NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
412693 | 2bl6 | 7352 | cing | 4-filtered-FRED | STAR | entry | full | 545 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2bl6 # This FRED archive file contains, for PDB entry <2bl6>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2bl6 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2bl6 _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 4275.63 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 $NUCLEOCAPSID_PROTEIN_P11 A . 1 1 2 . 2 $ZINC_ION B . 1 1 3 . 2 $ZINC_ION C . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 ZN 1 ZN 1 1 3 2 ZN 1 ZN 1 1 stop_ save_ save_NUCLEOCAPSID_PROTEIN_P11 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "NUCLEOCAPSID PROTEIN P11" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code QTCYNCGKPGHLSSQCRAPKVCFKCKQPGHFSKQCRS _Entity.Number_of_monomers 37 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 GLN . 1 1 2 THR . 1 1 3 CYS . 1 1 4 TYR . 1 1 5 ASN . 1 1 6 CYS . 1 1 7 GLY . 1 1 8 LYS . 1 1 9 PRO . 1 1 10 GLY . 1 1 11 HIS . 1 1 12 LEU . 1 1 13 SER . 1 1 14 SER . 1 1 15 GLN . 1 1 16 CYS . 1 1 17 ARG . 1 1 18 ALA . 1 1 19 PRO . 1 1 20 LYS . 1 1 21 VAL . 1 1 22 CYS . 1 1 23 PHE . 1 1 24 LYS . 1 1 25 CYS . 1 1 26 LYS . 1 1 27 GLN . 1 1 28 PRO . 1 1 29 GLY . 1 1 30 HIS . 1 1 31 PHE . 1 1 32 SER . 1 1 33 LYS . 1 1 34 GLN . 1 1 35 CYS . 1 1 36 ARG . 1 1 37 SER . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLN 1 1 1 1 THR 2 2 1 1 CYS 3 3 1 1 TYR 4 4 1 1 ASN 5 5 1 1 CYS 6 6 1 1 GLY 7 7 1 1 LYS 8 8 1 1 PRO 9 9 1 1 GLY 10 10 1 1 HIS 11 11 1 1 LEU 12 12 1 1 SER 13 13 1 1 SER 14 14 1 1 GLN 15 15 1 1 CYS 16 16 1 1 ARG 17 17 1 1 ALA 18 18 1 1 PRO 19 19 1 1 LYS 20 20 1 1 VAL 21 21 1 1 CYS 22 22 1 1 PHE 23 23 1 1 LYS 24 24 1 1 CYS 25 25 1 1 LYS 26 26 1 1 GLN 27 27 1 1 PRO 28 28 1 1 GLY 29 29 1 1 HIS 30 30 1 1 PHE 31 31 1 1 SER 32 32 1 1 LYS 33 33 1 1 GLN 34 34 1 1 CYS 35 35 1 1 ARG 36 36 1 1 SER 37 37 1 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "ZINC ION" _Entity.Type non-polymer 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 ZN $ZN 1 2 stop_ save_ save_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ZN _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 THR H . 2 THR H 1 1 1 1 2 1 1 2 THR HB . 2 THR HB 1 1 2 1 1 1 1 2 THR H . 2 THR H 1 1 2 1 2 1 1 2 THR MG . 2 THR QG2 1 1 3 1 1 1 1 2 THR H . 2 THR H 1 1 3 1 2 1 1 20 LYS H . 20 LYS H 1 1 4 1 1 1 1 2 THR HA . 2 THR HA 1 1 4 1 2 1 1 2 THR MG . 2 THR QG2 1 1 5 1 1 1 1 2 THR HA . 2 THR HA 1 1 5 1 2 1 1 3 CYS H . 3 CYS H 1 1 6 1 1 1 1 2 THR HA . 2 THR HA 1 1 6 1 2 1 1 3 CYS HA . 3 CYS HA 1 1 7 1 1 1 1 2 THR HA . 2 THR HA 1 1 7 1 2 1 1 3 CYS HB2 . 3 CYS HB2 1 1 8 1 1 1 1 2 THR HA . 2 THR HA 1 1 8 1 2 1 1 3 CYS HB3 . 3 CYS HB3 1 1 9 1 1 1 1 2 THR HA . 2 THR HA 1 1 9 1 2 1 1 8 LYS H . 8 LYS H 1 1 10 1 1 1 1 2 THR HA . 2 THR HA 1 1 10 1 2 1 1 9 PRO HA . 9 PRO HA 1 1 11 1 1 1 1 2 THR HB . 2 THR HB 1 1 11 1 2 1 1 3 CYS H . 3 CYS H 1 1 12 1 1 1 1 2 THR MG . 2 THR QG2 1 1 12 1 2 1 1 3 CYS H . 3 CYS H 1 1 13 1 1 1 1 2 THR MG . 2 THR QG2 1 1 13 1 2 1 1 7 GLY HA3 . 7 GLY HA2 1 1 14 1 1 1 1 2 THR MG . 2 THR QG2 1 1 14 1 2 1 1 8 LYS H . 8 LYS H 1 1 15 1 1 1 1 2 THR MG . 2 THR QG2 1 1 15 1 2 1 1 9 PRO HD3 . 9 PRO HD3 1 1 16 1 1 1 1 3 CYS H . 3 CYS H 1 1 16 1 2 1 1 3 CYS HA . 3 CYS HA 1 1 17 1 1 1 1 3 CYS H . 3 CYS H 1 1 17 1 2 1 1 3 CYS HB2 . 3 CYS HB2 1 1 18 1 1 1 1 3 CYS H . 3 CYS H 1 1 18 1 2 1 1 3 CYS HB3 . 3 CYS HB3 1 1 19 1 1 1 1 3 CYS H . 3 CYS H 1 1 19 1 2 1 1 4 TYR H . 4 TYR H 1 1 20 1 1 1 1 3 CYS H . 3 CYS H 1 1 20 1 2 1 1 7 GLY H . 7 GLY H 1 1 21 1 1 1 1 3 CYS H . 3 CYS H 1 1 21 1 2 1 1 8 LYS H . 8 LYS H 1 1 22 1 1 1 1 3 CYS H . 3 CYS H 1 1 22 1 2 1 1 11 HIS HE1 . 11 HIS HE1 1 1 23 1 1 1 1 3 CYS H . 3 CYS H 1 1 23 1 2 1 1 20 LYS H . 20 LYS H 1 1 24 1 1 1 1 3 CYS HA . 3 CYS HA 1 1 24 1 2 1 1 3 CYS HB2 . 3 CYS HB2 1 1 25 1 1 1 1 3 CYS HA . 3 CYS HA 1 1 25 1 2 1 1 4 TYR H . 4 TYR H 1 1 26 1 1 1 1 3 CYS HA . 3 CYS HA 1 1 26 1 2 1 1 4 TYR HD1 . 4 TYR HD2 1 1 27 1 1 1 1 3 CYS HA . 3 CYS HA 1 1 27 1 2 1 1 6 CYS H . 6 CYS H 1 1 28 1 1 1 1 3 CYS HA . 3 CYS HA 1 1 28 1 2 1 1 8 LYS H . 8 LYS H 1 1 29 1 1 1 1 3 CYS HA . 3 CYS HA 1 1 29 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1 30 1 1 1 1 3 CYS HB2 . 3 CYS HB2 1 1 30 1 2 1 1 4 TYR H . 4 TYR H 1 1 31 1 1 1 1 3 CYS HB2 . 3 CYS HB2 1 1 31 1 2 1 1 6 CYS HB2 . 6 CYS HB2 1 1 32 1 1 1 1 3 CYS HB2 . 3 CYS HB2 1 1 32 1 2 1 1 8 LYS H . 8 LYS H 1 1 33 1 1 1 1 3 CYS HB2 . 3 CYS HB2 1 1 33 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1 34 1 1 1 1 3 CYS HB3 . 3 CYS HB3 1 1 34 1 2 1 1 4 TYR H . 4 TYR H 1 1 35 1 1 1 1 3 CYS HB3 . 3 CYS HB3 1 1 35 1 2 1 1 4 TYR HA . 4 TYR HA 1 1 36 1 1 1 1 3 CYS HB3 . 3 CYS HB3 1 1 36 1 2 1 1 4 TYR HD1 . 4 TYR HD2 1 1 37 1 1 1 1 3 CYS HB3 . 3 CYS HB3 1 1 37 1 2 1 1 5 ASN HB3 . 5 ASN HB3 1 1 38 1 1 1 1 3 CYS HB3 . 3 CYS HB3 1 1 38 1 2 1 1 7 GLY H . 7 GLY H 1 1 39 1 1 1 1 3 CYS HB3 . 3 CYS HB3 1 1 39 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1 40 1 1 1 1 3 CYS HB3 . 3 CYS HB3 1 1 40 1 2 1 1 11 HIS HE1 . 11 HIS HE1 1 1 41 1 1 1 1 4 TYR H . 4 TYR H 1 1 41 1 2 1 1 4 TYR HB2 . 4 TYR HB2 1 1 42 1 1 1 1 4 TYR H . 4 TYR H 1 1 42 1 2 1 1 4 TYR HB3 . 4 TYR HB3 1 1 43 1 1 1 1 4 TYR H . 4 TYR H 1 1 43 1 2 1 1 4 TYR HD1 . 4 TYR HD2 1 1 44 1 1 1 1 4 TYR H . 4 TYR H 1 1 44 1 2 1 1 5 ASN H . 5 ASN H 1 1 45 1 1 1 1 4 TYR H . 4 TYR H 1 1 45 1 2 1 1 5 ASN HB2 . 5 ASN HB2 1 1 46 1 1 1 1 4 TYR H . 4 TYR H 1 1 46 1 2 1 1 5 ASN HB3 . 5 ASN HB3 1 1 47 1 1 1 1 4 TYR H . 4 TYR H 1 1 47 1 2 1 1 16 CYS HB2 . 16 CYS HB2 1 1 48 1 1 1 1 4 TYR H . 4 TYR H 1 1 48 1 2 1 1 18 ALA H . 18 ALA H 1 1 49 1 1 1 1 4 TYR H . 4 TYR H 1 1 49 1 2 1 1 20 LYS H . 20 LYS H 1 1 50 1 1 1 1 4 TYR HA . 4 TYR HA 1 1 50 1 2 1 1 4 TYR HB2 . 4 TYR HB2 1 1 51 1 1 1 1 4 TYR HA . 4 TYR HA 1 1 51 1 2 1 1 4 TYR HB3 . 4 TYR HB3 1 1 52 1 1 1 1 4 TYR HA . 4 TYR HA 1 1 52 1 2 1 1 4 TYR HD1 . 4 TYR HD2 1 1 53 1 1 1 1 4 TYR HA . 4 TYR HA 1 1 53 1 2 1 1 5 ASN H . 5 ASN H 1 1 54 1 1 1 1 4 TYR HA . 4 TYR HA 1 1 54 1 2 1 1 20 LYS QB . 20 LYS QB 1 1 55 1 1 1 1 4 TYR HA . 4 TYR HA 1 1 55 1 2 1 1 20 LYS QD . 20 LYS QD 1 1 56 1 1 1 1 4 TYR HA . 4 TYR HA 1 1 56 1 2 1 1 20 LYS QG . 20 LYS QG 1 1 57 1 1 1 1 4 TYR HB2 . 4 TYR HB2 1 1 57 1 2 1 1 5 ASN H . 5 ASN H 1 1 58 1 1 1 1 4 TYR HB2 . 4 TYR HB2 1 1 58 1 2 1 1 20 LYS H . 20 LYS H 1 1 59 1 1 1 1 4 TYR HB2 . 4 TYR HB2 1 1 59 1 2 1 1 20 LYS HA . 20 LYS HA 1 1 60 1 1 1 1 4 TYR HB3 . 4 TYR HB3 1 1 60 1 2 1 1 4 TYR HD1 . 4 TYR HD2 1 1 61 1 1 1 1 4 TYR HB3 . 4 TYR HB3 1 1 61 1 2 1 1 5 ASN H . 5 ASN H 1 1 62 1 1 1 1 4 TYR HB3 . 4 TYR HB3 1 1 62 1 2 1 1 18 ALA HA . 18 ALA HA 1 1 63 1 1 1 1 4 TYR HB3 . 4 TYR HB3 1 1 63 1 2 1 1 20 LYS HA . 20 LYS HA 1 1 64 1 1 1 1 4 TYR QD . 4 TYR QD 1 1 64 1 2 1 1 5 ASN HB2 . 5 ASN HB2 1 1 65 1 1 1 1 4 TYR QD . 4 TYR QD 1 1 65 1 2 1 1 5 ASN HB3 . 5 ASN HB3 1 1 66 1 1 1 1 4 TYR HD1 . 4 TYR HD2 1 1 66 1 2 1 1 5 ASN HA . 5 ASN HA 1 1 67 1 1 1 1 4 TYR HD1 . 4 TYR HD2 1 1 67 1 2 1 1 5 ASN HB2 . 5 ASN HB2 1 1 68 1 1 1 1 4 TYR HD1 . 4 TYR HD2 1 1 68 1 2 1 1 5 ASN HB3 . 5 ASN HB3 1 1 69 1 1 1 1 4 TYR HD1 . 4 TYR HD2 1 1 69 1 2 1 1 16 CYS HB3 . 16 CYS HB3 1 1 70 1 1 1 1 4 TYR HD1 . 4 TYR HD2 1 1 70 1 2 1 1 17 ARG H . 17 ARG H 1 1 71 1 1 1 1 4 TYR HE2 . 4 TYR HE1 1 1 71 1 2 1 1 17 ARG QD . 17 ARG QD 1 1 72 1 1 1 1 4 TYR HE2 . 4 TYR HE1 1 1 72 1 2 1 1 23 PHE HA . 23 PHE HA 1 1 73 1 1 1 1 4 TYR HE2 . 4 TYR HE1 1 1 73 1 2 1 1 23 PHE HB2 . 23 PHE HB2 1 1 74 1 1 1 1 4 TYR HE2 . 4 TYR HE1 1 1 74 1 2 1 1 23 PHE HB3 . 23 PHE HB3 1 1 75 1 1 1 1 5 ASN H . 5 ASN H 1 1 75 1 2 1 1 5 ASN HB2 . 5 ASN HB2 1 1 76 1 1 1 1 5 ASN H . 5 ASN H 1 1 76 1 2 1 1 5 ASN HB3 . 5 ASN HB3 1 1 77 1 1 1 1 5 ASN H . 5 ASN H 1 1 77 1 2 1 1 6 CYS H . 6 CYS H 1 1 78 1 1 1 1 5 ASN HA . 5 ASN HA 1 1 78 1 2 1 1 5 ASN HB2 . 5 ASN HB2 1 1 79 1 1 1 1 6 CYS H . 6 CYS H 1 1 79 1 2 1 1 6 CYS HA . 6 CYS HA 1 1 80 1 1 1 1 6 CYS H . 6 CYS H 1 1 80 1 2 1 1 6 CYS HB2 . 6 CYS HB2 1 1 81 1 1 1 1 6 CYS H . 6 CYS H 1 1 81 1 2 1 1 6 CYS HB3 . 6 CYS HB3 1 1 82 1 1 1 1 6 CYS H . 6 CYS H 1 1 82 1 2 1 1 7 GLY H . 7 GLY H 1 1 83 1 1 1 1 6 CYS H . 6 CYS H 1 1 83 1 2 1 1 8 LYS H . 8 LYS H 1 1 84 1 1 1 1 6 CYS HA . 6 CYS HA 1 1 84 1 2 1 1 6 CYS HB3 . 6 CYS HB3 1 1 85 1 1 1 1 6 CYS HA . 6 CYS HA 1 1 85 1 2 1 1 7 GLY HA2 . 7 GLY HA3 1 1 86 1 1 1 1 6 CYS HB2 . 6 CYS HB2 1 1 86 1 2 1 1 7 GLY H . 7 GLY H 1 1 87 1 1 1 1 6 CYS HB2 . 6 CYS HB2 1 1 87 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1 88 1 1 1 1 6 CYS HB3 . 6 CYS HB3 1 1 88 1 2 1 1 7 GLY H . 7 GLY H 1 1 89 1 1 1 1 6 CYS HB3 . 6 CYS HB3 1 1 89 1 2 1 1 11 HIS HE1 . 11 HIS HE1 1 1 90 1 1 1 1 7 GLY H . 7 GLY H 1 1 90 1 2 1 1 7 GLY HA2 . 7 GLY HA3 1 1 91 1 1 1 1 7 GLY H . 7 GLY H 1 1 91 1 2 1 1 7 GLY HA3 . 7 GLY HA2 1 1 92 1 1 1 1 7 GLY H . 7 GLY H 1 1 92 1 2 1 1 8 LYS H . 8 LYS H 1 1 93 1 1 1 1 7 GLY HA2 . 7 GLY HA3 1 1 93 1 2 1 1 8 LYS H . 8 LYS H 1 1 94 1 1 1 1 7 GLY HA3 . 7 GLY HA2 1 1 94 1 2 1 1 8 LYS H . 8 LYS H 1 1 95 1 1 1 1 8 LYS H . 8 LYS H 1 1 95 1 2 1 1 8 LYS HB2 . 8 LYS HB2 1 1 96 1 1 1 1 8 LYS H . 8 LYS H 1 1 96 1 2 1 1 8 LYS HB3 . 8 LYS HB3 1 1 97 1 1 1 1 8 LYS H . 8 LYS H 1 1 97 1 2 1 1 8 LYS HG3 . 8 LYS HG3 1 1 98 1 1 1 1 8 LYS H . 8 LYS H 1 1 98 1 2 1 1 9 PRO HD2 . 9 PRO HD2 1 1 99 1 1 1 1 8 LYS H . 8 LYS H 1 1 99 1 2 1 1 9 PRO HD3 . 9 PRO HD3 1 1 100 1 1 1 1 8 LYS H . 8 LYS H 1 1 100 1 2 1 1 11 HIS HE1 . 11 HIS HE1 1 1 101 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 101 1 2 1 1 8 LYS QD . 8 LYS QD 1 1 102 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 102 1 2 1 1 8 LYS HG3 . 8 LYS HG3 1 1 103 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 103 1 2 1 1 8 LYS QZ . 8 LYS QZ 1 1 104 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 104 1 2 1 1 9 PRO HD2 . 9 PRO HD2 1 1 105 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 105 1 2 1 1 9 PRO HD3 . 9 PRO HD3 1 1 106 1 1 1 1 8 LYS HB2 . 8 LYS HB2 1 1 106 1 2 1 1 8 LYS QE . 8 LYS QE 1 1 107 1 1 1 1 8 LYS HB2 . 8 LYS HB2 1 1 107 1 2 1 1 11 HIS HE1 . 11 HIS HE1 1 1 108 1 1 1 1 8 LYS HB3 . 8 LYS HB3 1 1 108 1 2 1 1 8 LYS QE . 8 LYS QE 1 1 109 1 1 1 1 8 LYS HB3 . 8 LYS HB3 1 1 109 1 2 1 1 10 GLY H . 10 GLY H 1 1 110 1 1 1 1 8 LYS HB3 . 8 LYS HB3 1 1 110 1 2 1 1 11 HIS HB2 . 11 HIS HB2 1 1 111 1 1 1 1 8 LYS HB3 . 8 LYS HB3 1 1 111 1 2 1 1 11 HIS HE1 . 11 HIS HE1 1 1 112 1 1 1 1 8 LYS QE . 8 LYS QE 1 1 112 1 2 1 1 9 PRO HD2 . 9 PRO HD2 1 1 113 1 1 1 1 8 LYS HG3 . 8 LYS HG3 1 1 113 1 2 1 1 11 HIS HE1 . 11 HIS HE1 1 1 114 1 1 1 1 9 PRO HA . 9 PRO HA 1 1 114 1 2 1 1 9 PRO HB3 . 9 PRO HB2 1 1 115 1 1 1 1 9 PRO HA . 9 PRO HA 1 1 115 1 2 1 1 9 PRO HD2 . 9 PRO HD2 1 1 116 1 1 1 1 9 PRO HA . 9 PRO HA 1 1 116 1 2 1 1 9 PRO HD3 . 9 PRO HD3 1 1 117 1 1 1 1 9 PRO HA . 9 PRO HA 1 1 117 1 2 1 1 10 GLY H . 10 GLY H 1 1 118 1 1 1 1 9 PRO HA . 9 PRO HA 1 1 118 1 2 1 1 11 HIS H . 11 HIS H 1 1 119 1 1 1 1 9 PRO HB2 . 9 PRO HB3 1 1 119 1 2 1 1 9 PRO HD2 . 9 PRO HD2 1 1 120 1 1 1 1 9 PRO HB2 . 9 PRO HB3 1 1 120 1 2 1 1 9 PRO HD3 . 9 PRO HD3 1 1 121 1 1 1 1 9 PRO HB2 . 9 PRO HB3 1 1 121 1 2 1 1 10 GLY H . 10 GLY H 1 1 122 1 1 1 1 9 PRO HB2 . 9 PRO HB3 1 1 122 1 2 1 1 11 HIS H . 11 HIS H 1 1 123 1 1 1 1 9 PRO HB3 . 9 PRO HB2 1 1 123 1 2 1 1 9 PRO HD2 . 9 PRO HD2 1 1 124 1 1 1 1 9 PRO HB3 . 9 PRO HB2 1 1 124 1 2 1 1 9 PRO HD3 . 9 PRO HD3 1 1 125 1 1 1 1 9 PRO HB3 . 9 PRO HB2 1 1 125 1 2 1 1 10 GLY H . 10 GLY H 1 1 126 1 1 1 1 9 PRO HD2 . 9 PRO HD2 1 1 126 1 2 1 1 9 PRO QG . 9 PRO QG 1 1 127 1 1 1 1 9 PRO HD3 . 9 PRO HD3 1 1 127 1 2 1 1 9 PRO QG . 9 PRO QG 1 1 128 1 1 1 1 9 PRO QG . 9 PRO QG 1 1 128 1 2 1 1 10 GLY H . 10 GLY H 1 1 129 1 1 1 1 10 GLY H . 10 GLY H 1 1 129 1 2 1 1 10 GLY HA3 . 10 GLY HA2 1 1 130 1 1 1 1 10 GLY H . 10 GLY H 1 1 130 1 2 1 1 11 HIS H . 11 HIS H 1 1 131 1 1 1 1 10 GLY H . 10 GLY H 1 1 131 1 2 1 1 11 HIS HB2 . 11 HIS HB2 1 1 132 1 1 1 1 10 GLY HA2 . 10 GLY HA3 1 1 132 1 2 1 1 11 HIS H . 11 HIS H 1 1 133 1 1 1 1 10 GLY HA2 . 10 GLY HA3 1 1 133 1 2 1 1 15 GLN QE . 15 GLN HE21 1 1 134 1 1 1 1 10 GLY HA3 . 10 GLY HA2 1 1 134 1 2 1 1 11 HIS H . 11 HIS H 1 1 135 1 1 1 1 11 HIS H . 11 HIS H 1 1 135 1 2 1 1 11 HIS HB2 . 11 HIS HB2 1 1 136 1 1 1 1 11 HIS H . 11 HIS H 1 1 136 1 2 1 1 11 HIS HB3 . 11 HIS HB3 1 1 137 1 1 1 1 11 HIS H . 11 HIS H 1 1 137 1 2 1 1 12 LEU H . 12 LEU H 1 1 138 1 1 1 1 11 HIS H . 11 HIS H 1 1 138 1 2 1 1 12 LEU HG . 12 LEU HG 1 1 139 1 1 1 1 11 HIS HA . 11 HIS HA 1 1 139 1 2 1 1 11 HIS HB3 . 11 HIS HB3 1 1 140 1 1 1 1 11 HIS HA . 11 HIS HA 1 1 140 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1 141 1 1 1 1 11 HIS HA . 11 HIS HA 1 1 141 1 2 1 1 12 LEU H . 12 LEU H 1 1 142 1 1 1 1 11 HIS HA . 11 HIS HA 1 1 142 1 2 1 1 15 GLN H . 15 GLN H 1 1 143 1 1 1 1 11 HIS HA . 11 HIS HA 1 1 143 1 2 1 1 15 GLN QE . 15 GLN HE22 1 1 144 1 1 1 1 11 HIS HB2 . 11 HIS HB2 1 1 144 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1 145 1 1 1 1 11 HIS HB2 . 11 HIS HB2 1 1 145 1 2 1 1 11 HIS HE1 . 11 HIS HE1 1 1 146 1 1 1 1 11 HIS HB2 . 11 HIS HB2 1 1 146 1 2 1 1 12 LEU H . 12 LEU H 1 1 147 1 1 1 1 11 HIS HB2 . 11 HIS HB2 1 1 147 1 2 1 1 15 GLN HB3 . 15 GLN HB3 1 1 148 1 1 1 1 11 HIS HB2 . 11 HIS HB2 1 1 148 1 2 1 1 19 PRO HB3 . 19 PRO HB2 1 1 149 1 1 1 1 11 HIS HB3 . 11 HIS HB3 1 1 149 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1 150 1 1 1 1 11 HIS HB3 . 11 HIS HB3 1 1 150 1 2 1 1 12 LEU H . 12 LEU H 1 1 151 1 1 1 1 11 HIS HB3 . 11 HIS HB3 1 1 151 1 2 1 1 19 PRO HB3 . 19 PRO HB2 1 1 152 1 1 1 1 11 HIS HD2 . 11 HIS HD2 1 1 152 1 2 1 1 12 LEU H . 12 LEU H 1 1 153 1 1 1 1 11 HIS HD2 . 11 HIS HD2 1 1 153 1 2 1 1 15 GLN HB2 . 15 GLN HB2 1 1 154 1 1 1 1 11 HIS HD2 . 11 HIS HD2 1 1 154 1 2 1 1 15 GLN HB3 . 15 GLN HB3 1 1 155 1 1 1 1 11 HIS HD2 . 11 HIS HD2 1 1 155 1 2 1 1 15 GLN QG . 15 GLN QG 1 1 156 1 1 1 1 11 HIS HD2 . 11 HIS HD2 1 1 156 1 2 1 1 16 CYS HA . 16 CYS HA 1 1 157 1 1 1 1 11 HIS HD2 . 11 HIS HD2 1 1 157 1 2 1 1 16 CYS HB2 . 16 CYS HB2 1 1 158 1 1 1 1 12 LEU H . 12 LEU H 1 1 158 1 2 1 1 12 LEU HB2 . 12 LEU HB2 1 1 159 1 1 1 1 12 LEU H . 12 LEU H 1 1 159 1 2 1 1 12 LEU QB . 12 LEU QB 1 1 160 1 1 1 1 12 LEU H . 12 LEU H 1 1 160 1 2 1 1 12 LEU HB3 . 12 LEU HB3 1 1 161 1 1 1 1 12 LEU H . 12 LEU H 1 1 161 1 2 1 1 12 LEU QD . 12 LEU QQD 1 1 162 1 1 1 1 12 LEU H . 12 LEU H 1 1 162 1 2 1 1 12 LEU HG . 12 LEU HG 1 1 163 1 1 1 1 12 LEU H . 12 LEU H 1 1 163 1 2 1 1 13 SER H . 13 SER H 1 1 164 1 1 1 1 12 LEU H . 12 LEU H 1 1 164 1 2 1 1 15 GLN H . 15 GLN H 1 1 165 1 1 1 1 12 LEU H . 12 LEU H 1 1 165 1 2 1 1 15 GLN QE . 15 GLN HE22 1 1 166 1 1 1 1 12 LEU H . 12 LEU H 1 1 166 1 2 1 1 16 CYS H . 16 CYS H 1 1 167 1 1 1 1 12 LEU HA . 12 LEU HA 1 1 167 1 2 1 1 12 LEU HB3 . 12 LEU HB3 1 1 168 1 1 1 1 12 LEU HA . 12 LEU HA 1 1 168 1 2 1 1 12 LEU QD . 12 LEU QQD 1 1 169 1 1 1 1 12 LEU HA . 12 LEU HA 1 1 169 1 2 1 1 12 LEU HG . 12 LEU HG 1 1 170 1 1 1 1 12 LEU HA . 12 LEU HA 1 1 170 1 2 1 1 13 SER H . 13 SER H 1 1 171 1 1 1 1 12 LEU HA . 12 LEU HA 1 1 171 1 2 1 1 15 GLN H . 15 GLN H 1 1 172 1 1 1 1 12 LEU QB . 12 LEU QB 1 1 172 1 2 1 1 12 LEU QD . 12 LEU QQD 1 1 173 1 1 1 1 12 LEU QB . 12 LEU QB 1 1 173 1 2 1 1 15 GLN H . 15 GLN H 1 1 174 1 1 1 1 12 LEU HB2 . 12 LEU HB2 1 1 174 1 2 1 1 13 SER H . 13 SER H 1 1 175 1 1 1 1 12 LEU HB2 . 12 LEU HB2 1 1 175 1 2 1 1 14 SER H . 14 SER H 1 1 176 1 1 1 1 12 LEU HB2 . 12 LEU HB2 1 1 176 1 2 1 1 15 GLN H . 15 GLN H 1 1 177 1 1 1 1 12 LEU HB2 . 12 LEU HB2 1 1 177 1 2 1 1 15 GLN HA . 15 GLN HA 1 1 178 1 1 1 1 12 LEU HB2 . 12 LEU HB2 1 1 178 1 2 1 1 15 GLN HB2 . 15 GLN HB2 1 1 179 1 1 1 1 12 LEU HB2 . 12 LEU HB2 1 1 179 1 2 1 1 15 GLN HB3 . 15 GLN HB3 1 1 180 1 1 1 1 12 LEU HB3 . 12 LEU HB3 1 1 180 1 2 1 1 12 LEU QD . 12 LEU QQD 1 1 181 1 1 1 1 12 LEU HB3 . 12 LEU HB3 1 1 181 1 2 1 1 13 SER H . 13 SER H 1 1 182 1 1 1 1 12 LEU HB3 . 12 LEU HB3 1 1 182 1 2 1 1 15 GLN H . 15 GLN H 1 1 183 1 1 1 1 12 LEU HB3 . 12 LEU HB3 1 1 183 1 2 1 1 15 GLN HB2 . 15 GLN HB2 1 1 184 1 1 1 1 12 LEU HB3 . 12 LEU HB3 1 1 184 1 2 1 1 15 GLN HB3 . 15 GLN HB3 1 1 185 1 1 1 1 12 LEU QD . 12 LEU QQD 1 1 185 1 2 1 1 12 LEU HG . 12 LEU HG 1 1 186 1 1 1 1 12 LEU QD . 12 LEU QQD 1 1 186 1 2 1 1 13 SER H . 13 SER H 1 1 187 1 1 1 1 12 LEU HG . 12 LEU HG 1 1 187 1 2 1 1 13 SER H . 13 SER H 1 1 188 1 1 1 1 12 LEU HG . 12 LEU HG 1 1 188 1 2 1 1 15 GLN HB2 . 15 GLN HB2 1 1 189 1 1 1 1 12 LEU HG . 12 LEU HG 1 1 189 1 2 1 1 15 GLN HB3 . 15 GLN HB3 1 1 190 1 1 1 1 13 SER H . 13 SER H 1 1 190 1 2 1 1 13 SER HA . 13 SER HA 1 1 191 1 1 1 1 13 SER H . 13 SER H 1 1 191 1 2 1 1 13 SER QB . 13 SER QB 1 1 192 1 1 1 1 13 SER H . 13 SER H 1 1 192 1 2 1 1 14 SER H . 14 SER H 1 1 193 1 1 1 1 13 SER HA . 13 SER HA 1 1 193 1 2 1 1 14 SER H . 14 SER H 1 1 194 1 1 1 1 13 SER HA . 13 SER HA 1 1 194 1 2 1 1 14 SER HA . 14 SER HA 1 1 195 1 1 1 1 13 SER HA . 13 SER HA 1 1 195 1 2 1 1 17 ARG HA . 17 ARG HA 1 1 196 1 1 1 1 13 SER QB . 13 SER QB 1 1 196 1 2 1 1 14 SER H . 14 SER H 1 1 197 1 1 1 1 14 SER H . 14 SER H 1 1 197 1 2 1 1 14 SER QB . 14 SER QB 1 1 198 1 1 1 1 14 SER H . 14 SER H 1 1 198 1 2 1 1 15 GLN H . 15 GLN H 1 1 199 1 1 1 1 14 SER H . 14 SER H 1 1 199 1 2 1 1 15 GLN HB2 . 15 GLN HB2 1 1 200 1 1 1 1 14 SER H . 14 SER H 1 1 200 1 2 1 1 15 GLN HB3 . 15 GLN HB3 1 1 201 1 1 1 1 14 SER H . 14 SER H 1 1 201 1 2 1 1 16 CYS H . 16 CYS H 1 1 202 1 1 1 1 14 SER HA . 14 SER HA 1 1 202 1 2 1 1 15 GLN H . 15 GLN H 1 1 203 1 1 1 1 14 SER HA . 14 SER HA 1 1 203 1 2 1 1 16 CYS H . 16 CYS H 1 1 204 1 1 1 1 14 SER QB . 14 SER QB 1 1 204 1 2 1 1 15 GLN H . 15 GLN H 1 1 205 1 1 1 1 14 SER HB2 . 14 SER HB2 1 1 205 1 2 1 1 15 GLN H . 15 GLN H 1 1 206 1 1 1 1 14 SER HB3 . 14 SER HB3 1 1 206 1 2 1 1 15 GLN H . 15 GLN H 1 1 207 1 1 1 1 15 GLN H . 15 GLN H 1 1 207 1 2 1 1 15 GLN HB2 . 15 GLN HB2 1 1 208 1 1 1 1 15 GLN H . 15 GLN H 1 1 208 1 2 1 1 15 GLN HB3 . 15 GLN HB3 1 1 209 1 1 1 1 15 GLN H . 15 GLN H 1 1 209 1 2 1 1 16 CYS H . 16 CYS H 1 1 210 1 1 1 1 15 GLN H . 15 GLN H 1 1 210 1 2 1 1 16 CYS HB2 . 16 CYS HB2 1 1 211 1 1 1 1 15 GLN HA . 15 GLN HA 1 1 211 1 2 1 1 15 GLN HB2 . 15 GLN HB2 1 1 212 1 1 1 1 15 GLN HA . 15 GLN HA 1 1 212 1 2 1 1 15 GLN QE . 15 GLN HE21 1 1 213 1 1 1 1 15 GLN HA . 15 GLN HA 1 1 213 1 2 1 1 16 CYS H . 16 CYS H 1 1 214 1 1 1 1 15 GLN HB2 . 15 GLN HB2 1 1 214 1 2 1 1 16 CYS H . 16 CYS H 1 1 215 1 1 1 1 15 GLN HB3 . 15 GLN HB3 1 1 215 1 2 1 1 16 CYS H . 16 CYS H 1 1 216 1 1 1 1 15 GLN HB3 . 15 GLN HB3 1 1 216 1 2 1 1 16 CYS HB2 . 16 CYS HB2 1 1 217 1 1 1 1 15 GLN QG . 15 GLN QG 1 1 217 1 2 1 1 16 CYS H . 16 CYS H 1 1 218 1 1 1 1 16 CYS H . 16 CYS H 1 1 218 1 2 1 1 16 CYS HB2 . 16 CYS HB2 1 1 219 1 1 1 1 16 CYS H . 16 CYS H 1 1 219 1 2 1 1 16 CYS HB3 . 16 CYS HB3 1 1 220 1 1 1 1 16 CYS H . 16 CYS H 1 1 220 1 2 1 1 17 ARG H . 17 ARG H 1 1 221 1 1 1 1 16 CYS HA . 16 CYS HA 1 1 221 1 2 1 1 16 CYS HB3 . 16 CYS HB3 1 1 222 1 1 1 1 16 CYS HA . 16 CYS HA 1 1 222 1 2 1 1 17 ARG H . 17 ARG H 1 1 223 1 1 1 1 16 CYS HA . 16 CYS HA 1 1 223 1 2 1 1 17 ARG HE . 17 ARG HE 1 1 224 1 1 1 1 16 CYS HA . 16 CYS HA 1 1 224 1 2 1 1 18 ALA H . 18 ALA H 1 1 225 1 1 1 1 16 CYS HB2 . 16 CYS HB2 1 1 225 1 2 1 1 17 ARG H . 17 ARG H 1 1 226 1 1 1 1 16 CYS HB2 . 16 CYS HB2 1 1 226 1 2 1 1 18 ALA H . 18 ALA H 1 1 227 1 1 1 1 16 CYS HB2 . 16 CYS HB2 1 1 227 1 2 1 1 19 PRO HA . 19 PRO HA 1 1 228 1 1 1 1 16 CYS HB3 . 16 CYS HB3 1 1 228 1 2 1 1 17 ARG H . 17 ARG H 1 1 229 1 1 1 1 16 CYS HB3 . 16 CYS HB3 1 1 229 1 2 1 1 17 ARG HA . 17 ARG HA 1 1 230 1 1 1 1 17 ARG H . 17 ARG H 1 1 230 1 2 1 1 17 ARG QB . 17 ARG QB 1 1 231 1 1 1 1 17 ARG H . 17 ARG H 1 1 231 1 2 1 1 17 ARG QD . 17 ARG QD 1 1 232 1 1 1 1 17 ARG H . 17 ARG H 1 1 232 1 2 1 1 17 ARG QG . 17 ARG QG 1 1 233 1 1 1 1 17 ARG H . 17 ARG H 1 1 233 1 2 1 1 18 ALA H . 18 ALA H 1 1 234 1 1 1 1 17 ARG HA . 17 ARG HA 1 1 234 1 2 1 1 17 ARG QD . 17 ARG QD 1 1 235 1 1 1 1 17 ARG HA . 17 ARG HA 1 1 235 1 2 1 1 17 ARG QG . 17 ARG QG 1 1 236 1 1 1 1 17 ARG HA . 17 ARG HA 1 1 236 1 2 1 1 18 ALA H . 18 ALA H 1 1 237 1 1 1 1 18 ALA H . 18 ALA H 1 1 237 1 2 1 1 18 ALA MB . 18 ALA QB 1 1 238 1 1 1 1 18 ALA H . 18 ALA H 1 1 238 1 2 1 1 19 PRO HD2 . 19 PRO HD2 1 1 239 1 1 1 1 18 ALA H . 18 ALA H 1 1 239 1 2 1 1 19 PRO HD3 . 19 PRO HD3 1 1 240 1 1 1 1 18 ALA HA . 18 ALA HA 1 1 240 1 2 1 1 19 PRO HD2 . 19 PRO HD2 1 1 241 1 1 1 1 18 ALA HA . 18 ALA HA 1 1 241 1 2 1 1 19 PRO HD3 . 19 PRO HD3 1 1 242 1 1 1 1 18 ALA MB . 18 ALA QB 1 1 242 1 2 1 1 19 PRO HD2 . 19 PRO HD2 1 1 243 1 1 1 1 18 ALA MB . 18 ALA QB 1 1 243 1 2 1 1 19 PRO HD3 . 19 PRO HD3 1 1 244 1 1 1 1 18 ALA MB . 18 ALA QB 1 1 244 1 2 1 1 22 CYS H . 22 CYS H 1 1 245 1 1 1 1 18 ALA MB . 18 ALA QB 1 1 245 1 2 1 1 23 PHE HA . 23 PHE HA 1 1 246 1 1 1 1 18 ALA MB . 18 ALA QB 1 1 246 1 2 1 1 24 LYS HA . 24 LYS HA 1 1 247 1 1 1 1 19 PRO HA . 19 PRO HA 1 1 247 1 2 1 1 19 PRO HB3 . 19 PRO HB2 1 1 248 1 1 1 1 19 PRO HA . 19 PRO HA 1 1 248 1 2 1 1 19 PRO HD2 . 19 PRO HD2 1 1 249 1 1 1 1 19 PRO HA . 19 PRO HA 1 1 249 1 2 1 1 19 PRO HD3 . 19 PRO HD3 1 1 250 1 1 1 1 19 PRO HA . 19 PRO HA 1 1 250 1 2 1 1 20 LYS H . 20 LYS H 1 1 251 1 1 1 1 19 PRO HA . 19 PRO HA 1 1 251 1 2 1 1 21 VAL H . 21 VAL H 1 1 252 1 1 1 1 19 PRO HB2 . 19 PRO HB3 1 1 252 1 2 1 1 19 PRO HD2 . 19 PRO HD2 1 1 253 1 1 1 1 19 PRO HB2 . 19 PRO HB3 1 1 253 1 2 1 1 19 PRO HD3 . 19 PRO HD3 1 1 254 1 1 1 1 19 PRO HB2 . 19 PRO HB3 1 1 254 1 2 1 1 20 LYS H . 20 LYS H 1 1 255 1 1 1 1 19 PRO HB2 . 19 PRO HB3 1 1 255 1 2 1 1 21 VAL H . 21 VAL H 1 1 256 1 1 1 1 19 PRO HB2 . 19 PRO HB3 1 1 256 1 2 1 1 21 VAL MG2 . 21 VAL QG2 1 1 257 1 1 1 1 19 PRO HB3 . 19 PRO HB2 1 1 257 1 2 1 1 19 PRO HD2 . 19 PRO HD2 1 1 258 1 1 1 1 19 PRO HB3 . 19 PRO HB2 1 1 258 1 2 1 1 19 PRO HD3 . 19 PRO HD3 1 1 259 1 1 1 1 19 PRO HB3 . 19 PRO HB2 1 1 259 1 2 1 1 20 LYS H . 20 LYS H 1 1 260 1 1 1 1 19 PRO HB3 . 19 PRO HB2 1 1 260 1 2 1 1 21 VAL H . 21 VAL H 1 1 261 1 1 1 1 19 PRO HD2 . 19 PRO HD2 1 1 261 1 2 1 1 19 PRO QG . 19 PRO QG 1 1 262 1 1 1 1 19 PRO HD2 . 19 PRO HD2 1 1 262 1 2 1 1 26 LYS QD . 26 LYS QD 1 1 263 1 1 1 1 19 PRO HD3 . 19 PRO HD3 1 1 263 1 2 1 1 19 PRO QG . 19 PRO QG 1 1 264 1 1 1 1 19 PRO QG . 19 PRO QG 1 1 264 1 2 1 1 20 LYS H . 20 LYS H 1 1 265 1 1 1 1 19 PRO QG . 19 PRO QG 1 1 265 1 2 1 1 21 VAL HB . 21 VAL HB 1 1 266 1 1 1 1 19 PRO QG . 19 PRO QG 1 1 266 1 2 1 1 21 VAL MG2 . 21 VAL QG2 1 1 267 1 1 1 1 20 LYS H . 20 LYS H 1 1 267 1 2 1 1 20 LYS HA . 20 LYS HA 1 1 268 1 1 1 1 20 LYS H . 20 LYS H 1 1 268 1 2 1 1 20 LYS QB . 20 LYS QB 1 1 269 1 1 1 1 20 LYS H . 20 LYS H 1 1 269 1 2 1 1 20 LYS QD . 20 LYS QD 1 1 270 1 1 1 1 20 LYS H . 20 LYS H 1 1 270 1 2 1 1 20 LYS QG . 20 LYS QG 1 1 271 1 1 1 1 20 LYS H . 20 LYS H 1 1 271 1 2 1 1 21 VAL H . 21 VAL H 1 1 272 1 1 1 1 20 LYS H . 20 LYS H 1 1 272 1 2 1 1 22 CYS H . 22 CYS H 1 1 273 1 1 1 1 20 LYS HA . 20 LYS HA 1 1 273 1 2 1 1 20 LYS QD . 20 LYS QD 1 1 274 1 1 1 1 20 LYS HA . 20 LYS HA 1 1 274 1 2 1 1 21 VAL H . 21 VAL H 1 1 275 1 1 1 1 20 LYS QB . 20 LYS QB 1 1 275 1 2 1 1 20 LYS QD . 20 LYS QD 1 1 276 1 1 1 1 20 LYS QB . 20 LYS QB 1 1 276 1 2 1 1 21 VAL H . 21 VAL H 1 1 277 1 1 1 1 20 LYS QE . 20 LYS QE 1 1 277 1 2 1 1 20 LYS QG . 20 LYS QG 1 1 278 1 1 1 1 21 VAL H . 21 VAL H 1 1 278 1 2 1 1 21 VAL HA . 21 VAL HA 1 1 279 1 1 1 1 21 VAL H . 21 VAL H 1 1 279 1 2 1 1 21 VAL HB . 21 VAL HB 1 1 280 1 1 1 1 21 VAL H . 21 VAL H 1 1 280 1 2 1 1 21 VAL MG1 . 21 VAL QG1 1 1 281 1 1 1 1 21 VAL H . 21 VAL H 1 1 281 1 2 1 1 21 VAL MG2 . 21 VAL QG2 1 1 282 1 1 1 1 21 VAL H . 21 VAL H 1 1 282 1 2 1 1 22 CYS H . 22 CYS H 1 1 283 1 1 1 1 21 VAL HA . 21 VAL HA 1 1 283 1 2 1 1 21 VAL MG1 . 21 VAL QG1 1 1 284 1 1 1 1 21 VAL HA . 21 VAL HA 1 1 284 1 2 1 1 21 VAL MG2 . 21 VAL QG2 1 1 285 1 1 1 1 21 VAL HA . 21 VAL HA 1 1 285 1 2 1 1 22 CYS H . 22 CYS H 1 1 286 1 1 1 1 21 VAL HA . 21 VAL HA 1 1 286 1 2 1 1 31 PHE QD . 31 PHE QD 1 1 287 1 1 1 1 21 VAL HB . 21 VAL HB 1 1 287 1 2 1 1 22 CYS H . 22 CYS H 1 1 288 1 1 1 1 21 VAL HB . 21 VAL HB 1 1 288 1 2 1 1 22 CYS HB2 . 22 CYS HB2 1 1 289 1 1 1 1 21 VAL HB . 21 VAL HB 1 1 289 1 2 1 1 22 CYS HB3 . 22 CYS HB3 1 1 290 1 1 1 1 21 VAL HB . 21 VAL HB 1 1 290 1 2 1 1 26 LYS HB2 . 26 LYS HB2 1 1 291 1 1 1 1 21 VAL HB . 21 VAL HB 1 1 291 1 2 1 1 26 LYS HB3 . 26 LYS HB3 1 1 292 1 1 1 1 21 VAL HB . 21 VAL HB 1 1 292 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 293 1 1 1 1 21 VAL HB . 21 VAL HB 1 1 293 1 2 1 1 31 PHE HB3 . 31 PHE HB3 1 1 294 1 1 1 1 21 VAL MG1 . 21 VAL QG1 1 1 294 1 2 1 1 22 CYS H . 22 CYS H 1 1 295 1 1 1 1 21 VAL MG1 . 21 VAL QG1 1 1 295 1 2 1 1 26 LYS HA . 26 LYS HA 1 1 296 1 1 1 1 21 VAL MG1 . 21 VAL QG1 1 1 296 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 297 1 1 1 1 21 VAL MG1 . 21 VAL QG1 1 1 297 1 2 1 1 31 PHE QD . 31 PHE QD 1 1 298 1 1 1 1 21 VAL MG1 . 21 VAL QG1 1 1 298 1 2 1 1 31 PHE QE . 31 PHE QE 1 1 299 1 1 1 1 21 VAL MG2 . 21 VAL QG2 1 1 299 1 2 1 1 22 CYS H . 22 CYS H 1 1 300 1 1 1 1 22 CYS H . 22 CYS H 1 1 300 1 2 1 1 22 CYS HB2 . 22 CYS HB2 1 1 301 1 1 1 1 22 CYS H . 22 CYS H 1 1 301 1 2 1 1 22 CYS HB3 . 22 CYS HB3 1 1 302 1 1 1 1 22 CYS H . 22 CYS H 1 1 302 1 2 1 1 23 PHE H . 23 PHE H 1 1 303 1 1 1 1 22 CYS H . 22 CYS H 1 1 303 1 2 1 1 23 PHE HA . 23 PHE HA 1 1 304 1 1 1 1 22 CYS HA . 22 CYS HA 1 1 304 1 2 1 1 22 CYS HB2 . 22 CYS HB2 1 1 305 1 1 1 1 22 CYS HA . 22 CYS HA 1 1 305 1 2 1 1 23 PHE H . 23 PHE H 1 1 306 1 1 1 1 22 CYS HA . 22 CYS HA 1 1 306 1 2 1 1 23 PHE HA . 23 PHE HA 1 1 307 1 1 1 1 22 CYS HA . 22 CYS HA 1 1 307 1 2 1 1 23 PHE HD1 . 23 PHE HD2 1 1 308 1 1 1 1 22 CYS HA . 22 CYS HA 1 1 308 1 2 1 1 24 LYS H . 24 LYS H 1 1 309 1 1 1 1 22 CYS HA . 22 CYS HA 1 1 309 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 310 1 1 1 1 22 CYS HA . 22 CYS HA 1 1 310 1 2 1 1 35 CYS HB2 . 35 CYS HB2 1 1 311 1 1 1 1 22 CYS HA . 22 CYS HA 1 1 311 1 2 1 1 35 CYS HB3 . 35 CYS HB3 1 1 312 1 1 1 1 22 CYS HB2 . 22 CYS HB2 1 1 312 1 2 1 1 23 PHE H . 23 PHE H 1 1 313 1 1 1 1 22 CYS HB2 . 22 CYS HB2 1 1 313 1 2 1 1 26 LYS H . 26 LYS H 1 1 314 1 1 1 1 22 CYS HB2 . 22 CYS HB2 1 1 314 1 2 1 1 27 GLN H . 27 GLN H 1 1 315 1 1 1 1 22 CYS HB2 . 22 CYS HB2 1 1 315 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 316 1 1 1 1 22 CYS HB3 . 22 CYS HB3 1 1 316 1 2 1 1 23 PHE H . 23 PHE H 1 1 317 1 1 1 1 22 CYS HB3 . 22 CYS HB3 1 1 317 1 2 1 1 25 CYS H . 25 CYS H 1 1 318 1 1 1 1 22 CYS HB3 . 22 CYS HB3 1 1 318 1 2 1 1 26 LYS H . 26 LYS H 1 1 319 1 1 1 1 22 CYS HB3 . 22 CYS HB3 1 1 319 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 320 1 1 1 1 23 PHE H . 23 PHE H 1 1 320 1 2 1 1 23 PHE HB2 . 23 PHE HB2 1 1 321 1 1 1 1 23 PHE H . 23 PHE H 1 1 321 1 2 1 1 23 PHE HB3 . 23 PHE HB3 1 1 322 1 1 1 1 23 PHE H . 23 PHE H 1 1 322 1 2 1 1 23 PHE HD1 . 23 PHE HD2 1 1 323 1 1 1 1 23 PHE H . 23 PHE H 1 1 323 1 2 1 1 23 PHE QE . 23 PHE QE 1 1 324 1 1 1 1 23 PHE H . 23 PHE H 1 1 324 1 2 1 1 24 LYS H . 24 LYS H 1 1 325 1 1 1 1 23 PHE H . 23 PHE H 1 1 325 1 2 1 1 26 LYS H . 26 LYS H 1 1 326 1 1 1 1 23 PHE HA . 23 PHE HA 1 1 326 1 2 1 1 23 PHE HB2 . 23 PHE HB2 1 1 327 1 1 1 1 23 PHE HA . 23 PHE HA 1 1 327 1 2 1 1 23 PHE HB3 . 23 PHE HB3 1 1 328 1 1 1 1 23 PHE HA . 23 PHE HA 1 1 328 1 2 1 1 23 PHE QD . 23 PHE QD 1 1 329 1 1 1 1 23 PHE HA . 23 PHE HA 1 1 329 1 2 1 1 24 LYS H . 24 LYS H 1 1 330 1 1 1 1 23 PHE HA . 23 PHE HA 1 1 330 1 2 1 1 24 LYS HA . 24 LYS HA 1 1 331 1 1 1 1 23 PHE HB2 . 23 PHE HB2 1 1 331 1 2 1 1 23 PHE QE . 23 PHE QE 1 1 332 1 1 1 1 23 PHE HB3 . 23 PHE HB3 1 1 332 1 2 1 1 23 PHE HD1 . 23 PHE HD2 1 1 333 1 1 1 1 23 PHE HB3 . 23 PHE HB3 1 1 333 1 2 1 1 23 PHE QE . 23 PHE QE 1 1 334 1 1 1 1 23 PHE HB3 . 23 PHE HB3 1 1 334 1 2 1 1 24 LYS H . 24 LYS H 1 1 335 1 1 1 1 23 PHE HD1 . 23 PHE HD2 1 1 335 1 2 1 1 24 LYS HB2 . 24 LYS HB2 1 1 336 1 1 1 1 23 PHE QE . 23 PHE QE 1 1 336 1 2 1 1 24 LYS HB2 . 24 LYS HB2 1 1 337 1 1 1 1 23 PHE QE . 23 PHE QE 1 1 337 1 2 1 1 24 LYS HB3 . 24 LYS HB3 1 1 338 1 1 1 1 24 LYS H . 24 LYS H 1 1 338 1 2 1 1 24 LYS HB2 . 24 LYS HB2 1 1 339 1 1 1 1 24 LYS H . 24 LYS H 1 1 339 1 2 1 1 24 LYS HB3 . 24 LYS HB3 1 1 340 1 1 1 1 24 LYS H . 24 LYS H 1 1 340 1 2 1 1 24 LYS QG . 24 LYS QG 1 1 341 1 1 1 1 24 LYS H . 24 LYS H 1 1 341 1 2 1 1 25 CYS H . 25 CYS H 1 1 342 1 1 1 1 24 LYS H . 24 LYS H 1 1 342 1 2 1 1 26 LYS H . 26 LYS H 1 1 343 1 1 1 1 24 LYS H . 24 LYS H 1 1 343 1 2 1 1 26 LYS HA . 26 LYS HA 1 1 344 1 1 1 1 24 LYS H . 24 LYS H 1 1 344 1 2 1 1 26 LYS HB3 . 26 LYS HB3 1 1 345 1 1 1 1 24 LYS HA . 24 LYS HA 1 1 345 1 2 1 1 24 LYS QD . 24 LYS QD 1 1 346 1 1 1 1 24 LYS HA . 24 LYS HA 1 1 346 1 2 1 1 24 LYS QE . 24 LYS QE 1 1 347 1 1 1 1 24 LYS HA . 24 LYS HA 1 1 347 1 2 1 1 24 LYS QG . 24 LYS QG 1 1 348 1 1 1 1 24 LYS HA . 24 LYS HA 1 1 348 1 2 1 1 25 CYS H . 25 CYS H 1 1 349 1 1 1 1 24 LYS HB2 . 24 LYS HB2 1 1 349 1 2 1 1 24 LYS QD . 24 LYS QD 1 1 350 1 1 1 1 24 LYS HB2 . 24 LYS HB2 1 1 350 1 2 1 1 24 LYS QE . 24 LYS QE 1 1 351 1 1 1 1 24 LYS HB2 . 24 LYS HB2 1 1 351 1 2 1 1 25 CYS H . 25 CYS H 1 1 352 1 1 1 1 24 LYS HB3 . 24 LYS HB3 1 1 352 1 2 1 1 24 LYS QD . 24 LYS QD 1 1 353 1 1 1 1 24 LYS HB3 . 24 LYS HB3 1 1 353 1 2 1 1 24 LYS QE . 24 LYS QE 1 1 354 1 1 1 1 24 LYS HB3 . 24 LYS HB3 1 1 354 1 2 1 1 25 CYS HA . 25 CYS HA 1 1 355 1 1 1 1 24 LYS HB3 . 24 LYS HB3 1 1 355 1 2 1 1 26 LYS H . 26 LYS H 1 1 356 1 1 1 1 24 LYS QD . 24 LYS QD 1 1 356 1 2 1 1 25 CYS H . 25 CYS H 1 1 357 1 1 1 1 24 LYS QG . 24 LYS QG 1 1 357 1 2 1 1 25 CYS H . 25 CYS H 1 1 358 1 1 1 1 25 CYS H . 25 CYS H 1 1 358 1 2 1 1 25 CYS HB2 . 25 CYS HB2 1 1 359 1 1 1 1 25 CYS H . 25 CYS H 1 1 359 1 2 1 1 25 CYS HB3 . 25 CYS HB3 1 1 360 1 1 1 1 25 CYS H . 25 CYS H 1 1 360 1 2 1 1 26 LYS H . 26 LYS H 1 1 361 1 1 1 1 25 CYS H . 25 CYS H 1 1 361 1 2 1 1 26 LYS HB3 . 26 LYS HB3 1 1 362 1 1 1 1 25 CYS H . 25 CYS H 1 1 362 1 2 1 1 26 LYS HG2 . 26 LYS HG2 1 1 363 1 1 1 1 25 CYS HA . 25 CYS HA 1 1 363 1 2 1 1 26 LYS H . 26 LYS H 1 1 364 1 1 1 1 25 CYS HA . 25 CYS HA 1 1 364 1 2 1 1 27 GLN H . 27 GLN H 1 1 365 1 1 1 1 25 CYS HB2 . 25 CYS HB2 1 1 365 1 2 1 1 26 LYS H . 26 LYS H 1 1 366 1 1 1 1 25 CYS HB2 . 25 CYS HB2 1 1 366 1 2 1 1 27 GLN H . 27 GLN H 1 1 367 1 1 1 1 25 CYS HB2 . 25 CYS HB2 1 1 367 1 2 1 1 27 GLN QG . 27 GLN QG 1 1 368 1 1 1 1 25 CYS HB3 . 25 CYS HB3 1 1 368 1 2 1 1 26 LYS H . 26 LYS H 1 1 369 1 1 1 1 26 LYS H . 26 LYS H 1 1 369 1 2 1 1 26 LYS HA . 26 LYS HA 1 1 370 1 1 1 1 26 LYS H . 26 LYS H 1 1 370 1 2 1 1 26 LYS HB2 . 26 LYS HB2 1 1 371 1 1 1 1 26 LYS H . 26 LYS H 1 1 371 1 2 1 1 26 LYS HB3 . 26 LYS HB3 1 1 372 1 1 1 1 26 LYS H . 26 LYS H 1 1 372 1 2 1 1 26 LYS QD . 26 LYS QD 1 1 373 1 1 1 1 26 LYS H . 26 LYS H 1 1 373 1 2 1 1 26 LYS HG2 . 26 LYS HG2 1 1 374 1 1 1 1 26 LYS H . 26 LYS H 1 1 374 1 2 1 1 27 GLN H . 27 GLN H 1 1 375 1 1 1 1 26 LYS H . 26 LYS H 1 1 375 1 2 1 1 27 GLN HE21 . 27 GLN HE22 1 1 376 1 1 1 1 26 LYS H . 26 LYS H 1 1 376 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 377 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 377 1 2 1 1 26 LYS HB2 . 26 LYS HB2 1 1 378 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 378 1 2 1 1 26 LYS HB3 . 26 LYS HB3 1 1 379 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 379 1 2 1 1 27 GLN H . 27 GLN H 1 1 380 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 380 1 2 1 1 27 GLN HA . 27 GLN HA 1 1 381 1 1 1 1 26 LYS HB2 . 26 LYS HB2 1 1 381 1 2 1 1 26 LYS QD . 26 LYS QD 1 1 382 1 1 1 1 26 LYS HB2 . 26 LYS HB2 1 1 382 1 2 1 1 26 LYS QE . 26 LYS QE 1 1 383 1 1 1 1 26 LYS HB2 . 26 LYS HB2 1 1 383 1 2 1 1 27 GLN H . 27 GLN H 1 1 384 1 1 1 1 26 LYS HB3 . 26 LYS HB3 1 1 384 1 2 1 1 26 LYS QD . 26 LYS QD 1 1 385 1 1 1 1 26 LYS HB3 . 26 LYS HB3 1 1 385 1 2 1 1 26 LYS QE . 26 LYS QE 1 1 386 1 1 1 1 26 LYS HB3 . 26 LYS HB3 1 1 386 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 387 1 1 1 1 26 LYS HG2 . 26 LYS HG2 1 1 387 1 2 1 1 26 LYS QZ . 26 LYS QZ 1 1 388 1 1 1 1 26 LYS HG2 . 26 LYS HG2 1 1 388 1 2 1 1 27 GLN HE22 . 27 GLN HE21 1 1 389 1 1 1 1 27 GLN H . 27 GLN H 1 1 389 1 2 1 1 27 GLN HB2 . 27 GLN HB2 1 1 390 1 1 1 1 27 GLN H . 27 GLN H 1 1 390 1 2 1 1 27 GLN HB3 . 27 GLN HB3 1 1 391 1 1 1 1 27 GLN H . 27 GLN H 1 1 391 1 2 1 1 27 GLN HE22 . 27 GLN HE21 1 1 392 1 1 1 1 27 GLN H . 27 GLN H 1 1 392 1 2 1 1 27 GLN QG . 27 GLN QG 1 1 393 1 1 1 1 27 GLN H . 27 GLN H 1 1 393 1 2 1 1 30 HIS H . 30 HIS H 1 1 394 1 1 1 1 27 GLN H . 27 GLN H 1 1 394 1 2 1 1 30 HIS HD2 . 30 HIS HD2 1 1 395 1 1 1 1 27 GLN H . 27 GLN H 1 1 395 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 396 1 1 1 1 27 GLN HA . 27 GLN HA 1 1 396 1 2 1 1 27 GLN HB3 . 27 GLN HB3 1 1 397 1 1 1 1 27 GLN HA . 27 GLN HA 1 1 397 1 2 1 1 27 GLN HE21 . 27 GLN HE22 1 1 398 1 1 1 1 27 GLN HA . 27 GLN HA 1 1 398 1 2 1 1 27 GLN HE22 . 27 GLN HE21 1 1 399 1 1 1 1 27 GLN HA . 27 GLN HA 1 1 399 1 2 1 1 28 PRO QD . 28 PRO QD 1 1 400 1 1 1 1 27 GLN HA . 27 GLN HA 1 1 400 1 2 1 1 29 GLY H . 29 GLY H 1 1 401 1 1 1 1 27 GLN HB2 . 27 GLN HB2 1 1 401 1 2 1 1 27 GLN HE22 . 27 GLN HE21 1 1 402 1 1 1 1 27 GLN HB2 . 27 GLN HB2 1 1 402 1 2 1 1 29 GLY H . 29 GLY H 1 1 403 1 1 1 1 27 GLN HB2 . 27 GLN HB2 1 1 403 1 2 1 1 30 HIS H . 30 HIS H 1 1 404 1 1 1 1 27 GLN HB2 . 27 GLN HB2 1 1 404 1 2 1 1 30 HIS HA . 30 HIS HA 1 1 405 1 1 1 1 27 GLN HB2 . 27 GLN HB2 1 1 405 1 2 1 1 30 HIS HB2 . 30 HIS HB2 1 1 406 1 1 1 1 27 GLN HB2 . 27 GLN HB2 1 1 406 1 2 1 1 30 HIS HD2 . 30 HIS HD2 1 1 407 1 1 1 1 27 GLN HB2 . 27 GLN HB2 1 1 407 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 408 1 1 1 1 27 GLN HB3 . 27 GLN HB3 1 1 408 1 2 1 1 27 GLN HE22 . 27 GLN HE21 1 1 409 1 1 1 1 27 GLN HB3 . 27 GLN HB3 1 1 409 1 2 1 1 29 GLY H . 29 GLY H 1 1 410 1 1 1 1 27 GLN HB3 . 27 GLN HB3 1 1 410 1 2 1 1 30 HIS H . 30 HIS H 1 1 411 1 1 1 1 28 PRO HA . 28 PRO HA 1 1 411 1 2 1 1 28 PRO HB3 . 28 PRO HB2 1 1 412 1 1 1 1 28 PRO HA . 28 PRO HA 1 1 412 1 2 1 1 28 PRO QD . 28 PRO QD 1 1 413 1 1 1 1 28 PRO HA . 28 PRO HA 1 1 413 1 2 1 1 29 GLY H . 29 GLY H 1 1 414 1 1 1 1 28 PRO HA . 28 PRO HA 1 1 414 1 2 1 1 30 HIS H . 30 HIS H 1 1 415 1 1 1 1 28 PRO HB2 . 28 PRO HB3 1 1 415 1 2 1 1 29 GLY H . 29 GLY H 1 1 416 1 1 1 1 28 PRO HB2 . 28 PRO HB3 1 1 416 1 2 1 1 30 HIS H . 30 HIS H 1 1 417 1 1 1 1 28 PRO HB3 . 28 PRO HB2 1 1 417 1 2 1 1 29 GLY H . 29 GLY H 1 1 418 1 1 1 1 28 PRO QG . 28 PRO QG 1 1 418 1 2 1 1 29 GLY H . 29 GLY H 1 1 419 1 1 1 1 29 GLY H . 29 GLY H 1 1 419 1 2 1 1 29 GLY HA2 . 29 GLY HA3 1 1 420 1 1 1 1 29 GLY H . 29 GLY H 1 1 420 1 2 1 1 30 HIS H . 30 HIS H 1 1 421 1 1 1 1 29 GLY H . 29 GLY H 1 1 421 1 2 1 1 30 HIS HA . 30 HIS HA 1 1 422 1 1 1 1 29 GLY H . 29 GLY H 1 1 422 1 2 1 1 31 PHE H . 31 PHE H 1 1 423 1 1 1 1 29 GLY HA2 . 29 GLY HA3 1 1 423 1 2 1 1 30 HIS H . 30 HIS H 1 1 424 1 1 1 1 29 GLY HA3 . 29 GLY HA2 1 1 424 1 2 1 1 30 HIS H . 30 HIS H 1 1 425 1 1 1 1 29 GLY HA3 . 29 GLY HA2 1 1 425 1 2 1 1 31 PHE H . 31 PHE H 1 1 426 1 1 1 1 29 GLY HA3 . 29 GLY HA2 1 1 426 1 2 1 1 31 PHE QD . 31 PHE QD 1 1 427 1 1 1 1 29 GLY HA3 . 29 GLY HA2 1 1 427 1 2 1 1 31 PHE QE . 31 PHE QE 1 1 428 1 1 1 1 29 GLY HA3 . 29 GLY HA2 1 1 428 1 2 1 1 32 SER H . 32 SER H 1 1 429 1 1 1 1 30 HIS H . 30 HIS H 1 1 429 1 2 1 1 30 HIS HB2 . 30 HIS HB2 1 1 430 1 1 1 1 30 HIS H . 30 HIS H 1 1 430 1 2 1 1 30 HIS HE1 . 30 HIS HE1 1 1 431 1 1 1 1 30 HIS H . 30 HIS H 1 1 431 1 2 1 1 31 PHE H . 31 PHE H 1 1 432 1 1 1 1 30 HIS HA . 30 HIS HA 1 1 432 1 2 1 1 30 HIS HB2 . 30 HIS HB2 1 1 433 1 1 1 1 30 HIS HA . 30 HIS HA 1 1 433 1 2 1 1 30 HIS HD2 . 30 HIS HD2 1 1 434 1 1 1 1 30 HIS HA . 30 HIS HA 1 1 434 1 2 1 1 31 PHE H . 31 PHE H 1 1 435 1 1 1 1 30 HIS HA . 30 HIS HA 1 1 435 1 2 1 1 32 SER H . 32 SER H 1 1 436 1 1 1 1 30 HIS HA . 30 HIS HA 1 1 436 1 2 1 1 33 LYS H . 33 LYS H 1 1 437 1 1 1 1 30 HIS HB2 . 30 HIS HB2 1 1 437 1 2 1 1 30 HIS HD2 . 30 HIS HD2 1 1 438 1 1 1 1 30 HIS HB2 . 30 HIS HB2 1 1 438 1 2 1 1 31 PHE H . 31 PHE H 1 1 439 1 1 1 1 30 HIS HB2 . 30 HIS HB2 1 1 439 1 2 1 1 34 GLN QB . 34 GLN QB 1 1 440 1 1 1 1 30 HIS HD2 . 30 HIS HD2 1 1 440 1 2 1 1 31 PHE HA . 31 PHE HA 1 1 441 1 1 1 1 30 HIS HD2 . 30 HIS HD2 1 1 441 1 2 1 1 34 GLN QB . 34 GLN QB 1 1 442 1 1 1 1 30 HIS HD2 . 30 HIS HD2 1 1 442 1 2 1 1 34 GLN HE22 . 34 GLN HE22 1 1 443 1 1 1 1 30 HIS HD2 . 30 HIS HD2 1 1 443 1 2 1 1 34 GLN QG . 34 GLN QG 1 1 444 1 1 1 1 30 HIS HD2 . 30 HIS HD2 1 1 444 1 2 1 1 35 CYS H . 35 CYS H 1 1 445 1 1 1 1 30 HIS HD2 . 30 HIS HD2 1 1 445 1 2 1 1 35 CYS HB2 . 35 CYS HB2 1 1 446 1 1 1 1 30 HIS HE1 . 30 HIS HE1 1 1 446 1 2 1 1 31 PHE H . 31 PHE H 1 1 447 1 1 1 1 31 PHE H . 31 PHE H 1 1 447 1 2 1 1 31 PHE HA . 31 PHE HA 1 1 448 1 1 1 1 31 PHE H . 31 PHE H 1 1 448 1 2 1 1 31 PHE HB2 . 31 PHE HB2 1 1 449 1 1 1 1 31 PHE H . 31 PHE H 1 1 449 1 2 1 1 31 PHE HB3 . 31 PHE HB3 1 1 450 1 1 1 1 31 PHE H . 31 PHE H 1 1 450 1 2 1 1 31 PHE QD . 31 PHE QD 1 1 451 1 1 1 1 31 PHE H . 31 PHE H 1 1 451 1 2 1 1 31 PHE QE . 31 PHE QE 1 1 452 1 1 1 1 31 PHE H . 31 PHE H 1 1 452 1 2 1 1 32 SER H . 32 SER H 1 1 453 1 1 1 1 31 PHE H . 31 PHE H 1 1 453 1 2 1 1 33 LYS H . 33 LYS H 1 1 454 1 1 1 1 31 PHE HA . 31 PHE HA 1 1 454 1 2 1 1 31 PHE HB2 . 31 PHE HB2 1 1 455 1 1 1 1 31 PHE HA . 31 PHE HA 1 1 455 1 2 1 1 31 PHE HB3 . 31 PHE HB3 1 1 456 1 1 1 1 31 PHE HA . 31 PHE HA 1 1 456 1 2 1 1 31 PHE QD . 31 PHE QD 1 1 457 1 1 1 1 31 PHE HA . 31 PHE HA 1 1 457 1 2 1 1 32 SER H . 32 SER H 1 1 458 1 1 1 1 31 PHE HA . 31 PHE HA 1 1 458 1 2 1 1 36 ARG H . 36 ARG H 1 1 459 1 1 1 1 31 PHE HB2 . 31 PHE HB2 1 1 459 1 2 1 1 31 PHE QD . 31 PHE QD 1 1 460 1 1 1 1 31 PHE HB2 . 31 PHE HB2 1 1 460 1 2 1 1 32 SER H . 32 SER H 1 1 461 1 1 1 1 31 PHE HB3 . 31 PHE HB3 1 1 461 1 2 1 1 31 PHE QD . 31 PHE QD 1 1 462 1 1 1 1 31 PHE HB3 . 31 PHE HB3 1 1 462 1 2 1 1 31 PHE QE . 31 PHE QE 1 1 463 1 1 1 1 31 PHE HB3 . 31 PHE HB3 1 1 463 1 2 1 1 32 SER H . 32 SER H 1 1 464 1 1 1 1 31 PHE QD . 31 PHE QD 1 1 464 1 2 1 1 32 SER HA . 32 SER HA 1 1 465 1 1 1 1 31 PHE QD . 31 PHE QD 1 1 465 1 2 1 1 35 CYS HB2 . 35 CYS HB2 1 1 466 1 1 1 1 31 PHE QE . 31 PHE QE 1 1 466 1 2 1 1 32 SER H . 32 SER H 1 1 467 1 1 1 1 32 SER H . 32 SER H 1 1 467 1 2 1 1 32 SER HA . 32 SER HA 1 1 468 1 1 1 1 32 SER H . 32 SER H 1 1 468 1 2 1 1 32 SER HB2 . 32 SER HB2 1 1 469 1 1 1 1 32 SER H . 32 SER H 1 1 469 1 2 1 1 32 SER HB3 . 32 SER HB3 1 1 470 1 1 1 1 32 SER H . 32 SER H 1 1 470 1 2 1 1 33 LYS H . 33 LYS H 1 1 471 1 1 1 1 32 SER H . 32 SER H 1 1 471 1 2 1 1 34 GLN H . 34 GLN H 1 1 472 1 1 1 1 32 SER H . 32 SER H 1 1 472 1 2 1 1 36 ARG H . 36 ARG H 1 1 473 1 1 1 1 32 SER H . 32 SER H 1 1 473 1 2 1 1 36 ARG QB . 36 ARG QB 1 1 474 1 1 1 1 32 SER HA . 32 SER HA 1 1 474 1 2 1 1 32 SER HB3 . 32 SER HB3 1 1 475 1 1 1 1 32 SER HA . 32 SER HA 1 1 475 1 2 1 1 33 LYS H . 33 LYS H 1 1 476 1 1 1 1 32 SER HA . 32 SER HA 1 1 476 1 2 1 1 34 GLN H . 34 GLN H 1 1 477 1 1 1 1 32 SER HA . 32 SER HA 1 1 477 1 2 1 1 36 ARG H . 36 ARG H 1 1 478 1 1 1 1 32 SER HA . 32 SER HA 1 1 478 1 2 1 1 37 SER H . 37 SER H 1 1 479 1 1 1 1 32 SER HB2 . 32 SER HB2 1 1 479 1 2 1 1 33 LYS H . 33 LYS H 1 1 480 1 1 1 1 32 SER HB2 . 32 SER HB2 1 1 480 1 2 1 1 33 LYS QB . 33 LYS QB 1 1 481 1 1 1 1 32 SER HB2 . 32 SER HB2 1 1 481 1 2 1 1 33 LYS QG . 33 LYS QG 1 1 482 1 1 1 1 32 SER HB3 . 32 SER HB3 1 1 482 1 2 1 1 33 LYS H . 33 LYS H 1 1 483 1 1 1 1 33 LYS H . 33 LYS H 1 1 483 1 2 1 1 33 LYS QB . 33 LYS QB 1 1 484 1 1 1 1 33 LYS H . 33 LYS H 1 1 484 1 2 1 1 33 LYS QD . 33 LYS QD 1 1 485 1 1 1 1 33 LYS H . 33 LYS H 1 1 485 1 2 1 1 33 LYS QE . 33 LYS QE 1 1 486 1 1 1 1 33 LYS H . 33 LYS H 1 1 486 1 2 1 1 33 LYS QG . 33 LYS QG 1 1 487 1 1 1 1 33 LYS H . 33 LYS H 1 1 487 1 2 1 1 34 GLN H . 34 GLN H 1 1 488 1 1 1 1 33 LYS H . 33 LYS H 1 1 488 1 2 1 1 34 GLN HA . 34 GLN HA 1 1 489 1 1 1 1 33 LYS H . 33 LYS H 1 1 489 1 2 1 1 34 GLN HB2 . 34 GLN HB2 1 1 490 1 1 1 1 33 LYS H . 33 LYS H 1 1 490 1 2 1 1 34 GLN HB3 . 34 GLN HB3 1 1 491 1 1 1 1 33 LYS H . 33 LYS H 1 1 491 1 2 1 1 35 CYS H . 35 CYS H 1 1 492 1 1 1 1 33 LYS H . 33 LYS H 1 1 492 1 2 1 1 36 ARG H . 36 ARG H 1 1 493 1 1 1 1 33 LYS H . 33 LYS H 1 1 493 1 2 1 1 37 SER HA . 37 SER HA 1 1 494 1 1 1 1 33 LYS HA . 33 LYS HA 1 1 494 1 2 1 1 33 LYS QD . 33 LYS QD 1 1 495 1 1 1 1 33 LYS HA . 33 LYS HA 1 1 495 1 2 1 1 33 LYS QE . 33 LYS QE 1 1 496 1 1 1 1 33 LYS HA . 33 LYS HA 1 1 496 1 2 1 1 33 LYS QG . 33 LYS QG 1 1 497 1 1 1 1 33 LYS HA . 33 LYS HA 1 1 497 1 2 1 1 34 GLN H . 34 GLN H 1 1 498 1 1 1 1 33 LYS HA . 33 LYS HA 1 1 498 1 2 1 1 37 SER H . 37 SER H 1 1 499 1 1 1 1 33 LYS QB . 33 LYS QB 1 1 499 1 2 1 1 33 LYS QD . 33 LYS QD 1 1 500 1 1 1 1 33 LYS QB . 33 LYS QB 1 1 500 1 2 1 1 34 GLN H . 34 GLN H 1 1 501 1 1 1 1 33 LYS QE . 33 LYS QE 1 1 501 1 2 1 1 33 LYS QG . 33 LYS QG 1 1 502 1 1 1 1 34 GLN H . 34 GLN H 1 1 502 1 2 1 1 34 GLN HB2 . 34 GLN HB2 1 1 503 1 1 1 1 34 GLN H . 34 GLN H 1 1 503 1 2 1 1 34 GLN HB3 . 34 GLN HB3 1 1 504 1 1 1 1 34 GLN H . 34 GLN H 1 1 504 1 2 1 1 34 GLN QG . 34 GLN QG 1 1 505 1 1 1 1 34 GLN H . 34 GLN H 1 1 505 1 2 1 1 35 CYS H . 35 CYS H 1 1 506 1 1 1 1 34 GLN H . 34 GLN H 1 1 506 1 2 1 1 37 SER H . 37 SER H 1 1 507 1 1 1 1 34 GLN H . 34 GLN H 1 1 507 1 2 1 1 37 SER HA . 37 SER HA 1 1 508 1 1 1 1 34 GLN HA . 34 GLN HA 1 1 508 1 2 1 1 34 GLN HB2 . 34 GLN HB2 1 1 509 1 1 1 1 34 GLN HA . 34 GLN HA 1 1 509 1 2 1 1 34 GLN QG . 34 GLN QG 1 1 510 1 1 1 1 34 GLN HA . 34 GLN HA 1 1 510 1 2 1 1 35 CYS H . 35 CYS H 1 1 511 1 1 1 1 34 GLN HA . 34 GLN HA 1 1 511 1 2 1 1 36 ARG H . 36 ARG H 1 1 512 1 1 1 1 34 GLN HA . 34 GLN HA 1 1 512 1 2 1 1 37 SER H . 37 SER H 1 1 513 1 1 1 1 34 GLN HB2 . 34 GLN HB2 1 1 513 1 2 1 1 34 GLN HE21 . 34 GLN HE21 1 1 514 1 1 1 1 34 GLN HB2 . 34 GLN HB2 1 1 514 1 2 1 1 34 GLN HE22 . 34 GLN HE22 1 1 515 1 1 1 1 34 GLN HB2 . 34 GLN HB2 1 1 515 1 2 1 1 35 CYS H . 35 CYS H 1 1 516 1 1 1 1 34 GLN HB3 . 34 GLN HB3 1 1 516 1 2 1 1 34 GLN HE21 . 34 GLN HE21 1 1 517 1 1 1 1 34 GLN HB3 . 34 GLN HB3 1 1 517 1 2 1 1 34 GLN HE22 . 34 GLN HE22 1 1 518 1 1 1 1 34 GLN HB3 . 34 GLN HB3 1 1 518 1 2 1 1 35 CYS H . 35 CYS H 1 1 519 1 1 1 1 34 GLN HE21 . 34 GLN HE21 1 1 519 1 2 1 1 35 CYS H . 35 CYS H 1 1 520 1 1 1 1 34 GLN HE21 . 34 GLN HE21 1 1 520 1 2 1 1 35 CYS HB2 . 35 CYS HB2 1 1 521 1 1 1 1 34 GLN HE21 . 34 GLN HE21 1 1 521 1 2 1 1 35 CYS HB3 . 35 CYS HB3 1 1 522 1 1 1 1 35 CYS H . 35 CYS H 1 1 522 1 2 1 1 35 CYS HB2 . 35 CYS HB2 1 1 523 1 1 1 1 35 CYS H . 35 CYS H 1 1 523 1 2 1 1 35 CYS HB3 . 35 CYS HB3 1 1 524 1 1 1 1 35 CYS H . 35 CYS H 1 1 524 1 2 1 1 36 ARG H . 36 ARG H 1 1 525 1 1 1 1 35 CYS H . 35 CYS H 1 1 525 1 2 1 1 36 ARG QB . 36 ARG QB 1 1 526 1 1 1 1 35 CYS H . 35 CYS H 1 1 526 1 2 1 1 37 SER H . 37 SER H 1 1 527 1 1 1 1 35 CYS HA . 35 CYS HA 1 1 527 1 2 1 1 35 CYS HB3 . 35 CYS HB3 1 1 528 1 1 1 1 35 CYS HA . 35 CYS HA 1 1 528 1 2 1 1 36 ARG H . 36 ARG H 1 1 529 1 1 1 1 35 CYS HA . 35 CYS HA 1 1 529 1 2 1 1 36 ARG HE . 36 ARG HE 1 1 530 1 1 1 1 35 CYS HB2 . 35 CYS HB2 1 1 530 1 2 1 1 36 ARG H . 36 ARG H 1 1 531 1 1 1 1 35 CYS HB2 . 35 CYS HB2 1 1 531 1 2 1 1 36 ARG QB . 36 ARG QB 1 1 532 1 1 1 1 35 CYS HB2 . 35 CYS HB2 1 1 532 1 2 1 1 36 ARG HE . 36 ARG HE 1 1 533 1 1 1 1 35 CYS HB3 . 35 CYS HB3 1 1 533 1 2 1 1 36 ARG H . 36 ARG H 1 1 534 1 1 1 1 35 CYS HB3 . 35 CYS HB3 1 1 534 1 2 1 1 36 ARG HE . 36 ARG HE 1 1 535 1 1 1 1 36 ARG H . 36 ARG H 1 1 535 1 2 1 1 36 ARG QB . 36 ARG QB 1 1 536 1 1 1 1 36 ARG H . 36 ARG H 1 1 536 1 2 1 1 36 ARG HE . 36 ARG HE 1 1 537 1 1 1 1 36 ARG H . 36 ARG H 1 1 537 1 2 1 1 37 SER H . 37 SER H 1 1 538 1 1 1 1 36 ARG H . 36 ARG H 1 1 538 1 2 1 1 37 SER QB . 37 SER QB 1 1 539 1 1 1 1 36 ARG HA . 36 ARG HA 1 1 539 1 2 1 1 36 ARG QD . 36 ARG QD 1 1 540 1 1 1 1 36 ARG HA . 36 ARG HA 1 1 540 1 2 1 1 36 ARG HE . 36 ARG HE 1 1 541 1 1 1 1 36 ARG HA . 36 ARG HA 1 1 541 1 2 1 1 36 ARG QG . 36 ARG QG 1 1 542 1 1 1 1 36 ARG HA . 36 ARG HA 1 1 542 1 2 1 1 37 SER H . 37 SER H 1 1 543 1 1 1 1 36 ARG QB . 36 ARG QB 1 1 543 1 2 1 1 36 ARG HE . 36 ARG HE 1 1 544 1 1 1 1 36 ARG QB . 36 ARG QB 1 1 544 1 2 1 1 37 SER H . 37 SER H 1 1 545 1 1 1 1 37 SER H . 37 SER H 1 1 545 1 2 1 1 37 SER QB . 37 SER QB 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.8 1 1 2 1 . . . . . . . 4.7 1 1 3 1 . . . . . . . 5.2 1 1 4 1 . . . . . . . 3.4 1 1 5 1 . . . . . . . 2.5 1 1 6 1 . . . . . . . 4.7 1 1 7 1 . . . . . . . 4.6 1 1 8 1 . . . . . . . 5.2 1 1 9 1 . . . . . . . 5.1 1 1 10 1 . . . . . . . 2.4 1 1 11 1 . . . . . . . 4.3 1 1 12 1 . . . . . . . 3.6 1 1 13 1 . . . . . . . 5.1 1 1 14 1 . . . . . . . 4.5 1 1 15 1 . . . . . . . 5.0 1 1 16 1 . . . . . . . 3.1 1 1 17 1 . . . . . . . 2.5 1 1 18 1 . . . . . . . 2.9 1 1 19 1 . . . . . . . 4.9 1 1 20 1 . . . . . . . 5.0 1 1 21 1 . . . . . . . 3.5 1 1 22 1 . . . . . . . 5.2 1 1 23 1 . . . . . . . 5.0 1 1 24 1 . . . . . . . 2.9 1 1 25 1 . . . . . . . 2.5 1 1 26 1 . . . . . . . 4.0 1 1 27 1 . . . . . . . 4.9 1 1 28 1 . . . . . . . 5.2 1 1 29 1 . . . . . . . 4.4 1 1 30 1 . . . . . . . 4.4 1 1 31 1 . . . . . . . 3.0 1 1 32 1 . . . . . . . 3.5 1 1 33 1 . . . . . . . 3.7 1 1 34 1 . . . . . . . 3.9 1 1 35 1 . . . . . . . 5.2 1 1 36 1 . . . . . . . 5.2 1 1 37 1 . . . . . . . 5.2 1 1 38 1 . . . . . . . 2.8 1 1 39 1 . . . . . . . 5.2 1 1 40 1 . . . . . . . 5.1 1 1 41 1 . . . . . . . 3.9 1 1 42 1 . . . . . . . 2.7 1 1 43 1 . . . . . . . 2.6 1 1 44 1 . . . . . . . 2.8 1 1 45 1 . . . . . . . 5.2 1 1 46 1 . . . . . . . 5.0 1 1 47 1 . . . . . . . 4.7 1 1 48 1 . . . . . . . 4.7 1 1 49 1 . . . . . . . 4.1 1 1 50 1 . . . . . . . 2.5 1 1 51 1 . . . . . . . 2.9 1 1 52 1 . . . . . . . 4.6 1 1 53 1 . . . . . . . 3.7 1 1 54 1 . . . . . . . 4.3 1 1 55 1 . . . . . . . 5.2 1 1 56 1 . . . . . . . 4.9 1 1 57 1 . . . . . . . 4.7 1 1 58 1 . . . . . . . 5.3 1 1 59 1 . . . . . . . 3.5 1 1 60 1 . . . . . . . 3.1 1 1 61 1 . . . . . . . 4.4 1 1 62 1 . . . . . . . 5.2 1 1 63 1 . . . . . . . 3.5 1 1 64 1 . . . . . . . 3.9 1 1 65 1 . . . . . . . 3.8 1 1 66 1 . . . . . . . 5.2 1 1 67 1 . . . . . . . 4.1 1 1 68 1 . . . . . . . 4.1 1 1 69 1 . . . . . . . 3.6 1 1 70 1 . . . . . . . 4.8 1 1 71 1 . . . . . . . 5.1 1 1 72 1 . . . . . . . 4.5 1 1 73 1 . . . . . . . 3.2 1 1 74 1 . . . . . . . 4.0 1 1 75 1 . . . . . . . 3.4 1 1 76 1 . . . . . . . 3.0 1 1 77 1 . . . . . . . 2.4 1 1 78 1 . . . . . . . 2.7 1 1 79 1 . . . . . . . 3.1 1 1 80 1 . . . . . . . 2.8 1 1 81 1 . . . . . . . 3.9 1 1 82 1 . . . . . . . 3.0 1 1 83 1 . . . . . . . 4.7 1 1 84 1 . . . . . . . 2.7 1 1 85 1 . . . . . . . 5.0 1 1 86 1 . . . . . . . 3.5 1 1 87 1 . . . . . . . 5.2 1 1 88 1 . . . . . . . 4.5 1 1 89 1 . . . . . . . 3.6 1 1 90 1 . . . . . . . 3.1 1 1 91 1 . . . . . . . 2.6 1 1 92 1 . . . . . . . 2.9 1 1 93 1 . . . . . . . 3.7 1 1 94 1 . . . . . . . 3.1 1 1 95 1 . . . . . . . 3.3 1 1 96 1 . . . . . . . 4.0 1 1 97 1 . . . . . . . 5.0 1 1 98 1 . . . . . . . 5.3 1 1 99 1 . . . . . . . 5.2 1 1 100 1 . . . . . . . 5.0 1 1 101 1 . . . . . . . 4.7 1 1 102 1 . . . . . . . 4.1 1 1 103 1 . . . . . . . 5.1 1 1 104 1 . . . . . . . 2.7 1 1 105 1 . . . . . . . 2.8 1 1 106 1 . . . . . . . 4.9 1 1 107 1 . . . . . . . 4.6 1 1 108 1 . . . . . . . 4.8 1 1 109 1 . . . . . . . 4.9 1 1 110 1 . . . . . . . 4.3 1 1 111 1 . . . . . . . 4.1 1 1 112 1 . . . . . . . 4.9 1 1 113 1 . . . . . . . 5.3 1 1 114 1 . . . . . . . 2.6 1 1 115 1 . . . . . . . 4.4 1 1 116 1 . . . . . . . 3.9 1 1 117 1 . . . . . . . 3.0 1 1 118 1 . . . . . . . 4.0 1 1 119 1 . . . . . . . 4.4 1 1 120 1 . . . . . . . 4.2 1 1 121 1 . . . . . . . 2.4 1 1 122 1 . . . . . . . 5.2 1 1 123 1 . . . . . . . 4.1 1 1 124 1 . . . . . . . 4.4 1 1 125 1 . . . . . . . 3.6 1 1 126 1 . . . . . . . 2.8 1 1 127 1 . . . . . . . 2.8 1 1 128 1 . . . . . . . 4.8 1 1 129 1 . . . . . . . 3.1 1 1 130 1 . . . . . . . 3.0 1 1 131 1 . . . . . . . 4.6 1 1 132 1 . . . . . . . 3.7 1 1 133 1 . . . . . . . 4.5 1 1 134 1 . . . . . . . 3.0 1 1 135 1 . . . . . . . 2.7 1 1 136 1 . . . . . . . 3.8 1 1 137 1 . . . . . . . 4.8 1 1 138 1 . . . . . . . 5.2 1 1 139 1 . . . . . . . 3.0 1 1 140 1 . . . . . . . 4.8 1 1 141 1 . . . . . . . 2.5 1 1 142 1 . . . . . . . 5.0 1 1 143 1 . . . . . . . 4.5 1 1 144 1 . . . . . . . 4.0 1 1 145 1 . . . . . . . 5.2 1 1 146 1 . . . . . . . 4.2 1 1 147 1 . . . . . . . 5.2 1 1 148 1 . . . . . . . 5.0 1 1 149 1 . . . . . . . 2.9 1 1 150 1 . . . . . . . 2.9 1 1 151 1 . . . . . . . 5.3 1 1 152 1 . . . . . . . 5.1 1 1 153 1 . . . . . . . 5.0 1 1 154 1 . . . . . . . 3.9 1 1 155 1 . . . . . . . 4.2 1 1 156 1 . . . . . . . 5.0 1 1 157 1 . . . . . . . 2.7 1 1 158 1 . . . . . . . 3.1 1 1 159 1 . . . . . . . 3.5 1 1 160 1 . . . . . . . 4.1 1 1 161 1 . . . . . . . 5.2 1 1 162 1 . . . . . . . 3.8 1 1 163 1 . . . . . . . 4.7 1 1 164 1 . . . . . . . 4.5 1 1 165 1 . . . . . . . 5.0 1 1 166 1 . . . . . . . 4.7 1 1 167 1 . . . . . . . 2.8 1 1 168 1 . . . . . . . 3.2 1 1 169 1 . . . . . . . 3.4 1 1 170 1 . . . . . . . 2.5 1 1 171 1 . . . . . . . 5.0 1 1 172 1 . . . . . . . 2.9 1 1 173 1 . . . . . . . 4.0 1 1 174 1 . . . . . . . 4.0 1 1 175 1 . . . . . . . 4.0 1 1 176 1 . . . . . . . 3.3 1 1 177 1 . . . . . . . 5.1 1 1 178 1 . . . . . . . 4.3 1 1 179 1 . . . . . . . 4.1 1 1 180 1 . . . . . . . 2.8 1 1 181 1 . . . . . . . 2.8 1 1 182 1 . . . . . . . 4.2 1 1 183 1 . . . . . . . 5.1 1 1 184 1 . . . . . . . 5.2 1 1 185 1 . . . . . . . 2.2 1 1 186 1 . . . . . . . 4.6 1 1 187 1 . . . . . . . 5.2 1 1 188 1 . . . . . . . 5.2 1 1 189 1 . . . . . . . 5.2 1 1 190 1 . . . . . . . 3.1 1 1 191 1 . . . . . . . 3.2 1 1 192 1 . . . . . . . 3.4 1 1 193 1 . . . . . . . 3.7 1 1 194 1 . . . . . . . 5.1 1 1 195 1 . . . . . . . 5.2 1 1 196 1 . . . . . . . 4.1 1 1 197 1 . . . . . . . 3.7 1 1 198 1 . . . . . . . 2.3 1 1 199 1 . . . . . . . 5.1 1 1 200 1 . . . . . . . 5.2 1 1 201 1 . . . . . . . 4.8 1 1 202 1 . . . . . . . 3.7 1 1 203 1 . . . . . . . 5.1 1 1 204 1 . . . . . . . 4.6 1 1 205 1 . . . . . . . 4.5 1 1 206 1 . . . . . . . 4.7 1 1 207 1 . . . . . . . 2.9 1 1 208 1 . . . . . . . 2.8 1 1 209 1 . . . . . . . 2.6 1 1 210 1 . . . . . . . 5.2 1 1 211 1 . . . . . . . 2.8 1 1 212 1 . . . . . . . 4.9 1 1 213 1 . . . . . . . 3.6 1 1 214 1 . . . . . . . 4.1 1 1 215 1 . . . . . . . 3.0 1 1 216 1 . . . . . . . 4.5 1 1 217 1 . . . . . . . 4.8 1 1 218 1 . . . . . . . 2.9 1 1 219 1 . . . . . . . 4.0 1 1 220 1 . . . . . . . 4.7 1 1 221 1 . . . . . . . 3.1 1 1 222 1 . . . . . . . 2.7 1 1 223 1 . . . . . . . 4.7 1 1 224 1 . . . . . . . 5.0 1 1 225 1 . . . . . . . 4.1 1 1 226 1 . . . . . . . 4.2 1 1 227 1 . . . . . . . 5.2 1 1 228 1 . . . . . . . 2.5 1 1 229 1 . . . . . . . 5.2 1 1 230 1 . . . . . . . 2.5 1 1 231 1 . . . . . . . 5.0 1 1 232 1 . . . . . . . 4.8 1 1 233 1 . . . . . . . 3.3 1 1 234 1 . . . . . . . 4.9 1 1 235 1 . . . . . . . 3.8 1 1 236 1 . . . . . . . 3.7 1 1 237 1 . . . . . . . 3.6 1 1 238 1 . . . . . . . 5.2 1 1 239 1 . . . . . . . 5.2 1 1 240 1 . . . . . . . 2.7 1 1 241 1 . . . . . . . 2.9 1 1 242 1 . . . . . . . 3.4 1 1 243 1 . . . . . . . 4.7 1 1 244 1 . . . . . . . 4.5 1 1 245 1 . . . . . . . 4.1 1 1 246 1 . . . . . . . 4.9 1 1 247 1 . . . . . . . 2.6 1 1 248 1 . . . . . . . 4.4 1 1 249 1 . . . . . . . 4.0 1 1 250 1 . . . . . . . 2.6 1 1 251 1 . . . . . . . 4.6 1 1 252 1 . . . . . . . 4.4 1 1 253 1 . . . . . . . 4.2 1 1 254 1 . . . . . . . 2.8 1 1 255 1 . . . . . . . 3.1 1 1 256 1 . . . . . . . 4.4 1 1 257 1 . . . . . . . 4.1 1 1 258 1 . . . . . . . 3.2 1 1 259 1 . . . . . . . 3.8 1 1 260 1 . . . . . . . 4.8 1 1 261 1 . . . . . . . 2.6 1 1 262 1 . . . . . . . 5.0 1 1 263 1 . . . . . . . 2.8 1 1 264 1 . . . . . . . 5.0 1 1 265 1 . . . . . . . 3.6 1 1 266 1 . . . . . . . 4.5 1 1 267 1 . . . . . . . 3.1 1 1 268 1 . . . . . . . 3.0 1 1 269 1 . . . . . . . 5.0 1 1 270 1 . . . . . . . 4.7 1 1 271 1 . . . . . . . 3.3 1 1 272 1 . . . . . . . 4.9 1 1 273 1 . . . . . . . 5.0 1 1 274 1 . . . . . . . 3.6 1 1 275 1 . . . . . . . 3.4 1 1 276 1 . . . . . . . 4.4 1 1 277 1 . . . . . . . 3.3 1 1 278 1 . . . . . . . 3.1 1 1 279 1 . . . . . . . 2.9 1 1 280 1 . . . . . . . 4.7 1 1 281 1 . . . . . . . 3.2 1 1 282 1 . . . . . . . 3.1 1 1 283 1 . . . . . . . 3.3 1 1 284 1 . . . . . . . 3.3 1 1 285 1 . . . . . . . 3.8 1 1 286 1 . . . . . . . 5.2 1 1 287 1 . . . . . . . 3.1 1 1 288 1 . . . . . . . 4.1 1 1 289 1 . . . . . . . 4.5 1 1 290 1 . . . . . . . 5.2 1 1 291 1 . . . . . . . 5.2 1 1 292 1 . . . . . . . 5.3 1 1 293 1 . . . . . . . 5.2 1 1 294 1 . . . . . . . 4.9 1 1 295 1 . . . . . . . 5.1 1 1 296 1 . . . . . . . 5.1 1 1 297 1 . . . . . . . 4.3 1 1 298 1 . . . . . . . 4.7 1 1 299 1 . . . . . . . 5.1 1 1 300 1 . . . . . . . 3.3 1 1 301 1 . . . . . . . 3.2 1 1 302 1 . . . . . . . 4.5 1 1 303 1 . . . . . . . 5.2 1 1 304 1 . . . . . . . 2.8 1 1 305 1 . . . . . . . 2.8 1 1 306 1 . . . . . . . 5.0 1 1 307 1 . . . . . . . 3.9 1 1 308 1 . . . . . . . 4.4 1 1 309 1 . . . . . . . 4.7 1 1 310 1 . . . . . . . 4.1 1 1 311 1 . . . . . . . 3.7 1 1 312 1 . . . . . . . 3.8 1 1 313 1 . . . . . . . 3.1 1 1 314 1 . . . . . . . 4.7 1 1 315 1 . . . . . . . 2.8 1 1 316 1 . . . . . . . 3.0 1 1 317 1 . . . . . . . 4.7 1 1 318 1 . . . . . . . 2.8 1 1 319 1 . . . . . . . 4.1 1 1 320 1 . . . . . . . 4.0 1 1 321 1 . . . . . . . 3.5 1 1 322 1 . . . . . . . 3.2 1 1 323 1 . . . . . . . 5.2 1 1 324 1 . . . . . . . 2.0 1 1 325 1 . . . . . . . 4.2 1 1 326 1 . . . . . . . 2.7 1 1 327 1 . . . . . . . 2.8 1 1 328 1 . . . . . . . 3.9 1 1 329 1 . . . . . . . 3.6 1 1 330 1 . . . . . . . 4.9 1 1 331 1 . . . . . . . 4.9 1 1 332 1 . . . . . . . 2.9 1 1 333 1 . . . . . . . 4.9 1 1 334 1 . . . . . . . 4.5 1 1 335 1 . . . . . . . 5.2 1 1 336 1 . . . . . . . 5.1 1 1 337 1 . . . . . . . 4.3 1 1 338 1 . . . . . . . 4.4 1 1 339 1 . . . . . . . 4.1 1 1 340 1 . . . . . . . 5.0 1 1 341 1 . . . . . . . 2.8 1 1 342 1 . . . . . . . 3.3 1 1 343 1 . . . . . . . 5.1 1 1 344 1 . . . . . . . 4.2 1 1 345 1 . . . . . . . 5.0 1 1 346 1 . . . . . . . 5.3 1 1 347 1 . . . . . . . 3.9 1 1 348 1 . . . . . . . 3.8 1 1 349 1 . . . . . . . 3.3 1 1 350 1 . . . . . . . 4.7 1 1 351 1 . . . . . . . 4.1 1 1 352 1 . . . . . . . 3.9 1 1 353 1 . . . . . . . 4.9 1 1 354 1 . . . . . . . 4.7 1 1 355 1 . . . . . . . 5.2 1 1 356 1 . . . . . . . 5.2 1 1 357 1 . . . . . . . 4.9 1 1 358 1 . . . . . . . 3.6 1 1 359 1 . . . . . . . 3.5 1 1 360 1 . . . . . . . 3.0 1 1 361 1 . . . . . . . 5.1 1 1 362 1 . . . . . . . 5.2 1 1 363 1 . . . . . . . 3.8 1 1 364 1 . . . . . . . 4.6 1 1 365 1 . . . . . . . 3.4 1 1 366 1 . . . . . . . 3.8 1 1 367 1 . . . . . . . 4.5 1 1 368 1 . . . . . . . 4.5 1 1 369 1 . . . . . . . 2.6 1 1 370 1 . . . . . . . 4.1 1 1 371 1 . . . . . . . 3.0 1 1 372 1 . . . . . . . 5.2 1 1 373 1 . . . . . . . 4.2 1 1 374 1 . . . . . . . 3.4 1 1 375 1 . . . . . . . 5.2 1 1 376 1 . . . . . . . 3.4 1 1 377 1 . . . . . . . 2.7 1 1 378 1 . . . . . . . 2.7 1 1 379 1 . . . . . . . 3.1 1 1 380 1 . . . . . . . 5.0 1 1 381 1 . . . . . . . 3.8 1 1 382 1 . . . . . . . 5.0 1 1 383 1 . . . . . . . 4.8 1 1 384 1 . . . . . . . 3.6 1 1 385 1 . . . . . . . 4.9 1 1 386 1 . . . . . . . 5.1 1 1 387 1 . . . . . . . 4.7 1 1 388 1 . . . . . . . 5.1 1 1 389 1 . . . . . . . 2.8 1 1 390 1 . . . . . . . 3.9 1 1 391 1 . . . . . . . 5.3 1 1 392 1 . . . . . . . 2.7 1 1 393 1 . . . . . . . 5.2 1 1 394 1 . . . . . . . 5.1 1 1 395 1 . . . . . . . 3.4 1 1 396 1 . . . . . . . 2.8 1 1 397 1 . . . . . . . 5.0 1 1 398 1 . . . . . . . 5.2 1 1 399 1 . . . . . . . 2.6 1 1 400 1 . . . . . . . 4.9 1 1 401 1 . . . . . . . 5.0 1 1 402 1 . . . . . . . 4.1 1 1 403 1 . . . . . . . 3.4 1 1 404 1 . . . . . . . 5.1 1 1 405 1 . . . . . . . 4.1 1 1 406 1 . . . . . . . 4.9 1 1 407 1 . . . . . . . 4.6 1 1 408 1 . . . . . . . 4.9 1 1 409 1 . . . . . . . 3.8 1 1 410 1 . . . . . . . 4.1 1 1 411 1 . . . . . . . 2.4 1 1 412 1 . . . . . . . 3.9 1 1 413 1 . . . . . . . 3.8 1 1 414 1 . . . . . . . 5.0 1 1 415 1 . . . . . . . 4.1 1 1 416 1 . . . . . . . 5.2 1 1 417 1 . . . . . . . 4.9 1 1 418 1 . . . . . . . 5.1 1 1 419 1 . . . . . . . 3.0 1 1 420 1 . . . . . . . 2.3 1 1 421 1 . . . . . . . 4.8 1 1 422 1 . . . . . . . 4.7 1 1 423 1 . . . . . . . 3.5 1 1 424 1 . . . . . . . 3.6 1 1 425 1 . . . . . . . 4.2 1 1 426 1 . . . . . . . 4.9 1 1 427 1 . . . . . . . 4.3 1 1 428 1 . . . . . . . 4.7 1 1 429 1 . . . . . . . 3.9 1 1 430 1 . . . . . . . 5.2 1 1 431 1 . . . . . . . 3.0 1 1 432 1 . . . . . . . 2.6 1 1 433 1 . . . . . . . 4.9 1 1 434 1 . . . . . . . 3.8 1 1 435 1 . . . . . . . 4.6 1 1 436 1 . . . . . . . 4.2 1 1 437 1 . . . . . . . 2.8 1 1 438 1 . . . . . . . 4.4 1 1 439 1 . . . . . . . 4.7 1 1 440 1 . . . . . . . 4.5 1 1 441 1 . . . . . . . 3.9 1 1 442 1 . . . . . . . 3.5 1 1 443 1 . . . . . . . 5.1 1 1 444 1 . . . . . . . 5.0 1 1 445 1 . . . . . . . 5.1 1 1 446 1 . . . . . . . 4.4 1 1 447 1 . . . . . . . 3.1 1 1 448 1 . . . . . . . 3.8 1 1 449 1 . . . . . . . 2.9 1 1 450 1 . . . . . . . 3.5 1 1 451 1 . . . . . . . 4.9 1 1 452 1 . . . . . . . 3.2 1 1 453 1 . . . . . . . 4.7 1 1 454 1 . . . . . . . 2.8 1 1 455 1 . . . . . . . 2.8 1 1 456 1 . . . . . . . 4.0 1 1 457 1 . . . . . . . 3.7 1 1 458 1 . . . . . . . 3.4 1 1 459 1 . . . . . . . 2.6 1 1 460 1 . . . . . . . 4.3 1 1 461 1 . . . . . . . 2.5 1 1 462 1 . . . . . . . 4.9 1 1 463 1 . . . . . . . 4.4 1 1 464 1 . . . . . . . 5.1 1 1 465 1 . . . . . . . 5.5 1 1 466 1 . . . . . . . 4.8 1 1 467 1 . . . . . . . 3.1 1 1 468 1 . . . . . . . 2.8 1 1 469 1 . . . . . . . 3.7 1 1 470 1 . . . . . . . 3.1 1 1 471 1 . . . . . . . 4.8 1 1 472 1 . . . . . . . 5.4 1 1 473 1 . . . . . . . 5.0 1 1 474 1 . . . . . . . 2.7 1 1 475 1 . . . . . . . 3.6 1 1 476 1 . . . . . . . 4.6 1 1 477 1 . . . . . . . 4.8 1 1 478 1 . . . . . . . 5.1 1 1 479 1 . . . . . . . 3.8 1 1 480 1 . . . . . . . 5.2 1 1 481 1 . . . . . . . 5.0 1 1 482 1 . . . . . . . 4.6 1 1 483 1 . . . . . . . 3.8 1 1 484 1 . . . . . . . 5.2 1 1 485 1 . . . . . . . 5.2 1 1 486 1 . . . . . . . 4.9 1 1 487 1 . . . . . . . 2.4 1 1 488 1 . . . . . . . 5.1 1 1 489 1 . . . . . . . 4.7 1 1 490 1 . . . . . . . 4.5 1 1 491 1 . . . . . . . 4.8 1 1 492 1 . . . . . . . 4.7 1 1 493 1 . . . . . . . 5.1 1 1 494 1 . . . . . . . 5.0 1 1 495 1 . . . . . . . 5.2 1 1 496 1 . . . . . . . 4.0 1 1 497 1 . . . . . . . 3.2 1 1 498 1 . . . . . . . 5.0 1 1 499 1 . . . . . . . 3.4 1 1 500 1 . . . . . . . 4.8 1 1 501 1 . . . . . . . 3.3 1 1 502 1 . . . . . . . 3.6 1 1 503 1 . . . . . . . 3.3 1 1 504 1 . . . . . . . 5.1 1 1 505 1 . . . . . . . 3.2 1 1 506 1 . . . . . . . 4.0 1 1 507 1 . . . . . . . 4.7 1 1 508 1 . . . . . . . 2.8 1 1 509 1 . . . . . . . 3.7 1 1 510 1 . . . . . . . 3.7 1 1 511 1 . . . . . . . 5.2 1 1 512 1 . . . . . . . 4.5 1 1 513 1 . . . . . . . 4.7 1 1 514 1 . . . . . . . 4.8 1 1 515 1 . . . . . . . 3.7 1 1 516 1 . . . . . . . 4.4 1 1 517 1 . . . . . . . 4.4 1 1 518 1 . . . . . . . 2.3 1 1 519 1 . . . . . . . 5.2 1 1 520 1 . . . . . . . 4.8 1 1 521 1 . . . . . . . 4.9 1 1 522 1 . . . . . . . 2.7 1 1 523 1 . . . . . . . 3.6 1 1 524 1 . . . . . . . 3.2 1 1 525 1 . . . . . . . 4.7 1 1 526 1 . . . . . . . 4.8 1 1 527 1 . . . . . . . 2.7 1 1 528 1 . . . . . . . 3.5 1 1 529 1 . . . . . . . 4.9 1 1 530 1 . . . . . . . 3.9 1 1 531 1 . . . . . . . 5.1 1 1 532 1 . . . . . . . 4.7 1 1 533 1 . . . . . . . 4.5 1 1 534 1 . . . . . . . 4.2 1 1 535 1 . . . . . . . 3.5 1 1 536 1 . . . . . . . 4.5 1 1 537 1 . . . . . . . 2.5 1 1 538 1 . . . . . . . 5.2 1 1 539 1 . . . . . . . 4.2 1 1 540 1 . . . . . . . 2.9 1 1 541 1 . . . . . . . 3.7 1 1 542 1 . . . . . . . 3.3 1 1 543 1 . . . . . . . 4.9 1 1 544 1 . . . . . . . 4.4 1 1 545 1 . . . . . . . 3.5 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 GLN C C -7.007 -1.710 -5.078 1.00 . A A . 22 GLN C 1 1 1 2 1 1 1 GLN CA C -6.273 -1.099 -6.287 1.00 . A A . 22 GLN CA 1 1 1 3 1 1 1 GLN CB C -4.993 -0.314 -5.890 1.00 . A A . 22 GLN CB 1 1 1 4 1 1 1 GLN CD C -3.210 -2.131 -6.300 1.00 . A A . 22 GLN CD 1 1 1 5 1 1 1 GLN CG C -3.734 -0.744 -6.668 1.00 . A A . 22 GLN CG 1 1 1 6 1 1 1 GLN H1 H -8.017 -0.764 -7.344 1.00 . A A . 22 GLN H1 1 1 1 7 1 1 1 GLN H2 H -7.484 0.549 -6.520 1.00 . A A . 22 GLN H2 1 1 1 8 1 1 1 GLN H3 H -6.741 0.096 -7.915 1.00 . A A . 22 GLN H3 1 1 1 9 1 1 1 GLN HA H -5.971 -1.942 -6.911 1.00 . A A . 22 GLN HA 1 1 1 10 1 1 1 GLN HB2 H -5.142 0.752 -6.076 1.00 . A A . 22 GLN HB2 1 1 1 11 1 1 1 GLN HB3 H -4.796 -0.413 -4.823 1.00 . A A . 22 GLN HB3 1 1 1 12 1 1 1 GLN HE21 H -1.800 -2.109 -7.751 1.00 . A A . 22 GLN HE21 1 1 1 13 1 1 1 GLN HE22 H -1.879 -3.551 -6.744 1.00 . A A . 22 GLN HE22 1 1 1 14 1 1 1 GLN HG2 H -3.942 -0.712 -7.740 1.00 . A A . 22 GLN HG2 1 1 1 15 1 1 1 GLN HG3 H -2.941 -0.024 -6.465 1.00 . A A . 22 GLN HG3 1 1 1 16 1 1 1 GLN N N -7.194 -0.242 -7.079 1.00 . A A . 22 GLN N 1 1 1 17 1 1 1 GLN NE2 N -2.212 -2.631 -6.991 1.00 . A A . 22 GLN NE2 1 1 1 18 1 1 1 GLN O O -8.206 -1.484 -4.896 1.00 . A A . 22 GLN O 1 1 1 19 1 1 1 GLN OE1 O -3.687 -2.797 -5.392 1.00 . A A . 22 GLN OE1 1 1 1 20 1 1 2 THR C C -6.091 -2.676 -1.809 1.00 . A A . 23 THR C 1 1 1 21 1 1 2 THR CA C -6.812 -3.192 -3.057 1.00 . A A . 23 THR CA 1 1 1 22 1 1 2 THR CB C -6.595 -4.710 -3.213 1.00 . A A . 23 THR CB 1 1 1 23 1 1 2 THR CG2 C -7.132 -5.553 -2.054 1.00 . A A . 23 THR CG2 1 1 1 24 1 1 2 THR H H -5.314 -2.625 -4.462 1.00 . A A . 23 THR H 1 1 1 25 1 1 2 THR HA H -7.879 -3.009 -2.943 1.00 . A A . 23 THR HA 1 1 1 26 1 1 2 THR HB H -5.527 -4.908 -3.317 1.00 . A A . 23 THR HB 1 1 1 27 1 1 2 THR HG1 H -6.780 -4.834 -5.145 1.00 . A A . 23 THR HG1 1 1 1 28 1 1 2 THR HG21 H -8.199 -5.380 -1.925 1.00 . A A . 23 THR HG21 1 1 1 29 1 1 2 THR HG22 H -6.970 -6.609 -2.272 1.00 . A A . 23 THR HG22 1 1 1 30 1 1 2 THR HG23 H -6.605 -5.312 -1.132 1.00 . A A . 23 THR HG23 1 1 1 31 1 1 2 THR N N -6.301 -2.491 -4.254 1.00 . A A . 23 THR N 1 1 1 32 1 1 2 THR O O -4.906 -2.340 -1.875 1.00 . A A . 23 THR O 1 1 1 33 1 1 2 THR OG1 O -7.263 -5.172 -4.371 1.00 . A A . 23 THR OG1 1 1 1 34 1 1 3 CYS C C -5.092 -2.832 1.168 1.00 . A A . 24 CYS C 1 1 1 35 1 1 3 CYS CA C -6.263 -2.027 0.570 1.00 . A A . 24 CYS CA 1 1 1 36 1 1 3 CYS CB C -7.406 -1.969 1.582 1.00 . A A . 24 CYS CB 1 1 1 37 1 1 3 CYS H H -7.767 -2.860 -0.694 1.00 . A A . 24 CYS H 1 1 1 38 1 1 3 CYS HA H -5.922 -1.008 0.369 1.00 . A A . 24 CYS HA 1 1 1 39 1 1 3 CYS HB2 H -8.312 -1.602 1.100 1.00 . A A . 24 CYS HB2 1 1 1 40 1 1 3 CYS HB3 H -7.603 -2.972 1.960 1.00 . A A . 24 CYS HB3 1 1 1 41 1 1 3 CYS N N -6.791 -2.581 -0.676 1.00 . A A . 24 CYS N 1 1 1 42 1 1 3 CYS O O -5.067 -4.064 1.098 1.00 . A A . 24 CYS O 1 1 1 43 1 1 3 CYS SG S -6.913 -0.862 2.929 1.00 . A A . 24 CYS SG 1 1 1 44 1 1 4 TYR C C -3.749 -3.452 3.975 1.00 . A A . 25 TYR C 1 1 1 45 1 1 4 TYR CA C -3.174 -2.757 2.725 1.00 . A A . 25 TYR CA 1 1 1 46 1 1 4 TYR CB C -2.107 -1.721 3.125 1.00 . A A . 25 TYR CB 1 1 1 47 1 1 4 TYR CD1 C -3.522 0.048 4.297 1.00 . A A . 25 TYR CD1 1 1 1 48 1 1 4 TYR CD2 C -1.663 -0.961 5.504 1.00 . A A . 25 TYR CD2 1 1 1 49 1 1 4 TYR CE1 C -3.840 0.815 5.433 1.00 . A A . 25 TYR CE1 1 1 1 50 1 1 4 TYR CE2 C -1.967 -0.178 6.637 1.00 . A A . 25 TYR CE2 1 1 1 51 1 1 4 TYR CG C -2.435 -0.850 4.331 1.00 . A A . 25 TYR CG 1 1 1 52 1 1 4 TYR CZ C -3.064 0.710 6.604 1.00 . A A . 25 TYR CZ 1 1 1 53 1 1 4 TYR H H -4.284 -1.134 1.886 1.00 . A A . 25 TYR H 1 1 1 54 1 1 4 TYR HA H -2.674 -3.529 2.146 1.00 . A A . 25 TYR HA 1 1 1 55 1 1 4 TYR HB2 H -1.201 -2.279 3.355 1.00 . A A . 25 TYR HB2 1 1 1 56 1 1 4 TYR HB3 H -1.877 -1.082 2.274 1.00 . A A . 25 TYR HB3 1 1 1 57 1 1 4 TYR HD1 H -4.128 0.144 3.408 1.00 . A A . 25 TYR HD1 1 1 1 58 1 1 4 TYR HD2 H -0.835 -1.657 5.543 1.00 . A A . 25 TYR HD2 1 1 1 59 1 1 4 TYR HE1 H -4.693 1.472 5.419 1.00 . A A . 25 TYR HE1 1 1 1 60 1 1 4 TYR HE2 H -1.371 -0.267 7.534 1.00 . A A . 25 TYR HE2 1 1 1 61 1 1 4 TYR HH H -2.803 1.272 8.449 1.00 . A A . 25 TYR HH 1 1 1 62 1 1 4 TYR N N -4.181 -2.138 1.856 1.00 . A A . 25 TYR N 1 1 1 63 1 1 4 TYR O O -3.093 -4.344 4.521 1.00 . A A . 25 TYR O 1 1 1 64 1 1 4 TYR OH O -3.394 1.450 7.698 1.00 . A A . 25 TYR OH 1 1 1 65 1 1 5 ASN C C -6.988 -3.821 5.748 1.00 . A A . 26 ASN C 1 1 1 66 1 1 5 ASN CA C -5.488 -3.456 5.745 1.00 . A A . 26 ASN CA 1 1 1 67 1 1 5 ASN CB C -5.192 -2.299 6.715 1.00 . A A . 26 ASN CB 1 1 1 68 1 1 5 ASN CG C -5.620 -2.608 8.140 1.00 . A A . 26 ASN CG 1 1 1 69 1 1 5 ASN H H -5.432 -2.341 3.915 1.00 . A A . 26 ASN H 1 1 1 70 1 1 5 ASN HA H -4.960 -4.340 6.104 1.00 . A A . 26 ASN HA 1 1 1 71 1 1 5 ASN HB2 H -4.123 -2.093 6.714 1.00 . A A . 26 ASN HB2 1 1 1 72 1 1 5 ASN HB3 H -5.711 -1.399 6.385 1.00 . A A . 26 ASN HB3 1 1 1 73 1 1 5 ASN HD21 H -3.922 -3.637 8.524 1.00 . A A . 26 ASN HD21 1 1 1 74 1 1 5 ASN HD22 H -5.086 -3.530 9.835 1.00 . A A . 26 ASN HD22 1 1 1 75 1 1 5 ASN N N -4.954 -3.071 4.429 1.00 . A A . 26 ASN N 1 1 1 76 1 1 5 ASN ND2 N -4.808 -3.322 8.888 1.00 . A A . 26 ASN ND2 1 1 1 77 1 1 5 ASN O O -7.366 -4.796 6.402 1.00 . A A . 26 ASN O 1 1 1 78 1 1 5 ASN OD1 O -6.686 -2.219 8.596 1.00 . A A . 26 ASN OD1 1 1 1 79 1 1 6 CYS C C -9.569 -4.706 4.147 1.00 . A A . 27 CYS C 1 1 1 80 1 1 6 CYS CA C -9.273 -3.385 4.892 1.00 . A A . 27 CYS CA 1 1 1 81 1 1 6 CYS CB C -9.973 -2.210 4.178 1.00 . A A . 27 CYS CB 1 1 1 82 1 1 6 CYS H H -7.489 -2.285 4.514 1.00 . A A . 27 CYS H 1 1 1 83 1 1 6 CYS HA H -9.687 -3.468 5.899 1.00 . A A . 27 CYS HA 1 1 1 84 1 1 6 CYS HB2 H -9.629 -2.153 3.144 1.00 . A A . 27 CYS HB2 1 1 1 85 1 1 6 CYS HB3 H -11.048 -2.409 4.160 1.00 . A A . 27 CYS HB3 1 1 1 86 1 1 6 CYS N N -7.835 -3.101 5.002 1.00 . A A . 27 CYS N 1 1 1 87 1 1 6 CYS O O -10.637 -5.296 4.321 1.00 . A A . 27 CYS O 1 1 1 88 1 1 6 CYS SG S -9.687 -0.622 5.012 1.00 . A A . 27 CYS SG 1 1 1 89 1 1 7 GLY C C -9.874 -6.007 1.219 1.00 . A A . 28 GLY C 1 1 1 90 1 1 7 GLY CA C -8.849 -6.266 2.339 1.00 . A A . 28 GLY CA 1 1 1 91 1 1 7 GLY H H -7.783 -4.639 3.220 1.00 . A A . 28 GLY H 1 1 1 92 1 1 7 GLY HA2 H -9.171 -7.142 2.901 1.00 . A A . 28 GLY HA2 1 1 1 93 1 1 7 GLY HA3 H -7.894 -6.496 1.867 1.00 . A A . 28 GLY HA3 1 1 1 94 1 1 7 GLY N N -8.655 -5.144 3.271 1.00 . A A . 28 GLY N 1 1 1 95 1 1 7 GLY O O -10.215 -6.931 0.477 1.00 . A A . 28 GLY O 1 1 1 96 1 1 8 LYS C C -10.719 -3.905 -1.216 1.00 . A A . 29 LYS C 1 1 1 97 1 1 8 LYS CA C -11.389 -4.361 0.096 1.00 . A A . 29 LYS CA 1 1 1 98 1 1 8 LYS CB C -12.243 -3.197 0.651 1.00 . A A . 29 LYS CB 1 1 1 99 1 1 8 LYS CD C -13.486 -4.345 2.627 1.00 . A A . 29 LYS CD 1 1 1 100 1 1 8 LYS CE C -13.332 -5.859 2.436 1.00 . A A . 29 LYS CE 1 1 1 101 1 1 8 LYS CG C -13.584 -3.584 1.297 1.00 . A A . 29 LYS CG 1 1 1 102 1 1 8 LYS H H -10.039 -4.068 1.726 1.00 . A A . 29 LYS H 1 1 1 103 1 1 8 LYS HA H -12.038 -5.207 -0.132 1.00 . A A . 29 LYS HA 1 1 1 104 1 1 8 LYS HB2 H -11.657 -2.611 1.359 1.00 . A A . 29 LYS HB2 1 1 1 105 1 1 8 LYS HB3 H -12.495 -2.528 -0.171 1.00 . A A . 29 LYS HB3 1 1 1 106 1 1 8 LYS HD2 H -12.655 -3.945 3.208 1.00 . A A . 29 LYS HD2 1 1 1 107 1 1 8 LYS HD3 H -14.406 -4.165 3.188 1.00 . A A . 29 LYS HD3 1 1 1 108 1 1 8 LYS HE2 H -14.230 -6.246 1.944 1.00 . A A . 29 LYS HE2 1 1 1 109 1 1 8 LYS HE3 H -12.481 -6.052 1.781 1.00 . A A . 29 LYS HE3 1 1 1 110 1 1 8 LYS HG2 H -14.120 -2.655 1.491 1.00 . A A . 29 LYS HG2 1 1 1 111 1 1 8 LYS HG3 H -14.181 -4.159 0.585 1.00 . A A . 29 LYS HG3 1 1 1 112 1 1 8 LYS HZ1 H -13.894 -6.372 4.371 1.00 . A A . 29 LYS HZ1 1 1 1 113 1 1 8 LYS HZ2 H -13.032 -7.541 3.618 1.00 . A A . 29 LYS HZ2 1 1 1 114 1 1 8 LYS HZ3 H -12.272 -6.200 4.179 1.00 . A A . 29 LYS HZ3 1 1 1 115 1 1 8 LYS N N -10.398 -4.776 1.105 1.00 . A A . 29 LYS N 1 1 1 116 1 1 8 LYS NZ N -13.123 -6.540 3.737 1.00 . A A . 29 LYS NZ 1 1 1 117 1 1 8 LYS O O -9.634 -3.317 -1.161 1.00 . A A . 29 LYS O 1 1 1 118 1 1 9 PRO C C -11.495 -1.894 -3.532 1.00 . A A . 30 PRO C 1 1 1 119 1 1 9 PRO CA C -11.070 -3.376 -3.621 1.00 . A A . 30 PRO CA 1 1 1 120 1 1 9 PRO CB C -11.836 -4.158 -4.699 1.00 . A A . 30 PRO CB 1 1 1 121 1 1 9 PRO CD C -12.608 -4.863 -2.552 1.00 . A A . 30 PRO CD 1 1 1 122 1 1 9 PRO CG C -13.106 -4.587 -3.969 1.00 . A A . 30 PRO CG 1 1 1 123 1 1 9 PRO HA H -10.002 -3.423 -3.837 1.00 . A A . 30 PRO HA 1 1 1 124 1 1 9 PRO HB2 H -12.058 -3.570 -5.589 1.00 . A A . 30 PRO HB2 1 1 1 125 1 1 9 PRO HB3 H -11.263 -5.045 -4.976 1.00 . A A . 30 PRO HB3 1 1 1 126 1 1 9 PRO HD2 H -13.377 -4.573 -1.833 1.00 . A A . 30 PRO HD2 1 1 1 127 1 1 9 PRO HD3 H -12.377 -5.924 -2.447 1.00 . A A . 30 PRO HD3 1 1 1 128 1 1 9 PRO HG2 H -13.819 -3.760 -3.955 1.00 . A A . 30 PRO HG2 1 1 1 129 1 1 9 PRO HG3 H -13.554 -5.473 -4.421 1.00 . A A . 30 PRO HG3 1 1 1 130 1 1 9 PRO N N -11.386 -4.083 -2.376 1.00 . A A . 30 PRO N 1 1 1 131 1 1 9 PRO O O -11.814 -1.388 -2.450 1.00 . A A . 30 PRO O 1 1 1 132 1 1 10 GLY C C -10.997 1.157 -3.845 1.00 . A A . 31 GLY C 1 1 1 133 1 1 10 GLY CA C -11.891 0.250 -4.701 1.00 . A A . 31 GLY CA 1 1 1 134 1 1 10 GLY H H -11.219 -1.616 -5.519 1.00 . A A . 31 GLY H 1 1 1 135 1 1 10 GLY HA2 H -12.921 0.351 -4.355 1.00 . A A . 31 GLY HA2 1 1 1 136 1 1 10 GLY HA3 H -11.838 0.601 -5.733 1.00 . A A . 31 GLY HA3 1 1 1 137 1 1 10 GLY N N -11.496 -1.168 -4.656 1.00 . A A . 31 GLY N 1 1 1 138 1 1 10 GLY O O -11.457 2.166 -3.303 1.00 . A A . 31 GLY O 1 1 1 139 1 1 11 HIS C C -7.588 2.010 -3.581 1.00 . A A . 32 HIS C 1 1 1 140 1 1 11 HIS CA C -8.755 1.400 -2.804 1.00 . A A . 32 HIS CA 1 1 1 141 1 1 11 HIS CB C -8.272 0.378 -1.763 1.00 . A A . 32 HIS CB 1 1 1 142 1 1 11 HIS CD2 C -8.658 0.980 0.695 1.00 . A A . 32 HIS CD2 1 1 1 143 1 1 11 HIS CE1 C -10.664 0.143 1.002 1.00 . A A . 32 HIS CE1 1 1 1 144 1 1 11 HIS CG C -9.067 0.423 -0.485 1.00 . A A . 32 HIS CG 1 1 1 145 1 1 11 HIS H H -9.428 -0.066 -4.179 1.00 . A A . 32 HIS H 1 1 1 146 1 1 11 HIS HA H -9.235 2.218 -2.270 1.00 . A A . 32 HIS HA 1 1 1 147 1 1 11 HIS HB2 H -8.319 -0.629 -2.179 1.00 . A A . 32 HIS HB2 1 1 1 148 1 1 11 HIS HB3 H -7.229 0.576 -1.512 1.00 . A A . 32 HIS HB3 1 1 1 149 1 1 11 HIS HD1 H -10.904 -0.562 -0.975 1.00 . A A . 32 HIS HD1 1 1 1 150 1 1 11 HIS HD2 H -7.705 1.462 0.864 1.00 . A A . 32 HIS HD2 1 1 1 151 1 1 11 HIS HE1 H -11.607 -0.144 1.454 1.00 . A A . 32 HIS HE1 1 1 1 152 1 1 11 HIS N N -9.728 0.769 -3.690 1.00 . A A . 32 HIS N 1 1 1 153 1 1 11 HIS ND1 N -10.327 -0.090 -0.279 1.00 . A A . 32 HIS ND1 1 1 1 154 1 1 11 HIS NE2 N -9.669 0.780 1.649 1.00 . A A . 32 HIS NE2 1 1 1 155 1 1 11 HIS O O -7.220 1.559 -4.668 1.00 . A A . 32 HIS O 1 1 1 156 1 1 12 LEU C C -5.199 4.536 -2.316 1.00 . A A . 33 LEU C 1 1 1 157 1 1 12 LEU CA C -5.968 3.931 -3.504 1.00 . A A . 33 LEU CA 1 1 1 158 1 1 12 LEU CB C -6.616 5.081 -4.316 1.00 . A A . 33 LEU CB 1 1 1 159 1 1 12 LEU CD1 C -7.949 5.935 -6.259 1.00 . A A . 33 LEU CD1 1 1 1 160 1 1 12 LEU CD2 C -6.267 4.165 -6.666 1.00 . A A . 33 LEU CD2 1 1 1 161 1 1 12 LEU CG C -7.281 4.701 -5.653 1.00 . A A . 33 LEU CG 1 1 1 162 1 1 12 LEU H H -7.348 3.289 -2.058 1.00 . A A . 33 LEU H 1 1 1 163 1 1 12 LEU HA H -5.269 3.367 -4.121 1.00 . A A . 33 LEU HA 1 1 1 164 1 1 12 LEU HB2 H -7.369 5.561 -3.686 1.00 . A A . 33 LEU HB2 1 1 1 165 1 1 12 LEU HB3 H -5.856 5.833 -4.535 1.00 . A A . 33 LEU HB3 1 1 1 166 1 1 12 LEU HD11 H -8.700 6.323 -5.570 1.00 . A A . 33 LEU HD11 1 1 1 167 1 1 12 LEU HD12 H -7.206 6.711 -6.451 1.00 . A A . 33 LEU HD12 1 1 1 168 1 1 12 LEU HD13 H -8.441 5.667 -7.195 1.00 . A A . 33 LEU HD13 1 1 1 169 1 1 12 LEU HD21 H -5.482 4.902 -6.839 1.00 . A A . 33 LEU HD21 1 1 1 170 1 1 12 LEU HD22 H -5.820 3.243 -6.299 1.00 . A A . 33 LEU HD22 1 1 1 171 1 1 12 LEU HD23 H -6.770 3.950 -7.610 1.00 . A A . 33 LEU HD23 1 1 1 172 1 1 12 LEU HG H -8.054 3.954 -5.486 1.00 . A A . 33 LEU HG 1 1 1 173 1 1 12 LEU N N -7.021 3.057 -2.985 1.00 . A A . 33 LEU N 1 1 1 174 1 1 12 LEU O O -5.666 4.488 -1.176 1.00 . A A . 33 LEU O 1 1 1 175 1 1 13 SER C C -4.020 7.197 -1.001 1.00 . A A . 34 SER C 1 1 1 176 1 1 13 SER CA C -3.277 6.033 -1.693 1.00 . A A . 34 SER CA 1 1 1 177 1 1 13 SER CB C -2.093 6.598 -2.485 1.00 . A A . 34 SER CB 1 1 1 178 1 1 13 SER H H -3.752 5.160 -3.565 1.00 . A A . 34 SER H 1 1 1 179 1 1 13 SER HA H -2.888 5.386 -0.906 1.00 . A A . 34 SER HA 1 1 1 180 1 1 13 SER HB2 H -2.465 7.304 -3.229 1.00 . A A . 34 SER HB2 1 1 1 181 1 1 13 SER HB3 H -1.419 7.124 -1.809 1.00 . A A . 34 SER HB3 1 1 1 182 1 1 13 SER HG H -0.748 5.937 -3.751 1.00 . A A . 34 SER HG 1 1 1 183 1 1 13 SER N N -4.088 5.210 -2.612 1.00 . A A . 34 SER N 1 1 1 184 1 1 13 SER O O -3.429 7.910 -0.188 1.00 . A A . 34 SER O 1 1 1 185 1 1 13 SER OG O -1.400 5.545 -3.139 1.00 . A A . 34 SER OG 1 1 1 186 1 1 14 SER C C -7.460 7.774 -0.077 1.00 . A A . 35 SER C 1 1 1 187 1 1 14 SER CA C -6.216 8.396 -0.739 1.00 . A A . 35 SER CA 1 1 1 188 1 1 14 SER CB C -6.652 9.375 -1.835 1.00 . A A . 35 SER CB 1 1 1 189 1 1 14 SER H H -5.673 6.851 -2.082 1.00 . A A . 35 SER H 1 1 1 190 1 1 14 SER HA H -5.694 8.965 0.030 1.00 . A A . 35 SER HA 1 1 1 191 1 1 14 SER HB2 H -7.357 10.098 -1.421 1.00 . A A . 35 SER HB2 1 1 1 192 1 1 14 SER HB3 H -5.775 9.913 -2.203 1.00 . A A . 35 SER HB3 1 1 1 193 1 1 14 SER HG H -7.532 9.317 -3.587 1.00 . A A . 35 SER HG 1 1 1 194 1 1 14 SER N N -5.302 7.402 -1.324 1.00 . A A . 35 SER N 1 1 1 195 1 1 14 SER O O -8.139 8.451 0.699 1.00 . A A . 35 SER O 1 1 1 196 1 1 14 SER OG O -7.258 8.668 -2.911 1.00 . A A . 35 SER OG 1 1 1 197 1 1 15 GLN C C -8.260 5.249 1.759 1.00 . A A . 36 GLN C 1 1 1 198 1 1 15 GLN CA C -8.782 5.721 0.385 1.00 . A A . 36 GLN CA 1 1 1 199 1 1 15 GLN CB C -9.200 4.520 -0.486 1.00 . A A . 36 GLN CB 1 1 1 200 1 1 15 GLN CD C -11.749 4.633 -0.420 1.00 . A A . 36 GLN CD 1 1 1 201 1 1 15 GLN CG C -10.503 3.839 -0.037 1.00 . A A . 36 GLN CG 1 1 1 202 1 1 15 GLN H H -7.125 5.979 -0.935 1.00 . A A . 36 GLN H 1 1 1 203 1 1 15 GLN HA H -9.652 6.360 0.548 1.00 . A A . 36 GLN HA 1 1 1 204 1 1 15 GLN HB2 H -9.325 4.849 -1.520 1.00 . A A . 36 GLN HB2 1 1 1 205 1 1 15 GLN HB3 H -8.397 3.781 -0.466 1.00 . A A . 36 GLN HB3 1 1 1 206 1 1 15 GLN HE21 H -12.041 3.562 -2.123 1.00 . A A . 36 GLN HE21 1 1 1 207 1 1 15 GLN HE22 H -13.203 4.842 -1.784 1.00 . A A . 36 GLN HE22 1 1 1 208 1 1 15 GLN HG2 H -10.566 2.861 -0.514 1.00 . A A . 36 GLN HG2 1 1 1 209 1 1 15 GLN HG3 H -10.492 3.673 1.041 1.00 . A A . 36 GLN HG3 1 1 1 210 1 1 15 GLN N N -7.749 6.489 -0.327 1.00 . A A . 36 GLN N 1 1 1 211 1 1 15 GLN NE2 N -12.378 4.320 -1.535 1.00 . A A . 36 GLN NE2 1 1 1 212 1 1 15 GLN O O -8.971 5.344 2.761 1.00 . A A . 36 GLN O 1 1 1 213 1 1 15 GLN OE1 O -12.180 5.547 0.271 1.00 . A A . 36 GLN OE1 1 1 1 214 1 1 16 CYS C C -4.745 4.960 2.821 1.00 . A A . 37 CYS C 1 1 1 215 1 1 16 CYS CA C -6.198 4.449 2.967 1.00 . A A . 37 CYS CA 1 1 1 216 1 1 16 CYS CB C -6.245 2.918 3.139 1.00 . A A . 37 CYS CB 1 1 1 217 1 1 16 CYS H H -6.487 4.821 0.911 1.00 . A A . 37 CYS H 1 1 1 218 1 1 16 CYS HA H -6.620 4.921 3.851 1.00 . A A . 37 CYS HA 1 1 1 219 1 1 16 CYS HB2 H -6.179 2.433 2.163 1.00 . A A . 37 CYS HB2 1 1 1 220 1 1 16 CYS HB3 H -5.385 2.591 3.718 1.00 . A A . 37 CYS HB3 1 1 1 221 1 1 16 CYS N N -6.989 4.822 1.791 1.00 . A A . 37 CYS N 1 1 1 222 1 1 16 CYS O O -4.365 5.488 1.772 1.00 . A A . 37 CYS O 1 1 1 223 1 1 16 CYS SG S -7.754 2.415 4.014 1.00 . A A . 37 CYS SG 1 1 1 224 1 1 17 ARG C C -1.674 4.721 2.735 1.00 . A A . 38 ARG C 1 1 1 225 1 1 17 ARG CA C -2.512 5.238 3.912 1.00 . A A . 38 ARG CA 1 1 1 226 1 1 17 ARG CB C -1.845 4.838 5.244 1.00 . A A . 38 ARG CB 1 1 1 227 1 1 17 ARG CD C -3.390 5.010 7.329 1.00 . A A . 38 ARG CD 1 1 1 228 1 1 17 ARG CG C -2.277 5.648 6.484 1.00 . A A . 38 ARG CG 1 1 1 229 1 1 17 ARG CZ C -5.795 4.502 6.815 1.00 . A A . 38 ARG CZ 1 1 1 230 1 1 17 ARG H H -4.306 4.353 4.696 1.00 . A A . 38 ARG H 1 1 1 231 1 1 17 ARG HA H -2.488 6.326 3.830 1.00 . A A . 38 ARG HA 1 1 1 232 1 1 17 ARG HB2 H -1.982 3.770 5.426 1.00 . A A . 38 ARG HB2 1 1 1 233 1 1 17 ARG HB3 H -0.772 5.006 5.128 1.00 . A A . 38 ARG HB3 1 1 1 234 1 1 17 ARG HD2 H -3.214 3.938 7.387 1.00 . A A . 38 ARG HD2 1 1 1 235 1 1 17 ARG HD3 H -3.310 5.408 8.342 1.00 . A A . 38 ARG HD3 1 1 1 236 1 1 17 ARG HE H -4.928 6.271 6.576 1.00 . A A . 38 ARG HE 1 1 1 237 1 1 17 ARG HG2 H -1.403 5.721 7.130 1.00 . A A . 38 ARG HG2 1 1 1 238 1 1 17 ARG HG3 H -2.551 6.664 6.199 1.00 . A A . 38 ARG HG3 1 1 1 239 1 1 17 ARG HH11 H -4.840 2.847 7.442 1.00 . A A . 38 ARG HH11 1 1 1 240 1 1 17 ARG HH12 H -6.540 2.665 7.095 1.00 . A A . 38 ARG HH12 1 1 1 241 1 1 17 ARG HH21 H -7.085 5.915 6.201 1.00 . A A . 38 ARG HH21 1 1 1 242 1 1 17 ARG HH22 H -7.720 4.302 6.307 1.00 . A A . 38 ARG HH22 1 1 1 243 1 1 17 ARG N N -3.923 4.794 3.871 1.00 . A A . 38 ARG N 1 1 1 244 1 1 17 ARG NE N -4.749 5.311 6.833 1.00 . A A . 38 ARG NE 1 1 1 245 1 1 17 ARG NH1 N -5.719 3.244 7.137 1.00 . A A . 38 ARG NH1 1 1 1 246 1 1 17 ARG NH2 N -6.956 4.945 6.434 1.00 . A A . 38 ARG NH2 1 1 1 247 1 1 17 ARG O O -0.802 5.444 2.249 1.00 . A A . 38 ARG O 1 1 1 248 1 1 18 ALA C C -2.370 1.806 0.495 1.00 . A A . 39 ALA C 1 1 1 249 1 1 18 ALA CA C -1.456 2.947 1.001 1.00 . A A . 39 ALA CA 1 1 1 250 1 1 18 ALA CB C -0.039 2.407 1.250 1.00 . A A . 39 ALA CB 1 1 1 251 1 1 18 ALA H H -2.673 2.980 2.734 1.00 . A A . 39 ALA H 1 1 1 252 1 1 18 ALA HA H -1.416 3.735 0.247 1.00 . A A . 39 ALA HA 1 1 1 253 1 1 18 ALA HB1 H -0.080 1.611 1.993 1.00 . A A . 39 ALA HB1 1 1 1 254 1 1 18 ALA HB2 H 0.375 1.999 0.328 1.00 . A A . 39 ALA HB2 1 1 1 255 1 1 18 ALA HB3 H 0.617 3.203 1.606 1.00 . A A . 39 ALA HB3 1 1 1 256 1 1 18 ALA N N -1.963 3.511 2.253 1.00 . A A . 39 ALA N 1 1 1 257 1 1 18 ALA O O -3.092 1.199 1.294 1.00 . A A . 39 ALA O 1 1 1 258 1 1 19 PRO C C -1.808 -0.978 -0.838 1.00 . A A . 40 PRO C 1 1 1 259 1 1 19 PRO CA C -2.772 0.143 -1.278 1.00 . A A . 40 PRO CA 1 1 1 260 1 1 19 PRO CB C -2.831 0.295 -2.802 1.00 . A A . 40 PRO CB 1 1 1 261 1 1 19 PRO CD C -1.698 2.201 -1.889 1.00 . A A . 40 PRO CD 1 1 1 262 1 1 19 PRO CG C -1.691 1.269 -3.101 1.00 . A A . 40 PRO CG 1 1 1 263 1 1 19 PRO HA H -3.770 -0.078 -0.899 1.00 . A A . 40 PRO HA 1 1 1 264 1 1 19 PRO HB2 H -2.706 -0.653 -3.325 1.00 . A A . 40 PRO HB2 1 1 1 265 1 1 19 PRO HB3 H -3.780 0.760 -3.074 1.00 . A A . 40 PRO HB3 1 1 1 266 1 1 19 PRO HD2 H -0.680 2.507 -1.650 1.00 . A A . 40 PRO HD2 1 1 1 267 1 1 19 PRO HD3 H -2.309 3.078 -2.107 1.00 . A A . 40 PRO HD3 1 1 1 268 1 1 19 PRO HG2 H -0.745 0.727 -3.140 1.00 . A A . 40 PRO HG2 1 1 1 269 1 1 19 PRO HG3 H -1.858 1.814 -4.030 1.00 . A A . 40 PRO HG3 1 1 1 270 1 1 19 PRO N N -2.313 1.447 -0.802 1.00 . A A . 40 PRO N 1 1 1 271 1 1 19 PRO O O -0.707 -0.710 -0.350 1.00 . A A . 40 PRO O 1 1 1 272 1 1 20 LYS C C -0.003 -3.562 -1.073 1.00 . A A . 41 LYS C 1 1 1 273 1 1 20 LYS CA C -1.472 -3.468 -0.632 1.00 . A A . 41 LYS CA 1 1 1 274 1 1 20 LYS CB C -2.290 -4.695 -1.088 1.00 . A A . 41 LYS CB 1 1 1 275 1 1 20 LYS CD C -1.969 -6.083 1.056 1.00 . A A . 41 LYS CD 1 1 1 276 1 1 20 LYS CE C -1.709 -7.497 1.588 1.00 . A A . 41 LYS CE 1 1 1 277 1 1 20 LYS CG C -1.883 -6.051 -0.479 1.00 . A A . 41 LYS CG 1 1 1 278 1 1 20 LYS H H -3.114 -2.370 -1.467 1.00 . A A . 41 LYS H 1 1 1 279 1 1 20 LYS HA H -1.434 -3.450 0.454 1.00 . A A . 41 LYS HA 1 1 1 280 1 1 20 LYS HB2 H -3.339 -4.528 -0.844 1.00 . A A . 41 LYS HB2 1 1 1 281 1 1 20 LYS HB3 H -2.224 -4.775 -2.175 1.00 . A A . 41 LYS HB3 1 1 1 282 1 1 20 LYS HD2 H -1.226 -5.405 1.479 1.00 . A A . 41 LYS HD2 1 1 1 283 1 1 20 LYS HD3 H -2.966 -5.766 1.363 1.00 . A A . 41 LYS HD3 1 1 1 284 1 1 20 LYS HE2 H -2.440 -8.180 1.147 1.00 . A A . 41 LYS HE2 1 1 1 285 1 1 20 LYS HE3 H -0.713 -7.818 1.267 1.00 . A A . 41 LYS HE3 1 1 1 286 1 1 20 LYS HG2 H -2.557 -6.811 -0.880 1.00 . A A . 41 LYS HG2 1 1 1 287 1 1 20 LYS HG3 H -0.873 -6.309 -0.791 1.00 . A A . 41 LYS HG3 1 1 1 288 1 1 20 LYS HZ1 H -2.719 -7.251 3.391 1.00 . A A . 41 LYS HZ1 1 1 1 289 1 1 20 LYS HZ2 H -1.648 -8.481 3.417 1.00 . A A . 41 LYS HZ2 1 1 1 290 1 1 20 LYS HZ3 H -1.120 -6.940 3.507 1.00 . A A . 41 LYS HZ3 1 1 1 291 1 1 20 LYS N N -2.193 -2.245 -1.055 1.00 . A A . 41 LYS N 1 1 1 292 1 1 20 LYS NZ N -1.806 -7.544 3.072 1.00 . A A . 41 LYS NZ 1 1 1 293 1 1 20 LYS O O 0.770 -4.311 -0.474 1.00 . A A . 41 LYS O 1 1 1 294 1 1 21 VAL C C 2.724 -2.168 -1.322 1.00 . A A . 42 VAL C 1 1 1 295 1 1 21 VAL CA C 1.802 -2.556 -2.495 1.00 . A A . 42 VAL CA 1 1 1 296 1 1 21 VAL CB C 1.839 -1.458 -3.583 1.00 . A A . 42 VAL CB 1 1 1 297 1 1 21 VAL CG1 C 3.248 -1.216 -4.131 1.00 . A A . 42 VAL CG1 1 1 1 298 1 1 21 VAL CG2 C 0.938 -1.805 -4.779 1.00 . A A . 42 VAL CG2 1 1 1 299 1 1 21 VAL H H -0.310 -2.223 -2.516 1.00 . A A . 42 VAL H 1 1 1 300 1 1 21 VAL HA H 2.189 -3.480 -2.926 1.00 . A A . 42 VAL HA 1 1 1 301 1 1 21 VAL HB H 1.481 -0.524 -3.149 1.00 . A A . 42 VAL HB 1 1 1 302 1 1 21 VAL HG11 H 3.663 -2.147 -4.518 1.00 . A A . 42 VAL HG11 1 1 1 303 1 1 21 VAL HG12 H 3.218 -0.477 -4.931 1.00 . A A . 42 VAL HG12 1 1 1 304 1 1 21 VAL HG13 H 3.897 -0.829 -3.346 1.00 . A A . 42 VAL HG13 1 1 1 305 1 1 21 VAL HG21 H 1.240 -2.763 -5.207 1.00 . A A . 42 VAL HG21 1 1 1 306 1 1 21 VAL HG22 H -0.107 -1.860 -4.475 1.00 . A A . 42 VAL HG22 1 1 1 307 1 1 21 VAL HG23 H 1.021 -1.031 -5.542 1.00 . A A . 42 VAL HG23 1 1 1 308 1 1 21 VAL N N 0.404 -2.781 -2.074 1.00 . A A . 42 VAL N 1 1 1 309 1 1 21 VAL O O 3.890 -2.564 -1.300 1.00 . A A . 42 VAL O 1 1 1 310 1 1 22 CYS C C 1.989 -0.827 2.059 1.00 . A A . 43 CYS C 1 1 1 311 1 1 22 CYS CA C 2.914 -0.882 0.814 1.00 . A A . 43 CYS CA 1 1 1 312 1 1 22 CYS CB C 3.451 0.494 0.370 1.00 . A A . 43 CYS CB 1 1 1 313 1 1 22 CYS H H 1.208 -1.208 -0.397 1.00 . A A . 43 CYS H 1 1 1 314 1 1 22 CYS HA H 3.764 -1.521 1.057 1.00 . A A . 43 CYS HA 1 1 1 315 1 1 22 CYS HB2 H 3.922 0.384 -0.608 1.00 . A A . 43 CYS HB2 1 1 1 316 1 1 22 CYS HB3 H 2.623 1.198 0.272 1.00 . A A . 43 CYS HB3 1 1 1 317 1 1 22 CYS N N 2.196 -1.434 -0.336 1.00 . A A . 43 CYS N 1 1 1 318 1 1 22 CYS O O 1.031 -1.594 2.177 1.00 . A A . 43 CYS O 1 1 1 319 1 1 22 CYS SG S 4.686 1.134 1.533 1.00 . A A . 43 CYS SG 1 1 1 320 1 1 23 PHE C C 1.504 1.976 4.437 1.00 . A A . 44 PHE C 1 1 1 321 1 1 23 PHE CA C 1.484 0.459 4.151 1.00 . A A . 44 PHE CA 1 1 1 322 1 1 23 PHE CB C 1.966 -0.326 5.384 1.00 . A A . 44 PHE CB 1 1 1 323 1 1 23 PHE CD1 C 4.507 -0.198 5.387 1.00 . A A . 44 PHE CD1 1 1 1 324 1 1 23 PHE CD2 C 3.269 1.010 7.102 1.00 . A A . 44 PHE CD2 1 1 1 325 1 1 23 PHE CE1 C 5.714 0.291 5.918 1.00 . A A . 44 PHE CE1 1 1 1 326 1 1 23 PHE CE2 C 4.477 1.497 7.633 1.00 . A A . 44 PHE CE2 1 1 1 327 1 1 23 PHE CG C 3.279 0.163 5.975 1.00 . A A . 44 PHE CG 1 1 1 328 1 1 23 PHE CZ C 5.699 1.140 7.039 1.00 . A A . 44 PHE CZ 1 1 1 329 1 1 23 PHE H H 3.136 0.599 2.800 1.00 . A A . 44 PHE H 1 1 1 330 1 1 23 PHE HA H 0.446 0.183 3.960 1.00 . A A . 44 PHE HA 1 1 1 331 1 1 23 PHE HB2 H 1.196 -0.252 6.152 1.00 . A A . 44 PHE HB2 1 1 1 332 1 1 23 PHE HB3 H 2.057 -1.382 5.127 1.00 . A A . 44 PHE HB3 1 1 1 333 1 1 23 PHE HD1 H 4.527 -0.851 4.526 1.00 . A A . 44 PHE HD1 1 1 1 334 1 1 23 PHE HD2 H 2.331 1.296 7.558 1.00 . A A . 44 PHE HD2 1 1 1 335 1 1 23 PHE HE1 H 6.657 0.013 5.466 1.00 . A A . 44 PHE HE1 1 1 1 336 1 1 23 PHE HE2 H 4.465 2.150 8.496 1.00 . A A . 44 PHE HE2 1 1 1 337 1 1 23 PHE HZ H 6.630 1.518 7.445 1.00 . A A . 44 PHE HZ 1 1 1 338 1 1 23 PHE N N 2.289 0.083 2.985 1.00 . A A . 44 PHE N 1 1 1 339 1 1 23 PHE O O 0.572 2.482 5.067 1.00 . A A . 44 PHE O 1 1 1 340 1 1 24 LYS C C 3.560 4.893 3.197 1.00 . A A . 45 LYS C 1 1 1 341 1 1 24 LYS CA C 2.710 4.158 4.243 1.00 . A A . 45 LYS CA 1 1 1 342 1 1 24 LYS CB C 3.325 4.317 5.650 1.00 . A A . 45 LYS CB 1 1 1 343 1 1 24 LYS CD C 4.010 5.864 7.526 1.00 . A A . 45 LYS CD 1 1 1 344 1 1 24 LYS CE C 4.106 7.326 7.975 1.00 . A A . 45 LYS CE 1 1 1 345 1 1 24 LYS CG C 3.435 5.781 6.105 1.00 . A A . 45 LYS CG 1 1 1 346 1 1 24 LYS H H 3.259 2.234 3.460 1.00 . A A . 45 LYS H 1 1 1 347 1 1 24 LYS HA H 1.730 4.638 4.242 1.00 . A A . 45 LYS HA 1 1 1 348 1 1 24 LYS HB2 H 2.698 3.788 6.368 1.00 . A A . 45 LYS HB2 1 1 1 349 1 1 24 LYS HB3 H 4.317 3.861 5.666 1.00 . A A . 45 LYS HB3 1 1 1 350 1 1 24 LYS HD2 H 3.362 5.313 8.210 1.00 . A A . 45 LYS HD2 1 1 1 351 1 1 24 LYS HD3 H 5.004 5.412 7.537 1.00 . A A . 45 LYS HD3 1 1 1 352 1 1 24 LYS HE2 H 4.735 7.872 7.267 1.00 . A A . 45 LYS HE2 1 1 1 353 1 1 24 LYS HE3 H 3.105 7.769 7.945 1.00 . A A . 45 LYS HE3 1 1 1 354 1 1 24 LYS HG2 H 4.089 6.331 5.429 1.00 . A A . 45 LYS HG2 1 1 1 355 1 1 24 LYS HG3 H 2.443 6.236 6.090 1.00 . A A . 45 LYS HG3 1 1 1 356 1 1 24 LYS HZ1 H 4.097 6.953 10.022 1.00 . A A . 45 LYS HZ1 1 1 1 357 1 1 24 LYS HZ2 H 5.604 7.058 9.394 1.00 . A A . 45 LYS HZ2 1 1 1 358 1 1 24 LYS HZ3 H 4.724 8.408 9.636 1.00 . A A . 45 LYS HZ3 1 1 1 359 1 1 24 LYS N N 2.536 2.714 3.976 1.00 . A A . 45 LYS N 1 1 1 360 1 1 24 LYS NZ N 4.669 7.441 9.346 1.00 . A A . 45 LYS NZ 1 1 1 361 1 1 24 LYS O O 3.100 5.900 2.658 1.00 . A A . 45 LYS O 1 1 1 362 1 1 25 CYS C C 5.506 5.030 0.562 1.00 . A A . 46 CYS C 1 1 1 363 1 1 25 CYS CA C 5.775 5.096 2.083 1.00 . A A . 46 CYS CA 1 1 1 364 1 1 25 CYS CB C 7.182 4.592 2.469 1.00 . A A . 46 CYS CB 1 1 1 365 1 1 25 CYS H H 5.102 3.601 3.416 1.00 . A A . 46 CYS H 1 1 1 366 1 1 25 CYS HA H 5.748 6.156 2.338 1.00 . A A . 46 CYS HA 1 1 1 367 1 1 25 CYS HB2 H 7.862 4.730 1.625 1.00 . A A . 46 CYS HB2 1 1 1 368 1 1 25 CYS HB3 H 7.551 5.216 3.287 1.00 . A A . 46 CYS HB3 1 1 1 369 1 1 25 CYS N N 4.775 4.415 2.916 1.00 . A A . 46 CYS N 1 1 1 370 1 1 25 CYS O O 5.797 6.000 -0.139 1.00 . A A . 46 CYS O 1 1 1 371 1 1 25 CYS SG S 7.215 2.861 3.020 1.00 . A A . 46 CYS SG 1 1 1 372 1 1 26 LYS C C 4.967 4.295 -2.520 1.00 . A A . 47 LYS C 1 1 1 373 1 1 26 LYS CA C 4.234 3.775 -1.259 1.00 . A A . 47 LYS CA 1 1 1 374 1 1 26 LYS CB C 2.764 4.243 -1.161 1.00 . A A . 47 LYS CB 1 1 1 375 1 1 26 LYS CD C 1.134 6.159 -0.801 1.00 . A A . 47 LYS CD 1 1 1 376 1 1 26 LYS CE C 0.951 7.514 -0.104 1.00 . A A . 47 LYS CE 1 1 1 377 1 1 26 LYS CG C 2.606 5.737 -0.837 1.00 . A A . 47 LYS CG 1 1 1 378 1 1 26 LYS H H 4.734 3.197 0.737 1.00 . A A . 47 LYS H 1 1 1 379 1 1 26 LYS HA H 4.182 2.700 -1.430 1.00 . A A . 47 LYS HA 1 1 1 380 1 1 26 LYS HB2 H 2.247 4.021 -2.097 1.00 . A A . 47 LYS HB2 1 1 1 381 1 1 26 LYS HB3 H 2.273 3.666 -0.376 1.00 . A A . 47 LYS HB3 1 1 1 382 1 1 26 LYS HD2 H 0.791 6.241 -1.831 1.00 . A A . 47 LYS HD2 1 1 1 383 1 1 26 LYS HD3 H 0.530 5.402 -0.294 1.00 . A A . 47 LYS HD3 1 1 1 384 1 1 26 LYS HE2 H 1.701 8.214 -0.483 1.00 . A A . 47 LYS HE2 1 1 1 385 1 1 26 LYS HE3 H -0.036 7.909 -0.363 1.00 . A A . 47 LYS HE3 1 1 1 386 1 1 26 LYS HG2 H 3.046 5.936 0.136 1.00 . A A . 47 LYS HG2 1 1 1 387 1 1 26 LYS HG3 H 3.131 6.337 -1.579 1.00 . A A . 47 LYS HG3 1 1 1 388 1 1 26 LYS HZ1 H 1.946 7.002 1.664 1.00 . A A . 47 LYS HZ1 1 1 1 389 1 1 26 LYS HZ2 H 0.939 8.287 1.828 1.00 . A A . 47 LYS HZ2 1 1 1 390 1 1 26 LYS HZ3 H 0.334 6.766 1.731 1.00 . A A . 47 LYS HZ3 1 1 1 391 1 1 26 LYS N N 4.882 3.947 0.068 1.00 . A A . 47 LYS N 1 1 1 392 1 1 26 LYS NZ N 1.052 7.392 1.375 1.00 . A A . 47 LYS NZ 1 1 1 393 1 1 26 LYS O O 4.326 4.558 -3.539 1.00 . A A . 47 LYS O 1 1 1 394 1 1 27 GLN C C 7.105 3.810 -4.792 1.00 . A A . 48 GLN C 1 1 1 395 1 1 27 GLN CA C 7.099 4.862 -3.652 1.00 . A A . 48 GLN CA 1 1 1 396 1 1 27 GLN CB C 8.537 5.195 -3.205 1.00 . A A . 48 GLN CB 1 1 1 397 1 1 27 GLN CD C 7.961 7.599 -2.555 1.00 . A A . 48 GLN CD 1 1 1 398 1 1 27 GLN CG C 8.637 6.294 -2.133 1.00 . A A . 48 GLN CG 1 1 1 399 1 1 27 GLN H H 6.769 4.219 -1.626 1.00 . A A . 48 GLN H 1 1 1 400 1 1 27 GLN HA H 6.638 5.774 -4.032 1.00 . A A . 48 GLN HA 1 1 1 401 1 1 27 GLN HB2 H 9.003 4.295 -2.811 1.00 . A A . 48 GLN HB2 1 1 1 402 1 1 27 GLN HB3 H 9.114 5.513 -4.072 1.00 . A A . 48 GLN HB3 1 1 1 403 1 1 27 GLN HE21 H 6.422 7.335 -1.268 1.00 . A A . 48 GLN HE21 1 1 1 404 1 1 27 GLN HE22 H 6.384 8.803 -2.252 1.00 . A A . 48 GLN HE22 1 1 1 405 1 1 27 GLN HG2 H 8.204 5.936 -1.201 1.00 . A A . 48 GLN HG2 1 1 1 406 1 1 27 GLN HG3 H 9.689 6.499 -1.940 1.00 . A A . 48 GLN HG3 1 1 1 407 1 1 27 GLN N N 6.297 4.428 -2.492 1.00 . A A . 48 GLN N 1 1 1 408 1 1 27 GLN NE2 N 6.831 7.943 -1.976 1.00 . A A . 48 GLN NE2 1 1 1 409 1 1 27 GLN O O 6.992 2.616 -4.494 1.00 . A A . 48 GLN O 1 1 1 410 1 1 27 GLN OE1 O 8.429 8.322 -3.426 1.00 . A A . 48 GLN OE1 1 1 1 411 1 1 28 PRO C C 7.740 1.975 -7.350 1.00 . A A . 49 PRO C 1 1 1 412 1 1 28 PRO CA C 7.061 3.357 -7.265 1.00 . A A . 49 PRO CA 1 1 1 413 1 1 28 PRO CB C 7.491 4.212 -8.461 1.00 . A A . 49 PRO CB 1 1 1 414 1 1 28 PRO CD C 7.526 5.581 -6.510 1.00 . A A . 49 PRO CD 1 1 1 415 1 1 28 PRO CG C 7.195 5.632 -7.999 1.00 . A A . 49 PRO CG 1 1 1 416 1 1 28 PRO HA H 5.986 3.193 -7.341 1.00 . A A . 49 PRO HA 1 1 1 417 1 1 28 PRO HB2 H 8.564 4.106 -8.633 1.00 . A A . 49 PRO HB2 1 1 1 418 1 1 28 PRO HB3 H 6.933 3.958 -9.362 1.00 . A A . 49 PRO HB3 1 1 1 419 1 1 28 PRO HD2 H 8.579 5.825 -6.364 1.00 . A A . 49 PRO HD2 1 1 1 420 1 1 28 PRO HD3 H 6.898 6.301 -5.987 1.00 . A A . 49 PRO HD3 1 1 1 421 1 1 28 PRO HG2 H 7.806 6.369 -8.523 1.00 . A A . 49 PRO HG2 1 1 1 422 1 1 28 PRO HG3 H 6.133 5.847 -8.131 1.00 . A A . 49 PRO HG3 1 1 1 423 1 1 28 PRO N N 7.282 4.204 -6.077 1.00 . A A . 49 PRO N 1 1 1 424 1 1 28 PRO O O 7.261 1.124 -8.104 1.00 . A A . 49 PRO O 1 1 1 425 1 1 29 GLY C C 10.296 0.059 -5.345 1.00 . A A . 50 GLY C 1 1 1 426 1 1 29 GLY CA C 9.557 0.440 -6.637 1.00 . A A . 50 GLY CA 1 1 1 427 1 1 29 GLY H H 9.220 2.494 -6.091 1.00 . A A . 50 GLY H 1 1 1 428 1 1 29 GLY HA2 H 10.291 0.472 -7.444 1.00 . A A . 50 GLY HA2 1 1 1 429 1 1 29 GLY HA3 H 8.857 -0.366 -6.853 1.00 . A A . 50 GLY HA3 1 1 1 430 1 1 29 GLY N N 8.832 1.726 -6.615 1.00 . A A . 50 GLY N 1 1 1 431 1 1 29 GLY O O 10.971 -0.970 -5.308 1.00 . A A . 50 GLY O 1 1 1 432 1 1 30 HIS C C 10.472 -0.659 -2.278 1.00 . A A . 51 HIS C 1 1 1 433 1 1 30 HIS CA C 10.873 0.645 -3.000 1.00 . A A . 51 HIS CA 1 1 1 434 1 1 30 HIS CB C 10.605 1.848 -2.078 1.00 . A A . 51 HIS CB 1 1 1 435 1 1 30 HIS CD2 C 9.075 1.509 -0.055 1.00 . A A . 51 HIS CD2 1 1 1 436 1 1 30 HIS CE1 C 7.109 1.454 -1.030 1.00 . A A . 51 HIS CE1 1 1 1 437 1 1 30 HIS CG C 9.261 1.783 -1.383 1.00 . A A . 51 HIS CG 1 1 1 438 1 1 30 HIS H H 9.610 1.688 -4.372 1.00 . A A . 51 HIS H 1 1 1 439 1 1 30 HIS HA H 11.945 0.597 -3.197 1.00 . A A . 51 HIS HA 1 1 1 440 1 1 30 HIS HB2 H 11.380 1.863 -1.311 1.00 . A A . 51 HIS HB2 1 1 1 441 1 1 30 HIS HB3 H 10.693 2.775 -2.642 1.00 . A A . 51 HIS HB3 1 1 1 442 1 1 30 HIS HD1 H 7.787 1.931 -2.951 1.00 . A A . 51 HIS HD1 1 1 1 443 1 1 30 HIS HD2 H 9.860 1.393 0.680 1.00 . A A . 51 HIS HD2 1 1 1 444 1 1 30 HIS HE1 H 6.047 1.340 -1.206 1.00 . A A . 51 HIS HE1 1 1 1 445 1 1 30 HIS N N 10.178 0.861 -4.280 1.00 . A A . 51 HIS N 1 1 1 446 1 1 30 HIS ND1 N 8.014 1.755 -1.974 1.00 . A A . 51 HIS ND1 1 1 1 447 1 1 30 HIS NE2 N 7.708 1.301 0.160 1.00 . A A . 51 HIS NE2 1 1 1 448 1 1 30 HIS O O 11.257 -1.223 -1.515 1.00 . A A . 51 HIS O 1 1 1 449 1 1 31 PHE C C 9.427 -3.534 -1.876 1.00 . A A . 52 PHE C 1 1 1 450 1 1 31 PHE CA C 8.634 -2.228 -1.731 1.00 . A A . 52 PHE CA 1 1 1 451 1 1 31 PHE CB C 7.154 -2.378 -2.120 1.00 . A A . 52 PHE CB 1 1 1 452 1 1 31 PHE CD1 C 6.875 -3.620 -4.320 1.00 . A A . 52 PHE CD1 1 1 1 453 1 1 31 PHE CD2 C 6.591 -1.202 -4.295 1.00 . A A . 52 PHE CD2 1 1 1 454 1 1 31 PHE CE1 C 6.623 -3.632 -5.704 1.00 . A A . 52 PHE CE1 1 1 1 455 1 1 31 PHE CE2 C 6.333 -1.217 -5.676 1.00 . A A . 52 PHE CE2 1 1 1 456 1 1 31 PHE CG C 6.867 -2.404 -3.612 1.00 . A A . 52 PHE CG 1 1 1 457 1 1 31 PHE CZ C 6.353 -2.432 -6.383 1.00 . A A . 52 PHE CZ 1 1 1 458 1 1 31 PHE H H 8.651 -0.630 -3.139 1.00 . A A . 52 PHE H 1 1 1 459 1 1 31 PHE HA H 8.665 -1.960 -0.675 1.00 . A A . 52 PHE HA 1 1 1 460 1 1 31 PHE HB2 H 6.759 -3.286 -1.662 1.00 . A A . 52 PHE HB2 1 1 1 461 1 1 31 PHE HB3 H 6.606 -1.543 -1.683 1.00 . A A . 52 PHE HB3 1 1 1 462 1 1 31 PHE HD1 H 7.083 -4.548 -3.806 1.00 . A A . 52 PHE HD1 1 1 1 463 1 1 31 PHE HD2 H 6.554 -0.264 -3.759 1.00 . A A . 52 PHE HD2 1 1 1 464 1 1 31 PHE HE1 H 6.639 -4.569 -6.246 1.00 . A A . 52 PHE HE1 1 1 1 465 1 1 31 PHE HE2 H 6.106 -0.295 -6.194 1.00 . A A . 52 PHE HE2 1 1 1 466 1 1 31 PHE HZ H 6.156 -2.442 -7.447 1.00 . A A . 52 PHE HZ 1 1 1 467 1 1 31 PHE N N 9.239 -1.130 -2.489 1.00 . A A . 52 PHE N 1 1 1 468 1 1 31 PHE O O 9.716 -4.173 -0.866 1.00 . A A . 52 PHE O 1 1 1 469 1 1 32 SER C C 12.084 -5.093 -2.619 1.00 . A A . 53 SER C 1 1 1 470 1 1 32 SER CA C 10.738 -5.042 -3.369 1.00 . A A . 53 SER CA 1 1 1 471 1 1 32 SER CB C 11.000 -5.132 -4.878 1.00 . A A . 53 SER CB 1 1 1 472 1 1 32 SER H H 9.619 -3.296 -3.868 1.00 . A A . 53 SER H 1 1 1 473 1 1 32 SER HA H 10.180 -5.933 -3.075 1.00 . A A . 53 SER HA 1 1 1 474 1 1 32 SER HB2 H 11.582 -4.264 -5.196 1.00 . A A . 53 SER HB2 1 1 1 475 1 1 32 SER HB3 H 11.570 -6.037 -5.094 1.00 . A A . 53 SER HB3 1 1 1 476 1 1 32 SER HG H 9.978 -5.258 -6.546 1.00 . A A . 53 SER HG 1 1 1 477 1 1 32 SER N N 9.900 -3.863 -3.080 1.00 . A A . 53 SER N 1 1 1 478 1 1 32 SER O O 12.784 -6.106 -2.689 1.00 . A A . 53 SER O 1 1 1 479 1 1 32 SER OG O 9.775 -5.170 -5.595 1.00 . A A . 53 SER OG 1 1 1 480 1 1 33 LYS C C 13.418 -3.311 0.334 1.00 . A A . 54 LYS C 1 1 1 481 1 1 33 LYS CA C 13.666 -3.911 -1.065 1.00 . A A . 54 LYS CA 1 1 1 482 1 1 33 LYS CB C 14.758 -3.163 -1.860 1.00 . A A . 54 LYS CB 1 1 1 483 1 1 33 LYS CD C 15.551 -0.927 -2.838 1.00 . A A . 54 LYS CD 1 1 1 484 1 1 33 LYS CE C 15.944 -1.483 -4.216 1.00 . A A . 54 LYS CE 1 1 1 485 1 1 33 LYS CG C 14.390 -1.706 -2.205 1.00 . A A . 54 LYS CG 1 1 1 486 1 1 33 LYS H H 11.840 -3.216 -1.924 1.00 . A A . 54 LYS H 1 1 1 487 1 1 33 LYS HA H 14.038 -4.918 -0.870 1.00 . A A . 54 LYS HA 1 1 1 488 1 1 33 LYS HB2 H 15.681 -3.168 -1.279 1.00 . A A . 54 LYS HB2 1 1 1 489 1 1 33 LYS HB3 H 14.948 -3.712 -2.783 1.00 . A A . 54 LYS HB3 1 1 1 490 1 1 33 LYS HD2 H 15.242 0.114 -2.951 1.00 . A A . 54 LYS HD2 1 1 1 491 1 1 33 LYS HD3 H 16.411 -0.959 -2.168 1.00 . A A . 54 LYS HD3 1 1 1 492 1 1 33 LYS HE2 H 16.242 -2.528 -4.104 1.00 . A A . 54 LYS HE2 1 1 1 493 1 1 33 LYS HE3 H 15.067 -1.450 -4.870 1.00 . A A . 54 LYS HE3 1 1 1 494 1 1 33 LYS HG2 H 13.544 -1.697 -2.895 1.00 . A A . 54 LYS HG2 1 1 1 495 1 1 33 LYS HG3 H 14.096 -1.185 -1.293 1.00 . A A . 54 LYS HG3 1 1 1 496 1 1 33 LYS HZ1 H 16.804 0.266 -4.944 1.00 . A A . 54 LYS HZ1 1 1 1 497 1 1 33 LYS HZ2 H 17.884 -0.738 -4.239 1.00 . A A . 54 LYS HZ2 1 1 1 498 1 1 33 LYS HZ3 H 17.309 -1.073 -5.727 1.00 . A A . 54 LYS HZ3 1 1 1 499 1 1 33 LYS N N 12.453 -4.023 -1.895 1.00 . A A . 54 LYS N 1 1 1 500 1 1 33 LYS NZ N 17.058 -0.704 -4.819 1.00 . A A . 54 LYS NZ 1 1 1 501 1 1 33 LYS O O 14.380 -2.947 1.015 1.00 . A A . 54 LYS O 1 1 1 502 1 1 34 GLN C C 10.510 -3.335 2.690 1.00 . A A . 55 GLN C 1 1 1 503 1 1 34 GLN CA C 11.807 -2.718 2.124 1.00 . A A . 55 GLN CA 1 1 1 504 1 1 34 GLN CB C 11.702 -1.181 2.089 1.00 . A A . 55 GLN CB 1 1 1 505 1 1 34 GLN CD C 11.323 0.909 3.468 1.00 . A A . 55 GLN CD 1 1 1 506 1 1 34 GLN CG C 11.646 -0.580 3.502 1.00 . A A . 55 GLN CG 1 1 1 507 1 1 34 GLN H H 11.423 -3.562 0.183 1.00 . A A . 55 GLN H 1 1 1 508 1 1 34 GLN HA H 12.613 -2.987 2.811 1.00 . A A . 55 GLN HA 1 1 1 509 1 1 34 GLN HB2 H 12.571 -0.765 1.577 1.00 . A A . 55 GLN HB2 1 1 1 510 1 1 34 GLN HB3 H 10.811 -0.890 1.530 1.00 . A A . 55 GLN HB3 1 1 1 511 1 1 34 GLN HE21 H 9.342 0.546 3.578 1.00 . A A . 55 GLN HE21 1 1 1 512 1 1 34 GLN HE22 H 9.809 2.239 3.514 1.00 . A A . 55 GLN HE22 1 1 1 513 1 1 34 GLN HG2 H 10.880 -1.084 4.093 1.00 . A A . 55 GLN HG2 1 1 1 514 1 1 34 GLN HG3 H 12.607 -0.728 3.997 1.00 . A A . 55 GLN HG3 1 1 1 515 1 1 34 GLN N N 12.157 -3.204 0.778 1.00 . A A . 55 GLN N 1 1 1 516 1 1 34 GLN NE2 N 10.058 1.262 3.535 1.00 . A A . 55 GLN NE2 1 1 1 517 1 1 34 GLN O O 10.531 -3.907 3.782 1.00 . A A . 55 GLN O 1 1 1 518 1 1 34 GLN OE1 O 12.189 1.771 3.377 1.00 . A A . 55 GLN OE1 1 1 1 519 1 1 35 CYS C C 7.498 -4.905 1.912 1.00 . A A . 56 CYS C 1 1 1 520 1 1 35 CYS CA C 8.038 -3.551 2.435 1.00 . A A . 56 CYS CA 1 1 1 521 1 1 35 CYS CB C 7.110 -2.380 2.061 1.00 . A A . 56 CYS CB 1 1 1 522 1 1 35 CYS H H 9.462 -2.740 1.081 1.00 . A A . 56 CYS H 1 1 1 523 1 1 35 CYS HA H 8.055 -3.617 3.524 1.00 . A A . 56 CYS HA 1 1 1 524 1 1 35 CYS HB2 H 7.035 -2.299 0.975 1.00 . A A . 56 CYS HB2 1 1 1 525 1 1 35 CYS HB3 H 6.109 -2.587 2.451 1.00 . A A . 56 CYS HB3 1 1 1 526 1 1 35 CYS N N 9.394 -3.232 1.957 1.00 . A A . 56 CYS N 1 1 1 527 1 1 35 CYS O O 6.393 -5.327 2.276 1.00 . A A . 56 CYS O 1 1 1 528 1 1 35 CYS SG S 7.714 -0.820 2.770 1.00 . A A . 56 CYS SG 1 1 1 529 1 1 36 ARG C C 9.170 -7.679 -0.010 1.00 . A A . 57 ARG C 1 1 1 530 1 1 36 ARG CA C 7.928 -6.837 0.351 1.00 . A A . 57 ARG CA 1 1 1 531 1 1 36 ARG CB C 7.080 -6.484 -0.895 1.00 . A A . 57 ARG CB 1 1 1 532 1 1 36 ARG CD C 5.076 -7.956 -0.167 1.00 . A A . 57 ARG CD 1 1 1 533 1 1 36 ARG CG C 6.039 -7.547 -1.298 1.00 . A A . 57 ARG CG 1 1 1 534 1 1 36 ARG CZ C 3.456 -6.097 0.307 1.00 . A A . 57 ARG CZ 1 1 1 535 1 1 36 ARG H H 9.093 -5.088 0.721 1.00 . A A . 57 ARG H 1 1 1 536 1 1 36 ARG HA H 7.350 -7.444 1.045 1.00 . A A . 57 ARG HA 1 1 1 537 1 1 36 ARG HB2 H 6.537 -5.555 -0.714 1.00 . A A . 57 ARG HB2 1 1 1 538 1 1 36 ARG HB3 H 7.741 -6.293 -1.743 1.00 . A A . 57 ARG HB3 1 1 1 539 1 1 36 ARG HD2 H 4.263 -8.550 -0.587 1.00 . A A . 57 ARG HD2 1 1 1 540 1 1 36 ARG HD3 H 5.607 -8.601 0.534 1.00 . A A . 57 ARG HD3 1 1 1 541 1 1 36 ARG HE H 5.129 -6.418 1.312 1.00 . A A . 57 ARG HE 1 1 1 542 1 1 36 ARG HG2 H 5.452 -7.146 -2.123 1.00 . A A . 57 ARG HG2 1 1 1 543 1 1 36 ARG HG3 H 6.548 -8.441 -1.659 1.00 . A A . 57 ARG HG3 1 1 1 544 1 1 36 ARG HH11 H 2.817 -7.208 -1.231 1.00 . A A . 57 ARG HH11 1 1 1 545 1 1 36 ARG HH12 H 1.823 -5.822 -0.798 1.00 . A A . 57 ARG HH12 1 1 1 546 1 1 36 ARG HH21 H 3.771 -4.746 1.749 1.00 . A A . 57 ARG HH21 1 1 1 547 1 1 36 ARG HH22 H 2.325 -4.525 0.771 1.00 . A A . 57 ARG HH22 1 1 1 548 1 1 36 ARG N N 8.263 -5.576 1.042 1.00 . A A . 57 ARG N 1 1 1 549 1 1 36 ARG NE N 4.547 -6.788 0.568 1.00 . A A . 57 ARG NE 1 1 1 550 1 1 36 ARG NH1 N 2.633 -6.410 -0.651 1.00 . A A . 57 ARG NH1 1 1 1 551 1 1 36 ARG NH2 N 3.156 -5.049 1.013 1.00 . A A . 57 ARG NH2 1 1 1 552 1 1 36 ARG O O 9.102 -8.535 -0.895 1.00 . A A . 57 ARG O 1 1 1 553 1 1 37 SER C C 11.537 -9.620 0.497 1.00 . A A . 58 SER C 1 1 1 554 1 1 37 SER CA C 11.612 -8.086 0.484 1.00 . A A . 58 SER CA 1 1 1 555 1 1 37 SER CB C 12.583 -7.625 1.572 1.00 . A A . 58 SER CB 1 1 1 556 1 1 37 SER H H 10.264 -6.692 1.353 1.00 . A A . 58 SER H 1 1 1 557 1 1 37 SER HA H 12.028 -7.791 -0.479 1.00 . A A . 58 SER HA 1 1 1 558 1 1 37 SER HB2 H 12.225 -7.964 2.549 1.00 . A A . 58 SER HB2 1 1 1 559 1 1 37 SER HB3 H 13.564 -8.068 1.390 1.00 . A A . 58 SER HB3 1 1 1 560 1 1 37 SER HG H 13.301 -5.937 2.268 1.00 . A A . 58 SER HG 1 1 1 561 1 1 37 SER N N 10.304 -7.416 0.654 1.00 . A A . 58 SER N 1 1 1 562 1 1 37 SER O O 12.149 -10.251 -0.399 1.00 . A A . 58 SER O 1 1 1 563 1 1 37 SER OXT O 10.907 -10.191 1.415 1.00 . A A . 58 SER OXT 1 1 1 564 1 1 37 SER OG O 12.682 -6.209 1.562 1.00 . A A . 58 SER OG 1 1 1 565 2 2 1 ZN ZN ZN -8.569 0.470 3.480 1.00 . B A . 1059 ZN ZN 1 1 1 566 3 2 1 ZN ZN ZN 6.805 0.988 1.990 1.00 . C A . 1060 ZN ZN 1 1 2 567 1 1 1 GLN C C -6.372 -1.541 -4.519 1.00 . A A . 22 GLN C 1 1 2 568 1 1 1 GLN CA C -6.195 -1.107 -5.973 1.00 . A A . 22 GLN CA 1 1 2 569 1 1 1 GLN CB C -4.729 -0.728 -6.283 1.00 . A A . 22 GLN CB 1 1 2 570 1 1 1 GLN CD C -3.959 -3.092 -6.915 1.00 . A A . 22 GLN CD 1 1 2 571 1 1 1 GLN CG C -3.697 -1.853 -6.060 1.00 . A A . 22 GLN CG 1 1 2 572 1 1 1 GLN H1 H -6.944 0.796 -5.659 1.00 . A A . 22 GLN H1 1 1 2 573 1 1 1 GLN H2 H -7.020 0.316 -7.235 1.00 . A A . 22 GLN H2 1 1 2 574 1 1 1 GLN H3 H -8.080 -0.282 -6.128 1.00 . A A . 22 GLN H3 1 1 2 575 1 1 1 GLN HA H -6.472 -1.950 -6.606 1.00 . A A . 22 GLN HA 1 1 2 576 1 1 1 GLN HB2 H -4.662 -0.412 -7.325 1.00 . A A . 22 GLN HB2 1 1 2 577 1 1 1 GLN HB3 H -4.442 0.122 -5.660 1.00 . A A . 22 GLN HB3 1 1 2 578 1 1 1 GLN HE21 H -2.204 -2.949 -7.917 1.00 . A A . 22 GLN HE21 1 1 2 579 1 1 1 GLN HE22 H -3.255 -4.292 -8.349 1.00 . A A . 22 GLN HE22 1 1 2 580 1 1 1 GLN HG2 H -2.706 -1.457 -6.292 1.00 . A A . 22 GLN HG2 1 1 2 581 1 1 1 GLN HG3 H -3.689 -2.152 -5.013 1.00 . A A . 22 GLN HG3 1 1 2 582 1 1 1 GLN N N -7.123 0.013 -6.277 1.00 . A A . 22 GLN N 1 1 2 583 1 1 1 GLN NE2 N -3.062 -3.468 -7.798 1.00 . A A . 22 GLN NE2 1 1 2 584 1 1 1 GLN O O -6.486 -0.691 -3.642 1.00 . A A . 22 GLN O 1 1 2 585 1 1 1 GLN OE1 O -4.984 -3.745 -6.798 1.00 . A A . 22 GLN OE1 1 1 2 586 1 1 2 THR C C -5.899 -2.870 -1.788 1.00 . A A . 23 THR C 1 1 2 587 1 1 2 THR CA C -6.733 -3.444 -2.939 1.00 . A A . 23 THR CA 1 1 2 588 1 1 2 THR CB C -6.578 -4.974 -2.998 1.00 . A A . 23 THR CB 1 1 2 589 1 1 2 THR CG2 C -7.145 -5.683 -1.768 1.00 . A A . 23 THR CG2 1 1 2 590 1 1 2 THR H H -6.298 -3.505 -5.023 1.00 . A A . 23 THR H 1 1 2 591 1 1 2 THR HA H -7.776 -3.231 -2.724 1.00 . A A . 23 THR HA 1 1 2 592 1 1 2 THR HB H -5.524 -5.228 -3.112 1.00 . A A . 23 THR HB 1 1 2 593 1 1 2 THR HG1 H -7.090 -6.411 -4.203 1.00 . A A . 23 THR HG1 1 1 2 594 1 1 2 THR HG21 H -8.203 -5.441 -1.657 1.00 . A A . 23 THR HG21 1 1 2 595 1 1 2 THR HG22 H -7.037 -6.761 -1.885 1.00 . A A . 23 THR HG22 1 1 2 596 1 1 2 THR HG23 H -6.603 -5.381 -0.872 1.00 . A A . 23 THR HG23 1 1 2 597 1 1 2 THR N N -6.419 -2.851 -4.255 1.00 . A A . 23 THR N 1 1 2 598 1 1 2 THR O O -4.677 -2.757 -1.896 1.00 . A A . 23 THR O 1 1 2 599 1 1 2 THR OG1 O -7.299 -5.464 -4.110 1.00 . A A . 23 THR OG1 1 1 2 600 1 1 3 CYS C C -4.851 -2.815 1.148 1.00 . A A . 24 CYS C 1 1 2 601 1 1 3 CYS CA C -5.986 -1.969 0.541 1.00 . A A . 24 CYS CA 1 1 2 602 1 1 3 CYS CB C -7.128 -1.848 1.553 1.00 . A A . 24 CYS CB 1 1 2 603 1 1 3 CYS H H -7.575 -2.603 -0.712 1.00 . A A . 24 CYS H 1 1 2 604 1 1 3 CYS HA H -5.608 -0.969 0.318 1.00 . A A . 24 CYS HA 1 1 2 605 1 1 3 CYS HB2 H -7.998 -1.408 1.072 1.00 . A A . 24 CYS HB2 1 1 2 606 1 1 3 CYS HB3 H -7.401 -2.844 1.903 1.00 . A A . 24 CYS HB3 1 1 2 607 1 1 3 CYS N N -6.569 -2.526 -0.683 1.00 . A A . 24 CYS N 1 1 2 608 1 1 3 CYS O O -4.882 -4.048 1.091 1.00 . A A . 24 CYS O 1 1 2 609 1 1 3 CYS SG S -6.608 -0.813 2.942 1.00 . A A . 24 CYS SG 1 1 2 610 1 1 4 TYR C C -3.558 -3.563 3.913 1.00 . A A . 25 TYR C 1 1 2 611 1 1 4 TYR CA C -2.933 -2.826 2.711 1.00 . A A . 25 TYR CA 1 1 2 612 1 1 4 TYR CB C -1.855 -1.832 3.178 1.00 . A A . 25 TYR CB 1 1 2 613 1 1 4 TYR CD1 C -3.298 -0.122 4.406 1.00 . A A . 25 TYR CD1 1 1 2 614 1 1 4 TYR CD2 C -1.388 -1.093 5.560 1.00 . A A . 25 TYR CD2 1 1 2 615 1 1 4 TYR CE1 C -3.611 0.628 5.554 1.00 . A A . 25 TYR CE1 1 1 2 616 1 1 4 TYR CE2 C -1.685 -0.326 6.705 1.00 . A A . 25 TYR CE2 1 1 2 617 1 1 4 TYR CG C -2.189 -0.991 4.404 1.00 . A A . 25 TYR CG 1 1 2 618 1 1 4 TYR CZ C -2.803 0.536 6.703 1.00 . A A . 25 TYR CZ 1 1 2 619 1 1 4 TYR H H -3.949 -1.147 1.849 1.00 . A A . 25 TYR H 1 1 2 620 1 1 4 TYR HA H -2.434 -3.584 2.114 1.00 . A A . 25 TYR HA 1 1 2 621 1 1 4 TYR HB2 H -0.970 -2.423 3.412 1.00 . A A . 25 TYR HB2 1 1 2 622 1 1 4 TYR HB3 H -1.582 -1.171 2.357 1.00 . A A . 25 TYR HB3 1 1 2 623 1 1 4 TYR HD1 H -3.926 -0.033 3.532 1.00 . A A . 25 TYR HD1 1 1 2 624 1 1 4 TYR HD2 H -0.536 -1.761 5.572 1.00 . A A . 25 TYR HD2 1 1 2 625 1 1 4 TYR HE1 H -4.484 1.260 5.570 1.00 . A A . 25 TYR HE1 1 1 2 626 1 1 4 TYR HE2 H -1.063 -0.403 7.586 1.00 . A A . 25 TYR HE2 1 1 2 627 1 1 4 TYR HH H -2.510 1.112 8.541 1.00 . A A . 25 TYR HH 1 1 2 628 1 1 4 TYR N N -3.906 -2.159 1.833 1.00 . A A . 25 TYR N 1 1 2 629 1 1 4 TYR O O -2.938 -4.481 4.457 1.00 . A A . 25 TYR O 1 1 2 630 1 1 4 TYR OH O -3.119 1.273 7.801 1.00 . A A . 25 TYR OH 1 1 2 631 1 1 5 ASN C C -6.875 -4.085 5.370 1.00 . A A . 