1.00 . A A . 28 GLU N 1 1 3 1834 1 1 28 GLU O O 7.072 -2.160 -4.577 1.00 . A A . 28 GLU O 1 1 3 1835 1 1 28 GLU OE1 O 2.061 -2.044 -6.724 1.00 . A A . 28 GLU OE1 1 1 3 1836 1 1 28 GLU OE2 O 2.985 -3.992 -6.734 1.00 . A A . 28 GLU OE2 1 1 3 1837 1 1 29 HIS C C 8.409 -1.960 -1.926 1.00 . A A . 29 HIS C 1 1 3 1838 1 1 29 HIS CA C 8.346 -3.402 -2.377 1.00 . A A . 29 HIS CA 1 1 3 1839 1 1 29 HIS CB C 9.526 -3.770 -3.282 1.00 . A A . 29 HIS CB 1 1 3 1840 1 1 29 HIS CD2 C 10.504 -5.926 -2.297 1.00 . A A . 29 HIS CD2 1 1 3 1841 1 1 29 HIS CE1 C 10.052 -7.307 -3.902 1.00 . A A . 29 HIS CE1 1 1 3 1842 1 1 29 HIS CG C 9.863 -5.221 -3.250 1.00 . A A . 29 HIS CG 1 1 3 1843 1 1 29 HIS H H 6.541 -4.503 -2.607 1.00 . A A . 29 HIS H 1 1 3 1844 1 1 29 HIS HA H 8.410 -4.000 -1.478 1.00 . A A . 29 HIS HA 1 1 3 1845 1 1 29 HIS HB2 H 9.283 -3.509 -4.301 1.00 . A A . 29 HIS HB2 1 1 3 1846 1 1 29 HIS HB3 H 10.398 -3.214 -2.971 1.00 . A A . 29 HIS HB3 1 1 3 1847 1 1 29 HIS HD1 H 9.112 -5.896 -5.096 1.00 . A A . 29 HIS HD1 1 1 3 1848 1 1 29 HIS HD2 H 10.871 -5.522 -1.363 1.00 . A A . 29 HIS HD2 1 1 3 1849 1 1 29 HIS HE1 H 9.976 -8.199 -4.509 1.00 . A A . 29 HIS HE1 1 1 3 1850 1 1 29 HIS N N 7.045 -3.750 -2.976 1.00 . A A . 29 HIS N 1 1 3 1851 1 1 29 HIS ND1 N 9.583 -6.110 -4.258 1.00 . A A . 29 HIS ND1 1 1 3 1852 1 1 29 HIS NE2 N 10.628 -7.251 -2.705 1.00 . A A . 29 HIS NE2 1 1 3 1853 1 1 29 HIS O O 9.429 -1.264 -2.090 1.00 . A A . 29 HIS O 1 1 3 1854 1 1 30 LEU C C 7.351 -0.323 0.695 1.00 . A A . 30 LEU C 1 1 3 1855 1 1 30 LEU CA C 7.233 -0.213 -0.821 1.00 . A A . 30 LEU CA 1 1 3 1856 1 1 30 LEU CB C 5.908 0.442 -1.244 1.00 . A A . 30 LEU CB 1 1 3 1857 1 1 30 LEU CD1 C 4.345 1.230 -3.063 1.00 . A A . 30 LEU CD1 1 1 3 1858 1 1 30 LEU CD2 C 6.798 1.021 -3.562 1.00 . A A . 30 LEU CD2 1 1 3 1859 1 1 30 LEU CG C 5.619 0.467 -2.760 1.00 . A A . 30 LEU CG 1 1 3 1860 1 1 30 LEU H H 6.553 -2.119 -1.280 1.00 . A A . 30 LEU H 1 1 3 1861 1 1 30 LEU HA H 8.062 0.366 -1.200 1.00 . A A . 30 LEU HA 1 1 3 1862 1 1 30 LEU HB2 H 5.105 -0.090 -0.756 1.00 . A A . 30 LEU HB2 1 1 3 1863 1 1 30 LEU HB3 H 5.907 1.460 -0.886 1.00 . A A . 30 LEU HB3 1 1 3 1864 1 1 30 LEU HD11 H 4.184 1.252 -4.131 1.00 . A A . 30 LEU HD11 1 1 3 1865 1 1 30 LEU HD12 H 4.421 2.238 -2.685 1.00 . A A . 30 LEU HD12 1 1 3 1866 1 1 30 LEU HD13 H 3.512 0.729 -2.589 1.00 . A A . 30 LEU HD13 1 1 3 1867 1 1 30 LEU HD21 H 7.067 2.003 -3.208 1.00 . A A . 30 LEU HD21 1 1 3 1868 1 1 30 LEU HD22 H 6.522 1.083 -4.604 1.00 . A A . 30 LEU HD22 1 1 3 1869 1 1 30 LEU HD23 H 7.643 0.356 -3.459 1.00 . A A . 30 LEU HD23 1 1 3 1870 1 1 30 LEU HG H 5.450 -0.554 -3.073 1.00 . A A . 30 LEU HG 1 1 3 1871 1 1 30 LEU N N 7.331 -1.522 -1.357 1.00 . A A . 30 LEU N 1 1 3 1872 1 1 30 LEU O O 7.508 -1.429 1.225 1.00 . A A . 30 LEU O 1 1 3 1873 1 1 31 ARG C C 6.257 0.268 3.594 1.00 . A A . 31 ARG C 1 1 3 1874 1 1 31 ARG CA C 7.462 0.798 2.819 1.00 . A A . 31 ARG CA 1 1 3 1875 1 1 31 ARG CB C 7.831 2.215 3.282 1.00 . A A . 31 ARG CB 1 1 3 1876 1 1 31 ARG CD C 8.468 3.727 5.180 1.00 . A A . 31 ARG CD 1 1 3 1877 1 1 31 ARG CG C 7.985 2.352 4.786 1.00 . A A . 31 ARG CG 1 1 3 1878 1 1 31 ARG CZ C 9.395 4.689 7.277 1.00 . A A . 31 ARG CZ 1 1 3 1879 1 1 31 ARG H H 6.982 1.602 0.924 1.00 . A A . 31 ARG H 1 1 3 1880 1 1 31 ARG HA H 8.302 0.150 3.025 1.00 . A A . 31 ARG HA 1 1 3 1881 1 1 31 ARG HB2 H 8.763 2.500 2.820 1.00 . A A . 31 ARG HB2 1 1 3 1882 1 1 31 ARG HB3 H 7.058 2.896 2.956 1.00 . A A . 31 ARG HB3 1 1 3 1883 1 1 31 ARG HD2 H 9.438 3.897 4.735 1.00 . A A . 31 ARG HD2 1 1 3 1884 1 1 31 ARG HD3 H 7.769 4.464 4.814 1.00 . A A . 31 ARG HD3 1 1 3 1885 1 1 31 ARG HE H 7.973 3.273 7.149 1.00 . A A . 31 ARG HE 1 1 3 1886 1 1 31 ARG HG2 H 7.027 2.174 5.252 1.00 . A A . 31 ARG HG2 1 1 3 1887 1 1 31 ARG HG3 H 8.691 1.615 5.130 1.00 . A A . 31 ARG HG3 1 1 3 1888 1 1 31 ARG HH11 H 10.316 5.453 5.605 1.00 . A A . 31 ARG HH11 1 1 3 1889 1 1 31 ARG HH12 H 10.875 6.092 7.072 1.00 . A A . 31 ARG HH12 1 1 3 1890 1 1 31 ARG HH21 H 8.749 4.124 9.112 1.00 . A A . 31 ARG HH21 1 1 3 1891 1 1 31 ARG HH22 H 9.950 5.343 9.143 1.00 . A A . 31 ARG HH22 1 1 3 1892 1 1 31 ARG N N 7.249 0.776 1.384 1.00 . A A . 31 ARG N 1 1 3 1893 1 1 31 ARG NE N 8.577 3.855 6.630 1.00 . A A . 31 ARG NE 1 1 3 1894 1 1 31 ARG NH1 N 10.249 5.463 6.602 1.00 . A A . 31 ARG NH1 1 1 3 1895 1 1 31 ARG NH2 N 9.372 4.727 8.603 1.00 . A A . 31 ARG NH2 1 1 3 1896 1 1 31 ARG O O 6.413 -0.511 4.538 1.00 . A A . 31 ARG O 1 1 3 1897 1 1 32 SER C C 2.682 0.565 2.991 1.00 . A A . 32 SER C 1 1 3 1898 1 1 32 SER CA C 3.869 0.309 3.900 1.00 . A A . 32 SER CA 1 1 3 1899 1 1 32 SER CB C 3.765 1.167 5.185 1.00 . A A . 32 SER CB 1 1 3 1900 1 1 32 SER H H 4.979 1.213 2.381 1.00 . A A . 32 SER H 1 1 3 1901 1 1 32 SER HA H 3.911 -0.735 4.169 1.00 . A A . 32 SER HA 1 1 3 1902 1 1 32 SER HB2 H 4.640 0.996 5.796 1.00 . A A . 32 SER HB2 1 1 3 1903 1 1 32 SER HB3 H 3.732 2.208 4.901 1.00 . A A . 32 SER HB3 1 1 3 1904 1 1 32 SER HG H 2.436 -0.094 5.872 1.00 . A A . 32 SER HG 1 1 3 1905 1 1 32 SER N N 5.076 0.668 3.192 1.00 . A A . 32 SER N 1 1 3 1906 1 1 32 SER O O 2.832 1.234 1.967 1.00 . A A . 32 SER O 1 1 3 1907 1 1 32 SER OG O 2.613 0.861 5.955 1.00 . A A . 32 SER OG 1 1 3 1908 1 1 33 GLY C C -0.741 0.812 3.468 1.00 . A A . 33 GLY C 1 1 3 1909 1 1 33 GLY CA C 0.338 0.255 2.583 1.00 . A A . 33 GLY CA 1 1 3 1910 1 1 33 GLY H H 1.492 -0.539 4.148 1.00 . A A . 33 GLY H 1 1 3 1911 1 1 33 GLY HA2 H 0.555 0.961 1.795 1.00 . A A . 33 GLY HA2 1 1 3 1912 1 1 33 GLY HA3 H -0.008 -0.666 2.140 1.00 . A A . 33 GLY HA3 1 1 3 1913 1 1 33 GLY N N 1.539 0.024 3.340 1.00 . A A . 33 GLY N 1 1 3 1914 1 1 33 GLY O O -1.085 0.206 4.488 1.00 . A A . 33 GLY O 1 1 3 1915 1 1 34 ARG C C -3.557 2.730 3.113 1.00 . A A . 34 ARG C 1 1 3 1916 1 1 34 ARG CA C -2.284 2.588 3.927 1.00 . A A . 34 ARG CA 1 1 3 1917 1 1 34 ARG CB C -1.835 3.951 4.479 1.00 . A A . 34 ARG CB 1 1 3 1918 1 1 34 ARG CD C -0.355 5.265 6.045 1.00 . A A . 34 ARG CD 1 1 3 1919 1 1 34 ARG CG C -0.597 3.915 5.368 1.00 . A A . 34 ARG CG 1 1 3 1920 1 1 34 ARG CZ C -0.221 7.687 5.411 1.00 . A A . 34 ARG CZ 1 1 3 1921 1 1 34 ARG H H -0.982 2.423 2.300 1.00 . A A . 34 ARG H 1 1 3 1922 1 1 34 ARG HA H -2.488 1.922 4.753 1.00 . A A . 34 ARG HA 1 1 3 1923 1 1 34 ARG HB2 H -1.599 4.584 3.637 1.00 . A A . 34 ARG HB2 1 1 3 1924 1 1 34 ARG HB3 H -2.647 4.391 5.037 1.00 . A A . 34 ARG HB3 1 1 3 1925 1 1 34 ARG HD2 H -1.193 5.476 6.692 1.00 . A A . 34 ARG HD2 1 1 3 1926 1 1 34 ARG HD3 H 0.543 5.197 6.641 1.00 . A A . 34 ARG HD3 1 1 3 1927 1 1 34 ARG HE H -0.125 6.135 4.134 1.00 . A A . 34 ARG HE 1 1 3 1928 1 1 34 ARG HG2 H -0.734 3.161 6.128 1.00 . A A . 34 ARG HG2 1 1 3 1929 1 1 34 ARG HG3 H 0.260 3.664 4.762 1.00 . A A . 34 ARG HG3 1 1 3 1930 1 1 34 ARG HH11 H -0.201 7.406 7.432 1.00 . A A . 34 ARG HH11 1 1 3 1931 1 1 34 ARG HH12 H -0.189 9.042 6.939 1.00 . A A . 34 ARG HH12 1 1 3 1932 1 1 34 ARG HH21 H -0.235 8.312 3.485 1.00 . A A . 34 ARG HH21 1 1 3 1933 1 1 34 ARG HH22 H -0.220 9.589 4.627 1.00 . A A . 34 ARG HH22 1 1 3 1934 1 1 34 ARG N N -1.257 1.968 3.127 1.00 . A A . 34 ARG N 1 1 3 1935 1 1 34 ARG NE N -0.213 6.380 5.088 1.00 . A A . 34 ARG NE 1 1 3 1936 1 1 34 ARG NH1 N -0.207 8.072 6.681 1.00 . A A . 34 ARG NH1 1 1 3 1937 1 1 34 ARG NH2 N -0.227 8.599 4.454 1.00 . A A . 34 ARG NH2 1 1 3 1938 1 1 34 ARG O O -3.521 2.965 1.900 1.00 . A A . 34 ARG O 1 1 3 1939 1 1 35 CYS C C -6.643 3.922 3.430 1.00 . A A . 35 CYS C 1 1 3 1940 1 1 35 CYS CA C -5.926 2.641 3.070 1.00 . A A . 35 CYS CA 1 1 3 1941 1 1 35 CYS CB C -6.736 1.404 3.450 1.00 . A A . 35 CYS CB 1 1 3 1942 1 1 35 CYS H H -4.662 2.478 4.728 1.00 . A A . 35 CYS H 1 1 3 1943 1 1 35 CYS HA H -5.755 2.644 2.004 1.00 . A A . 35 CYS HA 1 1 3 1944 1 1 35 CYS HB2 H -7.057 1.484 4.478 1.00 . A A . 35 CYS HB2 1 1 3 1945 1 1 35 CYS HB3 H -7.600 1.331 2.805 1.00 . A A . 35 CYS HB3 1 1 3 1946 1 1 35 CYS N N -4.664 2.596 3.754 1.00 . A A . 35 CYS N 1 1 3 1947 1 1 35 CYS O O -6.881 4.205 4.601 1.00 . A A . 35 CYS O 1 1 3 1948 1 1 35 CYS SG S -5.771 -0.147 3.272 1.00 . A A . 35 CYS SG 1 1 3 1949 1 1 36 ARG C C -9.111 5.821 2.717 1.00 . A A . 36 ARG C 1 1 3 1950 1 1 36 ARG CA C -7.602 5.988 2.655 1.00 . A A . 36 ARG CA 1 1 3 1951 1 1 36 ARG CB C -7.226 6.997 1.570 1.00 . A A . 36 ARG CB 1 1 3 1952 1 1 36 ARG CD C -5.532 8.651 0.723 1.00 . A A . 36 ARG CD 1 1 3 1953 1 1 36 ARG CG C -5.770 7.426 1.593 1.00 . A A . 36 ARG CG 1 1 3 1954 1 1 36 ARG CZ C -6.618 10.887 0.460 1.00 . A A . 36 ARG CZ 1 1 3 1955 1 1 36 ARG H H -6.739 4.427 1.518 1.00 . A A . 36 ARG H 1 1 3 1956 1 1 36 ARG HA H -7.261 6.365 3.608 1.00 . A A . 36 ARG HA 1 1 3 1957 1 1 36 ARG HB2 H -7.396 6.500 0.626 1.00 . A A . 36 ARG HB2 1 1 3 1958 1 1 36 ARG HB3 H -7.858 7.870 1.637 1.00 . A A . 36 ARG HB3 1 1 3 1959 1 1 36 ARG HD2 H -4.482 8.901 0.764 1.00 . A A . 36 ARG HD2 1 1 3 1960 1 1 36 ARG HD3 H -5.810 8.421 -0.295 1.00 . A A . 36 ARG HD3 1 1 3 1961 1 1 36 ARG HE H -6.632 9.738 2.112 1.00 . A A . 36 ARG HE 1 1 3 1962 1 1 36 ARG HG2 H -5.474 7.640 2.606 1.00 . A A . 36 ARG HG2 1 1 3 1963 1 1 36 ARG HG3 H -5.172 6.610 1.215 1.00 . A A . 36 ARG HG3 1 1 3 1964 1 1 36 ARG HH11 H -5.488 10.390 -1.179 1.00 . A A . 36 ARG HH11 1 1 3 1965 1 1 36 ARG HH12 H -6.345 11.847 -1.319 1.00 . A A . 36 ARG HH12 1 1 3 1966 1 1 36 ARG HH21 H -7.772 11.777 1.911 1.00 . A A . 36 ARG HH21 1 1 3 1967 1 1 36 ARG HH22 H -7.639 12.649 0.448 1.00 . A A . 36 ARG HH22 1 1 3 1968 1 1 36 ARG N N -6.945 4.716 2.432 1.00 . A A . 36 ARG N 1 1 3 1969 1 1 36 ARG NE N -6.310 9.806 1.184 1.00 . A A . 36 ARG NE 1 1 3 1970 1 1 36 ARG NH1 N -6.114 11.048 -0.755 1.00 . A A . 36 ARG NH1 1 1 3 1971 1 1 36 ARG NH2 N -7.396 11.832 0.980 1.00 . A A . 36 ARG NH2 1 1 3 1972 1 1 36 ARG O O -9.625 4.722 2.533 1.00 . A A . 36 ARG O 1 1 3 1973 1 1 37 ASP C C -11.920 6.763 1.618 1.00 . A A . 37 ASP C 1 1 3 1974 1 1 37 ASP CA C -11.298 6.940 3.001 1.00 . A A . 37 ASP CA 1 1 3 1975 1 1 37 ASP CB C -11.809 8.236 3.657 1.00 . A A . 37 ASP CB 1 1 3 1976 1 1 37 ASP CG C -11.556 9.480 2.829 1.00 . A A . 37 ASP CG 1 1 3 1977 1 1 37 ASP H H -9.358 7.793 2.999 1.00 . A A . 37 ASP H 1 1 3 1978 1 1 37 ASP HA H -11.585 6.095 3.610 1.00 . A A . 37 ASP HA 1 1 3 1979 1 1 37 ASP HB2 H -12.874 8.154 3.817 1.00 . A A . 37 ASP HB2 1 1 3 1980 1 1 37 ASP HB3 H -11.322 8.357 4.615 1.00 . A A . 37 ASP HB3 1 1 3 1981 1 1 37 ASP N N -9.819 6.931 2.911 1.00 . A A . 37 ASP N 1 1 3 1982 1 1 37 ASP O O -13.131 6.697 1.461 1.00 . A A . 37 ASP O 1 1 3 1983 1 1 37 ASP OD1 O -10.386 9.749 2.479 1.00 . A A . 37 ASP OD1 1 1 3 1984 1 1 37 ASP OD2 O -12.500 10.243 2.568 1.00 . A A . 37 ASP OD2 1 1 3 1985 1 1 38 ASP C C -11.490 4.870 -0.919 1.00 . A A . 38 ASP C 1 1 3 1986 1 1 38 ASP CA C -11.437 6.397 -0.757 1.00 . A A . 38 ASP CA 1 1 3 1987 1 1 38 ASP CB C -10.398 7.012 -1.717 1.00 . A A . 38 ASP CB 1 1 3 1988 1 1 38 ASP CG C -10.669 6.742 -3.190 1.00 . A A . 38 ASP CG 1 1 3 1989 1 1 38 ASP H H -10.123 6.882 0.843 1.00 . A A . 38 ASP H 1 1 3 1990 1 1 38 ASP HA H -12.412 6.817 -0.949 1.00 . A A . 38 ASP HA 1 1 3 1991 1 1 38 ASP HB2 H -10.383 8.083 -1.575 1.00 . A A . 38 ASP HB2 1 1 3 1992 1 1 38 ASP HB3 H -9.429 6.612 -1.464 1.00 . A A . 38 ASP HB3 1 1 3 1993 1 1 38 ASP N N -11.058 6.699 0.623 1.00 . A A . 38 ASP N 1 1 3 1994 1 1 38 ASP O O -11.954 4.344 -1.915 1.00 . A A . 38 ASP O 1 1 3 1995 1 1 38 ASP OD1 O -11.616 7.346 -3.760 1.00 . A A . 38 ASP OD1 1 1 3 1996 1 1 38 ASP OD2 O -9.928 5.957 -3.804 1.00 . A A . 38 ASP OD2 1 1 3 1997 1 1 39 PHE C C -9.854 2.106 -0.662 1.00 . A A . 39 PHE C 1 1 3 1998 1 1 39 PHE CA C -10.912 2.724 0.234 1.00 . A A . 39 PHE CA 1 1 3 1999 1 1 39 PHE CB C -12.276 2.027 0.059 1.00 . A A . 39 PHE CB 1 1 3 2000 1 1 39 PHE CD1 C -13.208 1.742 2.369 1.00 . A A . 39 PHE CD1 1 1 3 2001 1 1 39 PHE CD2 C -14.273 3.287 0.912 1.00 . A A . 39 PHE CD2 1 1 3 2002 1 1 39 PHE CE1 C -14.122 2.040 3.361 1.00 . A A . 39 PHE CE1 1 1 3 2003 1 1 39 PHE CE2 C -15.191 3.593 1.897 1.00 . A A . 39 PHE CE2 1 1 3 2004 1 1 39 PHE CG C -13.273 2.362 1.136 1.00 . A A . 39 PHE CG 1 1 3 2005 1 1 39 PHE CZ C -15.116 2.967 3.125 1.00 . A A . 39 PHE CZ 1 1 3 2006 1 1 39 PHE H H -10.664 4.697 0.892 1.00 . A A . 39 PHE H 1 1 3 2007 1 1 39 PHE HA H -10.577 2.546 1.245 1.00 . A A . 39 PHE HA 1 1 3 2008 1 1 39 PHE HB2 H -12.702 2.326 -0.887 1.00 . A A . 39 PHE HB2 1 1 3 2009 1 1 39 PHE HB3 H -12.128 0.956 0.057 1.00 . A A . 39 PHE HB3 1 1 3 2010 1 1 39 PHE HD1 H -12.428 1.016 2.550 1.00 . A A . 39 PHE HD1 1 1 3 2011 1 1 39 PHE HD2 H -14.330 3.776 -0.049 1.00 . A A . 39 PHE HD2 1 1 3 2012 1 1 39 PHE HE1 H -14.060 1.549 4.321 1.00 . A A . 39 PHE HE1 1 1 3 2013 1 1 39 PHE HE2 H -15.966 4.321 1.704 1.00 . A A . 39 PHE HE2 1 1 3 2014 1 1 39 PHE HZ H -15.832 3.201 3.899 1.00 . A A . 39 PHE HZ 1 1 3 2015 1 1 39 PHE N N -10.990 4.187 0.118 1.00 . A A . 39 PHE N 1 1 3 2016 1 1 39 PHE O O -9.644 0.911 -0.633 1.00 . A A . 39 PHE O 1 1 3 2017 1 1 40 ARG C C -6.769 2.529 -1.522 1.00 . A A . 40 ARG C 1 1 3 2018 1 1 40 ARG CA C -8.111 2.429 -2.261 1.00 . A A . 40 ARG CA 1 1 3 2019 1 1 40 ARG CB C -8.091 3.208 -3.582 1.00 . A A . 40 ARG CB 1 1 3 2020 1 1 40 ARG CD C -7.124 1.407 -5.057 1.00 . A A . 40 ARG CD 1 1 3 2021 1 1 40 ARG CG C -6.995 2.821 -4.539 1.00 . A A . 40 ARG CG 1 1 3 2022 1 1 40 ARG CZ C -6.030 0.468 -7.089 1.00 . A A . 40 ARG CZ 1 1 3 2023 1 1 40 ARG H H -9.389 3.867 -1.407 1.00 . A A . 40 ARG H 1 1 3 2024 1 1 40 ARG HA H -8.314 1.389 -2.464 1.00 . A A . 40 ARG HA 1 1 3 2025 1 1 40 ARG HB2 H -9.018 3.035 -4.104 1.00 . A A . 40 ARG HB2 1 1 3 2026 1 1 40 ARG HB3 H -7.987 4.262 -3.372 1.00 . A A . 40 ARG HB3 1 1 3 2027 1 1 40 ARG HD2 H -7.152 0.729 -4.217 1.00 . A A . 40 ARG HD2 1 1 3 2028 1 1 40 ARG HD3 H -8.029 1.305 -5.636 1.00 . A A . 40 ARG HD3 1 1 3 2029 1 1 40 ARG HE H -5.122 1.370 -5.506 1.00 . A A . 40 ARG HE 1 1 3 2030 1 1 40 ARG HG2 H -6.990 3.498 -5.379 1.00 . A A . 40 ARG HG2 1 1 3 2031 1 1 40 ARG HG3 H -6.062 2.906 -4.003 1.00 . A A . 40 ARG HG3 1 1 3 2032 1 1 40 ARG HH11 H -8.081 0.275 -7.140 1.00 . A A . 40 ARG HH11 1 1 3 2033 1 1 40 ARG HH12 H -7.258 -0.333 -8.504 1.00 . A A . 40 ARG HH12 1 1 3 2034 1 1 40 ARG HH21 H -3.973 0.450 -7.466 1.00 . A A . 40 ARG HH21 1 1 3 2035 1 1 40 ARG HH22 H -4.936 -0.216 -8.678 1.00 . A A . 40 ARG HH22 1 1 3 2036 1 1 40 ARG N N -9.165 2.914 -1.413 1.00 . A A . 40 ARG N 1 1 3 2037 1 1 40 ARG NE N -5.974 1.082 -5.896 1.00 . A A . 40 ARG NE 1 1 3 2038 1 1 40 ARG NH1 N -7.206 0.109 -7.603 1.00 . A A . 40 ARG NH1 1 1 3 2039 1 1 40 ARG NH2 N -4.904 0.219 -7.773 1.00 . A A . 40 ARG NH2 1 1 3 2040 1 1 40 ARG O O -6.602 3.369 -0.612 1.00 . A A . 40 ARG O 1 1 3 2041 1 1 41 CYS C C -3.579 2.651 -1.764 1.00 . A A . 41 CYS C 1 1 3 2042 1 1 41 CYS CA C -4.543 1.601 -1.278 1.00 . A A . 41 CYS CA 1 1 3 2043 1 1 41 CYS CB C -3.932 0.235 -1.483 1.00 . A A . 41 CYS CB 1 1 3 2044 1 1 41 CYS H H -6.044 1.036 -2.609 1.00 . A A . 41 CYS H 1 1 3 2045 1 1 41 CYS HA H -4.680 1.729 -0.215 1.00 . A A . 41 CYS HA 1 1 3 2046 1 1 41 CYS HB2 H -4.053 -0.055 -2.517 1.00 . A A . 41 CYS HB2 1 1 3 2047 1 1 41 CYS HB3 H -2.879 0.280 -1.249 1.00 . A A . 41 CYS HB3 1 1 3 2048 1 1 41 CYS N N -5.849 1.669 -1.890 1.00 . A A . 41 CYS N 1 1 3 2049 1 1 41 CYS O O -3.224 2.699 -2.953 1.00 . A A . 41 CYS O 1 1 3 2050 1 1 41 CYS SG S -4.668 -1.046 -0.471 1.00 . A A . 41 CYS SG 1 1 3 2051 1 1 42 TRP C C -0.951 3.945 -0.231 1.00 . A A . 42 TRP C 1 1 3 2052 1 1 42 TRP CA C -2.122 4.428 -1.039 1.00 . A A . 42 TRP CA 1 1 3 2053 1 1 42 TRP CB C -2.545 5.827 -0.587 1.00 . A A . 42 TRP CB 1 1 3 2054 1 1 42 TRP CD1 C -2.146 7.547 -2.425 1.00 . A A . 42 TRP CD1 1 1 3 2055 1 1 42 TRP CD2 C -4.293 6.957 -2.193 1.00 . A A . 42 TRP CD2 1 1 3 2056 1 1 42 TRP CE2 C -4.196 7.906 -3.230 1.00 . A A . 42 TRP CE2 1 1 3 2057 1 1 42 TRP CE3 C -5.550 6.441 -1.875 1.00 . A A . 42 TRP CE3 1 1 3 2058 1 1 42 TRP CG C -2.964 6.737 -1.696 1.00 . A A . 42 TRP CG 1 1 3 2059 1 1 42 TRP CH2 C -6.520 7.829 -3.606 1.00 . A A . 42 TRP CH2 1 1 3 2060 1 1 42 TRP CZ2 C -5.304 8.351 -3.940 1.00 . A A . 42 TRP CZ2 1 1 3 2061 1 1 42 TRP CZ3 C -6.650 6.884 -2.585 1.00 . A A . 42 TRP CZ3 1 1 3 2062 1 1 42 TRP H H -3.536 3.395 0.066 1.00 . A A . 42 TRP H 1 1 3 2063 1 1 42 TRP HA H -1.862 4.424 -2.087 1.00 . A A . 42 TRP HA 1 1 3 2064 1 1 42 TRP HB2 H -3.387 5.728 0.081 1.00 . A A . 42 TRP HB2 1 1 3 2065 1 1 42 TRP HB3 H -1.730 6.292 -0.053 1.00 . A A . 42 TRP HB3 1 1 3 2066 1 1 42 TRP HD1 H -1.077 7.614 -2.285 1.00 . A A . 42 TRP HD1 1 1 3 2067 1 1 42 TRP HE1 H -2.526 8.889 -4.007 1.00 . A A . 42 TRP HE1 1 1 3 2068 1 1 42 TRP HE3 H -5.665 5.711 -1.090 1.00 . A A . 42 TRP HE3 1 1 3 2069 1 1 42 TRP HH2 H -7.408 8.146 -4.133 1.00 . A A . 42 TRP HH2 1 1 3 2070 1 1 42 TRP HZ2 H -5.224 9.079 -4.735 1.00 . A A . 42 TRP HZ2 1 1 3 2071 1 1 42 TRP HZ3 H -7.635 6.500 -2.361 1.00 . A A . 42 TRP HZ3 1 1 3 2072 1 1 42 TRP N N -3.162 3.468 -0.842 1.00 . A A . 42 TRP N 1 1 3 2073 1 1 42 TRP NE1 N -2.881 8.249 -3.347 1.00 . A A . 42 TRP NE1 1 1 3 2074 1 1 42 TRP O O -0.985 3.945 1.003 1.00 . A A . 42 TRP O 1 1 3 2075 1 1 43 CYS C C 2.352 3.795 -0.216 1.00 . A A . 43 CYS C 1 1 3 2076 1 1 43 CYS CA C 1.141 2.889 -0.246 1.00 . A A . 43 CYS CA 1 1 3 2077 1 1 43 CYS CB C 1.405 1.525 -0.876 1.00 . A A . 43 CYS CB 1 1 3 2078 1 1 43 CYS H H 0.085 3.638 -1.871 1.00 . A A . 43 CYS H 1 1 3 2079 1 1 43 CYS HA H 0.833 2.731 0.777 1.00 . A A . 43 CYS HA 1 1 3 2080 1 1 43 CYS HB2 H 1.655 1.656 -1.918 1.00 . A A . 43 CYS HB2 1 1 3 2081 1 1 43 CYS HB3 H 2.220 1.042 -0.357 1.00 . A A . 43 CYS HB3 1 1 3 2082 1 1 43 CYS N N 0.046 3.509 -0.898 1.00 . A A . 43 CYS N 1 1 3 2083 1 1 43 CYS O O 2.678 4.474 -1.207 1.00 . A A . 43 CYS O 1 1 3 2084 1 1 43 CYS SG S -0.064 0.428 -0.766 1.00 . A A . 43 CYS SG 1 1 3 2085 1 1 44 THR C C 5.349 4.077 0.545 1.00 . A A . 44 THR C 1 1 3 2086 1 1 44 THR CA C 4.100 4.661 1.195 1.00 . A A . 44 THR CA 1 1 3 2087 1 1 44 THR CB C 4.313 4.703 2.712 1.00 . A A . 44 THR CB 1 1 3 2088 1 1 44 THR CG2 C 5.221 5.858 3.101 1.00 . A A . 44 THR CG2 1 1 3 2089 1 1 44 THR H H 2.719 3.188 1.630 1.00 . A A . 44 THR H 1 1 3 2090 1 1 44 THR HA H 3.902 5.662 0.841 1.00 . A A . 44 THR HA 1 1 3 2091 1 1 44 THR HB H 4.769 3.772 3.018 1.00 . A A . 44 THR HB 1 1 3 2092 1 1 44 THR HG1 H 2.445 5.460 2.919 1.00 . A A . 44 THR HG1 1 1 3 2093 1 1 44 THR HG21 H 5.351 5.868 4.172 1.00 . A A . 44 THR HG21 1 1 3 2094 1 1 44 THR HG22 H 4.778 6.789 2.780 1.00 . A A . 44 THR HG22 1 1 3 2095 1 1 44 THR HG23 H 6.182 5.735 2.624 1.00 . A A . 44 THR HG23 1 1 3 2096 1 1 44 THR N N 2.995 3.808 0.919 1.00 . A A . 44 THR N 1 1 3 2097 1 1 44 THR O O 5.688 2.918 0.769 1.00 . A A . 44 THR O 1 1 3 2098 1 1 44 THR OG1 O 3.038 4.839 3.379 1.00 . A A . 44 THR OG1 1 1 3 2099 1 1 45 LYS C C 8.353 5.328 -0.650 1.00 . A A . 45 LYS C 1 1 3 2100 1 1 45 LYS CA C 7.166 4.437 -0.957 1.00 . A A . 45 LYS CA 1 1 3 2101 1 1 45 LYS CB C 6.838 4.378 -2.459 1.00 . A A . 45 LYS CB 1 1 3 2102 1 1 45 LYS CD C 5.727 5.436 -4.475 1.00 . A A . 45 LYS CD 1 1 3 2103 1 1 45 LYS CE C 6.837 5.078 -5.451 1.00 . A A . 45 LYS CE 1 1 3 2104 1 1 45 LYS CG C 6.248 5.657 -3.049 1.00 . A A . 45 LYS CG 1 1 3 2105 1 1 45 LYS H H 5.744 5.812 -0.296 1.00 . A A . 45 LYS H 1 1 3 2106 1 1 45 LYS HA H 7.403 3.439 -0.619 1.00 . A A . 45 LYS HA 1 1 3 2107 1 1 45 LYS HB2 H 7.738 4.140 -3.005 1.00 . A A . 45 LYS HB2 1 1 3 2108 1 1 45 LYS HB3 H 6.116 3.588 -2.605 1.00 . A A . 45 LYS HB3 1 1 3 2109 1 1 45 LYS HD2 H 5.009 4.630 -4.463 1.00 . A A . 45 LYS HD2 1 1 3 2110 1 1 45 LYS HD3 H 5.241 6.340 -4.811 1.00 . A A . 45 LYS HD3 1 1 3 2111 1 1 45 LYS HE2 H 7.528 5.907 -5.503 1.00 . A A . 45 LYS HE2 1 1 3 2112 1 1 45 LYS HE3 H 7.352 4.200 -5.092 1.00 . A A . 45 LYS HE3 1 1 3 2113 1 1 45 LYS HG2 H 5.430 5.986 -2.425 1.00 . A A . 45 LYS HG2 1 1 3 2114 1 1 45 LYS HG3 H 7.014 6.419 -3.067 1.00 . A A . 45 LYS HG3 1 1 3 2115 1 1 45 LYS HZ1 H 7.128 4.630 -7.453 1.00 . A A . 45 LYS HZ1 1 1 3 2116 1 1 45 LYS HZ2 H 5.770 5.592 -7.219 1.00 . A A . 45 LYS HZ2 1 1 3 2117 1 1 45 LYS HZ3 H 5.739 3.959 -6.836 1.00 . A A . 45 LYS HZ3 1 1 3 2118 1 1 45 LYS N N 6.016 4.866 -0.228 1.00 . A A . 45 LYS N 1 1 3 2119 1 1 45 LYS NZ N 6.329 4.815 -6.813 1.00 . A A . 45 LYS NZ 1 1 3 2120 1 1 45 LYS O O 8.192 6.514 -0.343 1.00 . A A . 45 LYS O 1 1 3 2121 1 1 46 ASN C C 11.229 6.184 -1.615 1.00 . A A . 46 ASN C 1 1 3 2122 1 1 46 ASN CA C 10.740 5.487 -0.382 1.00 . A A . 46 ASN CA 1 1 3 2123 1 1 46 ASN CB C 11.847 4.577 0.172 1.00 . A A . 46 ASN CB 1 1 3 2124 1 1 46 ASN CG C 11.489 3.918 1.487 1.00 . A A . 46 ASN CG 1 1 3 2125 1 1 46 ASN H H 9.598 3.802 -0.915 1.00 . A A . 46 ASN H 1 1 3 2126 1 1 46 ASN HA H 10.498 6.232 0.361 1.00 . A A . 46 ASN HA 1 1 3 2127 1 1 46 ASN HB2 H 12.052 3.800 -0.547 1.00 . A A . 46 ASN HB2 1 1 3 2128 1 1 46 ASN HB3 H 12.743 5.166 0.316 1.00 . A A . 46 ASN HB3 1 1 3 2129 1 1 46 ASN HD21 H 10.918 2.257 0.565 1.00 . A A . 46 ASN HD21 1 1 3 2130 1 1 46 ASN HD22 H 10.813 2.270 2.295 1.00 . A A . 46 ASN HD22 1 1 3 2131 1 1 46 ASN N N 9.527 4.751 -0.677 1.00 . A A . 46 ASN N 1 1 3 2132 1 1 46 ASN ND2 N 11.022 2.700 1.439 1.00 . A A . 46 ASN ND2 1 1 3 2133 1 1 46 ASN O O 11.441 5.555 -2.654 1.00 . A A . 46 ASN O 1 1 3 2134 1 1 46 ASN OD1 O 11.677 4.500 2.558 1.00 . A A . 46 ASN OD1 1 1 3 2135 1 1 47 CYS C C 12.871 9.246 -2.132 1.00 . A A . 47 CYS C 1 1 3 2136 1 1 47 CYS CA C 11.846 8.238 -2.622 1.00 . A A . 47 CYS CA 1 1 3 2137 1 1 47 CYS CB C 10.656 8.877 -3.371 1.00 . A A . 47 CYS CB 1 1 3 2138 1 1 47 CYS H H 11.197 7.936 -0.686 1.00 . A A . 47 CYS H 1 1 3 2139 1 1 47 CYS HA H 12.354 7.558 -3.288 1.00 . A A . 47 CYS HA 1 1 3 2140 1 1 47 CYS HB2 H 11.024 9.597 -4.086 1.00 . A A . 47 CYS HB2 1 1 3 2141 1 1 47 CYS HB3 H 10.123 8.102 -3.902 1.00 . A A . 47 CYS HB3 1 1 3 2142 1 1 47 CYS N N 11.386 7.456 -1.525 1.00 . A A . 47 CYS N 1 1 3 2143 1 1 47 CYS O O 12.505 10.340 -1.681 1.00 . A A . 47 CYS O 1 1 3 2144 1 1 47 CYS OXT O 14.071 8.911 -2.128 1.00 . A A . 47 CYS OXT 1 1 3 2145 1 1 47 CYS SG S 9.450 9.734 -2.300 1.00 . A A . 47 CYS SG 1 1 4 2146 1 1 1 LYS C C 10.873 10.408 -0.517 1.00 . A A . 1 LYS C 1 1 4 2147 1 1 1 LYS CA C 11.660 11.682 -0.775 1.00 . A A . 1 LYS CA 1 1 4 2148 1 1 1 LYS CB C 10.750 12.775 -1.403 1.00 . A A . 1 LYS CB 1 1 4 2149 1 1 1 LYS CD C 9.915 13.841 0.736 1.00 . A A . 1 LYS CD 1 1 4 2150 1 1 1 LYS CE C 8.692 14.265 1.545 1.00 . A A . 1 LYS CE 1 1 4 2151 1 1 1 LYS CG C 9.528 13.211 -0.586 1.00 . A A . 1 LYS CG 1 1 4 2152 1 1 1 LYS H1 H 13.323 12.175 -1.937 1.00 . A A . 1 LYS H1 1 1 4 2153 1 1 1 LYS H2 H 12.255 11.068 -2.614 1.00 . A A . 1 LYS H2 1 1 4 2154 1 1 1 LYS H3 H 13.285 10.560 -1.386 1.00 . A A . 1 LYS H3 1 1 4 2155 1 1 1 LYS HA H 12.094 12.045 0.143 1.00 . A A . 1 LYS HA 1 1 4 2156 1 1 1 LYS HB2 H 11.350 13.655 -1.577 1.00 . A A . 1 LYS HB2 1 1 4 2157 1 1 1 LYS HB3 H 10.403 12.410 -2.358 1.00 . A A . 1 LYS HB3 1 1 4 2158 1 1 1 LYS HD2 H 10.481 13.124 1.311 1.00 . A A . 1 LYS HD2 1 1 4 2159 1 1 1 LYS HD3 H 10.527 14.709 0.540 1.00 . A A . 1 LYS HD3 1 1 4 2160 1 1 1 LYS HE2 H 8.055 13.405 1.686 1.00 . A A . 1 LYS HE2 1 1 4 2161 1 1 1 LYS HE3 H 9.026 14.620 2.510 1.00 . A A . 1 LYS HE3 1 1 4 2162 1 1 1 LYS HG2 H 8.971 13.935 -1.160 1.00 . A A . 1 LYS HG2 1 1 4 2163 1 1 1 LYS HG3 H 8.908 12.345 -0.399 1.00 . A A . 1 LYS HG3 1 1 4 2164 1 1 1 LYS HZ1 H 7.517 15.033 -0.032 1.00 . A A . 1 LYS HZ1 1 1 4 2165 1 1 1 LYS HZ2 H 8.503 16.171 0.714 1.00 . A A . 1 LYS HZ2 1 1 4 2166 1 1 1 LYS HZ3 H 7.121 15.645 1.489 1.00 . A A . 1 LYS HZ3 1 1 4 2167 1 1 1 LYS N N 12.717 11.362 -1.722 1.00 . A A . 1 LYS N 1 1 4 2168 1 1 1 LYS NZ N 7.908 15.335 0.881 1.00 . A A . 1 LYS NZ 1 1 4 2169 1 1 1 LYS O O 10.933 9.484 -1.305 1.00 . A A . 1 LYS O 1 1 4 2170 1 1 2 THR C C 7.928 9.815 0.747 1.00 . A A . 2 THR C 1 1 4 2171 1 1 2 THR CA C 9.318 9.250 0.842 1.00 . A A . 2 THR CA 1 1 4 2172 1 1 2 THR CB C 9.564 8.561 2.194 1.00 . A A . 2 THR CB 1 1 4 2173 1 1 2 THR CG2 C 10.641 7.503 2.069 1.00 . A A . 2 THR CG2 1 1 4 2174 1 1 2 THR H H 10.352 10.982 1.315 1.00 . A A . 2 THR H 1 1 4 2175 1 1 2 THR HA H 9.447 8.536 0.040 1.00 . A A . 2 THR HA 1 1 4 2176 1 1 2 THR HB H 8.640 8.091 2.499 1.00 . A A . 2 THR HB 1 1 4 2177 1 1 2 THR HG1 H 10.802 9.870 2.902 1.00 . A A . 2 THR HG1 1 1 4 2178 1 1 2 THR HG21 H 10.800 7.028 3.026 1.00 . A A . 2 THR HG21 1 1 4 2179 1 1 2 THR HG22 H 11.558 7.962 1.731 1.00 . A A . 2 THR HG22 1 1 4 2180 1 1 2 THR HG23 H 10.317 6.767 1.348 1.00 . A A . 2 THR HG23 1 1 4 2181 1 1 2 THR N N 10.232 10.315 0.605 1.00 . A A . 2 THR N 1 1 4 2182 1 1 2 THR O O 7.658 10.894 1.284 1.00 . A A . 2 THR O 1 1 4 2183 1 1 2 THR OG1 O 9.941 9.536 3.182 1.00 . A A . 2 THR OG1 1 1 4 2184 1 1 3 CYS C C 4.773 8.534 -0.239 1.00 . A A . 3 CYS C 1 1 4 2185 1 1 3 CYS CA C 5.767 9.662 -0.193 1.00 . A A . 3 CYS CA 1 1 4 2186 1 1 3 CYS CB C 5.740 10.492 -1.496 1.00 . A A . 3 CYS CB 1 1 4 2187 1 1 3 CYS H H 7.338 8.287 -0.352 1.00 . A A . 3 CYS H 1 1 4 2188 1 1 3 CYS HA H 5.520 10.315 0.630 1.00 . A A . 3 CYS HA 1 1 4 2189 1 1 3 CYS HB2 H 4.727 10.783 -1.723 1.00 . A A . 3 CYS HB2 1 1 4 2190 1 1 3 CYS HB3 H 6.344 11.379 -1.366 1.00 . A A . 3 CYS HB3 1 1 4 2191 1 1 3 CYS N N 7.085 9.158 0.037 1.00 . A A . 3 CYS N 1 1 4 2192 1 1 3 CYS O O 5.091 7.420 -0.671 1.00 . A A . 3 CYS O 1 1 4 2193 1 1 3 CYS SG S 6.386 9.618 -2.966 1.00 . A A . 3 CYS SG 1 1 4 2194 1 1 4 GLU C C 1.826 8.003 -1.090 1.00 . A A . 4 GLU C 1 1 4 2195 1 1 4 GLU CA C 2.570 7.816 0.219 1.00 . A A . 4 GLU CA 1 1 4 2196 1 1 4 GLU CB C 1.662 8.001 1.409 1.00 . A A . 4 GLU CB 1 1 4 2197 1 1 4 GLU CD C -0.115 7.068 2.845 1.00 . A A . 4 GLU CD 1 1 4 2198 1 1 4 GLU CG C 0.820 6.802 1.717 1.00 . A A . 4 GLU CG 1 1 4 2199 1 1 4 GLU H H 3.425 9.665 0.644 1.00 . A A . 4 GLU H 1 1 4 2200 1 1 4 GLU HA H 3.015 6.833 0.236 1.00 . A A . 4 GLU HA 1 1 4 2201 1 1 4 GLU HB2 H 2.271 8.211 2.276 1.00 . A A . 4 GLU HB2 1 1 4 2202 1 1 4 GLU HB3 H 1.007 8.841 1.227 1.00 . A A . 4 GLU HB3 1 1 4 2203 1 1 4 GLU HG2 H 0.276 6.513 0.834 1.00 . A A . 4 GLU HG2 1 1 4 2204 1 1 4 GLU HG3 H 1.476 5.992 2.000 1.00 . A A . 4 GLU HG3 1 1 4 2205 1 1 4 GLU N N 3.601 8.786 0.246 1.00 . A A . 4 GLU N 1 1 4 2206 1 1 4 GLU O O 1.165 9.025 -1.314 1.00 . A A . 4 GLU O 1 1 4 2207 1 1 4 GLU OE1 O 0.335 7.104 4.004 1.00 . A A . 4 GLU OE1 1 1 4 2208 1 1 4 GLU OE2 O -1.295 7.291 2.608 1.00 . A A . 4 GLU OE2 1 1 4 2209 1 1 5 ASN C C 0.769 5.865 -3.670 1.00 . A A . 5 ASN C 1 1 4 2210 1 1 5 ASN CA C 1.472 7.153 -3.294 1.00 . A A . 5 ASN CA 1 1 4 2211 1 1 5 ASN CB C 2.646 7.476 -4.241 1.00 . A A . 5 ASN CB 1 1 4 2212 1 1 5 ASN CG C 2.296 7.439 -5.710 1.00 . A A . 5 ASN CG 1 1 4 2213 1 1 5 ASN H H 2.437 6.233 -1.683 1.00 . A A . 5 ASN H 1 1 4 2214 1 1 5 ASN HA H 0.762 7.964 -3.336 1.00 . A A . 5 ASN HA 1 1 4 2215 1 1 5 ASN HB2 H 3.010 8.466 -4.017 1.00 . A A . 5 ASN HB2 1 1 4 2216 1 1 5 ASN HB3 H 3.437 6.766 -4.055 1.00 . A A . 5 ASN HB3 1 1 4 2217 1 1 5 ASN HD21 H 1.802 9.366 -5.704 1.00 . A A . 5 ASN HD21 1 1 4 2218 1 1 5 ASN HD22 H 1.635 8.521 -7.199 1.00 . A A . 5 ASN HD22 1 1 4 2219 1 1 5 ASN N N 1.979 7.064 -1.954 1.00 . A A . 5 ASN N 1 1 4 2220 1 1 5 ASN ND2 N 1.877 8.551 -6.247 1.00 . A A . 5 ASN ND2 1 1 4 2221 1 1 5 ASN O O 1.112 4.805 -3.159 1.00 . A A . 5 ASN O 1 1 4 2222 1 1 5 ASN OD1 O 2.423 6.396 -6.356 1.00 . A A . 5 ASN OD1 1 1 4 2223 1 1 6 LEU C C -0.300 3.603 -5.368 1.00 . A A . 6 LEU C 1 1 4 2224 1 1 6 LEU CA C -1.054 4.862 -4.979 1.00 . A A . 6 LEU CA 1 1 4 2225 1 1 6 LEU CB C -1.969 5.303 -6.109 1.00 . A A . 6 LEU CB 1 1 4 2226 1 1 6 LEU CD1 C -3.845 6.728 -6.876 1.00 . A A . 6 LEU CD1 1 1 4 2227 1 1 6 LEU CD2 C -4.059 5.449 -4.829 1.00 . A A . 6 LEU CD2 1 1 4 2228 1 1 6 LEU CG C -3.107 6.212 -5.689 1.00 . A A . 6 LEU CG 1 1 4 2229 1 1 6 LEU H H -0.410 6.864 -4.911 1.00 . A A . 6 LEU H 1 1 4 2230 1 1 6 LEU HA H -1.686 4.601 -4.144 1.00 . A A . 6 LEU HA 1 1 4 2231 1 1 6 LEU HB2 H -1.371 5.822 -6.843 1.00 . A A . 6 LEU HB2 1 1 4 2232 1 1 6 LEU HB3 H -2.392 4.423 -6.569 1.00 . A A . 6 LEU HB3 1 1 4 2233 1 1 6 LEU HD11 H -4.284 5.892 -7.399 1.00 . A A . 6 LEU HD11 1 1 4 2234 1 1 6 LEU HD12 H -3.171 7.270 -7.523 1.00 . A A . 6 LEU HD12 1 1 4 2235 1 1 6 LEU HD13 H -4.631 7.378 -6.524 1.00 . A A . 6 LEU HD13 1 1 4 2236 1 1 6 LEU HD21 H -4.903 6.077 -4.584 1.00 . A A . 6 LEU HD21 1 1 4 2237 1 1 6 LEU HD22 H -3.573 5.149 -3.913 1.00 . A A . 6 LEU HD22 1 1 4 2238 1 1 6 LEU HD23 H -4.404 4.580 -5.366 1.00 . A A . 6 LEU HD23 1 1 4 2239 1 1 6 LEU HG H -2.735 7.042 -5.109 1.00 . A A . 6 LEU HG 1 1 4 2240 1 1 6 LEU N N -0.217 5.977 -4.534 1.00 . A A . 6 LEU N 1 1 4 2241 1 1 6 LEU O O 0.737 3.650 -6.051 1.00 . A A . 6 LEU O 1 1 4 2242 1 1 7 ALA C C -0.423 0.886 -6.676 1.00 . A A . 7 ALA C 1 1 4 2243 1 1 7 ALA CA C -0.298 1.178 -5.190 1.00 . A A . 7 ALA CA 1 1 4 2244 1 1 7 ALA CB C -1.032 0.141 -4.368 1.00 . A A . 7 ALA CB 1 1 4 2245 1 1 7 ALA H H -1.622 2.572 -4.333 1.00 . A A . 7 ALA H 1 1 4 2246 1 1 7 ALA HA H 0.745 1.172 -4.908 1.00 . A A . 7 ALA HA 1 1 4 2247 1 1 7 ALA HB1 H -2.069 0.118 -4.668 1.00 . A A . 7 ALA HB1 1 1 4 2248 1 1 7 ALA HB2 H -0.972 0.423 -3.326 1.00 . A A . 7 ALA HB2 1 1 4 2249 1 1 7 ALA HB3 H -0.582 -0.830 -4.514 1.00 . A A . 7 ALA HB3 1 1 4 2250 1 1 7 ALA N N -0.826 2.491 -4.905 1.00 . A A . 7 ALA N 1 1 4 2251 1 1 7 ALA O O -1.509 1.012 -7.260 1.00 . A A . 7 ALA O 1 1 4 2252 1 1 8 ASP C C 0.264 -1.048 -9.117 1.00 . A A . 8 ASP C 1 1 4 2253 1 1 8 ASP CA C 0.742 0.317 -8.708 1.00 . A A . 8 ASP CA 1 1 4 2254 1 1 8 ASP CB C 2.171 0.546 -9.248 1.00 . A A . 8 ASP CB 1 1 4 2255 1 1 8 ASP CG C 2.687 1.957 -9.048 1.00 . A A . 8 ASP CG 1 1 4 2256 1 1 8 ASP H H 1.464 0.319 -6.724 1.00 . A A . 8 ASP H 1 1 4 2257 1 1 8 ASP HA H 0.094 1.054 -9.160 1.00 . A A . 8 ASP HA 1 1 4 2258 1 1 8 ASP HB2 H 2.844 -0.129 -8.741 1.00 . A A . 8 ASP HB2 1 1 4 2259 1 1 8 ASP HB3 H 2.185 0.321 -10.303 1.00 . A A . 8 ASP HB3 1 1 4 2260 1 1 8 ASP N N 0.672 0.500 -7.275 1.00 . A A . 8 ASP N 1 1 4 2261 1 1 8 ASP O O -0.572 -1.171 -10.017 1.00 . A A . 8 ASP O 1 1 4 2262 1 1 8 ASP OD1 O 2.265 2.877 -9.786 1.00 . A A . 8 ASP OD1 1 1 4 2263 1 1 8 ASP OD2 O 3.543 2.180 -8.165 1.00 . A A . 8 ASP OD2 1 1 4 2264 1 1 9 THR C C -0.894 -3.845 -8.184 1.00 . A A . 9 THR C 1 1 4 2265 1 1 9 THR CA C 0.438 -3.422 -8.824 1.00 . A A . 9 THR CA 1 1 4 2266 1 1 9 THR CB C 1.567 -4.345 -8.396 1.00 . A A . 9 THR CB 1 1 4 2267 1 1 9 THR CG2 C 1.400 -5.709 -8.989 1.00 . A A . 9 THR CG2 1 1 4 2268 1 1 9 THR H H 1.466 -1.965 -7.776 1.00 . A A . 9 THR H 1 1 4 2269 1 1 9 THR HA H 0.344 -3.479 -9.899 1.00 . A A . 9 THR HA 1 1 4 2270 1 1 9 THR HB H 1.583 -4.415 -7.318 1.00 . A A . 9 THR HB 1 1 4 2271 1 1 9 THR HG1 H 3.308 -3.670 -8.035 1.00 . A A . 9 THR HG1 1 1 4 2272 1 1 9 THR HG21 H 1.416 -5.623 -10.065 1.00 . A A . 9 THR HG21 1 1 4 2273 1 1 9 THR HG22 H 0.450 -6.100 -8.663 1.00 . A A . 9 THR HG22 1 1 4 2274 1 1 9 THR HG23 H 2.206 -6.345 -8.654 1.00 . A A . 9 THR HG23 1 1 4 2275 1 1 9 THR N N 0.785 -2.075 -8.479 1.00 . A A . 9 THR N 1 1 4 2276 1 1 9 THR O O -1.650 -4.635 -8.760 1.00 . A A . 9 THR O 1 1 4 2277 1 1 9 THR OG1 O 2.806 -3.789 -8.864 1.00 . A A . 9 THR OG1 1 1 4 2278 1 1 10 TYR C C -3.496 -2.705 -6.983 1.00 . A A . 10 TYR C 1 1 4 2279 1 1 10 TYR CA C -2.438 -3.592 -6.344 1.00 . A A . 10 TYR CA 1 1 4 2280 1 1 10 TYR CB C -2.315 -3.306 -4.832 1.00 . A A . 10 TYR CB 1 1 4 2281 1 1 10 TYR CD1 C -3.406 -5.043 -3.346 1.00 . A A . 10 TYR CD1 1 1 4 2282 1 1 10 TYR CD2 C -4.590 -3.031 -3.746 1.00 . A A . 10 TYR CD2 1 1 4 2283 1 1 10 TYR CE1 C -4.433 -5.499 -2.541 1.00 . A A . 10 TYR CE1 1 1 4 2284 1 1 10 TYR CE2 C -5.621 -3.478 -2.945 1.00 . A A . 10 TYR CE2 1 1 4 2285 1 1 10 TYR CG C -3.466 -3.803 -3.964 1.00 . A A . 10 TYR CG 1 1 4 2286 1 1 10 TYR CZ C -5.541 -4.709 -2.347 1.00 . A A . 10 TYR CZ 1 1 4 2287 1 1 10 TYR H H -0.544 -2.696 -6.602 1.00 . A A . 10 TYR H 1 1 4 2288 1 1 10 TYR HA H -2.687 -4.631 -6.511 1.00 . A A . 10 TYR HA 1 1 4 2289 1 1 10 TYR HB2 H -1.413 -3.769 -4.461 1.00 . A A . 10 TYR HB2 1 1 4 2290 1 1 10 TYR HB3 H -2.236 -2.237 -4.695 1.00 . A A . 10 TYR HB3 1 1 4 2291 1 1 10 TYR HD1 H -2.532 -5.658 -3.506 1.00 . A A . 10 TYR HD1 1 1 4 2292 1 1 10 TYR HD2 H -4.661 -2.060 -4.212 1.00 . A A . 10 TYR HD2 1 1 4 2293 1 1 10 TYR HE1 H -4.353 -6.468 -2.071 1.00 . A A . 10 TYR HE1 1 1 4 2294 1 1 10 TYR HE2 H -6.485 -2.845 -2.801 1.00 . A A . 10 TYR HE2 1 1 4 2295 1 1 10 TYR HH H -7.407 -4.898 -1.967 1.00 . A A . 10 TYR HH 1 1 4 2296 1 1 10 TYR N N -1.186 -3.307 -7.018 1.00 . A A . 10 TYR N 1 1 4 2297 1 1 10 TYR O O -3.624 -1.533 -6.643 1.00 . A A . 10 TYR O 1 1 4 2298 1 1 10 TYR OH O -6.572 -5.148 -1.545 1.00 . A A . 10 TYR OH 1 1 4 2299 1 1 11 LYS C C -6.576 -2.611 -8.221 1.00 . A A . 11 LYS C 1 1 4 2300 1 1 11 LYS CA C -5.155 -2.470 -8.736 1.00 . A A . 11 LYS CA 1 1 4 2301 1 1 11 LYS CB C -5.075 -2.895 -10.192 1.00 . A A . 11 LYS CB 1 1 4 2302 1 1 11 LYS CD C -3.647 -3.191 -12.246 1.00 . A A . 11 LYS CD 1 1 4 2303 1 1 11 LYS CE C -4.649 -2.439 -13.097 1.00 . A A . 11 LYS CE 1 1 4 2304 1 1 11 LYS CG C -3.693 -2.722 -10.804 1.00 . A A . 11 LYS CG 1 1 4 2305 1 1 11 LYS H H -4.050 -4.187 -8.174 1.00 . A A . 11 LYS H 1 1 4 2306 1 1 11 LYS HA H -4.874 -1.434 -8.665 1.00 . A A . 11 LYS HA 1 1 4 2307 1 1 11 LYS HB2 H -5.359 -3.934 -10.270 1.00 . A A . 11 LYS HB2 1 1 4 2308 1 1 11 LYS HB3 H -5.775 -2.296 -10.754 1.00 . A A . 11 LYS HB3 1 1 4 2309 1 1 11 LYS HD2 H -2.656 -3.026 -12.641 1.00 . A A . 11 LYS HD2 1 1 4 2310 1 1 11 LYS HD3 H -3.880 -4.245 -12.278 1.00 . A A . 11 LYS HD3 1 1 4 2311 1 1 11 LYS HE2 H -5.639 -2.687 -12.745 1.00 . A A . 11 LYS HE2 1 1 4 2312 1 1 11 LYS HE3 H -4.470 -1.385 -12.958 1.00 . A A . 11 LYS HE3 1 1 4 2313 1 1 11 LYS HG2 H -3.426 -1.679 -10.773 1.00 . A A . 11 LYS HG2 1 1 4 2314 1 1 11 LYS HG3 H -2.982 -3.293 -10.224 1.00 . A A . 11 LYS HG3 1 1 4 2315 1 1 11 LYS HZ1 H -3.655 -2.476 -14.932 1.00 . A A . 11 LYS HZ1 1 1 4 2316 1 1 11 LYS HZ2 H -5.347 -2.399 -15.078 1.00 . A A . 11 LYS HZ2 1 1 4 2317 1 1 11 LYS HZ3 H -4.604 -3.825 -14.658 1.00 . A A . 11 LYS HZ3 1 1 4 2318 1 1 11 LYS N N -4.196 -3.241 -7.951 1.00 . A A . 11 LYS N 1 1 4 2319 1 1 11 LYS NZ N -4.558 -2.794 -14.526 1.00 . A A . 11 LYS NZ 1 1 4 2320 1 1 11 LYS O O -7.548 -2.263 -8.906 1.00 . A A . 11 LYS O 1 1 4 2321 1 1 12 GLY C C -8.219 -2.424 -5.247 1.00 . A A . 12 GLY C 1 1 4 2322 1 1 12 GLY CA C -7.994 -3.271 -6.467 1.00 . A A . 12 GLY CA 1 1 4 2323 1 1 12 GLY H H -5.883 -3.278 -6.531 1.00 . A A . 12 GLY H 1 1 4 2324 1 1 12 GLY HA2 H -8.744 -3.030 -7.206 1.00 . A A . 12 GLY HA2 1 1 4 2325 1 1 12 GLY HA3 H -8.091 -4.309 -6.186 1.00 . A A . 12 GLY HA3 1 1 4 2326 1 1 12 GLY N N -6.698 -3.075 -7.034 1.00 . A A . 12 GLY N 1 1 4 2327 1 1 12 GLY O O -7.304 -1.696 -4.815 1.00 . A A . 12 GLY O 1 1 4 2328 1 1 13 PRO C C -9.204 -2.594 -2.277 1.00 . A A . 13 PRO C 1 1 4 2329 1 1 13 PRO CA C -9.739 -1.780 -3.447 1.00 . A A . 13 PRO CA 1 1 4 2330 1 1 13 PRO CB C -11.270 -1.744 -3.392 1.00 . A A . 13 PRO CB 1 1 4 2331 1 1 13 PRO CD C -10.641 -3.022 -5.318 1.00 . A A . 13 PRO CD 1 1 4 2332 1 1 13 PRO CG C -11.707 -2.861 -4.269 1.00 . A A . 13 PRO CG 1 1 4 2333 1 1 13 PRO HA H -9.340 -0.779 -3.397 1.00 . A A . 13 PRO HA 1 1 4 2334 1 1 13 PRO HB2 H -11.585 -1.910 -2.371 1.00 . A A . 13 PRO HB2 1 1 4 2335 1 1 13 PRO HB3 H -11.643 -0.790 -3.735 1.00 . A A . 13 PRO HB3 1 1 4 2336 1 1 13 PRO HD2 H -10.472 -4.063 -5.545 1.00 . A A . 13 PRO HD2 1 1 4 2337 1 1 13 PRO HD3 H -10.913 -2.481 -6.213 1.00 . A A . 13 PRO HD3 1 1 4 2338 1 1 13 PRO HG2 H -11.799 -3.766 -3.688 1.00 . A A . 13 PRO HG2 1 1 4 2339 1 1 13 PRO HG3 H -12.652 -2.615 -4.730 1.00 . A A . 13 PRO HG3 1 1 4 2340 1 1 13 PRO N N -9.440 -2.431 -4.705 1.00 . A A . 13 PRO N 1 1 4 2341 1 1 13 PRO O O -8.961 -3.818 -2.388 1.00 . A A . 13 PRO O 1 1 4 2342 1 1 14 CYS C C -9.691 -2.766 0.954 1.00 . A A . 14 CYS C 1 1 4 2343 1 1 14 CYS CA C -8.534 -2.531 0.008 1.00 . A A . 14 CYS CA 1 1 4 2344 1 1 14 CYS CB C -7.520 -1.600 0.664 1.00 . A A . 14 CYS CB 1 1 4 2345 1 1 14 CYS H H -9.208 -0.967 -1.196 1.00 . A A . 14 CYS H 1 1 4 2346 1 1 14 CYS HA H -8.048 -3.465 -0.226 1.00 . A A . 14 CYS HA 1 1 4 2347 1 1 14 CYS HB2 H -6.650 -1.523 0.029 1.00 . A A . 14 CYS HB2 1 1 4 2348 1 1 14 CYS HB3 H -7.964 -0.622 0.773 1.00 . A A . 14 CYS HB3 1 1 4 2349 1 1 14 CYS N N -9.012 -1.933 -1.196 1.00 . A A . 14 CYS N 1 1 4 2350 1 1 14 CYS O O -10.532 -1.874 1.152 1.00 . A A . 14 CYS O 1 1 4 2351 1 1 14 CYS SG S -6.954 -2.141 2.301 1.00 . A A . 14 CYS SG 1 1 4 2352 1 1 15 PHE C C -10.135 -4.160 3.869 1.00 . A A . 15 PHE C 1 1 4 2353 1 1 15 PHE CA C -10.777 -4.247 2.492 1.00 . A A . 15 PHE CA 1 1 4 2354 1 1 15 PHE CB C -11.389 -5.634 2.240 1.00 . A A . 15 PHE CB 1 1 4 2355 1 1 15 PHE CD1 C -11.252 -6.458 -0.138 1.00 . A A . 15 PHE CD1 1 1 4 2356 1 1 15 PHE CD2 C -13.182 -5.240 0.534 1.00 . A A . 15 PHE CD2 1 1 4 2357 1 1 15 PHE CE1 C -11.767 -6.579 -1.411 1.00 . A A . 15 PHE CE1 1 1 4 2358 1 1 15 PHE CE2 C -13.701 -5.359 -0.733 1.00 . A A . 15 PHE CE2 1 1 4 2359 1 1 15 PHE CG C -11.956 -5.786 0.852 1.00 . A A . 15 PHE CG 1 1 4 2360 1 1 15 PHE CZ C -12.995 -6.029 -1.710 1.00 . A A . 15 PHE CZ 1 1 4 2361 1 1 15 PHE H H -9.123 -4.650 1.270 1.00 . A A . 15 PHE H 1 1 4 2362 1 1 15 PHE HA H -11.542 -3.489 2.403 1.00 . A A . 15 PHE HA 1 1 4 2363 1 1 15 PHE HB2 H -10.643 -6.399 2.389 1.00 . A A . 15 PHE HB2 1 1 4 2364 1 1 15 PHE HB3 H -12.193 -5.791 2.943 1.00 . A A . 15 PHE HB3 1 1 4 2365 1 1 15 PHE HD1 H -10.292 -6.894 0.091 1.00 . A A . 15 PHE HD1 1 1 4 2366 1 1 15 PHE HD2 H -13.743 -4.712 1.290 1.00 . A A . 15 PHE HD2 1 1 4 2367 1 1 15 PHE HE1 H -11.209 -7.106 -2.171 1.00 . A A . 15 PHE HE1 1 1 4 2368 1 1 15 PHE HE2 H -14.663 -4.923 -0.950 1.00 . A A . 15 PHE HE2 1 1 4 2369 1 1 15 PHE HZ H -13.402 -6.123 -2.706 1.00 . A A . 15 PHE HZ 1 1 4 2370 1 1 15 PHE N N -9.765 -3.948 1.514 1.00 . A A . 15 PHE N 1 1 4 2371 1 1 15 PHE O O -10.465 -3.288 4.664 1.00 . A A . 15 PHE O 1 1 4 2372 1 1 16 THR C C -7.101 -4.247 5.087 1.00 . A A . 16 THR C 1 1 4 2373 1 1 16 THR CA C -8.406 -5.005 5.331 1.00 . A A . 16 THR CA 1 1 4 2374 1 1 16 THR CB C -8.074 -6.458 5.741 1.00 . A A . 16 THR CB 1 1 4 2375 1 1 16 THR CG2 C -7.323 -6.513 7.064 1.00 . A A . 16 THR CG2 1 1 4 2376 1 1 16 THR H H -8.901 -5.633 3.391 1.00 . A A . 16 THR H 1 1 4 2377 1 1 16 THR HA H -8.986 -4.530 6.107 1.00 . A A . 16 THR HA 1 1 4 2378 1 1 16 THR HB H -7.453 -6.873 4.962 1.00 . A A . 16 THR HB 1 1 4 2379 1 1 16 THR HG1 H -9.703 -7.232 4.976 1.00 . A A . 16 THR HG1 1 1 4 2380 1 1 16 THR HG21 H -7.928 -6.070 7.839 1.00 . A A . 16 THR HG21 1 1 4 2381 1 1 16 THR HG22 H -6.396 -5.965 6.975 1.00 . A A . 16 THR HG22 1 1 4 2382 1 1 16 THR HG23 H -7.110 -7.541 7.316 1.00 . A A . 16 THR HG23 1 1 4 2383 1 1 16 THR N N -9.158 -5.003 4.096 1.00 . A A . 16 THR N 1 1 4 2384 1 1 16 THR O O -6.344 -4.622 4.183 1.00 . A A . 16 THR O 1 1 4 2385 1 1 16 THR OG1 O -9.289 -7.222 5.849 1.00 . A A . 16 THR OG1 1 1 4 2386 1 1 17 THR C C -4.350 -3.230 5.717 1.00 . A A . 17 THR C 1 1 4 2387 1 1 17 THR CA C -5.631 -2.383 5.706 1.00 . A A . 17 THR CA 1 1 4 2388 1 1 17 THR CB C -5.550 -1.267 6.780 1.00 . A A . 17 THR CB 1 1 4 2389 1 1 17 THR CG2 C -4.305 -0.397 6.582 1.00 . A A . 17 THR CG2 1 1 4 2390 1 1 17 THR H H -7.457 -2.983 6.602 1.00 . A A . 17 THR H 1 1 4 2391 1 1 17 THR HA H -5.710 -1.918 4.733 1.00 . A A . 17 THR HA 1 1 4 2392 1 1 17 THR HB H -5.515 -1.722 7.758 1.00 . A A . 17 THR HB 1 1 4 2393 1 1 17 THR HG1 H -7.255 -0.602 7.483 1.00 . A A . 17 THR HG1 1 1 4 2394 1 1 17 THR HG21 H -4.267 0.362 7.350 1.00 . A A . 17 THR HG21 1 1 4 2395 1 1 17 THR HG22 H -4.348 0.076 5.611 1.00 . A A . 17 THR HG22 1 1 4 2396 1 1 17 THR HG23 H -3.422 -1.016 6.640 1.00 . A A . 17 THR HG23 1 1 4 2397 1 1 17 THR N N -6.834 -3.210 5.878 1.00 . A A . 17 THR N 1 1 4 2398 1 1 17 THR O O -3.470 -3.066 4.857 1.00 . A A . 17 THR O 1 1 4 2399 1 1 17 THR OG1 O -6.724 -0.439 6.694 1.00 . A A . 17 THR OG1 1 1 4 2400 1 1 18 GLY C C -2.922 -5.914 5.531 1.00 . A A . 18 GLY C 1 1 4 2401 1 1 18 GLY CA C -3.154 -5.056 6.760 1.00 . A A . 18 GLY CA 1 1 4 2402 1 1 18 GLY H H -5.058 -4.293 7.247 1.00 . A A . 18 GLY H 1 1 4 2403 1 1 18 GLY HA2 H -2.277 -4.452 6.937 1.00 . A A . 18 GLY HA2 1 1 4 2404 1 1 18 GLY HA3 H -3.311 -5.704 7.609 1.00 . A A . 18 GLY HA3 1 1 4 2405 1 1 18 GLY N N -4.300 -4.189 6.629 1.00 . A A . 18 GLY N 1 1 4 2406 1 1 18 GLY O O -1.805 -6.337 5.276 1.00 . A A . 18 GLY O 1 1 4 2407 1 1 19 SER C C -3.219 -6.180 2.430 1.00 . A A . 19 SER C 1 1 4 2408 1 1 19 SER CA C -3.889 -6.949 3.566 1.00 . A A . 19 SER CA 1 1 4 2409 1 1 19 SER CB C -5.295 -7.423 3.158 1.00 . A A . 19 SER CB 1 1 4 2410 1 1 19 SER H H -4.813 -5.679 4.963 1.00 . A A . 19 SER H 1 1 4 2411 1 1 19 SER HA H -3.282 -7.810 3.802 1.00 . A A . 19 SER HA 1 1 4 2412 1 1 19 SER HB2 H -5.736 -7.973 3.977 1.00 . A A . 19 SER HB2 1 1 4 2413 1 1 19 SER HB3 H -5.904 -6.558 2.941 1.00 . A A . 19 SER HB3 1 1 4 2414 1 1 19 SER HG H -5.017 -9.148 2.328 1.00 . A A . 19 SER HG 1 1 4 2415 1 1 19 SER N N -3.965 -6.122 4.748 1.00 . A A . 19 SER N 1 1 4 2416 1 1 19 SER O O -2.388 -6.733 1.688 1.00 . A A . 19 SER O 1 1 4 2417 1 1 19 SER OG O -5.265 -8.266 2.016 1.00 . A A . 19 SER OG 1 1 4 2418 1 1 20 CYS C C -1.542 -3.726 1.687 1.00 . A A . 20 CYS C 1 1 4 2419 1 1 20 CYS CA C -2.947 -4.102 1.267 1.00 . A A . 20 CYS CA 1 1 4 2420 1 1 20 CYS CB C -3.771 -2.860 0.957 1.00 . A A . 20 CYS CB 1 1 4 2421 1 1 20 CYS H H -4.196 -4.500 2.917 1.00 . A A . 20 CYS H 1 1 4 2422 1 1 20 CYS HA H -2.878 -4.721 0.383 1.00 . A A . 20 CYS HA 1 1 4 2423 1 1 20 CYS HB2 H -4.786 -3.147 0.728 1.00 . A A . 20 CYS HB2 1 1 4 2424 1 1 20 CYS HB3 H -3.768 -2.211 1.821 1.00 . A A . 20 CYS HB3 1 1 4 2425 1 1 20 CYS N N -3.548 -4.908 2.303 1.00 . A A . 20 CYS N 1 1 4 2426 1 1 20 CYS O O -0.621 -3.671 0.861 1.00 . A A . 20 CYS O 1 1 4 2427 1 1 20 CYS SG S -3.127 -1.911 -0.445 1.00 . A A . 20 CYS SG 1 1 4 2428 1 1 21 ASP C C 0.860 -4.399 3.255 1.00 . A A . 21 ASP C 1 1 4 2429 1 1 21 ASP CA C -0.054 -3.240 3.559 1.00 . A A . 21 ASP CA 1 1 4 2430 1 1 21 ASP CB C -0.126 -3.019 5.067 1.00 . A A . 21 ASP CB 1 1 4 2431 1 1 21 ASP CG C 1.225 -2.704 5.682 1.00 . A A . 21 ASP CG 1 1 4 2432 1 1 21 ASP H H -2.147 -3.510 3.595 1.00 . A A . 21 ASP H 1 1 4 2433 1 1 21 ASP HA H 0.341 -2.353 3.084 1.00 . A A . 21 ASP HA 1 1 4 2434 1 1 21 ASP HB2 H -0.794 -2.195 5.273 1.00 . A A . 21 ASP HB2 1 1 4 2435 1 1 21 ASP HB3 H -0.515 -3.912 5.532 1.00 . A A . 21 ASP HB3 1 1 4 2436 1 1 21 ASP N N -1.367 -3.510 2.996 1.00 . A A . 21 ASP N 1 1 4 2437 1 1 21 ASP O O 1.942 -4.207 2.750 1.00 . A A . 21 ASP O 1 1 4 2438 1 1 21 ASP OD1 O 1.631 -1.522 5.687 1.00 . A A . 21 ASP OD1 1 1 4 2439 1 1 21 ASP OD2 O 1.869 -3.615 6.220 1.00 . A A . 21 ASP OD2 1 1 4 2440 1 1 22 ASP C C 1.488 -6.938 1.745 1.00 . A A . 22 ASP C 1 1 4 2441 1 1 22 ASP CA C 1.081 -6.857 3.214 1.00 . A A . 22 ASP CA 1 1 4 2442 1 1 22 ASP CB C 0.193 -8.055 3.584 1.00 . A A . 22 ASP CB 1 1 4 2443 1 1 22 ASP CG C 0.870 -9.393 3.428 1.00 . A A . 22 ASP CG 1 1 4 2444 1 1 22 ASP H H -0.556 -5.666 3.851 1.00 . A A . 22 ASP H 1 1 4 2445 1 1 22 ASP HA H 1.979 -6.888 3.812 1.00 . A A . 22 ASP HA 1 1 4 2446 1 1 22 ASP HB2 H -0.114 -7.957 4.615 1.00 . A A . 22 ASP HB2 1 1 4 2447 1 1 22 ASP HB3 H -0.685 -8.039 2.956 1.00 . A A . 22 ASP HB3 1 1 4 2448 1 1 22 ASP N N 0.348 -5.608 3.473 1.00 . A A . 22 ASP N 1 1 4 2449 1 1 22 ASP O O 2.614 -7.296 1.429 1.00 . A A . 22 ASP O 1 1 4 2450 1 1 22 ASP OD1 O 0.707 -10.041 2.372 1.00 . A A . 22 ASP OD1 1 1 4 2451 1 1 22 ASP OD2 O 1.547 -9.850 4.376 1.00 . A A . 22 ASP OD2 1 1 4 2452 1 1 23 HIS C C 1.971 -5.497 -0.891 1.00 . A A . 23 HIS C 1 1 4 2453 1 1 23 HIS CA C 0.887 -6.538 -0.573 1.00 . A A . 23 HIS CA 1 1 4 2454 1 1 23 HIS CB C -0.390 -6.273 -1.395 1.00 . A A . 23 HIS CB 1 1 4 2455 1 1 23 HIS CD2 C 0.257 -5.404 -3.760 1.00 . A A . 23 HIS CD2 1 1 4 2456 1 1 23 HIS CE1 C -0.335 -7.110 -4.954 1.00 . A A . 23 HIS CE1 1 1 4 2457 1 1 23 HIS CG C -0.208 -6.339 -2.894 1.00 . A A . 23 HIS CG 1 1 4 2458 1 1 23 HIS H H -0.288 -6.229 1.160 1.00 . A A . 23 HIS H 1 1 4 2459 1 1 23 HIS HA H 1.273 -7.515 -0.823 1.00 . A A . 23 HIS HA 1 1 4 2460 1 1 23 HIS HB2 H -1.139 -7.003 -1.129 1.00 . A A . 23 HIS HB2 1 1 4 2461 1 1 23 HIS HB3 H -0.761 -5.289 -1.149 1.00 . A A . 23 HIS HB3 1 1 4 2462 1 1 23 HIS HD1 H -0.914 -8.283 -3.339 1.00 . A A . 23 HIS HD1 1 1 4 2463 1 1 23 HIS HD2 H 0.631 -4.429 -3.483 1.00 . A A . 23 HIS HD2 1 1 4 2464 1 1 23 HIS HE1 H -0.549 -7.750 -5.798 1.00 . A A . 23 HIS HE1 1 1 4 2465 1 1 23 HIS N N 0.592 -6.537 0.853 1.00 . A A . 23 HIS N 1 1 4 2466 1 1 23 HIS ND1 N -0.575 -7.420 -3.670 1.00 . A A . 23 HIS ND1 1 1 4 2467 1 1 23 HIS NE2 N 0.174 -5.897 -5.061 1.00 . A A . 23 HIS NE2 1 1 4 2468 1 1 23 HIS O O 2.949 -5.801 -1.571 1.00 . A A . 23 HIS O 1 1 4 2469 1 1 24 CYS C C 4.147 -3.547 0.056 1.00 . A A . 24 CYS C 1 1 4 2470 1 1 24 CYS CA C 2.796 -3.252 -0.620 1.00 . A A . 24 CYS CA 1 1 4 2471 1 1 24 CYS CB C 2.250 -1.842 -0.310 1.00 . A A . 24 CYS CB 1 1 4 2472 1 1 24 CYS H H 1.006 -4.085 0.140 1.00 . A A . 24 CYS H 1 1 4 2473 1 1 24 CYS HA H 2.976 -3.318 -1.682 1.00 . A A . 24 CYS HA 1 1 4 2474 1 1 24 CYS HB2 H 1.815 -1.839 0.679 1.00 . A A . 24 CYS HB2 1 1 4 2475 1 1 24 CYS HB3 H 3.059 -1.129 -0.352 1.00 . A A . 24 CYS HB3 1 1 4 2476 1 1 24 CYS N N 1.813 -4.292 -0.384 1.00 . A A . 24 CYS N 1 1 4 2477 1 1 24 CYS O O 5.181 -3.115 -0.420 1.00 . A A . 24 CYS O 1 1 4 2478 1 1 24 CYS SG S 0.959 -1.303 -1.502 1.00 . A A . 24 CYS SG 1 1 4 2479 1 1 25 LYS C C 6.029 -5.840 0.965 1.00 . A A . 25 LYS C 1 1 4 2480 1 1 25 LYS CA C 5.349 -4.756 1.802 1.00 . A A . 25 LYS CA 1 1 4 2481 1 1 25 LYS CB C 5.023 -5.378 3.167 1.00 . A A . 25 LYS CB 1 1 4 2482 1 1 25 LYS CD C 5.655 -3.655 4.888 1.00 . A A . 25 LYS CD 1 1 4 2483 1 1 25 LYS CE C 5.138 -2.962 6.130 1.00 . A A . 25 LYS CE 1 1 4 2484 1 1 25 LYS CG C 4.539 -4.451 4.257 1.00 . A A . 25 LYS CG 1 1 4 2485 1 1 25 LYS H H 3.255 -4.542 1.534 1.00 . A A . 25 LYS H 1 1 4 2486 1 1 25 LYS HA H 6.013 -3.918 1.946 1.00 . A A . 25 LYS HA 1 1 4 2487 1 1 25 LYS HB2 H 4.246 -6.112 3.024 1.00 . A A . 25 LYS HB2 1 1 4 2488 1 1 25 LYS HB3 H 5.911 -5.876 3.524 1.00 . A A . 25 LYS HB3 1 1 4 2489 1 1 25 LYS HD2 H 6.461 -4.321 5.156 1.00 . A A . 25 LYS HD2 1 1 4 2490 1 1 25 LYS HD3 H 6.007 -2.911 4.189 1.00 . A A . 25 LYS HD3 1 1 4 2491 1 1 25 LYS HE2 H 4.390 -2.242 5.832 1.00 . A A . 25 LYS HE2 1 1 4 2492 1 1 25 LYS HE3 H 4.678 -3.700 6.770 1.00 . A A . 25 LYS HE3 1 1 4 2493 1 1 25 LYS HG2 H 3.827 -3.760 3.829 1.00 . A A . 25 LYS HG2 1 1 4 2494 1 1 25 LYS HG3 H 4.047 -5.036 5.018 1.00 . A A . 25 LYS HG3 1 1 4 2495 1 1 25 LYS HZ1 H 5.784 -1.813 7.727 1.00 . A A . 25 LYS HZ1 1 1 4 2496 1 1 25 LYS HZ2 H 6.629 -1.519 6.291 1.00 . A A . 25 LYS HZ2 1 1 4 2497 1 1 25 LYS HZ3 H 6.937 -2.918 7.185 1.00 . A A . 25 LYS HZ3 1 1 4 2498 1 1 25 LYS N N 4.126 -4.302 1.140 1.00 . A A . 25 LYS N 1 1 4 2499 1 1 25 LYS NZ N 6.193 -2.260 6.880 1.00 . A A . 25 LYS NZ 1 1 4 2500 1 1 25 LYS O O 7.193 -5.732 0.620 1.00 . A A . 25 LYS O 1 1 4 2501 1 1 26 ASN C C 5.993 -7.925 -1.514 1.00 . A A . 26 ASN C 1 1 4 2502 1 1 26 ASN CA C 5.800 -8.064 -0.021 1.00 . A A . 26 ASN CA 1 1 4 2503 1 1 26 ASN CB C 4.909 -9.275 0.259 1.00 . A A . 26 ASN CB 1 1 4 2504 1 1 26 ASN CG C 4.805 -9.614 1.728 1.00 . A A . 26 ASN CG 1 1 4 2505 1 1 26 ASN H H 4.304 -6.822 0.834 1.00 . A A . 26 ASN H 1 1 4 2506 1 1 26 ASN HA H 6.760 -8.263 0.429 1.00 . A A . 26 ASN HA 1 1 4 2507 1 1 26 ASN HB2 H 3.915 -9.075 -0.111 1.00 . A A . 26 ASN HB2 1 1 4 2508 1 1 26 ASN HB3 H 5.315 -10.129 -0.262 1.00 . A A . 26 ASN HB3 1 1 4 2509 1 1 26 ASN HD21 H 2.942 -10.193 1.483 1.00 . A A . 26 ASN HD21 1 1 4 2510 1 1 26 ASN HD22 H 3.537 -10.287 3.080 1.00 . A A . 26 ASN HD22 1 1 4 2511 1 1 26 ASN N N 5.265 -6.862 0.625 1.00 . A A . 26 ASN N 1 1 4 2512 1 1 26 ASN ND2 N 3.669 -10.082 2.131 1.00 . A A . 26 ASN ND2 1 1 4 2513 1 1 26 ASN O O 7.059 -8.221 -2.023 1.00 . A A . 26 ASN O 1 1 4 2514 1 1 26 ASN OD1 O 5.738 -9.421 2.503 1.00 . A A . 26 ASN OD1 1 1 4 2515 1 1 27 LYS C C 5.662 -6.134 -4.123 1.00 . A A . 27 LYS C 1 1 4 2516 1 1 27 LYS CA C 5.039 -7.434 -3.663 1.00 . A A . 27 LYS CA 1 1 4 2517 1 1 27 LYS CB C 3.643 -7.612 -4.305 1.00 . A A . 27 LYS CB 1 1 4 2518 1 1 27 LYS CD C 4.512 -8.773 -6.381 1.00 . A A . 27 LYS CD 1 1 4 2519 1 1 27 LYS CE C 4.613 -8.737 -7.898 1.00 . A A . 27 LYS CE 1 1 4 2520 1 1 27 LYS CG C 3.647 -7.635 -5.837 1.00 . A A . 27 LYS CG 1 1 4 2521 1 1 27 LYS H H 4.156 -7.185 -1.763 1.00 . A A . 27 LYS H 1 1 4 2522 1 1 27 LYS HA H 5.670 -8.249 -3.983 1.00 . A A . 27 LYS HA 1 1 4 2523 1 1 27 LYS HB2 H 3.206 -8.535 -3.960 1.00 . A A . 27 LYS HB2 1 1 4 2524 1 1 27 LYS HB3 H 3.016 -6.794 -3.984 1.00 . A A . 27 LYS HB3 1 1 4 2525 1 1 27 LYS HD2 H 5.509 -8.685 -5.975 1.00 . A A . 27 LYS HD2 1 1 4 2526 1 1 27 LYS HD3 H 4.080 -9.716 -6.080 1.00 . A A . 27 LYS HD3 1 1 4 2527 1 1 27 LYS HE2 H 4.992 -7.767 -8.188 1.00 . A A . 27 LYS HE2 1 1 4 2528 1 1 27 LYS HE3 H 5.315 -9.495 -8.212 1.00 . A A . 27 LYS HE3 1 1 4 2529 1 1 27 LYS HG2 H 2.633 -7.765 -6.188 1.00 . A A . 27 LYS HG2 1 1 4 2530 1 1 27 LYS HG3 H 4.033 -6.693 -6.197 1.00 . A A . 27 LYS HG3 1 1 4 2531 1 1 27 LYS HZ1 H 2.559 -8.335 -8.239 1.00 . A A . 27 LYS HZ1 1 1 4 2532 1 1 27 LYS HZ2 H 2.999 -9.950 -8.482 1.00 . A A . 27 LYS HZ2 1 1 4 2533 1 1 27 LYS HZ3 H 3.430 -8.798 -9.595 1.00 . A A . 27 LYS HZ3 1 1 4 2534 1 1 27 LYS N N 4.972 -7.495 -2.216 1.00 . A A . 27 LYS N 1 1 4 2535 1 1 27 LYS NZ N 3.313 -8.964 -8.574 1.00 . A A . 27 LYS NZ 1 1 4 2536 1 1 27 LYS O O 6.554 -6.129 -4.966 1.00 . A A . 27 LYS O 1 1 4 2537 1 1 28 GLU C C 7.026 -3.405 -3.342 1.00 . A A . 28 GLU C 1 1 4 2538 1 1 28 GLU CA C 5.688 -3.732 -3.994 1.00 . A A . 28 GLU CA 1 1 4 2539 1 1 28 GLU CB C 4.658 -2.641 -3.705 1.00 . A A . 28 GLU CB 1 1 4 2540 1 1 28 GLU CD C 3.429 -2.731 -5.901 1.00 . A A . 28 GLU CD 1 1 4 2541 1 1 28 GLU CG C 3.316 -2.834 -4.401 1.00 . A A . 28 GLU CG 1 1 4 2542 1 1 28 GLU H H 4.497 -5.105 -2.892 1.00 . A A . 28 GLU H 1 1 4 2543 1 1 28 GLU HA H 5.845 -3.783 -5.061 1.00 . A A . 28 GLU HA 1 1 4 2544 1 1 28 GLU HB2 H 4.500 -2.566 -2.640 1.00 . A A . 28 GLU HB2 1 1 4 2545 1 1 28 GLU HB3 H 5.071 -1.707 -4.056 1.00 . A A . 28 GLU HB3 1 1 4 2546 1 1 28 GLU HG2 H 2.933 -3.812 -4.153 1.00 . A A . 28 GLU HG2 1 1 4 2547 1 1 28 GLU HG3 H 2.628 -2.079 -4.052 1.00 . A A . 28 GLU HG3 1 1 4 2548 1 1 28 GLU N N 5.198 -5.037 -3.576 1.00 . A A . 28 GLU N 1 1 4 2549 1 1 28 GLU O O 7.767 -2.558 -3.838 1.00 . A A . 28 GLU O 1 1 4 2550 1 1 28 GLU OE1 O 3.933 -3.673 -6.535 1.00 . A A . 28 GLU OE1 1 1 4 2551 1 1 28 GLU OE2 O 2.996 -1.696 -6.485 1.00 . A A . 28 GLU OE2 1 1 4 2552 1 1 29 HIS C C 8.724 -2.484 -0.958 1.00 . A A . 29 HIS C 1 1 4 2553 1 1 29 HIS CA C 8.585 -3.918 -1.471 1.00 . A A . 29 HIS CA 1 1 4 2554 1 1 29 HIS CB C 9.807 -4.329 -2.325 1.00 . A A . 29 HIS CB 1 1 4 2555 1 1 29 HIS CD2 C 10.350 -6.846 -2.027 1.00 . A A . 29 HIS CD2 1 1 4 2556 1 1 29 HIS CE1 C 9.536 -7.614 -3.885 1.00 . A A . 29 HIS CE1 1 1 4 2557 1 1 29 HIS CG C 9.839 -5.787 -2.698 1.00 . A A . 29 HIS CG 1 1 4 2558 1 1 29 HIS H H 6.669 -4.735 -1.891 1.00 . A A . 29 HIS H 1 1 4 2559 1 1 29 HIS HA H 8.521 -4.569 -0.611 1.00 . A A . 29 HIS HA 1 1 4 2560 1 1 29 HIS HB2 H 9.795 -3.760 -3.243 1.00 . A A . 29 HIS HB2 1 1 4 2561 1 1 29 HIS HB3 H 10.711 -4.102 -1.779 1.00 . A A . 29 HIS HB3 1 1 4 2562 1 1 29 HIS HD1 H 8.861 -5.795 -4.581 1.00 . A A . 29 HIS HD1 1 1 4 2563 1 1 29 HIS HD2 H 10.836 -6.802 -1.063 1.00 . A A . 29 HIS HD2 1 1 4 2564 1 1 29 HIS HE1 H 9.231 -8.271 -4.687 1.00 . A A . 29 HIS HE1 1 1 4 2565 1 1 29 HIS N N 7.324 -4.089 -2.226 1.00 . A A . 29 HIS N 1 1 4 2566 1 1 29 HIS ND1 N 9.327 -6.298 -3.876 1.00 . A A . 29 HIS ND1 1 1 4 2567 1 1 29 HIS NE2 N 10.158 -8.004 -2.780 1.00 . A A . 29 HIS NE2 1 1 4 2568 1 1 29 HIS O O 9.831 -1.961 -0.785 1.00 . A A . 29 HIS O 1 1 4 2569 1 1 30 LEU C C 7.612 -0.487 1.314 1.00 . A A . 30 LEU C 1 1 4 2570 1 1 30 LEU CA C 7.538 -0.521 -0.198 1.00 . A A . 30 LEU CA 1 1 4 2571 1 1 30 LEU CB C 6.246 0.130 -0.675 1.00 . A A . 30 LEU CB 1 1 4 2572 1 1 30 LEU CD1 C 4.719 0.816 -2.530 1.00 . A A . 30 LEU CD1 1 1 4 2573 1 1 30 LEU CD2 C 7.193 0.769 -2.919 1.00 . A A . 30 LEU CD2 1 1 4 2574 1 1 30 LEU CG C 6.023 0.133 -2.181 1.00 . A A . 30 LEU CG 1 1 4 2575 1 1 30 LEU H H 6.767 -2.400 -0.739 1.00 . A A . 30 LEU H 1 1 4 2576 1 1 30 LEU HA H 8.374 0.019 -0.612 1.00 . A A . 30 LEU HA 1 1 4 2577 1 1 30 LEU HB2 H 5.420 -0.390 -0.212 1.00 . A A . 30 LEU HB2 1 1 4 2578 1 1 30 LEU HB3 H 6.238 1.154 -0.333 1.00 . A A . 30 LEU HB3 1 1 4 2579 1 1 30 LEU HD11 H 3.899 0.249 -2.114 1.00 . A A . 30 LEU HD11 1 1 4 2580 1 1 30 LEU HD12 H 4.616 0.874 -3.603 1.00 . A A . 30 LEU HD12 1 1 4 2581 1 1 30 LEU HD13 H 4.707 1.810 -2.109 1.00 . A A . 30 LEU HD13 1 1 4 2582 1 1 30 LEU HD21 H 6.980 0.791 -3.977 1.00 . A A . 30 LEU HD21 1 1 4 2583 1 1 30 LEU HD22 H 8.084 0.181 -2.750 1.00 . A A . 30 LEU HD22 1 1 4 2584 1 1 30 LEU HD23 H 7.350 1.773 -2.558 1.00 . A A . 30 LEU HD23 1 1 4 2585 1 1 30 LEU HG H 5.949 -0.898 -2.493 1.00 . A A . 30 LEU HG 1 1 4 2586 1 1 30 LEU N N 7.601 -1.884 -0.662 1.00 . A A . 30 LEU N 1 1 4 2587 1 1 30 LEU O O 7.625 -1.544 1.958 1.00 . A A . 30 LEU O 1 1 4 2588 1 1 31 ARG C C 6.505 0.312 4.030 1.00 . A A . 31 ARG C 1 1 4 2589 1 1 31 ARG CA C 7.740 0.868 3.322 1.00 . A A . 31 ARG CA 1 1 4 2590 1 1 31 ARG CB C 7.977 2.339 3.722 1.00 . A A . 31 ARG CB 1 1 4 2591 1 1 31 ARG CD C 8.282 3.971 5.647 1.00 . A A . 31 ARG CD 1 1 4 2592 1 1 31 ARG CG C 8.118 2.524 5.222 1.00 . A A . 31 ARG CG 1 1 4 2593 1 1 31 ARG CZ C 8.000 5.077 7.877 1.00 . A A . 31 ARG CZ 1 1 4 2594 1 1 31 ARG H H 7.544 1.509 1.317 1.00 . A A . 31 ARG H 1 1 4 2595 1 1 31 ARG HA H 8.589 0.280 3.638 1.00 . A A . 31 ARG HA 1 1 4 2596 1 1 31 ARG HB2 H 8.883 2.691 3.252 1.00 . A A . 31 ARG HB2 1 1 4 2597 1 1 31 ARG HB3 H 7.152 2.943 3.380 1.00 . A A . 31 ARG HB3 1 1 4 2598 1 1 31 ARG HD2 H 9.167 4.382 5.185 1.00 . A A . 31 ARG HD2 1 1 4 2599 1 1 31 ARG HD3 H 7.413 4.532 5.336 1.00 . A A . 31 ARG HD3 1 1 4 2600 1 1 31 ARG HE H 8.797 3.252 7.516 1.00 . A A . 31 ARG HE 1 1 4 2601 1 1 31 ARG HG2 H 7.237 2.128 5.703 1.00 . A A . 31 ARG HG2 1 1 4 2602 1 1 31 ARG HG3 H 8.980 1.965 5.549 1.00 . A A . 31 ARG HG3 1 1 4 2603 1 1 31 ARG HH11 H 7.504 6.324 6.339 1.00 . A A . 31 ARG HH11 1 1 4 2604 1 1 31 ARG HH12 H 7.228 6.962 7.895 1.00 . A A . 31 ARG HH12 1 1 4 2605 1 1 31 ARG HH21 H 8.425 4.144 9.632 1.00 . A A . 31 ARG HH21 1 1 4 2606 1 1 31 ARG HH22 H 7.794 5.717 9.807 1.00 . A A . 31 ARG HH22 1 1 4 2607 1 1 31 ARG N N 7.626 0.709 1.883 1.00 . A A . 31 ARG N 1 1 4 2608 1 1 31 ARG NE N 8.403 4.057 7.109 1.00 . A A . 31 ARG NE 1 1 4 2609 1 1 31 ARG NH1 N 7.550 6.196 7.333 1.00 . A A . 31 ARG NH1 1 1 4 2610 1 1 31 ARG NH2 N 8.075 4.975 9.195 1.00 . A A . 31 ARG NH2 1 1 4 2611 1 1 31 ARG O O 6.625 -0.365 5.043 1.00 . A A . 31 ARG O 1 1 4 2612 1 1 32 SER C C 2.925 0.455 3.068 1.00 . A A . 32 SER C 1 1 4 2613 1 1 32 SER CA C 4.064 0.138 4.032 1.00 . A A . 32 SER CA 1 1 4 2614 1 1 32 SER CB C 3.836 0.786 5.421 1.00 . A A . 32 SER CB 1 1 4 2615 1 1 32 SER H H 5.295 1.106 2.643 1.00 . A A . 32 SER H 1 1 4 2616 1 1 32 SER HA H 4.126 -0.937 4.148 1.00 . A A . 32 SER HA 1 1 4 2617 1 1 32 SER HB2 H 2.785 0.751 5.663 1.00 . A A . 32 SER HB2 1 1 4 2618 1 1 32 SER HB3 H 4.393 0.235 6.163 1.00 . A A . 32 SER HB3 1 1 4 2619 1 1 32 SER HG H 3.792 2.693 4.792 1.00 . A A . 32 SER HG 1 1 4 2620 1 1 32 SER N N 5.334 0.584 3.472 1.00 . A A . 32 SER N 1 1 4 2621 1 1 32 SER O O 3.164 1.063 2.020 1.00 . A A . 32 SER O 1 1 4 2622 1 1 32 SER OG O 4.265 2.160 5.449 1.00 . A A . 32 SER OG 1 1 4 2623 1 1 33 GLY C C -0.602 0.775 3.381 1.00 . A A . 33 GLY C 1 1 4 2624 1 1 33 GLY CA C 0.574 0.316 2.561 1.00 . A A . 33 GLY CA 1 1 4 2625 1 1 33 GLY H H 1.589 -0.474 4.234 1.00 . A A . 33 GLY H 1 1 4 2626 1 1 33 GLY HA2 H 0.839 1.085 1.853 1.00 . A A . 33 GLY HA2 1 1 4 2627 1 1 33 GLY HA3 H 0.299 -0.575 2.018 1.00 . A A . 33 GLY HA3 1 1 4 2628 1 1 33 GLY N N 1.722 0.039 3.399 1.00 . A A . 33 GLY N 1 1 4 2629 1 1 33 GLY O O -0.937 0.149 4.384 1.00 . A A . 33 GLY O 1 1 4 2630 1 1 34 ARG C C -3.590 2.460 2.926 1.00 . A A . 34 ARG C 1 1 4 2631 1 1 34 ARG CA C -2.333 2.383 3.755 1.00 . A A . 34 ARG CA 1 1 4 2632 1 1 34 ARG CB C -2.011 3.735 4.371 1.00 . A A . 34 ARG CB 1 1 4 2633 1 1 34 ARG CD C -0.671 5.058 6.004 1.00 . A A . 34 ARG CD 1 1 4 2634 1 1 34 ARG CG C -0.919 3.689 5.423 1.00 . A A . 34 ARG CG 1 1 4 2635 1 1 34 ARG CZ C -2.301 6.869 6.530 1.00 . A A . 34 ARG CZ 1 1 4 2636 1 1 34 ARG H H -0.960 2.356 2.187 1.00 . A A . 34 ARG H 1 1 4 2637 1 1 34 ARG HA H -2.513 1.681 4.555 1.00 . A A . 34 ARG HA 1 1 4 2638 1 1 34 ARG HB2 H -1.693 4.404 3.584 1.00 . A A . 34 ARG HB2 1 1 4 2639 1 1 34 ARG HB3 H -2.904 4.136 4.825 1.00 . A A . 34 ARG HB3 1 1 4 2640 1 1 34 ARG HD2 H 0.119 4.971 6.735 1.00 . A A . 34 ARG HD2 1 1 4 2641 1 1 34 ARG HD3 H -0.357 5.722 5.212 1.00 . A A . 34 ARG HD3 1 1 4 2642 1 1 34 ARG HE H -2.317 4.988 7.270 1.00 . A A . 34 ARG HE 1 1 4 2643 1 1 34 ARG HG2 H -1.221 3.021 6.216 1.00 . A A . 34 ARG HG2 1 1 4 2644 1 1 34 ARG HG3 H -0.008 3.326 4.969 1.00 . A A . 34 ARG HG3 1 1 4 2645 1 1 34 ARG HH11 H -1.048 7.366 4.977 1.00 . A A . 34 ARG HH11 1 1 4 2646 1 1 34 ARG HH12 H -2.067 8.629 5.481 1.00 . A A . 34 ARG HH12 1 1 4 2647 1 1 34 ARG HH21 H -3.728 6.683 7.969 1.00 . A A . 34 ARG HH21 1 1 4 2648 1 1 34 ARG HH22 H -3.675 8.222 7.231 1.00 . A A . 34 ARG HH22 1 1 4 2649 1 1 34 ARG N N -1.219 1.866 2.999 1.00 . A A . 34 ARG N 1 1 4 2650 1 1 34 ARG NE N -1.859 5.613 6.660 1.00 . A A . 34 ARG NE 1 1 4 2651 1 1 34 ARG NH1 N -1.779 7.678 5.606 1.00 . A A . 34 ARG NH1 1 1 4 2652 1 1 34 ARG NH2 N -3.303 7.293 7.294 1.00 . A A . 34 ARG NH2 1 1 4 2653 1 1 34 ARG O O -3.582 2.883 1.761 1.00 . A A . 34 ARG O 1 1 4 2654 1 1 35 CYS C C -6.710 3.274 3.331 1.00 . A A . 35 CYS C 1 1 4 2655 1 1 35 CYS CA C -5.932 2.060 2.878 1.00 . A A . 35 CYS CA 1 1 4 2656 1 1 35 CYS CB C -6.661 0.762 3.205 1.00 . A A . 35 CYS CB 1 1 4 2657 1 1 35 CYS H H -4.608 1.746 4.449 1.00 . A A . 35 CYS H 1 1 4 2658 1 1 35 CYS HA H -5.780 2.126 1.811 1.00 . A A . 35 CYS HA 1 1 4 2659 1 1 35 CYS HB2 H -6.921 0.753 4.254 1.00 . A A . 35 CYS HB2 1 1 4 2660 1 1 35 CYS HB3 H -7.559 0.692 2.608 1.00 . A A . 35 CYS HB3 1 1 4 2661 1 1 35 CYS N N -4.662 2.060 3.523 1.00 . A A . 35 CYS N 1 1 4 2662 1 1 35 CYS O O -7.167 3.357 4.477 1.00 . A A . 35 CYS O 1 1 4 2663 1 1 35 CYS SG S -5.640 -0.709 2.857 1.00 . A A . 35 CYS SG 1 1 4 2664 1 1 36 ARG C C -9.000 5.265 2.757 1.00 . A A . 36 ARG C 1 1 4 2665 1 1 36 ARG CA C -7.483 5.480 2.743 1.00 . A A . 36 ARG CA 1 1 4 2666 1 1 36 ARG CB C -7.109 6.507 1.681 1.00 . A A . 36 ARG CB 1 1 4 2667 1 1 36 ARG CD C -5.227 7.725 2.862 1.00 . A A . 36 ARG CD 1 1 4 2668 1 1 36 ARG CG C -5.632 6.906 1.652 1.00 . A A . 36 ARG CG 1 1 4 2669 1 1 36 ARG CZ C -3.490 9.514 2.727 1.00 . A A . 36 ARG CZ 1 1 4 2670 1 1 36 ARG H H -6.400 4.101 1.573 1.00 . A A . 36 ARG H 1 1 4 2671 1 1 36 ARG HA H -7.158 5.839 3.707 1.00 . A A . 36 ARG HA 1 1 4 2672 1 1 36 ARG HB2 H -7.349 6.081 0.719 1.00 . A A . 36 ARG HB2 1 1 4 2673 1 1 36 ARG HB3 H -7.702 7.397 1.830 1.00 . A A . 36 ARG HB3 1 1 4 2674 1 1 36 ARG HD2 H -5.901 8.562 2.949 1.00 . A A . 36 ARG HD2 1 1 4 2675 1 1 36 ARG HD3 H -5.300 7.109 3.746 1.00 . A A . 36 ARG HD3 1 1 4 2676 1 1 36 ARG HE H -3.123 7.556 2.659 1.00 . A A . 36 ARG HE 1 1 4 2677 1 1 36 ARG HG2 H -5.033 6.006 1.634 1.00 . A A . 36 ARG HG2 1 1 4 2678 1 1 36 ARG HG3 H -5.440 7.478 0.756 1.00 . A A . 36 ARG HG3 1 1 4 2679 1 1 36 ARG HH11 H -5.375 10.285 2.935 1.00 . A A . 36 ARG HH11 1 1 4 2680 1 1 36 ARG HH12 H -4.137 11.451 2.834 1.00 . A A . 36 ARG HH12 1 1 4 2681 1 1 36 ARG HH21 H -1.566 9.041 2.517 1.00 . A A . 36 ARG HH21 1 1 4 2682 1 1 36 ARG HH22 H -1.832 10.741 2.558 1.00 . A A . 36 ARG HH22 1 1 4 2683 1 1 36 ARG N N -6.802 4.237 2.458 1.00 . A A . 36 ARG N 1 1 4 2684 1 1 36 ARG NE N -3.852 8.223 2.742 1.00 . A A . 36 ARG NE 1 1 4 2685 1 1 36 ARG NH1 N -4.397 10.480 2.839 1.00 . A A . 36 ARG NH1 1 1 4 2686 1 1 36 ARG NH2 N -2.214 9.813 2.598 1.00 . A A . 36 ARG NH2 1 1 4 2687 1 1 36 ARG O O -9.484 4.169 2.434 1.00 . A A . 36 ARG O 1 1 4 2688 1 1 37 ASP C C -11.802 6.001 1.767 1.00 . A A . 37 ASP C 1 1 4 2689 1 1 37 ASP CA C -11.227 6.278 3.149 1.00 . A A . 37 ASP CA 1 1 4 2690 1 1 37 ASP CB C -11.764 7.611 3.690 1.00 . A A . 37 ASP CB 1 1 4 2691 1 1 37 ASP CG C -13.275 7.682 3.728 1.00 . A A . 37 ASP CG 1 1 4 2692 1 1 37 ASP H H -9.299 7.155 3.339 1.00 . A A . 37 ASP H 1 1 4 2693 1 1 37 ASP HA H -11.517 5.480 3.816 1.00 . A A . 37 ASP HA 1 1 4 2694 1 1 37 ASP HB2 H -11.394 7.765 4.693 1.00 . A A . 37 ASP HB2 1 1 4 2695 1 1 37 ASP HB3 H -11.403 8.410 3.060 1.00 . A A . 37 ASP HB3 1 1 4 2696 1 1 37 ASP N N -9.743 6.314 3.094 1.00 . A A . 37 ASP N 1 1 4 2697 1 1 37 ASP O O -12.901 5.474 1.615 1.00 . A A . 37 ASP O 1 1 4 2698 1 1 37 ASP OD1 O -13.878 8.288 2.822 1.00 . A A . 37 ASP OD1 1 1 4 2699 1 1 37 ASP OD2 O -13.889 7.141 4.666 1.00 . A A . 37 ASP OD2 1 1 4 2700 1 1 38 ASP C C -11.372 4.640 -0.988 1.00 . A A . 38 ASP C 1 1 4 2701 1 1 38 ASP CA C -11.297 6.124 -0.643 1.00 . A A . 38 ASP CA 1 1 4 2702 1 1 38 ASP CB C -10.159 6.714 -1.489 1.00 . A A . 38 ASP CB 1 1 4 2703 1 1 38 ASP CG C -9.878 8.170 -1.229 1.00 . A A . 38 ASP CG 1 1 4 2704 1 1 38 ASP H H -10.150 6.748 1.016 1.00 . A A . 38 ASP H 1 1 4 2705 1 1 38 ASP HA H -12.212 6.632 -0.905 1.00 . A A . 38 ASP HA 1 1 4 2706 1 1 38 ASP HB2 H -9.257 6.162 -1.272 1.00 . A A . 38 ASP HB2 1 1 4 2707 1 1 38 ASP HB3 H -10.398 6.587 -2.533 1.00 . A A . 38 ASP HB3 1 1 4 2708 1 1 38 ASP N N -10.998 6.322 0.773 1.00 . A A . 38 ASP N 1 1 4 2709 1 1 38 ASP O O -11.817 4.277 -2.077 1.00 . A A . 38 ASP O 1 1 4 2710 1 1 38 ASP OD1 O -9.087 8.475 -0.314 1.00 . A A . 38 ASP OD1 1 1 4 2711 1 1 38 ASP OD2 O -10.423 9.029 -1.944 1.00 . A A . 38 ASP OD2 1 1 4 2712 1 1 39 PHE C C -9.605 1.963 -1.169 1.00 . A A . 39 PHE C 1 1 4 2713 1 1 39 PHE CA C -10.718 2.322 -0.212 1.00 . A A . 39 PHE CA 1 1 4 2714 1 1 39 PHE CB C -12.020 1.614 -0.622 1.00 . A A . 39 PHE CB 1 1 4 2715 1 1 39 PHE CD1 C -13.066 1.194 1.604 1.00 . A A . 39 PHE CD1 1 1 4 2716 1 1 39 PHE CD2 C -14.273 2.474 0.008 1.00 . A A . 39 PHE CD2 1 1 4 2717 1 1 39 PHE CE1 C -14.102 1.323 2.499 1.00 . A A . 39 PHE CE1 1 1 4 2718 1 1 39 PHE CE2 C -15.312 2.608 0.897 1.00 . A A . 39 PHE CE2 1 1 4 2719 1 1 39 PHE CG C -13.140 1.769 0.352 1.00 . A A . 39 PHE CG 1 1 4 2720 1 1 39 PHE CZ C -15.226 2.030 2.144 1.00 . A A . 39 PHE CZ 1 1 4 2721 1 1 39 PHE H H -10.548 4.189 0.778 1.00 . A A . 39 PHE H 1 1 4 2722 1 1 39 PHE HA H -10.415 1.965 0.762 1.00 . A A . 39 PHE HA 1 1 4 2723 1 1 39 PHE HB2 H -12.350 2.011 -1.570 1.00 . A A . 39 PHE HB2 1 1 4 2724 1 1 39 PHE HB3 H -11.819 0.559 -0.739 1.00 . A A . 39 PHE HB3 1 1 4 2725 1 1 39 PHE HD1 H -12.181 0.638 1.878 1.00 . A A . 39 PHE HD1 1 1 4 2726 1 1 39 PHE HD2 H -14.337 2.925 -0.971 1.00 . A A . 39 PHE HD2 1 1 4 2727 1 1 39 PHE HE1 H -14.039 0.871 3.478 1.00 . A A . 39 PHE HE1 1 1 4 2728 1 1 39 PHE HE2 H -16.194 3.164 0.617 1.00 . A A . 39 PHE HE2 1 1 4 2729 1 1 39 PHE HZ H -16.041 2.133 2.845 1.00 . A A . 39 PHE HZ 1 1 4 2730 1 1 39 PHE N N -10.850 3.798 -0.071 1.00 . A A . 39 PHE N 1 1 4 2731 1 1 39 PHE O O -9.302 0.793 -1.386 1.00 . A A . 39 PHE O 1 1 4 2732 1 1 40 ARG C C -6.594 2.854 -1.817 1.00 . A A . 40 ARG C 1 1 4 2733 1 1 40 ARG CA C -7.906 2.814 -2.613 1.00 . A A . 40 ARG CA 1 1 4 2734 1 1 40 ARG CB C -7.988 3.931 -3.669 1.00 . A A . 40 ARG CB 1 1 4 2735 1 1 40 ARG CD C -7.127 2.596 -5.619 1.00 . A A . 40 ARG CD 1 1 4 2736 1 1 40 ARG CG C -6.976 3.847 -4.778 1.00 . A A . 40 ARG CG 1 1 4 2737 1 1 40 ARG CZ C -5.261 1.526 -6.852 1.00 . A A . 40 ARG CZ 1 1 4 2738 1 1 40 ARG H H -9.270 3.865 -1.426 1.00 . A A . 40 ARG H 1 1 4 2739 1 1 40 ARG HA H -8.008 1.850 -3.090 1.00 . A A . 40 ARG HA 1 1 4 2740 1 1 40 ARG HB2 H -8.960 3.913 -4.138 1.00 . A A . 40 ARG HB2 1 1 4 2741 1 1 40 ARG HB3 H -7.864 4.880 -3.174 1.00 . A A . 40 ARG HB3 1 1 4 2742 1 1 40 ARG HD2 H -7.048 1.724 -4.986 1.00 . A A . 40 ARG HD2 1 1 4 2743 1 1 40 ARG HD3 H -8.093 2.620 -6.100 1.00 . A A . 40 ARG HD3 1 1 4 2744 1 1 40 ARG HE H -6.023 3.367 -7.179 1.00 . A A . 40 ARG HE 1 1 4 2745 1 1 40 ARG HG2 H -7.076 4.712 -5.415 1.00 . A A . 40 ARG HG2 1 1 4 2746 1 1 40 ARG HG3 H -5.995 3.845 -4.325 1.00 . A A . 40 ARG HG3 1 1 4 2747 1 1 40 ARG HH11 H -6.228 0.161 -5.621 1.00 . A A . 40 ARG HH11 1 1 4 2748 1 1 40 ARG HH12 H -4.807 -0.406 -6.371 1.00 . A A . 40 ARG HH12 1 1 4 2749 1 1 40 ARG HH21 H -4.124 2.517 -8.242 1.00 . A A . 40 ARG HH21 1 1 4 2750 1 1 40 ARG HH22 H -3.575 0.962 -7.913 1.00 . A A . 40 ARG HH22 1 1 4 2751 1 1 40 ARG N N -8.981 2.969 -1.693 1.00 . A A . 40 ARG N 1 1 4 2752 1 1 40 ARG NE N -6.095 2.540 -6.647 1.00 . A A . 40 ARG NE 1 1 4 2753 1 1 40 ARG NH1 N -5.459 0.353 -6.238 1.00 . A A . 40 ARG NH1 1 1 4 2754 1 1 40 ARG NH2 N -4.265 1.668 -7.723 1.00 . A A . 40 ARG NH2 1 1 4 2755 1 1 40 ARG O O -6.517 3.522 -0.767 1.00 . A A . 40 ARG O 1 1 4 2756 1 1 41 CYS C C -3.328 3.044 -1.887 1.00 . A A . 41 CYS C 1 1 4 2757 1 1 41 CYS CA C -4.355 2.004 -1.551 1.00 . A A . 41 CYS CA 1 1 4 2758 1 1 41 CYS CB C -3.749 0.640 -1.770 1.00 . A A . 41 CYS CB 1 1 4 2759 1 1 41 CYS H H -5.672 1.691 -3.144 1.00 . A A . 41 CYS H 1 1 4 2760 1 1 41 CYS HA H -4.588 2.080 -0.500 1.00 . A A . 41 CYS HA 1 1 4 2761 1 1 41 CYS HB2 H -3.701 0.446 -2.831 1.00 . A A . 41 CYS HB2 1 1 4 2762 1 1 41 CYS HB3 H -2.746 0.633 -1.369 1.00 . A A . 41 CYS HB3 1 1 4 2763 1 1 41 CYS N N -5.599 2.143 -2.279 1.00 . A A . 41 CYS N 1 1 4 2764 1 1 41 CYS O O -2.879 3.159 -3.030 1.00 . A A . 41 CYS O 1 1 4 2765 1 1 41 CYS SG S -4.652 -0.718 -1.017 1.00 . A A . 41 CYS SG 1 1 4 2766 1 1 42 TRP C C -0.743 4.087 -0.143 1.00 . A A . 42 TRP C 1 1 4 2767 1 1 42 TRP CA C -1.876 4.700 -0.943 1.00 . A A . 42 TRP CA 1 1 4 2768 1 1 42 TRP CB C -2.294 6.060 -0.359 1.00 . A A . 42 TRP CB 1 1 4 2769 1 1 42 TRP CD1 C -2.020 8.048 -1.939 1.00 . A A . 42 TRP CD1 1 1 4 2770 1 1 42 TRP CD2 C -4.111 7.260 -1.873 1.00 . A A . 42 TRP CD2 1 1 4 2771 1 1 42 TRP CE2 C -4.067 8.351 -2.762 1.00 . A A . 42 TRP CE2 1 1 4 2772 1 1 42 TRP CE3 C -5.328 6.611 -1.682 1.00 . A A . 42 TRP CE3 1 1 4 2773 1 1 42 TRP CG C -2.778 7.079 -1.357 1.00 . A A . 42 TRP CG 1 1 4 2774 1 1 42 TRP CH2 C -6.367 8.152 -3.230 1.00 . A A . 42 TRP CH2 1 1 4 2775 1 1 42 TRP CZ2 C -5.193 8.807 -3.445 1.00 . A A . 42 TRP CZ2 1 1 4 2776 1 1 42 TRP CZ3 C -6.443 7.066 -2.360 1.00 . A A . 42 TRP CZ3 1 1 4 2777 1 1 42 TRP H H -3.374 3.634 -0.007 1.00 . A A . 42 TRP H 1 1 4 2778 1 1 42 TRP HA H -1.572 4.803 -1.975 1.00 . A A . 42 TRP HA 1 1 4 2779 1 1 42 TRP HB2 H -3.103 5.898 0.338 1.00 . A A . 42 TRP HB2 1 1 4 2780 1 1 42 TRP HB3 H -1.468 6.495 0.181 1.00 . A A . 42 TRP HB3 1 1 4 2781 1 1 42 TRP HD1 H -0.964 8.182 -1.749 1.00 . A A . 42 TRP HD1 1 1 4 2782 1 1 42 TRP HE1 H -2.471 9.570 -3.320 1.00 . A A . 42 TRP HE1 1 1 4 2783 1 1 42 TRP HE3 H -5.405 5.765 -1.017 1.00 . A A . 42 TRP HE3 1 1 4 2784 1 1 42 TRP HH2 H -7.265 8.473 -3.737 1.00 . A A . 42 TRP HH2 1 1 4 2785 1 1 42 TRP HZ2 H -5.154 9.646 -4.124 1.00 . A A . 42 TRP HZ2 1 1 4 2786 1 1 42 TRP HZ3 H -7.397 6.583 -2.217 1.00 . A A . 42 TRP HZ3 1 1 4 2787 1 1 42 TRP N N -2.949 3.764 -0.885 1.00 . A A . 42 TRP N 1 1 4 2788 1 1 42 TRP NE1 N -2.787 8.812 -2.780 1.00 . A A . 42 TRP NE1 1 1 4 2789 1 1 42 TRP O O -0.833 3.951 1.074 1.00 . A A . 42 TRP O 1 1 4 2790 1 1 43 CYS C C 2.575 3.859 -0.025 1.00 . A A . 43 CYS C 1 1 4 2791 1 1 43 CYS CA C 1.350 2.978 -0.149 1.00 . A A . 43 CYS CA 1 1 4 2792 1 1 43 CYS CB C 1.652 1.639 -0.837 1.00 . A A . 43 CYS CB 1 1 4 2793 1 1 43 CYS H H 0.352 3.824 -1.775 1.00 . A A . 43 CYS H 1 1 4 2794 1 1 43 CYS HA H 1.002 2.773 0.852 1.00 . A A . 43 CYS HA 1 1 4 2795 1 1 43 CYS HB2 H 1.906 1.821 -1.872 1.00 . A A . 43 CYS HB2 1 1 4 2796 1 1 43 CYS HB3 H 2.486 1.167 -0.341 1.00 . A A . 43 CYS HB3 1 1 4 2797 1 1 43 CYS N N 0.278 3.659 -0.809 1.00 . A A . 43 CYS N 1 1 4 2798 1 1 43 CYS O O 2.860 4.689 -0.891 1.00 . A A . 43 CYS O 1 1 4 2799 1 1 43 CYS SG S 0.238 0.474 -0.797 1.00 . A A . 43 CYS SG 1 1 4 2800 1 1 44 THR C C 5.617 4.001 0.552 1.00 . A A . 44 THR C 1 1 4 2801 1 1 44 THR CA C 4.415 4.459 1.379 1.00 . A A . 44 THR CA 1 1 4 2802 1 1 44 THR CB C 4.713 4.223 2.856 1.00 . A A . 44 THR CB 1 1 4 2803 1 1 44 THR CG2 C 5.529 5.361 3.412 1.00 . A A . 44 THR CG2 1 1 4 2804 1 1 44 THR H H 3.051 2.942 1.657 1.00 . A A . 44 THR H 1 1 4 2805 1 1 44 THR HA H 4.209 5.506 1.227 1.00 . A A . 44 THR HA 1 1 4 2806 1 1 44 THR HB H 5.261 3.299 2.959 1.00 . A A . 44 THR HB 1 1 4 2807 1 1 44 THR HG1 H 3.209 4.992 3.900 1.00 . A A . 44 THR HG1 1 1 4 2808 1 1 44 THR HG21 H 4.999 6.288 3.253 1.00 . A A . 44 THR HG21 1 1 4 2809 1 1 44 THR HG22 H 6.488 5.400 2.916 1.00 . A A . 44 THR HG22 1 1 4 2810 1 1 44 THR HG23 H 5.672 5.211 4.472 1.00 . A A . 44 THR HG23 1 1 4 2811 1 1 44 THR N N 3.283 3.668 1.036 1.00 . A A . 44 THR N 1 1 4 2812 1 1 44 THR O O 6.151 2.911 0.775 1.00 . A A . 44 THR O 1 1 4 2813 1 1 44 THR OG1 O 3.468 4.116 3.587 1.00 . A A . 44 THR OG1 1 1 4 2814 1 1 45 LYS C C 8.154 5.511 -1.316 1.00 . A A . 45 LYS C 1 1 4 2815 1 1 45 LYS CA C 7.090 4.441 -1.280 1.00 . A A . 45 LYS CA 1 1 4 2816 1 1 45 LYS CB C 6.545 4.189 -2.690 1.00 . A A . 45 LYS CB 1 1 4 2817 1 1 45 LYS CD C 5.311 5.042 -4.714 1.00 . A A . 45 LYS CD 1 1 4 2818 1 1 45 LYS CE C 4.165 4.045 -4.598 1.00 . A A . 45 LYS CE 1 1 4 2819 1 1 45 LYS CG C 5.893 5.395 -3.351 1.00 . A A . 45 LYS CG 1 1 4 2820 1 1 45 LYS H H 5.615 5.699 -0.497 1.00 . A A . 45 LYS H 1 1 4 2821 1 1 45 LYS HA H 7.526 3.521 -0.917 1.00 . A A . 45 LYS HA 1 1 4 2822 1 1 45 LYS HB2 H 7.355 3.863 -3.325 1.00 . A A . 45 LYS HB2 1 1 4 2823 1 1 45 LYS HB3 H 5.811 3.401 -2.630 1.00 . A A . 45 LYS HB3 1 1 4 2824 1 1 45 LYS HD2 H 4.955 5.939 -5.199 1.00 . A A . 45 LYS HD2 1 1 4 2825 1 1 45 LYS HD3 H 6.092 4.603 -5.317 1.00 . A A . 45 LYS HD3 1 1 4 2826 1 1 45 LYS HE2 H 4.543 3.112 -4.206 1.00 . A A . 45 LYS HE2 1 1 4 2827 1 1 45 LYS HE3 H 3.421 4.442 -3.924 1.00 . A A . 45 LYS HE3 1 1 4 2828 1 1 45 LYS HG2 H 5.101 5.758 -2.713 1.00 . A A . 45 LYS HG2 1 1 4 2829 1 1 45 LYS HG3 H 6.637 6.168 -3.474 1.00 . A A . 45 LYS HG3 1 1 4 2830 1 1 45 LYS HZ1 H 2.728 3.137 -5.793 1.00 . A A . 45 LYS HZ1 1 1 4 2831 1 1 45 LYS HZ2 H 4.201 3.304 -6.549 1.00 . A A . 45 LYS HZ2 1 1 4 2832 1 1 45 LYS HZ3 H 3.200 4.658 -6.342 1.00 . A A . 45 LYS HZ3 1 1 4 2833 1 1 45 LYS N N 6.021 4.807 -0.391 1.00 . A A . 45 LYS N 1 1 4 2834 1 1 45 LYS NZ N 3.540 3.779 -5.898 1.00 . A A . 45 LYS NZ 1 1 4 2835 1 1 45 LYS O O 8.007 6.578 -0.701 1.00 . A A . 45 LYS O 1 1 4 2836 1 1 46 ASN C C 10.101 6.848 -3.517 1.00 . A A . 46 ASN C 1 1 4 2837 1 1 46 ASN CA C 10.275 6.152 -2.198 1.00 . A A . 46 ASN CA 1 1 4 2838 1 1 46 ASN CB C 11.639 5.450 -2.150 1.00 . A A . 46 ASN CB 1 1 4 2839 1 1 46 ASN CG C 12.004 4.936 -0.770 1.00 . A A . 46 ASN CG 1 1 4 2840 1 1 46 ASN H H 9.281 4.356 -2.469 1.00 . A A . 46 ASN H 1 1 4 2841 1 1 46 ASN HA H 10.227 6.880 -1.403 1.00 . A A . 46 ASN HA 1 1 4 2842 1 1 46 ASN HB2 H 11.632 4.614 -2.831 1.00 . A A . 46 ASN HB2 1 1 4 2843 1 1 46 ASN HB3 H 12.392 6.156 -2.463 1.00 . A A . 46 ASN HB3 1 1 4 2844 1 1 46 ASN HD21 H 13.010 6.597 -0.382 1.00 . A A . 46 ASN HD21 1 1 4 2845 1 1 46 ASN HD22 H 12.984 5.432 0.873 1.00 . A A . 46 ASN HD22 1 1 4 2846 1 1 46 ASN N N 9.206 5.225 -2.018 1.00 . A A . 46 ASN N 1 1 4 2847 1 1 46 ASN ND2 N 12.731 5.725 -0.027 1.00 . A A . 46 ASN ND2 1 1 4 2848 1 1 46 ASN O O 9.710 6.230 -4.513 1.00 . A A . 46 ASN O 1 1 4 2849 1 1 46 ASN OD1 O 11.661 3.814 -0.390 1.00 . A A . 46 ASN OD1 1 1 4 2850 1 1 47 CYS C C 11.386 9.920 -4.634 1.00 . A A . 47 CYS C 1 1 4 2851 1 1 47 CYS CA C 10.239 8.925 -4.663 1.00 . A A . 47 CYS CA 1 1 4 2852 1 1 47 CYS CB C 8.852 9.597 -4.743 1.00 . A A . 47 CYS CB 1 1 4 2853 1 1 47 CYS H H 10.568 8.564 -2.673 1.00 . A A . 47 CYS H 1 1 4 2854 1 1 47 CYS HA H 10.372 8.280 -5.519 1.00 . A A . 47 CYS HA 1 1 4 2855 1 1 47 CYS HB2 H 8.872 10.377 -5.488 1.00 . A A . 47 CYS HB2 1 1 4 2856 1 1 47 CYS HB3 H 8.117 8.859 -5.029 1.00 . A A . 47 CYS HB3 1 1 4 2857 1 1 47 CYS N N 10.325 8.107 -3.510 1.00 . A A . 47 CYS N 1 1 4 2858 1 1 47 CYS O O 11.269 10.984 -4.009 1.00 . A A . 47 CYS O 1 1 4 2859 1 1 47 CYS OXT O 12.465 9.592 -5.165 1.00 . A A . 47 CYS OXT 1 1 4 2860 1 1 47 CYS SG S 8.263 10.369 -3.190 1.00 . A A . 47 CYS SG 1 1 5 2861 1 1 1 LYS C C 10.325 10.321 0.925 1.00 . A A . 1 LYS C 1 1 5 2862 1 1 1 LYS CA C 11.301 11.403 1.266 1.00 . A A . 1 LYS CA 1 1 5 2863 1 1 1 LYS CB C 10.542 12.601 1.865 1.00 . A A . 1 LYS CB 1 1 5 2864 1 1 1 LYS CD C 10.590 14.933 2.792 1.00 . A A . 1 LYS CD 1 1 5 2865 1 1 1 LYS CE C 10.065 14.589 4.188 1.00 . A A . 1 LYS CE 1 1 5 2866 1 1 1 LYS CG C 11.401 13.801 2.171 1.00 . A A . 1 LYS CG 1 1 5 2867 1 1 1 LYS H1 H 12.668 12.548 0.168 1.00 . A A . 1 LYS H1 1 1 5 2868 1 1 1 LYS H2 H 11.278 12.030 -0.694 1.00 . A A . 1 LYS H2 1 1 5 2869 1 1 1 LYS H3 H 12.479 10.946 -0.343 1.00 . A A . 1 LYS H3 1 1 5 2870 1 1 1 LYS HA H 12.017 11.021 1.977 1.00 . A A . 1 LYS HA 1 1 5 2871 1 1 1 LYS HB2 H 9.770 12.910 1.178 1.00 . A A . 1 LYS HB2 1 1 5 2872 1 1 1 LYS HB3 H 10.075 12.279 2.783 1.00 . A A . 1 LYS HB3 1 1 5 2873 1 1 1 LYS HD2 H 11.214 15.810 2.860 1.00 . A A . 1 LYS HD2 1 1 5 2874 1 1 1 LYS HD3 H 9.750 15.144 2.146 1.00 . A A . 1 LYS HD3 1 1 5 2875 1 1 1 LYS HE2 H 9.420 15.389 4.515 1.00 . A A . 1 LYS HE2 1 1 5 2876 1 1 1 LYS HE3 H 9.496 13.672 4.144 1.00 . A A . 1 LYS HE3 1 1 5 2877 1 1 1 LYS HG2 H 12.201 13.516 2.837 1.00 . A A . 1 LYS HG2 1 1 5 2878 1 1 1 LYS HG3 H 11.803 14.133 1.230 1.00 . A A . 1 LYS HG3 1 1 5 2879 1 1 1 LYS HZ1 H 10.771 14.120 6.095 1.00 . A A . 1 LYS HZ1 1 1 5 2880 1 1 1 LYS HZ2 H 11.604 15.356 5.347 1.00 . A A . 1 LYS HZ2 1 1 5 2881 1 1 1 LYS HZ3 H 11.887 13.774 4.877 1.00 . A A . 1 LYS HZ3 1 1 5 2882 1 1 1 LYS N N 11.985 11.781 0.029 1.00 . A A . 1 LYS N 1 1 5 2883 1 1 1 LYS NZ N 11.149 14.438 5.180 1.00 . A A . 1 LYS NZ 1 1 5 2884 1 1 1 LYS O O 10.494 9.626 -0.080 1.00 . A A . 1 LYS O 1 1 5 2885 1 1 2 THR C C 7.187 9.803 0.685 1.00 . A A . 2 THR C 1 1 5 2886 1 1 2 THR CA C 8.335 9.199 1.442 1.00 . A A . 2 THR CA 1 1 5 2887 1 1 2 THR CB C 7.858 8.461 2.678 1.00 . A A . 2 THR CB 1 1 5 2888 1 1 2 THR CG2 C 8.828 7.356 3.012 1.00 . A A . 2 THR CG2 1 1 5 2889 1 1 2 THR H H 9.282 10.679 2.560 1.00 . A A . 2 THR H 1 1 5 2890 1 1 2 THR HA H 8.797 8.474 0.786 1.00 . A A . 2 THR HA 1 1 5 2891 1 1 2 THR HB H 6.894 8.026 2.458 1.00 . A A . 2 THR HB 1 1 5 2892 1 1 2 THR HG1 H 7.379 10.227 3.472 1.00 . A A . 2 THR HG1 1 1 5 2893 1 1 2 THR HG21 H 8.895 6.686 2.166 1.00 . A A . 2 THR HG21 1 1 5 2894 1 1 2 THR HG22 H 8.493 6.817 3.885 1.00 . A A . 2 THR HG22 1 1 5 2895 1 1 2 THR HG23 H 9.801 7.789 3.192 1.00 . A A . 2 THR HG23 1 1 5 2896 1 1 2 THR N N 9.337 10.149 1.734 1.00 . A A . 2 THR N 1 1 5 2897 1 1 2 THR O O 6.626 10.833 1.071 1.00 . A A . 2 THR O 1 1 5 2898 1 1 2 THR OG1 O 7.723 9.379 3.789 1.00 . A A . 2 THR OG1 1 1 5 2899 1 1 3 CYS C C 4.739 8.510 -1.104 1.00 . A A . 3 CYS C 1 1 5 2900 1 1 3 CYS CA C 5.805 9.575 -1.217 1.00 . A A . 3 CYS CA 1 1 5 2901 1 1 3 CYS CB C 6.314 9.733 -2.659 1.00 . A A . 3 CYS CB 1 1 5 2902 1 1 3 CYS H H 7.375 8.378 -0.647 1.00 . A A . 3 CYS H 1 1 5 2903 1 1 3 CYS HA H 5.424 10.520 -0.863 1.00 . A A . 3 CYS HA 1 1 5 2904 1 1 3 CYS HB2 H 5.466 9.826 -3.318 1.00 . A A . 3 CYS HB2 1 1 5 2905 1 1 3 CYS HB3 H 6.926 10.620 -2.730 1.00 . A A . 3 CYS HB3 1 1 5 2906 1 1 3 CYS N N 6.876 9.187 -0.387 1.00 . A A . 3 CYS N 1 1 5 2907 1 1 3 CYS O O 4.973 7.348 -1.426 1.00 . A A . 3 CYS O 1 1 5 2908 1 1 3 CYS SG S 7.307 8.316 -3.253 1.00 . A A . 3 CYS SG 1 1 5 2909 1 1 4 GLU C C 1.738 7.932 -1.689 1.00 . A A . 4 GLU C 1 1 5 2910 1 1 4 GLU CA C 2.584 7.879 -0.430 1.00 . A A . 4 GLU CA 1 1 5 2911 1 1 4 GLU CB C 1.812 8.101 0.861 1.00 . A A . 4 GLU CB 1 1 5 2912 1 1 4 GLU CD C 0.783 6.937 2.817 1.00 . A A . 4 GLU CD 1 1 5 2913 1 1 4 GLU CG C 1.085 6.871 1.349 1.00 . A A . 4 GLU CG 1 1 5 2914 1 1 4 GLU H H 3.466 9.774 -0.268 1.00 . A A . 4 GLU H 1 1 5 2915 1 1 4 GLU HA H 3.073 6.916 -0.411 1.00 . A A . 4 GLU HA 1 1 5 2916 1 1 4 GLU HB2 H 2.498 8.421 1.632 1.00 . A A . 4 GLU HB2 1 1 5 2917 1 1 4 GLU HB3 H 1.082 8.879 0.693 1.00 . A A . 4 GLU HB3 1 1 5 2918 1 1 4 GLU HG2 H 0.157 6.784 0.808 1.00 . A A . 4 GLU HG2 1 1 5 2919 1 1 4 GLU HG3 H 1.695 6.001 1.157 1.00 . A A . 4 GLU HG3 1 1 5 2920 1 1 4 GLU N N 3.615 8.851 -0.567 1.00 . A A . 4 GLU N 1 1 5 2921 1 1 4 GLU O O 1.045 8.912 -1.956 1.00 . A A . 4 GLU O 1 1 5 2922 1 1 4 GLU OE1 O -0.350 7.267 3.197 1.00 . A A . 4 GLU OE1 1 1 5 2923 1 1 4 GLU OE2 O 1.702 6.681 3.628 1.00 . A A . 4 GLU OE2 1 1 5 2924 1 1 5 ASN C C 0.473 5.602 -4.041 1.00 . A A . 5 ASN C 1 1 5 2925 1 1 5 ASN CA C 1.328 6.845 -3.827 1.00 . A A . 5 ASN CA 1 1 5 2926 1 1 5 ASN CB C 2.547 6.867 -4.784 1.00 . A A . 5 ASN CB 1 1 5 2927 1 1 5 ASN CG C 2.247 6.582 -6.246 1.00 . A A . 5 ASN CG 1 1 5 2928 1 1 5 ASN H H 2.277 6.081 -2.109 1.00 . A A . 5 ASN H 1 1 5 2929 1 1 5 ASN HA H 0.739 7.731 -4.008 1.00 . A A . 5 ASN HA 1 1 5 2930 1 1 5 ASN HB2 H 3.010 7.840 -4.732 1.00 . A A . 5 ASN HB2 1 1 5 2931 1 1 5 ASN HB3 H 3.259 6.134 -4.432 1.00 . A A . 5 ASN HB3 1 1 5 2932 1 1 5 ASN HD21 H 2.007 8.498 -6.607 1.00 . A A . 5 ASN HD21 1 1 5 2933 1 1 5 ASN HD22 H 1.800 7.439 -7.957 1.00 . A A . 5 ASN HD22 1 1 5 2934 1 1 5 ASN N N 1.848 6.892 -2.469 1.00 . A A . 5 ASN N 1 1 5 2935 1 1 5 ASN ND2 N 1.992 7.601 -7.007 1.00 . A A . 5 ASN ND2 1 1 5 2936 1 1 5 ASN O O 0.713 4.567 -3.407 1.00 . A A . 5 ASN O 1 1 5 2937 1 1 5 ASN OD1 O 2.294 5.431 -6.688 1.00 . A A . 5 ASN OD1 1 1 5 2938 1 1 6 LEU C C -0.732 3.388 -5.724 1.00 . A A . 6 LEU C 1 1 5 2939 1 1 6 LEU CA C -1.440 4.624 -5.229 1.00 . A A . 6 LEU CA 1 1 5 2940 1 1 6 LEU CB C -2.475 5.032 -6.277 1.00 . A A . 6 LEU CB 1 1 5 2941 1 1 6 LEU CD1 C -4.499 6.247 -7.000 1.00 . A A . 6 LEU CD1 1 1 5 2942 1 1 6 LEU CD2 C -4.515 5.026 -4.858 1.00 . A A . 6 LEU CD2 1 1 5 2943 1 1 6 LEU CG C -3.665 5.848 -5.808 1.00 . A A . 6 LEU CG 1 1 5 2944 1 1 6 LEU H H -0.676 6.584 -5.347 1.00 . A A . 6 LEU H 1 1 5 2945 1 1 6 LEU HA H -1.974 4.367 -4.328 1.00 . A A . 6 LEU HA 1 1 5 2946 1 1 6 LEU HB2 H -1.967 5.608 -7.036 1.00 . A A . 6 LEU HB2 1 1 5 2947 1 1 6 LEU HB3 H -2.848 4.130 -6.739 1.00 . A A . 6 LEU HB3 1 1 5 2948 1 1 6 LEU HD11 H -5.350 6.824 -6.668 1.00 . A A . 6 LEU HD11 1 1 5 2949 1 1 6 LEU HD12 H -4.837 5.346 -7.492 1.00 . A A . 6 LEU HD12 1 1 5 2950 1 1 6 LEU HD13 H -3.898 6.830 -7.680 1.00 . A A . 6 LEU HD13 1 1 5 2951 1 1 6 LEU HD21 H -5.374 5.610 -4.560 1.00 . A A . 6 LEU HD21 1 1 5 2952 1 1 6 LEU HD22 H -3.944 4.764 -3.980 1.00 . A A . 6 LEU HD22 1 1 5 2953 1 1 6 LEU HD23 H -4.852 4.127 -5.356 1.00 . A A . 6 LEU HD23 1 1 5 2954 1 1 6 LEU HG H -3.334 6.735 -5.290 1.00 . A A . 6 LEU HG 1 1 5 2955 1 1 6 LEU N N -0.532 5.721 -4.902 1.00 . A A . 6 LEU N 1 1 5 2956 1 1 6 LEU O O 0.247 3.457 -6.477 1.00 . A A . 6 LEU O 1 1 5 2957 1 1 7 ALA C C -1.641 0.545 -6.880 1.00 . A A . 7 ALA C 1 1 5 2958 1 1 7 ALA CA C -0.766 1.005 -5.722 1.00 . A A . 7 ALA CA 1 1 5 2959 1 1 7 ALA CB C -0.851 0.020 -4.570 1.00 . A A . 7 ALA CB 1 1 5 2960 1 1 7 ALA H H -1.950 2.317 -4.622 1.00 . A A . 7 ALA H 1 1 5 2961 1 1 7 ALA HA H 0.262 1.089 -6.040 1.00 . A A . 7 ALA HA 1 1 5 2962 1 1 7 ALA HB1 H -0.245 0.383 -3.753 1.00 . A A . 7 ALA HB1 1 1 5 2963 1 1 7 ALA HB2 H -0.514 -0.960 -4.877 1.00 . A A . 7 ALA HB2 1 1 5 2964 1 1 7 ALA HB3 H -1.880 -0.033 -4.243 1.00 . A A . 7 ALA HB3 1 1 5 2965 1 1 7 ALA N N -1.229 2.277 -5.289 1.00 . A A . 7 ALA N 1 1 5 2966 1 1 7 ALA O O -2.802 0.190 -6.680 1.00 . A A . 7 ALA O 1 1 5 2967 1 1 8 ASP C C -1.759 -1.341 -9.371 1.00 . A A . 8 ASP C 1 1 5 2968 1 1 8 ASP CA C -1.873 0.160 -9.261 1.00 . A A . 8 ASP CA 1 1 5 2969 1 1 8 ASP CB C -1.383 0.828 -10.556 1.00 . A A . 8 ASP CB 1 1 5 2970 1 1 8 ASP CG C -2.123 0.324 -11.789 1.00 . A A . 8 ASP CG 1 1 5 2971 1 1 8 ASP H H -0.230 1.011 -8.204 1.00 . A A . 8 ASP H 1 1 5 2972 1 1 8 ASP HA H -2.911 0.409 -9.099 1.00 . A A . 8 ASP HA 1 1 5 2973 1 1 8 ASP HB2 H -1.531 1.896 -10.484 1.00 . A A . 8 ASP HB2 1 1 5 2974 1 1 8 ASP HB3 H -0.330 0.624 -10.682 1.00 . A A . 8 ASP HB3 1 1 5 2975 1 1 8 ASP N N -1.124 0.622 -8.087 1.00 . A A . 8 ASP N 1 1 5 2976 1 1 8 ASP O O -2.658 -2.022 -9.870 1.00 . A A . 8 ASP O 1 1 5 2977 1 1 8 ASP OD1 O -1.530 -0.410 -12.603 1.00 . A A . 8 ASP OD1 1 1 5 2978 1 1 8 ASP OD2 O -3.328 0.632 -11.953 1.00 . A A . 8 ASP OD2 1 1 5 2979 1 1 9 THR C C -1.353 -3.970 -7.894 1.00 . A A . 9 THR C 1 1 5 2980 1 1 9 THR CA C -0.395 -3.246 -8.828 1.00 . A A . 9 THR CA 1 1 5 2981 1 1 9 THR CB C 1.025 -3.403 -8.363 1.00 . A A . 9 THR CB 1 1 5 2982 1 1 9 THR CG2 C 1.978 -3.499 -9.543 1.00 . A A . 9 THR CG2 1 1 5 2983 1 1 9 THR H H 0.003 -1.288 -8.419 1.00 . A A . 9 THR H 1 1 5 2984 1 1 9 THR HA H -0.477 -3.641 -9.829 1.00 . A A . 9 THR HA 1 1 5 2985 1 1 9 THR HB H 1.084 -4.294 -7.760 1.00 . A A . 9 THR HB 1 1 5 2986 1 1 9 THR HG1 H 2.271 -2.333 -7.261 1.00 . A A . 9 THR HG1 1 1 5 2987 1 1 9 THR HG21 H 2.988 -3.611 -9.179 1.00 . A A . 9 THR HG21 1 1 5 2988 1 1 9 THR HG22 H 1.905 -2.602 -10.142 1.00 . A A . 9 THR HG22 1 1 5 2989 1 1 9 THR HG23 H 1.718 -4.355 -10.147 1.00 . A A . 9 THR HG23 1 1 5 2990 1 1 9 THR N N -0.683 -1.848 -8.845 1.00 . A A . 9 THR N 1 1 5 2991 1 1 9 THR O O -1.828 -5.082 -8.191 1.00 . A A . 9 THR O 1 1 5 2992 1 1 9 THR OG1 O 1.344 -2.253 -7.541 1.00 . A A . 9 THR OG1 1 1 5 2993 1 1 10 TYR C C -4.009 -3.327 -6.385 1.00 . A A . 10 TYR C 1 1 5 2994 1 1 10 TYR CA C -2.669 -3.859 -5.908 1.00 . A A . 10 TYR CA 1 1 5 2995 1 1 10 TYR CB C -2.411 -3.504 -4.435 1.00 . A A . 10 TYR CB 1 1 5 2996 1 1 10 TYR CD1 C -3.288 -5.501 -3.181 1.00 . A A . 10 TYR CD1 1 1 5 2997 1 1 10 TYR CD2 C -4.408 -3.433 -2.891 1.00 . A A . 10 TYR CD2 1 1 5 2998 1 1 10 TYR CE1 C -4.175 -6.109 -2.326 1.00 . A A . 10 TYR CE1 1 1 5 2999 1 1 10 TYR CE2 C -5.297 -4.028 -2.029 1.00 . A A . 10 TYR CE2 1 1 5 3000 1 1 10 TYR CG C -3.389 -4.156 -3.481 1.00 . A A . 10 TYR CG 1 1 5 3001 1 1 10 TYR CZ C -5.177 -5.369 -1.752 1.00 . A A . 10 TYR CZ 1 1 5 3002 1 1 10 TYR H H -1.192 -2.511 -6.561 1.00 . A A . 10 TYR H 1 1 5 3003 1 1 10 TYR HA H -2.671 -4.933 -6.033 1.00 . A A . 10 TYR HA 1 1 5 3004 1 1 10 TYR HB2 H -1.416 -3.823 -4.164 1.00 . A A . 10 TYR HB2 1 1 5 3005 1 1 10 TYR HB3 H -2.486 -2.433 -4.313 1.00 . A A . 10 TYR HB3 1 1 5 3006 1 1 10 TYR HD1 H -2.494 -6.076 -3.636 1.00 . A A . 10 TYR HD1 1 1 5 3007 1 1 10 TYR HD2 H -4.500 -2.379 -3.111 1.00 . A A . 10 TYR HD2 1 1 5 3008 1 1 10 TYR HE1 H -4.065 -7.163 -2.113 1.00 . A A . 10 TYR HE1 1 1 5 3009 1 1 10 TYR HE2 H -6.077 -3.425 -1.587 1.00 . A A . 10 TYR HE2 1 1 5 3010 1 1 10 TYR HH H -5.594 -6.642 -0.393 1.00 . A A . 10 TYR HH 1 1 5 3011 1 1 10 TYR N N -1.665 -3.341 -6.782 1.00 . A A . 10 TYR N 1 1 5 3012 1 1 10 TYR O O -4.516 -2.309 -5.910 1.00 . A A . 10 TYR O 1 1 5 3013 1 1 10 TYR OH O -6.066 -5.974 -0.905 1.00 . A A . 10 TYR OH 1 1 5 3014 1 1 11 LYS C C -6.893 -4.143 -7.272 1.00 . A A . 11 LYS C 1 1 5 3015 1 1 11 LYS CA C -5.720 -3.552 -8.010 1.00 . A A . 11 LYS CA 1 1 5 3016 1 1 11 LYS CB C -5.700 -3.960 -9.484 1.00 . A A . 11 LYS CB 1 1 5 3017 1 1 11 LYS CD C -6.970 -1.895 -10.192 1.00 . A A . 11 LYS CD 1 1 5 3018 1 1 11 LYS CE C -5.686 -1.160 -10.585 1.00 . A A . 11 LYS CE 1 1 5 3019 1 1 11 LYS CG C -6.850 -3.417 -10.309 1.00 . A A . 11 LYS CG 1 1 5 3020 1 1 11 LYS H H -4.062 -4.739 -7.765 1.00 . A A . 11 LYS H 1 1 5 3021 1 1 11 LYS HA H -5.771 -2.475 -7.953 1.00 . A A . 11 LYS HA 1 1 5 3022 1 1 11 LYS HB2 H -4.773 -3.637 -9.932 1.00 . A A . 11 LYS HB2 1 1 5 3023 1 1 11 LYS HB3 H -5.740 -5.039 -9.528 1.00 . A A . 11 LYS HB3 1 1 5 3024 1 1 11 LYS HD2 H -7.769 -1.558 -10.834 1.00 . A A . 11 LYS HD2 1 1 5 3025 1 1 11 LYS HD3 H -7.221 -1.645 -9.172 1.00 . A A . 11 LYS HD3 1 1 5 3026 1 1 11 LYS HE2 H -5.795 -0.122 -10.324 1.00 . A A . 11 LYS HE2 1 1 5 3027 1 1 11 LYS HE3 H -4.877 -1.563 -9.993 1.00 . A A . 11 LYS HE3 1 1 5 3028 1 1 11 LYS HG2 H -6.680 -3.684 -11.341 1.00 . A A . 11 LYS HG2 1 1 5 3029 1 1 11 LYS HG3 H -7.758 -3.879 -9.952 1.00 . A A . 11 LYS HG3 1 1 5 3030 1 1 11 LYS HZ1 H -6.113 -0.971 -12.640 1.00 . A A . 11 LYS HZ1 1 1 5 3031 1 1 11 LYS HZ2 H -5.072 -2.253 -12.304 1.00 . A A . 11 LYS HZ2 1 1 5 3032 1 1 11 LYS HZ3 H -4.521 -0.665 -12.219 1.00 . A A . 11 LYS HZ3 1 1 5 3033 1 1 11 LYS N N -4.518 -3.955 -7.398 1.00 . A A . 11 LYS N 1 1 5 3034 1 1 11 LYS NZ N -5.337 -1.287 -12.022 1.00 . A A . 11 LYS NZ 1 1 5 3035 1 1 11 LYS O O -7.113 -5.353 -7.290 1.00 . A A . 11 LYS O 1 1 5 3036 1 1 12 GLY C C -8.893 -2.784 -4.653 1.00 . A A . 12 GLY C 1 1 5 3037 1 1 12 GLY CA C -8.716 -3.702 -5.829 1.00 . A A . 12 GLY CA 1 1 5 3038 1 1 12 GLY H H -7.331 -2.355 -6.549 1.00 . A A . 12 GLY H 1 1 5 3039 1 1 12 GLY HA2 H -9.584 -3.665 -6.468 1.00 . A A . 12 GLY HA2 1 1 5 3040 1 1 12 GLY HA3 H -8.571 -4.711 -5.472 1.00 . A A . 12 GLY HA3 1 1 5 3041 1 1 12 GLY N N -7.587 -3.300 -6.583 1.00 . A A . 12 GLY N 1 1 5 3042 1 1 12 GLY O O -7.936 -2.079 -4.274 1.00 . A A . 12 GLY O 1 1 5 3043 1 1 13 PRO C C -9.749 -2.524 -1.663 1.00 . A A . 13 PRO C 1 1 5 3044 1 1 13 PRO CA C -10.343 -1.893 -2.910 1.00 . A A . 13 PRO CA 1 1 5 3045 1 1 13 PRO CB C -11.882 -1.845 -2.798 1.00 . A A . 13 PRO CB 1 1 5 3046 1 1 13 PRO CD C -11.312 -3.393 -4.526 1.00 . A A . 13 PRO CD 1 1 5 3047 1 1 13 PRO CG C -12.390 -2.463 -4.058 1.00 . A A . 13 PRO CG 1 1 5 3048 1 1 13 PRO HA H -9.949 -0.895 -3.027 1.00 . A A . 13 PRO HA 1 1 5 3049 1 1 13 PRO HB2 H -12.194 -2.399 -1.925 1.00 . A A . 13 PRO HB2 1 1 5 3050 1 1 13 PRO HB3 H -12.208 -0.820 -2.702 1.00 . A A . 13 PRO HB3 1 1 5 3051 1 1 13 PRO HD2 H -11.416 -4.361 -4.056 1.00 . A A . 13 PRO HD2 1 1 5 3052 1 1 13 PRO HD3 H -11.341 -3.480 -5.601 1.00 . A A . 13 PRO HD3 1 1 5 3053 1 1 13 PRO HG2 H -13.298 -3.011 -3.858 1.00 . A A . 13 PRO HG2 1 1 5 3054 1 1 13 PRO HG3 H -12.570 -1.697 -4.798 1.00 . A A . 13 PRO HG3 1 1 5 3055 1 1 13 PRO N N -10.094 -2.710 -4.079 1.00 . A A . 13 PRO N 1 1 5 3056 1 1 13 PRO O O -9.488 -3.740 -1.618 1.00 . A A . 13 PRO O 1 1 5 3057 1 1 14 CYS C C -10.130 -2.732 1.426 1.00 . A A . 14 CYS C 1 1 5 3058 1 1 14 CYS CA C -9.005 -2.194 0.563 1.00 . A A . 14 CYS CA 1 1 5 3059 1 1 14 CYS CB C -8.240 -1.091 1.291 1.00 . A A . 14 CYS CB 1 1 5 3060 1 1 14 CYS H H -9.699 -0.759 -0.778 1.00 . A A . 14 CYS H 1 1 5 3061 1 1 14 CYS HA H -8.323 -3.002 0.345 1.00 . A A . 14 CYS HA 1 1 5 3062 1 1 14 CYS HB2 H -7.368 -0.826 0.710 1.00 . A A . 14 CYS HB2 1 1 5 3063 1 1 14 CYS HB3 H -8.877 -0.226 1.386 1.00 . A A . 14 CYS HB3 1 1 5 3064 1 1 14 CYS N N -9.521 -1.719 -0.676 1.00 . A A . 14 CYS N 1 1 5 3065 1 1 14 CYS O O -10.894 -1.966 2.033 1.00 . A A . 14 CYS O 1 1 5 3066 1 1 14 CYS SG S -7.671 -1.560 2.955 1.00 . A A . 14 CYS SG 1 1 5 3067 1 1 15 PHE C C -10.568 -5.012 3.572 1.00 . A A . 15 PHE C 1 1 5 3068 1 1 15 PHE CA C -11.246 -4.704 2.256 1.00 . A A . 15 PHE CA 1 1 5 3069 1 1 15 PHE CB C -11.747 -5.999 1.609 1.00 . A A . 15 PHE CB 1 1 5 3070 1 1 15 PHE CD1 C -11.779 -6.250 -0.884 1.00 . A A . 15 PHE CD1 1 1 5 3071 1 1 15 PHE CD2 C -13.629 -5.182 0.168 1.00 . A A . 15 PHE CD2 1 1 5 3072 1 1 15 PHE CE1 C -12.372 -6.073 -2.113 1.00 . A A . 15 PHE CE1 1 1 5 3073 1 1 15 PHE CE2 C -14.227 -5.002 -1.059 1.00 . A A . 15 PHE CE2 1 1 5 3074 1 1 15 PHE CG C -12.398 -5.808 0.271 1.00 . A A . 15 PHE CG 1 1 5 3075 1 1 15 PHE CZ C -13.600 -5.448 -2.201 1.00 . A A . 15 PHE CZ 1 1 5 3076 1 1 15 PHE H H -9.742 -4.569 0.791 1.00 . A A . 15 PHE H 1 1 5 3077 1 1 15 PHE HA H -12.076 -4.036 2.426 1.00 . A A . 15 PHE HA 1 1 5 3078 1 1 15 PHE HB2 H -10.916 -6.676 1.479 1.00 . A A . 15 PHE HB2 1 1 5 3079 1 1 15 PHE HB3 H -12.470 -6.456 2.268 1.00 . A A . 15 PHE HB3 1 1 5 3080 1 1 15 PHE HD1 H -10.819 -6.741 -0.820 1.00 . A A . 15 PHE HD1 1 1 5 3081 1 1 15 PHE HD2 H -14.125 -4.830 1.061 1.00 . A A . 15 PHE HD2 1 1 5 3082 1 1 15 PHE HE1 H -11.877 -6.425 -3.007 1.00 . A A . 15 PHE HE1 1 1 5 3083 1 1 15 PHE HE2 H -15.188 -4.511 -1.119 1.00 . A A . 15 PHE HE2 1 1 5 3084 1 1 15 PHE HZ H -14.067 -5.310 -3.166 1.00 . A A . 15 PHE HZ 1 1 5 3085 1 1 15 PHE N N -10.288 -4.034 1.407 1.00 . A A . 15 PHE N 1 1 5 3086 1 1 15 PHE O O -11.179 -4.969 4.638 1.00 . A A . 15 PHE O 1 1 5 3087 1 1 16 THR C C -7.205 -4.706 4.499 1.00 . A A . 16 THR C 1 1 5 3088 1 1 16 THR CA C -8.476 -5.553 4.623 1.00 . A A . 16 THR CA 1 1 5 3089 1 1 16 THR CB C -8.105 -7.055 4.684 1.00 . A A . 16 THR CB 1 1 5 3090 1 1 16 THR CG2 C -7.384 -7.394 5.985 1.00 . A A . 16 THR CG2 1 1 5 3091 1 1 16 THR H H -8.865 -5.316 2.601 1.00 . A A . 16 THR H 1 1 5 3092 1 1 16 THR HA H -9.019 -5.279 5.515 1.00 . A A . 16 THR HA 1 1 5 3093 1 1 16 THR HB H -7.456 -7.276 3.849 1.00 . A A . 16 THR HB 1 1 5 3094 1 1 16 THR HG1 H -9.464 -7.992 3.643 1.00 . A A . 16 THR HG1 1 1 5 3095 1 1 16 THR HG21 H -8.030 -7.173 6.822 1.00 . A A . 16 THR HG21 1 1 5 3096 1 1 16 THR HG22 H -6.484 -6.802 6.061 1.00 . A A . 16 THR HG22 1 1 5 3097 1 1 16 THR HG23 H -7.127 -8.442 5.994 1.00 . A A . 16 THR HG23 1 1 5 3098 1 1 16 THR N N -9.293 -5.291 3.485 1.00 . A A . 16 THR N 1 1 5 3099 1 1 16 THR O O -6.479 -4.799 3.506 1.00 . A A . 16 THR O 1 1 5 3100 1 1 16 THR OG1 O -9.304 -7.861 4.588 1.00 . A A . 16 THR OG1 1 1 5 3101 1 1 17 THR C C -4.527 -3.859 5.592 1.00 . A A . 17 THR C 1 1 5 3102 1 1 17 THR CA C -5.798 -3.011 5.485 1.00 . A A . 17 THR CA 1 1 5 3103 1 1 17 THR CB C -5.899 -2.011 6.650 1.00 . A A . 17 THR CB 1 1 5 3104 1 1 17 THR CG2 C -4.788 -0.963 6.581 1.00 . A A . 17 THR CG2 1 1 5 3105 1 1 17 THR H H -7.592 -3.802 6.227 1.00 . A A . 17 THR H 1 1 5 3106 1 1 17 THR HA H -5.779 -2.464 4.553 1.00 . A A . 17 THR HA 1 1 5 3107 1 1 17 THR HB H -5.838 -2.551 7.583 1.00 . A A . 17 THR HB 1 1 5 3108 1 1 17 THR HG1 H -7.505 -1.483 5.658 1.00 . A A . 17 THR HG1 1 1 5 3109 1 1 17 THR HG21 H -4.883 -0.278 7.409 1.00 . A A . 17 THR HG21 1 1 5 3110 1 1 17 THR HG22 H -4.867 -0.416 5.653 1.00 . A A . 17 THR HG22 1 1 5 3111 1 1 17 THR HG23 H -3.828 -1.455 6.626 1.00 . A A . 17 THR HG23 1 1 5 3112 1 1 17 THR N N -6.963 -3.865 5.477 1.00 . A A . 17 THR N 1 1 5 3113 1 1 17 THR O O -3.514 -3.560 4.959 1.00 . A A . 17 THR O 1 1 5 3114 1 1 17 THR OG1 O -7.183 -1.352 6.560 1.00 . A A . 17 THR OG1 1 1 5 3115 1 1 18 GLY C C -2.998 -6.402 5.214 1.00 . A A . 18 GLY C 1 1 5 3116 1 1 18 GLY CA C -3.542 -5.876 6.523 1.00 . A A . 18 GLY CA 1 1 5 3117 1 1 18 GLY H H -5.472 -5.107 6.824 1.00 . A A . 18 GLY H 1 1 5 3118 1 1 18 GLY HA2 H -2.743 -5.371 7.045 1.00 . A A . 18 GLY HA2 1 1 5 3119 1 1 18 GLY HA3 H -3.882 -6.709 7.120 1.00 . A A . 18 GLY HA3 1 1 5 3120 1 1 18 GLY N N -4.632 -4.951 6.347 1.00 . A A . 18 GLY N 1 1 5 3121 1 1 18 GLY O O -1.798 -6.359 4.999 1.00 . A A . 18 GLY O 1 1 5 3122 1 1 19 SER C C -2.931 -6.303 2.112 1.00 . A A . 19 SER C 1 1 5 3123 1 1 19 SER CA C -3.468 -7.387 3.043 1.00 . A A . 19 SER CA 1 1 5 3124 1 1 19 SER CB C -4.617 -8.182 2.413 1.00 . A A . 19 SER CB 1 1 5 3125 1 1 19 SER H H -4.843 -6.793 4.497 1.00 . A A . 19 SER H 1 1 5 3126 1 1 19 SER HA H -2.656 -8.069 3.251 1.00 . A A . 19 SER HA 1 1 5 3127 1 1 19 SER HB2 H -4.384 -8.395 1.382 1.00 . A A . 19 SER HB2 1 1 5 3128 1 1 19 SER HB3 H -4.751 -9.107 2.953 1.00 . A A . 19 SER HB3 1 1 5 3129 1 1 19 SER HG H -6.538 -8.017 2.140 1.00 . A A . 19 SER HG 1 1 5 3130 1 1 19 SER N N -3.881 -6.838 4.320 1.00 . A A . 19 SER N 1 1 5 3131 1 1 19 SER O O -2.001 -6.541 1.351 1.00 . A A . 19 SER O 1 1 5 3132 1 1 19 SER OG O -5.827 -7.450 2.464 1.00 . A A . 19 SER OG 1 1 5 3133 1 1 20 CYS C C -1.602 -3.617 1.836 1.00 . A A . 20 CYS C 1 1 5 3134 1 1 20 CYS CA C -3.043 -3.967 1.428 1.00 . A A . 20 CYS CA 1 1 5 3135 1 1 20 CYS CB C -3.981 -2.771 1.661 1.00 . A A . 20 CYS CB 1 1 5 3136 1 1 20 CYS H H -4.276 -5.021 2.801 1.00 . A A . 20 CYS H 1 1 5 3137 1 1 20 CYS HA H -3.056 -4.238 0.383 1.00 . A A . 20 CYS HA 1 1 5 3138 1 1 20 CYS HB2 H -4.960 -3.004 1.269 1.00 . A A . 20 CYS HB2 1 1 5 3139 1 1 20 CYS HB3 H -4.061 -2.595 2.723 1.00 . A A . 20 CYS HB3 1 1 5 3140 1 1 20 CYS N N -3.506 -5.118 2.200 1.00 . A A . 20 CYS N 1 1 5 3141 1 1 20 CYS O O -0.691 -3.521 0.988 1.00 . A A . 20 CYS O 1 1 5 3142 1 1 20 CYS SG S -3.442 -1.218 0.887 1.00 . A A . 20 CYS SG 1 1 5 3143 1 1 21 ASP C C 0.897 -4.302 3.395 1.00 . A A . 21 ASP C 1 1 5 3144 1 1 21 ASP CA C -0.090 -3.191 3.709 1.00 . A A . 21 ASP CA 1 1 5 3145 1 1 21 ASP CB C -0.211 -2.966 5.228 1.00 . A A . 21 ASP CB 1 1 5 3146 1 1 21 ASP CG C 1.129 -2.752 5.912 1.00 . A A . 21 ASP CG 1 1 5 3147 1 1 21 ASP H H -2.158 -3.583 3.757 1.00 . A A . 21 ASP H 1 1 5 3148 1 1 21 ASP HA H 0.273 -2.283 3.253 1.00 . A A . 21 ASP HA 1 1 5 3149 1 1 21 ASP HB2 H -0.806 -2.078 5.386 1.00 . A A . 21 ASP HB2 1 1 5 3150 1 1 21 ASP HB3 H -0.724 -3.803 5.683 1.00 . A A . 21 ASP HB3 1 1 5 3151 1 1 21 ASP N N -1.397 -3.488 3.140 1.00 . A A . 21 ASP N 1 1 5 3152 1 1 21 ASP O O 2.007 -4.051 2.921 1.00 . A A . 21 ASP O 1 1 5 3153 1 1 21 ASP OD1 O 1.568 -3.657 6.661 1.00 . A A . 21 ASP OD1 1 1 5 3154 1 1 21 ASP OD2 O 1.768 -1.677 5.709 1.00 . A A . 21 ASP OD2 1 1 5 3155 1 1 22 ASP C C 1.724 -6.817 1.897 1.00 . A A . 22 ASP C 1 1 5 3156 1 1 22 ASP CA C 1.253 -6.722 3.350 1.00 . A A . 22 ASP CA 1 1 5 3157 1 1 22 ASP CB C 0.455 -7.968 3.732 1.00 . A A . 22 ASP CB 1 1 5 3158 1 1 22 ASP CG C 1.207 -9.249 3.525 1.00 . A A . 22 ASP CG 1 1 5 3159 1 1 22 ASP H H -0.480 -5.633 3.888 1.00 . A A . 22 ASP H 1 1 5 3160 1 1 22 ASP HA H 2.121 -6.661 3.989 1.00 . A A . 22 ASP HA 1 1 5 3161 1 1 22 ASP HB2 H 0.175 -7.904 4.771 1.00 . A A . 22 ASP HB2 1 1 5 3162 1 1 22 ASP HB3 H -0.442 -7.997 3.130 1.00 . A A . 22 ASP HB3 1 1 5 3163 1 1 22 ASP N N 0.446 -5.524 3.578 1.00 . A A . 22 ASP N 1 1 5 3164 1 1 22 ASP O O 2.907 -7.095 1.637 1.00 . A A . 22 ASP O 1 1 5 3165 1 1 22 ASP OD1 O 2.032 -9.618 4.395 1.00 . A A . 22 ASP OD1 1 1 5 3166 1 1 22 ASP OD2 O 0.967 -9.924 2.515 1.00 . A A . 22 ASP OD2 1 1 5 3167 1 1 23 HIS C C 2.198 -5.573 -0.804 1.00 . A A . 23 HIS C 1 1 5 3168 1 1 23 HIS CA C 1.127 -6.600 -0.461 1.00 . A A . 23 HIS CA 1 1 5 3169 1 1 23 HIS CB C -0.146 -6.352 -1.297 1.00 . A A . 23 HIS CB 1 1 5 3170 1 1 23 HIS CD2 C 0.464 -5.508 -3.686 1.00 . A A . 23 HIS CD2 1 1 5 3171 1 1 23 HIS CE1 C -0.012 -7.292 -4.819 1.00 . A A . 23 HIS CE1 1 1 5 3172 1 1 23 HIS CG C 0.040 -6.442 -2.793 1.00 . A A . 23 HIS CG 1 1 5 3173 1 1 23 HIS H H -0.102 -6.316 1.220 1.00 . A A . 23 HIS H 1 1 5 3174 1 1 23 HIS HA H 1.506 -7.586 -0.684 1.00 . A A . 23 HIS HA 1 1 5 3175 1 1 23 HIS HB2 H -0.893 -7.081 -1.020 1.00 . A A . 23 HIS HB2 1 1 5 3176 1 1 23 HIS HB3 H -0.523 -5.367 -1.066 1.00 . A A . 23 HIS HB3 1 1 5 3177 1 1 23 HIS HD1 H -0.603 -8.414 -3.186 1.00 . A A . 23 HIS HD1 1 1 5 3178 1 1 23 HIS HD2 H 0.762 -4.497 -3.441 1.00 . A A . 23 HIS HD2 1 1 5 3179 1 1 23 HIS HE1 H -0.166 -7.992 -5.627 1.00 . A A . 23 HIS HE1 1 1 5 3180 1 1 23 HIS N N 0.819 -6.547 0.960 1.00 . A A . 23 HIS N 1 1 5 3181 1 1 23 HIS ND1 N -0.256 -7.561 -3.533 1.00 . A A . 23 HIS ND1 1 1 5 3182 1 1 23 HIS NE2 N 0.428 -6.055 -4.970 1.00 . A A . 23 HIS NE2 1 1 5 3183 1 1 23 HIS O O 3.231 -5.908 -1.406 1.00 . A A . 23 HIS O 1 1 5 3184 1 1 24 CYS C C 4.286 -3.513 -0.024 1.00 . A A . 24 CYS C 1 1 5 3185 1 1 24 CYS CA C 2.923 -3.294 -0.687 1.00 . A A . 24 CYS CA 1 1 5 3186 1 1 24 CYS CB C 2.335 -1.892 -0.429 1.00 . A A . 24 CYS CB 1 1 5 3187 1 1 24 CYS H H 1.162 -4.133 0.112 1.00 . A A . 24 CYS H 1 1 5 3188 1 1 24 CYS HA H 3.091 -3.392 -1.749 1.00 . A A . 24 CYS HA 1 1 5 3189 1 1 24 CYS HB2 H 1.901 -1.866 0.560 1.00 . A A . 24 CYS HB2 1 1 5 3190 1 1 24 CYS HB3 H 3.123 -1.156 -0.496 1.00 . A A . 24 CYS HB3 1 1 5 3191 1 1 24 CYS N N 1.981 -4.344 -0.392 1.00 . A A . 24 CYS N 1 1 5 3192 1 1 24 CYS O O 5.299 -3.132 -0.569 1.00 . A A . 24 CYS O 1 1 5 3193 1 1 24 CYS SG S 1.030 -1.437 -1.637 1.00 . A A . 24 CYS SG 1 1 5 3194 1 1 25 LYS C C 6.319 -5.665 1.204 1.00 . A A . 25 LYS C 1 1 5 3195 1 1 25 LYS CA C 5.575 -4.453 1.789 1.00 . A A . 25 LYS CA 1 1 5 3196 1 1 25 LYS CB C 5.356 -4.609 3.290 1.00 . A A . 25 LYS CB 1 1 5 3197 1 1 25 LYS CD C 4.442 -3.503 5.370 1.00 . A A . 25 LYS CD 1 1 5 3198 1 1 25 LYS CE C 5.511 -4.002 6.312 1.00 . A A . 25 LYS CE 1 1 5 3199 1 1 25 LYS CG C 4.922 -3.314 3.945 1.00 . A A . 25 LYS CG 1 1 5 3200 1 1 25 LYS H H 3.466 -4.448 1.529 1.00 . A A . 25 LYS H 1 1 5 3201 1 1 25 LYS HA H 6.203 -3.588 1.633 1.00 . A A . 25 LYS HA 1 1 5 3202 1 1 25 LYS HB2 H 4.594 -5.356 3.458 1.00 . A A . 25 LYS HB2 1 1 5 3203 1 1 25 LYS HB3 H 6.280 -4.931 3.749 1.00 . A A . 25 LYS HB3 1 1 5 3204 1 1 25 LYS HD2 H 4.085 -2.552 5.733 1.00 . A A . 25 LYS HD2 1 1 5 3205 1 1 25 LYS HD3 H 3.620 -4.204 5.364 1.00 . A A . 25 LYS HD3 1 1 5 3206 1 1 25 LYS HE2 H 5.817 -4.983 5.985 1.00 . A A . 25 LYS HE2 1 1 5 3207 1 1 25 LYS HE3 H 6.357 -3.332 6.273 1.00 . A A . 25 LYS HE3 1 1 5 3208 1 1 25 LYS HG2 H 5.758 -2.630 3.953 1.00 . A A . 25 LYS HG2 1 1 5 3209 1 1 25 LYS HG3 H 4.122 -2.888 3.358 1.00 . A A . 25 LYS HG3 1 1 5 3210 1 1 25 LYS HZ1 H 4.212 -4.749 7.770 1.00 . A A . 25 LYS HZ1 1 1 5 3211 1 1 25 LYS HZ2 H 4.675 -3.153 8.035 1.00 . A A . 25 LYS HZ2 1 1 5 3212 1 1 25 LYS HZ3 H 5.759 -4.408 8.344 1.00 . A A . 25 LYS HZ3 1 1 5 3213 1 1 25 LYS N N 4.314 -4.169 1.112 1.00 . A A . 25 LYS N 1 1 5 3214 1 1 25 LYS NZ N 5.006 -4.082 7.706 1.00 . A A . 25 LYS NZ 1 1 5 3215 1 1 25 LYS O O 7.523 -5.605 0.992 1.00 . A A . 25 LYS O 1 1 5 3216 1 1 26 ASN C C 6.418 -8.061 -1.045 1.00 . A A . 26 ASN C 1 1 5 3217 1 1 26 ASN CA C 6.263 -7.984 0.455 1.00 . A A . 26 ASN CA 1 1 5 3218 1 1 26 ASN CB C 5.536 -9.241 0.951 1.00 . A A . 26 ASN CB 1 1 5 3219 1 1 26 ASN CG C 5.570 -9.395 2.450 1.00 . A A . 26 ASN CG 1 1 5 3220 1 1 26 ASN H H 4.629 -6.708 1.027 1.00 . A A . 26 ASN H 1 1 5 3221 1 1 26 ASN HA H 7.254 -7.986 0.885 1.00 . A A . 26 ASN HA 1 1 5 3222 1 1 26 ASN HB2 H 4.502 -9.191 0.643 1.00 . A A . 26 ASN HB2 1 1 5 3223 1 1 26 ASN HB3 H 5.995 -10.111 0.505 1.00 . A A . 26 ASN HB3 1 1 5 3224 1 1 26 ASN HD21 H 3.866 -8.431 2.599 1.00 . A A . 26 ASN HD21 1 1 5 3225 1 1 26 ASN HD22 H 4.540 -8.960 4.080 1.00 . A A . 26 ASN HD22 1 1 5 3226 1 1 26 ASN N N 5.607 -6.738 0.916 1.00 . A A . 26 ASN N 1 1 5 3227 1 1 26 ASN ND2 N 4.579 -8.883 3.104 1.00 . A A . 26 ASN ND2 1 1 5 3228 1 1 26 ASN O O 7.441 -8.519 -1.544 1.00 . A A . 26 ASN O 1 1 5 3229 1 1 26 ASN OD1 O 6.490 -9.992 3.013 1.00 . A A . 26 ASN OD1 1 1 5 3230 1 1 27 LYS C C 6.032 -6.467 -3.820 1.00 . A A . 27 LYS C 1 1 5 3231 1 1 27 LYS CA C 5.445 -7.726 -3.213 1.00 . A A . 27 LYS CA 1 1 5 3232 1 1 27 LYS CB C 4.041 -8.015 -3.775 1.00 . A A . 27 LYS CB 1 1 5 3233 1 1 27 LYS CD C 4.842 -8.927 -6.003 1.00 . A A . 27 LYS CD 1 1 5 3234 1 1 27 LYS CE C 4.842 -8.693 -7.513 1.00 . A A . 27 LYS CE 1 1 5 3235 1 1 27 LYS CG C 3.941 -7.930 -5.292 1.00 . A A . 27 LYS CG 1 1 5 3236 1 1 27 LYS H H 4.617 -7.257 -1.338 1.00 . A A . 27 LYS H 1 1 5 3237 1 1 27 LYS HA H 6.091 -8.554 -3.466 1.00 . A A . 27 LYS HA 1 1 5 3238 1 1 27 LYS HB2 H 3.746 -9.010 -3.475 1.00 . A A . 27 LYS HB2 1 1 5 3239 1 1 27 LYS HB3 H 3.348 -7.305 -3.349 1.00 . A A . 27 LYS HB3 1 1 5 3240 1 1 27 LYS HD2 H 5.849 -8.813 -5.631 1.00 . A A . 27 LYS HD2 1 1 5 3241 1 1 27 LYS HD3 H 4.492 -9.928 -5.800 1.00 . A A . 27 LYS HD3 1 1 5 3242 1 1 27 LYS HE2 H 5.215 -7.698 -7.707 1.00 . A A . 27 LYS HE2 1 1 5 3243 1 1 27 LYS HE3 H 5.500 -9.411 -7.976 1.00 . A A . 27 LYS HE3 1 1 5 3244 1 1 27 LYS HG2 H 2.919 -8.126 -5.581 1.00 . A A . 27 LYS HG2 1 1 5 3245 1 1 27 LYS HG3 H 4.214 -6.930 -5.594 1.00 . A A . 27 LYS HG3 1 1 5 3246 1 1 27 LYS HZ1 H 3.089 -9.752 -7.927 1.00 . A A . 27 LYS HZ1 1 1 5 3247 1 1 27 LYS HZ2 H 3.558 -8.711 -9.149 1.00 . A A . 27 LYS HZ2 1 1 5 3248 1 1 27 LYS HZ3 H 2.839 -8.089 -7.756 1.00 . A A . 27 LYS HZ3 1 1 5 3249 1 1 27 LYS N N 5.411 -7.644 -1.768 1.00 . A A . 27 LYS N 1 1 5 3250 1 1 27 LYS NZ N 3.492 -8.812 -8.116 1.00 . A A . 27 LYS NZ 1 1 5 3251 1 1 27 LYS O O 6.946 -6.529 -4.640 1.00 . A A . 27 LYS O 1 1 5 3252 1 1 28 GLU C C 7.331 -3.670 -3.297 1.00 . A A . 28 GLU C 1 1 5 3253 1 1 28 GLU CA C 6.005 -4.071 -3.943 1.00 . A A . 28 GLU CA 1 1 5 3254 1 1 28 GLU CB C 4.964 -2.979 -3.748 1.00 . A A . 28 GLU CB 1 1 5 3255 1 1 28 GLU CD C 3.809 -3.261 -5.950 1.00 . A A . 28 GLU CD 1 1 5 3256 1 1 28 GLU CG C 3.650 -3.231 -4.456 1.00 . A A . 28 GLU CG 1 1 5 3257 1 1 28 GLU H H 4.799 -5.342 -2.750 1.00 . A A . 28 GLU H 1 1 5 3258 1 1 28 GLU HA H 6.164 -4.216 -5.000 1.00 . A A . 28 GLU HA 1 1 5 3259 1 1 28 GLU HB2 H 4.775 -2.858 -2.693 1.00 . A A . 28 GLU HB2 1 1 5 3260 1 1 28 GLU HB3 H 5.375 -2.059 -4.135 1.00 . A A . 28 GLU HB3 1 1 5 3261 1 1 28 GLU HG2 H 3.257 -4.184 -4.134 1.00 . A A . 28 GLU HG2 1 1 5 3262 1 1 28 GLU HG3 H 2.954 -2.447 -4.196 1.00 . A A . 28 GLU HG3 1 1 5 3263 1 1 28 GLU N N 5.528 -5.332 -3.408 1.00 . A A . 28 GLU N 1 1 5 3264 1 1 28 GLU O O 8.089 -2.861 -3.853 1.00 . A A . 28 GLU O 1 1 5 3265 1 1 28 GLU OE1 O 3.900 -4.356 -6.527 1.00 . A A . 28 GLU OE1 1 1 5 3266 1 1 28 GLU OE2 O 3.845 -2.166 -6.578 1.00 . A A . 28 GLU OE2 1 1 5 3267 1 1 29 HIS C C 8.899 -2.566 -0.869 1.00 . A A . 29 HIS C 1 1 5 3268 1 1 29 HIS CA C 8.821 -4.017 -1.335 1.00 . A A . 29 HIS CA 1 1 5 3269 1 1 29 HIS CB C 10.100 -4.443 -2.095 1.00 . A A . 29 HIS CB 1 1 5 3270 1 1 29 HIS CD2 C 10.569 -6.914 -1.458 1.00 . A A . 29 HIS CD2 1 1 5 3271 1 1 29 HIS CE1 C 10.177 -7.858 -3.371 1.00 . A A . 29 HIS CE1 1 1 5 3272 1 1 29 HIS CG C 10.212 -5.927 -2.318 1.00 . A A . 29 HIS CG 1 1 5 3273 1 1 29 HIS H H 6.946 -4.905 -1.786 1.00 . A A . 29 HIS H 1 1 5 3274 1 1 29 HIS HA H 8.726 -4.627 -0.447 1.00 . A A . 29 HIS HA 1 1 5 3275 1 1 29 HIS HB2 H 10.109 -3.965 -3.063 1.00 . A A . 29 HIS HB2 1 1 5 3276 1 1 29 HIS HB3 H 10.965 -4.122 -1.534 1.00 . A A . 29 HIS HB3 1 1 5 3277 1 1 29 HIS HD1 H 9.679 -6.121 -4.360 1.00 . A A . 29 HIS HD1 1 1 5 3278 1 1 29 HIS HD2 H 10.834 -6.782 -0.419 1.00 . A A . 29 HIS HD2 1 1 5 3279 1 1 29 HIS HE1 H 10.063 -8.589 -4.158 1.00 . A A . 29 HIS HE1 1 1 5 3280 1 1 29 HIS N N 7.602 -4.265 -2.125 1.00 . A A . 29 HIS N 1 1 5 3281 1 1 29 HIS ND1 N 9.968 -6.549 -3.524 1.00 . A A . 29 HIS ND1 1 1 5 3282 1 1 29 HIS NE2 N 10.546 -8.138 -2.130 1.00 . A A . 29 HIS NE2 1 1 5 3283 1 1 29 HIS O O 9.985 -2.024 -0.633 1.00 . A A . 29 HIS O 1 1 5 3284 1 1 30 LEU C C 7.628 -0.550 1.282 1.00 . A A . 30 LEU C 1 1 5 3285 1 1 30 LEU CA C 7.622 -0.606 -0.236 1.00 . A A . 30 LEU CA 1 1 5 3286 1 1 30 LEU CB C 6.322 0.012 -0.766 1.00 . A A . 30 LEU CB 1 1 5 3287 1 1 30 LEU CD1 C 4.784 0.573 -2.660 1.00 . A A . 30 LEU CD1 1 1 5 3288 1 1 30 LEU CD2 C 7.254 0.584 -3.031 1.00 . A A . 30 LEU CD2 1 1 5 3289 1 1 30 LEU CG C 6.106 -0.058 -2.275 1.00 . A A . 30 LEU CG 1 1 5 3290 1 1 30 LEU H H 6.919 -2.497 -0.795 1.00 . A A . 30 LEU H 1 1 5 3291 1 1 30 LEU HA H 8.463 -0.052 -0.627 1.00 . A A . 30 LEU HA 1 1 5 3292 1 1 30 LEU HB2 H 5.496 -0.490 -0.286 1.00 . A A . 30 LEU HB2 1 1 5 3293 1 1 30 LEU HB3 H 6.302 1.051 -0.472 1.00 . A A . 30 LEU HB3 1 1 5 3294 1 1 30 LEU HD11 H 4.668 0.539 -3.733 1.00 . A A . 30 LEU HD11 1 1 5 3295 1 1 30 LEU HD12 H 4.753 1.598 -2.323 1.00 . A A . 30 LEU HD12 1 1 5 3296 1 1 30 LEU HD13 H 3.977 0.023 -2.199 1.00 . A A . 30 LEU HD13 1 1 5 3297 1 1 30 LEU HD21 H 7.356 1.614 -2.726 1.00 . A A . 30 LEU HD21 1 1 5 3298 1 1 30 LEU HD22 H 7.054 0.543 -4.091 1.00 . A A . 30 LEU HD22 1 1 5 3299 1 1 30 LEU HD23 H 8.167 0.052 -2.817 1.00 . A A . 30 LEU HD23 1 1 5 3300 1 1 30 LEU HG H 6.066 -1.102 -2.546 1.00 . A A . 30 LEU HG 1 1 5 3301 1 1 30 LEU N N 7.743 -1.977 -0.669 1.00 . A A . 30 LEU N 1 1 5 3302 1 1 30 LEU O O 7.683 -1.590 1.951 1.00 . A A . 30 LEU O 1 1 5 3303 1 1 31 ARG C C 6.311 0.393 3.950 1.00 . A A . 31 ARG C 1 1 5 3304 1 1 31 ARG CA C 7.588 0.867 3.239 1.00 . A A . 31 ARG CA 1 1 5 3305 1 1 31 ARG CB C 7.883 2.346 3.524 1.00 . A A . 31 ARG CB 1 1 5 3306 1 1 31 ARG CD C 8.289 4.162 5.191 1.00 . A A . 31 ARG CD 1 1 5 3307 1 1 31 ARG CG C 7.861 2.724 4.989 1.00 . A A . 31 ARG CG 1 1 5 3308 1 1 31 ARG CZ C 8.526 5.764 7.090 1.00 . A A . 31 ARG CZ 1 1 5 3309 1 1 31 ARG H H 7.449 1.413 1.210 1.00 . A A . 31 ARG H 1 1 5 3310 1 1 31 ARG HA H 8.413 0.284 3.621 1.00 . A A . 31 ARG HA 1 1 5 3311 1 1 31 ARG HB2 H 8.861 2.584 3.132 1.00 . A A . 31 ARG HB2 1 1 5 3312 1 1 31 ARG HB3 H 7.150 2.948 3.006 1.00 . A A . 31 ARG HB3 1 1 5 3313 1 1 31 ARG HD2 H 9.321 4.254 4.891 1.00 . A A . 31 ARG HD2 1 1 5 3314 1 1 31 ARG HD3 H 7.674 4.801 4.576 1.00 . A A . 31 ARG HD3 1 1 5 3315 1 1 31 ARG HE H 7.719 3.906 7.158 1.00 . A A . 31 ARG HE 1 1 5 3316 1 1 31 ARG HG2 H 6.855 2.602 5.363 1.00 . A A . 31 ARG HG2 1 1 5 3317 1 1 31 ARG HG3 H 8.528 2.072 5.533 1.00 . A A . 31 ARG HG3 1 1 5 3318 1 1 31 ARG HH11 H 9.567 6.387 5.438 1.00 . A A . 31 ARG HH11 1 1 5 3319 1 1 31 ARG HH12 H 9.503 7.522 6.704 1.00 . A A . 31 ARG HH12 1 1 5 3320 1 1 31 ARG HH21 H 7.729 5.419 8.939 1.00 . A A . 31 ARG HH21 1 1 5 3321 1 1 31 ARG HH22 H 8.470 6.947 8.756 1.00 . A A . 31 ARG HH22 1 1 5 3322 1 1 31 ARG N N 7.542 0.643 1.812 1.00 . A A . 31 ARG N 1 1 5 3323 1 1 31 ARG NE N 8.161 4.575 6.588 1.00 . A A . 31 ARG NE 1 1 5 3324 1 1 31 ARG NH1 N 9.254 6.610 6.364 1.00 . A A . 31 ARG NH1 1 1 5 3325 1 1 31 ARG NH2 N 8.223 6.064 8.348 1.00 . A A . 31 ARG NH2 1 1 5 3326 1 1 31 ARG O O 6.387 -0.268 4.980 1.00 . A A . 31 ARG O 1 1 5 3327 1 1 32 SER C C 2.786 0.476 2.968 1.00 . A A . 32 SER C 1 1 5 3328 1 1 32 SER CA C 3.894 0.324 4.009 1.00 . A A . 32 SER CA 1 1 5 3329 1 1 32 SER CB C 3.625 1.237 5.244 1.00 . A A . 32 SER CB 1 1 5 3330 1 1 32 SER H H 5.119 1.198 2.550 1.00 . A A . 32 SER H 1 1 5 3331 1 1 32 SER HA H 3.963 -0.706 4.331 1.00 . A A . 32 SER HA 1 1 5 3332 1 1 32 SER HB2 H 4.488 1.218 5.891 1.00 . A A . 32 SER HB2 1 1 5 3333 1 1 32 SER HB3 H 3.464 2.249 4.902 1.00 . A A . 32 SER HB3 1 1 5 3334 1 1 32 SER HG H 2.335 -0.132 5.870 1.00 . A A . 32 SER HG 1 1 5 3335 1 1 32 SER N N 5.156 0.706 3.398 1.00 . A A . 32 SER N 1 1 5 3336 1 1 32 SER O O 3.014 1.080 1.913 1.00 . A A . 32 SER O 1 1 5 3337 1 1 32 SER OG O 2.488 0.822 6.004 1.00 . A A . 32 SER OG 1 1 5 3338 1 1 33 GLY C C -0.660 0.582 3.195 1.00 . A A . 33 GLY C 1 1 5 3339 1 1 33 GLY CA C 0.481 0.063 2.376 1.00 . A A . 33 GLY CA 1 1 5 3340 1 1 33 GLY H H 1.524 -0.633 4.055 1.00 . A A . 33 GLY H 1 1 5 3341 1 1 33 GLY HA2 H 0.724 0.772 1.598 1.00 . A A . 33 GLY HA2 1 1 5 3342 1 1 33 GLY HA3 H 0.200 -0.874 1.920 1.00 . A A . 33 GLY HA3 1 1 5 3343 1 1 33 GLY N N 1.633 -0.096 3.235 1.00 . A A . 33 GLY N 1 1 5 3344 1 1 33 GLY O O -1.011 -0.021 4.202 1.00 . A A . 33 GLY O 1 1 5 3345 1 1 34 ARG C C -3.516 2.571 2.924 1.00 . A A . 34 ARG C 1 1 5 3346 1 1 34 ARG CA C -2.215 2.335 3.650 1.00 . A A . 34 ARG CA 1 1 5 3347 1 1 34 ARG CB C -1.652 3.622 4.256 1.00 . A A . 34 ARG CB 1 1 5 3348 1 1 34 ARG CD C 0.173 4.562 5.719 1.00 . A A . 34 ARG CD 1 1 5 3349 1 1 34 ARG CG C -0.462 3.334 5.146 1.00 . A A . 34 ARG CG 1 1 5 3350 1 1 34 ARG CZ C 2.392 4.880 6.795 1.00 . A A . 34 ARG CZ 1 1 5 3351 1 1 34 ARG H H -0.992 2.137 1.967 1.00 . A A . 34 ARG H 1 1 5 3352 1 1 34 ARG HA H -2.415 1.652 4.461 1.00 . A A . 34 ARG HA 1 1 5 3353 1 1 34 ARG HB2 H -1.343 4.283 3.460 1.00 . A A . 34 ARG HB2 1 1 5 3354 1 1 34 ARG HB3 H -2.414 4.105 4.851 1.00 . A A . 34 ARG HB3 1 1 5 3355 1 1 34 ARG HD2 H 0.552 5.173 4.914 1.00 . A A . 34 ARG HD2 1 1 5 3356 1 1 34 ARG HD3 H -0.562 5.112 6.287 1.00 . A A . 34 ARG HD3 1 1 5 3357 1 1 34 ARG HE H 1.122 3.340 7.095 1.00 . A A . 34 ARG HE 1 1 5 3358 1 1 34 ARG HG2 H -0.786 2.710 5.963 1.00 . A A . 34 ARG HG2 1 1 5 3359 1 1 34 ARG HG3 H 0.272 2.794 4.565 1.00 . A A . 34 ARG HG3 1 1 5 3360 1 1 34 ARG HH11 H 2.005 6.303 5.364 1.00 . A A . 34 ARG HH11 1 1 5 3361 1 1 34 ARG HH12 H 3.464 6.518 6.228 1.00 . A A . 34 ARG HH12 1 1 5 3362 1 1 34 ARG HH21 H 3.168 3.598 8.180 1.00 . A A . 34 ARG HH21 1 1 5 3363 1 1 34 ARG HH22 H 4.151 4.949 7.820 1.00 . A A . 34 ARG HH22 1 1 5 3364 1 1 34 ARG N N -1.220 1.706 2.819 1.00 . A A . 34 ARG N 1 1 5 3365 1 1 34 ARG NE N 1.273 4.182 6.609 1.00 . A A . 34 ARG NE 1 1 5 3366 1 1 34 ARG NH1 N 2.637 5.971 6.079 1.00 . A A . 34 ARG NH1 1 1 5 3367 1 1 34 ARG NH2 N 3.298 4.446 7.658 1.00 . A A . 34 ARG NH2 1 1 5 3368 1 1 34 ARG O O -3.550 3.022 1.774 1.00 . A A . 34 ARG O 1 1 5 3369 1 1 35 CYS C C -6.446 3.744 3.441 1.00 . A A . 35 CYS C 1 1 5 3370 1 1 35 CYS CA C -5.895 2.401 3.053 1.00 . A A . 35 CYS CA 1 1 5 3371 1 1 35 CYS CB C -6.781 1.280 3.572 1.00 . A A . 35 CYS CB 1 1 5 3372 1 1 35 CYS H H -4.487 1.948 4.521 1.00 . A A . 35 CYS H 1 1 5 3373 1 1 35 CYS HA H -5.841 2.346 1.977 1.00 . A A . 35 CYS HA 1 1 5 3374 1 1 35 CYS HB2 H -6.923 1.402 4.636 1.00 . A A . 35 CYS HB2 1 1 5 3375 1 1 35 CYS HB3 H -7.738 1.321 3.074 1.00 . A A . 35 CYS HB3 1 1 5 3376 1 1 35 CYS N N -4.579 2.267 3.598 1.00 . A A . 35 CYS N 1 1 5 3377 1 1 35 CYS O O -6.644 4.039 4.621 1.00 . A A . 35 CYS O 1 1 5 3378 1 1 35 CYS SG S -6.072 -0.373 3.282 1.00 . A A . 35 CYS SG 1 1 5 3379 1 1 36 ARG C C -8.651 5.920 2.700 1.00 . A A . 36 ARG C 1 1 5 3380 1 1 36 ARG CA C -7.127 5.902 2.696 1.00 . A A . 36 ARG CA 1 1 5 3381 1 1 36 ARG CB C -6.578 6.843 1.642 1.00 . A A . 36 ARG CB 1 1 5 3382 1 1 36 ARG CD C -4.640 7.728 2.974 1.00 . A A . 36 ARG CD 1 1 5 3383 1 1 36 ARG CG C -5.070 7.047 1.693 1.00 . A A . 36 ARG CG 1 1 5 3384 1 1 36 ARG CZ C -2.793 9.375 2.960 1.00 . A A . 36 ARG CZ 1 1 5 3385 1 1 36 ARG H H -6.441 4.261 1.554 1.00 . A A . 36 ARG H 1 1 5 3386 1 1 36 ARG HA H -6.776 6.222 3.664 1.00 . A A . 36 ARG HA 1 1 5 3387 1 1 36 ARG HB2 H -6.823 6.427 0.676 1.00 . A A . 36 ARG HB2 1 1 5 3388 1 1 36 ARG HB3 H -7.058 7.804 1.751 1.00 . A A . 36 ARG HB3 1 1 5 3389 1 1 36 ARG HD2 H -5.240 8.612 3.118 1.00 . A A . 36 ARG HD2 1 1 5 3390 1 1 36 ARG HD3 H -4.799 7.050 3.799 1.00 . A A . 36 ARG HD3 1 1 5 3391 1 1 36 ARG HE H -2.557 7.388 2.963 1.00 . A A . 36 ARG HE 1 1 5 3392 1 1 36 ARG HG2 H -4.593 6.079 1.645 1.00 . A A . 36 ARG HG2 1 1 5 3393 1 1 36 ARG HG3 H -4.763 7.647 0.849 1.00 . A A . 36 ARG HG3 1 1 5 3394 1 1 36 ARG HH11 H -4.648 10.249 2.803 1.00 . A A . 36 ARG HH11 1 1 5 3395 1 1 36 ARG HH12 H -3.359 11.343 2.919 1.00 . A A . 36 ARG HH12 1 1 5 3396 1 1 36 ARG HH21 H -0.861 8.830 3.061 1.00 . A A . 36 ARG HH21 1 1 5 3397 1 1 36 ARG HH22 H -1.085 10.530 3.023 1.00 . A A . 36 ARG HH22 1 1 5 3398 1 1 36 ARG N N -6.633 4.572 2.467 1.00 . A A . 36 ARG N 1 1 5 3399 1 1 36 ARG NE N -3.227 8.112 2.949 1.00 . A A . 36 ARG NE 1 1 5 3400 1 1 36 ARG NH1 N -3.656 10.387 2.881 1.00 . A A . 36 ARG NH1 1 1 5 3401 1 1 36 ARG NH2 N -1.498 9.616 3.021 1.00 . A A . 36 ARG NH2 1 1 5 3402 1 1 36 ARG O O -9.281 4.900 2.436 1.00 . A A . 36 ARG O 1 1 5 3403 1 1 37 ASP C C -11.483 6.756 1.918 1.00 . A A . 37 ASP C 1 1 5 3404 1 1 37 ASP CA C -10.667 7.348 3.071 1.00 . A A . 37 ASP CA 1 1 5 3405 1 1 37 ASP CB C -10.903 8.857 3.145 1.00 . A A . 37 ASP CB 1 1 5 3406 1 1 37 ASP CG C -12.363 9.247 3.181 1.00 . A A . 37 ASP CG 1 1 5 3407 1 1 37 ASP H H -8.611 7.855 3.115 1.00 . A A . 37 ASP H 1 1 5 3408 1 1 37 ASP HA H -11.009 6.915 3.999 1.00 . A A . 37 ASP HA 1 1 5 3409 1 1 37 ASP HB2 H -10.434 9.240 4.039 1.00 . A A . 37 ASP HB2 1 1 5 3410 1 1 37 ASP HB3 H -10.444 9.319 2.283 1.00 . A A . 37 ASP HB3 1 1 5 3411 1 1 37 ASP N N -9.210 7.092 2.960 1.00 . A A . 37 ASP N 1 1 5 3412 1 1 37 ASP O O -12.584 6.225 2.121 1.00 . A A . 37 ASP O 1 1 5 3413 1 1 37 ASP OD1 O -12.904 9.685 2.140 1.00 . A A . 37 ASP OD1 1 1 5 3414 1 1 37 ASP OD2 O -12.986 9.158 4.255 1.00 . A A . 