26 ASN C 1 1 2 632 1 1 5 ASN CA C -5.426 -3.595 5.560 1.00 . A A . 26 ASN CA 1 1 2 633 1 1 5 ASN CB C -5.376 -2.371 6.496 1.00 . A A . 26 ASN CB 1 1 2 634 1 1 5 ASN CG C -6.157 -2.576 7.783 1.00 . A A . 26 ASN CG 1 1 2 635 1 1 5 ASN H H -5.216 -2.439 3.783 1.00 . A A . 26 ASN H 1 1 2 636 1 1 5 ASN HA H -4.867 -4.410 6.027 1.00 . A A . 26 ASN HA 1 1 2 637 1 1 5 ASN HB2 H -4.338 -2.160 6.755 1.00 . A A . 26 ASN HB2 1 1 2 638 1 1 5 ASN HB3 H -5.774 -1.497 5.982 1.00 . A A . 26 ASN HB3 1 1 2 639 1 1 5 ASN HD21 H -7.822 -1.679 7.039 1.00 . A A . 26 ASN HD21 1 1 2 640 1 1 5 ASN HD22 H -7.911 -2.259 8.695 1.00 . A A . 26 ASN HD22 1 1 2 641 1 1 5 ASN N N -4.782 -3.191 4.305 1.00 . A A . 26 ASN N 1 1 2 642 1 1 5 ASN ND2 N -7.392 -2.122 7.843 1.00 . A A . 26 ASN ND2 1 1 2 643 1 1 5 ASN O O -7.250 -5.128 5.908 1.00 . A A . 26 ASN O 1 1 2 644 1 1 5 ASN OD1 O -5.672 -3.152 8.748 1.00 . A A . 26 ASN OD1 1 1 2 645 1 1 6 CYS C C -9.597 -4.632 3.571 1.00 . A A . 27 CYS C 1 1 2 646 1 1 6 CYS CA C -9.136 -3.508 4.531 1.00 . A A . 27 CYS CA 1 1 2 647 1 1 6 CYS CB C -9.743 -2.151 4.131 1.00 . A A . 27 CYS CB 1 1 2 648 1 1 6 CYS H H -7.307 -2.493 4.205 1.00 . A A . 27 CYS H 1 1 2 649 1 1 6 CYS HA H -9.504 -3.759 5.527 1.00 . A A . 27 CYS HA 1 1 2 650 1 1 6 CYS HB2 H -9.461 -1.919 3.104 1.00 . A A . 27 CYS HB2 1 1 2 651 1 1 6 CYS HB3 H -10.832 -2.229 4.174 1.00 . A A . 27 CYS HB3 1 1 2 652 1 1 6 CYS N N -7.682 -3.341 4.609 1.00 . A A . 27 CYS N 1 1 2 653 1 1 6 CYS O O -10.779 -4.980 3.556 1.00 . A A . 27 CYS O 1 1 2 654 1 1 6 CYS SG S -9.190 -0.826 5.254 1.00 . A A . 27 CYS SG 1 1 2 655 1 1 7 GLY C C -10.015 -5.928 0.730 1.00 . A A . 28 GLY C 1 1 2 656 1 1 7 GLY CA C -8.970 -6.274 1.804 1.00 . A A . 28 GLY CA 1 1 2 657 1 1 7 GLY H H -7.728 -4.888 2.859 1.00 . A A . 28 GLY H 1 1 2 658 1 1 7 GLY HA2 H -9.318 -7.151 2.351 1.00 . A A . 28 GLY HA2 1 1 2 659 1 1 7 GLY HA3 H -8.044 -6.538 1.294 1.00 . A A . 28 GLY HA3 1 1 2 660 1 1 7 GLY N N -8.686 -5.194 2.763 1.00 . A A . 28 GLY N 1 1 2 661 1 1 7 GLY O O -10.756 -6.808 0.284 1.00 . A A . 28 GLY O 1 1 2 662 1 1 8 LYS C C -10.560 -3.389 -1.763 1.00 . A A . 29 LYS C 1 1 2 663 1 1 8 LYS CA C -11.159 -4.079 -0.519 1.00 . A A . 29 LYS CA 1 1 2 664 1 1 8 LYS CB C -11.977 -3.114 0.364 1.00 . A A . 29 LYS CB 1 1 2 665 1 1 8 LYS CD C -14.328 -3.497 -0.572 1.00 . A A . 29 LYS CD 1 1 2 666 1 1 8 LYS CE C -15.570 -2.783 -1.122 1.00 . A A . 29 LYS CE 1 1 2 667 1 1 8 LYS CG C -13.206 -2.481 -0.312 1.00 . A A . 29 LYS CG 1 1 2 668 1 1 8 LYS H H -9.436 -4.006 0.745 1.00 . A A . 29 LYS H 1 1 2 669 1 1 8 LYS HA H -11.829 -4.878 -0.827 1.00 . A A . 29 LYS HA 1 1 2 670 1 1 8 LYS HB2 H -12.314 -3.649 1.254 1.00 . A A . 29 LYS HB2 1 1 2 671 1 1 8 LYS HB3 H -11.322 -2.314 0.707 1.00 . A A . 29 LYS HB3 1 1 2 672 1 1 8 LYS HD2 H -13.992 -4.245 -1.292 1.00 . A A . 29 LYS HD2 1 1 2 673 1 1 8 LYS HD3 H -14.584 -3.995 0.364 1.00 . A A . 29 LYS HD3 1 1 2 674 1 1 8 LYS HE2 H -15.874 -2.010 -0.410 1.00 . A A . 29 LYS HE2 1 1 2 675 1 1 8 LYS HE3 H -15.309 -2.287 -2.062 1.00 . A A . 29 LYS HE3 1 1 2 676 1 1 8 LYS HG2 H -13.590 -1.706 0.353 1.00 . A A . 29 LYS HG2 1 1 2 677 1 1 8 LYS HG3 H -12.913 -2.006 -1.248 1.00 . A A . 29 LYS HG3 1 1 2 678 1 1 8 LYS HZ1 H -16.963 -4.191 -0.484 1.00 . A A . 29 LYS HZ1 1 1 2 679 1 1 8 LYS HZ2 H -17.509 -3.253 -1.699 1.00 . A A . 29 LYS HZ2 1 1 2 680 1 1 8 LYS HZ3 H -16.446 -4.449 -2.013 1.00 . A A . 29 LYS HZ3 1 1 2 681 1 1 8 LYS N N -10.093 -4.650 0.327 1.00 . A A . 29 LYS N 1 1 2 682 1 1 8 LYS NZ N -16.692 -3.732 -1.344 1.00 . A A . 29 LYS NZ 1 1 2 683 1 1 8 LYS O O -9.822 -2.416 -1.583 1.00 . A A . 29 LYS O 1 1 2 684 1 1 9 PRO C C -10.398 -1.810 -4.484 1.00 . A A . 30 PRO C 1 1 2 685 1 1 9 PRO CA C -10.281 -3.325 -4.259 1.00 . A A . 30 PRO CA 1 1 2 686 1 1 9 PRO CB C -10.998 -4.085 -5.380 1.00 . A A . 30 PRO CB 1 1 2 687 1 1 9 PRO CD C -11.610 -5.065 -3.296 1.00 . A A . 30 PRO CD 1 1 2 688 1 1 9 PRO CG C -11.299 -5.435 -4.743 1.00 . A A . 30 PRO CG 1 1 2 689 1 1 9 PRO HA H -9.228 -3.592 -4.301 1.00 . A A . 30 PRO HA 1 1 2 690 1 1 9 PRO HB2 H -11.936 -3.590 -5.635 1.00 . A A . 30 PRO HB2 1 1 2 691 1 1 9 PRO HB3 H -10.366 -4.188 -6.265 1.00 . A A . 30 PRO HB3 1 1 2 692 1 1 9 PRO HD2 H -12.675 -4.850 -3.198 1.00 . A A . 30 PRO HD2 1 1 2 693 1 1 9 PRO HD3 H -11.330 -5.894 -2.644 1.00 . A A . 30 PRO HD3 1 1 2 694 1 1 9 PRO HG2 H -12.142 -5.933 -5.224 1.00 . A A . 30 PRO HG2 1 1 2 695 1 1 9 PRO HG3 H -10.408 -6.065 -4.777 1.00 . A A . 30 PRO HG3 1 1 2 696 1 1 9 PRO N N -10.840 -3.858 -3.002 1.00 . A A . 30 PRO N 1 1 2 697 1 1 9 PRO O O -9.507 -1.212 -5.095 1.00 . A A . 30 PRO O 1 1 2 698 1 1 10 GLY C C -10.943 1.224 -3.319 1.00 . A A . 31 GLY C 1 1 2 699 1 1 10 GLY CA C -11.780 0.251 -4.162 1.00 . A A . 31 GLY CA 1 1 2 700 1 1 10 GLY H H -12.151 -1.739 -3.506 1.00 . A A . 31 GLY H 1 1 2 701 1 1 10 GLY HA2 H -12.831 0.414 -3.927 1.00 . A A . 31 GLY HA2 1 1 2 702 1 1 10 GLY HA3 H -11.629 0.512 -5.210 1.00 . A A . 31 GLY HA3 1 1 2 703 1 1 10 GLY N N -11.461 -1.176 -3.980 1.00 . A A . 31 GLY N 1 1 2 704 1 1 10 GLY O O -11.468 2.234 -2.840 1.00 . A A . 31 GLY O 1 1 2 705 1 1 11 HIS C C -7.722 2.503 -3.179 1.00 . A A . 32 HIS C 1 1 2 706 1 1 11 HIS CA C -8.730 1.729 -2.316 1.00 . A A . 32 HIS CA 1 1 2 707 1 1 11 HIS CB C -8.043 0.853 -1.259 1.00 . A A . 32 HIS CB 1 1 2 708 1 1 11 HIS CD2 C -8.502 1.389 1.202 1.00 . A A . 32 HIS CD2 1 1 2 709 1 1 11 HIS CE1 C -10.343 0.240 1.522 1.00 . A A . 32 HIS CE1 1 1 2 710 1 1 11 HIS CG C -8.825 0.780 0.022 1.00 . A A . 32 HIS CG 1 1 2 711 1 1 11 HIS H H -9.298 0.084 -3.543 1.00 . A A . 32 HIS H 1 1 2 712 1 1 11 HIS HA H -9.300 2.487 -1.782 1.00 . A A . 32 HIS HA 1 1 2 713 1 1 11 HIS HB2 H -7.905 -0.156 -1.638 1.00 . A A . 32 HIS HB2 1 1 2 714 1 1 11 HIS HB3 H -7.054 1.257 -1.030 1.00 . A A . 32 HIS HB3 1 1 2 715 1 1 11 HIS HD1 H -10.428 -0.543 -0.437 1.00 . A A . 32 HIS HD1 1 1 2 716 1 1 11 HIS HD2 H -7.649 2.029 1.355 1.00 . A A . 32 HIS HD2 1 1 2 717 1 1 11 HIS HE1 H -11.212 -0.211 1.987 1.00 . A A . 32 HIS HE1 1 1 2 718 1 1 11 HIS N N -9.661 0.918 -3.102 1.00 . A A . 32 HIS N 1 1 2 719 1 1 11 HIS ND1 N -9.978 0.066 0.239 1.00 . A A . 32 HIS ND1 1 1 2 720 1 1 11 HIS NE2 N -9.453 1.024 2.163 1.00 . A A . 32 HIS NE2 1 1 2 721 1 1 11 HIS O O -7.399 2.138 -4.313 1.00 . A A . 32 HIS O 1 1 2 722 1 1 12 LEU C C -5.620 5.316 -1.991 1.00 . A A . 33 LEU C 1 1 2 723 1 1 12 LEU CA C -6.380 4.646 -3.153 1.00 . A A . 33 LEU CA 1 1 2 724 1 1 12 LEU CB C -7.250 5.714 -3.862 1.00 . A A . 33 LEU CB 1 1 2 725 1 1 12 LEU CD1 C -8.856 6.428 -5.647 1.00 . A A . 33 LEU CD1 1 1 2 726 1 1 12 LEU CD2 C -6.991 4.925 -6.270 1.00 . A A . 33 LEU CD2 1 1 2 727 1 1 12 LEU CG C -7.973 5.282 -5.152 1.00 . A A . 33 LEU CG 1 1 2 728 1 1 12 LEU H H -7.526 3.762 -1.637 1.00 . A A . 33 LEU H 1 1 2 729 1 1 12 LEU HA H -5.656 4.214 -3.845 1.00 . A A . 33 LEU HA 1 1 2 730 1 1 12 LEU HB2 H -8.002 6.063 -3.150 1.00 . A A . 33 LEU HB2 1 1 2 731 1 1 12 LEU HB3 H -6.623 6.570 -4.112 1.00 . A A . 33 LEU HB3 1 1 2 732 1 1 12 LEU HD11 H -9.587 6.686 -4.880 1.00 . A A . 33 LEU HD11 1 1 2 733 1 1 12 LEU HD12 H -8.248 7.306 -5.870 1.00 . A A . 33 LEU HD12 1 1 2 734 1 1 12 LEU HD13 H -9.391 6.121 -6.547 1.00 . A A . 33 LEU HD13 1 1 2 735 1 1 12 LEU HD21 H -6.333 5.769 -6.476 1.00 . A A . 33 LEU HD21 1 1 2 736 1 1 12 LEU HD22 H -6.392 4.063 -5.980 1.00 . A A . 33 LEU HD22 1 1 2 737 1 1 12 LEU HD23 H -7.543 4.670 -7.175 1.00 . A A . 33 LEU HD23 1 1 2 738 1 1 12 LEU HG H -8.620 4.431 -4.951 1.00 . A A . 33 LEU HG 1 1 2 739 1 1 12 LEU N N -7.253 3.608 -2.598 1.00 . A A . 33 LEU N 1 1 2 740 1 1 12 LEU O O -5.970 5.121 -0.823 1.00 . A A . 33 LEU O 1 1 2 741 1 1 13 SER C C -4.882 7.973 -0.507 1.00 . A A . 34 SER C 1 1 2 742 1 1 13 SER CA C -3.961 7.079 -1.362 1.00 . A A . 34 SER CA 1 1 2 743 1 1 13 SER CB C -3.006 7.990 -2.145 1.00 . A A . 34 SER CB 1 1 2 744 1 1 13 SER H H -4.391 6.266 -3.281 1.00 . A A . 34 SER H 1 1 2 745 1 1 13 SER HA H -3.371 6.465 -0.682 1.00 . A A . 34 SER HA 1 1 2 746 1 1 13 SER HB2 H -3.590 8.677 -2.759 1.00 . A A . 34 SER HB2 1 1 2 747 1 1 13 SER HB3 H -2.400 8.571 -1.448 1.00 . A A . 34 SER HB3 1 1 2 748 1 1 13 SER HG H -1.678 7.827 -3.580 1.00 . A A . 34 SER HG 1 1 2 749 1 1 13 SER N N -4.664 6.191 -2.310 1.00 . A A . 34 SER N 1 1 2 750 1 1 13 SER O O -4.463 8.485 0.533 1.00 . A A . 34 SER O 1 1 2 751 1 1 13 SER OG O -2.159 7.218 -2.986 1.00 . A A . 34 SER OG 1 1 2 752 1 1 14 SER C C -8.172 8.040 0.555 1.00 . A A . 35 SER C 1 1 2 753 1 1 14 SER CA C -7.194 8.920 -0.247 1.00 . A A . 35 SER CA 1 1 2 754 1 1 14 SER CB C -7.973 9.731 -1.290 1.00 . A A . 35 SER CB 1 1 2 755 1 1 14 SER H H -6.388 7.773 -1.832 1.00 . A A . 35 SER H 1 1 2 756 1 1 14 SER HA H -6.741 9.623 0.454 1.00 . A A . 35 SER HA 1 1 2 757 1 1 14 SER HB2 H -8.797 10.259 -0.808 1.00 . A A . 35 SER HB2 1 1 2 758 1 1 14 SER HB3 H -7.304 10.467 -1.737 1.00 . A A . 35 SER HB3 1 1 2 759 1 1 14 SER HG H -8.971 9.417 -2.947 1.00 . A A . 35 SER HG 1 1 2 760 1 1 14 SER N N -6.135 8.166 -0.936 1.00 . A A . 35 SER N 1 1 2 761 1 1 14 SER O O -9.032 8.569 1.264 1.00 . A A . 35 SER O 1 1 2 762 1 1 14 SER OG O -8.474 8.872 -2.307 1.00 . A A . 35 SER OG 1 1 2 763 1 1 15 GLN C C -8.223 5.085 2.360 1.00 . A A . 36 GLN C 1 1 2 764 1 1 15 GLN CA C -8.918 5.732 1.143 1.00 . A A . 36 GLN CA 1 1 2 765 1 1 15 GLN CB C -9.342 4.674 0.106 1.00 . A A . 36 GLN CB 1 1 2 766 1 1 15 GLN CD C -11.888 4.695 0.053 1.00 . A A . 36 GLN CD 1 1 2 767 1 1 15 GLN CG C -10.636 3.927 0.474 1.00 . A A . 36 GLN CG 1 1 2 768 1 1 15 GLN H H -7.286 6.348 -0.092 1.00 . A A . 36 GLN H 1 1 2 769 1 1 15 GLN HA H -9.814 6.239 1.501 1.00 . A A . 36 GLN HA 1 1 2 770 1 1 15 GLN HB2 H -9.488 5.148 -0.866 1.00 . A A . 36 GLN HB2 1 1 2 771 1 1 15 GLN HB3 H -8.535 3.952 0.001 1.00 . A A . 36 GLN HB3 1 1 2 772 1 1 15 GLN HE21 H -12.071 3.658 -1.687 1.00 . A A . 36 GLN HE21 1 1 2 773 1 1 15 GLN HE22 H -13.277 4.904 -1.377 1.00 . A A . 36 GLN HE22 1 1 2 774 1 1 15 GLN HG2 H -10.646 2.966 -0.038 1.00 . A A . 36 GLN HG2 1 1 2 775 1 1 15 GLN HG3 H -10.668 3.729 1.545 1.00 . A A . 36 GLN HG3 1 1 2 776 1 1 15 GLN N N -8.041 6.709 0.479 1.00 . A A . 36 GLN N 1 1 2 777 1 1 15 GLN NE2 N -12.452 4.396 -1.100 1.00 . A A . 36 GLN NE2 1 1 2 778 1 1 15 GLN O O -8.838 4.967 3.421 1.00 . A A . 36 GLN O 1 1 2 779 1 1 15 GLN OE1 O -12.375 5.577 0.748 1.00 . A A . 36 GLN OE1 1 1 2 780 1 1 16 CYS C C -4.577 4.939 2.984 1.00 . A A . 37 CYS C 1 1 2 781 1 1 16 CYS CA C -5.987 4.388 3.286 1.00 . A A . 37 CYS CA 1 1 2 782 1 1 16 CYS CB C -5.925 2.854 3.449 1.00 . A A . 37 CYS CB 1 1 2 783 1 1 16 CYS H H -6.509 4.921 1.311 1.00 . A A . 37 CYS H 1 1 2 784 1 1 16 CYS HA H -6.313 4.832 4.228 1.00 . A A . 37 CYS HA 1 1 2 785 1 1 16 CYS HB2 H -5.973 2.367 2.474 1.00 . A A . 37 CYS HB2 1 1 2 786 1 1 16 CYS HB3 H -4.964 2.568 3.875 1.00 . A A . 37 CYS HB3 1 1 2 787 1 1 16 CYS N N -6.928 4.761 2.221 1.00 . A A . 37 CYS N 1 1 2 788 1 1 16 CYS O O -4.305 5.456 1.898 1.00 . A A . 37 CYS O 1 1 2 789 1 1 16 CYS SG S -7.224 2.251 4.563 1.00 . A A . 37 CYS SG 1 1 2 790 1 1 17 ARG C C -1.535 4.520 2.633 1.00 . A A . 38 ARG C 1 1 2 791 1 1 17 ARG CA C -2.240 5.137 3.849 1.00 . A A . 38 ARG CA 1 1 2 792 1 1 17 ARG CB C -1.525 4.753 5.157 1.00 . A A . 38 ARG CB 1 1 2 793 1 1 17 ARG CD C -2.611 4.699 7.496 1.00 . A A . 38 ARG CD 1 1 2 794 1 1 17 ARG CG C -1.988 5.562 6.385 1.00 . A A . 38 ARG CG 1 1 2 795 1 1 17 ARG CZ C -5.106 4.817 7.247 1.00 . A A . 38 ARG CZ 1 1 2 796 1 1 17 ARG H H -3.982 4.361 4.815 1.00 . A A . 38 ARG H 1 1 2 797 1 1 17 ARG HA H -2.163 6.217 3.719 1.00 . A A . 38 ARG HA 1 1 2 798 1 1 17 ARG HB2 H -1.657 3.685 5.340 1.00 . A A . 38 ARG HB2 1 1 2 799 1 1 17 ARG HB3 H -0.457 4.936 5.026 1.00 . A A . 38 ARG HB3 1 1 2 800 1 1 17 ARG HD2 H -1.941 3.864 7.707 1.00 . A A . 38 ARG HD2 1 1 2 801 1 1 17 ARG HD3 H -2.677 5.293 8.409 1.00 . A A . 38 ARG HD3 1 1 2 802 1 1 17 ARG HE H -4.009 3.178 6.987 1.00 . A A . 38 ARG HE 1 1 2 803 1 1 17 ARG HG2 H -1.114 6.059 6.807 1.00 . A A . 38 ARG HG2 1 1 2 804 1 1 17 ARG HG3 H -2.690 6.343 6.088 1.00 . A A . 38 ARG HG3 1 1 2 805 1 1 17 ARG HH11 H -4.342 6.525 7.951 1.00 . A A . 38 ARG HH11 1 1 2 806 1 1 17 ARG HH12 H -6.070 6.513 7.742 1.00 . A A . 38 ARG HH12 1 1 2 807 1 1 17 ARG HH21 H -6.237 3.337 6.462 1.00 . A A . 38 ARG HH21 1 1 2 808 1 1 17 ARG HH22 H -7.090 4.745 6.985 1.00 . A A . 38 ARG HH22 1 1 2 809 1 1 17 ARG N N -3.665 4.777 3.952 1.00 . A A . 38 ARG N 1 1 2 810 1 1 17 ARG NE N -3.953 4.174 7.150 1.00 . A A . 38 ARG NE 1 1 2 811 1 1 17 ARG NH1 N -5.181 6.049 7.667 1.00 . A A . 38 ARG NH1 1 1 2 812 1 1 17 ARG NH2 N -6.223 4.244 6.907 1.00 . A A . 38 ARG NH2 1 1 2 813 1 1 17 ARG O O -0.695 5.194 2.035 1.00 . A A . 38 ARG O 1 1 2 814 1 1 18 ALA C C -2.329 1.485 0.530 1.00 . A A . 39 ALA C 1 1 2 815 1 1 18 ALA CA C -1.427 2.658 0.992 1.00 . A A . 39 ALA CA 1 1 2 816 1 1 18 ALA CB C -0.001 2.133 1.222 1.00 . A A . 39 ALA CB 1 1 2 817 1 1 18 ALA H H -2.573 2.799 2.781 1.00 . A A . 39 ALA H 1 1 2 818 1 1 18 ALA HA H -1.412 3.411 0.204 1.00 . A A . 39 ALA HA 1 1 2 819 1 1 18 ALA HB1 H 0.667 2.952 1.489 1.00 . A A . 39 ALA HB1 1 1 2 820 1 1 18 ALA HB2 H -0.014 1.392 2.021 1.00 . A A . 39 ALA HB2 1 1 2 821 1 1 18 ALA HB3 H 0.378 1.657 0.319 1.00 . A A . 39 ALA HB3 1 1 2 822 1 1 18 ALA N N -1.891 3.296 2.231 1.00 . A A . 39 ALA N 1 1 2 823 1 1 18 ALA O O -3.043 0.896 1.349 1.00 . A A . 39 ALA O 1 1 2 824 1 1 19 PRO C C -1.673 -1.340 -0.737 1.00 . A A . 40 PRO C 1 1 2 825 1 1 19 PRO CA C -2.668 -0.253 -1.198 1.00 . A A . 40 PRO CA 1 1 2 826 1 1 19 PRO CB C -2.729 -0.144 -2.726 1.00 . A A . 40 PRO CB 1 1 2 827 1 1 19 PRO CD C -1.672 1.827 -1.864 1.00 . A A . 40 PRO CD 1 1 2 828 1 1 19 PRO CG C -1.632 0.865 -3.052 1.00 . A A . 40 PRO CG 1 1 2 829 1 1 19 PRO HA H -3.659 -0.493 -0.816 1.00 . A A . 40 PRO HA 1 1 2 830 1 1 19 PRO HB2 H -2.557 -1.100 -3.222 1.00 . A A . 40 PRO HB2 1 1 2 831 1 1 19 PRO HB3 H -3.698 0.266 -3.020 1.00 . A A . 40 PRO HB3 1 1 2 832 1 1 19 PRO HD2 H -0.664 2.177 -1.642 1.00 . A A . 40 PRO HD2 1 1 2 833 1 1 19 PRO HD3 H -2.317 2.675 -2.102 1.00 . A A . 40 PRO HD3 1 1 2 834 1 1 19 PRO HG2 H -0.665 0.361 -3.079 1.00 . A A . 40 PRO HG2 1 1 2 835 1 1 19 PRO HG3 H -1.820 1.380 -3.995 1.00 . A A . 40 PRO HG3 1 1 2 836 1 1 19 PRO N N -2.252 1.080 -0.753 1.00 . A A . 40 PRO N 1 1 2 837 1 1 19 PRO O O -0.588 -1.037 -0.235 1.00 . A A . 40 PRO O 1 1 2 838 1 1 20 LYS C C 0.198 -3.911 -1.093 1.00 . A A . 41 LYS C 1 1 2 839 1 1 20 LYS CA C -1.241 -3.823 -0.555 1.00 . A A . 41 LYS CA 1 1 2 840 1 1 20 LYS CB C -2.073 -5.076 -0.911 1.00 . A A . 41 LYS CB 1 1 2 841 1 1 20 LYS CD C -1.900 -6.237 1.376 1.00 . A A . 41 LYS CD 1 1 2 842 1 1 20 LYS CE C -1.741 -7.590 2.077 1.00 . A A . 41 LYS CE 1 1 2 843 1 1 20 LYS CG C -1.722 -6.368 -0.145 1.00 . A A . 41 LYS CG 1 1 2 844 1 1 20 LYS H H -2.921 -2.776 -1.386 1.00 . A A . 41 LYS H 1 1 2 845 1 1 20 LYS HA H -1.125 -3.765 0.522 1.00 . A A . 41 LYS HA 1 1 2 846 1 1 20 LYS HB2 H -3.126 -4.867 -0.719 1.00 . A A . 41 LYS HB2 1 1 2 847 1 1 20 LYS HB3 H -1.978 -5.268 -1.981 1.00 . A A . 41 LYS HB3 1 1 2 848 1 1 20 LYS HD2 H -1.152 -5.551 1.774 1.00 . A A . 41 LYS HD2 1 1 2 849 1 1 20 LYS HD3 H -2.898 -5.849 1.584 1.00 . A A . 41 LYS HD3 1 1 2 850 1 1 20 LYS HE2 H -2.485 -8.284 1.674 1.00 . A A . 41 LYS HE2 1 1 2 851 1 1 20 LYS HE3 H -0.749 -7.994 1.852 1.00 . A A . 41 LYS HE3 1 1 2 852 1 1 20 LYS HG2 H -2.385 -7.156 -0.505 1.00 . A A . 41 LYS HG2 1 1 2 853 1 1 20 LYS HG3 H -0.698 -6.668 -0.368 1.00 . A A . 41 LYS HG3 1 1 2 854 1 1 20 LYS HZ1 H -2.821 -7.069 3.780 1.00 . A A . 41 LYS HZ1 1 1 2 855 1 1 20 LYS HZ2 H -1.840 -8.354 4.007 1.00 . A A . 41 LYS HZ2 1 1 2 856 1 1 20 LYS HZ3 H -1.217 -6.845 3.951 1.00 . A A . 41 LYS HZ3 1 1 2 857 1 1 20 LYS N N -2.009 -2.620 -0.961 1.00 . A A . 41 LYS N 1 1 2 858 1 1 20 LYS NZ N -1.916 -7.456 3.549 1.00 . A A . 41 LYS NZ 1 1 2 859 1 1 20 LYS O O 0.983 -4.732 -0.619 1.00 . A A . 41 LYS O 1 1 2 860 1 1 21 VAL C C 2.864 -2.370 -1.236 1.00 . A A . 42 VAL C 1 1 2 861 1 1 21 VAL CA C 1.960 -2.744 -2.427 1.00 . A A . 42 VAL CA 1 1 2 862 1 1 21 VAL CB C 1.955 -1.603 -3.470 1.00 . A A . 42 VAL CB 1 1 2 863 1 1 21 VAL CG1 C 3.355 -1.266 -3.983 1.00 . A A . 42 VAL CG1 1 1 2 864 1 1 21 VAL CG2 C 1.094 -1.954 -4.694 1.00 . A A . 42 VAL CG2 1 1 2 865 1 1 21 VAL H H -0.148 -2.413 -2.358 1.00 . A A . 42 VAL H 1 1 2 866 1 1 21 VAL HA H 2.379 -3.637 -2.893 1.00 . A A . 42 VAL HA 1 1 2 867 1 1 21 VAL HB H 1.541 -0.707 -3.007 1.00 . A A . 42 VAL HB 1 1 2 868 1 1 21 VAL HG11 H 3.820 -2.158 -4.403 1.00 . A A . 42 VAL HG11 1 1 2 869 1 1 21 VAL HG12 H 3.298 -0.495 -4.753 1.00 . A A . 42 VAL HG12 1 1 2 870 1 1 21 VAL HG13 H 3.973 -0.881 -3.172 1.00 . A A . 42 VAL HG13 1 1 2 871 1 1 21 VAL HG21 H 1.462 -2.870 -5.159 1.00 . A A . 42 VAL HG21 1 1 2 872 1 1 21 VAL HG22 H 0.050 -2.090 -4.410 1.00 . A A . 42 VAL HG22 1 1 2 873 1 1 21 VAL HG23 H 1.138 -1.143 -5.422 1.00 . A A . 42 VAL HG23 1 1 2 874 1 1 21 VAL N N 0.573 -3.027 -2.016 1.00 . A A . 42 VAL N 1 1 2 875 1 1 21 VAL O O 4.027 -2.768 -1.203 1.00 . A A . 42 VAL O 1 1 2 876 1 1 22 CYS C C 2.214 -0.929 2.128 1.00 . A A . 43 CYS C 1 1 2 877 1 1 22 CYS CA C 3.078 -1.005 0.844 1.00 . A A . 43 CYS CA 1 1 2 878 1 1 22 CYS CB C 3.542 0.371 0.318 1.00 . A A . 43 CYS CB 1 1 2 879 1 1 22 CYS H H 1.343 -1.409 -0.311 1.00 . A A . 43 CYS H 1 1 2 880 1 1 22 CYS HA H 3.963 -1.600 1.072 1.00 . A A . 43 CYS HA 1 1 2 881 1 1 22 CYS HB2 H 3.986 0.230 -0.670 1.00 . A A . 43 CYS HB2 1 1 2 882 1 1 22 CYS HB3 H 2.677 1.030 0.209 1.00 . A A . 43 CYS HB3 1 1 2 883 1 1 22 CYS N N 2.333 -1.631 -0.253 1.00 . A A . 43 CYS N 1 1 2 884 1 1 22 CYS O O 1.299 -1.730 2.335 1.00 . A A . 43 CYS O 1 1 2 885 1 1 22 CYS SG S 4.784 1.141 1.395 1.00 . A A . 43 CYS SG 1 1 2 886 1 1 23 PHE C C 1.616 1.974 4.290 1.00 . A A . 44 PHE C 1 1 2 887 1 1 23 PHE CA C 1.724 0.440 4.160 1.00 . A A . 44 PHE CA 1 1 2 888 1 1 23 PHE CB C 2.311 -0.175 5.442 1.00 . A A . 44 PHE CB 1 1 2 889 1 1 23 PHE CD1 C 4.823 0.220 5.389 1.00 . A A . 44 PHE CD1 1 1 2 890 1 1 23 PHE CD2 C 3.466 1.493 6.962 1.00 . A A . 44 PHE CD2 1 1 2 891 1 1 23 PHE CE1 C 5.969 0.900 5.835 1.00 . A A . 44 PHE CE1 1 1 2 892 1 1 23 PHE CE2 C 4.614 2.173 7.405 1.00 . A A . 44 PHE CE2 1 1 2 893 1 1 23 PHE CG C 3.565 0.515 5.950 1.00 . A A . 44 PHE CG 1 1 2 894 1 1 23 PHE CZ C 5.866 1.878 6.840 1.00 . A A . 44 PHE CZ 1 1 2 895 1 1 23 PHE H H 3.346 0.561 2.768 1.00 . A A . 44 PHE H 1 1 2 896 1 1 23 PHE HA H 0.710 0.061 4.037 1.00 . A A . 44 PHE HA 1 1 2 897 1 1 23 PHE HB2 H 1.548 -0.123 6.220 1.00 . A A . 44 PHE HB2 1 1 2 898 1 1 23 PHE HB3 H 2.521 -1.231 5.274 1.00 . A A . 44 PHE HB3 1 1 2 899 1 1 23 PHE HD1 H 4.910 -0.526 4.612 1.00 . A A . 44 PHE HD1 1 1 2 900 1 1 23 PHE HD2 H 2.503 1.731 7.393 1.00 . A A . 44 PHE HD2 1 1 2 901 1 1 23 PHE HE1 H 6.935 0.672 5.404 1.00 . A A . 44 PHE HE1 1 1 2 902 1 1 23 PHE HE2 H 4.532 2.925 8.179 1.00 . A A . 44 PHE HE2 1 1 2 903 1 1 23 PHE HZ H 6.751 2.402 7.178 1.00 . A A . 44 PHE HZ 1 1 2 904 1 1 23 PHE N N 2.520 0.025 3.002 1.00 . A A . 44 PHE N 1 1 2 905 1 1 23 PHE O O 0.682 2.452 4.935 1.00 . A A . 44 PHE O 1 1 2 906 1 1 24 LYS C C 3.308 4.873 2.543 1.00 . A A . 45 LYS C 1 1 2 907 1 1 24 LYS CA C 2.529 4.227 3.700 1.00 . A A . 45 LYS CA 1 1 2 908 1 1 24 LYS CB C 3.096 4.690 5.059 1.00 . A A . 45 LYS CB 1 1 2 909 1 1 24 LYS CD C 3.462 6.590 6.680 1.00 . A A . 45 LYS CD 1 1 2 910 1 1 24 LYS CE C 3.293 8.097 6.910 1.00 . A A . 45 LYS CE 1 1 2 911 1 1 24 LYS CG C 2.947 6.202 5.288 1.00 . A A . 45 LYS CG 1 1 2 912 1 1 24 LYS H H 3.265 2.284 3.158 1.00 . A A . 45 LYS H 1 1 2 913 1 1 24 LYS HA H 1.500 4.579 3.617 1.00 . A A . 45 LYS HA 1 1 2 914 1 1 24 LYS HB2 H 2.560 4.177 5.859 1.00 . A A . 45 LYS HB2 1 1 2 915 1 1 24 LYS HB3 H 4.150 4.414 5.130 1.00 . A A . 45 LYS HB3 1 1 2 916 1 1 24 LYS HD2 H 2.901 6.041 7.438 1.00 . A A . 45 LYS HD2 1 1 2 917 1 1 24 LYS HD3 H 4.518 6.326 6.758 1.00 . A A . 45 LYS HD3 1 1 2 918 1 1 24 LYS HE2 H 3.838 8.636 6.129 1.00 . A A . 45 LYS HE2 1 1 2 919 1 1 24 LYS HE3 H 2.233 8.351 6.812 1.00 . A A . 45 LYS HE3 1 1 2 920 1 1 24 LYS HG2 H 3.516 6.747 4.533 1.00 . A A . 45 LYS HG2 1 1 2 921 1 1 24 LYS HG3 H 1.894 6.475 5.203 1.00 . A A . 45 LYS HG3 1 1 2 922 1 1 24 LYS HZ1 H 3.291 8.028 8.989 1.00 . A A . 45 LYS HZ1 1 1 2 923 1 1 24 LYS HZ2 H 4.773 8.298 8.356 1.00 . A A . 45 LYS HZ2 1 1 2 924 1 1 24 LYS HZ3 H 3.670 9.498 8.394 1.00 . A A . 45 LYS HZ3 1 1 2 925 1 1 24 LYS N N 2.531 2.749 3.673 1.00 . A A . 45 LYS N 1 1 2 926 1 1 24 LYS NZ N 3.789 8.504 8.249 1.00 . A A . 45 LYS NZ 1 1 2 927 1 1 24 LYS O O 2.764 5.743 1.860 1.00 . A A . 45 LYS O 1 1 2 928 1 1 25 CYS C C 5.130 4.916 -0.109 1.00 . A A . 46 CYS C 1 1 2 929 1 1 25 CYS CA C 5.497 5.098 1.381 1.00 . A A . 46 CYS CA 1 1 2 930 1 1 25 CYS CB C 6.945 4.642 1.680 1.00 . A A . 46 CYS CB 1 1 2 931 1 1 25 CYS H H 4.960 3.782 2.944 1.00 . A A . 46 CYS H 1 1 2 932 1 1 25 CYS HA H 5.461 6.172 1.572 1.00 . A A . 46 CYS HA 1 1 2 933 1 1 25 CYS HB2 H 7.434 4.347 0.748 1.00 . A A . 46 CYS HB2 1 1 2 934 1 1 25 CYS HB3 H 7.494 5.507 2.060 1.00 . A A . 46 CYS HB3 1 1 2 935 1 1 25 CYS N N 4.559 4.466 2.319 1.00 . A A . 46 CYS N 1 1 2 936 1 1 25 CYS O O 5.291 5.858 -0.886 1.00 . A A . 46 CYS O 1 1 2 937 1 1 25 CYS SG S 7.091 3.294 2.896 1.00 . A A . 46 CYS SG 1 1 2 938 1 1 26 LYS C C 4.693 3.856 -3.094 1.00 . A A . 47 LYS C 1 1 2 939 1 1 26 LYS CA C 3.984 3.386 -1.799 1.00 . A A . 47 LYS CA 1 1 2 940 1 1 26 LYS CB C 2.471 3.701 -1.752 1.00 . A A . 47 LYS CB 1 1 2 941 1 1 26 LYS CD C 0.634 5.430 -1.433 1.00 . A A . 47 LYS CD 1 1 2 942 1 1 26 LYS CE C 0.352 6.866 -0.971 1.00 . A A . 47 LYS CE 1 1 2 943 1 1 26 LYS CG C 2.140 5.195 -1.608 1.00 . A A . 47 LYS CG 1 1 2 944 1 1 26 LYS H H 4.533 3.044 0.242 1.00 . A A . 47 LYS H 1 1 2 945 1 1 26 LYS HA H 4.043 2.300 -1.870 1.00 . A A . 47 LYS HA 1 1 2 946 1 1 26 LYS HB2 H 1.988 3.314 -2.651 1.00 . A A . 47 LYS HB2 1 1 2 947 1 1 26 LYS HB3 H 2.044 3.170 -0.900 1.00 . A A . 47 LYS HB3 1 1 2 948 1 1 26 LYS HD2 H 0.135 5.256 -2.389 1.00 . A A . 47 LYS HD2 1 1 2 949 1 1 26 LYS HD3 H 0.228 4.733 -0.700 1.00 . A A . 47 LYS HD3 1 1 2 950 1 1 26 LYS HE2 H 0.918 7.558 -1.602 1.00 . A A . 47 LYS HE2 1 1 2 951 1 1 26 LYS HE3 H -0.710 7.069 -1.119 1.00 . A A . 47 LYS HE3 1 1 2 952 1 1 26 LYS HG2 H 2.646 5.590 -0.734 1.00 . A A . 47 LYS HG2 1 1 2 953 1 1 26 LYS HG3 H 2.491 5.741 -2.485 1.00 . A A . 47 LYS HG3 1 1 2 954 1 1 26 LYS HZ1 H 1.650 6.803 0.672 1.00 . A A . 47 LYS HZ1 1 1 2 955 1 1 26 LYS HZ2 H 0.556 8.028 0.746 1.00 . A A . 47 LYS HZ2 1 1 2 956 1 1 26 LYS HZ3 H 0.111 6.478 1.055 1.00 . A A . 47 LYS HZ3 1 1 2 957 1 1 26 LYS N N 4.595 3.744 -0.491 1.00 . A A . 47 LYS N 1 1 2 958 1 1 26 LYS NZ N 0.690 7.068 0.463 1.00 . A A . 47 LYS NZ 1 1 2 959 1 1 26 LYS O O 4.054 3.972 -4.140 1.00 . A A . 47 LYS O 1 1 2 960 1 1 27 GLN C C 6.947 3.322 -5.255 1.00 . A A . 48 GLN C 1 1 2 961 1 1 27 GLN CA C 6.813 4.481 -4.231 1.00 . A A . 48 GLN CA 1 1 2 962 1 1 27 GLN CB C 8.204 4.975 -3.784 1.00 . A A . 48 GLN CB 1 1 2 963 1 1 27 GLN CD C 7.421 7.375 -3.392 1.00 . A A . 48 GLN CD 1 1 2 964 1 1 27 GLN CG C 8.178 6.175 -2.824 1.00 . A A . 48 GLN CG 1 1 2 965 1 1 27 GLN H H 6.472 4.009 -2.166 1.00 . A A . 48 GLN H 1 1 2 966 1 1 27 GLN HA H 6.293 5.306 -4.714 1.00 . A A . 48 GLN HA 1 1 2 967 1 1 27 GLN HB2 H 8.736 4.159 -3.298 1.00 . A A . 48 GLN HB2 1 1 2 968 1 1 27 GLN HB3 H 8.780 5.261 -4.666 1.00 . A A . 48 GLN HB3 1 1 2 969 1 1 27 GLN HE21 H 5.862 7.118 -2.127 1.00 . A A . 48 GLN HE21 1 1 2 970 1 1 27 GLN HE22 H 5.751 8.476 -3.253 1.00 . A A . 48 GLN HE22 1 1 2 971 1 1 27 GLN HG2 H 7.742 5.874 -1.872 1.00 . A A . 48 GLN HG2 1 1 2 972 1 1 27 GLN HG3 H 9.206 6.482 -2.620 1.00 . A A . 48 GLN HG3 1 1 2 973 1 1 27 GLN N N 6.008 4.099 -3.056 1.00 . A A . 48 GLN N 1 1 2 974 1 1 27 GLN NE2 N 6.249 7.684 -2.880 1.00 . A A . 48 GLN NE2 1 1 2 975 1 1 27 GLN O O 6.929 2.160 -4.832 1.00 . A A . 48 GLN O 1 1 2 976 1 1 27 GLN OE1 O 7.864 8.045 -4.316 1.00 . A A . 48 GLN OE1 1 1 2 977 1 1 28 PRO C C 7.786 1.297 -7.625 1.00 . A A . 49 PRO C 1 1 2 978 1 1 28 PRO CA C 7.009 2.628 -7.676 1.00 . A A . 49 PRO CA 1 1 2 979 1 1 28 PRO CB C 7.406 3.399 -8.940 1.00 . A A . 49 PRO CB 1 1 2 980 1 1 28 PRO CD C 7.280 4.942 -7.130 1.00 . A A . 49 PRO CD 1 1 2 981 1 1 28 PRO CG C 6.989 4.829 -8.623 1.00 . A A . 49 PRO CG 1 1 2 982 1 1 28 PRO HA H 5.950 2.377 -7.759 1.00 . A A . 49 PRO HA 1 1 2 983 1 1 28 PRO HB2 H 8.489 3.363 -9.077 1.00 . A A . 49 PRO HB2 1 1 2 984 1 1 28 PRO HB3 H 6.895 3.019 -9.824 1.00 . A A . 49 PRO HB3 1 1 2 985 1 1 28 PRO HD2 H 8.307 5.283 -6.988 1.00 . A A . 49 PRO HD2 1 1 2 986 1 1 28 PRO HD3 H 6.586 5.659 -6.694 1.00 . A A . 49 PRO HD3 1 1 2 987 1 1 28 PRO HG2 H 7.555 5.557 -9.205 1.00 . A A . 49 PRO HG2 1 1 2 988 1 1 28 PRO HG3 H 5.918 4.945 -8.798 1.00 . A A . 49 PRO HG3 1 1 2 989 1 1 28 PRO N N 7.131 3.598 -6.569 1.00 . A A . 49 PRO N 1 1 2 990 1 1 28 PRO O O 7.416 0.370 -8.350 1.00 . A A . 49 PRO O 1 1 2 991 1 1 29 GLY C C 10.352 -0.299 -5.355 1.00 . A A . 50 GLY C 1 1 2 992 1 1 29 GLY CA C 9.635 -0.071 -6.694 1.00 . A A . 50 GLY CA 1 1 2 993 1 1 29 GLY H H 9.140 1.991 -6.309 1.00 . A A . 50 GLY H 1 1 2 994 1 1 29 GLY HA2 H 10.391 -0.072 -7.480 1.00 . A A . 50 GLY HA2 1 1 2 995 1 1 29 GLY HA3 H 8.984 -0.931 -6.855 1.00 . A A . 50 GLY HA3 1 1 2 996 1 1 29 GLY N N 8.841 1.170 -6.813 1.00 . A A . 50 GLY N 1 1 2 997 1 1 29 GLY O O 11.040 -1.306 -5.191 1.00 . A A . 50 GLY O 1 1 2 998 1 1 30 HIS C C 10.455 -0.663 -2.208 1.00 . A A . 51 HIS C 1 1 2 999 1 1 30 HIS CA C 10.869 0.548 -3.074 1.00 . A A . 51 HIS CA 1 1 2 1000 1 1 30 HIS CB C 10.583 1.856 -2.313 1.00 . A A . 51 HIS CB 1 1 2 1001 1 1 30 HIS CD2 C 9.066 1.809 -0.256 1.00 . A A . 51 HIS CD2 1 1 2 1002 1 1 30 HIS CE1 C 7.103 1.531 -1.201 1.00 . A A . 51 HIS CE1 1 1 2 1003 1 1 30 HIS CG C 9.243 1.864 -1.612 1.00 . A A . 51 HIS CG 1 1 2 1004 1 1 30 HIS H H 9.627 1.418 -4.578 1.00 . A A . 51 HIS H 1 1 2 1005 1 1 30 HIS HA H 11.945 0.480 -3.243 1.00 . A A . 51 HIS HA 1 1 2 1006 1 1 30 HIS HB2 H 11.360 1.983 -1.558 1.00 . A A . 51 HIS HB2 1 1 2 1007 1 1 30 HIS HB3 H 10.650 2.708 -2.991 1.00 . A A . 51 HIS HB3 1 1 2 1008 1 1 30 HIS HD1 H 7.766 1.714 -3.178 1.00 . A A . 51 HIS HD1 1 1 2 1009 1 1 30 HIS HD2 H 9.854 1.835 0.484 1.00 . A A . 51 HIS HD2 1 1 2 1010 1 1 30 HIS HE1 H 6.047 1.348 -1.349 1.00 . A A . 51 HIS HE1 1 1 2 1011 1 1 30 HIS N N 10.200 0.611 -4.385 1.00 . A A . 51 HIS N 1 1 2 1012 1 1 30 HIS ND1 N 7.996 1.705 -2.186 1.00 . A A . 51 HIS ND1 1 1 2 1013 1 1 30 HIS NE2 N 7.705 1.604 -0.003 1.00 . A A . 51 HIS NE2 1 1 2 1014 1 1 30 HIS O O 11.207 -1.114 -1.341 1.00 . A A . 51 HIS O 1 1 2 1015 1 1 31 PHE C C 9.372 -3.506 -1.525 1.00 . A A . 52 PHE C 1 1 2 1016 1 1 31 PHE CA C 8.606 -2.178 -1.551 1.00 . A A . 52 PHE CA 1 1 2 1017 1 1 31 PHE CB C 7.137 -2.350 -1.968 1.00 . A A . 52 PHE CB 1 1 2 1018 1 1 31 PHE CD1 C 6.925 -3.738 -4.090 1.00 . A A . 52 PHE CD1 1 1 2 1019 1 1 31 PHE CD2 C 6.610 -1.329 -4.227 1.00 . A A . 52 PHE CD2 1 1 2 1020 1 1 31 PHE CE1 C 6.706 -3.844 -5.475 1.00 . A A . 52 PHE CE1 1 1 2 1021 1 1 31 PHE CE2 C 6.381 -1.437 -5.610 1.00 . A A . 52 PHE CE2 1 1 2 1022 1 1 31 PHE CG C 6.885 -2.480 -3.462 1.00 . A A . 52 PHE CG 1 1 2 1023 1 1 31 PHE CZ C 6.436 -2.693 -6.236 1.00 . A A . 52 PHE CZ 1 1 2 1024 1 1 31 PHE H H 8.687 -0.787 -3.159 1.00 . A A . 52 PHE H 1 1 2 1025 1 1 31 PHE HA H 8.612 -1.793 -0.530 1.00 . A A . 52 PHE HA 1 1 2 1026 1 1 31 PHE HB2 H 6.727 -3.223 -1.461 1.00 . A A . 52 PHE HB2 1 1 2 1027 1 1 31 PHE HB3 H 6.580 -1.485 -1.603 1.00 . A A . 52 PHE HB3 1 1 2 1028 1 1 31 PHE HD1 H 7.130 -4.630 -3.513 1.00 . A A . 52 PHE HD1 1 1 2 1029 1 1 31 PHE HD2 H 6.546 -0.360 -3.755 1.00 . A A . 52 PHE HD2 1 1 2 1030 1 1 31 PHE HE1 H 6.748 -4.812 -5.957 1.00 . A A . 52 PHE HE1 1 1 2 1031 1 1 31 PHE HE2 H 6.148 -0.554 -6.188 1.00 . A A . 52 PHE HE2 1 1 2 1032 1 1 31 PHE HZ H 6.263 -2.774 -7.302 1.00 . A A . 52 PHE HZ 1 1 2 1033 1 1 31 PHE N N 9.241 -1.182 -2.415 1.00 . A A . 52 PHE N 1 1 2 1034 1 1 31 PHE O O 9.615 -4.043 -0.444 1.00 . A A . 52 PHE O 1 1 2 1035 1 1 32 SER C C 12.019 -5.194 -2.106 1.00 . A A . 53 SER C 1 1 2 1036 1 1 32 SER CA C 10.656 -5.208 -2.826 1.00 . A A . 53 SER CA 1 1 2 1037 1 1 32 SER CB C 10.881 -5.502 -4.316 1.00 . A A . 53 SER CB 1 1 2 1038 1 1 32 SER H H 9.609 -3.488 -3.527 1.00 . A A . 53 SER H 1 1 2 1039 1 1 32 SER HA H 10.085 -6.035 -2.406 1.00 . A A . 53 SER HA 1 1 2 1040 1 1 32 SER HB2 H 11.474 -4.699 -4.759 1.00 . A A . 53 SER HB2 1 1 2 1041 1 1 32 SER HB3 H 11.428 -6.442 -4.421 1.00 . A A . 53 SER HB3 1 1 2 1042 1 1 32 SER HG H 9.819 -5.832 -5.929 1.00 . A A . 53 SER HG 1 1 2 1043 1 1 32 SER N N 9.859 -3.976 -2.676 1.00 . A A . 53 SER N 1 1 2 1044 1 1 32 SER O O 12.719 -6.210 -2.107 1.00 . A A . 53 SER O 1 1 2 1045 1 1 32 SER OG O 9.640 -5.609 -4.995 1.00 . A A . 53 SER OG 1 1 2 1046 1 1 33 LYS C C 13.464 -3.180 0.637 1.00 . A A . 54 LYS C 1 1 2 1047 1 1 33 LYS CA C 13.651 -3.881 -0.724 1.00 . A A . 54 LYS CA 1 1 2 1048 1 1 33 LYS CB C 14.687 -3.174 -1.626 1.00 . A A . 54 LYS CB 1 1 2 1049 1 1 33 LYS CD C 15.362 -1.021 -2.850 1.00 . A A . 54 LYS CD 1 1 2 1050 1 1 33 LYS CE C 15.588 -1.656 -4.230 1.00 . A A . 54 LYS CE 1 1 2 1051 1 1 33 LYS CG C 14.275 -1.752 -2.053 1.00 . A A . 54 LYS CG 1 1 2 1052 1 1 33 LYS H H 11.788 -3.267 -1.571 1.00 . A A . 54 LYS H 1 1 2 1053 1 1 33 LYS HA H 14.059 -4.862 -0.479 1.00 . A A . 54 LYS HA 1 1 2 1054 1 1 33 LYS HB2 H 15.640 -3.123 -1.097 1.00 . A A . 54 LYS HB2 1 1 2 1055 1 1 33 LYS HB3 H 14.838 -3.785 -2.517 1.00 . A A . 54 LYS HB3 1 1 2 1056 1 1 33 LYS HD2 H 15.049 0.016 -2.984 1.00 . A A . 54 LYS HD2 1 1 2 1057 1 1 33 LYS HD3 H 16.295 -1.028 -2.280 1.00 . A A . 54 LYS HD3 1 1 2 1058 1 1 33 LYS HE2 H 15.899 -2.695 -4.097 1.00 . A A . 54 LYS HE2 1 1 2 1059 1 1 33 LYS HE3 H 14.639 -1.656 -4.775 1.00 . A A . 54 LYS HE3 1 1 2 1060 1 1 33 LYS HG2 H 13.375 -1.803 -2.664 1.00 . A A . 54 LYS HG2 1 1 2 1061 1 1 33 LYS HG3 H 14.056 -1.162 -1.161 1.00 . A A . 54 LYS HG3 1 1 2 1062 1 1 33 LYS HZ1 H 16.352 0.045 -5.153 1.00 . A A . 54 LYS HZ1 1 1 2 1063 1 1 33 LYS HZ2 H 17.511 -0.924 -4.531 1.00 . A A . 54 LYS HZ2 1 1 2 1064 1 1 33 LYS HZ3 H 16.758 -1.337 -5.917 1.00 . A A . 54 LYS HZ3 1 1 2 1065 1 1 33 LYS N N 12.400 -4.069 -1.481 1.00 . A A . 54 LYS N 1 1 2 1066 1 1 33 LYS NZ N 16.620 -0.918 -5.007 1.00 . A A . 54 LYS NZ 1 1 2 1067 1 1 33 LYS O O 14.460 -2.817 1.268 1.00 . A A . 54 LYS O 1 1 2 1068 1 1 34 GLN C C 10.621 -2.797 3.054 1.00 . A A . 55 GLN C 1 1 2 1069 1 1 34 GLN CA C 11.930 -2.326 2.386 1.00 . A A . 55 GLN CA 1 1 2 1070 1 1 34 GLN CB C 11.893 -0.800 2.163 1.00 . A A . 55 GLN CB 1 1 2 1071 1 1 34 GLN CD C 11.704 1.482 3.252 1.00 . A A . 55 GLN CD 1 1 2 1072 1 1 34 GLN CG C 11.841 -0.019 3.485 1.00 . A A . 55 GLN CG 1 1 2 1073 1 1 34 GLN H H 11.454 -3.349 0.556 1.00 . A A . 55 GLN H 1 1 2 1074 1 1 34 GLN HA H 12.739 -2.549 3.084 1.00 . A A . 55 GLN HA 1 1 2 1075 1 1 34 GLN HB2 H 12.790 -0.492 1.622 1.00 . A A . 55 GLN HB2 1 1 2 1076 1 1 34 GLN HB3 H 11.026 -0.542 1.553 1.00 . A A . 55 GLN HB3 1 1 2 1077 1 1 34 GLN HE21 H 9.689 1.389 3.314 1.00 . A A . 55 GLN HE21 1 1 2 1078 1 1 34 GLN HE22 H 10.385 2.990 3.089 1.00 . A A . 55 GLN HE22 1 1 2 1079 1 1 34 GLN HG2 H 10.992 -0.354 4.083 1.00 . A A . 55 GLN HG2 1 1 2 1080 1 1 34 GLN HG3 H 12.751 -0.209 4.053 1.00 . A A . 55 GLN HG3 1 1 2 1081 1 1 34 GLN N N 12.222 -2.985 1.101 1.00 . A A . 55 GLN N 1 1 2 1082 1 1 34 GLN NE2 N 10.494 1.998 3.213 1.00 . A A . 55 GLN NE2 1 1 2 1083 1 1 34 GLN O O 10.639 -3.165 4.232 1.00 . A A . 55 GLN O 1 1 2 1084 1 1 34 GLN OE1 O 12.674 2.215 3.104 1.00 . A A . 55 GLN OE1 1 1 2 1085 1 1 35 CYS C C 7.443 -4.229 2.608 1.00 . A A . 56 CYS C 1 1 2 1086 1 1 35 CYS CA C 8.145 -2.885 2.893 1.00 . A A . 56 CYS CA 1 1 2 1087 1 1 35 CYS CB C 7.309 -1.703 2.373 1.00 . A A . 56 CYS CB 1 1 2 1088 1 1 35 CYS H H 9.569 -2.449 1.375 1.00 . A A . 56 CYS H 1 1 2 1089 1 1 35 CYS HA H 8.205 -2.783 3.978 1.00 . A A . 56 CYS HA 1 1 2 1090 1 1 35 CYS HB2 H 7.196 -1.775 1.288 1.00 . A A . 56 CYS HB2 1 1 2 1091 1 1 35 CYS HB3 H 6.314 -1.749 2.821 1.00 . A A . 56 CYS HB3 1 1 2 1092 1 1 35 CYS N N 9.499 -2.785 2.322 1.00 . A A . 56 CYS N 1 1 2 1093 1 1 35 CYS O O 6.467 -4.576 3.281 1.00 . A A . 56 CYS O 1 1 2 1094 1 1 35 CYS SG S 8.101 -0.133 2.821 1.00 . A A . 56 CYS SG 1 1 2 1095 1 1 36 ARG C C 8.510 -7.320 0.859 1.00 . A A . 57 ARG C 1 1 2 1096 1 1 36 ARG CA C 7.403 -6.289 1.168 1.00 . A A . 57 ARG CA 1 1 2 1097 1 1 36 ARG CB C 6.494 -6.052 -0.061 1.00 . A A . 57 ARG CB 1 1 2 1098 1 1 36 ARG CD C 3.967 -6.084 0.423 1.00 . A A . 57 ARG CD 1 1 2 1099 1 1 36 ARG CG C 5.198 -6.887 -0.035 1.00 . A A . 57 ARG CG 1 1 2 1100 1 1 36 ARG CZ C 3.334 -4.590 2.325 1.00 . A A . 57 ARG CZ 1 1 2 1101 1 1 36 ARG H H 8.695 -4.586 1.088 1.00 . A A . 57 ARG H 1 1 2 1102 1 1 36 ARG HA H 6.818 -6.726 1.980 1.00 . A A . 57 ARG HA 1 1 2 1103 1 1 36 ARG HB2 H 6.220 -4.997 -0.131 1.00 . A A . 57 ARG HB2 1 1 2 1104 1 1 36 ARG HB3 H 7.052 -6.288 -0.968 1.00 . A A . 57 ARG HB3 1 1 2 1105 1 1 36 ARG HD2 H 3.742 -5.339 -0.343 1.00 . A A . 57 ARG HD2 1 1 2 1106 1 1 36 ARG HD3 H 3.116 -6.764 0.497 1.00 . A A . 57 ARG HD3 1 1 2 1107 1 1 36 ARG HE H 5.087 -5.472 2.144 1.00 . A A . 57 ARG HE 1 1 2 1108 1 1 36 ARG HG2 H 4.999 -7.247 -1.045 1.00 . A A . 57 ARG HG2 1 1 2 1109 1 1 36 ARG HG3 H 5.325 -7.761 0.607 1.00 . A A . 57 ARG HG3 1 1 2 1110 1 1 36 ARG HH11 H 1.861 -4.764 0.994 1.00 . A A . 57 ARG HH11 1 1 2 1111 1 1 36 ARG HH12 H 1.613 -3.575 2.249 1.00 . A A . 57 ARG HH12 1 1 2 1112 1 1 36 ARG HH21 H 4.652 -4.103 3.733 1.00 . A A . 57 ARG HH21 1 1 2 1113 1 1 36 ARG HH22 H 3.054 -3.393 3.910 1.00 . A A . 57 ARG HH22 1 1 2 1114 1 1 36 ARG N N 7.933 -4.990 1.624 1.00 . A A . 57 ARG N 1 1 2 1115 1 1 36 ARG NE N 4.173 -5.402 1.716 1.00 . A A . 57 ARG NE 1 1 2 1116 1 1 36 ARG NH1 N 2.134 -4.363 1.882 1.00 . A A . 57 ARG NH1 1 1 2 1117 1 1 36 ARG NH2 N 3.703 -3.969 3.405 1.00 . A A . 57 ARG NH2 1 1 2 1118 1 1 36 ARG O O 8.208 -8.430 0.416 1.00 . A A . 57 ARG O 1 1 2 1119 1 1 37 SER C C 10.936 -9.053 1.862 1.00 . A A . 58 SER C 1 1 2 1120 1 1 37 SER CA C 10.985 -7.789 0.990 1.00 . A A . 58 SER CA 1 1 2 1121 1 1 37 SER CB C 12.228 -6.949 1.311 1.00 . A A . 58 SER CB 1 1 2 1122 1 1 37 SER H H 9.913 -6.029 1.474 1.00 . A A . 58 SER H 1 1 2 1123 1 1 37 SER HA H 11.082 -8.130 -0.040 1.00 . A A . 58 SER HA 1 1 2 1124 1 1 37 SER HB2 H 13.090 -7.605 1.458 1.00 . A A . 58 SER HB2 1 1 2 1125 1 1 37 SER HB3 H 12.441 -6.300 0.462 1.00 . A A . 58 SER HB3 1 1 2 1126 1 1 37 SER HG H 11.837 -6.722 3.220 1.00 . A A . 58 SER HG 1 1 2 1127 1 1 37 SER N N 9.776 -6.948 1.085 1.00 . A A . 58 SER N 1 1 2 1128 1 1 37 SER O O 10.518 -8.968 3.041 1.00 . A A . 58 SER O 1 1 2 1129 1 1 37 SER OXT O 11.337 -10.128 1.363 1.00 . A A . 58 SER OXT 1 1 2 1130 1 1 37 SER OG O 12.020 -6.138 2.458 1.00 . A A . 58 SER OG 1 1 2 1131 2 2 1 ZN ZN ZN -8.186 0.465 3.798 1.00 . B A . 1059 ZN ZN 1 1 2 1132 3 2 1 ZN ZN ZN 6.891 1.384 1.888 1.00 . C A . 1060 ZN ZN 1 1 3 1133 1 1 1 GLN C C -6.469 -1.788 -4.539 1.00 . A A . 22 GLN C 1 1 3 1134 1 1 1 GLN CA C -6.283 -1.445 -6.017 1.00 . A A . 22 GLN CA 1 1 3 1135 1 1 1 GLN CB C -4.874 -0.879 -6.287 1.00 . A A . 22 GLN CB 1 1 3 1136 1 1 1 GLN CD C -2.379 -1.376 -6.403 1.00 . A A . 22 GLN CD 1 1 3 1137 1 1 1 GLN CG C -3.763 -1.913 -6.037 1.00 . A A . 22 GLN CG 1 1 3 1138 1 1 1 GLN H1 H -8.254 -0.885 -6.279 1.00 . A A . 22 GLN H1 1 1 3 1139 1 1 1 GLN H2 H -7.271 0.364 -5.899 1.00 . A A . 22 GLN H2 1 1 3 1140 1 1 1 GLN H3 H -7.246 -0.264 -7.420 1.00 . A A . 22 GLN H3 1 1 3 1141 1 1 1 GLN HA H -6.399 -2.362 -6.595 1.00 . A A . 22 GLN HA 1 1 3 1142 1 1 1 GLN HB2 H -4.816 -0.565 -7.331 1.00 . A A . 22 GLN HB2 1 1 3 1143 1 1 1 GLN HB3 H -4.704 -0.003 -5.656 1.00 . A A . 22 GLN HB3 1 1 3 1144 1 1 1 GLN HE21 H -1.806 -3.106 -7.287 1.00 . A A . 22 GLN HE21 1 1 3 1145 1 1 1 GLN HE22 H -0.633 -1.795 -7.273 1.00 . A A . 22 GLN HE22 1 1 3 1146 1 1 1 GLN HG2 H -3.746 -2.206 -4.987 1.00 . A A . 22 GLN HG2 1 1 3 1147 1 1 1 GLN HG3 H -3.969 -2.803 -6.635 1.00 . A A . 22 GLN HG3 1 1 3 1148 1 1 1 GLN N N -7.337 -0.489 -6.442 1.00 . A A . 22 GLN N 1 1 3 1149 1 1 1 GLN NE2 N -1.542 -2.163 -7.040 1.00 . A A . 22 GLN NE2 1 1 3 1150 1 1 1 GLN O O -6.586 -0.884 -3.717 1.00 . A A . 22 GLN O 1 1 3 1151 1 1 1 GLN OE1 O -2.021 -0.242 -6.122 1.00 . A A . 22 GLN OE1 1 1 3 1152 1 1 2 THR C C -6.017 -2.908 -1.718 1.00 . A A . 23 THR C 1 1 3 1153 1 1 2 THR CA C -6.832 -3.579 -2.833 1.00 . A A . 23 THR CA 1 1 3 1154 1 1 2 THR CB C -6.645 -5.107 -2.785 1.00 . A A . 23 THR CB 1 1 3 1155 1 1 2 THR CG2 C -7.264 -5.757 -1.546 1.00 . A A . 23 THR CG2 1 1 3 1156 1 1 2 THR H H -6.436 -3.786 -4.907 1.00 . A A . 23 THR H 1 1 3 1157 1 1 2 THR HA H -7.881 -3.371 -2.640 1.00 . A A . 23 THR HA 1 1 3 1158 1 1 2 THR HB H -5.581 -5.343 -2.825 1.00 . A A . 23 THR HB 1 1 3 1159 1 1 2 THR HG1 H -7.075 -6.633 -3.913 1.00 . A A . 23 THR HG1 1 1 3 1160 1 1 2 THR HG21 H -8.326 -5.518 -1.494 1.00 . A A . 23 THR HG21 1 1 3 1161 1 1 2 THR HG22 H -7.146 -6.839 -1.603 1.00 . A A . 23 THR HG22 1 1 3 1162 1 1 2 THR HG23 H -6.763 -5.408 -0.644 1.00 . A A . 23 THR HG23 1 1 3 1163 1 1 2 THR N N -6.522 -3.077 -4.190 1.00 . A A . 23 THR N 1 1 3 1164 1 1 2 THR O O -4.823 -2.654 -1.878 1.00 . A A . 23 THR O 1 1 3 1165 1 1 2 THR OG1 O -7.288 -5.683 -3.903 1.00 . A A . 23 THR OG1 1 1 3 1166 1 1 3 CYS C C -4.922 -2.846 1.224 1.00 . A A . 24 CYS C 1 1 3 1167 1 1 3 CYS CA C -6.078 -2.026 0.612 1.00 . A A . 24 CYS CA 1 1 3 1168 1 1 3 CYS CB C -7.210 -1.875 1.631 1.00 . A A . 24 CYS CB 1 1 3 1169 1 1 3 CYS H H -7.658 -2.824 -0.558 1.00 . A A . 24 CYS H 1 1 3 1170 1 1 3 CYS HA H -5.709 -1.032 0.346 1.00 . A A . 24 CYS HA 1 1 3 1171 1 1 3 CYS HB2 H -8.098 -1.482 1.138 1.00 . A A . 24 CYS HB2 1 1 3 1172 1 1 3 CYS HB3 H -7.455 -2.856 2.039 1.00 . A A . 24 CYS HB3 1 1 3 1173 1 1 3 CYS N N -6.667 -2.633 -0.583 1.00 . A A . 24 CYS N 1 1 3 1174 1 1 3 CYS O O -4.915 -4.079 1.163 1.00 . A A . 24 CYS O 1 1 3 1175 1 1 3 CYS SG S -6.709 -0.747 2.956 1.00 . A A . 24 CYS SG 1 1 3 1176 1 1 4 TYR C C -3.646 -3.429 4.081 1.00 . A A . 25 TYR C 1 1 3 1177 1 1 4 TYR CA C -3.024 -2.789 2.818 1.00 . A A . 25 TYR CA 1 1 3 1178 1 1 4 TYR CB C -1.946 -1.767 3.219 1.00 . A A . 25 TYR CB 1 1 3 1179 1 1 4 TYR CD1 C -3.407 -0.035 4.386 1.00 . A A . 25 TYR CD1 1 1 3 1180 1 1 4 TYR CD2 C -1.457 -0.895 5.558 1.00 . A A . 25 TYR CD2 1 1 3 1181 1 1 4 TYR CE1 C -3.734 0.749 5.504 1.00 . A A . 25 TYR CE1 1 1 3 1182 1 1 4 TYR CE2 C -1.764 -0.088 6.670 1.00 . A A . 25 TYR CE2 1 1 3 1183 1 1 4 TYR CG C -2.274 -0.871 4.407 1.00 . A A . 25 TYR CG 1 1 3 1184 1 1 4 TYR CZ C -2.910 0.738 6.646 1.00 . A A . 25 TYR CZ 1 1 3 1185 1 1 4 TYR H H -4.086 -1.156 1.933 1.00 . A A . 25 TYR H 1 1 3 1186 1 1 4 TYR HA H -2.533 -3.592 2.270 1.00 . A A . 25 TYR HA 1 1 3 1187 1 1 4 TYR HB2 H -1.051 -2.337 3.468 1.00 . A A . 25 TYR HB2 1 1 3 1188 1 1 4 TYR HB3 H -1.695 -1.142 2.363 1.00 . A A . 25 TYR HB3 1 1 3 1189 1 1 4 TYR HD1 H -4.047 -0.001 3.518 1.00 . A A . 25 TYR HD1 1 1 3 1190 1 1 4 TYR HD2 H -0.590 -1.541 5.589 1.00 . A A . 25 TYR HD2 1 1 3 1191 1 1 4 TYR HE1 H -4.630 1.344 5.500 1.00 . A A . 25 TYR HE1 1 1 3 1192 1 1 4 TYR HE2 H -1.132 -0.105 7.546 1.00 . A A . 25 TYR HE2 1 1 3 1193 1 1 4 TYR HH H -2.620 1.399 8.455 1.00 . A A . 25 TYR HH 1 1 3 1194 1 1 4 TYR N N -4.003 -2.164 1.913 1.00 . A A . 25 TYR N 1 1 3 1195 1 1 4 TYR O O -2.980 -4.213 4.762 1.00 . A A . 25 TYR O 1 1 3 1196 1 1 4 TYR OH O -3.241 1.515 7.714 1.00 . A A . 25 TYR OH 1 1 3 1197 1 1 5 ASN C C -7.011 -3.934 5.491 1.00 . A A . 26 ASN C 1 1 3 1198 1 1 5 ASN CA C -5.564 -3.435 5.668 1.00 . A A . 26 ASN CA 1 1 3 1199 1 1 5 ASN CB C -5.524 -2.163 6.538 1.00 . A A . 26 ASN CB 1 1 3 1200 1 1 5 ASN CG C -6.308 -2.306 7.833 1.00 . A A . 26 ASN CG 1 1 3 1201 1 1 5 ASN H H -5.372 -2.441 3.790 1.00 . A A . 26 ASN H 1 1 3 1202 1 1 5 ASN HA H -5.014 -4.225 6.184 1.00 . A A . 26 ASN HA 1 1 3 1203 1 1 5 ASN HB2 H -4.487 -1.933 6.788 1.00 . A A . 26 ASN HB2 1 1 3 1204 1 1 5 ASN HB3 H -5.926 -1.318 5.978 1.00 . A A . 26 ASN HB3 1 1 3 1205 1 1 5 ASN HD21 H -7.977 -1.458 7.041 1.00 . A A . 26 ASN HD21 1 1 3 1206 1 1 5 ASN HD22 H -8.065 -1.956 8.724 1.00 . A A . 26 ASN HD22 1 1 3 1207 1 1 5 ASN N N -4.907 -3.104 4.399 1.00 . A A . 26 ASN N 1 1 3 1208 1 1 5 ASN ND2 N -7.544 -1.856 7.867 1.00 . A A . 26 ASN ND2 1 1 3 1209 1 1 5 ASN O O -7.385 -4.964 6.057 1.00 . A A . 26 ASN O 1 1 3 1210 1 1 5 ASN OD1 O -5.821 -2.830 8.826 1.00 . A A . 26 ASN OD1 1 1 3 1211 1 1 6 CYS C C -9.737 -4.553 3.741 1.00 . A A . 27 CYS C 1 1 3 1212 1 1 6 CYS CA C -9.275 -3.380 4.641 1.00 . A A . 27 CYS CA 1 1 3 1213 1 1 6 CYS CB C -9.879 -2.047 4.171 1.00 . A A . 27 CYS CB 1 1 3 1214 1 1 6 CYS H H -7.450 -2.370 4.289 1.00 . A A . 27 CYS H 1 1 3 1215 1 1 6 CYS HA H -9.646 -3.579 5.648 1.00 . A A . 27 CYS HA 1 1 3 1216 1 1 6 CYS HB2 H -9.594 -1.868 3.132 1.00 . A A . 27 CYS HB2 1 1 3 1217 1 1 6 CYS HB3 H -10.969 -2.121 4.214 1.00 . A A . 27 CYS HB3 1 1 3 1218 1 1 6 CYS N N -7.822 -3.211 4.712 1.00 . A A . 27 CYS N 1 1 3 1219 1 1 6 CYS O O -10.920 -4.904 3.747 1.00 . A A . 27 CYS O 1 1 3 1220 1 1 6 CYS SG S -9.326 -0.670 5.226 1.00 . A A . 27 CYS SG 1 1 3 1221 1 1 7 GLY C C -10.153 -5.984 0.959 1.00 . A A . 28 GLY C 1 1 3 1222 1 1 7 GLY CA C -9.113 -6.278 2.054 1.00 . A A . 28 GLY CA 1 1 3 1223 1 1 7 GLY H H -7.870 -4.843 3.040 1.00 . A A . 28 GLY H 1 1 3 1224 1 1 7 GLY HA2 H -9.465 -7.126 2.642 1.00 . A A . 28 GLY HA2 1 1 3 1225 1 1 7 GLY HA3 H -8.186 -6.568 1.559 1.00 . A A . 28 GLY HA3 1 1 3 1226 1 1 7 GLY N N -8.828 -5.152 2.957 1.00 . A A . 28 GLY N 1 1 3 1227 1 1 7 GLY O O -10.864 -6.895 0.527 1.00 . A A . 28 GLY O 1 1 3 1228 1 1 8 LYS C C -10.726 -3.601 -1.648 1.00 . A A . 29 LYS C 1 1 3 1229 1 1 8 LYS CA C -11.326 -4.204 -0.361 1.00 . A A . 29 LYS CA 1 1 3 1230 1 1 8 LYS CB C -12.147 -3.182 0.451 1.00 . A A . 29 LYS CB 1 1 3 1231 1 1 8 LYS CD C -14.508 -3.677 -0.408 1.00 . A A . 29 LYS CD 1 1 3 1232 1 1 8 LYS CE C -15.758 -3.037 -1.026 1.00 . A A . 29 LYS CE 1 1 3 1233 1 1 8 LYS CG C -13.392 -2.628 -0.262 1.00 . A A . 29 LYS CG 1 1 3 1234 1 1 8 LYS H H -9.631 -4.045 0.930 1.00 . A A . 29 LYS H 1 1 3 1235 1 1 8 LYS HA H -11.995 -5.023 -0.614 1.00 . A A . 29 LYS HA 1 1 3 1236 1 1 8 LYS HB2 H -12.467 -3.645 1.387 1.00 . A A . 29 LYS HB2 1 1 3 1237 1 1 8 LYS HB3 H -11.503 -2.345 0.717 1.00 . A A . 29 LYS HB3 1 1 3 1238 1 1 8 LYS HD2 H -14.170 -4.495 -1.043 1.00 . A A . 29 LYS HD2 1 1 3 1239 1 1 8 LYS HD3 H -14.755 -4.072 0.579 1.00 . A A . 29 LYS HD3 1 1 3 1240 1 1 8 LYS HE2 H -16.065 -2.193 -0.401 1.00 . A A . 29 LYS HE2 1 1 3 1241 1 1 8 LYS HE3 H -15.505 -2.647 -2.016 1.00 . A A . 29 LYS HE3 1 1 3 1242 1 1 8 LYS HG2 H -13.777 -1.797 0.331 1.00 . A A . 29 LYS HG2 1 1 3 1243 1 1 8 LYS HG3 H -13.118 -2.242 -1.244 1.00 . A A . 29 LYS HG3 1 1 3 1244 1 1 8 LYS HZ1 H -17.138 -4.373 -0.225 1.00 . A A . 29 LYS HZ1 1 1 3 1245 1 1 8 LYS HZ2 H -17.694 -3.584 -1.538 1.00 . A A . 29 LYS HZ2 1 1 3 1246 1 1 8 LYS HZ3 H -16.623 -4.801 -1.718 1.00 . A A . 29 LYS HZ3 1 1 3 1247 1 1 8 LYS N N -10.262 -4.719 0.522 1.00 . A A . 29 LYS N 1 1 3 1248 1 1 8 LYS NZ N -16.873 -4.015 -1.134 1.00 . A A . 29 LYS NZ 1 1 3 1249 1 1 8 LYS O O -9.972 -2.629 -1.534 1.00 . A A . 29 LYS O 1 1 3 1250 1 1 9 PRO C C -10.539 -2.197 -4.464 1.00 . A A . 30 PRO C 1 1 3 1251 1 1 9 PRO CA C -10.452 -3.697 -4.140 1.00 . A A . 30 PRO CA 1 1 3 1252 1 1 9 PRO CB C -11.179 -4.511 -5.214 1.00 . A A . 30 PRO CB 1 1 3 1253 1 1 9 PRO CD C -11.825 -5.339 -3.074 1.00 . A A . 30 PRO CD 1 1 3 1254 1 1 9 PRO CG C -11.519 -5.809 -4.494 1.00 . A A . 30 PRO CG 1 1 3 1255 1 1 9 PRO HA H -9.402 -3.985 -4.157 1.00 . A A . 30 PRO HA 1 1 3 1256 1 1 9 PRO HB2 H -12.104 -4.011 -5.509 1.00 . A A . 30 PRO HB2 1 1 3 1257 1 1 9 PRO HB3 H -10.548 -4.688 -6.085 1.00 . A A . 30 PRO HB3 1 1 3 1258 1 1 9 PRO HD2 H -12.883 -5.090 -2.993 1.00 . A A . 30 PRO HD2 1 1 3 1259 1 1 9 PRO HD3 H -11.567 -6.134 -2.372 1.00 . A A . 30 PRO HD3 1 1 3 1260 1 1 9 PRO HG2 H -12.374 -6.315 -4.947 1.00 . A A . 30 PRO HG2 1 1 3 1261 1 1 9 PRO HG3 H -10.646 -6.462 -4.483 1.00 . A A . 30 PRO HG3 1 1 3 1262 1 1 9 PRO N N -11.023 -4.137 -2.854 1.00 . A A . 30 PRO N 1 1 3 1263 1 1 9 PRO O O -9.640 -1.661 -5.116 1.00 . A A . 30 PRO O 1 1 3 1264 1 1 10 GLY C C -11.000 0.926 -3.516 1.00 . A A . 31 GLY C 1 1 3 1265 1 1 10 GLY CA C -11.871 -0.085 -4.275 1.00 . A A . 31 GLY CA 1 1 3 1266 1 1 10 GLY H H -12.285 -2.019 -3.483 1.00 . A A . 31 GLY H 1 1 3 1267 1 1 10 GLY HA2 H -12.915 0.119 -4.038 1.00 . A A . 31 GLY HA2 1 1 3 1268 1 1 10 GLY HA3 H -11.731 0.096 -5.342 1.00 . A A . 31 GLY HA3 1 1 3 1269 1 1 10 GLY N N -11.585 -1.505 -3.998 1.00 . A A . 31 GLY N 1 1 3 1270 1 1 10 GLY O O -11.468 2.017 -3.178 1.00 . A A . 31 GLY O 1 1 3 1271 1 1 11 HIS C C -7.754 2.068 -3.427 1.00 . A A . 32 HIS C 1 1 3 1272 1 1 11 HIS CA C -8.787 1.406 -2.501 1.00 . A A . 32 HIS CA 1 1 3 1273 1 1 11 HIS CB C -8.132 0.586 -1.376 1.00 . A A . 32 HIS CB 1 1 3 1274 1 1 11 HIS CD2 C -8.554 1.304 1.047 1.00 . A A . 32 HIS CD2 1 1 3 1275 1 1 11 HIS CE1 C -10.448 0.266 1.439 1.00 . A A . 32 HIS CE1 1 1 3 1276 1 1 11 HIS CG C -8.913 0.638 -0.092 1.00 . A A . 32 HIS CG 1 1 3 1277 1 1 11 HIS H H -9.429 -0.332 -3.547 1.00 . A A . 32 HIS H 1 1 3 1278 1 1 11 HIS HA H -9.319 2.228 -2.030 1.00 . A A . 32 HIS HA 1 1 3 1279 1 1 11 HIS HB2 H -8.038 -0.455 -1.681 1.00 . A A . 32 HIS HB2 1 1 3 1280 1 1 11 HIS HB3 H -7.125 0.957 -1.174 1.00 . A A . 32 HIS HB3 1 1 3 1281 1 1 11 HIS HD1 H -10.580 -0.631 -0.467 1.00 . A A . 32 HIS HD1 1 1 3 1282 1 1 11 HIS HD2 H -7.664 1.902 1.163 1.00 . A A . 32 HIS HD2 1 1 3 1283 1 1 11 HIS HE1 H -11.336 -0.115 1.933 1.00 . A A . 32 HIS HE1 1 1 3 1284 1 1 11 HIS N N -9.751 0.568 -3.213 1.00 . A A . 32 HIS N 1 1 3 1285 1 1 11 HIS ND1 N -10.097 -0.007 0.170 1.00 . A A . 32 HIS ND1 1 1 3 1286 1 1 11 HIS NE2 N -9.522 1.047 2.027 1.00 . A A . 32 HIS NE2 1 1 3 1287 1 1 11 HIS O O -7.598 1.724 -4.603 1.00 . A A . 32 HIS O 1 1 3 1288 1 1 12 LEU C C -5.116 4.436 -2.367 1.00 . A A . 33 LEU C 1 1 3 1289 1 1 12 LEU CA C -6.067 3.940 -3.471 1.00 . A A . 33 LEU CA 1 1 3 1290 1 1 12 LEU CB C -6.773 5.162 -4.111 1.00 . A A . 33 LEU CB 1 1 3 1291 1 1 12 LEU CD1 C -8.294 6.198 -5.807 1.00 . A A . 33 LEU CD1 1 1 3 1292 1 1 12 LEU CD2 C -6.763 4.397 -6.540 1.00 . A A . 33 LEU CD2 1 1 3 1293 1 1 12 LEU CG C -7.616 4.899 -5.372 1.00 . A A . 33 LEU CG 1 1 3 1294 1 1 12 LEU H H -7.224 3.215 -1.876 1.00 . A A . 33 LEU H 1 1 3 1295 1 1 12 LEU HA H -5.482 3.396 -4.213 1.00 . A A . 33 LEU HA 1 1 3 1296 1 1 12 LEU HB2 H -7.417 5.618 -3.357 1.00 . A A . 33 LEU HB2 1 1 3 1297 1 1 12 LEU HB3 H -6.017 5.906 -4.376 1.00 . A A . 33 LEU HB3 1 1 3 1298 1 1 12 LEU HD11 H -8.934 6.565 -5.005 1.00 . A A . 33 LEU HD11 1 1 3 1299 1 1 12 LEU HD12 H -7.547 6.955 -6.045 1.00 . A A . 33 LEU HD12 1 1 3 1300 1 1 12 LEU HD13 H -8.913 6.014 -6.686 1.00 . A A . 33 LEU HD13 1 1 3 1301 1 1 12 LEU HD21 H -5.969 5.111 -6.761 1.00 . A A . 33 LEU HD21 1 1 3 1302 1 1 12 LEU HD22 H -6.322 3.432 -6.297 1.00 . A A . 33 LEU HD22 1 1 3 1303 1 1 12 LEU HD23 H -7.389 4.273 -7.424 1.00 . A A . 33 LEU HD23 1 1 3 1304 1 1 12 LEU HG H -8.396 4.173 -5.153 1.00 . A A . 33 LEU HG 1 1 3 1305 1 1 12 LEU N N -7.070 3.064 -2.862 1.00 . A A . 33 LEU N 1 1 3 1306 1 1 12 LEU O O -5.428 4.326 -1.177 1.00 . A A . 33 LEU O 1 1 3 1307 1 1 13 SER C C -3.697 6.971 -1.056 1.00 . A A . 34 SER C 1 1 3 1308 1 1 13 SER CA C -3.084 5.833 -1.898 1.00 . A A . 34 SER CA 1 1 3 1309 1 1 13 SER CB C -1.956 6.396 -2.773 1.00 . A A . 34 SER CB 1 1 3 1310 1 1 13 SER H H -3.819 5.100 -3.753 1.00 . A A . 34 SER H 1 1 3 1311 1 1 13 SER HA H -2.645 5.131 -1.191 1.00 . A A . 34 SER HA 1 1 3 1312 1 1 13 SER HB2 H -2.380 7.057 -3.531 1.00 . A A . 34 SER HB2 1 1 3 1313 1 1 13 SER HB3 H -1.257 6.967 -2.162 1.00 . A A . 34 SER HB3 1 1 3 1314 1 1 13 SER HG H -0.598 5.702 -4.006 1.00 . A A . 34 SER HG 1 1 3 1315 1 1 13 SER N N -4.025 5.094 -2.763 1.00 . A A . 34 SER N 1 1 3 1316 1 1 13 SER O O -2.977 7.603 -0.280 1.00 . A A . 34 SER O 1 1 3 1317 1 1 13 SER OG O -1.266 5.327 -3.402 1.00 . A A . 34 SER OG 1 1 3 1318 1 1 14 SER C C -7.069 7.654 0.196 1.00 . A A . 35 SER C 1 1 3 1319 1 1 14 SER CA C -5.791 8.224 -0.455 1.00 . A A . 35 SER CA 1 1 3 1320 1 1 14 SER CB C -6.169 9.367 -1.405 1.00 . A A . 35 SER CB 1 1 3 1321 1 1 14 SER H H -5.479 6.745 -1.938 1.00 . A A . 35 SER H 1 1 3 1322 1 1 14 SER HA H -5.185 8.642 0.349 1.00 . A A . 35 SER HA 1 1 3 1323 1 1 14 SER HB2 H -6.775 10.102 -0.872 1.00 . A A . 35 SER HB2 1 1 3 1324 1 1 14 SER HB3 H -5.259 9.854 -1.758 1.00 . A A . 35 SER HB3 1 1 3 1325 1 1 14 SER HG H -7.121 9.605 -3.104 1.00 . A A . 35 SER HG 1 1 3 1326 1 1 14 SER N N -5.000 7.230 -1.197 1.00 . A A . 35 SER N 1 1 3 1327 1 1 14 SER O O -7.658 8.315 1.055 1.00 . A A . 35 SER O 1 1 3 1328 1 1 14 SER OG O -6.894 8.857 -2.517 1.00 . A A . 35 SER OG 1 1 3 1329 1 1 15 GLN C C -8.163 5.193 1.896 1.00 . A A . 36 GLN C 1 1 3 1330 1 1 15 GLN CA C -8.601 5.721 0.512 1.00 . A A . 36 GLN CA 1 1 3 1331 1 1 15 GLN CB C -9.078 4.568 -0.389 1.00 . A A . 36 GLN CB 1 1 3 1332 1 1 15 GLN CD C -11.606 4.840 -0.564 1.00 . A A . 36 GLN CD 1 1 3 1333 1 1 15 GLN CG C -10.459 4.002 -0.004 1.00 . A A . 36 GLN CG 1 1 3 1334 1 1 15 GLN H H -6.948 5.919 -0.834 1.00 . A A . 36 GLN H 1 1 3 1335 1 1 15 GLN HA H -9.426 6.419 0.657 1.00 . A A . 36 GLN HA 1 1 3 1336 1 1 15 GLN HB2 H -9.126 4.909 -1.425 1.00 . A A . 36 GLN HB2 1 1 3 1337 1 1 15 GLN HB3 H -8.342 3.766 -0.338 1.00 . A A . 36 GLN HB3 1 1 3 1338 1 1 15 GLN HE21 H -11.880 3.610 -2.164 1.00 . A A . 36 GLN HE21 1 1 3 1339 1 1 15 GLN HE22 H -12.937 5.013 -2.052 1.00 . A A . 36 GLN HE22 1 1 3 1340 1 1 15 GLN HG2 H -10.554 2.992 -0.398 1.00 . A A . 36 GLN HG2 1 1 3 1341 1 1 15 GLN HG3 H -10.554 3.931 1.080 1.00 . A A . 36 GLN HG3 1 1 3 1342 1 1 15 GLN N N -7.494 6.430 -0.158 1.00 . A A . 36 GLN N 1 1 3 1343 1 1 15 GLN NE2 N -12.182 4.456 -1.688 1.00 . A A . 36 GLN NE2 1 1 3 1344 1 1 15 GLN O O -8.930 5.249 2.860 1.00 . A A . 36 GLN O 1 1 3 1345 1 1 15 GLN OE1 O -12.003 5.855 -0.009 1.00 . A A . 36 GLN OE1 1 1 3 1346 1 1 16 CYS C C -4.705 5.029 3.074 1.00 . A A . 37 CYS C 1 1 3 1347 1 1 16 CYS CA C -6.136 4.462 3.197 1.00 . A A . 37 CYS CA 1 1 3 1348 1 1 16 CYS CB C -6.124 2.939 3.439 1.00 . A A . 37 CYS CB 1 1 3 1349 1 1 16 CYS H H -6.354 4.788 1.129 1.00 . A A . 37 CYS H 1 1 3 1350 1 1 16 CYS HA H -6.605 4.956 4.046 1.00 . A A . 37 CYS HA 1 1 3 1351 1 1 16 CYS HB2 H -6.128 2.406 2.488 1.00 . A A . 37 CYS HB2 1 1 3 1352 1 1 16 CYS HB3 H -5.201 2.655 3.941 1.00 . A A . 37 CYS HB3 1 1 3 1353 1 1 16 CYS N N -6.897 4.762 1.983 1.00 . A A . 37 CYS N 1 1 3 1354 1 1 16 CYS O O -4.345 5.617 2.050 1.00 . A A . 37 CYS O 1 1 3 1355 1 1 16 CYS SG S -7.519 2.441 4.489 1.00 . A A . 37 CYS SG 1 1 3 1356 1 1 17 ARG C C -1.670 4.703 2.919 1.00 . A A . 38 ARG C 1 1 3 1357 1 1 17 ARG CA C -2.456 5.236 4.126 1.00 . A A . 38 ARG CA 1 1 3 1358 1 1 17 ARG CB C -1.769 4.822 5.442 1.00 . A A . 38 ARG CB 1 1 3 1359 1 1 17 ARG CD C -3.199 5.134 7.604 1.00 . A A . 38 ARG CD 1 1 3 1360 1 1 17 ARG CG C -2.105 5.686 6.676 1.00 . A A . 38 ARG CG 1 1 3 1361 1 1 17 ARG CZ C -5.581 4.695 6.921 1.00 . A A . 38 ARG CZ 1 1 3 1362 1 1 17 ARG H H -4.243 4.350 4.919 1.00 . A A . 38 ARG H 1 1 3 1363 1 1 17 ARG HA H -2.407 6.325 4.043 1.00 . A A . 38 ARG HA 1 1 3 1364 1 1 17 ARG HB2 H -1.959 3.768 5.652 1.00 . A A . 38 ARG HB2 1 1 3 1365 1 1 17 ARG HB3 H -0.696 4.928 5.284 1.00 . A A . 38 ARG HB3 1 1 3 1366 1 1 17 ARG HD2 H -3.079 4.058 7.701 1.00 . A A . 38 ARG HD2 1 1 3 1367 1 1 17 ARG HD3 H -3.037 5.563 8.596 1.00 . A A . 38 ARG HD3 1 1 3 1368 1 1 17 ARG HE H -4.766 6.490 7.130 1.00 . A A . 38 ARG HE 1 1 3 1369 1 1 17 ARG HG2 H -1.195 5.740 7.275 1.00 . A A . 38 ARG HG2 1 1 3 1370 1 1 17 ARG HG3 H -2.346 6.705 6.372 1.00 . A A . 38 ARG HG3 1 1 3 1371 1 1 17 ARG HH11 H -4.625 2.960 7.275 1.00 . A A . 38 ARG HH11 1 1 3 1372 1 1 17 ARG HH12 H -6.258 2.837 6.649 1.00 . A A . 38 ARG HH12 1 1 3 1373 1 1 17 ARG HH21 H -6.894 6.175 6.576 1.00 . A A . 38 ARG HH21 1 1 3 1374 1 1 17 ARG HH22 H -7.479 4.557 6.308 1.00 . A A . 38 ARG HH22 1 1 3 1375 1 1 17 ARG N N -3.874 4.832 4.111 1.00 . A A . 38 ARG N 1 1 3 1376 1 1 17 ARG NE N -4.567 5.503 7.180 1.00 . A A . 38 ARG NE 1 1 3 1377 1 1 17 ARG NH1 N -5.473 3.400 6.939 1.00 . A A . 38 ARG NH1 1 1 3 1378 1 1 17 ARG NH2 N -6.738 5.182 6.587 1.00 . A A . 38 ARG NH2 1 1 3 1379 1 1 17 ARG O O -0.821 5.428 2.401 1.00 . A A . 38 ARG O 1 1 3 1380 1 1 18 ALA C C -2.399 1.781 0.664 1.00 . A A . 39 ALA C 1 1 3 1381 1 1 18 ALA CA C -1.489 2.926 1.178 1.00 . A A . 39 ALA CA 1 1 3 1382 1 1 18 ALA CB C -0.072 2.381 1.421 1.00 . A A . 39 ALA CB 1 1 3 1383 1 1 18 ALA H H -2.677 2.962 2.936 1.00 . A A . 39 ALA H 1 1 3 1384 1 1 18 ALA HA H -1.447 3.714 0.425 1.00 . A A . 39 ALA HA 1 1 3 1385 1 1 18 ALA HB1 H 0.587 3.176 1.774 1.00 . A A . 39 ALA HB1 1 1 3 1386 1 1 18 ALA HB2 H -0.114 1.586 2.164 1.00 . A A . 39 ALA HB2 1 1 3 1387 1 1 18 ALA HB3 H 0.336 1.973 0.497 1.00 . A A . 39 ALA HB3 1 1 3 1388 1 1 18 ALA N N -1.981 3.497 2.438 1.00 . A A . 39 ALA N 1 1 3 1389 1 1 18 ALA O O -3.124 1.173 1.458 1.00 . A A . 39 ALA O 1 1 3 1390 1 1 19 PRO C C -1.822 -1.007 -0.692 1.00 . A A . 40 PRO C 1 1 3 1391 1 1 19 PRO CA C -2.794 0.114 -1.118 1.00 . A A . 40 PRO CA 1 1 3 1392 1 1 19 PRO CB C -2.863 0.275 -2.640 1.00 . A A . 40 PRO CB 1 1 3 1393 1 1 19 PRO CD C -1.717 2.170 -1.720 1.00 . A A . 40 PRO CD 1 1 3 1394 1 1 19 PRO CG C -1.722 1.246 -2.937 1.00 . A A . 40 PRO CG 1 1 3 1395 1 1 19 PRO HA H -3.790 -0.115 -0.735 1.00 . A A . 40 PRO HA 1 1 3 1396 1 1 19 PRO HB2 H -2.739 -0.670 -3.171 1.00 . A A . 40 PRO HB2 1 1 3 1397 1 1 19 PRO HB3 H -3.814 0.736 -2.914 1.00 . A A . 40 PRO HB3 1 1 3 1398 1 1 19 PRO HD2 H -0.695 2.467 -1.483 1.00 . A A . 40 PRO HD2 1 1 3 1399 1 1 19 PRO HD3 H -2.320 3.049 -1.935 1.00 . A A . 40 PRO HD3 1 1 3 1400 1 1 19 PRO HG2 H -0.778 0.701 -2.987 1.00 . A A . 40 PRO HG2 1 1 3 1401 1 1 19 PRO HG3 H -1.891 1.800 -3.862 1.00 . A A . 40 PRO HG3 1 1 3 1402 1 1 19 PRO N N -2.336 1.419 -0.633 1.00 . A A . 40 PRO N 1 1 3 1403 1 1 19 PRO O O -0.740 -0.744 -0.163 1.00 . A A . 40 PRO O 1 1 3 1404 1 1 20 LYS C C 0.046 -3.530 -1.115 1.00 . A A . 41 LYS C 1 1 3 1405 1 1 20 LYS CA C -1.423 -3.503 -0.652 1.00 . A A . 41 LYS CA 1 1 3 1406 1 1 20 LYS CB C -2.228 -4.704 -1.190 1.00 . A A . 41 LYS CB 1 1 3 1407 1 1 20 LYS CD C -2.720 -7.185 -1.067 1.00 . A A . 41 LYS CD 1 1 3 1408 1 1 20 LYS CE C -2.223 -8.530 -0.524 1.00 . A A . 41 LYS CE 1 1 3 1409 1 1 20 LYS CG C -1.764 -6.064 -0.640 1.00 . A A . 41 LYS CG 1 1 3 1410 1 1 20 LYS H H -3.086 -2.393 -1.415 1.00 . A A . 41 LYS H 1 1 3 1411 1 1 20 LYS HA H -1.383 -3.583 0.433 1.00 . A A . 41 LYS HA 1 1 3 1412 1 1 20 LYS HB2 H -3.272 -4.577 -0.905 1.00 . A A . 41 LYS HB2 1 1 3 1413 1 1 20 LYS HB3 H -2.175 -4.718 -2.280 1.00 . A A . 41 LYS HB3 1 1 3 1414 1 1 20 LYS HD2 H -3.718 -6.978 -0.675 1.00 . A A . 41 LYS HD2 1 1 3 1415 1 1 20 LYS HD3 H -2.764 -7.225 -2.158 1.00 . A A . 41 LYS HD3 1 1 3 1416 1 1 20 LYS HE2 H -1.210 -8.710 -0.901 1.00 . A A . 41 LYS HE2 1 1 3 1417 1 1 20 LYS HE3 H -2.167 -8.471 0.568 1.00 . A A . 41 LYS HE3 1 1 3 1418 1 1 20 LYS HG2 H -0.767 -6.293 -1.018 1.00 . A A . 41 LYS HG2 1 1 3 1419 1 1 20 LYS HG3 H -1.731 -6.017 0.450 1.00 . A A . 41 LYS HG3 1 1 3 1420 1 1 20 LYS HZ1 H -3.170 -9.736 -1.930 1.00 . A A . 41 LYS HZ1 1 1 3 1421 1 1 20 LYS HZ2 H -2.776 -10.531 -0.564 1.00 . A A . 41 LYS HZ2 1 1 3 1422 1 1 20 LYS HZ3 H -4.054 -9.518 -0.570 1.00 . A A . 41 LYS HZ3 1 1 3 1423 1 1 20 LYS N N -2.174 -2.268 -0.981 1.00 . A A . 41 LYS N 1 1 3 1424 1 1 20 LYS NZ N -3.117 -9.650 -0.924 1.00 . A A . 41 LYS NZ 1 1 3 1425 1 1 20 LYS O O 0.837 -4.319 -0.603 1.00 . A A . 41 LYS O 1 1 3 1426 1 1 21 VAL C C 2.723 -1.989 -1.211 1.00 . A A . 42 VAL C 1 1 3 1427 1 1 21 VAL CA C 1.826 -2.345 -2.412 1.00 . A A . 42 VAL CA 1 1 3 1428 1 1 21 VAL CB C 1.848 -1.192 -3.442 1.00 . A A . 42 VAL CB 1 1 3 1429 1 1 21 VAL CG1 C 3.256 -0.877 -3.953 1.00 . A A . 42 VAL CG1 1 1 3 1430 1 1 21 VAL CG2 C 0.988 -1.519 -4.672 1.00 . A A . 42 VAL CG2 1 1 3 1431 1 1 21 VAL H H -0.288 -2.038 -2.397 1.00 . A A . 42 VAL H 1 1 3 1432 1 1 21 VAL HA H 2.248 -3.234 -2.883 1.00 . A A . 42 VAL HA 1 1 3 1433 1 1 21 VAL HB H 1.447 -0.294 -2.973 1.00 . A A . 42 VAL HB 1 1 3 1434 1 1 21 VAL HG11 H 3.699 -1.775 -4.383 1.00 . A A . 42 VAL HG11 1 1 3 1435 1 1 21 VAL HG12 H 3.212 -0.099 -4.717 1.00 . A A . 42 VAL HG12 1 1 3 1436 1 1 21 VAL HG13 H 3.884 -0.515 -3.142 1.00 . A A . 42 VAL HG13 1 1 3 1437 1 1 21 VAL HG21 H 1.344 -2.437 -5.144 1.00 . A A . 42 VAL HG21 1 1 3 1438 1 1 21 VAL HG22 H -0.056 -1.642 -4.391 1.00 . A A . 42 VAL HG22 1 1 3 1439 1 1 21 VAL HG23 H 1.044 -0.702 -5.391 1.00 . A A . 42 VAL HG23 1 1 3 1440 1 1 21 VAL N N 0.433 -2.634 -2.023 1.00 . A A . 42 VAL N 1 1 3 1441 1 1 21 VAL O O 3.896 -2.357 -1.201 1.00 . A A . 42 VAL O 1 1 3 1442 1 1 22 CYS C C 2.080 -0.666 2.210 1.00 . A A . 43 CYS C 1 1 3 1443 1 1 22 CYS CA C 2.939 -0.723 0.922 1.00 . A A . 43 CYS CA 1 1 3 1444 1 1 22 CYS CB C 3.444 0.656 0.441 1.00 . A A . 43 CYS CB 1 1 3 1445 1 1 22 CYS H H 1.193 -1.092 -0.234 1.00 . A A . 43 CYS H 1 1 3 1446 1 1 22 CYS HA H 3.808 -1.348 1.134 1.00 . A A . 43 CYS HA 1 1 3 1447 1 1 22 CYS HB2 H 3.874 0.540 -0.556 1.00 . A A . 43 CYS HB2 1 1 3 1448 1 1 22 CYS HB3 H 2.605 1.350 0.371 1.00 . A A . 43 CYS HB3 1 1 3 1449 1 1 22 CYS N N 2.186 -1.300 -0.197 1.00 . A A . 43 CYS N 1 1 3 1450 1 1 22 CYS O O 1.178 -1.480 2.416 1.00 . A A . 43 CYS O 1 1 3 1451 1 1 22 CYS SG S 4.725 1.324 1.540 1.00 . A A . 43 CYS SG 1 1 3 1452 1 1 23 PHE C C 1.687 2.196 4.549 1.00 . A A . 44 PHE C 1 1 3 1453 1 1 23 PHE CA C 1.634 0.675 4.281 1.00 . A A . 44 PHE CA 1 1 3 1454 1 1 23 PHE CB C 2.152 -0.101 5.504 1.00 . A A . 44 PHE CB 1 1 3 1455 1 1 23 PHE CD1 C 4.693 0.012 5.416 1.00 . A A . 44 PHE CD1 1 1 3 1456 1 1 23 PHE CD2 C 3.525 1.225 7.173 1.00 . A A . 44 PHE CD2 1 1 3 1457 1 1 23 PHE CE1 C 5.922 0.487 5.909 1.00 . A A . 44 PHE CE1 1 1 3 1458 1 1 23 PHE CE2 C 4.755 1.698 7.667 1.00 . A A . 44 PHE CE2 1 1 3 1459 1 1 23 PHE CG C 3.488 0.382 6.046 1.00 . A A . 44 PHE CG 1 1 3 1460 1 1 23 PHE CZ C 5.954 1.330 7.033 1.00 . A A . 44 PHE CZ 1 1 3 1461 1 1 23 PHE H H 3.217 0.812 2.852 1.00 . A A . 44 PHE H 1 1 3 1462 1 1 23 PHE HA H 0.587 0.410 4.129 1.00 . A A . 44 PHE HA 1 1 3 1463 1 1 23 PHE HB2 H 1.408 -0.016 6.299 1.00 . A A . 44 PHE HB2 1 1 3 1464 1 1 23 PHE HB3 H 2.228 -1.161 5.255 1.00 . A A . 44 PHE HB3 1 1 3 1465 1 1 23 PHE HD1 H 4.679 -0.639 4.551 1.00 . A A . 44 PHE HD1 1 1 3 1466 1 1 23 PHE HD2 H 2.606 1.518 7.662 1.00 . A A . 44 PHE HD2 1 1 3 1467 1 1 23 PHE HE1 H 6.847 0.198 5.426 1.00 . A A . 44 PHE HE1 1 1 3 1468 1 1 23 PHE HE2 H 4.776 2.343 8.537 1.00 . A A . 44 PHE HE2 1 1 3 1469 1 1 23 PHE HZ H 6.903 1.687 7.414 1.00 . A A . 44 PHE HZ 1 1 3 1470 1 1 23 PHE N N 2.395 0.277 3.094 1.00 . A A . 44 PHE N 1 1 3 1471 1 1 23 PHE O O 0.846 2.708 5.290 1.00 . A A . 44 PHE O 1 1 3 1472 1 1 24 LYS C C 3.653 5.048 3.061 1.00 . A A . 45 LYS C 1 1 3 1473 1 1 24 LYS CA C 2.915 4.352 4.215 1.00 . A A . 45 LYS CA 1 1 3 1474 1 1 24 LYS CB C 3.726 4.456 5.526 1.00 . A A . 45 LYS CB 1 1 3 1475 1 1 24 LYS CD C 4.942 5.958 7.201 1.00 . A A . 45 LYS CD 1 1 3 1476 1 1 24 LYS CE C 6.341 5.364 6.973 1.00 . A A . 45 LYS CE 1 1 3 1477 1 1 24 LYS CG C 4.078 5.899 5.932 1.00 . A A . 45 LYS CG 1 1 3 1478 1 1 24 LYS H H 3.298 2.433 3.349 1.00 . A A . 45 LYS H 1 1 3 1479 1 1 24 LYS HA H 1.965 4.875 4.348 1.00 . A A . 45 LYS HA 1 1 3 1480 1 1 24 LYS HB2 H 3.144 4.012 6.334 1.00 . A A . 45 LYS HB2 1 1 3 1481 1 1 24 LYS HB3 H 4.642 3.873 5.416 1.00 . A A . 45 LYS HB3 1 1 3 1482 1 1 24 LYS HD2 H 5.043 7.003 7.495 1.00 . A A . 45 LYS HD2 1 1 3 1483 1 1 24 LYS HD3 H 4.440 5.420 8.007 1.00 . A A . 45 LYS HD3 1 1 3 1484 1 1 24 LYS HE2 H 6.244 4.304 6.723 1.00 . A A . 45 LYS HE2 1 1 3 1485 1 1 24 LYS HE3 H 6.800 5.868 6.115 1.00 . A A . 45 LYS HE3 1 1 3 1486 1 1 24 LYS HG2 H 4.618 6.396 5.128 1.00 . A A . 45 LYS HG2 1 1 3 1487 1 1 24 LYS HG3 H 3.152 6.445 6.112 1.00 . A A . 45 LYS HG3 1 1 3 1488 1 1 24 LYS HZ1 H 6.813 5.059 8.976 1.00 . A A . 45 LYS HZ1 1 1 3 1489 1 1 24 LYS HZ2 H 8.126 5.130 8.009 1.00 . A A . 45 LYS HZ2 1 1 3 1490 1 1 24 LYS HZ3 H 7.334 6.498 8.405 1.00 . A A . 45 LYS HZ3 1 1 3 1491 1 1 24 LYS N N 2.658 2.920 3.960 1.00 . A A . 45 LYS N 1 1 3 1492 1 1 24 LYS NZ N 7.208 5.523 8.170 1.00 . A A . 45 LYS NZ 1 1 3 1493 1 1 24 LYS O O 3.116 5.980 2.464 1.00 . A A . 45 LYS O 1 1 3 1494 1 1 25 CYS C C 5.488 5.183 0.373 1.00 . A A . 46 CYS C 1 1 3 1495 1 1 25 CYS CA C 5.832 5.284 1.875 1.00 . A A . 46 CYS CA 1 1 3 1496 1 1 25 CYS CB C 7.260 4.795 2.200 1.00 . A A . 46 CYS CB 1 1 3 1497 1 1 25 CYS H H 5.258 3.843 3.302 1.00 . A A . 46 CYS H 1 1 3 1498 1 1 25 CYS HA H 5.807 6.349 2.113 1.00 . A A . 46 CYS HA 1 1 3 1499 1 1 25 CYS HB2 H 7.880 4.858 1.301 1.00 . A A . 46 CYS HB2 1 1 3 1500 1 1 25 CYS HB3 H 7.690 5.479 2.935 1.00 . A A . 46 CYS HB3 1 1 3 1501 1 1 25 CYS N N 4.881 4.612 2.766 1.00 . A A . 46 CYS N 1 1 3 1502 1 1 25 CYS O O 5.747 6.135 -0.366 1.00 . A A . 46 CYS O 1 1 3 1503 1 1 25 CYS SG S 7.328 3.112 2.884 1.00 . A A . 46 CYS SG 1 1 3 1504 1 1 26 LYS C C 4.835 4.373 -2.647 1.00 . A A . 47 LYS C 1 1 3 1505 1 1 26 LYS CA C 4.159 3.855 -1.355 1.00 . A A . 47 LYS CA 1 1 3 1506 1 1 26 LYS CB C 2.671 4.242 -1.195 1.00 . A A . 47 LYS CB 1 1 3 1507 1 1 26 LYS CD C 1.037 5.984 -0.342 1.00 . A A . 47 LYS CD 1 1 3 1508 1 1 26 LYS CE C 0.873 7.470 0.005 1.00 . A A . 47 LYS CE 1 1 3 1509 1 1 26 LYS CG C 2.396 5.748 -1.011 1.00 . A A . 47 LYS CG 1 1 3 1510 1 1 26 LYS H H 4.736 3.356 0.639 1.00 . A A . 47 LYS H 1 1 3 1511 1 1 26 LYS HA H 4.152 2.775 -1.500 1.00 . A A . 47 LYS HA 1 1 3 1512 1 1 26 LYS HB2 H 2.105 3.886 -2.057 1.00 . A A . 47 LYS HB2 1 1 3 1513 1 1 26 LYS HB3 H 2.291 3.709 -0.323 1.00 . A A . 47 LYS HB3 1 1 3 1514 1 1 26 LYS HD2 H 0.234 5.650 -0.999 1.00 . A A . 47 LYS HD2 1 1 3 1515 1 1 26 LYS HD3 H 1.002 5.405 0.581 1.00 . A A . 47 LYS HD3 1 1 3 1516 1 1 26 LYS HE2 H 1.758 7.780 0.570 1.00 . A A . 47 LYS HE2 1 1 3 1517 1 1 26 LYS HE3 H 0.838 8.059 -0.916 1.00 . A A . 47 LYS HE3 1 1 3 1518 1 1 26 LYS HG2 H 3.153 6.191 -0.372 1.00 . A A . 47 LYS HG2 1 1 3 1519 1 1 26 LYS HG3 H 2.425 6.249 -1.981 1.00 . A A . 47 LYS HG3 1 1 3 1520 1 1 26 LYS HZ1 H -0.386 7.047 1.597 1.00 . A A . 47 LYS HZ1 1 1 3 1521 1 1 26 LYS HZ2 H -0.337 8.647 1.217 1.00 . A A . 47 LYS HZ2 1 1 3 1522 1 1 26 LYS HZ3 H -1.198 7.611 0.297 1.00 . A A . 47 LYS HZ3 1 1 3 1523 1 1 26 LYS N N 4.851 4.082 -0.059 1.00 . A A . 47 LYS N 1 1 3 1524 1 1 26 LYS NZ N -0.340 7.715 0.830 1.00 . A A . 47 LYS NZ 1 1 3 1525 1 1 26 LYS O O 4.154 4.654 -3.633 1.00 . A A . 47 LYS O 1 1 3 1526 1 1 27 GLN C C 6.935 3.794 -4.968 1.00 . A A . 48 GLN C 1 1 3 1527 1 1 27 GLN CA C 6.951 4.875 -3.856 1.00 . A A . 48 GLN CA 1 1 3 1528 1 1 27 GLN CB C 8.402 5.205 -3.445 1.00 . A A . 48 GLN CB 1 1 3 1529 1 1 27 GLN CD C 7.877 7.635 -2.856 1.00 . A A . 48 GLN CD 1 1 3 1530 1 1 27 GLN CG C 8.537 6.331 -2.408 1.00 . A A . 48 GLN CG 1 1 3 1531 1 1 27 GLN H H 6.665 4.250 -1.823 1.00 . A A . 48 GLN H 1 1 3 1532 1 1 27 GLN HA H 6.489 5.780 -4.248 1.00 . A A . 48 GLN HA 1 1 3 1533 1 1 27 GLN HB2 H 8.869 4.309 -3.040 1.00 . A A . 48 GLN HB2 1 1 3 1534 1 1 27 GLN HB3 H 8.964 5.495 -4.333 1.00 . A A . 48 GLN HB3 1 1 3 1535 1 1 27 GLN HE21 H 6.357 7.435 -1.536 1.00 . A A . 48 GLN HE21 1 1 3 1536 1 1 27 GLN HE22 H 6.329 8.876 -2.560 1.00 . A A . 48 GLN HE22 1 1 3 1537 1 1 27 GLN HG2 H 8.116 6.006 -1.458 1.00 . A A . 48 GLN HG2 1 1 3 1538 1 1 27 GLN HG3 H 9.597 6.523 -2.238 1.00 . A A . 48 GLN HG3 1 1 3 1539 1 1 27 GLN N N 6.169 4.473 -2.672 1.00 . A A . 48 GLN N 1 1 3 1540 1 1 27 GLN NE2 N 6.765 8.016 -2.267 1.00 . A A . 48 GLN NE2 1 1 3 1541 1 1 27 GLN O O 6.823 2.608 -4.637 1.00 . A A . 48 GLN O 1 1 3 1542 1 1 27 GLN OE1 O 8.343 8.325 -3.756 1.00 . A A . 48 GLN OE1 1 1 3 1543 1 1 28 PRO C C 7.571 1.902 -7.495 1.00 . A A . 49 PRO C 1 1 3 1544 1 1 28 PRO CA C 6.876 3.278 -7.429 1.00 . A A . 49 PRO CA 1 1 3 1545 1 1 28 PRO CB C 7.280 4.112 -8.650 1.00 . A A . 49 PRO CB 1 1 3 1546 1 1 28 PRO CD C 7.331 5.522 -6.732 1.00 . A A . 49 PRO CD 1 1 3 1547 1 1 28 PRO CG C 6.977 5.539 -8.216 1.00 . A A . 49 PRO CG 1 1 3 1548 1 1 28 PRO HA H 5.802 3.097 -7.487 1.00 . A A . 49 PRO HA 1 1 3 1549 1 1 28 PRO HB2 H 8.352 4.010 -8.837 1.00 . A A . 49 PRO HB2 1 1 3 1550 1 1 28 PRO HB3 H 6.711 3.832 -9.538 1.00 . A A . 49 PRO HB3 1 1 3 1551 1 1 28 PRO HD2 H 8.385 5.774 -6.608 1.00 . A A . 49 PRO HD2 1 1 3 1552 1 1 28 PRO HD3 H 6.709 6.254 -6.217 1.00 . A A . 49 PRO HD3 1 1 3 1553 1 1 28 PRO HG2 H 7.575 6.267 -8.766 1.00 . A A . 49 PRO HG2 1 1 3 1554 1 1 28 PRO HG3 H 5.912 5.741 -8.338 1.00 . A A . 49 PRO HG3 1 1 3 1555 1 1 28 PRO N N 7.099 4.156 -6.264 1.00 . A A . 49 PRO N 1 1 3 1556 1 1 28 PRO O O 7.113 1.045 -8.254 1.00 . A A . 49 PRO O 1 1 3 1557 1 1 29 GLY C C 10.158 0.012 -5.488 1.00 . A A . 50 GLY C 1 1 3 1558 1 1 29 GLY CA C 9.404 0.391 -6.772 1.00 . A A . 50 GLY CA 1 1 3 1559 1 1 29 GLY H H 9.030 2.439 -6.217 1.00 . A A . 50 GLY H 1 1 3 1560 1 1 29 GLY HA2 H 10.131 0.434 -7.584 1.00 . A A . 50 GLY HA2 1 1 3 1561 1 1 29 GLY HA3 H 8.714 -0.427 -6.986 1.00 . A A . 50 GLY HA3 1 1 3 1562 1 1 29 GLY N N 8.658 1.667 -6.746 1.00 . A A . 50 GLY N 1 1 3 1563 1 1 29 GLY O O 10.816 -1.028 -5.447 1.00 . A A . 50 GLY O 1 1 3 1564 1 1 30 HIS C C 10.352 -0.656 -2.395 1.00 . A A . 51 HIS C 1 1 3 1565 1 1 30 HIS CA C 10.778 0.620 -3.156 1.00 . A A . 51 HIS CA 1 1 3 1566 1 1 30 HIS CB C 10.546 1.852 -2.264 1.00 . A A . 51 HIS CB 1 1 3 1567 1 1 30 HIS CD2 C 9.040 1.619 -0.212 1.00 . A A . 51 HIS CD2 1 1 3 1568 1 1 30 HIS CE1 C 7.059 1.569 -1.153 1.00 . A A . 51 HIS CE1 1 1 3 1569 1 1 30 HIS CG C 9.211 1.838 -1.550 1.00 . A A . 51 HIS CG 1 1 3 1570 1 1 30 HIS H H 9.526 1.670 -4.529 1.00 . A A . 51 HIS H 1 1 3 1571 1 1 30 HIS HA H 11.846 0.541 -3.363 1.00 . A A . 51 HIS HA 1 1 3 1572 1 1 30 HIS HB2 H 11.332 1.875 -1.508 1.00 . A A . 51 HIS HB2 1 1 3 1573 1 1 30 HIS HB3 H 10.642 2.765 -2.853 1.00 . A A . 51 HIS HB3 1 1 3 1574 1 1 30 HIS HD1 H 7.711 1.956 -3.101 1.00 . A A . 51 HIS HD1 1 1 3 1575 1 1 30 HIS HD2 H 9.836 1.512 0.514 1.00 . A A . 51 HIS HD2 1 1 3 1576 1 1 30 HIS HE1 H 5.993 1.465 -1.306 1.00 . A A . 51 HIS HE1 1 1 3 1577 1 1 30 HIS N N 10.071 0.829 -4.432 1.00 . A A . 51 HIS N 1 1 3 1578 1 1 30 HIS ND1 N 7.953 1.815 -2.121 1.00 . A A . 51 HIS ND1 1 1 3 1579 1 1 30 HIS NE2 N 7.673 1.451 0.034 1.00 . A A . 51 HIS NE2 1 1 3 1580 1 1 30 HIS O O 11.115 -1.209 -1.601 1.00 . A A . 51 HIS O 1 1 3 1581 1 1 31 PHE C C 9.128 -3.472 -1.794 1.00 . A A . 52 PHE C 1 1 3 1582 1 1 31 PHE CA C 8.444 -2.100 -1.756 1.00 . A A . 52 PHE CA 1 1 3 1583 1 1 31 PHE CB C 6.960 -2.179 -2.143 1.00 . A A . 52 PHE CB 1 1 3 1584 1 1 31 PHE CD1 C 6.566 -3.624 -4.194 1.00 . A A . 52 PHE CD1 1 1 3 1585 1 1 31 PHE CD2 C 6.490 -1.204 -4.439 1.00 . A A . 52 PHE CD2 1 1 3 1586 1 1 31 PHE CE1 C 6.300 -3.770 -5.568 1.00 . A A . 52 PHE CE1 1 1 3 1587 1 1 31 PHE CE2 C 6.217 -1.351 -5.809 1.00 . A A . 52 PHE CE2 1 1 3 1588 1 1 31 PHE CG C 6.670 -2.341 -3.625 1.00 . A A . 52 PHE CG 1 1 3 1589 1 1 31 PHE CZ C 6.126 -2.634 -6.376 1.00 . A A . 52 PHE CZ 1 1 3 1590 1 1 31 PHE H H 8.548 -0.623 -3.281 1.00 . A A . 52 PHE H 1 1 3 1591 1 1 31 PHE HA H 8.493 -1.754 -0.722 1.00 . A A . 52 PHE HA 1 1 3 1592 1 1 31 PHE HB2 H 6.508 -3.006 -1.601 1.00 . A A . 52 PHE HB2 1 1 3 1593 1 1 31 PHE HB3 H 6.469 -1.268 -1.796 1.00 . A A . 52 PHE HB3 1 1 3 1594 1 1 31 PHE HD1 H 6.699 -4.505 -3.581 1.00 . A A . 52 PHE HD1 1 1 3 1595 1 1 31 PHE HD2 H 6.536 -0.211 -4.011 1.00 . A A . 52 PHE HD2 1 1 3 1596 1 1 31 PHE HE1 H 6.232 -4.759 -6.001 1.00 . A A . 52 PHE HE1 1 1 3 1597 1 1 31 PHE HE2 H 6.060 -0.477 -6.426 1.00 . A A . 52 PHE HE2 1 1 3 1598 1 1 31 PHE HZ H 5.917 -2.745 -7.432 1.00 . A A . 52 PHE HZ 1 1 3 1599 1 1 31 PHE N N 9.111 -1.105 -2.598 1.00 . A A . 52 PHE N 1 1 3 1600 1 1 31 PHE O O 9.319 -4.080 -0.741 1.00 . A A . 52 PHE O 1 1 3 1601 1 1 32 SER C C 11.662 -5.295 -2.450 1.00 . A A . 53 SER C 1 1 3 1602 1 1 32 SER CA C 10.308 -5.185 -3.177 1.00 . A A . 53 SER CA 1 1 3 1603 1 1 32 SER CB C 10.531 -5.416 -4.677 1.00 . A A . 53 SER CB 1 1 3 1604 1 1 32 SER H H 9.374 -3.370 -3.792 1.00 . A A . 53 SER H 1 1 3 1605 1 1 32 SER HA H 9.681 -5.995 -2.803 1.00 . A A . 53 SER HA 1 1 3 1606 1 1 32 SER HB2 H 11.178 -4.631 -5.072 1.00 . A A . 53 SER HB2 1 1 3 1607 1 1 32 SER HB3 H 11.017 -6.382 -4.828 1.00 . A A . 53 SER HB3 1 1 3 1608 1 1 32 SER HG H 9.471 -5.586 -6.316 1.00 . A A . 53 SER HG 1 1 3 1609 1 1 32 SER N N 9.590 -3.914 -2.967 1.00 . A A . 53 SER N 1 1 3 1610 1 1 32 SER O O 12.280 -6.360 -2.471 1.00 . A A . 53 SER O 1 1 3 1611 1 1 32 SER OG O 9.294 -5.406 -5.372 1.00 . A A . 53 SER OG 1 1 3 1612 1 1 33 LYS C C 13.218 -3.476 0.358 1.00 . A A . 54 LYS C 1 1 3 1613 1 1 33 LYS CA C 13.376 -4.141 -1.023 1.00 . A A . 54 LYS CA 1 1 3 1614 1 1 33 LYS CB C 14.470 -3.486 -1.893 1.00 . A A . 54 LYS CB 1 1 3 1615 1 1 33 LYS CD C 15.331 -1.353 -3.030 1.00 . A A . 54 LYS CD 1 1 3 1616 1 1 33 LYS CE C 15.578 -1.983 -4.407 1.00 . A A . 54 LYS CE 1 1 3 1617 1 1 33 LYS CG C 14.169 -2.026 -2.285 1.00 . A A . 54 LYS CG 1 1 3 1618 1 1 33 LYS H H 11.576 -3.367 -1.872 1.00 . A A . 54 LYS H 1 1 3 1619 1 1 33 LYS HA H 13.712 -5.156 -0.807 1.00 . A A . 54 LYS HA 1 1 3 1620 1 1 33 LYS HB2 H 15.417 -3.519 -1.350 1.00 . A A . 54 LYS HB2 1 1 3 1621 1 1 33 LYS HB3 H 14.591 -4.083 -2.797 1.00 . A A . 54 LYS HB3 1 1 3 1622 1 1 33 LYS HD2 H 15.087 -0.297 -3.160 1.00 . A A . 54 LYS HD2 1 1 3 1623 1 1 33 LYS HD3 H 16.235 -1.425 -2.422 1.00 . A A . 54 LYS HD3 1 1 3 1624 1 1 33 LYS HE2 H 15.813 -3.044 -4.278 1.00 . A A . 54 LYS HE2 1 1 3 1625 1 1 33 LYS HE3 H 14.658 -1.913 -4.996 1.00 . A A . 54 LYS HE3 1 1 3 1626 1 1 33 LYS HG2 H 13.285 -1.997 -2.923 1.00 . A A . 54 LYS HG2 1 1 3 1627 1 1 33 LYS HG3 H 13.965 -1.448 -1.384 1.00 . A A . 54 LYS HG3 1 1 3 1628 1 1 33 LYS HZ1 H 16.495 -0.326 -5.268 1.00 . A A . 54 LYS HZ1 1 1 3 1629 1 1 33 LYS HZ2 H 17.558 -1.377 -4.609 1.00 . A A . 54 LYS HZ2 1 1 3 1630 1 1 33 LYS HZ3 H 16.844 -1.723 -6.033 1.00 . A A . 54 LYS HZ3 1 1 3 1631 1 1 33 LYS N N 12.123 -4.216 -1.795 1.00 . A A . 54 LYS N 1 1 3 1632 1 1 33 LYS NZ N 16.691 -1.307 -5.124 1.00 . A A . 54 LYS NZ 1 1 3 1633 1 1 33 LYS O O 14.226 -3.151 0.991 1.00 . A A . 54 LYS O 1 1 3 1634 1 1 34 GLN C C 10.412 -3.122 2.826 1.00 . A A . 55 GLN C 1 1 3 1635 1 1 34 GLN CA C 11.715 -2.649 2.146 1.00 . A A . 55 GLN CA 1 1 3 1636 1 1 34 GLN CB C 11.688 -1.118 1.972 1.00 . A A . 55 GLN CB 1 1 3 1637 1 1 34 GLN CD C 11.519 1.117 3.159 1.00 . A A . 55 GLN CD 1 1 3 1638 1 1 34 GLN CG C 11.741 -0.384 3.320 1.00 . A A . 55 GLN CG 1 1 3 1639 1 1 34 GLN H H 11.204 -3.601 0.286 1.00 . A A . 55 GLN H 1 1 3 1640 1 1 34 GLN HA H 12.534 -2.900 2.823 1.00 . A A . 55 GLN HA 1 1 3 1641 1 1 34 GLN HB2 H 12.549 -0.801 1.379 1.00 . A A . 55 GLN HB2 1 1 3 1642 1 1 34 GLN HB3 H 10.783 -0.831 1.433 1.00 . A A . 55 GLN HB3 1 1 3 1643 1 1 34 GLN HE21 H 9.528 0.916 3.388 1.00 . A A . 55 GLN HE21 1 1 3 1644 1 1 34 GLN HE22 H 10.112 2.558 3.162 1.00 . A A . 55 GLN HE22 1 1 3 1645 1 1 34 GLN HG2 H 10.970 -0.771 3.988 1.00 . A A . 55 GLN HG2 1 1 3 1646 1 1 34 GLN HG3 H 12.711 -0.555 3.788 1.00 . A A . 55 GLN HG3 1 1 3 1647 1 1 34 GLN N N 11.983 -3.268 0.836 1.00 . A A . 55 GLN N 1 1 3 1648 1 1 34 GLN NE2 N 10.290 1.569 3.252 1.00 . A A . 55 GLN NE2 1 1 3 1649 1 1 34 GLN O O 10.438 -3.439 4.020 1.00 . A A . 55 GLN O 1 1 3 1650 1 1 34 GLN OE1 O 12.440 1.900 2.951 1.00 . A A . 55 GLN OE1 1 1 3 1651 1 1 35 CYS C C 7.236 -4.616 2.340 1.00 . A A . 56 CYS C 1 1 3 1652 1 1 35 CYS CA C 7.940 -3.284 2.670 1.00 . A A . 56 CYS CA 1 1 3 1653 1 1 35 CYS CB C 7.104 -2.080 2.196 1.00 . A A . 56 CYS CB 1 1 3 1654 1 1 35 CYS H H 9.356 -2.905 1.125 1.00 . A A . 56 CYS H 1 1 3 1655 1 1 35 CYS HA H 8.004 -3.221 3.757 1.00 . A A . 56 CYS HA 1 1 3 1656 1 1 35 CYS HB2 H 7.009 -2.099 1.108 1.00 . A A . 56 CYS HB2 1 1 3 1657 1 1 35 CYS HB3 H 6.101 -2.158 2.623 1.00 . A A . 56 CYS HB3 1 1 3 1658 1 1 35 CYS N N 9.292 -3.172 2.095 1.00 . A A . 56 CYS N 1 1 3 1659 1 1 35 CYS O O 6.408 -5.086 3.126 1.00 . A A . 56 CYS O 1 1 3 1660 1 1 35 CYS SG S 7.863 -0.521 2.735 1.00 . A A . 56 CYS SG 1 1 3 1661 1 1 36 ARG C C 8.189 -7.553 0.438 1.00 . A A . 57 ARG C 1 1 3 1662 1 1 36 ARG CA C 7.065 -6.524 0.691 1.00 . A A . 57 ARG CA 1 1 3 1663 1 1 36 ARG CB C 6.272 -6.283 -0.614 1.00 . A A . 57 ARG CB 1 1 3 1664 1 1 36 ARG CD C 3.897 -5.896 0.349 1.00 . A A . 57 ARG CD 1 1 3 1665 1 1 36 ARG CG C 5.040 -5.364 -0.529 1.00 . A A . 57 ARG CG 1 1 3 1666 1 1 36 ARG CZ C 3.241 -4.520 2.352 1.00 . A A . 57 ARG CZ 1 1 3 1667 1 1 36 ARG H H 8.252 -4.749 0.620 1.00 . A A . 57 ARG H 1 1 3 1668 1 1 36 ARG HA H 6.406 -6.983 1.429 1.00 . A A . 57 ARG HA 1 1 3 1669 1 1 36 ARG HB2 H 6.955 -5.859 -1.352 1.00 . A A . 57 ARG HB2 1 1 3 1670 1 1 36 ARG HB3 H 5.937 -7.246 -1.005 1.00 . A A . 57 ARG HB3 1 1 3 1671 1 1 36 ARG HD2 H 2.954 -5.578 -0.091 1.00 . A A . 57 ARG HD2 1 1 3 1672 1 1 36 ARG HD3 H 3.908 -6.988 0.346 1.00 . A A . 57 ARG HD3 1 1 3 1673 1 1 36 ARG HE H 4.853 -5.640 2.232 1.00 . A A . 57 ARG HE 1 1 3 1674 1 1 36 ARG HG2 H 5.339 -4.379 -0.176 1.00 . A A . 57 ARG HG2 1 1 3 1675 1 1 36 ARG HG3 H 4.653 -5.247 -1.541 1.00 . A A . 57 ARG HG3 1 1 3 1676 1 1 36 ARG HH11 H 1.824 -4.393 0.944 1.00 . A A . 57 ARG HH11 1 1 3 1677 1 1 36 ARG HH12 H 1.644 -3.297 2.287 1.00 . A A . 57 ARG HH12 1 1 3 1678 1 1 36 ARG HH21 H 4.501 -4.358 3.888 1.00 . A A . 57 ARG HH21 1 1 3 1679 1 1 36 ARG HH22 H 3.019 -3.433 4.022 1.00 . A A . 57 ARG HH22 1 1 3 1680 1 1 36 ARG N N 7.582 -5.236 1.204 1.00 . A A . 57 ARG N 1 1 3 1681 1 1 36 ARG NE N 4.009 -5.396 1.732 1.00 . A A . 57 ARG NE 1 1 3 1682 1 1 36 ARG NH1 N 2.125 -4.078 1.858 1.00 . A A . 57 ARG NH1 1 1 3 1683 1 1 36 ARG NH2 N 3.613 -4.058 3.508 1.00 . A A . 57 ARG NH2 1 1 3 1684 1 1 36 ARG O O 7.903 -8.682 0.031 1.00 . A A . 57 ARG O 1 1 3 1685 1 1 37 SER C C 10.601 -9.269 1.473 1.00 . A A . 58 SER C 1 1 3 1686 1 1 37 SER CA C 10.663 -8.003 0.604 1.00 . A A . 58 SER CA 1 1 3 1687 1 1 37 SER CB C 11.897 -7.161 0.950 1.00 . A A . 58 SER CB 1 1 3 1688 1 1 37 SER H H 9.575 -6.233 1.033 1.00 . A A . 58 SER H 1 1 3 1689 1 1 37 SER HA H 10.784 -8.343 -0.424 1.00 . A A . 58 SER HA 1 1 3 1690 1 1 37 SER HB2 H 12.759 -7.815 1.105 1.00 . A A . 58 SER HB2 1 1 3 1691 1 1 37 SER HB3 H 12.117 -6.505 0.110 1.00 . A A . 58 SER HB3 1 1 3 1692 1 1 37 SER HG H 11.454 -6.953 2.849 1.00 . A A . 58 SER HG 1 1 3 1693 1 1 37 SER N N 9.449 -7.165 0.673 1.00 . A A . 58 SER N 1 1 3 1694 1 1 37 SER O O 10.999 -10.345 0.972 1.00 . A A . 58 SER O 1 1 3 1695 1 1 37 SER OXT O 10.179 -9.185 2.650 1.00 . A A . 58 SER OXT 1 1 3 1696 1 1 37 SER OG O 11.666 -6.361 2.100 1.00 . A A . 58 SER OG 1 1 3 1697 2 2 1 ZN ZN ZN -8.317 0.568 3.726 1.00 . B A . 1059 ZN ZN 1 1 3 1698 3 2 1 ZN ZN ZN 6.865 1.217 1.917 1.00 . C A . 1060 ZN ZN 1 1 4 1699 1 1 1 GLN C C -6.401 -1.435 -4.562 1.00 . A A . 22 GLN C 1 1 4 1700 1 1 1 GLN CA C -6.279 -1.032 -6.030 1.00 . A A . 22 GLN CA 1 1 4 1701 1 1 1 GLN CB C -4.856 -0.522 -6.371 1.00 . A A . 22 GLN CB 1 1 4 1702 1 1 1 GLN CD C -4.828 2.026 -6.800 1.00 . A A . 22 GLN CD 1 1 4 1703 1 1 1 GLN CG C -4.444 0.878 -5.866 1.00 . A A . 22 GLN CG 1 1 4 1704 1 1 1 GLN H1 H -7.309 0.743 -5.799 1.00 . A A . 22 GLN H1 1 1 4 1705 1 1 1 GLN H2 H -7.266 0.216 -7.353 1.00 . A A . 22 GLN H2 1 1 4 1706 1 1 1 GLN H3 H -8.264 -0.504 -6.256 1.00 . A A . 22 GLN H3 1 1 4 1707 1 1 1 GLN HA H -6.434 -1.939 -6.616 1.00 . A A . 22 GLN HA 1 1 4 1708 1 1 1 GLN HB2 H -4.147 -1.242 -5.957 1.00 . A A . 22 GLN HB2 1 1 4 1709 1 1 1 GLN HB3 H -4.721 -0.556 -7.454 1.00 . A A . 22 GLN HB3 1 1 4 1710 1 1 1 GLN HE21 H -3.375 3.248 -6.091 1.00 . A A . 22 GLN HE21 1 1 4 1711 1 1 1 GLN HE22 H -4.401 3.892 -7.366 1.00 . A A . 22 GLN HE22 1 1 4 1712 1 1 1 GLN HG2 H -4.859 1.072 -4.877 1.00 . A A . 22 GLN HG2 1 1 4 1713 1 1 1 GLN HG3 H -3.358 0.883 -5.769 1.00 . A A . 22 GLN HG3 1 1 4 1714 1 1 1 GLN N N -7.357 -0.077 -6.390 1.00 . A A . 22 GLN N 1 1 4 1715 1 1 1 GLN NE2 N -4.148 3.149 -6.732 1.00 . A A . 22 GLN NE2 1 1 4 1716 1 1 1 GLN O O -6.516 -0.570 -3.699 1.00 . A A . 22 GLN O 1 1 4 1717 1 1 1 GLN OE1 O -5.738 1.938 -7.610 1.00 . A A . 22 GLN OE1 1 1 4 1718 1 1 2 THR C C -5.917 -2.720 -1.789 1.00 . A A . 23 THR C 1 1 4 1719 1 1 2 THR CA C -6.738 -3.313 -2.941 1.00 . A A . 23 THR CA 1 1 4 1720 1 1 2 THR CB C -6.561 -4.842 -2.977 1.00 . A A . 23 THR CB 1 1 4 1721 1 1 2 THR CG2 C -7.183 -5.553 -1.774 1.00 . A A . 23 THR CG2 1 1 4 1722 1 1 2 THR H H -6.330 -3.411 -5.021 1.00 . A A . 23 THR H 1 1 4 1723 1 1 2 THR HA H -7.785 -3.108 -2.736 1.00 . A A . 23 THR HA 1 1 4 1724 1 1 2 THR HB H -5.498 -5.083 -3.031 1.00 . A A . 23 THR HB 1 1 4 1725 1 1 2 THR HG1 H -6.994 -6.303 -4.187 1.00 . A A . 23 THR HG1 1 1 4 1726 1 1 2 THR HG21 H -8.246 -5.327 -1.717 1.00 . A A . 23 THR HG21 1 1 4 1727 1 1 2 THR HG22 H -7.054 -6.631 -1.879 1.00 . A A . 23 THR HG22 1 1 4 1728 1 1 2 THR HG23 H -6.690 -5.240 -0.853 1.00 . A A . 23 THR HG23 1 1 4 1729 1 1 2 THR N N -6.424 -2.739 -4.269 1.00 . A A . 23 THR N 1 1 4 1730 1 1 2 THR O O -4.705 -2.548 -1.908 1.00 . A A . 23 THR O 1 1 4 1731 1 1 2 THR OG1 O -7.209 -5.356 -4.124 1.00 . A A . 23 THR OG1 1 1 4 1732 1 1 3 CYS C C -4.867 -2.771 1.162 1.00 . A A . 24 CYS C 1 1 4 1733 1 1 3 CYS CA C -5.998 -1.902 0.569 1.00 . A A . 24 CYS CA 1 1 4 1734 1 1 3 CYS CB C -7.140 -1.784 1.583 1.00 . A A . 24 CYS CB 1 1 4 1735 1 1 3 CYS H H -7.584 -2.562 -0.675 1.00 . A A . 24 CYS H 1 1 4 1736 1 1 3 CYS HA H -5.609 -0.905 0.360 1.00 . A A . 24 CYS HA 1 1 4 1737 1 1 3 CYS HB2 H -8.017 -1.357 1.099 1.00 . A A . 24 CYS HB2 1 1 4 1738 1 1 3 CYS HB3 H -7.403 -2.782 1.941 1.00 . A A . 24 CYS HB3 1 1 4 1739 1 1 3 CYS N N -6.583 -2.438 -0.663 1.00 . A A . 24 CYS N 1 1 4 1740 1 1 3 CYS O O -4.896 -4.000 1.069 1.00 . A A . 24 CYS O 1 1 4 1741 1 1 3 CYS SG S -6.635 -0.730 2.965 1.00 . A A . 24 CYS SG 1 1 4 1742 1 1 4 TYR C C -3.606 -3.476 4.001 1.00 . A A . 25 TYR C 1 1 4 1743 1 1 4 TYR CA C -2.971 -2.814 2.757 1.00 . A A . 25 TYR CA 1 1 4 1744 1 1 4 TYR CB C -1.863 -1.836 3.189 1.00 . A A . 25 TYR CB 1 1 4 1745 1 1 4 TYR CD1 C -3.249 -0.076 4.411 1.00 . A A . 25 TYR CD1 1 1 4 1746 1 1 4 TYR CD2 C -1.361 -1.091 5.564 1.00 . A A . 25 TYR CD2 1 1 4 1747 1 1 4 TYR CE1 C -3.535 0.691 5.554 1.00 . A A . 25 TYR CE1 1 1 4 1748 1 1 4 TYR CE2 C -1.636 -0.312 6.707 1.00 . A A . 25 TYR CE2 1 1 4 1749 1 1 4 TYR CG C -2.163 -0.973 4.409 1.00 . A A . 25 TYR CG 1 1 4 1750 1 1 4 TYR CZ C -2.727 0.581 6.703 1.00 . A A . 25 TYR CZ 1 1 4 1751 1 1 4 TYR H H -3.973 -1.124 1.907 1.00 . A A . 25 TYR H 1 1 4 1752 1 1 4 TYR HA H -2.505 -3.614 2.186 1.00 . A A . 25 TYR HA 1 1 4 1753 1 1 4 TYR HB2 H -0.986 -2.442 3.416 1.00 . A A . 25 TYR HB2 1 1 4 1754 1 1 4 TYR HB3 H -1.594 -1.191 2.354 1.00 . A A . 25 TYR HB3 1 1 4 1755 1 1 4 TYR HD1 H -3.883 0.020 3.542 1.00 . A A . 25 TYR HD1 1 1 4 1756 1 1 4 TYR HD2 H -0.531 -1.786 5.577 1.00 . A A . 25 TYR HD2 1 1 4 1757 1 1 4 TYR HE1 H -4.386 1.349 5.563 1.00 . A A . 25 TYR HE1 1 1 4 1758 1 1 4 TYR HE2 H -1.017 -0.404 7.588 1.00 . A A . 25 TYR HE2 1 1 4 1759 1 1 4 TYR HH H -2.414 1.147 8.540 1.00 . A A . 25 TYR HH 1 1 4 1760 1 1 4 TYR N N -3.930 -2.135 1.873 1.00 . A A . 25 TYR N 1 1 4 1761 1 1 4 TYR O O -2.960 -4.301 4.653 1.00 . A A . 25 TYR O 1 1 4 1762 1 1 4 TYR OH O -3.022 1.329 7.804 1.00 . A A . 25 TYR OH 1 1 4 1763 1 1 5 ASN C C -6.956 -3.989 5.403 1.00 . A A . 26 ASN C 1 1 4 1764 1 1 5 ASN CA C -5.516 -3.475 5.596 1.00 . A A . 26 ASN CA 1 1 4 1765 1 1 5 ASN CB C -5.492 -2.211 6.479 1.00 . A A . 26 ASN CB 1 1 4 1766 1 1 5 ASN CG C -6.286 -2.374 7.766 1.00 . A A . 26 ASN CG 1 1 4 1767 1 1 5 ASN H H -5.305 -2.431 3.748 1.00 . A A . 26 ASN H 1 1 4 1768 1 1 5 ASN HA H -4.962 -4.264 6.109 1.00 . A A . 26 ASN HA 1 1 4 1769 1 1 5 ASN HB2 H -4.461 -1.976 6.739 1.00 . A A . 26 ASN HB2 1 1 4 1770 1 1 5 ASN HB3 H -5.898 -1.364 5.925 1.00 . A A . 26 ASN HB3 1 1 4 1771 1 1 5 ASN HD21 H -7.962 -1.548 6.965 1.00 . A A . 26 ASN HD21 1 1 4 1772 1 1 5 ASN HD22 H -8.054 -2.055 8.645 1.00 . A A . 26 ASN HD22 1 1 4 1773 1 1 5 ASN N N -4.856 -3.126 4.333 1.00 . A A . 26 ASN N 1 1 4 1774 1 1 5 ASN ND2 N -7.529 -1.944 7.792 1.00 . A A . 26 ASN ND2 1 1 4 1775 1 1 5 ASN O O -7.328 -5.018 5.971 1.00 . A A . 26 ASN O 1 1 4 1776 1 1 5 ASN OD1 O -5.799 -2.894 8.761 1.00 . A A . 26 ASN OD1 1 1 4 1777 1 1 6 CYS C C -9.661 -4.625 3.609 1.00 . A A . 27 CYS C 1 1 4 1778 1 1 6 CYS CA C -9.213 -3.462 4.527 1.00 . A A . 27 CYS CA 1 1 4 1779 1 1 6 CYS CB C -9.829 -2.125 4.077 1.00 . A A . 27 CYS CB 1 1 4 1780 1 1 6 CYS H H -7.394 -2.436 4.189 1.00 . A A . 27 CYS H 1 1 4 1781 1 1 6 CYS HA H -9.587 -3.679 5.529 1.00 . A A . 27 CYS HA 1 1 4 1782 1 1 6 CYS HB2 H -9.530 -1.919 3.048 1.00 . A A . 27 CYS HB2 1 1 4 1783 1 1 6 CYS HB3 H -10.918 -2.214 4.103 1.00 . A A . 27 CYS HB3 1 1 4 1784 1 1 6 CYS N N -7.763 -3.279 4.609 1.00 . A A . 27 CYS N 1 1 4 1785 1 1 6 CYS O O -10.844 -4.972 3.592 1.00 . A A . 27 CYS O 1 1 4 1786 1 1 6 CYS SG S -9.309 -0.768 5.173 1.00 . A A . 27 CYS SG 1 1 4 1787 1 1 7 GLY C C -10.073 -5.960 0.813 1.00 . A A . 28 GLY C 1 1 4 1788 1 1 7 GLY CA C -9.026 -6.311 1.886 1.00 . A A . 28 GLY CA 1 1 4 1789 1 1 7 GLY H H -7.783 -4.914 2.931 1.00 . A A . 28 GLY H 1 1 4 1790 1 1 7 GLY HA2 H -9.378 -7.182 2.440 1.00 . A A . 28 GLY HA2 1 1 4 1791 1 1 7 GLY HA3 H -8.102 -6.580 1.375 1.00 . A A . 28 GLY HA3 1 1 4 1792 1 1 7 GLY N N -8.741 -5.219 2.833 1.00 . A A . 28 GLY N 1 1 4 1793 1 1 7 GLY O O -10.870 -6.814 0.422 1.00 . A A . 28 GLY O 1 1 4 1794 1 1 8 LYS C C -10.613 -3.424 -1.696 1.00 . A A . 29 LYS C 1 1 4 1795 1 1 8 LYS CA C -11.177 -4.075 -0.415 1.00 . A A . 29 LYS CA 1 1 4 1796 1 1 8 LYS CB C -11.888 -3.067 0.511 1.00 . A A . 29 LYS CB 1 1 4 1797 1 1 8 LYS CD C -14.294 -3.281 -0.439 1.00 . A A . 29 LYS CD 1 1 4 1798 1 1 8 LYS CE C -14.815 -4.126 0.738 1.00 . A A . 29 LYS CE 1 1 4 1799 1 1 8 LYS CG C -13.111 -2.356 -0.098 1.00 . A A . 29 LYS CG 1 1 4 1800 1 1 8 LYS H H -9.386 -4.079 0.744 1.00 . A A . 29 LYS H 1 1 4 1801 1 1 8 LYS HA H -11.905 -4.839 -0.682 1.00 . A A . 29 LYS HA 1 1 4 1802 1 1 8 LYS HB2 H -12.199 -3.583 1.421 1.00 . A A . 29 LYS HB2 1 1 4 1803 1 1 8 LYS HB3 H -11.168 -2.311 0.820 1.00 . A A . 29 LYS HB3 1 1 4 1804 1 1 8 LYS HD2 H -15.112 -2.671 -0.826 1.00 . A A . 29 LYS HD2 1 1 4 1805 1 1 8 LYS HD3 H -13.995 -3.958 -1.239 1.00 . A A . 29 LYS HD3 1 1 4 1806 1 1 8 LYS HE2 H -15.577 -4.810 0.355 1.00 . A A . 29 LYS HE2 1 1 4 1807 1 1 8 LYS HE3 H -13.997 -4.739 1.130 1.00 . A A . 29 LYS HE3 1 1 4 1808 1 1 8 LYS HG2 H -13.451 -1.601 0.611 1.00 . A A . 29 LYS HG2 1 1 4 1809 1 1 8 LYS HG3 H -12.806 -1.831 -1.003 1.00 . A A . 29 LYS HG3 1 1 4 1810 1 1 8 LYS HZ1 H -16.171 -2.733 1.483 1.00 . A A . 29 LYS HZ1 1 1 4 1811 1 1 8 LYS HZ2 H -15.763 -3.877 2.569 1.00 . A A . 29 LYS HZ2 1 1 4 1812 1 1 8 LYS HZ3 H -14.718 -2.674 2.236 1.00 . A A . 29 LYS HZ3 1 1 4 1813 1 1 8 LYS N N -10.096 -4.694 0.373 1.00 . A A . 29 LYS N 1 1 4 1814 1 1 8 LYS NZ N -15.402 -3.295 1.825 1.00 . A A . 29 LYS NZ 1 1 4 1815 1 1 8 LYS O O -9.882 -2.438 -1.570 1.00 . A A . 29 LYS O 1 1 4 1816 1 1 9 PRO C C -10.500 -1.962 -4.479 1.00 . A A . 30 PRO C 1 1 4 1817 1 1 9 PRO CA C -10.364 -3.465 -4.192 1.00 . A A . 30 PRO CA 1 1 4 1818 1 1 9 PRO CB C -11.084 -4.282 -5.271 1.00 . A A . 30 PRO CB 1 1 4 1819 1 1 9 PRO CD C -11.664 -5.176 -3.138 1.00 . A A . 30 PRO CD 1 1 4 1820 1 1 9 PRO CG C -11.364 -5.606 -4.571 1.00 . A A . 30 PRO CG 1 1 4 1821 1 1 9 PRO HA H -9.307 -3.722 -4.231 1.00 . A A . 30 PRO HA 1 1 4 1822 1 1 9 PRO HB2 H -12.030 -3.809 -5.538 1.00 . A A . 30 PRO HB2 1 1 4 1823 1 1 9 PRO HB3 H -10.460 -4.419 -6.156 1.00 . A A . 30 PRO HB3 1 1 4 1824 1 1 9 PRO HD2 H -12.730 -4.969 -3.037 1.00 . A A . 30 PRO HD2 1 1 4 1825 1 1 9 PRO HD3 H -11.367 -5.971 -2.453 1.00 . A A . 30 PRO HD3 1 1 4 1826 1 1 9 PRO HG2 H -12.208 -6.133 -5.020 1.00 . A A . 30 PRO HG2 1 1 4 1827 1 1 9 PRO HG3 H -10.468 -6.227 -4.587 1.00 . A A . 30 PRO HG3 1 1 4 1828 1 1 9 PRO N N -10.904 -3.950 -2.908 1.00 . A A . 30 PRO N 1 1 4 1829 1 1 9 PRO O O -9.616 -1.379 -5.113 1.00 . A A . 30 PRO O 1 1 4 1830 1 1 10 GLY C C -11.060 1.109 -3.430 1.00 . A A . 31 GLY C 1 1 4 1831 1 1 10 GLY CA C -11.897 0.100 -4.230 1.00 . A A . 31 GLY CA 1 1 4 1832 1 1 10 GLY H H -12.253 -1.869 -3.498 1.00 . A A . 31 GLY H 1 1 4 1833 1 1 10 GLY HA2 H -12.948 0.264 -3.992 1.00 . A A . 31 GLY HA2 1 1 4 1834 1 1 10 GLY HA3 H -11.757 0.321 -5.288 1.00 . A A . 31 GLY HA3 1 1 4 1835 1 1 10 GLY N N -11.568 -1.318 -3.997 1.00 . A A . 31 GLY N 1 1 4 1836 1 1 10 GLY O O -11.580 2.146 -3.005 1.00 . A A . 31 GLY O 1 1 4 1837 1 1 11 HIS C C -7.876 2.430 -3.318 1.00 . A A . 32 HIS C 1 1 4 1838 1 1 11 HIS CA C -8.854 1.646 -2.430 1.00 . A A . 32 HIS CA 1 1 4 1839 1 1 11 HIS CB C -8.137 0.797 -1.369 1.00 . A A . 32 HIS CB 1 1 4 1840 1 1 11 HIS CD2 C -8.508 1.376 1.096 1.00 . A A . 32 HIS CD2 1 1 4 1841 1 1 11 HIS CE1 C -10.395 0.317 1.469 1.00 . A A . 32 HIS CE1 1 1 4 1842 1 1 11 HIS CG C -8.883 0.764 -0.065 1.00 . A A . 32 HIS CG 1 1 4 1843 1 1 11 HIS H H -9.424 -0.053 -3.581 1.00 . A A . 32 HIS H 1 1 4 1844 1 1 11 HIS HA H -9.429 2.401 -1.896 1.00 . A A . 32 HIS HA 1 1 4 1845 1 1 11 HIS HB2 H -8.020 -0.226 -1.723 1.00 . A A . 32 HIS HB2 1 1 4 1846 1 1 11 HIS HB3 H -7.139 1.198 -1.181 1.00 . A A . 32 HIS HB3 1 1 4 1847 1 1 11 HIS HD1 H -10.553 -0.490 -0.476 1.00 . A A . 32 HIS HD1 1 1 4 1848 1 1 11 HIS HD2 H -7.623 1.977 1.223 1.00 . A A . 32 HIS HD2 1 1 4 1849 1 1 11 HIS HE1 H -11.274 -0.088 1.956 1.00 . A A . 32 HIS HE1 1 1 4 1850 1 1 11 HIS N N -9.785 0.806 -3.186 1.00 . A A . 32 HIS N 1 1 4 1851 1 1 11 HIS ND1 N -10.062 0.105 0.183 1.00 . A A . 32 HIS ND1 1 1 4 1852 1 1 11 HIS NE2 N -9.461 1.070 2.078 1.00 . A A . 32 HIS NE2 1 1 4 1853 1 1 11 HIS O O -7.632 2.107 -4.484 1.00 . A A . 32 HIS O 1 1 4 1854 1 1 12 LEU C C -5.633 5.140 -2.169 1.00 . A A . 33 LEU C 1 1 4 1855 1 1 12 LEU CA C -6.501 4.548 -3.295 1.00 . A A . 33 LEU CA 1 1 4 1856 1 1 12 LEU CB C -7.401 5.675 -3.863 1.00 . A A . 33 LEU CB 1 1 4 1857 1 1 12 LEU CD1 C -9.184 6.517 -5.412 1.00 . A A . 33 LEU CD1 1 1 4 1858 1 1 12 LEU CD2 C -7.453 4.999 -6.316 1.00 . A A . 33 LEU CD2 1 1 4 1859 1 1 12 LEU CG C -8.285 5.327 -5.076 1.00 . A A . 33 LEU CG 1 1 4 1860 1 1 12 LEU H H -7.555 3.618 -1.742 1.00 . A A . 33 LEU H 1 1 4 1861 1 1 12 LEU HA H -5.853 4.142 -4.072 1.00 . A A . 33 LEU HA 1 1 4 1862 1 1 12 LEU HB2 H -8.052 6.024 -3.059 1.00 . A A . 33 LEU HB2 1 1 4 1863 1 1 12 LEU HB3 H -6.770 6.518 -4.150 1.00 . A A . 33 LEU HB3 1 1 4 1864 1 1 12 LEU HD11 H -9.814 6.756 -4.554 1.00 . A A . 33 LEU HD11 1 1 4 1865 1 1 12 LEU HD12 H -8.579 7.388 -5.665 1.00 . A A . 33 LEU HD12 1 1 4 1866 1 1 12 LEU HD13 H -9.826 6.268 -6.256 1.00 . A A . 33 LEU HD13 1 1 4 1867 1 1 12 LEU HD21 H -6.798 5.834 -6.563 1.00 . A A . 33 LEU HD21 1 1 4 1868 1 1 12 LEU HD22 H -6.854 4.110 -6.132 1.00 . A A . 33 LEU HD22 1 1 4 1869 1 1 12 LEU HD23 H -8.113 4.797 -7.159 1.00 . A A . 33 LEU HD23 1 1 4 1870 1 1 12 LEU HG H -8.928 4.481 -4.839 1.00 . A A . 33 LEU HG 1 1 4 1871 1 1 12 LEU N N -7.349 3.500 -2.723 1.00 . A A . 33 LEU N 1 1 4 1872 1 1 12 LEU O O -5.934 4.948 -0.987 1.00 . A A . 33 LEU O 1 1 4 1873 1 1 13 SER C C -4.661 7.755 -0.721 1.00 . A A . 34 SER C 1 1 4 1874 1 1 13 SER CA C -3.841 6.785 -1.597 1.00 . A A . 34 SER CA 1 1 4 1875 1 1 13 SER CB C -2.822 7.599 -2.401 1.00 . A A . 34 SER CB 1 1 4 1876 1 1 13 SER H H -4.415 6.036 -3.508 1.00 . A A . 34 SER H 1 1 4 1877 1 1 13 SER HA H -3.296 6.122 -0.922 1.00 . A A . 34 SER HA 1 1 4 1878 1 1 13 SER HB2 H -3.352 8.265 -3.085 1.00 . A A . 34 SER HB2 1 1 4 1879 1 1 13 SER HB3 H -2.218 8.206 -1.723 1.00 . A A . 34 SER HB3 1 1 4 1880 1 1 13 SER HG H -1.440 7.270 -3.753 1.00 . A A . 34 SER HG 1 1 4 1881 1 1 13 SER N N -4.639 5.957 -2.525 1.00 . A A . 34 SER N 1 1 4 1882 1 1 13 SER O O -4.144 8.292 0.261 1.00 . A A . 34 SER O 1 1 4 1883 1 1 13 SER OG O -1.979 6.730 -3.142 1.00 . A A . 34 SER OG 1 1 4 1884 1 1 14 SER C C -7.948 7.987 0.451 1.00 . A A . 35 SER C 1 1 4 1885 1 1 14 SER CA C -6.907 8.807 -0.332 1.00 . A A . 35 SER CA 1 1 4 1886 1 1 14 SER CB C -7.624 9.725 -1.330 1.00 . A A . 35 SER CB 1 1 4 1887 1 1 14 SER H H -6.259 7.586 -1.935 1.00 . A A . 35 SER H 1 1 4 1888 1 1 14 SER HA H -6.385 9.439 0.387 1.00 . A A . 35 SER HA 1 1 4 1889 1 1 14 SER HB2 H -8.390 10.306 -0.813 1.00 . A A . 35 SER HB2 1 1 4 1890 1 1 14 SER HB3 H -6.898 10.413 -1.764 1.00 . A A . 35 SER HB3 1 1 4 1891 1 1 14 SER HG H -8.672 9.564 -2.979 1.00 . A A . 35 SER HG 1 1 4 1892 1 1 14 SER N N -5.933 7.985 -1.066 1.00 . A A . 35 SER N 1 1 4 1893 1 1 14 SER O O -8.704 8.557 1.243 1.00 . A A . 35 SER O 1 1 4 1894 1 1 14 SER OG O -8.218 8.953 -2.367 1.00 . A A . 35 SER OG 1 1 4 1895 1 1 15 GLN C C -8.308 5.169 2.236 1.00 . A A . 36 GLN C 1 1 4 1896 1 1 15 GLN CA C -8.929 5.753 0.947 1.00 . A A . 36 GLN CA 1 1 4 1897 1 1 15 GLN CB C -9.340 4.642 -0.037 1.00 . A A . 36 GLN CB 1 1 4 1898 1 1 15 GLN CD C -11.884 4.725 -0.144 1.00 . A A . 36 GLN CD 1 1 4 1899 1 1 15 GLN CG C -10.660 3.942 0.333 1.00 . A A . 36 GLN CG 1 1 4 1900 1 1 15 GLN H H -7.306 6.250 -0.355 1.00 . A A . 36 GLN H 1 1 4 1901 1 1 15 GLN HA H -9.823 6.312 1.226 1.00 . A A . 36 GLN HA 1 1 4 1902 1 1 15 GLN HB2 H -9.449 5.060 -1.039 1.00 . A A . 36 GLN HB2 1 1 4 1903 1 1 15 GLN HB3 H -8.543 3.901 -0.076 1.00 . A A . 36 GLN HB3 1 1 4 1904 1 1 15 GLN HE21 H -12.076 3.620 -1.844 1.00 . A A . 36 GLN HE21 1 1 4 1905 1 1 15 GLN HE22 H -13.245 4.913 -1.602 1.00 . A A . 36 GLN HE22 1 1 4 1906 1 1 15 GLN HG2 H -10.686 2.962 -0.138 1.00 . A A . 36 GLN HG2 1 1 4 1907 1 1 15 GLN HG3 H -10.719 3.789 1.410 1.00 . A A . 36 GLN HG3 1 1 4 1908 1 1 15 GLN N N -7.992 6.660 0.266 1.00 . A A . 36 GLN N 1 1 4 1909 1 1 15 GLN NE2 N -12.440 4.393 -1.292 1.00 . A A . 36 GLN NE2 1 1 4 1910 1 1 15 GLN O O -8.970 5.150 3.276 1.00 . A A . 36 GLN O 1 1 4 1911 1 1 15 GLN OE1 O -12.357 5.649 0.502 1.00 . A A . 36 GLN OE1 1 1 4 1912 1 1 16 CYS C C -4.703 4.944 3.044 1.00 . A A . 37 CYS C 1 1 4 1913 1 1 16 CYS CA C -6.142 4.441 3.298 1.00 . A A . 37 CYS CA 1 1 4 1914 1 1 16 CYS CB C -6.146 2.916 3.539 1.00 . A A . 37 CYS CB 1 1 4 1915 1 1 16 CYS H H -6.563 4.882 1.274 1.00 . A A . 37 CYS H 1 1 4 1916 1 1 16 CYS HA H -6.500 4.943 4.195 1.00 . A A . 37 CYS HA 1 1 4 1917 1 1 16 CYS HB2 H -6.125 2.387 2.585 1.00 . A A . 37 CYS HB2 1 1 4 1918 1 1 16 CYS HB3 H -5.237 2.631 4.063 1.00 . A A . 37 CYS HB3 1 1 4 1919 1 1 16 CYS N N -7.021 4.791 2.173 1.00 . A A . 37 CYS N 1 1 4 1920 1 1 16 CYS O O -4.389 5.452 1.964 1.00 . A A . 37 CYS O 1 1 4 1921 1 1 16 CYS SG S -7.553 2.403 4.562 1.00 . A A . 37 CYS SG 1 1 4 1922 1 1 17 ARG C C -1.651 4.598 2.760 1.00 . A A . 38 ARG C 1 1 4 1923 1 1 17 ARG CA C -2.393 5.164 3.980 1.00 . A A . 38 ARG CA 1 1 4 1924 1 1 17 ARG CB C -1.658 4.761 5.273 1.00 . A A . 38 ARG CB 1 1 4 1925 1 1 17 ARG CD C -3.044 4.926 7.471 1.00 . A A . 38 ARG CD 1 1 4 1926 1 1 17 ARG CG C -2.010 5.575 6.536 1.00 . A A . 38 ARG CG 1 1 4 1927 1 1 17 ARG CZ C -5.467 4.395 7.067 1.00 . A A . 38 ARG CZ 1 1 4 1928 1 1 17 ARG H H -4.154 4.352 4.891 1.00 . A A . 38 ARG H 1 1 4 1929 1 1 17 ARG HA H -2.337 6.250 3.877 1.00 . A A . 38 ARG HA 1 1 4 1930 1 1 17 ARG HB2 H -1.797 3.695 5.464 1.00 . A A . 38 ARG HB2 1 1 4 1931 1 1 17 ARG HB3 H -0.593 4.918 5.096 1.00 . A A . 38 ARG HB3 1 1 4 1932 1 1 17 ARG HD2 H -2.861 3.854 7.510 1.00 . A A . 38 ARG HD2 1 1 4 1933 1 1 17 ARG HD3 H -2.880 5.319 8.477 1.00 . A A . 38 ARG HD3 1 1 4 1934 1 1 17 ARG HE H -4.654 6.198 6.917 1.00 . A A . 38 ARG HE 1 1 4 1935 1 1 17 ARG HG2 H -1.090 5.668 7.115 1.00 . A A . 38 ARG HG2 1 1 4 1936 1 1 17 ARG HG3 H -2.322 6.584 6.265 1.00 . A A . 38 ARG HG3 1 1 4 1937 1 1 17 ARG HH11 H -4.457 2.727 7.561 1.00 . A A . 38 ARG HH11 1 1 4 1938 1 1 17 ARG HH12 H -6.161 2.527 7.240 1.00 . A A . 38 ARG HH12 1 1 4 1939 1 1 17 ARG HH21 H -6.818 5.810 6.609 1.00 . A A . 38 ARG HH21 1 1 4 1940 1 1 17 ARG HH22 H -7.392 4.169 6.580 1.00 . A A . 38 ARG HH22 1 1 4 1941 1 1 17 ARG N N -3.815 4.773 4.038 1.00 . A A . 38 ARG N 1 1 4 1942 1 1 17 ARG NE N -4.441 5.228 7.094 1.00 . A A . 38 ARG NE 1 1 4 1943 1 1 17 ARG NH1 N -5.352 3.120 7.298 1.00 . A A . 38 ARG NH1 1 1 4 1944 1 1 17 ARG NH2 N -6.654 4.830 6.766 1.00 . A A . 38 ARG NH2 1 1 4 1945 1 1 17 ARG O O -0.810 5.301 2.196 1.00 . A A . 38 ARG O 1 1 4 1946 1 1 18 ALA C C -2.318 1.586 0.599 1.00 . A A . 39 ALA C 1 1 4 1947 1 1 18 ALA CA C -1.444 2.759 1.106 1.00 . A A . 39 ALA CA 1 1 4 1948 1 1 18 ALA CB C -0.025 2.245 1.393 1.00 . A A . 39 ALA CB 1 1 4 1949 1 1 18 ALA H H -2.655 2.852 2.855 1.00 . A A . 39 ALA H 1 1 4 1950 1 1 18 ALA HA H -1.405 3.522 0.330 1.00 . A A . 39 ALA HA 1 1 4 1951 1 1 18 ALA HB1 H 0.623 3.066 1.701 1.00 . A A . 39 ALA HB1 1 1 4 1952 1 1 18 ALA HB2 H -0.065 1.494 2.181 1.00 . A A . 39 ALA HB2 1 1 4 1953 1 1 18 ALA HB3 H 0.398 1.784 0.500 1.00 . A A . 39 ALA HB3 1 1 4 1954 1 1 18 ALA N N -1.966 3.372 2.332 1.00 . A A . 39 ALA N 1 1 4 1955 1 1 18 ALA O O -3.053 0.978 1.383 1.00 . A A . 39 ALA O 1 1 4 1956 1 1 19 PRO C C -1.666 -1.220 -0.715 1.00 . A A . 40 PRO C 1 1 4 1957 1 1 19 PRO CA C -2.629 -0.106 -1.173 1.00 . A A . 40 PRO CA 1 1 4 1958 1 1 19 PRO CB C -2.656 0.042 -2.698 1.00 . A A . 40 PRO CB 1 1 4 1959 1 1 19 PRO CD C -1.571 1.965 -1.766 1.00 . A A . 40 PRO CD 1 1 4 1960 1 1 19 PRO CG C -1.521 1.028 -2.972 1.00 . A A . 40 PRO CG 1 1 4 1961 1 1 19 PRO HA H -3.634 -0.336 -0.817 1.00 . A A . 40 PRO HA 1 1 4 1962 1 1 19 PRO HB2 H -2.509 -0.904 -3.221 1.00 . A A . 40 PRO HB2 1 1 4 1963 1 1 19 PRO HB3 H -3.604 0.490 -2.990 1.00 . A A . 40 PRO HB3 1 1 4 1964 1 1 19 PRO HD2 H -0.562 2.284 -1.506 1.00 . A A . 40 PRO HD2 1 1 4 1965 1 1 19 PRO HD3 H -2.189 2.833 -2.004 1.00 . A A . 40 PRO HD3 1 1 4 1966 1 1 19 PRO HG2 H -0.568 0.497 -2.982 1.00 . A A . 40 PRO HG2 1 1 4 1967 1 1 19 PRO HG3 H -1.667 1.566 -3.909 1.00 . A A . 40 PRO HG3 1 1 4 1968 1 1 19 PRO N N -2.201 1.207 -0.690 1.00 . A A . 40 PRO N 1 1 4 1969 1 1 19 PRO O O -0.586 -0.954 -0.184 1.00 . A A . 40 PRO O 1 1 4 1970 1 1 20 LYS C C 0.151 -3.817 -1.083 1.00 . A A . 41 LYS C 1 1 4 1971 1 1 20 LYS CA C -1.312 -3.725 -0.612 1.00 . A A . 41 LYS CA 1 1 4 1972 1 1 20 LYS CB C -2.164 -4.917 -1.093 1.00 . A A . 41 LYS CB 1 1 4 1973 1 1 20 LYS CD C -2.835 -7.333 -0.761 1.00 . A A . 41 LYS CD 1 1 4 1974 1 1 20 LYS CE C -2.490 -8.637 -0.033 1.00 . A A . 41 LYS CE 1 1 4 1975 1 1 20 LYS CG C -1.836 -6.235 -0.373 1.00 . A A . 41 LYS CG 1 1 4 1976 1 1 20 LYS H H -2.941 -2.596 -1.423 1.00 . A A . 41 LYS H 1 1 4 1977 1 1 20 LYS HA H -1.263 -3.759 0.476 1.00 . A A . 41 LYS HA 1 1 4 1978 1 1 20 LYS HB2 H -3.213 -4.694 -0.907 1.00 . A A . 41 LYS HB2 1 1 4 1979 1 1 20 LYS HB3 H -2.034 -5.047 -2.170 1.00 . A A . 41 LYS HB3 1 1 4 1980 1 1 20 LYS HD2 H -3.844 -7.017 -0.486 1.00 . A A . 41 LYS HD2 1 1 4 1981 1 1 20 LYS HD3 H -2.794 -7.494 -1.840 1.00 . A A . 41 LYS HD3 1 1 4 1982 1 1 20 LYS HE2 H -1.469 -8.929 -0.297 1.00 . A A . 41 LYS HE2 1 1 4 1983 1 1 20 LYS HE3 H -2.516 -8.456 1.046 1.00 . A A . 41 LYS HE3 1 1 4 1984 1 1 20 LYS HG2 H -0.832 -6.562 -0.641 1.00 . A A . 41 LYS HG2 1 1 4 1985 1 1 20 LYS HG3 H -1.884 -6.076 0.706 1.00 . A A . 41 LYS HG3 1 1 4 1986 1 1 20 LYS HZ1 H -3.416 -9.929 -1.375 1.00 . A A . 41 LYS HZ1 1 1 4 1987 1 1 20 LYS HZ2 H -3.196 -10.585 0.100 1.00 . A A . 41 LYS HZ2 1 1 4 1988 1 1 20 LYS HZ3 H -4.384 -9.493 -0.131 1.00 . A A . 41 LYS HZ3 1 1 4 1989 1 1 20 LYS N N -2.033 -2.482 -0.980 1.00 . A A . 41 LYS N 1 1 4 1990 1 1 20 LYS NZ N -3.435 -9.730 -0.385 1.00 . A A . 41 LYS NZ 1 1 4 1991 1 1 20 LYS O O 0.909 -4.651 -0.590 1.00 . A A . 41 LYS O 1 1 4 1992 1 1 21 VAL C C 2.870 -2.319 -1.157 1.00 . A A . 42 VAL C 1 1 4 1993 1 1 21 VAL CA C 1.978 -2.681 -2.363 1.00 . A A . 42 VAL CA 1 1 4 1994 1 1 21 VAL CB C 2.027 -1.548 -3.415 1.00 . A A . 42 VAL CB 1 1 4 1995 1 1 21 VAL CG1 C 3.444 -1.258 -3.911 1.00 . A A . 42 VAL CG1 1 1 4 1996 1 1 21 VAL CG2 C 1.177 -1.883 -4.650 1.00 . A A . 42 VAL CG2 1 1 4 1997 1 1 21 VAL H H -0.124 -2.298 -2.344 1.00 . A A . 42 VAL H 1 1 4 1998 1 1 21 VAL HA H 2.385 -3.587 -2.813 1.00 . A A . 42 VAL HA 1 1 4 1999 1 1 21 VAL HB H 1.633 -0.635 -2.966 1.00 . A A . 42 VAL HB 1 1 4 2000 1 1 21 VAL HG11 H 3.888 -2.167 -4.317 1.00 . A A . 42 VAL HG11 1 1 4 2001 1 1 21 VAL HG12 H 3.421 -0.493 -4.688 1.00 . A A . 42 VAL HG12 1 1 4 2002 1 1 21 VAL HG13 H 4.063 -0.885 -3.096 1.00 . A A . 42 VAL HG13 1 1 4 2003 1 1 21 VAL HG21 H 1.523 -2.814 -5.100 1.00 . A A . 42 VAL HG21 1 1 4 2004 1 1 21 VAL HG22 H 0.125 -1.982 -4.384 1.00 . A A . 42 VAL HG22 1 1 4 2005 1 1 21 VAL HG23 H 1.258 -1.081 -5.386 1.00 . A A . 42 VAL HG23 1 1 4 2006 1 1 21 VAL N N 0.574 -2.928 -1.980 1.00 . A A . 42 VAL N 1 1 4 2007 1 1 21 VAL O O 4.037 -2.707 -1.124 1.00 . A A . 42 VAL O 1 1 4 2008 1 1 22 CYS C C 2.198 -0.900 2.216 1.00 . A A . 43 CYS C 1 1 4 2009 1 1 22 CYS CA C 3.068 -0.977 0.935 1.00 . A A . 43 CYS CA 1 1 4 2010 1 1 22 CYS CB C 3.539 0.399 0.415 1.00 . A A . 43 CYS CB 1 1 4 2011 1 1 22 CYS H H 1.339 -1.378 -0.231 1.00 . A A . 43 CYS H 1 1 4 2012 1 1 22 CYS HA H 3.949 -1.576 1.168 1.00 . A A . 43 CYS HA 1 1 4 2013 1 1 22 CYS HB2 H 3.984 0.258 -0.572 1.00 . A A . 43 CYS HB2 1 1 4 2014 1 1 22 CYS HB3 H 2.678 1.059 0.308 1.00 . A A . 43 CYS HB3 1 1 4 2015 1 1 22 CYS N N 2.328 -1.598 -0.168 1.00 . A A . 43 CYS N 1 1 4 2016 1 1 22 CYS O O 1.296 -1.712 2.428 1.00 . A A . 43 CYS O 1 1 4 2017 1 1 22 CYS SG S 4.781 1.158 1.497 1.00 . A A . 43 CYS SG 1 1 4 2018 1 1 23 PHE C C 1.660 2.014 4.431 1.00 . A A . 44 PHE C 1 1 4 2019 1 1 23 PHE CA C 1.699 0.481 4.243 1.00 . A A . 44 PHE CA 1 1 4 2020 1 1 23 PHE CB C 2.238 -0.206 5.508 1.00 . A A . 44 PHE CB 1 1 4 2021 1 1 23 PHE CD1 C 4.768 0.073 5.488 1.00 . A A . 44 PHE CD1 1 1 4 2022 1 1 23 PHE CD2 C 3.461 1.319 7.123 1.00 . A A . 44 PHE CD2 1 1 4 2023 1 1 23 PHE CE1 C 5.944 0.667 5.982 1.00 . A A . 44 PHE CE1 1 1 4 2024 1 1 23 PHE CE2 C 4.637 1.912 7.614 1.00 . A A . 44 PHE CE2 1 1 4 2025 1 1 23 PHE CG C 3.520 0.399 6.057 1.00 . A A . 44 PHE CG 1 1 4 2026 1 1 23 PHE CZ C 5.880 1.588 7.042 1.00 . A A . 44 PHE CZ 1 1 4 2027 1 1 23 PHE H H 3.313 0.605 2.845 1.00 . A A . 44 PHE H 1 1 4 2028 1 1 23 PHE HA H 0.670 0.153 4.093 1.00 . A A . 44 PHE HA 1 1 4 2029 1 1 23 PHE HB2 H 1.471 -0.142 6.281 1.00 . A A . 44 PHE HB2 1 1 4 2030 1 1 23 PHE HB3 H 2.397 -1.266 5.307 1.00 . A A . 44 PHE HB3 1 1 4 2031 1 1 23 PHE HD1 H 4.827 -0.630 4.670 1.00 . A A . 44 PHE HD1 1 1 4 2032 1 1 23 PHE HD2 H 2.508 1.579 7.562 1.00 . A A . 44 PHE HD2 1 1 4 2033 1 1 23 PHE HE1 H 6.901 0.416 5.545 1.00 . A A . 44 PHE HE1 1 1 4 2034 1 1 23 PHE HE2 H 4.586 2.621 8.431 1.00 . A A . 44 PHE HE2 1 1 4 2035 1 1 23 PHE HZ H 6.785 2.045 7.418 1.00 . A A . 44 PHE HZ 1 1 4 2036 1 1 23 PHE N N 2.492 0.066 3.082 1.00 . A A . 44 PHE N 1 1 4 2037 1 1 23 PHE O O 0.772 2.512 5.125 1.00 . A A . 44 PHE O 1 1 4 2038 1 1 24 LYS C C 3.396 4.920 2.760 1.00 . A A . 45 LYS C 1 1 4 2039 1 1 24 LYS CA C 2.694 4.238 3.944 1.00 . A A . 45 LYS CA 1 1 4 2040 1 1 24 LYS CB C 3.427 4.543 5.270 1.00 . A A . 45 LYS CB 1 1 4 2041 1 1 24 LYS CD C 2.309 6.801 5.784 1.00 . A A . 45 LYS CD 1 1 4 2042 1 1 24 LYS CE C 2.619 8.237 6.232 1.00 . A A . 45 LYS CE 1 1 4 2043 1 1 24 LYS CG C 3.627 6.034 5.594 1.00 . A A . 45 LYS CG 1 1 4 2044 1 1 24 LYS H H 3.280 2.295 3.246 1.00 . A A . 45 LYS H 1 1 4 2045 1 1 24 LYS HA H 1.688 4.658 3.991 1.00 . A A . 45 LYS HA 1 1 4 2046 1 1 24 LYS HB2 H 2.869 4.094 6.094 1.00 . A A . 45 LYS HB2 1 1 4 2047 1 1 24 LYS HB3 H 4.409 4.070 5.250 1.00 . A A . 45 LYS HB3 1 1 4 2048 1 1 24 LYS HD2 H 1.755 6.824 4.844 1.00 . A A . 45 LYS HD2 1 1 4 2049 1 1 24 LYS HD3 H 1.708 6.301 6.546 1.00 . A A . 45 LYS HD3 1 1 4 2050 1 1 24 LYS HE2 H 3.220 8.195 7.145 1.00 . A A . 45 LYS HE2 1 1 4 2051 1 1 24 LYS HE3 H 3.222 8.723 5.459 1.00 . A A . 45 LYS HE3 1 1 4 2052 1 1 24 LYS HG2 H 4.201 6.097 6.521 1.00 . A A . 45 LYS HG2 1 1 4 2053 1 1 24 LYS HG3 H 4.213 6.508 4.808 1.00 . A A . 45 LYS HG3 1 1 4 2054 1 1 24 LYS HZ1 H 0.814 9.090 5.646 1.00 . A A . 45 LYS HZ1 1 1 4 2055 1 1 24 LYS HZ2 H 0.820 8.603 7.210 1.00 . A A . 45 LYS HZ2 1 1 4 2056 1 1 24 LYS HZ3 H 1.605 9.962 6.774 1.00 . A A . 45 LYS HZ3 1 1 4 2057 1 1 24 LYS N N 2.590 2.770 3.811 1.00 . A A . 45 LYS N 1 1 4 2058 1 1 24 LYS NZ N 1.381 9.019 6.479 1.00 . A A . 45 LYS NZ 1 1 4 2059 1 1 24 LYS O O 2.794 5.781 2.116 1.00 . A A . 45 LYS O 1 1 4 2060 1 1 25 CYS C C 5.257 4.994 0.048 1.00 . A A . 46 CYS C 1 1 4 2061 1 1 25 CYS CA C 5.533 5.268 1.544 1.00 . A A . 46 CYS CA 1 1 4 2062 1 1 25 CYS CB C 6.997 5.003 1.946 1.00 . A A . 46 CYS CB 1 1 4 2063 1 1 25 CYS H H 5.091 3.855 3.053 1.00 . A A . 46 CYS H 1 1 4 2064 1 1 25 CYS HA H 5.367 6.336 1.682 1.00 . A A . 46 CYS HA 1 1 4 2065 1 1 25 CYS HB2 H 7.654 5.237 1.105 1.00 . A A . 46 CYS HB2 1 1 4 2066 1 1 25 CYS HB3 H 7.254 5.683 2.762 1.00 . A A . 46 CYS HB3 1 1 4 2067 1 1 25 CYS N N 4.651 4.559 2.478 1.00 . A A . 46 CYS N 1 1 4 2068 1 1 25 CYS O O 5.430 5.906 -0.763 1.00 . A A . 46 CYS O 1 1 4 2069 1 1 25 CYS SG S 7.290 3.302 2.510 1.00 . A A . 46 CYS SG 1 1 4 2070 1 1 26 LYS C C 4.817 3.878 -2.913 1.00 . A A . 47 LYS C 1 1 4 2071 1 1 26 LYS CA C 4.134 3.411 -1.603 1.00 . A A . 47 LYS CA 1 1 4 2072 1 1 26 LYS CB C 2.616 3.700 -1.544 1.00 . A A . 47 LYS CB 1 1 4 2073 1 1 26 LYS CD C 0.750 5.397 -1.251 1.00 . A A . 47 LYS CD 1 1 4 2074 1 1 26 LYS CE C 0.437 6.835 -0.815 1.00 . A A . 47 LYS CE 1 1 4 2075 1 1 26 LYS CG C 2.262 5.189 -1.396 1.00 . A A . 47 LYS CG 1 1 4 2076 1 1 26 LYS H H 4.685 3.121 0.444 1.00 . A A . 47 LYS H 1 1 4 2077 1 1 26 LYS HA H 4.212 2.327 -1.661 1.00 . A A . 47 LYS HA 1 1 4 2078 1 1 26 LYS HB2 H 2.132 3.304 -2.437 1.00 . A A . 47 LYS HB2 1 1 4 2079 1 1 26 LYS HB3 H 2.203 3.165 -0.688 1.00 . A A . 47 LYS HB3 1 1 4 2080 1 1 26 LYS HD2 H 0.273 5.201 -2.214 1.00 . A A . 47 LYS HD2 1 1 4 2081 1 1 26 LYS HD3 H 0.345 4.703 -0.516 1.00 . A A . 47 LYS HD3 1 1 4 2082 1 1 26 LYS HE2 H 1.016 7.526 -1.435 1.00 . A A . 47 LYS HE2 1 1 4 2083 1 1 26 LYS HE3 H -0.623 7.024 -1.001 1.00 . A A . 47 LYS HE3 1 1 4 2084 1 1 26 LYS HG2 H 2.745 5.584 -0.509 1.00 . A A . 47 LYS HG2 1 1 4 2085 1 1 26 LYS HG3 H 2.622 5.744 -2.263 1.00 . A A . 47 LYS HG3 1 1 4 2086 1 1 26 LYS HZ1 H 1.679 6.791 0.874 1.00 . A A . 47 LYS HZ1 1 1 4 2087 1 1 26 LYS HZ2 H 0.590 8.022 0.889 1.00 . A A . 47 LYS HZ2 1 1 4 2088 1 1 26 LYS HZ3 H 0.121 6.484 1.209 1.00 . A A . 47 LYS HZ3 1 1 4 2089 1 1 26 LYS N N 4.751 3.801 -0.307 1.00 . A A . 47 LYS N 1 1 4 2090 1 1 26 LYS NZ N 0.729 7.056 0.627 1.00 . A A . 47 LYS NZ 1 1 4 2091 1 1 26 LYS O O 4.156 4.005 -3.945 1.00 . A A . 47 LYS O 1 1 4 2092 1 1 27 GLN C C 7.010 3.406 -5.153 1.00 . A A . 48 GLN C 1 1 4 2093 1 1 27 GLN CA C 6.909 4.529 -4.086 1.00 . A A . 48 GLN CA 1 1 4 2094 1 1 27 GLN CB C 8.314 5.000 -3.657 1.00 . A A . 48 GLN CB 1 1 4 2095 1 1 27 GLN CD C 7.572 7.411 -3.252 1.00 . A A . 48 GLN CD 1 1 4 2096 1 1 27 GLN CG C 8.313 6.198 -2.692 1.00 . A A . 