37 ASP OD2 1 1 5 3415 1 1 38 ASP C C -11.449 4.818 -0.656 1.00 . A A . 38 ASP C 1 1 5 3416 1 1 38 ASP CA C -11.618 6.305 -0.460 1.00 . A A . 38 ASP CA 1 1 5 3417 1 1 38 ASP CB C -11.164 7.036 -1.723 1.00 . A A . 38 ASP CB 1 1 5 3418 1 1 38 ASP CG C -11.590 8.465 -1.741 1.00 . A A . 38 ASP CG 1 1 5 3419 1 1 38 ASP H H -10.031 7.196 0.657 1.00 . A A . 38 ASP H 1 1 5 3420 1 1 38 ASP HA H -12.670 6.506 -0.321 1.00 . A A . 38 ASP HA 1 1 5 3421 1 1 38 ASP HB2 H -10.087 7.000 -1.788 1.00 . A A . 38 ASP HB2 1 1 5 3422 1 1 38 ASP HB3 H -11.584 6.539 -2.586 1.00 . A A . 38 ASP HB3 1 1 5 3423 1 1 38 ASP N N -10.927 6.800 0.729 1.00 . A A . 38 ASP N 1 1 5 3424 1 1 38 ASP O O -11.823 4.295 -1.698 1.00 . A A . 38 ASP O 1 1 5 3425 1 1 38 ASP OD1 O -10.755 9.354 -1.507 1.00 . A A . 38 ASP OD1 1 1 5 3426 1 1 38 ASP OD2 O -12.779 8.729 -1.961 1.00 . A A . 38 ASP OD2 1 1 5 3427 1 1 39 PHE C C -9.624 2.292 -0.734 1.00 . A A . 39 PHE C 1 1 5 3428 1 1 39 PHE CA C -10.644 2.692 0.309 1.00 . A A . 39 PHE CA 1 1 5 3429 1 1 39 PHE CB C -11.959 1.897 0.154 1.00 . A A . 39 PHE CB 1 1 5 3430 1 1 39 PHE CD1 C -13.772 3.030 1.461 1.00 . A A . 39 PHE CD1 1 1 5 3431 1 1 39 PHE CD2 C -12.766 1.079 2.368 1.00 . A A . 39 PHE CD2 1 1 5 3432 1 1 39 PHE CE1 C -14.580 3.133 2.569 1.00 . A A . 39 PHE CE1 1 1 5 3433 1 1 39 PHE CE2 C -13.575 1.173 3.483 1.00 . A A . 39 PHE CE2 1 1 5 3434 1 1 39 PHE CG C -12.855 2.003 1.349 1.00 . A A . 39 PHE CG 1 1 5 3435 1 1 39 PHE CZ C -14.482 2.203 3.585 1.00 . A A . 39 PHE CZ 1 1 5 3436 1 1 39 PHE H H -10.569 4.636 1.130 1.00 . A A . 39 PHE H 1 1 5 3437 1 1 39 PHE HA H -10.213 2.452 1.271 1.00 . A A . 39 PHE HA 1 1 5 3438 1 1 39 PHE HB2 H -12.499 2.276 -0.701 1.00 . A A . 39 PHE HB2 1 1 5 3439 1 1 39 PHE HB3 H -11.727 0.854 -0.005 1.00 . A A . 39 PHE HB3 1 1 5 3440 1 1 39 PHE HD1 H -13.853 3.759 0.667 1.00 . A A . 39 PHE HD1 1 1 5 3441 1 1 39 PHE HD2 H -12.056 0.268 2.283 1.00 . A A . 39 PHE HD2 1 1 5 3442 1 1 39 PHE HE1 H -15.291 3.941 2.639 1.00 . A A . 39 PHE HE1 1 1 5 3443 1 1 39 PHE HE2 H -13.496 0.442 4.274 1.00 . A A . 39 PHE HE2 1 1 5 3444 1 1 39 PHE HZ H -15.115 2.285 4.456 1.00 . A A . 39 PHE HZ 1 1 5 3445 1 1 39 PHE N N -10.867 4.144 0.331 1.00 . A A . 39 PHE N 1 1 5 3446 1 1 39 PHE O O -9.542 1.121 -1.130 1.00 . A A . 39 PHE O 1 1 5 3447 1 1 40 ARG C C -6.493 2.784 -1.318 1.00 . A A . 40 ARG C 1 1 5 3448 1 1 40 ARG CA C -7.759 3.003 -2.084 1.00 . A A . 40 ARG CA 1 1 5 3449 1 1 40 ARG CB C -7.526 4.143 -3.086 1.00 . A A . 40 ARG CB 1 1 5 3450 1 1 40 ARG CD C -9.828 4.416 -4.083 1.00 . A A . 40 ARG CD 1 1 5 3451 1 1 40 ARG CG C -8.374 4.127 -4.344 1.00 . A A . 40 ARG CG 1 1 5 3452 1 1 40 ARG CZ C -11.943 4.510 -5.390 1.00 . A A . 40 ARG CZ 1 1 5 3453 1 1 40 ARG H H -8.997 4.159 -0.825 1.00 . A A . 40 ARG H 1 1 5 3454 1 1 40 ARG HA H -8.002 2.102 -2.628 1.00 . A A . 40 ARG HA 1 1 5 3455 1 1 40 ARG HB2 H -7.721 5.075 -2.578 1.00 . A A . 40 ARG HB2 1 1 5 3456 1 1 40 ARG HB3 H -6.486 4.124 -3.374 1.00 . A A . 40 ARG HB3 1 1 5 3457 1 1 40 ARG HD2 H -10.220 3.690 -3.387 1.00 . A A . 40 ARG HD2 1 1 5 3458 1 1 40 ARG HD3 H -9.905 5.400 -3.643 1.00 . A A . 40 ARG HD3 1 1 5 3459 1 1 40 ARG HE H -10.069 4.310 -6.135 1.00 . A A . 40 ARG HE 1 1 5 3460 1 1 40 ARG HG2 H -7.990 4.864 -5.034 1.00 . A A . 40 ARG HG2 1 1 5 3461 1 1 40 ARG HG3 H -8.272 3.144 -4.778 1.00 . A A . 40 ARG HG3 1 1 5 3462 1 1 40 ARG HH11 H -12.290 4.462 -3.358 1.00 . A A . 40 ARG HH11 1 1 5 3463 1 1 40 ARG HH12 H -13.681 4.622 -4.329 1.00 . A A . 40 ARG HH12 1 1 5 3464 1 1 40 ARG HH21 H -12.035 4.505 -7.434 1.00 . A A . 40 ARG HH21 1 1 5 3465 1 1 40 ARG HH22 H -13.537 4.648 -6.640 1.00 . A A . 40 ARG HH22 1 1 5 3466 1 1 40 ARG N N -8.842 3.256 -1.167 1.00 . A A . 40 ARG N 1 1 5 3467 1 1 40 ARG NE N -10.611 4.395 -5.318 1.00 . A A . 40 ARG NE 1 1 5 3468 1 1 40 ARG NH1 N -12.681 4.534 -4.284 1.00 . A A . 40 ARG NH1 1 1 5 3469 1 1 40 ARG NH2 N -12.540 4.556 -6.566 1.00 . A A . 40 ARG NH2 1 1 5 3470 1 1 40 ARG O O -6.329 3.308 -0.196 1.00 . A A . 40 ARG O 1 1 5 3471 1 1 41 CYS C C -3.310 2.762 -1.769 1.00 . A A . 41 CYS C 1 1 5 3472 1 1 41 CYS CA C -4.347 1.771 -1.324 1.00 . A A . 41 CYS CA 1 1 5 3473 1 1 41 CYS CB C -3.893 0.348 -1.599 1.00 . A A . 41 CYS CB 1 1 5 3474 1 1 41 CYS H H -5.834 1.647 -2.776 1.00 . A A . 41 CYS H 1 1 5 3475 1 1 41 CYS HA H -4.465 1.880 -0.257 1.00 . A A . 41 CYS HA 1 1 5 3476 1 1 41 CYS HB2 H -4.059 0.119 -2.642 1.00 . A A . 41 CYS HB2 1 1 5 3477 1 1 41 CYS HB3 H -2.839 0.262 -1.379 1.00 . A A . 41 CYS HB3 1 1 5 3478 1 1 41 CYS N N -5.619 2.041 -1.903 1.00 . A A . 41 CYS N 1 1 5 3479 1 1 41 CYS O O -2.855 2.755 -2.921 1.00 . A A . 41 CYS O 1 1 5 3480 1 1 41 CYS SG S -4.769 -0.890 -0.613 1.00 . A A . 41 CYS SG 1 1 5 3481 1 1 42 TRP C C -0.778 4.028 -0.246 1.00 . A A . 42 TRP C 1 1 5 3482 1 1 42 TRP CA C -1.933 4.570 -1.041 1.00 . A A . 42 TRP CA 1 1 5 3483 1 1 42 TRP CB C -2.331 5.966 -0.541 1.00 . A A . 42 TRP CB 1 1 5 3484 1 1 42 TRP CD1 C -1.887 7.734 -2.323 1.00 . A A . 42 TRP CD1 1 1 5 3485 1 1 42 TRP CD2 C -4.057 7.268 -2.072 1.00 . A A . 42 TRP CD2 1 1 5 3486 1 1 42 TRP CE2 C -3.917 8.252 -3.072 1.00 . A A . 42 TRP CE2 1 1 5 3487 1 1 42 TRP CE3 C -5.340 6.824 -1.751 1.00 . A A . 42 TRP CE3 1 1 5 3488 1 1 42 TRP CG C -2.730 6.942 -1.613 1.00 . A A . 42 TRP CG 1 1 5 3489 1 1 42 TRP CH2 C -6.243 8.345 -3.402 1.00 . A A . 42 TRP CH2 1 1 5 3490 1 1 42 TRP CZ2 C -5.004 8.795 -3.741 1.00 . A A . 42 TRP CZ2 1 1 5 3491 1 1 42 TRP CZ3 C -6.420 7.372 -2.421 1.00 . A A . 42 TRP CZ3 1 1 5 3492 1 1 42 TRP H H -3.450 3.623 -0.003 1.00 . A A . 42 TRP H 1 1 5 3493 1 1 42 TRP HA H -1.669 4.602 -2.088 1.00 . A A . 42 TRP HA 1 1 5 3494 1 1 42 TRP HB2 H -3.174 5.861 0.124 1.00 . A A . 42 TRP HB2 1 1 5 3495 1 1 42 TRP HB3 H -1.510 6.393 0.012 1.00 . A A . 42 TRP HB3 1 1 5 3496 1 1 42 TRP HD1 H -0.813 7.733 -2.204 1.00 . A A . 42 TRP HD1 1 1 5 3497 1 1 42 TRP HE1 H -2.196 9.155 -3.836 1.00 . A A . 42 TRP HE1 1 1 5 3498 1 1 42 TRP HE3 H -5.499 6.066 -1.000 1.00 . A A . 42 TRP HE3 1 1 5 3499 1 1 42 TRP HH2 H -7.117 8.744 -3.896 1.00 . A A . 42 TRP HH2 1 1 5 3500 1 1 42 TRP HZ2 H -4.889 9.551 -4.506 1.00 . A A . 42 TRP HZ2 1 1 5 3501 1 1 42 TRP HZ3 H -7.425 7.054 -2.185 1.00 . A A . 42 TRP HZ3 1 1 5 3502 1 1 42 TRP N N -2.990 3.638 -0.873 1.00 . A A . 42 TRP N 1 1 5 3503 1 1 42 TRP NE1 N -2.589 8.514 -3.203 1.00 . A A . 42 TRP NE1 1 1 5 3504 1 1 42 TRP O O -0.787 4.054 0.979 1.00 . A A . 42 TRP O 1 1 5 3505 1 1 43 CYS C C 2.435 3.773 -0.158 1.00 . A A . 43 CYS C 1 1 5 3506 1 1 43 CYS CA C 1.259 2.837 -0.275 1.00 . A A . 43 CYS CA 1 1 5 3507 1 1 43 CYS CB C 1.614 1.525 -0.979 1.00 . A A . 43 CYS CB 1 1 5 3508 1 1 43 CYS H H 0.142 3.525 -1.905 1.00 . A A . 43 CYS H 1 1 5 3509 1 1 43 CYS HA H 0.929 2.606 0.727 1.00 . A A . 43 CYS HA 1 1 5 3510 1 1 43 CYS HB2 H 1.875 1.731 -2.006 1.00 . A A . 43 CYS HB2 1 1 5 3511 1 1 43 CYS HB3 H 2.454 1.068 -0.478 1.00 . A A . 43 CYS HB3 1 1 5 3512 1 1 43 CYS N N 0.161 3.474 -0.924 1.00 . A A . 43 CYS N 1 1 5 3513 1 1 43 CYS O O 2.720 4.568 -1.067 1.00 . A A . 43 CYS O 1 1 5 3514 1 1 43 CYS SG S 0.234 0.319 -0.974 1.00 . A A . 43 CYS SG 1 1 5 3515 1 1 44 THR C C 5.433 4.059 0.569 1.00 . A A . 44 THR C 1 1 5 3516 1 1 44 THR CA C 4.180 4.541 1.286 1.00 . A A . 44 THR CA 1 1 5 3517 1 1 44 THR CB C 4.409 4.449 2.794 1.00 . A A . 44 THR CB 1 1 5 3518 1 1 44 THR CG2 C 5.202 5.644 3.294 1.00 . A A . 44 THR CG2 1 1 5 3519 1 1 44 THR H H 2.847 3.006 1.614 1.00 . A A . 44 THR H 1 1 5 3520 1 1 44 THR HA H 3.952 5.564 1.031 1.00 . A A . 44 THR HA 1 1 5 3521 1 1 44 THR HB H 4.951 3.540 3.010 1.00 . A A . 44 THR HB 1 1 5 3522 1 1 44 THR HG1 H 2.684 5.267 3.425 1.00 . A A . 44 THR HG1 1 1 5 3523 1 1 44 THR HG21 H 5.329 5.574 4.364 1.00 . A A . 44 THR HG21 1 1 5 3524 1 1 44 THR HG22 H 4.674 6.553 3.048 1.00 . A A . 44 THR HG22 1 1 5 3525 1 1 44 THR HG23 H 6.171 5.655 2.817 1.00 . A A . 44 THR HG23 1 1 5 3526 1 1 44 THR N N 3.094 3.689 0.951 1.00 . A A . 44 THR N 1 1 5 3527 1 1 44 THR O O 5.967 2.982 0.880 1.00 . A A . 44 THR O 1 1 5 3528 1 1 44 THR OG1 O 3.132 4.405 3.456 1.00 . A A . 44 THR OG1 1 1 5 3529 1 1 45 LYS C C 8.107 5.528 -0.992 1.00 . A A . 45 LYS C 1 1 5 3530 1 1 45 LYS CA C 7.037 4.455 -1.146 1.00 . A A . 45 LYS CA 1 1 5 3531 1 1 45 LYS CB C 6.695 4.122 -2.620 1.00 . A A . 45 LYS CB 1 1 5 3532 1 1 45 LYS CD C 5.568 4.757 -4.806 1.00 . A A . 45 LYS CD 1 1 5 3533 1 1 45 LYS CE C 4.556 3.603 -4.791 1.00 . A A . 45 LYS CE 1 1 5 3534 1 1 45 LYS CG C 5.957 5.206 -3.392 1.00 . A A . 45 LYS CG 1 1 5 3535 1 1 45 LYS H H 5.410 5.644 -0.653 1.00 . A A . 45 LYS H 1 1 5 3536 1 1 45 LYS HA H 7.420 3.562 -0.672 1.00 . A A . 45 LYS HA 1 1 5 3537 1 1 45 LYS HB2 H 7.616 3.918 -3.143 1.00 . A A . 45 LYS HB2 1 1 5 3538 1 1 45 LYS HB3 H 6.087 3.231 -2.624 1.00 . A A . 45 LYS HB3 1 1 5 3539 1 1 45 LYS HD2 H 5.137 5.592 -5.337 1.00 . A A . 45 LYS HD2 1 1 5 3540 1 1 45 LYS HD3 H 6.460 4.434 -5.324 1.00 . A A . 45 LYS HD3 1 1 5 3541 1 1 45 LYS HE2 H 5.013 2.743 -4.326 1.00 . A A . 45 LYS HE2 1 1 5 3542 1 1 45 LYS HE3 H 3.690 3.902 -4.220 1.00 . A A . 45 LYS HE3 1 1 5 3543 1 1 45 LYS HG2 H 5.060 5.467 -2.852 1.00 . A A . 45 LYS HG2 1 1 5 3544 1 1 45 LYS HG3 H 6.596 6.076 -3.463 1.00 . A A . 45 LYS HG3 1 1 5 3545 1 1 45 LYS HZ1 H 3.476 2.406 -6.141 1.00 . A A . 45 LYS HZ1 1 1 5 3546 1 1 45 LYS HZ2 H 4.954 2.948 -6.729 1.00 . A A . 45 LYS HZ2 1 1 5 3547 1 1 45 LYS HZ3 H 3.653 4.011 -6.636 1.00 . A A . 45 LYS HZ3 1 1 5 3548 1 1 45 LYS N N 5.867 4.807 -0.408 1.00 . A A . 45 LYS N 1 1 5 3549 1 1 45 LYS NZ N 4.127 3.217 -6.157 1.00 . A A . 45 LYS NZ 1 1 5 3550 1 1 45 LYS O O 7.860 6.580 -0.390 1.00 . A A . 45 LYS O 1 1 5 3551 1 1 46 ASN C C 10.640 6.946 -2.585 1.00 . A A . 46 ASN C 1 1 5 3552 1 1 46 ASN CA C 10.409 6.152 -1.336 1.00 . A A . 46 ASN CA 1 1 5 3553 1 1 46 ASN CB C 11.697 5.388 -0.964 1.00 . A A . 46 ASN CB 1 1 5 3554 1 1 46 ASN CG C 11.668 4.796 0.433 1.00 . A A . 46 ASN CG 1 1 5 3555 1 1 46 ASN H H 9.407 4.431 -1.999 1.00 . A A . 46 ASN H 1 1 5 3556 1 1 46 ASN HA H 10.180 6.834 -0.530 1.00 . A A . 46 ASN HA 1 1 5 3557 1 1 46 ASN HB2 H 11.843 4.581 -1.666 1.00 . A A . 46 ASN HB2 1 1 5 3558 1 1 46 ASN HB3 H 12.535 6.066 -1.031 1.00 . A A . 46 ASN HB3 1 1 5 3559 1 1 46 ASN HD21 H 12.803 3.272 -0.132 1.00 . A A . 46 ASN HD21 1 1 5 3560 1 1 46 ASN HD22 H 12.322 3.287 1.516 1.00 . A A . 46 ASN HD22 1 1 5 3561 1 1 46 ASN N N 9.281 5.254 -1.480 1.00 . A A . 46 ASN N 1 1 5 3562 1 1 46 ASN ND2 N 12.321 3.684 0.619 1.00 . A A . 46 ASN ND2 1 1 5 3563 1 1 46 ASN O O 10.778 6.387 -3.677 1.00 . A A . 46 ASN O 1 1 5 3564 1 1 46 ASN OD1 O 11.054 5.343 1.345 1.00 . A A . 46 ASN OD1 1 1 5 3565 1 1 47 CYS C C 12.158 9.979 -3.092 1.00 . A A . 47 CYS C 1 1 5 3566 1 1 47 CYS CA C 10.993 9.112 -3.524 1.00 . A A . 47 CYS CA 1 1 5 3567 1 1 47 CYS CB C 9.781 9.972 -3.943 1.00 . A A . 47 CYS CB 1 1 5 3568 1 1 47 CYS H H 10.484 8.621 -1.557 1.00 . A A . 47 CYS H 1 1 5 3569 1 1 47 CYS HA H 11.311 8.502 -4.358 1.00 . A A . 47 CYS HA 1 1 5 3570 1 1 47 CYS HB2 H 9.360 10.433 -3.062 1.00 . A A . 47 CYS HB2 1 1 5 3571 1 1 47 CYS HB3 H 10.114 10.746 -4.619 1.00 . A A . 47 CYS HB3 1 1 5 3572 1 1 47 CYS N N 10.669 8.226 -2.440 1.00 . A A . 47 CYS N 1 1 5 3573 1 1 47 CYS O O 11.978 11.185 -2.853 1.00 . A A . 47 CYS O 1 1 5 3574 1 1 47 CYS OXT O 13.265 9.422 -2.896 1.00 . A A . 47 CYS OXT 1 1 5 3575 1 1 47 CYS SG S 8.426 9.054 -4.766 1.00 . A A . 47 CYS SG 1 1 6 3576 1 1 1 LYS C C 10.522 9.957 1.952 1.00 . A A . 1 LYS C 1 1 6 3577 1 1 1 LYS CA C 11.383 11.083 2.434 1.00 . A A . 1 LYS CA 1 1 6 3578 1 1 1 LYS CB C 10.779 12.415 2.000 1.00 . A A . 1 LYS CB 1 1 6 3579 1 1 1 LYS CD C 10.712 14.886 2.193 1.00 . A A . 1 LYS CD 1 1 6 3580 1 1 1 LYS CE C 11.318 16.120 2.831 1.00 . A A . 1 LYS CE 1 1 6 3581 1 1 1 LYS CG C 11.409 13.618 2.639 1.00 . A A . 1 LYS CG 1 1 6 3582 1 1 1 LYS H1 H 12.736 10.871 0.888 1.00 . A A . 1 LYS H1 1 1 6 3583 1 1 1 LYS H2 H 13.115 10.013 2.279 1.00 . A A . 1 LYS H2 1 1 6 3584 1 1 1 LYS H3 H 13.383 11.677 2.239 1.00 . A A . 1 LYS H3 1 1 6 3585 1 1 1 LYS HA H 11.417 11.044 3.513 1.00 . A A . 1 LYS HA 1 1 6 3586 1 1 1 LYS HB2 H 10.902 12.507 0.933 1.00 . A A . 1 LYS HB2 1 1 6 3587 1 1 1 LYS HB3 H 9.724 12.418 2.230 1.00 . A A . 1 LYS HB3 1 1 6 3588 1 1 1 LYS HD2 H 10.776 14.970 1.119 1.00 . A A . 1 LYS HD2 1 1 6 3589 1 1 1 LYS HD3 H 9.676 14.811 2.485 1.00 . A A . 1 LYS HD3 1 1 6 3590 1 1 1 LYS HE2 H 11.230 16.027 3.902 1.00 . A A . 1 LYS HE2 1 1 6 3591 1 1 1 LYS HE3 H 12.361 16.184 2.555 1.00 . A A . 1 LYS HE3 1 1 6 3592 1 1 1 LYS HG2 H 11.342 13.523 3.713 1.00 . A A . 1 LYS HG2 1 1 6 3593 1 1 1 LYS HG3 H 12.440 13.638 2.334 1.00 . A A . 1 LYS HG3 1 1 6 3594 1 1 1 LYS HZ1 H 9.626 17.350 2.692 1.00 . A A . 1 LYS HZ1 1 1 6 3595 1 1 1 LYS HZ2 H 10.680 17.510 1.389 1.00 . A A . 1 LYS HZ2 1 1 6 3596 1 1 1 LYS HZ3 H 11.077 18.183 2.878 1.00 . A A . 1 LYS HZ3 1 1 6 3597 1 1 1 LYS N N 12.744 10.920 1.932 1.00 . A A . 1 LYS N 1 1 6 3598 1 1 1 LYS NZ N 10.628 17.365 2.416 1.00 . A A . 1 LYS NZ 1 1 6 3599 1 1 1 LYS O O 11.009 9.006 1.341 1.00 . A A . 1 LYS O 1 1 6 3600 1 1 2 THR C C 7.217 9.664 0.950 1.00 . A A . 2 THR C 1 1 6 3601 1 1 2 THR CA C 8.311 9.064 1.825 1.00 . A A . 2 THR CA 1 1 6 3602 1 1 2 THR CB C 7.719 8.379 3.066 1.00 . A A . 2 THR CB 1 1 6 3603 1 1 2 THR CG2 C 8.656 7.300 3.580 1.00 . A A . 2 THR CG2 1 1 6 3604 1 1 2 THR H H 8.932 10.842 2.709 1.00 . A A . 2 THR H 1 1 6 3605 1 1 2 THR HA H 8.841 8.320 1.248 1.00 . A A . 2 THR HA 1 1 6 3606 1 1 2 THR HB H 6.776 7.931 2.792 1.00 . A A . 2 THR HB 1 1 6 3607 1 1 2 THR HG1 H 6.568 9.294 4.384 1.00 . A A . 2 THR HG1 1 1 6 3608 1 1 2 THR HG21 H 9.605 7.742 3.845 1.00 . A A . 2 THR HG21 1 1 6 3609 1 1 2 THR HG22 H 8.812 6.561 2.806 1.00 . A A . 2 THR HG22 1 1 6 3610 1 1 2 THR HG23 H 8.224 6.825 4.448 1.00 . A A . 2 THR HG23 1 1 6 3611 1 1 2 THR N N 9.262 10.058 2.217 1.00 . A A . 2 THR N 1 1 6 3612 1 1 2 THR O O 6.867 10.845 1.090 1.00 . A A . 2 THR O 1 1 6 3613 1 1 2 THR OG1 O 7.487 9.361 4.099 1.00 . A A . 2 THR OG1 1 1 6 3614 1 1 3 CYS C C 4.542 8.329 -0.818 1.00 . A A . 3 CYS C 1 1 6 3615 1 1 3 CYS CA C 5.699 9.301 -0.880 1.00 . A A . 3 CYS CA 1 1 6 3616 1 1 3 CYS CB C 6.252 9.332 -2.297 1.00 . A A . 3 CYS CB 1 1 6 3617 1 1 3 CYS H H 7.076 7.961 -0.064 1.00 . A A . 3 CYS H 1 1 6 3618 1 1 3 CYS HA H 5.371 10.293 -0.609 1.00 . A A . 3 CYS HA 1 1 6 3619 1 1 3 CYS HB2 H 6.522 8.328 -2.589 1.00 . A A . 3 CYS HB2 1 1 6 3620 1 1 3 CYS HB3 H 5.491 9.699 -2.967 1.00 . A A . 3 CYS HB3 1 1 6 3621 1 1 3 CYS N N 6.730 8.878 0.029 1.00 . A A . 3 CYS N 1 1 6 3622 1 1 3 CYS O O 4.732 7.123 -0.978 1.00 . A A . 3 CYS O 1 1 6 3623 1 1 3 CYS SG S 7.727 10.372 -2.513 1.00 . A A . 3 CYS SG 1 1 6 3624 1 1 4 GLU C C 1.585 7.990 -1.915 1.00 . A A . 4 GLU C 1 1 6 3625 1 1 4 GLU CA C 2.184 8.036 -0.505 1.00 . A A . 4 GLU CA 1 1 6 3626 1 1 4 GLU CB C 1.224 8.688 0.495 1.00 . A A . 4 GLU CB 1 1 6 3627 1 1 4 GLU CD C -0.867 8.588 1.852 1.00 . A A . 4 GLU CD 1 1 6 3628 1 1 4 GLU CG C -0.016 7.898 0.819 1.00 . A A . 4 GLU CG 1 1 6 3629 1 1 4 GLU H H 3.290 9.802 -0.415 1.00 . A A . 4 GLU H 1 1 6 3630 1 1 4 GLU HA H 2.441 7.040 -0.176 1.00 . A A . 4 GLU HA 1 1 6 3631 1 1 4 GLU HB2 H 1.754 8.857 1.421 1.00 . A A . 4 GLU HB2 1 1 6 3632 1 1 4 GLU HB3 H 0.921 9.646 0.097 1.00 . A A . 4 GLU HB3 1 1 6 3633 1 1 4 GLU HG2 H -0.593 7.806 -0.089 1.00 . A A . 4 GLU HG2 1 1 6 3634 1 1 4 GLU HG3 H 0.266 6.922 1.184 1.00 . A A . 4 GLU HG3 1 1 6 3635 1 1 4 GLU N N 3.375 8.836 -0.566 1.00 . A A . 4 GLU N 1 1 6 3636 1 1 4 GLU O O 1.087 9.002 -2.418 1.00 . A A . 4 GLU O 1 1 6 3637 1 1 4 GLU OE1 O -0.419 8.737 2.996 1.00 . A A . 4 GLU OE1 1 1 6 3638 1 1 4 GLU OE2 O -2.013 8.989 1.545 1.00 . A A . 4 GLU OE2 1 1 6 3639 1 1 5 ASN C C 0.401 5.423 -4.096 1.00 . A A . 5 ASN C 1 1 6 3640 1 1 5 ASN CA C 1.232 6.689 -3.945 1.00 . A A . 5 ASN CA 1 1 6 3641 1 1 5 ASN CB C 2.481 6.629 -4.857 1.00 . A A . 5 ASN CB 1 1 6 3642 1 1 5 ASN CG C 2.167 6.497 -6.344 1.00 . A A . 5 ASN CG 1 1 6 3643 1 1 5 ASN H H 2.007 6.045 -2.084 1.00 . A A . 5 ASN H 1 1 6 3644 1 1 5 ASN HA H 0.636 7.545 -4.220 1.00 . A A . 5 ASN HA 1 1 6 3645 1 1 5 ASN HB2 H 3.057 7.533 -4.720 1.00 . A A . 5 ASN HB2 1 1 6 3646 1 1 5 ASN HB3 H 3.086 5.785 -4.559 1.00 . A A . 5 ASN HB3 1 1 6 3647 1 1 5 ASN HD21 H 2.261 4.513 -6.246 1.00 . A A . 5 ASN HD21 1 1 6 3648 1 1 5 ASN HD22 H 1.902 5.159 -7.785 1.00 . A A . 5 ASN HD22 1 1 6 3649 1 1 5 ASN N N 1.662 6.840 -2.553 1.00 . A A . 5 ASN N 1 1 6 3650 1 1 5 ASN ND2 N 2.109 5.284 -6.832 1.00 . A A . 5 ASN ND2 1 1 6 3651 1 1 5 ASN O O 0.606 4.471 -3.364 1.00 . A A . 5 ASN O 1 1 6 3652 1 1 5 ASN OD1 O 1.999 7.493 -7.046 1.00 . A A . 5 ASN OD1 1 1 6 3653 1 1 6 LEU C C -0.671 3.007 -5.631 1.00 . A A . 6 LEU C 1 1 6 3654 1 1 6 LEU CA C -1.408 4.281 -5.252 1.00 . A A . 6 LEU CA 1 1 6 3655 1 1 6 LEU CB C -2.486 4.598 -6.285 1.00 . A A . 6 LEU CB 1 1 6 3656 1 1 6 LEU CD1 C -4.505 5.891 -6.952 1.00 . A A . 6 LEU CD1 1 1 6 3657 1 1 6 LEU CD2 C -4.377 4.906 -4.721 1.00 . A A . 6 LEU CD2 1 1 6 3658 1 1 6 LEU CG C -3.582 5.549 -5.820 1.00 . A A . 6 LEU CG 1 1 6 3659 1 1 6 LEU H H -0.633 6.206 -5.612 1.00 . A A . 6 LEU H 1 1 6 3660 1 1 6 LEU HA H -1.902 4.088 -4.312 1.00 . A A . 6 LEU HA 1 1 6 3661 1 1 6 LEU HB2 H -2.006 5.028 -7.151 1.00 . A A . 6 LEU HB2 1 1 6 3662 1 1 6 LEU HB3 H -2.951 3.670 -6.581 1.00 . A A . 6 LEU HB3 1 1 6 3663 1 1 6 LEU HD11 H -4.977 4.989 -7.310 1.00 . A A . 6 LEU HD11 1 1 6 3664 1 1 6 LEU HD12 H -3.942 6.352 -7.750 1.00 . A A . 6 LEU HD12 1 1 6 3665 1 1 6 LEU HD13 H -5.261 6.571 -6.591 1.00 . A A . 6 LEU HD13 1 1 6 3666 1 1 6 LEU HD21 H -4.772 3.965 -5.072 1.00 . A A . 6 LEU HD21 1 1 6 3667 1 1 6 LEU HD22 H -5.195 5.558 -4.450 1.00 . A A . 6 LEU HD22 1 1 6 3668 1 1 6 LEU HD23 H -3.757 4.739 -3.853 1.00 . A A . 6 LEU HD23 1 1 6 3669 1 1 6 LEU HG H -3.148 6.458 -5.430 1.00 . A A . 6 LEU HG 1 1 6 3670 1 1 6 LEU N N -0.529 5.423 -5.030 1.00 . A A . 6 LEU N 1 1 6 3671 1 1 6 LEU O O 0.297 3.020 -6.411 1.00 . A A . 6 LEU O 1 1 6 3672 1 1 7 ALA C C -1.033 0.197 -6.713 1.00 . A A . 7 ALA C 1 1 6 3673 1 1 7 ALA CA C -0.592 0.612 -5.323 1.00 . A A . 7 ALA CA 1 1 6 3674 1 1 7 ALA CB C -1.097 -0.367 -4.289 1.00 . A A . 7 ALA CB 1 1 6 3675 1 1 7 ALA H H -1.850 2.017 -4.394 1.00 . A A . 7 ALA H 1 1 6 3676 1 1 7 ALA HA H 0.486 0.653 -5.279 1.00 . A A . 7 ALA HA 1 1 6 3677 1 1 7 ALA HB1 H -0.780 -0.036 -3.310 1.00 . A A . 7 ALA HB1 1 1 6 3678 1 1 7 ALA HB2 H -0.699 -1.352 -4.489 1.00 . A A . 7 ALA HB2 1 1 6 3679 1 1 7 ALA HB3 H -2.176 -0.394 -4.322 1.00 . A A . 7 ALA HB3 1 1 6 3680 1 1 7 ALA N N -1.119 1.922 -5.044 1.00 . A A . 7 ALA N 1 1 6 3681 1 1 7 ALA O O -2.193 0.434 -7.100 1.00 . A A . 7 ALA O 1 1 6 3682 1 1 8 ASP C C -0.830 -2.191 -8.989 1.00 . A A . 8 ASP C 1 1 6 3683 1 1 8 ASP CA C -0.435 -0.749 -8.833 1.00 . A A . 8 ASP CA 1 1 6 3684 1 1 8 ASP CB C 0.747 -0.421 -9.752 1.00 . A A . 8 ASP CB 1 1 6 3685 1 1 8 ASP CG C 0.487 -0.809 -11.200 1.00 . A A . 8 ASP CG 1 1 6 3686 1 1 8 ASP H H 0.713 -0.705 -7.063 1.00 . A A . 8 ASP H 1 1 6 3687 1 1 8 ASP HA H -1.273 -0.139 -9.136 1.00 . A A . 8 ASP HA 1 1 6 3688 1 1 8 ASP HB2 H 0.945 0.640 -9.712 1.00 . A A . 8 ASP HB2 1 1 6 3689 1 1 8 ASP HB3 H 1.616 -0.958 -9.404 1.00 . A A . 8 ASP HB3 1 1 6 3690 1 1 8 ASP N N -0.146 -0.419 -7.453 1.00 . A A . 8 ASP N 1 1 6 3691 1 1 8 ASP O O -1.835 -2.491 -9.622 1.00 . A A . 8 ASP O 1 1 6 3692 1 1 8 ASP OD1 O -0.188 -0.046 -11.932 1.00 . A A . 8 ASP OD1 1 1 6 3693 1 1 8 ASP OD2 O 0.967 -1.874 -11.641 1.00 . A A . 8 ASP OD2 1 1 6 3694 1 1 9 THR C C -1.553 -4.902 -7.685 1.00 . A A . 9 THR C 1 1 6 3695 1 1 9 THR CA C -0.348 -4.485 -8.545 1.00 . A A . 9 THR CA 1 1 6 3696 1 1 9 THR CB C 0.882 -5.315 -8.176 1.00 . A A . 9 THR CB 1 1 6 3697 1 1 9 THR CG2 C 0.755 -6.698 -8.738 1.00 . A A . 9 THR CG2 1 1 6 3698 1 1 9 THR H H 0.711 -2.842 -7.852 1.00 . A A . 9 THR H 1 1 6 3699 1 1 9 THR HA H -0.582 -4.663 -9.584 1.00 . A A . 9 THR HA 1 1 6 3700 1 1 9 THR HB H 0.981 -5.370 -7.103 1.00 . A A . 9 THR HB 1 1 6 3701 1 1 9 THR HG1 H 2.458 -4.244 -8.001 1.00 . A A . 9 THR HG1 1 1 6 3702 1 1 9 THR HG21 H 1.618 -7.276 -8.450 1.00 . A A . 9 THR HG21 1 1 6 3703 1 1 9 THR HG22 H 0.697 -6.617 -9.812 1.00 . A A . 9 THR HG22 1 1 6 3704 1 1 9 THR HG23 H -0.145 -7.145 -8.349 1.00 . A A . 9 THR HG23 1 1 6 3705 1 1 9 THR N N -0.071 -3.090 -8.397 1.00 . A A . 9 THR N 1 1 6 3706 1 1 9 THR O O -2.199 -5.926 -7.950 1.00 . A A . 9 THR O 1 1 6 3707 1 1 9 THR OG1 O 2.051 -4.708 -8.758 1.00 . A A . 9 THR OG1 1 1 6 3708 1 1 10 TYR C C -4.267 -4.045 -6.571 1.00 . A A . 10 TYR C 1 1 6 3709 1 1 10 TYR CA C -2.992 -4.372 -5.816 1.00 . A A . 10 TYR CA 1 1 6 3710 1 1 10 TYR CB C -2.906 -3.552 -4.517 1.00 . A A . 10 TYR CB 1 1 6 3711 1 1 10 TYR CD1 C -3.859 -4.817 -2.536 1.00 . A A . 10 TYR CD1 1 1 6 3712 1 1 10 TYR CD2 C -5.211 -3.141 -3.546 1.00 . A A . 10 TYR CD2 1 1 6 3713 1 1 10 TYR CE1 C -4.864 -5.080 -1.623 1.00 . A A . 10 TYR CE1 1 1 6 3714 1 1 10 TYR CE2 C -6.218 -3.397 -2.645 1.00 . A A . 10 TYR CE2 1 1 6 3715 1 1 10 TYR CG C -4.014 -3.843 -3.513 1.00 . A A . 10 TYR CG 1 1 6 3716 1 1 10 TYR CZ C -6.045 -4.365 -1.686 1.00 . A A . 10 TYR CZ 1 1 6 3717 1 1 10 TYR H H -1.313 -3.307 -6.526 1.00 . A A . 10 TYR H 1 1 6 3718 1 1 10 TYR HA H -2.979 -5.426 -5.579 1.00 . A A . 10 TYR HA 1 1 6 3719 1 1 10 TYR HB2 H -1.963 -3.759 -4.032 1.00 . A A . 10 TYR HB2 1 1 6 3720 1 1 10 TYR HB3 H -2.950 -2.502 -4.767 1.00 . A A . 10 TYR HB3 1 1 6 3721 1 1 10 TYR HD1 H -2.935 -5.375 -2.494 1.00 . A A . 10 TYR HD1 1 1 6 3722 1 1 10 TYR HD2 H -5.347 -2.381 -4.301 1.00 . A A . 10 TYR HD2 1 1 6 3723 1 1 10 TYR HE1 H -4.713 -5.842 -0.872 1.00 . A A . 10 TYR HE1 1 1 6 3724 1 1 10 TYR HE2 H -7.137 -2.833 -2.704 1.00 . A A . 10 TYR HE2 1 1 6 3725 1 1 10 TYR HH H -7.893 -4.509 -1.246 1.00 . A A . 10 TYR HH 1 1 6 3726 1 1 10 TYR N N -1.860 -4.104 -6.677 1.00 . A A . 10 TYR N 1 1 6 3727 1 1 10 TYR O O -4.398 -2.959 -7.142 1.00 . A A . 10 TYR O 1 1 6 3728 1 1 10 TYR OH O -7.050 -4.610 -0.781 1.00 . A A . 10 TYR OH 1 1 6 3729 1 1 11 LYS C C -7.582 -4.832 -6.362 1.00 . A A . 11 LYS C 1 1 6 3730 1 1 11 LYS CA C -6.419 -4.816 -7.314 1.00 . A A . 11 LYS CA 1 1 6 3731 1 1 11 LYS CB C -6.571 -5.933 -8.332 1.00 . A A . 11 LYS CB 1 1 6 3732 1 1 11 LYS CD C -5.538 -7.174 -10.259 1.00 . A A . 11 LYS CD 1 1 6 3733 1 1 11 LYS CE C -5.176 -8.389 -9.415 1.00 . A A . 11 LYS CE 1 1 6 3734 1 1 11 LYS CG C -5.519 -5.909 -9.424 1.00 . A A . 11 LYS CG 1 1 6 3735 1 1 11 LYS H H -5.019 -5.813 -6.111 1.00 . A A . 11 LYS H 1 1 6 3736 1 1 11 LYS HA H -6.396 -3.874 -7.840 1.00 . A A . 11 LYS HA 1 1 6 3737 1 1 11 LYS HB2 H -6.507 -6.874 -7.808 1.00 . A A . 11 LYS HB2 1 1 6 3738 1 1 11 LYS HB3 H -7.544 -5.854 -8.793 1.00 . A A . 11 LYS HB3 1 1 6 3739 1 1 11 LYS HD2 H -6.532 -7.309 -10.660 1.00 . A A . 11 LYS HD2 1 1 6 3740 1 1 11 LYS HD3 H -4.831 -7.079 -11.070 1.00 . A A . 11 LYS HD3 1 1 6 3741 1 1 11 LYS HE2 H -4.272 -8.179 -8.866 1.00 . A A . 11 LYS HE2 1 1 6 3742 1 1 11 LYS HE3 H -5.978 -8.585 -8.718 1.00 . A A . 11 LYS HE3 1 1 6 3743 1 1 11 LYS HG2 H -5.703 -5.063 -10.070 1.00 . A A . 11 LYS HG2 1 1 6 3744 1 1 11 LYS HG3 H -4.546 -5.803 -8.965 1.00 . A A . 11 LYS HG3 1 1 6 3745 1 1 11 LYS HZ1 H -4.716 -10.403 -9.639 1.00 . A A . 11 LYS HZ1 1 1 6 3746 1 1 11 LYS HZ2 H -4.170 -9.439 -10.890 1.00 . A A . 11 LYS HZ2 1 1 6 3747 1 1 11 LYS HZ3 H -5.817 -9.830 -10.780 1.00 . A A . 11 LYS HZ3 1 1 6 3748 1 1 11 LYS N N -5.176 -4.976 -6.600 1.00 . A A . 11 LYS N 1 1 6 3749 1 1 11 LYS NZ N -4.965 -9.589 -10.237 1.00 . A A . 11 LYS NZ 1 1 6 3750 1 1 11 LYS O O -7.607 -5.624 -5.412 1.00 . A A . 11 LYS O 1 1 6 3751 1 1 12 GLY C C -9.580 -2.849 -4.721 1.00 . A A . 12 GLY C 1 1 6 3752 1 1 12 GLY CA C -9.703 -3.903 -5.796 1.00 . A A . 12 GLY CA 1 1 6 3753 1 1 12 GLY H H -8.432 -3.338 -7.353 1.00 . A A . 12 GLY H 1 1 6 3754 1 1 12 GLY HA2 H -10.550 -3.670 -6.425 1.00 . A A . 12 GLY HA2 1 1 6 3755 1 1 12 GLY HA3 H -9.863 -4.862 -5.327 1.00 . A A . 12 GLY HA3 1 1 6 3756 1 1 12 GLY N N -8.531 -3.969 -6.609 1.00 . A A . 12 GLY N 1 1 6 3757 1 1 12 GLY O O -8.585 -2.094 -4.689 1.00 . A A . 12 GLY O 1 1 6 3758 1 1 13 PRO C C -9.810 -2.419 -1.552 1.00 . A A . 13 PRO C 1 1 6 3759 1 1 13 PRO CA C -10.546 -1.809 -2.744 1.00 . A A . 13 PRO CA 1 1 6 3760 1 1 13 PRO CB C -12.034 -1.588 -2.390 1.00 . A A . 13 PRO CB 1 1 6 3761 1 1 13 PRO CD C -11.843 -3.467 -3.890 1.00 . A A . 13 PRO CD 1 1 6 3762 1 1 13 PRO CG C -12.818 -2.486 -3.303 1.00 . A A . 13 PRO CG 1 1 6 3763 1 1 13 PRO HA H -10.087 -0.869 -3.013 1.00 . A A . 13 PRO HA 1 1 6 3764 1 1 13 PRO HB2 H -12.194 -1.846 -1.354 1.00 . A A . 13 PRO HB2 1 1 6 3765 1 1 13 PRO HB3 H -12.292 -0.551 -2.543 1.00 . A A . 13 PRO HB3 1 1 6 3766 1 1 13 PRO HD2 H -11.786 -4.357 -3.279 1.00 . A A . 13 PRO HD2 1 1 6 3767 1 1 13 PRO HD3 H -12.116 -3.719 -4.904 1.00 . A A . 13 PRO HD3 1 1 6 3768 1 1 13 PRO HG2 H -13.575 -3.010 -2.738 1.00 . A A . 13 PRO HG2 1 1 6 3769 1 1 13 PRO HG3 H -13.279 -1.901 -4.084 1.00 . A A . 13 PRO HG3 1 1 6 3770 1 1 13 PRO N N -10.582 -2.729 -3.854 1.00 . A A . 13 PRO N 1 1 6 3771 1 1 13 PRO O O -9.530 -3.631 -1.519 1.00 . A A . 13 PRO O 1 1 6 3772 1 1 14 CYS C C -9.860 -2.493 1.603 1.00 . A A . 14 CYS C 1 1 6 3773 1 1 14 CYS CA C -8.836 -2.048 0.587 1.00 . A A . 14 CYS CA 1 1 6 3774 1 1 14 CYS CB C -7.960 -0.956 1.182 1.00 . A A . 14 CYS CB 1 1 6 3775 1 1 14 CYS H H -9.698 -0.645 -0.711 1.00 . A A . 14 CYS H 1 1 6 3776 1 1 14 CYS HA H -8.211 -2.889 0.328 1.00 . A A . 14 CYS HA 1 1 6 3777 1 1 14 CYS HB2 H -7.154 -0.733 0.498 1.00 . A A . 14 CYS HB2 1 1 6 3778 1 1 14 CYS HB3 H -8.557 -0.068 1.332 1.00 . A A . 14 CYS HB3 1 1 6 3779 1 1 14 CYS N N -9.488 -1.600 -0.603 1.00 . A A . 14 CYS N 1 1 6 3780 1 1 14 CYS O O -10.584 -1.668 2.183 1.00 . A A . 14 CYS O 1 1 6 3781 1 1 14 CYS SG S -7.225 -1.411 2.786 1.00 . A A . 14 CYS SG 1 1 6 3782 1 1 15 PHE C C -10.093 -4.479 4.066 1.00 . A A . 15 PHE C 1 1 6 3783 1 1 15 PHE CA C -10.855 -4.333 2.771 1.00 . A A . 15 PHE CA 1 1 6 3784 1 1 15 PHE CB C -11.381 -5.698 2.322 1.00 . A A . 15 PHE CB 1 1 6 3785 1 1 15 PHE CD1 C -11.457 -6.314 -0.106 1.00 . A A . 15 PHE CD1 1 1 6 3786 1 1 15 PHE CD2 C -13.246 -5.030 0.794 1.00 . A A . 15 PHE CD2 1 1 6 3787 1 1 15 PHE CE1 C -12.062 -6.294 -1.341 1.00 . A A . 15 PHE CE1 1 1 6 3788 1 1 15 PHE CE2 C -13.856 -5.006 -0.437 1.00 . A A . 15 PHE CE2 1 1 6 3789 1 1 15 PHE CG C -12.044 -5.683 0.977 1.00 . A A . 15 PHE CG 1 1 6 3790 1 1 15 PHE CZ C -13.264 -5.640 -1.506 1.00 . A A . 15 PHE CZ 1 1 6 3791 1 1 15 PHE H H -9.423 -4.392 1.234 1.00 . A A . 15 PHE H 1 1 6 3792 1 1 15 PHE HA H -11.682 -3.651 2.901 1.00 . A A . 15 PHE HA 1 1 6 3793 1 1 15 PHE HB2 H -10.560 -6.398 2.281 1.00 . A A . 15 PHE HB2 1 1 6 3794 1 1 15 PHE HB3 H -12.103 -6.047 3.047 1.00 . A A . 15 PHE HB3 1 1 6 3795 1 1 15 PHE HD1 H -10.516 -6.830 0.021 1.00 . A A . 15 PHE HD1 1 1 6 3796 1 1 15 PHE HD2 H -13.707 -4.530 1.633 1.00 . A A . 15 PHE HD2 1 1 6 3797 1 1 15 PHE HE1 H -11.595 -6.788 -2.180 1.00 . A A . 15 PHE HE1 1 1 6 3798 1 1 15 PHE HE2 H -14.797 -4.491 -0.563 1.00 . A A . 15 PHE HE2 1 1 6 3799 1 1 15 PHE HZ H -13.740 -5.622 -2.475 1.00 . A A . 15 PHE HZ 1 1 6 3800 1 1 15 PHE N N -9.963 -3.784 1.784 1.00 . A A . 15 PHE N 1 1 6 3801 1 1 15 PHE O O -10.477 -3.933 5.107 1.00 . A A . 15 PHE O 1 1 6 3802 1 1 16 THR C C -6.863 -4.605 4.876 1.00 . A A . 16 THR C 1 1 6 3803 1 1 16 THR CA C -8.136 -5.413 5.095 1.00 . A A . 16 THR CA 1 1 6 3804 1 1 16 THR CB C -7.790 -6.905 5.186 1.00 . A A . 16 THR CB 1 1 6 3805 1 1 16 THR CG2 C -7.148 -7.240 6.526 1.00 . A A . 16 THR CG2 1 1 6 3806 1 1 16 THR H H -8.732 -5.586 3.121 1.00 . A A . 16 THR H 1 1 6 3807 1 1 16 THR HA H -8.629 -5.100 6.002 1.00 . A A . 16 THR HA 1 1 6 3808 1 1 16 THR HB H -7.099 -7.132 4.389 1.00 . A A . 16 THR HB 1 1 6 3809 1 1 16 THR HG1 H -9.731 -7.074 5.237 1.00 . A A . 16 THR HG1 1 1 6 3810 1 1 16 THR HG21 H -6.240 -6.666 6.642 1.00 . A A . 16 THR HG21 1 1 6 3811 1 1 16 THR HG22 H -6.914 -8.293 6.560 1.00 . A A . 16 THR HG22 1 1 6 3812 1 1 16 THR HG23 H -7.830 -6.999 7.327 1.00 . A A . 16 THR HG23 1 1 6 3813 1 1 16 THR N N -8.994 -5.192 3.982 1.00 . A A . 16 THR N 1 1 6 3814 1 1 16 THR O O -6.062 -4.920 3.973 1.00 . A A . 16 THR O 1 1 6 3815 1 1 16 THR OG1 O -8.997 -7.670 5.037 1.00 . A A . 16 THR OG1 1 1 6 3816 1 1 17 THR C C -4.218 -3.433 5.712 1.00 . A A . 17 THR C 1 1 6 3817 1 1 17 THR CA C -5.541 -2.691 5.516 1.00 . A A . 17 THR CA 1 1 6 3818 1 1 17 THR CB C -5.630 -1.424 6.431 1.00 . A A . 17 THR CB 1 1 6 3819 1 1 17 THR CG2 C -5.598 -1.784 7.914 1.00 . A A . 17 THR CG2 1 1 6 3820 1 1 17 THR H H -7.326 -3.408 6.390 1.00 . A A . 17 THR H 1 1 6 3821 1 1 17 THR HA H -5.567 -2.366 4.487 1.00 . A A . 17 THR HA 1 1 6 3822 1 1 17 THR HB H -6.556 -0.914 6.209 1.00 . A A . 17 THR HB 1 1 6 3823 1 1 17 THR HG1 H -4.034 -0.916 5.418 1.00 . A A . 17 THR HG1 1 1 6 3824 1 1 17 THR HG21 H -6.439 -2.418 8.152 1.00 . A A . 17 THR HG21 1 1 6 3825 1 1 17 THR HG22 H -5.646 -0.884 8.508 1.00 . A A . 17 THR HG22 1 1 6 3826 1 1 17 THR HG23 H -4.680 -2.309 8.132 1.00 . A A . 17 THR HG23 1 1 6 3827 1 1 17 THR N N -6.673 -3.576 5.676 1.00 . A A . 17 THR N 1 1 6 3828 1 1 17 THR O O -3.229 -3.121 5.055 1.00 . A A . 17 THR O 1 1 6 3829 1 1 17 THR OG1 O -4.545 -0.530 6.142 1.00 . A A . 17 THR OG1 1 1 6 3830 1 1 18 GLY C C -2.624 -6.003 5.589 1.00 . A A . 18 GLY C 1 1 6 3831 1 1 18 GLY CA C -3.067 -5.242 6.818 1.00 . A A . 18 GLY CA 1 1 6 3832 1 1 18 GLY H H -5.061 -4.639 7.060 1.00 . A A . 18 GLY H 1 1 6 3833 1 1 18 GLY HA2 H -2.265 -4.599 7.150 1.00 . A A . 18 GLY HA2 1 1 6 3834 1 1 18 GLY HA3 H -3.302 -5.950 7.599 1.00 . A A . 18 GLY HA3 1 1 6 3835 1 1 18 GLY N N -4.234 -4.446 6.566 1.00 . A A . 18 GLY N 1 1 6 3836 1 1 18 GLY O O -1.432 -6.094 5.306 1.00 . A A . 18 GLY O 1 1 6 3837 1 1 19 SER C C -2.768 -6.307 2.551 1.00 . A A . 19 SER C 1 1 6 3838 1 1 19 SER CA C -3.288 -7.254 3.630 1.00 . A A . 19 SER CA 1 1 6 3839 1 1 19 SER CB C -4.531 -7.991 3.165 1.00 . A A . 19 SER CB 1 1 6 3840 1 1 19 SER H H -4.516 -6.422 5.110 1.00 . A A . 19 SER H 1 1 6 3841 1 1 19 SER HA H -2.513 -7.971 3.855 1.00 . A A . 19 SER HA 1 1 6 3842 1 1 19 SER HB2 H -5.288 -7.275 2.881 1.00 . A A . 19 SER HB2 1 1 6 3843 1 1 19 SER HB3 H -4.285 -8.617 2.320 1.00 . A A . 19 SER HB3 1 1 6 3844 1 1 19 SER HG H -4.286 -9.287 4.601 1.00 . A A . 19 SER HG 1 1 6 3845 1 1 19 SER N N -3.579 -6.522 4.842 1.00 . A A . 19 SER N 1 1 6 3846 1 1 19 SER O O -1.842 -6.648 1.811 1.00 . A A . 19 SER O 1 1 6 3847 1 1 19 SER OG O -5.035 -8.811 4.212 1.00 . A A . 19 SER OG 1 1 6 3848 1 1 20 CYS C C -1.452 -3.693 1.889 1.00 . A A . 20 CYS C 1 1 6 3849 1 1 20 CYS CA C -2.904 -4.071 1.572 1.00 . A A . 20 CYS CA 1 1 6 3850 1 1 20 CYS CB C -3.825 -2.849 1.702 1.00 . A A . 20 CYS CB 1 1 6 3851 1 1 20 CYS H H -4.110 -4.926 3.081 1.00 . A A . 20 CYS H 1 1 6 3852 1 1 20 CYS HA H -2.959 -4.459 0.566 1.00 . A A . 20 CYS HA 1 1 6 3853 1 1 20 CYS HB2 H -4.814 -3.112 1.358 1.00 . A A . 20 CYS HB2 1 1 6 3854 1 1 20 CYS HB3 H -3.879 -2.566 2.743 1.00 . A A . 20 CYS HB3 1 1 6 3855 1 1 20 CYS N N -3.347 -5.116 2.493 1.00 . A A . 20 CYS N 1 1 6 3856 1 1 20 CYS O O -0.580 -3.672 1.005 1.00 . A A . 20 CYS O 1 1 6 3857 1 1 20 CYS SG S -3.294 -1.396 0.762 1.00 . A A . 20 CYS SG 1 1 6 3858 1 1 21 ASP C C 1.121 -4.233 3.346 1.00 . A A . 21 ASP C 1 1 6 3859 1 1 21 ASP CA C 0.124 -3.144 3.688 1.00 . A A . 21 ASP CA 1 1 6 3860 1 1 21 ASP CB C 0.031 -2.941 5.205 1.00 . A A . 21 ASP CB 1 1 6 3861 1 1 21 ASP CG C 1.362 -2.754 5.878 1.00 . A A . 21 ASP CG 1 1 6 3862 1 1 21 ASP H H -1.931 -3.540 3.822 1.00 . A A . 21 ASP H 1 1 6 3863 1 1 21 ASP HA H 0.448 -2.220 3.234 1.00 . A A . 21 ASP HA 1 1 6 3864 1 1 21 ASP HB2 H -0.567 -2.065 5.407 1.00 . A A . 21 ASP HB2 1 1 6 3865 1 1 21 ASP HB3 H -0.456 -3.802 5.639 1.00 . A A . 21 ASP HB3 1 1 6 3866 1 1 21 ASP N N -1.196 -3.479 3.172 1.00 . A A . 21 ASP N 1 1 6 3867 1 1 21 ASP O O 2.205 -3.964 2.821 1.00 . A A . 21 ASP O 1 1 6 3868 1 1 21 ASP OD1 O 1.794 -3.682 6.614 1.00 . A A . 21 ASP OD1 1 1 6 3869 1 1 21 ASP OD2 O 1.998 -1.692 5.707 1.00 . A A . 21 ASP OD2 1 1 6 3870 1 1 22 ASP C C 1.834 -6.757 1.810 1.00 . A A . 22 ASP C 1 1 6 3871 1 1 22 ASP CA C 1.529 -6.642 3.299 1.00 . A A . 22 ASP CA 1 1 6 3872 1 1 22 ASP CB C 0.826 -7.907 3.781 1.00 . A A . 22 ASP CB 1 1 6 3873 1 1 22 ASP CG C 1.648 -9.163 3.555 1.00 . A A . 22 ASP CG 1 1 6 3874 1 1 22 ASP H H -0.179 -5.586 3.978 1.00 . A A . 22 ASP H 1 1 6 3875 1 1 22 ASP HA H 2.459 -6.536 3.837 1.00 . A A . 22 ASP HA 1 1 6 3876 1 1 22 ASP HB2 H 0.601 -7.799 4.831 1.00 . A A . 22 ASP HB2 1 1 6 3877 1 1 22 ASP HB3 H -0.104 -8.005 3.239 1.00 . A A . 22 ASP HB3 1 1 6 3878 1 1 22 ASP N N 0.712 -5.466 3.580 1.00 . A A . 22 ASP N 1 1 6 3879 1 1 22 ASP O O 2.974 -7.028 1.423 1.00 . A A . 22 ASP O 1 1 6 3880 1 1 22 ASP OD1 O 1.373 -9.901 2.587 1.00 . A A . 22 ASP OD1 1 1 6 3881 1 1 22 ASP OD2 O 2.582 -9.429 4.342 1.00 . A A . 22 ASP OD2 1 1 6 3882 1 1 23 HIS C C 1.987 -5.539 -0.931 1.00 . A A . 23 HIS C 1 1 6 3883 1 1 23 HIS CA C 0.988 -6.587 -0.468 1.00 . A A . 23 HIS CA 1 1 6 3884 1 1 23 HIS CB C -0.370 -6.413 -1.195 1.00 . A A . 23 HIS CB 1 1 6 3885 1 1 23 HIS CD2 C 0.011 -5.534 -3.616 1.00 . A A . 23 HIS CD2 1 1 6 3886 1 1 23 HIS CE1 C -0.371 -7.349 -4.726 1.00 . A A . 23 HIS CE1 1 1 6 3887 1 1 23 HIS CG C -0.290 -6.494 -2.705 1.00 . A A . 23 HIS CG 1 1 6 3888 1 1 23 HIS H H -0.056 -6.277 1.341 1.00 . A A . 23 HIS H 1 1 6 3889 1 1 23 HIS HA H 1.388 -7.563 -0.700 1.00 . A A . 23 HIS HA 1 1 6 3890 1 1 23 HIS HB2 H -1.050 -7.182 -0.865 1.00 . A A . 23 HIS HB2 1 1 6 3891 1 1 23 HIS HB3 H -0.780 -5.447 -0.936 1.00 . A A . 23 HIS HB3 1 1 6 3892 1 1 23 HIS HD1 H -0.778 -8.526 -3.102 1.00 . A A . 23 HIS HD1 1 1 6 3893 1 1 23 HIS HD2 H 0.249 -4.505 -3.388 1.00 . A A . 23 HIS HD2 1 1 6 3894 1 1 23 HIS HE1 H -0.497 -8.063 -5.526 1.00 . A A . 23 HIS HE1 1 1 6 3895 1 1 23 HIS N N 0.827 -6.515 0.977 1.00 . A A . 23 HIS N 1 1 6 3896 1 1 23 HIS ND1 N -0.531 -7.638 -3.436 1.00 . A A . 23 HIS ND1 1 1 6 3897 1 1 23 HIS NE2 N -0.040 -6.082 -4.892 1.00 . A A . 23 HIS NE2 1 1 6 3898 1 1 23 HIS O O 2.888 -5.832 -1.714 1.00 . A A . 23 HIS O 1 1 6 3899 1 1 24 CYS C C 4.172 -3.490 -0.297 1.00 . A A . 24 CYS C 1 1 6 3900 1 1 24 CYS CA C 2.750 -3.280 -0.803 1.00 . A A . 24 CYS CA 1 1 6 3901 1 1 24 CYS CB C 2.182 -1.907 -0.467 1.00 . A A . 24 CYS CB 1 1 6 3902 1 1 24 CYS H H 1.113 -4.145 0.191 1.00 . A A . 24 CYS H 1 1 6 3903 1 1 24 CYS HA H 2.799 -3.362 -1.879 1.00 . A A . 24 CYS HA 1 1 6 3904 1 1 24 CYS HB2 H 1.895 -1.882 0.573 1.00 . A A . 24 CYS HB2 1 1 6 3905 1 1 24 CYS HB3 H 2.931 -1.151 -0.658 1.00 . A A . 24 CYS HB3 1 1 6 3906 1 1 24 CYS N N 1.854 -4.339 -0.428 1.00 . A A . 24 CYS N 1 1 6 3907 1 1 24 CYS O O 5.119 -3.083 -0.944 1.00 . A A . 24 CYS O 1 1 6 3908 1 1 24 CYS SG S 0.720 -1.516 -1.479 1.00 . A A . 24 CYS SG 1 1 6 3909 1 1 25 LYS C C 6.294 -5.609 0.528 1.00 . A A . 25 LYS C 1 1 6 3910 1 1 25 LYS CA C 5.653 -4.479 1.335 1.00 . A A . 25 LYS CA 1 1 6 3911 1 1 25 LYS CB C 5.592 -4.863 2.811 1.00 . A A . 25 LYS CB 1 1 6 3912 1 1 25 LYS CD C 5.027 -4.172 5.146 1.00 . A A . 25 LYS CD 1 1 6 3913 1 1 25 LYS CE C 4.892 -2.999 6.092 1.00 . A A . 25 LYS CE 1 1 6 3914 1 1 25 LYS CG C 5.315 -3.699 3.736 1.00 . A A . 25 LYS CG 1 1 6 3915 1 1 25 LYS H H 3.531 -4.412 1.348 1.00 . A A . 25 LYS H 1 1 6 3916 1 1 25 LYS HA H 6.267 -3.596 1.232 1.00 . A A . 25 LYS HA 1 1 6 3917 1 1 25 LYS HB2 H 4.809 -5.595 2.946 1.00 . A A . 25 LYS HB2 1 1 6 3918 1 1 25 LYS HB3 H 6.536 -5.306 3.094 1.00 . A A . 25 LYS HB3 1 1 6 3919 1 1 25 LYS HD2 H 4.105 -4.733 5.149 1.00 . A A . 25 LYS HD2 1 1 6 3920 1 1 25 LYS HD3 H 5.839 -4.803 5.478 1.00 . A A . 25 LYS HD3 1 1 6 3921 1 1 25 LYS HE2 H 5.868 -2.565 6.255 1.00 . A A . 25 LYS HE2 1 1 6 3922 1 1 25 LYS HE3 H 4.248 -2.261 5.636 1.00 . A A . 25 LYS HE3 1 1 6 3923 1 1 25 LYS HG2 H 6.177 -3.048 3.752 1.00 . A A . 25 LYS HG2 1 1 6 3924 1 1 25 LYS HG3 H 4.458 -3.156 3.364 1.00 . A A . 25 LYS HG3 1 1 6 3925 1 1 25 LYS HZ1 H 3.332 -3.695 7.217 1.00 . A A . 25 LYS HZ1 1 1 6 3926 1 1 25 LYS HZ2 H 4.295 -2.584 8.040 1.00 . A A . 25 LYS HZ2 1 1 6 3927 1 1 25 LYS HZ3 H 4.836 -4.185 7.826 1.00 . A A . 25 LYS HZ3 1 1 6 3928 1 1 25 LYS N N 4.325 -4.154 0.829 1.00 . A A . 25 LYS N 1 1 6 3929 1 1 25 LYS NZ N 4.319 -3.395 7.393 1.00 . A A . 25 LYS NZ 1 1 6 3930 1 1 25 LYS O O 7.479 -5.552 0.190 1.00 . A A . 25 LYS O 1 1 6 3931 1 1 26 ASN C C 6.060 -7.637 -1.998 1.00 . A A . 26 ASN C 1 1 6 3932 1 1 26 ASN CA C 6.009 -7.787 -0.501 1.00 . A A . 26 ASN CA 1 1 6 3933 1 1 26 ASN CB C 5.224 -9.045 -0.137 1.00 . A A . 26 ASN CB 1 1 6 3934 1 1 26 ASN CG C 5.502 -9.530 1.261 1.00 . A A . 26 ASN CG 1 1 6 3935 1 1 26 ASN H H 4.548 -6.546 0.425 1.00 . A A . 26 ASN H 1 1 6 3936 1 1 26 ASN HA H 7.022 -7.927 -0.156 1.00 . A A . 26 ASN HA 1 1 6 3937 1 1 26 ASN HB2 H 4.166 -8.840 -0.218 1.00 . A A . 26 ASN HB2 1 1 6 3938 1 1 26 ASN HB3 H 5.486 -9.831 -0.828 1.00 . A A . 26 ASN HB3 1 1 6 3939 1 1 26 ASN HD21 H 4.045 -8.413 1.975 1.00 . A A . 26 ASN HD21 1 1 6 3940 1 1 26 ASN HD22 H 4.911 -9.359 3.124 1.00 . A A . 26 ASN HD22 1 1 6 3941 1 1 26 ASN N N 5.500 -6.603 0.192 1.00 . A A . 26 ASN N 1 1 6 3942 1 1 26 ASN ND2 N 4.753 -9.057 2.205 1.00 . A A . 26 ASN ND2 1 1 6 3943 1 1 26 ASN O O 7.128 -7.708 -2.583 1.00 . A A . 26 ASN O 1 1 6 3944 1 1 26 ASN OD1 O 6.395 -10.340 1.481 1.00 . A A . 26 ASN OD1 1 1 6 3945 1 1 27 LYS C C 5.296 -6.010 -4.590 1.00 . A A . 27 LYS C 1 1 6 3946 1 1 27 LYS CA C 4.850 -7.352 -4.058 1.00 . A A . 27 LYS CA 1 1 6 3947 1 1 27 LYS CB C 3.434 -7.688 -4.558 1.00 . A A . 27 LYS CB 1 1 6 3948 1 1 27 LYS CD C 4.243 -8.480 -6.816 1.00 . A A . 27 LYS CD 1 1 6 3949 1 1 27 LYS CE C 4.183 -8.285 -8.320 1.00 . A A . 27 LYS CE 1 1 6 3950 1 1 27 LYS CG C 3.265 -7.577 -6.077 1.00 . A A . 27 LYS CG 1 1 6 3951 1 1 27 LYS H H 4.109 -7.238 -2.090 1.00 . A A . 27 LYS H 1 1 6 3952 1 1 27 LYS HA H 5.527 -8.106 -4.429 1.00 . A A . 27 LYS HA 1 1 6 3953 1 1 27 LYS HB2 H 3.191 -8.696 -4.258 1.00 . A A . 27 LYS HB2 1 1 6 3954 1 1 27 LYS HB3 H 2.735 -7.011 -4.089 1.00 . A A . 27 LYS HB3 1 1 6 3955 1 1 27 LYS HD2 H 5.242 -8.246 -6.484 1.00 . A A . 27 LYS HD2 1 1 6 3956 1 1 27 LYS HD3 H 4.014 -9.509 -6.581 1.00 . A A . 27 LYS HD3 1 1 6 3957 1 1 27 LYS HE2 H 4.883 -8.970 -8.777 1.00 . A A . 27 LYS HE2 1 1 6 3958 1 1 27 LYS HE3 H 3.186 -8.523 -8.656 1.00 . A A . 27 LYS HE3 1 1 6 3959 1 1 27 LYS HG2 H 2.257 -7.864 -6.339 1.00 . A A . 27 LYS HG2 1 1 6 3960 1 1 27 LYS HG3 H 3.437 -6.553 -6.373 1.00 . A A . 27 LYS HG3 1 1 6 3961 1 1 27 LYS HZ1 H 3.864 -6.180 -8.390 1.00 . A A . 27 LYS HZ1 1 1 6 3962 1 1 27 LYS HZ2 H 4.547 -6.829 -9.780 1.00 . A A . 27 LYS HZ2 1 1 6 3963 1 1 27 LYS HZ3 H 5.487 -6.630 -8.435 1.00 . A A . 27 LYS HZ3 1 1 6 3964 1 1 27 LYS N N 4.925 -7.403 -2.612 1.00 . A A . 27 LYS N 1 1 6 3965 1 1 27 LYS NZ N 4.530 -6.897 -8.741 1.00 . A A . 27 LYS NZ 1 1 6 3966 1 1 27 LYS O O 6.068 -5.937 -5.548 1.00 . A A . 27 LYS O 1 1 6 3967 1 1 28 GLU C C 6.587 -3.238 -4.006 1.00 . A A . 28 GLU C 1 1 6 3968 1 1 28 GLU CA C 5.186 -3.634 -4.453 1.00 . A A . 28 GLU CA 1 1 6 3969 1 1 28 GLU CB C 4.144 -2.589 -4.030 1.00 . A A . 28 GLU CB 1 1 6 3970 1 1 28 GLU CD C 2.576 -2.978 -5.980 1.00 . A A . 28 GLU CD 1 1 6 3971 1 1 28 GLU CG C 2.717 -2.912 -4.478 1.00 . A A . 28 GLU CG 1 1 6 3972 1 1 28 GLU H H 4.244 -5.083 -3.206 1.00 . A A . 28 GLU H 1 1 6 3973 1 1 28 GLU HA H 5.193 -3.696 -5.531 1.00 . A A . 28 GLU HA 1 1 6 3974 1 1 28 GLU HB2 H 4.168 -2.477 -2.957 1.00 . A A . 28 GLU HB2 1 1 6 3975 1 1 28 GLU HB3 H 4.422 -1.645 -4.475 1.00 . A A . 28 GLU HB3 1 1 6 3976 1 1 28 GLU HG2 H 2.435 -3.873 -4.070 1.00 . A A . 28 GLU HG2 1 1 6 3977 1 1 28 GLU HG3 H 2.051 -2.152 -4.098 1.00 . A A . 28 GLU HG3 1 1 6 3978 1 1 28 GLU N N 4.840 -4.956 -3.975 1.00 . A A . 28 GLU N 1 1 6 3979 1 1 28 GLU O O 7.175 -2.303 -4.554 1.00 . A A . 28 GLU O 1 1 6 3980 1 1 28 GLU OE1 O 3.122 -3.901 -6.593 1.00 . A A . 28 GLU OE1 1 1 6 3981 1 1 28 GLU OE2 O 1.905 -2.109 -6.579 1.00 . A A . 28 GLU OE2 1 1 6 3982 1 1 29 HIS C C 8.583 -2.341 -1.870 1.00 . A A . 29 HIS C 1 1 6 3983 1 1 29 HIS CA C 8.464 -3.749 -2.447 1.00 . A A . 29 HIS CA 1 1 6 3984 1 1 29 HIS CB C 9.586 -4.008 -3.485 1.00 . A A . 29 HIS CB 1 1 6 3985 1 1 29 HIS CD2 C 9.004 -6.271 -4.612 1.00 . A A . 29 HIS CD2 1 1 6 3986 1 1 29 HIS CE1 C 10.759 -7.415 -4.060 1.00 . A A . 29 HIS CE1 1 1 6 3987 1 1 29 HIS CG C 9.779 -5.452 -3.872 1.00 . A A . 29 HIS CG 1 1 6 3988 1 1 29 HIS H H 6.577 -4.714 -2.666 1.00 . A A . 29 HIS H 1 1 6 3989 1 1 29 HIS HA H 8.575 -4.449 -1.632 1.00 . A A . 29 HIS HA 1 1 6 3990 1 1 29 HIS HB2 H 9.359 -3.460 -4.388 1.00 . A A . 29 HIS HB2 1 1 6 3991 1 1 29 HIS HB3 H 10.519 -3.643 -3.081 1.00 . A A . 29 HIS HB3 1 1 6 3992 1 1 29 HIS HD1 H 11.660 -5.892 -3.006 1.00 . A A . 29 HIS HD1 1 1 6 3993 1 1 29 HIS HD2 H 8.044 -6.008 -5.035 1.00 . A A . 29 HIS HD2 1 1 6 3994 1 1 29 HIS HE1 H 11.487 -8.206 -3.952 1.00 . A A . 29 HIS HE1 1 1 6 3995 1 1 29 HIS N N 7.119 -3.979 -3.017 1.00 . A A . 29 HIS N 1 1 6 3996 1 1 29 HIS ND1 N 10.887 -6.198 -3.532 1.00 . A A . 29 HIS ND1 1 1 6 3997 1 1 29 HIS NE2 N 9.627 -7.519 -4.730 1.00 . A A . 29 HIS NE2 1 1 6 3998 1 1 29 HIS O O 9.675 -1.755 -1.816 1.00 . A A . 29 HIS O 1 1 6 3999 1 1 30 LEU C C 7.595 -0.559 0.652 1.00 . A A . 30 LEU C 1 1 6 4000 1 1 30 LEU CA C 7.423 -0.496 -0.857 1.00 . A A . 30 LEU CA 1 1 6 4001 1 1 30 LEU CB C 6.103 0.192 -1.242 1.00 . A A . 30 LEU CB 1 1 6 4002 1 1 30 LEU CD1 C 4.543 1.085 -3.003 1.00 . A A . 30 LEU CD1 1 1 6 4003 1 1 30 LEU CD2 C 6.993 0.955 -3.481 1.00 . A A . 30 LEU CD2 1 1 6 4004 1 1 30 LEU CG C 5.824 0.316 -2.748 1.00 . A A . 30 LEU CG 1 1 6 4005 1 1 30 LEU H H 6.661 -2.370 -1.408 1.00 . A A . 30 LEU H 1 1 6 4006 1 1 30 LEU HA H 8.247 0.066 -1.272 1.00 . A A . 30 LEU HA 1 1 6 4007 1 1 30 LEU HB2 H 5.294 -0.365 -0.793 1.00 . A A . 30 LEU HB2 1 1 6 4008 1 1 30 LEU HB3 H 6.106 1.185 -0.819 1.00 . A A . 30 LEU HB3 1 1 6 4009 1 1 30 LEU HD11 H 3.715 0.563 -2.548 1.00 . A A . 30 LEU HD11 1 1 6 4010 1 1 30 LEU HD12 H 4.377 1.166 -4.067 1.00 . A A . 30 LEU HD12 1 1 6 4011 1 1 30 LEU HD13 H 4.623 2.073 -2.575 1.00 . A A . 30 LEU HD13 1 1 6 4012 1 1 30 LEU HD21 H 7.215 1.917 -3.044 1.00 . A A . 30 LEU HD21 1 1 6 4013 1 1 30 LEU HD22 H 6.734 1.087 -4.521 1.00 . A A . 30 LEU HD22 1 1 6 4014 1 1 30 LEU HD23 H 7.858 0.315 -3.406 1.00 . A A . 30 LEU HD23 1 1 6 4015 1 1 30 LEU HG H 5.684 -0.680 -3.141 1.00 . A A . 30 LEU HG 1 1 6 4016 1 1 30 LEU N N 7.478 -1.822 -1.406 1.00 . A A . 30 LEU N 1 1 6 4017 1 1 30 LEU O O 7.889 -1.624 1.207 1.00 . A A . 30 LEU O 1 1 6 4018 1 1 31 ARG C C 6.440 0.160 3.521 1.00 . A A . 31 ARG C 1 1 6 4019 1 1 31 ARG CA C 7.658 0.635 2.733 1.00 . A A . 31 ARG CA 1 1 6 4020 1 1 31 ARG CB C 8.029 2.072 3.099 1.00 . A A . 31 ARG CB 1 1 6 4021 1 1 31 ARG CD C 8.925 3.724 4.711 1.00 . A A . 31 ARG CD 1 1 6 4022 1 1 31 ARG CG C 8.546 2.273 4.512 1.00 . A A . 31 ARG CG 1 1 6 4023 1 1 31 ARG CZ C 10.590 4.896 6.130 1.00 . A A . 31 ARG CZ 1 1 6 4024 1 1 31 ARG H H 7.068 1.349 0.847 1.00 . A A . 31 ARG H 1 1 6 4025 1 1 31 ARG HA H 8.494 -0.008 2.962 1.00 . A A . 31 ARG HA 1 1 6 4026 1 1 31 ARG HB2 H 8.794 2.410 2.415 1.00 . A A . 31 ARG HB2 1 1 6 4027 1 1 31 ARG HB3 H 7.154 2.692 2.967 1.00 . A A . 31 ARG HB3 1 1 6 4028 1 1 31 ARG HD2 H 9.576 4.020 3.901 1.00 . A A . 31 ARG HD2 1 1 6 4029 1 1 31 ARG HD3 H 8.023 4.319 4.670 1.00 . A A . 31 ARG HD3 1 1 6 4030 1 1 31 ARG HE H 9.272 3.474 6.753 1.00 . A A . 31 ARG HE 1 1 6 4031 1 1 31 ARG HG2 H 7.773 2.002 5.214 1.00 . A A . 31 ARG HG2 1 1 6 4032 1 1 31 ARG HG3 H 9.417 1.653 4.667 1.00 . A A . 31 ARG HG3 1 1 6 4033 1 1 31 ARG HH11 H 10.868 5.280 4.107 1.00 . A A . 31 ARG HH11 1 1 6 4034 1 1 31 ARG HH12 H 11.876 6.158 5.157 1.00 . A A . 31 ARG HH12 1 1 6 4035 1 1 31 ARG HH21 H 10.710 4.733 8.163 1.00 . A A . 31 ARG HH21 1 1 6 4036 1 1 31 ARG HH22 H 11.774 5.870 7.482 1.00 . A A . 31 ARG HH22 1 1 6 4037 1 1 31 ARG N N 7.409 0.553 1.314 1.00 . A A . 31 ARG N 1 1 6 4038 1 1 31 ARG NE N 9.609 3.987 5.979 1.00 . A A . 31 ARG NE 1 1 6 4039 1 1 31 ARG NH1 N 11.141 5.479 5.056 1.00 . A A . 31 ARG NH1 1 1 6 4040 1 1 31 ARG NH2 N 11.059 5.177 7.334 1.00 . A A . 31 ARG NH2 1 1 6 4041 1 1 31 ARG O O 6.571 -0.603 4.471 1.00 . A A . 31 ARG O 1 1 6 4042 1 1 32 SER C C 2.858 0.460 2.883 1.00 . A A . 32 SER C 1 1 6 4043 1 1 32 SER CA C 4.045 0.218 3.788 1.00 . A A . 32 SER CA 1 1 6 4044 1 1 32 SER CB C 3.917 1.011 5.092 1.00 . A A . 32 SER CB 1 1 6 4045 1 1 32 SER H H 5.185 1.162 2.325 1.00 . A A . 32 SER H 1 1 6 4046 1 1 32 SER HA H 4.096 -0.835 4.025 1.00 . A A . 32 SER HA 1 1 6 4047 1 1 32 SER HB2 H 2.914 0.899 5.479 1.00 . A A . 32 SER HB2 1 1 6 4048 1 1 32 SER HB3 H 4.628 0.632 5.810 1.00 . A A . 32 SER HB3 1 1 6 4049 1 1 32 SER HG H 4.746 2.663 5.605 1.00 . A A . 32 SER HG 1 1 6 4050 1 1 32 SER N N 5.270 0.584 3.112 1.00 . A A . 32 SER N 1 1 6 4051 1 1 32 SER O O 3.026 0.996 1.781 1.00 . A A . 32 SER O 1 1 6 4052 1 1 32 SER OG O 4.169 2.398 4.879 1.00 . A A . 32 SER OG 1 1 6 4053 1 1 33 GLY C C -0.602 0.758 3.477 1.00 . A A . 33 GLY C 1 1 6 4054 1 1 33 GLY CA C 0.488 0.281 2.573 1.00 . A A . 33 GLY CA 1 1 6 4055 1 1 33 GLY H H 1.608 -0.363 4.208 1.00 . A A . 33 GLY H 1 1 6 4056 1 1 33 GLY HA2 H 0.680 1.027 1.818 1.00 . A A . 33 GLY HA2 1 1 6 4057 1 1 33 GLY HA3 H 0.177 -0.633 2.090 1.00 . A A . 33 GLY HA3 1 1 6 4058 1 1 33 GLY N N 1.690 0.071 3.328 1.00 . A A . 33 GLY N 1 1 6 4059 1 1 33 GLY O O -0.845 0.159 4.530 1.00 . A A . 33 GLY O 1 1 6 4060 1 1 34 ARG C C -3.492 2.705 3.129 1.00 . A A . 34 ARG C 1 1 6 4061 1 1 34 ARG CA C -2.257 2.394 3.949 1.00 . A A . 34 ARG CA 1 1 6 4062 1 1 34 ARG CB C -1.734 3.610 4.732 1.00 . A A . 34 ARG CB 1 1 6 4063 1 1 34 ARG CD C -0.548 5.822 4.732 1.00 . A A . 34 ARG CD 1 1 6 4064 1 1 34 ARG CG C -1.197 4.743 3.876 1.00 . A A . 34 ARG CG 1 1 6 4065 1 1 34 ARG CZ C -1.101 7.186 6.745 1.00 . A A . 34 ARG CZ 1 1 6 4066 1 1 34 ARG H H -1.043 2.281 2.265 1.00 . A A . 34 ARG H 1 1 6 4067 1 1 34 ARG HA H -2.530 1.623 4.654 1.00 . A A . 34 ARG HA 1 1 6 4068 1 1 34 ARG HB2 H -2.538 4.001 5.337 1.00 . A A . 34 ARG HB2 1 1 6 4069 1 1 34 ARG HB3 H -0.942 3.278 5.388 1.00 . A A . 34 ARG HB3 1 1 6 4070 1 1 34 ARG HD2 H 0.350 5.420 5.178 1.00 . A A . 34 ARG HD2 1 1 6 4071 1 1 34 ARG HD3 H -0.289 6.658 4.099 1.00 . A A . 34 ARG HD3 1 1 6 4072 1 1 34 ARG HE H -2.327 5.876 5.824 1.00 . A A . 34 ARG HE 1 1 6 4073 1 1 34 ARG HG2 H -0.450 4.318 3.221 1.00 . A A . 34 ARG HG2 1 1 6 4074 1 1 34 ARG HG3 H -2.002 5.168 3.295 1.00 . A A . 34 ARG HG3 1 1 6 4075 1 1 34 ARG HH11 H 0.652 7.755 5.863 1.00 . A A . 34 ARG HH11 1 1 6 4076 1 1 34 ARG HH12 H 0.300 8.544 7.340 1.00 . A A . 34 ARG HH12 1 1 6 4077 1 1 34 ARG HH21 H -2.817 6.969 7.845 1.00 . A A . 34 ARG HH21 1 1 6 4078 1 1 34 ARG HH22 H -1.694 8.095 8.476 1.00 . A A . 34 ARG HH22 1 1 6 4079 1 1 34 ARG N N -1.232 1.835 3.123 1.00 . A A . 34 ARG N 1 1 6 4080 1 1 34 ARG NE N -1.437 6.298 5.804 1.00 . A A . 34 ARG NE 1 1 6 4081 1 1 34 ARG NH1 N 0.031 7.875 6.641 1.00 . A A . 34 ARG NH1 1 1 6 4082 1 1 34 ARG NH2 N -1.929 7.433 7.757 1.00 . A A . 34 ARG NH2 1 1 6 4083 1 1 34 ARG O O -3.418 3.000 1.933 1.00 . A A . 34 ARG O 1 1 6 4084 1 1 35 CYS C C -6.530 4.047 3.448 1.00 . A A . 35 CYS C 1 1 6 4085 1 1 35 CYS CA C -5.847 2.767 3.042 1.00 . A A . 35 CYS CA 1 1 6 4086 1 1 35 CYS CB C -6.712 1.548 3.328 1.00 . A A . 35 CYS CB 1 1 6 4087 1 1 35 CYS H H -4.637 2.467 4.714 1.00 . A A . 35 CYS H 1 1 6 4088 1 1 35 CYS HA H -5.641 2.805 1.983 1.00 . A A . 35 CYS HA 1 1 6 4089 1 1 35 CYS HB2 H -7.059 1.585 4.350 1.00 . A A . 35 CYS HB2 1 1 6 4090 1 1 35 CYS HB3 H -7.559 1.542 2.658 1.00 . A A . 35 CYS HB3 1 1 6 4091 1 1 35 CYS N N -4.613 2.623 3.746 1.00 . A A . 35 CYS N 1 1 6 4092 1 1 35 CYS O O -6.799 4.277 4.627 1.00 . A A . 35 CYS O 1 1 6 4093 1 1 35 CYS SG S -5.799 -0.021 3.091 1.00 . A A . 35 CYS SG 1 1 6 4094 1 1 36 ARG C C -8.940 5.968 2.675 1.00 . A A . 36 ARG C 1 1 6 4095 1 1 36 ARG CA C -7.427 6.157 2.719 1.00 . A A . 36 ARG CA 1 1 6 4096 1 1 36 ARG CB C -6.954 7.219 1.714 1.00 . A A . 36 ARG CB 1 1 6 4097 1 1 36 ARG CD C -5.256 8.211 3.282 1.00 . A A . 36 ARG CD 1 1 6 4098 1 1 36 ARG CG C -5.488 7.647 1.889 1.00 . A A . 36 ARG CG 1 1 6 4099 1 1 36 ARG CZ C -3.451 9.180 4.683 1.00 . A A . 36 ARG CZ 1 1 6 4100 1 1 36 ARG H H -6.497 4.649 1.566 1.00 . A A . 36 ARG H 1 1 6 4101 1 1 36 ARG HA H -7.169 6.471 3.717 1.00 . A A . 36 ARG HA 1 1 6 4102 1 1 36 ARG HB2 H -7.048 6.784 0.729 1.00 . A A . 36 ARG HB2 1 1 6 4103 1 1 36 ARG HB3 H -7.585 8.092 1.784 1.00 . A A . 36 ARG HB3 1 1 6 4104 1 1 36 ARG HD2 H -5.942 9.024 3.460 1.00 . A A . 36 ARG HD2 1 1 6 4105 1 1 36 ARG HD3 H -5.456 7.424 3.993 1.00 . A A . 36 ARG HD3 1 1 6 4106 1 1 36 ARG HE H -3.260 8.642 2.743 1.00 . A A . 36 ARG HE 1 1 6 4107 1 1 36 ARG HG2 H -4.849 6.789 1.746 1.00 . A A . 36 ARG HG2 1 1 6 4108 1 1 36 ARG HG3 H -5.251 8.404 1.156 1.00 . A A . 36 ARG HG3 1 1 6 4109 1 1 36 ARG HH11 H -5.240 8.939 5.668 1.00 . A A . 36 ARG HH11 1 1 6 4110 1 1 36 ARG HH12 H -4.016 9.581 6.642 1.00 . A A . 36 ARG HH12 1 1 6 4111 1 1 36 ARG HH21 H -1.545 9.472 4.025 1.00 . A A . 36 ARG HH21 1 1 6 4112 1 1 36 ARG HH22 H -1.785 9.959 5.637 1.00 . A A . 36 ARG HH22 1 1 6 4113 1 1 36 ARG N N -6.765 4.897 2.477 1.00 . A A . 36 ARG N 1 1 6 4114 1 1 36 ARG NE N -3.888 8.690 3.512 1.00 . A A . 36 ARG NE 1 1 6 4115 1 1 36 ARG NH1 N -4.287 9.245 5.735 1.00 . A A . 36 ARG NH1 1 1 6 4116 1 1 36 ARG NH2 N -2.185 9.564 4.808 1.00 . A A . 36 ARG NH2 1 1 6 4117 1 1 36 ARG O O -9.413 4.881 2.335 1.00 . A A . 36 ARG O 1 1 6 4118 1 1 37 ASP C C -11.791 6.679 1.682 1.00 . A A . 37 ASP C 1 1 6 4119 1 1 37 ASP CA C -11.184 6.985 3.048 1.00 . A A . 37 ASP CA 1 1 6 4120 1 1 37 ASP CB C -11.731 8.312 3.593 1.00 . A A . 37 ASP CB 1 1 6 4121 1 1 37 ASP CG C -13.216 8.265 3.895 1.00 . A A . 37 ASP CG 1 1 6 4122 1 1 37 ASP H H -9.246 7.879 3.184 1.00 . A A . 37 ASP H 1 1 6 4123 1 1 37 ASP HA H -11.453 6.187 3.725 1.00 . A A . 37 ASP HA 1 1 6 4124 1 1 37 ASP HB2 H -11.205 8.570 4.499 1.00 . A A . 37 ASP HB2 1 1 6 4125 1 1 37 ASP HB3 H -11.557 9.084 2.858 1.00 . A A . 37 ASP HB3 1 1 6 4126 1 1 37 ASP N N -9.693 7.029 2.976 1.00 . A A . 37 ASP N 1 1 6 4127 1 1 37 ASP O O -12.953 6.320 1.552 1.00 . A A . 37 ASP O 1 1 6 4128 1 1 37 ASP OD1 O -13.615 7.614 4.893 1.00 . A A . 37 ASP OD1 1 1 6 4129 1 1 37 ASP OD2 O -14.014 8.908 3.183 1.00 . A A . 37 ASP OD2 1 1 6 4130 1 1 38 ASP C C -11.429 4.981 -0.875 1.00 . A A . 38 ASP C 1 1 6 4131 1 1 38 ASP CA C -11.275 6.493 -0.705 1.00 . A A . 38 ASP CA 1 1 6 4132 1 1 38 ASP CB C -10.108 6.914 -1.589 1.00 . A A . 38 ASP CB 1 1 6 4133 1 1 38 ASP CG C -9.816 8.394 -1.600 1.00 . A A . 38 ASP CG 1 1 6 4134 1 1 38 ASP H H -10.087 7.217 0.876 1.00 . A A . 38 ASP H 1 1 6 4135 1 1 38 ASP HA H -12.161 7.018 -1.028 1.00 . A A . 38 ASP HA 1 1 6 4136 1 1 38 ASP HB2 H -9.236 6.408 -1.207 1.00 . A A . 38 ASP HB2 1 1 6 4137 1 1 38 ASP HB3 H -10.290 6.576 -2.598 1.00 . A A . 38 ASP HB3 1 1 6 4138 1 1 38 ASP N N -10.964 6.824 0.678 1.00 . A A . 38 ASP N 1 1 6 4139 1 1 38 ASP O O -11.938 4.511 -1.900 1.00 . A A . 38 ASP O 1 1 6 4140 1 1 38 ASP OD1 O -9.227 8.898 -0.620 1.00 . A A . 38 ASP OD1 1 1 6 4141 1 1 38 ASP OD2 O -10.123 9.059 -2.615 1.00 . A A . 38 ASP OD2 1 1 6 4142 1 1 39 PHE C C -9.902 2.208 -0.888 1.00 . A A . 39 PHE C 1 1 6 4143 1 1 39 PHE CA C -10.883 2.747 0.138 1.00 . A A . 39 PHE CA 1 1 6 4144 1 1 39 PHE CB C -12.277 2.108 -0.041 1.00 . A A . 39 PHE CB 1 1 6 4145 1 1 39 PHE CD1 C -14.138 3.398 1.026 1.00 . A A . 39 PHE CD1 1 1 6 4146 1 1 39 PHE CD2 C -13.213 1.556 2.212 1.00 . A A . 39 PHE CD2 1 1 6 4147 1 1 39 PHE CE1 C -15.015 3.629 2.062 1.00 . A A . 39 PHE CE1 1 1 6 4148 1 1 39 PHE CE2 C -14.090 1.783 3.251 1.00 . A A . 39 PHE CE2 1 1 6 4149 1 1 39 PHE CG C -13.228 2.361 1.088 1.00 . A A . 39 PHE CG 1 1 6 4150 1 1 39 PHE CZ C -14.991 2.821 3.176 1.00 . A A . 39 PHE CZ 1 1 6 4151 1 1 39 PHE H H -10.547 4.685 0.909 1.00 . A A . 39 PHE H 1 1 6 4152 1 1 39 PHE HA H -10.496 2.475 1.110 1.00 . A A . 39 PHE HA 1 1 6 4153 1 1 39 PHE HB2 H -12.732 2.513 -0.932 1.00 . A A . 39 PHE HB2 1 1 6 4154 1 1 39 PHE HB3 H -12.163 1.040 -0.154 1.00 . A A . 39 PHE HB3 1 1 6 4155 1 1 39 PHE HD1 H -14.159 4.035 0.154 1.00 . A A . 39 PHE HD1 1 1 6 4156 1 1 39 PHE HD2 H -12.508 0.739 2.277 1.00 . A A . 39 PHE HD2 1 1 6 4157 1 1 39 PHE HE1 H -15.721 4.442 2.000 1.00 . A A . 39 PHE HE1 1 1 6 4158 1 1 39 PHE HE2 H -14.070 1.148 4.124 1.00 . A A . 39 PHE HE2 1 1 6 4159 1 1 39 PHE HZ H -15.679 3.001 3.989 1.00 . A A . 39 PHE HZ 1 1 6 4160 1 1 39 PHE N N -10.916 4.225 0.120 1.00 . A A . 39 PHE N 1 1 6 4161 1 1 39 PHE O O -9.884 1.023 -1.188 1.00 . A A . 39 PHE O 1 1 6 4162 1 1 40 ARG C C -6.723 2.645 -1.651 1.00 . A A . 40 ARG C 1 1 6 4163 1 1 40 ARG CA C -8.081 2.724 -2.363 1.00 . A A . 40 ARG CA 1 1 6 4164 1 1 40 ARG CB C -8.078 3.818 -3.442 1.00 . A A . 40 ARG CB 1 1 6 4165 1 1 40 ARG CD C -8.403 2.402 -5.496 1.00 . A A . 40 ARG CD 1 1 6 4166 1 1 40 ARG CG C -7.508 3.409 -4.790 1.00 . A A . 40 ARG CG 1 1 6 4167 1 1 40 ARG CZ C -8.311 1.049 -7.590 1.00 . A A . 40 ARG CZ 1 1 6 4168 1 1 40 ARG H H -9.079 3.984 -1.014 1.00 . A A . 40 ARG H 1 1 6 4169 1 1 40 ARG HA H -8.338 1.770 -2.796 1.00 . A A . 40 ARG HA 1 1 6 4170 1 1 40 ARG HB2 H -9.093 4.149 -3.600 1.00 . A A . 40 ARG HB2 1 1 6 4171 1 1 40 ARG HB3 H -7.501 4.652 -3.072 1.00 . A A . 40 ARG HB3 1 1 6 4172 1 1 40 ARG HD2 H -8.454 1.495 -4.913 1.00 . A A . 40 ARG HD2 1 1 6 4173 1 1 40 ARG HD3 H -9.395 2.821 -5.582 1.00 . A A . 40 ARG HD3 1 1 6 4174 1 1 40 ARG HE H -7.244 2.711 -7.198 1.00 . A A . 40 ARG HE 1 1 6 4175 1 1 40 ARG HG2 H -7.404 4.284 -5.414 1.00 . A A . 40 ARG HG2 1 1 6 4176 1 1 40 ARG HG3 H -6.539 2.960 -4.631 1.00 . A A . 40 ARG HG3 1 1 6 4177 1 1 40 ARG HH11 H -9.523 0.211 -6.169 1.00 . A A . 40 ARG HH11 1 1 6 4178 1 1 40 ARG HH12 H -9.463 -0.639 -7.644 1.00 . A A . 40 ARG HH12 1 1 6 4179 1 1 40 ARG HH21 H -7.181 1.569 -9.205 1.00 . A A . 40 ARG HH21 1 1 6 4180 1 1 40 ARG HH22 H -8.116 0.162 -9.428 1.00 . A A . 40 ARG HH22 1 1 6 4181 1 1 40 ARG N N -9.055 3.072 -1.367 1.00 . A A . 40 ARG N 1 1 6 4182 1 1 40 ARG NE N -7.909 2.082 -6.839 1.00 . A A . 40 ARG NE 1 1 6 4183 1 1 40 ARG NH1 N -9.157 0.148 -7.102 1.00 . A A . 40 ARG NH1 1 1 6 4184 1 1 40 ARG NH2 N -7.838 0.913 -8.823 1.00 . A A . 40 ARG NH2 1 1 6 4185 1 1 40 ARG O O -6.499 3.377 -0.664 1.00 . A A . 40 ARG O 1 1 6 4186 1 1 41 CYS C C -3.500 2.575 -1.854 1.00 . A A . 41 CYS C 1 1 6 4187 1 1 41 CYS CA C -4.564 1.576 -1.454 1.00 . A A . 41 CYS CA 1 1 6 4188 1 1 41 CYS CB C -4.047 0.162 -1.644 1.00 . A A . 41 CYS CB 1 1 6 4189 1 1 41 CYS H H -6.061 1.217 -2.883 1.00 . A A . 41 CYS H 1 1 6 4190 1 1 41 CYS HA H -4.738 1.709 -0.397 1.00 . A A . 41 CYS HA 1 1 6 4191 1 1 41 CYS HB2 H -4.229 -0.156 -2.660 1.00 . A A . 41 CYS HB2 1 1 6 4192 1 1 41 CYS HB3 H -2.984 0.160 -1.453 1.00 . A A . 41 CYS HB3 1 1 6 4193 1 1 41 CYS N N -5.857 1.771 -2.097 1.00 . A A . 41 CYS N 1 1 6 4194 1 1 41 CYS O O -3.044 2.607 -3.004 1.00 . A A . 41 CYS O 1 1 6 4195 1 1 41 CYS SG S -4.804 -1.051 -0.541 1.00 . A A . 41 CYS SG 1 1 6 4196 1 1 42 TRP C C -0.840 3.742 -0.286 1.00 . A A . 42 TRP C 1 1 6 4197 1 1 42 TRP CA C -2.019 4.297 -1.041 1.00 . A A . 42 TRP CA 1 1 6 4198 1 1 42 TRP CB C -2.384 5.677 -0.497 1.00 . A A . 42 TRP CB 1 1 6 4199 1 1 42 TRP CD1 C -2.029 7.524 -2.237 1.00 . A A . 42 TRP CD1 1 1 6 4200 1 1 42 TRP CD2 C -4.167 6.949 -1.956 1.00 . A A . 42 TRP CD2 1 1 6 4201 1 1 42 TRP CE2 C -4.094 7.973 -2.924 1.00 . A A . 42 TRP CE2 1 1 6 4202 1 1 42 TRP CE3 C -5.413 6.434 -1.623 1.00 . A A . 42 TRP CE3 1 1 6 4203 1 1 42 TRP CG C -2.830 6.673 -1.530 1.00 . A A . 42 TRP CG 1 1 6 4204 1 1 42 TRP CH2 C -6.424 7.959 -3.203 1.00 . A A . 42 TRP CH2 1 1 6 4205 1 1 42 TRP CZ2 C -5.220 8.484 -3.551 1.00 . A A . 42 TRP CZ2 1 1 6 4206 1 1 42 TRP CZ3 C -6.526 6.944 -2.251 1.00 . A A . 42 TRP CZ3 1 1 6 4207 1 1 42 TRP H H -3.510 3.295 -0.002 1.00 . A A . 42 TRP H 1 1 6 4208 1 1 42 TRP HA H -1.773 4.363 -2.090 1.00 . A A . 42 TRP HA 1 1 6 4209 1 1 42 TRP HB2 H -3.192 5.562 0.211 1.00 . A A . 42 TRP HB2 1 1 6 4210 1 1 42 TRP HB3 H -1.526 6.077 0.020 1.00 . A A . 42 TRP HB3 1 1 6 4211 1 1 42 TRP HD1 H -0.954 7.570 -2.144 1.00 . A A . 42 TRP HD1 1 1 6 4212 1 1 42 TRP HE1 H -2.437 8.991 -3.687 1.00 . A A . 42 TRP HE1 1 1 6 4213 1 1 42 TRP HE3 H -5.511 5.644 -0.894 1.00 . A A . 42 TRP HE3 1 1 6 4214 1 1 42 TRP HH2 H -7.326 8.330 -3.667 1.00 . A A . 42 TRP HH2 1 1 6 4215 1 1 42 TRP HZ2 H -5.160 9.269 -4.290 1.00 . A A . 42 TRP HZ2 1 1 6 4216 1 1 42 TRP HZ3 H -7.504 6.561 -2.009 1.00 . A A . 42 TRP HZ3 1 1 6 4217 1 1 42 TRP N N -3.101 3.368 -0.894 1.00 . A A . 42 TRP N 1 1 6 4218 1 1 42 TRP NE1 N -2.784 8.305 -3.071 1.00 . A A . 42 TRP NE1 1 1 6 4219 1 1 42 TRP O O -0.869 3.617 0.930 1.00 . A A . 42 TRP O 1 1 6 4220 1 1 43 CYS C C 2.478 3.684 -0.353 1.00 . A A . 43 CYS C 1 1 6 4221 1 1 43 CYS CA C 1.277 2.769 -0.372 1.00 . A A . 43 CYS CA 1 1 6 4222 1 1 43 CYS CB C 1.535 1.415 -1.016 1.00 . A A . 43 CYS CB 1 1 6 4223 1 1 43 CYS H H 0.196 3.577 -1.946 1.00 . A A . 43 CYS H 1 1 6 4224 1 1 43 CYS HA H 0.997 2.604 0.656 1.00 . A A . 43 CYS HA 1 1 6 4225 1 1 43 CYS HB2 H 1.733 1.551 -2.069 1.00 . A A . 43 CYS HB2 1 1 6 4226 1 1 43 CYS HB3 H 2.380 0.944 -0.539 1.00 . A A . 43 CYS HB3 1 1 6 4227 1 1 43 CYS N N 0.164 3.391 -0.979 1.00 . A A . 43 CYS N 1 1 6 4228 1 1 43 CYS O O 2.729 4.447 -1.298 1.00 . A A . 43 CYS O 1 1 6 4229 1 1 43 CYS SG S 0.093 0.298 -0.838 1.00 . A A . 43 CYS SG 1 1 6 4230 1 1 44 THR C C 5.533 3.978 0.293 1.00 . A A . 44 THR C 1 1 6 4231 1 1 44 THR CA C 4.280 4.485 1.010 1.00 . A A . 44 THR CA 1 1 6 4232 1 1 44 THR CB C 4.544 4.464 2.520 1.00 . A A . 44 THR CB 1 1 6 4233 1 1 44 THR CG2 C 5.318 5.697 2.948 1.00 . A A . 44 THR CG2 1 1 6 4234 1 1 44 THR H H 2.936 2.979 1.429 1.00 . A A . 44 THR H 1 1 6 4235 1 1 44 THR HA H 4.050 5.499 0.721 1.00 . A A . 44 THR HA 1 1 6 4236 1 1 44 THR HB H 5.114 3.580 2.766 1.00 . A A . 44 THR HB 1 1 6 4237 1 1 44 THR HG1 H 3.381 3.754 3.911 1.00 . A A . 44 THR HG1 1 1 6 4238 1 1 44 THR HG21 H 5.496 5.659 4.014 1.00 . A A . 44 THR HG21 1 1 6 4239 1 1 44 THR HG22 H 4.748 6.581 2.709 1.00 . A A . 44 THR HG22 1 1 6 4240 1 1 44 THR HG23 H 6.264 5.724 2.427 1.00 . A A . 44 THR HG23 1 1 6 4241 1 1 44 THR N N 3.174 3.635 0.739 1.00 . A A . 44 THR N 1 1 6 4242 1 1 44 THR O O 6.013 2.865 0.570 1.00 . A A . 44 THR O 1 1 6 4243 1 1 44 THR OG1 O 3.288 4.431 3.225 1.00 . A A . 44 THR OG1 1 1 6 4244 1 1 45 LYS C C 8.344 5.361 -0.829 1.00 . A A . 45 LYS C 1 1 6 4245 1 1 45 LYS CA C 7.261 4.418 -1.296 1.00 . A A . 45 LYS CA 1 1 6 4246 1 1 45 LYS CB C 7.102 4.442 -2.835 1.00 . A A . 45 LYS CB 1 1 6 4247 1 1 45 LYS CD C 6.587 5.636 -4.972 1.00 . A A . 45 LYS CD 1 1 6 4248 1 1 45 LYS CE C 6.373 6.968 -5.682 1.00 . A A . 45 LYS CE 1 1 6 4249 1 1 45 LYS CG C 6.802 5.795 -3.469 1.00 . A A . 45 LYS CG 1 1 6 4250 1 1 45 LYS H H 5.574 5.596 -0.841 1.00 . A A . 45 LYS H 1 1 6 4251 1 1 45 LYS HA H 7.530 3.420 -0.978 1.00 . A A . 45 LYS HA 1 1 6 4252 1 1 45 LYS HB2 H 8.013 4.073 -3.281 1.00 . A A . 45 LYS HB2 1 1 6 4253 1 1 45 LYS HB3 H 6.299 3.768 -3.095 1.00 . A A . 45 LYS HB3 1 1 6 4254 1 1 45 LYS HD2 H 7.454 5.155 -5.398 1.00 . A A . 45 LYS HD2 1 1 6 4255 1 1 45 LYS HD3 H 5.721 5.009 -5.132 1.00 . A A . 45 LYS HD3 1 1 6 4256 1 1 45 LYS HE2 H 6.084 6.768 -6.703 1.00 . A A . 45 LYS HE2 1 1 6 4257 1 1 45 LYS HE3 H 5.575 7.500 -5.183 1.00 . A A . 45 LYS HE3 1 1 6 4258 1 1 45 LYS HG2 H 5.906 6.201 -3.021 1.00 . A A . 45 LYS HG2 1 1 6 4259 1 1 45 LYS HG3 H 7.633 6.461 -3.297 1.00 . A A . 45 LYS HG3 1 1 6 4260 1 1 45 LYS HZ1 H 7.378 8.735 -6.139 1.00 . A A . 45 LYS HZ1 1 1 6 4261 1 1 45 LYS HZ2 H 8.346 7.363 -6.250 1.00 . A A . 45 LYS HZ2 1 1 6 4262 1 1 45 LYS HZ3 H 7.991 7.985 -4.749 1.00 . A A . 45 LYS HZ3 1 1 6 4263 1 1 45 LYS N N 6.040 4.757 -0.621 1.00 . A A . 45 LYS N 1 1 6 4264 1 1 45 LYS NZ N 7.592 7.820 -5.694 1.00 . A A . 45 LYS NZ 1 1 6 4265 1 1 45 LYS O O 8.058 6.507 -0.454 1.00 . A A . 45 LYS O 1 1 6 4266 1 1 46 ASN C C 11.201 6.577 -1.412 1.00 . A A . 46 ASN C 1 1 6 4267 1 1 46 ASN CA C 10.666 5.691 -0.320 1.00 . A A . 46 ASN CA 1 1 6 4268 1 1 46 ASN CB C 11.789 4.820 0.246 1.00 . A A . 46 ASN CB 1 1 6 4269 1 1 46 ASN CG C 11.436 4.148 1.561 1.00 . A A . 46 ASN CG 1 1 6 4270 1 1 46 ASN H H 9.719 3.976 -1.114 1.00 . A A . 46 ASN H 1 1 6 4271 1 1 46 ASN HA H 10.289 6.320 0.474 1.00 . A A . 46 ASN HA 1 1 6 4272 1 1 46 ASN HB2 H 12.022 4.049 -0.472 1.00 . A A . 46 ASN HB2 1 1 6 4273 1 1 46 ASN HB3 H 12.664 5.435 0.397 1.00 . A A . 46 ASN HB3 1 1 6 4274 1 1 46 ASN HD21 H 12.559 2.601 1.085 1.00 . A A . 46 ASN HD21 1 1 6 4275 1 1 46 ASN HD22 H 11.790 2.509 2.625 1.00 . A A . 46 ASN HD22 1 1 6 4276 1 1 46 ASN N N 9.554 4.889 -0.796 1.00 . A A . 46 ASN N 1 1 6 4277 1 1 46 ASN ND2 N 11.972 2.973 1.780 1.00 . A A . 46 ASN ND2 1 1 6 4278 1 1 46 ASN O O 11.541 6.104 -2.514 1.00 . A A . 46 ASN O 1 1 6 4279 1 1 46 ASN OD1 O 10.682 4.684 2.374 1.00 . A A . 46 ASN OD1 1 1 6 4280 1 1 47 CYS C C 12.931 9.548 -1.345 1.00 . A A . 47 CYS C 1 1 6 4281 1 1 47 CYS CA C 11.788 8.818 -2.034 1.00 . A A . 47 CYS CA 1 1 6 4282 1 1 47 CYS CB C 10.688 9.808 -2.413 1.00 . A A . 47 CYS CB 1 1 6 4283 1 1 47 CYS H H 11.033 8.153 -0.222 1.00 . A A . 47 CYS H 1 1 6 4284 1 1 47 CYS HA H 12.151 8.315 -2.917 1.00 . A A . 47 CYS HA 1 1 6 4285 1 1 47 CYS HB2 H 10.412 10.373 -1.535 1.00 . A A . 47 CYS HB2 1 1 6 4286 1 1 47 CYS HB3 H 11.072 10.488 -3.159 1.00 . A A . 47 CYS HB3 1 1 6 4287 1 1 47 CYS N N 11.286 7.838 -1.117 1.00 . A A . 47 CYS N 1 1 6 4288 1 1 47 CYS O O 12.717 10.651 -0.762 1.00 . A A . 47 CYS O 1 1 6 4289 1 1 47 CYS OXT O 14.046 8.993 -1.301 1.00 . A A . 47 CYS OXT 1 1 6 4290 1 1 47 CYS SG S 9.162 9.060 -3.072 1.00 . A A . 47 CYS SG 1 1 7 4291 1 1 1 LYS C C 11.584 9.257 0.860 1.00 . A A . 1 LYS C 1 1 7 4292 1 1 1 LYS CA C 12.814 10.052 1.252 1.00 . A A . 1 LYS CA 1 1 7 4293 1 1 1 LYS CB C 12.446 11.456 1.802 1.00 . A A . 1 LYS CB 1 1 7 4294 1 1 1 LYS CD C 11.167 13.589 1.670 1.00 . A A . 1 LYS CD 1 1 7 4295 1 1 1 LYS CE C 10.025 14.333 1.005 1.00 . A A . 1 LYS CE 1 1 7 4296 1 1 1 LYS CG C 11.503 12.292 0.951 1.00 . A A . 1 LYS CG 1 1 7 4297 1 1 1 LYS H1 H 14.001 9.189 -0.150 1.00 . A A . 1 LYS H1 1 1 7 4298 1 1 1 LYS H2 H 14.490 10.773 0.213 1.00 . A A . 1 LYS H2 1 1 7 4299 1 1 1 LYS H3 H 13.123 10.455 -0.755 1.00 . A A . 1 LYS H3 1 1 7 4300 1 1 1 LYS HA H 13.351 9.488 2.000 1.00 . A A . 1 LYS HA 1 1 7 4301 1 1 1 LYS HB2 H 11.985 11.338 2.770 1.00 . A A . 1 LYS HB2 1 1 7 4302 1 1 1 LYS HB3 H 13.360 12.015 1.936 1.00 . A A . 1 LYS HB3 1 1 7 4303 1 1 1 LYS HD2 H 10.886 13.363 2.688 1.00 . A A . 1 LYS HD2 1 1 7 4304 1 1 1 LYS HD3 H 12.045 14.218 1.671 1.00 . A A . 1 LYS HD3 1 1 7 4305 1 1 1 LYS HE2 H 9.870 15.270 1.519 1.00 . A A . 1 LYS HE2 1 1 7 4306 1 1 1 LYS HE3 H 10.288 14.527 -0.025 1.00 . A A . 1 LYS HE3 1 1 7 4307 1 1 1 LYS HG2 H 11.977 12.516 0.007 1.00 . A A . 1 LYS HG2 1 1 7 4308 1 1 1 LYS HG3 H 10.593 11.735 0.782 1.00 . A A . 1 LYS HG3 1 1 7 4309 1 1 1 LYS HZ1 H 8.843 12.660 0.510 1.00 . A A . 1 LYS HZ1 1 1 7 4310 1 1 1 LYS HZ2 H 7.997 14.091 0.596 1.00 . A A . 1 LYS HZ2 1 1 7 4311 1 1 1 LYS HZ3 H 8.470 13.325 2.013 1.00 . A A . 1 LYS HZ3 1 1 7 4312 1 1 1 LYS N N 13.673 10.148 0.080 1.00 . A A . 1 LYS N 1 1 7 4313 1 1 1 LYS NZ N 8.764 13.552 1.043 1.00 . A A . 1 LYS NZ 1 1 7 4314 1 1 1 LYS O O 11.633 8.520 -0.106 1.00 . A A . 1 LYS O 1 1 7 4315 1 1 2 THR C C 8.262 9.545 0.626 1.00 . A A . 2 THR C 1 1 7 4316 1 1 2 THR CA C 9.322 8.644 1.240 1.00 . A A . 2 THR CA 1 1 7 4317 1 1 2 THR CB C 8.743 7.915 2.447 1.00 . A A . 2 THR CB 1 1 7 4318 1 1 2 THR CG2 C 9.609 6.733 2.813 1.00 . A A . 2 THR CG2 1 1 7 4319 1 1 2 THR H H 10.515 9.901 2.414 1.00 . A A . 2 THR H 1 1 7 4320 1 1 2 THR HA H 9.598 7.899 0.510 1.00 . A A . 2 THR HA 1 1 7 4321 1 1 2 THR HB H 7.757 7.561 2.184 1.00 . A A . 2 THR HB 1 1 7 4322 1 1 2 THR HG1 H 8.526 9.716 3.221 1.00 . A A . 2 THR HG1 1 1 7 4323 1 1 2 THR HG21 H 10.616 7.079 2.992 1.00 . A A . 2 THR HG21 1 1 7 4324 1 1 2 THR HG22 H 9.613 6.024 1.998 1.00 . A A . 2 THR HG22 1 1 7 4325 1 1 2 THR HG23 H 9.226 6.267 3.708 1.00 . A A . 2 THR HG23 1 1 7 4326 1 1 2 THR N N 10.513 9.357 1.598 1.00 . A A . 2 THR N 1 1 7 4327 1 1 2 THR O O 8.212 10.748 0.904 1.00 . A A . 2 THR O 1 1 7 4328 1 1 2 THR OG1 O 8.624 8.818 3.568 1.00 . A A . 2 THR OG1 1 1 7 4329 1 1 3 CYS C C 5.216 8.558 -0.848 1.00 . A A . 3 CYS C 1 1 7 4330 1 1 3 CYS CA C 6.319 9.584 -0.815 1.00 . A A . 3 CYS CA 1 1 7 4331 1 1 3 CYS CB C 6.660 10.097 -2.219 1.00 . A A . 3 CYS CB 1 1 7 4332 1 1 3 CYS H H 7.643 8.031 -0.480 1.00 . A A . 3 CYS H 1 1 7 4333 1 1 3 CYS HA H 6.012 10.406 -0.185 1.00 . A A . 3 CYS HA 1 1 7 4334 1 1 3 CYS HB2 H 5.741 10.267 -2.761 1.00 . A A . 3 CYS HB2 1 1 7 4335 1 1 3 CYS HB3 H 7.200 11.029 -2.137 1.00 . A A . 3 CYS HB3 1 1 7 4336 1 1 3 CYS N N 7.464 8.962 -0.209 1.00 . A A . 3 CYS N 1 1 7 4337 1 1 3 CYS O O 5.494 7.363 -0.904 1.00 . A A . 3 CYS O 1 1 7 4338 1 1 3 CYS SG S 7.671 8.955 -3.220 1.00 . A A . 3 CYS SG 1 1 7 4339 1 1 4 GLU C C 2.091 8.166 -1.985 1.00 . A A . 4 GLU C 1 1 7 4340 1 1 4 GLU CA C 2.909 8.037 -0.724 1.00 . A A . 4 GLU CA 1 1 7 4341 1 1 4 GLU CB C 2.082 8.253 0.538 1.00 . A A . 4 GLU CB 1 1 7 4342 1 1 4 GLU CD C 0.287 7.453 2.060 1.00 . A A . 4 GLU CD 1 1 7 4343 1 1 4 GLU CG C 0.949 7.273 0.730 1.00 . A A . 4 GLU CG 1 1 7 4344 1 1 4 GLU H H 3.777 9.934 -0.739 1.00 . A A . 4 GLU H 1 1 7 4345 1 1 4 GLU HA H 3.336 7.046 -0.703 1.00 . A A . 4 GLU HA 1 1 7 4346 1 1 4 GLU HB2 H 2.733 8.178 1.396 1.00 . A A . 4 GLU HB2 1 1 7 4347 1 1 4 GLU HB3 H 1.665 9.249 0.507 1.00 . A A . 4 GLU HB3 1 1 7 4348 1 1 4 GLU HG2 H 0.219 7.429 -0.050 1.00 . A A . 4 GLU HG2 1 1 7 4349 1 1 4 GLU HG3 H 1.338 6.267 0.666 1.00 . A A . 4 GLU HG3 1 1 7 4350 1 1 4 GLU N N 3.993 8.975 -0.759 1.00 . A A . 4 GLU N 1 1 7 4351 1 1 4 GLU O O 1.677 9.260 -2.354 1.00 . A A . 4 GLU O 1 1 7 4352 1 1 4 GLU OE1 O 0.381 6.552 2.915 1.00 . A A . 4 GLU OE1 1 1 7 4353 1 1 4 GLU OE2 O -0.288 8.531 2.312 1.00 . A A . 4 GLU OE2 1 1 7 4354 1 1 5 ASN C C 0.334 5.813 -3.980 1.00 . A A . 5 ASN C 1 1 7 4355 1 1 5 ASN CA C 1.191 7.059 -3.917 1.00 . A A . 5 ASN CA 1 1 7 4356 1 1 5 ASN CB C 2.235 7.092 -5.067 1.00 . A A . 5 ASN CB 1 1 7 4357 1 1 5 ASN CG C 1.636 7.194 -6.464 1.00 . A A . 5 ASN CG 1 1 7 4358 1 1 5 ASN H H 2.178 6.204 -2.282 1.00 . A A . 5 ASN H 1 1 7 4359 1 1 5 ASN HA H 0.566 7.937 -3.976 1.00 . A A . 5 ASN HA 1 1 7 4360 1 1 5 ASN HB2 H 2.884 7.943 -4.925 1.00 . A A . 5 ASN HB2 1 1 7 4361 1 1 5 ASN HB3 H 2.830 6.191 -5.015 1.00 . A A . 5 ASN HB3 1 1 7 4362 1 1 5 ASN HD21 H 1.745 5.227 -6.721 1.00 . A A . 5 ASN HD21 1 1 7 4363 1 1 5 ASN HD22 H 1.095 6.125 -8.034 1.00 . A A . 5 ASN HD22 1 1 7 4364 1 1 5 ASN N N 1.885 7.067 -2.652 1.00 . A A . 5 ASN N 1 1 7 4365 1 1 5 ASN ND2 N 1.476 6.077 -7.132 1.00 . A A . 5 ASN ND2 1 1 7 4366 1 1 5 ASN O O 0.554 4.879 -3.196 1.00 . A A . 5 ASN O 1 1 7 4367 1 1 5 ASN OD1 O 1.362 8.291 -6.955 1.00 . A A . 5 ASN OD1 1 1 7 4368 1 1 6 LEU C C -0.776 3.416 -5.396 1.00 . A A . 6 LEU C 1 1 7 4369 1 1 6 LEU CA C -1.532 4.671 -5.040 1.00 . A A . 6 LEU CA 1 1 7 4370 1 1 6 LEU CB C -2.585 4.954 -6.113 1.00 . A A . 6 LEU CB 1 1 7 4371 1 1 6 LEU CD1 C -4.649 6.128 -6.866 1.00 . A A . 6 LEU CD1 1 1 7 4372 1 1 6 LEU CD2 C -4.539 5.128 -4.627 1.00 . A A . 6 LEU CD2 1 1 7 4373 1 1 6 LEU CG C -3.748 5.832 -5.690 1.00 . A A . 6 LEU CG 1 1 7 4374 1 1 6 LEU H H -0.822 6.617 -5.389 1.00 . A A . 6 LEU H 1 1 7 4375 1 1 6 LEU HA H -2.046 4.499 -4.107 1.00 . A A . 6 LEU HA 1 1 7 4376 1 1 6 LEU HB2 H -2.091 5.434 -6.944 1.00 . A A . 6 LEU HB2 1 1 7 4377 1 1 6 LEU HB3 H -2.980 4.008 -6.451 1.00 . A A . 6 LEU HB3 1 1 7 4378 1 1 6 LEU HD11 H -5.024 5.199 -7.269 1.00 . A A . 6 LEU HD11 1 1 7 4379 1 1 6 LEU HD12 H -4.097 6.665 -7.621 1.00 . A A . 6 LEU HD12 1 1 7 4380 1 1 6 LEU HD13 H -5.478 6.727 -6.520 1.00 . A A . 6 LEU HD13 1 1 7 4381 1 1 6 LEU HD21 H -4.861 4.167 -4.999 1.00 . A A . 6 LEU HD21 1 1 7 4382 1 1 6 LEU HD22 H -5.406 5.724 -4.384 1.00 . A A . 6 LEU HD22 1 1 7 4383 1 1 6 LEU HD23 H -3.943 4.994 -3.737 1.00 . A A . 6 LEU HD23 1 1 7 4384 1 1 6 LEU HG H -3.387 6.762 -5.277 1.00 . A A . 6 LEU HG 1 1 7 4385 1 1 6 LEU N N -0.657 5.813 -4.850 1.00 . A A . 6 LEU N 1 1 7 4386 1 1 6 LEU O O 0.181 3.447 -6.184 1.00 . A A . 6 LEU O 1 1 7 4387 1 1 7 ALA C C -1.020 0.657 -6.501 1.00 . A A . 7 ALA C 1 1 7 4388 1 1 7 ALA CA C -0.638 1.038 -5.085 1.00 . A A . 7 ALA CA 1 1 7 4389 1 1 7 ALA CB C -1.180 0.036 -4.100 1.00 . A A . 7 ALA CB 1 1 7 4390 1 1 7 ALA H H -1.894 2.417 -4.120 1.00 . A A . 7 ALA H 1 1 7 4391 1 1 7 ALA HA H 0.437 1.086 -4.991 1.00 . A A . 7 ALA HA 1 1 7 4392 1 1 7 ALA HB1 H -2.256 0.009 -4.184 1.00 . A A . 7 ALA HB1 1 1 7 4393 1 1 7 ALA HB2 H -0.913 0.350 -3.101 1.00 . A A . 7 ALA HB2 1 1 7 4394 1 1 7 ALA HB3 H -0.771 -0.942 -4.302 1.00 . A A . 7 ALA HB3 1 1 7 4395 1 1 7 ALA N N -1.185 2.335 -4.798 1.00 . A A . 7 ALA N 1 1 7 4396 1 1 7 ALA O O -2.185 0.796 -6.891 1.00 . A A . 7 ALA O 1 1 7 4397 1 1 8 ASP C C -0.835 -1.477 -8.871 1.00 . A A . 8 ASP C 1 1 7 4398 1 1 8 ASP CA C -0.283 -0.088 -8.664 1.00 . A A . 8 ASP CA 1 1 7 4399 1 1 8 ASP CB C 0.988 0.108 -9.502 1.00 . A A . 8 ASP CB 1 1 7 4400 1 1 8 ASP CG C 1.438 1.551 -9.594 1.00 . A A . 8 ASP CG 1 1 7 4401 1 1 8 ASP H H 0.832 0.075 -6.876 1.00 . A A . 8 ASP H 1 1 7 4402 1 1 8 ASP HA H -1.024 0.615 -9.016 1.00 . A A . 8 ASP HA 1 1 7 4403 1 1 8 ASP HB2 H 1.790 -0.465 -9.058 1.00 . A A . 8 ASP HB2 1 1 7 4404 1 1 8 ASP HB3 H 0.807 -0.262 -10.500 1.00 . A A . 8 ASP HB3 1 1 7 4405 1 1 8 ASP N N -0.060 0.212 -7.264 1.00 . A A . 8 ASP N 1 1 7 4406 1 1 8 ASP O O -1.841 -1.657 -9.560 1.00 . A A . 8 ASP O 1 1 7 4407 1 1 8 ASP OD1 O 0.744 2.374 -10.229 1.00 . A A . 8 ASP OD1 1 1 7 4408 1 1 8 ASP OD2 O 2.533 1.891 -9.081 1.00 . A A . 8 ASP OD2 1 1 7 4409 1 1 9 THR C C -1.915 -4.085 -7.619 1.00 . A A . 9 THR C 1 1 7 4410 1 1 9 THR CA C -0.659 -3.819 -8.454 1.00 . A A . 9 THR CA 1 1 7 4411 1 1 9 THR CB C 0.457 -4.786 -8.082 1.00 . A A . 9 THR CB 1 1 7 4412 1 1 9 THR CG2 C 0.119 -6.193 -8.496 1.00 . A A . 9 THR CG2 1 1 7 4413 1 1 9 THR H H 0.601 -2.353 -7.737 1.00 . A A . 9 THR H 1 1 7 4414 1 1 9 THR HA H -0.903 -3.958 -9.496 1.00 . A A . 9 THR HA 1 1 7 4415 1 1 9 THR HB H 0.622 -4.749 -7.015 1.00 . A A . 9 THR HB 1 1 7 4416 1 1 9 THR HG1 H 2.203 -3.986 -8.072 1.00 . A A . 9 THR HG1 1 1 7 4417 1 1 9 THR HG21 H 0.928 -6.849 -8.217 1.00 . A A . 9 THR HG21 1 1 7 4418 1 1 9 THR HG22 H -0.027 -6.204 -9.565 1.00 . A A . 9 THR HG22 1 1 7 4419 1 1 9 THR HG23 H -0.791 -6.486 -7.995 1.00 . A A . 9 THR HG23 1 1 7 4420 1 1 9 THR N N -0.212 -2.470 -8.285 1.00 . A A . 9 THR N 1 1 7 4421 1 1 9 THR O O -2.746 -4.953 -7.965 1.00 . A A . 9 THR O 1 1 7 4422 1 1 9 THR OG1 O 1.646 -4.380 -8.767 1.00 . A A . 9 THR OG1 1 1 7 4423 1 1 10 TYR C C -4.424 -2.741 -6.341 1.00 . A A . 10 TYR C 1 1 7 4424 1 1 10 TYR CA C -3.251 -3.491 -5.732 1.00 . A A . 10 TYR CA 1 1 7 4425 1 1 10 TYR CB C -3.009 -3.066 -4.271 1.00 . A A . 10 TYR CB 1 1 7 4426 1 1 10 TYR CD1 C -5.294 -2.707 -3.226 1.00 . A A . 10 TYR CD1 1 1 7 4427 1 1 10 TYR CD2 C -4.016 -4.570 -2.493 1.00 . A A . 10 TYR CD2 1 1 7 4428 1 1 10 TYR CE1 C -6.308 -3.052 -2.369 1.00 . A A . 10 TYR CE1 1 1 7 4429 1 1 10 TYR CE2 C -5.030 -4.924 -1.624 1.00 . A A . 10 TYR CE2 1 1 7 4430 1 1 10 TYR CG C -4.132 -3.455 -3.311 1.00 . A A . 10 TYR CG 1 1 7 4431 1 1 10 TYR CZ C -6.175 -4.159 -1.569 1.00 . A A . 10 TYR CZ 1 1 7 4432 1 1 10 TYR H H -1.424 -2.636 -6.347 1.00 . A A . 10 TYR H 1 1 7 4433 1 1 10 TYR HA H -3.487 -4.544 -5.759 1.00 . A A . 10 TYR HA 1 1 7 4434 1 1 10 TYR HB2 H -2.100 -3.526 -3.916 1.00 . A A . 10 TYR HB2 1 1 7 4435 1 1 10 TYR HB3 H -2.900 -1.993 -4.235 1.00 . A A . 10 TYR HB3 1 1 7 4436 1 1 10 TYR HD1 H -5.392 -1.842 -3.866 1.00 . A A . 10 TYR HD1 1 1 7 4437 1 1 10 TYR HD2 H -3.116 -5.164 -2.542 1.00 . A A . 10 TYR HD2 1 1 7 4438 1 1 10 TYR HE1 H -7.196 -2.440 -2.332 1.00 . A A . 10 TYR HE1 1 1 7 4439 1 1 10 TYR HE2 H -4.919 -5.795 -0.994 1.00 . A A . 10 TYR HE2 1 1 7 4440 1 1 10 TYR HH H -8.031 -4.423 -1.205 1.00 . A A . 10 TYR HH 1 1 7 4441 1 1 10 TYR N N -2.092 -3.321 -6.560 1.00 . A A . 10 TYR N 1 1 7 4442 1 1 10 TYR O O -4.696 -1.578 -6.017 1.00 . A A . 10 TYR O 1 1 7 4443 1 1 10 TYR OH O -7.195 -4.510 -0.722 1.00 . A A . 10 TYR OH 1 1 7 4444 1 1 11 LYS C C -7.377 -3.450 -7.148 1.00 . A A . 11 LYS C 1 1 7 4445 1 1 11 LYS CA C -6.217 -2.853 -7.892 1.00 . A A . 11 LYS CA 1 1 7 4446 1 1 11 LYS CB C -6.283 -3.245 -9.348 1.00 . A A . 11 LYS CB 1 1 7 4447 1 1 11 LYS CD C -5.143 -3.314 -11.530 1.00 . A A . 11 LYS CD 1 1 7 4448 1 1 11 LYS CE C -3.998 -2.811 -12.366 1.00 . A A . 11 LYS CE 1 1 7 4449 1 1 11 LYS CG C -5.132 -2.717 -10.158 1.00 . A A . 11 LYS CG 1 1 7 4450 1 1 11 LYS H H -4.606 -4.161 -7.694 1.00 . A A . 11 LYS H 1 1 7 4451 1 1 11 LYS HA H -6.232 -1.777 -7.807 1.00 . A A . 11 LYS HA 1 1 7 4452 1 1 11 LYS HB2 H -6.285 -4.323 -9.416 1.00 . A A . 11 LYS HB2 1 1 7 4453 1 1 11 LYS HB3 H -7.200 -2.865 -9.772 1.00 . A A . 11 LYS HB3 1 1 7 4454 1 1 11 LYS HD2 H -5.072 -4.388 -11.449 1.00 . A A . 11 LYS HD2 1 1 7 4455 1 1 11 LYS HD3 H -6.074 -3.051 -12.012 1.00 . A A . 11 LYS HD3 1 1 7 4456 1 1 11 LYS HE2 H -4.013 -3.434 -13.243 1.00 . A A . 11 LYS HE2 1 1 7 4457 1 1 11 LYS HE3 H -4.141 -1.772 -12.621 1.00 . A A . 11 LYS HE3 1 1 7 4458 1 1 11 LYS HG2 H -5.220 -1.644 -10.239 1.00 . A A . 11 LYS HG2 1 1 7 4459 1 1 11 LYS HG3 H -4.205 -2.972 -9.666 1.00 . A A . 11 LYS HG3 1 1 7 4460 1 1 11 LYS HZ1 H -2.585 -2.491 -10.837 1.00 . A A . 11 LYS HZ1 1 1 7 4461 1 1 11 LYS HZ2 H -1.939 -2.663 -12.373 1.00 . A A . 11 LYS HZ2 1 1 7 4462 1 1 11 LYS HZ3 H -2.482 -4.024 -11.567 1.00 . A A . 11 LYS HZ3 1 1 7 4463 1 1 11 LYS N N -5.019 -3.353 -7.315 1.00 . A A . 11 LYS N 1 1 7 4464 1 1 11 LYS NZ N -2.679 -3.016 -11.734 1.00 . A A . 11 LYS NZ 1 1 7 4465 1 1 11 LYS O O -7.604 -4.667 -7.212 1.00 . A A . 11 LYS O 1 1 7 4466 1 1 12 GLY C C -9.378 -2.284 -4.435 1.00 . A A . 12 GLY C 1 1 7 4467 1 1 12 GLY CA C -9.172 -3.096 -5.671 1.00 . A A . 12 GLY CA 1 1 7 4468 1 1 12 GLY H H -7.737 -1.722 -6.258 1.00 . A A . 12 GLY H 1 1 7 4469 1 1 12 GLY HA2 H -10.033 -3.000 -6.312 1.00 . A A . 12 GLY HA2 1 1 7 4470 1 1 12 GLY HA3 H -9.038 -4.131 -5.396 1.00 . A A . 12 GLY HA3 1 1 7 4471 1 1 12 GLY N N -8.034 -2.647 -6.385 1.00 . A A . 12 GLY N 1 1 7 4472 1 1 12 GLY O O -8.545 -1.416 -4.124 1.00 . A A . 12 GLY O 1 1 7 4473 1 1 13 PRO C C -10.084 -2.564 -1.336 1.00 . A A . 13 PRO C 1 1 7 4474 1 1 13 PRO CA C -10.744 -1.816 -2.492 1.00 . A A . 13 PRO CA 1 1 7 4475 1 1 13 PRO CB C -12.282 -1.857 -2.352 1.00 . A A . 13 PRO CB 1 1 7 4476 1 1 13 PRO CD C -11.610 -3.331 -4.117 1.00 . A A . 13 PRO CD 1 1 7 4477 1 1 13 PRO CG C -12.779 -2.571 -3.573 1.00 . A A . 13 PRO CG 1 1 7 4478 1 1 13 PRO HA H -10.402 -0.791 -2.504 1.00 . A A . 13 PRO HA 1 1 7 4479 1 1 13 PRO HB2 H -12.543 -2.390 -1.449 1.00 . A A . 13 PRO HB2 1 1 7 4480 1 1 13 PRO HB3 H -12.668 -0.849 -2.301 1.00 . A A . 13 PRO HB3 1 1 7 4481 1 1 13 PRO HD2 H -11.537 -4.295 -3.637 1.00 . A A . 13 PRO HD2 1 1 7 4482 1 1 13 PRO HD3 H -11.685 -3.434 -5.187 1.00 . A A . 13 PRO HD3 1 1 7 4483 1 1 13 PRO HG2 H -13.571 -3.253 -3.300 1.00 . A A . 13 PRO HG2 1 1 7 4484 1 1 13 PRO HG3 H -13.135 -1.855 -4.299 1.00 . A A . 13 PRO HG3 1 1 7 4485 1 1 13 PRO N N -10.488 -2.476 -3.740 1.00 . A A . 13 PRO N 1 1 7 4486 1 1 13 PRO O O -9.823 -3.775 -1.407 1.00 . A A . 13 PRO O 1 1 7 4487 1 1 14 CYS C C -10.258 -2.866 1.817 1.00 . A A . 14 CYS C 1 1 7 4488 1 1 14 CYS CA C -9.194 -2.410 0.851 1.00 . A A . 14 CYS CA 1 1 7 4489 1 1 14 CYS CB C -8.286 -1.401 1.523 1.00 . A A . 14 CYS CB 1 1 7 4490 1 1 14 CYS H H -9.942 -0.883 -0.361 1.00 . A A . 14 CYS H 1 1 7 4491 1 1 14 CYS HA H -8.597 -3.259 0.553 1.00 . A A . 14 CYS HA 1 1 7 4492 1 1 14 CYS HB2 H -7.434 -1.206 0.888 1.00 . A A . 14 CYS HB2 1 1 7 4493 1 1 14 CYS HB3 H -8.839 -0.486 1.672 1.00 . A A . 14 CYS HB3 1 1 7 4494 1 1 14 CYS N N -9.782 -1.852 -0.318 1.00 . A A . 14 CYS N 1 1 7 4495 1 1 14 CYS O O -11.042 -2.053 2.336 1.00 . A A . 14 CYS O 1 1 7 4496 1 1 14 CYS SG S -7.669 -1.951 3.139 1.00 . A A . 14 CYS SG 1 1 7 4497 1 1 15 PHE C C -10.452 -5.041 4.248 1.00 . A A . 15 PHE C 1 1 7 4498 1 1 15 PHE CA C -11.224 -4.727 2.986 1.00 . A A . 15 PHE CA 1 1 7 4499 1 1 15 PHE CB C -11.871 -5.997 2.427 1.00 . A A . 15 PHE CB 1 1 7 4500 1 1 15 PHE CD1 C -12.056 -6.144 -0.067 1.00 . A A . 15 PHE CD1 1 1 7 4501 1 1 15 PHE CD2 C -13.841 -5.139 1.146 1.00 . A A . 15 PHE CD2 1 1 7 4502 1 1 15 PHE CE1 C -12.721 -5.907 -1.246 1.00 . A A . 15 PHE CE1 1 1 7 4503 1 1 15 PHE CE2 C -14.512 -4.904 -0.030 1.00 . A A . 15 PHE CE2 1 1 7 4504 1 1 15 PHE CG C -12.608 -5.762 1.144 1.00 . A A . 15 PHE CG 1 1 7 4505 1 1 15 PHE CZ C -13.953 -5.286 -1.229 1.00 . A A . 15 PHE CZ 1 1 7 4506 1 1 15 PHE H H -9.729 -4.741 1.508 1.00 . A A . 15 PHE H 1 1 7 4507 1 1 15 PHE HA H -11.991 -3.999 3.205 1.00 . A A . 15 PHE HA 1 1 7 4508 1 1 15 PHE HB2 H -11.105 -6.735 2.243 1.00 . A A . 15 PHE HB2 1 1 7 4509 1 1 15 PHE HB3 H -12.573 -6.385 3.151 1.00 . A A . 15 PHE HB3 1 1 7 4510 1 1 15 PHE HD1 H -11.092 -6.632 -0.087 1.00 . A A . 15 PHE HD1 1 1 7 4511 1 1 15 PHE HD2 H -14.285 -4.836 2.084 1.00 . A A . 15 PHE HD2 1 1 7 4512 1 1 15 PHE HE1 H -12.275 -6.208 -2.183 1.00 . A A . 15 PHE HE1 1 1 7 4513 1 1 15 PHE HE2 H -15.475 -4.418 -0.006 1.00 . A A . 15 PHE HE2 1 1 7 4514 1 1 15 PHE HZ H -14.476 -5.096 -2.155 1.00 . A A . 15 PHE HZ 1 1 7 4515 1 1 15 PHE N N -10.317 -4.152 2.027 1.00 . A A . 15 PHE N 1 1 7 4516 1 1 15 PHE O O -10.929 -4.827 5.363 1.00 . A A . 15 PHE O 1 1 7 4517 1 1 16 THR C C -7.113 -4.987 4.997 1.00 . A A . 16 THR C 1 1 7 4518 1 1 16 THR CA C -8.379 -5.835 5.148 1.00 . A A . 16 THR CA 1 1 7 4519 1 1 16 THR CB C -8.011 -7.326 5.104 1.00 . A A . 16 THR CB 1 1 7 4520 1 1 16 THR CG2 C -7.388 -7.771 6.426 1.00 . A A . 16 THR CG2 1 1 7 4521 1 1 16 THR H H -8.902 -5.652 3.155 1.00 . A A . 16 THR H 1 1 7 4522 1 1 16 THR HA H -8.876 -5.609 6.080 1.00 . A A . 16 THR HA 1 1 7 4523 1 1 16 THR HB H -7.295 -7.469 4.309 1.00 . A A . 16 THR HB 1 1 7 4524 1 1 16 THR HG1 H -9.102 -8.383 3.920 1.00 . A A . 16 THR HG1 1 1 7 4525 1 1 16 THR HG21 H -7.135 -8.819 6.370 1.00 . A A . 16 THR HG21 1 1 7 4526 1 1 16 THR HG22 H -8.091 -7.615 7.231 1.00 . A A . 16 THR HG22 1 1 7 4527 1 1 16 THR HG23 H -6.493 -7.195 6.613 1.00 . A A . 16 THR HG23 1 1 7 4528 1 1 16 THR N N -9.247 -5.515 4.064 1.00 . A A . 16 THR N 1 1 7 4529 1 1 16 THR O O -6.341 -5.175 4.049 1.00 . A A . 16 THR O 1 1 7 4530 1 1 16 THR OG1 O -9.201 -8.115 4.845 1.00 . A A . 16 THR OG1 1 1 7 4531 1 1 17 THR C C -4.444 -3.870 5.896 1.00 . A A . 17 THR C 1 1 7 4532 1 1 17 THR CA C -5.805 -3.129 5.847 1.00 . A A . 17 THR CA 1 1 7 4533 1 1 17 THR CB C -5.927 -2.027 6.954 1.00 . A A . 17 THR CB 1 1 7 4534 1 1 17 THR CG2 C -5.954 -2.632 8.342 1.00 . A A . 17 THR CG2 1 1 7 4535 1 1 17 THR H H -7.589 -3.950 6.615 1.00 . A A . 17 THR H 1 1 7 4536 1 1 17 THR HA H -5.863 -2.647 4.882 1.00 . A A . 17 THR HA 1 1 7 4537 1 1 17 THR HB H -6.855 -1.499 6.790 1.00 . A A . 17 THR HB 1 1 7 4538 1 1 17 THR HG1 H -5.255 -0.234 6.636 1.00 . A A . 17 THR HG1 1 1 7 4539 1 1 17 THR HG21 H -6.811 -3.281 8.441 1.00 . A A . 17 THR HG21 1 1 7 4540 1 1 17 THR HG22 H -5.996 -1.847 9.083 1.00 . A A . 17 THR HG22 1 1 7 4541 1 1 17 THR HG23 H -5.052 -3.211 8.471 1.00 . A A . 17 THR HG23 1 1 7 4542 1 1 17 THR N N -6.927 -4.050 5.897 1.00 . A A . 17 THR N 1 1 7 4543 1 1 17 THR O O -3.479 -3.466 5.232 1.00 . A A . 17 THR O 1 1 7 4544 1 1 17 THR OG1 O -4.860 -1.084 6.868 1.00 . A A . 17 THR OG1 1 1 7 4545 1 1 18 GLY C C -2.825 -6.375 5.360 1.00 . A A . 18 GLY C 1 1 7 4546 1 1 18 GLY CA C -3.204 -5.794 6.703 1.00 . A A . 18 GLY CA 1 1 7 4547 1 1 18 GLY H H -5.174 -5.261 7.158 1.00 . A A . 18 GLY H 1 1 7 4548 1 1 18 GLY HA2 H -2.393 -5.175 7.055 1.00 . A A . 18 GLY HA2 1 1 7 4549 1 1 18 GLY HA3 H -3.362 -6.602 7.402 1.00 . A A . 18 GLY HA3 1 1 7 4550 1 1 18 GLY N N -4.399 -4.987 6.627 1.00 . A A . 18 GLY N 1 1 7 4551 1 1 18 GLY O O -1.644 -6.464 5.038 1.00 . A A . 18 GLY O 1 1 7 4552 1 1 19 SER C C -3.005 -6.208 2.332 1.00 . A A . 19 SER C 1 1 7 4553 1 1 19 SER CA C -3.626 -7.275 3.232 1.00 . A A . 19 SER CA 1 1 7 4554 1 1 19 SER CB C -4.972 -7.728 2.657 1.00 . A A . 19 SER CB 1 1 7 4555 1 1 19 SER H H -4.754 -6.623 4.875 1.00 . A A . 19 SER H 1 1 7 4556 1 1 19 SER HA H -2.965 -8.124 3.305 1.00 . A A . 19 SER HA 1 1 7 4557 1 1 19 SER HB2 H -5.602 -6.861 2.520 1.00 . A A . 19 SER HB2 1 1 7 4558 1 1 19 SER HB3 H -4.825 -8.216 1.705 1.00 . A A . 19 SER HB3 1 1 7 4559 1 1 19 SER HG H -4.955 -9.139 4.011 1.00 . A A . 19 SER HG 1 1 7 4560 1 1 19 SER N N -3.831 -6.730 4.564 1.00 . A A . 19 SER N 1 1 7 4561 1 1 19 SER O O -2.066 -6.473 1.581 1.00 . A A . 19 SER O 1 1 7 4562 1 1 19 SER OG O -5.629 -8.627 3.543 1.00 . A A . 19 SER OG 1 1 7 4563 1 1 20 CYS C C -1.598 -3.545 2.074 1.00 . A A . 20 CYS C 1 1 7 4564 1 1 20 CYS CA C -3.053 -3.855 1.711 1.00 . A A . 20 CYS CA 1 1 7 4565 1 1 20 CYS CB C -3.958 -2.665 2.026 1.00 . A A . 20 CYS CB 1 1 7 4566 1 1 20 CYS H H -4.257 -4.870 3.094 1.00 . A A . 20 CYS H 1 1 7 4567 1 1 20 CYS HA H -3.122 -4.079 0.657 1.00 . A A . 20 CYS HA 1 1 7 4568 1 1 20 CYS HB2 H -4.950 -2.871 1.654 1.00 . A A . 20 CYS HB2 1 1 7 4569 1 1 20 CYS HB3 H -4.007 -2.543 3.098 1.00 . A A . 20 CYS HB3 1 1 7 4570 1 1 20 CYS N N -3.521 -5.004 2.459 1.00 . A A . 20 CYS N 1 1 7 4571 1 1 20 CYS O O -0.723 -3.415 1.193 1.00 . A A . 20 CYS O 1 1 7 4572 1 1 20 CYS SG S -3.434 -1.092 1.310 1.00 . A A . 20 CYS SG 1 1 7 4573 1 1 21 ASP C C 0.977 -4.313 3.458 1.00 . A A . 21 ASP C 1 1 7 4574 1 1 21 ASP CA C 0.005 -3.222 3.882 1.00 . A A . 21 ASP CA 1 1 7 4575 1 1 21 ASP CB C -0.024 -3.094 5.405 1.00 . A A . 21 ASP CB 1 1 7 4576 1 1 21 ASP CG C 1.347 -2.849 5.998 1.00 . A A . 21 ASP CG 1 1 7 4577 1 1 21 ASP H H -2.072 -3.599 4.015 1.00 . A A . 21 ASP H 1 1 7 4578 1 1 21 ASP HA H 0.337 -2.285 3.463 1.00 . A A . 21 ASP HA 1 1 7 4579 1 1 21 ASP HB2 H -0.641 -2.241 5.643 1.00 . A A . 21 ASP HB2 1 1 7 4580 1 1 21 ASP HB3 H -0.464 -3.977 5.848 1.00 . A A . 21 ASP HB3 1 1 7 4581 1 1 21 ASP N N -1.333 -3.486 3.372 1.00 . A A . 21 ASP N 1 1 7 4582 1 1 21 ASP O O 2.136 -4.039 3.104 1.00 . A A . 21 ASP O 1 1 7 4583 1 1 21 ASP OD1 O 1.956 -3.799 6.533 1.00 . A A . 21 ASP OD1 1 1 7 4584 1 1 21 ASP OD2 O 1.837 -1.692 5.943 1.00 . A A . 21 ASP OD2 1 1 7 4585 1 1 22 ASP C C 1.676 -6.599 1.618 1.00 . A A . 22 ASP C 1 1 7 4586 1 1 22 ASP CA C 1.292 -6.688 3.068 1.00 . A A . 22 ASP CA 1 1 7 4587 1 1 22 ASP CB C 0.553 -8.001 3.310 1.00 . A A . 22 ASP CB 1 1 7 4588 1 1 22 ASP CG C 1.443 -9.205 3.091 1.00 . A A . 22 ASP CG 1 1 7 4589 1 1 22 ASP H H -0.442 -5.675 3.732 1.00 . A A . 22 ASP H 1 1 7 4590 1 1 22 ASP HA H 2.194 -6.682 3.657 1.00 . A A . 22 ASP HA 1 1 7 4591 1 1 22 ASP HB2 H 0.187 -8.024 4.325 1.00 . A A . 22 ASP HB2 1 1 7 4592 1 1 22 ASP HB3 H -0.283 -8.065 2.629 1.00 . A A . 22 ASP HB3 1 1 7 4593 1 1 22 ASP N N 0.491 -5.541 3.453 1.00 . A A . 22 ASP N 1 1 7 4594 1 1 22 ASP O O 2.855 -6.688 1.288 1.00 . A A . 22 ASP O 1 1 7 4595 1 1 22 ASP OD1 O 1.553 -9.699 1.950 1.00 . A A . 22 ASP OD1 1 1 7 4596 1 1 22 ASP OD2 O 2.042 -9.675 4.078 1.00 . A A . 22 ASP OD2 1 1 7 4597 1 1 23 HIS C C 1.850 -5.193 -1.026 1.00 . A A . 23 HIS C 1 1 7 4598 1 1 23 HIS CA C 0.877 -6.307 -0.660 1.00 . A A . 23 HIS CA 1 1 7 4599 1 1 23 HIS CB C -0.481 -6.115 -1.358 1.00 . A A . 23 HIS CB 1 1 7 4600 1 1 23 HIS CD2 C -0.228 -5.106 -3.726 1.00 . A A . 23 HIS CD2 1 1 7 4601 1 1 23 HIS CE1 C -0.565 -6.880 -4.910 1.00 . A A . 23 HIS CE1 1 1 7 4602 1 1 23 HIS CG C -0.428 -6.120 -2.860 1.00 . A A . 23 HIS CG 1 1 7 4603 1 1 23 HIS H H -0.226 -6.254 1.122 1.00 . A A . 23 HIS H 1 1 7 4604 1 1 23 HIS HA H 1.300 -7.247 -0.982 1.00 . A A . 23 HIS HA 1 1 7 4605 1 1 23 HIS HB2 H -1.146 -6.908 -1.054 1.00 . A A . 23 HIS HB2 1 1 7 4606 1 1 23 HIS HB3 H -0.899 -5.170 -1.042 1.00 . A A . 23 HIS HB3 1 1 7 4607 1 1 23 HIS HD1 H -0.751 -8.158 -3.298 1.00 . A A . 23 HIS HD1 1 1 7 4608 1 1 23 HIS HD2 H -0.024 -4.082 -3.452 1.00 . A A . 23 HIS HD2 1 1 7 4609 1 1 23 HIS HE1 H -0.711 -7.548 -5.747 1.00 . A A . 23 HIS HE1 1 1 7 4610 1 1 23 HIS N N 0.687 -6.376 0.773 1.00 . A A . 23 HIS N 1 1 7 4611 1 1 23 HIS ND1 N -0.634 -7.239 -3.631 1.00 . A A . 23 HIS ND1 1 1 7 4612 1 1 23 HIS NE2 N -0.317 -5.592 -5.024 1.00 . A A . 23 HIS NE2 1 1 7 4613 1 1 23 HIS O O 2.840 -5.431 -1.727 1.00 . A A . 23 HIS O 1 1 7 4614 1 1 24 CYS C C 3.872 -3.046 -0.314 1.00 . A A . 24 CYS C 1 1 7 4615 1 1 24 CYS CA C 2.449 -2.875 -0.821 1.00 . A A . 24 CYS CA 1 1 7 4616 1 1 24 CYS CB C 1.847 -1.563 -0.337 1.00 . A A . 24 CYS CB 1 1 7 4617 1 1 24 CYS H H 0.816 -3.874 0.059 1.00 . A A . 24 CYS H 1 1 7 4618 1 1 24 CYS HA H 2.491 -2.837 -1.900 1.00 . A A . 24 CYS HA 1 1 7 4619 1 1 24 CYS HB2 H 1.610 -1.652 0.712 1.00 . A A . 24 CYS HB2 1 1 7 4620 1 1 24 CYS HB3 H 2.572 -0.776 -0.477 1.00 . A A . 24 CYS HB3 1 1 7 4621 1 1 24 CYS N N 1.601 -4.003 -0.520 1.00 . A A . 24 CYS N 1 1 7 4622 1 1 24 CYS O O 4.813 -2.812 -1.043 1.00 . A A . 24 CYS O 1 1 7 4623 1 1 24 CYS SG S 0.332 -1.097 -1.222 1.00 . A A . 24 CYS SG 1 1 7 4624 1 1 25 LYS C C 6.117 -4.859 0.950 1.00 . A A . 25 LYS C 1 1 7 4625 1 1 25 LYS CA C 5.355 -3.612 1.443 1.00 . A A . 25 LYS CA 1 1 7 4626 1 1 25 LYS CB C 5.307 -3.450 2.971 1.00 . A A . 25 LYS CB 1 1 7 4627 1 1 25 LYS CD C 6.373 -3.874 5.216 1.00 . A A . 25 LYS CD 1 1 7 4628 1 1 25 LYS CE C 5.017 -3.717 5.901 1.00 . A A . 25 LYS CE 1 1 7 4629 1 1 25 LYS CG C 6.252 -4.324 3.756 1.00 . A A . 25 LYS CG 1 1 7 4630 1 1 25 LYS H H 3.295 -3.773 1.473 1.00 . A A . 25 LYS H 1 1 7 4631 1 1 25 LYS HA H 5.897 -2.766 1.045 1.00 . A A . 25 LYS HA 1 1 7 4632 1 1 25 LYS HB2 H 5.532 -2.422 3.217 1.00 . A A . 25 LYS HB2 1 1 7 4633 1 1 25 LYS HB3 H 4.298 -3.664 3.295 1.00 . A A . 25 LYS HB3 1 1 7 4634 1 1 25 LYS HD2 H 6.946 -4.610 5.759 1.00 . A A . 25 LYS HD2 1 1 7 4635 1 1 25 LYS HD3 H 6.893 -2.928 5.243 1.00 . A A . 25 LYS HD3 1 1 7 4636 1 1 25 LYS HE2 H 5.181 -3.357 6.907 1.00 . A A . 25 LYS HE2 1 1 7 4637 1 1 25 LYS HE3 H 4.439 -2.983 5.360 1.00 . A A . 25 LYS HE3 1 1 7 4638 1 1 25 LYS HG2 H 5.826 -5.315 3.708 1.00 . A A . 25 LYS HG2 1 1 7 4639 1 1 25 LYS HG3 H 7.216 -4.310 3.272 1.00 . A A . 25 LYS HG3 1 1 7 4640 1 1 25 LYS HZ1 H 3.291 -4.738 6.329 1.00 . A A . 25 LYS HZ1 1 1 7 4641 1 1 25 LYS HZ2 H 4.686 -5.630 6.663 1.00 . A A . 25 LYS HZ2 1 1 7 4642 1 1 25 LYS HZ3 H 4.158 -5.478 5.075 1.00 . A A . 25 LYS HZ3 1 1 7 4643 1 1 25 LYS N N 4.043 -3.495 0.899 1.00 . A A . 25 LYS N 1 1 7 4644 1 1 25 LYS NZ N 4.247 -4.980 5.979 1.00 . A A . 25 LYS NZ 1 1 7 4645 1 1 25 LYS O O 7.322 -4.798 0.717 1.00 . A A . 25 LYS O 1 1 7 4646 1 1 26 ASN C C 6.169 -7.346 -1.176 1.00 . A A . 26 ASN C 1 1 7 4647 1 1 26 ASN CA C 6.092 -7.197 0.327 1.00 . A A . 26 ASN CA 1 1 7 4648 1 1 26 ASN CB C 5.452 -8.455 0.936 1.00 . A A . 26 ASN CB 1 1 7 4649 1 1 26 ASN CG C 5.659 -8.596 2.426 1.00 . A A . 26 ASN CG 1 1 7 4650 1 1 26 ASN H H 4.446 -5.963 0.861 1.00 . A A . 26 ASN H 1 1 7 4651 1 1 26 ASN HA H 7.104 -7.130 0.695 1.00 . A A . 26 ASN HA 1 1 7 4652 1 1 26 ASN HB2 H 4.388 -8.403 0.768 1.00 . A A . 26 ASN HB2 1 1 7 4653 1 1 26 ASN HB3 H 5.851 -9.328 0.441 1.00 . A A . 26 ASN HB3 1 1 7 4654 1 1 26 ASN HD21 H 3.953 -7.697 2.752 1.00 . A A . 26 ASN HD21 1 1 7 4655 1 1 26 ASN HD22 H 4.821 -8.183 4.172 1.00 . A A . 26 ASN HD22 1 1 7 4656 1 1 26 ASN N N 5.424 -5.961 0.748 1.00 . A A . 26 ASN N 1 1 7 4657 1 1 26 ASN ND2 N 4.725 -8.111 3.196 1.00 . A A . 26 ASN ND2 1 1 7 4658 1 1 26 ASN O O 7.255 -7.388 -1.736 1.00 . A A . 26 ASN O 1 1 7 4659 1 1 26 ASN OD1 O 6.650 -9.181 2.876 1.00 . A A . 26 ASN OD1 1 1 7 4660 1 1 27 LYS C C 5.411 -6.438 -4.072 1.00 . A A . 27 LYS C 1 1 7 4661 1 1 27 LYS CA C 4.992 -7.660 -3.267 1.00 . A A . 27 LYS CA 1 1 7 4662 1 1 27 LYS CB C 3.603 -8.160 -3.710 1.00 . A A . 27 LYS CB 1 1 7 4663 1 1 27 LYS CD C 4.499 -9.874 -5.302 1.00 . A A . 27 LYS CD 1 1 7 4664 1 1 27 LYS CE C 4.515 -10.422 -6.713 1.00 . A A . 27 LYS CE 1 1 7 4665 1 1 27 LYS CG C 3.559 -8.685 -5.145 1.00 . A A . 27 LYS CG 1 1 7 4666 1 1 27 LYS H H 4.177 -7.245 -1.361 1.00 . A A . 27 LYS H 1 1 7 4667 1 1 27 LYS HA H 5.713 -8.442 -3.445 1.00 . A A . 27 LYS HA 1 1 7 4668 1 1 27 LYS HB2 H 3.296 -8.959 -3.053 1.00 . A A . 27 LYS HB2 1 1 7 4669 1 1 27 LYS HB3 H 2.897 -7.346 -3.626 1.00 . A A . 27 LYS HB3 1 1 7 4670 1 1 27 LYS HD2 H 5.502 -9.556 -5.066 1.00 . A A . 27 LYS HD2 1 1 7 4671 1 1 27 LYS HD3 H 4.196 -10.656 -4.622 1.00 . A A . 27 LYS HD3 1 1 7 4672 1 1 27 LYS HE2 H 3.517 -10.740 -6.975 1.00 . A A . 27 LYS HE2 1 1 7 4673 1 1 27 LYS HE3 H 4.832 -9.641 -7.387 1.00 . A A . 27 LYS HE3 1 1 7 4674 1 1 27 LYS HG2 H 2.551 -8.994 -5.380 1.00 . A A . 27 LYS HG2 1 1 7 4675 1 1 27 LYS HG3 H 3.867 -7.898 -5.818 1.00 . A A . 27 LYS HG3 1 1 7 4676 1 1 27 LYS HZ1 H 5.144 -12.352 -6.217 1.00 . A A . 27 LYS HZ1 1 1 7 4677 1 1 27 LYS HZ2 H 6.403 -11.318 -6.531 1.00 . A A . 27 LYS HZ2 1 1 7 4678 1 1 27 LYS HZ3 H 5.483 -11.929 -7.807 1.00 . A A . 27 LYS HZ3 1 1 7 4679 1 1 27 LYS N N 5.025 -7.390 -1.835 1.00 . A A . 27 LYS N 1 1 7 4680 1 1 27 LYS NZ N 5.440 -11.569 -6.833 1.00 . A A . 27 LYS NZ 1 1 7 4681 1 1 27 LYS O O 6.203 -6.541 -5.014 1.00 . A A . 27 LYS O 1 1 7 4682 1 1 28 GLU C C 6.591 -3.533 -3.915 1.00 . A A . 28 GLU C 1 1 7 4683 1 1 28 GLU CA C 5.238 -4.042 -4.367 1.00 . A A . 28 GLU CA 1 1 7 4684 1 1 28 GLU CB C 4.174 -2.984 -4.097 1.00 . A A . 28 GLU CB 1 1 7 4685 1 1 28 GLU CD C 2.765 -3.245 -6.147 1.00 . A A . 28 GLU CD 1 1 7 4686 1 1 28 GLU CG C 2.807 -3.321 -4.648 1.00 . A A . 28 GLU CG 1 1 7 4687 1 1 28 GLU H H 4.257 -5.278 -2.948 1.00 . A A . 28 GLU H 1 1 7 4688 1 1 28 GLU HA H 5.272 -4.237 -5.428 1.00 . A A . 28 GLU HA 1 1 7 4689 1 1 28 GLU HB2 H 4.097 -2.845 -3.029 1.00 . A A . 28 GLU HB2 1 1 7 4690 1 1 28 GLU HB3 H 4.498 -2.055 -4.540 1.00 . A A . 28 GLU HB3 1 1 7 4691 1 1 28 GLU HG2 H 2.546 -4.325 -4.347 1.00 . A A . 28 GLU HG2 1 1 7 4692 1 1 28 GLU HG3 H 2.084 -2.627 -4.244 1.00 . A A . 28 GLU HG3 1 1 7 4693 1 1 28 GLU N N 4.903 -5.289 -3.691 1.00 . A A . 28 GLU N 1 1 7 4694 1 1 28 GLU O O 7.161 -2.632 -4.545 1.00 . A A . 28 GLU O 1 1 7 4695 1 1 28 GLU OE1 O 3.421 -4.063 -6.833 1.00 . A A . 28 GLU OE1 1 1 7 4696 1 1 28 GLU OE2 O 2.061 -2.366 -6.685 1.00 . A A . 28 GLU OE2 1 1 7 4697 1 1 29 HIS C C 8.425 -2.286 -1.818 1.00 . A A . 29 HIS C 1 1 7 4698 1 1 29 HIS CA C 8.374 -3.745 -2.211 1.00 . A A . 29 HIS CA 1 1 7 4699 1 1 29 HIS CB C 9.587 -4.144 -3.066 1.00 . A A . 29 HIS CB 1 1 7 4700 1 1 29 HIS CD2 C 10.500 -6.192 -1.796 1.00 . A A . 29 HIS CD2 1 1 7 4701 1 1 29 HIS CE1 C 10.485 -7.653 -3.389 1.00 . A A . 29 HIS CE1 1 1 7 4702 1 1 29 HIS CG C 10.003 -5.569 -2.892 1.00 . A A . 29 HIS CG 1 1 7 4703 1 1 29 HIS H H 6.579 -4.852 -2.426 1.00 . A A . 29 HIS H 1 1 7 4704 1 1 29 HIS HA H 8.419 -4.305 -1.287 1.00 . A A . 29 HIS HA 1 1 7 4705 1 1 29 HIS HB2 H 9.345 -3.996 -4.109 1.00 . A A . 29 HIS HB2 1 1 7 4706 1 1 29 HIS HB3 H 10.425 -3.513 -2.805 1.00 . A A . 29 HIS HB3 1 1 7 4707 1 1 29 HIS HD1 H 9.679 -6.393 -4.814 1.00 . A A . 29 HIS HD1 1 1 7 4708 1 1 29 HIS HD2 H 10.633 -5.742 -0.823 1.00 . A A . 29 HIS HD2 1 1 7 4709 1 1 29 HIS HE1 H 10.608 -8.568 -3.949 1.00 . A A . 29 HIS HE1 1 1 7 4710 1 1 29 HIS N N 7.098 -4.122 -2.824 1.00 . A A . 29 HIS N 1 1 7 4711 1 1 29 HIS ND1 N 10.001 -6.513 -3.893 1.00 . A A . 29 HIS ND1 1 1 7 4712 1 1 29 HIS NE2 N 10.804 -7.509 -2.117 1.00 . A A . 29 HIS NE2 1 1 7 4713 1 1 29 HIS O O 9.423 -1.595 -2.037 1.00 . A A . 29 HIS O 1 1 7 4714 1 1 30 LEU C C 7.508 -0.500 0.766 1.00 . A A . 30 LEU C 1 1 7 4715 1 1 30 LEU CA C 7.295 -0.481 -0.749 1.00 . A A . 30 LEU CA 1 1 7 4716 1 1 30 LEU CB C 5.957 0.175 -1.121 1.00 . A A . 30 LEU CB 1 1 7 4717 1 1 30 LEU CD1 C 4.313 0.935 -2.872 1.00 . A A . 30 LEU CD1 1 1 7 4718 1 1 30 LEU CD2 C 6.735 0.692 -3.481 1.00 . A A . 30 LEU CD2 1 1 7 4719 1 1 30 LEU CG C 5.593 0.163 -2.617 1.00 . A A . 30 LEU CG 1 1 7 4720 1 1 30 LEU H H 6.572 -2.402 -1.127 1.00 . A A . 30 LEU H 1 1 7 4721 1 1 30 LEU HA H 8.103 0.055 -1.222 1.00 . A A . 30 LEU HA 1 1 7 4722 1 1 30 LEU HB2 H 5.174 -0.336 -0.580 1.00 . A A . 30 LEU HB2 1 1 7 4723 1 1 30 LEU HB3 H 5.984 1.203 -0.791 1.00 . A A . 30 LEU HB3 1 1 7 4724 1 1 30 LEU HD11 H 3.499 0.470 -2.335 1.00 . A A . 30 LEU HD11 1 1 7 4725 1 1 30 LEU HD12 H 4.095 0.934 -3.929 1.00 . A A . 30 LEU HD12 1 1 7 4726 1 1 30 LEU HD13 H 4.429 1.953 -2.531 1.00 . A A . 30 LEU HD13 1 1 7 4727 1 1 30 LEU HD21 H 6.416 0.741 -4.513 1.00 . A A . 30 LEU HD21 1 1 7 4728 1 1 30 LEU HD22 H 7.575 0.017 -3.406 1.00 . A A . 30 LEU HD22 1 1 7 4729 1 1 30 LEU HD23 H 7.034 1.671 -3.143 1.00 . A A . 30 LEU HD23 1 1 7 4730 1 1 30 LEU HG H 5.402 -0.862 -2.900 1.00 . A A . 30 LEU HG 1 1 7 4731 1 1 30 LEU N N 7.358 -1.823 -1.236 1.00 . A A . 30 LEU N 1 1 7 4732 1 1 30 LEU O O 7.743 -1.566 1.345 1.00 . A A . 30 LEU O 1 1 7 4733 1 1 31 ARG C C 6.443 0.342 3.648 1.00 . A A . 31 ARG C 1 1 7 4734 1 1 31 ARG CA C 7.663 0.756 2.820 1.00 . A A . 31 ARG CA 1 1 7 4735 1 1 31 ARG CB C 8.110 2.185 3.165 1.00 . A A . 31 ARG CB 1 1 7 4736 1 1 31 ARG CD C 8.623 3.910 4.897 1.00 . A A . 31 ARG CD 1 1 7 4737 1 1 31 ARG CG C 8.131 2.504 4.652 1.00 . A A . 31 ARG CG 1 1 7 4738 1 1 31 ARG CZ C 8.903 5.393 6.880 1.00 . A A . 31 ARG CZ 1 1 7 4739 1 1 31 ARG H H 7.198 1.445 0.876 1.00 . A A . 31 ARG H 1 1 7 4740 1 1 31 ARG HA H 8.473 0.085 3.062 1.00 . A A . 31 ARG HA 1 1 7 4741 1 1 31 ARG HB2 H 9.106 2.339 2.776 1.00 . A A . 31 ARG HB2 1 1 7 4742 1 1 31 ARG HB3 H 7.440 2.878 2.678 1.00 . A A . 31 ARG HB3 1 1 7 4743 1 1 31 ARG HD2 H 9.692 3.937 4.752 1.00 . A A . 31 ARG HD2 1 1 7 4744 1 1 31 ARG HD3 H 8.144 4.564 4.183 1.00 . A A . 31 ARG HD3 1 1 7 4745 1 1 31 ARG HE H 7.539 3.921 6.665 1.00 . A A . 31 ARG HE 1 1 7 4746 1 1 31 ARG HG2 H 7.130 2.408 5.046 1.00 . A A . 31 ARG HG2 1 1 7 4747 1 1 31 ARG HG3 H 8.786 1.807 5.150 1.00 . A A . 31 ARG HG3 1 1 7 4748 1 1 31 ARG HH11 H 10.480 5.539 5.594 1.00 . A A . 31 ARG HH11 1 1 7 4749 1 1 31 ARG HH12 H 10.510 6.656 6.875 1.00 . A A . 31 ARG HH12 1 1 7 4750 1 1 31 ARG HH21 H 7.543 5.465 8.392 1.00 . A A . 31 ARG HH21 1 1 7 4751 1 1 31 ARG HH22 H 8.775 6.622 8.526 1.00 . A A . 31 ARG HH22 1 1 7 4752 1 1 31 ARG N N 7.426 0.641 1.393 1.00 . A A . 31 ARG N 1 1 7 4753 1 1 31 ARG NE N 8.310 4.375 6.248 1.00 . A A . 31 ARG NE 1 1 7 4754 1 1 31 ARG NH1 N 10.037 5.900 6.417 1.00 . A A . 31 ARG NH1 1 1 7 4755 1 1 31 ARG NH2 N 8.380 5.860 8.003 1.00 . A A . 31 ARG NH2 1 1 7 4756 1 1 31 ARG O O 6.563 -0.455 4.586 1.00 . A A . 31 ARG O 1 1 7 4757 1 1 32 SER C C 2.874 0.774 3.142 1.00 . A A . 32 SER C 1 1 7 4758 1 1 32 SER CA C 4.078 0.589 4.053 1.00 . A A . 32 SER CA 1 1 7 4759 1 1 32 SER CB C 4.002 1.534 5.271 1.00 . A A . 32 SER CB 1 1 7 4760 1 1 32 SER H H 5.218 1.456 2.526 1.00 . A A . 32 SER H 1 1 7 4761 1 1 32 SER HA H 4.116 -0.432 4.398 1.00 . A A . 32 SER HA 1 1 7 4762 1 1 32 SER HB2 H 3.067 1.381 5.786 1.00 . A A . 32 SER HB2 1 1 7 4763 1 1 32 SER HB3 H 4.822 1.320 5.941 1.00 . A A . 32 SER HB3 1 1 7 4764 1 1 32 SER HG H 3.225 3.132 4.495 1.00 . A A . 32 SER HG 1 1 7 4765 1 1 32 SER N N 5.289 0.868 3.307 1.00 . A A . 32 SER N 1 1 7 4766 1 1 32 SER O O 2.996 1.413 2.091 1.00 . A A . 32 SER O 1 1 7 4767 1 1 32 SER OG O 4.084 2.906 4.870 1.00 . A A . 32 SER OG 1 1 7 4768 1 1 33 GLY C C -0.659 0.595 3.578 1.00 . A A . 33 GLY C 1 1 7 4769 1 1 33 GLY CA C 0.547 0.374 2.720 1.00 . A A . 33 GLY CA 1 1 7 4770 1 1 33 GLY H H 1.668 -0.263 4.370 1.00 . A A . 33 GLY H 1 1 7 4771 1 1 33 GLY HA2 H 0.671 1.219 2.060 1.00 . A A . 33 GLY HA2 1 1 7 4772 1 1 33 GLY HA3 H 0.401 -0.515 2.126 1.00 . A A . 33 GLY HA3 1 1 7 4773 1 1 33 GLY N N 1.737 0.234 3.523 1.00 . A A . 33 GLY N 1 1 7 4774 1 1 33 GLY O O -0.865 -0.126 4.562 1.00 . A A . 33 GLY O 1 1 7 4775 1 1 34 ARG C C -3.791 2.191 3.197 1.00 . A A . 34 ARG C 1 1 7 4776 1 1 34 ARG CA C -2.590 1.874 4.061 1.00 . A A . 34 ARG CA 1 1 7 4777 1 1 34 ARG CB C -2.308 3.002 5.053 1.00 . A A . 34 ARG CB 1 1 7 4778 1 1 34 ARG CD C -1.704 5.395 5.438 1.00 . A A . 34 ARG CD 1 1 7 4779 1 1 34 ARG CG C -1.943 4.312 4.408 1.00 . A A . 34 ARG CG 1 1 7 4780 1 1 34 ARG CZ C -2.022 7.843 5.174 1.00 . A A . 34 ARG CZ 1 1 7 4781 1 1 34 ARG H H -1.275 2.131 2.462 1.00 . A A . 34 ARG H 1 1 7 4782 1 1 34 ARG HA H -2.815 0.978 4.621 1.00 . A A . 34 ARG HA 1 1 7 4783 1 1 34 ARG HB2 H -3.189 3.160 5.655 1.00 . A A . 34 ARG HB2 1 1 7 4784 1 1 34 ARG HB3 H -1.493 2.702 5.696 1.00 . A A . 34 ARG HB3 1 1 7 4785 1 1 34 ARG HD2 H -2.552 5.464 6.101 1.00 . A A . 34 ARG HD2 1 1 7 4786 1 1 34 ARG HD3 H -0.825 5.141 6.011 1.00 . A A . 34 ARG HD3 1 1 7 4787 1 1 34 ARG HE H -0.878 6.651 4.010 1.00 . A A . 34 ARG HE 1 1 7 4788 1 1 34 ARG HG2 H -1.040 4.154 3.836 1.00 . A A . 34 ARG HG2 1 1 7 4789 1 1 34 ARG HG3 H -2.742 4.612 3.745 1.00 . A A . 34 ARG HG3 1 1 7 4790 1 1 34 ARG HH11 H -3.056 7.105 6.785 1.00 . A A . 34 ARG HH11 1 1 7 4791 1 1 34 ARG HH12 H -3.219 8.782 6.539 1.00 . A A . 34 ARG HH12 1 1 7 4792 1 1 34 ARG HH21 H -1.159 8.863 3.667 1.00 . A A . 34 ARG HH21 1 1 7 4793 1 1 34 ARG HH22 H -2.121 9.833 4.708 1.00 . A A . 34 ARG HH22 1 1 7 4794 1 1 34 ARG N N -1.440 1.584 3.262 1.00 . A A . 34 ARG N 1 1 7 4795 1 1 34 ARG NE N -1.485 6.683 4.797 1.00 . A A . 34 ARG NE 1 1 7 4796 1 1 34 ARG NH1 N -2.824 7.911 6.235 1.00 . A A . 34 ARG NH1 1 1 7 4797 1 1 34 ARG NH2 N -1.760 8.927 4.479 1.00 . A A . 34 ARG NH2 1 1 7 4798 1 1 34 ARG O O -3.670 2.674 2.062 1.00 . A A . 34 ARG O 1 1 7 4799 1 1 35 CYS C C -6.703 3.477 3.415 1.00 . A A . 35 CYS C 1 1 7 4800 1 1 35 CYS CA C -6.162 2.116 3.065 1.00 . A A . 35 CYS CA 1 1 7 4801 1 1 35 CYS CB C -7.095 1.021 3.535 1.00 . A A . 35 CYS CB 1 1 7 4802 1 1 35 CYS H H -4.948 1.611 4.660 1.00 . A A . 35 CYS H 1 1 7 4803 1 1 35 CYS HA H -6.027 2.043 1.997 1.00 . A A . 35 CYS HA 1 1 7 4804 1 1 35 CYS HB2 H -7.459 1.266 4.522 1.00 . A A . 35 CYS HB2 1 1 7 4805 1 1 35 CYS HB3 H -7.928 0.936 2.853 1.00 . A A . 35 CYS HB3 1 1 7 4806 1 1 35 CYS N N -4.921 1.941 3.737 1.00 . A A . 35 CYS N 1 1 7 4807 1 1 35 CYS O O -6.719 3.871 4.590 1.00 . A A . 35 CYS O 1 1 7 4808 1 1 35 CYS SG S -6.256 -0.597 3.610 1.00 . A A . 35 CYS SG 1 1 7 4809 1 1 36 ARG C C -9.097 5.606 2.455 1.00 . A A . 36 ARG C 1 1 7 4810 1 1 36 ARG CA C -7.590 5.542 2.621 1.00 . A A . 36 ARG CA 1 1 7 4811 1 1 36 ARG CB C -6.869 6.557 1.748 1.00 . A A . 36 ARG CB 1 1 7 4812 1 1 36 ARG CD C -5.296 7.155 3.631 1.00 . A A . 36 ARG CD 1 1 7 4813 1 1 36 ARG CG C -5.411 6.804 2.147 1.00 . A A . 36 ARG CG 1 1 7 4814 1 1 36 ARG CZ C -6.784 8.324 5.258 1.00 . A A . 36 ARG CZ 1 1 7 4815 1 1 36 ARG H H -7.018 3.860 1.506 1.00 . A A . 36 ARG H 1 1 7 4816 1 1 36 ARG HA H -7.389 5.785 3.654 1.00 . A A . 36 ARG HA 1 1 7 4817 1 1 36 ARG HB2 H -6.876 6.174 0.738 1.00 . A A . 36 ARG HB2 1 1 7 4818 1 1 36 ARG HB3 H -7.400 7.496 1.783 1.00 . A A . 36 ARG HB3 1 1 7 4819 1 1 36 ARG HD2 H -5.456 6.259 4.211 1.00 . A A . 36 ARG HD2 1 1 7 4820 1 1 36 ARG HD3 H -4.302 7.532 3.823 1.00 . A A . 36 ARG HD3 1 1 7 4821 1 1 36 ARG HE H -6.602 8.738 3.292 1.00 . A A . 36 ARG HE 1 1 7 4822 1 1 36 ARG HG2 H -4.846 5.903 1.961 1.00 . A A . 36 ARG HG2 1 1 7 4823 1 1 36 ARG HG3 H -5.011 7.615 1.557 1.00 . A A . 36 ARG HG3 1 1 7 4824 1 1 36 ARG HH11 H -5.545 6.969 6.180 1.00 . A A . 36 ARG HH11 1 1 7 4825 1 1 36 ARG HH12 H -6.660 7.733 7.209 1.00 . A A . 36 ARG HH12 1 1 7 4826 1 1 36 ARG HH21 H -8.226 9.668 4.690 1.00 . A A . 36 ARG HH21 1 1 7 4827 1 1 36 ARG HH22 H -8.199 9.304 6.359 1.00 . A A . 36 ARG HH22 1 1 7 4828 1 1 36 ARG N N -7.079 4.216 2.420 1.00 . A A . 36 ARG N 1 1 7 4829 1 1 36 ARG NE N -6.278 8.172 4.030 1.00 . A A . 36 ARG NE 1 1 7 4830 1 1 36 ARG NH1 N -6.296 7.629 6.280 1.00 . A A . 36 ARG NH1 1 1 7 4831 1 1 36 ARG NH2 N -7.801 9.151 5.450 1.00 . A A . 36 ARG NH2 1 1 7 4832 1 1 36 ARG O O -9.729 4.584 2.225 1.00 . A A . 36 ARG O 1 1 7 4833 1 1 37 ASP C C -11.836 6.424 1.429 1.00 . A A . 37 ASP C 1 1 7 4834 1 1 37 ASP CA C -11.102 7.122 2.572 1.00 . A A . 37 ASP CA 1 1 7 4835 1 1 37 ASP CB C -11.316 8.638 2.424 1.00 . A A . 37 ASP CB 1 1 7 4836 1 1 37 ASP CG C -10.636 9.454 3.495 1.00 . A A . 37 ASP CG 1 1 7 4837 1 1 37 ASP H H -9.054 7.587 2.736 1.00 . A A . 37 ASP H 1 1 7 4838 1 1 37 ASP HA H -11.530 6.816 3.515 1.00 . A A . 37 ASP HA 1 1 7 4839 1 1 37 ASP HB2 H -10.931 8.958 1.468 1.00 . A A . 37 ASP HB2 1 1 7 4840 1 1 37 ASP HB3 H -12.376 8.844 2.459 1.00 . A A . 37 ASP HB3 1 1 7 4841 1 1 37 ASP N N -9.645 6.816 2.598 1.00 . A A . 37 ASP N 1 1 7 4842 1 1 37 ASP O O -12.895 5.822 1.630 1.00 . A A . 37 ASP O 1 1 7 4843 1 1 37 ASP OD1 O -9.416 9.723 3.369 1.00 . A A . 37 ASP OD1 1 1 7 4844 1 1 37 ASP OD2 O -11.296 9.861 4.472 1.00 . A A . 37 ASP OD2 1 1 7 4845 1 1 38 ASP C C -11.677 4.382 -1.037 1.00 . A A . 38 ASP C 1 1 7 4846 1 1 38 ASP CA C -11.853 5.885 -0.977 1.00 . A A . 38 ASP CA 1 1 7 4847 1 1 38 ASP CB C -11.238 6.474 -2.251 1.00 . A A . 38 ASP CB 1 1 7 4848 1 1 38 ASP CG C -11.488 7.939 -2.450 1.00 . A A . 38 ASP CG 1 1 7 4849 1 1 38 ASP H H -10.376 6.918 0.193 1.00 . A A . 38 ASP H 1 1 7 4850 1 1 38 ASP HA H -12.907 6.117 -0.968 1.00 . A A . 38 ASP HA 1 1 7 4851 1 1 38 ASP HB2 H -10.169 6.324 -2.226 1.00 . A A . 38 ASP HB2 1 1 7 4852 1 1 38 ASP HB3 H -11.641 5.938 -3.098 1.00 . A A . 38 ASP HB3 1 1 7 4853 1 1 38 ASP N N -11.246 6.467 0.244 1.00 . A A . 38 ASP N 1 1 7 4854 1 1 38 ASP O O -11.980 3.760 -2.051 1.00 . A A . 38 ASP O 1 1 7 4855 1 1 38 ASP OD1 O -10.537 8.743 -2.291 1.00 . A A . 38 ASP OD1 1 1 7 4856 1 1 38 ASP OD2 O -12.612 8.322 -2.815 1.00 . A A . 38 ASP OD2 1 1 7 4857 1 1 39 PHE C C -9.757 1.928 -0.747 1.00 . A A . 39 PHE C 1 1 7 4858 1 1 39 PHE CA C -10.877 2.378 0.171 1.00 . A A . 39 PHE CA 1 1 7 4859 1 1 39 PHE CB C -12.142 1.513 -0.038 1.00 . A A . 39 PHE CB 1 1 7 4860 1 1 39 PHE CD1 C -14.242 2.651 0.719 1.00 . A A . 39 PHE CD1 1 1 7 4861 1 1 39 PHE CD2 C -13.204 1.097 2.186 1.00 . A A . 39 PHE CD2 1 1 7 4862 1 1 39 PHE CE1 C -15.229 2.881 1.652 1.00 . A A . 39 PHE CE1 1 1 7 4863 1 1 39 PHE CE2 C -14.187 1.321 3.124 1.00 . A A . 39 PHE CE2 1 1 7 4864 1 1 39 PHE CG C -13.218 1.758 0.976 1.00 . A A . 39 PHE CG 1 1 7 4865 1 1 39 PHE CZ C -15.202 2.215 2.856 1.00 . A A . 39 PHE CZ 1 1 7 4866 1 1 39 PHE H H -10.926 4.382 0.808 1.00 . A A . 39 PHE H 1 1 7 4867 1 1 39 PHE HA H -10.530 2.235 1.184 1.00 . A A . 39 PHE HA 1 1 7 4868 1 1 39 PHE HB2 H -12.553 1.724 -1.015 1.00 . A A . 39 PHE HB2 1 1 7 4869 1 1 39 PHE HB3 H -11.865 0.470 0.007 1.00 . A A . 39 PHE HB3 1 1 7 4870 1 1 39 PHE HD1 H -14.262 3.172 -0.228 1.00 . A A . 39 PHE HD1 1 1 7 4871 1 1 39 PHE HD2 H -12.409 0.395 2.395 1.00 . A A . 39 PHE HD2 1 1 7 4872 1 1 39 PHE HE1 H -16.024 3.581 1.439 1.00 . A A . 39 PHE HE1 1 1 7 4873 1 1 39 PHE HE2 H -14.162 0.798 4.070 1.00 . A A . 39 PHE HE2 1 1 7 4874 1 1 39 PHE HZ H -15.975 2.398 3.587 1.00 . A A . 39 PHE HZ 1 1 7 4875 1 1 39 PHE N N -11.145 3.812 0.038 1.00 . A A . 39 PHE N 1 1 7 4876 1 1 39 PHE O O -9.529 0.747 -0.909 1.00 . A A . 39 PHE O 1 1 7 4877 1 1 40 ARG C C -6.664 2.596 -1.384 1.00 . A A . 40 ARG C 1 1 7 4878 1 1 40 ARG CA C -7.953 2.518 -2.191 1.00 . A A . 40 ARG CA 1 1 7 4879 1 1 40 ARG CB C -7.903 3.469 -3.390 1.00 . A A . 40 ARG CB 1 1 7 4880 1 1 40 ARG CD C -7.863 1.743 -5.222 1.00 . A A . 40 ARG CD 1 1 7 4881 1 1 40 ARG CG C -7.150 2.933 -4.599 1.00 . A A . 40 ARG CG 1 1 7 4882 1 1 40 ARG CZ C -7.833 0.623 -7.439 1.00 . A A . 40 ARG CZ 1 1 7 4883 1 1 40 ARG H H -9.251 3.798 -1.121 1.00 . A A . 40 ARG H 1 1 7 4884 1 1 40 ARG HA H -8.104 1.504 -2.528 1.00 . A A . 40 ARG HA 1 1 7 4885 1 1 40 ARG HB2 H -8.906 3.698 -3.712 1.00 . A A . 40 ARG HB2 1 1 7 4886 1 1 40 ARG HB3 H -7.418 4.384 -3.084 1.00 . A A . 40 ARG HB3 1 1 7 4887 1 1 40 ARG HD2 H -7.841 0.913 -4.532 1.00 . A A . 40 ARG HD2 1 1 7 4888 1 1 40 ARG HD3 H -8.887 2.016 -5.426 1.00 . A A . 40 ARG HD3 1 1 7 4889 1 1 40 ARG HE H -6.299 1.631 -6.585 1.00 . A A . 40 ARG HE 1 1 7 4890 1 1 40 ARG HG2 H -7.059 3.716 -5.338 1.00 . A A . 40 ARG HG2 1 1 7 4891 1 1 40 ARG HG3 H -6.166 2.622 -4.279 1.00 . A A . 40 ARG HG3 1 1 7 4892 1 1 40 ARG HH11 H -9.613 0.370 -6.441 1.00 . A A . 40 ARG HH11 1 1 7 4893 1 1 40 ARG HH12 H -9.548 -0.341 -7.978 1.00 . A A . 40 ARG HH12 1 1 7 4894 1 1 40 ARG HH21 H -6.238 0.633 -8.735 1.00 . A A . 40 ARG HH21 1 1 7 4895 1 1 40 ARG HH22 H -7.629 -0.152 -9.326 1.00 . A A . 40 ARG HH22 1 1 7 4896 1 1 40 ARG N N -9.039 2.863 -1.314 1.00 . A A . 40 ARG N 1 1 7 4897 1 1 40 ARG NE N -7.230 1.327 -6.472 1.00 . A A . 40 ARG NE 1 1 7 4898 1 1 40 ARG NH1 N -9.078 0.194 -7.269 1.00 . A A . 40 ARG NH1 1 1 7 4899 1 1 40 ARG NH2 N -7.185 0.341 -8.570 1.00 . A A . 40 ARG NH2 1 1 7 4900 1 1 40 ARG O O -6.597 3.327 -0.376 1.00 . A A . 40 ARG O 1 1 7 4901 1 1 41 CYS C C -3.439 2.853 -1.498 1.00 . A A . 41 CYS C 1 1 7 4902 1 1 41 CYS CA C -4.430 1.796 -1.082 1.00 . A A . 41 CYS CA 1 1 7 4903 1 1 41 CYS CB C -3.816 0.417 -1.202 1.00 . A A . 41 CYS CB 1 1 7 4904 1 1 41 CYS H H -5.763 1.316 -2.602 1.00 . A A . 41 CYS H 1 1 7 4905 1 1 41 CYS HA H -4.659 1.952 -0.039 1.00 . A A . 41 CYS HA 1 1 7 4906 1 1 41 CYS HB2 H -3.834 0.111 -2.237 1.00 . A A . 41 CYS HB2 1 1 7 4907 1 1 41 CYS HB3 H -2.793 0.439 -0.857 1.00 . A A . 41 CYS HB3 1 1 7 4908 1 1 41 CYS N N -5.680 1.858 -1.793 1.00 . A A . 41 CYS N 1 1 7 4909 1 1 41 CYS O O -3.016 2.919 -2.660 1.00 . A A . 41 CYS O 1 1 7 4910 1 1 41 CYS SG S -4.688 -0.833 -0.249 1.00 . A A . 41 CYS SG 1 1 7 4911 1 1 42 TRP C C -0.879 4.090 0.060 1.00 . A A . 42 TRP C 1 1 7 4912 1 1 42 TRP CA C -2.053 4.643 -0.688 1.00 . A A . 42 TRP CA 1 1 7 4913 1 1 42 TRP CB C -2.461 6.013 -0.138 1.00 . A A . 42 TRP CB 1 1 7 4914 1 1 42 TRP CD1 C -2.146 7.931 -1.803 1.00 . A A . 42 TRP CD1 1 1 7 4915 1 1 42 TRP CD2 C -4.235 7.135 -1.742 1.00 . A A . 42 TRP CD2 1 1 7 4916 1 1 42 TRP CE2 C -4.174 8.182 -2.686 1.00 . A A . 42 TRP CE2 1 1 7 4917 1 1 42 TRP CE3 C -5.456 6.486 -1.540 1.00 . A A . 42 TRP CE3 1 1 7 4918 1 1 42 TRP CG C -2.918 6.989 -1.187 1.00 . A A . 42 TRP CG 1 1 7 4919 1 1 42 TRP CH2 C -6.464 7.937 -3.197 1.00 . A A . 42 TRP CH2 1 1 7 4920 1 1 42 TRP CZ2 C -5.284 8.591 -3.419 1.00 . A A . 42 TRP CZ2 1 1 7 4921 1 1 42 TRP CZ3 C -6.558 6.895 -2.270 1.00 . A A . 42 TRP CZ3 1 1 7 4922 1 1 42 TRP H H -3.531 3.597 0.328 1.00 . A A . 42 TRP H 1 1 7 4923 1 1 42 TRP HA H -1.804 4.711 -1.737 1.00 . A A . 42 TRP HA 1 1 7 4924 1 1 42 TRP HB2 H -3.276 5.871 0.555 1.00 . A A . 42 TRP HB2 1 1 7 4925 1 1 42 TRP HB3 H -1.624 6.446 0.389 1.00 . A A . 42 TRP HB3 1 1 7 4926 1 1 42 TRP HD1 H -1.096 8.082 -1.601 1.00 . A A . 42 TRP HD1 1 1 7 4927 1 1 42 TRP HE1 H -2.565 9.380 -3.264 1.00 . A A . 42 TRP HE1 1 1 7 4928 1 1 42 TRP HE3 H -5.543 5.675 -0.833 1.00 . A A . 42 TRP HE3 1 1 7 4929 1 1 42 TRP HH2 H -7.348 8.225 -3.747 1.00 . A A . 42 TRP HH2 1 1 7 4930 1 1 42 TRP HZ2 H -5.229 9.393 -4.142 1.00 . A A . 42 TRP HZ2 1 1 7 4931 1 1 42 TRP HZ3 H -7.512 6.408 -2.126 1.00 . A A . 42 TRP HZ3 1 1 7 4932 1 1 42 TRP N N -3.098 3.678 -0.551 1.00 . A A . 42 TRP N 1 1 7 4933 1 1 42 TRP NE1 N -2.896 8.648 -2.700 1.00 . A A . 42 TRP NE1 1 1 7 4934 1 1 42 TRP O O -0.946 3.866 1.279 1.00 . A A . 42 TRP O 1 1 7 4935 1 1 43 CYS C C 2.527 3.988 -0.172 1.00 . A A . 43 CYS C 1 1 7 4936 1 1 43 CYS CA C 1.268 3.150 -0.068 1.00 . A A . 43 CYS CA 1 1 7 4937 1 1 43 CYS CB C 1.408 1.769 -0.712 1.00 . A A . 43 CYS CB 1 1 7 4938 1 1 43 CYS H H 0.201 4.077 -1.591 1.00 . A A . 43 CYS H 1 1 7 4939 1 1 43 CYS HA H 1.045 3.008 0.979 1.00 . A A . 43 CYS HA 1 1 7 4940 1 1 43 CYS HB2 H 1.621 1.883 -1.765 1.00 . A A . 43 CYS HB2 1 1 7 4941 1 1 43 CYS HB3 H 2.215 1.237 -0.231 1.00 . A A . 43 CYS HB3 1 1 7 4942 1 1 43 CYS N N 0.157 3.815 -0.643 1.00 . A A . 43 CYS N 1 1 7 4943 1 1 43 CYS O O 2.798 4.624 -1.204 1.00 . A A . 43 CYS O 1 1 7 4944 1 1 43 CYS SG S -0.124 0.761 -0.534 1.00 . A A . 43 CYS SG 1 1 7 4945 1 1 44 THR C C 5.612 4.085 0.334 1.00 . A A . 44 THR C 1 1 7 4946 1 1 44 THR CA C 4.453 4.795 1.017 1.00 . A A . 44 THR CA 1 1 7 4947 1 1 44 THR CB C 4.774 5.021 2.499 1.00 . A A . 44 THR CB 1 1 7 4948 1 1 44 THR CG2 C 5.890 6.025 2.668 1.00 . A A . 44 THR CG2 1 1 7 4949 1 1 44 THR H H 3.002 3.455 1.665 1.00 . A A . 44 THR H 1 1 7 4950 1 1 44 THR HA H 4.289 5.754 0.551 1.00 . A A . 44 THR HA 1 1 7 4951 1 1 44 THR HB H 5.062 4.081 2.946 1.00 . A A . 44 THR HB 1 1 7 4952 1 1 44 THR HG1 H 3.625 6.487 3.143 1.00 . A A . 44 THR HG1 1 1 7 4953 1 1 44 THR HG21 H 6.776 5.657 2.172 1.00 . A A . 44 THR HG21 1 1 7 4954 1 1 44 THR HG22 H 6.093 6.166 3.719 1.00 . A A . 44 THR HG22 1 1 7 4955 1 1 44 THR HG23 H 5.596 6.966 2.227 1.00 . A A . 44 THR HG23 1 1 7 4956 1 1 44 THR N N 3.263 4.014 0.904 1.00 . A A . 44 THR N 1 1 7 4957 1 1 44 THR O O 5.923 2.929 0.651 1.00 . A A . 44 THR O 1 1 7 4958 1 1 44 THR OG1 O 3.602 5.522 3.151 1.00 . A A . 44 THR OG1 1 1 7 4959 1 1 45 LYS C C 8.522 5.169 -1.186 1.00 . A A . 45 LYS C 1 1 7 4960 1 1 45 LYS CA C 7.309 4.258 -1.364 1.00 . A A . 45 LYS CA 1 1 7 4961 1 1 45 LYS CB C 6.863 4.146 -2.840 1.00 . A A . 45 LYS CB 1 1 7 4962 1 1 45 LYS CD C 5.591 5.211 -4.774 1.00 . A A . 45 LYS CD 1 1 7 4963 1 1 45 LYS CE C 6.416 4.500 -5.836 1.00 . A A . 45 LYS CE 1 1 7 4964 1 1 45 LYS CG C 6.371 5.450 -3.469 1.00 . A A . 45 LYS CG 1 1 7 4965 1 1 45 LYS H H 5.938 5.698 -0.760 1.00 . A A . 45 LYS H 1 1 7 4966 1 1 45 LYS HA H 7.545 3.273 -0.990 1.00 . A A . 45 LYS HA 1 1 7 4967 1 1 45 LYS HB2 H 7.695 3.787 -3.428 1.00 . A A . 45 LYS HB2 1 1 7 4968 1 1 45 LYS HB3 H 6.059 3.428 -2.896 1.00 . A A . 45 LYS HB3 1 1 7 4969 1 1 45 LYS HD2 H 4.723 4.607 -4.555 1.00 . A A . 45 LYS HD2 1 1 7 4970 1 1 45 LYS HD3 H 5.267 6.167 -5.160 1.00 . A A . 45 LYS HD3 1 1 7 4971 1 1 45 LYS HE2 H 7.302 5.083 -6.032 1.00 . A A . 45 LYS HE2 1 1 7 4972 1 1 45 LYS HE3 H 6.705 3.531 -5.457 1.00 . A A . 45 LYS HE3 1 1 7 4973 1 1 45 LYS HG2 H 5.724 5.952 -2.766 1.00 . A A . 45 LYS HG2 1 1 7 4974 1 1 45 LYS HG3 H 7.224 6.079 -3.679 1.00 . A A . 45 LYS HG3 1 1 7 4975 1 1 45 LYS HZ1 H 5.302 5.226 -7.458 1.00 . A A . 45 LYS HZ1 1 1 7 4976 1 1 45 LYS HZ2 H 4.853 3.668 -6.990 1.00 . A A . 45 LYS HZ2 1 1 7 4977 1 1 45 LYS HZ3 H 6.268 3.917 -7.841 1.00 . A A . 45 LYS HZ3 1 1 7 4978 1 1 45 LYS N N 6.219 4.769 -0.588 1.00 . A A . 45 LYS N 1 1 7 4979 1 1 45 LYS NZ N 5.657 4.318 -7.100 1.00 . A A . 45 LYS NZ 1 1 7 4980 1 1 45 LYS O O 8.374 6.322 -0.756 1.00 . A A . 45 LYS O 1 1 7 4981 1 1 46 ASN C C 11.283 6.108 -2.614 1.00 . A A . 46 ASN C 1 1 7 4982 1 1 46 ASN CA C 10.915 5.443 -1.317 1.00 . A A . 46 ASN CA 1 1 7 4983 1 1 46 ASN CB C 12.099 4.613 -0.791 1.00 . A A . 46 ASN CB 1 1 7 4984 1 1 46 ASN CG C 11.929 4.163 0.647 1.00 . A A . 46 ASN CG 1 1 7 4985 1 1 46 ASN H H 9.763 3.729 -1.772 1.00 . A A . 46 ASN H 1 1 7 4986 1 1 46 ASN HA H 10.697 6.222 -0.601 1.00 . A A . 46 ASN HA 1 1 7 4987 1 1 46 ASN HB2 H 12.216 3.734 -1.406 1.00 . A A . 46 ASN HB2 1 1 7 4988 1 1 46 ASN HB3 H 12.999 5.210 -0.859 1.00 . A A . 46 ASN HB3 1 1 7 4989 1 1 46 ASN HD21 H 12.839 5.787 1.322 1.00 . A A . 46 ASN HD21 1 1 7 4990 1 1 46 ASN HD22 H 12.305 4.678 2.517 1.00 . A A . 46 ASN HD22 1 1 7 4991 1 1 46 ASN N N 9.697 4.658 -1.460 1.00 . A A . 46 ASN N 1 1 7 4992 1 1 46 ASN ND2 N 12.397 4.947 1.577 1.00 . A A . 46 ASN ND2 1 1 7 4993 1 1 46 ASN O O 11.376 5.456 -3.667 1.00 . A A . 46 ASN O 1 1 7 4994 1 1 46 ASN OD1 O 11.390 3.095 0.922 1.00 . A A . 46 ASN OD1 1 1 7 4995 1 1 47 CYS C C 12.895 9.217 -3.185 1.00 . A A . 47 CYS C 1 1 7 4996 1 1 47 CYS CA C 11.831 8.211 -3.639 1.00 . A A . 47 CYS CA 1 1 7 4997 1 1 47 CYS CB C 10.573 8.885 -4.208 1.00 . A A . 47 CYS CB 1 1 7 4998 1 1 47 CYS H H 11.395 7.833 -1.664 1.00 . A A . 47 CYS H 1 1 7 4999 1 1 47 CYS HA H 12.269 7.573 -4.392 1.00 . A A . 47 CYS HA 1 1 7 5000 1 1 47 CYS HB2 H 10.864 9.638 -4.925 1.00 . A A . 47 CYS HB2 1 1 7 5001 1 1 47 CYS HB3 H 9.965 8.141 -4.701 1.00 . A A . 47 CYS HB3 1 1 7 5002 1 1 47 CYS N N 11.481 7.382 -2.536 1.00 . A A . 47 CYS N 1 1 7 5003 1 1 47 CYS O O 12.593 10.159 -2.419 1.00 . A A . 47 CYS O 1 1 7 5004 1 1 47 CYS OXT O 14.077 9.032 -3.537 1.00 . A A . 47 CYS OXT 1 1 7 5005 1 1 47 CYS SG S 9.539 9.696 -2.947 1.00 . A A . 47 CYS SG 1 1 8 5006 1 1 1 LYS C C 9.496 10.646 1.810 1.00 . A A . 1 LYS C 1 1 8 5007 1 1 1 LYS CA C 10.284 11.792 2.382 1.00 . A A . 1 LYS CA 1 1 8 5008 1 1 1 LYS CB C 9.805 13.120 1.772 1.00 . A A . 1 LYS CB 1 1 8 5009 1 1 1 LYS CD C 8.070 14.920 1.594 1.00 . A A . 1 LYS CD 1 1 8 5010 1 1 1 LYS CE C 6.756 15.477 2.134 1.00 . A A . 1 LYS CE 1 1 8 5011 1 1 1 LYS CG C 8.416 13.566 2.200 1.00 . A A . 1 LYS CG 1 1 8 5012 1 1 1 LYS H1 H 11.826 11.500 1.009 1.00 . A A . 1 LYS H1 1 1 8 5013 1 1 1 LYS H2 H 12.003 10.678 2.461 1.00 . A A . 1 LYS H2 1 1 8 5014 1 1 1 LYS H3 H 12.287 12.337 2.414 1.00 . A A . 1 LYS H3 1 1 8 5015 1 1 1 LYS HA H 10.166 11.812 3.455 1.00 . A A . 1 LYS HA 1 1 8 5016 1 1 1 LYS HB2 H 10.499 13.901 2.043 1.00 . A A . 1 LYS HB2 1 1 8 5017 1 1 1 LYS HB3 H 9.806 13.017 0.697 1.00 . A A . 1 LYS HB3 1 1 8 5018 1 1 1 LYS HD2 H 8.864 15.617 1.814 1.00 . A A . 1 LYS HD2 1 1 8 5019 1 1 1 LYS HD3 H 7.989 14.806 0.522 1.00 . A A . 1 LYS HD3 1 1 8 5020 1 1 1 LYS HE2 H 6.569 16.432 1.667 1.00 . A A . 1 LYS HE2 1 1 8 5021 1 1 1 LYS HE3 H 5.961 14.794 1.879 1.00 . A A . 1 LYS HE3 1 1 8 5022 1 1 1 LYS HG2 H 7.691 12.833 1.875 1.00 . A A . 1 LYS HG2 1 1 8 5023 1 1 1 LYS HG3 H 8.395 13.646 3.275 1.00 . A A . 1 LYS HG3 1 1 8 5024 1 1 1 LYS HZ1 H 6.879 14.759 4.104 1.00 . A A . 1 LYS HZ1 1 1 8 5025 1 1 1 LYS HZ2 H 5.907 16.107 3.953 1.00 . A A . 1 LYS HZ2 1 1 8 5026 1 1 1 LYS HZ3 H 7.563 16.278 3.929 1.00 . A A . 1 LYS HZ3 1 1 8 5027 1 1 1 LYS N N 11.690 11.575 2.043 1.00 . A A . 1 LYS N 1 1 8 5028 1 1 1 LYS NZ N 6.783 15.668 3.607 1.00 . A A . 1 LYS NZ 1 1 8 5029 1 1 1 LYS O O 9.718 10.276 0.676 1.00 . A A . 1 LYS O 1 1 8 5030 1 1 2 THR C C 6.692 9.462 1.189 1.00 . A A . 2 THR C 1 1 8 5031 1 1 2 THR CA C 7.846 8.970 2.031 1.00 . A A . 2 THR CA 1 1 8 5032 1 1 2 THR CB C 7.397 7.917 3.070 1.00 . A A . 2 THR CB 1 1 8 5033 1 1 2 THR CG2 C 8.575 7.071 3.499 1.00 . A A . 2 THR CG2 1 1 8 5034 1 1 2 THR H H 8.472 10.336 3.500 1.00 . A A . 2 THR H 1 1 8 5035 1 1 2 THR HA H 8.519 8.483 1.338 1.00 . A A . 2 THR HA 1 1 8 5036 1 1 2 THR HB H 6.674 7.274 2.590 1.00 . A A . 2 THR HB 1 1 8 5037 1 1 2 THR HG1 H 6.842 9.485 4.143 1.00 . A A . 2 THR HG1 1 1 8 5038 1 1 2 THR HG21 H 8.261 6.337 4.226 1.00 . A A . 2 THR HG21 1 1 8 5039 1 1 2 THR HG22 H 9.340 7.705 3.921 1.00 . A A . 2 THR HG22 1 1 8 5040 1 1 2 THR HG23 H 8.964 6.567 2.625 1.00 . A A . 2 THR HG23 1 1 8 5041 1 1 2 THR N N 8.614 10.048 2.573 1.00 . A A . 2 THR N 1 1 8 5042 1 1 2 THR O O 5.871 10.273 1.630 1.00 . A A . 2 THR O 1 1 8 5043 1 1 2 THR OG1 O 6.771 8.524 4.219 1.00 . A A . 2 THR OG1 1 1 8 5044 1 1 3 CYS C C 4.530 8.368 -0.837 1.00 . A A . 3 CYS C 1 1 8 5045 1 1 3 CYS CA C 5.675 9.338 -0.972 1.00 . A A . 3 CYS CA 1 1 8 5046 1 1 3 CYS CB C 6.254 9.281 -2.382 1.00 . A A . 3 CYS CB 1 1 8 5047 1 1 3 CYS H H 7.386 8.376 -0.277 1.00 . A A . 3 CYS H 1 1 8 5048 1 1 3 CYS HA H 5.330 10.339 -0.771 1.00 . A A . 3 CYS HA 1 1 8 5049 1 1 3 CYS HB2 H 6.594 8.276 -2.583 1.00 . A A . 3 CYS HB2 1 1 8 5050 1 1 3 CYS HB3 H 5.483 9.543 -3.091 1.00 . A A . 3 CYS HB3 1 1 8 5051 1 1 3 CYS N N 6.678 9.010 -0.016 1.00 . A A . 3 CYS N 1 1 8 5052 1 1 3 CYS O O 4.728 7.197 -0.461 1.00 . A A . 3 CYS O 1 1 8 5053 1 1 3 CYS SG S 7.664 10.398 -2.654 1.00 . A A . 3 CYS SG 1 1 8 5054 1 1 4 GLU C C 1.579 7.917 -2.400 1.00 . A A . 4 GLU C 1 1 8 5055 1 1 4 GLU CA C 2.184 8.036 -1.002 1.00 . A A . 4 GLU CA 1 1 8 5056 1 1 4 GLU CB C 1.241 8.702 0.000 1.00 . A A . 4 GLU CB 1 1 8 5057 1 1 4 GLU CD C -0.658 8.485 1.595 1.00 . A A . 4 GLU CD 1 1 8 5058 1 1 4 GLU CG C 0.092 7.851 0.459 1.00 . A A . 4 GLU CG 1 1 8 5059 1 1 4 GLU H H 3.251 9.770 -1.403 1.00 . A A . 4 GLU H 1 1 8 5060 1 1 4 GLU HA H 2.468 7.057 -0.644 1.00 . A A . 4 GLU HA 1 1 8 5061 1 1 4 GLU HB2 H 1.812 8.984 0.874 1.00 . A A . 4 GLU HB2 1 1 8 5062 1 1 4 GLU HB3 H 0.842 9.598 -0.450 1.00 . A A . 4 GLU HB3 1 1 8 5063 1 1 4 GLU HG2 H -0.591 7.731 -0.368 1.00 . A A . 4 GLU HG2 1 1 8 5064 1 1 4 GLU HG3 H 0.464 6.888 0.777 1.00 . A A . 4 GLU HG3 1 1 8 5065 1 1 4 GLU N N 3.353 8.838 -1.108 1.00 . A A . 4 GLU N 1 1 8 5066 1 1 4 GLU O O 1.081 8.900 -2.961 1.00 . A A . 4 GLU O 1 1 8 5067 1 1 4 GLU OE1 O -0.110 8.547 2.721 1.00 . A A . 4 GLU OE1 1 1 8 5068 1 1 4 GLU OE2 O -1.811 8.918 1.408 1.00 . A A . 4 GLU OE2 1 1 8 5069 1 1 5 ASN C C 0.279 5.341 -4.421 1.00 . A A . 5 ASN C 1 1 8 5070 1 1 5 ASN CA C 1.260 6.494 -4.353 1.00 . A A . 5 ASN CA 1 1 8 5071 1 1 5 ASN CB C 2.507 6.151 -5.200 1.00 . A A . 5 ASN CB 1 1 8 5072 1 1 5 ASN CG C 2.221 5.848 -6.681 1.00 . A A . 5 ASN CG 1 1 8 5073 1 1 5 ASN H H 2.000 5.972 -2.440 1.00 . A A . 5 ASN H 1 1 8 5074 1 1 5 ASN HA H 0.811 7.392 -4.745 1.00 . A A . 5 ASN HA 1 1 8 5075 1 1 5 ASN HB2 H 3.192 6.984 -5.162 1.00 . A A . 5 ASN HB2 1 1 8 5076 1 1 5 ASN HB3 H 2.990 5.288 -4.764 1.00 . A A . 5 ASN HB3 1 1 8 5077 1 1 5 ASN HD21 H 0.838 7.288 -6.815 1.00 . A A . 5 ASN HD21 1 1 8 5078 1 1 5 ASN HD22 H 1.127 6.360 -8.235 1.00 . A A . 5 ASN HD22 1 1 8 5079 1 1 5 ASN N N 1.667 6.734 -2.966 1.00 . A A . 5 ASN N 1 1 8 5080 1 1 5 ASN ND2 N 1.311 6.572 -7.295 1.00 . A A . 5 ASN ND2 1 1 8 5081 1 1 5 ASN O O 0.466 4.337 -3.747 1.00 . A A . 5 ASN O 1 1 8 5082 1 1 5 ASN OD1 O 2.886 5.002 -7.285 1.00 . A A . 5 ASN OD1 1 1 8 5083 1 1 6 LEU C C -1.169 3.191 -5.978 1.00 . A A . 6 LEU C 1 1 8 5084 1 1 6 LEU CA C -1.753 4.455 -5.408 1.00 . A A . 6 LEU CA 1 1 8 5085 1 1 6 LEU CB C -2.895 4.932 -6.293 1.00 . A A . 6 LEU CB 1 1 8 5086 1 1 6 LEU CD1 C -4.985 6.209 -6.583 1.00 . A A . 6 LEU CD1 1 1 8 5087 1 1 6 LEU CD2 C -4.798 4.604 -4.747 1.00 . A A . 6 LEU CD2 1 1 8 5088 1 1 6 LEU CG C -4.045 5.615 -5.583 1.00 . A A . 6 LEU CG 1 1 8 5089 1 1 6 LEU H H -0.867 6.346 -5.690 1.00 . A A . 6 LEU H 1 1 8 5090 1 1 6 LEU HA H -2.163 4.225 -4.437 1.00 . A A . 6 LEU HA 1 1 8 5091 1 1 6 LEU HB2 H -2.489 5.623 -7.018 1.00 . A A . 6 LEU HB2 1 1 8 5092 1 1 6 LEU HB3 H -3.286 4.076 -6.823 1.00 . A A . 6 LEU HB3 1 1 8 5093 1 1 6 LEU HD11 H -5.796 6.683 -6.051 1.00 . A A . 6 LEU HD11 1 1 8 5094 1 1 6 LEU HD12 H -5.371 5.412 -7.203 1.00 . A A . 6 LEU HD12 1 1 8 5095 1 1 6 LEU HD13 H -4.465 6.935 -7.189 1.00 . A A . 6 LEU HD13 1 1 8 5096 1 1 6 LEU HD21 H -4.147 4.180 -3.998 1.00 . A A . 6 LEU HD21 1 1 8 5097 1 1 6 LEU HD22 H -5.171 3.816 -5.385 1.00 . A A . 6 LEU HD22 1 1 8 5098 1 1 6 LEU HD23 H -5.628 5.094 -4.261 1.00 . A A . 6 LEU HD23 1 1 8 5099 1 1 6 LEU HG H -3.681 6.389 -4.924 1.00 . A A . 6 LEU HG 1 1 8 5100 1 1 6 LEU N N -0.760 5.498 -5.210 1.00 . A A . 6 LEU N 1 1 8 5101 1 1 6 LEU O O -0.348 3.219 -6.901 1.00 . A A . 6 LEU O 1 1 8 5102 1 1 7 ALA C C -2.025 0.416 -7.066 1.00 . A A . 7 ALA C 1 1 8 5103 1 1 7 ALA CA C -1.194 0.801 -5.863 1.00 . A A . 7 ALA CA 1 1 8 5104 1 1 7 ALA CB C -1.406 -0.210 -4.752 1.00 . A A . 7 ALA CB 1 1 8 5105 1 1 7 ALA H H -2.202 2.167 -4.648 1.00 . A A . 7 ALA H 1 1 8 5106 1 1 7 ALA HA H -0.146 0.819 -6.118 1.00 . A A . 7 ALA HA 1 1 8 5107 1 1 7 ALA HB1 H -2.450 -0.210 -4.473 1.00 . A A . 7 ALA HB1 1 1 8 5108 1 1 7 ALA HB2 H -0.808 0.059 -3.895 1.00 . A A . 7 ALA HB2 1 1 8 5109 1 1 7 ALA HB3 H -1.130 -1.198 -5.095 1.00 . A A . 7 ALA HB3 1 1 8 5110 1 1 7 ALA N N -1.588 2.096 -5.415 1.00 . A A . 7 ALA N 1 1 8 5111 1 1 7 ALA O O -3.243 0.224 -6.951 1.00 . A A . 7 ALA O 1 1 8 5112 1 1 8 ASP C C -2.391 -1.566 -9.329 1.00 . A A . 8 ASP C 1 1 8 5113 1 1 8 ASP CA C -2.095 -0.096 -9.425 1.00 . A A . 8 ASP CA 1 1 8 5114 1 1 8 ASP CB C -1.254 0.165 -10.683 1.00 . A A . 8 ASP CB 1 1 8 5115 1 1 8 ASP CG C -1.959 -0.269 -11.968 1.00 . A A . 8 ASP CG 1 1 8 5116 1 1 8 ASP H H -0.437 0.542 -8.238 1.00 . A A . 8 ASP H 1 1 8 5117 1 1 8 ASP HA H -3.023 0.453 -9.490 1.00 . A A . 8 ASP HA 1 1 8 5118 1 1 8 ASP HB2 H -1.047 1.222 -10.750 1.00 . A A . 8 ASP HB2 1 1 8 5119 1 1 8 ASP HB3 H -0.321 -0.375 -10.603 1.00 . A A . 8 ASP HB3 1 1 8 5120 1 1 8 ASP N N -1.396 0.321 -8.212 1.00 . A A . 8 ASP N 1 1 8 5121 1 1 8 ASP O O -3.422 -2.037 -9.785 1.00 . A A . 8 ASP O 1 1 8 5122 1 1 8 ASP OD1 O -1.881 -1.458 -12.358 1.00 . A A . 8 ASP OD1 1 1 8 5123 1 1 8 ASP OD2 O -2.596 0.574 -12.624 1.00 . A A . 8 ASP OD2 1 1 8 5124 1 1 9 THR C C -2.723 -4.088 -7.599 1.00 . A A . 9 THR C 1 1 8 5125 1 1 9 THR CA C -1.560 -3.681 -8.521 1.00 . A A . 9 THR CA 1 1 8 5126 1 1 9 THR CB C -0.239 -4.151 -7.918 1.00 . A A . 9 THR CB 1 1 8 5127 1 1 9 THR CG2 C -0.081 -5.633 -8.112 1.00 . A A . 9 THR CG2 1 1 8 5128 1 1 9 THR H H -0.705 -1.826 -8.297 1.00 . A A . 9 THR H 1 1 8 5129 1 1 9 THR HA H -1.670 -4.143 -9.491 1.00 . A A . 9 THR HA 1 1 8 5130 1 1 9 THR HB H -0.220 -3.918 -6.864 1.00 . A A . 9 THR HB 1 1 8 5131 1 1 9 THR HG1 H 1.607 -3.484 -7.984 1.00 . A A . 9 THR HG1 1 1 8 5132 1 1 9 THR HG21 H 0.876 -5.945 -7.723 1.00 . A A . 9 THR HG21 1 1 8 5133 1 1 9 THR HG22 H -0.144 -5.850 -9.166 1.00 . A A . 9 THR HG22 1 1 8 5134 1 1 9 THR HG23 H -0.874 -6.146 -7.588 1.00 . A A . 9 THR HG23 1 1 8 5135 1 1 9 THR N N -1.494 -2.266 -8.676 1.00 . A A . 9 THR N 1 1 8 5136 1 1 9 THR O O -3.318 -5.160 -7.761 1.00 . A A . 9 THR O 1 1 8 5137 1 1 9 THR OG1 O 0.842 -3.477 -8.592 1.00 . A A . 9 THR OG1 1 1 8 5138 1 1 10 TYR C C -5.470 -3.119 -6.383 1.00 . A A . 10 TYR C 1 1 8 5139 1 1 10 TYR CA C -4.143 -3.513 -5.746 1.00 . A A . 10 TYR CA 1 1 8 5140 1 1 10 TYR CB C -3.921 -2.778 -4.421 1.00 . A A . 10 TYR CB 1 1 8 5141 1 1 10 TYR CD1 C -6.092 -2.682 -3.125 1.00 . A A . 10 TYR CD1 1 1 8 5142 1 1 10 TYR CD2 C -4.374 -4.121 -2.344 1.00 . A A . 10 TYR CD2 1 1 8 5143 1 1 10 TYR CE1 C -6.892 -3.054 -2.069 1.00 . A A . 10 TYR CE1 1 1 8 5144 1 1 10 TYR CE2 C -5.167 -4.504 -1.289 1.00 . A A . 10 TYR CE2 1 1 8 5145 1 1 10 TYR CG C -4.820 -3.208 -3.281 1.00 . A A . 10 TYR CG 1 1 8 5146 1 1 10 TYR CZ C -6.426 -3.966 -1.153 1.00 . A A . 10 TYR CZ 1 1 8 5147 1 1 10 TYR H H -2.626 -2.355 -6.621 1.00 . A A . 10 TYR H 1 1 8 5148 1 1 10 TYR HA H -4.145 -4.580 -5.571 1.00 . A A . 10 TYR HA 1 1 8 5149 1 1 10 TYR HB2 H -2.901 -2.929 -4.104 1.00 . A A . 10 TYR HB2 1 1 8 5150 1 1 10 TYR HB3 H -4.078 -1.722 -4.587 1.00 . A A . 10 TYR HB3 1 1 8 5151 1 1 10 TYR HD1 H -6.453 -1.973 -3.857 1.00 . A A . 10 TYR HD1 1 1 8 5152 1 1 10 TYR HD2 H -3.386 -4.541 -2.456 1.00 . A A . 10 TYR HD2 1 1 8 5153 1 1 10 TYR HE1 H -7.879 -2.625 -1.975 1.00 . A A . 10 TYR HE1 1 1 8 5154 1 1 10 TYR HE2 H -4.785 -5.220 -0.578 1.00 . A A . 10 TYR HE2 1 1 8 5155 1 1 10 TYR HH H -6.696 -4.314 0.710 1.00 . A A . 10 TYR HH 1 1 8 5156 1 1 10 TYR N N -3.077 -3.223 -6.672 1.00 . A A . 10 TYR N 1 1 8 5157 1 1 10 TYR O O -5.966 -2.003 -6.211 1.00 . A A . 10 TYR O 1 1 8 5158 1 1 10 TYR OH O -7.217 -4.337 -0.099 1.00 . A A . 10 TYR OH 1 1 8 5159 1 1 11 LYS C C -8.382 -4.279 -7.103 1.00 . A A . 11 LYS C 1 1 8 5160 1 1 11 LYS CA C -7.204 -3.763 -7.896 1.00 . A A . 11 LYS CA 1 1 8 5161 1 1 11 LYS CB C -7.114 -4.425 -9.265 1.00 . A A . 11 LYS CB 1 1 8 5162 1 1 11 LYS CD C -5.621 -4.785 -11.259 1.00 . A A . 11 LYS CD 1 1 8 5163 1 1 11 LYS CE C -4.276 -4.404 -11.858 1.00 . A A . 11 LYS CE 1 1 8 5164 1 1 11 LYS CG C -5.873 -3.987 -10.009 1.00 . A A . 11 LYS CG 1 1 8 5165 1 1 11 LYS H H -5.517 -4.854 -7.309 1.00 . A A . 11 LYS H 1 1 8 5166 1 1 11 LYS HA H -7.310 -2.696 -8.033 1.00 . A A . 11 LYS HA 1 1 8 5167 1 1 11 LYS HB2 H -7.088 -5.497 -9.136 1.00 . A A . 11 LYS HB2 1 1 8 5168 1 1 11 LYS HB3 H -7.978 -4.154 -9.852 1.00 . A A . 11 LYS HB3 1 1 8 5169 1 1 11 LYS HD2 H -5.616 -5.836 -11.013 1.00 . A A . 11 LYS HD2 1 1 8 5170 1 1 11 LYS HD3 H -6.398 -4.580 -11.979 1.00 . A A . 11 LYS HD3 1 1 8 5171 1 1 11 LYS HE2 H -3.514 -4.585 -11.114 1.00 . A A . 11 LYS HE2 1 1 8 5172 1 1 11 LYS HE3 H -4.098 -5.040 -12.708 1.00 . A A . 11 LYS HE3 1 1 8 5173 1 1 11 LYS HG2 H -5.981 -2.949 -10.282 1.00 . A A . 11 LYS HG2 1 1 8 5174 1 1 11 LYS HG3 H -5.025 -4.090 -9.348 1.00 . A A . 11 LYS HG3 1 1 8 5175 1 1 11 LYS HZ1 H -4.873 -2.756 -13.036 1.00 . A A . 11 LYS HZ1 1 1 8 5176 1 1 11 LYS HZ2 H -3.259 -2.688 -12.563 1.00 . A A . 11 LYS HZ2 1 1 8 5177 1 1 11 LYS HZ3 H -4.448 -2.349 -11.464 1.00 . A A . 11 LYS HZ3 1 1 8 5178 1 1 11 LYS N N -5.987 -4.002 -7.181 1.00 . A A . 11 LYS N 1 1 8 5179 1 1 11 LYS NZ N -4.216 -2.975 -12.262 1.00 . A A . 11 LYS NZ 1 1 8 5180 1 1 11 LYS O O -8.750 -5.458 -7.200 1.00 . A A . 11 LYS O 1 1 8 5181 1 1 12 GLY C C -10.108 -2.851 -4.275 1.00 . A A . 12 GLY C 1 1 8 5182 1 1 12 GLY CA C -10.025 -3.772 -5.461 1.00 . A A . 12 GLY CA 1 1 8 5183 1 1 12 GLY H H -8.505 -2.543 -6.158 1.00 . A A . 12 GLY H 1 1 8 5184 1 1 12 GLY HA2 H -10.921 -3.687 -6.057 1.00 . A A . 12 GLY HA2 1 1 8 5185 1 1 12 GLY HA3 H -9.924 -4.789 -5.110 1.00 . A A . 12 GLY HA3 1 1 8 5186 1 1 12 GLY N N -8.902 -3.434 -6.268 1.00 . A A . 12 GLY N 1 1 8 5187 1 1 12 GLY O O -9.201 -2.034 -4.072 1.00 . A A . 12 GLY O 1 1 8 5188 1 1 13 PRO C C -10.554 -2.685 -1.131 1.00 . A A . 13 PRO C 1 1 8 5189 1 1 13 PRO CA C -11.332 -2.099 -2.305 1.00 . A A . 13 PRO CA 1 1 8 5190 1 1 13 PRO CB C -12.844 -2.153 -2.011 1.00 . A A . 13 PRO CB 1 1 8 5191 1 1 13 PRO CD C -12.355 -3.752 -3.721 1.00 . A A . 13 PRO CD 1 1 8 5192 1 1 13 PRO CG C -13.452 -2.916 -3.145 1.00 . A A . 13 PRO CG 1 1 8 5193 1 1 13 PRO HA H -11.027 -1.076 -2.473 1.00 . A A . 13 PRO HA 1 1 8 5194 1 1 13 PRO HB2 H -13.007 -2.654 -1.069 1.00 . A A . 13 PRO HB2 1 1 8 5195 1 1 13 PRO HB3 H -13.239 -1.149 -1.960 1.00 . A A . 13 PRO HB3 1 1 8 5196 1 1 13 PRO HD2 H -12.269 -4.692 -3.196 1.00 . A A . 13 PRO HD2 1 1 8 5197 1 1 13 PRO HD3 H -12.519 -3.912 -4.775 1.00 . A A . 13 PRO HD3 1 1 8 5198 1 1 13 PRO HG2 H -14.251 -3.546 -2.781 1.00 . A A . 13 PRO HG2 1 1 8 5199 1 1 13 PRO HG3 H -13.828 -2.229 -3.887 1.00 . A A . 13 PRO HG3 1 1 8 5200 1 1 13 PRO N N -11.181 -2.911 -3.498 1.00 . A A . 13 PRO N 1 1 8 5201 1 1 13 PRO O O -10.333 -3.898 -1.059 1.00 . A A . 13 PRO O 1 1 8 5202 1 1 14 CYS C C -10.393 -2.841 1.946 1.00 . A A . 14 CYS C 1 1 8 5203 1 1 14 CYS CA C -9.417 -2.259 0.936 1.00 . A A . 14 CYS CA 1 1 8 5204 1 1 14 CYS CB C -8.640 -1.088 1.555 1.00 . A A . 14 CYS CB 1 1 8 5205 1 1 14 CYS H H -10.276 -0.873 -0.386 1.00 . A A . 14 CYS H 1 1 8 5206 1 1 14 CYS HA H -8.717 -3.028 0.645 1.00 . A A . 14 CYS HA 1 1 8 5207 1 1 14 CYS HB2 H -7.900 -0.743 0.849 1.00 . A A . 14 CYS HB2 1 1 8 5208 1 1 14 CYS HB3 H -9.329 -0.284 1.767 1.00 . A A . 14 CYS HB3 1 1 8 5209 1 1 14 CYS N N -10.123 -1.835 -0.244 1.00 . A A . 14 CYS N 1 1 8 5210 1 1 14 CYS O O -11.235 -2.117 2.509 1.00 . A A . 14 CYS O 1 1 8 5211 1 1 14 CYS SG S -7.771 -1.502 3.104 1.00 . A A . 14 CYS SG 1 1 8 5212 1 1 15 PHE C C -10.383 -5.051 4.370 1.00 . A A . 15 PHE C 1 1 8 5213 1 1 15 PHE CA C -11.173 -4.820 3.095 1.00 . A A . 15 PHE CA 1 1 8 5214 1 1 15 PHE CB C -11.705 -6.157 2.554 1.00 . A A . 15 PHE CB 1 1 8 5215 1 1 15 PHE CD1 C -13.897 -5.581 1.477 1.00 . A A . 15 PHE CD1 1 1 8 5216 1 1 15 PHE CD2 C -12.128 -6.354 0.091 1.00 . A A . 15 PHE CD2 1 1 8 5217 1 1 15 PHE CE1 C -14.717 -5.461 0.376 1.00 . A A . 15 PHE CE1 1 1 8 5218 1 1 15 PHE CE2 C -12.941 -6.238 -1.016 1.00 . A A . 15 PHE CE2 1 1 8 5219 1 1 15 PHE CG C -12.594 -6.026 1.348 1.00 . A A . 15 PHE CG 1 1 8 5220 1 1 15 PHE CZ C -14.239 -5.790 -0.874 1.00 . A A . 15 PHE CZ 1 1 8 5221 1 1 15 PHE H H -9.725 -4.681 1.565 1.00 . A A . 15 PHE H 1 1 8 5222 1 1 15 PHE HA H -12.008 -4.170 3.313 1.00 . A A . 15 PHE HA 1 1 8 5223 1 1 15 PHE HB2 H -10.868 -6.781 2.279 1.00 . A A . 15 PHE HB2 1 1 8 5224 1 1 15 PHE HB3 H -12.268 -6.651 3.332 1.00 . A A . 15 PHE HB3 1 1 8 5225 1 1 15 PHE HD1 H -14.273 -5.323 2.456 1.00 . A A . 15 PHE HD1 1 1 8 5226 1 1 15 PHE HD2 H -11.114 -6.704 -0.023 1.00 . A A . 15 PHE HD2 1 1 8 5227 1 1 15 PHE HE1 H -15.732 -5.111 0.494 1.00 . A A . 15 PHE HE1 1 1 8 5228 1 1 15 PHE HE2 H -12.562 -6.497 -1.993 1.00 . A A . 15 PHE HE2 1 1 8 5229 1 1 15 PHE HZ H -14.879 -5.698 -1.740 1.00 . A A . 15 PHE HZ 1 1 8 5230 1 1 15 PHE N N -10.338 -4.148 2.119 1.00 . A A . 15 PHE N 1 1 8 5231 1 1 15 PHE O O -10.938 -5.150 5.462 1.00 . A A . 15 PHE O 1 1 8 5232 1 1 16 THR C C -6.952 -4.519 5.119 1.00 . A A . 16 THR C 1 1 8 5233 1 1 16 THR CA C -8.216 -5.353 5.341 1.00 . A A . 16 THR CA 1 1 8 5234 1 1 16 THR CB C -7.847 -6.844 5.464 1.00 . A A . 16 THR CB 1 1 8 5235 1 1 16 THR CG2 C -7.100 -7.117 6.760 1.00 . A A . 16 THR CG2 1 1 8 5236 1 1 16 THR H H -8.688 -5.123 3.331 1.00 . A A . 16 THR H 1 1 8 5237 1 1 16 THR HA H -8.721 -5.035 6.241 1.00 . A A . 16 THR HA 1 1 8 5238 1 1 16 THR HB H -7.223 -7.114 4.626 1.00 . A A . 16 THR HB 1 1 8 5239 1 1 16 THR HG1 H -9.788 -7.034 5.632 1.00 . A A . 16 THR HG1 1 1 8 5240 1 1 16 THR HG21 H -6.823 -8.159 6.806 1.00 . A A . 16 THR HG21 1 1 8 5241 1 1 16 THR HG22 H -7.742 -6.885 7.597 1.00 . A A . 16 THR HG22 1 1 8 5242 1 1 16 THR HG23 H -6.212 -6.503 6.799 1.00 . A A . 16 THR HG23 1 1 8 5243 1 1 16 THR N N -9.091 -5.164 4.226 1.00 . A A . 16 THR N 1 1 8 5244 1 1 16 THR O O -6.256 -4.692 4.106 1.00 . A A . 16 THR O 1 1 8 5245 1 1 16 THR OG1 O -9.056 -7.639 5.444 1.00 . A A . 16 THR OG1 1 1 8 5246 1 1 17 THR C C -4.195 -3.538 6.014 1.00 . A A . 17 THR C 1 1 8 5247 1 1 17 THR CA C -5.521 -2.740 5.910 1.00 . A A . 17 THR CA 1 1 8 5248 1 1 17 THR CB C -5.585 -1.547 6.927 1.00 . A A . 17 THR CB 1 1 8 5249 1 1 17 THR CG2 C -5.427 -2.012 8.366 1.00 . A A . 17 THR CG2 1 1 8 5250 1 1 17 THR H H -7.244 -3.526 6.829 1.00 . A A . 17 THR H 1 1 8 5251 1 1 17 THR HA H -5.569 -2.343 4.905 1.00 . A A . 17 THR HA 1 1 8 5252 1 1 17 THR HB H -6.551 -1.077 6.819 1.00 . A A . 17 THR HB 1 1 8 5253 1 1 17 THR HG1 H -5.019 0.285 6.596 1.00 . A A . 17 THR HG1 1 1 8 5254 1 1 17 THR HG21 H -5.474 -1.156 9.022 1.00 . A A . 17 THR HG21 1 1 8 5255 1 1 17 THR HG22 H -4.471 -2.503 8.481 1.00 . A A . 17 THR HG22 1 1 8 5256 1 1 17 THR HG23 H -6.219 -2.702 8.614 1.00 . A A . 17 THR HG23 1 1 8 5257 1 1 17 THR N N -6.663 -3.621 6.043 1.00 . A A . 17 THR N 1 1 8 5258 1 1 17 THR O O -3.212 -3.211 5.353 1.00 . A A . 17 THR O 1 1 8 5259 1 1 17 THR OG1 O -4.581 -0.572 6.640 1.00 . A A . 17 THR OG1 1 1 8 5260 1 1 18 GLY C C -2.684 -6.123 5.579 1.00 . A A . 18 GLY C 1 1 8 5261 1 1 18 GLY CA C -3.046 -5.488 6.908 1.00 . A A . 18 GLY CA 1 1 8 5262 1 1 18 GLY H H -5.007 -4.826 7.325 1.00 . A A . 18 GLY H 1 1 8 5263 1 1 18 GLY HA2 H -2.211 -4.900 7.258 1.00 . A A . 18 GLY HA2 1 1 8 5264 1 1 18 GLY HA3 H -3.253 -6.267 7.625 1.00 . A A . 18 GLY HA3 1 1 8 5265 1 1 18 GLY N N -4.209 -4.627 6.791 1.00 . A A . 18 GLY N 1 1 8 5266 1 1 18 GLY O O -1.508 -6.266 5.251 1.00 . A A . 18 GLY O 1 1 8 5267 1 1 19 SER C C -2.962 -5.985 2.531 1.00 . A A . 19 SER C 1 1 8 5268 1 1 19 SER CA C -3.514 -7.043 3.493 1.00 . A A . 19 SER CA 1 1 8 5269 1 1 19 SER CB C -4.857 -7.558 2.996 1.00 . A A . 19 SER CB 1 1 8 5270 1 1 19 SER H H -4.617 -6.351 5.119 1.00 . A A . 19 SER H 1 1 8 5271 1 1 19 SER HA H -2.823 -7.869 3.569 1.00 . A A . 19 SER HA 1 1 8 5272 1 1 19 SER HB2 H -5.493 -6.721 2.747 1.00 . A A . 19 SER HB2 1 1 8 5273 1 1 19 SER HB3 H -4.711 -8.177 2.123 1.00 . A A . 19 SER HB3 1 1 8 5274 1 1 19 SER HG H -5.105 -9.218 3.985 1.00 . A A . 19 SER HG 1 1 8 5275 1 1 19 SER N N -3.698 -6.465 4.803 1.00 . A A . 19 SER N 1 1 8 5276 1 1 19 SER O O -2.222 -6.296 1.607 1.00 . A A . 19 SER O 1 1 8 5277 1 1 19 SER OG O -5.484 -8.331 4.004 1.00 . A A . 19 SER OG 1 1 8 5278 1 1 20 CYS C C -1.393 -3.361 2.271 1.00 . A A . 20 CYS C 1 1 8 5279 1 1 20 CYS CA C -2.864 -3.619 1.976 1.00 . A A . 20 CYS CA 1 1 8 5280 1 1 20 CYS CB C -3.693 -2.389 2.311 1.00 . A A . 20 CYS CB 1 1 8 5281 1 1 20 CYS H H -3.918 -4.561 3.536 1.00 . A A . 20 CYS H 1 1 8 5282 1 1 20 CYS HA H -2.989 -3.864 0.931 1.00 . A A . 20 CYS HA 1 1 8 5283 1 1 20 CYS HB2 H -4.740 -2.619 2.171 1.00 . A A . 20 CYS HB2 1 1 8 5284 1 1 20 CYS HB3 H -3.527 -2.131 3.347 1.00 . A A . 20 CYS HB3 1 1 8 5285 1 1 20 CYS N N -3.321 -4.738 2.777 1.00 . A A . 20 CYS N 1 1 8 5286 1 1 20 CYS O O -0.564 -3.210 1.355 1.00 . A A . 20 CYS O 1 1 8 5287 1 1 20 CYS SG S -3.321 -0.937 1.313 1.00 . A A . 20 CYS SG 1 1 8 5288 1 1 21 ASP C C 1.161 -4.282 3.459 1.00 . A A . 21 ASP C 1 1 8 5289 1 1 21 ASP CA C 0.289 -3.204 4.051 1.00 . A A . 21 ASP CA 1 1 8 5290 1 1 21 ASP CB C 0.306 -3.302 5.586 1.00 . A A . 21 ASP CB 1 1 8 5291 1 1 21 ASP CG C 1.703 -3.404 6.179 1.00 . A A . 21 ASP CG 1 1 8 5292 1 1 21 ASP H H -1.799 -3.435 4.224 1.00 . A A . 21 ASP H 1 1 8 5293 1 1 21 ASP HA H 0.660 -2.233 3.757 1.00 . A A . 21 ASP HA 1 1 8 5294 1 1 21 ASP HB2 H -0.164 -2.420 5.996 1.00 . A A . 21 ASP HB2 1 1 8 5295 1 1 21 ASP HB3 H -0.263 -4.170 5.886 1.00 . A A . 21 ASP HB3 1 1 8 5296 1 1 21 ASP N N -1.074 -3.352 3.563 1.00 . A A . 21 ASP N 1 1 8 5297 1 1 21 ASP O O 2.187 -3.999 2.838 1.00 . A A . 21 ASP O 1 1 8 5298 1 1 21 ASP OD1 O 2.381 -2.375 6.323 1.00 . A A . 21 ASP OD1 1 1 8 5299 1 1 21 ASP OD2 O 2.132 -4.536 6.557 1.00 . A A . 21 ASP OD2 1 1 8 5300 1 1 22 ASP C C 1.636 -6.609 1.595 1.00 . A A . 22 ASP C 1 1 8 5301 1 1 22 ASP CA C 1.409 -6.682 3.102 1.00 . A A . 22 ASP CA 1 1 8 5302 1 1 22 ASP CB C 0.618 -7.940 3.441 1.00 . A A . 22 ASP CB 1 1 8 5303 1 1 22 ASP CG C 1.336 -9.210 3.061 1.00 . A A . 22 ASP CG 1 1 8 5304 1 1 22 ASP H H -0.159 -5.630 4.056 1.00 . A A . 22 ASP H 1 1 8 5305 1 1 22 ASP HA H 2.364 -6.731 3.602 1.00 . A A . 22 ASP HA 1 1 8 5306 1 1 22 ASP HB2 H 0.421 -7.952 4.503 1.00 . A A . 22 ASP HB2 1 1 8 5307 1 1 22 ASP HB3 H -0.324 -7.906 2.914 1.00 . A A . 22 ASP HB3 1 1 8 5308 1 1 22 ASP N N 0.699 -5.508 3.589 1.00 . A A . 22 ASP N 1 1 8 5309 1 1 22 ASP O O 2.734 -6.911 1.112 1.00 . A A . 22 ASP O 1 1 8 5310 1 1 22 ASP OD1 O 2.095 -9.742 3.894 1.00 . A A . 22 ASP OD1 1 1 8 5311 1 1 22 ASP OD2 O 1.136 -9.717 1.946 1.00 . A A . 22 ASP OD2 1 1 8 5312 1 1 23 HIS C C 1.721 -5.062 -1.007 1.00 . A A . 23 HIS C 1 1 8 5313 1 1 23 HIS CA C 0.638 -6.052 -0.573 1.00 . A A . 23 HIS CA 1 1 8 5314 1 1 23 HIS CB C -0.751 -5.599 -1.077 1.00 . A A . 23 HIS CB 1 1 8 5315 1 1 23 HIS CD2 C -0.433 -4.811 -3.527 1.00 . A A . 23 HIS CD2 1 1 8 5316 1 1 23 HIS CE1 C -1.717 -6.234 -4.527 1.00 . A A . 23 HIS CE1 1 1 8 5317 1 1 23 HIS CG C -0.939 -5.620 -2.568 1.00 . A A . 23 HIS CG 1 1 8 5318 1 1 23 HIS H H -0.224 -5.928 1.328 1.00 . A A . 23 HIS H 1 1 8 5319 1 1 23 HIS HA H 0.859 -7.022 -0.990 1.00 . A A . 23 HIS HA 1 1 8 5320 1 1 23 HIS HB2 H -1.503 -6.245 -0.650 1.00 . A A . 23 HIS HB2 1 1 8 5321 1 1 23 HIS HB3 H -0.927 -4.590 -0.732 1.00 . A A . 23 HIS HB3 1 1 8 5322 1 1 23 HIS HD1 H -2.276 -7.240 -2.807 1.00 . A A . 23 HIS HD1 1 1 8 5323 1 1 23 HIS HD2 H 0.248 -3.990 -3.347 1.00 . A A . 23 HIS HD2 1 1 8 5324 1 1 23 HIS HE1 H -2.265 -6.772 -5.288 1.00 . A A . 23 HIS HE1 1 1 8 5325 1 1 23 HIS N N 0.612 -6.172 0.876 1.00 . A A . 23 HIS N 1 1 8 5326 1 1 23 HIS ND1 N -1.754 -6.518 -3.223 1.00 . A A . 23 HIS ND1 1 1 8 5327 1 1 23 HIS NE2 N -0.927 -5.203 -4.765 1.00 . A A . 23 HIS NE2 1 1 8 5328 1 1 23 HIS O O 2.618 -5.411 -1.762 1.00 . A A . 23 HIS O 1 1 8 5329 1 1 24 CYS C C 4.071 -3.227 -0.487 1.00 . A A . 24 CYS C 1 1 8 5330 1 1 24 CYS CA C 2.638 -2.827 -0.871 1.00 . A A . 24 CYS CA 1 1 8 5331 1 1 24 CYS CB C 2.275 -1.479 -0.266 1.00 . A A . 24 CYS CB 1 1 8 5332 1 1 24 CYS H H 0.949 -3.626 0.139 1.00 . A A . 24 CYS H 1 1 8 5333 1 1 24 CYS HA H 2.594 -2.744 -1.947 1.00 . A A . 24 CYS HA 1 1 8 5334 1 1 24 CYS HB2 H 2.233 -1.577 0.810 1.00 . A A . 24 CYS HB2 1 1 8 5335 1 1 24 CYS HB3 H 3.039 -0.760 -0.523 1.00 . A A . 24 CYS HB3 1 1 8 5336 1 1 24 CYS N N 1.666 -3.851 -0.497 1.00 . A A . 24 CYS N 1 1 8 5337 1 1 24 CYS O O 5.025 -2.863 -1.153 1.00 . A A . 24 CYS O 1 1 8 5338 1 1 24 CYS SG S 0.669 -0.808 -0.818 1.00 . A A . 24 CYS SG 1 1 8 5339 1 1 25 LYS C C 6.044 -5.629 0.207 1.00 . A A . 25 LYS C 1 1 8 5340 1 1 25 LYS CA C 5.502 -4.454 1.011 1.00 . A A . 25 LYS CA 1 1 8 5341 1 1 25 LYS CB C 5.439 -4.786 2.486 1.00 . A A . 25 LYS CB 1 1 8 5342 1 1 25 LYS CD C 4.763 -3.827 4.714 1.00 . A A . 25 LYS CD 1 1 8 5343 1 1 25 LYS CE C 5.495 -4.896 5.478 1.00 . A A . 25 LYS CE 1 1 8 5344 1 1 25 LYS CG C 5.347 -3.550 3.346 1.00 . A A . 25 LYS CG 1 1 8 5345 1 1 25 LYS H H 3.397 -4.278 1.044 1.00 . A A . 25 LYS H 1 1 8 5346 1 1 25 LYS HA H 6.184 -3.625 0.889 1.00 . A A . 25 LYS HA 1 1 8 5347 1 1 25 LYS HB2 H 4.570 -5.402 2.669 1.00 . A A . 25 LYS HB2 1 1 8 5348 1 1 25 LYS HB3 H 6.328 -5.331 2.764 1.00 . A A . 25 LYS HB3 1 1 8 5349 1 1 25 LYS HD2 H 4.788 -2.918 5.295 1.00 . A A . 25 LYS HD2 1 1 8 5350 1 1 25 LYS HD3 H 3.734 -4.129 4.589 1.00 . A A . 25 LYS HD3 1 1 8 5351 1 1 25 LYS HE2 H 5.504 -5.806 4.895 1.00 . A A . 25 LYS HE2 1 1 8 5352 1 1 25 LYS HE3 H 6.504 -4.549 5.641 1.00 . A A . 25 LYS HE3 1 1 8 5353 1 1 25 LYS HG2 H 6.333 -3.126 3.464 1.00 . A A . 25 LYS HG2 1 1 8 5354 1 1 25 LYS HG3 H 4.715 -2.847 2.825 1.00 . A A . 25 LYS HG3 1 1 8 5355 1 1 25 LYS HZ1 H 5.080 -4.389 7.458 1.00 . A A . 25 LYS HZ1 1 1 8 5356 1 1 25 LYS HZ2 H 5.136 -6.054 7.189 1.00 . A A . 25 LYS HZ2 1 1 8 5357 1 1 25 LYS HZ3 H 3.813 -5.133 6.659 1.00 . A A . 25 LYS HZ3 1 1 8 5358 1 1 25 LYS N N 4.204 -4.003 0.555 1.00 . A A . 25 LYS N 1 1 8 5359 1 1 25 LYS NZ N 4.851 -5.144 6.780 1.00 . A A . 25 LYS NZ 1 1 8 5360 1 1 25 LYS O O 7.182 -5.608 -0.220 1.00 . A A . 25 LYS O 1 1 8 5361 1 1 26 ASN C C 5.550 -7.821 -2.163 1.00 . A A . 26 ASN C 1 1 8 5362 1 1 26 ASN CA C 5.737 -7.847 -0.663 1.00 . A A . 26 ASN CA 1 1 8 5363 1 1 26 ASN CB C 5.133 -9.110 -0.059 1.00 . A A . 26 ASN CB 1 1 8 5364 1 1 26 ASN CG C 5.505 -9.289 1.399 1.00 . A A . 26 ASN CG 1 1 8 5365 1 1 26 ASN H H 4.313 -6.598 0.309 1.00 . A A . 26 ASN H 1 1 8 5366 1 1 26 ASN HA H 6.802 -7.874 -0.483 1.00 . A A . 26 ASN HA 1 1 8 5367 1 1 26 ASN HB2 H 4.058 -9.040 -0.127 1.00 . A A . 26 ASN HB2 1 1 8 5368 1 1 26 ASN HB3 H 5.473 -9.972 -0.614 1.00 . A A . 26 ASN HB3 1 1 8 5369 1 1 26 ASN HD21 H 3.854 -8.366 1.954 1.00 . A A . 26 ASN HD21 1 1 8 5370 1 1 26 ASN HD22 H 4.872 -8.898 3.241 1.00 . A A . 26 ASN HD22 1 1 8 5371 1 1 26 ASN N N 5.248 -6.642 0.005 1.00 . A A . 26 ASN N 1 1 8 5372 1 1 26 ASN ND2 N 4.668 -8.807 2.286 1.00 . A A . 26 ASN ND2 1 1 8 5373 1 1 26 ASN O O 6.369 -8.354 -2.905 1.00 . A A . 26 ASN O 1 1 8 5374 1 1 26 ASN OD1 O 6.534 -9.873 1.724 1.00 . A A . 26 ASN OD1 1 1 8 5375 1 1 27 LYS C C 4.912 -5.961 -4.666 1.00 . A A . 27 LYS C 1 1 8 5376 1 1 27 LYS CA C 4.216 -7.159 -4.038 1.00 . A A . 27 LYS CA 1 1 8 5377 1 1 27 LYS CB C 2.695 -7.100 -4.286 1.00 . A A . 27 LYS CB 1 1 8 5378 1 1 27 LYS CD C 2.691 -8.352 -6.468 1.00 . A A . 27 LYS CD 1 1 8 5379 1 1 27 LYS CE C 2.193 -8.366 -7.905 1.00 . A A . 27 LYS CE 1 1 8 5380 1 1 27 LYS CG C 2.272 -7.085 -5.748 1.00 . A A . 27 LYS CG 1 1 8 5381 1 1 27 LYS H H 3.862 -6.764 -2.004 1.00 . A A . 27 LYS H 1 1 8 5382 1 1 27 LYS HA H 4.604 -8.065 -4.475 1.00 . A A . 27 LYS HA 1 1 8 5383 1 1 27 LYS HB2 H 2.233 -7.956 -3.819 1.00 . A A . 27 LYS HB2 1 1 8 5384 1 1 27 LYS HB3 H 2.312 -6.207 -3.815 1.00 . A A . 27 LYS HB3 1 1 8 5385 1 1 27 LYS HD2 H 3.769 -8.406 -6.473 1.00 . A A . 27 LYS HD2 1 1 8 5386 1 1 27 LYS HD3 H 2.289 -9.204 -5.941 1.00 . A A . 27 LYS HD3 1 1 8 5387 1 1 27 LYS HE2 H 1.116 -8.283 -7.902 1.00 . A A . 27 LYS HE2 1 1 8 5388 1 1 27 LYS HE3 H 2.613 -7.520 -8.428 1.00 . A A . 27 LYS HE3 1 1 8 5389 1 1 27 LYS HG2 H 1.196 -6.996 -5.795 1.00 . A A . 27 LYS HG2 1 1 8 5390 1 1 27 LYS HG3 H 2.726 -6.233 -6.232 1.00 . A A . 27 LYS HG3 1 1 8 5391 1 1 27 LYS HZ1 H 2.160 -10.433 -8.129 1.00 . A A . 27 LYS HZ1 1 1 8 5392 1 1 27 LYS HZ2 H 3.602 -9.726 -8.610 1.00 . A A . 27 LYS HZ2 1 1 8 5393 1 1 27 LYS HZ3 H 2.246 -9.597 -9.594 1.00 . A A . 27 LYS HZ3 1 1 8 5394 1 1 27 LYS N N 4.489 -7.204 -2.619 1.00 . A A . 27 LYS N 1 1 8 5395 1 1 27 LYS NZ N 2.569 -9.606 -8.606 1.00 . A A . 27 LYS NZ 1 1 8 5396 1 1 27 LYS O O 5.678 -6.109 -5.613 1.00 . A A . 27 LYS O 1 1 8 5397 1 1 28 GLU C C 6.705 -3.338 -4.112 1.00 . A A . 28 GLU C 1 1 8 5398 1 1 28 GLU CA C 5.283 -3.561 -4.619 1.00 . A A . 28 GLU CA 1 1 8 5399 1 1 28 GLU CB C 4.400 -2.360 -4.287 1.00 . A A . 28 GLU CB 1 1 8 5400 1 1 28 GLU CD C 3.099 -2.406 -6.439 1.00 . A A . 28 GLU CD 1 1 8 5401 1 1 28 GLU CG C 3.023 -2.403 -4.930 1.00 . A A . 28 GLU CG 1 1 8 5402 1 1 28 GLU H H 4.133 -4.758 -3.290 1.00 . A A . 28 GLU H 1 1 8 5403 1 1 28 GLU HA H 5.322 -3.671 -5.692 1.00 . A A . 28 GLU HA 1 1 8 5404 1 1 28 GLU HB2 H 4.275 -2.308 -3.215 1.00 . A A . 28 GLU HB2 1 1 8 5405 1 1 28 GLU HB3 H 4.900 -1.462 -4.619 1.00 . A A . 28 GLU HB3 1 1 8 5406 1 1 28 GLU HG2 H 2.518 -3.302 -4.609 1.00 . A A . 28 GLU HG2 1 1 8 5407 1 1 28 GLU HG3 H 2.459 -1.539 -4.612 1.00 . A A . 28 GLU HG3 1 1 8 5408 1 1 28 GLU N N 4.707 -4.794 -4.084 1.00 . A A . 28 GLU N 1 1 8 5409 1 1 28 GLU O O 7.444 -2.516 -4.661 1.00 . A A . 28 GLU O 1 1 8 5410 1 1 28 GLU OE1 O 2.970 -3.474 -7.054 1.00 . A A . 28 GLU OE1 1 1 8 5411 1 1 28 GLU OE2 O 3.301 -1.337 -7.039 1.00 . A A . 28 GLU OE2 1 1 8 5412 1 1 29 HIS C C 8.703 -2.666 -1.833 1.00 . A A . 29 HIS C 1 1 8 5413 1 1 29 HIS CA C 8.418 -4.037 -2.444 1.00 . A A . 29 HIS CA 1 1 8 5414 1 1 29 HIS CB C 9.520 -4.424 -3.450 1.00 . A A . 29 HIS CB 1 1 8 5415 1 1 29 HIS CD2 C 9.440 -7.006 -3.348 1.00 . A A . 29 HIS CD2 1 1 8 5416 1 1 29 HIS CE1 C 9.193 -7.441 -5.456 1.00 . A A . 29 HIS CE1 1 1 8 5417 1 1 29 HIS CG C 9.402 -5.817 -3.990 1.00 . A A . 29 HIS CG 1 1 8 5418 1 1 29 HIS H H 6.411 -4.706 -2.702 1.00 . A A . 29 HIS H 1 1 8 5419 1 1 29 HIS HA H 8.411 -4.759 -1.640 1.00 . A A . 29 HIS HA 1 1 8 5420 1 1 29 HIS HB2 H 9.473 -3.745 -4.288 1.00 . A A . 29 HIS HB2 1 1 8 5421 1 1 29 HIS HB3 H 10.482 -4.327 -2.970 1.00 . A A . 29 HIS HB3 1 1 8 5422 1 1 29 HIS HD1 H 9.186 -5.464 -6.063 1.00 . A A . 29 HIS HD1 1 1 8 5423 1 1 29 HIS HD2 H 9.553 -7.144 -2.282 1.00 . A A . 29 HIS HD2 1 1 8 5424 1 1 29 HIS HE1 H 9.076 -7.960 -6.396 1.00 . A A . 29 HIS HE1 1 1 8 5425 1 1 29 HIS N N 7.073 -4.086 -3.068 1.00 . A A . 29 HIS N 1 1 8 5426 1 1 29 HIS ND1 N 9.247 -6.113 -5.329 1.00 . A A . 29 HIS ND1 1 1 8 5427 1 1 29 HIS NE2 N 9.306 -8.035 -4.279 1.00 . A A . 29 HIS NE2 1 1 8 5428 1 1 29 HIS O O 9.846 -2.212 -1.790 1.00 . A A . 29 HIS O 1 1 8 5429 1 1 30 LEU C C 7.801 -0.776 0.782 1.00 . A A . 30 LEU C 1 1 8 5430 1 1 30 LEU CA C 7.797 -0.725 -0.742 1.00 . A A . 30 LEU CA 1 1 8 5431 1 1 30 LEU CB C 6.661 0.149 -1.261 1.00 . A A . 30 LEU CB 1 1 8 5432 1 1 30 LEU CD1 C 5.419 1.107 -3.216 1.00 . A A . 30 LEU CD1 1 1 8 5433 1 1 30 LEU CD2 C 7.904 0.939 -3.290 1.00 . A A . 30 LEU CD2 1 1 8 5434 1 1 30 LEU CG C 6.621 0.309 -2.780 1.00 . A A . 30 LEU CG 1 1 8 5435 1 1 30 LEU H H 6.805 -2.492 -1.298 1.00 . A A . 30 LEU H 1 1 8 5436 1 1 30 LEU HA H 8.734 -0.301 -1.072 1.00 . A A . 30 LEU HA 1 1 8 5437 1 1 30 LEU HB2 H 5.727 -0.287 -0.936 1.00 . A A . 30 LEU HB2 1 1 8 5438 1 1 30 LEU HB3 H 6.755 1.131 -0.821 1.00 . A A . 30 LEU HB3 1 1 8 5439 1 1 30 LEU HD11 H 4.525 0.552 -2.975 1.00 . A A . 30 LEU HD11 1 1 8 5440 1 1 30 LEU HD12 H 5.465 1.270 -4.281 1.00 . A A . 30 LEU HD12 1 1 8 5441 1 1 30 LEU HD13 H 5.394 2.058 -2.705 1.00 . A A . 30 LEU HD13 1 1 8 5442 1 1 30 LEU HD21 H 8.735 0.274 -3.104 1.00 . A A . 30 LEU HD21 1 1 8 5443 1 1 30 LEU HD22 H 8.081 1.869 -2.774 1.00 . A A . 30 LEU HD22 1 1 8 5444 1 1 30 LEU HD23 H 7.820 1.123 -4.350 1.00 . A A . 30 LEU HD23 1 1 8 5445 1 1 30 LEU HG H 6.535 -0.673 -3.223 1.00 . A A . 30 LEU HG 1 1 8 5446 1 1 30 LEU N N 7.681 -2.049 -1.311 1.00 . A A . 30 LEU N 1 1 8 5447 1 1 30 LEU O O 7.720 -1.866 1.371 1.00 . A A . 30 LEU O 1 1 8 5448 1 1 31 ARG C C 6.724 -0.065 3.536 1.00 . A A . 31 ARG C 1 1 8 5449 1 1 31 ARG CA C 7.951 0.544 2.863 1.00 . A A . 31 ARG CA 1 1 8 5450 1 1 31 ARG CB C 8.067 2.032 3.268 1.00 . A A . 31 ARG CB 1 1 8 5451 1 1 31 ARG CD C 8.020 3.738 5.153 1.00 . A A . 31 ARG CD 1 1 8 5452 1 1 31 ARG CG C 8.051 2.260 4.781 1.00 . A A . 31 ARG CG 1 1 8 5453 1 1 31 ARG CZ C 7.509 5.050 7.253 1.00 . A A . 31 ARG CZ 1 1 8 5454 1 1 31 ARG H H 7.967 1.209 0.851 1.00 . A A . 31 ARG H 1 1 8 5455 1 1 31 ARG HA H 8.831 0.028 3.215 1.00 . A A . 31 ARG HA 1 1 8 5456 1 1 31 ARG HB2 H 8.988 2.433 2.871 1.00 . A A . 31 ARG HB2 1 1 8 5457 1 1 31 ARG HB3 H 7.238 2.571 2.835 1.00 . A A . 31 ARG HB3 1 1 8 5458 1 1 31 ARG HD2 H 8.930 4.204 4.805 1.00 . A A . 31 ARG HD2 1 1 8 5459 1 1 31 ARG HD3 H 7.170 4.202 4.677 1.00 . A A . 31 ARG HD3 1 1 8 5460 1 1 31 ARG HE H 8.167 3.130 7.141 1.00 . A A . 31 ARG HE 1 1 8 5461 1 1 31 ARG HG2 H 7.174 1.784 5.193 1.00 . A A . 31 ARG HG2 1 1 8 5462 1 1 31 ARG HG3 H 8.933 1.806 5.207 1.00 . A A . 31 ARG HG3 1 1 8 5463 1 1 31 ARG HH11 H 7.140 6.170 5.563 1.00 . A A . 31 ARG HH11 1 1 8 5464 1 1 31 ARG HH12 H 6.875 6.980 7.035 1.00 . A A . 31 ARG HH12 1 1 8 5465 1 1 31 ARG HH21 H 7.715 4.282 9.147 1.00 . A A . 31 ARG HH21 1 1 8 5466 1 1 31 ARG HH22 H 7.176 5.891 9.097 1.00 . A A . 31 ARG HH22 1 1 8 5467 1 1 31 ARG N N 7.903 0.400 1.405 1.00 . A A . 31 ARG N 1 1 8 5468 1 1 31 ARG NE N 7.910 3.924 6.615 1.00 . A A . 31 ARG NE 1 1 8 5469 1 1 31 ARG NH1 N 7.144 6.134 6.561 1.00 . A A . 31 ARG NH1 1 1 8 5470 1 1 31 ARG NH2 N 7.461 5.076 8.584 1.00 . A A . 31 ARG NH2 1 1 8 5471 1 1 31 ARG O O 6.849 -0.878 4.451 1.00 . A A . 31 ARG O 1 1 8 5472 1 1 32 SER C C 3.153 0.305 2.773 1.00 . A A . 32 SER C 1 1 8 5473 1 1 32 SER CA C 4.310 -0.108 3.684 1.00 . A A . 32 SER CA 1 1 8 5474 1 1 32 SER CB C 4.171 0.548 5.078 1.00 . A A . 32 SER CB 1 1 8 5475 1 1 32 SER H H 5.499 0.923 2.301 1.00 . A A . 32 SER H 1 1 8 5476 1 1 32 SER HA H 4.339 -1.182 3.799 1.00 . A A . 32 SER HA 1 1 8 5477 1 1 32 SER HB2 H 5.058 0.330 5.651 1.00 . A A . 32 SER HB2 1 1 8 5478 1 1 32 SER HB3 H 4.091 1.617 4.947 1.00 . A A . 32 SER HB3 1 1 8 5479 1 1 32 SER HG H 3.065 -0.883 5.925 1.00 . A A . 32 SER HG 1 1 8 5480 1 1 32 SER N N 5.550 0.328 3.083 1.00 . A A . 32 SER N 1 1 8 5481 1 1 32 SER O O 3.382 0.834 1.678 1.00 . A A . 32 SER O 1 1 8 5482 1 1 32 SER OG O 3.031 0.085 5.804 1.00 . A A . 32 SER OG 1 1 8 5483 1 1 33 GLY C C -0.250 0.962 3.461 1.00 . A A . 33 GLY C 1 1 8 5484 1 1 33 GLY CA C 0.767 0.430 2.501 1.00 . A A . 33 GLY CA 1 1 8 5485 1 1 33 GLY H H 1.827 -0.295 4.125 1.00 . A A . 33 GLY H 1 1 8 5486 1 1 33 GLY HA2 H 1.011 1.191 1.776 1.00 . A A . 33 GLY HA2 1 1 8 5487 1 1 33 GLY HA3 H 0.365 -0.440 2.006 1.00 . A A . 33 GLY HA3 1 1 8 5488 1 1 33 GLY N N 1.949 0.082 3.226 1.00 . A A . 33 GLY N 1 1 8 5489 1 1 33 GLY O O -0.102 0.759 4.673 1.00 . A A . 33 GLY O 1 1 8 5490 1 1 34 ARG C C -3.533 2.481 2.992 1.00 . A A . 34 ARG C 1 1 8 5491 1 1 34 ARG CA C -2.263 2.247 3.799 1.00 . A A . 34 ARG CA 1 1 8 5492 1 1 34 ARG CB C -1.768 3.558 4.436 1.00 . A A . 34 ARG CB 1 1 8 5493 1 1 34 ARG CD C -0.699 5.806 4.119 1.00 . A A . 34 ARG CD 1 1 8 5494 1 1 34 ARG CG C -1.271 4.585 3.435 1.00 . A A . 34 ARG CG 1 1 8 5495 1 1 34 ARG CZ C 1.492 6.309 5.200 1.00 . A A . 34 ARG CZ 1 1 8 5496 1 1 34 ARG H H -1.279 1.841 1.998 1.00 . A A . 34 ARG H 1 1 8 5497 1 1 34 ARG HA H -2.479 1.539 4.586 1.00 . A A . 34 ARG HA 1 1 8 5498 1 1 34 ARG HB2 H -2.581 4.002 4.991 1.00 . A A . 34 ARG HB2 1 1 8 5499 1 1 34 ARG HB3 H -0.964 3.330 5.118 1.00 . A A . 34 ARG HB3 1 1 8 5500 1 1 34 ARG HD2 H -0.395 6.515 3.364 1.00 . A A . 34 ARG HD2 1 1 8 5501 1 1 34 ARG HD3 H -1.468 6.249 4.734 1.00 . A A . 34 ARG HD3 1 1 8 5502 1 1 34 ARG HE H 0.439 4.603 5.396 1.00 . A A . 34 ARG HE 1 1 8 5503 1 1 34 ARG HG2 H -0.497 4.129 2.834 1.00 . A A . 34 ARG HG2 1 1 8 5504 1 1 34 ARG HG3 H -2.092 4.882 2.800 1.00 . A A . 34 ARG HG3 1 1 8 5505 1 1 34 ARG HH11 H 0.908 7.799 3.893 1.00 . A A . 34 ARG HH11 1 1 8 5506 1 1 34 ARG HH12 H 2.366 8.103 4.742 1.00 . A A . 34 ARG HH12 1 1 8 5507 1 1 34 ARG HH21 H 2.411 5.042 6.497 1.00 . A A . 34 ARG HH21 1 1 8 5508 1 1 34 ARG HH22 H 3.228 6.535 6.239 1.00 . A A . 34 ARG HH22 1 1 8 5509 1 1 34 ARG N N -1.229 1.672 2.965 1.00 . A A . 34 ARG N 1 1 8 5510 1 1 34 ARG NE N 0.458 5.487 4.963 1.00 . A A . 34 ARG NE 1 1 8 5511 1 1 34 ARG NH1 N 1.592 7.487 4.568 1.00 . A A . 34 ARG NH1 1 1 8 5512 1 1 34 ARG NH2 N 2.448 5.934 6.040 1.00 . A A . 34 ARG NH2 1 1 8 5513 1 1 34 ARG O O -3.479 2.777 1.783 1.00 . A A . 34 ARG O 1 1 8 5514 1 1 35 CYS C C -6.495 3.889 3.385 1.00 . A A . 35 CYS C 1 1 8 5515 1 1 35 CYS CA C -5.929 2.545 2.986 1.00 . A A . 35 CYS CA 1 1 8 5516 1 1 35 CYS CB C -6.897 1.417 3.359 1.00 . A A . 35 CYS CB 1 1 8 5517 1 1 35 CYS H H -4.655 2.126 4.594 1.00 . A A . 35 CYS H 1 1 8 5518 1 1 35 CYS HA H -5.773 2.544 1.917 1.00 . A A . 35 CYS HA 1 1 8 5519 1 1 35 CYS HB2 H -7.199 1.522 4.389 1.00 . A A . 35 CYS HB2 1 1 8 5520 1 1 35 CYS HB3 H -7.772 1.482 2.729 1.00 . A A . 35 CYS HB3 1 1 8 5521 1 1 35 CYS N N -4.658 2.354 3.639 1.00 . A A . 35 CYS N 1 1 8 5522 1 1 35 CYS O O -6.798 4.134 4.550 1.00 . A A . 35 CYS O 1 1 8 5523 1 1 35 CYS SG S -6.186 -0.248 3.144 1.00 . A A . 35 CYS SG 1 1 8 5524 1 1 36 ARG C C -8.629 6.100 2.599 1.00 . A A . 36 ARG C 1 1 8 5525 1 1 36 ARG CA C -7.103 6.098 2.684 1.00 . A A . 36 ARG CA 1 1 8 5526 1 1 36 ARG CB C -6.485 7.104 1.723 1.00 . A A . 36 ARG CB 1 1 8 5527 1 1 36 ARG CD C -4.813 8.113 3.306 1.00 . A A . 36 ARG CD 1 1 8 5528 1 1 36 ARG CG C -5.012 7.410 1.972 1.00 . A A . 36 ARG CG 1 1 8 5529 1 1 36 ARG CZ C -2.912 8.799 4.741 1.00 . A A . 36 ARG CZ 1 1 8 5530 1 1 36 ARG H H -6.300 4.510 1.537 1.00 . A A . 36 ARG H 1 1 8 5531 1 1 36 ARG HA H -6.833 6.363 3.694 1.00 . A A . 36 ARG HA 1 1 8 5532 1 1 36 ARG HB2 H -6.570 6.698 0.725 1.00 . A A . 36 ARG HB2 1 1 8 5533 1 1 36 ARG HB3 H -7.040 8.027 1.782 1.00 . A A . 36 ARG HB3 1 1 8 5534 1 1 36 ARG HD2 H -5.384 9.028 3.297 1.00 . A A . 36 ARG HD2 1 1 8 5535 1 1 36 ARG HD3 H -5.161 7.476 4.104 1.00 . A A . 36 ARG HD3 1 1 8 5536 1 1 36 ARG HE H -2.822 8.429 2.759 1.00 . A A . 36 ARG HE 1 1 8 5537 1 1 36 ARG HG2 H -4.458 6.483 1.979 1.00 . A A . 36 ARG HG2 1 1 8 5538 1 1 36 ARG HG3 H -4.644 8.044 1.179 1.00 . A A . 36 ARG HG3 1 1 8 5539 1 1 36 ARG HH11 H -4.699 8.794 5.747 1.00 . A A . 36 ARG HH11 1 1 8 5540 1 1 36 ARG HH12 H -3.358 9.191 6.702 1.00 . A A . 36 ARG HH12 1 1 8 5541 1 1 36 ARG HH21 H -1.007 8.944 4.060 1.00 . A A . 36 ARG HH21 1 1 8 5542 1 1 36 ARG HH22 H -1.195 9.275 5.736 1.00 . A A . 36 ARG HH22 1 1 8 5543 1 1 36 ARG N N -6.581 4.772 2.439 1.00 . A A . 36 ARG N 1 1 8 5544 1 1 36 ARG NE N -3.416 8.459 3.552 1.00 . A A . 36 ARG NE 1 1 8 5545 1 1 36 ARG NH1 N -3.707 8.935 5.797 1.00 . A A . 36 ARG NH1 1 1 8 5546 1 1 36 ARG NH2 N -1.620 9.025 4.860 1.00 . A A . 36 ARG NH2 1 1 8 5547 1 1 36 ARG O O -9.237 5.058 2.348 1.00 . A A . 36 ARG O 1 1 8 5548 1 1 37 ASP C C -11.401 6.992 1.552 1.00 . A A . 37 ASP C 1 1 8 5549 1 1 37 ASP CA C -10.701 7.461 2.826 1.00 . A A . 37 ASP CA 1 1 8 5550 1 1 37 ASP CB C -11.066 8.932 3.094 1.00 . A A . 37 ASP CB 1 1 8 5551 1 1 37 ASP CG C -10.631 9.871 1.989 1.00 . A A . 37 ASP CG 1 1 8 5552 1 1 37 ASP H H -8.666 8.066 2.928 1.00 . A A . 37 ASP H 1 1 8 5553 1 1 37 ASP HA H -11.076 6.871 3.647 1.00 . A A . 37 ASP HA 1 1 8 5554 1 1 37 ASP HB2 H -12.138 9.013 3.197 1.00 . A A . 37 ASP HB2 1 1 8 5555 1 1 37 ASP HB3 H -10.601 9.247 4.016 1.00 . A A . 37 ASP HB3 1 1 8 5556 1 1 37 ASP N N -9.227 7.270 2.792 1.00 . A A . 37 ASP N 1 1 8 5557 1 1 37 ASP O O -12.593 6.726 1.564 1.00 . A A . 37 ASP O 1 1 8 5558 1 1 37 ASP OD1 O -9.447 10.254 1.956 1.00 . A A . 37 ASP OD1 1 1 8 5559 1 1 37 ASP OD2 O -11.463 10.260 1.154 1.00 . A A . 37 ASP OD2 1 1 8 5560 1 1 38 ASP C C -11.179 4.877 -0.890 1.00 . A A . 38 ASP C 1 1 8 5561 1 1 38 ASP CA C -11.237 6.395 -0.801 1.00 . A A . 38 ASP CA 1 1 8 5562 1 1 38 ASP CB C -10.534 7.003 -2.023 1.00 . A A . 38 ASP CB 1 1 8 5563 1 1 38 ASP CG C -10.833 8.468 -2.239 1.00 . A A . 38 ASP CG 1 1 8 5564 1 1 38 ASP H H -9.724 7.152 0.511 1.00 . A A . 38 ASP H 1 1 8 5565 1 1 38 ASP HA H -12.275 6.690 -0.817 1.00 . A A . 38 ASP HA 1 1 8 5566 1 1 38 ASP HB2 H -9.470 6.899 -1.882 1.00 . A A . 38 ASP HB2 1 1 8 5567 1 1 38 ASP HB3 H -10.824 6.454 -2.906 1.00 . A A . 38 ASP HB3 1 1 8 5568 1 1 38 ASP N N -10.666 6.882 0.462 1.00 . A A . 38 ASP N 1 1 8 5569 1 1 38 ASP O O -11.350 4.315 -1.971 1.00 . A A . 38 ASP O 1 1 8 5570 1 1 38 ASP OD1 O -11.979 8.808 -2.649 1.00 . A A . 38 ASP OD1 1 1 8 5571 1 1 38 ASP OD2 O -9.931 9.302 -2.057 1.00 . A A . 38 ASP OD2 1 1 8 5572 1 1 39 PHE C C -9.958 2.046 -0.594 1.00 . A A . 39 PHE C 1 1 8 5573 1 1 39 PHE CA C -10.840 2.751 0.428 1.00 . A A . 39 PHE CA 1 1 8 5574 1 1 39 PHE CB C -12.235 2.067 0.582 1.00 . A A . 39 PHE CB 1 1 8 5575 1 1 39 PHE CD1 C -14.258 3.243 -0.316 1.00 . A A . 39 PHE CD1 1 1 8 5576 1 1 39 PHE CD2 C -13.212 1.605 -1.686 1.00 . A A . 39 PHE CD2 1 1 8 5577 1 1 39 PHE CE1 C -15.204 3.465 -1.292 1.00 . A A . 39 PHE CE1 1 1 8 5578 1 1 39 PHE CE2 C -14.152 1.824 -2.669 1.00 . A A . 39 PHE CE2 1 1 8 5579 1 1 39 PHE CG C -13.252 2.313 -0.501 1.00 . A A . 39 PHE CG 1 1 8 5580 1 1 39 PHE CZ C -15.151 2.754 -2.473 1.00 . A A . 39 PHE CZ 1 1 8 5581 1 1 39 PHE H H -10.747 4.772 1.058 1.00 . A A . 39 PHE H 1 1 8 5582 1 1 39 PHE HA H -10.316 2.633 1.364 1.00 . A A . 39 PHE HA 1 1 8 5583 1 1 39 PHE HB2 H -12.084 0.998 0.623 1.00 . A A . 39 PHE HB2 1 1 8 5584 1 1 39 PHE HB3 H -12.663 2.379 1.522 1.00 . A A . 39 PHE HB3 1 1 8 5585 1 1 39 PHE HD1 H -14.287 3.798 0.610 1.00 . A A . 39 PHE HD1 1 1 8 5586 1 1 39 PHE HD2 H -12.423 0.882 -1.832 1.00 . A A . 39 PHE HD2 1 1 8 5587 1 1 39 PHE HE1 H -15.983 4.196 -1.133 1.00 . A A . 39 PHE HE1 1 1 8 5588 1 1 39 PHE HE2 H -14.109 1.265 -3.592 1.00 . A A . 39 PHE HE2 1 1 8 5589 1 1 39 PHE HZ H -15.891 2.924 -3.241 1.00 . A A . 39 PHE HZ 1 1 8 5590 1 1 39 PHE N N -10.911 4.226 0.258 1.00 . A A . 39 PHE N 1 1 8 5591 1 1 39 PHE O O -10.121 0.853 -0.867 1.00 . A A . 39 PHE O 1 1 8 5592 1 1 40 ARG C C -6.698 2.205 -1.397 1.00 . A A . 40 ARG C 1 1 8 5593 1 1 40 ARG CA C -8.077 2.209 -2.055 1.00 . A A . 40 ARG CA 1 1 8 5594 1 1 40 ARG CB C -8.085 3.076 -3.324 1.00 . A A . 40 ARG CB 1 1 8 5595 1 1 40 ARG CD C -8.639 1.322 -5.034 1.00 . A A . 40 ARG CD 1 1 8 5596 1 1 40 ARG CG C -7.625 2.375 -4.589 1.00 . A A . 40 ARG CG 1 1 8 5597 1 1 40 ARG CZ C -9.064 -0.041 -7.072 1.00 . A A . 40 ARG CZ 1 1 8 5598 1 1 40 ARG H H -8.882 3.675 -0.782 1.00 . A A . 40 ARG H 1 1 8 5599 1 1 40 ARG HA H -8.377 1.199 -2.286 1.00 . A A . 40 ARG HA 1 1 8 5600 1 1 40 ARG HB2 H -9.092 3.420 -3.504 1.00 . A A . 40 ARG HB2 1 1 8 5601 1 1 40 ARG HB3 H -7.445 3.931 -3.166 1.00 . A A . 40 ARG HB3 1 1 8 5602 1 1 40 ARG HD2 H -8.710 0.557 -4.275 1.00 . A A . 40 ARG HD2 1 1 8 5603 1 1 40 ARG HD3 H -9.601 1.795 -5.158 1.00 . A A . 40 ARG HD3 1 1 8 5604 1 1 40 ARG HE H -7.322 0.842 -6.570 1.00 . A A . 40 ARG HE 1 1 8 5605 1 1 40 ARG HG2 H -7.498 3.115 -5.365 1.00 . A A . 40 ARG HG2 1 1 8 5606 1 1 40 ARG HG3 H -6.676 1.894 -4.396 1.00 . A A . 40 ARG HG3 1 1 8 5607 1 1 40 ARG HH11 H -10.760 0.180 -5.929 1.00 . A A . 40 ARG HH11 1 1 8 5608 1 1 40 ARG HH12 H -10.947 -0.769 -7.330 1.00 . A A . 40 ARG HH12 1 1 8 5609 1 1 40 ARG HH21 H -7.628 -0.418 -8.447 1.00 . A A . 40 ARG HH21 1 1 8 5610 1 1 40 ARG HH22 H -9.157 -1.088 -8.838 1.00 . A A . 40 ARG HH22 1 1 8 5611 1 1 40 ARG N N -8.989 2.754 -1.093 1.00 . A A . 40 ARG N 1 1 8 5612 1 1 40 ARG NE N -8.255 0.693 -6.291 1.00 . A A . 40 ARG NE 1 1 8 5613 1 1 40 ARG NH1 N -10.341 -0.219 -6.747 1.00 . A A . 40 ARG NH1 1 1 8 5614 1 1 40 ARG NH2 N -8.589 -0.567 -8.193 1.00 . A A . 40 ARG NH2 1 1 8 5615 1 1 40 ARG O O -6.509 2.867 -0.358 1.00 . A A . 40 ARG O 1 1 8 5616 1 1 41 CYS C C -3.444 2.347 -1.893 1.00 . A A . 41 CYS C 1 1 8 5617 1 1 41 CYS CA C -4.450 1.386 -1.364 1.00 . A A . 41 CYS CA 1 1 8 5618 1 1 41 CYS CB C -3.911 -0.020 -1.437 1.00 . A A . 41 CYS CB 1 1 8 5619 1 1 41 CYS H H -5.912 1.034 -2.809 1.00 . A A . 41 CYS H 1 1 8 5620 1 1 41 CYS HA H -4.584 1.613 -0.316 1.00 . A A . 41 CYS HA 1 1 8 5621 1 1 41 CYS HB2 H -4.123 -0.434 -2.412 1.00 . A A . 41 CYS HB2 1 1 8 5622 1 1 41 CYS HB3 H -2.843 -0.003 -1.277 1.00 . A A . 41 CYS HB3 1 1 8 5623 1 1 41 CYS N N -5.759 1.497 -1.962 1.00 . A A . 41 CYS N 1 1 8 5624 1 1 41 CYS O O -3.162 2.399 -3.092 1.00 . A A . 41 CYS O 1 1 8 5625 1 1 41 CYS SG S -4.636 -1.103 -0.210 1.00 . A A . 41 CYS SG 1 1 8 5626 1 1 42 TRP C C -0.603 3.371 -0.619 1.00 . A A . 42 TRP C 1 1 8 5627 1 1 42 TRP CA C -1.829 3.980 -1.248 1.00 . A A . 42 TRP CA 1 1 8 5628 1 1 42 TRP CB C -2.082 5.364 -0.659 1.00 . A A . 42 TRP CB 1 1 8 5629 1 1 42 TRP CD1 C -2.296 7.325 -2.298 1.00 . A A . 42 TRP CD1 1 1 8 5630 1 1 42 TRP CD2 C -4.264 6.410 -1.746 1.00 . A A . 42 TRP CD2 1 1 8 5631 1 1 42 TRP CE2 C -4.493 7.489 -2.626 1.00 . A A . 42 TRP CE2 1 1 8 5632 1 1 42 TRP CE3 C -5.363 5.688 -1.283 1.00 . A A . 42 TRP CE3 1 1 8 5633 1 1 42 TRP CG C -2.842 6.328 -1.538 1.00 . A A . 42 TRP CG 1 1 8 5634 1 1 42 TRP CH2 C -6.813 7.132 -2.566 1.00 . A A . 42 TRP CH2 1 1 8 5635 1 1 42 TRP CZ2 C -5.765 7.853 -3.036 1.00 . A A . 42 TRP CZ2 1 1 8 5636 1 1 42 TRP CZ3 C -6.628 6.056 -1.700 1.00 . A A . 42 TRP CZ3 1 1 8 5637 1 1 42 TRP H H -3.234 3.042 -0.061 1.00 . A A . 42 TRP H 1 1 8 5638 1 1 42 TRP HA H -1.690 4.055 -2.316 1.00 . A A . 42 TRP HA 1 1 8 5639 1 1 42 TRP HB2 H -2.644 5.252 0.256 1.00 . A A . 42 TRP HB2 1 1 8 5640 1 1 42 TRP HB3 H -1.124 5.803 -0.424 1.00 . A A . 42 TRP HB3 1 1 8 5641 1 1 42 TRP HD1 H -1.237 7.531 -2.363 1.00 . A A . 42 TRP HD1 1 1 8 5642 1 1 42 TRP HE1 H -3.141 8.794 -3.541 1.00 . A A . 42 TRP HE1 1 1 8 5643 1 1 42 TRP HE3 H -5.244 4.845 -0.621 1.00 . A A . 42 TRP HE3 1 1 8 5644 1 1 42 TRP HH2 H -7.813 7.395 -2.875 1.00 . A A . 42 TRP HH2 1 1 8 5645 1 1 42 TRP HZ2 H -5.938 8.682 -3.705 1.00 . A A . 42 TRP HZ2 1 1 8 5646 1 1 42 TRP HZ3 H -7.492 5.510 -1.351 1.00 . A A . 42 TRP HZ3 1 1 8 5647 1 1 42 TRP N N -2.911 3.102 -0.989 1.00 . A A . 42 TRP N 1 1 8 5648 1 1 42 TRP NE1 N -3.282 8.032 -2.938 1.00 . A A . 42 TRP NE1 1 1 8 5649 1 1 42 TRP O O -0.564 3.140 0.594 1.00 . A A . 42 TRP O 1 1 8 5650 1 1 43 CYS C C 2.520 3.569 -0.510 1.00 . A A . 43 CYS C 1 1 8 5651 1 1 43 CYS CA C 1.559 2.487 -0.935 1.00 . A A . 43 CYS CA 1 1 8 5652 1 1 43 CYS CB C 2.180 1.590 -1.994 1.00 . A A . 43 CYS CB 1 1 8 5653 1 1 43 CYS H H 0.288 3.296 -2.369 1.00 . A A . 43 CYS H 1 1 8 5654 1 1 43 CYS HA H 1.307 1.888 -0.075 1.00 . A A . 43 CYS HA 1 1 8 5655 1 1 43 CYS HB2 H 2.409 2.181 -2.868 1.00 . A A . 43 CYS HB2 1 1 8 5656 1 1 43 CYS HB3 H 3.093 1.173 -1.597 1.00 . A A . 43 CYS HB3 1 1 8 5657 1 1 43 CYS N N 0.359 3.078 -1.412 1.00 . A A . 43 CYS N 1 1 8 5658 1 1 43 CYS O O 2.630 4.619 -1.160 1.00 . A A . 43 CYS O 1 1 8 5659 1 1 43 CYS SG S 1.118 0.203 -2.527 1.00 . A A . 43 CYS SG 1 1 8 5660 1 1 44 THR C C 5.493 3.882 0.679 1.00 . A A . 44 THR C 1 1 8 5661 1 1 44 THR CA C 4.096 4.264 1.143 1.00 . A A . 44 THR CA 1 1 8 5662 1 1 44 THR CB C 4.015 4.162 2.664 1.00 . A A . 44 THR CB 1 1 8 5663 1 1 44 THR CG2 C 4.728 5.330 3.330 1.00 . A A . 44 THR CG2 1 1 8 5664 1 1 44 THR H H 3.062 2.475 1.045 1.00 . A A . 44 THR H 1 1 8 5665 1 1 44 THR HA H 3.846 5.270 0.839 1.00 . A A . 44 THR HA 1 1 8 5666 1 1 44 THR HB H 4.466 3.232 2.978 1.00 . A A . 44 THR HB 1 1 8 5667 1 1 44 THR HG1 H 2.115 4.215 2.223 1.00 . A A . 44 THR HG1 1 1 8 5668 1 1 44 THR HG21 H 5.768 5.322 3.040 1.00 . A A . 44 THR HG21 1 1 8 5669 1 1 44 THR HG22 H 4.651 5.235 4.402 1.00 . A A . 44 THR HG22 1 1 8 5670 1 1 44 THR HG23 H 4.273 6.257 3.017 1.00 . A A . 44 THR HG23 1 1 8 5671 1 1 44 THR N N 3.171 3.340 0.584 1.00 . A A . 44 THR N 1 1 8 5672 1 1 44 THR O O 5.942 2.754 0.924 1.00 . A A . 44 THR O 1 1 8 5673 1 1 44 THR OG1 O 2.632 4.173 3.034 1.00 . A A . 44 THR OG1 1 1 8 5674 1 1 45 LYS C C 8.435 5.609 -0.220 1.00 . A A . 45 LYS C 1 1 8 5675 1 1 45 LYS CA C 7.468 4.491 -0.523 1.00 . A A . 45 LYS CA 1 1 8 5676 1 1 45 LYS CB C 7.393 4.201 -2.019 1.00 . A A . 45 LYS CB 1 1 8 5677 1 1 45 LYS CD C 6.592 4.838 -4.320 1.00 . A A . 45 LYS CD 1 1 8 5678 1 1 45 LYS CE C 7.878 4.340 -4.972 1.00 . A A . 45 LYS CE 1 1 8 5679 1 1 45 LYS CG C 6.824 5.322 -2.887 1.00 . A A . 45 LYS CG 1 1 8 5680 1 1 45 LYS H H 5.767 5.669 -0.155 1.00 . A A . 45 LYS H 1 1 8 5681 1 1 45 LYS HA H 7.807 3.599 -0.020 1.00 . A A . 45 LYS HA 1 1 8 5682 1 1 45 LYS HB2 H 8.393 3.992 -2.366 1.00 . A A . 45 LYS HB2 1 1 8 5683 1 1 45 LYS HB3 H 6.783 3.322 -2.157 1.00 . A A . 45 LYS HB3 1 1 8 5684 1 1 45 LYS HD2 H 5.883 4.026 -4.293 1.00 . A A . 45 LYS HD2 1 1 8 5685 1 1 45 LYS HD3 H 6.185 5.649 -4.907 1.00 . A A . 45 LYS HD3 1 1 8 5686 1 1 45 LYS HE2 H 8.572 5.163 -5.056 1.00 . A A . 45 LYS HE2 1 1 8 5687 1 1 45 LYS HE3 H 8.312 3.573 -4.348 1.00 . A A . 45 LYS HE3 1 1 8 5688 1 1 45 LYS HG2 H 5.885 5.651 -2.468 1.00 . A A . 45 LYS HG2 1 1 8 5689 1 1 45 LYS HG3 H 7.524 6.144 -2.901 1.00 . A A . 45 LYS HG3 1 1 8 5690 1 1 45 LYS HZ1 H 7.289 4.485 -6.990 1.00 . A A . 45 LYS HZ1 1 1 8 5691 1 1 45 LYS HZ2 H 6.965 2.989 -6.275 1.00 . A A . 45 LYS HZ2 1 1 8 5692 1 1 45 LYS HZ3 H 8.537 3.383 -6.685 1.00 . A A . 45 LYS HZ3 1 1 8 5693 1 1 45 LYS N N 6.156 4.777 0.001 1.00 . A A . 45 LYS N 1 1 8 5694 1 1 45 LYS NZ N 7.644 3.777 -6.320 1.00 . A A . 45 LYS NZ 1 1 8 5695 1 1 45 LYS O O 8.043 6.754 -0.130 1.00 . A A . 45 LYS O 1 1 8 5696 1 1 46 ASN C C 11.117 7.020 -0.930 1.00 . A A . 46 ASN C 1 1 8 5697 1 1 46 ASN CA C 10.703 6.241 0.284 1.00 . A A . 46 ASN CA 1 1 8 5698 1 1 46 ASN CB C 11.956 5.580 0.884 1.00 . A A . 46 ASN CB 1 1 8 5699 1 1 46 ASN CG C 11.746 4.911 2.227 1.00 . A A . 46 ASN CG 1 1 8 5700 1 1 46 ASN H H 9.920 4.325 -0.146 1.00 . A A . 46 ASN H 1 1 8 5701 1 1 46 ASN HA H 10.299 6.925 1.014 1.00 . A A . 46 ASN HA 1 1 8 5702 1 1 46 ASN HB2 H 12.312 4.826 0.197 1.00 . A A . 46 ASN HB2 1 1 8 5703 1 1 46 ASN HB3 H 12.723 6.333 0.993 1.00 . A A . 46 ASN HB3 1 1 8 5704 1 1 46 ASN HD21 H 13.586 5.374 2.752 1.00 . A A . 46 ASN HD21 1 1 8 5705 1 1 46 ASN HD22 H 12.659 4.509 3.923 1.00 . A A . 46 ASN HD22 1 1 8 5706 1 1 46 ASN N N 9.674 5.270 -0.046 1.00 . A A . 46 ASN N 1 1 8 5707 1 1 46 ASN ND2 N 12.761 4.931 3.045 1.00 . A A . 46 ASN ND2 1 1 8 5708 1 1 46 ASN O O 11.263 6.459 -2.025 1.00 . A A . 46 ASN O 1 1 8 5709 1 1 46 ASN OD1 O 10.674 4.383 2.535 1.00 . A A . 46 ASN OD1 1 1 8 5710 1 1 47 CYS C C 12.831 10.013 -1.086 1.00 . A A . 47 CYS C 1 1 8 5711 1 1 47 CYS CA C 11.769 9.167 -1.755 1.00 . A A . 47 CYS CA 1 1 8 5712 1 1 47 CYS CB C 10.651 10.049 -2.329 1.00 . A A . 47 CYS CB 1 1 8 5713 1 1 47 CYS H H 11.033 8.704 0.109 1.00 . A A . 47 CYS H 1 1 8 5714 1 1 47 CYS HA H 12.220 8.573 -2.537 1.00 . A A . 47 CYS HA 1 1 8 5715 1 1 47 CYS HB2 H 10.280 10.698 -1.549 1.00 . A A . 47 CYS HB2 1 1 8 5716 1 1 47 CYS HB3 H 11.051 10.654 -3.128 1.00 . A A . 47 CYS HB3 1 1 8 5717 1 1 47 CYS N N 11.268 8.289 -0.749 1.00 . A A . 47 CYS N 1 1 8 5718 1 1 47 CYS O O 12.498 11.060 -0.481 1.00 . A A . 47 CYS O 1 1 8 5719 1 1 47 CYS OXT O 13.998 9.587 -1.059 1.00 . A A . 47 CYS OXT 1 1 8 5720 1 1 47 CYS SG S 9.217 9.136 -2.995 1.00 . A A . 47 CYS SG 1 1 9 5721 1 1 1 LYS C C 10.349 10.596 1.890 1.00 . A A . 1 LYS C 1 1 9 5722 1 1 1 LYS CA C 11.085 11.720 2.561 1.00 . A A . 1 LYS CA 1 1 9 5723 1 1 1 LYS CB C 10.499 13.080 2.102 1.00 . A A . 1 LYS CB 1 1 9 5724 1 1 1 LYS CD C 8.544 14.711 2.146 1.00 . A A . 1 LYS CD 1 1 9 5725 1 1 1 LYS CE C 8.249 14.701 0.648 1.00 . A A . 1 LYS CE 1 1 9 5726 1 1 1 LYS CG C 9.096 13.381 2.643 1.00 . A A . 1 LYS CG 1 1 9 5727 1 1 1 LYS H1 H 13.071 12.362 2.598 1.00 . A A . 1 LYS H1 1 1 9 5728 1 1 1 LYS H2 H 12.590 11.558 1.151 1.00 . A A . 1 LYS H2 1 1 9 5729 1 1 1 LYS H3 H 12.847 10.696 2.541 1.00 . A A . 1 LYS H3 1 1 9 5730 1 1 1 LYS HA H 10.984 11.613 3.630 1.00 . A A . 1 LYS HA 1 1 9 5731 1 1 1 LYS HB2 H 11.156 13.876 2.418 1.00 . A A . 1 LYS HB2 1 1 9 5732 1 1 1 LYS HB3 H 10.451 13.077 1.023 1.00 . A A . 1 LYS HB3 1 1 9 5733 1 1 1 LYS HD2 H 7.625 14.921 2.673 1.00 . A A . 1 LYS HD2 1 1 9 5734 1 1 1 LYS HD3 H 9.265 15.485 2.360 1.00 . A A . 1 LYS HD3 1 1 9 5735 1 1 1 LYS HE2 H 7.955 15.696 0.351 1.00 . A A . 1 LYS HE2 1 1 9 5736 1 1 1 LYS HE3 H 9.150 14.429 0.117 1.00 . A A . 1 LYS HE3 1 1 9 5737 1 1 1 LYS HG2 H 8.427 12.592 2.332 1.00 . A A . 1 LYS HG2 1 1 9 5738 1 1 1 LYS HG3 H 9.141 13.402 3.722 1.00 . A A . 1 LYS HG3 1 1 9 5739 1 1 1 LYS HZ1 H 7.012 13.797 -0.744 1.00 . A A . 1 LYS HZ1 1 1 9 5740 1 1 1 LYS HZ2 H 6.265 14.021 0.739 1.00 . A A . 1 LYS HZ2 1 1 9 5741 1 1 1 LYS HZ3 H 7.374 12.765 0.534 1.00 . A A . 1 LYS HZ3 1 1 9 5742 1 1 1 LYS N N 12.491 11.607 2.184 1.00 . A A . 1 LYS N 1 1 9 5743 1 1 1 LYS NZ N 7.162 13.755 0.284 1.00 . A A . 1 LYS NZ 1 1 9 5744 1 1 1 LYS O O 10.856 10.020 0.937 1.00 . A A . 1 LYS O 1 1 9 5745 1 1 2 THR C C 7.684 9.773 0.562 1.00 . A A . 2 THR C 1 1 9 5746 1 1 2 THR CA C 8.416 9.250 1.781 1.00 . A A . 2 THR CA 1 1 9 5747 1 1 2 THR CB C 7.412 8.676 2.790 1.00 . A A . 2 THR CB 1 1 9 5748 1 1 2 THR CG2 C 8.134 7.864 3.847 1.00 . A A . 2 THR CG2 1 1 9 5749 1 1 2 THR H H 8.819 10.699 3.174 1.00 . A A . 2 THR H 1 1 9 5750 1 1 2 THR HA H 9.078 8.451 1.479 1.00 . A A . 2 THR HA 1 1 9 5751 1 1 2 THR HB H 6.723 8.033 2.261 1.00 . A A . 2 THR HB 1 1 9 5752 1 1 2 THR HG1 H 5.731 9.507 3.387 1.00 . A A . 2 THR HG1 1 1 9 5753 1 1 2 THR HG21 H 7.423 7.460 4.552 1.00 . A A . 2 THR HG21 1 1 9 5754 1 1 2 THR HG22 H 8.847 8.495 4.358 1.00 . A A . 2 THR HG22 1 1 9 5755 1 1 2 THR HG23 H 8.656 7.057 3.353 1.00 . A A . 2 THR HG23 1 1 9 5756 1 1 2 THR N N 9.193 10.265 2.375 1.00 . A A . 2 THR N 1 1 9 5757 1 1 2 THR O O 7.385 10.980 0.456 1.00 . A A . 2 THR O 1 1 9 5758 1 1 2 THR OG1 O 6.668 9.746 3.411 1.00 . A A . 2 THR OG1 1 1 9 5759 1 1 3 CYS C C 5.516 8.217 -1.478 1.00 . A A . 3 CYS C 1 1 9 5760 1 1 3 CYS CA C 6.671 9.180 -1.522 1.00 . A A . 3 CYS CA 1 1 9 5761 1 1 3 CYS CB C 7.501 8.959 -2.786 1.00 . A A . 3 CYS CB 1 1 9 5762 1 1 3 CYS H H 7.803 7.989 -0.221 1.00 . A A . 3 CYS H 1 1 9 5763 1 1 3 CYS HA H 6.311 10.197 -1.472 1.00 . A A . 3 CYS HA 1 1 9 5764 1 1 3 CYS HB2 H 7.756 7.913 -2.866 1.00 . A A . 3 CYS HB2 1 1 9 5765 1 1 3 CYS HB3 H 6.917 9.251 -3.645 1.00 . A A . 3 CYS HB3 1 1 9 5766 1 1 3 CYS N N 7.449 8.898 -0.350 1.00 . A A . 3 CYS N 1 1 9 5767 1 1 3 CYS O O 5.686 7.082 -1.007 1.00 . A A . 3 CYS O 1 1 9 5768 1 1 3 CYS SG S 9.057 9.895 -2.843 1.00 . A A . 3 CYS SG 1 1 9 5769 1 1 4 GLU C C 2.257 7.978 -2.932 1.00 . A A . 4 GLU C 1 1 9 5770 1 1 4 GLU CA C 3.211 7.777 -1.774 1.00 . A A . 4 GLU CA 1 1 9 5771 1 1 4 GLU CB C 2.541 8.091 -0.449 1.00 . A A . 4 GLU CB 1 1 9 5772 1 1 4 GLU CD C 0.951 7.477 1.321 1.00 . A A . 4 GLU CD 1 1 9 5773 1 1 4 GLU CG C 1.435 7.157 -0.051 1.00 . A A . 4 GLU CG 1 1 9 5774 1 1 4 GLU H H 4.248 9.508 -2.321 1.00 . A A . 4 GLU H 1 1 9 5775 1 1 4 GLU HA H 3.543 6.751 -1.754 1.00 . A A . 4 GLU HA 1 1 9 5776 1 1 4 GLU HB2 H 3.291 8.057 0.327 1.00 . A A . 4 GLU HB2 1 1 9 5777 1 1 4 GLU HB3 H 2.141 9.092 -0.497 1.00 . A A . 4 GLU HB3 1 1 9 5778 1 1 4 GLU HG2 H 0.616 7.262 -0.747 1.00 . A A . 4 GLU HG2 1 1 9 5779 1 1 4 GLU HG3 H 1.799 6.141 -0.063 1.00 . A A . 4 GLU HG3 1 1 9 5780 1 1 4 GLU N N 4.359 8.624 -1.908 1.00 . A A . 4 GLU N 1 1 9 5781 1 1 4 GLU O O 1.820 9.102 -3.207 1.00 . A A . 4 GLU O 1 1 9 5782 1 1 4 GLU OE1 O 1.727 7.310 2.276 1.00 . A A . 4 GLU OE1 1 1 9 5783 1 1 4 GLU OE2 O -0.202 7.903 1.483 1.00 . A A . 4 GLU OE2 1 1 9 5784 1 1 5 ASN C C 0.124 5.714 -4.632 1.00 . A A . 5 ASN C 1 1 9 5785 1 1 5 ASN CA C 1.058 6.916 -4.739 1.00 . A A . 5 ASN CA 1 1 9 5786 1 1 5 ASN CB C 1.900 6.852 -6.038 1.00 . A A . 5 ASN CB 1 1 9 5787 1 1 5 ASN CG C 1.087 6.951 -7.327 1.00 . A A . 5 ASN CG 1 1 9 5788 1 1 5 ASN H H 2.304 6.033 -3.316 1.00 . A A . 5 ASN H 1 1 9 5789 1 1 5 ASN HA H 0.482 7.829 -4.724 1.00 . A A . 5 ASN HA 1 1 9 5790 1 1 5 ASN HB2 H 2.605 7.669 -6.033 1.00 . A A . 5 ASN HB2 1 1 9 5791 1 1 5 ASN HB3 H 2.448 5.922 -6.049 1.00 . A A . 5 ASN HB3 1 1 9 5792 1 1 5 ASN HD21 H 2.438 5.883 -8.293 1.00 . A A . 5 ASN HD21 1 1 9 5793 1 1 5 ASN HD22 H 1.101 6.401 -9.228 1.00 . A A . 5 ASN HD22 1 1 9 5794 1 1 5 ASN N N 1.942 6.901 -3.595 1.00 . A A . 5 ASN N 1 1 9 5795 1 1 5 ASN ND2 N 1.584 6.357 -8.376 1.00 . A A . 5 ASN ND2 1 1 9 5796 1 1 5 ASN O O 0.362 4.815 -3.796 1.00 . A A . 5 ASN O 1 1 9 5797 1 1 5 ASN OD1 O 0.023 7.573 -7.370 1.00 . A A . 5 ASN OD1 1 1 9 5798 1 1 6 LEU C C -1.241 3.338 -5.934 1.00 . A A . 6 LEU C 1 1 9 5799 1 1 6 LEU CA C -1.884 4.623 -5.462 1.00 . A A . 6 LEU CA 1 1 9 5800 1 1 6 LEU CB C -3.074 4.960 -6.371 1.00 . A A . 6 LEU CB 1 1 9 5801 1 1 6 LEU CD1 C -5.110 6.304 -6.876 1.00 . A A . 6 LEU CD1 1 1 9 5802 1 1 6 LEU CD2 C -4.903 5.176 -4.702 1.00 . A A . 6 LEU CD2 1 1 9 5803 1 1 6 LEU CG C -4.138 5.890 -5.795 1.00 . A A . 6 LEU CG 1 1 9 5804 1 1 6 LEU H H -1.066 6.475 -6.027 1.00 . A A . 6 LEU H 1 1 9 5805 1 1 6 LEU HA H -2.257 4.475 -4.461 1.00 . A A . 6 LEU HA 1 1 9 5806 1 1 6 LEU HB2 H -2.686 5.414 -7.271 1.00 . A A . 6 LEU HB2 1 1 9 5807 1 1 6 LEU HB3 H -3.550 4.031 -6.643 1.00 . A A . 6 LEU HB3 1 1 9 5808 1 1 6 LEU HD11 H -5.571 5.421 -7.292 1.00 . A A . 6 LEU HD11 1 1 9 5809 1 1 6 LEU HD12 H -4.585 6.846 -7.649 1.00 . A A . 6 LEU HD12 1 1 9 5810 1 1 6 LEU HD13 H -5.869 6.933 -6.437 1.00 . A A . 6 LEU HD13 1 1 9 5811 1 1 6 LEU HD21 H -5.382 4.297 -5.108 1.00 . A A . 6 LEU HD21 1 1 9 5812 1 1 6 LEU HD22 H -5.660 5.844 -4.317 1.00 . A A . 6 LEU HD22 1 1 9 5813 1 1 6 LEU HD23 H -4.235 4.892 -3.904 1.00 . A A . 6 LEU HD23 1 1 9 5814 1 1 6 LEU HG H -3.681 6.771 -5.369 1.00 . A A . 6 LEU HG 1 1 9 5815 1 1 6 LEU N N -0.932 5.713 -5.422 1.00 . A A . 6 LEU N 1 1 9 5816 1 1 6 LEU O O -0.333 3.341 -6.784 1.00 . A A . 6 LEU O 1 1 9 5817 1 1 7 ALA C C -1.930 0.594 -7.072 1.00 . A A . 7 ALA C 1 1 9 5818 1 1 7 ALA CA C -1.241 0.959 -5.765 1.00 . A A . 7 ALA CA 1 1 9 5819 1 1 7 ALA CB C -1.555 -0.053 -4.684 1.00 . A A . 7 ALA CB 1 1 9 5820 1 1 7 ALA H H -2.322 2.354 -4.622 1.00 . A A . 7 ALA H 1 1 9 5821 1 1 7 ALA HA H -0.173 0.993 -5.918 1.00 . A A . 7 ALA HA 1 1 9 5822 1 1 7 ALA HB1 H -2.625 -0.090 -4.542 1.00 . A A . 7 ALA HB1 1 1 9 5823 1 1 7 ALA HB2 H -1.087 0.263 -3.762 1.00 . A A . 7 ALA HB2 1 1 9 5824 1 1 7 ALA HB3 H -1.189 -1.027 -4.972 1.00 . A A . 7 ALA HB3 1 1 9 5825 1 1 7 ALA N N -1.679 2.257 -5.361 1.00 . A A . 7 ALA N 1 1 9 5826 1 1 7 ALA O O -3.165 0.656 -7.176 1.00 . A A . 7 ALA O 1 1 9 5827 1 1 8 ASP C C -1.677 -1.571 -9.553 1.00 . A A . 8 ASP C 1 1 9 5828 1 1 8 ASP CA C -1.663 -0.071 -9.381 1.00 . A A . 8 ASP CA 1 1 9 5829 1 1 8 ASP CB C -0.799 0.567 -10.461 1.00 . A A . 8 ASP CB 1 1 9 5830 1 1 8 ASP CG C -1.235 0.227 -11.867 1.00 . A A . 8 ASP CG 1 1 9 5831 1 1 8 ASP H H -0.179 0.272 -7.915 1.00 . A A . 8 ASP H 1 1 9 5832 1 1 8 ASP HA H -2.671 0.308 -9.465 1.00 . A A . 8 ASP HA 1 1 9 5833 1 1 8 ASP HB2 H -0.846 1.640 -10.352 1.00 . A A . 8 ASP HB2 1 1 9 5834 1 1 8 ASP HB3 H 0.221 0.241 -10.328 1.00 . A A . 8 ASP HB3 1 1 9 5835 1 1 8 ASP N N -1.150 0.276 -8.063 1.00 . A A . 8 ASP N 1 1 9 5836 1 1 8 ASP O O -2.616 -2.142 -10.135 1.00 . A A . 8 ASP O 1 1 9 5837 1 1 8 ASP OD1 O -2.066 0.952 -12.433 1.00 . A A . 8 ASP OD1 1 1 9 5838 1 1 8 ASP OD2 O -0.728 -0.758 -12.446 1.00 . A A . 8 ASP OD2 1 1 9 5839 1 1 9 THR C C -1.590 -4.301 -8.224 1.00 . A A . 9 THR C 1 1 9 5840 1 1 9 THR CA C -0.514 -3.639 -9.081 1.00 . A A . 9 THR CA 1 1 9 5841 1 1 9 THR CB C 0.876 -4.029 -8.566 1.00 . A A . 9 THR CB 1 1 9 5842 1 1 9 THR CG2 C 1.148 -5.496 -8.793 1.00 . A A . 9 THR CG2 1 1 9 5843 1 1 9 THR H H 0.079 -1.737 -8.570 1.00 . A A . 9 THR H 1 1 9 5844 1 1 9 THR HA H -0.608 -3.956 -10.108 1.00 . A A . 9 THR HA 1 1 9 5845 1 1 9 THR HB H 0.931 -3.810 -7.509 1.00 . A A . 9 THR HB 1 1 9 5846 1 1 9 THR HG1 H 2.460 -2.879 -8.583 1.00 . A A . 9 THR HG1 1 1 9 5847 1 1 9 THR HG21 H 2.133 -5.731 -8.421 1.00 . A A . 9 THR HG21 1 1 9 5848 1 1 9 THR HG22 H 1.089 -5.699 -9.852 1.00 . A A . 9 THR HG22 1 1 9 5849 1 1 9 THR HG23 H 0.405 -6.073 -8.264 1.00 . A A . 9 THR HG23 1 1 9 5850 1 1 9 THR N N -0.655 -2.214 -9.012 1.00 . A A . 9 THR N 1 1 9 5851 1 1 9 THR O O -2.130 -5.353 -8.582 1.00 . A A . 9 THR O 1 1 9 5852 1 1 9 THR OG1 O 1.869 -3.251 -9.264 1.00 . A A . 9 THR OG1 1 1 9 5853 1 1 10 TYR C C -4.279 -3.854 -6.950 1.00 . A A . 10 TYR C 1 1 9 5854 1 1 10 TYR CA C -2.962 -4.136 -6.268 1.00 . A A . 10 TYR CA 1 1 9 5855 1 1 10 TYR CB C -2.908 -3.454 -4.906 1.00 . A A . 10 TYR CB 1 1 9 5856 1 1 10 TYR CD1 C -5.073 -3.345 -3.617 1.00 . A A . 10 TYR CD1 1 1 9 5857 1 1 10 TYR CD2 C -3.645 -5.205 -3.273 1.00 . A A . 10 TYR CD2 1 1 9 5858 1 1 10 TYR CE1 C -5.971 -3.859 -2.710 1.00 . A A . 10 TYR CE1 1 1 9 5859 1 1 10 TYR CE2 C -4.531 -5.728 -2.368 1.00 . A A . 10 TYR CE2 1 1 9 5860 1 1 10 TYR CG C -3.896 -4.010 -3.911 1.00 . A A . 10 TYR CG 1 1 9 5861 1 1 10 TYR CZ C -5.693 -5.054 -2.086 1.00 . A A . 10 TYR CZ 1 1 9 5862 1 1 10 TYR H H -1.442 -2.843 -6.881 1.00 . A A . 10 TYR H 1 1 9 5863 1 1 10 TYR HA H -2.842 -5.202 -6.146 1.00 . A A . 10 TYR HA 1 1 9 5864 1 1 10 TYR HB2 H -1.917 -3.570 -4.491 1.00 . A A . 10 TYR HB2 1 1 9 5865 1 1 10 TYR HB3 H -3.116 -2.401 -5.033 1.00 . A A . 10 TYR HB3 1 1 9 5866 1 1 10 TYR HD1 H -5.288 -2.405 -4.104 1.00 . A A . 10 TYR HD1 1 1 9 5867 1 1 10 TYR HD2 H -2.728 -5.733 -3.495 1.00 . A A . 10 TYR HD2 1 1 9 5868 1 1 10 TYR HE1 H -6.873 -3.304 -2.504 1.00 . A A . 10 TYR HE1 1 1 9 5869 1 1 10 TYR HE2 H -4.295 -6.665 -1.887 1.00 . A A . 10 TYR HE2 1 1 9 5870 1 1 10 TYR HH H -6.061 -5.951 -0.452 1.00 . A A . 10 TYR HH 1 1 9 5871 1 1 10 TYR N N -1.918 -3.663 -7.120 1.00 . A A . 10 TYR N 1 1 9 5872 1 1 10 TYR O O -4.593 -2.701 -7.274 1.00 . A A . 10 TYR O 1 1 9 5873 1 1 10 TYR OH O -6.579 -5.581 -1.180 1.00 . A A . 10 TYR OH 1 1 9 5874 1 1 11 LYS C C -7.445 -5.044 -7.001 1.00 . A A . 11 LYS C 1 1 9 5875 1 1 11 LYS CA C -6.248 -4.766 -7.902 1.00 . A A . 11 LYS CA 1 1 9 5876 1 1 11 LYS CB C -6.209 -5.679 -9.138 1.00 . A A . 11 LYS CB 1 1 9 5877 1 1 11 LYS CD C -5.724 -7.976 -10.084 1.00 . A A . 11 LYS CD 1 1 9 5878 1 1 11 LYS CE C -4.469 -7.574 -10.844 1.00 . A A . 11 LYS CE 1 1 9 5879 1 1 11 LYS CG C -5.913 -7.144 -8.827 1.00 . A A . 11 LYS CG 1 1 9 5880 1 1 11 LYS H H -4.752 -5.758 -6.834 1.00 . A A . 11 LYS H 1 1 9 5881 1 1 11 LYS HA H -6.309 -3.743 -8.240 1.00 . A A . 11 LYS HA 1 1 9 5882 1 1 11 LYS HB2 H -7.162 -5.623 -9.641 1.00 . A A . 11 LYS HB2 1 1 9 5883 1 1 11 LYS HB3 H -5.442 -5.309 -9.803 1.00 . A A . 11 LYS HB3 1 1 9 5884 1 1 11 LYS HD2 H -5.647 -9.017 -9.811 1.00 . A A . 11 LYS HD2 1 1 9 5885 1 1 11 LYS HD3 H -6.582 -7.830 -10.724 1.00 . A A . 11 LYS HD3 1 1 9 5886 1 1 11 LYS HE2 H -4.558 -6.545 -11.159 1.00 . A A . 11 LYS HE2 1 1 9 5887 1 1 11 LYS HE3 H -3.619 -7.668 -10.188 1.00 . A A . 11 LYS HE3 1 1 9 5888 1 1 11 LYS HG2 H -5.011 -7.201 -8.238 1.00 . A A . 11 LYS HG2 1 1 9 5889 1 1 11 LYS HG3 H -6.737 -7.546 -8.257 1.00 . A A . 11 LYS HG3 1 1 9 5890 1 1 11 LYS HZ1 H -5.028 -8.308 -12.726 1.00 . A A . 11 LYS HZ1 1 1 9 5891 1 1 11 LYS HZ2 H -4.201 -9.422 -11.783 1.00 . A A . 11 LYS HZ2 1 1 9 5892 1 1 11 LYS HZ3 H -3.367 -8.157 -12.506 1.00 . A A . 11 LYS HZ3 1 1 9 5893 1 1 11 LYS N N -5.023 -4.880 -7.182 1.00 . A A . 11 LYS N 1 1 9 5894 1 1 11 LYS NZ N -4.258 -8.413 -12.037 1.00 . A A . 11 LYS NZ 1 1 9 5895 1 1 11 LYS O O -7.538 -6.104 -6.363 1.00 . A A . 11 LYS O 1 1 9 5896 1 1 12 GLY C C -9.571 -3.164 -5.029 1.00 . A A . 12 GLY C 1 1 9 5897 1 1 12 GLY CA C -9.501 -4.209 -6.125 1.00 . A A . 12 GLY CA 1 1 9 5898 1 1 12 GLY H H -8.143 -3.231 -7.381 1.00 . A A . 12 GLY H 1 1 9 5899 1 1 12 GLY HA2 H -10.363 -4.107 -6.770 1.00 . A A . 12 GLY HA2 1 1 9 5900 1 1 12 GLY HA3 H -9.516 -5.189 -5.673 1.00 . A A . 12 GLY HA3 1 1 9 5901 1 1 12 GLY N N -8.315 -4.077 -6.915 1.00 . A A . 12 GLY N 1 1 9 5902 1 1 12 GLY O O -8.568 -2.480 -4.749 1.00 . A A . 12 GLY O 1 1 9 5903 1 1 13 PRO C C -10.329 -2.621 -2.008 1.00 . A A . 13 PRO C 1 1 9 5904 1 1 13 PRO CA C -10.904 -2.050 -3.306 1.00 . A A . 13 PRO CA 1 1 9 5905 1 1 13 PRO CB C -12.421 -1.874 -3.202 1.00 . A A . 13 PRO CB 1 1 9 5906 1 1 13 PRO CD C -12.005 -3.686 -4.736 1.00 . A A . 13 PRO CD 1 1 9 5907 1 1 13 PRO CG C -12.996 -3.146 -3.734 1.00 . A A . 13 PRO CG 1 1 9 5908 1 1 13 PRO HA H -10.430 -1.103 -3.522 1.00 . A A . 13 PRO HA 1 1 9 5909 1 1 13 PRO HB2 H -12.696 -1.714 -2.169 1.00 . A A . 13 PRO HB2 1 1 9 5910 1 1 13 PRO HB3 H -12.730 -1.026 -3.794 1.00 . A A . 13 PRO HB3 1 1 9 5911 1 1 13 PRO HD2 H -11.894 -4.754 -4.618 1.00 . A A . 13 PRO HD2 1 1 9 5912 1 1 13 PRO HD3 H -12.322 -3.450 -5.741 1.00 . A A . 13 PRO HD3 1 1 9 5913 1 1 13 PRO HG2 H -13.128 -3.850 -2.926 1.00 . A A . 13 PRO HG2 1 1 9 5914 1 1 13 PRO HG3 H -13.944 -2.950 -4.213 1.00 . A A . 13 PRO HG3 1 1 9 5915 1 1 13 PRO N N -10.741 -2.986 -4.406 1.00 . A A . 13 PRO N 1 1 9 5916 1 1 13 PRO O O -10.449 -3.828 -1.726 1.00 . A A . 13 PRO O 1 1 9 5917 1 1 14 CYS C C -10.046 -2.028 1.151 1.00 . A A . 14 CYS C 1 1 9 5918 1 1 14 CYS CA C -9.100 -2.219 -0.007 1.00 . A A . 14 CYS CA 1 1 9 5919 1 1 14 CYS CB C -7.809 -1.470 0.253 1.00 . A A . 14 CYS CB 1 1 9 5920 1 1 14 CYS H H -9.662 -0.830 -1.467 1.00 . A A . 14 CYS H 1 1 9 5921 1 1 14 CYS HA H -8.874 -3.271 -0.103 1.00 . A A . 14 CYS HA 1 1 9 5922 1 1 14 CYS HB2 H -7.116 -1.666 -0.552 1.00 . A A . 14 CYS HB2 1 1 9 5923 1 1 14 CYS HB3 H -8.017 -0.411 0.293 1.00 . A A . 14 CYS HB3 1 1 9 5924 1 1 14 CYS N N -9.708 -1.785 -1.232 1.00 . A A . 14 CYS N 1 1 9 5925 1 1 14 CYS O O -10.455 -0.910 1.455 1.00 . A A . 14 CYS O 1 1 9 5926 1 1 14 CYS SG S -6.993 -1.937 1.813 1.00 . A A . 14 CYS SG 1 1 9 5927 1 1 15 PHE C C -10.444 -3.096 4.178 1.00 . A A . 15 PHE C 1 1 9 5928 1 1 15 PHE CA C -11.282 -3.078 2.913 1.00 . A A . 15 PHE CA 1 1 9 5929 1 1 15 PHE CB C -12.229 -4.279 2.894 1.00 . A A . 15 PHE CB 1 1 9 5930 1 1 15 PHE CD1 C -14.064 -3.509 1.374 1.00 . A A . 15 PHE CD1 1 1 9 5931 1 1 15 PHE CD2 C -12.747 -5.374 0.699 1.00 . A A . 15 PHE CD2 1 1 9 5932 1 1 15 PHE CE1 C -14.799 -3.604 0.215 1.00 . A A . 15 PHE CE1 1 1 9 5933 1 1 15 PHE CE2 C -13.481 -5.475 -0.463 1.00 . A A . 15 PHE CE2 1 1 9 5934 1 1 15 PHE CG C -13.031 -4.390 1.631 1.00 . A A . 15 PHE CG 1 1 9 5935 1 1 15 PHE CZ C -14.508 -4.587 -0.706 1.00 . A A . 15 PHE CZ 1 1 9 5936 1 1 15 PHE H H -10.071 -3.977 1.457 1.00 . A A . 15 PHE H 1 1 9 5937 1 1 15 PHE HA H -11.862 -2.168 2.867 1.00 . A A . 15 PHE HA 1 1 9 5938 1 1 15 PHE HB2 H -11.656 -5.186 3.007 1.00 . A A . 15 PHE HB2 1 1 9 5939 1 1 15 PHE HB3 H -12.916 -4.191 3.720 1.00 . A A . 15 PHE HB3 1 1 9 5940 1 1 15 PHE HD1 H -14.295 -2.736 2.094 1.00 . A A . 15 PHE HD1 1 1 9 5941 1 1 15 PHE HD2 H -11.944 -6.071 0.888 1.00 . A A . 15 PHE HD2 1 1 9 5942 1 1 15 PHE HE1 H -15.603 -2.907 0.030 1.00 . A A . 15 PHE HE1 1 1 9 5943 1 1 15 PHE HE2 H -13.253 -6.246 -1.184 1.00 . A A . 15 PHE HE2 1 1 9 5944 1 1 15 PHE HZ H -15.087 -4.662 -1.615 1.00 . A A . 15 PHE HZ 1 1 9 5945 1 1 15 PHE N N -10.409 -3.114 1.775 1.00 . A A . 15 PHE N 1 1 9 5946 1 1 15 PHE O O -10.651 -2.301 5.096 1.00 . A A . 15 PHE O 1 1 9 5947 1 1 16 THR C C -7.215 -3.635 4.931 1.00 . A A . 16 THR C 1 1 9 5948 1 1 16 THR CA C -8.606 -4.136 5.326 1.00 . A A . 16 THR CA 1 1 9 5949 1 1 16 THR CB C -8.524 -5.616 5.703 1.00 . A A . 16 THR CB 1 1 9 5950 1 1 16 THR CG2 C -7.876 -5.793 7.061 1.00 . A A . 16 THR CG2 1 1 9 5951 1 1 16 THR H H -9.330 -4.551 3.418 1.00 . A A . 16 THR H 1 1 9 5952 1 1 16 THR HA H -8.990 -3.571 6.164 1.00 . A A . 16 THR HA 1 1 9 5953 1 1 16 THR HB H -7.923 -6.107 4.953 1.00 . A A . 16 THR HB 1 1 9 5954 1 1 16 THR HG1 H -10.471 -5.447 5.923 1.00 . A A . 16 THR HG1 1 1 9 5955 1 1 16 THR HG21 H -8.462 -5.279 7.808 1.00 . A A . 16 THR HG21 1 1 9 5956 1 1 16 THR HG22 H -6.878 -5.383 7.033 1.00 . A A . 16 THR HG22 1 1 9 5957 1 1 16 THR HG23 H -7.827 -6.844 7.300 1.00 . A A . 16 THR HG23 1 1 9 5958 1 1 16 THR N N -9.482 -3.980 4.202 1.00 . A A . 16 THR N 1 1 9 5959 1 1 16 THR O O -6.523 -4.278 4.126 1.00 . A A . 16 THR O 1 1 9 5960 1 1 16 THR OG1 O -9.859 -6.175 5.741 1.00 . A A . 16 THR OG1 1 1 9 5961 1 1 17 THR C C -4.342 -2.757 5.332 1.00 . A A . 17 THR C 1 1 9 5962 1 1 17 THR CA C -5.562 -1.849 5.124 1.00 . A A . 17 THR CA 1 1 9 5963 1 1 17 THR CB C -5.372 -0.463 5.842 1.00 . A A . 17 THR CB 1 1 9 5964 1 1 17 THR CG2 C -5.191 -0.628 7.339 1.00 . A A . 17 THR CG2 1 1 9 5965 1 1 17 THR H H -7.397 -2.073 6.152 1.00 . A A . 17 THR H 1 1 9 5966 1 1 17 THR HA H -5.630 -1.666 4.062 1.00 . A A . 17 THR HA 1 1 9 5967 1 1 17 THR HB H -6.250 0.138 5.657 1.00 . A A . 17 THR HB 1 1 9 5968 1 1 17 THR HG1 H -3.424 -0.197 5.617 1.00 . A A . 17 THR HG1 1 1 9 5969 1 1 17 THR HG21 H -6.070 -1.094 7.760 1.00 . A A . 17 THR HG21 1 1 9 5970 1 1 17 THR HG22 H -5.032 0.336 7.797 1.00 . A A . 17 THR HG22 1 1 9 5971 1 1 17 THR HG23 H -4.332 -1.258 7.523 1.00 . A A . 17 THR HG23 1 1 9 5972 1 1 17 THR N N -6.815 -2.504 5.489 1.00 . A A . 17 THR N 1 1 9 5973 1 1 17 THR O O -3.407 -2.719 4.543 1.00 . A A . 17 THR O 1 1 9 5974 1 1 17 THR OG1 O -4.229 0.236 5.311 1.00 . A A . 17 THR OG1 1 1 9 5975 1 1 18 GLY C C -3.009 -5.481 5.512 1.00 . A A . 18 GLY C 1 1 9 5976 1 1 18 GLY CA C -3.285 -4.500 6.636 1.00 . A A . 18 GLY CA 1 1 9 5977 1 1 18 GLY H H -5.181 -3.631 6.931 1.00 . A A . 18 GLY H 1 1 9 5978 1 1 18 GLY HA2 H -2.402 -3.903 6.800 1.00 . A A . 18 GLY HA2 1 1 9 5979 1 1 18 GLY HA3 H -3.506 -5.053 7.537 1.00 . A A . 18 GLY HA3 1 1 9 5980 1 1 18 GLY N N -4.391 -3.612 6.349 1.00 . A A . 18 GLY N 1 1 9 5981 1 1 18 GLY O O -1.863 -5.858 5.274 1.00 . A A . 18 GLY O 1 1 9 5982 1 1 19 SER C C -3.206 -6.158 2.516 1.00 . A A . 19 SER C 1 1 9 5983 1 1 19 SER CA C -3.918 -6.804 3.722 1.00 . A A . 19 SER CA 1 1 9 5984 1 1 19 SER CB C -5.308 -7.309 3.359 1.00 . A A . 19 SER CB 1 1 9 5985 1 1 19 SER H H -4.928 -5.465 4.967 1.00 . A A . 19 SER H 1 1 9 5986 1 1 19 SER HA H -3.324 -7.632 4.080 1.00 . A A . 19 SER HA 1 1 9 5987 1 1 19 SER HB2 H -5.868 -6.522 2.875 1.00 . A A . 19 SER HB2 1 1 9 5988 1 1 19 SER HB3 H -5.226 -8.163 2.703 1.00 . A A . 19 SER HB3 1 1 9 5989 1 1 19 SER HG H -5.329 -7.786 5.244 1.00 . A A . 19 SER HG 1 1 9 5990 1 1 19 SER N N -4.044 -5.851 4.791 1.00 . A A . 19 SER N 1 1 9 5991 1 1 19 SER O O -2.349 -6.782 1.871 1.00 . A A . 19 SER O 1 1 9 5992 1 1 19 SER OG O -5.994 -7.713 4.546 1.00 . A A . 19 SER OG 1 1 9 5993 1 1 20 CYS C C -1.491 -3.713 1.586 1.00 . A A . 20 CYS C 1 1 9 5994 1 1 20 CYS CA C -2.895 -4.164 1.176 1.00 . A A . 20 CYS CA 1 1 9 5995 1 1 20 CYS CB C -3.762 -2.973 0.787 1.00 . A A . 20 CYS CB 1 1 9 5996 1 1 20 CYS H H -4.150 -4.428 2.848 1.00 . A A . 20 CYS H 1 1 9 5997 1 1 20 CYS HA H -2.810 -4.840 0.338 1.00 . A A . 20 CYS HA 1 1 9 5998 1 1 20 CYS HB2 H -4.771 -3.312 0.607 1.00 . A A . 20 CYS HB2 1 1 9 5999 1 1 20 CYS HB3 H -3.769 -2.267 1.605 1.00 . A A . 20 CYS HB3 1 1 9 6000 1 1 20 CYS N N -3.506 -4.893 2.273 1.00 . A A . 20 CYS N 1 1 9 6001 1 1 20 CYS O O -0.569 -3.657 0.763 1.00 . A A . 20 CYS O 1 1 9 6002 1 1 20 CYS SG S -3.211 -2.093 -0.695 1.00 . A A . 20 CYS SG 1 1 9 6003 1 1 21 ASP C C 0.925 -4.219 3.223 1.00 . A A . 21 ASP C 1 1 9 6004 1 1 21 ASP CA C -0.038 -3.092 3.478 1.00 . A A . 21 ASP CA 1 1 9 6005 1 1 21 ASP CB C -0.204 -2.858 4.988 1.00 . A A . 21 ASP CB 1 1 9 6006 1 1 21 ASP CG C 1.090 -2.553 5.721 1.00 . A A . 21 ASP CG 1 1 9 6007 1 1 21 ASP H H -2.123 -3.435 3.467 1.00 . A A . 21 ASP H 1 1 9 6008 1 1 21 ASP HA H 0.332 -2.191 3.012 1.00 . A A . 21 ASP HA 1 1 9 6009 1 1 21 ASP HB2 H -0.877 -2.028 5.142 1.00 . A A . 21 ASP HB2 1 1 9 6010 1 1 21 ASP HB3 H -0.643 -3.745 5.421 1.00 . A A . 21 ASP HB3 1 1 9 6011 1 1 21 ASP N N -1.332 -3.435 2.883 1.00 . A A . 21 ASP N 1 1 9 6012 1 1 21 ASP O O 2.041 -4.012 2.767 1.00 . A A . 21 ASP O 1 1 9 6013 1 1 21 ASP OD1 O 1.681 -1.496 5.495 1.00 . A A . 21 ASP OD1 1 1 9 6014 1 1 21 ASP OD2 O 1.495 -3.351 6.596 1.00 . A A . 21 ASP OD2 1 1 9 6015 1 1 22 ASP C C 1.599 -6.745 1.737 1.00 . A A . 22 ASP C 1 1 9 6016 1 1 22 ASP CA C 1.183 -6.654 3.201 1.00 . A A . 22 ASP CA 1 1 9 6017 1 1 22 ASP CB C 0.312 -7.854 3.556 1.00 . A A . 22 ASP CB 1 1 9 6018 1 1 22 ASP CG C 0.945 -9.190 3.234 1.00 . A A . 22 ASP CG 1 1 9 6019 1 1 22 ASP H H -0.473 -5.491 3.816 1.00 . A A . 22 ASP H 1 1 9 6020 1 1 22 ASP HA H 2.061 -6.660 3.830 1.00 . A A . 22 ASP HA 1 1 9 6021 1 1 22 ASP HB2 H 0.061 -7.824 4.606 1.00 . A A . 22 ASP HB2 1 1 9 6022 1 1 22 ASP HB3 H -0.595 -7.770 2.979 1.00 . A A . 22 ASP HB3 1 1 9 6023 1 1 22 ASP N N 0.434 -5.425 3.445 1.00 . A A . 22 ASP N 1 1 9 6024 1 1 22 ASP O O 2.765 -7.014 1.433 1.00 . A A . 22 ASP O 1 1 9 6025 1 1 22 ASP OD1 O 1.648 -9.762 4.092 1.00 . A A . 22 ASP OD1 1 1 9 6026 1 1 22 ASP OD2 O 0.708 -9.711 2.139 1.00 . A A . 22 ASP OD2 1 1 9 6027 1 1 23 HIS C C 1.998 -5.526 -0.994 1.00 . A A . 23 HIS C 1 1 9 6028 1 1 23 HIS CA C 0.902 -6.516 -0.597 1.00 . A A . 23 HIS CA 1 1 9 6029 1 1 23 HIS CB C -0.405 -6.240 -1.387 1.00 . A A . 23 HIS CB 1 1 9 6030 1 1 23 HIS CD2 C 0.063 -5.172 -3.727 1.00 . A A . 23 HIS CD2 1 1 9 6031 1 1 23 HIS CE1 C -0.280 -6.899 -4.988 1.00 . A A . 23 HIS CE1 1 1 9 6032 1 1 23 HIS CG C -0.255 -6.207 -2.899 1.00 . A A . 23 HIS CG 1 1 9 6033 1 1 23 HIS H H -0.239 -6.232 1.166 1.00 . A A . 23 HIS H 1 1 9 6034 1 1 23 HIS HA H 1.245 -7.512 -0.833 1.00 . A A . 23 HIS HA 1 1 9 6035 1 1 23 HIS HB2 H -1.126 -7.008 -1.151 1.00 . A A . 23 HIS HB2 1 1 9 6036 1 1 23 HIS HB3 H -0.801 -5.285 -1.071 1.00 . A A . 23 HIS HB3 1 1 9 6037 1 1 23 HIS HD1 H -0.683 -8.208 -3.447 1.00 . A A . 23 HIS HD1 1 1 9 6038 1 1 23 HIS HD2 H 0.289 -4.162 -3.414 1.00 . A A . 23 HIS HD2 1 1 9 6039 1 1 23 HIS HE1 H -0.383 -7.544 -5.848 1.00 . A A . 23 HIS HE1 1 1 9 6040 1 1 23 HIS N N 0.656 -6.473 0.844 1.00 . A A . 23 HIS N 1 1 9 6041 1 1 23 HIS ND1 N -0.466 -7.291 -3.722 1.00 . A A . 23 HIS ND1 1 1 9 6042 1 1 23 HIS NE2 N 0.046 -5.618 -5.048 1.00 . A A . 23 HIS NE2 1 1 9 6043 1 1 23 HIS O O 2.993 -5.901 -1.601 1.00 . A A . 23 HIS O 1 1 9 6044 1 1 24 CYS C C 4.186 -3.474 -0.394 1.00 . A A . 24 CYS C 1 1 9 6045 1 1 24 CYS CA C 2.788 -3.257 -0.981 1.00 . A A . 24 CYS CA 1 1 9 6046 1 1 24 CYS CB C 2.237 -1.858 -0.698 1.00 . A A . 24 CYS CB 1 1 9 6047 1 1 24 CYS H H 1.030 -4.041 -0.105 1.00 . A A . 24 CYS H 1 1 9 6048 1 1 24 CYS HA H 2.900 -3.351 -2.051 1.00 . A A . 24 CYS HA 1 1 9 6049 1 1 24 CYS HB2 H 1.875 -1.825 0.320 1.00 . A A . 24 CYS HB2 1 1 9 6050 1 1 24 CYS HB3 H 3.016 -1.123 -0.823 1.00 . A A . 24 CYS HB3 1 1 9 6051 1 1 24 CYS N N 1.833 -4.286 -0.621 1.00 . A A . 24 CYS N 1 1 9 6052 1 1 24 CYS O O 5.176 -3.125 -1.023 1.00 . A A . 24 CYS O 1 1 9 6053 1 1 24 CYS SG S 0.847 -1.417 -1.802 1.00 . A A . 24 CYS SG 1 1 9 6054 1 1 25 LYS C C 6.245 -5.575 0.767 1.00 . A A . 25 LYS C 1 1 9 6055 1 1 25 LYS CA C 5.589 -4.343 1.378 1.00 . A A . 25 LYS CA 1 1 9 6056 1 1 25 LYS CB C 5.476 -4.534 2.882 1.00 . A A . 25 LYS CB 1 1 9 6057 1 1 25 LYS CD C 4.735 -3.608 5.102 1.00 . A A . 25 LYS CD 1 1 9 6058 1 1 25 LYS CE C 3.917 -4.872 5.362 1.00 . A A . 25 LYS CE 1 1 9 6059 1 1 25 LYS CG C 4.898 -3.343 3.614 1.00 . A A . 25 LYS CG 1 1 9 6060 1 1 25 LYS H H 3.462 -4.345 1.254 1.00 . A A . 25 LYS H 1 1 9 6061 1 1 25 LYS HA H 6.215 -3.486 1.182 1.00 . A A . 25 LYS HA 1 1 9 6062 1 1 25 LYS HB2 H 4.837 -5.386 3.060 1.00 . A A . 25 LYS HB2 1 1 9 6063 1 1 25 LYS HB3 H 6.458 -4.740 3.283 1.00 . A A . 25 LYS HB3 1 1 9 6064 1 1 25 LYS HD2 H 5.711 -3.719 5.549 1.00 . A A . 25 LYS HD2 1 1 9 6065 1 1 25 LYS HD3 H 4.228 -2.767 5.552 1.00 . A A . 25 LYS HD3 1 1 9 6066 1 1 25 LYS HE2 H 2.997 -4.814 4.800 1.00 . A A . 25 LYS HE2 1 1 9 6067 1 1 25 LYS HE3 H 4.485 -5.727 5.029 1.00 . A A . 25 LYS HE3 1 1 9 6068 1 1 25 LYS HG2 H 5.561 -2.501 3.481 1.00 . A A . 25 LYS HG2 1 1 9 6069 1 1 25 LYS HG3 H 3.932 -3.113 3.187 1.00 . A A . 25 LYS HG3 1 1 9 6070 1 1 25 LYS HZ1 H 2.885 -4.304 7.021 1.00 . A A . 25 LYS HZ1 1 1 9 6071 1 1 25 LYS HZ2 H 4.438 -4.926 7.371 1.00 . A A . 25 LYS HZ2 1 1 9 6072 1 1 25 LYS HZ3 H 3.168 -5.968 6.965 1.00 . A A . 25 LYS HZ3 1 1 9 6073 1 1 25 LYS N N 4.279 -4.082 0.774 1.00 . A A . 25 LYS N 1 1 9 6074 1 1 25 LYS NZ N 3.591 -5.036 6.780 1.00 . A A . 25 LYS NZ 1 1 9 6075 1 1 25 LYS O O 7.460 -5.626 0.617 1.00 . A A . 25 LYS O 1 1 9 6076 1 1 26 ASN C C 6.110 -7.783 -1.625 1.00 . A A . 26 ASN C 1 1 9 6077 1 1 26 ASN CA C 5.990 -7.814 -0.115 1.00 . A A . 26 ASN CA 1 1 9 6078 1 1 26 ASN CB C 5.181 -9.042 0.334 1.00 . A A . 26 ASN CB 1 1 9 6079 1 1 26 ASN CG C 5.332 -9.366 1.811 1.00 . A A . 26 ASN CG 1 1 9 6080 1 1 26 ASN H H 4.478 -6.466 0.541 1.00 . A A . 26 ASN H 1 1 9 6081 1 1 26 ASN HA H 6.991 -7.906 0.284 1.00 . A A . 26 ASN HA 1 1 9 6082 1 1 26 ASN HB2 H 4.136 -8.857 0.141 1.00 . A A . 26 ASN HB2 1 1 9 6083 1 1 26 ASN HB3 H 5.500 -9.897 -0.243 1.00 . A A . 26 ASN HB3 1 1 9 6084 1 1 26 ASN HD21 H 3.703 -8.329 2.244 1.00 . A A . 26 ASN HD21 1 1 9 6085 1 1 26 ASN HD22 H 4.500 -9.075 3.582 1.00 . A A . 26 ASN HD22 1 1 9 6086 1 1 26 ASN N N 5.449 -6.567 0.424 1.00 . A A . 26 ASN N 1 1 9 6087 1 1 26 ASN ND2 N 4.430 -8.876 2.623 1.00 . A A . 26 ASN ND2 1 1 9 6088 1 1 26 ASN O O 7.209 -7.893 -2.172 1.00 . A A . 26 ASN O 1 1 9 6089 1 1 26 ASN OD1 O 6.251 -10.089 2.210 1.00 . A A . 26 ASN OD1 1 1 9 6090 1 1 27 LYS C C 5.666 -6.383 -4.322 1.00 . A A . 27 LYS C 1 1 9 6091 1 1 27 LYS CA C 4.944 -7.592 -3.744 1.00 . A A . 27 LYS CA 1 1 9 6092 1 1 27 LYS CB C 3.478 -7.618 -4.233 1.00 . A A . 27 LYS CB 1 1 9 6093 1 1 27 LYS CD C 3.954 -8.416 -6.579 1.00 . A A . 27 LYS CD 1 1 9 6094 1 1 27 LYS CE C 4.075 -7.949 -8.013 1.00 . A A . 27 LYS CE 1 1 9 6095 1 1 27 LYS CG C 3.305 -7.349 -5.723 1.00 . A A . 27 LYS CG 1 1 9 6096 1 1 27 LYS H H 4.157 -7.445 -1.804 1.00 . A A . 27 LYS H 1 1 9 6097 1 1 27 LYS HA H 5.431 -8.488 -4.092 1.00 . A A . 27 LYS HA 1 1 9 6098 1 1 27 LYS HB2 H 3.060 -8.591 -4.021 1.00 . A A . 27 LYS HB2 1 1 9 6099 1 1 27 LYS HB3 H 2.919 -6.875 -3.684 1.00 . A A . 27 LYS HB3 1 1 9 6100 1 1 27 LYS HD2 H 4.942 -8.624 -6.196 1.00 . A A . 27 LYS HD2 1 1 9 6101 1 1 27 LYS HD3 H 3.352 -9.312 -6.548 1.00 . A A . 27 LYS HD3 1 1 9 6102 1 1 27 LYS HE2 H 4.440 -8.771 -8.608 1.00 . A A . 27 LYS HE2 1 1 9 6103 1 1 27 LYS HE3 H 3.099 -7.654 -8.368 1.00 . A A . 27 LYS HE3 1 1 9 6104 1 1 27 LYS HG2 H 2.251 -7.317 -5.952 1.00 . A A . 27 LYS HG2 1 1 9 6105 1 1 27 LYS HG3 H 3.753 -6.393 -5.954 1.00 . A A . 27 LYS HG3 1 1 9 6106 1 1 27 LYS HZ1 H 5.957 -7.063 -7.792 1.00 . A A . 27 LYS HZ1 1 1 9 6107 1 1 27 LYS HZ2 H 4.703 -5.956 -7.599 1.00 . A A . 27 LYS HZ2 1 1 9 6108 1 1 27 LYS HZ3 H 5.120 -6.499 -9.128 1.00 . A A . 27 LYS HZ3 1 1 9 6109 1 1 27 LYS N N 4.996 -7.601 -2.293 1.00 . A A . 27 LYS N 1 1 9 6110 1 1 27 LYS NZ N 5.012 -6.798 -8.137 1.00 . A A . 27 LYS NZ 1 1 9 6111 1 1 27 LYS O O 6.508 -6.519 -5.206 1.00 . A A . 27 LYS O 1 1 9 6112 1 1 28 GLU C C 7.199 -3.587 -3.705 1.00 . A A . 28 GLU C 1 1 9 6113 1 1 28 GLU CA C 5.897 -4.001 -4.374 1.00 . A A . 28 GLU CA 1 1 9 6114 1 1 28 GLU CB C 4.860 -2.885 -4.340 1.00 . A A . 28 GLU CB 1 1 9 6115 1 1 28 GLU CD C 3.915 -3.334 -6.645 1.00 . A A . 28 GLU CD 1 1 9 6116 1 1 28 GLU CG C 3.617 -3.195 -5.164 1.00 . A A . 28 GLU CG 1 1 9 6117 1 1 28 GLU H H 4.715 -5.191 -3.070 1.00 . A A . 28 GLU H 1 1 9 6118 1 1 28 GLU HA H 6.120 -4.215 -5.408 1.00 . A A . 28 GLU HA 1 1 9 6119 1 1 28 GLU HB2 H 4.561 -2.713 -3.317 1.00 . A A . 28 GLU HB2 1 1 9 6120 1 1 28 GLU HB3 H 5.306 -1.984 -4.735 1.00 . A A . 28 GLU HB3 1 1 9 6121 1 1 28 GLU HG2 H 3.191 -4.124 -4.813 1.00 . A A . 28 GLU HG2 1 1 9 6122 1 1 28 GLU HG3 H 2.901 -2.400 -5.027 1.00 . A A . 28 GLU HG3 1 1 9 6123 1 1 28 GLU N N 5.348 -5.222 -3.819 1.00 . A A . 28 GLU N 1 1 9 6124 1 1 28 GLU O O 7.880 -2.688 -4.188 1.00 . A A . 28 GLU O 1 1 9 6125 1 1 28 GLU OE1 O 4.492 -4.367 -7.074 1.00 . A A . 28 GLU OE1 1 1 9 6126 1 1 28 GLU OE2 O 3.550 -2.423 -7.421 1.00 . A A . 28 GLU OE2 1 1 9 6127 1 1 29 HIS C C 8.848 -2.540 -1.330 1.00 . A A . 29 HIS C 1 1 9 6128 1 1 29 HIS CA C 8.785 -4.011 -1.836 1.00 . A A . 29 HIS CA 1 1 9 6129 1 1 29 HIS CB C 10.008 -4.379 -2.741 1.00 . A A . 29 HIS CB 1 1 9 6130 1 1 29 HIS CD2 C 11.906 -5.253 -1.195 1.00 . A A . 29 HIS CD2 1 1 9 6131 1 1 29 HIS CE1 C 13.373 -3.682 -1.504 1.00 . A A . 29 HIS CE1 1 1 9 6132 1 1 29 HIS CG C 11.355 -4.365 -2.057 1.00 . A A . 29 HIS CG 1 1 9 6133 1 1 29 HIS H H 6.901 -4.916 -2.245 1.00 . A A . 29 HIS H 1 1 9 6134 1 1 29 HIS HA H 8.770 -4.661 -0.973 1.00 . A A . 29 HIS HA 1 1 9 6135 1 1 29 HIS HB2 H 9.860 -5.373 -3.136 1.00 . A A . 29 HIS HB2 1 1 9 6136 1 1 29 HIS HB3 H 10.044 -3.683 -3.566 1.00 . A A . 29 HIS HB3 1 1 9 6137 1 1 29 HIS HD1 H 12.189 -2.572 -2.794 1.00 . A A . 29 HIS HD1 1 1 9 6138 1 1 29 HIS HD2 H 11.433 -6.155 -0.834 1.00 . A A . 29 HIS HD2 1 1 9 6139 1 1 29 HIS HE1 H 14.270 -3.081 -1.449 1.00 . A A . 29 HIS HE1 1 1 9 6140 1 1 29 HIS N N 7.528 -4.247 -2.584 1.00 . A A . 29 HIS N 1 1 9 6141 1 1 29 HIS ND1 N 12.303 -3.375 -2.239 1.00 . A A . 29 HIS ND1 1 1 9 6142 1 1 29 HIS NE2 N 13.185 -4.819 -0.845 1.00 . A A . 29 HIS NE2 1 1 9 6143 1 1 29 HIS O O 9.916 -1.956 -1.140 1.00 . A A . 29 HIS O 1 1 9 6144 1 1 30 LEU C C 7.740 -0.550 0.894 1.00 . A A . 30 LEU C 1 1 9 6145 1 1 30 LEU CA C 7.625 -0.601 -0.623 1.00 . A A . 30 LEU CA 1 1 9 6146 1 1 30 LEU CB C 6.318 0.051 -1.094 1.00 . A A . 30 LEU CB 1 1 9 6147 1 1 30 LEU CD1 C 4.761 0.727 -2.938 1.00 . A A . 30 LEU CD1 1 1 9 6148 1 1 30 LEU CD2 C 7.221 0.646 -3.383 1.00 . A A . 30 LEU CD2 1 1 9 6149 1 1 30 LEU CG C 6.061 0.028 -2.606 1.00 . A A . 30 LEU CG 1 1 9 6150 1 1 30 LEU H H 6.874 -2.496 -1.168 1.00 . A A . 30 LEU H 1 1 9 6151 1 1 30 LEU HA H 8.461 -0.066 -1.049 1.00 . A A . 30 LEU HA 1 1 9 6152 1 1 30 LEU HB2 H 5.499 -0.457 -0.606 1.00 . A A . 30 LEU HB2 1 1 9 6153 1 1 30 LEU HB3 H 6.319 1.080 -0.769 1.00 . A A . 30 LEU HB3 1 1 9 6154 1 1 30 LEU HD11 H 4.593 0.681 -4.004 1.00 . A A . 30 LEU HD11 1 1 9 6155 1 1 30 LEU HD12 H 4.814 1.760 -2.627 1.00 . A A . 30 LEU HD12 1 1 9 6156 1 1 30 LEU HD13 H 3.947 0.236 -2.425 1.00 . A A . 30 LEU HD13 1 1 9 6157 1 1 30 LEU HD21 H 6.991 0.633 -4.438 1.00 . A A . 30 LEU HD21 1 1 9 6158 1 1 30 LEU HD22 H 8.115 0.067 -3.206 1.00 . A A . 30 LEU HD22 1 1 9 6159 1 1 30 LEU HD23 H 7.387 1.664 -3.063 1.00 . A A . 30 LEU HD23 1 1 9 6160 1 1 30 LEU HG H 5.960 -1.002 -2.912 1.00 . A A . 30 LEU HG 1 1 9 6161 1 1 30 LEU N N 7.700 -1.971 -1.074 1.00 . A A . 30 LEU N 1 1 9 6162 1 1 30 LEU O O 8.011 -1.567 1.536 1.00 . A A . 30 LEU O 1 1 9 6163 1 1 31 ARG C C 6.446 0.202 3.592 1.00 . A A . 31 ARG C 1 1 9 6164 1 1 31 ARG CA C 7.656 0.791 2.893 1.00 . A A . 31 ARG CA 1 1 9 6165 1 1 31 ARG CB C 7.815 2.281 3.228 1.00 . A A . 31 ARG CB 1 1 9 6166 1 1 31 ARG CD C 7.987 4.103 4.918 1.00 . A A . 31 ARG CD 1 1 9 6167 1 1 31 ARG CG C 7.815 2.614 4.712 1.00 . A A . 31 ARG CG 1 1 9 6168 1 1 31 ARG CZ C 8.756 5.317 6.957 1.00 . A A . 31 ARG CZ 1 1 9 6169 1 1 31 ARG H H 7.266 1.379 0.915 1.00 . A A . 31 ARG H 1 1 9 6170 1 1 31 ARG HA H 8.538 0.263 3.221 1.00 . A A . 31 ARG HA 1 1 9 6171 1 1 31 ARG HB2 H 8.747 2.631 2.809 1.00 . A A . 31 ARG HB2 1 1 9 6172 1 1 31 ARG HB3 H 7.005 2.822 2.761 1.00 . A A . 31 ARG HB3 1 1 9 6173 1 1 31 ARG HD2 H 8.951 4.396 4.530 1.00 . A A . 31 ARG HD2 1 1 9 6174 1 1 31 ARG HD3 H 7.214 4.617 4.367 1.00 . A A . 31 ARG HD3 1 1 9 6175 1 1 31 ARG HE H 7.124 4.113 6.798 1.00 . A A . 31 ARG HE 1 1 9 6176 1 1 31 ARG HG2 H 6.877 2.300 5.146 1.00 . A A . 31 ARG HG2 1 1 9 6177 1 1 31 ARG HG3 H 8.631 2.093 5.192 1.00 . A A . 31 ARG HG3 1 1 9 6178 1 1 31 ARG HH11 H 10.031 5.594 5.354 1.00 . A A . 31 ARG HH11 1 1 9 6179 1 1 31 ARG HH12 H 10.475 6.416 6.772 1.00 . A A . 31 ARG HH12 1 1 9 6180 1 1 31 ARG HH21 H 7.761 5.286 8.746 1.00 . A A . 31 ARG HH21 1 1 9 6181 1 1 31 ARG HH22 H 9.154 6.252 8.739 1.00 . A A . 31 ARG HH22 1 1 9 6182 1 1 31 ARG N N 7.539 0.613 1.463 1.00 . A A . 31 ARG N 1 1 9 6183 1 1 31 ARG NE N 7.903 4.492 6.327 1.00 . A A . 31 ARG NE 1 1 9 6184 1 1 31 ARG NH1 N 9.819 5.808 6.316 1.00 . A A . 31 ARG NH1 1 1 9 6185 1 1 31 ARG NH2 N 8.543 5.640 8.228 1.00 . A A . 31 ARG NH2 1 1 9 6186 1 1 31 ARG O O 6.585 -0.607 4.505 1.00 . A A . 31 ARG O 1 1 9 6187 1 1 32 SER C C 2.875 0.503 2.860 1.00 . A A . 32 SER C 1 1 9 6188 1 1 32 SER CA C 4.048 0.130 3.748 1.00 . A A . 32 SER CA 1 1 9 6189 1 1 32 SER CB C 3.907 0.748 5.149 1.00 . A A . 32 SER CB 1 1 9 6190 1 1 32 SER H H 5.198 1.192 2.381 1.00 . A A . 32 SER H 1 1 9 6191 1 1 32 SER HA H 4.091 -0.945 3.844 1.00 . A A . 32 SER HA 1 1 9 6192 1 1 32 SER HB2 H 2.925 0.525 5.538 1.00 . A A . 32 SER HB2 1 1 9 6193 1 1 32 SER HB3 H 4.654 0.318 5.800 1.00 . A A . 32 SER HB3 1 1 9 6194 1 1 32 SER HG H 3.223 2.552 5.284 1.00 . A A . 32 SER HG 1 1 9 6195 1 1 32 SER N N 5.275 0.583 3.148 1.00 . A A . 32 SER N 1 1 9 6196 1 1 32 SER O O 3.060 1.158 1.825 1.00 . A A . 32 SER O 1 1 9 6197 1 1 32 SER OG O 4.084 2.158 5.113 1.00 . A A . 32 SER OG 1 1 9 6198 1 1 33 GLY C C -0.538 0.929 3.421 1.00 . A A . 33 GLY C 1 1 9 6199 1 1 33 GLY CA C 0.526 0.428 2.499 1.00 . A A . 33 GLY CA 1 1 9 6200 1 1 33 GLY H H 1.607 -0.463 4.052 1.00 . A A . 33 GLY H 1 1 9 6201 1 1 33 GLY HA2 H 0.776 1.202 1.790 1.00 . A A . 33 GLY HA2 1 1 9 6202 1 1 33 GLY HA3 H 0.158 -0.436 1.967 1.00 . A A . 33 GLY HA3 1 1 9 6203 1 1 33 GLY N N 1.700 0.089 3.237 1.00 . A A . 33 GLY N 1 1 9 6204 1 1 33 GLY O O -0.648 0.459 4.561 1.00 . A A . 33 GLY O 1 1 9 6205 1 1 34 ARG C C -3.542 2.738 2.945 1.00 . A A . 34 ARG C 1 1 9 6206 1 1 34 ARG CA C -2.349 2.415 3.784 1.00 . A A . 34 ARG CA 1 1 9 6207 1 1 34 ARG CB C -1.936 3.583 4.684 1.00 . A A . 34 ARG CB 1 1 9 6208 1 1 34 ARG CD C -0.876 5.787 5.004 1.00 . A A . 34 ARG CD 1 1 9 6209 1 1 34 ARG CG C -1.191 4.707 4.001 1.00 . A A . 34 ARG CG 1 1 9 6210 1 1 34 ARG CZ C 0.410 7.896 5.143 1.00 . A A . 34 ARG CZ 1 1 9 6211 1 1 34 ARG H H -1.107 2.320 2.116 1.00 . A A . 34 ARG H 1 1 9 6212 1 1 34 ARG HA H -2.643 1.592 4.420 1.00 . A A . 34 ARG HA 1 1 9 6213 1 1 34 ARG HB2 H -2.824 4.003 5.131 1.00 . A A . 34 ARG HB2 1 1 9 6214 1 1 34 ARG HB3 H -1.311 3.197 5.475 1.00 . A A . 34 ARG HB3 1 1 9 6215 1 1 34 ARG HD2 H -1.809 6.227 5.320 1.00 . A A . 34 ARG HD2 1 1 9 6216 1 1 34 ARG HD3 H -0.381 5.343 5.856 1.00 . A A . 34 ARG HD3 1 1 9 6217 1 1 34 ARG HE H 0.252 6.750 3.515 1.00 . A A . 34 ARG HE 1 1 9 6218 1 1 34 ARG HG2 H -0.270 4.321 3.587 1.00 . A A . 34 ARG HG2 1 1 9 6219 1 1 34 ARG HG3 H -1.805 5.119 3.213 1.00 . A A . 34 ARG HG3 1 1 9 6220 1 1 34 ARG HH11 H -0.646 7.513 6.857 1.00 . A A . 34 ARG HH11 1 1 9 6221 1 1 34 ARG HH12 H 0.332 8.894 6.937 1.00 . A A . 34 ARG HH12 1 1 9 6222 1 1 34 ARG HH21 H 1.516 8.543 3.611 1.00 . A A . 34 ARG HH21 1 1 9 6223 1 1 34 ARG HH22 H 1.627 9.532 5.020 1.00 . A A . 34 ARG HH22 1 1 9 6224 1 1 34 ARG N N -1.273 1.908 2.994 1.00 . A A . 34 ARG N 1 1 9 6225 1 1 34 ARG NE N -0.036 6.842 4.457 1.00 . A A . 34 ARG NE 1 1 9 6226 1 1 34 ARG NH1 N 0.005 8.116 6.392 1.00 . A A . 34 ARG NH1 1 1 9 6227 1 1 34 ARG NH2 N 1.239 8.727 4.565 1.00 . A A . 34 ARG NH2 1 1 9 6228 1 1 34 ARG O O -3.487 3.548 2.002 1.00 . A A . 34 ARG O 1 1 9 6229 1 1 35 CYS C C -6.579 3.382 3.211 1.00 . A A . 35 CYS C 1 1 9 6230 1 1 35 CYS CA C -5.820 2.258 2.571 1.00 . A A . 35 CYS CA 1 1 9 6231 1 1 35 CYS CB C -6.612 0.967 2.631 1.00 . A A . 35 CYS CB 1 1 9 6232 1 1 35 CYS H H -4.559 1.446 4.003 1.00 . A A . 35 CYS H 1 1 9 6233 1 1 35 CYS HA H -5.618 2.498 1.539 1.00 . A A . 35 CYS HA 1 1 9 6234 1 1 35 CYS HB2 H -6.944 0.797 3.646 1.00 . A A . 35 CYS HB2 1 1 9 6235 1 1 35 CYS HB3 H -7.471 1.041 1.981 1.00 . A A . 35 CYS HB3 1 1 9 6236 1 1 35 CYS N N -4.595 2.089 3.256 1.00 . A A . 35 CYS N 1 1 9 6237 1 1 35 CYS O O -6.807 3.384 4.419 1.00 . A A . 35 CYS O 1 1 9 6238 1 1 35 CYS SG S -5.634 -0.470 2.104 1.00 . A A . 35 CYS SG 1 1 9 6239 1 1 36 ARG C C -9.121 5.095 3.108 1.00 . A A . 36 ARG C 1 1 9 6240 1 1 36 ARG CA C -7.672 5.490 2.893 1.00 . A A . 36 ARG CA 1 1 9 6241 1 1 36 ARG CB C -7.558 6.639 1.902 1.00 . A A . 36 ARG CB 1 1 9 6242 1 1 36 ARG CD C -6.013 8.196 3.132 1.00 . A A . 36 ARG CD 1 1 9 6243 1 1 36 ARG CG C -6.196 7.319 1.899 1.00 . A A . 36 ARG CG 1 1 9 6244 1 1 36 ARG CZ C -7.300 10.083 4.174 1.00 . A A . 36 ARG CZ 1 1 9 6245 1 1 36 ARG H H -6.640 4.291 1.479 1.00 . A A . 36 ARG H 1 1 9 6246 1 1 36 ARG HA H -7.253 5.799 3.839 1.00 . A A . 36 ARG HA 1 1 9 6247 1 1 36 ARG HB2 H -7.756 6.261 0.909 1.00 . A A . 36 ARG HB2 1 1 9 6248 1 1 36 ARG HB3 H -8.306 7.375 2.156 1.00 . A A . 36 ARG HB3 1 1 9 6249 1 1 36 ARG HD2 H -6.196 7.610 4.020 1.00 . A A . 36 ARG HD2 1 1 9 6250 1 1 36 ARG HD3 H -4.999 8.564 3.147 1.00 . A A . 36 ARG HD3 1 1 9 6251 1 1 36 ARG HE H -7.246 9.589 2.208 1.00 . A A . 36 ARG HE 1 1 9 6252 1 1 36 ARG HG2 H -5.427 6.561 1.889 1.00 . A A . 36 ARG HG2 1 1 9 6253 1 1 36 ARG HG3 H -6.111 7.933 1.014 1.00 . A A . 36 ARG HG3 1 1 9 6254 1 1 36 ARG HH11 H -6.452 8.867 5.597 1.00 . A A . 36 ARG HH11 1 1 9 6255 1 1 36 ARG HH12 H -7.235 10.252 6.207 1.00 . A A . 36 ARG HH12 1 1 9 6256 1 1 36 ARG HH21 H -8.330 11.489 3.092 1.00 . A A . 36 ARG HH21 1 1 9 6257 1 1 36 ARG HH22 H -8.341 11.741 4.769 1.00 . A A . 36 ARG HH22 1 1 9 6258 1 1 36 ARG N N -6.915 4.360 2.422 1.00 . A A . 36 ARG N 1 1 9 6259 1 1 36 ARG NE N -6.931 9.347 3.111 1.00 . A A . 36 ARG NE 1 1 9 6260 1 1 36 ARG NH1 N -6.972 9.705 5.409 1.00 . A A . 36 ARG NH1 1 1 9 6261 1 1 36 ARG NH2 N -8.034 11.173 3.997 1.00 . A A . 36 ARG NH2 1 1 9 6262 1 1 36 ARG O O -9.526 3.977 2.757 1.00 . A A . 36 ARG O 1 1 9 6263 1 1 37 ASP C C -12.117 5.541 2.644 1.00 . A A . 37 ASP C 1 1 9 6264 1 1 37 ASP CA C -11.322 5.749 3.939 1.00 . A A . 37 ASP CA 1 1 9 6265 1 1 37 ASP CB C -11.908 6.890 4.779 1.00 . A A . 37 ASP CB 1 1 9 6266 1 1 37 ASP CG C -13.338 6.635 5.208 1.00 . A A . 37 ASP CG 1 1 9 6267 1 1 37 ASP H H -9.526 6.873 3.905 1.00 . A A . 37 ASP H 1 1 9 6268 1 1 37 ASP HA H -11.368 4.833 4.510 1.00 . A A . 37 ASP HA 1 1 9 6269 1 1 37 ASP HB2 H -11.308 7.027 5.666 1.00 . A A . 37 ASP HB2 1 1 9 6270 1 1 37 ASP HB3 H -11.884 7.798 4.195 1.00 . A A . 37 ASP HB3 1 1 9 6271 1 1 37 ASP N N -9.903 6.005 3.652 1.00 . A A . 37 ASP N 1 1 9 6272 1 1 37 ASP O O -13.174 4.937 2.641 1.00 . A A . 37 ASP O 1 1 9 6273 1 1 37 ASP OD1 O -13.573 5.761 6.082 1.00 . A A . 37 ASP OD1 1 1 9 6274 1 1 37 ASP OD2 O -14.249 7.323 4.707 1.00 . A A . 37 ASP OD2 1 1 9 6275 1 1 38 ASP C C -11.848 4.421 -0.345 1.00 . A A . 38 ASP C 1 1 9 6276 1 1 38 ASP CA C -12.133 5.819 0.192 1.00 . A A . 38 ASP CA 1 1 9 6277 1 1 38 ASP CB C -11.588 6.846 -0.823 1.00 . A A . 38 ASP CB 1 1 9 6278 1 1 38 ASP CG C -11.998 8.266 -0.547 1.00 . A A . 38 ASP CG 1 1 9 6279 1 1 38 ASP H H -10.711 6.508 1.621 1.00 . A A . 38 ASP H 1 1 9 6280 1 1 38 ASP HA H -13.200 5.949 0.280 1.00 . A A . 38 ASP HA 1 1 9 6281 1 1 38 ASP HB2 H -10.509 6.808 -0.812 1.00 . A A . 38 ASP HB2 1 1 9 6282 1 1 38 ASP HB3 H -11.935 6.572 -1.809 1.00 . A A . 38 ASP HB3 1 1 9 6283 1 1 38 ASP N N -11.544 6.004 1.531 1.00 . A A . 38 ASP N 1 1 9 6284 1 1 38 ASP O O -12.115 4.141 -1.500 1.00 . A A . 38 ASP O 1 1 9 6285 1 1 38 ASP OD1 O -13.077 8.699 -0.993 1.00 . A A . 38 ASP OD1 1 1 9 6286 1 1 38 ASP OD2 O -11.240 8.991 0.120 1.00 . A A . 38 ASP OD2 1 1 9 6287 1 1 39 PHE C C -9.789 2.051 -0.857 1.00 . A A . 39 PHE C 1 1 9 6288 1 1 39 PHE CA C -10.938 2.147 0.157 1.00 . A A . 39 PHE CA 1 1 9 6289 1 1 39 PHE CB C -12.184 1.371 -0.357 1.00 . A A . 39 PHE CB 1 1 9 6290 1 1 39 PHE CD1 C -13.359 0.193 1.523 1.00 . A A . 39 PHE CD1 1 1 9 6291 1 1 39 PHE CD2 C -14.315 2.205 0.691 1.00 . A A . 39 PHE CD2 1 1 9 6292 1 1 39 PHE CE1 C -14.388 0.079 2.433 1.00 . A A . 39 PHE CE1 1 1 9 6293 1 1 39 PHE CE2 C -15.343 2.098 1.600 1.00 . A A . 39 PHE CE2 1 1 9 6294 1 1 39 PHE CG C -13.308 1.255 0.641 1.00 . A A . 39 PHE CG 1 1 9 6295 1 1 39 PHE CZ C -15.379 1.035 2.472 1.00 . A A . 39 PHE CZ 1 1 9 6296 1 1 39 PHE H H -11.058 3.870 1.406 1.00 . A A . 39 PHE H 1 1 9 6297 1 1 39 PHE HA H -10.600 1.684 1.074 1.00 . A A . 39 PHE HA 1 1 9 6298 1 1 39 PHE HB2 H -12.574 1.877 -1.229 1.00 . A A . 39 PHE HB2 1 1 9 6299 1 1 39 PHE HB3 H -11.880 0.374 -0.638 1.00 . A A . 39 PHE HB3 1 1 9 6300 1 1 39 PHE HD1 H -12.575 -0.550 1.490 1.00 . A A . 39 PHE HD1 1 1 9 6301 1 1 39 PHE HD2 H -14.290 3.042 0.007 1.00 . A A . 39 PHE HD2 1 1 9 6302 1 1 39 PHE HE1 H -14.417 -0.757 3.117 1.00 . A A . 39 PHE HE1 1 1 9 6303 1 1 39 PHE HE2 H -16.119 2.847 1.630 1.00 . A A . 39 PHE HE2 1 1 9 6304 1 1 39 PHE HZ H -16.189 0.952 3.182 1.00 . A A . 39 PHE HZ 1 1 9 6305 1 1 39 PHE N N -11.264 3.556 0.499 1.00 . A A . 39 PHE N 1 1 9 6306 1 1 39 PHE O O -9.568 1.005 -1.465 1.00 . A A . 39 PHE O 1 1 9 6307 1 1 40 ARG C C -6.596 2.981 -1.293 1.00 . A A . 40 ARG C 1 1 9 6308 1 1 40 ARG CA C -7.933 3.162 -1.956 1.00 . A A . 40 ARG CA 1 1 9 6309 1 1 40 ARG CB C -7.932 4.427 -2.820 1.00 . A A . 40 ARG CB 1 1 9 6310 1 1 40 ARG CD C -10.171 4.023 -3.843 1.00 . A A . 40 ARG CD 1 1 9 6311 1 1 40 ARG CG C -8.717 4.301 -4.105 1.00 . A A . 40 ARG CG 1 1 9 6312 1 1 40 ARG CZ C -12.173 3.314 -5.076 1.00 . A A . 40 ARG CZ 1 1 9 6313 1 1 40 ARG H H -9.252 3.908 -0.454 1.00 . A A . 40 ARG H 1 1 9 6314 1 1 40 ARG HA H -8.078 2.315 -2.611 1.00 . A A . 40 ARG HA 1 1 9 6315 1 1 40 ARG HB2 H -8.366 5.236 -2.252 1.00 . A A . 40 ARG HB2 1 1 9 6316 1 1 40 ARG HB3 H -6.912 4.677 -3.070 1.00 . A A . 40 ARG HB3 1 1 9 6317 1 1 40 ARG HD2 H -10.245 3.162 -3.195 1.00 . A A . 40 ARG HD2 1 1 9 6318 1 1 40 ARG HD3 H -10.605 4.877 -3.344 1.00 . A A . 40 ARG HD3 1 1 9 6319 1 1 40 ARG HE H -10.400 3.896 -5.883 1.00 . A A . 40 ARG HE 1 1 9 6320 1 1 40 ARG HG2 H -8.621 5.215 -4.675 1.00 . A A . 40 ARG HG2 1 1 9 6321 1 1 40 ARG HG3 H -8.284 3.480 -4.655 1.00 . A A . 40 ARG HG3 1 1 9 6322 1 1 40 ARG HH11 H -12.518 3.566 -3.063 1.00 . A A . 40 ARG HH11 1 1 9 6323 1 1 40 ARG HH12 H -13.831 2.942 -3.938 1.00 . A A . 40 ARG HH12 1 1 9 6324 1 1 40 ARG HH21 H -12.236 3.024 -7.091 1.00 . A A . 40 ARG HH21 1 1 9 6325 1 1 40 ARG HH22 H -13.679 2.626 -6.268 1.00 . A A . 40 ARG HH22 1 1 9 6326 1 1 40 ARG N N -9.044 3.128 -1.007 1.00 . A A . 40 ARG N 1 1 9 6327 1 1 40 ARG NE N -10.915 3.756 -5.053 1.00 . A A . 40 ARG NE 1 1 9 6328 1 1 40 ARG NH1 N -12.883 3.269 -3.955 1.00 . A A . 40 ARG NH1 1 1 9 6329 1 1 40 ARG NH2 N -12.735 2.966 -6.221 1.00 . A A . 40 ARG NH2 1 1 9 6330 1 1 40 ARG O O -6.303 3.614 -0.262 1.00 . A A . 40 ARG O 1 1 9 6331 1 1 41 CYS C C -3.454 2.848 -1.836 1.00 . A A . 41 CYS C 1 1 9 6332 1 1 41 CYS CA C -4.471 1.812 -1.419 1.00 . A A . 41 CYS CA 1 1 9 6333 1 1 41 CYS CB C -4.019 0.462 -1.955 1.00 . A A . 41 CYS CB 1 1 9 6334 1 1 41 CYS H H -6.134 1.648 -2.678 1.00 . A A . 41 CYS H 1 1 9 6335 1 1 41 CYS HA H -4.491 1.745 -0.342 1.00 . A A . 41 CYS HA 1 1 9 6336 1 1 41 CYS HB2 H -4.234 0.417 -3.012 1.00 . A A . 41 CYS HB2 1 1 9 6337 1 1 41 CYS HB3 H -2.956 0.340 -1.819 1.00 . A A . 41 CYS HB3 1 1 9 6338 1 1 41 CYS N N -5.805 2.122 -1.882 1.00 . A A . 41 CYS N 1 1 9 6339 1 1 41 CYS O O -3.110 2.959 -3.017 1.00 . A A . 41 CYS O 1 1 9 6340 1 1 41 CYS SG S -4.811 -0.958 -1.211 1.00 . A A . 41 CYS SG 1 1 9 6341 1 1 42 TRP C C -0.708 3.886 -0.400 1.00 . A A . 42 TRP C 1 1 9 6342 1 1 42 TRP CA C -1.896 4.503 -1.088 1.00 . A A . 42 TRP CA 1 1 9 6343 1 1 42 TRP CB C -2.179 5.897 -0.527 1.00 . A A . 42 TRP CB 1 1 9 6344 1 1 42 TRP CD1 C -1.776 7.667 -2.325 1.00 . A A . 42 TRP CD1 1 1 9 6345 1 1 42 TRP CD2 C -3.943 7.287 -1.917 1.00 . A A . 42 TRP CD2 1 1 9 6346 1 1 42 TRP CE2 C -3.832 8.283 -2.911 1.00 . A A . 42 TRP CE2 1 1 9 6347 1 1 42 TRP CE3 C -5.222 6.890 -1.508 1.00 . A A . 42 TRP CE3 1 1 9 6348 1 1 42 TRP CG C -2.605 6.904 -1.555 1.00 . A A . 42 TRP CG 1 1 9 6349 1 1 42 TRP CH2 C -6.176 8.478 -3.069 1.00 . A A . 42 TRP CH2 1 1 9 6350 1 1 42 TRP CZ2 C -4.943 8.884 -3.491 1.00 . A A . 42 TRP CZ2 1 1 9 6351 1 1 42 TRP CZ3 C -6.324 7.492 -2.091 1.00 . A A . 42 TRP CZ3 1 1 9 6352 1 1 42 TRP H H -3.392 3.566 0.014 1.00 . A A . 42 TRP H 1 1 9 6353 1 1 42 TRP HA H -1.700 4.558 -2.149 1.00 . A A . 42 TRP HA 1 1 9 6354 1 1 42 TRP HB2 H -2.970 5.823 0.204 1.00 . A A . 42 TRP HB2 1 1 9 6355 1 1 42 TRP HB3 H -1.288 6.267 -0.042 1.00 . A A . 42 TRP HB3 1 1 9 6356 1 1 42 TRP HD1 H -0.697 7.618 -2.292 1.00 . A A . 42 TRP HD1 1 1 9 6357 1 1 42 TRP HE1 H -2.129 9.132 -3.783 1.00 . A A . 42 TRP HE1 1 1 9 6358 1 1 42 TRP HE3 H -5.365 6.122 -0.764 1.00 . A A . 42 TRP HE3 1 1 9 6359 1 1 42 TRP HH2 H -7.063 8.922 -3.498 1.00 . A A . 42 TRP HH2 1 1 9 6360 1 1 42 TRP HZ2 H -4.854 9.646 -4.250 1.00 . A A . 42 TRP HZ2 1 1 9 6361 1 1 42 TRP HZ3 H -7.320 7.207 -1.789 1.00 . A A . 42 TRP HZ3 1 1 9 6362 1 1 42 TRP N N -3.001 3.613 -0.887 1.00 . A A . 42 TRP N 1 1 9 6363 1 1 42 TRP NE1 N -2.503 8.492 -3.135 1.00 . A A . 42 TRP NE1 1 1 9 6364 1 1 42 TRP O O -0.716 3.700 0.820 1.00 . A A . 42 TRP O 1 1 9 6365 1 1 43 CYS C C 2.622 3.694 -0.473 1.00 . A A . 43 CYS C 1 1 9 6366 1 1 43 CYS CA C 1.388 2.830 -0.572 1.00 . A A . 43 CYS CA 1 1 9 6367 1 1 43 CYS CB C 1.628 1.502 -1.270 1.00 . A A . 43 CYS CB 1 1 9 6368 1 1 43 CYS H H 0.274 3.737 -2.108 1.00 . A A . 43 CYS H 1 1 9 6369 1 1 43 CYS HA H 1.088 2.621 0.443 1.00 . A A . 43 CYS HA 1 1 9 6370 1 1 43 CYS HB2 H 1.825 1.677 -2.318 1.00 . A A . 43 CYS HB2 1 1 9 6371 1 1 43 CYS HB3 H 2.476 1.009 -0.816 1.00 . A A . 43 CYS HB3 1 1 9 6372 1 1 43 CYS N N 0.276 3.523 -1.148 1.00 . A A . 43 CYS N 1 1 9 6373 1 1 43 CYS O O 3.111 4.258 -1.467 1.00 . A A . 43 CYS O 1 1 9 6374 1 1 43 CYS SG S 0.188 0.380 -1.133 1.00 . A A . 43 CYS SG 1 1 9 6375 1 1 44 THR C C 5.525 3.942 0.724 1.00 . A A . 44 THR C 1 1 9 6376 1 1 44 THR CA C 4.196 4.618 1.099 1.00 . A A . 44 THR CA 1 1 9 6377 1 1 44 THR CB C 4.153 4.794 2.630 1.00 . A A . 44 THR CB 1 1 9 6378 1 1 44 THR CG2 C 5.029 5.948 3.073 1.00 . A A . 44 THR CG2 1 1 9 6379 1 1 44 THR H H 2.707 3.248 1.445 1.00 . A A . 44 THR H 1 1 9 6380 1 1 44 THR HA H 4.106 5.593 0.645 1.00 . A A . 44 THR HA 1 1 9 6381 1 1 44 THR HB H 4.499 3.882 3.093 1.00 . A A . 44 THR HB 1 1 9 6382 1 1 44 THR HG1 H 2.482 5.879 2.641 1.00 . A A . 44 THR HG1 1 1 9 6383 1 1 44 THR HG21 H 6.050 5.756 2.780 1.00 . A A . 44 THR HG21 1 1 9 6384 1 1 44 THR HG22 H 4.973 6.057 4.147 1.00 . A A . 44 THR HG22 1 1 9 6385 1 1 44 THR HG23 H 4.686 6.856 2.600 1.00 . A A . 44 THR HG23 1 1 9 6386 1 1 44 THR N N 3.102 3.791 0.731 1.00 . A A . 44 THR N 1 1 9 6387 1 1 44 THR O O 5.694 2.734 0.916 1.00 . A A . 44 THR O 1 1 9 6388 1 1 44 THR OG1 O 2.793 5.049 3.047 1.00 . A A . 44 THR OG1 1 1 9 6389 1 1 45 LYS C C 8.759 5.265 0.309 1.00 . A A . 45 LYS C 1 1 9 6390 1 1 45 LYS CA C 7.755 4.217 -0.125 1.00 . A A . 45 LYS CA 1 1 9 6391 1 1 45 LYS CB C 7.907 3.880 -1.612 1.00 . A A . 45 LYS CB 1 1 9 6392 1 1 45 LYS CD C 8.027 4.599 -3.995 1.00 . A A . 45 LYS CD 1 1 9 6393 1 1 45 LYS CE C 7.907 5.730 -4.998 1.00 . A A . 45 LYS CE 1 1 9 6394 1 1 45 LYS CG C 7.742 5.047 -2.574 1.00 . A A . 45 LYS CG 1 1 9 6395 1 1 45 LYS H H 6.220 5.633 -0.055 1.00 . A A . 45 LYS H 1 1 9 6396 1 1 45 LYS HA H 7.915 3.326 0.467 1.00 . A A . 45 LYS HA 1 1 9 6397 1 1 45 LYS HB2 H 8.878 3.441 -1.785 1.00 . A A . 45 LYS HB2 1 1 9 6398 1 1 45 LYS HB3 H 7.146 3.150 -1.845 1.00 . A A . 45 LYS HB3 1 1 9 6399 1 1 45 LYS HD2 H 9.030 4.206 -4.041 1.00 . A A . 45 LYS HD2 1 1 9 6400 1 1 45 LYS HD3 H 7.327 3.819 -4.259 1.00 . A A . 45 LYS HD3 1 1 9 6401 1 1 45 LYS HE2 H 8.481 6.569 -4.636 1.00 . A A . 45 LYS HE2 1 1 9 6402 1 1 45 LYS HE3 H 8.316 5.401 -5.942 1.00 . A A . 45 LYS HE3 1 1 9 6403 1 1 45 LYS HG2 H 6.731 5.424 -2.509 1.00 . A A . 45 LYS HG2 1 1 9 6404 1 1 45 LYS HG3 H 8.438 5.827 -2.303 1.00 . A A . 45 LYS HG3 1 1 9 6405 1 1 45 LYS HZ1 H 6.484 6.925 -5.912 1.00 . A A . 45 LYS HZ1 1 1 9 6406 1 1 45 LYS HZ2 H 6.063 6.531 -4.338 1.00 . A A . 45 LYS HZ2 1 1 9 6407 1 1 45 LYS HZ3 H 5.918 5.396 -5.555 1.00 . A A . 45 LYS HZ3 1 1 9 6408 1 1 45 LYS N N 6.433 4.698 0.175 1.00 . A A . 45 LYS N 1 1 9 6409 1 1 45 LYS NZ N 6.517 6.168 -5.199 1.00 . A A . 45 LYS NZ 1 1 9 6410 1 1 45 LYS O O 8.379 6.409 0.553 1.00 . A A . 45 LYS O 1 1 9 6411 1 1 46 ASN C C 11.776 6.402 -0.312 1.00 . A A . 46 ASN C 1 1 9 6412 1 1 46 ASN CA C 11.037 5.824 0.858 1.00 . A A . 46 ASN CA 1 1 9 6413 1 1 46 ASN CB C 12.037 5.140 1.803 1.00 . A A . 46 ASN CB 1 1 9 6414 1 1 46 ASN CG C 11.447 4.736 3.142 1.00 . A A . 46 ASN CG 1 1 9 6415 1 1 46 ASN H H 10.267 3.996 0.115 1.00 . A A . 46 ASN H 1 1 9 6416 1 1 46 ASN HA H 10.547 6.625 1.392 1.00 . A A . 46 ASN HA 1 1 9 6417 1 1 46 ASN HB2 H 12.413 4.248 1.326 1.00 . A A . 46 ASN HB2 1 1 9 6418 1 1 46 ASN HB3 H 12.862 5.812 1.982 1.00 . A A . 46 ASN HB3 1 1 9 6419 1 1 46 ASN HD21 H 12.686 3.220 3.228 1.00 . A A . 46 ASN HD21 1 1 9 6420 1 1 46 ASN HD22 H 11.635 3.393 4.585 1.00 . A A . 46 ASN HD22 1 1 9 6421 1 1 46 ASN N N 10.005 4.900 0.400 1.00 . A A . 46 ASN N 1 1 9 6422 1 1 46 ASN ND2 N 11.961 3.682 3.705 1.00 . A A . 46 ASN ND2 1 1 9 6423 1 1 46 ASN O O 12.043 5.702 -1.295 1.00 . A A . 46 ASN O 1 1 9 6424 1 1 46 ASN OD1 O 10.531 5.374 3.664 1.00 . A A . 46 ASN OD1 1 1 9 6425 1 1 47 CYS C C 13.972 9.097 -0.649 1.00 . A A . 47 CYS C 1 1 9 6426 1 1 47 CYS CA C 12.820 8.326 -1.269 1.00 . A A . 47 CYS CA 1 1 9 6427 1 1 47 CYS CB C 11.903 9.261 -2.049 1.00 . A A . 47 CYS CB 1 1 9 6428 1 1 47 CYS H H 11.843 8.192 0.552 1.00 . A A . 47 CYS H 1 1 9 6429 1 1 47 CYS HA H 13.217 7.576 -1.936 1.00 . A A . 47 CYS HA 1 1 9 6430 1 1 47 CYS HB2 H 11.516 10.010 -1.374 1.00 . A A . 47 CYS HB2 1 1 9 6431 1 1 47 CYS HB3 H 12.472 9.741 -2.830 1.00 . A A . 47 CYS HB3 1 1 9 6432 1 1 47 CYS N N 12.094 7.654 -0.230 1.00 . A A . 47 CYS N 1 1 9 6433 1 1 47 CYS O O 15.114 8.586 -0.664 1.00 . A A . 47 CYS O 1 1 9 6434 1 1 47 CYS OXT O 13.752 10.187 -0.081 1.00 . A A . 47 CYS OXT 1 1 9 6435 1 1 47 CYS SG S 10.469 8.444 -2.819 1.00 . A A . 47 CYS SG 1 1 10 6436 1 1 1 LYS C C 9.980 10.717 1.893 1.00 . A A . 1 LYS C 1 1 10 6437 1 1 1 LYS CA C 10.745 11.953 2.290 1.00 . A A . 1 LYS CA 1 1 10 6438 1 1 1 LYS CB C 10.673 13.002 1.161 1.00 . A A . 1 LYS CB 1 1 10 6439 1 1 1 LYS CD C 9.271 14.492 -0.301 1.00 . A A . 1 LYS CD 1 1 10 6440 1 1 1 LYS CE C 7.883 15.061 -0.546 1.00 . A A . 1 LYS CE 1 1 10 6441 1 1 1 LYS CG C 9.275 13.546 0.883 1.00 . A A . 1 LYS CG 1 1 10 6442 1 1 1 LYS H1 H 12.146 10.818 3.232 1.00 . A A . 1 LYS H1 1 1 10 6443 1 1 1 LYS H2 H 12.720 12.345 2.834 1.00 . A A . 1 LYS H2 1 1 10 6444 1 1 1 LYS H3 H 12.518 11.144 1.631 1.00 . A A . 1 LYS H3 1 1 10 6445 1 1 1 LYS HA H 10.333 12.358 3.201 1.00 . A A . 1 LYS HA 1 1 10 6446 1 1 1 LYS HB2 H 11.309 13.835 1.424 1.00 . A A . 1 LYS HB2 1 1 10 6447 1 1 1 LYS HB3 H 11.048 12.554 0.253 1.00 . A A . 1 LYS HB3 1 1 10 6448 1 1 1 LYS HD2 H 9.953 15.305 -0.104 1.00 . A A . 1 LYS HD2 1 1 10 6449 1 1 1 LYS HD3 H 9.592 13.956 -1.182 1.00 . A A . 1 LYS HD3 1 1 10 6450 1 1 1 LYS HE2 H 7.191 14.244 -0.683 1.00 . A A . 1 LYS HE2 1 1 10 6451 1 1 1 LYS HE3 H 7.588 15.638 0.318 1.00 . A A . 1 LYS HE3 1 1 10 6452 1 1 1 LYS HG2 H 8.615 12.717 0.669 1.00 . A A . 1 LYS HG2 1 1 10 6453 1 1 1 LYS HG3 H 8.918 14.070 1.756 1.00 . A A . 1 LYS HG3 1 1 10 6454 1 1 1 LYS HZ1 H 6.898 16.346 -1.851 1.00 . A A . 1 LYS HZ1 1 1 10 6455 1 1 1 LYS HZ2 H 8.027 15.367 -2.596 1.00 . A A . 1 LYS HZ2 1 1 10 6456 1 1 1 LYS HZ3 H 8.548 16.691 -1.697 1.00 . A A . 1 LYS HZ3 1 1 10 6457 1 1 1 LYS N N 12.124 11.560 2.505 1.00 . A A . 1 LYS N 1 1 10 6458 1 1 1 LYS NZ N 7.844 15.927 -1.740 1.00 . A A . 1 LYS NZ 1 1 10 6459 1 1 1 LYS O O 10.553 9.799 1.351 1.00 . A A . 1 LYS O 1 1 10 6460 1 1 2 THR C C 7.095 9.859 0.579 1.00 . A A . 2 THR C 1 1 10 6461 1 1 2 THR CA C 7.959 9.531 1.779 1.00 . A A . 2 THR CA 1 1 10 6462 1 1 2 THR CB C 7.128 8.959 2.936 1.00 . A A . 2 THR CB 1 1 10 6463 1 1 2 THR CG2 C 7.990 8.080 3.831 1.00 . A A . 2 THR CG2 1 1 10 6464 1 1 2 THR H H 8.262 11.361 2.687 1.00 . A A . 2 THR H 1 1 10 6465 1 1 2 THR HA H 8.668 8.775 1.471 1.00 . A A . 2 THR HA 1 1 10 6466 1 1 2 THR HB H 6.337 8.361 2.509 1.00 . A A . 2 THR HB 1 1 10 6467 1 1 2 THR HG1 H 5.595 10.029 3.518 1.00 . A A . 2 THR HG1 1 1 10 6468 1 1 2 THR HG21 H 7.391 7.685 4.638 1.00 . A A . 2 THR HG21 1 1 10 6469 1 1 2 THR HG22 H 8.803 8.665 4.234 1.00 . A A . 2 THR HG22 1 1 10 6470 1 1 2 THR HG23 H 8.388 7.265 3.244 1.00 . A A . 2 THR HG23 1 1 10 6471 1 1 2 THR N N 8.723 10.654 2.187 1.00 . A A . 2 THR N 1 1 10 6472 1 1 2 THR O O 6.430 10.901 0.539 1.00 . A A . 2 THR O 1 1 10 6473 1 1 2 THR OG1 O 6.544 10.035 3.704 1.00 . A A . 2 THR OG1 1 1 10 6474 1 1 3 CYS C C 5.209 8.168 -1.381 1.00 . A A . 3 CYS C 1 1 10 6475 1 1 3 CYS CA C 6.349 9.123 -1.579 1.00 . A A . 3 CYS CA 1 1 10 6476 1 1 3 CYS CB C 7.150 8.739 -2.819 1.00 . A A . 3 CYS CB 1 1 10 6477 1 1 3 CYS H H 7.763 8.242 -0.312 1.00 . A A . 3 CYS H 1 1 10 6478 1 1 3 CYS HA H 5.979 10.134 -1.663 1.00 . A A . 3 CYS HA 1 1 10 6479 1 1 3 CYS HB2 H 7.438 7.702 -2.744 1.00 . A A . 3 CYS HB2 1 1 10 6480 1 1 3 CYS HB3 H 6.533 8.869 -3.695 1.00 . A A . 3 CYS HB3 1 1 10 6481 1 1 3 CYS N N 7.161 9.015 -0.399 1.00 . A A . 3 CYS N 1 1 10 6482 1 1 3 CYS O O 5.397 7.112 -0.765 1.00 . A A . 3 CYS O 1 1 10 6483 1 1 3 CYS SG S 8.673 9.712 -3.061 1.00 . A A . 3 CYS SG 1 1 10 6484 1 1 4 GLU C C 1.957 7.801 -2.766 1.00 . A A . 4 GLU C 1 1 10 6485 1 1 4 GLU CA C 2.906 7.704 -1.590 1.00 . A A . 4 GLU CA 1 1 10 6486 1 1 4 GLU CB C 2.282 8.211 -0.292 1.00 . A A . 4 GLU CB 1 1 10 6487 1 1 4 GLU CD C 0.763 7.904 1.623 1.00 . A A . 4 GLU CD 1 1 10 6488 1 1 4 GLU CG C 1.169 7.381 0.278 1.00 . A A . 4 GLU CG 1 1 10 6489 1 1 4 GLU H H 3.960 9.292 -2.432 1.00 . A A . 4 GLU H 1 1 10 6490 1 1 4 GLU HA H 3.215 6.677 -1.457 1.00 . A A . 4 GLU HA 1 1 10 6491 1 1 4 GLU HB2 H 3.057 8.269 0.456 1.00 . A A . 4 GLU HB2 1 1 10 6492 1 1 4 GLU HB3 H 1.905 9.209 -0.463 1.00 . A A . 4 GLU HB3 1 1 10 6493 1 1 4 GLU HG2 H 0.324 7.430 -0.391 1.00 . A A . 4 GLU HG2 1 1 10 6494 1 1 4 GLU HG3 H 1.501 6.358 0.385 1.00 . A A . 4 GLU HG3 1 1 10 6495 1 1 4 GLU N N 4.058 8.502 -1.857 1.00 . A A . 4 GLU N 1 1 10 6496 1 1 4 GLU O O 1.464 8.890 -3.091 1.00 . A A . 4 GLU O 1 1 10 6497 1 1 4 GLU OE1 O -0.210 8.669 1.710 1.00 . A A . 4 GLU OE1 1 1 10 6498 1 1 4 GLU OE2 O 1.450 7.602 2.617 1.00 . A A . 4 GLU OE2 1 1 10 6499 1 1 5 ASN C C -0.038 5.470 -4.563 1.00 . A A . 5 ASN C 1 1 10 6500 1 1 5 ASN CA C 0.913 6.638 -4.614 1.00 . A A . 5 ASN CA 1 1 10 6501 1 1 5 ASN CB C 1.781 6.556 -5.893 1.00 . A A . 5 ASN CB 1 1 10 6502 1 1 5 ASN CG C 2.743 5.364 -5.923 1.00 . A A . 5 ASN CG 1 1 10 6503 1 1 5 ASN H H 2.128 5.851 -3.077 1.00 . A A . 5 ASN H 1 1 10 6504 1 1 5 ASN HA H 0.335 7.549 -4.652 1.00 . A A . 5 ASN HA 1 1 10 6505 1 1 5 ASN HB2 H 1.133 6.479 -6.754 1.00 . A A . 5 ASN HB2 1 1 10 6506 1 1 5 ASN HB3 H 2.362 7.464 -5.974 1.00 . A A . 5 ASN HB3 1 1 10 6507 1 1 5 ASN HD21 H 1.398 4.190 -6.812 1.00 . A A . 5 ASN HD21 1 1 10 6508 1 1 5 ASN HD22 H 2.931 3.484 -6.475 1.00 . A A . 5 ASN HD22 1 1 10 6509 1 1 5 ASN N N 1.737 6.688 -3.416 1.00 . A A . 5 ASN N 1 1 10 6510 1 1 5 ASN ND2 N 2.310 4.245 -6.455 1.00 . A A . 5 ASN ND2 1 1 10 6511 1 1 5 ASN O O 0.133 4.557 -3.749 1.00 . A A . 5 ASN O 1 1 10 6512 1 1 5 ASN OD1 O 3.887 5.468 -5.471 1.00 . A A . 5 ASN OD1 1 1 10 6513 1 1 6 LEU C C -1.463 3.174 -6.049 1.00 . A A . 6 LEU C 1 1 10 6514 1 1 6 LEU CA C -2.017 4.446 -5.489 1.00 . A A . 6 LEU CA 1 1 10 6515 1 1 6 LEU CB C -3.261 4.859 -6.276 1.00 . A A . 6 LEU CB 1 1 10 6516 1 1 6 LEU CD1 C -5.327 6.221 -6.502 1.00 . A A . 6 LEU CD1 1 1 10 6517 1 1 6 LEU CD2 C -4.637 5.405 -4.301 1.00 . A A . 6 LEU CD2 1 1 10 6518 1 1 6 LEU CG C -4.147 5.907 -5.624 1.00 . A A . 6 LEU CG 1 1 10 6519 1 1 6 LEU H H -1.108 6.248 -6.052 1.00 . A A . 6 LEU H 1 1 10 6520 1 1 6 LEU HA H -2.321 4.241 -4.474 1.00 . A A . 6 LEU HA 1 1 10 6521 1 1 6 LEU HB2 H -2.947 5.228 -7.240 1.00 . A A . 6 LEU HB2 1 1 10 6522 1 1 6 LEU HB3 H -3.856 3.972 -6.438 1.00 . A A . 6 LEU HB3 1 1 10 6523 1 1 6 LEU HD11 H -4.989 6.611 -7.449 1.00 . A A . 6 LEU HD11 1 1 10 6524 1 1 6 LEU HD12 H -5.949 6.939 -5.991 1.00 . A A . 6 LEU HD12 1 1 10 6525 1 1 6 LEU HD13 H -5.883 5.308 -6.658 1.00 . A A . 6 LEU HD13 1 1 10 6526 1 1 6 LEU HD21 H -5.316 6.130 -3.875 1.00 . A A . 6 LEU HD21 1 1 10 6527 1 1 6 LEU HD22 H -3.805 5.274 -3.626 1.00 . A A . 6 LEU HD22 1 1 10 6528 1 1 6 LEU HD23 H -5.153 4.465 -4.433 1.00 . A A . 6 LEU HD23 1 1 10 6529 1 1 6 LEU HG H -3.586 6.814 -5.453 1.00 . A A . 6 LEU HG 1 1 10 6530 1 1 6 LEU N N -1.031 5.495 -5.428 1.00 . A A . 6 LEU N 1 1 10 6531 1 1 6 LEU O O -0.669 3.172 -7.012 1.00 . A A . 6 LEU O 1 1 10 6532 1 1 7 ALA C C -2.458 0.301 -6.921 1.00 . A A . 7 ALA C 1 1 10 6533 1 1 7 ALA CA C -1.498 0.803 -5.856 1.00 . A A . 7 ALA CA 1 1 10 6534 1 1 7 ALA CB C -1.495 -0.122 -4.663 1.00 . A A . 7 ALA CB 1 1 10 6535 1 1 7 ALA H H -2.449 2.218 -4.656 1.00 . A A . 7 ALA H 1 1 10 6536 1 1 7 ALA HA H -0.498 0.846 -6.258 1.00 . A A . 7 ALA HA 1 1 10 6537 1 1 7 ALA HB1 H -2.500 -0.178 -4.267 1.00 . A A . 7 ALA HB1 1 1 10 6538 1 1 7 ALA HB2 H -0.845 0.291 -3.905 1.00 . A A . 7 ALA HB2 1 1 10 6539 1 1 7 ALA HB3 H -1.159 -1.106 -4.953 1.00 . A A . 7 ALA HB3 1 1 10 6540 1 1 7 ALA N N -1.870 2.108 -5.445 1.00 . A A . 7 ALA N 1 1 10 6541 1 1 7 ALA O O -3.596 -0.061 -6.629 1.00 . A A . 7 ALA O 1 1 10 6542 1 1 8 ASP C C -2.693 -1.689 -9.329 1.00 . A A . 8 ASP C 1 1 10 6543 1 1 8 ASP CA C -2.795 -0.181 -9.285 1.00 . A A . 8 ASP CA 1 1 10 6544 1 1 8 ASP CB C -2.301 0.410 -10.622 1.00 . A A . 8 ASP CB 1 1 10 6545 1 1 8 ASP CG C -0.873 0.018 -10.962 1.00 . A A . 8 ASP CG 1 1 10 6546 1 1 8 ASP H H -1.104 0.672 -8.311 1.00 . A A . 8 ASP H 1 1 10 6547 1 1 8 ASP HA H -3.826 0.098 -9.124 1.00 . A A . 8 ASP HA 1 1 10 6548 1 1 8 ASP HB2 H -2.943 0.060 -11.419 1.00 . A A . 8 ASP HB2 1 1 10 6549 1 1 8 ASP HB3 H -2.360 1.487 -10.572 1.00 . A A . 8 ASP HB3 1 1 10 6550 1 1 8 ASP N N -2.005 0.316 -8.152 1.00 . A A . 8 ASP N 1 1 10 6551 1 1 8 ASP O O -3.506 -2.372 -9.949 1.00 . A A . 8 ASP O 1 1 10 6552 1 1 8 ASP OD1 O 0.067 0.685 -10.457 1.00 . A A . 8 ASP OD1 1 1 10 6553 1 1 8 ASP OD2 O -0.664 -0.952 -11.731 1.00 . A A . 8 ASP OD2 1 1 10 6554 1 1 9 THR C C -2.398 -4.215 -7.528 1.00 . A A . 9 THR C 1 1 10 6555 1 1 9 THR CA C -1.427 -3.589 -8.550 1.00 . A A . 9 THR CA 1 1 10 6556 1 1 9 THR CB C 0.019 -3.759 -8.087 1.00 . A A . 9 THR CB 1 1 10 6557 1 1 9 THR CG2 C 0.489 -5.166 -8.321 1.00 . A A . 9 THR CG2 1 1 10 6558 1 1 9 THR H H -1.020 -1.601 -8.249 1.00 . A A . 9 THR H 1 1 10 6559 1 1 9 THR HA H -1.541 -4.060 -9.514 1.00 . A A . 9 THR HA 1 1 10 6560 1 1 9 THR HB H 0.096 -3.512 -7.038 1.00 . A A . 9 THR HB 1 1 10 6561 1 1 9 THR HG1 H 0.719 -3.128 -9.789 1.00 . A A . 9 THR HG1 1 1 10 6562 1 1 9 THR HG21 H 1.512 -5.251 -7.989 1.00 . A A . 9 THR HG21 1 1 10 6563 1 1 9 THR HG22 H 0.421 -5.386 -9.375 1.00 . A A . 9 THR HG22 1 1 10 6564 1 1 9 THR HG23 H -0.136 -5.844 -7.761 1.00 . A A . 9 THR HG23 1 1 10 6565 1 1 9 THR N N -1.679 -2.192 -8.665 1.00 . A A . 9 THR N 1 1 10 6566 1 1 9 THR O O -2.670 -5.417 -7.553 1.00 . A A . 9 THR O 1 1 10 6567 1 1 9 THR OG1 O 0.842 -2.867 -8.867 1.00 . A A . 9 THR OG1 1 1 10 6568 1 1 10 TYR C C -5.253 -3.936 -6.271 1.00 . A A . 10 TYR C 1 1 10 6569 1 1 10 TYR CA C -3.866 -3.823 -5.662 1.00 . A A . 10 TYR CA 1 1 10 6570 1 1 10 TYR CB C -3.859 -2.873 -4.464 1.00 . A A . 10 TYR CB 1 1 10 6571 1 1 10 TYR CD1 C -6.013 -2.859 -3.170 1.00 . A A . 10 TYR CD1 1 1 10 6572 1 1 10 TYR CD2 C -4.247 -4.235 -2.384 1.00 . A A . 10 TYR CD2 1 1 10 6573 1 1 10 TYR CE1 C -6.807 -3.273 -2.135 1.00 . A A . 10 TYR CE1 1 1 10 6574 1 1 10 TYR CE2 C -5.038 -4.656 -1.338 1.00 . A A . 