48 GLN CG 1 1 4 2097 1 1 27 GLN H H 6.616 4.015 -2.022 1.00 . A A . 48 GLN H 1 1 4 2098 1 1 27 GLN HA H 6.382 5.372 -4.530 1.00 . A A . 48 GLN HA 1 1 4 2099 1 1 27 GLN HB2 H 8.838 4.174 -3.180 1.00 . A A . 48 GLN HB2 1 1 4 2100 1 1 27 GLN HB3 H 8.882 5.282 -4.545 1.00 . A A . 48 GLN HB3 1 1 4 2101 1 1 27 GLN HE21 H 6.005 7.161 -1.996 1.00 . A A . 48 GLN HE21 1 1 4 2102 1 1 27 GLN HE22 H 5.911 8.529 -3.111 1.00 . A A . 48 GLN HE22 1 1 4 2103 1 1 27 GLN HG2 H 7.877 5.901 -1.739 1.00 . A A . 48 GLN HG2 1 1 4 2104 1 1 27 GLN HG3 H 9.345 6.486 -2.494 1.00 . A A . 48 GLN HG3 1 1 4 2105 1 1 27 GLN N N 6.134 4.115 -2.901 1.00 . A A . 48 GLN N 1 1 4 2106 1 1 27 GLN NE2 N 6.401 7.729 -2.743 1.00 . A A . 48 GLN NE2 1 1 4 2107 1 1 27 GLN O O 6.989 2.230 -4.774 1.00 . A A . 48 GLN O 1 1 4 2108 1 1 27 GLN OE1 O 8.024 8.085 -4.169 1.00 . A A . 48 GLN OE1 1 1 4 2109 1 1 28 PRO C C 7.812 1.468 -7.606 1.00 . A A . 49 PRO C 1 1 4 2110 1 1 28 PRO CA C 7.027 2.796 -7.597 1.00 . A A . 49 PRO CA 1 1 4 2111 1 1 28 PRO CB C 7.395 3.610 -8.841 1.00 . A A . 49 PRO CB 1 1 4 2112 1 1 28 PRO CD C 7.304 5.091 -6.979 1.00 . A A . 49 PRO CD 1 1 4 2113 1 1 28 PRO CG C 6.979 5.026 -8.468 1.00 . A A . 49 PRO CG 1 1 4 2114 1 1 28 PRO HA H 5.968 2.540 -7.666 1.00 . A A . 49 PRO HA 1 1 4 2115 1 1 28 PRO HB2 H 8.475 3.581 -9.003 1.00 . A A . 49 PRO HB2 1 1 4 2116 1 1 28 PRO HB3 H 6.866 3.257 -9.728 1.00 . A A . 49 PRO HB3 1 1 4 2117 1 1 28 PRO HD2 H 8.333 5.427 -6.848 1.00 . A A . 49 PRO HD2 1 1 4 2118 1 1 28 PRO HD3 H 6.618 5.790 -6.503 1.00 . A A . 49 PRO HD3 1 1 4 2119 1 1 28 PRO HG2 H 7.531 5.776 -9.037 1.00 . A A . 49 PRO HG2 1 1 4 2120 1 1 28 PRO HG3 H 5.905 5.144 -8.614 1.00 . A A . 49 PRO HG3 1 1 4 2121 1 1 28 PRO N N 7.168 3.728 -6.460 1.00 . A A . 49 PRO N 1 1 4 2122 1 1 28 PRO O O 7.441 0.567 -8.364 1.00 . A A . 49 PRO O 1 1 4 2123 1 1 29 GLY C C 10.416 -0.203 -5.439 1.00 . A A . 50 GLY C 1 1 4 2124 1 1 29 GLY CA C 9.687 0.080 -6.761 1.00 . A A . 50 GLY CA 1 1 4 2125 1 1 29 GLY H H 9.181 2.119 -6.283 1.00 . A A . 50 GLY H 1 1 4 2126 1 1 29 GLY HA2 H 10.436 0.124 -7.551 1.00 . A A . 50 GLY HA2 1 1 4 2127 1 1 29 GLY HA3 H 9.045 -0.778 -6.958 1.00 . A A . 50 GLY HA3 1 1 4 2128 1 1 29 GLY N N 8.880 1.316 -6.813 1.00 . A A . 50 GLY N 1 1 4 2129 1 1 29 GLY O O 11.125 -1.205 -5.333 1.00 . A A . 50 GLY O 1 1 4 2130 1 1 30 HIS C C 10.527 -0.740 -2.326 1.00 . A A . 51 HIS C 1 1 4 2131 1 1 30 HIS CA C 10.928 0.525 -3.119 1.00 . A A . 51 HIS CA 1 1 4 2132 1 1 30 HIS CB C 10.623 1.783 -2.284 1.00 . A A . 51 HIS CB 1 1 4 2133 1 1 30 HIS CD2 C 9.104 1.498 -0.246 1.00 . A A . 51 HIS CD2 1 1 4 2134 1 1 30 HIS CE1 C 7.142 1.341 -1.219 1.00 . A A . 51 HIS CE1 1 1 4 2135 1 1 30 HIS CG C 9.283 1.727 -1.583 1.00 . A A . 51 HIS CG 1 1 4 2136 1 1 30 HIS H H 9.665 1.456 -4.569 1.00 . A A . 51 HIS H 1 1 4 2137 1 1 30 HIS HA H 12.005 0.481 -3.292 1.00 . A A . 51 HIS HA 1 1 4 2138 1 1 30 HIS HB2 H 11.398 1.878 -1.520 1.00 . A A . 51 HIS HB2 1 1 4 2139 1 1 30 HIS HB3 H 10.678 2.674 -2.910 1.00 . A A . 51 HIS HB3 1 1 4 2140 1 1 30 HIS HD1 H 7.808 1.752 -3.159 1.00 . A A . 51 HIS HD1 1 1 4 2141 1 1 30 HIS HD2 H 9.893 1.426 0.492 1.00 . A A . 51 HIS HD2 1 1 4 2142 1 1 30 HIS HE1 H 6.088 1.171 -1.389 1.00 . A A . 51 HIS HE1 1 1 4 2143 1 1 30 HIS N N 10.254 0.652 -4.422 1.00 . A A . 51 HIS N 1 1 4 2144 1 1 30 HIS ND1 N 8.037 1.636 -2.173 1.00 . A A . 51 HIS ND1 1 1 4 2145 1 1 30 HIS NE2 N 7.745 1.252 -0.025 1.00 . A A . 51 HIS NE2 1 1 4 2146 1 1 30 HIS O O 11.302 -1.250 -1.514 1.00 . A A . 51 HIS O 1 1 4 2147 1 1 31 PHE C C 9.373 -3.566 -1.662 1.00 . A A . 52 PHE C 1 1 4 2148 1 1 31 PHE CA C 8.641 -2.219 -1.674 1.00 . A A . 52 PHE CA 1 1 4 2149 1 1 31 PHE CB C 7.169 -2.356 -2.095 1.00 . A A . 52 PHE CB 1 1 4 2150 1 1 31 PHE CD1 C 6.923 -3.769 -4.192 1.00 . A A . 52 PHE CD1 1 1 4 2151 1 1 31 PHE CD2 C 6.671 -1.355 -4.371 1.00 . A A . 52 PHE CD2 1 1 4 2152 1 1 31 PHE CE1 C 6.698 -3.894 -5.575 1.00 . A A . 52 PHE CE1 1 1 4 2153 1 1 31 PHE CE2 C 6.432 -1.481 -5.749 1.00 . A A . 52 PHE CE2 1 1 4 2154 1 1 31 PHE CG C 6.916 -2.499 -3.586 1.00 . A A . 52 PHE CG 1 1 4 2155 1 1 31 PHE CZ C 6.454 -2.749 -6.355 1.00 . A A . 52 PHE CZ 1 1 4 2156 1 1 31 PHE H H 8.735 -0.773 -3.230 1.00 . A A . 52 PHE H 1 1 4 2157 1 1 31 PHE HA H 8.653 -1.848 -0.650 1.00 . A A . 52 PHE HA 1 1 4 2158 1 1 31 PHE HB2 H 6.733 -3.210 -1.579 1.00 . A A . 52 PHE HB2 1 1 4 2159 1 1 31 PHE HB3 H 6.633 -1.474 -1.742 1.00 . A A . 52 PHE HB3 1 1 4 2160 1 1 31 PHE HD1 H 7.107 -4.655 -3.601 1.00 . A A . 52 PHE HD1 1 1 4 2161 1 1 31 PHE HD2 H 6.633 -0.376 -3.914 1.00 . A A . 52 PHE HD2 1 1 4 2162 1 1 31 PHE HE1 H 6.714 -4.870 -6.039 1.00 . A A . 52 PHE HE1 1 1 4 2163 1 1 31 PHE HE2 H 6.220 -0.602 -6.342 1.00 . A A . 52 PHE HE2 1 1 4 2164 1 1 31 PHE HZ H 6.274 -2.844 -7.418 1.00 . A A . 52 PHE HZ 1 1 4 2165 1 1 31 PHE N N 9.299 -1.226 -2.528 1.00 . A A . 52 PHE N 1 1 4 2166 1 1 31 PHE O O 9.594 -4.124 -0.589 1.00 . A A . 52 PHE O 1 1 4 2167 1 1 32 SER C C 12.033 -5.209 -2.229 1.00 . A A . 53 SER C 1 1 4 2168 1 1 32 SER CA C 10.679 -5.248 -2.964 1.00 . A A . 53 SER CA 1 1 4 2169 1 1 32 SER CB C 10.934 -5.518 -4.454 1.00 . A A . 53 SER CB 1 1 4 2170 1 1 32 SER H H 9.627 -3.530 -3.663 1.00 . A A . 53 SER H 1 1 4 2171 1 1 32 SER HA H 10.117 -6.090 -2.559 1.00 . A A . 53 SER HA 1 1 4 2172 1 1 32 SER HB2 H 11.541 -4.709 -4.867 1.00 . A A . 53 SER HB2 1 1 4 2173 1 1 32 SER HB3 H 11.478 -6.458 -4.565 1.00 . A A . 53 SER HB3 1 1 4 2174 1 1 32 SER HG H 9.912 -5.787 -6.103 1.00 . A A . 53 SER HG 1 1 4 2175 1 1 32 SER N N 9.863 -4.030 -2.815 1.00 . A A . 53 SER N 1 1 4 2176 1 1 32 SER O O 12.764 -6.204 -2.235 1.00 . A A . 53 SER O 1 1 4 2177 1 1 32 SER OG O 9.710 -5.601 -5.166 1.00 . A A . 53 SER OG 1 1 4 2178 1 1 33 LYS C C 13.490 -3.208 0.469 1.00 . A A . 54 LYS C 1 1 4 2179 1 1 33 LYS CA C 13.666 -3.788 -0.948 1.00 . A A . 54 LYS CA 1 1 4 2180 1 1 33 LYS CB C 14.509 -2.846 -1.835 1.00 . A A . 54 LYS CB 1 1 4 2181 1 1 33 LYS CD C 15.616 -2.430 -4.083 1.00 . A A . 54 LYS CD 1 1 4 2182 1 1 33 LYS CE C 15.727 -2.944 -5.523 1.00 . A A . 54 LYS CE 1 1 4 2183 1 1 33 LYS CG C 14.718 -3.370 -3.268 1.00 . A A . 54 LYS CG 1 1 4 2184 1 1 33 LYS H H 11.741 -3.290 -1.701 1.00 . A A . 54 LYS H 1 1 4 2185 1 1 33 LYS HA H 14.214 -4.724 -0.821 1.00 . A A . 54 LYS HA 1 1 4 2186 1 1 33 LYS HB2 H 14.021 -1.871 -1.884 1.00 . A A . 54 LYS HB2 1 1 4 2187 1 1 33 LYS HB3 H 15.488 -2.712 -1.371 1.00 . A A . 54 LYS HB3 1 1 4 2188 1 1 33 LYS HD2 H 15.182 -1.429 -4.086 1.00 . A A . 54 LYS HD2 1 1 4 2189 1 1 33 LYS HD3 H 16.607 -2.391 -3.626 1.00 . A A . 54 LYS HD3 1 1 4 2190 1 1 33 LYS HE2 H 16.133 -3.961 -5.504 1.00 . A A . 54 LYS HE2 1 1 4 2191 1 1 33 LYS HE3 H 14.723 -2.995 -5.956 1.00 . A A . 54 LYS HE3 1 1 4 2192 1 1 33 LYS HG2 H 15.175 -4.359 -3.226 1.00 . A A . 54 LYS HG2 1 1 4 2193 1 1 33 LYS HG3 H 13.756 -3.445 -3.774 1.00 . A A . 54 LYS HG3 1 1 4 2194 1 1 33 LYS HZ1 H 16.230 -1.125 -6.396 1.00 . A A . 54 LYS HZ1 1 1 4 2195 1 1 33 LYS HZ2 H 17.533 -2.024 -5.985 1.00 . A A . 54 LYS HZ2 1 1 4 2196 1 1 33 LYS HZ3 H 16.653 -2.413 -7.303 1.00 . A A . 54 LYS HZ3 1 1 4 2197 1 1 33 LYS N N 12.386 -4.066 -1.619 1.00 . A A . 54 LYS N 1 1 4 2198 1 1 33 LYS NZ N 16.592 -2.068 -6.354 1.00 . A A . 54 LYS NZ 1 1 4 2199 1 1 33 LYS O O 14.489 -2.872 1.110 1.00 . A A . 54 LYS O 1 1 4 2200 1 1 34 GLN C C 10.636 -3.141 2.891 1.00 . A A . 55 GLN C 1 1 4 2201 1 1 34 GLN CA C 11.952 -2.576 2.314 1.00 . A A . 55 GLN CA 1 1 4 2202 1 1 34 GLN CB C 11.922 -1.034 2.266 1.00 . A A . 55 GLN CB 1 1 4 2203 1 1 34 GLN CD C 11.691 1.122 3.576 1.00 . A A . 55 GLN CD 1 1 4 2204 1 1 34 GLN CG C 11.783 -0.401 3.660 1.00 . A A . 55 GLN CG 1 1 4 2205 1 1 34 GLN H H 11.490 -3.440 0.408 1.00 . A A . 55 GLN H 1 1 4 2206 1 1 34 GLN HA H 12.754 -2.878 2.991 1.00 . A A . 55 GLN HA 1 1 4 2207 1 1 34 GLN HB2 H 12.849 -0.671 1.820 1.00 . A A . 55 GLN HB2 1 1 4 2208 1 1 34 GLN HB3 H 11.096 -0.703 1.635 1.00 . A A . 55 GLN HB3 1 1 4 2209 1 1 34 GLN HE21 H 9.676 1.077 3.458 1.00 . A A . 55 GLN HE21 1 1 4 2210 1 1 34 GLN HE22 H 10.422 2.673 3.427 1.00 . A A . 55 GLN HE22 1 1 4 2211 1 1 34 GLN HG2 H 10.888 -0.778 4.154 1.00 . A A . 55 GLN HG2 1 1 4 2212 1 1 34 GLN HG3 H 12.647 -0.672 4.267 1.00 . A A . 55 GLN HG3 1 1 4 2213 1 1 34 GLN N N 12.252 -3.084 0.967 1.00 . A A . 55 GLN N 1 1 4 2214 1 1 34 GLN NE2 N 10.500 1.670 3.480 1.00 . A A . 55 GLN NE2 1 1 4 2215 1 1 34 GLN O O 10.661 -3.853 3.897 1.00 . A A . 55 GLN O 1 1 4 2216 1 1 34 GLN OE1 O 12.684 1.839 3.589 1.00 . A A . 55 GLN OE1 1 1 4 2217 1 1 35 CYS C C 7.494 -4.358 2.533 1.00 . A A . 56 CYS C 1 1 4 2218 1 1 35 CYS CA C 8.160 -3.003 2.858 1.00 . A A . 56 CYS CA 1 1 4 2219 1 1 35 CYS CB C 7.278 -1.835 2.390 1.00 . A A . 56 CYS CB 1 1 4 2220 1 1 35 CYS H H 9.555 -2.211 1.470 1.00 . A A . 56 CYS H 1 1 4 2221 1 1 35 CYS HA H 8.246 -2.939 3.944 1.00 . A A . 56 CYS HA 1 1 4 2222 1 1 35 CYS HB2 H 7.174 -1.859 1.301 1.00 . A A . 56 CYS HB2 1 1 4 2223 1 1 35 CYS HB3 H 6.284 -1.941 2.830 1.00 . A A . 56 CYS HB3 1 1 4 2224 1 1 35 CYS N N 9.495 -2.823 2.269 1.00 . A A . 56 CYS N 1 1 4 2225 1 1 35 CYS O O 6.517 -4.739 3.185 1.00 . A A . 56 CYS O 1 1 4 2226 1 1 35 CYS SG S 8.008 -0.262 2.922 1.00 . A A . 56 CYS SG 1 1 4 2227 1 1 36 ARG C C 8.452 -7.332 0.486 1.00 . A A . 57 ARG C 1 1 4 2228 1 1 36 ARG CA C 7.399 -6.304 0.951 1.00 . A A . 57 ARG CA 1 1 4 2229 1 1 36 ARG CB C 6.448 -5.896 -0.204 1.00 . A A . 57 ARG CB 1 1 4 2230 1 1 36 ARG CD C 3.927 -6.013 0.298 1.00 . A A . 57 ARG CD 1 1 4 2231 1 1 36 ARG CG C 5.163 -6.745 -0.254 1.00 . A A . 57 ARG CG 1 1 4 2232 1 1 36 ARG CZ C 3.353 -4.613 2.290 1.00 . A A . 57 ARG CZ 1 1 4 2233 1 1 36 ARG H H 8.766 -4.659 1.012 1.00 . A A . 57 ARG H 1 1 4 2234 1 1 36 ARG HA H 6.831 -6.802 1.737 1.00 . A A . 57 ARG HA 1 1 4 2235 1 1 36 ARG HB2 H 6.166 -4.847 -0.105 1.00 . A A . 57 ARG HB2 1 1 4 2236 1 1 36 ARG HB3 H 6.978 -5.986 -1.153 1.00 . A A . 57 ARG HB3 1 1 4 2237 1 1 36 ARG HD2 H 3.660 -5.220 -0.404 1.00 . A A . 57 ARG HD2 1 1 4 2238 1 1 36 ARG HD3 H 3.094 -6.717 0.350 1.00 . A A . 57 ARG HD3 1 1 4 2239 1 1 36 ARG HE H 5.077 -5.534 2.042 1.00 . A A . 57 ARG HE 1 1 4 2240 1 1 36 ARG HG2 H 4.957 -7.001 -1.295 1.00 . A A . 57 ARG HG2 1 1 4 2241 1 1 36 ARG HG3 H 5.304 -7.680 0.291 1.00 . A A . 57 ARG HG3 1 1 4 2242 1 1 36 ARG HH11 H 1.837 -4.708 0.995 1.00 . A A . 57 ARG HH11 1 1 4 2243 1 1 36 ARG HH12 H 1.646 -3.563 2.297 1.00 . A A . 57 ARG HH12 1 1 4 2244 1 1 36 ARG HH21 H 4.714 -4.225 3.690 1.00 . A A . 57 ARG HH21 1 1 4 2245 1 1 36 ARG HH22 H 3.140 -3.479 3.932 1.00 . A A . 57 ARG HH22 1 1 4 2246 1 1 36 ARG N N 7.992 -5.077 1.520 1.00 . A A . 57 ARG N 1 1 4 2247 1 1 36 ARG NE N 4.161 -5.419 1.630 1.00 . A A . 57 ARG NE 1 1 4 2248 1 1 36 ARG NH1 N 2.153 -4.334 1.883 1.00 . A A . 57 ARG NH1 1 1 4 2249 1 1 36 ARG NH2 N 3.762 -4.050 3.387 1.00 . A A . 57 ARG NH2 1 1 4 2250 1 1 36 ARG O O 8.125 -8.246 -0.277 1.00 . A A . 57 ARG O 1 1 4 2251 1 1 37 SER C C 10.652 -9.508 0.709 1.00 . A A . 58 SER C 1 1 4 2252 1 1 37 SER CA C 10.892 -7.993 0.606 1.00 . A A . 58 SER CA 1 1 4 2253 1 1 37 SER CB C 12.057 -7.605 1.519 1.00 . A A . 58 SER CB 1 1 4 2254 1 1 37 SER H H 9.874 -6.374 1.525 1.00 . A A . 58 SER H 1 1 4 2255 1 1 37 SER HA H 11.194 -7.785 -0.420 1.00 . A A . 58 SER HA 1 1 4 2256 1 1 37 SER HB2 H 11.822 -7.886 2.549 1.00 . A A . 58 SER HB2 1 1 4 2257 1 1 37 SER HB3 H 12.953 -8.147 1.208 1.00 . A A . 58 SER HB3 1 1 4 2258 1 1 37 SER HG H 13.018 -5.981 2.054 1.00 . A A . 58 SER HG 1 1 4 2259 1 1 37 SER N N 9.708 -7.165 0.922 1.00 . A A . 58 SER N 1 1 4 2260 1 1 37 SER O O 10.142 -9.973 1.754 1.00 . A A . 58 SER O 1 1 4 2261 1 1 37 SER OXT O 11.016 -10.231 -0.247 1.00 . A A . 58 SER OXT 1 1 4 2262 1 1 37 SER OG O 12.287 -6.205 1.445 1.00 . A A . 58 SER OG 1 1 4 2263 2 2 1 ZN ZN ZN -8.273 0.531 3.751 1.00 . B A . 1059 ZN ZN 1 1 4 2264 3 2 1 ZN ZN ZN 6.921 1.265 1.864 1.00 . C A . 1060 ZN ZN 1 1 5 2265 1 1 1 GLN C C -6.378 -1.516 -4.525 1.00 . A A . 22 GLN C 1 1 5 2266 1 1 1 GLN CA C -6.224 -1.063 -5.976 1.00 . A A . 22 GLN CA 1 1 5 2267 1 1 1 GLN CB C -4.787 -0.574 -6.270 1.00 . A A . 22 GLN CB 1 1 5 2268 1 1 1 GLN CD C -3.830 -2.854 -6.945 1.00 . A A . 22 GLN CD 1 1 5 2269 1 1 1 GLN CG C -3.681 -1.625 -6.052 1.00 . A A . 22 GLN CG 1 1 5 2270 1 1 1 GLN H1 H -8.160 -0.367 -6.125 1.00 . A A . 22 GLN H1 1 1 5 2271 1 1 1 GLN H2 H -7.095 0.784 -5.659 1.00 . A A . 22 GLN H2 1 1 5 2272 1 1 1 GLN H3 H -7.147 0.300 -7.234 1.00 . A A . 22 GLN H3 1 1 5 2273 1 1 1 GLN HA H -6.435 -1.919 -6.616 1.00 . A A . 22 GLN HA 1 1 5 2274 1 1 1 GLN HB2 H -4.735 -0.241 -7.308 1.00 . A A . 22 GLN HB2 1 1 5 2275 1 1 1 GLN HB3 H -4.568 0.287 -5.637 1.00 . A A . 22 GLN HB3 1 1 5 2276 1 1 1 GLN HE21 H -2.069 -2.552 -7.898 1.00 . A A . 22 GLN HE21 1 1 5 2277 1 1 1 GLN HE22 H -3.007 -3.955 -8.394 1.00 . A A . 22 GLN HE22 1 1 5 2278 1 1 1 GLN HG2 H -2.718 -1.151 -6.247 1.00 . A A . 22 GLN HG2 1 1 5 2279 1 1 1 GLN HG3 H -3.677 -1.953 -5.013 1.00 . A A . 22 GLN HG3 1 1 5 2280 1 1 1 GLN N N -7.226 -0.009 -6.277 1.00 . A A . 22 GLN N 1 1 5 2281 1 1 1 GLN NE2 N -2.887 -3.138 -7.815 1.00 . A A . 22 GLN NE2 1 1 5 2282 1 1 1 GLN O O -6.507 -0.676 -3.640 1.00 . A A . 22 GLN O 1 1 5 2283 1 1 1 GLN OE1 O -4.808 -3.584 -6.872 1.00 . A A . 22 GLN OE1 1 1 5 2284 1 1 2 THR C C -5.864 -2.842 -1.804 1.00 . A A . 23 THR C 1 1 5 2285 1 1 2 THR CA C -6.687 -3.435 -2.954 1.00 . A A . 23 THR CA 1 1 5 2286 1 1 2 THR CB C -6.493 -4.959 -3.017 1.00 . A A . 23 THR CB 1 1 5 2287 1 1 2 THR CG2 C -7.036 -5.688 -1.787 1.00 . A A . 23 THR CG2 1 1 5 2288 1 1 2 THR H H -6.266 -3.475 -5.041 1.00 . A A . 23 THR H 1 1 5 2289 1 1 2 THR HA H -7.734 -3.247 -2.733 1.00 . A A . 23 THR HA 1 1 5 2290 1 1 2 THR HB H -5.433 -5.185 -3.136 1.00 . A A . 23 THR HB 1 1 5 2291 1 1 2 THR HG1 H -6.976 -6.408 -4.225 1.00 . A A . 23 THR HG1 1 1 5 2292 1 1 2 THR HG21 H -8.094 -5.461 -1.658 1.00 . A A . 23 THR HG21 1 1 5 2293 1 1 2 THR HG22 H -6.917 -6.765 -1.918 1.00 . A A . 23 THR HG22 1 1 5 2294 1 1 2 THR HG23 H -6.483 -5.391 -0.896 1.00 . A A . 23 THR HG23 1 1 5 2295 1 1 2 THR N N -6.393 -2.829 -4.270 1.00 . A A . 23 THR N 1 1 5 2296 1 1 2 THR O O -4.653 -2.657 -1.931 1.00 . A A . 23 THR O 1 1 5 2297 1 1 2 THR OG1 O -7.203 -5.466 -4.130 1.00 . A A . 23 THR OG1 1 1 5 2298 1 1 3 CYS C C -4.795 -2.840 1.146 1.00 . A A . 24 CYS C 1 1 5 2299 1 1 3 CYS CA C -5.945 -2.003 0.547 1.00 . A A . 24 CYS CA 1 1 5 2300 1 1 3 CYS CB C -7.085 -1.891 1.563 1.00 . A A . 24 CYS CB 1 1 5 2301 1 1 3 CYS H H -7.527 -2.699 -0.683 1.00 . A A . 24 CYS H 1 1 5 2302 1 1 3 CYS HA H -5.576 -1.000 0.321 1.00 . A A . 24 CYS HA 1 1 5 2303 1 1 3 CYS HB2 H -7.966 -1.476 1.078 1.00 . A A . 24 CYS HB2 1 1 5 2304 1 1 3 CYS HB3 H -7.337 -2.887 1.928 1.00 . A A . 24 CYS HB3 1 1 5 2305 1 1 3 CYS N N -6.526 -2.564 -0.675 1.00 . A A . 24 CYS N 1 1 5 2306 1 1 3 CYS O O -4.800 -4.072 1.073 1.00 . A A . 24 CYS O 1 1 5 2307 1 1 3 CYS SG S -6.591 -0.821 2.935 1.00 . A A . 24 CYS SG 1 1 5 2308 1 1 4 TYR C C -3.484 -3.482 3.978 1.00 . A A . 25 TYR C 1 1 5 2309 1 1 4 TYR CA C -2.881 -2.814 2.723 1.00 . A A . 25 TYR CA 1 1 5 2310 1 1 4 TYR CB C -1.799 -1.800 3.130 1.00 . A A . 25 TYR CB 1 1 5 2311 1 1 4 TYR CD1 C -3.220 -0.055 4.337 1.00 . A A . 25 TYR CD1 1 1 5 2312 1 1 4 TYR CD2 C -1.299 -1.007 5.490 1.00 . A A . 25 TYR CD2 1 1 5 2313 1 1 4 TYR CE1 C -3.517 0.719 5.472 1.00 . A A . 25 TYR CE1 1 1 5 2314 1 1 4 TYR CE2 C -1.582 -0.218 6.622 1.00 . A A . 25 TYR CE2 1 1 5 2315 1 1 4 TYR CG C -2.112 -0.927 4.340 1.00 . A A . 25 TYR CG 1 1 5 2316 1 1 4 TYR CZ C -2.696 0.647 6.616 1.00 . A A . 25 TYR CZ 1 1 5 2317 1 1 4 TYR H H -3.938 -1.163 1.864 1.00 . A A . 25 TYR H 1 1 5 2318 1 1 4 TYR HA H -2.398 -3.608 2.155 1.00 . A A . 25 TYR HA 1 1 5 2319 1 1 4 TYR HB2 H -0.903 -2.377 3.359 1.00 . A A . 25 TYR HB2 1 1 5 2320 1 1 4 TYR HB3 H -1.554 -1.159 2.284 1.00 . A A . 25 TYR HB3 1 1 5 2321 1 1 4 TYR HD1 H -3.858 0.016 3.470 1.00 . A A . 25 TYR HD1 1 1 5 2322 1 1 4 TYR HD2 H -0.452 -1.681 5.506 1.00 . A A . 25 TYR HD2 1 1 5 2323 1 1 4 TYR HE1 H -4.385 1.355 5.478 1.00 . A A . 25 TYR HE1 1 1 5 2324 1 1 4 TYR HE2 H -0.952 -0.282 7.498 1.00 . A A . 25 TYR HE2 1 1 5 2325 1 1 4 TYR HH H -2.378 1.250 8.440 1.00 . A A . 25 TYR HH 1 1 5 2326 1 1 4 TYR N N -3.867 -2.172 1.839 1.00 . A A . 25 TYR N 1 1 5 2327 1 1 4 TYR O O -2.808 -4.278 4.632 1.00 . A A . 25 TYR O 1 1 5 2328 1 1 4 TYR OH O -2.998 1.406 7.706 1.00 . A A . 25 TYR OH 1 1 5 2329 1 1 5 ASN C C -6.817 -4.061 5.407 1.00 . A A . 26 ASN C 1 1 5 2330 1 1 5 ASN CA C -5.382 -3.529 5.586 1.00 . A A . 26 ASN CA 1 1 5 2331 1 1 5 ASN CB C -5.364 -2.270 6.475 1.00 . A A . 26 ASN CB 1 1 5 2332 1 1 5 ASN CG C -6.128 -2.454 7.774 1.00 . A A . 26 ASN CG 1 1 5 2333 1 1 5 ASN H H -5.215 -2.490 3.730 1.00 . A A . 26 ASN H 1 1 5 2334 1 1 5 ASN HA H -4.810 -4.314 6.088 1.00 . A A . 26 ASN HA 1 1 5 2335 1 1 5 ASN HB2 H -4.331 -2.017 6.715 1.00 . A A . 26 ASN HB2 1 1 5 2336 1 1 5 ASN HB3 H -5.793 -1.427 5.931 1.00 . A A . 26 ASN HB3 1 1 5 2337 1 1 5 ASN HD21 H -7.830 -1.647 7.013 1.00 . A A . 26 ASN HD21 1 1 5 2338 1 1 5 ASN HD22 H -7.885 -2.169 8.691 1.00 . A A . 26 ASN HD22 1 1 5 2339 1 1 5 ASN N N -4.741 -3.166 4.317 1.00 . A A . 26 ASN N 1 1 5 2340 1 1 5 ASN ND2 N -7.377 -2.043 7.829 1.00 . A A . 26 ASN ND2 1 1 5 2341 1 1 5 ASN O O -7.171 -5.094 5.979 1.00 . A A . 26 ASN O 1 1 5 2342 1 1 5 ASN OD1 O -5.613 -2.975 8.755 1.00 . A A . 26 ASN OD1 1 1 5 2343 1 1 6 CYS C C -9.532 -4.705 3.612 1.00 . A A . 27 CYS C 1 1 5 2344 1 1 6 CYS CA C -9.089 -3.558 4.553 1.00 . A A . 27 CYS CA 1 1 5 2345 1 1 6 CYS CB C -9.722 -2.220 4.139 1.00 . A A . 27 CYS CB 1 1 5 2346 1 1 6 CYS H H -7.283 -2.514 4.199 1.00 . A A . 27 CYS H 1 1 5 2347 1 1 6 CYS HA H -9.450 -3.802 5.554 1.00 . A A . 27 CYS HA 1 1 5 2348 1 1 6 CYS HB2 H -9.446 -1.997 3.108 1.00 . A A . 27 CYS HB2 1 1 5 2349 1 1 6 CYS HB3 H -10.811 -2.316 4.184 1.00 . A A . 27 CYS HB3 1 1 5 2350 1 1 6 CYS N N -7.640 -3.361 4.623 1.00 . A A . 27 CYS N 1 1 5 2351 1 1 6 CYS O O -10.708 -5.075 3.603 1.00 . A A . 27 CYS O 1 1 5 2352 1 1 6 CYS SG S -9.191 -0.872 5.245 1.00 . A A . 27 CYS SG 1 1 5 2353 1 1 7 GLY C C -9.934 -6.042 0.788 1.00 . A A . 28 GLY C 1 1 5 2354 1 1 7 GLY CA C -8.879 -6.357 1.863 1.00 . A A . 28 GLY CA 1 1 5 2355 1 1 7 GLY H H -7.660 -4.938 2.900 1.00 . A A . 28 GLY H 1 1 5 2356 1 1 7 GLY HA2 H -9.210 -7.234 2.421 1.00 . A A . 28 GLY HA2 1 1 5 2357 1 1 7 GLY HA3 H -7.950 -6.609 1.352 1.00 . A A . 28 GLY HA3 1 1 5 2358 1 1 7 GLY N N -8.613 -5.260 2.808 1.00 . A A . 28 GLY N 1 1 5 2359 1 1 7 GLY O O -10.657 -6.942 0.353 1.00 . A A . 28 GLY O 1 1 5 2360 1 1 8 LYS C C -10.539 -3.529 -1.720 1.00 . A A . 29 LYS C 1 1 5 2361 1 1 8 LYS CA C -11.121 -4.228 -0.473 1.00 . A A . 29 LYS CA 1 1 5 2362 1 1 8 LYS CB C -11.960 -3.278 0.405 1.00 . A A . 29 LYS CB 1 1 5 2363 1 1 8 LYS CD C -14.321 -3.736 -0.470 1.00 . A A . 29 LYS CD 1 1 5 2364 1 1 8 LYS CE C -15.582 -3.067 -1.034 1.00 . A A . 29 LYS CE 1 1 5 2365 1 1 8 LYS CG C -13.213 -2.690 -0.268 1.00 . A A . 29 LYS CG 1 1 5 2366 1 1 8 LYS H H -9.395 -4.108 0.783 1.00 . A A . 29 LYS H 1 1 5 2367 1 1 8 LYS HA H -11.773 -5.044 -0.776 1.00 . A A . 29 LYS HA 1 1 5 2368 1 1 8 LYS HB2 H -12.274 -3.809 1.306 1.00 . A A . 29 LYS HB2 1 1 5 2369 1 1 8 LYS HB3 H -11.327 -2.454 0.730 1.00 . A A . 29 LYS HB3 1 1 5 2370 1 1 8 LYS HD2 H -13.982 -4.511 -1.157 1.00 . A A . 29 LYS HD2 1 1 5 2371 1 1 8 LYS HD3 H -14.557 -4.193 0.493 1.00 . A A . 29 LYS HD3 1 1 5 2372 1 1 8 LYS HE2 H -15.878 -2.255 -0.364 1.00 . A A . 29 LYS HE2 1 1 5 2373 1 1 8 LYS HE3 H -15.343 -2.628 -2.008 1.00 . A A . 29 LYS HE3 1 1 5 2374 1 1 8 LYS HG2 H -13.598 -1.899 0.375 1.00 . A A . 29 LYS HG2 1 1 5 2375 1 1 8 LYS HG3 H -12.947 -2.244 -1.227 1.00 . A A . 29 LYS HG3 1 1 5 2376 1 1 8 LYS HZ1 H -16.458 -4.795 -1.798 1.00 . A A . 29 LYS HZ1 1 1 5 2377 1 1 8 LYS HZ2 H -16.950 -4.439 -0.280 1.00 . A A . 29 LYS HZ2 1 1 5 2378 1 1 8 LYS HZ3 H -17.526 -3.588 -1.545 1.00 . A A . 29 LYS HZ3 1 1 5 2379 1 1 8 LYS N N -10.042 -4.769 0.374 1.00 . A A . 29 LYS N 1 1 5 2380 1 1 8 LYS NZ N -16.699 -4.037 -1.173 1.00 . A A . 29 LYS NZ 1 1 5 2381 1 1 8 LYS O O -9.810 -2.551 -1.546 1.00 . A A . 29 LYS O 1 1 5 2382 1 1 9 PRO C C -10.409 -1.942 -4.441 1.00 . A A . 30 PRO C 1 1 5 2383 1 1 9 PRO CA C -10.278 -3.457 -4.217 1.00 . A A . 30 PRO CA 1 1 5 2384 1 1 9 PRO CB C -10.993 -4.222 -5.336 1.00 . A A . 30 PRO CB 1 1 5 2385 1 1 9 PRO CD C -11.599 -5.203 -3.250 1.00 . A A . 30 PRO CD 1 1 5 2386 1 1 9 PRO CG C -11.292 -5.571 -4.698 1.00 . A A . 30 PRO CG 1 1 5 2387 1 1 9 PRO HA H -9.223 -3.716 -4.263 1.00 . A A . 30 PRO HA 1 1 5 2388 1 1 9 PRO HB2 H -11.934 -3.730 -5.593 1.00 . A A . 30 PRO HB2 1 1 5 2389 1 1 9 PRO HB3 H -10.363 -4.325 -6.221 1.00 . A A . 30 PRO HB3 1 1 5 2390 1 1 9 PRO HD2 H -12.664 -4.987 -3.146 1.00 . A A . 30 PRO HD2 1 1 5 2391 1 1 9 PRO HD3 H -11.315 -6.034 -2.602 1.00 . A A . 30 PRO HD3 1 1 5 2392 1 1 9 PRO HG2 H -12.137 -6.069 -5.177 1.00 . A A . 30 PRO HG2 1 1 5 2393 1 1 9 PRO HG3 H -10.401 -6.201 -4.735 1.00 . A A . 30 PRO HG3 1 1 5 2394 1 1 9 PRO N N -10.828 -3.996 -2.958 1.00 . A A . 30 PRO N 1 1 5 2395 1 1 9 PRO O O -9.527 -1.336 -5.054 1.00 . A A . 30 PRO O 1 1 5 2396 1 1 10 GLY C C -11.002 1.094 -3.298 1.00 . A A . 31 GLY C 1 1 5 2397 1 1 10 GLY CA C -11.821 0.100 -4.132 1.00 . A A . 31 GLY CA 1 1 5 2398 1 1 10 GLY H H -12.160 -1.890 -3.456 1.00 . A A . 31 GLY H 1 1 5 2399 1 1 10 GLY HA2 H -12.876 0.247 -3.899 1.00 . A A . 31 GLY HA2 1 1 5 2400 1 1 10 GLY HA3 H -11.674 0.351 -5.184 1.00 . A A . 31 GLY HA3 1 1 5 2401 1 1 10 GLY N N -11.479 -1.320 -3.935 1.00 . A A . 31 GLY N 1 1 5 2402 1 1 10 GLY O O -11.548 2.091 -2.817 1.00 . A A . 31 GLY O 1 1 5 2403 1 1 11 HIS C C -7.808 2.457 -3.154 1.00 . A A . 32 HIS C 1 1 5 2404 1 1 11 HIS CA C -8.800 1.651 -2.301 1.00 . A A . 32 HIS CA 1 1 5 2405 1 1 11 HIS CB C -8.092 0.784 -1.250 1.00 . A A . 32 HIS CB 1 1 5 2406 1 1 11 HIS CD2 C -8.581 1.319 1.203 1.00 . A A . 32 HIS CD2 1 1 5 2407 1 1 11 HIS CE1 C -10.380 0.103 1.522 1.00 . A A . 32 HIS CE1 1 1 5 2408 1 1 11 HIS CG C -8.874 0.686 0.029 1.00 . A A . 32 HIS CG 1 1 5 2409 1 1 11 HIS H H -9.331 -0.004 -3.533 1.00 . A A . 32 HIS H 1 1 5 2410 1 1 11 HIS HA H -9.388 2.390 -1.759 1.00 . A A . 32 HIS HA 1 1 5 2411 1 1 11 HIS HB2 H -7.934 -0.222 -1.634 1.00 . A A . 32 HIS HB2 1 1 5 2412 1 1 11 HIS HB3 H -7.113 1.207 -1.018 1.00 . A A . 32 HIS HB3 1 1 5 2413 1 1 11 HIS HD1 H -10.418 -0.705 -0.429 1.00 . A A . 32 HIS HD1 1 1 5 2414 1 1 11 HIS HD2 H -7.756 1.996 1.355 1.00 . A A . 32 HIS HD2 1 1 5 2415 1 1 11 HIS HE1 H -11.235 -0.377 1.987 1.00 . A A . 32 HIS HE1 1 1 5 2416 1 1 11 HIS N N -9.711 0.824 -3.093 1.00 . A A . 32 HIS N 1 1 5 2417 1 1 11 HIS ND1 N -10.000 -0.070 0.243 1.00 . A A . 32 HIS ND1 1 1 5 2418 1 1 11 HIS NE2 N -9.525 0.925 2.161 1.00 . A A . 32 HIS NE2 1 1 5 2419 1 1 11 HIS O O -7.466 2.105 -4.286 1.00 . A A . 32 HIS O 1 1 5 2420 1 1 12 LEU C C -5.845 5.349 -1.904 1.00 . A A . 33 LEU C 1 1 5 2421 1 1 12 LEU CA C -6.519 4.637 -3.096 1.00 . A A . 33 LEU CA 1 1 5 2422 1 1 12 LEU CB C -7.394 5.666 -3.858 1.00 . A A . 33 LEU CB 1 1 5 2423 1 1 12 LEU CD1 C -8.941 6.314 -5.718 1.00 . A A . 33 LEU CD1 1 1 5 2424 1 1 12 LEU CD2 C -7.013 4.853 -6.241 1.00 . A A . 33 LEU CD2 1 1 5 2425 1 1 12 LEU CG C -8.049 5.199 -5.171 1.00 . A A . 33 LEU CG 1 1 5 2426 1 1 12 LEU H H -7.673 3.720 -1.610 1.00 . A A . 33 LEU H 1 1 5 2427 1 1 12 LEU HA H -5.747 4.224 -3.746 1.00 . A A . 33 LEU HA 1 1 5 2428 1 1 12 LEU HB2 H -8.184 6.003 -3.183 1.00 . A A . 33 LEU HB2 1 1 5 2429 1 1 12 LEU HB3 H -6.781 6.538 -4.097 1.00 . A A . 33 LEU HB3 1 1 5 2430 1 1 12 LEU HD11 H -9.713 6.559 -4.987 1.00 . A A . 33 LEU HD11 1 1 5 2431 1 1 12 LEU HD12 H -8.347 7.206 -5.925 1.00 . A A . 33 LEU HD12 1 1 5 2432 1 1 12 LEU HD13 H -9.426 5.983 -6.637 1.00 . A A . 33 LEU HD13 1 1 5 2433 1 1 12 LEU HD21 H -6.373 5.713 -6.437 1.00 . A A . 33 LEU HD21 1 1 5 2434 1 1 12 LEU HD22 H -6.401 4.014 -5.913 1.00 . A A . 33 LEU HD22 1 1 5 2435 1 1 12 LEU HD23 H -7.520 4.565 -7.163 1.00 . A A . 33 LEU HD23 1 1 5 2436 1 1 12 LEU HG H -8.683 4.333 -4.984 1.00 . A A . 33 LEU HG 1 1 5 2437 1 1 12 LEU N N -7.380 3.575 -2.566 1.00 . A A . 33 LEU N 1 1 5 2438 1 1 12 LEU O O -6.247 5.147 -0.754 1.00 . A A . 33 LEU O 1 1 5 2439 1 1 13 SER C C -5.493 8.075 -0.491 1.00 . A A . 34 SER C 1 1 5 2440 1 1 13 SER CA C -4.400 7.246 -1.192 1.00 . A A . 34 SER CA 1 1 5 2441 1 1 13 SER CB C -3.433 8.205 -1.892 1.00 . A A . 34 SER CB 1 1 5 2442 1 1 13 SER H H -4.586 6.355 -3.125 1.00 . A A . 34 SER H 1 1 5 2443 1 1 13 SER HA H -3.851 6.705 -0.421 1.00 . A A . 34 SER HA 1 1 5 2444 1 1 13 SER HB2 H -3.953 8.709 -2.710 1.00 . A A . 34 SER HB2 1 1 5 2445 1 1 13 SER HB3 H -3.083 8.960 -1.184 1.00 . A A . 34 SER HB3 1 1 5 2446 1 1 13 SER HG H -1.941 7.991 -3.143 1.00 . A A . 34 SER HG 1 1 5 2447 1 1 13 SER N N -4.919 6.273 -2.174 1.00 . A A . 34 SER N 1 1 5 2448 1 1 13 SER O O -5.299 8.543 0.632 1.00 . A A . 34 SER O 1 1 5 2449 1 1 13 SER OG O -2.322 7.483 -2.398 1.00 . A A . 34 SER OG 1 1 5 2450 1 1 14 SER C C -8.764 7.980 0.245 1.00 . A A . 35 SER C 1 1 5 2451 1 1 14 SER CA C -7.855 8.904 -0.592 1.00 . A A . 35 SER CA 1 1 5 2452 1 1 14 SER CB C -8.669 9.512 -1.744 1.00 . A A . 35 SER CB 1 1 5 2453 1 1 14 SER H H -6.711 7.901 -2.084 1.00 . A A . 35 SER H 1 1 5 2454 1 1 14 SER HA H -7.538 9.719 0.058 1.00 . A A . 35 SER HA 1 1 5 2455 1 1 14 SER HB2 H -9.072 8.710 -2.367 1.00 . A A . 35 SER HB2 1 1 5 2456 1 1 14 SER HB3 H -9.500 10.090 -1.335 1.00 . A A . 35 SER HB3 1 1 5 2457 1 1 14 SER HG H -8.419 10.778 -3.225 1.00 . A A . 35 SER HG 1 1 5 2458 1 1 14 SER N N -6.657 8.235 -1.133 1.00 . A A . 35 SER N 1 1 5 2459 1 1 14 SER O O -9.836 8.408 0.675 1.00 . A A . 35 SER O 1 1 5 2460 1 1 14 SER OG O -7.855 10.364 -2.541 1.00 . A A . 35 SER OG 1 1 5 2461 1 1 15 GLN C C -8.399 5.091 2.369 1.00 . A A . 36 GLN C 1 1 5 2462 1 1 15 GLN CA C -9.154 5.690 1.162 1.00 . A A . 36 GLN CA 1 1 5 2463 1 1 15 GLN CB C -9.538 4.607 0.134 1.00 . A A . 36 GLN CB 1 1 5 2464 1 1 15 GLN CD C -12.081 4.506 0.096 1.00 . A A . 36 GLN CD 1 1 5 2465 1 1 15 GLN CG C -10.793 3.801 0.512 1.00 . A A . 36 GLN CG 1 1 5 2466 1 1 15 GLN H H -7.467 6.442 0.093 1.00 . A A . 36 GLN H 1 1 5 2467 1 1 15 GLN HA H -10.073 6.137 1.543 1.00 . A A . 36 GLN HA 1 1 5 2468 1 1 15 GLN HB2 H -9.711 5.065 -0.842 1.00 . A A . 36 GLN HB2 1 1 5 2469 1 1 15 GLN HB3 H -8.699 3.921 0.027 1.00 . A A . 36 GLN HB3 1 1 5 2470 1 1 15 GLN HE21 H -12.202 3.487 -1.661 1.00 . A A . 36 GLN HE21 1 1 5 2471 1 1 15 GLN HE22 H -13.472 4.664 -1.339 1.00 . A A . 36 GLN HE22 1 1 5 2472 1 1 15 GLN HG2 H -10.759 2.839 0.004 1.00 . A A . 36 GLN HG2 1 1 5 2473 1 1 15 GLN HG3 H -10.807 3.607 1.585 1.00 . A A . 36 GLN HG3 1 1 5 2474 1 1 15 GLN N N -8.361 6.723 0.476 1.00 . A A . 36 GLN N 1 1 5 2475 1 1 15 GLN NE2 N -12.622 4.197 -1.064 1.00 . A A . 36 GLN NE2 1 1 5 2476 1 1 15 GLN O O -8.977 5.002 3.453 1.00 . A A . 36 GLN O 1 1 5 2477 1 1 15 GLN OE1 O -12.621 5.349 0.802 1.00 . A A . 36 GLN OE1 1 1 5 2478 1 1 16 CYS C C -4.736 5.008 2.960 1.00 . A A . 37 CYS C 1 1 5 2479 1 1 16 CYS CA C -6.139 4.431 3.259 1.00 . A A . 37 CYS CA 1 1 5 2480 1 1 16 CYS CB C -6.062 2.900 3.433 1.00 . A A . 37 CYS CB 1 1 5 2481 1 1 16 CYS H H -6.706 4.918 1.277 1.00 . A A . 37 CYS H 1 1 5 2482 1 1 16 CYS HA H -6.468 4.873 4.197 1.00 . A A . 37 CYS HA 1 1 5 2483 1 1 16 CYS HB2 H -6.064 2.409 2.460 1.00 . A A . 37 CYS HB2 1 1 5 2484 1 1 16 CYS HB3 H -5.115 2.636 3.903 1.00 . A A . 37 CYS HB3 1 1 5 2485 1 1 16 CYS N N -7.101 4.785 2.203 1.00 . A A . 37 CYS N 1 1 5 2486 1 1 16 CYS O O -4.492 5.560 1.884 1.00 . A A . 37 CYS O 1 1 5 2487 1 1 16 CYS SG S -7.395 2.284 4.500 1.00 . A A . 37 CYS SG 1 1 5 2488 1 1 17 ARG C C -1.707 4.747 2.520 1.00 . A A . 38 ARG C 1 1 5 2489 1 1 17 ARG CA C -2.395 5.285 3.783 1.00 . A A . 38 ARG CA 1 1 5 2490 1 1 17 ARG CB C -1.579 4.883 5.027 1.00 . A A . 38 ARG CB 1 1 5 2491 1 1 17 ARG CD C -2.899 4.978 7.266 1.00 . A A . 38 ARG CD 1 1 5 2492 1 1 17 ARG CG C -1.886 5.654 6.327 1.00 . A A . 38 ARG CG 1 1 5 2493 1 1 17 ARG CZ C -5.357 4.536 6.988 1.00 . A A . 38 ARG CZ 1 1 5 2494 1 1 17 ARG H H -4.079 4.392 4.764 1.00 . A A . 38 ARG H 1 1 5 2495 1 1 17 ARG HA H -2.373 6.373 3.692 1.00 . A A . 38 ARG HA 1 1 5 2496 1 1 17 ARG HB2 H -1.671 3.810 5.201 1.00 . A A . 38 ARG HB2 1 1 5 2497 1 1 17 ARG HB3 H -0.530 5.079 4.796 1.00 . A A . 38 ARG HB3 1 1 5 2498 1 1 17 ARG HD2 H -2.741 3.901 7.236 1.00 . A A . 38 ARG HD2 1 1 5 2499 1 1 17 ARG HD3 H -2.685 5.308 8.285 1.00 . A A . 38 ARG HD3 1 1 5 2500 1 1 17 ARG HE H -4.490 6.311 6.807 1.00 . A A . 38 ARG HE 1 1 5 2501 1 1 17 ARG HG2 H -0.948 5.719 6.882 1.00 . A A . 38 ARG HG2 1 1 5 2502 1 1 17 ARG HG3 H -2.198 6.673 6.102 1.00 . A A . 38 ARG HG3 1 1 5 2503 1 1 17 ARG HH11 H -4.379 2.831 7.420 1.00 . A A . 38 ARG HH11 1 1 5 2504 1 1 17 ARG HH12 H -6.096 2.685 7.149 1.00 . A A . 38 ARG HH12 1 1 5 2505 1 1 17 ARG HH21 H -6.679 6.005 6.627 1.00 . A A . 38 ARG HH21 1 1 5 2506 1 1 17 ARG HH22 H -7.329 4.393 6.684 1.00 . A A . 38 ARG HH22 1 1 5 2507 1 1 17 ARG N N -3.799 4.847 3.907 1.00 . A A . 38 ARG N 1 1 5 2508 1 1 17 ARG NE N -4.301 5.332 6.965 1.00 . A A . 38 ARG NE 1 1 5 2509 1 1 17 ARG NH1 N -5.270 3.255 7.198 1.00 . A A . 38 ARG NH1 1 1 5 2510 1 1 17 ARG NH2 N -6.542 5.018 6.766 1.00 . A A . 38 ARG NH2 1 1 5 2511 1 1 17 ARG O O -0.984 5.499 1.866 1.00 . A A . 38 ARG O 1 1 5 2512 1 1 18 ALA C C -2.283 1.639 0.488 1.00 . A A . 39 ALA C 1 1 5 2513 1 1 18 ALA CA C -1.429 2.849 0.943 1.00 . A A . 39 ALA CA 1 1 5 2514 1 1 18 ALA CB C 0.006 2.379 1.240 1.00 . A A . 39 ALA CB 1 1 5 2515 1 1 18 ALA H H -2.563 2.936 2.742 1.00 . A A . 39 ALA H 1 1 5 2516 1 1 18 ALA HA H -1.406 3.587 0.140 1.00 . A A . 39 ALA HA 1 1 5 2517 1 1 18 ALA HB1 H -0.017 1.631 2.032 1.00 . A A . 39 ALA HB1 1 1 5 2518 1 1 18 ALA HB2 H 0.446 1.929 0.352 1.00 . A A . 39 ALA HB2 1 1 5 2519 1 1 18 ALA HB3 H 0.624 3.220 1.551 1.00 . A A . 39 ALA HB3 1 1 5 2520 1 1 18 ALA N N -1.956 3.486 2.155 1.00 . A A . 39 ALA N 1 1 5 2521 1 1 18 ALA O O -2.980 1.033 1.307 1.00 . A A . 39 ALA O 1 1 5 2522 1 1 19 PRO C C -1.640 -1.196 -0.771 1.00 . A A . 40 PRO C 1 1 5 2523 1 1 19 PRO CA C -2.619 -0.098 -1.240 1.00 . A A . 40 PRO CA 1 1 5 2524 1 1 19 PRO CB C -2.666 0.009 -2.769 1.00 . A A . 40 PRO CB 1 1 5 2525 1 1 19 PRO CD C -1.596 1.971 -1.901 1.00 . A A . 40 PRO CD 1 1 5 2526 1 1 19 PRO CG C -1.555 1.007 -3.086 1.00 . A A . 40 PRO CG 1 1 5 2527 1 1 19 PRO HA H -3.616 -0.328 -0.864 1.00 . A A . 40 PRO HA 1 1 5 2528 1 1 19 PRO HB2 H -2.497 -0.949 -3.260 1.00 . A A . 40 PRO HB2 1 1 5 2529 1 1 19 PRO HB3 H -3.628 0.424 -3.071 1.00 . A A . 40 PRO HB3 1 1 5 2530 1 1 19 PRO HD2 H -0.586 2.310 -1.668 1.00 . A A . 40 PRO HD2 1 1 5 2531 1 1 19 PRO HD3 H -2.231 2.825 -2.145 1.00 . A A . 40 PRO HD3 1 1 5 2532 1 1 19 PRO HG2 H -0.595 0.494 -3.105 1.00 . A A . 40 PRO HG2 1 1 5 2533 1 1 19 PRO HG3 H -1.732 1.521 -4.031 1.00 . A A . 40 PRO HG3 1 1 5 2534 1 1 19 PRO N N -2.193 1.229 -0.794 1.00 . A A . 40 PRO N 1 1 5 2535 1 1 19 PRO O O -0.557 -0.908 -0.258 1.00 . A A . 40 PRO O 1 1 5 2536 1 1 20 LYS C C 0.216 -3.751 -1.139 1.00 . A A . 41 LYS C 1 1 5 2537 1 1 20 LYS CA C -1.240 -3.691 -0.642 1.00 . A A . 41 LYS CA 1 1 5 2538 1 1 20 LYS CB C -2.062 -4.912 -1.101 1.00 . A A . 41 LYS CB 1 1 5 2539 1 1 20 LYS CD C -2.614 -7.362 -0.770 1.00 . A A . 41 LYS CD 1 1 5 2540 1 1 20 LYS CE C -2.196 -8.646 -0.040 1.00 . A A . 41 LYS CE 1 1 5 2541 1 1 20 LYS CG C -1.671 -6.214 -0.384 1.00 . A A . 41 LYS CG 1 1 5 2542 1 1 20 LYS H H -2.905 -2.605 -1.437 1.00 . A A . 41 LYS H 1 1 5 2543 1 1 20 LYS HA H -1.170 -3.715 0.444 1.00 . A A . 41 LYS HA 1 1 5 2544 1 1 20 LYS HB2 H -3.116 -4.725 -0.890 1.00 . A A . 41 LYS HB2 1 1 5 2545 1 1 20 LYS HB3 H -1.955 -5.039 -2.179 1.00 . A A . 41 LYS HB3 1 1 5 2546 1 1 20 LYS HD2 H -3.636 -7.101 -0.493 1.00 . A A . 41 LYS HD2 1 1 5 2547 1 1 20 LYS HD3 H -2.564 -7.522 -1.849 1.00 . A A . 41 LYS HD3 1 1 5 2548 1 1 20 LYS HE2 H -1.156 -8.872 -0.296 1.00 . A A . 41 LYS HE2 1 1 5 2549 1 1 20 LYS HE3 H -2.243 -8.468 1.038 1.00 . A A . 41 LYS HE3 1 1 5 2550 1 1 20 LYS HG2 H -0.653 -6.493 -0.656 1.00 . A A . 41 LYS HG2 1 1 5 2551 1 1 20 LYS HG3 H -1.721 -6.059 0.695 1.00 . A A . 41 LYS HG3 1 1 5 2552 1 1 20 LYS HZ1 H -4.031 -9.616 -0.162 1.00 . A A . 41 LYS HZ1 1 1 5 2553 1 1 20 LYS HZ2 H -3.023 -9.991 -1.393 1.00 . A A . 41 LYS HZ2 1 1 5 2554 1 1 20 LYS HZ3 H -2.782 -10.632 0.086 1.00 . A A . 41 LYS HZ3 1 1 5 2555 1 1 20 LYS N N -1.992 -2.468 -1.009 1.00 . A A . 41 LYS N 1 1 5 2556 1 1 20 LYS NZ N -3.067 -9.794 -0.404 1.00 . A A . 41 LYS NZ 1 1 5 2557 1 1 20 LYS O O 1.011 -4.536 -0.627 1.00 . A A . 41 LYS O 1 1 5 2558 1 1 21 VAL C C 2.883 -2.225 -1.301 1.00 . A A . 42 VAL C 1 1 5 2559 1 1 21 VAL CA C 1.977 -2.600 -2.489 1.00 . A A . 42 VAL CA 1 1 5 2560 1 1 21 VAL CB C 1.983 -1.464 -3.538 1.00 . A A . 42 VAL CB 1 1 5 2561 1 1 21 VAL CG1 C 3.386 -1.150 -4.066 1.00 . A A . 42 VAL CG1 1 1 5 2562 1 1 21 VAL CG2 C 1.107 -1.804 -4.755 1.00 . A A . 42 VAL CG2 1 1 5 2563 1 1 21 VAL H H -0.137 -2.294 -2.455 1.00 . A A . 42 VAL H 1 1 5 2564 1 1 21 VAL HA H 2.394 -3.496 -2.952 1.00 . A A . 42 VAL HA 1 1 5 2565 1 1 21 VAL HB H 1.587 -0.559 -3.077 1.00 . A A . 42 VAL HB 1 1 5 2566 1 1 21 VAL HG11 H 3.835 -2.052 -4.482 1.00 . A A . 42 VAL HG11 1 1 5 2567 1 1 21 VAL HG12 H 3.334 -0.384 -4.839 1.00 . A A . 42 VAL HG12 1 1 5 2568 1 1 21 VAL HG13 H 4.015 -0.771 -3.262 1.00 . A A . 42 VAL HG13 1 1 5 2569 1 1 21 VAL HG21 H 1.456 -2.730 -5.217 1.00 . A A . 42 VAL HG21 1 1 5 2570 1 1 21 VAL HG22 H 0.064 -1.921 -4.463 1.00 . A A . 42 VAL HG22 1 1 5 2571 1 1 21 VAL HG23 H 1.161 -1.000 -5.488 1.00 . A A . 42 VAL HG23 1 1 5 2572 1 1 21 VAL N N 0.589 -2.881 -2.079 1.00 . A A . 42 VAL N 1 1 5 2573 1 1 21 VAL O O 4.054 -2.599 -1.287 1.00 . A A . 42 VAL O 1 1 5 2574 1 1 22 CYS C C 2.240 -0.816 2.087 1.00 . A A . 43 CYS C 1 1 5 2575 1 1 22 CYS CA C 3.101 -0.899 0.799 1.00 . A A . 43 CYS CA 1 1 5 2576 1 1 22 CYS CB C 3.584 0.471 0.280 1.00 . A A . 43 CYS CB 1 1 5 2577 1 1 22 CYS H H 1.358 -1.300 -0.345 1.00 . A A . 43 CYS H 1 1 5 2578 1 1 22 CYS HA H 3.977 -1.509 1.025 1.00 . A A . 43 CYS HA 1 1 5 2579 1 1 22 CYS HB2 H 4.013 0.334 -0.715 1.00 . A A . 43 CYS HB2 1 1 5 2580 1 1 22 CYS HB3 H 2.734 1.149 0.194 1.00 . A A . 43 CYS HB3 1 1 5 2581 1 1 22 CYS N N 2.349 -1.511 -0.302 1.00 . A A . 43 CYS N 1 1 5 2582 1 1 22 CYS O O 1.344 -1.631 2.312 1.00 . A A . 43 CYS O 1 1 5 2583 1 1 22 CYS SG S 4.858 1.185 1.356 1.00 . A A . 43 CYS SG 1 1 5 2584 1 1 23 PHE C C 1.727 2.110 4.295 1.00 . A A . 44 PHE C 1 1 5 2585 1 1 23 PHE CA C 1.756 0.576 4.109 1.00 . A A . 44 PHE CA 1 1 5 2586 1 1 23 PHE CB C 2.302 -0.110 5.373 1.00 . A A . 44 PHE CB 1 1 5 2587 1 1 23 PHE CD1 C 4.829 0.188 5.341 1.00 . A A . 44 PHE CD1 1 1 5 2588 1 1 23 PHE CD2 C 3.522 1.408 6.994 1.00 . A A . 44 PHE CD2 1 1 5 2589 1 1 23 PHE CE1 C 6.003 0.789 5.831 1.00 . A A . 44 PHE CE1 1 1 5 2590 1 1 23 PHE CE2 C 4.696 2.009 7.483 1.00 . A A . 44 PHE CE2 1 1 5 2591 1 1 23 PHE CG C 3.582 0.499 5.920 1.00 . A A . 44 PHE CG 1 1 5 2592 1 1 23 PHE CZ C 5.938 1.700 6.899 1.00 . A A . 44 PHE CZ 1 1 5 2593 1 1 23 PHE H H 3.351 0.701 2.689 1.00 . A A . 44 PHE H 1 1 5 2594 1 1 23 PHE HA H 0.724 0.253 3.968 1.00 . A A . 44 PHE HA 1 1 5 2595 1 1 23 PHE HB2 H 1.537 -0.050 6.147 1.00 . A A . 44 PHE HB2 1 1 5 2596 1 1 23 PHE HB3 H 2.465 -1.169 5.170 1.00 . A A . 44 PHE HB3 1 1 5 2597 1 1 23 PHE HD1 H 4.888 -0.510 4.517 1.00 . A A . 44 PHE HD1 1 1 5 2598 1 1 23 PHE HD2 H 2.569 1.658 7.441 1.00 . A A . 44 PHE HD2 1 1 5 2599 1 1 23 PHE HE1 H 6.959 0.549 5.386 1.00 . A A . 44 PHE HE1 1 1 5 2600 1 1 23 PHE HE2 H 4.645 2.709 8.306 1.00 . A A . 44 PHE HE2 1 1 5 2601 1 1 23 PHE HZ H 6.842 2.161 7.274 1.00 . A A . 44 PHE HZ 1 1 5 2602 1 1 23 PHE N N 2.538 0.158 2.943 1.00 . A A . 44 PHE N 1 1 5 2603 1 1 23 PHE O O 0.823 2.619 4.959 1.00 . A A . 44 PHE O 1 1 5 2604 1 1 24 LYS C C 3.573 4.980 2.676 1.00 . A A . 45 LYS C 1 1 5 2605 1 1 24 LYS CA C 2.798 4.320 3.827 1.00 . A A . 45 LYS CA 1 1 5 2606 1 1 24 LYS CB C 3.465 4.637 5.186 1.00 . A A . 45 LYS CB 1 1 5 2607 1 1 24 LYS CD C 2.342 6.913 5.601 1.00 . A A . 45 LYS CD 1 1 5 2608 1 1 24 LYS CE C 2.638 8.356 6.028 1.00 . A A . 45 LYS CE 1 1 5 2609 1 1 24 LYS CG C 3.659 6.132 5.498 1.00 . A A . 45 LYS CG 1 1 5 2610 1 1 24 LYS H H 3.392 2.367 3.170 1.00 . A A . 45 LYS H 1 1 5 2611 1 1 24 LYS HA H 1.796 4.749 3.817 1.00 . A A . 45 LYS HA 1 1 5 2612 1 1 24 LYS HB2 H 2.864 4.204 5.986 1.00 . A A . 45 LYS HB2 1 1 5 2613 1 1 24 LYS HB3 H 4.445 4.157 5.220 1.00 . A A . 45 LYS HB3 1 1 5 2614 1 1 24 LYS HD2 H 1.837 6.917 4.633 1.00 . A A . 45 LYS HD2 1 1 5 2615 1 1 24 LYS HD3 H 1.697 6.436 6.342 1.00 . A A . 45 LYS HD3 1 1 5 2616 1 1 24 LYS HE2 H 3.186 8.337 6.975 1.00 . A A . 45 LYS HE2 1 1 5 2617 1 1 24 LYS HE3 H 3.288 8.817 5.277 1.00 . A A . 45 LYS HE3 1 1 5 2618 1 1 24 LYS HG2 H 4.183 6.205 6.453 1.00 . A A . 45 LYS HG2 1 1 5 2619 1 1 24 LYS HG3 H 4.295 6.588 4.737 1.00 . A A . 45 LYS HG3 1 1 5 2620 1 1 24 LYS HZ1 H 0.876 9.204 5.315 1.00 . A A . 45 LYS HZ1 1 1 5 2621 1 1 24 LYS HZ2 H 0.790 8.764 6.892 1.00 . A A . 45 LYS HZ2 1 1 5 2622 1 1 24 LYS HZ3 H 1.609 10.106 6.459 1.00 . A A . 45 LYS HZ3 1 1 5 2623 1 1 24 LYS N N 2.685 2.853 3.706 1.00 . A A . 45 LYS N 1 1 5 2624 1 1 24 LYS NZ N 1.395 9.156 6.182 1.00 . A A . 45 LYS NZ 1 1 5 2625 1 1 24 LYS O O 3.029 5.864 2.014 1.00 . A A . 45 LYS O 1 1 5 2626 1 1 25 CYS C C 5.524 5.025 0.045 1.00 . A A . 46 CYS C 1 1 5 2627 1 1 25 CYS CA C 5.775 5.247 1.553 1.00 . A A . 46 CYS CA 1 1 5 2628 1 1 25 CYS CB C 7.210 4.881 1.987 1.00 . A A . 46 CYS CB 1 1 5 2629 1 1 25 CYS H H 5.213 3.852 3.036 1.00 . A A . 46 CYS H 1 1 5 2630 1 1 25 CYS HA H 5.671 6.320 1.713 1.00 . A A . 46 CYS HA 1 1 5 2631 1 1 25 CYS HB2 H 7.900 5.076 1.162 1.00 . A A . 46 CYS HB2 1 1 5 2632 1 1 25 CYS HB3 H 7.492 5.538 2.812 1.00 . A A . 46 CYS HB3 1 1 5 2633 1 1 25 CYS N N 4.826 4.575 2.448 1.00 . A A . 46 CYS N 1 1 5 2634 1 1 25 CYS O O 5.776 5.940 -0.740 1.00 . A A . 46 CYS O 1 1 5 2635 1 1 25 CYS SG S 7.376 3.160 2.546 1.00 . A A . 46 CYS SG 1 1 5 2636 1 1 26 LYS C C 5.058 4.008 -2.954 1.00 . A A . 47 LYS C 1 1 5 2637 1 1 26 LYS CA C 4.346 3.536 -1.661 1.00 . A A . 47 LYS CA 1 1 5 2638 1 1 26 LYS CB C 2.839 3.878 -1.600 1.00 . A A . 47 LYS CB 1 1 5 2639 1 1 26 LYS CD C 1.061 5.627 -1.120 1.00 . A A . 47 LYS CD 1 1 5 2640 1 1 26 LYS CE C 0.896 7.095 -0.715 1.00 . A A . 47 LYS CE 1 1 5 2641 1 1 26 LYS CG C 2.529 5.379 -1.485 1.00 . A A . 47 LYS CG 1 1 5 2642 1 1 26 LYS H H 4.843 3.180 0.386 1.00 . A A . 47 LYS H 1 1 5 2643 1 1 26 LYS HA H 4.384 2.452 -1.742 1.00 . A A . 47 LYS HA 1 1 5 2644 1 1 26 LYS HB2 H 2.337 3.479 -2.483 1.00 . A A . 47 LYS HB2 1 1 5 2645 1 1 26 LYS HB3 H 2.419 3.368 -0.731 1.00 . A A . 47 LYS HB3 1 1 5 2646 1 1 26 LYS HD2 H 0.419 5.390 -1.970 1.00 . A A . 47 LYS HD2 1 1 5 2647 1 1 26 LYS HD3 H 0.790 4.996 -0.273 1.00 . A A . 47 LYS HD3 1 1 5 2648 1 1 26 LYS HE2 H 1.628 7.323 0.065 1.00 . A A . 47 LYS HE2 1 1 5 2649 1 1 26 LYS HE3 H 1.109 7.732 -1.580 1.00 . A A . 47 LYS HE3 1 1 5 2650 1 1 26 LYS HG2 H 3.137 5.818 -0.700 1.00 . A A . 47 LYS HG2 1 1 5 2651 1 1 26 LYS HG3 H 2.762 5.882 -2.426 1.00 . A A . 47 LYS HG3 1 1 5 2652 1 1 26 LYS HZ1 H -0.682 6.747 0.579 1.00 . A A . 47 LYS HZ1 1 1 5 2653 1 1 26 LYS HZ2 H -0.560 8.315 0.110 1.00 . A A . 47 LYS HZ2 1 1 5 2654 1 1 26 LYS HZ3 H -1.159 7.203 -0.934 1.00 . A A . 47 LYS HZ3 1 1 5 2655 1 1 26 LYS N N 4.963 3.869 -0.350 1.00 . A A . 47 LYS N 1 1 5 2656 1 1 26 LYS NZ N -0.468 7.360 -0.204 1.00 . A A . 47 LYS NZ 1 1 5 2657 1 1 26 LYS O O 4.411 4.186 -3.988 1.00 . A A . 47 LYS O 1 1 5 2658 1 1 27 GLN C C 7.251 3.467 -5.178 1.00 . A A . 48 GLN C 1 1 5 2659 1 1 27 GLN CA C 7.193 4.578 -4.096 1.00 . A A . 48 GLN CA 1 1 5 2660 1 1 27 GLN CB C 8.615 4.971 -3.642 1.00 . A A . 48 GLN CB 1 1 5 2661 1 1 27 GLN CD C 7.988 7.406 -3.185 1.00 . A A . 48 GLN CD 1 1 5 2662 1 1 27 GLN CG C 8.666 6.146 -2.650 1.00 . A A . 48 GLN CG 1 1 5 2663 1 1 27 GLN H H 6.850 4.048 -2.042 1.00 . A A . 48 GLN H 1 1 5 2664 1 1 27 GLN HA H 6.715 5.453 -4.531 1.00 . A A . 48 GLN HA 1 1 5 2665 1 1 27 GLN HB2 H 9.094 4.111 -3.180 1.00 . A A . 48 GLN HB2 1 1 5 2666 1 1 27 GLN HB3 H 9.205 5.243 -4.518 1.00 . A A . 48 GLN HB3 1 1 5 2667 1 1 27 GLN HE21 H 6.406 7.203 -1.941 1.00 . A A . 48 GLN HE21 1 1 5 2668 1 1 27 GLN HE22 H 6.383 8.599 -3.025 1.00 . A A . 48 GLN HE22 1 1 5 2669 1 1 27 GLN HG2 H 8.211 5.848 -1.706 1.00 . A A . 48 GLN HG2 1 1 5 2670 1 1 27 GLN HG3 H 9.711 6.379 -2.441 1.00 . A A . 48 GLN HG3 1 1 5 2671 1 1 27 GLN N N 6.384 4.186 -2.926 1.00 . A A . 48 GLN N 1 1 5 2672 1 1 27 GLN NE2 N 6.833 7.769 -2.673 1.00 . A A . 48 GLN NE2 1 1 5 2673 1 1 27 GLN O O 7.158 2.289 -4.816 1.00 . A A . 48 GLN O 1 1 5 2674 1 1 27 GLN OE1 O 8.479 8.076 -4.086 1.00 . A A . 48 GLN OE1 1 1 5 2675 1 1 28 PRO C C 7.963 1.516 -7.639 1.00 . A A . 49 PRO C 1 1 5 2676 1 1 28 PRO CA C 7.272 2.895 -7.630 1.00 . A A . 49 PRO CA 1 1 5 2677 1 1 28 PRO CB C 7.730 3.700 -8.851 1.00 . A A . 49 PRO CB 1 1 5 2678 1 1 28 PRO CD C 7.681 5.158 -6.968 1.00 . A A . 49 PRO CD 1 1 5 2679 1 1 28 PRO CG C 7.397 5.135 -8.467 1.00 . A A . 49 PRO CG 1 1 5 2680 1 1 28 PRO HA H 6.200 2.717 -7.729 1.00 . A A . 49 PRO HA 1 1 5 2681 1 1 28 PRO HB2 H 8.809 3.602 -8.983 1.00 . A A . 49 PRO HB2 1 1 5 2682 1 1 28 PRO HB3 H 7.206 3.394 -9.757 1.00 . A A . 49 PRO HB3 1 1 5 2683 1 1 28 PRO HD2 H 8.724 5.432 -6.803 1.00 . A A . 49 PRO HD2 1 1 5 2684 1 1 28 PRO HD3 H 7.025 5.891 -6.500 1.00 . A A . 49 PRO HD3 1 1 5 2685 1 1 28 PRO HG2 H 8.012 5.854 -9.009 1.00 . A A . 49 PRO HG2 1 1 5 2686 1 1 28 PRO HG3 H 6.337 5.325 -8.643 1.00 . A A . 49 PRO HG3 1 1 5 2687 1 1 28 PRO N N 7.450 3.799 -6.475 1.00 . A A . 49 PRO N 1 1 5 2688 1 1 28 PRO O O 7.523 0.639 -8.387 1.00 . A A . 49 PRO O 1 1 5 2689 1 1 29 GLY C C 10.470 -0.313 -5.486 1.00 . A A . 50 GLY C 1 1 5 2690 1 1 29 GLY CA C 9.747 0.010 -6.801 1.00 . A A . 50 GLY CA 1 1 5 2691 1 1 29 GLY H H 9.384 2.080 -6.330 1.00 . A A . 50 GLY H 1 1 5 2692 1 1 29 GLY HA2 H 10.490 0.002 -7.600 1.00 . A A . 50 GLY HA2 1 1 5 2693 1 1 29 GLY HA3 H 9.046 -0.804 -6.987 1.00 . A A . 50 GLY HA3 1 1 5 2694 1 1 29 GLY N N 9.023 1.297 -6.852 1.00 . A A . 50 GLY N 1 1 5 2695 1 1 29 GLY O O 11.123 -1.353 -5.386 1.00 . A A . 50 GLY O 1 1 5 2696 1 1 30 HIS C C 10.601 -0.859 -2.376 1.00 . A A . 51 HIS C 1 1 5 2697 1 1 30 HIS CA C 11.042 0.391 -3.170 1.00 . A A . 51 HIS CA 1 1 5 2698 1 1 30 HIS CB C 10.787 1.656 -2.327 1.00 . A A . 51 HIS CB 1 1 5 2699 1 1 30 HIS CD2 C 9.256 1.427 -0.292 1.00 . A A . 51 HIS CD2 1 1 5 2700 1 1 30 HIS CE1 C 7.289 1.367 -1.264 1.00 . A A . 51 HIS CE1 1 1 5 2701 1 1 30 HIS CG C 9.444 1.653 -1.629 1.00 . A A . 51 HIS CG 1 1 5 2702 1 1 30 HIS H H 9.816 1.383 -4.610 1.00 . A A . 51 HIS H 1 1 5 2703 1 1 30 HIS HA H 12.114 0.310 -3.352 1.00 . A A . 51 HIS HA 1 1 5 2704 1 1 30 HIS HB2 H 11.564 1.714 -1.563 1.00 . A A . 51 HIS HB2 1 1 5 2705 1 1 30 HIS HB3 H 10.881 2.548 -2.950 1.00 . A A . 51 HIS HB3 1 1 5 2706 1 1 30 HIS HD1 H 7.972 1.755 -3.203 1.00 . A A . 51 HIS HD1 1 1 5 2707 1 1 30 HIS HD2 H 10.041 1.317 0.443 1.00 . A A . 51 HIS HD2 1 1 5 2708 1 1 30 HIS HE1 H 6.227 1.248 -1.434 1.00 . A A . 51 HIS HE1 1 1 5 2709 1 1 30 HIS N N 10.363 0.550 -4.467 1.00 . A A . 51 HIS N 1 1 5 2710 1 1 30 HIS ND1 N 8.196 1.624 -2.218 1.00 . A A . 51 HIS ND1 1 1 5 2711 1 1 30 HIS NE2 N 7.887 1.244 -0.070 1.00 . A A . 51 HIS NE2 1 1 5 2712 1 1 30 HIS O O 11.364 -1.408 -1.578 1.00 . A A . 51 HIS O 1 1 5 2713 1 1 31 PHE C C 9.292 -3.581 -1.579 1.00 . A A . 52 PHE C 1 1 5 2714 1 1 31 PHE CA C 8.633 -2.203 -1.674 1.00 . A A . 52 PHE CA 1 1 5 2715 1 1 31 PHE CB C 7.161 -2.297 -2.110 1.00 . A A . 52 PHE CB 1 1 5 2716 1 1 31 PHE CD1 C 6.940 -3.641 -4.259 1.00 . A A . 52 PHE CD1 1 1 5 2717 1 1 31 PHE CD2 C 6.670 -1.223 -4.353 1.00 . A A . 52 PHE CD2 1 1 5 2718 1 1 31 PHE CE1 C 6.733 -3.716 -5.648 1.00 . A A . 52 PHE CE1 1 1 5 2719 1 1 31 PHE CE2 C 6.451 -1.301 -5.738 1.00 . A A . 52 PHE CE2 1 1 5 2720 1 1 31 PHE CG C 6.918 -2.392 -3.607 1.00 . A A . 52 PHE CG 1 1 5 2721 1 1 31 PHE CZ C 6.491 -2.547 -6.388 1.00 . A A . 52 PHE CZ 1 1 5 2722 1 1 31 PHE H H 8.802 -0.807 -3.264 1.00 . A A . 52 PHE H 1 1 5 2723 1 1 31 PHE HA H 8.648 -1.782 -0.668 1.00 . A A . 52 PHE HA 1 1 5 2724 1 1 31 PHE HB2 H 6.708 -3.156 -1.621 1.00 . A A . 52 PHE HB2 1 1 5 2725 1 1 31 PHE HB3 H 6.642 -1.414 -1.735 1.00 . A A . 52 PHE HB3 1 1 5 2726 1 1 31 PHE HD1 H 7.120 -4.547 -3.695 1.00 . A A . 52 PHE HD1 1 1 5 2727 1 1 31 PHE HD2 H 6.623 -0.263 -3.862 1.00 . A A . 52 PHE HD2 1 1 5 2728 1 1 31 PHE HE1 H 6.762 -4.675 -6.146 1.00 . A A . 52 PHE HE1 1 1 5 2729 1 1 31 PHE HE2 H 6.241 -0.403 -6.300 1.00 . A A . 52 PHE HE2 1 1 5 2730 1 1 31 PHE HZ H 6.326 -2.603 -7.457 1.00 . A A . 52 PHE HZ 1 1 5 2731 1 1 31 PHE N N 9.348 -1.284 -2.563 1.00 . A A . 52 PHE N 1 1 5 2732 1 1 31 PHE O O 9.457 -4.095 -0.474 1.00 . A A . 52 PHE O 1 1 5 2733 1 1 32 SER C C 11.796 -5.474 -1.979 1.00 . A A . 53 SER C 1 1 5 2734 1 1 32 SER CA C 10.475 -5.426 -2.767 1.00 . A A . 53 SER CA 1 1 5 2735 1 1 32 SER CB C 10.759 -5.781 -4.232 1.00 . A A . 53 SER CB 1 1 5 2736 1 1 32 SER H H 9.580 -3.663 -3.574 1.00 . A A . 53 SER H 1 1 5 2737 1 1 32 SER HA H 9.824 -6.197 -2.353 1.00 . A A . 53 SER HA 1 1 5 2738 1 1 32 SER HB2 H 11.450 -5.048 -4.654 1.00 . A A . 53 SER HB2 1 1 5 2739 1 1 32 SER HB3 H 11.222 -6.769 -4.282 1.00 . A A . 53 SER HB3 1 1 5 2740 1 1 32 SER HG H 9.773 -6.037 -5.907 1.00 . A A . 53 SER HG 1 1 5 2741 1 1 32 SER N N 9.766 -4.134 -2.698 1.00 . A A . 53 SER N 1 1 5 2742 1 1 32 SER O O 12.385 -6.548 -1.843 1.00 . A A . 53 SER O 1 1 5 2743 1 1 32 SER OG O 9.558 -5.788 -4.988 1.00 . A A . 53 SER OG 1 1 5 2744 1 1 33 LYS C C 13.364 -3.449 0.619 1.00 . A A . 54 LYS C 1 1 5 2745 1 1 33 LYS CA C 13.541 -4.138 -0.750 1.00 . A A . 54 LYS CA 1 1 5 2746 1 1 33 LYS CB C 14.516 -3.343 -1.649 1.00 . A A . 54 LYS CB 1 1 5 2747 1 1 33 LYS CD C 15.459 -5.292 -3.040 1.00 . A A . 54 LYS CD 1 1 5 2748 1 1 33 LYS CE C 15.594 -5.822 -4.472 1.00 . A A . 54 LYS CE 1 1 5 2749 1 1 33 LYS CG C 14.763 -3.923 -3.055 1.00 . A A . 54 LYS CG 1 1 5 2750 1 1 33 LYS H H 11.728 -3.488 -1.656 1.00 . A A . 54 LYS H 1 1 5 2751 1 1 33 LYS HA H 13.977 -5.113 -0.530 1.00 . A A . 54 LYS HA 1 1 5 2752 1 1 33 LYS HB2 H 14.124 -2.331 -1.771 1.00 . A A . 54 LYS HB2 1 1 5 2753 1 1 33 LYS HB3 H 15.479 -3.262 -1.145 1.00 . A A . 54 LYS HB3 1 1 5 2754 1 1 33 LYS HD2 H 16.448 -5.188 -2.590 1.00 . A A . 54 LYS HD2 1 1 5 2755 1 1 33 LYS HD3 H 14.876 -6.000 -2.451 1.00 . A A . 54 LYS HD3 1 1 5 2756 1 1 33 LYS HE2 H 14.598 -5.874 -4.922 1.00 . A A . 54 LYS HE2 1 1 5 2757 1 1 33 LYS HE3 H 16.187 -5.112 -5.057 1.00 . A A . 54 LYS HE3 1 1 5 2758 1 1 33 LYS HG2 H 13.818 -4.000 -3.593 1.00 . A A . 54 LYS HG2 1 1 5 2759 1 1 33 LYS HG3 H 15.396 -3.223 -3.603 1.00 . A A . 54 LYS HG3 1 1 5 2760 1 1 33 LYS HZ1 H 15.692 -7.839 -3.976 1.00 . A A . 54 LYS HZ1 1 1 5 2761 1 1 33 LYS HZ2 H 16.308 -7.509 -5.450 1.00 . A A . 54 LYS HZ2 1 1 5 2762 1 1 33 LYS HZ3 H 17.164 -7.138 -4.112 1.00 . A A . 54 LYS HZ3 1 1 5 2763 1 1 33 LYS N N 12.267 -4.325 -1.468 1.00 . A A . 54 LYS N 1 1 5 2764 1 1 33 LYS NZ N 16.231 -7.165 -4.503 1.00 . A A . 54 LYS NZ 1 1 5 2765 1 1 33 LYS O O 14.364 -3.100 1.252 1.00 . A A . 54 LYS O 1 1 5 2766 1 1 34 GLN C C 10.534 -3.080 3.049 1.00 . A A . 55 GLN C 1 1 5 2767 1 1 34 GLN CA C 11.835 -2.592 2.375 1.00 . A A . 55 GLN CA 1 1 5 2768 1 1 34 GLN CB C 11.777 -1.068 2.161 1.00 . A A . 55 GLN CB 1 1 5 2769 1 1 34 GLN CD C 11.524 1.196 3.275 1.00 . A A . 55 GLN CD 1 1 5 2770 1 1 34 GLN CG C 11.768 -0.296 3.490 1.00 . A A . 55 GLN CG 1 1 5 2771 1 1 34 GLN H H 11.357 -3.602 0.537 1.00 . A A . 55 GLN H 1 1 5 2772 1 1 34 GLN HA H 12.651 -2.809 3.066 1.00 . A A . 55 GLN HA 1 1 5 2773 1 1 34 GLN HB2 H 12.647 -0.746 1.587 1.00 . A A . 55 GLN HB2 1 1 5 2774 1 1 34 GLN HB3 H 10.883 -0.818 1.588 1.00 . A A . 55 GLN HB3 1 1 5 2775 1 1 34 GLN HE21 H 9.530 0.952 3.412 1.00 . A A . 55 GLN HE21 1 1 5 2776 1 1 34 GLN HE22 H 10.085 2.599 3.152 1.00 . A A . 55 GLN HE22 1 1 5 2777 1 1 34 GLN HG2 H 10.984 -0.679 4.142 1.00 . A A . 55 GLN HG2 1 1 5 2778 1 1 34 GLN HG3 H 12.726 -0.433 3.994 1.00 . A A . 55 GLN HG3 1 1 5 2779 1 1 34 GLN N N 12.124 -3.238 1.083 1.00 . A A . 55 GLN N 1 1 5 2780 1 1 34 GLN NE2 N 10.281 1.619 3.289 1.00 . A A . 55 GLN NE2 1 1 5 2781 1 1 34 GLN O O 10.553 -3.390 4.243 1.00 . A A . 55 GLN O 1 1 5 2782 1 1 34 GLN OE1 O 12.435 1.992 3.090 1.00 . A A . 55 GLN OE1 1 1 5 2783 1 1 35 CYS C C 7.408 -4.651 2.568 1.00 . A A . 56 CYS C 1 1 5 2784 1 1 35 CYS CA C 8.066 -3.286 2.860 1.00 . A A . 56 CYS CA 1 1 5 2785 1 1 35 CYS CB C 7.208 -2.129 2.316 1.00 . A A . 56 CYS CB 1 1 5 2786 1 1 35 CYS H H 9.495 -2.904 1.331 1.00 . A A . 56 CYS H 1 1 5 2787 1 1 35 CYS HA H 8.106 -3.178 3.946 1.00 . A A . 56 CYS HA 1 1 5 2788 1 1 35 CYS HB2 H 7.135 -2.202 1.228 1.00 . A A . 56 CYS HB2 1 1 5 2789 1 1 35 CYS HB3 H 6.199 -2.214 2.727 1.00 . A A . 56 CYS HB3 1 1 5 2790 1 1 35 CYS N N 9.423 -3.155 2.306 1.00 . A A . 56 CYS N 1 1 5 2791 1 1 35 CYS O O 6.530 -5.087 3.318 1.00 . A A . 56 CYS O 1 1 5 2792 1 1 35 CYS SG S 7.912 -0.523 2.788 1.00 . A A . 56 CYS SG 1 1 5 2793 1 1 36 ARG C C 8.482 -7.671 0.837 1.00 . A A . 57 ARG C 1 1 5 2794 1 1 36 ARG CA C 7.347 -6.631 0.988 1.00 . A A . 57 ARG CA 1 1 5 2795 1 1 36 ARG CB C 6.634 -6.413 -0.367 1.00 . A A . 57 ARG CB 1 1 5 2796 1 1 36 ARG CD C 4.196 -5.952 0.390 1.00 . A A . 57 ARG CD 1 1 5 2797 1 1 36 ARG CG C 5.423 -5.462 -0.394 1.00 . A A . 57 ARG CG 1 1 5 2798 1 1 36 ARG CZ C 3.403 -4.625 2.371 1.00 . A A . 57 ARG CZ 1 1 5 2799 1 1 36 ARG H H 8.552 -4.869 0.942 1.00 . A A . 57 ARG H 1 1 5 2800 1 1 36 ARG HA H 6.643 -7.065 1.697 1.00 . A A . 57 ARG HA 1 1 5 2801 1 1 36 ARG HB2 H 7.369 -6.030 -1.077 1.00 . A A . 57 ARG HB2 1 1 5 2802 1 1 36 ARG HB3 H 6.294 -7.377 -0.748 1.00 . A A . 57 ARG HB3 1 1 5 2803 1 1 36 ARG HD2 H 3.306 -5.583 -0.117 1.00 . A A . 57 ARG HD2 1 1 5 2804 1 1 36 ARG HD3 H 4.159 -7.043 0.374 1.00 . A A . 57 ARG HD3 1 1 5 2805 1 1 36 ARG HE H 5.058 -5.680 2.315 1.00 . A A . 57 ARG HE 1 1 5 2806 1 1 36 ARG HG2 H 5.714 -4.476 -0.035 1.00 . A A . 57 ARG HG2 1 1 5 2807 1 1 36 ARG HG3 H 5.123 -5.356 -1.438 1.00 . A A . 57 ARG HG3 1 1 5 2808 1 1 36 ARG HH11 H 2.018 -4.574 0.925 1.00 . A A . 57 ARG HH11 1 1 5 2809 1 1 36 ARG HH12 H 1.772 -3.457 2.239 1.00 . A A . 57 ARG HH12 1 1 5 2810 1 1 36 ARG HH21 H 4.606 -4.399 3.944 1.00 . A A . 57 ARG HH21 1 1 5 2811 1 1 36 ARG HH22 H 3.084 -3.533 4.025 1.00 . A A . 57 ARG HH22 1 1 5 2812 1 1 36 ARG N N 7.842 -5.335 1.501 1.00 . A A . 57 ARG N 1 1 5 2813 1 1 36 ARG NE N 4.226 -5.467 1.781 1.00 . A A . 57 ARG NE 1 1 5 2814 1 1 36 ARG NH1 N 2.284 -4.234 1.840 1.00 . A A . 57 ARG NH1 1 1 5 2815 1 1 36 ARG NH2 N 3.718 -4.139 3.535 1.00 . A A . 57 ARG NH2 1 1 5 2816 1 1 36 ARG O O 8.282 -8.710 0.204 1.00 . A A . 57 ARG O 1 1 5 2817 1 1 37 SER C C 10.711 -9.674 1.642 1.00 . A A . 58 SER C 1 1 5 2818 1 1 37 SER CA C 10.908 -8.180 1.345 1.00 . A A . 58 SER CA 1 1 5 2819 1 1 37 SER CB C 11.934 -7.605 2.324 1.00 . A A . 58 SER CB 1 1 5 2820 1 1 37 SER H H 9.730 -6.496 1.876 1.00 . A A . 58 SER H 1 1 5 2821 1 1 37 SER HA H 11.329 -8.104 0.344 1.00 . A A . 58 SER HA 1 1 5 2822 1 1 37 SER HB2 H 11.578 -7.739 3.348 1.00 . A A . 58 SER HB2 1 1 5 2823 1 1 37 SER HB3 H 12.879 -8.144 2.211 1.00 . A A . 58 SER HB3 1 1 5 2824 1 1 37 SER HG H 12.798 -5.883 2.691 1.00 . A A . 58 SER HG 1 1 5 2825 1 1 37 SER N N 9.667 -7.377 1.391 1.00 . A A . 58 SER N 1 1 5 2826 1 1 37 SER O O 11.215 -10.506 0.851 1.00 . A A . 58 SER O 1 1 5 2827 1 1 37 SER OXT O 10.094 -10.013 2.678 1.00 . A A . 58 SER OXT 1 1 5 2828 1 1 37 SER OG O 12.131 -6.223 2.062 1.00 . A A . 58 SER OG 1 1 5 2829 2 2 1 ZN ZN ZN -8.218 0.418 3.773 1.00 . B A . 1059 ZN ZN 1 1 5 2830 3 2 1 ZN ZN ZN 6.986 1.158 1.786 1.00 . C A . 1060 ZN ZN 1 1 6 2831 1 1 1 GLN C C -6.405 -1.360 -4.555 1.00 . A A . 22 GLN C 1 1 6 2832 1 1 1 GLN CA C -6.250 -0.865 -5.992 1.00 . A A . 22 GLN CA 1 1 6 2833 1 1 1 GLN CB C -4.808 -0.388 -6.281 1.00 . A A . 22 GLN CB 1 1 6 2834 1 1 1 GLN CD C -3.889 -2.672 -7.000 1.00 . A A . 22 GLN CD 1 1 6 2835 1 1 1 GLN CG C -3.713 -1.456 -6.093 1.00 . A A . 22 GLN CG 1 1 6 2836 1 1 1 GLN H1 H -7.105 0.980 -5.618 1.00 . A A . 22 GLN H1 1 1 6 2837 1 1 1 GLN H2 H -7.158 0.544 -7.208 1.00 . A A . 22 GLN H2 1 1 6 2838 1 1 1 GLN H3 H -8.178 -0.149 -6.121 1.00 . A A . 22 GLN H3 1 1 6 2839 1 1 1 GLN HA H -6.474 -1.701 -6.655 1.00 . A A . 22 GLN HA 1 1 6 2840 1 1 1 GLN HB2 H -4.757 -0.031 -7.310 1.00 . A A . 22 GLN HB2 1 1 6 2841 1 1 1 GLN HB3 H -4.577 0.455 -5.626 1.00 . A A . 22 GLN HB3 1 1 6 2842 1 1 1 GLN HE21 H -2.132 -2.385 -7.968 1.00 . A A . 22 GLN HE21 1 1 6 2843 1 1 1 GLN HE22 H -3.098 -3.768 -8.470 1.00 . A A . 22 GLN HE22 1 1 6 2844 1 1 1 GLN HG2 H -2.746 -0.992 -6.295 1.00 . A A . 22 GLN HG2 1 1 6 2845 1 1 1 GLN HG3 H -3.698 -1.800 -5.059 1.00 . A A . 22 GLN HG3 1 1 6 2846 1 1 1 GLN N N -7.242 0.207 -6.261 1.00 . A A . 22 GLN N 1 1 6 2847 1 1 1 GLN NE2 N -2.961 -2.958 -7.884 1.00 . A A . 22 GLN NE2 1 1 6 2848 1 1 1 GLN O O -6.570 -0.550 -3.648 1.00 . A A . 22 GLN O 1 1 6 2849 1 1 1 GLN OE1 O -4.876 -3.390 -6.925 1.00 . A A . 22 GLN OE1 1 1 6 2850 1 1 2 THR C C -5.898 -2.750 -1.861 1.00 . A A . 23 THR C 1 1 6 2851 1 1 2 THR CA C -6.684 -3.329 -3.045 1.00 . A A . 23 THR CA 1 1 6 2852 1 1 2 THR CB C -6.454 -4.845 -3.148 1.00 . A A . 23 THR CB 1 1 6 2853 1 1 2 THR CG2 C -6.999 -5.611 -1.943 1.00 . A A . 23 THR CG2 1 1 6 2854 1 1 2 THR H H -6.226 -3.299 -5.125 1.00 . A A . 23 THR H 1 1 6 2855 1 1 2 THR HA H -7.737 -3.175 -2.841 1.00 . A A . 23 THR HA 1 1 6 2856 1 1 2 THR HB H -5.386 -5.046 -3.254 1.00 . A A . 23 THR HB 1 1 6 2857 1 1 2 THR HG1 H -6.891 -6.274 -4.394 1.00 . A A . 23 THR HG1 1 1 6 2858 1 1 2 THR HG21 H -8.058 -5.392 -1.816 1.00 . A A . 23 THR HG21 1 1 6 2859 1 1 2 THR HG22 H -6.872 -6.684 -2.099 1.00 . A A . 23 THR HG22 1 1 6 2860 1 1 2 THR HG23 H -6.456 -5.333 -1.040 1.00 . A A . 23 THR HG23 1 1 6 2861 1 1 2 THR N N -6.384 -2.677 -4.337 1.00 . A A . 23 THR N 1 1 6 2862 1 1 2 THR O O -4.685 -2.557 -1.955 1.00 . A A . 23 THR O 1 1 6 2863 1 1 2 THR OG1 O -7.135 -5.339 -4.283 1.00 . A A . 23 THR OG1 1 1 6 2864 1 1 3 CYS C C -4.876 -2.758 1.086 1.00 . A A . 24 CYS C 1 1 6 2865 1 1 3 CYS CA C -6.045 -1.944 0.497 1.00 . A A . 24 CYS CA 1 1 6 2866 1 1 3 CYS CB C -7.195 -1.902 1.506 1.00 . A A . 24 CYS CB 1 1 6 2867 1 1 3 CYS H H -7.593 -2.639 -0.781 1.00 . A A . 24 CYS H 1 1 6 2868 1 1 3 CYS HA H -5.707 -0.925 0.303 1.00 . A A . 24 CYS HA 1 1 6 2869 1 1 3 CYS HB2 H -8.080 -1.478 1.038 1.00 . A A . 24 CYS HB2 1 1 6 2870 1 1 3 CYS HB3 H -7.431 -2.919 1.815 1.00 . A A . 24 CYS HB3 1 1 6 2871 1 1 3 CYS N N -6.592 -2.494 -0.747 1.00 . A A . 24 CYS N 1 1 6 2872 1 1 3 CYS O O -4.863 -3.990 1.010 1.00 . A A . 24 CYS O 1 1 6 2873 1 1 3 CYS SG S -6.717 -0.907 2.942 1.00 . A A . 24 CYS SG 1 1 6 2874 1 1 4 TYR C C -3.529 -3.510 3.832 1.00 . A A . 25 TYR C 1 1 6 2875 1 1 4 TYR CA C -2.949 -2.728 2.635 1.00 . A A . 25 TYR CA 1 1 6 2876 1 1 4 TYR CB C -1.893 -1.710 3.098 1.00 . A A . 25 TYR CB 1 1 6 2877 1 1 4 TYR CD1 C -3.365 -0.100 4.426 1.00 . A A . 25 TYR CD1 1 1 6 2878 1 1 4 TYR CD2 C -1.369 -1.017 5.480 1.00 . A A . 25 TYR CD2 1 1 6 2879 1 1 4 TYR CE1 C -3.673 0.589 5.614 1.00 . A A . 25 TYR CE1 1 1 6 2880 1 1 4 TYR CE2 C -1.664 -0.312 6.663 1.00 . A A . 25 TYR CE2 1 1 6 2881 1 1 4 TYR CG C -2.219 -0.916 4.357 1.00 . A A . 25 TYR CG 1 1 6 2882 1 1 4 TYR CZ C -2.822 0.491 6.733 1.00 . A A . 25 TYR CZ 1 1 6 2883 1 1 4 TYR H H -4.030 -1.072 1.811 1.00 . A A . 25 TYR H 1 1 6 2884 1 1 4 TYR HA H -2.437 -3.461 2.023 1.00 . A A . 25 TYR HA 1 1 6 2885 1 1 4 TYR HB2 H -0.982 -2.275 3.288 1.00 . A A . 25 TYR HB2 1 1 6 2886 1 1 4 TYR HB3 H -1.667 -1.018 2.288 1.00 . A A . 25 TYR HB3 1 1 6 2887 1 1 4 TYR HD1 H -4.025 -0.010 3.575 1.00 . A A . 25 TYR HD1 1 1 6 2888 1 1 4 TYR HD2 H -0.486 -1.642 5.436 1.00 . A A . 25 TYR HD2 1 1 6 2889 1 1 4 TYR HE1 H -4.571 1.180 5.684 1.00 . A A . 25 TYR HE1 1 1 6 2890 1 1 4 TYR HE2 H -1.009 -0.392 7.519 1.00 . A A . 25 TYR HE2 1 1 6 2891 1 1 4 TYR HH H -2.502 0.983 8.588 1.00 . A A . 25 TYR HH 1 1 6 2892 1 1 4 TYR N N -3.953 -2.081 1.779 1.00 . A A . 25 TYR N 1 1 6 2893 1 1 4 TYR O O -2.858 -4.400 4.362 1.00 . A A . 25 TYR O 1 1 6 2894 1 1 4 TYR OH O -3.136 1.166 7.871 1.00 . A A . 25 TYR OH 1 1 6 2895 1 1 5 ASN C C -6.808 -4.259 5.258 1.00 . A A . 26 ASN C 1 1 6 2896 1 1 5 ASN CA C -5.392 -3.687 5.473 1.00 . A A . 26 ASN CA 1 1 6 2897 1 1 5 ASN CB C -5.418 -2.490 6.443 1.00 . A A . 26 ASN CB 1 1 6 2898 1 1 5 ASN CG C -6.189 -2.781 7.721 1.00 . A A . 26 ASN CG 1 1 6 2899 1 1 5 ASN H H -5.247 -2.479 3.722 1.00 . A A . 26 ASN H 1 1 6 2900 1 1 5 ASN HA H -4.789 -4.480 5.920 1.00 . A A . 26 ASN HA 1 1 6 2901 1 1 5 ASN HB2 H -4.395 -2.223 6.711 1.00 . A A . 26 ASN HB2 1 1 6 2902 1 1 5 ASN HB3 H -5.869 -1.626 5.954 1.00 . A A . 26 ASN HB3 1 1 6 2903 1 1 5 ASN HD21 H -7.906 -1.968 6.997 1.00 . A A . 26 ASN HD21 1 1 6 2904 1 1 5 ASN HD22 H -7.961 -2.604 8.634 1.00 . A A . 26 ASN HD22 1 1 6 2905 1 1 5 ASN N N -4.770 -3.212 4.233 1.00 . A A . 26 ASN N 1 1 6 2906 1 1 5 ASN ND2 N -7.449 -2.408 7.789 1.00 . A A . 26 ASN ND2 1 1 6 2907 1 1 5 ASN O O -7.115 -5.349 5.744 1.00 . A A . 26 ASN O 1 1 6 2908 1 1 5 ASN OD1 O -5.670 -3.353 8.669 1.00 . A A . 26 ASN OD1 1 1 6 2909 1 1 6 CYS C C -9.503 -4.890 3.475 1.00 . A A . 27 CYS C 1 1 6 2910 1 1 6 CYS CA C -9.107 -3.778 4.473 1.00 . A A . 27 CYS CA 1 1 6 2911 1 1 6 CYS CB C -9.796 -2.448 4.114 1.00 . A A . 27 CYS CB 1 1 6 2912 1 1 6 CYS H H -7.348 -2.637 4.181 1.00 . A A . 27 CYS H 1 1 6 2913 1 1 6 CYS HA H -9.455 -4.083 5.462 1.00 . A A . 27 CYS HA 1 1 6 2914 1 1 6 CYS HB2 H -9.548 -2.177 3.086 1.00 . A A . 27 CYS HB2 1 1 6 2915 1 1 6 CYS HB3 H -10.880 -2.586 4.177 1.00 . A A . 27 CYS HB3 1 1 6 2916 1 1 6 CYS N N -7.666 -3.527 4.543 1.00 . A A . 27 CYS N 1 1 6 2917 1 1 6 CYS O O -10.612 -5.423 3.545 1.00 . A A . 27 CYS O 1 1 6 2918 1 1 6 CYS SG S -9.292 -1.115 5.249 1.00 . A A . 27 CYS SG 1 1 6 2919 1 1 7 GLY C C -9.906 -5.792 0.386 1.00 . A A . 28 GLY C 1 1 6 2920 1 1 7 GLY CA C -8.875 -6.205 1.453 1.00 . A A . 28 GLY CA 1 1 6 2921 1 1 7 GLY H H -7.717 -4.785 2.554 1.00 . A A . 28 GLY H 1 1 6 2922 1 1 7 GLY HA2 H -9.215 -7.138 1.906 1.00 . A A . 28 GLY HA2 1 1 6 2923 1 1 7 GLY HA3 H -7.933 -6.404 0.942 1.00 . A A . 28 GLY HA3 1 1 6 2924 1 1 7 GLY N N -8.628 -5.221 2.519 1.00 . A A . 28 GLY N 1 1 6 2925 1 1 7 GLY O O -10.266 -6.615 -0.457 1.00 . A A . 28 GLY O 1 1 6 2926 1 1 8 LYS C C -10.583 -3.444 -1.818 1.00 . A A . 29 LYS C 1 1 6 2927 1 1 8 LYS CA C -11.346 -3.989 -0.591 1.00 . A A . 29 LYS CA 1 1 6 2928 1 1 8 LYS CB C -12.179 -2.860 0.050 1.00 . A A . 29 LYS CB 1 1 6 2929 1 1 8 LYS CD C -13.409 -4.175 1.931 1.00 . A A . 29 LYS CD 1 1 6 2930 1 1 8 LYS CE C -13.332 -5.667 1.580 1.00 . A A . 29 LYS CE 1 1 6 2931 1 1 8 LYS CG C -13.516 -3.281 0.686 1.00 . A A . 29 LYS CG 1 1 6 2932 1 1 8 LYS H H -10.050 -3.923 1.118 1.00 . A A . 29 LYS H 1 1 6 2933 1 1 8 LYS HA H -12.033 -4.767 -0.917 1.00 . A A . 29 LYS HA 1 1 6 2934 1 1 8 LYS HB2 H -11.580 -2.344 0.799 1.00 . A A . 29 LYS HB2 1 1 6 2935 1 1 8 LYS HB3 H -12.427 -2.130 -0.724 1.00 . A A . 29 LYS HB3 1 1 6 2936 1 1 8 LYS HD2 H -12.541 -3.872 2.518 1.00 . A A . 29 LYS HD2 1 1 6 2937 1 1 8 LYS HD3 H -14.300 -4.016 2.541 1.00 . A A . 29 LYS HD3 1 1 6 2938 1 1 8 LYS HE2 H -14.257 -5.958 1.074 1.00 . A A . 29 LYS HE2 1 1 6 2939 1 1 8 LYS HE3 H -12.508 -5.831 0.884 1.00 . A A . 29 LYS HE3 1 1 6 2940 1 1 8 LYS HG2 H -14.024 -2.363 0.989 1.00 . A A . 29 LYS HG2 1 1 6 2941 1 1 8 LYS HG3 H -14.142 -3.765 -0.064 1.00 . A A . 29 LYS HG3 1 1 6 2942 1 1 8 LYS HZ1 H -13.885 -6.369 3.457 1.00 . A A . 29 LYS HZ1 1 1 6 2943 1 1 8 LYS HZ2 H -13.077 -7.478 2.567 1.00 . A A . 29 LYS HZ2 1 1 6 2944 1 1 8 LYS HZ3 H -12.262 -6.234 3.260 1.00 . A A . 29 LYS HZ3 1 1 6 2945 1 1 8 LYS N N -10.402 -4.545 0.404 1.00 . A A . 29 LYS N 1 1 6 2946 1 1 8 LYS NZ N -13.130 -6.494 2.796 1.00 . A A . 29 LYS NZ 1 1 6 2947 1 1 8 LYS O O -9.733 -2.571 -1.624 1.00 . A A . 29 LYS O 1 1 6 2948 1 1 9 PRO C C -10.404 -1.834 -4.507 1.00 . A A . 30 PRO C 1 1 6 2949 1 1 9 PRO CA C -10.300 -3.356 -4.305 1.00 . A A . 30 PRO CA 1 1 6 2950 1 1 9 PRO CB C -11.021 -4.087 -5.443 1.00 . A A . 30 PRO CB 1 1 6 2951 1 1 9 PRO CD C -11.759 -5.011 -3.374 1.00 . A A . 30 PRO CD 1 1 6 2952 1 1 9 PRO CG C -11.434 -5.411 -4.810 1.00 . A A . 30 PRO CG 1 1 6 2953 1 1 9 PRO HA H -9.249 -3.637 -4.339 1.00 . A A . 30 PRO HA 1 1 6 2954 1 1 9 PRO HB2 H -11.920 -3.541 -5.739 1.00 . A A . 30 PRO HB2 1 1 6 2955 1 1 9 PRO HB3 H -10.370 -4.240 -6.303 1.00 . A A . 30 PRO HB3 1 1 6 2956 1 1 9 PRO HD2 H -12.801 -4.697 -3.305 1.00 . A A . 30 PRO HD2 1 1 6 2957 1 1 9 PRO HD3 H -11.576 -5.860 -2.715 1.00 . A A . 30 PRO HD3 1 1 6 2958 1 1 9 PRO HG2 H -12.295 -5.853 -5.312 1.00 . A A . 30 PRO HG2 1 1 6 2959 1 1 9 PRO HG3 H -10.587 -6.100 -4.815 1.00 . A A . 30 PRO HG3 1 1 6 2960 1 1 9 PRO N N -10.887 -3.884 -3.061 1.00 . A A . 30 PRO N 1 1 6 2961 1 1 9 PRO O O -9.509 -1.227 -5.100 1.00 . A A . 30 PRO O 1 1 6 2962 1 1 10 GLY C C -11.004 1.195 -3.312 1.00 . A A . 31 GLY C 1 1 6 2963 1 1 10 GLY CA C -11.801 0.219 -4.191 1.00 . A A . 31 GLY CA 1 1 6 2964 1 1 10 GLY H H -12.168 -1.776 -3.543 1.00 . A A . 31 GLY H 1 1 6 2965 1 1 10 GLY HA2 H -12.862 0.368 -3.988 1.00 . A A . 31 GLY HA2 1 1 6 2966 1 1 10 GLY HA3 H -11.620 0.486 -5.231 1.00 . A A . 31 GLY HA3 1 1 6 2967 1 1 10 GLY N N -11.473 -1.205 -4.004 1.00 . A A . 31 GLY N 1 1 6 2968 1 1 10 GLY O O -11.556 2.189 -2.835 1.00 . A A . 31 GLY O 1 1 6 2969 1 1 11 HIS C C -7.827 2.548 -3.053 1.00 . A A . 32 HIS C 1 1 6 2970 1 1 11 HIS CA C -8.834 1.720 -2.238 1.00 . A A . 32 HIS CA 1 1 6 2971 1 1 11 HIS CB C -8.146 0.832 -1.189 1.00 . A A . 32 HIS CB 1 1 6 2972 1 1 11 HIS CD2 C -8.627 1.285 1.283 1.00 . A A . 32 HIS CD2 1 1 6 2973 1 1 11 HIS CE1 C -10.478 0.139 1.548 1.00 . A A . 32 HIS CE1 1 1 6 2974 1 1 11 HIS CG C -8.943 0.721 0.081 1.00 . A A . 32 HIS CG 1 1 6 2975 1 1 11 HIS H H -9.336 0.081 -3.503 1.00 . A A . 32 HIS H 1 1 6 2976 1 1 11 HIS HA H -9.434 2.447 -1.694 1.00 . A A . 32 HIS HA 1 1 6 2977 1 1 11 HIS HB2 H -7.989 -0.168 -1.588 1.00 . A A . 32 HIS HB2 1 1 6 2978 1 1 11 HIS HB3 H -7.167 1.244 -0.939 1.00 . A A . 32 HIS HB3 1 1 6 2979 1 1 11 HIS HD1 H -10.563 -0.559 -0.442 1.00 . A A . 32 HIS HD1 1 1 6 2980 1 1 11 HIS HD2 H -7.770 1.912 1.468 1.00 . A A . 32 HIS HD2 1 1 6 2981 1 1 11 HIS HE1 H -11.358 -0.316 1.989 1.00 . A A . 32 HIS HE1 1 1 6 2982 1 1 11 HIS N N -9.724 0.905 -3.066 1.00 . A A . 32 HIS N 1 1 6 2983 1 1 11 HIS ND1 N -10.104 0.006 0.263 1.00 . A A . 32 HIS ND1 1 1 6 2984 1 1 11 HIS NE2 N -9.590 0.892 2.222 1.00 . A A . 32 HIS NE2 1 1 6 2985 1 1 11 HIS O O -7.506 2.255 -4.208 1.00 . A A . 32 HIS O 1 1 6 2986 1 1 12 LEU C C -5.755 5.298 -1.678 1.00 . A A . 33 LEU C 1 1 6 2987 1 1 12 LEU CA C -6.486 4.689 -2.890 1.00 . A A . 33 LEU CA 1 1 6 2988 1 1 12 LEU CB C -7.349 5.792 -3.550 1.00 . A A . 33 LEU CB 1 1 6 2989 1 1 12 LEU CD1 C -8.941 6.606 -5.307 1.00 . A A . 33 LEU CD1 1 1 6 2990 1 1 12 LEU CD2 C -7.074 5.132 -5.995 1.00 . A A . 33 LEU CD2 1 1 6 2991 1 1 12 LEU CG C -8.064 5.434 -4.867 1.00 . A A . 33 LEU CG 1 1 6 2992 1 1 12 LEU H H -7.639 3.714 -1.440 1.00 . A A . 33 LEU H 1 1 6 2993 1 1 12 LEU HA H -5.747 4.300 -3.592 1.00 . A A . 33 LEU HA 1 1 6 2994 1 1 12 LEU HB2 H -8.107 6.102 -2.827 1.00 . A A . 33 LEU HB2 1 1 6 2995 1 1 12 LEU HB3 H -6.719 6.661 -3.749 1.00 . A A . 33 LEU HB3 1 1 6 2996 1 1 12 LEU HD11 H -9.677 6.824 -4.531 1.00 . A A . 33 LEU HD11 1 1 6 2997 1 1 12 LEU HD12 H -8.330 7.493 -5.477 1.00 . A A . 33 LEU HD12 1 1 6 2998 1 1 12 LEU HD13 H -9.469 6.349 -6.225 1.00 . A A . 33 LEU HD13 1 1 6 2999 1 1 12 LEU HD21 H -6.416 5.987 -6.154 1.00 . A A . 33 LEU HD21 1 1 6 3000 1 1 12 LEU HD22 H -6.477 4.257 -5.745 1.00 . A A . 33 LEU HD22 1 1 6 3001 1 1 12 LEU HD23 H -7.620 4.925 -6.915 1.00 . A A . 33 LEU HD23 1 1 6 3002 1 1 12 LEU HG H -8.713 4.573 -4.715 1.00 . A A . 33 LEU HG 1 1 6 3003 1 1 12 LEU N N -7.362 3.619 -2.406 1.00 . A A . 33 LEU N 1 1 6 3004 1 1 12 LEU O O -6.154 5.061 -0.533 1.00 . A A . 33 LEU O 1 1 6 3005 1 1 13 SER C C -5.095 7.921 -0.095 1.00 . A A . 34 SER C 1 1 6 3006 1 1 13 SER CA C -4.128 7.024 -0.895 1.00 . A A . 34 SER CA 1 1 6 3007 1 1 13 SER CB C -3.084 7.926 -1.565 1.00 . A A . 34 SER CB 1 1 6 3008 1 1 13 SER H H -4.460 6.294 -2.870 1.00 . A A . 34 SER H 1 1 6 3009 1 1 13 SER HA H -3.613 6.376 -0.185 1.00 . A A . 34 SER HA 1 1 6 3010 1 1 13 SER HB2 H -3.595 8.655 -2.196 1.00 . A A . 34 SER HB2 1 1 6 3011 1 1 13 SER HB3 H -2.518 8.459 -0.800 1.00 . A A . 34 SER HB3 1 1 6 3012 1 1 13 SER HG H -1.674 7.775 -2.914 1.00 . A A . 34 SER HG 1 1 6 3013 1 1 13 SER N N -4.778 6.176 -1.917 1.00 . A A . 34 SER N 1 1 6 3014 1 1 13 SER O O -4.743 8.425 0.973 1.00 . A A . 34 SER O 1 1 6 3015 1 1 13 SER OG O -2.198 7.159 -2.365 1.00 . A A . 34 SER OG 1 1 6 3016 1 1 14 SER C C -8.426 7.970 0.773 1.00 . A A . 35 SER C 1 1 6 3017 1 1 14 SER CA C -7.417 8.869 0.030 1.00 . A A . 35 SER CA 1 1 6 3018 1 1 14 SER CB C -8.150 9.678 -1.047 1.00 . A A . 35 SER CB 1 1 6 3019 1 1 14 SER H H -6.510 7.750 -1.522 1.00 . A A . 35 SER H 1 1 6 3020 1 1 14 SER HA H -7.011 9.571 0.757 1.00 . A A . 35 SER HA 1 1 6 3021 1 1 14 SER HB2 H -9.005 10.194 -0.605 1.00 . A A . 35 SER HB2 1 1 6 3022 1 1 14 SER HB3 H -7.467 10.427 -1.453 1.00 . A A . 35 SER HB3 1 1 6 3023 1 1 14 SER HG H -9.057 9.370 -2.757 1.00 . A A . 35 SER HG 1 1 6 3024 1 1 14 SER N N -6.315 8.130 -0.607 1.00 . A A . 35 SER N 1 1 6 3025 1 1 14 SER O O -9.334 8.483 1.431 1.00 . A A . 35 SER O 1 1 6 3026 1 1 14 SER OG O -8.586 8.825 -2.097 1.00 . A A . 35 SER OG 1 1 6 3027 1 1 15 GLN C C -8.462 4.996 2.558 1.00 . A A . 36 GLN C 1 1 6 3028 1 1 15 GLN CA C -9.144 5.644 1.333 1.00 . A A . 36 GLN CA 1 1 6 3029 1 1 15 GLN CB C -9.525 4.594 0.272 1.00 . A A . 36 GLN CB 1 1 6 3030 1 1 15 GLN CD C -12.067 4.571 0.151 1.00 . A A . 36 GLN CD 1 1 6 3031 1 1 15 GLN CG C -10.815 3.819 0.594 1.00 . A A . 36 GLN CG 1 1 6 3032 1 1 15 GLN H H -7.476 6.297 0.170 1.00 . A A . 36 GLN H 1 1 6 3033 1 1 15 GLN HA H -10.056 6.132 1.675 1.00 . A A . 36 GLN HA 1 1 6 3034 1 1 15 GLN HB2 H -9.654 5.078 -0.697 1.00 . A A . 36 GLN HB2 1 1 6 3035 1 1 15 GLN HB3 H -8.703 3.886 0.177 1.00 . A A . 36 GLN HB3 1 1 6 3036 1 1 15 GLN HE21 H -12.181 3.571 -1.619 1.00 . A A . 36 GLN HE21 1 1 6 3037 1 1 15 GLN HE22 H -13.419 4.787 -1.314 1.00 . A A . 36 GLN HE22 1 1 6 3038 1 1 15 GLN HG2 H -10.793 2.866 0.069 1.00 . A A . 36 GLN HG2 1 1 6 3039 1 1 15 GLN HG3 H -10.871 3.604 1.661 1.00 . A A . 36 GLN HG3 1 1 6 3040 1 1 15 GLN N N -8.265 6.642 0.702 1.00 . A A . 36 GLN N 1 1 6 3041 1 1 15 GLN NE2 N -12.591 4.288 -1.024 1.00 . A A . 36 GLN NE2 1 1 6 3042 1 1 15 GLN O O -9.092 4.874 3.610 1.00 . A A . 36 GLN O 1 1 6 3043 1 1 15 GLN OE1 O -12.595 5.427 0.849 1.00 . A A . 36 GLN OE1 1 1 6 3044 1 1 16 CYS C C -4.821 4.874 3.206 1.00 . A A . 37 CYS C 1 1 6 3045 1 1 16 CYS CA C -6.225 4.300 3.500 1.00 . A A . 37 CYS CA 1 1 6 3046 1 1 16 CYS CB C -6.150 2.764 3.628 1.00 . A A . 37 CYS CB 1 1 6 3047 1 1 16 CYS H H -6.739 4.848 1.527 1.00 . A A . 37 CYS H 1 1 6 3048 1 1 16 CYS HA H -6.558 4.718 4.450 1.00 . A A . 37 CYS HA 1 1 6 3049 1 1 16 CYS HB2 H -6.121 2.305 2.640 1.00 . A A . 37 CYS HB2 1 1 6 3050 1 1 16 CYS HB3 H -5.218 2.490 4.117 1.00 . A A . 37 CYS HB3 1 1 6 3051 1 1 16 CYS N N -7.162 4.681 2.433 1.00 . A A . 37 CYS N 1 1 6 3052 1 1 16 CYS O O -4.567 5.426 2.133 1.00 . A A . 37 CYS O 1 1 6 3053 1 1 16 CYS SG S -7.513 2.113 4.630 1.00 . A A . 37 CYS SG 1 1 6 3054 1 1 17 ARG C C -1.746 4.601 2.812 1.00 . A A . 38 ARG C 1 1 6 3055 1 1 17 ARG CA C -2.485 5.150 4.042 1.00 . A A . 38 ARG CA 1 1 6 3056 1 1 17 ARG CB C -1.736 4.814 5.344 1.00 . A A . 38 ARG CB 1 1 6 3057 1 1 17 ARG CD C -2.543 4.888 7.792 1.00 . A A . 38 ARG CD 1 1 6 3058 1 1 17 ARG CG C -2.200 5.690 6.526 1.00 . A A . 38 ARG CG 1 1 6 3059 1 1 17 ARG CZ C -5.010 4.412 7.633 1.00 . A A . 38 ARG CZ 1 1 6 3060 1 1 17 ARG H H -4.175 4.244 5.004 1.00 . A A . 38 ARG H 1 1 6 3061 1 1 17 ARG HA H -2.476 6.235 3.915 1.00 . A A . 38 ARG HA 1 1 6 3062 1 1 17 ARG HB2 H -1.867 3.754 5.572 1.00 . A A . 38 ARG HB2 1 1 6 3063 1 1 17 ARG HB3 H -0.670 4.994 5.196 1.00 . A A . 38 ARG HB3 1 1 6 3064 1 1 17 ARG HD2 H -1.690 4.256 8.047 1.00 . A A . 38 ARG HD2 1 1 6 3065 1 1 17 ARG HD3 H -2.696 5.580 8.622 1.00 . A A . 38 ARG HD3 1 1 6 3066 1 1 17 ARG HE H -3.578 3.040 7.586 1.00 . A A . 38 ARG HE 1 1 6 3067 1 1 17 ARG HG2 H -1.394 6.385 6.772 1.00 . A A . 38 ARG HG2 1 1 6 3068 1 1 17 ARG HG3 H -3.063 6.292 6.241 1.00 . A A . 38 ARG HG3 1 1 6 3069 1 1 17 ARG HH11 H -4.676 6.364 7.905 1.00 . A A . 38 ARG HH11 1 1 6 3070 1 1 17 ARG HH12 H -6.350 5.904 7.784 1.00 . A A . 38 ARG HH12 1 1 6 3071 1 1 17 ARG HH21 H -5.717 2.551 7.402 1.00 . A A . 38 ARG HH21 1 1 6 3072 1 1 17 ARG HH22 H -6.913 3.805 7.434 1.00 . A A . 38 ARG HH22 1 1 6 3073 1 1 17 ARG N N -3.888 4.704 4.152 1.00 . A A . 38 ARG N 1 1 6 3074 1 1 17 ARG NE N -3.742 4.040 7.626 1.00 . A A . 38 ARG NE 1 1 6 3075 1 1 17 ARG NH1 N -5.374 5.657 7.760 1.00 . A A . 38 ARG NH1 1 1 6 3076 1 1 17 ARG NH2 N -5.947 3.526 7.487 1.00 . A A . 38 ARG NH2 1 1 6 3077 1 1 17 ARG O O -0.915 5.320 2.254 1.00 . A A . 38 ARG O 1 1 6 3078 1 1 18 ALA C C -2.465 1.664 0.550 1.00 . A A . 39 ALA C 1 1 6 3079 1 1 18 ALA CA C -1.598 2.838 1.072 1.00 . A A . 39 ALA CA 1 1 6 3080 1 1 18 ALA CB C -0.150 2.351 1.259 1.00 . A A . 39 ALA CB 1 1 6 3081 1 1 18 ALA H H -2.750 2.853 2.864 1.00 . A A . 39 ALA H 1 1 6 3082 1 1 18 ALA HA H -1.618 3.634 0.328 1.00 . A A . 39 ALA HA 1 1 6 3083 1 1 18 ALA HB1 H -0.132 1.560 2.009 1.00 . A A . 39 ALA HB1 1 1 6 3084 1 1 18 ALA HB2 H 0.242 1.949 0.326 1.00 . A A . 39 ALA HB2 1 1 6 3085 1 1 18 ALA HB3 H 0.489 3.173 1.577 1.00 . A A . 39 ALA HB3 1 1 6 3086 1 1 18 ALA N N -2.071 3.391 2.347 1.00 . A A . 39 ALA N 1 1 6 3087 1 1 18 ALA O O -3.158 1.010 1.336 1.00 . A A . 39 ALA O 1 1 6 3088 1 1 19 PRO C C -1.696 -1.057 -0.846 1.00 . A A . 40 PRO C 1 1 6 3089 1 1 19 PRO CA C -2.733 0.008 -1.266 1.00 . A A . 40 PRO CA 1 1 6 3090 1 1 19 PRO CB C -2.782 0.180 -2.787 1.00 . A A . 40 PRO CB 1 1 6 3091 1 1 19 PRO CD C -1.819 2.153 -1.826 1.00 . A A . 40 PRO CD 1 1 6 3092 1 1 19 PRO CG C -1.721 1.245 -3.054 1.00 . A A . 40 PRO CG 1 1 6 3093 1 1 19 PRO HA H -3.717 -0.291 -0.903 1.00 . A A . 40 PRO HA 1 1 6 3094 1 1 19 PRO HB2 H -2.562 -0.745 -3.317 1.00 . A A . 40 PRO HB2 1 1 6 3095 1 1 19 PRO HB3 H -3.763 0.562 -3.076 1.00 . A A . 40 PRO HB3 1 1 6 3096 1 1 19 PRO HD2 H -0.830 2.537 -1.578 1.00 . A A . 40 PRO HD2 1 1 6 3097 1 1 19 PRO HD3 H -2.500 2.979 -2.037 1.00 . A A . 40 PRO HD3 1 1 6 3098 1 1 19 PRO HG2 H -0.735 0.781 -3.086 1.00 . A A . 40 PRO HG2 1 1 6 3099 1 1 19 PRO HG3 H -1.918 1.791 -3.977 1.00 . A A . 40 PRO HG3 1 1 6 3100 1 1 19 PRO N N -2.376 1.332 -0.754 1.00 . A A . 40 PRO N 1 1 6 3101 1 1 19 PRO O O -0.605 -0.731 -0.374 1.00 . A A . 40 PRO O 1 1 6 3102 1 1 20 LYS C C 0.221 -3.579 -1.099 1.00 . A A . 41 LYS C 1 1 6 3103 1 1 20 LYS CA C -1.239 -3.524 -0.634 1.00 . A A . 41 LYS CA 1 1 6 3104 1 1 20 LYS CB C -2.022 -4.797 -1.028 1.00 . A A . 41 LYS CB 1 1 6 3105 1 1 20 LYS CD C -1.732 -6.026 1.211 1.00 . A A . 41 LYS CD 1 1 6 3106 1 1 20 LYS CE C -1.488 -7.388 1.866 1.00 . A A . 41 LYS CE 1 1 6 3107 1 1 20 LYS CG C -1.604 -6.101 -0.320 1.00 . A A . 41 LYS CG 1 1 6 3108 1 1 20 LYS H H -2.929 -2.513 -1.476 1.00 . A A . 41 LYS H 1 1 6 3109 1 1 20 LYS HA H -1.169 -3.468 0.447 1.00 . A A . 41 LYS HA 1 1 6 3110 1 1 20 LYS HB2 H -3.080 -4.639 -0.817 1.00 . A A . 41 LYS HB2 1 1 6 3111 1 1 20 LYS HB3 H -1.931 -4.945 -2.106 1.00 . A A . 41 LYS HB3 1 1 6 3112 1 1 20 LYS HD2 H -1.000 -5.317 1.603 1.00 . A A . 41 LYS HD2 1 1 6 3113 1 1 20 LYS HD3 H -2.737 -5.689 1.465 1.00 . A A . 41 LYS HD3 1 1 6 3114 1 1 20 LYS HE2 H -2.227 -8.099 1.482 1.00 . A A . 41 LYS HE2 1 1 6 3115 1 1 20 LYS HE3 H -0.495 -7.748 1.579 1.00 . A A . 41 LYS HE3 1 1 6 3116 1 1 20 LYS HG2 H -2.251 -6.900 -0.683 1.00 . A A . 41 LYS HG2 1 1 6 3117 1 1 20 LYS HG3 H -0.579 -6.357 -0.587 1.00 . A A . 41 LYS HG3 1 1 6 3118 1 1 20 LYS HZ1 H -2.491 -6.939 3.634 1.00 . A A . 41 LYS HZ1 1 1 6 3119 1 1 20 LYS HZ2 H -1.467 -8.204 3.777 1.00 . A A . 41 LYS HZ2 1 1 6 3120 1 1 20 LYS HZ3 H -0.886 -6.680 3.729 1.00 . A A . 41 LYS HZ3 1 1 6 3121 1 1 20 LYS N N -2.014 -2.339 -1.066 1.00 . A A . 41 LYS N 1 1 6 3122 1 1 20 LYS NZ N -1.590 -7.297 3.347 1.00 . A A . 41 LYS NZ 1 1 6 3123 1 1 20 LYS O O 1.017 -4.301 -0.499 1.00 . A A . 41 LYS O 1 1 6 3124 1 1 21 VAL C C 2.902 -2.131 -1.350 1.00 . A A . 42 VAL C 1 1 6 3125 1 1 21 VAL CA C 1.994 -2.541 -2.523 1.00 . A A . 42 VAL CA 1 1 6 3126 1 1 21 VAL CB C 2.026 -1.452 -3.622 1.00 . A A . 42 VAL CB 1 1 6 3127 1 1 21 VAL CG1 C 3.433 -1.225 -4.186 1.00 . A A . 42 VAL CG1 1 1 6 3128 1 1 21 VAL CG2 C 1.115 -1.807 -4.807 1.00 . A A . 42 VAL CG2 1 1 6 3129 1 1 21 VAL H H -0.127 -2.240 -2.537 1.00 . A A . 42 VAL H 1 1 6 3130 1 1 21 VAL HA H 2.396 -3.464 -2.945 1.00 . A A . 42 VAL HA 1 1 6 3131 1 1 21 VAL HB H 1.674 -0.512 -3.194 1.00 . A A . 42 VAL HB 1 1 6 3132 1 1 21 VAL HG11 H 3.830 -2.162 -4.576 1.00 . A A . 42 VAL HG11 1 1 6 3133 1 1 21 VAL HG12 H 3.400 -0.488 -4.988 1.00 . A A . 42 VAL HG12 1 1 6 3134 1 1 21 VAL HG13 H 4.097 -0.845 -3.411 1.00 . A A . 42 VAL HG13 1 1 6 3135 1 1 21 VAL HG21 H 1.404 -2.774 -5.223 1.00 . A A . 42 VAL HG21 1 1 6 3136 1 1 21 VAL HG22 H 0.071 -1.848 -4.497 1.00 . A A . 42 VAL HG22 1 1 6 3137 1 1 21 VAL HG23 H 1.199 -1.046 -5.583 1.00 . A A . 42 VAL HG23 1 1 6 3138 1 1 21 VAL N N 0.600 -2.785 -2.101 1.00 . A A . 42 VAL N 1 1 6 3139 1 1 21 VAL O O 4.077 -2.497 -1.323 1.00 . A A . 42 VAL O 1 1 6 3140 1 1 22 CYS C C 2.193 -0.713 2.011 1.00 . A A . 43 CYS C 1 1 6 3141 1 1 22 CYS CA C 3.079 -0.779 0.741 1.00 . A A . 43 CYS CA 1 1 6 3142 1 1 22 CYS CB C 3.518 0.606 0.223 1.00 . A A . 43 CYS CB 1 1 6 3143 1 1 22 CYS H H 1.364 -1.203 -0.426 1.00 . A A . 43 CYS H 1 1 6 3144 1 1 22 CYS HA H 3.970 -1.360 0.977 1.00 . A A . 43 CYS HA 1 1 6 3145 1 1 22 CYS HB2 H 3.956 0.478 -0.768 1.00 . A A . 43 CYS HB2 1 1 6 3146 1 1 22 CYS HB3 H 2.645 1.256 0.129 1.00 . A A . 43 CYS HB3 1 1 6 3147 1 1 22 CYS N N 2.357 -1.404 -0.369 1.00 . A A . 43 CYS N 1 1 6 3148 1 1 22 CYS O O 1.219 -1.453 2.153 1.00 . A A . 43 CYS O 1 1 6 3149 1 1 22 CYS SG S 4.757 1.371 1.301 1.00 . A A . 43 CYS SG 1 1 6 3150 1 1 23 PHE C C 1.685 2.211 4.133 1.00 . A A . 44 PHE C 1 1 6 3151 1 1 23 PHE CA C 1.736 0.669 4.050 1.00 . A A . 44 PHE CA 1 1 6 3152 1 1 23 PHE CB C 2.274 0.070 5.360 1.00 . A A . 44 PHE CB 1 1 6 3153 1 1 23 PHE CD1 C 4.791 0.434 5.339 1.00 . A A . 44 PHE CD1 1 1 6 3154 1 1 23 PHE CD2 C 3.435 1.715 6.903 1.00 . A A . 44 PHE CD2 1 1 6 3155 1 1 23 PHE CE1 C 5.944 1.097 5.802 1.00 . A A . 44 PHE CE1 1 1 6 3156 1 1 23 PHE CE2 C 4.587 2.374 7.367 1.00 . A A . 44 PHE CE2 1 1 6 3157 1 1 23 PHE CG C 3.532 0.744 5.886 1.00 . A A . 44 PHE CG 1 1 6 3158 1 1 23 PHE CZ C 5.842 2.067 6.813 1.00 . A A . 44 PHE CZ 1 1 6 3159 1 1 23 PHE H H 3.411 0.670 2.728 1.00 . A A . 44 PHE H 1 1 6 3160 1 1 23 PHE HA H 0.710 0.322 3.919 1.00 . A A . 44 PHE HA 1 1 6 3161 1 1 23 PHE HB2 H 1.493 0.158 6.116 1.00 . A A . 44 PHE HB2 1 1 6 3162 1 1 23 PHE HB3 H 2.465 -0.995 5.222 1.00 . A A . 44 PHE HB3 1 1 6 3163 1 1 23 PHE HD1 H 4.880 -0.310 4.560 1.00 . A A . 44 PHE HD1 1 1 6 3164 1 1 23 PHE HD2 H 2.470 1.962 7.326 1.00 . A A . 44 PHE HD2 1 1 6 3165 1 1 23 PHE HE1 H 6.910 0.858 5.380 1.00 . A A . 44 PHE HE1 1 1 6 3166 1 1 23 PHE HE2 H 4.510 3.116 8.151 1.00 . A A . 44 PHE HE2 1 1 6 3167 1 1 23 PHE HZ H 6.730 2.575 7.168 1.00 . A A . 44 PHE HZ 1 1 6 3168 1 1 23 PHE N N 2.542 0.192 2.922 1.00 . A A . 44 PHE N 1 1 6 3169 1 1 23 PHE O O 0.790 2.748 4.788 1.00 . A A . 44 PHE O 1 1 6 3170 1 1 24 LYS C C 3.440 4.981 2.256 1.00 . A A . 45 LYS C 1 1 6 3171 1 1 24 LYS CA C 2.698 4.406 3.473 1.00 . A A . 45 LYS CA 1 1 6 3172 1 1 24 LYS CB C 3.368 4.842 4.794 1.00 . A A . 45 LYS CB 1 1 6 3173 1 1 24 LYS CD C 4.067 6.790 6.304 1.00 . A A . 45 LYS CD 1 1 6 3174 1 1 24 LYS CE C 3.240 6.366 7.527 1.00 . A A . 45 LYS CE 1 1 6 3175 1 1 24 LYS CG C 3.409 6.369 4.978 1.00 . A A . 45 LYS CG 1 1 6 3176 1 1 24 LYS H H 3.302 2.420 2.929 1.00 . A A . 45 LYS H 1 1 6 3177 1 1 24 LYS HA H 1.687 4.818 3.450 1.00 . A A . 45 LYS HA 1 1 6 3178 1 1 24 LYS HB2 H 2.806 4.410 5.622 1.00 . A A . 45 LYS HB2 1 1 6 3179 1 1 24 LYS HB3 H 4.386 4.449 4.838 1.00 . A A . 45 LYS HB3 1 1 6 3180 1 1 24 LYS HD2 H 5.064 6.352 6.363 1.00 . A A . 45 LYS HD2 1 1 6 3181 1 1 24 LYS HD3 H 4.169 7.875 6.303 1.00 . A A . 45 LYS HD3 1 1 6 3182 1 1 24 LYS HE2 H 2.235 6.786 7.433 1.00 . A A . 45 LYS HE2 1 1 6 3183 1 1 24 LYS HE3 H 3.150 5.276 7.537 1.00 . A A . 45 LYS HE3 1 1 6 3184 1 1 24 LYS HG2 H 3.983 6.814 4.165 1.00 . A A . 45 LYS HG2 1 1 6 3185 1 1 24 LYS HG3 H 2.393 6.766 4.938 1.00 . A A . 45 LYS HG3 1 1 6 3186 1 1 24 LYS HZ1 H 4.793 6.448 8.912 1.00 . A A . 45 LYS HZ1 1 1 6 3187 1 1 24 LYS HZ2 H 3.942 7.838 8.819 1.00 . A A . 45 LYS HZ2 1 1 6 3188 1 1 24 LYS HZ3 H 3.316 6.550 9.596 1.00 . A A . 45 LYS HZ3 1 1 6 3189 1 1 24 LYS N N 2.613 2.930 3.467 1.00 . A A . 45 LYS N 1 1 6 3190 1 1 24 LYS NZ N 3.865 6.831 8.794 1.00 . A A . 45 LYS NZ 1 1 6 3191 1 1 24 LYS O O 2.840 5.728 1.480 1.00 . A A . 45 LYS O 1 1 6 3192 1 1 25 CYS C C 5.302 5.014 -0.373 1.00 . A A . 46 CYS C 1 1 6 3193 1 1 25 CYS CA C 5.642 5.260 1.117 1.00 . A A . 46 CYS CA 1 1 6 3194 1 1 25 CYS CB C 7.095 4.852 1.461 1.00 . A A . 46 CYS CB 1 1 6 3195 1 1 25 CYS H H 5.143 4.024 2.752 1.00 . A A . 46 CYS H 1 1 6 3196 1 1 25 CYS HA H 5.581 6.341 1.258 1.00 . A A . 46 CYS HA 1 1 6 3197 1 1 25 CYS HB2 H 7.654 4.679 0.538 1.00 . A A . 46 CYS HB2 1 1 6 3198 1 1 25 CYS HB3 H 7.569 5.698 1.964 1.00 . A A . 46 CYS HB3 1 1 6 3199 1 1 25 CYS N N 4.719 4.648 2.081 1.00 . A A . 46 CYS N 1 1 6 3200 1 1 25 CYS O O 5.531 5.902 -1.197 1.00 . A A . 46 CYS O 1 1 6 3201 1 1 25 CYS SG S 7.240 3.395 2.544 1.00 . A A . 46 CYS SG 1 1 6 3202 1 1 26 LYS C C 4.900 3.760 -3.315 1.00 . A A . 47 LYS C 1 1 6 3203 1 1 26 LYS CA C 4.132 3.443 -2.008 1.00 . A A . 47 LYS CA 1 1 6 3204 1 1 26 LYS CB C 2.646 3.869 -2.038 1.00 . A A . 47 LYS CB 1 1 6 3205 1 1 26 LYS CD C 0.930 5.749 -2.284 1.00 . A A . 47 LYS CD 1 1 6 3206 1 1 26 LYS CE C 0.142 5.479 -0.994 1.00 . A A . 47 LYS CE 1 1 6 3207 1 1 26 LYS CG C 2.419 5.385 -2.188 1.00 . A A . 47 LYS CG 1 1 6 3208 1 1 26 LYS H H 4.619 3.193 0.059 1.00 . A A . 47 LYS H 1 1 6 3209 1 1 26 LYS HA H 4.115 2.354 -1.996 1.00 . A A . 47 LYS HA 1 1 6 3210 1 1 26 LYS HB2 H 2.154 3.358 -2.869 1.00 . A A . 47 LYS HB2 1 1 6 3211 1 1 26 LYS HB3 H 2.174 3.523 -1.119 1.00 . A A . 47 LYS HB3 1 1 6 3212 1 1 26 LYS HD2 H 0.839 6.804 -2.543 1.00 . A A . 47 LYS HD2 1 1 6 3213 1 1 26 LYS HD3 H 0.480 5.173 -3.094 1.00 . A A . 47 LYS HD3 1 1 6 3214 1 1 26 LYS HE2 H -0.923 5.577 -1.218 1.00 . A A . 47 LYS HE2 1 1 6 3215 1 1 26 LYS HE3 H 0.320 4.450 -0.673 1.00 . A A . 47 LYS HE3 1 1 6 3216 1 1 26 LYS HG2 H 2.859 5.914 -1.345 1.00 . A A . 47 LYS HG2 1 1 6 3217 1 1 26 LYS HG3 H 2.910 5.733 -3.097 1.00 . A A . 47 LYS HG3 1 1 6 3218 1 1 26 LYS HZ1 H 0.351 7.383 -0.175 1.00 . A A . 47 LYS HZ1 1 1 6 3219 1 1 26 LYS HZ2 H -0.060 6.233 0.925 1.00 . A A . 47 LYS HZ2 1 1 6 3220 1 1 26 LYS HZ3 H 1.470 6.309 0.386 1.00 . A A . 47 LYS HZ3 1 1 6 3221 1 1 26 LYS N N 4.723 3.851 -0.707 1.00 . A A . 47 LYS N 1 1 6 3222 1 1 26 LYS NZ N 0.501 6.421 0.098 1.00 . A A . 47 LYS NZ 1 1 6 3223 1 1 26 LYS O O 4.300 3.768 -4.390 1.00 . A A . 47 LYS O 1 1 6 3224 1 1 27 GLN C C 7.140 3.084 -5.413 1.00 . A A . 48 GLN C 1 1 6 3225 1 1 27 GLN CA C 7.050 4.291 -4.439 1.00 . A A . 48 GLN CA 1 1 6 3226 1 1 27 GLN CB C 8.454 4.745 -3.995 1.00 . A A . 48 GLN CB 1 1 6 3227 1 1 27 GLN CD C 7.779 7.196 -3.731 1.00 . A A . 48 GLN CD 1 1 6 3228 1 1 27 GLN CG C 8.470 5.991 -3.094 1.00 . A A . 48 GLN CG 1 1 6 3229 1 1 27 GLN H H 6.650 3.991 -2.348 1.00 . A A . 48 GLN H 1 1 6 3230 1 1 27 GLN HA H 6.570 5.116 -4.963 1.00 . A A . 48 GLN HA 1 1 6 3231 1 1 27 GLN HB2 H 8.939 3.932 -3.461 1.00 . A A . 48 GLN HB2 1 1 6 3232 1 1 27 GLN HB3 H 9.054 4.959 -4.881 1.00 . A A . 48 GLN HB3 1 1 6 3233 1 1 27 GLN HE21 H 6.190 7.072 -2.484 1.00 . A A . 48 GLN HE21 1 1 6 3234 1 1 27 GLN HE22 H 6.160 8.379 -3.674 1.00 . A A . 48 GLN HE22 1 1 6 3235 1 1 27 GLN HG2 H 8.006 5.758 -2.138 1.00 . A A . 48 GLN HG2 1 1 6 3236 1 1 27 GLN HG3 H 9.509 6.258 -2.888 1.00 . A A . 48 GLN HG3 1 1 6 3237 1 1 27 GLN N N 6.214 3.999 -3.256 1.00 . A A . 48 GLN N 1 1 6 3238 1 1 27 GLN NE2 N 6.615 7.583 -3.256 1.00 . A A . 48 GLN NE2 1 1 6 3239 1 1 27 GLN O O 7.071 1.941 -4.945 1.00 . A A . 48 GLN O 1 1 6 3240 1 1 27 GLN OE1 O 8.268 7.799 -4.679 1.00 . A A . 48 GLN OE1 1 1 6 3241 1 1 28 PRO C C 7.875 0.923 -7.664 1.00 . A A . 49 PRO C 1 1 6 3242 1 1 28 PRO CA C 7.167 2.287 -7.796 1.00 . A A . 49 PRO CA 1 1 6 3243 1 1 28 PRO CB C 7.615 2.975 -9.091 1.00 . A A . 49 PRO CB 1 1 6 3244 1 1 28 PRO CD C 7.554 4.607 -7.355 1.00 . A A . 49 PRO CD 1 1 6 3245 1 1 28 PRO CG C 7.272 4.437 -8.845 1.00 . A A . 49 PRO CG 1 1 6 3246 1 1 28 PRO HA H 6.098 2.087 -7.876 1.00 . A A . 49 PRO HA 1 1 6 3247 1 1 28 PRO HB2 H 8.695 2.873 -9.216 1.00 . A A . 49 PRO HB2 1 1 6 3248 1 1 28 PRO HB3 H 7.091 2.578 -9.961 1.00 . A A . 49 PRO HB3 1 1 6 3249 1 1 28 PRO HD2 H 8.596 4.904 -7.216 1.00 . A A . 49 PRO HD2 1 1 6 3250 1 1 28 PRO HD3 H 6.892 5.374 -6.958 1.00 . A A . 49 PRO HD3 1 1 6 3251 1 1 28 PRO HG2 H 7.883 5.106 -9.452 1.00 . A A . 49 PRO HG2 1 1 6 3252 1 1 28 PRO HG3 H 6.211 4.602 -9.037 1.00 . A A . 49 PRO HG3 1 1 6 3253 1 1 28 PRO N N 7.337 3.299 -6.735 1.00 . A A . 49 PRO N 1 1 6 3254 1 1 28 PRO O O 7.419 -0.045 -8.276 1.00 . A A . 49 PRO O 1 1 6 3255 1 1 29 GLY C C 10.455 -0.595 -5.378 1.00 . A A . 50 GLY C 1 1 6 3256 1 1 29 GLY CA C 9.731 -0.432 -6.723 1.00 . A A . 50 GLY CA 1 1 6 3257 1 1 29 GLY H H 9.339 1.671 -6.503 1.00 . A A . 50 GLY H 1 1 6 3258 1 1 29 GLY HA2 H 10.477 -0.501 -7.514 1.00 . A A . 50 GLY HA2 1 1 6 3259 1 1 29 GLY HA3 H 9.057 -1.284 -6.825 1.00 . A A . 50 GLY HA3 1 1 6 3260 1 1 29 GLY N N 8.971 0.820 -6.901 1.00 . A A . 50 GLY N 1 1 6 3261 1 1 29 GLY O O 11.166 -1.581 -5.180 1.00 . A A . 50 GLY O 1 1 6 3262 1 1 30 HIS C C 10.566 -0.843 -2.229 1.00 . A A . 51 HIS C 1 1 6 3263 1 1 30 HIS CA C 10.958 0.344 -3.134 1.00 . A A . 51 HIS CA 1 1 6 3264 1 1 30 HIS CB C 10.650 1.669 -2.413 1.00 . A A . 51 HIS CB 1 1 6 3265 1 1 30 HIS CD2 C 9.116 1.658 -0.365 1.00 . A A . 51 HIS CD2 1 1 6 3266 1 1 30 HIS CE1 C 7.159 1.370 -1.320 1.00 . A A . 51 HIS CE1 1 1 6 3267 1 1 30 HIS CG C 9.304 1.682 -1.720 1.00 . A A . 51 HIS CG 1 1 6 3268 1 1 30 HIS H H 9.690 1.130 -4.664 1.00 . A A . 51 HIS H 1 1 6 3269 1 1 30 HIS HA H 12.034 0.290 -3.304 1.00 . A A . 51 HIS HA 1 1 6 3270 1 1 30 HIS HB2 H 11.421 1.823 -1.655 1.00 . A A . 51 HIS HB2 1 1 6 3271 1 1 30 HIS HB3 H 10.720 2.499 -3.113 1.00 . A A . 51 HIS HB3 1 1 6 3272 1 1 30 HIS HD1 H 7.839 1.504 -3.294 1.00 . A A . 51 HIS HD1 1 1 6 3273 1 1 30 HIS HD2 H 9.897 1.708 0.382 1.00 . A A . 51 HIS HD2 1 1 6 3274 1 1 30 HIS HE1 H 6.102 1.200 -1.474 1.00 . A A . 51 HIS HE1 1 1 6 3275 1 1 30 HIS N N 10.285 0.348 -4.444 1.00 . A A . 51 HIS N 1 1 6 3276 1 1 30 HIS ND1 N 8.063 1.511 -2.300 1.00 . A A . 51 HIS ND1 1 1 6 3277 1 1 30 HIS NE2 N 7.751 1.463 -0.120 1.00 . A A . 51 HIS NE2 1 1 6 3278 1 1 30 HIS O O 11.335 -1.249 -1.357 1.00 . A A . 51 HIS O 1 1 6 3279 1 1 31 PHE C C 9.586 -3.656 -1.414 1.00 . A A . 52 PHE C 1 1 6 3280 1 1 31 PHE CA C 8.760 -2.367 -1.499 1.00 . A A . 52 PHE CA 1 1 6 3281 1 1 31 PHE CB C 7.295 -2.614 -1.888 1.00 . A A . 52 PHE CB 1 1 6 3282 1 1 31 PHE CD1 C 7.081 -4.293 -3.784 1.00 . A A . 52 PHE CD1 1 1 6 3283 1 1 31 PHE CD2 C 6.778 -1.927 -4.275 1.00 . A A . 52 PHE CD2 1 1 6 3284 1 1 31 PHE CE1 C 6.861 -4.601 -5.139 1.00 . A A . 52 PHE CE1 1 1 6 3285 1 1 31 PHE CE2 C 6.553 -2.237 -5.628 1.00 . A A . 52 PHE CE2 1 1 6 3286 1 1 31 PHE CG C 7.048 -2.954 -3.348 1.00 . A A . 52 PHE CG 1 1 6 3287 1 1 31 PHE CZ C 6.600 -3.574 -6.061 1.00 . A A . 52 PHE CZ 1 1 6 3288 1 1 31 PHE H H 8.782 -1.020 -3.149 1.00 . A A . 52 PHE H 1 1 6 3289 1 1 31 PHE HA H 8.757 -1.933 -0.499 1.00 . A A . 52 PHE HA 1 1 6 3290 1 1 31 PHE HB2 H 6.894 -3.413 -1.262 1.00 . A A . 52 PHE HB2 1 1 6 3291 1 1 31 PHE HB3 H 6.729 -1.713 -1.649 1.00 . A A . 52 PHE HB3 1 1 6 3292 1 1 31 PHE HD1 H 7.283 -5.090 -3.082 1.00 . A A . 52 PHE HD1 1 1 6 3293 1 1 31 PHE HD2 H 6.723 -0.898 -3.952 1.00 . A A . 52 PHE HD2 1 1 6 3294 1 1 31 PHE HE1 H 6.898 -5.630 -5.471 1.00 . A A . 52 PHE HE1 1 1 6 3295 1 1 31 PHE HE2 H 6.334 -1.448 -6.334 1.00 . A A . 52 PHE HE2 1 1 6 3296 1 1 31 PHE HZ H 6.428 -3.811 -7.104 1.00 . A A . 52 PHE HZ 1 1 6 3297 1 1 31 PHE N N 9.357 -1.387 -2.407 1.00 . A A . 52 PHE N 1 1 6 3298 1 1 31 PHE O O 9.862 -4.121 -0.309 1.00 . A A . 52 PHE O 1 1 6 3299 1 1 32 SER C C 12.299 -5.244 -1.834 1.00 . A A . 53 SER C 1 1 6 3300 1 1 32 SER CA C 10.972 -5.351 -2.613 1.00 . A A . 53 SER CA 1 1 6 3301 1 1 32 SER CB C 11.279 -5.675 -4.082 1.00 . A A . 53 SER CB 1 1 6 3302 1 1 32 SER H H 9.829 -3.738 -3.414 1.00 . A A . 53 SER H 1 1 6 3303 1 1 32 SER HA H 10.426 -6.196 -2.194 1.00 . A A . 53 SER HA 1 1 6 3304 1 1 32 SER HB2 H 11.851 -4.855 -4.521 1.00 . A A . 53 SER HB2 1 1 6 3305 1 1 32 SER HB3 H 11.874 -6.588 -4.136 1.00 . A A . 53 SER HB3 1 1 6 3306 1 1 32 SER HG H 10.308 -6.091 -5.734 1.00 . A A . 53 SER HG 1 1 6 3307 1 1 32 SER N N 10.100 -4.162 -2.537 1.00 . A A . 53 SER N 1 1 6 3308 1 1 32 SER O O 13.027 -6.236 -1.735 1.00 . A A . 53 SER O 1 1 6 3309 1 1 32 SER OG O 10.076 -5.859 -4.813 1.00 . A A . 53 SER OG 1 1 6 3310 1 1 33 LYS C C 13.513 -3.001 0.840 1.00 . A A . 54 LYS C 1 1 6 3311 1 1 33 LYS CA C 13.810 -3.789 -0.452 1.00 . A A . 54 LYS CA 1 1 6 3312 1 1 33 LYS CB C 14.890 -3.126 -1.332 1.00 . A A . 54 LYS CB 1 1 6 3313 1 1 33 LYS CD C 15.611 -1.041 -2.647 1.00 . A A . 54 LYS CD 1 1 6 3314 1 1 33 LYS CE C 16.002 -1.779 -3.937 1.00 . A A . 54 LYS CE 1 1 6 3315 1 1 33 LYS CG C 14.477 -1.752 -1.895 1.00 . A A . 54 LYS CG 1 1 6 3316 1 1 33 LYS H H 11.983 -3.294 -1.437 1.00 . A A . 54 LYS H 1 1 6 3317 1 1 33 LYS HA H 14.213 -4.743 -0.105 1.00 . A A . 54 LYS HA 1 1 6 3318 1 1 33 LYS HB2 H 15.802 -3.010 -0.745 1.00 . A A . 54 LYS HB2 1 1 6 3319 1 1 33 LYS HB3 H 15.118 -3.799 -2.162 1.00 . A A . 54 LYS HB3 1 1 6 3320 1 1 33 LYS HD2 H 15.272 -0.035 -2.903 1.00 . A A . 54 LYS HD2 1 1 6 3321 1 1 33 LYS HD3 H 16.480 -0.955 -1.991 1.00 . A A . 54 LYS HD3 1 1 6 3322 1 1 33 LYS HE2 H 16.340 -2.788 -3.680 1.00 . A A . 54 LYS HE2 1 1 6 3323 1 1 33 LYS HE3 H 15.115 -1.872 -4.570 1.00 . A A . 54 LYS HE3 1 1 6 3324 1 1 33 LYS HG2 H 13.633 -1.875 -2.573 1.00 . A A . 54 LYS HG2 1 1 6 3325 1 1 33 LYS HG3 H 14.166 -1.108 -1.071 1.00 . A A . 54 LYS HG3 1 1 6 3326 1 1 33 LYS HZ1 H 16.786 -0.129 -4.930 1.00 . A A . 54 LYS HZ1 1 1 6 3327 1 1 33 LYS HZ2 H 17.914 -0.979 -4.109 1.00 . A A . 54 LYS HZ2 1 1 6 3328 1 1 33 LYS HZ3 H 17.327 -1.550 -5.519 1.00 . A A . 54 LYS HZ3 1 1 6 3329 1 1 33 LYS N N 12.618 -4.067 -1.273 1.00 . A A . 54 LYS N 1 1 6 3330 1 1 33 LYS NZ N 17.077 -1.061 -4.670 1.00 . A A . 54 LYS NZ 1 1 6 3331 1 1 33 LYS O O 14.450 -2.521 1.482 1.00 . A A . 54 LYS O 1 1 6 3332 1 1 34 GLN C C 10.539 -2.734 3.109 1.00 . A A . 55 GLN C 1 1 6 3333 1 1 34 GLN CA C 11.849 -2.197 2.492 1.00 . A A . 55 GLN CA 1 1 6 3334 1 1 34 GLN CB C 11.735 -0.681 2.238 1.00 . A A . 55 GLN CB 1 1 6 3335 1 1 34 GLN CD C 11.332 1.579 3.308 1.00 . A A . 55 GLN CD 1 1 6 3336 1 1 34 GLN CG C 11.667 0.112 3.552 1.00 . A A . 55 GLN CG 1 1 6 3337 1 1 34 GLN H H 11.528 -3.325 0.686 1.00 . A A . 55 GLN H 1 1 6 3338 1 1 34 GLN HA H 12.638 -2.358 3.228 1.00 . A A . 55 GLN HA 1 1 6 3339 1 1 34 GLN HB2 H 12.603 -0.335 1.677 1.00 . A A . 55 GLN HB2 1 1 6 3340 1 1 34 GLN HB3 H 10.845 -0.479 1.639 1.00 . A A . 55 GLN HB3 1 1 6 3341 1 1 34 GLN HE21 H 9.356 1.203 3.416 1.00 . A A . 55 GLN HE21 1 1 6 3342 1 1 34 GLN HE22 H 9.801 2.880 3.135 1.00 . A A . 55 GLN HE22 1 1 6 3343 1 1 34 GLN HG2 H 10.902 -0.310 4.204 1.00 . A A . 55 GLN HG2 1 1 6 3344 1 1 34 GLN HG3 H 12.626 0.043 4.066 1.00 . A A . 55 GLN HG3 1 1 6 3345 1 1 34 GLN N N 12.239 -2.861 1.235 1.00 . A A . 55 GLN N 1 1 6 3346 1 1 34 GLN NE2 N 10.062 1.918 3.294 1.00 . A A . 55 GLN NE2 1 1 6 3347 1 1 34 GLN O O 10.525 -3.093 4.289 1.00 . A A . 55 GLN O 1 1 6 3348 1 1 34 GLN OE1 O 12.191 2.431 3.122 1.00 . A A . 55 GLN OE1 1 1 6 3349 1 1 35 CYS C C 7.547 -4.461 2.454 1.00 . A A . 56 CYS C 1 1 6 3350 1 1 35 CYS CA C 8.083 -3.049 2.804 1.00 . A A . 56 CYS CA 1 1 6 3351 1 1 35 CYS CB C 7.174 -1.934 2.253 1.00 . A A . 56 CYS CB 1 1 6 3352 1 1 35 CYS H H 9.554 -2.487 1.374 1.00 . A A . 56 CYS H 1 1 6 3353 1 1 35 CYS HA H 8.069 -2.969 3.892 1.00 . A A . 56 CYS HA 1 1 6 3354 1 1 35 CYS HB2 H 7.125 -1.999 1.164 1.00 . A A . 56 CYS HB2 1 1 6 3355 1 1 35 CYS HB3 H 6.163 -2.080 2.644 1.00 . A A . 56 CYS HB3 1 1 6 3356 1 1 35 CYS N N 9.456 -2.803 2.326 1.00 . A A . 56 CYS N 1 1 6 3357 1 1 35 CYS O O 6.428 -4.824 2.836 1.00 . A A . 56 CYS O 1 1 6 3358 1 1 35 CYS SG S 7.777 -0.294 2.756 1.00 . A A . 56 CYS SG 1 1 6 3359 1 1 36 ARG C C 9.294 -7.473 1.014 1.00 . A A . 57 ARG C 1 1 6 3360 1 1 36 ARG CA C 8.033 -6.605 1.220 1.00 . A A . 57 ARG CA 1 1 6 3361 1 1 36 ARG CB C 7.208 -6.463 -0.081 1.00 . A A . 57 ARG CB 1 1 6 3362 1 1 36 ARG CD C 5.201 -7.823 0.826 1.00 . A A . 57 ARG CD 1 1 6 3363 1 1 36 ARG CG C 6.191 -7.595 -0.330 1.00 . A A . 57 ARG CG 1 1 6 3364 1 1 36 ARG CZ C 3.576 -5.915 0.853 1.00 . A A . 57 ARG CZ 1 1 6 3365 1 1 36 ARG H H 9.181 -4.813 1.359 1.00 . A A . 57 ARG H 1 1 6 3366 1 1 36 ARG HA H 7.448 -7.108 1.988 1.00 . A A . 57 ARG HA 1 1 6 3367 1 1 36 ARG HB2 H 6.648 -5.527 -0.058 1.00 . A A . 57 ARG HB2 1 1 6 3368 1 1 36 ARG HB3 H 7.884 -6.396 -0.934 1.00 . A A . 57 ARG HB3 1 1 6 3369 1 1 36 ARG HD2 H 4.411 -8.500 0.494 1.00 . A A . 57 ARG HD2 1 1 6 3370 1 1 36 ARG HD3 H 5.719 -8.322 1.646 1.00 . A A . 57 ARG HD3 1 1 6 3371 1 1 36 ARG HE H 5.151 -6.070 2.044 1.00 . A A . 57 ARG HE 1 1 6 3372 1 1 36 ARG HG2 H 5.625 -7.346 -1.228 1.00 . A A . 57 ARG HG2 1 1 6 3373 1 1 36 ARG HG3 H 6.721 -8.529 -0.523 1.00 . A A . 57 ARG HG3 1 1 6 3374 1 1 36 ARG HH11 H 3.061 -7.268 -0.530 1.00 . A A . 57 ARG HH11 1 1 6 3375 1 1 36 ARG HH12 H 2.067 -5.819 -0.444 1.00 . A A . 57 ARG HH12 1 1 6 3376 1 1 36 ARG HH21 H 3.779 -4.341 2.074 1.00 . A A . 57 ARG HH21 1 1 6 3377 1 1 36 ARG HH22 H 2.440 -4.282 0.935 1.00 . A A . 57 ARG HH22 1 1 6 3378 1 1 36 ARG N N 8.339 -5.251 1.718 1.00 . A A . 57 ARG N 1 1 6 3379 1 1 36 ARG NE N 4.624 -6.557 1.325 1.00 . A A . 57 ARG NE 1 1 6 3380 1 1 36 ARG NH1 N 2.841 -6.382 -0.113 1.00 . A A . 57 ARG NH1 1 1 6 3381 1 1 36 ARG NH2 N 3.233 -4.760 1.341 1.00 . A A . 57 ARG NH2 1 1 6 3382 1 1 36 ARG O O 9.257 -8.450 0.261 1.00 . A A . 57 ARG O 1 1 6 3383 1 1 37 SER C C 11.688 -9.275 1.814 1.00 . A A . 58 SER C 1 1 6 3384 1 1 37 SER CA C 11.734 -7.755 1.596 1.00 . A A . 58 SER CA 1 1 6 3385 1 1 37 SER CB C 12.671 -7.129 2.631 1.00 . A A . 58 SER CB 1 1 6 3386 1 1 37 SER H H 10.345 -6.278 2.236 1.00 . A A . 58 SER H 1 1 6 3387 1 1 37 SER HA H 12.164 -7.583 0.611 1.00 . A A . 58 SER HA 1 1 6 3388 1 1 37 SER HB2 H 12.304 -7.349 3.637 1.00 . A A . 58 SER HB2 1 1 6 3389 1 1 37 SER HB3 H 13.667 -7.568 2.523 1.00 . A A . 58 SER HB3 1 1 6 3390 1 1 37 SER HG H 13.334 -5.347 3.113 1.00 . A A . 58 SER HG 1 1 6 3391 1 1 37 SER N N 10.409 -7.096 1.652 1.00 . A A . 58 SER N 1 1 6 3392 1 1 37 SER O O 11.055 -9.731 2.792 1.00 . A A . 58 SER O 1 1 6 3393 1 1 37 SER OXT O 12.324 -10.006 1.018 1.00 . A A . 58 SER OXT 1 1 6 3394 1 1 37 SER OG O 12.735 -5.725 2.437 1.00 . A A . 58 SER OG 1 1 6 3395 2 2 1 ZN ZN ZN -8.345 0.279 3.844 1.00 . B A . 1059 ZN ZN 1 1 6 3396 3 2 1 ZN ZN ZN 6.880 1.401 1.747 1.00 . C A . 1060 ZN ZN 1 1 7 3397 1 1 1 GLN C C -6.301 -1.471 -4.513 1.00 . A A . 22 GLN C 1 1 7 3398 1 1 1 GLN CA C -6.090 -1.029 -5.958 1.00 . A A . 22 GLN CA 1 1 7 3399 1 1 1 GLN CB C -4.668 -0.449 -6.128 1.00 . A A . 22 GLN CB 1 1 7 3400 1 1 1 GLN CD C -3.984 -1.609 -8.327 1.00 . A A . 22 GLN CD 1 1 7 3401 1 1 1 GLN CG C -4.206 -0.286 -7.588 1.00 . A A . 22 GLN CG 1 1 7 3402 1 1 1 GLN H1 H -8.062 -0.472 -6.212 1.00 . A A . 22 GLN H1 1 1 7 3403 1 1 1 GLN H2 H -7.098 0.762 -5.746 1.00 . A A . 22 GLN H2 1 1 7 3404 1 1 1 GLN H3 H -7.051 0.226 -7.303 1.00 . A A . 22 GLN H3 1 1 7 3405 1 1 1 GLN HA H -6.184 -1.915 -6.585 1.00 . A A . 22 GLN HA 1 1 7 3406 1 1 1 GLN HB2 H -4.618 0.524 -5.636 1.00 . A A . 22 GLN HB2 1 1 7 3407 1 1 1 GLN HB3 H -3.954 -1.105 -5.623 1.00 . A A . 22 GLN HB3 1 1 7 3408 1 1 1 GLN HE21 H -2.847 -0.747 -9.762 1.00 . A A . 22 GLN HE21 1 1 7 3409 1 1 1 GLN HE22 H -3.112 -2.481 -9.899 1.00 . A A . 22 GLN HE22 1 1 7 3410 1 1 1 GLN HG2 H -4.920 0.320 -8.147 1.00 . A A . 22 GLN HG2 1 1 7 3411 1 1 1 GLN HG3 H -3.260 0.258 -7.579 1.00 . A A . 22 GLN HG3 1 1 7 3412 1 1 1 GLN N N -7.148 -0.057 -6.340 1.00 . A A . 22 GLN N 1 1 7 3413 1 1 1 GLN NE2 N -3.254 -1.605 -9.418 1.00 . A A . 22 GLN NE2 1 1 7 3414 1 1 1 GLN O O -6.429 -0.624 -3.635 1.00 . A A . 22 GLN O 1 1 7 3415 1 1 1 GLN OE1 O -4.462 -2.667 -7.944 1.00 . A A . 22 GLN OE1 1 1 7 3416 1 1 2 THR C C -5.903 -2.801 -1.780 1.00 . A A . 23 THR C 1 1 7 3417 1 1 2 THR CA C -6.712 -3.375 -2.947 1.00 . A A . 23 THR CA 1 1 7 3418 1 1 2 THR CB C -6.544 -4.904 -2.999 1.00 . A A . 23 THR CB 1 1 7 3419 1 1 2 THR CG2 C -7.185 -5.624 -1.811 1.00 . A A . 23 THR CG2 1 1 7 3420 1 1 2 THR H H -6.263 -3.437 -5.022 1.00 . A A . 23 THR H 1 1 7 3421 1 1 2 THR HA H -7.759 -3.164 -2.752 1.00 . A A . 23 THR HA 1 1 7 3422 1 1 2 THR HB H -5.482 -5.151 -3.045 1.00 . A A . 23 THR HB 1 1 7 3423 1 1 2 THR HG1 H -6.981 -6.350 -4.229 1.00 . A A . 23 THR HG1 1 1 7 3424 1 1 2 THR HG21 H -8.247 -5.390 -1.765 1.00 . A A . 23 THR HG21 1 1 7 3425 1 1 2 THR HG22 H -7.064 -6.700 -1.927 1.00 . A A . 23 THR HG22 1 1 7 3426 1 1 2 THR HG23 H -6.700 -5.325 -0.881 1.00 . A A . 23 THR HG23 1 1 7 3427 1 1 2 THR N N -6.369 -2.781 -4.258 1.00 . A A . 23 THR N 1 1 7 3428 1 1 2 THR O O -4.689 -2.634 -1.887 1.00 . A A . 23 THR O 1 1 7 3429 1 1 2 THR OG1 O -7.181 -5.400 -4.161 1.00 . A A . 23 THR OG1 1 1 7 3430 1 1 3 CYS C C -4.861 -2.838 1.164 1.00 . A A . 24 CYS C 1 1 7 3431 1 1 3 CYS CA C -5.994 -1.975 0.570 1.00 . A A . 24 CYS CA 1 1 7 3432 1 1 3 CYS CB C -7.137 -1.852 1.582 1.00 . A A . 24 CYS CB 1 1 7 3433 1 1 3 CYS H H -7.580 -2.627 -0.681 1.00 . A A . 24 CYS H 1 1 7 3434 1 1 3 CYS HA H -5.607 -0.978 0.357 1.00 . A A . 24 CYS HA 1 1 7 3435 1 1 3 CYS HB2 H -8.010 -1.421 1.099 1.00 . A A . 24 CYS HB2 1 1 7 3436 1 1 3 CYS HB3 H -7.404 -2.847 1.941 1.00 . A A . 24 CYS HB3 1 1 7 3437 1 1 3 CYS N N -6.578 -2.515 -0.661 1.00 . A A . 24 CYS N 1 1 7 3438 1 1 3 CYS O O -4.886 -4.070 1.074 1.00 . A A . 24 CYS O 1 1 7 3439 1 1 3 CYS SG S -6.625 -0.797 2.961 1.00 . A A . 24 CYS SG 1 1 7 3440 1 1 4 TYR C C -3.588 -3.533 3.997 1.00 . A A . 25 TYR C 1 1 7 3441 1 1 4 TYR CA C -2.958 -2.867 2.752 1.00 . A A . 25 TYR CA 1 1 7 3442 1 1 4 TYR CB C -1.857 -1.880 3.177 1.00 . A A . 25 TYR CB 1 1 7 3443 1 1 4 TYR CD1 C -3.254 -0.134 4.406 1.00 . A A . 25 TYR CD1 1 1 7 3444 1 1 4 TYR CD2 C -1.348 -1.127 5.548 1.00 . A A . 25 TYR CD2 1 1 7 3445 1 1 4 TYR CE1 C -3.545 0.625 5.554 1.00 . A A . 25 TYR CE1 1 1 7 3446 1 1 4 TYR CE2 C -1.625 -0.353 6.693 1.00 . A A . 25 TYR CE2 1 1 7 3447 1 1 4 TYR CG C -2.157 -1.019 4.398 1.00 . A A . 25 TYR CG 1 1 7 3448 1 1 4 TYR CZ C -2.730 0.524 6.699 1.00 . A A . 25 TYR CZ 1 1 7 3449 1 1 4 TYR H H -3.976 -1.187 1.906 1.00 . A A . 25 TYR H 1 1 7 3450 1 1 4 TYR HA H -2.487 -3.666 2.179 1.00 . A A . 25 TYR HA 1 1 7 3451 1 1 4 TYR HB2 H -0.973 -2.477 3.398 1.00 . A A . 25 TYR HB2 1 1 7 3452 1 1 4 TYR HB3 H -1.601 -1.232 2.339 1.00 . A A . 25 TYR HB3 1 1 7 3453 1 1 4 TYR HD1 H -3.890 -0.040 3.540 1.00 . A A . 25 TYR HD1 1 1 7 3454 1 1 4 TYR HD2 H -0.509 -1.811 5.556 1.00 . A A . 25 TYR HD2 1 1 7 3455 1 1 4 TYR HE1 H -4.406 1.271 5.569 1.00 . A A . 25 TYR HE1 1 1 7 3456 1 1 4 TYR HE2 H -0.999 -0.440 7.570 1.00 . A A . 25 TYR HE2 1 1 7 3457 1 1 4 TYR HH H -2.413 1.089 8.535 1.00 . A A . 25 TYR HH 1 1 7 3458 1 1 4 TYR N N -3.924 -2.197 1.869 1.00 . A A . 25 TYR N 1 1 7 3459 1 1 4 TYR O O -2.934 -4.348 4.653 1.00 . A A . 25 TYR O 1 1 7 3460 1 1 4 TYR OH O -3.028 1.266 7.802 1.00 . A A . 25 TYR OH 1 1 7 3461 1 1 5 ASN C C -6.950 -4.063 5.381 1.00 . A A . 26 ASN C 1 1 7 3462 1 1 5 ASN CA C -5.507 -3.558 5.583 1.00 . A A . 26 ASN CA 1 1 7 3463 1 1 5 ASN CB C -5.480 -2.304 6.478 1.00 . A A . 26 ASN CB 1 1 7 3464 1 1 5 ASN CG C -6.269 -2.480 7.766 1.00 . A A . 26 ASN CG 1 1 7 3465 1 1 5 ASN H H -5.297 -2.508 3.737 1.00 . A A . 26 ASN H 1 1 7 3466 1 1 5 ASN HA H -4.957 -4.355 6.087 1.00 . A A . 26 ASN HA 1 1 7 3467 1 1 5 ASN HB2 H -4.447 -2.072 6.738 1.00 . A A . 26 ASN HB2 1 1 7 3468 1 1 5 ASN HB3 H -5.884 -1.450 5.934 1.00 . A A . 26 ASN HB3 1 1 7 3469 1 1 5 ASN HD21 H -7.943 -1.636 6.979 1.00 . A A . 26 ASN HD21 1 1 7 3470 1 1 5 ASN HD22 H -8.035 -2.166 8.653 1.00 . A A . 26 ASN HD22 1 1 7 3471 1 1 5 ASN N N -4.842 -3.198 4.324 1.00 . A A . 26 ASN N 1 1 7 3472 1 1 5 ASN ND2 N -7.511 -2.045 7.801 1.00 . A A . 26 ASN ND2 1 1 7 3473 1 1 5 ASN O O -7.328 -5.095 5.940 1.00 . A A . 26 ASN O 1 1 7 3474 1 1 5 ASN OD1 O -5.782 -3.016 8.751 1.00 . A A . 26 ASN OD1 1 1 7 3475 1 1 6 CYS C C -9.664 -4.652 3.566 1.00 . A A . 27 CYS C 1 1 7 3476 1 1 6 CYS CA C -9.204 -3.513 4.509 1.00 . A A . 27 CYS CA 1 1 7 3477 1 1 6 CYS CB C -9.808 -2.162 4.086 1.00 . A A . 27 CYS CB 1 1 7 3478 1 1 6 CYS H H -7.377 -2.499 4.178 1.00 . A A . 27 CYS H 1 1 7 3479 1 1 6 CYS HA H -9.578 -3.748 5.506 1.00 . A A . 27 CYS HA 1 1 7 3480 1 1 6 CYS HB2 H -9.517 -1.941 3.059 1.00 . A A . 27 CYS HB2 1 1 7 3481 1 1 6 CYS HB3 H -10.898 -2.240 4.119 1.00 . A A . 27 CYS HB3 1 1 7 3482 1 1 6 CYS N N -7.751 -3.343 4.592 1.00 . A A . 27 CYS N 1 1 7 3483 1 1 6 CYS O O -10.853 -4.979 3.535 1.00 . A A . 27 CYS O 1 1 7 3484 1 1 6 CYS SG S -9.268 -0.827 5.199 1.00 . A A . 27 CYS SG 1 1 7 3485 1 1 7 GLY C C -10.078 -5.969 0.752 1.00 . A A . 28 GLY C 1 1 7 3486 1 1 7 GLY CA C -9.046 -6.333 1.833 1.00 . A A . 28 GLY CA 1 1 7 3487 1 1 7 GLY H H -7.788 -4.962 2.894 1.00 . A A . 28 GLY H 1 1 7 3488 1 1 7 GLY HA2 H -9.410 -7.201 2.382 1.00 . A A . 28 GLY HA2 1 1 7 3489 1 1 7 GLY HA3 H -8.120 -6.612 1.328 1.00 . A A . 28 GLY HA3 1 1 7 3490 1 1 7 GLY N N -8.750 -5.248 2.785 1.00 . A A . 28 GLY N 1 1 7 3491 1 1 7 GLY O O -10.876 -6.819 0.347 1.00 . A A . 28 GLY O 1 1 7 3492 1 1 8 LYS C C -10.556 -3.417 -1.759 1.00 . A A . 29 LYS C 1 1 7 3493 1 1 8 LYS CA C -11.152 -4.079 -0.499 1.00 . A A . 29 LYS CA 1 1 7 3494 1 1 8 LYS CB C -11.893 -3.083 0.416 1.00 . A A . 29 LYS CB 1 1 7 3495 1 1 8 LYS CD C -14.234 -3.217 -0.701 1.00 . A A . 29 LYS CD 1 1 7 3496 1 1 8 LYS CE C -14.838 -4.118 0.390 1.00 . A A . 29 LYS CE 1 1 7 3497 1 1 8 LYS CG C -13.067 -2.327 -0.232 1.00 . A A . 29 LYS CG 1 1 7 3498 1 1 8 LYS H H -9.385 -4.090 0.701 1.00 . A A . 29 LYS H 1 1 7 3499 1 1 8 LYS HA H -11.870 -4.842 -0.793 1.00 . A A . 29 LYS HA 1 1 7 3500 1 1 8 LYS HB2 H -12.261 -3.618 1.292 1.00 . A A . 29 LYS HB2 1 1 7 3501 1 1 8 LYS HB3 H -11.176 -2.351 0.785 1.00 . A A . 29 LYS HB3 1 1 7 3502 1 1 8 LYS HD2 H -15.020 -2.575 -1.107 1.00 . A A . 29 LYS HD2 1 1 7 3503 1 1 8 LYS HD3 H -13.888 -3.852 -1.516 1.00 . A A . 29 LYS HD3 1 1 7 3504 1 1 8 LYS HE2 H -15.575 -4.776 -0.081 1.00 . A A . 29 LYS HE2 1 1 7 3505 1 1 8 LYS HE3 H -14.052 -4.756 0.804 1.00 . A A . 29 LYS HE3 1 1 7 3506 1 1 8 LYS HG2 H -13.446 -1.605 0.491 1.00 . A A . 29 LYS HG2 1 1 7 3507 1 1 8 LYS HG3 H -12.699 -1.758 -1.087 1.00 . A A . 29 LYS HG3 1 1 7 3508 1 1 8 LYS HZ1 H -16.235 -2.756 1.114 1.00 . A A . 29 LYS HZ1 1 1 7 3509 1 1 8 LYS HZ2 H -15.910 -3.959 2.162 1.00 . A A . 29 LYS HZ2 1 1 7 3510 1 1 8 LYS HZ3 H -14.838 -2.748 1.965 1.00 . A A . 29 LYS HZ3 1 1 7 3511 1 1 8 LYS N N -10.090 -4.702 0.315 1.00 . A A . 29 LYS N 1 1 7 3512 1 1 8 LYS NZ N -15.494 -3.341 1.477 1.00 . A A . 29 LYS NZ 1 1 7 3513 1 1 8 LYS O O -9.839 -2.425 -1.607 1.00 . A A . 29 LYS O 1 1 7 3514 1 1 9 PRO C C -10.379 -1.933 -4.529 1.00 . A A . 30 PRO C 1 1 7 3515 1 1 9 PRO CA C -10.251 -3.440 -4.252 1.00 . A A . 30 PRO CA 1 1 7 3516 1 1 9 PRO CB C -10.947 -4.249 -5.351 1.00 . A A . 30 PRO CB 1 1 7 3517 1 1 9 PRO CD C -11.541 -5.177 -3.237 1.00 . A A . 30 PRO CD 1 1 7 3518 1 1 9 PRO CG C -11.213 -5.585 -4.670 1.00 . A A . 30 PRO CG 1 1 7 3519 1 1 9 PRO HA H -9.194 -3.695 -4.281 1.00 . A A . 30 PRO HA 1 1 7 3520 1 1 9 PRO HB2 H -11.899 -3.784 -5.620 1.00 . A A . 30 PRO HB2 1 1 7 3521 1 1 9 PRO HB3 H -10.315 -4.363 -6.233 1.00 . A A . 30 PRO HB3 1 1 7 3522 1 1 9 PRO HD2 H -12.612 -4.994 -3.150 1.00 . A A . 30 PRO HD2 1 1 7 3523 1 1 9 PRO HD3 H -11.237 -5.974 -2.556 1.00 . A A . 30 PRO HD3 1 1 7 3524 1 1 9 PRO HG2 H -12.038 -6.124 -5.139 1.00 . A A . 30 PRO HG2 1 1 7 3525 1 1 9 PRO HG3 H -10.303 -6.190 -4.682 1.00 . A A . 30 PRO HG3 1 1 7 3526 1 1 9 PRO N N -10.810 -3.938 -2.982 1.00 . A A . 30 PRO N 1 1 7 3527 1 1 9 PRO O O -9.482 -1.345 -5.139 1.00 . A A . 30 PRO O 1 1 7 3528 1 1 10 GLY C C -10.945 1.125 -3.443 1.00 . A A . 31 GLY C 1 1 7 3529 1 1 10 GLY CA C -11.771 0.132 -4.276 1.00 . A A . 31 GLY CA 1 1 7 3530 1 1 10 GLY H H -12.150 -1.846 -3.580 1.00 . A A . 31 GLY H 1 1 7 3531 1 1 10 GLY HA2 H -12.825 0.298 -4.057 1.00 . A A . 31 GLY HA2 1 1 7 3532 1 1 10 GLY HA3 H -11.607 0.368 -5.329 1.00 . A A . 31 GLY HA3 1 1 7 3533 1 1 10 GLY N N -11.454 -1.291 -4.059 1.00 . A A . 31 GLY N 1 1 7 3534 1 1 10 GLY O O -11.464 2.165 -3.029 1.00 . A A . 31 GLY O 1 1 7 3535 1 1 11 HIS C C -7.755 2.410 -3.247 1.00 . A A . 32 HIS C 1 1 7 3536 1 1 11 HIS CA C -8.763 1.635 -2.382 1.00 . A A . 32 HIS CA 1 1 7 3537 1 1 11 HIS CB C -8.071 0.778 -1.311 1.00 . A A . 32 HIS CB 1 1 7 3538 1 1 11 HIS CD2 C -8.501 1.347 1.147 1.00 . A A . 32 HIS CD2 1 1 7 3539 1 1 11 HIS CE1 C -10.381 0.265 1.478 1.00 . A A . 32 HIS CE1 1 1 7 3540 1 1 11 HIS CG C -8.845 0.738 -0.025 1.00 . A A . 32 HIS CG 1 1 7 3541 1 1 11 HIS H H -9.319 -0.056 -3.551 1.00 . A A . 32 HIS H 1 1 7 3542 1 1 11 HIS HA H -9.342 2.393 -1.860 1.00 . A A . 32 HIS HA 1 1 7 3543 1 1 11 HIS HB2 H -7.946 -0.242 -1.669 1.00 . A A . 32 HIS HB2 1 1 7 3544 1 1 11 HIS HB3 H -7.078 1.176 -1.099 1.00 . A A . 32 HIS HB3 1 1 7 3545 1 1 11 HIS HD1 H -10.491 -0.535 -0.473 1.00 . A A . 32 HIS HD1 1 1 7 3546 1 1 11 HIS HD2 H -7.625 1.960 1.294 1.00 . A A . 32 HIS HD2 1 1 7 3547 1 1 11 HIS HE1 H -11.264 -0.153 1.948 1.00 . A A . 32 HIS HE1 1 1 7 3548 1 1 11 HIS N N -9.681 0.803 -3.162 1.00 . A A . 32 HIS N 1 1 7 3549 1 1 11 HIS ND1 N -10.021 0.064 0.198 1.00 . A A . 32 HIS ND1 1 1 7 3550 1 1 11 HIS NE2 N -9.466 1.025 2.109 1.00 . A A . 32 HIS NE2 1 1 7 3551 1 1 11 HIS O O -7.476 2.076 -4.403 1.00 . A A . 32 HIS O 1 1 7 3552 1 1 12 LEU C C -5.537 5.097 -1.993 1.00 . A A . 33 LEU C 1 1 7 3553 1 1 12 LEU CA C -6.323 4.490 -3.172 1.00 . A A . 33 LEU CA 1 1 7 3554 1 1 12 LEU CB C -7.143 5.611 -3.857 1.00 . A A . 33 LEU CB 1 1 7 3555 1 1 12 LEU CD1 C -8.695 6.443 -5.642 1.00 . A A . 