10 TYR CE2 1 1 10 6575 1 1 10 TYR CG C -4.724 -3.329 -3.317 1.00 . A A . 10 TYR CG 1 1 10 6576 1 1 10 TYR CZ C -6.321 -4.168 -1.222 1.00 . A A . 10 TYR CZ 1 1 10 6577 1 1 10 TYR H H -2.759 -2.419 -6.743 1.00 . A A . 10 TYR H 1 1 10 6578 1 1 10 TYR HA H -3.548 -4.805 -5.343 1.00 . A A . 10 TYR HA 1 1 10 6579 1 1 10 TYR HB2 H -2.848 -2.775 -4.097 1.00 . A A . 10 TYR HB2 1 1 10 6580 1 1 10 TYR HB3 H -4.213 -1.904 -4.785 1.00 . A A . 10 TYR HB3 1 1 10 6581 1 1 10 TYR HD1 H -6.402 -2.152 -3.888 1.00 . A A . 10 TYR HD1 1 1 10 6582 1 1 10 TYR HD2 H -3.239 -4.611 -2.485 1.00 . A A . 10 TYR HD2 1 1 10 6583 1 1 10 TYR HE1 H -7.808 -2.878 -2.054 1.00 . A A . 10 TYR HE1 1 1 10 6584 1 1 10 TYR HE2 H -4.636 -5.360 -0.627 1.00 . A A . 10 TYR HE2 1 1 10 6585 1 1 10 TYR HH H -6.661 -4.499 0.643 1.00 . A A . 10 TYR HH 1 1 10 6586 1 1 10 TYR N N -2.951 -3.376 -6.671 1.00 . A A . 10 TYR N 1 1 10 6587 1 1 10 TYR O O -5.802 -2.956 -6.807 1.00 . A A . 10 TYR O 1 1 10 6588 1 1 10 TYR OH O -7.126 -4.582 -0.193 1.00 . A A . 10 TYR OH 1 1 10 6589 1 1 11 LYS C C -8.184 -5.457 -5.803 1.00 . A A . 11 LYS C 1 1 10 6590 1 1 11 LYS CA C -7.057 -5.419 -6.831 1.00 . A A . 11 LYS CA 1 1 10 6591 1 1 11 LYS CB C -6.916 -6.751 -7.572 1.00 . A A . 11 LYS CB 1 1 10 6592 1 1 11 LYS CD C -5.435 -8.087 -9.138 1.00 . A A . 11 LYS CD 1 1 10 6593 1 1 11 LYS CE C -4.250 -7.983 -10.087 1.00 . A A . 11 LYS CE 1 1 10 6594 1 1 11 LYS CG C -5.779 -6.720 -8.587 1.00 . A A . 11 LYS CG 1 1 10 6595 1 1 11 LYS H H -5.333 -5.823 -5.715 1.00 . A A . 11 LYS H 1 1 10 6596 1 1 11 LYS HA H -7.268 -4.647 -7.556 1.00 . A A . 11 LYS HA 1 1 10 6597 1 1 11 LYS HB2 H -6.722 -7.532 -6.852 1.00 . A A . 11 LYS HB2 1 1 10 6598 1 1 11 LYS HB3 H -7.835 -6.968 -8.096 1.00 . A A . 11 LYS HB3 1 1 10 6599 1 1 11 LYS HD2 H -5.181 -8.747 -8.321 1.00 . A A . 11 LYS HD2 1 1 10 6600 1 1 11 LYS HD3 H -6.284 -8.480 -9.676 1.00 . A A . 11 LYS HD3 1 1 10 6601 1 1 11 LYS HE2 H -4.547 -7.400 -10.945 1.00 . A A . 11 LYS HE2 1 1 10 6602 1 1 11 LYS HE3 H -3.448 -7.470 -9.579 1.00 . A A . 11 LYS HE3 1 1 10 6603 1 1 11 LYS HG2 H -6.063 -6.083 -9.411 1.00 . A A . 11 LYS HG2 1 1 10 6604 1 1 11 LYS HG3 H -4.905 -6.304 -8.107 1.00 . A A . 11 LYS HG3 1 1 10 6605 1 1 11 LYS HZ1 H -2.983 -9.206 -11.205 1.00 . A A . 11 LYS HZ1 1 1 10 6606 1 1 11 LYS HZ2 H -4.522 -9.860 -10.993 1.00 . A A . 11 LYS HZ2 1 1 10 6607 1 1 11 LYS HZ3 H -3.422 -9.844 -9.720 1.00 . A A . 11 LYS HZ3 1 1 10 6608 1 1 11 LYS N N -5.798 -5.114 -6.208 1.00 . A A . 11 LYS N 1 1 10 6609 1 1 11 LYS NZ N -3.773 -9.303 -10.537 1.00 . A A . 11 LYS NZ 1 1 10 6610 1 1 11 LYS O O -8.217 -6.332 -4.915 1.00 . A A . 11 LYS O 1 1 10 6611 1 1 12 GLY C C -10.111 -3.195 -4.105 1.00 . A A . 12 GLY C 1 1 10 6612 1 1 12 GLY CA C -10.207 -4.404 -5.021 1.00 . A A . 12 GLY CA 1 1 10 6613 1 1 12 GLY H H -8.936 -3.793 -6.574 1.00 . A A . 12 GLY H 1 1 10 6614 1 1 12 GLY HA2 H -11.099 -4.328 -5.625 1.00 . A A . 12 GLY HA2 1 1 10 6615 1 1 12 GLY HA3 H -10.257 -5.297 -4.418 1.00 . A A . 12 GLY HA3 1 1 10 6616 1 1 12 GLY N N -9.067 -4.492 -5.900 1.00 . A A . 12 GLY N 1 1 10 6617 1 1 12 GLY O O -9.080 -2.520 -4.087 1.00 . A A . 12 GLY O 1 1 10 6618 1 1 13 PRO C C -10.545 -2.289 -1.092 1.00 . A A . 13 PRO C 1 1 10 6619 1 1 13 PRO CA C -11.145 -1.779 -2.396 1.00 . A A . 13 PRO CA 1 1 10 6620 1 1 13 PRO CB C -12.633 -1.421 -2.188 1.00 . A A . 13 PRO CB 1 1 10 6621 1 1 13 PRO CD C -12.504 -3.447 -3.455 1.00 . A A . 13 PRO CD 1 1 10 6622 1 1 13 PRO CG C -13.395 -2.288 -3.142 1.00 . A A . 13 PRO CG 1 1 10 6623 1 1 13 PRO HA H -10.593 -0.920 -2.748 1.00 . A A . 13 PRO HA 1 1 10 6624 1 1 13 PRO HB2 H -12.909 -1.626 -1.164 1.00 . A A . 13 PRO HB2 1 1 10 6625 1 1 13 PRO HB3 H -12.787 -0.374 -2.401 1.00 . A A . 13 PRO HB3 1 1 10 6626 1 1 13 PRO HD2 H -12.623 -4.212 -2.704 1.00 . A A . 13 PRO HD2 1 1 10 6627 1 1 13 PRO HD3 H -12.704 -3.834 -4.442 1.00 . A A . 13 PRO HD3 1 1 10 6628 1 1 13 PRO HG2 H -14.310 -2.631 -2.682 1.00 . A A . 13 PRO HG2 1 1 10 6629 1 1 13 PRO HG3 H -13.615 -1.733 -4.041 1.00 . A A . 13 PRO HG3 1 1 10 6630 1 1 13 PRO N N -11.178 -2.851 -3.376 1.00 . A A . 13 PRO N 1 1 10 6631 1 1 13 PRO O O -10.748 -3.456 -0.717 1.00 . A A . 13 PRO O 1 1 10 6632 1 1 14 CYS C C -10.137 -1.713 1.982 1.00 . A A . 14 CYS C 1 1 10 6633 1 1 14 CYS CA C -9.201 -1.892 0.806 1.00 . A A . 14 CYS CA 1 1 10 6634 1 1 14 CYS CB C -7.881 -1.181 1.075 1.00 . A A . 14 CYS CB 1 1 10 6635 1 1 14 CYS H H -9.692 -0.540 -0.731 1.00 . A A . 14 CYS H 1 1 10 6636 1 1 14 CYS HA H -9.003 -2.948 0.701 1.00 . A A . 14 CYS HA 1 1 10 6637 1 1 14 CYS HB2 H -7.208 -1.351 0.247 1.00 . A A . 14 CYS HB2 1 1 10 6638 1 1 14 CYS HB3 H -8.059 -0.122 1.184 1.00 . A A . 14 CYS HB3 1 1 10 6639 1 1 14 CYS N N -9.813 -1.464 -0.413 1.00 . A A . 14 CYS N 1 1 10 6640 1 1 14 CYS O O -10.670 -0.615 2.225 1.00 . A A . 14 CYS O 1 1 10 6641 1 1 14 CYS SG S -7.073 -1.776 2.599 1.00 . A A . 14 CYS SG 1 1 10 6642 1 1 15 PHE C C -10.271 -2.907 5.090 1.00 . A A . 15 PHE C 1 1 10 6643 1 1 15 PHE CA C -11.167 -2.746 3.878 1.00 . A A . 15 PHE CA 1 1 10 6644 1 1 15 PHE CB C -12.267 -3.813 3.841 1.00 . A A . 15 PHE CB 1 1 10 6645 1 1 15 PHE CD1 C -13.130 -4.151 1.500 1.00 . A A . 15 PHE CD1 1 1 10 6646 1 1 15 PHE CD2 C -14.374 -2.756 2.978 1.00 . A A . 15 PHE CD2 1 1 10 6647 1 1 15 PHE CE1 C -14.050 -3.913 0.500 1.00 . A A . 15 PHE CE1 1 1 10 6648 1 1 15 PHE CE2 C -15.298 -2.519 1.984 1.00 . A A . 15 PHE CE2 1 1 10 6649 1 1 15 PHE CG C -13.281 -3.575 2.751 1.00 . A A . 15 PHE CG 1 1 10 6650 1 1 15 PHE CZ C -15.136 -3.096 0.742 1.00 . A A . 15 PHE CZ 1 1 10 6651 1 1 15 PHE H H -9.988 -3.643 2.389 1.00 . A A . 15 PHE H 1 1 10 6652 1 1 15 PHE HA H -11.626 -1.770 3.910 1.00 . A A . 15 PHE HA 1 1 10 6653 1 1 15 PHE HB2 H -11.813 -4.777 3.665 1.00 . A A . 15 PHE HB2 1 1 10 6654 1 1 15 PHE HB3 H -12.786 -3.827 4.787 1.00 . A A . 15 PHE HB3 1 1 10 6655 1 1 15 PHE HD1 H -12.282 -4.793 1.308 1.00 . A A . 15 PHE HD1 1 1 10 6656 1 1 15 PHE HD2 H -14.504 -2.304 3.951 1.00 . A A . 15 PHE HD2 1 1 10 6657 1 1 15 PHE HE1 H -13.921 -4.369 -0.472 1.00 . A A . 15 PHE HE1 1 1 10 6658 1 1 15 PHE HE2 H -16.146 -1.879 2.179 1.00 . A A . 15 PHE HE2 1 1 10 6659 1 1 15 PHE HZ H -15.858 -2.909 -0.040 1.00 . A A . 15 PHE HZ 1 1 10 6660 1 1 15 PHE N N -10.369 -2.789 2.687 1.00 . A A . 15 PHE N 1 1 10 6661 1 1 15 PHE O O -10.393 -2.177 6.077 1.00 . A A . 15 PHE O 1 1 10 6662 1 1 16 THR C C -7.002 -3.662 5.589 1.00 . A A . 16 THR C 1 1 10 6663 1 1 16 THR CA C -8.406 -4.098 6.031 1.00 . A A . 16 THR CA 1 1 10 6664 1 1 16 THR CB C -8.419 -5.606 6.314 1.00 . A A . 16 THR CB 1 1 10 6665 1 1 16 THR CG2 C -7.614 -5.934 7.556 1.00 . A A . 16 THR CG2 1 1 10 6666 1 1 16 THR H H -9.248 -4.333 4.153 1.00 . A A . 16 THR H 1 1 10 6667 1 1 16 THR HA H -8.701 -3.566 6.923 1.00 . A A . 16 THR HA 1 1 10 6668 1 1 16 THR HB H -7.994 -6.116 5.463 1.00 . A A . 16 THR HB 1 1 10 6669 1 1 16 THR HG1 H -10.145 -6.287 5.653 1.00 . A A . 16 THR HG1 1 1 10 6670 1 1 16 THR HG21 H -6.597 -5.603 7.412 1.00 . A A . 16 THR HG21 1 1 10 6671 1 1 16 THR HG22 H -7.624 -7.000 7.725 1.00 . A A . 16 THR HG22 1 1 10 6672 1 1 16 THR HG23 H -8.040 -5.428 8.411 1.00 . A A . 16 THR HG23 1 1 10 6673 1 1 16 THR N N -9.337 -3.814 4.981 1.00 . A A . 16 THR N 1 1 10 6674 1 1 16 THR O O -6.479 -4.171 4.586 1.00 . A A . 16 THR O 1 1 10 6675 1 1 16 THR OG1 O -9.781 -6.028 6.510 1.00 . A A . 16 THR OG1 1 1 10 6676 1 1 17 THR C C -4.033 -3.263 5.830 1.00 . A A . 17 THR C 1 1 10 6677 1 1 17 THR CA C -5.100 -2.171 6.014 1.00 . A A . 17 THR CA 1 1 10 6678 1 1 17 THR CB C -4.645 -1.176 7.110 1.00 . A A . 17 THR CB 1 1 10 6679 1 1 17 THR CG2 C -3.356 -0.470 6.702 1.00 . A A . 17 THR CG2 1 1 10 6680 1 1 17 THR H H -6.840 -2.425 7.159 1.00 . A A . 17 THR H 1 1 10 6681 1 1 17 THR HA H -5.204 -1.630 5.085 1.00 . A A . 17 THR HA 1 1 10 6682 1 1 17 THR HB H -4.473 -1.731 8.020 1.00 . A A . 17 THR HB 1 1 10 6683 1 1 17 THR HG1 H -5.350 0.645 6.956 1.00 . A A . 17 THR HG1 1 1 10 6684 1 1 17 THR HG21 H -2.575 -1.201 6.558 1.00 . A A . 17 THR HG21 1 1 10 6685 1 1 17 THR HG22 H -3.065 0.225 7.475 1.00 . A A . 17 THR HG22 1 1 10 6686 1 1 17 THR HG23 H -3.521 0.067 5.780 1.00 . A A . 17 THR HG23 1 1 10 6687 1 1 17 THR N N -6.401 -2.740 6.341 1.00 . A A . 17 THR N 1 1 10 6688 1 1 17 THR O O -3.239 -3.198 4.899 1.00 . A A . 17 THR O 1 1 10 6689 1 1 17 THR OG1 O -5.675 -0.183 7.338 1.00 . A A . 17 THR OG1 1 1 10 6690 1 1 18 GLY C C -3.010 -6.053 5.279 1.00 . A A . 18 GLY C 1 1 10 6691 1 1 18 GLY CA C -3.115 -5.386 6.642 1.00 . A A . 18 GLY CA 1 1 10 6692 1 1 18 GLY H H -4.764 -4.296 7.384 1.00 . A A . 18 GLY H 1 1 10 6693 1 1 18 GLY HA2 H -2.143 -5.004 6.913 1.00 . A A . 18 GLY HA2 1 1 10 6694 1 1 18 GLY HA3 H -3.409 -6.127 7.370 1.00 . A A . 18 GLY HA3 1 1 10 6695 1 1 18 GLY N N -4.076 -4.288 6.686 1.00 . A A . 18 GLY N 1 1 10 6696 1 1 18 GLY O O -1.913 -6.397 4.845 1.00 . A A . 18 GLY O 1 1 10 6697 1 1 19 SER C C -3.407 -5.992 2.251 1.00 . A A . 19 SER C 1 1 10 6698 1 1 19 SER CA C -4.194 -6.815 3.288 1.00 . A A . 19 SER CA 1 1 10 6699 1 1 19 SER CB C -5.651 -6.886 2.868 1.00 . A A . 19 SER CB 1 1 10 6700 1 1 19 SER H H -4.981 -5.833 4.950 1.00 . A A . 19 SER H 1 1 10 6701 1 1 19 SER HA H -3.798 -7.817 3.358 1.00 . A A . 19 SER HA 1 1 10 6702 1 1 19 SER HB2 H -5.975 -5.908 2.543 1.00 . A A . 19 SER HB2 1 1 10 6703 1 1 19 SER HB3 H -5.764 -7.592 2.059 1.00 . A A . 19 SER HB3 1 1 10 6704 1 1 19 SER HG H -6.500 -8.269 3.970 1.00 . A A . 19 SER HG 1 1 10 6705 1 1 19 SER N N -4.135 -6.175 4.589 1.00 . A A . 19 SER N 1 1 10 6706 1 1 19 SER O O -2.767 -6.534 1.347 1.00 . A A . 19 SER O 1 1 10 6707 1 1 19 SER OG O -6.468 -7.302 3.963 1.00 . A A . 19 SER OG 1 1 10 6708 1 1 20 CYS C C -1.359 -3.569 1.904 1.00 . A A . 20 CYS C 1 1 10 6709 1 1 20 CYS CA C -2.807 -3.781 1.500 1.00 . A A . 20 CYS CA 1 1 10 6710 1 1 20 CYS CB C -3.557 -2.472 1.544 1.00 . A A . 20 CYS CB 1 1 10 6711 1 1 20 CYS H H -3.898 -4.328 3.206 1.00 . A A . 20 CYS H 1 1 10 6712 1 1 20 CYS HA H -2.859 -4.185 0.501 1.00 . A A . 20 CYS HA 1 1 10 6713 1 1 20 CYS HB2 H -4.603 -2.661 1.354 1.00 . A A . 20 CYS HB2 1 1 10 6714 1 1 20 CYS HB3 H -3.454 -2.046 2.531 1.00 . A A . 20 CYS HB3 1 1 10 6715 1 1 20 CYS N N -3.441 -4.697 2.418 1.00 . A A . 20 CYS N 1 1 10 6716 1 1 20 CYS O O -0.446 -3.498 1.062 1.00 . A A . 20 CYS O 1 1 10 6717 1 1 20 CYS SG S -3.012 -1.250 0.358 1.00 . A A . 20 CYS SG 1 1 10 6718 1 1 21 ASP C C 1.046 -4.485 3.403 1.00 . A A . 21 ASP C 1 1 10 6719 1 1 21 ASP CA C 0.150 -3.334 3.800 1.00 . A A . 21 ASP CA 1 1 10 6720 1 1 21 ASP CB C 0.006 -3.249 5.322 1.00 . A A . 21 ASP CB 1 1 10 6721 1 1 21 ASP CG C 1.306 -3.038 6.047 1.00 . A A . 21 ASP CG 1 1 10 6722 1 1 21 ASP H H -1.934 -3.540 3.804 1.00 . A A . 21 ASP H 1 1 10 6723 1 1 21 ASP HA H 0.574 -2.410 3.436 1.00 . A A . 21 ASP HA 1 1 10 6724 1 1 21 ASP HB2 H -0.648 -2.425 5.568 1.00 . A A . 21 ASP HB2 1 1 10 6725 1 1 21 ASP HB3 H -0.440 -4.166 5.677 1.00 . A A . 21 ASP HB3 1 1 10 6726 1 1 21 ASP N N -1.155 -3.503 3.204 1.00 . A A . 21 ASP N 1 1 10 6727 1 1 21 ASP O O 2.172 -4.282 2.969 1.00 . A A . 21 ASP O 1 1 10 6728 1 1 21 ASP OD1 O 1.695 -3.916 6.851 1.00 . A A . 21 ASP OD1 1 1 10 6729 1 1 21 ASP OD2 O 1.951 -1.985 5.846 1.00 . A A . 21 ASP OD2 1 1 10 6730 1 1 22 ASP C C 1.579 -6.867 1.622 1.00 . A A . 22 ASP C 1 1 10 6731 1 1 22 ASP CA C 1.213 -6.911 3.108 1.00 . A A . 22 ASP CA 1 1 10 6732 1 1 22 ASP CB C 0.325 -8.132 3.378 1.00 . A A . 22 ASP CB 1 1 10 6733 1 1 22 ASP CG C 1.045 -9.452 3.234 1.00 . A A . 22 ASP CG 1 1 10 6734 1 1 22 ASP H H -0.425 -5.765 3.809 1.00 . A A . 22 ASP H 1 1 10 6735 1 1 22 ASP HA H 2.113 -6.984 3.701 1.00 . A A . 22 ASP HA 1 1 10 6736 1 1 22 ASP HB2 H -0.062 -8.070 4.384 1.00 . A A . 22 ASP HB2 1 1 10 6737 1 1 22 ASP HB3 H -0.502 -8.115 2.684 1.00 . A A . 22 ASP HB3 1 1 10 6738 1 1 22 ASP N N 0.499 -5.686 3.479 1.00 . A A . 22 ASP N 1 1 10 6739 1 1 22 ASP O O 2.699 -7.196 1.233 1.00 . A A . 22 ASP O 1 1 10 6740 1 1 22 ASP OD1 O 1.245 -9.934 2.103 1.00 . A A . 22 ASP OD1 1 1 10 6741 1 1 22 ASP OD2 O 1.393 -10.056 4.263 1.00 . A A . 22 ASP OD2 1 1 10 6742 1 1 23 HIS C C 1.964 -5.387 -1.010 1.00 . A A . 23 HIS C 1 1 10 6743 1 1 23 HIS CA C 0.801 -6.304 -0.628 1.00 . A A . 23 HIS CA 1 1 10 6744 1 1 23 HIS CB C -0.522 -5.835 -1.295 1.00 . A A . 23 HIS CB 1 1 10 6745 1 1 23 HIS CD2 C -0.065 -4.692 -3.591 1.00 . A A . 23 HIS CD2 1 1 10 6746 1 1 23 HIS CE1 C -0.728 -6.267 -4.917 1.00 . A A . 23 HIS CE1 1 1 10 6747 1 1 23 HIS CG C -0.480 -5.719 -2.804 1.00 . A A . 23 HIS CG 1 1 10 6748 1 1 23 HIS H H -0.197 -6.061 1.216 1.00 . A A . 23 HIS H 1 1 10 6749 1 1 23 HIS HA H 1.034 -7.293 -0.993 1.00 . A A . 23 HIS HA 1 1 10 6750 1 1 23 HIS HB2 H -1.307 -6.533 -1.047 1.00 . A A . 23 HIS HB2 1 1 10 6751 1 1 23 HIS HB3 H -0.783 -4.866 -0.894 1.00 . A A . 23 HIS HB3 1 1 10 6752 1 1 23 HIS HD1 H -1.284 -7.579 -3.422 1.00 . A A . 23 HIS HD1 1 1 10 6753 1 1 23 HIS HD2 H 0.324 -3.745 -3.243 1.00 . A A . 23 HIS HD2 1 1 10 6754 1 1 23 HIS HE1 H -0.975 -6.830 -5.806 1.00 . A A . 23 HIS HE1 1 1 10 6755 1 1 23 HIS N N 0.639 -6.384 0.818 1.00 . A A . 23 HIS N 1 1 10 6756 1 1 23 HIS ND1 N -0.900 -6.708 -3.667 1.00 . A A . 23 HIS ND1 1 1 10 6757 1 1 23 HIS NE2 N -0.223 -5.045 -4.923 1.00 . A A . 23 HIS NE2 1 1 10 6758 1 1 23 HIS O O 2.949 -5.836 -1.598 1.00 . A A . 23 HIS O 1 1 10 6759 1 1 24 CYS C C 4.272 -3.396 -0.414 1.00 . A A . 24 CYS C 1 1 10 6760 1 1 24 CYS CA C 2.903 -3.193 -1.044 1.00 . A A . 24 CYS CA 1 1 10 6761 1 1 24 CYS CB C 2.416 -1.750 -0.984 1.00 . A A . 24 CYS CB 1 1 10 6762 1 1 24 CYS H H 1.135 -3.846 -0.071 1.00 . A A . 24 CYS H 1 1 10 6763 1 1 24 CYS HA H 3.048 -3.433 -2.088 1.00 . A A . 24 CYS HA 1 1 10 6764 1 1 24 CYS HB2 H 1.927 -1.586 -0.035 1.00 . A A . 24 CYS HB2 1 1 10 6765 1 1 24 CYS HB3 H 3.252 -1.073 -1.078 1.00 . A A . 24 CYS HB3 1 1 10 6766 1 1 24 CYS N N 1.889 -4.139 -0.631 1.00 . A A . 24 CYS N 1 1 10 6767 1 1 24 CYS O O 5.276 -3.021 -1.004 1.00 . A A . 24 CYS O 1 1 10 6768 1 1 24 CYS SG S 1.221 -1.371 -2.311 1.00 . A A . 24 CYS SG 1 1 10 6769 1 1 25 LYS C C 6.293 -5.494 0.714 1.00 . A A . 25 LYS C 1 1 10 6770 1 1 25 LYS CA C 5.643 -4.276 1.343 1.00 . A A . 25 LYS CA 1 1 10 6771 1 1 25 LYS CB C 5.556 -4.492 2.842 1.00 . A A . 25 LYS CB 1 1 10 6772 1 1 25 LYS CD C 4.960 -3.621 5.122 1.00 . A A . 25 LYS CD 1 1 10 6773 1 1 25 LYS CE C 4.261 -4.943 5.383 1.00 . A A . 25 LYS CE 1 1 10 6774 1 1 25 LYS CG C 5.006 -3.318 3.627 1.00 . A A . 25 LYS CG 1 1 10 6775 1 1 25 LYS H H 3.520 -4.303 1.208 1.00 . A A . 25 LYS H 1 1 10 6776 1 1 25 LYS HA H 6.266 -3.415 1.148 1.00 . A A . 25 LYS HA 1 1 10 6777 1 1 25 LYS HB2 H 4.906 -5.337 3.006 1.00 . A A . 25 LYS HB2 1 1 10 6778 1 1 25 LYS HB3 H 6.540 -4.731 3.221 1.00 . A A . 25 LYS HB3 1 1 10 6779 1 1 25 LYS HD2 H 5.969 -3.672 5.504 1.00 . A A . 25 LYS HD2 1 1 10 6780 1 1 25 LYS HD3 H 4.422 -2.830 5.625 1.00 . A A . 25 LYS HD3 1 1 10 6781 1 1 25 LYS HE2 H 3.308 -4.940 4.874 1.00 . A A . 25 LYS HE2 1 1 10 6782 1 1 25 LYS HE3 H 4.886 -5.717 4.972 1.00 . A A . 25 LYS HE3 1 1 10 6783 1 1 25 LYS HG2 H 5.639 -2.460 3.461 1.00 . A A . 25 LYS HG2 1 1 10 6784 1 1 25 LYS HG3 H 4.006 -3.106 3.278 1.00 . A A . 25 LYS HG3 1 1 10 6785 1 1 25 LYS HZ1 H 3.309 -4.534 7.154 1.00 . A A . 25 LYS HZ1 1 1 10 6786 1 1 25 LYS HZ2 H 4.899 -5.066 7.374 1.00 . A A . 25 LYS HZ2 1 1 10 6787 1 1 25 LYS HZ3 H 3.683 -6.161 6.966 1.00 . A A . 25 LYS HZ3 1 1 10 6788 1 1 25 LYS N N 4.340 -4.018 0.745 1.00 . A A . 25 LYS N 1 1 10 6789 1 1 25 LYS NZ N 4.038 -5.197 6.808 1.00 . A A . 25 LYS NZ 1 1 10 6790 1 1 25 LYS O O 7.480 -5.490 0.429 1.00 . A A . 25 LYS O 1 1 10 6791 1 1 26 ASN C C 6.117 -7.859 -1.519 1.00 . A A . 26 ASN C 1 1 10 6792 1 1 26 ASN CA C 6.054 -7.780 -0.008 1.00 . A A . 26 ASN CA 1 1 10 6793 1 1 26 ASN CB C 5.266 -8.959 0.570 1.00 . A A . 26 ASN CB 1 1 10 6794 1 1 26 ASN CG C 5.402 -9.057 2.081 1.00 . A A . 26 ASN CG 1 1 10 6795 1 1 26 ASN H H 4.542 -6.440 0.626 1.00 . A A . 26 ASN H 1 1 10 6796 1 1 26 ASN HA H 7.064 -7.845 0.367 1.00 . A A . 26 ASN HA 1 1 10 6797 1 1 26 ASN HB2 H 4.219 -8.838 0.329 1.00 . A A . 26 ASN HB2 1 1 10 6798 1 1 26 ASN HB3 H 5.628 -9.877 0.131 1.00 . A A . 26 ASN HB3 1 1 10 6799 1 1 26 ASN HD21 H 3.523 -9.650 2.252 1.00 . A A . 26 ASN HD21 1 1 10 6800 1 1 26 ASN HD22 H 4.404 -9.520 3.721 1.00 . A A . 26 ASN HD22 1 1 10 6801 1 1 26 ASN N N 5.510 -6.515 0.471 1.00 . A A . 26 ASN N 1 1 10 6802 1 1 26 ASN ND2 N 4.346 -9.445 2.746 1.00 . A A . 26 ASN ND2 1 1 10 6803 1 1 26 ASN O O 7.160 -8.170 -2.080 1.00 . A A . 26 ASN O 1 1 10 6804 1 1 26 ASN OD1 O 6.448 -8.741 2.647 1.00 . A A . 26 ASN OD1 1 1 10 6805 1 1 27 LYS C C 5.711 -6.511 -4.286 1.00 . A A . 27 LYS C 1 1 10 6806 1 1 27 LYS CA C 4.962 -7.660 -3.640 1.00 . A A . 27 LYS CA 1 1 10 6807 1 1 27 LYS CB C 3.504 -7.635 -4.130 1.00 . A A . 27 LYS CB 1 1 10 6808 1 1 27 LYS CD C 3.050 -10.105 -3.963 1.00 . A A . 27 LYS CD 1 1 10 6809 1 1 27 LYS CE C 2.101 -11.150 -3.420 1.00 . A A . 27 LYS CE 1 1 10 6810 1 1 27 LYS CG C 2.604 -8.716 -3.555 1.00 . A A . 27 LYS CG 1 1 10 6811 1 1 27 LYS H H 4.231 -7.223 -1.697 1.00 . A A . 27 LYS H 1 1 10 6812 1 1 27 LYS HA H 5.415 -8.596 -3.936 1.00 . A A . 27 LYS HA 1 1 10 6813 1 1 27 LYS HB2 H 3.075 -6.677 -3.876 1.00 . A A . 27 LYS HB2 1 1 10 6814 1 1 27 LYS HB3 H 3.507 -7.734 -5.206 1.00 . A A . 27 LYS HB3 1 1 10 6815 1 1 27 LYS HD2 H 3.064 -10.165 -5.041 1.00 . A A . 27 LYS HD2 1 1 10 6816 1 1 27 LYS HD3 H 4.040 -10.289 -3.574 1.00 . A A . 27 LYS HD3 1 1 10 6817 1 1 27 LYS HE2 H 2.092 -11.089 -2.342 1.00 . A A . 27 LYS HE2 1 1 10 6818 1 1 27 LYS HE3 H 1.111 -10.942 -3.797 1.00 . A A . 27 LYS HE3 1 1 10 6819 1 1 27 LYS HG2 H 2.625 -8.648 -2.477 1.00 . A A . 27 LYS HG2 1 1 10 6820 1 1 27 LYS HG3 H 1.595 -8.551 -3.904 1.00 . A A . 27 LYS HG3 1 1 10 6821 1 1 27 LYS HZ1 H 2.454 -12.628 -4.848 1.00 . A A . 27 LYS HZ1 1 1 10 6822 1 1 27 LYS HZ2 H 1.860 -13.220 -3.377 1.00 . A A . 27 LYS HZ2 1 1 10 6823 1 1 27 LYS HZ3 H 3.457 -12.730 -3.511 1.00 . A A . 27 LYS HZ3 1 1 10 6824 1 1 27 LYS N N 5.022 -7.550 -2.182 1.00 . A A . 27 LYS N 1 1 10 6825 1 1 27 LYS NZ N 2.486 -12.513 -3.814 1.00 . A A . 27 LYS NZ 1 1 10 6826 1 1 27 LYS O O 6.588 -6.714 -5.128 1.00 . A A . 27 LYS O 1 1 10 6827 1 1 28 GLU C C 7.293 -3.724 -3.793 1.00 . A A . 28 GLU C 1 1 10 6828 1 1 28 GLU CA C 5.970 -4.105 -4.437 1.00 . A A . 28 GLU CA 1 1 10 6829 1 1 28 GLU CB C 4.979 -2.946 -4.368 1.00 . A A . 28 GLU CB 1 1 10 6830 1 1 28 GLU CD C 4.052 -3.370 -6.651 1.00 . A A . 28 GLU CD 1 1 10 6831 1 1 28 GLU CG C 3.726 -3.170 -5.194 1.00 . A A . 28 GLU CG 1 1 10 6832 1 1 28 GLU H H 4.725 -5.236 -3.135 1.00 . A A . 28 GLU H 1 1 10 6833 1 1 28 GLU HA H 6.160 -4.320 -5.477 1.00 . A A . 28 GLU HA 1 1 10 6834 1 1 28 GLU HB2 H 4.692 -2.791 -3.338 1.00 . A A . 28 GLU HB2 1 1 10 6835 1 1 28 GLU HB3 H 5.468 -2.055 -4.734 1.00 . A A . 28 GLU HB3 1 1 10 6836 1 1 28 GLU HG2 H 3.217 -4.050 -4.828 1.00 . A A . 28 GLU HG2 1 1 10 6837 1 1 28 GLU HG3 H 3.079 -2.311 -5.097 1.00 . A A . 28 GLU HG3 1 1 10 6838 1 1 28 GLU N N 5.390 -5.310 -3.854 1.00 . A A . 28 GLU N 1 1 10 6839 1 1 28 GLU O O 8.041 -2.919 -4.342 1.00 . A A . 28 GLU O 1 1 10 6840 1 1 28 GLU OE1 O 4.409 -2.386 -7.332 1.00 . A A . 28 GLU OE1 1 1 10 6841 1 1 28 GLU OE2 O 3.981 -4.515 -7.152 1.00 . A A . 28 GLU OE2 1 1 10 6842 1 1 29 HIS C C 8.935 -2.584 -1.464 1.00 . A A . 29 HIS C 1 1 10 6843 1 1 29 HIS CA C 8.802 -4.079 -1.860 1.00 . A A . 29 HIS CA 1 1 10 6844 1 1 29 HIS CB C 10.049 -4.605 -2.626 1.00 . A A . 29 HIS CB 1 1 10 6845 1 1 29 HIS CD2 C 11.584 -5.420 -0.709 1.00 . A A . 29 HIS CD2 1 1 10 6846 1 1 29 HIS CE1 C 13.327 -4.191 -1.087 1.00 . A A . 29 HIS CE1 1 1 10 6847 1 1 29 HIS CG C 11.302 -4.663 -1.791 1.00 . A A . 29 HIS CG 1 1 10 6848 1 1 29 HIS H H 6.911 -4.945 -2.276 1.00 . A A . 29 HIS H 1 1 10 6849 1 1 29 HIS HA H 8.688 -4.637 -0.942 1.00 . A A . 29 HIS HA 1 1 10 6850 1 1 29 HIS HB2 H 9.849 -5.602 -2.989 1.00 . A A . 29 HIS HB2 1 1 10 6851 1 1 29 HIS HB3 H 10.238 -3.955 -3.467 1.00 . A A . 29 HIS HB3 1 1 10 6852 1 1 29 HIS HD1 H 12.551 -3.235 -2.737 1.00 . A A . 29 HIS HD1 1 1 10 6853 1 1 29 HIS HD2 H 10.923 -6.144 -0.257 1.00 . A A . 29 HIS HD2 1 1 10 6854 1 1 29 HIS HE1 H 14.302 -3.730 -1.012 1.00 . A A . 29 HIS HE1 1 1 10 6855 1 1 29 HIS N N 7.567 -4.313 -2.632 1.00 . A A . 29 HIS N 1 1 10 6856 1 1 29 HIS ND1 N 12.424 -3.892 -2.015 1.00 . A A . 29 HIS ND1 1 1 10 6857 1 1 29 HIS NE2 N 12.868 -5.119 -0.263 1.00 . A A . 29 HIS NE2 1 1 10 6858 1 1 29 HIS O O 10.023 -1.991 -1.465 1.00 . A A . 29 HIS O 1 1 10 6859 1 1 30 LEU C C 7.794 -0.593 0.859 1.00 . A A . 30 LEU C 1 1 10 6860 1 1 30 LEU CA C 7.805 -0.622 -0.662 1.00 . A A . 30 LEU CA 1 1 10 6861 1 1 30 LEU CB C 6.591 0.120 -1.237 1.00 . A A . 30 LEU CB 1 1 10 6862 1 1 30 LEU CD1 C 5.295 0.973 -3.216 1.00 . A A . 30 LEU CD1 1 1 10 6863 1 1 30 LEU CD2 C 7.780 0.678 -3.393 1.00 . A A . 30 LEU CD2 1 1 10 6864 1 1 30 LEU CG C 6.492 0.152 -2.767 1.00 . A A . 30 LEU CG 1 1 10 6865 1 1 30 LEU H H 6.981 -2.496 -1.132 1.00 . A A . 30 LEU H 1 1 10 6866 1 1 30 LEU HA H 8.712 -0.149 -1.006 1.00 . A A . 30 LEU HA 1 1 10 6867 1 1 30 LEU HB2 H 5.700 -0.350 -0.850 1.00 . A A . 30 LEU HB2 1 1 10 6868 1 1 30 LEU HB3 H 6.620 1.139 -0.881 1.00 . A A . 30 LEU HB3 1 1 10 6869 1 1 30 LEU HD11 H 4.391 0.533 -2.823 1.00 . A A . 30 LEU HD11 1 1 10 6870 1 1 30 LEU HD12 H 5.251 0.985 -4.295 1.00 . A A . 30 LEU HD12 1 1 10 6871 1 1 30 LEU HD13 H 5.392 1.984 -2.849 1.00 . A A . 30 LEU HD13 1 1 10 6872 1 1 30 LEU HD21 H 7.996 1.670 -3.023 1.00 . A A . 30 LEU HD21 1 1 10 6873 1 1 30 LEU HD22 H 7.665 0.714 -4.465 1.00 . A A . 30 LEU HD22 1 1 10 6874 1 1 30 LEU HD23 H 8.598 0.017 -3.146 1.00 . A A . 30 LEU HD23 1 1 10 6875 1 1 30 LEU HG H 6.336 -0.859 -3.116 1.00 . A A . 30 LEU HG 1 1 10 6876 1 1 30 LEU N N 7.826 -1.994 -1.108 1.00 . A A . 30 LEU N 1 1 10 6877 1 1 30 LEU O O 7.891 -1.650 1.501 1.00 . A A . 30 LEU O 1 1 10 6878 1 1 31 ARG C C 6.473 0.173 3.541 1.00 . A A . 31 ARG C 1 1 10 6879 1 1 31 ARG CA C 7.711 0.748 2.870 1.00 . A A . 31 ARG CA 1 1 10 6880 1 1 31 ARG CB C 7.893 2.223 3.263 1.00 . A A . 31 ARG CB 1 1 10 6881 1 1 31 ARG CD C 8.060 3.909 5.133 1.00 . A A . 31 ARG CD 1 1 10 6882 1 1 31 ARG CG C 7.854 2.455 4.763 1.00 . A A . 31 ARG CG 1 1 10 6883 1 1 31 ARG CZ C 8.481 5.141 7.265 1.00 . A A . 31 ARG CZ 1 1 10 6884 1 1 31 ARG H H 7.533 1.381 0.872 1.00 . A A . 31 ARG H 1 1 10 6885 1 1 31 ARG HA H 8.571 0.197 3.224 1.00 . A A . 31 ARG HA 1 1 10 6886 1 1 31 ARG HB2 H 8.844 2.573 2.889 1.00 . A A . 31 ARG HB2 1 1 10 6887 1 1 31 ARG HB3 H 7.101 2.803 2.810 1.00 . A A . 31 ARG HB3 1 1 10 6888 1 1 31 ARG HD2 H 9.026 4.232 4.776 1.00 . A A . 31 ARG HD2 1 1 10 6889 1 1 31 ARG HD3 H 7.286 4.501 4.670 1.00 . A A . 31 ARG HD3 1 1 10 6890 1 1 31 ARG HE H 7.514 3.386 7.069 1.00 . A A . 31 ARG HE 1 1 10 6891 1 1 31 ARG HG2 H 6.893 2.134 5.139 1.00 . A A . 31 ARG HG2 1 1 10 6892 1 1 31 ARG HG3 H 8.629 1.856 5.217 1.00 . A A . 31 ARG HG3 1 1 10 6893 1 1 31 ARG HH11 H 9.494 5.985 5.691 1.00 . A A . 31 ARG HH11 1 1 10 6894 1 1 31 ARG HH12 H 9.612 6.845 7.160 1.00 . A A . 31 ARG HH12 1 1 10 6895 1 1 31 ARG HH21 H 7.723 4.524 9.052 1.00 . A A . 31 ARG HH21 1 1 10 6896 1 1 31 ARG HH22 H 8.583 5.995 9.125 1.00 . A A . 31 ARG HH22 1 1 10 6897 1 1 31 ARG N N 7.668 0.587 1.431 1.00 . A A . 31 ARG N 1 1 10 6898 1 1 31 ARG NE N 7.995 4.094 6.584 1.00 . A A . 31 ARG NE 1 1 10 6899 1 1 31 ARG NH1 N 9.246 6.054 6.663 1.00 . A A . 31 ARG NH1 1 1 10 6900 1 1 31 ARG NH2 N 8.250 5.229 8.567 1.00 . A A . 31 ARG NH2 1 1 10 6901 1 1 31 ARG O O 6.581 -0.644 4.454 1.00 . A A . 31 ARG O 1 1 10 6902 1 1 32 SER C C 2.905 0.409 2.732 1.00 . A A . 32 SER C 1 1 10 6903 1 1 32 SER CA C 4.051 0.168 3.716 1.00 . A A . 32 SER CA 1 1 10 6904 1 1 32 SER CB C 3.781 0.965 5.014 1.00 . A A . 32 SER CB 1 1 10 6905 1 1 32 SER H H 5.258 1.241 2.366 1.00 . A A . 32 SER H 1 1 10 6906 1 1 32 SER HA H 4.123 -0.886 3.955 1.00 . A A . 32 SER HA 1 1 10 6907 1 1 32 SER HB2 H 3.656 2.010 4.774 1.00 . A A . 32 SER HB2 1 1 10 6908 1 1 32 SER HB3 H 2.879 0.594 5.475 1.00 . A A . 32 SER HB3 1 1 10 6909 1 1 32 SER HG H 5.462 0.178 5.578 1.00 . A A . 32 SER HG 1 1 10 6910 1 1 32 SER N N 5.306 0.607 3.118 1.00 . A A . 32 SER N 1 1 10 6911 1 1 32 SER O O 3.083 1.108 1.730 1.00 . A A . 32 SER O 1 1 10 6912 1 1 32 SER OG O 4.856 0.839 5.944 1.00 . A A . 32 SER OG 1 1 10 6913 1 1 33 GLY C C -0.531 0.484 3.120 1.00 . A A . 33 GLY C 1 1 10 6914 1 1 33 GLY CA C 0.584 0.047 2.216 1.00 . A A . 33 GLY CA 1 1 10 6915 1 1 33 GLY H H 1.690 -0.764 3.789 1.00 . A A . 33 GLY H 1 1 10 6916 1 1 33 GLY HA2 H 0.783 0.809 1.478 1.00 . A A . 33 GLY HA2 1 1 10 6917 1 1 33 GLY HA3 H 0.298 -0.872 1.724 1.00 . A A . 33 GLY HA3 1 1 10 6918 1 1 33 GLY N N 1.767 -0.173 3.010 1.00 . A A . 33 GLY N 1 1 10 6919 1 1 33 GLY O O -0.850 -0.216 4.082 1.00 . A A . 33 GLY O 1 1 10 6920 1 1 34 ARG C C -3.387 2.448 2.986 1.00 . A A . 34 ARG C 1 1 10 6921 1 1 34 ARG CA C -2.110 2.162 3.737 1.00 . A A . 34 ARG CA 1 1 10 6922 1 1 34 ARG CB C -1.613 3.384 4.513 1.00 . A A . 34 ARG CB 1 1 10 6923 1 1 34 ARG CD C -0.462 5.607 4.495 1.00 . A A . 34 ARG CD 1 1 10 6924 1 1 34 ARG CG C -0.993 4.467 3.654 1.00 . A A . 34 ARG CG 1 1 10 6925 1 1 34 ARG CZ C 1.667 5.743 5.778 1.00 . A A . 34 ARG CZ 1 1 10 6926 1 1 34 ARG H H -0.842 2.157 2.076 1.00 . A A . 34 ARG H 1 1 10 6927 1 1 34 ARG HA H -2.330 1.381 4.450 1.00 . A A . 34 ARG HA 1 1 10 6928 1 1 34 ARG HB2 H -2.451 3.818 5.039 1.00 . A A . 34 ARG HB2 1 1 10 6929 1 1 34 ARG HB3 H -0.880 3.057 5.235 1.00 . A A . 34 ARG HB3 1 1 10 6930 1 1 34 ARG HD2 H 0.010 6.324 3.841 1.00 . A A . 34 ARG HD2 1 1 10 6931 1 1 34 ARG HD3 H -1.289 6.077 5.008 1.00 . A A . 34 ARG HD3 1 1 10 6932 1 1 34 ARG HE H 0.262 4.330 5.983 1.00 . A A . 34 ARG HE 1 1 10 6933 1 1 34 ARG HG2 H -0.174 4.026 3.104 1.00 . A A . 34 ARG HG2 1 1 10 6934 1 1 34 ARG HG3 H -1.734 4.841 2.963 1.00 . A A . 34 ARG HG3 1 1 10 6935 1 1 34 ARG HH11 H 1.561 7.170 4.307 1.00 . A A . 34 ARG HH11 1 1 10 6936 1 1 34 ARG HH12 H 2.938 7.263 5.312 1.00 . A A . 34 ARG HH12 1 1 10 6937 1 1 34 ARG HH21 H 2.131 4.439 7.248 1.00 . A A . 34 ARG HH21 1 1 10 6938 1 1 34 ARG HH22 H 3.310 5.649 6.982 1.00 . A A . 34 ARG HH22 1 1 10 6939 1 1 34 ARG N N -1.087 1.634 2.875 1.00 . A A . 34 ARG N 1 1 10 6940 1 1 34 ARG NE N 0.513 5.143 5.488 1.00 . A A . 34 ARG NE 1 1 10 6941 1 1 34 ARG NH1 N 2.083 6.793 5.086 1.00 . A A . 34 ARG NH1 1 1 10 6942 1 1 34 ARG NH2 N 2.422 5.252 6.738 1.00 . A A . 34 ARG NH2 1 1 10 6943 1 1 34 ARG O O -3.381 2.859 1.823 1.00 . A A . 34 ARG O 1 1 10 6944 1 1 35 CYS C C -6.411 3.613 3.611 1.00 . A A . 35 CYS C 1 1 10 6945 1 1 35 CYS CA C -5.758 2.377 3.063 1.00 . A A . 35 CYS CA 1 1 10 6946 1 1 35 CYS CB C -6.581 1.138 3.387 1.00 . A A . 35 CYS CB 1 1 10 6947 1 1 35 CYS H H -4.413 1.963 4.590 1.00 . A A . 35 CYS H 1 1 10 6948 1 1 35 CYS HA H -5.660 2.463 1.992 1.00 . A A . 35 CYS HA 1 1 10 6949 1 1 35 CYS HB2 H -6.839 1.147 4.435 1.00 . A A . 35 CYS HB2 1 1 10 6950 1 1 35 CYS HB3 H -7.482 1.136 2.791 1.00 . A A . 35 CYS HB3 1 1 10 6951 1 1 35 CYS N N -4.466 2.231 3.649 1.00 . A A . 35 CYS N 1 1 10 6952 1 1 35 CYS O O -6.383 3.863 4.823 1.00 . A A . 35 CYS O 1 1 10 6953 1 1 35 CYS SG S -5.667 -0.397 3.035 1.00 . A A . 35 CYS SG 1 1 10 6954 1 1 36 ARG C C -9.106 5.407 3.042 1.00 . A A . 36 ARG C 1 1 10 6955 1 1 36 ARG CA C -7.615 5.610 3.136 1.00 . A A . 36 ARG CA 1 1 10 6956 1 1 36 ARG CB C -7.159 6.799 2.295 1.00 . A A . 36 ARG CB 1 1 10 6957 1 1 36 ARG CD C -5.558 7.659 4.046 1.00 . A A . 36 ARG CD 1 1 10 6958 1 1 36 ARG CG C -5.726 7.259 2.582 1.00 . A A . 36 ARG CG 1 1 10 6959 1 1 36 ARG CZ C -7.251 8.679 5.572 1.00 . A A . 36 ARG CZ 1 1 10 6960 1 1 36 ARG H H -6.884 4.168 1.787 1.00 . A A . 36 ARG H 1 1 10 6961 1 1 36 ARG HA H -7.369 5.796 4.170 1.00 . A A . 36 ARG HA 1 1 10 6962 1 1 36 ARG HB2 H -7.211 6.505 1.257 1.00 . A A . 36 ARG HB2 1 1 10 6963 1 1 36 ARG HB3 H -7.829 7.628 2.467 1.00 . A A . 36 ARG HB3 1 1 10 6964 1 1 36 ARG HD2 H -5.666 6.785 4.672 1.00 . A A . 36 ARG HD2 1 1 10 6965 1 1 36 ARG HD3 H -4.569 8.070 4.183 1.00 . A A . 36 ARG HD3 1 1 10 6966 1 1 36 ARG HE H -6.691 9.373 3.756 1.00 . A A . 36 ARG HE 1 1 10 6967 1 1 36 ARG HG2 H -5.045 6.450 2.357 1.00 . A A . 36 ARG HG2 1 1 10 6968 1 1 36 ARG HG3 H -5.499 8.109 1.954 1.00 . A A . 36 ARG HG3 1 1 10 6969 1 1 36 ARG HH11 H -6.316 7.062 6.428 1.00 . A A . 36 ARG HH11 1 1 10 6970 1 1 36 ARG HH12 H -7.546 7.760 7.374 1.00 . A A . 36 ARG HH12 1 1 10 6971 1 1 36 ARG HH21 H -8.363 10.309 5.063 1.00 . A A . 36 ARG HH21 1 1 10 6972 1 1 36 ARG HH22 H -8.748 9.660 6.587 1.00 . A A . 36 ARG HH22 1 1 10 6973 1 1 36 ARG N N -6.935 4.412 2.738 1.00 . A A . 36 ARG N 1 1 10 6974 1 1 36 ARG NE N -6.547 8.670 4.436 1.00 . A A . 36 ARG NE 1 1 10 6975 1 1 36 ARG NH1 N -7.018 7.773 6.519 1.00 . A A . 36 ARG NH1 1 1 10 6976 1 1 36 ARG NH2 N -8.179 9.607 5.761 1.00 . A A . 36 ARG NH2 1 1 10 6977 1 1 36 ARG O O -9.555 4.389 2.507 1.00 . A A . 36 ARG O 1 1 10 6978 1 1 37 ASP C C -11.952 6.228 2.140 1.00 . A A . 37 ASP C 1 1 10 6979 1 1 37 ASP CA C -11.359 6.293 3.547 1.00 . A A . 37 ASP CA 1 1 10 6980 1 1 37 ASP CB C -11.987 7.465 4.312 1.00 . A A . 37 ASP CB 1 1 10 6981 1 1 37 ASP CG C -12.004 8.760 3.531 1.00 . A A . 37 ASP CG 1 1 10 6982 1 1 37 ASP H H -9.461 7.219 3.832 1.00 . A A . 37 ASP H 1 1 10 6983 1 1 37 ASP HA H -11.589 5.374 4.064 1.00 . A A . 37 ASP HA 1 1 10 6984 1 1 37 ASP HB2 H -13.006 7.213 4.560 1.00 . A A . 37 ASP HB2 1 1 10 6985 1 1 37 ASP HB3 H -11.432 7.623 5.225 1.00 . A A . 37 ASP HB3 1 1 10 6986 1 1 37 ASP N N -9.879 6.396 3.500 1.00 . A A . 37 ASP N 1 1 10 6987 1 1 37 ASP O O -13.113 5.877 1.947 1.00 . A A . 37 ASP O 1 1 10 6988 1 1 37 ASP OD1 O -10.974 9.460 3.475 1.00 . A A . 37 ASP OD1 1 1 10 6989 1 1 37 ASP OD2 O -13.061 9.120 2.980 1.00 . A A . 37 ASP OD2 1 1 10 6990 1 1 38 ASP C C -11.561 5.045 -0.724 1.00 . A A . 38 ASP C 1 1 10 6991 1 1 38 ASP CA C -11.436 6.507 -0.251 1.00 . A A . 38 ASP CA 1 1 10 6992 1 1 38 ASP CB C -10.286 7.198 -1.000 1.00 . A A . 38 ASP CB 1 1 10 6993 1 1 38 ASP CG C -10.536 7.430 -2.473 1.00 . A A . 38 ASP CG 1 1 10 6994 1 1 38 ASP H H -10.224 6.828 1.460 1.00 . A A . 38 ASP H 1 1 10 6995 1 1 38 ASP HA H -12.354 7.047 -0.434 1.00 . A A . 38 ASP HA 1 1 10 6996 1 1 38 ASP HB2 H -10.089 8.156 -0.542 1.00 . A A . 38 ASP HB2 1 1 10 6997 1 1 38 ASP HB3 H -9.407 6.579 -0.897 1.00 . A A . 38 ASP HB3 1 1 10 6998 1 1 38 ASP N N -11.115 6.542 1.176 1.00 . A A . 38 ASP N 1 1 10 6999 1 1 38 ASP O O -12.051 4.768 -1.819 1.00 . A A . 38 ASP O 1 1 10 7000 1 1 38 ASP OD1 O -10.059 6.645 -3.314 1.00 . A A . 38 ASP OD1 1 1 10 7001 1 1 38 ASP OD2 O -11.163 8.447 -2.817 1.00 . A A . 38 ASP OD2 1 1 10 7002 1 1 39 PHE C C -9.899 2.282 -0.970 1.00 . A A . 39 PHE C 1 1 10 7003 1 1 39 PHE CA C -11.055 2.653 -0.071 1.00 . A A . 39 PHE CA 1 1 10 7004 1 1 39 PHE CB C -12.372 2.062 -0.615 1.00 . A A . 39 PHE CB 1 1 10 7005 1 1 39 PHE CD1 C -13.805 1.055 1.179 1.00 . A A . 39 PHE CD1 1 1 10 7006 1 1 39 PHE CD2 C -14.386 3.213 0.356 1.00 . A A . 39 PHE CD2 1 1 10 7007 1 1 39 PHE CE1 C -14.887 1.092 2.035 1.00 . A A . 39 PHE CE1 1 1 10 7008 1 1 39 PHE CE2 C -15.465 3.256 1.210 1.00 . A A . 39 PHE CE2 1 1 10 7009 1 1 39 PHE CG C -13.541 2.115 0.331 1.00 . A A . 39 PHE CG 1 1 10 7010 1 1 39 PHE CZ C -15.718 2.195 2.050 1.00 . A A . 39 PHE CZ 1 1 10 7011 1 1 39 PHE H H -10.782 4.432 1.030 1.00 . A A . 39 PHE H 1 1 10 7012 1 1 39 PHE HA H -10.846 2.215 0.895 1.00 . A A . 39 PHE HA 1 1 10 7013 1 1 39 PHE HB2 H -12.652 2.602 -1.507 1.00 . A A . 39 PHE HB2 1 1 10 7014 1 1 39 PHE HB3 H -12.198 1.028 -0.876 1.00 . A A . 39 PHE HB3 1 1 10 7015 1 1 39 PHE HD1 H -13.154 0.193 1.173 1.00 . A A . 39 PHE HD1 1 1 10 7016 1 1 39 PHE HD2 H -14.187 4.048 -0.301 1.00 . A A . 39 PHE HD2 1 1 10 7017 1 1 39 PHE HE1 H -15.084 0.259 2.694 1.00 . A A . 39 PHE HE1 1 1 10 7018 1 1 39 PHE HE2 H -16.114 4.120 1.219 1.00 . A A . 39 PHE HE2 1 1 10 7019 1 1 39 PHE HZ H -16.567 2.229 2.717 1.00 . A A . 39 PHE HZ 1 1 10 7020 1 1 39 PHE N N -11.102 4.118 0.155 1.00 . A A . 39 PHE N 1 1 10 7021 1 1 39 PHE O O -9.712 1.118 -1.324 1.00 . A A . 39 PHE O 1 1 10 7022 1 1 40 ARG C C -6.728 2.829 -1.388 1.00 . A A . 40 ARG C 1 1 10 7023 1 1 40 ARG CA C -7.995 3.060 -2.180 1.00 . A A . 40 ARG CA 1 1 10 7024 1 1 40 ARG CB C -7.817 4.259 -3.098 1.00 . A A . 40 ARG CB 1 1 10 7025 1 1 40 ARG CD C -9.223 3.406 -4.995 1.00 . A A . 40 ARG CD 1 1 10 7026 1 1 40 ARG CG C -7.860 3.921 -4.582 1.00 . A A . 40 ARG CG 1 1 10 7027 1 1 40 ARG CZ C -11.526 4.308 -5.133 1.00 . A A . 40 ARG CZ 1 1 10 7028 1 1 40 ARG H H -9.300 4.144 -0.935 1.00 . A A . 40 ARG H 1 1 10 7029 1 1 40 ARG HA H -8.192 2.190 -2.786 1.00 . A A . 40 ARG HA 1 1 10 7030 1 1 40 ARG HB2 H -8.601 4.971 -2.892 1.00 . A A . 40 ARG HB2 1 1 10 7031 1 1 40 ARG HB3 H -6.863 4.718 -2.882 1.00 . A A . 40 ARG HB3 1 1 10 7032 1 1 40 ARG HD2 H -9.209 3.178 -6.052 1.00 . A A . 40 ARG HD2 1 1 10 7033 1 1 40 ARG HD3 H -9.447 2.510 -4.436 1.00 . A A . 40 ARG HD3 1 1 10 7034 1 1 40 ARG HE H -10.009 5.194 -4.209 1.00 . A A . 40 ARG HE 1 1 10 7035 1 1 40 ARG HG2 H -7.636 4.811 -5.149 1.00 . A A . 40 ARG HG2 1 1 10 7036 1 1 40 ARG HG3 H -7.116 3.165 -4.783 1.00 . A A . 40 ARG HG3 1 1 10 7037 1 1 40 ARG HH11 H -11.342 2.479 -6.029 1.00 . A A . 40 ARG HH11 1 1 10 7038 1 1 40 ARG HH12 H -12.903 3.150 -6.102 1.00 . A A . 40 ARG HH12 1 1 10 7039 1 1 40 ARG HH21 H -12.051 6.080 -4.306 1.00 . A A . 40 ARG HH21 1 1 10 7040 1 1 40 ARG HH22 H -13.325 5.297 -5.106 1.00 . A A . 40 ARG HH22 1 1 10 7041 1 1 40 ARG N N -9.109 3.260 -1.306 1.00 . A A . 40 ARG N 1 1 10 7042 1 1 40 ARG NE N -10.269 4.393 -4.735 1.00 . A A . 40 ARG NE 1 1 10 7043 1 1 40 ARG NH1 N -11.949 3.244 -5.806 1.00 . A A . 40 ARG NH1 1 1 10 7044 1 1 40 ARG NH2 N -12.361 5.283 -4.833 1.00 . A A . 40 ARG NH2 1 1 10 7045 1 1 40 ARG O O -6.592 3.303 -0.237 1.00 . A A . 40 ARG O 1 1 10 7046 1 1 41 CYS C C -3.483 2.785 -1.827 1.00 . A A . 41 CYS C 1 1 10 7047 1 1 41 CYS CA C -4.548 1.811 -1.417 1.00 . A A . 41 CYS CA 1 1 10 7048 1 1 41 CYS CB C -4.116 0.411 -1.781 1.00 . A A . 41 CYS CB 1 1 10 7049 1 1 41 CYS H H -6.021 1.754 -2.884 1.00 . A A . 41 CYS H 1 1 10 7050 1 1 41 CYS HA H -4.656 1.849 -0.344 1.00 . A A . 41 CYS HA 1 1 10 7051 1 1 41 CYS HB2 H -4.502 0.164 -2.759 1.00 . A A . 41 CYS HB2 1 1 10 7052 1 1 41 CYS HB3 H -3.040 0.340 -1.801 1.00 . A A . 41 CYS HB3 1 1 10 7053 1 1 41 CYS N N -5.828 2.114 -1.993 1.00 . A A . 41 CYS N 1 1 10 7054 1 1 41 CYS O O -3.136 2.882 -3.008 1.00 . A A . 41 CYS O 1 1 10 7055 1 1 41 CYS SG S -4.706 -0.837 -0.655 1.00 . A A . 41 CYS SG 1 1 10 7056 1 1 42 TRP C C -0.661 3.711 -0.443 1.00 . A A . 42 TRP C 1 1 10 7057 1 1 42 TRP CA C -1.870 4.379 -1.035 1.00 . A A . 42 TRP CA 1 1 10 7058 1 1 42 TRP CB C -2.109 5.734 -0.354 1.00 . A A . 42 TRP CB 1 1 10 7059 1 1 42 TRP CD1 C -1.948 7.684 -2.001 1.00 . A A . 42 TRP CD1 1 1 10 7060 1 1 42 TRP CD2 C -4.050 7.153 -1.452 1.00 . A A . 42 TRP CD2 1 1 10 7061 1 1 42 TRP CE2 C -4.076 8.242 -2.351 1.00 . A A . 42 TRP CE2 1 1 10 7062 1 1 42 TRP CE3 C -5.260 6.649 -0.981 1.00 . A A . 42 TRP CE3 1 1 10 7063 1 1 42 TRP CG C -2.669 6.810 -1.243 1.00 . A A . 42 TRP CG 1 1 10 7064 1 1 42 TRP CH2 C -6.427 8.317 -2.288 1.00 . A A . 42 TRP CH2 1 1 10 7065 1 1 42 TRP CZ2 C -5.261 8.832 -2.774 1.00 . A A . 42 TRP CZ2 1 1 10 7066 1 1 42 TRP CZ3 C -6.435 7.238 -1.403 1.00 . A A . 42 TRP CZ3 1 1 10 7067 1 1 42 TRP H H -3.323 3.379 0.055 1.00 . A A . 42 TRP H 1 1 10 7068 1 1 42 TRP HA H -1.717 4.520 -2.096 1.00 . A A . 42 TRP HA 1 1 10 7069 1 1 42 TRP HB2 H -2.808 5.590 0.456 1.00 . A A . 42 TRP HB2 1 1 10 7070 1 1 42 TRP HB3 H -1.175 6.085 0.057 1.00 . A A . 42 TRP HB3 1 1 10 7071 1 1 42 TRP HD1 H -0.869 7.692 -2.064 1.00 . A A . 42 TRP HD1 1 1 10 7072 1 1 42 TRP HE1 H -2.475 9.251 -3.276 1.00 . A A . 42 TRP HE1 1 1 10 7073 1 1 42 TRP HE3 H -5.284 5.810 -0.306 1.00 . A A . 42 TRP HE3 1 1 10 7074 1 1 42 TRP HH2 H -7.372 8.747 -2.588 1.00 . A A . 42 TRP HH2 1 1 10 7075 1 1 42 TRP HZ2 H -5.274 9.668 -3.458 1.00 . A A . 42 TRP HZ2 1 1 10 7076 1 1 42 TRP HZ3 H -7.382 6.864 -1.044 1.00 . A A . 42 TRP HZ3 1 1 10 7077 1 1 42 TRP N N -2.980 3.492 -0.860 1.00 . A A . 42 TRP N 1 1 10 7078 1 1 42 TRP NE1 N -2.783 8.544 -2.666 1.00 . A A . 42 TRP NE1 1 1 10 7079 1 1 42 TRP O O -0.622 3.417 0.750 1.00 . A A . 42 TRP O 1 1 10 7080 1 1 43 CYS C C 2.583 3.719 -0.643 1.00 . A A . 43 CYS C 1 1 10 7081 1 1 43 CYS CA C 1.448 2.754 -0.799 1.00 . A A . 43 CYS CA 1 1 10 7082 1 1 43 CYS CB C 1.768 1.583 -1.704 1.00 . A A . 43 CYS CB 1 1 10 7083 1 1 43 CYS H H 0.215 3.689 -2.197 1.00 . A A . 43 CYS H 1 1 10 7084 1 1 43 CYS HA H 1.214 2.373 0.184 1.00 . A A . 43 CYS HA 1 1 10 7085 1 1 43 CYS HB2 H 1.959 1.942 -2.705 1.00 . A A . 43 CYS HB2 1 1 10 7086 1 1 43 CYS HB3 H 2.637 1.063 -1.329 1.00 . A A . 43 CYS HB3 1 1 10 7087 1 1 43 CYS N N 0.284 3.425 -1.252 1.00 . A A . 43 CYS N 1 1 10 7088 1 1 43 CYS O O 2.906 4.494 -1.555 1.00 . A A . 43 CYS O 1 1 10 7089 1 1 43 CYS SG S 0.385 0.388 -1.768 1.00 . A A . 43 CYS SG 1 1 10 7090 1 1 44 THR C C 5.530 3.968 0.674 1.00 . A A . 44 THR C 1 1 10 7091 1 1 44 THR CA C 4.163 4.600 0.904 1.00 . A A . 44 THR CA 1 1 10 7092 1 1 44 THR CB C 3.986 4.908 2.393 1.00 . A A . 44 THR CB 1 1 10 7093 1 1 44 THR CG2 C 4.741 6.170 2.779 1.00 . A A . 44 THR CG2 1 1 10 7094 1 1 44 THR H H 2.877 3.016 1.170 1.00 . A A . 44 THR H 1 1 10 7095 1 1 44 THR HA H 4.066 5.522 0.350 1.00 . A A . 44 THR HA 1 1 10 7096 1 1 44 THR HB H 4.354 4.073 2.970 1.00 . A A . 44 THR HB 1 1 10 7097 1 1 44 THR HG1 H 2.331 6.024 2.557 1.00 . A A . 44 THR HG1 1 1 10 7098 1 1 44 THR HG21 H 4.589 6.373 3.829 1.00 . A A . 44 THR HG21 1 1 10 7099 1 1 44 THR HG22 H 4.374 7.001 2.195 1.00 . A A . 44 THR HG22 1 1 10 7100 1 1 44 THR HG23 H 5.795 6.030 2.588 1.00 . A A . 44 THR HG23 1 1 10 7101 1 1 44 THR N N 3.149 3.696 0.517 1.00 . A A . 44 THR N 1 1 10 7102 1 1 44 THR O O 5.750 2.787 0.993 1.00 . A A . 44 THR O 1 1 10 7103 1 1 44 THR OG1 O 2.585 5.092 2.656 1.00 . A A . 44 THR OG1 1 1 10 7104 1 1 45 LYS C C 8.703 5.403 0.305 1.00 . A A . 45 LYS C 1 1 10 7105 1 1 45 LYS CA C 7.761 4.301 -0.136 1.00 . A A . 45 LYS CA 1 1 10 7106 1 1 45 LYS CB C 7.953 3.962 -1.622 1.00 . A A . 45 LYS CB 1 1 10 7107 1 1 45 LYS CD C 7.825 4.718 -4.038 1.00 . A A . 45 LYS CD 1 1 10 7108 1 1 45 LYS CE C 9.258 4.323 -4.377 1.00 . A A . 45 LYS CE 1 1 10 7109 1 1 45 LYS CG C 7.667 5.116 -2.573 1.00 . A A . 45 LYS CG 1 1 10 7110 1 1 45 LYS H H 6.155 5.638 -0.159 1.00 . A A . 45 LYS H 1 1 10 7111 1 1 45 LYS HA H 7.944 3.419 0.460 1.00 . A A . 45 LYS HA 1 1 10 7112 1 1 45 LYS HB2 H 8.969 3.638 -1.776 1.00 . A A . 45 LYS HB2 1 1 10 7113 1 1 45 LYS HB3 H 7.281 3.153 -1.864 1.00 . A A . 45 LYS HB3 1 1 10 7114 1 1 45 LYS HD2 H 7.179 3.876 -4.242 1.00 . A A . 45 LYS HD2 1 1 10 7115 1 1 45 LYS HD3 H 7.531 5.550 -4.661 1.00 . A A . 45 LYS HD3 1 1 10 7116 1 1 45 LYS HE2 H 9.922 5.131 -4.106 1.00 . A A . 45 LYS HE2 1 1 10 7117 1 1 45 LYS HE3 H 9.518 3.440 -3.813 1.00 . A A . 45 LYS HE3 1 1 10 7118 1 1 45 LYS HG2 H 6.658 5.465 -2.412 1.00 . A A . 45 LYS HG2 1 1 10 7119 1 1 45 LYS HG3 H 8.363 5.911 -2.349 1.00 . A A . 45 LYS HG3 1 1 10 7120 1 1 45 LYS HZ1 H 9.173 4.874 -6.377 1.00 . A A . 45 LYS HZ1 1 1 10 7121 1 1 45 LYS HZ2 H 8.779 3.271 -6.117 1.00 . A A . 45 LYS HZ2 1 1 10 7122 1 1 45 LYS HZ3 H 10.393 3.760 -6.047 1.00 . A A . 45 LYS HZ3 1 1 10 7123 1 1 45 LYS N N 6.417 4.726 0.111 1.00 . A A . 45 LYS N 1 1 10 7124 1 1 45 LYS NZ N 9.416 4.034 -5.814 1.00 . A A . 45 LYS NZ 1 1 10 7125 1 1 45 LYS O O 8.304 6.574 0.370 1.00 . A A . 45 LYS O 1 1 10 7126 1 1 46 ASN C C 11.616 6.630 -0.086 1.00 . A A . 46 ASN C 1 1 10 7127 1 1 46 ASN CA C 10.870 6.046 1.089 1.00 . A A . 46 ASN CA 1 1 10 7128 1 1 46 ASN CB C 11.861 5.491 2.133 1.00 . A A . 46 ASN CB 1 1 10 7129 1 1 46 ASN CG C 11.199 4.969 3.405 1.00 . A A . 46 ASN CG 1 1 10 7130 1 1 46 ASN H H 10.186 4.114 0.524 1.00 . A A . 46 ASN H 1 1 10 7131 1 1 46 ASN HA H 10.294 6.842 1.538 1.00 . A A . 46 ASN HA 1 1 10 7132 1 1 46 ASN HB2 H 12.406 4.674 1.686 1.00 . A A . 46 ASN HB2 1 1 10 7133 1 1 46 ASN HB3 H 12.559 6.270 2.401 1.00 . A A . 46 ASN HB3 1 1 10 7134 1 1 46 ASN HD21 H 11.395 3.078 2.807 1.00 . A A . 46 ASN HD21 1 1 10 7135 1 1 46 ASN HD22 H 10.701 3.301 4.362 1.00 . A A . 46 ASN HD22 1 1 10 7136 1 1 46 ASN N N 9.915 5.053 0.626 1.00 . A A . 46 ASN N 1 1 10 7137 1 1 46 ASN ND2 N 11.073 3.662 3.528 1.00 . A A . 46 ASN ND2 1 1 10 7138 1 1 46 ASN O O 11.966 5.910 -1.031 1.00 . A A . 46 ASN O 1 1 10 7139 1 1 46 ASN OD1 O 10.852 5.743 4.308 1.00 . A A . 46 ASN OD1 1 1 10 7140 1 1 47 CYS C C 13.480 9.623 -0.485 1.00 . A A . 47 CYS C 1 1 10 7141 1 1 47 CYS CA C 12.487 8.642 -1.099 1.00 . A A . 47 CYS CA 1 1 10 7142 1 1 47 CYS CB C 11.465 9.408 -1.942 1.00 . A A . 47 CYS CB 1 1 10 7143 1 1 47 CYS H H 11.525 8.455 0.719 1.00 . A A . 47 CYS H 1 1 10 7144 1 1 47 CYS HA H 13.014 7.941 -1.728 1.00 . A A . 47 CYS HA 1 1 10 7145 1 1 47 CYS HB2 H 10.978 10.145 -1.322 1.00 . A A . 47 CYS HB2 1 1 10 7146 1 1 47 CYS HB3 H 11.987 9.912 -2.743 1.00 . A A . 47 CYS HB3 1 1 10 7147 1 1 47 CYS N N 11.826 7.916 -0.048 1.00 . A A . 47 CYS N 1 1 10 7148 1 1 47 CYS O O 13.052 10.652 0.093 1.00 . A A . 47 CYS O 1 1 10 7149 1 1 47 CYS OXT O 14.697 9.392 -0.590 1.00 . A A . 47 CYS OXT 1 1 10 7150 1 1 47 CYS SG S 10.157 8.382 -2.694 1.00 . A A . 47 CYS SG 1 1 11 7151 1 1 1 LYS C C 10.613 9.581 1.636 1.00 . A A . 1 LYS C 1 1 11 7152 1 1 1 LYS CA C 11.445 10.803 1.986 1.00 . A A . 1 LYS CA 1 1 11 7153 1 1 1 LYS CB C 10.896 12.039 1.230 1.00 . A A . 1 LYS CB 1 1 11 7154 1 1 1 LYS CD C 8.934 13.556 0.694 1.00 . A A . 1 LYS CD 1 1 11 7155 1 1 1 LYS CE C 9.820 14.786 0.558 1.00 . A A . 1 LYS CE 1 1 11 7156 1 1 1 LYS CG C 9.508 12.526 1.668 1.00 . A A . 1 LYS CG 1 1 11 7157 1 1 1 LYS H1 H 13.451 11.319 1.729 1.00 . A A . 1 LYS H1 1 1 11 7158 1 1 1 LYS H2 H 12.782 10.354 0.495 1.00 . A A . 1 LYS H2 1 1 11 7159 1 1 1 LYS H3 H 13.149 9.671 1.983 1.00 . A A . 1 LYS H3 1 1 11 7160 1 1 1 LYS HA H 11.437 10.979 3.051 1.00 . A A . 1 LYS HA 1 1 11 7161 1 1 1 LYS HB2 H 11.588 12.854 1.375 1.00 . A A . 1 LYS HB2 1 1 11 7162 1 1 1 LYS HB3 H 10.856 11.803 0.177 1.00 . A A . 1 LYS HB3 1 1 11 7163 1 1 1 LYS HD2 H 8.831 13.098 -0.278 1.00 . A A . 1 LYS HD2 1 1 11 7164 1 1 1 LYS HD3 H 7.959 13.860 1.047 1.00 . A A . 1 LYS HD3 1 1 11 7165 1 1 1 LYS HE2 H 9.874 15.286 1.514 1.00 . A A . 1 LYS HE2 1 1 11 7166 1 1 1 LYS HE3 H 10.809 14.471 0.261 1.00 . A A . 1 LYS HE3 1 1 11 7167 1 1 1 LYS HG2 H 8.841 11.679 1.710 1.00 . A A . 1 LYS HG2 1 1 11 7168 1 1 1 LYS HG3 H 9.586 12.970 2.649 1.00 . A A . 1 LYS HG3 1 1 11 7169 1 1 1 LYS HZ1 H 9.189 15.263 -1.371 1.00 . A A . 1 LYS HZ1 1 1 11 7170 1 1 1 LYS HZ2 H 9.954 16.525 -0.592 1.00 . A A . 1 LYS HZ2 1 1 11 7171 1 1 1 LYS HZ3 H 8.376 16.131 -0.180 1.00 . A A . 1 LYS HZ3 1 1 11 7172 1 1 1 LYS N N 12.801 10.536 1.525 1.00 . A A . 1 LYS N 1 1 11 7173 1 1 1 LYS NZ N 9.296 15.731 -0.448 1.00 . A A . 1 LYS NZ 1 1 11 7174 1 1 1 LYS O O 11.090 8.699 0.920 1.00 . A A . 1 LYS O 1 1 11 7175 1 1 2 THR C C 7.296 9.123 1.087 1.00 . A A . 2 THR C 1 1 11 7176 1 1 2 THR CA C 8.531 8.479 1.697 1.00 . A A . 2 THR CA 1 1 11 7177 1 1 2 THR CB C 8.204 7.381 2.737 1.00 . A A . 2 THR CB 1 1 11 7178 1 1 2 THR CG2 C 9.333 6.377 2.822 1.00 . A A . 2 THR CG2 1 1 11 7179 1 1 2 THR H H 9.123 10.069 2.880 1.00 . A A . 2 THR H 1 1 11 7180 1 1 2 THR HA H 9.053 8.024 0.867 1.00 . A A . 2 THR HA 1 1 11 7181 1 1 2 THR HB H 7.322 6.871 2.381 1.00 . A A . 2 THR HB 1 1 11 7182 1 1 2 THR HG1 H 7.440 8.751 3.942 1.00 . A A . 2 THR HG1 1 1 11 7183 1 1 2 THR HG21 H 10.248 6.884 3.090 1.00 . A A . 2 THR HG21 1 1 11 7184 1 1 2 THR HG22 H 9.449 5.889 1.867 1.00 . A A . 2 THR HG22 1 1 11 7185 1 1 2 THR HG23 H 9.099 5.638 3.573 1.00 . A A . 2 THR HG23 1 1 11 7186 1 1 2 THR N N 9.425 9.475 2.161 1.00 . A A . 2 THR N 1 1 11 7187 1 1 2 THR O O 6.625 9.942 1.716 1.00 . A A . 2 THR O 1 1 11 7188 1 1 2 THR OG1 O 7.943 7.932 4.037 1.00 . A A . 2 THR OG1 1 1 11 7189 1 1 3 CYS C C 4.898 8.320 -1.068 1.00 . A A . 3 CYS C 1 1 11 7190 1 1 3 CYS CA C 5.997 9.352 -0.921 1.00 . A A . 3 CYS CA 1 1 11 7191 1 1 3 CYS CB C 6.542 9.776 -2.302 1.00 . A A . 3 CYS CB 1 1 11 7192 1 1 3 CYS H H 7.608 8.080 -0.535 1.00 . A A . 3 CYS H 1 1 11 7193 1 1 3 CYS HA H 5.617 10.222 -0.407 1.00 . A A . 3 CYS HA 1 1 11 7194 1 1 3 CYS HB2 H 6.976 8.912 -2.783 1.00 . A A . 3 CYS HB2 1 1 11 7195 1 1 3 CYS HB3 H 5.722 10.137 -2.905 1.00 . A A . 3 CYS HB3 1 1 11 7196 1 1 3 CYS N N 7.054 8.788 -0.134 1.00 . A A . 3 CYS N 1 1 11 7197 1 1 3 CYS O O 5.144 7.198 -1.514 1.00 . A A . 3 CYS O 1 1 11 7198 1 1 3 CYS SG S 7.836 11.091 -2.262 1.00 . A A . 3 CYS SG 1 1 11 7199 1 1 4 GLU C C 1.799 7.966 -1.952 1.00 . A A . 4 GLU C 1 1 11 7200 1 1 4 GLU CA C 2.613 7.755 -0.694 1.00 . A A . 4 GLU CA 1 1 11 7201 1 1 4 GLU CB C 1.763 7.949 0.545 1.00 . A A . 4 GLU CB 1 1 11 7202 1 1 4 GLU CD C -0.132 7.155 1.932 1.00 . A A . 4 GLU CD 1 1 11 7203 1 1 4 GLU CG C 0.664 6.942 0.688 1.00 . A A . 4 GLU CG 1 1 11 7204 1 1 4 GLU H H 3.561 9.583 -0.346 1.00 . A A . 4 GLU H 1 1 11 7205 1 1 4 GLU HA H 2.993 6.747 -0.710 1.00 . A A . 4 GLU HA 1 1 11 7206 1 1 4 GLU HB2 H 2.392 7.893 1.422 1.00 . A A . 4 GLU HB2 1 1 11 7207 1 1 4 GLU HB3 H 1.313 8.930 0.496 1.00 . A A . 4 GLU HB3 1 1 11 7208 1 1 4 GLU HG2 H 0.020 7.059 -0.170 1.00 . A A . 4 GLU HG2 1 1 11 7209 1 1 4 GLU HG3 H 1.086 5.948 0.695 1.00 . A A . 4 GLU HG3 1 1 11 7210 1 1 4 GLU N N 3.717 8.668 -0.665 1.00 . A A . 4 GLU N 1 1 11 7211 1 1 4 GLU O O 1.272 9.054 -2.182 1.00 . A A . 4 GLU O 1 1 11 7212 1 1 4 GLU OE1 O 0.345 6.781 3.021 1.00 . A A . 4 GLU OE1 1 1 11 7213 1 1 4 GLU OE2 O -1.248 7.718 1.859 1.00 . A A . 4 GLU OE2 1 1 11 7214 1 1 5 ASN C C 0.105 5.818 -4.177 1.00 . A A . 5 ASN C 1 1 11 7215 1 1 5 ASN CA C 1.001 7.017 -4.028 1.00 . A A . 5 ASN CA 1 1 11 7216 1 1 5 ASN CB C 1.971 7.071 -5.223 1.00 . A A . 5 ASN CB 1 1 11 7217 1 1 5 ASN CG C 2.843 8.326 -5.305 1.00 . A A . 5 ASN CG 1 1 11 7218 1 1 5 ASN H H 2.086 6.074 -2.487 1.00 . A A . 5 ASN H 1 1 11 7219 1 1 5 ASN HA H 0.398 7.912 -4.022 1.00 . A A . 5 ASN HA 1 1 11 7220 1 1 5 ASN HB2 H 2.624 6.215 -5.168 1.00 . A A . 5 ASN HB2 1 1 11 7221 1 1 5 ASN HB3 H 1.390 6.999 -6.131 1.00 . A A . 5 ASN HB3 1 1 11 7222 1 1 5 ASN HD21 H 1.452 9.459 -4.432 1.00 . A A . 5 ASN HD21 1 1 11 7223 1 1 5 ASN HD22 H 2.893 10.260 -4.908 1.00 . A A . 5 ASN HD22 1 1 11 7224 1 1 5 ASN N N 1.708 6.940 -2.761 1.00 . A A . 5 ASN N 1 1 11 7225 1 1 5 ASN ND2 N 2.349 9.447 -4.833 1.00 . A A . 5 ASN ND2 1 1 11 7226 1 1 5 ASN O O 0.260 4.833 -3.455 1.00 . A A . 5 ASN O 1 1 11 7227 1 1 5 ASN OD1 O 3.975 8.273 -5.799 1.00 . A A . 5 ASN OD1 1 1 11 7228 1 1 6 LEU C C -1.124 3.528 -5.790 1.00 . A A . 6 LEU C 1 1 11 7229 1 1 6 LEU CA C -1.759 4.830 -5.358 1.00 . A A . 6 LEU CA 1 1 11 7230 1 1 6 LEU CB C -2.835 5.257 -6.345 1.00 . A A . 6 LEU CB 1 1 11 7231 1 1 6 LEU CD1 C -4.926 6.512 -6.817 1.00 . A A . 6 LEU CD1 1 1 11 7232 1 1 6 LEU CD2 C -4.743 5.184 -4.789 1.00 . A A . 6 LEU CD2 1 1 11 7233 1 1 6 LEU CG C -3.984 6.049 -5.750 1.00 . A A . 6 LEU CG 1 1 11 7234 1 1 6 LEU H H -0.884 6.720 -5.632 1.00 . A A . 6 LEU H 1 1 11 7235 1 1 6 LEU HA H -2.249 4.637 -4.416 1.00 . A A . 6 LEU HA 1 1 11 7236 1 1 6 LEU HB2 H -2.365 5.860 -7.107 1.00 . A A . 6 LEU HB2 1 1 11 7237 1 1 6 LEU HB3 H -3.236 4.369 -6.810 1.00 . A A . 6 LEU HB3 1 1 11 7238 1 1 6 LEU HD11 H -4.416 7.138 -7.533 1.00 . A A . 6 LEU HD11 1 1 11 7239 1 1 6 LEU HD12 H -5.706 7.062 -6.311 1.00 . A A . 6 LEU HD12 1 1 11 7240 1 1 6 LEU HD13 H -5.354 5.643 -7.294 1.00 . A A . 6 LEU HD13 1 1 11 7241 1 1 6 LEU HD21 H -4.120 4.906 -3.952 1.00 . A A . 6 LEU HD21 1 1 11 7242 1 1 6 LEU HD22 H -5.068 4.291 -5.300 1.00 . A A . 6 LEU HD22 1 1 11 7243 1 1 6 LEU HD23 H -5.606 5.724 -4.428 1.00 . A A . 6 LEU HD23 1 1 11 7244 1 1 6 LEU HG H -3.614 6.902 -5.202 1.00 . A A . 6 LEU HG 1 1 11 7245 1 1 6 LEU N N -0.818 5.898 -5.101 1.00 . A A . 6 LEU N 1 1 11 7246 1 1 6 LEU O O -0.148 3.498 -6.555 1.00 . A A . 6 LEU O 1 1 11 7247 1 1 7 ALA C C -1.862 0.727 -6.925 1.00 . A A . 7 ALA C 1 1 11 7248 1 1 7 ALA CA C -1.267 1.134 -5.593 1.00 . A A . 7 ALA CA 1 1 11 7249 1 1 7 ALA CB C -1.727 0.181 -4.508 1.00 . A A . 7 ALA CB 1 1 11 7250 1 1 7 ALA H H -2.414 2.591 -4.631 1.00 . A A . 7 ALA H 1 1 11 7251 1 1 7 ALA HA H -0.190 1.105 -5.644 1.00 . A A . 7 ALA HA 1 1 11 7252 1 1 7 ALA HB1 H -1.434 -0.826 -4.759 1.00 . A A . 7 ALA HB1 1 1 11 7253 1 1 7 ALA HB2 H -2.802 0.232 -4.420 1.00 . A A . 7 ALA HB2 1 1 11 7254 1 1 7 ALA HB3 H -1.277 0.464 -3.567 1.00 . A A . 7 ALA HB3 1 1 11 7255 1 1 7 ALA N N -1.680 2.464 -5.273 1.00 . A A . 7 ALA N 1 1 11 7256 1 1 7 ALA O O -3.083 0.769 -7.115 1.00 . A A . 7 ALA O 1 1 11 7257 1 1 8 ASP C C -1.516 -1.570 -9.203 1.00 . A A . 8 ASP C 1 1 11 7258 1 1 8 ASP CA C -1.457 -0.061 -9.149 1.00 . A A . 8 ASP CA 1 1 11 7259 1 1 8 ASP CB C -0.513 0.460 -10.234 1.00 . A A . 8 ASP CB 1 1 11 7260 1 1 8 ASP CG C -0.880 -0.035 -11.618 1.00 . A A . 8 ASP CG 1 1 11 7261 1 1 8 ASP H H -0.058 0.419 -7.641 1.00 . A A . 8 ASP H 1 1 11 7262 1 1 8 ASP HA H -2.443 0.339 -9.324 1.00 . A A . 8 ASP HA 1 1 11 7263 1 1 8 ASP HB2 H -0.539 1.540 -10.239 1.00 . A A . 8 ASP HB2 1 1 11 7264 1 1 8 ASP HB3 H 0.491 0.134 -10.010 1.00 . A A . 8 ASP HB3 1 1 11 7265 1 1 8 ASP N N -1.018 0.376 -7.840 1.00 . A A . 8 ASP N 1 1 11 7266 1 1 8 ASP O O -2.425 -2.151 -9.798 1.00 . A A . 8 ASP O 1 1 11 7267 1 1 8 ASP OD1 O -0.179 -0.933 -12.148 1.00 . A A . 8 ASP OD1 1 1 11 7268 1 1 8 ASP OD2 O -1.866 0.464 -12.206 1.00 . A A . 8 ASP OD2 1 1 11 7269 1 1 9 THR C C -1.493 -4.269 -7.629 1.00 . A A . 9 THR C 1 1 11 7270 1 1 9 THR CA C -0.446 -3.619 -8.567 1.00 . A A . 9 THR CA 1 1 11 7271 1 1 9 THR CB C 0.970 -3.989 -8.136 1.00 . A A . 9 THR CB 1 1 11 7272 1 1 9 THR CG2 C 1.294 -5.407 -8.534 1.00 . A A . 9 THR CG2 1 1 11 7273 1 1 9 THR H H 0.152 -1.717 -8.096 1.00 . A A . 9 THR H 1 1 11 7274 1 1 9 THR HA H -0.598 -3.974 -9.575 1.00 . A A . 9 THR HA 1 1 11 7275 1 1 9 THR HB H 1.061 -3.881 -7.066 1.00 . A A . 9 THR HB 1 1 11 7276 1 1 9 THR HG1 H 2.710 -3.132 -8.270 1.00 . A A . 9 THR HG1 1 1 11 7277 1 1 9 THR HG21 H 2.292 -5.652 -8.203 1.00 . A A . 9 THR HG21 1 1 11 7278 1 1 9 THR HG22 H 1.235 -5.479 -9.609 1.00 . A A . 9 THR HG22 1 1 11 7279 1 1 9 THR HG23 H 0.579 -6.075 -8.078 1.00 . A A . 9 THR HG23 1 1 11 7280 1 1 9 THR N N -0.560 -2.198 -8.567 1.00 . A A . 9 THR N 1 1 11 7281 1 1 9 THR O O -1.958 -5.384 -7.888 1.00 . A A . 9 THR O 1 1 11 7282 1 1 9 THR OG1 O 1.894 -3.102 -8.804 1.00 . A A . 9 THR OG1 1 1 11 7283 1 1 10 TYR C C -4.233 -4.019 -6.275 1.00 . A A . 10 TYR C 1 1 11 7284 1 1 10 TYR CA C -2.864 -4.091 -5.629 1.00 . A A . 10 TYR CA 1 1 11 7285 1 1 10 TYR CB C -2.859 -3.306 -4.304 1.00 . A A . 10 TYR CB 1 1 11 7286 1 1 10 TYR CD1 C -3.320 -4.879 -2.379 1.00 . A A . 10 TYR CD1 1 1 11 7287 1 1 10 TYR CD2 C -5.088 -3.456 -3.087 1.00 . A A . 10 TYR CD2 1 1 11 7288 1 1 10 TYR CE1 C -4.136 -5.423 -1.412 1.00 . A A . 10 TYR CE1 1 1 11 7289 1 1 10 TYR CE2 C -5.911 -3.993 -2.118 1.00 . A A . 10 TYR CE2 1 1 11 7290 1 1 10 TYR CG C -3.775 -3.890 -3.235 1.00 . A A . 10 TYR CG 1 1 11 7291 1 1 10 TYR CZ C -5.427 -4.977 -1.283 1.00 . A A . 10 TYR CZ 1 1 11 7292 1 1 10 TYR H H -1.471 -2.691 -6.397 1.00 . A A . 10 TYR H 1 1 11 7293 1 1 10 TYR HA H -2.624 -5.126 -5.435 1.00 . A A . 10 TYR HA 1 1 11 7294 1 1 10 TYR HB2 H -1.856 -3.292 -3.906 1.00 . A A . 10 TYR HB2 1 1 11 7295 1 1 10 TYR HB3 H -3.176 -2.293 -4.497 1.00 . A A . 10 TYR HB3 1 1 11 7296 1 1 10 TYR HD1 H -2.303 -5.230 -2.479 1.00 . A A . 10 TYR HD1 1 1 11 7297 1 1 10 TYR HD2 H -5.472 -2.687 -3.740 1.00 . A A . 10 TYR HD2 1 1 11 7298 1 1 10 TYR HE1 H -3.751 -6.193 -0.759 1.00 . A A . 10 TYR HE1 1 1 11 7299 1 1 10 TYR HE2 H -6.924 -3.633 -2.025 1.00 . A A . 10 TYR HE2 1 1 11 7300 1 1 10 TYR HH H -7.057 -5.806 -0.769 1.00 . A A . 10 TYR HH 1 1 11 7301 1 1 10 TYR N N -1.868 -3.570 -6.560 1.00 . A A . 10 TYR N 1 1 11 7302 1 1 10 TYR O O -4.635 -2.969 -6.782 1.00 . A A . 10 TYR O 1 1 11 7303 1 1 10 TYR OH O -6.245 -5.529 -0.328 1.00 . A A . 10 TYR OH 1 1 11 7304 1 1 11 LYS C C -7.316 -5.265 -5.866 1.00 . A A . 11 LYS C 1 1 11 7305 1 1 11 LYS CA C -6.222 -5.169 -6.912 1.00 . A A . 11 LYS CA 1 1 11 7306 1 1 11 LYS CB C -6.296 -6.340 -7.894 1.00 . A A . 11 LYS CB 1 1 11 7307 1 1 11 LYS CD C -5.142 -5.067 -9.738 1.00 . A A . 11 LYS CD 1 1 11 7308 1 1 11 LYS CE C -3.981 -5.046 -10.702 1.00 . A A . 11 LYS CE 1 1 11 7309 1 1 11 LYS CG C -5.172 -6.351 -8.927 1.00 . A A . 11 LYS CG 1 1 11 7310 1 1 11 LYS H H -4.581 -5.927 -5.852 1.00 . A A . 11 LYS H 1 1 11 7311 1 1 11 LYS HA H -6.357 -4.248 -7.459 1.00 . A A . 11 LYS HA 1 1 11 7312 1 1 11 LYS HB2 H -6.252 -7.260 -7.332 1.00 . A A . 11 LYS HB2 1 1 11 7313 1 1 11 LYS HB3 H -7.239 -6.293 -8.418 1.00 . A A . 11 LYS HB3 1 1 11 7314 1 1 11 LYS HD2 H -6.057 -4.987 -10.304 1.00 . A A . 11 LYS HD2 1 1 11 7315 1 1 11 LYS HD3 H -5.052 -4.228 -9.065 1.00 . A A . 11 LYS HD3 1 1 11 7316 1 1 11 LYS HE2 H -3.064 -5.131 -10.135 1.00 . A A . 11 LYS HE2 1 1 11 7317 1 1 11 LYS HE3 H -4.074 -5.893 -11.363 1.00 . A A . 11 LYS HE3 1 1 11 7318 1 1 11 LYS HG2 H -4.228 -6.456 -8.413 1.00 . A A . 11 LYS HG2 1 1 11 7319 1 1 11 LYS HG3 H -5.314 -7.189 -9.593 1.00 . A A . 11 LYS HG3 1 1 11 7320 1 1 11 LYS HZ1 H -4.828 -3.671 -12.024 1.00 . A A . 11 LYS HZ1 1 1 11 7321 1 1 11 LYS HZ2 H -3.151 -3.791 -12.162 1.00 . A A . 11 LYS HZ2 1 1 11 7322 1 1 11 LYS HZ3 H -3.835 -2.974 -10.861 1.00 . A A . 11 LYS HZ3 1 1 11 7323 1 1 11 LYS N N -4.929 -5.119 -6.285 1.00 . A A . 11 LYS N 1 1 11 7324 1 1 11 LYS NZ N -3.945 -3.798 -11.491 1.00 . A A . 11 LYS NZ 1 1 11 7325 1 1 11 LYS O O -7.125 -5.870 -4.790 1.00 . A A . 11 LYS O 1 1 11 7326 1 1 12 GLY C C -9.438 -3.519 -4.253 1.00 . A A . 12 GLY C 1 1 11 7327 1 1 12 GLY CA C -9.549 -4.649 -5.262 1.00 . A A . 12 GLY CA 1 1 11 7328 1 1 12 GLY H H -8.518 -4.186 -7.020 1.00 . A A . 12 GLY H 1 1 11 7329 1 1 12 GLY HA2 H -10.456 -4.538 -5.836 1.00 . A A . 12 GLY HA2 1 1 11 7330 1 1 12 GLY HA3 H -9.581 -5.590 -4.733 1.00 . A A . 12 GLY HA3 1 1 11 7331 1 1 12 GLY N N -8.437 -4.657 -6.165 1.00 . A A . 12 GLY N 1 1 11 7332 1 1 12 GLY O O -8.357 -2.940 -4.091 1.00 . A A . 12 GLY O 1 1 11 7333 1 1 13 PRO C C -9.846 -2.680 -1.273 1.00 . A A . 13 PRO C 1 1 11 7334 1 1 13 PRO CA C -10.494 -2.134 -2.539 1.00 . A A . 13 PRO CA 1 1 11 7335 1 1 13 PRO CB C -11.980 -1.817 -2.277 1.00 . A A . 13 PRO CB 1 1 11 7336 1 1 13 PRO CD C -11.888 -3.640 -3.813 1.00 . A A . 13 PRO CD 1 1 11 7337 1 1 13 PRO CG C -12.722 -2.475 -3.393 1.00 . A A . 13 PRO CG 1 1 11 7338 1 1 13 PRO HA H -9.972 -1.243 -2.856 1.00 . A A . 13 PRO HA 1 1 11 7339 1 1 13 PRO HB2 H -12.269 -2.206 -1.311 1.00 . A A . 13 PRO HB2 1 1 11 7340 1 1 13 PRO HB3 H -12.128 -0.747 -2.285 1.00 . A A . 13 PRO HB3 1 1 11 7341 1 1 13 PRO HD2 H -12.102 -4.501 -3.197 1.00 . A A . 13 PRO HD2 1 1 11 7342 1 1 13 PRO HD3 H -12.054 -3.858 -4.855 1.00 . A A . 13 PRO HD3 1 1 11 7343 1 1 13 PRO HG2 H -13.683 -2.819 -3.046 1.00 . A A . 13 PRO HG2 1 1 11 7344 1 1 13 PRO HG3 H -12.841 -1.785 -4.215 1.00 . A A . 13 PRO HG3 1 1 11 7345 1 1 13 PRO N N -10.528 -3.149 -3.586 1.00 . A A . 13 PRO N 1 1 11 7346 1 1 13 PRO O O -9.641 -3.899 -1.132 1.00 . A A . 13 PRO O 1 1 11 7347 1 1 14 CYS C C -10.003 -2.489 1.883 1.00 . A A . 14 CYS C 1 1 11 7348 1 1 14 CYS CA C -8.925 -2.191 0.864 1.00 . A A . 14 CYS CA 1 1 11 7349 1 1 14 CYS CB C -7.985 -1.103 1.384 1.00 . A A . 14 CYS CB 1 1 11 7350 1 1 14 CYS H H -9.676 -0.851 -0.551 1.00 . A A . 14 CYS H 1 1 11 7351 1 1 14 CYS HA H -8.350 -3.090 0.692 1.00 . A A . 14 CYS HA 1 1 11 7352 1 1 14 CYS HB2 H -7.147 -1.003 0.710 1.00 . A A . 14 CYS HB2 1 1 11 7353 1 1 14 CYS HB3 H -8.520 -0.166 1.427 1.00 . A A . 14 CYS HB3 1 1 11 7354 1 1 14 CYS N N -9.515 -1.806 -0.379 1.00 . A A . 14 CYS N 1 1 11 7355 1 1 14 CYS O O -10.637 -1.569 2.430 1.00 . A A . 14 CYS O 1 1 11 7356 1 1 14 CYS SG S -7.321 -1.440 3.045 1.00 . A A . 14 CYS SG 1 1 11 7357 1 1 15 PHE C C -10.444 -4.433 4.372 1.00 . A A . 15 PHE C 1 1 11 7358 1 1 15 PHE CA C -11.209 -4.203 3.088 1.00 . A A . 15 PHE CA 1 1 11 7359 1 1 15 PHE CB C -11.880 -5.516 2.656 1.00 . A A . 15 PHE CB 1 1 11 7360 1 1 15 PHE CD1 C -12.031 -6.007 0.208 1.00 . A A . 15 PHE CD1 1 1 11 7361 1 1 15 PHE CD2 C -13.783 -4.762 1.220 1.00 . A A . 15 PHE CD2 1 1 11 7362 1 1 15 PHE CE1 C -12.667 -5.920 -1.007 1.00 . A A . 15 PHE CE1 1 1 11 7363 1 1 15 PHE CE2 C -14.424 -4.672 0.008 1.00 . A A . 15 PHE CE2 1 1 11 7364 1 1 15 PHE CG C -12.582 -5.431 1.336 1.00 . A A . 15 PHE CG 1 1 11 7365 1 1 15 PHE CZ C -13.866 -5.251 -1.109 1.00 . A A . 15 PHE CZ 1 1 11 7366 1 1 15 PHE H H -9.814 -4.424 1.520 1.00 . A A . 15 PHE H 1 1 11 7367 1 1 15 PHE HA H -11.958 -3.438 3.219 1.00 . A A . 15 PHE HA 1 1 11 7368 1 1 15 PHE HB2 H -11.128 -6.287 2.581 1.00 . A A . 15 PHE HB2 1 1 11 7369 1 1 15 PHE HB3 H -12.604 -5.803 3.405 1.00 . A A . 15 PHE HB3 1 1 11 7370 1 1 15 PHE HD1 H -11.091 -6.534 0.282 1.00 . A A . 15 PHE HD1 1 1 11 7371 1 1 15 PHE HD2 H -14.223 -4.306 2.095 1.00 . A A . 15 PHE HD2 1 1 11 7372 1 1 15 PHE HE1 H -12.221 -6.376 -1.878 1.00 . A A . 15 PHE HE1 1 1 11 7373 1 1 15 PHE HE2 H -15.362 -4.143 -0.062 1.00 . A A . 15 PHE HE2 1 1 11 7374 1 1 15 PHE HZ H -14.367 -5.179 -2.063 1.00 . A A . 15 PHE HZ 1 1 11 7375 1 1 15 PHE N N -10.267 -3.757 2.082 1.00 . A A . 15 PHE N 1 1 11 7376 1 1 15 PHE O O -10.948 -4.237 5.474 1.00 . A A . 15 PHE O 1 1 11 7377 1 1 16 THR C C -7.002 -4.416 4.944 1.00 . A A . 16 THR C 1 1 11 7378 1 1 16 THR CA C -8.324 -5.116 5.269 1.00 . A A . 16 THR CA 1 1 11 7379 1 1 16 THR CB C -8.104 -6.642 5.337 1.00 . A A . 16 THR CB 1 1 11 7380 1 1 16 THR CG2 C -7.297 -7.041 6.553 1.00 . A A . 16 THR CG2 1 1 11 7381 1 1 16 THR H H -8.877 -4.952 3.292 1.00 . A A . 16 THR H 1 1 11 7382 1 1 16 THR HA H -8.733 -4.764 6.204 1.00 . A A . 16 THR HA 1 1 11 7383 1 1 16 THR HB H -7.575 -6.933 4.442 1.00 . A A . 16 THR HB 1 1 11 7384 1 1 16 THR HG1 H -9.970 -6.769 5.930 1.00 . A A . 16 THR HG1 1 1 11 7385 1 1 16 THR HG21 H -6.335 -6.549 6.526 1.00 . A A . 16 THR HG21 1 1 11 7386 1 1 16 THR HG22 H -7.153 -8.111 6.548 1.00 . A A . 16 THR HG22 1 1 11 7387 1 1 16 THR HG23 H -7.828 -6.755 7.449 1.00 . A A . 16 THR HG23 1 1 11 7388 1 1 16 THR N N -9.219 -4.833 4.204 1.00 . A A . 16 THR N 1 1 11 7389 1 1 16 THR O O -6.383 -4.701 3.902 1.00 . A A . 16 THR O 1 1 11 7390 1 1 16 THR OG1 O -9.382 -7.310 5.388 1.00 . A A . 16 THR OG1 1 1 11 7391 1 1 17 THR C C -4.149 -3.671 5.639 1.00 . A A . 17 THR C 1 1 11 7392 1 1 17 THR CA C -5.364 -2.755 5.550 1.00 . A A . 17 THR CA 1 1 11 7393 1 1 17 THR CB C -5.213 -1.477 6.461 1.00 . A A . 17 THR CB 1 1 11 7394 1 1 17 THR CG2 C -5.055 -1.838 7.927 1.00 . A A . 17 THR CG2 1 1 11 7395 1 1 17 THR H H -7.088 -3.334 6.619 1.00 . A A . 17 THR H 1 1 11 7396 1 1 17 THR HA H -5.433 -2.438 4.518 1.00 . A A . 17 THR HA 1 1 11 7397 1 1 17 THR HB H -6.103 -0.876 6.340 1.00 . A A . 17 THR HB 1 1 11 7398 1 1 17 THR HG1 H -3.830 -0.951 5.160 1.00 . A A . 17 THR HG1 1 1 11 7399 1 1 17 THR HG21 H -5.953 -2.322 8.277 1.00 . A A . 17 THR HG21 1 1 11 7400 1 1 17 THR HG22 H -4.879 -0.941 8.500 1.00 . A A . 17 THR HG22 1 1 11 7401 1 1 17 THR HG23 H -4.217 -2.510 8.040 1.00 . A A . 17 THR HG23 1 1 11 7402 1 1 17 THR N N -6.574 -3.503 5.800 1.00 . A A . 17 THR N 1 1 11 7403 1 1 17 THR O O -3.144 -3.419 4.997 1.00 . A A . 17 THR O 1 1 11 7404 1 1 17 THR OG1 O -4.082 -0.678 6.052 1.00 . A A . 17 THR OG1 1 1 11 7405 1 1 18 GLY C C -2.885 -6.338 5.133 1.00 . A A . 18 GLY C 1 1 11 7406 1 1 18 GLY CA C -3.239 -5.759 6.489 1.00 . A A . 18 GLY CA 1 1 11 7407 1 1 18 GLY H H -5.115 -4.879 6.904 1.00 . A A . 18 GLY H 1 1 11 7408 1 1 18 GLY HA2 H -2.360 -5.295 6.910 1.00 . A A . 18 GLY HA2 1 1 11 7409 1 1 18 GLY HA3 H -3.563 -6.559 7.137 1.00 . A A . 18 GLY HA3 1 1 11 7410 1 1 18 GLY N N -4.288 -4.769 6.388 1.00 . A A . 18 GLY N 1 1 11 7411 1 1 18 GLY O O -1.719 -6.394 4.775 1.00 . A A . 18 GLY O 1 1 11 7412 1 1 19 SER C C -3.040 -6.243 2.102 1.00 . A A . 19 SER C 1 1 11 7413 1 1 19 SER CA C -3.726 -7.264 3.025 1.00 . A A . 19 SER CA 1 1 11 7414 1 1 19 SER CB C -5.100 -7.618 2.467 1.00 . A A . 19 SER CB 1 1 11 7415 1 1 19 SER H H -4.828 -6.622 4.677 1.00 . A A . 19 SER H 1 1 11 7416 1 1 19 SER HA H -3.130 -8.162 3.093 1.00 . A A . 19 SER HA 1 1 11 7417 1 1 19 SER HB2 H -5.635 -6.709 2.237 1.00 . A A . 19 SER HB2 1 1 11 7418 1 1 19 SER HB3 H -4.984 -8.207 1.569 1.00 . A A . 19 SER HB3 1 1 11 7419 1 1 19 SER HG H -6.388 -8.998 2.921 1.00 . A A . 19 SER HG 1 1 11 7420 1 1 19 SER N N -3.905 -6.705 4.359 1.00 . A A . 19 SER N 1 1 11 7421 1 1 19 SER O O -2.210 -6.595 1.249 1.00 . A A . 19 SER O 1 1 11 7422 1 1 19 SER OG O -5.850 -8.367 3.419 1.00 . A A . 19 SER OG 1 1 11 7423 1 1 20 CYS C C -1.388 -3.609 1.899 1.00 . A A . 20 CYS C 1 1 11 7424 1 1 20 CYS CA C -2.848 -3.891 1.528 1.00 . A A . 20 CYS CA 1 1 11 7425 1 1 20 CYS CB C -3.719 -2.659 1.772 1.00 . A A . 20 CYS CB 1 1 11 7426 1 1 20 CYS H H -3.989 -4.787 3.046 1.00 . A A . 20 CYS H 1 1 11 7427 1 1 20 CYS HA H -2.908 -4.160 0.484 1.00 . A A . 20 CYS HA 1 1 11 7428 1 1 20 CYS HB2 H -4.746 -2.896 1.539 1.00 . A A . 20 CYS HB2 1 1 11 7429 1 1 20 CYS HB3 H -3.651 -2.388 2.816 1.00 . A A . 20 CYS HB3 1 1 11 7430 1 1 20 CYS N N -3.367 -4.989 2.315 1.00 . A A . 20 CYS N 1 1 11 7431 1 1 20 CYS O O -0.506 -3.525 1.029 1.00 . A A . 20 CYS O 1 1 11 7432 1 1 20 CYS SG S -3.271 -1.208 0.804 1.00 . A A . 20 CYS SG 1 1 11 7433 1 1 21 ASP C C 1.151 -4.362 3.385 1.00 . A A . 21 ASP C 1 1 11 7434 1 1 21 ASP CA C 0.191 -3.243 3.723 1.00 . A A . 21 ASP CA 1 1 11 7435 1 1 21 ASP CB C 0.109 -3.009 5.228 1.00 . A A . 21 ASP CB 1 1 11 7436 1 1 21 ASP CG C 1.446 -2.745 5.866 1.00 . A A . 21 ASP CG 1 1 11 7437 1 1 21 ASP H H -1.867 -3.636 3.838 1.00 . A A . 21 ASP H 1 1 11 7438 1 1 21 ASP HA H 0.560 -2.344 3.253 1.00 . A A . 21 ASP HA 1 1 11 7439 1 1 21 ASP HB2 H -0.519 -2.148 5.403 1.00 . A A . 21 ASP HB2 1 1 11 7440 1 1 21 ASP HB3 H -0.347 -3.868 5.697 1.00 . A A . 21 ASP HB3 1 1 11 7441 1 1 21 ASP N N -1.134 -3.521 3.192 1.00 . A A . 21 ASP N 1 1 11 7442 1 1 21 ASP O O 2.289 -4.115 2.977 1.00 . A A . 21 ASP O 1 1 11 7443 1 1 21 ASP OD1 O 2.052 -1.685 5.596 1.00 . A A . 21 ASP OD1 1 1 11 7444 1 1 21 ASP OD2 O 1.878 -3.565 6.711 1.00 . A A . 21 ASP OD2 1 1 11 7445 1 1 22 ASP C C 1.875 -6.727 1.680 1.00 . A A . 22 ASP C 1 1 11 7446 1 1 22 ASP CA C 1.420 -6.782 3.127 1.00 . A A . 22 ASP CA 1 1 11 7447 1 1 22 ASP CB C 0.557 -8.021 3.328 1.00 . A A . 22 ASP CB 1 1 11 7448 1 1 22 ASP CG C 1.205 -9.286 2.840 1.00 . A A . 22 ASP CG 1 1 11 7449 1 1 22 ASP H H -0.263 -5.691 3.813 1.00 . A A . 22 ASP H 1 1 11 7450 1 1 22 ASP HA H 2.280 -6.847 3.777 1.00 . A A . 22 ASP HA 1 1 11 7451 1 1 22 ASP HB2 H 0.315 -8.133 4.374 1.00 . A A . 22 ASP HB2 1 1 11 7452 1 1 22 ASP HB3 H -0.354 -7.877 2.769 1.00 . A A . 22 ASP HB3 1 1 11 7453 1 1 22 ASP N N 0.654 -5.584 3.474 1.00 . A A . 22 ASP N 1 1 11 7454 1 1 22 ASP O O 3.033 -7.045 1.365 1.00 . A A . 22 ASP O 1 1 11 7455 1 1 22 ASP OD1 O 2.090 -9.819 3.534 1.00 . A A . 22 ASP OD1 1 1 11 7456 1 1 22 ASP OD2 O 0.814 -9.790 1.774 1.00 . A A . 22 ASP OD2 1 1 11 7457 1 1 23 HIS C C 2.317 -5.097 -0.830 1.00 . A A . 23 HIS C 1 1 11 7458 1 1 23 HIS CA C 1.265 -6.171 -0.585 1.00 . A A . 23 HIS CA 1 1 11 7459 1 1 23 HIS CB C -0.018 -5.874 -1.384 1.00 . A A . 23 HIS CB 1 1 11 7460 1 1 23 HIS CD2 C 0.459 -4.535 -3.540 1.00 . A A . 23 HIS CD2 1 1 11 7461 1 1 23 HIS CE1 C 0.470 -6.147 -4.977 1.00 . A A . 23 HIS CE1 1 1 11 7462 1 1 23 HIS CG C 0.206 -5.671 -2.856 1.00 . A A . 23 HIS CG 1 1 11 7463 1 1 23 HIS H H 0.095 -6.026 1.154 1.00 . A A . 23 HIS H 1 1 11 7464 1 1 23 HIS HA H 1.665 -7.118 -0.914 1.00 . A A . 23 HIS HA 1 1 11 7465 1 1 23 HIS HB2 H -0.710 -6.696 -1.270 1.00 . A A . 23 HIS HB2 1 1 11 7466 1 1 23 HIS HB3 H -0.472 -4.978 -0.990 1.00 . A A . 23 HIS HB3 1 1 11 7467 1 1 23 HIS HD1 H 0.049 -7.638 -3.620 1.00 . A A . 23 HIS HD1 1 1 11 7468 1 1 23 HIS HD2 H 0.519 -3.548 -3.105 1.00 . A A . 23 HIS HD2 1 1 11 7469 1 1 23 HIS HE1 H 0.545 -6.715 -5.894 1.00 . A A . 23 HIS HE1 1 1 11 7470 1 1 23 HIS N N 0.980 -6.287 0.821 1.00 . A A . 23 HIS N 1 1 11 7471 1 1 23 HIS ND1 N 0.211 -6.681 -3.784 1.00 . A A . 23 HIS ND1 1 1 11 7472 1 1 23 HIS NE2 N 0.628 -4.835 -4.884 1.00 . A A . 23 HIS NE2 1 1 11 7473 1 1 23 HIS O O 3.351 -5.368 -1.443 1.00 . A A . 23 HIS O 1 1 11 7474 1 1 24 CYS C C 4.382 -3.115 0.015 1.00 . A A . 24 CYS C 1 1 11 7475 1 1 24 CYS CA C 2.988 -2.797 -0.561 1.00 . A A . 24 CYS CA 1 1 11 7476 1 1 24 CYS CB C 2.435 -1.470 -0.013 1.00 . A A . 24 CYS CB 1 1 11 7477 1 1 24 CYS H H 1.237 -3.744 0.166 1.00 . A A . 24 CYS H 1 1 11 7478 1 1 24 CYS HA H 3.099 -2.711 -1.632 1.00 . A A . 24 CYS HA 1 1 11 7479 1 1 24 CYS HB2 H 2.376 -1.533 1.063 1.00 . A A . 24 CYS HB2 1 1 11 7480 1 1 24 CYS HB3 H 3.112 -0.671 -0.280 1.00 . A A . 24 CYS HB3 1 1 11 7481 1 1 24 CYS N N 2.067 -3.896 -0.341 1.00 . A A . 24 CYS N 1 1 11 7482 1 1 24 CYS O O 5.382 -2.839 -0.629 1.00 . A A . 24 CYS O 1 1 11 7483 1 1 24 CYS SG S 0.756 -1.018 -0.632 1.00 . A A . 24 CYS SG 1 1 11 7484 1 1 25 LYS C C 6.427 -5.253 1.040 1.00 . A A . 25 LYS C 1 1 11 7485 1 1 25 LYS CA C 5.728 -4.128 1.789 1.00 . A A . 25 LYS CA 1 1 11 7486 1 1 25 LYS CB C 5.610 -4.575 3.246 1.00 . A A . 25 LYS CB 1 1 11 7487 1 1 25 LYS CD C 5.368 -4.131 5.650 1.00 . A A . 25 LYS CD 1 1 11 7488 1 1 25 LYS CE C 4.984 -3.161 6.741 1.00 . A A . 25 LYS CE 1 1 11 7489 1 1 25 LYS CG C 5.254 -3.525 4.261 1.00 . A A . 25 LYS CG 1 1 11 7490 1 1 25 LYS H H 3.610 -3.987 1.667 1.00 . A A . 25 LYS H 1 1 11 7491 1 1 25 LYS HA H 6.362 -3.253 1.758 1.00 . A A . 25 LYS HA 1 1 11 7492 1 1 25 LYS HB2 H 4.847 -5.337 3.302 1.00 . A A . 25 LYS HB2 1 1 11 7493 1 1 25 LYS HB3 H 6.552 -5.018 3.535 1.00 . A A . 25 LYS HB3 1 1 11 7494 1 1 25 LYS HD2 H 4.720 -4.991 5.710 1.00 . A A . 25 LYS HD2 1 1 11 7495 1 1 25 LYS HD3 H 6.389 -4.448 5.805 1.00 . A A . 25 LYS HD3 1 1 11 7496 1 1 25 LYS HE2 H 3.969 -2.840 6.563 1.00 . A A . 25 LYS HE2 1 1 11 7497 1 1 25 LYS HE3 H 5.027 -3.678 7.689 1.00 . A A . 25 LYS HE3 1 1 11 7498 1 1 25 LYS HG2 H 5.934 -2.691 4.168 1.00 . A A . 25 LYS HG2 1 1 11 7499 1 1 25 LYS HG3 H 4.237 -3.198 4.101 1.00 . A A . 25 LYS HG3 1 1 11 7500 1 1 25 LYS HZ1 H 5.515 -1.335 7.546 1.00 . A A . 25 LYS HZ1 1 1 11 7501 1 1 25 LYS HZ2 H 5.860 -1.435 5.906 1.00 . A A . 25 LYS HZ2 1 1 11 7502 1 1 25 LYS HZ3 H 6.834 -2.234 7.042 1.00 . A A . 25 LYS HZ3 1 1 11 7503 1 1 25 LYS N N 4.439 -3.758 1.189 1.00 . A A . 25 LYS N 1 1 11 7504 1 1 25 LYS NZ N 5.859 -1.973 6.799 1.00 . A A . 25 LYS NZ 1 1 11 7505 1 1 25 LYS O O 7.522 -5.074 0.539 1.00 . A A . 25 LYS O 1 1 11 7506 1 1 26 ASN C C 6.500 -7.674 -1.038 1.00 . A A . 26 ASN C 1 1 11 7507 1 1 26 ASN CA C 6.457 -7.606 0.460 1.00 . A A . 26 ASN CA 1 1 11 7508 1 1 26 ASN CB C 5.819 -8.897 1.014 1.00 . A A . 26 ASN CB 1 1 11 7509 1 1 26 ASN CG C 5.851 -8.991 2.531 1.00 . A A . 26 ASN CG 1 1 11 7510 1 1 26 ASN H H 4.839 -6.449 1.218 1.00 . A A . 26 ASN H 1 1 11 7511 1 1 26 ASN HA H 7.477 -7.567 0.814 1.00 . A A . 26 ASN HA 1 1 11 7512 1 1 26 ASN HB2 H 4.786 -8.935 0.701 1.00 . A A . 26 ASN HB2 1 1 11 7513 1 1 26 ASN HB3 H 6.341 -9.749 0.605 1.00 . A A . 26 ASN HB3 1 1 11 7514 1 1 26 ASN HD21 H 4.006 -8.272 2.653 1.00 . A A . 26 ASN HD21 1 1 11 7515 1 1 26 ASN HD22 H 4.761 -8.661 4.149 1.00 . A A . 26 ASN HD22 1 1 11 7516 1 1 26 ASN N N 5.785 -6.401 0.955 1.00 . A A . 26 ASN N 1 1 11 7517 1 1 26 ASN ND2 N 4.775 -8.600 3.171 1.00 . A A . 26 ASN ND2 1 1 11 7518 1 1 26 ASN O O 7.534 -7.969 -1.621 1.00 . A A . 26 ASN O 1 1 11 7519 1 1 26 ASN OD1 O 6.826 -9.460 3.119 1.00 . A A . 26 ASN OD1 1 1 11 7520 1 1 27 LYS C C 6.016 -6.396 -3.811 1.00 . A A . 27 LYS C 1 1 11 7521 1 1 27 LYS CA C 5.302 -7.519 -3.098 1.00 . A A . 27 LYS CA 1 1 11 7522 1 1 27 LYS CB C 3.837 -7.577 -3.532 1.00 . A A . 27 LYS CB 1 1 11 7523 1 1 27 LYS CD C 3.623 -10.069 -3.509 1.00 . A A . 27 LYS CD 1 1 11 7524 1 1 27 LYS CE C 2.841 -11.255 -2.997 1.00 . A A . 27 LYS CE 1 1 11 7525 1 1 27 LYS CG C 3.066 -8.764 -2.982 1.00 . A A . 27 LYS CG 1 1 11 7526 1 1 27 LYS H H 4.625 -7.038 -1.166 1.00 . A A . 27 LYS H 1 1 11 7527 1 1 27 LYS HA H 5.770 -8.453 -3.366 1.00 . A A . 27 LYS HA 1 1 11 7528 1 1 27 LYS HB2 H 3.345 -6.676 -3.199 1.00 . A A . 27 LYS HB2 1 1 11 7529 1 1 27 LYS HB3 H 3.798 -7.615 -4.609 1.00 . A A . 27 LYS HB3 1 1 11 7530 1 1 27 LYS HD2 H 3.567 -10.059 -4.587 1.00 . A A . 27 LYS HD2 1 1 11 7531 1 1 27 LYS HD3 H 4.652 -10.167 -3.202 1.00 . A A . 27 LYS HD3 1 1 11 7532 1 1 27 LYS HE2 H 2.913 -11.270 -1.919 1.00 . A A . 27 LYS HE2 1 1 11 7533 1 1 27 LYS HE3 H 1.807 -11.152 -3.290 1.00 . A A . 27 LYS HE3 1 1 11 7534 1 1 27 LYS HG2 H 3.141 -8.761 -1.905 1.00 . A A . 27 LYS HG2 1 1 11 7535 1 1 27 LYS HG3 H 2.031 -8.672 -3.274 1.00 . A A . 27 LYS HG3 1 1 11 7536 1 1 27 LYS HZ1 H 3.376 -12.502 -4.564 1.00 . A A . 27 LYS HZ1 1 1 11 7537 1 1 27 LYS HZ2 H 2.774 -13.314 -3.219 1.00 . A A . 27 LYS HZ2 1 1 11 7538 1 1 27 LYS HZ3 H 4.339 -12.690 -3.188 1.00 . A A . 27 LYS HZ3 1 1 11 7539 1 1 27 LYS N N 5.398 -7.380 -1.665 1.00 . A A . 27 LYS N 1 1 11 7540 1 1 27 LYS NZ N 3.370 -12.520 -3.524 1.00 . A A . 27 LYS NZ 1 1 11 7541 1 1 27 LYS O O 6.878 -6.630 -4.671 1.00 . A A . 27 LYS O 1 1 11 7542 1 1 28 GLU C C 7.524 -3.509 -3.465 1.00 . A A . 28 GLU C 1 1 11 7543 1 1 28 GLU CA C 6.246 -4.045 -4.115 1.00 . A A . 28 GLU CA 1 1 11 7544 1 1 28 GLU CB C 5.175 -2.969 -4.223 1.00 . A A . 28 GLU CB 1 1 11 7545 1 1 28 GLU CD C 4.103 -3.943 -6.317 1.00 . A A . 28 GLU CD 1 1 11 7546 1 1 28 GLU CG C 3.892 -3.446 -4.899 1.00 . A A . 28 GLU CG 1 1 11 7547 1 1 28 GLU H H 5.099 -5.073 -2.667 1.00 . A A . 28 GLU H 1 1 11 7548 1 1 28 GLU HA H 6.495 -4.369 -5.114 1.00 . A A . 28 GLU HA 1 1 11 7549 1 1 28 GLU HB2 H 4.923 -2.634 -3.228 1.00 . A A . 28 GLU HB2 1 1 11 7550 1 1 28 GLU HB3 H 5.568 -2.137 -4.789 1.00 . A A . 28 GLU HB3 1 1 11 7551 1 1 28 GLU HG2 H 3.471 -4.252 -4.317 1.00 . A A . 28 GLU HG2 1 1 11 7552 1 1 28 GLU HG3 H 3.194 -2.621 -4.922 1.00 . A A . 28 GLU HG3 1 1 11 7553 1 1 28 GLU N N 5.716 -5.191 -3.422 1.00 . A A . 28 GLU N 1 1 11 7554 1 1 28 GLU O O 8.175 -2.623 -4.016 1.00 . A A . 28 GLU O 1 1 11 7555 1 1 28 GLU OE1 O 3.983 -3.142 -7.258 1.00 . A A . 28 GLU OE1 1 1 11 7556 1 1 28 GLU OE2 O 4.382 -5.136 -6.517 1.00 . A A . 28 GLU OE2 1 1 11 7557 1 1 29 HIS C C 9.062 -2.243 -1.057 1.00 . A A . 29 HIS C 1 1 11 7558 1 1 29 HIS CA C 9.103 -3.687 -1.541 1.00 . A A . 29 HIS CA 1 1 11 7559 1 1 29 HIS CB C 10.395 -3.962 -2.335 1.00 . A A . 29 HIS CB 1 1 11 7560 1 1 29 HIS CD2 C 10.221 -6.224 -3.574 1.00 . A A . 29 HIS CD2 1 1 11 7561 1 1 29 HIS CE1 C 11.497 -7.423 -2.295 1.00 . A A . 29 HIS CE1 1 1 11 7562 1 1 29 HIS CG C 10.660 -5.414 -2.582 1.00 . A A . 29 HIS CG 1 1 11 7563 1 1 29 HIS H H 7.313 -4.769 -1.925 1.00 . A A . 29 HIS H 1 1 11 7564 1 1 29 HIS HA H 9.100 -4.315 -0.663 1.00 . A A . 29 HIS HA 1 1 11 7565 1 1 29 HIS HB2 H 10.327 -3.475 -3.297 1.00 . A A . 29 HIS HB2 1 1 11 7566 1 1 29 HIS HB3 H 11.236 -3.554 -1.793 1.00 . A A . 29 HIS HB3 1 1 11 7567 1 1 29 HIS HD1 H 11.940 -5.905 -0.965 1.00 . A A . 29 HIS HD1 1 1 11 7568 1 1 29 HIS HD2 H 9.561 -5.932 -4.379 1.00 . A A . 29 HIS HD2 1 1 11 7569 1 1 29 HIS HE1 H 12.049 -8.249 -1.872 1.00 . A A . 29 HIS HE1 1 1 11 7570 1 1 29 HIS N N 7.881 -4.065 -2.301 1.00 . A A . 29 HIS N 1 1 11 7571 1 1 29 HIS ND1 N 11.467 -6.194 -1.780 1.00 . A A . 29 HIS ND1 1 1 11 7572 1 1 29 HIS NE2 N 10.755 -7.496 -3.392 1.00 . A A . 29 HIS NE2 1 1 11 7573 1 1 29 HIS O O 10.102 -1.603 -0.837 1.00 . A A . 29 HIS O 1 1 11 7574 1 1 30 LEU C C 7.586 -0.348 1.116 1.00 . A A . 30 LEU C 1 1 11 7575 1 1 30 LEU CA C 7.679 -0.396 -0.415 1.00 . A A . 30 LEU CA 1 1 11 7576 1 1 30 LEU CB C 6.411 0.160 -1.082 1.00 . A A . 30 LEU CB 1 1 11 7577 1 1 30 LEU CD1 C 5.048 0.521 -3.186 1.00 . A A . 30 LEU CD1 1 1 11 7578 1 1 30 LEU CD2 C 7.546 0.519 -3.337 1.00 . A A . 30 LEU CD2 1 1 11 7579 1 1 30 LEU CG C 6.328 -0.045 -2.613 1.00 . A A . 30 LEU CG 1 1 11 7580 1 1 30 LEU H H 7.097 -2.349 -0.906 1.00 . A A . 30 LEU H 1 1 11 7581 1 1 30 LEU HA H 8.535 0.181 -0.732 1.00 . A A . 30 LEU HA 1 1 11 7582 1 1 30 LEU HB2 H 5.557 -0.318 -0.627 1.00 . A A . 30 LEU HB2 1 1 11 7583 1 1 30 LEU HB3 H 6.356 1.220 -0.883 1.00 . A A . 30 LEU HB3 1 1 11 7584 1 1 30 LEU HD11 H 4.211 -0.027 -2.776 1.00 . A A . 30 LEU HD11 1 1 11 7585 1 1 30 LEU HD12 H 5.052 0.421 -4.261 1.00 . A A . 30 LEU HD12 1 1 11 7586 1 1 30 LEU HD13 H 4.947 1.562 -2.922 1.00 . A A . 30 LEU HD13 1 1 11 7587 1 1 30 LEU HD21 H 8.430 -0.006 -3.007 1.00 . A A . 30 LEU HD21 1 1 11 7588 1 1 30 LEU HD22 H 7.653 1.567 -3.113 1.00 . A A . 30 LEU HD22 1 1 11 7589 1 1 30 LEU HD23 H 7.428 0.386 -4.403 1.00 . A A . 30 LEU HD23 1 1 11 7590 1 1 30 LEU HG H 6.301 -1.111 -2.790 1.00 . A A . 30 LEU HG 1 1 11 7591 1 1 30 LEU N N 7.879 -1.757 -0.829 1.00 . A A . 30 LEU N 1 1 11 7592 1 1 30 LEU O O 7.750 -1.378 1.780 1.00 . A A . 30 LEU O 1 1 11 7593 1 1 31 ARG C C 6.033 0.446 3.759 1.00 . A A . 31 ARG C 1 1 11 7594 1 1 31 ARG CA C 7.304 0.983 3.114 1.00 . A A . 31 ARG CA 1 1 11 7595 1 1 31 ARG CB C 7.531 2.454 3.500 1.00 . A A . 31 ARG CB 1 1 11 7596 1 1 31 ARG CD C 7.672 4.173 5.321 1.00 . A A . 31 ARG CD 1 1 11 7597 1 1 31 ARG CG C 7.435 2.719 4.992 1.00 . A A . 31 ARG CG 1 1 11 7598 1 1 31 ARG CZ C 7.742 5.582 7.357 1.00 . A A . 31 ARG CZ 1 1 11 7599 1 1 31 ARG H H 7.056 1.580 1.111 1.00 . A A . 31 ARG H 1 1 11 7600 1 1 31 ARG HA H 8.131 0.405 3.497 1.00 . A A . 31 ARG HA 1 1 11 7601 1 1 31 ARG HB2 H 8.513 2.754 3.165 1.00 . A A . 31 ARG HB2 1 1 11 7602 1 1 31 ARG HB3 H 6.793 3.061 2.998 1.00 . A A . 31 ARG HB3 1 1 11 7603 1 1 31 ARG HD2 H 8.691 4.414 5.061 1.00 . A A . 31 ARG HD2 1 1 11 7604 1 1 31 ARG HD3 H 6.988 4.790 4.758 1.00 . A A . 31 ARG HD3 1 1 11 7605 1 1 31 ARG HE H 7.178 3.659 7.262 1.00 . A A . 31 ARG HE 1 1 11 7606 1 1 31 ARG HG2 H 6.448 2.441 5.333 1.00 . A A . 31 ARG HG2 1 1 11 7607 1 1 31 ARG HG3 H 8.171 2.117 5.503 1.00 . A A . 31 ARG HG3 1 1 11 7608 1 1 31 ARG HH11 H 8.246 6.692 5.675 1.00 . A A . 31 ARG HH11 1 1 11 7609 1 1 31 ARG HH12 H 8.335 7.521 7.145 1.00 . A A . 31 ARG HH12 1 1 11 7610 1 1 31 ARG HH21 H 7.279 4.876 9.217 1.00 . A A . 31 ARG HH21 1 1 11 7611 1 1 31 ARG HH22 H 7.750 6.514 9.165 1.00 . A A . 31 ARG HH22 1 1 11 7612 1 1 31 ARG N N 7.305 0.814 1.671 1.00 . A A . 31 ARG N 1 1 11 7613 1 1 31 ARG NE N 7.497 4.431 6.739 1.00 . A A . 31 ARG NE 1 1 11 7614 1 1 31 ARG NH1 N 8.126 6.661 6.671 1.00 . A A . 31 ARG NH1 1 1 11 7615 1 1 31 ARG NH2 N 7.578 5.660 8.665 1.00 . A A . 31 ARG NH2 1 1 11 7616 1 1 31 ARG O O 6.094 -0.444 4.593 1.00 . A A . 31 ARG O 1 1 11 7617 1 1 32 SER C C 2.506 0.668 3.028 1.00 . A A . 32 SER C 1 1 11 7618 1 1 32 SER CA C 3.658 0.565 3.995 1.00 . A A . 32 SER CA 1 1 11 7619 1 1 32 SER CB C 3.402 1.432 5.249 1.00 . A A . 32 SER CB 1 1 11 7620 1 1 32 SER H H 4.861 1.622 2.646 1.00 . A A . 32 SER H 1 1 11 7621 1 1 32 SER HA H 3.762 -0.463 4.313 1.00 . A A . 32 SER HA 1 1 11 7622 1 1 32 SER HB2 H 2.417 1.221 5.639 1.00 . A A . 32 SER HB2 1 1 11 7623 1 1 32 SER HB3 H 4.143 1.191 5.996 1.00 . A A . 32 SER HB3 1 1 11 7624 1 1 32 SER HG H 2.996 3.068 4.163 1.00 . A A . 32 SER HG 1 1 11 7625 1 1 32 SER N N 4.897 0.966 3.373 1.00 . A A . 32 SER N 1 1 11 7626 1 1 32 SER O O 2.606 1.372 2.020 1.00 . A A . 32 SER O 1 1 11 7627 1 1 32 SER OG O 3.486 2.839 4.966 1.00 . A A . 32 SER OG 1 1 11 7628 1 1 33 GLY C C -0.822 0.647 3.342 1.00 . A A . 33 GLY C 1 1 11 7629 1 1 33 GLY CA C 0.259 0.063 2.509 1.00 . A A . 33 GLY CA 1 1 11 7630 1 1 33 GLY H H 1.475 -0.646 4.085 1.00 . A A . 33 GLY H 1 1 11 7631 1 1 33 GLY HA2 H 0.463 0.727 1.682 1.00 . A A . 33 GLY HA2 1 1 11 7632 1 1 33 GLY HA3 H -0.056 -0.891 2.118 1.00 . A A . 33 GLY HA3 1 1 11 7633 1 1 33 GLY N N 1.453 -0.041 3.304 1.00 . A A . 33 GLY N 1 1 11 7634 1 1 33 GLY O O -1.361 -0.017 4.237 1.00 . A A . 33 GLY O 1 1 11 7635 1 1 34 ARG C C -3.330 2.810 3.162 1.00 . A A . 34 ARG C 1 1 11 7636 1 1 34 ARG CA C -2.046 2.577 3.922 1.00 . A A . 34 ARG CA 1 1 11 7637 1 1 34 ARG CB C -1.421 3.878 4.443 1.00 . A A . 34 ARG CB 1 1 11 7638 1 1 34 ARG CD C 0.478 4.934 5.745 1.00 . A A . 34 ARG CD 1 1 11 7639 1 1 34 ARG CG C -0.111 3.644 5.211 1.00 . A A . 34 ARG CG 1 1 11 7640 1 1 34 ARG CZ C 2.221 5.461 7.466 1.00 . A A . 34 ARG CZ 1 1 11 7641 1 1 34 ARG H H -0.744 2.350 2.323 1.00 . A A . 34 ARG H 1 1 11 7642 1 1 34 ARG HA H -2.267 1.938 4.764 1.00 . A A . 34 ARG HA 1 1 11 7643 1 1 34 ARG HB2 H -1.216 4.527 3.603 1.00 . A A . 34 ARG HB2 1 1 11 7644 1 1 34 ARG HB3 H -2.121 4.365 5.105 1.00 . A A . 34 ARG HB3 1 1 11 7645 1 1 34 ARG HD2 H 0.614 5.619 4.921 1.00 . A A . 34 ARG HD2 1 1 11 7646 1 1 34 ARG HD3 H -0.219 5.357 6.450 1.00 . A A . 34 ARG HD3 1 1 11 7647 1 1 34 ARG HE H 2.342 4.019 6.035 1.00 . A A . 34 ARG HE 1 1 11 7648 1 1 34 ARG HG2 H -0.306 2.987 6.046 1.00 . A A . 34 ARG HG2 1 1 11 7649 1 1 34 ARG HG3 H 0.602 3.176 4.548 1.00 . A A . 34 ARG HG3 1 1 11 7650 1 1 34 ARG HH11 H 0.523 6.596 7.665 1.00 . A A . 34 ARG HH11 1 1 11 7651 1 1 34 ARG HH12 H 1.725 6.946 8.798 1.00 . A A . 34 ARG HH12 1 1 11 7652 1 1 34 ARG HH21 H 4.054 4.532 7.617 1.00 . A A . 34 ARG HH21 1 1 11 7653 1 1 34 ARG HH22 H 3.776 5.766 8.759 1.00 . A A . 34 ARG HH22 1 1 11 7654 1 1 34 ARG N N -1.118 1.881 3.104 1.00 . A A . 34 ARG N 1 1 11 7655 1 1 34 ARG NE N 1.780 4.732 6.422 1.00 . A A . 34 ARG NE 1 1 11 7656 1 1 34 ARG NH1 N 1.445 6.398 8.006 1.00 . A A . 34 ARG NH1 1 1 11 7657 1 1 34 ARG NH2 N 3.433 5.237 7.976 1.00 . A A . 34 ARG NH2 1 1 11 7658 1 1 34 ARG O O -3.325 3.224 1.997 1.00 . A A . 34 ARG O 1 1 11 7659 1 1 35 CYS C C -6.302 3.947 3.564 1.00 . A A . 35 CYS C 1 1 11 7660 1 1 35 CYS CA C -5.695 2.629 3.185 1.00 . A A . 35 CYS CA 1 1 11 7661 1 1 35 CYS CB C -6.564 1.454 3.606 1.00 . A A . 35 CYS CB 1 1 11 7662 1 1 35 CYS H H -4.358 2.212 4.728 1.00 . A A . 35 CYS H 1 1 11 7663 1 1 35 CYS HA H -5.571 2.614 2.112 1.00 . A A . 35 CYS HA 1 1 11 7664 1 1 35 CYS HB2 H -6.751 1.507 4.669 1.00 . A A . 35 CYS HB2 1 1 11 7665 1 1 35 CYS HB3 H -7.501 1.490 3.071 1.00 . A A . 35 CYS HB3 1 1 11 7666 1 1 35 CYS N N -4.410 2.514 3.795 1.00 . A A . 35 CYS N 1 1 11 7667 1 1 35 CYS O O -6.264 4.355 4.728 1.00 . A A . 35 CYS O 1 1 11 7668 1 1 35 CYS SG S -5.781 -0.152 3.242 1.00 . A A . 35 CYS SG 1 1 11 7669 1 1 36 ARG C C -8.854 5.952 2.736 1.00 . A A . 36 ARG C 1 1 11 7670 1 1 36 ARG CA C -7.337 5.958 2.811 1.00 . A A . 36 ARG CA 1 1 11 7671 1 1 36 ARG CB C -6.707 6.949 1.834 1.00 . A A . 36 ARG CB 1 1 11 7672 1 1 36 ARG CD C -4.799 7.580 3.344 1.00 . A A . 36 ARG CD 1 1 11 7673 1 1 36 ARG CG C -5.189 7.066 1.975 1.00 . A A . 36 ARG CG 1 1 11 7674 1 1 36 ARG CZ C -2.782 7.647 4.766 1.00 . A A . 36 ARG CZ 1 1 11 7675 1 1 36 ARG H H -6.824 4.254 1.690 1.00 . A A . 36 ARG H 1 1 11 7676 1 1 36 ARG HA H -7.072 6.248 3.816 1.00 . A A . 36 ARG HA 1 1 11 7677 1 1 36 ARG HB2 H -6.919 6.602 0.834 1.00 . A A . 36 ARG HB2 1 1 11 7678 1 1 36 ARG HB3 H -7.143 7.925 1.983 1.00 . A A . 36 ARG HB3 1 1 11 7679 1 1 36 ARG HD2 H -5.133 8.603 3.432 1.00 . A A . 36 ARG HD2 1 1 11 7680 1 1 36 ARG HD3 H -5.281 6.983 4.103 1.00 . A A . 36 ARG HD3 1 1 11 7681 1 1 36 ARG HE H -2.778 7.404 2.777 1.00 . A A . 36 ARG HE 1 1 11 7682 1 1 36 ARG HG2 H -4.750 6.089 1.834 1.00 . A A . 36 ARG HG2 1 1 11 7683 1 1 36 ARG HG3 H -4.817 7.741 1.219 1.00 . A A . 36 ARG HG3 1 1 11 7684 1 1 36 ARG HH11 H -4.483 8.156 5.803 1.00 . A A . 36 ARG HH11 1 1 11 7685 1 1 36 ARG HH12 H -3.056 8.033 6.739 1.00 . A A . 36 ARG HH12 1 1 11 7686 1 1 36 ARG HH21 H -0.899 7.283 4.083 1.00 . A A . 36 ARG HH21 1 1 11 7687 1 1 36 ARG HH22 H -1.026 7.592 5.767 1.00 . A A . 36 ARG HH22 1 1 11 7688 1 1 36 ARG N N -6.804 4.643 2.591 1.00 . A A . 36 ARG N 1 1 11 7689 1 1 36 ARG NE N -3.358 7.542 3.570 1.00 . A A . 36 ARG NE 1 1 11 7690 1 1 36 ARG NH1 N -3.499 7.968 5.841 1.00 . A A . 36 ARG NH1 1 1 11 7691 1 1 36 ARG NH2 N -1.488 7.489 4.881 1.00 . A A . 36 ARG NH2 1 1 11 7692 1 1 36 ARG O O -9.460 4.895 2.529 1.00 . A A . 36 ARG O 1 1 11 7693 1 1 37 ASP C C -11.652 6.754 1.784 1.00 . A A . 37 ASP C 1 1 11 7694 1 1 37 ASP CA C -10.902 7.334 2.973 1.00 . A A . 37 ASP CA 1 1 11 7695 1 1 37 ASP CB C -11.200 8.828 3.098 1.00 . A A . 37 ASP CB 1 1 11 7696 1 1 37 ASP CG C -12.676 9.147 3.081 1.00 . A A . 37 ASP CG 1 1 11 7697 1 1 37 ASP H H -8.874 7.913 3.019 1.00 . A A . 37 ASP H 1 1 11 7698 1 1 37 ASP HA H -11.260 6.853 3.871 1.00 . A A . 37 ASP HA 1 1 11 7699 1 1 37 ASP HB2 H -10.791 9.194 4.029 1.00 . A A . 37 ASP HB2 1 1 11 7700 1 1 37 ASP HB3 H -10.727 9.349 2.278 1.00 . A A . 37 ASP HB3 1 1 11 7701 1 1 37 ASP N N -9.440 7.120 2.914 1.00 . A A . 37 ASP N 1 1 11 7702 1 1 37 ASP O O -12.731 6.192 1.937 1.00 . A A . 37 ASP O 1 1 11 7703 1 1 37 ASP OD1 O -13.366 8.879 4.086 1.00 . A A . 37 ASP OD1 1 1 11 7704 1 1 37 ASP OD2 O -13.158 9.714 2.086 1.00 . A A . 37 ASP OD2 1 1 11 7705 1 1 38 ASP C C -11.556 4.819 -0.753 1.00 . A A . 38 ASP C 1 1 11 7706 1 1 38 ASP CA C -11.702 6.353 -0.618 1.00 . A A . 38 ASP CA 1 1 11 7707 1 1 38 ASP CB C -11.128 7.089 -1.847 1.00 . A A . 38 ASP CB 1 1 11 7708 1 1 38 ASP CG C -11.856 6.784 -3.153 1.00 . A A . 38 ASP CG 1 1 11 7709 1 1 38 ASP H H -10.188 7.292 0.557 1.00 . A A . 38 ASP H 1 1 11 7710 1 1 38 ASP HA H -12.755 6.580 -0.536 1.00 . A A . 38 ASP HA 1 1 11 7711 1 1 38 ASP HB2 H -11.188 8.153 -1.674 1.00 . A A . 38 ASP HB2 1 1 11 7712 1 1 38 ASP HB3 H -10.090 6.814 -1.961 1.00 . A A . 38 ASP HB3 1 1 11 7713 1 1 38 ASP N N -11.062 6.849 0.610 1.00 . A A . 38 ASP N 1 1 11 7714 1 1 38 ASP O O -11.891 4.238 -1.768 1.00 . A A . 38 ASP O 1 1 11 7715 1 1 38 ASP OD1 O -13.101 6.919 -3.206 1.00 . A A . 38 ASP OD1 1 1 11 7716 1 1 38 ASP OD2 O -11.184 6.489 -4.175 1.00 . A A . 38 ASP OD2 1 1 11 7717 1 1 39 PHE C C -9.880 2.124 -0.583 1.00 . A A . 39 PHE C 1 1 11 7718 1 1 39 PHE CA C -10.869 2.708 0.407 1.00 . A A . 39 PHE CA 1 1 11 7719 1 1 39 PHE CB C -12.212 1.959 0.360 1.00 . A A . 39 PHE CB 1 1 11 7720 1 1 39 PHE CD1 C -12.843 1.498 2.730 1.00 . A A . 39 PHE CD1 1 1 11 7721 1 1 39 PHE CD2 C -14.083 3.135 1.539 1.00 . A A . 39 PHE CD2 1 1 11 7722 1 1 39 PHE CE1 C -13.616 1.714 3.848 1.00 . A A . 39 PHE CE1 1 1 11 7723 1 1 39 PHE CE2 C -14.861 3.358 2.652 1.00 . A A . 39 PHE CE2 1 1 11 7724 1 1 39 PHE CG C -13.066 2.204 1.565 1.00 . A A . 39 PHE CG 1 1 11 7725 1 1 39 PHE CZ C -14.629 2.647 3.810 1.00 . A A . 39 PHE CZ 1 1 11 7726 1 1 39 PHE H H -10.749 4.728 1.066 1.00 . A A . 39 PHE H 1 1 11 7727 1 1 39 PHE HA H -10.438 2.546 1.385 1.00 . A A . 39 PHE HA 1 1 11 7728 1 1 39 PHE HB2 H -12.764 2.280 -0.511 1.00 . A A . 39 PHE HB2 1 1 11 7729 1 1 39 PHE HB3 H -12.021 0.899 0.289 1.00 . A A . 39 PHE HB3 1 1 11 7730 1 1 39 PHE HD1 H -12.049 0.764 2.752 1.00 . A A . 39 PHE HD1 1 1 11 7731 1 1 39 PHE HD2 H -14.269 3.694 0.633 1.00 . A A . 39 PHE HD2 1 1 11 7732 1 1 39 PHE HE1 H -13.428 1.153 4.750 1.00 . A A . 39 PHE HE1 1 1 11 7733 1 1 39 PHE HE2 H -15.653 4.090 2.615 1.00 . A A . 39 PHE HE2 1 1 11 7734 1 1 39 PHE HZ H -15.241 2.821 4.684 1.00 . A A . 39 PHE HZ 1 1 11 7735 1 1 39 PHE N N -11.031 4.181 0.301 1.00 . A A . 39 PHE N 1 1 11 7736 1 1 39 PHE O O -9.702 0.907 -0.662 1.00 . A A . 39 PHE O 1 1 11 7737 1 1 40 ARG C C -6.873 2.498 -1.506 1.00 . A A . 40 ARG C 1 1 11 7738 1 1 40 ARG CA C -8.230 2.537 -2.227 1.00 . A A . 40 ARG CA 1 1 11 7739 1 1 40 ARG CB C -8.218 3.466 -3.454 1.00 . A A . 40 ARG CB 1 1 11 7740 1 1 40 ARG CD C -7.766 1.687 -5.187 1.00 . A A . 40 ARG CD 1 1 11 7741 1 1 40 ARG CG C -7.323 3.009 -4.591 1.00 . A A . 40 ARG CG 1 1 11 7742 1 1 40 ARG CZ C -6.696 -0.048 -6.606 1.00 . A A . 40 ARG CZ 1 1 11 7743 1 1 40 ARG H H -9.415 3.922 -1.188 1.00 . A A . 40 ARG H 1 1 11 7744 1 1 40 ARG HA H -8.493 1.535 -2.531 1.00 . A A . 40 ARG HA 1 1 11 7745 1 1 40 ARG HB2 H -9.224 3.539 -3.839 1.00 . A A . 40 ARG HB2 1 1 11 7746 1 1 40 ARG HB3 H -7.892 4.446 -3.141 1.00 . A A . 40 ARG HB3 1 1 11 7747 1 1 40 ARG HD2 H -7.882 0.957 -4.400 1.00 . A A . 40 ARG HD2 1 1 11 7748 1 1 40 ARG HD3 H -8.705 1.828 -5.700 1.00 . A A . 40 ARG HD3 1 1 11 7749 1 1 40 ARG HE H -6.109 1.869 -6.410 1.00 . A A . 40 ARG HE 1 1 11 7750 1 1 40 ARG HG2 H -7.328 3.756 -5.370 1.00 . A A . 40 ARG HG2 1 1 11 7751 1 1 40 ARG HG3 H -6.319 2.899 -4.208 1.00 . A A . 40 ARG HG3 1 1 11 7752 1 1 40 ARG HH11 H -8.457 -0.703 -5.797 1.00 . A A . 40 ARG HH11 1 1 11 7753 1 1 40 ARG HH12 H -7.612 -1.864 -6.702 1.00 . A A . 40 ARG HH12 1 1 11 7754 1 1 40 ARG HH21 H -4.937 0.256 -7.586 1.00 . A A . 40 ARG HH21 1 1 11 7755 1 1 40 ARG HH22 H -5.541 -1.329 -7.715 1.00 . A A . 40 ARG HH22 1 1 11 7756 1 1 40 ARG N N -9.216 2.972 -1.298 1.00 . A A . 40 ARG N 1 1 11 7757 1 1 40 ARG NE N -6.778 1.200 -6.137 1.00 . A A . 40 ARG NE 1 1 11 7758 1 1 40 ARG NH1 N -7.646 -0.927 -6.347 1.00 . A A . 40 ARG NH1 1 1 11 7759 1 1 40 ARG NH2 N -5.666 -0.396 -7.356 1.00 . A A . 40 ARG NH2 1 1 11 7760 1 1 40 ARG O O -6.701 3.144 -0.447 1.00 . A A . 40 ARG O 1 1 11 7761 1 1 41 CYS C C -3.641 2.582 -1.871 1.00 . A A . 41 CYS C 1 1 11 7762 1 1 41 CYS CA C -4.652 1.577 -1.430 1.00 . A A . 41 CYS CA 1 1 11 7763 1 1 41 CYS CB C -4.121 0.179 -1.655 1.00 . A A . 41 CYS CB 1 1 11 7764 1 1 41 CYS H H -6.093 1.326 -2.911 1.00 . A A . 41 CYS H 1 1 11 7765 1 1 41 CYS HA H -4.795 1.698 -0.367 1.00 . A A . 41 CYS HA 1 1 11 7766 1 1 41 CYS HB2 H -4.368 -0.136 -2.658 1.00 . A A . 41 CYS HB2 1 1 11 7767 1 1 41 CYS HB3 H -3.047 0.182 -1.539 1.00 . A A . 41 CYS HB3 1 1 11 7768 1 1 41 CYS N N -5.941 1.756 -2.046 1.00 . A A . 41 CYS N 1 1 11 7769 1 1 41 CYS O O -3.442 2.809 -3.070 1.00 . A A . 41 CYS O 1 1 11 7770 1 1 41 CYS SG S -4.792 -1.037 -0.522 1.00 . A A . 41 CYS SG 1 1 11 7771 1 1 42 TRP C C -0.698 3.504 -0.491 1.00 . A A . 42 TRP C 1 1 11 7772 1 1 42 TRP CA C -1.960 4.095 -1.103 1.00 . A A . 42 TRP CA 1 1 11 7773 1 1 42 TRP CB C -2.297 5.427 -0.447 1.00 . A A . 42 TRP CB 1 1 11 7774 1 1 42 TRP CD1 C -2.166 7.456 -1.997 1.00 . A A . 42 TRP CD1 1 1 11 7775 1 1 42 TRP CD2 C -4.252 6.702 -1.703 1.00 . A A . 42 TRP CD2 1 1 11 7776 1 1 42 TRP CE2 C -4.294 7.831 -2.544 1.00 . A A . 42 TRP CE2 1 1 11 7777 1 1 42 TRP CE3 C -5.451 6.061 -1.393 1.00 . A A . 42 TRP CE3 1 1 11 7778 1 1 42 TRP CG C -2.870 6.483 -1.355 1.00 . A A . 42 TRP CG 1 1 11 7779 1 1 42 TRP CH2 C -6.641 7.679 -2.739 1.00 . A A . 42 TRP CH2 1 1 11 7780 1 1 42 TRP CZ2 C -5.487 8.328 -3.066 1.00 . A A . 42 TRP CZ2 1 1 11 7781 1 1 42 TRP CZ3 C -6.632 6.556 -1.913 1.00 . A A . 42 TRP CZ3 1 1 11 7782 1 1 42 TRP H H -3.262 2.993 0.030 1.00 . A A . 42 TRP H 1 1 11 7783 1 1 42 TRP HA H -1.818 4.241 -2.163 1.00 . A A . 42 TRP HA 1 1 11 7784 1 1 42 TRP HB2 H -3.033 5.240 0.321 1.00 . A A . 42 TRP HB2 1 1 11 7785 1 1 42 TRP HB3 H -1.411 5.819 0.025 1.00 . A A . 42 TRP HB3 1 1 11 7786 1 1 42 TRP HD1 H -1.092 7.571 -1.938 1.00 . A A . 42 TRP HD1 1 1 11 7787 1 1 42 TRP HE1 H -2.737 9.048 -3.238 1.00 . A A . 42 TRP HE1 1 1 11 7788 1 1 42 TRP HE3 H -5.464 5.184 -0.767 1.00 . A A . 42 TRP HE3 1 1 11 7789 1 1 42 TRP HH2 H -7.587 8.033 -3.124 1.00 . A A . 42 TRP HH2 1 1 11 7790 1 1 42 TRP HZ2 H -5.517 9.196 -3.708 1.00 . A A . 42 TRP HZ2 1 1 11 7791 1 1 42 TRP HZ3 H -7.570 6.074 -1.681 1.00 . A A . 42 TRP HZ3 1 1 11 7792 1 1 42 TRP N N -3.022 3.177 -0.906 1.00 . A A . 42 TRP N 1 1 11 7793 1 1 42 TRP NE1 N -3.015 8.275 -2.699 1.00 . A A . 42 TRP NE1 1 1 11 7794 1 1 42 TRP O O -0.585 3.373 0.733 1.00 . A A . 42 TRP O 1 1 11 7795 1 1 43 CYS C C 2.442 3.641 -0.585 1.00 . A A . 43 CYS C 1 1 11 7796 1 1 43 CYS CA C 1.440 2.531 -0.847 1.00 . A A . 43 CYS CA 1 1 11 7797 1 1 43 CYS CB C 2.042 1.544 -1.855 1.00 . A A . 43 CYS CB 1 1 11 7798 1 1 43 CYS H H 0.095 3.266 -2.282 1.00 . A A . 43 CYS H 1 1 11 7799 1 1 43 CYS HA H 1.228 2.012 0.077 1.00 . A A . 43 CYS HA 1 1 11 7800 1 1 43 CYS HB2 H 2.261 2.079 -2.766 1.00 . A A . 43 CYS HB2 1 1 11 7801 1 1 43 CYS HB3 H 2.971 1.174 -1.446 1.00 . A A . 43 CYS HB3 1 1 11 7802 1 1 43 CYS N N 0.219 3.110 -1.320 1.00 . A A . 43 CYS N 1 1 11 7803 1 1 43 CYS O O 2.735 4.465 -1.469 1.00 . A A . 43 CYS O 1 1 11 7804 1 1 43 CYS SG S 1.015 0.095 -2.329 1.00 . A A . 43 CYS SG 1 1 11 7805 1 1 44 THR C C 5.270 4.074 0.503 1.00 . A A . 44 THR C 1 1 11 7806 1 1 44 THR CA C 3.923 4.620 0.997 1.00 . A A . 44 THR CA 1 1 11 7807 1 1 44 THR CB C 3.926 4.703 2.528 1.00 . A A . 44 THR CB 1 1 11 7808 1 1 44 THR CG2 C 4.523 6.019 2.997 1.00 . A A . 44 THR CG2 1 1 11 7809 1 1 44 THR H H 2.610 3.040 1.278 1.00 . A A . 44 THR H 1 1 11 7810 1 1 44 THR HA H 3.722 5.591 0.578 1.00 . A A . 44 THR HA 1 1 11 7811 1 1 44 THR HB H 4.505 3.880 2.923 1.00 . A A . 44 THR HB 1 1 11 7812 1 1 44 THR HG1 H 2.047 5.397 2.792 1.00 . A A . 44 THR HG1 1 1 11 7813 1 1 44 THR HG21 H 3.936 6.841 2.612 1.00 . A A . 44 THR HG21 1 1 11 7814 1 1 44 THR HG22 H 5.533 6.096 2.628 1.00 . A A . 44 THR HG22 1 1 11 7815 1 1 44 THR HG23 H 4.528 6.051 4.076 1.00 . A A . 44 THR HG23 1 1 11 7816 1 1 44 THR N N 2.931 3.684 0.606 1.00 . A A . 44 THR N 1 1 11 7817 1 1 44 THR O O 5.732 3.040 0.987 1.00 . A A . 44 THR O 1 1 11 7818 1 1 44 THR OG1 O 2.559 4.603 3.007 1.00 . A A . 44 THR OG1 1 1 11 7819 1 1 45 LYS C C 8.241 5.152 -0.846 1.00 . A A . 45 LYS C 1 1 11 7820 1 1 45 LYS CA C 7.088 4.206 -1.061 1.00 . A A . 45 LYS CA 1 1 11 7821 1 1 45 LYS CB C 6.901 3.837 -2.534 1.00 . A A . 45 LYS CB 1 1 11 7822 1 1 45 LYS CD C 6.046 4.352 -4.815 1.00 . A A . 45 LYS CD 1 1 11 7823 1 1 45 LYS CE C 5.485 5.401 -5.757 1.00 . A A . 45 LYS CE 1 1 11 7824 1 1 45 LYS CG C 6.336 4.918 -3.431 1.00 . A A . 45 LYS CG 1 1 11 7825 1 1 45 LYS H H 5.476 5.542 -0.837 1.00 . A A . 45 LYS H 1 1 11 7826 1 1 45 LYS HA H 7.322 3.301 -0.517 1.00 . A A . 45 LYS HA 1 1 11 7827 1 1 45 LYS HB2 H 7.866 3.568 -2.937 1.00 . A A . 45 LYS HB2 1 1 11 7828 1 1 45 LYS HB3 H 6.248 2.981 -2.585 1.00 . A A . 45 LYS HB3 1 1 11 7829 1 1 45 LYS HD2 H 6.959 3.957 -5.231 1.00 . A A . 45 LYS HD2 1 1 11 7830 1 1 45 LYS HD3 H 5.328 3.551 -4.713 1.00 . A A . 45 LYS HD3 1 1 11 7831 1 1 45 LYS HE2 H 5.200 4.925 -6.683 1.00 . A A . 45 LYS HE2 1 1 11 7832 1 1 45 LYS HE3 H 4.612 5.839 -5.297 1.00 . A A . 45 LYS HE3 1 1 11 7833 1 1 45 LYS HG2 H 5.420 5.292 -2.998 1.00 . A A . 45 LYS HG2 1 1 11 7834 1 1 45 LYS HG3 H 7.053 5.719 -3.518 1.00 . A A . 45 LYS HG3 1 1 11 7835 1 1 45 LYS HZ1 H 7.277 6.076 -6.555 1.00 . A A . 45 LYS HZ1 1 1 11 7836 1 1 45 LYS HZ2 H 6.817 6.921 -5.188 1.00 . A A . 45 LYS HZ2 1 1 11 7837 1 1 45 LYS HZ3 H 6.017 7.193 -6.664 1.00 . A A . 45 LYS HZ3 1 1 11 7838 1 1 45 LYS N N 5.855 4.704 -0.485 1.00 . A A . 45 LYS N 1 1 11 7839 1 1 45 LYS NZ N 6.456 6.474 -6.055 1.00 . A A . 45 LYS NZ 1 1 11 7840 1 1 45 LYS O O 8.041 6.295 -0.471 1.00 . A A . 45 LYS O 1 1 11 7841 1 1 46 ASN C C 10.923 6.416 -1.953 1.00 . A A . 46 ASN C 1 1 11 7842 1 1 46 ASN CA C 10.621 5.474 -0.813 1.00 . A A . 46 ASN CA 1 1 11 7843 1 1 46 ASN CB C 11.857 4.599 -0.516 1.00 . A A . 46 ASN CB 1 1 11 7844 1 1 46 ASN CG C 11.721 3.730 0.732 1.00 . A A . 46 ASN CG 1 1 11 7845 1 1 46 ASN H H 9.548 3.785 -1.465 1.00 . A A . 46 ASN H 1 1 11 7846 1 1 46 ASN HA H 10.417 6.074 0.061 1.00 . A A . 46 ASN HA 1 1 11 7847 1 1 46 ASN HB2 H 12.037 3.946 -1.358 1.00 . A A . 46 ASN HB2 1 1 11 7848 1 1 46 ASN HB3 H 12.715 5.244 -0.391 1.00 . A A . 46 ASN HB3 1 1 11 7849 1 1 46 ASN HD21 H 11.068 2.214 -0.357 1.00 . A A . 46 ASN HD21 1 1 11 7850 1 1 46 ASN HD22 H 11.206 1.898 1.328 1.00 . A A . 46 ASN HD22 1 1 11 7851 1 1 46 ASN N N 9.437 4.681 -1.078 1.00 . A A . 46 ASN N 1 1 11 7852 1 1 46 ASN ND2 N 11.284 2.502 0.558 1.00 . A A . 46 ASN ND2 1 1 11 7853 1 1 46 ASN O O 10.867 6.037 -3.136 1.00 . A A . 46 ASN O 1 1 11 7854 1 1 46 ASN OD1 O 12.039 4.160 1.846 1.00 . A A . 46 ASN OD1 1 1 11 7855 1 1 47 CYS C C 12.827 9.298 -1.931 1.00 . A A . 47 CYS C 1 1 11 7856 1 1 47 CYS CA C 11.604 8.634 -2.519 1.00 . A A . 47 CYS CA 1 1 11 7857 1 1 47 CYS CB C 10.464 9.630 -2.858 1.00 . A A . 47 CYS CB 1 1 11 7858 1 1 47 CYS H H 11.124 7.908 -0.665 1.00 . A A . 47 CYS H 1 1 11 7859 1 1 47 CYS HA H 11.916 8.119 -3.416 1.00 . A A . 47 CYS HA 1 1 11 7860 1 1 47 CYS HB2 H 10.900 10.503 -3.320 1.00 . A A . 47 CYS HB2 1 1 11 7861 1 1 47 CYS HB3 H 9.783 9.173 -3.557 1.00 . A A . 47 CYS HB3 1 1 11 7862 1 1 47 CYS N N 11.186 7.626 -1.606 1.00 . A A . 47 CYS N 1 1 11 7863 1 1 47 CYS O O 12.705 10.261 -1.154 1.00 . A A . 47 CYS O 1 1 11 7864 1 1 47 CYS OXT O 13.934 8.774 -2.162 1.00 . A A . 47 CYS OXT 1 1 11 7865 1 1 47 CYS SG S 9.487 10.226 -1.439 1.00 . A A . 47 CYS SG 1 1 12 7866 1 1 1 LYS C C 10.628 9.990 0.921 1.00 . A A . 1 LYS C 1 1 12 7867 1 1 1 LYS CA C 11.593 11.085 1.263 1.00 . A A . 1 LYS CA 1 1 12 7868 1 1 1 LYS CB C 11.191 12.407 0.552 1.00 . A A . 1 LYS CB 1 1 12 7869 1 1 1 LYS CD C 9.566 13.216 2.327 1.00 . A A . 1 LYS CD 1 1 12 7870 1 1 1 LYS CE C 8.164 13.727 2.619 1.00 . A A . 1 LYS CE 1 1 12 7871 1 1 1 LYS CG C 9.774 12.935 0.848 1.00 . A A . 1 LYS CG 1 1 12 7872 1 1 1 LYS H1 H 13.640 11.384 1.025 1.00 . A A . 1 LYS H1 1 1 12 7873 1 1 1 LYS H2 H 12.897 10.508 -0.229 1.00 . A A . 1 LYS H2 1 1 12 7874 1 1 1 LYS H3 H 13.196 9.767 1.243 1.00 . A A . 1 LYS H3 1 1 12 7875 1 1 1 LYS HA H 11.609 11.231 2.331 1.00 . A A . 1 LYS HA 1 1 12 7876 1 1 1 LYS HB2 H 11.891 13.172 0.848 1.00 . A A . 1 LYS HB2 1 1 12 7877 1 1 1 LYS HB3 H 11.281 12.258 -0.515 1.00 . A A . 1 LYS HB3 1 1 12 7878 1 1 1 LYS HD2 H 9.701 12.285 2.857 1.00 . A A . 1 LYS HD2 1 1 12 7879 1 1 1 LYS HD3 H 10.292 13.940 2.663 1.00 . A A . 1 LYS HD3 1 1 12 7880 1 1 1 LYS HE2 H 8.027 14.675 2.122 1.00 . A A . 1 LYS HE2 1 1 12 7881 1 1 1 LYS HE3 H 7.445 13.015 2.240 1.00 . A A . 1 LYS HE3 1 1 12 7882 1 1 1 LYS HG2 H 9.618 13.851 0.297 1.00 . A A . 1 LYS HG2 1 1 12 7883 1 1 1 LYS HG3 H 9.056 12.195 0.524 1.00 . A A . 1 LYS HG3 1 1 12 7884 1 1 1 LYS HZ1 H 6.965 14.224 4.256 1.00 . A A . 1 LYS HZ1 1 1 12 7885 1 1 1 LYS HZ2 H 8.584 14.626 4.468 1.00 . A A . 1 LYS HZ2 1 1 12 7886 1 1 1 LYS HZ3 H 8.092 13.025 4.594 1.00 . A A . 1 LYS HZ3 1 1 12 7887 1 1 1 LYS N N 12.921 10.668 0.804 1.00 . A A . 1 LYS N 1 1 12 7888 1 1 1 LYS NZ N 7.940 13.914 4.074 1.00 . A A . 1 LYS NZ 1 1 12 7889 1 1 1 LYS O O 10.786 9.354 -0.083 1.00 . A A . 1 LYS O 1 1 12 7890 1 1 2 THR C C 7.448 9.420 0.895 1.00 . A A . 2 THR C 1 1 12 7891 1 1 2 THR CA C 8.701 8.750 1.422 1.00 . A A . 2 THR CA 1 1 12 7892 1 1 2 THR CB C 8.431 7.770 2.575 1.00 . A A . 2 THR CB 1 1 12 7893 1 1 2 THR CG2 C 9.487 6.688 2.609 1.00 . A A . 2 THR CG2 1 1 12 7894 1 1 2 THR H H 9.587 10.174 2.626 1.00 . A A . 2 THR H 1 1 12 7895 1 1 2 THR HA H 9.122 8.197 0.594 1.00 . A A . 2 THR HA 1 1 12 7896 1 1 2 THR HB H 7.468 7.309 2.413 1.00 . A A . 2 THR HB 1 1 12 7897 1 1 2 THR HG1 H 7.609 8.996 3.847 1.00 . A A . 2 THR HG1 1 1 12 7898 1 1 2 THR HG21 H 9.437 6.103 1.702 1.00 . A A . 2 THR HG21 1 1 12 7899 1 1 2 THR HG22 H 9.319 6.053 3.465 1.00 . A A . 2 THR HG22 1 1 12 7900 1 1 2 THR HG23 H 10.462 7.143 2.689 1.00 . A A . 2 THR HG23 1 1 12 7901 1 1 2 THR N N 9.680 9.722 1.760 1.00 . A A . 2 THR N 1 1 12 7902 1 1 2 THR O O 7.019 10.446 1.408 1.00 . A A . 2 THR O 1 1 12 7903 1 1 2 THR OG1 O 8.415 8.458 3.829 1.00 . A A . 2 THR OG1 1 1 12 7904 1 1 3 CYS C C 4.607 8.509 -0.717 1.00 . A A . 3 CYS C 1 1 12 7905 1 1 3 CYS CA C 5.779 9.458 -0.819 1.00 . A A . 3 CYS CA 1 1 12 7906 1 1 3 CYS CB C 6.114 9.677 -2.293 1.00 . A A . 3 CYS CB 1 1 12 7907 1 1 3 CYS H H 7.293 8.041 -0.503 1.00 . A A . 3 CYS H 1 1 12 7908 1 1 3 CYS HA H 5.540 10.409 -0.367 1.00 . A A . 3 CYS HA 1 1 12 7909 1 1 3 CYS HB2 H 6.194 8.717 -2.782 1.00 . A A . 3 CYS HB2 1 1 12 7910 1 1 3 CYS HB3 H 5.326 10.249 -2.758 1.00 . A A . 3 CYS HB3 1 1 12 7911 1 1 3 CYS N N 6.916 8.879 -0.155 1.00 . A A . 3 CYS N 1 1 12 7912 1 1 3 CYS O O 4.773 7.291 -0.877 1.00 . A A . 3 CYS O 1 1 12 7913 1 1 3 CYS SG S 7.684 10.542 -2.599 1.00 . A A . 3 CYS SG 1 1 12 7914 1 1 4 GLU C C 1.557 8.299 -1.708 1.00 . A A . 4 GLU C 1 1 12 7915 1 1 4 GLU CA C 2.262 8.240 -0.358 1.00 . A A . 4 GLU CA 1 1 12 7916 1 1 4 GLU CB C 1.355 8.771 0.746 1.00 . A A . 4 GLU CB 1 1 12 7917 1 1 4 GLU CD C -0.757 8.494 2.058 1.00 . A A . 4 GLU CD 1 1 12 7918 1 1 4 GLU CG C 0.107 7.952 0.961 1.00 . A A . 4 GLU CG 1 1 12 7919 1 1 4 GLU H H 3.368 10.002 -0.278 1.00 . A A . 4 GLU H 1 1 12 7920 1 1 4 GLU HA H 2.542 7.219 -0.140 1.00 . A A . 4 GLU HA 1 1 12 7921 1 1 4 GLU HB2 H 1.906 8.798 1.674 1.00 . A A . 4 GLU HB2 1 1 12 7922 1 1 4 GLU HB3 H 1.056 9.774 0.483 1.00 . A A . 4 GLU HB3 1 1 12 7923 1 1 4 GLU HG2 H -0.457 7.971 0.041 1.00 . A A . 4 GLU HG2 1 1 12 7924 1 1 4 GLU HG3 H 0.388 6.935 1.196 1.00 . A A . 4 GLU HG3 1 1 12 7925 1 1 4 GLU N N 3.449 9.036 -0.434 1.00 . A A . 4 GLU N 1 1 12 7926 1 1 4 GLU O O 1.050 9.352 -2.108 1.00 . A A . 4 GLU O 1 1 12 7927 1 1 4 GLU OE1 O -1.815 9.115 1.775 1.00 . A A . 4 GLU OE1 1 1 12 7928 1 1 4 GLU OE2 O -0.404 8.322 3.222 1.00 . A A . 4 GLU OE2 1 1 12 7929 1 1 5 ASN C C 0.163 5.913 -3.920 1.00 . A A . 5 ASN C 1 1 12 7930 1 1 5 ASN CA C 0.940 7.174 -3.739 1.00 . A A . 5 ASN CA 1 1 12 7931 1 1 5 ASN CB C 1.958 7.324 -4.884 1.00 . A A . 5 ASN CB 1 1 12 7932 1 1 5 ASN CG C 2.583 8.705 -4.974 1.00 . A A . 5 ASN CG 1 1 12 7933 1 1 5 ASN H H 1.968 6.384 -2.074 1.00 . A A . 5 ASN H 1 1 12 7934 1 1 5 ASN HA H 0.251 8.005 -3.782 1.00 . A A . 5 ASN HA 1 1 12 7935 1 1 5 ASN HB2 H 2.753 6.608 -4.738 1.00 . A A . 5 ASN HB2 1 1 12 7936 1 1 5 ASN HB3 H 1.463 7.109 -5.819 1.00 . A A . 5 ASN HB3 1 1 12 7937 1 1 5 ASN HD21 H 1.099 9.341 -6.120 1.00 . A A . 5 ASN HD21 1 1 12 7938 1 1 5 ASN HD22 H 2.348 10.482 -5.817 1.00 . A A . 5 ASN HD22 1 1 12 7939 1 1 5 ASN N N 1.563 7.208 -2.427 1.00 . A A . 5 ASN N 1 1 12 7940 1 1 5 ASN ND2 N 1.946 9.598 -5.693 1.00 . A A . 5 ASN ND2 1 1 12 7941 1 1 5 ASN O O 0.345 4.950 -3.175 1.00 . A A . 5 ASN O 1 1 12 7942 1 1 5 ASN OD1 O 3.625 8.971 -4.374 1.00 . A A . 5 ASN OD1 1 1 12 7943 1 1 6 LEU C C -0.768 3.559 -5.629 1.00 . A A . 6 LEU C 1 1 12 7944 1 1 6 LEU CA C -1.530 4.787 -5.191 1.00 . A A . 6 LEU CA 1 1 12 7945 1 1 6 LEU CB C -2.609 5.137 -6.214 1.00 . A A . 6 LEU CB 1 1 12 7946 1 1 6 LEU CD1 C -4.721 6.337 -6.785 1.00 . A A . 6 LEU CD1 1 1 12 7947 1 1 6 LEU CD2 C -4.402 5.392 -4.555 1.00 . A A . 6 LEU CD2 1 1 12 7948 1 1 6 LEU CG C -3.713 6.046 -5.706 1.00 . A A . 6 LEU CG 1 1 12 7949 1 1 6 LEU H H -0.770 6.725 -5.448 1.00 . A A . 6 LEU H 1 1 12 7950 1 1 6 LEU HA H -2.031 4.545 -4.266 1.00 . A A . 6 LEU HA 1 1 12 7951 1 1 6 LEU HB2 H -2.133 5.616 -7.056 1.00 . A A . 6 LEU HB2 1 1 12 7952 1 1 6 LEU HB3 H -3.060 4.217 -6.555 1.00 . A A . 6 LEU HB3 1 1 12 7953 1 1 6 LEU HD11 H -4.252 6.844 -7.614 1.00 . A A . 6 LEU HD11 1 1 12 7954 1 1 6 LEU HD12 H -5.495 6.949 -6.345 1.00 . A A . 6 LEU HD12 1 1 12 7955 1 1 6 LEU HD13 H -5.153 5.401 -7.108 1.00 . A A . 6 LEU HD13 1 1 12 7956 1 1 6 LEU HD21 H -4.723 4.405 -4.849 1.00 . A A . 6 LEU HD21 1 1 12 7957 1 1 6 LEU HD22 H -5.266 5.982 -4.287 1.00 . A A . 6 LEU HD22 1 1 12 7958 1 1 6 LEU HD23 H -3.745 5.326 -3.702 1.00 . A A . 6 LEU HD23 1 1 12 7959 1 1 6 LEU HG H -3.295 6.977 -5.356 1.00 . A A . 6 LEU HG 1 1 12 7960 1 1 6 LEU N N -0.691 5.915 -4.900 1.00 . A A . 6 LEU N 1 1 12 7961 1 1 6 LEU O O 0.211 3.632 -6.395 1.00 . A A . 6 LEU O 1 1 12 7962 1 1 7 ALA C C -1.403 0.756 -6.755 1.00 . A A . 7 ALA C 1 1 12 7963 1 1 7 ALA CA C -0.699 1.160 -5.478 1.00 . A A . 7 ALA CA 1 1 12 7964 1 1 7 ALA CB C -0.983 0.161 -4.377 1.00 . A A . 7 ALA CB 1 1 12 7965 1 1 7 ALA H H -1.885 2.507 -4.396 1.00 . A A . 7 ALA H 1 1 12 7966 1 1 7 ALA HA H 0.365 1.222 -5.642 1.00 . A A . 7 ALA HA 1 1 12 7967 1 1 7 ALA HB1 H -0.627 -0.817 -4.663 1.00 . A A . 7 ALA HB1 1 1 12 7968 1 1 7 ALA HB2 H -2.050 0.127 -4.207 1.00 . A A . 7 ALA HB2 1 1 12 7969 1 1 7 ALA HB3 H -0.492 0.484 -3.471 1.00 . A A . 7 ALA HB3 1 1 12 7970 1 1 7 ALA N N -1.196 2.447 -5.097 1.00 . A A . 7 ALA N 1 1 12 7971 1 1 7 ALA O O -2.642 0.828 -6.832 1.00 . A A . 7 ALA O 1 1 12 7972 1 1 8 ASP C C -1.580 -1.435 -9.131 1.00 . A A . 8 ASP C 1 1 12 7973 1 1 8 ASP CA C -1.231 0.030 -9.040 1.00 . A A . 8 ASP CA 1 1 12 7974 1 1 8 ASP CB C -0.312 0.423 -10.194 1.00 . A A . 8 ASP CB 1 1 12 7975 1 1 8 ASP CG C -0.905 0.074 -11.542 1.00 . A A . 8 ASP CG 1 1 12 7976 1 1 8 ASP H H 0.322 0.303 -7.635 1.00 . A A . 8 ASP H 1 1 12 7977 1 1 8 ASP HA H -2.147 0.595 -9.131 1.00 . A A . 8 ASP HA 1 1 12 7978 1 1 8 ASP HB2 H -0.129 1.485 -10.161 1.00 . A A . 8 ASP HB2 1 1 12 7979 1 1 8 ASP HB3 H 0.627 -0.100 -10.091 1.00 . A A . 8 ASP HB3 1 1 12 7980 1 1 8 ASP N N -0.653 0.371 -7.750 1.00 . A A . 8 ASP N 1 1 12 7981 1 1 8 ASP O O -2.612 -1.785 -9.670 1.00 . A A . 8 ASP O 1 1 12 7982 1 1 8 ASP OD1 O -0.461 -0.921 -12.157 1.00 . A A . 8 ASP OD1 1 1 12 7983 1 1 8 ASP OD2 O -1.833 0.790 -12.008 1.00 . A A . 8 ASP OD2 1 1 12 7984 1 1 9 THR C C -2.153 -4.097 -7.729 1.00 . A A . 9 THR C 1 1 12 7985 1 1 9 THR CA C -0.964 -3.707 -8.627 1.00 . A A . 9 THR CA 1 1 12 7986 1 1 9 THR CB C 0.304 -4.429 -8.176 1.00 . A A . 9 THR CB 1 1 12 7987 1 1 9 THR CG2 C 0.229 -5.895 -8.516 1.00 . A A . 9 THR CG2 1 1 12 7988 1 1 9 THR H H 0.109 -1.993 -8.178 1.00 . A A . 9 THR H 1 1 12 7989 1 1 9 THR HA H -1.180 -3.993 -9.645 1.00 . A A . 9 THR HA 1 1 12 7990 1 1 9 THR HB H 0.428 -4.309 -7.109 1.00 . A A . 9 THR HB 1 1 12 7991 1 1 9 THR HG1 H 2.174 -3.972 -8.260 1.00 . A A . 9 THR HG1 1 1 12 7992 1 1 9 THR HG21 H -0.634 -6.323 -8.027 1.00 . A A . 9 THR HG21 1 1 12 7993 1 1 9 THR HG22 H 1.130 -6.384 -8.179 1.00 . A A . 9 THR HG22 1 1 12 7994 1 1 9 THR HG23 H 0.128 -5.994 -9.586 1.00 . A A . 9 THR HG23 1 1 12 7995 1 1 9 THR N N -0.734 -2.285 -8.587 1.00 . A A . 9 THR N 1 1 12 7996 1 1 9 THR O O -2.910 -5.037 -8.039 1.00 . A A . 9 THR O 1 1 12 7997 1 1 9 THR OG1 O 1.423 -3.858 -8.869 1.00 . A A . 9 THR OG1 1 1 12 7998 1 1 10 TYR C C -4.680 -2.948 -6.344 1.00 . A A . 10 TYR C 1 1 12 7999 1 1 10 TYR CA C -3.435 -3.586 -5.750 1.00 . A A . 10 TYR CA 1 1 12 8000 1 1 10 TYR CB C -3.133 -2.992 -4.362 1.00 . A A . 10 TYR CB 1 1 12 8001 1 1 10 TYR CD1 C -5.363 -2.757 -3.156 1.00 . A A . 10 TYR CD1 1 1 12 8002 1 1 10 TYR CD2 C -3.781 -4.321 -2.315 1.00 . A A . 10 TYR CD2 1 1 12 8003 1 1 10 TYR CE1 C -6.234 -3.086 -2.144 1.00 . A A . 10 TYR CE1 1 1 12 8004 1 1 10 TYR CE2 C -4.647 -4.659 -1.303 1.00 . A A . 10 TYR CE2 1 1 12 8005 1 1 10 TYR CG C -4.117 -3.369 -3.262 1.00 . A A . 10 TYR CG 1 1 12 8006 1 1 10 TYR CZ C -5.872 -4.037 -1.221 1.00 . A A . 10 TYR CZ 1 1 12 8007 1 1 10 TYR H H -1.707 -2.629 -6.471 1.00 . A A . 10 TYR H 1 1 12 8008 1 1 10 TYR HA H -3.587 -4.652 -5.665 1.00 . A A . 10 TYR HA 1 1 12 8009 1 1 10 TYR HB2 H -2.154 -3.321 -4.048 1.00 . A A . 10 TYR HB2 1 1 12 8010 1 1 10 TYR HB3 H -3.125 -1.915 -4.445 1.00 . A A . 10 TYR HB3 1 1 12 8011 1 1 10 TYR HD1 H -5.644 -2.013 -3.886 1.00 . A A . 10 TYR HD1 1 1 12 8012 1 1 10 TYR HD2 H -2.818 -4.808 -2.383 1.00 . A A . 10 TYR HD2 1 1 12 8013 1 1 10 TYR HE1 H -7.196 -2.596 -2.085 1.00 . A A . 10 TYR HE1 1 1 12 8014 1 1 10 TYR HE2 H -4.353 -5.409 -0.585 1.00 . A A . 10 TYR HE2 1 1 12 8015 1 1 10 TYR HH H -6.274 -4.308 0.639 1.00 . A A . 10 TYR HH 1 1 12 8016 1 1 10 TYR N N -2.336 -3.356 -6.654 1.00 . A A . 10 TYR N 1 1 12 8017 1 1 10 TYR O O -4.964 -1.772 -6.119 1.00 . A A . 10 TYR O 1 1 12 8018 1 1 10 TYR OH O -6.731 -4.359 -0.206 1.00 . A A . 10 TYR OH 1 1 12 8019 1 1 11 LYS C C -7.769 -3.757 -7.128 1.00 . A A . 11 LYS C 1 1 12 8020 1 1 11 LYS CA C -6.540 -3.217 -7.804 1.00 . A A . 11 LYS CA 1 1 12 8021 1 1 11 LYS CB C -6.507 -3.553 -9.290 1.00 . A A . 11 LYS CB 1 1 12 8022 1 1 11 LYS CD C -5.302 -3.195 -11.487 1.00 . A A . 11 LYS CD 1 1 12 8023 1 1 11 LYS CE C -4.568 -4.524 -11.513 1.00 . A A . 11 LYS CE 1 1 12 8024 1 1 11 LYS CG C -5.501 -2.714 -10.061 1.00 . A A . 11 LYS CG 1 1 12 8025 1 1 11 LYS H H -5.031 -4.596 -7.341 1.00 . A A . 11 LYS H 1 1 12 8026 1 1 11 LYS HA H -6.549 -2.143 -7.701 1.00 . A A . 11 LYS HA 1 1 12 8027 1 1 11 LYS HB2 H -6.248 -4.596 -9.395 1.00 . A A . 11 LYS HB2 1 1 12 8028 1 1 11 LYS HB3 H -7.487 -3.389 -9.714 1.00 . A A . 11 LYS HB3 1 1 12 8029 1 1 11 LYS HD2 H -6.267 -3.316 -11.956 1.00 . A A . 11 LYS HD2 1 1 12 8030 1 1 11 LYS HD3 H -4.725 -2.461 -12.031 1.00 . A A . 11 LYS HD3 1 1 12 8031 1 1 11 LYS HE2 H -3.619 -4.403 -11.016 1.00 . A A . 11 LYS HE2 1 1 12 8032 1 1 11 LYS HE3 H -5.155 -5.253 -10.977 1.00 . A A . 11 LYS HE3 1 1 12 8033 1 1 11 LYS HG2 H -5.839 -1.688 -10.086 1.00 . A A . 11 LYS HG2 1 1 12 8034 1 1 11 LYS HG3 H -4.554 -2.755 -9.544 1.00 . A A . 11 LYS HG3 1 1 12 8035 1 1 11 LYS HZ1 H -5.237 -5.149 -13.379 1.00 . A A . 11 LYS HZ1 1 1 12 8036 1 1 11 LYS HZ2 H -3.823 -5.911 -12.880 1.00 . A A . 11 LYS HZ2 1 1 12 8037 1 1 11 LYS HZ3 H -3.775 -4.317 -13.430 1.00 . A A . 11 LYS HZ3 1 1 12 8038 1 1 11 LYS N N -5.356 -3.689 -7.160 1.00 . A A . 11 LYS N 1 1 12 8039 1 1 11 LYS NZ N -4.334 -5.006 -12.886 1.00 . A A . 11 LYS NZ 1 1 12 8040 1 1 11 LYS O O -8.178 -4.904 -7.347 1.00 . A A . 11 LYS O 1 1 12 8041 1 1 12 GLY C C -9.581 -2.470 -4.327 1.00 . A A . 12 GLY C 1 1 12 8042 1 1 12 GLY CA C -9.487 -3.308 -5.557 1.00 . A A . 12 GLY CA 1 1 12 8043 1 1 12 GLY H H -7.884 -2.106 -6.045 1.00 . A A . 12 GLY H 1 1 12 8044 1 1 12 GLY HA2 H -10.345 -3.128 -6.188 1.00 . A A . 12 GLY HA2 1 1 12 8045 1 1 12 GLY HA3 H -9.458 -4.348 -5.272 1.00 . A A . 12 GLY HA3 1 1 12 8046 1 1 12 GLY N N -8.304 -2.966 -6.263 1.00 . A A . 12 GLY N 1 1 12 8047 1 1 12 GLY O O -8.680 -1.650 -4.084 1.00 . A A . 12 GLY O 1 1 12 8048 1 1 13 PRO C C -10.084 -2.551 -1.166 1.00 . A A . 13 PRO C 1 1 12 8049 1 1 13 PRO CA C -10.777 -1.860 -2.333 1.00 . A A . 13 PRO CA 1 1 12 8050 1 1 13 PRO CB C -12.283 -1.814 -2.112 1.00 . A A . 13 PRO CB 1 1 12 8051 1 1 13 PRO CD C -11.792 -3.490 -3.793 1.00 . A A . 13 PRO CD 1 1 12 8052 1 1 13 PRO CG C -12.824 -3.032 -2.789 1.00 . A A . 13 PRO CG 1 1 12 8053 1 1 13 PRO HA H -10.393 -0.857 -2.436 1.00 . A A . 13 PRO HA 1 1 12 8054 1 1 13 PRO HB2 H -12.487 -1.824 -1.053 1.00 . A A . 13 PRO HB2 1 1 12 8055 1 1 13 PRO HB3 H -12.684 -0.912 -2.548 1.00 . A A . 13 PRO HB3 1 1 12 8056 1 1 13 PRO HD2 H -11.526 -4.522 -3.618 1.00 . A A . 13 PRO HD2 1 1 12 8057 1 1 13 PRO HD3 H -12.161 -3.368 -4.802 1.00 . A A . 13 PRO HD3 1 1 12 8058 1 1 13 PRO HG2 H -12.995 -3.807 -2.055 1.00 . A A . 13 PRO HG2 1 1 12 8059 1 1 13 PRO HG3 H -13.749 -2.786 -3.286 1.00 . A A . 13 PRO HG3 1 1 12 8060 1 1 13 PRO N N -10.636 -2.605 -3.547 1.00 . A A . 13 PRO N 1 1 12 8061 1 1 13 PRO O O -10.000 -3.786 -1.110 1.00 . A A . 13 PRO O 1 1 12 8062 1 1 14 CYS C C -10.003 -2.754 1.880 1.00 . A A . 14 CYS C 1 1 12 8063 1 1 14 CYS CA C -8.943 -2.252 0.916 1.00 . A A . 14 CYS CA 1 1 12 8064 1 1 14 CYS CB C -8.106 -1.140 1.570 1.00 . A A . 14 CYS CB 1 1 12 8065 1 1 14 CYS H H -9.607 -0.793 -0.443 1.00 . A A . 14 CYS H 1 1 12 8066 1 1 14 CYS HA H -8.288 -3.068 0.646 1.00 . A A . 14 CYS HA 1 1 12 8067 1 1 14 CYS HB2 H -7.274 -0.898 0.926 1.00 . A A . 14 CYS HB2 1 1 12 8068 1 1 14 CYS HB3 H -8.725 -0.263 1.689 1.00 . A A . 14 CYS HB3 1 1 12 8069 1 1 14 CYS N N -9.570 -1.763 -0.277 1.00 . A A . 14 CYS N 1 1 12 8070 1 1 14 CYS O O -10.796 -1.962 2.413 1.00 . A A . 14 CYS O 1 1 12 8071 1 1 14 CYS SG S -7.423 -1.571 3.212 1.00 . A A . 14 CYS SG 1 1 12 8072 1 1 15 PHE C C -10.319 -4.692 4.340 1.00 . A A . 15 PHE C 1 1 12 8073 1 1 15 PHE CA C -10.999 -4.643 2.995 1.00 . A A . 15 PHE CA 1 1 12 8074 1 1 15 PHE CB C -11.404 -6.060 2.572 1.00 . A A . 15 PHE CB 1 1 12 8075 1 1 15 PHE CD1 C -13.120 -5.522 0.830 1.00 . A A . 15 PHE CD1 1 1 12 8076 1 1 15 PHE CD2 C -11.272 -6.888 0.214 1.00 . A A . 15 PHE CD2 1 1 12 8077 1 1 15 PHE CE1 C -13.613 -5.617 -0.451 1.00 . A A . 15 PHE CE1 1 1 12 8078 1 1 15 PHE CE2 C -11.763 -6.986 -1.067 1.00 . A A . 15 PHE CE2 1 1 12 8079 1 1 15 PHE CG C -11.943 -6.156 1.177 1.00 . A A . 15 PHE CG 1 1 12 8080 1 1 15 PHE CZ C -12.933 -6.351 -1.401 1.00 . A A . 15 PHE CZ 1 1 12 8081 1 1 15 PHE H H -9.490 -4.646 1.526 1.00 . A A . 15 PHE H 1 1 12 8082 1 1 15 PHE HA H -11.876 -4.013 3.047 1.00 . A A . 15 PHE HA 1 1 12 8083 1 1 15 PHE HB2 H -10.545 -6.709 2.643 1.00 . A A . 15 PHE HB2 1 1 12 8084 1 1 15 PHE HB3 H -12.165 -6.419 3.251 1.00 . A A . 15 PHE HB3 1 1 12 8085 1 1 15 PHE HD1 H -13.651 -4.948 1.574 1.00 . A A . 15 PHE HD1 1 1 12 8086 1 1 15 PHE HD2 H -10.353 -7.392 0.471 1.00 . A A . 15 PHE HD2 1 1 12 8087 1 1 15 PHE HE1 H -14.532 -5.115 -0.711 1.00 . A A . 15 PHE HE1 1 1 12 8088 1 1 15 PHE HE2 H -11.227 -7.563 -1.808 1.00 . A A . 15 PHE HE2 1 1 12 8089 1 1 15 PHE HZ H -13.318 -6.428 -2.407 1.00 . A A . 15 PHE HZ 1 1 12 8090 1 1 15 PHE N N -10.072 -4.055 2.051 1.00 . A A . 15 PHE N 1 1 12 8091 1 1 15 PHE O O -10.881 -4.296 5.361 1.00 . A A . 15 PHE O 1 1 12 8092 1 1 16 THR C C -6.978 -4.485 5.194 1.00 . A A . 16 THR C 1 1 12 8093 1 1 16 THR CA C -8.280 -5.230 5.482 1.00 . A A . 16 THR CA 1 1 12 8094 1 1 16 THR CB C -7.987 -6.715 5.818 1.00 . A A . 16 THR CB 1 1 12 8095 1 1 16 THR CG2 C -7.213 -6.840 7.126 1.00 . A A . 16 THR CG2 1 1 12 8096 1 1 16 THR H H -8.707 -5.435 3.467 1.00 . A A . 16 THR H 1 1 12 8097 1 1 16 THR HA H -8.796 -4.766 6.310 1.00 . A A . 16 THR HA 1 1 12 8098 1 1 16 THR HB H -7.406 -7.141 5.014 1.00 . A A . 16 THR HB 1 1 12 8099 1 1 16 THR HG1 H -9.214 -8.149 5.287 1.00 . A A . 16 THR HG1 1 1 12 8100 1 1 16 THR HG21 H -7.787 -6.399 7.928 1.00 . A A . 16 THR HG21 1 1 12 8101 1 1 16 THR HG22 H -6.267 -6.327 7.035 1.00 . A A . 16 THR HG22 1 1 12 8102 1 1 16 THR HG23 H -7.037 -7.883 7.343 1.00 . A A . 16 THR HG23 1 1 12 8103 1 1 16 THR N N -9.097 -5.141 4.318 1.00 . A A . 16 THR N 1 1 12 8104 1 1 16 THR O O -6.320 -4.738 4.168 1.00 . A A . 16 THR O 1 1 12 8105 1 1 16 THR OG1 O -9.233 -7.434 5.938 1.00 . A A . 16 THR OG1 1 1 12 8106 1 1 17 THR C C -4.164 -3.626 5.911 1.00 . A A . 17 THR C 1 1 12 8107 1 1 17 THR CA C -5.425 -2.761 5.871 1.00 . A A . 17 THR CA 1 1 12 8108 1 1 17 THR CB C -5.370 -1.633 6.913 1.00 . A A . 17 THR CB 1 1 12 8109 1 1 17 THR CG2 C -4.174 -0.712 6.670 1.00 . A A . 17 THR CG2 1 1 12 8110 1 1 17 THR H H -7.152 -3.406 6.872 1.00 . A A . 17 THR H 1 1 12 8111 1 1 17 THR HA H -5.498 -2.317 4.889 1.00 . A A . 17 THR HA 1 1 12 8112 1 1 17 THR HB H -5.305 -2.072 7.898 1.00 . A A . 17 THR HB 1 1 12 8113 1 1 17 THR HG1 H -6.962 -1.068 5.937 1.00 . A A . 17 THR HG1 1 1 12 8114 1 1 17 THR HG21 H -3.263 -1.291 6.707 1.00 . A A . 17 THR HG21 1 1 12 8115 1 1 17 THR HG22 H -4.143 0.050 7.435 1.00 . A A . 17 THR HG22 1 1 12 8116 1 1 17 THR HG23 H -4.266 -0.247 5.700 1.00 . A A . 17 THR HG23 1 1 12 8117 1 1 17 THR N N -6.615 -3.560 6.063 1.00 . A A . 17 THR N 1 1 12 8118 1 1 17 THR O O -3.208 -3.371 5.179 1.00 . A A . 17 THR O 1 1 12 8119 1 1 17 THR OG1 O -6.596 -0.867 6.809 1.00 . A A . 17 THR OG1 1 1 12 8120 1 1 18 GLY C C -2.736 -6.215 5.476 1.00 . A A . 18 GLY C 1 1 12 8121 1 1 18 GLY CA C -3.104 -5.611 6.814 1.00 . A A . 18 GLY CA 1 1 12 8122 1 1 18 GLY H H -4.999 -4.829 7.274 1.00 . A A . 18 GLY H 1 1 12 8123 1 1 18 GLY HA2 H -2.246 -5.093 7.214 1.00 . A A . 18 GLY HA2 1 1 12 8124 1 1 18 GLY HA3 H -3.384 -6.406 7.488 1.00 . A A . 18 GLY HA3 1 1 12 8125 1 1 18 GLY N N -4.208 -4.685 6.711 1.00 . A A . 18 GLY N 1 1 12 8126 1 1 18 GLY O O -1.561 -6.290 5.138 1.00 . A A . 18 GLY O 1 1 12 8127 1 1 19 SER C C -2.936 -6.161 2.419 1.00 . A A . 19 SER C 1 1 12 8128 1 1 19 SER CA C -3.563 -7.176 3.387 1.00 . A A . 19 SER CA 1 1 12 8129 1 1 19 SER CB C -4.924 -7.615 2.875 1.00 . A A . 19 SER CB 1 1 12 8130 1 1 19 SER H H -4.669 -6.492 5.012 1.00 . A A . 19 SER H 1 1 12 8131 1 1 19 SER HA H -2.926 -8.044 3.477 1.00 . A A . 19 SER HA 1 1 12 8132 1 1 19 SER HB2 H -5.497 -6.743 2.593 1.00 . A A . 19 SER HB2 1 1 12 8133 1 1 19 SER HB3 H -4.803 -8.265 2.022 1.00 . A A . 19 SER HB3 1 1 12 8134 1 1 19 SER HG H -5.864 -9.179 3.547 1.00 . A A . 19 SER HG 1 1 12 8135 1 1 19 SER N N -3.745 -6.585 4.699 1.00 . A A . 19 SER N 1 1 12 8136 1 1 19 SER O O -2.116 -6.517 1.570 1.00 . A A . 19 SER O 1 1 12 8137 1 1 19 SER OG O -5.614 -8.312 3.895 1.00 . A A . 19 SER OG 1 1 12 8138 1 1 20 CYS C C -1.341 -3.559 2.107 1.00 . A A . 20 CYS C 1 1 12 8139 1 1 20 CYS CA C -2.803 -3.806 1.769 1.00 . A A . 20 CYS CA 1 1 12 8140 1 1 20 CYS CB C -3.632 -2.554 2.046 1.00 . A A . 20 CYS CB 1 1 12 8141 1 1 20 CYS H H -3.944 -4.699 3.306 1.00 . A A . 20 CYS H 1 1 12 8142 1 1 20 CYS HA H -2.896 -4.073 0.727 1.00 . A A . 20 CYS HA 1 1 12 8143 1 1 20 CYS HB2 H -4.655 -2.738 1.754 1.00 . A A . 20 CYS HB2 1 1 12 8144 1 1 20 CYS HB3 H -3.605 -2.346 3.106 1.00 . A A . 20 CYS HB3 1 1 12 8145 1 1 20 CYS N N -3.310 -4.903 2.585 1.00 . A A . 20 CYS N 1 1 12 8146 1 1 20 CYS O O -0.468 -3.503 1.220 1.00 . A A . 20 CYS O 1 1 12 8147 1 1 20 CYS SG S -3.087 -1.070 1.179 1.00 . A A . 20 CYS SG 1 1 12 8148 1 1 21 ASP C C 1.145 -4.420 3.483 1.00 . A A . 21 ASP C 1 1 12 8149 1 1 21 ASP CA C 0.249 -3.289 3.955 1.00 . A A . 21 ASP CA 1 1 12 8150 1 1 21 ASP CB C 0.152 -3.276 5.489 1.00 . A A . 21 ASP CB 1 1 12 8151 1 1 21 ASP CG C 1.480 -3.144 6.184 1.00 . A A . 21 ASP CG 1 1 12 8152 1 1 21 ASP H H -1.836 -3.489 4.036 1.00 . A A . 21 ASP H 1 1 12 8153 1 1 21 ASP HA H 0.648 -2.343 3.618 1.00 . A A . 21 ASP HA 1 1 12 8154 1 1 21 ASP HB2 H -0.466 -2.446 5.795 1.00 . A A . 21 ASP HB2 1 1 12 8155 1 1 21 ASP HB3 H -0.316 -4.195 5.812 1.00 . A A . 21 ASP HB3 1 1 12 8156 1 1 21 ASP N N -1.083 -3.461 3.403 1.00 . A A . 21 ASP N 1 1 12 8157 1 1 21 ASP O O 2.234 -4.192 2.962 1.00 . A A . 21 ASP O 1 1 12 8158 1 1 21 ASP OD1 O 1.993 -4.159 6.727 1.00 . A A . 21 ASP OD1 1 1 12 8159 1 1 21 ASP OD2 O 2.027 -2.025 6.228 1.00 . A A . 21 ASP OD2 1 1 12 8160 1 1 22 ASP C C 1.632 -6.809 1.690 1.00 . A A . 22 ASP C 1 1 12 8161 1 1 22 ASP CA C 1.297 -6.856 3.176 1.00 . A A . 22 ASP CA 1 1 12 8162 1 1 22 ASP CB C 0.380 -8.057 3.457 1.00 . A A . 22 ASP CB 1 1 12 8163 1 1 22 ASP CG C 0.975 -9.395 3.089 1.00 . A A . 22 ASP CG 1 1 12 8164 1 1 22 ASP H H -0.278 -5.702 3.983 1.00 . A A . 22 ASP H 1 1 12 8165 1 1 22 ASP HA H 2.202 -6.966 3.752 1.00 . A A . 22 ASP HA 1 1 12 8166 1 1 22 ASP HB2 H 0.139 -8.081 4.510 1.00 . A A . 22 ASP HB2 1 1 12 8167 1 1 22 ASP HB3 H -0.531 -7.926 2.896 1.00 . A A . 22 ASP HB3 1 1 12 8168 1 1 22 ASP N N 0.620 -5.627 3.589 1.00 . A A . 22 ASP N 1 1 12 8169 1 1 22 ASP O O 2.763 -7.046 1.304 1.00 . A A . 22 ASP O 1 1 12 8170 1 1 22 ASP OD1 O 0.895 -9.799 1.912 1.00 . A A . 22 ASP OD1 1 1 12 8171 1 1 22 ASP OD2 O 1.487 -10.093 3.982 1.00 . A A . 22 ASP OD2 1 1 12 8172 1 1 23 HIS C C 1.908 -5.406 -0.975 1.00 . A A . 23 HIS C 1 1 12 8173 1 1 23 HIS CA C 0.813 -6.391 -0.572 1.00 . A A . 23 HIS CA 1 1 12 8174 1 1 23 HIS CB C -0.524 -6.024 -1.246 1.00 . A A . 23 HIS CB 1 1 12 8175 1 1 23 HIS CD2 C -0.209 -4.907 -3.569 1.00 . A A . 23 HIS CD2 1 1 12 8176 1 1 23 HIS CE1 C -0.634 -6.602 -4.837 1.00 . A A . 23 HIS CE1 1 1 12 8177 1 1 23 HIS CG C -0.476 -5.956 -2.750 1.00 . A A . 23 HIS CG 1 1 12 8178 1 1 23 HIS H H -0.216 -6.195 1.260 1.00 . A A . 23 HIS H 1 1 12 8179 1 1 23 HIS HA H 1.105 -7.377 -0.903 1.00 . A A . 23 HIS HA 1 1 12 8180 1 1 23 HIS HB2 H -1.269 -6.759 -0.977 1.00 . A A . 23 HIS HB2 1 1 12 8181 1 1 23 HIS HB3 H -0.839 -5.058 -0.879 1.00 . A A . 23 HIS HB3 1 1 12 8182 1 1 23 HIS HD1 H -0.937 -7.944 -3.292 1.00 . A A . 23 HIS HD1 1 1 12 8183 1 1 23 HIS HD2 H 0.045 -3.908 -3.246 1.00 . A A . 23 HIS HD2 1 1 12 8184 1 1 23 HIS HE1 H -0.801 -7.223 -5.704 1.00 . A A . 23 HIS HE1 1 1 12 8185 1 1 23 HIS N N 0.653 -6.444 0.876 1.00 . A A . 23 HIS N 1 1 12 8186 1 1 23 HIS ND1 N -0.740 -7.022 -3.575 1.00 . A A . 23 HIS ND1 1 1 12 8187 1 1 23 HIS NE2 N -0.311 -5.323 -4.889 1.00 . A A . 23 HIS NE2 1 1 12 8188 1 1 23 HIS O O 2.863 -5.773 -1.663 1.00 . A A . 23 HIS O 1 1 12 8189 1 1 24 CYS C C 4.158 -3.445 -0.350 1.00 . A A . 24 CYS C 1 1 12 8190 1 1 24 CYS CA C 2.760 -3.171 -0.896 1.00 . A A . 24 CYS CA 1 1 12 8191 1 1 24 CYS CB C 2.258 -1.759 -0.588 1.00 . A A . 24 CYS CB 1 1 12 8192 1 1 24 CYS H H 1.044 -3.948 0.065 1.00 . A A . 24 CYS H 1 1 12 8193 1 1 24 CYS HA H 2.837 -3.268 -1.970 1.00 . A A . 24 CYS HA 1 1 12 8194 1 1 24 CYS HB2 H 1.938 -1.711 0.441 1.00 . A A . 24 CYS HB2 1 1 12 8195 1 1 24 CYS HB3 H 3.055 -1.050 -0.753 1.00 . A A . 24 CYS HB3 1 1 12 8196 1 1 24 CYS N N 1.797 -4.182 -0.524 1.00 . A A . 24 CYS N 1 1 12 8197 1 1 24 CYS O O 5.132 -3.093 -0.973 1.00 . A A . 24 CYS O 1 1 12 8198 1 1 24 CYS SG S 0.850 -1.278 -1.647 1.00 . A A . 24 CYS SG 1 1 12 8199 1 1 25 LYS C C 6.147 -5.710 0.718 1.00 . A A . 25 LYS C 1 1 12 8200 1 1 25 LYS CA C 5.541 -4.462 1.352 1.00 . A A . 25 LYS CA 1 1 12 8201 1 1 25 LYS CB C 5.417 -4.631 2.847 1.00 . A A . 25 LYS CB 1 1 12 8202 1 1 25 LYS CD C 4.704 -3.456 4.950 1.00 . A A . 25 LYS CD 1 1 12 8203 1 1 25 LYS CE C 5.375 -4.497 5.815 1.00 . A A . 25 LYS CE 1 1 12 8204 1 1 25 LYS CG C 5.330 -3.314 3.579 1.00 . A A . 25 LYS CG 1 1 12 8205 1 1 25 LYS H H 3.430 -4.341 1.267 1.00 . A A . 25 LYS H 1 1 12 8206 1 1 25 LYS HA H 6.212 -3.637 1.164 1.00 . A A . 25 LYS HA 1 1 12 8207 1 1 25 LYS HB2 H 4.524 -5.201 3.059 1.00 . A A . 25 LYS HB2 1 1 12 8208 1 1 25 LYS HB3 H 6.277 -5.170 3.215 1.00 . A A . 25 LYS HB3 1 1 12 8209 1 1 25 LYS HD2 H 4.769 -2.506 5.458 1.00 . A A . 25 LYS HD2 1 1 12 8210 1 1 25 LYS HD3 H 3.663 -3.719 4.827 1.00 . A A . 25 LYS HD3 1 1 12 8211 1 1 25 LYS HE2 H 5.362 -5.446 5.302 1.00 . A A . 25 LYS HE2 1 1 12 8212 1 1 25 LYS HE3 H 6.393 -4.183 5.988 1.00 . A A . 25 LYS HE3 1 1 12 8213 1 1 25 LYS HG2 H 6.324 -2.907 3.688 1.00 . A A . 25 LYS HG2 1 1 12 8214 1 1 25 LYS HG3 H 4.731 -2.643 2.981 1.00 . A A . 25 LYS HG3 1 1 12 8215 1 1 25 LYS HZ1 H 5.030 -5.441 7.648 1.00 . A A . 25 LYS HZ1 1 1 12 8216 1 1 25 LYS HZ2 H 3.645 -4.705 6.985 1.00 . A A . 25 LYS HZ2 1 1 12 8217 1 1 25 LYS HZ3 H 4.850 -3.778 7.684 1.00 . A A . 25 LYS HZ3 1 1 12 8218 1 1 25 LYS N N 4.249 -4.099 0.780 1.00 . A A . 25 LYS N 1 1 12 8219 1 1 25 LYS NZ N 4.679 -4.624 7.107 1.00 . A A . 25 LYS NZ 1 1 12 8220 1 1 25 LYS O O 7.333 -5.742 0.425 1.00 . A A . 25 LYS O 1 1 12 8221 1 1 26 ASN C C 5.904 -8.064 -1.523 1.00 . A A . 26 ASN C 1 1 12 8222 1 1 26 ASN CA C 5.850 -7.993 -0.015 1.00 . A A . 26 ASN CA 1 1 12 8223 1 1 26 ASN CB C 5.037 -9.170 0.528 1.00 . A A . 26 ASN CB 1 1 12 8224 1 1 26 ASN CG C 5.104 -9.300 2.036 1.00 . A A . 26 ASN CG 1 1 12 8225 1 1 26 ASN H H 4.377 -6.617 0.664 1.00 . A A . 26 ASN H 1 1 12 8226 1 1 26 ASN HA H 6.858 -8.090 0.358 1.00 . A A . 26 ASN HA 1 1 12 8227 1 1 26 ASN HB2 H 4.001 -9.042 0.247 1.00 . A A . 26 ASN HB2 1 1 12 8228 1 1 26 ASN HB3 H 5.410 -10.083 0.088 1.00 . A A . 26 ASN HB3 1 1 12 8229 1 1 26 ASN HD21 H 3.281 -10.040 2.075 1.00 . A A . 26 ASN HD21 1 1 12 8230 1 1 26 ASN HD22 H 4.050 -9.897 3.595 1.00 . A A . 26 ASN HD22 1 1 12 8231 1 1 26 ASN N N 5.340 -6.713 0.483 1.00 . A A . 26 ASN N 1 1 12 8232 1 1 26 ASN ND2 N 4.058 -9.787 2.622 1.00 . A A . 26 ASN ND2 1 1 12 8233 1 1 26 ASN O O 6.855 -8.595 -2.087 1.00 . A A . 26 ASN O 1 1 12 8234 1 1 26 ASN OD1 O 6.100 -8.946 2.670 1.00 . A A . 26 ASN OD1 1 1 12 8235 1 1 27 LYS C C 5.522 -6.391 -4.231 1.00 . A A . 27 LYS C 1 1 12 8236 1 1 27 LYS CA C 4.850 -7.616 -3.629 1.00 . A A . 27 LYS CA 1 1 12 8237 1 1 27 LYS CB C 3.387 -7.746 -4.119 1.00 . A A . 27 LYS CB 1 1 12 8238 1 1 27 LYS CD C 3.931 -9.058 -6.208 1.00 . A A . 27 LYS CD 1 1 12 8239 1 1 27 LYS CE C 3.784 -9.146 -7.720 1.00 . A A . 27 LYS CE 1 1 12 8240 1 1 27 LYS CG C 3.218 -7.839 -5.638 1.00 . A A . 27 LYS CG 1 1 12 8241 1 1 27 LYS H H 4.164 -7.111 -1.699 1.00 . A A . 27 LYS H 1 1 12 8242 1 1 27 LYS HA H 5.399 -8.494 -3.931 1.00 . A A . 27 LYS HA 1 1 12 8243 1 1 27 LYS HB2 H 2.957 -8.636 -3.683 1.00 . A A . 27 LYS HB2 1 1 12 8244 1 1 27 LYS HB3 H 2.833 -6.889 -3.769 1.00 . A A . 27 LYS HB3 1 1 12 8245 1 1 27 LYS HD2 H 4.980 -9.003 -5.962 1.00 . A A . 27 LYS HD2 1 1 12 8246 1 1 27 LYS HD3 H 3.503 -9.943 -5.761 1.00 . A A . 27 LYS HD3 1 1 12 8247 1 1 27 LYS HE2 H 4.146 -8.228 -8.156 1.00 . A A . 27 LYS HE2 1 1 12 8248 1 1 27 LYS HE3 H 4.392 -9.964 -8.074 1.00 . A A . 27 LYS HE3 1 1 12 8249 1 1 27 LYS HG2 H 2.166 -7.908 -5.871 1.00 . A A . 27 LYS HG2 1 1 12 8250 1 1 27 LYS HG3 H 3.629 -6.947 -6.088 1.00 . A A . 27 LYS HG3 1 1 12 8251 1 1 27 LYS HZ1 H 1.719 -8.674 -7.738 1.00 . A A . 27 LYS HZ1 1 1 12 8252 1 1 27 LYS HZ2 H 2.059 -10.322 -7.905 1.00 . A A . 27 LYS HZ2 1 1 12 8253 1 1 27 LYS HZ3 H 2.323 -9.278 -9.183 1.00 . A A . 27 LYS HZ3 1 1 12 8254 1 1 27 LYS N N 4.898 -7.552 -2.183 1.00 . A A . 27 LYS N 1 1 12 8255 1 1 27 LYS NZ N 2.381 -9.363 -8.147 1.00 . A A . 27 LYS NZ 1 1 12 8256 1 1 27 LYS O O 6.416 -6.512 -5.071 1.00 . A A . 27 LYS O 1 1 12 8257 1 1 28 GLU C C 7.002 -3.606 -3.649 1.00 . A A . 28 GLU C 1 1 12 8258 1 1 28 GLU CA C 5.667 -3.978 -4.295 1.00 . A A . 28 GLU CA 1 1 12 8259 1 1 28 GLU CB C 4.665 -2.837 -4.142 1.00 . A A . 28 GLU CB 1 1 12 8260 1 1 28 GLU CD C 3.545 -3.202 -6.363 1.00 . A A . 28 GLU CD 1 1 12 8261 1 1 28 GLU CG C 3.350 -3.046 -4.877 1.00 . A A . 28 GLU CG 1 1 12 8262 1 1 28 GLU H H 4.444 -5.202 -3.059 1.00 . A A . 28 GLU H 1 1 12 8263 1 1 28 GLU HA H 5.839 -4.141 -5.349 1.00 . A A . 28 GLU HA 1 1 12 8264 1 1 28 GLU HB2 H 4.455 -2.696 -3.093 1.00 . A A . 28 GLU HB2 1 1 12 8265 1 1 28 GLU HB3 H 5.121 -1.936 -4.526 1.00 . A A . 28 GLU HB3 1 1 12 8266 1 1 28 GLU HG2 H 2.878 -3.940 -4.496 1.00 . A A . 28 GLU HG2 1 1 12 8267 1 1 28 GLU HG3 H 2.709 -2.196 -4.697 1.00 . A A . 28 GLU HG3 1 1 12 8268 1 1 28 GLU N N 5.129 -5.222 -3.761 1.00 . A A . 28 GLU N 1 1 12 8269 1 1 28 GLU O O 7.735 -2.765 -4.175 1.00 . A A . 28 GLU O 1 1 12 8270 1 1 28 GLU OE1 O 3.233 -4.257 -6.911 1.00 . A A . 28 GLU OE1 1 1 12 8271 1 1 28 GLU OE2 O 4.038 -2.258 -7.017 1.00 . A A . 28 GLU OE2 1 1 12 8272 1 1 29 HIS C C 8.699 -2.595 -1.203 1.00 . A A . 29 HIS C 1 1 12 8273 1 1 29 HIS CA C 8.553 -4.027 -1.742 1.00 . A A . 29 HIS CA 1 1 12 8274 1 1 29 HIS CB C 9.789 -4.454 -2.572 1.00 . A A . 29 HIS CB 1 1 12 8275 1 1 29 HIS CD2 C 10.459 -6.916 -2.086 1.00 . A A . 29 HIS CD2 1 1 12 8276 1 1 29 HIS CE1 C 9.567 -7.886 -3.809 1.00 . A A . 29 HIS CE1 1 1 12 8277 1 1 29 HIS CG C 9.869 -5.940 -2.822 1.00 . A A . 29 HIS CG 1 1 12 8278 1 1 29 HIS H H 6.640 -4.863 -2.145 1.00 . A A . 29 HIS H 1 1 12 8279 1 1 29 HIS HA H 8.482 -4.677 -0.881 1.00 . A A . 29 HIS HA 1 1 12 8280 1 1 29 HIS HB2 H 9.754 -3.961 -3.531 1.00 . A A . 29 HIS HB2 1 1 12 8281 1 1 29 HIS HB3 H 10.685 -4.153 -2.050 1.00 . A A . 29 HIS HB3 1 1 12 8282 1 1 29 HIS HD1 H 8.807 -6.169 -4.653 1.00 . A A . 29 HIS HD1 1 1 12 8283 1 1 29 HIS HD2 H 11.001 -6.767 -1.162 1.00 . A A . 29 HIS HD2 1 1 12 8284 1 1 29 HIS HE1 H 9.241 -8.627 -4.525 1.00 . A A . 29 HIS HE1 1 1 12 8285 1 1 29 HIS N N 7.296 -4.230 -2.501 1.00 . A A . 29 HIS N 1 1 12 8286 1 1 29 HIS ND1 N 9.312 -6.580 -3.915 1.00 . A A . 29 HIS ND1 1 1 12 8287 1 1 29 HIS NE2 N 10.266 -8.149 -2.713 1.00 . A A . 29 HIS NE2 1 1 12 8288 1 1 29 HIS O O 9.811 -2.132 -0.925 1.00 . A A . 29 HIS O 1 1 12 8289 1 1 30 LEU C C 7.658 -0.506 1.020 1.00 . A A . 30 LEU C 1 1 12 8290 1 1 30 LEU CA C 7.545 -0.560 -0.511 1.00 . A A . 30 LEU CA 1 1 12 8291 1 1 30 LEU CB C 6.254 0.134 -0.974 1.00 . A A . 30 LEU CB 1 1 12 8292 1 1 30 LEU CD1 C 4.703 0.892 -2.794 1.00 . A A . 30 LEU CD1 1 1 12 8293 1 1 30 LEU CD2 C 7.159 0.754 -3.252 1.00 . A A . 30 LEU CD2 1 1 12 8294 1 1 30 LEU CG C 5.989 0.148 -2.486 1.00 . A A . 30 LEU CG 1 1 12 8295 1 1 30 LEU H H 6.726 -2.409 -1.125 1.00 . A A . 30 LEU H 1 1 12 8296 1 1 30 LEU HA H 8.391 -0.053 -0.945 1.00 . A A . 30 LEU HA 1 1 12 8297 1 1 30 LEU HB2 H 5.422 -0.361 -0.495 1.00 . A A . 30 LEU HB2 1 1 12 8298 1 1 30 LEU HB3 H 6.282 1.156 -0.629 1.00 . A A . 30 LEU HB3 1 1 12 8299 1 1 30 LEU HD11 H 4.772 1.903 -2.420 1.00 . A A . 30 LEU HD11 1 1 12 8300 1 1 30 LEU HD12 H 3.872 0.389 -2.323 1.00 . A A . 30 LEU HD12 1 1 12 8301 1 1 30 LEU HD13 H 4.548 0.916 -3.862 1.00 . A A . 30 LEU HD13 1 1 12 8302 1 1 30 LEU HD21 H 8.043 0.155 -3.095 1.00 . A A . 30 LEU HD21 1 1 12 8303 1 1 30 LEU HD22 H 7.339 1.758 -2.896 1.00 . A A . 30 LEU HD22 1 1 12 8304 1 1 30 LEU HD23 H 6.923 0.783 -4.306 1.00 . A A . 30 LEU HD23 1 1 12 8305 1 1 30 LEU HG H 5.859 -0.873 -2.813 1.00 . A A . 30 LEU HG 1 1 12 8306 1 1 30 LEU N N 7.576 -1.937 -0.983 1.00 . A A . 30 LEU N 1 1 12 8307 1 1 30 LEU O O 7.888 -1.527 1.665 1.00 . A A . 30 LEU O 1 1 12 8308 1 1 31 ARG C C 6.423 0.266 3.773 1.00 . A A . 31 ARG C 1 1 12 8309 1 1 31 ARG CA C 7.620 0.874 3.041 1.00 . A A . 31 ARG CA 1 1 12 8310 1 1 31 ARG CB C 7.768 2.368 3.383 1.00 . A A . 31 ARG CB 1 1 12 8311 1 1 31 ARG CD C 8.136 4.163 5.112 1.00 . A A . 31 ARG CD 1 1 12 8312 1 1 31 ARG CG C 7.949 2.670 4.870 1.00 . A A . 31 ARG CG 1 1 12 8313 1 1 31 ARG CZ C 8.358 5.721 7.060 1.00 . A A . 31 ARG CZ 1 1 12 8314 1 1 31 ARG H H 7.275 1.458 1.027 1.00 . A A . 31 ARG H 1 1 12 8315 1 1 31 ARG HA H 8.510 0.353 3.359 1.00 . A A . 31 ARG HA 1 1 12 8316 1 1 31 ARG HB2 H 8.624 2.760 2.853 1.00 . A A . 31 ARG HB2 1 1 12 8317 1 1 31 ARG HB3 H 6.885 2.886 3.037 1.00 . A A . 31 ARG HB3 1 1 12 8318 1 1 31 ARG HD2 H 9.004 4.482 4.556 1.00 . A A . 31 ARG HD2 1 1 12 8319 1 1 31 ARG HD3 H 7.267 4.692 4.752 1.00 . A A . 31 ARG HD3 1 1 12 8320 1 1 31 ARG HE H 8.506 3.705 7.109 1.00 . A A . 31 ARG HE 1 1 12 8321 1 1 31 ARG HG2 H 7.073 2.333 5.404 1.00 . A A . 31 ARG HG2 1 1 12 8322 1 1 31 ARG HG3 H 8.816 2.140 5.234 1.00 . A A . 31 ARG HG3 1 1 12 8323 1 1 31 ARG HH11 H 7.937 6.752 5.317 1.00 . A A . 31 ARG HH11 1 1 12 8324 1 1 31 ARG HH12 H 8.137 7.730 6.683 1.00 . A A . 31 ARG HH12 1 1 12 8325 1 1 31 ARG HH21 H 8.794 5.097 8.965 1.00 . A A . 31 ARG HH21 1 1 12 8326 1 1 31 ARG HH22 H 8.612 6.783 8.777 1.00 . A A . 31 ARG HH22 1 1 12 8327 1 1 31 ARG N N 7.497 0.685 1.592 1.00 . A A . 31 ARG N 1 1 12 8328 1 1 31 ARG NE N 8.348 4.484 6.528 1.00 . A A . 31 ARG NE 1 1 12 8329 1 1 31 ARG NH1 N 8.126 6.803 6.299 1.00 . A A . 31 ARG NH1 1 1 12 8330 1 1 31 ARG NH2 N 8.607 5.873 8.354 1.00 . A A . 31 ARG NH2 1 1 12 8331 1 1 31 ARG O O 6.593 -0.495 4.728 1.00 . A A . 31 ARG O 1 1 12 8332 1 1 32 SER C C 2.817 0.420 3.002 1.00 . A A . 32 SER C 1 1 12 8333 1 1 32 SER CA C 3.999 0.081 3.905 1.00 . A A . 32 SER CA 1 1 12 8334 1 1 32 SER CB C 3.785 0.656 5.320 1.00 . A A . 32 SER CB 1 1 12 8335 1 1 32 SER H H 5.133 1.215 2.565 1.00 . A A . 32 SER H 1 1 12 8336 1 1 32 SER HA H 4.094 -0.993 3.972 1.00 . A A . 32 SER HA 1 1 12 8337 1 1 32 SER HB2 H 2.838 0.307 5.705 1.00 . A A . 32 SER HB2 1 1 12 8338 1 1 32 SER HB3 H 4.580 0.316 5.966 1.00 . A A . 32 SER HB3 1 1 12 8339 1 1 32 SER HG H 3.084 2.343 5.934 1.00 . A A . 32 SER HG 1 1 12 8340 1 1 32 SER N N 5.224 0.599 3.323 1.00 . A A . 32 SER N 1 1 12 8341 1 1 32 SER O O 2.985 1.153 2.009 1.00 . A A . 32 SER O 1 1 12 8342 1 1 32 SER OG O 3.775 2.076 5.313 1.00 . A A . 32 SER OG 1 1 12 8343 1 1 33 GLY C C -0.589 0.792 3.445 1.00 . A A . 33 GLY C 1 1 12 8344 1 1 33 GLY CA C 0.462 0.187 2.558 1.00 . A A . 33 GLY CA 1 1 12 8345 1 1 33 GLY H H 1.570 -0.681 4.112 1.00 . A A . 33 GLY H 1 1 12 8346 1 1 33 GLY HA2 H 0.715 0.884 1.774 1.00 . A A . 33 GLY HA2 1 1 12 8347 1 1 33 GLY HA3 H 0.074 -0.716 2.112 1.00 . A A . 33 GLY HA3 1 1 12 8348 1 1 33 GLY N N 1.652 -0.102 3.323 1.00 . A A . 33 GLY N 1 1 12 8349 1 1 33 GLY O O -0.909 0.231 4.499 1.00 . A A . 33 GLY O 1 1 12 8350 1 1 34 ARG C C -3.399 2.709 3.153 1.00 . A A . 34 ARG C 1 1 12 8351 1 1 34 ARG CA C -2.063 2.637 3.881 1.00 . A A . 34 ARG CA 1 1 12 8352 1 1 34 ARG CB C -1.560 4.058 4.219 1.00 . A A . 34 ARG CB 1 1 12 8353 1 1 34 ARG CD C 0.255 5.507 5.222 1.00 . A A . 34 ARG CD 1 1 12 8354 1 1 34 ARG CG C -0.144 4.099 4.801 1.00 . A A . 34 ARG CG 1 1 12 8355 1 1 34 ARG CZ C 2.042 6.083 6.902 1.00 . A A . 34 ARG CZ 1 1 12 8356 1 1 34 ARG H H -0.868 2.343 2.200 1.00 . A A . 34 ARG H 1 1 12 8357 1 1 34 ARG HA H -2.192 2.083 4.798 1.00 . A A . 34 ARG HA 1 1 12 8358 1 1 34 ARG HB2 H -1.568 4.649 3.316 1.00 . A A . 34 ARG HB2 1 1 12 8359 1 1 34 ARG HB3 H -2.234 4.505 4.935 1.00 . A A . 34 ARG HB3 1 1 12 8360 1 1 34 ARG HD2 H 0.149 6.166 4.371 1.00 . A A . 34 ARG HD2 1 1 12 8361 1 1 34 ARG HD3 H -0.407 5.834 6.011 1.00 . A A . 34 ARG HD3 1 1 12 8362 1 1 34 ARG HE H 2.316 5.236 5.059 1.00 . A A . 34 ARG HE 1 1 12 8363 1 1 34 ARG HG2 H -0.094 3.444 5.657 1.00 . A A . 34 ARG HG2 1 1 12 8364 1 1 34 ARG HG3 H 0.547 3.749 4.048 1.00 . A A . 34 ARG HG3 1 1 12 8365 1 1 34 ARG HH11 H 0.154 6.497 7.620 1.00 . A A . 34 ARG HH11 1 1 12 8366 1 1 34 ARG HH12 H 1.414 6.878 8.686 1.00 . A A . 34 ARG HH12 1 1 12 8367 1 1 34 ARG HH21 H 4.052 5.824 6.588 1.00 . A A . 34 ARG HH21 1 1 12 8368 1 1 34 ARG HH22 H 3.638 6.514 8.092 1.00 . A A . 34 ARG HH22 1 1 12 8369 1 1 34 ARG N N -1.101 1.939 3.065 1.00 . A A . 34 ARG N 1 1 12 8370 1 1 34 ARG NE N 1.650 5.575 5.705 1.00 . A A . 34 ARG NE 1 1 12 8371 1 1 34 ARG NH1 N 1.142 6.517 7.788 1.00 . A A . 34 ARG NH1 1 1 12 8372 1 1 34 ARG NH2 N 3.332 6.143 7.211 1.00 . A A . 34 ARG NH2 1 1 12 8373 1 1 34 ARG O O -3.456 2.987 1.953 1.00 . A A . 34 ARG O 1 1 12 8374 1 1 35 CYS C C -6.411 3.818 3.621 1.00 . A A . 35 CYS C 1 1 12 8375 1 1 35 CYS CA C -5.772 2.499 3.274 1.00 . A A . 35 CYS CA 1 1 12 8376 1 1 35 CYS CB C -6.625 1.330 3.766 1.00 . A A . 35 CYS CB 1 1 12 8377 1 1 35 CYS H H -4.361 2.249 4.811 1.00 . A A . 35 CYS H 1 1 12 8378 1 1 35 CYS HA H -5.677 2.452 2.200 1.00 . A A . 35 CYS HA 1 1 12 8379 1 1 35 CYS HB2 H -6.783 1.428 4.830 1.00 . A A . 35 CYS HB2 1 1 12 8380 1 1 35 CYS HB3 H -7.579 1.347 3.260 1.00 . A A . 35 CYS HB3 1 1 12 8381 1 1 35 CYS N N -4.455 2.453 3.857 1.00 . A A . 35 CYS N 1 1 12 8382 1 1 35 CYS O O -6.437 4.225 4.786 1.00 . A A . 35 CYS O 1 1 12 8383 1 1 35 CYS SG S -5.863 -0.302 3.464 1.00 . A A . 35 CYS SG 1 1 12 8384 1 1 36 ARG C C -8.964 5.704 2.542 1.00 . A A . 36 ARG C 1 1 12 8385 1 1 36 ARG CA C -7.468 5.796 2.815 1.00 . A A . 36 ARG CA 1 1 12 8386 1 1 36 ARG CB C -6.796 6.834 1.911 1.00 . A A . 36 ARG CB 1 1 12 8387 1 1 36 ARG CD C -5.069 7.546 3.603 1.00 . A A . 36 ARG CD 1 1 12 8388 1 1 36 ARG CG C -5.303 7.055 2.190 1.00 . A A . 36 ARG CG 1 1 12 8389 1 1 36 ARG CZ C -3.161 7.902 5.149 1.00 . A A . 36 ARG CZ 1 1 12 8390 1 1 36 ARG H H -6.811 4.139 1.717 1.00 . A A . 36 ARG H 1 1 12 8391 1 1 36 ARG HA H -7.327 6.079 3.847 1.00 . A A . 36 ARG HA 1 1 12 8392 1 1 36 ARG HB2 H -6.886 6.481 0.895 1.00 . A A . 36 ARG HB2 1 1 12 8393 1 1 36 ARG HB3 H -7.308 7.778 2.016 1.00 . A A . 36 ARG HB3 1 1 12 8394 1 1 36 ARG HD2 H -5.621 8.462 3.752 1.00 . A A . 36 ARG HD2 1 1 12 8395 1 1 36 ARG HD3 H -5.432 6.794 4.288 1.00 . A A . 36 ARG HD3 1 1 12 8396 1 1 36 ARG HE H -3.063 7.958 3.127 1.00 . A A . 36 ARG HE 1 1 12 8397 1 1 36 ARG HG2 H -4.783 6.117 2.059 1.00 . A A . 36 ARG HG2 1 1 12 8398 1 1 36 ARG HG3 H -4.918 7.782 1.490 1.00 . A A . 36 ARG HG3 1 1 12 8399 1 1 36 ARG HH11 H -4.908 7.418 6.111 1.00 . A A . 36 ARG HH11 1 1 12 8400 1 1 36 ARG HH12 H -3.587 7.778 7.129 1.00 . A A . 36 ARG HH12 1 1 12 8401 1 1 36 ARG HH21 H -1.277 8.378 4.556 1.00 . A A . 36 ARG HH21 1 1 12 8402 1 1 36 ARG HH22 H -1.505 8.309 6.263 1.00 . A A . 36 ARG HH22 1 1 12 8403 1 1 36 ARG N N -6.862 4.509 2.624 1.00 . A A . 36 ARG N 1 1 12 8404 1 1 36 ARG NE N -3.654 7.806 3.904 1.00 . A A . 36 ARG NE 1 1 12 8405 1 1 36 ARG NH1 N -3.940 7.673 6.193 1.00 . A A . 36 ARG NH1 1 1 12 8406 1 1 36 ARG NH2 N -1.896 8.214 5.343 1.00 . A A . 36 ARG NH2 1 1 12 8407 1 1 36 ARG O O -9.432 4.687 2.024 1.00 . A A . 36 ARG O 1 1 12 8408 1 1 37 ASP C C -11.703 6.436 1.390 1.00 . A A . 37 ASP C 1 1 12 8409 1 1 37 ASP CA C -11.169 6.864 2.747 1.00 . A A . 37 ASP CA 1 1 12 8410 1 1 37 ASP CB C -11.638 8.289 3.046 1.00 . A A . 37 ASP CB 1 1 12 8411 1 1 37 ASP CG C -13.128 8.480 2.840 1.00 . A A . 37 ASP CG 1 1 12 8412 1 1 37 ASP H H -9.209 7.551 3.219 1.00 . A A . 37 ASP H 1 1 12 8413 1 1 37 ASP HA H -11.594 6.215 3.498 1.00 . A A . 37 ASP HA 1 1 12 8414 1 1 37 ASP HB2 H -11.402 8.535 4.071 1.00 . A A . 37 ASP HB2 1 1 12 8415 1 1 37 ASP HB3 H -11.117 8.970 2.391 1.00 . A A . 37 ASP HB3 1 1 12 8416 1 1 37 ASP N N -9.687 6.771 2.864 1.00 . A A . 37 ASP N 1 1 12 8417 1 1 37 ASP O O -12.780 5.859 1.294 1.00 . A A . 37 ASP O 1 1 12 8418 1 1 37 ASP OD1 O -13.535 9.007 1.776 1.00 . A A . 37 ASP OD1 1 1 12 8419 1 1 37 ASP OD2 O -13.914 8.111 3.735 1.00 . A A . 37 ASP OD2 1 1 12 8420 1 1 38 ASP C C -11.253 4.837 -1.295 1.00 . A A . 38 ASP C 1 1 12 8421 1 1 38 ASP CA C -11.339 6.341 -1.018 1.00 . A A . 38 ASP CA 1 1 12 8422 1 1 38 ASP CB C -10.544 7.139 -2.060 1.00 . A A . 38 ASP CB 1 1 12 8423 1 1 38 ASP CG C -10.972 8.590 -2.144 1.00 . A A . 38 ASP CG 1 1 12 8424 1 1 38 ASP H H -10.086 7.144 0.527 1.00 . A A . 38 ASP H 1 1 12 8425 1 1 38 ASP HA H -12.379 6.617 -1.102 1.00 . A A . 38 ASP HA 1 1 12 8426 1 1 38 ASP HB2 H -9.499 7.113 -1.795 1.00 . A A . 38 ASP HB2 1 1 12 8427 1 1 38 ASP HB3 H -10.677 6.682 -3.030 1.00 . A A . 38 ASP HB3 1 1 12 8428 1 1 38 ASP N N -10.939 6.691 0.354 1.00 . A A . 38 ASP N 1 1 12 8429 1 1 38 ASP O O -11.472 4.398 -2.421 1.00 . A A . 38 ASP O 1 1 12 8430 1 1 38 ASP OD1 O -10.473 9.427 -1.369 1.00 . A A . 38 ASP OD1 1 1 12 8431 1 1 38 ASP OD2 O -11.833 8.918 -2.988 1.00 . A A . 38 ASP OD2 1 1 12 8432 1 1 39 PHE C C -9.725 2.014 -1.093 1.00 . A A . 39 PHE C 1 1 12 8433 1 1 39 PHE CA C -10.854 2.588 -0.261 1.00 . A A . 39 PHE CA 1 1 12 8434 1 1 39 PHE CB C -12.199 1.950 -0.672 1.00 . A A . 39 PHE CB 1 1 12 8435 1 1 39 PHE CD1 C -13.524 1.324 1.354 1.00 . A A . 39 PHE CD1 1 1 12 8436 1 1 39 PHE CD2 C -14.170 3.266 0.146 1.00 . A A . 39 PHE CD2 1 1 12 8437 1 1 39 PHE CE1 C -14.555 1.533 2.243 1.00 . A A . 39 PHE CE1 1 1 12 8438 1 1 39 PHE CE2 C -15.201 3.482 1.033 1.00 . A A . 39 PHE CE2 1 1 12 8439 1 1 39 PHE CG C -13.319 2.187 0.296 1.00 . A A . 39 PHE CG 1 1 12 8440 1 1 39 PHE CZ C -15.392 2.613 2.082 1.00 . A A . 39 PHE CZ 1 1 12 8441 1 1 39 PHE H H -10.649 4.516 0.580 1.00 . A A . 39 PHE H 1 1 12 8442 1 1 39 PHE HA H -10.657 2.302 0.763 1.00 . A A . 39 PHE HA 1 1 12 8443 1 1 39 PHE HB2 H -12.499 2.360 -1.624 1.00 . A A . 39 PHE HB2 1 1 12 8444 1 1 39 PHE HB3 H -12.063 0.884 -0.777 1.00 . A A . 39 PHE HB3 1 1 12 8445 1 1 39 PHE HD1 H -12.867 0.477 1.483 1.00 . A A . 39 PHE HD1 1 1 12 8446 1 1 39 PHE HD2 H -14.019 3.948 -0.679 1.00 . A A . 39 PHE HD2 1 1 12 8447 1 1 39 PHE HE1 H -14.710 0.853 3.069 1.00 . A A . 39 PHE HE1 1 1 12 8448 1 1 39 PHE HE2 H -15.858 4.329 0.904 1.00 . A A . 39 PHE HE2 1 1 12 8449 1 1 39 PHE HZ H -16.199 2.773 2.781 1.00 . A A . 39 PHE HZ 1 1 12 8450 1 1 39 PHE N N -10.902 4.068 -0.258 1.00 . A A . 39 PHE N 1 1 12 8451 1 1 39 PHE O O -9.543 0.806 -1.142 1.00 . A A . 39 PHE O 1 1 12 8452 1 1 40 ARG C C -6.586 2.487 -1.649 1.00 . A A . 40 ARG C 1 1 12 8453 1 1 40 ARG CA C -7.853 2.414 -2.506 1.00 . A A . 40 ARG CA 1 1 12 8454 1 1 40 ARG CB C -7.742 3.297 -3.765 1.00 . A A . 40 ARG CB 1 1 12 8455 1 1 40 ARG CD C -6.999 1.592 -5.477 1.00 . A A . 40 ARG CD 1 1 12 8456 1 1 40 ARG CG C -6.681 2.886 -4.763 1.00 . A A . 40 ARG CG 1 1 12 8457 1 1 40 ARG CZ C -6.011 0.753 -7.616 1.00 . A A . 40 ARG CZ 1 1 12 8458 1 1 40 ARG H H -9.147 3.809 -1.599 1.00 . A A . 40 ARG H 1 1 12 8459 1 1 40 ARG HA H -8.033 1.389 -2.793 1.00 . A A . 40 ARG HA 1 1 12 8460 1 1 40 ARG HB2 H -8.679 3.267 -4.298 1.00 . A A . 40 ARG HB2 1 1 12 8461 1 1 40 ARG HB3 H -7.534 4.313 -3.464 1.00 . A A . 40 ARG HB3 1 1 12 8462 1 1 40 ARG HD2 H -7.146 0.807 -4.749 1.00 . A A . 40 ARG HD2 1 1 12 8463 1 1 40 ARG HD3 H -7.896 1.726 -6.064 1.00 . A A . 40 ARG HD3 1 1 12 8464 1 1 40 ARG HE H -5.009 1.389 -5.974 1.00 . A A . 40 ARG HE 1 1 12 8465 1 1 40 ARG HG2 H -6.576 3.664 -5.505 1.00 . A A . 40 ARG HG2 1 1 12 8466 1 1 40 ARG HG3 H -5.749 2.766 -4.228 1.00 . A A . 40 ARG HG3 1 1 12 8467 1 1 40 ARG HH11 H -8.062 0.649 -7.623 1.00 . A A . 40 ARG HH11 1 1 12 8468 1 1 40 ARG HH12 H -7.338 0.143 -9.068 1.00 . A A . 40 ARG HH12 1 1 12 8469 1 1 40 ARG HH21 H -4.000 0.653 -7.916 1.00 . A A . 40 ARG HH21 1 1 12 8470 1 1 40 ARG HH22 H -4.911 0.173 -9.267 1.00 . A A . 40 ARG HH22 1 1 12 8471 1 1 40 ARG N N -8.959 2.855 -1.704 1.00 . A A . 40 ARG N 1 1 12 8472 1 1 40 ARG NE N -5.897 1.236 -6.364 1.00 . A A . 40 ARG NE 1 1 12 8473 1 1 40 ARG NH1 N -7.212 0.498 -8.137 1.00 . A A . 40 ARG NH1 1 1 12 8474 1 1 40 ARG NH2 N -4.912 0.500 -8.317 1.00 . A A . 40 ARG NH2 1 1 12 8475 1 1 40 ARG O O -6.556 3.207 -0.635 1.00 . A A . 40 ARG O 1 1 12 8476 1 1 41 CYS C C -3.389 2.805 -1.697 1.00 . A A . 41 CYS C 1 1 12 8477 1 1 41 CYS CA C -4.348 1.729 -1.279 1.00 . A A . 41 CYS CA 1 1 12 8478 1 1 41 CYS CB C -3.677 0.377 -1.337 1.00 . A A . 41 CYS CB 1 1 12 8479 1 1 41 CYS H H -5.656 1.166 -2.802 1.00 . A A . 41 CYS H 1 1 12 8480 1 1 41 CYS HA H -4.609 1.912 -0.247 1.00 . A A . 41 CYS HA 1 1 12 8481 1 1 41 CYS HB2 H -3.707 0.009 -2.351 1.00 . A A . 41 CYS HB2 1 1 12 8482 1 1 41 CYS HB3 H -2.647 0.474 -1.023 1.00 . A A . 41 CYS HB3 1 1 12 8483 1 1 41 CYS N N -5.583 1.742 -2.015 1.00 . A A . 41 CYS N 1 1 12 8484 1 1 41 CYS O O -3.000 2.910 -2.875 1.00 . A A . 41 CYS O 1 1 12 8485 1 1 41 CYS SG S -4.460 -0.850 -0.283 1.00 . A A . 41 CYS SG 1 1 12 8486 1 1 42 TRP C C -0.824 4.075 -0.110 1.00 . A A . 42 TRP C 1 1 12 8487 1 1 42 TRP CA C -2.029 4.596 -0.847 1.00 . A A . 42 TRP CA 1 1 12 8488 1 1 42 TRP CB C -2.489 5.911 -0.225 1.00 . A A . 42 TRP CB 1 1 12 8489 1 1 42 TRP CD1 C -2.535 7.940 -1.769 1.00 . A A . 42 TRP CD1 1 1 12 8490 1 1 42 TRP CD2 C -4.521 6.939 -1.570 1.00 . A A . 42 TRP CD2 1 1 12 8491 1 1 42 TRP CE2 C -4.659 8.053 -2.417 1.00 . A A . 42 TRP CE2 1 1 12 8492 1 1 42 TRP CE3 C -5.643 6.158 -1.316 1.00 . A A . 42 TRP CE3 1 1 12 8493 1 1 42 TRP CG C -3.144 6.890 -1.157 1.00 . A A . 42 TRP CG 1 1 12 8494 1 1 42 TRP CH2 C -6.948 7.617 -2.728 1.00 . A A . 42 TRP CH2 1 1 12 8495 1 1 42 TRP CZ2 C -5.869 8.402 -2.999 1.00 . A A . 42 TRP CZ2 1 1 12 8496 1 1 42 TRP CZ3 C -6.844 6.503 -1.896 1.00 . A A . 42 TRP CZ3 1 1 12 8497 1 1 42 TRP H H -3.436 3.470 0.157 1.00 . A A . 42 TRP H 1 1 12 8498 1 1 42 TRP HA H -1.791 4.735 -1.892 1.00 . A A . 42 TRP HA 1 1 12 8499 1 1 42 TRP HB2 H -3.206 5.682 0.549 1.00 . A A . 42 TRP HB2 1 1 12 8500 1 1 42 TRP HB3 H -1.638 6.390 0.232 1.00 . A A . 42 TRP HB3 1 1 12 8501 1 1 42 TRP HD1 H -1.487 8.181 -1.665 1.00 . A A . 42 TRP HD1 1 1 12 8502 1 1 42 TRP HE1 H -3.249 9.448 -3.049 1.00 . A A . 42 TRP HE1 1 1 12 8503 1 1 42 TRP HE3 H -5.581 5.284 -0.689 1.00 . A A . 42 TRP HE3 1 1 12 8504 1 1 42 TRP HH2 H -7.906 7.859 -3.164 1.00 . A A . 42 TRP HH2 1 1 12 8505 1 1 42 TRP HZ2 H -5.969 9.261 -3.647 1.00 . A A . 42 TRP HZ2 1 1 12 8506 1 1 42 TRP HZ3 H -7.722 5.905 -1.703 1.00 . A A . 42 TRP HZ3 1 1 12 8507 1 1 42 TRP N N -3.033 3.594 -0.734 1.00 . A A . 42 TRP N 1 1 12 8508 1 1 42 TRP NE1 N -3.442 8.646 -2.513 1.00 . A A . 42 TRP NE1 1 1 12 8509 1 1 42 TRP O O -0.773 4.092 1.116 1.00 . A A . 42 TRP O 1 1 12 8510 1 1 43 CYS C C 2.398 3.899 -0.169 1.00 . A A . 43 CYS C 1 1 12 8511 1 1 43 CYS CA C 1.228 2.949 -0.230 1.00 . A A . 43 CYS CA 1 1 12 8512 1 1 43 CYS CB C 1.547 1.643 -0.952 1.00 . A A . 43 CYS CB 1 1 12 8513 1 1 43 CYS H H 0.065 3.664 -1.804 1.00 . A A . 43 CYS H 1 1 12 8514 1 1 43 CYS HA H 0.943 2.711 0.785 1.00 . A A . 43 CYS HA 1 1 12 8515 1 1 43 CYS HB2 H 1.756 1.848 -1.991 1.00 . A A . 43 CYS HB2 1 1 12 8516 1 1 43 CYS HB3 H 2.404 1.177 -0.490 1.00 . A A . 43 CYS HB3 1 1 12 8517 1 1 43 CYS N N 0.102 3.571 -0.826 1.00 . A A . 43 CYS N 1 1 12 8518 1 1 43 CYS O O 2.593 4.743 -1.058 1.00 . A A . 43 CYS O 1 1 12 8519 1 1 43 CYS SG S 0.151 0.459 -0.864 1.00 . A A . 43 CYS SG 1 1 12 8520 1 1 44 THR C C 5.485 4.084 0.455 1.00 . A A . 44 THR C 1 1 12 8521 1 1 44 THR CA C 4.239 4.654 1.147 1.00 . A A . 44 THR CA 1 1 12 8522 1 1 44 THR CB C 4.458 4.766 2.669 1.00 . A A . 44 THR CB 1 1 12 8523 1 1 44 THR CG2 C 5.515 5.798 2.982 1.00 . A A . 44 THR CG2 1 1 12 8524 1 1 44 THR H H 2.926 3.110 1.563 1.00 . A A . 44 THR H 1 1 12 8525 1 1 44 THR HA H 4.020 5.636 0.753 1.00 . A A . 44 THR HA 1 1 12 8526 1 1 44 THR HB H 4.765 3.804 3.052 1.00 . A A . 44 THR HB 1 1 12 8527 1 1 44 THR HG1 H 2.889 5.928 2.824 1.00 . A A . 44 THR HG1 1 1 12 8528 1 1 44 THR HG21 H 5.223 6.746 2.554 1.00 . A A . 44 THR HG21 1 1 12 8529 1 1 44 THR HG22 H 6.458 5.480 2.565 1.00 . A A . 44 THR HG22 1 1 12 8530 1 1 44 THR HG23 H 5.609 5.904 4.053 1.00 . A A . 44 THR HG23 1 1 12 8531 1 1 44 THR N N 3.128 3.805 0.900 1.00 . A A . 44 THR N 1 1 12 8532 1 1 44 THR O O 5.945 2.985 0.788 1.00 . A A . 44 THR O 1 1 12 8533 1 1 44 THR OG1 O 3.216 5.157 3.302 1.00 . A A . 44 THR OG1 1 1 12 8534 1 1 45 LYS C C 8.312 5.323 -1.012 1.00 . A A . 45 LYS C 1 1 12 8535 1 1 45 LYS CA C 7.147 4.385 -1.276 1.00 . A A . 45 LYS CA 1 1 12 8536 1 1 45 LYS CB C 6.817 4.361 -2.772 1.00 . A A . 45 LYS CB 1 1 12 8537 1 1 45 LYS CD C 6.045 5.571 -4.815 1.00 . A A . 45 LYS CD 1 1 12 8538 1 1 45 LYS CE C 5.743 6.914 -5.459 1.00 . A A . 45 LYS CE 1 1 12 8539 1 1 45 LYS CG C 6.455 5.714 -3.367 1.00 . A A . 45 LYS CG 1 1 12 8540 1 1 45 LYS H H 5.572 5.677 -0.722 1.00 . A A . 45 LYS H 1 1 12 8541 1 1 45 LYS HA H 7.411 3.388 -0.957 1.00 . A A . 45 LYS HA 1 1 12 8542 1 1 45 LYS HB2 H 7.674 3.983 -3.310 1.00 . A A . 45 LYS HB2 1 1 12 8543 1 1 45 LYS HB3 H 5.984 3.690 -2.931 1.00 . A A . 45 LYS HB3 1 1 12 8544 1 1 45 LYS HD2 H 6.843 5.093 -5.359 1.00 . A A . 45 LYS HD2 1 1 12 8545 1 1 45 LYS HD3 H 5.159 4.953 -4.858 1.00 . A A . 45 LYS HD3 1 1 12 8546 1 1 45 LYS HE2 H 5.319 6.742 -6.437 1.00 . A A . 45 LYS HE2 1 1 12 8547 1 1 45 LYS HE3 H 5.015 7.428 -4.850 1.00 . A A . 45 LYS HE3 1 1 12 8548 1 1 45 LYS HG2 H 5.636 6.139 -2.806 1.00 . A A . 45 LYS HG2 1 1 12 8549 1 1 45 LYS HG3 H 7.313 6.368 -3.304 1.00 . A A . 45 LYS HG3 1 1 12 8550 1 1 45 LYS HZ1 H 7.660 7.305 -6.194 1.00 . A A . 45 LYS HZ1 1 1 12 8551 1 1 45 LYS HZ2 H 7.418 7.954 -4.686 1.00 . A A . 45 LYS HZ2 1 1 12 8552 1 1 45 LYS HZ3 H 6.712 8.681 -6.040 1.00 . A A . 45 LYS HZ3 1 1 12 8553 1 1 45 LYS N N 5.989 4.809 -0.513 1.00 . A A . 45 LYS N 1 1 12 8554 1 1 45 LYS NZ N 6.947 7.771 -5.595 1.00 . A A . 45 LYS NZ 1 1 12 8555 1 1 45 LYS O O 8.107 6.459 -0.583 1.00 . A A . 45 LYS O 1 1 12 8556 1 1 46 ASN C C 11.051 6.445 -2.277 1.00 . A A . 46 ASN C 1 1 12 8557 1 1 46 ASN CA C 10.700 5.653 -1.045 1.00 . A A . 46 ASN CA 1 1 12 8558 1 1 46 ASN CB C 11.891 4.786 -0.610 1.00 . A A . 46 ASN CB 1 1 12 8559 1 1 46 ASN CG C 11.766 4.246 0.804 1.00 . A A . 46 ASN CG 1 1 12 8560 1 1 46 ASN H H 9.598 3.945 -1.604 1.00 . A A . 46 ASN H 1 1 12 8561 1 1 46 ASN HA H 10.480 6.353 -0.251 1.00 . A A . 46 ASN HA 1 1 12 8562 1 1 46 ASN HB2 H 11.972 3.944 -1.282 1.00 . A A . 46 ASN HB2 1 1 12 8563 1 1 46 ASN HB3 H 12.795 5.373 -0.676 1.00 . A A . 46 ASN HB3 1 1 12 8564 1 1 46 ASN HD21 H 12.736 5.813 1.515 1.00 . A A . 46 ASN HD21 1 1 12 8565 1 1 46 ASN HD22 H 12.251 4.633 2.679 1.00 . A A . 46 ASN HD22 1 1 12 8566 1 1 46 ASN N N 9.504 4.860 -1.259 1.00 . A A . 46 ASN N 1 1 12 8567 1 1 46 ASN ND2 N 12.297 4.970 1.759 1.00 . A A . 46 ASN ND2 1 1 12 8568 1 1 46 ASN O O 11.135 5.907 -3.377 1.00 . A A . 46 ASN O 1 1 12 8569 1 1 46 ASN OD1 O 11.195 3.177 1.039 1.00 . A A . 46 ASN OD1 1 1 12 8570 1 1 47 CYS C C 12.936 9.200 -2.736 1.00 . A A . 47 CYS C 1 1 12 8571 1 1 47 CYS CA C 11.580 8.617 -3.126 1.00 . A A . 47 CYS CA 1 1 12 8572 1 1 47 CYS CB C 10.529 9.731 -3.265 1.00 . A A . 47 CYS CB 1 1 12 8573 1 1 47 CYS H H 11.049 8.112 -1.210 1.00 . A A . 47 CYS H 1 1 12 8574 1 1 47 CYS HA H 11.664 8.073 -4.055 1.00 . A A . 47 CYS HA 1 1 12 8575 1 1 47 CYS HB2 H 10.515 10.321 -2.361 1.00 . A A . 47 CYS HB2 1 1 12 8576 1 1 47 CYS HB3 H 10.784 10.366 -4.101 1.00 . A A . 47 CYS HB3 1 1 12 8577 1 1 47 CYS N N 11.198 7.710 -2.096 1.00 . A A . 47 CYS N 1 1 12 8578 1 1 47 CYS O O 12.992 10.193 -1.956 1.00 . A A . 47 CYS O 1 1 12 8579 1 1 47 CYS OXT O 13.962 8.640 -3.148 1.00 . A A . 47 CYS OXT 1 1 12 8580 1 1 47 CYS SG S 8.822 9.139 -3.524 1.00 . A A . 47 CYS SG 1 1 13 8581 1 1 1 LYS C C 9.970 10.347 1.544 1.00 . A A . 1 LYS C 1 1 13 8582 1 1 1 LYS CA C 10.922 11.505 1.757 1.00 . A A . 1 LYS CA 1 1 13 8583 1 1 1 LYS CB C 10.644 12.589 0.690 1.00 . A A . 1 LYS CB 1 1 13 8584 1 1 1 LYS CD C 8.969 14.035 -0.513 1.00 . A A . 1 LYS CD 1 1 13 8585 1 1 1 LYS CE C 7.544 14.570 -0.527 1.00 . A A . 1 LYS CE 1 1 13 8586 1 1 1 LYS CG C 9.229 13.162 0.704 1.00 . A A . 1 LYS CG 1 1 13 8587 1 1 1 LYS H1 H 12.994 11.741 1.773 1.00 . A A . 1 LYS H1 1 1 13 8588 1 1 1 LYS H2 H 12.396 10.681 0.605 1.00 . A A . 1 LYS H2 1 1 13 8589 1 1 1 LYS H3 H 12.472 10.191 2.212 1.00 . A A . 1 LYS H3 1 1 13 8590 1 1 1 LYS HA H 10.795 11.921 2.745 1.00 . A A . 1 LYS HA 1 1 13 8591 1 1 1 LYS HB2 H 11.334 13.407 0.839 1.00 . A A . 1 LYS HB2 1 1 13 8592 1 1 1 LYS HB3 H 10.824 12.160 -0.284 1.00 . A A . 1 LYS HB3 1 1 13 8593 1 1 1 LYS HD2 H 9.649 14.873 -0.496 1.00 . A A . 1 LYS HD2 1 1 13 8594 1 1 1 LYS HD3 H 9.137 13.451 -1.405 1.00 . A A . 1 LYS HD3 1 1 13 8595 1 1 1 LYS HE2 H 6.857 13.739 -0.448 1.00 . A A . 1 LYS HE2 1 1 13 8596 1 1 1 LYS HE3 H 7.409 15.225 0.320 1.00 . A A . 1 LYS HE3 1 1 13 8597 1 1 1 LYS HG2 H 8.521 12.346 0.711 1.00 . A A . 1 LYS HG2 1 1 13 8598 1 1 1 LYS HG3 H 9.104 13.756 1.598 1.00 . A A . 1 LYS HG3 1 1 13 8599 1 1 1 LYS HZ1 H 7.896 16.119 -1.904 1.00 . A A . 1 LYS HZ1 1 1 13 8600 1 1 1 LYS HZ2 H 6.283 15.702 -1.740 1.00 . A A . 1 LYS HZ2 1 1 13 8601 1 1 1 LYS HZ3 H 7.299 14.699 -2.604 1.00 . A A . 1 LYS HZ3 1 1 13 8602 1 1 1 LYS N N 12.287 11.005 1.593 1.00 . A A . 1 LYS N 1 1 13 8603 1 1 1 LYS NZ N 7.250 15.318 -1.768 1.00 . A A . 1 LYS NZ 1 1 13 8604 1 1 1 LYS O O 10.195 9.529 0.685 1.00 . A A . 1 LYS O 1 1 13 8605 1 1 2 THR C C 6.971 9.659 1.070 1.00 . A A . 2 THR C 1 1 13 8606 1 1 2 THR CA C 7.990 9.210 2.079 1.00 . A A . 2 THR CA 1 1 13 8607 1 1 2 THR CB C 7.330 8.718 3.355 1.00 . A A . 2 THR CB 1 1 13 8608 1 1 2 THR CG2 C 8.228 7.719 4.053 1.00 . A A . 2 THR CG2 1 1 13 8609 1 1 2 THR H H 8.788 10.869 3.060 1.00 . A A . 2 THR H 1 1 13 8610 1 1 2 THR HA H 8.539 8.391 1.637 1.00 . A A . 2 THR HA 1 1 13 8611 1 1 2 THR HB H 6.412 8.226 3.069 1.00 . A A . 2 THR HB 1 1 13 8612 1 1 2 THR HG1 H 6.829 10.609 3.689 1.00 . A A . 2 THR HG1 1 1 13 8613 1 1 2 THR HG21 H 9.154 8.203 4.324 1.00 . A A . 2 THR HG21 1 1 13 8614 1 1 2 THR HG22 H 8.447 6.911 3.368 1.00 . A A . 2 THR HG22 1 1 13 8615 1 1 2 THR HG23 H 7.742 7.333 4.936 1.00 . A A . 2 THR HG23 1 1 13 8616 1 1 2 THR N N 8.943 10.242 2.318 1.00 . A A . 2 THR N 1 1 13 8617 1 1 2 THR O O 6.354 10.709 1.214 1.00 . A A . 2 THR O 1 1 13 8618 1 1 2 THR OG1 O 7.046 9.832 4.222 1.00 . A A . 2 THR OG1 1 1 13 8619 1 1 3 CYS C C 4.784 8.240 -0.999 1.00 . A A . 3 CYS C 1 1 13 8620 1 1 3 CYS CA C 5.942 9.214 -1.013 1.00 . A A . 3 CYS CA 1 1 13 8621 1 1 3 CYS CB C 6.723 9.176 -2.321 1.00 . A A . 3 CYS CB 1 1 13 8622 1 1 3 CYS H H 7.319 8.046 0.017 1.00 . A A . 3 CYS H 1 1 13 8623 1 1 3 CYS HA H 5.566 10.213 -0.854 1.00 . A A . 3 CYS HA 1 1 13 8624 1 1 3 CYS HB2 H 6.032 9.167 -3.152 1.00 . A A . 3 CYS HB2 1 1 13 8625 1 1 3 CYS HB3 H 7.357 10.048 -2.386 1.00 . A A . 3 CYS HB3 1 1 13 8626 1 1 3 CYS N N 6.829 8.898 0.057 1.00 . A A . 3 CYS N 1 1 13 8627 1 1 3 CYS O O 4.980 7.014 -0.900 1.00 . A A . 3 CYS O 1 1 13 8628 1 1 3 CYS SG S 7.784 7.706 -2.449 1.00 . A A . 3 CYS SG 1 1 13 8629 1 1 4 GLU C C 1.771 7.952 -2.364 1.00 . A A . 4 GLU C 1 1 13 8630 1 1 4 GLU CA C 2.402 7.993 -0.972 1.00 . A A . 4 GLU CA 1 1 13 8631 1 1 4 GLU CB C 1.472 8.633 0.062 1.00 . A A . 4 GLU CB 1 1 13 8632 1 1 4 GLU CD C -0.626 8.538 1.417 1.00 . A A . 4 GLU CD 1 1 13 8633 1 1 4 GLU CG C 0.216 7.856 0.372 1.00 . A A . 4 GLU CG 1 1 13 8634 1 1 4 GLU H H 3.501 9.746 -1.148 1.00 . A A . 4 GLU H 1 1 13 8635 1 1 4 GLU HA H 2.659 6.992 -0.658 1.00 . A A . 4 GLU HA 1 1 13 8636 1 1 4 GLU HB2 H 2.017 8.761 0.986 1.00 . A A . 4 GLU HB2 1 1 13 8637 1 1 4 GLU HB3 H 1.185 9.608 -0.303 1.00 . A A . 4 GLU HB3 1 1 13 8638 1 1 4 GLU HG2 H -0.364 7.776 -0.533 1.00 . A A . 4 GLU HG2 1 1 13 8639 1 1 4 GLU HG3 H 0.488 6.873 0.726 1.00 . A A . 4 GLU HG3 1 1 13 8640 1 1 4 GLU N N 3.599 8.774 -1.041 1.00 . A A . 4 GLU N 1 1 13 8641 1 1 4 GLU O O 1.312 8.972 -2.880 1.00 . A A . 4 GLU O 1 1 13 8642 1 1 4 GLU OE1 O -0.504 8.201 2.614 1.00 . A A . 4 GLU OE1 1 1 13 8643 1 1 4 GLU OE2 O -1.396 9.458 1.070 1.00 . A A . 4 GLU OE2 1 1 13 8644 1 1 5 ASN C C 0.385 5.437 -4.445 1.00 . A A . 5 ASN C 1 1 13 8645 1 1 5 ASN CA C 1.298 6.639 -4.335 1.00 . A A . 5 ASN CA 1 1 13 8646 1 1 5 ASN CB C 2.472 6.525 -5.336 1.00 . A A . 5 ASN CB 1 1 13 8647 1 1 5 ASN CG C 3.433 5.368 -5.056 1.00 . A A . 5 ASN CG 1 1 13 8648 1 1 5 ASN H H 2.117 6.007 -2.489 1.00 . A A . 5 ASN H 1 1 13 8649 1 1 5 ASN HA H 0.726 7.522 -4.578 1.00 . A A . 5 ASN HA 1 1 13 8650 1 1 5 ASN HB2 H 2.071 6.380 -6.328 1.00 . A A . 5 ASN HB2 1 1 13 8651 1 1 5 ASN HB3 H 3.035 7.448 -5.318 1.00 . A A . 5 ASN HB3 1 1 13 8652 1 1 5 ASN HD21 H 2.428 4.171 -6.262 1.00 . A A . 5 ASN HD21 1 1 13 8653 1 1 5 ASN HD22 H 3.805 3.485 -5.502 1.00 . A A . 5 ASN HD22 1 1 13 8654 1 1 5 ASN N N 1.786 6.799 -2.973 1.00 . A A . 5 ASN N 1 1 13 8655 1 1 5 ASN ND2 N 3.198 4.239 -5.661 1.00 . A A . 5 ASN ND2 1 1 13 8656 1 1 5 ASN O O 0.575 4.449 -3.752 1.00 . A A . 5 ASN O 1 1 13 8657 1 1 5 ASN OD1 O 4.408 5.514 -4.317 1.00 . A A . 5 ASN OD1 1 1 13 8658 1 1 6 LEU C C -1.006 3.145 -5.955 1.00 . A A . 6 LEU C 1 1 13 8659 1 1 6 LEU CA C -1.587 4.464 -5.502 1.00 . A A . 6 LEU CA 1 1 13 8660 1 1 6 LEU CB C -2.688 4.894 -6.463 1.00 . A A . 6 LEU CB 1 1 13 8661 1 1 6 LEU CD1 C -4.648 6.317 -6.974 1.00 . A A . 6 LEU CD1 1 1 13 8662 1 1 6 LEU CD2 C -4.569 5.053 -4.887 1.00 . A A . 6 LEU CD2 1 1 13 8663 1 1 6 LEU CG C -3.745 5.812 -5.887 1.00 . A A . 6 LEU CG 1 1 13 8664 1 1 6 LEU H H -0.675 6.339 -5.862 1.00 . A A . 6 LEU H 1 1 13 8665 1 1 6 LEU HA H -2.047 4.301 -4.540 1.00 . A A . 6 LEU HA 1 1 13 8666 1 1 6 LEU HB2 H -2.233 5.388 -7.307 1.00 . A A . 6 LEU HB2 1 1 13 8667 1 1 6 LEU HB3 H -3.183 4.003 -6.821 1.00 . A A . 6 LEU HB3 1 1 13 8668 1 1 6 LEU HD11 H -5.381 6.972 -6.528 1.00 . A A . 6 LEU HD11 1 1 13 8669 1 1 6 LEU HD12 H -5.148 5.468 -7.418 1.00 . A A . 6 LEU HD12 1 1 13 8670 1 1 6 LEU HD13 H -4.074 6.850 -7.715 1.00 . A A . 6 LEU HD13 1 1 13 8671 1 1 6 LEU HD21 H -5.018 4.199 -5.373 1.00 . A A . 6 LEU HD21 1 1 13 8672 1 1 6 LEU HD22 H -5.349 5.697 -4.508 1.00 . A A . 6 LEU HD22 1 1 13 8673 1 1 6 LEU HD23 H -3.954 4.720 -4.065 1.00 . A A . 6 LEU HD23 1 1 13 8674 1 1 6 LEU HG H -3.288 6.648 -5.377 1.00 . A A . 6 LEU HG 1 1 13 8675 1 1 6 LEU N N -0.598 5.526 -5.315 1.00 . A A . 6 LEU N 1 1 13 8676 1 1 6 LEU O O -0.061 3.094 -6.764 1.00 . A A . 6 LEU O 1 1 13 8677 1 1 7 ALA C C -1.954 0.381 -7.066 1.00 . A A . 7 ALA C 1 1 13 8678 1 1 7 ALA CA C -1.221 0.745 -5.793 1.00 . A A . 7 ALA CA 1 1 13 8679 1 1 7 ALA CB C -1.602 -0.220 -4.686 1.00 . A A . 7 ALA CB 1 1 13 8680 1 1 7 ALA H H -2.261 2.224 -4.734 1.00 . A A . 7 ALA H 1 1 13 8681 1 1 7 ALA HA H -0.154 0.695 -5.951 1.00 . A A . 7 ALA HA 1 1 13 8682 1 1 7 ALA HB1 H -2.666 -0.160 -4.508 1.00 . A A . 7 ALA HB1 1 1 13 8683 1 1 7 ALA HB2 H -1.074 0.039 -3.781 1.00 . A A . 7 ALA HB2 1 1 13 8684 1 1 7 ALA HB3 H -1.344 -1.228 -4.977 1.00 . A A . 7 ALA HB3 1 1 13 8685 1 1 7 ALA N N -1.571 2.088 -5.422 1.00 . A A . 7 ALA N 1 1 13 8686 1 1 7 ALA O O -3.165 0.596 -7.179 1.00 . A A . 7 ALA O 1 1 13 8687 1 1 8 ASP C C -2.137 -1.995 -9.235 1.00 . A A . 8 ASP C 1 1 13 8688 1 1 8 ASP CA C -1.831 -0.523 -9.281 1.00 . A A . 8 ASP CA 1 1 13 8689 1 1 8 ASP CB C -0.888 -0.232 -10.443 1.00 . A A . 8 ASP CB 1 1 13 8690 1 1 8 ASP CG C -1.476 -0.587 -11.792 1.00 . A A . 8 ASP CG 1 1 13 8691 1 1 8 ASP H H -0.269 -0.206 -7.899 1.00 . A A . 8 ASP H 1 1 13 8692 1 1 8 ASP HA H -2.749 0.026 -9.422 1.00 . A A . 8 ASP HA 1 1 13 8693 1 1 8 ASP HB2 H -0.649 0.822 -10.443 1.00 . A A . 8 ASP HB2 1 1 13 8694 1 1 8 ASP HB3 H 0.019 -0.801 -10.304 1.00 . A A . 8 ASP HB3 1 1 13 8695 1 1 8 ASP N N -1.238 -0.113 -8.024 1.00 . A A . 8 ASP N 1 1 13 8696 1 1 8 ASP O O -3.167 -2.449 -9.732 1.00 . A A . 8 ASP O 1 1 13 8697 1 1 8 ASP OD1 O -1.197 -1.689 -12.315 1.00 . A A . 8 ASP OD1 1 1 13 8698 1 1 8 ASP OD2 O -2.211 0.242 -12.362 1.00 . A A . 8 ASP OD2 1 1 13 8699 1 1 9 THR C C -2.526 -4.568 -7.544 1.00 . A A . 9 THR C 1 1 13 8700 1 1 9 THR CA C -1.379 -4.158 -8.493 1.00 . A A . 9 THR CA 1 1 13 8701 1 1 9 THR CB C -0.049 -4.730 -8.001 1.00 . A A . 9 THR CB 1 1 13 8702 1 1 9 THR CG2 C -0.004 -6.220 -8.218 1.00 . A A . 9 THR CG2 1 1 13 8703 1 1 9 THR H H -0.469 -2.340 -8.171 1.00 . A A . 9 THR H 1 1 13 8704 1 1 9 THR HA H -1.573 -4.553 -9.479 1.00 . A A . 9 THR HA 1 1 13 8705 1 1 9 THR HB H 0.074 -4.511 -6.951 1.00 . A A . 9 THR HB 1 1 13 8706 1 1 9 THR HG1 H 1.815 -4.165 -8.187 1.00 . A A . 9 THR HG1 1 1 13 8707 1 1 9 THR HG21 H 0.934 -6.597 -7.840 1.00 . A A . 9 THR HG21 1 1 13 8708 1 1 9 THR HG22 H -0.083 -6.415 -9.277 1.00 . A A . 9 THR HG22 1 1 13 8709 1 1 9 THR HG23 H -0.828 -6.680 -7.692 1.00 . A A . 9 THR HG23 1 1 13 8710 1 1 9 THR N N -1.262 -2.736 -8.593 1.00 . A A . 9 THR N 1 1 13 8711 1 1 9 THR O O -3.067 -5.680 -7.645 1.00 . A A . 9 THR O 1 1 13 8712 1 1 9 THR OG1 O 1.026 -4.129 -8.760 1.00 . A A . 9 THR OG1 1 1 13 8713 1 1 10 TYR C C -5.309 -3.799 -6.403 1.00 . A A . 10 TYR C 1 1 13 8714 1 1 10 TYR CA C -3.963 -3.971 -5.718 1.00 . A A . 10 TYR CA 1 1 13 8715 1 1 10 TYR CB C -3.860 -3.084 -4.471 1.00 . A A . 10 TYR CB 1 1 13 8716 1 1 10 TYR CD1 C -5.990 -3.253 -3.105 1.00 . A A . 10 TYR CD1 1 1 13 8717 1 1 10 TYR CD2 C -4.067 -4.415 -2.350 1.00 . A A . 10 TYR CD2 1 1 13 8718 1 1 10 TYR CE1 C -6.702 -3.728 -2.021 1.00 . A A . 10 TYR CE1 1 1 13 8719 1 1 10 TYR CE2 C -4.768 -4.891 -1.269 1.00 . A A . 10 TYR CE2 1 1 13 8720 1 1 10 TYR CG C -4.659 -3.590 -3.287 1.00 . A A . 10 TYR CG 1 1 13 8721 1 1 10 TYR CZ C -6.086 -4.546 -1.107 1.00 . A A . 10 TYR CZ 1 1 13 8722 1 1 10 TYR H H -2.491 -2.791 -6.646 1.00 . A A . 10 TYR H 1 1 13 8723 1 1 10 TYR HA H -3.855 -5.007 -5.431 1.00 . A A . 10 TYR HA 1 1 13 8724 1 1 10 TYR HB2 H -2.825 -3.020 -4.168 1.00 . A A . 10 TYR HB2 1 1 13 8725 1 1 10 TYR HB3 H -4.218 -2.095 -4.715 1.00 . A A . 10 TYR HB3 1 1 13 8726 1 1 10 TYR HD1 H -6.483 -2.611 -3.821 1.00 . A A . 10 TYR HD1 1 1 13 8727 1 1 10 TYR HD2 H -3.030 -4.688 -2.475 1.00 . A A . 10 TYR HD2 1 1 13 8728 1 1 10 TYR HE1 H -7.738 -3.445 -1.907 1.00 . A A . 10 TYR HE1 1 1 13 8729 1 1 10 TYR HE2 H -4.264 -5.532 -0.562 1.00 . A A . 10 TYR HE2 1 1 13 8730 1 1 10 TYR HH H -6.257 -4.923 0.765 1.00 . A A . 10 TYR HH 1 1 13 8731 1 1 10 TYR N N -2.915 -3.672 -6.660 1.00 . A A . 10 TYR N 1 1 13 8732 1 1 10 TYR O O -5.795 -2.680 -6.606 1.00 . A A . 10 TYR O 1 1 13 8733 1 1 10 TYR OH O -6.794 -5.028 -0.027 1.00 . A A . 10 TYR OH 1 1 13 8734 1 1 11 LYS C C -8.242 -5.275 -6.518 1.00 . A A . 11 LYS C 1 1 13 8735 1 1 11 LYS CA C -7.125 -4.915 -7.491 1.00 . A A . 11 LYS CA 1 1 13 8736 1 1 11 LYS CB C -7.051 -5.847 -8.721 1.00 . A A . 11 LYS CB 1 1 13 8737 1 1 11 LYS CD C -6.187 -7.998 -9.714 1.00 . A A . 11 LYS CD 1 1 13 8738 1 1 11 LYS CE C -5.516 -9.331 -9.409 1.00 . A A . 11 LYS CE 1 1 13 8739 1 1 11 LYS CG C -6.431 -7.211 -8.439 1.00 . A A . 11 LYS CG 1 1 13 8740 1 1 11 LYS H H -5.399 -5.739 -6.642 1.00 . A A . 11 LYS H 1 1 13 8741 1 1 11 LYS HA H -7.307 -3.906 -7.831 1.00 . A A . 11 LYS HA 1 1 13 8742 1 1 11 LYS HB2 H -8.052 -6.004 -9.095 1.00 . A A . 11 LYS HB2 1 1 13 8743 1 1 11 LYS HB3 H -6.468 -5.360 -9.489 1.00 . A A . 11 LYS HB3 1 1 13 8744 1 1 11 LYS HD2 H -7.135 -8.176 -10.199 1.00 . A A . 11 LYS HD2 1 1 13 8745 1 1 11 LYS HD3 H -5.550 -7.422 -10.368 1.00 . A A . 11 LYS HD3 1 1 13 8746 1 1 11 LYS HE2 H -4.607 -9.143 -8.859 1.00 . A A . 11 LYS HE2 1 1 13 8747 1 1 11 LYS HE3 H -6.184 -9.925 -8.802 1.00 . A A . 11 LYS HE3 1 1 13 8748 1 1 11 LYS HG2 H -5.485 -7.067 -7.939 1.00 . A A . 11 LYS HG2 1 1 13 8749 1 1 11 LYS HG3 H -7.094 -7.771 -7.798 1.00 . A A . 11 LYS HG3 1 1 13 8750 1 1 11 LYS HZ1 H -4.508 -9.559 -11.231 1.00 . A A . 11 LYS HZ1 1 1 13 8751 1 1 11 LYS HZ2 H -6.034 -10.281 -11.198 1.00 . A A . 11 LYS HZ2 1 1 13 8752 1 1 11 LYS HZ3 H -4.749 -10.999 -10.386 1.00 . A A . 11 LYS HZ3 1 1 13 8753 1 1 11 LYS N N -5.863 -4.893 -6.813 1.00 . A A . 11 LYS N 1 1 13 8754 1 1 11 LYS NZ N -5.180 -10.087 -10.638 1.00 . A A . 11 LYS NZ 1 1 13 8755 1 1 11 LYS O O -8.363 -6.425 -6.066 1.00 . A A . 11 LYS O 1 1 13 8756 1 1 12 GLY C C -9.959 -3.347 -4.146 1.00 . A A . 12 GLY C 1 1 13 8757 1 1 12 GLY CA C -10.063 -4.426 -5.206 1.00 . A A . 12 GLY CA 1 1 13 8758 1 1 12 GLY H H -8.848 -3.388 -6.537 1.00 . A A . 12 GLY H 1 1 13 8759 1 1 12 GLY HA2 H -11.006 -4.344 -5.725 1.00 . A A . 12 GLY HA2 1 1 13 8760 1 1 12 GLY HA3 H -9.992 -5.393 -4.734 1.00 . A A . 12 GLY HA3 1 1 13 8761 1 1 12 GLY N N -9.002 -4.279 -6.159 1.00 . A A . 12 GLY N 1 1 13 8762 1 1 12 GLY O O -8.915 -2.692 -4.055 1.00 . A A . 12 GLY O 1 1 13 8763 1 1 13 PRO C C -10.288 -2.692 -1.048 1.00 . A A . 13 PRO C 1 1 13 8764 1 1 13 PRO CA C -10.976 -2.115 -2.285 1.00 . A A . 13 PRO CA 1 1 13 8765 1 1 13 PRO CB C -12.461 -1.825 -1.987 1.00 . A A . 13 PRO CB 1 1 13 8766 1 1 13 PRO CD C -12.351 -3.670 -3.510 1.00 . A A . 13 PRO CD 1 1 13 8767 1 1 13 PRO CG C -13.231 -2.548 -3.049 1.00 . A A . 13 PRO CG 1 1 13 8768 1 1 13 PRO HA H -10.469 -1.206 -2.570 1.00 . A A . 13 PRO HA 1 1 13 8769 1 1 13 PRO HB2 H -12.706 -2.197 -1.002 1.00 . A A . 13 PRO HB2 1 1 13 8770 1 1 13 PRO HB3 H -12.640 -0.761 -2.027 1.00 . A A . 13 PRO HB3 1 1 13 8771 1 1 13 PRO HD2 H -12.467 -4.532 -2.870 1.00 . A A . 13 PRO HD2 1 1 13 8772 1 1 13 PRO HD3 H -12.567 -3.921 -4.537 1.00 . A A . 13 PRO HD3 1 1 13 8773 1 1 13 PRO HG2 H -14.149 -2.938 -2.634 1.00 . A A . 13 PRO HG2 1 1 13 8774 1 1 13 PRO HG3 H -13.446 -1.878 -3.869 1.00 . A A . 13 PRO HG3 1 1 13 8775 1 1 13 PRO N N -11.018 -3.087 -3.374 1.00 . A A . 13 PRO N 1 1 13 8776 1 1 13 PRO O O -10.215 -3.921 -0.868 1.00 . A A . 13 PRO O 1 1 13 8777 1 1 14 CYS C C -10.075 -2.369 2.137 1.00 . A A . 14 CYS C 1 1 13 8778 1 1 14 CYS CA C -9.108 -2.240 0.979 1.00 . A A . 14 CYS CA 1 1 13 8779 1 1 14 CYS CB C -7.981 -1.278 1.360 1.00 . A A . 14 CYS CB 1 1 13 8780 1 1 14 CYS H H -9.847 -0.870 -0.419 1.00 . A A . 14 CYS H 1 1 13 8781 1 1 14 CYS HA H -8.672 -3.210 0.790 1.00 . A A . 14 CYS HA 1 1 13 8782 1 1 14 CYS HB2 H -7.221 -1.294 0.593 1.00 . A A . 14 CYS HB2 1 1 13 8783 1 1 14 CYS HB3 H -8.381 -0.278 1.448 1.00 . A A . 14 CYS HB3 1 1 13 8784 1 1 14 CYS N N -9.777 -1.831 -0.221 1.00 . A A . 14 CYS N 1 1 13 8785 1 1 14 CYS O O -10.659 -1.380 2.602 1.00 . A A . 14 CYS O 1 1 13 8786 1 1 14 CYS SG S -7.190 -1.709 2.951 1.00 . A A . 14 CYS SG 1 1 13 8787 1 1 15 PHE C C -10.090 -4.195 4.860 1.00 . A A . 15 PHE C 1 1 13 8788 1 1 15 PHE CA C -11.049 -3.854 3.739 1.00 . A A . 15 PHE CA 1 1 13 8789 1 1 15 PHE CB C -12.039 -4.992 3.471 1.00 . A A . 15 PHE CB 1 1 13 8790 1 1 15 PHE CD1 C -12.833 -5.053 1.085 1.00 . A A . 15 PHE CD1 1 1 13 8791 1 1 15 PHE CD2 C -14.164 -3.911 2.694 1.00 . A A . 15 PHE CD2 1 1 13 8792 1 1 15 PHE CE1 C -13.738 -4.722 0.098 1.00 . A A . 15 PHE CE1 1 1 13 8793 1 1 15 PHE CE2 C -15.072 -3.580 1.712 1.00 . A A . 15 PHE CE2 1 1 13 8794 1 1 15 PHE CG C -13.035 -4.652 2.395 1.00 . A A . 15 PHE CG 1 1 13 8795 1 1 15 PHE CZ C -14.860 -3.985 0.411 1.00 . A A . 15 PHE CZ 1 1 13 8796 1 1 15 PHE H H -9.862 -4.326 2.082 1.00 . A A . 15 PHE H 1 1 13 8797 1 1 15 PHE HA H -11.588 -2.952 3.992 1.00 . A A . 15 PHE HA 1 1 13 8798 1 1 15 PHE HB2 H -11.495 -5.871 3.159 1.00 . A A . 15 PHE HB2 1 1 13 8799 1 1 15 PHE HB3 H -12.585 -5.211 4.377 1.00 . A A . 15 PHE HB3 1 1 13 8800 1 1 15 PHE HD1 H -11.955 -5.633 0.835 1.00 . A A . 15 PHE HD1 1 1 13 8801 1 1 15 PHE HD2 H -14.335 -3.591 3.712 1.00 . A A . 15 PHE HD2 1 1 13 8802 1 1 15 PHE HE1 H -13.569 -5.038 -0.921 1.00 . A A . 15 PHE HE1 1 1 13 8803 1 1 15 PHE HE2 H -15.948 -3.001 1.962 1.00 . A A . 15 PHE HE2 1 1 13 8804 1 1 15 PHE HZ H -15.570 -3.722 -0.359 1.00 . A A . 15 PHE HZ 1 1 13 8805 1 1 15 PHE N N -10.267 -3.578 2.570 1.00 . A A . 15 PHE N 1 1 13 8806 1 1 15 PHE O O -10.163 -3.642 5.956 1.00 . A A . 15 PHE O 1 1 13 8807 1 1 16 THR C C -6.904 -4.565 5.175 1.00 . A A . 16 THR C 1 1 13 8808 1 1 16 THR CA C -8.129 -5.417 5.488 1.00 . A A . 16 THR CA 1 1 13 8809 1 1 16 THR CB C -7.749 -6.891 5.370 1.00 . A A . 16 THR CB 1 1 13 8810 1 1 16 THR CG2 C -6.821 -7.305 6.504 1.00 . A A . 16 THR CG2 1 1 13 8811 1 1 16 THR H H -9.166 -5.513 3.688 1.00 . A A . 16 THR H 1 1 13 8812 1 1 16 THR HA H -8.477 -5.209 6.488 1.00 . A A . 16 THR HA 1 1 13 8813 1 1 16 THR HB H -7.220 -6.991 4.436 1.00 . A A . 16 THR HB 1 1 13 8814 1 1 16 THR HG1 H -8.719 -8.545 4.987 1.00 . A A . 16 THR HG1 1 1 13 8815 1 1 16 THR HG21 H -6.557 -8.346 6.390 1.00 . A A . 16 THR HG21 1 1 13 8816 1 1 16 THR HG22 H -7.322 -7.163 7.450 1.00 . A A . 16 THR HG22 1 1 13 8817 1 1 16 THR HG23 H -5.926 -6.700 6.478 1.00 . A A . 16 THR HG23 1 1 13 8818 1 1 16 THR N N -9.161 -5.072 4.563 1.00 . A A . 16 THR N 1 1 13 8819 1 1 16 THR O O -6.170 -4.824 4.192 1.00 . A A . 16 THR O 1 1 13 8820 1 1 16 THR OG1 O -8.934 -7.707 5.413 1.00 . A A . 16 THR OG1 1 1 13 8821 1 1 17 THR C C -4.277 -3.362 5.915 1.00 . A A . 17 THR C 1 1 13 8822 1 1 17 THR CA C -5.618 -2.626 5.859 1.00 . A A . 17 THR CA 1 1 13 8823 1 1 17 THR CB C -5.692 -1.635 7.023 1.00 . A A . 17 THR CB 1 1 13 8824 1 1 17 THR CG2 C -4.852 -0.405 6.744 1.00 . A A . 17 THR CG2 1 1 13 8825 1 1 17 THR H H -7.316 -3.441 6.741 1.00 . A A . 17 THR H 1 1 13 8826 1 1 17 THR HA H -5.717 -2.081 4.932 1.00 . A A . 17 THR HA 1 1 13 8827 1 1 17 THR HB H -5.330 -2.124 7.916 1.00 . A A . 17 THR HB 1 1 13 8828 1 1 17 THR HG1 H -7.340 -0.655 6.500 1.00 . A A . 17 THR HG1 1 1 13 8829 1 1 17 THR HG21 H -5.213 0.084 5.850 1.00 . A A . 17 THR HG21 1 1 13 8830 1 1 17 THR HG22 H -3.825 -0.705 6.601 1.00 . A A . 17 THR HG22 1 1 13 8831 1 1 17 THR HG23 H -4.918 0.273 7.580 1.00 . A A . 17 THR HG23 1 1 13 8832 1 1 17 THR N N -6.701 -3.566 5.988 1.00 . A A . 17 THR N 1 1 13 8833 1 1 17 THR O O -3.351 -3.062 5.156 1.00 . A A . 17 THR O 1 1 13 8834 1 1 17 THR OG1 O -7.066 -1.243 7.218 1.00 . A A . 17 THR OG1 1 1 13 8835 1 1 18 GLY C C -2.564 -5.862 5.720 1.00 . A A . 18 GLY C 1 1 13 8836 1 1 18 GLY CA C -3.018 -5.146 6.968 1.00 . A A . 18 GLY CA 1 1 13 8837 1 1 18 GLY H H -5.056 -4.640 7.229 1.00 . A A . 18 GLY H 1 1 13 8838 1 1 18 GLY HA2 H -2.239 -4.470 7.289 1.00 . A A . 18 GLY HA2 1 1 13 8839 1 1 18 GLY HA3 H -3.195 -5.873 7.745 1.00 . A A . 18 GLY HA3 1 1 13 8840 1 1 18 GLY N N -4.229 -4.391 6.756 1.00 . A A . 18 GLY N 1 1 13 8841 1 1 18 GLY O O -1.369 -5.925 5.435 1.00 . A A . 18 GLY O 1 1 13 8842 1 1 19 SER C C -2.805 -6.126 2.620 1.00 . A A . 19 SER C 1 1 13 8843 1 1 19 SER CA C -3.218 -7.079 3.740 1.00 . A A . 19 SER CA 1 1 13 8844 1 1 19 SER CB C -4.416 -7.951 3.334 1.00 . A A . 19 SER CB 1 1 13 8845 1 1 19 SER H H -4.452 -6.180 5.186 1.00 . A A . 19 SER H 1 1 13 8846 1 1 19 SER HA H -2.375 -7.718 3.959 1.00 . A A . 19 SER HA 1 1 13 8847 1 1 19 SER HB2 H -4.715 -8.561 4.174 1.00 . A A . 19 SER HB2 1 1 13 8848 1 1 19 SER HB3 H -5.237 -7.312 3.045 1.00 . A A . 19 SER HB3 1 1 13 8849 1 1 19 SER HG H -3.962 -9.695 2.598 1.00 . A A . 19 SER HG 1 1 13 8850 1 1 19 SER N N -3.518 -6.336 4.941 1.00 . A A . 19 SER N 1 1 13 8851 1 1 19 SER O O -2.010 -6.487 1.755 1.00 . A A . 19 SER O 1 1 13 8852 1 1 19 SER OG O -4.097 -8.805 2.247 1.00 . A A . 19 SER OG 1 1 13 8853 1 1 20 CYS C C -1.520 -3.437 1.979 1.00 . A A . 20 CYS C 1 1 13 8854 1 1 20 CYS CA C -2.937 -3.885 1.690 1.00 . A A . 20 CYS CA 1 1 13 8855 1 1 20 CYS CB C -3.892 -2.704 1.749 1.00 . A A . 20 CYS CB 1 1 13 8856 1 1 20 CYS H H -3.955 -4.669 3.369 1.00 . A A . 20 CYS H 1 1 13 8857 1 1 20 CYS HA H -2.967 -4.330 0.707 1.00 . A A . 20 CYS HA 1 1 13 8858 1 1 20 CYS HB2 H -4.866 -3.014 1.402 1.00 . A A . 20 CYS HB2 1 1 13 8859 1 1 20 CYS HB3 H -3.972 -2.366 2.772 1.00 . A A . 20 CYS HB3 1 1 13 8860 1 1 20 CYS N N -3.316 -4.903 2.661 1.00 . A A . 20 CYS N 1 1 13 8861 1 1 20 CYS O O -0.685 -3.301 1.074 1.00 . A A . 20 CYS O 1 1 13 8862 1 1 20 CYS SG S -3.382 -1.287 0.743 1.00 . A A . 20 CYS SG 1 1 13 8863 1 1 21 ASP C C 1.061 -3.998 3.328 1.00 . A A . 21 ASP C 1 1 13 8864 1 1 21 ASP CA C 0.075 -2.919 3.731 1.00 . A A . 21 ASP CA 1 1 13 8865 1 1 21 ASP CB C 0.035 -2.763 5.246 1.00 . A A . 21 ASP CB 1 1 13 8866 1 1 21 ASP CG C 1.383 -2.552 5.853 1.00 . A A . 21 ASP CG 1 1 13 8867 1 1 21 ASP H H -1.974 -3.326 3.912 1.00 . A A . 21 ASP H 1 1 13 8868 1 1 21 ASP HA H 0.373 -1.980 3.290 1.00 . A A . 21 ASP HA 1 1 13 8869 1 1 21 ASP HB2 H -0.580 -1.910 5.493 1.00 . A A . 21 ASP HB2 1 1 13 8870 1 1 21 ASP HB3 H -0.407 -3.648 5.680 1.00 . A A . 21 ASP HB3 1 1 13 8871 1 1 21 ASP N N -1.245 -3.258 3.254 1.00 . A A . 21 ASP N 1 1 13 8872 1 1 21 ASP O O 2.132 -3.717 2.792 1.00 . A A . 21 ASP O 1 1 13 8873 1 1 21 ASP OD1 O 1.959 -1.445 5.704 1.00 . A A . 21 ASP OD1 1 1 13 8874 1 1 21 ASP OD2 O 1.881 -3.479 6.543 1.00 . A A . 21 ASP OD2 1 1 13 8875 1 1 22 ASP C C 1.663 -6.503 1.683 1.00 . A A . 22 ASP C 1 1 13 8876 1 1 22 ASP CA C 1.419 -6.423 3.188 1.00 . A A . 22 ASP CA 1 1 13 8877 1 1 22 ASP CB C 0.665 -7.669 3.661 1.00 . A A . 22 ASP CB 1 1 13 8878 1 1 22 ASP CG C 1.401 -8.959 3.414 1.00 . A A . 22 ASP CG 1 1 13 8879 1 1 22 ASP H H -0.248 -5.351 3.927 1.00 . A A . 22 ASP H 1 1 13 8880 1 1 22 ASP HA H 2.366 -6.371 3.705 1.00 . A A . 22 ASP HA 1 1 13 8881 1 1 22 ASP HB2 H 0.477 -7.590 4.721 1.00 . A A . 22 ASP HB2 1 1 13 8882 1 1 22 ASP HB3 H -0.281 -7.713 3.143 1.00 . A A . 22 ASP HB3 1 1 13 8883 1 1 22 ASP N N 0.639 -5.233 3.524 1.00 . A A . 22 ASP N 1 1 13 8884 1 1 22 ASP O O 2.740 -6.914 1.239 1.00 . A A . 22 ASP O 1 1 13 8885 1 1 22 ASP OD1 O 1.137 -9.624 2.393 1.00 . A A . 22 ASP OD1 1 1 13 8886 1 1 22 ASP OD2 O 2.231 -9.353 4.268 1.00 . A A . 22 ASP OD2 1 1 13 8887 1 1 23 HIS C C 1.800 -5.126 -1.028 1.00 . A A . 23 HIS C 1 1 13 8888 1 1 23 HIS CA C 0.722 -6.074 -0.539 1.00 . A A . 23 HIS CA 1 1 13 8889 1 1 23 HIS CB C -0.653 -5.680 -1.129 1.00 . A A . 23 HIS CB 1 1 13 8890 1 1 23 HIS CD2 C -0.267 -4.842 -3.567 1.00 . A A . 23 HIS CD2 1 1 13 8891 1 1 23 HIS CE1 C -1.281 -6.420 -4.635 1.00 . A A . 23 HIS CE1 1 1 13 8892 1 1 23 HIS CG C -0.738 -5.713 -2.637 1.00 . A A . 23 HIS CG 1 1 13 8893 1 1 23 HIS H H -0.148 -5.748 1.348 1.00 . A A . 23 HIS H 1 1 13 8894 1 1 23 HIS HA H 0.965 -7.074 -0.861 1.00 . A A . 23 HIS HA 1 1 13 8895 1 1 23 HIS HB2 H -1.403 -6.357 -0.749 1.00 . A A . 23 HIS HB2 1 1 13 8896 1 1 23 HIS HB3 H -0.893 -4.678 -0.804 1.00 . A A . 23 HIS HB3 1 1 13 8897 1 1 23 HIS HD1 H -1.840 -7.481 -2.963 1.00 . A A . 23 HIS HD1 1 1 13 8898 1 1 23 HIS HD2 H 0.287 -3.938 -3.359 1.00 . A A . 23 HIS HD2 1 1 13 8899 1 1 23 HIS HE1 H -1.696 -7.034 -5.422 1.00 . A A . 23 HIS HE1 1 1 13 8900 1 1 23 HIS N N 0.670 -6.075 0.916 1.00 . A A . 23 HIS N 1 1 13 8901 1 1 23 HIS ND1 N -1.379 -6.700 -3.341 1.00 . A A . 23 HIS ND1 1 1 13 8902 1 1 23 HIS NE2 N -0.613 -5.297 -4.833 1.00 . A A . 23 HIS NE2 1 1 13 8903 1 1 23 HIS O O 2.698 -5.528 -1.772 1.00 . A A . 23 HIS O 1 1 13 8904 1 1 24 CYS C C 4.105 -3.291 -0.580 1.00 . A A . 24 CYS C 1 1 13 8905 1 1 24 CYS CA C 2.698 -2.874 -1.008 1.00 . A A . 24 CYS CA 1 1 13 8906 1 1 24 CYS CB C 2.347 -1.494 -0.448 1.00 . A A . 24 CYS CB 1 1 13 8907 1 1 24 CYS H H 0.981 -3.614 -0.006 1.00 . A A . 24 CYS H 1 1 13 8908 1 1 24 CYS HA H 2.672 -2.835 -2.087 1.00 . A A . 24 CYS HA 1 1 13 8909 1 1 24 CYS HB2 H 2.377 -1.536 0.631 1.00 . A A . 24 CYS HB2 1 1 13 8910 1 1 24 CYS HB3 H 3.082 -0.780 -0.792 1.00 . A A . 24 CYS HB3 1 1 13 8911 1 1 24 CYS N N 1.723 -3.874 -0.597 1.00 . A A . 24 CYS N 1 1 13 8912 1 1 24 CYS O O 5.064 -3.106 -1.318 1.00 . A A . 24 CYS O 1 1 13 8913 1 1 24 CYS SG S 0.692 -0.873 -0.927 1.00 . A A . 24 CYS SG 1 1 13 8914 1 1 25 LYS C C 6.031 -5.546 0.277 1.00 . A A . 25 LYS C 1 1 13 8915 1 1 25 LYS CA C 5.478 -4.392 1.102 1.00 . A A . 25 LYS CA 1 1 13 8916 1 1 25 LYS CB C 5.357 -4.825 2.557 1.00 . A A . 25 LYS CB 1 1 13 8917 1 1 25 LYS CD C 4.951 -4.204 4.935 1.00 . A A . 25 LYS CD 1 1 13 8918 1 1 25 LYS CE C 4.912 -3.065 5.932 1.00 . A A . 25 LYS CE 1 1 13 8919 1 1 25 LYS CG C 5.180 -3.693 3.531 1.00 . A A . 25 LYS CG 1 1 13 8920 1 1 25 LYS H H 3.399 -4.026 1.138 1.00 . A A . 25 LYS H 1 1 13 8921 1 1 25 LYS HA H 6.180 -3.573 1.054 1.00 . A A . 25 LYS HA 1 1 13 8922 1 1 25 LYS HB2 H 4.513 -5.492 2.655 1.00 . A A . 25 LYS HB2 1 1 13 8923 1 1 25 LYS HB3 H 6.257 -5.360 2.822 1.00 . A A . 25 LYS HB3 1 1 13 8924 1 1 25 LYS HD2 H 4.006 -4.726 4.968 1.00 . A A . 25 LYS HD2 1 1 13 8925 1 1 25 LYS HD3 H 5.750 -4.880 5.202 1.00 . A A . 25 LYS HD3 1 1 13 8926 1 1 25 LYS HE2 H 5.900 -2.639 6.016 1.00 . A A . 25 LYS HE2 1 1 13 8927 1 1 25 LYS HE3 H 4.227 -2.311 5.571 1.00 . A A . 25 LYS HE3 1 1 13 8928 1 1 25 LYS HG2 H 6.065 -3.074 3.523 1.00 . A A . 25 LYS HG2 1 1 13 8929 1 1 25 LYS HG3 H 4.325 -3.108 3.225 1.00 . A A . 25 LYS HG3 1 1 13 8930 1 1 25 LYS HZ1 H 3.473 -3.823 7.160 1.00 . A A . 25 LYS HZ1 1 1 13 8931 1 1 25 LYS HZ2 H 4.495 -2.738 7.953 1.00 . A A . 25 LYS HZ2 1 1 13 8932 1 1 25 LYS HZ3 H 5.030 -4.318 7.608 1.00 . A A . 25 LYS HZ3 1 1 13 8933 1 1 25 LYS N N 4.207 -3.903 0.592 1.00 . A A . 25 LYS N 1 1 13 8934 1 1 25 LYS NZ N 4.466 -3.516 7.263 1.00 . A A . 25 LYS NZ 1 1 13 8935 1 1 25 LYS O O 7.127 -5.463 -0.250 1.00 . A A . 25 LYS O 1 1 13 8936 1 1 26 ASN C C 5.707 -7.726 -2.016 1.00 . A A . 26 ASN C 1 1 13 8937 1 1 26 ASN CA C 5.763 -7.814 -0.520 1.00 . A A . 26 ASN CA 1 1 13 8938 1 1 26 ASN CB C 5.017 -9.071 -0.067 1.00 . A A . 26 ASN CB 1 1 13 8939 1 1 26 ASN CG C 5.328 -9.491 1.342 1.00 . A A . 26 ASN CG 1 1 13 8940 1 1 26 ASN H H 4.348 -6.581 0.493 1.00 . A A . 26 ASN H 1 1 13 8941 1 1 26 ASN HA H 6.797 -7.928 -0.232 1.00 . A A . 26 ASN HA 1 1 13 8942 1 1 26 ASN HB2 H 3.954 -8.896 -0.136 1.00 . A A . 26 ASN HB2 1 1 13 8943 1 1 26 ASN HB3 H 5.285 -9.879 -0.729 1.00 . A A . 26 ASN HB3 1 1 13 8944 1 1 26 ASN HD21 H 3.785 -8.471 2.011 1.00 . A A . 26 ASN HD21 1 1 13 8945 1 1 26 ASN HD22 H 4.693 -9.303 3.206 1.00 . A A . 26 ASN HD22 1 1 13 8946 1 1 26 ASN N N 5.269 -6.606 0.145 1.00 . A A . 26 ASN N 1 1 13 8947 1 1 26 ASN ND2 N 4.538 -9.048 2.272 1.00 . A A . 26 ASN ND2 1 1 13 8948 1 1 26 ASN O O 6.737 -7.767 -2.678 1.00 . A A . 26 ASN O 1 1 13 8949 1 1 26 ASN OD1 O 6.272 -10.245 1.583 1.00 . A A . 26 ASN OD1 1 1 13 8950 1 1 27 LYS C C 5.003 -6.408 -4.683 1.00 . A A . 27 LYS C 1 1 13 8951 1 1 27 LYS CA C 4.308 -7.572 -3.981 1.00 . A A . 27 LYS CA 1 1 13 8952 1 1 27 LYS CB C 2.800 -7.580 -4.302 1.00 . A A . 27 LYS CB 1 1 13 8953 1 1 27 LYS CD C 3.082 -8.607 -6.582 1.00 . A A . 27 LYS CD 1 1 13 8954 1 1 27 LYS CE C 3.186 -8.235 -8.043 1.00 . A A . 27 LYS CE 1 1 13 8955 1 1 27 LYS CG C 2.483 -7.463 -5.779 1.00 . A A . 27 LYS CG 1 1 13 8956 1 1 27 LYS H H 3.748 -7.394 -1.963 1.00 . A A . 27 LYS H 1 1 13 8957 1 1 27 LYS HA H 4.732 -8.495 -4.345 1.00 . A A . 27 LYS HA 1 1 13 8958 1 1 27 LYS HB2 H 2.376 -8.498 -3.929 1.00 . A A . 27 LYS HB2 1 1 13 8959 1 1 27 LYS HB3 H 2.337 -6.750 -3.788 1.00 . A A . 27 LYS HB3 1 1 13 8960 1 1 27 LYS HD2 H 4.070 -8.826 -6.209 1.00 . A A . 27 LYS HD2 1 1 13 8961 1 1 27 LYS HD3 H 2.455 -9.480 -6.483 1.00 . A A . 27 LYS HD3 1 1 13 8962 1 1 27 LYS HE2 H 3.612 -9.070 -8.578 1.00 . A A . 27 LYS HE2 1 1 13 8963 1 1 27 LYS HE3 H 2.203 -8.021 -8.436 1.00 . A A . 27 LYS HE3 1 1 13 8964 1 1 27 LYS HG2 H 1.410 -7.477 -5.902 1.00 . A A . 27 LYS HG2 1 1 13 8965 1 1 27 LYS HG3 H 2.878 -6.527 -6.143 1.00 . A A . 27 LYS HG3 1 1 13 8966 1 1 27 LYS HZ1 H 3.707 -6.198 -7.733 1.00 . A A . 27 LYS HZ1 1 1 13 8967 1 1 27 LYS HZ2 H 4.139 -6.809 -9.240 1.00 . A A . 27 LYS HZ2 1 1 13 8968 1 1 27 LYS HZ3 H 5.016 -7.266 -7.877 1.00 . A A . 27 LYS HZ3 1 1 13 8969 1 1 27 LYS N N 4.522 -7.555 -2.547 1.00 . A A . 27 LYS N 1 1 13 8970 1 1 27 LYS NZ N 4.062 -7.046 -8.231 1.00 . A A . 27 LYS NZ 1 1 13 8971 1 1 27 LYS O O 5.636 -6.579 -5.733 1.00 . A A . 27 LYS O 1 1 13 8972 1 1 28 GLU C C 6.863 -3.749 -4.227 1.00 . A A . 28 GLU C 1 1 13 8973 1 1 28 GLU CA C 5.467 -4.085 -4.742 1.00 . A A . 28 GLU CA 1 1 13 8974 1 1 28 GLU CB C 4.518 -2.912 -4.622 1.00 . A A . 28 GLU CB 1 1 13 8975 1 1 28 GLU CD C 3.421 -3.405 -6.827 1.00 . A A . 28 GLU CD 1 1 13 8976 1 1 28 GLU CG C 3.208 -3.144 -5.351 1.00 . A A . 28 GLU CG 1 1 13 8977 1 1 28 GLU H H 4.395 -5.194 -3.276 1.00 . A A . 28 GLU H 1 1 13 8978 1 1 28 GLU HA H 5.566 -4.323 -5.792 1.00 . A A . 28 GLU HA 1 1 13 8979 1 1 28 GLU HB2 H 4.309 -2.739 -3.577 1.00 . A A . 28 GLU HB2 1 1 13 8980 1 1 28 GLU HB3 H 4.985 -2.033 -5.037 1.00 . A A . 28 GLU HB3 1 1 13 8981 1 1 28 GLU HG2 H 2.716 -4.002 -4.914 1.00 . A A . 28 GLU HG2 1 1 13 8982 1 1 28 GLU HG3 H 2.583 -2.272 -5.234 1.00 . A A . 28 GLU HG3 1 1 13 8983 1 1 28 GLU N N 4.897 -5.255 -4.118 1.00 . A A . 28 GLU N 1 1 13 8984 1 1 28 GLU O O 7.514 -2.839 -4.746 1.00 . A A . 28 GLU O 1 1 13 8985 1 1 28 GLU OE1 O 3.749 -2.458 -7.566 1.00 . A A . 28 GLU OE1 1 1 13 8986 1 1 28 GLU OE2 O 3.243 -4.556 -7.295 1.00 . A A . 28 GLU OE2 1 1 13 8987 1 1 29 HIS C C 8.826 -2.962 -1.936 1.00 . A A . 29 HIS C 1 1 13 8988 1 1 29 HIS CA C 8.660 -4.340 -2.598 1.00 . A A . 29 HIS CA 1 1 13 8989 1 1 29 HIS CB C 9.799 -4.572 -3.627 1.00 . A A . 29 HIS CB 1 1 13 8990 1 1 29 HIS CD2 C 9.970 -7.162 -3.718 1.00 . A A . 29 HIS CD2 1 1 13 8991 1 1 29 HIS CE1 C 9.846 -7.444 -5.866 1.00 . A A . 29 HIS CE1 1 1 13 8992 1 1 29 HIS CG C 9.821 -5.933 -4.270 1.00 . A A . 29 HIS CG 1 1 13 8993 1 1 29 HIS H H 6.729 -5.199 -2.860 1.00 . A A . 29 HIS H 1 1 13 8994 1 1 29 HIS HA H 8.734 -5.089 -1.823 1.00 . A A . 29 HIS HA 1 1 13 8995 1 1 29 HIS HB2 H 9.699 -3.849 -4.421 1.00 . A A . 29 HIS HB2 1 1 13 8996 1 1 29 HIS HB3 H 10.747 -4.419 -3.133 1.00 . A A . 29 HIS HB3 1 1 13 8997 1 1 29 HIS HD1 H 9.618 -5.449 -6.322 1.00 . A A . 29 HIS HD1 1 1 13 8998 1 1 29 HIS HD2 H 10.069 -7.368 -2.662 1.00 . A A . 29 HIS HD2 1 1 13 8999 1 1 29 HIS HE1 H 9.826 -7.892 -6.851 1.00 . A A . 29 HIS HE1 1 1 13 9000 1 1 29 HIS N N 7.315 -4.498 -3.214 1.00 . A A . 29 HIS N 1 1 13 9001 1 1 29 HIS ND1 N 9.742 -6.138 -5.632 1.00 . A A . 29 HIS ND1 1 1 13 9002 1 1 29 HIS NE2 N 9.985 -8.122 -4.732 1.00 . A A . 29 HIS NE2 1 1 13 9003 1 1 29 HIS O O 9.952 -2.493 -1.722 1.00 . A A . 29 HIS O 1 1 13 9004 1 1 30 LEU C C 7.766 -1.046 0.526 1.00 . A A . 30 LEU C 1 1 13 9005 1 1 30 LEU CA C 7.741 -1.017 -1.002 1.00 . A A . 30 LEU CA 1 1 13 9006 1 1 30 LEU CB C 6.536 -0.221 -1.508 1.00 . A A . 30 LEU CB 1 1 13 9007 1 1 30 LEU CD1 C 5.191 0.706 -3.415 1.00 . A A . 30 LEU CD1 1 1 13 9008 1 1 30 LEU CD2 C 7.654 0.371 -3.695 1.00 . A A . 30 LEU CD2 1 1 13 9009 1 1 30 LEU CG C 6.382 -0.144 -3.033 1.00 . A A . 30 LEU CG 1 1 13 9010 1 1 30 LEU H H 6.867 -2.826 -1.628 1.00 . A A . 30 LEU H 1 1 13 9011 1 1 30 LEU HA H 8.642 -0.530 -1.346 1.00 . A A . 30 LEU HA 1 1 13 9012 1 1 30 LEU HB2 H 5.644 -0.676 -1.101 1.00 . A A . 30 LEU HB2 1 1 13 9013 1 1 30 LEU HB3 H 6.610 0.784 -1.124 1.00 . A A . 30 LEU HB3 1 1 13 9014 1 1 30 LEU HD11 H 5.319 1.708 -3.030 1.00 . A A . 30 LEU HD11 1 1 13 9015 1 1 30 LEU HD12 H 4.293 0.269 -3.004 1.00 . A A . 30 LEU HD12 1 1 13 9016 1 1 30 LEU HD13 H 5.109 0.743 -4.490 1.00 . A A . 30 LEU HD13 1 1 13 9017 1 1 30 LEU HD21 H 7.498 0.456 -4.760 1.00 . A A . 30 LEU HD21 1 1 13 9018 1 1 30 LEU HD22 H 8.461 -0.324 -3.512 1.00 . A A . 30 LEU HD22 1 1 13 9019 1 1 30 LEU HD23 H 7.910 1.335 -3.286 1.00 . A A . 30 LEU HD23 1 1 13 9020 1 1 30 LEU HG H 6.193 -1.142 -3.399 1.00 . A A . 30 LEU HG 1 1 13 9021 1 1 30 LEU N N 7.727 -2.355 -1.557 1.00 . A A . 30 LEU N 1 1 13 9022 1 1 30 LEU O O 7.772 -2.120 1.138 1.00 . A A . 30 LEU O 1 1 13 9023 1 1 31 ARG C C 6.611 -0.201 3.284 1.00 . A A . 31 ARG C 1 1 13 9024 1 1 31 ARG CA C 7.873 0.275 2.572 1.00 . A A . 31 ARG CA 1 1 13 9025 1 1 31 ARG CB C 8.163 1.730 2.958 1.00 . A A . 31 ARG CB 1 1 13 9026 1 1 31 ARG CD C 8.372 3.432 4.787 1.00 . A A . 31 ARG CD 1 1 13 9027 1 1 31 ARG CG C 8.197 1.968 4.451 1.00 . A A . 31 ARG CG 1 1 13 9028 1 1 31 ARG CZ C 8.906 4.651 6.884 1.00 . A A . 31 ARG CZ 1 1 13 9029 1 1 31 ARG H H 7.746 0.944 0.580 1.00 . A A . 31 ARG H 1 1 13 9030 1 1 31 ARG HA H 8.701 -0.330 2.907 1.00 . A A . 31 ARG HA 1 1 13 9031 1 1 31 ARG HB2 H 9.122 2.022 2.553 1.00 . A A . 31 ARG HB2 1 1 13 9032 1 1 31 ARG HB3 H 7.395 2.360 2.535 1.00 . A A . 31 ARG HB3 1 1 13 9033 1 1 31 ARG HD2 H 9.306 3.789 4.381 1.00 . A A . 31 ARG HD2 1 1 13 9034 1 1 31 ARG HD3 H 7.557 3.987 4.347 1.00 . A A . 31 ARG HD3 1 1 13 9035 1 1 31 ARG HE H 7.851 2.948 6.728 1.00 . A A . 31 ARG HE 1 1 13 9036 1 1 31 ARG HG2 H 7.269 1.620 4.879 1.00 . A A . 31 ARG HG2 1 1 13 9037 1 1 31 ARG HG3 H 9.018 1.408 4.872 1.00 . A A . 31 ARG HG3 1 1 13 9038 1 1 31 ARG HH11 H 9.898 5.474 5.264 1.00 . A A . 31 ARG HH11 1 1 13 9039 1 1 31 ARG HH12 H 10.090 6.310 6.727 1.00 . A A . 31 ARG HH12 1 1 13 9040 1 1 31 ARG HH21 H 8.188 4.082 8.713 1.00 . A A . 31 ARG HH21 1 1 13 9041 1 1 31 ARG HH22 H 9.118 5.499 8.742 1.00 . A A . 31 ARG HH22 1 1 13 9042 1 1 31 ARG N N 7.783 0.133 1.128 1.00 . A A . 31 ARG N 1 1 13 9043 1 1 31 ARG NE N 8.351 3.637 6.227 1.00 . A A . 31 ARG NE 1 1 13 9044 1 1 31 ARG NH1 N 9.682 5.529 6.244 1.00 . A A . 31 ARG NH1 1 1 13 9045 1 1 31 ARG NH2 N 8.729 4.752 8.194 1.00 . A A . 31 ARG NH2 1 1 13 9046 1 1 31 ARG O O 6.680 -1.046 4.162 1.00 . A A . 31 ARG O 1 1 13 9047 1 1 32 SER C C 3.033 0.365 2.687 1.00 . A A . 32 SER C 1 1 13 9048 1 1 32 SER CA C 4.211 0.044 3.606 1.00 . A A . 32 SER CA 1 1 13 9049 1 1 32 SER CB C 4.086 0.852 4.909 1.00 . A A . 32 SER CB 1 1 13 9050 1 1 32 SER H H 5.455 1.051 2.233 1.00 . A A . 32 SER H 1 1 13 9051 1 1 32 SER HA H 4.211 -1.009 3.844 1.00 . A A . 32 SER HA 1 1 13 9052 1 1 32 SER HB2 H 4.075 1.907 4.678 1.00 . A A . 32 SER HB2 1 1 13 9053 1 1 32 SER HB3 H 3.167 0.584 5.409 1.00 . A A . 32 SER HB3 1 1 13 9054 1 1 32 SER HG H 5.736 -0.079 5.356 1.00 . A A . 32 SER HG 1 1 13 9055 1 1 32 SER N N 5.472 0.375 2.947 1.00 . A A . 32 SER N 1 1 13 9056 1 1 32 SER O O 3.224 0.954 1.618 1.00 . A A . 32 SER O 1 1 13 9057 1 1 32 SER OG O 5.179 0.588 5.785 1.00 . A A . 32 SER OG 1 1 13 9058 1 1 33 GLY C C -0.433 0.822 3.183 1.00 . A A . 33 GLY C 1 1 13 9059 1 1 33 GLY CA C 0.659 0.286 2.311 1.00 . A A . 33 GLY CA 1 1 13 9060 1 1 33 GLY H H 1.734 -0.489 3.946 1.00 . A A . 33 GLY H 1 1 13 9061 1 1 33 GLY HA2 H 0.919 1.038 1.583 1.00 . A A . 33 GLY HA2 1 1 13 9062 1 1 33 GLY HA3 H 0.314 -0.600 1.801 1.00 . A A . 33 GLY HA3 1 1 13 9063 1 1 33 GLY N N 1.842 -0.007 3.093 1.00 . A A . 33 GLY N 1 1 13 9064 1 1 33 GLY O O -0.679 0.286 4.258 1.00 . A A . 33 GLY O 1 1 13 9065 1 1 34 ARG C C -3.398 2.541 2.825 1.00 . A A . 34 ARG C 1 1 13 9066 1 1 34 ARG CA C -2.087 2.501 3.559 1.00 . A A . 34 ARG CA 1 1 13 9067 1 1 34 ARG CB C -1.680 3.914 3.976 1.00 . A A . 34 ARG CB 1 1 13 9068 1 1 34 ARG CD C -0.173 5.380 5.308 1.00 . A A . 34 ARG CD 1 1 13 9069 1 1 34 ARG CG C -0.463 3.966 4.876 1.00 . A A . 34 ARG CG 1 1 13 9070 1 1 34 ARG CZ C 1.162 6.414 7.127 1.00 . A A . 34 ARG CZ 1 1 13 9071 1 1 34 ARG H H -0.882 2.266 1.877 1.00 . A A . 34 ARG H 1 1 13 9072 1 1 34 ARG HA H -2.205 1.906 4.451 1.00 . A A . 34 ARG HA 1 1 13 9073 1 1 34 ARG HB2 H -1.464 4.487 3.087 1.00 . A A . 34 ARG HB2 1 1 13 9074 1 1 34 ARG HB3 H -2.507 4.376 4.495 1.00 . A A . 34 ARG HB3 1 1 13 9075 1 1 34 ARG HD2 H 0.028 5.978 4.431 1.00 . A A . 34 ARG HD2 1 1 13 9076 1 1 34 ARG HD3 H -1.044 5.769 5.815 1.00 . A A . 34 ARG HD3 1 1 13 9077 1 1 34 ARG HE H 1.632 4.727 6.132 1.00 . A A . 34 ARG HE 1 1 13 9078 1 1 34 ARG HG2 H -0.647 3.362 5.753 1.00 . A A . 34 ARG HG2 1 1 13 9079 1 1 34 ARG HG3 H 0.389 3.577 4.338 1.00 . A A . 34 ARG HG3 1 1 13 9080 1 1 34 ARG HH11 H -0.505 7.489 6.629 1.00 . A A . 34 ARG HH11 1 1 13 9081 1 1 34 ARG HH12 H 0.395 8.147 7.920 1.00 . A A . 34 ARG HH12 1 1 13 9082 1 1 34 ARG HH21 H 2.876 5.602 7.864 1.00 . A A . 34 ARG HH21 1 1 13 9083 1 1 34 ARG HH22 H 2.408 7.042 8.636 1.00 . A A . 34 ARG HH22 1 1 13 9084 1 1 34 ARG N N -1.065 1.880 2.762 1.00 . A A . 34 ARG N 1 1 13 9085 1 1 34 ARG NE N 0.975 5.455 6.215 1.00 . A A . 34 ARG NE 1 1 13 9086 1 1 34 ARG NH1 N 0.296 7.421 7.232 1.00 . A A . 34 ARG NH1 1 1 13 9087 1 1 34 ARG NH2 N 2.215 6.355 7.929 1.00 . A A . 34 ARG NH2 1 1 13 9088 1 1 34 ARG O O -3.442 2.715 1.601 1.00 . A A . 34 ARG O 1 1 13 9089 1 1 35 CYS C C -6.415 3.724 3.393 1.00 . A A . 35 CYS C 1 1 13 9090 1 1 35 CYS CA C -5.767 2.428 2.998 1.00 . A A . 35 CYS CA 1 1 13 9091 1 1 35 CYS CB C -6.563 1.232 3.488 1.00 . A A . 35 CYS CB 1 1 13 9092 1 1 35 CYS H H -4.352 2.280 4.526 1.00 . A A . 35 CYS H 1 1 13 9093 1 1 35 CYS HA H -5.696 2.404 1.920 1.00 . A A . 35 CYS HA 1 1 13 9094 1 1 35 CYS HB2 H -6.724 1.330 4.551 1.00 . A A . 35 CYS HB2 1 1 13 9095 1 1 35 CYS HB3 H -7.513 1.195 2.976 1.00 . A A . 35 CYS HB3 1 1 13 9096 1 1 35 CYS N N -4.451 2.399 3.556 1.00 . A A . 35 CYS N 1 1 13 9097 1 1 35 CYS O O -6.605 4.006 4.572 1.00 . A A . 35 CYS O 1 1 13 9098 1 1 35 CYS SG S -5.713 -0.349 3.196 1.00 . A A . 35 CYS SG 1 1 13 9099 1 1 36 ARG C C -8.761 5.838 2.645 1.00 . A A . 36 ARG C 1 1 13 9100 1 1 36 ARG CA C -7.235 5.846 2.659 1.00 . A A . 36 ARG CA 1 1 13 9101 1 1 36 ARG CB C -6.668 6.837 1.651 1.00 . A A . 36 ARG CB 1 1 13 9102 1 1 36 ARG CD C -4.717 7.576 3.078 1.00 . A A . 36 ARG CD 1 1 13 9103 1 1 36 ARG CG C -5.151 7.023 1.733 1.00 . A A . 36 ARG CG 1 1 13 9104 1 1 36 ARG CZ C -5.202 9.553 4.510 1.00 . A A . 36 ARG CZ 1 1 13 9105 1 1 36 ARG H H -6.544 4.221 1.498 1.00 . A A . 36 ARG H 1 1 13 9106 1 1 36 ARG HA H -6.920 6.145 3.647 1.00 . A A . 36 ARG HA 1 1 13 9107 1 1 36 ARG HB2 H -6.896 6.454 0.667 1.00 . A A . 36 ARG HB2 1 1 13 9108 1 1 36 ARG HB3 H -7.143 7.797 1.788 1.00 . A A . 36 ARG HB3 1 1 13 9109 1 1 36 ARG HD2 H -5.021 6.888 3.853 1.00 . A A . 36 ARG HD2 1 1 13 9110 1 1 36 ARG HD3 H -3.641 7.668 3.084 1.00 . A A . 36 ARG HD3 1 1 13 9111 1 1 36 ARG HE H -5.794 9.296 2.598 1.00 . A A . 36 ARG HE 1 1 13 9112 1 1 36 ARG HG2 H -4.676 6.065 1.585 1.00 . A A . 36 ARG HG2 1 1 13 9113 1 1 36 ARG HG3 H -4.838 7.702 0.953 1.00 . A A . 36 ARG HG3 1 1 13 9114 1 1 36 ARG HH11 H -4.106 8.115 5.488 1.00 . A A . 36 ARG HH11 1 1 13 9115 1 1 36 ARG HH12 H -4.443 9.515 6.401 1.00 . A A . 36 ARG HH12 1 1 13 9116 1 1 36 ARG HH21 H -6.271 11.181 3.892 1.00 . A A . 36 ARG HH21 1 1 13 9117 1 1 36 ARG HH22 H -5.679 11.274 5.487 1.00 . A A . 36 ARG HH22 1 1 13 9118 1 1 36 ARG N N -6.696 4.533 2.418 1.00 . A A . 36 ARG N 1 1 13 9119 1 1 36 ARG NE N -5.308 8.892 3.353 1.00 . A A . 36 ARG NE 1 1 13 9120 1 1 36 ARG NH1 N -4.542 9.020 5.535 1.00 . A A . 36 ARG NH1 1 1 13 9121 1 1 36 ARG NH2 N -5.757 10.748 4.638 1.00 . A A . 36 ARG NH2 1 1 13 9122 1 1 36 ARG O O -9.380 4.787 2.445 1.00 . A A . 36 ARG O 1 1 13 9123 1 1 37 ASP C C -11.606 6.608 1.794 1.00 . A A . 37 ASP C 1 1 13 9124 1 1 37 ASP CA C -10.811 7.248 2.944 1.00 . A A . 37 ASP CA 1 1 13 9125 1 1 37 ASP CB C -11.085 8.756 2.978 1.00 . A A . 37 ASP CB 1 1 13 9126 1 1 37 ASP CG C -12.548 9.092 3.156 1.00 . A A . 37 ASP CG 1 1 13 9127 1 1 37 ASP H H -8.763 7.799 2.961 1.00 . A A . 37 ASP H 1 1 13 9128 1 1 37 ASP HA H -11.151 6.826 3.876 1.00 . A A . 37 ASP HA 1 1 13 9129 1 1 37 ASP HB2 H -10.533 9.203 3.791 1.00 . A A . 37 ASP HB2 1 1 13 9130 1 1 37 ASP HB3 H -10.747 9.191 2.049 1.00 . A A . 37 ASP HB3 1 1 13 9131 1 1 37 ASP N N -9.344 7.017 2.848 1.00 . A A . 37 ASP N 1 1 13 9132 1 1 37 ASP O O -12.712 6.115 1.988 1.00 . A A . 37 ASP O 1 1 13 9133 1 1 37 ASP OD1 O -13.039 9.046 4.303 1.00 . A A . 37 ASP OD1 1 1 13 9134 1 1 37 ASP OD2 O -13.213 9.457 2.165 1.00 . A A . 37 ASP OD2 1 1 13 9135 1 1 38 ASP C C -11.661 4.501 -0.591 1.00 . A A . 38 ASP C 1 1 13 9136 1 1 38 ASP CA C -11.650 6.016 -0.593 1.00 . A A . 38 ASP CA 1 1 13 9137 1 1 38 ASP CB C -10.918 6.455 -1.875 1.00 . A A . 38 ASP CB 1 1 13 9138 1 1 38 ASP CG C -11.287 7.821 -2.381 1.00 . A A . 38 ASP CG 1 1 13 9139 1 1 38 ASP H H -10.127 7.000 0.560 1.00 . A A . 38 ASP H 1 1 13 9140 1 1 38 ASP HA H -12.664 6.381 -0.652 1.00 . A A . 38 ASP HA 1 1 13 9141 1 1 38 ASP HB2 H -9.855 6.455 -1.682 1.00 . A A . 38 ASP HB2 1 1 13 9142 1 1 38 ASP HB3 H -11.122 5.732 -2.651 1.00 . A A . 38 ASP HB3 1 1 13 9143 1 1 38 ASP N N -11.018 6.590 0.617 1.00 . A A . 38 ASP N 1 1 13 9144 1 1 38 ASP O O -12.142 3.898 -1.546 1.00 . A A . 38 ASP O 1 1 13 9145 1 1 38 ASP OD1 O -10.737 8.824 -1.887 1.00 . A A . 38 ASP OD1 1 1 13 9146 1 1 38 ASP OD2 O -12.102 7.907 -3.320 1.00 . A A . 38 ASP OD2 1 1 13 9147 1 1 39 PHE C C -9.863 1.986 -0.477 1.00 . A A . 39 PHE C 1 1 13 9148 1 1 39 PHE CA C -10.909 2.417 0.534 1.00 . A A . 39 PHE CA 1 1 13 9149 1 1 39 PHE CB C -12.216 1.603 0.307 1.00 . A A . 39 PHE CB 1 1 13 9150 1 1 39 PHE CD1 C -13.281 0.464 2.263 1.00 . A A . 39 PHE CD1 1 1 13 9151 1 1 39 PHE CD2 C -14.041 2.650 1.696 1.00 . A A . 39 PHE CD2 1 1 13 9152 1 1 39 PHE CE1 C -14.185 0.409 3.299 1.00 . A A . 39 PHE CE1 1 1 13 9153 1 1 39 PHE CE2 C -14.948 2.601 2.739 1.00 . A A . 39 PHE CE2 1 1 13 9154 1 1 39 PHE CG C -13.196 1.582 1.449 1.00 . A A . 39 PHE CG 1 1 13 9155 1 1 39 PHE CZ C -15.019 1.477 3.539 1.00 . A A . 39 PHE CZ 1 1 13 9156 1 1 39 PHE H H -10.807 4.430 1.222 1.00 . A A . 39 PHE H 1 1 13 9157 1 1 39 PHE HA H -10.518 2.202 1.518 1.00 . A A . 39 PHE HA 1 1 13 9158 1 1 39 PHE HB2 H -12.734 2.022 -0.543 1.00 . A A . 39 PHE HB2 1 1 13 9159 1 1 39 PHE HB3 H -11.948 0.583 0.075 1.00 . A A . 39 PHE HB3 1 1 13 9160 1 1 39 PHE HD1 H -12.625 -0.376 2.082 1.00 . A A . 39 PHE HD1 1 1 13 9161 1 1 39 PHE HD2 H -13.984 3.529 1.070 1.00 . A A . 39 PHE HD2 1 1 13 9162 1 1 39 PHE HE1 H -14.240 -0.472 3.924 1.00 . A A . 39 PHE HE1 1 1 13 9163 1 1 39 PHE HE2 H -15.605 3.438 2.928 1.00 . A A . 39 PHE HE2 1 1 13 9164 1 1 39 PHE HZ H -15.730 1.431 4.352 1.00 . A A . 39 PHE HZ 1 1 13 9165 1 1 39 PHE N N -11.102 3.885 0.459 1.00 . A A . 39 PHE N 1 1 13 9166 1 1 39 PHE O O -9.710 0.810 -0.763 1.00 . A A . 39 PHE O 1 1 13 9167 1 1 40 ARG C C -6.768 2.597 -1.366 1.00 . A A . 40 ARG C 1 1 13 9168 1 1 40 ARG CA C -8.154 2.651 -2.002 1.00 . A A . 40 ARG CA 1 1 13 9169 1 1 40 ARG CB C -8.230 3.696 -3.130 1.00 . A A . 40 ARG CB 1 1 13 9170 1 1 40 ARG CD C -8.023 2.043 -5.007 1.00 . A A . 40 ARG CD 1 1 13 9171 1 1 40 ARG CG C -7.472 3.319 -4.395 1.00 . A A . 40 ARG CG 1 1 13 9172 1 1 40 ARG CZ C -7.117 0.376 -6.610 1.00 . A A . 40 ARG CZ 1 1 13 9173 1 1 40 ARG H H -9.237 3.848 -0.646 1.00 . A A . 40 ARG H 1 1 13 9174 1 1 40 ARG HA H -8.391 1.677 -2.399 1.00 . A A . 40 ARG HA 1 1 13 9175 1 1 40 ARG HB2 H -9.264 3.840 -3.401 1.00 . A A . 40 ARG HB2 1 1 13 9176 1 1 40 ARG HB3 H -7.830 4.631 -2.767 1.00 . A A . 40 ARG HB3 1 1 13 9177 1 1 40 ARG HD2 H -7.946 1.242 -4.289 1.00 . A A . 40 ARG HD2 1 1 13 9178 1 1 40 ARG HD3 H -9.059 2.204 -5.263 1.00 . A A . 40 ARG HD3 1 1 13 9179 1 1 40 ARG HE H -6.949 2.393 -6.741 1.00 . A A . 40 ARG HE 1 1 13 9180 1 1 40 ARG HG2 H -7.555 4.121 -5.113 1.00 . A A . 40 ARG HG2 1 1 13 9181 1 1 40 ARG HG3 H -6.434 3.165 -4.138 1.00 . A A . 40 ARG HG3 1 1 13 9182 1 1 40 ARG HH11 H -8.239 -0.502 -5.120 1.00 . A A . 40 ARG HH11 1 1 13 9183 1 1 40 ARG HH12 H -7.495 -1.584 -6.204 1.00 . A A . 40 ARG HH12 1 1 13 9184 1 1 40 ARG HH21 H -6.060 0.883 -8.276 1.00 . A A . 40 ARG HH21 1 1 13 9185 1 1 40 ARG HH22 H -6.276 -0.801 -8.066 1.00 . A A . 40 ARG HH22 1 1 13 9186 1 1 40 ARG N N -9.124 2.939 -0.989 1.00 . A A . 40 ARG N 1 1 13 9187 1 1 40 ARG NE N -7.300 1.645 -6.207 1.00 . A A . 40 ARG NE 1 1 13 9188 1 1 40 ARG NH1 N -7.661 -0.632 -5.932 1.00 . A A . 40 ARG NH1 1 1 13 9189 1 1 40 ARG NH2 N -6.434 0.131 -7.727 1.00 . A A . 40 ARG NH2 1 1 13 9190 1 1 40 ARG O O -6.525 3.244 -0.327 1.00 . A A . 40 ARG O 1 1 13 9191 1 1 41 CYS C C -3.532 2.581 -1.964 1.00 . A A . 41 CYS C 1 1 13 9192 1 1 41 CYS CA C -4.566 1.616 -1.448 1.00 . A A . 41 CYS CA 1 1 13 9193 1 1 41 CYS CB C -4.129 0.182 -1.697 1.00 . A A . 41 CYS CB 1 1 13 9194 1 1 41 CYS H H -6.103 1.437 -2.835 1.00 . A A . 41 CYS H 1 1 13 9195 1 1 41 CYS HA H -4.632 1.748 -0.378 1.00 . A A . 41 CYS HA 1 1 13 9196 1 1 41 CYS HB2 H -4.402 -0.102 -2.702 1.00 . A A . 41 CYS HB2 1 1 13 9197 1 1 41 CYS HB3 H -3.058 0.093 -1.587 1.00 . A A . 41 CYS HB3 1 1 13 9198 1 1 41 CYS N N -5.886 1.849 -1.974 1.00 . A A . 41 CYS N 1 1 13 9199 1 1 41 CYS O O -3.242 2.640 -3.168 1.00 . A A . 41 CYS O 1 1 13 9200 1 1 41 CYS SG S -4.886 -1.008 -0.576 1.00 . A A . 41 CYS SG 1 1 13 9201 1 1 42 TRP C C -0.685 3.661 -0.631 1.00 . A A . 42 TRP C 1 1 13 9202 1 1 42 TRP CA C -1.923 4.231 -1.294 1.00 . A A . 42 TRP CA 1 1 13 9203 1 1 42 TRP CB C -2.234 5.620 -0.727 1.00 . A A . 42 TRP CB 1 1 13 9204 1 1 42 TRP CD1 C -1.961 7.469 -2.487 1.00 . A A . 42 TRP CD1 1 1 13 9205 1 1 42 TRP CD2 C -4.097 6.962 -2.053 1.00 . A A . 42 TRP CD2 1 1 13 9206 1 1 42 TRP CE2 C -4.058 7.995 -3.016 1.00 . A A . 42 TRP CE2 1 1 13 9207 1 1 42 TRP CE3 C -5.340 6.484 -1.639 1.00 . A A . 42 TRP CE3 1 1 13 9208 1 1 42 TRP CG C -2.733 6.637 -1.726 1.00 . A A . 42 TRP CG 1 1 13 9209 1 1 42 TRP CH2 C -6.413 8.068 -3.129 1.00 . A A . 42 TRP CH2 1 1 13 9210 1 1 42 TRP CZ2 C -5.211 8.555 -3.558 1.00 . A A . 42 TRP CZ2 1 1 13 9211 1 1 42 TRP CZ3 C -6.486 7.043 -2.180 1.00 . A A . 42 TRP CZ3 1 1 13 9212 1 1 42 TRP H H -3.311 3.241 -0.121 1.00 . A A . 42 TRP H 1 1 13 9213 1 1 42 TRP HA H -1.763 4.299 -2.359 1.00 . A A . 42 TRP HA 1 1 13 9214 1 1 42 TRP HB2 H -2.996 5.516 0.031 1.00 . A A . 42 TRP HB2 1 1 13 9215 1 1 42 TRP HB3 H -1.339 6.006 -0.263 1.00 . A A . 42 TRP HB3 1 1 13 9216 1 1 42 TRP HD1 H -0.881 7.478 -2.476 1.00 . A A . 42 TRP HD1 1 1 13 9217 1 1 42 TRP HE1 H -2.416 8.961 -3.887 1.00 . A A . 42 TRP HE1 1 1 13 9218 1 1 42 TRP HE3 H -5.413 5.692 -0.910 1.00 . A A . 42 TRP HE3 1 1 13 9219 1 1 42 TRP HH2 H -7.332 8.477 -3.522 1.00 . A A . 42 TRP HH2 1 1 13 9220 1 1 42 TRP HZ2 H -5.175 9.347 -4.294 1.00 . A A . 42 TRP HZ2 1 1 13 9221 1 1 42 TRP HZ3 H -7.460 6.692 -1.869 1.00 . A A . 42 TRP HZ3 1 1 13 9222 1 1 42 TRP N N -2.997 3.328 -1.052 1.00 . A A . 42 TRP N 1 1 13 9223 1 1 42 TRP NE1 N -2.747 8.282 -3.257 1.00 . A A . 42 TRP NE1 1 1 13 9224 1 1 42 TRP O O -0.580 3.628 0.601 1.00 . A A . 42 TRP O 1 1 13 9225 1 1 43 CYS C C 2.386 3.680 -0.538 1.00 . A A . 43 CYS C 1 1 13 9226 1 1 43 CYS CA C 1.420 2.591 -0.929 1.00 . A A . 43 CYS CA 1 1 13 9227 1 1 43 CYS CB C 2.059 1.683 -1.979 1.00 . A A . 43 CYS CB 1 1 13 9228 1 1 43 CYS H H 0.104 3.266 -2.395 1.00 . A A . 43 CYS H 1 1 13 9229 1 1 43 CYS HA H 1.172 2.003 -0.059 1.00 . A A . 43 CYS HA 1 1 13 9230 1 1 43 CYS HB2 H 2.316 2.278 -2.842 1.00 . A A . 43 CYS HB2 1 1 13 9231 1 1 43 CYS HB3 H 2.964 1.263 -1.564 1.00 . A A . 43 CYS HB3 1 1 13 9232 1 1 43 CYS N N 0.215 3.182 -1.422 1.00 . A A . 43 CYS N 1 1 13 9233 1 1 43 CYS O O 2.492 4.699 -1.214 1.00 . A A . 43 CYS O 1 1 13 9234 1 1 43 CYS SG S 1.014 0.303 -2.562 1.00 . A A . 43 CYS SG 1 1 13 9235 1 1 44 THR C C 5.390 3.819 0.830 1.00 . A A . 44 THR C 1 1 13 9236 1 1 44 THR CA C 4.011 4.422 1.005 1.00 . A A . 44 THR CA 1 1 13 9237 1 1 44 THR CB C 3.753 4.749 2.485 1.00 . A A . 44 THR CB 1 1 13 9238 1 1 44 THR CG2 C 4.700 5.837 2.985 1.00 . A A . 44 THR CG2 1 1 13 9239 1 1 44 THR H H 2.954 2.642 1.037 1.00 . A A . 44 THR H 1 1 13 9240 1 1 44 THR HA H 3.928 5.328 0.421 1.00 . A A . 44 THR HA 1 1 13 9241 1 1 44 THR HB H 3.893 3.849 3.068 1.00 . A A . 44 THR HB 1 1 13 9242 1 1 44 THR HG1 H 1.935 4.976 1.805 1.00 . A A . 44 THR HG1 1 1 13 9243 1 1 44 THR HG21 H 4.557 6.735 2.403 1.00 . A A . 44 THR HG21 1 1 13 9244 1 1 44 THR HG22 H 5.722 5.500 2.883 1.00 . A A . 44 THR HG22 1 1 13 9245 1 1 44 THR HG23 H 4.495 6.044 4.024 1.00 . A A . 44 THR HG23 1 1 13 9246 1 1 44 THR N N 3.059 3.484 0.539 1.00 . A A . 44 THR N 1 1 13 9247 1 1 44 THR O O 5.679 2.743 1.366 1.00 . A A . 44 THR O 1 1 13 9248 1 1 44 THR OG1 O 2.389 5.194 2.629 1.00 . A A . 44 THR OG1 1 1 13 9249 1 1 45 LYS C C 8.480 5.124 0.147 1.00 . A A . 45 LYS C 1 1 13 9250 1 1 45 LYS CA C 7.536 3.989 -0.171 1.00 . A A . 45 LYS CA 1 1 13 9251 1 1 45 LYS CB C 7.714 3.465 -1.616 1.00 . A A . 45 LYS CB 1 1 13 9252 1 1 45 LYS CD C 7.616 3.903 -4.095 1.00 . A A . 45 LYS CD 1 1 13 9253 1 1 45 LYS CE C 7.839 4.933 -5.196 1.00 . A A . 45 LYS CE 1 1 13 9254 1 1 45 LYS CG C 7.663 4.521 -2.705 1.00 . A A . 45 LYS CG 1 1 13 9255 1 1 45 LYS H H 5.905 5.283 -0.394 1.00 . A A . 45 LYS H 1 1 13 9256 1 1 45 LYS HA H 7.717 3.186 0.529 1.00 . A A . 45 LYS HA 1 1 13 9257 1 1 45 LYS HB2 H 8.668 2.963 -1.689 1.00 . A A . 45 LYS HB2 1 1 13 9258 1 1 45 LYS HB3 H 6.930 2.746 -1.809 1.00 . A A . 45 LYS HB3 1 1 13 9259 1 1 45 LYS HD2 H 8.383 3.149 -4.172 1.00 . A A . 45 LYS HD2 1 1 13 9260 1 1 45 LYS HD3 H 6.649 3.442 -4.237 1.00 . A A . 45 LYS HD3 1 1 13 9261 1 1 45 LYS HE2 H 8.860 5.280 -5.149 1.00 . A A . 45 LYS HE2 1 1 13 9262 1 1 45 LYS HE3 H 7.675 4.454 -6.150 1.00 . A A . 45 LYS HE3 1 1 13 9263 1 1 45 LYS HG2 H 6.781 5.128 -2.564 1.00 . A A . 45 LYS HG2 1 1 13 9264 1 1 45 LYS HG3 H 8.542 5.144 -2.627 1.00 . A A . 45 LYS HG3 1 1 13 9265 1 1 45 LYS HZ1 H 5.943 5.821 -4.985 1.00 . A A . 45 LYS HZ1 1 1 13 9266 1 1 45 LYS HZ2 H 7.022 6.669 -5.952 1.00 . A A . 45 LYS HZ2 1 1 13 9267 1 1 45 LYS HZ3 H 7.222 6.700 -4.281 1.00 . A A . 45 LYS HZ3 1 1 13 9268 1 1 45 LYS N N 6.200 4.452 0.045 1.00 . A A . 45 LYS N 1 1 13 9269 1 1 45 LYS NZ N 6.942 6.101 -5.083 1.00 . A A . 45 LYS NZ 1 1 13 9270 1 1 45 LYS O O 8.028 6.256 0.399 1.00 . A A . 45 LYS O 1 1 13 9271 1 1 46 ASN C C 11.265 6.444 -0.802 1.00 . A A . 46 ASN C 1 1 13 9272 1 1 46 ASN CA C 10.692 5.890 0.475 1.00 . A A . 46 ASN CA 1 1 13 9273 1 1 46 ASN CB C 11.820 5.422 1.415 1.00 . A A . 46 ASN CB 1 1 13 9274 1 1 46 ASN CG C 11.324 4.919 2.766 1.00 . A A . 46 ASN CG 1 1 13 9275 1 1 46 ASN H H 10.053 3.943 0.001 1.00 . A A . 46 ASN H 1 1 13 9276 1 1 46 ASN HA H 10.144 6.683 0.962 1.00 . A A . 46 ASN HA 1 1 13 9277 1 1 46 ASN HB2 H 12.363 4.620 0.939 1.00 . A A . 46 ASN HB2 1 1 13 9278 1 1 46 ASN HB3 H 12.495 6.248 1.582 1.00 . A A . 46 ASN HB3 1 1 13 9279 1 1 46 ASN HD21 H 11.461 3.046 2.155 1.00 . A A . 46 ASN HD21 1 1 13 9280 1 1 46 ASN HD22 H 10.969 3.255 3.784 1.00 . A A . 46 ASN HD22 1 1 13 9281 1 1 46 ASN N N 9.743 4.856 0.184 1.00 . A A . 46 ASN N 1 1 13 9282 1 1 46 ASN ND2 N 11.224 3.623 2.914 1.00 . A A . 46 ASN ND2 1 1 13 9283 1 1 46 ASN O O 11.861 5.720 -1.598 1.00 . A A . 46 ASN O 1 1 13 9284 1 1 46 ASN OD1 O 11.067 5.706 3.693 1.00 . A A . 46 ASN OD1 1 1 13 9285 1 1 47 CYS C C 12.637 9.340 -1.619 1.00 . A A . 47 CYS C 1 1 13 9286 1 1 47 CYS CA C 11.550 8.416 -2.128 1.00 . A A . 47 CYS CA 1 1 13 9287 1 1 47 CYS CB C 10.439 9.209 -2.843 1.00 . A A . 47 CYS CB 1 1 13 9288 1 1 47 CYS H H 10.500 8.199 -0.358 1.00 . A A . 47 CYS H 1 1 13 9289 1 1 47 CYS HA H 11.988 7.706 -2.813 1.00 . A A . 47 CYS HA 1 1 13 9290 1 1 47 CYS HB2 H 9.881 9.767 -2.105 1.00 . A A . 47 CYS HB2 1 1 13 9291 1 1 47 CYS HB3 H 10.889 9.902 -3.539 1.00 . A A . 47 CYS HB3 1 1 13 9292 1 1 47 CYS N N 11.032 7.689 -1.010 1.00 . A A . 47 CYS N 1 1 13 9293 1 1 47 CYS O O 13.814 8.951 -1.666 1.00 . A A . 47 CYS O 1 1 13 9294 1 1 47 CYS OXT O 12.324 10.425 -1.083 1.00 . A A . 47 CYS OXT 1 1 13 9295 1 1 47 CYS SG S 9.236 8.182 -3.773 1.00 . A A . 47 CYS SG 1 1 14 9296 1 1 1 LYS C C 10.023 10.093 2.619 1.00 . A A . 1 LYS C 1 1 14 9297 1 1 1 LYS CA C 10.842 11.197 3.228 1.00 . A A . 1 LYS CA 1 1 14 9298 1 1 1 LYS CB C 11.157 12.233 2.154 1.00 . A A . 1 LYS CB 1 1 14 9299 1 1 1 LYS CD C 10.300 13.838 0.411 1.00 . A A . 1 LYS CD 1 1 14 9300 1 1 1 LYS CE C 11.298 14.914 0.783 1.00 . A A . 1 LYS CE 1 1 14 9301 1 1 1 LYS CG C 9.936 12.962 1.599 1.00 . A A . 1 LYS CG 1 1 14 9302 1 1 1 LYS H1 H 11.859 9.961 4.523 1.00 . A A . 1 LYS H1 1 1 14 9303 1 1 1 LYS H2 H 12.751 11.343 4.062 1.00 . A A . 1 LYS H2 1 1 14 9304 1 1 1 LYS H3 H 12.508 10.064 2.988 1.00 . A A . 1 LYS H3 1 1 14 9305 1 1 1 LYS HA H 10.292 11.660 4.033 1.00 . A A . 1 LYS HA 1 1 14 9306 1 1 1 LYS HB2 H 11.833 12.962 2.573 1.00 . A A . 1 LYS HB2 1 1 14 9307 1 1 1 LYS HB3 H 11.652 11.732 1.335 1.00 . A A . 1 LYS HB3 1 1 14 9308 1 1 1 LYS HD2 H 10.733 13.217 -0.359 1.00 . A A . 1 LYS HD2 1 1 14 9309 1 1 1 LYS HD3 H 9.403 14.306 0.032 1.00 . A A . 1 LYS HD3 1 1 14 9310 1 1 1 LYS HE2 H 10.820 15.590 1.475 1.00 . A A . 1 LYS HE2 1 1 14 9311 1 1 1 LYS HE3 H 12.152 14.461 1.263 1.00 . A A . 1 LYS HE3 1 1 14 9312 1 1 1 LYS HG2 H 9.206 12.231 1.286 1.00 . A A . 1 LYS HG2 1 1 14 9313 1 1 1 LYS HG3 H 9.516 13.581 2.378 1.00 . A A . 1 LYS HG3 1 1 14 9314 1 1 1 LYS HZ1 H 12.134 15.036 -1.115 1.00 . A A . 1 LYS HZ1 1 1 14 9315 1 1 1 LYS HZ2 H 12.521 16.319 -0.126 1.00 . A A . 1 LYS HZ2 1 1 14 9316 1 1 1 LYS HZ3 H 10.985 16.231 -0.822 1.00 . A A . 1 LYS HZ3 1 1 14 9317 1 1 1 LYS N N 12.072 10.623 3.749 1.00 . A A . 1 LYS N 1 1 14 9318 1 1 1 LYS NZ N 11.749 15.675 -0.390 1.00 . A A . 1 LYS NZ 1 1 14 9319 1 1 1 LYS O O 10.570 9.196 1.983 1.00 . A A . 1 LYS O 1 1 14 9320 1 1 2 THR C C 6.892 9.803 1.303 1.00 . A A . 2 THR C 1 1 14 9321 1 1 2 THR CA C 7.879 9.161 2.249 1.00 . A A . 2 THR CA 1 1 14 9322 1 1 2 THR CB C 7.140 8.388 3.349 1.00 . A A . 2 THR CB 1 1 14 9323 1 1 2 THR CG2 C 8.039 7.330 3.946 1.00 . A A . 2 THR CG2 1 1 14 9324 1 1 2 THR H H 8.344 10.813 3.397 1.00 . A A . 2 THR H 1 1 14 9325 1 1 2 THR HA H 8.483 8.457 1.697 1.00 . A A . 2 THR HA 1 1 14 9326 1 1 2 THR HB H 6.274 7.917 2.909 1.00 . A A . 2 THR HB 1 1 14 9327 1 1 2 THR HG1 H 5.834 9.023 4.698 1.00 . A A . 2 THR HG1 1 1 14 9328 1 1 2 THR HG21 H 8.334 6.657 3.154 1.00 . A A . 2 THR HG21 1 1 14 9329 1 1 2 THR HG22 H 7.505 6.786 4.712 1.00 . A A . 2 THR HG22 1 1 14 9330 1 1 2 THR HG23 H 8.917 7.794 4.368 1.00 . A A . 2 THR HG23 1 1 14 9331 1 1 2 THR N N 8.747 10.130 2.819 1.00 . A A . 2 THR N 1 1 14 9332 1 1 2 THR O O 6.400 10.913 1.554 1.00 . A A . 2 THR O 1 1 14 9333 1 1 2 THR OG1 O 6.700 9.305 4.377 1.00 . A A . 2 THR OG1 1 1 14 9334 1 1 3 CYS C C 4.689 8.471 -0.894 1.00 . A A . 3 CYS C 1 1 14 9335 1 1 3 CYS CA C 5.635 9.617 -0.690 1.00 . A A . 3 CYS CA 1 1 14 9336 1 1 3 CYS CB C 6.194 10.184 -2.024 1.00 . A A . 3 CYS CB 1 1 14 9337 1 1 3 CYS H H 7.138 8.338 -0.002 1.00 . A A . 3 CYS H 1 1 14 9338 1 1 3 CYS HA H 5.094 10.388 -0.159 1.00 . A A . 3 CYS HA 1 1 14 9339 1 1 3 CYS HB2 H 5.393 10.670 -2.558 1.00 . A A . 3 CYS HB2 1 1 14 9340 1 1 3 CYS HB3 H 6.944 10.926 -1.790 1.00 . A A . 3 CYS HB3 1 1 14 9341 1 1 3 CYS N N 6.649 9.167 0.210 1.00 . A A . 3 CYS N 1 1 14 9342 1 1 3 CYS O O 5.081 7.295 -0.722 1.00 . A A . 3 CYS O 1 1 14 9343 1 1 3 CYS SG S 6.946 8.998 -3.183 1.00 . A A . 3 CYS SG 1 1 14 9344 1 1 4 GLU C C 1.781 7.828 -2.615 1.00 . A A . 4 GLU C 1 1 14 9345 1 1 4 GLU CA C 2.470 7.762 -1.266 1.00 . A A . 4 GLU CA 1 1 14 9346 1 1 4 GLU CB C 1.511 8.011 -0.127 1.00 . A A . 4 GLU CB 1 1 14 9347 1 1 4 GLU CD C -0.229 7.211 1.402 1.00 . A A . 4 GLU CD 1 1 14 9348 1 1 4 GLU CG C 0.569 6.896 0.181 1.00 . A A . 4 GLU CG 1 1 14 9349 1 1 4 GLU H H 3.208 9.695 -1.383 1.00 . A A . 4 GLU H 1 1 14 9350 1 1 4 GLU HA H 2.930 6.794 -1.132 1.00 . A A . 4 GLU HA 1 1 14 9351 1 1 4 GLU HB2 H 2.088 8.208 0.763 1.00 . A A . 4 GLU HB2 1 1 14 9352 1 1 4 GLU HB3 H 0.932 8.893 -0.360 1.00 . A A . 4 GLU HB3 1 1 14 9353 1 1 4 GLU HG2 H -0.088 6.776 -0.667 1.00 . A A . 4 GLU HG2 1 1 14 9354 1 1 4 GLU HG3 H 1.129 5.987 0.344 1.00 . A A . 4 GLU HG3 1 1 14 9355 1 1 4 GLU N N 3.471 8.768 -1.196 1.00 . A A . 4 GLU N 1 1 14 9356 1 1 4 GLU O O 1.527 8.922 -3.128 1.00 . A A . 4 GLU O 1 1 14 9357 1 1 4 GLU OE1 O -1.400 7.569 1.289 1.00 . A A . 4 GLU OE1 1 1 14 9358 1 1 4 GLU OE2 O 0.339 7.176 2.513 1.00 . A A . 4 GLU OE2 1 1 14 9359 1 1 5 ASN C C 0.027 5.363 -4.562 1.00 . A A . 5 ASN C 1 1 14 9360 1 1 5 ASN CA C 0.920 6.593 -4.516 1.00 . A A . 5 ASN CA 1 1 14 9361 1 1 5 ASN CB C 2.032 6.523 -5.591 1.00 . A A . 5 ASN CB 1 1 14 9362 1 1 5 ASN CG C 1.520 6.459 -7.026 1.00 . A A . 5 ASN CG 1 1 14 9363 1 1 5 ASN H H 1.735 5.845 -2.725 1.00 . A A . 5 ASN H 1 1 14 9364 1 1 5 ASN HA H 0.319 7.476 -4.676 1.00 . A A . 5 ASN HA 1 1 14 9365 1 1 5 ASN HB2 H 2.657 7.399 -5.503 1.00 . A A . 5 ASN HB2 1 1 14 9366 1 1 5 ASN HB3 H 2.637 5.648 -5.402 1.00 . A A . 5 ASN HB3 1 1 14 9367 1 1 5 ASN HD21 H 1.488 8.442 -7.152 1.00 . A A . 5 ASN HD21 1 1 14 9368 1 1 5 ASN HD22 H 0.989 7.575 -8.558 1.00 . A A . 5 ASN HD22 1 1 14 9369 1 1 5 ASN N N 1.526 6.683 -3.195 1.00 . A A . 5 ASN N 1 1 14 9370 1 1 5 ASN ND2 N 1.314 7.602 -7.634 1.00 . A A . 5 ASN ND2 1 1 14 9371 1 1 5 ASN O O 0.246 4.418 -3.801 1.00 . A A . 5 ASN O 1 1 14 9372 1 1 5 ASN OD1 O 1.318 5.380 -7.582 1.00 . A A . 5 ASN OD1 1 1 14 9373 1 1 6 LEU C C -1.319 2.969 -5.977 1.00 . A A . 6 LEU C 1 1 14 9374 1 1 6 LEU CA C -1.942 4.292 -5.545 1.00 . A A . 6 LEU CA 1 1 14 9375 1 1 6 LEU CB C -3.076 4.663 -6.508 1.00 . A A . 6 LEU CB 1 1 14 9376 1 1 6 LEU CD1 C -5.165 5.938 -6.995 1.00 . A A . 6 LEU CD1 1 1 14 9377 1 1 6 LEU CD2 C -5.003 4.582 -4.964 1.00 . A A . 6 LEU CD2 1 1 14 9378 1 1 6 LEU CG C -4.229 5.458 -5.914 1.00 . A A . 6 LEU CG 1 1 14 9379 1 1 6 LEU H H -1.127 6.192 -5.959 1.00 . A A . 6 LEU H 1 1 14 9380 1 1 6 LEU HA H -2.385 4.139 -4.573 1.00 . A A . 6 LEU HA 1 1 14 9381 1 1 6 LEU HB2 H -2.653 5.236 -7.319 1.00 . A A . 6 LEU HB2 1 1 14 9382 1 1 6 LEU HB3 H -3.475 3.746 -6.915 1.00 . A A . 6 LEU HB3 1 1 14 9383 1 1 6 LEU HD11 H -5.961 6.488 -6.515 1.00 . A A . 6 LEU HD11 1 1 14 9384 1 1 6 LEU HD12 H -5.583 5.082 -7.502 1.00 . A A . 6 LEU HD12 1 1 14 9385 1 1 6 LEU HD13 H -4.641 6.578 -7.689 1.00 . A A . 6 LEU HD13 1 1 14 9386 1 1 6 LEU HD21 H -4.369 4.253 -4.154 1.00 . A A . 6 LEU HD21 1 1 14 9387 1 1 6 LEU HD22 H -5.378 3.720 -5.496 1.00 . A A . 6 LEU HD22 1 1 14 9388 1 1 6 LEU HD23 H -5.834 5.142 -4.561 1.00 . A A . 6 LEU HD23 1 1 14 9389 1 1 6 LEU HG H -3.857 6.304 -5.355 1.00 . A A . 6 LEU HG 1 1 14 9390 1 1 6 LEU N N -0.991 5.395 -5.403 1.00 . A A . 6 LEU N 1 1 14 9391 1 1 6 LEU O O -0.301 2.925 -6.688 1.00 . A A . 6 LEU O 1 1 14 9392 1 1 7 ALA C C -2.436 0.182 -7.114 1.00 . A A . 7 ALA C 1 1 14 9393 1 1 7 ALA CA C -1.587 0.561 -5.900 1.00 . A A . 7 ALA CA 1 1 14 9394 1 1 7 ALA CB C -1.843 -0.391 -4.741 1.00 . A A . 7 ALA CB 1 1 14 9395 1 1 7 ALA H H -2.647 2.037 -4.849 1.00 . A A . 7 ALA H 1 1 14 9396 1 1 7 ALA HA H -0.539 0.537 -6.162 1.00 . A A . 7 ALA HA 1 1 14 9397 1 1 7 ALA HB1 H -2.882 -0.327 -4.452 1.00 . A A . 7 ALA HB1 1 1 14 9398 1 1 7 ALA HB2 H -1.222 -0.116 -3.902 1.00 . A A . 7 ALA HB2 1 1 14 9399 1 1 7 ALA HB3 H -1.617 -1.403 -5.039 1.00 . A A . 7 ALA HB3 1 1 14 9400 1 1 7 ALA N N -1.931 1.904 -5.512 1.00 . A A . 7 ALA N 1 1 14 9401 1 1 7 ALA O O -3.677 0.170 -7.038 1.00 . A A . 7 ALA O 1 1 14 9402 1 1 8 ASP C C -2.983 -1.800 -9.553 1.00 . A A . 8 ASP C 1 1 14 9403 1 1 8 ASP CA C -2.431 -0.380 -9.498 1.00 . A A . 8 ASP CA 1 1 14 9404 1 1 8 ASP CB C -1.435 -0.166 -10.650 1.00 . A A . 8 ASP CB 1 1 14 9405 1 1 8 ASP CG C -2.001 -0.517 -12.017 1.00 . A A . 8 ASP CG 1 1 14 9406 1 1 8 ASP H H -0.797 -0.096 -8.168 1.00 . A A . 8 ASP H 1 1 14 9407 1 1 8 ASP HA H -3.246 0.316 -9.626 1.00 . A A . 8 ASP HA 1 1 14 9408 1 1 8 ASP HB2 H -1.135 0.872 -10.668 1.00 . A A . 8 ASP HB2 1 1 14 9409 1 1 8 ASP HB3 H -0.562 -0.777 -10.474 1.00 . A A . 8 ASP HB3 1 1 14 9410 1 1 8 ASP N N -1.778 -0.087 -8.217 1.00 . A A . 8 ASP N 1 1 14 9411 1 1 8 ASP O O -4.120 -2.026 -9.998 1.00 . A A . 8 ASP O 1 1 14 9412 1 1 8 ASP OD1 O -2.603 0.354 -12.675 1.00 . A A . 8 ASP OD1 1 1 14 9413 1 1 8 ASP OD2 O -1.841 -1.653 -12.470 1.00 . A A . 8 ASP OD2 1 1 14 9414 1 1 9 THR C C -3.595 -4.484 -8.102 1.00 . A A . 9 THR C 1 1 14 9415 1 1 9 THR CA C -2.525 -4.129 -9.140 1.00 . A A . 9 THR CA 1 1 14 9416 1 1 9 THR CB C -1.265 -4.939 -8.864 1.00 . A A . 9 THR CB 1 1 14 9417 1 1 9 THR CG2 C -1.469 -6.386 -9.233 1.00 . A A . 9 THR CG2 1 1 14 9418 1 1 9 THR H H -1.319 -2.525 -8.705 1.00 . A A . 9 THR H 1 1 14 9419 1 1 9 THR HA H -2.872 -4.374 -10.131 1.00 . A A . 9 THR HA 1 1 14 9420 1 1 9 THR HB H -1.019 -4.868 -7.815 1.00 . A A . 9 THR HB 1 1 14 9421 1 1 9 THR HG1 H 0.607 -4.834 -9.328 1.00 . A A . 9 THR HG1 1 1 14 9422 1 1 9 THR HG21 H -2.276 -6.786 -8.640 1.00 . A A . 9 THR HG21 1 1 14 9423 1 1 9 THR HG22 H -0.560 -6.936 -9.045 1.00 . A A . 9 THR HG22 1 1 14 9424 1 1 9 THR HG23 H -1.726 -6.438 -10.280 1.00 . A A . 9 THR HG23 1 1 14 9425 1 1 9 THR N N -2.195 -2.735 -9.093 1.00 . A A . 9 THR N 1 1 14 9426 1 1 9 THR O O -4.450 -5.358 -8.343 1.00 . A A . 9 THR O 1 1 14 9427 1 1 9 THR OG1 O -0.196 -4.406 -9.652 1.00 . A A . 9 THR OG1 1 1 14 9428 1 1 10 TYR C C -5.886 -3.628 -6.335 1.00 . A A . 10 TYR C 1 1 14 9429 1 1 10 TYR CA C -4.499 -4.071 -5.904 1.00 . A A . 10 TYR CA 1 1 14 9430 1 1 10 TYR CB C -4.095 -3.371 -4.594 1.00 . A A . 10 TYR CB 1 1 14 9431 1 1 10 TYR CD1 C -6.234 -3.213 -3.228 1.00 . A A . 10 TYR CD1 1 1 14 9432 1 1 10 TYR CD2 C -4.516 -4.672 -2.467 1.00 . A A . 10 TYR CD2 1 1 14 9433 1 1 10 TYR CE1 C -7.023 -3.572 -2.171 1.00 . A A . 10 TYR CE1 1 1 14 9434 1 1 10 TYR CE2 C -5.303 -5.033 -1.396 1.00 . A A . 10 TYR CE2 1 1 14 9435 1 1 10 TYR CG C -4.963 -3.756 -3.404 1.00 . A A . 10 TYR CG 1 1 14 9436 1 1 10 TYR CZ C -6.559 -4.481 -1.259 1.00 . A A . 10 TYR CZ 1 1 14 9437 1 1 10 TYR H H -2.873 -3.112 -6.850 1.00 . A A . 10 TYR H 1 1 14 9438 1 1 10 TYR HA H -4.516 -5.139 -5.743 1.00 . A A . 10 TYR HA 1 1 14 9439 1 1 10 TYR HB2 H -3.074 -3.629 -4.357 1.00 . A A . 10 TYR HB2 1 1 14 9440 1 1 10 TYR HB3 H -4.166 -2.302 -4.729 1.00 . A A . 10 TYR HB3 1 1 14 9441 1 1 10 TYR HD1 H -6.604 -2.497 -3.947 1.00 . A A . 10 TYR HD1 1 1 14 9442 1 1 10 TYR HD2 H -3.531 -5.101 -2.580 1.00 . A A . 10 TYR HD2 1 1 14 9443 1 1 10 TYR HE1 H -8.004 -3.130 -2.065 1.00 . A A . 10 TYR HE1 1 1 14 9444 1 1 10 TYR HE2 H -4.924 -5.749 -0.681 1.00 . A A . 10 TYR HE2 1 1 14 9445 1 1 10 TYR HH H -6.892 -4.607 0.611 1.00 . A A . 10 TYR HH 1 1 14 9446 1 1 10 TYR N N -3.554 -3.807 -6.964 1.00 . A A . 10 TYR N 1 1 14 9447 1 1 10 TYR O O -6.138 -2.432 -6.549 1.00 . A A . 10 TYR O 1 1 14 9448 1 1 10 TYR OH O -7.347 -4.834 -0.210 1.00 . A A . 10 TYR OH 1 1 14 9449 1 1 11 LYS C C -9.073 -4.689 -5.753 1.00 . A A . 11 LYS C 1 1 14 9450 1 1 11 LYS CA C -8.107 -4.323 -6.872 1.00 . A A . 11 LYS CA 1 1 14 9451 1 1 11 LYS CB C -8.405 -5.077 -8.167 1.00 . A A . 11 LYS CB 1 1 14 9452 1 1 11 LYS CD C -8.236 -7.218 -9.482 1.00 . A A . 11 LYS CD 1 1 14 9453 1 1 11 LYS CE C -7.321 -6.622 -10.553 1.00 . A A . 11 LYS CE 1 1 14 9454 1 1 11 LYS CG C -8.044 -6.560 -8.129 1.00 . A A . 11 LYS CG 1 1 14 9455 1 1 11 LYS H H -6.485 -5.498 -6.297 1.00 . A A . 11 LYS H 1 1 14 9456 1 1 11 LYS HA H -8.186 -3.264 -7.063 1.00 . A A . 11 LYS HA 1 1 14 9457 1 1 11 LYS HB2 H -9.458 -4.991 -8.389 1.00 . A A . 11 LYS HB2 1 1 14 9458 1 1 11 LYS HB3 H -7.843 -4.611 -8.961 1.00 . A A . 11 LYS HB3 1 1 14 9459 1 1 11 LYS HD2 H -8.023 -8.273 -9.390 1.00 . A A . 11 LYS HD2 1 1 14 9460 1 1 11 LYS HD3 H -9.263 -7.087 -9.786 1.00 . A A . 11 LYS HD3 1 1 14 9461 1 1 11 LYS HE2 H -7.548 -7.110 -11.486 1.00 . A A . 11 LYS HE2 1 1 14 9462 1 1 11 LYS HE3 H -7.524 -5.567 -10.658 1.00 . A A . 11 LYS HE3 1 1 14 9463 1 1 11 LYS HG2 H -7.009 -6.660 -7.839 1.00 . A A . 11 LYS HG2 1 1 14 9464 1 1 11 LYS HG3 H -8.671 -7.054 -7.401 1.00 . A A . 11 LYS HG3 1 1 14 9465 1 1 11 LYS HZ1 H -5.637 -7.828 -10.159 1.00 . A A . 11 LYS HZ1 1 1 14 9466 1 1 11 LYS HZ2 H -5.560 -6.320 -9.405 1.00 . A A . 11 LYS HZ2 1 1 14 9467 1 1 11 LYS HZ3 H -5.308 -6.447 -11.049 1.00 . A A . 11 LYS HZ3 1 1 14 9468 1 1 11 LYS N N -6.756 -4.572 -6.473 1.00 . A A . 11 LYS N 1 1 14 9469 1 1 11 LYS NZ N -5.876 -6.821 -10.262 1.00 . A A . 11 LYS NZ 1 1 14 9470 1 1 11 LYS O O -8.913 -5.726 -5.088 1.00 . A A . 11 LYS O 1 1 14 9471 1 1 12 GLY C C -10.835 -3.021 -3.383 1.00 . A A . 12 GLY C 1 1 14 9472 1 1 12 GLY CA C -10.992 -4.047 -4.483 1.00 . A A . 12 GLY CA 1 1 14 9473 1 1 12 GLY H H -10.060 -3.014 -6.059 1.00 . A A . 12 GLY H 1 1 14 9474 1 1 12 GLY HA2 H -11.980 -3.967 -4.912 1.00 . A A . 12 GLY HA2 1 1 14 9475 1 1 12 GLY HA3 H -10.857 -5.034 -4.066 1.00 . A A . 12 GLY HA3 1 1 14 9476 1 1 12 GLY N N -10.023 -3.834 -5.520 1.00 . A A . 12 GLY N 1 1 14 9477 1 1 12 GLY O O -9.843 -2.275 -3.378 1.00 . A A . 12 GLY O 1 1 14 9478 1 1 13 PRO C C -10.896 -2.538 -0.209 1.00 . A A . 13 PRO C 1 1 14 9479 1 1 13 PRO CA C -11.712 -1.965 -1.365 1.00 . A A . 13 PRO CA 1 1 14 9480 1 1 13 PRO CB C -13.177 -1.756 -0.935 1.00 . A A . 13 PRO CB 1 1 14 9481 1 1 13 PRO CD C -13.038 -3.691 -2.407 1.00 . A A . 13 PRO CD 1 1 14 9482 1 1 13 PRO CG C -13.994 -2.778 -1.683 1.00 . A A . 13 PRO CG 1 1 14 9483 1 1 13 PRO HA H -11.281 -1.027 -1.681 1.00 . A A . 13 PRO HA 1 1 14 9484 1 1 13 PRO HB2 H -13.256 -1.900 0.133 1.00 . A A . 13 PRO HB2 1 1 14 9485 1 1 13 PRO HB3 H -13.483 -0.752 -1.184 1.00 . A A . 13 PRO HB3 1 1 14 9486 1 1 13 PRO HD2 H -12.893 -4.602 -1.846 1.00 . A A . 13 PRO HD2 1 1 14 9487 1 1 13 PRO HD3 H -13.405 -3.911 -3.399 1.00 . A A . 13 PRO HD3 1 1 14 9488 1 1 13 PRO HG2 H -14.586 -3.348 -0.983 1.00 . A A . 13 PRO HG2 1 1 14 9489 1 1 13 PRO HG3 H -14.644 -2.279 -2.387 1.00 . A A . 13 PRO HG3 1 1 14 9490 1 1 13 PRO N N -11.795 -2.909 -2.462 1.00 . A A . 13 PRO N 1 1 14 9491 1 1 13 PRO O O -10.930 -3.746 0.051 1.00 . A A . 13 PRO O 1 1 14 9492 1 1 14 CYS C C -10.206 -2.460 2.791 1.00 . A A . 14 CYS C 1 1 14 9493 1 1 14 CYS CA C -9.350 -2.135 1.573 1.00 . A A . 14 CYS CA 1 1 14 9494 1 1 14 CYS CB C -8.270 -1.110 1.945 1.00 . A A . 14 CYS CB 1 1 14 9495 1 1 14 CYS H H -10.140 -0.757 0.178 1.00 . A A . 14 CYS H 1 1 14 9496 1 1 14 CYS HA H -8.860 -3.045 1.260 1.00 . A A . 14 CYS HA 1 1 14 9497 1 1 14 CYS HB2 H -7.544 -1.057 1.148 1.00 . A A . 14 CYS HB2 1 1 14 9498 1 1 14 CYS HB3 H -8.730 -0.142 2.074 1.00 . A A . 14 CYS HB3 1 1 14 9499 1 1 14 CYS N N -10.153 -1.700 0.455 1.00 . A A . 14 CYS N 1 1 14 9500 1 1 14 CYS O O -10.849 -1.571 3.387 1.00 . A A . 14 CYS O 1 1 14 9501 1 1 14 CYS SG S -7.379 -1.526 3.499 1.00 . A A . 14 CYS SG 1 1 14 9502 1 1 15 PHE C C -9.942 -4.171 5.475 1.00 . A A . 15 PHE C 1 1 14 9503 1 1 15 PHE CA C -10.933 -4.160 4.321 1.00 . A A . 15 PHE CA 1 1 14 9504 1 1 15 PHE CB C -11.549 -5.554 4.129 1.00 . A A . 15 PHE CB 1 1 14 9505 1 1 15 PHE CD1 C -13.746 -5.020 3.040 1.00 . A A . 15 PHE CD1 1 1 14 9506 1 1 15 PHE CD2 C -12.188 -6.365 1.842 1.00 . A A . 15 PHE CD2 1 1 14 9507 1 1 15 PHE CE1 C -14.634 -5.109 1.991 1.00 . A A . 15 PHE CE1 1 1 14 9508 1 1 15 PHE CE2 C -13.075 -6.458 0.790 1.00 . A A . 15 PHE CE2 1 1 14 9509 1 1 15 PHE CG C -12.512 -5.644 2.979 1.00 . A A . 15 PHE CG 1 1 14 9510 1 1 15 PHE CZ C -14.300 -5.828 0.863 1.00 . A A . 15 PHE CZ 1 1 14 9511 1 1 15 PHE H H -9.785 -4.376 2.565 1.00 . A A . 15 PHE H 1 1 14 9512 1 1 15 PHE HA H -11.716 -3.444 4.527 1.00 . A A . 15 PHE HA 1 1 14 9513 1 1 15 PHE HB2 H -10.759 -6.269 3.956 1.00 . A A . 15 PHE HB2 1 1 14 9514 1 1 15 PHE HB3 H -12.077 -5.826 5.030 1.00 . A A . 15 PHE HB3 1 1 14 9515 1 1 15 PHE HD1 H -14.011 -4.454 3.920 1.00 . A A . 15 PHE HD1 1 1 14 9516 1 1 15 PHE HD2 H -11.229 -6.860 1.780 1.00 . A A . 15 PHE HD2 1 1 14 9517 1 1 15 PHE HE1 H -15.592 -4.614 2.054 1.00 . A A . 15 PHE HE1 1 1 14 9518 1 1 15 PHE HE2 H -12.815 -7.023 -0.093 1.00 . A A . 15 PHE HE2 1 1 14 9519 1 1 15 PHE HZ H -14.994 -5.900 0.038 1.00 . A A . 15 PHE HZ 1 1 14 9520 1 1 15 PHE N N -10.243 -3.724 3.137 1.00 . A A . 15 PHE N 1 1 14 9521 1 1 15 PHE O O -10.043 -3.376 6.404 1.00 . A A . 15 PHE O 1 1 14 9522 1 1 16 THR C C -6.688 -4.424 5.883 1.00 . A A . 16 THR C 1 1 14 9523 1 1 16 THR CA C -7.951 -5.138 6.397 1.00 . A A . 16 THR CA 1 1 14 9524 1 1 16 THR CB C -7.625 -6.616 6.679 1.00 . A A . 16 THR CB 1 1 14 9525 1 1 16 THR CG2 C -6.760 -6.754 7.927 1.00 . A A . 16 THR CG2 1 1 14 9526 1 1 16 THR H H -8.940 -5.687 4.650 1.00 . A A . 16 THR H 1 1 14 9527 1 1 16 THR HA H -8.305 -4.670 7.303 1.00 . A A . 16 THR HA 1 1 14 9528 1 1 16 THR HB H -7.087 -7.006 5.827 1.00 . A A . 16 THR HB 1 1 14 9529 1 1 16 THR HG1 H -9.504 -6.766 7.277 1.00 . A A . 16 THR HG1 1 1 14 9530 1 1 16 THR HG21 H -6.547 -7.799 8.102 1.00 . A A . 16 THR HG21 1 1 14 9531 1 1 16 THR HG22 H -7.286 -6.349 8.779 1.00 . A A . 16 THR HG22 1 1 14 9532 1 1 16 THR HG23 H -5.833 -6.217 7.787 1.00 . A A . 16 THR HG23 1 1 14 9533 1 1 16 THR N N -8.975 -5.050 5.396 1.00 . A A . 16 THR N 1 1 14 9534 1 1 16 THR O O -6.097 -4.845 4.882 1.00 . A A . 16 THR O 1 1 14 9535 1 1 16 THR OG1 O -8.851 -7.348 6.870 1.00 . A A . 16 THR OG1 1 1 14 9536 1 1 17 THR C C -3.845 -3.444 6.098 1.00 . A A . 17 THR C 1 1 14 9537 1 1 17 THR CA C -5.119 -2.584 6.143 1.00 . A A . 17 THR CA 1 1 14 9538 1 1 17 THR CB C -4.940 -1.361 7.065 1.00 . A A . 17 THR CB 1 1 14 9539 1 1 17 THR CG2 C -3.736 -0.514 6.653 1.00 . A A . 17 THR CG2 1 1 14 9540 1 1 17 THR H H -6.802 -3.061 7.323 1.00 . A A . 17 THR H 1 1 14 9541 1 1 17 THR HA H -5.310 -2.229 5.140 1.00 . A A . 17 THR HA 1 1 14 9542 1 1 17 THR HB H -4.813 -1.707 8.080 1.00 . A A . 17 THR HB 1 1 14 9543 1 1 17 THR HG1 H -6.248 -0.396 6.031 1.00 . A A . 17 THR HG1 1 1 14 9544 1 1 17 THR HG21 H -3.883 -0.145 5.648 1.00 . A A . 17 THR HG21 1 1 14 9545 1 1 17 THR HG22 H -2.844 -1.123 6.682 1.00 . A A . 17 THR HG22 1 1 14 9546 1 1 17 THR HG23 H -3.626 0.318 7.333 1.00 . A A . 17 THR HG23 1 1 14 9547 1 1 17 THR N N -6.290 -3.358 6.540 1.00 . A A . 17 THR N 1 1 14 9548 1 1 17 THR O O -3.008 -3.264 5.220 1.00 . A A . 17 THR O 1 1 14 9549 1 1 17 THR OG1 O -6.128 -0.560 6.977 1.00 . A A . 17 THR OG1 1 1 14 9550 1 1 18 GLY C C -2.424 -6.081 5.709 1.00 . A A . 18 GLY C 1 1 14 9551 1 1 18 GLY CA C -2.612 -5.319 7.024 1.00 . A A . 18 GLY CA 1 1 14 9552 1 1 18 GLY H H -4.456 -4.502 7.677 1.00 . A A . 18 GLY H 1 1 14 9553 1 1 18 GLY HA2 H -1.725 -4.737 7.219 1.00 . A A . 18 GLY HA2 1 1 14 9554 1 1 18 GLY HA3 H -2.750 -6.027 7.828 1.00 . A A . 18 GLY HA3 1 1 14 9555 1 1 18 GLY N N -3.754 -4.417 6.996 1.00 . A A . 18 GLY N 1 1 14 9556 1 1 18 GLY O O -1.297 -6.329 5.283 1.00 . A A . 18 GLY O 1 1 14 9557 1 1 19 SER C C -3.002 -6.171 2.674 1.00 . A A . 19 SER C 1 1 14 9558 1 1 19 SER CA C -3.488 -7.121 3.786 1.00 . A A . 19 SER CA 1 1 14 9559 1 1 19 SER CB C -4.889 -7.625 3.469 1.00 . A A . 19 SER CB 1 1 14 9560 1 1 19 SER H H -4.403 -6.200 5.431 1.00 . A A . 19 SER H 1 1 14 9561 1 1 19 SER HA H -2.816 -7.962 3.873 1.00 . A A . 19 SER HA 1 1 14 9562 1 1 19 SER HB2 H -5.512 -6.790 3.184 1.00 . A A . 19 SER HB2 1 1 14 9563 1 1 19 SER HB3 H -4.845 -8.340 2.661 1.00 . A A . 19 SER HB3 1 1 14 9564 1 1 19 SER HG H -5.995 -8.994 4.289 1.00 . A A . 19 SER HG 1 1 14 9565 1 1 19 SER N N -3.525 -6.415 5.055 1.00 . A A . 19 SER N 1 1 14 9566 1 1 19 SER O O -2.271 -6.566 1.770 1.00 . A A . 19 SER O 1 1 14 9567 1 1 19 SER OG O -5.457 -8.259 4.612 1.00 . A A . 19 SER OG 1 1 14 9568 1 1 20 CYS C C -1.530 -3.550 2.005 1.00 . A A . 20 CYS C 1 1 14 9569 1 1 20 CYS CA C -3.013 -3.883 1.838 1.00 . A A . 20 CYS CA 1 1 14 9570 1 1 20 CYS CB C -3.886 -2.647 2.062 1.00 . A A . 20 CYS CB 1 1 14 9571 1 1 20 CYS H H -3.939 -4.665 3.563 1.00 . A A . 20 CYS H 1 1 14 9572 1 1 20 CYS HA H -3.181 -4.266 0.843 1.00 . A A . 20 CYS HA 1 1 14 9573 1 1 20 CYS HB2 H -4.917 -2.907 1.872 1.00 . A A . 20 CYS HB2 1 1 14 9574 1 1 20 CYS HB3 H -3.789 -2.337 3.092 1.00 . A A . 20 CYS HB3 1 1 14 9575 1 1 20 CYS N N -3.390 -4.916 2.792 1.00 . A A . 20 CYS N 1 1 14 9576 1 1 20 CYS O O -0.784 -3.419 1.028 1.00 . A A . 20 CYS O 1 1 14 9577 1 1 20 CYS SG S -3.495 -1.227 1.017 1.00 . A A . 20 CYS SG 1 1 14 9578 1 1 21 ASP C C 1.156 -4.378 3.099 1.00 . A A . 21 ASP C 1 1 14 9579 1 1 21 ASP CA C 0.294 -3.229 3.587 1.00 . A A . 21 ASP CA 1 1 14 9580 1 1 21 ASP CB C 0.460 -3.002 5.091 1.00 . A A . 21 ASP CB 1 1 14 9581 1 1 21 ASP CG C 1.902 -2.900 5.529 1.00 . A A . 21 ASP CG 1 1 14 9582 1 1 21 ASP H H -1.750 -3.566 3.988 1.00 . A A . 21 ASP H 1 1 14 9583 1 1 21 ASP HA H 0.604 -2.340 3.061 1.00 . A A . 21 ASP HA 1 1 14 9584 1 1 21 ASP HB2 H -0.039 -2.083 5.365 1.00 . A A . 21 ASP HB2 1 1 14 9585 1 1 21 ASP HB3 H -0.005 -3.823 5.619 1.00 . A A . 21 ASP HB3 1 1 14 9586 1 1 21 ASP N N -1.099 -3.471 3.256 1.00 . A A . 21 ASP N 1 1 14 9587 1 1 21 ASP O O 2.253 -4.164 2.587 1.00 . A A . 21 ASP O 1 1 14 9588 1 1 21 ASP OD1 O 2.578 -1.877 5.240 1.00 . A A . 21 ASP OD1 1 1 14 9589 1 1 21 ASP OD2 O 2.377 -3.820 6.216 1.00 . A A . 21 ASP OD2 1 1 14 9590 1 1 22 ASP C C 1.523 -6.658 1.197 1.00 . A A . 22 ASP C 1 1 14 9591 1 1 22 ASP CA C 1.291 -6.792 2.690 1.00 . A A . 22 ASP CA 1 1 14 9592 1 1 22 ASP CB C 0.454 -8.051 2.951 1.00 . A A . 22 ASP CB 1 1 14 9593 1 1 22 ASP CG C 1.099 -9.320 2.424 1.00 . A A . 22 ASP CG 1 1 14 9594 1 1 22 ASP H H -0.249 -5.686 3.650 1.00 . A A . 22 ASP H 1 1 14 9595 1 1 22 ASP HA H 2.245 -6.890 3.188 1.00 . A A . 22 ASP HA 1 1 14 9596 1 1 22 ASP HB2 H 0.287 -8.162 4.011 1.00 . A A . 22 ASP HB2 1 1 14 9597 1 1 22 ASP HB3 H -0.497 -7.934 2.456 1.00 . A A . 22 ASP HB3 1 1 14 9598 1 1 22 ASP N N 0.619 -5.592 3.200 1.00 . A A . 22 ASP N 1 1 14 9599 1 1 22 ASP O O 2.606 -6.960 0.702 1.00 . A A . 22 ASP O 1 1 14 9600 1 1 22 ASP OD1 O 1.733 -10.050 3.209 1.00 . A A . 22 ASP OD1 1 1 14 9601 1 1 22 ASP OD2 O 0.965 -9.634 1.222 1.00 . A A . 22 ASP OD2 1 1 14 9602 1 1 23 HIS C C 1.687 -4.967 -1.263 1.00 . A A . 23 HIS C 1 1 14 9603 1 1 23 HIS CA C 0.595 -5.981 -0.940 1.00 . A A . 23 HIS CA 1 1 14 9604 1 1 23 HIS CB C -0.769 -5.537 -1.519 1.00 . A A . 23 HIS CB 1 1 14 9605 1 1 23 HIS CD2 C -0.454 -4.365 -3.817 1.00 . A A . 23 HIS CD2 1 1 14 9606 1 1 23 HIS CE1 C -1.094 -5.966 -5.130 1.00 . A A . 23 HIS CE1 1 1 14 9607 1 1 23 HIS CG C -0.798 -5.408 -3.024 1.00 . A A . 23 HIS CG 1 1 14 9608 1 1 23 HIS H H -0.321 -5.924 0.951 1.00 . A A . 23 HIS H 1 1 14 9609 1 1 23 HIS HA H 0.871 -6.928 -1.377 1.00 . A A . 23 HIS HA 1 1 14 9610 1 1 23 HIS HB2 H -1.522 -6.259 -1.238 1.00 . A A . 23 HIS HB2 1 1 14 9611 1 1 23 HIS HB3 H -1.031 -4.579 -1.097 1.00 . A A . 23 HIS HB3 1 1 14 9612 1 1 23 HIS HD1 H -1.538 -7.298 -3.612 1.00 . A A . 23 HIS HD1 1 1 14 9613 1 1 23 HIS HD2 H -0.093 -3.412 -3.457 1.00 . A A . 23 HIS HD2 1 1 14 9614 1 1 23 HIS HE1 H -1.342 -6.547 -6.007 1.00 . A A . 23 HIS HE1 1 1 14 9615 1 1 23 HIS N N 0.511 -6.170 0.490 1.00 . A A . 23 HIS N 1 1 14 9616 1 1 23 HIS ND1 N -1.205 -6.411 -3.877 1.00 . A A . 23 HIS ND1 1 1 14 9617 1 1 23 HIS NE2 N -0.642 -4.722 -5.154 1.00 . A A . 23 HIS NE2 1 1 14 9618 1 1 23 HIS O O 2.561 -5.223 -2.091 1.00 . A A . 23 HIS O 1 1 14 9619 1 1 24 CYS C C 4.080 -3.269 -0.428 1.00 . A A . 24 CYS C 1 1 14 9620 1 1 24 CYS CA C 2.650 -2.831 -0.810 1.00 . A A . 24 CYS CA 1 1 14 9621 1 1 24 CYS CB C 2.256 -1.529 -0.125 1.00 . A A . 24 CYS CB 1 1 14 9622 1 1 24 CYS H H 0.981 -3.725 0.110 1.00 . A A . 24 CYS H 1 1 14 9623 1 1 24 CYS HA H 2.640 -2.665 -1.877 1.00 . A A . 24 CYS HA 1 1 14 9624 1 1 24 CYS HB2 H 2.213 -1.694 0.942 1.00 . A A . 24 CYS HB2 1 1 14 9625 1 1 24 CYS HB3 H 3.002 -0.779 -0.335 1.00 . A A . 24 CYS HB3 1 1 14 9626 1 1 24 CYS N N 1.677 -3.863 -0.571 1.00 . A A . 24 CYS N 1 1 14 9627 1 1 24 CYS O O 5.020 -2.974 -1.157 1.00 . A A . 24 CYS O 1 1 14 9628 1 1 24 CYS SG S 0.628 -0.867 -0.649 1.00 . A A . 24 CYS SG 1 1 14 9629 1 1 25 LYS C C 6.076 -5.641 0.252 1.00 . A A . 25 LYS C 1 1 14 9630 1 1 25 LYS CA C 5.592 -4.449 1.084 1.00 . A A . 25 LYS CA 1 1 14 9631 1 1 25 LYS CB C 5.681 -4.883 2.560 1.00 . A A . 25 LYS CB 1 1 14 9632 1 1 25 LYS CD C 5.954 -4.314 4.956 1.00 . A A . 25 LYS CD 1 1 14 9633 1 1 25 LYS CE C 5.390 -3.618 6.193 1.00 . A A . 25 LYS CE 1 1 14 9634 1 1 25 LYS CG C 5.313 -3.874 3.634 1.00 . A A . 25 LYS CG 1 1 14 9635 1 1 25 LYS H H 3.467 -4.230 1.239 1.00 . A A . 25 LYS H 1 1 14 9636 1 1 25 LYS HA H 6.268 -3.622 0.927 1.00 . A A . 25 LYS HA 1 1 14 9637 1 1 25 LYS HB2 H 5.021 -5.727 2.689 1.00 . A A . 25 LYS HB2 1 1 14 9638 1 1 25 LYS HB3 H 6.691 -5.221 2.743 1.00 . A A . 25 LYS HB3 1 1 14 9639 1 1 25 LYS HD2 H 5.808 -5.376 5.071 1.00 . A A . 25 LYS HD2 1 1 14 9640 1 1 25 LYS HD3 H 7.015 -4.116 4.895 1.00 . A A . 25 LYS HD3 1 1 14 9641 1 1 25 LYS HE2 H 4.399 -4.006 6.382 1.00 . A A . 25 LYS HE2 1 1 14 9642 1 1 25 LYS HE3 H 6.023 -3.850 7.036 1.00 . A A . 25 LYS HE3 1 1 14 9643 1 1 25 LYS HG2 H 5.686 -2.900 3.352 1.00 . A A . 25 LYS HG2 1 1 14 9644 1 1 25 LYS HG3 H 4.240 -3.842 3.754 1.00 . A A . 25 LYS HG3 1 1 14 9645 1 1 25 LYS HZ1 H 5.129 -1.712 6.976 1.00 . A A . 25 LYS HZ1 1 1 14 9646 1 1 25 LYS HZ2 H 4.420 -1.968 5.507 1.00 . A A . 25 LYS HZ2 1 1 14 9647 1 1 25 LYS HZ3 H 6.118 -1.728 5.590 1.00 . A A . 25 LYS HZ3 1 1 14 9648 1 1 25 LYS N N 4.245 -4.004 0.679 1.00 . A A . 25 LYS N 1 1 14 9649 1 1 25 LYS NZ N 5.289 -2.158 6.052 1.00 . A A . 25 LYS NZ 1 1 14 9650 1 1 25 LYS O O 7.146 -5.608 -0.342 1.00 . A A . 25 LYS O 1 1 14 9651 1 1 26 ASN C C 5.500 -8.017 -1.869 1.00 . A A . 26 ASN C 1 1 14 9652 1 1 26 ASN CA C 5.662 -7.963 -0.368 1.00 . A A . 26 ASN CA 1 1 14 9653 1 1 26 ASN CB C 4.876 -9.109 0.300 1.00 . A A . 26 ASN CB 1 1 14 9654 1 1 26 ASN CG C 5.317 -9.371 1.730 1.00 . A A . 26 ASN CG 1 1 14 9655 1 1 26 ASN H H 4.362 -6.584 0.575 1.00 . A A . 26 ASN H 1 1 14 9656 1 1 26 ASN HA H 6.707 -8.111 -0.139 1.00 . A A . 26 ASN HA 1 1 14 9657 1 1 26 ASN HB2 H 3.826 -8.856 0.313 1.00 . A A . 26 ASN HB2 1 1 14 9658 1 1 26 ASN HB3 H 5.014 -10.013 -0.274 1.00 . A A . 26 ASN HB3 1 1 14 9659 1 1 26 ASN HD21 H 3.437 -9.723 2.365 1.00 . A A . 26 ASN HD21 1 1 14 9660 1 1 26 ASN HD22 H 4.681 -9.836 3.530 1.00 . A A . 26 ASN HD22 1 1 14 9661 1 1 26 ASN N N 5.273 -6.677 0.211 1.00 . A A . 26 ASN N 1 1 14 9662 1 1 26 ASN ND2 N 4.393 -9.670 2.608 1.00 . A A . 26 ASN ND2 1 1 14 9663 1 1 26 ASN O O 6.333 -8.593 -2.570 1.00 . A A . 26 ASN O 1 1 14 9664 1 1 26 ASN OD1 O 6.494 -9.261 2.054 1.00 . A A . 26 ASN OD1 1 1 14 9665 1 1 27 LYS C C 4.827 -6.322 -4.539 1.00 . A A . 27 LYS C 1 1 14 9666 1 1 27 LYS CA C 4.177 -7.489 -3.798 1.00 . A A . 27 LYS CA 1 1 14 9667 1 1 27 LYS CB C 2.653 -7.554 -4.085 1.00 . A A . 27 LYS CB 1 1 14 9668 1 1 27 LYS CD C 2.097 -9.415 -2.381 1.00 . A A . 27 LYS CD 1 1 14 9669 1 1 27 LYS CE C 1.311 -10.700 -2.163 1.00 . A A . 27 LYS CE 1 1 14 9670 1 1 27 LYS CG C 1.953 -8.912 -3.816 1.00 . A A . 27 LYS CG 1 1 14 9671 1 1 27 LYS H H 3.840 -6.926 -1.790 1.00 . A A . 27 LYS H 1 1 14 9672 1 1 27 LYS HA H 4.628 -8.404 -4.149 1.00 . A A . 27 LYS HA 1 1 14 9673 1 1 27 LYS HB2 H 2.166 -6.810 -3.472 1.00 . A A . 27 LYS HB2 1 1 14 9674 1 1 27 LYS HB3 H 2.496 -7.292 -5.121 1.00 . A A . 27 LYS HB3 1 1 14 9675 1 1 27 LYS HD2 H 3.142 -9.611 -2.190 1.00 . A A . 27 LYS HD2 1 1 14 9676 1 1 27 LYS HD3 H 1.746 -8.661 -1.695 1.00 . A A . 27 LYS HD3 1 1 14 9677 1 1 27 LYS HE2 H 0.260 -10.492 -2.299 1.00 . A A . 27 LYS HE2 1 1 14 9678 1 1 27 LYS HE3 H 1.629 -11.427 -2.895 1.00 . A A . 27 LYS HE3 1 1 14 9679 1 1 27 LYS HG2 H 0.900 -8.802 -4.026 1.00 . A A . 27 LYS HG2 1 1 14 9680 1 1 27 LYS HG3 H 2.364 -9.649 -4.490 1.00 . A A . 27 LYS HG3 1 1 14 9681 1 1 27 LYS HZ1 H 2.503 -11.541 -0.667 1.00 . A A . 27 LYS HZ1 1 1 14 9682 1 1 27 LYS HZ2 H 0.928 -12.106 -0.658 1.00 . A A . 27 LYS HZ2 1 1 14 9683 1 1 27 LYS HZ3 H 1.265 -10.577 -0.049 1.00 . A A . 27 LYS HZ3 1 1 14 9684 1 1 27 LYS N N 4.449 -7.428 -2.373 1.00 . A A . 27 LYS N 1 1 14 9685 1 1 27 LYS NZ N 1.512 -11.258 -0.805 1.00 . A A . 27 LYS NZ 1 1 14 9686 1 1 27 LYS O O 5.583 -6.522 -5.498 1.00 . A A . 27 LYS O 1 1 14 9687 1 1 28 GLU C C 6.519 -3.566 -4.252 1.00 . A A . 28 GLU C 1 1 14 9688 1 1 28 GLU CA C 5.103 -3.908 -4.691 1.00 . A A . 