33 LEU CD1 1 1 7 3556 1 1 12 LEU CD2 C -6.896 4.867 -6.282 1.00 . A A . 33 LEU CD2 1 1 7 3557 1 1 12 LEU CG C -7.872 5.246 -5.164 1.00 . A A . 33 LEU CG 1 1 7 3558 1 1 12 LEU H H -7.486 3.610 -1.671 1.00 . A A . 33 LEU H 1 1 7 3559 1 1 12 LEU HA H -5.615 4.044 -3.873 1.00 . A A . 33 LEU HA 1 1 7 3560 1 1 12 LEU HB2 H -7.887 5.969 -3.142 1.00 . A A . 33 LEU HB2 1 1 7 3561 1 1 12 LEU HB3 H -6.481 6.448 -4.079 1.00 . A A . 33 LEU HB3 1 1 7 3562 1 1 12 LEU HD11 H -9.420 6.716 -4.875 1.00 . A A . 33 LEU HD11 1 1 7 3563 1 1 12 LEU HD12 H -8.043 7.294 -5.839 1.00 . A A . 33 LEU HD12 1 1 7 3564 1 1 12 LEU HD13 H -9.233 6.181 -6.553 1.00 . A A . 33 LEU HD13 1 1 7 3565 1 1 12 LEU HD21 H -6.196 5.683 -6.461 1.00 . A A . 33 LEU HD21 1 1 7 3566 1 1 12 LEU HD22 H -6.343 3.970 -6.009 1.00 . A A . 33 LEU HD22 1 1 7 3567 1 1 12 LEU HD23 H -7.451 4.662 -7.199 1.00 . A A . 33 LEU HD23 1 1 7 3568 1 1 12 LEU HG H -8.559 4.420 -4.990 1.00 . A A . 33 LEU HG 1 1 7 3569 1 1 12 LEU N N -7.237 3.479 -2.641 1.00 . A A . 33 LEU N 1 1 7 3570 1 1 12 LEU O O -5.903 4.898 -0.830 1.00 . A A . 33 LEU O 1 1 7 3571 1 1 13 SER C C -4.772 7.779 -0.567 1.00 . A A . 34 SER C 1 1 7 3572 1 1 13 SER CA C -3.847 6.795 -1.311 1.00 . A A . 34 SER CA 1 1 7 3573 1 1 13 SER CB C -2.749 7.583 -2.033 1.00 . A A . 34 SER CB 1 1 7 3574 1 1 13 SER H H -4.303 6.072 -3.260 1.00 . A A . 34 SER H 1 1 7 3575 1 1 13 SER HA H -3.373 6.165 -0.558 1.00 . A A . 34 SER HA 1 1 7 3576 1 1 13 SER HB2 H -2.285 8.284 -1.338 1.00 . A A . 34 SER HB2 1 1 7 3577 1 1 13 SER HB3 H -1.989 6.886 -2.391 1.00 . A A . 34 SER HB3 1 1 7 3578 1 1 13 SER HG H -2.568 8.784 -3.577 1.00 . A A . 34 SER HG 1 1 7 3579 1 1 13 SER N N -4.532 5.925 -2.287 1.00 . A A . 34 SER N 1 1 7 3580 1 1 13 SER O O -4.409 8.292 0.493 1.00 . A A . 34 SER O 1 1 7 3581 1 1 13 SER OG O -3.290 8.289 -3.140 1.00 . A A . 34 SER OG 1 1 7 3582 1 1 14 SER C C -8.058 7.995 0.335 1.00 . A A . 35 SER C 1 1 7 3583 1 1 14 SER CA C -7.047 8.826 -0.479 1.00 . A A . 35 SER CA 1 1 7 3584 1 1 14 SER CB C -7.786 9.596 -1.581 1.00 . A A . 35 SER CB 1 1 7 3585 1 1 14 SER H H -6.171 7.649 -2.011 1.00 . A A . 35 SER H 1 1 7 3586 1 1 14 SER HA H -6.607 9.558 0.199 1.00 . A A . 35 SER HA 1 1 7 3587 1 1 14 SER HB2 H -8.608 10.165 -1.144 1.00 . A A . 35 SER HB2 1 1 7 3588 1 1 14 SER HB3 H -7.092 10.294 -2.051 1.00 . A A . 35 SER HB3 1 1 7 3589 1 1 14 SER HG H -8.762 9.222 -3.238 1.00 . A A . 35 SER HG 1 1 7 3590 1 1 14 SER N N -5.975 8.030 -1.097 1.00 . A A . 35 SER N 1 1 7 3591 1 1 14 SER O O -8.922 8.570 1.002 1.00 . A A . 35 SER O 1 1 7 3592 1 1 14 SER OG O -8.287 8.699 -2.563 1.00 . A A . 35 SER OG 1 1 7 3593 1 1 15 GLN C C -8.235 5.133 2.265 1.00 . A A . 36 GLN C 1 1 7 3594 1 1 15 GLN CA C -8.873 5.732 0.992 1.00 . A A . 36 GLN CA 1 1 7 3595 1 1 15 GLN CB C -9.288 4.634 -0.007 1.00 . A A . 36 GLN CB 1 1 7 3596 1 1 15 GLN CD C -11.830 4.714 -0.138 1.00 . A A . 36 GLN CD 1 1 7 3597 1 1 15 GLN CG C -10.611 3.934 0.352 1.00 . A A . 36 GLN CG 1 1 7 3598 1 1 15 GLN H H -7.196 6.259 -0.225 1.00 . A A . 36 GLN H 1 1 7 3599 1 1 15 GLN HA H -9.771 6.274 1.292 1.00 . A A . 36 GLN HA 1 1 7 3600 1 1 15 GLN HB2 H -9.392 5.064 -1.004 1.00 . A A . 36 GLN HB2 1 1 7 3601 1 1 15 GLN HB3 H -8.494 3.890 -0.050 1.00 . A A . 36 GLN HB3 1 1 7 3602 1 1 15 GLN HE21 H -11.984 3.627 -1.854 1.00 . A A . 36 GLN HE21 1 1 7 3603 1 1 15 GLN HE22 H -13.166 4.910 -1.618 1.00 . A A . 36 GLN HE22 1 1 7 3604 1 1 15 GLN HG2 H -10.631 2.953 -0.118 1.00 . A A . 36 GLN HG2 1 1 7 3605 1 1 15 GLN HG3 H -10.679 3.782 1.429 1.00 . A A . 36 GLN HG3 1 1 7 3606 1 1 15 GLN N N -7.955 6.659 0.312 1.00 . A A . 36 GLN N 1 1 7 3607 1 1 15 GLN NE2 N -12.363 4.391 -1.300 1.00 . A A . 36 GLN NE2 1 1 7 3608 1 1 15 GLN O O -8.887 5.102 3.311 1.00 . A A . 36 GLN O 1 1 7 3609 1 1 15 GLN OE1 O -12.321 5.628 0.510 1.00 . A A . 36 GLN OE1 1 1 7 3610 1 1 16 CYS C C -4.627 4.911 3.052 1.00 . A A . 37 CYS C 1 1 7 3611 1 1 16 CYS CA C -6.062 4.398 3.303 1.00 . A A . 37 CYS CA 1 1 7 3612 1 1 16 CYS CB C -6.057 2.869 3.521 1.00 . A A . 37 CYS CB 1 1 7 3613 1 1 16 CYS H H -6.497 4.853 1.285 1.00 . A A . 37 CYS H 1 1 7 3614 1 1 16 CYS HA H -6.421 4.882 4.210 1.00 . A A . 37 CYS HA 1 1 7 3615 1 1 16 CYS HB2 H -6.035 2.353 2.562 1.00 . A A . 37 CYS HB2 1 1 7 3616 1 1 16 CYS HB3 H -5.145 2.585 4.042 1.00 . A A . 37 CYS HB3 1 1 7 3617 1 1 16 CYS N N -6.949 4.757 2.187 1.00 . A A . 37 CYS N 1 1 7 3618 1 1 16 CYS O O -4.317 5.424 1.974 1.00 . A A . 37 CYS O 1 1 7 3619 1 1 16 CYS SG S -7.461 2.336 4.538 1.00 . A A . 37 CYS SG 1 1 7 3620 1 1 17 ARG C C -1.584 4.597 2.748 1.00 . A A . 38 ARG C 1 1 7 3621 1 1 17 ARG CA C -2.317 5.143 3.982 1.00 . A A . 38 ARG CA 1 1 7 3622 1 1 17 ARG CB C -1.568 4.721 5.262 1.00 . A A . 38 ARG CB 1 1 7 3623 1 1 17 ARG CD C -2.959 4.852 7.458 1.00 . A A . 38 ARG CD 1 1 7 3624 1 1 17 ARG CG C -1.913 5.508 6.542 1.00 . A A . 38 ARG CG 1 1 7 3625 1 1 17 ARG CZ C -5.398 4.391 7.072 1.00 . A A . 38 ARG CZ 1 1 7 3626 1 1 17 ARG H H -4.071 4.320 4.897 1.00 . A A . 38 ARG H 1 1 7 3627 1 1 17 ARG HA H -2.265 6.230 3.895 1.00 . A A . 38 ARG HA 1 1 7 3628 1 1 17 ARG HB2 H -1.696 3.650 5.433 1.00 . A A . 38 ARG HB2 1 1 7 3629 1 1 17 ARG HB3 H -0.506 4.889 5.077 1.00 . A A . 38 ARG HB3 1 1 7 3630 1 1 17 ARG HD2 H -2.797 3.778 7.462 1.00 . A A . 38 ARG HD2 1 1 7 3631 1 1 17 ARG HD3 H -2.786 5.212 8.474 1.00 . A A . 38 ARG HD3 1 1 7 3632 1 1 17 ARG HE H -4.539 6.172 6.920 1.00 . A A . 38 ARG HE 1 1 7 3633 1 1 17 ARG HG2 H -0.992 5.575 7.126 1.00 . A A . 38 ARG HG2 1 1 7 3634 1 1 17 ARG HG3 H -2.208 6.528 6.295 1.00 . A A . 38 ARG HG3 1 1 7 3635 1 1 17 ARG HH11 H -4.427 2.694 7.551 1.00 . A A . 38 ARG HH11 1 1 7 3636 1 1 17 ARG HH12 H -6.137 2.540 7.234 1.00 . A A . 38 ARG HH12 1 1 7 3637 1 1 17 ARG HH21 H -6.715 5.846 6.637 1.00 . A A . 38 ARG HH21 1 1 7 3638 1 1 17 ARG HH22 H -7.345 4.226 6.645 1.00 . A A . 38 ARG HH22 1 1 7 3639 1 1 17 ARG N N -3.737 4.744 4.045 1.00 . A A . 38 ARG N 1 1 7 3640 1 1 17 ARG NE N -4.350 5.195 7.091 1.00 . A A . 38 ARG NE 1 1 7 3641 1 1 17 ARG NH1 N -5.314 3.113 7.297 1.00 . A A . 38 ARG NH1 1 1 7 3642 1 1 17 ARG NH2 N -6.577 4.861 6.791 1.00 . A A . 38 ARG NH2 1 1 7 3643 1 1 17 ARG O O -0.758 5.311 2.177 1.00 . A A . 38 ARG O 1 1 7 3644 1 1 18 ALA C C -2.306 1.606 0.589 1.00 . A A . 39 ALA C 1 1 7 3645 1 1 18 ALA CA C -1.406 2.770 1.074 1.00 . A A . 39 ALA CA 1 1 7 3646 1 1 18 ALA CB C 0.018 2.249 1.325 1.00 . A A . 39 ALA CB 1 1 7 3647 1 1 18 ALA H H -2.576 2.848 2.848 1.00 . A A . 39 ALA H 1 1 7 3648 1 1 18 ALA HA H -1.379 3.537 0.302 1.00 . A A . 39 ALA HA 1 1 7 3649 1 1 18 ALA HB1 H 0.675 3.066 1.622 1.00 . A A . 39 ALA HB1 1 1 7 3650 1 1 18 ALA HB2 H -0.005 1.493 2.112 1.00 . A A . 39 ALA HB2 1 1 7 3651 1 1 18 ALA HB3 H 0.415 1.791 0.419 1.00 . A A . 39 ALA HB3 1 1 7 3652 1 1 18 ALA N N -1.898 3.373 2.317 1.00 . A A . 39 ALA N 1 1 7 3653 1 1 18 ALA O O -3.010 0.991 1.397 1.00 . A A . 39 ALA O 1 1 7 3654 1 1 19 PRO C C -1.692 -1.181 -0.737 1.00 . A A . 40 PRO C 1 1 7 3655 1 1 19 PRO CA C -2.677 -0.079 -1.178 1.00 . A A . 40 PRO CA 1 1 7 3656 1 1 19 PRO CB C -2.746 0.063 -2.703 1.00 . A A . 40 PRO CB 1 1 7 3657 1 1 19 PRO CD C -1.652 1.999 -1.801 1.00 . A A . 40 PRO CD 1 1 7 3658 1 1 19 PRO CG C -1.632 1.063 -3.011 1.00 . A A . 40 PRO CG 1 1 7 3659 1 1 19 PRO HA H -3.670 -0.318 -0.795 1.00 . A A . 40 PRO HA 1 1 7 3660 1 1 19 PRO HB2 H -2.599 -0.882 -3.225 1.00 . A A . 40 PRO HB2 1 1 7 3661 1 1 19 PRO HB3 H -3.708 0.499 -2.980 1.00 . A A . 40 PRO HB3 1 1 7 3662 1 1 19 PRO HD2 H -0.636 2.323 -1.570 1.00 . A A . 40 PRO HD2 1 1 7 3663 1 1 19 PRO HD3 H -2.280 2.864 -2.019 1.00 . A A . 40 PRO HD3 1 1 7 3664 1 1 19 PRO HG2 H -0.675 0.541 -3.053 1.00 . A A . 40 PRO HG2 1 1 7 3665 1 1 19 PRO HG3 H -1.815 1.600 -3.941 1.00 . A A . 40 PRO HG3 1 1 7 3666 1 1 19 PRO N N -2.244 1.237 -0.706 1.00 . A A . 40 PRO N 1 1 7 3667 1 1 19 PRO O O -0.607 -0.897 -0.224 1.00 . A A . 40 PRO O 1 1 7 3668 1 1 20 LYS C C 0.171 -3.736 -1.125 1.00 . A A . 41 LYS C 1 1 7 3669 1 1 20 LYS CA C -1.291 -3.680 -0.640 1.00 . A A . 41 LYS CA 1 1 7 3670 1 1 20 LYS CB C -2.118 -4.888 -1.128 1.00 . A A . 41 LYS CB 1 1 7 3671 1 1 20 LYS CD C -2.714 -7.353 -0.761 1.00 . A A . 41 LYS CD 1 1 7 3672 1 1 20 LYS CE C -2.688 -7.741 -2.247 1.00 . A A . 41 LYS CE 1 1 7 3673 1 1 20 LYS CG C -1.738 -6.211 -0.440 1.00 . A A . 41 LYS CG 1 1 7 3674 1 1 20 LYS H H -2.949 -2.580 -1.423 1.00 . A A . 41 LYS H 1 1 7 3675 1 1 20 LYS HA H -1.234 -3.722 0.446 1.00 . A A . 41 LYS HA 1 1 7 3676 1 1 20 LYS HB2 H -3.170 -4.699 -0.913 1.00 . A A . 41 LYS HB2 1 1 7 3677 1 1 20 LYS HB3 H -2.006 -4.984 -2.209 1.00 . A A . 41 LYS HB3 1 1 7 3678 1 1 20 LYS HD2 H -2.430 -8.221 -0.162 1.00 . A A . 41 LYS HD2 1 1 7 3679 1 1 20 LYS HD3 H -3.724 -7.056 -0.474 1.00 . A A . 41 LYS HD3 1 1 7 3680 1 1 20 LYS HE2 H -3.022 -6.888 -2.845 1.00 . A A . 41 LYS HE2 1 1 7 3681 1 1 20 LYS HE3 H -1.657 -7.968 -2.532 1.00 . A A . 41 LYS HE3 1 1 7 3682 1 1 20 LYS HG2 H -0.735 -6.513 -0.743 1.00 . A A . 41 LYS HG2 1 1 7 3683 1 1 20 LYS HG3 H -1.740 -6.057 0.640 1.00 . A A . 41 LYS HG3 1 1 7 3684 1 1 20 LYS HZ1 H -4.518 -8.740 -2.271 1.00 . A A . 41 LYS HZ1 1 1 7 3685 1 1 20 LYS HZ2 H -3.533 -9.168 -3.500 1.00 . A A . 41 LYS HZ2 1 1 7 3686 1 1 20 LYS HZ3 H -3.247 -9.730 -1.998 1.00 . A A . 41 LYS HZ3 1 1 7 3687 1 1 20 LYS N N -2.037 -2.449 -0.994 1.00 . A A . 41 LYS N 1 1 7 3688 1 1 20 LYS NZ N -3.555 -8.920 -2.520 1.00 . A A . 41 LYS NZ 1 1 7 3689 1 1 20 LYS O O 0.950 -4.558 -0.644 1.00 . A A . 41 LYS O 1 1 7 3690 1 1 21 VAL C C 2.853 -2.186 -1.204 1.00 . A A . 42 VAL C 1 1 7 3691 1 1 21 VAL CA C 1.955 -2.535 -2.408 1.00 . A A . 42 VAL CA 1 1 7 3692 1 1 21 VAL CB C 1.958 -1.369 -3.423 1.00 . A A . 42 VAL CB 1 1 7 3693 1 1 21 VAL CG1 C 3.359 -1.029 -3.930 1.00 . A A . 42 VAL CG1 1 1 7 3694 1 1 21 VAL CG2 C 1.095 -1.685 -4.657 1.00 . A A . 42 VAL CG2 1 1 7 3695 1 1 21 VAL H H -0.154 -2.215 -2.366 1.00 . A A . 42 VAL H 1 1 7 3696 1 1 21 VAL HA H 2.380 -3.415 -2.892 1.00 . A A . 42 VAL HA 1 1 7 3697 1 1 21 VAL HB H 1.549 -0.482 -2.940 1.00 . A A . 42 VAL HB 1 1 7 3698 1 1 21 VAL HG11 H 3.811 -1.915 -4.375 1.00 . A A . 42 VAL HG11 1 1 7 3699 1 1 21 VAL HG12 H 3.307 -0.237 -4.678 1.00 . A A . 42 VAL HG12 1 1 7 3700 1 1 21 VAL HG13 H 3.983 -0.675 -3.110 1.00 . A A . 42 VAL HG13 1 1 7 3701 1 1 21 VAL HG21 H 1.457 -2.592 -5.142 1.00 . A A . 42 VAL HG21 1 1 7 3702 1 1 21 VAL HG22 H 0.051 -1.818 -4.379 1.00 . A A . 42 VAL HG22 1 1 7 3703 1 1 21 VAL HG23 H 1.148 -0.857 -5.367 1.00 . A A . 42 VAL HG23 1 1 7 3704 1 1 21 VAL N N 0.564 -2.830 -2.018 1.00 . A A . 42 VAL N 1 1 7 3705 1 1 21 VAL O O 4.017 -2.582 -1.178 1.00 . A A . 42 VAL O 1 1 7 3706 1 1 22 CYS C C 2.180 -0.803 2.183 1.00 . A A . 43 CYS C 1 1 7 3707 1 1 22 CYS CA C 3.063 -0.874 0.910 1.00 . A A . 43 CYS CA 1 1 7 3708 1 1 22 CYS CB C 3.565 0.502 0.420 1.00 . A A . 43 CYS CB 1 1 7 3709 1 1 22 CYS H H 1.331 -1.246 -0.262 1.00 . A A . 43 CYS H 1 1 7 3710 1 1 22 CYS HA H 3.931 -1.493 1.140 1.00 . A A . 43 CYS HA 1 1 7 3711 1 1 22 CYS HB2 H 4.009 0.374 -0.569 1.00 . A A . 43 CYS HB2 1 1 7 3712 1 1 22 CYS HB3 H 2.719 1.185 0.323 1.00 . A A . 43 CYS HB3 1 1 7 3713 1 1 22 CYS N N 2.320 -1.466 -0.208 1.00 . A A . 43 CYS N 1 1 7 3714 1 1 22 CYS O O 1.222 -1.559 2.343 1.00 . A A . 43 CYS O 1 1 7 3715 1 1 22 CYS SG S 4.823 1.217 1.520 1.00 . A A . 43 CYS SG 1 1 7 3716 1 1 23 PHE C C 1.778 2.051 4.486 1.00 . A A . 44 PHE C 1 1 7 3717 1 1 23 PHE CA C 1.729 0.525 4.255 1.00 . A A . 44 PHE CA 1 1 7 3718 1 1 23 PHE CB C 2.207 -0.230 5.507 1.00 . A A . 44 PHE CB 1 1 7 3719 1 1 23 PHE CD1 C 4.751 -0.226 5.481 1.00 . A A . 44 PHE CD1 1 1 7 3720 1 1 23 PHE CD2 C 3.596 1.126 7.143 1.00 . A A . 44 PHE CD2 1 1 7 3721 1 1 23 PHE CE1 C 5.988 0.210 5.990 1.00 . A A . 44 PHE CE1 1 1 7 3722 1 1 23 PHE CE2 C 4.833 1.560 7.653 1.00 . A A . 44 PHE CE2 1 1 7 3723 1 1 23 PHE CG C 3.550 0.230 6.056 1.00 . A A . 44 PHE CG 1 1 7 3724 1 1 23 PHE CZ C 6.030 1.101 7.077 1.00 . A A . 44 PHE CZ 1 1 7 3725 1 1 23 PHE H H 3.399 0.572 2.915 1.00 . A A . 44 PHE H 1 1 7 3726 1 1 23 PHE HA H 0.686 0.261 4.079 1.00 . A A . 44 PHE HA 1 1 7 3727 1 1 23 PHE HB2 H 1.455 -0.103 6.287 1.00 . A A . 44 PHE HB2 1 1 7 3728 1 1 23 PHE HB3 H 2.257 -1.297 5.289 1.00 . A A . 44 PHE HB3 1 1 7 3729 1 1 23 PHE HD1 H 4.730 -0.914 4.648 1.00 . A A . 44 PHE HD1 1 1 7 3730 1 1 23 PHE HD2 H 2.677 1.484 7.589 1.00 . A A . 44 PHE HD2 1 1 7 3731 1 1 23 PHE HE1 H 6.911 -0.146 5.551 1.00 . A A . 44 PHE HE1 1 1 7 3732 1 1 23 PHE HE2 H 4.861 2.242 8.493 1.00 . A A . 44 PHE HE2 1 1 7 3733 1 1 23 PHE HZ H 6.982 1.427 7.474 1.00 . A A . 44 PHE HZ 1 1 7 3734 1 1 23 PHE N N 2.527 0.097 3.099 1.00 . A A . 44 PHE N 1 1 7 3735 1 1 23 PHE O O 1.016 2.572 5.304 1.00 . A A . 44 PHE O 1 1 7 3736 1 1 24 LYS C C 3.611 4.862 2.771 1.00 . A A . 45 LYS C 1 1 7 3737 1 1 24 LYS CA C 2.978 4.198 4.002 1.00 . A A . 45 LYS CA 1 1 7 3738 1 1 24 LYS CB C 3.920 4.280 5.225 1.00 . A A . 45 LYS CB 1 1 7 3739 1 1 24 LYS CD C 5.382 5.724 6.756 1.00 . A A . 45 LYS CD 1 1 7 3740 1 1 24 LYS CE C 6.593 4.772 6.734 1.00 . A A . 45 LYS CE 1 1 7 3741 1 1 24 LYS CG C 4.488 5.683 5.505 1.00 . A A . 45 LYS CG 1 1 7 3742 1 1 24 LYS H H 3.223 2.274 3.096 1.00 . A A . 45 LYS H 1 1 7 3743 1 1 24 LYS HA H 2.060 4.745 4.226 1.00 . A A . 45 LYS HA 1 1 7 3744 1 1 24 LYS HB2 H 3.370 3.953 6.109 1.00 . A A . 45 LYS HB2 1 1 7 3745 1 1 24 LYS HB3 H 4.749 3.586 5.077 1.00 . A A . 45 LYS HB3 1 1 7 3746 1 1 24 LYS HD2 H 5.739 6.746 6.896 1.00 . A A . 45 LYS HD2 1 1 7 3747 1 1 24 LYS HD3 H 4.769 5.473 7.624 1.00 . A A . 45 LYS HD3 1 1 7 3748 1 1 24 LYS HE2 H 7.108 4.866 7.695 1.00 . A A . 45 LYS HE2 1 1 7 3749 1 1 24 LYS HE3 H 6.236 3.741 6.656 1.00 . A A . 45 LYS HE3 1 1 7 3750 1 1 24 LYS HG2 H 5.073 6.030 4.653 1.00 . A A . 45 LYS HG2 1 1 7 3751 1 1 24 LYS HG3 H 3.659 6.377 5.648 1.00 . A A . 45 LYS HG3 1 1 7 3752 1 1 24 LYS HZ1 H 7.811 6.040 5.616 1.00 . A A . 45 LYS HZ1 1 1 7 3753 1 1 24 LYS HZ2 H 8.398 4.524 5.745 1.00 . A A . 45 LYS HZ2 1 1 7 3754 1 1 24 LYS HZ3 H 7.173 4.810 4.724 1.00 . A A . 45 LYS HZ3 1 1 7 3755 1 1 24 LYS N N 2.672 2.772 3.783 1.00 . A A . 45 LYS N 1 1 7 3756 1 1 24 LYS NZ N 7.549 5.063 5.631 1.00 . A A . 45 LYS NZ 1 1 7 3757 1 1 24 LYS O O 3.044 5.804 2.216 1.00 . A A . 45 LYS O 1 1 7 3758 1 1 25 CYS C C 5.259 4.954 -0.037 1.00 . A A . 46 CYS C 1 1 7 3759 1 1 25 CYS CA C 5.704 5.041 1.436 1.00 . A A . 46 CYS CA 1 1 7 3760 1 1 25 CYS CB C 7.135 4.480 1.622 1.00 . A A . 46 CYS CB 1 1 7 3761 1 1 25 CYS H H 5.175 3.608 2.887 1.00 . A A . 46 CYS H 1 1 7 3762 1 1 25 CYS HA H 5.734 6.100 1.700 1.00 . A A . 46 CYS HA 1 1 7 3763 1 1 25 CYS HB2 H 7.465 4.011 0.692 1.00 . A A . 46 CYS HB2 1 1 7 3764 1 1 25 CYS HB3 H 7.809 5.323 1.794 1.00 . A A . 46 CYS HB3 1 1 7 3765 1 1 25 CYS N N 4.787 4.381 2.367 1.00 . A A . 46 CYS N 1 1 7 3766 1 1 25 CYS O O 5.420 5.923 -0.780 1.00 . A A . 46 CYS O 1 1 7 3767 1 1 25 CYS SG S 7.314 3.292 2.992 1.00 . A A . 46 CYS SG 1 1 7 3768 1 1 26 LYS C C 4.683 4.015 -3.026 1.00 . A A . 47 LYS C 1 1 7 3769 1 1 26 LYS CA C 3.982 3.540 -1.730 1.00 . A A . 47 LYS CA 1 1 7 3770 1 1 26 LYS CB C 2.493 3.948 -1.619 1.00 . A A . 47 LYS CB 1 1 7 3771 1 1 26 LYS CD C 0.781 5.787 -1.152 1.00 . A A . 47 LYS CD 1 1 7 3772 1 1 26 LYS CE C 0.625 7.187 -0.538 1.00 . A A . 47 LYS CE 1 1 7 3773 1 1 26 LYS CG C 2.266 5.439 -1.321 1.00 . A A . 47 LYS CG 1 1 7 3774 1 1 26 LYS H H 4.596 3.094 0.270 1.00 . A A . 47 LYS H 1 1 7 3775 1 1 26 LYS HA H 3.974 2.456 -1.842 1.00 . A A . 47 LYS HA 1 1 7 3776 1 1 26 LYS HB2 H 1.969 3.682 -2.538 1.00 . A A . 47 LYS HB2 1 1 7 3777 1 1 26 LYS HB3 H 2.044 3.367 -0.811 1.00 . A A . 47 LYS HB3 1 1 7 3778 1 1 26 LYS HD2 H 0.304 5.766 -2.133 1.00 . A A . 47 LYS HD2 1 1 7 3779 1 1 26 LYS HD3 H 0.291 5.052 -0.511 1.00 . A A . 47 LYS HD3 1 1 7 3780 1 1 26 LYS HE2 H 1.287 7.881 -1.065 1.00 . A A . 47 LYS HE2 1 1 7 3781 1 1 26 LYS HE3 H -0.402 7.524 -0.695 1.00 . A A . 47 LYS HE3 1 1 7 3782 1 1 26 LYS HG2 H 2.771 5.693 -0.394 1.00 . A A . 47 LYS HG2 1 1 7 3783 1 1 26 LYS HG3 H 2.689 6.045 -2.123 1.00 . A A . 47 LYS HG3 1 1 7 3784 1 1 26 LYS HZ1 H 1.852 6.847 1.129 1.00 . A A . 47 LYS HZ1 1 1 7 3785 1 1 26 LYS HZ2 H 0.838 8.123 1.311 1.00 . A A . 47 LYS HZ2 1 1 7 3786 1 1 26 LYS HZ3 H 0.272 6.588 1.422 1.00 . A A . 47 LYS HZ3 1 1 7 3787 1 1 26 LYS N N 4.660 3.817 -0.437 1.00 . A A . 47 LYS N 1 1 7 3788 1 1 26 LYS NZ N 0.918 7.195 0.920 1.00 . A A . 47 LYS NZ 1 1 7 3789 1 1 26 LYS O O 4.027 4.199 -4.052 1.00 . A A . 47 LYS O 1 1 7 3790 1 1 27 GLN C C 6.892 3.419 -5.232 1.00 . A A . 48 GLN C 1 1 7 3791 1 1 27 GLN CA C 6.807 4.568 -4.194 1.00 . A A . 48 GLN CA 1 1 7 3792 1 1 27 GLN CB C 8.221 5.010 -3.764 1.00 . A A . 48 GLN CB 1 1 7 3793 1 1 27 GLN CD C 7.510 7.425 -3.320 1.00 . A A . 48 GLN CD 1 1 7 3794 1 1 27 GLN CG C 8.251 6.197 -2.787 1.00 . A A . 48 GLN CG 1 1 7 3795 1 1 27 GLN H H 6.488 4.046 -2.137 1.00 . A A . 48 GLN H 1 1 7 3796 1 1 27 GLN HA H 6.305 5.417 -4.654 1.00 . A A . 48 GLN HA 1 1 7 3797 1 1 27 GLN HB2 H 8.733 4.172 -3.297 1.00 . A A . 48 GLN HB2 1 1 7 3798 1 1 27 GLN HB3 H 8.788 5.290 -4.653 1.00 . A A . 48 GLN HB3 1 1 7 3799 1 1 27 GLN HE21 H 5.983 7.198 -2.011 1.00 . A A . 48 GLN HE21 1 1 7 3800 1 1 27 GLN HE22 H 5.876 8.570 -3.118 1.00 . A A . 48 GLN HE22 1 1 7 3801 1 1 27 GLN HG2 H 7.829 5.895 -1.829 1.00 . A A . 48 GLN HG2 1 1 7 3802 1 1 27 GLN HG3 H 9.290 6.475 -2.605 1.00 . A A . 48 GLN HG3 1 1 7 3803 1 1 27 GLN N N 6.010 4.189 -3.012 1.00 . A A . 48 GLN N 1 1 7 3804 1 1 27 GLN NE2 N 6.364 7.761 -2.769 1.00 . A A . 48 GLN NE2 1 1 7 3805 1 1 27 GLN O O 6.881 2.254 -4.818 1.00 . A A . 48 GLN O 1 1 7 3806 1 1 27 GLN OE1 O 7.943 8.093 -4.250 1.00 . A A . 48 GLN OE1 1 1 7 3807 1 1 28 PRO C C 7.643 1.419 -7.651 1.00 . A A . 49 PRO C 1 1 7 3808 1 1 28 PRO CA C 6.865 2.751 -7.661 1.00 . A A . 49 PRO CA 1 1 7 3809 1 1 28 PRO CB C 7.221 3.534 -8.931 1.00 . A A . 49 PRO CB 1 1 7 3810 1 1 28 PRO CD C 7.168 5.058 -7.101 1.00 . A A . 49 PRO CD 1 1 7 3811 1 1 28 PRO CG C 6.825 4.961 -8.584 1.00 . A A . 49 PRO CG 1 1 7 3812 1 1 28 PRO HA H 5.804 2.501 -7.708 1.00 . A A . 49 PRO HA 1 1 7 3813 1 1 28 PRO HB2 H 8.298 3.491 -9.108 1.00 . A A . 49 PRO HB2 1 1 7 3814 1 1 28 PRO HB3 H 6.676 3.164 -9.799 1.00 . A A . 49 PRO HB3 1 1 7 3815 1 1 28 PRO HD2 H 8.201 5.390 -6.988 1.00 . A A . 49 PRO HD2 1 1 7 3816 1 1 28 PRO HD3 H 6.492 5.774 -6.636 1.00 . A A . 49 PRO HD3 1 1 7 3817 1 1 28 PRO HG2 H 7.376 5.691 -9.177 1.00 . A A . 49 PRO HG2 1 1 7 3818 1 1 28 PRO HG3 H 5.749 5.087 -8.721 1.00 . A A . 49 PRO HG3 1 1 7 3819 1 1 28 PRO N N 7.030 3.709 -6.548 1.00 . A A . 49 PRO N 1 1 7 3820 1 1 28 PRO O O 7.254 0.502 -8.377 1.00 . A A . 49 PRO O 1 1 7 3821 1 1 29 GLY C C 10.319 -0.183 -5.514 1.00 . A A . 50 GLY C 1 1 7 3822 1 1 29 GLY CA C 9.526 0.046 -6.808 1.00 . A A . 50 GLY CA 1 1 7 3823 1 1 29 GLY H H 9.037 2.097 -6.365 1.00 . A A . 50 GLY H 1 1 7 3824 1 1 29 GLY HA2 H 10.234 0.050 -7.635 1.00 . A A . 50 GLY HA2 1 1 7 3825 1 1 29 GLY HA3 H 8.871 -0.816 -6.932 1.00 . A A . 50 GLY HA3 1 1 7 3826 1 1 29 GLY N N 8.723 1.282 -6.871 1.00 . A A . 50 GLY N 1 1 7 3827 1 1 29 GLY O O 11.125 -1.113 -5.450 1.00 . A A . 50 GLY O 1 1 7 3828 1 1 30 HIS C C 10.501 -0.712 -2.384 1.00 . A A . 51 HIS C 1 1 7 3829 1 1 30 HIS CA C 10.850 0.549 -3.203 1.00 . A A . 51 HIS CA 1 1 7 3830 1 1 30 HIS CB C 10.556 1.816 -2.374 1.00 . A A . 51 HIS CB 1 1 7 3831 1 1 30 HIS CD2 C 9.091 1.638 -0.282 1.00 . A A . 51 HIS CD2 1 1 7 3832 1 1 30 HIS CE1 C 7.095 1.498 -1.184 1.00 . A A . 51 HIS CE1 1 1 7 3833 1 1 30 HIS CG C 9.234 1.780 -1.636 1.00 . A A . 51 HIS CG 1 1 7 3834 1 1 30 HIS H H 9.463 1.397 -4.596 1.00 . A A . 51 HIS H 1 1 7 3835 1 1 30 HIS HA H 11.921 0.523 -3.413 1.00 . A A . 51 HIS HA 1 1 7 3836 1 1 30 HIS HB2 H 11.350 1.922 -1.635 1.00 . A A . 51 HIS HB2 1 1 7 3837 1 1 30 HIS HB3 H 10.596 2.698 -3.015 1.00 . A A . 51 HIS HB3 1 1 7 3838 1 1 30 HIS HD1 H 7.711 1.785 -3.165 1.00 . A A . 51 HIS HD1 1 1 7 3839 1 1 30 HIS HD2 H 9.898 1.602 0.437 1.00 . A A . 51 HIS HD2 1 1 7 3840 1 1 30 HIS HE1 H 6.028 1.368 -1.313 1.00 . A A . 51 HIS HE1 1 1 7 3841 1 1 30 HIS N N 10.126 0.647 -4.483 1.00 . A A . 51 HIS N 1 1 7 3842 1 1 30 HIS ND1 N 7.967 1.702 -2.183 1.00 . A A . 51 HIS ND1 1 1 7 3843 1 1 30 HIS NE2 N 7.730 1.465 -0.002 1.00 . A A . 51 HIS NE2 1 1 7 3844 1 1 30 HIS O O 11.322 -1.231 -1.626 1.00 . A A . 51 HIS O 1 1 7 3845 1 1 31 PHE C C 9.331 -3.495 -1.539 1.00 . A A . 52 PHE C 1 1 7 3846 1 1 31 PHE CA C 8.615 -2.142 -1.613 1.00 . A A . 52 PHE CA 1 1 7 3847 1 1 31 PHE CB C 7.135 -2.285 -2.007 1.00 . A A . 52 PHE CB 1 1 7 3848 1 1 31 PHE CD1 C 6.877 -3.693 -4.111 1.00 . A A . 52 PHE CD1 1 1 7 3849 1 1 31 PHE CD2 C 6.588 -1.283 -4.269 1.00 . A A . 52 PHE CD2 1 1 7 3850 1 1 31 PHE CE1 C 6.641 -3.811 -5.492 1.00 . A A . 52 PHE CE1 1 1 7 3851 1 1 31 PHE CE2 C 6.338 -1.402 -5.647 1.00 . A A . 52 PHE CE2 1 1 7 3852 1 1 31 PHE CG C 6.859 -2.428 -3.494 1.00 . A A . 52 PHE CG 1 1 7 3853 1 1 31 PHE CZ C 6.372 -2.665 -6.261 1.00 . A A . 52 PHE CZ 1 1 7 3854 1 1 31 PHE H H 8.669 -0.739 -3.201 1.00 . A A . 52 PHE H 1 1 7 3855 1 1 31 PHE HA H 8.644 -1.722 -0.607 1.00 . A A . 52 PHE HA 1 1 7 3856 1 1 31 PHE HB2 H 6.712 -3.141 -1.483 1.00 . A A . 52 PHE HB2 1 1 7 3857 1 1 31 PHE HB3 H 6.605 -1.403 -1.645 1.00 . A A . 52 PHE HB3 1 1 7 3858 1 1 31 PHE HD1 H 7.080 -4.581 -3.526 1.00 . A A . 52 PHE HD1 1 1 7 3859 1 1 31 PHE HD2 H 6.539 -0.309 -3.805 1.00 . A A . 52 PHE HD2 1 1 7 3860 1 1 31 PHE HE1 H 6.666 -4.785 -5.963 1.00 . A A . 52 PHE HE1 1 1 7 3861 1 1 31 PHE HE2 H 6.104 -0.523 -6.229 1.00 . A A . 52 PHE HE2 1 1 7 3862 1 1 31 PHE HZ H 6.182 -2.755 -7.323 1.00 . A A . 52 PHE HZ 1 1 7 3863 1 1 31 PHE N N 9.260 -1.191 -2.522 1.00 . A A . 52 PHE N 1 1 7 3864 1 1 31 PHE O O 9.557 -3.998 -0.440 1.00 . A A . 52 PHE O 1 1 7 3865 1 1 32 SER C C 11.892 -5.314 -2.039 1.00 . A A . 53 SER C 1 1 7 3866 1 1 32 SER CA C 10.524 -5.313 -2.752 1.00 . A A . 53 SER CA 1 1 7 3867 1 1 32 SER CB C 10.719 -5.712 -4.221 1.00 . A A . 53 SER CB 1 1 7 3868 1 1 32 SER H H 9.543 -3.588 -3.543 1.00 . A A . 53 SER H 1 1 7 3869 1 1 32 SER HA H 9.920 -6.086 -2.275 1.00 . A A . 53 SER HA 1 1 7 3870 1 1 32 SER HB2 H 11.360 -4.980 -4.715 1.00 . A A . 53 SER HB2 1 1 7 3871 1 1 32 SER HB3 H 11.202 -6.690 -4.271 1.00 . A A . 53 SER HB3 1 1 7 3872 1 1 32 SER HG H 9.629 -6.063 -5.810 1.00 . A A . 53 SER HG 1 1 7 3873 1 1 32 SER N N 9.786 -4.039 -2.671 1.00 . A A . 53 SER N 1 1 7 3874 1 1 32 SER O O 12.548 -6.358 -1.982 1.00 . A A . 53 SER O 1 1 7 3875 1 1 32 SER OG O 9.471 -5.774 -4.891 1.00 . A A . 53 SER OG 1 1 7 3876 1 1 33 LYS C C 13.420 -3.280 0.589 1.00 . A A . 54 LYS C 1 1 7 3877 1 1 33 LYS CA C 13.599 -3.966 -0.782 1.00 . A A . 54 LYS CA 1 1 7 3878 1 1 33 LYS CB C 14.604 -3.198 -1.669 1.00 . A A . 54 LYS CB 1 1 7 3879 1 1 33 LYS CD C 14.167 -3.477 -4.216 1.00 . A A . 54 LYS CD 1 1 7 3880 1 1 33 LYS CE C 14.577 -2.076 -4.687 1.00 . A A . 54 LYS CE 1 1 7 3881 1 1 33 LYS CG C 14.978 -3.916 -2.983 1.00 . A A . 54 LYS CG 1 1 7 3882 1 1 33 LYS H H 11.746 -3.343 -1.634 1.00 . A A . 54 LYS H 1 1 7 3883 1 1 33 LYS HA H 14.028 -4.943 -0.553 1.00 . A A . 54 LYS HA 1 1 7 3884 1 1 33 LYS HB2 H 14.221 -2.199 -1.878 1.00 . A A . 54 LYS HB2 1 1 7 3885 1 1 33 LYS HB3 H 15.530 -3.080 -1.104 1.00 . A A . 54 LYS HB3 1 1 7 3886 1 1 33 LYS HD2 H 14.358 -4.191 -5.019 1.00 . A A . 54 LYS HD2 1 1 7 3887 1 1 33 LYS HD3 H 13.101 -3.489 -3.992 1.00 . A A . 54 LYS HD3 1 1 7 3888 1 1 33 LYS HE2 H 14.362 -1.352 -3.896 1.00 . A A . 54 LYS HE2 1 1 7 3889 1 1 33 LYS HE3 H 15.658 -2.069 -4.864 1.00 . A A . 54 LYS HE3 1 1 7 3890 1 1 33 LYS HG2 H 16.032 -3.728 -3.191 1.00 . A A . 54 LYS HG2 1 1 7 3891 1 1 33 LYS HG3 H 14.868 -4.993 -2.848 1.00 . A A . 54 LYS HG3 1 1 7 3892 1 1 33 LYS HZ1 H 14.035 -2.355 -6.677 1.00 . A A . 54 LYS HZ1 1 1 7 3893 1 1 33 LYS HZ2 H 12.860 -1.639 -5.779 1.00 . A A . 54 LYS HZ2 1 1 7 3894 1 1 33 LYS HZ3 H 14.168 -0.784 -6.259 1.00 . A A . 54 LYS HZ3 1 1 7 3895 1 1 33 LYS N N 12.331 -4.161 -1.507 1.00 . A A . 54 LYS N 1 1 7 3896 1 1 33 LYS NZ N 13.864 -1.692 -5.933 1.00 . A A . 54 LYS NZ 1 1 7 3897 1 1 33 LYS O O 14.418 -2.928 1.221 1.00 . A A . 54 LYS O 1 1 7 3898 1 1 34 GLN C C 10.585 -2.988 3.016 1.00 . A A . 55 GLN C 1 1 7 3899 1 1 34 GLN CA C 11.901 -2.494 2.382 1.00 . A A . 55 GLN CA 1 1 7 3900 1 1 34 GLN CB C 11.895 -0.958 2.241 1.00 . A A . 55 GLN CB 1 1 7 3901 1 1 34 GLN CD C 11.752 1.270 3.435 1.00 . A A . 55 GLN CD 1 1 7 3902 1 1 34 GLN CG C 11.816 -0.246 3.600 1.00 . A A . 55 GLN CG 1 1 7 3903 1 1 34 GLN H H 11.410 -3.464 0.528 1.00 . A A . 55 GLN H 1 1 7 3904 1 1 34 GLN HA H 12.704 -2.767 3.069 1.00 . A A . 55 GLN HA 1 1 7 3905 1 1 34 GLN HB2 H 12.814 -0.640 1.745 1.00 . A A . 55 GLN HB2 1 1 7 3906 1 1 34 GLN HB3 H 11.053 -0.651 1.619 1.00 . A A . 55 GLN HB3 1 1 7 3907 1 1 34 GLN HE21 H 9.736 1.258 3.369 1.00 . A A . 55 GLN HE21 1 1 7 3908 1 1 34 GLN HE22 H 10.509 2.834 3.231 1.00 . A A . 55 GLN HE22 1 1 7 3909 1 1 34 GLN HG2 H 10.929 -0.575 4.144 1.00 . A A . 55 GLN HG2 1 1 7 3910 1 1 34 GLN HG3 H 12.694 -0.501 4.195 1.00 . A A . 55 GLN HG3 1 1 7 3911 1 1 34 GLN N N 12.181 -3.089 1.065 1.00 . A A . 55 GLN N 1 1 7 3912 1 1 34 GLN NE2 N 10.567 1.835 3.338 1.00 . A A . 55 GLN NE2 1 1 7 3913 1 1 34 GLN O O 10.602 -3.531 4.122 1.00 . A A . 55 GLN O 1 1 7 3914 1 1 34 GLN OE1 O 12.758 1.967 3.385 1.00 . A A . 55 GLN OE1 1 1 7 3915 1 1 35 CYS C C 7.389 -4.238 2.596 1.00 . A A . 56 CYS C 1 1 7 3916 1 1 35 CYS CA C 8.107 -2.908 2.909 1.00 . A A . 56 CYS CA 1 1 7 3917 1 1 35 CYS CB C 7.283 -1.708 2.411 1.00 . A A . 56 CYS CB 1 1 7 3918 1 1 35 CYS H H 9.523 -2.338 1.435 1.00 . A A . 56 CYS H 1 1 7 3919 1 1 35 CYS HA H 8.179 -2.827 3.994 1.00 . A A . 56 CYS HA 1 1 7 3920 1 1 35 CYS HB2 H 7.166 -1.760 1.325 1.00 . A A . 56 CYS HB2 1 1 7 3921 1 1 35 CYS HB3 H 6.289 -1.748 2.861 1.00 . A A . 56 CYS HB3 1 1 7 3922 1 1 35 CYS N N 9.451 -2.802 2.327 1.00 . A A . 56 CYS N 1 1 7 3923 1 1 35 CYS O O 6.387 -4.568 3.238 1.00 . A A . 56 CYS O 1 1 7 3924 1 1 35 CYS SG S 8.101 -0.160 2.883 1.00 . A A . 56 CYS SG 1 1 7 3925 1 1 36 ARG C C 8.326 -7.292 0.672 1.00 . A A . 57 ARG C 1 1 7 3926 1 1 36 ARG CA C 7.278 -6.229 1.071 1.00 . A A . 57 ARG CA 1 1 7 3927 1 1 36 ARG CB C 6.365 -5.846 -0.119 1.00 . A A . 57 ARG CB 1 1 7 3928 1 1 36 ARG CD C 3.838 -5.893 0.344 1.00 . A A . 57 ARG CD 1 1 7 3929 1 1 36 ARG CG C 5.064 -6.669 -0.169 1.00 . A A . 57 ARG CG 1 1 7 3930 1 1 36 ARG CZ C 3.236 -4.478 2.317 1.00 . A A . 57 ARG CZ 1 1 7 3931 1 1 36 ARG H H 8.679 -4.611 1.109 1.00 . A A . 57 ARG H 1 1 7 3932 1 1 36 ARG HA H 6.681 -6.688 1.860 1.00 . A A . 57 ARG HA 1 1 7 3933 1 1 36 ARG HB2 H 6.102 -4.790 -0.065 1.00 . A A . 57 ARG HB2 1 1 7 3934 1 1 36 ARG HB3 H 6.914 -5.980 -1.052 1.00 . A A . 57 ARG HB3 1 1 7 3935 1 1 36 ARG HD2 H 3.609 -5.106 -0.376 1.00 . A A . 57 ARG HD2 1 1 7 3936 1 1 36 ARG HD3 H 2.985 -6.574 0.388 1.00 . A A . 57 ARG HD3 1 1 7 3937 1 1 36 ARG HE H 4.971 -5.388 2.091 1.00 . A A . 57 ARG HE 1 1 7 3938 1 1 36 ARG HG2 H 4.869 -6.946 -1.207 1.00 . A A . 57 ARG HG2 1 1 7 3939 1 1 36 ARG HG3 H 5.176 -7.592 0.402 1.00 . A A . 57 ARG HG3 1 1 7 3940 1 1 36 ARG HH11 H 1.752 -4.589 0.995 1.00 . A A . 57 ARG HH11 1 1 7 3941 1 1 36 ARG HH12 H 1.530 -3.429 2.283 1.00 . A A . 57 ARG HH12 1 1 7 3942 1 1 36 ARG HH21 H 4.576 -4.074 3.731 1.00 . A A . 57 ARG HH21 1 1 7 3943 1 1 36 ARG HH22 H 2.991 -3.348 3.955 1.00 . A A . 57 ARG HH22 1 1 7 3944 1 1 36 ARG N N 7.883 -4.995 1.610 1.00 . A A . 57 ARG N 1 1 7 3945 1 1 36 ARG NE N 4.057 -5.283 1.671 1.00 . A A . 57 ARG NE 1 1 7 3946 1 1 36 ARG NH1 N 2.041 -4.210 1.889 1.00 . A A . 57 ARG NH1 1 1 7 3947 1 1 36 ARG NH2 N 3.627 -3.906 3.416 1.00 . A A . 57 ARG NH2 1 1 7 3948 1 1 36 ARG O O 8.004 -8.225 -0.069 1.00 . A A . 57 ARG O 1 1 7 3949 1 1 37 SER C C 10.482 -9.491 1.054 1.00 . A A . 58 SER C 1 1 7 3950 1 1 37 SER CA C 10.748 -7.986 0.896 1.00 . A A . 58 SER CA 1 1 7 3951 1 1 37 SER CB C 11.892 -7.576 1.828 1.00 . A A . 58 SER CB 1 1 7 3952 1 1 37 SER H H 9.728 -6.322 1.725 1.00 . A A . 58 SER H 1 1 7 3953 1 1 37 SER HA H 11.084 -7.825 -0.127 1.00 . A A . 58 SER HA 1 1 7 3954 1 1 37 SER HB2 H 11.624 -7.821 2.860 1.00 . A A . 58 SER HB2 1 1 7 3955 1 1 37 SER HB3 H 12.790 -8.137 1.562 1.00 . A A . 58 SER HB3 1 1 7 3956 1 1 37 SER HG H 12.854 -5.945 2.337 1.00 . A A . 58 SER HG 1 1 7 3957 1 1 37 SER N N 9.570 -7.129 1.142 1.00 . A A . 58 SER N 1 1 7 3958 1 1 37 SER O O 9.929 -9.904 2.100 1.00 . A A . 58 SER O 1 1 7 3959 1 1 37 SER OXT O 10.863 -10.259 0.139 1.00 . A A . 58 SER OXT 1 1 7 3960 1 1 37 SER OG O 12.136 -6.181 1.717 1.00 . A A . 58 SER OG 1 1 7 3961 2 2 1 ZN ZN ZN -8.246 0.472 3.764 1.00 . B A . 1059 ZN ZN 1 1 7 3962 3 2 1 ZN ZN ZN 6.965 1.393 1.931 1.00 . C A . 1060 ZN ZN 1 1 8 3963 1 1 1 GLN C C -6.272 -1.561 -4.569 1.00 . A A . 22 GLN C 1 1 8 3964 1 1 1 GLN CA C -6.158 -1.218 -6.056 1.00 . A A . 22 GLN CA 1 1 8 3965 1 1 1 GLN CB C -4.732 -0.763 -6.442 1.00 . A A . 22 GLN CB 1 1 8 3966 1 1 1 GLN CD C -2.876 0.987 -6.331 1.00 . A A . 22 GLN CD 1 1 8 3967 1 1 1 GLN CG C -4.338 0.667 -6.019 1.00 . A A . 22 GLN CG 1 1 8 3968 1 1 1 GLN H1 H -7.108 0.613 -5.900 1.00 . A A . 22 GLN H1 1 1 8 3969 1 1 1 GLN H2 H -7.137 -0.012 -7.427 1.00 . A A . 22 GLN H2 1 1 8 3970 1 1 1 GLN H3 H -8.123 -0.618 -6.261 1.00 . A A . 22 GLN H3 1 1 8 3971 1 1 1 GLN HA H -6.350 -2.142 -6.604 1.00 . A A . 22 GLN HA 1 1 8 3972 1 1 1 GLN HB2 H -4.025 -1.472 -6.008 1.00 . A A . 22 GLN HB2 1 1 8 3973 1 1 1 GLN HB3 H -4.634 -0.829 -7.527 1.00 . A A . 22 GLN HB3 1 1 8 3974 1 1 1 GLN HE21 H -3.280 2.896 -6.877 1.00 . A A . 22 GLN HE21 1 1 8 3975 1 1 1 GLN HE22 H -1.599 2.388 -6.960 1.00 . A A . 22 GLN HE22 1 1 8 3976 1 1 1 GLN HG2 H -4.970 1.384 -6.545 1.00 . A A . 22 GLN HG2 1 1 8 3977 1 1 1 GLN HG3 H -4.497 0.804 -4.951 1.00 . A A . 22 GLN HG3 1 1 8 3978 1 1 1 GLN N N -7.203 -0.236 -6.446 1.00 . A A . 22 GLN N 1 1 8 3979 1 1 1 GLN NE2 N -2.567 2.194 -6.752 1.00 . A A . 22 GLN NE2 1 1 8 3980 1 1 1 GLN O O -6.352 -0.664 -3.737 1.00 . A A . 22 GLN O 1 1 8 3981 1 1 1 GLN OE1 O -1.978 0.166 -6.204 1.00 . A A . 22 GLN OE1 1 1 8 3982 1 1 2 THR C C -5.893 -2.765 -1.734 1.00 . A A . 23 THR C 1 1 8 3983 1 1 2 THR CA C -6.691 -3.377 -2.892 1.00 . A A . 23 THR CA 1 1 8 3984 1 1 2 THR CB C -6.540 -4.910 -2.879 1.00 . A A . 23 THR CB 1 1 8 3985 1 1 2 THR CG2 C -7.202 -5.577 -1.671 1.00 . A A . 23 THR CG2 1 1 8 3986 1 1 2 THR H H -6.264 -3.552 -4.960 1.00 . A A . 23 THR H 1 1 8 3987 1 1 2 THR HA H -7.739 -3.150 -2.721 1.00 . A A . 23 THR HA 1 1 8 3988 1 1 2 THR HB H -5.481 -5.170 -2.901 1.00 . A A . 23 THR HB 1 1 8 3989 1 1 2 THR HG1 H -6.971 -6.399 -4.056 1.00 . A A . 23 THR HG1 1 1 8 3990 1 1 2 THR HG21 H -8.262 -5.328 -1.645 1.00 . A A . 23 THR HG21 1 1 8 3991 1 1 2 THR HG22 H -7.093 -6.659 -1.746 1.00 . A A . 23 THR HG22 1 1 8 3992 1 1 2 THR HG23 H -6.723 -5.251 -0.749 1.00 . A A . 23 THR HG23 1 1 8 3993 1 1 2 THR N N -6.336 -2.853 -4.230 1.00 . A A . 23 THR N 1 1 8 3994 1 1 2 THR O O -4.677 -2.600 -1.826 1.00 . A A . 23 THR O 1 1 8 3995 1 1 2 THR OG1 O -7.170 -5.446 -4.026 1.00 . A A . 23 THR OG1 1 1 8 3996 1 1 3 CYS C C -4.928 -2.777 1.254 1.00 . A A . 24 CYS C 1 1 8 3997 1 1 3 CYS CA C -6.029 -1.906 0.609 1.00 . A A . 24 CYS CA 1 1 8 3998 1 1 3 CYS CB C -7.198 -1.755 1.585 1.00 . A A . 24 CYS CB 1 1 8 3999 1 1 3 CYS H H -7.586 -2.579 -0.665 1.00 . A A . 24 CYS H 1 1 8 4000 1 1 3 CYS HA H -5.621 -0.917 0.392 1.00 . A A . 24 CYS HA 1 1 8 4001 1 1 3 CYS HB2 H -8.055 -1.328 1.068 1.00 . A A . 24 CYS HB2 1 1 8 4002 1 1 3 CYS HB3 H -7.485 -2.741 1.955 1.00 . A A . 24 CYS HB3 1 1 8 4003 1 1 3 CYS N N -6.585 -2.457 -0.631 1.00 . A A . 24 CYS N 1 1 8 4004 1 1 3 CYS O O -4.975 -4.008 1.189 1.00 . A A . 24 CYS O 1 1 8 4005 1 1 3 CYS SG S -6.723 -0.679 2.961 1.00 . A A . 24 CYS SG 1 1 8 4006 1 1 4 TYR C C -3.756 -3.418 4.155 1.00 . A A . 25 TYR C 1 1 8 4007 1 1 4 TYR CA C -3.080 -2.806 2.906 1.00 . A A . 25 TYR CA 1 1 8 4008 1 1 4 TYR CB C -1.960 -1.836 3.327 1.00 . A A . 25 TYR CB 1 1 8 4009 1 1 4 TYR CD1 C -3.358 -0.047 4.491 1.00 . A A . 25 TYR CD1 1 1 8 4010 1 1 4 TYR CD2 C -1.449 -0.992 5.667 1.00 . A A . 25 TYR CD2 1 1 8 4011 1 1 4 TYR CE1 C -3.645 0.760 5.604 1.00 . A A . 25 TYR CE1 1 1 8 4012 1 1 4 TYR CE2 C -1.725 -0.173 6.779 1.00 . A A . 25 TYR CE2 1 1 8 4013 1 1 4 TYR CG C -2.261 -0.931 4.516 1.00 . A A . 25 TYR CG 1 1 8 4014 1 1 4 TYR CZ C -2.829 0.707 6.751 1.00 . A A . 25 TYR CZ 1 1 8 4015 1 1 4 TYR H H -4.035 -1.125 1.988 1.00 . A A . 25 TYR H 1 1 8 4016 1 1 4 TYR HA H -2.619 -3.636 2.373 1.00 . A A . 25 TYR HA 1 1 8 4017 1 1 4 TYR HB2 H -1.096 -2.450 3.583 1.00 . A A . 25 TYR HB2 1 1 8 4018 1 1 4 TYR HB3 H -1.669 -1.221 2.477 1.00 . A A . 25 TYR HB3 1 1 8 4019 1 1 4 TYR HD1 H -3.998 0.010 3.622 1.00 . A A . 25 TYR HD1 1 1 8 4020 1 1 4 TYR HD2 H -0.609 -1.675 5.700 1.00 . A A . 25 TYR HD2 1 1 8 4021 1 1 4 TYR HE1 H -4.505 1.407 5.591 1.00 . A A . 25 TYR HE1 1 1 8 4022 1 1 4 TYR HE2 H -1.096 -0.221 7.658 1.00 . A A . 25 TYR HE2 1 1 8 4023 1 1 4 TYR HH H -2.507 1.347 8.560 1.00 . A A . 25 TYR HH 1 1 8 4024 1 1 4 TYR N N -4.003 -2.138 1.977 1.00 . A A . 25 TYR N 1 1 8 4025 1 1 4 TYR O O -3.133 -4.217 4.859 1.00 . A A . 25 TYR O 1 1 8 4026 1 1 4 TYR OH O -3.123 1.494 7.821 1.00 . A A . 25 TYR OH 1 1 8 4027 1 1 5 ASN C C -7.160 -3.880 5.449 1.00 . A A . 26 ASN C 1 1 8 4028 1 1 5 ASN CA C -5.722 -3.373 5.679 1.00 . A A . 26 ASN CA 1 1 8 4029 1 1 5 ASN CB C -5.717 -2.092 6.536 1.00 . A A . 26 ASN CB 1 1 8 4030 1 1 5 ASN CG C -6.551 -2.223 7.800 1.00 . A A . 26 ASN CG 1 1 8 4031 1 1 5 ASN H H -5.445 -2.385 3.808 1.00 . A A . 26 ASN H 1 1 8 4032 1 1 5 ASN HA H -5.194 -4.157 6.228 1.00 . A A . 26 ASN HA 1 1 8 4033 1 1 5 ASN HB2 H -4.692 -1.858 6.823 1.00 . A A . 26 ASN HB2 1 1 8 4034 1 1 5 ASN HB3 H -6.098 -1.254 5.951 1.00 . A A . 26 ASN HB3 1 1 8 4035 1 1 5 ASN HD21 H -8.194 -1.400 6.933 1.00 . A A . 26 ASN HD21 1 1 8 4036 1 1 5 ASN HD22 H -8.345 -1.876 8.617 1.00 . A A . 26 ASN HD22 1 1 8 4037 1 1 5 ASN N N -5.016 -3.059 4.432 1.00 . A A . 26 ASN N 1 1 8 4038 1 1 5 ASN ND2 N -7.791 -1.785 7.780 1.00 . A A . 26 ASN ND2 1 1 8 4039 1 1 5 ASN O O -7.558 -4.895 6.024 1.00 . A A . 26 ASN O 1 1 8 4040 1 1 5 ASN OD1 O -6.101 -2.730 8.818 1.00 . A A . 26 ASN OD1 1 1 8 4041 1 1 6 CYS C C -9.827 -4.522 3.599 1.00 . A A . 27 CYS C 1 1 8 4042 1 1 6 CYS CA C -9.386 -3.344 4.501 1.00 . A A . 27 CYS CA 1 1 8 4043 1 1 6 CYS CB C -9.970 -2.011 4.002 1.00 . A A . 27 CYS CB 1 1 8 4044 1 1 6 CYS H H -7.545 -2.345 4.192 1.00 . A A . 27 CYS H 1 1 8 4045 1 1 6 CYS HA H -9.789 -3.531 5.498 1.00 . A A . 27 CYS HA 1 1 8 4046 1 1 6 CYS HB2 H -9.639 -1.833 2.977 1.00 . A A . 27 CYS HB2 1 1 8 4047 1 1 6 CYS HB3 H -11.060 -2.085 3.997 1.00 . A A . 27 CYS HB3 1 1 8 4048 1 1 6 CYS N N -7.935 -3.177 4.618 1.00 . A A . 27 CYS N 1 1 8 4049 1 1 6 CYS O O -11.013 -4.854 3.561 1.00 . A A . 27 CYS O 1 1 8 4050 1 1 6 CYS SG S -9.464 -0.634 5.079 1.00 . A A . 27 CYS SG 1 1 8 4051 1 1 7 GLY C C -10.187 -5.908 0.821 1.00 . A A . 28 GLY C 1 1 8 4052 1 1 7 GLY CA C -9.177 -6.252 1.928 1.00 . A A . 28 GLY CA 1 1 8 4053 1 1 7 GLY H H -7.937 -4.853 2.974 1.00 . A A . 28 GLY H 1 1 8 4054 1 1 7 GLY HA2 H -9.558 -7.106 2.491 1.00 . A A . 28 GLY HA2 1 1 8 4055 1 1 7 GLY HA3 H -8.244 -6.549 1.449 1.00 . A A . 28 GLY HA3 1 1 8 4056 1 1 7 GLY N N -8.896 -5.145 2.859 1.00 . A A . 28 GLY N 1 1 8 4057 1 1 7 GLY O O -10.980 -6.760 0.415 1.00 . A A . 28 GLY O 1 1 8 4058 1 1 8 LYS C C -10.601 -3.415 -1.750 1.00 . A A . 29 LYS C 1 1 8 4059 1 1 8 LYS CA C -11.226 -4.033 -0.481 1.00 . A A . 29 LYS CA 1 1 8 4060 1 1 8 LYS CB C -11.959 -2.996 0.395 1.00 . A A . 29 LYS CB 1 1 8 4061 1 1 8 LYS CD C -14.310 -3.155 -0.698 1.00 . A A . 29 LYS CD 1 1 8 4062 1 1 8 LYS CE C -14.924 -3.981 0.446 1.00 . A A . 29 LYS CE 1 1 8 4063 1 1 8 LYS CG C -13.129 -2.260 -0.285 1.00 . A A . 29 LYS CG 1 1 8 4064 1 1 8 LYS H H -9.480 -4.033 0.745 1.00 . A A . 29 LYS H 1 1 8 4065 1 1 8 LYS HA H -11.953 -4.791 -0.763 1.00 . A A . 29 LYS HA 1 1 8 4066 1 1 8 LYS HB2 H -12.332 -3.493 1.292 1.00 . A A . 29 LYS HB2 1 1 8 4067 1 1 8 LYS HB3 H -11.237 -2.255 0.732 1.00 . A A . 29 LYS HB3 1 1 8 4068 1 1 8 LYS HD2 H -15.087 -2.528 -1.138 1.00 . A A . 29 LYS HD2 1 1 8 4069 1 1 8 LYS HD3 H -13.977 -3.844 -1.475 1.00 . A A . 29 LYS HD3 1 1 8 4070 1 1 8 LYS HE2 H -15.672 -4.653 0.018 1.00 . A A . 29 LYS HE2 1 1 8 4071 1 1 8 LYS HE3 H -14.147 -4.607 0.896 1.00 . A A . 29 LYS HE3 1 1 8 4072 1 1 8 LYS HG2 H -13.493 -1.495 0.401 1.00 . A A . 29 LYS HG2 1 1 8 4073 1 1 8 LYS HG3 H -12.758 -1.741 -1.171 1.00 . A A . 29 LYS HG3 1 1 8 4074 1 1 8 LYS HZ1 H -16.297 -2.557 1.092 1.00 . A A . 29 LYS HZ1 1 1 8 4075 1 1 8 LYS HZ2 H -15.986 -3.700 2.209 1.00 . A A . 29 LYS HZ2 1 1 8 4076 1 1 8 LYS HZ3 H -14.897 -2.519 1.937 1.00 . A A . 29 LYS HZ3 1 1 8 4077 1 1 8 LYS N N -10.183 -4.648 0.360 1.00 . A A . 29 LYS N 1 1 8 4078 1 1 8 LYS NZ N -15.564 -3.131 1.487 1.00 . A A . 29 LYS NZ 1 1 8 4079 1 1 8 LYS O O -9.858 -2.439 -1.613 1.00 . A A . 29 LYS O 1 1 8 4080 1 1 9 PRO C C -10.395 -1.985 -4.540 1.00 . A A . 30 PRO C 1 1 8 4081 1 1 9 PRO CA C -10.281 -3.488 -4.235 1.00 . A A . 30 PRO CA 1 1 8 4082 1 1 9 PRO CB C -10.975 -4.309 -5.327 1.00 . A A . 30 PRO CB 1 1 8 4083 1 1 9 PRO CD C -11.623 -5.177 -3.202 1.00 . A A . 30 PRO CD 1 1 8 4084 1 1 9 PRO CG C -11.284 -5.624 -4.622 1.00 . A A . 30 PRO CG 1 1 8 4085 1 1 9 PRO HA H -9.225 -3.752 -4.242 1.00 . A A . 30 PRO HA 1 1 8 4086 1 1 9 PRO HB2 H -11.911 -3.832 -5.625 1.00 . A A . 30 PRO HB2 1 1 8 4087 1 1 9 PRO HB3 H -10.330 -4.458 -6.193 1.00 . A A . 30 PRO HB3 1 1 8 4088 1 1 9 PRO HD2 H -12.691 -4.960 -3.136 1.00 . A A . 30 PRO HD2 1 1 8 4089 1 1 9 PRO HD3 H -11.353 -5.965 -2.500 1.00 . A A . 30 PRO HD3 1 1 8 4090 1 1 9 PRO HG2 H -12.117 -6.151 -5.090 1.00 . A A . 30 PRO HG2 1 1 8 4091 1 1 9 PRO HG3 H -10.391 -6.250 -4.605 1.00 . A A . 30 PRO HG3 1 1 8 4092 1 1 9 PRO N N -10.862 -3.953 -2.962 1.00 . A A . 30 PRO N 1 1 8 4093 1 1 9 PRO O O -9.495 -1.422 -5.168 1.00 . A A . 30 PRO O 1 1 8 4094 1 1 10 GLY C C -10.931 1.100 -3.522 1.00 . A A . 31 GLY C 1 1 8 4095 1 1 10 GLY CA C -11.771 0.097 -4.329 1.00 . A A . 31 GLY CA 1 1 8 4096 1 1 10 GLY H H -12.163 -1.861 -3.592 1.00 . A A . 31 GLY H 1 1 8 4097 1 1 10 GLY HA2 H -12.822 0.277 -4.108 1.00 . A A . 31 GLY HA2 1 1 8 4098 1 1 10 GLY HA3 H -11.611 0.309 -5.387 1.00 . A A . 31 GLY HA3 1 1 8 4099 1 1 10 GLY N N -11.463 -1.322 -4.082 1.00 . A A . 31 GLY N 1 1 8 4100 1 1 10 GLY O O -11.462 2.104 -3.040 1.00 . A A . 31 GLY O 1 1 8 4101 1 1 11 HIS C C -7.658 2.366 -3.423 1.00 . A A . 32 HIS C 1 1 8 4102 1 1 11 HIS CA C -8.702 1.638 -2.563 1.00 . A A . 32 HIS CA 1 1 8 4103 1 1 11 HIS CB C -8.053 0.774 -1.470 1.00 . A A . 32 HIS CB 1 1 8 4104 1 1 11 HIS CD2 C -8.488 1.415 0.969 1.00 . A A . 32 HIS CD2 1 1 8 4105 1 1 11 HIS CE1 C -10.391 0.376 1.316 1.00 . A A . 32 HIS CE1 1 1 8 4106 1 1 11 HIS CG C -8.837 0.780 -0.189 1.00 . A A . 32 HIS CG 1 1 8 4107 1 1 11 HIS H H -9.275 -0.012 -3.780 1.00 . A A . 32 HIS H 1 1 8 4108 1 1 11 HIS HA H -9.262 2.425 -2.059 1.00 . A A . 32 HIS HA 1 1 8 4109 1 1 11 HIS HB2 H -7.960 -0.255 -1.815 1.00 . A A . 32 HIS HB2 1 1 8 4110 1 1 11 HIS HB3 H -7.048 1.141 -1.254 1.00 . A A . 32 HIS HB3 1 1 8 4111 1 1 11 HIS HD1 H -10.499 -0.482 -0.610 1.00 . A A . 32 HIS HD1 1 1 8 4112 1 1 11 HIS HD2 H -7.602 2.013 1.105 1.00 . A A . 32 HIS HD2 1 1 8 4113 1 1 11 HIS HE1 H -11.284 -0.013 1.791 1.00 . A A . 32 HIS HE1 1 1 8 4114 1 1 11 HIS N N -9.638 0.824 -3.342 1.00 . A A . 32 HIS N 1 1 8 4115 1 1 11 HIS ND1 N -10.025 0.133 0.045 1.00 . A A . 32 HIS ND1 1 1 8 4116 1 1 11 HIS NE2 N -9.467 1.138 1.933 1.00 . A A . 32 HIS NE2 1 1 8 4117 1 1 11 HIS O O -7.361 1.994 -4.563 1.00 . A A . 32 HIS O 1 1 8 4118 1 1 12 LEU C C -5.437 5.079 -2.198 1.00 . A A . 33 LEU C 1 1 8 4119 1 1 12 LEU CA C -6.188 4.425 -3.376 1.00 . A A . 33 LEU CA 1 1 8 4120 1 1 12 LEU CB C -6.971 5.524 -4.136 1.00 . A A . 33 LEU CB 1 1 8 4121 1 1 12 LEU CD1 C -8.436 6.308 -6.012 1.00 . A A . 33 LEU CD1 1 1 8 4122 1 1 12 LEU CD2 C -6.650 4.670 -6.514 1.00 . A A . 33 LEU CD2 1 1 8 4123 1 1 12 LEU CG C -7.658 5.117 -5.454 1.00 . A A . 33 LEU CG 1 1 8 4124 1 1 12 LEU H H -7.403 3.609 -1.878 1.00 . A A . 33 LEU H 1 1 8 4125 1 1 12 LEU HA H -5.461 3.943 -4.031 1.00 . A A . 33 LEU HA 1 1 8 4126 1 1 12 LEU HB2 H -7.734 5.920 -3.463 1.00 . A A . 33 LEU HB2 1 1 8 4127 1 1 12 LEU HB3 H -6.291 6.345 -4.368 1.00 . A A . 33 LEU HB3 1 1 8 4128 1 1 12 LEU HD11 H -9.182 6.631 -5.286 1.00 . A A . 33 LEU HD11 1 1 8 4129 1 1 12 LEU HD12 H -7.758 7.136 -6.222 1.00 . A A . 33 LEU HD12 1 1 8 4130 1 1 12 LEU HD13 H -8.947 6.018 -6.930 1.00 . A A . 33 LEU HD13 1 1 8 4131 1 1 12 LEU HD21 H -5.923 5.463 -6.701 1.00 . A A . 33 LEU HD21 1 1 8 4132 1 1 12 LEU HD22 H -6.129 3.774 -6.182 1.00 . A A . 33 LEU HD22 1 1 8 4133 1 1 12 LEU HD23 H -7.172 4.437 -7.442 1.00 . A A . 33 LEU HD23 1 1 8 4134 1 1 12 LEU HG H -8.369 4.314 -5.269 1.00 . A A . 33 LEU HG 1 1 8 4135 1 1 12 LEU N N -7.131 3.442 -2.837 1.00 . A A . 33 LEU N 1 1 8 4136 1 1 12 LEU O O -5.844 4.932 -1.039 1.00 . A A . 33 LEU O 1 1 8 4137 1 1 13 SER C C -4.646 7.752 -0.771 1.00 . A A . 34 SER C 1 1 8 4138 1 1 13 SER CA C -3.727 6.782 -1.540 1.00 . A A . 34 SER CA 1 1 8 4139 1 1 13 SER CB C -2.687 7.614 -2.300 1.00 . A A . 34 SER CB 1 1 8 4140 1 1 13 SER H H -4.105 5.930 -3.454 1.00 . A A . 34 SER H 1 1 8 4141 1 1 13 SER HA H -3.208 6.166 -0.804 1.00 . A A . 34 SER HA 1 1 8 4142 1 1 13 SER HB2 H -3.197 8.260 -3.015 1.00 . A A . 34 SER HB2 1 1 8 4143 1 1 13 SER HB3 H -2.134 8.240 -1.598 1.00 . A A . 34 SER HB3 1 1 8 4144 1 1 13 SER HG H -1.228 7.313 -3.575 1.00 . A A . 34 SER HG 1 1 8 4145 1 1 13 SER N N -4.422 5.894 -2.496 1.00 . A A . 34 SER N 1 1 8 4146 1 1 13 SER O O -4.252 8.291 0.265 1.00 . A A . 34 SER O 1 1 8 4147 1 1 13 SER OG O -1.787 6.763 -2.992 1.00 . A A . 34 SER OG 1 1 8 4148 1 1 14 SER C C -7.961 8.017 0.141 1.00 . A A . 35 SER C 1 1 8 4149 1 1 14 SER CA C -6.916 8.815 -0.660 1.00 . A A . 35 SER CA 1 1 8 4150 1 1 14 SER CB C -7.617 9.605 -1.772 1.00 . A A . 35 SER CB 1 1 8 4151 1 1 14 SER H H -6.096 7.566 -2.161 1.00 . A A . 35 SER H 1 1 8 4152 1 1 14 SER HA H -6.460 9.532 0.023 1.00 . A A . 35 SER HA 1 1 8 4153 1 1 14 SER HB2 H -8.438 10.189 -1.349 1.00 . A A . 35 SER HB2 1 1 8 4154 1 1 14 SER HB3 H -6.902 10.294 -2.223 1.00 . A A . 35 SER HB3 1 1 8 4155 1 1 14 SER HG H -8.561 9.257 -3.453 1.00 . A A . 35 SER HG 1 1 8 4156 1 1 14 SER N N -5.865 7.984 -1.269 1.00 . A A . 35 SER N 1 1 8 4157 1 1 14 SER O O -8.809 8.620 0.806 1.00 . A A . 35 SER O 1 1 8 4158 1 1 14 SER OG O -8.112 8.722 -2.770 1.00 . A A . 35 SER OG 1 1 8 4159 1 1 15 GLN C C -8.288 5.203 2.087 1.00 . A A . 36 GLN C 1 1 8 4160 1 1 15 GLN CA C -8.866 5.785 0.777 1.00 . A A . 36 GLN CA 1 1 8 4161 1 1 15 GLN CB C -9.267 4.674 -0.211 1.00 . A A . 36 GLN CB 1 1 8 4162 1 1 15 GLN CD C -11.810 4.759 -0.337 1.00 . A A . 36 GLN CD 1 1 8 4163 1 1 15 GLN CG C -10.591 3.974 0.142 1.00 . A A . 36 GLN CG 1 1 8 4164 1 1 15 GLN H H -7.160 6.252 -0.424 1.00 . A A . 36 GLN H 1 1 8 4165 1 1 15 GLN HA H -9.764 6.351 1.032 1.00 . A A . 36 GLN HA 1 1 8 4166 1 1 15 GLN HB2 H -9.362 5.092 -1.215 1.00 . A A . 36 GLN HB2 1 1 8 4167 1 1 15 GLN HB3 H -8.469 3.933 -0.239 1.00 . A A . 36 GLN HB3 1 1 8 4168 1 1 15 GLN HE21 H -12.020 3.623 -2.011 1.00 . A A . 36 GLN HE21 1 1 8 4169 1 1 15 GLN HE22 H -13.181 4.932 -1.791 1.00 . A A . 36 GLN HE22 1 1 8 4170 1 1 15 GLN HG2 H -10.612 2.998 -0.338 1.00 . A A . 36 GLN HG2 1 1 8 4171 1 1 15 GLN HG3 H -10.660 3.810 1.217 1.00 . A A . 36 GLN HG3 1 1 8 4172 1 1 15 GLN N N -7.907 6.679 0.109 1.00 . A A . 36 GLN N 1 1 8 4173 1 1 15 GLN NE2 N -12.377 4.412 -1.476 1.00 . A A . 36 GLN NE2 1 1 8 4174 1 1 15 GLN O O -8.984 5.191 3.103 1.00 . A A . 36 GLN O 1 1 8 4175 1 1 15 GLN OE1 O -12.273 5.699 0.297 1.00 . A A . 36 GLN OE1 1 1 8 4176 1 1 16 CYS C C -4.716 4.965 3.041 1.00 . A A . 37 CYS C 1 1 8 4177 1 1 16 CYS CA C -6.170 4.478 3.235 1.00 . A A . 37 CYS CA 1 1 8 4178 1 1 16 CYS CB C -6.200 2.956 3.493 1.00 . A A . 37 CYS CB 1 1 8 4179 1 1 16 CYS H H -6.508 4.903 1.190 1.00 . A A . 37 CYS H 1 1 8 4180 1 1 16 CYS HA H -6.562 4.992 4.110 1.00 . A A . 37 CYS HA 1 1 8 4181 1 1 16 CYS HB2 H -6.180 2.414 2.548 1.00 . A A . 37 CYS HB2 1 1 8 4182 1 1 16 CYS HB3 H -5.299 2.661 4.029 1.00 . A A . 37 CYS HB3 1 1 8 4183 1 1 16 CYS N N -7.002 4.821 2.072 1.00 . A A . 37 CYS N 1 1 8 4184 1 1 16 CYS O O -4.347 5.447 1.966 1.00 . A A . 37 CYS O 1 1 8 4185 1 1 16 CYS SG S -7.623 2.480 4.510 1.00 . A A . 37 CYS SG 1 1 8 4186 1 1 17 ARG C C -1.665 4.576 2.905 1.00 . A A . 38 ARG C 1 1 8 4187 1 1 17 ARG CA C -2.450 5.172 4.082 1.00 . A A . 38 ARG CA 1 1 8 4188 1 1 17 ARG CB C -1.783 4.778 5.416 1.00 . A A . 38 ARG CB 1 1 8 4189 1 1 17 ARG CD C -3.206 5.102 7.576 1.00 . A A . 38 ARG CD 1 1 8 4190 1 1 17 ARG CG C -2.135 5.666 6.627 1.00 . A A . 38 ARG CG 1 1 8 4191 1 1 17 ARG CZ C -5.591 4.526 7.023 1.00 . A A . 38 ARG CZ 1 1 8 4192 1 1 17 ARG H H -4.265 4.405 4.924 1.00 . A A . 38 ARG H 1 1 8 4193 1 1 17 ARG HA H -2.370 6.254 3.965 1.00 . A A . 38 ARG HA 1 1 8 4194 1 1 17 ARG HB2 H -1.983 3.730 5.643 1.00 . A A . 38 ARG HB2 1 1 8 4195 1 1 17 ARG HB3 H -0.705 4.871 5.272 1.00 . A A . 38 ARG HB3 1 1 8 4196 1 1 17 ARG HD2 H -3.031 4.036 7.714 1.00 . A A . 38 ARG HD2 1 1 8 4197 1 1 17 ARG HD3 H -3.073 5.577 8.549 1.00 . A A . 38 ARG HD3 1 1 8 4198 1 1 17 ARG HE H -4.811 6.347 6.952 1.00 . A A . 38 ARG HE 1 1 8 4199 1 1 17 ARG HG2 H -1.224 5.766 7.220 1.00 . A A . 38 ARG HG2 1 1 8 4200 1 1 17 ARG HG3 H -2.412 6.668 6.299 1.00 . A A . 38 ARG HG3 1 1 8 4201 1 1 17 ARG HH11 H -4.574 2.868 7.536 1.00 . A A . 38 ARG HH11 1 1 8 4202 1 1 17 ARG HH12 H -6.255 2.643 7.117 1.00 . A A . 38 ARG HH12 1 1 8 4203 1 1 17 ARG HH21 H -6.947 5.922 6.520 1.00 . A A . 38 ARG HH21 1 1 8 4204 1 1 17 ARG HH22 H -7.477 4.268 6.417 1.00 . A A . 38 ARG HH22 1 1 8 4205 1 1 17 ARG N N -3.880 4.806 4.081 1.00 . A A . 38 ARG N 1 1 8 4206 1 1 17 ARG NE N -4.586 5.379 7.127 1.00 . A A . 38 ARG NE 1 1 8 4207 1 1 17 ARG NH1 N -5.461 3.249 7.231 1.00 . A A . 38 ARG NH1 1 1 8 4208 1 1 17 ARG NH2 N -6.769 4.942 6.663 1.00 . A A . 38 ARG NH2 1 1 8 4209 1 1 17 ARG O O -0.786 5.258 2.374 1.00 . A A . 38 ARG O 1 1 8 4210 1 1 18 ALA C C -2.337 1.586 0.720 1.00 . A A . 39 ALA C 1 1 8 4211 1 1 18 ALA CA C -1.453 2.736 1.257 1.00 . A A . 39 ALA CA 1 1 8 4212 1 1 18 ALA CB C -0.051 2.194 1.575 1.00 . A A . 39 ALA CB 1 1 8 4213 1 1 18 ALA H H -2.710 2.854 2.970 1.00 . A A . 39 ALA H 1 1 8 4214 1 1 18 ALA HA H -1.381 3.502 0.484 1.00 . A A . 39 ALA HA 1 1 8 4215 1 1 18 ALA HB1 H 0.605 3.000 1.899 1.00 . A A . 39 ALA HB1 1 1 8 4216 1 1 18 ALA HB2 H -0.126 1.441 2.360 1.00 . A A . 39 ALA HB2 1 1 8 4217 1 1 18 ALA HB3 H 0.383 1.726 0.692 1.00 . A A . 39 ALA HB3 1 1 8 4218 1 1 18 ALA N N -1.993 3.357 2.471 1.00 . A A . 39 ALA N 1 1 8 4219 1 1 18 ALA O O -3.098 0.980 1.481 1.00 . A A . 39 ALA O 1 1 8 4220 1 1 19 PRO C C -1.662 -1.207 -0.585 1.00 . A A . 40 PRO C 1 1 8 4221 1 1 19 PRO CA C -2.612 -0.093 -1.071 1.00 . A A . 40 PRO CA 1 1 8 4222 1 1 19 PRO CB C -2.584 0.059 -2.594 1.00 . A A . 40 PRO CB 1 1 8 4223 1 1 19 PRO CD C -1.522 1.973 -1.620 1.00 . A A . 40 PRO CD 1 1 8 4224 1 1 19 PRO CG C -1.433 1.038 -2.826 1.00 . A A . 40 PRO CG 1 1 8 4225 1 1 19 PRO HA H -3.627 -0.323 -0.750 1.00 . A A . 40 PRO HA 1 1 8 4226 1 1 19 PRO HB2 H -2.429 -0.888 -3.113 1.00 . A A . 40 PRO HB2 1 1 8 4227 1 1 19 PRO HB3 H -3.521 0.517 -2.916 1.00 . A A . 40 PRO HB3 1 1 8 4228 1 1 19 PRO HD2 H -0.522 2.286 -1.324 1.00 . A A . 40 PRO HD2 1 1 8 4229 1 1 19 PRO HD3 H -2.125 2.845 -1.878 1.00 . A A . 40 PRO HD3 1 1 8 4230 1 1 19 PRO HG2 H -0.484 0.501 -2.803 1.00 . A A . 40 PRO HG2 1 1 8 4231 1 1 19 PRO HG3 H -1.543 1.583 -3.762 1.00 . A A . 40 PRO HG3 1 1 8 4232 1 1 19 PRO N N -2.196 1.217 -0.569 1.00 . A A . 40 PRO N 1 1 8 4233 1 1 19 PRO O O -0.576 -0.935 -0.067 1.00 . A A . 40 PRO O 1 1 8 4234 1 1 20 LYS C C 0.138 -3.794 -0.773 1.00 . A A . 41 LYS C 1 1 8 4235 1 1 20 LYS CA C -1.343 -3.701 -0.373 1.00 . A A . 41 LYS CA 1 1 8 4236 1 1 20 LYS CB C -2.156 -4.913 -0.868 1.00 . A A . 41 LYS CB 1 1 8 4237 1 1 20 LYS CD C -2.711 -7.370 -0.598 1.00 . A A . 41 LYS CD 1 1 8 4238 1 1 20 LYS CE C -2.299 -8.672 0.101 1.00 . A A . 41 LYS CE 1 1 8 4239 1 1 20 LYS CG C -1.775 -6.229 -0.172 1.00 . A A . 41 LYS CG 1 1 8 4240 1 1 20 LYS H H -2.949 -2.594 -1.253 1.00 . A A . 41 LYS H 1 1 8 4241 1 1 20 LYS HA H -1.341 -3.712 0.715 1.00 . A A . 41 LYS HA 1 1 8 4242 1 1 20 LYS HB2 H -3.212 -4.728 -0.674 1.00 . A A . 41 LYS HB2 1 1 8 4243 1 1 20 LYS HB3 H -2.026 -5.021 -1.946 1.00 . A A . 41 LYS HB3 1 1 8 4244 1 1 20 LYS HD2 H -3.737 -7.117 -0.325 1.00 . A A . 41 LYS HD2 1 1 8 4245 1 1 20 LYS HD3 H -2.650 -7.500 -1.680 1.00 . A A . 41 LYS HD3 1 1 8 4246 1 1 20 LYS HE2 H -1.258 -8.893 -0.154 1.00 . A A . 41 LYS HE2 1 1 8 4247 1 1 20 LYS HE3 H -2.352 -8.523 1.183 1.00 . A A . 41 LYS HE3 1 1 8 4248 1 1 20 LYS HG2 H -0.752 -6.501 -0.433 1.00 . A A . 41 LYS HG2 1 1 8 4249 1 1 20 LYS HG3 H -1.844 -6.097 0.909 1.00 . A A . 41 LYS HG3 1 1 8 4250 1 1 20 LYS HZ1 H -3.122 -9.976 -1.295 1.00 . A A . 41 LYS HZ1 1 1 8 4251 1 1 20 LYS HZ2 H -2.888 -10.662 0.166 1.00 . A A . 41 LYS HZ2 1 1 8 4252 1 1 20 LYS HZ3 H -4.136 -9.637 -0.056 1.00 . A A . 41 LYS HZ3 1 1 8 4253 1 1 20 LYS N N -2.044 -2.471 -0.806 1.00 . A A . 41 LYS N 1 1 8 4254 1 1 20 LYS NZ N -3.170 -9.809 -0.299 1.00 . A A . 41 LYS NZ 1 1 8 4255 1 1 20 LYS O O 0.902 -4.520 -0.139 1.00 . A A . 41 LYS O 1 1 8 4256 1 1 21 VAL C C 2.876 -2.399 -1.017 1.00 . A A . 42 VAL C 1 1 8 4257 1 1 21 VAL CA C 1.965 -2.817 -2.189 1.00 . A A . 42 VAL CA 1 1 8 4258 1 1 21 VAL CB C 2.016 -1.746 -3.304 1.00 . A A . 42 VAL CB 1 1 8 4259 1 1 21 VAL CG1 C 3.430 -1.518 -3.845 1.00 . A A . 42 VAL CG1 1 1 8 4260 1 1 21 VAL CG2 C 1.131 -2.127 -4.502 1.00 . A A . 42 VAL CG2 1 1 8 4261 1 1 21 VAL H H -0.146 -2.485 -2.249 1.00 . A A . 42 VAL H 1 1 8 4262 1 1 21 VAL HA H 2.356 -3.753 -2.593 1.00 . A A . 42 VAL HA 1 1 8 4263 1 1 21 VAL HB H 1.651 -0.802 -2.900 1.00 . A A . 42 VAL HB 1 1 8 4264 1 1 21 VAL HG11 H 3.848 -2.459 -4.202 1.00 . A A . 42 VAL HG11 1 1 8 4265 1 1 21 VAL HG12 H 3.407 -0.801 -4.666 1.00 . A A . 42 VAL HG12 1 1 8 4266 1 1 21 VAL HG13 H 4.073 -1.109 -3.065 1.00 . A A . 42 VAL HG13 1 1 8 4267 1 1 21 VAL HG21 H 1.439 -3.095 -4.902 1.00 . A A . 42 VAL HG21 1 1 8 4268 1 1 21 VAL HG22 H 0.083 -2.174 -4.212 1.00 . A A . 42 VAL HG22 1 1 8 4269 1 1 21 VAL HG23 H 1.223 -1.373 -5.285 1.00 . A A . 42 VAL HG23 1 1 8 4270 1 1 21 VAL N N 0.561 -3.028 -1.780 1.00 . A A . 42 VAL N 1 1 8 4271 1 1 21 VAL O O 4.051 -2.767 -0.990 1.00 . A A . 42 VAL O 1 1 8 4272 1 1 22 CYS C C 2.161 -0.932 2.324 1.00 . A A . 43 CYS C 1 1 8 4273 1 1 22 CYS CA C 3.054 -1.024 1.059 1.00 . A A . 43 CYS CA 1 1 8 4274 1 1 22 CYS CB C 3.516 0.347 0.525 1.00 . A A . 43 CYS CB 1 1 8 4275 1 1 22 CYS H H 1.340 -1.456 -0.104 1.00 . A A . 43 CYS H 1 1 8 4276 1 1 22 CYS HA H 3.938 -1.613 1.310 1.00 . A A . 43 CYS HA 1 1 8 4277 1 1 22 CYS HB2 H 3.962 0.204 -0.460 1.00 . A A . 43 CYS HB2 1 1 8 4278 1 1 22 CYS HB3 H 2.651 1.004 0.417 1.00 . A A . 43 CYS HB3 1 1 8 4279 1 1 22 CYS N N 2.333 -1.659 -0.044 1.00 . A A . 43 CYS N 1 1 8 4280 1 1 22 CYS O O 1.207 -1.693 2.493 1.00 . A A . 43 CYS O 1 1 8 4281 1 1 22 CYS SG S 4.752 1.111 1.606 1.00 . A A . 43 CYS SG 1 1 8 4282 1 1 23 PHE C C 1.670 1.979 4.539 1.00 . A A . 44 PHE C 1 1 8 4283 1 1 23 PHE CA C 1.700 0.443 4.369 1.00 . A A . 44 PHE CA 1 1 8 4284 1 1 23 PHE CB C 2.244 -0.230 5.640 1.00 . A A . 44 PHE CB 1 1 8 4285 1 1 23 PHE CD1 C 4.776 0.008 5.572 1.00 . A A . 44 PHE CD1 1 1 8 4286 1 1 23 PHE CD2 C 3.520 1.305 7.204 1.00 . A A . 44 PHE CD2 1 1 8 4287 1 1 23 PHE CE1 C 5.971 0.596 6.026 1.00 . A A . 44 PHE CE1 1 1 8 4288 1 1 23 PHE CE2 C 4.715 1.891 7.660 1.00 . A A . 44 PHE CE2 1 1 8 4289 1 1 23 PHE CG C 3.545 0.363 6.157 1.00 . A A . 44 PHE CG 1 1 8 4290 1 1 23 PHE CZ C 5.940 1.540 7.068 1.00 . A A . 44 PHE CZ 1 1 8 4291 1 1 23 PHE H H 3.332 0.514 2.992 1.00 . A A . 44 PHE H 1 1 8 4292 1 1 23 PHE HA H 0.668 0.119 4.231 1.00 . A A . 44 PHE HA 1 1 8 4293 1 1 23 PHE HB2 H 1.489 -0.139 6.421 1.00 . A A . 44 PHE HB2 1 1 8 4294 1 1 23 PHE HB3 H 2.383 -1.297 5.454 1.00 . A A . 44 PHE HB3 1 1 8 4295 1 1 23 PHE HD1 H 4.808 -0.715 4.768 1.00 . A A . 44 PHE HD1 1 1 8 4296 1 1 23 PHE HD2 H 2.579 1.589 7.656 1.00 . A A . 44 PHE HD2 1 1 8 4297 1 1 23 PHE HE1 H 6.914 0.320 5.575 1.00 . A A . 44 PHE HE1 1 1 8 4298 1 1 23 PHE HE2 H 4.689 2.616 8.462 1.00 . A A . 44 PHE HE2 1 1 8 4299 1 1 23 PHE HZ H 6.860 1.991 7.417 1.00 . A A . 44 PHE HZ 1 1 8 4300 1 1 23 PHE N N 2.485 0.010 3.210 1.00 . A A . 44 PHE N 1 1 8 4301 1 1 23 PHE O O 0.766 2.491 5.205 1.00 . A A . 44 PHE O 1 1 8 4302 1 1 24 LYS C C 3.465 4.868 2.892 1.00 . A A . 45 LYS C 1 1 8 4303 1 1 24 LYS CA C 2.723 4.194 4.056 1.00 . A A . 45 LYS CA 1 1 8 4304 1 1 24 LYS CB C 3.400 4.524 5.403 1.00 . A A . 45 LYS CB 1 1 8 4305 1 1 24 LYS CD C 4.047 6.282 7.097 1.00 . A A . 45 LYS CD 1 1 8 4306 1 1 24 LYS CE C 4.047 7.782 7.412 1.00 . A A . 45 LYS CE 1 1 8 4307 1 1 24 LYS CG C 3.424 6.029 5.716 1.00 . A A . 45 LYS CG 1 1 8 4308 1 1 24 LYS H H 3.322 2.238 3.395 1.00 . A A . 45 LYS H 1 1 8 4309 1 1 24 LYS HA H 1.716 4.615 4.067 1.00 . A A . 45 LYS HA 1 1 8 4310 1 1 24 LYS HB2 H 2.855 4.023 6.203 1.00 . A A . 45 LYS HB2 1 1 8 4311 1 1 24 LYS HB3 H 4.423 4.141 5.402 1.00 . A A . 45 LYS HB3 1 1 8 4312 1 1 24 LYS HD2 H 3.472 5.750 7.857 1.00 . A A . 45 LYS HD2 1 1 8 4313 1 1 24 LYS HD3 H 5.074 5.909 7.100 1.00 . A A . 45 LYS HD3 1 1 8 4314 1 1 24 LYS HE2 H 4.611 8.307 6.635 1.00 . A A . 45 LYS HE2 1 1 8 4315 1 1 24 LYS HE3 H 3.016 8.148 7.382 1.00 . A A . 45 LYS HE3 1 1 8 4316 1 1 24 LYS HG2 H 4.006 6.555 4.961 1.00 . A A . 45 LYS HG2 1 1 8 4317 1 1 24 LYS HG3 H 2.401 6.411 5.707 1.00 . A A . 45 LYS HG3 1 1 8 4318 1 1 24 LYS HZ1 H 4.130 7.595 9.482 1.00 . A A . 45 LYS HZ1 1 1 8 4319 1 1 24 LYS HZ2 H 5.604 7.749 8.791 1.00 . A A . 45 LYS HZ2 1 1 8 4320 1 1 24 LYS HZ3 H 4.634 9.052 8.948 1.00 . A A . 45 LYS HZ3 1 1 8 4321 1 1 24 LYS N N 2.622 2.722 3.940 1.00 . A A . 45 LYS N 1 1 8 4322 1 1 24 LYS NZ N 4.642 8.060 8.746 1.00 . A A . 45 LYS NZ 1 1 8 4323 1 1 24 LYS O O 2.898 5.756 2.253 1.00 . A A . 45 LYS O 1 1 8 4324 1 1 25 CYS C C 5.276 4.916 0.181 1.00 . A A . 46 CYS C 1 1 8 4325 1 1 25 CYS CA C 5.613 5.143 1.673 1.00 . A A . 46 CYS CA 1 1 8 4326 1 1 25 CYS CB C 7.072 4.788 2.025 1.00 . A A . 46 CYS CB 1 1 8 4327 1 1 25 CYS H H 5.127 3.748 3.185 1.00 . A A . 46 CYS H 1 1 8 4328 1 1 25 CYS HA H 5.513 6.219 1.834 1.00 . A A . 46 CYS HA 1 1 8 4329 1 1 25 CYS HB2 H 7.706 4.933 1.146 1.00 . A A . 46 CYS HB2 1 1 8 4330 1 1 25 CYS HB3 H 7.415 5.489 2.790 1.00 . A A . 46 CYS HB3 1 1 8 4331 1 1 25 CYS N N 4.711 4.474 2.618 1.00 . A A . 46 CYS N 1 1 8 4332 1 1 25 CYS O O 5.441 5.841 -0.615 1.00 . A A . 46 CYS O 1 1 8 4333 1 1 25 CYS SG S 7.280 3.102 2.671 1.00 . A A . 46 CYS SG 1 1 8 4334 1 1 26 LYS C C 4.683 3.855 -2.789 1.00 . A A . 47 LYS C 1 1 8 4335 1 1 26 LYS CA C 4.055 3.384 -1.455 1.00 . A A . 47 LYS CA 1 1 8 4336 1 1 26 LYS CB C 2.549 3.699 -1.326 1.00 . A A . 47 LYS CB 1 1 8 4337 1 1 26 LYS CD C 0.728 5.424 -0.967 1.00 . A A . 47 LYS CD 1 1 8 4338 1 1 26 LYS CE C 0.450 6.867 -0.526 1.00 . A A . 47 LYS CE 1 1 8 4339 1 1 26 LYS CG C 2.227 5.196 -1.187 1.00 . A A . 47 LYS CG 1 1 8 4340 1 1 26 LYS H H 4.680 3.051 0.561 1.00 . A A . 47 LYS H 1 1 8 4341 1 1 26 LYS HA H 4.113 2.299 -1.530 1.00 . A A . 47 LYS HA 1 1 8 4342 1 1 26 LYS HB2 H 2.016 3.299 -2.191 1.00 . A A . 47 LYS HB2 1 1 8 4343 1 1 26 LYS HB3 H 2.168 3.182 -0.444 1.00 . A A . 47 LYS HB3 1 1 8 4344 1 1 26 LYS HD2 H 0.203 5.223 -1.901 1.00 . A A . 47 LYS HD2 1 1 8 4345 1 1 26 LYS HD3 H 0.354 4.741 -0.205 1.00 . A A . 47 LYS HD3 1 1 8 4346 1 1 26 LYS HE2 H 1.023 7.548 -1.161 1.00 . A A . 47 LYS HE2 1 1 8 4347 1 1 26 LYS HE3 H -0.611 7.074 -0.684 1.00 . A A . 47 LYS HE3 1 1 8 4348 1 1 26 LYS HG2 H 2.764 5.601 -0.334 1.00 . A A . 47 LYS HG2 1 1 8 4349 1 1 26 LYS HG3 H 2.546 5.731 -2.082 1.00 . A A . 47 LYS HG3 1 1 8 4350 1 1 26 LYS HZ1 H 1.735 6.804 1.126 1.00 . A A . 47 LYS HZ1 1 1 8 4351 1 1 26 LYS HZ2 H 0.662 8.048 1.178 1.00 . A A . 47 LYS HZ2 1 1 8 4352 1 1 26 LYS HZ3 H 0.183 6.511 1.499 1.00 . A A . 47 LYS HZ3 1 1 8 4353 1 1 26 LYS N N 4.732 3.742 -0.181 1.00 . A A . 47 LYS N 1 1 8 4354 1 1 26 LYS NZ N 0.782 7.083 0.907 1.00 . A A . 47 LYS NZ 1 1 8 4355 1 1 26 LYS O O 3.979 3.971 -3.795 1.00 . A A . 47 LYS O 1 1 8 4356 1 1 27 GLN C C 6.773 3.371 -5.112 1.00 . A A . 48 GLN C 1 1 8 4357 1 1 27 GLN CA C 6.715 4.508 -4.056 1.00 . A A . 48 GLN CA 1 1 8 4358 1 1 27 GLN CB C 8.133 4.992 -3.699 1.00 . A A . 48 GLN CB 1 1 8 4359 1 1 27 GLN CD C 7.380 7.391 -3.240 1.00 . A A . 48 GLN CD 1 1 8 4360 1 1 27 GLN CG C 8.176 6.189 -2.733 1.00 . A A . 48 GLN CG 1 1 8 4361 1 1 27 GLN H H 6.517 4.012 -1.975 1.00 . A A . 48 GLN H 1 1 8 4362 1 1 27 GLN HA H 6.163 5.344 -4.486 1.00 . A A . 48 GLN HA 1 1 8 4363 1 1 27 GLN HB2 H 8.685 4.170 -3.248 1.00 . A A . 48 GLN HB2 1 1 8 4364 1 1 27 GLN HB3 H 8.654 5.277 -4.614 1.00 . A A . 48 GLN HB3 1 1 8 4365 1 1 27 GLN HE21 H 5.908 7.117 -1.880 1.00 . A A . 48 GLN HE21 1 1 8 4366 1 1 27 GLN HE22 H 5.716 8.484 -2.986 1.00 . A A . 48 GLN HE22 1 1 8 4367 1 1 27 GLN HG2 H 7.805 5.883 -1.755 1.00 . A A . 48 GLN HG2 1 1 8 4368 1 1 27 GLN HG3 H 9.215 6.493 -2.601 1.00 . A A . 48 GLN HG3 1 1 8 4369 1 1 27 GLN N N 5.996 4.105 -2.834 1.00 . A A . 48 GLN N 1 1 8 4370 1 1 27 GLN NE2 N 6.242 7.691 -2.652 1.00 . A A . 48 GLN NE2 1 1 8 4371 1 1 27 GLN O O 6.779 2.200 -4.715 1.00 . A A . 48 GLN O 1 1 8 4372 1 1 27 GLN OE1 O 7.760 8.070 -4.186 1.00 . A A . 48 GLN OE1 1 1 8 4373 1 1 28 PRO C C 7.503 1.405 -7.550 1.00 . A A . 49 PRO C 1 1 8 4374 1 1 28 PRO CA C 6.692 2.718 -7.540 1.00 . A A . 49 PRO CA 1 1 8 4375 1 1 28 PRO CB C 6.995 3.514 -8.814 1.00 . A A . 49 PRO CB 1 1 8 4376 1 1 28 PRO CD C 6.962 5.029 -6.975 1.00 . A A . 49 PRO CD 1 1 8 4377 1 1 28 PRO CG C 6.576 4.931 -8.449 1.00 . A A . 49 PRO CG 1 1 8 4378 1 1 28 PRO HA H 5.637 2.444 -7.558 1.00 . A A . 49 PRO HA 1 1 8 4379 1 1 28 PRO HB2 H 8.066 3.498 -9.022 1.00 . A A . 49 PRO HB2 1 1 8 4380 1 1 28 PRO HB3 H 6.433 3.137 -9.669 1.00 . A A . 49 PRO HB3 1 1 8 4381 1 1 28 PRO HD2 H 7.990 5.382 -6.892 1.00 . A A . 49 PRO HD2 1 1 8 4382 1 1 28 PRO HD3 H 6.285 5.727 -6.484 1.00 . A A . 49 PRO HD3 1 1 8 4383 1 1 28 PRO HG2 H 7.094 5.677 -9.054 1.00 . A A . 49 PRO HG2 1 1 8 4384 1 1 28 PRO HG3 H 5.495 5.032 -8.553 1.00 . A A . 49 PRO HG3 1 1 8 4385 1 1 28 PRO N N 6.867 3.674 -6.428 1.00 . A A . 49 PRO N 1 1 8 4386 1 1 28 PRO O O 7.104 0.470 -8.246 1.00 . A A . 49 PRO O 1 1 8 4387 1 1 29 GLY C C 10.255 -0.133 -5.481 1.00 . A A . 50 GLY C 1 1 8 4388 1 1 29 GLY CA C 9.466 0.100 -6.777 1.00 . A A . 50 GLY CA 1 1 8 4389 1 1 29 GLY H H 8.936 2.141 -6.344 1.00 . A A . 50 GLY H 1 1 8 4390 1 1 29 GLY HA2 H 10.183 0.151 -7.597 1.00 . A A . 50 GLY HA2 1 1 8 4391 1 1 29 GLY HA3 H 8.845 -0.782 -6.932 1.00 . A A . 50 GLY HA3 1 1 8 4392 1 1 29 GLY N N 8.621 1.309 -6.819 1.00 . A A . 50 GLY N 1 1 8 4393 1 1 29 GLY O O 11.007 -1.105 -5.388 1.00 . A A . 50 GLY O 1 1 8 4394 1 1 30 HIS C C 10.519 -0.642 -2.386 1.00 . A A . 51 HIS C 1 1 8 4395 1 1 30 HIS CA C 10.821 0.642 -3.189 1.00 . A A . 51 HIS CA 1 1 8 4396 1 1 30 HIS CB C 10.480 1.879 -2.336 1.00 . A A . 51 HIS CB 1 1 8 4397 1 1 30 HIS CD2 C 9.033 1.525 -0.256 1.00 . A A . 51 HIS CD2 1 1 8 4398 1 1 30 HIS CE1 C 7.053 1.286 -1.173 1.00 . A A . 51 HIS CE1 1 1 8 4399 1 1 30 HIS CG C 9.163 1.759 -1.599 1.00 . A A . 51 HIS CG 1 1 8 4400 1 1 30 HIS H H 9.469 1.506 -4.601 1.00 . A A . 51 HIS H 1 1 8 4401 1 1 30 HIS HA H 11.891 0.657 -3.399 1.00 . A A . 51 HIS HA 1 1 8 4402 1 1 30 HIS HB2 H 11.271 2.004 -1.594 1.00 . A A . 51 HIS HB2 1 1 8 4403 1 1 30 HIS HB3 H 10.482 2.773 -2.960 1.00 . A A . 51 HIS HB3 1 1 8 4404 1 1 30 HIS HD1 H 7.643 1.727 -3.130 1.00 . A A . 51 HIS HD1 1 1 8 4405 1 1 30 HIS HD2 H 9.844 1.490 0.458 1.00 . A A . 51 HIS HD2 1 1 8 4406 1 1 30 HIS HE1 H 5.999 1.077 -1.313 1.00 . A A . 51 HIS HE1 1 1 8 4407 1 1 30 HIS N N 10.096 0.729 -4.467 1.00 . A A . 51 HIS N 1 1 8 4408 1 1 30 HIS ND1 N 7.906 1.617 -2.153 1.00 . A A . 51 HIS ND1 1 1 8 4409 1 1 30 HIS NE2 N 7.692 1.223 0.005 1.00 . A A . 51 HIS NE2 1 1 8 4410 1 1 30 HIS O O 11.356 -1.120 -1.618 1.00 . A A . 51 HIS O 1 1 8 4411 1 1 31 PHE C C 9.614 -3.536 -1.770 1.00 . A A . 52 PHE C 1 1 8 4412 1 1 31 PHE CA C 8.775 -2.255 -1.686 1.00 . A A . 52 PHE CA 1 1 8 4413 1 1 31 PHE CB C 7.291 -2.491 -2.015 1.00 . A A . 52 PHE CB 1 1 8 4414 1 1 31 PHE CD1 C 6.683 -1.631 -4.324 1.00 . A A . 52 PHE CD1 1 1 8 4415 1 1 31 PHE CD2 C 6.953 -4.029 -4.009 1.00 . A A . 52 PHE CD2 1 1 8 4416 1 1 31 PHE CE1 C 6.383 -1.844 -5.681 1.00 . A A . 52 PHE CE1 1 1 8 4417 1 1 31 PHE CE2 C 6.657 -4.241 -5.366 1.00 . A A . 52 PHE CE2 1 1 8 4418 1 1 31 PHE CG C 6.973 -2.723 -3.483 1.00 . A A . 52 PHE CG 1 1 8 4419 1 1 31 PHE CZ C 6.374 -3.148 -6.204 1.00 . A A . 52 PHE CZ 1 1 8 4420 1 1 31 PHE H H 8.679 -0.755 -3.191 1.00 . A A . 52 PHE H 1 1 8 4421 1 1 31 PHE HA H 8.824 -1.915 -0.652 1.00 . A A . 52 PHE HA 1 1 8 4422 1 1 31 PHE HB2 H 6.933 -3.341 -1.433 1.00 . A A . 52 PHE HB2 1 1 8 4423 1 1 31 PHE HB3 H 6.726 -1.622 -1.677 1.00 . A A . 52 PHE HB3 1 1 8 4424 1 1 31 PHE HD1 H 6.666 -0.624 -3.931 1.00 . A A . 52 PHE HD1 1 1 8 4425 1 1 31 PHE HD2 H 7.169 -4.876 -3.372 1.00 . A A . 52 PHE HD2 1 1 8 4426 1 1 31 PHE HE1 H 6.142 -1.006 -6.320 1.00 . A A . 52 PHE HE1 1 1 8 4427 1 1 31 PHE HE2 H 6.651 -5.246 -5.768 1.00 . A A . 52 PHE HE2 1 1 8 4428 1 1 31 PHE HZ H 6.141 -3.311 -7.249 1.00 . A A . 52 PHE HZ 1 1 8 4429 1 1 31 PHE N N 9.308 -1.189 -2.534 1.00 . A A . 52 PHE N 1 1 8 4430 1 1 31 PHE O O 9.939 -4.111 -0.733 1.00 . A A . 52 PHE O 1 1 8 4431 1 1 32 SER C C 12.311 -5.042 -2.466 1.00 . A A . 53 SER C 1 1 8 4432 1 1 32 SER CA C 10.961 -5.071 -3.210 1.00 . A A . 53 SER CA 1 1 8 4433 1 1 32 SER CB C 11.222 -5.208 -4.716 1.00 . A A . 53 SER CB 1 1 8 4434 1 1 32 SER H H 9.767 -3.399 -3.775 1.00 . A A . 53 SER H 1 1 8 4435 1 1 32 SER HA H 10.437 -5.967 -2.880 1.00 . A A . 53 SER HA 1 1 8 4436 1 1 32 SER HB2 H 11.778 -4.336 -5.067 1.00 . A A . 53 SER HB2 1 1 8 4437 1 1 32 SER HB3 H 11.818 -6.104 -4.901 1.00 . A A . 53 SER HB3 1 1 8 4438 1 1 32 SER HG H 10.200 -5.415 -6.377 1.00 . A A . 53 SER HG 1 1 8 4439 1 1 32 SER N N 10.083 -3.911 -2.964 1.00 . A A . 53 SER N 1 1 8 4440 1 1 32 SER O O 13.044 -6.034 -2.496 1.00 . A A . 53 SER O 1 1 8 4441 1 1 32 SER OG O 9.998 -5.305 -5.428 1.00 . A A . 53 SER OG 1 1 8 4442 1 1 33 LYS C C 13.599 -3.063 0.385 1.00 . A A . 54 LYS C 1 1 8 4443 1 1 33 LYS CA C 13.859 -3.744 -0.974 1.00 . A A . 54 LYS CA 1 1 8 4444 1 1 33 LYS CB C 14.938 -3.030 -1.817 1.00 . A A . 54 LYS CB 1 1 8 4445 1 1 33 LYS CD C 15.689 -0.860 -2.959 1.00 . A A . 54 LYS CD 1 1 8 4446 1 1 33 LYS CE C 16.084 -1.513 -4.291 1.00 . A A . 54 LYS CE 1 1 8 4447 1 1 33 LYS CG C 14.543 -1.607 -2.261 1.00 . A A . 54 LYS CG 1 1 8 4448 1 1 33 LYS H H 12.012 -3.142 -1.861 1.00 . A A . 54 LYS H 1 1 8 4449 1 1 33 LYS HA H 14.247 -4.730 -0.717 1.00 . A A . 54 LYS HA 1 1 8 4450 1 1 33 LYS HB2 H 15.860 -2.977 -1.235 1.00 . A A . 54 LYS HB2 1 1 8 4451 1 1 33 LYS HB3 H 15.140 -3.637 -2.699 1.00 . A A . 54 LYS HB3 1 1 8 4452 1 1 33 LYS HD2 H 15.363 0.166 -3.148 1.00 . A A . 54 LYS HD2 1 1 8 4453 1 1 33 LYS HD3 H 16.553 -0.827 -2.293 1.00 . A A . 54 LYS HD3 1 1 8 4454 1 1 33 LYS HE2 H 16.398 -2.544 -4.104 1.00 . A A . 54 LYS HE2 1 1 8 4455 1 1 33 LYS HE3 H 15.206 -1.544 -4.942 1.00 . A A . 54 LYS HE3 1 1 8 4456 1 1 33 LYS HG2 H 13.693 -1.660 -2.943 1.00 . A A . 54 LYS HG2 1 1 8 4457 1 1 33 LYS HG3 H 14.247 -1.027 -1.387 1.00 . A A . 54 LYS HG3 1 1 8 4458 1 1 33 LYS HZ1 H 16.917 0.187 -5.155 1.00 . A A . 54 LYS HZ1 1 1 8 4459 1 1 33 LYS HZ2 H 18.015 -0.745 -4.382 1.00 . A A . 54 LYS HZ2 1 1 8 4460 1 1 33 LYS HZ3 H 17.438 -1.201 -5.837 1.00 . A A . 54 LYS HZ3 1 1 8 4461 1 1 33 LYS N N 12.649 -3.929 -1.795 1.00 . A A . 54 LYS N 1 1 8 4462 1 1 33 LYS NZ N 17.184 -0.768 -4.958 1.00 . A A . 54 LYS NZ 1 1 8 4463 1 1 33 LYS O O 14.553 -2.621 1.032 1.00 . A A . 54 LYS O 1 1 8 4464 1 1 34 GLN C C 10.712 -3.046 2.770 1.00 . A A . 55 GLN C 1 1 8 4465 1 1 34 GLN CA C 11.986 -2.425 2.155 1.00 . A A . 55 GLN CA 1 1 8 4466 1 1 34 GLN CB C 11.835 -0.897 2.039 1.00 . A A . 55 GLN CB 1 1 8 4467 1 1 34 GLN CD C 11.424 1.259 3.304 1.00 . A A . 55 GLN CD 1 1 8 4468 1 1 34 GLN CG C 11.776 -0.221 3.418 1.00 . A A . 55 GLN CG 1 1 8 4469 1 1 34 GLN H H 11.615 -3.404 0.276 1.00 . A A . 55 GLN H 1 1 8 4470 1 1 34 GLN HA H 12.804 -2.633 2.846 1.00 . A A . 55 GLN HA 1 1 8 4471 1 1 34 GLN HB2 H 12.686 -0.484 1.495 1.00 . A A . 55 GLN HB2 1 1 8 4472 1 1 34 GLN HB3 H 10.930 -0.662 1.475 1.00 . A A . 55 GLN HB3 1 1 8 4473 1 1 34 GLN HE21 H 9.455 0.865 3.474 1.00 . A A . 55 GLN HE21 1 1 8 4474 1 1 34 GLN HE22 H 9.885 2.560 3.292 1.00 . A A . 55 GLN HE22 1 1 8 4475 1 1 34 GLN HG2 H 11.025 -0.707 4.040 1.00 . A A . 55 GLN HG2 1 1 8 4476 1 1 34 GLN HG3 H 12.743 -0.323 3.912 1.00 . A A . 55 GLN HG3 1 1 8 4477 1 1 34 GLN N N 12.339 -2.974 0.834 1.00 . A A . 55 GLN N 1 1 8 4478 1 1 34 GLN NE2 N 10.153 1.591 3.374 1.00 . A A . 55 GLN NE2 1 1 8 4479 1 1 34 GLN O O 10.759 -3.543 3.899 1.00 . A A . 55 GLN O 1 1 8 4480 1 1 34 GLN OE1 O 12.271 2.128 3.147 1.00 . A A . 55 GLN OE1 1 1 8 4481 1 1 35 CYS C C 7.719 -4.733 2.086 1.00 . A A . 56 CYS C 1 1 8 4482 1 1 35 CYS CA C 8.246 -3.353 2.552 1.00 . A A . 56 CYS CA 1 1 8 4483 1 1 35 CYS CB C 7.293 -2.208 2.156 1.00 . A A . 56 CYS CB 1 1 8 4484 1 1 35 CYS H H 9.637 -2.598 1.132 1.00 . A A . 56 CYS H 1 1 8 4485 1 1 35 CYS HA H 8.280 -3.383 3.643 1.00 . A A . 56 CYS HA 1 1 8 4486 1 1 35 CYS HB2 H 7.208 -2.156 1.069 1.00 . A A . 56 CYS HB2 1 1 8 4487 1 1 35 CYS HB3 H 6.301 -2.423 2.560 1.00 . A A . 56 CYS HB3 1 1 8 4488 1 1 35 CYS N N 9.590 -3.030 2.041 1.00 . A A . 56 CYS N 1 1 8 4489 1 1 35 CYS O O 6.629 -5.162 2.484 1.00 . A A . 56 CYS O 1 1 8 4490 1 1 35 CYS SG S 7.875 -0.617 2.818 1.00 . A A . 56 CYS SG 1 1 8 4491 1 1 36 ARG C C 9.427 -7.537 0.231 1.00 . A A . 57 ARG C 1 1 8 4492 1 1 36 ARG CA C 8.168 -6.721 0.600 1.00 . A A . 57 ARG CA 1 1 8 4493 1 1 36 ARG CB C 7.273 -6.444 -0.631 1.00 . A A . 57 ARG CB 1 1 8 4494 1 1 36 ARG CD C 5.355 -7.968 0.199 1.00 . A A . 57 ARG CD 1 1 8 4495 1 1 36 ARG CG C 6.264 -7.557 -0.972 1.00 . A A . 57 ARG CG 1 1 8 4496 1 1 36 ARG CZ C 3.662 -6.174 0.670 1.00 . A A . 57 ARG CZ 1 1 8 4497 1 1 36 ARG H H 9.305 -4.939 0.885 1.00 . A A . 57 ARG H 1 1 8 4498 1 1 36 ARG HA H 7.631 -7.318 1.334 1.00 . A A . 57 ARG HA 1 1 8 4499 1 1 36 ARG HB2 H 6.698 -5.531 -0.463 1.00 . A A . 57 ARG HB2 1 1 8 4500 1 1 36 ARG HB3 H 7.905 -6.255 -1.501 1.00 . A A . 57 ARG HB3 1 1 8 4501 1 1 36 ARG HD2 H 4.556 -8.611 -0.177 1.00 . A A . 57 ARG HD2 1 1 8 4502 1 1 36 ARG HD3 H 5.932 -8.567 0.904 1.00 . A A . 57 ARG HD3 1 1 8 4503 1 1 36 ARG HE H 5.388 -6.373 1.618 1.00 . A A . 57 ARG HE 1 1 8 4504 1 1 36 ARG HG2 H 5.636 -7.203 -1.790 1.00 . A A . 57 ARG HG2 1 1 8 4505 1 1 36 ARG HG3 H 6.798 -8.441 -1.325 1.00 . A A . 57 ARG HG3 1 1 8 4506 1 1 36 ARG HH11 H 3.026 -7.373 -0.802 1.00 . A A . 57 ARG HH11 1 1 8 4507 1 1 36 ARG HH12 H 1.979 -6.022 -0.380 1.00 . A A . 57 ARG HH12 1 1 8 4508 1 1 36 ARG HH21 H 3.962 -4.755 2.049 1.00 . A A . 57 ARG HH21 1 1 8 4509 1 1 36 ARG HH22 H 2.472 -4.644 1.123 1.00 . A A . 57 ARG HH22 1 1 8 4510 1 1 36 ARG N N 8.485 -5.425 1.232 1.00 . A A . 57 ARG N 1 1 8 4511 1 1 36 ARG NE N 4.797 -6.799 0.912 1.00 . A A . 57 ARG NE 1 1 8 4512 1 1 36 ARG NH1 N 2.824 -6.562 -0.245 1.00 . A A . 57 ARG NH1 1 1 8 4513 1 1 36 ARG NH2 N 3.336 -5.117 1.350 1.00 . A A . 57 ARG NH2 1 1 8 4514 1 1 36 ARG O O 9.366 -8.411 -0.637 1.00 . A A . 57 ARG O 1 1 8 4515 1 1 37 SER C C 11.871 -9.391 0.693 1.00 . A A . 58 SER C 1 1 8 4516 1 1 37 SER CA C 11.892 -7.854 0.673 1.00 . A A . 58 SER CA 1 1 8 4517 1 1 37 SER CB C 12.867 -7.353 1.739 1.00 . A A . 58 SER CB 1 1 8 4518 1 1 37 SER H H 10.520 -6.489 1.548 1.00 . A A . 58 SER H 1 1 8 4519 1 1 37 SER HA H 12.280 -7.552 -0.299 1.00 . A A . 58 SER HA 1 1 8 4520 1 1 37 SER HB2 H 12.545 -7.707 2.721 1.00 . A A . 58 SER HB2 1 1 8 4521 1 1 37 SER HB3 H 13.863 -7.757 1.535 1.00 . A A . 58 SER HB3 1 1 8 4522 1 1 37 SER HG H 13.521 -5.637 2.428 1.00 . A A . 58 SER HG 1 1 8 4523 1 1 37 SER N N 10.567 -7.227 0.864 1.00 . A A . 58 SER N 1 1 8 4524 1 1 37 SER O O 12.482 -10.004 -0.213 1.00 . A A . 58 SER O 1 1 8 4525 1 1 37 SER OXT O 11.280 -9.978 1.629 1.00 . A A . 58 SER OXT 1 1 8 4526 1 1 37 SER OG O 12.907 -5.934 1.727 1.00 . A A . 58 SER OG 1 1 8 4527 2 2 1 ZN ZN ZN -8.359 0.625 3.670 1.00 . B A . 1059 ZN ZN 1 1 8 4528 3 2 1 ZN ZN ZN 6.899 1.095 1.909 1.00 . C A . 1060 ZN ZN 1 1 9 4529 1 1 1 GLN C C -6.353 -1.552 -4.496 1.00 . A A . 22 GLN C 1 1 9 4530 1 1 1 GLN CA C -6.103 -1.103 -5.933 1.00 . A A . 22 GLN CA 1 1 9 4531 1 1 1 GLN CB C -4.686 -0.497 -6.041 1.00 . A A . 22 GLN CB 1 1 9 4532 1 1 1 GLN CD C -2.771 0.204 -7.571 1.00 . A A . 22 GLN CD 1 1 9 4533 1 1 1 GLN CG C -4.228 -0.258 -7.490 1.00 . A A . 22 GLN CG 1 1 9 4534 1 1 1 GLN H1 H -8.076 -0.576 -6.236 1.00 . A A . 22 GLN H1 1 1 9 4535 1 1 1 GLN H2 H -7.141 0.674 -5.749 1.00 . A A . 22 GLN H2 1 1 9 4536 1 1 1 GLN H3 H -7.049 0.134 -7.304 1.00 . A A . 22 GLN H3 1 1 9 4537 1 1 1 GLN HA H -6.150 -1.985 -6.573 1.00 . A A . 22 GLN HA 1 1 9 4538 1 1 1 GLN HB2 H -4.651 0.444 -5.488 1.00 . A A . 22 GLN HB2 1 1 9 4539 1 1 1 GLN HB3 H -3.981 -1.190 -5.577 1.00 . A A . 22 GLN HB3 1 1 9 4540 1 1 1 GLN HE21 H -2.461 -0.705 -9.353 1.00 . A A . 22 GLN HE21 1 1 9 4541 1 1 1 GLN HE22 H -1.095 0.161 -8.659 1.00 . A A . 22 GLN HE22 1 1 9 4542 1 1 1 GLN HG2 H -4.335 -1.189 -8.048 1.00 . A A . 22 GLN HG2 1 1 9 4543 1 1 1 GLN HG3 H -4.853 0.500 -7.962 1.00 . A A . 22 GLN HG3 1 1 9 4544 1 1 1 GLN N N -7.165 -0.148 -6.343 1.00 . A A . 22 GLN N 1 1 9 4545 1 1 1 GLN NE2 N -2.056 -0.147 -8.616 1.00 . A A . 22 GLN NE2 1 1 9 4546 1 1 1 GLN O O -6.520 -0.706 -3.623 1.00 . A A . 22 GLN O 1 1 9 4547 1 1 1 GLN OE1 O -2.242 0.881 -6.700 1.00 . A A . 22 GLN OE1 1 1 9 4548 1 1 2 THR C C -5.934 -2.855 -1.762 1.00 . A A . 23 THR C 1 1 9 4549 1 1 2 THR CA C -6.747 -3.446 -2.919 1.00 . A A . 23 THR CA 1 1 9 4550 1 1 2 THR CB C -6.578 -4.976 -2.956 1.00 . A A . 23 THR CB 1 1 9 4551 1 1 2 THR CG2 C -7.206 -5.682 -1.753 1.00 . A A . 23 THR CG2 1 1 9 4552 1 1 2 THR H H -6.280 -3.523 -4.992 1.00 . A A . 23 THR H 1 1 9 4553 1 1 2 THR HA H -7.793 -3.234 -2.725 1.00 . A A . 23 THR HA 1 1 9 4554 1 1 2 THR HB H -5.516 -5.223 -3.008 1.00 . A A . 23 THR HB 1 1 9 4555 1 1 2 THR HG1 H -7.020 -6.434 -4.168 1.00 . A A . 23 THR HG1 1 1 9 4556 1 1 2 THR HG21 H -8.268 -5.446 -1.696 1.00 . A A . 23 THR HG21 1 1 9 4557 1 1 2 THR HG22 H -7.087 -6.761 -1.860 1.00 . A A . 23 THR HG22 1 1 9 4558 1 1 2 THR HG23 H -6.710 -5.375 -0.834 1.00 . A A . 23 THR HG23 1 1 9 4559 1 1 2 THR N N -6.407 -2.862 -4.235 1.00 . A A . 23 THR N 1 1 9 4560 1 1 2 THR O O -4.722 -2.670 -1.882 1.00 . A A . 23 THR O 1 1 9 4561 1 1 2 THR OG1 O -7.225 -5.484 -4.106 1.00 . A A . 23 THR OG1 1 1 9 4562 1 1 3 CYS C C -4.875 -2.868 1.178 1.00 . A A . 24 CYS C 1 1 9 4563 1 1 3 CYS CA C -6.013 -2.011 0.580 1.00 . A A . 24 CYS CA 1 1 9 4564 1 1 3 CYS CB C -7.151 -1.871 1.594 1.00 . A A . 24 CYS CB 1 1 9 4565 1 1 3 CYS H H -7.605 -2.691 -0.651 1.00 . A A . 24 CYS H 1 1 9 4566 1 1 3 CYS HA H -5.626 -1.017 0.349 1.00 . A A . 24 CYS HA 1 1 9 4567 1 1 3 CYS HB2 H -8.026 -1.443 1.105 1.00 . A A . 24 CYS HB2 1 1 9 4568 1 1 3 CYS HB3 H -7.421 -2.860 1.967 1.00 . A A . 24 CYS HB3 1 1 9 4569 1 1 3 CYS N N -6.602 -2.568 -0.640 1.00 . A A . 24 CYS N 1 1 9 4570 1 1 3 CYS O O -4.903 -4.100 1.108 1.00 . A A . 24 CYS O 1 1 9 4571 1 1 3 CYS SG S -6.633 -0.799 2.955 1.00 . A A . 24 CYS SG 1 1 9 4572 1 1 4 TYR C C -3.588 -3.519 4.014 1.00 . A A . 25 TYR C 1 1 9 4573 1 1 4 TYR CA C -2.962 -2.873 2.758 1.00 . A A . 25 TYR CA 1 1 9 4574 1 1 4 TYR CB C -1.861 -1.877 3.168 1.00 . A A . 25 TYR CB 1 1 9 4575 1 1 4 TYR CD1 C -3.296 -0.131 4.351 1.00 . A A . 25 TYR CD1 1 1 9 4576 1 1 4 TYR CD2 C -1.341 -1.010 5.501 1.00 . A A . 25 TYR CD2 1 1 9 4577 1 1 4 TYR CE1 C -3.595 0.665 5.469 1.00 . A A . 25 TYR CE1 1 1 9 4578 1 1 4 TYR CE2 C -1.620 -0.189 6.612 1.00 . A A . 25 TYR CE2 1 1 9 4579 1 1 4 TYR CG C -2.172 -0.979 4.360 1.00 . A A . 25 TYR CG 1 1 9 4580 1 1 4 TYR CZ C -2.753 0.654 6.597 1.00 . A A . 25 TYR CZ 1 1 9 4581 1 1 4 TYR H H -3.981 -1.205 1.884 1.00 . A A . 25 TYR H 1 1 9 4582 1 1 4 TYR HA H -2.491 -3.677 2.196 1.00 . A A . 25 TYR HA 1 1 9 4583 1 1 4 TYR HB2 H -0.981 -2.468 3.414 1.00 . A A . 25 TYR HB2 1 1 9 4584 1 1 4 TYR HB3 H -1.595 -1.253 2.315 1.00 . A A . 25 TYR HB3 1 1 9 4585 1 1 4 TYR HD1 H -3.948 -0.093 3.493 1.00 . A A . 25 TYR HD1 1 1 9 4586 1 1 4 TYR HD2 H -0.481 -1.666 5.524 1.00 . A A . 25 TYR HD2 1 1 9 4587 1 1 4 TYR HE1 H -4.482 1.272 5.474 1.00 . A A . 25 TYR HE1 1 1 9 4588 1 1 4 TYR HE2 H -0.974 -0.209 7.478 1.00 . A A . 25 TYR HE2 1 1 9 4589 1 1 4 TYR HH H -2.422 1.334 8.391 1.00 . A A . 25 TYR HH 1 1 9 4590 1 1 4 TYR N N -3.932 -2.217 1.865 1.00 . A A . 25 TYR N 1 1 9 4591 1 1 4 TYR O O -2.930 -4.319 4.683 1.00 . A A . 25 TYR O 1 1 9 4592 1 1 4 TYR OH O -3.052 1.452 7.659 1.00 . A A . 25 TYR OH 1 1 9 4593 1 1 5 ASN C C -6.947 -4.023 5.424 1.00 . A A . 26 ASN C 1 1 9 4594 1 1 5 ASN CA C -5.502 -3.521 5.607 1.00 . A A . 26 ASN CA 1 1 9 4595 1 1 5 ASN CB C -5.465 -2.254 6.484 1.00 . A A . 26 ASN CB 1 1 9 4596 1 1 5 ASN CG C -6.244 -2.410 7.781 1.00 . A A . 26 ASN CG 1 1 9 4597 1 1 5 ASN H H -5.302 -2.504 3.742 1.00 . A A . 26 ASN H 1 1 9 4598 1 1 5 ASN HA H -4.951 -4.312 6.120 1.00 . A A . 26 ASN HA 1 1 9 4599 1 1 5 ASN HB2 H -4.430 -2.019 6.731 1.00 . A A . 26 ASN HB2 1 1 9 4600 1 1 5 ASN HB3 H -5.874 -1.408 5.931 1.00 . A A . 26 ASN HB3 1 1 9 4601 1 1 5 ASN HD21 H -7.922 -1.569 6.999 1.00 . A A . 26 ASN HD21 1 1 9 4602 1 1 5 ASN HD22 H -8.000 -2.078 8.680 1.00 . A A . 26 ASN HD22 1 1 9 4603 1 1 5 ASN N N -4.844 -3.182 4.339 1.00 . A A . 26 ASN N 1 1 9 4604 1 1 5 ASN ND2 N -7.483 -1.970 7.821 1.00 . A A . 26 ASN ND2 1 1 9 4605 1 1 5 ASN O O -7.325 -5.047 5.999 1.00 . A A . 26 ASN O 1 1 9 4606 1 1 5 ASN OD1 O -5.751 -2.933 8.769 1.00 . A A . 26 ASN OD1 1 1 9 4607 1 1 6 CYS C C -9.684 -4.622 3.645 1.00 . A A . 27 CYS C 1 1 9 4608 1 1 6 CYS CA C -9.208 -3.471 4.566 1.00 . A A . 27 CYS CA 1 1 9 4609 1 1 6 CYS CB C -9.809 -2.123 4.131 1.00 . A A . 27 CYS CB 1 1 9 4610 1 1 6 CYS H H -7.378 -2.472 4.206 1.00 . A A . 27 CYS H 1 1 9 4611 1 1 6 CYS HA H -9.574 -3.689 5.571 1.00 . A A . 27 CYS HA 1 1 9 4612 1 1 6 CYS HB2 H -9.522 -1.919 3.098 1.00 . A A . 27 CYS HB2 1 1 9 4613 1 1 6 CYS HB3 H -10.899 -2.196 4.173 1.00 . A A . 27 CYS HB3 1 1 9 4614 1 1 6 CYS N N -7.754 -3.310 4.633 1.00 . A A . 27 CYS N 1 1 9 4615 1 1 6 CYS O O -10.874 -4.944 3.632 1.00 . A A . 27 CYS O 1 1 9 4616 1 1 6 CYS SG S -9.252 -0.775 5.221 1.00 . A A . 27 CYS SG 1 1 9 4617 1 1 7 GLY C C -10.125 -5.959 0.844 1.00 . A A . 28 GLY C 1 1 9 4618 1 1 7 GLY CA C -9.092 -6.324 1.924 1.00 . A A . 28 GLY CA 1 1 9 4619 1 1 7 GLY H H -7.816 -4.950 2.959 1.00 . A A . 28 GLY H 1 1 9 4620 1 1 7 GLY HA2 H -9.465 -7.182 2.483 1.00 . A A . 28 GLY HA2 1 1 9 4621 1 1 7 GLY HA3 H -8.173 -6.620 1.418 1.00 . A A . 28 GLY HA3 1 1 9 4622 1 1 7 GLY N N -8.780 -5.233 2.864 1.00 . A A . 28 GLY N 1 1 9 4623 1 1 7 GLY O O -10.931 -6.803 0.445 1.00 . A A . 28 GLY O 1 1 9 4624 1 1 8 LYS C C -10.585 -3.437 -1.693 1.00 . A A . 29 LYS C 1 1 9 4625 1 1 8 LYS CA C -11.184 -4.067 -0.416 1.00 . A A . 29 LYS CA 1 1 9 4626 1 1 8 LYS CB C -11.899 -3.039 0.485 1.00 . A A . 29 LYS CB 1 1 9 4627 1 1 8 LYS CD C -14.277 -3.135 -0.554 1.00 . A A . 29 LYS CD 1 1 9 4628 1 1 8 LYS CE C -14.915 -3.802 0.675 1.00 . A A . 29 LYS CE 1 1 9 4629 1 1 8 LYS CG C -13.062 -2.272 -0.174 1.00 . A A . 29 LYS CG 1 1 9 4630 1 1 8 LYS H H -9.417 -4.085 0.779 1.00 . A A . 29 LYS H 1 1 9 4631 1 1 8 LYS HA H -11.920 -4.822 -0.691 1.00 . A A . 29 LYS HA 1 1 9 4632 1 1 8 LYS HB2 H -12.270 -3.546 1.376 1.00 . A A . 29 LYS HB2 1 1 9 4633 1 1 8 LYS HB3 H -11.164 -2.314 0.830 1.00 . A A . 29 LYS HB3 1 1 9 4634 1 1 8 LYS HD2 H -15.016 -2.487 -1.030 1.00 . A A . 29 LYS HD2 1 1 9 4635 1 1 8 LYS HD3 H -13.981 -3.897 -1.275 1.00 . A A . 29 LYS HD3 1 1 9 4636 1 1 8 LYS HE2 H -14.192 -4.483 1.129 1.00 . A A . 29 LYS HE2 1 1 9 4637 1 1 8 LYS HE3 H -15.151 -3.025 1.410 1.00 . A A . 29 LYS HE3 1 1 9 4638 1 1 8 LYS HG2 H -13.395 -1.501 0.522 1.00 . A A . 29 LYS HG2 1 1 9 4639 1 1 8 LYS HG3 H -12.699 -1.765 -1.068 1.00 . A A . 29 LYS HG3 1 1 9 4640 1 1 8 LYS HZ1 H -16.849 -3.932 -0.083 1.00 . A A . 29 LYS HZ1 1 1 9 4641 1 1 8 LYS HZ2 H -15.961 -5.280 -0.353 1.00 . A A . 29 LYS HZ2 1 1 9 4642 1 1 8 LYS HZ3 H -16.563 -4.980 1.133 1.00 . A A . 29 LYS HZ3 1 1 9 4643 1 1 8 LYS N N -10.128 -4.693 0.399 1.00 . A A . 29 LYS N 1 1 9 4644 1 1 8 LYS NZ N -16.152 -4.546 0.316 1.00 . A A . 29 LYS NZ 1 1 9 4645 1 1 8 LYS O O -9.835 -2.466 -1.561 1.00 . A A . 29 LYS O 1 1 9 4646 1 1 9 PRO C C -10.422 -1.983 -4.480 1.00 . A A . 30 PRO C 1 1 9 4647 1 1 9 PRO CA C -10.318 -3.489 -4.188 1.00 . A A . 30 PRO CA 1 1 9 4648 1 1 9 PRO CB C -11.046 -4.292 -5.271 1.00 . A A . 30 PRO CB 1 1 9 4649 1 1 9 PRO CD C -11.653 -5.174 -3.140 1.00 . A A . 30 PRO CD 1 1 9 4650 1 1 9 PRO CG C -11.351 -5.612 -4.571 1.00 . A A . 30 PRO CG 1 1 9 4651 1 1 9 PRO HA H -9.267 -3.766 -4.226 1.00 . A A . 30 PRO HA 1 1 9 4652 1 1 9 PRO HB2 H -11.984 -3.804 -5.542 1.00 . A A . 30 PRO HB2 1 1 9 4653 1 1 9 PRO HB3 H -10.424 -4.441 -6.154 1.00 . A A . 30 PRO HB3 1 1 9 4654 1 1 9 PRO HD2 H -12.717 -4.948 -3.046 1.00 . A A . 30 PRO HD2 1 1 9 4655 1 1 9 PRO HD3 H -11.374 -5.973 -2.453 1.00 . A A . 30 PRO HD3 1 1 9 4656 1 1 9 PRO HG2 H -12.199 -6.126 -5.025 1.00 . A A . 30 PRO HG2 1 1 9 4657 1 1 9 PRO HG3 H -10.463 -6.246 -4.582 1.00 . A A . 30 PRO HG3 1 1 9 4658 1 1 9 PRO N N -10.874 -3.961 -2.906 1.00 . A A . 30 PRO N 1 1 9 4659 1 1 9 PRO O O -9.523 -1.416 -5.106 1.00 . A A . 30 PRO O 1 1 9 4660 1 1 10 GLY C C -10.954 1.098 -3.430 1.00 . A A . 31 GLY C 1 1 9 4661 1 1 10 GLY CA C -11.790 0.100 -4.246 1.00 . A A . 31 GLY CA 1 1 9 4662 1 1 10 GLY H H -12.184 -1.861 -3.517 1.00 . A A . 31 GLY H 1 1 9 4663 1 1 10 GLY HA2 H -12.842 0.281 -4.028 1.00 . A A . 31 GLY HA2 1 1 9 4664 1 1 10 GLY HA3 H -11.626 0.320 -5.302 1.00 . A A . 31 GLY HA3 1 1 9 4665 1 1 10 GLY N N -11.486 -1.322 -4.009 1.00 . A A . 31 GLY N 1 1 9 4666 1 1 10 GLY O O -11.461 2.151 -3.035 1.00 . A A . 31 GLY O 1 1 9 4667 1 1 11 HIS C C -7.766 2.363 -3.263 1.00 . A A . 32 HIS C 1 1 9 4668 1 1 11 HIS CA C -8.765 1.602 -2.378 1.00 . A A . 32 HIS CA 1 1 9 4669 1 1 11 HIS CB C -8.074 0.758 -1.296 1.00 . A A . 32 HIS CB 1 1 9 4670 1 1 11 HIS CD2 C -8.474 1.366 1.156 1.00 . A A . 32 HIS CD2 1 1 9 4671 1 1 11 HIS CE1 C -10.357 0.307 1.525 1.00 . A A . 32 HIS CE1 1 1 9 4672 1 1 11 HIS CG C -8.837 0.742 -0.002 1.00 . A A . 32 HIS CG 1 1 9 4673 1 1 11 HIS H H -9.340 -0.105 -3.512 1.00 . A A . 32 HIS H 1 1 9 4674 1 1 11 HIS HA H -9.339 2.370 -1.862 1.00 . A A . 32 HIS HA 1 1 9 4675 1 1 11 HIS HB2 H -7.961 -0.269 -1.638 1.00 . A A . 32 HIS HB2 1 1 9 4676 1 1 11 HIS HB3 H -7.075 1.152 -1.099 1.00 . A A . 32 HIS HB3 1 1 9 4677 1 1 11 HIS HD1 H -10.504 -0.513 -0.416 1.00 . A A . 32 HIS HD1 1 1 9 4678 1 1 11 HIS HD2 H -7.592 1.973 1.279 1.00 . A A . 32 HIS HD2 1 1 9 4679 1 1 11 HIS HE1 H -11.240 -0.095 2.011 1.00 . A A . 32 HIS HE1 1 1 9 4680 1 1 11 HIS N N -9.694 0.765 -3.138 1.00 . A A . 32 HIS N 1 1 9 4681 1 1 11 HIS ND1 N -10.016 0.085 0.243 1.00 . A A . 32 HIS ND1 1 1 9 4682 1 1 11 HIS NE2 N -9.430 1.068 2.135 1.00 . A A . 32 HIS NE2 1 1 9 4683 1 1 11 HIS O O -7.498 2.011 -4.414 1.00 . A A . 32 HIS O 1 1 9 4684 1 1 12 LEU C C -5.547 5.115 -2.132 1.00 . A A . 33 LEU C 1 1 9 4685 1 1 12 LEU CA C -6.368 4.467 -3.266 1.00 . A A . 33 LEU CA 1 1 9 4686 1 1 12 LEU CB C -7.232 5.562 -3.941 1.00 . A A . 33 LEU CB 1 1 9 4687 1 1 12 LEU CD1 C -8.874 6.331 -5.673 1.00 . A A . 33 LEU CD1 1 1 9 4688 1 1 12 LEU CD2 C -7.073 4.777 -6.359 1.00 . A A . 33 LEU CD2 1 1 9 4689 1 1 12 LEU CG C -8.009 5.158 -5.209 1.00 . A A . 33 LEU CG 1 1 9 4690 1 1 12 LEU H H -7.476 3.596 -1.713 1.00 . A A . 33 LEU H 1 1 9 4691 1 1 12 LEU HA H -5.680 4.021 -3.984 1.00 . A A . 33 LEU HA 1 1 9 4692 1 1 12 LEU HB2 H -7.951 5.929 -3.204 1.00 . A A . 33 LEU HB2 1 1 9 4693 1 1 12 LEU HB3 H -6.591 6.403 -4.208 1.00 . A A . 33 LEU HB3 1 1 9 4694 1 1 12 LEU HD11 H -9.573 6.606 -4.882 1.00 . A A . 33 LEU HD11 1 1 9 4695 1 1 12 LEU HD12 H -8.248 7.191 -5.912 1.00 . A A . 33 LEU HD12 1 1 9 4696 1 1 12 LEU HD13 H -9.443 6.041 -6.555 1.00 . A A . 33 LEU HD13 1 1 9 4697 1 1 12 LEU HD21 H -6.400 5.604 -6.586 1.00 . A A . 33 LEU HD21 1 1 9 4698 1 1 12 LEU HD22 H -6.489 3.898 -6.092 1.00 . A A . 33 LEU HD22 1 1 9 4699 1 1 12 LEU HD23 H -7.662 4.540 -7.247 1.00 . A A . 33 LEU HD23 1 1 9 4700 1 1 12 LEU HG H -8.672 4.324 -4.990 1.00 . A A . 33 LEU HG 1 1 9 4701 1 1 12 LEU N N -7.246 3.449 -2.685 1.00 . A A . 33 LEU N 1 1 9 4702 1 1 12 LEU O O -5.872 4.942 -0.953 1.00 . A A . 33 LEU O 1 1 9 4703 1 1 13 SER C C -4.608 7.763 -0.692 1.00 . A A . 34 SER C 1 1 9 4704 1 1 13 SER CA C -3.782 6.809 -1.578 1.00 . A A . 34 SER CA 1 1 9 4705 1 1 13 SER CB C -2.809 7.651 -2.411 1.00 . A A . 34 SER CB 1 1 9 4706 1 1 13 SER H H -4.327 6.002 -3.470 1.00 . A A . 34 SER H 1 1 9 4707 1 1 13 SER HA H -3.201 6.169 -0.912 1.00 . A A . 34 SER HA 1 1 9 4708 1 1 13 SER HB2 H -3.377 8.297 -3.083 1.00 . A A . 34 SER HB2 1 1 9 4709 1 1 13 SER HB3 H -2.206 8.279 -1.754 1.00 . A A . 34 SER HB3 1 1 9 4710 1 1 13 SER HG H -1.450 7.360 -3.795 1.00 . A A . 34 SER HG 1 1 9 4711 1 1 13 SER N N -4.565 5.947 -2.488 1.00 . A A . 34 SER N 1 1 9 4712 1 1 13 SER O O -4.077 8.338 0.260 1.00 . A A . 34 SER O 1 1 9 4713 1 1 13 SER OG O -1.959 6.806 -3.173 1.00 . A A . 34 SER OG 1 1 9 4714 1 1 14 SER C C -7.926 7.929 0.506 1.00 . A A . 35 SER C 1 1 9 4715 1 1 14 SER CA C -6.871 8.758 -0.250 1.00 . A A . 35 SER CA 1 1 9 4716 1 1 14 SER CB C -7.568 9.709 -1.230 1.00 . A A . 35 SER CB 1 1 9 4717 1 1 14 SER H H -6.239 7.517 -1.847 1.00 . A A . 35 SER H 1 1 9 4718 1 1 14 SER HA H -6.349 9.366 0.490 1.00 . A A . 35 SER HA 1 1 9 4719 1 1 14 SER HB2 H -8.325 10.292 -0.702 1.00 . A A . 35 SER HB2 1 1 9 4720 1 1 14 SER HB3 H -6.828 10.394 -1.646 1.00 . A A . 35 SER HB3 1 1 9 4721 1 1 14 SER HG H -8.612 9.603 -2.888 1.00 . A A . 35 SER HG 1 1 9 4722 1 1 14 SER N N -5.899 7.942 -0.996 1.00 . A A . 35 SER N 1 1 9 4723 1 1 14 SER O O -8.682 8.485 1.306 1.00 . A A . 35 SER O 1 1 9 4724 1 1 14 SER OG O -8.171 8.970 -2.286 1.00 . A A . 35 SER OG 1 1 9 4725 1 1 15 GLN C C -8.264 5.078 2.234 1.00 . A A . 36 GLN C 1 1 9 4726 1 1 15 GLN CA C -8.902 5.685 0.965 1.00 . A A . 36 GLN CA 1 1 9 4727 1 1 15 GLN CB C -9.315 4.590 -0.036 1.00 . A A . 36 GLN CB 1 1 9 4728 1 1 15 GLN CD C -11.857 4.676 -0.156 1.00 . A A . 36 GLN CD 1 1 9 4729 1 1 15 GLN CG C -10.638 3.890 0.321 1.00 . A A . 36 GLN CG 1 1 9 4730 1 1 15 GLN H H -7.287 6.210 -0.337 1.00 . A A . 36 GLN H 1 1 9 4731 1 1 15 GLN HA H -9.795 6.235 1.263 1.00 . A A . 36 GLN HA 1 1 9 4732 1 1 15 GLN HB2 H -9.422 5.024 -1.033 1.00 . A A . 36 GLN HB2 1 1 9 4733 1 1 15 GLN HB3 H -8.520 3.849 -0.085 1.00 . A A . 36 GLN HB3 1 1 9 4734 1 1 15 GLN HE21 H -12.020 3.603 -1.879 1.00 . A A . 36 GLN HE21 1 1 9 4735 1 1 15 GLN HE22 H -13.199 4.885 -1.630 1.00 . A A . 36 GLN HE22 1 1 9 4736 1 1 15 GLN HG2 H -10.663 2.913 -0.155 1.00 . A A . 36 GLN HG2 1 1 9 4737 1 1 15 GLN HG3 H -10.704 3.731 1.398 1.00 . A A . 36 GLN HG3 1 1 9 4738 1 1 15 GLN N N -7.976 6.607 0.291 1.00 . A A . 36 GLN N 1 1 9 4739 1 1 15 GLN NE2 N -12.396 4.363 -1.318 1.00 . A A . 36 GLN NE2 1 1 9 4740 1 1 15 GLN O O -8.927 4.990 3.270 1.00 . A A . 36 GLN O 1 1 9 4741 1 1 15 GLN OE1 O -12.343 5.589 0.501 1.00 . A A . 36 GLN OE1 1 1 9 4742 1 1 16 CYS C C -4.652 4.981 3.034 1.00 . A A . 37 CYS C 1 1 9 4743 1 1 16 CYS CA C -6.069 4.416 3.279 1.00 . A A . 37 CYS CA 1 1 9 4744 1 1 16 CYS CB C -6.012 2.888 3.490 1.00 . A A . 37 CYS CB 1 1 9 4745 1 1 16 CYS H H -6.507 4.886 1.267 1.00 . A A . 37 CYS H 1 1 9 4746 1 1 16 CYS HA H -6.448 4.885 4.184 1.00 . A A . 37 CYS HA 1 1 9 4747 1 1 16 CYS HB2 H -6.044 2.372 2.531 1.00 . A A . 37 CYS HB2 1 1 9 4748 1 1 16 CYS HB3 H -5.058 2.621 3.937 1.00 . A A . 37 CYS HB3 1 1 9 4749 1 1 16 CYS N N -6.964 4.751 2.162 1.00 . A A . 37 CYS N 1 1 9 4750 1 1 16 CYS O O -4.361 5.524 1.966 1.00 . A A . 37 CYS O 1 1 9 4751 1 1 16 CYS SG S -7.329 2.323 4.606 1.00 . A A . 37 CYS SG 1 1 9 4752 1 1 17 ARG C C -1.612 4.636 2.717 1.00 . A A . 38 ARG C 1 1 9 4753 1 1 17 ARG CA C -2.337 5.213 3.941 1.00 . A A . 38 ARG CA 1 1 9 4754 1 1 17 ARG CB C -1.585 4.829 5.231 1.00 . A A . 38 ARG CB 1 1 9 4755 1 1 17 ARG CD C -2.905 5.095 7.465 1.00 . A A . 38 ARG CD 1 1 9 4756 1 1 17 ARG CG C -1.883 5.687 6.478 1.00 . A A . 38 ARG CG 1 1 9 4757 1 1 17 ARG CZ C -5.332 4.690 6.937 1.00 . A A . 38 ARG CZ 1 1 9 4758 1 1 17 ARG H H -4.076 4.363 4.866 1.00 . A A . 38 ARG H 1 1 9 4759 1 1 17 ARG HA H -2.287 6.297 3.825 1.00 . A A . 38 ARG HA 1 1 9 4760 1 1 17 ARG HB2 H -1.742 3.773 5.456 1.00 . A A . 38 ARG HB2 1 1 9 4761 1 1 17 ARG HB3 H -0.521 4.957 5.026 1.00 . A A . 38 ARG HB3 1 1 9 4762 1 1 17 ARG HD2 H -2.781 4.014 7.508 1.00 . A A . 38 ARG HD2 1 1 9 4763 1 1 17 ARG HD3 H -2.667 5.481 8.459 1.00 . A A . 38 ARG HD3 1 1 9 4764 1 1 17 ARG HE H -4.497 6.471 7.173 1.00 . A A . 38 ARG HE 1 1 9 4765 1 1 17 ARG HG2 H -0.945 5.777 7.027 1.00 . A A . 38 ARG HG2 1 1 9 4766 1 1 17 ARG HG3 H -2.179 6.695 6.186 1.00 . A A . 38 ARG HG3 1 1 9 4767 1 1 17 ARG HH11 H -4.376 2.937 7.181 1.00 . A A . 38 ARG HH11 1 1 9 4768 1 1 17 ARG HH12 H -6.029 2.848 6.603 1.00 . A A . 38 ARG HH12 1 1 9 4769 1 1 17 ARG HH21 H -6.655 6.190 6.747 1.00 . A A . 38 ARG HH21 1 1 9 4770 1 1 17 ARG HH22 H -7.276 4.585 6.474 1.00 . A A . 38 ARG HH22 1 1 9 4771 1 1 17 ARG N N -3.754 4.814 4.021 1.00 . A A . 38 ARG N 1 1 9 4772 1 1 17 ARG NE N -4.298 5.482 7.161 1.00 . A A . 38 ARG NE 1 1 9 4773 1 1 17 ARG NH1 N -5.232 3.395 6.892 1.00 . A A . 38 ARG NH1 1 1 9 4774 1 1 17 ARG NH2 N -6.507 5.195 6.706 1.00 . A A . 38 ARG NH2 1 1 9 4775 1 1 17 ARG O O -0.782 5.335 2.134 1.00 . A A . 38 ARG O 1 1 9 4776 1 1 18 ALA C C -2.331 1.615 0.579 1.00 . A A . 39 ALA C 1 1 9 4777 1 1 18 ALA CA C -1.444 2.790 1.061 1.00 . A A . 39 ALA CA 1 1 9 4778 1 1 18 ALA CB C -0.017 2.277 1.312 1.00 . A A . 39 ALA CB 1 1 9 4779 1 1 18 ALA H H -2.610 2.888 2.838 1.00 . A A . 39 ALA H 1 1 9 4780 1 1 18 ALA HA H -1.422 3.552 0.281 1.00 . A A . 39 ALA HA 1 1 9 4781 1 1 18 ALA HB1 H 0.638 3.097 1.606 1.00 . A A . 39 ALA HB1 1 1 9 4782 1 1 18 ALA HB2 H -0.038 1.522 2.099 1.00 . A A . 39 ALA HB2 1 1 9 4783 1 1 18 ALA HB3 H 0.383 1.817 0.408 1.00 . A A . 39 ALA HB3 1 1 9 4784 1 1 18 ALA N N -1.935 3.408 2.298 1.00 . A A . 39 ALA N 1 1 9 4785 1 1 18 ALA O O -3.040 1.006 1.385 1.00 . A A . 39 ALA O 1 1 9 4786 1 1 19 PRO C C -1.704 -1.192 -0.746 1.00 . A A . 40 PRO C 1 1 9 4787 1 1 19 PRO CA C -2.685 -0.083 -1.184 1.00 . A A . 40 PRO CA 1 1 9 4788 1 1 19 PRO CB C -2.752 0.061 -2.709 1.00 . A A . 40 PRO CB 1 1 9 4789 1 1 19 PRO CD C -1.654 1.993 -1.807 1.00 . A A . 40 PRO CD 1 1 9 4790 1 1 19 PRO CG C -1.632 1.054 -3.013 1.00 . A A . 40 PRO CG 1 1 9 4791 1 1 19 PRO HA H -3.679 -0.319 -0.803 1.00 . A A . 40 PRO HA 1 1 9 4792 1 1 19 PRO HB2 H -2.609 -0.885 -3.232 1.00 . A A . 40 PRO HB2 1 1 9 4793 1 1 19 PRO HB3 H -3.711 0.501 -2.986 1.00 . A A . 40 PRO HB3 1 1 9 4794 1 1 19 PRO HD2 H -0.639 2.316 -1.575 1.00 . A A . 40 PRO HD2 1 1 9 4795 1 1 19 PRO HD3 H -2.281 2.857 -2.028 1.00 . A A . 40 PRO HD3 1 1 9 4796 1 1 19 PRO HG2 H -0.676 0.530 -3.050 1.00 . A A . 40 PRO HG2 1 1 9 4797 1 1 19 PRO HG3 H -1.808 1.594 -3.944 1.00 . A A . 40 PRO HG3 1 1 9 4798 1 1 19 PRO N N -2.251 1.233 -0.712 1.00 . A A . 40 PRO N 1 1 9 4799 1 1 19 PRO O O -0.616 -0.920 -0.230 1.00 . A A . 40 PRO O 1 1 9 4800 1 1 20 LYS C C 0.131 -3.771 -1.155 1.00 . A A . 41 LYS C 1 1 9 4801 1 1 20 LYS CA C -1.332 -3.702 -0.676 1.00 . A A . 41 LYS CA 1 1 9 4802 1 1 20 LYS CB C -2.177 -4.883 -1.195 1.00 . A A . 41 LYS CB 1 1 9 4803 1 1 20 LYS CD C -2.792 -7.327 -1.036 1.00 . A A . 41 LYS CD 1 1 9 4804 1 1 20 LYS CE C -2.483 -8.703 -0.425 1.00 . A A . 41 LYS CE 1 1 9 4805 1 1 20 LYS CG C -1.782 -6.249 -0.612 1.00 . A A . 41 LYS CG 1 1 9 4806 1 1 20 LYS H H -2.977 -2.574 -1.441 1.00 . A A . 41 LYS H 1 1 9 4807 1 1 20 LYS HA H -1.282 -3.771 0.410 1.00 . A A . 41 LYS HA 1 1 9 4808 1 1 20 LYS HB2 H -3.219 -4.703 -0.928 1.00 . A A . 41 LYS HB2 1 1 9 4809 1 1 20 LYS HB3 H -2.112 -4.922 -2.285 1.00 . A A . 41 LYS HB3 1 1 9 4810 1 1 20 LYS HD2 H -3.787 -7.026 -0.699 1.00 . A A . 41 LYS HD2 1 1 9 4811 1 1 20 LYS HD3 H -2.814 -7.406 -2.125 1.00 . A A . 41 LYS HD3 1 1 9 4812 1 1 20 LYS HE2 H -2.387 -8.594 0.660 1.00 . A A . 41 LYS HE2 1 1 9 4813 1 1 20 LYS HE3 H -3.336 -9.361 -0.615 1.00 . A A . 41 LYS HE3 1 1 9 4814 1 1 20 LYS HG2 H -0.792 -6.525 -0.970 1.00 . A A . 41 LYS HG2 1 1 9 4815 1 1 20 LYS HG3 H -1.767 -6.183 0.477 1.00 . A A . 41 LYS HG3 1 1 9 4816 1 1 20 LYS HZ1 H -1.326 -9.435 -1.993 1.00 . A A . 41 LYS HZ1 1 1 9 4817 1 1 20 LYS HZ2 H -0.433 -8.757 -0.799 1.00 . A A . 41 LYS HZ2 1 1 9 4818 1 1 20 LYS HZ3 H -1.091 -10.234 -0.592 1.00 . A A . 41 LYS HZ3 1 1 9 4819 1 1 20 LYS N N -2.062 -2.457 -1.012 1.00 . A A . 41 LYS N 1 1 9 4820 1 1 20 LYS NZ N -1.252 -9.317 -0.991 1.00 . A A . 41 LYS NZ 1 1 9 4821 1 1 20 LYS O O 0.899 -4.602 -0.672 1.00 . A A . 41 LYS O 1 1 9 4822 1 1 21 VAL C C 2.835 -2.255 -1.232 1.00 . A A . 42 VAL C 1 1 9 4823 1 1 21 VAL CA C 1.937 -2.605 -2.435 1.00 . A A . 42 VAL CA 1 1 9 4824 1 1 21 VAL CB C 1.968 -1.452 -3.468 1.00 . A A . 42 VAL CB 1 1 9 4825 1 1 21 VAL CG1 C 3.380 -1.145 -3.970 1.00 . A A . 42 VAL CG1 1 1 9 4826 1 1 21 VAL CG2 C 1.108 -1.772 -4.703 1.00 . A A . 42 VAL CG2 1 1 9 4827 1 1 21 VAL H H -0.167 -2.243 -2.399 1.00 . A A . 42 VAL H 1 1 9 4828 1 1 21 VAL HA H 2.347 -3.499 -2.905 1.00 . A A . 42 VAL HA 1 1 9 4829 1 1 21 VAL HB H 1.571 -0.551 -3.000 1.00 . A A . 42 VAL HB 1 1 9 4830 1 1 21 VAL HG11 H 3.826 -2.045 -4.393 1.00 . A A . 42 VAL HG11 1 1 9 4831 1 1 21 VAL HG12 H 3.346 -0.369 -4.735 1.00 . A A . 42 VAL HG12 1 1 9 4832 1 1 21 VAL HG13 H 4.003 -0.782 -3.154 1.00 . A A . 42 VAL HG13 1 1 9 4833 1 1 21 VAL HG21 H 1.456 -2.693 -5.171 1.00 . A A . 42 VAL HG21 1 1 9 4834 1 1 21 VAL HG22 H 0.060 -1.883 -4.428 1.00 . A A . 42 VAL HG22 1 1 9 4835 1 1 21 VAL HG23 H 1.179 -0.956 -5.424 1.00 . A A . 42 VAL HG23 1 1 9 4836 1 1 21 VAL N N 0.539 -2.868 -2.045 1.00 . A A . 42 VAL N 1 1 9 4837 1 1 21 VAL O O 4.001 -2.647 -1.207 1.00 . A A . 42 VAL O 1 1 9 4838 1 1 22 CYS C C 2.192 -0.844 2.155 1.00 . A A . 43 CYS C 1 1 9 4839 1 1 22 CYS CA C 3.050 -0.922 0.865 1.00 . A A . 43 CYS CA 1 1 9 4840 1 1 22 CYS CB C 3.517 0.452 0.341 1.00 . A A . 43 CYS CB 1 1 9 4841 1 1 22 CYS H H 1.311 -1.320 -0.287 1.00 . A A . 43 CYS H 1 1 9 4842 1 1 22 CYS HA H 3.932 -1.523 1.090 1.00 . A A . 43 CYS HA 1 1 9 4843 1 1 22 CYS HB2 H 3.952 0.313 -0.650 1.00 . A A . 43 CYS HB2 1 1 9 4844 1 1 22 CYS HB3 H 2.658 1.117 0.246 1.00 . A A . 43 CYS HB3 1 1 9 4845 1 1 22 CYS N N 2.300 -1.541 -0.234 1.00 . A A . 43 CYS N 1 1 9 4846 1 1 22 CYS O O 1.281 -1.648 2.368 1.00 . A A . 43 CYS O 1 1 9 4847 1 1 22 CYS SG S 4.773 1.201 1.415 1.00 . A A . 43 CYS SG 1 1 9 4848 1 1 23 PHE C C 1.640 2.053 4.362 1.00 . A A . 44 PHE C 1 1 9 4849 1 1 23 PHE CA C 1.718 0.522 4.193 1.00 . A A . 44 PHE CA 1 1 9 4850 1 1 23 PHE CB C 2.293 -0.137 5.458 1.00 . A A . 44 PHE CB 1 1 9 4851 1 1 23 PHE CD1 C 4.811 0.222 5.421 1.00 . A A . 44 PHE CD1 1 1 9 4852 1 1 23 PHE CD2 C 3.472 1.455 7.039 1.00 . A A . 44 PHE CD2 1 1 9 4853 1 1 23 PHE CE1 C 5.970 0.863 5.896 1.00 . A A . 44 PHE CE1 1 1 9 4854 1 1 23 PHE CE2 C 4.632 2.096 7.512 1.00 . A A . 44 PHE CE2 1 1 9 4855 1 1 23 PHE CG C 3.556 0.517 5.991 1.00 . A A . 44 PHE CG 1 1 9 4856 1 1 23 PHE CZ C 5.881 1.801 6.939 1.00 . A A . 44 PHE CZ 1 1 9 4857 1 1 23 PHE H H 3.320 0.654 2.780 1.00 . A A . 44 PHE H 1 1 9 4858 1 1 23 PHE HA H 0.696 0.166 4.063 1.00 . A A . 44 PHE HA 1 1 9 4859 1 1 23 PHE HB2 H 1.530 -0.093 6.237 1.00 . A A . 44 PHE HB2 1 1 9 4860 1 1 23 PHE HB3 H 2.485 -1.193 5.263 1.00 . A A . 44 PHE HB3 1 1 9 4861 1 1 23 PHE HD1 H 4.889 -0.496 4.616 1.00 . A A . 44 PHE HD1 1 1 9 4862 1 1 23 PHE HD2 H 2.513 1.692 7.478 1.00 . A A . 44 PHE HD2 1 1 9 4863 1 1 23 PHE HE1 H 6.933 0.632 5.461 1.00 . A A . 44 PHE HE1 1 1 9 4864 1 1 23 PHE HE2 H 4.561 2.818 8.315 1.00 . A A . 44 PHE HE2 1 1 9 4865 1 1 23 PHE HZ H 6.773 2.294 7.302 1.00 . A A . 44 PHE HZ 1 1 9 4866 1 1 23 PHE N N 2.502 0.115 3.024 1.00 . A A . 44 PHE N 1 1 9 4867 1 1 23 PHE O O 0.714 2.535 5.017 1.00 . A A . 44 PHE O 1 1 9 4868 1 1 24 LYS C C 3.365 4.982 2.707 1.00 . A A . 45 LYS C 1 1 9 4869 1 1 24 LYS CA C 2.605 4.301 3.856 1.00 . A A . 45 LYS CA 1 1 9 4870 1 1 24 LYS CB C 3.215 4.692 5.219 1.00 . A A . 45 LYS CB 1 1 9 4871 1 1 24 LYS CD C 3.698 6.518 6.895 1.00 . A A . 45 LYS CD 1 1 9 4872 1 1 24 LYS CE C 3.557 8.014 7.197 1.00 . A A . 45 LYS CE 1 1 9 4873 1 1 24 LYS CG C 3.112 6.197 5.513 1.00 . A A . 45 LYS CG 1 1 9 4874 1 1 24 LYS H H 3.298 2.362 3.241 1.00 . A A . 45 LYS H 1 1 9 4875 1 1 24 LYS HA H 1.582 4.679 3.816 1.00 . A A . 45 LYS HA 1 1 9 4876 1 1 24 LYS HB2 H 2.686 4.161 6.010 1.00 . A A . 45 LYS HB2 1 1 9 4877 1 1 24 LYS HB3 H 4.263 4.387 5.253 1.00 . A A . 45 LYS HB3 1 1 9 4878 1 1 24 LYS HD2 H 3.167 5.941 7.655 1.00 . A A . 45 LYS HD2 1 1 9 4879 1 1 24 LYS HD3 H 4.753 6.239 6.910 1.00 . A A . 45 LYS HD3 1 1 9 4880 1 1 24 LYS HE2 H 4.063 8.581 6.410 1.00 . A A . 45 LYS HE2 1 1 9 4881 1 1 24 LYS HE3 H 2.496 8.279 7.172 1.00 . A A . 45 LYS HE3 1 1 9 4882 1 1 24 LYS HG2 H 3.659 6.761 4.757 1.00 . A A . 45 LYS HG2 1 1 9 4883 1 1 24 LYS HG3 H 2.063 6.494 5.488 1.00 . A A . 45 LYS HG3 1 1 9 4884 1 1 24 LYS HZ1 H 3.678 7.853 9.268 1.00 . A A . 45 LYS HZ1 1 1 9 4885 1 1 24 LYS HZ2 H 5.123 8.146 8.560 1.00 . A A . 45 LYS HZ2 1 1 9 4886 1 1 24 LYS HZ3 H 4.032 9.348 8.718 1.00 . A A . 45 LYS HZ3 1 1 9 4887 1 1 24 LYS N N 2.571 2.827 3.767 1.00 . A A . 45 LYS N 1 1 9 4888 1 1 24 LYS NZ N 4.136 8.361 8.522 1.00 . A A . 45 LYS NZ 1 1 9 4889 1 1 24 LYS O O 2.795 5.848 2.040 1.00 . A A . 45 LYS O 1 1 9 4890 1 1 25 CYS C C 5.252 5.055 0.048 1.00 . A A . 46 CYS C 1 1 9 4891 1 1 25 CYS CA C 5.537 5.302 1.547 1.00 . A A . 46 CYS CA 1 1 9 4892 1 1 25 CYS CB C 6.995 4.989 1.943 1.00 . A A . 46 CYS CB 1 1 9 4893 1 1 25 CYS H H 5.045 3.914 3.065 1.00 . A A . 46 CYS H 1 1 9 4894 1 1 25 CYS HA H 5.403 6.375 1.695 1.00 . A A . 46 CYS HA 1 1 9 4895 1 1 25 CYS HB2 H 7.648 5.146 1.081 1.00 . A A . 46 CYS HB2 1 1 9 4896 1 1 25 CYS HB3 H 7.296 5.701 2.713 1.00 . A A . 46 CYS HB3 1 1 9 4897 1 1 25 CYS N N 4.627 4.616 2.473 1.00 . A A . 46 CYS N 1 1 9 4898 1 1 25 CYS O O 5.441 5.973 -0.753 1.00 . A A . 46 CYS O 1 1 9 4899 1 1 25 CYS SG S 7.226 3.312 2.600 1.00 . A A . 46 CYS SG 1 1 9 4900 1 1 26 LYS C C 4.820 3.970 -2.927 1.00 . A A . 47 LYS C 1 1 9 4901 1 1 26 LYS CA C 4.121 3.499 -1.627 1.00 . A A . 47 LYS CA 1 1 9 4902 1 1 26 LYS CB C 2.604 3.799 -1.578 1.00 . A A . 47 LYS CB 1 1 9 4903 1 1 26 LYS CD C 0.747 5.502 -1.280 1.00 . A A . 47 LYS CD 1 1 9 4904 1 1 26 LYS CE C 0.439 6.939 -0.839 1.00 . A A . 47 LYS CE 1 1 9 4905 1 1 26 LYS CG C 2.257 5.289 -1.434 1.00 . A A . 47 LYS CG 1 1 9 4906 1 1 26 LYS H H 4.652 3.186 0.421 1.00 . A A . 47 LYS H 1 1 9 4907 1 1 26 LYS HA H 4.191 2.414 -1.692 1.00 . A A . 47 LYS HA 1 1 9 4908 1 1 26 LYS HB2 H 2.126 3.405 -2.477 1.00 . A A . 47 LYS HB2 1 1 9 4909 1 1 26 LYS HB3 H 2.183 3.265 -0.726 1.00 . A A . 47 LYS HB3 1 1 9 4910 1 1 26 LYS HD2 H 0.266 5.311 -2.241 1.00 . A A . 47 LYS HD2 1 1 9 4911 1 1 26 LYS HD3 H 0.341 4.806 -0.546 1.00 . A A . 47 LYS HD3 1 1 9 4912 1 1 26 LYS HE2 H 1.024 7.631 -1.453 1.00 . A A . 47 LYS HE2 1 1 9 4913 1 1 26 LYS HE3 H -0.618 7.136 -1.026 1.00 . A A . 47 LYS HE3 1 1 9 4914 1 1 26 LYS HG2 H 2.749 5.688 -0.553 1.00 . A A . 47 LYS HG2 1 1 9 4915 1 1 26 LYS HG3 H 2.613 5.839 -2.306 1.00 . A A . 47 LYS HG3 1 1 9 4916 1 1 26 LYS HZ1 H 1.677 6.885 0.851 1.00 . A A . 47 LYS HZ1 1 1 9 4917 1 1 26 LYS HZ2 H 0.587 8.116 0.876 1.00 . A A . 47 LYS HZ2 1 1 9 4918 1 1 26 LYS HZ3 H 0.122 6.573 1.181 1.00 . A A . 47 LYS HZ3 1 1 9 4919 1 1 26 LYS N N 4.731 3.873 -0.323 1.00 . A A . 47 LYS N 1 1 9 4920 1 1 26 LYS NZ N 0.728 7.153 0.604 1.00 . A A . 47 LYS NZ 1 1 9 4921 1 1 26 LYS O O 4.169 4.113 -3.962 1.00 . A A . 47 LYS O 1 1 9 4922 1 1 27 GLN C C 7.014 3.478 -5.149 1.00 . A A . 48 GLN C 1 1 9 4923 1 1 27 GLN CA C 6.930 4.598 -4.078 1.00 . A A . 48 GLN CA 1 1 9 4924 1 1 27 GLN CB C 8.341 5.040 -3.637 1.00 . A A . 48 GLN CB 1 1 9 4925 1 1 27 GLN CD C 7.649 7.460 -3.203 1.00 . A A . 48 GLN CD 1 1 9 4926 1 1 27 GLN CG C 8.360 6.222 -2.654 1.00 . A A . 48 GLN CG 1 1 9 4927 1 1 27 GLN H H 6.612 4.079 -2.017 1.00 . A A . 48 GLN H 1 1 9 4928 1 1 27 GLN HA H 6.423 5.454 -4.516 1.00 . A A . 48 GLN HA 1 1 9 4929 1 1 27 GLN HB2 H 8.850 4.197 -3.170 1.00 . A A . 48 GLN HB2 1 1 9 4930 1 1 27 GLN HB3 H 8.915 5.322 -4.519 1.00 . A A . 48 GLN HB3 1 1 9 4931 1 1 27 GLN HE21 H 6.065 7.227 -1.963 1.00 . A A . 48 GLN HE21 1 1 9 4932 1 1 27 GLN HE22 H 6.014 8.612 -3.059 1.00 . A A . 48 GLN HE22 1 1 9 4933 1 1 27 GLN HG2 H 7.908 5.923 -1.709 1.00 . A A . 48 GLN HG2 1 1 9 4934 1 1 27 GLN HG3 H 9.396 6.485 -2.444 1.00 . A A . 48 GLN HG3 1 1 9 4935 1 1 27 GLN N N 6.138 4.191 -2.901 1.00 . A A . 48 GLN N 1 1 9 4936 1 1 27 GLN NE2 N 6.482 7.796 -2.697 1.00 . A A . 48 GLN NE2 1 1 9 4937 1 1 27 GLN O O 6.983 2.302 -4.772 1.00 . A A . 48 GLN O 1 1 9 4938 1 1 27 GLN OE1 O 8.125 8.137 -4.106 1.00 . A A . 48 GLN OE1 1 1 9 4939 1 1 28 PRO C C 7.744 1.531 -7.605 1.00 . A A . 49 PRO C 1 1 9 4940 1 1 28 PRO CA C 6.997 2.879 -7.594 1.00 . A A . 49 PRO CA 1 1 9 4941 1 1 28 PRO CB C 7.387 3.687 -8.836 1.00 . A A . 49 PRO CB 1 1 9 4942 1 1 28 PRO CD C 7.331 5.165 -6.968 1.00 . A A . 49 PRO CD 1 1 9 4943 1 1 28 PRO CG C 7.008 5.111 -8.459 1.00 . A A . 49 PRO CG 1 1 9 4944 1 1 28 PRO HA H 5.931 2.655 -7.662 1.00 . A A . 49 PRO HA 1 1 9 4945 1 1 28 PRO HB2 H 8.466 3.631 -8.997 1.00 . A A . 49 PRO HB2 1 1 9 4946 1 1 28 PRO HB3 H 6.850 3.350 -9.723 1.00 . A A . 49 PRO HB3 1 1 9 4947 1 1 28 PRO HD2 H 8.365 5.481 -6.832 1.00 . A A . 49 PRO HD2 1 1 9 4948 1 1 28 PRO HD3 H 6.656 5.876 -6.492 1.00 . A A . 49 PRO HD3 1 1 9 4949 1 1 28 PRO HG2 H 7.581 5.848 -9.024 1.00 . A A . 49 PRO HG2 1 1 9 4950 1 1 28 PRO HG3 H 5.938 5.257 -8.608 1.00 . A A . 49 PRO HG3 1 1 9 4951 1 1 28 PRO N N 7.167 3.803 -6.455 1.00 . A A . 49 PRO N 1 1 9 4952 1 1 28 PRO O O 7.325 0.626 -8.331 1.00 . A A . 49 PRO O 1 1 9 4953 1 1 29 GLY C C 10.407 -0.143 -5.511 1.00 . A A . 50 GLY C 1 1 9 4954 1 1 29 GLY CA C 9.614 0.115 -6.799 1.00 . A A . 50 GLY CA 1 1 9 4955 1 1 29 GLY H H 9.172 2.170 -6.337 1.00 . A A . 50 GLY H 1 1 9 4956 1 1 29 GLY HA2 H 10.317 0.115 -7.631 1.00 . A A . 50 GLY HA2 1 1 9 4957 1 1 29 GLY HA3 H 8.941 -0.733 -6.928 1.00 . A A . 50 GLY HA3 1 1 9 4958 1 1 29 GLY N N 8.833 1.366 -6.842 1.00 . A A . 50 GLY N 1 1 9 4959 1 1 29 GLY O O 11.221 -1.067 -5.467 1.00 . A A . 50 GLY O 1 1 9 4960 1 1 30 HIS C C 10.559 -0.736 -2.388 1.00 . A A . 51 HIS C 1 1 9 4961 1 1 30 HIS CA C 10.925 0.537 -3.181 1.00 . A A . 51 HIS CA 1 1 9 4962 1 1 30 HIS CB C 10.633 1.791 -2.333 1.00 . A A . 51 HIS CB 1 1 9 4963 1 1 30 HIS CD2 C 9.140 1.555 -0.269 1.00 . A A . 51 HIS CD2 1 1 9 4964 1 1 30 HIS CE1 C 7.159 1.432 -1.209 1.00 . A A . 51 HIS CE1 1 1 9 4965 1 1 30 HIS CG C 9.302 1.746 -1.614 1.00 . A A . 51 HIS CG 1 1 9 4966 1 1 30 HIS H H 9.543 1.411 -4.561 1.00 . A A . 51 HIS H 1 1 9 4967 1 1 30 HIS HA H 11.996 0.508 -3.385 1.00 . A A . 51 HIS HA 1 1 9 4968 1 1 30 HIS HB2 H 11.419 1.878 -1.581 1.00 . A A . 51 HIS HB2 1 1 9 4969 1 1 30 HIS HB3 H 10.686 2.684 -2.956 1.00 . A A . 51 HIS HB3 1 1 9 4970 1 1 30 HIS HD1 H 7.801 1.799 -3.165 1.00 . A A . 51 HIS HD1 1 1 9 4971 1 1 30 HIS HD2 H 9.936 1.491 0.460 1.00 . A A . 51 HIS HD2 1 1 9 4972 1 1 30 HIS HE1 H 6.096 1.295 -1.358 1.00 . A A . 51 HIS HE1 1 1 9 4973 1 1 30 HIS N N 10.210 0.663 -4.462 1.00 . A A . 51 HIS N 1 1 9 4974 1 1 30 HIS ND1 N 8.046 1.680 -2.183 1.00 . A A . 51 HIS ND1 1 1 9 4975 1 1 30 HIS NE2 N 7.777 1.354 -0.021 1.00 . A A . 51 HIS NE2 1 1 9 4976 1 1 30 HIS O O 11.375 -1.279 -1.641 1.00 . A A . 51 HIS O 1 1 9 4977 1 1 31 PHE C C 9.366 -3.527 -1.606 1.00 . A A . 52 PHE C 1 1 9 4978 1 1 31 PHE CA C 8.662 -2.165 -1.640 1.00 . A A . 52 PHE CA 1 1 9 4979 1 1 31 PHE CB C 7.177 -2.285 -2.025 1.00 . A A . 52 PHE CB 1 1 9 4980 1 1 31 PHE CD1 C 6.877 -3.719 -4.103 1.00 . A A . 52 PHE CD1 1 1 9 4981 1 1 31 PHE CD2 C 6.642 -1.304 -4.303 1.00 . A A . 52 PHE CD2 1 1 9 4982 1 1 31 PHE CE1 C 6.633 -3.854 -5.482 1.00 . A A . 52 PHE CE1 1 1 9 4983 1 1 31 PHE CE2 C 6.390 -1.441 -5.679 1.00 . A A . 52 PHE CE2 1 1 9 4984 1 1 31 PHE CG C 6.892 -2.442 -3.509 1.00 . A A . 52 PHE CG 1 1 9 4985 1 1 31 PHE CZ C 6.392 -2.716 -6.270 1.00 . A A . 52 PHE CZ 1 1 9 4986 1 1 31 PHE H H 8.723 -0.725 -3.197 1.00 . A A . 52 PHE H 1 1 9 4987 1 1 31 PHE HA H 8.702 -1.770 -0.626 1.00 . A A . 52 PHE HA 1 1 9 4988 1 1 31 PHE HB2 H 6.741 -3.125 -1.489 1.00 . A A . 52 PHE HB2 1 1 9 4989 1 1 31 PHE HB3 H 6.662 -1.390 -1.672 1.00 . A A . 52 PHE HB3 1 1 9 4990 1 1 31 PHE HD1 H 7.062 -4.600 -3.505 1.00 . A A . 52 PHE HD1 1 1 9 4991 1 1 31 PHE HD2 H 6.621 -0.321 -3.856 1.00 . A A . 52 PHE HD2 1 1 9 4992 1 1 31 PHE HE1 H 6.635 -4.836 -5.936 1.00 . A A . 52 PHE HE1 1 1 9 4993 1 1 31 PHE HE2 H 6.180 -0.567 -6.277 1.00 . A A . 52 PHE HE2 1 1 9 4994 1 1 31 PHE HZ H 6.200 -2.820 -7.330 1.00 . A A . 52 PHE HZ 1 1 9 4995 1 1 31 PHE N N 9.312 -1.199 -2.531 1.00 . A A . 52 PHE N 1 1 9 4996 1 1 31 PHE O O 9.573 -4.074 -0.525 1.00 . A A . 52 PHE O 1 1 9 4997 1 1 32 SER C C 11.934 -5.318 -2.144 1.00 . A A . 53 SER C 1 1 9 4998 1 1 32 SER CA C 10.578 -5.295 -2.877 1.00 . A A . 53 SER CA 1 1 9 4999 1 1 32 SER CB C 10.803 -5.625 -4.360 1.00 . A A . 53 SER CB 1 1 9 5000 1 1 32 SER H H 9.599 -3.543 -3.610 1.00 . A A . 53 SER H 1 1 9 5001 1 1 32 SER HA H 9.969 -6.090 -2.447 1.00 . A A . 53 SER HA 1 1 9 5002 1 1 32 SER HB2 H 11.449 -4.868 -4.806 1.00 . A A . 53 SER HB2 1 1 9 5003 1 1 32 SER HB3 H 11.290 -6.598 -4.444 1.00 . A A . 53 SER HB3 1 1 9 5004 1 1 32 SER HG H 9.744 -5.898 -5.986 1.00 . A A . 53 SER HG 1 1 9 5005 1 1 32 SER N N 9.833 -4.028 -2.753 1.00 . A A . 53 SER N 1 1 9 5006 1 1 32 SER O O 12.580 -6.368 -2.096 1.00 . A A . 53 SER O 1 1 9 5007 1 1 32 SER OG O 9.567 -5.659 -5.056 1.00 . A A . 53 SER OG 1 1 9 5008 1 1 33 LYS C C 13.424 -3.359 0.557 1.00 . A A . 54 LYS C 1 1 9 5009 1 1 33 LYS CA C 13.628 -4.009 -0.827 1.00 . A A . 54 LYS CA 1 1 9 5010 1 1 33 LYS CB C 14.653 -3.221 -1.674 1.00 . A A . 54 LYS CB 1 1 9 5011 1 1 33 LYS CD C 14.242 -3.374 -4.234 1.00 . A A . 54 LYS CD 1 1 9 5012 1 1 33 LYS CE C 14.677 -1.953 -4.624 1.00 . A A . 54 LYS CE 1 1 9 5013 1 1 33 LYS CG C 15.028 -3.886 -3.013 1.00 . A A . 54 LYS CG 1 1 9 5014 1 1 33 LYS H H 11.796 -3.354 -1.703 1.00 . A A . 54 LYS H 1 1 9 5015 1 1 33 LYS HA H 14.049 -4.994 -0.619 1.00 . A A . 54 LYS HA 1 1 9 5016 1 1 33 LYS HB2 H 14.285 -2.207 -1.844 1.00 . A A . 54 LYS HB2 1 1 9 5017 1 1 33 LYS HB3 H 15.573 -3.138 -1.095 1.00 . A A . 54 LYS HB3 1 1 9 5018 1 1 33 LYS HD2 H 14.441 -4.046 -5.070 1.00 . A A . 54 LYS HD2 1 1 9 5019 1 1 33 LYS HD3 H 13.173 -3.385 -4.028 1.00 . A A . 54 LYS HD3 1 1 9 5020 1 1 33 LYS HE2 H 14.443 -1.269 -3.803 1.00 . A A . 54 LYS HE2 1 1 9 5021 1 1 33 LYS HE3 H 15.762 -1.946 -4.767 1.00 . A A . 54 LYS HE3 1 1 9 5022 1 1 33 LYS HG2 H 16.089 -3.710 -3.199 1.00 . A A . 54 LYS HG2 1 1 9 5023 1 1 33 LYS HG3 H 14.895 -4.965 -2.929 1.00 . A A . 54 LYS HG3 1 1 9 5024 1 1 33 LYS HZ1 H 14.206 -2.120 -6.643 1.00 . A A . 54 LYS HZ1 1 1 9 5025 1 1 33 LYS HZ2 H 12.993 -1.471 -5.749 1.00 . A A . 54 LYS HZ2 1 1 9 5026 1 1 33 LYS HZ3 H 14.308 -0.574 -6.131 1.00 . A A . 54 LYS HZ3 1 1 9 5027 1 1 33 LYS N N 12.372 -4.180 -1.580 1.00 . A A . 54 LYS N 1 1 9 5028 1 1 33 LYS NZ N 14.003 -1.502 -5.869 1.00 . A A . 54 LYS NZ 1 1 9 5029 1 1 33 LYS O O 14.411 -3.029 1.219 1.00 . A A . 54 LYS O 1 1 9 5030 1 1 34 GLN C C 10.542 -3.150 2.917 1.00 . A A . 55 GLN C 1 1 9 5031 1 1 34 GLN CA C 11.867 -2.615 2.336 1.00 . A A . 55 GLN CA 1 1 9 5032 1 1 34 GLN CB C 11.859 -1.075 2.239 1.00 . A A . 55 GLN CB 1 1 9 5033 1 1 34 GLN CD C 11.648 1.119 3.488 1.00 . A A . 55 GLN CD 1 1 9 5034 1 1 34 GLN CG C 11.723 -0.401 3.612 1.00 . A A . 55 GLN CG 1 1 9 5035 1 1 34 GLN H H 11.417 -3.525 0.444 1.00 . A A . 55 GLN H 1 1 9 5036 1 1 34 GLN HA H 12.658 -2.904 3.031 1.00 . A A . 55 GLN HA 1 1 9 5037 1 1 34 GLN HB2 H 12.793 -0.739 1.787 1.00 . A A . 55 GLN HB2 1 1 9 5038 1 1 34 GLN HB3 H 11.041 -0.751 1.593 1.00 . A A . 55 GLN HB3 1 1 9 5039 1 1 34 GLN HE21 H 9.632 1.094 3.403 1.00 . A A . 55 GLN HE21 1 1 9 5040 1 1 34 GLN HE22 H 10.395 2.681 3.325 1.00 . A A . 55 GLN HE22 1 1 9 5041 1 1 34 GLN HG2 H 10.824 -0.756 4.115 1.00 . A A . 55 GLN HG2 1 1 9 5042 1 1 34 GLN HG3 H 12.583 -0.664 4.230 1.00 . A A . 55 GLN HG3 1 1 9 5043 1 1 34 GLN N N 12.177 -3.171 1.009 1.00 . A A . 55 GLN N 1 1 9 5044 1 1 34 GLN NE2 N 10.461 1.678 3.396 1.00 . A A . 55 GLN NE2 1 1 9 5045 1 1 34 GLN O O 10.552 -3.849 3.932 1.00 . A A . 55 GLN O 1 1 9 5046 1 1 34 GLN OE1 O 12.649 1.825 3.466 1.00 . A A . 55 GLN OE1 1 1 9 5047 1 1 35 CYS C C 7.403 -4.340 2.545 1.00 . A A . 56 CYS C 1 1 9 5048 1 1 35 CYS CA C 8.068 -2.984 2.864 1.00 . A A . 56 CYS CA 1 1 9 5049 1 1 35 CYS CB C 7.201 -1.816 2.372 1.00 . A A . 56 CYS CB 1 1 9 5050 1 1 35 CYS H H 9.481 -2.219 1.482 1.00 . A A . 56 CYS H 1 1 9 5051 1 1 35 CYS HA H 8.143 -2.909 3.951 1.00 . A A . 56 CYS HA 1 1 9 5052 1 1 35 CYS HB2 H 7.101 -1.857 1.285 1.00 . A A . 56 CYS HB2 1 1 9 5053 1 1 35 CYS HB3 H 6.203 -1.903 2.810 1.00 . A A . 56 CYS HB3 1 1 9 5054 1 1 35 CYS N N 9.409 -2.820 2.289 1.00 . A A . 56 CYS N 1 1 9 5055 1 1 35 CYS O O 6.421 -4.715 3.193 1.00 . A A . 56 CYS O 1 1 9 5056 1 1 35 CYS SG S 7.951 -0.246 2.883 1.00 . A A . 56 CYS SG 1 1 9 5057 1 1 36 ARG C C 8.372 -7.349 0.569 1.00 . A A . 57 ARG C 1 1 9 5058 1 1 36 ARG CA C 7.318 -6.299 0.980 1.00 . A A . 57 ARG CA 1 1 9 5059 1 1 36 ARG CB C 6.403 -5.907 -0.205 1.00 . A A . 57 ARG CB 1 1 9 5060 1 1 36 ARG CD C 3.873 -5.968 0.264 1.00 . A A . 57 ARG CD 1 1 9 5061 1 1 36 ARG CG C 5.101 -6.732 -0.262 1.00 . A A . 57 ARG CG 1 1 9 5062 1 1 36 ARG CZ C 3.281 -4.560 2.246 1.00 . A A . 57 ARG CZ 1 1 9 5063 1 1 36 ARG H H 8.688 -4.655 1.036 1.00 . A A . 57 ARG H 1 1 9 5064 1 1 36 ARG HA H 6.724 -6.776 1.761 1.00 . A A . 57 ARG HA 1 1 9 5065 1 1 36 ARG HB2 H 6.136 -4.850 -0.143 1.00 . A A . 57 ARG HB2 1 1 9 5066 1 1 36 ARG HB3 H 6.950 -6.031 -1.140 1.00 . A A . 57 ARG HB3 1 1 9 5067 1 1 36 ARG HD2 H 3.638 -5.172 -0.446 1.00 . A A . 57 ARG HD2 1 1 9 5068 1 1 36 ARG HD3 H 3.023 -6.652 0.303 1.00 . A A . 57 ARG HD3 1 1 9 5069 1 1 36 ARG HE H 5.003 -5.494 2.023 1.00 . A A . 57 ARG HE 1 1 9 5070 1 1 36 ARG HG2 H 4.904 -6.997 -1.301 1.00 . A A . 57 ARG HG2 1 1 9 5071 1 1 36 ARG HG3 H 5.217 -7.660 0.297 1.00 . A A . 57 ARG HG3 1 1 9 5072 1 1 36 ARG HH11 H 1.787 -4.647 0.928 1.00 . A A . 57 ARG HH11 1 1 9 5073 1 1 36 ARG HH12 H 1.586 -3.498 2.226 1.00 . A A . 57 ARG HH12 1 1 9 5074 1 1 36 ARG HH21 H 4.621 -4.181 3.668 1.00 . A A . 57 ARG HH21 1 1 9 5075 1 1 36 ARG HH22 H 3.051 -3.422 3.881 1.00 . A A . 57 ARG HH22 1 1 9 5076 1 1 36 ARG N N 7.908 -5.067 1.542 1.00 . A A . 57 ARG N 1 1 9 5077 1 1 36 ARG NE N 4.094 -5.372 1.597 1.00 . A A . 57 ARG NE 1 1 9 5078 1 1 36 ARG NH1 N 2.089 -4.275 1.821 1.00 . A A . 57 ARG NH1 1 1 9 5079 1 1 36 ARG NH2 N 3.677 -3.999 3.349 1.00 . A A . 57 ARG NH2 1 1 9 5080 1 1 36 ARG O O 8.058 -8.272 -0.187 1.00 . A A . 57 ARG O 1 1 9 5081 1 1 37 SER C C 10.512 -9.559 0.950 1.00 . A A . 58 SER C 1 1 9 5082 1 1 37 SER CA C 10.789 -8.056 0.804 1.00 . A A . 58 SER CA 1 1 9 5083 1 1 37 SER CB C 11.929 -7.660 1.744 1.00 . A A . 58 SER CB 1 1 9 5084 1 1 37 SER H H 9.769 -6.393 1.643 1.00 . A A . 58 SER H 1 1 9 5085 1 1 37 SER HA H 11.131 -7.891 -0.217 1.00 . A A . 58 SER HA 1 1 9 5086 1 1 37 SER HB2 H 11.647 -7.893 2.775 1.00 . A A . 58 SER HB2 1 1 9 5087 1 1 37 SER HB3 H 12.821 -8.240 1.492 1.00 . A A . 58 SER HB3 1 1 9 5088 1 1 37 SER HG H 12.913 -6.044 2.255 1.00 . A A . 58 SER HG 1 1 9 5089 1 1 37 SER N N 9.613 -7.192 1.049 1.00 . A A . 58 SER N 1 1 9 5090 1 1 37 SER O O 10.897 -10.325 0.037 1.00 . A A . 58 SER O 1 1 9 5091 1 1 37 SER OXT O 9.949 -9.975 1.990 1.00 . A A . 58 SER OXT 1 1 9 5092 1 1 37 SER OG O 12.203 -6.273 1.624 1.00 . A A . 58 SER OG 1 1 9 5093 2 2 1 ZN ZN ZN -8.209 0.512 3.789 1.00 . B A . 1059 ZN ZN 1 1 9 5094 3 2 1 ZN ZN ZN 6.898 1.313 1.843 1.00 . C A . 1060 ZN ZN 1 1 10 5095 1 1 1 GLN C C -6.346 -1.455 -4.495 1.00 . A A . 22 GLN C 1 1 10 5096 1 1 1 GLN CA C -6.154 -0.968 -5.930 1.00 . A A . 22 GLN CA 1 1 10 5097 1 1 1 GLN CB C -4.774 -0.283 -6.074 1.00 . A A . 22 GLN CB 1 1 10 5098 1 1 1 GLN CD C -4.243 -1.023 -8.474 1.00 . A A . 22 GLN CD 1 1 10 5099 1 1 1 GLN CG C -4.381 0.147 -7.501 1.00 . A A . 22 GLN CG 1 1 10 5100 1 1 1 GLN H1 H -8.161 -0.538 -6.162 1.00 . A A . 22 GLN H1 1 1 10 5101 1 1 1 GLN H2 H -7.268 0.757 -5.712 1.00 . A A . 22 GLN H2 1 1 10 5102 1 1 1 GLN H3 H -7.208 0.216 -7.267 1.00 . A A . 22 GLN H3 1 1 10 5103 1 1 1 GLN HA H -6.179 -1.844 -6.578 1.00 . A A . 22 GLN HA 1 1 10 5104 1 1 1 GLN HB2 H -4.750 0.603 -5.437 1.00 . A A . 22 GLN HB2 1 1 10 5105 1 1 1 GLN HB3 H -4.007 -0.969 -5.709 1.00 . A A . 22 GLN HB3 1 1 10 5106 1 1 1 GLN HE21 H -2.354 -0.534 -9.014 1.00 . A A . 22 GLN HE21 1 1 10 5107 1 1 1 GLN HE22 H -3.050 -1.958 -9.778 1.00 . A A . 22 GLN HE22 1 1 10 5108 1 1 1 GLN HG2 H -5.109 0.855 -7.897 1.00 . A A . 22 GLN HG2 1 1 10 5109 1 1 1 GLN HG3 H -3.427 0.672 -7.439 1.00 . A A . 22 GLN HG3 1 1 10 5110 1 1 1 GLN N N -7.276 -0.066 -6.301 1.00 . A A . 22 GLN N 1 1 10 5111 1 1 1 GLN NE2 N -3.120 -1.181 -9.136 1.00 . A A . 22 GLN NE2 1 1 10 5112 1 1 1 GLN O O -6.479 -0.635 -3.593 1.00 . A A . 22 GLN O 1 1 10 5113 1 1 1 GLN OE1 O -5.150 -1.823 -8.655 1.00 . A A . 22 GLN OE1 1 1 10 5114 1 1 2 THR C C -5.910 -2.845 -1.801 1.00 . A A . 23 THR C 1 1 10 5115 1 1 2 THR CA C -6.727 -3.399 -2.974 1.00 . A A . 23 THR CA 1 1 10 5116 1 1 2 THR CB C -6.555 -4.925 -3.060 1.00 . A A . 23 THR CB 1 1 10 5117 1 1 2 THR CG2 C -7.173 -5.667 -1.873 1.00 . A A . 23 THR CG2 1 1 10 5118 1 1 2 THR H H -6.295 -3.408 -5.055 1.00 . A A . 23 THR H 1 1 10 5119 1 1 2 THR HA H -7.773 -3.196 -2.767 1.00 . A A . 23 THR HA 1 1 10 5120 1 1 2 THR HB H -5.494 -5.167 -3.128 1.00 . A A . 23 THR HB 1 1 10 5121 1 1 2 THR HG1 H -7.001 -6.346 -4.314 1.00 . A A . 23 THR HG1 1 1 10 5122 1 1 2 THR HG21 H -8.234 -5.435 -1.799 1.00 . A A . 23 THR HG21 1 1 10 5123 1 1 2 THR HG22 H -7.054 -6.742 -2.013 1.00 . A A . 23 THR HG22 1 1 10 5124 1 1 2 THR HG23 H -6.669 -5.387 -0.949 1.00 . A A . 23 THR HG23 1 1 10 5125 1 1 2 THR N N -6.398 -2.773 -4.273 1.00 . A A . 23 THR N 1 1 10 5126 1 1 2 THR O O -4.696 -2.682 -1.909 1.00 . A A . 23 THR O 1 1 10 5127 1 1 2 THR OG1 O -7.210 -5.399 -4.219 1.00 . A A . 23 THR OG1 1 1 10 5128 1 1 3 CYS C C -4.854 -2.842 1.146 1.00 . A A . 24 CYS C 1 1 10 5129 1 1 3 CYS CA C -6.007 -2.008 0.545 1.00 . A A . 24 CYS CA 1 1 10 5130 1 1 3 CYS CB C -7.151 -1.897 1.556 1.00 . A A . 24 CYS CB 1 1 10 5131 1 1 3 CYS H H -7.588 -2.678 -0.702 1.00 . A A . 24 CYS H 1 1 10 5132 1 1 3 CYS HA H -5.640 -1.005 0.321 1.00 . A A . 24 CYS HA 1 1 10 5133 1 1 3 CYS HB2 H -8.028 -1.474 1.070 1.00 . A A . 24 CYS HB2 1 1 10 5134 1 1 3 CYS HB3 H -7.406 -2.893 1.920 1.00 . A A . 24 CYS HB3 1 1 10 5135 1 1 3 CYS N N -6.584 -2.566 -0.681 1.00 . A A . 24 CYS N 1 1 10 5136 1 1 3 CYS O O -4.851 -4.073 1.072 1.00 . A A . 24 CYS O 1 1 10 5137 1 1 3 CYS SG S -6.646 -0.835 2.928 1.00 . A A . 24 CYS SG 1 1 10 5138 1 1 4 TYR C C -3.545 -3.475 3.980 1.00 . A A . 25 TYR C 1 1 10 5139 1 1 4 TYR CA C -2.942 -2.800 2.729 1.00 . A A . 25 TYR CA 1 1 10 5140 1 1 4 TYR CB C -1.876 -1.773 3.150 1.00 . A A . 25 TYR CB 1 1 10 5141 1 1 4 TYR CD1 C -3.328 -0.039 4.339 1.00 . A A . 25 TYR CD1 1 1 10 5142 1 1 4 TYR CD2 C -1.416 -0.978 5.515 1.00 . A A . 25 TYR CD2 1 1 10 5143 1 1 4 TYR CE1 C -3.649 0.730 5.472 1.00 . A A . 25 TYR CE1 1 1 10 5144 1 1 4 TYR CE2 C -1.720 -0.191 6.645 1.00 . A A . 25 TYR CE2 1 1 10 5145 1 1 4 TYR CG C -2.215 -0.902 4.356 1.00 . A A . 25 TYR CG 1 1 10 5146 1 1 4 TYR CZ C -2.842 0.666 6.624 1.00 . A A . 25 TYR CZ 1 1 10 5147 1 1 4 TYR H H -4.009 -1.160 1.866 1.00 . A A . 25 TYR H 1 1 10 5148 1 1 4 TYR HA H -2.443 -3.585 2.162 1.00 . A A . 25 TYR HA 1 1 10 5149 1 1 4 TYR HB2 H -0.978 -2.340 3.390 1.00 . A A . 25 TYR HB2 1 1 10 5150 1 1 4 TYR HB3 H -1.628 -1.132 2.306 1.00 . A A . 25 TYR HB3 1 1 10 5151 1 1 4 TYR HD1 H -3.957 0.028 3.463 1.00 . A A . 25 TYR HD1 1 1 10 5152 1 1 4 TYR HD2 H -0.565 -1.646 5.545 1.00 . A A . 25 TYR HD2 1 1 10 5153 1 1 4 TYR HE1 H -4.524 1.357 5.476 1.00 . A A . 25 TYR HE1 1 1 10 5154 1 1 4 TYR HE2 H -1.102 -0.250 7.529 1.00 . A A . 25 TYR HE2 1 1 10 5155 1 1 4 TYR HH H -2.560 1.276 8.453 1.00 . A A . 25 TYR HH 1 1 10 5156 1 1 4 TYR N N -3.930 -2.168 1.841 1.00 . A A . 25 TYR N 1 1 10 5157 1 1 4 TYR O O -2.868 -4.277 4.631 1.00 . A A . 25 TYR O 1 1 10 5158 1 1 4 TYR OH O -3.165 1.423 7.707 1.00 . A A . 25 TYR OH 1 1 10 5159 1 1 5 ASN C C -6.876 -4.037 5.429 1.00 . A A . 26 ASN C 1 1 10 5160 1 1 5 ASN CA C -5.437 -3.516 5.598 1.00 . A A . 26 ASN CA 1 1 10 5161 1 1 5 ASN CB C -5.405 -2.252 6.480 1.00 . A A . 26 ASN CB 1 1 10 5162 1 1 5 ASN CG C -6.173 -2.421 7.781 1.00 . A A . 26 ASN CG 1 1 10 5163 1 1 5 ASN H H -5.275 -2.483 3.738 1.00 . A A . 26 ASN H 1 1 10 5164 1 1 5 ASN HA H -4.867 -4.302 6.099 1.00 . A A . 26 ASN HA 1 1 10 5165 1 1 5 ASN HB2 H -4.371 -2.009 6.721 1.00 . A A . 26 ASN HB2 1 1 10 5166 1 1 5 ASN HB3 H -5.828 -1.408 5.935 1.00 . A A . 26 ASN HB3 1 1 10 5167 1 1 5 ASN HD21 H -7.865 -1.597 7.016 1.00 . A A . 26 ASN HD21 1 1 10 5168 1 1 5 ASN HD22 H -7.928 -2.112 8.694 1.00 . A A . 26 ASN HD22 1 1 10 5169 1 1 5 ASN N N -4.801 -3.160 4.323 1.00 . A A . 26 ASN N 1 1 10 5170 1 1 5 ASN ND2 N -7.418 -1.996 7.833 1.00 . A A . 26 ASN ND2 1 1 10 5171 1 1 5 ASN O O -7.235 -5.066 6.004 1.00 . A A . 26 ASN O 1 1 10 5172 1 1 5 ASN OD1 O -5.667 -2.944 8.766 1.00 . A A . 26 ASN OD1 1 1 10 5173 1 1 6 CYS C C -9.588 -4.679 3.644 1.00 . A A . 27 CYS C 1 1 10 5174 1 1 6 CYS CA C -9.147 -3.523 4.575 1.00 . A A . 27 CYS CA 1 1 10 5175 1 1 6 CYS CB C -9.774 -2.186 4.145 1.00 . A A . 27 CYS CB 1 1 10 5176 1 1 6 CYS H H -7.338 -2.489 4.218 1.00 . A A . 27 CYS H 1 1 10 5177 1 1 6 CYS HA H -9.512 -3.756 5.578 1.00 . A A . 27 CYS HA 1 1 10 5178 1 1 6 CYS HB2 H -9.498 -1.977 3.110 1.00 . A A . 27 CYS HB2 1 1 10 5179 1 1 6 CYS HB3 H -10.863 -2.277 4.191 1.00 . A A . 27 CYS HB3 1 1 10 5180 1 1 6 CYS N N -7.698 -3.331 4.646 1.00 . A A . 27 CYS N 1 1 10 5181 1 1 6 CYS O O -10.766 -5.043 3.631 1.00 . A A . 27 CYS O 1 1 10 5182 1 1 6 CYS SG S -9.236 -0.825 5.229 1.00 . A A . 27 CYS SG 1 1 10 5183 1 1 7 GLY C C -9.975 -6.021 0.826 1.00 . A A . 28 GLY C 1 1 10 5184 1 1 7 GLY CA C -8.933 -6.346 1.909 1.00 . A A . 28 GLY CA 1 1 10 5185 1 1 7 GLY H H -7.712 -4.930 2.951 1.00 . A A . 28 GLY H 1 1 10 5186 1 1 7 GLY HA2 H -9.275 -7.220 2.465 1.00 . A A . 28 GLY HA2 1 1 10 5187 1 1 7 GLY HA3 H -8.002 -6.606 1.406 1.00 . A A . 28 GLY HA3 1 1 10 5188 1 1 7 GLY N N -8.666 -5.249 2.854 1.00 . A A . 28 GLY N 1 1 10 5189 1 1 7 GLY O O -10.715 -6.909 0.395 1.00 . A A . 28 GLY O 1 1 10 5190 1 1 8 LYS C C -10.563 -3.507 -1.684 1.00 . A A . 29 LYS C 1 1 10 5191 1 1 8 LYS CA C -11.138 -4.182 -0.421 1.00 . A A . 29 LYS CA 1 1 10 5192 1 1 8 LYS CB C -11.931 -3.206 0.473 1.00 . A A . 29 LYS CB 1 1 10 5193 1 1 8 LYS CD C -14.303 -3.549 -0.423 1.00 . A A . 29 LYS CD 1 1 10 5194 1 1 8 LYS CE C -15.539 -2.814 -0.960 1.00 . A A . 29 LYS CE 1 1 10 5195 1 1 8 LYS CG C -13.158 -2.553 -0.184 1.00 . A A . 29 LYS CG 1 1 10 5196 1 1 8 LYS H H -9.394 -4.100 0.809 1.00 . A A . 29 LYS H 1 1 10 5197 1 1 8 LYS HA H -11.820 -4.980 -0.707 1.00 . A A . 29 LYS HA 1 1 10 5198 1 1 8 LYS HB2 H -12.263 -3.737 1.367 1.00 . A A . 29 LYS HB2 1 1 10 5199 1 1 8 LYS HB3 H -11.259 -2.418 0.808 1.00 . A A . 29 LYS HB3 1 1 10 5200 1 1 8 LYS HD2 H -13.992 -4.308 -1.140 1.00 . A A . 29 LYS HD2 1 1 10 5201 1 1 8 LYS HD3 H -14.556 -4.034 0.522 1.00 . A A . 29 LYS HD3 1 1 10 5202 1 1 8 LYS HE2 H -15.810 -2.023 -0.257 1.00 . A A . 29 LYS HE2 1 1 10 5203 1 1 8 LYS HE3 H -15.283 -2.340 -1.913 1.00 . A A . 29 LYS HE3 1 1 10 5204 1 1 8 LYS HG2 H -13.518 -1.769 0.485 1.00 . A A . 29 LYS HG2 1 1 10 5205 1 1 8 LYS HG3 H -12.873 -2.085 -1.127 1.00 . A A . 29 LYS HG3 1 1 10 5206 1 1 8 LYS HZ1 H -16.471 -4.476 -1.802 1.00 . A A . 29 LYS HZ1 1 1 10 5207 1 1 8 LYS HZ2 H -16.954 -4.172 -0.270 1.00 . A A . 29 LYS HZ2 1 1 10 5208 1 1 8 LYS HZ3 H -17.498 -3.247 -1.496 1.00 . A A . 29 LYS HZ3 1 1 10 5209 1 1 8 LYS N N -10.056 -4.750 0.406 1.00 . A A . 29 LYS N 1 1 10 5210 1 1 8 LYS NZ N -16.688 -3.739 -1.144 1.00 . A A . 29 LYS NZ 1 1 10 5211 1 1 8 LYS O O -9.824 -2.531 -1.530 1.00 . A A . 29 LYS O 1 1 10 5212 1 1 9 PRO C C -10.457 -1.963 -4.425 1.00 . A A . 30 PRO C 1 1 10 5213 1 1 9 PRO CA C -10.326 -3.473 -4.182 1.00 . A A . 30 PRO CA 1 1 10 5214 1 1 9 PRO CB C -11.053 -4.254 -5.282 1.00 . A A . 30 PRO CB 1 1 10 5215 1 1 9 PRO CD C -11.632 -5.207 -3.176 1.00 . A A . 30 PRO CD 1 1 10 5216 1 1 9 PRO CG C -11.339 -5.596 -4.622 1.00 . A A . 30 PRO CG 1 1 10 5217 1 1 9 PRO HA H -9.271 -3.734 -4.236 1.00 . A A . 30 PRO HA 1 1 10 5218 1 1 9 PRO HB2 H -11.997 -3.768 -5.532 1.00 . A A . 30 PRO HB2 1 1 10 5219 1 1 9 PRO HB3 H -10.435 -4.368 -6.175 1.00 . A A . 30 PRO HB3 1 1 10 5220 1 1 9 PRO HD2 H -12.696 -4.994 -3.064 1.00 . A A . 30 PRO HD2 1 1 10 5221 1 1 9 PRO HD3 H -11.339 -6.025 -2.516 1.00 . A A . 30 PRO HD3 1 1 10 5222 1 1 9 PRO HG2 H -12.185 -6.106 -5.084 1.00 . A A . 30 PRO HG2 1 1 10 5223 1 1 9 PRO HG3 H -10.445 -6.221 -4.659 1.00 . A A . 30 PRO HG3 1 1 10 5224 1 1 9 PRO N N -10.862 -3.993 -2.910 1.00 . A A . 30 PRO N 1 1 10 5225 1 1 9 PRO O O -9.572 -1.361 -5.039 1.00 . A A . 30 PRO O 1 1 10 5226 1 1 10 GLY C C -11.051 1.081 -3.299 1.00 . A A . 31 GLY C 1 1 10 5227 1 1 10 GLY CA C -11.872 0.083 -4.128 1.00 . A A . 31 GLY CA 1 1 10 5228 1 1 10 GLY H H -12.211 -1.905 -3.447 1.00 . A A . 31 GLY H 1 1 10 5229 1 1 10 GLY HA2 H -12.926 0.231 -3.893 1.00 . A A . 31 GLY HA2 1 1 10 5230 1 1 10 GLY HA3 H -11.727 0.331 -5.181 1.00 . A A . 31 GLY HA3 1 1 10 5231 1 1 10 GLY N N -11.530 -1.335 -3.927 1.00 . A A . 31 GLY N 1 1 10 5232 1 1 10 GLY O O -11.594 2.079 -2.817 1.00 . A A . 31 GLY O 1 1 10 5233 1 1 11 HIS C C -7.837 2.413 -3.207 1.00 . A A . 32 HIS C 1 1 10 5234 1 1 11 HIS CA C -8.835 1.641 -2.330 1.00 . A A . 32 HIS CA 1 1 10 5235 1 1 11 HIS CB C -8.135 0.785 -1.264 1.00 . A A . 32 HIS CB 1 1 10 5236 1 1 11 HIS CD2 C -8.578 1.352 1.193 1.00 . A A . 32 HIS CD2 1 1 10 5237 1 1 11 HIS CE1 C -10.406 0.192 1.543 1.00 . A A . 32 HIS CE1 1 1 10 5238 1 1 11 HIS CG C -8.905 0.722 0.026 1.00 . A A . 32 HIS CG 1 1 10 5239 1 1 11 HIS H H -9.384 -0.021 -3.543 1.00 . A A . 32 HIS H 1 1 10 5240 1 1 11 HIS HA H -9.411 2.400 -1.804 1.00 . A A . 32 HIS HA 1 1 10 5241 1 1 11 HIS HB2 H -7.994 -0.231 -1.630 1.00 . A A . 32 HIS HB2 1 1 10 5242 1 1 11 HIS HB3 H -7.148 1.197 -1.049 1.00 . A A . 32 HIS HB3 1 1 10 5243 1 1 11 HIS HD1 H -10.500 -0.620 -0.405 1.00 . A A . 32 HIS HD1 1 1 10 5244 1 1 11 HIS HD2 H -7.730 2.004 1.330 1.00 . A A . 32 HIS HD2 1 1 10 5245 1 1 11 HIS HE1 H -11.267 -0.261 2.021 1.00 . A A . 32 HIS HE1 1 1 10 5246 1 1 11 HIS N N -9.759 0.808 -3.102 1.00 . A A . 32 HIS N 1 1 10 5247 1 1 11 HIS ND1 N -10.049 0.002 0.259 1.00 . A A . 32 HIS ND1 1 1 10 5248 1 1 11 HIS NE2 N -9.520 0.994 2.164 1.00 . A A . 32 HIS NE2 1 1 10 5249 1 1 11 HIS O O -7.543 2.055 -4.351 1.00 . A A . 32 HIS O 1 1 10 5250 1 1 12 LEU C C -5.709 5.194 -1.994 1.00 . A A . 33 LEU C 1 1 10 5251 1 1 12 LEU CA C -6.445 4.524 -3.172 1.00 . A A . 33 LEU CA 1 1 10 5252 1 1 12 LEU CB C -7.278 5.596 -3.921 1.00 . A A . 33 LEU CB 1 1 10 5253 1 1 12 LEU CD1 C -8.777 6.330 -5.791 1.00 . A A . 33 LEU CD1 1 1 10 5254 1 1 12 LEU CD2 C -6.918 4.779 -6.309 1.00 . A A . 33 LEU CD2 1 1 10 5255 1 1 12 LEU CG C -7.945 5.169 -5.242 1.00 . A A . 33 LEU CG 1 1 10 5256 1 1 12 LEU H H -7.608 3.661 -1.663 1.00 . A A . 33 LEU H 1 1 10 5257 1 1 12 LEU HA H -5.707 4.074 -3.837 1.00 . A A . 33 LEU HA 1 1 10 5258 1 1 12 LEU HB2 H -8.058 5.945 -3.243 1.00 . A A . 33 LEU HB2 1 1 10 5259 1 1 12 LEU HB3 H -6.637 6.451 -4.143 1.00 . A A . 33 LEU HB3 1 1 10 5260 1 1 12 LEU HD11 H -9.537 6.609 -5.061 1.00 . A A . 33 LEU HD11 1 1 10 5261 1 1 12 LEU HD12 H -8.138 7.191 -5.990 1.00 . A A . 33 LEU HD12 1 1 10 5262 1 1 12 LEU HD13 H -9.272 6.025 -6.712 1.00 . A A . 33 LEU HD13 1 1 10 5263 1 1 12 LEU HD21 H -6.228 5.606 -6.485 1.00 . A A . 33 LEU HD21 1 1 10 5264 1 1 12 LEU HD22 H -6.357 3.903 -5.986 1.00 . A A . 33 LEU HD22 1 1 10 5265 1 1 12 LEU HD23 H -7.430 4.535 -7.239 1.00 . A A . 33 LEU HD23 1 1 10 5266 1 1 12 LEU HG H -8.619 4.335 -5.066 1.00 . A A . 33 LEU HG 1 1 10 5267 1 1 12 LEU N N -7.346 3.508 -2.627 1.00 . A A . 33 LEU N 1 1 10 5268 1 1 12 LEU O O -6.080 4.997 -0.833 1.00 . A A . 33 LEU O 1 1 10 5269 1 1 13 SER C C -5.108 7.922 -0.592 1.00 . A A . 34 SER C 1 1 10 5270 1 1 13 SER CA C -4.117 6.977 -1.304 1.00 . A A . 34 SER CA 1 1 10 5271 1 1 13 SER CB C -3.030 7.803 -2.000 1.00 . A A . 34 SER CB 1 1 10 5272 1 1 13 SER H H -4.497 6.210 -3.256 1.00 . A A . 34 SER H 1 1 10 5273 1 1 13 SER HA H -3.636 6.374 -0.533 1.00 . A A . 34 SER HA 1 1 10 5274 1 1 13 SER HB2 H -2.597 8.510 -1.290 1.00 . A A . 34 SER HB2 1 1 10 5275 1 1 13 SER HB3 H -2.246 7.132 -2.351 1.00 . A A . 34 SER HB3 1 1 10 5276 1 1 13 SER HG H -2.862 9.024 -3.529 1.00 . A A . 34 SER HG 1 1 10 5277 1 1 13 SER N N -4.740 6.066 -2.284 1.00 . A A . 34 SER N 1 1 10 5278 1 1 13 SER O O -4.812 8.436 0.488 1.00 . A A . 34 SER O 1 1 10 5279 1 1 13 SER OG O -3.575 8.503 -3.109 1.00 . A A . 34 SER OG 1 1 10 5280 1 1 14 SER C C -8.372 8.007 0.273 1.00 . A A . 35 SER C 1 1 10 5281 1 1 14 SER CA C -7.429 8.871 -0.586 1.00 . A A . 35 SER CA 1 1 10 5282 1 1 14 SER CB C -8.226 9.532 -1.717 1.00 . A A . 35 SER CB 1 1 10 5283 1 1 14 SER H H -6.444 7.744 -2.091 1.00 . A A . 35 SER H 1 1 10 5284 1 1 14 SER HA H -7.042 9.664 0.055 1.00 . A A . 35 SER HA 1 1 10 5285 1 1 14 SER HB2 H -9.085 10.062 -1.302 1.00 . A A . 35 SER HB2 1 1 10 5286 1 1 14 SER HB3 H -7.586 10.256 -2.226 1.00 . A A . 35 SER HB3 1 1 10 5287 1 1 14 SER HG H -9.186 9.012 -3.343 1.00 . A A . 35 SER HG 1 1 10 5288 1 1 14 SER N N -6.296 8.132 -1.170 1.00 . A A . 35 SER N 1 1 10 5289 1 1 14 SER O O -9.305 8.541 0.878 1.00 . A A . 35 SER O 1 1 10 5290 1 1 14 SER OG O -8.665 8.559 -2.653 1.00 . A A . 35 SER OG 1 1 10 5291 1 1 15 GLN C C -8.270 5.098 2.279 1.00 . A A . 36 GLN C 1 1 10 5292 1 1 15 GLN CA C -8.990 5.718 1.060 1.00 . A A . 36 GLN CA 1 1 10 5293 1 1 15 GLN CB C -9.426 4.637 0.052 1.00 . A A . 36 GLN CB 1 1 10 5294 1 1 15 GLN CD C -11.971 4.640 0.014 1.00 . A A . 36 GLN CD 1 1 10 5295 1 1 15 GLN CG C -10.712 3.893 0.449 1.00 . A A . 36 GLN CG 1 1 10 5296 1 1 15 GLN H H -7.336 6.329 -0.147 1.00 . A A . 36 GLN H 1 1 10 5297 1 1 15 GLN HA H -9.885 6.222 1.424 1.00 . A A . 36 GLN HA 1 1 10 5298 1 1 15 GLN HB2 H -9.583 5.088 -0.931 1.00 . A A . 36 GLN HB2 1 1 10 5299 1 1 15 GLN HB3 H -8.618 3.914 -0.047 1.00 . A A . 36 GLN HB3 1 1 10 5300 1 1 15 GLN HE21 H -12.168 3.544 -1.689 1.00 . A A . 36 GLN HE21 1 1 10 5301 1 1 15 GLN HE22 H -13.375 4.797 -1.409 1.00 . A A . 36 GLN HE22 1 1 10 5302 1 1 15 GLN HG2 H -10.719 2.917 -0.034 1.00 . A A . 36 GLN HG2 1 1 10 5303 1 1 15 GLN HG3 H -10.736 3.725 1.525 1.00 . A A . 36 GLN HG3 1 1 10 5304 1 1 15 GLN N N -8.137 6.691 0.358 1.00 . A A . 36 GLN N 1 1 10 5305 1 1 15 GLN NE2 N -12.545 4.300 -1.123 1.00 . A A . 36 GLN NE2 1 1 10 5306 1 1 15 GLN O O -8.875 4.991 3.348 1.00 . A A . 36 GLN O 1 1 10 5307 1 1 15 GLN OE1 O -12.458 5.542 0.683 1.00 . A A . 36 GLN OE1 1 1 10 5308 1 1 16 CYS C C -4.624 4.990 2.909 1.00 . A A . 37 CYS C 1 1 10 5309 1 1 16 CYS CA C -6.029 4.419 3.200 1.00 . A A . 37 CYS CA 1 1 10 5310 1 1 16 CYS CB C -5.951 2.885 3.347 1.00 . A A . 37 CYS CB 1 1 10 5311 1 1 16 CYS H H -6.564 4.928 1.218 1.00 . A A . 37 CYS H 1 1 10 5312 1 1 16 CYS HA H -6.363 4.850 4.145 1.00 . A A . 37 CYS HA 1 1 10 5313 1 1 16 CYS HB2 H -6.005 2.410 2.367 1.00 . A A . 37 CYS HB2 1 1 10 5314 1 1 16 CYS HB3 H -4.983 2.606 3.759 1.00 . A A . 37 CYS HB3 1 1 10 5315 1 1 16 CYS N N -6.973 4.788 2.134 1.00 . A A . 37 CYS N 1 1 10 5316 1 1 16 CYS O O -4.349 5.500 1.821 1.00 . A A . 37 CYS O 1 1 10 5317 1 1 16 CYS SG S -7.237 2.263 4.465 1.00 . A A . 37 CYS SG 1 1 10 5318 1 1 17 ARG C C -1.561 4.661 2.589 1.00 . A A . 38 ARG C 1 1 10 5319 1 1 17 ARG CA C -2.300 5.258 3.796 1.00 . A A . 38 ARG CA 1 1 10 5320 1 1 17 ARG CB C -1.581 4.900 5.108 1.00 . A A . 38 ARG CB 1 1 10 5321 1 1 17 ARG CD C -2.660 4.872 7.453 1.00 . A A . 38 ARG CD 1 1 10 5322 1 1 17 ARG CG C -2.064 5.724 6.320 1.00 . A A . 38 ARG CG 1 1 10 5323 1 1 17 ARG CZ C -5.154 4.889 7.169 1.00 . A A . 38 ARG CZ 1 1 10 5324 1 1 17 ARG H H -4.030 4.434 4.749 1.00 . A A . 38 ARG H 1 1 10 5325 1 1 17 ARG HA H -2.254 6.341 3.661 1.00 . A A . 38 ARG HA 1 1 10 5326 1 1 17 ARG HB2 H -1.699 3.833 5.306 1.00 . A A . 38 ARG HB2 1 1 10 5327 1 1 17 ARG HB3 H -0.516 5.095 4.979 1.00 . A A . 38 ARG HB3 1 1 10 5328 1 1 17 ARG HD2 H -1.960 4.069 7.692 1.00 . A A . 38 ARG HD2 1 1 10 5329 1 1 17 ARG HD3 H -2.755 5.490 8.348 1.00 . A A . 38 ARG HD3 1 1 10 5330 1 1 17 ARG HE H -3.992 3.282 6.986 1.00 . A A . 38 ARG HE 1 1 10 5331 1 1 17 ARG HG2 H -1.203 6.256 6.726 1.00 . A A . 38 ARG HG2 1 1 10 5332 1 1 17 ARG HG3 H -2.787 6.477 6.007 1.00 . A A . 38 ARG HG3 1 1 10 5333 1 1 17 ARG HH11 H -4.465 6.654 7.805 1.00 . A A . 38 ARG HH11 1 1 10 5334 1 1 17 ARG HH12 H -6.188 6.567 7.574 1.00 . A A . 38 ARG HH12 1 1 10 5335 1 1 17 ARG HH21 H -6.216 3.330 6.442 1.00 . A A . 38 ARG HH21 1 1 10 5336 1 1 17 ARG HH22 H -7.129 4.730 6.879 1.00 . A A . 38 ARG HH22 1 1 10 5337 1 1 17 ARG N N -3.715 4.854 3.886 1.00 . A A . 38 ARG N 1 1 10 5338 1 1 17 ARG NE N -3.976 4.286 7.114 1.00 . A A . 38 ARG NE 1 1 10 5339 1 1 17 ARG NH1 N -5.280 6.135 7.531 1.00 . A A . 38 ARG NH1 1 1 10 5340 1 1 17 ARG NH2 N -6.242 4.259 6.839 1.00 . A A . 38 ARG NH2 1 1 10 5341 1 1 17 ARG O O -0.726 5.350 2.002 1.00 . A A . 38 ARG O 1 1 10 5342 1 1 18 ALA C C -2.299 1.614 0.506 1.00 . A A . 39 ALA C 1 1 10 5343 1 1 18 ALA CA C -1.400 2.791 0.961 1.00 . A A . 39 ALA CA 1 1 10 5344 1 1 18 ALA CB C 0.024 2.271 1.221 1.00 . A A . 39 ALA CB 1 1 10 5345 1 1 18 ALA H H -2.571 2.924 2.731 1.00 . A A . 39 ALA H 1 1 10 5346 1 1 18 ALA HA H -1.372 3.538 0.166 1.00 . A A . 39 ALA HA 1 1 10 5347 1 1 18 ALA HB1 H -0.002 1.528 2.016 1.00 . A A . 39 ALA HB1 1 1 10 5348 1 1 18 ALA HB2 H 0.422 1.801 0.321 1.00 . A A . 39 ALA HB2 1 1 10 5349 1 1 18 ALA HB3 H 0.683 3.092 1.506 1.00 . A A . 39 ALA HB3 1 1 10 5350 1 1 18 ALA N N -1.888 3.429 2.188 1.00 . A A . 39 ALA N 1 1 10 5351 1 1 18 ALA O O -3.015 1.033 1.327 1.00 . A A . 39 ALA O 1 1 10 5352 1 1 19 PRO C C -1.688 -1.226 -0.764 1.00 . A A . 40 PRO C 1 1 10 5353 1 1 19 PRO CA C -2.671 -0.124 -1.214 1.00 . A A . 40 PRO CA 1 1 10 5354 1 1 19 PRO CB C -2.753 -0.010 -2.742 1.00 . A A . 40 PRO CB 1 1 10 5355 1 1 19 PRO CD C -1.629 1.929 -1.891 1.00 . A A . 40 PRO CD 1 1 10 5356 1 1 19 PRO CG C -1.627 0.965 -3.078 1.00 . A A . 40 PRO CG 1 1 10 5357 1 1 19 PRO HA H -3.661 -0.349 -0.818 1.00 . A A . 40 PRO HA 1 1 10 5358 1 1 19 PRO HB2 H -2.626 -0.968 -3.247 1.00 . A A . 40 PRO HB2 1 1 10 5359 1 1 19 PRO HB3 H -3.712 0.435 -3.017 1.00 . A A . 40 PRO HB3 1 1 10 5360 1 1 19 PRO HD2 H -0.609 2.246 -1.671 1.00 . A A . 40 PRO HD2 1 1 10 5361 1 1 19 PRO HD3 H -2.248 2.796 -2.126 1.00 . A A . 40 PRO HD3 1 1 10 5362 1 1 19 PRO HG2 H -0.677 0.431 -3.112 1.00 . A A . 40 PRO HG2 1 1 10 5363 1 1 19 PRO HG3 H -1.807 1.483 -4.020 1.00 . A A . 40 PRO HG3 1 1 10 5364 1 1 19 PRO N N -2.226 1.200 -0.776 1.00 . A A . 40 PRO N 1 1 10 5365 1 1 19 PRO O O -0.605 -0.942 -0.247 1.00 . A A . 40 PRO O 1 1 10 5366 1 1 20 LYS C C 0.177 -3.772 -1.157 1.00 . A A . 41 LYS C 1 1 10 5367 1 1 20 LYS CA C -1.287 -3.728 -0.682 1.00 . A A . 41 LYS CA 1 1 10 5368 1 1 20 LYS CB C -2.107 -4.929 -1.198 1.00 . A A . 41 LYS CB 1 1 10 5369 1 1 20 LYS CD C -2.609 -7.408 -1.047 1.00 . A A . 41 LYS CD 1 1 10 5370 1 1 20 LYS CE C -2.088 -8.752 -0.524 1.00 . A A . 41 LYS CE 1 1 10 5371 1 1 20 LYS CG C -1.640 -6.286 -0.650 1.00 . A A . 41 LYS CG 1 1 10 5372 1 1 20 LYS H H -2.949 -2.624 -1.449 1.00 . A A . 41 LYS H 1 1 10 5373 1 1 20 LYS HA H -1.238 -3.795 0.403 1.00 . A A . 41 LYS HA 1 1 10 5374 1 1 20 LYS HB2 H -3.148 -4.790 -0.899 1.00 . A A . 41 LYS HB2 1 1 10 5375 1 1 20 LYS HB3 H -2.073 -4.948 -2.290 1.00 . A A . 41 LYS HB3 1 1 10 5376 1 1 20 LYS HD2 H -3.594 -7.204 -0.619 1.00 . A A . 41 LYS HD2 1 1 10 5377 1 1 20 LYS HD3 H -2.692 -7.446 -2.135 1.00 . A A . 41 LYS HD3 1 1 10 5378 1 1 20 LYS HE2 H -1.092 -8.928 -0.941 1.00 . A A . 41 LYS HE2 1 1 10 5379 1 1 20 LYS HE3 H -1.989 -8.694 0.564 1.00 . A A . 41 LYS HE3 1 1 10 5380 1 1 20 LYS HG2 H -0.654 -6.523 -1.051 1.00 . A A . 41 LYS HG2 1 1 10 5381 1 1 20 LYS HG3 H -1.580 -6.233 0.437 1.00 . A A . 41 LYS HG3 1 1 10 5382 1 1 20 LYS HZ1 H -3.090 -9.957 -1.892 1.00 . A A . 41 LYS HZ1 1 1 10 5383 1 1 20 LYS HZ2 H -2.638 -10.755 -0.544 1.00 . A A . 41 LYS HZ2 1 1 10 5384 1 1 20 LYS HZ3 H -3.917 -9.745 -0.496 1.00 . A A . 41 LYS HZ3 1 1 10 5385 1 1 20 LYS N N -2.035 -2.494 -1.021 1.00 . A A . 41 LYS N 1 1 10 5386 1 1 20 LYS NZ N -2.994 -9.874 -0.889 1.00 . A A . 41 LYS NZ 1 1 10 5387 1 1 20 LYS O O 0.964 -4.574 -0.654 1.00 . A A . 41 LYS O 1 1 10 5388 1 1 21 VAL C C 2.858 -2.232 -1.239 1.00 . A A . 42 VAL C 1 1 10 5389 1 1 21 VAL CA C 1.969 -2.596 -2.446 1.00 . A A . 42 VAL CA 1 1 10 5390 1 1 21 VAL CB C 1.994 -1.453 -3.486 1.00 . A A . 42 VAL CB 1 1 10 5391 1 1 21 VAL CG1 C 3.404 -1.135 -3.984 1.00 . A A . 42 VAL CG1 1 1 10 5392 1 1 21 VAL CG2 C 1.144 -1.792 -4.723 1.00 . A A . 42 VAL CG2 1 1 10 5393 1 1 21 VAL H H -0.144 -2.273 -2.431 1.00 . A A . 42 VAL H 1 1 10 5394 1 1 21 VAL HA H 2.390 -3.489 -2.907 1.00 . A A . 42 VAL HA 1 1 10 5395 1 1 21 VAL HB H 1.586 -0.551 -3.028 1.00 . A A . 42 VAL HB 1 1 10 5396 1 1 21 VAL HG11 H 3.860 -2.033 -4.402 1.00 . A A . 42 VAL HG11 1 1 10 5397 1 1 21 VAL HG12 H 3.366 -0.363 -4.753 1.00 . A A . 42 VAL HG12 1 1 10 5398 1 1 21 VAL HG13 H 4.019 -0.762 -3.167 1.00 . A A . 42 VAL HG13 1 1 10 5399 1 1 21 VAL HG21 H 1.504 -2.713 -5.182 1.00 . A A . 42 VAL HG21 1 1 10 5400 1 1 21 VAL HG22 H 0.095 -1.912 -4.453 1.00 . A A . 42 VAL HG22 1 1 10 5401 1 1 21 VAL HG23 H 1.209 -0.982 -5.450 1.00 . A A . 42 VAL HG23 1 1 10 5402 1 1 21 VAL N N 0.572 -2.877 -2.061 1.00 . A A . 42 VAL N 1 1 10 5403 1 1 21 VAL O O 4.025 -2.619 -1.203 1.00 . A A . 42 VAL O 1 1 10 5404 1 1 22 CYS C C 2.173 -0.817 2.136 1.00 . A A . 43 CYS C 1 1 10 5405 1 1 22 CYS CA C 3.051 -0.896 0.860 1.00 . A A . 43 CYS CA 1 1 10 5406 1 1 22 CYS CB C 3.536 0.476 0.345 1.00 . A A . 43 CYS CB 1 1 10 5407 1 1 22 CYS H H 1.323 -1.298 -0.309 1.00 . A A . 43 CYS H 1 1 10 5408 1 1 22 CYS HA H 3.927 -1.503 1.098 1.00 . A A . 43 CYS HA 1 1 10 5409 1 1 22 CYS HB2 H 3.993 0.334 -0.637 1.00 . A A . 43 CYS HB2 1 1 10 5410 1 1 22 CYS HB3 H 2.681 1.144 0.227 1.00 . A A . 43 CYS HB3 1 1 10 5411 1 1 22 CYS N N 2.314 -1.512 -0.250 1.00 . A A . 43 CYS N 1 1 10 5412 1 1 22 CYS O O 1.262 -1.621 2.338 1.00 . A A . 43 CYS O 1 1 10 5413 1 1 22 CYS SG S 4.770 1.226 1.444 1.00 . A A . 43 CYS SG 1 1 10 5414 1 1 23 PHE C C 1.637 2.093 4.353 1.00 . A A . 44 PHE C 1 1 10 5415 1 1 23 PHE CA C 1.669 0.560 4.163 1.00 . A A . 44 PHE CA 1 1 10 5416 1 1 23 PHE CB C 2.195 -0.132 5.433 1.00 . A A . 44 PHE CB 1 1 10 5417 1 1 23 PHE CD1 C 4.728 0.110 5.431 1.00 . A A . 44 PHE CD1 1 1 10 5418 1 1 23 PHE CD2 C 3.427 1.386 7.046 1.00 . A A . 44 PHE CD2 1 1 10 5419 1 1 23 PHE CE1 C 5.909 0.690 5.929 1.00 . A A . 44 PHE CE1 1 1 10 5420 1 1 23 PHE CE2 C 4.608 1.967 7.542 1.00 . A A . 44 PHE CE2 1 1 10 5421 1 1 23 PHE CG C 3.481 0.458 5.987 1.00 . A A . 44 PHE CG 1 1 10 5422 1 1 23 PHE CZ C 5.849 1.620 6.981 1.00 . A A . 44 PHE CZ 1 1 10 5423 1 1 23 PHE H H 3.296 0.676 2.779 1.00 . A A . 44 PHE H 1 1 10 5424 1 1 23 PHE HA H 0.639 0.237 4.006 1.00 . A A . 44 PHE HA 1 1 10 5425 1 1 23 PHE HB2 H 1.425 -0.059 6.200 1.00 . A A . 44 PHE HB2 1 1 10 5426 1 1 23 PHE HB3 H 2.343 -1.195 5.232 1.00 . A A . 44 PHE HB3 1 1 10 5427 1 1 23 PHE HD1 H 4.783 -0.602 4.617 1.00 . A A . 44 PHE HD1 1 1 10 5428 1 1 23 PHE HD2 H 2.473 1.663 7.475 1.00 . A A . 44 PHE HD2 1 1 10 5429 1 1 23 PHE HE1 H 6.865 0.420 5.503 1.00 . A A . 44 PHE HE1 1 1 10 5430 1 1 23 PHE HE2 H 4.561 2.681 8.353 1.00 . A A . 44 PHE HE2 1 1 10 5431 1 1 23 PHE HZ H 6.760 2.066 7.362 1.00 . A A . 44 PHE HZ 1 1 10 5432 1 1 23 PHE N N 2.470 0.141 3.008 1.00 . A A . 44 PHE N 1 1 10 5433 1 1 23 PHE O O 0.743 2.594 5.037 1.00 . A A . 44 PHE O 1 1 10 5434 1 1 24 LYS C C 3.442 4.985 2.731 1.00 . A A . 45 LYS C 1 1 10 5435 1 1 24 LYS CA C 2.701 4.307 3.894 1.00 . A A . 45 LYS CA 1 1 10 5436 1 1 24 LYS CB C 3.402 4.604 5.237 1.00 . A A . 45 LYS CB 1 1 10 5437 1 1 24 LYS CD C 4.207 6.315 6.908 1.00 . A A . 45 LYS CD 1 1 10 5438 1 1 24 LYS CE C 4.318 7.813 7.219 1.00 . A A . 45 LYS CE 1 1 10 5439 1 1 24 LYS CG C 3.509 6.102 5.557 1.00 . A A . 45 LYS CG 1 1 10 5440 1 1 24 LYS H H 3.277 2.363 3.195 1.00 . A A . 45 LYS H 1 1 10 5441 1 1 24 LYS HA H 1.701 4.745 3.922 1.00 . A A . 45 LYS HA 1 1 10 5442 1 1 24 LYS HB2 H 2.837 4.128 6.041 1.00 . A A . 45 LYS HB2 1 1 10 5443 1 1 24 LYS HB3 H 4.403 4.167 5.229 1.00 . A A . 45 LYS HB3 1 1 10 5444 1 1 24 LYS HD2 H 3.634 5.820 7.694 1.00 . A A . 45 LYS HD2 1 1 10 5445 1 1 24 LYS HD3 H 5.208 5.878 6.868 1.00 . A A . 45 LYS HD3 1 1 10 5446 1 1 24 LYS HE2 H 4.860 8.302 6.404 1.00 . A A . 45 LYS HE2 1 1 10 5447 1 1 24 LYS HE3 H 3.311 8.240 7.254 1.00 . A A . 45 LYS HE3 1 1 10 5448 1 1 24 LYS HG2 H 4.086 6.607 4.781 1.00 . A A . 45 LYS HG2 1 1 10 5449 1 1 24 LYS HG3 H 2.507 6.534 5.594 1.00 . A A . 45 LYS HG3 1 1 10 5450 1 1 24 LYS HZ1 H 4.528 7.621 9.279 1.00 . A A . 45 LYS HZ1 1 1 10 5451 1 1 24 LYS HZ2 H 5.959 7.686 8.490 1.00 . A A . 45 LYS HZ2 1 1 10 5452 1 1 24 LYS HZ3 H 5.082 9.044 8.706 1.00 . A A . 45 LYS HZ3 1 1 10 5453 1 1 24 LYS N N 2.583 2.842 3.752 1.00 . A A . 45 LYS N 1 1 10 5454 1 1 24 LYS NZ N 5.017 8.054 8.508 1.00 . A A . 45 LYS NZ 1 1 10 5455 1 1 24 LYS O O 2.871 5.859 2.076 1.00 . A A . 45 LYS O 1 1 10 5456 1 1 25 CYS C C 5.340 5.059 0.062 1.00 . A A . 46 CYS C 1 1 10 5457 1 1 25 CYS CA C 5.613 5.296 1.565 1.00 . A A . 46 CYS CA 1 1 10 5458 1 1 25 CYS CB C 7.065 4.976 1.974 1.00 . A A . 46 CYS CB 1 1 10 5459 1 1 25 CYS H H 5.111 3.891 3.061 1.00 . A A . 46 CYS H 1 1 10 5460 1 1 25 CYS HA H 5.481 6.367 1.721 1.00 . A A . 46 CYS HA 1 1 10 5461 1 1 25 CYS HB2 H 7.730 5.143 1.122 1.00 . A A . 46 CYS HB2 1 1 10 5462 1 1 25 CYS HB3 H 7.359 5.680 2.757 1.00 . A A . 46 CYS HB3 1 1 10 5463 1 1 25 CYS N N 4.697 4.604 2.478 1.00 . A A . 46 CYS N 1 1 10 5464 1 1 25 CYS O O 5.554 5.979 -0.731 1.00 . A A . 46 CYS O 1 1 10 5465 1 1 25 CYS SG S 7.287 3.290 2.615 1.00 . A A . 46 CYS SG 1 1 10 5466 1 1 26 LYS C C 4.931 4.001 -2.921 1.00 . A A . 47 LYS C 1 1 10 5467 1 1 26 LYS CA C 4.198 3.541 -1.635 1.00 . A A . 47 LYS CA 1 1 10 5468 1 1 26 LYS CB C 2.689 3.883 -1.607 1.00 . A A . 47 LYS CB 1 1 10 5469 1 1 26 LYS CD C 0.876 5.655 -1.342 1.00 . A A . 47 LYS CD 1 1 10 5470 1 1 26 LYS CE C 0.618 7.085 -0.850 1.00 . A A . 47 LYS CE 1 1 10 5471 1 1 26 LYS CG C 2.384 5.381 -1.439 1.00 . A A . 47 LYS CG 1 1 10 5472 1 1 26 LYS H H 4.699 3.201 0.417 1.00 . A A . 47 LYS H 1 1 10 5473 1 1 26 LYS HA H 4.240 2.454 -1.706 1.00 . A A . 47 LYS HA 1 1 10 5474 1 1 26 LYS HB2 H 2.216 3.522 -2.522 1.00 . A A . 47 LYS HB2 1 1 10 5475 1 1 26 LYS HB3 H 2.237 3.346 -0.774 1.00 . A A . 47 LYS HB3 1 1 10 5476 1 1 26 LYS HD2 H 0.432 5.527 -2.331 1.00 . A A . 47 LYS HD2 1 1 10 5477 1 1 26 LYS HD3 H 0.407 4.945 -0.659 1.00 . A A . 47 LYS HD3 1 1 10 5478 1 1 26 LYS HE2 H 1.261 7.774 -1.406 1.00 . A A . 47 LYS HE2 1 1 10 5479 1 1 26 LYS HE3 H -0.420 7.348 -1.070 1.00 . A A . 47 LYS HE3 1 1 10 5480 1 1 26 LYS HG2 H 2.852 5.736 -0.528 1.00 . A A . 47 LYS HG2 1 1 10 5481 1 1 26 LYS HG3 H 2.798 5.940 -2.279 1.00 . A A . 47 LYS HG3 1 1 10 5482 1 1 26 LYS HZ1 H 1.788 6.917 0.880 1.00 . A A . 47 LYS HZ1 1 1 10 5483 1 1 26 LYS HZ2 H 0.732 8.173 0.926 1.00 . A A . 47 LYS HZ2 1 1 10 5484 1 1 26 LYS HZ3 H 0.216 6.630 1.139 1.00 . A A . 47 LYS HZ3 1 1 10 5485 1 1 26 LYS N N 4.800 3.890 -0.320 1.00 . A A . 47 LYS N 1 1 10 5486 1 1 26 LYS NZ N 0.856 7.220 0.613 1.00 . A A . 47 LYS NZ 1 1 10 5487 1 1 26 LYS O O 4.302 4.169 -3.965 1.00 . A A . 47 LYS O 1 1 10 5488 1 1 27 GLN C C 7.169 3.475 -5.107 1.00 . A A . 48 GLN C 1 1 10 5489 1 1 27 GLN CA C 7.077 4.588 -4.031 1.00 . A A . 48 GLN CA 1 1 10 5490 1 1 27 GLN CB C 8.485 5.006 -3.557 1.00 . A A . 48 GLN CB 1 1 10 5491 1 1 27 GLN CD C 7.825 7.437 -3.130 1.00 . A A . 48 GLN CD 1 1 10 5492 1 1 27 GLN CG C 8.502 6.186 -2.570 1.00 . A A . 48 GLN CG 1 1 10 5493 1 1 27 GLN H H 6.710 4.056 -1.983 1.00 . A A . 48 GLN H 1 1 10 5494 1 1 27 GLN HA H 6.592 5.456 -4.477 1.00 . A A . 48 GLN HA 1 1 10 5495 1 1 27 GLN HB2 H 8.971 4.156 -3.082 1.00 . A A . 48 GLN HB2 1 1 10 5496 1 1 27 GLN HB3 H 9.084 5.283 -4.424 1.00 . A A . 48 GLN HB3 1 1 10 5497 1 1 27 GLN HE21 H 6.214 7.229 -1.924 1.00 . A A . 48 GLN HE21 1 1 10 5498 1 1 27 GLN HE22 H 6.208 8.619 -3.017 1.00 . A A . 48 GLN HE22 1 1 10 5499 1 1 27 GLN HG2 H 8.027 5.891 -1.637 1.00 . A A . 48 GLN HG2 1 1 10 5500 1 1 27 GLN HG3 H 9.538 6.431 -2.338 1.00 . A A . 48 GLN HG3 1 1 10 5501 1 1 27 GLN N N 6.255 4.190 -2.873 1.00 . A A . 48 GLN N 1 1 10 5502 1 1 27 GLN NE2 N 6.653 7.793 -2.649 1.00 . A A . 48 GLN NE2 1 1 10 5503 1 1 27 GLN O O 7.092 2.297 -4.744 1.00 . A A . 48 GLN O 1 1 10 5504 1 1 27 GLN OE1 O 8.332 8.107 -4.022 1.00 . A A . 48 GLN OE1 1 1 10 5505 1 1 28 PRO C C 7.961 1.532 -7.557 1.00 . A A . 49 PRO C 1 1 10 5506 1 1 28 PRO CA C 7.234 2.892 -7.556 1.00 . A A . 49 PRO CA 1 1 10 5507 1 1 28 PRO CB C 7.673 3.704 -8.779 1.00 . A A . 49 PRO CB 1 1 10 5508 1 1 28 PRO CD C 7.588 5.167 -6.902 1.00 . A A . 49 PRO CD 1 1 10 5509 1 1 28 PRO CG C 7.306 5.132 -8.401 1.00 . A A . 49 PRO CG 1 1 10 5510 1 1 28 PRO HA H 6.168 2.683 -7.660 1.00 . A A . 49 PRO HA 1 1 10 5511 1 1 28 PRO HB2 H 8.755 3.631 -8.908 1.00 . A A . 49 PRO HB2 1 1 10 5512 1 1 28 PRO HB3 H 7.158 3.383 -9.685 1.00 . A A . 49 PRO HB3 1 1 10 5513 1 1 28 PRO HD2 H 8.627 5.458 -6.736 1.00 . A A . 49 PRO HD2 1 1 10 5514 1 1 28 PRO HD3 H 6.918 5.889 -6.438 1.00 . A A . 49 PRO HD3 1 1 10 5515 1 1 28 PRO HG2 H 7.906 5.864 -8.943 1.00 . A A . 49 PRO HG2 1 1 10 5516 1 1 28 PRO HG3 H 6.242 5.297 -8.579 1.00 . A A . 49 PRO HG3 1 1 10 5517 1 1 28 PRO N N 7.380 3.805 -6.404 1.00 . A A . 49 PRO N 1 1 10 5518 1 1 28 PRO O O 7.561 0.648 -8.319 1.00 . A A . 49 PRO O 1 1 10 5519 1 1 29 GLY C C 10.464 -0.250 -5.354 1.00 . A A . 50 GLY C 1 1 10 5520 1 1 29 GLY CA C 9.762 0.063 -6.685 1.00 . A A . 50 GLY CA 1 1 10 5521 1 1 29 GLY H H 9.337 2.123 -6.211 1.00 . A A . 50 GLY H 1 1 10 5522 1 1 29 GLY HA2 H 10.523 0.076 -7.466 1.00 . A A . 50 GLY HA2 1 1 10 5523 1 1 29 GLY HA3 H 9.086 -0.767 -6.889 1.00 . A A . 50 GLY HA3 1 1 10 5524 1 1 29 GLY N N 9.010 1.333 -6.746 1.00 . A A . 50 GLY N 1 1 10 5525 1 1 29 GLY O O 11.134 -1.278 -5.241 1.00 . A A . 50 GLY O 1 1 10 5526 1 1 30 HIS C C 10.514 -0.792 -2.234 1.00 . A A . 51 HIS C 1 1 10 5527 1 1 30 HIS CA C 10.969 0.456 -3.024 1.00 . A A . 51 HIS CA 1 1 10 5528 1 1 30 HIS CB C 10.693 1.725 -2.197 1.00 . A A . 51 HIS CB 1 1 10 5529 1 1 30 HIS CD2 C 9.124 1.525 -0.188 1.00 . A A . 51 HIS CD2 1 1 10 5530 1 1 30 HIS CE1 C 7.179 1.407 -1.201 1.00 . A A . 51 HIS CE1 1 1 10 5531 1 1 30 HIS CG C 9.338 1.718 -1.527 1.00 . A A . 51 HIS CG 1 1 10 5532 1 1 30 HIS H H 9.764 1.432 -4.491 1.00 . A A . 51 HIS H 1 1 10 5533 1 1 30 HIS HA H 12.045 0.375 -3.180 1.00 . A A . 51 HIS HA 1 1 10 5534 1 1 30 HIS HB2 H 11.455 1.792 -1.417 1.00 . A A . 51 HIS HB2 1 1 10 5535 1 1 30 HIS HB3 H 10.795 2.612 -2.822 1.00 . A A . 51 HIS HB3 1 1 10 5536 1 1 30 HIS HD1 H 7.897 1.764 -3.133 1.00 . A A . 51 HIS HD1 1 1 10 5537 1 1 30 HIS HD2 H 9.895 1.446 0.567 1.00 . A A . 51 HIS HD2 1 1 10 5538 1 1 30 HIS HE1 H 6.122 1.270 -1.389 1.00 . A A . 51 HIS HE1 1 1 10 5539 1 1 30 HIS N N 10.319 0.608 -4.337 1.00 . A A . 51 HIS N 1 1 10 5540 1 1 30 HIS ND1 N 8.102 1.654 -2.141 1.00 . A A . 51 HIS ND1 1 1 10 5541 1 1 30 HIS NE2 N 7.753 1.327 0.009 1.00 . A A . 51 HIS NE2 1 1 10 5542 1 1 30 HIS O O 11.247 -1.311 -1.392 1.00 . A A . 51 HIS O 1 1 10 5543 1 1 31 PHE C C 9.309 -3.614 -1.655 1.00 . A A . 52 PHE C 1 1 10 5544 1 1 31 PHE CA C 8.599 -2.254 -1.647 1.00 . A A . 52 PHE CA 1 1 10 5545 1 1 31 PHE CB C 7.129 -2.353 -2.085 1.00 . A A . 52 PHE CB 1 1 10 5546 1 1 31 PHE CD1 C 6.881 -3.663 -4.251 1.00 . A A . 52 PHE CD1 1 1 10 5547 1 1 31 PHE CD2 C 6.660 -1.240 -4.316 1.00 . A A . 52 PHE CD2 1 1 10 5548 1 1 31 PHE CE1 C 6.665 -3.717 -5.640 1.00 . A A . 52 PHE CE1 1 1 10 5549 1 1 31 PHE CE2 C 6.435 -1.296 -5.701 1.00 . A A . 52 PHE CE2 1 1 10 5550 1 1 31 PHE CG C 6.888 -2.423 -3.584 1.00 . A A . 52 PHE CG 1 1 10 5551 1 1 31 PHE CZ C 6.443 -2.534 -6.366 1.00 . A A . 52 PHE CZ 1 1 10 5552 1 1 31 PHE H H 8.746 -0.800 -3.192 1.00 . A A . 52 PHE H 1 1 10 5553 1 1 31 PHE HA H 8.606 -1.906 -0.614 1.00 . A A . 52 PHE HA 1 1 10 5554 1 1 31 PHE HB2 H 6.679 -3.225 -1.613 1.00 . A A . 52 PHE HB2 1 1 10 5555 1 1 31 PHE HB3 H 6.603 -1.480 -1.697 1.00 . A A . 52 PHE HB3 1 1 10 5556 1 1 31 PHE HD1 H 7.047 -4.580 -3.701 1.00 . A A . 52 PHE HD1 1 1 10 5557 1 1 31 PHE HD2 H 6.632 -0.285 -3.812 1.00 . A A . 52 PHE HD2 1 1 10 5558 1 1 31 PHE HE1 H 6.671 -4.672 -6.150 1.00 . A A . 52 PHE HE1 1 1 10 5559 1 1 31 PHE HE2 H 6.240 -0.387 -6.251 1.00 . A A . 52 PHE HE2 1 1 10 5560 1 1 31 PHE HZ H 6.272 -2.575 -7.434 1.00 . A A . 52 PHE HZ 1 1 10 5561 1 1 31 PHE N N 9.284 -1.256 -2.471 1.00 . A A . 52 PHE N 1 1 10 5562 1 1 31 PHE O O 9.516 -4.197 -0.592 1.00 . A A . 52 PHE O 1 1 10 5563 1 1 32 SER C C 11.896 -5.378 -2.260 1.00 . A A . 53 SER C 1 1 10 5564 1 1 32 SER CA C 10.541 -5.326 -2.990 1.00 . A A . 53 SER CA 1 1 10 5565 1 1 32 SER CB C 10.768 -5.591 -4.484 1.00 . A A . 53 SER CB 1 1 10 5566 1 1 32 SER H H 9.568 -3.547 -3.654 1.00 . A A . 53 SER H 1 1 10 5567 1 1 32 SER HA H 9.934 -6.141 -2.594 1.00 . A A . 53 SER HA 1 1 10 5568 1 1 32 SER HB2 H 11.401 -4.804 -4.900 1.00 . A A . 53 SER HB2 1 1 10 5569 1 1 32 SER HB3 H 11.274 -6.551 -4.609 1.00 . A A . 53 SER HB3 1 1 10 5570 1 1 32 SER HG H 9.711 -5.826 -6.119 1.00 . A A . 53 SER HG 1 1 10 5571 1 1 32 SER N N 9.789 -4.068 -2.816 1.00 . A A . 53 SER N 1 1 10 5572 1 1 32 SER O O 12.556 -6.421 -2.272 1.00 . A A . 53 SER O 1 1 10 5573 1 1 32 SER OG O 9.532 -5.623 -5.180 1.00 . A A . 53 SER OG 1 1 10 5574 1 1 33 LYS C C 13.408 -3.435 0.493 1.00 . A A . 54 LYS C 1 1 10 5575 1 1 33 LYS CA C 13.576 -4.134 -0.871 1.00 . A A . 54 LYS CA 1 1 10 5576 1 1 33 LYS CB C 14.645 -3.469 -1.766 1.00 . A A . 54 LYS CB 1 1 10 5577 1 1 33 LYS CD C 15.412 -1.345 -2.986 1.00 . A A . 54 LYS CD 1 1 10 5578 1 1 33 LYS CE C 15.616 -1.995 -4.362 1.00 . A A . 54 LYS CE 1 1 10 5579 1 1 33 LYS CG C 14.293 -2.029 -2.189 1.00 . A A . 54 LYS CG 1 1 10 5580 1 1 33 LYS H H 11.736 -3.449 -1.706 1.00 . A A . 54 LYS H 1 1 10 5581 1 1 33 LYS HA H 13.936 -5.135 -0.624 1.00 . A A . 54 LYS HA 1 1 10 5582 1 1 33 LYS HB2 H 15.595 -3.459 -1.231 1.00 . A A . 54 LYS HB2 1 1 10 5583 1 1 33 LYS HB3 H 14.775 -4.083 -2.657 1.00 . A A . 54 LYS HB3 1 1 10 5584 1 1 33 LYS HD2 H 15.141 -0.296 -3.125 1.00 . A A . 54 LYS HD2 1 1 10 5585 1 1 33 LYS HD3 H 16.340 -1.388 -2.414 1.00 . A A . 54 LYS HD3 1 1 10 5586 1 1 33 LYS HE2 H 15.880 -3.048 -4.224 1.00 . A A . 54 LYS HE2 1 1 10 5587 1 1 33 LYS HE3 H 14.671 -1.954 -4.913 1.00 . A A . 54 LYS HE3 1 1 10 5588 1 1 33 LYS HG2 H 13.389 -2.039 -2.799 1.00 . A A . 54 LYS HG2 1 1 10 5589 1 1 33 LYS HG3 H 14.101 -1.431 -1.296 1.00 . A A . 54 LYS HG3 1 1 10 5590 1 1 33 LYS HZ1 H 16.459 -0.333 -5.289 1.00 . A A . 54 LYS HZ1 1 1 10 5591 1 1 33 LYS HZ2 H 17.571 -1.348 -4.655 1.00 . A A . 54 LYS HZ2 1 1 10 5592 1 1 33 LYS HZ3 H 16.808 -1.735 -6.044 1.00 . A A . 54 LYS HZ3 1 1 10 5593 1 1 33 LYS N N 12.322 -4.272 -1.631 1.00 . A A . 54 LYS N 1 1 10 5594 1 1 33 LYS NZ N 16.684 -1.306 -5.136 1.00 . A A . 54 LYS NZ 1 1 10 5595 1 1 33 LYS O O 14.409 -3.090 1.125 1.00 . A A . 54 LYS O 1 1 10 5596 1 1 34 GLN C C 10.555 -3.199 2.877 1.00 . A A . 55 GLN C 1 1 10 5597 1 1 34 GLN CA C 11.877 -2.669 2.286 1.00 . A A . 55 GLN CA 1 1 10 5598 1 1 34 GLN CB C 11.873 -1.128 2.184 1.00 . A A . 55 GLN CB 1 1 10 5599 1 1 34 GLN CD C 11.674 1.065 3.439 1.00 . A A . 55 GLN CD 1 1 10 5600 1 1 34 GLN CG C 11.756 -0.454 3.561 1.00 . A A . 55 GLN CG 1 1 10 5601 1 1 34 GLN H H 11.400 -3.592 0.410 1.00 . A A . 55 GLN H 1 1 10 5602 1 1 34 GLN HA H 12.672 -2.959 2.975 1.00 . A A . 55 GLN HA 1 1 10 5603 1 1 34 GLN HB2 H 12.803 -0.797 1.722 1.00 . A A . 55 GLN HB2 1 1 10 5604 1 1 34 GLN HB3 H 11.048 -0.801 1.550 1.00 . A A . 55 GLN HB3 1 1 10 5605 1 1 34 GLN HE21 H 9.656 1.039 3.426 1.00 . A A . 55 GLN HE21 1 1 10 5606 1 1 34 GLN HE22 H 10.413 2.626 3.323 1.00 . A A . 55 GLN HE22 1 1 10 5607 1 1 34 GLN HG2 H 10.864 -0.813 4.078 1.00 . A A . 55 GLN HG2 1 1 10 5608 1 1 34 GLN HG3 H 12.625 -0.715 4.166 1.00 . A A . 55 GLN HG3 1 1 10 5609 1 1 34 GLN N N 12.168 -3.235 0.961 1.00 . A A . 55 GLN N 1 1 10 5610 1 1 34 GLN NE2 N 10.483 1.623 3.392 1.00 . A A . 55 GLN NE2 1 1 10 5611 1 1 34 GLN O O 10.573 -3.913 3.883 1.00 . A A . 55 GLN O 1 1 10 5612 1 1 34 GLN OE1 O 12.672 1.772 3.381 1.00 . A A . 55 GLN OE1 1 1 10 5613 1 1 35 CYS C C 7.413 -4.375 2.550 1.00 . A A . 56 CYS C 1 1 10 5614 1 1 35 CYS CA C 8.083 -3.021 2.863 1.00 . A A . 56 CYS CA 1 1 10 5615 1 1 35 CYS CB C 7.205 -1.852 2.386 1.00 . A A . 56 CYS CB 1 1 10 5616 1 1 35 CYS H H 9.480 -2.235 1.475 1.00 . A A . 56 CYS H 1 1 10 5617 1 1 35 CYS HA H 8.171 -2.947 3.948 1.00 . A A . 56 CYS HA 1 1 10 5618 1 1 35 CYS HB2 H 7.096 -1.886 1.299 1.00 . A A . 56 CYS HB2 1 1 10 5619 1 1 35 CYS HB3 H 6.212 -1.947 2.833 1.00 . A A . 56 CYS HB3 1 1 10 5620 1 1 35 CYS N N 9.415 -2.851 2.269 1.00 . A A . 56 CYS N 1 1 10 5621 1 1 35 CYS O O 6.435 -4.748 3.208 1.00 . A A . 56 CYS O 1 1 10 5622 1 1 35 CYS SG S 7.951 -0.281 2.902 1.00 . A A . 56 CYS SG 1 1 10 5623 1 1 36 ARG C C 8.345 -7.380 0.544 1.00 . A A . 57 ARG C 1 1 10 5624 1 1 36 ARG CA C 7.303 -6.326 0.977 1.00 . A A . 57 ARG CA 1 1 10 5625 1 1 36 ARG CB C 6.382 -5.914 -0.197 1.00 . A A . 57 ARG CB 1 1 10 5626 1 1 36 ARG CD C 3.858 -5.951 0.286 1.00 . A A . 57 ARG CD 1 1 10 5627 1 1 36 ARG CG C 5.073 -6.727 -0.252 1.00 . A A . 57 ARG CG 1 1 10 5628 1 1 36 ARG CZ C 3.292 -4.555 2.281 1.00 . A A . 57 ARG CZ 1 1 10 5629 1 1 36 ARG H H 8.683 -4.693 1.031 1.00 . A A . 57 ARG H 1 1 10 5630 1 1 36 ARG HA H 6.711 -6.807 1.757 1.00 . A A . 57 ARG HA 1 1 10 5631 1 1 36 ARG HB2 H 6.128 -4.856 -0.124 1.00 . A A . 57 ARG HB2 1 1 10 5632 1 1 36 ARG HB3 H 6.922 -6.035 -1.139 1.00 . A A . 57 ARG HB3 1 1 10 5633 1 1 36 ARG HD2 H 3.631 -5.146 -0.416 1.00 . A A . 57 ARG HD2 1 1 10 5634 1 1 36 ARG HD3 H 2.999 -6.624 0.320 1.00 . A A . 57 ARG HD3 1 1 10 5635 1 1 36 ARG HE H 5.000 -5.509 2.044 1.00 . A A . 57 ARG HE 1 1 10 5636 1 1 36 ARG HG2 H 4.868 -6.981 -1.294 1.00 . A A . 57 ARG HG2 1 1 10 5637 1 1 36 ARG HG3 H 5.183 -7.660 0.299 1.00 . A A . 57 ARG HG3 1 1 10 5638 1 1 36 ARG HH11 H 1.799 -4.613 0.962 1.00 . A A . 57 ARG HH11 1 1 10 5639 1 1 36 ARG HH12 H 1.606 -3.472 2.268 1.00 . A A . 57 ARG HH12 1 1 10 5640 1 1 36 ARG HH21 H 4.639 -4.204 3.702 1.00 . A A . 57 ARG HH21 1 1 10 5641 1 1 36 ARG HH22 H 3.077 -3.433 3.930 1.00 . A A . 57 ARG HH22 1 1 10 5642 1 1 36 ARG N N 7.908 -5.104 1.543 1.00 . A A . 57 ARG N 1 1 10 5643 1 1 36 ARG NE N 4.092 -5.371 1.624 1.00 . A A . 57 ARG NE 1 1 10 5644 1 1 36 ARG NH1 N 2.103 -4.253 1.860 1.00 . A A . 57 ARG NH1 1 1 10 5645 1 1 36 ARG NH2 N 3.695 -4.009 3.389 1.00 . A A . 57 ARG NH2 1 1 10 5646 1 1 36 ARG O O 8.016 -8.295 -0.216 1.00 . A A . 57 ARG O 1 1 10 5647 1 1 37 SER C C 10.483 -9.603 0.853 1.00 . A A . 58 SER C 1 1 10 5648 1 1 37 SER CA C 10.765 -8.098 0.733 1.00 . A A . 58 SER CA 1 1 10 5649 1 1 37 SER CB C 11.915 -7.724 1.668 1.00 . A A . 58 SER CB 1 1 10 5650 1 1 37 SER H H 9.763 -6.442 1.607 1.00 . A A . 58 SER H 1 1 10 5651 1 1 37 SER HA H 11.096 -7.912 -0.288 1.00 . A A . 58 SER HA 1 1 10 5652 1 1 37 SER HB2 H 11.641 -7.973 2.698 1.00 . A A . 58 SER HB2 1 1 10 5653 1 1 37 SER HB3 H 12.801 -8.305 1.396 1.00 . A A . 58 SER HB3 1 1 10 5654 1 1 37 SER HG H 12.904 -6.120 2.206 1.00 . A A . 58 SER HG 1 1 10 5655 1 1 37 SER N N 9.593 -7.235 1.007 1.00 . A A . 58 SER N 1 1 10 5656 1 1 37 SER O O 9.936 -10.038 1.891 1.00 . A A . 58 SER O 1 1 10 5657 1 1 37 SER OXT O 10.851 -10.350 -0.083 1.00 . A A . 58 SER OXT 1 1 10 5658 1 1 37 SER OG O 12.195 -6.337 1.568 1.00 . A A . 58 SER OG 1 1 10 5659 2 2 1 ZN ZN ZN -8.220 0.457 3.773 1.00 . B A . 1059 ZN ZN 1 1 10 5660 3 2 1 ZN ZN ZN 6.897 1.290 1.879 1.00 . C A . 1060 ZN ZN 1 1 11 5661 1 1 1 GLN C C -6.973 -1.518 -5.091 1.00 . A A . 22 GLN C 1 1 11 5662 1 1 1 GLN CA C -6.274 -0.843 -6.289 1.00 . A A . 22 GLN CA 1 1 11 5663 1 1 1 GLN CB C -4.858 -0.298 -5.942 1.00 . A A . 22 GLN CB 1 1 11 5664 1 1 1 GLN CD C -4.201 1.374 -7.798 1.00 . A A . 22 GLN CD 1 1 11 5665 1 1 1 GLN CG C -3.940 0.020 -7.141 1.00 . A A . 22 GLN CG 1 1 11 5666 1 1 1 GLN H1 H -8.054 -0.172 -7.100 1.00 . A A . 22 GLN H1 1 1 11 5667 1 1 1 GLN H2 H -7.304 0.935 -6.147 1.00 . A A . 22 GLN H2 1 1 11 5668 1 1 1 GLN H3 H -6.737 0.641 -7.661 1.00 . A A . 22 GLN H3 1 1 11 5669 1 1 1 GLN HA H -6.151 -1.619 -7.046 1.00 . A A . 22 GLN HA 1 1 11 5670 1 1 1 GLN HB2 H -4.934 0.583 -5.304 1.00 . A A . 22 GLN HB2 1 1 11 5671 1 1 1 GLN HB3 H -4.325 -1.058 -5.371 1.00 . A A . 22 GLN HB3 1 1 11 5672 1 1 1 GLN HE21 H -2.364 2.104 -7.367 1.00 . A A . 22 GLN HE21 1 1 11 5673 1 1 1 GLN HE22 H -3.459 3.174 -8.232 1.00 . A A . 22 GLN HE22 1 1 11 5674 1 1 1 GLN HG2 H -2.908 0.006 -6.783 1.00 . A A . 22 GLN HG2 1 1 11 5675 1 1 1 GLN HG3 H -4.029 -0.766 -7.893 1.00 . A A . 22 GLN HG3 1 1 11 5676 1 1 1 GLN N N -7.157 0.216 -6.845 1.00 . A A . 22 GLN N 1 1 11 5677 1 1 1 GLN NE2 N -3.262 2.291 -7.786 1.00 . A A . 22 GLN NE2 1 1 11 5678 1 1 1 GLN O O -8.166 -1.293 -4.867 1.00 . A A . 22 GLN O 1 1 11 5679 1 1 1 GLN OE1 O -5.270 1.632 -8.335 1.00 . A A . 22 GLN OE1 1 1 11 5680 1 1 2 THR C C -6.010 -2.703 -1.895 1.00 . A A . 23 THR C 1 1 11 5681 1 1 2 THR CA C -6.766 -3.114 -3.162 1.00 . A A . 23 THR CA 1 1 11 5682 1 1 2 THR CB C -6.593 -4.621 -3.433 1.00 . A A . 23 THR CB 1 1 11 5683 1 1 2 THR CG2 C -7.126 -5.537 -2.330 1.00 . A A . 23 THR CG2 1 1 11 5684 1 1 2 THR H H -5.282 -2.477 -4.544 1.00 . A A . 23 THR H 1 1 11 5685 1 1 2 THR HA H -7.826 -2.913 -3.012 1.00 . A A . 23 THR HA 1 1 11 5686 1 1 2 THR HB H -5.532 -4.832 -3.578 1.00 . A A . 23 THR HB 1 1 11 5687 1 1 2 THR HG1 H -7.051 -5.876 -4.845 1.00 . A A . 23 THR HG1 1 1 11 5688 1 1 2 THR HG21 H -8.190 -5.361 -2.177 1.00 . A A . 23 THR HG21 1 1 11 5689 1 1 2 THR HG22 H -6.977 -6.579 -2.618 1.00 . A A . 23 THR HG22 1 1 11 5690 1 1 2 THR HG23 H -6.587 -5.364 -1.398 1.00 . A A . 23 THR HG23 1 1 11 5691 1 1 2 THR N N -6.257 -2.338 -4.315 1.00 . A A . 23 THR N 1 1 11 5692 1 1 2 THR O O -4.821 -2.386 -1.969 1.00 . A A . 23 THR O 1 1 11 5693 1 1 2 THR OG1 O -7.290 -4.961 -4.614 1.00 . A A . 23 THR OG1 1 1 11 5694 1 1 3 CYS C C -4.947 -2.962 1.075 1.00 . A A . 24 CYS C 1 1 11 5695 1 1 3 CYS CA C -6.140 -2.157 0.515 1.00 . A A . 24 CYS CA 1 1 11 5696 1 1 3 CYS CB C -7.278 -2.140 1.537 1.00 . A A . 24 CYS CB 1 1 11 5697 1 1 3 CYS H H -7.666 -2.931 -0.760 1.00 . A A . 24 CYS H 1 1 11 5698 1 1 3 CYS HA H -5.816 -1.129 0.343 1.00 . A A . 24 CYS HA 1 1 11 5699 1 1 3 CYS HB2 H -8.190 -1.765 1.074 1.00 . A A . 24 CYS HB2 1 1 11 5700 1 1 3 CYS HB3 H -7.464 -3.155 1.887 1.00 . A A . 24 CYS HB3 1 1 11 5701 1 1 3 CYS N N -6.685 -2.669 -0.745 1.00 . A A . 24 CYS N 1 1 11 5702 1 1 3 CYS O O -4.887 -4.188 0.950 1.00 . A A . 24 CYS O 1 1 11 5703 1 1 3 CYS SG S -6.789 -1.068 2.912 1.00 . A A . 24 CYS SG 1 1 11 5704 1 1 4 TYR C C -3.568 -3.550 3.924 1.00 . A A . 25 TYR C 1 1 11 5705 1 1 4 TYR CA C -3.024 -2.879 2.644 1.00 . A A . 25 TYR CA 1 1 11 5706 1 1 4 TYR CB C -1.970 -1.824 3.020 1.00 . A A . 25 TYR CB 1 1 11 5707 1 1 4 TYR CD1 C -3.380 -0.066 4.224 1.00 . A A . 25 TYR CD1 1 1 11 5708 1 1 4 TYR CD2 C -1.491 -1.063 5.393 1.00 . A A . 25 TYR CD2 1 1 11 5709 1 1 4 TYR CE1 C -3.678 0.703 5.364 1.00 . A A . 25 TYR CE1 1 1 11 5710 1 1 4 TYR CE2 C -1.780 -0.287 6.532 1.00 . A A . 25 TYR CE2 1 1 11 5711 1 1 4 TYR CG C -2.286 -0.955 4.233 1.00 . A A . 25 TYR CG 1 1 11 5712 1 1 4 TYR CZ C -2.878 0.597 6.519 1.00 . A A . 25 TYR CZ 1 1 11 5713 1 1 4 TYR H H -4.189 -1.273 1.856 1.00 . A A . 25 TYR H 1 1 11 5714 1 1 4 TYR HA H -2.528 -3.658 2.066 1.00 . A A . 25 TYR HA 1 1 11 5715 1 1 4 TYR HB2 H -1.050 -2.369 3.233 1.00 . A A . 25 TYR HB2 1 1 11 5716 1 1 4 TYR HB3 H -1.765 -1.183 2.163 1.00 . A A . 25 TYR HB3 1 1 11 5717 1 1 4 TYR HD1 H -4.008 0.022 3.349 1.00 . A A . 25 TYR HD1 1 1 11 5718 1 1 4 TYR HD2 H -0.656 -1.752 5.413 1.00 . A A . 25 TYR HD2 1 1 11 5719 1 1 4 TYR HE1 H -4.533 1.359 5.371 1.00 . A A . 25 TYR HE1 1 1 11 5720 1 1 4 TYR HE2 H -1.167 -0.376 7.418 1.00 . A A . 25 TYR HE2 1 1 11 5721 1 1 4 TYR HH H -2.598 1.142 8.366 1.00 . A A . 25 TYR HH 1 1 11 5722 1 1 4 TYR N N -4.053 -2.272 1.788 1.00 . A A . 25 TYR N 1 1 11 5723 1 1 4 TYR O O -2.857 -4.343 4.546 1.00 . A A . 25 TYR O 1 1 11 5724 1 1 4 TYR OH O -3.192 1.335 7.620 1.00 . A A . 25 TYR OH 1 1 11 5725 1 1 5 ASN C C -6.803 -4.075 5.604 1.00 . A A . 26 ASN C 1 1 11 5726 1 1 5 ASN CA C -5.354 -3.556 5.653 1.00 . A A . 26 ASN CA 1 1 11 5727 1 1 5 ASN CB C -5.255 -2.275 6.504 1.00 . A A . 26 ASN CB 1 1 11 5728 1 1 5 ASN CG C -5.929 -2.412 7.859 1.00 . A A . 26 ASN CG 1 1 11 5729 1 1 5 ASN H H -5.321 -2.578 3.755 1.00 . A A . 26 ASN H 1 1 11 5730 1 1 5 ASN HA H -4.754 -4.333 6.131 1.00 . A A . 26 ASN HA 1 1 11 5731 1 1 5 ASN HB2 H -4.206 -2.036 6.668 1.00 . A A . 26 ASN HB2 1 1 11 5732 1 1 5 ASN HB3 H -5.709 -1.440 5.968 1.00 . A A . 26 ASN HB3 1 1 11 5733 1 1 5 ASN HD21 H -7.642 -1.537 7.212 1.00 . A A . 26 ASN HD21 1 1 11 5734 1 1 5 ASN HD22 H -7.603 -2.042 8.894 1.00 . A A . 26 ASN HD22 1 1 11 5735 1 1 5 ASN N N -4.806 -3.238 4.328 1.00 . A A . 26 ASN N 1 1 11 5736 1 1 5 ASN ND2 N -7.153 -1.948 7.996 1.00 . A A . 26 ASN ND2 1 1 11 5737 1 1 5 ASN O O -7.106 -5.112 6.200 1.00 . A A . 26 ASN O 1 1 11 5738 1 1 5 ASN OD1 O -5.370 -2.945 8.807 1.00 . A A . 26 ASN OD1 1 1 11 5739 1 1 6 CYS C C -9.463 -4.925 4.027 1.00 . A A . 27 CYS C 1 1 11 5740 1 1 6 CYS CA C -9.125 -3.656 4.843 1.00 . A A . 27 CYS CA 1 1 11 5741 1 1 6 CYS CB C -9.835 -2.422 4.253 1.00 . A A . 27 CYS CB 1 1 11 5742 1 1 6 CYS H H -7.380 -2.523 4.441 1.00 . A A . 27 CYS H 1 1 11 5743 1 1 6 CYS HA H -9.487 -3.806 5.862 1.00 . A A . 27 CYS HA 1 1 11 5744 1 1 6 CYS HB2 H -9.569 -2.315 3.200 1.00 . A A . 27 CYS HB2 1 1 11 5745 1 1 6 CYS HB3 H -10.915 -2.576 4.313 1.00 . A A . 27 CYS HB3 1 1 11 5746 1 1 6 CYS N N -7.690 -3.373 4.895 1.00 . A A . 27 CYS N 1 1 11 5747 1 1 6 CYS O O -10.544 -5.495 4.179 1.00 . A A . 27 CYS O 1 1 11 5748 1 1 6 CYS SG S -9.399 -0.901 5.154 1.00 . A A . 27 CYS SG 1 1 11 5749 1 1 7 GLY C C -9.809 -6.110 1.049 1.00 . A A . 28 GLY C 1 1 11 5750 1 1 7 GLY CA C -8.784 -6.426 2.153 1.00 . A A . 28 GLY CA 1 1 11 5751 1 1 7 GLY H H -7.681 -4.859 3.098 1.00 . A A . 28 GLY H 1 1 11 5752 1 1 7 GLY HA2 H -9.119 -7.317 2.684 1.00 . A A . 28 GLY HA2 1 1 11 5753 1 1 7 GLY HA3 H -7.834 -6.655 1.670 1.00 . A A . 28 GLY HA3 1 1 11 5754 1 1 7 GLY N N -8.566 -5.344 3.125 1.00 . A A . 28 GLY N 1 1 11 5755 1 1 7 GLY O O -10.156 -6.995 0.265 1.00 . A A . 28 GLY O 1 1 11 5756 1 1 8 LYS C C -10.636 -3.895 -1.291 1.00 . A A . 29 LYS C 1 1 11 5757 1 1 8 LYS CA C -11.310 -4.404 -0.001 1.00 . A A . 29 LYS CA 1 1 11 5758 1 1 8 LYS CB C -12.154 -3.260 0.606 1.00 . A A . 29 LYS CB 1 1 11 5759 1 1 8 LYS CD C -13.394 -4.468 2.546 1.00 . A A . 29 LYS CD 1 1 11 5760 1 1 8 LYS CE C -13.250 -5.975 2.301 1.00 . A A . 29 LYS CE 1 1 11 5761 1 1 8 LYS CG C -13.495 -3.664 1.243 1.00 . A A . 29 LYS CG 1 1 11 5762 1 1 8 LYS H H -9.958 -4.194 1.643 1.00 . A A . 29 LYS H 1 1 11 5763 1 1 8 LYS HA H -11.965 -5.233 -0.264 1.00 . A A . 29 LYS HA 1 1 11 5764 1 1 8 LYS HB2 H -11.558 -2.709 1.338 1.00 . A A . 29 LYS HB2 1 1 11 5765 1 1 8 LYS HB3 H -12.404 -2.555 -0.185 1.00 . A A . 29 LYS HB3 1 1 11 5766 1 1 8 LYS HD2 H -12.556 -4.094 3.136 1.00 . A A . 29 LYS HD2 1 1 11 5767 1 1 8 LYS HD3 H -14.309 -4.303 3.119 1.00 . A A . 29 LYS HD3 1 1 11 5768 1 1 8 LYS HE2 H -14.154 -6.338 1.801 1.00 . A A . 29 LYS HE2 1 1 11 5769 1 1 8 LYS HE3 H -12.405 -6.152 1.633 1.00 . A A . 29 LYS HE3 1 1 11 5770 1 1 8 LYS HG2 H -14.025 -2.738 1.473 1.00 . A A . 29 LYS HG2 1 1 11 5771 1 1 8 LYS HG3 H -14.097 -4.209 0.516 1.00 . A A . 29 LYS HG3 1 1 11 5772 1 1 8 LYS HZ1 H -13.806 -6.555 4.219 1.00 . A A . 29 LYS HZ1 1 1 11 5773 1 1 8 LYS HZ2 H -12.956 -7.701 3.421 1.00 . A A . 29 LYS HZ2 1 1 11 5774 1 1 8 LYS HZ3 H -12.185 -6.386 4.026 1.00 . A A . 29 LYS HZ3 1 1 11 5775 1 1 8 LYS N N -10.322 -4.871 0.989 1.00 . A A . 29 LYS N 1 1 11 5776 1 1 8 LYS NZ N -13.040 -6.705 3.576 1.00 . A A . 29 LYS NZ 1 1 11 5777 1 1 8 LYS O O -9.543 -3.322 -1.210 1.00 . A A . 29 LYS O 1 1 11 5778 1 1 9 PRO C C -11.380 -1.770 -3.513 1.00 . A A . 30 PRO C 1 1 11 5779 1 1 9 PRO CA C -10.978 -3.253 -3.670 1.00 . A A . 30 PRO CA 1 1 11 5780 1 1 9 PRO CB C -11.754 -3.973 -4.781 1.00 . A A . 30 PRO CB 1 1 11 5781 1 1 9 PRO CD C -12.534 -4.769 -2.668 1.00 . A A . 30 PRO CD 1 1 11 5782 1 1 9 PRO CG C -13.029 -4.420 -4.070 1.00 . A A . 30 PRO CG 1 1 11 5783 1 1 9 PRO HA H -9.911 -3.308 -3.888 1.00 . A A . 30 PRO HA 1 1 11 5784 1 1 9 PRO HB2 H -11.972 -3.341 -5.642 1.00 . A A . 30 PRO HB2 1 1 11 5785 1 1 9 PRO HB3 H -11.193 -4.852 -5.101 1.00 . A A . 30 PRO HB3 1 1 11 5786 1 1 9 PRO HD2 H -13.299 -4.505 -1.936 1.00 . A A . 30 PRO HD2 1 1 11 5787 1 1 9 PRO HD3 H -12.314 -5.836 -2.614 1.00 . A A . 30 PRO HD3 1 1 11 5788 1 1 9 PRO HG2 H -13.732 -3.588 -4.016 1.00 . A A . 30 PRO HG2 1 1 11 5789 1 1 9 PRO HG3 H -13.488 -5.279 -4.562 1.00 . A A . 30 PRO HG3 1 1 11 5790 1 1 9 PRO N N -11.304 -4.011 -2.456 1.00 . A A . 30 PRO N 1 1 11 5791 1 1 9 PRO O O -11.708 -1.312 -2.414 1.00 . A A . 30 PRO O 1 1 11 5792 1 1 10 GLY C C -10.867 1.301 -3.682 1.00 . A A . 31 GLY C 1 1 11 5793 1 1 10 GLY CA C -11.746 0.429 -4.589 1.00 . A A . 31 GLY CA 1 1 11 5794 1 1 10 GLY H H -11.065 -1.399 -5.479 1.00 . A A . 31 GLY H 1 1 11 5795 1 1 10 GLY HA2 H -12.781 0.515 -4.253 1.00 . A A . 31 GLY HA2 1 1 11 5796 1 1 10 GLY HA3 H -11.680 0.823 -5.602 1.00 . A A . 31 GLY HA3 1 1 11 5797 1 1 10 GLY N N -11.354 -0.991 -4.602 1.00 . A A . 31 GLY N 1 1 11 5798 1 1 10 GLY O O -11.337 2.289 -3.112 1.00 . A A . 31 GLY O 1 1 11 5799 1 1 11 HIS C C -7.498 2.213 -3.337 1.00 . A A . 32 HIS C 1 1 11 5800 1 1 11 HIS CA C -8.642 1.514 -2.597 1.00 . A A . 32 HIS CA 1 1 11 5801 1 1 11 HIS CB C -8.129 0.447 -1.621 1.00 . A A . 32 HIS CB 1 1 11 5802 1 1 11 HIS CD2 C -8.561 0.881 0.861 1.00 . A A . 32 HIS CD2 1 1 11 5803 1 1 11 HIS CE1 C -10.559 0.003 1.089 1.00 . A A . 32 HIS CE1 1 1 11 5804 1 1 11 HIS CG C -8.941 0.387 -0.354 1.00 . A A . 32 HIS CG 1 1 11 5805 1 1 11 HIS H H -9.295 0.086 -4.024 1.00 . A A . 32 HIS H 1 1 11 5806 1 1 11 HIS HA H -9.150 2.280 -2.010 1.00 . A A . 32 HIS HA 1 1 11 5807 1 1 11 HIS HB2 H -8.133 -0.533 -2.099 1.00 . A A . 32 HIS HB2 1 1 11 5808 1 1 11 HIS HB3 H -7.097 0.671 -1.346 1.00 . A A . 32 HIS HB3 1 1 11 5809 1 1 11 HIS HD1 H -10.762 -0.586 -0.930 1.00 . A A . 32 HIS HD1 1 1 11 5810 1 1 11 HIS HD2 H -7.621 1.371 1.068 1.00 . A A . 32 HIS HD2 1 1 11 5811 1 1 11 HIS HE1 H -11.505 -0.317 1.506 1.00 . A A . 32 HIS HE1 1 1 11 5812 1 1 11 HIS N N -9.601 0.908 -3.518 1.00 . A A . 32 HIS N 1 1 11 5813 1 1 11 HIS ND1 N -10.197 -0.154 -0.198 1.00 . A A . 32 HIS ND1 1 1 11 5814 1 1 11 HIS NE2 N -9.581 0.613 1.787 1.00 . A A . 32 HIS NE2 1 1 11 5815 1 1 11 HIS O O -7.057 1.782 -4.403 1.00 . A A . 32 HIS O 1 1 11 5816 1 1 12 LEU C C -5.444 5.028 -2.062 1.00 . A A . 33 LEU C 1 1 11 5817 1 1 12 LEU CA C -6.100 4.307 -3.254 1.00 . A A . 33 LEU CA 1 1 11 5818 1 1 12 LEU CB C -6.873 5.352 -4.098 1.00 . A A . 33 LEU CB 1 1 11 5819 1 1 12 LEU CD1 C -8.284 6.007 -6.063 1.00 . A A . 33 LEU CD1 1 1 11 5820 1 1 12 LEU CD2 C -6.393 4.450 -6.429 1.00 . A A . 33 LEU CD2 1 1 11 5821 1 1 12 LEU CG C -7.475 4.874 -5.433 1.00 . A A . 33 LEU CG 1 1 11 5822 1 1 12 LEU H H -7.429 3.529 -1.830 1.00 . A A . 33 LEU H 1 1 11 5823 1 1 12 LEU HA H -5.321 3.827 -3.848 1.00 . A A . 33 LEU HA 1 1 11 5824 1 1 12 LEU HB2 H -7.684 5.745 -3.483 1.00 . A A . 33 LEU HB2 1 1 11 5825 1 1 12 LEU HB3 H -6.209 6.188 -4.325 1.00 . A A . 33 LEU HB3 1 1 11 5826 1 1 12 LEU HD11 H -9.082 6.308 -5.383 1.00 . A A . 33 LEU HD11 1 1 11 5827 1 1 12 LEU HD12 H -7.641 6.866 -6.262 1.00 . A A . 33 LEU HD12 1 1 11 5828 1 1 12 LEU HD13 H -8.733 5.667 -6.997 1.00 . A A . 33 LEU HD13 1 1 11 5829 1 1 12 LEU HD21 H -5.707 5.277 -6.611 1.00 . A A . 33 LEU HD21 1 1 11 5830 1 1 12 LEU HD22 H -5.838 3.599 -6.039 1.00 . A A . 33 LEU HD22 1 1 11 5831 1 1 12 LEU HD23 H -6.856 4.155 -7.371 1.00 . A A . 33 LEU HD23 1 1 11 5832 1 1 12 LEU HG H -8.154 4.042 -5.260 1.00 . A A . 33 LEU HG 1 1 11 5833 1 1 12 LEU N N -7.050 3.318 -2.742 1.00 . A A . 33 LEU N 1 1 11 5834 1 1 12 LEU O O -5.910 4.906 -0.925 1.00 . A A . 33 LEU O 1 1 11 5835 1 1 13 SER C C -4.881 7.792 -0.722 1.00 . A A . 34 SER C 1 1 11 5836 1 1 13 SER CA C -3.862 6.841 -1.383 1.00 . A A . 34 SER CA 1 1 11 5837 1 1 13 SER CB C -2.820 7.693 -2.117 1.00 . A A . 34 SER CB 1 1 11 5838 1 1 13 SER H H -4.075 5.887 -3.273 1.00 . A A . 34 SER H 1 1 11 5839 1 1 13 SER HA H -3.358 6.289 -0.590 1.00 . A A . 34 SER HA 1 1 11 5840 1 1 13 SER HB2 H -3.329 8.331 -2.842 1.00 . A A . 34 SER HB2 1 1 11 5841 1 1 13 SER HB3 H -2.295 8.326 -1.401 1.00 . A A . 34 SER HB3 1 1 11 5842 1 1 13 SER HG H -1.367 7.423 -3.405 1.00 . A A . 34 SER HG 1 1 11 5843 1 1 13 SER N N -4.449 5.875 -2.333 1.00 . A A . 34 SER N 1 1 11 5844 1 1 13 SER O O -4.603 8.376 0.326 1.00 . A A . 34 SER O 1 1 11 5845 1 1 13 SER OG O -1.890 6.865 -2.798 1.00 . A A . 34 SER OG 1 1 11 5846 1 1 14 SER C C -8.231 7.933 -0.027 1.00 . A A . 35 SER C 1 1 11 5847 1 1 14 SER CA C -7.201 8.748 -0.833 1.00 . A A . 35 SER CA 1 1 11 5848 1 1 14 SER CB C -7.893 9.416 -2.027 1.00 . A A . 35 SER CB 1 1 11 5849 1 1 14 SER H H -6.201 7.502 -2.221 1.00 . A A . 35 SER H 1 1 11 5850 1 1 14 SER HA H -6.831 9.539 -0.177 1.00 . A A . 35 SER HA 1 1 11 5851 1 1 14 SER HB2 H -8.772 9.966 -1.686 1.00 . A A . 35 SER HB2 1 1 11 5852 1 1 14 SER HB3 H -7.200 10.121 -2.489 1.00 . A A . 35 SER HB3 1 1 11 5853 1 1 14 SER HG H -8.723 8.897 -3.724 1.00 . A A . 35 SER HG 1 1 11 5854 1 1 14 SER N N -6.062 7.958 -1.331 1.00 . A A . 35 SER N 1 1 11 5855 1 1 14 SER O O -9.172 8.509 0.524 1.00 . A A . 35 SER O 1 1 11 5856 1 1 14 SER OG O -8.274 8.439 -2.988 1.00 . A A . 35 SER OG 1 1 11 5857 1 1 15 GLN C C -8.276 5.144 2.078 1.00 . A A . 36 GLN C 1 1 11 5858 1 1 15 GLN CA C -8.944 5.683 0.796 1.00 . A A . 36 GLN CA 1 1 11 5859 1 1 15 GLN CB C -9.323 4.532 -0.157 1.00 . A A . 36 GLN CB 1 1 11 5860 1 1 15 GLN CD C -11.866 4.451 -0.032 1.00 . A A . 36 GLN CD 1 1 11 5861 1 1 15 GLN CG C -10.557 3.730 0.282 1.00 . A A . 36 GLN CG 1 1 11 5862 1 1 15 GLN H H -7.243 6.212 -0.384 1.00 . A A . 36 GLN H 1 1 11 5863 1 1 15 GLN HA H -9.856 6.206 1.084 1.00 . A A . 36 GLN HA 1 1 11 5864 1 1 15 GLN HB2 H -9.514 4.930 -1.157 1.00 . A A . 36 GLN HB2 1 1 11 5865 1 1 15 GLN HB3 H -8.476 3.849 -0.229 1.00 . A A . 36 GLN HB3 1 1 11 5866 1 1 15 GLN HE21 H -12.059 3.532 -1.835 1.00 . A A . 36 GLN HE21 1 1 11 5867 1 1 15 GLN HE22 H -13.328 4.672 -1.387 1.00 . A A . 36 GLN HE22 1 1 11 5868 1 1 15 GLN HG2 H -10.563 2.780 -0.248 1.00 . A A . 36 GLN HG2 1 1 11 5869 1 1 15 GLN HG3 H -10.505 3.511 1.349 1.00 . A A . 36 GLN HG3 1 1 11 5870 1 1 15 GLN N N -8.054 6.608 0.075 1.00 . A A . 36 GLN N 1 1 11 5871 1 1 15 GLN NE2 N -12.463 4.198 -1.179 1.00 . A A . 36 GLN NE2 1 1 11 5872 1 1 15 GLN O O -8.912 5.120 3.134 1.00 . A A . 36 GLN O 1 1 11 5873 1 1 15 GLN OE1 O -12.374 5.253 0.742 1.00 . A A . 36 GLN OE1 1 1 11 5874 1 1 16 CYS C C -4.670 4.924 2.864 1.00 . A A . 37 CYS C 1 1 11 5875 1 1 16 CYS CA C -6.097 4.369 3.072 1.00 . A A . 37 CYS CA 1 1 11 5876 1 1 16 CYS CB C -6.077 2.828 3.123 1.00 . A A . 37 CYS CB 1 1 11 5877 1 1 16 CYS H H -6.544 4.897 1.079 1.00 . A A . 37 CYS H 1 1 11 5878 1 1 16 CYS HA H -6.463 4.752 4.027 1.00 . A A . 37 CYS HA 1 1 11 5879 1 1 16 CYS HB2 H -6.044 2.427 2.108 1.00 . A A . 37 CYS HB2 1 1 11 5880 1 1 16 CYS HB3 H -5.171 2.493 3.625 1.00 . A A . 37 CYS HB3 1 1 11 5881 1 1 16 CYS N N -6.982 4.804 1.987 1.00 . A A . 37 CYS N 1 1 11 5882 1 1 16 CYS O O -4.340 5.463 1.805 1.00 . A A . 37 CYS O 1 1 11 5883 1 1 16 CYS SG S -7.511 2.186 4.034 1.00 . A A . 37 CYS SG 1 1 11 5884 1 1 17 ARG C C -1.578 4.641 2.690 1.00 . A A . 38 ARG C 1 1 11 5885 1 1 17 ARG CA C -2.393 5.208 3.859 1.00 . A A . 38 ARG CA 1 1 11 5886 1 1 17 ARG CB C -1.735 4.881 5.212 1.00 . A A . 38 ARG CB 1 1 11 5887 1 1 17 ARG CD C -2.694 5.017 7.599 1.00 . A A . 38 ARG CD 1 1 11 5888 1 1 17 ARG CG C -2.255 5.790 6.346 1.00 . A A . 38 ARG CG 1 1 11 5889 1 1 17 ARG CZ C -5.146 4.555 7.264 1.00 . A A . 38 ARG CZ 1 1 11 5890 1 1 17 ARG H H -4.150 4.311 4.710 1.00 . A A . 38 ARG H 1 1 11 5891 1 1 17 ARG HA H -2.372 6.291 3.720 1.00 . A A . 38 ARG HA 1 1 11 5892 1 1 17 ARG HB2 H -1.904 3.829 5.450 1.00 . A A . 38 ARG HB2 1 1 11 5893 1 1 17 ARG HB3 H -0.659 5.034 5.129 1.00 . A A . 38 ARG HB3 1 1 11 5894 1 1 17 ARG HD2 H -1.867 4.384 7.926 1.00 . A A . 38 ARG HD2 1 1 11 5895 1 1 17 ARG HD3 H -2.899 5.728 8.402 1.00 . A A . 38 ARG HD3 1 1 11 5896 1 1 17 ARG HE H -3.722 3.173 7.349 1.00 . A A . 38 ARG HE 1 1 11 5897 1 1 17 ARG HG2 H -1.453 6.473 6.629 1.00 . A A . 38 ARG HG2 1 1 11 5898 1 1 17 ARG HG3 H -3.087 6.399 5.993 1.00 . A A . 38 ARG HG3 1 1 11 5899 1 1 17 ARG HH11 H -4.818 6.507 7.537 1.00 . A A . 38 ARG HH11 1 1 11 5900 1 1 17 ARG HH12 H -6.481 6.058 7.285 1.00 . A A . 38 ARG HH12 1 1 11 5901 1 1 17 ARG HH21 H -5.848 2.694 7.008 1.00 . A A . 38 ARG HH21 1 1 11 5902 1 1 17 ARG HH22 H -7.033 3.959 6.928 1.00 . A A . 38 ARG HH22 1 1 11 5903 1 1 17 ARG N N -3.804 4.763 3.876 1.00 . A A . 38 ARG N 1 1 11 5904 1 1 17 ARG NE N -3.885 4.173 7.364 1.00 . A A . 38 ARG NE 1 1 11 5905 1 1 17 ARG NH1 N -5.510 5.803 7.346 1.00 . A A . 38 ARG NH1 1 1 11 5906 1 1 17 ARG NH2 N -6.077 3.671 7.055 1.00 . A A . 38 ARG NH2 1 1 11 5907 1 1 17 ARG O O -0.705 5.340 2.174 1.00 . A A . 38 ARG O 1 1 11 5908 1 1 18 ALA C C -2.328 1.713 0.470 1.00 . A A . 39 ALA C 1 1 11 5909 1 1 18 ALA CA C -1.412 2.856 0.969 1.00 . A A . 39 ALA CA 1 1 11 5910 1 1 18 ALA CB C 0.010 2.315 1.189 1.00 . A A . 39 ALA CB 1 1 11 5911 1 1 18 ALA H H -2.603 2.912 2.723 1.00 . A A . 39 ALA H 1 1 11 5912 1 1 18 ALA HA H -1.389 3.641 0.213 1.00 . A A . 39 ALA HA 1 1 11 5913 1 1 18 ALA HB1 H -0.017 1.524 1.938 1.00 . A A . 39 ALA HB1 1 1 11 5914 1 1 18 ALA HB2 H 0.402 1.897 0.262 1.00 . A A . 39 ALA HB2 1 1 11 5915 1 1 18 ALA HB3 H 0.675 3.113 1.519 1.00 . A A . 39 ALA HB3 1 1 11 5916 1 1 18 ALA N N -1.893 3.429 2.228 1.00 . A A . 39 ALA N 1 1 11 5917 1 1 18 ALA O O -3.051 1.111 1.271 1.00 . A A . 39 ALA O 1 1 11 5918 1 1 19 PRO C C -1.754 -1.084 -0.874 1.00 . A A . 40 PRO C 1 1 11 5919 1 1 19 PRO CA C -2.724 0.043 -1.300 1.00 . A A . 40 PRO CA 1 1 11 5920 1 1 19 PRO CB C -2.802 0.198 -2.822 1.00 . A A . 40 PRO CB 1 1 11 5921 1 1 19 PRO CD C -1.676 2.111 -1.918 1.00 . A A . 40 PRO CD 1 1 11 5922 1 1 19 PRO CG C -1.677 1.184 -3.133 1.00 . A A . 40 PRO CG 1 1 11 5923 1 1 19 PRO HA H -3.717 -0.183 -0.910 1.00 . A A . 40 PRO HA 1 1 11 5924 1 1 19 PRO HB2 H -2.673 -0.746 -3.354 1.00 . A A . 40 PRO HB2 1 1 11 5925 1 1 19 PRO HB3 H -3.761 0.649 -3.086 1.00 . A A . 40 PRO HB3 1 1 11 5926 1 1 19 PRO HD2 H -0.656 2.425 -1.693 1.00 . A A . 40 PRO HD2 1 1 11 5927 1 1 19 PRO HD3 H -2.297 2.984 -2.123 1.00 . A A . 40 PRO HD3 1 1 11 5928 1 1 19 PRO HG2 H -0.726 0.651 -3.187 1.00 . A A . 40 PRO HG2 1 1 11 5929 1 1 19 PRO HG3 H -1.861 1.731 -4.059 1.00 . A A . 40 PRO HG3 1 1 11 5930 1 1 19 PRO N N -2.268 1.348 -0.824 1.00 . A A . 40 PRO N 1 1 11 5931 1 1 19 PRO O O -0.667 -0.827 -0.352 1.00 . A A . 40 PRO O 1 1 11 5932 1 1 20 LYS C C 0.064 -3.667 -1.296 1.00 . A A . 41 LYS C 1 1 11 5933 1 1 20 LYS CA C -1.402 -3.593 -0.830 1.00 . A A . 41 LYS CA 1 1 11 5934 1 1 20 LYS CB C -2.244 -4.772 -1.361 1.00 . A A . 41 LYS CB 1 1 11 5935 1 1 20 LYS CD C -2.882 -7.213 -1.141 1.00 . A A . 41 LYS CD 1 1 11 5936 1 1 20 LYS CE C -2.486 -8.553 -0.508 1.00 . A A . 41 LYS CE 1 1 11 5937 1 1 20 LYS CG C -1.887 -6.122 -0.721 1.00 . A A . 41 LYS CG 1 1 11 5938 1 1 20 LYS H H -3.044 -2.444 -1.578 1.00 . A A . 41 LYS H 1 1 11 5939 1 1 20 LYS HA H -1.362 -3.668 0.255 1.00 . A A . 41 LYS HA 1 1 11 5940 1 1 20 LYS HB2 H -3.295 -4.574 -1.150 1.00 . A A . 41 LYS HB2 1 1 11 5941 1 1 20 LYS HB3 H -2.130 -4.840 -2.445 1.00 . A A . 41 LYS HB3 1 1 11 5942 1 1 20 LYS HD2 H -3.885 -6.933 -0.809 1.00 . A A . 41 LYS HD2 1 1 11 5943 1 1 20 LYS HD3 H -2.877 -7.307 -2.228 1.00 . A A . 41 LYS HD3 1 1 11 5944 1 1 20 LYS HE2 H -1.472 -8.807 -0.832 1.00 . A A . 41 LYS HE2 1 1 11 5945 1 1 20 LYS HE3 H -2.471 -8.437 0.580 1.00 . A A . 41 LYS HE3 1 1 11 5946 1 1 20 LYS HG2 H -0.886 -6.424 -1.031 1.00 . A A . 41 LYS HG2 1 1 11 5947 1 1 20 LYS HG3 H -1.906 -6.021 0.365 1.00 . A A . 41 LYS HG3 1 1 11 5948 1 1 20 LYS HZ1 H -3.447 -9.775 -1.891 1.00 . A A . 41 LYS HZ1 1 1 11 5949 1 1 20 LYS HZ2 H -3.154 -10.519 -0.470 1.00 . A A . 41 LYS HZ2 1 1 11 5950 1 1 20 LYS HZ3 H -4.368 -9.437 -0.582 1.00 . A A . 41 LYS HZ3 1 1 11 5951 1 1 20 LYS N N -2.124 -2.341 -1.157 1.00 . A A . 41 LYS N 1 1 11 5952 1 1 20 LYS NZ N -3.426 -9.639 -0.889 1.00 . A A . 41 LYS NZ 1 1 11 5953 1 1 20 LYS O O 0.819 -4.515 -0.824 1.00 . A A . 41 LYS O 1 1 11 5954 1 1 21 VAL C C 2.786 -2.183 -1.316 1.00 . A A . 42 VAL C 1 1 11 5955 1 1 21 VAL CA C 1.896 -2.498 -2.537 1.00 . A A . 42 VAL CA 1 1 11 5956 1 1 21 VAL CB C 1.952 -1.328 -3.546 1.00 . A A . 42 VAL CB 1 1 11 5957 1 1 21 VAL CG1 C 3.374 -1.013 -4.014 1.00 . A A . 42 VAL CG1 1 1 11 5958 1 1 21 VAL CG2 C 1.116 -1.622 -4.803 1.00 . A A . 42 VAL CG2 1 1 11 5959 1 1 21 VAL H H -0.205 -2.112 -2.514 1.00 . A A . 42 VAL H 1 1 11 5960 1 1 21 VAL HA H 2.302 -3.388 -3.018 1.00 . A A . 42 VAL HA 1 1 11 5961 1 1 21 VAL HB H 1.547 -0.434 -3.070 1.00 . A A . 42 VAL HB 1 1 11 5962 1 1 21 VAL HG11 H 3.829 -1.904 -4.448 1.00 . A A . 42 VAL HG11 1 1 11 5963 1 1 21 VAL HG12 H 3.355 -0.221 -4.765 1.00 . A A . 42 VAL HG12 1 1 11 5964 1 1 21 VAL HG13 H 3.980 -0.666 -3.178 1.00 . A A . 42 VAL HG13 1 1 11 5965 1 1 21 VAL HG21 H 1.473 -2.533 -5.282 1.00 . A A . 42 VAL HG21 1 1 11 5966 1 1 21 VAL HG22 H 0.062 -1.739 -4.550 1.00 . A A . 42 VAL HG22 1 1 11 5967 1 1 21 VAL HG23 H 1.199 -0.793 -5.505 1.00 . A A . 42 VAL HG23 1 1 11 5968 1 1 21 VAL N N 0.492 -2.753 -2.168 1.00 . A A . 42 VAL N 1 1 11 5969 1 1 21 VAL O O 3.942 -2.604 -1.280 1.00 . A A . 42 VAL O 1 1 11 5970 1 1 22 CYS C C 2.109 -0.821 2.078 1.00 . A A . 43 CYS C 1 1 11 5971 1 1 22 CYS CA C 2.997 -0.895 0.810 1.00 . A A . 43 CYS CA 1 1 11 5972 1 1 22 CYS CB C 3.523 0.474 0.329 1.00 . A A . 43 CYS CB 1 1 11 5973 1 1 22 CYS H H 1.271 -1.227 -0.381 1.00 . A A . 43 CYS H 1 1 11 5974 1 1 22 CYS HA H 3.854 -1.529 1.042 1.00 . A A . 43 CYS HA 1 1 11 5975 1 1 22 CYS HB2 H 3.985 0.342 -0.652 1.00 . A A . 43 CYS HB2 1 1 11 5976 1 1 22 CYS HB3 H 2.688 1.168 0.222 1.00 . A A . 43 CYS HB3 1 1 11 5977 1 1 22 CYS N N 2.254 -1.469 -0.317 1.00 . A A . 43 CYS N 1 1 11 5978 1 1 22 CYS O O 1.198 -1.627 2.268 1.00 . A A . 43 CYS O 1 1 11 5979 1 1 22 CYS SG S 4.769 1.164 1.455 1.00 . A A . 43 CYS SG 1 1 11 5980 1 1 23 PHE C C 1.546 2.066 4.320 1.00 . A A . 44 PHE C 1 1 11 5981 1 1 23 PHE CA C 1.587 0.536 4.113 1.00 . A A . 44 PHE CA 1 1 11 5982 1 1 23 PHE CB C 2.107 -0.167 5.379 1.00 . A A . 44 PHE CB 1 1 11 5983 1 1 23 PHE CD1 C 4.636 0.111 5.401 1.00 . A A . 44 PHE CD1 1 1 11 5984 1 1 23 PHE CD2 C 3.305 1.332 7.035 1.00 . A A . 44 PHE CD2 1 1 11 5985 1 1 23 PHE CE1 C 5.805 0.698 5.919 1.00 . A A . 44 PHE CE1 1 1 11 5986 1 1 23 PHE CE2 C 4.474 1.920 7.551 1.00 . A A . 44 PHE CE2 1 1 11 5987 1 1 23 PHE CG C 3.381 0.429 5.956 1.00 . A A . 44 PHE CG 1 1 11 5988 1 1 23 PHE CZ C 5.724 1.604 6.993 1.00 . A A . 44 PHE CZ 1 1 11 5989 1 1 23 PHE H H 3.218 0.678 2.735 1.00 . A A . 44 PHE H 1 1 11 5990 1 1 23 PHE HA H 0.559 0.210 3.947 1.00 . A A . 44 PHE HA 1 1 11 5991 1 1 23 PHE HB2 H 1.327 -0.111 6.141 1.00 . A A . 44 PHE HB2 1 1 11 5992 1 1 23 PHE HB3 H 2.267 -1.225 5.167 1.00 . A A . 44 PHE HB3 1 1 11 5993 1 1 23 PHE HD1 H 4.707 -0.582 4.575 1.00 . A A . 44 PHE HD1 1 1 11 5994 1 1 23 PHE HD2 H 2.344 1.586 7.464 1.00 . A A . 44 PHE HD2 1 1 11 5995 1 1 23 PHE HE1 H 6.768 0.452 5.495 1.00 . A A . 44 PHE HE1 1 1 11 5996 1 1 23 PHE HE2 H 4.411 2.616 8.378 1.00 . A A . 44 PHE HE2 1 1 11 5997 1 1 23 PHE HZ H 6.625 2.055 7.388 1.00 . A A . 44 PHE HZ 1 1 11 5998 1 1 23 PHE N N 2.396 0.136 2.960 1.00 . A A . 44 PHE N 1 1 11 5999 1 1 23 PHE O O 0.608 2.562 4.947 1.00 . A A . 44 PHE O 1 1 11 6000 1 1 24 LYS C C 3.430 4.977 2.826 1.00 . A A . 45 LYS C 1 1 11 6001 1 1 24 LYS CA C 2.627 4.286 3.939 1.00 . A A . 45 LYS CA 1 1 11 6002 1 1 24 LYS CB C 3.245 4.582 5.322 1.00 . A A . 45 LYS CB 1 1 11 6003 1 1 24 LYS CD C 3.867 6.299 7.064 1.00 . A A . 45 LYS CD 1 1 11 6004 1 1 24 LYS CE C 3.888 7.794 7.404 1.00 . A A . 45 LYS CE 1 1 11 6005 1 1 24 LYS CG C 3.277 6.081 5.664 1.00 . A A . 45 LYS CG 1 1 11 6006 1 1 24 LYS H H 3.260 2.343 3.280 1.00 . A A . 45 LYS H 1 1 11 6007 1 1 24 LYS HA H 1.623 4.714 3.910 1.00 . A A . 45 LYS HA 1 1 11 6008 1 1 24 LYS HB2 H 2.655 4.076 6.086 1.00 . A A . 45 LYS HB2 1 1 11 6009 1 1 24 LYS HB3 H 4.260 4.183 5.362 1.00 . A A . 45 LYS HB3 1 1 11 6010 1 1 24 LYS HD2 H 3.261 5.767 7.799 1.00 . A A . 45 LYS HD2 1 1 11 6011 1 1 24 LYS HD3 H 4.885 5.905 7.091 1.00 . A A . 45 LYS HD3 1 1 11 6012 1 1 24 LYS HE2 H 4.473 8.320 6.644 1.00 . A A . 45 LYS HE2 1 1 11 6013 1 1 24 LYS HE3 H 2.864 8.178 7.362 1.00 . A A . 45 LYS HE3 1 1 11 6014 1 1 24 LYS HG2 H 3.890 6.614 4.937 1.00 . A A . 45 LYS HG2 1 1 11 6015 1 1 24 LYS HG3 H 2.262 6.477 5.633 1.00 . A A . 45 LYS HG3 1 1 11 6016 1 1 24 LYS HZ1 H 3.936 7.573 9.472 1.00 . A A . 45 LYS HZ1 1 1 11 6017 1 1 24 LYS HZ2 H 5.423 7.713 8.806 1.00 . A A . 45 LYS HZ2 1 1 11 6018 1 1 24 LYS HZ3 H 4.473 9.028 8.968 1.00 . A A . 45 LYS HZ3 1 1 11 6019 1 1 24 LYS N N 2.527 2.819 3.786 1.00 . A A . 45 LYS N 1 1 11 6020 1 1 24 LYS NZ N 4.468 8.042 8.750 1.00 . A A . 45 LYS NZ 1 1 11 6021 1 1 24 LYS O O 2.904 5.888 2.184 1.00 . A A . 45 LYS O 1 1 11 6022 1 1 25 CYS C C 5.399 5.062 0.210 1.00 . A A . 46 CYS C 1 1 11 6023 1 1 25 CYS CA C 5.636 5.264 1.724 1.00 . A A . 46 CYS CA 1 1 11 6024 1 1 25 CYS CB C 7.070 4.909 2.166 1.00 . A A . 46 CYS CB 1 1 11 6025 1 1 25 CYS H H 5.063 3.835 3.173 1.00 . A A . 46 CYS H 1 1 11 6026 1 1 25 CYS HA H 5.520 6.336 1.898 1.00 . A A . 46 CYS HA 1 1 11 6027 1 1 25 CYS HB2 H 7.763 5.097 1.343 1.00 . A A . 46 CYS HB2 1 1 11 6028 1 1 25 CYS HB3 H 7.347 5.576 2.984 1.00 . A A . 46 CYS HB3 1 1 11 6029 1 1 25 CYS N N 4.681 4.572 2.599 1.00 . A A . 46 CYS N 1 1 11 6030 1 1 25 CYS O O 5.630 5.999 -0.557 1.00 . A A . 46 CYS O 1 1 11 6031 1 1 25 CYS SG S 7.244 3.197 2.746 1.00 . A A . 46 CYS SG 1 1 11 6032 1 1 26 LYS C C 5.020 4.086 -2.808 1.00 . A A . 47 LYS C 1 1 11 6033 1 1 26 LYS CA C 4.284 3.584 -1.541 1.00 . A A . 47 LYS CA 1 1 11 6034 1 1 26 LYS CB C 2.772 3.909 -1.516 1.00 . A A . 47 LYS CB 1 1 11 6035 1 1 26 LYS CD C 0.933 5.631 -1.205 1.00 . A A . 47 LYS CD 1 1 11 6036 1 1 26 LYS CE C 0.631 7.054 -0.716 1.00 . A A . 47 LYS CE 1 1 11 6037 1 1 26 LYS CG C 2.445 5.397 -1.317 1.00 . A A . 47 LYS CG 1 1 11 6038 1 1 26 LYS H H 4.754 3.196 0.510 1.00 . A A . 47 LYS H 1 1 11 6039 1 1 26 LYS HA H 4.335 2.502 -1.641 1.00 . A A . 47 LYS HA 1 1 11 6040 1 1 26 LYS HB2 H 2.308 3.561 -2.441 1.00 . A A . 47 LYS HB2 1 1 11 6041 1 1 26 LYS HB3 H 2.320 3.347 -0.697 1.00 . A A . 47 LYS HB3 1 1 11 6042 1 1 26 LYS HD2 H 0.484 5.489 -2.190 1.00 . A A . 47 LYS HD2 1 1 11 6043 1 1 26 LYS HD3 H 0.488 4.911 -0.518 1.00 . A A . 47 LYS HD3 1 1 11 6044 1 1 26 LYS HE2 H 1.251 7.761 -1.275 1.00 . A A . 47 LYS HE2 1 1 11 6045 1 1 26 LYS HE3 H -0.414 7.278 -0.936 1.00 . A A . 47 LYS HE3 1 1 11 6046 1 1 26 LYS HG2 H 2.912 5.747 -0.402 1.00 . A A . 47 LYS HG2 1 1 11 6047 1 1 26 LYS HG3 H 2.839 5.979 -2.151 1.00 . A A . 47 LYS HG3 1 1 11 6048 1 1 26 LYS HZ1 H 1.801 6.920 1.016 1.00 . A A . 47 LYS HZ1 1 1 11 6049 1 1 26 LYS HZ2 H 0.715 8.152 1.053 1.00 . A A . 47 LYS HZ2 1 1 11 6050 1 1 26 LYS HZ3 H 0.232 6.599 1.272 1.00 . A A . 47 LYS HZ3 1 1 11 6051 1 1 26 LYS N N 4.867 3.902 -0.210 1.00 . A A . 47 LYS N 1 1 11 6052 1 1 26 LYS NZ N 0.863 7.200 0.746 1.00 . A A . 47 LYS NZ 1 1 11 6053 1 1 26 LYS O O 4.396 4.281 -3.851 1.00 . A A . 47 LYS O 1 1 11 6054 1 1 27 GLN C C 7.267 3.609 -4.995 1.00 . A A . 48 GLN C 1 1 11 6055 1 1 27 GLN CA C 7.171 4.700 -3.894 1.00 . A A . 48 GLN CA 1 1 11 6056 1 1 27 GLN CB C 8.578 5.104 -3.405 1.00 . A A . 48 GLN CB 1 1 11 6057 1 1 27 GLN CD C 7.910 7.521 -2.919 1.00 . A A . 48 GLN CD 1 1 11 6058 1 1 27 GLN CG C 8.589 6.260 -2.390 1.00 . A A . 48 GLN CG 1 1 11 6059 1 1 27 GLN H H 6.795 4.121 -1.861 1.00 . A A . 48 GLN H 1 1 11 6060 1 1 27 GLN HA H 6.690 5.575 -4.324 1.00 . A A . 48 GLN HA 1 1 11 6061 1 1 27 GLN HB2 H 9.059 4.241 -2.947 1.00 . A A . 48 GLN HB2 1 1 11 6062 1 1 27 GLN HB3 H 9.182 5.401 -4.262 1.00 . A A . 48 GLN HB3 1 1 11 6063 1 1 27 GLN HE21 H 6.297 7.278 -1.721 1.00 . A A . 48 GLN HE21 1 1 11 6064 1 1 27 GLN HE22 H 6.287 8.693 -2.781 1.00 . A A . 48 GLN HE22 1 1 11 6065 1 1 27 GLN HG2 H 8.112 5.940 -1.463 1.00 . A A . 48 GLN HG2 1 1 11 6066 1 1 27 GLN HG3 H 9.625 6.502 -2.149 1.00 . A A . 48 GLN HG3 1 1 11 6067 1 1 27 GLN N N 6.344 4.276 -2.748 1.00 . A A . 48 GLN N 1 1 11 6068 1 1 27 GLN NE2 N 6.735 7.861 -2.432 1.00 . A A . 48 GLN NE2 1 1 11 6069 1 1 27 GLN O O 7.180 2.423 -4.657 1.00 . A A . 48 GLN O 1 1 11 6070 1 1 27 GLN OE1 O 8.415 8.214 -3.794 1.00 . A A . 48 GLN OE1 1 1 11 6071 1 1 28 PRO C C 8.062 1.712 -7.483 1.00 . A A . 49 PRO C 1 1 11 6072 1 1 28 PRO CA C 7.345 3.079 -7.456 1.00 . A A . 49 PRO CA 1 1 11 6073 1 1 28 PRO CB C 7.800 3.914 -8.658 1.00 . A A . 49 PRO CB 1 1 11 6074 1 1 28 PRO CD C 7.711 5.335 -6.748 1.00 . A A . 49 PRO CD 1 1 11 6075 1 1 28 PRO CG C 7.440 5.335 -8.251 1.00 . A A . 49 PRO CG 1 1 11 6076 1 1 28 PRO HA H 6.278 2.881 -7.571 1.00 . A A . 49 PRO HA 1 1 11 6077 1 1 28 PRO HB2 H 8.883 3.836 -8.780 1.00 . A A . 49 PRO HB2 1 1 11 6078 1 1 28 PRO HB3 H 7.290 3.616 -9.574 1.00 . A A . 49 PRO HB3 1 1 11 6079 1 1 28 PRO HD2 H 8.749 5.615 -6.569 1.00 . A A . 49 PRO HD2 1 1 11 6080 1 1 28 PRO HD3 H 7.042 6.052 -6.274 1.00 . A A . 49 PRO HD3 1 1 11 6081 1 1 28 PRO HG2 H 8.048 6.076 -8.772 1.00 . A A . 49 PRO HG2 1 1 11 6082 1 1 28 PRO HG3 H 6.379 5.511 -8.433 1.00 . A A . 49 PRO HG3 1 1 11 6083 1 1 28 PRO N N 7.489 3.965 -6.283 1.00 . A A . 49 PRO N 1 1 11 6084 1 1 28 PRO O O 7.664 0.853 -8.274 1.00 . A A . 49 PRO O 1 1 11 6085 1 1 29 GLY C C 10.500 -0.149 -5.280 1.00 . A A . 50 GLY C 1 1 11 6086 1 1 29 GLY CA C 9.829 0.203 -6.616 1.00 . A A . 50 GLY CA 1 1 11 6087 1 1 29 GLY H H 9.421 2.255 -6.104 1.00 . A A . 50 GLY H 1 1 11 6088 1 1 29 GLY HA2 H 10.606 0.222 -7.382 1.00 . A A . 50 GLY HA2 1 1 11 6089 1 1 29 GLY HA3 H 9.146 -0.614 -6.853 1.00 . A A . 50 GLY HA3 1 1 11 6090 1 1 29 GLY N N 9.096 1.483 -6.663 1.00 . A A . 50 GLY N 1 1 11 6091 1 1 29 GLY O O 11.136 -1.200 -5.171 1.00 . A A . 50 GLY O 1 1 11 6092 1 1 30 HIS C C 10.497 -0.750 -2.178 1.00 . A A . 51 HIS C 1 1 11 6093 1 1 30 HIS CA C 10.990 0.507 -2.932 1.00 . A A . 51 HIS CA 1 1 11 6094 1 1 30 HIS CB C 10.730 1.764 -2.081 1.00 . A A . 51 HIS CB 1 1 11 6095 1 1 30 HIS CD2 C 9.146 1.523 -0.091 1.00 . A A . 51 HIS CD2 1 1 11 6096 1 1 30 HIS CE1 C 7.210 1.443 -1.121 1.00 . A A . 51 HIS CE1 1 1 11 6097 1 1 30 HIS CG C 9.370 1.761 -1.421 1.00 . A A . 51 HIS CG 1 1 11 6098 1 1 30 HIS H H 9.835 1.539 -4.401 1.00 . A A . 51 HIS H 1 1 11 6099 1 1 30 HIS HA H 12.067 0.407 -3.075 1.00 . A A . 51 HIS HA 1 1 11 6100 1 1 30 HIS HB2 H 11.488 1.803 -1.297 1.00 . A A . 51 HIS HB2 1 1 11 6101 1 1 30 HIS HB3 H 10.847 2.662 -2.689 1.00 . A A . 51 HIS HB3 1 1 11 6102 1 1 30 HIS HD1 H 7.944 1.860 -3.037 1.00 . A A . 51 HIS HD1 1 1 11 6103 1 1 30 HIS HD2 H 9.912 1.407 0.664 1.00 . A A . 51 HIS HD2 1 1 11 6104 1 1 30 HIS HE1 H 6.154 1.309 -1.322 1.00 . A A . 51 HIS HE1 1 1 11 6105 1 1 30 HIS N N 10.365 0.696 -4.252 1.00 . A A . 51 HIS N 1 1 11 6106 1 1 30 HIS ND1 N 8.139 1.723 -2.046 1.00 . A A . 51 HIS ND1 1 1 11 6107 1 1 30 HIS NE2 N 7.775 1.321 0.088 1.00 . A A . 51 HIS NE2 1 1 11 6108 1 1 30 HIS O O 11.210 -1.310 -1.346 1.00 . A A . 51 HIS O 1 1 11 6109 1 1 31 PHE C C 9.280 -3.573 -1.753 1.00 . A A . 52 PHE C 1 1 11 6110 1 1 31 PHE CA C 8.562 -2.220 -1.681 1.00 . A A . 52 PHE CA 1 1 11 6111 1 1 31 PHE CB C 7.098 -2.299 -2.142 1.00 . A A . 52 PHE CB 1 1 11 6112 1 1 31 PHE CD1 C 6.910 -3.441 -4.407 1.00 . A A . 52 PHE CD1 1 1 11 6113 1 1 31 PHE CD2 C 6.633 -1.026 -4.285 1.00 . A A . 52 PHE CD2 1 1 11 6114 1 1 31 PHE CE1 C 6.716 -3.388 -5.801 1.00 . A A . 52 PHE CE1 1 1 11 6115 1 1 31 PHE CE2 C 6.429 -0.976 -5.673 1.00 . A A . 52 PHE CE2 1 1 11 6116 1 1 31 PHE CG C 6.876 -2.258 -3.645 1.00 . A A . 52 PHE CG 1 1 11 6117 1 1 31 PHE CZ C 6.478 -2.157 -6.434 1.00 . A A . 52 PHE CZ 1 1 11 6118 1 1 31 PHE H H 8.735 -0.690 -3.150 1.00 . A A . 52 PHE H 1 1 11 6119 1 1 31 PHE HA H 8.557 -1.925 -0.631 1.00 . A A . 52 PHE HA 1 1 11 6120 1 1 31 PHE HB2 H 6.650 -3.206 -1.742 1.00 . A A . 52 PHE HB2 1 1 11 6121 1 1 31 PHE HB3 H 6.560 -1.461 -1.697 1.00 . A A . 52 PHE HB3 1 1 11 6122 1 1 31 PHE HD1 H 7.089 -4.395 -3.928 1.00 . A A . 52 PHE HD1 1 1 11 6123 1 1 31 PHE HD2 H 6.575 -0.114 -3.709 1.00 . A A . 52 PHE HD2 1 1 11 6124 1 1 31 PHE HE1 H 6.753 -4.299 -6.384 1.00 . A A . 52 PHE HE1 1 1 11 6125 1 1 31 PHE HE2 H 6.223 -0.030 -6.154 1.00 . A A . 52 PHE HE2 1 1 11 6126 1 1 31 PHE HZ H 6.324 -2.117 -7.505 1.00 . A A . 52 PHE HZ 1 1 11 6127 1 1 31 PHE N N 9.259 -1.182 -2.443 1.00 . A A . 52 PHE N 1 1 11 6128 1 1 31 PHE O O 9.476 -4.213 -0.719 1.00 . A A . 52 PHE O 1 1 11 6129 1 1 32 SER C C 11.906 -5.260 -2.435 1.00 . A A . 53 SER C 1 1 11 6130 1 1 32 SER CA C 10.557 -5.184 -3.173 1.00 . A A . 53 SER CA 1 1 11 6131 1 1 32 SER CB C 10.799 -5.354 -4.679 1.00 . A A . 53 SER CB 1 1 11 6132 1 1 32 SER H H 9.571 -3.381 -3.737 1.00 . A A . 53 SER H 1 1 11 6133 1 1 32 SER HA H 9.961 -6.032 -2.832 1.00 . A A . 53 SER HA 1 1 11 6134 1 1 32 SER HB2 H 11.415 -4.529 -5.043 1.00 . A A . 53 SER HB2 1 1 11 6135 1 1 32 SER HB3 H 11.327 -6.292 -4.859 1.00 . A A . 53 SER HB3 1 1 11 6136 1 1 32 SER HG H 9.755 -5.524 -6.330 1.00 . A A . 53 SER HG 1 1 11 6137 1 1 32 SER N N 9.783 -3.953 -2.930 1.00 . A A . 53 SER N 1 1 11 6138 1 1 32 SER O O 12.585 -6.287 -2.512 1.00 . A A . 53 SER O 1 1 11 6139 1 1 32 SER OG O 9.566 -5.374 -5.383 1.00 . A A . 53 SER OG 1 1 11 6140 1 1 33 LYS C C 13.346 -3.506 0.494 1.00 . A A . 54 LYS C 1 1 11 6141 1 1 33 LYS CA C 13.539 -4.112 -0.910 1.00 . A A . 54 LYS CA 1 1 11 6142 1 1 33 LYS CB C 14.624 -3.386 -1.734 1.00 . A A . 54 LYS CB 1 1 11 6143 1 1 33 LYS CD C 15.427 -1.172 -2.760 1.00 . A A . 54 LYS CD 1 1 11 6144 1 1 33 LYS CE C 15.748 -1.741 -4.148 1.00 . A A . 54 LYS CE 1 1 11 6145 1 1 33 LYS CG C 14.274 -1.923 -2.077 1.00 . A A . 54 LYS CG 1 1 11 6146 1 1 33 LYS H H 11.711 -3.376 -1.740 1.00 . A A . 54 LYS H 1 1 11 6147 1 1 33 LYS HA H 13.905 -5.124 -0.728 1.00 . A A . 54 LYS HA 1 1 11 6148 1 1 33 LYS HB2 H 15.562 -3.404 -1.177 1.00 . A A . 54 LYS HB2 1 1 11 6149 1 1 33 LYS HB3 H 14.781 -3.940 -2.660 1.00 . A A . 54 LYS HB3 1 1 11 6150 1 1 33 LYS HD2 H 15.138 -0.125 -2.861 1.00 . A A . 54 LYS HD2 1 1 11 6151 1 1 33 LYS HD3 H 16.313 -1.223 -2.123 1.00 . A A . 54 LYS HD3 1 1 11 6152 1 1 33 LYS HE2 H 16.029 -2.793 -4.046 1.00 . A A . 54 LYS HE2 1 1 11 6153 1 1 33 LYS HE3 H 14.845 -1.693 -4.764 1.00 . A A . 54 LYS HE3 1 1 11 6154 1 1 33 LYS HG2 H 13.407 -1.902 -2.737 1.00 . A A . 54 LYS HG2 1 1 11 6155 1 1 33 LYS HG3 H 14.024 -1.391 -1.159 1.00 . A A . 54 LYS HG3 1 1 11 6156 1 1 33 LYS HZ1 H 16.614 -0.013 -4.921 1.00 . A A . 54 LYS HZ1 1 1 11 6157 1 1 33 LYS HZ2 H 17.702 -1.037 -4.258 1.00 . A A . 54 LYS HZ2 1 1 11 6158 1 1 33 LYS HZ3 H 17.055 -1.366 -5.717 1.00 . A A . 54 LYS HZ3 1 1 11 6159 1 1 33 LYS N N 12.302 -4.200 -1.710 1.00 . A A . 54 LYS N 1 1 11 6160 1 1 33 LYS NZ N 16.851 -0.990 -4.802 1.00 . A A . 54 LYS NZ 1 1 11 6161 1 1 33 LYS O O 14.339 -3.230 1.171 1.00 . A A . 54 LYS O 1 1 11 6162 1 1 34 GLN C C 10.465 -3.225 2.867 1.00 . A A . 55 GLN C 1 1 11 6163 1 1 34 GLN CA C 11.803 -2.737 2.274 1.00 . A A . 55 GLN CA 1 1 11 6164 1 1 34 GLN CB C 11.825 -1.197 2.177 1.00 . A A . 55 GLN CB 1 1 11 6165 1 1 34 GLN CD C 11.665 0.996 3.440 1.00 . A A . 55 GLN CD 1 1 11 6166 1 1 34 GLN CG C 11.740 -0.525 3.556 1.00 . A A . 55 GLN CG 1 1 11 6167 1 1 34 GLN H H 11.332 -3.585 0.356 1.00 . A A . 55 GLN H 1 1 11 6168 1 1 34 GLN HA H 12.587 -3.044 2.968 1.00 . A A . 55 GLN HA 1 1 11 6169 1 1 34 GLN HB2 H 12.753 -0.878 1.700 1.00 . A A . 55 GLN HB2 1 1 11 6170 1 1 34 GLN HB3 H 10.994 -0.856 1.557 1.00 . A A . 55 GLN HB3 1 1 11 6171 1 1 34 GLN HE21 H 9.647 0.980 3.488 1.00 . A A . 55 GLN HE21 1 1 11 6172 1 1 34 GLN HE22 H 10.408 2.563 3.374 1.00 . A A . 55 GLN HE22 1 1 11 6173 1 1 34 GLN HG2 H 10.857 -0.878 4.090 1.00 . A A . 55 GLN HG2 1 1 11 6174 1 1 34 GLN HG3 H 12.619 -0.792 4.144 1.00 . A A . 55 GLN HG3 1 1 11 6175 1 1 34 GLN N N 12.101 -3.300 0.946 1.00 . A A . 55 GLN N 1 1 11 6176 1 1 34 GLN NE2 N 10.476 1.561 3.436 1.00 . A A . 55 GLN NE2 1 1 11 6177 1 1 34 GLN O O 10.458 -3.813 3.951 1.00 . A A . 55 GLN O 1 1 11 6178 1 1 34 GLN OE1 O 12.664 1.697 3.353 1.00 . A A . 55 GLN OE1 1 1 11 6179 1 1 35 CYS C C 7.270 -4.415 2.370 1.00 . A A . 56 CYS C 1 1 11 6180 1 1 35 CYS CA C 7.992 -3.105 2.743 1.00 . A A . 56 CYS CA 1 1 11 6181 1 1 35 CYS CB C 7.173 -1.877 2.312 1.00 . A A . 56 CYS CB 1 1 11 6182 1 1 35 CYS H H 9.433 -2.460 1.317 1.00 . A A . 56 CYS H 1 1 11 6183 1 1 35 CYS HA H 8.062 -3.081 3.832 1.00 . A A . 56 CYS HA 1 1 11 6184 1 1 35 CYS HB2 H 7.092 -1.844 1.223 1.00 . A A . 56 CYS HB2 1 1 11 6185 1 1 35 CYS HB3 H 6.165 -1.961 2.726 1.00 . A A . 56 CYS HB3 1 1 11 6186 1 1 35 CYS N N 9.344 -2.981 2.176 1.00 . A A . 56 CYS N 1 1 11 6187 1 1 35 CYS O O 6.293 -4.791 3.024 1.00 . A A . 56 CYS O 1 1 11 6188 1 1 35 CYS SG S 7.957 -0.367 2.940 1.00 . A A . 56 CYS SG 1 1 11 6189 1 1 36 ARG C C 8.198 -7.398 0.353 1.00 . A A . 57 ARG C 1 1 11 6190 1 1 36 ARG CA C 7.145 -6.349 0.774 1.00 . A A . 57 ARG CA 1 1 11 6191 1 1 36 ARG CB C 6.222 -5.970 -0.410 1.00 . A A . 57 ARG CB 1 1 11 6192 1 1 36 ARG CD C 3.704 -5.969 0.107 1.00 . A A . 57 ARG CD 1 1 11 6193 1 1 36 ARG CG C 4.903 -6.766 -0.434 1.00 . A A . 57 ARG CG 1 1 11 6194 1 1 36 ARG CZ C 3.158 -4.572 2.107 1.00 . A A . 57 ARG CZ 1 1 11 6195 1 1 36 ARG H H 8.510 -4.700 0.819 1.00 . A A . 57 ARG H 1 1 11 6196 1 1 36 ARG HA H 6.557 -6.831 1.558 1.00 . A A . 57 ARG HA 1 1 11 6197 1 1 36 ARG HB2 H 5.982 -4.906 -0.374 1.00 . A A . 57 ARG HB2 1 1 11 6198 1 1 36 ARG HB3 H 6.758 -6.136 -1.346 1.00 . A A . 57 ARG HB3 1 1 11 6199 1 1 36 ARG HD2 H 3.486 -5.165 -0.598 1.00 . A A . 57 ARG HD2 1 1 11 6200 1 1 36 ARG HD3 H 2.834 -6.630 0.146 1.00 . A A . 57 ARG HD3 1 1 11 6201 1 1 36 ARG HE H 4.861 -5.531 1.856 1.00 . A A . 57 ARG HE 1 1 11 6202 1 1 36 ARG HG2 H 4.682 -7.036 -1.467 1.00 . A A . 57 ARG HG2 1 1 11 6203 1 1 36 ARG HG3 H 5.009 -7.693 0.132 1.00 . A A . 57 ARG HG3 1 1 11 6204 1 1 36 ARG HH11 H 1.659 -4.608 0.793 1.00 . A A . 57 ARG HH11 1 1 11 6205 1 1 36 ARG HH12 H 1.483 -3.478 2.111 1.00 . A A . 57 ARG HH12 1 1 11 6206 1 1 36 ARG HH21 H 4.511 -4.237 3.526 1.00 . A A . 57 ARG HH21 1 1 11 6207 1 1 36 ARG HH22 H 2.953 -3.456 3.762 1.00 . A A . 57 ARG HH22 1 1 11 6208 1 1 36 ARG N N 7.736 -5.115 1.329 1.00 . A A . 57 ARG N 1 1 11 6209 1 1 36 ARG NE N 3.950 -5.388 1.440 1.00 . A A . 57 ARG NE 1 1 11 6210 1 1 36 ARG NH1 N 1.968 -4.260 1.691 1.00 . A A . 57 ARG NH1 1 1 11 6211 1 1 36 ARG NH2 N 3.567 -4.035 3.215 1.00 . A A . 57 ARG NH2 1 1 11 6212 1 1 36 ARG O O 7.837 -8.442 -0.196 1.00 . A A . 57 ARG O 1 1 11 6213 1 1 37 SER C C 10.533 -9.358 1.120 1.00 . A A . 58 SER C 1 1 11 6214 1 1 37 SER CA C 10.644 -8.005 0.398 1.00 . A A . 58 SER CA 1 1 11 6215 1 1 37 SER CB C 11.933 -7.277 0.795 1.00 . A A . 58 SER CB 1 1 11 6216 1 1 37 SER H H 9.672 -6.248 1.074 1.00 . A A . 58 SER H 1 1 11 6217 1 1 37 SER HA H 10.717 -8.232 -0.666 1.00 . A A . 58 SER HA 1 1 11 6218 1 1 37 SER HB2 H 12.762 -7.990 0.842 1.00 . A A . 58 SER HB2 1 1 11 6219 1 1 37 SER HB3 H 12.169 -6.538 0.031 1.00 . A A . 58 SER HB3 1 1 11 6220 1 1 37 SER HG H 11.558 -7.269 2.720 1.00 . A A . 58 SER HG 1 1 11 6221 1 1 37 SER N N 9.482 -7.118 0.602 1.00 . A A . 58 SER N 1 1 11 6222 1 1 37 SER O O 10.865 -10.388 0.491 1.00 . A A . 58 SER O 1 1 11 6223 1 1 37 SER OXT O 10.138 -9.388 2.308 1.00 . A A . 58 SER OXT 1 1 11 6224 1 1 37 SER OG O 11.784 -6.606 2.037 1.00 . A A . 58 SER OG 1 1 11 6225 2 2 1 ZN ZN ZN -8.416 0.262 3.567 1.00 . B A . 1059 ZN ZN 1 1 11 6226 3 2 1 ZN ZN ZN 6.887 1.215 1.944 1.00 . C A . 1060 ZN ZN 1 1 12 6227 1 1 1 GLN C C -6.189 -1.480 -4.496 1.00 . A A . 22 GLN C 1 1 12 6228 1 1 1 GLN CA C -5.980 -1.051 -5.947 1.00 . A A . 22 GLN CA 1 1 12 6229 1 1 1 GLN CB C -4.539 -0.523 -6.149 1.00 . A A . 22 GLN CB 1 1 12 6230 1 1 1 GLN CD C -4.503 0.211 -8.646 1.00 . A A . 22 GLN CD 1 1 12 6231 1 1 1 GLN CG C -3.960 -0.726 -7.565 1.00 . A A . 22 GLN CG 1 1 12 6232 1 1 1 GLN H1 H -6.960 0.748 -5.686 1.00 . A A . 22 GLN H1 1 1 12 6233 1 1 1 GLN H2 H -6.879 0.274 -7.257 1.00 . A A . 22 GLN H2 1 1 12 6234 1 1 1 GLN H3 H -7.941 -0.450 -6.220 1.00 . A A . 22 GLN H3 1 1 12 6235 1 1 1 GLN HA H -6.109 -1.936 -6.573 1.00 . A A . 22 GLN HA 1 1 12 6236 1 1 1 GLN HB2 H -4.475 0.530 -5.867 1.00 . A A . 22 GLN HB2 1 1 12 6237 1 1 1 GLN HB3 H -3.883 -1.075 -5.474 1.00 . A A . 22 GLN HB3 1 1 12 6238 1 1 1 GLN HE21 H -2.917 -0.090 -9.868 1.00 . A A . 22 GLN HE21 1 1 12 6239 1 1 1 GLN HE22 H -4.169 1.003 -10.450 1.00 . A A . 22 GLN HE22 1 1 12 6240 1 1 1 GLN HG2 H -2.881 -0.569 -7.502 1.00 . A A . 22 GLN HG2 1 1 12 6241 1 1 1 GLN HG3 H -4.116 -1.758 -7.880 1.00 . A A . 22 GLN HG3 1 1 12 6242 1 1 1 GLN N N -7.015 -0.050 -6.309 1.00 . A A . 22 GLN N 1 1 12 6243 1 1 1 GLN NE2 N -3.799 0.387 -9.741 1.00 . A A . 22 GLN NE2 1 1 12 6244 1 1 1 GLN O O -6.292 -0.626 -3.621 1.00 . A A . 22 GLN O 1 1 12 6245 1 1 1 GLN OE1 O -5.570 0.797 -8.535 1.00 . A A . 22 GLN OE1 1 1 12 6246 1 1 2 THR C C -5.892 -2.829 -1.737 1.00 . A A . 23 THR C 1 1 12 6247 1 1 2 THR CA C -6.681 -3.370 -2.934 1.00 . A A . 23 THR CA 1 1 12 6248 1 1 2 THR CB C -6.556 -4.904 -2.990 1.00 . A A . 23 THR CB 1 1 12 6249 1 1 2 THR CG2 C -7.258 -5.611 -1.832 1.00 . A A . 23 THR CG2 1 1 12 6250 1 1 2 THR H H -6.202 -3.447 -4.997 1.00 . A A . 23 THR H 1 1 12 6251 1 1 2 THR HA H -7.727 -3.134 -2.772 1.00 . A A . 23 THR HA 1 1 12 6252 1 1 2 THR HB H -5.501 -5.179 -2.997 1.00 . A A . 23 THR HB 1 1 12 6253 1 1 2 THR HG1 H -7.043 -6.339 -4.216 1.00 . A A . 23 THR HG1 1 1 12 6254 1 1 2 THR HG21 H -8.321 -5.371 -1.842 1.00 . A A . 23 THR HG21 1 1 12 6255 1 1 2 THR HG22 H -7.138 -6.689 -1.934 1.00 . A A . 23 THR HG22 1 1 12 6256 1 1 2 THR HG23 H -6.821 -5.308 -0.881 1.00 . A A . 23 THR HG23 1 1 12 6257 1 1 2 THR N N -6.288 -2.786 -4.234 1.00 . A A . 23 THR N 1 1 12 6258 1 1 2 THR O O -4.663 -2.769 -1.776 1.00 . A A . 23 THR O 1 1 12 6259 1 1 2 THR OG1 O -7.159 -5.374 -4.177 1.00 . A A . 23 THR OG1 1 1 12 6260 1 1 3 CYS C C -4.962 -2.844 1.215 1.00 . A A . 24 CYS C 1 1 12 6261 1 1 3 CYS CA C -6.045 -1.944 0.590 1.00 . A A . 24 CYS CA 1 1 12 6262 1 1 3 CYS CB C -7.201 -1.792 1.579 1.00 . A A . 24 CYS CB 1 1 12 6263 1 1 3 CYS H H -7.610 -2.496 -0.737 1.00 . A A . 24 CYS H 1 1 12 6264 1 1 3 CYS HA H -5.620 -0.957 0.392 1.00 . A A . 24 CYS HA 1 1 12 6265 1 1 3 CYS HB2 H -8.051 -1.333 1.082 1.00 . A A . 24 CYS HB2 1 1 12 6266 1 1 3 CYS HB3 H -7.506 -2.779 1.925 1.00 . A A . 24 CYS HB3 1 1 12 6267 1 1 3 CYS N N -6.603 -2.465 -0.662 1.00 . A A . 24 CYS N 1 1 12 6268 1 1 3 CYS O O -5.068 -4.073 1.183 1.00 . A A . 24 CYS O 1 1 12 6269 1 1 3 CYS SG S -6.682 -0.769 2.982 1.00 . A A . 24 CYS SG 1 1 12 6270 1 1 4 TYR C C -3.664 -3.587 4.000 1.00 . A A . 25 TYR C 1 1 12 6271 1 1 4 TYR CA C -3.029 -2.926 2.757 1.00 . A A . 25 TYR CA 1 1 12 6272 1 1 4 TYR CB C -1.892 -1.973 3.171 1.00 . A A . 25 TYR CB 1 1 12 6273 1 1 4 TYR CD1 C -3.261 -0.229 4.431 1.00 . A A . 25 TYR CD1 1 1 12 6274 1 1 4 TYR CD2 C -1.300 -1.184 5.511 1.00 . A A . 25 TYR CD2 1 1 12 6275 1 1 4 TYR CE1 C -3.516 0.544 5.577 1.00 . A A . 25 TYR CE1 1 1 12 6276 1 1 4 TYR CE2 C -1.541 -0.395 6.655 1.00 . A A . 25 TYR CE2 1 1 12 6277 1 1 4 TYR CG C -2.156 -1.101 4.393 1.00 . A A . 25 TYR CG 1 1 12 6278 1 1 4 TYR CZ C -2.655 0.471 6.691 1.00 . A A . 25 TYR CZ 1 1 12 6279 1 1 4 TYR H H -3.971 -1.215 1.878 1.00 . A A . 25 TYR H 1 1 12 6280 1 1 4 TYR HA H -2.587 -3.734 2.175 1.00 . A A . 25 TYR HA 1 1 12 6281 1 1 4 TYR HB2 H -1.021 -2.594 3.381 1.00 . A A . 25 TYR HB2 1 1 12 6282 1 1 4 TYR HB3 H -1.624 -1.332 2.331 1.00 . A A . 25 TYR HB3 1 1 12 6283 1 1 4 TYR HD1 H -3.933 -0.154 3.590 1.00 . A A . 25 TYR HD1 1 1 12 6284 1 1 4 TYR HD2 H -0.451 -1.856 5.494 1.00 . A A . 25 TYR HD2 1 1 12 6285 1 1 4 TYR HE1 H -4.382 1.182 5.612 1.00 . A A . 25 TYR HE1 1 1 12 6286 1 1 4 TYR HE2 H -0.880 -0.458 7.507 1.00 . A A . 25 TYR HE2 1 1 12 6287 1 1 4 TYR HH H -2.270 1.072 8.503 1.00 . A A . 25 TYR HH 1 1 12 6288 1 1 4 TYR N N -3.981 -2.228 1.883 1.00 . A A . 25 TYR N 1 1 12 6289 1 1 4 TYR O O -3.018 -4.422 4.637 1.00 . A A . 25 TYR O 1 1 12 6290 1 1 4 TYR OH O -2.915 1.230 7.792 1.00 . A A . 25 TYR OH 1 1 12 6291 1 1 5 ASN C C -7.056 -4.018 5.447 1.00 . A A . 26 ASN C 1 1 12 6292 1 1 5 ASN CA C -5.560 -3.663 5.598 1.00 . A A . 26 ASN CA 1 1 12 6293 1 1 5 ASN CB C -5.345 -2.547 6.637 1.00 . A A . 26 ASN CB 1 1 12 6294 1 1 5 ASN CG C -5.857 -2.934 8.015 1.00 . A A . 26 ASN CG 1 1 12 6295 1 1 5 ASN H H -5.367 -2.521 3.796 1.00 . A A . 26 ASN H 1 1 12 6296 1 1 5 ASN HA H -5.068 -4.565 5.966 1.00 . A A . 26 ASN HA 1 1 12 6297 1 1 5 ASN HB2 H -4.282 -2.321 6.715 1.00 . A A . 26 ASN HB2 1 1 12 6298 1 1 5 ASN HB3 H -5.859 -1.641 6.315 1.00 . A A . 26 ASN HB3 1 1 12 6299 1 1 5 ASN HD21 H -4.189 -3.998 8.434 1.00 . A A . 26 ASN HD21 1 1 12 6300 1 1 5 ASN HD22 H -5.427 -3.959 9.680 1.00 . A A . 26 ASN HD22 1 1 12 6301 1 1 5 ASN N N -4.909 -3.232 4.355 1.00 . A A . 26 ASN N 1 1 12 6302 1 1 5 ASN ND2 N -5.093 -3.697 8.765 1.00 . A A . 26 ASN ND2 1 1 12 6303 1 1 5 ASN O O -7.497 -5.022 6.013 1.00 . A A . 26 ASN O 1 1 12 6304 1 1 5 ASN OD1 O -6.946 -2.564 8.430 1.00 . A A . 26 ASN OD1 1 1 12 6305 1 1 6 CYS C C -9.645 -4.639 3.571 1.00 . A A . 27 CYS C 1 1 12 6306 1 1 6 CYS CA C -9.275 -3.449 4.489 1.00 . A A . 27 CYS CA 1 1 12 6307 1 1 6 CYS CB C -9.898 -2.150 3.943 1.00 . A A . 27 CYS CB 1 1 12 6308 1 1 6 CYS H H -7.428 -2.417 4.261 1.00 . A A . 27 CYS H 1 1 12 6309 1 1 6 CYS HA H -9.714 -3.643 5.469 1.00 . A A . 27 CYS HA 1 1 12 6310 1 1 6 CYS HB2 H -9.522 -1.958 2.938 1.00 . A A . 27 CYS HB2 1 1 12 6311 1 1 6 CYS HB3 H -10.980 -2.288 3.871 1.00 . A A . 27 CYS HB3 1 1 12 6312 1 1 6 CYS N N -7.829 -3.250 4.668 1.00 . A A . 27 CYS N 1 1 12 6313 1 1 6 CYS O O -10.801 -5.067 3.560 1.00 . A A . 27 CYS O 1 1 12 6314 1 1 6 CYS SG S -9.557 -0.732 5.026 1.00 . A A . 27 CYS SG 1 1 12 6315 1 1 7 GLY C C -9.954 -5.879 0.709 1.00 . A A . 28 GLY C 1 1 12 6316 1 1 7 GLY CA C -8.927 -6.232 1.799 1.00 . A A . 28 GLY CA 1 1 12 6317 1 1 7 GLY H H -7.755 -4.799 2.875 1.00 . A A . 28 GLY H 1 1 12 6318 1 1 7 GLY HA2 H -9.269 -7.126 2.320 1.00 . A A . 28 GLY HA2 1 1 12 6319 1 1 7 GLY HA3 H -7.983 -6.464 1.305 1.00 . A A . 28 GLY HA3 1 1 12 6320 1 1 7 GLY N N -8.693 -5.161 2.782 1.00 . A A . 28 GLY N 1 1 12 6321 1 1 7 GLY O O -10.689 -6.755 0.246 1.00 . A A . 28 GLY O 1 1 12 6322 1 1 8 LYS C C -10.508 -3.350 -1.779 1.00 . A A . 29 LYS C 1 1 12 6323 1 1 8 LYS CA C -11.095 -4.008 -0.512 1.00 . A A . 29 LYS CA 1 1 12 6324 1 1 8 LYS CB C -11.867 -3.010 0.378 1.00 . A A . 29 LYS CB 1 1 12 6325 1 1 8 LYS CD C -14.235 -3.304 -0.550 1.00 . A A . 29 LYS CD 1 1 12 6326 1 1 8 LYS CE C -15.457 -2.544 -1.080 1.00 . A A . 29 LYS CE 1 1 12 6327 1 1 8 LYS CG C -13.077 -2.330 -0.284 1.00 . A A . 29 LYS CG 1 1 12 6328 1 1 8 LYS H H -9.369 -3.961 0.743 1.00 . A A . 29 LYS H 1 1 12 6329 1 1 8 LYS HA H -11.796 -4.791 -0.795 1.00 . A A . 29 LYS HA 1 1 12 6330 1 1 8 LYS HB2 H -12.214 -3.531 1.274 1.00 . A A . 29 LYS HB2 1 1 12 6331 1 1 8 LYS HB3 H -11.177 -2.237 0.712 1.00 . A A . 29 LYS HB3 1 1 12 6332 1 1 8 LYS HD2 H -13.928 -4.053 -1.283 1.00 . A A . 29 LYS HD2 1 1 12 6333 1 1 8 LYS HD3 H -14.500 -3.808 0.382 1.00 . A A . 29 LYS HD3 1 1 12 6334 1 1 8 LYS HE2 H -15.733 -1.775 -0.352 1.00 . A A . 29 LYS HE2 1 1 12 6335 1 1 8 LYS HE3 H -15.184 -2.037 -2.010 1.00 . A A . 29 LYS HE3 1 1 12 6336 1 1 8 LYS HG2 H -13.432 -1.550 0.392 1.00 . A A . 29 LYS HG2 1 1 12 6337 1 1 8 LYS HG3 H -12.774 -1.853 -1.215 1.00 . A A . 29 LYS HG3 1 1 12 6338 1 1 8 LYS HZ1 H -16.888 -3.920 -0.463 1.00 . A A . 29 LYS HZ1 1 1 12 6339 1 1 8 LYS HZ2 H -17.410 -2.943 -1.659 1.00 . A A . 29 LYS HZ2 1 1 12 6340 1 1 8 LYS HZ3 H -16.386 -4.164 -1.999 1.00 . A A . 29 LYS HZ3 1 1 12 6341 1 1 8 LYS N N -10.028 -4.597 0.319 1.00 . A A . 29 LYS N 1 1 12 6342 1 1 8 LYS NZ N -16.608 -3.454 -1.315 1.00 . A A . 29 LYS NZ 1 1 12 6343 1 1 8 LYS O O -9.761 -2.379 -1.632 1.00 . A A . 29 LYS O 1 1 12 6344 1 1 9 PRO C C -10.305 -1.858 -4.548 1.00 . A A . 30 PRO C 1 1 12 6345 1 1 9 PRO CA C -10.232 -3.368 -4.275 1.00 . A A . 30 PRO CA 1 1 12 6346 1 1 9 PRO CB C -10.972 -4.141 -5.372 1.00 . A A . 30 PRO CB 1 1 12 6347 1 1 9 PRO CD C -11.591 -5.052 -3.259 1.00 . A A . 30 PRO CD 1 1 12 6348 1 1 9 PRO CG C -11.298 -5.467 -4.698 1.00 . A A . 30 PRO CG 1 1 12 6349 1 1 9 PRO HA H -9.185 -3.666 -4.314 1.00 . A A . 30 PRO HA 1 1 12 6350 1 1 9 PRO HB2 H -11.903 -3.633 -5.634 1.00 . A A . 30 PRO HB2 1 1 12 6351 1 1 9 PRO HB3 H -10.351 -4.281 -6.259 1.00 . A A . 30 PRO HB3 1 1 12 6352 1 1 9 PRO HD2 H -12.652 -4.818 -3.158 1.00 . A A . 30 PRO HD2 1 1 12 6353 1 1 9 PRO HD3 H -11.318 -5.867 -2.588 1.00 . A A . 30 PRO HD3 1 1 12 6354 1 1 9 PRO HG2 H -12.153 -5.959 -5.160 1.00 . A A . 30 PRO HG2 1 1 12 6355 1 1 9 PRO HG3 H -10.419 -6.114 -4.720 1.00 . A A . 30 PRO HG3 1 1 12 6356 1 1 9 PRO N N -10.800 -3.849 -3.002 1.00 . A A . 30 PRO N 1 1 12 6357 1 1 9 PRO O O -9.381 -1.299 -5.143 1.00 . A A . 30 PRO O 1 1 12 6358 1 1 10 GLY C C -10.819 1.236 -3.531 1.00 . A A . 31 GLY C 1 1 12 6359 1 1 10 GLY CA C -11.655 0.239 -4.348 1.00 . A A . 31 GLY CA 1 1 12 6360 1 1 10 GLY H H -12.084 -1.718 -3.623 1.00 . A A . 31 GLY H 1 1 12 6361 1 1 10 GLY HA2 H -12.708 0.432 -4.141 1.00 . A A . 31 GLY HA2 1 1 12 6362 1 1 10 GLY HA3 H -11.478 0.450 -5.403 1.00 . A A . 31 GLY HA3 1 1 12 6363 1 1 10 GLY N N -11.370 -1.184 -4.096 1.00 . A A . 31 GLY N 1 1 12 6364 1 1 10 GLY O O -11.310 2.310 -3.174 1.00 . A A . 31 GLY O 1 1 12 6365 1 1 11 HIS C C -7.645 2.480 -3.290 1.00 . A A . 32 HIS C 1 1 12 6366 1 1 11 HIS CA C -8.653 1.712 -2.423 1.00 . A A . 32 HIS CA 1 1 12 6367 1 1 11 HIS CB C -7.972 0.858 -1.345 1.00 . A A . 32 HIS CB 1 1 12 6368 1 1 11 HIS CD2 C -8.429 1.422 1.107 1.00 . A A . 32 HIS CD2 1 1 12 6369 1 1 11 HIS CE1 C -10.342 0.388 1.401 1.00 . A A . 32 HIS CE1 1 1 12 6370 1 1 11 HIS CG C -8.767 0.822 -0.072 1.00 . A A . 32 HIS CG 1 1 12 6371 1 1 11 HIS H H -9.232 -0.006 -3.542 1.00 . A A . 32 HIS H 1 1 12 6372 1 1 11 HIS HA H -9.232 2.474 -1.906 1.00 . A A . 32 HIS HA 1 1 12 6373 1 1 11 HIS HB2 H -7.843 -0.163 -1.701 1.00 . A A . 32 HIS HB2 1 1 12 6374 1 1 11 HIS HB3 H -6.983 1.259 -1.120 1.00 . A A . 32 HIS HB3 1 1 12 6375 1 1 11 HIS HD1 H -10.442 -0.402 -0.553 1.00 . A A . 32 HIS HD1 1 1 12 6376 1 1 11 HIS HD2 H -7.541 2.013 1.271 1.00 . A A . 32 HIS HD2 1 1 12 6377 1 1 11 HIS HE1 H -11.245 -0.008 1.855 1.00 . A A . 32 HIS HE1 1 1 12 6378 1 1 11 HIS N N -9.575 0.880 -3.198 1.00 . A A . 32 HIS N 1 1 12 6379 1 1 11 HIS ND1 N -9.965 0.179 0.128 1.00 . A A . 32 HIS ND1 1 1 12 6380 1 1 11 HIS NE2 N -9.422 1.125 2.050 1.00 . A A . 32 HIS NE2 1 1 12 6381 1 1 11 HIS O O -7.344 2.122 -4.431 1.00 . A A . 32 HIS O 1 1 12 6382 1 1 12 LEU C C -5.482 5.267 -2.145 1.00 . A A . 33 LEU C 1 1 12 6383 1 1 12 LEU CA C -6.292 4.611 -3.282 1.00 . A A . 33 LEU CA 1 1 12 6384 1 1 12 LEU CB C -7.175 5.688 -3.959 1.00 . A A . 33 LEU CB 1 1 12 6385 1 1 12 LEU CD1 C -8.819 6.423 -5.701 1.00 . A A . 33 LEU CD1 1 1 12 6386 1 1 12 LEU CD2 C -6.966 4.928 -6.380 1.00 . A A . 33 LEU CD2 1 1 12 6387 1 1 12 LEU CG C -7.924 5.271 -5.238 1.00 . A A . 33 LEU CG 1 1 12 6388 1 1 12 LEU H H -7.403 3.723 -1.739 1.00 . A A . 33 LEU H 1 1 12 6389 1 1 12 LEU HA H -5.593 4.176 -3.999 1.00 . A A . 33 LEU HA 1 1 12 6390 1 1 12 LEU HB2 H -7.910 6.032 -3.228 1.00 . A A . 33 LEU HB2 1 1 12 6391 1 1 12 LEU HB3 H -6.552 6.548 -4.214 1.00 . A A . 33 LEU HB3 1 1 12 6392 1 1 12 LEU HD11 H -9.538 6.665 -4.918 1.00 . A A . 33 LEU HD11 1 1 12 6393 1 1 12 LEU HD12 H -8.217 7.304 -5.921 1.00 . A A . 33 LEU HD12 1 1 12 6394 1 1 12 LEU HD13 H -9.367 6.127 -6.595 1.00 . A A . 33 LEU HD13 1 1 12 6395 1 1 12 LEU HD21 H -6.309 5.772 -6.587 1.00 . A A . 33 LEU HD21 1 1 12 6396 1 1 12 LEU HD22 H -6.366 4.058 -6.117 1.00 . A A . 33 LEU HD22 1 1 12 6397 1 1 12 LEU HD23 H -7.535 4.688 -7.278 1.00 . A A . 33 LEU HD23 1 1 12 6398 1 1 12 LEU HG H -8.566 4.416 -5.033 1.00 . A A . 33 LEU HG 1 1 12 6399 1 1 12 LEU N N -7.155 3.575 -2.708 1.00 . A A . 33 LEU N 1 1 12 6400 1 1 12 LEU O O -5.795 5.073 -0.966 1.00 . A A . 33 LEU O 1 1 12 6401 1 1 13 SER C C -4.491 7.862 -0.615 1.00 . A A . 34 SER C 1 1 12 6402 1 1 13 SER CA C -3.709 6.963 -1.595 1.00 . A A . 34 SER CA 1 1 12 6403 1 1 13 SER CB C -2.794 7.856 -2.441 1.00 . A A . 34 SER CB 1 1 12 6404 1 1 13 SER H H -4.306 6.202 -3.485 1.00 . A A . 34 SER H 1 1 12 6405 1 1 13 SER HA H -3.084 6.303 -0.993 1.00 . A A . 34 SER HA 1 1 12 6406 1 1 13 SER HB2 H -3.406 8.520 -3.054 1.00 . A A . 34 SER HB2 1 1 12 6407 1 1 13 SER HB3 H -2.165 8.464 -1.788 1.00 . A A . 34 SER HB3 1 1 12 6408 1 1 13 SER HG H -1.485 7.645 -3.887 1.00 . A A . 34 SER HG 1 1 12 6409 1 1 13 SER N N -4.525 6.127 -2.501 1.00 . A A . 34 SER N 1 1 12 6410 1 1 13 SER O O -3.898 8.399 0.324 1.00 . A A . 34 SER O 1 1 12 6411 1 1 13 SER OG O -1.974 7.057 -3.278 1.00 . A A . 34 SER OG 1 1 12 6412 1 1 14 SER C C -7.864 7.997 0.638 1.00 . A A . 35 SER C 1 1 12 6413 1 1 14 SER CA C -6.716 8.822 0.025 1.00 . A A . 35 SER CA 1 1 12 6414 1 1 14 SER CB C -7.284 9.995 -0.790 1.00 . A A . 35 SER CB 1 1 12 6415 1 1 14 SER H H -6.188 7.616 -1.654 1.00 . A A . 35 SER H 1 1 12 6416 1 1 14 SER HA H -6.159 9.241 0.864 1.00 . A A . 35 SER HA 1 1 12 6417 1 1 14 SER HB2 H -7.917 9.600 -1.586 1.00 . A A . 35 SER HB2 1 1 12 6418 1 1 14 SER HB3 H -7.898 10.626 -0.144 1.00 . A A . 35 SER HB3 1 1 12 6419 1 1 14 SER HG H -5.767 11.233 -0.649 1.00 . A A . 35 SER HG 1 1 12 6420 1 1 14 SER N N -5.804 8.022 -0.816 1.00 . A A . 35 SER N 1 1 12 6421 1 1 14 SER O O -8.711 8.554 1.338 1.00 . A A . 35 SER O 1 1 12 6422 1 1 14 SER OG O -6.250 10.781 -1.367 1.00 . A A . 35 SER OG 1 1 12 6423 1 1 15 GLN C C -8.298 5.121 2.297 1.00 . A A . 36 GLN C 1 1 12 6424 1 1 15 GLN CA C -8.872 5.752 1.008 1.00 . A A . 36 GLN CA 1 1 12 6425 1 1 15 GLN CB C -9.246 4.680 -0.033 1.00 . A A . 36 GLN CB 1 1 12 6426 1 1 15 GLN CD C -11.787 4.754 -0.225 1.00 . A A . 36 GLN CD 1 1 12 6427 1 1 15 GLN CG C -10.575 3.965 0.271 1.00 . A A . 36 GLN CG 1 1 12 6428 1 1 15 GLN H H -7.147 6.276 -0.144 1.00 . A A . 36 GLN H 1 1 12 6429 1 1 15 GLN HA H -9.775 6.302 1.273 1.00 . A A . 36 GLN HA 1 1 12 6430 1 1 15 GLN HB2 H -9.325 5.139 -1.020 1.00 . A A . 36 GLN HB2 1 1 12 6431 1 1 15 GLN HB3 H -8.447 3.944 -0.075 1.00 . A A . 36 GLN HB3 1 1 12 6432 1 1 15 GLN HE21 H -11.888 3.725 -1.981 1.00 . A A . 36 GLN HE21 1 1 12 6433 1 1 15 GLN HE22 H -13.085 4.990 -1.733 1.00 . A A . 36 GLN HE22 1 1 12 6434 1 1 15 GLN HG2 H -10.581 2.998 -0.228 1.00 . A A . 36 GLN HG2 1 1 12 6435 1 1 15 GLN HG3 H -10.671 3.780 1.340 1.00 . A A . 36 GLN HG3 1 1 12 6436 1 1 15 GLN N N -7.900 6.678 0.401 1.00 . A A . 36 GLN N 1 1 12 6437 1 1 15 GLN NE2 N -12.286 4.467 -1.410 1.00 . A A . 36 GLN NE2 1 1 12 6438 1 1 15 GLN O O -8.983 5.090 3.320 1.00 . A A . 36 GLN O 1 1 12 6439 1 1 15 GLN OE1 O -12.300 5.644 0.439 1.00 . A A . 36 GLN OE1 1 1 12 6440 1 1 16 CYS C C -4.705 4.896 3.112 1.00 . A A . 37 CYS C 1 1 12 6441 1 1 16 CYS CA C -6.141 4.390 3.385 1.00 . A A . 37 CYS CA 1 1 12 6442 1 1 16 CYS CB C -6.141 2.869 3.650 1.00 . A A . 37 CYS CB 1 1 12 6443 1 1 16 CYS H H -6.542 4.829 1.365 1.00 . A A . 37 CYS H 1 1 12 6444 1 1 16 CYS HA H -6.499 4.905 4.275 1.00 . A A . 37 CYS HA 1 1 12 6445 1 1 16 CYS HB2 H -6.084 2.323 2.708 1.00 . A A . 37 CYS HB2 1 1 12 6446 1 1 16 CYS HB3 H -5.248 2.600 4.213 1.00 . A A . 37 CYS HB3 1 1 12 6447 1 1 16 CYS N N -7.016 4.725 2.252 1.00 . A A . 37 CYS N 1 1 12 6448 1 1 16 CYS O O -4.416 5.436 2.040 1.00 . A A . 37 CYS O 1 1 12 6449 1 1 16 CYS SG S -7.575 2.356 4.635 1.00 . A A . 37 CYS SG 1 1 12 6450 1 1 17 ARG C C -1.672 4.500 2.735 1.00 . A A . 38 ARG C 1 1 12 6451 1 1 17 ARG CA C -2.372 5.076 3.977 1.00 . A A . 38 ARG CA 1 1 12 6452 1 1 17 ARG CB C -1.605 4.673 5.253 1.00 . A A . 38 ARG CB 1 1 12 6453 1 1 17 ARG CD C -2.933 4.836 7.485 1.00 . A A . 38 ARG CD 1 1 12 6454 1 1 17 ARG CG C -1.923 5.485 6.524 1.00 . A A . 38 ARG CG 1 1 12 6455 1 1 17 ARG CZ C -5.364 4.310 7.123 1.00 . A A . 