28 GLU CA 1 1 14 9689 1 1 28 GLU CB C 4.165 -2.738 -4.421 1.00 . A A . 28 GLU CB 1 1 14 9690 1 1 28 GLU CD C 2.788 -2.979 -6.516 1.00 . A A . 28 GLU CD 1 1 14 9691 1 1 28 GLU CG C 2.779 -2.929 -5.005 1.00 . A A . 28 GLU CG 1 1 14 9692 1 1 28 GLU H H 4.015 -5.036 -3.257 1.00 . A A . 28 GLU H 1 1 14 9693 1 1 28 GLU HA H 5.114 -4.088 -5.756 1.00 . A A . 28 GLU HA 1 1 14 9694 1 1 28 GLU HB2 H 4.079 -2.603 -3.354 1.00 . A A . 28 GLU HB2 1 1 14 9695 1 1 28 GLU HB3 H 4.593 -1.843 -4.848 1.00 . A A . 28 GLU HB3 1 1 14 9696 1 1 28 GLU HG2 H 2.372 -3.860 -4.633 1.00 . A A . 28 GLU HG2 1 1 14 9697 1 1 28 GLU HG3 H 2.149 -2.110 -4.689 1.00 . A A . 28 GLU HG3 1 1 14 9698 1 1 28 GLU N N 4.591 -5.120 -4.051 1.00 . A A . 28 GLU N 1 1 14 9699 1 1 28 GLU O O 7.169 -2.695 -4.857 1.00 . A A . 28 GLU O 1 1 14 9700 1 1 28 GLU OE1 O 2.356 -1.992 -7.152 1.00 . A A . 28 GLU OE1 1 1 14 9701 1 1 28 GLU OE2 O 3.223 -3.983 -7.094 1.00 . A A . 28 GLU OE2 1 1 14 9702 1 1 29 HIS C C 8.586 -2.665 -2.097 1.00 . A A . 29 HIS C 1 1 14 9703 1 1 29 HIS CA C 8.339 -4.063 -2.637 1.00 . A A . 29 HIS CA 1 1 14 9704 1 1 29 HIS CB C 9.432 -4.480 -3.636 1.00 . A A . 29 HIS CB 1 1 14 9705 1 1 29 HIS CD2 C 8.750 -6.843 -4.452 1.00 . A A . 29 HIS CD2 1 1 14 9706 1 1 29 HIS CE1 C 10.416 -7.976 -3.656 1.00 . A A . 29 HIS CE1 1 1 14 9707 1 1 29 HIS CG C 9.556 -5.962 -3.813 1.00 . A A . 29 HIS CG 1 1 14 9708 1 1 29 HIS H H 6.373 -4.865 -2.753 1.00 . A A . 29 HIS H 1 1 14 9709 1 1 29 HIS HA H 8.383 -4.733 -1.792 1.00 . A A . 29 HIS HA 1 1 14 9710 1 1 29 HIS HB2 H 9.206 -4.049 -4.600 1.00 . A A . 29 HIS HB2 1 1 14 9711 1 1 29 HIS HB3 H 10.384 -4.101 -3.292 1.00 . A A . 29 HIS HB3 1 1 14 9712 1 1 29 HIS HD1 H 11.375 -6.349 -2.816 1.00 . A A . 29 HIS HD1 1 1 14 9713 1 1 29 HIS HD2 H 7.829 -6.595 -4.961 1.00 . A A . 29 HIS HD2 1 1 14 9714 1 1 29 HIS HE1 H 11.087 -8.782 -3.396 1.00 . A A . 29 HIS HE1 1 1 14 9715 1 1 29 HIS N N 6.978 -4.233 -3.192 1.00 . A A . 29 HIS N 1 1 14 9716 1 1 29 HIS ND1 N 10.606 -6.703 -3.318 1.00 . A A . 29 HIS ND1 1 1 14 9717 1 1 29 HIS NE2 N 9.297 -8.121 -4.349 1.00 . A A . 29 HIS NE2 1 1 14 9718 1 1 29 HIS O O 9.727 -2.191 -2.039 1.00 . A A . 29 HIS O 1 1 14 9719 1 1 30 LEU C C 7.711 -0.774 0.413 1.00 . A A . 30 LEU C 1 1 14 9720 1 1 30 LEU CA C 7.637 -0.715 -1.100 1.00 . A A . 30 LEU CA 1 1 14 9721 1 1 30 LEU CB C 6.473 0.158 -1.579 1.00 . A A . 30 LEU CB 1 1 14 9722 1 1 30 LEU CD1 C 5.259 1.313 -3.450 1.00 . A A . 30 LEU CD1 1 1 14 9723 1 1 30 LEU CD2 C 7.713 0.892 -3.649 1.00 . A A . 30 LEU CD2 1 1 14 9724 1 1 30 LEU CG C 6.391 0.375 -3.095 1.00 . A A . 30 LEU CG 1 1 14 9725 1 1 30 LEU H H 6.671 -2.493 -1.638 1.00 . A A . 30 LEU H 1 1 14 9726 1 1 30 LEU HA H 8.561 -0.289 -1.458 1.00 . A A . 30 LEU HA 1 1 14 9727 1 1 30 LEU HB2 H 5.553 -0.306 -1.254 1.00 . A A . 30 LEU HB2 1 1 14 9728 1 1 30 LEU HB3 H 6.555 1.125 -1.105 1.00 . A A . 30 LEU HB3 1 1 14 9729 1 1 30 LEU HD11 H 5.252 1.481 -4.516 1.00 . A A . 30 LEU HD11 1 1 14 9730 1 1 30 LEU HD12 H 5.385 2.253 -2.935 1.00 . A A . 30 LEU HD12 1 1 14 9731 1 1 30 LEU HD13 H 4.322 0.863 -3.157 1.00 . A A . 30 LEU HD13 1 1 14 9732 1 1 30 LEU HD21 H 7.996 1.803 -3.143 1.00 . A A . 30 LEU HD21 1 1 14 9733 1 1 30 LEU HD22 H 7.588 1.101 -4.700 1.00 . A A . 30 LEU HD22 1 1 14 9734 1 1 30 LEU HD23 H 8.483 0.146 -3.521 1.00 . A A . 30 LEU HD23 1 1 14 9735 1 1 30 LEU HG H 6.181 -0.576 -3.565 1.00 . A A . 30 LEU HG 1 1 14 9736 1 1 30 LEU N N 7.543 -2.037 -1.643 1.00 . A A . 30 LEU N 1 1 14 9737 1 1 30 LEU O O 7.750 -1.860 0.999 1.00 . A A . 30 LEU O 1 1 14 9738 1 1 31 ARG C C 6.670 -0.025 3.242 1.00 . A A . 31 ARG C 1 1 14 9739 1 1 31 ARG CA C 7.889 0.482 2.468 1.00 . A A . 31 ARG CA 1 1 14 9740 1 1 31 ARG CB C 8.238 1.925 2.851 1.00 . A A . 31 ARG CB 1 1 14 9741 1 1 31 ARG CD C 8.752 3.618 4.604 1.00 . A A . 31 ARG CD 1 1 14 9742 1 1 31 ARG CG C 8.337 2.187 4.342 1.00 . A A . 31 ARG CG 1 1 14 9743 1 1 31 ARG CZ C 9.333 4.973 6.606 1.00 . A A . 31 ARG CZ 1 1 14 9744 1 1 31 ARG H H 7.561 1.198 0.521 1.00 . A A . 31 ARG H 1 1 14 9745 1 1 31 ARG HA H 8.730 -0.145 2.726 1.00 . A A . 31 ARG HA 1 1 14 9746 1 1 31 ARG HB2 H 9.186 2.185 2.404 1.00 . A A . 31 ARG HB2 1 1 14 9747 1 1 31 ARG HB3 H 7.476 2.573 2.446 1.00 . A A . 31 ARG HB3 1 1 14 9748 1 1 31 ARG HD2 H 9.762 3.762 4.253 1.00 . A A . 31 ARG HD2 1 1 14 9749 1 1 31 ARG HD3 H 8.090 4.274 4.057 1.00 . A A . 31 ARG HD3 1 1 14 9750 1 1 31 ARG HE H 8.049 3.406 6.531 1.00 . A A . 31 ARG HE 1 1 14 9751 1 1 31 ARG HG2 H 7.372 2.011 4.793 1.00 . A A . 31 ARG HG2 1 1 14 9752 1 1 31 ARG HG3 H 9.068 1.519 4.774 1.00 . A A . 31 ARG HG3 1 1 14 9753 1 1 31 ARG HH11 H 10.595 5.429 5.023 1.00 . A A . 31 ARG HH11 1 1 14 9754 1 1 31 ARG HH12 H 10.777 6.404 6.398 1.00 . A A . 31 ARG HH12 1 1 14 9755 1 1 31 ARG HH21 H 8.352 4.808 8.384 1.00 . A A . 31 ARG HH21 1 1 14 9756 1 1 31 ARG HH22 H 9.492 6.061 8.326 1.00 . A A . 31 ARG HH22 1 1 14 9757 1 1 31 ARG N N 7.712 0.378 1.037 1.00 . A A . 31 ARG N 1 1 14 9758 1 1 31 ARG NE N 8.685 3.957 6.017 1.00 . A A . 31 ARG NE 1 1 14 9759 1 1 31 ARG NH1 N 10.297 5.639 5.959 1.00 . A A . 31 ARG NH1 1 1 14 9760 1 1 31 ARG NH2 N 9.047 5.296 7.850 1.00 . A A . 31 ARG NH2 1 1 14 9761 1 1 31 ARG O O 6.792 -0.927 4.072 1.00 . A A . 31 ARG O 1 1 14 9762 1 1 32 SER C C 3.095 0.441 2.829 1.00 . A A . 32 SER C 1 1 14 9763 1 1 32 SER CA C 4.319 0.159 3.695 1.00 . A A . 32 SER CA 1 1 14 9764 1 1 32 SER CB C 4.280 0.979 5.010 1.00 . A A . 32 SER CB 1 1 14 9765 1 1 32 SER H H 5.424 1.168 2.226 1.00 . A A . 32 SER H 1 1 14 9766 1 1 32 SER HA H 4.361 -0.893 3.934 1.00 . A A . 32 SER HA 1 1 14 9767 1 1 32 SER HB2 H 5.230 0.889 5.513 1.00 . A A . 32 SER HB2 1 1 14 9768 1 1 32 SER HB3 H 4.109 2.019 4.768 1.00 . A A . 32 SER HB3 1 1 14 9769 1 1 32 SER HG H 2.990 -0.366 5.708 1.00 . A A . 32 SER HG 1 1 14 9770 1 1 32 SER N N 5.509 0.517 2.959 1.00 . A A . 32 SER N 1 1 14 9771 1 1 32 SER O O 3.229 1.007 1.750 1.00 . A A . 32 SER O 1 1 14 9772 1 1 32 SER OG O 3.264 0.546 5.902 1.00 . A A . 32 SER OG 1 1 14 9773 1 1 33 GLY C C -0.329 0.866 3.463 1.00 . A A . 33 GLY C 1 1 14 9774 1 1 33 GLY CA C 0.716 0.290 2.555 1.00 . A A . 33 GLY CA 1 1 14 9775 1 1 33 GLY H H 1.893 -0.509 4.102 1.00 . A A . 33 GLY H 1 1 14 9776 1 1 33 GLY HA2 H 0.933 1.009 1.778 1.00 . A A . 33 GLY HA2 1 1 14 9777 1 1 33 GLY HA3 H 0.335 -0.611 2.100 1.00 . A A . 33 GLY HA3 1 1 14 9778 1 1 33 GLY N N 1.936 0.016 3.269 1.00 . A A . 33 GLY N 1 1 14 9779 1 1 33 GLY O O -0.414 0.482 4.645 1.00 . A A . 33 GLY O 1 1 14 9780 1 1 34 ARG C C -3.414 2.488 2.931 1.00 . A A . 34 ARG C 1 1 14 9781 1 1 34 ARG CA C -2.121 2.457 3.707 1.00 . A A . 34 ARG CA 1 1 14 9782 1 1 34 ARG CB C -1.709 3.888 4.068 1.00 . A A . 34 ARG CB 1 1 14 9783 1 1 34 ARG CD C -0.789 3.275 6.302 1.00 . A A . 34 ARG CD 1 1 14 9784 1 1 34 ARG CG C -0.510 3.979 4.991 1.00 . A A . 34 ARG CG 1 1 14 9785 1 1 34 ARG CZ C 0.904 2.315 7.830 1.00 . A A . 34 ARG CZ 1 1 14 9786 1 1 34 ARG H H -0.973 2.096 2.020 1.00 . A A . 34 ARG H 1 1 14 9787 1 1 34 ARG HA H -2.281 1.907 4.620 1.00 . A A . 34 ARG HA 1 1 14 9788 1 1 34 ARG HB2 H -1.472 4.419 3.159 1.00 . A A . 34 ARG HB2 1 1 14 9789 1 1 34 ARG HB3 H -2.545 4.378 4.547 1.00 . A A . 34 ARG HB3 1 1 14 9790 1 1 34 ARG HD2 H -1.659 3.721 6.760 1.00 . A A . 34 ARG HD2 1 1 14 9791 1 1 34 ARG HD3 H -0.988 2.233 6.103 1.00 . A A . 34 ARG HD3 1 1 14 9792 1 1 34 ARG HE H 0.592 4.286 7.456 1.00 . A A . 34 ARG HE 1 1 14 9793 1 1 34 ARG HG2 H 0.336 3.510 4.511 1.00 . A A . 34 ARG HG2 1 1 14 9794 1 1 34 ARG HG3 H -0.291 5.019 5.179 1.00 . A A . 34 ARG HG3 1 1 14 9795 1 1 34 ARG HH11 H 0.031 0.877 6.637 1.00 . A A . 34 ARG HH11 1 1 14 9796 1 1 34 ARG HH12 H 1.048 0.259 7.847 1.00 . A A . 34 ARG HH12 1 1 14 9797 1 1 34 ARG HH21 H 2.035 3.443 9.104 1.00 . A A . 34 ARG HH21 1 1 14 9798 1 1 34 ARG HH22 H 2.232 1.762 9.286 1.00 . A A . 34 ARG HH22 1 1 14 9799 1 1 34 ARG N N -1.087 1.804 2.954 1.00 . A A . 34 ARG N 1 1 14 9800 1 1 34 ARG NE N 0.326 3.366 7.234 1.00 . A A . 34 ARG NE 1 1 14 9801 1 1 34 ARG NH1 N 0.645 1.067 7.408 1.00 . A A . 34 ARG NH1 1 1 14 9802 1 1 34 ARG NH2 N 1.786 2.518 8.801 1.00 . A A . 34 ARG NH2 1 1 14 9803 1 1 34 ARG O O -3.426 2.529 1.696 1.00 . A A . 34 ARG O 1 1 14 9804 1 1 35 CYS C C -6.349 3.897 3.406 1.00 . A A . 35 CYS C 1 1 14 9805 1 1 35 CYS CA C -5.789 2.540 3.079 1.00 . A A . 35 CYS CA 1 1 14 9806 1 1 35 CYS CB C -6.654 1.438 3.667 1.00 . A A . 35 CYS CB 1 1 14 9807 1 1 35 CYS H H -4.414 2.430 4.626 1.00 . A A . 35 CYS H 1 1 14 9808 1 1 35 CYS HA H -5.726 2.433 2.006 1.00 . A A . 35 CYS HA 1 1 14 9809 1 1 35 CYS HB2 H -6.872 1.666 4.700 1.00 . A A . 35 CYS HB2 1 1 14 9810 1 1 35 CYS HB3 H -7.575 1.380 3.106 1.00 . A A . 35 CYS HB3 1 1 14 9811 1 1 35 CYS N N -4.485 2.475 3.649 1.00 . A A . 35 CYS N 1 1 14 9812 1 1 35 CYS O O -6.463 4.273 4.574 1.00 . A A . 35 CYS O 1 1 14 9813 1 1 35 CYS SG S -5.858 -0.204 3.604 1.00 . A A . 35 CYS SG 1 1 14 9814 1 1 36 ARG C C -8.618 6.084 2.530 1.00 . A A . 36 ARG C 1 1 14 9815 1 1 36 ARG CA C -7.099 5.994 2.590 1.00 . A A . 36 ARG CA 1 1 14 9816 1 1 36 ARG CB C -6.409 6.926 1.607 1.00 . A A . 36 ARG CB 1 1 14 9817 1 1 36 ARG CD C -4.511 7.530 3.157 1.00 . A A . 36 ARG CD 1 1 14 9818 1 1 36 ARG CG C -4.893 6.995 1.787 1.00 . A A . 36 ARG CG 1 1 14 9819 1 1 36 ARG CZ C -2.482 7.435 4.576 1.00 . A A . 36 ARG CZ 1 1 14 9820 1 1 36 ARG H H -6.562 4.273 1.496 1.00 . A A . 36 ARG H 1 1 14 9821 1 1 36 ARG HA H -6.812 6.275 3.590 1.00 . A A . 36 ARG HA 1 1 14 9822 1 1 36 ARG HB2 H -6.599 6.539 0.617 1.00 . A A . 36 ARG HB2 1 1 14 9823 1 1 36 ARG HB3 H -6.816 7.921 1.712 1.00 . A A . 36 ARG HB3 1 1 14 9824 1 1 36 ARG HD2 H -4.843 8.555 3.242 1.00 . A A . 36 ARG HD2 1 1 14 9825 1 1 36 ARG HD3 H -4.990 6.936 3.921 1.00 . A A . 36 ARG HD3 1 1 14 9826 1 1 36 ARG HE H -2.511 7.475 2.551 1.00 . A A . 36 ARG HE 1 1 14 9827 1 1 36 ARG HG2 H -4.487 6.000 1.683 1.00 . A A . 36 ARG HG2 1 1 14 9828 1 1 36 ARG HG3 H -4.470 7.635 1.027 1.00 . A A . 36 ARG HG3 1 1 14 9829 1 1 36 ARG HH11 H -4.214 7.590 5.661 1.00 . A A . 36 ARG HH11 1 1 14 9830 1 1 36 ARG HH12 H -2.817 7.437 6.604 1.00 . A A . 36 ARG HH12 1 1 14 9831 1 1 36 ARG HH21 H -0.601 7.265 3.824 1.00 . A A . 36 ARG HH21 1 1 14 9832 1 1 36 ARG HH22 H -0.675 7.281 5.532 1.00 . A A . 36 ARG HH22 1 1 14 9833 1 1 36 ARG N N -6.642 4.647 2.400 1.00 . A A . 36 ARG N 1 1 14 9834 1 1 36 ARG NE N -3.067 7.487 3.379 1.00 . A A . 36 ARG NE 1 1 14 9835 1 1 36 ARG NH1 N -3.215 7.497 5.686 1.00 . A A . 36 ARG NH1 1 1 14 9836 1 1 36 ARG NH2 N -1.170 7.321 4.663 1.00 . A A . 36 ARG NH2 1 1 14 9837 1 1 36 ARG O O -9.290 5.064 2.373 1.00 . A A . 36 ARG O 1 1 14 9838 1 1 37 ASP C C -11.384 7.178 1.504 1.00 . A A . 37 ASP C 1 1 14 9839 1 1 37 ASP CA C -10.603 7.573 2.760 1.00 . A A . 37 ASP CA 1 1 14 9840 1 1 37 ASP CB C -10.866 9.051 3.085 1.00 . A A . 37 ASP CB 1 1 14 9841 1 1 37 ASP CG C -10.527 10.003 1.952 1.00 . A A . 37 ASP CG 1 1 14 9842 1 1 37 ASP H H -8.530 8.058 2.744 1.00 . A A . 37 ASP H 1 1 14 9843 1 1 37 ASP HA H -10.983 6.981 3.580 1.00 . A A . 37 ASP HA 1 1 14 9844 1 1 37 ASP HB2 H -11.911 9.177 3.326 1.00 . A A . 37 ASP HB2 1 1 14 9845 1 1 37 ASP HB3 H -10.278 9.325 3.949 1.00 . A A . 37 ASP HB3 1 1 14 9846 1 1 37 ASP N N -9.145 7.295 2.670 1.00 . A A . 37 ASP N 1 1 14 9847 1 1 37 ASP O O -12.622 7.137 1.514 1.00 . A A . 37 ASP O 1 1 14 9848 1 1 37 ASP OD1 O -9.348 10.409 1.825 1.00 . A A . 37 ASP OD1 1 1 14 9849 1 1 37 ASP OD2 O -11.437 10.376 1.182 1.00 . A A . 37 ASP OD2 1 1 14 9850 1 1 38 ASP C C -11.379 4.925 -0.808 1.00 . A A . 38 ASP C 1 1 14 9851 1 1 38 ASP CA C -11.318 6.440 -0.797 1.00 . A A . 38 ASP CA 1 1 14 9852 1 1 38 ASP CB C -10.595 6.945 -2.053 1.00 . A A . 38 ASP CB 1 1 14 9853 1 1 38 ASP CG C -10.757 8.426 -2.279 1.00 . A A . 38 ASP CG 1 1 14 9854 1 1 38 ASP H H -9.712 7.067 0.468 1.00 . A A . 38 ASP H 1 1 14 9855 1 1 38 ASP HA H -12.330 6.818 -0.797 1.00 . A A . 38 ASP HA 1 1 14 9856 1 1 38 ASP HB2 H -9.540 6.737 -1.959 1.00 . A A . 38 ASP HB2 1 1 14 9857 1 1 38 ASP HB3 H -10.982 6.420 -2.915 1.00 . A A . 38 ASP HB3 1 1 14 9858 1 1 38 ASP N N -10.680 6.914 0.430 1.00 . A A . 38 ASP N 1 1 14 9859 1 1 38 ASP O O -11.825 4.321 -1.780 1.00 . A A . 38 ASP O 1 1 14 9860 1 1 38 ASP OD1 O -9.826 9.193 -2.003 1.00 . A A . 38 ASP OD1 1 1 14 9861 1 1 38 ASP OD2 O -11.831 8.851 -2.736 1.00 . A A . 38 ASP OD2 1 1 14 9862 1 1 39 PHE C C -9.978 2.118 -0.481 1.00 . A A . 39 PHE C 1 1 14 9863 1 1 39 PHE CA C -10.844 2.859 0.513 1.00 . A A . 39 PHE CA 1 1 14 9864 1 1 39 PHE CB C -12.250 2.251 0.625 1.00 . A A . 39 PHE CB 1 1 14 9865 1 1 39 PHE CD1 C -13.758 3.791 1.897 1.00 . A A . 39 PHE CD1 1 1 14 9866 1 1 39 PHE CD2 C -12.808 1.943 3.045 1.00 . A A . 39 PHE CD2 1 1 14 9867 1 1 39 PHE CE1 C -14.391 4.185 3.054 1.00 . A A . 39 PHE CE1 1 1 14 9868 1 1 39 PHE CE2 C -13.440 2.331 4.205 1.00 . A A . 39 PHE CE2 1 1 14 9869 1 1 39 PHE CG C -12.961 2.668 1.877 1.00 . A A . 39 PHE CG 1 1 14 9870 1 1 39 PHE CZ C -14.231 3.456 4.210 1.00 . A A . 39 PHE CZ 1 1 14 9871 1 1 39 PHE H H -10.515 4.889 0.999 1.00 . A A . 39 PHE H 1 1 14 9872 1 1 39 PHE HA H -10.355 2.745 1.470 1.00 . A A . 39 PHE HA 1 1 14 9873 1 1 39 PHE HB2 H -12.841 2.571 -0.220 1.00 . A A . 39 PHE HB2 1 1 14 9874 1 1 39 PHE HB3 H -12.174 1.173 0.622 1.00 . A A . 39 PHE HB3 1 1 14 9875 1 1 39 PHE HD1 H -13.885 4.364 0.990 1.00 . A A . 39 PHE HD1 1 1 14 9876 1 1 39 PHE HD2 H -12.189 1.058 3.041 1.00 . A A . 39 PHE HD2 1 1 14 9877 1 1 39 PHE HE1 H -15.011 5.069 3.054 1.00 . A A . 39 PHE HE1 1 1 14 9878 1 1 39 PHE HE2 H -13.311 1.758 5.111 1.00 . A A . 39 PHE HE2 1 1 14 9879 1 1 39 PHE HZ H -14.726 3.765 5.120 1.00 . A A . 39 PHE HZ 1 1 14 9880 1 1 39 PHE N N -10.877 4.321 0.283 1.00 . A A . 39 PHE N 1 1 14 9881 1 1 39 PHE O O -9.998 0.888 -0.553 1.00 . A A . 39 PHE O 1 1 14 9882 1 1 40 ARG C C -6.898 2.233 -1.522 1.00 . A A . 40 ARG C 1 1 14 9883 1 1 40 ARG CA C -8.289 2.301 -2.160 1.00 . A A . 40 ARG CA 1 1 14 9884 1 1 40 ARG CB C -8.285 3.189 -3.410 1.00 . A A . 40 ARG CB 1 1 14 9885 1 1 40 ARG CD C -8.788 1.374 -5.066 1.00 . A A . 40 ARG CD 1 1 14 9886 1 1 40 ARG CG C -7.830 2.495 -4.684 1.00 . A A . 40 ARG CG 1 1 14 9887 1 1 40 ARG CZ C -11.274 1.173 -5.046 1.00 . A A . 40 ARG CZ 1 1 14 9888 1 1 40 ARG H H -9.187 3.824 -1.031 1.00 . A A . 40 ARG H 1 1 14 9889 1 1 40 ARG HA H -8.629 1.307 -2.409 1.00 . A A . 40 ARG HA 1 1 14 9890 1 1 40 ARG HB2 H -9.287 3.560 -3.574 1.00 . A A . 40 ARG HB2 1 1 14 9891 1 1 40 ARG HB3 H -7.630 4.030 -3.232 1.00 . A A . 40 ARG HB3 1 1 14 9892 1 1 40 ARG HD2 H -8.451 0.940 -5.994 1.00 . A A . 40 ARG HD2 1 1 14 9893 1 1 40 ARG HD3 H -8.787 0.615 -4.299 1.00 . A A . 40 ARG HD3 1 1 14 9894 1 1 40 ARG HE H -10.202 2.826 -5.516 1.00 . A A . 40 ARG HE 1 1 14 9895 1 1 40 ARG HG2 H -7.795 3.221 -5.484 1.00 . A A . 40 ARG HG2 1 1 14 9896 1 1 40 ARG HG3 H -6.844 2.086 -4.523 1.00 . A A . 40 ARG HG3 1 1 14 9897 1 1 40 ARG HH11 H -10.341 -0.627 -4.743 1.00 . A A . 40 ARG HH11 1 1 14 9898 1 1 40 ARG HH12 H -12.041 -0.663 -4.653 1.00 . A A . 40 ARG HH12 1 1 14 9899 1 1 40 ARG HH21 H -12.579 2.738 -5.354 1.00 . A A . 40 ARG HH21 1 1 14 9900 1 1 40 ARG HH22 H -13.310 1.245 -4.988 1.00 . A A . 40 ARG HH22 1 1 14 9901 1 1 40 ARG N N -9.175 2.860 -1.188 1.00 . A A . 40 ARG N 1 1 14 9902 1 1 40 ARG NE N -10.157 1.881 -5.243 1.00 . A A . 40 ARG NE 1 1 14 9903 1 1 40 ARG NH1 N -11.207 -0.123 -4.794 1.00 . A A . 40 ARG NH1 1 1 14 9904 1 1 40 ARG NH2 N -12.462 1.763 -5.139 1.00 . A A . 40 ARG NH2 1 1 14 9905 1 1 40 ARG O O -6.653 2.917 -0.500 1.00 . A A . 40 ARG O 1 1 14 9906 1 1 41 CYS C C -3.683 2.253 -2.014 1.00 . A A . 41 CYS C 1 1 14 9907 1 1 41 CYS CA C -4.701 1.270 -1.511 1.00 . A A . 41 CYS CA 1 1 14 9908 1 1 41 CYS CB C -4.201 -0.153 -1.654 1.00 . A A . 41 CYS CB 1 1 14 9909 1 1 41 CYS H H -6.202 0.966 -2.919 1.00 . A A . 41 CYS H 1 1 14 9910 1 1 41 CYS HA H -4.819 1.462 -0.454 1.00 . A A . 41 CYS HA 1 1 14 9911 1 1 41 CYS HB2 H -4.444 -0.529 -2.636 1.00 . A A . 41 CYS HB2 1 1 14 9912 1 1 41 CYS HB3 H -3.130 -0.157 -1.519 1.00 . A A . 41 CYS HB3 1 1 14 9913 1 1 41 CYS N N -6.015 1.445 -2.083 1.00 . A A . 41 CYS N 1 1 14 9914 1 1 41 CYS O O -3.478 2.417 -3.221 1.00 . A A . 41 CYS O 1 1 14 9915 1 1 41 CYS SG S -4.904 -1.283 -0.436 1.00 . A A . 41 CYS SG 1 1 14 9916 1 1 42 TRP C C -0.754 3.321 -0.637 1.00 . A A . 42 TRP C 1 1 14 9917 1 1 42 TRP CA C -2.022 3.848 -1.294 1.00 . A A . 42 TRP CA 1 1 14 9918 1 1 42 TRP CB C -2.413 5.191 -0.686 1.00 . A A . 42 TRP CB 1 1 14 9919 1 1 42 TRP CD1 C -2.300 7.129 -2.347 1.00 . A A . 42 TRP CD1 1 1 14 9920 1 1 42 TRP CD2 C -4.375 6.395 -1.985 1.00 . A A . 42 TRP CD2 1 1 14 9921 1 1 42 TRP CE2 C -4.426 7.466 -2.896 1.00 . A A . 42 TRP CE2 1 1 14 9922 1 1 42 TRP CE3 C -5.567 5.778 -1.615 1.00 . A A . 42 TRP CE3 1 1 14 9923 1 1 42 TRP CG C -2.995 6.195 -1.644 1.00 . A A . 42 TRP CG 1 1 14 9924 1 1 42 TRP CH2 C -6.771 7.307 -3.052 1.00 . A A . 42 TRP CH2 1 1 14 9925 1 1 42 TRP CZ2 C -5.621 7.931 -3.436 1.00 . A A . 42 TRP CZ2 1 1 14 9926 1 1 42 TRP CZ3 C -6.752 6.239 -2.152 1.00 . A A . 42 TRP CZ3 1 1 14 9927 1 1 42 TRP H H -3.291 2.710 -0.134 1.00 . A A . 42 TRP H 1 1 14 9928 1 1 42 TRP HA H -1.868 3.961 -2.356 1.00 . A A . 42 TRP HA 1 1 14 9929 1 1 42 TRP HB2 H -3.163 5.004 0.068 1.00 . A A . 42 TRP HB2 1 1 14 9930 1 1 42 TRP HB3 H -1.552 5.628 -0.205 1.00 . A A . 42 TRP HB3 1 1 14 9931 1 1 42 TRP HD1 H -1.227 7.246 -2.310 1.00 . A A . 42 TRP HD1 1 1 14 9932 1 1 42 TRP HE1 H -2.875 8.626 -3.686 1.00 . A A . 42 TRP HE1 1 1 14 9933 1 1 42 TRP HE3 H -5.568 4.944 -0.931 1.00 . A A . 42 TRP HE3 1 1 14 9934 1 1 42 TRP HH2 H -7.721 7.639 -3.446 1.00 . A A . 42 TRP HH2 1 1 14 9935 1 1 42 TRP HZ2 H -5.653 8.755 -4.133 1.00 . A A . 42 TRP HZ2 1 1 14 9936 1 1 42 TRP HZ3 H -7.683 5.772 -1.871 1.00 . A A . 42 TRP HZ3 1 1 14 9937 1 1 42 TRP N N -3.064 2.897 -1.075 1.00 . A A . 42 TRP N 1 1 14 9938 1 1 42 TRP NE1 N -3.153 7.892 -3.096 1.00 . A A . 42 TRP NE1 1 1 14 9939 1 1 42 TRP O O -0.703 3.134 0.577 1.00 . A A . 42 TRP O 1 1 14 9940 1 1 43 CYS C C 2.461 3.581 -0.539 1.00 . A A . 43 CYS C 1 1 14 9941 1 1 43 CYS CA C 1.461 2.495 -0.911 1.00 . A A . 43 CYS CA 1 1 14 9942 1 1 43 CYS CB C 2.069 1.527 -1.924 1.00 . A A . 43 CYS CB 1 1 14 9943 1 1 43 CYS H H 0.178 3.287 -2.374 1.00 . A A . 43 CYS H 1 1 14 9944 1 1 43 CYS HA H 1.210 1.941 -0.018 1.00 . A A . 43 CYS HA 1 1 14 9945 1 1 43 CYS HB2 H 2.304 2.070 -2.828 1.00 . A A . 43 CYS HB2 1 1 14 9946 1 1 43 CYS HB3 H 2.980 1.122 -1.509 1.00 . A A . 43 CYS HB3 1 1 14 9947 1 1 43 CYS N N 0.242 3.065 -1.418 1.00 . A A . 43 CYS N 1 1 14 9948 1 1 43 CYS O O 2.678 4.534 -1.294 1.00 . A A . 43 CYS O 1 1 14 9949 1 1 43 CYS SG S 0.994 0.121 -2.393 1.00 . A A . 43 CYS SG 1 1 14 9950 1 1 44 THR C C 5.421 3.825 0.743 1.00 . A A . 44 THR C 1 1 14 9951 1 1 44 THR CA C 4.030 4.335 1.130 1.00 . A A . 44 THR CA 1 1 14 9952 1 1 44 THR CB C 3.953 4.365 2.668 1.00 . A A . 44 THR CB 1 1 14 9953 1 1 44 THR CG2 C 4.917 5.399 3.237 1.00 . A A . 44 THR CG2 1 1 14 9954 1 1 44 THR H H 2.829 2.643 1.159 1.00 . A A . 44 THR H 1 1 14 9955 1 1 44 THR HA H 3.859 5.331 0.748 1.00 . A A . 44 THR HA 1 1 14 9956 1 1 44 THR HB H 4.233 3.388 3.032 1.00 . A A . 44 THR HB 1 1 14 9957 1 1 44 THR HG1 H 2.117 5.036 2.364 1.00 . A A . 44 THR HG1 1 1 14 9958 1 1 44 THR HG21 H 4.694 6.367 2.815 1.00 . A A . 44 THR HG21 1 1 14 9959 1 1 44 THR HG22 H 5.929 5.123 2.981 1.00 . A A . 44 THR HG22 1 1 14 9960 1 1 44 THR HG23 H 4.821 5.444 4.311 1.00 . A A . 44 THR HG23 1 1 14 9961 1 1 44 THR N N 3.045 3.435 0.617 1.00 . A A . 44 THR N 1 1 14 9962 1 1 44 THR O O 5.731 2.634 0.929 1.00 . A A . 44 THR O 1 1 14 9963 1 1 44 THR OG1 O 2.605 4.650 3.101 1.00 . A A . 44 THR OG1 1 1 14 9964 1 1 45 LYS C C 8.512 5.459 0.262 1.00 . A A . 45 LYS C 1 1 14 9965 1 1 45 LYS CA C 7.584 4.334 -0.138 1.00 . A A . 45 LYS CA 1 1 14 9966 1 1 45 LYS CB C 7.701 4.025 -1.632 1.00 . A A . 45 LYS CB 1 1 14 9967 1 1 45 LYS CD C 7.435 4.809 -3.991 1.00 . A A . 45 LYS CD 1 1 14 9968 1 1 45 LYS CE C 6.956 5.939 -4.874 1.00 . A A . 45 LYS CE 1 1 14 9969 1 1 45 LYS CG C 7.204 5.133 -2.535 1.00 . A A . 45 LYS CG 1 1 14 9970 1 1 45 LYS H H 5.930 5.602 0.019 1.00 . A A . 45 LYS H 1 1 14 9971 1 1 45 LYS HA H 7.849 3.454 0.428 1.00 . A A . 45 LYS HA 1 1 14 9972 1 1 45 LYS HB2 H 8.736 3.832 -1.871 1.00 . A A . 45 LYS HB2 1 1 14 9973 1 1 45 LYS HB3 H 7.121 3.139 -1.838 1.00 . A A . 45 LYS HB3 1 1 14 9974 1 1 45 LYS HD2 H 8.490 4.653 -4.160 1.00 . A A . 45 LYS HD2 1 1 14 9975 1 1 45 LYS HD3 H 6.892 3.910 -4.243 1.00 . A A . 45 LYS HD3 1 1 14 9976 1 1 45 LYS HE2 H 5.886 6.034 -4.768 1.00 . A A . 45 LYS HE2 1 1 14 9977 1 1 45 LYS HE3 H 7.428 6.856 -4.555 1.00 . A A . 45 LYS HE3 1 1 14 9978 1 1 45 LYS HG2 H 6.147 5.273 -2.371 1.00 . A A . 45 LYS HG2 1 1 14 9979 1 1 45 LYS HG3 H 7.730 6.045 -2.289 1.00 . A A . 45 LYS HG3 1 1 14 9980 1 1 45 LYS HZ1 H 6.821 4.831 -6.639 1.00 . A A . 45 LYS HZ1 1 1 14 9981 1 1 45 LYS HZ2 H 8.302 5.601 -6.406 1.00 . A A . 45 LYS HZ2 1 1 14 9982 1 1 45 LYS HZ3 H 6.968 6.495 -6.875 1.00 . A A . 45 LYS HZ3 1 1 14 9983 1 1 45 LYS N N 6.234 4.684 0.206 1.00 . A A . 45 LYS N 1 1 14 9984 1 1 45 LYS NZ N 7.274 5.696 -6.286 1.00 . A A . 45 LYS NZ 1 1 14 9985 1 1 45 LYS O O 8.049 6.556 0.580 1.00 . A A . 45 LYS O 1 1 14 9986 1 1 46 ASN C C 11.112 6.945 -0.623 1.00 . A A . 46 ASN C 1 1 14 9987 1 1 46 ASN CA C 10.775 6.208 0.620 1.00 . A A . 46 ASN CA 1 1 14 9988 1 1 46 ASN CB C 12.046 5.615 1.233 1.00 . A A . 46 ASN CB 1 1 14 9989 1 1 46 ASN CG C 11.790 4.854 2.508 1.00 . A A . 46 ASN CG 1 1 14 9990 1 1 46 ASN H H 10.106 4.298 0.012 1.00 . A A . 46 ASN H 1 1 14 9991 1 1 46 ASN HA H 10.315 6.890 1.319 1.00 . A A . 46 ASN HA 1 1 14 9992 1 1 46 ASN HB2 H 12.495 4.942 0.519 1.00 . A A . 46 ASN HB2 1 1 14 9993 1 1 46 ASN HB3 H 12.740 6.415 1.443 1.00 . A A . 46 ASN HB3 1 1 14 9994 1 1 46 ASN HD21 H 11.614 3.166 1.498 1.00 . A A . 46 ASN HD21 1 1 14 9995 1 1 46 ASN HD22 H 11.445 3.028 3.195 1.00 . A A . 46 ASN HD22 1 1 14 9996 1 1 46 ASN N N 9.795 5.190 0.278 1.00 . A A . 46 ASN N 1 1 14 9997 1 1 46 ASN ND2 N 11.590 3.571 2.392 1.00 . A A . 46 ASN ND2 1 1 14 9998 1 1 46 ASN O O 11.469 6.336 -1.641 1.00 . A A . 46 ASN O 1 1 14 9999 1 1 46 ASN OD1 O 11.787 5.421 3.608 1.00 . A A . 46 ASN OD1 1 1 14 10000 1 1 47 CYS C C 12.168 10.107 -1.458 1.00 . A A . 47 CYS C 1 1 14 10001 1 1 47 CYS CA C 11.161 9.023 -1.738 1.00 . A A . 47 CYS CA 1 1 14 10002 1 1 47 CYS CB C 9.788 9.576 -2.126 1.00 . A A . 47 CYS CB 1 1 14 10003 1 1 47 CYS H H 10.835 8.673 0.280 1.00 . A A . 47 CYS H 1 1 14 10004 1 1 47 CYS HA H 11.524 8.397 -2.539 1.00 . A A . 47 CYS HA 1 1 14 10005 1 1 47 CYS HB2 H 9.468 10.295 -1.385 1.00 . A A . 47 CYS HB2 1 1 14 10006 1 1 47 CYS HB3 H 9.836 10.045 -3.097 1.00 . A A . 47 CYS HB3 1 1 14 10007 1 1 47 CYS N N 11.006 8.218 -0.575 1.00 . A A . 47 CYS N 1 1 14 10008 1 1 47 CYS O O 13.362 9.912 -1.802 1.00 . A A . 47 CYS O 1 1 14 10009 1 1 47 CYS OXT O 11.821 11.106 -0.836 1.00 . A A . 47 CYS OXT 1 1 14 10010 1 1 47 CYS SG S 8.537 8.238 -2.212 1.00 . A A . 47 CYS SG 1 1 15 10011 1 1 1 LYS C C 9.538 10.030 2.999 1.00 . A A . 1 LYS C 1 1 15 10012 1 1 1 LYS CA C 10.038 11.246 3.717 1.00 . A A . 1 LYS CA 1 1 15 10013 1 1 1 LYS CB C 9.207 12.477 3.279 1.00 . A A . 1 LYS CB 1 1 15 10014 1 1 1 LYS CD C 8.174 13.834 1.391 1.00 . A A . 1 LYS CD 1 1 15 10015 1 1 1 LYS CE C 6.725 13.507 1.775 1.00 . A A . 1 LYS CE 1 1 15 10016 1 1 1 LYS CG C 9.144 12.712 1.764 1.00 . A A . 1 LYS CG 1 1 15 10017 1 1 1 LYS H1 H 11.960 10.584 3.774 1.00 . A A . 1 LYS H1 1 1 15 10018 1 1 1 LYS H2 H 11.849 12.278 3.816 1.00 . A A . 1 LYS H2 1 1 15 10019 1 1 1 LYS H3 H 11.593 11.413 2.373 1.00 . A A . 1 LYS H3 1 1 15 10020 1 1 1 LYS HA H 9.929 11.094 4.780 1.00 . A A . 1 LYS HA 1 1 15 10021 1 1 1 LYS HB2 H 8.199 12.352 3.645 1.00 . A A . 1 LYS HB2 1 1 15 10022 1 1 1 LYS HB3 H 9.637 13.353 3.741 1.00 . A A . 1 LYS HB3 1 1 15 10023 1 1 1 LYS HD2 H 8.473 14.733 1.908 1.00 . A A . 1 LYS HD2 1 1 15 10024 1 1 1 LYS HD3 H 8.229 13.997 0.325 1.00 . A A . 1 LYS HD3 1 1 15 10025 1 1 1 LYS HE2 H 6.434 12.582 1.299 1.00 . A A . 1 LYS HE2 1 1 15 10026 1 1 1 LYS HE3 H 6.667 13.386 2.846 1.00 . A A . 1 LYS HE3 1 1 15 10027 1 1 1 LYS HG2 H 10.129 12.971 1.408 1.00 . A A . 1 LYS HG2 1 1 15 10028 1 1 1 LYS HG3 H 8.823 11.797 1.290 1.00 . A A . 1 LYS HG3 1 1 15 10029 1 1 1 LYS HZ1 H 5.995 15.485 1.803 1.00 . A A . 1 LYS HZ1 1 1 15 10030 1 1 1 LYS HZ2 H 4.801 14.318 1.624 1.00 . A A . 1 LYS HZ2 1 1 15 10031 1 1 1 LYS HZ3 H 5.784 14.700 0.335 1.00 . A A . 1 LYS HZ3 1 1 15 10032 1 1 1 LYS N N 11.449 11.412 3.409 1.00 . A A . 1 LYS N 1 1 15 10033 1 1 1 LYS NZ N 5.776 14.568 1.366 1.00 . A A . 1 LYS NZ 1 1 15 10034 1 1 1 LYS O O 10.317 9.269 2.439 1.00 . A A . 1 LYS O 1 1 15 10035 1 1 2 THR C C 6.570 9.365 1.418 1.00 . A A . 2 THR C 1 1 15 10036 1 1 2 THR CA C 7.663 8.791 2.296 1.00 . A A . 2 THR CA 1 1 15 10037 1 1 2 THR CB C 7.120 7.746 3.251 1.00 . A A . 2 THR CB 1 1 15 10038 1 1 2 THR CG2 C 8.225 6.806 3.715 1.00 . A A . 2 THR CG2 1 1 15 10039 1 1 2 THR H H 7.665 10.396 3.554 1.00 . A A . 2 THR H 1 1 15 10040 1 1 2 THR HA H 8.417 8.336 1.670 1.00 . A A . 2 THR HA 1 1 15 10041 1 1 2 THR HB H 6.360 7.178 2.735 1.00 . A A . 2 THR HB 1 1 15 10042 1 1 2 THR HG1 H 7.087 8.234 5.145 1.00 . A A . 2 THR HG1 1 1 15 10043 1 1 2 THR HG21 H 8.630 6.277 2.865 1.00 . A A . 2 THR HG21 1 1 15 10044 1 1 2 THR HG22 H 7.823 6.095 4.421 1.00 . A A . 2 THR HG22 1 1 15 10045 1 1 2 THR HG23 H 9.010 7.378 4.187 1.00 . A A . 2 THR HG23 1 1 15 10046 1 1 2 THR N N 8.267 9.834 3.020 1.00 . A A . 2 THR N 1 1 15 10047 1 1 2 THR O O 5.963 10.385 1.761 1.00 . A A . 2 THR O 1 1 15 10048 1 1 2 THR OG1 O 6.530 8.412 4.376 1.00 . A A . 2 THR OG1 1 1 15 10049 1 1 3 CYS C C 4.279 8.203 -0.744 1.00 . A A . 3 CYS C 1 1 15 10050 1 1 3 CYS CA C 5.373 9.232 -0.627 1.00 . A A . 3 CYS CA 1 1 15 10051 1 1 3 CYS CB C 6.014 9.491 -1.977 1.00 . A A . 3 CYS CB 1 1 15 10052 1 1 3 CYS H H 6.882 7.964 0.071 1.00 . A A . 3 CYS H 1 1 15 10053 1 1 3 CYS HA H 4.961 10.156 -0.247 1.00 . A A . 3 CYS HA 1 1 15 10054 1 1 3 CYS HB2 H 6.343 8.555 -2.400 1.00 . A A . 3 CYS HB2 1 1 15 10055 1 1 3 CYS HB3 H 5.283 9.947 -2.625 1.00 . A A . 3 CYS HB3 1 1 15 10056 1 1 3 CYS N N 6.359 8.766 0.298 1.00 . A A . 3 CYS N 1 1 15 10057 1 1 3 CYS O O 4.550 6.998 -0.839 1.00 . A A . 3 CYS O 1 1 15 10058 1 1 3 CYS SG S 7.456 10.597 -1.910 1.00 . A A . 3 CYS SG 1 1 15 10059 1 1 4 GLU C C 1.375 7.763 -2.177 1.00 . A A . 4 GLU C 1 1 15 10060 1 1 4 GLU CA C 1.914 7.813 -0.740 1.00 . A A . 4 GLU CA 1 1 15 10061 1 1 4 GLU CB C 0.904 8.402 0.220 1.00 . A A . 4 GLU CB 1 1 15 10062 1 1 4 GLU CD C -1.153 8.219 1.535 1.00 . A A . 4 GLU CD 1 1 15 10063 1 1 4 GLU CG C -0.311 7.584 0.484 1.00 . A A . 4 GLU CG 1 1 15 10064 1 1 4 GLU H H 2.912 9.627 -0.608 1.00 . A A . 4 GLU H 1 1 15 10065 1 1 4 GLU HA H 2.184 6.822 -0.408 1.00 . A A . 4 GLU HA 1 1 15 10066 1 1 4 GLU HB2 H 1.389 8.585 1.167 1.00 . A A . 4 GLU HB2 1 1 15 10067 1 1 4 GLU HB3 H 0.585 9.353 -0.182 1.00 . A A . 4 GLU HB3 1 1 15 10068 1 1 4 GLU HG2 H -0.890 7.515 -0.424 1.00 . A A . 4 GLU HG2 1 1 15 10069 1 1 4 GLU HG3 H -0.014 6.602 0.818 1.00 . A A . 4 GLU HG3 1 1 15 10070 1 1 4 GLU N N 3.067 8.660 -0.694 1.00 . A A . 4 GLU N 1 1 15 10071 1 1 4 GLU O O 0.950 8.791 -2.727 1.00 . A A . 4 GLU O 1 1 15 10072 1 1 4 GLU OE1 O -1.066 7.801 2.712 1.00 . A A . 4 GLU OE1 1 1 15 10073 1 1 4 GLU OE2 O -1.866 9.183 1.235 1.00 . A A . 4 GLU OE2 1 1 15 10074 1 1 5 ASN C C 0.123 5.165 -4.319 1.00 . A A . 5 ASN C 1 1 15 10075 1 1 5 ASN CA C 1.006 6.403 -4.182 1.00 . A A . 5 ASN CA 1 1 15 10076 1 1 5 ASN CB C 2.256 6.271 -5.076 1.00 . A A . 5 ASN CB 1 1 15 10077 1 1 5 ASN CG C 1.932 6.105 -6.553 1.00 . A A . 5 ASN CG 1 1 15 10078 1 1 5 ASN H H 1.722 5.800 -2.276 1.00 . A A . 5 ASN H 1 1 15 10079 1 1 5 ASN HA H 0.446 7.274 -4.487 1.00 . A A . 5 ASN HA 1 1 15 10080 1 1 5 ASN HB2 H 2.864 7.155 -4.964 1.00 . A A . 5 ASN HB2 1 1 15 10081 1 1 5 ASN HB3 H 2.825 5.412 -4.752 1.00 . A A . 5 ASN HB3 1 1 15 10082 1 1 5 ASN HD21 H 2.045 4.130 -6.426 1.00 . A A . 5 ASN HD21 1 1 15 10083 1 1 5 ASN HD22 H 1.669 4.784 -7.975 1.00 . A A . 5 ASN HD22 1 1 15 10084 1 1 5 ASN N N 1.417 6.588 -2.782 1.00 . A A . 5 ASN N 1 1 15 10085 1 1 5 ASN ND2 N 1.879 4.890 -7.023 1.00 . A A . 5 ASN ND2 1 1 15 10086 1 1 5 ASN O O 0.361 4.173 -3.647 1.00 . A A . 5 ASN O 1 1 15 10087 1 1 5 ASN OD1 O 1.760 7.086 -7.270 1.00 . A A . 5 ASN OD1 1 1 15 10088 1 1 6 LEU C C -1.227 2.824 -5.839 1.00 . A A . 6 LEU C 1 1 15 10089 1 1 6 LEU CA C -1.837 4.136 -5.389 1.00 . A A . 6 LEU CA 1 1 15 10090 1 1 6 LEU CB C -2.936 4.528 -6.377 1.00 . A A . 6 LEU CB 1 1 15 10091 1 1 6 LEU CD1 C -5.004 5.771 -6.918 1.00 . A A . 6 LEU CD1 1 1 15 10092 1 1 6 LEU CD2 C -4.917 4.421 -4.899 1.00 . A A . 6 LEU CD2 1 1 15 10093 1 1 6 LEU CG C -4.112 5.306 -5.812 1.00 . A A . 6 LEU CG 1 1 15 10094 1 1 6 LEU H H -0.998 6.041 -5.728 1.00 . A A . 6 LEU H 1 1 15 10095 1 1 6 LEU HA H -2.317 3.964 -4.438 1.00 . A A . 6 LEU HA 1 1 15 10096 1 1 6 LEU HB2 H -2.487 5.118 -7.161 1.00 . A A . 6 LEU HB2 1 1 15 10097 1 1 6 LEU HB3 H -3.318 3.621 -6.822 1.00 . A A . 6 LEU HB3 1 1 15 10098 1 1 6 LEU HD11 H -4.466 6.433 -7.580 1.00 . A A . 6 LEU HD11 1 1 15 10099 1 1 6 LEU HD12 H -5.844 6.276 -6.464 1.00 . A A . 6 LEU HD12 1 1 15 10100 1 1 6 LEU HD13 H -5.354 4.903 -7.455 1.00 . A A . 6 LEU HD13 1 1 15 10101 1 1 6 LEU HD21 H -5.266 3.559 -5.447 1.00 . A A . 6 LEU HD21 1 1 15 10102 1 1 6 LEU HD22 H -5.767 4.977 -4.530 1.00 . A A . 6 LEU HD22 1 1 15 10103 1 1 6 LEU HD23 H -4.316 4.099 -4.062 1.00 . A A . 6 LEU HD23 1 1 15 10104 1 1 6 LEU HG H -3.770 6.155 -5.238 1.00 . A A . 6 LEU HG 1 1 15 10105 1 1 6 LEU N N -0.880 5.233 -5.184 1.00 . A A . 6 LEU N 1 1 15 10106 1 1 6 LEU O O -0.331 2.779 -6.691 1.00 . A A . 6 LEU O 1 1 15 10107 1 1 7 ALA C C -2.391 0.063 -6.734 1.00 . A A . 7 ALA C 1 1 15 10108 1 1 7 ALA CA C -1.411 0.430 -5.649 1.00 . A A . 7 ALA CA 1 1 15 10109 1 1 7 ALA CB C -1.552 -0.518 -4.476 1.00 . A A . 7 ALA CB 1 1 15 10110 1 1 7 ALA H H -2.364 1.900 -4.514 1.00 . A A . 7 ALA H 1 1 15 10111 1 1 7 ALA HA H -0.401 0.400 -6.031 1.00 . A A . 7 ALA HA 1 1 15 10112 1 1 7 ALA HB1 H -0.845 -0.247 -3.705 1.00 . A A . 7 ALA HB1 1 1 15 10113 1 1 7 ALA HB2 H -1.372 -1.532 -4.801 1.00 . A A . 7 ALA HB2 1 1 15 10114 1 1 7 ALA HB3 H -2.556 -0.434 -4.086 1.00 . A A . 7 ALA HB3 1 1 15 10115 1 1 7 ALA N N -1.728 1.767 -5.254 1.00 . A A . 7 ALA N 1 1 15 10116 1 1 7 ALA O O -3.567 -0.192 -6.463 1.00 . A A . 7 ALA O 1 1 15 10117 1 1 8 ASP C C -3.079 -1.599 -9.287 1.00 . A A . 8 ASP C 1 1 15 10118 1 1 8 ASP CA C -2.794 -0.126 -9.099 1.00 . A A . 8 ASP CA 1 1 15 10119 1 1 8 ASP CB C -2.136 0.440 -10.354 1.00 . A A . 8 ASP CB 1 1 15 10120 1 1 8 ASP CG C -3.060 0.434 -11.541 1.00 . A A . 8 ASP CG 1 1 15 10121 1 1 8 ASP H H -0.972 0.232 -8.085 1.00 . A A . 8 ASP H 1 1 15 10122 1 1 8 ASP HA H -3.722 0.398 -8.927 1.00 . A A . 8 ASP HA 1 1 15 10123 1 1 8 ASP HB2 H -1.831 1.459 -10.166 1.00 . A A . 8 ASP HB2 1 1 15 10124 1 1 8 ASP HB3 H -1.266 -0.154 -10.593 1.00 . A A . 8 ASP HB3 1 1 15 10125 1 1 8 ASP N N -1.933 0.084 -7.947 1.00 . A A . 8 ASP N 1 1 15 10126 1 1 8 ASP O O -4.157 -1.990 -9.728 1.00 . A A . 8 ASP O 1 1 15 10127 1 1 8 ASP OD1 O -3.784 1.431 -11.732 1.00 . A A . 8 ASP OD1 1 1 15 10128 1 1 8 ASP OD2 O -3.068 -0.538 -12.318 1.00 . A A . 8 ASP OD2 1 1 15 10129 1 1 9 THR C C -3.138 -4.461 -7.961 1.00 . A A . 9 THR C 1 1 15 10130 1 1 9 THR CA C -2.236 -3.845 -9.054 1.00 . A A . 9 THR CA 1 1 15 10131 1 1 9 THR CB C -0.833 -4.505 -9.050 1.00 . A A . 9 THR CB 1 1 15 10132 1 1 9 THR CG2 C -0.149 -4.294 -7.720 1.00 . A A . 9 THR CG2 1 1 15 10133 1 1 9 THR H H -1.307 -2.025 -8.527 1.00 . A A . 9 THR H 1 1 15 10134 1 1 9 THR HA H -2.697 -4.032 -10.012 1.00 . A A . 9 THR HA 1 1 15 10135 1 1 9 THR HB H -0.239 -4.039 -9.822 1.00 . A A . 9 THR HB 1 1 15 10136 1 1 9 THR HG1 H -1.773 -6.235 -8.998 1.00 . A A . 9 THR HG1 1 1 15 10137 1 1 9 THR HG21 H -0.736 -4.758 -6.942 1.00 . A A . 9 THR HG21 1 1 15 10138 1 1 9 THR HG22 H -0.069 -3.236 -7.518 1.00 . A A . 9 THR HG22 1 1 15 10139 1 1 9 THR HG23 H 0.836 -4.737 -7.741 1.00 . A A . 9 THR HG23 1 1 15 10140 1 1 9 THR N N -2.126 -2.413 -8.905 1.00 . A A . 9 THR N 1 1 15 10141 1 1 9 THR O O -3.478 -5.656 -8.020 1.00 . A A . 9 THR O 1 1 15 10142 1 1 9 THR OG1 O -0.920 -5.914 -9.316 1.00 . A A . 9 THR OG1 1 1 15 10143 1 1 10 TYR C C -5.807 -4.002 -6.493 1.00 . A A . 10 TYR C 1 1 15 10144 1 1 10 TYR CA C -4.400 -4.106 -5.947 1.00 . A A . 10 TYR CA 1 1 15 10145 1 1 10 TYR CB C -4.243 -3.238 -4.683 1.00 . A A . 10 TYR CB 1 1 15 10146 1 1 10 TYR CD1 C -6.414 -3.282 -3.378 1.00 . A A . 10 TYR CD1 1 1 15 10147 1 1 10 TYR CD2 C -4.568 -4.518 -2.524 1.00 . A A . 10 TYR CD2 1 1 15 10148 1 1 10 TYR CE1 C -7.187 -3.691 -2.322 1.00 . A A . 10 TYR CE1 1 1 15 10149 1 1 10 TYR CE2 C -5.336 -4.932 -1.454 1.00 . A A . 10 TYR CE2 1 1 15 10150 1 1 10 TYR CG C -5.091 -3.688 -3.505 1.00 . A A . 10 TYR CG 1 1 15 10151 1 1 10 TYR CZ C -6.653 -4.511 -1.359 1.00 . A A . 10 TYR CZ 1 1 15 10152 1 1 10 TYR H H -3.199 -2.734 -6.968 1.00 . A A . 10 TYR H 1 1 15 10153 1 1 10 TYR HA H -4.173 -5.136 -5.717 1.00 . A A . 10 TYR HA 1 1 15 10154 1 1 10 TYR HB2 H -3.210 -3.258 -4.370 1.00 . A A . 10 TYR HB2 1 1 15 10155 1 1 10 TYR HB3 H -4.515 -2.220 -4.923 1.00 . A A . 10 TYR HB3 1 1 15 10156 1 1 10 TYR HD1 H -6.840 -2.637 -4.133 1.00 . A A . 10 TYR HD1 1 1 15 10157 1 1 10 TYR HD2 H -3.540 -4.841 -2.607 1.00 . A A . 10 TYR HD2 1 1 15 10158 1 1 10 TYR HE1 H -8.213 -3.358 -2.255 1.00 . A A . 10 TYR HE1 1 1 15 10159 1 1 10 TYR HE2 H -4.886 -5.570 -0.707 1.00 . A A . 10 TYR HE2 1 1 15 10160 1 1 10 TYR HH H -8.338 -5.026 -0.686 1.00 . A A . 10 TYR HH 1 1 15 10161 1 1 10 TYR N N -3.510 -3.662 -6.981 1.00 . A A . 10 TYR N 1 1 15 10162 1 1 10 TYR O O -6.296 -2.898 -6.775 1.00 . A A . 10 TYR O 1 1 15 10163 1 1 10 TYR OH O -7.450 -4.932 -0.314 1.00 . A A . 10 TYR OH 1 1 15 10164 1 1 11 LYS C C -8.818 -5.166 -6.161 1.00 . A A . 11 LYS C 1 1 15 10165 1 1 11 LYS CA C -7.759 -5.115 -7.240 1.00 . A A . 11 LYS CA 1 1 15 10166 1 1 11 LYS CB C -7.933 -6.245 -8.267 1.00 . A A . 11 LYS CB 1 1 15 10167 1 1 11 LYS CD C -7.888 -8.678 -8.831 1.00 . A A . 11 LYS CD 1 1 15 10168 1 1 11 LYS CE C -7.645 -10.091 -8.329 1.00 . A A . 11 LYS CE 1 1 15 10169 1 1 11 LYS CG C -7.683 -7.649 -7.737 1.00 . A A . 11 LYS CG 1 1 15 10170 1 1 11 LYS H H -6.030 -5.957 -6.381 1.00 . A A . 11 LYS H 1 1 15 10171 1 1 11 LYS HA H -7.863 -4.170 -7.753 1.00 . A A . 11 LYS HA 1 1 15 10172 1 1 11 LYS HB2 H -8.944 -6.208 -8.641 1.00 . A A . 11 LYS HB2 1 1 15 10173 1 1 11 LYS HB3 H -7.256 -6.067 -9.090 1.00 . A A . 11 LYS HB3 1 1 15 10174 1 1 11 LYS HD2 H -8.903 -8.602 -9.189 1.00 . A A . 11 LYS HD2 1 1 15 10175 1 1 11 LYS HD3 H -7.207 -8.465 -9.642 1.00 . A A . 11 LYS HD3 1 1 15 10176 1 1 11 LYS HE2 H -6.637 -10.156 -7.947 1.00 . A A . 11 LYS HE2 1 1 15 10177 1 1 11 LYS HE3 H -8.340 -10.309 -7.533 1.00 . A A . 11 LYS HE3 1 1 15 10178 1 1 11 LYS HG2 H -6.668 -7.714 -7.376 1.00 . A A . 11 LYS HG2 1 1 15 10179 1 1 11 LYS HG3 H -8.370 -7.849 -6.928 1.00 . A A . 11 LYS HG3 1 1 15 10180 1 1 11 LYS HZ1 H -7.662 -12.050 -9.033 1.00 . A A . 11 LYS HZ1 1 1 15 10181 1 1 11 LYS HZ2 H -7.119 -10.925 -10.160 1.00 . A A . 11 LYS HZ2 1 1 15 10182 1 1 11 LYS HZ3 H -8.767 -11.043 -9.814 1.00 . A A . 11 LYS HZ3 1 1 15 10183 1 1 11 LYS N N -6.445 -5.116 -6.672 1.00 . A A . 11 LYS N 1 1 15 10184 1 1 11 LYS NZ N -7.812 -11.090 -9.403 1.00 . A A . 11 LYS NZ 1 1 15 10185 1 1 11 LYS O O -8.703 -5.923 -5.191 1.00 . A A . 11 LYS O 1 1 15 10186 1 1 12 GLY C C -10.700 -3.206 -4.354 1.00 . A A . 12 GLY C 1 1 15 10187 1 1 12 GLY CA C -10.887 -4.320 -5.361 1.00 . A A . 12 GLY CA 1 1 15 10188 1 1 12 GLY H H -9.832 -3.747 -7.083 1.00 . A A . 12 GLY H 1 1 15 10189 1 1 12 GLY HA2 H -11.822 -4.180 -5.883 1.00 . A A . 12 GLY HA2 1 1 15 10190 1 1 12 GLY HA3 H -10.917 -5.262 -4.833 1.00 . A A . 12 GLY HA3 1 1 15 10191 1 1 12 GLY N N -9.821 -4.355 -6.314 1.00 . A A . 12 GLY N 1 1 15 10192 1 1 12 GLY O O -9.809 -2.349 -4.528 1.00 . A A . 12 GLY O 1 1 15 10193 1 1 13 PRO C C -10.471 -2.631 -1.181 1.00 . A A . 13 PRO C 1 1 15 10194 1 1 13 PRO CA C -11.429 -2.164 -2.269 1.00 . A A . 13 PRO CA 1 1 15 10195 1 1 13 PRO CB C -12.862 -2.083 -1.696 1.00 . A A . 13 PRO CB 1 1 15 10196 1 1 13 PRO CD C -12.673 -4.040 -3.093 1.00 . A A . 13 PRO CD 1 1 15 10197 1 1 13 PRO CG C -13.659 -3.139 -2.411 1.00 . A A . 13 PRO CG 1 1 15 10198 1 1 13 PRO HA H -11.128 -1.197 -2.644 1.00 . A A . 13 PRO HA 1 1 15 10199 1 1 13 PRO HB2 H -12.825 -2.275 -0.635 1.00 . A A . 13 PRO HB2 1 1 15 10200 1 1 13 PRO HB3 H -13.269 -1.097 -1.864 1.00 . A A . 13 PRO HB3 1 1 15 10201 1 1 13 PRO HD2 H -12.398 -4.860 -2.446 1.00 . A A . 13 PRO HD2 1 1 15 10202 1 1 13 PRO HD3 H -13.072 -4.407 -4.026 1.00 . A A . 13 PRO HD3 1 1 15 10203 1 1 13 PRO HG2 H -14.244 -3.702 -1.698 1.00 . A A . 13 PRO HG2 1 1 15 10204 1 1 13 PRO HG3 H -14.311 -2.677 -3.138 1.00 . A A . 13 PRO HG3 1 1 15 10205 1 1 13 PRO N N -11.537 -3.150 -3.323 1.00 . A A . 13 PRO N 1 1 15 10206 1 1 13 PRO O O -10.074 -3.809 -1.134 1.00 . A A . 13 PRO O 1 1 15 10207 1 1 14 CYS C C -10.073 -2.728 1.847 1.00 . A A . 14 CYS C 1 1 15 10208 1 1 14 CYS CA C -9.244 -2.071 0.775 1.00 . A A . 14 CYS CA 1 1 15 10209 1 1 14 CYS CB C -8.545 -0.849 1.346 1.00 . A A . 14 CYS CB 1 1 15 10210 1 1 14 CYS H H -10.362 -0.795 -0.452 1.00 . A A . 14 CYS H 1 1 15 10211 1 1 14 CYS HA H -8.499 -2.772 0.428 1.00 . A A . 14 CYS HA 1 1 15 10212 1 1 14 CYS HB2 H -7.833 -0.476 0.626 1.00 . A A . 14 CYS HB2 1 1 15 10213 1 1 14 CYS HB3 H -9.280 -0.085 1.554 1.00 . A A . 14 CYS HB3 1 1 15 10214 1 1 14 CYS N N -10.079 -1.730 -0.334 1.00 . A A . 14 CYS N 1 1 15 10215 1 1 14 CYS O O -10.912 -2.081 2.480 1.00 . A A . 14 CYS O 1 1 15 10216 1 1 14 CYS SG S -7.653 -1.199 2.890 1.00 . A A . 14 CYS SG 1 1 15 10217 1 1 15 PHE C C -9.956 -4.456 4.382 1.00 . A A . 15 PHE C 1 1 15 10218 1 1 15 PHE CA C -10.580 -4.750 3.037 1.00 . A A . 15 PHE CA 1 1 15 10219 1 1 15 PHE CB C -10.517 -6.243 2.723 1.00 . A A . 15 PHE CB 1 1 15 10220 1 1 15 PHE CD1 C -12.284 -6.433 0.964 1.00 . A A . 15 PHE CD1 1 1 15 10221 1 1 15 PHE CD2 C -10.039 -6.933 0.372 1.00 . A A . 15 PHE CD2 1 1 15 10222 1 1 15 PHE CE1 C -12.684 -6.688 -0.325 1.00 . A A . 15 PHE CE1 1 1 15 10223 1 1 15 PHE CE2 C -10.431 -7.195 -0.917 1.00 . A A . 15 PHE CE2 1 1 15 10224 1 1 15 PHE CG C -10.958 -6.551 1.327 1.00 . A A . 15 PHE CG 1 1 15 10225 1 1 15 PHE CZ C -11.757 -7.070 -1.268 1.00 . A A . 15 PHE CZ 1 1 15 10226 1 1 15 PHE H H -9.234 -4.460 1.434 1.00 . A A . 15 PHE H 1 1 15 10227 1 1 15 PHE HA H -11.609 -4.426 3.039 1.00 . A A . 15 PHE HA 1 1 15 10228 1 1 15 PHE HB2 H -9.500 -6.586 2.842 1.00 . A A . 15 PHE HB2 1 1 15 10229 1 1 15 PHE HB3 H -11.159 -6.777 3.406 1.00 . A A . 15 PHE HB3 1 1 15 10230 1 1 15 PHE HD1 H -13.013 -6.134 1.703 1.00 . A A . 15 PHE HD1 1 1 15 10231 1 1 15 PHE HD2 H -8.999 -7.033 0.647 1.00 . A A . 15 PHE HD2 1 1 15 10232 1 1 15 PHE HE1 H -13.726 -6.590 -0.595 1.00 . A A . 15 PHE HE1 1 1 15 10233 1 1 15 PHE HE2 H -9.700 -7.495 -1.651 1.00 . A A . 15 PHE HE2 1 1 15 10234 1 1 15 PHE HZ H -12.068 -7.270 -2.283 1.00 . A A . 15 PHE HZ 1 1 15 10235 1 1 15 PHE N N -9.870 -4.004 2.026 1.00 . A A . 15 PHE N 1 1 15 10236 1 1 15 PHE O O -10.646 -4.147 5.351 1.00 . A A . 15 PHE O 1 1 15 10237 1 1 16 THR C C -6.593 -3.618 5.092 1.00 . A A . 16 THR C 1 1 15 10238 1 1 16 THR CA C -7.879 -4.236 5.574 1.00 . A A . 16 THR CA 1 1 15 10239 1 1 16 THR CB C -7.574 -5.438 6.499 1.00 . A A . 16 THR CB 1 1 15 10240 1 1 16 THR CG2 C -7.072 -6.605 5.704 1.00 . A A . 16 THR CG2 1 1 15 10241 1 1 16 THR H H -8.174 -4.923 3.655 1.00 . A A . 16 THR H 1 1 15 10242 1 1 16 THR HA H -8.433 -3.491 6.126 1.00 . A A . 16 THR HA 1 1 15 10243 1 1 16 THR HB H -8.478 -5.721 7.013 1.00 . A A . 16 THR HB 1 1 15 10244 1 1 16 THR HG1 H -6.749 -5.583 8.284 1.00 . A A . 16 THR HG1 1 1 15 10245 1 1 16 THR HG21 H -6.829 -7.425 6.362 1.00 . A A . 16 THR HG21 1 1 15 10246 1 1 16 THR HG22 H -6.199 -6.263 5.171 1.00 . A A . 16 THR HG22 1 1 15 10247 1 1 16 THR HG23 H -7.832 -6.898 4.995 1.00 . A A . 16 THR HG23 1 1 15 10248 1 1 16 THR N N -8.663 -4.588 4.434 1.00 . A A . 16 THR N 1 1 15 10249 1 1 16 THR O O -6.027 -4.050 4.058 1.00 . A A . 16 THR O 1 1 15 10250 1 1 16 THR OG1 O -6.591 -5.065 7.483 1.00 . A A . 16 THR OG1 1 1 15 10251 1 1 17 THR C C -3.700 -2.879 5.783 1.00 . A A . 17 THR C 1 1 15 10252 1 1 17 THR CA C -4.908 -1.992 5.449 1.00 . A A . 17 THR CA 1 1 15 10253 1 1 17 THR CB C -4.807 -0.592 6.105 1.00 . A A . 17 THR CB 1 1 15 10254 1 1 17 THR CG2 C -4.542 -0.682 7.601 1.00 . A A . 17 THR CG2 1 1 15 10255 1 1 17 THR H H -6.605 -2.338 6.603 1.00 . A A . 17 THR H 1 1 15 10256 1 1 17 THR HA H -4.942 -1.867 4.376 1.00 . A A . 17 THR HA 1 1 15 10257 1 1 17 THR HB H -5.779 -0.150 5.945 1.00 . A A . 17 THR HB 1 1 15 10258 1 1 17 THR HG1 H -2.961 -0.332 5.422 1.00 . A A . 17 THR HG1 1 1 15 10259 1 1 17 THR HG21 H -5.338 -1.239 8.072 1.00 . A A . 17 THR HG21 1 1 15 10260 1 1 17 THR HG22 H -4.502 0.311 8.024 1.00 . A A . 17 THR HG22 1 1 15 10261 1 1 17 THR HG23 H -3.602 -1.187 7.771 1.00 . A A . 17 THR HG23 1 1 15 10262 1 1 17 THR N N -6.113 -2.645 5.810 1.00 . A A . 17 THR N 1 1 15 10263 1 1 17 THR O O -2.616 -2.639 5.302 1.00 . A A . 17 THR O 1 1 15 10264 1 1 17 THR OG1 O -3.772 0.190 5.483 1.00 . A A . 17 THR OG1 1 1 15 10265 1 1 18 GLY C C -2.498 -5.678 5.676 1.00 . A A . 18 GLY C 1 1 15 10266 1 1 18 GLY CA C -2.861 -4.860 6.893 1.00 . A A . 18 GLY CA 1 1 15 10267 1 1 18 GLY H H -4.816 -4.065 6.964 1.00 . A A . 18 GLY H 1 1 15 10268 1 1 18 GLY HA2 H -1.993 -4.309 7.222 1.00 . A A . 18 GLY HA2 1 1 15 10269 1 1 18 GLY HA3 H -3.192 -5.523 7.678 1.00 . A A . 18 GLY HA3 1 1 15 10270 1 1 18 GLY N N -3.922 -3.928 6.580 1.00 . A A . 18 GLY N 1 1 15 10271 1 1 18 GLY O O -1.316 -5.825 5.337 1.00 . A A . 18 GLY O 1 1 15 10272 1 1 19 SER C C -2.760 -6.030 2.714 1.00 . A A . 19 SER C 1 1 15 10273 1 1 19 SER CA C -3.364 -6.940 3.768 1.00 . A A . 19 SER CA 1 1 15 10274 1 1 19 SER CB C -4.737 -7.451 3.293 1.00 . A A . 19 SER CB 1 1 15 10275 1 1 19 SER H H -4.419 -6.077 5.390 1.00 . A A . 19 SER H 1 1 15 10276 1 1 19 SER HA H -2.710 -7.780 3.948 1.00 . A A . 19 SER HA 1 1 15 10277 1 1 19 SER HB2 H -5.176 -8.061 4.069 1.00 . A A . 19 SER HB2 1 1 15 10278 1 1 19 SER HB3 H -5.378 -6.601 3.111 1.00 . A A . 19 SER HB3 1 1 15 10279 1 1 19 SER HG H -4.715 -9.146 2.382 1.00 . A A . 19 SER HG 1 1 15 10280 1 1 19 SER N N -3.523 -6.188 5.007 1.00 . A A . 19 SER N 1 1 15 10281 1 1 19 SER O O -1.845 -6.412 1.992 1.00 . A A . 19 SER O 1 1 15 10282 1 1 19 SER OG O -4.653 -8.221 2.100 1.00 . A A . 19 SER OG 1 1 15 10283 1 1 20 CYS C C -1.322 -3.498 1.995 1.00 . A A . 20 CYS C 1 1 15 10284 1 1 20 CYS CA C -2.807 -3.803 1.749 1.00 . A A . 20 CYS CA 1 1 15 10285 1 1 20 CYS CB C -3.652 -2.558 1.944 1.00 . A A . 20 CYS CB 1 1 15 10286 1 1 20 CYS H H -3.987 -4.580 3.293 1.00 . A A . 20 CYS H 1 1 15 10287 1 1 20 CYS HA H -2.941 -4.168 0.742 1.00 . A A . 20 CYS HA 1 1 15 10288 1 1 20 CYS HB2 H -4.695 -2.819 1.846 1.00 . A A . 20 CYS HB2 1 1 15 10289 1 1 20 CYS HB3 H -3.476 -2.186 2.941 1.00 . A A . 20 CYS HB3 1 1 15 10290 1 1 20 CYS N N -3.263 -4.814 2.675 1.00 . A A . 20 CYS N 1 1 15 10291 1 1 20 CYS O O -0.528 -3.424 1.066 1.00 . A A . 20 CYS O 1 1 15 10292 1 1 20 CYS SG S -3.322 -1.224 0.790 1.00 . A A . 20 CYS SG 1 1 15 10293 1 1 21 ASP C C 1.335 -4.256 3.212 1.00 . A A . 21 ASP C 1 1 15 10294 1 1 21 ASP CA C 0.418 -3.137 3.670 1.00 . A A . 21 ASP CA 1 1 15 10295 1 1 21 ASP CB C 0.494 -2.987 5.186 1.00 . A A . 21 ASP CB 1 1 15 10296 1 1 21 ASP CG C 1.901 -2.856 5.681 1.00 . A A . 21 ASP CG 1 1 15 10297 1 1 21 ASP H H -1.640 -3.445 3.966 1.00 . A A . 21 ASP H 1 1 15 10298 1 1 21 ASP HA H 0.742 -2.214 3.216 1.00 . A A . 21 ASP HA 1 1 15 10299 1 1 21 ASP HB2 H -0.045 -2.094 5.468 1.00 . A A . 21 ASP HB2 1 1 15 10300 1 1 21 ASP HB3 H 0.025 -3.838 5.658 1.00 . A A . 21 ASP HB3 1 1 15 10301 1 1 21 ASP N N -0.958 -3.387 3.260 1.00 . A A . 21 ASP N 1 1 15 10302 1 1 21 ASP O O 2.427 -4.010 2.692 1.00 . A A . 21 ASP O 1 1 15 10303 1 1 21 ASP OD1 O 2.473 -3.847 6.181 1.00 . A A . 21 ASP OD1 1 1 15 10304 1 1 21 ASP OD2 O 2.476 -1.771 5.577 1.00 . A A . 21 ASP OD2 1 1 15 10305 1 1 22 ASP C C 1.779 -6.676 1.458 1.00 . A A . 22 ASP C 1 1 15 10306 1 1 22 ASP CA C 1.621 -6.662 2.970 1.00 . A A . 22 ASP CA 1 1 15 10307 1 1 22 ASP CB C 0.904 -7.927 3.431 1.00 . A A . 22 ASP CB 1 1 15 10308 1 1 22 ASP CG C 1.694 -9.185 3.151 1.00 . A A . 22 ASP CG 1 1 15 10309 1 1 22 ASP H H -0.024 -5.584 3.773 1.00 . A A . 22 ASP H 1 1 15 10310 1 1 22 ASP HA H 2.604 -6.627 3.417 1.00 . A A . 22 ASP HA 1 1 15 10311 1 1 22 ASP HB2 H 0.712 -7.858 4.491 1.00 . A A . 22 ASP HB2 1 1 15 10312 1 1 22 ASP HB3 H -0.042 -7.992 2.913 1.00 . A A . 22 ASP HB3 1 1 15 10313 1 1 22 ASP N N 0.866 -5.480 3.372 1.00 . A A . 22 ASP N 1 1 15 10314 1 1 22 ASP O O 2.854 -6.979 0.932 1.00 . A A . 22 ASP O 1 1 15 10315 1 1 22 ASP OD1 O 1.546 -9.774 2.050 1.00 . A A . 22 ASP OD1 1 1 15 10316 1 1 22 ASP OD2 O 2.464 -9.626 4.037 1.00 . A A . 22 ASP OD2 1 1 15 10317 1 1 23 HIS C C 1.729 -5.162 -1.120 1.00 . A A . 23 HIS C 1 1 15 10318 1 1 23 HIS CA C 0.688 -6.201 -0.673 1.00 . A A . 23 HIS CA 1 1 15 10319 1 1 23 HIS CB C -0.737 -5.813 -1.137 1.00 . A A . 23 HIS CB 1 1 15 10320 1 1 23 HIS CD2 C -0.683 -4.808 -3.524 1.00 . A A . 23 HIS CD2 1 1 15 10321 1 1 23 HIS CE1 C -1.636 -6.420 -4.611 1.00 . A A . 23 HIS CE1 1 1 15 10322 1 1 23 HIS CG C -0.956 -5.779 -2.625 1.00 . A A . 23 HIS CG 1 1 15 10323 1 1 23 HIS H H -0.130 -6.111 1.249 1.00 . A A . 23 HIS H 1 1 15 10324 1 1 23 HIS HA H 0.948 -7.164 -1.087 1.00 . A A . 23 HIS HA 1 1 15 10325 1 1 23 HIS HB2 H -1.441 -6.520 -0.727 1.00 . A A . 23 HIS HB2 1 1 15 10326 1 1 23 HIS HB3 H -0.966 -4.834 -0.744 1.00 . A A . 23 HIS HB3 1 1 15 10327 1 1 23 HIS HD1 H -1.888 -7.649 -2.978 1.00 . A A . 23 HIS HD1 1 1 15 10328 1 1 23 HIS HD2 H -0.208 -3.865 -3.297 1.00 . A A . 23 HIS HD2 1 1 15 10329 1 1 23 HIS HE1 H -2.070 -7.019 -5.399 1.00 . A A . 23 HIS HE1 1 1 15 10330 1 1 23 HIS N N 0.707 -6.310 0.771 1.00 . A A . 23 HIS N 1 1 15 10331 1 1 23 HIS ND1 N -1.560 -6.794 -3.336 1.00 . A A . 23 HIS ND1 1 1 15 10332 1 1 23 HIS NE2 N -1.117 -5.219 -4.781 1.00 . A A . 23 HIS NE2 1 1 15 10333 1 1 23 HIS O O 2.548 -5.430 -1.989 1.00 . A A . 23 HIS O 1 1 15 10334 1 1 24 CYS C C 4.130 -3.407 -0.510 1.00 . A A . 24 CYS C 1 1 15 10335 1 1 24 CYS CA C 2.684 -2.968 -0.808 1.00 . A A . 24 CYS CA 1 1 15 10336 1 1 24 CYS CB C 2.343 -1.670 -0.081 1.00 . A A . 24 CYS CB 1 1 15 10337 1 1 24 CYS H H 1.035 -3.841 0.192 1.00 . A A . 24 CYS H 1 1 15 10338 1 1 24 CYS HA H 2.607 -2.796 -1.872 1.00 . A A . 24 CYS HA 1 1 15 10339 1 1 24 CYS HB2 H 2.355 -1.851 0.984 1.00 . A A . 24 CYS HB2 1 1 15 10340 1 1 24 CYS HB3 H 3.089 -0.926 -0.319 1.00 . A A . 24 CYS HB3 1 1 15 10341 1 1 24 CYS N N 1.727 -4.012 -0.489 1.00 . A A . 24 CYS N 1 1 15 10342 1 1 24 CYS O O 5.022 -3.164 -1.305 1.00 . A A . 24 CYS O 1 1 15 10343 1 1 24 CYS SG S 0.706 -0.978 -0.503 1.00 . A A . 24 CYS SG 1 1 15 10344 1 1 25 LYS C C 6.201 -5.657 0.064 1.00 . A A . 25 LYS C 1 1 15 10345 1 1 25 LYS CA C 5.688 -4.558 0.987 1.00 . A A . 25 LYS CA 1 1 15 10346 1 1 25 LYS CB C 5.713 -5.102 2.418 1.00 . A A . 25 LYS CB 1 1 15 10347 1 1 25 LYS CD C 5.729 -4.761 4.873 1.00 . A A . 25 LYS CD 1 1 15 10348 1 1 25 LYS CE C 5.993 -3.797 6.017 1.00 . A A . 25 LYS CE 1 1 15 10349 1 1 25 LYS CG C 5.713 -4.070 3.518 1.00 . A A . 25 LYS CG 1 1 15 10350 1 1 25 LYS H H 3.589 -4.246 1.219 1.00 . A A . 25 LYS H 1 1 15 10351 1 1 25 LYS HA H 6.365 -3.718 0.938 1.00 . A A . 25 LYS HA 1 1 15 10352 1 1 25 LYS HB2 H 4.844 -5.728 2.556 1.00 . A A . 25 LYS HB2 1 1 15 10353 1 1 25 LYS HB3 H 6.594 -5.717 2.527 1.00 . A A . 25 LYS HB3 1 1 15 10354 1 1 25 LYS HD2 H 4.772 -5.235 5.037 1.00 . A A . 25 LYS HD2 1 1 15 10355 1 1 25 LYS HD3 H 6.503 -5.512 4.862 1.00 . A A . 25 LYS HD3 1 1 15 10356 1 1 25 LYS HE2 H 5.926 -4.335 6.950 1.00 . A A . 25 LYS HE2 1 1 15 10357 1 1 25 LYS HE3 H 6.991 -3.398 5.906 1.00 . A A . 25 LYS HE3 1 1 15 10358 1 1 25 LYS HG2 H 6.591 -3.447 3.423 1.00 . A A . 25 LYS HG2 1 1 15 10359 1 1 25 LYS HG3 H 4.821 -3.465 3.441 1.00 . A A . 25 LYS HG3 1 1 15 10360 1 1 25 LYS HZ1 H 4.043 -3.028 6.078 1.00 . A A . 25 LYS HZ1 1 1 15 10361 1 1 25 LYS HZ2 H 5.162 -2.093 5.212 1.00 . A A . 25 LYS HZ2 1 1 15 10362 1 1 25 LYS HZ3 H 5.191 -2.091 6.887 1.00 . A A . 25 LYS HZ3 1 1 15 10363 1 1 25 LYS N N 4.347 -4.077 0.614 1.00 . A A . 25 LYS N 1 1 15 10364 1 1 25 LYS NZ N 5.034 -2.690 6.050 1.00 . A A . 25 LYS NZ 1 1 15 10365 1 1 25 LYS O O 7.364 -5.659 -0.334 1.00 . A A . 25 LYS O 1 1 15 10366 1 1 26 ASN C C 5.544 -7.621 -2.484 1.00 . A A . 26 ASN C 1 1 15 10367 1 1 26 ASN CA C 5.732 -7.773 -0.987 1.00 . A A . 26 ASN CA 1 1 15 10368 1 1 26 ASN CB C 5.007 -8.994 -0.441 1.00 . A A . 26 ASN CB 1 1 15 10369 1 1 26 ASN CG C 5.491 -9.351 0.956 1.00 . A A . 26 ASN CG 1 1 15 10370 1 1 26 ASN H H 4.422 -6.512 0.089 1.00 . A A . 26 ASN H 1 1 15 10371 1 1 26 ASN HA H 6.788 -7.919 -0.809 1.00 . A A . 26 ASN HA 1 1 15 10372 1 1 26 ASN HB2 H 3.949 -8.780 -0.395 1.00 . A A . 26 ASN HB2 1 1 15 10373 1 1 26 ASN HB3 H 5.181 -9.837 -1.093 1.00 . A A . 26 ASN HB3 1 1 15 10374 1 1 26 ASN HD21 H 3.648 -9.789 1.583 1.00 . A A . 26 ASN HD21 1 1 15 10375 1 1 26 ASN HD22 H 4.912 -9.980 2.721 1.00 . A A . 26 ASN HD22 1 1 15 10376 1 1 26 ASN N N 5.352 -6.598 -0.228 1.00 . A A . 26 ASN N 1 1 15 10377 1 1 26 ASN ND2 N 4.599 -9.740 1.824 1.00 . A A . 26 ASN ND2 1 1 15 10378 1 1 26 ASN O O 6.516 -7.688 -3.244 1.00 . A A . 26 ASN O 1 1 15 10379 1 1 26 ASN OD1 O 6.675 -9.204 1.267 1.00 . A A . 26 ASN OD1 1 1 15 10380 1 1 27 LYS C C 4.632 -6.084 -4.985 1.00 . A A . 27 LYS C 1 1 15 10381 1 1 27 LYS CA C 3.954 -7.276 -4.315 1.00 . A A . 27 LYS CA 1 1 15 10382 1 1 27 LYS CB C 2.418 -7.188 -4.462 1.00 . A A . 27 LYS CB 1 1 15 10383 1 1 27 LYS CD C 2.230 -7.933 -6.872 1.00 . A A . 27 LYS CD 1 1 15 10384 1 1 27 LYS CE C 1.813 -7.503 -8.267 1.00 . A A . 27 LYS CE 1 1 15 10385 1 1 27 LYS CG C 1.913 -6.855 -5.861 1.00 . A A . 27 LYS CG 1 1 15 10386 1 1 27 LYS H H 3.608 -7.213 -2.237 1.00 . A A . 27 LYS H 1 1 15 10387 1 1 27 LYS HA H 4.292 -8.180 -4.801 1.00 . A A . 27 LYS HA 1 1 15 10388 1 1 27 LYS HB2 H 1.989 -8.137 -4.175 1.00 . A A . 27 LYS HB2 1 1 15 10389 1 1 27 LYS HB3 H 2.056 -6.431 -3.782 1.00 . A A . 27 LYS HB3 1 1 15 10390 1 1 27 LYS HD2 H 3.295 -8.117 -6.864 1.00 . A A . 27 LYS HD2 1 1 15 10391 1 1 27 LYS HD3 H 1.700 -8.834 -6.604 1.00 . A A . 27 LYS HD3 1 1 15 10392 1 1 27 LYS HE2 H 1.923 -8.340 -8.938 1.00 . A A . 27 LYS HE2 1 1 15 10393 1 1 27 LYS HE3 H 0.774 -7.206 -8.239 1.00 . A A . 27 LYS HE3 1 1 15 10394 1 1 27 LYS HG2 H 0.841 -6.724 -5.823 1.00 . A A . 27 LYS HG2 1 1 15 10395 1 1 27 LYS HG3 H 2.372 -5.929 -6.176 1.00 . A A . 27 LYS HG3 1 1 15 10396 1 1 27 LYS HZ1 H 2.251 -6.014 -9.676 1.00 . A A . 27 LYS HZ1 1 1 15 10397 1 1 27 LYS HZ2 H 3.599 -6.673 -8.956 1.00 . A A . 27 LYS HZ2 1 1 15 10398 1 1 27 LYS HZ3 H 2.673 -5.554 -8.106 1.00 . A A . 27 LYS HZ3 1 1 15 10399 1 1 27 LYS N N 4.315 -7.375 -2.899 1.00 . A A . 27 LYS N 1 1 15 10400 1 1 27 LYS NZ N 2.626 -6.362 -8.770 1.00 . A A . 27 LYS NZ 1 1 15 10401 1 1 27 LYS O O 5.260 -6.227 -6.033 1.00 . A A . 27 LYS O 1 1 15 10402 1 1 28 GLU C C 6.491 -3.455 -4.468 1.00 . A A . 28 GLU C 1 1 15 10403 1 1 28 GLU CA C 5.096 -3.738 -4.975 1.00 . A A . 28 GLU CA 1 1 15 10404 1 1 28 GLU CB C 4.174 -2.546 -4.763 1.00 . A A . 28 GLU CB 1 1 15 10405 1 1 28 GLU CD C 2.976 -2.995 -6.924 1.00 . A A . 28 GLU CD 1 1 15 10406 1 1 28 GLU CG C 2.827 -2.719 -5.443 1.00 . A A . 28 GLU CG 1 1 15 10407 1 1 28 GLU H H 4.027 -4.880 -3.537 1.00 . A A . 28 GLU H 1 1 15 10408 1 1 28 GLU HA H 5.162 -3.924 -6.037 1.00 . A A . 28 GLU HA 1 1 15 10409 1 1 28 GLU HB2 H 4.013 -2.423 -3.703 1.00 . A A . 28 GLU HB2 1 1 15 10410 1 1 28 GLU HB3 H 4.649 -1.658 -5.152 1.00 . A A . 28 GLU HB3 1 1 15 10411 1 1 28 GLU HG2 H 2.310 -3.550 -4.987 1.00 . A A . 28 GLU HG2 1 1 15 10412 1 1 28 GLU HG3 H 2.246 -1.817 -5.314 1.00 . A A . 28 GLU HG3 1 1 15 10413 1 1 28 GLU N N 4.525 -4.933 -4.380 1.00 . A A . 28 GLU N 1 1 15 10414 1 1 28 GLU O O 7.231 -2.675 -5.072 1.00 . A A . 28 GLU O 1 1 15 10415 1 1 28 GLU OE1 O 2.957 -2.042 -7.725 1.00 . A A . 28 GLU OE1 1 1 15 10416 1 1 28 GLU OE2 O 3.131 -4.169 -7.320 1.00 . A A . 28 GLU OE2 1 1 15 10417 1 1 29 HIS C C 8.380 -2.527 -2.326 1.00 . A A . 29 HIS C 1 1 15 10418 1 1 29 HIS CA C 8.116 -3.983 -2.699 1.00 . A A . 29 HIS CA 1 1 15 10419 1 1 29 HIS CB C 9.309 -4.630 -3.434 1.00 . A A . 29 HIS CB 1 1 15 10420 1 1 29 HIS CD2 C 10.851 -5.418 -1.505 1.00 . A A . 29 HIS CD2 1 1 15 10421 1 1 29 HIS CE1 C 12.611 -4.229 -1.933 1.00 . A A . 29 HIS CE1 1 1 15 10422 1 1 29 HIS CG C 10.570 -4.683 -2.605 1.00 . A A . 29 HIS CG 1 1 15 10423 1 1 29 HIS H H 6.196 -4.780 -3.054 1.00 . A A . 29 HIS H 1 1 15 10424 1 1 29 HIS HA H 7.969 -4.498 -1.759 1.00 . A A . 29 HIS HA 1 1 15 10425 1 1 29 HIS HB2 H 9.050 -5.640 -3.713 1.00 . A A . 29 HIS HB2 1 1 15 10426 1 1 29 HIS HB3 H 9.519 -4.058 -4.325 1.00 . A A . 29 HIS HB3 1 1 15 10427 1 1 29 HIS HD1 H 11.823 -3.293 -3.592 1.00 . A A . 29 HIS HD1 1 1 15 10428 1 1 29 HIS HD2 H 10.179 -6.121 -1.034 1.00 . A A . 29 HIS HD2 1 1 15 10429 1 1 29 HIS HE1 H 13.597 -3.789 -1.891 1.00 . A A . 29 HIS HE1 1 1 15 10430 1 1 29 HIS N N 6.845 -4.134 -3.400 1.00 . A A . 29 HIS N 1 1 15 10431 1 1 29 HIS ND1 N 11.701 -3.937 -2.858 1.00 . A A . 29 HIS ND1 1 1 15 10432 1 1 29 HIS NE2 N 12.146 -5.128 -1.078 1.00 . A A . 29 HIS NE2 1 1 15 10433 1 1 29 HIS O O 9.279 -1.861 -2.861 1.00 . A A . 29 HIS O 1 1 15 10434 1 1 30 LEU C C 7.723 -0.762 0.535 1.00 . A A . 30 LEU C 1 1 15 10435 1 1 30 LEU CA C 7.632 -0.692 -0.976 1.00 . A A . 30 LEU CA 1 1 15 10436 1 1 30 LEU CB C 6.433 0.145 -1.438 1.00 . A A . 30 LEU CB 1 1 15 10437 1 1 30 LEU CD1 C 5.060 1.094 -3.311 1.00 . A A . 30 LEU CD1 1 1 15 10438 1 1 30 LEU CD2 C 7.522 0.961 -3.554 1.00 . A A . 30 LEU CD2 1 1 15 10439 1 1 30 LEU CG C 6.291 0.303 -2.960 1.00 . A A . 30 LEU CG 1 1 15 10440 1 1 30 LEU H H 6.769 -2.583 -1.206 1.00 . A A . 30 LEU H 1 1 15 10441 1 1 30 LEU HA H 8.544 -0.260 -1.360 1.00 . A A . 30 LEU HA 1 1 15 10442 1 1 30 LEU HB2 H 5.534 -0.316 -1.057 1.00 . A A . 30 LEU HB2 1 1 15 10443 1 1 30 LEU HB3 H 6.521 1.132 -1.006 1.00 . A A . 30 LEU HB3 1 1 15 10444 1 1 30 LEU HD11 H 4.187 0.573 -2.949 1.00 . A A . 30 LEU HD11 1 1 15 10445 1 1 30 LEU HD12 H 4.995 1.194 -4.384 1.00 . A A . 30 LEU HD12 1 1 15 10446 1 1 30 LEU HD13 H 5.111 2.073 -2.856 1.00 . A A . 30 LEU HD13 1 1 15 10447 1 1 30 LEU HD21 H 7.373 1.093 -4.614 1.00 . A A . 30 LEU HD21 1 1 15 10448 1 1 30 LEU HD22 H 8.382 0.328 -3.394 1.00 . A A . 30 LEU HD22 1 1 15 10449 1 1 30 LEU HD23 H 7.684 1.921 -3.088 1.00 . A A . 30 LEU HD23 1 1 15 10450 1 1 30 LEU HG H 6.189 -0.677 -3.403 1.00 . A A . 30 LEU HG 1 1 15 10451 1 1 30 LEU N N 7.527 -2.027 -1.490 1.00 . A A . 30 LEU N 1 1 15 10452 1 1 30 LEU O O 7.788 -1.868 1.094 1.00 . A A . 30 LEU O 1 1 15 10453 1 1 31 ARG C C 6.703 -0.164 3.374 1.00 . A A . 31 ARG C 1 1 15 10454 1 1 31 ARG CA C 7.902 0.430 2.637 1.00 . A A . 31 ARG CA 1 1 15 10455 1 1 31 ARG CB C 8.109 1.874 3.102 1.00 . A A . 31 ARG CB 1 1 15 10456 1 1 31 ARG CD C 8.545 3.417 5.043 1.00 . A A . 31 ARG CD 1 1 15 10457 1 1 31 ARG CG C 8.489 1.982 4.564 1.00 . A A . 31 ARG CG 1 1 15 10458 1 1 31 ARG CZ C 9.131 4.495 7.222 1.00 . A A . 31 ARG CZ 1 1 15 10459 1 1 31 ARG H H 7.582 1.212 0.697 1.00 . A A . 31 ARG H 1 1 15 10460 1 1 31 ARG HA H 8.785 -0.139 2.883 1.00 . A A . 31 ARG HA 1 1 15 10461 1 1 31 ARG HB2 H 8.895 2.323 2.511 1.00 . A A . 31 ARG HB2 1 1 15 10462 1 1 31 ARG HB3 H 7.193 2.425 2.946 1.00 . A A . 31 ARG HB3 1 1 15 10463 1 1 31 ARG HD2 H 9.120 4.003 4.340 1.00 . A A . 31 ARG HD2 1 1 15 10464 1 1 31 ARG HD3 H 7.541 3.809 5.111 1.00 . A A . 31 ARG HD3 1 1 15 10465 1 1 31 ARG HE H 9.726 2.695 6.552 1.00 . A A . 31 ARG HE 1 1 15 10466 1 1 31 ARG HG2 H 7.759 1.448 5.154 1.00 . A A . 31 ARG HG2 1 1 15 10467 1 1 31 ARG HG3 H 9.459 1.528 4.702 1.00 . A A . 31 ARG HG3 1 1 15 10468 1 1 31 ARG HH11 H 7.687 5.604 6.264 1.00 . A A . 31 ARG HH11 1 1 15 10469 1 1 31 ARG HH12 H 8.269 6.297 7.683 1.00 . A A . 31 ARG HH12 1 1 15 10470 1 1 31 ARG HH21 H 10.498 3.669 8.489 1.00 . A A . 31 ARG HH21 1 1 15 10471 1 1 31 ARG HH22 H 9.908 5.187 8.975 1.00 . A A . 31 ARG HH22 1 1 15 10472 1 1 31 ARG N N 7.720 0.376 1.193 1.00 . A A . 31 ARG N 1 1 15 10473 1 1 31 ARG NE N 9.172 3.484 6.356 1.00 . A A . 31 ARG NE 1 1 15 10474 1 1 31 ARG NH1 N 8.315 5.525 7.042 1.00 . A A . 31 ARG NH1 1 1 15 10475 1 1 31 ARG NH2 N 9.891 4.446 8.298 1.00 . A A . 31 ARG NH2 1 1 15 10476 1 1 31 ARG O O 6.833 -1.107 4.162 1.00 . A A . 31 ARG O 1 1 15 10477 1 1 32 SER C C 3.139 0.358 2.958 1.00 . A A . 32 SER C 1 1 15 10478 1 1 32 SER CA C 4.355 -0.013 3.787 1.00 . A A . 32 SER CA 1 1 15 10479 1 1 32 SER CB C 4.332 0.641 5.189 1.00 . A A . 32 SER CB 1 1 15 10480 1 1 32 SER H H 5.477 1.066 2.414 1.00 . A A . 32 SER H 1 1 15 10481 1 1 32 SER HA H 4.373 -1.085 3.908 1.00 . A A . 32 SER HA 1 1 15 10482 1 1 32 SER HB2 H 3.337 0.558 5.601 1.00 . A A . 32 SER HB2 1 1 15 10483 1 1 32 SER HB3 H 5.029 0.125 5.832 1.00 . A A . 32 SER HB3 1 1 15 10484 1 1 32 SER HG H 4.626 2.354 6.038 1.00 . A A . 32 SER HG 1 1 15 10485 1 1 32 SER N N 5.554 0.375 3.106 1.00 . A A . 32 SER N 1 1 15 10486 1 1 32 SER O O 3.291 0.824 1.821 1.00 . A A . 32 SER O 1 1 15 10487 1 1 32 SER OG O 4.684 2.016 5.137 1.00 . A A . 32 SER OG 1 1 15 10488 1 1 33 GLY C C -0.310 0.916 3.737 1.00 . A A . 33 GLY C 1 1 15 10489 1 1 33 GLY CA C 0.761 0.480 2.782 1.00 . A A . 33 GLY CA 1 1 15 10490 1 1 33 GLY H H 1.897 -0.338 4.349 1.00 . A A . 33 GLY H 1 1 15 10491 1 1 33 GLY HA2 H 0.986 1.300 2.116 1.00 . A A . 33 GLY HA2 1 1 15 10492 1 1 33 GLY HA3 H 0.402 -0.358 2.204 1.00 . A A . 33 GLY HA3 1 1 15 10493 1 1 33 GLY N N 1.964 0.114 3.477 1.00 . A A . 33 GLY N 1 1 15 10494 1 1 33 GLY O O -0.516 0.276 4.783 1.00 . A A . 33 GLY O 1 1 15 10495 1 1 34 ARG C C -3.200 2.938 3.378 1.00 . A A . 34 ARG C 1 1 15 10496 1 1 34 ARG CA C -2.035 2.528 4.240 1.00 . A A . 34 ARG CA 1 1 15 10497 1 1 34 ARG CB C -1.588 3.716 5.125 1.00 . A A . 34 ARG CB 1 1 15 10498 1 1 34 ARG CD C -0.381 4.536 7.199 1.00 . A A . 34 ARG CD 1 1 15 10499 1 1 34 ARG CG C -0.608 3.360 6.241 1.00 . A A . 34 ARG CG 1 1 15 10500 1 1 34 ARG CZ C -1.731 5.635 9.026 1.00 . A A . 34 ARG CZ 1 1 15 10501 1 1 34 ARG H H -0.795 2.446 2.555 1.00 . A A . 34 ARG H 1 1 15 10502 1 1 34 ARG HA H -2.364 1.722 4.879 1.00 . A A . 34 ARG HA 1 1 15 10503 1 1 34 ARG HB2 H -1.117 4.456 4.494 1.00 . A A . 34 ARG HB2 1 1 15 10504 1 1 34 ARG HB3 H -2.467 4.158 5.571 1.00 . A A . 34 ARG HB3 1 1 15 10505 1 1 34 ARG HD2 H 0.345 4.245 7.946 1.00 . A A . 34 ARG HD2 1 1 15 10506 1 1 34 ARG HD3 H -0.003 5.377 6.638 1.00 . A A . 34 ARG HD3 1 1 15 10507 1 1 34 ARG HE H -2.450 4.644 7.419 1.00 . A A . 34 ARG HE 1 1 15 10508 1 1 34 ARG HG2 H -1.008 2.527 6.801 1.00 . A A . 34 ARG HG2 1 1 15 10509 1 1 34 ARG HG3 H 0.335 3.074 5.798 1.00 . A A . 34 ARG HG3 1 1 15 10510 1 1 34 ARG HH11 H 0.293 5.824 9.401 1.00 . A A . 34 ARG HH11 1 1 15 10511 1 1 34 ARG HH12 H -0.738 6.544 10.555 1.00 . A A . 34 ARG HH12 1 1 15 10512 1 1 34 ARG HH21 H -3.775 5.633 9.039 1.00 . A A . 34 ARG HH21 1 1 15 10513 1 1 34 ARG HH22 H -3.052 6.435 10.362 1.00 . A A . 34 ARG HH22 1 1 15 10514 1 1 34 ARG N N -0.974 1.998 3.414 1.00 . A A . 34 ARG N 1 1 15 10515 1 1 34 ARG NE N -1.629 4.935 7.876 1.00 . A A . 34 ARG NE 1 1 15 10516 1 1 34 ARG NH1 N -0.644 6.024 9.699 1.00 . A A . 34 ARG NH1 1 1 15 10517 1 1 34 ARG NH2 N -2.937 5.922 9.507 1.00 . A A . 34 ARG NH2 1 1 15 10518 1 1 34 ARG O O -3.068 3.777 2.484 1.00 . A A . 34 ARG O 1 1 15 10519 1 1 35 CYS C C -6.041 4.003 3.304 1.00 . A A . 35 CYS C 1 1 15 10520 1 1 35 CYS CA C -5.528 2.643 2.899 1.00 . A A . 35 CYS CA 1 1 15 10521 1 1 35 CYS CB C -6.569 1.583 3.161 1.00 . A A . 35 CYS CB 1 1 15 10522 1 1 35 CYS H H -4.335 1.631 4.312 1.00 . A A . 35 CYS H 1 1 15 10523 1 1 35 CYS HA H -5.309 2.670 1.842 1.00 . A A . 35 CYS HA 1 1 15 10524 1 1 35 CYS HB2 H -6.834 1.595 4.208 1.00 . A A . 35 CYS HB2 1 1 15 10525 1 1 35 CYS HB3 H -7.446 1.788 2.564 1.00 . A A . 35 CYS HB3 1 1 15 10526 1 1 35 CYS N N -4.320 2.333 3.621 1.00 . A A . 35 CYS N 1 1 15 10527 1 1 35 CYS O O -5.970 4.393 4.480 1.00 . A A . 35 CYS O 1 1 15 10528 1 1 35 CYS SG S -5.995 -0.081 2.748 1.00 . A A . 35 CYS SG 1 1 15 10529 1 1 36 ARG C C -8.528 6.102 2.503 1.00 . A A . 36 ARG C 1 1 15 10530 1 1 36 ARG CA C -7.000 6.061 2.569 1.00 . A A . 36 ARG CA 1 1 15 10531 1 1 36 ARG CB C -6.367 7.027 1.577 1.00 . A A . 36 ARG CB 1 1 15 10532 1 1 36 ARG CD C -4.288 7.407 3.002 1.00 . A A . 36 ARG CD 1 1 15 10533 1 1 36 ARG CG C -4.836 7.091 1.616 1.00 . A A . 36 ARG CG 1 1 15 10534 1 1 36 ARG CZ C -4.171 9.671 4.029 1.00 . A A . 36 ARG CZ 1 1 15 10535 1 1 36 ARG H H -6.573 4.352 1.439 1.00 . A A . 36 ARG H 1 1 15 10536 1 1 36 ARG HA H -6.697 6.336 3.568 1.00 . A A . 36 ARG HA 1 1 15 10537 1 1 36 ARG HB2 H -6.641 6.687 0.590 1.00 . A A . 36 ARG HB2 1 1 15 10538 1 1 36 ARG HB3 H -6.757 8.020 1.747 1.00 . A A . 36 ARG HB3 1 1 15 10539 1 1 36 ARG HD2 H -4.512 6.581 3.662 1.00 . A A . 36 ARG HD2 1 1 15 10540 1 1 36 ARG HD3 H -3.217 7.519 2.929 1.00 . A A . 36 ARG HD3 1 1 15 10541 1 1 36 ARG HE H -5.840 8.626 3.645 1.00 . A A . 36 ARG HE 1 1 15 10542 1 1 36 ARG HG2 H -4.446 6.132 1.308 1.00 . A A . 36 ARG HG2 1 1 15 10543 1 1 36 ARG HG3 H -4.503 7.848 0.922 1.00 . A A . 36 ARG HG3 1 1 15 10544 1 1 36 ARG HH11 H -2.352 9.031 3.347 1.00 . A A . 36 ARG HH11 1 1 15 10545 1 1 36 ARG HH12 H -2.312 10.508 4.195 1.00 . A A . 36 ARG HH12 1 1 15 10546 1 1 36 ARG HH21 H -5.803 10.643 4.773 1.00 . A A . 36 ARG HH21 1 1 15 10547 1 1 36 ARG HH22 H -4.321 11.473 4.965 1.00 . A A . 36 ARG HH22 1 1 15 10548 1 1 36 ARG N N -6.524 4.729 2.343 1.00 . A A . 36 ARG N 1 1 15 10549 1 1 36 ARG NE N -4.860 8.631 3.569 1.00 . A A . 36 ARG NE 1 1 15 10550 1 1 36 ARG NH1 N -2.862 9.746 3.847 1.00 . A A . 36 ARG NH1 1 1 15 10551 1 1 36 ARG NH2 N -4.808 10.660 4.638 1.00 . A A . 36 ARG NH2 1 1 15 10552 1 1 36 ARG O O -9.170 5.051 2.303 1.00 . A A . 36 ARG O 1 1 15 10553 1 1 37 ASP C C -11.290 7.046 1.494 1.00 . A A . 37 ASP C 1 1 15 10554 1 1 37 ASP CA C -10.566 7.532 2.731 1.00 . A A . 37 ASP CA 1 1 15 10555 1 1 37 ASP CB C -10.913 9.015 2.951 1.00 . A A . 37 ASP CB 1 1 15 10556 1 1 37 ASP CG C -10.407 9.571 4.254 1.00 . A A . 37 ASP CG 1 1 15 10557 1 1 37 ASP H H -8.514 8.085 2.754 1.00 . A A . 37 ASP H 1 1 15 10558 1 1 37 ASP HA H -10.923 6.978 3.585 1.00 . A A . 37 ASP HA 1 1 15 10559 1 1 37 ASP HB2 H -10.482 9.596 2.149 1.00 . A A . 37 ASP HB2 1 1 15 10560 1 1 37 ASP HB3 H -11.987 9.128 2.921 1.00 . A A . 37 ASP HB3 1 1 15 10561 1 1 37 ASP N N -9.100 7.301 2.671 1.00 . A A . 37 ASP N 1 1 15 10562 1 1 37 ASP O O -12.459 6.686 1.554 1.00 . A A . 37 ASP O 1 1 15 10563 1 1 37 ASP OD1 O -11.033 9.347 5.304 1.00 . A A . 37 ASP OD1 1 1 15 10564 1 1 37 ASP OD2 O -9.360 10.249 4.254 1.00 . A A . 37 ASP OD2 1 1 15 10565 1 1 38 ASP C C -11.349 5.053 -0.915 1.00 . A A . 38 ASP C 1 1 15 10566 1 1 38 ASP CA C -11.155 6.564 -0.901 1.00 . A A . 38 ASP CA 1 1 15 10567 1 1 38 ASP CB C -10.278 6.964 -2.114 1.00 . A A . 38 ASP CB 1 1 15 10568 1 1 38 ASP CG C -10.277 8.444 -2.442 1.00 . A A . 38 ASP CG 1 1 15 10569 1 1 38 ASP H H -9.676 7.382 0.412 1.00 . A A . 38 ASP H 1 1 15 10570 1 1 38 ASP HA H -12.121 7.029 -1.011 1.00 . A A . 38 ASP HA 1 1 15 10571 1 1 38 ASP HB2 H -9.259 6.681 -1.902 1.00 . A A . 38 ASP HB2 1 1 15 10572 1 1 38 ASP HB3 H -10.617 6.417 -2.981 1.00 . A A . 38 ASP HB3 1 1 15 10573 1 1 38 ASP N N -10.592 7.031 0.376 1.00 . A A . 38 ASP N 1 1 15 10574 1 1 38 ASP O O -11.852 4.511 -1.881 1.00 . A A . 38 ASP O 1 1 15 10575 1 1 38 ASP OD1 O -11.313 8.958 -2.890 1.00 . A A . 38 ASP OD1 1 1 15 10576 1 1 38 ASP OD2 O -9.228 9.114 -2.304 1.00 . A A . 38 ASP OD2 1 1 15 10577 1 1 39 PHE C C -10.135 2.164 -0.681 1.00 . A A . 39 PHE C 1 1 15 10578 1 1 39 PHE CA C -11.004 2.910 0.315 1.00 . A A . 39 PHE CA 1 1 15 10579 1 1 39 PHE CB C -12.461 2.400 0.255 1.00 . A A . 39 PHE CB 1 1 15 10580 1 1 39 PHE CD1 C -14.169 3.932 1.270 1.00 . A A . 39 PHE CD1 1 1 15 10581 1 1 39 PHE CD2 C -13.298 2.167 2.606 1.00 . A A . 39 PHE CD2 1 1 15 10582 1 1 39 PHE CE1 C -14.967 4.337 2.319 1.00 . A A . 39 PHE CE1 1 1 15 10583 1 1 39 PHE CE2 C -14.092 2.566 3.661 1.00 . A A . 39 PHE CE2 1 1 15 10584 1 1 39 PHE CG C -13.327 2.845 1.400 1.00 . A A . 39 PHE CG 1 1 15 10585 1 1 39 PHE CZ C -14.928 3.653 3.517 1.00 . A A . 39 PHE CZ 1 1 15 10586 1 1 39 PHE H H -10.493 4.893 0.883 1.00 . A A . 39 PHE H 1 1 15 10587 1 1 39 PHE HA H -10.607 2.693 1.295 1.00 . A A . 39 PHE HA 1 1 15 10588 1 1 39 PHE HB2 H -12.916 2.759 -0.656 1.00 . A A . 39 PHE HB2 1 1 15 10589 1 1 39 PHE HB3 H -12.452 1.320 0.240 1.00 . A A . 39 PHE HB3 1 1 15 10590 1 1 39 PHE HD1 H -14.200 4.469 0.332 1.00 . A A . 39 PHE HD1 1 1 15 10591 1 1 39 PHE HD2 H -12.645 1.314 2.718 1.00 . A A . 39 PHE HD2 1 1 15 10592 1 1 39 PHE HE1 H -15.621 5.189 2.199 1.00 . A A . 39 PHE HE1 1 1 15 10593 1 1 39 PHE HE2 H -14.059 2.027 4.597 1.00 . A A . 39 PHE HE2 1 1 15 10594 1 1 39 PHE HZ H -15.554 3.969 4.340 1.00 . A A . 39 PHE HZ 1 1 15 10595 1 1 39 PHE N N -10.902 4.377 0.153 1.00 . A A . 39 PHE N 1 1 15 10596 1 1 39 PHE O O -10.258 0.954 -0.848 1.00 . A A . 39 PHE O 1 1 15 10597 1 1 40 ARG C C -6.967 2.167 -1.591 1.00 . A A . 40 ARG C 1 1 15 10598 1 1 40 ARG CA C -8.347 2.262 -2.253 1.00 . A A . 40 ARG CA 1 1 15 10599 1 1 40 ARG CB C -8.303 3.100 -3.544 1.00 . A A . 40 ARG CB 1 1 15 10600 1 1 40 ARG CD C -8.793 1.250 -5.200 1.00 . A A . 40 ARG CD 1 1 15 10601 1 1 40 ARG CG C -7.811 2.347 -4.783 1.00 . A A . 40 ARG CG 1 1 15 10602 1 1 40 ARG CZ C -11.221 1.075 -5.813 1.00 . A A . 40 ARG CZ 1 1 15 10603 1 1 40 ARG H H -9.177 3.826 -1.106 1.00 . A A . 40 ARG H 1 1 15 10604 1 1 40 ARG HA H -8.711 1.268 -2.466 1.00 . A A . 40 ARG HA 1 1 15 10605 1 1 40 ARG HB2 H -9.297 3.466 -3.752 1.00 . A A . 40 ARG HB2 1 1 15 10606 1 1 40 ARG HB3 H -7.651 3.944 -3.382 1.00 . A A . 40 ARG HB3 1 1 15 10607 1 1 40 ARG HD2 H -8.395 0.746 -6.068 1.00 . A A . 40 ARG HD2 1 1 15 10608 1 1 40 ARG HD3 H -8.904 0.539 -4.394 1.00 . A A . 40 ARG HD3 1 1 15 10609 1 1 40 ARG HE H -10.159 2.783 -5.588 1.00 . A A . 40 ARG HE 1 1 15 10610 1 1 40 ARG HG2 H -7.699 3.046 -5.597 1.00 . A A . 40 ARG HG2 1 1 15 10611 1 1 40 ARG HG3 H -6.854 1.899 -4.561 1.00 . A A . 40 ARG HG3 1 1 15 10612 1 1 40 ARG HH11 H -10.390 -0.784 -5.469 1.00 . A A . 40 ARG HH11 1 1 15 10613 1 1 40 ARG HH12 H -12.032 -0.777 -5.927 1.00 . A A . 40 ARG HH12 1 1 15 10614 1 1 40 ARG HH21 H -12.419 2.688 -6.227 1.00 . A A . 40 ARG HH21 1 1 15 10615 1 1 40 ARG HH22 H -13.197 1.188 -6.355 1.00 . A A . 40 ARG HH22 1 1 15 10616 1 1 40 ARG N N -9.236 2.869 -1.307 1.00 . A A . 40 ARG N 1 1 15 10617 1 1 40 ARG NE N -10.116 1.800 -5.541 1.00 . A A . 40 ARG NE 1 1 15 10618 1 1 40 ARG NH1 N -11.200 -0.250 -5.731 1.00 . A A . 40 ARG NH1 1 1 15 10619 1 1 40 ARG NH2 N -12.349 1.690 -6.157 1.00 . A A . 40 ARG NH2 1 1 15 10620 1 1 40 ARG O O -6.730 2.816 -0.556 1.00 . A A . 40 ARG O 1 1 15 10621 1 1 41 CYS C C -3.740 2.153 -2.008 1.00 . A A . 41 CYS C 1 1 15 10622 1 1 41 CYS CA C -4.781 1.175 -1.565 1.00 . A A . 41 CYS CA 1 1 15 10623 1 1 41 CYS CB C -4.289 -0.230 -1.794 1.00 . A A . 41 CYS CB 1 1 15 10624 1 1 41 CYS H H -6.289 0.913 -2.983 1.00 . A A . 41 CYS H 1 1 15 10625 1 1 41 CYS HA H -4.902 1.293 -0.499 1.00 . A A . 41 CYS HA 1 1 15 10626 1 1 41 CYS HB2 H -4.637 -0.588 -2.751 1.00 . A A . 41 CYS HB2 1 1 15 10627 1 1 41 CYS HB3 H -3.209 -0.221 -1.780 1.00 . A A . 41 CYS HB3 1 1 15 10628 1 1 41 CYS N N -6.090 1.381 -2.148 1.00 . A A . 41 CYS N 1 1 15 10629 1 1 41 CYS O O -3.462 2.294 -3.190 1.00 . A A . 41 CYS O 1 1 15 10630 1 1 41 CYS SG S -4.839 -1.376 -0.537 1.00 . A A . 41 CYS SG 1 1 15 10631 1 1 42 TRP C C -0.854 3.095 -0.562 1.00 . A A . 42 TRP C 1 1 15 10632 1 1 42 TRP CA C -2.060 3.691 -1.249 1.00 . A A . 42 TRP CA 1 1 15 10633 1 1 42 TRP CB C -2.333 5.074 -0.682 1.00 . A A . 42 TRP CB 1 1 15 10634 1 1 42 TRP CD1 C -2.313 7.015 -2.351 1.00 . A A . 42 TRP CD1 1 1 15 10635 1 1 42 TRP CD2 C -4.355 6.228 -1.928 1.00 . A A . 42 TRP CD2 1 1 15 10636 1 1 42 TRP CE2 C -4.460 7.305 -2.826 1.00 . A A . 42 TRP CE2 1 1 15 10637 1 1 42 TRP CE3 C -5.515 5.581 -1.532 1.00 . A A . 42 TRP CE3 1 1 15 10638 1 1 42 TRP CG C -2.967 6.064 -1.624 1.00 . A A . 42 TRP CG 1 1 15 10639 1 1 42 TRP CH2 C -6.792 7.086 -2.915 1.00 . A A . 42 TRP CH2 1 1 15 10640 1 1 42 TRP CZ2 C -5.677 7.741 -3.323 1.00 . A A . 42 TRP CZ2 1 1 15 10641 1 1 42 TRP CZ3 C -6.722 6.013 -2.028 1.00 . A A . 42 TRP CZ3 1 1 15 10642 1 1 42 TRP H H -3.469 2.695 -0.123 1.00 . A A . 42 TRP H 1 1 15 10643 1 1 42 TRP HA H -1.868 3.765 -2.308 1.00 . A A . 42 TRP HA 1 1 15 10644 1 1 42 TRP HB2 H -2.990 4.972 0.167 1.00 . A A . 42 TRP HB2 1 1 15 10645 1 1 42 TRP HB3 H -1.394 5.486 -0.344 1.00 . A A . 42 TRP HB3 1 1 15 10646 1 1 42 TRP HD1 H -1.242 7.155 -2.348 1.00 . A A . 42 TRP HD1 1 1 15 10647 1 1 42 TRP HE1 H -2.981 8.516 -3.651 1.00 . A A . 42 TRP HE1 1 1 15 10648 1 1 42 TRP HE3 H -5.480 4.743 -0.855 1.00 . A A . 42 TRP HE3 1 1 15 10649 1 1 42 TRP HH2 H -7.759 7.401 -3.280 1.00 . A A . 42 TRP HH2 1 1 15 10650 1 1 42 TRP HZ2 H -5.756 8.570 -4.009 1.00 . A A . 42 TRP HZ2 1 1 15 10651 1 1 42 TRP HZ3 H -7.630 5.515 -1.723 1.00 . A A . 42 TRP HZ3 1 1 15 10652 1 1 42 TRP N N -3.169 2.813 -1.048 1.00 . A A . 42 TRP N 1 1 15 10653 1 1 42 TRP NE1 N -3.205 7.764 -3.062 1.00 . A A . 42 TRP NE1 1 1 15 10654 1 1 42 TRP O O -0.900 2.762 0.625 1.00 . A A . 42 TRP O 1 1 15 10655 1 1 43 CYS C C 2.362 3.482 -0.391 1.00 . A A . 43 CYS C 1 1 15 10656 1 1 43 CYS CA C 1.395 2.384 -0.763 1.00 . A A . 43 CYS CA 1 1 15 10657 1 1 43 CYS CB C 2.035 1.445 -1.767 1.00 . A A . 43 CYS CB 1 1 15 10658 1 1 43 CYS H H 0.183 3.236 -2.228 1.00 . A A . 43 CYS H 1 1 15 10659 1 1 43 CYS HA H 1.140 1.821 0.122 1.00 . A A . 43 CYS HA 1 1 15 10660 1 1 43 CYS HB2 H 2.265 1.998 -2.667 1.00 . A A . 43 CYS HB2 1 1 15 10661 1 1 43 CYS HB3 H 2.953 1.067 -1.341 1.00 . A A . 43 CYS HB3 1 1 15 10662 1 1 43 CYS N N 0.193 2.943 -1.288 1.00 . A A . 43 CYS N 1 1 15 10663 1 1 43 CYS O O 2.409 4.539 -1.036 1.00 . A A . 43 CYS O 1 1 15 10664 1 1 43 CYS SG S 1.011 0.021 -2.244 1.00 . A A . 43 CYS SG 1 1 15 10665 1 1 44 THR C C 5.446 3.775 0.557 1.00 . A A . 44 THR C 1 1 15 10666 1 1 44 THR CA C 4.073 4.136 1.144 1.00 . A A . 44 THR CA 1 1 15 10667 1 1 44 THR CB C 4.119 3.971 2.676 1.00 . A A . 44 THR CB 1 1 15 10668 1 1 44 THR CG2 C 5.043 4.983 3.316 1.00 . A A . 44 THR CG2 1 1 15 10669 1 1 44 THR H H 3.018 2.371 1.096 1.00 . A A . 44 THR H 1 1 15 10670 1 1 44 THR HA H 3.800 5.154 0.909 1.00 . A A . 44 THR HA 1 1 15 10671 1 1 44 THR HB H 4.473 2.974 2.896 1.00 . A A . 44 THR HB 1 1 15 10672 1 1 44 THR HG1 H 2.358 4.865 2.797 1.00 . A A . 44 THR HG1 1 1 15 10673 1 1 44 THR HG21 H 5.076 4.812 4.382 1.00 . A A . 44 THR HG21 1 1 15 10674 1 1 44 THR HG22 H 4.675 5.979 3.123 1.00 . A A . 44 THR HG22 1 1 15 10675 1 1 44 THR HG23 H 6.037 4.874 2.908 1.00 . A A . 44 THR HG23 1 1 15 10676 1 1 44 THR N N 3.104 3.236 0.632 1.00 . A A . 44 THR N 1 1 15 10677 1 1 44 THR O O 5.969 2.687 0.819 1.00 . A A . 44 THR O 1 1 15 10678 1 1 44 THR OG1 O 2.790 4.116 3.227 1.00 . A A . 44 THR OG1 1 1 15 10679 1 1 45 LYS C C 8.292 5.411 -0.182 1.00 . A A . 45 LYS C 1 1 15 10680 1 1 45 LYS CA C 7.320 4.422 -0.804 1.00 . A A . 45 LYS CA 1 1 15 10681 1 1 45 LYS CB C 7.341 4.545 -2.343 1.00 . A A . 45 LYS CB 1 1 15 10682 1 1 45 LYS CD C 7.154 5.992 -4.389 1.00 . A A . 45 LYS CD 1 1 15 10683 1 1 45 LYS CE C 6.741 7.350 -4.936 1.00 . A A . 45 LYS CE 1 1 15 10684 1 1 45 LYS CG C 6.932 5.907 -2.887 1.00 . A A . 45 LYS CG 1 1 15 10685 1 1 45 LYS H H 5.505 5.462 -0.498 1.00 . A A . 45 LYS H 1 1 15 10686 1 1 45 LYS HA H 7.614 3.422 -0.520 1.00 . A A . 45 LYS HA 1 1 15 10687 1 1 45 LYS HB2 H 8.341 4.334 -2.694 1.00 . A A . 45 LYS HB2 1 1 15 10688 1 1 45 LYS HB3 H 6.668 3.805 -2.752 1.00 . A A . 45 LYS HB3 1 1 15 10689 1 1 45 LYS HD2 H 8.202 5.833 -4.593 1.00 . A A . 45 LYS HD2 1 1 15 10690 1 1 45 LYS HD3 H 6.571 5.221 -4.872 1.00 . A A . 45 LYS HD3 1 1 15 10691 1 1 45 LYS HE2 H 5.673 7.455 -4.818 1.00 . A A . 45 LYS HE2 1 1 15 10692 1 1 45 LYS HE3 H 7.240 8.119 -4.366 1.00 . A A . 45 LYS HE3 1 1 15 10693 1 1 45 LYS HG2 H 5.887 6.074 -2.674 1.00 . A A . 45 LYS HG2 1 1 15 10694 1 1 45 LYS HG3 H 7.528 6.664 -2.398 1.00 . A A . 45 LYS HG3 1 1 15 10695 1 1 45 LYS HZ1 H 6.632 6.768 -6.945 1.00 . A A . 45 LYS HZ1 1 1 15 10696 1 1 45 LYS HZ2 H 8.106 7.462 -6.514 1.00 . A A . 45 LYS HZ2 1 1 15 10697 1 1 45 LYS HZ3 H 6.756 8.428 -6.729 1.00 . A A . 45 LYS HZ3 1 1 15 10698 1 1 45 LYS N N 5.995 4.643 -0.257 1.00 . A A . 45 LYS N 1 1 15 10699 1 1 45 LYS NZ N 7.077 7.508 -6.367 1.00 . A A . 45 LYS NZ 1 1 15 10700 1 1 45 LYS O O 7.886 6.496 0.233 1.00 . A A . 45 LYS O 1 1 15 10701 1 1 46 ASN C C 11.004 6.975 -0.478 1.00 . A A . 46 ASN C 1 1 15 10702 1 1 46 ASN CA C 10.569 5.895 0.479 1.00 . A A . 46 ASN CA 1 1 15 10703 1 1 46 ASN CB C 11.787 5.093 0.954 1.00 . A A . 46 ASN CB 1 1 15 10704 1 1 46 ASN CG C 11.564 4.409 2.285 1.00 . A A . 46 ASN CG 1 1 15 10705 1 1 46 ASN H H 9.787 4.142 -0.414 1.00 . A A . 46 ASN H 1 1 15 10706 1 1 46 ASN HA H 10.131 6.378 1.340 1.00 . A A . 46 ASN HA 1 1 15 10707 1 1 46 ASN HB2 H 12.008 4.332 0.221 1.00 . A A . 46 ASN HB2 1 1 15 10708 1 1 46 ASN HB3 H 12.637 5.753 1.041 1.00 . A A . 46 ASN HB3 1 1 15 10709 1 1 46 ASN HD21 H 12.291 5.982 3.227 1.00 . A A . 46 ASN HD21 1 1 15 10710 1 1 46 ASN HD22 H 11.781 4.682 4.235 1.00 . A A . 46 ASN HD22 1 1 15 10711 1 1 46 ASN N N 9.538 5.036 -0.093 1.00 . A A . 46 ASN N 1 1 15 10712 1 1 46 ASN ND2 N 11.911 5.085 3.350 1.00 . A A . 46 ASN ND2 1 1 15 10713 1 1 46 ASN O O 11.243 6.719 -1.665 1.00 . A A . 46 ASN O 1 1 15 10714 1 1 46 ASN OD1 O 11.092 3.277 2.355 1.00 . A A . 46 ASN OD1 1 1 15 10715 1 1 47 CYS C C 12.435 10.125 0.215 1.00 . A A . 47 CYS C 1 1 15 10716 1 1 47 CYS CA C 11.524 9.321 -0.705 1.00 . A A . 47 CYS CA 1 1 15 10717 1 1 47 CYS CB C 10.334 10.187 -1.126 1.00 . A A . 47 CYS CB 1 1 15 10718 1 1 47 CYS H H 10.835 8.334 0.975 1.00 . A A . 47 CYS H 1 1 15 10719 1 1 47 CYS HA H 12.071 8.989 -1.575 1.00 . A A . 47 CYS HA 1 1 15 10720 1 1 47 CYS HB2 H 9.856 10.582 -0.244 1.00 . A A . 47 CYS HB2 1 1 15 10721 1 1 47 CYS HB3 H 10.701 11.007 -1.724 1.00 . A A . 47 CYS HB3 1 1 15 10722 1 1 47 CYS N N 11.079 8.175 0.034 1.00 . A A . 47 CYS N 1 1 15 10723 1 1 47 CYS O O 11.994 11.131 0.801 1.00 . A A . 47 CYS O 1 1 15 10724 1 1 47 CYS OXT O 13.581 9.694 0.447 1.00 . A A . 47 CYS OXT 1 1 15 10725 1 1 47 CYS SG S 9.040 9.340 -2.088 1.00 . A A . 47 CYS SG 1 1 16 10726 1 1 1 LYS C C 10.652 9.962 0.811 1.00 . A A . 1 LYS C 1 1 16 10727 1 1 1 LYS CA C 11.643 11.117 0.868 1.00 . A A . 1 LYS CA 1 1 16 10728 1 1 1 LYS CB C 11.579 11.959 -0.418 1.00 . A A . 1 LYS CB 1 1 16 10729 1 1 1 LYS CD C 10.317 13.279 -2.104 1.00 . A A . 1 LYS CD 1 1 16 10730 1 1 1 LYS CE C 8.967 13.730 -2.644 1.00 . A A . 1 LYS CE 1 1 16 10731 1 1 1 LYS CG C 10.205 12.476 -0.818 1.00 . A A . 1 LYS CG 1 1 16 10732 1 1 1 LYS H1 H 13.713 11.329 1.051 1.00 . A A . 1 LYS H1 1 1 16 10733 1 1 1 LYS H2 H 13.173 10.012 0.141 1.00 . A A . 1 LYS H2 1 1 16 10734 1 1 1 LYS H3 H 13.058 9.953 1.822 1.00 . A A . 1 LYS H3 1 1 16 10735 1 1 1 LYS HA H 11.419 11.739 1.721 1.00 . A A . 1 LYS HA 1 1 16 10736 1 1 1 LYS HB2 H 12.226 12.815 -0.296 1.00 . A A . 1 LYS HB2 1 1 16 10737 1 1 1 LYS HB3 H 11.965 11.359 -1.230 1.00 . A A . 1 LYS HB3 1 1 16 10738 1 1 1 LYS HD2 H 10.919 14.155 -1.914 1.00 . A A . 1 LYS HD2 1 1 16 10739 1 1 1 LYS HD3 H 10.807 12.668 -2.848 1.00 . A A . 1 LYS HD3 1 1 16 10740 1 1 1 LYS HE2 H 9.126 14.260 -3.571 1.00 . A A . 1 LYS HE2 1 1 16 10741 1 1 1 LYS HE3 H 8.372 12.851 -2.847 1.00 . A A . 1 LYS HE3 1 1 16 10742 1 1 1 LYS HG2 H 9.543 11.636 -0.974 1.00 . A A . 1 LYS HG2 1 1 16 10743 1 1 1 LYS HG3 H 9.815 13.108 -0.035 1.00 . A A . 1 LYS HG3 1 1 16 10744 1 1 1 LYS HZ1 H 7.398 15.003 -2.204 1.00 . A A . 1 LYS HZ1 1 1 16 10745 1 1 1 LYS HZ2 H 8.794 15.401 -1.339 1.00 . A A . 1 LYS HZ2 1 1 16 10746 1 1 1 LYS HZ3 H 7.865 14.064 -0.909 1.00 . A A . 1 LYS HZ3 1 1 16 10747 1 1 1 LYS N N 12.994 10.581 0.999 1.00 . A A . 1 LYS N 1 1 16 10748 1 1 1 LYS NZ N 8.229 14.614 -1.715 1.00 . A A . 1 LYS NZ 1 1 16 10749 1 1 1 LYS O O 10.922 8.950 0.191 1.00 . A A . 1 LYS O 1 1 16 10750 1 1 2 THR C C 7.345 9.583 0.647 1.00 . A A . 2 THR C 1 1 16 10751 1 1 2 THR CA C 8.544 9.069 1.412 1.00 . A A . 2 THR CA 1 1 16 10752 1 1 2 THR CB C 8.162 8.533 2.790 1.00 . A A . 2 THR CB 1 1 16 10753 1 1 2 THR CG2 C 9.116 7.422 3.222 1.00 . A A . 2 THR CG2 1 1 16 10754 1 1 2 THR H H 9.380 10.834 2.091 1.00 . A A . 2 THR H 1 1 16 10755 1 1 2 THR HA H 8.970 8.260 0.834 1.00 . A A . 2 THR HA 1 1 16 10756 1 1 2 THR HB H 7.167 8.125 2.689 1.00 . A A . 2 THR HB 1 1 16 10757 1 1 2 THR HG1 H 7.253 9.809 3.992 1.00 . A A . 2 THR HG1 1 1 16 10758 1 1 2 THR HG21 H 8.833 7.058 4.199 1.00 . A A . 2 THR HG21 1 1 16 10759 1 1 2 THR HG22 H 10.123 7.808 3.258 1.00 . A A . 2 THR HG22 1 1 16 10760 1 1 2 THR HG23 H 9.071 6.611 2.509 1.00 . A A . 2 THR HG23 1 1 16 10761 1 1 2 THR N N 9.556 10.073 1.493 1.00 . A A . 2 THR N 1 1 16 10762 1 1 2 THR O O 6.801 10.656 0.957 1.00 . A A . 2 THR O 1 1 16 10763 1 1 2 THR OG1 O 8.169 9.606 3.757 1.00 . A A . 2 THR OG1 1 1 16 10764 1 1 3 CYS C C 4.737 8.310 -1.128 1.00 . A A . 3 CYS C 1 1 16 10765 1 1 3 CYS CA C 5.907 9.263 -1.245 1.00 . A A . 3 CYS CA 1 1 16 10766 1 1 3 CYS CB C 6.435 9.253 -2.682 1.00 . A A . 3 CYS CB 1 1 16 10767 1 1 3 CYS H H 7.394 7.979 -0.504 1.00 . A A . 3 CYS H 1 1 16 10768 1 1 3 CYS HA H 5.591 10.262 -0.993 1.00 . A A . 3 CYS HA 1 1 16 10769 1 1 3 CYS HB2 H 6.543 8.229 -3.009 1.00 . A A . 3 CYS HB2 1 1 16 10770 1 1 3 CYS HB3 H 5.732 9.763 -3.323 1.00 . A A . 3 CYS HB3 1 1 16 10771 1 1 3 CYS N N 6.962 8.850 -0.353 1.00 . A A . 3 CYS N 1 1 16 10772 1 1 3 CYS O O 4.881 7.117 -1.383 1.00 . A A . 3 CYS O 1 1 16 10773 1 1 3 CYS SG S 8.068 10.042 -2.906 1.00 . A A . 3 CYS SG 1 1 16 10774 1 1 4 GLU C C 1.695 8.050 -1.948 1.00 . A A . 4 GLU C 1 1 16 10775 1 1 4 GLU CA C 2.423 7.995 -0.611 1.00 . A A . 4 GLU CA 1 1 16 10776 1 1 4 GLU CB C 1.548 8.516 0.528 1.00 . A A . 4 GLU CB 1 1 16 10777 1 1 4 GLU CD C -0.401 8.172 2.062 1.00 . A A . 4 GLU CD 1 1 16 10778 1 1 4 GLU CG C 0.397 7.614 0.913 1.00 . A A . 4 GLU CG 1 1 16 10779 1 1 4 GLU H H 3.553 9.760 -0.486 1.00 . A A . 4 GLU H 1 1 16 10780 1 1 4 GLU HA H 2.715 6.975 -0.416 1.00 . A A . 4 GLU HA 1 1 16 10781 1 1 4 GLU HB2 H 2.165 8.653 1.404 1.00 . A A . 4 GLU HB2 1 1 16 10782 1 1 4 GLU HB3 H 1.146 9.473 0.234 1.00 . A A . 4 GLU HB3 1 1 16 10783 1 1 4 GLU HG2 H -0.252 7.506 0.058 1.00 . A A . 4 GLU HG2 1 1 16 10784 1 1 4 GLU HG3 H 0.787 6.647 1.195 1.00 . A A . 4 GLU HG3 1 1 16 10785 1 1 4 GLU N N 3.607 8.808 -0.721 1.00 . A A . 4 GLU N 1 1 16 10786 1 1 4 GLU O O 1.252 9.113 -2.380 1.00 . A A . 4 GLU O 1 1 16 10787 1 1 4 GLU OE1 O 0.090 8.136 3.209 1.00 . A A . 4 GLU OE1 1 1 16 10788 1 1 4 GLU OE2 O -1.535 8.663 1.851 1.00 . A A . 4 GLU OE2 1 1 16 10789 1 1 5 ASN C C 0.067 5.714 -4.033 1.00 . A A . 5 ASN C 1 1 16 10790 1 1 5 ASN CA C 1.050 6.872 -3.945 1.00 . A A . 5 ASN CA 1 1 16 10791 1 1 5 ASN CB C 2.172 6.685 -4.988 1.00 . A A . 5 ASN CB 1 1 16 10792 1 1 5 ASN CG C 1.689 6.707 -6.439 1.00 . A A . 5 ASN CG 1 1 16 10793 1 1 5 ASN H H 1.942 6.094 -2.206 1.00 . A A . 5 ASN H 1 1 16 10794 1 1 5 ASN HA H 0.544 7.804 -4.140 1.00 . A A . 5 ASN HA 1 1 16 10795 1 1 5 ASN HB2 H 2.897 7.477 -4.867 1.00 . A A . 5 ASN HB2 1 1 16 10796 1 1 5 ASN HB3 H 2.659 5.737 -4.804 1.00 . A A . 5 ASN HB3 1 1 16 10797 1 1 5 ASN HD21 H 0.400 8.185 -6.072 1.00 . A A . 5 ASN HD21 1 1 16 10798 1 1 5 ASN HD22 H 0.426 7.578 -7.679 1.00 . A A . 5 ASN HD22 1 1 16 10799 1 1 5 ASN N N 1.623 6.932 -2.616 1.00 . A A . 5 ASN N 1 1 16 10800 1 1 5 ASN ND2 N 0.756 7.574 -6.755 1.00 . A A . 5 ASN ND2 1 1 16 10801 1 1 5 ASN O O 0.205 4.730 -3.307 1.00 . A A . 5 ASN O 1 1 16 10802 1 1 5 ASN OD1 O 2.217 5.982 -7.285 1.00 . A A . 5 ASN OD1 1 1 16 10803 1 1 6 LEU C C -1.330 3.512 -5.598 1.00 . A A . 6 LEU C 1 1 16 10804 1 1 6 LEU CA C -1.912 4.805 -5.115 1.00 . A A . 6 LEU CA 1 1 16 10805 1 1 6 LEU CB C -3.002 5.243 -6.078 1.00 . A A . 6 LEU CB 1 1 16 10806 1 1 6 LEU CD1 C -5.150 6.363 -6.536 1.00 . A A . 6 LEU CD1 1 1 16 10807 1 1 6 LEU CD2 C -4.869 5.039 -4.497 1.00 . A A . 6 LEU CD2 1 1 16 10808 1 1 6 LEU CG C -4.178 5.959 -5.466 1.00 . A A . 6 LEU CG 1 1 16 10809 1 1 6 LEU H H -0.993 6.676 -5.408 1.00 . A A . 6 LEU H 1 1 16 10810 1 1 6 LEU HA H -2.377 4.617 -4.160 1.00 . A A . 6 LEU HA 1 1 16 10811 1 1 6 LEU HB2 H -2.556 5.897 -6.810 1.00 . A A . 6 LEU HB2 1 1 16 10812 1 1 6 LEU HB3 H -3.369 4.363 -6.587 1.00 . A A . 6 LEU HB3 1 1 16 10813 1 1 6 LEU HD11 H -5.498 5.459 -7.015 1.00 . A A . 6 LEU HD11 1 1 16 10814 1 1 6 LEU HD12 H -4.670 7.008 -7.257 1.00 . A A . 6 LEU HD12 1 1 16 10815 1 1 6 LEU HD13 H -5.993 6.860 -6.080 1.00 . A A . 6 LEU HD13 1 1 16 10816 1 1 6 LEU HD21 H -5.751 5.535 -4.122 1.00 . A A . 6 LEU HD21 1 1 16 10817 1 1 6 LEU HD22 H -4.224 4.814 -3.660 1.00 . A A . 6 LEU HD22 1 1 16 10818 1 1 6 LEU HD23 H -5.160 4.127 -4.998 1.00 . A A . 6 LEU HD23 1 1 16 10819 1 1 6 LEU HG H -3.855 6.834 -4.923 1.00 . A A . 6 LEU HG 1 1 16 10820 1 1 6 LEU N N -0.922 5.844 -4.896 1.00 . A A . 6 LEU N 1 1 16 10821 1 1 6 LEU O O -0.472 3.481 -6.477 1.00 . A A . 6 LEU O 1 1 16 10822 1 1 7 ALA C C -2.437 0.610 -6.395 1.00 . A A . 7 ALA C 1 1 16 10823 1 1 7 ALA CA C -1.432 1.148 -5.402 1.00 . A A . 7 ALA CA 1 1 16 10824 1 1 7 ALA CB C -1.363 0.237 -4.189 1.00 . A A . 7 ALA CB 1 1 16 10825 1 1 7 ALA H H -2.428 2.575 -4.267 1.00 . A A . 7 ALA H 1 1 16 10826 1 1 7 ALA HA H -0.453 1.182 -5.858 1.00 . A A . 7 ALA HA 1 1 16 10827 1 1 7 ALA HB1 H -0.660 0.634 -3.472 1.00 . A A . 7 ALA HB1 1 1 16 10828 1 1 7 ALA HB2 H -1.062 -0.757 -4.489 1.00 . A A . 7 ALA HB2 1 1 16 10829 1 1 7 ALA HB3 H -2.343 0.185 -3.737 1.00 . A A . 7 ALA HB3 1 1 16 10830 1 1 7 ALA N N -1.800 2.457 -5.018 1.00 . A A . 7 ALA N 1 1 16 10831 1 1 7 ALA O O -3.555 0.213 -6.025 1.00 . A A . 7 ALA O 1 1 16 10832 1 1 8 ASP C C -2.295 -1.310 -8.949 1.00 . A A . 8 ASP C 1 1 16 10833 1 1 8 ASP CA C -2.882 0.034 -8.682 1.00 . A A . 8 ASP CA 1 1 16 10834 1 1 8 ASP CB C -2.981 0.857 -9.976 1.00 . A A . 8 ASP CB 1 1 16 10835 1 1 8 ASP CG C -3.831 2.092 -9.825 1.00 . A A . 8 ASP CG 1 1 16 10836 1 1 8 ASP H H -1.279 1.172 -7.903 1.00 . A A . 8 ASP H 1 1 16 10837 1 1 8 ASP HA H -3.868 -0.115 -8.266 1.00 . A A . 8 ASP HA 1 1 16 10838 1 1 8 ASP HB2 H -1.991 1.163 -10.277 1.00 . A A . 8 ASP HB2 1 1 16 10839 1 1 8 ASP HB3 H -3.409 0.237 -10.750 1.00 . A A . 8 ASP HB3 1 1 16 10840 1 1 8 ASP N N -2.087 0.672 -7.649 1.00 . A A . 8 ASP N 1 1 16 10841 1 1 8 ASP O O -2.881 -2.149 -9.629 1.00 . A A . 8 ASP O 1 1 16 10842 1 1 8 ASP OD1 O -3.295 3.215 -9.890 1.00 . A A . 8 ASP OD1 1 1 16 10843 1 1 8 ASP OD2 O -5.068 1.966 -9.641 1.00 . A A . 8 ASP OD2 1 1 16 10844 1 1 9 THR C C -1.220 -3.732 -7.539 1.00 . A A . 9 THR C 1 1 16 10845 1 1 9 THR CA C -0.438 -2.762 -8.417 1.00 . A A . 9 THR CA 1 1 16 10846 1 1 9 THR CB C 0.954 -2.591 -7.820 1.00 . A A . 9 THR CB 1 1 16 10847 1 1 9 THR CG2 C 1.816 -3.768 -8.198 1.00 . A A . 9 THR CG2 1 1 16 10848 1 1 9 THR H H -0.619 -0.771 -7.980 1.00 . A A . 9 THR H 1 1 16 10849 1 1 9 THR HA H -0.355 -3.123 -9.431 1.00 . A A . 9 THR HA 1 1 16 10850 1 1 9 THR HB H 0.876 -2.536 -6.745 1.00 . A A . 9 THR HB 1 1 16 10851 1 1 9 THR HG1 H 2.240 -1.611 -8.957 1.00 . A A . 9 THR HG1 1 1 16 10852 1 1 9 THR HG21 H 2.796 -3.651 -7.764 1.00 . A A . 9 THR HG21 1 1 16 10853 1 1 9 THR HG22 H 1.893 -3.811 -9.274 1.00 . A A . 9 THR HG22 1 1 16 10854 1 1 9 THR HG23 H 1.359 -4.674 -7.829 1.00 . A A . 9 THR HG23 1 1 16 10855 1 1 9 THR N N -1.111 -1.512 -8.389 1.00 . A A . 9 THR N 1 1 16 10856 1 1 9 THR O O -1.390 -4.908 -7.882 1.00 . A A . 9 THR O 1 1 16 10857 1 1 9 THR OG1 O 1.547 -1.374 -8.327 1.00 . A A . 9 THR OG1 1 1 16 10858 1 1 10 TYR C C -3.879 -4.131 -6.198 1.00 . A A . 10 TYR C 1 1 16 10859 1 1 10 TYR CA C -2.537 -3.982 -5.541 1.00 . A A . 10 TYR CA 1 1 16 10860 1 1 10 TYR CB C -2.658 -3.346 -4.149 1.00 . A A . 10 TYR CB 1 1 16 10861 1 1 10 TYR CD1 C -4.646 -3.569 -2.608 1.00 . A A . 10 TYR CD1 1 1 16 10862 1 1 10 TYR CD2 C -3.254 -5.466 -2.900 1.00 . A A . 10 TYR CD2 1 1 16 10863 1 1 10 TYR CE1 C -5.454 -4.287 -1.759 1.00 . A A . 10 TYR CE1 1 1 16 10864 1 1 10 TYR CE2 C -4.053 -6.196 -2.050 1.00 . A A . 10 TYR CE2 1 1 16 10865 1 1 10 TYR CG C -3.534 -4.139 -3.193 1.00 . A A . 10 TYR CG 1 1 16 10866 1 1 10 TYR CZ C -5.152 -5.608 -1.479 1.00 . A A . 10 TYR CZ 1 1 16 10867 1 1 10 TYR H H -1.512 -2.286 -6.187 1.00 . A A . 10 TYR H 1 1 16 10868 1 1 10 TYR HA H -2.090 -4.963 -5.455 1.00 . A A . 10 TYR HA 1 1 16 10869 1 1 10 TYR HB2 H -1.674 -3.268 -3.710 1.00 . A A . 10 TYR HB2 1 1 16 10870 1 1 10 TYR HB3 H -3.080 -2.356 -4.249 1.00 . A A . 10 TYR HB3 1 1 16 10871 1 1 10 TYR HD1 H -4.885 -2.537 -2.819 1.00 . A A . 10 TYR HD1 1 1 16 10872 1 1 10 TYR HD2 H -2.386 -5.930 -3.347 1.00 . A A . 10 TYR HD2 1 1 16 10873 1 1 10 TYR HE1 H -6.307 -3.783 -1.329 1.00 . A A . 10 TYR HE1 1 1 16 10874 1 1 10 TYR HE2 H -3.803 -7.225 -1.840 1.00 . A A . 10 TYR HE2 1 1 16 10875 1 1 10 TYR HH H -5.442 -6.972 -0.120 1.00 . A A . 10 TYR HH 1 1 16 10876 1 1 10 TYR N N -1.709 -3.216 -6.414 1.00 . A A . 10 TYR N 1 1 16 10877 1 1 10 TYR O O -4.456 -3.156 -6.702 1.00 . A A . 10 TYR O 1 1 16 10878 1 1 10 TYR OH O -5.965 -6.344 -0.643 1.00 . A A . 10 TYR OH 1 1 16 10879 1 1 11 LYS C C -6.761 -5.335 -6.106 1.00 . A A . 11 LYS C 1 1 16 10880 1 1 11 LYS CA C -5.535 -5.687 -6.917 1.00 . A A . 11 LYS CA 1 1 16 10881 1 1 11 LYS CB C -5.482 -7.167 -7.263 1.00 . A A . 11 LYS CB 1 1 16 10882 1 1 11 LYS CD C -4.097 -8.986 -8.315 1.00 . A A . 11 LYS CD 1 1 16 10883 1 1 11 LYS CE C -2.844 -9.271 -9.120 1.00 . A A . 11 LYS CE 1 1 16 10884 1 1 11 LYS CG C -4.260 -7.504 -8.103 1.00 . A A . 11 LYS CG 1 1 16 10885 1 1 11 LYS H H -3.842 -6.033 -5.757 1.00 . A A . 11 LYS H 1 1 16 10886 1 1 11 LYS HA H -5.561 -5.129 -7.841 1.00 . A A . 11 LYS HA 1 1 16 10887 1 1 11 LYS HB2 H -5.449 -7.741 -6.350 1.00 . A A . 11 LYS HB2 1 1 16 10888 1 1 11 LYS HB3 H -6.365 -7.434 -7.825 1.00 . A A . 11 LYS HB3 1 1 16 10889 1 1 11 LYS HD2 H -4.023 -9.477 -7.356 1.00 . A A . 11 LYS HD2 1 1 16 10890 1 1 11 LYS HD3 H -4.955 -9.358 -8.854 1.00 . A A . 11 LYS HD3 1 1 16 10891 1 1 11 LYS HE2 H -2.941 -8.813 -10.092 1.00 . A A . 11 LYS HE2 1 1 16 10892 1 1 11 LYS HE3 H -1.996 -8.842 -8.608 1.00 . A A . 11 LYS HE3 1 1 16 10893 1 1 11 LYS HG2 H -4.360 -7.029 -9.067 1.00 . A A . 11 LYS HG2 1 1 16 10894 1 1 11 LYS HG3 H -3.383 -7.119 -7.605 1.00 . A A . 11 LYS HG3 1 1 16 10895 1 1 11 LYS HZ1 H -1.805 -10.867 -9.928 1.00 . A A . 11 LYS HZ1 1 1 16 10896 1 1 11 LYS HZ2 H -3.449 -11.179 -9.720 1.00 . A A . 11 LYS HZ2 1 1 16 10897 1 1 11 LYS HZ3 H -2.415 -11.171 -8.388 1.00 . A A . 11 LYS HZ3 1 1 16 10898 1 1 11 LYS N N -4.338 -5.333 -6.231 1.00 . A A . 11 LYS N 1 1 16 10899 1 1 11 LYS NZ N -2.618 -10.716 -9.299 1.00 . A A . 11 LYS NZ 1 1 16 10900 1 1 11 LYS O O -7.067 -5.975 -5.087 1.00 . A A . 11 LYS O 1 1 16 10901 1 1 12 GLY C C -8.405 -2.880 -4.773 1.00 . A A . 12 GLY C 1 1 16 10902 1 1 12 GLY CA C -8.630 -3.848 -5.915 1.00 . A A . 12 GLY CA 1 1 16 10903 1 1 12 GLY H H -7.022 -3.751 -7.251 1.00 . A A . 12 GLY H 1 1 16 10904 1 1 12 GLY HA2 H -9.235 -3.364 -6.668 1.00 . A A . 12 GLY HA2 1 1 16 10905 1 1 12 GLY HA3 H -9.160 -4.711 -5.542 1.00 . A A . 12 GLY HA3 1 1 16 10906 1 1 12 GLY N N -7.410 -4.279 -6.524 1.00 . A A . 12 GLY N 1 1 16 10907 1 1 12 GLY O O -7.276 -2.417 -4.552 1.00 . A A . 12 GLY O 1 1 16 10908 1 1 13 PRO C C -8.983 -2.373 -1.628 1.00 . A A . 13 PRO C 1 1 16 10909 1 1 13 PRO CA C -9.398 -1.644 -2.903 1.00 . A A . 13 PRO CA 1 1 16 10910 1 1 13 PRO CB C -10.849 -1.136 -2.755 1.00 . A A . 13 PRO CB 1 1 16 10911 1 1 13 PRO CD C -10.834 -2.995 -4.266 1.00 . A A . 13 PRO CD 1 1 16 10912 1 1 13 PRO CG C -11.628 -1.803 -3.844 1.00 . A A . 13 PRO CG 1 1 16 10913 1 1 13 PRO HA H -8.739 -0.809 -3.084 1.00 . A A . 13 PRO HA 1 1 16 10914 1 1 13 PRO HB2 H -11.217 -1.423 -1.780 1.00 . A A . 13 PRO HB2 1 1 16 10915 1 1 13 PRO HB3 H -10.878 -0.060 -2.841 1.00 . A A . 13 PRO HB3 1 1 16 10916 1 1 13 PRO HD2 H -11.070 -3.848 -3.648 1.00 . A A . 13 PRO HD2 1 1 16 10917 1 1 13 PRO HD3 H -11.001 -3.216 -5.309 1.00 . A A . 13 PRO HD3 1 1 16 10918 1 1 13 PRO HG2 H -12.586 -2.121 -3.459 1.00 . A A . 13 PRO HG2 1 1 16 10919 1 1 13 PRO HG3 H -11.758 -1.122 -4.672 1.00 . A A . 13 PRO HG3 1 1 16 10920 1 1 13 PRO N N -9.465 -2.544 -4.040 1.00 . A A . 13 PRO N 1 1 16 10921 1 1 13 PRO O O -8.759 -3.597 -1.625 1.00 . A A . 13 PRO O 1 1 16 10922 1 1 14 CYS C C -9.754 -2.553 1.506 1.00 . A A . 14 CYS C 1 1 16 10923 1 1 14 CYS CA C -8.532 -2.164 0.705 1.00 . A A . 14 CYS CA 1 1 16 10924 1 1 14 CYS CB C -7.712 -1.152 1.494 1.00 . A A . 14 CYS CB 1 1 16 10925 1 1 14 CYS H H -9.121 -0.676 -0.622 1.00 . A A . 14 CYS H 1 1 16 10926 1 1 14 CYS HA H -7.921 -3.039 0.542 1.00 . A A . 14 CYS HA 1 1 16 10927 1 1 14 CYS HB2 H -6.771 -0.985 0.990 1.00 . A A . 14 CYS HB2 1 1 16 10928 1 1 14 CYS HB3 H -8.260 -0.222 1.544 1.00 . A A . 14 CYS HB3 1 1 16 10929 1 1 14 CYS N N -8.903 -1.636 -0.563 1.00 . A A . 14 CYS N 1 1 16 10930 1 1 14 CYS O O -10.513 -1.691 1.971 1.00 . A A . 14 CYS O 1 1 16 10931 1 1 14 CYS SG S -7.352 -1.682 3.198 1.00 . A A . 14 CYS SG 1 1 16 10932 1 1 15 PHE C C -10.403 -4.730 3.799 1.00 . A A . 15 PHE C 1 1 16 10933 1 1 15 PHE CA C -11.018 -4.354 2.469 1.00 . A A . 15 PHE CA 1 1 16 10934 1 1 15 PHE CB C -11.678 -5.582 1.834 1.00 . A A . 15 PHE CB 1 1 16 10935 1 1 15 PHE CD1 C -11.729 -5.731 -0.670 1.00 . A A . 15 PHE CD1 1 1 16 10936 1 1 15 PHE CD2 C -13.513 -4.606 0.440 1.00 . A A . 15 PHE CD2 1 1 16 10937 1 1 15 PHE CE1 C -12.319 -5.470 -1.887 1.00 . A A . 15 PHE CE1 1 1 16 10938 1 1 15 PHE CE2 C -14.106 -4.343 -0.774 1.00 . A A . 15 PHE CE2 1 1 16 10939 1 1 15 PHE CG C -12.320 -5.304 0.508 1.00 . A A . 15 PHE CG 1 1 16 10940 1 1 15 PHE CZ C -13.509 -4.775 -1.937 1.00 . A A . 15 PHE CZ 1 1 16 10941 1 1 15 PHE H H -9.414 -4.459 1.110 1.00 . A A . 15 PHE H 1 1 16 10942 1 1 15 PHE HA H -11.755 -3.579 2.615 1.00 . A A . 15 PHE HA 1 1 16 10943 1 1 15 PHE HB2 H -10.931 -6.347 1.686 1.00 . A A . 15 PHE HB2 1 1 16 10944 1 1 15 PHE HB3 H -12.439 -5.958 2.503 1.00 . A A . 15 PHE HB3 1 1 16 10945 1 1 15 PHE HD1 H -10.798 -6.278 -0.628 1.00 . A A . 15 PHE HD1 1 1 16 10946 1 1 15 PHE HD2 H -13.982 -4.268 1.353 1.00 . A A . 15 PHE HD2 1 1 16 10947 1 1 15 PHE HE1 H -11.852 -5.808 -2.800 1.00 . A A . 15 PHE HE1 1 1 16 10948 1 1 15 PHE HE2 H -15.038 -3.798 -0.812 1.00 . A A . 15 PHE HE2 1 1 16 10949 1 1 15 PHE HZ H -13.973 -4.568 -2.890 1.00 . A A . 15 PHE HZ 1 1 16 10950 1 1 15 PHE N N -9.971 -3.834 1.623 1.00 . A A . 15 PHE N 1 1 16 10951 1 1 15 PHE O O -11.077 -4.804 4.824 1.00 . A A . 15 PHE O 1 1 16 10952 1 1 16 THR C C -6.977 -4.715 4.793 1.00 . A A . 16 THR C 1 1 16 10953 1 1 16 THR CA C -8.365 -5.341 4.917 1.00 . A A . 16 THR CA 1 1 16 10954 1 1 16 THR CB C -8.256 -6.856 5.078 1.00 . A A . 16 THR CB 1 1 16 10955 1 1 16 THR CG2 C -7.555 -7.222 6.372 1.00 . A A . 16 THR CG2 1 1 16 10956 1 1 16 THR H H -8.660 -5.034 2.895 1.00 . A A . 16 THR H 1 1 16 10957 1 1 16 THR HA H -8.871 -4.933 5.777 1.00 . A A . 16 THR HA 1 1 16 10958 1 1 16 THR HB H -7.694 -7.235 4.238 1.00 . A A . 16 THR HB 1 1 16 10959 1 1 16 THR HG1 H -10.168 -6.626 5.068 1.00 . A A . 16 THR HG1 1 1 16 10960 1 1 16 THR HG21 H -7.489 -8.297 6.456 1.00 . A A . 16 THR HG21 1 1 16 10961 1 1 16 THR HG22 H -8.117 -6.831 7.206 1.00 . A A . 16 THR HG22 1 1 16 10962 1 1 16 THR HG23 H -6.561 -6.800 6.376 1.00 . A A . 16 THR HG23 1 1 16 10963 1 1 16 THR N N -9.128 -5.026 3.758 1.00 . A A . 16 THR N 1 1 16 10964 1 1 16 THR O O -6.216 -5.035 3.861 1.00 . A A . 16 THR O 1 1 16 10965 1 1 16 THR OG1 O -9.588 -7.402 5.090 1.00 . A A . 16 THR OG1 1 1 16 10966 1 1 17 THR C C -4.219 -4.074 5.755 1.00 . A A . 17 THR C 1 1 16 10967 1 1 17 THR CA C -5.406 -3.111 5.753 1.00 . A A . 17 THR CA 1 1 16 10968 1 1 17 THR CB C -5.361 -2.209 6.997 1.00 . A A . 17 THR CB 1 1 16 10969 1 1 17 THR CG2 C -4.199 -1.237 6.917 1.00 . A A . 17 THR CG2 1 1 16 10970 1 1 17 THR H H -7.325 -3.620 6.412 1.00 . A A . 17 THR H 1 1 16 10971 1 1 17 THR HA H -5.355 -2.485 4.875 1.00 . A A . 17 THR HA 1 1 16 10972 1 1 17 THR HB H -5.262 -2.822 7.880 1.00 . A A . 17 THR HB 1 1 16 10973 1 1 17 THR HG1 H -6.609 -0.863 6.302 1.00 . A A . 17 THR HG1 1 1 16 10974 1 1 17 THR HG21 H -4.325 -0.600 6.055 1.00 . A A . 17 THR HG21 1 1 16 10975 1 1 17 THR HG22 H -3.276 -1.789 6.819 1.00 . A A . 17 THR HG22 1 1 16 10976 1 1 17 THR HG23 H -4.167 -0.633 7.811 1.00 . A A . 17 THR HG23 1 1 16 10977 1 1 17 THR N N -6.665 -3.832 5.717 1.00 . A A . 17 THR N 1 1 16 10978 1 1 17 THR O O -3.230 -3.836 5.084 1.00 . A A . 17 THR O 1 1 16 10979 1 1 17 THR OG1 O -6.587 -1.461 7.058 1.00 . A A . 17 THR OG1 1 1 16 10980 1 1 18 GLY C C -2.949 -6.739 5.163 1.00 . A A . 18 GLY C 1 1 16 10981 1 1 18 GLY CA C -3.325 -6.193 6.528 1.00 . A A . 18 GLY CA 1 1 16 10982 1 1 18 GLY H H -5.187 -5.295 6.983 1.00 . A A . 18 GLY H 1 1 16 10983 1 1 18 GLY HA2 H -2.446 -5.755 6.974 1.00 . A A . 18 GLY HA2 1 1 16 10984 1 1 18 GLY HA3 H -3.663 -7.007 7.151 1.00 . A A . 18 GLY HA3 1 1 16 10985 1 1 18 GLY N N -4.363 -5.183 6.466 1.00 . A A . 18 GLY N 1 1 16 10986 1 1 18 GLY O O -1.774 -6.925 4.876 1.00 . A A . 18 GLY O 1 1 16 10987 1 1 19 SER C C -3.061 -6.378 2.108 1.00 . A A . 19 SER C 1 1 16 10988 1 1 19 SER CA C -3.729 -7.453 2.975 1.00 . A A . 19 SER CA 1 1 16 10989 1 1 19 SER CB C -5.083 -7.876 2.372 1.00 . A A . 19 SER CB 1 1 16 10990 1 1 19 SER H H -4.855 -6.727 4.599 1.00 . A A . 19 SER H 1 1 16 10991 1 1 19 SER HA H -3.083 -8.317 3.034 1.00 . A A . 19 SER HA 1 1 16 10992 1 1 19 SER HB2 H -5.504 -8.676 2.963 1.00 . A A . 19 SER HB2 1 1 16 10993 1 1 19 SER HB3 H -5.753 -7.030 2.397 1.00 . A A . 19 SER HB3 1 1 16 10994 1 1 19 SER HG H -4.687 -9.250 1.044 1.00 . A A . 19 SER HG 1 1 16 10995 1 1 19 SER N N -3.942 -6.942 4.316 1.00 . A A . 19 SER N 1 1 16 10996 1 1 19 SER O O -2.138 -6.663 1.324 1.00 . A A . 19 SER O 1 1 16 10997 1 1 19 SER OG O -4.961 -8.322 1.032 1.00 . A A . 19 SER OG 1 1 16 10998 1 1 20 CYS C C -1.570 -3.699 1.905 1.00 . A A . 20 CYS C 1 1 16 10999 1 1 20 CYS CA C -3.029 -4.004 1.547 1.00 . A A . 20 CYS CA 1 1 16 11000 1 1 20 CYS CB C -3.921 -2.801 1.886 1.00 . A A . 20 CYS CB 1 1 16 11001 1 1 20 CYS H H -4.218 -5.015 2.956 1.00 . A A . 20 CYS H 1 1 16 11002 1 1 20 CYS HA H -3.111 -4.207 0.490 1.00 . A A . 20 CYS HA 1 1 16 11003 1 1 20 CYS HB2 H -4.932 -3.001 1.563 1.00 . A A . 20 CYS HB2 1 1 16 11004 1 1 20 CYS HB3 H -3.916 -2.661 2.957 1.00 . A A . 20 CYS HB3 1 1 16 11005 1 1 20 CYS N N -3.515 -5.156 2.287 1.00 . A A . 20 CYS N 1 1 16 11006 1 1 20 CYS O O -0.694 -3.587 1.027 1.00 . A A . 20 CYS O 1 1 16 11007 1 1 20 CYS SG S -3.428 -1.237 1.135 1.00 . A A . 20 CYS SG 1 1 16 11008 1 1 21 ASP C C 1.016 -4.339 3.391 1.00 . A A . 21 ASP C 1 1 16 11009 1 1 21 ASP CA C -0.018 -3.275 3.727 1.00 . A A . 21 ASP CA 1 1 16 11010 1 1 21 ASP CB C -0.132 -3.024 5.244 1.00 . A A . 21 ASP CB 1 1 16 11011 1 1 21 ASP CG C 1.155 -2.554 5.890 1.00 . A A . 21 ASP CG 1 1 16 11012 1 1 21 ASP H H -2.033 -3.829 3.837 1.00 . A A . 21 ASP H 1 1 16 11013 1 1 21 ASP HA H 0.285 -2.354 3.249 1.00 . A A . 21 ASP HA 1 1 16 11014 1 1 21 ASP HB2 H -0.867 -2.246 5.388 1.00 . A A . 21 ASP HB2 1 1 16 11015 1 1 21 ASP HB3 H -0.487 -3.916 5.741 1.00 . A A . 21 ASP HB3 1 1 16 11016 1 1 21 ASP N N -1.313 -3.632 3.195 1.00 . A A . 21 ASP N 1 1 16 11017 1 1 21 ASP O O 2.121 -4.018 2.958 1.00 . A A . 21 ASP O 1 1 16 11018 1 1 21 ASP OD1 O 1.574 -1.405 5.654 1.00 . A A . 21 ASP OD1 1 1 16 11019 1 1 21 ASP OD2 O 1.737 -3.299 6.704 1.00 . A A . 21 ASP OD2 1 1 16 11020 1 1 22 ASP C C 1.937 -6.687 1.721 1.00 . A A . 22 ASP C 1 1 16 11021 1 1 22 ASP CA C 1.492 -6.751 3.173 1.00 . A A . 22 ASP CA 1 1 16 11022 1 1 22 ASP CB C 0.769 -8.084 3.423 1.00 . A A . 22 ASP CB 1 1 16 11023 1 1 22 ASP CG C 1.578 -9.325 3.043 1.00 . A A . 22 ASP CG 1 1 16 11024 1 1 22 ASP H H -0.293 -5.791 3.828 1.00 . A A . 22 ASP H 1 1 16 11025 1 1 22 ASP HA H 2.365 -6.700 3.808 1.00 . A A . 22 ASP HA 1 1 16 11026 1 1 22 ASP HB2 H 0.485 -8.150 4.462 1.00 . A A . 22 ASP HB2 1 1 16 11027 1 1 22 ASP HB3 H -0.128 -8.085 2.824 1.00 . A A . 22 ASP HB3 1 1 16 11028 1 1 22 ASP N N 0.616 -5.609 3.502 1.00 . A A . 22 ASP N 1 1 16 11029 1 1 22 ASP O O 3.110 -6.888 1.422 1.00 . A A . 22 ASP O 1 1 16 11030 1 1 22 ASP OD1 O 1.488 -9.786 1.885 1.00 . A A . 22 ASP OD1 1 1 16 11031 1 1 22 ASP OD2 O 2.274 -9.904 3.907 1.00 . A A . 22 ASP OD2 1 1 16 11032 1 1 23 HIS C C 2.337 -5.223 -0.892 1.00 . A A . 23 HIS C 1 1 16 11033 1 1 23 HIS CA C 1.283 -6.279 -0.595 1.00 . A A . 23 HIS CA 1 1 16 11034 1 1 23 HIS CB C -0.009 -5.989 -1.396 1.00 . A A . 23 HIS CB 1 1 16 11035 1 1 23 HIS CD2 C 0.658 -4.941 -3.693 1.00 . A A . 23 HIS CD2 1 1 16 11036 1 1 23 HIS CE1 C 0.099 -6.566 -5.013 1.00 . A A . 23 HIS CE1 1 1 16 11037 1 1 23 HIS CG C 0.171 -5.936 -2.904 1.00 . A A . 23 HIS CG 1 1 16 11038 1 1 23 HIS H H 0.107 -6.120 1.157 1.00 . A A . 23 HIS H 1 1 16 11039 1 1 23 HIS HA H 1.672 -7.239 -0.899 1.00 . A A . 23 HIS HA 1 1 16 11040 1 1 23 HIS HB2 H -0.744 -6.750 -1.183 1.00 . A A . 23 HIS HB2 1 1 16 11041 1 1 23 HIS HB3 H -0.400 -5.033 -1.078 1.00 . A A . 23 HIS HB3 1 1 16 11042 1 1 23 HIS HD1 H -0.588 -7.821 -3.522 1.00 . A A . 23 HIS HD1 1 1 16 11043 1 1 23 HIS HD2 H 1.013 -3.983 -3.343 1.00 . A A . 23 HIS HD2 1 1 16 11044 1 1 23 HIS HE1 H -0.073 -7.164 -5.897 1.00 . A A . 23 HIS HE1 1 1 16 11045 1 1 23 HIS N N 1.006 -6.345 0.836 1.00 . A A . 23 HIS N 1 1 16 11046 1 1 23 HIS ND1 N -0.181 -6.958 -3.764 1.00 . A A . 23 HIS ND1 1 1 16 11047 1 1 23 HIS NE2 N 0.611 -5.345 -5.022 1.00 . A A . 23 HIS NE2 1 1 16 11048 1 1 23 HIS O O 3.387 -5.519 -1.458 1.00 . A A . 23 HIS O 1 1 16 11049 1 1 24 CYS C C 4.382 -3.134 -0.171 1.00 . A A . 24 CYS C 1 1 16 11050 1 1 24 CYS CA C 2.989 -2.937 -0.789 1.00 . A A . 24 CYS CA 1 1 16 11051 1 1 24 CYS CB C 2.356 -1.582 -0.474 1.00 . A A . 24 CYS CB 1 1 16 11052 1 1 24 CYS H H 1.269 -3.842 0.041 1.00 . A A . 24 CYS H 1 1 16 11053 1 1 24 CYS HA H 3.132 -2.997 -1.858 1.00 . A A . 24 CYS HA 1 1 16 11054 1 1 24 CYS HB2 H 2.055 -1.561 0.564 1.00 . A A . 24 CYS HB2 1 1 16 11055 1 1 24 CYS HB3 H 3.071 -0.796 -0.662 1.00 . A A . 24 CYS HB3 1 1 16 11056 1 1 24 CYS N N 2.086 -4.016 -0.481 1.00 . A A . 24 CYS N 1 1 16 11057 1 1 24 CYS O O 5.381 -2.786 -0.779 1.00 . A A . 24 CYS O 1 1 16 11058 1 1 24 CYS SG S 0.878 -1.261 -1.512 1.00 . A A . 24 CYS SG 1 1 16 11059 1 1 25 LYS C C 6.429 -5.236 1.008 1.00 . A A . 25 LYS C 1 1 16 11060 1 1 25 LYS CA C 5.732 -4.030 1.622 1.00 . A A . 25 LYS CA 1 1 16 11061 1 1 25 LYS CB C 5.533 -4.281 3.103 1.00 . A A . 25 LYS CB 1 1 16 11062 1 1 25 LYS CD C 4.501 -3.490 5.219 1.00 . A A . 25 LYS CD 1 1 16 11063 1 1 25 LYS CE C 5.654 -3.847 6.130 1.00 . A A . 25 LYS CE 1 1 16 11064 1 1 25 LYS CG C 4.932 -3.116 3.826 1.00 . A A . 25 LYS CG 1 1 16 11065 1 1 25 LYS H H 3.620 -4.065 1.417 1.00 . A A . 25 LYS H 1 1 16 11066 1 1 25 LYS HA H 6.356 -3.157 1.504 1.00 . A A . 25 LYS HA 1 1 16 11067 1 1 25 LYS HB2 H 4.883 -5.135 3.226 1.00 . A A . 25 LYS HB2 1 1 16 11068 1 1 25 LYS HB3 H 6.492 -4.503 3.548 1.00 . A A . 25 LYS HB3 1 1 16 11069 1 1 25 LYS HD2 H 3.963 -2.655 5.636 1.00 . A A . 25 LYS HD2 1 1 16 11070 1 1 25 LYS HD3 H 3.829 -4.333 5.152 1.00 . A A . 25 LYS HD3 1 1 16 11071 1 1 25 LYS HE2 H 6.185 -4.693 5.720 1.00 . A A . 25 LYS HE2 1 1 16 11072 1 1 25 LYS HE3 H 6.317 -2.998 6.196 1.00 . A A . 25 LYS HE3 1 1 16 11073 1 1 25 LYS HG2 H 5.661 -2.322 3.887 1.00 . A A . 25 LYS HG2 1 1 16 11074 1 1 25 LYS HG3 H 4.071 -2.775 3.270 1.00 . A A . 25 LYS HG3 1 1 16 11075 1 1 25 LYS HZ1 H 4.540 -5.007 7.442 1.00 . A A . 25 LYS HZ1 1 1 16 11076 1 1 25 LYS HZ2 H 4.645 -3.375 7.874 1.00 . A A . 25 LYS HZ2 1 1 16 11077 1 1 25 LYS HZ3 H 5.969 -4.397 8.112 1.00 . A A . 25 LYS HZ3 1 1 16 11078 1 1 25 LYS N N 4.449 -3.767 0.979 1.00 . A A . 25 LYS N 1 1 16 11079 1 1 25 LYS NZ N 5.171 -4.182 7.481 1.00 . A A . 25 LYS NZ 1 1 16 11080 1 1 25 LYS O O 7.498 -5.118 0.431 1.00 . A A . 25 LYS O 1 1 16 11081 1 1 26 ASN C C 6.455 -7.848 -0.790 1.00 . A A . 26 ASN C 1 1 16 11082 1 1 26 ASN CA C 6.388 -7.650 0.707 1.00 . A A . 26 ASN CA 1 1 16 11083 1 1 26 ASN CB C 5.640 -8.805 1.380 1.00 . A A . 26 ASN CB 1 1 16 11084 1 1 26 ASN CG C 5.904 -8.873 2.870 1.00 . A A . 26 ASN CG 1 1 16 11085 1 1 26 ASN H H 4.859 -6.377 1.414 1.00 . A A . 26 ASN H 1 1 16 11086 1 1 26 ASN HA H 7.397 -7.651 1.089 1.00 . A A . 26 ASN HA 1 1 16 11087 1 1 26 ASN HB2 H 4.578 -8.675 1.229 1.00 . A A . 26 ASN HB2 1 1 16 11088 1 1 26 ASN HB3 H 5.952 -9.736 0.934 1.00 . A A . 26 ASN HB3 1 1 16 11089 1 1 26 ASN HD21 H 4.003 -9.362 3.277 1.00 . A A . 26 ASN HD21 1 1 16 11090 1 1 26 ASN HD22 H 5.080 -9.222 4.607 1.00 . A A . 26 ASN HD22 1 1 16 11091 1 1 26 ASN N N 5.790 -6.372 1.093 1.00 . A A . 26 ASN N 1 1 16 11092 1 1 26 ASN ND2 N 4.902 -9.181 3.645 1.00 . A A . 26 ASN ND2 1 1 16 11093 1 1 26 ASN O O 7.453 -8.343 -1.313 1.00 . A A . 26 ASN O 1 1 16 11094 1 1 26 ASN OD1 O 7.011 -8.592 3.330 1.00 . A A . 26 ASN OD1 1 1 16 11095 1 1 27 LYS C C 6.091 -6.497 -3.657 1.00 . A A . 27 LYS C 1 1 16 11096 1 1 27 LYS CA C 5.375 -7.627 -2.918 1.00 . A A . 27 LYS CA 1 1 16 11097 1 1 27 LYS CB C 3.902 -7.738 -3.374 1.00 . A A . 27 LYS CB 1 1 16 11098 1 1 27 LYS CD C 4.260 -9.044 -5.502 1.00 . A A . 27 LYS CD 1 1 16 11099 1 1 27 LYS CE C 4.025 -9.060 -7.001 1.00 . A A . 27 LYS CE 1 1 16 11100 1 1 27 LYS CG C 3.676 -7.795 -4.879 1.00 . A A . 27 LYS CG 1 1 16 11101 1 1 27 LYS H H 4.687 -6.987 -1.032 1.00 . A A . 27 LYS H 1 1 16 11102 1 1 27 LYS HA H 5.872 -8.559 -3.146 1.00 . A A . 27 LYS HA 1 1 16 11103 1 1 27 LYS HB2 H 3.476 -8.632 -2.943 1.00 . A A . 27 LYS HB2 1 1 16 11104 1 1 27 LYS HB3 H 3.365 -6.886 -2.984 1.00 . A A . 27 LYS HB3 1 1 16 11105 1 1 27 LYS HD2 H 5.320 -9.077 -5.306 1.00 . A A . 27 LYS HD2 1 1 16 11106 1 1 27 LYS HD3 H 3.781 -9.907 -5.061 1.00 . A A . 27 LYS HD3 1 1 16 11107 1 1 27 LYS HE2 H 4.394 -9.991 -7.404 1.00 . A A . 27 LYS HE2 1 1 16 11108 1 1 27 LYS HE3 H 2.961 -8.994 -7.179 1.00 . A A . 27 LYS HE3 1 1 16 11109 1 1 27 LYS HG2 H 2.614 -7.776 -5.076 1.00 . A A . 27 LYS HG2 1 1 16 11110 1 1 27 LYS HG3 H 4.137 -6.929 -5.329 1.00 . A A . 27 LYS HG3 1 1 16 11111 1 1 27 LYS HZ1 H 4.419 -7.932 -8.690 1.00 . A A . 27 LYS HZ1 1 1 16 11112 1 1 27 LYS HZ2 H 5.734 -8.063 -7.667 1.00 . A A . 27 LYS HZ2 1 1 16 11113 1 1 27 LYS HZ3 H 4.488 -6.994 -7.285 1.00 . A A . 27 LYS HZ3 1 1 16 11114 1 1 27 LYS N N 5.433 -7.440 -1.485 1.00 . A A . 27 LYS N 1 1 16 11115 1 1 27 LYS NZ N 4.703 -7.934 -7.690 1.00 . A A . 27 LYS NZ 1 1 16 11116 1 1 27 LYS O O 6.954 -6.750 -4.497 1.00 . A A . 27 LYS O 1 1 16 11117 1 1 28 GLU C C 7.551 -3.504 -3.459 1.00 . A A . 28 GLU C 1 1 16 11118 1 1 28 GLU CA C 6.317 -4.142 -4.070 1.00 . A A . 28 GLU CA 1 1 16 11119 1 1 28 GLU CB C 5.249 -3.115 -4.387 1.00 . A A . 28 GLU CB 1 1 16 11120 1 1 28 GLU CD C 4.913 -4.044 -6.695 1.00 . A A . 28 GLU CD 1 1 16 11121 1 1 28 GLU CG C 4.240 -3.612 -5.404 1.00 . A A . 28 GLU CG 1 1 16 11122 1 1 28 GLU H H 5.133 -5.121 -2.593 1.00 . A A . 28 GLU H 1 1 16 11123 1 1 28 GLU HA H 6.639 -4.562 -5.012 1.00 . A A . 28 GLU HA 1 1 16 11124 1 1 28 GLU HB2 H 4.728 -2.863 -3.477 1.00 . A A . 28 GLU HB2 1 1 16 11125 1 1 28 GLU HB3 H 5.722 -2.229 -4.782 1.00 . A A . 28 GLU HB3 1 1 16 11126 1 1 28 GLU HG2 H 3.710 -4.456 -4.987 1.00 . A A . 28 GLU HG2 1 1 16 11127 1 1 28 GLU HG3 H 3.541 -2.819 -5.625 1.00 . A A . 28 GLU HG3 1 1 16 11128 1 1 28 GLU N N 5.771 -5.268 -3.327 1.00 . A A . 28 GLU N 1 1 16 11129 1 1 28 GLU O O 8.171 -2.647 -4.087 1.00 . A A . 28 GLU O 1 1 16 11130 1 1 28 GLU OE1 O 5.440 -3.173 -7.428 1.00 . A A . 28 GLU OE1 1 1 16 11131 1 1 28 GLU OE2 O 4.918 -5.265 -7.020 1.00 . A A . 28 GLU OE2 1 1 16 11132 1 1 29 HIS C C 9.033 -1.958 -1.221 1.00 . A A . 29 HIS C 1 1 16 11133 1 1 29 HIS CA C 9.137 -3.444 -1.565 1.00 . A A . 29 HIS CA 1 1 16 11134 1 1 29 HIS CB C 10.408 -3.750 -2.404 1.00 . A A . 29 HIS CB 1 1 16 11135 1 1 29 HIS CD2 C 11.353 -6.113 -1.919 1.00 . A A . 29 HIS CD2 1 1 16 11136 1 1 29 HIS CE1 C 10.402 -7.209 -3.529 1.00 . A A . 29 HIS CE1 1 1 16 11137 1 1 29 HIS CG C 10.631 -5.219 -2.632 1.00 . A A . 29 HIS CG 1 1 16 11138 1 1 29 HIS H H 7.345 -4.578 -1.790 1.00 . A A . 29 HIS H 1 1 16 11139 1 1 29 HIS HA H 9.196 -3.987 -0.633 1.00 . A A . 29 HIS HA 1 1 16 11140 1 1 29 HIS HB2 H 10.317 -3.274 -3.369 1.00 . A A . 29 HIS HB2 1 1 16 11141 1 1 29 HIS HB3 H 11.272 -3.355 -1.891 1.00 . A A . 29 HIS HB3 1 1 16 11142 1 1 29 HIS HD1 H 9.465 -5.579 -4.360 1.00 . A A . 29 HIS HD1 1 1 16 11143 1 1 29 HIS HD2 H 11.958 -5.886 -1.052 1.00 . A A . 29 HIS HD2 1 1 16 11144 1 1 29 HIS HE1 H 10.083 -7.999 -4.194 1.00 . A A . 29 HIS HE1 1 1 16 11145 1 1 29 HIS N N 7.912 -3.928 -2.252 1.00 . A A . 29 HIS N 1 1 16 11146 1 1 29 HIS ND1 N 10.043 -5.937 -3.651 1.00 . A A . 29 HIS ND1 1 1 16 11147 1 1 29 HIS NE2 N 11.202 -7.377 -2.487 1.00 . A A . 29 HIS NE2 1 1 16 11148 1 1 29 HIS O O 10.030 -1.207 -1.245 1.00 . A A . 29 HIS O 1 1 16 11149 1 1 30 LEU C C 7.576 -0.158 1.050 1.00 . A A . 30 LEU C 1 1 16 11150 1 1 30 LEU CA C 7.557 -0.199 -0.472 1.00 . A A . 30 LEU CA 1 1 16 11151 1 1 30 LEU CB C 6.195 0.263 -1.012 1.00 . A A . 30 LEU CB 1 1 16 11152 1 1 30 LEU CD1 C 4.641 0.700 -2.947 1.00 . A A . 30 LEU CD1 1 1 16 11153 1 1 30 LEU CD2 C 7.115 0.724 -3.322 1.00 . A A . 30 LEU CD2 1 1 16 11154 1 1 30 LEU CG C 5.975 0.109 -2.527 1.00 . A A . 30 LEU CG 1 1 16 11155 1 1 30 LEU H H 7.090 -2.192 -0.890 1.00 . A A . 30 LEU H 1 1 16 11156 1 1 30 LEU HA H 8.337 0.438 -0.855 1.00 . A A . 30 LEU HA 1 1 16 11157 1 1 30 LEU HB2 H 5.428 -0.302 -0.504 1.00 . A A . 30 LEU HB2 1 1 16 11158 1 1 30 LEU HB3 H 6.069 1.306 -0.759 1.00 . A A . 30 LEU HB3 1 1 16 11159 1 1 30 LEU HD11 H 3.840 0.185 -2.436 1.00 . A A . 30 LEU HD11 1 1 16 11160 1 1 30 LEU HD12 H 4.517 0.587 -4.013 1.00 . A A . 30 LEU HD12 1 1 16 11161 1 1 30 LEU HD13 H 4.614 1.750 -2.690 1.00 . A A . 30 LEU HD13 1 1 16 11162 1 1 30 LEU HD21 H 6.902 0.638 -4.377 1.00 . A A . 30 LEU HD21 1 1 16 11163 1 1 30 LEU HD22 H 8.031 0.194 -3.101 1.00 . A A . 30 LEU HD22 1 1 16 11164 1 1 30 LEU HD23 H 7.230 1.764 -3.057 1.00 . A A . 30 LEU HD23 1 1 16 11165 1 1 30 LEU HG H 5.936 -0.946 -2.752 1.00 . A A . 30 LEU HG 1 1 16 11166 1 1 30 LEU N N 7.832 -1.548 -0.881 1.00 . A A . 30 LEU N 1 1 16 11167 1 1 30 LEU O O 7.775 -1.195 1.686 1.00 . A A . 30 LEU O 1 1 16 11168 1 1 31 ARG C C 6.231 0.466 3.749 1.00 . A A . 31 ARG C 1 1 16 11169 1 1 31 ARG CA C 7.421 1.135 3.086 1.00 . A A . 31 ARG CA 1 1 16 11170 1 1 31 ARG CB C 7.483 2.605 3.524 1.00 . A A . 31 ARG CB 1 1 16 11171 1 1 31 ARG CD C 7.431 4.215 5.473 1.00 . A A . 31 ARG CD 1 1 16 11172 1 1 31 ARG CG C 7.628 2.776 5.036 1.00 . A A . 31 ARG CG 1 1 16 11173 1 1 31 ARG CZ C 6.652 4.577 7.833 1.00 . A A . 31 ARG CZ 1 1 16 11174 1 1 31 ARG H H 7.090 1.773 1.086 1.00 . A A . 31 ARG H 1 1 16 11175 1 1 31 ARG HA H 8.315 0.633 3.419 1.00 . A A . 31 ARG HA 1 1 16 11176 1 1 31 ARG HB2 H 8.327 3.078 3.041 1.00 . A A . 31 ARG HB2 1 1 16 11177 1 1 31 ARG HB3 H 6.575 3.100 3.211 1.00 . A A . 31 ARG HB3 1 1 16 11178 1 1 31 ARG HD2 H 8.143 4.837 4.950 1.00 . A A . 31 ARG HD2 1 1 16 11179 1 1 31 ARG HD3 H 6.429 4.524 5.218 1.00 . A A . 31 ARG HD3 1 1 16 11180 1 1 31 ARG HE H 8.573 4.356 7.205 1.00 . A A . 31 ARG HE 1 1 16 11181 1 1 31 ARG HG2 H 6.888 2.162 5.528 1.00 . A A . 31 ARG HG2 1 1 16 11182 1 1 31 ARG HG3 H 8.615 2.449 5.330 1.00 . A A . 31 ARG HG3 1 1 16 11183 1 1 31 ARG HH11 H 5.063 4.401 6.537 1.00 . A A . 31 ARG HH11 1 1 16 11184 1 1 31 ARG HH12 H 4.621 4.688 8.139 1.00 . A A . 31 ARG HH12 1 1 16 11185 1 1 31 ARG HH21 H 7.931 4.780 9.398 1.00 . A A . 31 ARG HH21 1 1 16 11186 1 1 31 ARG HH22 H 6.289 4.935 9.813 1.00 . A A . 31 ARG HH22 1 1 16 11187 1 1 31 ARG N N 7.349 1.000 1.637 1.00 . A A . 31 ARG N 1 1 16 11188 1 1 31 ARG NE N 7.630 4.375 6.919 1.00 . A A . 31 ARG NE 1 1 16 11189 1 1 31 ARG NH1 N 5.367 4.558 7.479 1.00 . A A . 31 ARG NH1 1 1 16 11190 1 1 31 ARG NH2 N 6.973 4.777 9.096 1.00 . A A . 31 ARG NH2 1 1 16 11191 1 1 31 ARG O O 6.392 -0.392 4.618 1.00 . A A . 31 ARG O 1 1 16 11192 1 1 32 SER C C 2.664 0.641 2.986 1.00 . A A . 32 SER C 1 1 16 11193 1 1 32 SER CA C 3.817 0.374 3.935 1.00 . A A . 32 SER CA 1 1 16 11194 1 1 32 SER CB C 3.556 1.073 5.279 1.00 . A A . 32 SER CB 1 1 16 11195 1 1 32 SER H H 4.957 1.517 2.625 1.00 . A A . 32 SER H 1 1 16 11196 1 1 32 SER HA H 3.914 -0.688 4.103 1.00 . A A . 32 SER HA 1 1 16 11197 1 1 32 SER HB2 H 3.482 2.137 5.117 1.00 . A A . 32 SER HB2 1 1 16 11198 1 1 32 SER HB3 H 2.625 0.703 5.676 1.00 . A A . 32 SER HB3 1 1 16 11199 1 1 32 SER HG H 5.200 0.192 5.774 1.00 . A A . 32 SER HG 1 1 16 11200 1 1 32 SER N N 5.045 0.869 3.355 1.00 . A A . 32 SER N 1 1 16 11201 1 1 32 SER O O 2.828 1.393 2.010 1.00 . A A . 32 SER O 1 1 16 11202 1 1 32 SER OG O 4.602 0.814 6.213 1.00 . A A . 32 SER OG 1 1 16 11203 1 1 33 GLY C C -0.761 0.716 3.335 1.00 . A A . 33 GLY C 1 1 16 11204 1 1 33 GLY CA C 0.356 0.245 2.462 1.00 . A A . 33 GLY CA 1 1 16 11205 1 1 33 GLY H H 1.469 -0.546 4.052 1.00 . A A . 33 GLY H 1 1 16 11206 1 1 33 GLY HA2 H 0.568 0.992 1.712 1.00 . A A . 33 GLY HA2 1 1 16 11207 1 1 33 GLY HA3 H 0.066 -0.671 1.970 1.00 . A A . 33 GLY HA3 1 1 16 11208 1 1 33 GLY N N 1.534 0.041 3.258 1.00 . A A . 33 GLY N 1 1 16 11209 1 1 33 GLY O O -1.059 0.086 4.351 1.00 . A A . 33 GLY O 1 1 16 11210 1 1 34 ARG C C -3.673 2.560 3.105 1.00 . A A . 34 ARG C 1 1 16 11211 1 1 34 ARG CA C -2.379 2.389 3.838 1.00 . A A . 34 ARG CA 1 1 16 11212 1 1 34 ARG CB C -1.935 3.720 4.431 1.00 . A A . 34 ARG CB 1 1 16 11213 1 1 34 ARG CD C -0.422 4.868 6.038 1.00 . A A . 34 ARG CD 1 1 16 11214 1 1 34 ARG CG C -0.637 3.641 5.204 1.00 . A A . 34 ARG CG 1 1 16 11215 1 1 34 ARG CZ C -1.271 5.440 8.297 1.00 . A A . 34 ARG CZ 1 1 16 11216 1 1 34 ARG H H -1.159 2.277 2.147 1.00 . A A . 34 ARG H 1 1 16 11217 1 1 34 ARG HA H -2.536 1.697 4.650 1.00 . A A . 34 ARG HA 1 1 16 11218 1 1 34 ARG HB2 H -1.810 4.432 3.627 1.00 . A A . 34 ARG HB2 1 1 16 11219 1 1 34 ARG HB3 H -2.708 4.080 5.094 1.00 . A A . 34 ARG HB3 1 1 16 11220 1 1 34 ARG HD2 H 0.536 4.781 6.527 1.00 . A A . 34 ARG HD2 1 1 16 11221 1 1 34 ARG HD3 H -0.433 5.740 5.400 1.00 . A A . 34 ARG HD3 1 1 16 11222 1 1 34 ARG HE H -2.378 4.740 6.787 1.00 . A A . 34 ARG HE 1 1 16 11223 1 1 34 ARG HG2 H -0.661 2.779 5.853 1.00 . A A . 34 ARG HG2 1 1 16 11224 1 1 34 ARG HG3 H 0.179 3.540 4.504 1.00 . A A . 34 ARG HG3 1 1 16 11225 1 1 34 ARG HH11 H 0.731 5.827 8.072 1.00 . A A . 34 ARG HH11 1 1 16 11226 1 1 34 ARG HH12 H 0.095 6.180 9.616 1.00 . A A . 34 ARG HH12 1 1 16 11227 1 1 34 ARG HH21 H -3.214 5.191 8.886 1.00 . A A . 34 ARG HH21 1 1 16 11228 1 1 34 ARG HH22 H -2.182 5.762 10.102 1.00 . A A . 