38 ARG CZ 1 1 12 6456 1 1 17 ARG H H -4.108 4.259 4.930 1.00 . A A . 38 ARG H 1 1 12 6457 1 1 17 ARG HA H -2.308 6.161 3.870 1.00 . A A . 38 ARG HA 1 1 12 6458 1 1 17 ARG HB2 H -1.738 3.607 5.446 1.00 . A A . 38 ARG HB2 1 1 12 6459 1 1 17 ARG HB3 H -0.545 4.832 5.047 1.00 . A A . 38 ARG HB3 1 1 12 6460 1 1 17 ARG HD2 H -2.749 3.764 7.518 1.00 . A A . 38 ARG HD2 1 1 12 6461 1 1 17 ARG HD3 H -2.741 5.228 8.486 1.00 . A A . 38 ARG HD3 1 1 12 6462 1 1 17 ARG HE H -4.557 6.117 6.994 1.00 . A A . 38 ARG HE 1 1 12 6463 1 1 17 ARG HG2 H -0.987 5.579 7.078 1.00 . A A . 38 ARG HG2 1 1 12 6464 1 1 17 ARG HG3 H -2.241 6.496 6.263 1.00 . A A . 38 ARG HG3 1 1 12 6465 1 1 17 ARG HH11 H -4.343 2.633 7.568 1.00 . A A . 38 ARG HH11 1 1 12 6466 1 1 17 ARG HH12 H -6.054 2.440 7.277 1.00 . A A . 38 ARG HH12 1 1 12 6467 1 1 17 ARG HH21 H -6.725 5.733 6.724 1.00 . A A . 38 ARG HH21 1 1 12 6468 1 1 17 ARG HH22 H -7.299 4.091 6.677 1.00 . A A . 38 ARG HH22 1 1 12 6469 1 1 17 ARG N N -3.793 4.698 4.078 1.00 . A A . 38 ARG N 1 1 12 6470 1 1 17 ARG NE N -4.338 5.143 7.146 1.00 . A A . 38 ARG NE 1 1 12 6471 1 1 17 ARG NH1 N -5.243 3.030 7.325 1.00 . A A . 38 ARG NH1 1 1 12 6472 1 1 17 ARG NH2 N -6.556 4.749 6.856 1.00 . A A . 38 ARG NH2 1 1 12 6473 1 1 17 ARG O O -0.855 5.201 2.138 1.00 . A A . 38 ARG O 1 1 12 6474 1 1 18 ALA C C -2.389 1.463 0.610 1.00 . A A . 39 ALA C 1 1 12 6475 1 1 18 ALA CA C -1.515 2.650 1.085 1.00 . A A . 39 ALA CA 1 1 12 6476 1 1 18 ALA CB C -0.079 2.153 1.330 1.00 . A A . 39 ALA CB 1 1 12 6477 1 1 18 ALA H H -2.670 2.752 2.871 1.00 . A A . 39 ALA H 1 1 12 6478 1 1 18 ALA HA H -1.507 3.407 0.300 1.00 . A A . 39 ALA HA 1 1 12 6479 1 1 18 ALA HB1 H 0.568 2.984 1.610 1.00 . A A . 39 ALA HB1 1 1 12 6480 1 1 18 ALA HB2 H -0.086 1.408 2.125 1.00 . A A . 39 ALA HB2 1 1 12 6481 1 1 18 ALA HB3 H 0.320 1.691 0.428 1.00 . A A . 39 ALA HB3 1 1 12 6482 1 1 18 ALA N N -2.003 3.272 2.321 1.00 . A A . 39 ALA N 1 1 12 6483 1 1 18 ALA O O -3.091 0.848 1.421 1.00 . A A . 39 ALA O 1 1 12 6484 1 1 19 PRO C C -1.671 -1.332 -0.656 1.00 . A A . 40 PRO C 1 1 12 6485 1 1 19 PRO CA C -2.688 -0.271 -1.126 1.00 . A A . 40 PRO CA 1 1 12 6486 1 1 19 PRO CB C -2.740 -0.162 -2.654 1.00 . A A . 40 PRO CB 1 1 12 6487 1 1 19 PRO CD C -1.720 1.824 -1.781 1.00 . A A . 40 PRO CD 1 1 12 6488 1 1 19 PRO CG C -1.651 0.862 -2.968 1.00 . A A . 40 PRO CG 1 1 12 6489 1 1 19 PRO HA H -3.676 -0.533 -0.749 1.00 . A A . 40 PRO HA 1 1 12 6490 1 1 19 PRO HB2 H -2.558 -1.116 -3.151 1.00 . A A . 40 PRO HB2 1 1 12 6491 1 1 19 PRO HB3 H -3.710 0.239 -2.953 1.00 . A A . 40 PRO HB3 1 1 12 6492 1 1 19 PRO HD2 H -0.720 2.188 -1.546 1.00 . A A . 40 PRO HD2 1 1 12 6493 1 1 19 PRO HD3 H -2.374 2.662 -2.028 1.00 . A A . 40 PRO HD3 1 1 12 6494 1 1 19 PRO HG2 H -0.678 0.371 -2.983 1.00 . A A . 40 PRO HG2 1 1 12 6495 1 1 19 PRO HG3 H -1.836 1.372 -3.914 1.00 . A A . 40 PRO HG3 1 1 12 6496 1 1 19 PRO N N -2.302 1.068 -0.676 1.00 . A A . 40 PRO N 1 1 12 6497 1 1 19 PRO O O -0.570 -0.998 -0.210 1.00 . A A . 40 PRO O 1 1 12 6498 1 1 20 LYS C C 0.223 -3.908 -0.981 1.00 . A A . 41 LYS C 1 1 12 6499 1 1 20 LYS CA C -1.184 -3.786 -0.372 1.00 . A A . 41 LYS CA 1 1 12 6500 1 1 20 LYS CB C -1.990 -5.089 -0.535 1.00 . A A . 41 LYS CB 1 1 12 6501 1 1 20 LYS CD C -3.015 -6.829 -2.046 1.00 . A A . 41 LYS CD 1 1 12 6502 1 1 20 LYS CE C -3.244 -7.265 -3.498 1.00 . A A . 41 LYS CE 1 1 12 6503 1 1 20 LYS CG C -2.255 -5.495 -1.995 1.00 . A A . 41 LYS CG 1 1 12 6504 1 1 20 LYS H H -2.919 -2.816 -1.193 1.00 . A A . 41 LYS H 1 1 12 6505 1 1 20 LYS HA H -0.996 -3.658 0.694 1.00 . A A . 41 LYS HA 1 1 12 6506 1 1 20 LYS HB2 H -1.445 -5.896 -0.042 1.00 . A A . 41 LYS HB2 1 1 12 6507 1 1 20 LYS HB3 H -2.945 -4.980 -0.021 1.00 . A A . 41 LYS HB3 1 1 12 6508 1 1 20 LYS HD2 H -2.429 -7.591 -1.529 1.00 . A A . 41 LYS HD2 1 1 12 6509 1 1 20 LYS HD3 H -3.976 -6.718 -1.538 1.00 . A A . 41 LYS HD3 1 1 12 6510 1 1 20 LYS HE2 H -3.860 -6.513 -4.002 1.00 . A A . 41 LYS HE2 1 1 12 6511 1 1 20 LYS HE3 H -2.278 -7.301 -4.010 1.00 . A A . 41 LYS HE3 1 1 12 6512 1 1 20 LYS HG2 H -2.846 -4.723 -2.491 1.00 . A A . 41 LYS HG2 1 1 12 6513 1 1 20 LYS HG3 H -1.308 -5.608 -2.522 1.00 . A A . 41 LYS HG3 1 1 12 6514 1 1 20 LYS HZ1 H -4.796 -8.600 -3.101 1.00 . A A . 41 LYS HZ1 1 1 12 6515 1 1 20 LYS HZ2 H -4.059 -8.874 -4.530 1.00 . A A . 41 LYS HZ2 1 1 12 6516 1 1 20 LYS HZ3 H -3.328 -9.313 -3.142 1.00 . A A . 41 LYS HZ3 1 1 12 6517 1 1 20 LYS N N -1.999 -2.625 -0.805 1.00 . A A . 41 LYS N 1 1 12 6518 1 1 20 LYS NZ N -3.901 -8.596 -3.571 1.00 . A A . 41 LYS NZ 1 1 12 6519 1 1 20 LYS O O 1.001 -4.764 -0.559 1.00 . A A . 41 LYS O 1 1 12 6520 1 1 21 VAL C C 2.877 -2.365 -1.198 1.00 . A A . 42 VAL C 1 1 12 6521 1 1 21 VAL CA C 1.959 -2.772 -2.366 1.00 . A A . 42 VAL CA 1 1 12 6522 1 1 21 VAL CB C 1.948 -1.666 -3.446 1.00 . A A . 42 VAL CB 1 1 12 6523 1 1 21 VAL CG1 C 3.342 -1.374 -4.006 1.00 . A A . 42 VAL CG1 1 1 12 6524 1 1 21 VAL CG2 C 1.049 -2.042 -4.635 1.00 . A A . 42 VAL CG2 1 1 12 6525 1 1 21 VAL H H -0.136 -2.387 -2.219 1.00 . A A . 42 VAL H 1 1 12 6526 1 1 21 VAL HA H 2.366 -3.684 -2.807 1.00 . A A . 42 VAL HA 1 1 12 6527 1 1 21 VAL HB H 1.562 -0.747 -3.004 1.00 . A A . 42 VAL HB 1 1 12 6528 1 1 21 VAL HG11 H 3.778 -2.290 -4.405 1.00 . A A . 42 VAL HG11 1 1 12 6529 1 1 21 VAL HG12 H 3.279 -0.631 -4.802 1.00 . A A . 42 VAL HG12 1 1 12 6530 1 1 21 VAL HG13 H 3.986 -0.975 -3.225 1.00 . A A . 42 VAL HG13 1 1 12 6531 1 1 21 VAL HG21 H 1.385 -2.981 -5.074 1.00 . A A . 42 VAL HG21 1 1 12 6532 1 1 21 VAL HG22 H 0.010 -2.143 -4.320 1.00 . A A . 42 VAL HG22 1 1 12 6533 1 1 21 VAL HG23 H 1.091 -1.259 -5.393 1.00 . A A . 42 VAL HG23 1 1 12 6534 1 1 21 VAL N N 0.578 -3.030 -1.919 1.00 . A A . 42 VAL N 1 1 12 6535 1 1 21 VAL O O 4.051 -2.731 -1.183 1.00 . A A . 42 VAL O 1 1 12 6536 1 1 22 CYS C C 2.229 -0.922 2.170 1.00 . A A . 43 CYS C 1 1 12 6537 1 1 22 CYS CA C 3.085 -0.990 0.878 1.00 . A A . 43 CYS CA 1 1 12 6538 1 1 22 CYS CB C 3.515 0.390 0.339 1.00 . A A . 43 CYS CB 1 1 12 6539 1 1 22 CYS H H 1.351 -1.425 -0.259 1.00 . A A . 43 CYS H 1 1 12 6540 1 1 22 CYS HA H 3.983 -1.568 1.101 1.00 . A A . 43 CYS HA 1 1 12 6541 1 1 22 CYS HB2 H 3.946 0.253 -0.655 1.00 . A A . 43 CYS HB2 1 1 12 6542 1 1 22 CYS HB3 H 2.636 1.031 0.242 1.00 . A A . 43 CYS HB3 1 1 12 6543 1 1 22 CYS N N 2.344 -1.633 -0.210 1.00 . A A . 43 CYS N 1 1 12 6544 1 1 22 CYS O O 1.319 -1.727 2.381 1.00 . A A . 43 CYS O 1 1 12 6545 1 1 22 CYS SG S 4.756 1.186 1.395 1.00 . A A . 43 CYS SG 1 1 12 6546 1 1 23 PHE C C 1.653 1.978 4.353 1.00 . A A . 44 PHE C 1 1 12 6547 1 1 23 PHE CA C 1.755 0.445 4.205 1.00 . A A . 44 PHE CA 1 1 12 6548 1 1 23 PHE CB C 2.344 -0.188 5.477 1.00 . A A . 44 PHE CB 1 1 12 6549 1 1 23 PHE CD1 C 4.853 0.238 5.428 1.00 . A A . 44 PHE CD1 1 1 12 6550 1 1 23 PHE CD2 C 3.488 1.441 7.047 1.00 . A A . 44 PHE CD2 1 1 12 6551 1 1 23 PHE CE1 C 5.995 0.913 5.895 1.00 . A A . 44 PHE CE1 1 1 12 6552 1 1 23 PHE CE2 C 4.632 2.114 7.513 1.00 . A A . 44 PHE CE2 1 1 12 6553 1 1 23 PHE CG C 3.595 0.501 6.003 1.00 . A A . 44 PHE CG 1 1 12 6554 1 1 23 PHE CZ C 5.887 1.852 6.935 1.00 . A A . 44 PHE CZ 1 1 12 6555 1 1 23 PHE H H 3.361 0.574 2.797 1.00 . A A . 44 PHE H 1 1 12 6556 1 1 23 PHE HA H 0.737 0.072 4.085 1.00 . A A . 44 PHE HA 1 1 12 6557 1 1 23 PHE HB2 H 1.582 -0.154 6.256 1.00 . A A . 44 PHE HB2 1 1 12 6558 1 1 23 PHE HB3 H 2.562 -1.241 5.293 1.00 . A A . 44 PHE HB3 1 1 12 6559 1 1 23 PHE HD1 H 4.946 -0.481 4.624 1.00 . A A . 44 PHE HD1 1 1 12 6560 1 1 23 PHE HD2 H 2.526 1.653 7.491 1.00 . A A . 44 PHE HD2 1 1 12 6561 1 1 23 PHE HE1 H 6.961 0.708 5.452 1.00 . A A . 44 PHE HE1 1 1 12 6562 1 1 23 PHE HE2 H 4.546 2.837 8.314 1.00 . A A . 44 PHE HE2 1 1 12 6563 1 1 23 PHE HZ H 6.766 2.371 7.291 1.00 . A A . 44 PHE HZ 1 1 12 6564 1 1 23 PHE N N 2.542 0.034 3.041 1.00 . A A . 44 PHE N 1 1 12 6565 1 1 23 PHE O O 0.735 2.450 5.024 1.00 . A A . 44 PHE O 1 1 12 6566 1 1 24 LYS C C 3.284 4.918 2.618 1.00 . A A . 45 LYS C 1 1 12 6567 1 1 24 LYS CA C 2.560 4.237 3.790 1.00 . A A . 45 LYS CA 1 1 12 6568 1 1 24 LYS CB C 3.177 4.666 5.138 1.00 . A A . 45 LYS CB 1 1 12 6569 1 1 24 LYS CD C 3.595 6.531 6.789 1.00 . A A . 45 LYS CD 1 1 12 6570 1 1 24 LYS CE C 3.419 8.029 7.059 1.00 . A A . 45 LYS CE 1 1 12 6571 1 1 24 LYS CG C 3.034 6.172 5.406 1.00 . A A . 45 LYS CG 1 1 12 6572 1 1 24 LYS H H 3.277 2.303 3.186 1.00 . A A . 45 LYS H 1 1 12 6573 1 1 24 LYS HA H 1.526 4.589 3.758 1.00 . A A . 45 LYS HA 1 1 12 6574 1 1 24 LYS HB2 H 2.673 4.133 5.945 1.00 . A A . 45 LYS HB2 1 1 12 6575 1 1 24 LYS HB3 H 4.233 4.391 5.164 1.00 . A A . 45 LYS HB3 1 1 12 6576 1 1 24 LYS HD2 H 3.066 5.959 7.553 1.00 . A A . 45 LYS HD2 1 1 12 6577 1 1 24 LYS HD3 H 4.656 6.276 6.824 1.00 . A A . 45 LYS HD3 1 1 12 6578 1 1 24 LYS HE2 H 3.935 8.593 6.277 1.00 . A A . 45 LYS HE2 1 1 12 6579 1 1 24 LYS HE3 H 2.353 8.275 6.998 1.00 . A A . 45 LYS HE3 1 1 12 6580 1 1 24 LYS HG2 H 3.578 6.736 4.646 1.00 . A A . 45 LYS HG2 1 1 12 6581 1 1 24 LYS HG3 H 1.978 6.444 5.364 1.00 . A A . 45 LYS HG3 1 1 12 6582 1 1 24 LYS HZ1 H 3.476 7.913 9.136 1.00 . A A . 45 LYS HZ1 1 1 12 6583 1 1 24 LYS HZ2 H 4.937 8.214 8.468 1.00 . A A . 45 LYS HZ2 1 1 12 6584 1 1 24 LYS HZ3 H 3.823 9.400 8.567 1.00 . A A . 45 LYS HZ3 1 1 12 6585 1 1 24 LYS N N 2.556 2.759 3.728 1.00 . A A . 45 LYS N 1 1 12 6586 1 1 24 LYS NZ N 3.948 8.412 8.395 1.00 . A A . 45 LYS NZ 1 1 12 6587 1 1 24 LYS O O 2.682 5.761 1.950 1.00 . A A . 45 LYS O 1 1 12 6588 1 1 25 CYS C C 5.126 4.999 -0.074 1.00 . A A . 46 CYS C 1 1 12 6589 1 1 25 CYS CA C 5.427 5.279 1.417 1.00 . A A . 46 CYS CA 1 1 12 6590 1 1 25 CYS CB C 6.899 5.019 1.794 1.00 . A A . 46 CYS CB 1 1 12 6591 1 1 25 CYS H H 4.998 3.900 2.963 1.00 . A A . 46 CYS H 1 1 12 6592 1 1 25 CYS HA H 5.264 6.349 1.551 1.00 . A A . 46 CYS HA 1 1 12 6593 1 1 25 CYS HB2 H 7.533 5.166 0.916 1.00 . A A . 46 CYS HB2 1 1 12 6594 1 1 25 CYS HB3 H 7.194 5.763 2.536 1.00 . A A . 46 CYS HB3 1 1 12 6595 1 1 25 CYS N N 4.551 4.582 2.369 1.00 . A A . 46 CYS N 1 1 12 6596 1 1 25 CYS O O 5.290 5.905 -0.893 1.00 . A A . 46 CYS O 1 1 12 6597 1 1 25 CYS SG S 7.192 3.371 2.500 1.00 . A A . 46 CYS SG 1 1 12 6598 1 1 26 LYS C C 4.656 3.856 -3.022 1.00 . A A . 47 LYS C 1 1 12 6599 1 1 26 LYS CA C 3.991 3.398 -1.702 1.00 . A A . 47 LYS CA 1 1 12 6600 1 1 26 LYS CB C 2.470 3.674 -1.629 1.00 . A A . 47 LYS CB 1 1 12 6601 1 1 26 LYS CD C 0.592 5.357 -1.324 1.00 . A A . 47 LYS CD 1 1 12 6602 1 1 26 LYS CE C 0.275 6.794 -0.889 1.00 . A A . 47 LYS CE 1 1 12 6603 1 1 26 LYS CG C 2.102 5.163 -1.507 1.00 . A A . 47 LYS CG 1 1 12 6604 1 1 26 LYS H H 4.560 3.130 0.342 1.00 . A A . 47 LYS H 1 1 12 6605 1 1 26 LYS HA H 4.076 2.314 -1.751 1.00 . A A . 47 LYS HA 1 1 12 6606 1 1 26 LYS HB2 H 1.980 3.257 -2.510 1.00 . A A . 47 LYS HB2 1 1 12 6607 1 1 26 LYS HB3 H 2.074 3.151 -0.758 1.00 . A A . 47 LYS HB3 1 1 12 6608 1 1 26 LYS HD2 H 0.093 5.151 -2.272 1.00 . A A . 47 LYS HD2 1 1 12 6609 1 1 26 LYS HD3 H 0.212 4.663 -0.574 1.00 . A A . 47 LYS HD3 1 1 12 6610 1 1 26 LYS HE2 H 0.839 7.487 -1.520 1.00 . A A . 47 LYS HE2 1 1 12 6611 1 1 26 LYS HE3 H -0.787 6.974 -1.061 1.00 . A A . 47 LYS HE3 1 1 12 6612 1 1 26 LYS HG2 H 2.608 5.587 -0.646 1.00 . A A . 47 LYS HG2 1 1 12 6613 1 1 26 LYS HG3 H 2.430 5.701 -2.398 1.00 . A A . 47 LYS HG3 1 1 12 6614 1 1 26 LYS HZ1 H 1.540 6.772 0.780 1.00 . A A . 47 LYS HZ1 1 1 12 6615 1 1 26 LYS HZ2 H 0.434 7.988 0.811 1.00 . A A . 47 LYS HZ2 1 1 12 6616 1 1 26 LYS HZ3 H -0.004 6.443 1.139 1.00 . A A . 47 LYS HZ3 1 1 12 6617 1 1 26 LYS N N 4.617 3.803 -0.415 1.00 . A A . 47 LYS N 1 1 12 6618 1 1 26 LYS NZ N 0.583 7.024 0.547 1.00 . A A . 47 LYS NZ 1 1 12 6619 1 1 26 LYS O O 3.983 3.965 -4.049 1.00 . A A . 47 LYS O 1 1 12 6620 1 1 27 GLN C C 6.819 3.348 -5.273 1.00 . A A . 48 GLN C 1 1 12 6621 1 1 27 GLN CA C 6.731 4.493 -4.229 1.00 . A A . 48 GLN CA 1 1 12 6622 1 1 27 GLN CB C 8.140 4.976 -3.828 1.00 . A A . 48 GLN CB 1 1 12 6623 1 1 27 GLN CD C 7.394 7.388 -3.437 1.00 . A A . 48 GLN CD 1 1 12 6624 1 1 27 GLN CG C 8.150 6.185 -2.876 1.00 . A A . 48 GLN CG 1 1 12 6625 1 1 27 GLN H H 6.463 4.016 -2.152 1.00 . A A . 48 GLN H 1 1 12 6626 1 1 27 GLN HA H 6.197 5.326 -4.682 1.00 . A A . 48 GLN HA 1 1 12 6627 1 1 27 GLN HB2 H 8.677 4.158 -3.350 1.00 . A A . 48 GLN HB2 1 1 12 6628 1 1 27 GLN HB3 H 8.692 5.249 -4.729 1.00 . A A . 48 GLN HB3 1 1 12 6629 1 1 27 GLN HE21 H 5.846 7.141 -2.157 1.00 . A A . 48 GLN HE21 1 1 12 6630 1 1 27 GLN HE22 H 5.729 8.497 -3.285 1.00 . A A . 48 GLN HE22 1 1 12 6631 1 1 27 GLN HG2 H 7.731 5.897 -1.913 1.00 . A A . 48 GLN HG2 1 1 12 6632 1 1 27 GLN HG3 H 9.184 6.480 -2.698 1.00 . A A . 48 GLN HG3 1 1 12 6633 1 1 27 GLN N N 5.971 4.102 -3.027 1.00 . A A . 48 GLN N 1 1 12 6634 1 1 27 GLN NE2 N 6.228 7.703 -2.916 1.00 . A A . 48 GLN NE2 1 1 12 6635 1 1 27 GLN O O 6.813 2.181 -4.868 1.00 . A A . 48 GLN O 1 1 12 6636 1 1 27 GLN OE1 O 7.831 8.055 -4.367 1.00 . A A . 48 GLN OE1 1 1 12 6637 1 1 28 PRO C C 7.546 1.352 -7.693 1.00 . A A . 49 PRO C 1 1 12 6638 1 1 28 PRO CA C 6.778 2.688 -7.703 1.00 . A A . 49 PRO CA 1 1 12 6639 1 1 28 PRO CB C 7.136 3.472 -8.970 1.00 . A A . 49 PRO CB 1 1 12 6640 1 1 28 PRO CD C 7.074 4.994 -7.138 1.00 . A A . 49 PRO CD 1 1 12 6641 1 1 28 PRO CG C 6.734 4.898 -8.623 1.00 . A A . 49 PRO CG 1 1 12 6642 1 1 28 PRO HA H 5.715 2.445 -7.750 1.00 . A A . 49 PRO HA 1 1 12 6643 1 1 28 PRO HB2 H 8.213 3.433 -9.143 1.00 . A A . 49 PRO HB2 1 1 12 6644 1 1 28 PRO HB3 H 6.596 3.102 -9.841 1.00 . A A . 49 PRO HB3 1 1 12 6645 1 1 28 PRO HD2 H 8.105 5.336 -7.025 1.00 . A A . 49 PRO HD2 1 1 12 6646 1 1 28 PRO HD3 H 6.392 5.704 -6.671 1.00 . A A . 49 PRO HD3 1 1 12 6647 1 1 28 PRO HG2 H 7.284 5.631 -9.213 1.00 . A A . 49 PRO HG2 1 1 12 6648 1 1 28 PRO HG3 H 5.659 5.019 -8.761 1.00 . A A . 49 PRO HG3 1 1 12 6649 1 1 28 PRO N N 6.948 3.643 -6.590 1.00 . A A . 49 PRO N 1 1 12 6650 1 1 28 PRO O O 7.133 0.426 -8.394 1.00 . A A . 49 PRO O 1 1 12 6651 1 1 29 GLY C C 10.239 -0.252 -5.584 1.00 . A A . 50 GLY C 1 1 12 6652 1 1 29 GLY CA C 9.449 -0.017 -6.878 1.00 . A A . 50 GLY CA 1 1 12 6653 1 1 29 GLY H H 8.977 2.044 -6.457 1.00 . A A . 50 GLY H 1 1 12 6654 1 1 29 GLY HA2 H 10.159 -0.008 -7.704 1.00 . A A . 50 GLY HA2 1 1 12 6655 1 1 29 GLY HA3 H 8.793 -0.879 -7.008 1.00 . A A . 50 GLY HA3 1 1 12 6656 1 1 29 GLY N N 8.646 1.222 -6.939 1.00 . A A . 50 GLY N 1 1 12 6657 1 1 29 GLY O O 10.992 -1.224 -5.500 1.00 . A A . 50 GLY O 1 1 12 6658 1 1 30 HIS C C 10.497 -0.703 -2.452 1.00 . A A . 51 HIS C 1 1 12 6659 1 1 30 HIS CA C 10.832 0.542 -3.302 1.00 . A A . 51 HIS CA 1 1 12 6660 1 1 30 HIS CB C 10.537 1.820 -2.493 1.00 . A A . 51 HIS CB 1 1 12 6661 1 1 30 HIS CD2 C 9.086 1.629 -0.392 1.00 . A A . 51 HIS CD2 1 1 12 6662 1 1 30 HIS CE1 C 7.093 1.420 -1.290 1.00 . A A . 51 HIS CE1 1 1 12 6663 1 1 30 HIS CG C 9.220 1.776 -1.747 1.00 . A A . 51 HIS CG 1 1 12 6664 1 1 30 HIS H H 9.470 1.393 -4.710 1.00 . A A . 51 HIS H 1 1 12 6665 1 1 30 HIS HA H 11.901 0.515 -3.526 1.00 . A A . 51 HIS HA 1 1 12 6666 1 1 30 HIS HB2 H 11.336 1.945 -1.760 1.00 . A A . 51 HIS HB2 1 1 12 6667 1 1 30 HIS HB3 H 10.562 2.692 -3.148 1.00 . A A . 51 HIS HB3 1 1 12 6668 1 1 30 HIS HD1 H 7.693 1.727 -3.271 1.00 . A A . 51 HIS HD1 1 1 12 6669 1 1 30 HIS HD2 H 9.896 1.609 0.324 1.00 . A A . 51 HIS HD2 1 1 12 6670 1 1 30 HIS HE1 H 6.032 1.250 -1.416 1.00 . A A . 51 HIS HE1 1 1 12 6671 1 1 30 HIS N N 10.094 0.613 -4.576 1.00 . A A . 51 HIS N 1 1 12 6672 1 1 30 HIS ND1 N 7.956 1.655 -2.289 1.00 . A A . 51 HIS ND1 1 1 12 6673 1 1 30 HIS NE2 N 7.733 1.402 -0.111 1.00 . A A . 51 HIS NE2 1 1 12 6674 1 1 30 HIS O O 11.325 -1.187 -1.678 1.00 . A A . 51 HIS O 1 1 12 6675 1 1 31 PHE C C 9.394 -3.485 -1.558 1.00 . A A . 52 PHE C 1 1 12 6676 1 1 31 PHE CA C 8.646 -2.151 -1.640 1.00 . A A . 52 PHE CA 1 1 12 6677 1 1 31 PHE CB C 7.165 -2.331 -2.015 1.00 . A A . 52 PHE CB 1 1 12 6678 1 1 31 PHE CD1 C 6.894 -3.884 -4.010 1.00 . A A . 52 PHE CD1 1 1 12 6679 1 1 31 PHE CD2 C 6.609 -1.490 -4.343 1.00 . A A . 52 PHE CD2 1 1 12 6680 1 1 31 PHE CE1 C 6.646 -4.102 -5.377 1.00 . A A . 52 PHE CE1 1 1 12 6681 1 1 31 PHE CE2 C 6.354 -1.711 -5.707 1.00 . A A . 52 PHE CE2 1 1 12 6682 1 1 31 PHE CG C 6.884 -2.576 -3.488 1.00 . A A . 52 PHE CG 1 1 12 6683 1 1 31 PHE CZ C 6.378 -3.015 -6.227 1.00 . A A . 52 PHE CZ 1 1 12 6684 1 1 31 PHE H H 8.660 -0.773 -3.255 1.00 . A A . 52 PHE H 1 1 12 6685 1 1 31 PHE HA H 8.676 -1.714 -0.640 1.00 . A A . 52 PHE HA 1 1 12 6686 1 1 31 PHE HB2 H 6.754 -3.154 -1.433 1.00 . A A . 52 PHE HB2 1 1 12 6687 1 1 31 PHE HB3 H 6.625 -1.434 -1.710 1.00 . A A . 52 PHE HB3 1 1 12 6688 1 1 31 PHE HD1 H 7.099 -4.726 -3.363 1.00 . A A . 52 PHE HD1 1 1 12 6689 1 1 31 PHE HD2 H 6.569 -0.484 -3.953 1.00 . A A . 52 PHE HD2 1 1 12 6690 1 1 31 PHE HE1 H 6.666 -5.107 -5.775 1.00 . A A . 52 PHE HE1 1 1 12 6691 1 1 31 PHE HE2 H 6.122 -0.875 -6.353 1.00 . A A . 52 PHE HE2 1 1 12 6692 1 1 31 PHE HZ H 6.182 -3.182 -7.278 1.00 . A A . 52 PHE HZ 1 1 12 6693 1 1 31 PHE N N 9.263 -1.202 -2.571 1.00 . A A . 52 PHE N 1 1 12 6694 1 1 31 PHE O O 9.618 -3.988 -0.458 1.00 . A A . 52 PHE O 1 1 12 6695 1 1 32 SER C C 12.052 -5.162 -2.038 1.00 . A A . 53 SER C 1 1 12 6696 1 1 32 SER CA C 10.699 -5.227 -2.777 1.00 . A A . 53 SER CA 1 1 12 6697 1 1 32 SER CB C 10.955 -5.572 -4.250 1.00 . A A . 53 SER CB 1 1 12 6698 1 1 32 SER H H 9.636 -3.551 -3.559 1.00 . A A . 53 SER H 1 1 12 6699 1 1 32 SER HA H 10.130 -6.044 -2.333 1.00 . A A . 53 SER HA 1 1 12 6700 1 1 32 SER HB2 H 11.593 -4.807 -4.694 1.00 . A A . 53 SER HB2 1 1 12 6701 1 1 32 SER HB3 H 11.466 -6.536 -4.314 1.00 . A A . 53 SER HB3 1 1 12 6702 1 1 32 SER HG H 9.936 -5.893 -5.894 1.00 . A A . 53 SER HG 1 1 12 6703 1 1 32 SER N N 9.888 -4.000 -2.687 1.00 . A A . 53 SER N 1 1 12 6704 1 1 32 SER O O 12.761 -6.169 -1.981 1.00 . A A . 53 SER O 1 1 12 6705 1 1 32 SER OG O 9.737 -5.639 -4.972 1.00 . A A . 53 SER OG 1 1 12 6706 1 1 33 LYS C C 13.484 -3.125 0.626 1.00 . A A . 54 LYS C 1 1 12 6707 1 1 33 LYS CA C 13.686 -3.727 -0.778 1.00 . A A . 54 LYS CA 1 1 12 6708 1 1 33 LYS CB C 14.601 -2.820 -1.632 1.00 . A A . 54 LYS CB 1 1 12 6709 1 1 33 LYS CD C 13.921 -2.589 -4.092 1.00 . A A . 54 LYS CD 1 1 12 6710 1 1 33 LYS CE C 14.124 -3.176 -5.492 1.00 . A A . 54 LYS CE 1 1 12 6711 1 1 33 LYS CG C 14.840 -3.293 -3.080 1.00 . A A . 54 LYS CG 1 1 12 6712 1 1 33 LYS H H 11.796 -3.205 -1.617 1.00 . A A . 54 LYS H 1 1 12 6713 1 1 33 LYS HA H 14.205 -4.674 -0.618 1.00 . A A . 54 LYS HA 1 1 12 6714 1 1 33 LYS HB2 H 14.200 -1.805 -1.642 1.00 . A A . 54 LYS HB2 1 1 12 6715 1 1 33 LYS HB3 H 15.574 -2.777 -1.140 1.00 . A A . 54 LYS HB3 1 1 12 6716 1 1 33 LYS HD2 H 12.877 -2.704 -3.800 1.00 . A A . 54 LYS HD2 1 1 12 6717 1 1 33 LYS HD3 H 14.164 -1.523 -4.102 1.00 . A A . 54 LYS HD3 1 1 12 6718 1 1 33 LYS HE2 H 15.192 -3.172 -5.731 1.00 . A A . 54 LYS HE2 1 1 12 6719 1 1 33 LYS HE3 H 13.787 -4.216 -5.486 1.00 . A A . 54 LYS HE3 1 1 12 6720 1 1 33 LYS HG2 H 15.872 -3.065 -3.348 1.00 . A A . 54 LYS HG2 1 1 12 6721 1 1 33 LYS HG3 H 14.713 -4.375 -3.142 1.00 . A A . 54 LYS HG3 1 1 12 6722 1 1 33 LYS HZ1 H 12.408 -2.258 -6.235 1.00 . A A . 54 LYS HZ1 1 1 12 6723 1 1 33 LYS HZ2 H 13.782 -1.486 -6.646 1.00 . A A . 54 LYS HZ2 1 1 12 6724 1 1 33 LYS HZ3 H 13.382 -2.870 -7.411 1.00 . A A . 54 LYS HZ3 1 1 12 6725 1 1 33 LYS N N 12.422 -3.994 -1.489 1.00 . A A . 54 LYS N 1 1 12 6726 1 1 33 LYS NZ N 13.374 -2.402 -6.515 1.00 . A A . 54 LYS NZ 1 1 12 6727 1 1 33 LYS O O 14.471 -2.794 1.285 1.00 . A A . 54 LYS O 1 1 12 6728 1 1 34 GLN C C 10.613 -2.988 3.008 1.00 . A A . 55 GLN C 1 1 12 6729 1 1 34 GLN CA C 11.924 -2.428 2.422 1.00 . A A . 55 GLN CA 1 1 12 6730 1 1 34 GLN CB C 11.876 -0.887 2.323 1.00 . A A . 55 GLN CB 1 1 12 6731 1 1 34 GLN CD C 11.596 1.305 3.557 1.00 . A A . 55 GLN CD 1 1 12 6732 1 1 34 GLN CG C 11.715 -0.211 3.693 1.00 . A A . 55 GLN CG 1 1 12 6733 1 1 34 GLN H H 11.480 -3.330 0.526 1.00 . A A . 55 GLN H 1 1 12 6734 1 1 34 GLN HA H 12.724 -2.698 3.113 1.00 . A A . 55 GLN HA 1 1 12 6735 1 1 34 GLN HB2 H 12.804 -0.529 1.874 1.00 . A A . 55 GLN HB2 1 1 12 6736 1 1 34 GLN HB3 H 11.055 -0.588 1.672 1.00 . A A . 55 GLN HB3 1 1 12 6737 1 1 34 GLN HE21 H 9.587 1.214 3.387 1.00 . A A . 55 GLN HE21 1 1 12 6738 1 1 34 GLN HE22 H 10.298 2.824 3.329 1.00 . A A . 55 GLN HE22 1 1 12 6739 1 1 34 GLN HG2 H 10.823 -0.587 4.194 1.00 . A A . 55 GLN HG2 1 1 12 6740 1 1 34 GLN HG3 H 12.579 -0.446 4.315 1.00 . A A . 55 GLN HG3 1 1 12 6741 1 1 34 GLN N N 12.237 -2.974 1.092 1.00 . A A . 55 GLN N 1 1 12 6742 1 1 34 GLN NE2 N 10.396 1.825 3.412 1.00 . A A . 55 GLN NE2 1 1 12 6743 1 1 34 GLN O O 10.638 -3.659 4.044 1.00 . A A . 55 GLN O 1 1 12 6744 1 1 34 GLN OE1 O 12.573 2.044 3.574 1.00 . A A . 55 GLN OE1 1 1 12 6745 1 1 35 CYS C C 7.515 -4.284 2.647 1.00 . A A . 56 CYS C 1 1 12 6746 1 1 35 CYS CA C 8.138 -2.901 2.933 1.00 . A A . 56 CYS CA 1 1 12 6747 1 1 35 CYS CB C 7.240 -1.775 2.397 1.00 . A A . 56 CYS CB 1 1 12 6748 1 1 35 CYS H H 9.536 -2.136 1.538 1.00 . A A . 56 CYS H 1 1 12 6749 1 1 35 CYS HA H 8.199 -2.790 4.017 1.00 . A A . 56 CYS HA 1 1 12 6750 1 1 35 CYS HB2 H 7.139 -1.864 1.312 1.00 . A A . 56 CYS HB2 1 1 12 6751 1 1 35 CYS HB3 H 6.245 -1.868 2.842 1.00 . A A . 56 CYS HB3 1 1 12 6752 1 1 35 CYS N N 9.476 -2.715 2.359 1.00 . A A . 56 CYS N 1 1 12 6753 1 1 35 CYS O O 6.550 -4.678 3.310 1.00 . A A . 56 CYS O 1 1 12 6754 1 1 35 CYS SG S 7.953 -0.167 2.837 1.00 . A A . 56 CYS SG 1 1 12 6755 1 1 36 ARG C C 8.570 -7.298 0.726 1.00 . A A . 57 ARG C 1 1 12 6756 1 1 36 ARG CA C 7.485 -6.272 1.118 1.00 . A A . 57 ARG CA 1 1 12 6757 1 1 36 ARG CB C 6.561 -5.926 -0.078 1.00 . A A . 57 ARG CB 1 1 12 6758 1 1 36 ARG CD C 4.035 -6.032 0.394 1.00 . A A . 57 ARG CD 1 1 12 6759 1 1 36 ARG CG C 5.278 -6.779 -0.119 1.00 . A A . 57 ARG CG 1 1 12 6760 1 1 36 ARG CZ C 3.413 -4.604 2.351 1.00 . A A . 57 ARG CZ 1 1 12 6761 1 1 36 ARG H H 8.797 -4.582 1.136 1.00 . A A . 57 ARG H 1 1 12 6762 1 1 36 ARG HA H 6.902 -6.752 1.905 1.00 . A A . 57 ARG HA 1 1 12 6763 1 1 36 ARG HB2 H 6.273 -4.875 -0.040 1.00 . A A . 57 ARG HB2 1 1 12 6764 1 1 36 ARG HB3 H 7.113 -6.060 -1.009 1.00 . A A . 57 ARG HB3 1 1 12 6765 1 1 36 ARG HD2 H 3.784 -5.252 -0.330 1.00 . A A . 57 ARG HD2 1 1 12 6766 1 1 36 ARG HD3 H 3.199 -6.732 0.443 1.00 . A A . 57 ARG HD3 1 1 12 6767 1 1 36 ARG HE H 5.151 -5.509 2.146 1.00 . A A . 57 ARG HE 1 1 12 6768 1 1 36 ARG HG2 H 5.087 -7.068 -1.153 1.00 . A A . 57 ARG HG2 1 1 12 6769 1 1 36 ARG HG3 H 5.415 -7.695 0.457 1.00 . A A . 57 ARG HG3 1 1 12 6770 1 1 36 ARG HH11 H 1.917 -4.756 1.038 1.00 . A A . 57 ARG HH11 1 1 12 6771 1 1 36 ARG HH12 H 1.691 -3.582 2.312 1.00 . A A . 57 ARG HH12 1 1 12 6772 1 1 36 ARG HH21 H 4.740 -4.176 3.769 1.00 . A A . 57 ARG HH21 1 1 12 6773 1 1 36 ARG HH22 H 3.153 -3.447 3.969 1.00 . A A . 57 ARG HH22 1 1 12 6774 1 1 36 ARG N N 8.038 -5.015 1.655 1.00 . A A . 57 ARG N 1 1 12 6775 1 1 36 ARG NE N 4.242 -5.410 1.717 1.00 . A A . 57 ARG NE 1 1 12 6776 1 1 36 ARG NH1 N 2.215 -4.351 1.917 1.00 . A A . 57 ARG NH1 1 1 12 6777 1 1 36 ARG NH2 N 3.792 -4.017 3.445 1.00 . A A . 57 ARG NH2 1 1 12 6778 1 1 36 ARG O O 8.282 -8.247 -0.006 1.00 . A A . 57 ARG O 1 1 12 6779 1 1 37 SER C C 10.785 -9.426 1.148 1.00 . A A . 58 SER C 1 1 12 6780 1 1 37 SER CA C 11.010 -7.918 0.964 1.00 . A A . 58 SER CA 1 1 12 6781 1 1 37 SER CB C 12.140 -7.461 1.888 1.00 . A A . 58 SER CB 1 1 12 6782 1 1 37 SER H H 9.938 -6.272 1.772 1.00 . A A . 58 SER H 1 1 12 6783 1 1 37 SER HA H 11.341 -7.765 -0.062 1.00 . A A . 58 SER HA 1 1 12 6784 1 1 37 SER HB2 H 11.873 -7.678 2.925 1.00 . A A . 58 SER HB2 1 1 12 6785 1 1 37 SER HB3 H 13.051 -8.016 1.642 1.00 . A A . 58 SER HB3 1 1 12 6786 1 1 37 SER HG H 13.080 -5.802 2.342 1.00 . A A . 58 SER HG 1 1 12 6787 1 1 37 SER N N 9.807 -7.090 1.196 1.00 . A A . 58 SER N 1 1 12 6788 1 1 37 SER O O 10.240 -9.835 2.199 1.00 . A A . 58 SER O 1 1 12 6789 1 1 37 SER OXT O 11.194 -10.200 0.252 1.00 . A A . 58 SER OXT 1 1 12 6790 1 1 37 SER OG O 12.366 -6.068 1.731 1.00 . A A . 58 SER OG 1 1 12 6791 2 2 1 ZN ZN ZN -8.306 0.516 3.753 1.00 . B A . 1059 ZN ZN 1 1 12 6792 3 2 1 ZN ZN ZN 6.886 1.360 1.767 1.00 . C A . 1060 ZN ZN 1 1 13 6793 1 1 1 GLN C C -6.345 -1.614 -4.517 1.00 . A A . 22 GLN C 1 1 13 6794 1 1 1 GLN CA C -6.179 -1.206 -5.980 1.00 . A A . 22 GLN CA 1 1 13 6795 1 1 1 GLN CB C -4.724 -0.794 -6.296 1.00 . A A . 22 GLN CB 1 1 13 6796 1 1 1 GLN CD C -3.884 -3.148 -6.879 1.00 . A A . 22 GLN CD 1 1 13 6797 1 1 1 GLN CG C -3.662 -1.886 -6.047 1.00 . A A . 22 GLN CG 1 1 13 6798 1 1 1 GLN H1 H -6.979 0.681 -5.707 1.00 . A A . 22 GLN H1 1 1 13 6799 1 1 1 GLN H2 H -7.045 0.164 -7.270 1.00 . A A . 22 GLN H2 1 1 13 6800 1 1 1 GLN H3 H -8.085 -0.439 -6.149 1.00 . A A . 22 GLN H3 1 1 13 6801 1 1 1 GLN HA H -6.431 -2.070 -6.595 1.00 . A A . 22 GLN HA 1 1 13 6802 1 1 1 GLN HB2 H -4.663 -0.500 -7.345 1.00 . A A . 22 GLN HB2 1 1 13 6803 1 1 1 GLN HB3 H -4.461 0.076 -5.692 1.00 . A A . 22 GLN HB3 1 1 13 6804 1 1 1 GLN HE21 H -2.124 -2.980 -7.866 1.00 . A A . 22 GLN HE21 1 1 13 6805 1 1 1 GLN HE22 H -3.139 -4.357 -8.281 1.00 . A A . 22 GLN HE22 1 1 13 6806 1 1 1 GLN HG2 H -2.682 -1.468 -6.280 1.00 . A A . 22 GLN HG2 1 1 13 6807 1 1 1 GLN HG3 H -3.653 -2.164 -4.993 1.00 . A A . 22 GLN HG3 1 1 13 6808 1 1 1 GLN N N -7.137 -0.119 -6.307 1.00 . A A . 22 GLN N 1 1 13 6809 1 1 1 GLN NE2 N -2.971 -3.518 -7.746 1.00 . A A . 22 GLN NE2 1 1 13 6810 1 1 1 GLN O O -6.462 -0.746 -3.657 1.00 . A A . 22 GLN O 1 1 13 6811 1 1 1 GLN OE1 O -4.895 -3.826 -6.757 1.00 . A A . 22 GLN OE1 1 1 13 6812 1 1 2 THR C C -5.901 -2.888 -1.752 1.00 . A A . 23 THR C 1 1 13 6813 1 1 2 THR CA C -6.717 -3.485 -2.905 1.00 . A A . 23 THR CA 1 1 13 6814 1 1 2 THR CB C -6.558 -5.016 -2.929 1.00 . A A . 23 THR CB 1 1 13 6815 1 1 2 THR CG2 C -7.156 -5.694 -1.697 1.00 . A A . 23 THR CG2 1 1 13 6816 1 1 2 THR H H -6.263 -3.587 -4.982 1.00 . A A . 23 THR H 1 1 13 6817 1 1 2 THR HA H -7.761 -3.270 -2.710 1.00 . A A . 23 THR HA 1 1 13 6818 1 1 2 THR HB H -5.501 -5.271 -3.011 1.00 . A A . 23 THR HB 1 1 13 6819 1 1 2 THR HG1 H -7.045 -6.484 -4.109 1.00 . A A . 23 THR HG1 1 1 13 6820 1 1 2 THR HG21 H -8.204 -5.418 -1.594 1.00 . A A . 23 THR HG21 1 1 13 6821 1 1 2 THR HG22 H -7.080 -6.778 -1.799 1.00 . A A . 23 THR HG22 1 1 13 6822 1 1 2 THR HG23 H -6.609 -5.400 -0.801 1.00 . A A . 23 THR HG23 1 1 13 6823 1 1 2 THR N N -6.387 -2.918 -4.229 1.00 . A A . 23 THR N 1 1 13 6824 1 1 2 THR O O -4.683 -2.742 -1.860 1.00 . A A . 23 THR O 1 1 13 6825 1 1 2 THR OG1 O -7.247 -5.534 -4.049 1.00 . A A . 23 THR OG1 1 1 13 6826 1 1 3 CYS C C -4.856 -2.838 1.185 1.00 . A A . 24 CYS C 1 1 13 6827 1 1 3 CYS CA C -5.999 -1.997 0.579 1.00 . A A . 24 CYS CA 1 1 13 6828 1 1 3 CYS CB C -7.139 -1.880 1.593 1.00 . A A . 24 CYS CB 1 1 13 6829 1 1 3 CYS H H -7.581 -2.679 -0.663 1.00 . A A . 24 CYS H 1 1 13 6830 1 1 3 CYS HA H -5.625 -0.997 0.352 1.00 . A A . 24 CYS HA 1 1 13 6831 1 1 3 CYS HB2 H -8.016 -1.455 1.111 1.00 . A A . 24 CYS HB2 1 1 13 6832 1 1 3 CYS HB3 H -7.400 -2.876 1.948 1.00 . A A . 24 CYS HB3 1 1 13 6833 1 1 3 CYS N N -6.576 -2.565 -0.643 1.00 . A A . 24 CYS N 1 1 13 6834 1 1 3 CYS O O -4.874 -4.069 1.116 1.00 . A A . 24 CYS O 1 1 13 6835 1 1 3 CYS SG S -6.630 -0.832 2.978 1.00 . A A . 24 CYS SG 1 1 13 6836 1 1 4 TYR C C -3.567 -3.519 4.005 1.00 . A A . 25 TYR C 1 1 13 6837 1 1 4 TYR CA C -2.947 -2.835 2.767 1.00 . A A . 25 TYR CA 1 1 13 6838 1 1 4 TYR CB C -1.860 -1.834 3.198 1.00 . A A . 25 TYR CB 1 1 13 6839 1 1 4 TYR CD1 C -3.277 -0.100 4.428 1.00 . A A . 25 TYR CD1 1 1 13 6840 1 1 4 TYR CD2 C -1.356 -1.072 5.566 1.00 . A A . 25 TYR CD2 1 1 13 6841 1 1 4 TYR CE1 C -3.566 0.667 5.571 1.00 . A A . 25 TYR CE1 1 1 13 6842 1 1 4 TYR CE2 C -1.631 -0.292 6.707 1.00 . A A . 25 TYR CE2 1 1 13 6843 1 1 4 TYR CG C -2.172 -0.976 4.420 1.00 . A A . 25 TYR CG 1 1 13 6844 1 1 4 TYR CZ C -2.741 0.581 6.710 1.00 . A A . 25 TYR CZ 1 1 13 6845 1 1 4 TYR H H -3.976 -1.169 1.901 1.00 . A A . 25 TYR H 1 1 13 6846 1 1 4 TYR HA H -2.460 -3.620 2.192 1.00 . A A . 25 TYR HA 1 1 13 6847 1 1 4 TYR HB2 H -0.969 -2.420 3.421 1.00 . A A . 25 TYR HB2 1 1 13 6848 1 1 4 TYR HB3 H -1.603 -1.183 2.363 1.00 . A A . 25 TYR HB3 1 1 13 6849 1 1 4 TYR HD1 H -3.919 -0.019 3.565 1.00 . A A . 25 TYR HD1 1 1 13 6850 1 1 4 TYR HD2 H -0.511 -1.748 5.573 1.00 . A A . 25 TYR HD2 1 1 13 6851 1 1 4 TYR HE1 H -4.429 1.311 5.592 1.00 . A A . 25 TYR HE1 1 1 13 6852 1 1 4 TYR HE2 H -0.998 -0.364 7.579 1.00 . A A . 25 TYR HE2 1 1 13 6853 1 1 4 TYR HH H -2.421 1.158 8.541 1.00 . A A . 25 TYR HH 1 1 13 6854 1 1 4 TYR N N -3.921 -2.179 1.880 1.00 . A A . 25 TYR N 1 1 13 6855 1 1 4 TYR O O -2.903 -4.334 4.649 1.00 . A A . 25 TYR O 1 1 13 6856 1 1 4 TYR OH O -3.031 1.336 7.805 1.00 . A A . 25 TYR OH 1 1 13 6857 1 1 5 ASN C C -6.921 -4.077 5.407 1.00 . A A . 26 ASN C 1 1 13 6858 1 1 5 ASN CA C -5.477 -3.570 5.600 1.00 . A A . 26 ASN CA 1 1 13 6859 1 1 5 ASN CB C -5.444 -2.323 6.505 1.00 . A A . 26 ASN CB 1 1 13 6860 1 1 5 ASN CG C -6.227 -2.508 7.795 1.00 . A A . 26 ASN CG 1 1 13 6861 1 1 5 ASN H H -5.288 -2.511 3.757 1.00 . A A . 26 ASN H 1 1 13 6862 1 1 5 ASN HA H -4.920 -4.371 6.093 1.00 . A A . 26 ASN HA 1 1 13 6863 1 1 5 ASN HB2 H -4.410 -2.092 6.760 1.00 . A A . 26 ASN HB2 1 1 13 6864 1 1 5 ASN HB3 H -5.853 -1.465 5.970 1.00 . A A . 26 ASN HB3 1 1 13 6865 1 1 5 ASN HD21 H -7.901 -1.648 7.031 1.00 . A A . 26 ASN HD21 1 1 13 6866 1 1 5 ASN HD22 H -7.985 -2.194 8.698 1.00 . A A . 26 ASN HD22 1 1 13 6867 1 1 5 ASN N N -4.823 -3.198 4.340 1.00 . A A . 26 ASN N 1 1 13 6868 1 1 5 ASN ND2 N -7.466 -2.069 7.844 1.00 . A A . 26 ASN ND2 1 1 13 6869 1 1 5 ASN O O -7.283 -5.130 5.936 1.00 . A A . 26 ASN O 1 1 13 6870 1 1 5 ASN OD1 O -5.736 -3.057 8.772 1.00 . A A . 26 ASN OD1 1 1 13 6871 1 1 6 CYS C C -9.655 -4.639 3.657 1.00 . A A . 27 CYS C 1 1 13 6872 1 1 6 CYS CA C -9.195 -3.507 4.604 1.00 . A A . 27 CYS CA 1 1 13 6873 1 1 6 CYS CB C -9.809 -2.159 4.184 1.00 . A A . 27 CYS CB 1 1 13 6874 1 1 6 CYS H H -7.378 -2.473 4.269 1.00 . A A . 27 CYS H 1 1 13 6875 1 1 6 CYS HA H -9.556 -3.747 5.605 1.00 . A A . 27 CYS HA 1 1 13 6876 1 1 6 CYS HB2 H -9.542 -1.947 3.148 1.00 . A A . 27 CYS HB2 1 1 13 6877 1 1 6 CYS HB3 H -10.897 -2.235 4.246 1.00 . A A . 27 CYS HB3 1 1 13 6878 1 1 6 CYS N N -7.742 -3.330 4.663 1.00 . A A . 27 CYS N 1 1 13 6879 1 1 6 CYS O O -10.794 -5.101 3.749 1.00 . A A . 27 CYS O 1 1 13 6880 1 1 6 CYS SG S -9.237 -0.810 5.264 1.00 . A A . 27 CYS SG 1 1 13 6881 1 1 7 GLY C C -10.098 -5.680 0.609 1.00 . A A . 28 GLY C 1 1 13 6882 1 1 7 GLY CA C -9.098 -6.090 1.707 1.00 . A A . 28 GLY CA 1 1 13 6883 1 1 7 GLY H H -7.867 -4.679 2.736 1.00 . A A . 28 GLY H 1 1 13 6884 1 1 7 GLY HA2 H -9.494 -6.974 2.209 1.00 . A A . 28 GLY HA2 1 1 13 6885 1 1 7 GLY HA3 H -8.168 -6.372 1.217 1.00 . A A . 28 GLY HA3 1 1 13 6886 1 1 7 GLY N N -8.800 -5.064 2.720 1.00 . A A . 28 GLY N 1 1 13 6887 1 1 7 GLY O O -10.483 -6.524 -0.202 1.00 . A A . 28 GLY O 1 1 13 6888 1 1 8 LYS C C -10.643 -3.420 -1.713 1.00 . A A . 29 LYS C 1 1 13 6889 1 1 8 LYS CA C -11.443 -3.863 -0.469 1.00 . A A . 29 LYS CA 1 1 13 6890 1 1 8 LYS CB C -12.226 -2.660 0.101 1.00 . A A . 29 LYS CB 1 1 13 6891 1 1 8 LYS CD C -13.523 -3.797 2.051 1.00 . A A . 29 LYS CD 1 1 13 6892 1 1 8 LYS CE C -13.522 -5.310 1.792 1.00 . A A . 29 LYS CE 1 1 13 6893 1 1 8 LYS CG C -13.584 -2.978 0.752 1.00 . A A . 29 LYS CG 1 1 13 6894 1 1 8 LYS H H -10.171 -3.776 1.256 1.00 . A A . 29 LYS H 1 1 13 6895 1 1 8 LYS HA H -12.168 -4.620 -0.765 1.00 . A A . 29 LYS HA 1 1 13 6896 1 1 8 LYS HB2 H -11.605 -2.132 0.824 1.00 . A A . 29 LYS HB2 1 1 13 6897 1 1 8 LYS HB3 H -12.436 -1.964 -0.713 1.00 . A A . 29 LYS HB3 1 1 13 6898 1 1 8 LYS HD2 H -12.643 -3.505 2.623 1.00 . A A . 29 LYS HD2 1 1 13 6899 1 1 8 LYS HD3 H -14.407 -3.555 2.646 1.00 . A A . 29 LYS HD3 1 1 13 6900 1 1 8 LYS HE2 H -14.461 -5.583 1.300 1.00 . A A . 29 LYS HE2 1 1 13 6901 1 1 8 LYS HE3 H -12.705 -5.558 1.112 1.00 . A A . 29 LYS HE3 1 1 13 6902 1 1 8 LYS HG2 H -14.048 -2.020 0.994 1.00 . A A . 29 LYS HG2 1 1 13 6903 1 1 8 LYS HG3 H -14.230 -3.477 0.029 1.00 . A A . 29 LYS HG3 1 1 13 6904 1 1 8 LYS HZ1 H -14.116 -5.864 3.706 1.00 . A A . 29 LYS HZ1 1 1 13 6905 1 1 8 LYS HZ2 H -13.367 -7.067 2.891 1.00 . A A . 29 LYS HZ2 1 1 13 6906 1 1 8 LYS HZ3 H -12.488 -5.829 3.509 1.00 . A A . 29 LYS HZ3 1 1 13 6907 1 1 8 LYS N N -10.539 -4.413 0.565 1.00 . A A . 29 LYS N 1 1 13 6908 1 1 8 LYS NZ N -13.368 -6.069 3.058 1.00 . A A . 29 LYS NZ 1 1 13 6909 1 1 8 LYS O O -9.767 -2.563 -1.558 1.00 . A A . 29 LYS O 1 1 13 6910 1 1 9 PRO C C -10.376 -1.982 -4.487 1.00 . A A . 30 PRO C 1 1 13 6911 1 1 9 PRO CA C -10.318 -3.490 -4.195 1.00 . A A . 30 PRO CA 1 1 13 6912 1 1 9 PRO CB C -11.040 -4.271 -5.300 1.00 . A A . 30 PRO CB 1 1 13 6913 1 1 9 PRO CD C -11.843 -5.042 -3.193 1.00 . A A . 30 PRO CD 1 1 13 6914 1 1 9 PRO CG C -11.502 -5.540 -4.595 1.00 . A A . 30 PRO CG 1 1 13 6915 1 1 9 PRO HA H -9.275 -3.801 -4.190 1.00 . A A . 30 PRO HA 1 1 13 6916 1 1 9 PRO HB2 H -11.915 -3.717 -5.647 1.00 . A A . 30 PRO HB2 1 1 13 6917 1 1 9 PRO HB3 H -10.376 -4.493 -6.136 1.00 . A A . 30 PRO HB3 1 1 13 6918 1 1 9 PRO HD2 H -12.876 -4.690 -3.168 1.00 . A A . 30 PRO HD2 1 1 13 6919 1 1 9 PRO HD3 H -11.701 -5.854 -2.480 1.00 . A A . 30 PRO HD3 1 1 13 6920 1 1 9 PRO HG2 H -12.366 -5.989 -5.087 1.00 . A A . 30 PRO HG2 1 1 13 6921 1 1 9 PRO HG3 H -10.674 -6.250 -4.540 1.00 . A A . 30 PRO HG3 1 1 13 6922 1 1 9 PRO N N -10.940 -3.925 -2.931 1.00 . A A . 30 PRO N 1 1 13 6923 1 1 9 PRO O O -9.453 -1.435 -5.095 1.00 . A A . 30 PRO O 1 1 13 6924 1 1 10 GLY C C -10.881 1.120 -3.458 1.00 . A A . 31 GLY C 1 1 13 6925 1 1 10 GLY CA C -11.706 0.131 -4.294 1.00 . A A . 31 GLY CA 1 1 13 6926 1 1 10 GLY H H -12.152 -1.817 -3.558 1.00 . A A . 31 GLY H 1 1 13 6927 1 1 10 GLY HA2 H -12.763 0.329 -4.109 1.00 . A A . 31 GLY HA2 1 1 13 6928 1 1 10 GLY HA3 H -11.507 0.341 -5.346 1.00 . A A . 31 GLY HA3 1 1 13 6929 1 1 10 GLY N N -11.432 -1.294 -4.036 1.00 . A A . 31 GLY N 1 1 13 6930 1 1 10 GLY O O -11.381 2.186 -3.089 1.00 . A A . 31 GLY O 1 1 13 6931 1 1 11 HIS C C -7.738 2.399 -3.233 1.00 . A A . 32 HIS C 1 1 13 6932 1 1 11 HIS CA C -8.721 1.610 -2.354 1.00 . A A . 32 HIS CA 1 1 13 6933 1 1 11 HIS CB C -8.011 0.766 -1.285 1.00 . A A . 32 HIS CB 1 1 13 6934 1 1 11 HIS CD2 C -8.433 1.332 1.175 1.00 . A A . 32 HIS CD2 1 1 13 6935 1 1 11 HIS CE1 C -10.328 0.278 1.506 1.00 . A A . 32 HIS CE1 1 1 13 6936 1 1 11 HIS CG C -8.783 0.723 0.004 1.00 . A A . 32 HIS CG 1 1 13 6937 1 1 11 HIS H H -9.287 -0.113 -3.472 1.00 . A A . 32 HIS H 1 1 13 6938 1 1 11 HIS HA H -9.305 2.361 -1.826 1.00 . A A . 32 HIS HA 1 1 13 6939 1 1 11 HIS HB2 H -7.874 -0.254 -1.640 1.00 . A A . 32 HIS HB2 1 1 13 6940 1 1 11 HIS HB3 H -7.023 1.182 -1.079 1.00 . A A . 32 HIS HB3 1 1 13 6941 1 1 11 HIS HD1 H -10.457 -0.511 -0.449 1.00 . A A . 32 HIS HD1 1 1 13 6942 1 1 11 HIS HD2 H -7.552 1.936 1.321 1.00 . A A . 32 HIS HD2 1 1 13 6943 1 1 11 HIS HE1 H -11.224 -0.115 1.973 1.00 . A A . 32 HIS HE1 1 1 13 6944 1 1 11 HIS N N -9.638 0.768 -3.120 1.00 . A A . 32 HIS N 1 1 13 6945 1 1 11 HIS ND1 N -9.969 0.067 0.226 1.00 . A A . 32 HIS ND1 1 1 13 6946 1 1 11 HIS NE2 N -9.406 1.027 2.136 1.00 . A A . 32 HIS NE2 1 1 13 6947 1 1 11 HIS O O -7.449 2.052 -4.383 1.00 . A A . 32 HIS O 1 1 13 6948 1 1 12 LEU C C -5.594 5.205 -2.109 1.00 . A A . 33 LEU C 1 1 13 6949 1 1 12 LEU CA C -6.420 4.554 -3.236 1.00 . A A . 33 LEU CA 1 1 13 6950 1 1 12 LEU CB C -7.331 5.633 -3.873 1.00 . A A . 33 LEU CB 1 1 13 6951 1 1 12 LEU CD1 C -9.055 6.367 -5.538 1.00 . A A . 33 LEU CD1 1 1 13 6952 1 1 12 LEU CD2 C -7.226 4.886 -6.306 1.00 . A A . 33 LEU CD2 1 1 13 6953 1 1 12 LEU CG C -8.134 5.220 -5.121 1.00 . A A . 33 LEU CG 1 1 13 6954 1 1 12 LEU H H -7.494 3.639 -1.683 1.00 . A A . 33 LEU H 1 1 13 6955 1 1 12 LEU HA H -5.736 4.138 -3.977 1.00 . A A . 33 LEU HA 1 1 13 6956 1 1 12 LEU HB2 H -8.034 5.976 -3.111 1.00 . A A . 33 LEU HB2 1 1 13 6957 1 1 12 LEU HB3 H -6.717 6.493 -4.150 1.00 . A A . 33 LEU HB3 1 1 13 6958 1 1 12 LEU HD11 H -9.738 6.603 -4.722 1.00 . A A . 33 LEU HD11 1 1 13 6959 1 1 12 LEU HD12 H -8.468 7.252 -5.784 1.00 . A A . 33 LEU HD12 1 1 13 6960 1 1 12 LEU HD13 H -9.642 6.070 -6.407 1.00 . A A . 33 LEU HD13 1 1 13 6961 1 1 12 LEU HD21 H -6.590 5.740 -6.542 1.00 . A A . 33 LEU HD21 1 1 13 6962 1 1 12 LEU HD22 H -6.602 4.026 -6.069 1.00 . A A . 33 LEU HD22 1 1 13 6963 1 1 12 LEU HD23 H -7.832 4.639 -7.176 1.00 . A A . 33 LEU HD23 1 1 13 6964 1 1 12 LEU HG H -8.760 4.359 -4.891 1.00 . A A . 33 LEU HG 1 1 13 6965 1 1 12 LEU N N -7.258 3.501 -2.654 1.00 . A A . 33 LEU N 1 1 13 6966 1 1 12 LEU O O -5.901 5.017 -0.928 1.00 . A A . 33 LEU O 1 1 13 6967 1 1 13 SER C C -4.609 7.821 -0.622 1.00 . A A . 34 SER C 1 1 13 6968 1 1 13 SER CA C -3.816 6.890 -1.563 1.00 . A A . 34 SER CA 1 1 13 6969 1 1 13 SER CB C -2.866 7.752 -2.402 1.00 . A A . 34 SER CB 1 1 13 6970 1 1 13 SER H H -4.411 6.124 -3.456 1.00 . A A . 34 SER H 1 1 13 6971 1 1 13 SER HA H -3.217 6.231 -0.933 1.00 . A A . 34 SER HA 1 1 13 6972 1 1 13 SER HB2 H -3.452 8.421 -3.036 1.00 . A A . 34 SER HB2 1 1 13 6973 1 1 13 SER HB3 H -2.238 8.356 -1.745 1.00 . A A . 34 SER HB3 1 1 13 6974 1 1 13 SER HG H -1.551 7.498 -3.835 1.00 . A A . 34 SER HG 1 1 13 6975 1 1 13 SER N N -4.629 6.053 -2.471 1.00 . A A . 34 SER N 1 1 13 6976 1 1 13 SER O O -4.040 8.372 0.321 1.00 . A A . 34 SER O 1 1 13 6977 1 1 13 SER OG O -2.045 6.926 -3.215 1.00 . A A . 34 SER OG 1 1 13 6978 1 1 14 SER C C -7.915 7.949 0.664 1.00 . A A . 35 SER C 1 1 13 6979 1 1 14 SER CA C -6.853 8.796 -0.063 1.00 . A A . 35 SER CA 1 1 13 6980 1 1 14 SER CB C -7.544 9.817 -0.974 1.00 . A A . 35 SER CB 1 1 13 6981 1 1 14 SER H H -6.283 7.598 -1.716 1.00 . A A . 35 SER H 1 1 13 6982 1 1 14 SER HA H -6.307 9.348 0.701 1.00 . A A . 35 SER HA 1 1 13 6983 1 1 14 SER HB2 H -8.275 10.388 -0.399 1.00 . A A . 35 SER HB2 1 1 13 6984 1 1 14 SER HB3 H -6.795 10.506 -1.368 1.00 . A A . 35 SER HB3 1 1 13 6985 1 1 14 SER HG H -8.622 9.829 -2.613 1.00 . A A . 35 SER HG 1 1 13 6986 1 1 14 SER N N -5.911 8.002 -0.870 1.00 . A A . 35 SER N 1 1 13 6987 1 1 14 SER O O -8.632 8.470 1.521 1.00 . A A . 35 SER O 1 1 13 6988 1 1 14 SER OG O -8.188 9.154 -2.056 1.00 . A A . 35 SER OG 1 1 13 6989 1 1 15 GLN C C -8.257 5.113 2.305 1.00 . A A . 36 GLN C 1 1 13 6990 1 1 15 GLN CA C -8.913 5.701 1.033 1.00 . A A . 36 GLN CA 1 1 13 6991 1 1 15 GLN CB C -9.294 4.595 0.032 1.00 . A A . 36 GLN CB 1 1 13 6992 1 1 15 GLN CD C -11.837 4.636 -0.100 1.00 . A A . 36 GLN CD 1 1 13 6993 1 1 15 GLN CG C -10.607 3.871 0.383 1.00 . A A . 36 GLN CG 1 1 13 6994 1 1 15 GLN H H -7.345 6.271 -0.303 1.00 . A A . 36 GLN H 1 1 13 6995 1 1 15 GLN HA H -9.820 6.230 1.330 1.00 . A A . 36 GLN HA 1 1 13 6996 1 1 15 GLN HB2 H -9.400 5.022 -0.966 1.00 . A A . 36 GLN HB2 1 1 13 6997 1 1 15 GLN HB3 H -8.486 3.866 -0.006 1.00 . A A . 36 GLN HB3 1 1 13 6998 1 1 15 GLN HE21 H -11.952 3.592 -1.847 1.00 . A A . 36 GLN HE21 1 1 13 6999 1 1 15 GLN HE22 H -13.163 4.841 -1.587 1.00 . A A . 36 GLN HE22 1 1 13 7000 1 1 15 GLN HG2 H -10.612 2.895 -0.098 1.00 . A A . 36 GLN HG2 1 1 13 7001 1 1 15 GLN HG3 H -10.673 3.707 1.458 1.00 . A A . 36 GLN HG3 1 1 13 7002 1 1 15 GLN N N -8.006 6.645 0.365 1.00 . A A . 36 GLN N 1 1 13 7003 1 1 15 GLN NE2 N -12.353 4.331 -1.276 1.00 . A A . 36 GLN NE2 1 1 13 7004 1 1 15 GLN O O -8.901 5.055 3.354 1.00 . A A . 36 GLN O 1 1 13 7005 1 1 15 GLN OE1 O -12.353 5.526 0.564 1.00 . A A . 36 GLN OE1 1 1 13 7006 1 1 16 CYS C C -4.620 4.963 2.978 1.00 . A A . 37 CYS C 1 1 13 7007 1 1 16 CYS CA C -6.036 4.431 3.296 1.00 . A A . 37 CYS CA 1 1 13 7008 1 1 16 CYS CB C -5.987 2.901 3.498 1.00 . A A . 37 CYS CB 1 1 13 7009 1 1 16 CYS H H -6.528 4.901 1.300 1.00 . A A . 37 CYS H 1 1 13 7010 1 1 16 CYS HA H -6.364 4.901 4.223 1.00 . A A . 37 CYS HA 1 1 13 7011 1 1 16 CYS HB2 H -5.956 2.395 2.534 1.00 . A A . 37 CYS HB2 1 1 13 7012 1 1 16 CYS HB3 H -5.063 2.634 4.010 1.00 . A A . 37 CYS HB3 1 1 13 7013 1 1 16 CYS N N -6.962 4.777 2.208 1.00 . A A . 37 CYS N 1 1 13 7014 1 1 16 CYS O O -4.355 5.470 1.885 1.00 . A A . 37 CYS O 1 1 13 7015 1 1 16 CYS SG S -7.367 2.320 4.519 1.00 . A A . 37 CYS SG 1 1 13 7016 1 1 17 ARG C C -1.562 4.534 2.609 1.00 . A A . 38 ARG C 1 1 13 7017 1 1 17 ARG CA C -2.272 5.178 3.807 1.00 . A A . 38 ARG CA 1 1 13 7018 1 1 17 ARG CB C -1.547 4.857 5.126 1.00 . A A . 38 ARG CB 1 1 13 7019 1 1 17 ARG CD C -2.313 5.047 7.573 1.00 . A A . 38 ARG CD 1 1 13 7020 1 1 17 ARG CG C -1.964 5.794 6.277 1.00 . A A . 38 ARG CG 1 1 13 7021 1 1 17 ARG CZ C -4.794 4.646 7.451 1.00 . A A . 38 ARG CZ 1 1 13 7022 1 1 17 ARG H H -3.999 4.386 4.801 1.00 . A A . 38 ARG H 1 1 13 7023 1 1 17 ARG HA H -2.210 6.255 3.636 1.00 . A A . 38 ARG HA 1 1 13 7024 1 1 17 ARG HB2 H -1.733 3.814 5.390 1.00 . A A . 38 ARG HB2 1 1 13 7025 1 1 17 ARG HB3 H -0.472 4.973 4.977 1.00 . A A . 38 ARG HB3 1 1 13 7026 1 1 17 ARG HD2 H -1.476 4.399 7.839 1.00 . A A . 38 ARG HD2 1 1 13 7027 1 1 17 ARG HD3 H -2.432 5.772 8.381 1.00 . A A . 38 ARG HD3 1 1 13 7028 1 1 17 ARG HE H -3.407 3.225 7.443 1.00 . A A . 38 ARG HE 1 1 13 7029 1 1 17 ARG HG2 H -1.136 6.472 6.482 1.00 . A A . 38 ARG HG2 1 1 13 7030 1 1 17 ARG HG3 H -2.815 6.408 5.978 1.00 . A A . 38 ARG HG3 1 1 13 7031 1 1 17 ARG HH11 H -4.394 6.591 7.670 1.00 . A A . 38 ARG HH11 1 1 13 7032 1 1 17 ARG HH12 H -6.083 6.187 7.561 1.00 . A A . 38 ARG HH12 1 1 13 7033 1 1 17 ARG HH21 H -5.563 2.804 7.266 1.00 . A A . 38 ARG HH21 1 1 13 7034 1 1 17 ARG HH22 H -6.717 4.100 7.272 1.00 . A A . 38 ARG HH22 1 1 13 7035 1 1 17 ARG N N -3.693 4.803 3.933 1.00 . A A . 38 ARG N 1 1 13 7036 1 1 17 ARG NE N -3.539 4.230 7.452 1.00 . A A . 38 ARG NE 1 1 13 7037 1 1 17 ARG NH1 N -5.117 5.904 7.546 1.00 . A A . 38 ARG NH1 1 1 13 7038 1 1 17 ARG NH2 N -5.762 3.788 7.331 1.00 . A A . 38 ARG NH2 1 1 13 7039 1 1 17 ARG O O -0.711 5.191 2.008 1.00 . A A . 38 ARG O 1 1 13 7040 1 1 18 ALA C C -2.339 1.466 0.550 1.00 . A A . 39 ALA C 1 1 13 7041 1 1 18 ALA CA C -1.442 2.645 1.002 1.00 . A A . 39 ALA CA 1 1 13 7042 1 1 18 ALA CB C -0.019 2.121 1.259 1.00 . A A . 39 ALA CB 1 1 13 7043 1 1 18 ALA H H -2.612 2.820 2.775 1.00 . A A . 39 ALA H 1 1 13 7044 1 1 18 ALA HA H -1.414 3.385 0.202 1.00 . A A . 39 ALA HA 1 1 13 7045 1 1 18 ALA HB1 H 0.645 2.941 1.527 1.00 . A A . 39 ALA HB1 1 1 13 7046 1 1 18 ALA HB2 H -0.046 1.387 2.063 1.00 . A A . 39 ALA HB2 1 1 13 7047 1 1 18 ALA HB3 H 0.372 1.638 0.364 1.00 . A A . 39 ALA HB3 1 1 13 7048 1 1 18 ALA N N -1.920 3.304 2.225 1.00 . A A . 39 ALA N 1 1 13 7049 1 1 18 ALA O O -3.065 0.892 1.369 1.00 . A A . 39 ALA O 1 1 13 7050 1 1 19 PRO C C -1.681 -1.387 -0.680 1.00 . A A . 40 PRO C 1 1 13 7051 1 1 19 PRO CA C -2.668 -0.297 -1.155 1.00 . A A . 40 PRO CA 1 1 13 7052 1 1 19 PRO CB C -2.722 -0.205 -2.684 1.00 . A A . 40 PRO CB 1 1 13 7053 1 1 19 PRO CD C -1.656 1.769 -1.842 1.00 . A A . 40 PRO CD 1 1 13 7054 1 1 19 PRO CG C -1.617 0.795 -3.019 1.00 . A A . 40 PRO CG 1 1 13 7055 1 1 19 PRO HA H -3.662 -0.527 -0.773 1.00 . A A . 40 PRO HA 1 1 13 7056 1 1 19 PRO HB2 H -2.553 -1.165 -3.169 1.00 . A A . 40 PRO HB2 1 1 13 7057 1 1 19 PRO HB3 H -3.687 0.207 -2.987 1.00 . A A . 40 PRO HB3 1 1 13 7058 1 1 19 PRO HD2 H -0.647 2.115 -1.617 1.00 . A A . 40 PRO HD2 1 1 13 7059 1 1 19 PRO HD3 H -2.293 2.619 -2.092 1.00 . A A . 40 PRO HD3 1 1 13 7060 1 1 19 PRO HG2 H -0.654 0.284 -3.036 1.00 . A A . 40 PRO HG2 1 1 13 7061 1 1 19 PRO HG3 H -1.799 1.299 -3.967 1.00 . A A . 40 PRO HG3 1 1 13 7062 1 1 19 PRO N N -2.247 1.038 -0.724 1.00 . A A . 40 PRO N 1 1 13 7063 1 1 19 PRO O O -0.599 -1.087 -0.171 1.00 . A A . 40 PRO O 1 1 13 7064 1 1 20 LYS C C 0.204 -3.933 -1.074 1.00 . A A . 41 LYS C 1 1 13 7065 1 1 20 LYS CA C -1.240 -3.878 -0.543 1.00 . A A . 41 LYS CA 1 1 13 7066 1 1 20 LYS CB C -2.036 -5.139 -0.959 1.00 . A A . 41 LYS CB 1 1 13 7067 1 1 20 LYS CD C -0.990 -6.796 0.739 1.00 . A A . 41 LYS CD 1 1 13 7068 1 1 20 LYS CE C -1.369 -7.890 1.745 1.00 . A A . 41 LYS CE 1 1 13 7069 1 1 20 LYS CG C -2.267 -6.159 0.170 1.00 . A A . 41 LYS CG 1 1 13 7070 1 1 20 LYS H H -2.931 -2.817 -1.332 1.00 . A A . 41 LYS H 1 1 13 7071 1 1 20 LYS HA H -1.139 -3.872 0.541 1.00 . A A . 41 LYS HA 1 1 13 7072 1 1 20 LYS HB2 H -3.022 -4.845 -1.321 1.00 . A A . 41 LYS HB2 1 1 13 7073 1 1 20 LYS HB3 H -1.535 -5.636 -1.791 1.00 . A A . 41 LYS HB3 1 1 13 7074 1 1 20 LYS HD2 H -0.408 -7.231 -0.076 1.00 . A A . 41 LYS HD2 1 1 13 7075 1 1 20 LYS HD3 H -0.395 -6.035 1.244 1.00 . A A . 41 LYS HD3 1 1 13 7076 1 1 20 LYS HE2 H -1.983 -7.444 2.535 1.00 . A A . 41 LYS HE2 1 1 13 7077 1 1 20 LYS HE3 H -1.979 -8.641 1.233 1.00 . A A . 41 LYS HE3 1 1 13 7078 1 1 20 LYS HG2 H -2.806 -5.676 0.984 1.00 . A A . 41 LYS HG2 1 1 13 7079 1 1 20 LYS HG3 H -2.902 -6.953 -0.227 1.00 . A A . 41 LYS HG3 1 1 13 7080 1 1 20 LYS HZ1 H 0.408 -8.966 1.630 1.00 . A A . 41 LYS HZ1 1 1 13 7081 1 1 20 LYS HZ2 H 0.398 -7.867 2.845 1.00 . A A . 41 LYS HZ2 1 1 13 7082 1 1 20 LYS HZ3 H -0.434 -9.260 2.993 1.00 . A A . 41 LYS HZ3 1 1 13 7083 1 1 20 LYS N N -2.018 -2.666 -0.909 1.00 . A A . 41 LYS N 1 1 13 7084 1 1 20 LYS NZ N -0.168 -8.535 2.340 1.00 . A A . 41 LYS NZ 1 1 13 7085 1 1 20 LYS O O 0.991 -4.767 -0.629 1.00 . A A . 41 LYS O 1 1 13 7086 1 1 21 VAL C C 2.869 -2.369 -1.199 1.00 . A A . 42 VAL C 1 1 13 7087 1 1 21 VAL CA C 1.966 -2.748 -2.390 1.00 . A A . 42 VAL CA 1 1 13 7088 1 1 21 VAL CB C 1.968 -1.614 -3.441 1.00 . A A . 42 VAL CB 1 1 13 7089 1 1 21 VAL CG1 C 3.370 -1.283 -3.954 1.00 . A A . 42 VAL CG1 1 1 13 7090 1 1 21 VAL CG2 C 1.109 -1.974 -4.664 1.00 . A A . 42 VAL CG2 1 1 13 7091 1 1 21 VAL H H -0.140 -2.402 -2.304 1.00 . A A . 42 VAL H 1 1 13 7092 1 1 21 VAL HA H 2.384 -3.646 -2.850 1.00 . A A . 42 VAL HA 1 1 13 7093 1 1 21 VAL HB H 1.553 -0.715 -2.985 1.00 . A A . 42 VAL HB 1 1 13 7094 1 1 21 VAL HG11 H 3.835 -2.179 -4.366 1.00 . A A . 42 VAL HG11 1 1 13 7095 1 1 21 VAL HG12 H 3.314 -0.519 -4.731 1.00 . A A . 42 VAL HG12 1 1 13 7096 1 1 21 VAL HG13 H 3.987 -0.893 -3.145 1.00 . A A . 42 VAL HG13 1 1 13 7097 1 1 21 VAL HG21 H 1.479 -2.892 -5.123 1.00 . A A . 42 VAL HG21 1 1 13 7098 1 1 21 VAL HG22 H 0.066 -2.110 -4.380 1.00 . A A . 42 VAL HG22 1 1 13 7099 1 1 21 VAL HG23 H 1.152 -1.167 -5.397 1.00 . A A . 42 VAL HG23 1 1 13 7100 1 1 21 VAL N N 0.578 -3.027 -1.975 1.00 . A A . 42 VAL N 1 1 13 7101 1 1 21 VAL O O 4.039 -2.753 -1.173 1.00 . A A . 42 VAL O 1 1 13 7102 1 1 22 CYS C C 2.223 -0.927 2.167 1.00 . A A . 43 CYS C 1 1 13 7103 1 1 22 CYS CA C 3.077 -1.001 0.875 1.00 . A A . 43 CYS CA 1 1 13 7104 1 1 22 CYS CB C 3.521 0.374 0.333 1.00 . A A . 43 CYS CB 1 1 13 7105 1 1 22 CYS H H 1.341 -1.432 -0.266 1.00 . A A . 43 CYS H 1 1 13 7106 1 1 22 CYS HA H 3.971 -1.585 1.100 1.00 . A A . 43 CYS HA 1 1 13 7107 1 1 22 CYS HB2 H 3.959 0.232 -0.656 1.00 . A A . 43 CYS HB2 1 1 13 7108 1 1 22 CYS HB3 H 2.650 1.023 0.228 1.00 . A A . 43 CYS HB3 1 1 13 7109 1 1 22 CYS N N 2.332 -1.644 -0.213 1.00 . A A . 43 CYS N 1 1 13 7110 1 1 22 CYS O O 1.348 -1.763 2.405 1.00 . A A . 43 CYS O 1 1 13 7111 1 1 22 CYS SG S 4.763 1.159 1.396 1.00 . A A . 43 CYS SG 1 1 13 7112 1 1 23 PHE C C 1.594 2.004 4.314 1.00 . A A . 44 PHE C 1 1 13 7113 1 1 23 PHE CA C 1.709 0.471 4.175 1.00 . A A . 44 PHE CA 1 1 13 7114 1 1 23 PHE CB C 2.304 -0.146 5.452 1.00 . A A . 44 PHE CB 1 1 13 7115 1 1 23 PHE CD1 C 4.807 0.310 5.396 1.00 . A A . 44 PHE CD1 1 1 13 7116 1 1 23 PHE CD2 C 3.431 1.503 7.013 1.00 . A A . 44 PHE CD2 1 1 13 7117 1 1 23 PHE CE1 C 5.941 1.004 5.855 1.00 . A A . 44 PHE CE1 1 1 13 7118 1 1 23 PHE CE2 C 4.565 2.198 7.469 1.00 . A A . 44 PHE CE2 1 1 13 7119 1 1 23 PHE CG C 3.546 0.560 5.973 1.00 . A A . 44 PHE CG 1 1 13 7120 1 1 23 PHE CZ C 5.821 1.949 6.888 1.00 . A A . 44 PHE CZ 1 1 13 7121 1 1 23 PHE H H 3.294 0.628 2.749 1.00 . A A . 44 PHE H 1 1 13 7122 1 1 23 PHE HA H 0.695 0.086 4.056 1.00 . A A . 44 PHE HA 1 1 13 7123 1 1 23 PHE HB2 H 1.540 -0.114 6.230 1.00 . A A . 44 PHE HB2 1 1 13 7124 1 1 23 PHE HB3 H 2.534 -1.199 5.275 1.00 . A A . 44 PHE HB3 1 1 13 7125 1 1 23 PHE HD1 H 4.908 -0.413 4.597 1.00 . A A . 44 PHE HD1 1 1 13 7126 1 1 23 PHE HD2 H 2.465 1.707 7.456 1.00 . A A . 44 PHE HD2 1 1 13 7127 1 1 23 PHE HE1 H 6.909 0.812 5.412 1.00 . A A . 44 PHE HE1 1 1 13 7128 1 1 23 PHE HE2 H 4.471 2.924 8.266 1.00 . A A . 44 PHE HE2 1 1 13 7129 1 1 23 PHE HZ H 6.696 2.483 7.239 1.00 . A A . 44 PHE HZ 1 1 13 7130 1 1 23 PHE N N 2.501 0.063 3.012 1.00 . A A . 44 PHE N 1 1 13 7131 1 1 23 PHE O O 0.646 2.477 4.943 1.00 . A A . 44 PHE O 1 1 13 7132 1 1 24 LYS C C 3.292 4.937 2.632 1.00 . A A . 45 LYS C 1 1 13 7133 1 1 24 LYS CA C 2.522 4.263 3.778 1.00 . A A . 45 LYS CA 1 1 13 7134 1 1 24 LYS CB C 3.096 4.693 5.144 1.00 . A A . 45 LYS CB 1 1 13 7135 1 1 24 LYS CD C 3.519 6.556 6.793 1.00 . A A . 45 LYS CD 1 1 13 7136 1 1 24 LYS CE C 3.384 8.063 7.049 1.00 . A A . 45 LYS CE 1 1 13 7137 1 1 24 LYS CG C 2.977 6.203 5.401 1.00 . A A . 45 LYS CG 1 1 13 7138 1 1 24 LYS H H 3.268 2.326 3.221 1.00 . A A . 45 LYS H 1 1 13 7139 1 1 24 LYS HA H 1.494 4.618 3.709 1.00 . A A . 45 LYS HA 1 1 13 7140 1 1 24 LYS HB2 H 2.552 4.175 5.936 1.00 . A A . 45 LYS HB2 1 1 13 7141 1 1 24 LYS HB3 H 4.146 4.397 5.210 1.00 . A A . 45 LYS HB3 1 1 13 7142 1 1 24 LYS HD2 H 2.958 6.007 7.550 1.00 . A A . 45 LYS HD2 1 1 13 7143 1 1 24 LYS HD3 H 4.571 6.269 6.852 1.00 . A A . 45 LYS HD3 1 1 13 7144 1 1 24 LYS HE2 H 3.925 8.603 6.265 1.00 . A A . 45 LYS HE2 1 1 13 7145 1 1 24 LYS HE3 H 2.328 8.338 6.977 1.00 . A A . 45 LYS HE3 1 1 13 7146 1 1 24 LYS HG2 H 3.546 6.752 4.650 1.00 . A A . 45 LYS HG2 1 1 13 7147 1 1 24 LYS HG3 H 1.928 6.496 5.336 1.00 . A A . 45 LYS HG3 1 1 13 7148 1 1 24 LYS HZ1 H 3.425 7.962 9.127 1.00 . A A . 45 LYS HZ1 1 1 13 7149 1 1 24 LYS HZ2 H 4.899 8.213 8.465 1.00 . A A . 45 LYS HZ2 1 1 13 7150 1 1 24 LYS HZ3 H 3.821 9.434 8.546 1.00 . A A . 45 LYS HZ3 1 1 13 7151 1 1 24 LYS N N 2.519 2.785 3.721 1.00 . A A . 45 LYS N 1 1 13 7152 1 1 24 LYS NZ N 3.917 8.439 8.384 1.00 . A A . 45 LYS NZ 1 1 13 7153 1 1 24 LYS O O 2.728 5.797 1.952 1.00 . A A . 45 LYS O 1 1 13 7154 1 1 25 CYS C C 5.199 5.001 -0.008 1.00 . A A . 46 CYS C 1 1 13 7155 1 1 25 CYS CA C 5.473 5.257 1.492 1.00 . A A . 46 CYS CA 1 1 13 7156 1 1 25 CYS CB C 6.930 4.956 1.902 1.00 . A A . 46 CYS CB 1 1 13 7157 1 1 25 CYS H H 4.976 3.881 3.018 1.00 . A A . 46 CYS H 1 1 13 7158 1 1 25 CYS HA H 5.335 6.331 1.633 1.00 . A A . 46 CYS HA 1 1 13 7159 1 1 25 CYS HB2 H 7.585 5.078 1.035 1.00 . A A . 46 CYS HB2 1 1 13 7160 1 1 25 CYS HB3 H 7.231 5.698 2.643 1.00 . A A . 46 CYS HB3 1 1 13 7161 1 1 25 CYS N N 4.558 4.574 2.415 1.00 . A A . 46 CYS N 1 1 13 7162 1 1 25 CYS O O 5.387 5.917 -0.811 1.00 . A A . 46 CYS O 1 1 13 7163 1 1 25 CYS SG S 7.161 3.306 2.627 1.00 . A A . 46 CYS SG 1 1 13 7164 1 1 26 LYS C C 4.786 3.898 -2.984 1.00 . A A . 47 LYS C 1 1 13 7165 1 1 26 LYS CA C 4.086 3.431 -1.682 1.00 . A A . 47 LYS CA 1 1 13 7166 1 1 26 LYS CB C 2.567 3.723 -1.642 1.00 . A A . 47 LYS CB 1 1 13 7167 1 1 26 LYS CD C 0.703 5.428 -1.387 1.00 . A A . 47 LYS CD 1 1 13 7168 1 1 26 LYS CE C 0.393 6.869 -0.957 1.00 . A A . 47 LYS CE 1 1 13 7169 1 1 26 LYS CG C 2.216 5.214 -1.522 1.00 . A A . 47 LYS CG 1 1 13 7170 1 1 26 LYS H H 4.609 3.131 0.370 1.00 . A A . 47 LYS H 1 1 13 7171 1 1 26 LYS HA H 4.161 2.346 -1.741 1.00 . A A . 47 LYS HA 1 1 13 7172 1 1 26 LYS HB2 H 2.093 3.315 -2.536 1.00 . A A . 47 LYS HB2 1 1 13 7173 1 1 26 LYS HB3 H 2.144 3.200 -0.783 1.00 . A A . 47 LYS HB3 1 1 13 7174 1 1 26 LYS HD2 H 0.232 5.233 -2.350 1.00 . A A . 47 LYS HD2 1 1 13 7175 1 1 26 LYS HD3 H 0.289 4.738 -0.652 1.00 . A A . 47 LYS HD3 1 1 13 7176 1 1 26 LYS HE2 H 0.972 7.558 -1.579 1.00 . A A . 47 LYS HE2 1 1 13 7177 1 1 26 LYS HE3 H -0.666 7.059 -1.143 1.00 . A A . 47 LYS HE3 1 1 13 7178 1 1 26 LYS HG2 H 2.699 5.625 -0.642 1.00 . A A . 47 LYS HG2 1 1 13 7179 1 1 26 LYS HG3 H 2.578 5.754 -2.397 1.00 . A A . 47 LYS HG3 1 1 13 7180 1 1 26 LYS HZ1 H 1.639 6.845 0.727 1.00 . A A . 47 LYS HZ1 1 1 13 7181 1 1 26 LYS HZ2 H 0.527 8.057 0.752 1.00 . A A . 47 LYS HZ2 1 1 13 7182 1 1 26 LYS HZ3 H 0.094 6.504 1.065 1.00 . A A . 47 LYS HZ3 1 1 13 7183 1 1 26 LYS N N 4.687 3.814 -0.376 1.00 . A A . 47 LYS N 1 1 13 7184 1 1 26 LYS NZ N 0.684 7.095 0.484 1.00 . A A . 47 LYS NZ 1 1 13 7185 1 1 26 LYS O O 4.137 4.017 -4.024 1.00 . A A . 47 LYS O 1 1 13 7186 1 1 27 GLN C C 6.993 3.420 -5.193 1.00 . A A . 48 GLN C 1 1 13 7187 1 1 27 GLN CA C 6.889 4.549 -4.134 1.00 . A A . 48 GLN CA 1 1 13 7188 1 1 27 GLN CB C 8.293 5.015 -3.694 1.00 . A A . 48 GLN CB 1 1 13 7189 1 1 27 GLN CD C 7.562 7.428 -3.273 1.00 . A A . 48 GLN CD 1 1 13 7190 1 1 27 GLN CG C 8.293 6.204 -2.719 1.00 . A A . 48 GLN CG 1 1 13 7191 1 1 27 GLN H H 6.571 4.053 -2.069 1.00 . A A . 48 GLN H 1 1 13 7192 1 1 27 GLN HA H 6.372 5.394 -4.585 1.00 . A A . 48 GLN HA 1 1 13 7193 1 1 27 GLN HB2 H 8.814 4.186 -3.221 1.00 . A A . 48 GLN HB2 1 1 13 7194 1 1 27 GLN HB3 H 8.865 5.303 -4.576 1.00 . A A . 48 GLN HB3 1 1 13 7195 1 1 27 GLN HE21 H 5.986 7.177 -2.030 1.00 . A A . 48 GLN HE21 1 1 13 7196 1 1 27 GLN HE22 H 5.910 8.555 -3.133 1.00 . A A . 48 GLN HE22 1 1 13 7197 1 1 27 GLN HG2 H 7.847 5.902 -1.770 1.00 . A A . 48 GLN HG2 1 1 13 7198 1 1 27 GLN HG3 H 9.326 6.485 -2.511 1.00 . A A . 48 GLN HG3 1 1 13 7199 1 1 27 GLN N N 6.100 4.145 -2.956 1.00 . A A . 48 GLN N 1 1 13 7200 1 1 27 GLN NE2 N 6.390 7.748 -2.768 1.00 . A A . 48 GLN NE2 1 1 13 7201 1 1 27 GLN O O 6.963 2.247 -4.806 1.00 . A A . 48 GLN O 1 1 13 7202 1 1 27 GLN OE1 O 8.026 8.105 -4.181 1.00 . A A . 48 GLN OE1 1 1 13 7203 1 1 28 PRO C C 7.783 1.456 -7.631 1.00 . A A . 49 PRO C 1 1 13 7204 1 1 28 PRO CA C 7.018 2.797 -7.634 1.00 . A A . 49 PRO CA 1 1 13 7205 1 1 28 PRO CB C 7.406 3.600 -8.880 1.00 . A A . 49 PRO CB 1 1 13 7206 1 1 28 PRO CD C 7.321 5.091 -7.026 1.00 . A A . 49 PRO CD 1 1 13 7207 1 1 28 PRO CG C 7.008 5.023 -8.516 1.00 . A A . 49 PRO CG 1 1 13 7208 1 1 28 PRO HA H 5.955 2.558 -7.709 1.00 . A A . 49 PRO HA 1 1 13 7209 1 1 28 PRO HB2 H 8.486 3.556 -9.034 1.00 . A A . 49 PRO HB2 1 1 13 7210 1 1 28 PRO HB3 H 6.879 3.249 -9.768 1.00 . A A . 49 PRO HB3 1 1 13 7211 1 1 28 PRO HD2 H 8.355 5.415 -6.888 1.00 . A A . 49 PRO HD2 1 1 13 7212 1 1 28 PRO HD3 H 6.642 5.802 -6.558 1.00 . A A . 49 PRO HD3 1 1 13 7213 1 1 28 PRO HG2 H 7.573 5.762 -9.084 1.00 . A A . 49 PRO HG2 1 1 13 7214 1 1 28 PRO HG3 H 5.935 5.155 -8.672 1.00 . A A . 49 PRO HG3 1 1 13 7215 1 1 28 PRO N N 7.163 3.733 -6.500 1.00 . A A . 49 PRO N 1 1 13 7216 1 1 28 PRO O O 7.397 0.554 -8.379 1.00 . A A . 49 PRO O 1 1 13 7217 1 1 29 GLY C C 10.343 -0.231 -5.426 1.00 . A A . 50 GLY C 1 1 13 7218 1 1 29 GLY CA C 9.626 0.046 -6.758 1.00 . A A . 50 GLY CA 1 1 13 7219 1 1 29 GLY H H 9.155 2.100 -6.309 1.00 . A A . 50 GLY H 1 1 13 7220 1 1 29 GLY HA2 H 10.383 0.066 -7.543 1.00 . A A . 50 GLY HA2 1 1 13 7221 1 1 29 GLY HA3 H 8.969 -0.803 -6.948 1.00 . A A . 50 GLY HA3 1 1 13 7222 1 1 29 GLY N N 8.844 1.297 -6.832 1.00 . A A . 50 GLY N 1 1 13 7223 1 1 29 GLY O O 11.005 -1.262 -5.294 1.00 . A A . 50 GLY O 1 1 13 7224 1 1 30 HIS C C 10.494 -0.693 -2.309 1.00 . A A . 51 HIS C 1 1 13 7225 1 1 30 HIS CA C 10.901 0.549 -3.132 1.00 . A A . 51 HIS CA 1 1 13 7226 1 1 30 HIS CB C 10.618 1.829 -2.322 1.00 . A A . 51 HIS CB 1 1 13 7227 1 1 30 HIS CD2 C 9.107 1.644 -0.267 1.00 . A A . 51 HIS CD2 1 1 13 7228 1 1 30 HIS CE1 C 7.140 1.449 -1.225 1.00 . A A . 51 HIS CE1 1 1 13 7229 1 1 30 HIS CG C 9.279 1.807 -1.615 1.00 . A A . 51 HIS CG 1 1 13 7230 1 1 30 HIS H H 9.668 1.482 -4.603 1.00 . A A . 51 HIS H 1 1 13 7231 1 1 30 HIS HA H 11.976 0.490 -3.313 1.00 . A A . 51 HIS HA 1 1 13 7232 1 1 30 HIS HB2 H 11.397 1.927 -1.564 1.00 . A A . 51 HIS HB2 1 1 13 7233 1 1 30 HIS HB3 H 10.682 2.705 -2.968 1.00 . A A . 51 HIS HB3 1 1 13 7234 1 1 30 HIS HD1 H 7.800 1.774 -3.186 1.00 . A A . 51 HIS HD1 1 1 13 7235 1 1 30 HIS HD2 H 9.897 1.604 0.469 1.00 . A A . 51 HIS HD2 1 1 13 7236 1 1 30 HIS HE1 H 6.084 1.278 -1.382 1.00 . A A . 51 HIS HE1 1 1 13 7237 1 1 30 HIS N N 10.220 0.657 -4.434 1.00 . A A . 51 HIS N 1 1 13 7238 1 1 30 HIS ND1 N 8.032 1.695 -2.196 1.00 . A A . 51 HIS ND1 1 1 13 7239 1 1 30 HIS NE2 N 7.746 1.418 -0.029 1.00 . A A . 51 HIS NE2 1 1 13 7240 1 1 30 HIS O O 11.272 -1.196 -1.495 1.00 . A A . 51 HIS O 1 1 13 7241 1 1 31 PHE C C 9.354 -3.500 -1.608 1.00 . A A . 52 PHE C 1 1 13 7242 1 1 31 PHE CA C 8.606 -2.162 -1.633 1.00 . A A . 52 PHE CA 1 1 13 7243 1 1 31 PHE CB C 7.137 -2.319 -2.059 1.00 . A A . 52 PHE CB 1 1 13 7244 1 1 31 PHE CD1 C 6.946 -3.669 -4.208 1.00 . A A . 52 PHE CD1 1 1 13 7245 1 1 31 PHE CD2 C 6.611 -1.260 -4.302 1.00 . A A . 52 PHE CD2 1 1 13 7246 1 1 31 PHE CE1 C 6.734 -3.750 -5.596 1.00 . A A . 52 PHE CE1 1 1 13 7247 1 1 31 PHE CE2 C 6.386 -1.344 -5.685 1.00 . A A . 52 PHE CE2 1 1 13 7248 1 1 31 PHE CG C 6.891 -2.422 -3.555 1.00 . A A . 52 PHE CG 1 1 13 7249 1 1 31 PHE CZ C 6.456 -2.587 -6.336 1.00 . A A . 52 PHE CZ 1 1 13 7250 1 1 31 PHE H H 8.693 -0.725 -3.196 1.00 . A A . 52 PHE H 1 1 13 7251 1 1 31 PHE HA H 8.611 -1.782 -0.611 1.00 . A A . 52 PHE HA 1 1 13 7252 1 1 31 PHE HB2 H 6.720 -3.198 -1.569 1.00 . A A . 52 PHE HB2 1 1 13 7253 1 1 31 PHE HB3 H 6.585 -1.458 -1.682 1.00 . A A . 52 PHE HB3 1 1 13 7254 1 1 31 PHE HD1 H 7.154 -4.570 -3.647 1.00 . A A . 52 PHE HD1 1 1 13 7255 1 1 31 PHE HD2 H 6.538 -0.301 -3.810 1.00 . A A . 52 PHE HD2 1 1 13 7256 1 1 31 PHE HE1 H 6.786 -4.708 -6.095 1.00 . A A . 52 PHE HE1 1 1 13 7257 1 1 31 PHE HE2 H 6.149 -0.451 -6.246 1.00 . A A . 52 PHE HE2 1 1 13 7258 1 1 31 PHE HZ H 6.288 -2.650 -7.404 1.00 . A A . 52 PHE HZ 1 1 13 7259 1 1 31 PHE N N 9.259 -1.171 -2.491 1.00 . A A . 52 PHE N 1 1 13 7260 1 1 31 PHE O O 9.593 -4.041 -0.529 1.00 . A A . 52 PHE O 1 1 13 7261 1 1 32 SER C C 12.004 -5.150 -2.167 1.00 . A A . 53 SER C 1 1 13 7262 1 1 32 SER CA C 10.655 -5.188 -2.907 1.00 . A A . 53 SER CA 1 1 13 7263 1 1 32 SER CB C 10.913 -5.463 -4.395 1.00 . A A . 53 SER CB 1 1 13 7264 1 1 32 SER H H 9.591 -3.479 -3.610 1.00 . A A . 53 SER H 1 1 13 7265 1 1 32 SER HA H 10.090 -6.028 -2.502 1.00 . A A . 53 SER HA 1 1 13 7266 1 1 32 SER HB2 H 11.507 -4.648 -4.815 1.00 . A A . 53 SER HB2 1 1 13 7267 1 1 32 SER HB3 H 11.468 -6.395 -4.500 1.00 . A A . 53 SER HB3 1 1 13 7268 1 1 32 SER HG H 9.888 -5.764 -6.039 1.00 . A A . 53 SER HG 1 1 13 7269 1 1 32 SER N N 9.837 -3.970 -2.761 1.00 . A A . 53 SER N 1 1 13 7270 1 1 32 SER O O 12.709 -6.161 -2.139 1.00 . A A . 53 SER O 1 1 13 7271 1 1 32 SER OG O 9.687 -5.567 -5.104 1.00 . A A . 53 SER OG 1 1 13 7272 1 1 33 LYS C C 13.454 -3.179 0.555 1.00 . A A . 54 LYS C 1 1 13 7273 1 1 33 LYS CA C 13.642 -3.747 -0.867 1.00 . A A . 54 LYS CA 1 1 13 7274 1 1 33 LYS CB C 14.502 -2.786 -1.723 1.00 . A A . 54 LYS CB 1 1 13 7275 1 1 33 LYS CD C 15.576 -4.513 -3.300 1.00 . A A . 54 LYS CD 1 1 13 7276 1 1 33 LYS CE C 15.695 -4.917 -4.774 1.00 . A A . 54 LYS CE 1 1 13 7277 1 1 33 LYS CG C 14.753 -3.221 -3.180 1.00 . A A . 54 LYS CG 1 1 13 7278 1 1 33 LYS H H 11.748 -3.215 -1.679 1.00 . A A . 54 LYS H 1 1 13 7279 1 1 33 LYS HA H 14.186 -4.684 -0.741 1.00 . A A . 54 LYS HA 1 1 13 7280 1 1 33 LYS HB2 H 14.011 -1.813 -1.747 1.00 . A A . 54 LYS HB2 1 1 13 7281 1 1 33 LYS HB3 H 15.470 -2.650 -1.239 1.00 . A A . 54 LYS HB3 1 1 13 7282 1 1 33 LYS HD2 H 16.570 -4.345 -2.883 1.00 . A A . 54 LYS HD2 1 1 13 7283 1 1 33 LYS HD3 H 15.092 -5.316 -2.749 1.00 . A A . 54 LYS HD3 1 1 13 7284 1 1 33 LYS HE2 H 14.688 -5.024 -5.191 1.00 . A A . 54 LYS HE2 1 1 13 7285 1 1 33 LYS HE3 H 16.200 -4.115 -5.322 1.00 . A A . 54 LYS HE3 1 1 13 7286 1 1 33 LYS HG2 H 13.800 -3.346 -3.695 1.00 . A A . 54 LYS HG2 1 1 13 7287 1 1 33 LYS HG3 H 15.294 -2.419 -3.685 1.00 . A A . 54 LYS HG3 1 1 13 7288 1 1 33 LYS HZ1 H 15.985 -6.949 -4.444 1.00 . A A . 54 LYS HZ1 1 1 13 7289 1 1 33 LYS HZ2 H 16.510 -6.455 -5.907 1.00 . A A . 54 LYS HZ2 1 1 13 7290 1 1 33 LYS HZ3 H 17.384 -6.114 -4.572 1.00 . A A . 54 LYS HZ3 1 1 13 7291 1 1 33 LYS N N 12.371 -4.006 -1.568 1.00 . A A . 54 LYS N 1 1 13 7292 1 1 33 LYS NZ N 16.443 -6.192 -4.933 1.00 . A A . 54 LYS NZ 1 1 13 7293 1 1 33 LYS O O 14.451 -2.882 1.216 1.00 . A A . 54 LYS O 1 1 13 7294 1 1 34 GLN C C 10.608 -2.948 2.990 1.00 . A A . 55 GLN C 1 1 13 7295 1 1 34 GLN CA C 11.916 -2.433 2.354 1.00 . A A . 55 GLN CA 1 1 13 7296 1 1 34 GLN CB C 11.871 -0.897 2.208 1.00 . A A . 55 GLN CB 1 1 13 7297 1 1 34 GLN CD C 11.616 1.332 3.387 1.00 . A A . 55 GLN CD 1 1 13 7298 1 1 34 GLN CG C 11.767 -0.176 3.561 1.00 . A A . 55 GLN CG 1 1 13 7299 1 1 34 GLN H H 11.441 -3.324 0.456 1.00 . A A . 55 GLN H 1 1 13 7300 1 1 34 GLN HA H 12.726 -2.686 3.040 1.00 . A A . 55 GLN HA 1 1 13 7301 1 1 34 GLN HB2 H 12.782 -0.556 1.711 1.00 . A A . 55 GLN HB2 1 1 13 7302 1 1 34 GLN HB3 H 11.023 -0.616 1.583 1.00 . A A . 55 GLN HB3 1 1 13 7303 1 1 34 GLN HE21 H 9.603 1.211 3.382 1.00 . A A . 55 GLN HE21 1 1 13 7304 1 1 34 GLN HE22 H 10.282 2.828 3.225 1.00 . A A . 55 GLN HE22 1 1 13 7305 1 1 34 GLN HG2 H 10.907 -0.548 4.118 1.00 . A A . 55 GLN HG2 1 1 13 7306 1 1 34 GLN HG3 H 12.664 -0.380 4.149 1.00 . A A . 55 GLN HG3 1 1 13 7307 1 1 34 GLN N N 12.211 -3.018 1.034 1.00 . A A . 55 GLN N 1 1 13 7308 1 1 34 GLN NE2 N 10.401 1.833 3.327 1.00 . A A . 55 GLN NE2 1 1 13 7309 1 1 34 GLN O O 10.635 -3.451 4.118 1.00 . A A . 55 GLN O 1 1 13 7310 1 1 34 GLN OE1 O 12.581 2.082 3.298 1.00 . A A . 55 GLN OE1 1 1 13 7311 1 1 35 CYS C C 7.475 -4.333 2.565 1.00 . A A . 56 CYS C 1 1 13 7312 1 1 35 CYS CA C 8.131 -2.971 2.870 1.00 . A A . 56 CYS CA 1 1 13 7313 1 1 35 CYS CB C 7.254 -1.812 2.368 1.00 . A A . 56 CYS CB 1 1 13 7314 1 1 35 CYS H H 9.533 -2.362 1.395 1.00 . A A . 56 CYS H 1 1 13 7315 1 1 35 CYS HA H 8.197 -2.883 3.956 1.00 . A A . 56 CYS HA 1 1 13 7316 1 1 35 CYS HB2 H 7.156 -1.860 1.283 1.00 . A A . 56 CYS HB2 1 1 13 7317 1 1 35 CYS HB3 H 6.256 -1.906 2.805 1.00 . A A . 56 CYS HB3 1 1 13 7318 1 1 35 CYS N N 9.475 -2.814 2.293 1.00 . A A . 56 CYS N 1 1 13 7319 1 1 35 CYS O O 6.528 -4.735 3.247 1.00 . A A . 56 CYS O 1 1 13 7320 1 1 35 CYS SG S 7.982 -0.227 2.870 1.00 . A A . 56 CYS SG 1 1 13 7321 1 1 36 ARG C C 8.581 -7.325 0.668 1.00 . A A . 57 ARG C 1 1 13 7322 1 1 36 ARG CA C 7.457 -6.332 1.038 1.00 . A A . 57 ARG CA 1 1 13 7323 1 1 36 ARG CB C 6.532 -6.051 -0.173 1.00 . A A . 57 ARG CB 1 1 13 7324 1 1 36 ARG CD C 4.011 -6.088 0.332 1.00 . A A . 57 ARG CD 1 1 13 7325 1 1 36 ARG CG C 5.234 -6.883 -0.157 1.00 . A A . 57 ARG CG 1 1 13 7326 1 1 36 ARG CZ C 3.402 -4.635 2.276 1.00 . A A . 57 ARG CZ 1 1 13 7327 1 1 36 ARG H H 8.708 -4.598 1.012 1.00 . A A . 57 ARG H 1 1 13 7328 1 1 36 ARG HA H 6.890 -6.817 1.833 1.00 . A A . 57 ARG HA 1 1 13 7329 1 1 36 ARG HB2 H 6.265 -4.995 -0.208 1.00 . A A . 57 ARG HB2 1 1 13 7330 1 1 36 ARG HB3 H 7.077 -6.262 -1.096 1.00 . A A . 57 ARG HB3 1 1 13 7331 1 1 36 ARG HD2 H 3.787 -5.316 -0.406 1.00 . A A . 57 ARG HD2 1 1 13 7332 1 1 36 ARG HD3 H 3.155 -6.764 0.387 1.00 . A A . 57 ARG HD3 1 1 13 7333 1 1 36 ARG HE H 5.135 -5.558 2.078 1.00 . A A . 57 ARG HE 1 1 13 7334 1 1 36 ARG HG2 H 5.026 -7.215 -1.175 1.00 . A A . 57 ARG HG2 1 1 13 7335 1 1 36 ARG HG3 H 5.363 -7.774 0.458 1.00 . A A . 57 ARG HG3 1 1 13 7336 1 1 36 ARG HH11 H 1.926 -4.741 0.940 1.00 . A A . 57 ARG HH11 1 1 13 7337 1 1 36 ARG HH12 H 1.698 -3.592 2.235 1.00 . A A . 57 ARG HH12 1 1 13 7338 1 1 36 ARG HH21 H 4.724 -4.225 3.707 1.00 . A A . 57 ARG HH21 1 1 13 7339 1 1 36 ARG HH22 H 3.144 -3.477 3.892 1.00 . A A . 57 ARG HH22 1 1 13 7340 1 1 36 ARG N N 7.970 -5.045 1.546 1.00 . A A . 57 ARG N 1 1 13 7341 1 1 36 ARG NE N 4.225 -5.451 1.647 1.00 . A A . 57 ARG NE 1 1 13 7342 1 1 36 ARG NH1 N 2.210 -4.369 1.838 1.00 . A A . 57 ARG NH1 1 1 13 7343 1 1 36 ARG NH2 N 3.780 -4.058 3.375 1.00 . A A . 57 ARG NH2 1 1 13 7344 1 1 36 ARG O O 8.298 -8.407 0.150 1.00 . A A . 57 ARG O 1 1 13 7345 1 1 37 SER C C 11.025 -9.102 1.526 1.00 . A A . 58 SER C 1 1 13 7346 1 1 37 SER CA C 11.064 -7.764 0.771 1.00 . A A . 58 SER CA 1 1 13 7347 1 1 37 SER CB C 12.292 -6.941 1.180 1.00 . A A . 58 SER CB 1 1 13 7348 1 1 37 SER H H 9.962 -6.060 1.382 1.00 . A A . 58 SER H 1 1 13 7349 1 1 37 SER HA H 11.177 -8.011 -0.285 1.00 . A A . 58 SER HA 1 1 13 7350 1 1 37 SER HB2 H 13.165 -7.596 1.257 1.00 . A A . 58 SER HB2 1 1 13 7351 1 1 37 SER HB3 H 12.496 -6.200 0.408 1.00 . A A . 58 SER HB3 1 1 13 7352 1 1 37 SER HG H 11.869 -6.927 3.095 1.00 . A A . 58 SER HG 1 1 13 7353 1 1 37 SER N N 9.840 -6.952 0.927 1.00 . A A . 58 SER N 1 1 13 7354 1 1 37 SER O O 10.612 -9.127 2.710 1.00 . A A . 58 SER O 1 1 13 7355 1 1 37 SER OXT O 11.433 -10.127 0.931 1.00 . A A . 58 SER OXT 1 1 13 7356 1 1 37 SER OG O 12.070 -6.263 2.407 1.00 . A A . 58 SER OG 1 1 13 7357 2 2 1 ZN ZN ZN -8.213 0.466 3.803 1.00 . B A . 1059 ZN ZN 1 1 13 7358 3 2 1 ZN ZN ZN 6.883 1.310 1.839 1.00 . C A . 1060 ZN ZN 1 1 14 7359 1 1 1 GLN C C -6.997 -1.456 -5.174 1.00 . A A . 22 GLN C 1 1 14 7360 1 1 1 GLN CA C -6.313 -0.774 -6.375 1.00 . A A . 22 GLN CA 1 1 14 7361 1 1 1 GLN CB C -4.886 -0.265 -6.043 1.00 . A A . 22 GLN CB 1 1 14 7362 1 1 1 GLN CD C -2.691 0.711 -6.905 1.00 . A A . 22 GLN CD 1 1 14 7363 1 1 1 GLN CG C -4.141 0.353 -7.240 1.00 . A A . 22 GLN CG 1 1 14 7364 1 1 1 GLN H1 H -8.105 -0.040 -7.089 1.00 . A A . 22 GLN H1 1 1 14 7365 1 1 1 GLN H2 H -7.258 1.052 -6.207 1.00 . A A . 22 GLN H2 1 1 14 7366 1 1 1 GLN H3 H -6.802 0.701 -7.752 1.00 . A A . 22 GLN H3 1 1 14 7367 1 1 1 GLN HA H -6.220 -1.537 -7.149 1.00 . A A . 22 GLN HA 1 1 14 7368 1 1 1 GLN HB2 H -4.935 0.471 -5.240 1.00 . A A . 22 GLN HB2 1 1 14 7369 1 1 1 GLN HB3 H -4.293 -1.110 -5.689 1.00 . A A . 22 GLN HB3 1 1 14 7370 1 1 1 GLN HE21 H -2.752 2.452 -7.939 1.00 . A A . 22 GLN HE21 1 1 14 7371 1 1 1 GLN HE22 H -1.235 2.057 -7.143 1.00 . A A . 22 GLN HE22 1 1 14 7372 1 1 1 GLN HG2 H -4.132 -0.353 -8.073 1.00 . A A . 22 GLN HG2 1 1 14 7373 1 1 1 GLN HG3 H -4.659 1.258 -7.562 1.00 . A A . 22 GLN HG3 1 1 14 7374 1 1 1 GLN N N -7.180 0.316 -6.899 1.00 . A A . 22 GLN N 1 1 14 7375 1 1 1 GLN NE2 N -2.194 1.840 -7.364 1.00 . A A . 22 GLN NE2 1 1 14 7376 1 1 1 GLN O O -8.202 -1.284 -4.978 1.00 . A A . 22 GLN O 1 1 14 7377 1 1 1 GLN OE1 O -1.975 -0.008 -6.225 1.00 . A A . 22 GLN OE1 1 1 14 7378 1 1 2 THR C C -5.982 -2.616 -1.949 1.00 . A A . 23 THR C 1 1 14 7379 1 1 2 THR CA C -6.749 -3.004 -3.215 1.00 . A A . 23 THR CA 1 1 14 7380 1 1 2 THR CB C -6.588 -4.508 -3.510 1.00 . A A . 23 THR CB 1 1 14 7381 1 1 2 THR CG2 C -7.093 -5.439 -2.404 1.00 . A A . 23 THR CG2 1 1 14 7382 1 1 2 THR H H -5.265 -2.300 -4.561 1.00 . A A . 23 THR H 1 1 14 7383 1 1 2 THR HA H -7.806 -2.801 -3.053 1.00 . A A . 23 THR HA 1 1 14 7384 1 1 2 THR HB H -5.532 -4.720 -3.687 1.00 . A A . 23 THR HB 1 1 14 7385 1 1 2 THR HG1 H -7.099 -5.748 -4.919 1.00 . A A . 23 THR HG1 1 1 14 7386 1 1 2 THR HG21 H -8.151 -5.268 -2.223 1.00 . A A . 23 THR HG21 1 1 14 7387 1 1 2 THR HG22 H -6.949 -6.476 -2.707 1.00 . A A . 23 THR HG22 1 1 14 7388 1 1 2 THR HG23 H -6.531 -5.277 -1.485 1.00 . A A . 23 THR HG23 1 1 14 7389 1 1 2 THR N N -6.253 -2.214 -4.360 1.00 . A A . 23 THR N 1 1 14 7390 1 1 2 THR O O -4.789 -2.317 -2.023 1.00 . A A . 23 THR O 1 1 14 7391 1 1 2 THR OG1 O -7.320 -4.831 -4.674 1.00 . A A . 23 THR OG1 1 1 14 7392 1 1 3 CYS C C -4.934 -2.896 1.017 1.00 . A A . 24 CYS C 1 1 14 7393 1 1 3 CYS CA C -6.117 -2.077 0.467 1.00 . A A . 24 CYS CA 1 1 14 7394 1 1 3 CYS CB C -7.254 -2.077 1.488 1.00 . A A . 24 CYS CB 1 1 14 7395 1 1 3 CYS H H -7.641 -2.825 -0.819 1.00 . A A . 24 CYS H 1 1 14 7396 1 1 3 CYS HA H -5.790 -1.047 0.310 1.00 . A A . 24 CYS HA 1 1 14 7397 1 1 3 CYS HB2 H -8.166 -1.696 1.031 1.00 . A A . 24 CYS HB2 1 1 14 7398 1 1 3 CYS HB3 H -7.441 -3.100 1.818 1.00 . A A . 24 CYS HB3 1 1 14 7399 1 1 3 CYS N N -6.659 -2.574 -0.799 1.00 . A A . 24 CYS N 1 1 14 7400 1 1 3 CYS O O -4.892 -4.122 0.890 1.00 . A A . 24 CYS O 1 1 14 7401 1 1 3 CYS SG S -6.764 -1.035 2.886 1.00 . A A . 24 CYS SG 1 1 14 7402 1 1 4 TYR C C -3.560 -3.602 3.803 1.00 . A A . 25 TYR C 1 1 14 7403 1 1 4 TYR CA C -3.007 -2.859 2.568 1.00 . A A . 25 TYR CA 1 1 14 7404 1 1 4 TYR CB C -1.950 -1.826 2.995 1.00 . A A . 25 TYR CB 1 1 14 7405 1 1 4 TYR CD1 C -3.376 -0.115 4.245 1.00 . A A . 25 TYR CD1 1 1 14 7406 1 1 4 TYR CD2 C -1.465 -1.112 5.379 1.00 . A A . 25 TYR CD2 1 1 14 7407 1 1 4 TYR CE1 C -3.676 0.627 5.403 1.00 . A A . 25 TYR CE1 1 1 14 7408 1 1 4 TYR CE2 C -1.755 -0.362 6.536 1.00 . A A . 25 TYR CE2 1 1 14 7409 1 1 4 TYR CG C -2.273 -0.992 4.229 1.00 . A A . 25 TYR CG 1 1 14 7410 1 1 4 TYR CZ C -2.866 0.508 6.550 1.00 . A A . 25 TYR CZ 1 1 14 7411 1 1 4 TYR H H -4.145 -1.219 1.805 1.00 . A A . 25 TYR H 1 1 14 7412 1 1 4 TYR HA H -2.506 -3.607 1.958 1.00 . A A . 25 TYR HA 1 1 14 7413 1 1 4 TYR HB2 H -1.039 -2.387 3.202 1.00 . A A . 25 TYR HB2 1 1 14 7414 1 1 4 TYR HB3 H -1.729 -1.161 2.161 1.00 . A A . 25 TYR HB3 1 1 14 7415 1 1 4 TYR HD1 H -4.008 -0.012 3.375 1.00 . A A . 25 TYR HD1 1 1 14 7416 1 1 4 TYR HD2 H -0.619 -1.788 5.378 1.00 . A A . 25 TYR HD2 1 1 14 7417 1 1 4 TYR HE1 H -4.538 1.274 5.426 1.00 . A A . 25 TYR HE1 1 1 14 7418 1 1 4 TYR HE2 H -1.133 -0.456 7.414 1.00 . A A . 25 TYR HE2 1 1 14 7419 1 1 4 TYR HH H -2.572 1.025 8.403 1.00 . A A . 25 TYR HH 1 1 14 7420 1 1 4 TYR N N -4.028 -2.221 1.732 1.00 . A A . 25 TYR N 1 1 14 7421 1 1 4 TYR O O -2.882 -4.492 4.321 1.00 . A A . 25 TYR O 1 1 14 7422 1 1 4 TYR OH O -3.177 1.221 7.666 1.00 . A A . 25 TYR OH 1 1 14 7423 1 1 5 ASN C C -6.777 -4.075 5.594 1.00 . A A . 26 ASN C 1 1 14 7424 1 1 5 ASN CA C -5.282 -3.686 5.586 1.00 . A A . 26 ASN CA 1 1 14 7425 1 1 5 ASN CB C -4.995 -2.550 6.585 1.00 . A A . 26 ASN CB 1 1 14 7426 1 1 5 ASN CG C -5.398 -2.907 8.006 1.00 . A A . 26 ASN CG 1 1 14 7427 1 1 5 ASN H H -5.266 -2.523 3.786 1.00 . A A . 26 ASN H 1 1 14 7428 1 1 5 ASN HA H -4.735 -4.571 5.917 1.00 . A A . 26 ASN HA 1 1 14 7429 1 1 5 ASN HB2 H -3.930 -2.322 6.574 1.00 . A A . 26 ASN HB2 1 1 14 7430 1 1 5 ASN HB3 H -5.536 -1.651 6.285 1.00 . A A . 26 ASN HB3 1 1 14 7431 1 1 5 ASN HD21 H -3.668 -3.899 8.344 1.00 . A A . 26 ASN HD21 1 1 14 7432 1 1 5 ASN HD22 H -4.818 -3.857 9.669 1.00 . A A . 26 ASN HD22 1 1 14 7433 1 1 5 ASN N N -4.769 -3.257 4.277 1.00 . A A . 26 ASN N 1 1 14 7434 1 1 5 ASN ND2 N -4.557 -3.617 8.726 1.00 . A A . 26 ASN ND2 1 1 14 7435 1 1 5 ASN O O -7.133 -5.078 6.217 1.00 . A A . 26 ASN O 1 1 14 7436 1 1 5 ASN OD1 O -6.468 -2.559 8.484 1.00 . A A . 26 ASN OD1 1 1 14 7437 1 1 6 CYS C C -9.367 -4.923 3.950 1.00 . A A . 27 CYS C 1 1 14 7438 1 1 6 CYS CA C -9.075 -3.642 4.767 1.00 . A A . 27 CYS CA 1 1 14 7439 1 1 6 CYS CB C -9.793 -2.439 4.120 1.00 . A A . 27 CYS CB 1 1 14 7440 1 1 6 CYS H H -7.308 -2.510 4.416 1.00 . A A . 27 CYS H 1 1 14 7441 1 1 6 CYS HA H -9.479 -3.783 5.771 1.00 . A A . 27 CYS HA 1 1 14 7442 1 1 6 CYS HB2 H -9.458 -2.325 3.089 1.00 . A A . 27 CYS HB2 1 1 14 7443 1 1 6 CYS HB3 H -10.867 -2.647 4.100 1.00 . A A . 27 CYS HB3 1 1 14 7444 1 1 6 CYS N N -7.641 -3.345 4.878 1.00 . A A . 27 CYS N 1 1 14 7445 1 1 6 CYS O O -10.453 -5.497 4.055 1.00 . A A . 27 CYS O 1 1 14 7446 1 1 6 CYS SG S -9.514 -0.894 5.035 1.00 . A A . 27 CYS SG 1 1 14 7447 1 1 7 GLY C C -9.592 -6.064 0.949 1.00 . A A . 28 GLY C 1 1 14 7448 1 1 7 GLY CA C -8.606 -6.401 2.085 1.00 . A A . 28 GLY CA 1 1 14 7449 1 1 7 GLY H H -7.549 -4.842 3.091 1.00 . A A . 28 GLY H 1 1 14 7450 1 1 7 GLY HA2 H -8.960 -7.303 2.586 1.00 . A A . 28 GLY HA2 1 1 14 7451 1 1 7 GLY HA3 H -7.639 -6.620 1.633 1.00 . A A . 28 GLY HA3 1 1 14 7452 1 1 7 GLY N N -8.429 -5.337 3.087 1.00 . A A . 28 GLY N 1 1 14 7453 1 1 7 GLY O O -9.851 -6.910 0.090 1.00 . A A . 28 GLY O 1 1 14 7454 1 1 8 LYS C C -10.519 -3.853 -1.328 1.00 . A A . 29 LYS C 1 1 14 7455 1 1 8 LYS CA C -11.159 -4.375 -0.027 1.00 . A A . 29 LYS CA 1 1 14 7456 1 1 8 LYS CB C -11.995 -3.244 0.615 1.00 . A A . 29 LYS CB 1 1 14 7457 1 1 8 LYS CD C -13.285 -4.704 2.291 1.00 . A A . 29 LYS CD 1 1 14 7458 1 1 8 LYS CE C -14.703 -5.056 2.750 1.00 . A A . 29 LYS CE 1 1 14 7459 1 1 8 LYS CG C -13.364 -3.697 1.140 1.00 . A A . 29 LYS CG 1 1 14 7460 1 1 8 LYS H H -9.862 -4.205 1.660 1.00 . A A . 29 LYS H 1 1 14 7461 1 1 8 LYS HA H -11.813 -5.211 -0.274 1.00 . A A . 29 LYS HA 1 1 14 7462 1 1 8 LYS HB2 H -11.435 -2.771 1.422 1.00 . A A . 29 LYS HB2 1 1 14 7463 1 1 8 LYS HB3 H -12.191 -2.474 -0.130 1.00 . A A . 29 LYS HB3 1 1 14 7464 1 1 8 LYS HD2 H -12.775 -5.609 1.957 1.00 . A A . 29 LYS HD2 1 1 14 7465 1 1 8 LYS HD3 H -12.730 -4.263 3.120 1.00 . A A . 29 LYS HD3 1 1 14 7466 1 1 8 LYS HE2 H -15.200 -4.141 3.088 1.00 . A A . 29 LYS HE2 1 1 14 7467 1 1 8 LYS HE3 H -15.264 -5.443 1.894 1.00 . A A . 29 LYS HE3 1 1 14 7468 1 1 8 LYS HG2 H -13.901 -2.812 1.487 1.00 . A A . 29 LYS HG2 1 1 14 7469 1 1 8 LYS HG3 H -13.930 -4.133 0.316 1.00 . A A . 29 LYS HG3 1 1 14 7470 1 1 8 LYS HZ1 H -14.183 -5.720 4.649 1.00 . A A . 29 LYS HZ1 1 1 14 7471 1 1 8 LYS HZ2 H -15.632 -6.279 4.145 1.00 . A A . 29 LYS HZ2 1 1 14 7472 1 1 8 LYS HZ3 H -14.258 -6.924 3.544 1.00 . A A . 29 LYS HZ3 1 1 14 7473 1 1 8 LYS N N -10.155 -4.848 0.940 1.00 . A A . 29 LYS N 1 1 14 7474 1 1 8 LYS NZ N -14.690 -6.061 3.844 1.00 . A A . 29 LYS NZ 1 1 14 7475 1 1 8 LYS O O -9.467 -3.210 -1.255 1.00 . A A . 29 LYS O 1 1 14 7476 1 1 9 PRO C C -11.342 -1.801 -3.568 1.00 . A A . 30 PRO C 1 1 14 7477 1 1 9 PRO CA C -10.889 -3.271 -3.712 1.00 . A A . 30 PRO CA 1 1 14 7478 1 1 9 PRO CB C -11.636 -4.030 -4.818 1.00 . A A . 30 PRO CB 1 1 14 7479 1 1 9 PRO CD C -12.345 -4.881 -2.700 1.00 . A A . 30 PRO CD 1 1 14 7480 1 1 9 PRO CG C -12.869 -4.567 -4.099 1.00 . A A . 30 PRO CG 1 1 14 7481 1 1 9 PRO HA H -9.821 -3.285 -3.936 1.00 . A A . 30 PRO HA 1 1 14 7482 1 1 9 PRO HB2 H -11.905 -3.405 -5.670 1.00 . A A . 30 PRO HB2 1 1 14 7483 1 1 9 PRO HB3 H -11.023 -4.869 -5.155 1.00 . A A . 30 PRO HB3 1 1 14 7484 1 1 9 PRO HD2 H -13.125 -4.676 -1.965 1.00 . A A . 30 PRO HD2 1 1 14 7485 1 1 9 PRO HD3 H -12.043 -5.926 -2.648 1.00 . A A . 30 PRO HD3 1 1 14 7486 1 1 9 PRO HG2 H -13.630 -3.786 -4.039 1.00 . A A . 30 PRO HG2 1 1 14 7487 1 1 9 PRO HG3 H -13.269 -5.456 -4.589 1.00 . A A . 30 PRO HG3 1 1 14 7488 1 1 9 PRO N N -11.175 -4.031 -2.492 1.00 . A A . 30 PRO N 1 1 14 7489 1 1 9 PRO O O -11.703 -1.349 -2.475 1.00 . A A . 30 PRO O 1 1 14 7490 1 1 10 GLY C C -10.869 1.275 -3.739 1.00 . A A . 31 GLY C 1 1 14 7491 1 1 10 GLY CA C -11.727 0.390 -4.653 1.00 . A A . 31 GLY CA 1 1 14 7492 1 1 10 GLY H H -10.990 -1.427 -5.526 1.00 . A A . 31 GLY H 1 1 14 7493 1 1 10 GLY HA2 H -12.766 0.464 -4.333 1.00 . A A . 31 GLY HA2 1 1 14 7494 1 1 10 GLY HA3 H -11.651 0.781 -5.669 1.00 . A A . 31 GLY HA3 1 1 14 7495 1 1 10 GLY N N -11.316 -1.024 -4.657 1.00 . A A . 31 GLY N 1 1 14 7496 1 1 10 GLY O O -11.359 2.256 -3.172 1.00 . A A . 31 GLY O 1 1 14 7497 1 1 11 HIS C C -7.512 2.242 -3.357 1.00 . A A . 32 HIS C 1 1 14 7498 1 1 11 HIS CA C -8.658 1.529 -2.633 1.00 . A A . 32 HIS CA 1 1 14 7499 1 1 11 HIS CB C -8.139 0.472 -1.649 1.00 . A A . 32 HIS CB 1 1 14 7500 1 1 11 HIS CD2 C -8.566 0.921 0.832 1.00 . A A . 32 HIS CD2 1 1 14 7501 1 1 11 HIS CE1 C -10.554 0.023 1.070 1.00 . A A . 32 HIS CE1 1 1 14 7502 1 1 11 HIS CG C -8.947 0.420 -0.382 1.00 . A A . 32 HIS CG 1 1 14 7503 1 1 11 HIS H H -9.273 0.089 -4.070 1.00 . A A . 32 HIS H 1 1 14 7504 1 1 11 HIS HA H -9.182 2.288 -2.056 1.00 . A A . 32 HIS HA 1 1 14 7505 1 1 11 HIS HB2 H -8.143 -0.512 -2.119 1.00 . A A . 32 HIS HB2 1 1 14 7506 1 1 11 HIS HB3 H -7.106 0.700 -1.379 1.00 . A A . 32 HIS HB3 1 1 14 7507 1 1 11 HIS HD1 H -10.757 -0.581 -0.945 1.00 . A A . 32 HIS HD1 1 1 14 7508 1 1 11 HIS HD2 H -7.629 1.420 1.034 1.00 . A A . 32 HIS HD2 1 1 14 7509 1 1 11 HIS HE1 H -11.493 -0.310 1.496 1.00 . A A . 32 HIS HE1 1 1 14 7510 1 1 11 HIS N N -9.596 0.907 -3.565 1.00 . A A . 32 HIS N 1 1 14 7511 1 1 11 HIS ND1 N -10.198 -0.133 -0.219 1.00 . A A . 32 HIS ND1 1 1 14 7512 1 1 11 HIS NE2 N -9.579 0.646 1.761 1.00 . A A . 32 HIS NE2 1 1 14 7513 1 1 11 HIS O O -7.060 1.828 -4.428 1.00 . A A . 32 HIS O 1 1 14 7514 1 1 12 LEU C C -5.465 5.045 -2.038 1.00 . A A . 33 LEU C 1 1 14 7515 1 1 12 LEU CA C -6.125 4.342 -3.240 1.00 . A A . 33 LEU CA 1 1 14 7516 1 1 12 LEU CB C -6.905 5.399 -4.064 1.00 . A A . 33 LEU CB 1 1 14 7517 1 1 12 LEU CD1 C -8.338 6.080 -6.003 1.00 . A A . 33 LEU CD1 1 1 14 7518 1 1 12 LEU CD2 C -6.460 4.517 -6.410 1.00 . A A . 33 LEU CD2 1 1 14 7519 1 1 12 LEU CG C -7.526 4.938 -5.395 1.00 . A A . 33 LEU CG 1 1 14 7520 1 1 12 LEU H H -7.455 3.537 -1.831 1.00 . A A . 33 LEU H 1 1 14 7521 1 1 12 LEU HA H -5.347 3.875 -3.845 1.00 . A A . 33 LEU HA 1 1 14 7522 1 1 12 LEU HB2 H -7.707 5.788 -3.433 1.00 . A A . 33 LEU HB2 1 1 14 7523 1 1 12 LEU HB3 H -6.239 6.235 -4.289 1.00 . A A . 33 LEU HB3 1 1 14 7524 1 1 12 LEU HD11 H -9.124 6.379 -5.309 1.00 . A A . 33 LEU HD11 1 1 14 7525 1 1 12 LEU HD12 H -7.693 6.937 -6.202 1.00 . A A . 33 LEU HD12 1 1 14 7526 1 1 12 LEU HD13 H -8.800 5.752 -6.934 1.00 . A A . 33 LEU HD13 1 1 14 7527 1 1 12 LEU HD21 H -5.772 5.343 -6.595 1.00 . A A . 33 LEU HD21 1 1 14 7528 1 1 12 LEU HD22 H -5.900 3.662 -6.035 1.00 . A A . 33 LEU HD22 1 1 14 7529 1 1 12 LEU HD23 H -6.938 4.235 -7.348 1.00 . A A . 33 LEU HD23 1 1 14 7530 1 1 12 LEU HG H -8.206 4.106 -5.221 1.00 . A A . 33 LEU HG 1 1 14 7531 1 1 12 LEU N N -7.071 3.341 -2.744 1.00 . A A . 33 LEU N 1 1 14 7532 1 1 12 LEU O O -5.925 4.904 -0.901 1.00 . A A . 33 LEU O 1 1 14 7533 1 1 13 SER C C -4.885 7.787 -0.654 1.00 . A A . 34 SER C 1 1 14 7534 1 1 13 SER CA C -3.875 6.842 -1.337 1.00 . A A . 34 SER CA 1 1 14 7535 1 1 13 SER CB C -2.834 7.703 -2.063 1.00 . A A . 34 SER CB 1 1 14 7536 1 1 13 SER H H -4.103 5.924 -3.243 1.00 . A A . 34 SER H 1 1 14 7537 1 1 13 SER HA H -3.369 6.274 -0.557 1.00 . A A . 34 SER HA 1 1 14 7538 1 1 13 SER HB2 H -3.344 8.349 -2.780 1.00 . A A . 34 SER HB2 1 1 14 7539 1 1 13 SER HB3 H -2.307 8.328 -1.341 1.00 . A A . 34 SER HB3 1 1 14 7540 1 1 13 SER HG H -1.382 7.446 -3.355 1.00 . A A . 34 SER HG 1 1 14 7541 1 1 13 SER N N -4.472 5.897 -2.302 1.00 . A A . 34 SER N 1 1 14 7542 1 1 13 SER O O -4.598 8.348 0.405 1.00 . A A . 34 SER O 1 1 14 7543 1 1 13 SER OG O -1.907 6.881 -2.755 1.00 . A A . 34 SER OG 1 1 14 7544 1 1 14 SER C C -8.220 7.927 0.074 1.00 . A A . 35 SER C 1 1 14 7545 1 1 14 SER CA C -7.199 8.755 -0.730 1.00 . A A . 35 SER CA 1 1 14 7546 1 1 14 SER CB C -7.907 9.440 -1.904 1.00 . A A . 35 SER CB 1 1 14 7547 1 1 14 SER H H -6.215 7.535 -2.152 1.00 . A A . 35 SER H 1 1 14 7548 1 1 14 SER HA H -6.821 9.534 -0.066 1.00 . A A . 35 SER HA 1 1 14 7549 1 1 14 SER HB2 H -8.782 9.985 -1.543 1.00 . A A . 35 SER HB2 1 1 14 7550 1 1 14 SER HB3 H -7.221 10.153 -2.364 1.00 . A A . 35 SER HB3 1 1 14 7551 1 1 14 SER HG H -8.762 8.948 -3.597 1.00 . A A . 35 SER HG 1 1 14 7552 1 1 14 SER N N -6.068 7.972 -1.253 1.00 . A A . 35 SER N 1 1 14 7553 1 1 14 SER O O -9.142 8.497 0.662 1.00 . A A . 35 SER O 1 1 14 7554 1 1 14 SER OG O -8.301 8.479 -2.875 1.00 . A A . 35 SER OG 1 1 14 7555 1 1 15 GLN C C -8.296 5.116 2.116 1.00 . A A . 36 GLN C 1 1 14 7556 1 1 15 GLN CA C -8.952 5.661 0.831 1.00 . A A . 36 GLN CA 1 1 14 7557 1 1 15 GLN CB C -9.317 4.521 -0.138 1.00 . A A . 36 GLN CB 1 1 14 7558 1 1 15 GLN CD C -11.864 4.476 -0.104 1.00 . A A . 36 GLN CD 1 1 14 7559 1 1 15 GLN CG C -10.579 3.737 0.260 1.00 . A A . 36 GLN CG 1 1 14 7560 1 1 15 GLN H H -7.260 6.207 -0.354 1.00 . A A . 36 GLN H 1 1 14 7561 1 1 15 GLN HA H -9.868 6.181 1.114 1.00 . A A . 36 GLN HA 1 1 14 7562 1 1 15 GLN HB2 H -9.472 4.925 -1.140 1.00 . A A . 36 GLN HB2 1 1 14 7563 1 1 15 GLN HB3 H -8.479 3.824 -0.187 1.00 . A A . 36 GLN HB3 1 1 14 7564 1 1 15 GLN HE21 H -12.035 3.524 -1.894 1.00 . A A . 36 GLN HE21 1 1 14 7565 1 1 15 GLN HE22 H -13.290 4.697 -1.497 1.00 . A A . 36 GLN HE22 1 1 14 7566 1 1 15 GLN HG2 H -10.578 2.786 -0.268 1.00 . A A . 36 GLN HG2 1 1 14 7567 1 1 15 GLN HG3 H -10.567 3.521 1.328 1.00 . A A . 36 GLN HG3 1 1 14 7568 1 1 15 GLN N N -8.058 6.597 0.130 1.00 . A A . 36 GLN N 1 1 14 7569 1 1 15 GLN NE2 N -12.438 4.210 -1.260 1.00 . A A . 36 GLN NE2 1 1 14 7570 1 1 15 GLN O O -8.946 5.078 3.165 1.00 . A A . 36 GLN O 1 1 14 7571 1 1 15 GLN OE1 O -12.376 5.303 0.640 1.00 . A A . 36 GLN OE1 1 1 14 7572 1 1 16 CYS C C -4.692 4.907 2.944 1.00 . A A . 37 CYS C 1 1 14 7573 1 1 16 CYS CA C -6.122 4.353 3.137 1.00 . A A . 37 CYS CA 1 1 14 7574 1 1 16 CYS CB C -6.102 2.812 3.192 1.00 . A A . 37 CYS CB 1 1 14 7575 1 1 16 CYS H H -6.549 4.889 1.138 1.00 . A A . 37 CYS H 1 1 14 7576 1 1 16 CYS HA H -6.498 4.739 4.086 1.00 . A A . 37 CYS HA 1 1 14 7577 1 1 16 CYS HB2 H -6.056 2.406 2.181 1.00 . A A . 37 CYS HB2 1 1 14 7578 1 1 16 CYS HB3 H -5.204 2.478 3.710 1.00 . A A . 37 CYS HB3 1 1 14 7579 1 1 16 CYS N N -6.998 4.786 2.041 1.00 . A A . 37 CYS N 1 1 14 7580 1 1 16 CYS O O -4.352 5.446 1.887 1.00 . A A . 37 CYS O 1 1 14 7581 1 1 16 CYS SG S -7.546 2.174 4.088 1.00 . A A . 37 CYS SG 1 1 14 7582 1 1 17 ARG C C -1.603 4.621 2.785 1.00 . A A . 38 ARG C 1 1 14 7583 1 1 17 ARG CA C -2.420 5.171 3.962 1.00 . A A . 38 ARG CA 1 1 14 7584 1 1 17 ARG CB C -1.770 4.804 5.308 1.00 . A A . 38 ARG CB 1 1 14 7585 1 1 17 ARG CD C -2.701 4.882 7.706 1.00 . A A . 38 ARG CD 1 1 14 7586 1 1 17 ARG CG C -2.282 5.685 6.465 1.00 . A A . 38 ARG CG 1 1 14 7587 1 1 17 ARG CZ C -5.164 4.457 7.416 1.00 . A A . 38 ARG CZ 1 1 14 7588 1 1 17 ARG H H -4.194 4.288 4.793 1.00 . A A . 38 ARG H 1 1 14 7589 1 1 17 ARG HA H -2.389 6.257 3.849 1.00 . A A . 38 ARG HA 1 1 14 7590 1 1 17 ARG HB2 H -1.947 3.747 5.517 1.00 . A A . 38 ARG HB2 1 1 14 7591 1 1 17 ARG HB3 H -0.691 4.946 5.233 1.00 . A A . 38 ARG HB3 1 1 14 7592 1 1 17 ARG HD2 H -1.874 4.233 7.999 1.00 . A A . 38 ARG HD2 1 1 14 7593 1 1 17 ARG HD3 H -2.884 5.572 8.534 1.00 . A A . 38 ARG HD3 1 1 14 7594 1 1 17 ARG HE H -3.754 3.058 7.412 1.00 . A A . 38 ARG HE 1 1 14 7595 1 1 17 ARG HG2 H -1.483 6.369 6.753 1.00 . A A . 38 ARG HG2 1 1 14 7596 1 1 17 ARG HG3 H -3.124 6.295 6.136 1.00 . A A . 38 ARG HG3 1 1 14 7597 1 1 17 ARG HH11 H -4.808 6.389 7.777 1.00 . A A . 38 ARG HH11 1 1 14 7598 1 1 17 ARG HH12 H -6.481 5.972 7.542 1.00 . A A . 38 ARG HH12 1 1 14 7599 1 1 17 ARG HH21 H -5.896 2.619 7.079 1.00 . A A . 38 ARG HH21 1 1 14 7600 1 1 17 ARG HH22 H -7.066 3.899 7.102 1.00 . A A . 38 ARG HH22 1 1 14 7601 1 1 17 ARG N N -3.836 4.738 3.963 1.00 . A A . 38 ARG N 1 1 14 7602 1 1 17 ARG NE N -3.905 4.058 7.471 1.00 . A A . 38 ARG NE 1 1 14 7603 1 1 17 ARG NH1 N -5.512 5.703 7.569 1.00 . A A . 38 ARG NH1 1 1 14 7604 1 1 17 ARG NH2 N -6.111 3.596 7.188 1.00 . A A . 38 ARG NH2 1 1 14 7605 1 1 17 ARG O O -0.726 5.325 2.286 1.00 . A A . 38 ARG O 1 1 14 7606 1 1 18 ALA C C -2.335 1.731 0.511 1.00 . A A . 39 ALA C 1 1 14 7607 1 1 18 ALA CA C -1.423 2.861 1.045 1.00 . A A . 39 ALA CA 1 1 14 7608 1 1 18 ALA CB C -0.007 2.310 1.277 1.00 . A A . 39 ALA CB 1 1 14 7609 1 1 18 ALA H H -2.635 2.895 2.789 1.00 . A A . 39 ALA H 1 1 14 7610 1 1 18 ALA HA H -1.387 3.659 0.305 1.00 . A A . 39 ALA HA 1 1 14 7611 1 1 18 ALA HB1 H -0.048 1.513 2.017 1.00 . A A . 39 ALA HB1 1 1 14 7612 1 1 18 ALA HB2 H 0.393 1.899 0.350 1.00 . A A . 39 ALA HB2 1 1 14 7613 1 1 18 ALA HB3 H 0.658 3.103 1.623 1.00 . A A . 39 ALA HB3 1 1 14 7614 1 1 18 ALA N N -1.920 3.416 2.306 1.00 . A A . 39 ALA N 1 1 14 7615 1 1 18 ALA O O -3.063 1.104 1.288 1.00 . A A . 39 ALA O 1 1 14 7616 1 1 19 PRO C C -1.733 -1.018 -0.913 1.00 . A A . 40 PRO C 1 1 14 7617 1 1 19 PRO CA C -2.707 0.112 -1.315 1.00 . A A . 40 PRO CA 1 1 14 7618 1 1 19 PRO CB C -2.770 0.314 -2.833 1.00 . A A . 40 PRO CB 1 1 14 7619 1 1 19 PRO CD C -1.655 2.200 -1.857 1.00 . A A . 40 PRO CD 1 1 14 7620 1 1 19 PRO CG C -1.642 1.310 -3.100 1.00 . A A . 40 PRO CG 1 1 14 7621 1 1 19 PRO HA H -3.701 -0.131 -0.942 1.00 . A A . 40 PRO HA 1 1 14 7622 1 1 19 PRO HB2 H -2.634 -0.614 -3.390 1.00 . A A . 40 PRO HB2 1 1 14 7623 1 1 19 PRO HB3 H -3.725 0.772 -3.093 1.00 . A A . 40 PRO HB3 1 1 14 7624 1 1 19 PRO HD2 H -0.636 2.501 -1.610 1.00 . A A . 40 PRO HD2 1 1 14 7625 1 1 19 PRO HD3 H -2.270 3.081 -2.043 1.00 . A A . 40 PRO HD3 1 1 14 7626 1 1 19 PRO HG2 H -0.690 0.781 -3.161 1.00 . A A . 40 PRO HG2 1 1 14 7627 1 1 19 PRO HG3 H -1.818 1.887 -4.008 1.00 . A A . 40 PRO HG3 1 1 14 7628 1 1 19 PRO N N -2.262 1.405 -0.795 1.00 . A A . 40 PRO N 1 1 14 7629 1 1 19 PRO O O -0.649 -0.767 -0.380 1.00 . A A . 40 PRO O 1 1 14 7630 1 1 20 LYS C C 0.103 -3.586 -1.354 1.00 . A A . 41 LYS C 1 1 14 7631 1 1 20 LYS CA C -1.362 -3.518 -0.885 1.00 . A A . 41 LYS CA 1 1 14 7632 1 1 20 LYS CB C -2.197 -4.710 -1.405 1.00 . A A . 41 LYS CB 1 1 14 7633 1 1 20 LYS CD C -1.860 -6.219 0.656 1.00 . A A . 41 LYS CD 1 1 14 7634 1 1 20 LYS CE C -1.620 -7.669 1.092 1.00 . A A . 41 LYS CE 1 1 14 7635 1 1 20 LYS CG C -1.809 -6.105 -0.875 1.00 . A A . 41 LYS CG 1 1 14 7636 1 1 20 LYS H H -3.006 -2.378 -1.651 1.00 . A A . 41 LYS H 1 1 14 7637 1 1 20 LYS HA H -1.316 -3.569 0.200 1.00 . A A . 41 LYS HA 1 1 14 7638 1 1 20 LYS HB2 H -3.243 -4.546 -1.144 1.00 . A A . 41 LYS HB2 1 1 14 7639 1 1 20 LYS HB3 H -2.139 -4.728 -2.495 1.00 . A A . 41 LYS HB3 1 1 14 7640 1 1 20 LYS HD2 H -1.091 -5.585 1.099 1.00 . A A . 41 LYS HD2 1 1 14 7641 1 1 20 LYS HD3 H -2.842 -5.897 1.007 1.00 . A A . 41 LYS HD3 1 1 14 7642 1 1 20 LYS HE2 H -2.380 -8.304 0.631 1.00 . A A . 41 LYS HE2 1 1 14 7643 1 1 20 LYS HE3 H -0.643 -7.993 0.720 1.00 . A A . 41 LYS HE3 1 1 14 7644 1 1 20 LYS HG2 H -2.508 -6.827 -1.301 1.00 . A A . 41 LYS HG2 1 1 14 7645 1 1 20 LYS HG3 H -0.812 -6.368 -1.227 1.00 . A A . 41 LYS HG3 1 1 14 7646 1 1 20 LYS HZ1 H -2.569 -7.520 2.939 1.00 . A A . 41 LYS HZ1 1 1 14 7647 1 1 20 LYS HZ2 H -1.526 -8.771 2.851 1.00 . A A . 41 LYS HZ2 1 1 14 7648 1 1 20 LYS HZ3 H -0.959 -7.251 3.023 1.00 . A A . 41 LYS HZ3 1 1 14 7649 1 1 20 LYS N N -2.092 -2.272 -1.219 1.00 . A A . 41 LYS N 1 1 14 7650 1 1 20 LYS NZ N -1.673 -7.808 2.572 1.00 . A A . 41 LYS NZ 1 1 14 7651 1 1 20 LYS O O 0.857 -4.434 -0.879 1.00 . A A . 41 LYS O 1 1 14 7652 1 1 21 VAL C C 2.818 -2.107 -1.336 1.00 . A A . 42 VAL C 1 1 14 7653 1 1 21 VAL CA C 1.939 -2.405 -2.569 1.00 . A A . 42 VAL CA 1 1 14 7654 1 1 21 VAL CB C 2.007 -1.223 -3.564 1.00 . A A . 42 VAL CB 1 1 14 7655 1 1 21 VAL CG1 C 3.433 -0.930 -4.038 1.00 . A A . 42 VAL CG1 1 1 14 7656 1 1 21 VAL CG2 C 1.162 -1.489 -4.820 1.00 . A A . 42 VAL CG2 1 1 14 7657 1 1 21 VAL H H -0.164 -2.025 -2.564 1.00 . A A . 42 VAL H 1 1 14 7658 1 1 21 VAL HA H 2.348 -3.289 -3.057 1.00 . A A . 42 VAL HA 1 1 14 7659 1 1 21 VAL HB H 1.620 -0.328 -3.075 1.00 . A A . 42 VAL HB 1 1 14 7660 1 1 21 VAL HG11 H 3.861 -1.825 -4.489 1.00 . A A . 42 VAL HG11 1 1 14 7661 1 1 21 VAL HG12 H 3.427 -0.126 -4.773 1.00 . A A . 42 VAL HG12 1 1 14 7662 1 1 21 VAL HG13 H 4.056 -0.614 -3.202 1.00 . A A . 42 VAL HG13 1 1 14 7663 1 1 21 VAL HG21 H 1.496 -2.405 -5.308 1.00 . A A . 42 VAL HG21 1 1 14 7664 1 1 21 VAL HG22 H 0.107 -1.581 -4.566 1.00 . A A . 42 VAL HG22 1 1 14 7665 1 1 21 VAL HG23 H 1.260 -0.657 -5.518 1.00 . A A . 42 VAL HG23 1 1 14 7666 1 1 21 VAL N N 0.532 -2.666 -2.215 1.00 . A A . 42 VAL N 1 1 14 7667 1 1 21 VAL O O 3.975 -2.521 -1.298 1.00 . A A . 42 VAL O 1 1 14 7668 1 1 22 CYS C C 2.121 -0.784 2.077 1.00 . A A . 43 CYS C 1 1 14 7669 1 1 22 CYS CA C 3.011 -0.850 0.810 1.00 . A A . 43 CYS CA 1 1 14 7670 1 1 22 CYS CB C 3.535 0.526 0.344 1.00 . A A . 43 CYS CB 1 1 14 7671 1 1 22 CYS H H 1.291 -1.170 -0.396 1.00 . A A . 43 CYS H 1 1 14 7672 1 1 22 CYS HA H 3.870 -1.483 1.040 1.00 . A A . 43 CYS HA 1 1 14 7673 1 1 22 CYS HB2 H 3.993 0.403 -0.639 1.00 . A A . 43 CYS HB2 1 1 14 7674 1 1 22 CYS HB3 H 2.696 1.217 0.246 1.00 . A A . 43 CYS HB3 1 1 14 7675 1 1 22 CYS N N 2.275 -1.411 -0.329 1.00 . A A . 43 CYS N 1 1 14 7676 1 1 22 CYS O O 1.184 -1.566 2.240 1.00 . A A . 43 CYS O 1 1 14 7677 1 1 22 CYS SG S 4.782 1.210 1.473 1.00 . A A . 43 CYS SG 1 1 14 7678 1 1 23 PHE C C 1.616 2.066 4.372 1.00 . A A . 44 PHE C 1 1 14 7679 1 1 23 PHE CA C 1.626 0.539 4.143 1.00 . A A . 44 PHE CA 1 1 14 7680 1 1 23 PHE CB C 2.130 -0.196 5.396 1.00 . A A . 44 PHE CB 1 1 14 7681 1 1 23 PHE CD1 C 4.663 0.055 5.435 1.00 . A A . 44 PHE CD1 1 1 14 7682 1 1 23 PHE CD2 C 3.338 1.250 7.093 1.00 . A A . 44 PHE CD2 1 1 14 7683 1 1 23 PHE CE1 C 5.836 0.615 5.974 1.00 . A A . 44 PHE CE1 1 1 14 7684 1 1 23 PHE CE2 C 4.511 1.809 7.630 1.00 . A A . 44 PHE CE2 1 1 14 7685 1 1 23 PHE CG C 3.409 0.373 5.993 1.00 . A A . 44 PHE CG 1 1 14 7686 1 1 23 PHE CZ C 5.760 1.494 7.069 1.00 . A A . 44 PHE CZ 1 1 14 7687 1 1 23 PHE H H 3.274 0.657 2.782 1.00 . A A . 44 PHE H 1 1 14 7688 1 1 23 PHE HA H 0.594 0.235 3.968 1.00 . A A . 44 PHE HA 1 1 14 7689 1 1 23 PHE HB2 H 1.348 -0.144 6.154 1.00 . A A . 44 PHE HB2 1 1 14 7690 1 1 23 PHE HB3 H 2.278 -1.251 5.165 1.00 . A A . 44 PHE HB3 1 1 14 7691 1 1 23 PHE HD1 H 4.729 -0.617 4.591 1.00 . A A . 44 PHE HD1 1 1 14 7692 1 1 23 PHE HD2 H 2.380 1.504 7.524 1.00 . A A . 44 PHE HD2 1 1 14 7693 1 1 23 PHE HE1 H 6.798 0.368 5.547 1.00 . A A . 44 PHE HE1 1 1 14 7694 1 1 23 PHE HE2 H 4.452 2.486 8.473 1.00 . A A . 44 PHE HE2 1 1 14 7695 1 1 23 PHE HZ H 6.665 1.924 7.481 1.00 . A A . 44 PHE HZ 1 1 14 7696 1 1 23 PHE N N 2.431 0.139 2.983 1.00 . A A . 44 PHE N 1 1 14 7697 1 1 23 PHE O O 0.716 2.566 5.051 1.00 . A A . 44 PHE O 1 1 14 7698 1 1 24 LYS C C 3.473 4.985 2.865 1.00 . A A . 45 LYS C 1 1 14 7699 1 1 24 LYS CA C 2.730 4.274 4.005 1.00 . A A . 45 LYS CA 1 1 14 7700 1 1 24 LYS CB C 3.444 4.503 5.357 1.00 . A A . 45 LYS CB 1 1 14 7701 1 1 24 LYS CD C 2.396 6.782 5.926 1.00 . A A . 45 LYS CD 1 1 14 7702 1 1 24 LYS CE C 2.748 8.188 6.431 1.00 . A A . 45 LYS CE 1 1 14 7703 1 1 24 LYS CG C 3.689 5.973 5.743 1.00 . A A . 45 LYS CG 1 1 14 7704 1 1 24 LYS H H 3.282 2.340 3.253 1.00 . A A . 45 LYS H 1 1 14 7705 1 1 24 LYS HA H 1.735 4.719 4.053 1.00 . A A . 45 LYS HA 1 1 14 7706 1 1 24 LYS HB2 H 2.853 4.044 6.150 1.00 . A A . 45 LYS HB2 1 1 14 7707 1 1 24 LYS HB3 H 4.410 3.995 5.338 1.00 . A A . 45 LYS HB3 1 1 14 7708 1 1 24 LYS HD2 H 1.869 6.858 4.974 1.00 . A A . 45 LYS HD2 1 1 14 7709 1 1 24 LYS HD3 H 1.757 6.280 6.655 1.00 . A A . 45 LYS HD3 1 1 14 7710 1 1 24 LYS HE2 H 3.323 8.094 7.357 1.00 . A A . 45 LYS HE2 1 1 14 7711 1 1 24 LYS HE3 H 3.387 8.677 5.690 1.00 . A A . 45 LYS HE3 1 1 14 7712 1 1 24 LYS HG2 H 4.240 5.980 6.684 1.00 . A A . 45 LYS HG2 1 1 14 7713 1 1 24 LYS HG3 H 4.315 6.453 4.989 1.00 . A A . 45 LYS HG3 1 1 14 7714 1 1 24 LYS HZ1 H 0.991 9.128 5.828 1.00 . A A . 45 LYS HZ1 1 1 14 7715 1 1 24 LYS HZ2 H 0.938 8.589 7.374 1.00 . A A . 45 LYS HZ2 1 1 14 7716 1 1 24 LYS HZ3 H 1.783 9.932 7.004 1.00 . A A . 45 LYS HZ3 1 1 14 7717 1 1 24 LYS N N 2.585 2.816 3.810 1.00 . A A . 45 LYS N 1 1 14 7718 1 1 24 LYS NZ N 1.534 9.010 6.673 1.00 . A A . 45 LYS NZ 1 1 14 7719 1 1 24 LYS O O 2.907 5.894 2.256 1.00 . A A . 45 LYS O 1 1 14 7720 1 1 25 CYS C C 5.382 5.098 0.179 1.00 . A A . 46 CYS C 1 1 14 7721 1 1 25 CYS CA C 5.629 5.327 1.686 1.00 . A A . 46 CYS CA 1 1 14 7722 1 1 25 CYS CB C 7.078 5.030 2.112 1.00 . A A . 46 CYS CB 1 1 14 7723 1 1 25 CYS H H 5.132 3.857 3.126 1.00 . A A . 46 CYS H 1 1 14 7724 1 1 25 CYS HA H 5.473 6.395 1.853 1.00 . A A . 46 CYS HA 1 1 14 7725 1 1 25 CYS HB2 H 7.763 5.361 1.328 1.00 . A A . 46 CYS HB2 1 1 14 7726 1 1 25 CYS HB3 H 7.299 5.612 3.009 1.00 . A A . 46 CYS HB3 1 1 14 7727 1 1 25 CYS N N 4.719 4.601 2.582 1.00 . A A . 46 CYS N 1 1 14 7728 1 1 25 CYS O O 5.598 6.022 -0.608 1.00 . A A . 46 CYS O 1 1 14 7729 1 1 25 CYS SG S 7.355 3.275 2.479 1.00 . A A . 46 CYS SG 1 1 14 7730 1 1 26 LYS C C 4.955 4.076 -2.811 1.00 . A A . 47 LYS C 1 1 14 7731 1 1 26 LYS CA C 4.244 3.584 -1.527 1.00 . A A . 47 LYS CA 1 1 14 7732 1 1 26 LYS CB C 2.731 3.896 -1.475 1.00 . A A . 47 LYS CB 1 1 14 7733 1 1 26 LYS CD C 0.882 5.598 -1.132 1.00 . A A . 47 LYS CD 1 1 14 7734 1 1 26 LYS CE C 0.574 7.018 -0.637 1.00 . A A . 47 LYS CE 1 1 14 7735 1 1 26 LYS CG C 2.394 5.380 -1.268 1.00 . A A . 47 LYS CG 1 1 14 7736 1 1 26 LYS H H 4.756 3.232 0.521 1.00 . A A . 47 LYS H 1 1 14 7737 1 1 26 LYS HA H 4.306 2.500 -1.613 1.00 . A A . 47 LYS HA 1 1 14 7738 1 1 26 LYS HB2 H 2.255 3.544 -2.391 1.00 . A A . 47 LYS HB2 1 1 14 7739 1 1 26 LYS HB3 H 2.298 3.330 -0.648 1.00 . A A . 47 LYS HB3 1 1 14 7740 1 1 26 LYS HD2 H 0.419 5.450 -2.109 1.00 . A A . 47 LYS HD2 1 1 14 7741 1 1 26 LYS HD3 H 0.459 4.874 -0.436 1.00 . A A . 47 LYS HD3 1 1 14 7742 1 1 26 LYS HE2 H 1.176 7.731 -1.210 1.00 . A A . 47 LYS HE2 1 1 14 7743 1 1 26 LYS HE3 H -0.477 7.230 -0.840 1.00 . A A . 47 LYS HE3 1 1 14 7744 1 1 26 LYS HG2 H 2.870 5.732 -0.358 1.00 . A A . 47 LYS HG2 1 1 14 7745 1 1 26 LYS HG3 H 2.771 5.967 -2.105 1.00 . A A . 47 LYS HG3 1 1 14 7746 1 1 26 LYS HZ1 H 1.777 6.897 1.074 1.00 . A A . 47 LYS HZ1 1 1 14 7747 1 1 26 LYS HZ2 H 0.682 8.121 1.125 1.00 . A A . 47 LYS HZ2 1 1 14 7748 1 1 26 LYS HZ3 H 0.213 6.565 1.359 1.00 . A A . 47 LYS HZ3 1 1 14 7749 1 1 26 LYS N N 4.853 3.926 -0.213 1.00 . A A . 47 LYS N 1 1 14 7750 1 1 26 LYS NZ N 0.831 7.169 0.820 1.00 . A A . 47 LYS NZ 1 1 14 7751 1 1 26 LYS O O 4.308 4.278 -3.838 1.00 . A A . 47 LYS O 1 1 14 7752 1 1 27 GLN C C 7.135 3.570 -5.046 1.00 . A A . 48 GLN C 1 1 14 7753 1 1 27 GLN CA C 7.085 4.662 -3.943 1.00 . A A . 48 GLN CA 1 1 14 7754 1 1 27 GLN CB C 8.507 5.048 -3.488 1.00 . A A . 48 GLN CB 1 1 14 7755 1 1 27 GLN CD C 7.890 7.481 -3.009 1.00 . A A . 48 GLN CD 1 1 14 7756 1 1 27 GLN CG C 8.555 6.209 -2.481 1.00 . A A . 48 GLN CG 1 1 14 7757 1 1 27 GLN H H 6.750 4.087 -1.902 1.00 . A A . 48 GLN H 1 1 14 7758 1 1 27 GLN HA H 6.604 5.545 -4.363 1.00 . A A . 48 GLN HA 1 1 14 7759 1 1 27 GLN HB2 H 8.985 4.181 -3.033 1.00 . A A . 48 GLN HB2 1 1 14 7760 1 1 27 GLN HB3 H 9.096 5.330 -4.361 1.00 . A A . 48 GLN HB3 1 1 14 7761 1 1 27 GLN HE21 H 6.286 7.270 -1.793 1.00 . A A . 48 GLN HE21 1 1 14 7762 1 1 27 GLN HE22 H 6.287 8.679 -2.859 1.00 . A A . 48 GLN HE22 1 1 14 7763 1 1 27 GLN HG2 H 8.086 5.905 -1.546 1.00 . A A . 48 GLN HG2 1 1 14 7764 1 1 27 GLN HG3 H 9.598 6.436 -2.259 1.00 . A A . 48 GLN HG3 1 1 14 7765 1 1 27 GLN N N 6.280 4.248 -2.779 1.00 . A A . 48 GLN N 1 1 14 7766 1 1 27 GLN NE2 N 6.727 7.841 -2.511 1.00 . A A . 48 GLN NE2 1 1 14 7767 1 1 27 GLN O O 7.058 2.385 -4.703 1.00 . A A . 48 GLN O 1 1 14 7768 1 1 27 GLN OE1 O 8.396 8.161 -3.894 1.00 . A A . 48 GLN OE1 1 1 14 7769 1 1 28 PRO C C 7.810 1.664 -7.545 1.00 . A A . 49 PRO C 1 1 14 7770 1 1 28 PRO CA C 7.110 3.038 -7.504 1.00 . A A . 49 PRO CA 1 1 14 7771 1 1 28 PRO CB C 7.536 3.861 -8.723 1.00 . A A . 49 PRO CB 1 1 14 7772 1 1 28 PRO CD C 7.525 5.293 -6.817 1.00 . A A . 49 PRO CD 1 1 14 7773 1 1 28 PRO CG C 7.209 5.290 -8.310 1.00 . A A . 49 PRO CG 1 1 14 7774 1 1 28 PRO HA H 6.038 2.853 -7.583 1.00 . A A . 49 PRO HA 1 1 14 7775 1 1 28 PRO HB2 H 8.612 3.770 -8.882 1.00 . A A . 49 PRO HB2 1 1 14 7776 1 1 28 PRO HB3 H 6.991 3.568 -9.622 1.00 . A A . 49 PRO HB3 1 1 14 7777 1 1 28 PRO HD2 H 8.570 5.566 -6.670 1.00 . A A . 49 PRO HD2 1 1 14 7778 1 1 28 PRO HD3 H 6.876 6.015 -6.325 1.00 . A A . 49 PRO HD3 1 1 14 7779 1 1 28 PRO HG2 H 7.810 6.019 -8.854 1.00 . A A . 49 PRO HG2 1 1 14 7780 1 1 28 PRO HG3 H 6.145 5.480 -8.461 1.00 . A A . 49 PRO HG3 1 1 14 7781 1 1 28 PRO N N 7.309 3.926 -6.341 1.00 . A A . 49 PRO N 1 1 14 7782 1 1 28 PRO O O 7.353 0.788 -8.282 1.00 . A A . 49 PRO O 1 1 14 7783 1 1 29 GLY C C 10.427 -0.138 -5.505 1.00 . A A . 50 GLY C 1 1 14 7784 1 1 29 GLY CA C 9.647 0.179 -6.789 1.00 . A A . 50 GLY CA 1 1 14 7785 1 1 29 GLY H H 9.270 2.237 -6.282 1.00 . A A . 50 GLY H 1 1 14 7786 1 1 29 GLY HA2 H 10.357 0.188 -7.617 1.00 . A A . 50 GLY HA2 1 1 14 7787 1 1 29 GLY HA3 H 8.955 -0.648 -6.950 1.00 . A A . 50 GLY HA3 1 1 14 7788 1 1 29 GLY N N 8.899 1.452 -6.795 1.00 . A A . 50 GLY N 1 1 14 7789 1 1 29 GLY O O 11.210 -1.090 -5.484 1.00 . A A . 50 GLY O 1 1 14 7790 1 1 30 HIS C C 10.552 -0.827 -2.403 1.00 . A A . 51 HIS C 1 1 14 7791 1 1 30 HIS CA C 10.951 0.463 -3.155 1.00 . A A . 51 HIS CA 1 1 14 7792 1 1 30 HIS CB C 10.673 1.693 -2.266 1.00 . A A . 51 HIS CB 1 1 14 7793 1 1 30 HIS CD2 C 9.156 1.358 -0.233 1.00 . A A . 51 HIS CD2 1 1 14 7794 1 1 30 HIS CE1 C 7.182 1.338 -1.193 1.00 . A A . 51 HIS CE1 1 1 14 7795 1 1 30 HIS CG C 9.335 1.640 -1.561 1.00 . A A . 51 HIS CG 1 1 14 7796 1 1 30 HIS H H 9.604 1.414 -4.517 1.00 . A A . 51 HIS H 1 1 14 7797 1 1 30 HIS HA H 12.023 0.418 -3.351 1.00 . A A . 51 HIS HA 1 1 14 7798 1 1 30 HIS HB2 H 11.454 1.742 -1.507 1.00 . A A . 51 HIS HB2 1 1 14 7799 1 1 30 HIS HB3 H 10.744 2.604 -2.861 1.00 . A A . 51 HIS HB3 1 1 14 7800 1 1 30 HIS HD1 H 7.849 1.812 -3.119 1.00 . A A . 51 HIS HD1 1 1 14 7801 1 1 30 HIS HD2 H 9.945 1.225 0.494 1.00 . A A . 51 HIS HD2 1 1 14 7802 1 1 30 HIS HE1 H 6.118 1.229 -1.361 1.00 . A A . 51 HIS HE1 1 1 14 7803 1 1 30 HIS N N 10.247 0.642 -4.436 1.00 . A A . 51 HIS N 1 1 14 7804 1 1 30 HIS ND1 N 8.082 1.633 -2.143 1.00 . A A . 51 HIS ND1 1 1 14 7805 1 1 30 HIS NE2 N 7.789 1.164 -0.011 1.00 . A A . 51 HIS NE2 1 1 14 7806 1 1 30 HIS O O 11.345 -1.396 -1.650 1.00 . A A . 51 HIS O 1 1 14 7807 1 1 31 PHE C C 9.283 -3.586 -1.631 1.00 . A A . 52 PHE C 1 1 14 7808 1 1 31 PHE CA C 8.612 -2.209 -1.691 1.00 . A A . 52 PHE CA 1 1 14 7809 1 1 31 PHE CB C 7.133 -2.297 -2.098 1.00 . A A . 52 PHE CB 1 1 14 7810 1 1 31 PHE CD1 C 6.788 -3.803 -4.116 1.00 . A A . 52 PHE CD1 1 1 14 7811 1 1 31 PHE CD2 C 6.687 -1.391 -4.427 1.00 . A A . 52 PHE CD2 1 1 14 7812 1 1 31 PHE CE1 C 6.550 -3.988 -5.489 1.00 . A A . 52 PHE CE1 1 1 14 7813 1 1 31 PHE CE2 C 6.442 -1.578 -5.798 1.00 . A A . 52 PHE CE2 1 1 14 7814 1 1 31 PHE CG C 6.865 -2.504 -3.579 1.00 . A A . 52 PHE CG 1 1 14 7815 1 1 31 PHE CZ C 6.378 -2.876 -6.332 1.00 . A A . 52 PHE CZ 1 1 14 7816 1 1 31 PHE H H 8.732 -0.770 -3.245 1.00 . A A . 52 PHE H 1 1 14 7817 1 1 31 PHE HA H 8.644 -1.805 -0.678 1.00 . A A . 52 PHE HA 1 1 14 7818 1 1 31 PHE HB2 H 6.662 -3.103 -1.537 1.00 . A A . 52 PHE HB2 1 1 14 7819 1 1 31 PHE HB3 H 6.638 -1.376 -1.790 1.00 . A A . 52 PHE HB3 1 1 14 7820 1 1 31 PHE HD1 H 6.919 -4.665 -3.476 1.00 . A A . 52 PHE HD1 1 1 14 7821 1 1 31 PHE HD2 H 6.713 -0.387 -4.026 1.00 . A A . 52 PHE HD2 1 1 14 7822 1 1 31 PHE HE1 H 6.501 -4.989 -5.898 1.00 . A A . 52 PHE HE1 1 1 14 7823 1 1 31 PHE HE2 H 6.286 -0.723 -6.440 1.00 . A A . 52 PHE HE2 1 1 14 7824 1 1 31 PHE HZ H 6.189 -3.019 -7.387 1.00 . A A . 52 PHE HZ 1 1 14 7825 1 1 31 PHE N N 9.300 -1.266 -2.577 1.00 . A A . 52 PHE N 1 1 14 7826 1 1 31 PHE O O 9.466 -4.122 -0.538 1.00 . A A . 52 PHE O 1 1 14 7827 1 1 32 SER C C 11.827 -5.430 -2.113 1.00 . A A . 53 SER C 1 1 14 7828 1 1 32 SER CA C 10.480 -5.392 -2.861 1.00 . A A . 53 SER CA 1 1 14 7829 1 1 32 SER CB C 10.714 -5.748 -4.337 1.00 . A A . 53 SER CB 1 1 14 7830 1 1 32 SER H H 9.540 -3.635 -3.630 1.00 . A A . 53 SER H 1 1 14 7831 1 1 32 SER HA H 9.853 -6.172 -2.426 1.00 . A A . 53 SER HA 1 1 14 7832 1 1 32 SER HB2 H 11.379 -5.008 -4.786 1.00 . A A . 53 SER HB2 1 1 14 7833 1 1 32 SER HB3 H 11.183 -6.731 -4.404 1.00 . A A . 53 SER HB3 1 1 14 7834 1 1 32 SER HG H 9.667 -6.019 -5.973 1.00 . A A . 53 SER HG 1 1 14 7835 1 1 32 SER N N 9.753 -4.112 -2.764 1.00 . A A . 53 SER N 1 1 14 7836 1 1 32 SER O O 12.464 -6.484 -2.061 1.00 . A A . 53 SER O 1 1 14 7837 1 1 32 SER OG O 9.485 -5.768 -5.046 1.00 . A A . 53 SER OG 1 1 14 7838 1 1 33 LYS C C 13.313 -3.487 0.602 1.00 . A A . 54 LYS C 1 1 14 7839 1 1 33 LYS CA C 13.521 -4.134 -0.782 1.00 . A A . 54 LYS CA 1 1 14 7840 1 1 33 LYS CB C 14.555 -3.351 -1.622 1.00 . A A . 54 LYS CB 1 1 14 7841 1 1 33 LYS CD C 14.172 -3.522 -4.186 1.00 . A A . 54 LYS CD 1 1 14 7842 1 1 33 LYS CE C 14.623 -2.110 -4.590 1.00 . A A . 54 LYS CE 1 1 14 7843 1 1 33 LYS CG C 14.943 -4.026 -2.954 1.00 . A A . 54 LYS CG 1 1 14 7844 1 1 33 LYS H H 11.702 -3.465 -1.671 1.00 . A A . 54 LYS H 1 1 14 7845 1 1 33 LYS HA H 13.935 -5.122 -0.574 1.00 . A A . 54 LYS HA 1 1 14 7846 1 1 33 LYS HB2 H 14.190 -2.339 -1.802 1.00 . A A . 54 LYS HB2 1 1 14 7847 1 1 33 LYS HB3 H 15.470 -3.266 -1.034 1.00 . A A . 54 LYS HB3 1 1 14 7848 1 1 33 LYS HD2 H 14.370 -4.206 -5.013 1.00 . A A . 54 LYS HD2 1 1 14 7849 1 1 33 LYS HD3 H 13.101 -3.520 -3.988 1.00 . A A . 54 LYS HD3 1 1 14 7850 1 1 33 LYS HE2 H 14.387 -1.413 -3.780 1.00 . A A . 54 LYS HE2 1 1 14 7851 1 1 33 LYS HE3 H 15.709 -2.117 -4.722 1.00 . A A . 54 LYS HE3 1 1 14 7852 1 1 33 LYS HG2 H 16.007 -3.854 -3.130 1.00 . A A . 54 LYS HG2 1 1 14 7853 1 1 33 LYS HG3 H 14.807 -5.104 -2.863 1.00 . A A . 54 LYS HG3 1 1 14 7854 1 1 33 LYS HZ1 H 14.161 -2.305 -6.608 1.00 . A A . 54 LYS HZ1 1 1 14 7855 1 1 33 LYS HZ2 H 12.958 -1.611 -5.735 1.00 . A A . 54 LYS HZ2 1 1 14 7856 1 1 33 LYS HZ3 H 14.293 -0.753 -6.125 1.00 . A A . 54 LYS HZ3 1 1 14 7857 1 1 33 LYS N N 12.270 -4.296 -1.543 1.00 . A A . 54 LYS N 1 1 14 7858 1 1 33 LYS NZ N 13.968 -1.669 -5.847 1.00 . A A . 54 LYS NZ 1 1 14 7859 1 1 33 LYS O O 14.299 -3.171 1.274 1.00 . A A . 54 LYS O 1 1 14 7860 1 1 34 GLN C C 10.416 -3.246 2.949 1.00 . A A . 55 GLN C 1 1 14 7861 1 1 34 GLN CA C 11.756 -2.738 2.379 1.00 . A A . 55 GLN CA 1 1 14 7862 1 1 34 GLN CB C 11.778 -1.196 2.300 1.00 . A A . 55 GLN CB 1 1 14 7863 1 1 34 GLN CD C 11.610 0.983 3.577 1.00 . A A . 55 GLN CD 1 1 14 7864 1 1 34 GLN CG C 11.662 -0.538 3.683 1.00 . A A . 55 GLN CG 1 1 14 7865 1 1 34 GLN H H 11.304 -3.628 0.477 1.00 . A A . 55 GLN H 1 1 14 7866 1 1 34 GLN HA H 12.535 -3.051 3.075 1.00 . A A . 55 GLN HA 1 1 14 7867 1 1 34 GLN HB2 H 12.716 -0.874 1.847 1.00 . A A . 55 GLN HB2 1 1 14 7868 1 1 34 GLN HB3 H 10.962 -0.851 1.664 1.00 . A A . 55 GLN HB3 1 1 14 7869 1 1 34 GLN HE21 H 9.595 0.988 3.492 1.00 . A A . 55 GLN HE21 1 1 14 7870 1 1 34 GLN HE22 H 10.379 2.565 3.424 1.00 . A A . 55 GLN HE22 1 1 14 7871 1 1 34 GLN HG2 H 10.761 -0.884 4.188 1.00 . A A . 55 GLN HG2 1 1 14 7872 1 1 34 GLN HG3 H 12.522 -0.823 4.292 1.00 . A A . 55 GLN HG3 1 1 14 7873 1 1 34 GLN N N 12.065 -3.286 1.048 1.00 . A A . 55 GLN N 1 1 14 7874 1 1 34 GLN NE2 N 10.432 1.560 3.493 1.00 . A A . 55 GLN NE2 1 1 14 7875 1 1 34 GLN O O 10.403 -3.907 3.990 1.00 . A A . 55 GLN O 1 1 14 7876 1 1 34 GLN OE1 O 12.621 1.675 3.563 1.00 . A A . 55 GLN OE1 1 1 14 7877 1 1 35 CYS C C 7.240 -4.393 2.480 1.00 . A A . 56 CYS C 1 1 14 7878 1 1 35 CYS CA C 7.945 -3.069 2.843 1.00 . A A . 56 CYS CA 1 1 14 7879 1 1 35 CYS CB C 7.122 -1.858 2.373 1.00 . A A . 56 CYS CB 1 1 14 7880 1 1 35 CYS H H 9.389 -2.375 1.453 1.00 . A A . 56 CYS H 1 1 14 7881 1 1 35 CYS HA H 8.006 -3.025 3.930 1.00 . A A . 56 CYS HA 1 1 14 7882 1 1 35 CYS HB2 H 7.045 -1.859 1.284 1.00 . A A . 56 CYS HB2 1 1 14 7883 1 1 35 CYS HB3 H 6.112 -1.932 2.787 1.00 . A A . 56 CYS HB3 1 1 14 7884 1 1 35 CYS N N 9.298 -2.935 2.284 1.00 . A A . 56 CYS N 1 1 14 7885 1 1 35 CYS O O 6.233 -4.749 3.101 1.00 . A A . 56 CYS O 1 1 14 7886 1 1 35 CYS SG S 7.899 -0.326 2.955 1.00 . A A . 56 CYS SG 1 1 14 7887 1 1 36 ARG C C 8.171 -7.395 0.476 1.00 . A A . 57 ARG C 1 1 14 7888 1 1 36 ARG CA C 7.134 -6.326 0.882 1.00 . A A . 57 ARG CA 1 1 14 7889 1 1 36 ARG CB C 6.253 -5.895 -0.315 1.00 . A A . 57 ARG CB 1 1 14 7890 1 1 36 ARG CD C 3.716 -5.894 0.103 1.00 . A A . 57 ARG CD 1 1 14 7891 1 1 36 ARG CG C 4.932 -6.683 -0.413 1.00 . A A . 57 ARG CG 1 1 14 7892 1 1 36 ARG CZ C 3.115 -4.528 2.109 1.00 . A A . 57 ARG CZ 1 1 14 7893 1 1 36 ARG H H 8.543 -4.720 0.991 1.00 . A A . 57 ARG H 1 1 14 7894 1 1 36 ARG HA H 6.512 -6.801 1.643 1.00 . A A . 57 ARG HA 1 1 14 7895 1 1 36 ARG HB2 H 6.013 -4.833 -0.242 1.00 . A A . 