34 ARG HH22 1 1 16 11229 1 1 34 ARG N N -1.364 1.824 2.994 1.00 . A A . 34 ARG N 1 1 16 11230 1 1 34 ARG NE N -1.468 5.008 7.058 1.00 . A A . 34 ARG NE 1 1 16 11231 1 1 34 ARG NH1 N -0.063 5.838 8.685 1.00 . A A . 34 ARG NH1 1 1 16 11232 1 1 34 ARG NH2 N -2.283 5.479 9.146 1.00 . A A . 34 ARG NH2 1 1 16 11233 1 1 34 ARG O O -3.704 2.962 1.952 1.00 . A A . 34 ARG O 1 1 16 11234 1 1 35 CYS C C -6.581 3.734 3.541 1.00 . A A . 35 CYS C 1 1 16 11235 1 1 35 CYS CA C -6.035 2.371 3.206 1.00 . A A . 35 CYS CA 1 1 16 11236 1 1 35 CYS CB C -6.902 1.273 3.794 1.00 . A A . 35 CYS CB 1 1 16 11237 1 1 35 CYS H H -4.641 1.974 4.703 1.00 . A A . 35 CYS H 1 1 16 11238 1 1 35 CYS HA H -5.985 2.267 2.132 1.00 . A A . 35 CYS HA 1 1 16 11239 1 1 35 CYS HB2 H -7.206 1.551 4.793 1.00 . A A . 35 CYS HB2 1 1 16 11240 1 1 35 CYS HB3 H -7.779 1.139 3.179 1.00 . A A . 35 CYS HB3 1 1 16 11241 1 1 35 CYS N N -4.727 2.271 3.772 1.00 . A A . 35 CYS N 1 1 16 11242 1 1 35 CYS O O -6.749 4.079 4.710 1.00 . A A . 35 CYS O 1 1 16 11243 1 1 35 CYS SG S -6.023 -0.327 3.876 1.00 . A A . 35 CYS SG 1 1 16 11244 1 1 36 ARG C C -8.776 5.937 2.554 1.00 . A A . 36 ARG C 1 1 16 11245 1 1 36 ARG CA C -7.267 5.865 2.732 1.00 . A A . 36 ARG CA 1 1 16 11246 1 1 36 ARG CB C -6.536 6.824 1.808 1.00 . A A . 36 ARG CB 1 1 16 11247 1 1 36 ARG CD C -4.805 7.520 3.501 1.00 . A A . 36 ARG CD 1 1 16 11248 1 1 36 ARG CG C -5.043 6.969 2.107 1.00 . A A . 36 ARG CG 1 1 16 11249 1 1 36 ARG CZ C -2.882 7.835 5.045 1.00 . A A . 36 ARG CZ 1 1 16 11250 1 1 36 ARG H H -6.622 4.189 1.628 1.00 . A A . 36 ARG H 1 1 16 11251 1 1 36 ARG HA H -7.048 6.133 3.755 1.00 . A A . 36 ARG HA 1 1 16 11252 1 1 36 ARG HB2 H -6.637 6.428 0.809 1.00 . A A . 36 ARG HB2 1 1 16 11253 1 1 36 ARG HB3 H -6.999 7.796 1.870 1.00 . A A . 36 ARG HB3 1 1 16 11254 1 1 36 ARG HD2 H -5.304 8.473 3.584 1.00 . A A . 36 ARG HD2 1 1 16 11255 1 1 36 ARG HD3 H -5.217 6.835 4.227 1.00 . A A . 36 ARG HD3 1 1 16 11256 1 1 36 ARG HE H -2.778 7.797 3.021 1.00 . A A . 36 ARG HE 1 1 16 11257 1 1 36 ARG HG2 H -4.585 5.992 2.048 1.00 . A A . 36 ARG HG2 1 1 16 11258 1 1 36 ARG HG3 H -4.594 7.629 1.380 1.00 . A A . 36 ARG HG3 1 1 16 11259 1 1 36 ARG HH11 H -4.672 7.617 6.034 1.00 . A A . 36 ARG HH11 1 1 16 11260 1 1 36 ARG HH12 H -3.338 7.842 7.051 1.00 . A A . 36 ARG HH12 1 1 16 11261 1 1 36 ARG HH21 H -0.959 8.081 4.426 1.00 . A A . 36 ARG HH21 1 1 16 11262 1 1 36 ARG HH22 H -1.180 8.130 6.130 1.00 . A A . 36 ARG HH22 1 1 16 11263 1 1 36 ARG N N -6.789 4.525 2.539 1.00 . A A . 36 ARG N 1 1 16 11264 1 1 36 ARG NE N -3.381 7.721 3.803 1.00 . A A . 36 ARG NE 1 1 16 11265 1 1 36 ARG NH1 N -3.682 7.760 6.111 1.00 . A A . 36 ARG NH1 1 1 16 11266 1 1 36 ARG NH2 N -1.590 8.023 5.220 1.00 . A A . 36 ARG NH2 1 1 16 11267 1 1 36 ARG O O -9.414 4.919 2.283 1.00 . A A . 36 ARG O 1 1 16 11268 1 1 37 ASP C C -11.462 6.831 1.431 1.00 . A A . 37 ASP C 1 1 16 11269 1 1 37 ASP CA C -10.789 7.421 2.653 1.00 . A A . 37 ASP CA 1 1 16 11270 1 1 37 ASP CB C -11.056 8.928 2.665 1.00 . A A . 37 ASP CB 1 1 16 11271 1 1 37 ASP CG C -10.536 9.635 3.887 1.00 . A A . 37 ASP CG 1 1 16 11272 1 1 37 ASP H H -8.722 7.900 2.848 1.00 . A A . 37 ASP H 1 1 16 11273 1 1 37 ASP HA H -11.237 6.993 3.535 1.00 . A A . 37 ASP HA 1 1 16 11274 1 1 37 ASP HB2 H -10.595 9.376 1.799 1.00 . A A . 37 ASP HB2 1 1 16 11275 1 1 37 ASP HB3 H -12.123 9.083 2.605 1.00 . A A . 37 ASP HB3 1 1 16 11276 1 1 37 ASP N N -9.326 7.140 2.697 1.00 . A A . 37 ASP N 1 1 16 11277 1 1 37 ASP O O -12.578 6.319 1.504 1.00 . A A . 37 ASP O 1 1 16 11278 1 1 37 ASP OD1 O -11.263 9.739 4.885 1.00 . A A . 37 ASP OD1 1 1 16 11279 1 1 37 ASP OD2 O -9.393 10.123 3.870 1.00 . A A . 37 ASP OD2 1 1 16 11280 1 1 38 ASP C C -11.377 4.822 -0.970 1.00 . A A . 38 ASP C 1 1 16 11281 1 1 38 ASP CA C -11.273 6.343 -0.970 1.00 . A A . 38 ASP CA 1 1 16 11282 1 1 38 ASP CB C -10.317 6.706 -2.101 1.00 . A A . 38 ASP CB 1 1 16 11283 1 1 38 ASP CG C -10.242 8.168 -2.428 1.00 . A A . 38 ASP CG 1 1 16 11284 1 1 38 ASP H H -9.889 7.303 0.361 1.00 . A A . 38 ASP H 1 1 16 11285 1 1 38 ASP HA H -12.234 6.784 -1.187 1.00 . A A . 38 ASP HA 1 1 16 11286 1 1 38 ASP HB2 H -9.331 6.371 -1.823 1.00 . A A . 38 ASP HB2 1 1 16 11287 1 1 38 ASP HB3 H -10.624 6.167 -2.986 1.00 . A A . 38 ASP HB3 1 1 16 11288 1 1 38 ASP N N -10.769 6.872 0.317 1.00 . A A . 38 ASP N 1 1 16 11289 1 1 38 ASP O O -11.747 4.232 -1.981 1.00 . A A . 38 ASP O 1 1 16 11290 1 1 38 ASP OD1 O -10.764 8.564 -3.472 1.00 . A A . 38 ASP OD1 1 1 16 11291 1 1 38 ASP OD2 O -9.619 8.933 -1.679 1.00 . A A . 38 ASP OD2 1 1 16 11292 1 1 39 PHE C C -9.711 2.206 -0.522 1.00 . A A . 39 PHE C 1 1 16 11293 1 1 39 PHE CA C -10.879 2.722 0.297 1.00 . A A . 39 PHE CA 1 1 16 11294 1 1 39 PHE CB C -12.180 1.973 -0.080 1.00 . A A . 39 PHE CB 1 1 16 11295 1 1 39 PHE CD1 C -13.567 1.613 1.973 1.00 . A A . 39 PHE CD1 1 1 16 11296 1 1 39 PHE CD2 C -14.286 3.247 0.403 1.00 . A A . 39 PHE CD2 1 1 16 11297 1 1 39 PHE CE1 C -14.660 1.891 2.769 1.00 . A A . 39 PHE CE1 1 1 16 11298 1 1 39 PHE CE2 C -15.383 3.531 1.194 1.00 . A A . 39 PHE CE2 1 1 16 11299 1 1 39 PHE CG C -13.367 2.288 0.785 1.00 . A A . 39 PHE CG 1 1 16 11300 1 1 39 PHE CZ C -15.570 2.851 2.379 1.00 . A A . 39 PHE CZ 1 1 16 11301 1 1 39 PHE H H -10.726 4.731 0.928 1.00 . A A . 39 PHE H 1 1 16 11302 1 1 39 PHE HA H -10.643 2.541 1.336 1.00 . A A . 39 PHE HA 1 1 16 11303 1 1 39 PHE HB2 H -12.445 2.230 -1.094 1.00 . A A . 39 PHE HB2 1 1 16 11304 1 1 39 PHE HB3 H -11.998 0.909 -0.028 1.00 . A A . 39 PHE HB3 1 1 16 11305 1 1 39 PHE HD1 H -12.853 0.861 2.274 1.00 . A A . 39 PHE HD1 1 1 16 11306 1 1 39 PHE HD2 H -14.137 3.776 -0.527 1.00 . A A . 39 PHE HD2 1 1 16 11307 1 1 39 PHE HE1 H -14.804 1.355 3.697 1.00 . A A . 39 PHE HE1 1 1 16 11308 1 1 39 PHE HE2 H -16.095 4.283 0.886 1.00 . A A . 39 PHE HE2 1 1 16 11309 1 1 39 PHE HZ H -16.426 3.070 3.001 1.00 . A A . 39 PHE HZ 1 1 16 11310 1 1 39 PHE N N -10.976 4.191 0.144 1.00 . A A . 39 PHE N 1 1 16 11311 1 1 39 PHE O O -9.469 1.015 -0.617 1.00 . A A . 39 PHE O 1 1 16 11312 1 1 40 ARG C C -6.603 2.728 -1.147 1.00 . A A . 40 ARG C 1 1 16 11313 1 1 40 ARG CA C -7.864 2.832 -1.918 1.00 . A A . 40 ARG CA 1 1 16 11314 1 1 40 ARG CB C -7.716 3.855 -3.032 1.00 . A A . 40 ARG CB 1 1 16 11315 1 1 40 ARG CD C -8.428 4.570 -5.336 1.00 . A A . 40 ARG CD 1 1 16 11316 1 1 40 ARG CG C -8.655 3.621 -4.170 1.00 . A A . 40 ARG CG 1 1 16 11317 1 1 40 ARG CZ C -8.895 6.908 -6.010 1.00 . A A . 40 ARG CZ 1 1 16 11318 1 1 40 ARG H H -9.203 4.057 -0.867 1.00 . A A . 40 ARG H 1 1 16 11319 1 1 40 ARG HA H -8.059 1.873 -2.376 1.00 . A A . 40 ARG HA 1 1 16 11320 1 1 40 ARG HB2 H -7.895 4.842 -2.633 1.00 . A A . 40 ARG HB2 1 1 16 11321 1 1 40 ARG HB3 H -6.705 3.801 -3.406 1.00 . A A . 40 ARG HB3 1 1 16 11322 1 1 40 ARG HD2 H -7.373 4.586 -5.567 1.00 . A A . 40 ARG HD2 1 1 16 11323 1 1 40 ARG HD3 H -8.968 4.193 -6.191 1.00 . A A . 40 ARG HD3 1 1 16 11324 1 1 40 ARG HE H -9.199 6.122 -4.171 1.00 . A A . 40 ARG HE 1 1 16 11325 1 1 40 ARG HG2 H -8.442 2.618 -4.495 1.00 . A A . 40 ARG HG2 1 1 16 11326 1 1 40 ARG HG3 H -9.672 3.704 -3.821 1.00 . A A . 40 ARG HG3 1 1 16 11327 1 1 40 ARG HH11 H -8.005 5.795 -7.498 1.00 . A A . 40 ARG HH11 1 1 16 11328 1 1 40 ARG HH12 H -8.426 7.362 -7.963 1.00 . A A . 40 ARG HH12 1 1 16 11329 1 1 40 ARG HH21 H -9.824 8.317 -4.829 1.00 . A A . 40 ARG HH21 1 1 16 11330 1 1 40 ARG HH22 H -9.478 8.809 -6.422 1.00 . A A . 40 ARG HH22 1 1 16 11331 1 1 40 ARG N N -8.973 3.130 -1.076 1.00 . A A . 40 ARG N 1 1 16 11332 1 1 40 ARG NE N -8.864 5.945 -5.075 1.00 . A A . 40 ARG NE 1 1 16 11333 1 1 40 ARG NH1 N -8.408 6.675 -7.231 1.00 . A A . 40 ARG NH1 1 1 16 11334 1 1 40 ARG NH2 N -9.424 8.085 -5.729 1.00 . A A . 40 ARG NH2 1 1 16 11335 1 1 40 ARG O O -6.428 3.401 -0.113 1.00 . A A . 40 ARG O 1 1 16 11336 1 1 41 CYS C C -3.495 2.744 -1.507 1.00 . A A . 41 CYS C 1 1 16 11337 1 1 41 CYS CA C -4.461 1.701 -1.045 1.00 . A A . 41 CYS CA 1 1 16 11338 1 1 41 CYS CB C -3.926 0.309 -1.328 1.00 . A A . 41 CYS CB 1 1 16 11339 1 1 41 CYS H H -5.953 1.367 -2.434 1.00 . A A . 41 CYS H 1 1 16 11340 1 1 41 CYS HA H -4.581 1.800 0.023 1.00 . A A . 41 CYS HA 1 1 16 11341 1 1 41 CYS HB2 H -4.061 0.078 -2.373 1.00 . A A . 41 CYS HB2 1 1 16 11342 1 1 41 CYS HB3 H -2.873 0.262 -1.093 1.00 . A A . 41 CYS HB3 1 1 16 11343 1 1 41 CYS N N -5.741 1.892 -1.630 1.00 . A A . 41 CYS N 1 1 16 11344 1 1 41 CYS O O -3.134 2.810 -2.678 1.00 . A A . 41 CYS O 1 1 16 11345 1 1 41 CYS SG S -4.744 -0.982 -0.377 1.00 . A A . 41 CYS SG 1 1 16 11346 1 1 42 TRP C C -0.930 4.078 -0.075 1.00 . A A . 42 TRP C 1 1 16 11347 1 1 42 TRP CA C -2.152 4.570 -0.804 1.00 . A A . 42 TRP CA 1 1 16 11348 1 1 42 TRP CB C -2.610 5.915 -0.261 1.00 . A A . 42 TRP CB 1 1 16 11349 1 1 42 TRP CD1 C -2.038 7.762 -1.932 1.00 . A A . 42 TRP CD1 1 1 16 11350 1 1 42 TRP CD2 C -4.220 7.287 -1.847 1.00 . A A . 42 TRP CD2 1 1 16 11351 1 1 42 TRP CE2 C -4.012 8.325 -2.779 1.00 . A A . 42 TRP CE2 1 1 16 11352 1 1 42 TRP CE3 C -5.528 6.828 -1.639 1.00 . A A . 42 TRP CE3 1 1 16 11353 1 1 42 TRP CG C -2.927 6.942 -1.311 1.00 . A A . 42 TRP CG 1 1 16 11354 1 1 42 TRP CH2 C -6.310 8.446 -3.259 1.00 . A A . 42 TRP CH2 1 1 16 11355 1 1 42 TRP CZ2 C -5.051 8.910 -3.488 1.00 . A A . 42 TRP CZ2 1 1 16 11356 1 1 42 TRP CZ3 C -6.554 7.417 -2.351 1.00 . A A . 42 TRP CZ3 1 1 16 11357 1 1 42 TRP H H -3.550 3.522 0.289 1.00 . A A . 42 TRP H 1 1 16 11358 1 1 42 TRP HA H -1.940 4.644 -1.861 1.00 . A A . 42 TRP HA 1 1 16 11359 1 1 42 TRP HB2 H -3.512 5.755 0.311 1.00 . A A . 42 TRP HB2 1 1 16 11360 1 1 42 TRP HB3 H -1.849 6.315 0.393 1.00 . A A . 42 TRP HB3 1 1 16 11361 1 1 42 TRP HD1 H -0.971 7.758 -1.757 1.00 . A A . 42 TRP HD1 1 1 16 11362 1 1 42 TRP HE1 H -2.227 9.257 -3.368 1.00 . A A . 42 TRP HE1 1 1 16 11363 1 1 42 TRP HE3 H -5.754 6.019 -0.960 1.00 . A A . 42 TRP HE3 1 1 16 11364 1 1 42 TRP HH2 H -7.144 8.877 -3.794 1.00 . A A . 42 TRP HH2 1 1 16 11365 1 1 42 TRP HZ2 H -4.884 9.710 -4.195 1.00 . A A . 42 TRP HZ2 1 1 16 11366 1 1 42 TRP HZ3 H -7.570 7.089 -2.204 1.00 . A A . 42 TRP HZ3 1 1 16 11367 1 1 42 TRP N N -3.145 3.586 -0.607 1.00 . A A . 42 TRP N 1 1 16 11368 1 1 42 TRP NE1 N -2.679 8.587 -2.810 1.00 . A A . 42 TRP NE1 1 1 16 11369 1 1 42 TRP O O -0.887 4.055 1.160 1.00 . A A . 42 TRP O 1 1 16 11370 1 1 43 CYS C C 2.348 3.940 -0.349 1.00 . A A . 43 CYS C 1 1 16 11371 1 1 43 CYS CA C 1.172 3.012 -0.271 1.00 . A A . 43 CYS CA 1 1 16 11372 1 1 43 CYS CB C 1.456 1.698 -0.992 1.00 . A A . 43 CYS CB 1 1 16 11373 1 1 43 CYS H H -0.055 3.737 -1.791 1.00 . A A . 43 CYS H 1 1 16 11374 1 1 43 CYS HA H 0.969 2.788 0.766 1.00 . A A . 43 CYS HA 1 1 16 11375 1 1 43 CYS HB2 H 1.611 1.896 -2.043 1.00 . A A . 43 CYS HB2 1 1 16 11376 1 1 43 CYS HB3 H 2.345 1.252 -0.574 1.00 . A A . 43 CYS HB3 1 1 16 11377 1 1 43 CYS N N 0.009 3.624 -0.816 1.00 . A A . 43 CYS N 1 1 16 11378 1 1 43 CYS O O 2.547 4.637 -1.344 1.00 . A A . 43 CYS O 1 1 16 11379 1 1 43 CYS SG S 0.095 0.489 -0.840 1.00 . A A . 43 CYS SG 1 1 16 11380 1 1 44 THR C C 5.450 4.111 0.169 1.00 . A A . 44 THR C 1 1 16 11381 1 1 44 THR CA C 4.244 4.800 0.777 1.00 . A A . 44 THR CA 1 1 16 11382 1 1 44 THR CB C 4.528 5.140 2.235 1.00 . A A . 44 THR CB 1 1 16 11383 1 1 44 THR CG2 C 5.655 6.145 2.336 1.00 . A A . 44 THR CG2 1 1 16 11384 1 1 44 THR H H 2.891 3.373 1.447 1.00 . A A . 44 THR H 1 1 16 11385 1 1 44 THR HA H 4.055 5.718 0.243 1.00 . A A . 44 THR HA 1 1 16 11386 1 1 44 THR HB H 4.806 4.237 2.757 1.00 . A A . 44 THR HB 1 1 16 11387 1 1 44 THR HG1 H 3.290 6.626 2.617 1.00 . A A . 44 THR HG1 1 1 16 11388 1 1 44 THR HG21 H 5.853 6.370 3.372 1.00 . A A . 44 THR HG21 1 1 16 11389 1 1 44 THR HG22 H 5.381 7.048 1.811 1.00 . A A . 44 THR HG22 1 1 16 11390 1 1 44 THR HG23 H 6.544 5.728 1.885 1.00 . A A . 44 THR HG23 1 1 16 11391 1 1 44 THR N N 3.106 3.961 0.692 1.00 . A A . 44 THR N 1 1 16 11392 1 1 44 THR O O 5.833 3.017 0.588 1.00 . A A . 44 THR O 1 1 16 11393 1 1 44 THR OG1 O 3.340 5.685 2.828 1.00 . A A . 44 THR OG1 1 1 16 11394 1 1 45 LYS C C 8.377 5.110 -1.027 1.00 . A A . 45 LYS C 1 1 16 11395 1 1 45 LYS CA C 7.205 4.245 -1.438 1.00 . A A . 45 LYS CA 1 1 16 11396 1 1 45 LYS CB C 7.033 4.243 -2.970 1.00 . A A . 45 LYS CB 1 1 16 11397 1 1 45 LYS CD C 6.648 5.518 -5.096 1.00 . A A . 45 LYS CD 1 1 16 11398 1 1 45 LYS CE C 6.404 6.888 -5.705 1.00 . A A . 45 LYS CE 1 1 16 11399 1 1 45 LYS CG C 6.761 5.605 -3.587 1.00 . A A . 45 LYS CG 1 1 16 11400 1 1 45 LYS H H 5.658 5.604 -1.097 1.00 . A A . 45 LYS H 1 1 16 11401 1 1 45 LYS HA H 7.374 3.235 -1.095 1.00 . A A . 45 LYS HA 1 1 16 11402 1 1 45 LYS HB2 H 7.931 3.852 -3.422 1.00 . A A . 45 LYS HB2 1 1 16 11403 1 1 45 LYS HB3 H 6.207 3.592 -3.219 1.00 . A A . 45 LYS HB3 1 1 16 11404 1 1 45 LYS HD2 H 7.568 5.117 -5.492 1.00 . A A . 45 LYS HD2 1 1 16 11405 1 1 45 LYS HD3 H 5.827 4.866 -5.353 1.00 . A A . 45 LYS HD3 1 1 16 11406 1 1 45 LYS HE2 H 5.457 7.262 -5.349 1.00 . A A . 45 LYS HE2 1 1 16 11407 1 1 45 LYS HE3 H 7.194 7.552 -5.384 1.00 . A A . 45 LYS HE3 1 1 16 11408 1 1 45 LYS HG2 H 5.836 5.992 -3.187 1.00 . A A . 45 LYS HG2 1 1 16 11409 1 1 45 LYS HG3 H 7.573 6.268 -3.331 1.00 . A A . 45 LYS HG3 1 1 16 11410 1 1 45 LYS HZ1 H 5.599 6.264 -7.547 1.00 . A A . 45 LYS HZ1 1 1 16 11411 1 1 45 LYS HZ2 H 7.264 6.457 -7.551 1.00 . A A . 45 LYS HZ2 1 1 16 11412 1 1 45 LYS HZ3 H 6.264 7.819 -7.553 1.00 . A A . 45 LYS HZ3 1 1 16 11413 1 1 45 LYS N N 6.035 4.744 -0.796 1.00 . A A . 45 LYS N 1 1 16 11414 1 1 45 LYS NZ N 6.374 6.853 -7.183 1.00 . A A . 45 LYS NZ 1 1 16 11415 1 1 45 LYS O O 8.213 6.316 -0.757 1.00 . A A . 45 LYS O 1 1 16 11416 1 1 46 ASN C C 11.333 5.840 -1.756 1.00 . A A . 46 ASN C 1 1 16 11417 1 1 46 ASN CA C 10.709 5.216 -0.533 1.00 . A A . 46 ASN CA 1 1 16 11418 1 1 46 ASN CB C 11.721 4.310 0.193 1.00 . A A . 46 ASN CB 1 1 16 11419 1 1 46 ASN CG C 11.206 3.737 1.509 1.00 . A A . 46 ASN CG 1 1 16 11420 1 1 46 ASN H H 9.582 3.548 -1.123 1.00 . A A . 46 ASN H 1 1 16 11421 1 1 46 ASN HA H 10.405 6.010 0.132 1.00 . A A . 46 ASN HA 1 1 16 11422 1 1 46 ASN HB2 H 11.967 3.480 -0.451 1.00 . A A . 46 ASN HB2 1 1 16 11423 1 1 46 ASN HB3 H 12.616 4.877 0.396 1.00 . A A . 46 ASN HB3 1 1 16 11424 1 1 46 ASN HD21 H 10.622 2.093 0.586 1.00 . A A . 46 ASN HD21 1 1 16 11425 1 1 46 ASN HD22 H 10.340 2.112 2.287 1.00 . A A . 46 ASN HD22 1 1 16 11426 1 1 46 ASN N N 9.521 4.506 -0.917 1.00 . A A . 46 ASN N 1 1 16 11427 1 1 46 ASN ND2 N 10.662 2.538 1.464 1.00 . A A . 46 ASN ND2 1 1 16 11428 1 1 46 ASN O O 11.711 5.145 -2.714 1.00 . A A . 46 ASN O 1 1 16 11429 1 1 46 ASN OD1 O 11.335 4.361 2.573 1.00 . A A . 46 ASN OD1 1 1 16 11430 1 1 47 CYS C C 13.248 8.478 -2.338 1.00 . A A . 47 CYS C 1 1 16 11431 1 1 47 CYS CA C 11.917 7.918 -2.805 1.00 . A A . 47 CYS CA 1 1 16 11432 1 1 47 CYS CB C 10.944 9.058 -3.140 1.00 . A A . 47 CYS CB 1 1 16 11433 1 1 47 CYS H H 11.067 7.628 -0.957 1.00 . A A . 47 CYS H 1 1 16 11434 1 1 47 CYS HA H 12.057 7.292 -3.674 1.00 . A A . 47 CYS HA 1 1 16 11435 1 1 47 CYS HB2 H 10.855 9.708 -2.282 1.00 . A A . 47 CYS HB2 1 1 16 11436 1 1 47 CYS HB3 H 11.320 9.619 -3.982 1.00 . A A . 47 CYS HB3 1 1 16 11437 1 1 47 CYS N N 11.385 7.128 -1.742 1.00 . A A . 47 CYS N 1 1 16 11438 1 1 47 CYS O O 14.294 8.051 -2.833 1.00 . A A . 47 CYS O 1 1 16 11439 1 1 47 CYS OXT O 13.261 9.277 -1.376 1.00 . A A . 47 CYS OXT 1 1 16 11440 1 1 47 CYS SG S 9.247 8.512 -3.552 1.00 . A A . 47 CYS SG 1 1 17 11441 1 1 1 LYS C C 11.037 10.014 0.441 1.00 . A A . 1 LYS C 1 1 17 11442 1 1 1 LYS CA C 11.980 11.192 0.436 1.00 . A A . 1 LYS CA 1 1 17 11443 1 1 1 LYS CB C 11.296 12.402 -0.257 1.00 . A A . 1 LYS CB 1 1 17 11444 1 1 1 LYS CD C 10.419 13.608 1.814 1.00 . A A . 1 LYS CD 1 1 17 11445 1 1 1 LYS CE C 11.288 14.850 1.649 1.00 . A A . 1 LYS CE 1 1 17 11446 1 1 1 LYS CG C 10.068 12.971 0.466 1.00 . A A . 1 LYS CG 1 1 17 11447 1 1 1 LYS H1 H 13.862 11.581 -0.328 1.00 . A A . 1 LYS H1 1 1 17 11448 1 1 1 LYS H2 H 12.862 10.590 -1.291 1.00 . A A . 1 LYS H2 1 1 17 11449 1 1 1 LYS H3 H 13.581 9.961 0.111 1.00 . A A . 1 LYS H3 1 1 17 11450 1 1 1 LYS HA H 12.254 11.458 1.445 1.00 . A A . 1 LYS HA 1 1 17 11451 1 1 1 LYS HB2 H 12.016 13.197 -0.373 1.00 . A A . 1 LYS HB2 1 1 17 11452 1 1 1 LYS HB3 H 10.986 12.087 -1.242 1.00 . A A . 1 LYS HB3 1 1 17 11453 1 1 1 LYS HD2 H 9.506 13.893 2.315 1.00 . A A . 1 LYS HD2 1 1 17 11454 1 1 1 LYS HD3 H 10.947 12.885 2.419 1.00 . A A . 1 LYS HD3 1 1 17 11455 1 1 1 LYS HE2 H 11.497 15.261 2.625 1.00 . A A . 1 LYS HE2 1 1 17 11456 1 1 1 LYS HE3 H 12.217 14.574 1.175 1.00 . A A . 1 LYS HE3 1 1 17 11457 1 1 1 LYS HG2 H 9.609 13.722 -0.160 1.00 . A A . 1 LYS HG2 1 1 17 11458 1 1 1 LYS HG3 H 9.364 12.169 0.631 1.00 . A A . 1 LYS HG3 1 1 17 11459 1 1 1 LYS HZ1 H 11.225 16.721 0.733 1.00 . A A . 1 LYS HZ1 1 1 17 11460 1 1 1 LYS HZ2 H 9.720 16.180 1.261 1.00 . A A . 1 LYS HZ2 1 1 17 11461 1 1 1 LYS HZ3 H 10.404 15.538 -0.123 1.00 . A A . 1 LYS HZ3 1 1 17 11462 1 1 1 LYS N N 13.165 10.813 -0.315 1.00 . A A . 1 LYS N 1 1 17 11463 1 1 1 LYS NZ N 10.619 15.881 0.834 1.00 . A A . 1 LYS NZ 1 1 17 11464 1 1 1 LYS O O 11.125 9.164 -0.416 1.00 . A A . 1 LYS O 1 1 17 11465 1 1 2 THR C C 7.862 9.652 1.088 1.00 . A A . 2 THR C 1 1 17 11466 1 1 2 THR CA C 9.164 8.953 1.409 1.00 . A A . 2 THR CA 1 1 17 11467 1 1 2 THR CB C 9.075 8.184 2.728 1.00 . A A . 2 THR CB 1 1 17 11468 1 1 2 THR CG2 C 10.029 7.012 2.736 1.00 . A A . 2 THR CG2 1 1 17 11469 1 1 2 THR H H 10.296 10.481 2.226 1.00 . A A . 2 THR H 1 1 17 11470 1 1 2 THR HA H 9.381 8.261 0.609 1.00 . A A . 2 THR HA 1 1 17 11471 1 1 2 THR HB H 8.063 7.820 2.830 1.00 . A A . 2 THR HB 1 1 17 11472 1 1 2 THR HG1 H 10.326 9.088 3.947 1.00 . A A . 2 THR HG1 1 1 17 11473 1 1 2 THR HG21 H 11.035 7.387 2.623 1.00 . A A . 2 THR HG21 1 1 17 11474 1 1 2 THR HG22 H 9.796 6.353 1.913 1.00 . A A . 2 THR HG22 1 1 17 11475 1 1 2 THR HG23 H 9.944 6.478 3.671 1.00 . A A . 2 THR HG23 1 1 17 11476 1 1 2 THR N N 10.211 9.914 1.429 1.00 . A A . 2 THR N 1 1 17 11477 1 1 2 THR O O 7.574 10.733 1.623 1.00 . A A . 2 THR O 1 1 17 11478 1 1 2 THR OG1 O 9.366 9.068 3.831 1.00 . A A . 2 THR OG1 1 1 17 11479 1 1 3 CYS C C 4.854 8.582 -0.422 1.00 . A A . 3 CYS C 1 1 17 11480 1 1 3 CYS CA C 5.882 9.669 -0.232 1.00 . A A . 3 CYS CA 1 1 17 11481 1 1 3 CYS CB C 6.109 10.472 -1.520 1.00 . A A . 3 CYS CB 1 1 17 11482 1 1 3 CYS H H 7.395 8.237 -0.210 1.00 . A A . 3 CYS H 1 1 17 11483 1 1 3 CYS HA H 5.545 10.341 0.542 1.00 . A A . 3 CYS HA 1 1 17 11484 1 1 3 CYS HB2 H 5.155 10.743 -1.945 1.00 . A A . 3 CYS HB2 1 1 17 11485 1 1 3 CYS HB3 H 6.664 11.370 -1.288 1.00 . A A . 3 CYS HB3 1 1 17 11486 1 1 3 CYS N N 7.120 9.091 0.197 1.00 . A A . 3 CYS N 1 1 17 11487 1 1 3 CYS O O 5.197 7.447 -0.735 1.00 . A A . 3 CYS O 1 1 17 11488 1 1 3 CYS SG S 7.037 9.575 -2.812 1.00 . A A . 3 CYS SG 1 1 17 11489 1 1 4 GLU C C 1.925 8.092 -1.681 1.00 . A A . 4 GLU C 1 1 17 11490 1 1 4 GLU CA C 2.576 7.935 -0.316 1.00 . A A . 4 GLU CA 1 1 17 11491 1 1 4 GLU CB C 1.566 8.116 0.813 1.00 . A A . 4 GLU CB 1 1 17 11492 1 1 4 GLU CD C -0.411 7.209 2.045 1.00 . A A . 4 GLU CD 1 1 17 11493 1 1 4 GLU CG C 0.504 7.051 0.864 1.00 . A A . 4 GLU CG 1 1 17 11494 1 1 4 GLU H H 3.391 9.810 0.072 1.00 . A A . 4 GLU H 1 1 17 11495 1 1 4 GLU HA H 3.010 6.948 -0.252 1.00 . A A . 4 GLU HA 1 1 17 11496 1 1 4 GLU HB2 H 2.087 8.119 1.758 1.00 . A A . 4 GLU HB2 1 1 17 11497 1 1 4 GLU HB3 H 1.076 9.070 0.679 1.00 . A A . 4 GLU HB3 1 1 17 11498 1 1 4 GLU HG2 H -0.073 7.139 -0.043 1.00 . A A . 4 GLU HG2 1 1 17 11499 1 1 4 GLU HG3 H 0.976 6.080 0.903 1.00 . A A . 4 GLU HG3 1 1 17 11500 1 1 4 GLU N N 3.624 8.894 -0.186 1.00 . A A . 4 GLU N 1 1 17 11501 1 1 4 GLU O O 1.672 9.213 -2.124 1.00 . A A . 4 GLU O 1 1 17 11502 1 1 4 GLU OE1 O -0.032 6.806 3.149 1.00 . A A . 4 GLU OE1 1 1 17 11503 1 1 4 GLU OE2 O -1.521 7.748 1.900 1.00 . A A . 4 GLU OE2 1 1 17 11504 1 1 5 ASN C C 0.399 5.678 -3.928 1.00 . A A . 5 ASN C 1 1 17 11505 1 1 5 ASN CA C 1.110 6.998 -3.676 1.00 . A A . 5 ASN CA 1 1 17 11506 1 1 5 ASN CB C 2.172 7.300 -4.760 1.00 . A A . 5 ASN CB 1 1 17 11507 1 1 5 ASN CG C 1.619 7.289 -6.176 1.00 . A A . 5 ASN CG 1 1 17 11508 1 1 5 ASN H H 1.964 6.120 -1.965 1.00 . A A . 5 ASN H 1 1 17 11509 1 1 5 ASN HA H 0.368 7.783 -3.682 1.00 . A A . 5 ASN HA 1 1 17 11510 1 1 5 ASN HB2 H 2.597 8.276 -4.574 1.00 . A A . 5 ASN HB2 1 1 17 11511 1 1 5 ASN HB3 H 2.959 6.563 -4.692 1.00 . A A . 5 ASN HB3 1 1 17 11512 1 1 5 ASN HD21 H 1.019 9.162 -5.987 1.00 . A A . 5 ASN HD21 1 1 17 11513 1 1 5 ASN HD22 H 0.671 8.413 -7.504 1.00 . A A . 5 ASN HD22 1 1 17 11514 1 1 5 ASN N N 1.714 6.989 -2.358 1.00 . A A . 5 ASN N 1 1 17 11515 1 1 5 ASN ND2 N 1.054 8.391 -6.599 1.00 . A A . 5 ASN ND2 1 1 17 11516 1 1 5 ASN O O 0.751 4.661 -3.331 1.00 . A A . 5 ASN O 1 1 17 11517 1 1 5 ASN OD1 O 1.680 6.281 -6.869 1.00 . A A . 5 ASN OD1 1 1 17 11518 1 1 6 LEU C C -0.689 3.363 -5.616 1.00 . A A . 6 LEU C 1 1 17 11519 1 1 6 LEU CA C -1.443 4.573 -5.111 1.00 . A A . 6 LEU CA 1 1 17 11520 1 1 6 LEU CB C -2.506 4.971 -6.122 1.00 . A A . 6 LEU CB 1 1 17 11521 1 1 6 LEU CD1 C -4.526 6.282 -6.680 1.00 . A A . 6 LEU CD1 1 1 17 11522 1 1 6 LEU CD2 C -4.522 4.855 -4.702 1.00 . A A . 6 LEU CD2 1 1 17 11523 1 1 6 LEU CG C -3.679 5.755 -5.566 1.00 . A A . 6 LEU CG 1 1 17 11524 1 1 6 LEU H H -0.802 6.565 -5.225 1.00 . A A . 6 LEU H 1 1 17 11525 1 1 6 LEU HA H -1.957 4.286 -4.209 1.00 . A A . 6 LEU HA 1 1 17 11526 1 1 6 LEU HB2 H -2.033 5.569 -6.887 1.00 . A A . 6 LEU HB2 1 1 17 11527 1 1 6 LEU HB3 H -2.889 4.072 -6.581 1.00 . A A . 6 LEU HB3 1 1 17 11528 1 1 6 LEU HD11 H -3.947 6.946 -7.303 1.00 . A A . 6 LEU HD11 1 1 17 11529 1 1 6 LEU HD12 H -5.361 6.804 -6.237 1.00 . A A . 6 LEU HD12 1 1 17 11530 1 1 6 LEU HD13 H -4.884 5.443 -7.258 1.00 . A A . 6 LEU HD13 1 1 17 11531 1 1 6 LEU HD21 H -5.371 5.410 -4.332 1.00 . A A . 6 LEU HD21 1 1 17 11532 1 1 6 LEU HD22 H -3.943 4.499 -3.863 1.00 . A A . 6 LEU HD22 1 1 17 11533 1 1 6 LEU HD23 H -4.871 4.015 -5.284 1.00 . A A . 6 LEU HD23 1 1 17 11534 1 1 6 LEU HG H -3.334 6.575 -4.956 1.00 . A A . 6 LEU HG 1 1 17 11535 1 1 6 LEU N N -0.606 5.717 -4.777 1.00 . A A . 6 LEU N 1 1 17 11536 1 1 6 LEU O O 0.325 3.465 -6.328 1.00 . A A . 6 LEU O 1 1 17 11537 1 1 7 ALA C C -1.361 0.578 -6.939 1.00 . A A . 7 ALA C 1 1 17 11538 1 1 7 ALA CA C -0.672 0.965 -5.657 1.00 . A A . 7 ALA CA 1 1 17 11539 1 1 7 ALA CB C -0.929 -0.085 -4.609 1.00 . A A . 7 ALA CB 1 1 17 11540 1 1 7 ALA H H -1.941 2.238 -4.595 1.00 . A A . 7 ALA H 1 1 17 11541 1 1 7 ALA HA H 0.393 1.054 -5.812 1.00 . A A . 7 ALA HA 1 1 17 11542 1 1 7 ALA HB1 H -0.426 0.191 -3.695 1.00 . A A . 7 ALA HB1 1 1 17 11543 1 1 7 ALA HB2 H -0.567 -1.042 -4.956 1.00 . A A . 7 ALA HB2 1 1 17 11544 1 1 7 ALA HB3 H -1.993 -0.137 -4.430 1.00 . A A . 7 ALA HB3 1 1 17 11545 1 1 7 ALA N N -1.184 2.225 -5.222 1.00 . A A . 7 ALA N 1 1 17 11546 1 1 7 ALA O O -2.565 0.291 -6.943 1.00 . A A . 7 ALA O 1 1 17 11547 1 1 8 ASP C C -1.489 -1.238 -9.378 1.00 . A A . 8 ASP C 1 1 17 11548 1 1 8 ASP CA C -1.175 0.238 -9.322 1.00 . A A . 8 ASP CA 1 1 17 11549 1 1 8 ASP CB C -0.189 0.590 -10.438 1.00 . A A . 8 ASP CB 1 1 17 11550 1 1 8 ASP CG C -0.691 0.166 -11.804 1.00 . A A . 8 ASP CG 1 1 17 11551 1 1 8 ASP H H 0.320 0.839 -7.934 1.00 . A A . 8 ASP H 1 1 17 11552 1 1 8 ASP HA H -2.085 0.801 -9.469 1.00 . A A . 8 ASP HA 1 1 17 11553 1 1 8 ASP HB2 H -0.029 1.658 -10.448 1.00 . A A . 8 ASP HB2 1 1 17 11554 1 1 8 ASP HB3 H 0.749 0.090 -10.247 1.00 . A A . 8 ASP HB3 1 1 17 11555 1 1 8 ASP N N -0.627 0.587 -8.017 1.00 . A A . 8 ASP N 1 1 17 11556 1 1 8 ASP O O -2.529 -1.653 -9.888 1.00 . A A . 8 ASP O 1 1 17 11557 1 1 8 ASP OD1 O -0.295 -0.906 -12.299 1.00 . A A . 8 ASP OD1 1 1 17 11558 1 1 8 ASP OD2 O -1.492 0.898 -12.406 1.00 . A A . 8 ASP OD2 1 1 17 11559 1 1 9 THR C C -1.849 -3.954 -7.928 1.00 . A A . 9 THR C 1 1 17 11560 1 1 9 THR CA C -0.684 -3.441 -8.800 1.00 . A A . 9 THR CA 1 1 17 11561 1 1 9 THR CB C 0.648 -3.970 -8.277 1.00 . A A . 9 THR CB 1 1 17 11562 1 1 9 THR CG2 C 0.806 -5.433 -8.585 1.00 . A A . 9 THR CG2 1 1 17 11563 1 1 9 THR H H 0.166 -1.615 -8.344 1.00 . A A . 9 THR H 1 1 17 11564 1 1 9 THR HA H -0.806 -3.786 -9.815 1.00 . A A . 9 THR HA 1 1 17 11565 1 1 9 THR HB H 0.703 -3.807 -7.210 1.00 . A A . 9 THR HB 1 1 17 11566 1 1 9 THR HG1 H 2.289 -2.892 -8.233 1.00 . A A . 9 THR HG1 1 1 17 11567 1 1 9 THR HG21 H 1.737 -5.781 -8.167 1.00 . A A . 9 THR HG21 1 1 17 11568 1 1 9 THR HG22 H 0.824 -5.547 -9.657 1.00 . A A . 9 THR HG22 1 1 17 11569 1 1 9 THR HG23 H -0.022 -5.984 -8.165 1.00 . A A . 9 THR HG23 1 1 17 11570 1 1 9 THR N N -0.608 -2.010 -8.797 1.00 . A A . 9 THR N 1 1 17 11571 1 1 9 THR O O -2.363 -5.056 -8.143 1.00 . A A . 9 THR O 1 1 17 11572 1 1 9 THR OG1 O 1.711 -3.243 -8.940 1.00 . A A . 9 THR OG1 1 1 17 11573 1 1 10 TYR C C -4.655 -3.387 -6.836 1.00 . A A . 10 TYR C 1 1 17 11574 1 1 10 TYR CA C -3.347 -3.528 -6.095 1.00 . A A . 10 TYR CA 1 1 17 11575 1 1 10 TYR CB C -3.350 -2.654 -4.841 1.00 . A A . 10 TYR CB 1 1 17 11576 1 1 10 TYR CD1 C -5.612 -2.758 -3.697 1.00 . A A . 10 TYR CD1 1 1 17 11577 1 1 10 TYR CD2 C -3.796 -3.964 -2.744 1.00 . A A . 10 TYR CD2 1 1 17 11578 1 1 10 TYR CE1 C -6.434 -3.193 -2.686 1.00 . A A . 10 TYR CE1 1 1 17 11579 1 1 10 TYR CE2 C -4.614 -4.405 -1.734 1.00 . A A . 10 TYR CE2 1 1 17 11580 1 1 10 TYR CG C -4.274 -3.136 -3.743 1.00 . A A . 10 TYR CG 1 1 17 11581 1 1 10 TYR CZ C -5.931 -4.015 -1.710 1.00 . A A . 10 TYR CZ 1 1 17 11582 1 1 10 TYR H H -1.867 -2.262 -6.876 1.00 . A A . 10 TYR H 1 1 17 11583 1 1 10 TYR HA H -3.201 -4.560 -5.814 1.00 . A A . 10 TYR HA 1 1 17 11584 1 1 10 TYR HB2 H -2.350 -2.617 -4.434 1.00 . A A . 10 TYR HB2 1 1 17 11585 1 1 10 TYR HB3 H -3.653 -1.655 -5.117 1.00 . A A . 10 TYR HB3 1 1 17 11586 1 1 10 TYR HD1 H -6.016 -2.113 -4.463 1.00 . A A . 10 TYR HD1 1 1 17 11587 1 1 10 TYR HD2 H -2.759 -4.267 -2.765 1.00 . A A . 10 TYR HD2 1 1 17 11588 1 1 10 TYR HE1 H -7.472 -2.894 -2.668 1.00 . A A . 10 TYR HE1 1 1 17 11589 1 1 10 TYR HE2 H -4.212 -5.053 -0.969 1.00 . A A . 10 TYR HE2 1 1 17 11590 1 1 10 TYR HH H -6.314 -4.247 0.143 1.00 . A A . 10 TYR HH 1 1 17 11591 1 1 10 TYR N N -2.275 -3.146 -6.977 1.00 . A A . 10 TYR N 1 1 17 11592 1 1 10 TYR O O -5.096 -2.268 -7.136 1.00 . A A . 10 TYR O 1 1 17 11593 1 1 10 TYR OH O -6.740 -4.434 -0.699 1.00 . A A . 10 TYR OH 1 1 17 11594 1 1 11 LYS C C -7.672 -4.613 -6.951 1.00 . A A . 11 LYS C 1 1 17 11595 1 1 11 LYS CA C -6.477 -4.503 -7.891 1.00 . A A . 11 LYS CA 1 1 17 11596 1 1 11 LYS CB C -6.492 -5.620 -8.952 1.00 . A A . 11 LYS CB 1 1 17 11597 1 1 11 LYS CD C -6.393 -8.056 -9.542 1.00 . A A . 11 LYS CD 1 1 17 11598 1 1 11 LYS CE C -6.222 -9.470 -9.025 1.00 . A A . 11 LYS CE 1 1 17 11599 1 1 11 LYS CG C -6.278 -7.036 -8.424 1.00 . A A . 11 LYS CG 1 1 17 11600 1 1 11 LYS H H -4.814 -5.344 -6.920 1.00 . A A . 11 LYS H 1 1 17 11601 1 1 11 LYS HA H -6.544 -3.554 -8.401 1.00 . A A . 11 LYS HA 1 1 17 11602 1 1 11 LYS HB2 H -7.444 -5.601 -9.460 1.00 . A A . 11 LYS HB2 1 1 17 11603 1 1 11 LYS HB3 H -5.712 -5.409 -9.669 1.00 . A A . 11 LYS HB3 1 1 17 11604 1 1 11 LYS HD2 H -7.369 -7.969 -9.997 1.00 . A A . 11 LYS HD2 1 1 17 11605 1 1 11 LYS HD3 H -5.631 -7.855 -10.281 1.00 . A A . 11 LYS HD3 1 1 17 11606 1 1 11 LYS HE2 H -5.248 -9.564 -8.567 1.00 . A A . 11 LYS HE2 1 1 17 11607 1 1 11 LYS HE3 H -6.980 -9.659 -8.282 1.00 . A A . 11 LYS HE3 1 1 17 11608 1 1 11 LYS HG2 H -5.293 -7.102 -7.986 1.00 . A A . 11 LYS HG2 1 1 17 11609 1 1 11 LYS HG3 H -7.025 -7.245 -7.673 1.00 . A A . 11 LYS HG3 1 1 17 11610 1 1 11 LYS HZ1 H -5.659 -10.288 -10.854 1.00 . A A . 11 LYS HZ1 1 1 17 11611 1 1 11 LYS HZ2 H -7.298 -10.425 -10.530 1.00 . A A . 11 LYS HZ2 1 1 17 11612 1 1 11 LYS HZ3 H -6.197 -11.430 -9.732 1.00 . A A . 11 LYS HZ3 1 1 17 11613 1 1 11 LYS N N -5.239 -4.497 -7.169 1.00 . A A . 11 LYS N 1 1 17 11614 1 1 11 LYS NZ N -6.352 -10.471 -10.100 1.00 . A A . 11 LYS NZ 1 1 17 11615 1 1 11 LYS O O -7.816 -5.593 -6.206 1.00 . A A . 11 LYS O 1 1 17 11616 1 1 12 GLY C C -9.633 -2.669 -4.993 1.00 . A A . 12 GLY C 1 1 17 11617 1 1 12 GLY CA C -9.696 -3.619 -6.168 1.00 . A A . 12 GLY CA 1 1 17 11618 1 1 12 GLY H H -8.275 -2.806 -7.488 1.00 . A A . 12 GLY H 1 1 17 11619 1 1 12 GLY HA2 H -10.531 -3.342 -6.795 1.00 . A A . 12 GLY HA2 1 1 17 11620 1 1 12 GLY HA3 H -9.855 -4.620 -5.796 1.00 . A A . 12 GLY HA3 1 1 17 11621 1 1 12 GLY N N -8.495 -3.603 -6.958 1.00 . A A . 12 GLY N 1 1 17 11622 1 1 12 GLY O O -8.719 -1.825 -4.923 1.00 . A A . 12 GLY O 1 1 17 11623 1 1 13 PRO C C -9.975 -2.616 -1.706 1.00 . A A . 13 PRO C 1 1 17 11624 1 1 13 PRO CA C -10.650 -1.928 -2.889 1.00 . A A . 13 PRO CA 1 1 17 11625 1 1 13 PRO CB C -12.149 -1.790 -2.599 1.00 . A A . 13 PRO CB 1 1 17 11626 1 1 13 PRO CD C -11.783 -3.627 -4.158 1.00 . A A . 13 PRO CD 1 1 17 11627 1 1 13 PRO CG C -12.820 -2.936 -3.303 1.00 . A A . 13 PRO CG 1 1 17 11628 1 1 13 PRO HA H -10.221 -0.950 -3.046 1.00 . A A . 13 PRO HA 1 1 17 11629 1 1 13 PRO HB2 H -12.300 -1.858 -1.530 1.00 . A A . 13 PRO HB2 1 1 17 11630 1 1 13 PRO HB3 H -12.516 -0.836 -2.949 1.00 . A A . 13 PRO HB3 1 1 17 11631 1 1 13 PRO HD2 H -11.550 -4.602 -3.758 1.00 . A A . 13 PRO HD2 1 1 17 11632 1 1 13 PRO HD3 H -12.134 -3.711 -5.177 1.00 . A A . 13 PRO HD3 1 1 17 11633 1 1 13 PRO HG2 H -13.213 -3.630 -2.573 1.00 . A A . 13 PRO HG2 1 1 17 11634 1 1 13 PRO HG3 H -13.625 -2.562 -3.918 1.00 . A A . 13 PRO HG3 1 1 17 11635 1 1 13 PRO N N -10.612 -2.744 -4.083 1.00 . A A . 13 PRO N 1 1 17 11636 1 1 13 PRO O O -9.693 -3.815 -1.734 1.00 . A A . 13 PRO O 1 1 17 11637 1 1 14 CYS C C -10.252 -2.957 1.400 1.00 . A A . 14 CYS C 1 1 17 11638 1 1 14 CYS CA C -9.160 -2.374 0.519 1.00 . A A . 14 CYS CA 1 1 17 11639 1 1 14 CYS CB C -8.397 -1.279 1.269 1.00 . A A . 14 CYS CB 1 1 17 11640 1 1 14 CYS H H -9.925 -0.899 -0.750 1.00 . A A . 14 CYS H 1 1 17 11641 1 1 14 CYS HA H -8.468 -3.159 0.254 1.00 . A A . 14 CYS HA 1 1 17 11642 1 1 14 CYS HB2 H -7.545 -0.983 0.672 1.00 . A A . 14 CYS HB2 1 1 17 11643 1 1 14 CYS HB3 H -9.046 -0.428 1.409 1.00 . A A . 14 CYS HB3 1 1 17 11644 1 1 14 CYS N N -9.726 -1.860 -0.686 1.00 . A A . 14 CYS N 1 1 17 11645 1 1 14 CYS O O -11.194 -2.254 1.805 1.00 . A A . 14 CYS O 1 1 17 11646 1 1 14 CYS SG S -7.776 -1.793 2.908 1.00 . A A . 14 CYS SG 1 1 17 11647 1 1 15 PHE C C -10.445 -5.045 3.899 1.00 . A A . 15 PHE C 1 1 17 11648 1 1 15 PHE CA C -11.082 -4.914 2.528 1.00 . A A . 15 PHE CA 1 1 17 11649 1 1 15 PHE CB C -11.430 -6.305 1.995 1.00 . A A . 15 PHE CB 1 1 17 11650 1 1 15 PHE CD1 C -11.353 -6.516 -0.496 1.00 . A A . 15 PHE CD1 1 1 17 11651 1 1 15 PHE CD2 C -13.439 -6.059 0.544 1.00 . A A . 15 PHE CD2 1 1 17 11652 1 1 15 PHE CE1 C -11.960 -6.507 -1.729 1.00 . A A . 15 PHE CE1 1 1 17 11653 1 1 15 PHE CE2 C -14.051 -6.049 -0.683 1.00 . A A . 15 PHE CE2 1 1 17 11654 1 1 15 PHE CG C -12.087 -6.293 0.655 1.00 . A A . 15 PHE CG 1 1 17 11655 1 1 15 PHE CZ C -13.312 -6.273 -1.825 1.00 . A A . 15 PHE CZ 1 1 17 11656 1 1 15 PHE H H -9.466 -4.758 1.185 1.00 . A A . 15 PHE H 1 1 17 11657 1 1 15 PHE HA H -11.984 -4.323 2.589 1.00 . A A . 15 PHE HA 1 1 17 11658 1 1 15 PHE HB2 H -10.525 -6.887 1.911 1.00 . A A . 15 PHE HB2 1 1 17 11659 1 1 15 PHE HB3 H -12.097 -6.792 2.692 1.00 . A A . 15 PHE HB3 1 1 17 11660 1 1 15 PHE HD1 H -10.291 -6.699 -0.428 1.00 . A A . 15 PHE HD1 1 1 17 11661 1 1 15 PHE HD2 H -14.024 -5.881 1.436 1.00 . A A . 15 PHE HD2 1 1 17 11662 1 1 15 PHE HE1 H -11.373 -6.681 -2.618 1.00 . A A . 15 PHE HE1 1 1 17 11663 1 1 15 PHE HE2 H -15.113 -5.863 -0.742 1.00 . A A . 15 PHE HE2 1 1 17 11664 1 1 15 PHE HZ H -13.788 -6.267 -2.794 1.00 . A A . 15 PHE HZ 1 1 17 11665 1 1 15 PHE N N -10.165 -4.241 1.642 1.00 . A A . 15 PHE N 1 1 17 11666 1 1 15 PHE O O -11.123 -5.017 4.928 1.00 . A A . 15 PHE O 1 1 17 11667 1 1 16 THR C C -7.077 -4.539 5.001 1.00 . A A . 16 THR C 1 1 17 11668 1 1 16 THR CA C -8.380 -5.346 5.121 1.00 . A A . 16 THR CA 1 1 17 11669 1 1 16 THR CB C -8.034 -6.836 5.347 1.00 . A A . 16 THR CB 1 1 17 11670 1 1 16 THR CG2 C -7.473 -7.050 6.744 1.00 . A A . 16 THR CG2 1 1 17 11671 1 1 16 THR H H -8.642 -5.193 3.056 1.00 . A A . 16 THR H 1 1 17 11672 1 1 16 THR HA H -8.967 -4.985 5.953 1.00 . A A . 16 THR HA 1 1 17 11673 1 1 16 THR HB H -7.294 -7.134 4.618 1.00 . A A . 16 THR HB 1 1 17 11674 1 1 16 THR HG1 H -9.442 -7.617 4.245 1.00 . A A . 16 THR HG1 1 1 17 11675 1 1 16 THR HG21 H -6.567 -6.473 6.856 1.00 . A A . 16 THR HG21 1 1 17 11676 1 1 16 THR HG22 H -7.257 -8.096 6.893 1.00 . A A . 16 THR HG22 1 1 17 11677 1 1 16 THR HG23 H -8.198 -6.724 7.475 1.00 . A A . 16 THR HG23 1 1 17 11678 1 1 16 THR N N -9.135 -5.192 3.906 1.00 . A A . 16 THR N 1 1 17 11679 1 1 16 THR O O -6.281 -4.776 4.075 1.00 . A A . 16 THR O 1 1 17 11680 1 1 16 THR OG1 O -9.216 -7.642 5.184 1.00 . A A . 16 THR OG1 1 1 17 11681 1 1 17 THR C C -4.383 -3.557 5.954 1.00 . A A . 17 THR C 1 1 17 11682 1 1 17 THR CA C -5.699 -2.744 5.915 1.00 . A A . 17 THR CA 1 1 17 11683 1 1 17 THR CB C -5.768 -1.736 7.095 1.00 . A A . 17 THR CB 1 1 17 11684 1 1 17 THR CG2 C -4.689 -0.664 6.959 1.00 . A A . 17 THR CG2 1 1 17 11685 1 1 17 THR H H -7.510 -3.492 6.650 1.00 . A A . 17 THR H 1 1 17 11686 1 1 17 THR HA H -5.726 -2.190 4.987 1.00 . A A . 17 THR HA 1 1 17 11687 1 1 17 THR HB H -5.633 -2.272 8.024 1.00 . A A . 17 THR HB 1 1 17 11688 1 1 17 THR HG1 H -7.632 -1.591 7.699 1.00 . A A . 17 THR HG1 1 1 17 11689 1 1 17 THR HG21 H -3.715 -1.131 6.958 1.00 . A A . 17 THR HG21 1 1 17 11690 1 1 17 THR HG22 H -4.759 0.028 7.786 1.00 . A A . 17 THR HG22 1 1 17 11691 1 1 17 THR HG23 H -4.831 -0.129 6.031 1.00 . A A . 17 THR HG23 1 1 17 11692 1 1 17 THR N N -6.861 -3.618 5.925 1.00 . A A . 17 THR N 1 1 17 11693 1 1 17 THR O O -3.446 -3.266 5.213 1.00 . A A . 17 THR O 1 1 17 11694 1 1 17 THR OG1 O -7.066 -1.093 7.093 1.00 . A A . 17 THR OG1 1 1 17 11695 1 1 18 GLY C C -2.861 -6.187 5.545 1.00 . A A . 18 GLY C 1 1 17 11696 1 1 18 GLY CA C -3.176 -5.471 6.857 1.00 . A A . 18 GLY CA 1 1 17 11697 1 1 18 GLY H H -5.130 -4.801 7.335 1.00 . A A . 18 GLY H 1 1 17 11698 1 1 18 GLY HA2 H -2.328 -4.862 7.134 1.00 . A A . 18 GLY HA2 1 1 17 11699 1 1 18 GLY HA3 H -3.341 -6.208 7.629 1.00 . A A . 18 GLY HA3 1 1 17 11700 1 1 18 GLY N N -4.354 -4.614 6.764 1.00 . A A . 18 GLY N 1 1 17 11701 1 1 18 GLY O O -1.698 -6.402 5.210 1.00 . A A . 18 GLY O 1 1 17 11702 1 1 19 SER C C -3.181 -6.202 2.477 1.00 . A A . 19 SER C 1 1 17 11703 1 1 19 SER CA C -3.738 -7.199 3.514 1.00 . A A . 19 SER CA 1 1 17 11704 1 1 19 SER CB C -5.098 -7.779 3.068 1.00 . A A . 19 SER CB 1 1 17 11705 1 1 19 SER H H -4.793 -6.305 5.109 1.00 . A A . 19 SER H 1 1 17 11706 1 1 19 SER HA H -3.028 -8.002 3.645 1.00 . A A . 19 SER HA 1 1 17 11707 1 1 19 SER HB2 H -5.492 -8.405 3.856 1.00 . A A . 19 SER HB2 1 1 17 11708 1 1 19 SER HB3 H -5.782 -6.962 2.891 1.00 . A A . 19 SER HB3 1 1 17 11709 1 1 19 SER HG H -5.463 -9.388 2.057 1.00 . A A . 19 SER HG 1 1 17 11710 1 1 19 SER N N -3.893 -6.521 4.792 1.00 . A A . 19 SER N 1 1 17 11711 1 1 19 SER O O -2.415 -6.566 1.573 1.00 . A A . 19 SER O 1 1 17 11712 1 1 19 SER OG O -4.997 -8.556 1.887 1.00 . A A . 19 SER OG 1 1 17 11713 1 1 20 CYS C C -1.600 -3.586 2.145 1.00 . A A . 20 CYS C 1 1 17 11714 1 1 20 CYS CA C -3.060 -3.867 1.814 1.00 . A A . 20 CYS CA 1 1 17 11715 1 1 20 CYS CB C -3.907 -2.630 2.068 1.00 . A A . 20 CYS CB 1 1 17 11716 1 1 20 CYS H H -4.163 -4.735 3.378 1.00 . A A . 20 CYS H 1 1 17 11717 1 1 20 CYS HA H -3.150 -4.158 0.779 1.00 . A A . 20 CYS HA 1 1 17 11718 1 1 20 CYS HB2 H -4.932 -2.849 1.810 1.00 . A A . 20 CYS HB2 1 1 17 11719 1 1 20 CYS HB3 H -3.856 -2.386 3.118 1.00 . A A . 20 CYS HB3 1 1 17 11720 1 1 20 CYS N N -3.541 -4.948 2.651 1.00 . A A . 20 CYS N 1 1 17 11721 1 1 20 CYS O O -0.746 -3.484 1.252 1.00 . A A . 20 CYS O 1 1 17 11722 1 1 20 CYS SG S -3.421 -1.165 1.135 1.00 . A A . 20 CYS SG 1 1 17 11723 1 1 21 ASP C C 0.953 -4.401 3.442 1.00 . A A . 21 ASP C 1 1 17 11724 1 1 21 ASP CA C 0.034 -3.310 3.961 1.00 . A A . 21 ASP CA 1 1 17 11725 1 1 21 ASP CB C -0.001 -3.316 5.491 1.00 . A A . 21 ASP CB 1 1 17 11726 1 1 21 ASP CG C 1.351 -3.112 6.127 1.00 . A A . 21 ASP CG 1 1 17 11727 1 1 21 ASP H H -2.052 -3.569 4.094 1.00 . A A . 21 ASP H 1 1 17 11728 1 1 21 ASP HA H 0.392 -2.351 3.618 1.00 . A A . 21 ASP HA 1 1 17 11729 1 1 21 ASP HB2 H -0.653 -2.524 5.830 1.00 . A A . 21 ASP HB2 1 1 17 11730 1 1 21 ASP HB3 H -0.400 -4.262 5.826 1.00 . A A . 21 ASP HB3 1 1 17 11731 1 1 21 ASP N N -1.316 -3.514 3.443 1.00 . A A . 21 ASP N 1 1 17 11732 1 1 21 ASP O O 2.062 -4.136 2.986 1.00 . A A . 21 ASP O 1 1 17 11733 1 1 21 ASP OD1 O 1.913 -4.086 6.679 1.00 . A A . 21 ASP OD1 1 1 17 11734 1 1 21 ASP OD2 O 1.857 -1.962 6.116 1.00 . A A . 21 ASP OD2 1 1 17 11735 1 1 22 ASP C C 1.523 -6.608 1.462 1.00 . A A . 22 ASP C 1 1 17 11736 1 1 22 ASP CA C 1.111 -6.794 2.919 1.00 . A A . 22 ASP CA 1 1 17 11737 1 1 22 ASP CB C 0.157 -7.982 3.013 1.00 . A A . 22 ASP CB 1 1 17 11738 1 1 22 ASP CG C 0.675 -9.252 2.386 1.00 . A A . 22 ASP CG 1 1 17 11739 1 1 22 ASP H H -0.484 -5.706 3.787 1.00 . A A . 22 ASP H 1 1 17 11740 1 1 22 ASP HA H 1.976 -6.996 3.533 1.00 . A A . 22 ASP HA 1 1 17 11741 1 1 22 ASP HB2 H -0.066 -8.184 4.049 1.00 . A A . 22 ASP HB2 1 1 17 11742 1 1 22 ASP HB3 H -0.757 -7.708 2.509 1.00 . A A . 22 ASP HB3 1 1 17 11743 1 1 22 ASP N N 0.421 -5.608 3.419 1.00 . A A . 22 ASP N 1 1 17 11744 1 1 22 ASP O O 2.685 -6.845 1.099 1.00 . A A . 22 ASP O 1 1 17 11745 1 1 22 ASP OD1 O 1.163 -10.127 3.119 1.00 . A A . 22 ASP OD1 1 1 17 11746 1 1 22 ASP OD2 O 0.541 -9.421 1.156 1.00 . A A . 22 ASP OD2 1 1 17 11747 1 1 23 HIS C C 1.913 -4.946 -1.024 1.00 . A A . 23 HIS C 1 1 17 11748 1 1 23 HIS CA C 0.806 -5.962 -0.773 1.00 . A A . 23 HIS CA 1 1 17 11749 1 1 23 HIS CB C -0.508 -5.532 -1.463 1.00 . A A . 23 HIS CB 1 1 17 11750 1 1 23 HIS CD2 C -0.024 -4.268 -3.683 1.00 . A A . 23 HIS CD2 1 1 17 11751 1 1 23 HIS CE1 C -0.563 -5.815 -5.094 1.00 . A A . 23 HIS CE1 1 1 17 11752 1 1 23 HIS CG C -0.413 -5.346 -2.958 1.00 . A A . 23 HIS CG 1 1 17 11753 1 1 23 HIS H H -0.287 -5.911 1.029 1.00 . A A . 23 HIS H 1 1 17 11754 1 1 23 HIS HA H 1.120 -6.908 -1.187 1.00 . A A . 23 HIS HA 1 1 17 11755 1 1 23 HIS HB2 H -1.264 -6.282 -1.278 1.00 . A A . 23 HIS HB2 1 1 17 11756 1 1 23 HIS HB3 H -0.835 -4.598 -1.031 1.00 . A A . 23 HIS HB3 1 1 17 11757 1 1 23 HIS HD1 H -1.069 -7.221 -3.679 1.00 . A A . 23 HIS HD1 1 1 17 11758 1 1 23 HIS HD2 H 0.309 -3.323 -3.276 1.00 . A A . 23 HIS HD2 1 1 17 11759 1 1 23 HIS HE1 H -0.757 -6.355 -6.009 1.00 . A A . 23 HIS HE1 1 1 17 11760 1 1 23 HIS N N 0.587 -6.147 0.652 1.00 . A A . 23 HIS N 1 1 17 11761 1 1 23 HIS ND1 N -0.750 -6.312 -3.875 1.00 . A A . 23 HIS ND1 1 1 17 11762 1 1 23 HIS NE2 N -0.120 -4.570 -5.037 1.00 . A A . 23 HIS NE2 1 1 17 11763 1 1 23 HIS O O 2.877 -5.224 -1.750 1.00 . A A . 23 HIS O 1 1 17 11764 1 1 24 CYS C C 4.162 -3.142 -0.114 1.00 . A A . 24 CYS C 1 1 17 11765 1 1 24 CYS CA C 2.760 -2.744 -0.586 1.00 . A A . 24 CYS CA 1 1 17 11766 1 1 24 CYS CB C 2.308 -1.471 0.111 1.00 . A A . 24 CYS CB 1 1 17 11767 1 1 24 CYS H H 1.035 -3.666 0.208 1.00 . A A . 24 CYS H 1 1 17 11768 1 1 24 CYS HA H 2.793 -2.553 -1.648 1.00 . A A . 24 CYS HA 1 1 17 11769 1 1 24 CYS HB2 H 2.268 -1.652 1.176 1.00 . A A . 24 CYS HB2 1 1 17 11770 1 1 24 CYS HB3 H 3.026 -0.690 -0.085 1.00 . A A . 24 CYS HB3 1 1 17 11771 1 1 24 CYS N N 1.800 -3.805 -0.394 1.00 . A A . 24 CYS N 1 1 17 11772 1 1 24 CYS O O 5.146 -2.822 -0.764 1.00 . A A . 24 CYS O 1 1 17 11773 1 1 24 CYS SG S 0.661 -0.871 -0.405 1.00 . A A . 24 CYS SG 1 1 17 11774 1 1 25 LYS C C 6.196 -5.396 0.762 1.00 . A A . 25 LYS C 1 1 17 11775 1 1 25 LYS CA C 5.554 -4.248 1.529 1.00 . A A . 25 LYS CA 1 1 17 11776 1 1 25 LYS CB C 5.451 -4.610 3.010 1.00 . A A . 25 LYS CB 1 1 17 11777 1 1 25 LYS CD C 4.823 -3.845 5.348 1.00 . A A . 25 LYS CD 1 1 17 11778 1 1 25 LYS CE C 6.141 -3.641 6.102 1.00 . A A . 25 LYS CE 1 1 17 11779 1 1 25 LYS CG C 4.897 -3.490 3.867 1.00 . A A . 25 LYS CG 1 1 17 11780 1 1 25 LYS H H 3.430 -4.158 1.445 1.00 . A A . 25 LYS H 1 1 17 11781 1 1 25 LYS HA H 6.196 -3.385 1.438 1.00 . A A . 25 LYS HA 1 1 17 11782 1 1 25 LYS HB2 H 4.799 -5.466 3.109 1.00 . A A . 25 LYS HB2 1 1 17 11783 1 1 25 LYS HB3 H 6.430 -4.874 3.380 1.00 . A A . 25 LYS HB3 1 1 17 11784 1 1 25 LYS HD2 H 4.067 -3.233 5.816 1.00 . A A . 25 LYS HD2 1 1 17 11785 1 1 25 LYS HD3 H 4.531 -4.882 5.427 1.00 . A A . 25 LYS HD3 1 1 17 11786 1 1 25 LYS HE2 H 6.456 -2.619 5.954 1.00 . A A . 25 LYS HE2 1 1 17 11787 1 1 25 LYS HE3 H 5.949 -3.794 7.152 1.00 . A A . 25 LYS HE3 1 1 17 11788 1 1 25 LYS HG2 H 5.530 -2.622 3.755 1.00 . A A . 25 LYS HG2 1 1 17 11789 1 1 25 LYS HG3 H 3.904 -3.251 3.513 1.00 . A A . 25 LYS HG3 1 1 17 11790 1 1 25 LYS HZ1 H 7.535 -4.363 4.690 1.00 . A A . 25 LYS HZ1 1 1 17 11791 1 1 25 LYS HZ2 H 6.994 -5.530 5.785 1.00 . A A . 25 LYS HZ2 1 1 17 11792 1 1 25 LYS HZ3 H 8.072 -4.361 6.283 1.00 . A A . 25 LYS HZ3 1 1 17 11793 1 1 25 LYS N N 4.251 -3.874 0.983 1.00 . A A . 25 LYS N 1 1 17 11794 1 1 25 LYS NZ N 7.245 -4.528 5.673 1.00 . A A . 25 LYS NZ 1 1 17 11795 1 1 25 LYS O O 7.371 -5.339 0.415 1.00 . A A . 25 LYS O 1 1 17 11796 1 1 26 ASN C C 6.022 -7.484 -1.653 1.00 . A A . 26 ASN C 1 1 17 11797 1 1 26 ASN CA C 5.980 -7.609 -0.152 1.00 . A A . 26 ASN CA 1 1 17 11798 1 1 26 ASN CB C 5.211 -8.876 0.263 1.00 . A A . 26 ASN CB 1 1 17 11799 1 1 26 ASN CG C 5.271 -9.131 1.758 1.00 . A A . 26 ASN CG 1 1 17 11800 1 1 26 ASN H H 4.467 -6.368 0.675 1.00 . A A . 26 ASN H 1 1 17 11801 1 1 26 ASN HA H 6.996 -7.701 0.201 1.00 . A A . 26 ASN HA 1 1 17 11802 1 1 26 ASN HB2 H 4.176 -8.767 -0.022 1.00 . A A . 26 ASN HB2 1 1 17 11803 1 1 26 ASN HB3 H 5.633 -9.728 -0.249 1.00 . A A . 26 ASN HB3 1 1 17 11804 1 1 26 ASN HD21 H 3.567 -8.171 2.022 1.00 . A A . 26 ASN HD21 1 1 17 11805 1 1 26 ASN HD22 H 4.294 -8.792 3.452 1.00 . A A . 26 ASN HD22 1 1 17 11806 1 1 26 ASN N N 5.428 -6.416 0.472 1.00 . A A . 26 ASN N 1 1 17 11807 1 1 26 ASN ND2 N 4.288 -8.658 2.480 1.00 . A A . 26 ASN ND2 1 1 17 11808 1 1 26 ASN O O 7.098 -7.489 -2.252 1.00 . A A . 26 ASN O 1 1 17 11809 1 1 26 ASN OD1 O 6.191 -9.771 2.252 1.00 . A A . 26 ASN OD1 1 1 17 11810 1 1 27 LYS C C 5.321 -5.971 -4.277 1.00 . A A . 27 LYS C 1 1 17 11811 1 1 27 LYS CA C 4.736 -7.255 -3.693 1.00 . A A . 27 LYS CA 1 1 17 11812 1 1 27 LYS CB C 3.255 -7.411 -4.097 1.00 . A A . 27 LYS CB 1 1 17 11813 1 1 27 LYS CD C 3.721 -8.195 -6.456 1.00 . A A . 27 LYS CD 1 1 17 11814 1 1 27 LYS CE C 3.656 -7.784 -7.913 1.00 . A A . 27 LYS CE 1 1 17 11815 1 1 27 LYS CG C 2.979 -7.199 -5.582 1.00 . A A . 27 LYS CG 1 1 17 11816 1 1 27 LYS H H 4.061 -7.178 -1.704 1.00 . A A . 27 LYS H 1 1 17 11817 1 1 27 LYS HA H 5.283 -8.095 -4.093 1.00 . A A . 27 LYS HA 1 1 17 11818 1 1 27 LYS HB2 H 2.925 -8.401 -3.823 1.00 . A A . 27 LYS HB2 1 1 17 11819 1 1 27 LYS HB3 H 2.673 -6.691 -3.539 1.00 . A A . 27 LYS HB3 1 1 17 11820 1 1 27 LYS HD2 H 4.757 -8.234 -6.149 1.00 . A A . 27 LYS HD2 1 1 17 11821 1 1 27 LYS HD3 H 3.272 -9.171 -6.343 1.00 . A A . 27 LYS HD3 1 1 17 11822 1 1 27 LYS HE2 H 4.124 -8.552 -8.510 1.00 . A A . 27 LYS HE2 1 1 17 11823 1 1 27 LYS HE3 H 2.620 -7.689 -8.200 1.00 . A A . 27 LYS HE3 1 1 17 11824 1 1 27 LYS HG2 H 1.919 -7.305 -5.758 1.00 . A A . 27 LYS HG2 1 1 17 11825 1 1 27 LYS HG3 H 3.287 -6.199 -5.848 1.00 . A A . 27 LYS HG3 1 1 17 11826 1 1 27 LYS HZ1 H 5.352 -6.572 -7.896 1.00 . A A . 27 LYS HZ1 1 1 17 11827 1 1 27 LYS HZ2 H 3.949 -5.700 -7.589 1.00 . A A . 27 LYS HZ2 1 1 17 11828 1 1 27 LYS HZ3 H 4.309 -6.216 -9.152 1.00 . A A . 27 LYS HZ3 1 1 17 11829 1 1 27 LYS N N 4.868 -7.305 -2.249 1.00 . A A . 27 LYS N 1 1 17 11830 1 1 27 LYS NZ N 4.347 -6.487 -8.150 1.00 . A A . 27 LYS NZ 1 1 17 11831 1 1 27 LYS O O 6.072 -6.004 -5.258 1.00 . A A . 27 LYS O 1 1 17 11832 1 1 28 GLU C C 6.786 -3.152 -3.700 1.00 . A A . 28 GLU C 1 1 17 11833 1 1 28 GLU CA C 5.438 -3.590 -4.232 1.00 . A A . 28 GLU CA 1 1 17 11834 1 1 28 GLU CB C 4.380 -2.514 -4.078 1.00 . A A . 28 GLU CB 1 1 17 11835 1 1 28 GLU CD C 3.308 -3.044 -6.300 1.00 . A A . 28 GLU CD 1 1 17 11836 1 1 28 GLU CG C 3.093 -2.849 -4.811 1.00 . A A . 28 GLU CG 1 1 17 11837 1 1 28 GLU H H 4.397 -4.891 -2.907 1.00 . A A . 28 GLU H 1 1 17 11838 1 1 28 GLU HA H 5.572 -3.767 -5.287 1.00 . A A . 28 GLU HA 1 1 17 11839 1 1 28 GLU HB2 H 4.171 -2.377 -3.028 1.00 . A A . 28 GLU HB2 1 1 17 11840 1 1 28 GLU HB3 H 4.768 -1.589 -4.480 1.00 . A A . 28 GLU HB3 1 1 17 11841 1 1 28 GLU HG2 H 2.687 -3.762 -4.402 1.00 . A A . 28 GLU HG2 1 1 17 11842 1 1 28 GLU HG3 H 2.387 -2.044 -4.665 1.00 . A A . 28 GLU HG3 1 1 17 11843 1 1 28 GLU N N 4.989 -4.858 -3.691 1.00 . A A . 28 GLU N 1 1 17 11844 1 1 28 GLU O O 7.350 -2.180 -4.189 1.00 . A A . 28 GLU O 1 1 17 11845 1 1 28 GLU OE1 O 3.625 -4.175 -6.748 1.00 . A A . 28 GLU OE1 1 1 17 11846 1 1 28 GLU OE2 O 3.160 -2.071 -7.063 1.00 . A A . 28 GLU OE2 1 1 17 11847 1 1 29 HIS C C 8.752 -2.226 -1.508 1.00 . A A . 29 HIS C 1 1 17 11848 1 1 29 HIS CA C 8.645 -3.623 -2.124 1.00 . A A . 29 HIS CA 1 1 17 11849 1 1 29 HIS CB C 9.749 -3.816 -3.195 1.00 . A A . 29 HIS CB 1 1 17 11850 1 1 29 HIS CD2 C 9.134 -6.035 -4.406 1.00 . A A . 29 HIS CD2 1 1 17 11851 1 1 29 HIS CE1 C 10.941 -7.156 -4.003 1.00 . A A . 29 HIS CE1 1 1 17 11852 1 1 29 HIS CG C 9.942 -5.230 -3.668 1.00 . A A . 29 HIS CG 1 1 17 11853 1 1 29 HIS H H 6.759 -4.607 -2.337 1.00 . A A . 29 HIS H 1 1 17 11854 1 1 29 HIS HA H 8.799 -4.350 -1.339 1.00 . A A . 29 HIS HA 1 1 17 11855 1 1 29 HIS HB2 H 9.495 -3.219 -4.059 1.00 . A A . 29 HIS HB2 1 1 17 11856 1 1 29 HIS HB3 H 10.685 -3.463 -2.791 1.00 . A A . 29 HIS HB3 1 1 17 11857 1 1 29 HIS HD1 H 11.860 -5.649 -2.916 1.00 . A A . 29 HIS HD1 1 1 17 11858 1 1 29 HIS HD2 H 8.150 -5.781 -4.777 1.00 . A A . 29 HIS HD2 1 1 17 11859 1 1 29 HIS HE1 H 11.688 -7.937 -3.971 1.00 . A A . 29 HIS HE1 1 1 17 11860 1 1 29 HIS N N 7.300 -3.878 -2.700 1.00 . A A . 29 HIS N 1 1 17 11861 1 1 29 HIS ND1 N 11.078 -5.961 -3.425 1.00 . A A . 29 HIS ND1 1 1 17 11862 1 1 29 HIS NE2 N 9.772 -7.255 -4.615 1.00 . A A . 29 HIS NE2 1 1 17 11863 1 1 29 HIS O O 9.847 -1.652 -1.413 1.00 . A A . 29 HIS O 1 1 17 11864 1 1 30 LEU C C 7.497 -0.477 1.016 1.00 . A A . 30 LEU C 1 1 17 11865 1 1 30 LEU CA C 7.576 -0.385 -0.500 1.00 . A A . 30 LEU CA 1 1 17 11866 1 1 30 LEU CB C 6.370 0.353 -1.085 1.00 . A A . 30 LEU CB 1 1 17 11867 1 1 30 LEU CD1 C 5.105 1.144 -3.114 1.00 . A A . 30 LEU CD1 1 1 17 11868 1 1 30 LEU CD2 C 7.599 1.111 -3.154 1.00 . A A . 30 LEU CD2 1 1 17 11869 1 1 30 LEU CG C 6.345 0.440 -2.620 1.00 . A A . 30 LEU CG 1 1 17 11870 1 1 30 LEU H H 6.818 -2.247 -1.082 1.00 . A A . 30 LEU H 1 1 17 11871 1 1 30 LEU HA H 8.480 0.141 -0.770 1.00 . A A . 30 LEU HA 1 1 17 11872 1 1 30 LEU HB2 H 5.474 -0.153 -0.755 1.00 . A A . 30 LEU HB2 1 1 17 11873 1 1 30 LEU HB3 H 6.361 1.359 -0.692 1.00 . A A . 30 LEU HB3 1 1 17 11874 1 1 30 LEU HD11 H 4.238 0.556 -2.854 1.00 . A A . 30 LEU HD11 1 1 17 11875 1 1 30 LEU HD12 H 5.153 1.267 -4.186 1.00 . A A . 30 LEU HD12 1 1 17 11876 1 1 30 LEU HD13 H 5.027 2.110 -2.639 1.00 . A A . 30 LEU HD13 1 1 17 11877 1 1 30 LEU HD21 H 8.466 0.531 -2.875 1.00 . A A . 30 LEU HD21 1 1 17 11878 1 1 30 LEU HD22 H 7.683 2.105 -2.739 1.00 . A A . 30 LEU HD22 1 1 17 11879 1 1 30 LEU HD23 H 7.543 1.177 -4.230 1.00 . A A . 30 LEU HD23 1 1 17 11880 1 1 30 LEU HG H 6.315 -0.568 -3.011 1.00 . A A . 30 LEU HG 1 1 17 11881 1 1 30 LEU N N 7.641 -1.710 -1.059 1.00 . A A . 30 LEU N 1 1 17 11882 1 1 30 LEU O O 7.423 -1.581 1.564 1.00 . A A . 30 LEU O 1 1 17 11883 1 1 31 ARG C C 6.261 0.092 3.781 1.00 . A A . 31 ARG C 1 1 17 11884 1 1 31 ARG CA C 7.521 0.678 3.147 1.00 . A A . 31 ARG CA 1 1 17 11885 1 1 31 ARG CB C 7.768 2.089 3.696 1.00 . A A . 31 ARG CB 1 1 17 11886 1 1 31 ARG CD C 7.699 3.541 5.751 1.00 . A A . 31 ARG CD 1 1 17 11887 1 1 31 ARG CG C 7.647 2.142 5.210 1.00 . A A . 31 ARG CG 1 1 17 11888 1 1 31 ARG CZ C 6.774 4.652 7.761 1.00 . A A . 31 ARG CZ 1 1 17 11889 1 1 31 ARG H H 7.435 1.508 1.202 1.00 . A A . 31 ARG H 1 1 17 11890 1 1 31 ARG HA H 8.352 0.056 3.442 1.00 . A A . 31 ARG HA 1 1 17 11891 1 1 31 ARG HB2 H 8.758 2.415 3.417 1.00 . A A . 31 ARG HB2 1 1 17 11892 1 1 31 ARG HB3 H 7.038 2.764 3.274 1.00 . A A . 31 ARG HB3 1 1 17 11893 1 1 31 ARG HD2 H 8.720 3.892 5.731 1.00 . A A . 31 ARG HD2 1 1 17 11894 1 1 31 ARG HD3 H 7.080 4.182 5.140 1.00 . A A . 31 ARG HD3 1 1 17 11895 1 1 31 ARG HE H 7.114 2.675 7.543 1.00 . A A . 31 ARG HE 1 1 17 11896 1 1 31 ARG HG2 H 6.703 1.702 5.499 1.00 . A A . 31 ARG HG2 1 1 17 11897 1 1 31 ARG HG3 H 8.451 1.565 5.641 1.00 . A A . 31 ARG HG3 1 1 17 11898 1 1 31 ARG HH11 H 7.548 6.024 6.436 1.00 . A A . 31 ARG HH11 1 1 17 11899 1 1 31 ARG HH12 H 6.733 6.688 7.750 1.00 . A A . 31 ARG HH12 1 1 17 11900 1 1 31 ARG HH21 H 5.930 3.651 9.322 1.00 . A A . 31 ARG HH21 1 1 17 11901 1 1 31 ARG HH22 H 5.815 5.350 9.399 1.00 . A A . 31 ARG HH22 1 1 17 11902 1 1 31 ARG N N 7.486 0.657 1.691 1.00 . A A . 31 ARG N 1 1 17 11903 1 1 31 ARG NE N 7.194 3.565 7.124 1.00 . A A . 31 ARG NE 1 1 17 11904 1 1 31 ARG NH1 N 7.035 5.853 7.282 1.00 . A A . 31 ARG NH1 1 1 17 11905 1 1 31 ARG NH2 N 6.129 4.539 8.899 1.00 . A A . 31 ARG NH2 1 1 17 11906 1 1 31 ARG O O 6.339 -0.823 4.584 1.00 . A A . 31 ARG O 1 1 17 11907 1 1 32 SER C C 2.714 0.500 3.146 1.00 . A A . 32 SER C 1 1 17 11908 1 1 32 SER CA C 3.873 0.201 4.064 1.00 . A A . 32 SER CA 1 1 17 11909 1 1 32 SER CB C 3.671 0.906 5.417 1.00 . A A . 32 SER CB 1 1 17 11910 1 1 32 SER H H 5.072 1.341 2.776 1.00 . A A . 32 SER H 1 1 17 11911 1 1 32 SER HA H 3.930 -0.864 4.234 1.00 . A A . 32 SER HA 1 1 17 11912 1 1 32 SER HB2 H 3.671 1.976 5.265 1.00 . A A . 32 SER HB2 1 1 17 11913 1 1 32 SER HB3 H 2.727 0.603 5.841 1.00 . A A . 32 SER HB3 1 1 17 11914 1 1 32 SER HG H 5.361 0.033 5.844 1.00 . A A . 32 SER HG 1 1 17 11915 1 1 32 SER N N 5.116 0.636 3.456 1.00 . A A . 32 SER N 1 1 17 11916 1 1 32 SER O O 2.873 1.254 2.173 1.00 . A A . 32 SER O 1 1 17 11917 1 1 32 SER OG O 4.718 0.571 6.330 1.00 . A A . 32 SER OG 1 1 17 11918 1 1 33 GLY C C -0.723 0.606 3.516 1.00 . A A . 33 GLY C 1 1 17 11919 1 1 33 GLY CA C 0.395 0.141 2.654 1.00 . A A . 33 GLY CA 1 1 17 11920 1 1 33 GLY H H 1.516 -0.687 4.213 1.00 . A A . 33 GLY H 1 1 17 11921 1 1 33 GLY HA2 H 0.605 0.892 1.908 1.00 . A A . 33 GLY HA2 1 1 17 11922 1 1 33 GLY HA3 H 0.103 -0.775 2.160 1.00 . A A . 33 GLY HA3 1 1 17 11923 1 1 33 GLY N N 1.579 -0.087 3.436 1.00 . A A . 33 GLY N 1 1 17 11924 1 1 33 GLY O O -1.053 -0.043 4.512 1.00 . A A . 33 GLY O 1 1 17 11925 1 1 34 ARG C C -3.569 2.535 3.142 1.00 . A A . 34 ARG C 1 1 17 11926 1 1 34 ARG CA C -2.331 2.296 3.969 1.00 . A A . 34 ARG CA 1 1 17 11927 1 1 34 ARG CB C -1.853 3.580 4.674 1.00 . A A . 34 ARG CB 1 1 17 11928 1 1 34 ARG CD C -0.310 4.572 6.434 1.00 . A A . 34 ARG CD 1 1 17 11929 1 1 34 ARG CG C -0.782 3.312 5.729 1.00 . A A . 34 ARG CG 1 1 17 11930 1 1 34 ARG CZ C 1.474 6.211 5.842 1.00 . A A . 34 ARG CZ 1 1 17 11931 1 1 34 ARG H H -1.030 2.188 2.349 1.00 . A A . 34 ARG H 1 1 17 11932 1 1 34 ARG HA H -2.579 1.569 4.729 1.00 . A A . 34 ARG HA 1 1 17 11933 1 1 34 ARG HB2 H -1.443 4.250 3.933 1.00 . A A . 34 ARG HB2 1 1 17 11934 1 1 34 ARG HB3 H -2.694 4.059 5.155 1.00 . A A . 34 ARG HB3 1 1 17 11935 1 1 34 ARG HD2 H -1.168 5.072 6.860 1.00 . A A . 34 ARG HD2 1 1 17 11936 1 1 34 ARG HD3 H 0.364 4.285 7.224 1.00 . A A . 34 ARG HD3 1 1 17 11937 1 1 34 ARG HE H -0.034 5.650 4.648 1.00 . A A . 34 ARG HE 1 1 17 11938 1 1 34 ARG HG2 H -1.188 2.638 6.468 1.00 . A A . 34 ARG HG2 1 1 17 11939 1 1 34 ARG HG3 H 0.062 2.840 5.246 1.00 . A A . 34 ARG HG3 1 1 17 11940 1 1 34 ARG HH11 H 1.795 5.383 7.690 1.00 . A A . 34 ARG HH11 1 1 17 11941 1 1 34 ARG HH12 H 2.924 6.577 7.228 1.00 . A A . 34 ARG HH12 1 1 17 11942 1 1 34 ARG HH21 H 1.425 7.186 4.099 1.00 . A A . 34 ARG HH21 1 1 17 11943 1 1 34 ARG HH22 H 2.744 7.642 5.127 1.00 . A A . 34 ARG HH22 1 1 17 11944 1 1 34 ARG N N -1.287 1.724 3.180 1.00 . A A . 34 ARG N 1 1 17 11945 1 1 34 ARG NE N 0.375 5.505 5.538 1.00 . A A . 34 ARG NE 1 1 17 11946 1 1 34 ARG NH1 N 2.107 6.042 6.999 1.00 . A A . 34 ARG NH1 1 1 17 11947 1 1 34 ARG NH2 N 1.928 7.081 4.968 1.00 . A A . 34 ARG NH2 1 1 17 11948 1 1 34 ARG O O -3.522 3.142 2.064 1.00 . A A . 34 ARG O 1 1 17 11949 1 1 35 CYS C C -6.462 3.532 3.378 1.00 . A A . 35 CYS C 1 1 17 11950 1 1 35 CYS CA C -5.934 2.191 2.981 1.00 . A A . 35 CYS CA 1 1 17 11951 1 1 35 CYS CB C -6.893 1.086 3.431 1.00 . A A . 35 CYS CB 1 1 17 11952 1 1 35 CYS H H -4.621 1.519 4.461 1.00 . A A . 35 CYS H 1 1 17 11953 1 1 35 CYS HA H -5.821 2.169 1.908 1.00 . A A . 35 CYS HA 1 1 17 11954 1 1 35 CYS HB2 H -7.143 1.237 4.471 1.00 . A A . 35 CYS HB2 1 1 17 11955 1 1 35 CYS HB3 H -7.793 1.130 2.836 1.00 . A A . 35 CYS HB3 1 1 17 11956 1 1 35 CYS N N -4.661 2.026 3.624 1.00 . A A . 35 CYS N 1 1 17 11957 1 1 35 CYS O O -6.470 3.877 4.562 1.00 . A A . 35 CYS O 1 1 17 11958 1 1 35 CYS SG S -6.192 -0.582 3.263 1.00 . A A . 35 CYS SG 1 1 17 11959 1 1 36 ARG C C -8.824 5.660 2.558 1.00 . A A . 36 ARG C 1 1 17 11960 1 1 36 ARG CA C -7.317 5.621 2.700 1.00 . A A . 36 ARG CA 1 1 17 11961 1 1 36 ARG CB C -6.617 6.655 1.837 1.00 . A A . 36 ARG CB 1 1 17 11962 1 1 36 ARG CD C -4.831 7.084 3.552 1.00 . A A . 36 ARG CD 1 1 17 11963 1 1 36 ARG CG C -5.116 6.768 2.097 1.00 . A A . 36 ARG CG 1 1 17 11964 1 1 36 ARG CZ C -2.895 7.637 4.995 1.00 . A A . 36 ARG CZ 1 1 17 11965 1 1 36 ARG H H -6.779 3.993 1.491 1.00 . A A . 36 ARG H 1 1 17 11966 1 1 36 ARG HA H -7.084 5.813 3.736 1.00 . A A . 36 ARG HA 1 1 17 11967 1 1 36 ARG HB2 H -6.745 6.349 0.809 1.00 . A A . 36 ARG HB2 1 1 17 11968 1 1 36 ARG HB3 H -7.068 7.622 2.003 1.00 . A A . 36 ARG HB3 1 1 17 11969 1 1 36 ARG HD2 H -5.376 7.971 3.835 1.00 . A A . 36 ARG HD2 1 1 17 11970 1 1 36 ARG HD3 H -5.167 6.255 4.156 1.00 . A A . 36 ARG HD3 1 1 17 11971 1 1 36 ARG HE H -2.804 7.209 3.029 1.00 . A A . 36 ARG HE 1 1 17 11972 1 1 36 ARG HG2 H -4.647 5.828 1.847 1.00 . A A . 36 ARG HG2 1 1 17 11973 1 1 36 ARG HG3 H -4.710 7.552 1.476 1.00 . A A . 36 ARG HG3 1 1 17 11974 1 1 36 ARG HH11 H -4.653 7.532 6.034 1.00 . A A . 36 ARG HH11 1 1 17 11975 1 1 36 ARG HH12 H -3.314 8.013 6.957 1.00 . A A . 36 ARG HH12 1 1 17 11976 1 1 36 ARG HH21 H -0.998 7.737 4.306 1.00 . A A . 36 ARG HH21 1 1 17 11977 1 1 36 ARG HH22 H -1.161 8.154 5.953 1.00 . A A . 36 ARG HH22 1 1 17 11978 1 1 36 ARG N N -6.828 4.312 2.418 1.00 . A A . 36 ARG N 1 1 17 11979 1 1 36 ARG NE N -3.408 7.294 3.811 1.00 . A A . 36 ARG NE 1 1 17 11980 1 1 36 ARG NH1 N -3.670 7.726 6.065 1.00 . A A . 36 ARG NH1 1 1 17 11981 1 1 36 ARG NH2 N -1.605 7.849 5.107 1.00 . A A . 36 ARG NH2 1 1 17 11982 1 1 36 ARG O O -9.426 4.655 2.187 1.00 . A A . 36 ARG O 1 1 17 11983 1 1 37 ASP C C -11.585 6.653 1.558 1.00 . A A . 37 ASP C 1 1 17 11984 1 1 37 ASP CA C -10.895 6.989 2.868 1.00 . A A . 37 ASP CA 1 1 17 11985 1 1 37 ASP CB C -11.266 8.414 3.302 1.00 . A A . 37 ASP CB 1 1 17 11986 1 1 37 ASP CG C -10.793 8.751 4.693 1.00 . A A . 37 ASP CG 1 1 17 11987 1 1 37 ASP H H -8.861 7.603 2.969 1.00 . A A . 37 ASP H 1 1 17 11988 1 1 37 ASP HA H -11.264 6.306 3.620 1.00 . A A . 37 ASP HA 1 1 17 11989 1 1 37 ASP HB2 H -10.825 9.120 2.615 1.00 . A A . 37 ASP HB2 1 1 17 11990 1 1 37 ASP HB3 H -12.340 8.517 3.271 1.00 . A A . 37 ASP HB3 1 1 17 11991 1 1 37 ASP N N -9.422 6.811 2.814 1.00 . A A . 37 ASP N 1 1 17 11992 1 1 37 ASP O O -12.777 6.368 1.528 1.00 . A A . 37 ASP O 1 1 17 11993 1 1 37 ASP OD1 O -9.663 9.281 4.839 1.00 . A A . 37 ASP OD1 1 1 17 11994 1 1 37 ASP OD2 O -11.522 8.473 5.672 1.00 . A A . 37 ASP OD2 1 1 17 11995 1 1 38 ASP C C -11.355 4.824 -1.064 1.00 . A A . 38 ASP C 1 1 17 11996 1 1 38 ASP CA C -11.361 6.330 -0.848 1.00 . A A . 38 ASP CA 1 1 17 11997 1 1 38 ASP CB C -10.573 7.012 -1.974 1.00 . A A . 38 ASP CB 1 1 17 11998 1 1 38 ASP CG C -10.689 8.511 -1.951 1.00 . A A . 38 ASP CG 1 1 17 11999 1 1 38 ASP H H -9.903 6.979 0.585 1.00 . A A . 38 ASP H 1 1 17 12000 1 1 38 ASP HA H -12.384 6.673 -0.884 1.00 . A A . 38 ASP HA 1 1 17 12001 1 1 38 ASP HB2 H -9.529 6.756 -1.877 1.00 . A A . 38 ASP HB2 1 1 17 12002 1 1 38 ASP HB3 H -10.938 6.652 -2.925 1.00 . A A . 38 ASP HB3 1 1 17 12003 1 1 38 ASP N N -10.832 6.681 0.477 1.00 . A A . 38 ASP N 1 1 17 12004 1 1 38 ASP O O -11.679 4.345 -2.145 1.00 . A A . 38 ASP O 1 1 17 12005 1 1 38 ASP OD1 O -9.683 9.200 -1.656 1.00 . A A . 38 ASP OD1 1 1 17 12006 1 1 38 ASP OD2 O -11.788 9.041 -2.210 1.00 . A A . 38 ASP OD2 1 1 17 12007 1 1 39 PHE C C -9.844 2.019 -0.929 1.00 . A A . 39 PHE C 1 1 17 12008 1 1 39 PHE CA C -10.874 2.622 0.008 1.00 . A A . 39 PHE CA 1 1 17 12009 1 1 39 PHE CB C -12.257 1.965 -0.182 1.00 . A A . 39 PHE CB 1 1 17 12010 1 1 39 PHE CD1 C -13.146 1.505 2.119 1.00 . A A . 39 PHE CD1 1 1 17 12011 1 1 39 PHE CD2 C -14.198 3.200 0.821 1.00 . A A . 39 PHE CD2 1 1 17 12012 1 1 39 PHE CE1 C -14.029 1.741 3.154 1.00 . A A . 39 PHE CE1 1 1 17 12013 1 1 39 PHE CE2 C -15.084 3.443 1.851 1.00 . A A . 39 PHE CE2 1 1 17 12014 1 1 39 PHE CG C -13.220 2.232 0.942 1.00 . A A . 39 PHE CG 1 1 17 12015 1 1 39 PHE CZ C -15.001 2.714 3.019 1.00 . A A . 39 PHE CZ 1 1 17 12016 1 1 39 PHE H H -10.621 4.577 0.767 1.00 . A A . 39 PHE H 1 1 17 12017 1 1 39 PHE HA H -10.536 2.388 1.008 1.00 . A A . 39 PHE HA 1 1 17 12018 1 1 39 PHE HB2 H -12.699 2.345 -1.091 1.00 . A A . 39 PHE HB2 1 1 17 12019 1 1 39 PHE HB3 H -12.130 0.896 -0.272 1.00 . A A . 39 PHE HB3 1 1 17 12020 1 1 39 PHE HD1 H -12.386 0.744 2.226 1.00 . A A . 39 PHE HD1 1 1 17 12021 1 1 39 PHE HD2 H -14.264 3.770 -0.093 1.00 . A A . 39 PHE HD2 1 1 17 12022 1 1 39 PHE HE1 H -13.959 1.168 4.067 1.00 . A A . 39 PHE HE1 1 1 17 12023 1 1 39 PHE HE2 H -15.843 4.205 1.742 1.00 . A A . 39 PHE HE2 1 1 17 12024 1 1 39 PHE HZ H -15.695 2.904 3.825 1.00 . A A . 39 PHE HZ 1 1 17 12025 1 1 39 PHE N N -10.925 4.097 -0.035 1.00 . A A . 39 PHE N 1 1 17 12026 1 1 39 PHE O O -9.732 0.808 -1.030 1.00 . A A . 39 PHE O 1 1 17 12027 1 1 40 ARG C C -6.734 2.311 -1.664 1.00 . A A . 40 ARG C 1 1 17 12028 1 1 40 ARG CA C -8.049 2.352 -2.461 1.00 . A A . 40 ARG CA 1 1 17 12029 1 1 40 ARG CB C -7.930 3.267 -3.691 1.00 . A A . 40 ARG CB 1 1 17 12030 1 1 40 ARG CD C -8.072 1.508 -5.506 1.00 . A A . 40 ARG CD 1 1 17 12031 1 1 40 ARG CG C -7.235 2.631 -4.894 1.00 . A A . 40 ARG CG 1 1 17 12032 1 1 40 ARG CZ C -10.190 1.268 -6.800 1.00 . A A . 40 ARG CZ 1 1 17 12033 1 1 40 ARG H H -9.202 3.804 -1.444 1.00 . A A . 40 ARG H 1 1 17 12034 1 1 40 ARG HA H -8.317 1.352 -2.762 1.00 . A A . 40 ARG HA 1 1 17 12035 1 1 40 ARG HB2 H -8.922 3.564 -3.995 1.00 . A A . 40 ARG HB2 1 1 17 12036 1 1 40 ARG HB3 H -7.375 4.149 -3.409 1.00 . A A . 40 ARG HB3 1 1 17 12037 1 1 40 ARG HD2 H -7.509 1.048 -6.304 1.00 . A A . 40 ARG HD2 1 1 17 12038 1 1 40 ARG HD3 H -8.285 0.765 -4.751 1.00 . A A . 40 ARG HD3 1 1 17 12039 1 1 40 ARG HE H -9.552 2.945 -5.873 1.00 . A A . 40 ARG HE 1 1 17 12040 1 1 40 ARG HG2 H -7.073 3.389 -5.646 1.00 . A A . 40 ARG HG2 1 1 17 12041 1 1 40 ARG HG3 H -6.284 2.229 -4.576 1.00 . A A . 40 ARG HG3 1 1 17 12042 1 1 40 ARG HH11 H -9.127 -0.470 -6.676 1.00 . A A . 40 ARG HH11 1 1 17 12043 1 1 40 ARG HH12 H -10.554 -0.575 -7.592 1.00 . A A . 40 ARG HH12 1 1 17 12044 1 1 40 ARG HH21 H -11.513 2.782 -7.146 1.00 . A A . 40 ARG HH21 1 1 17 12045 1 1 40 ARG HH22 H -11.936 1.288 -7.847 1.00 . A A . 40 ARG HH22 1 1 17 12046 1 1 40 ARG N N -9.072 2.843 -1.577 1.00 . A A . 40 ARG N 1 1 17 12047 1 1 40 ARG NE N -9.343 2.000 -6.059 1.00 . A A . 40 ARG NE 1 1 17 12048 1 1 40 ARG NH1 N -9.941 -0.007 -7.036 1.00 . A A . 40 ARG NH1 1 1 17 12049 1 1 40 ARG NH2 N -11.283 1.819 -7.297 1.00 . A A . 40 ARG NH2 1 1 17 12050 1 1 40 ARG O O -6.632 2.952 -0.598 1.00 . A A . 40 ARG O 1 1 17 12051 1 1 41 CYS C C -3.449 2.411 -1.857 1.00 . A A . 41 CYS C 1 1 17 12052 1 1 41 CYS CA C -4.505 1.433 -1.441 1.00 . A A . 41 CYS CA 1 1 17 12053 1 1 41 CYS CB C -3.978 0.022 -1.512 1.00 . A A . 41 CYS CB 1 1 17 12054 1 1 41 CYS H H -5.865 1.101 -2.992 1.00 . A A . 41 CYS H 1 1 17 12055 1 1 41 CYS HA H -4.726 1.634 -0.403 1.00 . A A . 41 CYS HA 1 1 17 12056 1 1 41 CYS HB2 H -4.132 -0.368 -2.507 1.00 . A A . 41 CYS HB2 1 1 17 12057 1 1 41 CYS HB3 H -2.921 0.025 -1.288 1.00 . A A . 41 CYS HB3 1 1 17 12058 1 1 41 CYS N N -5.763 1.574 -2.143 1.00 . A A . 41 CYS N 1 1 17 12059 1 1 41 CYS O O -3.098 2.530 -3.040 1.00 . A A . 41 CYS O 1 1 17 12060 1 1 41 CYS SG S -4.785 -1.084 -0.351 1.00 . A A . 41 CYS SG 1 1 17 12061 1 1 42 TRP C C -0.665 3.452 -0.296 1.00 . A A . 42 TRP C 1 1 17 12062 1 1 42 TRP CA C -1.885 4.026 -1.000 1.00 . A A . 42 TRP CA 1 1 17 12063 1 1 42 TRP CB C -2.280 5.346 -0.357 1.00 . A A . 42 TRP CB 1 1 17 12064 1 1 42 TRP CD1 C -2.225 7.375 -1.898 1.00 . A A . 42 TRP CD1 1 1 17 12065 1 1 42 TRP CD2 C -4.275 6.522 -1.645 1.00 . A A . 42 TRP CD2 1 1 17 12066 1 1 42 TRP CE2 C -4.354 7.646 -2.489 1.00 . A A . 42 TRP CE2 1 1 17 12067 1 1 42 TRP CE3 C -5.445 5.827 -1.355 1.00 . A A . 42 TRP CE3 1 1 17 12068 1 1 42 TRP CG C -2.889 6.370 -1.272 1.00 . A A . 42 TRP CG 1 1 17 12069 1 1 42 TRP CH2 C -6.685 7.386 -2.730 1.00 . A A . 42 TRP CH2 1 1 17 12070 1 1 42 TRP CZ2 C -5.556 8.088 -3.036 1.00 . A A . 42 TRP CZ2 1 1 17 12071 1 1 42 TRP CZ3 C -6.638 6.263 -1.900 1.00 . A A . 42 TRP CZ3 1 1 17 12072 1 1 42 TRP H H -3.296 2.964 0.039 1.00 . A A . 42 TRP H 1 1 17 12073 1 1 42 TRP HA H -1.670 4.186 -2.047 1.00 . A A . 42 TRP HA 1 1 17 12074 1 1 42 TRP HB2 H -3.011 5.134 0.409 1.00 . A A . 42 TRP HB2 1 1 17 12075 1 1 42 TRP HB3 H -1.411 5.776 0.114 1.00 . A A . 42 TRP HB3 1 1 17 12076 1 1 42 TRP HD1 H -1.159 7.541 -1.817 1.00 . A A . 42 TRP HD1 1 1 17 12077 1 1 42 TRP HE1 H -2.841 8.932 -3.153 1.00 . A A . 42 TRP HE1 1 1 17 12078 1 1 42 TRP HE3 H -5.427 4.952 -0.726 1.00 . A A . 42 TRP HE3 1 1 17 12079 1 1 42 TRP HH2 H -7.638 7.693 -3.135 1.00 . A A . 42 TRP HH2 1 1 17 12080 1 1 42 TRP HZ2 H -5.611 8.954 -3.679 1.00 . A A . 42 TRP HZ2 1 1 17 12081 1 1 42 TRP HZ3 H -7.552 5.734 -1.681 1.00 . A A . 42 TRP HZ3 1 1 17 12082 1 1 42 TRP N N -2.952 3.095 -0.873 1.00 . A A . 42 TRP N 1 1 17 12083 1 1 42 TRP NE1 N -3.096 8.145 -2.619 1.00 . A A . 42 TRP NE1 1 1 17 12084 1 1 42 TRP O O -0.710 3.159 0.900 1.00 . A A . 42 TRP O 1 1 17 12085 1 1 43 CYS C C 2.613 3.777 -0.218 1.00 . A A . 43 CYS C 1 1 17 12086 1 1 43 CYS CA C 1.580 2.690 -0.455 1.00 . A A . 43 CYS CA 1 1 17 12087 1 1 43 CYS CB C 2.164 1.649 -1.401 1.00 . A A . 43 CYS CB 1 1 17 12088 1 1 43 CYS H H 0.408 3.555 -1.956 1.00 . A A . 43 CYS H 1 1 17 12089 1 1 43 CYS HA H 1.330 2.215 0.481 1.00 . A A . 43 CYS HA 1 1 17 12090 1 1 43 CYS HB2 H 2.534 2.158 -2.278 1.00 . A A . 43 CYS HB2 1 1 17 12091 1 1 43 CYS HB3 H 2.993 1.160 -0.912 1.00 . A A . 43 CYS HB3 1 1 17 12092 1 1 43 CYS N N 0.393 3.269 -1.014 1.00 . A A . 43 CYS N 1 1 17 12093 1 1 43 CYS O O 2.741 4.710 -1.017 1.00 . A A . 43 CYS O 1 1 17 12094 1 1 43 CYS SG S 1.005 0.362 -1.983 1.00 . A A . 43 CYS SG 1 1 17 12095 1 1 44 THR C C 5.641 4.143 0.447 1.00 . A A . 44 THR C 1 1 17 12096 1 1 44 THR CA C 4.370 4.599 1.175 1.00 . A A . 44 THR CA 1 1 17 12097 1 1 44 THR CB C 4.603 4.620 2.688 1.00 . A A . 44 THR CB 1 1 17 12098 1 1 44 THR CG2 C 5.452 5.820 3.091 1.00 . A A . 44 THR CG2 1 1 17 12099 1 1 44 THR H H 3.130 2.944 1.496 1.00 . A A . 44 THR H 1 1 17 12100 1 1 44 THR HA H 4.087 5.586 0.839 1.00 . A A . 44 THR HA 1 1 17 12101 1 1 44 THR HB H 5.099 3.707 2.985 1.00 . A A . 44 THR HB 1 1 17 12102 1 1 44 THR HG1 H 2.697 5.118 2.735 1.00 . A A . 44 THR HG1 1 1 17 12103 1 1 44 THR HG21 H 6.410 5.768 2.595 1.00 . A A . 44 THR HG21 1 1 17 12104 1 1 44 THR HG22 H 5.598 5.815 4.161 1.00 . A A . 44 THR HG22 1 1 17 12105 1 1 44 THR HG23 H 4.947 6.731 2.803 1.00 . A A . 44 THR HG23 1 1 17 12106 1 1 44 THR N N 3.320 3.678 0.869 1.00 . A A . 44 THR N 1 1 17 12107 1 1 44 THR O O 6.224 3.099 0.786 1.00 . A A . 44 THR O 1 1 17 12108 1 1 44 THR OG1 O 3.326 4.706 3.337 1.00 . A A . 44 THR OG1 1 1 17 12109 1 1 45 LYS C C 8.306 5.501 -1.158 1.00 . A A . 45 LYS C 1 1 17 12110 1 1 45 LYS CA C 7.161 4.544 -1.386 1.00 . A A . 45 LYS CA 1 1 17 12111 1 1 45 LYS CB C 6.775 4.548 -2.873 1.00 . A A . 45 LYS CB 1 1 17 12112 1 1 45 LYS CD C 5.961 5.821 -4.900 1.00 . A A . 45 LYS CD 1 1 17 12113 1 1 45 LYS CE C 5.002 4.708 -5.297 1.00 . A A . 45 LYS CE 1 1 17 12114 1 1 45 LYS CG C 6.195 5.864 -3.392 1.00 . A A . 45 LYS CG 1 1 17 12115 1 1 45 LYS H H 5.564 5.734 -0.745 1.00 . A A . 45 LYS H 1 1 17 12116 1 1 45 LYS HA H 7.479 3.547 -1.120 1.00 . A A . 45 LYS HA 1 1 17 12117 1 1 45 LYS HB2 H 7.657 4.323 -3.454 1.00 . A A . 45 LYS HB2 1 1 17 12118 1 1 45 LYS HB3 H 6.046 3.770 -3.033 1.00 . A A . 45 LYS HB3 1 1 17 12119 1 1 45 LYS HD2 H 5.550 6.767 -5.220 1.00 . A A . 45 LYS HD2 1 1 17 12120 1 1 45 LYS HD3 H 6.911 5.658 -5.386 1.00 . A A . 45 LYS HD3 1 1 17 12121 1 1 45 LYS HE2 H 5.407 3.767 -4.960 1.00 . A A . 45 LYS HE2 1 1 17 12122 1 1 45 LYS HE3 H 4.049 4.870 -4.817 1.00 . A A . 45 LYS HE3 1 1 17 12123 1 1 45 LYS HG2 H 5.254 6.052 -2.896 1.00 . A A . 45 LYS HG2 1 1 17 12124 1 1 45 LYS HG3 H 6.887 6.663 -3.164 1.00 . A A . 45 LYS HG3 1 1 17 12125 1 1 45 LYS HZ1 H 4.441 5.515 -7.158 1.00 . A A . 45 LYS HZ1 1 1 17 12126 1 1 45 LYS HZ2 H 4.104 3.874 -6.949 1.00 . A A . 45 LYS HZ2 1 1 17 12127 1 1 45 LYS HZ3 H 5.686 4.353 -7.238 1.00 . A A . 45 LYS HZ3 1 1 17 12128 1 1 45 LYS N N 6.028 4.884 -0.560 1.00 . A A . 45 LYS N 1 1 17 12129 1 1 45 LYS NZ N 4.802 4.623 -6.762 1.00 . A A . 45 LYS NZ 1 1 17 12130 1 1 45 LYS O O 8.157 6.512 -0.460 1.00 . A A . 45 LYS O 1 1 17 12131 1 1 46 ASN C C 10.722 6.788 -2.921 1.00 . A A . 46 ASN C 1 1 17 12132 1 1 46 ASN CA C 10.595 6.025 -1.630 1.00 . A A . 46 ASN CA 1 1 17 12133 1 1 46 ASN CB C 11.888 5.223 -1.365 1.00 . A A . 46 ASN CB 1 1 17 12134 1 1 46 ASN CG C 11.846 4.412 -0.078 1.00 . A A . 46 ASN CG 1 1 17 12135 1 1 46 ASN H H 9.513 4.345 -2.237 1.00 . A A . 46 ASN H 1 1 17 12136 1 1 46 ASN HA H 10.435 6.724 -0.822 1.00 . A A . 46 ASN HA 1 1 17 12137 1 1 46 ASN HB2 H 12.065 4.546 -2.187 1.00 . A A . 46 ASN HB2 1 1 17 12138 1 1 46 ASN HB3 H 12.715 5.915 -1.304 1.00 . A A . 46 ASN HB3 1 1 17 12139 1 1 46 ASN HD21 H 11.159 2.856 -1.070 1.00 . A A . 46 ASN HD21 1 1 17 12140 1 1 46 ASN HD22 H 11.344 2.618 0.629 1.00 . A A . 46 ASN HD22 1 1 17 12141 1 1 46 ASN N N 9.439 5.175 -1.717 1.00 . A A . 46 ASN N 1 1 17 12142 1 1 46 ASN ND2 N 11.415 3.176 -0.176 1.00 . A A . 46 ASN ND2 1 1 17 12143 1 1 46 ASN O O 10.647 6.208 -4.006 1.00 . A A . 46 ASN O 1 1 17 12144 1 1 46 ASN OD1 O 12.225 4.894 1.002 1.00 . A A . 46 ASN OD1 1 1 17 12145 1 1 47 CYS C C 12.246 9.802 -3.687 1.00 . A A . 47 CYS C 1 1 17 12146 1 1 47 CYS CA C 11.033 8.917 -3.923 1.00 . A A . 47 CYS CA 1 1 17 12147 1 1 47 CYS CB C 9.737 9.710 -4.210 1.00 . A A . 47 CYS CB 1 1 17 12148 1 1 47 CYS H H 10.870 8.473 -1.922 1.00 . A A . 47 CYS H 1 1 17 12149 1 1 47 CYS HA H 11.255 8.285 -4.772 1.00 . A A . 47 CYS HA 1 1 17 12150 1 1 47 CYS HB2 H 9.966 10.543 -4.858 1.00 . A A . 47 CYS HB2 1 1 17 12151 1 1 47 CYS HB3 H 9.030 9.063 -4.709 1.00 . A A . 47 CYS HB3 1 1 17 12152 1 1 47 CYS N N 10.864 8.050 -2.812 1.00 . A A . 47 CYS N 1 1 17 12153 1 1 47 CYS O O 13.303 9.542 -4.292 1.00 . A A . 47 CYS O 1 1 17 12154 1 1 47 CYS OXT O 12.202 10.690 -2.819 1.00 . A A . 47 CYS OXT 1 1 17 12155 1 1 47 CYS SG S 8.895 10.409 -2.740 1.00 . A A . 47 CYS SG 1 1 18 12156 1 1 1 LYS C C 11.425 9.755 0.365 1.00 . A A . 1 LYS C 1 1 18 12157 1 1 1 LYS CA C 12.507 10.818 0.552 1.00 . A A . 1 LYS CA 1 1 18 12158 1 1 1 LYS CB C 13.886 10.160 0.649 1.00 . A A . 1 LYS CB 1 1 18 12159 1 1 1 LYS CD C 15.460 8.636 1.910 1.00 . A A . 1 LYS CD 1 1 18 12160 1 1 1 LYS CE C 16.562 9.683 2.012 1.00 . A A . 1 LYS CE 1 1 18 12161 1 1 1 LYS CG C 14.078 9.274 1.878 1.00 . A A . 1 LYS CG 1 1 18 12162 1 1 1 LYS H1 H 13.016 12.395 1.796 1.00 . A A . 1 LYS H1 1 1 18 12163 1 1 1 LYS H2 H 12.200 11.180 2.605 1.00 . A A . 1 LYS H2 1 1 18 12164 1 1 1 LYS H3 H 11.368 12.233 1.565 1.00 . A A . 1 LYS H3 1 1 18 12165 1 1 1 LYS HA H 12.470 11.435 -0.327 1.00 . A A . 1 LYS HA 1 1 18 12166 1 1 1 LYS HB2 H 14.027 9.547 -0.229 1.00 . A A . 1 LYS HB2 1 1 18 12167 1 1 1 LYS HB3 H 14.640 10.931 0.659 1.00 . A A . 1 LYS HB3 1 1 18 12168 1 1 1 LYS HD2 H 15.521 7.976 2.763 1.00 . A A . 1 LYS HD2 1 1 18 12169 1 1 1 LYS HD3 H 15.600 8.063 1.006 1.00 . A A . 1 LYS HD3 1 1 18 12170 1 1 1 LYS HE2 H 16.527 10.316 1.137 1.00 . A A . 1 LYS HE2 1 1 18 12171 1 1 1 LYS HE3 H 16.397 10.281 2.895 1.00 . A A . 1 LYS HE3 1 1 18 12172 1 1 1 LYS HG2 H 13.956 9.877 2.765 1.00 . A A . 1 LYS HG2 1 1 18 12173 1 1 1 LYS HG3 H 13.330 8.495 1.866 1.00 . A A . 1 LYS HG3 1 1 18 12174 1 1 1 LYS HZ1 H 18.623 9.817 2.176 1.00 . A A . 1 LYS HZ1 1 1 18 12175 1 1 1 LYS HZ2 H 18.113 8.525 1.227 1.00 . A A . 1 LYS HZ2 1 1 18 12176 1 1 1 LYS HZ3 H 17.976 8.446 2.913 1.00 . A A . 1 LYS HZ3 1 1 18 12177 1 1 1 LYS N N 12.247 11.700 1.707 1.00 . A A . 1 LYS N 1 1 18 12178 1 1 1 LYS NZ N 17.901 9.073 2.085 1.00 . A A . 1 LYS NZ 1 1 18 12179 1 1 1 LYS O O 11.604 8.806 -0.400 1.00 . A A . 1 LYS O 1 1 18 12180 1 1 2 THR C C 7.949 9.662 0.505 1.00 . A A . 2 THR C 1 1 18 12181 1 1 2 THR CA C 9.231 8.968 0.889 1.00 . A A . 2 THR CA 1 1 18 12182 1 1 2 THR CB C 9.037 8.101 2.156 1.00 . A A . 2 THR CB 1 1 18 12183 1 1 2 THR CG2 C 10.078 7.000 2.230 1.00 . A A . 2 THR CG2 1 1 18 12184 1 1 2 THR H H 10.185 10.713 1.569 1.00 . A A . 2 THR H 1 1 18 12185 1 1 2 THR HA H 9.498 8.318 0.068 1.00 . A A . 2 THR HA 1 1 18 12186 1 1 2 THR HB H 8.058 7.650 2.092 1.00 . A A . 2 THR HB 1 1 18 12187 1 1 2 THR HG1 H 8.165 9.152 3.562 1.00 . A A . 2 THR HG1 1 1 18 12188 1 1 2 THR HG21 H 9.978 6.382 1.350 1.00 . A A . 2 THR HG21 1 1 18 12189 1 1 2 THR HG22 H 9.917 6.405 3.117 1.00 . A A . 2 THR HG22 1 1 18 12190 1 1 2 THR HG23 H 11.066 7.437 2.253 1.00 . A A . 2 THR HG23 1 1 18 12191 1 1 2 THR N N 10.314 9.917 1.015 1.00 . A A . 2 THR N 1 1 18 12192 1 1 2 THR O O 7.559 10.657 1.114 1.00 . A A . 2 THR O 1 1 18 12193 1 1 2 THR OG1 O 9.076 8.908 3.346 1.00 . A A . 2 THR OG1 1 1 18 12194 1 1 3 CYS C C 4.962 8.800 -0.871 1.00 . A A . 3 CYS C 1 1 18 12195 1 1 3 CYS CA C 6.119 9.748 -1.013 1.00 . A A . 3 CYS CA 1 1 18 12196 1 1 3 CYS CB C 6.307 10.169 -2.482 1.00 . A A . 3 CYS CB 1 1 18 12197 1 1 3 CYS H H 7.642 8.316 -0.891 1.00 . A A . 3 CYS H 1 1 18 12198 1 1 3 CYS HA H 5.913 10.633 -0.430 1.00 . A A . 3 CYS HA 1 1 18 12199 1 1 3 CYS HB2 H 6.678 9.324 -3.043 1.00 . A A . 3 CYS HB2 1 1 18 12200 1 1 3 CYS HB3 H 5.351 10.468 -2.887 1.00 . A A . 3 CYS HB3 1 1 18 12201 1 1 3 CYS N N 7.316 9.156 -0.494 1.00 . A A . 3 CYS N 1 1 18 12202 1 1 3 CYS O O 5.106 7.580 -1.071 1.00 . A A . 3 CYS O 1 1 18 12203 1 1 3 CYS SG S 7.485 11.560 -2.734 1.00 . A A . 3 CYS SG 1 1 18 12204 1 1 4 GLU C C 1.953 8.579 -1.687 1.00 . A A . 4 GLU C 1 1 18 12205 1 1 4 GLU CA C 2.644 8.568 -0.346 1.00 . A A . 4 GLU CA 1 1 18 12206 1 1 4 GLU CB C 1.730 9.228 0.668 1.00 . A A . 4 GLU CB 1 1 18 12207 1 1 4 GLU CD C 1.192 7.369 2.214 1.00 . A A . 4 GLU CD 1 1 18 12208 1 1 4 GLU CG C 0.655 8.319 1.190 1.00 . A A . 4 GLU CG 1 1 18 12209 1 1 4 GLU H H 3.775 10.305 -0.330 1.00 . A A . 4 GLU H 1 1 18 12210 1 1 4 GLU HA H 2.884 7.563 -0.037 1.00 . A A . 4 GLU HA 1 1 18 12211 1 1 4 GLU HB2 H 2.325 9.561 1.505 1.00 . A A . 4 GLU HB2 1 1 18 12212 1 1 4 GLU HB3 H 1.260 10.083 0.206 1.00 . A A . 4 GLU HB3 1 1 18 12213 1 1 4 GLU HG2 H -0.150 8.898 1.611 1.00 . A A . 4 GLU HG2 1 1 18 12214 1 1 4 GLU HG3 H 0.282 7.739 0.359 1.00 . A A . 4 GLU HG3 1 1 18 12215 1 1 4 GLU N N 3.834 9.340 -0.499 1.00 . A A . 4 GLU N 1 1 18 12216 1 1 4 GLU O O 1.652 9.657 -2.225 1.00 . A A . 4 GLU O 1 1 18 12217 1 1 4 GLU OE1 O 1.793 6.369 1.851 1.00 . A A . 4 GLU OE1 1 1 18 12218 1 1 4 GLU OE2 O 1.035 7.652 3.428 1.00 . A A . 4 GLU OE2 1 1 18 12219 1 1 5 ASN C C 0.332 6.107 -3.710 1.00 . A A . 5 ASN C 1 1 18 12220 1 1 5 ASN CA C 1.115 7.387 -3.558 1.00 . A A . 5 ASN CA 1 1 18 12221 1 1 5 ASN CB C 2.196 7.520 -4.657 1.00 . A A . 5 ASN CB 1 1 18 12222 1 1 5 ASN CG C 1.605 7.803 -6.030 1.00 . A A . 5 ASN CG 1 1 18 12223 1 1 5 ASN H H 1.915 6.603 -1.757 1.00 . A A . 5 ASN H 1 1 18 12224 1 1 5 ASN HA H 0.433 8.221 -3.636 1.00 . A A . 5 ASN HA 1 1 18 12225 1 1 5 ASN HB2 H 2.865 8.327 -4.401 1.00 . A A . 5 ASN HB2 1 1 18 12226 1 1 5 ASN HB3 H 2.758 6.600 -4.708 1.00 . A A . 5 ASN HB3 1 1 18 12227 1 1 5 ASN HD21 H 3.175 7.002 -6.955 1.00 . A A . 5 ASN HD21 1 1 18 12228 1 1 5 ASN HD22 H 1.930 7.623 -7.955 1.00 . A A . 5 ASN HD22 1 1 18 12229 1 1 5 ASN N N 1.717 7.434 -2.245 1.00 . A A . 5 ASN N 1 1 18 12230 1 1 5 ASN ND2 N 2.305 7.439 -7.067 1.00 . A A . 5 ASN ND2 1 1 18 12231 1 1 5 ASN O O 0.588 5.136 -2.995 1.00 . A A . 5 ASN O 1 1 18 12232 1 1 5 ASN OD1 O 0.528 8.378 -6.145 1.00 . A A . 5 ASN OD1 1 1 18 12233 1 1 6 LEU C C -0.722 3.721 -5.201 1.00 . A A . 6 LEU C 1 1 18 12234 1 1 6 LEU CA C -1.483 4.980 -4.854 1.00 . A A . 6 LEU CA 1 1 18 12235 1 1 6 LEU CB C -2.529 5.288 -5.928 1.00 . A A . 6 LEU CB 1 1 18 12236 1 1 6 LEU CD1 C -4.563 6.548 -6.676 1.00 . A A . 6 LEU CD1 1 1 18 12237 1 1 6 LEU CD2 C -4.420 5.680 -4.383 1.00 . A A . 6 LEU CD2 1 1 18 12238 1 1 6 LEU CG C -3.632 6.261 -5.520 1.00 . A A . 6 LEU CG 1 1 18 12239 1 1 6 LEU H H -0.746 6.925 -5.150 1.00 . A A . 6 LEU H 1 1 18 12240 1 1 6 LEU HA H -2.009 4.788 -3.931 1.00 . A A . 6 LEU HA 1 1 18 12241 1 1 6 LEU HB2 H -2.017 5.699 -6.785 1.00 . A A . 6 LEU HB2 1 1 18 12242 1 1 6 LEU HB3 H -2.993 4.358 -6.222 1.00 . A A . 6 LEU HB3 1 1 18 12243 1 1 6 LEU HD11 H -5.029 5.629 -6.995 1.00 . A A . 6 LEU HD11 1 1 18 12244 1 1 6 LEU HD12 H -4.011 6.988 -7.494 1.00 . A A . 6 LEU HD12 1 1 18 12245 1 1 6 LEU HD13 H -5.324 7.232 -6.333 1.00 . A A . 6 LEU HD13 1 1 18 12246 1 1 6 LEU HD21 H -4.789 4.705 -4.662 1.00 . A A . 6 LEU HD21 1 1 18 12247 1 1 6 LEU HD22 H -5.257 6.329 -4.169 1.00 . A A . 6 LEU HD22 1 1 18 12248 1 1 6 LEU HD23 H -3.803 5.597 -3.500 1.00 . A A . 6 LEU HD23 1 1 18 12249 1 1 6 LEU HG H -3.197 7.190 -5.184 1.00 . A A . 6 LEU HG 1 1 18 12250 1 1 6 LEU N N -0.621 6.113 -4.613 1.00 . A A . 6 LEU N 1 1 18 12251 1 1 6 LEU O O 0.294 3.754 -5.925 1.00 . A A . 6 LEU O 1 1 18 12252 1 1 7 ALA C C -0.786 0.991 -6.356 1.00 . A A . 7 ALA C 1 1 18 12253 1 1 7 ALA CA C -0.680 1.311 -4.871 1.00 . A A . 7 ALA CA 1 1 18 12254 1 1 7 ALA CB C -1.460 0.326 -4.039 1.00 . A A . 7 ALA CB 1 1 18 12255 1 1 7 ALA H H -1.937 2.751 -3.998 1.00 . A A . 7 ALA H 1 1 18 12256 1 1 7 ALA HA H 0.358 1.286 -4.569 1.00 . A A . 7 ALA HA 1 1 18 12257 1 1 7 ALA HB1 H -1.363 0.591 -2.997 1.00 . A A . 7 ALA HB1 1 1 18 12258 1 1 7 ALA HB2 H -1.078 -0.672 -4.193 1.00 . A A . 7 ALA HB2 1 1 18 12259 1 1 7 ALA HB3 H -2.501 0.373 -4.321 1.00 . A A . 7 ALA HB3 1 1 18 12260 1 1 7 ALA N N -1.196 2.635 -4.633 1.00 . A A . 7 ALA N 1 1 18 12261 1 1 7 ALA O O -1.823 1.246 -6.984 1.00 . A A . 7 ALA O 1 1 18 12262 1 1 8 ASP C C -0.258 -1.016 -8.819 1.00 . A A . 8 ASP C 1 1 18 12263 1 1 8 ASP CA C 0.393 0.271 -8.329 1.00 . A A . 8 ASP CA 1 1 18 12264 1 1 8 ASP CB C 1.882 0.272 -8.704 1.00 . A A . 8 ASP CB 1 1 18 12265 1 1 8 ASP CG C 2.619 1.513 -8.236 1.00 . A A . 8 ASP CG 1 1 18 12266 1 1 8 ASP H H 0.971 0.116 -6.309 1.00 . A A . 8 ASP H 1 1 18 12267 1 1 8 ASP HA H -0.072 1.114 -8.818 1.00 . A A . 8 ASP HA 1 1 18 12268 1 1 8 ASP HB2 H 2.348 -0.585 -8.243 1.00 . A A . 8 ASP HB2 1 1 18 12269 1 1 8 ASP HB3 H 1.978 0.195 -9.777 1.00 . A A . 8 ASP HB3 1 1 18 12270 1 1 8 ASP N N 0.256 0.443 -6.896 1.00 . A A . 8 ASP N 1 1 18 12271 1 1 8 ASP O O -1.078 -0.991 -9.736 1.00 . A A . 8 ASP O 1 1 18 12272 1 1 8 ASP OD1 O 3.156 1.516 -7.093 1.00 . A A . 8 ASP OD1 1 1 18 12273 1 1 8 ASP OD2 O 2.690 2.503 -8.991 1.00 . A A . 8 ASP OD2 1 1 18 12274 1 1 9 THR C C -1.758 -3.718 -7.848 1.00 . A A . 9 THR C 1 1 18 12275 1 1 9 THR CA C -0.430 -3.405 -8.585 1.00 . A A . 9 THR CA 1 1 18 12276 1 1 9 THR CB C 0.623 -4.465 -8.218 1.00 . A A . 9 THR CB 1 1 18 12277 1 1 9 THR CG2 C 0.348 -5.762 -8.929 1.00 . A A . 9 THR CG2 1 1 18 12278 1 1 9 THR H H 0.711 -2.120 -7.459 1.00 . A A . 9 THR H 1 1 18 12279 1 1 9 THR HA H -0.580 -3.424 -9.653 1.00 . A A . 9 THR HA 1 1 18 12280 1 1 9 THR HB H 0.601 -4.628 -7.150 1.00 . A A . 9 THR HB 1 1 18 12281 1 1 9 THR HG1 H 2.476 -4.110 -7.804 1.00 . A A . 9 THR HG1 1 1 18 12282 1 1 9 THR HG21 H -0.633 -6.107 -8.641 1.00 . A A . 9 THR HG21 1 1 18 12283 1 1 9 THR HG22 H 1.100 -6.484 -8.649 1.00 . A A . 9 THR HG22 1 1 18 12284 1 1 9 THR HG23 H 0.377 -5.581 -9.993 1.00 . A A . 9 THR HG23 1 1 18 12285 1 1 9 THR N N 0.071 -2.117 -8.199 1.00 . A A . 9 THR N 1 1 18 12286 1 1 9 THR O O -2.567 -4.542 -8.303 1.00 . A A . 9 THR O 1 1 18 12287 1 1 9 THR OG1 O 1.932 -3.999 -8.604 1.00 . A A . 9 THR OG1 1 1 18 12288 1 1 10 TYR C C -4.327 -2.522 -6.532 1.00 . A A . 10 TYR C 1 1 18 12289 1 1 10 TYR CA C -3.158 -3.272 -5.908 1.00 . A A . 10 TYR CA 1 1 18 12290 1 1 10 TYR CB C -2.889 -2.768 -4.489 1.00 . A A . 10 TYR CB 1 1 18 12291 1 1 10 TYR CD1 C -3.574 -4.241 -2.573 1.00 . A A . 10 TYR CD1 1 1 18 12292 1 1 10 TYR CD2 C -5.053 -2.492 -3.193 1.00 . A A . 10 TYR CD2 1 1 18 12293 1 1 10 TYR CE1 C -4.416 -4.605 -1.554 1.00 . A A . 10 TYR CE1 1 1 18 12294 1 1 10 TYR CE2 C -5.912 -2.858 -2.177 1.00 . A A . 10 TYR CE2 1 1 18 12295 1 1 10 TYR CG C -3.869 -3.183 -3.410 1.00 . A A . 10 TYR CG 1 1 18 12296 1 1 10 TYR CZ C -5.582 -3.912 -1.357 1.00 . A A . 10 TYR CZ 1 1 18 12297 1 1 10 TYR H H -1.315 -2.384 -6.442 1.00 . A A . 10 TYR H 1 1 18 12298 1 1 10 TYR HA H -3.373 -4.329 -5.886 1.00 . A A . 10 TYR HA 1 1 18 12299 1 1 10 TYR HB2 H -1.913 -3.110 -4.178 1.00 . A A . 10 TYR HB2 1 1 18 12300 1 1 10 TYR HB3 H -2.877 -1.689 -4.524 1.00 . A A . 10 TYR HB3 1 1 18 12301 1 1 10 TYR HD1 H -2.656 -4.789 -2.730 1.00 . A A . 10 TYR HD1 1 1 18 12302 1 1 10 TYR HD2 H -5.308 -1.667 -3.841 1.00 . A A . 10 TYR HD2 1 1 18 12303 1 1 10 TYR HE1 H -4.148 -5.440 -0.923 1.00 . A A . 10 TYR HE1 1 1 18 12304 1 1 10 TYR HE2 H -6.829 -2.305 -2.028 1.00 . A A . 10 TYR HE2 1 1 18 12305 1 1 10 TYR HH H -5.900 -4.294 0.481 1.00 . A A . 10 TYR HH 1 1 18 12306 1 1 10 TYR N N -1.976 -3.051 -6.727 1.00 . A A . 10 TYR N 1 1 18 12307 1 1 10 TYR O O -4.499 -1.316 -6.326 1.00 . A A . 10 TYR O 1 1 18 12308 1 1 10 TYR OH O -6.416 -4.266 -0.330 1.00 . A A . 10 TYR OH 1 1 18 12309 1 1 11 LYS C C -7.527 -2.982 -7.446 1.00 . A A . 11 LYS C 1 1 18 12310 1 1 11 LYS CA C -6.194 -2.616 -8.059 1.00 . A A . 11 LYS CA 1 1 18 12311 1 1 11 LYS CB C -6.122 -2.994 -9.536 1.00 . A A . 11 LYS CB 1 1 18 12312 1 1 11 LYS CD C -4.769 -2.924 -11.678 1.00 . A A . 11 LYS CD 1 1 18 12313 1 1 11 LYS CE C -4.350 -4.390 -11.674 1.00 . A A . 11 LYS CE 1 1 18 12314 1 1 11 LYS CG C -4.927 -2.384 -10.262 1.00 . A A . 11 LYS CG 1 1 18 12315 1 1 11 LYS H H -4.894 -4.172 -7.432 1.00 . A A . 11 LYS H 1 1 18 12316 1 1 11 LYS HA H -6.082 -1.549 -7.964 1.00 . A A . 11 LYS HA 1 1 18 12317 1 1 11 LYS HB2 H -6.054 -4.069 -9.607 1.00 . A A . 11 LYS HB2 1 1 18 12318 1 1 11 LYS HB3 H -7.025 -2.666 -10.028 1.00 . A A . 11 LYS HB3 1 1 18 12319 1 1 11 LYS HD2 H -5.714 -2.834 -12.191 1.00 . A A . 11 LYS HD2 1 1 18 12320 1 1 11 LYS HD3 H -4.021 -2.343 -12.198 1.00 . A A . 11 LYS HD3 1 1 18 12321 1 1 11 LYS HE2 H -3.429 -4.485 -11.119 1.00 . A A . 11 LYS HE2 1 1 18 12322 1 1 11 LYS HE3 H -5.116 -4.977 -11.191 1.00 . A A . 11 LYS HE3 1 1 18 12323 1 1 11 LYS HG2 H -5.064 -1.314 -10.314 1.00 . A A . 11 LYS HG2 1 1 18 12324 1 1 11 LYS HG3 H -4.032 -2.602 -9.698 1.00 . A A . 11 LYS HG3 1 1 18 12325 1 1 11 LYS HZ1 H -3.808 -5.895 -12.995 1.00 . A A . 11 LYS HZ1 1 1 18 12326 1 1 11 LYS HZ2 H -3.410 -4.356 -13.530 1.00 . A A . 11 LYS HZ2 1 1 18 12327 1 1 11 LYS HZ3 H -5.013 -4.876 -13.598 1.00 . A A . 11 LYS HZ3 1 1 18 12328 1 1 11 LYS N N -5.086 -3.214 -7.328 1.00 . A A . 11 LYS N 1 1 18 12329 1 1 11 LYS NZ N -4.137 -4.911 -13.037 1.00 . A A . 11 LYS NZ 1 1 18 12330 1 1 11 LYS O O -8.588 -2.701 -8.000 1.00 . A A . 11 LYS O 1 1 18 12331 1 1 12 GLY C C -8.946 -2.890 -4.491 1.00 . A A . 12 GLY C 1 1 18 12332 1 1 12 GLY CA C -8.641 -3.909 -5.570 1.00 . A A . 12 GLY CA 1 1 18 12333 1 1 12 GLY H H -6.562 -3.700 -5.932 1.00 . A A . 12 GLY H 1 1 18 12334 1 1 12 GLY HA2 H -9.467 -3.956 -6.264 1.00 . A A . 12 GLY HA2 1 1 18 12335 1 1 12 GLY HA3 H -8.500 -4.877 -5.111 1.00 . A A . 12 GLY HA3 1 1 18 12336 1 1 12 GLY N N -7.458 -3.546 -6.292 1.00 . A A . 12 GLY N 1 1 18 12337 1 1 12 GLY O O -8.206 -1.892 -4.355 1.00 . A A . 12 GLY O 1 1 18 12338 1 1 13 PRO C C -9.856 -2.749 -1.312 1.00 . A A . 13 PRO C 1 1 18 12339 1 1 13 PRO CA C -10.383 -2.204 -2.640 1.00 . A A . 13 PRO CA 1 1 18 12340 1 1 13 PRO CB C -11.919 -2.244 -2.650 1.00 . A A . 13 PRO CB 1 1 18 12341 1 1 13 PRO CD C -11.023 -4.130 -3.903 1.00 . A A . 13 PRO CD 1 1 18 12342 1 1 13 PRO CG C -12.301 -3.450 -3.479 1.00 . A A . 13 PRO CG 1 1 18 12343 1 1 13 PRO HA H -10.039 -1.191 -2.790 1.00 . A A . 13 PRO HA 1 1 18 12344 1 1 13 PRO HB2 H -12.279 -2.335 -1.636 1.00 . A A . 13 PRO HB2 1 1 18 12345 1 1 13 PRO HB3 H -12.301 -1.333 -3.085 1.00 . A A . 13 PRO HB3 1 1 18 12346 1 1 13 PRO HD2 H -10.804 -4.962 -3.250 1.00 . A A . 13 PRO HD2 1 1 18 12347 1 1 13 PRO HD3 H -11.075 -4.456 -4.929 1.00 . A A . 13 PRO HD3 1 1 18 12348 1 1 13 PRO HG2 H -12.896 -4.125 -2.881 1.00 . A A . 13 PRO HG2 1 1 18 12349 1 1 13 PRO HG3 H -12.868 -3.138 -4.343 1.00 . A A . 13 PRO HG3 1 1 18 12350 1 1 13 PRO N N -10.027 -3.074 -3.737 1.00 . A A . 13 PRO N 1 1 18 12351 1 1 13 PRO O O -9.874 -3.966 -1.071 1.00 . A A . 13 PRO O 1 1 18 12352 1 1 14 CYS C C -10.018 -2.364 1.816 1.00 . A A . 14 CYS C 1 1 18 12353 1 1 14 CYS CA C -8.894 -2.313 0.811 1.00 . A A . 14 CYS CA 1 1 18 12354 1 1 14 CYS CB C -7.771 -1.415 1.347 1.00 . A A . 14 CYS CB 1 1 18 12355 1 1 14 CYS H H -9.375 -0.930 -0.703 1.00 . A A . 14 CYS H 1 1 18 12356 1 1 14 CYS HA H -8.502 -3.312 0.684 1.00 . A A . 14 CYS HA 1 1 18 12357 1 1 14 CYS HB2 H -6.921 -1.468 0.683 1.00 . A A . 14 CYS HB2 1 1 18 12358 1 1 14 CYS HB3 H -8.124 -0.395 1.400 1.00 . A A . 14 CYS HB3 1 1 18 12359 1 1 14 CYS N N -9.381 -1.886 -0.467 1.00 . A A . 14 CYS N 1 1 18 12360 1 1 14 CYS O O -10.703 -1.363 2.049 1.00 . A A . 14 CYS O 1 1 18 12361 1 1 14 CYS SG S -7.220 -1.909 3.026 1.00 . A A . 14 CYS SG 1 1 18 12362 1 1 15 PHE C C -10.383 -4.078 4.664 1.00 . A A . 15 PHE C 1 1 18 12363 1 1 15 PHE CA C -11.180 -3.691 3.445 1.00 . A A . 15 PHE CA 1 1 18 12364 1 1 15 PHE CB C -12.214 -4.768 3.114 1.00 . A A . 15 PHE CB 1 1 18 12365 1 1 15 PHE CD1 C -12.831 -5.303 0.745 1.00 . A A . 15 PHE CD1 1 1 18 12366 1 1 15 PHE CD2 C -13.866 -3.424 1.782 1.00 . A A . 15 PHE CD2 1 1 18 12367 1 1 15 PHE CE1 C -13.534 -5.054 -0.413 1.00 . A A . 15 PHE CE1 1 1 18 12368 1 1 15 PHE CE2 C -14.573 -3.169 0.626 1.00 . A A . 15 PHE CE2 1 1 18 12369 1 1 15 PHE CG C -12.988 -4.495 1.855 1.00 . A A . 15 PHE CG 1 1 18 12370 1 1 15 PHE CZ C -14.407 -3.986 -0.473 1.00 . A A . 15 PHE CZ 1 1 18 12371 1 1 15 PHE H H -9.753 -4.310 2.035 1.00 . A A . 15 PHE H 1 1 18 12372 1 1 15 PHE HA H -11.668 -2.744 3.621 1.00 . A A . 15 PHE HA 1 1 18 12373 1 1 15 PHE HB2 H -11.711 -5.716 2.997 1.00 . A A . 15 PHE HB2 1 1 18 12374 1 1 15 PHE HB3 H -12.915 -4.841 3.931 1.00 . A A . 15 PHE HB3 1 1 18 12375 1 1 15 PHE HD1 H -12.150 -6.140 0.791 1.00 . A A . 15 PHE HD1 1 1 18 12376 1 1 15 PHE HD2 H -13.995 -2.785 2.644 1.00 . A A . 15 PHE HD2 1 1 18 12377 1 1 15 PHE HE1 H -13.399 -5.695 -1.272 1.00 . A A . 15 PHE HE1 1 1 18 12378 1 1 15 PHE HE2 H -15.255 -2.332 0.580 1.00 . A A . 15 PHE HE2 1 1 18 12379 1 1 15 PHE HZ H -14.959 -3.788 -1.380 1.00 . A A . 15 PHE HZ 1 1 18 12380 1 1 15 PHE N N -10.239 -3.523 2.367 1.00 . A A . 15 PHE N 1 1 18 12381 1 1 15 PHE O O -10.488 -3.469 5.733 1.00 . A A . 15 PHE O 1 1 18 12382 1 1 16 THR C C -7.325 -4.782 5.224 1.00 . A A . 16 THR C 1 1 18 12383 1 1 16 THR CA C -8.649 -5.500 5.478 1.00 . A A . 16 THR CA 1 1 18 12384 1 1 16 THR CB C -8.437 -7.014 5.365 1.00 . A A . 16 THR CB 1 1 18 12385 1 1 16 THR CG2 C -7.672 -7.543 6.567 1.00 . A A . 16 THR CG2 1 1 18 12386 1 1 16 THR H H -9.560 -5.556 3.633 1.00 . A A . 16 THR H 1 1 18 12387 1 1 16 THR HA H -9.037 -5.257 6.456 1.00 . A A . 16 THR HA 1 1 18 12388 1 1 16 THR HB H -7.874 -7.213 4.466 1.00 . A A . 16 THR HB 1 1 18 12389 1 1 16 THR HG1 H -10.086 -7.722 6.184 1.00 . A A . 16 THR HG1 1 1 18 12390 1 1 16 THR HG21 H -8.227 -7.338 7.470 1.00 . A A . 16 THR HG21 1 1 18 12391 1 1 16 THR HG22 H -6.708 -7.059 6.620 1.00 . A A . 16 THR HG22 1 1 18 12392 1 1 16 THR HG23 H -7.535 -8.609 6.463 1.00 . A A . 16 THR HG23 1 1 18 12393 1 1 16 THR N N -9.560 -5.068 4.482 1.00 . A A . 16 THR N 1 1 18 12394 1 1 16 THR O O -6.693 -4.980 4.173 1.00 . A A . 16 THR O 1 1 18 12395 1 1 16 THR OG1 O -9.717 -7.665 5.293 1.00 . A A . 16 THR OG1 1 1 18 12396 1 1 17 THR C C -4.482 -4.076 5.878 1.00 . A A . 17 THR C 1 1 18 12397 1 1 17 THR CA C -5.714 -3.162 6.017 1.00 . A A . 17 THR CA 1 1 18 12398 1 1 17 THR CB C -5.560 -2.225 7.226 1.00 . A A . 17 THR CB 1 1 18 12399 1 1 17 THR CG2 C -4.433 -1.222 7.000 1.00 . A A . 17 THR CG2 1 1 18 12400 1 1 17 THR H H -7.453 -3.848 6.974 1.00 . A A . 17 THR H 1 1 18 12401 1 1 17 THR HA H -5.808 -2.564 5.123 1.00 . A A . 17 THR HA 1 1 18 12402 1 1 17 THR HB H -5.346 -2.823 8.098 1.00 . A A . 17 THR HB 1 1 18 12403 1 1 17 THR HG1 H -7.296 -1.522 6.588 1.00 . A A . 17 THR HG1 1 1 18 12404 1 1 17 THR HG21 H -4.355 -0.568 7.855 1.00 . A A . 17 THR HG21 1 1 18 12405 1 1 17 THR HG22 H -4.643 -0.638 6.115 1.00 . A A . 17 THR HG22 1 1 18 12406 1 1 17 THR HG23 H -3.504 -1.756 6.867 1.00 . A A . 17 THR HG23 1 1 18 12407 1 1 17 THR N N -6.921 -3.947 6.155 1.00 . A A . 17 THR N 1 1 18 12408 1 1 17 THR O O -3.555 -3.776 5.123 1.00 . A A . 17 THR O 1 1 18 12409 1 1 17 THR OG1 O -6.804 -1.508 7.422 1.00 . A A . 17 THR OG1 1 1 18 12410 1 1 18 GLY C C -3.149 -6.676 5.105 1.00 . A A . 18 GLY C 1 1 18 12411 1 1 18 GLY CA C -3.454 -6.189 6.509 1.00 . A A . 18 GLY CA 1 1 18 12412 1 1 18 GLY H H -5.304 -5.400 7.132 1.00 . A A . 18 GLY H 1 1 18 12413 1 1 18 GLY HA2 H -2.564 -5.724 6.909 1.00 . A A . 18 GLY HA2 1 1 18 12414 1 1 18 GLY HA3 H -3.718 -7.033 7.127 1.00 . A A . 18 GLY HA3 1 1 18 12415 1 1 18 GLY N N -4.529 -5.220 6.557 1.00 . A A . 18 GLY N 1 1 18 12416 1 1 18 GLY O O -1.985 -6.881 4.762 1.00 . A A . 18 GLY O 1 1 18 12417 1 1 19 SER C C -3.270 -6.234 2.092 1.00 . A A . 19 SER C 1 1 18 12418 1 1 19 SER CA C -4.043 -7.273 2.912 1.00 . A A . 19 SER CA 1 1 18 12419 1 1 19 SER CB C -5.430 -7.470 2.326 1.00 . A A . 19 SER CB 1 1 18 12420 1 1 19 SER H H -5.098 -6.645 4.597 1.00 . A A . 19 SER H 1 1 18 12421 1 1 19 SER HA H -3.516 -8.214 2.903 1.00 . A A . 19 SER HA 1 1 18 12422 1 1 19 SER HB2 H -5.885 -6.507 2.148 1.00 . A A . 19 SER HB2 1 1 18 12423 1 1 19 SER HB3 H -5.360 -8.018 1.399 1.00 . A A . 19 SER HB3 1 1 18 12424 1 1 19 SER HG H -6.146 -9.139 3.017 1.00 . A A . 19 SER HG 1 1 18 12425 1 1 19 SER N N -4.185 -6.822 4.285 1.00 . A A . 19 SER N 1 1 18 12426 1 1 19 SER O O -2.403 -6.566 1.288 1.00 . A A . 19 SER O 1 1 18 12427 1 1 19 SER OG O -6.235 -8.201 3.229 1.00 . A A . 19 SER OG 1 1 18 12428 1 1 20 CYS C C -1.498 -3.738 2.123 1.00 . A A . 20 CYS C 1 1 18 12429 1 1 20 CYS CA C -2.932 -3.867 1.659 1.00 . A A . 20 CYS CA 1 1 18 12430 1 1 20 CYS CB C -3.692 -2.589 1.956 1.00 . A A . 20 CYS CB 1 1 18 12431 1 1 20 CYS H H -4.234 -4.780 3.043 1.00 . A A . 20 CYS H 1 1 18 12432 1 1 20 CYS HA H -2.956 -4.056 0.597 1.00 . A A . 20 CYS HA 1 1 18 12433 1 1 20 CYS HB2 H -4.708 -2.692 1.605 1.00 . A A . 20 CYS HB2 1 1 18 12434 1 1 20 CYS HB3 H -3.706 -2.432 3.025 1.00 . A A . 20 CYS HB3 1 1 18 12435 1 1 20 CYS N N -3.571 -4.975 2.346 1.00 . A A . 20 CYS N 1 1 18 12436 1 1 20 CYS O O -0.574 -3.508 1.322 1.00 . A A . 20 CYS O 1 1 18 12437 1 1 20 CYS SG S -3.008 -1.108 1.194 1.00 . A A . 20 CYS SG 1 1 18 12438 1 1 21 ASP C C 0.854 -4.971 3.480 1.00 . A A . 21 ASP C 1 1 18 12439 1 1 21 ASP CA C -0.013 -3.874 4.031 1.00 . A A . 21 ASP CA 1 1 18 12440 1 1 21 ASP CB C -0.140 -3.998 5.545 1.00 . A A . 21 ASP CB 1 1 18 12441 1 1 21 ASP CG C 1.184 -4.049 6.256 1.00 . A A . 21 ASP CG 1 1 18 12442 1 1 21 ASP H H -2.084 -4.156 3.983 1.00 . A A . 21 ASP H 1 1 18 12443 1 1 21 ASP HA H 0.427 -2.918 3.790 1.00 . A A . 21 ASP HA 1 1 18 12444 1 1 21 ASP HB2 H -0.692 -3.149 5.921 1.00 . A A . 21 ASP HB2 1 1 18 12445 1 1 21 ASP HB3 H -0.689 -4.896 5.768 1.00 . A A . 21 ASP HB3 1 1 18 12446 1 1 21 ASP N N -1.311 -3.943 3.415 1.00 . A A . 21 ASP N 1 1 18 12447 1 1 21 ASP O O 1.956 -4.730 3.070 1.00 . A A . 21 ASP O 1 1 18 12448 1 1 21 ASP OD1 O 1.721 -5.157 6.466 1.00 . A A . 21 ASP OD1 1 1 18 12449 1 1 21 ASP OD2 O 1.689 -2.987 6.645 1.00 . A A . 21 ASP OD2 1 1 18 12450 1 1 22 ASP C C 1.456 -7.068 1.441 1.00 . A A . 22 ASP C 1 1 18 12451 1 1 22 ASP CA C 0.987 -7.325 2.842 1.00 . A A . 22 ASP CA 1 1 18 12452 1 1 22 ASP CB C 0.061 -8.526 2.815 1.00 . A A . 22 ASP CB 1 1 18 12453 1 1 22 ASP CG C 0.622 -9.659 1.968 1.00 . A A . 22 ASP CG 1 1 18 12454 1 1 22 ASP H H -0.641 -6.264 3.683 1.00 . A A . 22 ASP H 1 1 18 12455 1 1 22 ASP HA H 1.830 -7.554 3.476 1.00 . A A . 22 ASP HA 1 1 18 12456 1 1 22 ASP HB2 H -0.136 -8.848 3.825 1.00 . A A . 22 ASP HB2 1 1 18 12457 1 1 22 ASP HB3 H -0.868 -8.204 2.373 1.00 . A A . 22 ASP HB3 1 1 18 12458 1 1 22 ASP N N 0.287 -6.158 3.377 1.00 . A A . 22 ASP N 1 1 18 12459 1 1 22 ASP O O 2.624 -7.330 1.098 1.00 . A A . 22 ASP O 1 1 18 12460 1 1 22 ASP OD1 O 0.106 -9.895 0.844 1.00 . A A . 22 ASP OD1 1 1 18 12461 1 1 22 ASP OD2 O 1.608 -10.278 2.362 1.00 . A A . 22 ASP OD2 1 1 18 12462 1 1 23 HIS C C 1.958 -5.209 -0.832 1.00 . A A . 23 HIS C 1 1 18 12463 1 1 23 HIS CA C 0.846 -6.253 -0.719 1.00 . A A . 23 HIS CA 1 1 18 12464 1 1 23 HIS CB C -0.427 -5.818 -1.452 1.00 . A A . 23 HIS CB 1 1 18 12465 1 1 23 HIS CD2 C 0.051 -4.441 -3.570 1.00 . A A . 23 HIS CD2 1 1 18 12466 1 1 23 HIS CE1 C -0.107 -5.998 -5.061 1.00 . A A . 23 HIS CE1 1 1 18 12467 1 1 23 HIS CG C -0.235 -5.578 -2.915 1.00 . A A . 23 HIS CG 1 1 18 12468 1 1 23 HIS H H -0.338 -6.357 0.996 1.00 . A A . 23 HIS H 1 1 18 12469 1 1 23 HIS HA H 1.202 -7.168 -1.166 1.00 . A A . 23 HIS HA 1 1 18 12470 1 1 23 HIS HB2 H -1.178 -6.584 -1.341 1.00 . A A . 23 HIS HB2 1 1 18 12471 1 1 23 HIS HB3 H -0.789 -4.903 -1.007 1.00 . A A . 23 HIS HB3 1 1 18 12472 1 1 23 HIS HD1 H -0.547 -7.506 -3.740 1.00 . A A . 23 HIS HD1 1 1 18 12473 1 1 23 HIS HD2 H 0.196 -3.474 -3.107 1.00 . A A . 23 HIS HD2 1 1 18 12474 1 1 23 HIS HE1 H -0.126 -6.534 -5.999 1.00 . A A . 23 HIS HE1 1 1 18 12475 1 1 23 HIS N N 0.561 -6.542 0.645 1.00 . A A . 23 HIS N 1 1 18 12476 1 1 23 HIS ND1 N -0.334 -6.556 -3.878 1.00 . A A . 23 HIS ND1 1 1 18 12477 1 1 23 HIS NE2 N 0.133 -4.705 -4.934 1.00 . A A . 23 HIS NE2 1 1 18 12478 1 1 23 HIS O O 3.030 -5.501 -1.350 1.00 . A A . 23 HIS O 1 1 18 12479 1 1 24 CYS C C 4.051 -3.286 0.318 1.00 . A A . 24 CYS C 1 1 18 12480 1 1 24 CYS CA C 2.731 -2.993 -0.421 1.00 . A A . 24 CYS CA 1 1 18 12481 1 1 24 CYS CB C 2.141 -1.610 -0.121 1.00 . A A . 24 CYS CB 1 1 18 12482 1 1 24 CYS H H 0.914 -3.869 0.209 1.00 . A A . 24 CYS H 1 1 18 12483 1 1 24 CYS HA H 2.982 -3.020 -1.471 1.00 . A A . 24 CYS HA 1 1 18 12484 1 1 24 CYS HB2 H 1.693 -1.622 0.861 1.00 . A A . 24 CYS HB2 1 1 18 12485 1 1 24 CYS HB3 H 2.928 -0.871 -0.151 1.00 . A A . 24 CYS HB3 1 1 18 12486 1 1 24 CYS N N 1.747 -4.041 -0.288 1.00 . A A . 24 CYS N 1 1 18 12487 1 1 24 CYS O O 5.100 -2.842 -0.106 1.00 . A A . 24 CYS O 1 1 18 12488 1 1 24 CYS SG S 0.856 -1.120 -1.341 1.00 . A A . 24 CYS SG 1 1 18 12489 1 1 25 LYS C C 5.981 -5.566 1.378 1.00 . A A . 25 LYS C 1 1 18 12490 1 1 25 LYS CA C 5.231 -4.454 2.086 1.00 . A A . 25 LYS CA 1 1 18 12491 1 1 25 LYS CB C 4.941 -4.898 3.529 1.00 . A A . 25 LYS CB 1 1 18 12492 1 1 25 LYS CD C 5.632 -2.823 4.771 1.00 . A A . 25 LYS CD 1 1 18 12493 1 1 25 LYS CE C 6.753 -3.488 5.543 1.00 . A A . 25 LYS CE 1 1 18 12494 1 1 25 LYS CG C 4.506 -3.788 4.470 1.00 . A A . 25 LYS CG 1 1 18 12495 1 1 25 LYS H H 3.146 -4.412 1.707 1.00 . A A . 25 LYS H 1 1 18 12496 1 1 25 LYS HA H 5.869 -3.585 2.122 1.00 . A A . 25 LYS HA 1 1 18 12497 1 1 25 LYS HB2 H 4.146 -5.629 3.494 1.00 . A A . 25 LYS HB2 1 1 18 12498 1 1 25 LYS HB3 H 5.822 -5.374 3.932 1.00 . A A . 25 LYS HB3 1 1 18 12499 1 1 25 LYS HD2 H 6.031 -2.433 3.846 1.00 . A A . 25 LYS HD2 1 1 18 12500 1 1 25 LYS HD3 H 5.248 -2.004 5.361 1.00 . A A . 25 LYS HD3 1 1 18 12501 1 1 25 LYS HE2 H 6.332 -3.915 6.439 1.00 . A A . 25 LYS HE2 1 1 18 12502 1 1 25 LYS HE3 H 7.176 -4.264 4.925 1.00 . A A . 25 LYS HE3 1 1 18 12503 1 1 25 LYS HG2 H 3.695 -3.241 4.012 1.00 . A A . 25 LYS HG2 1 1 18 12504 1 1 25 LYS HG3 H 4.160 -4.228 5.393 1.00 . A A . 25 LYS HG3 1 1 18 12505 1 1 25 LYS HZ1 H 7.431 -1.777 6.519 1.00 . A A . 25 LYS HZ1 1 1 18 12506 1 1 25 LYS HZ2 H 8.238 -2.095 5.078 1.00 . A A . 25 LYS HZ2 1 1 18 12507 1 1 25 LYS HZ3 H 8.570 -3.019 6.445 1.00 . A A . 25 LYS HZ3 1 1 18 12508 1 1 25 LYS N N 4.010 -4.078 1.375 1.00 . A A . 25 LYS N 1 1 18 12509 1 1 25 LYS NZ N 7.814 -2.536 5.919 1.00 . A A . 25 LYS NZ 1 1 18 12510 1 1 25 LYS O O 7.108 -5.378 0.937 1.00 . A A . 25 LYS O 1 1 18 12511 1 1 26 ASN C C 5.992 -8.010 -0.760 1.00 . A A . 26 ASN C 1 1 18 12512 1 1 26 ASN CA C 6.038 -7.891 0.745 1.00 . A A . 26 ASN CA 1 1 18 12513 1 1 26 ASN CB C 5.450 -9.175 1.355 1.00 . A A . 26 ASN CB 1 1 18 12514 1 1 26 ASN CG C 5.362 -9.158 2.863 1.00 . A A . 26 ASN CG 1 1 18 12515 1 1 26 ASN H H 4.386 -6.749 1.436 1.00 . A A . 26 ASN H 1 1 18 12516 1 1 26 ASN HA H 7.070 -7.820 1.055 1.00 . A A . 26 ASN HA 1 1 18 12517 1 1 26 ASN HB2 H 4.455 -9.330 0.965 1.00 . A A . 26 ASN HB2 1 1 18 12518 1 1 26 ASN HB3 H 6.076 -10.004 1.061 1.00 . A A . 26 ASN HB3 1 1 18 12519 1 1 26 ASN HD21 H 3.432 -8.704 2.785 1.00 . A A . 26 ASN HD21 1 1 18 12520 1 1 26 ASN HD22 H 4.102 -8.857 4.359 1.00 . A A . 26 ASN HD22 1 1 18 12521 1 1 26 ASN N N 5.346 -6.702 1.229 1.00 . A A . 26 ASN N 1 1 18 12522 1 1 26 ASN ND2 N 4.193 -8.878 3.382 1.00 . A A . 26 ASN ND2 1 1 18 12523 1 1 26 ASN O O 7.003 -8.296 -1.404 1.00 . A A . 26 ASN O 1 1 18 12524 1 1 26 ASN OD1 O 6.326 -9.475 3.558 1.00 . A A . 26 ASN OD1 1 1 18 12525 1 1 27 LYS C C 5.261 -6.877 -3.590 1.00 . A A . 27 LYS C 1 1 18 12526 1 1 27 LYS CA C 4.629 -7.994 -2.751 1.00 . A A . 27 LYS CA 1 1 18 12527 1 1 27 LYS CB C 3.128 -8.118 -3.064 1.00 . A A . 27 LYS CB 1 1 18 12528 1 1 27 LYS CD C 2.882 -10.573 -2.464 1.00 . A A . 27 LYS CD 1 1 18 12529 1 1 27 LYS CE C 2.080 -11.619 -1.671 1.00 . A A . 27 LYS CE 1 1 18 12530 1 1 27 LYS CG C 2.372 -9.162 -2.229 1.00 . A A . 27 LYS CG 1 1 18 12531 1 1 27 LYS H H 4.092 -7.426 -0.785 1.00 . A A . 27 LYS H 1 1 18 12532 1 1 27 LYS HA H 5.111 -8.925 -3.007 1.00 . A A . 27 LYS HA 1 1 18 12533 1 1 27 LYS HB2 H 2.663 -7.157 -2.899 1.00 . A A . 27 LYS HB2 1 1 18 12534 1 1 27 LYS HB3 H 3.017 -8.377 -4.107 1.00 . A A . 27 LYS HB3 1 1 18 12535 1 1 27 LYS HD2 H 2.803 -10.798 -3.516 1.00 . A A . 27 LYS HD2 1 1 18 12536 1 1 27 LYS HD3 H 3.919 -10.622 -2.166 1.00 . A A . 27 LYS HD3 1 1 18 12537 1 1 27 LYS HE2 H 1.045 -11.551 -1.967 1.00 . A A . 27 LYS HE2 1 1 18 12538 1 1 27 LYS HE3 H 2.453 -12.601 -1.922 1.00 . A A . 27 LYS HE3 1 1 18 12539 1 1 27 LYS HG2 H 2.492 -8.927 -1.182 1.00 . A A . 27 LYS HG2 1 1 18 12540 1 1 27 LYS HG3 H 1.326 -9.115 -2.490 1.00 . A A . 27 LYS HG3 1 1 18 12541 1 1 27 LYS HZ1 H 3.135 -11.323 0.137 1.00 . A A . 27 LYS HZ1 1 1 18 12542 1 1 27 LYS HZ2 H 1.798 -12.290 0.272 1.00 . A A . 27 LYS HZ2 1 1 18 12543 1 1 27 LYS HZ3 H 1.569 -10.653 0.179 1.00 . A A . 27 LYS HZ3 1 1 18 12544 1 1 27 LYS N N 4.834 -7.773 -1.327 1.00 . A A . 27 LYS N 1 1 18 12545 1 1 27 LYS NZ N 2.157 -11.433 -0.194 1.00 . A A . 27 LYS NZ 1 1 18 12546 1 1 27 LYS O O 5.867 -7.140 -4.623 1.00 . A A . 27 LYS O 1 1 18 12547 1 1 28 GLU C C 7.016 -4.086 -3.373 1.00 . A A . 28 GLU C 1 1 18 12548 1 1 28 GLU CA C 5.639 -4.489 -3.864 1.00 . A A . 28 GLU CA 1 1 18 12549 1 1 28 GLU CB C 4.711 -3.310 -3.675 1.00 . A A . 28 GLU CB 1 1 18 12550 1 1 28 GLU CD C 3.309 -3.486 -5.741 1.00 . A A . 28 GLU CD 1 1 18 12551 1 1 28 GLU CG C 3.333 -3.507 -4.239 1.00 . A A . 28 GLU CG 1 1 18 12552 1 1 28 GLU H H 4.587 -5.516 -2.322 1.00 . A A . 28 GLU H 1 1 18 12553 1 1 28 GLU HA H 5.678 -4.721 -4.918 1.00 . A A . 28 GLU HA 1 1 18 12554 1 1 28 GLU HB2 H 4.629 -3.104 -2.618 1.00 . A A . 28 GLU HB2 1 1 18 12555 1 1 28 GLU HB3 H 5.155 -2.451 -4.158 1.00 . A A . 28 GLU HB3 1 1 18 12556 1 1 28 GLU HG2 H 2.955 -4.461 -3.902 1.00 . A A . 28 GLU HG2 1 1 18 12557 1 1 28 GLU HG3 H 2.694 -2.718 -3.869 1.00 . A A . 28 GLU HG3 1 1 18 12558 1 1 28 GLU N N 5.112 -5.651 -3.143 1.00 . A A . 28 GLU N 1 1 18 12559 1 1 28 GLU O O 7.827 -3.579 -4.144 1.00 . A A . 28 GLU O 1 1 18 12560 1 1 28 GLU OE1 O 3.122 -2.396 -6.317 1.00 . A A . 28 GLU OE1 1 1 18 12561 1 1 28 GLU OE2 O 3.440 -4.536 -6.382 1.00 . A A . 28 GLU OE2 1 1 18 12562 1 1 29 HIS C C 8.529 -2.332 -1.351 1.00 . A A . 29 HIS C 1 1 18 12563 1 1 29 HIS CA C 8.486 -3.871 -1.428 1.00 . A A . 29 HIS CA 1 1 18 12564 1 1 29 HIS CB C 9.788 -4.506 -2.018 1.00 . A A . 29 HIS CB 1 1 18 12565 1 1 29 HIS CD2 C 11.417 -3.965 -0.054 1.00 . A A . 29 HIS CD2 1 1 18 12566 1 1 29 HIS CE1 C 13.131 -3.300 -1.201 1.00 . A A . 29 HIS CE1 1 1 18 12567 1 1 29 HIS CG C 11.076 -4.054 -1.364 1.00 . A A . 29 HIS CG 1 1 18 12568 1 1 29 HIS H H 6.602 -4.804 -1.573 1.00 . A A . 29 HIS H 1 1 18 12569 1 1 29 HIS HA H 8.363 -4.202 -0.406 1.00 . A A . 29 HIS HA 1 1 18 12570 1 1 29 HIS HB2 H 9.733 -5.578 -1.908 1.00 . A A . 29 HIS HB2 1 1 18 12571 1 1 29 HIS HB3 H 9.843 -4.266 -3.069 1.00 . A A . 29 HIS HB3 1 1 18 12572 1 1 29 HIS HD1 H 12.265 -3.582 -3.047 1.00 . A A . 29 HIS HD1 1 1 18 12573 1 1 29 HIS HD2 H 10.790 -4.228 0.785 1.00 . A A . 29 HIS HD2 1 1 18 12574 1 1 29 HIS HE1 H 14.109 -2.932 -1.480 1.00 . A A . 29 HIS HE1 1 1 18 12575 1 1 29 HIS N N 7.267 -4.316 -2.098 1.00 . A A . 29 HIS N 1 1 18 12576 1 1 29 HIS ND1 N 12.180 -3.630 -2.069 1.00 . A A . 29 HIS ND1 1 1 18 12577 1 1 29 HIS NE2 N 12.718 -3.482 0.045 1.00 . A A . 29 HIS NE2 1 1 18 12578 1 1 29 HIS O O 9.352 -1.646 -1.985 1.00 . A A . 29 HIS O 1 1 18 12579 1 1 30 LEU C C 7.573 -0.268 1.132 1.00 . A A . 30 LEU C 1 1 18 12580 1 1 30 LEU CA C 7.461 -0.408 -0.370 1.00 . A A . 30 LEU CA 1 1 18 12581 1 1 30 LEU CB C 6.123 0.164 -0.870 1.00 . A A . 30 LEU CB 1 1 18 12582 1 1 30 LEU CD1 C 4.504 0.649 -2.730 1.00 . A A . 30 LEU CD1 1 1 18 12583 1 1 30 LEU CD2 C 6.952 0.473 -3.243 1.00 . A A . 30 LEU CD2 1 1 18 12584 1 1 30 LEU CG C 5.811 -0.028 -2.363 1.00 . A A . 30 LEU CG 1 1 18 12585 1 1 30 LEU H H 6.851 -2.394 -0.308 1.00 . A A . 30 LEU H 1 1 18 12586 1 1 30 LEU HA H 8.286 0.100 -0.847 1.00 . A A . 30 LEU HA 1 1 18 12587 1 1 30 LEU HB2 H 5.332 -0.300 -0.301 1.00 . A A . 30 LEU HB2 1 1 18 12588 1 1 30 LEU HB3 H 6.114 1.223 -0.658 1.00 . A A . 30 LEU HB3 1 1 18 12589 1 1 30 LEU HD11 H 4.570 1.704 -2.510 1.00 . A A . 30 LEU HD11 1 1 18 12590 1 1 30 LEU HD12 H 3.699 0.212 -2.158 1.00 . A A . 30 LEU HD12 1 1 18 12591 1 1 30 LEU HD13 H 4.309 0.513 -3.783 1.00 . A A . 30 LEU HD13 1 1 18 12592 1 1 30 LEU HD21 H 6.674 0.387 -4.284 1.00 . A A . 30 LEU HD21 1 1 18 12593 1 1 30 LEU HD22 H 7.826 -0.134 -3.062 1.00 . A A . 30 LEU HD22 1 1 18 12594 1 1 30 LEU HD23 H 7.180 1.501 -3.008 1.00 . A A . 30 LEU HD23 1 1 18 12595 1 1 30 LEU HG H 5.683 -1.086 -2.542 1.00 . A A . 30 LEU HG 1 1 18 12596 1 1 30 LEU N N 7.560 -1.810 -0.658 1.00 . A A . 30 LEU N 1 1 18 12597 1 1 30 LEU O O 7.726 -1.282 1.824 1.00 . A A . 30 LEU O 1 1 18 12598 1 1 31 ARG C C 6.452 0.612 3.869 1.00 . A A . 31 ARG C 1 1 18 12599 1 1 31 ARG CA C 7.645 1.135 3.083 1.00 . A A . 31 ARG CA 1 1 18 12600 1 1 31 ARG CB C 7.908 2.605 3.424 1.00 . A A . 31 ARG CB 1 1 18 12601 1 1 31 ARG CD C 8.373 4.300 5.211 1.00 . A A . 31 ARG CD 1 1 18 12602 1 1 31 ARG CG C 8.062 2.858 4.914 1.00 . A A . 31 ARG CG 1 1 18 12603 1 1 31 ARG CZ C 8.803 5.688 7.215 1.00 . A A . 31 ARG CZ 1 1 18 12604 1 1 31 ARG H H 7.274 1.702 1.075 1.00 . A A . 31 ARG H 1 1 18 12605 1 1 31 ARG HA H 8.508 0.557 3.377 1.00 . A A . 31 ARG HA 1 1 18 12606 1 1 31 ARG HB2 H 8.811 2.931 2.929 1.00 . A A . 31 ARG HB2 1 1 18 12607 1 1 31 ARG HB3 H 7.082 3.198 3.063 1.00 . A A . 31 ARG HB3 1 1 18 12608 1 1 31 ARG HD2 H 9.322 4.554 4.761 1.00 . A A . 31 ARG HD2 1 1 18 12609 1 1 31 ARG HD3 H 7.596 4.920 4.790 1.00 . A A . 31 ARG HD3 1 1 18 12610 1 1 31 ARG HE H 8.180 3.795 7.231 1.00 . A A . 31 ARG HE 1 1 18 12611 1 1 31 ARG HG2 H 7.139 2.595 5.410 1.00 . A A . 31 ARG HG2 1 1 18 12612 1 1 31 ARG HG3 H 8.860 2.237 5.294 1.00 . A A . 31 ARG HG3 1 1 18 12613 1 1 31 ARG HH11 H 9.322 6.631 5.476 1.00 . A A . 31 ARG HH11 1 1 18 12614 1 1 31 ARG HH12 H 9.508 7.577 6.873 1.00 . A A . 31 ARG HH12 1 1 18 12615 1 1 31 ARG HH21 H 8.440 5.051 9.108 1.00 . A A . 31 ARG HH21 1 1 18 12616 1 1 31 ARG HH22 H 8.987 6.658 8.999 1.00 . A A . 31 ARG HH22 1 1 18 12617 1 1 31 ARG N N 7.477 0.932 1.652 1.00 . A A . 31 ARG N 1 1 18 12618 1 1 31 ARG NE N 8.448 4.544 6.648 1.00 . A A . 31 ARG NE 1 1 18 12619 1 1 31 ARG NH1 N 9.242 6.697 6.470 1.00 . A A . 31 ARG NH1 1 1 18 12620 1 1 31 ARG NH2 N 8.745 5.809 8.522 1.00 . A A . 31 ARG NH2 1 1 18 12621 1 1 31 ARG O O 6.629 0.002 4.918 1.00 . A A . 31 ARG O 1 1 18 12622 1 1 32 SER C C 2.861 0.588 3.050 1.00 . A A . 32 SER C 1 1 18 12623 1 1 32 SER CA C 4.035 0.421 4.014 1.00 . A A . 32 SER CA 1 1 18 12624 1 1 32 SER CB C 3.831 1.302 5.259 1.00 . A A . 32 SER CB 1 1 18 12625 1 1 32 SER H H 5.160 1.287 2.491 1.00 . A A . 32 SER H 1 1 18 12626 1 1 32 SER HA H 4.136 -0.612 4.321 1.00 . A A . 32 SER HA 1 1 18 12627 1 1 32 SER HB2 H 2.846 1.133 5.667 1.00 . A A . 32 SER HB2 1 1 18 12628 1 1 32 SER HB3 H 4.579 1.058 6.001 1.00 . A A . 32 SER HB3 1 1 18 12629 1 1 32 SER HG H 3.966 3.189 5.740 1.00 . A A . 32 SER HG 1 1 18 12630 1 1 32 SER N N 5.261 0.827 3.350 1.00 . A A . 32 SER N 1 1 18 12631 1 1 32 SER O O 3.035 1.181 1.973 1.00 . A A . 32 SER O 1 1 18 12632 1 1 32 SER OG O 3.956 2.680 4.922 1.00 . A A . 32 SER OG 1 1 18 12633 1 1 33 GLY C C -0.620 0.704 3.470 1.00 . A A . 33 GLY C 1 1 18 12634 1 1 33 GLY CA C 0.509 0.248 2.596 1.00 . A A . 33 GLY CA 1 1 18 12635 1 1 33 GLY H H 1.608 -0.492 4.217 1.00 . A A . 33 GLY H 1 1 18 12636 1 1 33 GLY HA2 H 0.722 1.015 1.866 1.00 . A A . 33 GLY HA2 1 1 18 12637 1 1 33 GLY HA3 H 0.227 -0.650 2.074 1.00 . A A . 33 GLY HA3 1 1 18 12638 1 1 33 GLY N N 1.698 0.049 3.399 1.00 . A A . 33 GLY N 1 1 18 12639 1 1 33 GLY O O -1.022 -0.013 4.395 1.00 . A A . 33 GLY O 1 1 18 12640 1 1 34 ARG C C -3.413 2.644 3.324 1.00 . A A . 34 ARG C 1 1 18 12641 1 1 34 ARG CA C -2.091 2.508 4.075 1.00 . A A . 34 ARG CA 1 1 18 12642 1 1 34 ARG CB C -1.560 3.887 4.506 1.00 . A A . 34 ARG CB 1 1 18 12643 1 1 34 ARG CD C 0.467 5.203 5.298 1.00 . A A . 34 ARG CD 1 1 18 12644 1 1 34 ARG CG C -0.107 3.833 4.992 1.00 . A A . 34 ARG CG 1 1 18 12645 1 1 34 ARG CZ C 0.146 7.057 6.918 1.00 . A A . 34 ARG CZ 1 1 18 12646 1 1 34 ARG H H -0.834 2.396 2.423 1.00 . A A . 34 ARG H 1 1 18 12647 1 1 34 ARG HA H -2.227 1.893 4.951 1.00 . A A . 34 ARG HA 1 1 18 12648 1 1 34 ARG HB2 H -1.619 4.562 3.666 1.00 . A A . 34 ARG HB2 1 1 18 12649 1 1 34 ARG HB3 H -2.172 4.268 5.310 1.00 . A A . 34 ARG HB3 1 1 18 12650 1 1 34 ARG HD2 H 1.540 5.115 5.391 1.00 . A A . 34 ARG HD2 1 1 18 12651 1 1 34 ARG HD3 H 0.239 5.864 4.474 1.00 . A A . 34 ARG HD3 1 1 18 12652 1 1 34 ARG HE H -0.522 5.144 7.118 1.00 . A A . 34 ARG HE 1 1 18 12653 1 1 34 ARG HG2 H -0.063 3.238 5.892 1.00 . A A . 34 ARG HG2 1 1 18 12654 1 1 34 ARG HG3 H 0.491 3.360 4.227 1.00 . A A . 34 ARG HG3 1 1 18 12655 1 1 34 ARG HH11 H 0.814 7.712 5.087 1.00 . A A . 34 ARG HH11 1 1 18 12656 1 1 34 ARG HH12 H 0.795 8.909 6.298 1.00 . A A . 34 ARG HH12 1 1 18 12657 1 1 34 ARG HH21 H -0.568 6.811 8.824 1.00 . A A . 34 ARG HH21 1 1 18 12658 1 1 34 ARG HH22 H -0.033 8.388 8.454 1.00 . A A . 34 ARG HH22 1 1 18 12659 1 1 34 ARG N N -1.109 1.889 3.219 1.00 . A A . 34 ARG N 1 1 18 12660 1 1 34 ARG NE N -0.059 5.788 6.535 1.00 . A A . 34 ARG NE 1 1 18 12661 1 1 34 ARG NH1 N 0.612 7.954 6.048 1.00 . A A . 34 ARG NH1 1 1 18 12662 1 1 34 ARG NH2 N -0.175 7.441 8.151 1.00 . A A . 34 ARG NH2 1 1 18 12663 1 1 34 ARG O O -3.472 3.203 2.224 1.00 . A A . 34 ARG O 1 1 18 12664 1 1 35 CYS C C -6.423 3.493 3.590 1.00 . A A . 35 CYS C 1 1 18 12665 1 1 35 CYS CA C -5.758 2.171 3.271 1.00 . A A . 35 CYS CA 1 1 18 12666 1 1 35 CYS CB C -6.603 1.000 3.742 1.00 . A A . 35 CYS CB 1 1 18 12667 1 1 35 CYS H H -4.362 1.702 4.774 1.00 . A A . 35 CYS H 1 1 18 12668 1 1 35 CYS HA H -5.619 2.109 2.202 1.00 . A A . 35 CYS HA 1 1 18 12669 1 1 35 CYS HB2 H -6.851 1.127 4.784 1.00 . A A . 35 CYS HB2 1 1 18 12670 1 1 35 CYS HB3 H -7.509 0.971 3.155 1.00 . A A . 35 CYS HB3 1 1 18 12671 1 1 35 CYS N N -4.456 2.125 3.893 1.00 . A A . 35 CYS N 1 1 18 12672 1 1 35 CYS O O -6.387 3.968 4.735 1.00 . A A . 35 CYS O 1 1 18 12673 1 1 35 CYS SG S -5.764 -0.600 3.542 1.00 . A A . 35 CYS SG 1 1 18 12674 1 1 36 ARG C C -9.050 5.406 2.537 1.00 . A A . 36 ARG C 1 1 18 12675 1 1 36 ARG CA C -7.538 5.433 2.736 1.00 . A A . 36 ARG CA 1 1 18 12676 1 1 36 ARG CB C -6.834 6.416 1.824 1.00 . A A . 36 ARG CB 1 1 18 12677 1 1 36 ARG CD C -5.090 7.361 3.461 1.00 . A A . 36 ARG CD 1 1 18 12678 1 1 36 ARG CG C -5.338 6.594 2.153 1.00 . A A . 36 ARG CG 1 1 18 12679 1 1 36 ARG CZ C -6.331 7.442 5.618 1.00 . A A . 36 ARG CZ 1 1 18 12680 1 1 36 ARG H H -6.927 3.730 1.683 1.00 . A A . 36 ARG H 1 1 18 12681 1 1 36 ARG HA H -7.353 5.734 3.757 1.00 . A A . 36 ARG HA 1 1 18 12682 1 1 36 ARG HB2 H -6.922 6.052 0.810 1.00 . A A . 36 ARG HB2 1 1 18 12683 1 1 36 ARG HB3 H -7.316 7.376 1.900 1.00 . A A . 36 ARG HB3 1 1 18 12684 1 1 36 ARG HD2 H -4.025 7.409 3.627 1.00 . A A . 36 ARG HD2 1 1 18 12685 1 1 36 ARG HD3 H -5.470 8.364 3.346 1.00 . A A . 36 ARG HD3 1 1 18 12686 1 1 36 ARG HE H -5.666 5.766 4.698 1.00 . A A . 36 ARG HE 1 1 18 12687 1 1 36 ARG HG2 H -4.884 5.618 2.241 1.00 . A A . 36 ARG HG2 1 1 18 12688 1 1 36 ARG HG3 H -4.871 7.131 1.340 1.00 . A A . 36 ARG HG3 1 1 18 12689 1 1 36 ARG HH11 H -5.822 9.299 4.916 1.00 . A A . 36 ARG HH11 1 1 18 12690 1 1 36 ARG HH12 H -6.807 9.331 6.292 1.00 . A A . 36 ARG HH12 1 1 18 12691 1 1 36 ARG HH21 H -6.978 5.794 6.639 1.00 . A A . 36 ARG HH21 1 1 18 12692 1 1 36 ARG HH22 H -7.459 7.279 7.302 1.00 . A A . 36 ARG HH22 1 1 18 12693 1 1 36 ARG N N -6.939 4.135 2.576 1.00 . A A . 36 ARG N 1 1 18 12694 1 1 36 ARG NE N -5.704 6.752 4.653 1.00 . A A . 36 ARG NE 1 1 18 12695 1 1 36 ARG NH1 N -6.310 8.777 5.619 1.00 . A A . 36 ARG NH1 1 1 18 12696 1 1 36 ARG NH2 N -6.953 6.797 6.586 1.00 . A A . 36 ARG NH2 1 1 18 12697 1 1 36 ARG O O -9.611 4.361 2.192 1.00 . A A . 36 ARG O 1 1 18 12698 1 1 37 ASP C C -11.742 6.416 1.272 1.00 . A A . 37 ASP C 1 1 18 12699 1 1 37 ASP CA C -11.179 6.682 2.662 1.00 . A A . 37 ASP CA 1 1 18 12700 1 1 37 ASP CB C -11.692 8.053 3.176 1.00 . A A . 37 ASP CB 1 1 18 12701 1 1 37 ASP CG C -11.457 9.212 2.221 1.00 . A A . 37 ASP CG 1 1 18 12702 1 1 37 ASP H H -9.164 7.374 2.875 1.00 . A A . 37 ASP H 1 1 18 12703 1 1 37 ASP HA H -11.561 5.911 3.315 1.00 . A A . 37 ASP HA 1 1 18 12704 1 1 37 ASP HB2 H -12.755 7.983 3.351 1.00 . A A . 37 ASP HB2 1 1 18 12705 1 1 37 ASP HB3 H -11.202 8.276 4.112 1.00 . A A . 37 ASP HB3 1 1 18 12706 1 1 37 ASP N N -9.697 6.567 2.707 1.00 . A A . 37 ASP N 1 1 18 12707 1 1 37 ASP O O -12.926 6.181 1.116 1.00 . A A . 37 ASP O 1 1 18 12708 1 1 37 ASP OD1 O -12.392 9.600 1.478 1.00 . A A . 37 ASP OD1 1 1 18 12709 1 1 37 ASP OD2 O -10.345 9.764 2.195 1.00 . A A . 37 ASP OD2 1 1 18 12710 1 1 38 ASP C C -11.307 4.647 -1.370 1.00 . A A . 38 ASP C 1 1 18 12711 1 1 38 ASP CA C -11.338 6.136 -1.106 1.00 . A A . 38 ASP CA 1 1 18 12712 1 1 38 ASP CB C -10.503 6.860 -2.176 1.00 . A A . 38 ASP CB 1 1 18 12713 1 1 38 ASP CG C -10.836 8.321 -2.303 1.00 . A A . 38 ASP CG 1 1 18 12714 1 1 38 ASP H H -9.969 6.715 0.445 1.00 . A A . 38 ASP H 1 1 18 12715 1 1 38 ASP HA H -12.364 6.465 -1.189 1.00 . A A . 38 ASP HA 1 1 18 12716 1 1 38 ASP HB2 H -9.458 6.777 -1.920 1.00 . A A . 38 ASP HB2 1 1 18 12717 1 1 38 ASP HB3 H -10.671 6.384 -3.130 1.00 . A A . 38 ASP HB3 1 1 18 12718 1 1 38 ASP N N -10.896 6.450 0.264 1.00 . A A . 38 ASP N 1 1 18 12719 1 1 38 ASP O O -11.486 4.214 -2.505 1.00 . A A . 38 ASP O 1 1 18 12720 1 1 38 ASP OD1 O -10.075 9.167 -1.811 1.00 . A A . 38 ASP OD1 1 1 18 12721 1 1 38 ASP OD2 O -11.885 8.650 -2.884 1.00 . A A . 38 ASP OD2 1 1 18 12722 1 1 39 PHE C C -9.696 1.931 -1.113 1.00 . A A . 39 PHE C 1 1 18 12723 1 1 39 PHE CA C -10.934 2.383 -0.358 1.00 . A A . 39 PHE CA 1 1 18 12724 1 1 39 PHE CB C -12.192 1.700 -0.952 1.00 . A A . 39 PHE CB 1 1 18 12725 1 1 39 PHE CD1 C -13.719 1.038 0.928 1.00 . A A . 39 PHE CD1 1 1 18 12726 1 1 39 PHE CD2 C -14.389 2.832 -0.491 1.00 . A A . 39 PHE CD2 1 1 18 12727 1 1 39 PHE CE1 C -14.887 1.172 1.654 1.00 . A A . 39 PHE CE1 1 1 18 12728 1 1 39 PHE CE2 C -15.556 2.972 0.231 1.00 . A A . 39 PHE CE2 1 1 18 12729 1 1 39 PHE CG C -13.456 1.866 -0.152 1.00 . A A . 39 PHE CG 1 1 18 12730 1 1 39 PHE CZ C -15.807 2.142 1.305 1.00 . A A . 39 PHE CZ 1 1 18 12731 1 1 39 PHE H H -10.888 4.298 0.558 1.00 . A A . 39 PHE H 1 1 18 12732 1 1 39 PHE HA H -10.815 2.059 0.668 1.00 . A A . 39 PHE HA 1 1 18 12733 1 1 39 PHE HB2 H -12.378 2.111 -1.934 1.00 . A A . 39 PHE HB2 1 1 18 12734 1 1 39 PHE HB3 H -11.995 0.642 -1.054 1.00 . A A . 39 PHE HB3 1 1 18 12735 1 1 39 PHE HD1 H -12.999 0.281 1.205 1.00 . A A . 39 PHE HD1 1 1 18 12736 1 1 39 PHE HD2 H -14.194 3.481 -1.332 1.00 . A A . 39 PHE HD2 1 1 18 12737 1 1 39 PHE HE1 H -15.082 0.522 2.495 1.00 . A A . 39 PHE HE1 1 1 18 12738 1 1 39 PHE HE2 H -16.276 3.730 -0.044 1.00 . A A . 39 PHE HE2 1 1 18 12739 1 1 39 PHE HZ H -16.721 2.249 1.871 1.00 . A A . 39 PHE HZ 1 1 18 12740 1 1 39 PHE N N -11.034 3.864 -0.311 1.00 . A A . 39 PHE N 1 1 18 12741 1 1 39 PHE O O -9.421 0.740 -1.225 1.00 . A A . 39 PHE O 1 1 18 12742 1 1 40 ARG C C -6.564 2.723 -1.420 1.00 . A A . 40 ARG C 1 1 18 12743 1 1 40 ARG CA C -7.765 2.576 -2.346 1.00 . A A . 40 ARG CA 1 1 18 12744 1 1 40 ARG CB C -7.651 3.522 -3.551 1.00 . A A . 40 ARG CB 1 1 18 12745 1 1 40 ARG CD C -7.197 1.833 -5.367 1.00 . A A . 40 ARG CD 1 1 18 12746 1 1 40 ARG CG C -6.672 3.051 -4.622 1.00 . A A . 40 ARG CG 1 1 18 12747 1 1 40 ARG CZ C -9.090 1.293 -6.893 1.00 . A A . 40 ARG CZ 1 1 18 12748 1 1 40 ARG H H -9.189 3.803 -1.415 1.00 . A A . 40 ARG H 1 1 18 12749 1 1 40 ARG HA H -7.832 1.554 -2.689 1.00 . A A . 40 ARG HA 1 1 18 12750 1 1 40 ARG HB2 H -8.624 3.622 -4.008 1.00 . A A . 40 ARG HB2 1 1 18 12751 1 1 40 ARG HB3 H -7.328 4.491 -3.201 1.00 . A A . 40 ARG HB3 1 1 18 12752 1 1 40 ARG HD2 H -6.415 1.456 -6.010 1.00 . A A . 40 ARG HD2 1 1 18 12753 1 1 40 ARG HD3 H -7.475 1.068 -4.658 1.00 . A A . 40 ARG HD3 1 1 18 12754 1 1 40 ARG HE H -8.568 3.133 -6.243 1.00 . A A . 40 ARG HE 1 1 18 12755 1 1 40 ARG HG2 H -6.528 3.847 -5.337 1.00 . A A . 40 ARG HG2 1 1 18 12756 1 1 40 ARG HG3 H -5.731 2.802 -4.154 1.00 . A A . 40 ARG HG3 1 1 18 12757 1 1 40 ARG HH11 H -8.239 -0.409 -6.094 1.00 . A A . 40 ARG HH11 1 1 18 12758 1 1 40 ARG HH12 H -9.421 -0.705 -7.275 1.00 . A A . 40 ARG HH12 1 1 18 12759 1 1 40 ARG HH21 H -10.244 2.720 -7.804 1.00 . A A . 40 ARG HH21 1 1 18 12760 1 1 40 ARG HH22 H -10.605 1.121 -8.260 1.00 . A A . 40 ARG HH22 1 1 18 12761 1 1 40 ARG N N -8.937 2.874 -1.596 1.00 . A A . 40 ARG N 1 1 18 12762 1 1 40 ARG NE N -8.362 2.168 -6.187 1.00 . A A . 40 ARG NE 1 1 18 12763 1 1 40 ARG NH1 N -8.905 -0.026 -6.740 1.00 . A A . 40 ARG NH1 1 1 18 12764 1 1 40 ARG NH2 N -10.045 1.740 -7.706 1.00 . A A . 