57 ARG HB2 1 1 14 7896 1 1 36 ARG HB3 H 6.817 -6.020 -1.241 1.00 . A A . 57 ARG HB3 1 1 14 7897 1 1 36 ARG HD2 H 3.522 -5.077 -0.594 1.00 . A A . 57 ARG HD2 1 1 14 7898 1 1 36 ARG HD3 H 2.844 -6.554 0.104 1.00 . A A . 57 ARG HD3 1 1 14 7899 1 1 36 ARG HE H 4.822 -5.490 1.893 1.00 . A A . 57 ARG HE 1 1 14 7900 1 1 36 ARG HG2 H 4.750 -6.925 -1.460 1.00 . A A . 57 ARG HG2 1 1 14 7901 1 1 36 ARG HG3 H 5.013 -7.626 0.132 1.00 . A A . 57 ARG HG3 1 1 14 7902 1 1 36 ARG HH11 H 1.664 -4.530 0.747 1.00 . A A . 57 ARG HH11 1 1 14 7903 1 1 36 ARG HH12 H 1.451 -3.416 2.075 1.00 . A A . 57 ARG HH12 1 1 14 7904 1 1 36 ARG HH21 H 4.433 -4.213 3.567 1.00 . A A . 57 ARG HH21 1 1 14 7905 1 1 36 ARG HH22 H 2.873 -3.431 3.773 1.00 . A A . 57 ARG HH22 1 1 14 7906 1 1 36 ARG N N 7.743 -5.118 1.474 1.00 . A A . 57 ARG N 1 1 14 7907 1 1 36 ARG NE N 3.923 -5.337 1.456 1.00 . A A . 57 ARG NE 1 1 14 7908 1 1 36 ARG NH1 N 1.939 -4.203 1.665 1.00 . A A . 57 ARG NH1 1 1 14 7909 1 1 36 ARG NH2 N 3.497 -4.006 3.236 1.00 . A A . 57 ARG NH2 1 1 14 7910 1 1 36 ARG O O 7.851 -8.302 -0.296 1.00 . A A . 57 ARG O 1 1 14 7911 1 1 37 SER C C 10.271 -9.647 0.853 1.00 . A A . 58 SER C 1 1 14 7912 1 1 37 SER CA C 10.573 -8.146 0.736 1.00 . A A . 58 SER CA 1 1 14 7913 1 1 37 SER CB C 11.703 -7.782 1.703 1.00 . A A . 58 SER CB 1 1 14 7914 1 1 37 SER H H 9.569 -6.480 1.583 1.00 . A A . 58 SER H 1 1 14 7915 1 1 37 SER HA H 10.934 -7.969 -0.276 1.00 . A A . 58 SER HA 1 1 14 7916 1 1 37 SER HB2 H 11.405 -8.038 2.722 1.00 . A A . 58 SER HB2 1 1 14 7917 1 1 37 SER HB3 H 12.594 -8.362 1.447 1.00 . A A . 58 SER HB3 1 1 14 7918 1 1 37 SER HG H 12.692 -6.185 2.266 1.00 . A A . 58 SER HG 1 1 14 7919 1 1 37 SER N N 9.407 -7.268 0.976 1.00 . A A . 58 SER N 1 1 14 7920 1 1 37 SER O O 9.684 -10.072 1.878 1.00 . A A . 58 SER O 1 1 14 7921 1 1 37 SER OXT O 10.658 -10.403 -0.067 1.00 . A A . 58 SER OXT 1 1 14 7922 1 1 37 SER OG O 11.988 -6.394 1.619 1.00 . A A . 58 SER OG 1 1 14 7923 2 2 1 ZN ZN ZN -8.416 0.260 3.538 1.00 . B A . 1059 ZN ZN 1 1 14 7924 3 2 1 ZN ZN ZN 6.919 1.242 1.856 1.00 . C A . 1060 ZN ZN 1 1 15 7925 1 1 1 GLN C C -7.005 -1.679 -5.131 1.00 . A A . 22 GLN C 1 1 15 7926 1 1 1 GLN CA C -6.270 -1.088 -6.348 1.00 . A A . 22 GLN CA 1 1 15 7927 1 1 1 GLN CB C -5.030 -0.236 -5.961 1.00 . A A . 22 GLN CB 1 1 15 7928 1 1 1 GLN CD C -3.134 -1.963 -6.243 1.00 . A A . 22 GLN CD 1 1 15 7929 1 1 1 GLN CG C -3.742 -0.639 -6.704 1.00 . A A . 22 GLN CG 1 1 15 7930 1 1 1 GLN H1 H -8.006 -0.869 -7.451 1.00 . A A . 22 GLN H1 1 1 15 7931 1 1 1 GLN H2 H -7.547 0.497 -6.667 1.00 . A A . 22 GLN H2 1 1 15 7932 1 1 1 GLN H3 H -6.755 0.023 -8.029 1.00 . A A . 22 GLN H3 1 1 15 7933 1 1 1 GLN HA H -5.923 -1.941 -6.933 1.00 . A A . 22 GLN HA 1 1 15 7934 1 1 1 GLN HB2 H -5.221 0.813 -6.192 1.00 . A A . 22 GLN HB2 1 1 15 7935 1 1 1 GLN HB3 H -4.848 -0.284 -4.889 1.00 . A A . 22 GLN HB3 1 1 15 7936 1 1 1 GLN HE21 H -1.566 -1.813 -7.513 1.00 . A A . 22 GLN HE21 1 1 15 7937 1 1 1 GLN HE22 H -1.625 -3.245 -6.493 1.00 . A A . 22 GLN HE22 1 1 15 7938 1 1 1 GLN HG2 H -3.938 -0.689 -7.777 1.00 . A A . 22 GLN HG2 1 1 15 7939 1 1 1 GLN HG3 H -2.998 0.142 -6.542 1.00 . A A . 22 GLN HG3 1 1 15 7940 1 1 1 GLN N N -7.211 -0.302 -7.190 1.00 . A A . 22 GLN N 1 1 15 7941 1 1 1 GLN NE2 N -2.013 -2.365 -6.797 1.00 . A A . 22 GLN NE2 1 1 15 7942 1 1 1 GLN O O -8.212 -1.482 -4.967 1.00 . A A . 22 GLN O 1 1 15 7943 1 1 1 GLN OE1 O -3.648 -2.660 -5.382 1.00 . A A . 22 GLN OE1 1 1 15 7944 1 1 2 THR C C -6.052 -2.673 -1.847 1.00 . A A . 23 THR C 1 1 15 7945 1 1 2 THR CA C -6.788 -3.148 -3.104 1.00 . A A . 23 THR CA 1 1 15 7946 1 1 2 THR CB C -6.577 -4.658 -3.322 1.00 . A A . 23 THR CB 1 1 15 7947 1 1 2 THR CG2 C -7.074 -5.549 -2.180 1.00 . A A . 23 THR CG2 1 1 15 7948 1 1 2 THR H H -5.293 -2.528 -4.481 1.00 . A A . 23 THR H 1 1 15 7949 1 1 2 THR HA H -7.853 -2.963 -2.976 1.00 . A A . 23 THR HA 1 1 15 7950 1 1 2 THR HB H -5.512 -4.846 -3.471 1.00 . A A . 23 THR HB 1 1 15 7951 1 1 2 THR HG1 H -7.017 -5.975 -4.685 1.00 . A A . 23 THR HG1 1 1 15 7952 1 1 2 THR HG21 H -8.137 -5.386 -2.012 1.00 . A A . 23 THR HG21 1 1 15 7953 1 1 2 THR HG22 H -6.913 -6.595 -2.437 1.00 . A A . 23 THR HG22 1 1 15 7954 1 1 2 THR HG23 H -6.521 -5.337 -1.266 1.00 . A A . 23 THR HG23 1 1 15 7955 1 1 2 THR N N -6.283 -2.408 -4.278 1.00 . A A . 23 THR N 1 1 15 7956 1 1 2 THR O O -4.876 -2.314 -1.922 1.00 . A A . 23 THR O 1 1 15 7957 1 1 2 THR OG1 O -7.280 -5.061 -4.480 1.00 . A A . 23 THR OG1 1 1 15 7958 1 1 3 CYS C C -4.992 -2.905 1.113 1.00 . A A . 24 CYS C 1 1 15 7959 1 1 3 CYS CA C -6.183 -2.101 0.552 1.00 . A A . 24 CYS CA 1 1 15 7960 1 1 3 CYS CB C -7.314 -2.063 1.582 1.00 . A A . 24 CYS CB 1 1 15 7961 1 1 3 CYS H H -7.704 -2.915 -0.709 1.00 . A A . 24 CYS H 1 1 15 7962 1 1 3 CYS HA H -5.856 -1.077 0.362 1.00 . A A . 24 CYS HA 1 1 15 7963 1 1 3 CYS HB2 H -8.232 -1.710 1.113 1.00 . A A . 24 CYS HB2 1 1 15 7964 1 1 3 CYS HB3 H -7.486 -3.069 1.968 1.00 . A A . 24 CYS HB3 1 1 15 7965 1 1 3 CYS N N -6.730 -2.632 -0.699 1.00 . A A . 24 CYS N 1 1 15 7966 1 1 3 CYS O O -4.929 -4.131 0.987 1.00 . A A . 24 CYS O 1 1 15 7967 1 1 3 CYS SG S -6.822 -0.941 2.917 1.00 . A A . 24 CYS SG 1 1 15 7968 1 1 4 TYR C C -3.648 -3.491 3.970 1.00 . A A . 25 TYR C 1 1 15 7969 1 1 4 TYR CA C -3.084 -2.829 2.694 1.00 . A A . 25 TYR CA 1 1 15 7970 1 1 4 TYR CB C -2.018 -1.786 3.074 1.00 . A A . 25 TYR CB 1 1 15 7971 1 1 4 TYR CD1 C -3.433 -0.018 4.254 1.00 . A A . 25 TYR CD1 1 1 15 7972 1 1 4 TYR CD2 C -1.542 -0.992 5.439 1.00 . A A . 25 TYR CD2 1 1 15 7973 1 1 4 TYR CE1 C -3.737 0.762 5.384 1.00 . A A . 25 TYR CE1 1 1 15 7974 1 1 4 TYR CE2 C -1.833 -0.199 6.567 1.00 . A A . 25 TYR CE2 1 1 15 7975 1 1 4 TYR CG C -2.337 -0.904 4.276 1.00 . A A . 25 TYR CG 1 1 15 7976 1 1 4 TYR CZ C -2.937 0.680 6.542 1.00 . A A . 25 TYR CZ 1 1 15 7977 1 1 4 TYR H H -4.237 -1.217 1.900 1.00 . A A . 25 TYR H 1 1 15 7978 1 1 4 TYR HA H -2.591 -3.614 2.121 1.00 . A A . 25 TYR HA 1 1 15 7979 1 1 4 TYR HB2 H -1.106 -2.338 3.297 1.00 . A A . 25 TYR HB2 1 1 15 7980 1 1 4 TYR HB3 H -1.800 -1.152 2.215 1.00 . A A . 25 TYR HB3 1 1 15 7981 1 1 4 TYR HD1 H -4.057 0.060 3.377 1.00 . A A . 25 TYR HD1 1 1 15 7982 1 1 4 TYR HD2 H -0.705 -1.679 5.469 1.00 . A A . 25 TYR HD2 1 1 15 7983 1 1 4 TYR HE1 H -4.597 1.410 5.378 1.00 . A A . 25 TYR HE1 1 1 15 7984 1 1 4 TYR HE2 H -1.220 -0.271 7.453 1.00 . A A . 25 TYR HE2 1 1 15 7985 1 1 4 TYR HH H -2.650 1.270 8.375 1.00 . A A . 25 TYR HH 1 1 15 7986 1 1 4 TYR N N -4.100 -2.214 1.830 1.00 . A A . 25 TYR N 1 1 15 7987 1 1 4 TYR O O -2.955 -4.305 4.587 1.00 . A A . 25 TYR O 1 1 15 7988 1 1 4 TYR OH O -3.255 1.434 7.631 1.00 . A A . 25 TYR OH 1 1 15 7989 1 1 5 ASN C C -6.910 -3.902 5.695 1.00 . A A . 26 ASN C 1 1 15 7990 1 1 5 ASN CA C -5.425 -3.487 5.704 1.00 . A A . 26 ASN CA 1 1 15 7991 1 1 5 ASN CB C -5.203 -2.263 6.611 1.00 . A A . 26 ASN CB 1 1 15 7992 1 1 5 ASN CG C -5.727 -2.481 8.020 1.00 . A A . 26 ASN CG 1 1 15 7993 1 1 5 ASN H H -5.384 -2.476 3.818 1.00 . A A . 26 ASN H 1 1 15 7994 1 1 5 ASN HA H -4.869 -4.327 6.128 1.00 . A A . 26 ASN HA 1 1 15 7995 1 1 5 ASN HB2 H -4.135 -2.057 6.679 1.00 . A A . 26 ASN HB2 1 1 15 7996 1 1 5 ASN HB3 H -5.687 -1.389 6.174 1.00 . A A . 26 ASN HB3 1 1 15 7997 1 1 5 ASN HD21 H -7.355 -1.320 7.703 1.00 . A A . 26 ASN HD21 1 1 15 7998 1 1 5 ASN HD22 H -7.202 -2.038 9.299 1.00 . A A . 26 ASN HD22 1 1 15 7999 1 1 5 ASN N N -4.881 -3.153 4.379 1.00 . A A . 26 ASN N 1 1 15 8000 1 1 5 ASN ND2 N -6.851 -1.890 8.365 1.00 . A A . 26 ASN ND2 1 1 15 8001 1 1 5 ASN O O -7.268 -4.884 6.350 1.00 . A A . 26 ASN O 1 1 15 8002 1 1 5 ASN OD1 O -5.139 -3.190 8.825 1.00 . A A . 26 ASN OD1 1 1 15 8003 1 1 6 CYS C C -9.586 -4.768 4.195 1.00 . A A . 27 CYS C 1 1 15 8004 1 1 6 CYS CA C -9.215 -3.444 4.904 1.00 . A A . 27 CYS CA 1 1 15 8005 1 1 6 CYS CB C -9.902 -2.255 4.204 1.00 . A A . 27 CYS CB 1 1 15 8006 1 1 6 CYS H H -7.428 -2.381 4.456 1.00 . A A . 27 CYS H 1 1 15 8007 1 1 6 CYS HA H -9.590 -3.499 5.926 1.00 . A A . 27 CYS HA 1 1 15 8008 1 1 6 CYS HB2 H -9.578 -2.205 3.164 1.00 . A A . 27 CYS HB2 1 1 15 8009 1 1 6 CYS HB3 H -10.982 -2.425 4.209 1.00 . A A . 27 CYS HB3 1 1 15 8010 1 1 6 CYS N N -7.769 -3.193 4.955 1.00 . A A . 27 CYS N 1 1 15 8011 1 1 6 CYS O O -10.687 -5.288 4.388 1.00 . A A . 27 CYS O 1 1 15 8012 1 1 6 CYS SG S -9.547 -0.682 5.046 1.00 . A A . 27 CYS SG 1 1 15 8013 1 1 7 GLY C C -10.011 -6.188 1.394 1.00 . A A . 28 GLY C 1 1 15 8014 1 1 7 GLY CA C -8.958 -6.455 2.482 1.00 . A A . 28 GLY CA 1 1 15 8015 1 1 7 GLY H H -7.787 -4.855 3.286 1.00 . A A . 28 GLY H 1 1 15 8016 1 1 7 GLY HA2 H -9.294 -7.294 3.092 1.00 . A A . 28 GLY HA2 1 1 15 8017 1 1 7 GLY HA3 H -8.031 -6.741 1.986 1.00 . A A . 28 GLY HA3 1 1 15 8018 1 1 7 GLY N N -8.691 -5.299 3.351 1.00 . A A . 28 GLY N 1 1 15 8019 1 1 7 GLY O O -10.655 -7.128 0.920 1.00 . A A . 28 GLY O 1 1 15 8020 1 1 8 LYS C C -10.631 -3.938 -1.247 1.00 . A A . 29 LYS C 1 1 15 8021 1 1 8 LYS CA C -11.244 -4.449 0.070 1.00 . A A . 29 LYS CA 1 1 15 8022 1 1 8 LYS CB C -12.070 -3.312 0.719 1.00 . A A . 29 LYS CB 1 1 15 8023 1 1 8 LYS CD C -13.331 -4.691 2.476 1.00 . A A . 29 LYS CD 1 1 15 8024 1 1 8 LYS CE C -14.732 -5.033 2.988 1.00 . A A . 29 LYS CE 1 1 15 8025 1 1 8 LYS CG C -13.434 -3.748 1.272 1.00 . A A . 29 LYS CG 1 1 15 8026 1 1 8 LYS H H -9.611 -4.218 1.427 1.00 . A A . 29 LYS H 1 1 15 8027 1 1 8 LYS HA H -11.907 -5.280 -0.161 1.00 . A A . 29 LYS HA 1 1 15 8028 1 1 8 LYS HB2 H -11.494 -2.828 1.509 1.00 . A A . 29 LYS HB2 1 1 15 8029 1 1 8 LYS HB3 H -12.279 -2.551 -0.033 1.00 . A A . 29 LYS HB3 1 1 15 8030 1 1 8 LYS HD2 H -12.817 -5.606 2.182 1.00 . A A . 29 LYS HD2 1 1 15 8031 1 1 8 LYS HD3 H -12.769 -4.195 3.266 1.00 . A A . 29 LYS HD3 1 1 15 8032 1 1 8 LYS HE2 H -15.229 -4.109 3.297 1.00 . A A . 29 LYS HE2 1 1 15 8033 1 1 8 LYS HE3 H -15.313 -5.468 2.169 1.00 . A A . 29 LYS HE3 1 1 15 8034 1 1 8 LYS HG2 H -13.975 -2.853 1.579 1.00 . A A . 29 LYS HG2 1 1 15 8035 1 1 8 LYS HG3 H -14.003 -4.234 0.479 1.00 . A A . 29 LYS HG3 1 1 15 8036 1 1 8 LYS HZ1 H -14.132 -5.606 4.894 1.00 . A A . 29 LYS HZ1 1 1 15 8037 1 1 8 LYS HZ2 H -15.600 -6.191 4.477 1.00 . A A . 29 LYS HZ2 1 1 15 8038 1 1 8 LYS HZ3 H -14.250 -6.860 3.852 1.00 . A A . 29 LYS HZ3 1 1 15 8039 1 1 8 LYS N N -10.211 -4.916 1.014 1.00 . A A . 29 LYS N 1 1 15 8040 1 1 8 LYS NZ N -14.673 -5.985 4.129 1.00 . A A . 29 LYS NZ 1 1 15 8041 1 1 8 LYS O O -9.562 -3.320 -1.204 1.00 . A A . 29 LYS O 1 1 15 8042 1 1 9 PRO C C -11.488 -1.918 -3.523 1.00 . A A . 30 PRO C 1 1 15 8043 1 1 9 PRO CA C -11.042 -3.392 -3.637 1.00 . A A . 30 PRO CA 1 1 15 8044 1 1 9 PRO CB C -11.815 -4.176 -4.707 1.00 . A A . 30 PRO CB 1 1 15 8045 1 1 9 PRO CD C -12.531 -4.918 -2.553 1.00 . A A . 30 PRO CD 1 1 15 8046 1 1 9 PRO CG C -13.061 -4.635 -3.958 1.00 . A A . 30 PRO CG 1 1 15 8047 1 1 9 PRO HA H -9.978 -3.418 -3.873 1.00 . A A . 30 PRO HA 1 1 15 8048 1 1 9 PRO HB2 H -12.067 -3.582 -5.586 1.00 . A A . 30 PRO HB2 1 1 15 8049 1 1 9 PRO HB3 H -11.232 -5.049 -5.005 1.00 . A A . 30 PRO HB3 1 1 15 8050 1 1 9 PRO HD2 H -13.291 -4.652 -1.817 1.00 . A A . 30 PRO HD2 1 1 15 8051 1 1 9 PRO HD3 H -12.277 -5.975 -2.465 1.00 . A A . 30 PRO HD3 1 1 15 8052 1 1 9 PRO HG2 H -13.790 -3.823 -3.919 1.00 . A A . 30 PRO HG2 1 1 15 8053 1 1 9 PRO HG3 H -13.502 -5.524 -4.410 1.00 . A A . 30 PRO HG3 1 1 15 8054 1 1 9 PRO N N -11.322 -4.114 -2.393 1.00 . A A . 30 PRO N 1 1 15 8055 1 1 9 PRO O O -11.804 -1.430 -2.432 1.00 . A A . 30 PRO O 1 1 15 8056 1 1 10 GLY C C -11.002 1.133 -3.809 1.00 . A A . 31 GLY C 1 1 15 8057 1 1 10 GLY CA C -11.910 0.237 -4.662 1.00 . A A . 31 GLY CA 1 1 15 8058 1 1 10 GLY H H -11.238 -1.615 -5.510 1.00 . A A . 31 GLY H 1 1 15 8059 1 1 10 GLY HA2 H -12.933 0.332 -4.299 1.00 . A A . 31 GLY HA2 1 1 15 8060 1 1 10 GLY HA3 H -11.873 0.599 -5.690 1.00 . A A . 31 GLY HA3 1 1 15 8061 1 1 10 GLY N N -11.511 -1.180 -4.639 1.00 . A A . 31 GLY N 1 1 15 8062 1 1 10 GLY O O -11.453 2.137 -3.251 1.00 . A A . 31 GLY O 1 1 15 8063 1 1 11 HIS C C -7.596 1.989 -3.596 1.00 . A A . 32 HIS C 1 1 15 8064 1 1 11 HIS CA C -8.744 1.366 -2.799 1.00 . A A . 32 HIS CA 1 1 15 8065 1 1 11 HIS CB C -8.236 0.333 -1.780 1.00 . A A . 32 HIS CB 1 1 15 8066 1 1 11 HIS CD2 C -8.584 0.899 0.693 1.00 . A A . 32 HIS CD2 1 1 15 8067 1 1 11 HIS CE1 C -10.583 0.053 1.021 1.00 . A A . 32 HIS CE1 1 1 15 8068 1 1 11 HIS CG C -9.010 0.356 -0.488 1.00 . A A . 32 HIS CG 1 1 15 8069 1 1 11 HIS H H -9.437 -0.085 -4.181 1.00 . A A . 32 HIS H 1 1 15 8070 1 1 11 HIS HA H -9.216 2.175 -2.247 1.00 . A A . 32 HIS HA 1 1 15 8071 1 1 11 HIS HB2 H -8.284 -0.667 -2.208 1.00 . A A . 32 HIS HB2 1 1 15 8072 1 1 11 HIS HB3 H -7.190 0.537 -1.546 1.00 . A A . 32 HIS HB3 1 1 15 8073 1 1 11 HIS HD1 H -10.851 -0.629 -0.962 1.00 . A A . 32 HIS HD1 1 1 15 8074 1 1 11 HIS HD2 H -7.630 1.383 0.853 1.00 . A A . 32 HIS HD2 1 1 15 8075 1 1 11 HIS HE1 H -11.517 -0.245 1.484 1.00 . A A . 32 HIS HE1 1 1 15 8076 1 1 11 HIS N N -9.733 0.742 -3.675 1.00 . A A . 32 HIS N 1 1 15 8077 1 1 11 HIS ND1 N -10.264 -0.163 -0.269 1.00 . A A . 32 HIS ND1 1 1 15 8078 1 1 11 HIS NE2 N -9.579 0.686 1.659 1.00 . A A . 32 HIS NE2 1 1 15 8079 1 1 11 HIS O O -7.249 1.549 -4.694 1.00 . A A . 32 HIS O 1 1 15 8080 1 1 12 LEU C C -5.196 4.526 -2.379 1.00 . A A . 33 LEU C 1 1 15 8081 1 1 12 LEU CA C -5.996 3.923 -3.546 1.00 . A A . 33 LEU CA 1 1 15 8082 1 1 12 LEU CB C -6.675 5.071 -4.336 1.00 . A A . 33 LEU CB 1 1 15 8083 1 1 12 LEU CD1 C -8.056 5.922 -6.245 1.00 . A A . 33 LEU CD1 1 1 15 8084 1 1 12 LEU CD2 C -6.361 4.176 -6.699 1.00 . A A . 33 LEU CD2 1 1 15 8085 1 1 12 LEU CG C -7.361 4.691 -5.661 1.00 . A A . 33 LEU CG 1 1 15 8086 1 1 12 LEU H H -7.333 3.258 -2.069 1.00 . A A . 33 LEU H 1 1 15 8087 1 1 12 LEU HA H -5.307 3.367 -4.186 1.00 . A A . 33 LEU HA 1 1 15 8088 1 1 12 LEU HB2 H -7.419 5.536 -3.686 1.00 . A A . 33 LEU HB2 1 1 15 8089 1 1 12 LEU HB3 H -5.930 5.833 -4.565 1.00 . A A . 33 LEU HB3 1 1 15 8090 1 1 12 LEU HD11 H -8.798 6.294 -5.539 1.00 . A A . 33 LEU HD11 1 1 15 8091 1 1 12 LEU HD12 H -7.327 6.707 -6.447 1.00 . A A . 33 LEU HD12 1 1 15 8092 1 1 12 LEU HD13 H -8.561 5.654 -7.173 1.00 . A A . 33 LEU HD13 1 1 15 8093 1 1 12 LEU HD21 H -5.588 4.924 -6.880 1.00 . A A . 33 LEU HD21 1 1 15 8094 1 1 12 LEU HD22 H -5.896 3.257 -6.348 1.00 . A A . 33 LEU HD22 1 1 15 8095 1 1 12 LEU HD23 H -6.879 3.964 -7.634 1.00 . A A . 33 LEU HD23 1 1 15 8096 1 1 12 LEU HG H -8.121 3.933 -5.485 1.00 . A A . 33 LEU HG 1 1 15 8097 1 1 12 LEU N N -7.025 3.037 -3.005 1.00 . A A . 33 LEU N 1 1 15 8098 1 1 12 LEU O O -5.625 4.463 -1.224 1.00 . A A . 33 LEU O 1 1 15 8099 1 1 13 SER C C -3.994 7.177 -1.062 1.00 . A A . 34 SER C 1 1 15 8100 1 1 13 SER CA C -3.265 6.039 -1.813 1.00 . A A . 34 SER CA 1 1 15 8101 1 1 13 SER CB C -2.137 6.642 -2.655 1.00 . A A . 34 SER CB 1 1 15 8102 1 1 13 SER H H -3.801 5.175 -3.670 1.00 . A A . 34 SER H 1 1 15 8103 1 1 13 SER HA H -2.823 5.388 -1.060 1.00 . A A . 34 SER HA 1 1 15 8104 1 1 13 SER HB2 H -2.562 7.347 -3.373 1.00 . A A . 34 SER HB2 1 1 15 8105 1 1 13 SER HB3 H -1.442 7.178 -2.011 1.00 . A A . 34 SER HB3 1 1 15 8106 1 1 13 SER HG H -0.820 6.028 -3.975 1.00 . A A . 34 SER HG 1 1 15 8107 1 1 13 SER N N -4.104 5.215 -2.706 1.00 . A A . 34 SER N 1 1 15 8108 1 1 13 SER O O -3.376 7.875 -0.256 1.00 . A A . 34 SER O 1 1 15 8109 1 1 13 SER OG O -1.451 5.614 -3.356 1.00 . A A . 34 SER OG 1 1 15 8110 1 1 14 SER C C -7.422 7.718 -0.023 1.00 . A A . 35 SER C 1 1 15 8111 1 1 14 SER CA C -6.186 8.352 -0.690 1.00 . A A . 35 SER CA 1 1 15 8112 1 1 14 SER CB C -6.633 9.372 -1.742 1.00 . A A . 35 SER CB 1 1 15 8113 1 1 14 SER H H -5.686 6.834 -2.081 1.00 . A A . 35 SER H 1 1 15 8114 1 1 14 SER HA H -5.644 8.890 0.088 1.00 . A A . 35 SER HA 1 1 15 8115 1 1 14 SER HB2 H -7.323 10.088 -1.290 1.00 . A A . 35 SER HB2 1 1 15 8116 1 1 14 SER HB3 H -5.760 9.914 -2.111 1.00 . A A . 35 SER HB3 1 1 15 8117 1 1 14 SER HG H -7.551 9.384 -3.477 1.00 . A A . 35 SER HG 1 1 15 8118 1 1 14 SER N N -5.291 7.373 -1.326 1.00 . A A . 35 SER N 1 1 15 8119 1 1 14 SER O O -8.088 8.381 0.777 1.00 . A A . 35 SER O 1 1 15 8120 1 1 14 SER OG O -7.270 8.708 -2.829 1.00 . A A . 35 SER OG 1 1 15 8121 1 1 15 GLN C C -8.221 5.188 1.788 1.00 . A A . 36 GLN C 1 1 15 8122 1 1 15 GLN CA C -8.750 5.664 0.418 1.00 . A A . 36 GLN CA 1 1 15 8123 1 1 15 GLN CB C -9.167 4.466 -0.457 1.00 . A A . 36 GLN CB 1 1 15 8124 1 1 15 GLN CD C -11.716 4.568 -0.351 1.00 . A A . 36 GLN CD 1 1 15 8125 1 1 15 GLN CG C -10.461 3.772 0.003 1.00 . A A . 36 GLN CG 1 1 15 8126 1 1 15 GLN H H -7.109 5.939 -0.924 1.00 . A A . 36 GLN H 1 1 15 8127 1 1 15 GLN HA H -9.619 6.300 0.586 1.00 . A A . 36 GLN HA 1 1 15 8128 1 1 15 GLN HB2 H -9.307 4.799 -1.487 1.00 . A A . 36 GLN HB2 1 1 15 8129 1 1 15 GLN HB3 H -8.360 3.733 -0.448 1.00 . A A . 36 GLN HB3 1 1 15 8130 1 1 15 GLN HE21 H -12.031 3.516 -2.062 1.00 . A A . 36 GLN HE21 1 1 15 8131 1 1 15 GLN HE22 H -13.192 4.789 -1.690 1.00 . A A . 36 GLN HE22 1 1 15 8132 1 1 15 GLN HG2 H -10.529 2.802 -0.484 1.00 . A A . 36 GLN HG2 1 1 15 8133 1 1 15 GLN HG3 H -10.434 3.595 1.077 1.00 . A A . 36 GLN HG3 1 1 15 8134 1 1 15 GLN N N -7.721 6.439 -0.295 1.00 . A A . 36 GLN N 1 1 15 8135 1 1 15 GLN NE2 N -12.361 4.267 -1.460 1.00 . A A . 36 GLN NE2 1 1 15 8136 1 1 15 GLN O O -8.934 5.262 2.790 1.00 . A A . 36 GLN O 1 1 15 8137 1 1 15 GLN OE1 O -12.139 5.472 0.358 1.00 . A A . 36 GLN OE1 1 1 15 8138 1 1 16 CYS C C -4.704 4.948 2.844 1.00 . A A . 37 CYS C 1 1 15 8139 1 1 16 CYS CA C -6.147 4.407 2.984 1.00 . A A . 37 CYS CA 1 1 15 8140 1 1 16 CYS CB C -6.167 2.875 3.137 1.00 . A A . 37 CYS CB 1 1 15 8141 1 1 16 CYS H H -6.443 4.795 0.934 1.00 . A A . 37 CYS H 1 1 15 8142 1 1 16 CYS HA H -6.577 4.861 3.874 1.00 . A A . 37 CYS HA 1 1 15 8143 1 1 16 CYS HB2 H -6.110 2.402 2.154 1.00 . A A . 37 CYS HB2 1 1 15 8144 1 1 16 CYS HB3 H -5.291 2.552 3.697 1.00 . A A . 37 CYS HB3 1 1 15 8145 1 1 16 CYS N N -6.944 4.779 1.813 1.00 . A A . 37 CYS N 1 1 15 8146 1 1 16 CYS O O -4.333 5.487 1.798 1.00 . A A . 37 CYS O 1 1 15 8147 1 1 16 CYS SG S -7.653 2.337 4.031 1.00 . A A . 37 CYS SG 1 1 15 8148 1 1 17 ARG C C -1.636 4.725 2.753 1.00 . A A . 38 ARG C 1 1 15 8149 1 1 17 ARG CA C -2.474 5.243 3.933 1.00 . A A . 38 ARG CA 1 1 15 8150 1 1 17 ARG CB C -1.801 4.855 5.264 1.00 . A A . 38 ARG CB 1 1 15 8151 1 1 17 ARG CD C -3.332 5.017 7.361 1.00 . A A . 38 ARG CD 1 1 15 8152 1 1 17 ARG CG C -2.234 5.665 6.502 1.00 . A A . 38 ARG CG 1 1 15 8153 1 1 17 ARG CZ C -5.721 4.462 6.821 1.00 . A A . 38 ARG CZ 1 1 15 8154 1 1 17 ARG H H -4.257 4.340 4.717 1.00 . A A . 38 ARG H 1 1 15 8155 1 1 17 ARG HA H -2.457 6.331 3.844 1.00 . A A . 38 ARG HA 1 1 15 8156 1 1 17 ARG HB2 H -1.929 3.787 5.450 1.00 . A A . 38 ARG HB2 1 1 15 8157 1 1 17 ARG HB3 H -0.730 5.031 5.144 1.00 . A A . 38 ARG HB3 1 1 15 8158 1 1 17 ARG HD2 H -3.139 3.949 7.428 1.00 . A A . 38 ARG HD2 1 1 15 8159 1 1 17 ARG HD3 H -3.250 5.425 8.371 1.00 . A A . 38 ARG HD3 1 1 15 8160 1 1 17 ARG HE H -4.901 6.260 6.646 1.00 . A A . 38 ARG HE 1 1 15 8161 1 1 17 ARG HG2 H -1.356 5.755 7.142 1.00 . A A . 38 ARG HG2 1 1 15 8162 1 1 17 ARG HG3 H -2.525 6.677 6.214 1.00 . A A . 38 ARG HG3 1 1 15 8163 1 1 17 ARG HH11 H -4.726 2.811 7.395 1.00 . A A . 38 ARG HH11 1 1 15 8164 1 1 17 ARG HH12 H -6.418 2.598 7.029 1.00 . A A . 38 ARG HH12 1 1 15 8165 1 1 17 ARG HH21 H -7.047 5.862 6.254 1.00 . A A . 38 ARG HH21 1 1 15 8166 1 1 17 ARG HH22 H -7.640 4.230 6.301 1.00 . A A . 38 ARG HH22 1 1 15 8167 1 1 17 ARG N N -3.880 4.788 3.894 1.00 . A A . 38 ARG N 1 1 15 8168 1 1 17 ARG NE N -4.698 5.298 6.872 1.00 . A A . 38 ARG NE 1 1 15 8169 1 1 17 ARG NH1 N -5.614 3.195 7.097 1.00 . A A . 38 ARG NH1 1 1 15 8170 1 1 17 ARG NH2 N -6.893 4.888 6.453 1.00 . A A . 38 ARG NH2 1 1 15 8171 1 1 17 ARG O O -0.774 5.454 2.256 1.00 . A A . 38 ARG O 1 1 15 8172 1 1 18 ALA C C -2.342 1.808 0.525 1.00 . A A . 39 ALA C 1 1 15 8173 1 1 18 ALA CA C -1.425 2.950 1.022 1.00 . A A . 39 ALA CA 1 1 15 8174 1 1 18 ALA CB C -0.004 2.413 1.254 1.00 . A A . 39 ALA CB 1 1 15 8175 1 1 18 ALA H H -2.620 2.976 2.769 1.00 . A A . 39 ALA H 1 1 15 8176 1 1 18 ALA HA H -1.396 3.739 0.269 1.00 . A A . 39 ALA HA 1 1 15 8177 1 1 18 ALA HB1 H -0.035 1.619 2.001 1.00 . A A . 39 ALA HB1 1 1 15 8178 1 1 18 ALA HB2 H 0.395 2.002 0.328 1.00 . A A . 39 ALA HB2 1 1 15 8179 1 1 18 ALA HB3 H 0.655 3.212 1.598 1.00 . A A . 39 ALA HB3 1 1 15 8180 1 1 18 ALA N N -1.919 3.512 2.280 1.00 . A A . 39 ALA N 1 1 15 8181 1 1 18 ALA O O -3.059 1.203 1.330 1.00 . A A . 39 ALA O 1 1 15 8182 1 1 19 PRO C C -1.813 -0.984 -0.832 1.00 . A A . 40 PRO C 1 1 15 8183 1 1 19 PRO CA C -2.773 0.151 -1.249 1.00 . A A . 40 PRO CA 1 1 15 8184 1 1 19 PRO CB C -2.862 0.315 -2.769 1.00 . A A . 40 PRO CB 1 1 15 8185 1 1 19 PRO CD C -1.699 2.209 -1.866 1.00 . A A . 40 PRO CD 1 1 15 8186 1 1 19 PRO CG C -1.727 1.287 -3.086 1.00 . A A . 40 PRO CG 1 1 15 8187 1 1 19 PRO HA H -3.766 -0.065 -0.852 1.00 . A A . 40 PRO HA 1 1 15 8188 1 1 19 PRO HB2 H -2.751 -0.628 -3.306 1.00 . A A . 40 PRO HB2 1 1 15 8189 1 1 19 PRO HB3 H -3.815 0.784 -3.020 1.00 . A A . 40 PRO HB3 1 1 15 8190 1 1 19 PRO HD2 H -0.673 2.501 -1.646 1.00 . A A . 40 PRO HD2 1 1 15 8191 1 1 19 PRO HD3 H -2.304 3.093 -2.062 1.00 . A A . 40 PRO HD3 1 1 15 8192 1 1 19 PRO HG2 H -0.785 0.743 -3.153 1.00 . A A . 40 PRO HG2 1 1 15 8193 1 1 19 PRO HG3 H -1.914 1.843 -4.006 1.00 . A A . 40 PRO HG3 1 1 15 8194 1 1 19 PRO N N -2.298 1.450 -0.773 1.00 . A A . 40 PRO N 1 1 15 8195 1 1 19 PRO O O -0.730 -0.737 -0.295 1.00 . A A . 40 PRO O 1 1 15 8196 1 1 20 LYS C C 0.020 -3.538 -1.274 1.00 . A A . 41 LYS C 1 1 15 8197 1 1 20 LYS CA C -1.451 -3.491 -0.817 1.00 . A A . 41 LYS CA 1 1 15 8198 1 1 20 LYS CB C -2.273 -4.670 -1.374 1.00 . A A . 41 LYS CB 1 1 15 8199 1 1 20 LYS CD C -2.816 -7.146 -1.245 1.00 . A A . 41 LYS CD 1 1 15 8200 1 1 20 LYS CE C -2.341 -8.493 -0.686 1.00 . A A . 41 LYS CE 1 1 15 8201 1 1 20 LYS CG C -1.856 -6.035 -0.803 1.00 . A A . 41 LYS CG 1 1 15 8202 1 1 20 LYS H H -3.095 -2.341 -1.564 1.00 . A A . 41 LYS H 1 1 15 8203 1 1 20 LYS HA H -1.419 -3.585 0.268 1.00 . A A . 41 LYS HA 1 1 15 8204 1 1 20 LYS HB2 H -3.323 -4.512 -1.124 1.00 . A A . 41 LYS HB2 1 1 15 8205 1 1 20 LYS HB3 H -2.189 -4.690 -2.463 1.00 . A A . 41 LYS HB3 1 1 15 8206 1 1 20 LYS HD2 H -3.819 -6.927 -0.873 1.00 . A A . 41 LYS HD2 1 1 15 8207 1 1 20 LYS HD3 H -2.840 -7.191 -2.335 1.00 . A A . 41 LYS HD3 1 1 15 8208 1 1 20 LYS HE2 H -1.323 -8.681 -1.042 1.00 . A A . 41 LYS HE2 1 1 15 8209 1 1 20 LYS HE3 H -2.304 -8.429 0.405 1.00 . A A . 41 LYS HE3 1 1 15 8210 1 1 20 LYS HG2 H -0.853 -6.286 -1.151 1.00 . A A . 41 LYS HG2 1 1 15 8211 1 1 20 LYS HG3 H -1.849 -5.982 0.287 1.00 . A A . 41 LYS HG3 1 1 15 8212 1 1 20 LYS HZ1 H -3.266 -9.700 -2.106 1.00 . A A . 41 LYS HZ1 1 1 15 8213 1 1 20 LYS HZ2 H -2.905 -10.491 -0.727 1.00 . A A . 41 LYS HZ2 1 1 15 8214 1 1 20 LYS HZ3 H -4.175 -9.471 -0.764 1.00 . A A . 41 LYS HZ3 1 1 15 8215 1 1 20 LYS N N -2.180 -2.238 -1.131 1.00 . A A . 41 LYS N 1 1 15 8216 1 1 20 LYS NZ N -3.233 -9.609 -1.099 1.00 . A A . 41 LYS NZ 1 1 15 8217 1 1 20 LYS O O 0.790 -4.366 -0.789 1.00 . A A . 41 LYS O 1 1 15 8218 1 1 21 VAL C C 2.723 -2.033 -1.287 1.00 . A A . 42 VAL C 1 1 15 8219 1 1 21 VAL CA C 1.833 -2.334 -2.510 1.00 . A A . 42 VAL CA 1 1 15 8220 1 1 21 VAL CB C 1.868 -1.144 -3.496 1.00 . A A . 42 VAL CB 1 1 15 8221 1 1 21 VAL CG1 C 3.282 -0.806 -3.970 1.00 . A A . 42 VAL CG1 1 1 15 8222 1 1 21 VAL CG2 C 1.022 -1.417 -4.750 1.00 . A A . 42 VAL CG2 1 1 15 8223 1 1 21 VAL H H -0.275 -1.999 -2.502 1.00 . A A . 42 VAL H 1 1 15 8224 1 1 21 VAL HA H 2.251 -3.209 -3.013 1.00 . A A . 42 VAL HA 1 1 15 8225 1 1 21 VAL HB H 1.461 -0.264 -2.995 1.00 . A A . 42 VAL HB 1 1 15 8226 1 1 21 VAL HG11 H 3.738 -1.685 -4.430 1.00 . A A . 42 VAL HG11 1 1 15 8227 1 1 21 VAL HG12 H 3.251 0.003 -4.700 1.00 . A A . 42 VAL HG12 1 1 15 8228 1 1 21 VAL HG13 H 3.895 -0.477 -3.132 1.00 . A A . 42 VAL HG13 1 1 15 8229 1 1 21 VAL HG21 H 1.380 -2.316 -5.252 1.00 . A A . 42 VAL HG21 1 1 15 8230 1 1 21 VAL HG22 H -0.028 -1.545 -4.490 1.00 . A A . 42 VAL HG22 1 1 15 8231 1 1 21 VAL HG23 H 1.092 -0.572 -5.436 1.00 . A A . 42 VAL HG23 1 1 15 8232 1 1 21 VAL N N 0.433 -2.620 -2.146 1.00 . A A . 42 VAL N 1 1 15 8233 1 1 21 VAL O O 3.882 -2.446 -1.261 1.00 . A A . 42 VAL O 1 1 15 8234 1 1 22 CYS C C 2.056 -0.730 2.137 1.00 . A A . 43 CYS C 1 1 15 8235 1 1 22 CYS CA C 2.936 -0.779 0.861 1.00 . A A . 43 CYS CA 1 1 15 8236 1 1 22 CYS CB C 3.462 0.598 0.404 1.00 . A A . 43 CYS CB 1 1 15 8237 1 1 22 CYS H H 1.205 -1.100 -0.331 1.00 . A A . 43 CYS H 1 1 15 8238 1 1 22 CYS HA H 3.795 -1.417 1.078 1.00 . A A . 43 CYS HA 1 1 15 8239 1 1 22 CYS HB2 H 3.922 0.485 -0.581 1.00 . A A . 43 CYS HB2 1 1 15 8240 1 1 22 CYS HB3 H 2.627 1.296 0.307 1.00 . A A . 43 CYS HB3 1 1 15 8241 1 1 22 CYS N N 2.190 -1.337 -0.274 1.00 . A A . 43 CYS N 1 1 15 8242 1 1 22 CYS O O 1.151 -1.548 2.322 1.00 . A A . 43 CYS O 1 1 15 8243 1 1 22 CYS SG S 4.708 1.268 1.542 1.00 . A A . 43 CYS SG 1 1 15 8244 1 1 23 PHE C C 1.541 2.103 4.472 1.00 . A A . 44 PHE C 1 1 15 8245 1 1 23 PHE CA C 1.551 0.582 4.207 1.00 . A A . 44 PHE CA 1 1 15 8246 1 1 23 PHE CB C 2.064 -0.178 5.441 1.00 . A A . 44 PHE CB 1 1 15 8247 1 1 23 PHE CD1 C 4.596 0.077 5.467 1.00 . A A . 44 PHE CD1 1 1 15 8248 1 1 23 PHE CD2 C 3.283 1.223 7.167 1.00 . A A . 44 PHE CD2 1 1 15 8249 1 1 23 PHE CE1 C 5.771 0.628 6.010 1.00 . A A . 44 PHE CE1 1 1 15 8250 1 1 23 PHE CE2 C 4.459 1.774 7.708 1.00 . A A . 44 PHE CE2 1 1 15 8251 1 1 23 PHE CG C 3.346 0.376 6.043 1.00 . A A . 44 PHE CG 1 1 15 8252 1 1 23 PHE CZ C 5.704 1.477 7.127 1.00 . A A . 44 PHE CZ 1 1 15 8253 1 1 23 PHE H H 3.158 0.767 2.805 1.00 . A A . 44 PHE H 1 1 15 8254 1 1 23 PHE HA H 0.517 0.282 4.033 1.00 . A A . 44 PHE HA 1 1 15 8255 1 1 23 PHE HB2 H 1.287 -0.143 6.204 1.00 . A A . 44 PHE HB2 1 1 15 8256 1 1 23 PHE HB3 H 2.211 -1.229 5.187 1.00 . A A . 44 PHE HB3 1 1 15 8257 1 1 23 PHE HD1 H 4.658 -0.574 4.605 1.00 . A A . 44 PHE HD1 1 1 15 8258 1 1 23 PHE HD2 H 2.327 1.463 7.613 1.00 . A A . 44 PHE HD2 1 1 15 8259 1 1 23 PHE HE1 H 6.732 0.395 5.568 1.00 . A A . 44 PHE HE1 1 1 15 8260 1 1 23 PHE HE2 H 4.405 2.427 8.568 1.00 . A A . 44 PHE HE2 1 1 15 8261 1 1 23 PHE HZ H 6.610 1.901 7.541 1.00 . A A . 44 PHE HZ 1 1 15 8262 1 1 23 PHE N N 2.346 0.211 3.032 1.00 . A A . 44 PHE N 1 1 15 8263 1 1 23 PHE O O 0.605 2.595 5.104 1.00 . A A . 44 PHE O 1 1 15 8264 1 1 24 LYS C C 3.508 5.035 3.136 1.00 . A A . 45 LYS C 1 1 15 8265 1 1 24 LYS CA C 2.684 4.310 4.209 1.00 . A A . 45 LYS CA 1 1 15 8266 1 1 24 LYS CB C 3.297 4.535 5.608 1.00 . A A . 45 LYS CB 1 1 15 8267 1 1 24 LYS CD C 3.955 6.183 7.411 1.00 . A A . 45 LYS CD 1 1 15 8268 1 1 24 LYS CE C 4.016 7.668 7.784 1.00 . A A . 45 LYS CE 1 1 15 8269 1 1 24 LYS CG C 3.365 6.019 6.004 1.00 . A A . 45 LYS CG 1 1 15 8270 1 1 24 LYS H H 3.284 2.381 3.482 1.00 . A A . 45 LYS H 1 1 15 8271 1 1 24 LYS HA H 1.690 4.761 4.195 1.00 . A A . 45 LYS HA 1 1 15 8272 1 1 24 LYS HB2 H 2.688 4.015 6.348 1.00 . A A . 45 LYS HB2 1 1 15 8273 1 1 24 LYS HB3 H 4.302 4.109 5.638 1.00 . A A . 45 LYS HB3 1 1 15 8274 1 1 24 LYS HD2 H 3.331 5.650 8.130 1.00 . A A . 45 LYS HD2 1 1 15 8275 1 1 24 LYS HD3 H 4.962 5.760 7.430 1.00 . A A . 45 LYS HD3 1 1 15 8276 1 1 24 LYS HE2 H 4.614 8.197 7.035 1.00 . A A . 45 LYS HE2 1 1 15 8277 1 1 24 LYS HE3 H 3.002 8.081 7.753 1.00 . A A . 45 LYS HE3 1 1 15 8278 1 1 24 LYS HG2 H 3.993 6.561 5.296 1.00 . A A . 45 LYS HG2 1 1 15 8279 1 1 24 LYS HG3 H 2.360 6.442 5.981 1.00 . A A . 45 LYS HG3 1 1 15 8280 1 1 24 LYS HZ1 H 4.061 7.403 9.847 1.00 . A A . 45 LYS HZ1 1 1 15 8281 1 1 24 LYS HZ2 H 5.549 7.518 9.182 1.00 . A A . 45 LYS HZ2 1 1 15 8282 1 1 24 LYS HZ3 H 4.634 8.853 9.374 1.00 . A A . 45 LYS HZ3 1 1 15 8283 1 1 24 LYS N N 2.551 2.854 3.990 1.00 . A A . 45 LYS N 1 1 15 8284 1 1 24 LYS NZ N 4.603 7.871 9.135 1.00 . A A . 45 LYS NZ 1 1 15 8285 1 1 24 LYS O O 3.011 6.003 2.558 1.00 . A A . 45 LYS O 1 1 15 8286 1 1 25 CYS C C 5.472 5.181 0.510 1.00 . A A . 46 CYS C 1 1 15 8287 1 1 25 CYS CA C 5.716 5.304 2.031 1.00 . A A . 46 CYS CA 1 1 15 8288 1 1 25 CYS CB C 7.140 4.888 2.446 1.00 . A A . 46 CYS CB 1 1 15 8289 1 1 25 CYS H H 5.102 3.819 3.406 1.00 . A A . 46 CYS H 1 1 15 8290 1 1 25 CYS HA H 5.631 6.370 2.255 1.00 . A A . 46 CYS HA 1 1 15 8291 1 1 25 CYS HB2 H 7.834 5.088 1.627 1.00 . A A . 46 CYS HB2 1 1 15 8292 1 1 25 CYS HB3 H 7.443 5.511 3.291 1.00 . A A . 46 CYS HB3 1 1 15 8293 1 1 25 CYS N N 4.743 4.600 2.876 1.00 . A A . 46 CYS N 1 1 15 8294 1 1 25 CYS O O 5.749 6.137 -0.216 1.00 . A A . 46 CYS O 1 1 15 8295 1 1 25 CYS SG S 7.264 3.149 2.952 1.00 . A A . 46 CYS SG 1 1 15 8296 1 1 26 LYS C C 5.034 4.356 -2.547 1.00 . A A . 47 LYS C 1 1 15 8297 1 1 26 LYS CA C 4.276 3.842 -1.297 1.00 . A A . 47 LYS CA 1 1 15 8298 1 1 26 LYS CB C 2.787 4.262 -1.245 1.00 . A A . 47 LYS CB 1 1 15 8299 1 1 26 LYS CD C 1.073 6.104 -0.893 1.00 . A A . 47 LYS CD 1 1 15 8300 1 1 26 LYS CE C 0.839 7.479 -0.250 1.00 . A A . 47 LYS CE 1 1 15 8301 1 1 26 LYS CG C 2.564 5.752 -0.939 1.00 . A A . 47 LYS CG 1 1 15 8302 1 1 26 LYS H H 4.738 3.334 0.727 1.00 . A A . 47 LYS H 1 1 15 8303 1 1 26 LYS HA H 4.261 2.762 -1.444 1.00 . A A . 47 LYS HA 1 1 15 8304 1 1 26 LYS HB2 H 2.304 4.012 -2.191 1.00 . A A . 47 LYS HB2 1 1 15 8305 1 1 26 LYS HB3 H 2.297 3.674 -0.468 1.00 . A A . 47 LYS HB3 1 1 15 8306 1 1 26 LYS HD2 H 0.705 6.122 -1.917 1.00 . A A . 47 LYS HD2 1 1 15 8307 1 1 26 LYS HD3 H 0.518 5.344 -0.339 1.00 . A A . 47 LYS HD3 1 1 15 8308 1 1 26 LYS HE2 H 1.554 8.193 -0.670 1.00 . A A . 47 LYS HE2 1 1 15 8309 1 1 26 LYS HE3 H -0.166 7.822 -0.510 1.00 . A A . 47 LYS HE3 1 1 15 8310 1 1 26 LYS HG2 H 3.000 5.986 0.026 1.00 . A A . 47 LYS HG2 1 1 15 8311 1 1 26 LYS HG3 H 3.053 6.364 -1.697 1.00 . A A . 47 LYS HG3 1 1 15 8312 1 1 26 LYS HZ1 H 1.873 7.077 1.525 1.00 . A A . 47 LYS HZ1 1 1 15 8313 1 1 26 LYS HZ2 H 0.829 8.339 1.645 1.00 . A A . 47 LYS HZ2 1 1 15 8314 1 1 26 LYS HZ3 H 0.273 6.795 1.626 1.00 . A A . 47 LYS HZ3 1 1 15 8315 1 1 26 LYS N N 4.885 4.067 0.040 1.00 . A A . 47 LYS N 1 1 15 8316 1 1 26 LYS NZ N 0.965 7.428 1.230 1.00 . A A . 47 LYS NZ 1 1 15 8317 1 1 26 LYS O O 4.414 4.629 -3.576 1.00 . A A . 47 LYS O 1 1 15 8318 1 1 27 GLN C C 7.240 3.878 -4.774 1.00 . A A . 48 GLN C 1 1 15 8319 1 1 27 GLN CA C 7.202 4.916 -3.621 1.00 . A A . 48 GLN CA 1 1 15 8320 1 1 27 GLN CB C 8.628 5.236 -3.128 1.00 . A A . 48 GLN CB 1 1 15 8321 1 1 27 GLN CD C 8.071 7.658 -2.531 1.00 . A A . 48 GLN CD 1 1 15 8322 1 1 27 GLN CG C 8.697 6.343 -2.064 1.00 . A A . 48 GLN CG 1 1 15 8323 1 1 27 GLN H H 6.814 4.257 -1.614 1.00 . A A . 48 GLN H 1 1 15 8324 1 1 27 GLN HA H 6.756 5.832 -4.004 1.00 . A A . 48 GLN HA 1 1 15 8325 1 1 27 GLN HB2 H 9.074 4.334 -2.713 1.00 . A A . 48 GLN HB2 1 1 15 8326 1 1 27 GLN HB3 H 9.238 5.544 -3.977 1.00 . A A . 48 GLN HB3 1 1 15 8327 1 1 27 GLN HE21 H 6.458 7.434 -1.329 1.00 . A A . 48 GLN HE21 1 1 15 8328 1 1 27 GLN HE22 H 6.504 8.893 -2.326 1.00 . A A . 48 GLN HE22 1 1 15 8329 1 1 27 GLN HG2 H 8.213 6.005 -1.148 1.00 . A A . 48 GLN HG2 1 1 15 8330 1 1 27 GLN HG3 H 9.744 6.529 -1.821 1.00 . A A . 48 GLN HG3 1 1 15 8331 1 1 27 GLN N N 6.364 4.475 -2.489 1.00 . A A . 48 GLN N 1 1 15 8332 1 1 27 GLN NE2 N 6.918 8.027 -2.018 1.00 . A A . 48 GLN NE2 1 1 15 8333 1 1 27 GLN O O 7.113 2.680 -4.493 1.00 . A A . 48 GLN O 1 1 15 8334 1 1 27 GLN OE1 O 8.600 8.364 -3.379 1.00 . A A . 48 GLN OE1 1 1 15 8335 1 1 28 PRO C C 7.944 2.077 -7.358 1.00 . A A . 49 PRO C 1 1 15 8336 1 1 28 PRO CA C 7.271 3.463 -7.258 1.00 . A A . 49 PRO CA 1 1 15 8337 1 1 28 PRO CB C 7.738 4.339 -8.425 1.00 . A A . 49 PRO CB 1 1 15 8338 1 1 28 PRO CD C 7.719 5.671 -6.450 1.00 . A A . 49 PRO CD 1 1 15 8339 1 1 28 PRO CG C 7.431 5.750 -7.947 1.00 . A A . 49 PRO CG 1 1 15 8340 1 1 28 PRO HA H 6.196 3.305 -7.369 1.00 . A A . 49 PRO HA 1 1 15 8341 1 1 28 PRO HB2 H 8.816 4.233 -8.567 1.00 . A A . 49 PRO HB2 1 1 15 8342 1 1 28 PRO HB3 H 7.205 4.104 -9.347 1.00 . A A . 49 PRO HB3 1 1 15 8343 1 1 28 PRO HD2 H 8.770 5.907 -6.271 1.00 . A A . 49 PRO HD2 1 1 15 8344 1 1 28 PRO HD3 H 7.080 6.385 -5.934 1.00 . A A . 49 PRO HD3 1 1 15 8345 1 1 28 PRO HG2 H 8.057 6.494 -8.441 1.00 . A A . 49 PRO HG2 1 1 15 8346 1 1 28 PRO HG3 H 6.373 5.970 -8.104 1.00 . A A . 49 PRO HG3 1 1 15 8347 1 1 28 PRO N N 7.459 4.287 -6.047 1.00 . A A . 49 PRO N 1 1 15 8348 1 1 28 PRO O O 7.507 1.267 -8.179 1.00 . A A . 49 PRO O 1 1 15 8349 1 1 29 GLY C C 10.364 0.046 -5.290 1.00 . A A . 50 GLY C 1 1 15 8350 1 1 29 GLY CA C 9.683 0.481 -6.596 1.00 . A A . 50 GLY CA 1 1 15 8351 1 1 29 GLY H H 9.343 2.518 -5.981 1.00 . A A . 50 GLY H 1 1 15 8352 1 1 29 GLY HA2 H 10.447 0.518 -7.372 1.00 . A A . 50 GLY HA2 1 1 15 8353 1 1 29 GLY HA3 H 8.974 -0.304 -6.860 1.00 . A A . 50 GLY HA3 1 1 15 8354 1 1 29 GLY N N 8.983 1.782 -6.568 1.00 . A A . 50 GLY N 1 1 15 8355 1 1 29 GLY O O 10.985 -1.018 -5.247 1.00 . A A . 50 GLY O 1 1 15 8356 1 1 30 HIS C C 10.418 -0.714 -2.221 1.00 . A A . 51 HIS C 1 1 15 8357 1 1 30 HIS CA C 10.905 0.573 -2.921 1.00 . A A . 51 HIS CA 1 1 15 8358 1 1 30 HIS CB C 10.677 1.787 -2.001 1.00 . A A . 51 HIS CB 1 1 15 8359 1 1 30 HIS CD2 C 9.103 1.529 -0.004 1.00 . A A . 51 HIS CD2 1 1 15 8360 1 1 30 HIS CE1 C 7.153 1.542 -1.015 1.00 . A A . 51 HIS CE1 1 1 15 8361 1 1 30 HIS CG C 9.322 1.785 -1.330 1.00 . A A . 51 HIS CG 1 1 15 8362 1 1 30 HIS H H 9.738 1.696 -4.313 1.00 . A A . 51 HIS H 1 1 15 8363 1 1 30 HIS HA H 11.978 0.472 -3.091 1.00 . A A . 51 HIS HA 1 1 15 8364 1 1 30 HIS HB2 H 11.440 1.767 -1.222 1.00 . A A . 51 HIS HB2 1 1 15 8365 1 1 30 HIS HB3 H 10.813 2.713 -2.562 1.00 . A A . 51 HIS HB3 1 1 15 8366 1 1 30 HIS HD1 H 7.882 1.983 -2.926 1.00 . A A . 51 HIS HD1 1 1 15 8367 1 1 30 HIS HD2 H 9.869 1.385 0.745 1.00 . A A . 51 HIS HD2 1 1 15 8368 1 1 30 HIS HE1 H 6.091 1.460 -1.208 1.00 . A A . 51 HIS HE1 1 1 15 8369 1 1 30 HIS N N 10.257 0.838 -4.217 1.00 . A A . 51 HIS N 1 1 15 8370 1 1 30 HIS ND1 N 8.085 1.803 -1.944 1.00 . A A . 51 HIS ND1 1 1 15 8371 1 1 30 HIS NE2 N 7.725 1.376 0.186 1.00 . A A . 51 HIS NE2 1 1 15 8372 1 1 30 HIS O O 11.148 -1.330 -1.445 1.00 . A A . 51 HIS O 1 1 15 8373 1 1 31 PHE C C 9.171 -3.543 -1.887 1.00 . A A . 52 PHE C 1 1 15 8374 1 1 31 PHE CA C 8.471 -2.183 -1.750 1.00 . A A . 52 PHE CA 1 1 15 8375 1 1 31 PHE CB C 7.002 -2.222 -2.204 1.00 . A A . 52 PHE CB 1 1 15 8376 1 1 31 PHE CD1 C 6.772 -3.243 -4.523 1.00 . A A . 52 PHE CD1 1 1 15 8377 1 1 31 PHE CD2 C 6.537 -0.834 -4.275 1.00 . A A . 52 PHE CD2 1 1 15 8378 1 1 31 PHE CE1 C 6.567 -3.117 -5.909 1.00 . A A . 52 PHE CE1 1 1 15 8379 1 1 31 PHE CE2 C 6.319 -0.711 -5.657 1.00 . A A . 52 PHE CE2 1 1 15 8380 1 1 31 PHE CG C 6.767 -2.100 -3.701 1.00 . A A . 52 PHE CG 1 1 15 8381 1 1 31 PHE CZ C 6.343 -1.850 -6.477 1.00 . A A . 52 PHE CZ 1 1 15 8382 1 1 31 PHE H H 8.634 -0.580 -3.138 1.00 . A A . 52 PHE H 1 1 15 8383 1 1 31 PHE HA H 8.477 -1.939 -0.687 1.00 . A A . 52 PHE HA 1 1 15 8384 1 1 31 PHE HB2 H 6.544 -3.142 -1.848 1.00 . A A . 52 PHE HB2 1 1 15 8385 1 1 31 PHE HB3 H 6.479 -1.400 -1.711 1.00 . A A . 52 PHE HB3 1 1 15 8386 1 1 31 PHE HD1 H 6.941 -4.221 -4.095 1.00 . A A . 52 PHE HD1 1 1 15 8387 1 1 31 PHE HD2 H 6.498 0.048 -3.652 1.00 . A A . 52 PHE HD2 1 1 15 8388 1 1 31 PHE HE1 H 6.584 -3.997 -6.539 1.00 . A A . 52 PHE HE1 1 1 15 8389 1 1 31 PHE HE2 H 6.122 0.262 -6.086 1.00 . A A . 52 PHE HE2 1 1 15 8390 1 1 31 PHE HZ H 6.180 -1.754 -7.543 1.00 . A A . 52 PHE HZ 1 1 15 8391 1 1 31 PHE N N 9.168 -1.116 -2.472 1.00 . A A . 52 PHE N 1 1 15 8392 1 1 31 PHE O O 9.385 -4.220 -0.882 1.00 . A A . 52 PHE O 1 1 15 8393 1 1 32 SER C C 11.732 -5.275 -2.697 1.00 . A A . 53 SER C 1 1 15 8394 1 1 32 SER CA C 10.363 -5.139 -3.393 1.00 . A A . 53 SER CA 1 1 15 8395 1 1 32 SER CB C 10.559 -5.274 -4.909 1.00 . A A . 53 SER CB 1 1 15 8396 1 1 32 SER H H 9.411 -3.292 -3.873 1.00 . A A . 53 SER H 1 1 15 8397 1 1 32 SER HA H 9.753 -5.979 -3.058 1.00 . A A . 53 SER HA 1 1 15 8398 1 1 32 SER HB2 H 11.183 -4.454 -5.269 1.00 . A A . 53 SER HB2 1 1 15 8399 1 1 32 SER HB3 H 11.060 -6.219 -5.126 1.00 . A A . 53 SER HB3 1 1 15 8400 1 1 32 SER HG H 9.465 -5.384 -6.530 1.00 . A A . 53 SER HG 1 1 15 8401 1 1 32 SER N N 9.634 -3.894 -3.092 1.00 . A A . 53 SER N 1 1 15 8402 1 1 32 SER O O 12.357 -6.334 -2.788 1.00 . A A . 53 SER O 1 1 15 8403 1 1 32 SER OG O 9.307 -5.250 -5.576 1.00 . A A . 53 SER OG 1 1 15 8404 1 1 33 LYS C C 13.267 -3.672 0.223 1.00 . A A . 54 LYS C 1 1 15 8405 1 1 33 LYS CA C 13.447 -4.198 -1.212 1.00 . A A . 54 LYS CA 1 1 15 8406 1 1 33 LYS CB C 14.531 -3.433 -1.999 1.00 . A A . 54 LYS CB 1 1 15 8407 1 1 33 LYS CD C 15.351 -1.167 -2.881 1.00 . A A . 54 LYS CD 1 1 15 8408 1 1 33 LYS CE C 15.662 -1.649 -4.304 1.00 . A A . 54 LYS CE 1 1 15 8409 1 1 33 LYS CG C 14.195 -1.950 -2.243 1.00 . A A . 54 LYS CG 1 1 15 8410 1 1 33 LYS H H 11.646 -3.379 -2.021 1.00 . A A . 54 LYS H 1 1 15 8411 1 1 33 LYS HA H 13.803 -5.223 -1.090 1.00 . A A . 54 LYS HA 1 1 15 8412 1 1 33 LYS HB2 H 15.473 -3.498 -1.453 1.00 . A A . 54 LYS HB2 1 1 15 8413 1 1 33 LYS HB3 H 14.673 -3.932 -2.961 1.00 . A A . 54 LYS HB3 1 1 15 8414 1 1 33 LYS HD2 H 15.072 -0.112 -2.916 1.00 . A A . 54 LYS HD2 1 1 15 8415 1 1 33 LYS HD3 H 16.240 -1.266 -2.254 1.00 . A A . 54 LYS HD3 1 1 15 8416 1 1 33 LYS HE2 H 15.928 -2.709 -4.271 1.00 . A A . 54 LYS HE2 1 1 15 8417 1 1 33 LYS HE3 H 14.758 -1.550 -4.914 1.00 . A A . 54 LYS HE3 1 1 15 8418 1 1 33 LYS HG2 H 13.324 -1.877 -2.895 1.00 . A A . 54 LYS HG2 1 1 15 8419 1 1 33 LYS HG3 H 13.956 -1.476 -1.291 1.00 . A A . 54 LYS HG3 1 1 15 8420 1 1 33 LYS HZ1 H 16.548 0.113 -4.967 1.00 . A A . 54 LYS HZ1 1 1 15 8421 1 1 33 LYS HZ2 H 17.624 -0.965 -4.376 1.00 . A A . 54 LYS HZ2 1 1 15 8422 1 1 33 LYS HZ3 H 16.968 -1.192 -5.852 1.00 . A A . 54 LYS HZ3 1 1 15 8423 1 1 33 LYS N N 12.197 -4.229 -1.996 1.00 . A A . 54 LYS N 1 1 15 8424 1 1 33 LYS NZ N 16.772 -0.871 -4.914 1.00 . A A . 54 LYS NZ 1 1 15 8425 1 1 33 LYS O O 14.254 -3.494 0.938 1.00 . A A . 54 LYS O 1 1 15 8426 1 1 34 GLN C C 10.327 -3.562 2.463 1.00 . A A . 55 GLN C 1 1 15 8427 1 1 34 GLN CA C 11.683 -2.983 2.010 1.00 . A A . 55 GLN CA 1 1 15 8428 1 1 34 GLN CB C 11.744 -1.438 2.048 1.00 . A A . 55 GLN CB 1 1 15 8429 1 1 34 GLN CD C 11.607 0.655 3.473 1.00 . A A . 55 GLN CD 1 1 15 8430 1 1 34 GLN CG C 11.610 -0.873 3.471 1.00 . A A . 55 GLN CG 1 1 15 8431 1 1 34 GLN H H 11.262 -3.621 0.017 1.00 . A A . 55 GLN H 1 1 15 8432 1 1 34 GLN HA H 12.432 -3.359 2.707 1.00 . A A . 55 GLN HA 1 1 15 8433 1 1 34 GLN HB2 H 12.703 -1.113 1.646 1.00 . A A . 55 GLN HB2 1 1 15 8434 1 1 34 GLN HB3 H 10.963 -1.018 1.413 1.00 . A A . 55 GLN HB3 1 1 15 8435 1 1 34 GLN HE21 H 9.590 0.746 3.580 1.00 . A A . 55 GLN HE21 1 1 15 8436 1 1 34 GLN HE22 H 10.440 2.287 3.553 1.00 . A A . 55 GLN HE22 1 1 15 8437 1 1 34 GLN HG2 H 10.689 -1.230 3.930 1.00 . A A . 55 GLN HG2 1 1 15 8438 1 1 34 GLN HG3 H 12.446 -1.223 4.077 1.00 . A A . 55 GLN HG3 1 1 15 8439 1 1 34 GLN N N 12.022 -3.442 0.659 1.00 . A A . 55 GLN N 1 1 15 8440 1 1 34 GLN NE2 N 10.451 1.280 3.542 1.00 . A A . 55 GLN NE2 1 1 15 8441 1 1 34 GLN O O 10.291 -4.635 3.066 1.00 . A A . 55 GLN O 1 1 15 8442 1 1 34 GLN OE1 O 12.639 1.311 3.408 1.00 . A A . 55 GLN OE1 1 1 15 8443 1 1 35 CYS C C 7.220 -4.452 2.332 1.00 . A A . 56 CYS C 1 1 15 8444 1 1 35 CYS CA C 7.892 -3.125 2.746 1.00 . A A . 56 CYS CA 1 1 15 8445 1 1 35 CYS CB C 7.006 -1.924 2.386 1.00 . A A . 56 CYS CB 1 1 15 8446 1 1 35 CYS H H 9.319 -2.000 1.682 1.00 . A A . 56 CYS H 1 1 15 8447 1 1 35 CYS HA H 8.004 -3.149 3.832 1.00 . A A . 56 CYS HA 1 1 15 8448 1 1 35 CYS HB2 H 6.867 -1.875 1.303 1.00 . A A . 56 CYS HB2 1 1 15 8449 1 1 35 CYS HB3 H 6.028 -2.046 2.856 1.00 . A A . 56 CYS HB3 1 1 15 8450 1 1 35 CYS N N 9.215 -2.882 2.160 1.00 . A A . 56 CYS N 1 1 15 8451 1 1 35 CYS O O 6.284 -4.902 2.997 1.00 . A A . 56 CYS O 1 1 15 8452 1 1 35 CYS SG S 7.792 -0.408 2.994 1.00 . A A . 56 CYS SG 1 1 15 8453 1 1 36 ARG C C 8.157 -7.289 0.137 1.00 . A A . 57 ARG C 1 1 15 8454 1 1 36 ARG CA C 7.091 -6.281 0.621 1.00 . A A . 57 ARG CA 1 1 15 8455 1 1 36 ARG CB C 6.142 -5.843 -0.522 1.00 . A A . 57 ARG CB 1 1 15 8456 1 1 36 ARG CD C 3.636 -5.858 0.044 1.00 . A A . 57 ARG CD 1 1 15 8457 1 1 36 ARG CG C 4.821 -6.635 -0.555 1.00 . A A . 57 ARG CG 1 1 15 8458 1 1 36 ARG CZ C 3.149 -4.533 2.109 1.00 . A A . 57 ARG CZ 1 1 15 8459 1 1 36 ARG H H 8.415 -4.605 0.724 1.00 . A A . 57 ARG H 1 1 15 8460 1 1 36 ARG HA H 6.522 -6.813 1.384 1.00 . A A . 57 ARG HA 1 1 15 8461 1 1 36 ARG HB2 H 5.904 -4.783 -0.426 1.00 . A A . 57 ARG HB2 1 1 15 8462 1 1 36 ARG HB3 H 6.655 -5.958 -1.480 1.00 . A A . 57 ARG HB3 1 1 15 8463 1 1 36 ARG HD2 H 3.414 -5.016 -0.615 1.00 . A A . 57 ARG HD2 1 1 15 8464 1 1 36 ARG HD3 H 2.763 -6.512 0.067 1.00 . A A . 57 ARG HD3 1 1 15 8465 1 1 36 ARG HE H 4.815 -5.543 1.806 1.00 . A A . 57 ARG HE 1 1 15 8466 1 1 36 ARG HG2 H 4.578 -6.855 -1.595 1.00 . A A . 57 ARG HG2 1 1 15 8467 1 1 36 ARG HG3 H 4.936 -7.588 -0.037 1.00 . A A . 57 ARG HG3 1 1 15 8468 1 1 36 ARG HH11 H 1.644 -4.471 0.806 1.00 . A A . 57 ARG HH11 1 1 15 8469 1 1 36 ARG HH12 H 1.499 -3.392 2.169 1.00 . A A . 57 ARG HH12 1 1 15 8470 1 1 36 ARG HH21 H 4.517 -4.314 3.538 1.00 . A A . 57 ARG HH21 1 1 15 8471 1 1 36 ARG HH22 H 2.990 -3.489 3.815 1.00 . A A . 57 ARG HH22 1 1 15 8472 1 1 36 ARG N N 7.672 -5.072 1.234 1.00 . A A . 57 ARG N 1 1 15 8473 1 1 36 ARG NE N 3.910 -5.346 1.403 1.00 . A A . 57 ARG NE 1 1 15 8474 1 1 36 ARG NH1 N 1.968 -4.165 1.715 1.00 . A A . 57 ARG NH1 1 1 15 8475 1 1 36 ARG NH2 N 3.582 -4.061 3.239 1.00 . A A . 57 ARG NH2 1 1 15 8476 1 1 36 ARG O O 7.838 -8.203 -0.626 1.00 . A A . 57 ARG O 1 1 15 8477 1 1 37 SER C C 10.355 -9.433 0.630 1.00 . A A . 58 SER C 1 1 15 8478 1 1 37 SER CA C 10.585 -7.955 0.272 1.00 . A A . 58 SER CA 1 1 15 8479 1 1 37 SER CB C 11.804 -7.391 1.006 1.00 . A A . 58 SER CB 1 1 15 8480 1 1 37 SER H H 9.548 -6.340 1.213 1.00 . A A . 58 SER H 1 1 15 8481 1 1 37 SER HA H 10.785 -7.907 -0.798 1.00 . A A . 58 SER HA 1 1 15 8482 1 1 37 SER HB2 H 11.875 -6.317 0.817 1.00 . A A . 58 SER HB2 1 1 15 8483 1 1 37 SER HB3 H 11.691 -7.550 2.082 1.00 . A A . 58 SER HB3 1 1 15 8484 1 1 37 SER HG H 13.748 -7.723 1.059 1.00 . A A . 58 SER HG 1 1 15 8485 1 1 37 SER N N 9.413 -7.104 0.568 1.00 . A A . 58 SER N 1 1 15 8486 1 1 37 SER O O 9.978 -9.722 1.791 1.00 . A A . 58 SER O 1 1 15 8487 1 1 37 SER OXT O 10.529 -10.303 -0.256 1.00 . A A . 58 SER OXT 1 1 15 8488 1 1 37 SER OG O 12.980 -8.028 0.533 1.00 . A A . 58 SER OG 1 1 15 8489 2 2 1 ZN ZN ZN -8.470 0.399 3.479 1.00 . B A . 1059 ZN ZN 1 1 15 8490 3 2 1 ZN ZN ZN 6.822 1.245 2.030 1.00 . C A . 1060 ZN ZN 1 1 16 8491 1 1 1 GLN C C -6.454 -1.391 -4.511 1.00 . A A . 22 GLN C 1 1 16 8492 1 1 1 GLN CA C -6.328 -0.974 -5.976 1.00 . A A . 22 GLN CA 1 1 16 8493 1 1 1 GLN CB C -4.917 -0.431 -6.294 1.00 . A A . 22 GLN CB 1 1 16 8494 1 1 1 GLN CD C -3.858 -2.679 -6.926 1.00 . A A . 22 GLN CD 1 1 16 8495 1 1 1 GLN CG C -3.765 -1.429 -6.057 1.00 . A A . 22 GLN CG 1 1 16 8496 1 1 1 GLN H1 H -8.297 -0.374 -6.138 1.00 . A A . 22 GLN H1 1 1 16 8497 1 1 1 GLN H2 H -7.285 0.840 -5.718 1.00 . A A . 22 GLN H2 1 1 16 8498 1 1 1 GLN H3 H -7.318 0.301 -7.274 1.00 . A A . 22 GLN H3 1 1 16 8499 1 1 1 GLN HA H -6.502 -1.859 -6.588 1.00 . A A . 22 GLN HA 1 1 16 8500 1 1 1 GLN HB2 H -4.885 -0.124 -7.339 1.00 . A A . 22 GLN HB2 1 1 16 8501 1 1 1 GLN HB3 H -4.731 0.454 -5.682 1.00 . A A . 22 GLN HB3 1 1 16 8502 1 1 1 GLN HE21 H -2.089 -2.340 -7.852 1.00 . A A . 22 GLN HE21 1 1 16 8503 1 1 1 GLN HE22 H -2.971 -3.784 -8.337 1.00 . A A . 22 GLN HE22 1 1 16 8504 1 1 1 GLN HG2 H -2.824 -0.917 -6.259 1.00 . A A . 22 GLN HG2 1 1 16 8505 1 1 1 GLN HG3 H -3.748 -1.738 -5.012 1.00 . A A . 22 GLN HG3 1 1 16 8506 1 1 1 GLN N N -7.380 0.020 -6.307 1.00 . A A . 22 GLN N 1 1 16 8507 1 1 1 GLN NE2 N -2.890 -2.949 -7.773 1.00 . A A . 22 GLN NE2 1 1 16 8508 1 1 1 GLN O O -6.589 -0.531 -3.644 1.00 . A A . 22 GLN O 1 1 16 8509 1 1 1 GLN OE1 O -4.812 -3.441 -6.856 1.00 . A A . 22 GLN OE1 1 1 16 8510 1 1 2 THR C C -5.914 -2.667 -1.752 1.00 . A A . 23 THR C 1 1 16 8511 1 1 2 THR CA C -6.727 -3.283 -2.899 1.00 . A A . 23 THR CA 1 1 16 8512 1 1 2 THR CB C -6.512 -4.806 -2.941 1.00 . A A . 23 THR CB 1 1 16 8513 1 1 2 THR CG2 C -7.074 -5.528 -1.716 1.00 . A A . 23 THR CG2 1 1 16 8514 1 1 2 THR H H -6.309 -3.358 -4.983 1.00 . A A . 23 THR H 1 1 16 8515 1 1 2 THR HA H -7.777 -3.109 -2.687 1.00 . A A . 23 THR HA 1 1 16 8516 1 1 2 THR HB H -5.447 -5.020 -3.034 1.00 . A A . 23 THR HB 1 1 16 8517 1 1 2 THR HG1 H -6.949 -6.276 -4.139 1.00 . A A . 23 THR HG1 1 1 16 8518 1 1 2 THR HG21 H -8.143 -5.332 -1.629 1.00 . A A . 23 THR HG21 1 1 16 8519 1 1 2 THR HG22 H -6.917 -6.602 -1.820 1.00 . A A . 23 THR HG22 1 1 16 8520 1 1 2 THR HG23 H -6.564 -5.196 -0.814 1.00 . A A . 23 THR HG23 1 1 16 8521 1 1 2 THR N N -6.440 -2.696 -4.226 1.00 . A A . 23 THR N 1 1 16 8522 1 1 2 THR O O -4.697 -2.502 -1.864 1.00 . A A . 23 THR O 1 1 16 8523 1 1 2 THR OG1 O -7.189 -5.337 -4.063 1.00 . A A . 23 THR OG1 1 1 16 8524 1 1 3 CYS C C -4.864 -2.622 1.179 1.00 . A A . 24 CYS C 1 1 16 8525 1 1 3 CYS CA C -6.023 -1.795 0.589 1.00 . A A . 24 CYS CA 1 1 16 8526 1 1 3 CYS CB C -7.159 -1.720 1.613 1.00 . A A . 24 CYS CB 1 1 16 8527 1 1 3 CYS H H -7.595 -2.475 -0.664 1.00 . A A . 24 CYS H 1 1 16 8528 1 1 3 CYS HA H -5.670 -0.785 0.377 1.00 . A A . 24 CYS HA 1 1 16 8529 1 1 3 CYS HB2 H -8.046 -1.295 1.149 1.00 . A A . 24 CYS HB2 1 1 16 8530 1 1 3 CYS HB3 H -7.403 -2.729 1.947 1.00 . A A . 24 CYS HB3 1 1 16 8531 1 1 3 CYS N N -6.593 -2.355 -0.641 1.00 . A A . 24 CYS N 1 1 16 8532 1 1 3 CYS O O -4.861 -3.853 1.091 1.00 . A A . 24 CYS O 1 1 16 8533 1 1 3 CYS SG S -6.650 -0.701 3.022 1.00 . A A . 24 CYS SG 1 1 16 8534 1 1 4 TYR C C -3.565 -3.436 3.905 1.00 . A A . 25 TYR C 1 1 16 8535 1 1 4 TYR CA C -2.954 -2.622 2.743 1.00 . A A . 25 TYR CA 1 1 16 8536 1 1 4 TYR CB C -1.910 -1.613 3.251 1.00 . A A . 25 TYR CB 1 1 16 8537 1 1 4 TYR CD1 C -3.327 0.006 4.618 1.00 . A A . 25 TYR CD1 1 1 16 8538 1 1 4 TYR CD2 C -1.519 -1.207 5.718 1.00 . A A . 25 TYR CD2 1 1 16 8539 1 1 4 TYR CE1 C -3.694 0.577 5.853 1.00 . A A . 25 TYR CE1 1 1 16 8540 1 1 4 TYR CE2 C -1.870 -0.622 6.948 1.00 . A A . 25 TYR CE2 1 1 16 8541 1 1 4 TYR CG C -2.254 -0.905 4.553 1.00 . A A . 25 TYR CG 1 1 16 8542 1 1 4 TYR CZ C -2.970 0.257 7.024 1.00 . A A . 25 TYR CZ 1 1 16 8543 1 1 4 TYR H H -4.023 -0.950 1.935 1.00 . A A . 25 TYR H 1 1 16 8544 1 1 4 TYR HA H -2.426 -3.336 2.123 1.00 . A A . 25 TYR HA 1 1 16 8545 1 1 4 TYR HB2 H -0.990 -2.170 3.412 1.00 . A A . 25 TYR HB2 1 1 16 8546 1 1 4 TYR HB3 H -1.700 -0.872 2.479 1.00 . A A . 25 TYR HB3 1 1 16 8547 1 1 4 TYR HD1 H -3.891 0.248 3.728 1.00 . A A . 25 TYR HD1 1 1 16 8548 1 1 4 TYR HD2 H -0.696 -1.910 5.675 1.00 . A A . 25 TYR HD2 1 1 16 8549 1 1 4 TYR HE1 H -4.539 1.248 5.909 1.00 . A A . 25 TYR HE1 1 1 16 8550 1 1 4 TYR HE2 H -1.318 -0.864 7.846 1.00 . A A . 25 TYR HE2 1 1 16 8551 1 1 4 TYR HH H -4.133 1.327 8.168 1.00 . A A . 25 TYR HH 1 1 16 8552 1 1 4 TYR N N -3.943 -1.957 1.886 1.00 . A A . 25 TYR N 1 1 16 8553 1 1 4 TYR O O -2.940 -4.386 4.384 1.00 . A A . 25 TYR O 1 1 16 8554 1 1 4 TYR OH O -3.339 0.771 8.228 1.00 . A A . 25 TYR OH 1 1 16 8555 1 1 5 ASN C C -6.865 -4.098 5.331 1.00 . A A . 26 ASN C 1 1 16 8556 1 1 5 ASN CA C -5.427 -3.592 5.553 1.00 . A A . 26 ASN CA 1 1 16 8557 1 1 5 ASN CB C -5.405 -2.429 6.563 1.00 . A A . 26 ASN CB 1 1 16 8558 1 1 5 ASN CG C -6.218 -2.708 7.817 1.00 . A A . 26 ASN CG 1 1 16 8559 1 1 5 ASN H H -5.232 -2.320 3.852 1.00 . A A . 26 ASN H 1 1 16 8560 1 1 5 ASN HA H -4.853 -4.422 5.970 1.00 . A A . 26 ASN HA 1 1 16 8561 1 1 5 ASN HB2 H -4.374 -2.240 6.860 1.00 . A A . 26 ASN HB2 1 1 16 8562 1 1 5 ASN HB3 H -5.791 -1.525 6.094 1.00 . A A . 26 ASN HB3 1 1 16 8563 1 1 5 ASN HD21 H -7.863 -1.766 7.084 1.00 . A A . 26 ASN HD21 1 1 16 8564 1 1 5 ASN HD22 H -7.994 -2.441 8.702 1.00 . A A . 26 ASN HD22 1 1 16 8565 1 1 5 ASN N N -4.790 -3.098 4.326 1.00 . A A . 26 ASN N 1 1 16 8566 1 1 5 ASN ND2 N -7.453 -2.255 7.872 1.00 . A A . 26 ASN ND2 1 1 16 8567 1 1 5 ASN O O -7.218 -5.179 5.809 1.00 . A A . 26 ASN O 1 1 16 8568 1 1 5 ASN OD1 O -5.757 -3.340 8.757 1.00 . A A . 26 ASN OD1 1 1 16 8569 1 1 6 CYS C C -9.577 -4.671 3.598 1.00 . A A . 27 CYS C 1 1 16 8570 1 1 6 CYS CA C -9.141 -3.524 4.541 1.00 . A A . 27 CYS CA 1 1 16 8571 1 1 6 CYS CB C -9.779 -2.184 4.133 1.00 . A A . 27 CYS CB 1 1 16 8572 1 1 6 CYS H H -7.338 -2.449 4.262 1.00 . A A . 27 CYS H 1 1 16 8573 1 1 6 CYS HA H -9.503 -3.773 5.540 1.00 . A A . 27 CYS HA 1 1 16 8574 1 1 6 CYS HB2 H -9.492 -1.944 3.107 1.00 . A A . 27 CYS HB2 1 1 16 8575 1 1 6 CYS HB3 H -10.866 -2.290 4.164 1.00 . A A . 27 CYS HB3 1 1 16 8576 1 1 6 CYS N N -7.691 -3.327 4.621 1.00 . A A . 27 CYS N 1 1 16 8577 1 1 6 CYS O O -10.755 -5.040 3.586 1.00 . A A . 27 CYS O 1 1 16 8578 1 1 6 CYS SG S -9.271 -0.849 5.262 1.00 . A A . 27 CYS SG 1 1 16 8579 1 1 7 GLY C C -9.981 -5.980 0.785 1.00 . A A . 28 GLY C 1 1 16 8580 1 1 7 GLY CA C -8.923 -6.319 1.847 1.00 . A A . 28 GLY CA 1 1 16 8581 1 1 7 GLY H H -7.702 -4.907 2.894 1.00 . A A . 28 GLY H 1 1 16 8582 1 1 7 GLY HA2 H -9.255 -7.202 2.396 1.00 . A A . 28 GLY HA2 1 1 16 8583 1 1 7 GLY HA3 H -7.997 -6.567 1.328 1.00 . A A . 28 GLY HA3 1 1 16 8584 1 1 7 GLY N N -8.655 -5.230 2.800 1.00 . A A . 28 GLY N 1 1 16 8585 1 1 7 GLY O O -10.752 -6.851 0.374 1.00 . A A . 28 GLY O 1 1 16 8586 1 1 8 LYS C C -10.584 -3.437 -1.694 1.00 . A A . 29 LYS C 1 1 16 8587 1 1 8 LYS CA C -11.138 -4.112 -0.421 1.00 . A A . 29 LYS CA 1 1 16 8588 1 1 8 LYS CB C -11.883 -3.129 0.504 1.00 . A A . 29 LYS CB 1 1 16 8589 1 1 8 LYS CD C -14.305 -3.474 -0.361 1.00 . A A . 29 LYS CD 1 1 16 8590 1 1 8 LYS CE C -14.779 -4.165 0.928 1.00 . A A . 29 LYS CE 1 1 16 8591 1 1 8 LYS CG C -13.148 -2.493 -0.100 1.00 . A A . 29 LYS CG 1 1 16 8592 1 1 8 LYS H H -9.357 -4.075 0.754 1.00 . A A . 29 LYS H 1 1 16 8593 1 1 8 LYS HA H -11.841 -4.895 -0.696 1.00 . A A . 29 LYS HA 1 1 16 8594 1 1 8 LYS HB2 H -12.151 -3.643 1.428 1.00 . A A . 29 LYS HB2 1 1 16 8595 1 1 8 LYS HB3 H -11.198 -2.333 0.787 1.00 . A A . 29 LYS HB3 1 1 16 8596 1 1 8 LYS HD2 H -15.136 -2.910 -0.790 1.00 . A A . 29 LYS HD2 1 1 16 8597 1 1 8 LYS HD3 H -13.996 -4.225 -1.090 1.00 . A A . 29 LYS HD3 1 1 16 8598 1 1 8 LYS HE2 H -13.957 -4.760 1.336 1.00 . A A . 29 LYS HE2 1 1 16 8599 1 1 8 LYS HE3 H -15.033 -3.395 1.663 1.00 . A A . 29 LYS HE3 1 1 16 8600 1 1 8 LYS HG2 H -13.503 -1.725 0.590 1.00 . A A . 29 LYS HG2 1 1 16 8601 1 1 8 LYS HG3 H -12.891 -1.996 -1.035 1.00 . A A . 29 LYS HG3 1 1 16 8602 1 1 8 LYS HZ1 H -15.745 -5.768 0.017 1.00 . A A . 29 LYS HZ1 1 1 16 8603 1 1 8 LYS HZ2 H -16.258 -5.485 1.539 1.00 . A A . 29 LYS HZ2 1 1 16 8604 1 1 8 LYS HZ3 H -16.741 -4.507 0.328 1.00 . A A . 29 LYS HZ3 1 1 16 8605 1 1 8 LYS N N -10.044 -4.707 0.368 1.00 . A A . 29 LYS N 1 1 16 8606 1 1 8 LYS NZ N -15.958 -5.038 0.683 1.00 . A A . 29 LYS NZ 1 1 16 8607 1 1 8 LYS O O -9.868 -2.440 -1.557 1.00 . A A . 29 LYS O 1 1 16 8608 1 1 9 PRO C C -10.526 -1.929 -4.449 1.00 . A A . 30 PRO C 1 1 16 8609 1 1 9 PRO CA C -10.351 -3.434 -4.190 1.00 . A A . 30 PRO CA 1 1 16 8610 1 1 9 PRO CB C -11.057 -4.247 -5.279 1.00 . A A . 30 PRO CB 1 1 16 8611 1 1 9 PRO CD C -11.618 -5.181 -3.159 1.00 . A A . 30 PRO CD 1 1 16 8612 1 1 9 PRO CG C -11.316 -5.585 -4.599 1.00 . A A . 30 PRO CG 1 1 16 8613 1 1 9 PRO HA H -9.287 -3.662 -4.238 1.00 . A A . 30 PRO HA 1 1 16 8614 1 1 9 PRO HB2 H -12.012 -3.786 -5.540 1.00 . A A . 30 PRO HB2 1 1 16 8615 1 1 9 PRO HB3 H -10.433 -4.361 -6.168 1.00 . A A . 30 PRO HB3 1 1 16 8616 1 1 9 PRO HD2 H -12.686 -4.990 -3.049 1.00 . A A . 30 PRO HD2 1 1 16 8617 1 1 9 PRO HD3 H -11.308 -5.983 -2.488 1.00 . A A . 30 PRO HD3 1 1 16 8618 1 1 9 PRO HG2 H -12.153 -6.117 -5.054 1.00 . A A . 30 PRO HG2 1 1 16 8619 1 1 9 PRO HG3 H -10.411 -6.194 -4.628 1.00 . A A . 30 PRO HG3 1 1 16 8620 1 1 9 PRO N N -10.874 -3.950 -2.911 1.00 . A A . 30 PRO N 1 1 16 8621 1 1 9 PRO O O -9.659 -1.310 -5.071 1.00 . A A . 30 PRO O 1 1 16 8622 1 1 10 GLY C C -11.179 1.107 -3.345 1.00 . A A . 31 GLY C 1 1 16 8623 1 1 10 GLY CA C -11.985 0.085 -4.162 1.00 . A A . 31 GLY CA 1 1 16 8624 1 1 10 GLY H H -12.281 -1.905 -3.467 1.00 . A A . 31 GLY H 1 1 16 8625 1 1 10 GLY HA2 H -13.040 0.214 -3.919 1.00 . A A . 31 GLY HA2 1 1 16 8626 1 1 10 GLY HA3 H -11.853 0.329 -5.216 1.00 . A A . 31 GLY HA3 1 1 16 8627 1 1 10 GLY N N -11.614 -1.326 -3.955 1.00 . A A . 31 GLY N 1 1 16 8628 1 1 10 GLY O O -11.723 2.134 -2.930 1.00 . A A . 31 GLY O 1 1 16 8629 1 1 11 HIS C C -8.047 2.501 -3.250 1.00 . A A . 32 HIS C 1 1 16 8630 1 1 11 HIS CA C -8.993 1.699 -2.341 1.00 . A A . 32 HIS CA 1 1 16 8631 1 1 11 HIS CB C -8.231 0.885 -1.282 1.00 . A A . 32 HIS CB 1 1 16 8632 1 1 11 HIS CD2 C -8.585 1.381 1.206 1.00 . A A . 32 HIS CD2 1 1 16 8633 1 1 11 HIS CE1 C -10.458 0.288 1.560 1.00 . A A . 32 HIS CE1 1 1 16 8634 1 1 11 HIS CG C -8.967 0.810 0.026 1.00 . A A . 32 HIS CG 1 1 16 8635 1 1 11 HIS H H -9.521 -0.028 -3.468 1.00 . A A . 32 HIS H 1 1 16 8636 1 1 11 HIS HA H -9.584 2.441 -1.806 1.00 . A A . 32 HIS HA 1 1 16 8637 1 1 11 HIS HB2 H -8.061 -0.129 -1.642 1.00 . A A . 32 HIS HB2 1 1 16 8638 1 1 11 HIS HB3 H -7.256 1.338 -1.096 1.00 . A A . 32 HIS HB3 1 1 16 8639 1 1 11 HIS HD1 H -10.634 -0.441 -0.412 1.00 . A A . 32 HIS HD1 1 1 16 8640 1 1 11 HIS HD2 H -7.698 1.980 1.353 1.00 . A A . 32 HIS HD2 1 1 16 8641 1 1 11 HIS HE1 H -11.328 -0.143 2.041 1.00 . A A . 32 HIS HE1 1 1 16 8642 1 1 11 HIS N N -9.903 0.824 -3.079 1.00 . A A . 32 HIS N 1 1 16 8643 1 1 11 HIS ND1 N -10.138 0.129 0.263 1.00 . A A . 32 HIS ND1 1 1 16 8644 1 1 11 HIS NE2 N -9.525 1.030 2.186 1.00 . A A . 32 HIS NE2 1 1 16 8645 1 1 11 HIS O O -7.786 2.160 -4.407 1.00 . A A . 32 HIS O 1 1 16 8646 1 1 12 LEU C C -5.872 5.227 -2.056 1.00 . A A . 33 LEU C 1 1 16 8647 1 1 12 LEU CA C -6.671 4.626 -3.226 1.00 . A A . 33 LEU CA 1 1 16 8648 1 1 12 LEU CB C -7.528 5.743 -3.872 1.00 . A A . 33 LEU CB 1 1 16 8649 1 1 12 LEU CD1 C -9.206 6.543 -5.551 1.00 . A A . 33 LEU CD1 1 1 16 8650 1 1 12 LEU CD2 C -7.416 5.006 -6.307 1.00 . A A . 33 LEU CD2 1 1 16 8651 1 1 12 LEU CG C -8.329 5.364 -5.130 1.00 . A A . 33 LEU CG 1 1 16 8652 1 1 12 LEU H H -7.786 3.732 -1.700 1.00 . A A . 33 LEU H 1 1 16 8653 1 1 12 LEU HA H -5.977 4.197 -3.951 1.00 . A A . 33 LEU HA 1 1 16 8654 1 1 12 LEU HB2 H -8.230 6.106 -3.118 1.00 . A A . 33 LEU HB2 1 1 16 8655 1 1 12 LEU HB3 H -6.876 6.578 -4.133 1.00 . A A . 33 LEU HB3 1 1 16 8656 1 1 12 LEU HD11 H -9.890 6.798 -4.740 1.00 . A A . 33 LEU HD11 1 1 16 8657 1 1 12 LEU HD12 H -8.587 7.410 -5.783 1.00 . A A . 33 LEU HD12 1 1 16 8658 1 1 12 LEU HD13 H -9.793 6.273 -6.428 1.00 . A A . 33 LEU HD13 1 1 16 8659 1 1 12 LEU HD21 H -6.752 5.840 -6.532 1.00 . A A . 33 LEU HD21 1 1 16 8660 1 1 12 LEU HD22 H -6.823 4.125 -6.065 1.00 . A A . 33 LEU HD22 1 1 16 8661 1 1 12 LEU HD23 H -8.023 4.782 -7.184 1.00 . A A . 33 LEU HD23 1 1 16 8662 1 1 12 LEU HG H -8.986 4.522 -4.915 1.00 . A A . 33 LEU HG 1 1 16 8663 1 1 12 LEU N N -7.556 3.597 -2.675 1.00 . A A . 33 LEU N 1 1 16 8664 1 1 12 LEU O O -6.252 5.034 -0.897 1.00 . A A . 33 LEU O 1 1 16 8665 1 1 13 SER C C -4.932 7.804 -0.503 1.00 . A A . 34 SER C 1 1 16 8666 1 1 13 SER CA C -4.088 6.829 -1.353 1.00 . A A . 34 SER CA 1 1 16 8667 1 1 13 SER CB C -2.991 7.625 -2.069 1.00 . A A . 34 SER CB 1 1 16 8668 1 1 13 SER H H -4.564 6.122 -3.309 1.00 . A A . 34 SER H 1 1 16 8669 1 1 13 SER HA H -3.603 6.137 -0.664 1.00 . A A . 34 SER HA 1 1 16 8670 1 1 13 SER HB2 H -3.456 8.353 -2.736 1.00 . A A . 34 SER HB2 1 1 16 8671 1 1 13 SER HB3 H -2.389 8.160 -1.333 1.00 . A A . 34 SER HB3 1 1 16 8672 1 1 13 SER HG H -1.606 7.300 -3.417 1.00 . A A . 34 SER HG 1 1 16 8673 1 1 13 SER N N -4.851 6.039 -2.344 1.00 . A A . 34 SER N 1 1 16 8674 1 1 13 SER O O -4.442 8.351 0.487 1.00 . A A . 34 SER O 1 1 16 8675 1 1 13 SER OG O -2.157 6.758 -2.822 1.00 . A A . 34 SER OG 1 1 16 8676 1 1 14 SER C C -8.240 8.002 0.602 1.00 . A A . 35 SER C 1 1 16 8677 1 1 14 SER CA C -7.197 8.838 -0.165 1.00 . A A . 35 SER CA 1 1 16 8678 1 1 14 SER CB C -7.917 9.738 -1.177 1.00 . A A . 35 SER CB 1 1 16 8679 1 1 14 SER H H -6.501 7.624 -1.754 1.00 . A A . 35 SER H 1 1 16 8680 1 1 14 SER HA H -6.700 9.481 0.560 1.00 . A A . 35 SER HA 1 1 16 8681 1 1 14 SER HB2 H -8.701 10.306 -0.672 1.00 . A A . 35 SER HB2 1 1 16 8682 1 1 14 SER HB3 H -7.198 10.440 -1.601 1.00 . A A . 35 SER HB3 1 1 16 8683 1 1 14 SER HG H -8.937 9.556 -2.842 1.00 . A A . 35 SER HG 1 1 16 8684 1 1 14 SER N N -6.195 8.032 -0.883 1.00 . A A . 35 SER N 1 1 16 8685 1 1 14 SER O O -8.984 8.551 1.418 1.00 . A A . 35 SER O 1 1 16 8686 1 1 14 SER OG O -8.480 8.954 -2.221 1.00 . A A . 35 SER OG 1 1 16 8687 1 1 15 GLN C C -8.533 5.175 2.341 1.00 . A A . 36 GLN C 1 1 16 8688 1 1 15 GLN CA C -9.198 5.748 1.068 1.00 . A A . 36 GLN CA 1 1 16 8689 1 1 15 GLN CB C -9.586 4.628 0.082 1.00 . A A . 36 GLN CB 1 1 16 8690 1 1 15 GLN CD C -12.131 4.621 0.015 1.00 . A A . 36 GLN CD 1 1 16 8691 1 1 15 GLN CG C -10.874 3.880 0.466 1.00 . A A . 36 GLN CG 1 1 16 8692 1 1 15 GLN H H -7.616 6.290 -0.261 1.00 . A A . 36 GLN H 1 1 16 8693 1 1 15 GLN HA H -10.104 6.280 1.363 1.00 . A A . 36 GLN HA 1 1 16 8694 1 1 15 GLN HB2 H -9.724 5.051 -0.915 1.00 . A A . 36 GLN HB2 1 1 16 8695 1 1 15 GLN HB3 H -8.766 3.916 0.025 1.00 . A A . 36 GLN HB3 1 1 16 8696 1 1 15 GLN HE21 H -12.282 3.554 -1.715 1.00 . A A . 36 GLN HE21 1 1 16 8697 1 1 15 GLN HE22 H -13.506 4.789 -1.435 1.00 . A A . 36 GLN HE22 1 1 16 8698 1 1 15 GLN HG2 H -10.871 2.904 -0.015 1.00 . A A . 36 GLN HG2 1 1 16 8699 1 1 15 GLN HG3 H -10.910 3.715 1.543 1.00 . A A . 36 GLN HG3 1 1 16 8700 1 1 15 GLN N N -8.294 6.681 0.380 1.00 . A A . 36 GLN N 1 1 16 8701 1 1 15 GLN NE2 N -12.677 4.295 -1.140 1.00 . A A . 36 GLN NE2 1 1 16 8702 1 1 15 GLN O O -9.144 5.184 3.412 1.00 . A A . 36 GLN O 1 1 16 8703 1 1 15 GLN OE1 O -12.640 5.510 0.685 1.00 . A A . 36 GLN OE1 1 1 16 8704 1 1 16 CYS C C -4.903 5.086 2.818 1.00 . A A . 37 CYS C 1 1 16 8705 1 1 16 CYS CA C -6.272 4.541 3.283 1.00 . A A . 37 CYS CA 1 1 16 8706 1 1 16 CYS CB C -6.165 3.033 3.594 1.00 . A A . 37 CYS CB 1 1 16 8707 1 1 16 CYS H H -6.855 4.859 1.288 1.00 . A A . 37 CYS H 1 1 16 8708 1 1 16 CYS HA H -6.562 5.075 4.189 1.00 . A A . 37 CYS HA 1 1 16 8709 1 1 16 CYS HB2 H -6.052 2.468 2.667 1.00 . A A . 37 CYS HB2 1 1 16 8710 1 1 16 CYS HB3 H -5.265 2.856 4.186 1.00 . A A . 37 CYS HB3 1 1 16 8711 1 1 16 CYS N N -7.255 4.791 2.217 1.00 . A A . 37 CYS N 1 1 16 8712 1 1 16 CYS O O -4.722 5.403 1.641 1.00 . A A . 37 CYS O 1 1 16 8713 1 1 16 CYS SG S -7.584 2.434 4.553 1.00 . A A . 37 CYS SG 1 1 16 8714 1 1 17 ARG C C -1.850 5.044 2.233 1.00 . A A . 38 ARG C 1 1 16 8715 1 1 17 ARG CA C -2.579 5.720 3.405 1.00 . A A . 38 ARG CA 1 1 16 8716 1 1 17 ARG CB C -1.682 5.791 4.661 1.00 . A A . 38 ARG CB 1 1 16 8717 1 1 17 ARG CD C -1.834 3.392 5.637 1.00 . A A . 38 ARG CD 1 1 16 8718 1 1 17 ARG CG C -0.945 4.494 5.045 1.00 . A A . 38 ARG CG 1 1 16 8719 1 1 17 ARG CZ C -1.340 3.383 8.082 1.00 . A A . 38 ARG CZ 1 1 16 8720 1 1 17 ARG H H -4.136 4.936 4.679 1.00 . A A . 38 ARG H 1 1 16 8721 1 1 17 ARG HA H -2.738 6.749 3.076 1.00 . A A . 38 ARG HA 1 1 16 8722 1 1 17 ARG HB2 H -0.916 6.544 4.467 1.00 . A A . 38 ARG HB2 1 1 16 8723 1 1 17 ARG HB3 H -2.266 6.148 5.513 1.00 . A A . 38 ARG HB3 1 1 16 8724 1 1 17 ARG HD2 H -2.757 3.305 5.068 1.00 . A A . 38 ARG HD2 1 1 16 8725 1 1 17 ARG HD3 H -1.325 2.432 5.545 1.00 . A A . 38 ARG HD3 1 1 16 8726 1 1 17 ARG HE H -3.036 4.042 7.279 1.00 . A A . 38 ARG HE 1 1 16 8727 1 1 17 ARG HG2 H -0.432 4.094 4.172 1.00 . A A . 38 ARG HG2 1 1 16 8728 1 1 17 ARG HG3 H -0.170 4.746 5.768 1.00 . A A . 38 ARG HG3 1 1 16 8729 1 1 17 ARG HH11 H 0.186 2.660 6.997 1.00 . A A . 38 ARG HH11 1 1 16 8730 1 1 17 ARG HH12 H 0.427 2.682 8.730 1.00 . A A . 38 ARG HH12 1 1 16 8731 1 1 17 ARG HH21 H -2.642 4.035 9.463 1.00 . A A . 38 ARG HH21 1 1 16 8732 1 1 17 ARG HH22 H -1.130 3.440 10.079 1.00 . A A . 38 ARG HH22 1 1 16 8733 1 1 17 ARG N N -3.916 5.172 3.721 1.00 . A A . 38 ARG N 1 1 16 8734 1 1 17 ARG NE N -2.135 3.647 7.059 1.00 . A A . 38 ARG NE 1 1 16 8735 1 1 17 ARG NH1 N -0.151 2.870 7.931 1.00 . A A . 38 ARG NH1 1 1 16 8736 1 1 17 ARG NH2 N -1.728 3.650 9.297 1.00 . A A . 38 ARG NH2 1 1 16 8737 1 1 17 ARG O O -1.017 5.695 1.604 1.00 . A A . 38 ARG O 1 1 16 8738 1 1 18 ALA C C -2.304 1.752 0.464 1.00 . A A . 39 ALA C 1 1 16 8739 1 1 18 ALA CA C -1.477 2.993 0.888 1.00 . A A . 39 ALA CA 1 1 16 8740 1 1 18 ALA CB C -0.092 2.542 1.385 1.00 . A A . 39 ALA CB 1 1 16 8741 1 1 18 ALA H H -2.828 3.302 2.503 1.00 . A A . 39 ALA H 1 1 16 8742 1 1 18 ALA HA H -1.353 3.646 0.024 1.00 . A A . 39 ALA HA 1 1 16 8743 1 1 18 ALA HB1 H 0.527 3.407 1.621 1.00 . A A . 39 ALA HB1 1 1 16 8744 1 1 18 ALA HB2 H -0.203 1.921 2.275 1.00 . A A . 39 ALA HB2 1 1 16 8745 1 1 18 ALA HB3 H 0.407 1.956 0.611 1.00 . A A . 39 ALA HB3 1 1 16 8746 1 1 18 ALA N N -2.118 3.764 1.956 1.00 . A A . 39 ALA N 1 1 16 8747 1 1 18 ALA O O -3.021 1.178 1.291 1.00 . A A . 39 ALA O 1 1 16 8748 1 1 19 PRO C C -1.632 -1.145 -0.738 1.00 . A A . 40 PRO C 1 1 16 8749 1 1 19 PRO CA C -2.600 -0.044 -1.223 1.00 . A A . 40 PRO CA 1 1 16 8750 1 1 19 PRO CB C -2.629 0.038 -2.753 1.00 . A A . 40 PRO CB 1 1 16 8751 1 1 19 PRO CD C -1.507 1.978 -1.901 1.00 . A A . 40 PRO CD 1 1 16 8752 1 1 19 PRO CG C -1.480 0.993 -3.071 1.00 . A A . 40 PRO CG 1 1 16 8753 1 1 19 PRO HA H -3.602 -0.261 -0.851 1.00 . A A . 40 PRO HA 1 1 16 8754 1 1 19 PRO HB2 H -2.486 -0.933 -3.226 1.00 . A A . 40 PRO HB2 1 1 16 8755 1 1 19 PRO HB3 H -3.573 0.482 -3.074 1.00 . A A . 40 PRO HB3 1 1 16 8756 1 1 19 PRO HD2 H -0.488 2.270 -1.643 1.00 . A A . 40 PRO HD2 1 1 16 8757 1 1 19 PRO HD3 H -2.091 2.856 -2.177 1.00 . A A . 40 PRO HD3 1 1 16 8758 1 1 19 PRO HG2 H -0.536 0.447 -3.067 1.00 . A A . 40 PRO HG2 1 1 16 8759 1 1 19 PRO HG3 H -1.626 1.497 -4.026 1.00 . A A . 40 PRO HG3 1 1 16 8760 1 1 19 PRO N N -2.164 1.286 -0.795 1.00 . A A . 40 PRO N 1 1 16 8761 1 1 19 PRO O O -0.543 -0.856 -0.235 1.00 . A A . 40 PRO O 1 1 16 8762 1 1 20 LYS C C 0.197 -3.735 -0.991 1.00 . A A . 41 LYS C 1 1 16 8763 1 1 20 LYS CA C -1.253 -3.622 -0.503 1.00 . A A . 41 LYS CA 1 1 16 8764 1 1 20 LYS CB C -2.081 -4.879 -0.856 1.00 . A A . 41 LYS CB 1 1 16 8765 1 1 20 LYS CD C -1.864 -5.976 1.455 1.00 . A A . 41 LYS CD 1 1 16 8766 1 1 20 LYS CE C -1.788 -7.305 2.213 1.00 . A A . 41 LYS CE 1 1 16 8767 1 1 20 LYS CG C -1.738 -6.160 -0.067 1.00 . A A . 41 LYS CG 1 1 16 8768 1 1 20 LYS H H -2.909 -2.565 -1.370 1.00 . A A . 41 LYS H 1 1 16 8769 1 1 20 LYS HA H -1.158 -3.544 0.574 1.00 . A A . 41 LYS HA 1 1 16 8770 1 1 20 LYS HB2 H -3.136 -4.667 -0.682 1.00 . A A . 41 LYS HB2 1 1 16 8771 1 1 20 LYS HB3 H -1.972 -5.087 -1.921 1.00 . A A . 41 LYS HB3 1 1 16 8772 1 1 20 LYS HD2 H -1.060 -5.329 1.806 1.00 . A A . 41 LYS HD2 1 1 16 8773 1 1 20 LYS HD3 H -2.826 -5.516 1.674 1.00 . A A . 41 LYS HD3 1 1 16 8774 1 1 20 LYS HE2 H -2.649 -7.918 1.925 1.00 . A A . 41 LYS HE2 1 1 16 8775 1 1 20 LYS HE3 H -0.880 -7.839 1.919 1.00 . A A . 41 LYS HE3 1 1 16 8776 1 1 20 LYS HG2 H -2.430 -6.942 -0.383 1.00 . A A . 41 LYS HG2 1 1 16 8777 1 1 20 LYS HG3 H -0.729 -6.489 -0.311 1.00 . A A . 41 LYS HG3 1 1 16 8778 1 1 20 LYS HZ1 H -2.546 -6.452 3.960 1.00 . A A . 41 LYS HZ1 1 1 16 8779 1 1 20 LYS HZ2 H -1.898 -7.942 4.191 1.00 . A A . 41 LYS HZ2 1 1 16 8780 1 1 20 LYS HZ3 H -0.931 -6.642 3.987 1.00 . A A . 41 LYS HZ3 1 1 16 8781 1 1 20 LYS N N -1.996 -2.420 -0.946 1.00 . A A . 41 LYS N 1 1 16 8782 1 1 20 LYS NZ N -1.793 -7.073 3.683 1.00 . A A . 41 LYS NZ 1 1 16 8783 1 1 20 LYS O O 0.973 -4.494 -0.414 1.00 . A A . 41 LYS O 1 1 16 8784 1 1 21 VAL C C 2.913 -2.335 -1.263 1.00 . A A . 42 VAL C 1 1 16 8785 1 1 21 VAL CA C 1.988 -2.741 -2.428 1.00 . A A . 42 VAL CA 1 1 16 8786 1 1 21 VAL CB C 2.030 -1.667 -3.540 1.00 . A A . 42 VAL CB 1 1 16 8787 1 1 21 VAL CG1 C 3.439 -1.442 -4.094 1.00 . A A . 42 VAL CG1 1 1 16 8788 1 1 21 VAL CG2 C 1.130 -2.042 -4.728 1.00 . A A . 42 VAL CG2 1 1 16 8789 1 1 21 VAL H H -0.123 -2.378 -2.418 1.00 . A A . 42 VAL H 1 1 16 8790 1 1 21 VAL HA H 2.369 -3.677 -2.841 1.00 . A A . 42 VAL HA 1 1 16 8791 1 1 21 VAL HB H 1.673 -0.722 -3.127 1.00 . A A . 42 VAL HB 1 1 16 8792 1 1 21 VAL HG11 H 3.854 -2.383 -4.455 1.00 . A A . 42 VAL HG11 1 1 16 8793 1 1 21 VAL HG12 H 3.411 -0.723 -4.915 1.00 . A A . 42 VAL HG12 1 1 16 8794 1 1 21 VAL HG13 H 4.090 -1.034 -3.320 1.00 . A A . 42 VAL HG13 1 1 16 8795 1 1 21 VAL HG21 H 1.434 -3.007 -5.135 1.00 . A A . 42 VAL HG21 1 1 16 8796 1 1 21 VAL HG22 H 0.085 -2.093 -4.423 1.00 . A A . 42 VAL HG22 1 1 16 8797 1 1 21 VAL HG23 H 1.211 -1.284 -5.508 1.00 . A A . 42 VAL HG23 1 1 16 8798 1 1 21 VAL N N 0.590 -2.949 -1.993 1.00 . A A . 42 VAL N 1 1 16 8799 1 1 21 VAL O O 4.085 -2.713 -1.248 1.00 . A A . 42 VAL O 1 1 16 8800 1 1 22 CYS C C 2.223 -0.982 2.116 1.00 . A A . 43 CYS C 1 1 16 8801 1 1 22 CYS CA C 3.105 -1.005 0.843 1.00 . A A . 43 CYS CA 1 1 16 8802 1 1 22 CYS CB C 3.540 0.396 0.364 1.00 . A A . 43 CYS CB 1 1 16 8803 1 1 22 CYS H H 1.391 -1.390 -0.333 1.00 . A A . 43 CYS H 1 1 16 8804 1 1 22 CYS HA H 3.999 -1.591 1.060 1.00 . A A . 43 CYS HA 1 1 16 8805 1 1 22 CYS HB2 H 3.977 0.301 -0.631 1.00 . A A . 43 CYS HB2 1 1 16 8806 1 1 22 CYS HB3 H 2.665 1.045 0.294 1.00 . A A . 43 CYS HB3 1 1 16 8807 1 1 22 CYS N N 2.381 -1.603 -0.280 1.00 . A A . 43 CYS N 1 1 16 8808 1 1 22 CYS O O 1.245 -1.723 2.233 1.00 . A A . 43 CYS O 1 1 16 8809 1 1 22 CYS SG S 4.777 1.125 1.468 1.00 . A A . 43 CYS SG 1 1 16 8810 1 1 23 PHE C C 1.857 1.790 4.532 1.00 . A A . 44 PHE C 1 1 16 8811 1 1 23 PHE CA C 1.806 0.271 4.249 1.00 . A A . 44 PHE CA 1 1 16 8812 1 1 23 PHE CB C 2.300 -0.523 5.469 1.00 . A A . 44 PHE CB 1 1 16 8813 1 1 23 PHE CD1 C 4.841 -0.375 5.476 1.00 . A A . 44 PHE CD1 1 1 16 8814 1 1 23 PHE CD2 C 3.591 0.849 7.169 1.00 . A A . 44 PHE CD2 1 1 16 8815 1 1 23 PHE CE1 C 6.044 0.136 6.000 1.00 . A A . 44 PHE CE1 1 1 16 8816 1 1 23 PHE CE2 C 4.792 1.362 7.690 1.00 . A A . 44 PHE CE2 1 1 16 8817 1 1 23 PHE CG C 3.609 -0.017 6.057 1.00 . A A . 44 PHE CG 1 1 16 8818 1 1 23 PHE CZ C 6.020 1.006 7.104 1.00 . A A . 44 PHE CZ 1 1 16 8819 1 1 23 PHE H H 3.455 0.359 2.894 1.00 . A A . 44 PHE H 1 1 16 8820 1 1 23 PHE HA H 0.759 0.015 4.077 1.00 . A A . 44 PHE HA 1 1 16 8821 1 1 23 PHE HB2 H 1.531 -0.469 6.242 1.00 . A A . 44 PHE HB2 1 1 16 8822 1 1 23 PHE HB3 H 2.406 -1.576 5.201 1.00 . A A . 44 PHE HB3 1 1 16 8823 1 1 23 PHE HD1 H 4.868 -1.038 4.623 1.00 . A A . 44 PHE HD1 1 1 16 8824 1 1 23 PHE HD2 H 2.649 1.132 7.619 1.00 . A A . 44 PHE HD2 1 1 16 8825 1 1 23 PHE HE1 H 6.988 -0.140 5.550 1.00 . A A . 44 PHE HE1 1 1 16 8826 1 1 23 PHE HE2 H 4.773 2.030 8.542 1.00 . A A . 44 PHE HE2 1 1 16 8827 1 1 23 PHE HZ H 6.946 1.400 7.503 1.00 . A A . 44 PHE HZ 1 1 16 8828 1 1 23 PHE N N 2.582 -0.120 3.067 1.00 . A A . 44 PHE N 1 1 16 8829 1 1 23 PHE O O 1.144 2.256 5.426 1.00 . A A . 44 PHE O 1 1 16 8830 1 1 24 LYS C C 3.532 4.709 2.782 1.00 . A A . 45 LYS C 1 1 16 8831 1 1 24 LYS CA C 2.864 4.024 3.986 1.00 . A A . 45 LYS CA 1 1 16 8832 1 1 24 LYS CB C 3.696 4.248 5.274 1.00 . A A . 45 LYS CB 1 1 16 8833 1 1 24 LYS CD C 2.699 6.513 5.971 1.00 . A A . 45 LYS CD 1 1 16 8834 1 1 24 LYS CE C 3.088 7.907 6.478 1.00 . A A . 45 LYS CE 1 1 16 8835 1 1 24 LYS CG C 3.971 5.716 5.642 1.00 . A A . 45 LYS CG 1 1 16 8836 1 1 24 LYS H H 3.227 2.112 3.079 1.00 . A A . 45 LYS H 1 1 16 8837 1 1 24 LYS HA H 1.887 4.487 4.112 1.00 . A A . 45 LYS HA 1 1 16 8838 1 1 24 LYS HB2 H 3.184 3.785 6.117 1.00 . A A . 45 LYS HB2 1 1 16 8839 1 1 24 LYS HB3 H 4.657 3.741 5.170 1.00 . A A . 45 LYS HB3 1 1 16 8840 1 1 24 LYS HD2 H 2.081 6.608 5.076 1.00 . A A . 45 LYS HD2 1 1 16 8841 1 1 24 LYS HD3 H 2.135 5.986 6.744 1.00 . A A . 45 LYS HD3 1 1 16 8842 1 1 24 LYS HE2 H 3.749 7.792 7.342 1.00 . A A . 45 LYS HE2 1 1 16 8843 1 1 24 LYS HE3 H 3.652 8.422 5.694 1.00 . A A . 45 LYS HE3 1 1 16 8844 1 1 24 LYS HG2 H 4.618 5.720 6.521 1.00 . A A . 45 LYS HG2 1 1 16 8845 1 1 24 LYS HG3 H 4.509 6.207 4.832 1.00 . A A . 45 LYS HG3 1 1 16 8846 1 1 24 LYS HZ1 H 1.370 8.262 7.596 1.00 . A A . 45 LYS HZ1 1 1 16 8847 1 1 24 LYS HZ2 H 2.172 9.623 7.201 1.00 . A A . 45 LYS HZ2 1 1 16 8848 1 1 24 LYS HZ3 H 1.280 8.856 6.073 1.00 . A A . 45 LYS HZ3 1 1 16 8849 1 1 24 LYS N N 2.685 2.566 3.804 1.00 . A A . 45 LYS N 1 1 16 8850 1 1 24 LYS NZ N 1.896 8.711 6.860 1.00 . A A . 45 LYS NZ 1 1 16 8851 1 1 24 LYS O O 2.930 5.592 2.165 1.00 . A A . 45 LYS O 1 1 16 8852 1 1 25 CYS C C 5.313 4.852 0.042 1.00 . A A . 46 CYS C 1 1 16 8853 1 1 25 CYS CA C 5.684 4.983 1.535 1.00 . A A . 46 CYS CA 1 1 16 8854 1 1 25 CYS CB C 7.134 4.521 1.813 1.00 . A A . 46 CYS CB 1 1 16 8855 1 1 25 CYS H H 5.183 3.588 3.030 1.00 . A A . 46 CYS H 1 1 16 8856 1 1 25 CYS HA H 5.646 6.050 1.762 1.00 . A A . 46 CYS HA 1 1 16 8857 1 1 25 CYS HB2 H 7.650 4.347 0.866 1.00 . A A . 46 CYS HB2 1 1 16 8858 1 1 25 CYS HB3 H 7.657 5.340 2.312 1.00 . A A . 46 CYS HB3 1 1 16 8859 1 1 25 CYS N N 4.766 4.312 2.463 1.00 . A A . 46 CYS N 1 1 16 8860 1 1 25 CYS O O 5.511 5.809 -0.708 1.00 . A A . 46 CYS O 1 1 16 8861 1 1 25 CYS SG S 7.280 3.035 2.861 1.00 . A A . 46 CYS SG 1 1 16 8862 1 1 26 LYS C C 4.843 3.884 -2.973 1.00 . A A . 47 LYS C 1 1 16 8863 1 1 26 LYS CA C 4.105 3.422 -1.691 1.00 . A A . 47 LYS CA 1 1 16 8864 1 1 26 LYS CB C 2.616 3.836 -1.644 1.00 . A A . 47 LYS CB 1 1 16 8865 1 1 26 LYS CD C 0.924 5.730 -1.392 1.00 . A A . 47 LYS CD 1 1 16 8866 1 1 26 LYS CE C 0.774 7.173 -0.892 1.00 . A A . 47 LYS CE 1 1 16 8867 1 1 26 LYS CG C 2.406 5.344 -1.445 1.00 . A A . 47 LYS CG 1 1 16 8868 1 1 26 LYS H H 4.642 2.994 0.336 1.00 . A A . 47 LYS H 1 1 16 8869 1 1 26 LYS HA H 4.100 2.337 -1.789 1.00 . A A . 47 LYS HA 1 1 16 8870 1 1 26 LYS HB2 H 2.120 3.522 -2.564 1.00 . A A . 47 LYS HB2 1 1 16 8871 1 1 26 LYS HB3 H 2.137 3.307 -0.818 1.00 . A A . 47 LYS HB3 1 1 16 8872 1 1 26 LYS HD2 H 0.502 5.648 -2.395 1.00 . A A . 47 LYS HD2 1 1 16 8873 1 1 26 LYS HD3 H 0.381 5.055 -0.730 1.00 . A A . 47 LYS HD3 1 1 16 8874 1 1 26 LYS HE2 H 1.460 7.815 -1.454 1.00 . A A . 47 LYS HE2 1 1 16 8875 1 1 26 LYS HE3 H -0.246 7.507 -1.101 1.00 . A A . 47 LYS HE3 1 1 16 8876 1 1 26 LYS HG2 H 2.861 5.637 -0.503 1.00 . A A . 47 LYS HG2 1 1 16 8877 1 1 26 LYS HG3 H 2.891 5.896 -2.251 1.00 . A A . 47 LYS HG3 1 1 16 8878 1 1 26 LYS HZ1 H 1.934 6.882 0.829 1.00 . A A . 47 LYS HZ1 1 1 16 8879 1 1 26 LYS HZ2 H 1.012 8.244 0.879 1.00 . A A . 47 LYS HZ2 1 1 16 8880 1 1 26 LYS HZ3 H 0.328 6.766 1.084 1.00 . A A . 47 LYS HZ3 1 1 16 8881 1 1 26 LYS N N 4.733 3.713 -0.375 1.00 . A A . 47 LYS N 1 1 16 8882 1 1 26 LYS NZ N 1.039 7.281 0.569 1.00 . A A . 47 LYS NZ 1 1 16 8883 1 1 26 LYS O O 4.216 4.031 -4.023 1.00 . A A . 47 LYS O 1 1 16 8884 1 1 27 GLN C C 7.074 3.354 -5.143 1.00 . A A . 48 GLN C 1 1 16 8885 1 1 27 GLN CA C 6.980 4.485 -4.085 1.00 . A A . 48 GLN CA 1 1 16 8886 1 1 27 GLN CB C 8.385 4.921 -3.623 1.00 . A A . 48 GLN CB 1 1 16 8887 1 1 27 GLN CD C 7.680 7.335 -3.165 1.00 . A A . 48 GLN CD 1 1 16 8888 1 1 27 GLN CG C 8.398 6.096 -2.631 1.00 . A A . 48 GLN CG 1 1 16 8889 1 1 27 GLN H H 6.619 3.974 -2.030 1.00 . A A . 48 GLN H 1 1 16 8890 1 1 27 GLN HA H 6.488 5.341 -4.543 1.00 . A A . 48 GLN HA 1 1 16 8891 1 1 27 GLN HB2 H 8.883 4.075 -3.154 1.00 . A A . 48 GLN HB2 1 1 16 8892 1 1 27 GLN HB3 H 8.973 5.207 -4.494 1.00 . A A . 48 GLN HB3 1 1 16 8893 1 1 27 GLN HE21 H 6.113 7.091 -1.908 1.00 . A A . 48 GLN HE21 1 1 16 8894 1 1 27 GLN HE22 H 6.043 8.484 -2.995 1.00 . A A . 48 GLN HE22 1 1 16 8895 1 1 27 GLN HG2 H 7.952 5.785 -1.687 1.00 . A A . 48 GLN HG2 1 1 16 8896 1 1 27 GLN HG3 H 9.434 6.365 -2.421 1.00 . A A . 48 GLN HG3 1 1 16 8897 1 1 27 GLN N N 6.163 4.092 -2.922 1.00 . A A . 48 GLN N 1 1 16 8898 1 1 27 GLN NE2 N 6.518 7.667 -2.645 1.00 . A A . 48 GLN NE2 1 1 16 8899 1 1 27 GLN O O 7.021 2.180 -4.757 1.00 . A A . 48 GLN O 1 1 16 8900 1 1 27 GLN OE1 O 8.143 8.016 -4.071 1.00 . A A . 48 GLN OE1 1 1 16 8901 1 1 28 PRO C C 7.818 1.369 -7.548 1.00 . A A . 49 PRO C 1 1 16 8902 1 1 28 PRO CA C 7.096 2.731 -7.579 1.00 . A A . 49 PRO CA 1 1 16 8903 1 1 28 PRO CB C 7.534 3.515 -8.822 1.00 . A A . 49 PRO CB 1 1 16 8904 1 1 28 PRO CD C 7.458 5.018 -6.972 1.00 . A A . 49 PRO CD 1 1 16 8905 1 1 28 PRO CG C 7.174 4.952 -8.470 1.00 . A A . 49 PRO CG 1 1 16 8906 1 1 28 PRO HA H 6.028 2.527 -7.671 1.00 . A A . 49 PRO HA 1 1 16 8907 1 1 28 PRO HB2 H 8.614 3.435 -8.954 1.00 . A A . 49 PRO HB2 1 1 16 8908 1 1 28 PRO HB3 H 7.013 3.178 -9.718 1.00 . A A . 49 PRO HB3 1 1 16 8909 1 1 28 PRO HD2 H 8.496 5.318 -6.814 1.00 . A A . 49 PRO HD2 1 1 16 8910 1 1 28 PRO HD3 H 6.786 5.745 -6.520 1.00 . A A . 49 PRO HD3 1 1 16 8911 1 1 28 PRO HG2 H 7.775 5.669 -9.028 1.00 . A A . 49 PRO HG2 1 1 16 8912 1 1 28 PRO HG3 H 6.110 5.117 -8.650 1.00 . A A . 49 PRO HG3 1 1 16 8913 1 1 28 PRO N N 7.259 3.666 -6.448 1.00 . A A . 49 PRO N 1 1 16 8914 1 1 28 PRO O O 7.367 0.442 -8.225 1.00 . A A . 49 PRO O 1 1 16 8915 1 1 29 GLY C C 10.443 -0.270 -5.399 1.00 . A A . 50 GLY C 1 1 16 8916 1 1 29 GLY CA C 9.689 -0.033 -6.714 1.00 . A A . 50 GLY CA 1 1 16 8917 1 1 29 GLY H H 9.280 2.046 -6.342 1.00 . A A . 50 GLY H 1 1 16 8918 1 1 29 GLY HA2 H 10.419 -0.049 -7.524 1.00 . A A . 50 GLY HA2 1 1 16 8919 1 1 29 GLY HA3 H 9.017 -0.881 -6.850 1.00 . A A . 50 GLY HA3 1 1 16 8920 1 1 29 GLY N N 8.918 1.223 -6.799 1.00 . A A . 50 GLY N 1 1 16 8921 1 1 29 GLY O O 11.199 -1.237 -5.290 1.00 . A A . 50 GLY O 1 1 16 8922 1 1 30 HIS C C 10.615 -0.762 -2.290 1.00 . A A . 51 HIS C 1 1 16 8923 1 1 30 HIS CA C 10.957 0.506 -3.097 1.00 . A A . 51 HIS CA 1 1 16 8924 1 1 30 HIS CB C 10.627 1.760 -2.267 1.00 . A A . 51 HIS CB 1 1 16 8925 1 1 30 HIS CD2 C 9.113 1.544 -0.214 1.00 . A A . 51 HIS CD2 1 1 16 8926 1 1 30 HIS CE1 C 7.148 1.337 -1.173 1.00 . A A . 51 HIS CE1 1 1 16 8927 1 1 30 HIS CG C 9.289 1.695 -1.562 1.00 . A A . 51 HIS CG 1 1 16 8928 1 1 30 HIS H H 9.632 1.366 -4.539 1.00 . A A . 51 HIS H 1 1 16 8929 1 1 30 HIS HA H 12.031 0.499 -3.287 1.00 . A A . 51 HIS HA 1 1 16 8930 1 1 30 HIS HB2 H 11.402 1.871 -1.506 1.00 . A A . 51 HIS HB2 1 1 16 8931 1 1 30 HIS HB3 H 10.673 2.647 -2.900 1.00 . A A . 51 HIS HB3 1 1 16 8932 1 1 30 HIS HD1 H 7.807 1.657 -3.133 1.00 . A A . 51 HIS HD1 1 1 16 8933 1 1 30 HIS HD2 H 9.901 1.528 0.527 1.00 . A A . 51 HIS HD2 1 1 16 8934 1 1 30 HIS HE1 H 6.089 1.175 -1.332 1.00 . A A . 51 HIS HE1 1 1 16 8935 1 1 30 HIS N N 10.261 0.593 -4.391 1.00 . A A . 51 HIS N 1 1 16 8936 1 1 30 HIS ND1 N 8.041 1.574 -2.145 1.00 . A A . 51 HIS ND1 1 1 16 8937 1 1 30 HIS NE2 N 7.752 1.321 0.025 1.00 . A A . 51 HIS NE2 1 1 16 8938 1 1 30 HIS O O 11.439 -1.259 -1.519 1.00 . A A . 51 HIS O 1 1 16 8939 1 1 31 PHE C C 9.604 -3.608 -1.581 1.00 . A A . 52 PHE C 1 1 16 8940 1 1 31 PHE CA C 8.802 -2.303 -1.582 1.00 . A A . 52 PHE CA 1 1 16 8941 1 1 31 PHE CB C 7.325 -2.514 -1.957 1.00 . A A . 52 PHE CB 1 1 16 8942 1 1 31 PHE CD1 C 7.060 -4.039 -3.974 1.00 . A A . 52 PHE CD1 1 1 16 8943 1 1 31 PHE CD2 C 6.779 -1.640 -4.276 1.00 . A A . 52 PHE CD2 1 1 16 8944 1 1 31 PHE CE1 C 6.818 -4.237 -5.345 1.00 . A A . 52 PHE CE1 1 1 16 8945 1 1 31 PHE CE2 C 6.533 -1.840 -5.646 1.00 . A A . 52 PHE CE2 1 1 16 8946 1 1 31 PHE CG C 7.049 -2.738 -3.435 1.00 . A A . 52 PHE CG 1 1 16 8947 1 1 31 PHE CZ C 6.557 -3.138 -6.182 1.00 . A A . 52 PHE CZ 1 1 16 8948 1 1 31 PHE H H 8.786 -0.835 -3.119 1.00 . A A . 52 PHE H 1 1 16 8949 1 1 31 PHE HA H 8.820 -1.926 -0.559 1.00 . A A . 52 PHE HA 1 1 16 8950 1 1 31 PHE HB2 H 6.934 -3.360 -1.389 1.00 . A A . 52 PHE HB2 1 1 16 8951 1 1 31 PHE HB3 H 6.766 -1.635 -1.636 1.00 . A A . 52 PHE HB3 1 1 16 8952 1 1 31 PHE HD1 H 7.261 -4.889 -3.338 1.00 . A A . 52 PHE HD1 1 1 16 8953 1 1 31 PHE HD2 H 6.739 -0.638 -3.872 1.00 . A A . 52 PHE HD2 1 1 16 8954 1 1 31 PHE HE1 H 6.838 -5.237 -5.758 1.00 . A A . 52 PHE HE1 1 1 16 8955 1 1 31 PHE HE2 H 6.312 -0.996 -6.283 1.00 . A A . 52 PHE HE2 1 1 16 8956 1 1 31 PHE HZ H 6.368 -3.291 -7.236 1.00 . A A . 52 PHE HZ 1 1 16 8957 1 1 31 PHE N N 9.392 -1.280 -2.448 1.00 . A A . 52 PHE N 1 1 16 8958 1 1 31 PHE O O 9.897 -4.129 -0.507 1.00 . A A . 52 PHE O 1 1 16 8959 1 1 32 SER C C 12.293 -5.175 -2.126 1.00 . A A . 53 SER C 1 1 16 8960 1 1 32 SER CA C 10.946 -5.260 -2.873 1.00 . A A . 53 SER CA 1 1 16 8961 1 1 32 SER CB C 11.210 -5.542 -4.360 1.00 . A A . 53 SER CB 1 1 16 8962 1 1 32 SER H H 9.795 -3.609 -3.590 1.00 . A A . 53 SER H 1 1 16 8963 1 1 32 SER HA H 10.410 -6.116 -2.464 1.00 . A A . 53 SER HA 1 1 16 8964 1 1 32 SER HB2 H 11.777 -4.717 -4.792 1.00 . A A . 53 SER HB2 1 1 16 8965 1 1 32 SER HB3 H 11.793 -6.461 -4.456 1.00 . A A . 53 SER HB3 1 1 16 8966 1 1 32 SER HG H 10.188 -5.891 -5.997 1.00 . A A . 53 SER HG 1 1 16 8967 1 1 32 SER N N 10.084 -4.071 -2.737 1.00 . A A . 53 SER N 1 1 16 8968 1 1 32 SER O O 13.032 -6.162 -2.085 1.00 . A A . 53 SER O 1 1 16 8969 1 1 32 SER OG O 9.985 -5.692 -5.062 1.00 . A A . 53 SER OG 1 1 16 8970 1 1 33 LYS C C 13.569 -3.126 0.622 1.00 . A A . 54 LYS C 1 1 16 8971 1 1 33 LYS CA C 13.846 -3.724 -0.775 1.00 . A A . 54 LYS CA 1 1 16 8972 1 1 33 LYS CB C 14.773 -2.806 -1.605 1.00 . A A . 54 LYS CB 1 1 16 8973 1 1 33 LYS CD C 14.267 -2.870 -4.154 1.00 . A A . 54 LYS CD 1 1 16 8974 1 1 33 LYS CE C 14.465 -1.392 -4.525 1.00 . A A . 54 LYS CE 1 1 16 8975 1 1 33 LYS CG C 15.160 -3.355 -2.996 1.00 . A A . 54 LYS CG 1 1 16 8976 1 1 33 LYS H H 11.965 -3.245 -1.647 1.00 . A A . 54 LYS H 1 1 16 8977 1 1 33 LYS HA H 14.374 -4.661 -0.590 1.00 . A A . 54 LYS HA 1 1 16 8978 1 1 33 LYS HB2 H 14.315 -1.821 -1.707 1.00 . A A . 54 LYS HB2 1 1 16 8979 1 1 33 LYS HB3 H 15.699 -2.676 -1.043 1.00 . A A . 54 LYS HB3 1 1 16 8980 1 1 33 LYS HD2 H 14.462 -3.486 -5.033 1.00 . A A . 54 LYS HD2 1 1 16 8981 1 1 33 LYS HD3 H 13.219 -3.011 -3.890 1.00 . A A . 54 LYS HD3 1 1 16 8982 1 1 33 LYS HE2 H 13.645 -1.095 -5.185 1.00 . A A . 54 LYS HE2 1 1 16 8983 1 1 33 LYS HE3 H 14.398 -0.781 -3.619 1.00 . A A . 54 LYS HE3 1 1 16 8984 1 1 33 LYS HG2 H 16.190 -3.063 -3.207 1.00 . A A . 54 LYS HG2 1 1 16 8985 1 1 33 LYS HG3 H 15.145 -4.444 -2.964 1.00 . A A . 54 LYS HG3 1 1 16 8986 1 1 33 LYS HZ1 H 15.831 -1.697 -6.066 1.00 . A A . 54 LYS HZ1 1 1 16 8987 1 1 33 LYS HZ2 H 15.861 -0.179 -5.475 1.00 . A A . 54 LYS HZ2 1 1 16 8988 1 1 33 LYS HZ3 H 16.549 -1.391 -4.630 1.00 . A A . 54 LYS HZ3 1 1 16 8989 1 1 33 LYS N N 12.618 -4.014 -1.534 1.00 . A A . 54 LYS N 1 1 16 8990 1 1 33 LYS NZ N 15.761 -1.151 -5.216 1.00 . A A . 54 LYS NZ 1 1 16 8991 1 1 33 LYS O O 14.517 -2.724 1.300 1.00 . A A . 54 LYS O 1 1 16 8992 1 1 34 GLN C C 10.633 -3.161 2.958 1.00 . A A . 55 GLN C 1 1 16 8993 1 1 34 GLN CA C 11.931 -2.543 2.395 1.00 . A A . 55 GLN CA 1 1 16 8994 1 1 34 GLN CB C 11.805 -1.008 2.315 1.00 . A A . 55 GLN CB 1 1 16 8995 1 1 34 GLN CD C 11.377 1.124 3.610 1.00 . A A . 55 GLN CD 1 1 16 8996 1 1 34 GLN CG C 11.692 -0.365 3.706 1.00 . A A . 55 GLN CG 1 1 16 8997 1 1 34 GLN H H 11.584 -3.453 0.477 1.00 . A A . 55 GLN H 1 1 16 8998 1 1 34 GLN HA H 12.731 -2.783 3.096 1.00 . A A . 55 GLN HA 1 1 16 8999 1 1 34 GLN HB2 H 12.686 -0.595 1.822 1.00 . A A . 55 GLN HB2 1 1 16 9000 1 1 34 GLN HB3 H 10.931 -0.745 1.716 1.00 . A A . 55 GLN HB3 1 1 16 9001 1 1 34 GLN HE21 H 9.394 0.769 3.562 1.00 . A A . 55 GLN HE21 1 1 16 9002 1 1 34 GLN HE22 H 9.872 2.458 3.494 1.00 . A A . 55 GLN HE22 1 1 16 9003 1 1 34 GLN HG2 H 10.897 -0.847 4.276 1.00 . A A . 55 GLN HG2 1 1 16 9004 1 1 34 GLN HG3 H 12.629 -0.501 4.246 1.00 . A A . 55 GLN HG3 1 1 16 9005 1 1 34 GLN N N 12.304 -3.054 1.063 1.00 . A A . 55 GLN N 1 1 16 9006 1 1 34 GLN NE2 N 10.114 1.481 3.557 1.00 . A A . 55 GLN NE2 1 1 16 9007 1 1 34 GLN O O 10.645 -3.714 4.060 1.00 . A A . 55 GLN O 1 1 16 9008 1 1 34 GLN OE1 O 12.253 1.981 3.574 1.00 . A A . 55 GLN OE1 1 1 16 9009 1 1 35 CYS C C 7.651 -4.777 2.241 1.00 . A A . 56 CYS C 1 1 16 9010 1 1 35 CYS CA C 8.162 -3.382 2.682 1.00 . A A . 56 CYS CA 1 1 16 9011 1 1 35 CYS CB C 7.228 -2.256 2.199 1.00 . A A . 56 CYS CB 1 1 16 9012 1 1 35 CYS H H 9.598 -2.598 1.330 1.00 . A A . 56 CYS H 1 1 16 9013 1 1 35 CYS HA H 8.153 -3.369 3.773 1.00 . A A . 56 CYS HA 1 1 16 9014 1 1 35 CYS HB2 H 7.162 -2.273 1.109 1.00 . A A . 56 CYS HB2 1 1 16 9015 1 1 35 CYS HB3 H 6.226 -2.433 2.599 1.00 . A A . 56 CYS HB3 1 1 16 9016 1 1 35 CYS N N 9.524 -3.074 2.215 1.00 . A A . 56 CYS N 1 1 16 9017 1 1 35 CYS O O 6.548 -5.194 2.613 1.00 . A A . 56 CYS O 1 1 16 9018 1 1 35 CYS SG S 7.824 -0.636 2.764 1.00 . A A . 56 CYS SG 1 1 16 9019 1 1 36 ARG C C 9.403 -7.640 0.529 1.00 . A A . 57 ARG C 1 1 16 9020 1 1 36 ARG CA C 8.140 -6.795 0.814 1.00 . A A . 57 ARG CA 1 1 16 9021 1 1 36 ARG CB C 7.310 -6.539 -0.468 1.00 . A A . 57 ARG CB 1 1 16 9022 1 1 36 ARG CD C 5.324 -8.003 0.317 1.00 . A A . 57 ARG CD 1 1 16 9023 1 1 36 ARG CG C 6.299 -7.647 -0.820 1.00 . A A . 57 ARG CG 1 1 16 9024 1 1 36 ARG CZ C 3.654 -6.155 0.611 1.00 . A A . 57 ARG CZ 1 1 16 9025 1 1 36 ARG H H 9.268 -5.005 1.089 1.00 . A A . 57 ARG H 1 1 16 9026 1 1 36 ARG HA H 7.559 -7.366 1.536 1.00 . A A . 57 ARG HA 1 1 16 9027 1 1 36 ARG HB2 H 6.745 -5.612 -0.355 1.00 . A A . 57 ARG HB2 1 1 16 9028 1 1 36 ARG HB3 H 7.984 -6.388 -1.312 1.00 . A A . 57 ARG HB3 1 1 16 9029 1 1 36 ARG HD2 H 4.535 -8.647 -0.076 1.00 . A A . 57 ARG HD2 1 1 16 9030 1 1 36 ARG HD3 H 5.856 -8.584 1.072 1.00 . A A . 57 ARG HD3 1 1 16 9031 1 1 36 ARG HE H 5.298 -6.371 1.693 1.00 . A A . 57 ARG HE 1 1 16 9032 1 1 36 ARG HG2 H 5.720 -7.311 -1.681 1.00 . A A . 57 ARG HG2 1 1 16 9033 1 1 36 ARG HG3 H 6.833 -8.551 -1.116 1.00 . A A . 57 ARG HG3 1 1 16 9034 1 1 36 ARG HH11 H 3.094 -7.386 -0.866 1.00 . A A . 57 ARG HH11 1 1 16 9035 1 1 36 ARG HH12 H 2.058 -5.995 -0.571 1.00 . A A . 57 ARG HH12 1 1 16 9036 1 1 36 ARG HH21 H 3.883 -4.704 1.970 1.00 . A A . 57 ARG HH21 1 1 16 9037 1 1 36 ARG HH22 H 2.474 -4.582 0.924 1.00 . A A . 57 ARG HH22 1 1 16 9038 1 1 36 ARG N N 8.443 -5.489 1.429 1.00 . A A . 57 ARG N 1 1 16 9039 1 1 36 ARG NE N 4.748 -6.802 0.957 1.00 . A A . 57 ARG NE 1 1 16 9040 1 1 36 ARG NH1 N 2.875 -6.552 -0.352 1.00 . A A . 57 ARG NH1 1 1 16 9041 1 1 36 ARG NH2 N 3.306 -5.069 1.232 1.00 . A A . 57 ARG NH2 1 1 16 9042 1 1 36 ARG O O 9.364 -8.553 -0.299 1.00 . A A . 57 ARG O 1 1 16 9043 1 1 37 SER C C 11.791 -9.499 1.207 1.00 . A A . 58 SER C 1 1 16 9044 1 1 37 SER CA C 11.841 -7.969 1.085 1.00 . A A . 58 SER CA 1 1 16 9045 1 1 37 SER CB C 12.789 -7.411 2.147 1.00 . A A . 58 SER CB 1 1 16 9046 1 1 37 SER H H 10.457 -6.542 1.839 1.00 . A A . 58 SER H 1 1 16 9047 1 1 37 SER HA H 12.265 -7.737 0.108 1.00 . A A . 58 SER HA 1 1 16 9048 1 1 37 SER HB2 H 12.423 -7.683 3.142 1.00 . A A . 58 SER HB2 1 1 16 9049 1 1 37 SER HB3 H 13.780 -7.853 2.012 1.00 . A A . 58 SER HB3 1 1 16 9050 1 1 37 SER HG H 13.480 -5.665 2.715 1.00 . A A . 58 SER HG 1 1 16 9051 1 1 37 SER N N 10.521 -7.311 1.191 1.00 . A A . 58 SER N 1 1 16 9052 1 1 37 SER O O 12.425 -10.182 0.368 1.00 . A A . 58 SER O 1 1 16 9053 1 1 37 SER OXT O 11.155 -10.013 2.156 1.00 . A A . 58 SER OXT 1 1 16 9054 1 1 37 SER OG O 12.868 -6.000 2.031 1.00 . A A . 58 SER OG 1 1 16 9055 2 2 1 ZN ZN ZN -8.297 0.512 3.848 1.00 . B A . 1059 ZN ZN 1 1 16 9056 3 2 1 ZN ZN ZN 6.905 1.119 1.897 1.00 . C A . 1060 ZN ZN 1 1 17 9057 1 1 1 GLN C C -6.270 -1.449 -4.430 1.00 . A A . 22 GLN C 1 1 17 9058 1 1 1 GLN CA C -6.057 -1.008 -5.877 1.00 . A A . 22 GLN CA 1 1 17 9059 1 1 1 GLN CB C -4.691 -0.295 -6.018 1.00 . A A . 22 GLN CB 1 1 17 9060 1 1 1 GLN CD C -4.685 0.795 -8.362 1.00 . A A . 22 GLN CD 1 1 17 9061 1 1 1 GLN CG C -4.092 -0.267 -7.438 1.00 . A A . 22 GLN CG 1 1 17 9062 1 1 1 GLN H1 H -8.071 -0.673 -6.214 1.00 . A A . 22 GLN H1 1 1 17 9063 1 1 1 GLN H2 H -7.267 0.655 -5.694 1.00 . A A . 22 GLN H2 1 1 17 9064 1 1 1 GLN H3 H -7.085 0.151 -7.249 1.00 . A A . 22 GLN H3 1 1 17 9065 1 1 1 GLN HA H -6.037 -1.906 -6.495 1.00 . A A . 22 GLN HA 1 1 17 9066 1 1 1 GLN HB2 H -4.751 0.721 -5.622 1.00 . A A . 22 GLN HB2 1 1 17 9067 1 1 1 GLN HB3 H -3.974 -0.839 -5.398 1.00 . A A . 22 GLN HB3 1 1 17 9068 1 1 1 GLN HE21 H -2.880 1.498 -8.946 1.00 . A A . 22 GLN HE21 1 1 17 9069 1 1 1 GLN HE22 H -4.295 2.281 -9.638 1.00 . A A . 22 GLN HE22 1 1 17 9070 1 1 1 GLN HG2 H -3.021 -0.075 -7.338 1.00 . A A . 22 GLN HG2 1 1 17 9071 1 1 1 GLN HG3 H -4.199 -1.247 -7.906 1.00 . A A . 22 GLN HG3 1 1 17 9072 1 1 1 GLN N N -7.201 -0.161 -6.294 1.00 . A A . 22 GLN N 1 1 17 9073 1 1 1 GLN NE2 N -3.881 1.589 -9.030 1.00 . A A . 22 GLN NE2 1 1 17 9074 1 1 1 GLN O O -6.412 -0.601 -3.555 1.00 . A A . 22 GLN O 1 1 17 9075 1 1 1 GLN OE1 O -5.893 0.933 -8.499 1.00 . A A . 22 GLN OE1 1 1 17 9076 1 1 2 THR C C -5.930 -2.800 -1.678 1.00 . A A . 23 THR C 1 1 17 9077 1 1 2 THR CA C -6.717 -3.351 -2.875 1.00 . A A . 23 THR CA 1 1 17 9078 1 1 2 THR CB C -6.575 -4.882 -2.927 1.00 . A A . 23 THR CB 1 1 17 9079 1 1 2 THR CG2 C -7.299 -5.586 -1.780 1.00 . A A . 23 THR CG2 1 1 17 9080 1 1 2 THR H H -6.218 -3.417 -4.935 1.00 . A A . 23 THR H 1 1 17 9081 1 1 2 THR HA H -7.765 -3.123 -2.715 1.00 . A A . 23 THR HA 1 1 17 9082 1 1 2 THR HB H -5.518 -5.147 -2.908 1.00 . A A . 23 THR HB 1 1 17 9083 1 1 2 THR HG1 H -7.037 -6.332 -4.147 1.00 . A A . 23 THR HG1 1 1 17 9084 1 1 2 THR HG21 H -8.355 -5.318 -1.791 1.00 . A A . 23 THR HG21 1 1 17 9085 1 1 2 THR HG22 H -7.205 -6.667 -1.892 1.00 . A A . 23 THR HG22 1 1 17 9086 1 1 2 THR HG23 H -6.858 -5.302 -0.825 1.00 . A A . 23 THR HG23 1 1 17 9087 1 1 2 THR N N -6.329 -2.759 -4.172 1.00 . A A . 23 THR N 1 1 17 9088 1 1 2 THR O O -4.705 -2.684 -1.738 1.00 . A A . 23 THR O 1 1 17 9089 1 1 2 THR OG1 O -7.142 -5.364 -4.129 1.00 . A A . 23 THR OG1 1 1 17 9090 1 1 3 CYS C C -4.967 -2.839 1.273 1.00 . A A . 24 CYS C 1 1 17 9091 1 1 3 CYS CA C -6.069 -1.954 0.658 1.00 . A A . 24 CYS CA 1 1 17 9092 1 1 3 CYS CB C -7.220 -1.807 1.656 1.00 . A A . 24 CYS CB 1 1 17 9093 1 1 3 CYS H H -7.639 -2.586 -0.629 1.00 . A A . 24 CYS H 1 1 17 9094 1 1 3 CYS HA H -5.658 -0.964 0.449 1.00 . A A . 24 CYS HA 1 1 17 9095 1 1 3 CYS HB2 H -8.079 -1.358 1.165 1.00 . A A . 24 CYS HB2 1 1 17 9096 1 1 3 CYS HB3 H -7.514 -2.795 2.005 1.00 . A A . 24 CYS HB3 1 1 17 9097 1 1 3 CYS N N -6.633 -2.489 -0.584 1.00 . A A . 24 CYS N 1 1 17 9098 1 1 3 CYS O O -5.062 -4.070 1.249 1.00 . A A . 24 CYS O 1 1 17 9099 1 1 3 CYS SG S -6.694 -0.776 3.050 1.00 . A A . 24 CYS SG 1 1 17 9100 1 1 4 TYR C C -3.630 -3.534 4.061 1.00 . A A . 25 TYR C 1 1 17 9101 1 1 4 TYR CA C -3.013 -2.891 2.798 1.00 . A A . 25 TYR CA 1 1 17 9102 1 1 4 TYR CB C -1.886 -1.916 3.188 1.00 . A A . 25 TYR CB 1 1 17 9103 1 1 4 TYR CD1 C -3.259 -0.164 4.433 1.00 . A A . 25 TYR CD1 1 1 17 9104 1 1 4 TYR CD2 C -1.307 -1.118 5.529 1.00 . A A . 25 TYR CD2 1 1 17 9105 1 1 4 TYR CE1 C -3.525 0.606 5.580 1.00 . A A . 25 TYR CE1 1 1 17 9106 1 1 4 TYR CE2 C -1.558 -0.333 6.671 1.00 . A A . 25 TYR CE2 1 1 17 9107 1 1 4 TYR CG C -2.154 -1.036 4.404 1.00 . A A . 25 TYR CG 1 1 17 9108 1 1 4 TYR CZ C -2.674 0.531 6.700 1.00 . A A . 25 TYR CZ 1 1 17 9109 1 1 4 TYR H H -3.984 -1.200 1.914 1.00 . A A . 25 TYR H 1 1 17 9110 1 1 4 TYR HA H -2.568 -3.702 2.224 1.00 . A A . 25 TYR HA 1 1 17 9111 1 1 4 TYR HB2 H -1.004 -2.522 3.397 1.00 . A A . 25 TYR HB2 1 1 17 9112 1 1 4 TYR HB3 H -1.635 -1.281 2.339 1.00 . A A . 25 TYR HB3 1 1 17 9113 1 1 4 TYR HD1 H -3.924 -0.089 3.586 1.00 . A A . 25 TYR HD1 1 1 17 9114 1 1 4 TYR HD2 H -0.460 -1.793 5.520 1.00 . A A . 25 TYR HD2 1 1 17 9115 1 1 4 TYR HE1 H -4.392 1.242 5.611 1.00 . A A . 25 TYR HE1 1 1 17 9116 1 1 4 TYR HE2 H -0.906 -0.399 7.531 1.00 . A A . 25 TYR HE2 1 1 17 9117 1 1 4 TYR HH H -2.311 1.126 8.518 1.00 . A A . 25 TYR HH 1 1 17 9118 1 1 4 TYR N N -3.982 -2.212 1.924 1.00 . A A . 25 TYR N 1 1 17 9119 1 1 4 TYR O O -2.972 -4.341 4.721 1.00 . A A . 25 TYR O 1 1 17 9120 1 1 4 TYR OH O -2.948 1.284 7.800 1.00 . A A . 25 TYR OH 1 1 17 9121 1 1 5 ASN C C -6.987 -4.061 5.446 1.00 . A A . 26 ASN C 1 1 17 9122 1 1 5 ASN CA C -5.545 -3.556 5.652 1.00 . A A . 26 ASN CA 1 1 17 9123 1 1 5 ASN CB C -5.517 -2.308 6.556 1.00 . A A . 26 ASN CB 1 1 17 9124 1 1 5 ASN CG C -6.304 -2.495 7.844 1.00 . A A . 26 ASN CG 1 1 17 9125 1 1 5 ASN H H -5.340 -2.506 3.807 1.00 . A A . 26 ASN H 1 1 17 9126 1 1 5 ASN HA H -4.996 -4.355 6.152 1.00 . A A . 26 ASN HA 1 1 17 9127 1 1 5 ASN HB2 H -4.484 -2.076 6.816 1.00 . A A . 26 ASN HB2 1 1 17 9128 1 1 5 ASN HB3 H -5.925 -1.450 6.020 1.00 . A A . 26 ASN HB3 1 1 17 9129 1 1 5 ASN HD21 H -7.983 -1.651 7.070 1.00 . A A . 26 ASN HD21 1 1 17 9130 1 1 5 ASN HD22 H -8.068 -2.196 8.738 1.00 . A A . 26 ASN HD22 1 1 17 9131 1 1 5 ASN N N -4.881 -3.190 4.397 1.00 . A A . 26 ASN N 1 1 17 9132 1 1 5 ASN ND2 N -7.547 -2.066 7.886 1.00 . A A . 26 ASN ND2 1 1 17 9133 1 1 5 ASN O O -7.352 -5.119 5.963 1.00 . A A . 26 ASN O 1 1 17 9134 1 1 5 ASN OD1 O -5.813 -3.040 8.824 1.00 . A A . 26 ASN OD1 1 1 17 9135 1 1 6 CYS C C -9.689 -4.625 3.657 1.00 . A A . 27 CYS C 1 1 17 9136 1 1 6 CYS CA C -9.254 -3.498 4.620 1.00 . A A . 27 CYS CA 1 1 17 9137 1 1 6 CYS CB C -9.877 -2.151 4.207 1.00 . A A . 27 CYS CB 1 1 17 9138 1 1 6 CYS H H -7.440 -2.446 4.319 1.00 . A A . 27 CYS H 1 1 17 9139 1 1 6 CYS HA H -9.626 -3.750 5.615 1.00 . A A . 27 CYS HA 1 1 17 9140 1 1 6 CYS HB2 H -9.608 -1.928 3.172 1.00 . A A . 27 CYS HB2 1 1 17 9141 1 1 6 CYS HB3 H -10.966 -2.237 4.262 1.00 . A A . 27 CYS HB3 1 1 17 9142 1 1 6 CYS N N -7.803 -3.311 4.700 1.00 . A A . 27 CYS N 1 1 17 9143 1 1 6 CYS O O -10.819 -5.111 3.740 1.00 . A A . 27 CYS O 1 1 17 9144 1 1 6 CYS SG S -9.324 -0.805 5.300 1.00 . A A . 27 CYS SG 1 1 17 9145 1 1 7 GLY C C -10.101 -5.654 0.596 1.00 . A A . 28 GLY C 1 1 17 9146 1 1 7 GLY CA C -9.099 -6.050 1.699 1.00 . A A . 28 GLY CA 1 1 17 9147 1 1 7 GLY H H -7.897 -4.624 2.742 1.00 . A A . 28 GLY H 1 1 17 9148 1 1 7 GLY HA2 H -9.480 -6.944 2.192 1.00 . A A . 28 GLY HA2 1 1 17 9149 1 1 7 GLY HA3 H -8.160 -6.312 1.212 1.00 . A A . 28 GLY HA3 1 1 17 9150 1 1 7 GLY N N -8.824 -5.027 2.718 1.00 . A A . 28 GLY N 1 1 17 9151 1 1 7 GLY O O -10.466 -6.501 -0.217 1.00 . A A . 28 GLY O 1 1 17 9152 1 1 8 LYS C C -10.696 -3.428 -1.736 1.00 . A A . 29 LYS C 1 1 17 9153 1 1 8 LYS CA C -11.481 -3.860 -0.479 1.00 . A A . 29 LYS CA 1 1 17 9154 1 1 8 LYS CB C -12.266 -2.657 0.089 1.00 . A A . 29 LYS CB 1 1 17 9155 1 1 8 LYS CD C -13.541 -3.811 2.046 1.00 . A A . 29 LYS CD 1 1 17 9156 1 1 8 LYS CE C -13.541 -5.324 1.780 1.00 . A A . 29 LYS CE 1 1 17 9157 1 1 8 LYS CG C -13.615 -2.984 0.754 1.00 . A A . 29 LYS CG 1 1 17 9158 1 1 8 LYS H H -10.210 -3.753 1.249 1.00 . A A . 29 LYS H 1 1 17 9159 1 1 8 LYS HA H -12.203 -4.624 -0.758 1.00 . A A . 29 LYS HA 1 1 17 9160 1 1 8 LYS HB2 H -11.644 -2.118 0.802 1.00 . A A . 29 LYS HB2 1 1 17 9161 1 1 8 LYS HB3 H -12.490 -1.971 -0.731 1.00 . A A . 29 LYS HB3 1 1 17 9162 1 1 8 LYS HD2 H -12.655 -3.521 2.611 1.00 . A A . 29 LYS HD2 1 1 17 9163 1 1 8 LYS HD3 H -14.418 -3.575 2.651 1.00 . A A . 29 LYS HD3 1 1 17 9164 1 1 8 LYS HE2 H -14.479 -5.595 1.288 1.00 . A A . 29 LYS HE2 1 1 17 9165 1 1 8 LYS HE3 H -12.723 -5.568 1.099 1.00 . A A . 29 LYS HE3 1 1 17 9166 1 1 8 LYS HG2 H -14.082 -2.030 1.005 1.00 . A A . 29 LYS HG2 1 1 17 9167 1 1 8 LYS HG3 H -14.267 -3.483 0.035 1.00 . A A . 29 LYS HG3 1 1 17 9168 1 1 8 LYS HZ1 H -14.133 -5.890 3.691 1.00 . A A . 29 LYS HZ1 1 1 17 9169 1 1 8 LYS HZ2 H -13.382 -7.086 2.869 1.00 . A A . 29 LYS HZ2 1 1 17 9170 1 1 8 LYS HZ3 H -12.505 -5.850 3.494 1.00 . A A . 29 LYS HZ3 1 1 17 9171 1 1 8 LYS N N -10.565 -4.395 0.554 1.00 . A A . 29 LYS N 1 1 17 9172 1 1 8 LYS NZ N -13.385 -6.091 3.042 1.00 . A A . 29 LYS NZ 1 1 17 9173 1 1 8 LYS O O -9.836 -2.550 -1.608 1.00 . A A . 29 LYS O 1 1 17 9174 1 1 9 PRO C C -10.403 -2.087 -4.556 1.00 . A A . 30 PRO C 1 1 17 9175 1 1 9 PRO CA C -10.339 -3.583 -4.208 1.00 . A A . 30 PRO CA 1 1 17 9176 1 1 9 PRO CB C -11.036 -4.409 -5.296 1.00 . A A . 30 PRO CB 1 1 17 9177 1 1 9 PRO CD C -11.870 -5.108 -3.176 1.00 . A A . 30 PRO CD 1 1 17 9178 1 1 9 PRO CG C -11.502 -5.656 -4.552 1.00 . A A . 30 PRO CG 1 1 17 9179 1 1 9 PRO HA H -9.294 -3.884 -4.172 1.00 . A A . 30 PRO HA 1 1 17 9180 1 1 9 PRO HB2 H -11.908 -3.877 -5.680 1.00 . A A . 30 PRO HB2 1 1 17 9181 1 1 9 PRO HB3 H -10.355 -4.659 -6.112 1.00 . A A . 30 PRO HB3 1 1 17 9182 1 1 9 PRO HD2 H -12.905 -4.763 -3.182 1.00 . A A . 30 PRO HD2 1 1 17 9183 1 1 9 PRO HD3 H -11.739 -5.893 -2.432 1.00 . A A . 30 PRO HD3 1 1 17 9184 1 1 9 PRO HG2 H -12.355 -6.128 -5.042 1.00 . A A . 30 PRO HG2 1 1 17 9185 1 1 9 PRO HG3 H -10.673 -6.358 -4.458 1.00 . A A . 30 PRO HG3 1 1 17 9186 1 1 9 PRO N N -10.978 -3.978 -2.940 1.00 . A A . 30 PRO N 1 1 17 9187 1 1 9 PRO O O -9.464 -1.553 -5.150 1.00 . A A . 30 PRO O 1 1 17 9188 1 1 10 GLY C C -10.956 1.046 -3.658 1.00 . A A . 31 GLY C 1 1 17 9189 1 1 10 GLY CA C -11.750 0.020 -4.480 1.00 . A A . 31 GLY CA 1 1 17 9190 1 1 10 GLY H H -12.212 -1.906 -3.692 1.00 . A A . 31 GLY H 1 1 17 9191 1 1 10 GLY HA2 H -12.811 0.218 -4.333 1.00 . A A . 31 GLY HA2 1 1 17 9192 1 1 10 GLY HA3 H -11.521 0.193 -5.533 1.00 . A A . 31 GLY HA3 1 1 17 9193 1 1 10 GLY N N -11.479 -1.395 -4.165 1.00 . A A . 31 GLY N 1 1 17 9194 1 1 10 GLY O O -11.377 2.201 -3.530 1.00 . A A . 31 GLY O 1 1 17 9195 1 1 11 HIS C C -7.980 2.312 -3.292 1.00 . A A . 32 HIS C 1 1 17 9196 1 1 11 HIS CA C -8.920 1.537 -2.353 1.00 . A A . 32 HIS CA 1 1 17 9197 1 1 11 HIS CB C -8.165 0.755 -1.270 1.00 . A A . 32 HIS CB 1 1 17 9198 1 1 11 HIS CD2 C -8.499 1.341 1.200 1.00 . A A . 32 HIS CD2 1 1 17 9199 1 1 11 HIS CE1 C -10.436 0.377 1.576 1.00 . A A . 32 HIS CE1 1 1 17 9200 1 1 11 HIS CG C -8.907 0.752 0.037 1.00 . A A . 32 HIS CG 1 1 17 9201 1 1 11 HIS H H -9.540 -0.316 -3.199 1.00 . A A . 32 HIS H 1 1 17 9202 1 1 11 HIS HA H -9.516 2.296 -1.849 1.00 . A A . 32 HIS HA 1 1 17 9203 1 1 11 HIS HB2 H -8.012 -0.274 -1.589 1.00 . A A . 32 HIS HB2 1 1 17 9204 1 1 11 HIS HB3 H -7.181 1.198 -1.104 1.00 . A A . 32 HIS HB3 1 1 17 9205 1 1 11 HIS HD1 H -10.666 -0.375 -0.380 1.00 . A A . 32 HIS HD1 1 1 17 9206 1 1 11 HIS HD2 H -7.582 1.895 1.327 1.00 . A A . 32 HIS HD2 1 1 17 9207 1 1 11 HIS HE1 H -11.338 0.027 2.063 1.00 . A A . 32 HIS HE1 1 1 17 9208 1 1 11 HIS N N -9.835 0.641 -3.057 1.00 . A A . 32 HIS N 1 1 17 9209 1 1 11 HIS ND1 N -10.120 0.157 0.287 1.00 . A A . 32 HIS ND1 1 1 17 9210 1 1 11 HIS NE2 N -9.463 1.080 2.184 1.00 . A A . 32 HIS NE2 1 1 17 9211 1 1 11 HIS O O -7.786 1.975 -4.463 1.00 . A A . 32 HIS O 1 1 17 9212 1 1 12 LEU C C -5.585 4.963 -2.340 1.00 . A A . 33 LEU C 1 1 17 9213 1 1 12 LEU CA C -6.567 4.395 -3.382 1.00 . A A . 33 LEU CA 1 1 17 9214 1 1 12 LEU CB C -7.459 5.540 -3.925 1.00 . A A . 33 LEU CB 1 1 17 9215 1 1 12 LEU CD1 C -9.255 6.396 -5.448 1.00 . A A . 33 LEU CD1 1 1 17 9216 1 1 12 LEU CD2 C -7.564 4.843 -6.374 1.00 . A A . 33 LEU CD2 1 1 17 9217 1 1 12 LEU CG C -8.370 5.193 -5.120 1.00 . A A . 33 LEU CG 1 1 17 9218 1 1 12 LEU H H -7.566 3.524 -1.751 1.00 . A A . 33 LEU H 1 1 17 9219 1 1 12 LEU HA H -5.986 3.946 -4.190 1.00 . A A . 33 LEU HA 1 1 17 9220 1 1 12 LEU HB2 H -8.086 5.901 -3.108 1.00 . A A . 33 LEU HB2 1 1 17 9221 1 1 12 LEU HB3 H -6.824 6.371 -4.231 1.00 . A A . 33 LEU HB3 1 1 17 9222 1 1 12 LEU HD11 H -9.867 6.648 -4.582 1.00 . A A . 33 LEU HD11 1 1 17 9223 1 1 12 LEU HD12 H -8.641 7.255 -5.715 1.00 . A A . 33 LEU HD12 1 1 17 9224 1 1 12 LEU HD13 H -9.915 6.152 -6.281 1.00 . A A . 33 LEU HD13 1 1 17 9225 1 1 12 LEU HD21 H -6.896 5.664 -6.633 1.00 . A A . 33 LEU HD21 1 1 17 9226 1 1 12 LEU HD22 H -6.979 3.940 -6.204 1.00 . A A . 33 LEU HD22 1 1 17 9227 1 1 12 LEU HD23 H -8.243 4.657 -7.206 1.00 . A A . 33 LEU HD23 1 1 17 9228 1 1 12 LEU HG H -9.020 4.359 -4.863 1.00 . A A . 33 LEU HG 1 1 17 9229 1 1 12 LEU N N -7.414 3.387 -2.741 1.00 . A A . 33 LEU N 1 1 17 9230 1 1 12 LEU O O -5.759 4.751 -1.137 1.00 . A A . 33 LEU O 1 1 17 9231 1 1 13 SER C C -4.253 7.427 -0.895 1.00 . A A . 34 SER C 1 1 17 9232 1 1 13 SER CA C -3.640 6.506 -1.976 1.00 . A A . 34 SER CA 1 1 17 9233 1 1 13 SER CB C -2.753 7.320 -2.929 1.00 . A A . 34 SER CB 1 1 17 9234 1 1 13 SER H H -4.559 5.880 -3.802 1.00 . A A . 34 SER H 1 1 17 9235 1 1 13 SER HA H -3.010 5.778 -1.466 1.00 . A A . 34 SER HA 1 1 17 9236 1 1 13 SER HB2 H -2.412 6.673 -3.739 1.00 . A A . 34 SER HB2 1 1 17 9237 1 1 13 SER HB3 H -3.338 8.137 -3.356 1.00 . A A . 34 SER HB3 1 1 17 9238 1 1 13 SER HG H -1.121 8.388 -2.908 1.00 . A A . 34 SER HG 1 1 17 9239 1 1 13 SER N N -4.619 5.765 -2.799 1.00 . A A . 34 SER N 1 1 17 9240 1 1 13 SER O O -3.554 7.842 0.033 1.00 . A A . 34 SER O 1 1 17 9241 1 1 13 SER OG O -1.618 7.842 -2.266 1.00 . A A . 34 SER OG 1 1 17 9242 1 1 14 SER C C -7.484 7.805 0.645 1.00 . A A . 35 SER C 1 1 17 9243 1 1 14 SER CA C -6.337 8.553 -0.062 1.00 . A A . 35 SER CA 1 1 17 9244 1 1 14 SER CB C -6.902 9.755 -0.829 1.00 . A A . 35 SER CB 1 1 17 9245 1 1 14 SER H H -6.034 7.424 -1.829 1.00 . A A . 35 SER H 1 1 17 9246 1 1 14 SER HA H -5.683 8.939 0.721 1.00 . A A . 35 SER HA 1 1 17 9247 1 1 14 SER HB2 H -7.506 10.368 -0.159 1.00 . A A . 35 SER HB2 1 1 17 9248 1 1 14 SER HB3 H -6.074 10.360 -1.203 1.00 . A A . 35 SER HB3 1 1 17 9249 1 1 14 SER HG H -8.044 10.095 -2.389 1.00 . A A . 35 SER HG 1 1 17 9250 1 1 14 SER N N -5.554 7.723 -0.992 1.00 . A A . 35 SER N 1 1 17 9251 1 1 14 SER O O -8.093 8.356 1.566 1.00 . A A . 35 SER O 1 1 17 9252 1 1 14 SER OG O -7.693 9.308 -1.924 1.00 . A A . 35 SER OG 1 1 17 9253 1 1 15 GLN C C -8.285 5.127 2.236 1.00 . A A . 36 GLN C 1 1 17 9254 1 1 15 GLN CA C -8.809 5.720 0.908 1.00 . A A . 36 GLN CA 1 1 17 9255 1 1 15 GLN CB C -9.242 4.610 -0.067 1.00 . A A . 36 GLN CB 1 1 17 9256 1 1 15 GLN CD C -11.764 4.801 -0.353 1.00 . A A . 36 GLN CD 1 1 17 9257 1 1 15 GLN CG C -10.616 4.001 0.262 1.00 . A A . 36 GLN CG 1 1 17 9258 1 1 15 GLN H H -7.205 6.133 -0.454 1.00 . A A . 36 GLN H 1 1 17 9259 1 1 15 GLN HA H -9.677 6.344 1.131 1.00 . A A . 36 GLN HA 1 1 17 9260 1 1 15 GLN HB2 H -9.283 5.010 -1.081 1.00 . A A . 36 GLN HB2 1 1 17 9261 1 1 15 GLN HB3 H -8.489 3.824 -0.052 1.00 . A A . 36 GLN HB3 1 1 17 9262 1 1 15 GLN HE21 H -11.820 3.674 -2.058 1.00 . A A . 36 GLN HE21 1 1 17 9263 1 1 15 GLN HE22 H -12.970 4.995 -1.940 1.00 . A A . 36 GLN HE22 1 1 17 9264 1 1 15 GLN HG2 H -10.665 2.988 -0.132 1.00 . A A . 36 GLN HG2 1 1 17 9265 1 1 15 GLN HG3 H -10.754 3.932 1.341 1.00 . A A . 36 GLN HG3 1 1 17 9266 1 1 15 GLN N N -7.783 6.556 0.257 1.00 . A A . 36 GLN N 1 1 17 9267 1 1 15 GLN NE2 N -12.213 4.459 -1.546 1.00 . A A . 36 GLN NE2 1 1 17 9268 1 1 15 GLN O O -8.993 5.141 3.244 1.00 . A A . 36 GLN O 1 1 17 9269 1 1 15 GLN OE1 O -12.273 5.753 0.222 1.00 . A A . 36 GLN OE1 1 1 17 9270 1 1 16 CYS C C -4.725 4.911 3.105 1.00 . A A . 37 CYS C 1 1 17 9271 1 1 16 CYS CA C -6.156 4.396 3.379 1.00 . A A . 37 CYS CA 1 1 17 9272 1 1 16 CYS CB C -6.154 2.881 3.666 1.00 . A A . 37 CYS CB 1 1 17 9273 1 1 16 CYS H H -6.526 4.775 1.344 1.00 . A A . 37 CYS H 1 1 17 9274 1 1 16 CYS HA H -6.529 4.926 4.254 1.00 . A A . 37 CYS HA 1 1 17 9275 1 1 16 CYS HB2 H -6.110 2.321 2.732 1.00 . A A . 37 CYS HB2 1 1 17 9276 1 1 16 CYS HB3 H -5.255 2.622 4.222 1.00 . A A . 37 CYS HB3 1 1 17 9277 1 1 16 CYS N N -7.013 4.703 2.228 1.00 . A A . 37 CYS N 1 1 17 9278 1 1 16 CYS O O -4.443 5.440 2.026 1.00 . A A . 37 CYS O 1 1 17 9279 1 1 16 CYS SG S -7.580 2.388 4.673 1.00 . A A . 37 CYS SG 1 1 17 9280 1 1 17 ARG C C -1.698 4.629 2.712 1.00 . A A . 38 ARG C 1 1 17 9281 1 1 17 ARG CA C -2.400 5.162 3.970 1.00 . A A . 38 ARG CA 1 1 17 9282 1 1 17 ARG CB C -1.608 4.758 5.231 1.00 . A A . 38 ARG CB 1 1 17 9283 1 1 17 ARG CD C -2.947 4.875 7.459 1.00 . A A . 38 ARG CD 1 1 17 9284 1 1 17 ARG CG C -1.931 5.542 6.519 1.00 . A A . 38 ARG CG 1 1 17 9285 1 1 17 ARG CZ C -5.384 4.374 7.111 1.00 . A A . 38 ARG CZ 1 1 17 9286 1 1 17 ARG H H -4.114 4.303 4.931 1.00 . A A . 38 ARG H 1 1 17 9287 1 1 17 ARG HA H -2.369 6.249 3.883 1.00 . A A . 38 ARG HA 1 1 17 9288 1 1 17 ARG HB2 H -1.715 3.686 5.408 1.00 . A A . 38 ARG HB2 1 1 17 9289 1 1 17 ARG HB3 H -0.556 4.944 5.014 1.00 . A A . 38 ARG HB3 1 1 17 9290 1 1 17 ARG HD2 H -2.769 3.801 7.463 1.00 . A A . 38 ARG HD2 1 1 17 9291 1 1 17 ARG HD3 H -2.756 5.238 8.470 1.00 . A A . 38 ARG HD3 1 1 17 9292 1 1 17 ARG HE H -4.558 6.171 6.965 1.00 . A A . 38 ARG HE 1 1 17 9293 1 1 17 ARG HG2 H -0.997 5.620 7.079 1.00 . A A . 38 ARG HG2 1 1 17 9294 1 1 17 ARG HG3 H -2.244 6.558 6.277 1.00 . A A . 38 ARG HG3 1 1 17 9295 1 1 17 ARG HH11 H -4.378 2.692 7.570 1.00 . A A . 38 ARG HH11 1 1 17 9296 1 1 17 ARG HH12 H -6.090 2.511 7.279 1.00 . A A . 38 ARG HH12 1 1 17 9297 1 1 17 ARG HH21 H -6.732 5.807 6.699 1.00 . A A . 38 ARG HH21 1 1 17 9298 1 1 17 ARG HH22 H -7.323 4.170 6.673 1.00 . A A . 38 ARG HH22 1 1 17 9299 1 1 17 ARG N N -3.810 4.739 4.074 1.00 . A A . 38 ARG N 1 1 17 9300 1 1 17 ARG NE N -4.349 5.197 7.124 1.00 . A A . 38 ARG NE 1 1 17 9301 1 1 17 ARG NH1 N -5.274 3.094 7.325 1.00 . A A . 38 ARG NH1 1 1 17 9302 1 1 17 ARG NH2 N -6.573 4.823 6.842 1.00 . A A . 38 ARG NH2 1 1 17 9303 1 1 17 ARG O O -0.943 5.379 2.092 1.00 . A A . 38 ARG O 1 1 17 9304 1 1 18 ALA C C -2.354 1.576 0.610 1.00 . A A . 39 ALA C 1 1 17 9305 1 1 18 ALA CA C -1.484 2.776 1.065 1.00 . A A . 39 ALA CA 1 1 17 9306 1 1 18 ALA CB C -0.040 2.300 1.300 1.00 . A A . 39 ALA CB 1 1 17 9307 1 1 18 ALA H H -2.598 2.835 2.876 1.00 . A A . 39 ALA H 1 1 17 9308 1 1 18 ALA HA H -1.489 3.533 0.279 1.00 . A A . 39 ALA HA 1 1 17 9309 1 1 18 ALA HB1 H -0.034 1.536 2.077 1.00 . A A . 39 ALA HB1 1 1 17 9310 1 1 18 ALA HB2 H 0.367 1.869 0.388 1.00 . A A . 39 ALA HB2 1 1 17 9311 1 1 18 ALA HB3 H 0.591 3.136 1.606 1.00 . A A . 39 ALA HB3 1 1 17 9312 1 1 18 ALA N N -1.971 3.384 2.309 1.00 . A A . 39 ALA N 1 1 17 9313 1 1 18 ALA O O -3.032 0.960 1.439 1.00 . A A . 39 ALA O 1 1 17 9314 1 1 19 PRO C C -1.691 -1.232 -0.650 1.00 . A A . 40 PRO C 1 1 17 9315 1 1 19 PRO CA C -2.705 -0.163 -1.112 1.00 . A A . 40 PRO CA 1 1 17 9316 1 1 19 PRO CB C -2.782 -0.063 -2.638 1.00 . A A . 40 PRO CB 1 1 17 9317 1 1 19 PRO CD C -1.735 1.923 -1.796 1.00 . A A . 40 PRO CD 1 1 17 9318 1 1 19 PRO CG C -1.692 0.953 -2.977 1.00 . A A . 40 PRO CG 1 1 17 9319 1 1 19 PRO HA H -3.690 -0.412 -0.715 1.00 . A A . 40 PRO HA 1 1 17 9320 1 1 19 PRO HB2 H -2.613 -1.021 -3.134 1.00 . A A . 40 PRO HB2 1 1 17 9321 1 1 19 PRO HB3 H -3.754 0.342 -2.924 1.00 . A A . 40 PRO HB3 1 1 17 9322 1 1 19 PRO HD2 H -0.729 2.287 -1.581 1.00 . A A . 40 PRO HD2 1 1 17 9323 1 1 19 PRO HD3 H -2.392 2.761 -2.034 1.00 . A A . 40 PRO HD3 1 1 17 9324 1 1 19 PRO HG2 H -0.722 0.455 -3.005 1.00 . A A . 40 PRO HG2 1 1 17 9325 1 1 19 PRO HG3 H -1.889 1.458 -3.923 1.00 . A A . 40 PRO HG3 1 1 17 9326 1 1 19 PRO N N -2.297 1.175 -0.676 1.00 . A A . 40 PRO N 1 1 17 9327 1 1 19 PRO O O -0.589 -0.904 -0.206 1.00 . A A . 40 PRO O 1 1 17 9328 1 1 20 LYS C C 0.197 -3.803 -0.980 1.00 . A A . 41 LYS C 1 1 17 9329 1 1 20 LYS CA C -1.215 -3.691 -0.384 1.00 . A A . 41 LYS CA 1 1 17 9330 1 1 20 LYS CB C -2.019 -4.991 -0.575 1.00 . A A . 41 LYS CB 1 1 17 9331 1 1 20 LYS CD C -3.014 -6.716 -2.122 1.00 . A A . 41 LYS CD 1 1 17 9332 1 1 20 LYS CE C -3.246 -7.119 -3.584 1.00 . A A . 41 LYS CE 1 1 17 9333 1 1 20 LYS CG C -2.270 -5.375 -2.042 1.00 . A A . 