40 ARG NH2 1 1 18 12765 1 1 40 ARG O O -6.646 3.413 -0.386 1.00 . A A . 40 ARG O 1 1 18 12766 1 1 41 CYS C C -3.339 3.176 -1.365 1.00 . A A . 41 CYS C 1 1 18 12767 1 1 41 CYS CA C -4.304 2.109 -0.953 1.00 . A A . 41 CYS CA 1 1 18 12768 1 1 41 CYS CB C -3.602 0.772 -0.991 1.00 . A A . 41 CYS CB 1 1 18 12769 1 1 41 CYS H H -5.456 1.567 -2.589 1.00 . A A . 41 CYS H 1 1 18 12770 1 1 41 CYS HA H -4.604 2.285 0.069 1.00 . A A . 41 CYS HA 1 1 18 12771 1 1 41 CYS HB2 H -3.517 0.451 -2.018 1.00 . A A . 41 CYS HB2 1 1 18 12772 1 1 41 CYS HB3 H -2.613 0.871 -0.570 1.00 . A A . 41 CYS HB3 1 1 18 12773 1 1 41 CYS N N -5.487 2.083 -1.761 1.00 . A A . 41 CYS N 1 1 18 12774 1 1 41 CYS O O -3.008 3.318 -2.549 1.00 . A A . 41 CYS O 1 1 18 12775 1 1 41 CYS SG S -4.448 -0.530 -0.094 1.00 . A A . 41 CYS SG 1 1 18 12776 1 1 42 TRP C C -0.678 4.236 0.187 1.00 . A A . 42 TRP C 1 1 18 12777 1 1 42 TRP CA C -1.854 4.853 -0.527 1.00 . A A . 42 TRP CA 1 1 18 12778 1 1 42 TRP CB C -2.222 6.217 0.071 1.00 . A A . 42 TRP CB 1 1 18 12779 1 1 42 TRP CD1 C -1.739 8.140 -1.562 1.00 . A A . 42 TRP CD1 1 1 18 12780 1 1 42 TRP CD2 C -3.900 7.569 -1.482 1.00 . A A . 42 TRP CD2 1 1 18 12781 1 1 42 TRP CE2 C -3.742 8.627 -2.401 1.00 . A A . 42 TRP CE2 1 1 18 12782 1 1 42 TRP CE3 C -5.178 7.051 -1.276 1.00 . A A . 42 TRP CE3 1 1 18 12783 1 1 42 TRP CG C -2.593 7.267 -0.954 1.00 . A A . 42 TRP CG 1 1 18 12784 1 1 42 TRP CH2 C -6.055 8.642 -2.874 1.00 . A A . 42 TRP CH2 1 1 18 12785 1 1 42 TRP CZ2 C -4.815 9.170 -3.104 1.00 . A A . 42 TRP CZ2 1 1 18 12786 1 1 42 TRP CZ3 C -6.242 7.593 -1.972 1.00 . A A . 42 TRP CZ3 1 1 18 12787 1 1 42 TRP H H -3.291 3.808 0.510 1.00 . A A . 42 TRP H 1 1 18 12788 1 1 42 TRP HA H -1.621 4.948 -1.577 1.00 . A A . 42 TRP HA 1 1 18 12789 1 1 42 TRP HB2 H -3.072 6.074 0.723 1.00 . A A . 42 TRP HB2 1 1 18 12790 1 1 42 TRP HB3 H -1.392 6.585 0.655 1.00 . A A . 42 TRP HB3 1 1 18 12791 1 1 42 TRP HD1 H -0.675 8.174 -1.380 1.00 . A A . 42 TRP HD1 1 1 18 12792 1 1 42 TRP HE1 H -2.019 9.659 -2.988 1.00 . A A . 42 TRP HE1 1 1 18 12793 1 1 42 TRP HE3 H -5.341 6.235 -0.591 1.00 . A A . 42 TRP HE3 1 1 18 12794 1 1 42 TRP HH2 H -6.916 9.036 -3.395 1.00 . A A . 42 TRP HH2 1 1 18 12795 1 1 42 TRP HZ2 H -4.694 9.980 -3.809 1.00 . A A . 42 TRP HZ2 1 1 18 12796 1 1 42 TRP HZ3 H -7.240 7.209 -1.820 1.00 . A A . 42 TRP HZ3 1 1 18 12797 1 1 42 TRP N N -2.913 3.918 -0.394 1.00 . A A . 42 TRP N 1 1 18 12798 1 1 42 TRP NE1 N -2.420 8.953 -2.431 1.00 . A A . 42 TRP NE1 1 1 18 12799 1 1 42 TRP O O -0.692 4.065 1.402 1.00 . A A . 42 TRP O 1 1 18 12800 1 1 43 CYS C C 2.621 4.005 -0.130 1.00 . A A . 43 CYS C 1 1 18 12801 1 1 43 CYS CA C 1.399 3.126 -0.032 1.00 . A A . 43 CYS CA 1 1 18 12802 1 1 43 CYS CB C 1.602 1.815 -0.800 1.00 . A A . 43 CYS CB 1 1 18 12803 1 1 43 CYS H H 0.254 4.028 -1.525 1.00 . A A . 43 CYS H 1 1 18 12804 1 1 43 CYS HA H 1.191 2.887 1.002 1.00 . A A . 43 CYS HA 1 1 18 12805 1 1 43 CYS HB2 H 1.792 2.039 -1.839 1.00 . A A . 43 CYS HB2 1 1 18 12806 1 1 43 CYS HB3 H 2.451 1.293 -0.385 1.00 . A A . 43 CYS HB3 1 1 18 12807 1 1 43 CYS N N 0.272 3.821 -0.564 1.00 . A A . 43 CYS N 1 1 18 12808 1 1 43 CYS O O 2.846 4.666 -1.166 1.00 . A A . 43 CYS O 1 1 18 12809 1 1 43 CYS SG S 0.157 0.693 -0.721 1.00 . A A . 43 CYS SG 1 1 18 12810 1 1 44 THR C C 5.700 4.223 0.171 1.00 . A A . 44 THR C 1 1 18 12811 1 1 44 THR CA C 4.551 4.866 0.955 1.00 . A A . 44 THR CA 1 1 18 12812 1 1 44 THR CB C 4.991 5.106 2.418 1.00 . A A . 44 THR CB 1 1 18 12813 1 1 44 THR CG2 C 6.125 6.113 2.476 1.00 . A A . 44 THR CG2 1 1 18 12814 1 1 44 THR H H 3.185 3.474 1.690 1.00 . A A . 44 THR H 1 1 18 12815 1 1 44 THR HA H 4.301 5.818 0.512 1.00 . A A . 44 THR HA 1 1 18 12816 1 1 44 THR HB H 5.326 4.171 2.839 1.00 . A A . 44 THR HB 1 1 18 12817 1 1 44 THR HG1 H 3.119 5.767 2.613 1.00 . A A . 44 THR HG1 1 1 18 12818 1 1 44 THR HG21 H 6.419 6.277 3.501 1.00 . A A . 44 THR HG21 1 1 18 12819 1 1 44 THR HG22 H 5.799 7.045 2.040 1.00 . A A . 44 THR HG22 1 1 18 12820 1 1 44 THR HG23 H 6.967 5.731 1.916 1.00 . A A . 44 THR HG23 1 1 18 12821 1 1 44 THR N N 3.399 4.031 0.911 1.00 . A A . 44 THR N 1 1 18 12822 1 1 44 THR O O 6.173 3.130 0.514 1.00 . A A . 44 THR O 1 1 18 12823 1 1 44 THR OG1 O 3.884 5.599 3.202 1.00 . A A . 44 THR OG1 1 1 18 12824 1 1 45 LYS C C 8.322 5.460 -1.627 1.00 . A A . 45 LYS C 1 1 18 12825 1 1 45 LYS CA C 7.223 4.421 -1.678 1.00 . A A . 45 LYS CA 1 1 18 12826 1 1 45 LYS CB C 6.824 4.094 -3.135 1.00 . A A . 45 LYS CB 1 1 18 12827 1 1 45 LYS CD C 6.072 4.923 -5.405 1.00 . A A . 45 LYS CD 1 1 18 12828 1 1 45 LYS CE C 5.433 3.576 -5.791 1.00 . A A . 45 LYS CE 1 1 18 12829 1 1 45 LYS CG C 6.086 5.198 -3.892 1.00 . A A . 45 LYS CG 1 1 18 12830 1 1 45 LYS H H 5.653 5.712 -1.134 1.00 . A A . 45 LYS H 1 1 18 12831 1 1 45 LYS HA H 7.596 3.525 -1.203 1.00 . A A . 45 LYS HA 1 1 18 12832 1 1 45 LYS HB2 H 7.712 3.848 -3.696 1.00 . A A . 45 LYS HB2 1 1 18 12833 1 1 45 LYS HB3 H 6.181 3.227 -3.110 1.00 . A A . 45 LYS HB3 1 1 18 12834 1 1 45 LYS HD2 H 5.511 5.707 -5.889 1.00 . A A . 45 LYS HD2 1 1 18 12835 1 1 45 LYS HD3 H 7.090 4.946 -5.766 1.00 . A A . 45 LYS HD3 1 1 18 12836 1 1 45 LYS HE2 H 5.631 3.389 -6.835 1.00 . A A . 45 LYS HE2 1 1 18 12837 1 1 45 LYS HE3 H 5.892 2.793 -5.204 1.00 . A A . 45 LYS HE3 1 1 18 12838 1 1 45 LYS HG2 H 5.068 5.249 -3.534 1.00 . A A . 45 LYS HG2 1 1 18 12839 1 1 45 LYS HG3 H 6.582 6.140 -3.709 1.00 . A A . 45 LYS HG3 1 1 18 12840 1 1 45 LYS HZ1 H 3.669 3.625 -4.601 1.00 . A A . 45 LYS HZ1 1 1 18 12841 1 1 45 LYS HZ2 H 3.604 2.645 -6.009 1.00 . A A . 45 LYS HZ2 1 1 18 12842 1 1 45 LYS HZ3 H 3.528 4.286 -6.163 1.00 . A A . 45 LYS HZ3 1 1 18 12843 1 1 45 LYS N N 6.105 4.871 -0.888 1.00 . A A . 45 LYS N 1 1 18 12844 1 1 45 LYS NZ N 3.964 3.536 -5.591 1.00 . A A . 45 LYS NZ 1 1 18 12845 1 1 45 LYS O O 8.084 6.589 -1.186 1.00 . A A . 45 LYS O 1 1 18 12846 1 1 46 ASN C C 10.590 6.924 -3.218 1.00 . A A . 46 ASN C 1 1 18 12847 1 1 46 ASN CA C 10.626 6.020 -2.009 1.00 . A A . 46 ASN CA 1 1 18 12848 1 1 46 ASN CB C 11.985 5.294 -1.955 1.00 . A A . 46 ASN CB 1 1 18 12849 1 1 46 ASN CG C 12.153 4.369 -0.757 1.00 . A A . 46 ASN CG 1 1 18 12850 1 1 46 ASN H H 9.648 4.197 -2.410 1.00 . A A . 46 ASN H 1 1 18 12851 1 1 46 ASN HA H 10.518 6.627 -1.123 1.00 . A A . 46 ASN HA 1 1 18 12852 1 1 46 ASN HB2 H 12.095 4.698 -2.848 1.00 . A A . 46 ASN HB2 1 1 18 12853 1 1 46 ASN HB3 H 12.772 6.033 -1.930 1.00 . A A . 46 ASN HB3 1 1 18 12854 1 1 46 ASN HD21 H 13.464 3.299 -1.758 1.00 . A A . 46 ASN HD21 1 1 18 12855 1 1 46 ASN HD22 H 13.154 2.761 -0.155 1.00 . A A . 46 ASN HD22 1 1 18 12856 1 1 46 ASN N N 9.504 5.096 -2.049 1.00 . A A . 46 ASN N 1 1 18 12857 1 1 46 ASN ND2 N 12.996 3.382 -0.899 1.00 . A A . 46 ASN ND2 1 1 18 12858 1 1 46 ASN O O 10.185 6.500 -4.315 1.00 . A A . 46 ASN O 1 1 18 12859 1 1 46 ASN OD1 O 11.544 4.556 0.301 1.00 . A A . 46 ASN OD1 1 1 18 12860 1 1 47 CYS C C 12.293 9.938 -3.963 1.00 . A A . 47 CYS C 1 1 18 12861 1 1 47 CYS CA C 11.020 9.110 -4.073 1.00 . A A . 47 CYS CA 1 1 18 12862 1 1 47 CYS CB C 9.741 9.976 -4.069 1.00 . A A . 47 CYS CB 1 1 18 12863 1 1 47 CYS H H 11.290 8.429 -2.135 1.00 . A A . 47 CYS H 1 1 18 12864 1 1 47 CYS HA H 11.067 8.559 -5.001 1.00 . A A . 47 CYS HA 1 1 18 12865 1 1 47 CYS HB2 H 9.860 10.771 -4.789 1.00 . A A . 47 CYS HB2 1 1 18 12866 1 1 47 CYS HB3 H 8.902 9.361 -4.359 1.00 . A A . 47 CYS HB3 1 1 18 12867 1 1 47 CYS N N 10.987 8.140 -3.027 1.00 . A A . 47 CYS N 1 1 18 12868 1 1 47 CYS O O 13.253 9.661 -4.712 1.00 . A A . 47 CYS O 1 1 18 12869 1 1 47 CYS OXT O 12.385 10.822 -3.100 1.00 . A A . 47 CYS OXT 1 1 18 12870 1 1 47 CYS SG S 9.332 10.760 -2.462 1.00 . A A . 47 CYS SG 1 1 19 12871 1 1 1 LYS C C 11.535 9.245 0.522 1.00 . A A . 1 LYS C 1 1 19 12872 1 1 1 LYS CA C 12.668 10.242 0.644 1.00 . A A . 1 LYS CA 1 1 19 12873 1 1 1 LYS CB C 13.789 9.698 1.538 1.00 . A A . 1 LYS CB 1 1 19 12874 1 1 1 LYS CD C 14.553 9.003 3.827 1.00 . A A . 1 LYS CD 1 1 19 12875 1 1 1 LYS CE C 14.168 8.801 5.290 1.00 . A A . 1 LYS CE 1 1 19 12876 1 1 1 LYS CG C 13.386 9.495 2.993 1.00 . A A . 1 LYS CG 1 1 19 12877 1 1 1 LYS H1 H 11.510 11.973 0.435 1.00 . A A . 1 LYS H1 1 1 19 12878 1 1 1 LYS H2 H 12.994 12.227 1.140 1.00 . A A . 1 LYS H2 1 1 19 12879 1 1 1 LYS H3 H 11.768 11.532 2.045 1.00 . A A . 1 LYS H3 1 1 19 12880 1 1 1 LYS HA H 13.034 10.384 -0.353 1.00 . A A . 1 LYS HA 1 1 19 12881 1 1 1 LYS HB2 H 14.113 8.745 1.146 1.00 . A A . 1 LYS HB2 1 1 19 12882 1 1 1 LYS HB3 H 14.620 10.387 1.511 1.00 . A A . 1 LYS HB3 1 1 19 12883 1 1 1 LYS HD2 H 14.904 8.065 3.424 1.00 . A A . 1 LYS HD2 1 1 19 12884 1 1 1 LYS HD3 H 15.346 9.734 3.771 1.00 . A A . 1 LYS HD3 1 1 19 12885 1 1 1 LYS HE2 H 15.042 8.482 5.837 1.00 . A A . 1 LYS HE2 1 1 19 12886 1 1 1 LYS HE3 H 13.827 9.745 5.687 1.00 . A A . 1 LYS HE3 1 1 19 12887 1 1 1 LYS HG2 H 13.034 10.432 3.397 1.00 . A A . 1 LYS HG2 1 1 19 12888 1 1 1 LYS HG3 H 12.592 8.764 3.032 1.00 . A A . 1 LYS HG3 1 1 19 12889 1 1 1 LYS HZ1 H 12.221 8.105 5.008 1.00 . A A . 1 LYS HZ1 1 1 19 12890 1 1 1 LYS HZ2 H 12.903 7.635 6.471 1.00 . A A . 1 LYS HZ2 1 1 19 12891 1 1 1 LYS HZ3 H 13.378 6.876 5.046 1.00 . A A . 1 LYS HZ3 1 1 19 12892 1 1 1 LYS N N 12.197 11.561 1.099 1.00 . A A . 1 LYS N 1 1 19 12893 1 1 1 LYS NZ N 13.101 7.789 5.462 1.00 . A A . 1 LYS NZ 1 1 19 12894 1 1 1 LYS O O 11.733 8.094 0.130 1.00 . A A . 1 LYS O 1 1 19 12895 1 1 2 THR C C 8.048 9.673 0.213 1.00 . A A . 2 THR C 1 1 19 12896 1 1 2 THR CA C 9.199 8.865 0.749 1.00 . A A . 2 THR CA 1 1 19 12897 1 1 2 THR CB C 8.822 8.253 2.125 1.00 . A A . 2 THR CB 1 1 19 12898 1 1 2 THR CG2 C 9.661 7.024 2.453 1.00 . A A . 2 THR CG2 1 1 19 12899 1 1 2 THR H H 10.280 10.622 1.072 1.00 . A A . 2 THR H 1 1 19 12900 1 1 2 THR HA H 9.403 8.059 0.060 1.00 . A A . 2 THR HA 1 1 19 12901 1 1 2 THR HB H 7.781 7.966 2.077 1.00 . A A . 2 THR HB 1 1 19 12902 1 1 2 THR HG1 H 8.541 10.061 2.874 1.00 . A A . 2 THR HG1 1 1 19 12903 1 1 2 THR HG21 H 9.486 6.270 1.700 1.00 . A A . 2 THR HG21 1 1 19 12904 1 1 2 THR HG22 H 9.383 6.639 3.423 1.00 . A A . 2 THR HG22 1 1 19 12905 1 1 2 THR HG23 H 10.708 7.292 2.455 1.00 . A A . 2 THR HG23 1 1 19 12906 1 1 2 THR N N 10.374 9.681 0.824 1.00 . A A . 2 THR N 1 1 19 12907 1 1 2 THR O O 7.972 10.883 0.450 1.00 . A A . 2 THR O 1 1 19 12908 1 1 2 THR OG1 O 8.957 9.236 3.170 1.00 . A A . 2 THR OG1 1 1 19 12909 1 1 3 CYS C C 4.909 8.662 -0.964 1.00 . A A . 3 CYS C 1 1 19 12910 1 1 3 CYS CA C 6.027 9.677 -1.021 1.00 . A A . 3 CYS CA 1 1 19 12911 1 1 3 CYS CB C 6.227 10.275 -2.450 1.00 . A A . 3 CYS CB 1 1 19 12912 1 1 3 CYS H H 7.356 8.103 -0.776 1.00 . A A . 3 CYS H 1 1 19 12913 1 1 3 CYS HA H 5.788 10.470 -0.326 1.00 . A A . 3 CYS HA 1 1 19 12914 1 1 3 CYS HB2 H 5.359 10.865 -2.701 1.00 . A A . 3 CYS HB2 1 1 19 12915 1 1 3 CYS HB3 H 7.085 10.931 -2.418 1.00 . A A . 3 CYS HB3 1 1 19 12916 1 1 3 CYS N N 7.207 9.046 -0.532 1.00 . A A . 3 CYS N 1 1 19 12917 1 1 3 CYS O O 5.138 7.471 -1.185 1.00 . A A . 3 CYS O 1 1 19 12918 1 1 3 CYS SG S 6.477 9.098 -3.851 1.00 . A A . 3 CYS SG 1 1 19 12919 1 1 4 GLU C C 1.833 8.277 -1.753 1.00 . A A . 4 GLU C 1 1 19 12920 1 1 4 GLU CA C 2.647 8.177 -0.488 1.00 . A A . 4 GLU CA 1 1 19 12921 1 1 4 GLU CB C 1.834 8.486 0.755 1.00 . A A . 4 GLU CB 1 1 19 12922 1 1 4 GLU CD C 0.165 7.742 2.421 1.00 . A A . 4 GLU CD 1 1 19 12923 1 1 4 GLU CG C 0.751 7.486 1.069 1.00 . A A . 4 GLU CG 1 1 19 12924 1 1 4 GLU H H 3.609 10.024 -0.351 1.00 . A A . 4 GLU H 1 1 19 12925 1 1 4 GLU HA H 3.045 7.177 -0.419 1.00 . A A . 4 GLU HA 1 1 19 12926 1 1 4 GLU HB2 H 2.499 8.529 1.605 1.00 . A A . 4 GLU HB2 1 1 19 12927 1 1 4 GLU HB3 H 1.371 9.453 0.624 1.00 . A A . 4 GLU HB3 1 1 19 12928 1 1 4 GLU HG2 H -0.025 7.576 0.324 1.00 . A A . 4 GLU HG2 1 1 19 12929 1 1 4 GLU HG3 H 1.167 6.489 1.048 1.00 . A A . 4 GLU HG3 1 1 19 12930 1 1 4 GLU N N 3.749 9.080 -0.581 1.00 . A A . 4 GLU N 1 1 19 12931 1 1 4 GLU O O 1.309 9.343 -2.090 1.00 . A A . 4 GLU O 1 1 19 12932 1 1 4 GLU OE1 O 0.745 7.277 3.415 1.00 . A A . 4 GLU OE1 1 1 19 12933 1 1 4 GLU OE2 O -0.855 8.460 2.529 1.00 . A A . 4 GLU OE2 1 1 19 12934 1 1 5 ASN C C 0.306 5.909 -3.867 1.00 . A A . 5 ASN C 1 1 19 12935 1 1 5 ASN CA C 1.099 7.183 -3.742 1.00 . A A . 5 ASN CA 1 1 19 12936 1 1 5 ASN CB C 2.160 7.310 -4.863 1.00 . A A . 5 ASN CB 1 1 19 12937 1 1 5 ASN CG C 1.575 7.500 -6.259 1.00 . A A . 5 ASN CG 1 1 19 12938 1 1 5 ASN H H 2.108 6.345 -2.116 1.00 . A A . 5 ASN H 1 1 19 12939 1 1 5 ASN HA H 0.422 8.022 -3.799 1.00 . A A . 5 ASN HA 1 1 19 12940 1 1 5 ASN HB2 H 2.797 8.156 -4.651 1.00 . A A . 5 ASN HB2 1 1 19 12941 1 1 5 ASN HB3 H 2.761 6.413 -4.865 1.00 . A A . 5 ASN HB3 1 1 19 12942 1 1 5 ASN HD21 H 1.523 9.452 -5.994 1.00 . A A . 5 ASN HD21 1 1 19 12943 1 1 5 ASN HD22 H 0.949 8.897 -7.512 1.00 . A A . 5 ASN HD22 1 1 19 12944 1 1 5 ASN N N 1.751 7.195 -2.464 1.00 . A A . 5 ASN N 1 1 19 12945 1 1 5 ASN ND2 N 1.326 8.723 -6.622 1.00 . A A . 5 ASN ND2 1 1 19 12946 1 1 5 ASN O O 0.452 5.006 -3.041 1.00 . A A . 5 ASN O 1 1 19 12947 1 1 5 ASN OD1 O 1.348 6.543 -6.996 1.00 . A A . 5 ASN OD1 1 1 19 12948 1 1 6 LEU C C -0.568 3.473 -5.435 1.00 . A A . 6 LEU C 1 1 19 12949 1 1 6 LEU CA C -1.366 4.702 -5.081 1.00 . A A . 6 LEU CA 1 1 19 12950 1 1 6 LEU CB C -2.396 4.985 -6.166 1.00 . A A . 6 LEU CB 1 1 19 12951 1 1 6 LEU CD1 C -4.421 6.211 -6.948 1.00 . A A . 6 LEU CD1 1 1 19 12952 1 1 6 LEU CD2 C -4.181 5.599 -4.593 1.00 . A A . 6 LEU CD2 1 1 19 12953 1 1 6 LEU CG C -3.444 6.022 -5.816 1.00 . A A . 6 LEU CG 1 1 19 12954 1 1 6 LEU H H -0.578 6.581 -5.498 1.00 . A A . 6 LEU H 1 1 19 12955 1 1 6 LEU HA H -1.896 4.525 -4.158 1.00 . A A . 6 LEU HA 1 1 19 12956 1 1 6 LEU HB2 H -1.862 5.327 -7.041 1.00 . A A . 6 LEU HB2 1 1 19 12957 1 1 6 LEU HB3 H -2.896 4.058 -6.403 1.00 . A A . 6 LEU HB3 1 1 19 12958 1 1 6 LEU HD11 H -5.145 6.954 -6.646 1.00 . A A . 6 LEU HD11 1 1 19 12959 1 1 6 LEU HD12 H -4.929 5.275 -7.123 1.00 . A A . 6 LEU HD12 1 1 19 12960 1 1 6 LEU HD13 H -3.905 6.535 -7.838 1.00 . A A . 6 LEU HD13 1 1 19 12961 1 1 6 LEU HD21 H -3.520 5.601 -3.739 1.00 . A A . 6 LEU HD21 1 1 19 12962 1 1 6 LEU HD22 H -4.549 4.598 -4.751 1.00 . A A . 6 LEU HD22 1 1 19 12963 1 1 6 LEU HD23 H -5.008 6.269 -4.414 1.00 . A A . 6 LEU HD23 1 1 19 12964 1 1 6 LEU HG H -2.957 6.960 -5.602 1.00 . A A . 6 LEU HG 1 1 19 12965 1 1 6 LEU N N -0.532 5.841 -4.860 1.00 . A A . 6 LEU N 1 1 19 12966 1 1 6 LEU O O 0.425 3.544 -6.175 1.00 . A A . 6 LEU O 1 1 19 12967 1 1 7 ALA C C -0.552 0.720 -6.625 1.00 . A A . 7 ALA C 1 1 19 12968 1 1 7 ALA CA C -0.413 1.073 -5.141 1.00 . A A . 7 ALA CA 1 1 19 12969 1 1 7 ALA CB C -1.093 0.047 -4.263 1.00 . A A . 7 ALA CB 1 1 19 12970 1 1 7 ALA H H -1.751 2.444 -4.257 1.00 . A A . 7 ALA H 1 1 19 12971 1 1 7 ALA HA H 0.635 1.116 -4.883 1.00 . A A . 7 ALA HA 1 1 19 12972 1 1 7 ALA HB1 H -1.024 0.394 -3.241 1.00 . A A . 7 ALA HB1 1 1 19 12973 1 1 7 ALA HB2 H -0.605 -0.912 -4.361 1.00 . A A . 7 ALA HB2 1 1 19 12974 1 1 7 ALA HB3 H -2.133 -0.030 -4.541 1.00 . A A . 7 ALA HB3 1 1 19 12975 1 1 7 ALA N N -0.998 2.370 -4.886 1.00 . A A . 7 ALA N 1 1 19 12976 1 1 7 ALA O O -1.551 1.098 -7.276 1.00 . A A . 7 ALA O 1 1 19 12977 1 1 8 ASP C C -0.077 -1.639 -8.900 1.00 . A A . 8 ASP C 1 1 19 12978 1 1 8 ASP CA C 0.447 -0.257 -8.577 1.00 . A A . 8 ASP CA 1 1 19 12979 1 1 8 ASP CB C 1.866 -0.086 -9.136 1.00 . A A . 8 ASP CB 1 1 19 12980 1 1 8 ASP CG C 1.945 -0.318 -10.636 1.00 . A A . 8 ASP CG 1 1 19 12981 1 1 8 ASP H H 1.106 -0.369 -6.567 1.00 . A A . 8 ASP H 1 1 19 12982 1 1 8 ASP HA H -0.192 0.468 -9.059 1.00 . A A . 8 ASP HA 1 1 19 12983 1 1 8 ASP HB2 H 2.210 0.917 -8.930 1.00 . A A . 8 ASP HB2 1 1 19 12984 1 1 8 ASP HB3 H 2.521 -0.791 -8.646 1.00 . A A . 8 ASP HB3 1 1 19 12985 1 1 8 ASP N N 0.411 0.018 -7.153 1.00 . A A . 8 ASP N 1 1 19 12986 1 1 8 ASP O O -0.892 -1.801 -9.808 1.00 . A A . 8 ASP O 1 1 19 12987 1 1 8 ASP OD1 O 1.674 0.628 -11.423 1.00 . A A . 8 ASP OD1 1 1 19 12988 1 1 8 ASP OD2 O 2.311 -1.420 -11.067 1.00 . A A . 8 ASP OD2 1 1 19 12989 1 1 9 THR C C -1.132 -4.497 -7.537 1.00 . A A . 9 THR C 1 1 19 12990 1 1 9 THR CA C -0.054 -3.972 -8.453 1.00 . A A . 9 THR CA 1 1 19 12991 1 1 9 THR CB C 1.143 -4.940 -8.535 1.00 . A A . 9 THR CB 1 1 19 12992 1 1 9 THR CG2 C 1.845 -4.810 -9.873 1.00 . A A . 9 THR CG2 1 1 19 12993 1 1 9 THR H H 0.894 -2.454 -7.356 1.00 . A A . 9 THR H 1 1 19 12994 1 1 9 THR HA H -0.494 -3.925 -9.438 1.00 . A A . 9 THR HA 1 1 19 12995 1 1 9 THR HB H 0.768 -5.948 -8.435 1.00 . A A . 9 THR HB 1 1 19 12996 1 1 9 THR HG1 H 1.593 -4.839 -6.632 1.00 . A A . 9 THR HG1 1 1 19 12997 1 1 9 THR HG21 H 1.145 -5.030 -10.666 1.00 . A A . 9 THR HG21 1 1 19 12998 1 1 9 THR HG22 H 2.667 -5.507 -9.919 1.00 . A A . 9 THR HG22 1 1 19 12999 1 1 9 THR HG23 H 2.216 -3.802 -9.991 1.00 . A A . 9 THR HG23 1 1 19 13000 1 1 9 THR N N 0.339 -2.624 -8.154 1.00 . A A . 9 THR N 1 1 19 13001 1 1 9 THR O O -1.714 -5.552 -7.811 1.00 . A A . 9 THR O 1 1 19 13002 1 1 9 THR OG1 O 2.071 -4.691 -7.463 1.00 . A A . 9 THR OG1 1 1 19 13003 1 1 10 TYR C C -3.791 -4.014 -6.298 1.00 . A A . 10 TYR C 1 1 19 13004 1 1 10 TYR CA C -2.475 -4.183 -5.563 1.00 . A A . 10 TYR CA 1 1 19 13005 1 1 10 TYR CB C -2.477 -3.391 -4.247 1.00 . A A . 10 TYR CB 1 1 19 13006 1 1 10 TYR CD1 C -3.491 -4.932 -2.512 1.00 . A A . 10 TYR CD1 1 1 19 13007 1 1 10 TYR CD2 C -4.764 -3.059 -3.227 1.00 . A A . 10 TYR CD2 1 1 19 13008 1 1 10 TYR CE1 C -4.517 -5.312 -1.671 1.00 . A A . 10 TYR CE1 1 1 19 13009 1 1 10 TYR CE2 C -5.787 -3.430 -2.389 1.00 . A A . 10 TYR CE2 1 1 19 13010 1 1 10 TYR CG C -3.598 -3.799 -3.306 1.00 . A A . 10 TYR CG 1 1 19 13011 1 1 10 TYR CZ C -5.664 -4.552 -1.617 1.00 . A A . 10 TYR CZ 1 1 19 13012 1 1 10 TYR H H -0.825 -3.020 -6.220 1.00 . A A . 10 TYR H 1 1 19 13013 1 1 10 TYR HA H -2.342 -5.234 -5.353 1.00 . A A . 10 TYR HA 1 1 19 13014 1 1 10 TYR HB2 H -1.537 -3.548 -3.738 1.00 . A A . 10 TYR HB2 1 1 19 13015 1 1 10 TYR HB3 H -2.592 -2.340 -4.468 1.00 . A A . 10 TYR HB3 1 1 19 13016 1 1 10 TYR HD1 H -2.588 -5.523 -2.560 1.00 . A A . 10 TYR HD1 1 1 19 13017 1 1 10 TYR HD2 H -4.868 -2.172 -3.835 1.00 . A A . 10 TYR HD2 1 1 19 13018 1 1 10 TYR HE1 H -4.408 -6.197 -1.061 1.00 . A A . 10 TYR HE1 1 1 19 13019 1 1 10 TYR HE2 H -6.684 -2.828 -2.353 1.00 . A A . 10 TYR HE2 1 1 19 13020 1 1 10 TYR HH H -7.531 -4.714 -1.228 1.00 . A A . 10 TYR HH 1 1 19 13021 1 1 10 TYR N N -1.394 -3.789 -6.442 1.00 . A A . 10 TYR N 1 1 19 13022 1 1 10 TYR O O -4.190 -2.893 -6.657 1.00 . A A . 10 TYR O 1 1 19 13023 1 1 10 TYR OH O -6.692 -4.921 -0.789 1.00 . A A . 10 TYR OH 1 1 19 13024 1 1 11 LYS C C -6.856 -5.226 -6.406 1.00 . A A . 11 LYS C 1 1 19 13025 1 1 11 LYS CA C -5.649 -5.098 -7.303 1.00 . A A . 11 LYS CA 1 1 19 13026 1 1 11 LYS CB C -5.600 -6.176 -8.383 1.00 . A A . 11 LYS CB 1 1 19 13027 1 1 11 LYS CD C -4.394 -7.016 -10.457 1.00 . A A . 11 LYS CD 1 1 19 13028 1 1 11 LYS CE C -3.714 -8.227 -9.829 1.00 . A A . 11 LYS CE 1 1 19 13029 1 1 11 LYS CG C -4.557 -5.879 -9.462 1.00 . A A . 11 LYS CG 1 1 19 13030 1 1 11 LYS H H -4.097 -5.960 -6.199 1.00 . A A . 11 LYS H 1 1 19 13031 1 1 11 LYS HA H -5.696 -4.136 -7.791 1.00 . A A . 11 LYS HA 1 1 19 13032 1 1 11 LYS HB2 H -5.365 -7.122 -7.915 1.00 . A A . 11 LYS HB2 1 1 19 13033 1 1 11 LYS HB3 H -6.569 -6.245 -8.854 1.00 . A A . 11 LYS HB3 1 1 19 13034 1 1 11 LYS HD2 H -5.370 -7.311 -10.813 1.00 . A A . 11 LYS HD2 1 1 19 13035 1 1 11 LYS HD3 H -3.798 -6.669 -11.287 1.00 . A A . 11 LYS HD3 1 1 19 13036 1 1 11 LYS HE2 H -2.726 -7.941 -9.502 1.00 . A A . 11 LYS HE2 1 1 19 13037 1 1 11 LYS HE3 H -4.290 -8.557 -8.978 1.00 . A A . 11 LYS HE3 1 1 19 13038 1 1 11 LYS HG2 H -4.857 -4.992 -10.000 1.00 . A A . 11 LYS HG2 1 1 19 13039 1 1 11 LYS HG3 H -3.609 -5.694 -8.979 1.00 . A A . 11 LYS HG3 1 1 19 13040 1 1 11 LYS HZ1 H -3.109 -10.149 -10.353 1.00 . A A . 11 LYS HZ1 1 1 19 13041 1 1 11 LYS HZ2 H -3.061 -9.062 -11.637 1.00 . A A . 11 LYS HZ2 1 1 19 13042 1 1 11 LYS HZ3 H -4.541 -9.660 -11.079 1.00 . A A . 11 LYS HZ3 1 1 19 13043 1 1 11 LYS N N -4.440 -5.107 -6.547 1.00 . A A . 11 LYS N 1 1 19 13044 1 1 11 LYS NZ N -3.593 -9.339 -10.788 1.00 . A A . 11 LYS NZ 1 1 19 13045 1 1 11 LYS O O -6.911 -6.101 -5.519 1.00 . A A . 11 LYS O 1 1 19 13046 1 1 12 GLY C C -8.889 -3.272 -4.738 1.00 . A A . 12 GLY C 1 1 19 13047 1 1 12 GLY CA C -8.999 -4.320 -5.828 1.00 . A A . 12 GLY CA 1 1 19 13048 1 1 12 GLY H H -7.700 -3.697 -7.343 1.00 . A A . 12 GLY H 1 1 19 13049 1 1 12 GLY HA2 H -9.837 -4.089 -6.469 1.00 . A A . 12 GLY HA2 1 1 19 13050 1 1 12 GLY HA3 H -9.153 -5.287 -5.369 1.00 . A A . 12 GLY HA3 1 1 19 13051 1 1 12 GLY N N -7.806 -4.356 -6.623 1.00 . A A . 12 GLY N 1 1 19 13052 1 1 12 GLY O O -7.825 -2.649 -4.588 1.00 . A A . 12 GLY O 1 1 19 13053 1 1 13 PRO C C -9.366 -2.720 -1.615 1.00 . A A . 13 PRO C 1 1 19 13054 1 1 13 PRO CA C -9.925 -2.078 -2.888 1.00 . A A . 13 PRO CA 1 1 19 13055 1 1 13 PRO CB C -11.406 -1.691 -2.681 1.00 . A A . 13 PRO CB 1 1 19 13056 1 1 13 PRO CD C -11.290 -3.588 -4.163 1.00 . A A . 13 PRO CD 1 1 19 13057 1 1 13 PRO CG C -12.188 -2.482 -3.688 1.00 . A A . 13 PRO CG 1 1 19 13058 1 1 13 PRO HA H -9.345 -1.199 -3.124 1.00 . A A . 13 PRO HA 1 1 19 13059 1 1 13 PRO HB2 H -11.700 -1.942 -1.672 1.00 . A A . 13 PRO HB2 1 1 19 13060 1 1 13 PRO HB3 H -11.527 -0.629 -2.834 1.00 . A A . 13 PRO HB3 1 1 19 13061 1 1 13 PRO HD2 H -11.419 -4.470 -3.552 1.00 . A A . 13 PRO HD2 1 1 19 13062 1 1 13 PRO HD3 H -11.485 -3.810 -5.201 1.00 . A A . 13 PRO HD3 1 1 19 13063 1 1 13 PRO HG2 H -13.071 -2.895 -3.224 1.00 . A A . 13 PRO HG2 1 1 19 13064 1 1 13 PRO HG3 H -12.468 -1.846 -4.514 1.00 . A A . 13 PRO HG3 1 1 19 13065 1 1 13 PRO N N -9.957 -3.018 -3.988 1.00 . A A . 13 PRO N 1 1 19 13066 1 1 13 PRO O O -9.123 -3.943 -1.554 1.00 . A A . 13 PRO O 1 1 19 13067 1 1 14 CYS C C -9.830 -2.860 1.481 1.00 . A A . 14 CYS C 1 1 19 13068 1 1 14 CYS CA C -8.667 -2.377 0.644 1.00 . A A . 14 CYS CA 1 1 19 13069 1 1 14 CYS CB C -7.912 -1.276 1.390 1.00 . A A . 14 CYS CB 1 1 19 13070 1 1 14 CYS H H -9.272 -0.944 -0.756 1.00 . A A . 14 CYS H 1 1 19 13071 1 1 14 CYS HA H -7.993 -3.202 0.470 1.00 . A A . 14 CYS HA 1 1 19 13072 1 1 14 CYS HB2 H -7.005 -1.041 0.853 1.00 . A A . 14 CYS HB2 1 1 19 13073 1 1 14 CYS HB3 H -8.533 -0.396 1.441 1.00 . A A . 14 CYS HB3 1 1 19 13074 1 1 14 CYS N N -9.134 -1.911 -0.626 1.00 . A A . 14 CYS N 1 1 19 13075 1 1 14 CYS O O -10.720 -2.080 1.849 1.00 . A A . 14 CYS O 1 1 19 13076 1 1 14 CYS SG S -7.449 -1.734 3.098 1.00 . A A . 14 CYS SG 1 1 19 13077 1 1 15 PHE C C -10.278 -4.871 3.973 1.00 . A A . 15 PHE C 1 1 19 13078 1 1 15 PHE CA C -10.857 -4.715 2.586 1.00 . A A . 15 PHE CA 1 1 19 13079 1 1 15 PHE CB C -11.320 -6.059 2.038 1.00 . A A . 15 PHE CB 1 1 19 13080 1 1 15 PHE CD1 C -13.205 -5.486 0.500 1.00 . A A . 15 PHE CD1 1 1 19 13081 1 1 15 PHE CD2 C -11.215 -6.370 -0.446 1.00 . A A . 15 PHE CD2 1 1 19 13082 1 1 15 PHE CE1 C -13.767 -5.406 -0.751 1.00 . A A . 15 PHE CE1 1 1 19 13083 1 1 15 PHE CE2 C -11.770 -6.292 -1.701 1.00 . A A . 15 PHE CE2 1 1 19 13084 1 1 15 PHE CG C -11.924 -5.968 0.670 1.00 . A A . 15 PHE CG 1 1 19 13085 1 1 15 PHE CZ C -13.050 -5.810 -1.854 1.00 . A A . 15 PHE CZ 1 1 19 13086 1 1 15 PHE H H -9.185 -4.725 1.328 1.00 . A A . 15 PHE H 1 1 19 13087 1 1 15 PHE HA H -11.695 -4.036 2.629 1.00 . A A . 15 PHE HA 1 1 19 13088 1 1 15 PHE HB2 H -10.473 -6.725 1.983 1.00 . A A . 15 PHE HB2 1 1 19 13089 1 1 15 PHE HB3 H -12.057 -6.476 2.706 1.00 . A A . 15 PHE HB3 1 1 19 13090 1 1 15 PHE HD1 H -13.767 -5.170 1.367 1.00 . A A . 15 PHE HD1 1 1 19 13091 1 1 15 PHE HD2 H -10.209 -6.747 -0.329 1.00 . A A . 15 PHE HD2 1 1 19 13092 1 1 15 PHE HE1 H -14.772 -5.027 -0.869 1.00 . A A . 15 PHE HE1 1 1 19 13093 1 1 15 PHE HE2 H -11.204 -6.611 -2.564 1.00 . A A . 15 PHE HE2 1 1 19 13094 1 1 15 PHE HZ H -13.491 -5.745 -2.837 1.00 . A A . 15 PHE HZ 1 1 19 13095 1 1 15 PHE N N -9.858 -4.136 1.735 1.00 . A A . 15 PHE N 1 1 19 13096 1 1 15 PHE O O -10.934 -4.588 4.978 1.00 . A A . 15 PHE O 1 1 19 13097 1 1 16 THR C C -6.992 -4.707 5.058 1.00 . A A . 16 THR C 1 1 19 13098 1 1 16 THR CA C -8.320 -5.441 5.236 1.00 . A A . 16 THR CA 1 1 19 13099 1 1 16 THR CB C -8.071 -6.934 5.552 1.00 . A A . 16 THR CB 1 1 19 13100 1 1 16 THR CG2 C -7.444 -7.098 6.929 1.00 . A A . 16 THR CG2 1 1 19 13101 1 1 16 THR H H -8.587 -5.550 3.187 1.00 . A A . 16 THR H 1 1 19 13102 1 1 16 THR HA H -8.889 -4.987 6.035 1.00 . A A . 16 THR HA 1 1 19 13103 1 1 16 THR HB H -7.408 -7.342 4.804 1.00 . A A . 16 THR HB 1 1 19 13104 1 1 16 THR HG1 H -10.026 -7.025 5.775 1.00 . A A . 16 THR HG1 1 1 19 13105 1 1 16 THR HG21 H -6.491 -6.592 6.949 1.00 . A A . 16 THR HG21 1 1 19 13106 1 1 16 THR HG22 H -7.303 -8.147 7.142 1.00 . A A . 16 THR HG22 1 1 19 13107 1 1 16 THR HG23 H -8.096 -6.665 7.673 1.00 . A A . 16 THR HG23 1 1 19 13108 1 1 16 THR N N -9.050 -5.305 4.017 1.00 . A A . 16 THR N 1 1 19 13109 1 1 16 THR O O -6.235 -4.999 4.117 1.00 . A A . 16 THR O 1 1 19 13110 1 1 16 THR OG1 O -9.327 -7.645 5.523 1.00 . A A . 16 THR OG1 1 1 19 13111 1 1 17 THR C C -4.248 -3.750 5.879 1.00 . A A . 17 THR C 1 1 19 13112 1 1 17 THR CA C -5.540 -2.923 5.833 1.00 . A A . 17 THR CA 1 1 19 13113 1 1 17 THR CB C -5.579 -1.841 6.922 1.00 . A A . 17 THR CB 1 1 19 13114 1 1 17 THR CG2 C -4.399 -0.878 6.805 1.00 . A A . 17 THR CG2 1 1 19 13115 1 1 17 THR H H -7.350 -3.573 6.665 1.00 . A A . 17 THR H 1 1 19 13116 1 1 17 THR HA H -5.580 -2.431 4.872 1.00 . A A . 17 THR HA 1 1 19 13117 1 1 17 THR HB H -5.575 -2.323 7.889 1.00 . A A . 17 THR HB 1 1 19 13118 1 1 17 THR HG1 H -7.022 -1.208 5.814 1.00 . A A . 17 THR HG1 1 1 19 13119 1 1 17 THR HG21 H -4.429 -0.385 5.845 1.00 . A A . 17 THR HG21 1 1 19 13120 1 1 17 THR HG22 H -3.475 -1.429 6.896 1.00 . A A . 17 THR HG22 1 1 19 13121 1 1 17 THR HG23 H -4.459 -0.140 7.592 1.00 . A A . 17 THR HG23 1 1 19 13122 1 1 17 THR N N -6.727 -3.749 5.923 1.00 . A A . 17 THR N 1 1 19 13123 1 1 17 THR O O -3.299 -3.453 5.159 1.00 . A A . 17 THR O 1 1 19 13124 1 1 17 THR OG1 O -6.811 -1.107 6.750 1.00 . A A . 17 THR OG1 1 1 19 13125 1 1 18 GLY C C -2.732 -6.323 5.437 1.00 . A A . 18 GLY C 1 1 19 13126 1 1 18 GLY CA C -3.111 -5.694 6.767 1.00 . A A . 18 GLY CA 1 1 19 13127 1 1 18 GLY H H -5.053 -5.006 7.205 1.00 . A A . 18 GLY H 1 1 19 13128 1 1 18 GLY HA2 H -2.273 -5.120 7.130 1.00 . A A . 18 GLY HA2 1 1 19 13129 1 1 18 GLY HA3 H -3.333 -6.478 7.476 1.00 . A A . 18 GLY HA3 1 1 19 13130 1 1 18 GLY N N -4.258 -4.817 6.662 1.00 . A A . 18 GLY N 1 1 19 13131 1 1 18 GLY O O -1.556 -6.462 5.141 1.00 . A A . 18 GLY O 1 1 19 13132 1 1 19 SER C C -2.982 -6.240 2.332 1.00 . A A . 19 SER C 1 1 19 13133 1 1 19 SER CA C -3.524 -7.271 3.328 1.00 . A A . 19 SER CA 1 1 19 13134 1 1 19 SER CB C -4.846 -7.834 2.840 1.00 . A A . 19 SER CB 1 1 19 13135 1 1 19 SER H H -4.654 -6.544 4.933 1.00 . A A . 19 SER H 1 1 19 13136 1 1 19 SER HA H -2.817 -8.081 3.432 1.00 . A A . 19 SER HA 1 1 19 13137 1 1 19 SER HB2 H -5.532 -7.020 2.658 1.00 . A A . 19 SER HB2 1 1 19 13138 1 1 19 SER HB3 H -4.690 -8.394 1.930 1.00 . A A . 19 SER HB3 1 1 19 13139 1 1 19 SER HG H -4.999 -9.559 3.673 1.00 . A A . 19 SER HG 1 1 19 13140 1 1 19 SER N N -3.730 -6.670 4.635 1.00 . A A . 19 SER N 1 1 19 13141 1 1 19 SER O O -2.114 -6.544 1.511 1.00 . A A . 19 SER O 1 1 19 13142 1 1 19 SER OG O -5.400 -8.692 3.821 1.00 . A A . 19 SER OG 1 1 19 13143 1 1 20 CYS C C -1.582 -3.614 1.921 1.00 . A A . 20 CYS C 1 1 19 13144 1 1 20 CYS CA C -3.039 -3.919 1.594 1.00 . A A . 20 CYS CA 1 1 19 13145 1 1 20 CYS CB C -3.922 -2.694 1.865 1.00 . A A . 20 CYS CB 1 1 19 13146 1 1 20 CYS H H -4.199 -4.864 3.086 1.00 . A A . 20 CYS H 1 1 19 13147 1 1 20 CYS HA H -3.127 -4.205 0.556 1.00 . A A . 20 CYS HA 1 1 19 13148 1 1 20 CYS HB2 H -4.917 -2.885 1.492 1.00 . A A . 20 CYS HB2 1 1 19 13149 1 1 20 CYS HB3 H -3.975 -2.536 2.932 1.00 . A A . 20 CYS HB3 1 1 19 13150 1 1 20 CYS N N -3.493 -5.028 2.426 1.00 . A A . 20 CYS N 1 1 19 13151 1 1 20 CYS O O -0.709 -3.549 1.035 1.00 . A A . 20 CYS O 1 1 19 13152 1 1 20 CYS SG S -3.350 -1.151 1.108 1.00 . A A . 20 CYS SG 1 1 19 13153 1 1 21 ASP C C 0.936 -4.370 3.372 1.00 . A A . 21 ASP C 1 1 19 13154 1 1 21 ASP CA C -0.014 -3.245 3.757 1.00 . A A . 21 ASP CA 1 1 19 13155 1 1 21 ASP CB C -0.138 -3.119 5.279 1.00 . A A . 21 ASP CB 1 1 19 13156 1 1 21 ASP CG C 1.145 -2.800 5.983 1.00 . A A . 21 ASP CG 1 1 19 13157 1 1 21 ASP H H -2.074 -3.585 3.848 1.00 . A A . 21 ASP H 1 1 19 13158 1 1 21 ASP HA H 0.358 -2.314 3.359 1.00 . A A . 21 ASP HA 1 1 19 13159 1 1 21 ASP HB2 H -0.844 -2.334 5.507 1.00 . A A . 21 ASP HB2 1 1 19 13160 1 1 21 ASP HB3 H -0.522 -4.051 5.668 1.00 . A A . 21 ASP HB3 1 1 19 13161 1 1 21 ASP N N -1.328 -3.502 3.211 1.00 . A A . 21 ASP N 1 1 19 13162 1 1 21 ASP O O 2.073 -4.132 2.981 1.00 . A A . 21 ASP O 1 1 19 13163 1 1 21 ASP OD1 O 1.699 -1.702 5.773 1.00 . A A . 21 ASP OD1 1 1 19 13164 1 1 21 ASP OD2 O 1.586 -3.605 6.820 1.00 . A A . 21 ASP OD2 1 1 19 13165 1 1 22 ASP C C 1.647 -6.730 1.623 1.00 . A A . 22 ASP C 1 1 19 13166 1 1 22 ASP CA C 1.160 -6.797 3.063 1.00 . A A . 22 ASP CA 1 1 19 13167 1 1 22 ASP CB C 0.260 -8.029 3.252 1.00 . A A . 22 ASP CB 1 1 19 13168 1 1 22 ASP CG C 0.924 -9.335 2.912 1.00 . A A . 22 ASP CG 1 1 19 13169 1 1 22 ASP H H -0.513 -5.671 3.714 1.00 . A A . 22 ASP H 1 1 19 13170 1 1 22 ASP HA H 2.010 -6.884 3.723 1.00 . A A . 22 ASP HA 1 1 19 13171 1 1 22 ASP HB2 H -0.066 -8.078 4.281 1.00 . A A . 22 ASP HB2 1 1 19 13172 1 1 22 ASP HB3 H -0.607 -7.915 2.619 1.00 . A A . 22 ASP HB3 1 1 19 13173 1 1 22 ASP N N 0.419 -5.584 3.417 1.00 . A A . 22 ASP N 1 1 19 13174 1 1 22 ASP O O 2.849 -6.829 1.366 1.00 . A A . 22 ASP O 1 1 19 13175 1 1 22 ASP OD1 O 1.565 -9.935 3.792 1.00 . A A . 22 ASP OD1 1 1 19 13176 1 1 22 ASP OD2 O 0.788 -9.804 1.773 1.00 . A A . 22 ASP OD2 1 1 19 13177 1 1 23 HIS C C 2.051 -5.339 -1.024 1.00 . A A . 23 HIS C 1 1 19 13178 1 1 23 HIS CA C 1.036 -6.444 -0.719 1.00 . A A . 23 HIS CA 1 1 19 13179 1 1 23 HIS CB C -0.247 -6.253 -1.560 1.00 . A A . 23 HIS CB 1 1 19 13180 1 1 23 HIS CD2 C 0.552 -5.430 -3.898 1.00 . A A . 23 HIS CD2 1 1 19 13181 1 1 23 HIS CE1 C -0.040 -7.129 -5.099 1.00 . A A . 23 HIS CE1 1 1 19 13182 1 1 23 HIS CG C -0.025 -6.322 -3.056 1.00 . A A . 23 HIS CG 1 1 19 13183 1 1 23 HIS H H -0.208 -6.333 0.980 1.00 . A A . 23 HIS H 1 1 19 13184 1 1 23 HIS HA H 1.480 -7.393 -0.980 1.00 . A A . 23 HIS HA 1 1 19 13185 1 1 23 HIS HB2 H -0.958 -7.021 -1.297 1.00 . A A . 23 HIS HB2 1 1 19 13186 1 1 23 HIS HB3 H -0.670 -5.286 -1.329 1.00 . A A . 23 HIS HB3 1 1 19 13187 1 1 23 HIS HD1 H -0.873 -8.195 -3.536 1.00 . A A . 23 HIS HD1 1 1 19 13188 1 1 23 HIS HD2 H 0.931 -4.459 -3.607 1.00 . A A . 23 HIS HD2 1 1 19 13189 1 1 23 HIS HE1 H -0.211 -7.791 -5.934 1.00 . A A . 23 HIS HE1 1 1 19 13190 1 1 23 HIS N N 0.722 -6.488 0.700 1.00 . A A . 23 HIS N 1 1 19 13191 1 1 23 HIS ND1 N -0.399 -7.389 -3.840 1.00 . A A . 23 HIS ND1 1 1 19 13192 1 1 23 HIS NE2 N 0.548 -5.946 -5.189 1.00 . A A . 23 HIS NE2 1 1 19 13193 1 1 23 HIS O O 3.073 -5.592 -1.673 1.00 . A A . 23 HIS O 1 1 19 13194 1 1 24 CYS C C 4.093 -3.237 -0.266 1.00 . A A . 24 CYS C 1 1 19 13195 1 1 24 CYS CA C 2.674 -3.020 -0.801 1.00 . A A . 24 CYS CA 1 1 19 13196 1 1 24 CYS CB C 2.062 -1.690 -0.337 1.00 . A A . 24 CYS CB 1 1 19 13197 1 1 24 CYS H H 0.980 -4.002 -0.003 1.00 . A A . 24 CYS H 1 1 19 13198 1 1 24 CYS HA H 2.761 -2.988 -1.878 1.00 . A A . 24 CYS HA 1 1 19 13199 1 1 24 CYS HB2 H 1.747 -1.788 0.692 1.00 . A A . 24 CYS HB2 1 1 19 13200 1 1 24 CYS HB3 H 2.804 -0.910 -0.411 1.00 . A A . 24 CYS HB3 1 1 19 13201 1 1 24 CYS N N 1.792 -4.142 -0.539 1.00 . A A . 24 CYS N 1 1 19 13202 1 1 24 CYS O O 5.054 -2.846 -0.904 1.00 . A A . 24 CYS O 1 1 19 13203 1 1 24 CYS SG S 0.608 -1.189 -1.325 1.00 . A A . 24 CYS SG 1 1 19 13204 1 1 25 LYS C C 6.229 -5.355 0.714 1.00 . A A . 25 LYS C 1 1 19 13205 1 1 25 LYS CA C 5.566 -4.158 1.409 1.00 . A A . 25 LYS CA 1 1 19 13206 1 1 25 LYS CB C 5.502 -4.417 2.910 1.00 . A A . 25 LYS CB 1 1 19 13207 1 1 25 LYS CD C 4.821 -3.605 5.205 1.00 . A A . 25 LYS CD 1 1 19 13208 1 1 25 LYS CE C 4.055 -4.898 5.420 1.00 . A A . 25 LYS CE 1 1 19 13209 1 1 25 LYS CG C 4.929 -3.265 3.719 1.00 . A A . 25 LYS CG 1 1 19 13210 1 1 25 LYS H H 3.435 -4.208 1.352 1.00 . A A . 25 LYS H 1 1 19 13211 1 1 25 LYS HA H 6.168 -3.280 1.232 1.00 . A A . 25 LYS HA 1 1 19 13212 1 1 25 LYS HB2 H 4.878 -5.284 3.069 1.00 . A A . 25 LYS HB2 1 1 19 13213 1 1 25 LYS HB3 H 6.495 -4.631 3.272 1.00 . A A . 25 LYS HB3 1 1 19 13214 1 1 25 LYS HD2 H 5.815 -3.720 5.611 1.00 . A A . 25 LYS HD2 1 1 19 13215 1 1 25 LYS HD3 H 4.310 -2.802 5.716 1.00 . A A . 25 LYS HD3 1 1 19 13216 1 1 25 LYS HE2 H 3.143 -4.866 4.841 1.00 . A A . 25 LYS HE2 1 1 19 13217 1 1 25 LYS HE3 H 4.683 -5.697 5.060 1.00 . A A . 25 LYS HE3 1 1 19 13218 1 1 25 LYS HG2 H 5.573 -2.406 3.604 1.00 . A A . 25 LYS HG2 1 1 19 13219 1 1 25 LYS HG3 H 3.946 -3.032 3.339 1.00 . A A . 25 LYS HG3 1 1 19 13220 1 1 25 LYS HZ1 H 3.009 -4.417 7.106 1.00 . A A . 25 LYS HZ1 1 1 19 13221 1 1 25 LYS HZ2 H 4.534 -5.057 7.471 1.00 . A A . 25 LYS HZ2 1 1 19 13222 1 1 25 LYS HZ3 H 3.269 -6.067 6.952 1.00 . A A . 25 LYS HZ3 1 1 19 13223 1 1 25 LYS N N 4.233 -3.898 0.865 1.00 . A A . 25 LYS N 1 1 19 13224 1 1 25 LYS NZ N 3.717 -5.136 6.833 1.00 . A A . 25 LYS NZ 1 1 19 13225 1 1 25 LYS O O 7.391 -5.293 0.315 1.00 . A A . 25 LYS O 1 1 19 13226 1 1 26 ASN C C 6.203 -7.642 -1.488 1.00 . A A . 26 ASN C 1 1 19 13227 1 1 26 ASN CA C 6.017 -7.681 0.009 1.00 . A A . 26 ASN CA 1 1 19 13228 1 1 26 ASN CB C 5.129 -8.884 0.368 1.00 . A A . 26 ASN CB 1 1 19 13229 1 1 26 ASN CG C 5.027 -9.163 1.852 1.00 . A A . 26 ASN CG 1 1 19 13230 1 1 26 ASN H H 4.526 -6.387 0.803 1.00 . A A . 26 ASN H 1 1 19 13231 1 1 26 ASN HA H 6.982 -7.837 0.467 1.00 . A A . 26 ASN HA 1 1 19 13232 1 1 26 ASN HB2 H 4.131 -8.692 0.003 1.00 . A A . 26 ASN HB2 1 1 19 13233 1 1 26 ASN HB3 H 5.508 -9.767 -0.124 1.00 . A A . 26 ASN HB3 1 1 19 13234 1 1 26 ASN HD21 H 3.244 -9.966 1.591 1.00 . A A . 26 ASN HD21 1 1 19 13235 1 1 26 ASN HD22 H 3.802 -9.964 3.198 1.00 . A A . 26 ASN HD22 1 1 19 13236 1 1 26 ASN N N 5.478 -6.425 0.550 1.00 . A A . 26 ASN N 1 1 19 13237 1 1 26 ASN ND2 N 3.939 -9.746 2.250 1.00 . A A . 26 ASN ND2 1 1 19 13238 1 1 26 ASN O O 7.304 -7.863 -1.996 1.00 . A A . 26 ASN O 1 1 19 13239 1 1 26 ASN OD1 O 5.928 -8.848 2.636 1.00 . A A . 26 ASN OD1 1 1 19 13240 1 1 27 LYS C C 5.684 -6.109 -4.231 1.00 . A A . 27 LYS C 1 1 19 13241 1 1 27 LYS CA C 5.143 -7.397 -3.636 1.00 . A A . 27 LYS CA 1 1 19 13242 1 1 27 LYS CB C 3.719 -7.685 -4.151 1.00 . A A . 27 LYS CB 1 1 19 13243 1 1 27 LYS CD C 4.426 -8.857 -6.273 1.00 . A A . 27 LYS CD 1 1 19 13244 1 1 27 LYS CE C 4.236 -8.917 -7.773 1.00 . A A . 27 LYS CE 1 1 19 13245 1 1 27 LYS CG C 3.571 -7.758 -5.667 1.00 . A A . 27 LYS CG 1 1 19 13246 1 1 27 LYS H H 4.318 -7.069 -1.735 1.00 . A A . 27 LYS H 1 1 19 13247 1 1 27 LYS HA H 5.781 -8.214 -3.936 1.00 . A A . 27 LYS HA 1 1 19 13248 1 1 27 LYS HB2 H 3.390 -8.629 -3.745 1.00 . A A . 27 LYS HB2 1 1 19 13249 1 1 27 LYS HB3 H 3.063 -6.908 -3.785 1.00 . A A . 27 LYS HB3 1 1 19 13250 1 1 27 LYS HD2 H 5.464 -8.650 -6.059 1.00 . A A . 27 LYS HD2 1 1 19 13251 1 1 27 LYS HD3 H 4.146 -9.806 -5.841 1.00 . A A . 27 LYS HD3 1 1 19 13252 1 1 27 LYS HE2 H 3.215 -9.199 -7.981 1.00 . A A . 27 LYS HE2 1 1 19 13253 1 1 27 LYS HE3 H 4.423 -7.936 -8.180 1.00 . A A . 27 LYS HE3 1 1 19 13254 1 1 27 LYS HG2 H 2.536 -7.950 -5.910 1.00 . A A . 27 LYS HG2 1 1 19 13255 1 1 27 LYS HG3 H 3.867 -6.808 -6.088 1.00 . A A . 27 LYS HG3 1 1 19 13256 1 1 27 LYS HZ1 H 6.133 -9.654 -8.228 1.00 . A A . 27 LYS HZ1 1 1 19 13257 1 1 27 LYS HZ2 H 4.996 -9.878 -9.447 1.00 . A A . 27 LYS HZ2 1 1 19 13258 1 1 27 LYS HZ3 H 4.957 -10.856 -8.075 1.00 . A A . 27 LYS HZ3 1 1 19 13259 1 1 27 LYS N N 5.141 -7.351 -2.192 1.00 . A A . 27 LYS N 1 1 19 13260 1 1 27 LYS NZ N 5.137 -9.892 -8.418 1.00 . A A . 27 LYS NZ 1 1 19 13261 1 1 27 LYS O O 6.535 -6.137 -5.119 1.00 . A A . 27 LYS O 1 1 19 13262 1 1 28 GLU C C 6.923 -3.177 -3.722 1.00 . A A . 28 GLU C 1 1 19 13263 1 1 28 GLU CA C 5.636 -3.724 -4.317 1.00 . A A . 28 GLU CA 1 1 19 13264 1 1 28 GLU CB C 4.516 -2.692 -4.313 1.00 . A A . 28 GLU CB 1 1 19 13265 1 1 28 GLU CD C 2.384 -2.027 -5.503 1.00 . A A . 28 GLU CD 1 1 19 13266 1 1 28 GLU CG C 3.315 -3.144 -5.108 1.00 . A A . 28 GLU CG 1 1 19 13267 1 1 28 GLU H H 4.576 -5.007 -2.995 1.00 . A A . 28 GLU H 1 1 19 13268 1 1 28 GLU HA H 5.864 -3.955 -5.348 1.00 . A A . 28 GLU HA 1 1 19 13269 1 1 28 GLU HB2 H 4.208 -2.518 -3.293 1.00 . A A . 28 GLU HB2 1 1 19 13270 1 1 28 GLU HB3 H 4.880 -1.768 -4.737 1.00 . A A . 28 GLU HB3 1 1 19 13271 1 1 28 GLU HG2 H 3.656 -3.640 -6.003 1.00 . A A . 28 GLU HG2 1 1 19 13272 1 1 28 GLU HG3 H 2.765 -3.854 -4.510 1.00 . A A . 28 GLU HG3 1 1 19 13273 1 1 28 GLU N N 5.221 -4.986 -3.737 1.00 . A A . 28 GLU N 1 1 19 13274 1 1 28 GLU O O 7.507 -2.252 -4.270 1.00 . A A . 28 GLU O 1 1 19 13275 1 1 28 GLU OE1 O 1.165 -2.250 -5.565 1.00 . A A . 28 GLU OE1 1 1 19 13276 1 1 28 GLU OE2 O 2.868 -0.921 -5.828 1.00 . A A . 28 GLU OE2 1 1 19 13277 1 1 29 HIS C C 8.579 -1.916 -1.475 1.00 . A A . 29 HIS C 1 1 19 13278 1 1 29 HIS CA C 8.629 -3.373 -1.942 1.00 . A A . 29 HIS CA 1 1 19 13279 1 1 29 HIS CB C 9.858 -3.606 -2.854 1.00 . A A . 29 HIS CB 1 1 19 13280 1 1 29 HIS CD2 C 10.504 -6.056 -2.387 1.00 . A A . 29 HIS CD2 1 1 19 13281 1 1 29 HIS CE1 C 10.383 -6.860 -4.397 1.00 . A A . 29 HIS CE1 1 1 19 13282 1 1 29 HIS CG C 10.119 -5.043 -3.187 1.00 . A A . 29 HIS CG 1 1 19 13283 1 1 29 HIS H H 6.839 -4.504 -2.246 1.00 . A A . 29 HIS H 1 1 19 13284 1 1 29 HIS HA H 8.725 -3.998 -1.066 1.00 . A A . 29 HIS HA 1 1 19 13285 1 1 29 HIS HB2 H 9.704 -3.080 -3.784 1.00 . A A . 29 HIS HB2 1 1 19 13286 1 1 29 HIS HB3 H 10.736 -3.207 -2.368 1.00 . A A . 29 HIS HB3 1 1 19 13287 1 1 29 HIS HD1 H 9.767 -5.101 -5.278 1.00 . A A . 29 HIS HD1 1 1 19 13288 1 1 29 HIS HD2 H 10.660 -5.987 -1.320 1.00 . A A . 29 HIS HD2 1 1 19 13289 1 1 29 HIS HE1 H 10.420 -7.524 -5.250 1.00 . A A . 29 HIS HE1 1 1 19 13290 1 1 29 HIS N N 7.373 -3.772 -2.617 1.00 . A A . 29 HIS N 1 1 19 13291 1 1 29 HIS ND1 N 10.044 -5.571 -4.459 1.00 . A A . 29 HIS ND1 1 1 19 13292 1 1 29 HIS NE2 N 10.675 -7.212 -3.153 1.00 . A A . 29 HIS NE2 1 1 19 13293 1 1 29 HIS O O 9.582 -1.188 -1.511 1.00 . A A . 29 HIS O 1 1 19 13294 1 1 30 LEU C C 7.437 -0.181 0.995 1.00 . A A . 30 LEU C 1 1 19 13295 1 1 30 LEU CA C 7.244 -0.166 -0.519 1.00 . A A . 30 LEU CA 1 1 19 13296 1 1 30 LEU CB C 5.842 0.344 -0.894 1.00 . A A . 30 LEU CB 1 1 19 13297 1 1 30 LEU CD1 C 4.080 0.786 -2.649 1.00 . A A . 30 LEU CD1 1 1 19 13298 1 1 30 LEU CD2 C 6.487 0.679 -3.341 1.00 . A A . 30 LEU CD2 1 1 19 13299 1 1 30 LEU CG C 5.429 0.160 -2.371 1.00 . A A . 30 LEU CG 1 1 19 13300 1 1 30 LEU H H 6.673 -2.130 -1.000 1.00 . A A . 30 LEU H 1 1 19 13301 1 1 30 LEU HA H 7.994 0.470 -0.964 1.00 . A A . 30 LEU HA 1 1 19 13302 1 1 30 LEU HB2 H 5.125 -0.176 -0.276 1.00 . A A . 30 LEU HB2 1 1 19 13303 1 1 30 LEU HB3 H 5.791 1.397 -0.660 1.00 . A A . 30 LEU HB3 1 1 19 13304 1 1 30 LEU HD11 H 4.109 1.843 -2.436 1.00 . A A . 30 LEU HD11 1 1 19 13305 1 1 30 LEU HD12 H 3.332 0.316 -2.027 1.00 . A A . 30 LEU HD12 1 1 19 13306 1 1 30 LEU HD13 H 3.822 0.633 -3.686 1.00 . A A . 30 LEU HD13 1 1 19 13307 1 1 30 LEU HD21 H 6.126 0.587 -4.354 1.00 . A A . 30 LEU HD21 1 1 19 13308 1 1 30 LEU HD22 H 7.381 0.081 -3.233 1.00 . A A . 30 LEU HD22 1 1 19 13309 1 1 30 LEU HD23 H 6.724 1.707 -3.126 1.00 . A A . 30 LEU HD23 1 1 19 13310 1 1 30 LEU HG H 5.313 -0.901 -2.537 1.00 . A A . 30 LEU HG 1 1 19 13311 1 1 30 LEU N N 7.433 -1.507 -1.014 1.00 . A A . 30 LEU N 1 1 19 13312 1 1 30 LEU O O 7.734 -1.238 1.562 1.00 . A A . 30 LEU O 1 1 19 13313 1 1 31 ARG C C 6.332 0.333 3.817 1.00 . A A . 31 ARG C 1 1 19 13314 1 1 31 ARG CA C 7.480 1.018 3.092 1.00 . A A . 31 ARG CA 1 1 19 13315 1 1 31 ARG CB C 7.606 2.474 3.579 1.00 . A A . 31 ARG CB 1 1 19 13316 1 1 31 ARG CD C 7.830 4.043 5.551 1.00 . A A . 31 ARG CD 1 1 19 13317 1 1 31 ARG CG C 7.860 2.597 5.079 1.00 . A A . 31 ARG CG 1 1 19 13318 1 1 31 ARG CZ C 7.702 5.099 7.822 1.00 . A A . 31 ARG CZ 1 1 19 13319 1 1 31 ARG H H 6.961 1.758 1.183 1.00 . A A . 31 ARG H 1 1 19 13320 1 1 31 ARG HA H 8.395 0.491 3.313 1.00 . A A . 31 ARG HA 1 1 19 13321 1 1 31 ARG HB2 H 8.424 2.947 3.055 1.00 . A A . 31 ARG HB2 1 1 19 13322 1 1 31 ARG HB3 H 6.692 2.998 3.346 1.00 . A A . 31 ARG HB3 1 1 19 13323 1 1 31 ARG HD2 H 8.560 4.612 4.995 1.00 . A A . 31 ARG HD2 1 1 19 13324 1 1 31 ARG HD3 H 6.846 4.447 5.374 1.00 . A A . 31 ARG HD3 1 1 19 13325 1 1 31 ARG HE H 8.715 3.426 7.330 1.00 . A A . 31 ARG HE 1 1 19 13326 1 1 31 ARG HG2 H 7.097 2.044 5.608 1.00 . A A . 31 ARG HG2 1 1 19 13327 1 1 31 ARG HG3 H 8.828 2.171 5.304 1.00 . A A . 31 ARG HG3 1 1 19 13328 1 1 31 ARG HH11 H 6.644 6.178 6.432 1.00 . A A . 31 ARG HH11 1 1 19 13329 1 1 31 ARG HH12 H 6.594 6.787 8.026 1.00 . A A . 31 ARG HH12 1 1 19 13330 1 1 31 ARG HH21 H 8.661 4.347 9.453 1.00 . A A . 31 ARG HH21 1 1 19 13331 1 1 31 ARG HH22 H 7.768 5.780 9.740 1.00 . A A . 31 ARG HH22 1 1 19 13332 1 1 31 ARG N N 7.270 0.952 1.652 1.00 . A A . 31 ARG N 1 1 19 13333 1 1 31 ARG NE N 8.133 4.141 6.987 1.00 . A A . 31 ARG NE 1 1 19 13334 1 1 31 ARG NH1 N 6.930 6.088 7.388 1.00 . A A . 31 ARG NH1 1 1 19 13335 1 1 31 ARG NH2 N 8.068 5.071 9.095 1.00 . A A . 31 ARG NH2 1 1 19 13336 1 1 31 ARG O O 6.543 -0.588 4.595 1.00 . A A . 31 ARG O 1 1 19 13337 1 1 32 SER C C 2.749 0.563 3.265 1.00 . A A . 32 SER C 1 1 19 13338 1 1 32 SER CA C 3.946 0.265 4.164 1.00 . A A . 32 SER CA 1 1 19 13339 1 1 32 SER CB C 3.799 0.955 5.532 1.00 . A A . 32 SER CB 1 1 19 13340 1 1 32 SER H H 5.001 1.469 2.855 1.00 . A A . 32 SER H 1 1 19 13341 1 1 32 SER HA H 4.046 -0.803 4.310 1.00 . A A . 32 SER HA 1 1 19 13342 1 1 32 SER HB2 H 2.816 0.750 5.932 1.00 . A A . 32 SER HB2 1 1 19 13343 1 1 32 SER HB3 H 4.552 0.577 6.208 1.00 . A A . 32 SER HB3 1 1 19 13344 1 1 32 SER HG H 3.483 2.793 6.131 1.00 . A A . 32 SER HG 1 1 19 13345 1 1 32 SER N N 5.135 0.768 3.528 1.00 . A A . 32 SER N 1 1 19 13346 1 1 32 SER O O 2.883 1.327 2.289 1.00 . A A . 32 SER O 1 1 19 13347 1 1 32 SER OG O 3.960 2.373 5.407 1.00 . A A . 32 SER OG 1 1 19 13348 1 1 33 GLY C C -0.682 0.743 3.653 1.00 . A A . 33 GLY C 1 1 19 13349 1 1 33 GLY CA C 0.424 0.225 2.783 1.00 . A A . 33 GLY CA 1 1 19 13350 1 1 33 GLY H H 1.564 -0.627 4.343 1.00 . A A . 33 GLY H 1 1 19 13351 1 1 33 GLY HA2 H 0.663 0.976 2.044 1.00 . A A . 33 GLY HA2 1 1 19 13352 1 1 33 GLY HA3 H 0.094 -0.662 2.266 1.00 . A A . 33 GLY HA3 1 1 19 13353 1 1 33 GLY N N 1.614 -0.024 3.562 1.00 . A A . 33 GLY N 1 1 19 13354 1 1 33 GLY O O -0.900 0.231 4.756 1.00 . A A . 33 GLY O 1 1 19 13355 1 1 34 ARG C C -3.683 2.484 3.226 1.00 . A A . 34 ARG C 1 1 19 13356 1 1 34 ARG CA C -2.385 2.389 3.995 1.00 . A A . 34 ARG CA 1 1 19 13357 1 1 34 ARG CB C -1.928 3.778 4.431 1.00 . A A . 34 ARG CB 1 1 19 13358 1 1 34 ARG CD C -0.195 5.178 5.561 1.00 . A A . 34 ARG CD 1 1 19 13359 1 1 34 ARG CG C -0.639 3.776 5.238 1.00 . A A . 34 ARG CG 1 1 19 13360 1 1 34 ARG CZ C -1.267 7.210 6.471 1.00 . A A . 34 ARG CZ 1 1 19 13361 1 1 34 ARG H H -1.210 2.111 2.294 1.00 . A A . 34 ARG H 1 1 19 13362 1 1 34 ARG HA H -2.540 1.785 4.876 1.00 . A A . 34 ARG HA 1 1 19 13363 1 1 34 ARG HB2 H -1.774 4.383 3.550 1.00 . A A . 34 ARG HB2 1 1 19 13364 1 1 34 ARG HB3 H -2.704 4.227 5.033 1.00 . A A . 34 ARG HB3 1 1 19 13365 1 1 34 ARG HD2 H 0.739 5.135 6.099 1.00 . A A . 34 ARG HD2 1 1 19 13366 1 1 34 ARG HD3 H -0.052 5.717 4.636 1.00 . A A . 34 ARG HD3 1 1 19 13367 1 1 34 ARG HE H -1.767 5.306 6.904 1.00 . A A . 34 ARG HE 1 1 19 13368 1 1 34 ARG HG2 H -0.804 3.239 6.161 1.00 . A A . 34 ARG HG2 1 1 19 13369 1 1 34 ARG HG3 H 0.132 3.280 4.667 1.00 . A A . 34 ARG HG3 1 1 19 13370 1 1 34 ARG HH11 H 0.049 7.610 4.945 1.00 . A A . 34 ARG HH11 1 1 19 13371 1 1 34 ARG HH12 H -0.562 8.987 5.736 1.00 . A A . 34 ARG HH12 1 1 19 13372 1 1 34 ARG HH21 H -2.743 7.203 7.887 1.00 . A A . 34 ARG HH21 1 1 19 13373 1 1 34 ARG HH22 H -2.218 8.751 7.408 1.00 . A A . 34 ARG HH22 1 1 19 13374 1 1 34 ARG N N -1.363 1.760 3.199 1.00 . A A . 34 ARG N 1 1 19 13375 1 1 34 ARG NE N -1.176 5.888 6.375 1.00 . A A . 34 ARG NE 1 1 19 13376 1 1 34 ARG NH1 N -0.557 7.985 5.663 1.00 . A A . 34 ARG NH1 1 1 19 13377 1 1 34 ARG NH2 N -2.134 7.755 7.313 1.00 . A A . 34 ARG NH2 1 1 19 13378 1 1 34 ARG O O -3.700 2.732 2.010 1.00 . A A . 34 ARG O 1 1 19 13379 1 1 35 CYS C C -6.725 3.645 3.669 1.00 . A A . 35 CYS C 1 1 19 13380 1 1 35 CYS CA C -6.059 2.349 3.318 1.00 . A A . 35 CYS CA 1 1 19 13381 1 1 35 CYS CB C -6.879 1.164 3.791 1.00 . A A . 35 CYS CB 1 1 19 13382 1 1 35 CYS H H -4.700 2.167 4.892 1.00 . A A . 35 CYS H 1 1 19 13383 1 1 35 CYS HA H -5.958 2.311 2.243 1.00 . A A . 35 CYS HA 1 1 19 13384 1 1 35 CYS HB2 H -7.110 1.288 4.839 1.00 . A A . 35 CYS HB2 1 1 19 13385 1 1 35 CYS HB3 H -7.796 1.111 3.223 1.00 . A A . 35 CYS HB3 1 1 19 13386 1 1 35 CYS N N -4.762 2.313 3.922 1.00 . A A . 35 CYS N 1 1 19 13387 1 1 35 CYS O O -7.129 3.872 4.819 1.00 . A A . 35 CYS O 1 1 19 13388 1 1 35 CYS SG S -6.007 -0.419 3.591 1.00 . A A . 35 CYS SG 1 1 19 13389 1 1 36 ARG C C -8.890 5.724 2.682 1.00 . A A . 36 ARG C 1 1 19 13390 1 1 36 ARG CA C -7.375 5.812 2.875 1.00 . A A . 36 ARG CA 1 1 19 13391 1 1 36 ARG CB C -6.754 6.776 1.882 1.00 . A A . 36 ARG CB 1 1 19 13392 1 1 36 ARG CD C -4.684 7.351 3.294 1.00 . A A . 36 ARG CD 1 1 19 13393 1 1 36 ARG CG C -5.226 6.869 1.950 1.00 . A A . 36 ARG CG 1 1 19 13394 1 1 36 ARG CZ C -4.310 9.669 4.133 1.00 . A A . 36 ARG CZ 1 1 19 13395 1 1 36 ARG H H -6.451 4.253 1.820 1.00 . A A . 36 ARG H 1 1 19 13396 1 1 36 ARG HA H -7.163 6.148 3.878 1.00 . A A . 36 ARG HA 1 1 19 13397 1 1 36 ARG HB2 H -7.003 6.395 0.903 1.00 . A A . 36 ARG HB2 1 1 19 13398 1 1 36 ARG HB3 H -7.176 7.760 2.015 1.00 . A A . 36 ARG HB3 1 1 19 13399 1 1 36 ARG HD2 H -5.019 6.672 4.064 1.00 . A A . 36 ARG HD2 1 1 19 13400 1 1 36 ARG HD3 H -3.606 7.328 3.254 1.00 . A A . 36 ARG HD3 1 1 19 13401 1 1 36 ARG HE H -6.090 8.864 3.575 1.00 . A A . 36 ARG HE 1 1 19 13402 1 1 36 ARG HG2 H -4.836 5.876 1.784 1.00 . A A . 36 ARG HG2 1 1 19 13403 1 1 36 ARG HG3 H -4.877 7.525 1.165 1.00 . A A . 36 ARG HG3 1 1 19 13404 1 1 36 ARG HH11 H -2.484 8.772 3.652 1.00 . A A . 36 ARG HH11 1 1 19 13405 1 1 36 ARG HH12 H -2.385 10.262 4.464 1.00 . A A . 36 ARG HH12 1 1 19 13406 1 1 36 ARG HH21 H -5.816 10.960 4.632 1.00 . A A . 36 ARG HH21 1 1 19 13407 1 1 36 ARG HH22 H -4.246 11.509 4.987 1.00 . A A . 36 ARG HH22 1 1 19 13408 1 1 36 ARG N N -6.794 4.510 2.702 1.00 . A A . 36 ARG N 1 1 19 13409 1 1 36 ARG NE N -5.119 8.706 3.646 1.00 . A A . 36 ARG NE 1 1 19 13410 1 1 36 ARG NH1 N -2.974 9.550 4.068 1.00 . A A . 36 ARG NH1 1 1 19 13411 1 1 36 ARG NH2 N -4.828 10.783 4.611 1.00 . A A . 36 ARG NH2 1 1 19 13412 1 1 36 ARG O O -9.410 4.644 2.386 1.00 . A A . 36 ARG O 1 1 19 13413 1 1 37 ASP C C -11.656 6.368 1.460 1.00 . A A . 37 ASP C 1 1 19 13414 1 1 37 ASP CA C -11.054 6.923 2.757 1.00 . A A . 37 ASP CA 1 1 19 13415 1 1 37 ASP CB C -11.525 8.362 2.968 1.00 . A A . 37 ASP CB 1 1 19 13416 1 1 37 ASP CG C -13.033 8.489 2.977 1.00 . A A . 37 ASP CG 1 1 19 13417 1 1 37 ASP H H -9.072 7.682 2.948 1.00 . A A . 37 ASP H 1 1 19 13418 1 1 37 ASP HA H -11.427 6.328 3.577 1.00 . A A . 37 ASP HA 1 1 19 13419 1 1 37 ASP HB2 H -11.145 8.728 3.909 1.00 . A A . 37 ASP HB2 1 1 19 13420 1 1 37 ASP HB3 H -11.135 8.976 2.169 1.00 . A A . 37 ASP HB3 1 1 19 13421 1 1 37 ASP N N -9.571 6.848 2.805 1.00 . A A . 37 ASP N 1 1 19 13422 1 1 37 ASP O O -12.753 5.814 1.463 1.00 . A A . 37 ASP O 1 1 19 13423 1 1 37 ASP OD1 O -13.618 8.857 1.936 1.00 . A A . 37 ASP OD1 1 1 19 13424 1 1 37 ASP OD2 O -13.658 8.229 4.027 1.00 . A A . 37 ASP OD2 1 1 19 13425 1 1 38 ASP C C -11.256 4.500 -1.066 1.00 . A A . 38 ASP C 1 1 19 13426 1 1 38 ASP CA C -11.426 6.002 -0.945 1.00 . A A . 38 ASP CA 1 1 19 13427 1 1 38 ASP CB C -10.723 6.680 -2.140 1.00 . A A . 38 ASP CB 1 1 19 13428 1 1 38 ASP CG C -10.996 8.157 -2.260 1.00 . A A . 38 ASP CG 1 1 19 13429 1 1 38 ASP H H -10.069 6.958 0.425 1.00 . A A . 38 ASP H 1 1 19 13430 1 1 38 ASP HA H -12.482 6.224 -0.995 1.00 . A A . 38 ASP HA 1 1 19 13431 1 1 38 ASP HB2 H -9.657 6.548 -2.035 1.00 . A A . 38 ASP HB2 1 1 19 13432 1 1 38 ASP HB3 H -11.045 6.195 -3.050 1.00 . A A . 38 ASP HB3 1 1 19 13433 1 1 38 ASP N N -10.934 6.500 0.359 1.00 . A A . 38 ASP N 1 1 19 13434 1 1 38 ASP O O -11.644 3.900 -2.069 1.00 . A A . 38 ASP O 1 1 19 13435 1 1 38 ASP OD1 O -10.029 8.958 -2.271 1.00 . A A . 38 ASP OD1 1 1 19 13436 1 1 38 ASP OD2 O -12.172 8.547 -2.339 1.00 . A A . 38 ASP OD2 1 1 19 13437 1 1 39 PHE C C -9.331 1.976 -0.979 1.00 . A A . 39 PHE C 1 1 19 13438 1 1 39 PHE CA C -10.352 2.460 0.019 1.00 . A A . 39 PHE CA 1 1 19 13439 1 1 39 PHE CB C -11.611 1.585 0.037 1.00 . A A . 39 PHE CB 1 1 19 13440 1 1 39 PHE CD1 C -11.949 0.903 2.409 1.00 . A A . 39 PHE CD1 1 1 19 13441 1 1 39 PHE CD2 C -13.409 2.544 1.489 1.00 . A A . 39 PHE CD2 1 1 19 13442 1 1 39 PHE CE1 C -12.599 0.991 3.616 1.00 . A A . 39 PHE CE1 1 1 19 13443 1 1 39 PHE CE2 C -14.064 2.633 2.693 1.00 . A A . 39 PHE CE2 1 1 19 13444 1 1 39 PHE CG C -12.345 1.677 1.332 1.00 . A A . 39 PHE CG 1 1 19 13445 1 1 39 PHE CZ C -13.657 1.857 3.757 1.00 . A A . 39 PHE CZ 1 1 19 13446 1 1 39 PHE H H -10.363 4.453 0.709 1.00 . A A . 39 PHE H 1 1 19 13447 1 1 39 PHE HA H -9.867 2.348 0.979 1.00 . A A . 39 PHE HA 1 1 19 13448 1 1 39 PHE HB2 H -12.275 1.903 -0.753 1.00 . A A . 39 PHE HB2 1 1 19 13449 1 1 39 PHE HB3 H -11.332 0.554 -0.122 1.00 . A A . 39 PHE HB3 1 1 19 13450 1 1 39 PHE HD1 H -11.119 0.222 2.295 1.00 . A A . 39 PHE HD1 1 1 19 13451 1 1 39 PHE HD2 H -13.731 3.154 0.658 1.00 . A A . 39 PHE HD2 1 1 19 13452 1 1 39 PHE HE1 H -12.280 0.382 4.449 1.00 . A A . 39 PHE HE1 1 1 19 13453 1 1 39 PHE HE2 H -14.896 3.313 2.803 1.00 . A A . 39 PHE HE2 1 1 19 13454 1 1 39 PHE HZ H -14.170 1.930 4.703 1.00 . A A . 39 PHE HZ 1 1 19 13455 1 1 39 PHE N N -10.634 3.902 -0.059 1.00 . A A . 39 PHE N 1 1 19 13456 1 1 39 PHE O O -9.006 0.792 -1.015 1.00 . A A . 39 PHE O 1 1 19 13457 1 1 40 ARG C C -6.463 2.630 -1.816 1.00 . A A . 40 ARG C 1 1 19 13458 1 1 40 ARG CA C -7.741 2.544 -2.643 1.00 . A A . 40 ARG CA 1 1 19 13459 1 1 40 ARG CB C -7.689 3.499 -3.853 1.00 . A A . 40 ARG CB 1 1 19 13460 1 1 40 ARG CD C -6.829 1.821 -5.515 1.00 . A A . 40 ARG CD 1 1 19 13461 1 1 40 ARG CG C -6.603 3.162 -4.854 1.00 . A A . 40 ARG CG 1 1 19 13462 1 1 40 ARG CZ C -5.306 0.173 -6.543 1.00 . A A . 40 ARG CZ 1 1 19 13463 1 1 40 ARG H H -9.183 3.780 -1.750 1.00 . A A . 40 ARG H 1 1 19 13464 1 1 40 ARG HA H -7.884 1.527 -2.971 1.00 . A A . 40 ARG HA 1 1 19 13465 1 1 40 ARG HB2 H -8.631 3.464 -4.378 1.00 . A A . 40 ARG HB2 1 1 19 13466 1 1 40 ARG HB3 H -7.516 4.505 -3.501 1.00 . A A . 40 ARG HB3 1 1 19 13467 1 1 40 ARG HD2 H -6.984 1.070 -4.755 1.00 . A A . 40 ARG HD2 1 1 19 13468 1 1 40 ARG HD3 H -7.698 1.881 -6.153 1.00 . A A . 40 ARG HD3 1 1 19 13469 1 1 40 ARG HE H -5.153 2.184 -6.680 1.00 . A A . 40 ARG HE 1 1 19 13470 1 1 40 ARG HG2 H -6.547 3.926 -5.614 1.00 . A A . 40 ARG HG2 1 1 19 13471 1 1 40 ARG HG3 H -5.674 3.111 -4.307 1.00 . A A . 40 ARG HG3 1 1 19 13472 1 1 40 ARG HH11 H -7.010 -0.715 -5.769 1.00 . A A . 40 ARG HH11 1 1 19 13473 1 1 40 ARG HH12 H -5.822 -1.786 -6.348 1.00 . A A . 40 ARG HH12 1 1 19 13474 1 1 40 ARG HH21 H -3.536 0.640 -7.483 1.00 . A A . 40 ARG HH21 1 1 19 13475 1 1 40 ARG HH22 H -3.864 -1.028 -7.342 1.00 . A A . 40 ARG HH22 1 1 19 13476 1 1 40 ARG N N -8.814 2.874 -1.767 1.00 . A A . 40 ARG N 1 1 19 13477 1 1 40 ARG NE N -5.680 1.432 -6.321 1.00 . A A . 40 ARG NE 1 1 19 13478 1 1 40 ARG NH1 N -6.107 -0.835 -6.195 1.00 . A A . 40 ARG NH1 1 1 19 13479 1 1 40 ARG NH2 N -4.160 -0.085 -7.162 1.00 . A A . 40 ARG NH2 1 1 19 13480 1 1 40 ARG O O -6.369 3.463 -0.895 1.00 . A A . 40 ARG O 1 1 19 13481 1 1 41 CYS C C -3.349 2.833 -1.689 1.00 . A A . 41 CYS C 1 1 19 13482 1 1 41 CYS CA C -4.315 1.741 -1.331 1.00 . A A . 41 CYS CA 1 1 19 13483 1 1 41 CYS CB C -3.650 0.383 -1.416 1.00 . A A . 41 CYS CB 1 1 19 13484 1 1 41 CYS H H -5.632 1.146 -2.833 1.00 . A A . 41 CYS H 1 1 19 13485 1 1 41 CYS HA H -4.602 1.892 -0.301 1.00 . A A . 41 CYS HA 1 1 19 13486 1 1 41 CYS HB2 H -3.596 0.079 -2.450 1.00 . A A . 41 CYS HB2 1 1 19 13487 1 1 41 CYS HB3 H -2.651 0.447 -1.009 1.00 . A A . 41 CYS HB3 1 1 19 13488 1 1 41 CYS N N -5.528 1.779 -2.092 1.00 . A A . 41 CYS N 1 1 19 13489 1 1 41 CYS O O -2.857 2.914 -2.821 1.00 . A A . 41 CYS O 1 1 19 13490 1 1 41 CYS SG S -4.536 -0.904 -0.509 1.00 . A A . 41 CYS SG 1 1 19 13491 1 1 42 TRP C C -0.986 4.159 0.029 1.00 . A A . 42 TRP C 1 1 19 13492 1 1 42 TRP CA C -2.107 4.687 -0.808 1.00 . A A . 42 TRP CA 1 1 19 13493 1 1 42 TRP CB C -2.557 6.031 -0.234 1.00 . A A . 42 TRP CB 1 1 19 13494 1 1 42 TRP CD1 C -2.318 8.063 -1.766 1.00 . A A . 42 TRP CD1 1 1 19 13495 1 1 42 TRP CD2 C -4.400 7.249 -1.689 1.00 . A A . 42 TRP CD2 1 1 19 13496 1 1 42 TRP CE2 C -4.389 8.381 -2.529 1.00 . A A . 42 TRP CE2 1 1 19 13497 1 1 42 TRP CE3 C -5.602 6.571 -1.503 1.00 . A A . 42 TRP CE3 1 1 19 13498 1 1 42 TRP CG C -3.058 7.068 -1.204 1.00 . A A . 42 TRP CG 1 1 19 13499 1 1 42 TRP CH2 C -6.694 8.159 -2.960 1.00 . A A . 42 TRP CH2 1 1 19 13500 1 1 42 TRP CZ2 C -5.534 8.847 -3.169 1.00 . A A . 42 TRP CZ2 1 1 19 13501 1 1 42 TRP CZ3 C -6.733 7.031 -2.140 1.00 . A A . 42 TRP CZ3 1 1 19 13502 1 1 42 TRP H H -3.648 3.627 0.092 1.00 . A A . 42 TRP H 1 1 19 13503 1 1 42 TRP HA H -1.793 4.781 -1.837 1.00 . A A . 42 TRP HA 1 1 19 13504 1 1 42 TRP HB2 H -3.363 5.841 0.456 1.00 . A A . 42 TRP HB2 1 1 19 13505 1 1 42 TRP HB3 H -1.735 6.458 0.321 1.00 . A A . 42 TRP HB3 1 1 19 13506 1 1 42 TRP HD1 H -1.259 8.192 -1.593 1.00 . A A . 42 TRP HD1 1 1 19 13507 1 1 42 TRP HE1 H -2.816 9.646 -3.064 1.00 . A A . 42 TRP HE1 1 1 19 13508 1 1 42 TRP HE3 H -5.654 5.690 -0.885 1.00 . A A . 42 TRP HE3 1 1 19 13509 1 1 42 TRP HH2 H -7.609 8.480 -3.436 1.00 . A A . 42 TRP HH2 1 1 19 13510 1 1 42 TRP HZ2 H -5.524 9.718 -3.807 1.00 . A A . 42 TRP HZ2 1 1 19 13511 1 1 42 TRP HZ3 H -7.670 6.516 -2.001 1.00 . A A . 42 TRP HZ3 1 1 19 13512 1 1 42 TRP N N -3.129 3.691 -0.739 1.00 . A A . 42 TRP N 1 1 19 13513 1 1 42 TRP NE1 N -3.115 8.862 -2.552 1.00 . A A . 42 TRP NE1 1 1 19 13514 1 1 42 TRP O O -1.058 4.157 1.260 1.00 . A A . 42 TRP O 1 1 19 13515 1 1 43 CYS C C 2.248 4.002 0.113 1.00 . A A . 43 CYS C 1 1 19 13516 1 1 43 CYS CA C 1.067 3.061 0.084 1.00 . A A . 43 CYS CA 1 1 19 13517 1 1 43 CYS CB C 1.388 1.711 -0.561 1.00 . A A . 43 CYS CB 1 1 19 13518 1 1 43 CYS H H 0.032 3.735 -1.582 1.00 . A A . 43 CYS H 1 1 19 13519 1 1 43 CYS HA H 0.740 2.883 1.099 1.00 . A A . 43 CYS HA 1 1 19 13520 1 1 43 CYS HB2 H 1.661 1.865 -1.595 1.00 . A A . 43 CYS HB2 1 1 19 13521 1 1 43 CYS HB3 H 2.207 1.246 -0.032 1.00 . A A . 43 CYS HB3 1 1 19 13522 1 1 43 CYS N N -0.006 3.664 -0.602 1.00 . A A . 43 CYS N 1 1 19 13523 1 1 43 CYS O O 2.526 4.709 -0.869 1.00 . A A . 43 CYS O 1 1 19 13524 1 1 43 CYS SG S -0.042 0.560 -0.508 1.00 . A A . 43 CYS SG 1 1 19 13525 1 1 44 THR C C 5.223 4.241 0.754 1.00 . A A . 44 THR C 1 1 19 13526 1 1 44 THR CA C 4.028 4.908 1.415 1.00 . A A . 44 THR CA 1 1 19 13527 1 1 44 THR CB C 4.308 5.095 2.920 1.00 . A A . 44 THR CB 1 1 19 13528 1 1 44 THR CG2 C 5.345 6.189 3.147 1.00 . A A . 44 THR CG2 1 1 19 13529 1 1 44 THR H H 2.650 3.463 1.980 1.00 . A A . 44 THR H 1 1 19 13530 1 1 44 THR HA H 3.829 5.868 0.964 1.00 . A A . 44 THR HA 1 1 19 13531 1 1 44 THR HB H 4.682 4.163 3.320 1.00 . A A . 44 THR HB 1 1 19 13532 1 1 44 THR HG1 H 2.481 5.929 3.029 1.00 . A A . 44 THR HG1 1 1 19 13533 1 1 44 THR HG21 H 6.267 5.919 2.654 1.00 . A A . 44 THR HG21 1 1 19 13534 1 1 44 THR HG22 H 5.524 6.302 4.206 1.00 . A A . 44 THR HG22 1 1 19 13535 1 1 44 THR HG23 H 4.978 7.121 2.741 1.00 . A A . 44 THR HG23 1 1 19 13536 1 1 44 THR N N 2.907 4.051 1.236 1.00 . A A . 44 THR N 1 1 19 13537 1 1 44 THR O O 5.661 3.173 1.182 1.00 . A A . 44 THR O 1 1 19 13538 1 1 44 THR OG1 O 3.084 5.447 3.610 1.00 . A A . 44 THR OG1 1 1 19 13539 1 1 45 LYS C C 8.021 5.097 -0.916 1.00 . A A . 45 LYS C 1 1 19 13540 1 1 45 LYS CA C 6.784 4.250 -1.036 1.00 . A A . 45 LYS CA 1 1 19 13541 1 1 45 LYS CB C 6.371 4.024 -2.493 1.00 . A A . 45 LYS CB 1 1 19 13542 1 1 45 LYS CD C 5.233 4.891 -4.565 1.00 . A A . 45 LYS CD 1 1 19 13543 1 1 45 LYS CE C 6.262 4.306 -5.519 1.00 . A A . 45 LYS CE 1 1 19 13544 1 1 45 LYS CG C 5.828 5.245 -3.210 1.00 . A A . 45 LYS CG 1 1 19 13545 1 1 45 LYS H H 5.340 5.687 -0.604 1.00 . A A . 45 LYS H 1 1 19 13546 1 1 45 LYS HA H 6.997 3.289 -0.592 1.00 . A A . 45 LYS HA 1 1 19 13547 1 1 45 LYS HB2 H 7.237 3.688 -3.042 1.00 . A A . 45 LYS HB2 1 1 19 13548 1 1 45 LYS HB3 H 5.609 3.259 -2.513 1.00 . A A . 45 LYS HB3 1 1 19 13549 1 1 45 LYS HD2 H 4.443 4.167 -4.423 1.00 . A A . 45 LYS HD2 1 1 19 13550 1 1 45 LYS HD3 H 4.820 5.789 -4.998 1.00 . A A . 45 LYS HD3 1 1 19 13551 1 1 45 LYS HE2 H 7.047 5.031 -5.677 1.00 . A A . 45 LYS HE2 1 1 19 13552 1 1 45 LYS HE3 H 6.681 3.413 -5.079 1.00 . A A . 45 LYS HE3 1 1 19 13553 1 1 45 LYS HG2 H 5.059 5.694 -2.599 1.00 . A A . 45 LYS HG2 1 1 19 13554 1 1 45 LYS HG3 H 6.631 5.953 -3.351 1.00 . A A . 45 LYS HG3 1 1 19 13555 1 1 45 LYS HZ1 H 4.911 3.249 -6.709 1.00 . A A . 45 LYS HZ1 1 1 19 13556 1 1 45 LYS HZ2 H 6.364 3.549 -7.460 1.00 . A A . 45 LYS HZ2 1 1 19 13557 1 1 45 LYS HZ3 H 5.241 4.795 -7.279 1.00 . A A . 45 LYS HZ3 1 1 19 13558 1 1 45 LYS N N 5.704 4.823 -0.300 1.00 . A A . 45 LYS N 1 1 19 13559 1 1 45 LYS NZ N 5.661 3.963 -6.818 1.00 . A A . 45 LYS NZ 1 1 19 13560 1 1 45 LYS O O 7.943 6.275 -0.552 1.00 . A A . 45 LYS O 1 1 19 13561 1 1 46 ASN C C 10.623 5.928 -2.391 1.00 . A A . 46 ASN C 1 1 19 13562 1 1 46 ASN CA C 10.398 5.211 -1.097 1.00 . A A . 46 ASN CA 1 1 19 13563 1 1 46 ASN CB C 11.572 4.287 -0.747 1.00 . A A . 46 ASN CB 1 1 19 13564 1 1 46 ASN CG C 11.410 3.638 0.621 1.00 . A A . 46 ASN CG 1 1 19 13565 1 1 46 ASN H H 9.159 3.559 -1.445 1.00 . A A . 46 ASN H 1 1 19 13566 1 1 46 ASN HA H 10.287 5.957 -0.322 1.00 . A A . 46 ASN HA 1 1 19 13567 1 1 46 ASN HB2 H 11.649 3.509 -1.491 1.00 . A A . 46 ASN HB2 1 1 19 13568 1 1 46 ASN HB3 H 12.484 4.865 -0.745 1.00 . A A . 46 ASN HB3 1 1 19 13569 1 1 46 ASN HD21 H 10.583 2.044 -0.197 1.00 . A A . 46 ASN HD21 1 1 19 13570 1 1 46 ASN HD22 H 10.765 1.974 1.515 1.00 . A A . 46 ASN HD22 1 1 19 13571 1 1 46 ASN N N 9.152 4.501 -1.173 1.00 . A A . 46 ASN N 1 1 19 13572 1 1 46 ASN ND2 N 10.858 2.444 0.658 1.00 . A A . 46 ASN ND2 1 1 19 13573 1 1 46 ASN O O 10.644 5.318 -3.470 1.00 . A A . 46 ASN O 1 1 19 13574 1 1 46 ASN OD1 O 11.796 4.209 1.639 1.00 . A A . 46 ASN OD1 1 1 19 13575 1 1 47 CYS C C 12.101 8.876 -3.287 1.00 . A A . 47 CYS C 1 1 19 13576 1 1 47 CYS CA C 10.853 8.039 -3.438 1.00 . A A . 47 CYS CA 1 1 19 13577 1 1 47 CYS CB C 9.574 8.904 -3.527 1.00 . A A . 47 CYS CB 1 1 19 13578 1 1 47 CYS H H 10.840 7.613 -1.410 1.00 . A A . 47 CYS H 1 1 19 13579 1 1 47 CYS HA H 10.929 7.422 -4.320 1.00 . A A . 47 CYS HA 1 1 19 13580 1 1 47 CYS HB2 H 9.580 9.634 -2.731 1.00 . A A . 47 CYS HB2 1 1 19 13581 1 1 47 CYS HB3 H 9.542 9.407 -4.482 1.00 . A A . 47 CYS HB3 1 1 19 13582 1 1 47 CYS N N 10.755 7.199 -2.297 1.00 . A A . 47 CYS N 1 1 19 13583 1 1 47 CYS O O 13.191 8.382 -3.639 1.00 . A A . 47 CYS O 1 1 19 13584 1 1 47 CYS OXT O 12.031 9.992 -2.768 1.00 . A A . 47 CYS OXT 1 1 19 13585 1 1 47 CYS SG S 8.043 7.898 -3.366 1.00 . A A . 47 CYS SG 1 1 20 13586 1 1 1 LYS C C 10.170 10.409 1.860 1.00 . A A . 1 LYS C 1 1 20 13587 1 1 1 LYS CA C 10.904 11.581 2.461 1.00 . A A . 1 LYS CA 1 1 20 13588 1 1 1 LYS CB C 9.905 12.711 2.763 1.00 . A A . 1 LYS CB 1 1 20 13589 1 1 1 LYS CD C 9.389 14.888 3.849 1.00 . A A . 1 LYS CD 1 1 20 13590 1 1 1 LYS CE C 9.911 16.029 4.705 1.00 . A A . 1 LYS CE 1 1 20 13591 1 1 1 LYS CG C 10.451 13.830 3.602 1.00 . A A . 1 LYS CG 1 1 20 13592 1 1 1 LYS H1 H 12.602 11.234 1.382 1.00 . A A . 1 LYS H1 1 1 20 13593 1 1 1 LYS H2 H 12.480 12.848 1.909 1.00 . A A . 1 LYS H2 1 1 20 13594 1 1 1 LYS H3 H 11.516 12.272 0.638 1.00 . A A . 1 LYS H3 1 1 20 13595 1 1 1 LYS HA H 11.368 11.261 3.383 1.00 . A A . 1 LYS HA 1 1 20 13596 1 1 1 LYS HB2 H 9.575 13.139 1.829 1.00 . A A . 1 LYS HB2 1 1 20 13597 1 1 1 LYS HB3 H 9.044 12.306 3.271 1.00 . A A . 1 LYS HB3 1 1 20 13598 1 1 1 LYS HD2 H 9.062 15.287 2.901 1.00 . A A . 1 LYS HD2 1 1 20 13599 1 1 1 LYS HD3 H 8.550 14.428 4.348 1.00 . A A . 1 LYS HD3 1 1 20 13600 1 1 1 LYS HE2 H 10.749 16.488 4.203 1.00 . A A . 1 LYS HE2 1 1 20 13601 1 1 1 LYS HE3 H 9.126 16.761 4.827 1.00 . A A . 1 LYS HE3 1 1 20 13602 1 1 1 LYS HG2 H 10.789 13.429 4.546 1.00 . A A . 1 LYS HG2 1 1 20 13603 1 1 1 LYS HG3 H 11.281 14.265 3.071 1.00 . A A . 1 LYS HG3 1 1 20 13604 1 1 1 LYS HZ1 H 11.161 14.921 5.970 1.00 . A A . 1 LYS HZ1 1 1 20 13605 1 1 1 LYS HZ2 H 9.580 15.054 6.516 1.00 . A A . 1 LYS HZ2 1 1 20 13606 1 1 1 LYS HZ3 H 10.613 16.364 6.649 1.00 . A A . 1 LYS HZ3 1 1 20 13607 1 1 1 LYS N N 11.953 12.028 1.548 1.00 . A A . 1 LYS N 1 1 20 13608 1 1 1 LYS NZ N 10.349 15.567 6.036 1.00 . A A . 1 LYS NZ 1 1 20 13609 1 1 1 LYS O O 10.635 9.796 0.895 1.00 . A A . 1 LYS O 1 1 20 13610 1 1 2 THR C C 7.195 9.554 0.981 1.00 . A A . 2 THR C 1 1 20 13611 1 1 2 THR CA C 8.229 9.028 1.964 1.00 . A A . 2 THR CA 1 1 20 13612 1 1 2 THR CB C 7.539 8.343 3.137 1.00 . A A . 2 THR CB 1 1 20 13613 1 1 2 THR CG2 C 8.493 7.420 3.838 1.00 . A A . 2 THR CG2 1 1 20 13614 1 1 2 THR H H 8.764 10.553 3.251 1.00 . A A . 2 THR H 1 1 20 13615 1 1 2 THR HA H 8.854 8.300 1.468 1.00 . A A . 2 THR HA 1 1 20 13616 1 1 2 THR HB H 6.701 7.773 2.762 1.00 . A A . 2 THR HB 1 1 20 13617 1 1 2 THR HG1 H 6.788 8.889 4.870 1.00 . A A . 2 THR HG1 1 1 20 13618 1 1 2 THR HG21 H 8.835 6.666 3.144 1.00 . A A . 2 THR HG21 1 1 20 13619 1 1 2 THR HG22 H 7.993 6.946 4.671 1.00 . A A . 2 THR HG22 1 1 20 13620 1 1 2 THR HG23 H 9.340 7.984 4.197 1.00 . A A . 2 THR HG23 1 1 20 13621 1 1 2 THR N N 9.060 10.079 2.444 1.00 . A A . 2 THR N 1 1 20 13622 1 1 2 THR O O 6.719 10.693 1.106 1.00 . A A . 2 THR O 1 1 20 13623 1 1 2 THR OG1 O 7.058 9.338 4.060 1.00 . A A . 2 THR OG1 1 1 20 13624 1 1 3 CYS C C 4.757 8.099 -0.881 1.00 . A A . 3 CYS C 1 1 20 13625 1 1 3 CYS CA C 5.891 9.094 -0.978 1.00 . A A . 3 CYS CA 1 1 20 13626 1 1 3 CYS CB C 6.499 9.047 -2.380 1.00 . A A . 3 CYS CB 1 1 20 13627 1 1 3 CYS H H 7.338 7.886 -0.060 1.00 . A A . 3 CYS H 1 1 20 13628 1 1 3 CYS HA H 5.530 10.091 -0.775 1.00 . A A . 3 CYS HA 1 1 20 13629 1 1 3 CYS HB2 H 6.789 8.031 -2.602 1.00 . A A . 3 CYS HB2 1 1 20 13630 1 1 3 CYS HB3 H 5.762 9.371 -3.099 1.00 . A A . 3 CYS HB3 1 1 20 13631 1 1 3 CYS N N 6.879 8.755 0.007 1.00 . A A . 3 CYS N 1 1 20 13632 1 1 3 CYS O O 4.974 6.883 -1.030 1.00 . A A . 3 CYS O 1 1 20 13633 1 1 3 CYS SG S 7.982 10.083 -2.598 1.00 . A A . 3 CYS SG 1 1 20 13634 1 1 4 GLU C C 1.590 7.898 -1.736 1.00 . A A . 4 GLU C 1 1 20 13635 1 1 4 GLU CA C 2.422 7.742 -0.469 1.00 . A A . 4 GLU CA 1 1 20 13636 1 1 4 GLU CB C 1.626 8.125 0.780 1.00 . A A . 4 GLU CB 1 1 20 13637 1 1 4 GLU CD C -0.238 7.596 2.366 1.00 . A A . 4 GLU CD 1 1 20 13638 1 1 4 GLU CG C 0.493 7.184 1.118 1.00 . A A . 4 GLU CG 1 1 20 13639 1 1 4 GLU H H 3.476 9.547 -0.439 1.00 . A A . 4 GLU H 1 1 20 13640 1 1 4 GLU HA H 2.752 6.717 -0.391 1.00 . A A . 4 GLU HA 1 1 20 13641 1 1 4 GLU HB2 H 2.301 8.148 1.624 1.00 . A A . 4 GLU HB2 1 1 20 13642 1 1 4 GLU HB3 H 1.216 9.114 0.638 1.00 . A A . 4 GLU HB3 1 1 20 13643 1 1 4 GLU HG2 H -0.204 7.195 0.294 1.00 . A A . 4 GLU HG2 1 1 20 13644 1 1 4 GLU HG3 H 0.885 6.186 1.250 1.00 . A A . 4 GLU HG3 1 1 20 13645 1 1 4 GLU N N 3.582 8.583 -0.581 1.00 . A A . 4 GLU N 1 1 20 13646 1 1 4 GLU O O 1.008 8.953 -1.987 1.00 . A A . 4 GLU O 1 1 20 13647 1 1 4 GLU OE1 O -1.355 8.128 2.266 1.00 . A A . 4 GLU OE1 1 1 20 13648 1 1 4 GLU OE2 O 0.308 7.410 3.479 1.00 . A A . 4 GLU OE2 1 1 20 13649 1 1 5 ASN C C 0.142 5.605 -4.027 1.00 . A A . 5 ASN C 1 1 20 13650 1 1 5 ASN CA C 0.893 6.894 -3.823 1.00 . A A . 5 ASN CA 1 1 20 13651 1 1 5 ASN CB C 1.900 7.134 -4.968 1.00 . A A . 5 ASN CB 1 1 20 13652 1 1 5 ASN CG C 2.964 6.053 -5.095 1.00 . A A . 5 ASN CG 1 1 20 13653 1 1 5 ASN H H 1.990 6.031 -2.244 1.00 . A A . 5 ASN H 1 1 20 13654 1 1 5 ASN HA H 0.170 7.696 -3.818 1.00 . A A . 5 ASN HA 1 1 20 13655 1 1 5 ASN HB2 H 1.363 7.180 -5.903 1.00 . A A . 5 ASN HB2 1 1 20 13656 1 1 5 ASN HB3 H 2.394 8.079 -4.800 1.00 . A A . 5 ASN HB3 1 1 20 13657 1 1 5 ASN HD21 H 1.916 5.128 -6.489 1.00 . A A . 5 ASN HD21 1 1 20 13658 1 1 5 ASN HD22 H 3.415 4.394 -6.069 1.00 . A A . 5 ASN HD22 1 1 20 13659 1 1 5 ASN N N 1.565 6.871 -2.535 1.00 . A A . 5 ASN N 1 1 20 13660 1 1 5 ASN ND2 N 2.744 5.102 -5.965 1.00 . A A . 5 ASN ND2 1 1 20 13661 1 1 5 ASN O O 0.318 4.669 -3.276 1.00 . A A . 5 ASN O 1 1 20 13662 1 1 5 ASN OD1 O 4.011 6.108 -4.438 1.00 . A A . 5 ASN OD1 1 1 20 13663 1 1 6 LEU C C -0.801 3.132 -5.638 1.00 . A A . 6 LEU C 1 1 20 13664 1 1 6 LEU CA C -1.533 4.407 -5.271 1.00 . A A . 6 LEU CA 1 1 20 13665 1 1 6 LEU CB C -2.582 4.719 -6.319 1.00 . A A . 6 LEU CB 1 1 20 13666 1 1 6 LEU CD1 C -4.602 5.955 -7.040 1.00 . A A . 6 LEU CD1 1 1 20 13667 1 1 6 LEU CD2 C -4.368 5.273 -4.710 1.00 . A A . 6 LEU CD2 1 1 20 13668 1 1 6 LEU CG C -3.628 5.743 -5.922 1.00 . A A . 6 LEU CG 1 1 20 13669 1 1 6 LEU H H -0.700 6.301 -5.673 1.00 . A A . 6 LEU H 1 1 20 13670 1 1 6 LEU HA H -2.053 4.216 -4.346 1.00 . A A . 6 LEU HA 1 1 20 13671 1 1 6 LEU HB2 H -2.062 5.098 -7.186 1.00 . A A . 6 LEU HB2 1 1 20 13672 1 1 6 LEU HB3 H -3.085 3.802 -6.585 1.00 . A A . 6 LEU HB3 1 1 20 13673 1 1 6 LEU HD11 H -4.093 6.271 -7.936 1.00 . A A . 6 LEU HD11 1 1 20 13674 1 1 6 LEU HD12 H -5.295 6.714 -6.709 1.00 . A A . 6 LEU HD12 1 1 20 13675 1 1 6 LEU HD13 H -5.139 5.033 -7.205 1.00 . A A . 6 LEU HD13 1 1 20 13676 1 1 6 LEU HD21 H -4.785 4.299 -4.908 1.00 . A A . 6 LEU HD21 1 1 20 13677 1 1 6 LEU HD22 H -5.169 5.967 -4.498 1.00 . A A . 6 LEU HD22 1 1 20 13678 1 1 6 LEU HD23 H -3.709 5.224 -3.856 1.00 . A A . 6 LEU HD23 1 1 20 13679 1 1 6 LEU HG H -3.151 6.682 -5.680 1.00 . A A . 6 LEU HG 1 1 20 13680 1 1 6 LEU N N -0.672 5.552 -5.039 1.00 . A A . 6 LEU N 1 1 20 13681 1 1 6 LEU O O 0.272 3.155 -6.267 1.00 . A A . 6 LEU O 1 1 20 13682 1 1 7 ALA C C -1.309 0.375 -6.954 1.00 . A A . 7 ALA C 1 1 20 13683 1 1 7 ALA CA C -0.908 0.713 -5.530 1.00 . A A . 7 ALA CA 1 1 20 13684 1 1 7 ALA CB C -1.505 -0.294 -4.572 1.00 . A A . 7 ALA CB 1 1 20 13685 1 1 7 ALA H H -2.167 2.130 -4.627 1.00 . A A . 7 ALA H 1 1 20 13686 1 1 7 ALA HA H 0.168 0.692 -5.437 1.00 . A A . 7 ALA HA 1 1 20 13687 1 1 7 ALA HB1 H -1.147 -1.283 -4.816 1.00 . A A . 7 ALA HB1 1 1 20 13688 1 1 7 ALA HB2 H -2.582 -0.268 -4.651 1.00 . A A . 7 ALA HB2 1 1 20 13689 1 1 7 ALA HB3 H -1.215 -0.045 -3.561 1.00 . A A . 7 ALA HB3 1 1 20 13690 1 1 7 ALA N N -1.380 2.035 -5.207 1.00 . A A . 7 ALA N 1 1 20 13691 1 1 7 ALA O O -2.440 0.669 -7.373 1.00 . A A . 7 ALA O 1 1 20 13692 1 1 8 ASP C C -1.226 -1.943 -9.264 1.00 . A A . 8 ASP C 1 1 20 13693 1 1 8 ASP CA C -0.644 -0.550 -9.076 1.00 . A A . 8 ASP CA 1 1 20 13694 1 1 8 ASP CB C 0.645 -0.418 -9.891 1.00 . A A . 8 ASP CB 1 1 20 13695 1 1 8 ASP CG C 0.455 -0.828 -11.338 1.00 . A A . 8 ASP CG 1 1 20 13696 1 1 8 ASP H H 0.454 -0.459 -7.268 1.00 . A A . 8 ASP H 1 1 20 13697 1 1 8 ASP HA H -1.353 0.168 -9.460 1.00 . A A . 8 ASP HA 1 1 20 13698 1 1 8 ASP HB2 H 0.977 0.609 -9.867 1.00 . A A . 8 ASP HB2 1 1 20 13699 1 1 8 ASP HB3 H 1.406 -1.047 -9.452 1.00 . A A . 8 ASP HB3 1 1 20 13700 1 1 8 ASP N N -0.412 -0.225 -7.682 1.00 . A A . 8 ASP N 1 1 20 13701 1 1 8 ASP O O -2.248 -2.109 -9.942 1.00 . A A . 8 ASP O 1 1 20 13702 1 1 8 ASP OD1 O 0.692 -2.001 -11.678 1.00 . A A . 8 ASP OD1 1 1 20 13703 1 1 8 ASP OD2 O 0.062 0.017 -12.161 1.00 . A A . 8 ASP OD2 1 1 20 13704 1 1 9 THR C C -2.144 -4.749 -7.914 1.00 . A A . 9 THR C 1 1 20 13705 1 1 9 THR CA C -1.063 -4.296 -8.913 1.00 . A A . 9 THR CA 1 1 20 13706 1 1 9 THR CB C 0.131 -5.308 -8.996 1.00 . A A . 9 THR CB 1 1 20 13707 1 1 9 THR CG2 C 0.778 -5.522 -7.643 1.00 . A A . 9 THR CG2 1 1 20 13708 1 1 9 THR H H 0.131 -2.782 -8.039 1.00 . A A . 9 THR H 1 1 20 13709 1 1 9 THR HA H -1.540 -4.261 -9.881 1.00 . A A . 9 THR HA 1 1 20 13710 1 1 9 THR HB H 0.867 -4.903 -9.678 1.00 . A A . 9 THR HB 1 1 20 13711 1 1 9 THR HG1 H -0.718 -6.409 -10.368 1.00 . A A . 9 THR HG1 1 1 20 13712 1 1 9 THR HG21 H 0.045 -5.924 -6.961 1.00 . A A . 9 THR HG21 1 1 20 13713 1 1 9 THR HG22 H 1.138 -4.576 -7.268 1.00 . A A . 9 THR HG22 1 1 20 13714 1 1 9 THR HG23 H 1.603 -6.214 -7.742 1.00 . A A . 9 THR HG23 1 1 20 13715 1 1 9 THR N N -0.623 -2.944 -8.659 1.00 . A A . 9 THR N 1 1 20 13716 1 1 9 THR O O -2.713 -5.847 -8.045 1.00 . A A . 9 THR O 1 1 20 13717 1 1 9 THR OG1 O -0.312 -6.578 -9.507 1.00 . A A . 9 THR OG1 1 1 20 13718 1 1 10 TYR C C -4.853 -4.153 -6.645 1.00 . A A . 10 TYR C 1 1 20 13719 1 1 10 TYR CA C -3.493 -4.215 -5.982 1.00 . A A . 10 TYR CA 1 1 20 13720 1 1 10 TYR CB C -3.439 -3.252 -4.785 1.00 . A A . 10 TYR CB 1 1 20 13721 1 1 10 TYR CD1 C -4.053 -4.505 -2.674 1.00 . A A . 10 TYR CD1 1 1 20 13722 1 1 10 TYR CD2 C -5.652 -3.002 -3.579 1.00 . A A . 10 TYR CD2 1 1 20 13723 1 1 10 TYR CE1 C -4.917 -4.819 -1.647 1.00 . A A . 10 TYR CE1 1 1 20 13724 1 1 10 TYR CE2 C -6.519 -3.311 -2.559 1.00 . A A . 10 TYR CE2 1 1 20 13725 1 1 10 TYR CG C -4.403 -3.594 -3.658 1.00 . A A . 10 TYR CG 1 1 20 13726 1 1 10 TYR CZ C -6.150 -4.218 -1.598 1.00 . A A . 10 TYR CZ 1 1 20 13727 1 1 10 TYR H H -1.986 -3.044 -6.921 1.00 . A A . 10 TYR H 1 1 20 13728 1 1 10 TYR HA H -3.319 -5.223 -5.637 1.00 . A A . 10 TYR HA 1 1 20 13729 1 1 10 TYR HB2 H -2.440 -3.259 -4.374 1.00 . A A . 10 TYR HB2 1 1 20 13730 1 1 10 TYR HB3 H -3.668 -2.254 -5.130 1.00 . A A . 10 TYR HB3 1 1 20 13731 1 1 10 TYR HD1 H -3.082 -4.976 -2.721 1.00 . A A . 10 TYR HD1 1 1 20 13732 1 1 10 TYR HD2 H -5.949 -2.289 -4.334 1.00 . A A . 10 TYR HD2 1 1 20 13733 1 1 10 TYR HE1 H -4.616 -5.530 -0.892 1.00 . A A . 10 TYR HE1 1 1 20 13734 1 1 10 TYR HE2 H -7.488 -2.834 -2.528 1.00 . A A . 10 TYR HE2 1 1 20 13735 1 1 10 TYR HH H -7.916 -4.539 -0.941 1.00 . A A . 10 TYR HH 1 1 20 13736 1 1 10 TYR N N -2.464 -3.897 -6.960 1.00 . A A . 10 TYR N 1 1 20 13737 1 1 10 TYR O O -5.295 -3.084 -7.075 1.00 . A A . 10 TYR O 1 1 20 13738 1 1 10 TYR OH O -7.017 -4.521 -0.581 1.00 . A A . 10 TYR OH 1 1 20 13739 1 1 11 LYS C C -7.852 -5.404 -6.329 1.00 . A A . 11 LYS C 1 1 20 13740 1 1 11 LYS CA C -6.766 -5.351 -7.382 1.00 . A A . 11 LYS CA 1 1 20 13741 1 1 11 LYS CB C -6.851 -6.555 -8.305 1.00 . A A . 11 LYS CB 1 1 20 13742 1 1 11 LYS CD C -8.209 -7.841 -9.984 1.00 . A A . 11 LYS CD 1 1 20 13743 1 1 11 LYS CE C -7.175 -7.713 -11.084 1.00 . A A . 11 LYS CE 1 1 20 13744 1 1 11 LYS CG C -8.172 -6.665 -9.030 1.00 . A A . 11 LYS CG 1 1 20 13745 1 1 11 LYS H H -5.090 -6.116 -6.436 1.00 . A A . 11 LYS H 1 1 20 13746 1 1 11 LYS HA H -6.890 -4.456 -7.973 1.00 . A A . 11 LYS HA 1 1 20 13747 1 1 11 LYS HB2 H -6.062 -6.486 -9.037 1.00 . A A . 11 LYS HB2 1 1 20 13748 1 1 11 LYS HB3 H -6.707 -7.451 -7.721 1.00 . A A . 11 LYS HB3 1 1 20 13749 1 1 11 LYS HD2 H -8.019 -8.750 -9.434 1.00 . A A . 11 LYS HD2 1 1 20 13750 1 1 11 LYS HD3 H -9.190 -7.887 -10.430 1.00 . A A . 11 LYS HD3 1 1 20 13751 1 1 11 LYS HE2 H -7.236 -6.723 -11.510 1.00 . A A . 11 LYS HE2 1 1 20 13752 1 1 11 LYS HE3 H -6.198 -7.837 -10.642 1.00 . A A . 11 LYS HE3 1 1 20 13753 1 1 11 LYS HG2 H -8.953 -6.785 -8.294 1.00 . A A . 11 LYS HG2 1 1 20 13754 1 1 11 LYS HG3 H -8.335 -5.752 -9.581 1.00 . A A . 11 LYS HG3 1 1 20 13755 1 1 11 LYS HZ1 H -7.219 -9.704 -11.753 1.00 . A A . 11 LYS HZ1 1 1 20 13756 1 1 11 LYS HZ2 H -6.695 -8.605 -12.913 1.00 . A A . 11 LYS HZ2 1 1 20 13757 1 1 11 LYS HZ3 H -8.323 -8.694 -12.515 1.00 . A A . 11 LYS HZ3 1 1 20 13758 1 1 11 LYS N N -5.487 -5.283 -6.769 1.00 . A A . 11 LYS N 1 1 20 13759 1 1 11 LYS NZ N -7.360 -8.743 -12.125 1.00 . A A . 11 LYS NZ 1 1 20 13760 1 1 11 LYS O O -7.817 -6.251 -5.413 1.00 . A A . 11 LYS O 1 1 20 13761 1 1 12 GLY C C -9.713 -3.337 -4.552 1.00 . A A . 12 GLY C 1 1 20 13762 1 1 12 GLY CA C -9.889 -4.439 -5.557 1.00 . A A . 12 GLY CA 1 1 20 13763 1 1 12 GLY H H -8.720 -3.841 -7.172 1.00 . A A . 12 GLY H 1 1 20 13764 1 1 12 GLY HA2 H -10.787 -4.258 -6.128 1.00 . A A . 12 GLY HA2 1 1 20 13765 1 1 12 GLY HA3 H -9.979 -5.379 -5.034 1.00 . A A . 12 GLY HA3 1 1 20 13766 1 1 12 GLY N N -8.785 -4.505 -6.454 1.00 . A A . 12 GLY N 1 1 20 13767 1 1 12 GLY O O -8.722 -2.594 -4.608 1.00 . A A . 12 GLY O 1 1 20 13768 1 1 13 PRO C C -9.919 -2.780 -1.348 1.00 . A A . 13 PRO C 1 1 20 13769 1 1 13 PRO CA C -10.563 -2.180 -2.596 1.00 . A A . 13 PRO CA 1 1 20 13770 1 1 13 PRO CB C -12.023 -1.794 -2.308 1.00 . A A . 13 PRO CB 1 1 20 13771 1 1 13 PRO CD C -11.963 -3.823 -3.616 1.00 . A A . 13 PRO CD 1 1 20 13772 1 1 13 PRO CG C -12.869 -2.728 -3.129 1.00 . A A . 13 PRO CG 1 1 20 13773 1 1 13 PRO HA H -10.006 -1.307 -2.903 1.00 . A A . 13 PRO HA 1 1 20 13774 1 1 13 PRO HB2 H -12.215 -1.916 -1.252 1.00 . A A . 13 PRO HB2 1 1 20 13775 1 1 13 PRO HB3 H -12.189 -0.764 -2.586 1.00 . A A . 13 PRO HB3 1 1 20 13776 1 1 13 PRO HD2 H -11.956 -4.647 -2.919 1.00 . A A . 13 PRO HD2 1 1 20 13777 1 1 13 PRO HD3 H -12.259 -4.154 -4.600 1.00 . A A . 13 PRO HD3 1 1 20 13778 1 1 13 PRO HG2 H -13.653 -3.143 -2.515 1.00 . A A . 13 PRO HG2 1 1 20 13779 1 1 13 PRO HG3 H -13.294 -2.191 -3.965 1.00 . A A . 13 PRO HG3 1 1 20 13780 1 1 13 PRO N N -10.669 -3.152 -3.653 1.00 . A A . 13 PRO N 1 1 20 13781 1 1 13 PRO O O -9.671 -4.009 -1.270 1.00 . A A . 13 PRO O 1 1 20 13782 1 1 14 CYS C C -10.137 -2.695 1.839 1.00 . A A . 14 CYS C 1 1 20 13783 1 1 14 CYS CA C -9.060 -2.334 0.850 1.00 . A A . 14 CYS CA 1 1 20 13784 1 1 14 CYS CB C -8.187 -1.220 1.433 1.00 . A A . 14 CYS CB 1 1 20 13785 1 1 14 CYS H H -9.813 -0.980 -0.545 1.00 . A A . 14 CYS H 1 1 20 13786 1 1 14 CYS HA H -8.436 -3.197 0.673 1.00 . A A . 14 CYS HA 1 1 20 13787 1 1 14 CYS HB2 H -7.311 -1.097 0.814 1.00 . A A . 14 CYS HB2 1 1 20 13788 1 1 14 CYS HB3 H -8.750 -0.298 1.439 1.00 . A A . 14 CYS HB3 1 1 20 13789 1 1 14 CYS N N -9.634 -1.938 -0.404 1.00 . A A . 14 CYS N 1 1 20 13790 1 1 14 CYS O O -11.017 -1.884 2.146 1.00 . A A . 14 CYS O 1 1 20 13791 1 1 14 CYS SG S -7.623 -1.543 3.145 1.00 . A A . 14 CYS SG 1 1 20 13792 1 1 15 PHE C C -10.159 -4.557 4.600 1.00 . A A . 15 PHE C 1 1 20 13793 1 1 15 PHE CA C -10.972 -4.371 3.326 1.00 . A A . 15 PHE CA 1 1 20 13794 1 1 15 PHE CB C -11.666 -5.676 2.918 1.00 . A A . 15 PHE CB 1 1 20 13795 1 1 15 PHE CD1 C -12.067 -6.082 0.469 1.00 . A A . 15 PHE CD1 1 1 20 13796 1 1 15 PHE CD2 C -13.721 -4.897 1.709 1.00 . A A . 15 PHE CD2 1 1 20 13797 1 1 15 PHE CE1 C -12.835 -5.960 -0.671 1.00 . A A . 15 PHE CE1 1 1 20 13798 1 1 15 PHE CE2 C -14.489 -4.773 0.573 1.00 . A A . 15 PHE CE2 1 1 20 13799 1 1 15 PHE CG C -12.502 -5.553 1.673 1.00 . A A . 15 PHE CG 1 1 20 13800 1 1 15 PHE CZ C -14.048 -5.305 -0.619 1.00 . A A . 15 PHE CZ 1 1 20 13801 1 1 15 PHE H H -9.436 -4.533 1.911 1.00 . A A . 15 PHE H 1 1 20 13802 1 1 15 PHE HA H -11.714 -3.603 3.492 1.00 . A A . 15 PHE HA 1 1 20 13803 1 1 15 PHE HB2 H -10.922 -6.439 2.744 1.00 . A A . 15 PHE HB2 1 1 20 13804 1 1 15 PHE HB3 H -12.316 -5.992 3.721 1.00 . A A . 15 PHE HB3 1 1 20 13805 1 1 15 PHE HD1 H -11.118 -6.597 0.425 1.00 . A A . 15 PHE HD1 1 1 20 13806 1 1 15 PHE HD2 H -14.072 -4.477 2.639 1.00 . A A . 15 PHE HD2 1 1 20 13807 1 1 15 PHE HE1 H -12.488 -6.378 -1.605 1.00 . A A . 15 PHE HE1 1 1 20 13808 1 1 15 PHE HE2 H -15.438 -4.258 0.621 1.00 . A A . 15 PHE HE2 1 1 20 13809 1 1 15 PHE HZ H -14.653 -5.208 -1.509 1.00 . A A . 15 PHE HZ 1 1 20 13810 1 1 15 PHE N N -10.093 -3.915 2.293 1.00 . A A . 15 PHE N 1 1 20 13811 1 1 15 PHE O O -10.564 -4.139 5.688 1.00 . A A . 15 PHE O 1 1 20 13812 1 1 16 THR C C -6.857 -4.501 5.318 1.00 . A A . 16 THR C 1 1 20 13813 1 1 16 THR CA C -8.108 -5.351 5.556 1.00 . A A . 16 THR CA 1 1 20 13814 1 1 16 THR CB C -7.703 -6.828 5.643 1.00 . A A . 16 THR CB 1 1 20 13815 1 1 16 THR CG2 C -7.007 -7.123 6.965 1.00 . A A . 16 THR CG2 1 1 20 13816 1 1 16 THR H H -8.707 -5.453 3.572 1.00 . A A . 16 THR H 1 1 20 13817 1 1 16 THR HA H -8.602 -5.055 6.469 1.00 . A A . 16 THR HA 1 1 20 13818 1 1 16 THR HB H -7.013 -7.019 4.835 1.00 . A A . 16 THR HB 1 1 20 13819 1 1 16 THR HG1 H -8.578 -8.476 5.107 1.00 . A A . 16 THR HG1 1 1 20 13820 1 1 16 THR HG21 H -6.124 -6.507 7.053 1.00 . A A . 16 THR HG21 1 1 20 13821 1 1 16 THR HG22 H -6.725 -8.165 7.000 1.00 . A A . 16 THR HG22 1 1 20 13822 1 1 16 THR HG23 H -7.680 -6.907 7.781 1.00 . A A . 16 THR HG23 1 1 20 13823 1 1 16 THR N N -9.000 -5.145 4.456 1.00 . A A . 16 THR N 1 1 20 13824 1 1 16 THR O O -6.065 -4.791 4.411 1.00 . A A . 16 THR O 1 1 20 13825 1 1 16 THR OG1 O -8.876 -7.662 5.535 1.00 . A A . 16 THR OG1 1 1 20 13826 1 1 17 THR C C -4.193 -3.237 6.045 1.00 . A A . 17 THR C 1 1 20 13827 1 1 17 THR CA C -5.572 -2.536 5.961 1.00 . A A . 17 THR CA 1 1 20 13828 1 1 17 THR CB C -5.688 -1.401 7.001 1.00 . A A . 17 THR CB 1 1 20 13829 1 1 17 THR CG2 C -4.600 -0.347 6.805 1.00 . A A . 17 THR CG2 1 1 20 13830 1 1 17 THR H H -7.311 -3.334 6.860 1.00 . A A . 17 THR H 1 1 20 13831 1 1 17 THR HA H -5.667 -2.104 4.975 1.00 . A A . 17 THR HA 1 1 20 13832 1 1 17 THR HB H -5.610 -1.829 7.989 1.00 . A A . 17 THR HB 1 1 20 13833 1 1 17 THR HG1 H -7.386 -1.117 6.048 1.00 . A A . 17 THR HG1 1 1 20 13834 1 1 17 THR HG21 H -4.697 0.092 5.823 1.00 . A A . 17 THR HG21 1 1 20 13835 1 1 17 THR HG22 H -3.630 -0.813 6.896 1.00 . A A . 17 THR HG22 1 1 20 13836 1 1 17 THR HG23 H -4.703 0.422 7.557 1.00 . A A . 17 THR HG23 1 1 20 13837 1 1 17 THR N N -6.678 -3.474 6.121 1.00 . A A . 17 THR N 1 1 20 13838 1 1 17 THR O O -3.278 -2.919 5.284 1.00 . A A . 17 THR O 1 1 20 13839 1 1 17 THR OG1 O -6.984 -0.779 6.858 1.00 . A A . 17 THR OG1 1 1 20 13840 1 1 18 GLY C C -2.531 -5.800 5.859 1.00 . A A . 18 GLY C 1 1 20 13841 1 1 18 GLY CA C -2.864 -4.966 7.072 1.00 . A A . 18 GLY CA 1 1 20 13842 1 1 18 GLY H H -4.864 -4.481 7.451 1.00 . A A . 18 GLY H 1 1 20 13843 1 1 18 GLY HA2 H -2.062 -4.266 7.255 1.00 . A A . 18 GLY HA2 1 1 20 13844 1 1 18 GLY HA3 H -2.971 -5.615 7.927 1.00 . A A . 18 GLY HA3 1 1 20 13845 1 1 18 GLY N N -4.093 -4.236 6.902 1.00 . A A . 18 GLY N 1 1 20 13846 1 1 18 GLY O O -1.360 -6.030 5.560 1.00 . A A . 18 GLY O 1 1 20 13847 1 1 19 SER C C -2.875 -6.062 2.835 1.00 . A A . 19 SER C 1 1 20 13848 1 1 19 SER CA C -3.372 -6.997 3.931 1.00 . A A . 19 SER CA 1 1 20 13849 1 1 19 SER CB C -4.690 -7.681 3.518 1.00 . A A . 19 SER CB 1 1 20 13850 1 1 19 SER H H -4.468 -5.991 5.416 1.00 . A A . 19 SER H 1 1 20 13851 1 1 19 SER HA H -2.618 -7.744 4.128 1.00 . A A . 19 SER HA 1 1 20 13852 1 1 19 SER HB2 H -5.061 -8.270 4.344 1.00 . A A . 19 SER HB2 1 1 20 13853 1 1 19 SER HB3 H -5.414 -6.921 3.269 1.00 . A A . 19 SER HB3 1 1 20 13854 1 1 19 SER HG H -4.113 -9.352 2.710 1.00 . A A . 19 SER HG 1 1 20 13855 1 1 19 SER N N -3.560 -6.223 5.136 1.00 . A A . 19 SER N 1 1 20 13856 1 1 19 SER O O -2.015 -6.428 2.030 1.00 . A A . 19 SER O 1 1 20 13857 1 1 19 SER OG O -4.514 -8.529 2.396 1.00 . A A . 19 SER OG 1 1 20 13858 1 1 20 CYS C C -1.524 -3.426 2.158 1.00 . A A . 20 CYS C 1 1 20 13859 1 1 20 CYS CA C -2.992 -3.805 1.922 1.00 . A A . 20 CYS CA 1 1 20 13860 1 1 20 CYS CB C -3.910 -2.594 2.095 1.00 . A A . 20 CYS CB 1 1 20 13861 1 1 20 CYS H H -4.088 -4.635 3.509 1.00 . A A . 20 CYS H 1 1 20 13862 1 1 20 CYS HA H -3.099 -4.190 0.919 1.00 . A A . 20 CYS HA 1 1 20 13863 1 1 20 CYS HB2 H -4.915 -2.875 1.812 1.00 . A A . 20 CYS HB2 1 1 20 13864 1 1 20 CYS HB3 H -3.910 -2.306 3.135 1.00 . A A . 20 CYS HB3 1 1 20 13865 1 1 20 CYS N N -3.392 -4.846 2.849 1.00 . A A . 20 CYS N 1 1 20 13866 1 1 20 CYS O O -0.722 -3.390 1.221 1.00 . A A . 20 CYS O 1 1 20 13867 1 1 20 CYS SG S -3.463 -1.144 1.114 1.00 . A A . 20 CYS SG 1 1 20 13868 1 1 21 ASP C C 1.160 -4.005 3.393 1.00 . A A . 21 ASP C 1 1 20 13869 1 1 21 ASP CA C 0.211 -2.884 3.808 1.00 . A A . 21 ASP CA 1 1 20 13870 1 1 21 ASP CB C 0.307 -2.615 5.322 1.00 . A A . 21 ASP CB 1 1 20 13871 1 1 21 ASP CG C 1.741 -2.402 5.803 1.00 . A A . 21 ASP CG 1 1 20 13872 1 1 21 ASP H H -1.850 -3.271 4.130 1.00 . A A . 21 ASP H 1 1 20 13873 1 1 21 ASP HA H 0.488 -1.989 3.271 1.00 . A A . 21 ASP HA 1 1 20 13874 1 1 21 ASP HB2 H -0.245 -1.708 5.522 1.00 . A A . 21 ASP HB2 1 1 20 13875 1 1 21 ASP HB3 H -0.155 -3.424 5.874 1.00 . A A . 21 ASP HB3 1 1 20 13876 1 1 21 ASP N N -1.166 -3.216 3.426 1.00 . A A . 21 ASP N 1 1 20 13877 1 1 21 ASP O O 2.237 -3.756 2.836 1.00 . A A . 21 ASP O 1 1 20 13878 1 1 21 ASP OD1 O 2.242 -1.249 5.790 1.00 . A A . 21 ASP OD1 1 1 20 13879 1 1 21 ASP OD2 O 2.380 -3.374 6.231 1.00 . A A . 21 ASP OD2 1 1 20 13880 1 1 22 ASP C C 1.662 -6.472 1.710 1.00 . A A . 22 ASP C 1 1 20 13881 1 1 22 ASP CA C 1.467 -6.438 3.220 1.00 . A A . 22 ASP CA 1 1 20 13882 1 1 22 ASP CB C 0.705 -7.688 3.646 1.00 . A A . 22 ASP CB 1 1 20 13883 1 1 22 ASP CG C 1.387 -8.978 3.239 1.00 . A A . 22 ASP CG 1 1 20 13884 1 1 22 ASP H H -0.136 -5.342 4.086 1.00 . A A . 22 ASP H 1 1 20 13885 1 1 22 ASP HA H 2.429 -6.429 3.710 1.00 . A A . 22 ASP HA 1 1 20 13886 1 1 22 ASP HB2 H 0.545 -7.677 4.712 1.00 . A A . 22 ASP HB2 1 1 20 13887 1 1 22 ASP HB3 H -0.256 -7.656 3.155 1.00 . A A . 22 ASP HB3 1 1 20 13888 1 1 22 ASP N N 0.721 -5.237 3.617 1.00 . A A . 22 ASP N 1 1 20 13889 1 1 22 ASP O O 2.759 -6.761 1.212 1.00 . A A . 22 ASP O 1 1 20 13890 1 1 22 ASP OD1 O 2.364 -9.391 3.904 1.00 . A A . 22 ASP OD1 1 1 20 13891 1 1 22 ASP OD2 O 0.934 -9.620 2.262 1.00 . A A . 22 ASP OD2 1 1 20 13892 1 1 23 HIS C C 1.593 -5.103 -0.968 1.00 . A A . 23 HIS C 1 1 20 13893 1 1 23 HIS CA C 0.609 -6.144 -0.457 1.00 . A A . 23 HIS CA 1 1 20 13894 1 1 23 HIS CB C -0.808 -5.874 -1.000 1.00 . A A . 23 HIS CB 1 1 20 13895 1 1 23 HIS CD2 C -0.573 -5.077 -3.452 1.00 . A A . 23 HIS CD2 1 1 20 13896 1 1 23 HIS CE1 C -1.459 -6.764 -4.465 1.00 . A A . 23 HIS CE1 1 1 20 13897 1 1 23 HIS CG C -0.934 -5.960 -2.493 1.00 . A A . 23 HIS CG 1 1 20 13898 1 1 23 HIS H H -0.225 -5.890 1.455 1.00 . A A . 23 HIS H 1 1 20 13899 1 1 23 HIS HA H 0.933 -7.118 -0.791 1.00 . A A . 23 HIS HA 1 1 20 13900 1 1 23 HIS HB2 H -1.493 -6.592 -0.573 1.00 . A A . 23 HIS HB2 1 1 20 13901 1 1 23 HIS HB3 H -1.111 -4.883 -0.696 1.00 . A A . 23 HIS HB3 1 1 20 13902 1 1 23 HIS HD1 H -1.852 -7.848 -2.747 1.00 . A A . 23 HIS HD1 1 1 20 13903 1 1 23 HIS HD2 H -0.101 -4.119 -3.282 1.00 . A A . 23 HIS HD2 1 1 20 13904 1 1 23 HIS HE1 H -1.827 -7.422 -5.238 1.00 . A A . 23 HIS HE1 1 1 20 13905 1 1 23 HIS N N 0.602 -6.147 0.991 1.00 . A A . 23 HIS N 1 1 20 13906 1 1 23 HIS ND1 N -1.497 -7.027 -3.157 1.00 . A A . 23 HIS ND1 1 1 20 13907 1 1 23 HIS NE2 N -0.906 -5.593 -4.692 1.00 . A A . 23 HIS NE2 1 1 20 13908 1 1 23 HIS O O 2.389 -5.381 -1.864 1.00 . A A . 23 HIS O 1 1 20 13909 1 1 24 CYS C C 3.927 -3.244 -0.592 1.00 . A A . 24 CYS C 1 1 20 13910 1 1 24 CYS CA C 2.453 -2.853 -0.755 1.00 . A A . 24 CYS CA 1 1 20 13911 1 1 24 CYS CB C 2.149 -1.575 0.026 1.00 . A A . 24 CYS CB 1 1 20 13912 1 1 24 CYS H H 0.877 -3.755 0.311 1.00 . A A . 24 CYS H 1 1 20 13913 1 1 24 CYS HA H 2.265 -2.662 -1.801 1.00 . A A . 24 CYS HA 1 1 20 13914 1 1 24 CYS HB2 H 2.203 -1.792 1.082 1.00 . A A . 24 CYS HB2 1 1 20 13915 1 1 24 CYS HB3 H 2.893 -0.831 -0.216 1.00 . A A . 24 CYS HB3 1 1 20 13916 1 1 24 CYS N N 1.556 -3.927 -0.381 1.00 . A A . 24 CYS N 1 1 20 13917 1 1 24 CYS O O 4.762 -2.850 -1.385 1.00 . A A . 24 CYS O 1 1 20 13918 1 1 24 CYS SG S 0.504 -0.852 -0.299 1.00 . A A . 24 CYS SG 1 1 20 13919 1 1 25 LYS C C 6.054 -5.583 -0.289 1.00 . A A . 25 LYS C 1 1 20 13920 1 1 25 LYS CA C 5.620 -4.450 0.639 1.00 . A A . 25 LYS CA 1 1 20 13921 1 1 25 LYS CB C 5.824 -4.873 2.086 1.00 . A A . 25 LYS CB 1 1 20 13922 1 1 25 LYS CD C 5.762 -4.251 4.492 1.00 . A A . 25 LYS CD 1 1 20 13923 1 1 25 LYS CE C 5.369 -3.181 5.481 1.00 . A A . 25 LYS CE 1 1 20 13924 1 1 25 LYS CG C 5.516 -3.785 3.080 1.00 . A A . 25 LYS CG 1 1 20 13925 1 1 25 LYS H H 3.528 -4.355 1.012 1.00 . A A . 25 LYS H 1 1 20 13926 1 1 25 LYS HA H 6.246 -3.591 0.445 1.00 . A A . 25 LYS HA 1 1 20 13927 1 1 25 LYS HB2 H 5.180 -5.715 2.293 1.00 . A A . 25 LYS HB2 1 1 20 13928 1 1 25 LYS HB3 H 6.850 -5.177 2.218 1.00 . A A . 25 LYS HB3 1 1 20 13929 1 1 25 LYS HD2 H 5.186 -5.145 4.677 1.00 . A A . 25 LYS HD2 1 1 20 13930 1 1 25 LYS HD3 H 6.814 -4.469 4.610 1.00 . A A . 25 LYS HD3 1 1 20 13931 1 1 25 LYS HE2 H 5.967 -2.301 5.297 1.00 . A A . 25 LYS HE2 1 1 20 13932 1 1 25 LYS HE3 H 4.328 -2.939 5.327 1.00 . A A . 25 LYS HE3 1 1 20 13933 1 1 25 LYS HG2 H 6.148 -2.933 2.878 1.00 . A A . 25 LYS HG2 1 1 20 13934 1 1 25 LYS HG3 H 4.479 -3.500 2.978 1.00 . A A . 25 LYS HG3 1 1 20 13935 1 1 25 LYS HZ1 H 5.221 -2.865 7.517 1.00 . A A . 25 LYS HZ1 1 1 20 13936 1 1 25 LYS HZ2 H 6.569 -3.765 7.075 1.00 . A A . 25 LYS HZ2 1 1 20 13937 1 1 25 LYS HZ3 H 5.029 -4.482 7.070 1.00 . A A . 25 LYS HZ3 1 1 20 13938 1 1 25 LYS N N 4.237 -4.045 0.407 1.00 . A A . 25 LYS N 1 1 20 13939 1 1 25 LYS NZ N 5.560 -3.610 6.875 1.00 . A A . 25 LYS NZ 1 1 20 13940 1 1 25 LYS O O 7.179 -5.598 -0.788 1.00 . A A . 25 LYS O 1 1 20 13941 1 1 26 ASN C C 5.271 -7.509 -2.795 1.00 . A A . 26 ASN C 1 1 20 13942 1 1 26 ASN CA C 5.527 -7.694 -1.323 1.00 . A A . 26 ASN CA 1 1 20 13943 1 1 26 ASN CB C 4.814 -8.959 -0.840 1.00 . A A . 26 ASN CB 1 1 20 13944 1 1 26 ASN CG C 5.209 -9.373 0.556 1.00 . A A . 26 ASN CG 1 1 20 13945 1 1 26 ASN H H 4.270 -6.417 -0.149 1.00 . A A . 26 ASN H 1 1 20 13946 1 1 26 ASN HA H 6.589 -7.845 -1.191 1.00 . A A . 26 ASN HA 1 1 20 13947 1 1 26 ASN HB2 H 3.752 -8.770 -0.847 1.00 . A A . 26 ASN HB2 1 1 20 13948 1 1 26 ASN HB3 H 5.033 -9.769 -1.519 1.00 . A A . 26 ASN HB3 1 1 20 13949 1 1 26 ASN HD21 H 3.685 -8.369 1.326 1.00 . A A . 26 ASN HD21 1 1 20 13950 1 1 26 ASN HD22 H 4.683 -9.185 2.456 1.00 . A A . 26 ASN HD22 1 1 20 13951 1 1 26 ASN N N 5.172 -6.519 -0.526 1.00 . A A . 26 ASN N 1 1 20 13952 1 1 26 ASN ND2 N 4.461 -8.938 1.535 1.00 . A A . 26 ASN ND2 1 1 20 13953 1 1 26 ASN O O 6.153 -7.726 -3.612 1.00 . A A . 26 ASN O 1 1 20 13954 1 1 26 ASN OD1 O 6.185 -10.104 0.750 1.00 . A A . 26 ASN OD1 1 1 20 13955 1 1 27 LYS C C 4.098 -5.691 -5.153 1.00 . A A . 27 LYS C 1 1 20 13956 1 1 27 LYS CA C 3.660 -7.003 -4.522 1.00 . A A . 27 LYS CA 1 1 20 13957 1 1 27 LYS CB C 2.148 -7.173 -4.632 1.00 . A A . 27 LYS CB 1 1 20 13958 1 1 27 LYS CD C 2.136 -9.694 -4.790 1.00 . A A . 27 LYS CD 1 1 20 13959 1 1 27 LYS CE C 1.532 -10.989 -4.264 1.00 . A A . 27 LYS CE 1 1 20 13960 1 1 27 LYS CG C 1.601 -8.481 -4.055 1.00 . A A . 27 LYS CG 1 1 20 13961 1 1 27 LYS H H 3.449 -6.789 -2.438 1.00 . A A . 27 LYS H 1 1 20 13962 1 1 27 LYS HA H 4.135 -7.812 -5.055 1.00 . A A . 27 LYS HA 1 1 20 13963 1 1 27 LYS HB2 H 1.672 -6.355 -4.111 1.00 . A A . 27 LYS HB2 1 1 20 13964 1 1 27 LYS HB3 H 1.872 -7.124 -5.675 1.00 . A A . 27 LYS HB3 1 1 20 13965 1 1 27 LYS HD2 H 1.890 -9.593 -5.836 1.00 . A A . 27 LYS HD2 1 1 20 13966 1 1 27 LYS HD3 H 3.209 -9.730 -4.672 1.00 . A A . 27 LYS HD3 1 1 20 13967 1 1 27 LYS HE2 H 1.987 -11.822 -4.780 1.00 . A A . 27 LYS HE2 1 1 20 13968 1 1 27 LYS HE3 H 1.750 -11.062 -3.209 1.00 . A A . 27 LYS HE3 1 1 20 13969 1 1 27 LYS HG2 H 1.890 -8.550 -3.017 1.00 . A A . 27 LYS HG2 1 1 20 13970 1 1 27 LYS HG3 H 0.524 -8.469 -4.126 1.00 . A A . 27 LYS HG3 1 1 20 13971 1 1 27 LYS HZ1 H -0.315 -11.946 -4.073 1.00 . A A . 27 LYS HZ1 1 1 20 13972 1 1 27 LYS HZ2 H -0.182 -11.042 -5.471 1.00 . A A . 27 LYS HZ2 1 1 20 13973 1 1 27 LYS HZ3 H -0.435 -10.269 -4.001 1.00 . A A . 27 LYS HZ3 1 1 20 13974 1 1 27 LYS N N 4.078 -7.088 -3.132 1.00 . A A . 27 LYS N 1 1 20 13975 1 1 27 LYS NZ N 0.063 -11.057 -4.459 1.00 . A A . 27 LYS NZ 1 1 20 13976 1 1 27 LYS O O 4.611 -5.675 -6.274 1.00 . A A . 27 LYS O 1 1 20 13977 1 1 28 GLU C C 5.813 -3.096 -4.675 1.00 . A A . 28 GLU C 1 1 20 13978 1 1 28 GLU CA C 4.320 -3.295 -4.919 1.00 . A A . 28 GLU CA 1 1 20 13979 1 1 28 GLU CB C 3.522 -2.187 -4.245 1.00 . A A . 28 GLU CB 1 1 20 13980 1 1 28 GLU CD C 1.812 -1.731 -6.031 1.00 . A A . 28 GLU CD 1 1 20 13981 1 1 28 GLU CG C 2.046 -2.166 -4.605 1.00 . A A . 28 GLU CG 1 1 20 13982 1 1 28 GLU H H 3.439 -4.680 -3.574 1.00 . A A . 28 GLU H 1 1 20 13983 1 1 28 GLU HA H 4.137 -3.267 -5.982 1.00 . A A . 28 GLU HA 1 1 20 13984 1 1 28 GLU HB2 H 3.623 -2.289 -3.176 1.00 . A A . 28 GLU HB2 1 1 20 13985 1 1 28 GLU HB3 H 3.950 -1.240 -4.538 1.00 . A A . 28 GLU HB3 1 1 20 13986 1 1 28 GLU HG2 H 1.644 -3.160 -4.479 1.00 . A A . 28 GLU HG2 1 1 20 13987 1 1 28 GLU HG3 H 1.533 -1.483 -3.944 1.00 . A A . 28 GLU HG3 1 1 20 13988 1 1 28 GLU N N 3.900 -4.602 -4.437 1.00 . A A . 28 GLU N 1 1 20 13989 1 1 28 GLU O O 6.448 -2.272 -5.331 1.00 . A A . 28 GLU O 1 1 20 13990 1 1 28 GLU OE1 O 1.481 -2.558 -6.889 1.00 . A A . 28 GLU OE1 1 1 20 13991 1 1 28 GLU OE2 O 1.957 -0.536 -6.322 1.00 . A A . 28 GLU OE2 1 1 20 13992 1 1 29 HIS C C 8.187 -2.554 -2.689 1.00 . A A . 29 HIS C 1 1 20 13993 1 1 29 HIS CA C 7.788 -3.864 -3.354 1.00 . A A . 29 HIS CA 1 1 20 13994 1 1 29 HIS CB C 8.706 -4.123 -4.567 1.00 . A A . 29 HIS CB 1 1 20 13995 1 1 29 HIS CD2 C 7.790 -5.969 -6.123 1.00 . A A . 29 HIS CD2 1 1 20 13996 1 1 29 HIS CE1 C 9.135 -7.578 -5.584 1.00 . A A . 29 HIS CE1 1 1 20 13997 1 1 29 HIS CG C 8.615 -5.489 -5.166 1.00 . A A . 29 HIS CG 1 1 20 13998 1 1 29 HIS H H 5.754 -4.493 -3.258 1.00 . A A . 29 HIS H 1 1 20 13999 1 1 29 HIS HA H 7.934 -4.660 -2.637 1.00 . A A . 29 HIS HA 1 1 20 14000 1 1 29 HIS HB2 H 8.462 -3.415 -5.345 1.00 . A A . 29 HIS HB2 1 1 20 14001 1 1 29 HIS HB3 H 9.724 -3.958 -4.255 1.00 . A A . 29 HIS HB3 1 1 20 14002 1 1 29 HIS HD1 H 10.169 -6.499 -4.157 1.00 . A A . 29 HIS HD1 1 1 20 14003 1 1 29 HIS HD2 H 6.989 -5.420 -6.596 1.00 . A A . 29 HIS HD2 1 1 20 14004 1 1 29 HIS HE1 H 9.629 -8.537 -5.538 1.00 . A A . 29 HIS HE1 1 1 20 14005 1 1 29 HIS N N 6.355 -3.881 -3.728 1.00 . A A . 29 HIS N 1 1 20 14006 1 1 29 HIS ND1 N 9.458 -6.525 -4.834 1.00 . A A . 29 HIS ND1 1 1 20 14007 1 1 29 HIS NE2 N 8.125 -7.294 -6.388 1.00 . A A . 29 HIS NE2 1 1 20 14008 1 1 29 HIS O O 9.338 -2.136 -2.773 1.00 . A A . 29 HIS O 1 1 20 14009 1 1 30 LEU C C 7.697 -0.797 0.133 1.00 . A A . 30 LEU C 1 1 20 14010 1 1 30 LEU CA C 7.539 -0.662 -1.384 1.00 . A A . 30 LEU CA 1 1 20 14011 1 1 30 LEU CB C 6.421 0.324 -1.733 1.00 . A A . 30 LEU CB 1 1 20 14012 1 1 30 LEU CD1 C 5.042 1.529 -3.453 1.00 . A A . 30 LEU CD1 1 1 20 14013 1 1 30 LEU CD2 C 7.382 0.849 -4.031 1.00 . A A . 30 LEU CD2 1 1 20 14014 1 1 30 LEU CG C 6.124 0.499 -3.233 1.00 . A A . 30 LEU CG 1 1 20 14015 1 1 30 LEU H H 6.389 -2.353 -1.871 1.00 . A A . 30 LEU H 1 1 20 14016 1 1 30 LEU HA H 8.465 -0.288 -1.793 1.00 . A A . 30 LEU HA 1 1 20 14017 1 1 30 LEU HB2 H 5.518 -0.015 -1.246 1.00 . A A . 30 LEU HB2 1 1 20 14018 1 1 30 LEU HB3 H 6.683 1.289 -1.324 1.00 . A A . 30 LEU HB3 1 1 20 14019 1 1 30 LEU HD11 H 4.858 1.625 -4.512 1.00 . A A . 30 LEU HD11 1 1 20 14020 1 1 30 LEU HD12 H 5.347 2.483 -3.049 1.00 . A A . 30 LEU HD12 1 1 20 14021 1 1 30 LEU HD13 H 4.136 1.202 -2.967 1.00 . A A . 30 LEU HD13 1 1 20 14022 1 1 30 LEU HD21 H 7.831 1.755 -3.654 1.00 . A A . 30 LEU HD21 1 1 20 14023 1 1 30 LEU HD22 H 7.118 0.992 -5.068 1.00 . A A . 30 LEU HD22 1 1 20 14024 1 1 30 LEU HD23 H 8.091 0.036 -3.957 1.00 . A A . 30 LEU HD23 1 1 20 14025 1 1 30 LEU HG H 5.742 -0.442 -3.604 1.00 . A A . 30 LEU HG 1 1 20 14026 1 1 30 LEU N N 7.272 -1.940 -1.995 1.00 . A A . 30 LEU N 1 1 20 14027 1 1 30 LEU O O 7.579 -1.897 0.686 1.00 . A A . 30 LEU O 1 1 20 14028 1 1 31 ARG C C 6.949 -0.090 3.017 1.00 . A A . 31 ARG C 1 1 20 14029 1 1 31 ARG CA C 8.171 0.409 2.231 1.00 . A A . 31 ARG CA 1 1 20 14030 1 1 31 ARG CB C 8.492 1.865 2.617 1.00 . A A . 31 ARG CB 1 1 20 14031 1 1 31 ARG CD C 8.701 3.642 4.350 1.00 . A A . 31 ARG CD 1 1 20 14032 1 1 31 ARG CG C 8.499 2.161 4.110 1.00 . A A . 31 ARG CG 1 1 20 14033 1 1 31 ARG CZ C 9.278 4.978 6.374 1.00 . A A . 31 ARG CZ 1 1 20 14034 1 1 31 ARG H H 8.079 1.144 0.255 1.00 . A A . 31 ARG H 1 1 20 14035 1 1 31 ARG HA H 9.024 -0.201 2.488 1.00 . A A . 31 ARG HA 1 1 20 14036 1 1 31 ARG HB2 H 9.466 2.119 2.228 1.00 . A A . 31 ARG HB2 1 1 20 14037 1 1 31 ARG HB3 H 7.759 2.505 2.150 1.00 . A A . 31 ARG HB3 1 1 20 14038 1 1 31 ARG HD2 H 9.678 3.930 3.995 1.00 . A A . 31 ARG HD2 1 1 20 14039 1 1 31 ARG HD3 H 7.956 4.178 3.782 1.00 . A A . 31 ARG HD3 1 1 20 14040 1 1 31 ARG HE H 7.847 3.544 6.238 1.00 . A A . 31 ARG HE 1 1 20 14041 1 1 31 ARG HG2 H 7.552 1.858 4.533 1.00 . A A . 31 ARG HG2 1 1 20 14042 1 1 31 ARG HG3 H 9.302 1.611 4.578 1.00 . A A . 31 ARG HG3 1 1 20 14043 1 1 31 ARG HH11 H 10.584 5.333 4.812 1.00 . A A . 31 ARG HH11 1 1 20 14044 1 1 31 ARG HH12 H 10.841 6.294 6.181 1.00 . A A . 31 ARG HH12 1 1 20 14045 1 1 31 ARG HH21 H 8.205 4.922 8.103 1.00 . A A . 31 ARG HH21 1 1 20 14046 1 1 31 ARG HH22 H 9.470 6.063 8.094 1.00 . A A . 31 ARG HH22 1 1 20 14047 1 1 31 ARG N N 7.979 0.324 0.782 1.00 . A A . 31 ARG N 1 1 20 14048 1 1 31 ARG NE N 8.569 4.016 5.762 1.00 . A A . 31 ARG NE 1 1 20 14049 1 1 31 ARG NH1 N 10.299 5.567 5.751 1.00 . A A . 31 ARG NH1 1 1 20 14050 1 1 31 ARG NH2 N 8.964 5.346 7.606 1.00 . A A . 31 ARG NH2 1 1 20 14051 1 1 31 ARG O O 7.063 -0.984 3.847 1.00 . A A . 31 ARG O 1 1 20 14052 1 1 32 SER C C 3.368 0.607 2.680 1.00 . A A . 32 SER C 1 1 20 14053 1 1 32 SER CA C 4.572 0.170 3.504 1.00 . A A . 32 SER CA 1 1 20 14054 1 1 32 SER CB C 4.567 0.871 4.876 1.00 . A A . 32 SER CB 1 1 20 14055 1 1 32 SER H H 5.748 1.198 2.083 1.00 . A A . 32 SER H 1 1 20 14056 1 1 32 SER HA H 4.541 -0.900 3.648 1.00 . A A . 32 SER HA 1 1 20 14057 1 1 32 SER HB2 H 4.646 1.938 4.728 1.00 . A A . 32 SER HB2 1 1 20 14058 1 1 32 SER HB3 H 3.646 0.646 5.393 1.00 . A A . 32 SER HB3 1 1 20 14059 1 1 32 SER HG H 6.197 -0.143 5.098 1.00 . A A . 32 SER HG 1 1 20 14060 1 1 32 SER N N 5.800 0.507 2.782 1.00 . A A . 32 SER N 1 1 20 14061 1 1 32 SER O O 3.526 0.949 1.509 1.00 . A A . 32 SER O 1 1 20 14062 1 1 32 SER OG O 5.669 0.431 5.677 1.00 . A A . 32 SER OG 1 1 20 14063 1 1 33 GLY C C -0.130 1.144 3.493 1.00 . A A . 33 GLY C 1 1 20 14064 1 1 33 GLY CA C 1.019 1.026 2.562 1.00 . A A . 33 GLY CA 1 1 20 14065 1 1 33 GLY H H 2.052 0.243 4.173 1.00 . A A . 33 GLY H 1 1 20 14066 1 1 33 GLY HA2 H 1.230 2.006 2.161 1.00 . A A . 33 GLY HA2 1 1 20 14067 1 1 33 GLY HA3 H 0.772 0.339 1.766 1.00 . A A . 33 GLY HA3 1 1 20 14068 1 1 33 GLY N N 2.188 0.578 3.256 1.00 . A A . 33 GLY N 1 1 20 14069 1 1 33 GLY O O -0.061 0.649 4.612 1.00 . A A . 33 GLY O 1 1 20 14070 1 1 34 ARG C C -3.540 2.221 3.047 1.00 . A A . 34 ARG C 1 1 20 14071 1 1 34 ARG CA C -2.312 1.992 3.906 1.00 . A A . 34 ARG CA 1 1 20 14072 1 1 34 ARG CB C -2.130 3.164 4.865 1.00 . A A . 34 ARG CB 1 1 20 14073 1 1 34 ARG CD C -2.108 5.632 5.169 1.00 . A A . 34 ARG CD 1 1 20 14074 1 1 34 ARG CG C -1.951 4.500 4.181 1.00 . A A . 34 ARG CG 1 1 20 14075 1 1 34 ARG CZ C -3.906 6.545 6.649 1.00 . A A . 34 ARG CZ 1 1 20 14076 1 1 34 ARG H H -1.161 2.226 2.183 1.00 . A A . 34 ARG H 1 1 20 14077 1 1 34 ARG HA H -2.448 1.090 4.484 1.00 . A A . 34 ARG HA 1 1 20 14078 1 1 34 ARG HB2 H -2.991 3.227 5.507 1.00 . A A . 34 ARG HB2 1 1 20 14079 1 1 34 ARG HB3 H -1.258 2.976 5.474 1.00 . A A . 34 ARG HB3 1 1 20 14080 1 1 34 ARG HD2 H -1.341 5.551 5.923 1.00 . A A . 34 ARG HD2 1 1 20 14081 1 1 34 ARG HD3 H -2.003 6.568 4.639 1.00 . A A . 34 ARG HD3 1 1 20 14082 1 1 34 ARG HE H -3.997 4.820 5.633 1.00 . A A . 34 ARG HE 1 1 20 14083 1 1 34 ARG HG2 H -0.953 4.519 3.764 1.00 . A A . 34 ARG HG2 1 1 20 14084 1 1 34 ARG HG3 H -2.681 4.596 3.391 1.00 . A A . 34 ARG HG3 1 1 20 14085 1 1 34 ARG HH11 H -2.233 7.708 6.605 1.00 . A A . 34 ARG HH11 1 1 20 14086 1 1 34 ARG HH12 H -3.470 8.333 7.569 1.00 . A A . 34 ARG HH12 1 1 20 14087 1 1 34 ARG HH21 H -5.704 5.630 6.953 1.00 . A A . 34 ARG HH21 1 1 20 14088 1 1 34 ARG HH22 H -5.523 7.096 7.778 1.00 . A A . 34 ARG HH22 1 1 20 14089 1 1 34 ARG N N -1.156 1.819 3.081 1.00 . A A . 34 ARG N 1 1 20 14090 1 1 34 ARG NE N -3.433 5.606 5.828 1.00 . A A . 34 ARG NE 1 1 20 14091 1 1 34 ARG NH1 N -3.164 7.593 6.963 1.00 . A A . 34 ARG NH1 1 1 20 14092 1 1 34 ARG NH2 N -5.115 6.419 7.159 1.00 . A A . 34 ARG NH2 1 1 20 14093 1 1 34 ARG O O -3.448 2.341 1.820 1.00 . A A . 34 ARG O 1 1 20 14094 1 1 35 CYS C C -6.452 3.872 3.321 1.00 . A A . 35 CYS C 1 1 20 14095 1 1 35 CYS CA C -5.908 2.501 3.004 1.00 . A A . 35 CYS CA 1 1 20 14096 1 1 35 CYS CB C -6.867 1.405 3.460 1.00 . A A . 35 CYS CB 1 1 20 14097 1 1 35 CYS H H -4.677 2.325 4.669 1.00 . A A . 35 CYS H 1 1 20 14098 1 1 35 CYS HA H -5.750 2.420 1.939 1.00 . A A . 35 CYS HA 1 1 20 14099 1 1 35 CYS HB2 H -7.184 1.608 4.472 1.00 . A A . 35 CYS HB2 1 1 20 14100 1 1 35 CYS HB3 H -7.728 1.386 2.808 1.00 . A A . 35 CYS HB3 1 1 20 14101 1 1 35 CYS N N -4.664 2.335 3.688 1.00 . A A . 35 CYS N 1 1 20 14102 1 1 35 CYS O O -6.318 4.356 4.442 1.00 . A A . 35 CYS O 1 1 20 14103 1 1 35 CYS SG S -6.098 -0.252 3.422 1.00 . A A . 35 CYS SG 1 1 20 14104 1 1 36 ARG C C -9.046 5.839 2.409 1.00 . A A . 36 ARG C 1 1 20 14105 1 1 36 ARG CA C -7.536 5.845 2.530 1.00 . A A . 36 ARG CA 1 1 20 14106 1 1 36 ARG CB C -6.895 6.867 1.605 1.00 . A A . 36 ARG CB 1 1 20 14107 1 1 36 ARG CD C -5.321 7.790 3.364 1.00 . A A . 36 ARG CD 1 1 20 14108 1 1 36 ARG CG C -5.445 7.215 1.952 1.00 . A A . 36 ARG CG 1 1 20 14109 1 1 36 ARG CZ C -6.130 9.835 4.577 1.00 . A A . 36 ARG CZ 1 1 20 14110 1 1 36 ARG H H -7.012 4.116 1.445 1.00 . A A . 36 ARG H 1 1 20 14111 1 1 36 ARG HA H -7.311 6.118 3.549 1.00 . A A . 36 ARG HA 1 1 20 14112 1 1 36 ARG HB2 H -6.903 6.450 0.609 1.00 . A A . 36 ARG HB2 1 1 20 14113 1 1 36 ARG HB3 H -7.482 7.773 1.620 1.00 . A A . 36 ARG HB3 1 1 20 14114 1 1 36 ARG HD2 H -5.560 7.021 4.084 1.00 . A A . 36 ARG HD2 1 1 20 14115 1 1 36 ARG HD3 H -4.300 8.102 3.514 1.00 . A A . 36 ARG HD3 1 1 20 14116 1 1 36 ARG HE H -6.950 9.030 2.930 1.00 . A A . 36 ARG HE 1 1 20 14117 1 1 36 ARG HG2 H -4.847 6.318 1.888 1.00 . A A . 36 ARG HG2 1 1 20 14118 1 1 36 ARG HG3 H -5.080 7.941 1.241 1.00 . A A . 36 ARG HG3 1 1 20 14119 1 1 36 ARG HH11 H -4.294 9.235 5.250 1.00 . A A . 36 ARG HH11 1 1 20 14120 1 1 36 ARG HH12 H -4.966 10.498 6.145 1.00 . A A . 36 ARG HH12 1 1 20 14121 1 1 36 ARG HH21 H -7.905 10.737 4.136 1.00 . A A . 36 ARG HH21 1 1 20 14122 1 1 36 ARG HH22 H -7.070 11.416 5.460 1.00 . A A . 36 ARG HH22 1 1 20 14123 1 1 36 ARG N N -6.983 4.529 2.336 1.00 . A A . 36 ARG N 1 1 20 14124 1 1 36 ARG NE N -6.213 8.948 3.575 1.00 . A A . 36 ARG NE 1 1 20 14125 1 1 36 ARG NH1 N -5.066 9.861 5.375 1.00 . A A . 36 ARG NH1 1 1 20 14126 1 1 36 ARG NH2 N -7.097 10.720 4.738 1.00 . A A . 36 ARG NH2 1 1 20 14127 1 1 36 ARG O O -9.642 4.788 2.198 1.00 . A A . 36 ARG O 1 1 20 14128 1 1 37 ASP C C -11.830 6.641 1.354 1.00 . A A . 37 ASP C 1 1 20 14129 1 1 37 ASP CA C -11.107 7.256 2.567 1.00 . A A . 37 ASP CA 1 1 20 14130 1 1 37 ASP CB C -11.382 8.774 2.594 1.00 . A A . 37 ASP CB 1 1 20 14131 1 1 37 ASP CG C -10.655 9.511 3.708 1.00 . A A . 37 ASP CG 1 1 20 14132 1 1 37 ASP H H -9.084 7.820 2.658 1.00 . A A . 37 ASP H 1 1 20 14133 1 1 37 ASP HA H -11.507 6.827 3.474 1.00 . A A . 37 ASP HA 1 1 20 14134 1 1 37 ASP HB2 H -11.068 9.196 1.653 1.00 . A A . 37 ASP HB2 1 1 20 14135 1 1 37 ASP HB3 H -12.443 8.934 2.711 1.00 . A A . 37 ASP HB3 1 1 20 14136 1 1 37 ASP N N -9.641 7.018 2.548 1.00 . A A . 37 ASP N 1 1 20 14137 1 1 37 ASP O O -12.994 6.247 1.447 1.00 . A A . 37 ASP O 1 1 20 14138 1 1 37 ASP OD1 O -9.410 9.694 3.604 1.00 . A A . 37 ASP OD1 1 1 20 14139 1 1 37 ASP OD2 O -11.299 9.947 4.696 1.00 . A A . 37 ASP OD2 1 1 20 14140 1 1 38 ASP C C -11.695 4.457 -0.981 1.00 . A A . 38 ASP C 1 1 20 14141 1 1 38 ASP CA C -11.714 5.973 -1.018 1.00 . A A . 38 ASP CA 1 1 20 14142 1 1 38 ASP CB C -10.936 6.392 -2.278 1.00 . A A . 38 ASP CB 1 1 20 14143 1 1 38 ASP CG C -10.919 7.861 -2.549 1.00 . A A . 38 ASP CG 1 1 20 14144 1 1 38 ASP H H -10.229 6.935 0.217 1.00 . A A . 38 ASP H 1 1 20 14145 1 1 38 ASP HA H -12.733 6.318 -1.112 1.00 . A A . 38 ASP HA 1 1 20 14146 1 1 38 ASP HB2 H -9.912 6.069 -2.175 1.00 . A A . 38 ASP HB2 1 1 20 14147 1 1 38 ASP HB3 H -11.371 5.889 -3.129 1.00 . A A . 38 ASP HB3 1 1 20 14148 1 1 38 ASP N N -11.134 6.559 0.221 1.00 . A A . 38 ASP N 1 1 20 14149 1 1 38 ASP O O -12.175 3.812 -1.902 1.00 . A A . 38 ASP O 1 1 20 14150 1 1 38 ASP OD1 O -11.986 8.459 -2.752 1.00 . A A . 38 ASP OD1 1 1 20 14151 1 1 38 ASP OD2 O -9.823 8.438 -2.624 1.00 . A A . 38 ASP OD2 1 1 20 14152 1 1 39 PHE C C -9.826 1.921 -0.719 1.00 . A A . 39 PHE C 1 1 20 14153 1 1 39 PHE CA C -10.875 2.449 0.240 1.00 . A A . 39 PHE CA 1 1 20 14154 1 1 39 PHE CB C -12.170 1.615 0.157 1.00 . A A . 39 PHE CB 1 1 20 14155 1 1 39 PHE CD1 C -14.160 2.724 1.195 1.00 . A A . 39 PHE CD1 1 1 20 14156 1 1 39 PHE CD2 C -12.948 1.130 2.484 1.00 . A A . 39 PHE CD2 1 1 20 14157 1 1 39 PHE CE1 C -15.025 2.917 2.247 1.00 . A A . 39 PHE CE1 1 1 20 14158 1 1 39 PHE CE2 C -13.813 1.320 3.539 1.00 . A A . 39 PHE CE2 1 1 20 14159 1 1 39 PHE CG C -13.112 1.830 1.300 1.00 . A A . 39 PHE CG 1 1 20 14160 1 1 39 PHE CZ C -14.853 2.216 3.420 1.00 . A A . 39 PHE CZ 1 1 20 14161 1 1 39 PHE H H -10.782 4.491 0.789 1.00 . A A . 39 PHE H 1 1 20 14162 1 1 39 PHE HA H -10.457 2.343 1.232 1.00 . A A . 39 PHE HA 1 1 20 14163 1 1 39 PHE HB2 H -12.694 1.874 -0.751 1.00 . A A . 39 PHE HB2 1 1 20 14164 1 1 39 PHE HB3 H -11.910 0.568 0.126 1.00 . A A . 39 PHE HB3 1 1 20 14165 1 1 39 PHE HD1 H -14.298 3.275 0.277 1.00 . A A . 39 PHE HD1 1 1 20 14166 1 1 39 PHE HD2 H -12.135 0.424 2.582 1.00 . A A . 39 PHE HD2 1 1 20 14167 1 1 39 PHE HE1 H -15.842 3.617 2.157 1.00 . A A . 39 PHE HE1 1 1 20 14168 1 1 39 PHE HE2 H -13.674 0.769 4.458 1.00 . A A . 39 PHE HE2 1 1 20 14169 1 1 39 PHE HZ H -15.534 2.370 4.242 1.00 . A A . 39 PHE HZ 1 1 20 14170 1 1 39 PHE N N -11.091 3.901 0.066 1.00 . A A . 39 PHE N 1 1 20 14171 1 1 39 PHE O O -9.628 0.723 -0.834 1.00 . A A . 39 PHE O 1 1 20 14172 1 1 40 ARG C C -6.757 2.408 -1.537 1.00 . A A . 40 ARG C 1 1 20 14173 1 1 40 ARG CA C -8.092 2.436 -2.291 1.00 . A A . 40 ARG CA 1 1 20 14174 1 1 40 ARG CB C -8.046 3.407 -3.492 1.00 . A A . 40 ARG CB 1 1 20 14175 1 1 40 ARG CD C -7.355 1.712 -5.222 1.00 . A A . 40 ARG CD 1 1 20 14176 1 1 40 ARG CG C -7.032 3.040 -4.565 1.00 . A A . 40 ARG CG 1 1 20 14177 1 1 40 ARG CZ C -6.157 0.064 -6.639 1.00 . A A . 40 ARG CZ 1 1 20 14178 1 1 40 ARG H H -9.338 3.761 -1.218 1.00 . A A . 40 ARG H 1 1 20 14179 1 1 40 ARG HA H -8.315 1.439 -2.638 1.00 . A A . 40 ARG HA 1 1 20 14180 1 1 40 ARG HB2 H -9.016 3.430 -3.963 1.00 . A A . 40 ARG HB2 1 1 20 14181 1 1 40 ARG HB3 H -7.807 4.397 -3.133 1.00 . A A . 40 ARG HB3 1 1 20 14182 1 1 40 ARG HD2 H -7.453 0.952 -4.461 1.00 . A A . 40 ARG HD2 1 1 20 14183 1 1 40 ARG HD3 H -8.285 1.807 -5.762 1.00 . A A . 40 ARG HD3 1 1 20 14184 1 1 40 ARG HE H -5.691 2.021 -6.422 1.00 . A A . 40 ARG HE 1 1 20 14185 1 1 40 ARG HG2 H -7.009 3.810 -5.320 1.00 . A A . 40 ARG HG2 1 1 20 14186 1 1 40 ARG HG3 H -6.064 2.964 -4.092 1.00 . A A . 40 ARG HG3 1 1 20 14187 1 1 40 ARG HH11 H -7.813 -0.788 -5.719 1.00 . A A . 40 ARG HH11 1 1 20 14188 1 1 40 ARG HH12 H -6.912 -1.825 -6.707 1.00 . A A . 40 ARG HH12 1 1 20 14189 1 1 40 ARG HH21 H -4.445 0.472 -7.694 1.00 . A A . 40 ARG HH21 1 1 20 14190 1 1 40 ARG HH22 H -5.026 -1.129 -7.830 1.00 . A A . 40 ARG HH22 1 1 20 14191 1 1 40 ARG N N -9.133 2.818 -1.372 1.00 . A A . 40 ARG N 1 1 20 14192 1 1 40 ARG NE N -6.310 1.305 -6.153 1.00 . A A . 40 ARG NE 1 1 20 14193 1 1 40 ARG NH1 N -7.019 -0.902 -6.322 1.00 . A A . 40 ARG NH1 1 1 20 14194 1 1 40 ARG NH2 N -5.138 -0.210 -7.433 1.00 . A A . 40 ARG NH2 1 1 20 14195 1 1 40 ARG O O -6.588 3.133 -0.533 1.00 . A A . 40 ARG O 1 1 20 14196 1 1 41 CYS C C -3.557 2.455 -1.801 1.00 . A A . 41 CYS C 1 1 20 14197 1 1 41 CYS CA C -4.558 1.429 -1.360 1.00 . A A . 41 CYS CA 1 1 20 14198 1 1 41 CYS CB C -3.999 0.031 -1.542 1.00 . A A . 41 CYS CB 1 1 20 14199 1 1 41 CYS H H -6.027 1.042 -2.789 1.00 . A A . 41 CYS H 1 1 20 14200 1 1 41 CYS HA H -4.722 1.575 -0.302 1.00 . A A . 41 CYS HA 1 1 20 14201 1 1 41 CYS HB2 H -4.172 -0.291 -2.558 1.00 . A A . 41 CYS HB2 1 1 20 14202 1 1 41 CYS HB3 H -2.937 0.044 -1.347 1.00 . A A . 41 CYS HB3 1 1 20 14203 1 1 41 CYS N N -5.847 1.577 -1.991 1.00 . A A . 41 CYS N 1 1 20 14204 1 1 41 CYS O O -3.293 2.634 -3.003 1.00 . A A . 41 CYS O 1 1 20 14205 1 1 41 CYS SG S -4.750 -1.179 -0.444 1.00 . A A . 41 CYS SG 1 1 20 14206 1 1 42 TRP C C -0.731 3.527 -0.336 1.00 . A A . 42 TRP C 1 1 20 14207 1 1 42 TRP CA C -1.992 4.086 -0.977 1.00 . A A . 42 TRP CA 1 1 20 14208 1 1 42 TRP CB C -2.394 5.386 -0.284 1.00 . A A . 42 TRP CB 1 1 20 14209 1 1 42 TRP CD1 C -2.072 7.490 -1.707 1.00 . A A . 42 TRP CD1 1 1 20 14210 1 1 42 TRP CD2 C -4.196 6.793 -1.639 1.00 . A A . 42 TRP CD2 1 1 20 14211 1 1 42 TRP CE2 C -4.130 7.975 -2.406 1.00 . A A . 42 TRP CE2 1 1 20 14212 1 1 42 TRP CE3 C -5.438 6.174 -1.477 1.00 . A A . 42 TRP CE3 1 1 20 14213 1 1 42 TRP CG C -2.855 6.509 -1.183 1.00 . A A . 42 TRP CG 1 1 20 14214 1 1 42 TRP CH2 C -6.454 7.921 -2.812 1.00 . A A . 42 TRP CH2 1 1 20 14215 1 1 42 TRP CZ2 C -5.256 8.549 -2.995 1.00 . A A . 42 TRP CZ2 1 1 20 14216 1 1 42 TRP CZ3 C -6.553 6.745 -2.067 1.00 . A A . 42 TRP CZ3 1 1 20 14217 1 1 42 TRP H H -3.296 2.902 0.097 1.00 . A A . 42 TRP H 1 1 20 14218 1 1 42 TRP HA H -1.826 4.266 -2.028 1.00 . A A . 42 TRP HA 1 1 20 14219 1 1 42 TRP HB2 H -3.209 5.168 0.391 1.00 . A A . 42 TRP HB2 1 1 20 14220 1 1 42 TRP HB3 H -1.557 5.737 0.298 1.00 . A A . 42 TRP HB3 1 1 20 14221 1 1 42 TRP HD1 H -1.005 7.564 -1.556 1.00 . A A . 42 TRP HD1 1 1 20 14222 1 1 42 TRP HE1 H -2.480 9.179 -2.877 1.00 . A A . 42 TRP HE1 1 1 20 14223 1 1 42 TRP HE3 H -5.533 5.258 -0.919 1.00 . A A . 42 TRP HE3 1 1 20 14224 1 1 42 TRP HH2 H -7.353 8.332 -3.249 1.00 . A A . 42 TRP HH2 1 1 20 14225 1 1 42 TRP HZ2 H -5.202 9.459 -3.576 1.00 . A A . 42 TRP HZ2 1 1 20 14226 1 1 42 TRP HZ3 H -7.524 6.287 -1.950 1.00 . A A . 42 TRP HZ3 1 1 20 14227 1 1 42 TRP N N -3.017 3.111 -0.825 1.00 . A A . 42 TRP N 1 1 20 14228 1 1 42 TRP NE1 N -2.828 8.381 -2.418 1.00 . A A . 42 TRP NE1 1 1 20 14229 1 1 42 TRP O O -0.623 3.452 0.891 1.00 . A A . 42 TRP O 1 1 20 14230 1 1 43 CYS C C 2.438 3.602 -0.468 1.00 . A A . 43 CYS C 1 1 20 14231 1 1 43 CYS CA C 1.400 2.518 -0.693 1.00 . A A . 43 CYS CA 1 1 20 14232 1 1 43 CYS CB C 1.902 1.494 -1.704 1.00 . A A . 43 CYS CB 1 1 20 14233 1 1 43 CYS H H 0.057 3.250 -2.110 1.00 . A A . 43 CYS H 1 1 20 14234 1 1 43 CYS HA H 1.195 2.017 0.239 1.00 . A A . 43 CYS HA 1 1 20 14235 1 1 43 CYS HB2 H 2.110 1.997 -2.636 1.00 . A A . 43 CYS HB2 1 1 20 14236 1 1 43 CYS HB3 H 2.809 1.048 -1.325 1.00 . A A . 43 CYS HB3 1 1 20 14237 1 1 43 CYS N N 0.179 3.108 -1.146 1.00 . A A . 43 CYS N 1 1 20 14238 1 1 43 CYS O O 2.457 4.610 -1.161 1.00 . A A . 43 CYS O 1 1 20 14239 1 1 43 CYS SG S 0.722 0.148 -2.058 1.00 . A A . 43 CYS SG 1 1 20 14240 1 1 44 THR C C 5.641 3.815 0.536 1.00 . A A . 44 THR C 1 1 20 14241 1 1 44 THR CA C 4.259 4.364 0.853 1.00 . A A . 44 THR CA 1 1 20 14242 1 1 44 THR CB C 4.149 4.641 2.351 1.00 . A A . 44 THR CB 1 1 20 14243 1 1 44 THR CG2 C 5.003 5.834 2.750 1.00 . A A . 44 THR CG2 1 1 20 14244 1 1 44 THR H H 3.261 2.549 0.974 1.00 . A A . 44 THR H 1 1 20 14245 1 1 44 THR HA H 4.090 5.285 0.317 1.00 . A A . 44 THR HA 1 1 20 14246 1 1 44 THR HB H 4.471 3.765 2.895 1.00 . A A . 44 THR HB 1 1 20 14247 1 1 44 THR HG1 H 2.292 4.929 1.820 1.00 . A A . 44 THR HG1 1 1 20 14248 1 1 44 THR HG21 H 6.038 5.621 2.527 1.00 . A A . 44 THR HG21 1 1 20 14249 1 1 44 THR HG22 H 4.895 6.018 3.809 1.00 . A A . 44 THR HG22 1 1 20 14250 1 1 44 THR HG23 H 4.687 6.706 2.197 1.00 . A A . 44 THR HG23 1 1 20 14251 1 1 44 THR N N 3.272 3.406 0.491 1.00 . A A . 44 THR N 1 1 20 14252 1 1 44 THR O O 5.990 2.719 0.973 1.00 . A A . 44 THR O 1 1 20 14253 1 1 44 THR OG1 O 2.775 4.913 2.655 1.00 . A A . 44 THR OG1 1 1 20 14254 1 1 45 LYS C C 8.704 5.223 -0.137 1.00 . A A . 45 LYS C 1 1 20 14255 1 1 45 LYS CA C 7.741 4.145 -0.559 1.00 . A A . 45 LYS CA 1 1 20 14256 1 1 45 LYS CB C 7.916 3.855 -2.055 1.00 . A A . 45 LYS CB 1 1 20 14257 1 1 45 LYS CD C 8.105 4.703 -4.405 1.00 . A A . 45 LYS CD 1 1 20 14258 1 1 45 LYS CE C 7.855 5.848 -5.372 1.00 . A A . 45 LYS CE 1 1 20 14259 1 1 45 LYS CG C 7.646 5.031 -2.990 1.00 . A A . 45 LYS CG 1 1 20 14260 1 1 45 LYS H H 6.035 5.383 -0.602 1.00 . A A . 45 LYS H 1 1 20 14261 1 1 45 LYS HA H 7.959 3.247 -0.002 1.00 . A A . 45 LYS HA 1 1 20 14262 1 1 45 LYS HB2 H 8.925 3.513 -2.230 1.00 . A A . 45 LYS HB2 1 1 20 14263 1 1 45 LYS HB3 H 7.230 3.063 -2.310 1.00 . A A . 45 LYS HB3 1 1 20 14264 1 1 45 LYS HD2 H 9.164 4.489 -4.389 1.00 . A A . 45 LYS HD2 1 1 20 14265 1 1 45 LYS HD3 H 7.571 3.829 -4.749 1.00 . A A . 45 LYS HD3 1 1 20 14266 1 1 45 LYS HE2 H 8.250 6.756 -4.938 1.00 . A A . 45 LYS HE2 1 1 20 14267 1 1 45 LYS HE3 H 8.376 5.644 -6.296 1.00 . A A . 45 LYS HE3 1 1 20 14268 1 1 45 LYS HG2 H 6.587 5.242 -2.999 1.00 . A A . 45 LYS HG2 1 1 20 14269 1 1 45 LYS HG3 H 8.187 5.896 -2.634 1.00 . A A . 45 LYS HG3 1 1 20 14270 1 1 45 LYS HZ1 H 6.304 6.883 -6.270 1.00 . A A . 45 LYS HZ1 1 1 20 14271 1 1 45 LYS HZ2 H 5.811 6.175 -4.824 1.00 . A A . 45 LYS HZ2 1 1 20 14272 1 1 45 LYS HZ3 H 6.050 5.245 -6.203 1.00 . A A . 45 LYS HZ3 1 1 20 14273 1 1 45 LYS N N 6.394 4.540 -0.240 1.00 . A A . 45 LYS N 1 1 20 14274 1 1 45 LYS NZ N 6.422 6.049 -5.658 1.00 . A A . 45 LYS NZ 1 1 20 14275 1 1 45 LYS O O 8.298 6.371 0.079 1.00 . A A . 45 LYS O 1 1 20 14276 1 1 46 ASN C C 11.455 6.450 -0.961 1.00 . A A . 46 ASN C 1 1 20 14277 1 1 46 ASN CA C 10.991 5.811 0.314 1.00 . A A . 46 ASN CA 1 1 20 14278 1 1 46 ASN CB C 12.190 5.145 1.013 1.00 . A A . 46 ASN CB 1 1 20 14279 1 1 46 ASN CG C 11.888 4.668 2.418 1.00 . A A . 46 ASN CG 1 1 20 14280 1 1 46 ASN H H 10.193 3.916 -0.120 1.00 . A A . 46 ASN H 1 1 20 14281 1 1 46 ASN HA H 10.575 6.568 0.962 1.00 . A A . 46 ASN HA 1 1 20 14282 1 1 46 ASN HB2 H 12.502 4.291 0.433 1.00 . A A . 46 ASN HB2 1 1 20 14283 1 1 46 ASN HB3 H 13.003 5.853 1.058 1.00 . A A . 46 ASN HB3 1 1 20 14284 1 1 46 ASN HD21 H 13.170 3.186 2.214 1.00 . A A . 46 ASN HD21 1 1 20 14285 1 1 46 ASN HD22 H 12.387 3.283 3.739 1.00 . A A . 46 ASN HD22 1 1 20 14286 1 1 46 ASN N N 9.948 4.858 0.004 1.00 . A A . 46 ASN N 1 1 20 14287 1 1 46 ASN ND2 N 12.535 3.615 2.829 1.00 . A A . 46 ASN ND2 1 1 20 14288 1 1 46 ASN O O 11.692 5.763 -1.959 1.00 . A A . 46 ASN O 1 1 20 14289 1 1 46 ASN OD1 O 11.069 5.243 3.126 1.00 . A A . 46 ASN OD1 1 1 20 14290 1 1 47 CYS C C 13.303 9.116 -1.722 1.00 . A A . 47 CYS C 1 1 20 14291 1 1 47 CYS CA C 12.002 8.463 -2.087 1.00 . A A . 47 CYS CA 1 1 20 14292 1 1 47 CYS CB C 10.963 9.490 -2.544 1.00 . A A . 47 CYS CB 1 1 20 14293 1 1 47 CYS H H 11.291 8.259 -0.163 1.00 . A A . 47 CYS H 1 1 20 14294 1 1 47 CYS HA H 12.181 7.756 -2.883 1.00 . A A . 47 CYS HA 1 1 20 14295 1 1 47 CYS HB2 H 10.712 10.131 -1.712 1.00 . A A . 47 CYS HB2 1 1 20 14296 1 1 47 CYS HB3 H 11.375 10.085 -3.344 1.00 . A A . 47 CYS HB3 1 1 20 14297 1 1 47 CYS N N 11.536 7.733 -0.957 1.00 . A A . 47 CYS N 1 1 20 14298 1 1 47 CYS O O 14.348 8.747 -2.294 1.00 . A A . 47 CYS O 1 1 20 14299 1 1 47 CYS OXT O 13.311 9.939 -0.788 1.00 . A A . 47 CYS OXT 1 1 20 14300 1 1 47 CYS SG S 9.406 8.747 -3.145 1.00 . A A . 47 CYS SG 1 1 stop_ save_
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