41 LYS CG 1 1 17 9334 1 1 20 LYS H H -2.950 -2.706 -1.191 1.00 . A A . 41 LYS H 1 1 17 9335 1 1 20 LYS HA H -1.040 -3.578 0.687 1.00 . A A . 41 LYS HA 1 1 17 9336 1 1 20 LYS HB2 H -1.476 -5.805 -0.089 1.00 . A A . 41 LYS HB2 1 1 17 9337 1 1 20 LYS HB3 H -2.977 -4.892 -0.068 1.00 . A A . 41 LYS HB3 1 1 17 9338 1 1 20 LYS HD2 H -2.416 -7.485 -1.628 1.00 . A A . 41 LYS HD2 1 1 17 9339 1 1 20 LYS HD3 H -3.973 -6.631 -1.608 1.00 . A A . 41 LYS HD3 1 1 17 9340 1 1 20 LYS HE2 H -3.868 -6.360 -4.068 1.00 . A A . 41 LYS HE2 1 1 17 9341 1 1 20 LYS HE3 H -2.280 -7.137 -4.101 1.00 . A A . 41 LYS HE3 1 1 17 9342 1 1 20 LYS HG2 H -2.865 -4.601 -2.529 1.00 . A A . 41 LYS HG2 1 1 17 9343 1 1 20 LYS HG3 H -1.318 -5.468 -2.566 1.00 . A A . 41 LYS HG3 1 1 17 9344 1 1 20 LYS HZ1 H -4.788 -8.473 -3.215 1.00 . A A . 41 LYS HZ1 1 1 17 9345 1 1 20 LYS HZ2 H -4.053 -8.706 -4.654 1.00 . A A . 41 LYS HZ2 1 1 17 9346 1 1 20 LYS HZ3 H -3.315 -9.175 -3.278 1.00 . A A . 41 LYS HZ3 1 1 17 9347 1 1 20 LYS N N -2.027 -2.521 -0.808 1.00 . A A . 41 LYS N 1 1 17 9348 1 1 20 LYS NZ N -3.894 -8.453 -3.687 1.00 . A A . 41 LYS NZ 1 1 17 9349 1 1 20 LYS O O 0.975 -4.654 -0.548 1.00 . A A . 41 LYS O 1 1 17 9350 1 1 21 VAL C C 2.853 -2.257 -1.201 1.00 . A A . 42 VAL C 1 1 17 9351 1 1 21 VAL CA C 1.935 -2.675 -2.365 1.00 . A A . 42 VAL CA 1 1 17 9352 1 1 21 VAL CB C 1.926 -1.582 -3.460 1.00 . A A . 42 VAL CB 1 1 17 9353 1 1 21 VAL CG1 C 3.321 -1.290 -4.014 1.00 . A A . 42 VAL CG1 1 1 17 9354 1 1 21 VAL CG2 C 1.036 -1.977 -4.648 1.00 . A A . 42 VAL CG2 1 1 17 9355 1 1 21 VAL H H -0.161 -2.289 -2.226 1.00 . A A . 42 VAL H 1 1 17 9356 1 1 21 VAL HA H 2.342 -3.591 -2.798 1.00 . A A . 42 VAL HA 1 1 17 9357 1 1 21 VAL HB H 1.533 -0.660 -3.031 1.00 . A A . 42 VAL HB 1 1 17 9358 1 1 21 VAL HG11 H 3.766 -2.210 -4.398 1.00 . A A . 42 VAL HG11 1 1 17 9359 1 1 21 VAL HG12 H 3.260 -0.557 -4.818 1.00 . A A . 42 VAL HG12 1 1 17 9360 1 1 21 VAL HG13 H 3.958 -0.879 -3.232 1.00 . A A . 42 VAL HG13 1 1 17 9361 1 1 21 VAL HG21 H 1.382 -2.920 -5.075 1.00 . A A . 42 VAL HG21 1 1 17 9362 1 1 21 VAL HG22 H -0.002 -2.082 -4.339 1.00 . A A . 42 VAL HG22 1 1 17 9363 1 1 21 VAL HG23 H 1.078 -1.204 -5.416 1.00 . A A . 42 VAL HG23 1 1 17 9364 1 1 21 VAL N N 0.554 -2.929 -1.919 1.00 . A A . 42 VAL N 1 1 17 9365 1 1 21 VAL O O 4.021 -2.640 -1.177 1.00 . A A . 42 VAL O 1 1 17 9366 1 1 22 CYS C C 2.200 -0.810 2.156 1.00 . A A . 43 CYS C 1 1 17 9367 1 1 22 CYS CA C 3.068 -0.883 0.873 1.00 . A A . 43 CYS CA 1 1 17 9368 1 1 22 CYS CB C 3.537 0.495 0.352 1.00 . A A . 43 CYS CB 1 1 17 9369 1 1 22 CYS H H 1.335 -1.292 -0.280 1.00 . A A . 43 CYS H 1 1 17 9370 1 1 22 CYS HA H 3.952 -1.479 1.104 1.00 . A A . 43 CYS HA 1 1 17 9371 1 1 22 CYS HB2 H 3.976 0.357 -0.638 1.00 . A A . 43 CYS HB2 1 1 17 9372 1 1 22 CYS HB3 H 2.678 1.160 0.252 1.00 . A A . 43 CYS HB3 1 1 17 9373 1 1 22 CYS N N 2.325 -1.508 -0.225 1.00 . A A . 43 CYS N 1 1 17 9374 1 1 22 CYS O O 1.294 -1.618 2.368 1.00 . A A . 43 CYS O 1 1 17 9375 1 1 22 CYS SG S 4.790 1.244 1.433 1.00 . A A . 43 CYS SG 1 1 17 9376 1 1 23 PHE C C 1.700 2.090 4.398 1.00 . A A . 44 PHE C 1 1 17 9377 1 1 23 PHE CA C 1.725 0.559 4.198 1.00 . A A . 44 PHE CA 1 1 17 9378 1 1 23 PHE CB C 2.276 -0.141 5.451 1.00 . A A . 44 PHE CB 1 1 17 9379 1 1 23 PHE CD1 C 4.802 0.162 5.398 1.00 . A A . 44 PHE CD1 1 1 17 9380 1 1 23 PHE CD2 C 3.510 1.352 7.085 1.00 . A A . 44 PHE CD2 1 1 17 9381 1 1 23 PHE CE1 C 5.979 0.761 5.883 1.00 . A A . 44 PHE CE1 1 1 17 9382 1 1 23 PHE CE2 C 4.688 1.948 7.571 1.00 . A A . 44 PHE CE2 1 1 17 9383 1 1 23 PHE CG C 3.561 0.460 5.997 1.00 . A A . 44 PHE CG 1 1 17 9384 1 1 23 PHE CZ C 5.923 1.655 6.967 1.00 . A A . 44 PHE CZ 1 1 17 9385 1 1 23 PHE H H 3.324 0.690 2.782 1.00 . A A . 44 PHE H 1 1 17 9386 1 1 23 PHE HA H 0.693 0.238 4.056 1.00 . A A . 44 PHE HA 1 1 17 9387 1 1 23 PHE HB2 H 1.513 -0.086 6.229 1.00 . A A . 44 PHE HB2 1 1 17 9388 1 1 23 PHE HB3 H 2.433 -1.199 5.238 1.00 . A A . 44 PHE HB3 1 1 17 9389 1 1 23 PHE HD1 H 4.854 -0.521 4.562 1.00 . A A . 44 PHE HD1 1 1 17 9390 1 1 23 PHE HD2 H 2.561 1.592 7.547 1.00 . A A . 44 PHE HD2 1 1 17 9391 1 1 23 PHE HE1 H 6.930 0.534 5.420 1.00 . A A . 44 PHE HE1 1 1 17 9392 1 1 23 PHE HE2 H 4.643 2.637 8.405 1.00 . A A . 44 PHE HE2 1 1 17 9393 1 1 23 PHE HZ H 6.830 2.116 7.336 1.00 . A A . 44 PHE HZ 1 1 17 9394 1 1 23 PHE N N 2.506 0.151 3.026 1.00 . A A . 44 PHE N 1 1 17 9395 1 1 23 PHE O O 0.809 2.592 5.084 1.00 . A A . 44 PHE O 1 1 17 9396 1 1 24 LYS C C 3.559 4.973 2.807 1.00 . A A . 45 LYS C 1 1 17 9397 1 1 24 LYS CA C 2.779 4.304 3.949 1.00 . A A . 45 LYS CA 1 1 17 9398 1 1 24 LYS CB C 3.456 4.592 5.310 1.00 . A A . 45 LYS CB 1 1 17 9399 1 1 24 LYS CD C 2.400 6.900 5.727 1.00 . A A . 45 LYS CD 1 1 17 9400 1 1 24 LYS CE C 2.742 8.332 6.159 1.00 . A A . 45 LYS CE 1 1 17 9401 1 1 24 LYS CG C 3.693 6.077 5.635 1.00 . A A . 45 LYS CG 1 1 17 9402 1 1 24 LYS H H 3.345 2.358 3.246 1.00 . A A . 45 LYS H 1 1 17 9403 1 1 24 LYS HA H 1.782 4.744 3.949 1.00 . A A . 45 LYS HA 1 1 17 9404 1 1 24 LYS HB2 H 2.844 4.167 6.106 1.00 . A A . 45 LYS HB2 1 1 17 9405 1 1 24 LYS HB3 H 4.422 4.085 5.336 1.00 . A A . 45 LYS HB3 1 1 17 9406 1 1 24 LYS HD2 H 1.904 6.923 4.756 1.00 . A A . 45 LYS HD2 1 1 17 9407 1 1 24 LYS HD3 H 1.733 6.444 6.463 1.00 . A A . 45 LYS HD3 1 1 17 9408 1 1 24 LYS HE2 H 3.279 8.292 7.112 1.00 . A A . 45 LYS HE2 1 1 17 9409 1 1 24 LYS HE3 H 3.416 8.771 5.416 1.00 . A A . 45 LYS HE3 1 1 17 9410 1 1 24 LYS HG2 H 4.207 6.128 6.596 1.00 . A A . 45 LYS HG2 1 1 17 9411 1 1 24 LYS HG3 H 4.350 6.517 4.885 1.00 . A A . 45 LYS HG3 1 1 17 9412 1 1 24 LYS HZ1 H 1.020 9.243 5.427 1.00 . A A . 45 LYS HZ1 1 1 17 9413 1 1 24 LYS HZ2 H 0.899 8.803 7.000 1.00 . A A . 45 LYS HZ2 1 1 17 9414 1 1 24 LYS HZ3 H 1.768 10.116 6.582 1.00 . A A . 45 LYS HZ3 1 1 17 9415 1 1 24 LYS N N 2.653 2.839 3.804 1.00 . A A . 45 LYS N 1 1 17 9416 1 1 24 LYS NZ N 1.525 9.174 6.300 1.00 . A A . 45 LYS NZ 1 1 17 9417 1 1 24 LYS O O 3.040 5.899 2.185 1.00 . A A . 45 LYS O 1 1 17 9418 1 1 25 CYS C C 5.402 5.053 0.137 1.00 . A A . 46 CYS C 1 1 17 9419 1 1 25 CYS CA C 5.751 5.171 1.638 1.00 . A A . 46 CYS CA 1 1 17 9420 1 1 25 CYS CB C 7.184 4.674 1.944 1.00 . A A . 46 CYS CB 1 1 17 9421 1 1 25 CYS H H 5.165 3.792 3.126 1.00 . A A . 46 CYS H 1 1 17 9422 1 1 25 CYS HA H 5.739 6.239 1.864 1.00 . A A . 46 CYS HA 1 1 17 9423 1 1 25 CYS HB2 H 7.720 4.505 1.005 1.00 . A A . 46 CYS HB2 1 1 17 9424 1 1 25 CYS HB3 H 7.710 5.474 2.469 1.00 . A A . 46 CYS HB3 1 1 17 9425 1 1 25 CYS N N 4.791 4.527 2.545 1.00 . A A . 46 CYS N 1 1 17 9426 1 1 25 CYS O O 5.653 5.999 -0.612 1.00 . A A . 46 CYS O 1 1 17 9427 1 1 25 CYS SG S 7.266 3.174 2.971 1.00 . A A . 46 CYS SG 1 1 17 9428 1 1 26 LYS C C 4.810 4.174 -2.881 1.00 . A A . 47 LYS C 1 1 17 9429 1 1 26 LYS CA C 4.109 3.689 -1.587 1.00 . A A . 47 LYS CA 1 1 17 9430 1 1 26 LYS CB C 2.621 4.095 -1.466 1.00 . A A . 47 LYS CB 1 1 17 9431 1 1 26 LYS CD C 0.934 5.880 -0.796 1.00 . A A . 47 LYS CD 1 1 17 9432 1 1 26 LYS CE C 0.857 7.287 -0.190 1.00 . A A . 47 LYS CE 1 1 17 9433 1 1 26 LYS CG C 2.373 5.599 -1.245 1.00 . A A . 47 LYS CG 1 1 17 9434 1 1 26 LYS H H 4.663 3.221 0.423 1.00 . A A . 47 LYS H 1 1 17 9435 1 1 26 LYS HA H 4.096 2.606 -1.710 1.00 . A A . 47 LYS HA 1 1 17 9436 1 1 26 LYS HB2 H 2.078 3.773 -2.357 1.00 . A A . 47 LYS HB2 1 1 17 9437 1 1 26 LYS HB3 H 2.202 3.547 -0.621 1.00 . A A . 47 LYS HB3 1 1 17 9438 1 1 26 LYS HD2 H 0.257 5.793 -1.649 1.00 . A A . 47 LYS HD2 1 1 17 9439 1 1 26 LYS HD3 H 0.646 5.156 -0.034 1.00 . A A . 47 LYS HD3 1 1 17 9440 1 1 26 LYS HE2 H 1.593 7.354 0.618 1.00 . A A . 47 LYS HE2 1 1 17 9441 1 1 26 LYS HE3 H 1.123 8.022 -0.955 1.00 . A A . 47 LYS HE3 1 1 17 9442 1 1 26 LYS HG2 H 3.032 5.964 -0.464 1.00 . A A . 47 LYS HG2 1 1 17 9443 1 1 26 LYS HG3 H 2.589 6.151 -2.160 1.00 . A A . 47 LYS HG3 1 1 17 9444 1 1 26 LYS HZ1 H -0.777 6.856 1.008 1.00 . A A . 47 LYS HZ1 1 1 17 9445 1 1 26 LYS HZ2 H -0.525 8.467 0.814 1.00 . A A . 47 LYS HZ2 1 1 17 9446 1 1 26 LYS HZ3 H -1.176 7.604 -0.409 1.00 . A A . 47 LYS HZ3 1 1 17 9447 1 1 26 LYS N N 4.779 3.940 -0.284 1.00 . A A . 47 LYS N 1 1 17 9448 1 1 26 LYS NZ N -0.495 7.574 0.347 1.00 . A A . 47 LYS NZ 1 1 17 9449 1 1 26 LYS O O 4.146 4.409 -3.890 1.00 . A A . 47 LYS O 1 1 17 9450 1 1 27 GLN C C 6.969 3.537 -5.132 1.00 . A A . 48 GLN C 1 1 17 9451 1 1 27 GLN CA C 6.937 4.668 -4.068 1.00 . A A . 48 GLN CA 1 1 17 9452 1 1 27 GLN CB C 8.372 5.051 -3.650 1.00 . A A . 48 GLN CB 1 1 17 9453 1 1 27 GLN CD C 7.764 7.479 -3.140 1.00 . A A . 48 GLN CD 1 1 17 9454 1 1 27 GLN CG C 8.460 6.213 -2.646 1.00 . A A . 48 GLN CG 1 1 17 9455 1 1 27 GLN H H 6.626 4.117 -2.017 1.00 . A A . 48 GLN H 1 1 17 9456 1 1 27 GLN HA H 6.463 5.542 -4.509 1.00 . A A . 48 GLN HA 1 1 17 9457 1 1 27 GLN HB2 H 8.860 4.184 -3.212 1.00 . A A . 48 GLN HB2 1 1 17 9458 1 1 27 GLN HB3 H 8.938 5.330 -4.539 1.00 . A A . 48 GLN HB3 1 1 17 9459 1 1 27 GLN HE21 H 6.244 7.277 -1.821 1.00 . A A . 48 GLN HE21 1 1 17 9460 1 1 27 GLN HE22 H 6.177 8.682 -2.893 1.00 . A A . 48 GLN HE22 1 1 17 9461 1 1 27 GLN HG2 H 8.040 5.904 -1.690 1.00 . A A . 48 GLN HG2 1 1 17 9462 1 1 27 GLN HG3 H 9.512 6.445 -2.472 1.00 . A A . 48 GLN HG3 1 1 17 9463 1 1 27 GLN N N 6.142 4.299 -2.882 1.00 . A A . 48 GLN N 1 1 17 9464 1 1 27 GLN NE2 N 6.637 7.847 -2.569 1.00 . A A . 48 GLN NE2 1 1 17 9465 1 1 27 GLN O O 6.888 2.365 -4.749 1.00 . A A . 48 GLN O 1 1 17 9466 1 1 27 GLN OE1 O 8.212 8.153 -4.060 1.00 . A A . 48 GLN OE1 1 1 17 9467 1 1 28 PRO C C 7.685 1.558 -7.575 1.00 . A A . 49 PRO C 1 1 17 9468 1 1 28 PRO CA C 6.952 2.915 -7.571 1.00 . A A . 49 PRO CA 1 1 17 9469 1 1 28 PRO CB C 7.348 3.708 -8.823 1.00 . A A . 49 PRO CB 1 1 17 9470 1 1 28 PRO CD C 7.343 5.198 -6.965 1.00 . A A . 49 PRO CD 1 1 17 9471 1 1 28 PRO CG C 7.006 5.143 -8.453 1.00 . A A . 49 PRO CG 1 1 17 9472 1 1 28 PRO HA H 5.884 2.704 -7.634 1.00 . A A . 49 PRO HA 1 1 17 9473 1 1 28 PRO HB2 H 8.423 3.627 -8.994 1.00 . A A . 49 PRO HB2 1 1 17 9474 1 1 28 PRO HB3 H 6.796 3.377 -9.703 1.00 . A A . 49 PRO HB3 1 1 17 9475 1 1 28 PRO HD2 H 8.388 5.482 -6.842 1.00 . A A . 49 PRO HD2 1 1 17 9476 1 1 28 PRO HD3 H 6.697 5.934 -6.490 1.00 . A A . 49 PRO HD3 1 1 17 9477 1 1 28 PRO HG2 H 7.589 5.862 -9.028 1.00 . A A . 49 PRO HG2 1 1 17 9478 1 1 28 PRO HG3 H 5.937 5.313 -8.593 1.00 . A A . 49 PRO HG3 1 1 17 9479 1 1 28 PRO N N 7.140 3.847 -6.441 1.00 . A A . 49 PRO N 1 1 17 9480 1 1 28 PRO O O 7.266 0.663 -8.314 1.00 . A A . 49 PRO O 1 1 17 9481 1 1 29 GLY C C 10.273 -0.185 -5.443 1.00 . A A . 50 GLY C 1 1 17 9482 1 1 29 GLY CA C 9.531 0.116 -6.754 1.00 . A A . 50 GLY CA 1 1 17 9483 1 1 29 GLY H H 9.101 2.175 -6.286 1.00 . A A . 50 GLY H 1 1 17 9484 1 1 29 GLY HA2 H 10.268 0.136 -7.556 1.00 . A A . 50 GLY HA2 1 1 17 9485 1 1 29 GLY HA3 H 8.861 -0.724 -6.939 1.00 . A A . 50 GLY HA3 1 1 17 9486 1 1 29 GLY N N 8.760 1.376 -6.797 1.00 . A A . 50 GLY N 1 1 17 9487 1 1 29 GLY O O 10.941 -1.215 -5.343 1.00 . A A . 50 GLY O 1 1 17 9488 1 1 30 HIS C C 10.463 -0.698 -2.329 1.00 . A A . 51 HIS C 1 1 17 9489 1 1 30 HIS CA C 10.867 0.550 -3.143 1.00 . A A . 51 HIS CA 1 1 17 9490 1 1 30 HIS CB C 10.614 1.821 -2.312 1.00 . A A . 51 HIS CB 1 1 17 9491 1 1 30 HIS CD2 C 9.104 1.745 -0.245 1.00 . A A . 51 HIS CD2 1 1 17 9492 1 1 30 HIS CE1 C 7.127 1.574 -1.187 1.00 . A A . 51 HIS CE1 1 1 17 9493 1 1 30 HIS CG C 9.278 1.830 -1.601 1.00 . A A . 51 HIS CG 1 1 17 9494 1 1 30 HIS H H 9.617 1.515 -4.579 1.00 . A A . 51 HIS H 1 1 17 9495 1 1 30 HIS HA H 11.939 0.481 -3.343 1.00 . A A . 51 HIS HA 1 1 17 9496 1 1 30 HIS HB2 H 11.397 1.887 -1.555 1.00 . A A . 51 HIS HB2 1 1 17 9497 1 1 30 HIS HB3 H 10.704 2.705 -2.942 1.00 . A A . 51 HIS HB3 1 1 17 9498 1 1 30 HIS HD1 H 7.785 1.791 -3.160 1.00 . A A . 51 HIS HD1 1 1 17 9499 1 1 30 HIS HD2 H 9.895 1.732 0.493 1.00 . A A . 51 HIS HD2 1 1 17 9500 1 1 30 HIS HE1 H 6.063 1.444 -1.333 1.00 . A A . 51 HIS HE1 1 1 17 9501 1 1 30 HIS N N 10.167 0.685 -4.432 1.00 . A A . 51 HIS N 1 1 17 9502 1 1 30 HIS ND1 N 8.023 1.735 -2.171 1.00 . A A . 51 HIS ND1 1 1 17 9503 1 1 30 HIS NE2 N 7.736 1.589 0.008 1.00 . A A . 51 HIS NE2 1 1 17 9504 1 1 30 HIS O O 11.247 -1.214 -1.530 1.00 . A A . 51 HIS O 1 1 17 9505 1 1 31 PHE C C 9.304 -3.518 -1.653 1.00 . A A . 52 PHE C 1 1 17 9506 1 1 31 PHE CA C 8.579 -2.166 -1.649 1.00 . A A . 52 PHE CA 1 1 17 9507 1 1 31 PHE CB C 7.100 -2.291 -2.049 1.00 . A A . 52 PHE CB 1 1 17 9508 1 1 31 PHE CD1 C 6.817 -3.730 -4.125 1.00 . A A . 52 PHE CD1 1 1 17 9509 1 1 31 PHE CD2 C 6.588 -1.315 -4.334 1.00 . A A . 52 PHE CD2 1 1 17 9510 1 1 31 PHE CE1 C 6.578 -3.869 -5.505 1.00 . A A . 52 PHE CE1 1 1 17 9511 1 1 31 PHE CE2 C 6.338 -1.458 -5.708 1.00 . A A . 52 PHE CE2 1 1 17 9512 1 1 31 PHE CG C 6.831 -2.451 -3.536 1.00 . A A . 52 PHE CG 1 1 17 9513 1 1 31 PHE CZ C 6.339 -2.734 -6.298 1.00 . A A . 52 PHE CZ 1 1 17 9514 1 1 31 PHE H H 8.654 -0.716 -3.202 1.00 . A A . 52 PHE H 1 1 17 9515 1 1 31 PHE HA H 8.607 -1.799 -0.622 1.00 . A A . 52 PHE HA 1 1 17 9516 1 1 31 PHE HB2 H 6.666 -3.136 -1.518 1.00 . A A . 52 PHE HB2 1 1 17 9517 1 1 31 PHE HB3 H 6.579 -1.398 -1.701 1.00 . A A . 52 PHE HB3 1 1 17 9518 1 1 31 PHE HD1 H 6.997 -4.610 -3.523 1.00 . A A . 52 PHE HD1 1 1 17 9519 1 1 31 PHE HD2 H 6.565 -0.330 -3.890 1.00 . A A . 52 PHE HD2 1 1 17 9520 1 1 31 PHE HE1 H 6.579 -4.853 -5.956 1.00 . A A . 52 PHE HE1 1 1 17 9521 1 1 31 PHE HE2 H 6.130 -0.585 -6.311 1.00 . A A . 52 PHE HE2 1 1 17 9522 1 1 31 PHE HZ H 6.150 -2.841 -7.358 1.00 . A A . 52 PHE HZ 1 1 17 9523 1 1 31 PHE N N 9.226 -1.170 -2.506 1.00 . A A . 52 PHE N 1 1 17 9524 1 1 31 PHE O O 9.532 -4.084 -0.585 1.00 . A A . 52 PHE O 1 1 17 9525 1 1 32 SER C C 11.943 -5.184 -2.260 1.00 . A A . 53 SER C 1 1 17 9526 1 1 32 SER CA C 10.576 -5.212 -2.971 1.00 . A A . 53 SER CA 1 1 17 9527 1 1 32 SER CB C 10.802 -5.493 -4.463 1.00 . A A . 53 SER CB 1 1 17 9528 1 1 32 SER H H 9.534 -3.480 -3.657 1.00 . A A . 53 SER H 1 1 17 9529 1 1 32 SER HA H 10.012 -6.046 -2.552 1.00 . A A . 53 SER HA 1 1 17 9530 1 1 32 SER HB2 H 11.403 -4.689 -4.894 1.00 . A A . 53 SER HB2 1 1 17 9531 1 1 32 SER HB3 H 11.344 -6.434 -4.576 1.00 . A A . 53 SER HB3 1 1 17 9532 1 1 32 SER HG H 9.749 -5.780 -6.090 1.00 . A A . 53 SER HG 1 1 17 9533 1 1 32 SER N N 9.776 -3.982 -2.813 1.00 . A A . 53 SER N 1 1 17 9534 1 1 32 SER O O 12.663 -6.186 -2.276 1.00 . A A . 53 SER O 1 1 17 9535 1 1 32 SER OG O 9.565 -5.582 -5.152 1.00 . A A . 53 SER OG 1 1 17 9536 1 1 33 LYS C C 13.458 -3.201 0.417 1.00 . A A . 54 LYS C 1 1 17 9537 1 1 33 LYS CA C 13.608 -3.777 -1.006 1.00 . A A . 54 LYS CA 1 1 17 9538 1 1 33 LYS CB C 14.440 -2.836 -1.903 1.00 . A A . 54 LYS CB 1 1 17 9539 1 1 33 LYS CD C 15.512 -2.417 -4.167 1.00 . A A . 54 LYS CD 1 1 17 9540 1 1 33 LYS CE C 15.594 -2.926 -5.611 1.00 . A A . 54 LYS CE 1 1 17 9541 1 1 33 LYS CG C 14.622 -3.355 -3.341 1.00 . A A . 54 LYS CG 1 1 17 9542 1 1 33 LYS H H 11.674 -3.262 -1.729 1.00 . A A . 54 LYS H 1 1 17 9543 1 1 33 LYS HA H 14.152 -4.717 -0.892 1.00 . A A . 54 LYS HA 1 1 17 9544 1 1 33 LYS HB2 H 13.958 -1.858 -1.938 1.00 . A A . 54 LYS HB2 1 1 17 9545 1 1 33 LYS HB3 H 15.428 -2.710 -1.456 1.00 . A A . 54 LYS HB3 1 1 17 9546 1 1 33 LYS HD2 H 15.083 -1.413 -4.158 1.00 . A A . 54 LYS HD2 1 1 17 9547 1 1 33 LYS HD3 H 16.511 -2.386 -3.728 1.00 . A A . 54 LYS HD3 1 1 17 9548 1 1 33 LYS HE2 H 15.994 -3.945 -5.604 1.00 . A A . 54 LYS HE2 1 1 17 9549 1 1 33 LYS HE3 H 14.582 -2.968 -6.027 1.00 . A A . 54 LYS HE3 1 1 17 9550 1 1 33 LYS HG2 H 15.074 -4.348 -3.311 1.00 . A A . 54 LYS HG2 1 1 17 9551 1 1 33 LYS HG3 H 13.650 -3.422 -3.831 1.00 . A A . 54 LYS HG3 1 1 17 9552 1 1 33 LYS HZ1 H 16.094 -1.105 -6.482 1.00 . A A . 54 LYS HZ1 1 1 17 9553 1 1 33 LYS HZ2 H 17.398 -2.016 -6.101 1.00 . A A . 54 LYS HZ2 1 1 17 9554 1 1 33 LYS HZ3 H 16.494 -2.391 -7.404 1.00 . A A . 54 LYS HZ3 1 1 17 9555 1 1 33 LYS N N 12.314 -4.044 -1.657 1.00 . A A . 54 LYS N 1 1 17 9556 1 1 33 LYS NZ N 16.452 -2.051 -6.452 1.00 . A A . 54 LYS NZ 1 1 17 9557 1 1 33 LYS O O 14.468 -2.868 1.042 1.00 . A A . 54 LYS O 1 1 17 9558 1 1 34 GLN C C 10.644 -3.142 2.881 1.00 . A A . 55 GLN C 1 1 17 9559 1 1 34 GLN CA C 11.949 -2.574 2.287 1.00 . A A . 55 GLN CA 1 1 17 9560 1 1 34 GLN CB C 11.910 -1.031 2.239 1.00 . A A . 55 GLN CB 1 1 17 9561 1 1 34 GLN CD C 11.679 1.123 3.552 1.00 . A A . 55 GLN CD 1 1 17 9562 1 1 34 GLN CG C 11.778 -0.398 3.632 1.00 . A A . 55 GLN CG 1 1 17 9563 1 1 34 GLN H H 11.458 -3.432 0.386 1.00 . A A . 55 GLN H 1 1 17 9564 1 1 34 GLN HA H 12.762 -2.872 2.952 1.00 . A A . 55 GLN HA 1 1 17 9565 1 1 34 GLN HB2 H 12.834 -0.664 1.787 1.00 . A A . 55 GLN HB2 1 1 17 9566 1 1 34 GLN HB3 H 11.080 -0.703 1.613 1.00 . A A . 55 GLN HB3 1 1 17 9567 1 1 34 GLN HE21 H 9.666 1.066 3.407 1.00 . A A . 55 GLN HE21 1 1 17 9568 1 1 34 GLN HE22 H 10.399 2.667 3.408 1.00 . A A . 55 GLN HE22 1 1 17 9569 1 1 34 GLN HG2 H 10.887 -0.779 4.134 1.00 . A A . 55 GLN HG2 1 1 17 9570 1 1 34 GLN HG3 H 12.648 -0.665 4.235 1.00 . A A . 55 GLN HG3 1 1 17 9571 1 1 34 GLN N N 12.229 -3.079 0.935 1.00 . A A . 55 GLN N 1 1 17 9572 1 1 34 GLN NE2 N 10.484 1.664 3.442 1.00 . A A . 55 GLN NE2 1 1 17 9573 1 1 34 GLN O O 10.681 -3.836 3.900 1.00 . A A . 55 GLN O 1 1 17 9574 1 1 34 GLN OE1 O 12.666 1.847 3.582 1.00 . A A . 55 GLN OE1 1 1 17 9575 1 1 35 CYS C C 7.513 -4.390 2.563 1.00 . A A . 56 CYS C 1 1 17 9576 1 1 35 CYS CA C 8.166 -3.024 2.858 1.00 . A A . 56 CYS CA 1 1 17 9577 1 1 35 CYS CB C 7.271 -1.881 2.353 1.00 . A A . 56 CYS CB 1 1 17 9578 1 1 35 CYS H H 9.547 -2.244 1.453 1.00 . A A . 56 CYS H 1 1 17 9579 1 1 35 CYS HA H 8.251 -2.929 3.941 1.00 . A A . 56 CYS HA 1 1 17 9580 1 1 35 CYS HB2 H 7.132 -1.965 1.273 1.00 . A A . 56 CYS HB2 1 1 17 9581 1 1 35 CYS HB3 H 6.290 -1.959 2.830 1.00 . A A . 56 CYS HB3 1 1 17 9582 1 1 35 CYS N N 9.496 -2.846 2.259 1.00 . A A . 56 CYS N 1 1 17 9583 1 1 35 CYS O O 6.554 -4.777 3.238 1.00 . A A . 56 CYS O 1 1 17 9584 1 1 35 CYS SG S 8.022 -0.285 2.771 1.00 . A A . 56 CYS SG 1 1 17 9585 1 1 36 ARG C C 8.446 -7.366 0.514 1.00 . A A . 57 ARG C 1 1 17 9586 1 1 36 ARG CA C 7.397 -6.332 0.978 1.00 . A A . 57 ARG CA 1 1 17 9587 1 1 36 ARG CB C 6.451 -5.924 -0.177 1.00 . A A . 57 ARG CB 1 1 17 9588 1 1 36 ARG CD C 3.935 -5.967 0.346 1.00 . A A . 57 ARG CD 1 1 17 9589 1 1 36 ARG CG C 5.144 -6.741 -0.205 1.00 . A A . 57 ARG CG 1 1 17 9590 1 1 36 ARG CZ C 3.400 -4.547 2.334 1.00 . A A . 57 ARG CZ 1 1 17 9591 1 1 36 ARG H H 8.753 -4.679 1.017 1.00 . A A . 57 ARG H 1 1 17 9592 1 1 36 ARG HA H 6.829 -6.828 1.765 1.00 . A A . 57 ARG HA 1 1 17 9593 1 1 36 ARG HB2 H 6.195 -4.865 -0.098 1.00 . A A . 57 ARG HB2 1 1 17 9594 1 1 36 ARG HB3 H 6.971 -6.043 -1.129 1.00 . A A . 57 ARG HB3 1 1 17 9595 1 1 36 ARG HD2 H 3.692 -5.169 -0.357 1.00 . A A . 57 ARG HD2 1 1 17 9596 1 1 36 ARG HD3 H 3.079 -6.644 0.400 1.00 . A A . 57 ARG HD3 1 1 17 9597 1 1 36 ARG HE H 5.097 -5.521 2.092 1.00 . A A . 57 ARG HE 1 1 17 9598 1 1 36 ARG HG2 H 4.924 -7.005 -1.240 1.00 . A A . 57 ARG HG2 1 1 17 9599 1 1 36 ARG HG3 H 5.267 -7.671 0.352 1.00 . A A . 57 ARG HG3 1 1 17 9600 1 1 36 ARG HH11 H 1.885 -4.630 1.042 1.00 . A A . 57 ARG HH11 1 1 17 9601 1 1 36 ARG HH12 H 1.709 -3.464 2.331 1.00 . A A . 57 ARG HH12 1 1 17 9602 1 1 36 ARG HH21 H 4.764 -4.196 3.739 1.00 . A A . 57 ARG HH21 1 1 17 9603 1 1 36 ARG HH22 H 3.212 -3.407 3.974 1.00 . A A . 57 ARG HH22 1 1 17 9604 1 1 36 ARG N N 7.998 -5.107 1.543 1.00 . A A . 57 ARG N 1 1 17 9605 1 1 36 ARG NE N 4.186 -5.376 1.676 1.00 . A A . 57 ARG NE 1 1 17 9606 1 1 36 ARG NH1 N 2.207 -4.243 1.920 1.00 . A A . 57 ARG NH1 1 1 17 9607 1 1 36 ARG NH2 N 3.819 -3.992 3.431 1.00 . A A . 57 ARG NH2 1 1 17 9608 1 1 36 ARG O O 8.110 -8.292 -0.228 1.00 . A A . 57 ARG O 1 1 17 9609 1 1 37 SER C C 10.661 -9.528 0.733 1.00 . A A . 58 SER C 1 1 17 9610 1 1 37 SER CA C 10.891 -8.014 0.610 1.00 . A A . 58 SER CA 1 1 17 9611 1 1 37 SER CB C 12.064 -7.608 1.504 1.00 . A A . 58 SER CB 1 1 17 9612 1 1 37 SER H H 9.878 -6.388 1.520 1.00 . A A . 58 SER H 1 1 17 9613 1 1 37 SER HA H 11.180 -7.816 -0.422 1.00 . A A . 58 SER HA 1 1 17 9614 1 1 37 SER HB2 H 11.844 -7.880 2.540 1.00 . A A . 58 SER HB2 1 1 17 9615 1 1 37 SER HB3 H 12.960 -8.146 1.188 1.00 . A A . 58 SER HB3 1 1 17 9616 1 1 37 SER HG H 13.021 -5.973 2.012 1.00 . A A . 58 SER HG 1 1 17 9617 1 1 37 SER N N 9.708 -7.187 0.930 1.00 . A A . 58 SER N 1 1 17 9618 1 1 37 SER O O 10.167 -9.985 1.791 1.00 . A A . 58 SER O 1 1 17 9619 1 1 37 SER OXT O 11.014 -10.259 -0.220 1.00 . A A . 58 SER OXT 1 1 17 9620 1 1 37 SER OG O 12.283 -6.207 1.416 1.00 . A A . 58 SER OG 1 1 17 9621 2 2 1 ZN ZN ZN -8.304 0.508 3.870 1.00 . B A . 1059 ZN ZN 1 1 17 9622 3 2 1 ZN ZN ZN 6.915 1.333 1.888 1.00 . C A . 1060 ZN ZN 1 1 18 9623 1 1 1 GLN C C -6.350 -1.548 -4.470 1.00 . A A . 22 GLN C 1 1 18 9624 1 1 1 GLN CA C -6.108 -1.119 -5.916 1.00 . A A . 22 GLN CA 1 1 18 9625 1 1 1 GLN CB C -4.705 -0.485 -6.036 1.00 . A A . 22 GLN CB 1 1 18 9626 1 1 1 GLN CD C -2.826 0.279 -7.601 1.00 . A A . 22 GLN CD 1 1 18 9627 1 1 1 GLN CG C -4.256 -0.255 -7.490 1.00 . A A . 22 GLN CG 1 1 18 9628 1 1 1 GLN H1 H -8.094 -0.647 -6.230 1.00 . A A . 22 GLN H1 1 1 18 9629 1 1 1 GLN H2 H -7.193 0.634 -5.766 1.00 . A A . 22 GLN H2 1 1 18 9630 1 1 1 GLN H3 H -7.083 0.068 -7.310 1.00 . A A . 22 GLN H3 1 1 18 9631 1 1 1 GLN HA H -6.135 -2.014 -6.538 1.00 . A A . 22 GLN HA 1 1 18 9632 1 1 1 GLN HB2 H -4.685 0.464 -5.498 1.00 . A A . 22 GLN HB2 1 1 18 9633 1 1 1 GLN HB3 H -3.987 -1.158 -5.564 1.00 . A A . 22 GLN HB3 1 1 18 9634 1 1 1 GLN HE21 H -2.941 0.458 -9.615 1.00 . A A . 22 GLN HE21 1 1 18 9635 1 1 1 GLN HE22 H -1.421 0.931 -8.864 1.00 . A A . 22 GLN HE22 1 1 18 9636 1 1 1 GLN HG2 H -4.312 -1.198 -8.036 1.00 . A A . 22 GLN HG2 1 1 18 9637 1 1 1 GLN HG3 H -4.924 0.460 -7.971 1.00 . A A . 22 GLN HG3 1 1 18 9638 1 1 1 GLN N N -7.192 -0.199 -6.344 1.00 . A A . 22 GLN N 1 1 18 9639 1 1 1 GLN NE2 N -2.365 0.580 -8.794 1.00 . A A . 22 GLN NE2 1 1 18 9640 1 1 1 GLN O O -6.521 -0.691 -3.610 1.00 . A A . 22 GLN O 1 1 18 9641 1 1 1 GLN OE1 O -2.092 0.440 -6.634 1.00 . A A . 22 GLN OE1 1 1 18 9642 1 1 2 THR C C -5.924 -2.827 -1.717 1.00 . A A . 23 THR C 1 1 18 9643 1 1 2 THR CA C -6.728 -3.432 -2.872 1.00 . A A . 23 THR CA 1 1 18 9644 1 1 2 THR CB C -6.542 -4.960 -2.899 1.00 . A A . 23 THR CB 1 1 18 9645 1 1 2 THR CG2 C -7.179 -5.666 -1.700 1.00 . A A . 23 THR CG2 1 1 18 9646 1 1 2 THR H H -6.257 -3.523 -4.942 1.00 . A A . 23 THR H 1 1 18 9647 1 1 2 THR HA H -7.778 -3.230 -2.685 1.00 . A A . 23 THR HA 1 1 18 9648 1 1 2 THR HB H -5.477 -5.195 -2.934 1.00 . A A . 23 THR HB 1 1 18 9649 1 1 2 THR HG1 H -6.948 -6.431 -4.107 1.00 . A A . 23 THR HG1 1 1 18 9650 1 1 2 THR HG21 H -8.245 -5.444 -1.661 1.00 . A A . 23 THR HG21 1 1 18 9651 1 1 2 THR HG22 H -7.043 -6.743 -1.797 1.00 . A A . 23 THR HG22 1 1 18 9652 1 1 2 THR HG23 H -6.701 -5.345 -0.774 1.00 . A A . 23 THR HG23 1 1 18 9653 1 1 2 THR N N -6.389 -2.857 -4.192 1.00 . A A . 23 THR N 1 1 18 9654 1 1 2 THR O O -4.713 -2.638 -1.834 1.00 . A A . 23 THR O 1 1 18 9655 1 1 2 THR OG1 O -7.167 -5.484 -4.053 1.00 . A A . 23 THR OG1 1 1 18 9656 1 1 3 CYS C C -4.883 -2.838 1.235 1.00 . A A . 24 CYS C 1 1 18 9657 1 1 3 CYS CA C -6.006 -1.974 0.621 1.00 . A A . 24 CYS CA 1 1 18 9658 1 1 3 CYS CB C -7.145 -1.812 1.631 1.00 . A A . 24 CYS CB 1 1 18 9659 1 1 3 CYS H H -7.595 -2.670 -0.606 1.00 . A A . 24 CYS H 1 1 18 9660 1 1 3 CYS HA H -5.607 -0.987 0.383 1.00 . A A . 24 CYS HA 1 1 18 9661 1 1 3 CYS HB2 H -8.015 -1.385 1.136 1.00 . A A . 24 CYS HB2 1 1 18 9662 1 1 3 CYS HB3 H -7.424 -2.794 2.016 1.00 . A A . 24 CYS HB3 1 1 18 9663 1 1 3 CYS N N -6.594 -2.538 -0.597 1.00 . A A . 24 CYS N 1 1 18 9664 1 1 3 CYS O O -4.929 -4.070 1.183 1.00 . A A . 24 CYS O 1 1 18 9665 1 1 3 CYS SG S -6.623 -0.727 2.984 1.00 . A A . 24 CYS SG 1 1 18 9666 1 1 4 TYR C C -3.602 -3.476 4.076 1.00 . A A . 25 TYR C 1 1 18 9667 1 1 4 TYR CA C -2.968 -2.849 2.814 1.00 . A A . 25 TYR CA 1 1 18 9668 1 1 4 TYR CB C -1.860 -1.860 3.216 1.00 . A A . 25 TYR CB 1 1 18 9669 1 1 4 TYR CD1 C -3.269 -0.081 4.377 1.00 . A A . 25 TYR CD1 1 1 18 9670 1 1 4 TYR CD2 C -1.358 -1.011 5.559 1.00 . A A . 25 TYR CD2 1 1 18 9671 1 1 4 TYR CE1 C -3.567 0.722 5.491 1.00 . A A . 25 TYR CE1 1 1 18 9672 1 1 4 TYR CE2 C -1.638 -0.186 6.668 1.00 . A A . 25 TYR CE2 1 1 18 9673 1 1 4 TYR CG C -2.166 -0.954 4.405 1.00 . A A . 25 TYR CG 1 1 18 9674 1 1 4 TYR CZ C -2.749 0.686 6.634 1.00 . A A . 25 TYR CZ 1 1 18 9675 1 1 4 TYR H H -3.966 -1.180 1.920 1.00 . A A . 25 TYR H 1 1 18 9676 1 1 4 TYR HA H -2.506 -3.665 2.261 1.00 . A A . 25 TYR HA 1 1 18 9677 1 1 4 TYR HB2 H -0.982 -2.456 3.465 1.00 . A A . 25 TYR HB2 1 1 18 9678 1 1 4 TYR HB3 H -1.590 -1.242 2.360 1.00 . A A . 25 TYR HB3 1 1 18 9679 1 1 4 TYR HD1 H -3.908 -0.029 3.509 1.00 . A A . 25 TYR HD1 1 1 18 9680 1 1 4 TYR HD2 H -0.516 -1.690 5.596 1.00 . A A . 25 TYR HD2 1 1 18 9681 1 1 4 TYR HE1 H -4.437 1.351 5.480 1.00 . A A . 25 TYR HE1 1 1 18 9682 1 1 4 TYR HE2 H -1.010 -0.225 7.547 1.00 . A A . 25 TYR HE2 1 1 18 9683 1 1 4 TYR HH H -2.436 1.348 8.439 1.00 . A A . 25 TYR HH 1 1 18 9684 1 1 4 TYR N N -3.931 -2.190 1.914 1.00 . A A . 25 TYR N 1 1 18 9685 1 1 4 TYR O O -2.959 -4.286 4.747 1.00 . A A . 25 TYR O 1 1 18 9686 1 1 4 TYR OH O -3.049 1.485 7.695 1.00 . A A . 25 TYR OH 1 1 18 9687 1 1 5 ASN C C -6.957 -3.916 5.501 1.00 . A A . 26 ASN C 1 1 18 9688 1 1 5 ASN CA C -5.507 -3.422 5.679 1.00 . A A . 26 ASN CA 1 1 18 9689 1 1 5 ASN CB C -5.459 -2.143 6.537 1.00 . A A . 26 ASN CB 1 1 18 9690 1 1 5 ASN CG C -6.243 -2.272 7.834 1.00 . A A . 26 ASN CG 1 1 18 9691 1 1 5 ASN H H -5.294 -2.426 3.805 1.00 . A A . 26 ASN H 1 1 18 9692 1 1 5 ASN HA H -4.963 -4.211 6.204 1.00 . A A . 26 ASN HA 1 1 18 9693 1 1 5 ASN HB2 H -4.422 -1.917 6.785 1.00 . A A . 26 ASN HB2 1 1 18 9694 1 1 5 ASN HB3 H -5.857 -1.301 5.971 1.00 . A A . 26 ASN HB3 1 1 18 9695 1 1 5 ASN HD21 H -7.915 -1.436 7.033 1.00 . A A . 26 ASN HD21 1 1 18 9696 1 1 5 ASN HD22 H -8.000 -1.912 8.722 1.00 . A A . 26 ASN HD22 1 1 18 9697 1 1 5 ASN N N -4.848 -3.108 4.407 1.00 . A A . 26 ASN N 1 1 18 9698 1 1 5 ASN ND2 N -7.480 -1.823 7.863 1.00 . A A . 26 ASN ND2 1 1 18 9699 1 1 5 ASN O O -7.341 -4.932 6.082 1.00 . A A . 26 ASN O 1 1 18 9700 1 1 5 ASN OD1 O -5.757 -2.781 8.833 1.00 . A A . 26 ASN OD1 1 1 18 9701 1 1 6 CYS C C -9.653 -4.529 3.688 1.00 . A A . 27 CYS C 1 1 18 9702 1 1 6 CYS CA C -9.207 -3.372 4.614 1.00 . A A . 27 CYS CA 1 1 18 9703 1 1 6 CYS CB C -9.808 -2.029 4.159 1.00 . A A . 27 CYS CB 1 1 18 9704 1 1 6 CYS H H -7.375 -2.368 4.272 1.00 . A A . 27 CYS H 1 1 18 9705 1 1 6 CYS HA H -9.589 -3.587 5.613 1.00 . A A . 27 CYS HA 1 1 18 9706 1 1 6 CYS HB2 H -9.515 -1.834 3.127 1.00 . A A . 27 CYS HB2 1 1 18 9707 1 1 6 CYS HB3 H -10.898 -2.104 4.193 1.00 . A A . 27 CYS HB3 1 1 18 9708 1 1 6 CYS N N -7.755 -3.201 4.705 1.00 . A A . 27 CYS N 1 1 18 9709 1 1 6 CYS O O -10.837 -4.876 3.664 1.00 . A A . 27 CYS O 1 1 18 9710 1 1 6 CYS SG S -9.263 -0.669 5.241 1.00 . A A . 27 CYS SG 1 1 18 9711 1 1 7 GLY C C -10.043 -5.920 0.904 1.00 . A A . 28 GLY C 1 1 18 9712 1 1 7 GLY CA C -8.997 -6.231 1.988 1.00 . A A . 28 GLY CA 1 1 18 9713 1 1 7 GLY H H -7.773 -4.813 3.022 1.00 . A A . 28 GLY H 1 1 18 9714 1 1 7 GLY HA2 H -9.338 -7.096 2.558 1.00 . A A . 28 GLY HA2 1 1 18 9715 1 1 7 GLY HA3 H -8.067 -6.497 1.488 1.00 . A A . 28 GLY HA3 1 1 18 9716 1 1 7 GLY N N -8.729 -5.120 2.917 1.00 . A A . 28 GLY N 1 1 18 9717 1 1 7 GLY O O -10.810 -6.805 0.518 1.00 . A A . 28 GLY O 1 1 18 9718 1 1 8 LYS C C -10.582 -3.496 -1.713 1.00 . A A . 29 LYS C 1 1 18 9719 1 1 8 LYS CA C -11.168 -4.128 -0.431 1.00 . A A . 29 LYS CA 1 1 18 9720 1 1 8 LYS CB C -11.988 -3.124 0.406 1.00 . A A . 29 LYS CB 1 1 18 9721 1 1 8 LYS CD C -14.535 -3.496 0.329 1.00 . A A . 29 LYS CD 1 1 18 9722 1 1 8 LYS CE C -14.433 -5.015 0.130 1.00 . A A . 29 LYS CE 1 1 18 9723 1 1 8 LYS CG C -13.330 -2.723 -0.233 1.00 . A A . 29 LYS CG 1 1 18 9724 1 1 8 LYS H H -9.429 -4.009 0.807 1.00 . A A . 29 LYS H 1 1 18 9725 1 1 8 LYS HA H -11.835 -4.939 -0.703 1.00 . A A . 29 LYS HA 1 1 18 9726 1 1 8 LYS HB2 H -12.178 -3.541 1.396 1.00 . A A . 29 LYS HB2 1 1 18 9727 1 1 8 LYS HB3 H -11.390 -2.227 0.559 1.00 . A A . 29 LYS HB3 1 1 18 9728 1 1 8 LYS HD2 H -14.621 -3.278 1.395 1.00 . A A . 29 LYS HD2 1 1 18 9729 1 1 8 LYS HD3 H -15.437 -3.131 -0.166 1.00 . A A . 29 LYS HD3 1 1 18 9730 1 1 8 LYS HE2 H -14.348 -5.226 -0.940 1.00 . A A . 29 LYS HE2 1 1 18 9731 1 1 8 LYS HE3 H -13.524 -5.378 0.622 1.00 . A A . 29 LYS HE3 1 1 18 9732 1 1 8 LYS HG2 H -13.499 -1.663 -0.032 1.00 . A A . 29 LYS HG2 1 1 18 9733 1 1 8 LYS HG3 H -13.287 -2.847 -1.316 1.00 . A A . 29 LYS HG3 1 1 18 9734 1 1 8 LYS HZ1 H -16.472 -5.413 0.248 1.00 . A A . 29 LYS HZ1 1 1 18 9735 1 1 8 LYS HZ2 H -15.544 -6.719 0.557 1.00 . A A . 29 LYS HZ2 1 1 18 9736 1 1 8 LYS HZ3 H -15.706 -5.553 1.685 1.00 . A A . 29 LYS HZ3 1 1 18 9737 1 1 8 LYS N N -10.100 -4.665 0.433 1.00 . A A . 29 LYS N 1 1 18 9738 1 1 8 LYS NZ N -15.615 -5.718 0.692 1.00 . A A . 29 LYS NZ 1 1 18 9739 1 1 8 LYS O O -9.851 -2.509 -1.593 1.00 . A A . 29 LYS O 1 1 18 9740 1 1 9 PRO C C -10.418 -2.078 -4.524 1.00 . A A . 30 PRO C 1 1 18 9741 1 1 9 PRO CA C -10.300 -3.576 -4.206 1.00 . A A . 30 PRO CA 1 1 18 9742 1 1 9 PRO CB C -11.009 -4.404 -5.283 1.00 . A A . 30 PRO CB 1 1 18 9743 1 1 9 PRO CD C -11.628 -5.260 -3.147 1.00 . A A . 30 PRO CD 1 1 18 9744 1 1 9 PRO CG C -11.313 -5.714 -4.569 1.00 . A A . 30 PRO CG 1 1 18 9745 1 1 9 PRO HA H -9.244 -3.842 -4.227 1.00 . A A . 30 PRO HA 1 1 18 9746 1 1 9 PRO HB2 H -11.947 -3.928 -5.574 1.00 . A A . 30 PRO HB2 1 1 18 9747 1 1 9 PRO HB3 H -10.374 -4.561 -6.157 1.00 . A A . 30 PRO HB3 1 1 18 9748 1 1 9 PRO HD2 H -12.693 -5.044 -3.058 1.00 . A A . 30 PRO HD2 1 1 18 9749 1 1 9 PRO HD3 H -11.343 -6.050 -2.449 1.00 . A A . 30 PRO HD3 1 1 18 9750 1 1 9 PRO HG2 H -12.155 -6.240 -5.022 1.00 . A A . 30 PRO HG2 1 1 18 9751 1 1 9 PRO HG3 H -10.423 -6.345 -4.565 1.00 . A A . 30 PRO HG3 1 1 18 9752 1 1 9 PRO N N -10.861 -4.037 -2.923 1.00 . A A . 30 PRO N 1 1 18 9753 1 1 9 PRO O O -9.519 -1.514 -5.151 1.00 . A A . 30 PRO O 1 1 18 9754 1 1 10 GLY C C -10.979 1.028 -3.568 1.00 . A A . 31 GLY C 1 1 18 9755 1 1 10 GLY CA C -11.803 -0.002 -4.356 1.00 . A A . 31 GLY CA 1 1 18 9756 1 1 10 GLY H H -12.189 -1.948 -3.574 1.00 . A A . 31 GLY H 1 1 18 9757 1 1 10 GLY HA2 H -12.858 0.176 -4.147 1.00 . A A . 31 GLY HA2 1 1 18 9758 1 1 10 GLY HA3 H -11.638 0.187 -5.418 1.00 . A A . 31 GLY HA3 1 1 18 9759 1 1 10 GLY N N -11.491 -1.416 -4.075 1.00 . A A . 31 GLY N 1 1 18 9760 1 1 10 GLY O O -11.441 2.150 -3.339 1.00 . A A . 31 GLY O 1 1 18 9761 1 1 11 HIS C C -7.903 2.309 -3.314 1.00 . A A . 32 HIS C 1 1 18 9762 1 1 11 HIS CA C -8.863 1.538 -2.394 1.00 . A A . 32 HIS CA 1 1 18 9763 1 1 11 HIS CB C -8.127 0.737 -1.309 1.00 . A A . 32 HIS CB 1 1 18 9764 1 1 11 HIS CD2 C -8.481 1.381 1.141 1.00 . A A . 32 HIS CD2 1 1 18 9765 1 1 11 HIS CE1 C -10.377 0.357 1.550 1.00 . A A . 32 HIS CE1 1 1 18 9766 1 1 11 HIS CG C -8.868 0.745 -0.003 1.00 . A A . 32 HIS CG 1 1 18 9767 1 1 11 HIS H H -9.455 -0.271 -3.346 1.00 . A A . 32 HIS H 1 1 18 9768 1 1 11 HIS HA H -9.450 2.299 -1.885 1.00 . A A . 32 HIS HA 1 1 18 9769 1 1 11 HIS HB2 H -7.999 -0.297 -1.625 1.00 . A A . 32 HIS HB2 1 1 18 9770 1 1 11 HIS HB3 H -7.132 1.155 -1.142 1.00 . A A . 32 HIS HB3 1 1 18 9771 1 1 11 HIS HD1 H -10.573 -0.472 -0.380 1.00 . A A . 32 HIS HD1 1 1 18 9772 1 1 11 HIS HD2 H -7.588 1.976 1.246 1.00 . A A . 32 HIS HD2 1 1 18 9773 1 1 11 HIS HE1 H -11.261 -0.021 2.052 1.00 . A A . 32 HIS HE1 1 1 18 9774 1 1 11 HIS N N -9.780 0.656 -3.112 1.00 . A A . 32 HIS N 1 1 18 9775 1 1 11 HIS ND1 N -10.057 0.112 0.268 1.00 . A A . 32 HIS ND1 1 1 18 9776 1 1 11 HIS NE2 N -9.429 1.113 2.137 1.00 . A A . 32 HIS NE2 1 1 18 9777 1 1 11 HIS O O -7.690 1.974 -4.484 1.00 . A A . 32 HIS O 1 1 18 9778 1 1 12 LEU C C -5.542 4.956 -2.269 1.00 . A A . 33 LEU C 1 1 18 9779 1 1 12 LEU CA C -6.479 4.391 -3.354 1.00 . A A . 33 LEU CA 1 1 18 9780 1 1 12 LEU CB C -7.351 5.543 -3.914 1.00 . A A . 33 LEU CB 1 1 18 9781 1 1 12 LEU CD1 C -9.132 6.413 -5.449 1.00 . A A . 33 LEU CD1 1 1 18 9782 1 1 12 LEU CD2 C -7.448 4.846 -6.362 1.00 . A A . 33 LEU CD2 1 1 18 9783 1 1 12 LEU CG C -8.257 5.205 -5.113 1.00 . A A . 33 LEU CG 1 1 18 9784 1 1 12 LEU H H -7.522 3.511 -1.761 1.00 . A A . 33 LEU H 1 1 18 9785 1 1 12 LEU HA H -5.869 3.953 -4.144 1.00 . A A . 33 LEU HA 1 1 18 9786 1 1 12 LEU HB2 H -7.981 5.916 -3.105 1.00 . A A . 33 LEU HB2 1 1 18 9787 1 1 12 LEU HB3 H -6.700 6.364 -4.217 1.00 . A A . 33 LEU HB3 1 1 18 9788 1 1 12 LEU HD11 H -9.746 6.672 -4.585 1.00 . A A . 33 LEU HD11 1 1 18 9789 1 1 12 LEU HD12 H -8.511 7.268 -5.714 1.00 . A A . 33 LEU HD12 1 1 18 9790 1 1 12 LEU HD13 H -9.790 6.173 -6.284 1.00 . A A . 33 LEU HD13 1 1 18 9791 1 1 12 LEU HD21 H -6.779 5.666 -6.625 1.00 . A A . 33 LEU HD21 1 1 18 9792 1 1 12 LEU HD22 H -6.862 3.946 -6.183 1.00 . A A . 33 LEU HD22 1 1 18 9793 1 1 12 LEU HD23 H -8.124 4.654 -7.196 1.00 . A A . 33 LEU HD23 1 1 18 9794 1 1 12 LEU HG H -8.917 4.377 -4.861 1.00 . A A . 33 LEU HG 1 1 18 9795 1 1 12 LEU N N -7.345 3.381 -2.747 1.00 . A A . 33 LEU N 1 1 18 9796 1 1 12 LEU O O -5.791 4.773 -1.073 1.00 . A A . 33 LEU O 1 1 18 9797 1 1 13 SER C C -4.394 7.571 -0.912 1.00 . A A . 34 SER C 1 1 18 9798 1 1 13 SER CA C -3.664 6.537 -1.796 1.00 . A A . 34 SER CA 1 1 18 9799 1 1 13 SER CB C -2.616 7.253 -2.657 1.00 . A A . 34 SER CB 1 1 18 9800 1 1 13 SER H H -4.420 5.876 -3.671 1.00 . A A . 34 SER H 1 1 18 9801 1 1 13 SER HA H -3.142 5.858 -1.122 1.00 . A A . 34 SER HA 1 1 18 9802 1 1 13 SER HB2 H -2.012 7.911 -2.033 1.00 . A A . 34 SER HB2 1 1 18 9803 1 1 13 SER HB3 H -1.963 6.507 -3.115 1.00 . A A . 34 SER HB3 1 1 18 9804 1 1 13 SER HG H -2.556 8.458 -4.207 1.00 . A A . 34 SER HG 1 1 18 9805 1 1 13 SER N N -4.538 5.734 -2.676 1.00 . A A . 34 SER N 1 1 18 9806 1 1 13 SER O O -3.796 8.117 0.018 1.00 . A A . 34 SER O 1 1 18 9807 1 1 13 SER OG O -3.248 8.010 -3.680 1.00 . A A . 34 SER OG 1 1 18 9808 1 1 14 SER C C -7.654 7.916 0.394 1.00 . A A . 35 SER C 1 1 18 9809 1 1 14 SER CA C -6.582 8.689 -0.397 1.00 . A A . 35 SER CA 1 1 18 9810 1 1 14 SER CB C -7.267 9.676 -1.350 1.00 . A A . 35 SER CB 1 1 18 9811 1 1 14 SER H H -6.062 7.436 -2.026 1.00 . A A . 35 SER H 1 1 18 9812 1 1 14 SER HA H -6.004 9.268 0.323 1.00 . A A . 35 SER HA 1 1 18 9813 1 1 14 SER HB2 H -7.960 10.305 -0.791 1.00 . A A . 35 SER HB2 1 1 18 9814 1 1 14 SER HB3 H -6.507 10.315 -1.806 1.00 . A A . 35 SER HB3 1 1 18 9815 1 1 14 SER HG H -8.396 9.627 -2.952 1.00 . A A . 35 SER HG 1 1 18 9816 1 1 14 SER N N -5.680 7.826 -1.178 1.00 . A A . 35 SER N 1 1 18 9817 1 1 14 SER O O -8.325 8.502 1.247 1.00 . A A . 35 SER O 1 1 18 9818 1 1 14 SER OG O -7.964 8.972 -2.371 1.00 . A A . 35 SER OG 1 1 18 9819 1 1 15 GLN C C -8.188 5.166 2.146 1.00 . A A . 36 GLN C 1 1 18 9820 1 1 15 GLN CA C -8.784 5.744 0.842 1.00 . A A . 36 GLN CA 1 1 18 9821 1 1 15 GLN CB C -9.222 4.622 -0.118 1.00 . A A . 36 GLN CB 1 1 18 9822 1 1 15 GLN CD C -11.750 4.791 -0.351 1.00 . A A . 36 GLN CD 1 1 18 9823 1 1 15 GLN CG C -10.584 3.998 0.237 1.00 . A A . 36 GLN CG 1 1 18 9824 1 1 15 GLN H H -7.191 6.176 -0.520 1.00 . A A . 36 GLN H 1 1 18 9825 1 1 15 GLN HA H -9.661 6.339 1.104 1.00 . A A . 36 GLN HA 1 1 18 9826 1 1 15 GLN HB2 H -9.287 5.015 -1.134 1.00 . A A . 36 GLN HB2 1 1 18 9827 1 1 15 GLN HB3 H -8.459 3.846 -0.112 1.00 . A A . 36 GLN HB3 1 1 18 9828 1 1 15 GLN HE21 H -11.861 3.640 -2.035 1.00 . A A . 36 GLN HE21 1 1 18 9829 1 1 15 GLN HE22 H -13.003 4.967 -1.903 1.00 . A A . 36 GLN HE22 1 1 18 9830 1 1 15 GLN HG2 H -10.629 2.988 -0.163 1.00 . A A . 36 GLN HG2 1 1 18 9831 1 1 15 GLN HG3 H -10.697 3.924 1.319 1.00 . A A . 36 GLN HG3 1 1 18 9832 1 1 15 GLN N N -7.816 6.608 0.147 1.00 . A A . 36 GLN N 1 1 18 9833 1 1 15 GLN NE2 N -12.235 4.433 -1.524 1.00 . A A . 36 GLN NE2 1 1 18 9834 1 1 15 GLN O O -8.871 5.128 3.171 1.00 . A A . 36 GLN O 1 1 18 9835 1 1 15 GLN OE1 O -12.239 5.751 0.229 1.00 . A A . 36 GLN OE1 1 1 18 9836 1 1 16 CYS C C -4.599 4.989 3.021 1.00 . A A . 37 CYS C 1 1 18 9837 1 1 16 CYS CA C -6.034 4.461 3.246 1.00 . A A . 37 CYS CA 1 1 18 9838 1 1 16 CYS CB C -6.019 2.935 3.476 1.00 . A A . 37 CYS CB 1 1 18 9839 1 1 16 CYS H H -6.423 4.898 1.218 1.00 . A A . 37 CYS H 1 1 18 9840 1 1 16 CYS HA H -6.418 4.951 4.138 1.00 . A A . 37 CYS HA 1 1 18 9841 1 1 16 CYS HB2 H -6.062 2.411 2.523 1.00 . A A . 37 CYS HB2 1 1 18 9842 1 1 16 CYS HB3 H -5.073 2.646 3.928 1.00 . A A . 37 CYS HB3 1 1 18 9843 1 1 16 CYS N N -6.897 4.801 2.108 1.00 . A A . 37 CYS N 1 1 18 9844 1 1 16 CYS O O -4.278 5.512 1.950 1.00 . A A . 37 CYS O 1 1 18 9845 1 1 16 CYS SG S -7.354 2.421 4.591 1.00 . A A . 37 CYS SG 1 1 18 9846 1 1 17 ARG C C -1.556 4.615 2.758 1.00 . A A . 38 ARG C 1 1 18 9847 1 1 17 ARG CA C -2.298 5.196 3.972 1.00 . A A . 38 ARG CA 1 1 18 9848 1 1 17 ARG CB C -1.574 4.799 5.275 1.00 . A A . 38 ARG CB 1 1 18 9849 1 1 17 ARG CD C -2.913 5.116 7.492 1.00 . A A . 38 ARG CD 1 1 18 9850 1 1 17 ARG CG C -1.867 5.674 6.511 1.00 . A A . 38 ARG CG 1 1 18 9851 1 1 17 ARG CZ C -5.332 4.712 6.934 1.00 . A A . 38 ARG CZ 1 1 18 9852 1 1 17 ARG H H -4.068 4.382 4.868 1.00 . A A . 38 ARG H 1 1 18 9853 1 1 17 ARG HA H -2.231 6.279 3.861 1.00 . A A . 38 ARG HA 1 1 18 9854 1 1 17 ARG HB2 H -1.762 3.749 5.505 1.00 . A A . 38 ARG HB2 1 1 18 9855 1 1 17 ARG HB3 H -0.504 4.897 5.086 1.00 . A A . 38 ARG HB3 1 1 18 9856 1 1 17 ARG HD2 H -2.796 4.036 7.565 1.00 . A A . 38 ARG HD2 1 1 18 9857 1 1 17 ARG HD3 H -2.692 5.527 8.479 1.00 . A A . 38 ARG HD3 1 1 18 9858 1 1 17 ARG HE H -4.488 6.494 7.127 1.00 . A A . 38 ARG HE 1 1 18 9859 1 1 17 ARG HG2 H -0.933 5.749 7.069 1.00 . A A . 38 ARG HG2 1 1 18 9860 1 1 17 ARG HG3 H -2.137 6.686 6.206 1.00 . A A . 38 ARG HG3 1 1 18 9861 1 1 17 ARG HH11 H -4.389 2.962 7.231 1.00 . A A . 38 ARG HH11 1 1 18 9862 1 1 17 ARG HH12 H -6.041 2.866 6.656 1.00 . A A . 38 ARG HH12 1 1 18 9863 1 1 17 ARG HH21 H -6.642 6.214 6.678 1.00 . A A . 38 ARG HH21 1 1 18 9864 1 1 17 ARG HH22 H -7.265 4.607 6.431 1.00 . A A . 38 ARG HH22 1 1 18 9865 1 1 17 ARG N N -3.723 4.817 4.025 1.00 . A A . 38 ARG N 1 1 18 9866 1 1 17 ARG NE N -4.297 5.504 7.149 1.00 . A A . 38 ARG NE 1 1 18 9867 1 1 17 ARG NH1 N -5.242 3.417 6.930 1.00 . A A . 38 ARG NH1 1 1 18 9868 1 1 17 ARG NH2 N -6.501 5.218 6.668 1.00 . A A . 38 ARG NH2 1 1 18 9869 1 1 17 ARG O O -0.703 5.305 2.200 1.00 . A A . 38 ARG O 1 1 18 9870 1 1 18 ALA C C -2.311 1.626 0.593 1.00 . A A . 39 ALA C 1 1 18 9871 1 1 18 ALA CA C -1.408 2.788 1.079 1.00 . A A . 39 ALA CA 1 1 18 9872 1 1 18 ALA CB C 0.011 2.253 1.327 1.00 . A A . 39 ALA CB 1 1 18 9873 1 1 18 ALA H H -2.588 2.886 2.848 1.00 . A A . 39 ALA H 1 1 18 9874 1 1 18 ALA HA H -1.377 3.553 0.305 1.00 . A A . 39 ALA HA 1 1 18 9875 1 1 18 ALA HB1 H 0.675 3.062 1.634 1.00 . A A . 39 ALA HB1 1 1 18 9876 1 1 18 ALA HB2 H -0.021 1.489 2.102 1.00 . A A . 39 ALA HB2 1 1 18 9877 1 1 18 ALA HB3 H 0.407 1.805 0.416 1.00 . A A . 39 ALA HB3 1 1 18 9878 1 1 18 ALA N N -1.895 3.397 2.323 1.00 . A A . 39 ALA N 1 1 18 9879 1 1 18 ALA O O -3.024 1.020 1.399 1.00 . A A . 39 ALA O 1 1 18 9880 1 1 19 PRO C C -1.697 -1.180 -0.705 1.00 . A A . 40 PRO C 1 1 18 9881 1 1 19 PRO CA C -2.674 -0.075 -1.162 1.00 . A A . 40 PRO CA 1 1 18 9882 1 1 19 PRO CB C -2.733 0.055 -2.689 1.00 . A A . 40 PRO CB 1 1 18 9883 1 1 19 PRO CD C -1.642 1.997 -1.797 1.00 . A A . 40 PRO CD 1 1 18 9884 1 1 19 PRO CG C -1.616 1.051 -2.996 1.00 . A A . 40 PRO CG 1 1 18 9885 1 1 19 PRO HA H -3.672 -0.306 -0.785 1.00 . A A . 40 PRO HA 1 1 18 9886 1 1 19 PRO HB2 H -2.580 -0.897 -3.202 1.00 . A A . 40 PRO HB2 1 1 18 9887 1 1 19 PRO HB3 H -3.692 0.486 -2.977 1.00 . A A . 40 PRO HB3 1 1 18 9888 1 1 19 PRO HD2 H -0.629 2.324 -1.564 1.00 . A A . 40 PRO HD2 1 1 18 9889 1 1 19 PRO HD3 H -2.271 2.860 -2.024 1.00 . A A . 40 PRO HD3 1 1 18 9890 1 1 19 PRO HG2 H -0.658 0.530 -3.030 1.00 . A A . 40 PRO HG2 1 1 18 9891 1 1 19 PRO HG3 H -1.793 1.582 -3.933 1.00 . A A . 40 PRO HG3 1 1 18 9892 1 1 19 PRO N N -2.240 1.245 -0.698 1.00 . A A . 40 PRO N 1 1 18 9893 1 1 19 PRO O O -0.608 -0.901 -0.200 1.00 . A A . 40 PRO O 1 1 18 9894 1 1 20 LYS C C 0.124 -3.767 -1.075 1.00 . A A . 41 LYS C 1 1 18 9895 1 1 20 LYS CA C -1.325 -3.681 -0.566 1.00 . A A . 41 LYS CA 1 1 18 9896 1 1 20 LYS CB C -2.175 -4.888 -1.015 1.00 . A A . 41 LYS CB 1 1 18 9897 1 1 20 LYS CD C -2.804 -7.312 -0.684 1.00 . A A . 41 LYS CD 1 1 18 9898 1 1 20 LYS CE C -2.547 -8.623 0.076 1.00 . A A . 41 LYS CE 1 1 18 9899 1 1 20 LYS CG C -1.813 -6.201 -0.306 1.00 . A A . 41 LYS CG 1 1 18 9900 1 1 20 LYS H H -2.975 -2.578 -1.364 1.00 . A A . 41 LYS H 1 1 18 9901 1 1 20 LYS HA H -1.251 -3.701 0.521 1.00 . A A . 41 LYS HA 1 1 18 9902 1 1 20 LYS HB2 H -3.222 -4.676 -0.797 1.00 . A A . 41 LYS HB2 1 1 18 9903 1 1 20 LYS HB3 H -2.079 -5.017 -2.095 1.00 . A A . 41 LYS HB3 1 1 18 9904 1 1 20 LYS HD2 H -3.814 -6.977 -0.441 1.00 . A A . 41 LYS HD2 1 1 18 9905 1 1 20 LYS HD3 H -2.760 -7.497 -1.760 1.00 . A A . 41 LYS HD3 1 1 18 9906 1 1 20 LYS HE2 H -2.530 -8.410 1.149 1.00 . A A . 41 LYS HE2 1 1 18 9907 1 1 20 LYS HE3 H -3.388 -9.297 -0.113 1.00 . A A . 41 LYS HE3 1 1 18 9908 1 1 20 LYS HG2 H -0.806 -6.505 -0.591 1.00 . A A . 41 LYS HG2 1 1 18 9909 1 1 20 LYS HG3 H -1.847 -6.045 0.775 1.00 . A A . 41 LYS HG3 1 1 18 9910 1 1 20 LYS HZ1 H -1.281 -9.497 -1.326 1.00 . A A . 41 LYS HZ1 1 1 18 9911 1 1 20 LYS HZ2 H -0.475 -8.708 -0.138 1.00 . A A . 41 LYS HZ2 1 1 18 9912 1 1 20 LYS HZ3 H -1.154 -10.159 0.157 1.00 . A A . 41 LYS HZ3 1 1 18 9913 1 1 20 LYS N N -2.061 -2.449 -0.938 1.00 . A A . 41 LYS N 1 1 18 9914 1 1 20 LYS NZ N -1.280 -9.285 -0.336 1.00 . A A . 41 LYS NZ 1 1 18 9915 1 1 20 LYS O O 0.911 -4.571 -0.573 1.00 . A A . 41 LYS O 1 1 18 9916 1 1 21 VAL C C 2.804 -2.254 -1.256 1.00 . A A . 42 VAL C 1 1 18 9917 1 1 21 VAL CA C 1.888 -2.632 -2.437 1.00 . A A . 42 VAL CA 1 1 18 9918 1 1 21 VAL CB C 1.890 -1.499 -3.490 1.00 . A A . 42 VAL CB 1 1 18 9919 1 1 21 VAL CG1 C 3.289 -1.185 -4.024 1.00 . A A . 42 VAL CG1 1 1 18 9920 1 1 21 VAL CG2 C 1.008 -1.846 -4.700 1.00 . A A . 42 VAL CG2 1 1 18 9921 1 1 21 VAL H H -0.220 -2.304 -2.382 1.00 . A A . 42 VAL H 1 1 18 9922 1 1 21 VAL HA H 2.298 -3.531 -2.899 1.00 . A A . 42 VAL HA 1 1 18 9923 1 1 21 VAL HB H 1.495 -0.593 -3.029 1.00 . A A . 42 VAL HB 1 1 18 9924 1 1 21 VAL HG11 H 3.739 -2.089 -4.438 1.00 . A A . 42 VAL HG11 1 1 18 9925 1 1 21 VAL HG12 H 3.232 -0.424 -4.803 1.00 . A A . 42 VAL HG12 1 1 18 9926 1 1 21 VAL HG13 H 3.920 -0.799 -3.226 1.00 . A A . 42 VAL HG13 1 1 18 9927 1 1 21 VAL HG21 H 1.354 -2.771 -5.162 1.00 . A A . 42 VAL HG21 1 1 18 9928 1 1 21 VAL HG22 H -0.034 -1.960 -4.403 1.00 . A A . 42 VAL HG22 1 1 18 9929 1 1 21 VAL HG23 H 1.056 -1.041 -5.436 1.00 . A A . 42 VAL HG23 1 1 18 9930 1 1 21 VAL N N 0.502 -2.902 -2.015 1.00 . A A . 42 VAL N 1 1 18 9931 1 1 21 VAL O O 3.977 -2.624 -1.255 1.00 . A A . 42 VAL O 1 1 18 9932 1 1 22 CYS C C 2.183 -0.888 2.147 1.00 . A A . 43 CYS C 1 1 18 9933 1 1 22 CYS CA C 3.033 -0.940 0.851 1.00 . A A . 43 CYS CA 1 1 18 9934 1 1 22 CYS CB C 3.497 0.440 0.342 1.00 . A A . 43 CYS CB 1 1 18 9935 1 1 22 CYS H H 1.287 -1.334 -0.288 1.00 . A A . 43 CYS H 1 1 18 9936 1 1 22 CYS HA H 3.918 -1.543 1.060 1.00 . A A . 43 CYS HA 1 1 18 9937 1 1 22 CYS HB2 H 3.927 0.318 -0.653 1.00 . A A . 43 CYS HB2 1 1 18 9938 1 1 22 CYS HB3 H 2.638 1.109 0.260 1.00 . A A . 43 CYS HB3 1 1 18 9939 1 1 22 CYS N N 2.278 -1.546 -0.250 1.00 . A A . 43 CYS N 1 1 18 9940 1 1 22 CYS O O 1.301 -1.720 2.369 1.00 . A A . 43 CYS O 1 1 18 9941 1 1 22 CYS SG S 4.757 1.167 1.424 1.00 . A A . 43 CYS SG 1 1 18 9942 1 1 23 PHE C C 1.636 1.987 4.413 1.00 . A A . 44 PHE C 1 1 18 9943 1 1 23 PHE CA C 1.698 0.458 4.199 1.00 . A A . 44 PHE CA 1 1 18 9944 1 1 23 PHE CB C 2.271 -0.241 5.442 1.00 . A A . 44 PHE CB 1 1 18 9945 1 1 23 PHE CD1 C 4.794 0.079 5.391 1.00 . A A . 44 PHE CD1 1 1 18 9946 1 1 23 PHE CD2 C 3.491 1.280 7.063 1.00 . A A . 44 PHE CD2 1 1 18 9947 1 1 23 PHE CE1 C 5.967 0.687 5.875 1.00 . A A . 44 PHE CE1 1 1 18 9948 1 1 23 PHE CE2 C 4.664 1.887 7.544 1.00 . A A . 44 PHE CE2 1 1 18 9949 1 1 23 PHE CG C 3.550 0.376 5.982 1.00 . A A . 44 PHE CG 1 1 18 9950 1 1 23 PHE CZ C 5.903 1.592 6.949 1.00 . A A . 44 PHE CZ 1 1 18 9951 1 1 23 PHE H H 3.271 0.643 2.761 1.00 . A A . 44 PHE H 1 1 18 9952 1 1 23 PHE HA H 0.672 0.116 4.061 1.00 . A A . 44 PHE HA 1 1 18 9953 1 1 23 PHE HB2 H 1.515 -0.202 6.228 1.00 . A A . 44 PHE HB2 1 1 18 9954 1 1 23 PHE HB3 H 2.444 -1.294 5.220 1.00 . A A . 44 PHE HB3 1 1 18 9955 1 1 23 PHE HD1 H 4.851 -0.613 4.562 1.00 . A A . 44 PHE HD1 1 1 18 9956 1 1 23 PHE HD2 H 2.540 1.519 7.519 1.00 . A A . 44 PHE HD2 1 1 18 9957 1 1 23 PHE HE1 H 6.922 0.456 5.422 1.00 . A A . 44 PHE HE1 1 1 18 9958 1 1 23 PHE HE2 H 4.614 2.583 8.373 1.00 . A A . 44 PHE HE2 1 1 18 9959 1 1 23 PHE HZ H 6.807 2.059 7.319 1.00 . A A . 44 PHE HZ 1 1 18 9960 1 1 23 PHE N N 2.474 0.079 3.016 1.00 . A A . 44 PHE N 1 1 18 9961 1 1 23 PHE O O 0.708 2.461 5.071 1.00 . A A . 44 PHE O 1 1 18 9962 1 1 24 LYS C C 3.429 4.940 2.883 1.00 . A A . 45 LYS C 1 1 18 9963 1 1 24 LYS CA C 2.652 4.232 4.002 1.00 . A A . 45 LYS CA 1 1 18 9964 1 1 24 LYS CB C 3.271 4.554 5.380 1.00 . A A . 45 LYS CB 1 1 18 9965 1 1 24 LYS CD C 3.832 6.299 7.115 1.00 . A A . 45 LYS CD 1 1 18 9966 1 1 24 LYS CE C 3.766 7.790 7.464 1.00 . A A . 45 LYS CE 1 1 18 9967 1 1 24 LYS CG C 3.228 6.050 5.726 1.00 . A A . 45 LYS CG 1 1 18 9968 1 1 24 LYS H H 3.317 2.303 3.330 1.00 . A A . 45 LYS H 1 1 18 9969 1 1 24 LYS HA H 1.637 4.634 3.977 1.00 . A A . 45 LYS HA 1 1 18 9970 1 1 24 LYS HB2 H 2.717 4.016 6.151 1.00 . A A . 45 LYS HB2 1 1 18 9971 1 1 24 LYS HB3 H 4.306 4.207 5.405 1.00 . A A . 45 LYS HB3 1 1 18 9972 1 1 24 LYS HD2 H 3.275 5.725 7.859 1.00 . A A . 45 LYS HD2 1 1 18 9973 1 1 24 LYS HD3 H 4.872 5.970 7.118 1.00 . A A . 45 LYS HD3 1 1 18 9974 1 1 24 LYS HE2 H 4.292 8.357 6.691 1.00 . A A . 45 LYS HE2 1 1 18 9975 1 1 24 LYS HE3 H 2.717 8.107 7.454 1.00 . A A . 45 LYS HE3 1 1 18 9976 1 1 24 LYS HG2 H 3.797 6.618 4.987 1.00 . A A . 45 LYS HG2 1 1 18 9977 1 1 24 LYS HG3 H 2.192 6.391 5.715 1.00 . A A . 45 LYS HG3 1 1 18 9978 1 1 24 LYS HZ1 H 3.888 7.562 9.529 1.00 . A A . 45 LYS HZ1 1 1 18 9979 1 1 24 LYS HZ2 H 5.343 7.804 8.820 1.00 . A A . 45 LYS HZ2 1 1 18 9980 1 1 24 LYS HZ3 H 4.312 9.053 9.021 1.00 . A A . 45 LYS HZ3 1 1 18 9981 1 1 24 LYS N N 2.587 2.762 3.858 1.00 . A A . 45 LYS N 1 1 18 9982 1 1 24 LYS NZ N 4.365 8.069 8.795 1.00 . A A . 45 LYS NZ 1 1 18 9983 1 1 24 LYS O O 2.889 5.858 2.264 1.00 . A A . 45 LYS O 1 1 18 9984 1 1 25 CYS C C 5.307 5.054 0.217 1.00 . A A . 46 CYS C 1 1 18 9985 1 1 25 CYS CA C 5.607 5.228 1.723 1.00 . A A . 46 CYS CA 1 1 18 9986 1 1 25 CYS CB C 7.053 4.845 2.101 1.00 . A A . 46 CYS CB 1 1 18 9987 1 1 25 CYS H H 5.072 3.795 3.180 1.00 . A A . 46 CYS H 1 1 18 9988 1 1 25 CYS HA H 5.515 6.298 1.917 1.00 . A A . 46 CYS HA 1 1 18 9989 1 1 25 CYS HB2 H 7.709 5.000 1.241 1.00 . A A . 46 CYS HB2 1 1 18 9990 1 1 25 CYS HB3 H 7.386 5.522 2.891 1.00 . A A . 46 CYS HB3 1 1 18 9991 1 1 25 CYS N N 4.676 4.538 2.623 1.00 . A A . 46 CYS N 1 1 18 9992 1 1 25 CYS O O 5.521 5.998 -0.548 1.00 . A A . 46 CYS O 1 1 18 9993 1 1 25 CYS SG S 7.218 3.142 2.712 1.00 . A A . 46 CYS SG 1 1 18 9994 1 1 26 LYS C C 4.809 4.100 -2.799 1.00 . A A . 47 LYS C 1 1 18 9995 1 1 26 LYS CA C 4.106 3.608 -1.508 1.00 . A A . 47 LYS CA 1 1 18 9996 1 1 26 LYS CB C 2.603 3.968 -1.432 1.00 . A A . 47 LYS CB 1 1 18 9997 1 1 26 LYS CD C 0.816 5.752 -1.093 1.00 . A A . 47 LYS CD 1 1 18 9998 1 1 26 LYS CE C 0.575 7.170 -0.555 1.00 . A A . 47 LYS CE 1 1 18 9999 1 1 26 LYS CG C 2.319 5.466 -1.230 1.00 . A A . 47 LYS CG 1 1 18 10000 1 1 26 LYS H H 4.652 3.192 0.516 1.00 . A A . 47 LYS H 1 1 18 10001 1 1 26 LYS HA H 4.133 2.524 -1.613 1.00 . A A . 47 LYS HA 1 1 18 10002 1 1 26 LYS HB2 H 2.101 3.629 -2.340 1.00 . A A . 47 LYS HB2 1 1 18 10003 1 1 26 LYS HB3 H 2.167 3.420 -0.595 1.00 . A A . 47 LYS HB3 1 1 18 10004 1 1 26 LYS HD2 H 0.352 5.654 -2.075 1.00 . A A . 47 LYS HD2 1 1 18 10005 1 1 26 LYS HD3 H 0.356 5.028 -0.420 1.00 . A A . 47 LYS HD3 1 1 18 10006 1 1 26 LYS HE2 H 1.207 7.872 -1.108 1.00 . A A . 47 LYS HE2 1 1 18 10007 1 1 26 LYS HE3 H -0.468 7.441 -0.740 1.00 . A A . 47 LYS HE3 1 1 18 10008 1 1 26 LYS HG2 H 2.813 5.801 -0.323 1.00 . A A . 47 LYS HG2 1 1 18 10009 1 1 26 LYS HG3 H 2.717 6.036 -2.069 1.00 . A A . 47 LYS HG3 1 1 18 10010 1 1 26 LYS HZ1 H 1.785 6.956 1.142 1.00 . A A . 47 LYS HZ1 1 1 18 10011 1 1 26 LYS HZ2 H 0.723 8.207 1.247 1.00 . A A . 47 LYS HZ2 1 1 18 10012 1 1 26 LYS HZ3 H 0.217 6.656 1.425 1.00 . A A . 47 LYS HZ3 1 1 18 10013 1 1 26 LYS N N 4.743 3.906 -0.197 1.00 . A A . 47 LYS N 1 1 18 10014 1 1 26 LYS NZ N 0.845 7.264 0.904 1.00 . A A . 47 LYS NZ 1 1 18 10015 1 1 26 LYS O O 4.152 4.288 -3.825 1.00 . A A . 47 LYS O 1 1 18 10016 1 1 27 GLN C C 6.977 3.612 -5.055 1.00 . A A . 48 GLN C 1 1 18 10017 1 1 27 GLN CA C 6.921 4.709 -3.956 1.00 . A A . 48 GLN CA 1 1 18 10018 1 1 27 GLN CB C 8.343 5.118 -3.522 1.00 . A A . 48 GLN CB 1 1 18 10019 1 1 27 GLN CD C 7.683 7.532 -3.007 1.00 . A A . 48 GLN CD 1 1 18 10020 1 1 27 GLN CG C 8.391 6.272 -2.508 1.00 . A A . 48 GLN CG 1 1 18 10021 1 1 27 GLN H H 6.612 4.141 -1.908 1.00 . A A . 48 GLN H 1 1 18 10022 1 1 27 GLN HA H 6.422 5.582 -4.374 1.00 . A A . 48 GLN HA 1 1 18 10023 1 1 27 GLN HB2 H 8.847 4.257 -3.087 1.00 . A A . 48 GLN HB2 1 1 18 10024 1 1 27 GLN HB3 H 8.909 5.418 -4.404 1.00 . A A . 48 GLN HB3 1 1 18 10025 1 1 27 GLN HE21 H 6.127 7.284 -1.736 1.00 . A A . 48 GLN HE21 1 1 18 10026 1 1 27 GLN HE22 H 6.065 8.698 -2.794 1.00 . A A . 48 GLN HE22 1 1 18 10027 1 1 27 GLN HG2 H 7.955 5.950 -1.563 1.00 . A A . 48 GLN HG2 1 1 18 10028 1 1 27 GLN HG3 H 9.433 6.520 -2.310 1.00 . A A . 48 GLN HG3 1 1 18 10029 1 1 27 GLN N N 6.133 4.289 -2.782 1.00 . A A . 48 GLN N 1 1 18 10030 1 1 27 GLN NE2 N 6.532 7.868 -2.465 1.00 . A A . 48 GLN NE2 1 1 18 10031 1 1 27 GLN O O 6.922 2.428 -4.707 1.00 . A A . 48 GLN O 1 1 18 10032 1 1 27 GLN OE1 O 8.144 8.226 -3.904 1.00 . A A . 48 GLN OE1 1 1 18 10033 1 1 28 PRO C C 7.695 1.713 -7.563 1.00 . A A . 49 PRO C 1 1 18 10034 1 1 28 PRO CA C 6.954 3.066 -7.512 1.00 . A A . 49 PRO CA 1 1 18 10035 1 1 28 PRO CB C 7.336 3.899 -8.740 1.00 . A A . 49 PRO CB 1 1 18 10036 1 1 28 PRO CD C 7.314 5.333 -6.839 1.00 . A A . 49 PRO CD 1 1 18 10037 1 1 28 PRO CG C 6.974 5.318 -8.325 1.00 . A A . 49 PRO CG 1 1 18 10038 1 1 28 PRO HA H 5.887 2.846 -7.577 1.00 . A A . 49 PRO HA 1 1 18 10039 1 1 28 PRO HB2 H 8.412 3.839 -8.914 1.00 . A A . 49 PRO HB2 1 1 18 10040 1 1 28 PRO HB3 H 6.787 3.588 -9.629 1.00 . A A . 49 PRO HB3 1 1 18 10041 1 1 28 PRO HD2 H 8.354 5.630 -6.708 1.00 . A A . 49 PRO HD2 1 1 18 10042 1 1 28 PRO HD3 H 6.657 6.044 -6.339 1.00 . A A . 49 PRO HD3 1 1 18 10043 1 1 28 PRO HG2 H 7.545 6.062 -8.880 1.00 . A A . 49 PRO HG2 1 1 18 10044 1 1 28 PRO HG3 H 5.902 5.475 -8.459 1.00 . A A . 49 PRO HG3 1 1 18 10045 1 1 28 PRO N N 7.136 3.963 -6.354 1.00 . A A . 49 PRO N 1 1 18 10046 1 1 28 PRO O O 7.280 0.841 -8.329 1.00 . A A . 49 PRO O 1 1 18 10047 1 1 29 GLY C C 10.291 -0.081 -5.484 1.00 . A A . 50 GLY C 1 1 18 10048 1 1 29 GLY CA C 9.542 0.252 -6.784 1.00 . A A . 50 GLY CA 1 1 18 10049 1 1 29 GLY H H 9.108 2.295 -6.253 1.00 . A A . 50 GLY H 1 1 18 10050 1 1 29 GLY HA2 H 10.277 0.293 -7.589 1.00 . A A . 50 GLY HA2 1 1 18 10051 1 1 29 GLY HA3 H 8.872 -0.583 -6.986 1.00 . A A . 50 GLY HA3 1 1 18 10052 1 1 29 GLY N N 8.772 1.513 -6.792 1.00 . A A . 50 GLY N 1 1 18 10053 1 1 29 GLY O O 10.964 -1.110 -5.413 1.00 . A A . 50 GLY O 1 1 18 10054 1 1 30 HIS C C 10.468 -0.682 -2.382 1.00 . A A . 51 HIS C 1 1 18 10055 1 1 30 HIS CA C 10.880 0.588 -3.161 1.00 . A A . 51 HIS CA 1 1 18 10056 1 1 30 HIS CB C 10.617 1.834 -2.296 1.00 . A A . 51 HIS CB 1 1 18 10057 1 1 30 HIS CD2 C 9.118 1.564 -0.242 1.00 . A A . 51 HIS CD2 1 1 18 10058 1 1 30 HIS CE1 C 7.138 1.476 -1.186 1.00 . A A . 51 HIS CE1 1 1 18 10059 1 1 30 HIS CG C 9.283 1.797 -1.580 1.00 . A A . 51 HIS CG 1 1 18 10060 1 1 30 HIS H H 9.621 1.586 -4.568 1.00 . A A . 51 HIS H 1 1 18 10061 1 1 30 HIS HA H 11.951 0.524 -3.357 1.00 . A A . 51 HIS HA 1 1 18 10062 1 1 30 HIS HB2 H 11.404 1.891 -1.540 1.00 . A A . 51 HIS HB2 1 1 18 10063 1 1 30 HIS HB3 H 10.688 2.737 -2.904 1.00 . A A . 51 HIS HB3 1 1 18 10064 1 1 30 HIS HD1 H 7.788 1.883 -3.133 1.00 . A A . 51 HIS HD1 1 1 18 10065 1 1 30 HIS HD2 H 9.916 1.467 0.481 1.00 . A A . 51 HIS HD2 1 1 18 10066 1 1 30 HIS HE1 H 6.075 1.348 -1.341 1.00 . A A . 51 HIS HE1 1 1 18 10067 1 1 30 HIS N N 10.182 0.759 -4.448 1.00 . A A . 51 HIS N 1 1 18 10068 1 1 30 HIS ND1 N 8.028 1.750 -2.152 1.00 . A A . 51 HIS ND1 1 1 18 10069 1 1 30 HIS NE2 N 7.756 1.360 -0.001 1.00 . A A . 51 HIS NE2 1 1 18 10070 1 1 30 HIS O O 11.238 -1.215 -1.582 1.00 . A A . 51 HIS O 1 1 18 10071 1 1 31 PHE C C 9.259 -3.478 -1.690 1.00 . A A . 52 PHE C 1 1 18 10072 1 1 31 PHE CA C 8.561 -2.114 -1.710 1.00 . A A . 52 PHE CA 1 1 18 10073 1 1 31 PHE CB C 7.082 -2.224 -2.114 1.00 . A A . 52 PHE CB 1 1 18 10074 1 1 31 PHE CD1 C 6.808 -3.574 -4.252 1.00 . A A . 52 PHE CD1 1 1 18 10075 1 1 31 PHE CD2 C 6.553 -1.154 -4.352 1.00 . A A . 52 PHE CD2 1 1 18 10076 1 1 31 PHE CE1 C 6.566 -3.654 -5.636 1.00 . A A . 52 PHE CE1 1 1 18 10077 1 1 31 PHE CE2 C 6.301 -1.238 -5.732 1.00 . A A . 52 PHE CE2 1 1 18 10078 1 1 31 PHE CG C 6.809 -2.323 -3.606 1.00 . A A . 52 PHE CG 1 1 18 10079 1 1 31 PHE CZ C 6.315 -2.485 -6.376 1.00 . A A . 52 PHE CZ 1 1 18 10080 1 1 31 PHE H H 8.665 -0.676 -3.271 1.00 . A A . 52 PHE H 1 1 18 10081 1 1 31 PHE HA H 8.590 -1.733 -0.688 1.00 . A A . 52 PHE HA 1 1 18 10082 1 1 31 PHE HB2 H 6.650 -3.089 -1.619 1.00 . A A . 52 PHE HB2 1 1 18 10083 1 1 31 PHE HB3 H 6.559 -1.348 -1.729 1.00 . A A . 52 PHE HB3 1 1 18 10084 1 1 31 PHE HD1 H 6.996 -4.477 -3.690 1.00 . A A . 52 PHE HD1 1 1 18 10085 1 1 31 PHE HD2 H 6.524 -0.191 -3.865 1.00 . A A . 52 PHE HD2 1 1 18 10086 1 1 31 PHE HE1 H 6.575 -4.616 -6.130 1.00 . A A . 52 PHE HE1 1 1 18 10087 1 1 31 PHE HE2 H 6.084 -0.341 -6.294 1.00 . A A . 52 PHE HE2 1 1 18 10088 1 1 31 PHE HZ H 6.122 -2.548 -7.439 1.00 . A A . 52 PHE HZ 1 1 18 10089 1 1 31 PHE N N 9.228 -1.141 -2.577 1.00 . A A . 52 PHE N 1 1 18 10090 1 1 31 PHE O O 9.447 -4.041 -0.612 1.00 . A A . 52 PHE O 1 1 18 10091 1 1 32 SER C C 11.800 -5.317 -2.229 1.00 . A A . 53 SER C 1 1 18 10092 1 1 32 SER CA C 10.462 -5.237 -2.989 1.00 . A A . 53 SER CA 1 1 18 10093 1 1 32 SER CB C 10.718 -5.514 -4.477 1.00 . A A . 53 SER CB 1 1 18 10094 1 1 32 SER H H 9.529 -3.451 -3.686 1.00 . A A . 53 SER H 1 1 18 10095 1 1 32 SER HA H 9.829 -6.037 -2.604 1.00 . A A . 53 SER HA 1 1 18 10096 1 1 32 SER HB2 H 11.383 -4.745 -4.878 1.00 . A A . 53 SER HB2 1 1 18 10097 1 1 32 SER HB3 H 11.200 -6.488 -4.587 1.00 . A A . 53 SER HB3 1 1 18 10098 1 1 32 SER HG H 9.697 -5.715 -6.138 1.00 . A A . 53 SER HG 1 1 18 10099 1 1 32 SER N N 9.737 -3.962 -2.839 1.00 . A A . 53 SER N 1 1 18 10100 1 1 32 SER O O 12.411 -6.388 -2.177 1.00 . A A . 53 SER O 1 1 18 10101 1 1 32 SER OG O 9.499 -5.513 -5.203 1.00 . A A . 53 SER OG 1 1 18 10102 1 1 33 LYS C C 13.325 -3.318 0.472 1.00 . A A . 54 LYS C 1 1 18 10103 1 1 33 LYS CA C 13.501 -4.080 -0.857 1.00 . A A . 54 LYS CA 1 1 18 10104 1 1 33 LYS CB C 14.610 -3.480 -1.747 1.00 . A A . 54 LYS CB 1 1 18 10105 1 1 33 LYS CD C 15.480 -1.376 -2.931 1.00 . A A . 54 LYS CD 1 1 18 10106 1 1 33 LYS CE C 16.482 -0.900 -1.868 1.00 . A A . 54 LYS CE 1 1 18 10107 1 1 33 LYS CG C 14.277 -2.072 -2.281 1.00 . A A . 54 LYS CG 1 1 18 10108 1 1 33 LYS H H 11.711 -3.359 -1.767 1.00 . A A . 54 LYS H 1 1 18 10109 1 1 33 LYS HA H 13.822 -5.081 -0.563 1.00 . A A . 54 LYS HA 1 1 18 10110 1 1 33 LYS HB2 H 15.537 -3.448 -1.174 1.00 . A A . 54 LYS HB2 1 1 18 10111 1 1 33 LYS HB3 H 14.778 -4.144 -2.597 1.00 . A A . 54 LYS HB3 1 1 18 10112 1 1 33 LYS HD2 H 15.966 -2.059 -3.629 1.00 . A A . 54 LYS HD2 1 1 18 10113 1 1 33 LYS HD3 H 15.116 -0.509 -3.487 1.00 . A A . 54 LYS HD3 1 1 18 10114 1 1 33 LYS HE2 H 15.960 -0.241 -1.168 1.00 . A A . 54 LYS HE2 1 1 18 10115 1 1 33 LYS HE3 H 16.843 -1.765 -1.305 1.00 . A A . 54 LYS HE3 1 1 18 10116 1 1 33 LYS HG2 H 13.488 -2.161 -3.029 1.00 . A A . 54 LYS HG2 1 1 18 10117 1 1 33 LYS HG3 H 13.910 -1.443 -1.470 1.00 . A A . 54 LYS HG3 1 1 18 10118 1 1 33 LYS HZ1 H 17.321 0.630 -3.001 1.00 . A A . 54 LYS HZ1 1 1 18 10119 1 1 33 LYS HZ2 H 18.273 0.144 -1.769 1.00 . A A . 54 LYS HZ2 1 1 18 10120 1 1 33 LYS HZ3 H 18.146 -0.777 -3.109 1.00 . A A . 54 LYS HZ3 1 1 18 10121 1 1 33 LYS N N 12.257 -4.203 -1.638 1.00 . A A . 54 LYS N 1 1 18 10122 1 1 33 LYS NZ N 17.630 -0.179 -2.479 1.00 . A A . 54 LYS NZ 1 1 18 10123 1 1 33 LYS O O 14.321 -2.903 1.069 1.00 . A A . 54 LYS O 1 1 18 10124 1 1 34 GLN C C 10.526 -2.986 2.929 1.00 . A A . 55 GLN C 1 1 18 10125 1 1 34 GLN CA C 11.801 -2.473 2.229 1.00 . A A . 55 GLN CA 1 1 18 10126 1 1 34 GLN CB C 11.705 -0.951 2.005 1.00 . A A . 55 GLN CB 1 1 18 10127 1 1 34 GLN CD C 11.437 1.305 3.134 1.00 . A A . 55 GLN CD 1 1 18 10128 1 1 34 GLN CG C 11.742 -0.177 3.332 1.00 . A A . 55 GLN CG 1 1 18 10129 1 1 34 GLN H H 11.324 -3.542 0.424 1.00 . A A . 55 GLN H 1 1 18 10130 1 1 34 GLN HA H 12.635 -2.663 2.908 1.00 . A A . 55 GLN HA 1 1 18 10131 1 1 34 GLN HB2 H 12.542 -0.616 1.391 1.00 . A A . 55 GLN HB2 1 1 18 10132 1 1 34 GLN HB3 H 10.780 -0.723 1.471 1.00 . A A . 55 GLN HB3 1 1 18 10133 1 1 34 GLN HE21 H 9.467 1.003 3.434 1.00 . A A . 55 GLN HE21 1 1 18 10134 1 1 34 GLN HE22 H 9.952 2.665 3.132 1.00 . A A . 55 GLN HE22 1 1 18 10135 1 1 34 GLN HG2 H 11.007 -0.585 4.025 1.00 . A A . 55 GLN HG2 1 1 18 10136 1 1 34 GLN HG3 H 12.728 -0.283 3.785 1.00 . A A . 55 GLN HG3 1 1 18 10137 1 1 34 GLN N N 12.085 -3.128 0.942 1.00 . A A . 55 GLN N 1 1 18 10138 1 1 34 GLN NE2 N 10.187 1.692 3.254 1.00 . A A . 55 GLN NE2 1 1 18 10139 1 1 34 GLN O O 10.570 -3.271 4.129 1.00 . A A . 55 GLN O 1 1 18 10140 1 1 34 GLN OE1 O 12.305 2.126 2.869 1.00 . A A . 55 GLN OE1 1 1 18 10141 1 1 35 CYS C C 7.428 -4.659 2.460 1.00 . A A . 56 CYS C 1 1 18 10142 1 1 35 CYS CA C 8.067 -3.289 2.773 1.00 . A A . 56 CYS CA 1 1 18 10143 1 1 35 CYS CB C 7.179 -2.133 2.276 1.00 . A A . 56 CYS CB 1 1 18 10144 1 1 35 CYS H H 9.464 -2.886 1.220 1.00 . A A . 56 CYS H 1 1 18 10145 1 1 35 CYS HA H 8.123 -3.207 3.860 1.00 . A A . 56 CYS HA 1 1 18 10146 1 1 35 CYS HB2 H 7.089 -2.176 1.188 1.00 . A A . 56 CYS HB2 1 1 18 10147 1 1 35 CYS HB3 H 6.179 -2.248 2.701 1.00 . A A . 56 CYS HB3 1 1 18 10148 1 1 35 CYS N N 9.412 -3.121 2.198 1.00 . A A . 56 CYS N 1 1 18 10149 1 1 35 CYS O O 6.571 -5.126 3.216 1.00 . A A . 56 CYS O 1 1 18 10150 1 1 35 CYS SG S 7.862 -0.528 2.783 1.00 . A A . 56 CYS SG 1 1 18 10151 1 1 36 ARG C C 8.531 -7.622 0.652 1.00 . A A . 57 ARG C 1 1 18 10152 1 1 36 ARG CA C 7.377 -6.610 0.849 1.00 . A A . 57 ARG CA 1 1 18 10153 1 1 36 ARG CB C 6.628 -6.384 -0.486 1.00 . A A . 57 ARG CB 1 1 18 10154 1 1 36 ARG CD C 4.194 -5.968 0.322 1.00 . A A . 57 ARG CD 1 1 18 10155 1 1 36 ARG CG C 5.402 -5.452 -0.472 1.00 . A A . 57 ARG CG 1 1 18 10156 1 1 36 ARG CZ C 3.423 -4.686 2.343 1.00 . A A . 57 ARG CZ 1 1 18 10157 1 1 36 ARG H H 8.549 -4.828 0.810 1.00 . A A . 57 ARG H 1 1 18 10158 1 1 36 ARG HA H 6.698 -7.072 1.566 1.00 . A A . 57 ARG HA 1 1 18 10159 1 1 36 ARG HB2 H 7.339 -5.981 -1.208 1.00 . A A . 57 ARG HB2 1 1 18 10160 1 1 36 ARG HB3 H 6.293 -7.349 -0.873 1.00 . A A . 57 ARG HB3 1 1 18 10161 1 1 36 ARG HD2 H 3.291 -5.596 -0.162 1.00 . A A . 57 ARG HD2 1 1 18 10162 1 1 36 ARG HD3 H 4.166 -7.058 0.284 1.00 . A A . 57 ARG HD3 1 1 18 10163 1 1 36 ARG HE H 5.089 -5.724 2.237 1.00 . A A . 57 ARG HE 1 1 18 10164 1 1 36 ARG HG2 H 5.687 -4.469 -0.099 1.00 . A A . 57 ARG HG2 1 1 18 10165 1 1 36 ARG HG3 H 5.083 -5.327 -1.508 1.00 . A A . 57 ARG HG3 1 1 18 10166 1 1 36 ARG HH11 H 2.002 -4.630 0.931 1.00 . A A . 57 ARG HH11 1 1 18 10167 1 1 36 ARG HH12 H 1.774 -3.537 2.268 1.00 . A A . 57 ARG HH12 1 1 18 10168 1 1 36 ARG HH21 H 4.659 -4.474 3.892 1.00 . A A . 57 ARG HH21 1 1 18 10169 1 1 36 ARG HH22 H 3.129 -3.628 4.022 1.00 . A A . 57 ARG HH22 1 1 18 10170 1 1 36 ARG N N 7.857 -5.312 1.373 1.00 . A A . 57 ARG N 1 1 18 10171 1 1 36 ARG NE N 4.244 -5.510 1.722 1.00 . A A . 57 ARG NE 1 1 18 10172 1 1 36 ARG NH1 N 2.290 -4.298 1.843 1.00 . A A . 57 ARG NH1 1 1 18 10173 1 1 36 ARG NH2 N 3.759 -4.217 3.509 1.00 . A A . 57 ARG NH2 1 1 18 10174 1 1 36 ARG O O 8.340 -8.649 -0.002 1.00 . A A . 57 ARG O 1 1 18 10175 1 1 37 SER C C 10.820 -9.594 1.358 1.00 . A A . 58 SER C 1 1 18 10176 1 1 37 SER CA C 10.978 -8.087 1.101 1.00 . A A . 58 SER CA 1 1 18 10177 1 1 37 SER CB C 12.009 -7.517 2.078 1.00 . A A . 58 SER CB 1 1 18 10178 1 1 37 SER H H 9.775 -6.444 1.695 1.00 . A A . 58 SER H 1 1 18 10179 1 1 37 SER HA H 11.379 -7.975 0.095 1.00 . A A . 58 SER HA 1 1 18 10180 1 1 37 SER HB2 H 11.673 -7.691 3.104 1.00 . A A . 58 SER HB2 1 1 18 10181 1 1 37 SER HB3 H 12.962 -8.032 1.934 1.00 . A A . 58 SER HB3 1 1 18 10182 1 1 37 SER HG H 12.830 -5.787 2.494 1.00 . A A . 58 SER HG 1 1 18 10183 1 1 37 SER N N 9.720 -7.315 1.191 1.00 . A A . 58 SER N 1 1 18 10184 1 1 37 SER O O 11.325 -10.391 0.533 1.00 . A A . 58 SER O 1 1 18 10185 1 1 37 SER OXT O 10.232 -9.977 2.395 1.00 . A A . 58 SER OXT 1 1 18 10186 1 1 37 SER OG O 12.171 -6.124 1.855 1.00 . A A . 58 SER OG 1 1 18 10187 2 2 1 ZN ZN ZN -8.208 0.590 3.793 1.00 . B A . 1059 ZN ZN 1 1 18 10188 3 2 1 ZN ZN ZN 6.884 1.170 1.859 1.00 . C A . 1060 ZN ZN 1 1 19 10189 1 1 1 GLN C C -6.227 -1.425 -4.476 1.00 . A A . 22 GLN C 1 1 19 10190 1 1 1 GLN CA C -5.984 -0.925 -5.898 1.00 . A A . 22 GLN CA 1 1 19 10191 1 1 1 GLN CB C -4.606 -0.233 -5.979 1.00 . A A . 22 GLN CB 1 1 19 10192 1 1 1 GLN CD C -2.745 0.670 -7.457 1.00 . A A . 22 GLN CD 1 1 19 10193 1 1 1 GLN CG C -4.152 0.071 -7.417 1.00 . A A . 22 GLN CG 1 1 19 10194 1 1 1 GLN H1 H -7.984 -0.495 -6.202 1.00 . A A . 22 GLN H1 1 1 19 10195 1 1 1 GLN H2 H -7.112 0.793 -5.697 1.00 . A A . 22 GLN H2 1 1 19 10196 1 1 1 GLN H3 H -6.989 0.280 -7.257 1.00 . A A . 22 GLN H3 1 1 19 10197 1 1 1 GLN HA H -5.972 -1.792 -6.561 1.00 . A A . 22 GLN HA 1 1 19 10198 1 1 1 GLN HB2 H -4.630 0.694 -5.404 1.00 . A A . 22 GLN HB2 1 1 19 10199 1 1 1 GLN HB3 H -3.862 -0.892 -5.528 1.00 . A A . 22 GLN HB3 1 1 19 10200 1 1 1 GLN HE21 H -2.134 -0.542 -8.961 1.00 . A A . 22 GLN HE21 1 1 19 10201 1 1 1 GLN HE22 H -0.953 0.606 -8.340 1.00 . A A . 22 GLN HE22 1 1 19 10202 1 1 1 GLN HG2 H -4.165 -0.856 -7.995 1.00 . A A . 22 GLN HG2 1 1 19 10203 1 1 1 GLN HG3 H -4.836 0.778 -7.888 1.00 . A A . 22 GLN HG3 1 1 19 10204 1 1 1 GLN N N -7.093 -0.022 -6.299 1.00 . A A . 22 GLN N 1 1 19 10205 1 1 1 GLN NE2 N -1.876 0.199 -8.324 1.00 . A A . 22 GLN NE2 1 1 19 10206 1 1 1 GLN O O -6.366 -0.611 -3.569 1.00 . A A . 22 GLN O 1 1 19 10207 1 1 1 GLN OE1 O -2.394 1.571 -6.709 1.00 . A A . 22 GLN OE1 1 1 19 10208 1 1 2 THR C C -5.872 -2.849 -1.786 1.00 . A A . 23 THR C 1 1 19 10209 1 1 2 THR CA C -6.677 -3.376 -2.982 1.00 . A A . 23 THR CA 1 1 19 10210 1 1 2 THR CB C -6.529 -4.904 -3.081 1.00 . A A . 23 THR CB 1 1 19 10211 1 1 2 THR CG2 C -7.175 -5.647 -1.911 1.00 . A A . 23 THR CG2 1 1 19 10212 1 1 2 THR H H -6.200 -3.374 -5.053 1.00 . A A . 23 THR H 1 1 19 10213 1 1 2 THR HA H -7.724 -3.158 -2.797 1.00 . A A . 23 THR HA 1 1 19 10214 1 1 2 THR HB H -5.471 -5.163 -3.136 1.00 . A A . 23 THR HB 1 1 19 10215 1 1 2 THR HG1 H -6.978 -6.304 -4.357 1.00 . A A . 23 THR HG1 1 1 19 10216 1 1 2 THR HG21 H -8.232 -5.394 -1.846 1.00 . A A . 23 THR HG21 1 1 19 10217 1 1 2 THR HG22 H -7.075 -6.723 -2.060 1.00 . A A . 23 THR HG22 1 1 19 10218 1 1 2 THR HG23 H -6.677 -5.387 -0.977 1.00 . A A . 23 THR HG23 1 1 19 10219 1 1 2 THR N N -6.309 -2.743 -4.268 1.00 . A A . 23 THR N 1 1 19 10220 1 1 2 THR O O -4.652 -2.712 -1.871 1.00 . A A . 23 THR O 1 1 19 10221 1 1 2 THR OG1 O -7.174 -5.354 -4.255 1.00 . A A . 23 THR OG1 1 1 19 10222 1 1 3 CYS C C -4.857 -2.872 1.175 1.00 . A A . 24 CYS C 1 1 19 10223 1 1 3 CYS CA C -5.987 -2.018 0.561 1.00 . A A . 24 CYS CA 1 1 19 10224 1 1 3 CYS CB C -7.138 -1.890 1.561 1.00 . A A . 24 CYS CB 1 1 19 10225 1 1 3 CYS H H -7.561 -2.667 -0.709 1.00 . A A . 24 CYS H 1 1 19 10226 1 1 3 CYS HA H -5.600 -1.021 0.345 1.00 . A A . 24 CYS HA 1 1 19 10227 1 1 3 CYS HB2 H -8.005 -1.462 1.067 1.00 . A A . 24 CYS HB2 1 1 19 10228 1 1 3 CYS HB3 H -7.409 -2.884 1.920 1.00 . A A . 24 CYS HB3 1 1 19 10229 1 1 3 CYS N N -6.556 -2.564 -0.675 1.00 . A A . 24 CYS N 1 1 19 10230 1 1 3 CYS O O -4.883 -4.104 1.107 1.00 . A A . 24 CYS O 1 1 19 10231 1 1 3 CYS SG S -6.642 -0.833 2.945 1.00 . A A . 24 CYS SG 1 1 19 10232 1 1 4 TYR C C -3.577 -3.522 4.022 1.00 . A A . 25 TYR C 1 1 19 10233 1 1 4 TYR CA C -2.953 -2.874 2.765 1.00 . A A . 25 TYR CA 1 1 19 10234 1 1 4 TYR CB C -1.849 -1.880 3.169 1.00 . A A . 25 TYR CB 1 1 19 10235 1 1 4 TYR CD1 C -3.245 -0.135 4.405 1.00 . A A . 25 TYR CD1 1 1 19 10236 1 1 4 TYR CD2 C -1.293 -1.081 5.513 1.00 . A A . 25 TYR CD2 1 1 19 10237 1 1 4 TYR CE1 C -3.516 0.639 5.548 1.00 . A A . 25 TYR CE1 1 1 19 10238 1 1 4 TYR CE2 C -1.552 -0.292 6.652 1.00 . A A . 25 TYR CE2 1 1 19 10239 1 1 4 TYR CG C -2.134 -1.005 4.384 1.00 . A A . 25 TYR CG 1 1 19 10240 1 1 4 TYR CZ C -2.669 0.571 6.671 1.00 . A A . 25 TYR CZ 1 1 19 10241 1 1 4 TYR H H -3.975 -1.207 1.894 1.00 . A A . 25 TYR H 1 1 19 10242 1 1 4 TYR HA H -2.486 -3.681 2.204 1.00 . A A . 25 TYR HA 1 1 19 10243 1 1 4 TYR HB2 H -0.960 -2.474 3.386 1.00 . A A . 25 TYR HB2 1 1 19 10244 1 1 4 TYR HB3 H -1.600 -1.241 2.324 1.00 . A A . 25 TYR HB3 1 1 19 10245 1 1 4 TYR HD1 H -3.905 -0.067 3.554 1.00 . A A . 25 TYR HD1 1 1 19 10246 1 1 4 TYR HD2 H -0.442 -1.751 5.509 1.00 . A A . 25 TYR HD2 1 1 19 10247 1 1 4 TYR HE1 H -4.385 1.274 5.574 1.00 . A A . 25 TYR HE1 1 1 19 10248 1 1 4 TYR HE2 H -0.902 -0.352 7.513 1.00 . A A . 25 TYR HE2 1 1 19 10249 1 1 4 TYR HH H -2.310 1.171 8.488 1.00 . A A . 25 TYR HH 1 1 19 10250 1 1 4 TYR N N -3.922 -2.218 1.874 1.00 . A A . 25 TYR N 1 1 19 10251 1 1 4 TYR O O -2.917 -4.321 4.690 1.00 . A A . 25 TYR O 1 1 19 10252 1 1 4 TYR OH O -2.947 1.328 7.769 1.00 . A A . 25 TYR OH 1 1 19 10253 1 1 5 ASN C C -6.936 -4.066 5.401 1.00 . A A . 26 ASN C 1 1 19 10254 1 1 5 ASN CA C -5.499 -3.545 5.604 1.00 . A A . 26 ASN CA 1 1 19 10255 1 1 5 ASN CB C -5.487 -2.284 6.492 1.00 . A A . 26 ASN CB 1 1 19 10256 1 1 5 ASN CG C -6.275 -2.462 7.780 1.00 . A A . 26 ASN CG 1 1 19 10257 1 1 5 ASN H H -5.294 -2.514 3.748 1.00 . A A . 26 ASN H 1 1 19 10258 1 1 5 ASN HA H -4.943 -4.334 6.117 1.00 . A A . 26 ASN HA 1 1 19 10259 1 1 5 ASN HB2 H -4.457 -2.038 6.750 1.00 . A A . 26 ASN HB2 1 1 19 10260 1 1 5 ASN HB3 H -5.902 -1.439 5.942 1.00 . A A . 26 ASN HB3 1 1 19 10261 1 1 5 ASN HD21 H -7.962 -1.649 6.988 1.00 . A A . 26 ASN HD21 1 1 19 10262 1 1 5 ASN HD22 H -8.046 -2.169 8.665 1.00 . A A . 26 ASN HD22 1 1 19 10263 1 1 5 ASN N N -4.834 -3.190 4.346 1.00 . A A . 26 ASN N 1 1 19 10264 1 1 5 ASN ND2 N -7.523 -2.046 7.811 1.00 . A A . 26 ASN ND2 1 1 19 10265 1 1 5 ASN O O -7.303 -5.104 5.955 1.00 . A A . 26 ASN O 1 1 19 10266 1 1 5 ASN OD1 O -5.781 -2.984 8.770 1.00 . A A . 26 ASN OD1 1 1 19 10267 1 1 6 CYS C C -9.604 -4.676 3.528 1.00 . A A . 27 CYS C 1 1 19 10268 1 1 6 CYS CA C -9.190 -3.548 4.504 1.00 . A A . 27 CYS CA 1 1 19 10269 1 1 6 CYS CB C -9.812 -2.202 4.093 1.00 . A A . 27 CYS CB 1 1 19 10270 1 1 6 CYS H H -7.375 -2.502 4.202 1.00 . A A . 27 CYS H 1 1 19 10271 1 1 6 CYS HA H -9.576 -3.808 5.491 1.00 . A A . 27 CYS HA 1 1 19 10272 1 1 6 CYS HB2 H -9.521 -1.973 3.067 1.00 . A A . 27 CYS HB2 1 1 19 10273 1 1 6 CYS HB3 H -10.902 -2.296 4.123 1.00 . A A . 27 CYS HB3 1 1 19 10274 1 1 6 CYS N N -7.741 -3.352 4.612 1.00 . A A . 27 CYS N 1 1 19 10275 1 1 6 CYS O O -10.773 -5.067 3.499 1.00 . A A . 27 CYS O 1 1 19 10276 1 1 6 CYS SG S -9.289 -0.863 5.210 1.00 . A A . 27 CYS SG 1 1 19 10277 1 1 7 GLY C C -9.920 -5.936 0.629 1.00 . A A . 28 GLY C 1 1 19 10278 1 1 7 GLY CA C -8.899 -6.259 1.735 1.00 . A A . 28 GLY CA 1 1 19 10279 1 1 7 GLY H H -7.724 -4.846 2.828 1.00 . A A . 28 GLY H 1 1 19 10280 1 1 7 GLY HA2 H -9.235 -7.152 2.260 1.00 . A A . 28 GLY HA2 1 1 19 10281 1 1 7 GLY HA3 H -7.951 -6.490 1.248 1.00 . A A . 28 GLY HA3 1 1 19 10282 1 1 7 GLY N N -8.668 -5.186 2.715 1.00 . A A . 28 GLY N 1 1 19 10283 1 1 7 GLY O O -10.512 -6.857 0.061 1.00 . A A . 28 GLY O 1 1 19 10284 1 1 8 LYS C C -10.573 -3.475 -1.827 1.00 . A A . 29 LYS C 1 1 19 10285 1 1 8 LYS CA C -11.193 -4.154 -0.587 1.00 . A A . 29 LYS CA 1 1 19 10286 1 1 8 LYS CB C -12.111 -3.205 0.208 1.00 . A A . 29 LYS CB 1 1 19 10287 1 1 8 LYS CD C -14.214 -1.800 0.235 1.00 . A A . 29 LYS CD 1 1 19 10288 1 1 8 LYS CE C -15.502 -1.387 -0.493 1.00 . A A . 29 LYS CE 1 1 19 10289 1 1 8 LYS CG C -13.356 -2.777 -0.586 1.00 . A A . 29 LYS CG 1 1 19 10290 1 1 8 LYS H H -9.605 -3.960 0.835 1.00 . A A . 29 LYS H 1 1 19 10291 1 1 8 LYS HA H -11.810 -4.994 -0.896 1.00 . A A . 29 LYS HA 1 1 19 10292 1 1 8 LYS HB2 H -12.442 -3.718 1.115 1.00 . A A . 29 LYS HB2 1 1 19 10293 1 1 8 LYS HB3 H -11.549 -2.324 0.510 1.00 . A A . 29 LYS HB3 1 1 19 10294 1 1 8 LYS HD2 H -14.468 -2.244 1.199 1.00 . A A . 29 LYS HD2 1 1 19 10295 1 1 8 LYS HD3 H -13.628 -0.898 0.424 1.00 . A A . 29 LYS HD3 1 1 19 10296 1 1 8 LYS HE2 H -15.930 -0.527 0.031 1.00 . A A . 29 LYS HE2 1 1 19 10297 1 1 8 LYS HE3 H -15.250 -1.061 -1.506 1.00 . A A . 29 LYS HE3 1 1 19 10298 1 1 8 LYS HG2 H -13.055 -2.286 -1.511 1.00 . A A . 29 LYS HG2 1 1 19 10299 1 1 8 LYS HG3 H -13.939 -3.665 -0.829 1.00 . A A . 29 LYS HG3 1 1 19 10300 1 1 8 LYS HZ1 H -16.760 -2.787 0.393 1.00 . A A . 29 LYS HZ1 1 1 19 10301 1 1 8 LYS HZ2 H -17.355 -2.180 -0.996 1.00 . A A . 29 LYS HZ2 1 1 19 10302 1 1 8 LYS HZ3 H -16.162 -3.288 -1.044 1.00 . A A . 29 LYS HZ3 1 1 19 10303 1 1 8 LYS N N -10.143 -4.647 0.326 1.00 . A A . 29 LYS N 1 1 19 10304 1 1 8 LYS NZ N -16.506 -2.485 -0.537 1.00 . A A . 29 LYS NZ 1 1 19 10305 1 1 8 LYS O O -9.808 -2.525 -1.640 1.00 . A A . 29 LYS O 1 1 19 10306 1 1 9 PRO C C -10.374 -1.873 -4.525 1.00 . A A . 30 PRO C 1 1 19 10307 1 1 9 PRO CA C -10.299 -3.394 -4.319 1.00 . A A . 30 PRO CA 1 1 19 10308 1 1 9 PRO CB C -11.043 -4.112 -5.449 1.00 . A A . 30 PRO CB 1 1 19 10309 1 1 9 PRO CD C -11.718 -5.076 -3.374 1.00 . A A . 30 PRO CD 1 1 19 10310 1 1 9 PRO CG C -11.433 -5.446 -4.827 1.00 . A A . 30 PRO CG 1 1 19 10311 1 1 9 PRO HA H -9.253 -3.693 -4.361 1.00 . A A . 30 PRO HA 1 1 19 10312 1 1 9 PRO HB2 H -11.950 -3.565 -5.717 1.00 . A A . 30 PRO HB2 1 1 19 10313 1 1 9 PRO HB3 H -10.411 -4.249 -6.329 1.00 . A A . 30 PRO HB3 1 1 19 10314 1 1 9 PRO HD2 H -12.768 -4.801 -3.262 1.00 . A A . 30 PRO HD2 1 1 19 10315 1 1 9 PRO HD3 H -11.481 -5.929 -2.739 1.00 . A A . 30 PRO HD3 1 1 19 10316 1 1 9 PRO HG2 H -12.308 -5.881 -5.311 1.00 . A A . 30 PRO HG2 1 1 19 10317 1 1 9 PRO HG3 H -10.586 -6.133 -4.870 1.00 . A A . 30 PRO HG3 1 1 19 10318 1 1 9 PRO N N -10.878 -3.919 -3.069 1.00 . A A . 30 PRO N 1 1 19 10319 1 1 9 PRO O O -9.452 -1.285 -5.096 1.00 . A A . 30 PRO O 1 1 19 10320 1 1 10 GLY C C -10.933 1.170 -3.375 1.00 . A A . 31 GLY C 1 1 19 10321 1 1 10 GLY CA C -11.750 0.200 -4.241 1.00 . A A . 31 GLY CA 1 1 19 10322 1 1 10 GLY H H -12.157 -1.789 -3.604 1.00 . A A . 31 GLY H 1 1 19 10323 1 1 10 GLY HA2 H -12.807 0.370 -4.035 1.00 . A A . 31 GLY HA2 1 1 19 10324 1 1 10 GLY HA3 H -11.569 0.458 -5.285 1.00 . A A . 31 GLY HA3 1 1 19 10325 1 1 10 GLY N N -11.445 -1.228 -4.049 1.00 . A A . 31 GLY N 1 1 19 10326 1 1 10 GLY O O -11.462 2.183 -2.912 1.00 . A A . 31 GLY O 1 1 19 10327 1 1 11 HIS C C -7.730 2.445 -3.197 1.00 . A A . 32 HIS C 1 1 19 10328 1 1 11 HIS CA C -8.739 1.671 -2.335 1.00 . A A . 32 HIS CA 1 1 19 10329 1 1 11 HIS CB C -8.055 0.798 -1.270 1.00 . A A . 32 HIS CB 1 1 19 10330 1 1 11 HIS CD2 C -8.558 1.320 1.184 1.00 . A A . 32 HIS CD2 1 1 19 10331 1 1 11 HIS CE1 C -10.393 0.150 1.468 1.00 . A A . 32 HIS CE1 1 1 19 10332 1 1 11 HIS CG C -8.854 0.712 -0.002 1.00 . A A . 32 HIS CG 1 1 19 10333 1 1 11 HIS H H -9.293 0.016 -3.555 1.00 . A A . 32 HIS H 1 1 19 10334 1 1 11 HIS HA H -9.313 2.426 -1.805 1.00 . A A . 32 HIS HA 1 1 19 10335 1 1 11 HIS HB2 H -7.905 -0.211 -1.651 1.00 . A A . 32 HIS HB2 1 1 19 10336 1 1 11 HIS HB3 H -7.074 1.211 -1.027 1.00 . A A . 32 HIS HB3 1 1 19 10337 1 1 11 HIS HD1 H -10.434 -0.629 -0.496 1.00 . A A . 32 HIS HD1 1 1 19 10338 1 1 11 HIS HD2 H -7.712 1.967 1.356 1.00 . A A . 32 HIS HD2 1 1 19 10339 1 1 11 HIS HE1 H -11.263 -0.312 1.917 1.00 . A A . 32 HIS HE1 1 1 19 10340 1 1 11 HIS N N -9.660 0.854 -3.124 1.00 . A A . 32 HIS N 1 1 19 10341 1 1 11 HIS ND1 N -10.003 -0.017 0.191 1.00 . A A . 32 HIS ND1 1 1 19 10342 1 1 11 HIS NE2 N -9.524 0.942 2.125 1.00 . A A . 32 HIS NE2 1 1 19 10343 1 1 11 HIS O O -7.426 2.094 -4.339 1.00 . A A . 32 HIS O 1 1 19 10344 1 1 12 LEU C C -5.605 5.236 -1.994 1.00 . A A . 33 LEU C 1 1 19 10345 1 1 12 LEU CA C -6.362 4.570 -3.159 1.00 . A A . 33 LEU CA 1 1 19 10346 1 1 12 LEU CB C -7.219 5.645 -3.875 1.00 . A A . 33 LEU CB 1 1 19 10347 1 1 12 LEU CD1 C -8.793 6.380 -5.683 1.00 . A A . 33 LEU CD1 1 1 19 10348 1 1 12 LEU CD2 C -6.936 4.855 -6.281 1.00 . A A . 33 LEU CD2 1 1 19 10349 1 1 12 LEU CG C -7.929 5.224 -5.175 1.00 . A A . 33 LEU CG 1 1 19 10350 1 1 12 LEU H H -7.507 3.688 -1.644 1.00 . A A . 33 LEU H 1 1 19 10351 1 1 12 LEU HA H -5.636 4.133 -3.846 1.00 . A A . 33 LEU HA 1 1 19 10352 1 1 12 LEU HB2 H -7.977 5.997 -3.171 1.00 . A A . 33 LEU HB2 1 1 19 10353 1 1 12 LEU HB3 H -6.585 6.499 -4.116 1.00 . A A . 33 LEU HB3 1 1 19 10354 1 1 12 LEU HD11 H -9.531 6.644 -4.925 1.00 . A A . 33 LEU HD11 1 1 19 10355 1 1 12 LEU HD12 H -8.171 7.250 -5.897 1.00 . A A . 33 LEU HD12 1 1 19 10356 1 1 12 LEU HD13 H -9.318 6.079 -6.589 1.00 . A A . 33 LEU HD13 1 1 19 10357 1 1 12 LEU HD21 H -6.266 5.692 -6.479 1.00 . A A . 33 LEU HD21 1 1 19 10358 1 1 12 LEU HD22 H -6.350 3.986 -5.985 1.00 . A A . 33 LEU HD22 1 1 19 10359 1 1 12 LEU HD23 H -7.479 4.608 -7.193 1.00 . A A . 33 LEU HD23 1 1 19 10360 1 1 12 LEU HG H -8.588 4.379 -4.984 1.00 . A A . 33 LEU HG 1 1 19 10361 1 1 12 LEU N N -7.244 3.539 -2.608 1.00 . A A . 33 LEU N 1 1 19 10362 1 1 12 LEU O O -5.970 5.050 -0.829 1.00 . A A . 33 LEU O 1 1 19 10363 1 1 13 SER C C -4.858 7.900 -0.522 1.00 . A A . 34 SER C 1 1 19 10364 1 1 13 SER CA C -3.936 6.989 -1.358 1.00 . A A . 34 SER CA 1 1 19 10365 1 1 13 SER CB C -2.962 7.880 -2.137 1.00 . A A . 34 SER CB 1 1 19 10366 1 1 13 SER H H -4.351 6.165 -3.276 1.00 . A A . 34 SER H 1 1 19 10367 1 1 13 SER HA H -3.363 6.374 -0.664 1.00 . A A . 34 SER HA 1 1 19 10368 1 1 13 SER HB2 H -3.530 8.556 -2.778 1.00 . A A . 34 SER HB2 1 1 19 10369 1 1 13 SER HB3 H -2.372 8.475 -1.438 1.00 . A A . 34 SER HB3 1 1 19 10370 1 1 13 SER HG H -1.606 7.682 -3.540 1.00 . A A . 34 SER HG 1 1 19 10371 1 1 13 SER N N -4.636 6.099 -2.307 1.00 . A A . 34 SER N 1 1 19 10372 1 1 13 SER O O -4.442 8.427 0.510 1.00 . A A . 34 SER O 1 1 19 10373 1 1 13 SER OG O -2.098 7.089 -2.940 1.00 . A A . 34 SER OG 1 1 19 10374 1 1 14 SER C C -8.159 8.000 0.506 1.00 . A A . 35 SER C 1 1 19 10375 1 1 14 SER CA C -7.163 8.865 -0.289 1.00 . A A . 35 SER CA 1 1 19 10376 1 1 14 SER CB C -7.924 9.676 -1.346 1.00 . A A . 35 SER CB 1 1 19 10377 1 1 14 SER H H -6.356 7.693 -1.857 1.00 . A A . 35 SER H 1 1 19 10378 1 1 14 SER HA H -6.712 9.569 0.410 1.00 . A A . 35 SER HA 1 1 19 10379 1 1 14 SER HB2 H -8.749 10.216 -0.875 1.00 . A A . 35 SER HB2 1 1 19 10380 1 1 14 SER HB3 H -7.245 10.404 -1.792 1.00 . A A . 35 SER HB3 1 1 19 10381 1 1 14 SER HG H -8.911 9.363 -3.011 1.00 . A A . 35 SER HG 1 1 19 10382 1 1 14 SER N N -6.106 8.095 -0.964 1.00 . A A . 35 SER N 1 1 19 10383 1 1 14 SER O O -9.001 8.544 1.226 1.00 . A A . 35 SER O 1 1 19 10384 1 1 14 SER OG O -8.423 8.817 -2.364 1.00 . A A . 35 SER OG 1 1 19 10385 1 1 15 GLN C C -8.289 5.103 2.335 1.00 . A A . 36 GLN C 1 1 19 10386 1 1 15 GLN CA C -8.958 5.710 1.083 1.00 . A A . 36 GLN CA 1 1 19 10387 1 1 15 GLN CB C -9.357 4.619 0.069 1.00 . A A . 36 GLN CB 1 1 19 10388 1 1 15 GLN CD C -11.902 4.640 -0.004 1.00 . A A . 36 GLN CD 1 1 19 10389 1 1 15 GLN CG C -10.654 3.877 0.435 1.00 . A A . 36 GLN CG 1 1 19 10390 1 1 15 GLN H H -7.321 6.292 -0.164 1.00 . A A . 36 GLN H 1 1 19 10391 1 1 15 GLN HA H -9.864 6.227 1.401 1.00 . A A . 36 GLN HA 1 1 19 10392 1 1 15 GLN HB2 H -9.488 5.065 -0.920 1.00 . A A . 36 GLN HB2 1 1 19 10393 1 1 15 GLN HB3 H -8.543 3.898 -0.001 1.00 . A A . 36 GLN HB3 1 1 19 10394 1 1 15 GLN HE21 H -12.060 3.601 -1.748 1.00 . A A . 36 GLN HE21 1 1 19 10395 1 1 15 GLN HE22 H -13.273 4.845 -1.453 1.00 . A A . 36 GLN HE22 1 1 19 10396 1 1 15 GLN HG2 H -10.660 2.910 -0.064 1.00 . A A . 36 GLN HG2 1 1 19 10397 1 1 15 GLN HG3 H -10.694 3.692 1.508 1.00 . A A . 36 GLN HG3 1 1 19 10398 1 1 15 GLN N N -8.067 6.667 0.410 1.00 . A A . 36 GLN N 1 1 19 10399 1 1 15 GLN NE2 N -12.451 4.338 -1.165 1.00 . A A . 36 GLN NE2 1 1 19 10400 1 1 15 GLN O O -8.921 5.043 3.391 1.00 . A A . 36 GLN O 1 1 19 10401 1 1 15 GLN OE1 O -12.403 5.522 0.682 1.00 . A A . 36 GLN OE1 1 1 19 10402 1 1 16 CYS C C -4.662 4.921 3.038 1.00 . A A . 37 CYS C 1 1 19 10403 1 1 16 CYS CA C -6.083 4.382 3.314 1.00 . A A . 37 CYS CA 1 1 19 10404 1 1 16 CYS CB C -6.054 2.850 3.502 1.00 . A A . 37 CYS CB 1 1 19 10405 1 1 16 CYS H H -6.565 4.876 1.317 1.00 . A A . 37 CYS H 1 1 19 10406 1 1 16 CYS HA H -6.428 4.844 4.238 1.00 . A A . 37 CYS HA 1 1 19 10407 1 1 16 CYS HB2 H -6.035 2.354 2.532 1.00 . A A . 37 CYS HB2 1 1 19 10408 1 1 16 CYS HB3 H -5.133 2.567 4.009 1.00 . A A . 37 CYS HB3 1 1 19 10409 1 1 16 CYS N N -6.999 4.751 2.226 1.00 . A A . 37 CYS N 1 1 19 10410 1 1 16 CYS O O -4.383 5.453 1.959 1.00 . A A . 37 CYS O 1 1 19 10411 1 1 16 CYS SG S -7.442 2.278 4.521 1.00 . A A . 37 CYS SG 1 1 19 10412 1 1 17 ARG C C -1.619 4.599 2.676 1.00 . A A . 38 ARG C 1 1 19 10413 1 1 17 ARG CA C -2.337 5.169 3.908 1.00 . A A . 38 ARG CA 1 1 19 10414 1 1 17 ARG CB C -1.560 4.795 5.185 1.00 . A A . 38 ARG CB 1 1 19 10415 1 1 17 ARG CD C -2.930 4.912 7.389 1.00 . A A . 38 ARG CD 1 1 19 10416 1 1 17 ARG CG C -1.910 5.588 6.458 1.00 . A A . 38 ARG CG 1 1 19 10417 1 1 17 ARG CZ C -5.372 4.411 7.079 1.00 . A A . 38 ARG CZ 1 1 19 10418 1 1 17 ARG H H -4.055 4.314 4.864 1.00 . A A . 38 ARG H 1 1 19 10419 1 1 17 ARG HA H -2.302 6.255 3.792 1.00 . A A . 38 ARG HA 1 1 19 10420 1 1 17 ARG HB2 H -1.656 3.724 5.374 1.00 . A A . 38 ARG HB2 1 1 19 10421 1 1 17 ARG HB3 H -0.506 4.992 4.983 1.00 . A A . 38 ARG HB3 1 1 19 10422 1 1 17 ARG HD2 H -2.748 3.840 7.391 1.00 . A A . 38 ARG HD2 1 1 19 10423 1 1 17 ARG HD3 H -2.747 5.273 8.404 1.00 . A A . 38 ARG HD3 1 1 19 10424 1 1 17 ARG HE H -4.538 6.196 6.857 1.00 . A A . 38 ARG HE 1 1 19 10425 1 1 17 ARG HG2 H -0.988 5.688 7.031 1.00 . A A . 38 ARG HG2 1 1 19 10426 1 1 17 ARG HG3 H -2.238 6.597 6.202 1.00 . A A . 38 ARG HG3 1 1 19 10427 1 1 17 ARG HH11 H -4.365 2.735 7.553 1.00 . A A . 38 ARG HH11 1 1 19 10428 1 1 17 ARG HH12 H -6.083 2.555 7.309 1.00 . A A . 38 ARG HH12 1 1 19 10429 1 1 17 ARG HH21 H -6.718 5.843 6.656 1.00 . A A . 38 ARG HH21 1 1 19 10430 1 1 17 ARG HH22 H -7.333 4.220 6.735 1.00 . A A . 38 ARG HH22 1 1 19 10431 1 1 17 ARG N N -3.749 4.754 4.008 1.00 . A A . 38 ARG N 1 1 19 10432 1 1 17 ARG NE N -4.332 5.228 7.046 1.00 . A A . 38 ARG NE 1 1 19 10433 1 1 17 ARG NH1 N -5.265 3.139 7.329 1.00 . A A . 38 ARG NH1 1 1 19 10434 1 1 17 ARG NH2 N -6.565 4.864 6.827 1.00 . A A . 38 ARG NH2 1 1 19 10435 1 1 17 ARG O O -0.804 5.304 2.080 1.00 . A A . 38 ARG O 1 1 19 10436 1 1 18 ALA C C -2.305 1.546 0.579 1.00 . A A . 39 ALA C 1 1 19 10437 1 1 18 ALA CA C -1.427 2.732 1.050 1.00 . A A . 39 ALA CA 1 1 19 10438 1 1 18 ALA CB C 0.000 2.228 1.325 1.00 . A A . 39 ALA CB 1 1 19 10439 1 1 18 ALA H H -2.601 2.844 2.821 1.00 . A A . 39 ALA H 1 1 19 10440 1 1 18 ALA HA H -1.401 3.480 0.259 1.00 . A A . 39 ALA HA 1 1 19 10441 1 1 18 ALA HB1 H 0.647 3.059 1.604 1.00 . A A . 39 ALA HB1 1 1 19 10442 1 1 18 ALA HB2 H -0.024 1.494 2.130 1.00 . A A . 39 ALA HB2 1 1 19 10443 1 1 18 ALA HB3 H 0.408 1.750 0.435 1.00 . A A . 39 ALA HB3 1 1 19 10444 1 1 18 ALA N N -1.931 3.364 2.273 1.00 . A A . 39 ALA N 1 1 19 10445 1 1 18 ALA O O -3.023 0.948 1.387 1.00 . A A . 39 ALA O 1 1 19 10446 1 1 19 PRO C C -1.653 -1.279 -0.696 1.00 . A A . 40 PRO C 1 1 19 10447 1 1 19 PRO CA C -2.635 -0.182 -1.160 1.00 . A A . 40 PRO CA 1 1 19 10448 1 1 19 PRO CB C -2.684 -0.061 -2.688 1.00 . A A . 40 PRO CB 1 1 19 10449 1 1 19 PRO CD C -1.601 1.885 -1.804 1.00 . A A . 40 PRO CD 1 1 19 10450 1 1 19 PRO CG C -1.561 0.928 -2.995 1.00 . A A . 40 PRO CG 1 1 19 10451 1 1 19 PRO HA H -3.631 -0.416 -0.787 1.00 . A A . 40 PRO HA 1 1 19 10452 1 1 19 PRO HB2 H -2.536 -1.015 -3.194 1.00 . A A . 40 PRO HB2 1 1 19 10453 1 1 19 PRO HB3 H -3.640 0.376 -2.981 1.00 . A A . 40 PRO HB3 1 1 19 10454 1 1 19 PRO HD2 H -0.590 2.215 -1.564 1.00 . A A . 40 PRO HD2 1 1 19 10455 1 1 19 PRO HD3 H -2.227 2.746 -2.048 1.00 . A A . 40 PRO HD3 1 1 19 10456 1 1 19 PRO HG2 H -0.605 0.405 -3.011 1.00 . A A . 40 PRO HG2 1 1 19 10457 1 1 19 PRO HG3 H -1.727 1.451 -3.937 1.00 . A A . 40 PRO HG3 1 1 19 10458 1 1 19 PRO N N -2.210 1.143 -0.705 1.00 . A A . 40 PRO N 1 1 19 10459 1 1 19 PRO O O -0.572 -0.989 -0.181 1.00 . A A . 40 PRO O 1 1 19 10460 1 1 20 LYS C C 0.211 -3.835 -1.047 1.00 . A A . 41 LYS C 1 1 19 10461 1 1 20 LYS CA C -1.253 -3.778 -0.573 1.00 . A A . 41 LYS CA 1 1 19 10462 1 1 20 LYS CB C -2.074 -4.989 -1.063 1.00 . A A . 41 LYS CB 1 1 19 10463 1 1 20 LYS CD C -2.606 -7.455 -0.832 1.00 . A A . 41 LYS CD 1 1 19 10464 1 1 20 LYS CE C -2.140 -8.777 -0.209 1.00 . A A . 41 LYS CE 1 1 19 10465 1 1 20 LYS CG C -1.649 -6.324 -0.432 1.00 . A A . 41 LYS CG 1 1 19 10466 1 1 20 LYS H H -2.911 -2.687 -1.371 1.00 . A A . 41 LYS H 1 1 19 10467 1 1 20 LYS HA H -1.203 -3.820 0.514 1.00 . A A . 41 LYS HA 1 1 19 10468 1 1 20 LYS HB2 H -3.122 -4.823 -0.810 1.00 . A A . 41 LYS HB2 1 1 19 10469 1 1 20 LYS HB3 H -2.000 -5.061 -2.150 1.00 . A A . 41 LYS HB3 1 1 19 10470 1 1 20 LYS HD2 H -3.612 -7.218 -0.481 1.00 . A A . 41 LYS HD2 1 1 19 10471 1 1 20 LYS HD3 H -2.619 -7.549 -1.921 1.00 . A A . 41 LYS HD3 1 1 19 10472 1 1 20 LYS HE2 H -1.120 -8.982 -0.543 1.00 . A A . 41 LYS HE2 1 1 19 10473 1 1 20 LYS HE3 H -2.120 -8.664 0.880 1.00 . A A . 41 LYS HE3 1 1 19 10474 1 1 20 LYS HG2 H -0.645 -6.586 -0.767 1.00 . A A . 41 LYS HG2 1 1 19 10475 1 1 20 LYS HG3 H -1.648 -6.224 0.655 1.00 . A A . 41 LYS HG3 1 1 19 10476 1 1 20 LYS HZ1 H -3.055 -10.041 -1.586 1.00 . A A . 41 LYS HZ1 1 1 19 10477 1 1 20 LYS HZ2 H -2.715 -10.772 -0.169 1.00 . A A . 41 LYS HZ2 1 1 19 10478 1 1 20 LYS HZ3 H -3.980 -9.749 -0.270 1.00 . A A . 41 LYS HZ3 1 1 19 10479 1 1 20 LYS N N -2.000 -2.551 -0.939 1.00 . A A . 41 LYS N 1 1 19 10480 1 1 20 LYS NZ N -3.032 -9.906 -0.584 1.00 . A A . 41 LYS NZ 1 1 19 10481 1 1 20 LYS O O 0.997 -4.632 -0.535 1.00 . A A . 41 LYS O 1 1 19 10482 1 1 21 VAL C C 2.888 -2.286 -1.155 1.00 . A A . 42 VAL C 1 1 19 10483 1 1 21 VAL CA C 1.995 -2.666 -2.355 1.00 . A A . 42 VAL CA 1 1 19 10484 1 1 21 VAL CB C 2.004 -1.528 -3.402 1.00 . A A . 42 VAL CB 1 1 19 10485 1 1 21 VAL CG1 C 3.409 -1.206 -3.913 1.00 . A A . 42 VAL CG1 1 1 19 10486 1 1 21 VAL CG2 C 1.145 -1.874 -4.629 1.00 . A A . 42 VAL CG2 1 1 19 10487 1 1 21 VAL H H -0.117 -2.355 -2.340 1.00 . A A . 42 VAL H 1 1 19 10488 1 1 21 VAL HA H 2.422 -3.559 -2.813 1.00 . A A . 42 VAL HA 1 1 19 10489 1 1 21 VAL HB H 1.597 -0.628 -2.943 1.00 . A A . 42 VAL HB 1 1 19 10490 1 1 21 VAL HG11 H 3.863 -2.105 -4.330 1.00 . A A . 42 VAL HG11 1 1 19 10491 1 1 21 VAL HG12 H 3.361 -0.436 -4.683 1.00 . A A . 42 VAL HG12 1 1 19 10492 1 1 21 VAL HG13 H 4.030 -0.829 -3.101 1.00 . A A . 42 VAL HG13 1 1 19 10493 1 1 21 VAL HG21 H 1.504 -2.796 -5.087 1.00 . A A . 42 VAL HG21 1 1 19 10494 1 1 21 VAL HG22 H 0.098 -1.993 -4.350 1.00 . A A . 42 VAL HG22 1 1 19 10495 1 1 21 VAL HG23 H 1.203 -1.067 -5.361 1.00 . A A . 42 VAL HG23 1 1 19 10496 1 1 21 VAL N N 0.603 -2.951 -1.963 1.00 . A A . 42 VAL N 1 1 19 10497 1 1 21 VAL O O 4.056 -2.670 -1.118 1.00 . A A . 42 VAL O 1 1 19 10498 1 1 22 CYS C C 2.230 -0.813 2.201 1.00 . A A . 43 CYS C 1 1 19 10499 1 1 22 CYS CA C 3.086 -0.901 0.910 1.00 . A A . 43 CYS CA 1 1 19 10500 1 1 22 CYS CB C 3.528 0.473 0.358 1.00 . A A . 43 CYS CB 1 1 19 10501 1 1 22 CYS H H 1.354 -1.343 -0.233 1.00 . A A . 43 CYS H 1 1 19 10502 1 1 22 CYS HA H 3.981 -1.480 1.144 1.00 . A A . 43 CYS HA 1 1 19 10503 1 1 22 CYS HB2 H 3.975 0.319 -0.625 1.00 . A A . 43 CYS HB2 1 1 19 10504 1 1 22 CYS HB3 H 2.653 1.113 0.237 1.00 . A A . 43 CYS HB3 1 1 19 10505 1 1 22 CYS N N 2.344 -1.552 -0.174 1.00 . A A . 43 CYS N 1 1 19 10506 1 1 22 CYS O O 1.312 -1.608 2.419 1.00 . A A . 43 CYS O 1 1 19 10507 1 1 22 CYS SG S 4.756 1.288 1.419 1.00 . A A . 43 CYS SG 1 1 19 10508 1 1 23 PHE C C 1.713 2.103 4.392 1.00 . A A . 44 PHE C 1 1 19 10509 1 1 23 PHE CA C 1.771 0.567 4.233 1.00 . A A . 44 PHE CA 1 1 19 10510 1 1 23 PHE CB C 2.334 -0.091 5.502 1.00 . A A . 44 PHE CB 1 1 19 10511 1 1 23 PHE CD1 C 4.858 0.226 5.461 1.00 . A A . 44 PHE CD1 1 1 19 10512 1 1 23 PHE CD2 C 3.543 1.490 7.074 1.00 . A A . 44 PHE CD2 1 1 19 10513 1 1 23 PHE CE1 C 6.028 0.849 5.933 1.00 . A A . 44 PHE CE1 1 1 19 10514 1 1 23 PHE CE2 C 4.713 2.114 7.543 1.00 . A A . 44 PHE CE2 1 1 19 10515 1 1 23 PHE CG C 3.610 0.547 6.030 1.00 . A A . 44 PHE CG 1 1 19 10516 1 1 23 PHE CZ C 5.956 1.795 6.970 1.00 . A A . 44 PHE CZ 1 1 19 10517 1 1 23 PHE H H 3.379 0.669 2.828 1.00 . A A . 44 PHE H 1 1 19 10518 1 1 23 PHE HA H 0.742 0.224 4.104 1.00 . A A . 44 PHE HA 1 1 19 10519 1 1 23 PHE HB2 H 1.573 -0.029 6.282 1.00 . A A . 44 PHE HB2 1 1 19 10520 1 1 23 PHE HB3 H 2.510 -1.152 5.315 1.00 . A A . 44 PHE HB3 1 1 19 10521 1 1 23 PHE HD1 H 4.922 -0.495 4.659 1.00 . A A . 44 PHE HD1 1 1 19 10522 1 1 23 PHE HD2 H 2.589 1.747 7.514 1.00 . A A . 44 PHE HD2 1 1 19 10523 1 1 23 PHE HE1 H 6.986 0.601 5.497 1.00 . A A . 44 PHE HE1 1 1 19 10524 1 1 23 PHE HE2 H 4.656 2.840 8.343 1.00 . A A . 44 PHE HE2 1 1 19 10525 1 1 23 PHE HZ H 6.858 2.274 7.330 1.00 . A A . 44 PHE HZ 1 1 19 10526 1 1 23 PHE N N 2.551 0.141 3.069 1.00 . A A . 44 PHE N 1 1 19 10527 1 1 23 PHE O O 0.830 2.596 5.097 1.00 . A A . 44 PHE O 1 1 19 10528 1 1 24 LYS C C 3.390 5.007 2.648 1.00 . A A . 45 LYS C 1 1 19 10529 1 1 24 LYS CA C 2.690 4.337 3.841 1.00 . A A . 45 LYS CA 1 1 19 10530 1 1 24 LYS CB C 3.393 4.699 5.166 1.00 . A A . 45 LYS CB 1 1 19 10531 1 1 24 LYS CD C 4.066 6.496 6.807 1.00 . A A . 45 LYS CD 1 1 19 10532 1 1 24 LYS CE C 4.064 8.003 7.089 1.00 . A A . 45 LYS CE 1 1 19 10533 1 1 24 LYS CG C 3.402 6.208 5.453 1.00 . A A . 45 LYS CG 1 1 19 10534 1 1 24 LYS H H 3.303 2.390 3.170 1.00 . A A . 45 LYS H 1 1 19 10535 1 1 24 LYS HA H 1.675 4.737 3.868 1.00 . A A . 45 LYS HA 1 1 19 10536 1 1 24 LYS HB2 H 2.873 4.205 5.987 1.00 . A A . 45 LYS HB2 1 1 19 10537 1 1 24 LYS HB3 H 4.420 4.329 5.150 1.00 . A A . 45 LYS HB3 1 1 19 10538 1 1 24 LYS HD2 H 3.519 5.977 7.595 1.00 . A A . 45 LYS HD2 1 1 19 10539 1 1 24 LYS HD3 H 5.096 6.129 6.787 1.00 . A A . 45 LYS HD3 1 1 19 10540 1 1 24 LYS HE2 H 4.593 8.515 6.279 1.00 . A A . 45 LYS HE2 1 1 19 10541 1 1 24 LYS HE3 H 3.029 8.359 7.090 1.00 . A A . 45 LYS HE3 1 1 19 10542 1 1 24 LYS HG2 H 3.955 6.731 4.670 1.00 . A A . 45 LYS HG2 1 1 19 10543 1 1 24 LYS HG3 H 2.376 6.577 5.469 1.00 . A A . 45 LYS HG3 1 1 19 10544 1 1 24 LYS HZ1 H 4.229 7.864 9.159 1.00 . A A . 45 LYS HZ1 1 1 19 10545 1 1 24 LYS HZ2 H 5.674 8.014 8.407 1.00 . A A . 45 LYS HZ2 1 1 19 10546 1 1 24 LYS HZ3 H 4.699 9.311 8.572 1.00 . A A . 45 LYS HZ3 1 1 19 10547 1 1 24 LYS N N 2.618 2.863 3.744 1.00 . A A . 45 LYS N 1 1 19 10548 1 1 24 LYS NZ N 4.710 8.316 8.391 1.00 . A A . 45 LYS NZ 1 1 19 10549 1 1 24 LYS O O 2.783 5.853 1.990 1.00 . A A . 45 LYS O 1 1 19 10550 1 1 25 CYS C C 5.213 5.066 -0.073 1.00 . A A . 46 CYS C 1 1 19 10551 1 1 25 CYS CA C 5.522 5.343 1.416 1.00 . A A . 46 CYS CA 1 1 19 10552 1 1 25 CYS CB C 6.995 5.068 1.784 1.00 . A A . 46 CYS CB 1 1 19 10553 1 1 25 CYS H H 5.094 3.971 2.965 1.00 . A A . 46 CYS H 1 1 19 10554 1 1 25 CYS HA H 5.370 6.415 1.551 1.00 . A A . 46 CYS HA 1 1 19 10555 1 1 25 CYS HB2 H 7.619 5.159 0.891 1.00 . A A . 46 CYS HB2 1 1 19 10556 1 1 25 CYS HB3 H 7.318 5.839 2.486 1.00 . A A . 46 CYS HB3 1 1 19 10557 1 1 25 CYS N N 4.647 4.654 2.373 1.00 . A A . 46 CYS N 1 1 19 10558 1 1 25 CYS O O 5.393 5.967 -0.895 1.00 . A A . 46 CYS O 1 1 19 10559 1 1 25 CYS SG S 7.263 3.448 2.564 1.00 . A A . 46 CYS SG 1 1 19 10560 1 1 26 LYS C C 4.742 3.924 -3.020 1.00 . A A . 47 LYS C 1 1 19 10561 1 1 26 LYS CA C 4.054 3.484 -1.702 1.00 . A A . 47 LYS CA 1 1 19 10562 1 1 26 LYS CB C 2.540 3.794 -1.636 1.00 . A A . 47 LYS CB 1 1 19 10563 1 1 26 LYS CD C 0.698 5.520 -1.329 1.00 . A A . 47 LYS CD 1 1 19 10564 1 1 26 LYS CE C 0.414 6.955 -0.865 1.00 . A A . 47 LYS CE 1 1 19 10565 1 1 26 LYS CG C 2.205 5.289 -1.492 1.00 . A A . 47 LYS CG 1 1 19 10566 1 1 26 LYS H H 4.609 3.208 0.345 1.00 . A A . 47 LYS H 1 1 19 10567 1 1 26 LYS HA H 4.116 2.397 -1.746 1.00 . A A . 47 LYS HA 1 1 19 10568 1 1 26 LYS HB2 H 2.048 3.403 -2.529 1.00 . A A . 47 LYS HB2 1 1 19 10569 1 1 26 LYS HB3 H 2.125 3.266 -0.778 1.00 . A A . 47 LYS HB3 1 1 19 10570 1 1 26 LYS HD2 H 0.209 5.350 -2.289 1.00 . A A . 47 LYS HD2 1 1 19 10571 1 1 26 LYS HD3 H 0.286 4.819 -0.601 1.00 . A A . 47 LYS HD3 1 1 19 10572 1 1 26 LYS HE2 H 1.004 7.648 -1.471 1.00 . A A . 47 LYS HE2 1 1 19 10573 1 1 26 LYS HE3 H -0.642 7.169 -1.045 1.00 . A A . 47 LYS HE3 1 1 19 10574 1 1 26 LYS HG2 H 2.705 5.682 -0.612 1.00 . A A . 47 LYS HG2 1 1 19 10575 1 1 26 LYS HG3 H 2.562 5.835 -2.365 1.00 . A A . 47 LYS HG3 1 1 19 10576 1 1 26 LYS HZ1 H 1.656 6.868 0.820 1.00 . A A . 47 LYS HZ1 1 1 19 10577 1 1 26 LYS HZ2 H 0.574 8.104 0.866 1.00 . A A . 47 LYS HZ2 1 1 19 10578 1 1 26 LYS HZ3 H 0.099 6.559 1.149 1.00 . A A . 47 LYS HZ3 1 1 19 10579 1 1 26 LYS N N 4.684 3.880 -0.413 1.00 . A A . 47 LYS N 1 1 19 10580 1 1 26 LYS NZ N 0.706 7.145 0.581 1.00 . A A . 47 LYS NZ 1 1 19 10581 1 1 26 LYS O O 4.078 4.052 -4.050 1.00 . A A . 47 LYS O 1 1 19 10582 1 1 27 GLN C C 6.933 3.345 -5.243 1.00 . A A . 48 GLN C 1 1 19 10583 1 1 27 GLN CA C 6.842 4.503 -4.213 1.00 . A A . 48 GLN CA 1 1 19 10584 1 1 27 GLN CB C 8.251 4.975 -3.799 1.00 . A A . 48 GLN CB 1 1 19 10585 1 1 27 GLN CD C 7.525 7.398 -3.437 1.00 . A A . 48 GLN CD 1 1 19 10586 1 1 27 GLN CG C 8.263 6.191 -2.858 1.00 . A A . 48 GLN CG 1 1 19 10587 1 1 27 GLN H H 6.546 4.035 -2.138 1.00 . A A . 48 GLN H 1 1 19 10588 1 1 27 GLN HA H 6.324 5.336 -4.682 1.00 . A A . 48 GLN HA 1 1 19 10589 1 1 27 GLN HB2 H 8.776 4.156 -3.308 1.00 . A A . 48 GLN HB2 1 1 19 10590 1 1 27 GLN HB3 H 8.816 5.235 -4.694 1.00 . A A . 48 GLN HB3 1 1 19 10591 1 1 27 GLN HE21 H 5.970 7.189 -2.158 1.00 . A A . 48 GLN HE21 1 1 19 10592 1 1 27 GLN HE22 H 5.876 8.532 -3.303 1.00 . A A . 48 GLN HE22 1 1 19 10593 1 1 27 GLN HG2 H 7.831 5.915 -1.896 1.00 . A A . 48 GLN HG2 1 1 19 10594 1 1 27 GLN HG3 H 9.299 6.478 -2.670 1.00 . A A . 48 GLN HG3 1 1 19 10595 1 1 27 GLN N N 6.062 4.133 -3.016 1.00 . A A . 48 GLN N 1 1 19 10596 1 1 27 GLN NE2 N 6.362 7.737 -2.921 1.00 . A A . 48 GLN NE2 1 1 19 10597 1 1 27 GLN O O 6.898 2.182 -4.828 1.00 . A A . 48 GLN O 1 1 19 10598 1 1 27 GLN OE1 O 7.974 8.046 -4.374 1.00 . A A . 48 GLN OE1 1 1 19 10599 1 1 28 PRO C C 7.738 1.324 -7.634 1.00 . A A . 49 PRO C 1 1 19 10600 1 1 28 PRO CA C 6.956 2.655 -7.664 1.00 . A A . 49 PRO CA 1 1 19 10601 1 1 28 PRO CB C 7.323 3.429 -8.936 1.00 . A A . 49 PRO CB 1 1 19 10602 1 1 28 PRO CD C 7.249 4.967 -7.120 1.00 . A A . 49 PRO CD 1 1 19 10603 1 1 28 PRO CG C 6.916 4.858 -8.605 1.00 . A A . 49 PRO CG 1 1 19 10604 1 1 28 PRO HA H 5.896 2.401 -7.722 1.00 . A A . 49 PRO HA 1 1 19 10605 1 1 28 PRO HB2 H 8.401 3.389 -9.102 1.00 . A A . 49 PRO HB2 1 1 19 10606 1 1 28 PRO HB3 H 6.787 3.050 -9.808 1.00 . A A . 49 PRO HB3 1 1 19 10607 1 1 28 PRO HD2 H 8.282 5.296 -7.006 1.00 . A A . 49 PRO HD2 1 1 19 10608 1 1 28 PRO HD3 H 6.574 5.690 -6.666 1.00 . A A . 49 PRO HD3 1 1 19 10609 1 1 28 PRO HG2 H 7.469 5.585 -9.201 1.00 . A A . 49 PRO HG2 1 1 19 10610 1 1 28 PRO HG3 H 5.842 4.976 -8.751 1.00 . A A . 49 PRO HG3 1 1 19 10611 1 1 28 PRO N N 7.102 3.624 -6.558 1.00 . A A . 49 PRO N 1 1 19 10612 1 1 28 PRO O O 7.370 0.408 -8.371 1.00 . A A . 49 PRO O 1 1 19 10613 1 1 29 GLY C C 10.324 -0.314 -5.411 1.00 . A A . 50 GLY C 1 1 19 10614 1 1 29 GLY CA C 9.599 -0.052 -6.740 1.00 . A A . 50 GLY CA 1 1 19 10615 1 1 29 GLY H H 9.094 1.999 -6.308 1.00 . A A . 50 GLY H 1 1 19 10616 1 1 29 GLY HA2 H 10.354 -0.026 -7.528 1.00 . A A . 50 GLY HA2 1 1 19 10617 1 1 29 GLY HA3 H 8.954 -0.912 -6.925 1.00 . A A . 50 GLY HA3 1 1 19 10618 1 1 29 GLY N N 8.797 1.187 -6.824 1.00 . A A . 50 GLY N 1 1 19 10619 1 1 29 GLY O O 10.973 -1.350 -5.263 1.00 . A A . 50 GLY O 1 1 19 10620 1 1 30 HIS C C 10.512 -0.727 -2.285 1.00 . A A . 51 HIS C 1 1 19 10621 1 1 30 HIS CA C 10.907 0.503 -3.133 1.00 . A A . 51 HIS CA 1 1 19 10622 1 1 30 HIS CB C 10.622 1.796 -2.345 1.00 . A A . 51 HIS CB 1 1 19 10623 1 1 30 HIS CD2 C 9.084 1.694 -0.304 1.00 . A A . 51 HIS CD2 1 1 19 10624 1 1 30 HIS CE1 C 7.127 1.474 -1.277 1.00 . A A . 51 HIS CE1 1 1 19 10625 1 1 30 HIS CG C 9.275 1.795 -1.655 1.00 . A A . 51 HIS CG 1 1 19 10626 1 1 30 HIS H H 9.685 1.426 -4.619 1.00 . A A . 51 HIS H 1 1 19 10627 1 1 30 HIS HA H 11.980 0.445 -3.317 1.00 . A A . 51 HIS HA 1 1 19 10628 1 1 30 HIS HB2 H 11.394 1.900 -1.580 1.00 . A A . 51 HIS HB2 1 1 19 10629 1 1 30 HIS HB3 H 10.700 2.662 -3.002 1.00 . A A . 51 HIS HB3 1 1 19 10630 1 1 30 HIS HD1 H 7.811 1.716 -3.239 1.00 . A A . 51 HIS HD1 1 1 19 10631 1 1 30 HIS HD2 H 9.863 1.688 0.445 1.00 . A A . 51 HIS HD2 1 1 19 10632 1 1 30 HIS HE1 H 6.070 1.311 -1.441 1.00 . A A . 51 HIS HE1 1 1 19 10633 1 1 30 HIS N N 10.219 0.593 -4.433 1.00 . A A . 51 HIS N 1 1 19 10634 1 1 30 HIS ND1 N 8.033 1.670 -2.246 1.00 . A A . 51 HIS ND1 1 1 19 10635 1 1 30 HIS NE2 N 7.717 1.493 -0.075 1.00 . A A . 51 HIS NE2 1 1 19 10636 1 1 30 HIS O O 11.290 -1.212 -1.462 1.00 . A A . 51 HIS O 1 1 19 10637 1 1 31 PHE C C 9.388 -3.558 -1.582 1.00 . A A . 52 PHE C 1 1 19 10638 1 1 31 PHE CA C 8.647 -2.214 -1.589 1.00 . A A . 52 PHE CA 1 1 19 10639 1 1 31 PHE CB C 7.170 -2.355 -1.989 1.00 . A A . 52 PHE CB 1 1 19 10640 1 1 31 PHE CD1 C 6.903 -3.770 -4.086 1.00 . A A . 52 PHE CD1 1 1 19 10641 1 1 31 PHE CD2 C 6.641 -1.356 -4.259 1.00 . A A . 52 PHE CD2 1 1 19 10642 1 1 31 PHE CE1 C 6.663 -3.891 -5.467 1.00 . A A . 52 PHE CE1 1 1 19 10643 1 1 31 PHE CE2 C 6.391 -1.480 -5.636 1.00 . A A . 52 PHE CE2 1 1 19 10644 1 1 31 PHE CG C 6.900 -2.499 -3.477 1.00 . A A . 52 PHE CG 1 1 19 10645 1 1 31 PHE CZ C 6.408 -2.747 -6.243 1.00 . A A . 52 PHE CZ 1 1 19 10646 1 1 31 PHE H H 8.708 -0.793 -3.167 1.00 . A A . 52 PHE H 1 1 19 10647 1 1 31 PHE HA H 8.673 -1.839 -0.564 1.00 . A A . 52 PHE HA 1 1 19 10648 1 1 31 PHE HB2 H 6.745 -3.210 -1.468 1.00 . A A . 52 PHE HB2 1 1 19 10649 1 1 31 PHE HB3 H 6.637 -1.473 -1.629 1.00 . A A . 52 PHE HB3 1 1 19 10650 1 1 31 PHE HD1 H 7.096 -4.655 -3.498 1.00 . A A . 52 PHE HD1 1 1 19 10651 1 1 31 PHE HD2 H 6.603 -0.379 -3.801 1.00 . A A . 52 PHE HD2 1 1 19 10652 1 1 31 PHE HE1 H 6.677 -4.867 -5.932 1.00 . A A . 52 PHE HE1 1 1 19 10653 1 1 31 PHE HE2 H 6.168 -0.601 -6.224 1.00 . A A . 52 PHE HE2 1 1 19 10654 1 1 31 PHE HZ H 6.218 -2.841 -7.304 1.00 . A A . 52 PHE HZ 1 1 19 10655 1 1 31 PHE N N 9.282 -1.219 -2.457 1.00 . A A . 52 PHE N 1 1 19 10656 1 1 31 PHE O O 9.610 -4.123 -0.511 1.00 . A A . 52 PHE O 1 1 19 10657 1 1 32 SER C C 11.968 -5.332 -2.168 1.00 . A A . 53 SER C 1 1 19 10658 1 1 32 SER CA C 10.621 -5.276 -2.912 1.00 . A A . 53 SER CA 1 1 19 10659 1 1 32 SER CB C 10.868 -5.536 -4.403 1.00 . A A . 53 SER CB 1 1 19 10660 1 1 32 SER H H 9.633 -3.509 -3.583 1.00 . A A . 53 SER H 1 1 19 10661 1 1 32 SER HA H 10.010 -6.093 -2.526 1.00 . A A . 53 SER HA 1 1 19 10662 1 1 32 SER HB2 H 11.498 -4.742 -4.809 1.00 . A A . 53 SER HB2 1 1 19 10663 1 1 32 SER HB3 H 11.383 -6.490 -4.525 1.00 . A A . 53 SER HB3 1 1 19 10664 1 1 32 SER HG H 9.834 -5.773 -6.051 1.00 . A A . 53 SER HG 1 1 19 10665 1 1 32 SER N N 9.866 -4.019 -2.742 1.00 . A A . 53 SER N 1 1 19 10666 1 1 32 SER O O 12.592 -6.395 -2.116 1.00 . A A . 53 SER O 1 1 19 10667 1 1 32 SER OG O 9.640 -5.577 -5.113 1.00 . A A . 53 SER OG 1 1 19 10668 1 1 33 LYS C C 13.455 -3.393 0.572 1.00 . A A . 54 LYS C 1 1 19 10669 1 1 33 LYS CA C 13.655 -4.080 -0.792 1.00 . A A . 54 LYS CA 1 1 19 10670 1 1 33 LYS CB C 14.742 -3.393 -1.644 1.00 . A A . 54 LYS CB 1 1 19 10671 1 1 33 LYS CD C 15.529 -1.209 -2.733 1.00 . A A . 54 LYS CD 1 1 19 10672 1 1 33 LYS CE C 16.526 -0.751 -1.658 1.00 . A A . 54 LYS CE 1 1 19 10673 1 1 33 LYS CG C 14.355 -1.975 -2.107 1.00 . A A . 54 LYS CG 1 1 19 10674 1 1 33 LYS H H 11.864 -3.373 -1.720 1.00 . A A . 54 LYS H 1 1 19 10675 1 1 33 LYS HA H 14.019 -5.081 -0.549 1.00 . A A . 54 LYS HA 1 1 19 10676 1 1 33 LYS HB2 H 15.664 -3.354 -1.064 1.00 . A A . 54 LYS HB2 1 1 19 10677 1 1 33 LYS HB3 H 14.938 -4.006 -2.526 1.00 . A A . 54 LYS HB3 1 1 19 10678 1 1 33 LYS HD2 H 16.028 -1.844 -3.466 1.00 . A A . 54 LYS HD2 1 1 19 10679 1 1 33 LYS HD3 H 15.133 -0.332 -3.245 1.00 . A A . 54 LYS HD3 1 1 19 10680 1 1 33 LYS HE2 H 15.995 -0.126 -0.934 1.00 . A A . 54 LYS HE2 1 1 19 10681 1 1 33 LYS HE3 H 16.906 -1.627 -1.126 1.00 . A A . 54 LYS HE3 1 1 19 10682 1 1 33 LYS HG2 H 13.563 -2.055 -2.853 1.00 . A A . 54 LYS HG2 1 1 19 10683 1 1 33 LYS HG3 H 13.974 -1.397 -1.263 1.00 . A A . 54 LYS HG3 1 1 19 10684 1 1 33 LYS HZ1 H 17.330 0.830 -2.744 1.00 . A A . 54 LYS HZ1 1 1 19 10685 1 1 33 LYS HZ2 H 18.296 0.325 -1.532 1.00 . A A . 54 LYS HZ2 1 1 19 10686 1 1 33 LYS HZ3 H 18.182 -0.557 -2.899 1.00 . A A . 54 LYS HZ3 1 1 19 10687 1 1 33 LYS N N 12.416 -4.212 -1.582 1.00 . A A . 54 LYS N 1 1 19 10688 1 1 33 LYS NZ N 17.656 0.012 -2.249 1.00 . A A . 54 LYS NZ 1 1 19 10689 1 1 33 LYS O O 14.436 -3.092 1.253 1.00 . A A . 54 LYS O 1 1 19 10690 1 1 34 GLN C C 10.530 -3.102 2.817 1.00 . A A . 55 GLN C 1 1 19 10691 1 1 34 GLN CA C 11.862 -2.548 2.276 1.00 . A A . 55 GLN CA 1 1 19 10692 1 1 34 GLN CB C 11.868 -1.010 2.123 1.00 . A A . 55 GLN CB 1 1 19 10693 1 1 34 GLN CD C 11.673 1.235 3.282 1.00 . A A . 55 GLN CD 1 1 19 10694 1 1 34 GLN CG C 11.726 -0.281 3.468 1.00 . A A . 55 GLN CG 1 1 19 10695 1 1 34 GLN H H 11.447 -3.445 0.377 1.00 . A A . 55 GLN H 1 1 19 10696 1 1 34 GLN HA H 12.631 -2.812 3.003 1.00 . A A . 55 GLN HA 1 1 19 10697 1 1 34 GLN HB2 H 12.814 -0.703 1.673 1.00 . A A . 55 GLN HB2 1 1 19 10698 1 1 34 GLN HB3 H 11.068 -0.697 1.451 1.00 . A A . 55 GLN HB3 1 1 19 10699 1 1 34 GLN HE21 H 9.653 1.262 3.330 1.00 . A A . 55 GLN HE21 1 1 19 10700 1 1 34 GLN HE22 H 10.448 2.822 3.140 1.00 . A A . 55 GLN HE22 1 1 19 10701 1 1 34 GLN HG2 H 10.817 -0.608 3.974 1.00 . A A . 55 GLN HG2 1 1 19 10702 1 1 34 GLN HG3 H 12.576 -0.528 4.103 1.00 . A A . 55 GLN HG3 1 1 19 10703 1 1 34 GLN N N 12.203 -3.156 0.983 1.00 . A A . 55 GLN N 1 1 19 10704 1 1 34 GLN NE2 N 10.496 1.821 3.248 1.00 . A A . 55 GLN NE2 1 1 19 10705 1 1 34 GLN O O 10.533 -4.015 3.644 1.00 . A A . 55 GLN O 1 1 19 10706 1 1 34 GLN OE1 O 12.685 1.915 3.163 1.00 . A A . 55 GLN OE1 1 1 19 10707 1 1 35 CYS C C 7.433 -4.159 2.660 1.00 . A A . 56 CYS C 1 1 19 10708 1 1 35 CYS CA C 8.070 -2.781 2.935 1.00 . A A . 56 CYS CA 1 1 19 10709 1 1 35 CYS CB C 7.171 -1.644 2.426 1.00 . A A . 56 CYS CB 1 1 19 10710 1 1 35 CYS H H 9.469 -1.815 1.687 1.00 . A A . 56 CYS H 1 1 19 10711 1 1 35 CYS HA H 8.161 -2.677 4.017 1.00 . A A . 56 CYS HA 1 1 19 10712 1 1 35 CYS HB2 H 7.043 -1.724 1.343 1.00 . A A . 56 CYS HB2 1 1 19 10713 1 1 35 CYS HB3 H 6.189 -1.724 2.898 1.00 . A A . 56 CYS HB3 1 1 19 10714 1 1 35 CYS N N 9.394 -2.581 2.339 1.00 . A A . 56 CYS N 1 1 19 10715 1 1 35 CYS O O 6.491 -4.555 3.355 1.00 . A A . 56 CYS O 1 1 19 10716 1 1 35 CYS SG S 7.935 -0.059 2.863 1.00 . A A . 56 CYS SG 1 1 19 10717 1 1 36 ARG C C 8.519 -7.201 0.848 1.00 . A A . 57 ARG C 1 1 19 10718 1 1 36 ARG CA C 7.403 -6.186 1.177 1.00 . A A . 57 ARG CA 1 1 19 10719 1 1 36 ARG CB C 6.474 -5.929 -0.034 1.00 . A A . 57 ARG CB 1 1 19 10720 1 1 36 ARG CD C 3.957 -5.985 0.480 1.00 . A A . 57 ARG CD 1 1 19 10721 1 1 36 ARG CG C 5.184 -6.773 -0.007 1.00 . A A . 57 ARG CG 1 1 19 10722 1 1 36 ARG CZ C 3.352 -4.497 2.397 1.00 . A A . 57 ARG CZ 1 1 19 10723 1 1 36 ARG H H 8.659 -4.456 1.100 1.00 . A A . 57 ARG H 1 1 19 10724 1 1 36 ARG HA H 6.831 -6.643 1.987 1.00 . A A . 57 ARG HA 1 1 19 10725 1 1 36 ARG HB2 H 6.191 -4.877 -0.073 1.00 . A A . 57 ARG HB2 1 1 19 10726 1 1 36 ARG HB3 H 7.020 -6.136 -0.956 1.00 . A A . 57 ARG HB3 1 1 19 10727 1 1 36 ARG HD2 H 3.716 -5.229 -0.271 1.00 . A A . 57 ARG HD2 1 1 19 10728 1 1 36 ARG HD3 H 3.108 -6.669 0.556 1.00 . A A . 57 ARG HD3 1 1 19 10729 1 1 36 ARG HE H 5.088 -5.413 2.207 1.00 . A A . 57 ARG HE 1 1 19 10730 1 1 36 ARG HG2 H 4.975 -7.115 -1.022 1.00 . A A . 57 ARG HG2 1 1 19 10731 1 1 36 ARG HG3 H 5.325 -7.658 0.616 1.00 . A A . 57 ARG HG3 1 1 19 10732 1 1 36 ARG HH11 H 1.864 -4.645 1.077 1.00 . A A . 57 ARG HH11 1 1 19 10733 1 1 36 ARG HH12 H 1.642 -3.460 2.339 1.00 . A A . 57 ARG HH12 1 1 19 10734 1 1 36 ARG HH21 H 4.683 -4.049 3.809 1.00 . A A . 57 ARG HH21 1 1 19 10735 1 1 36 ARG HH22 H 3.098 -3.309 3.994 1.00 . A A . 57 ARG HH22 1 1 19 10736 1 1 36 ARG N N 7.925 -4.889 1.653 1.00 . A A . 57 ARG N 1 1 19 10737 1 1 36 ARG NE N 4.176 -5.320 1.780 1.00 . A A . 57 ARG NE 1 1 19 10738 1 1 36 ARG NH1 N 2.156 -4.244 1.961 1.00 . A A . 57 ARG NH1 1 1 19 10739 1 1 36 ARG NH2 N 3.736 -3.891 3.481 1.00 . A A . 57 ARG NH2 1 1 19 10740 1 1 36 ARG O O 8.258 -8.217 0.200 1.00 . A A . 57 ARG O 1 1 19 10741 1 1 37 SER C C 10.788 -9.169 1.662 1.00 . A A . 58 SER C 1 1 19 10742 1 1 37 SER CA C 10.968 -7.738 1.128 1.00 . A A . 58 SER CA 1 1 19 10743 1 1 37 SER CB C 12.139 -7.035 1.819 1.00 . A A . 58 SER CB 1 1 19 10744 1 1 37 SER H H 9.837 -6.067 1.828 1.00 . A A . 58 SER H 1 1 19 10745 1 1 37 SER HA H 11.202 -7.816 0.065 1.00 . A A . 58 SER HA 1 1 19 10746 1 1 37 SER HB2 H 12.168 -5.988 1.506 1.00 . A A . 58 SER HB2 1 1 19 10747 1 1 37 SER HB3 H 12.002 -7.071 2.903 1.00 . A A . 58 SER HB3 1 1 19 10748 1 1 37 SER HG H 14.093 -7.263 1.959 1.00 . A A . 58 SER HG 1 1 19 10749 1 1 37 SER N N 9.755 -6.910 1.282 1.00 . A A . 58 SER N 1 1 19 10750 1 1 37 SER O O 11.029 -10.135 0.901 1.00 . A A . 58 SER O 1 1 19 10751 1 1 37 SER OXT O 10.382 -9.326 2.841 1.00 . A A . 58 SER OXT 1 1 19 10752 1 1 37 SER OG O 13.355 -7.663 1.453 1.00 . A A . 58 SER OG 1 1 19 10753 2 2 1 ZN ZN ZN -8.266 0.424 3.767 1.00 . B A . 1059 ZN ZN 1 1 19 10754 3 2 1 ZN ZN ZN 6.878 1.466 1.801 1.00 . C A . 1060 ZN ZN 1 1 20 10755 1 1 1 GLN C C -6.361 -1.513 -4.480 1.00 . A A . 22 GLN C 1 1 20 10756 1 1 1 GLN CA C -6.123 -1.059 -5.918 1.00 . A A . 22 GLN CA 1 1 20 10757 1 1 1 GLN CB C -4.718 -0.431 -6.032 1.00 . A A . 22 GLN CB 1 1 20 10758 1 1 1 GLN CD C -2.841 0.364 -7.585 1.00 . A A . 22 GLN CD 1 1 20 10759 1 1 1 GLN CG C -4.272 -0.173 -7.483 1.00 . A A . 22 GLN CG 1 1 20 10760 1 1 1 GLN H1 H -8.109 -0.567 -6.214 1.00 . A A . 22 GLN H1 1 1 20 10761 1 1 1 GLN H2 H -7.193 0.699 -5.734 1.00 . A A . 22 GLN H2 1 1 20 10762 1 1 1 GLN H3 H -7.099 0.158 -7.288 1.00 . A A . 22 GLN H3 1 1 20 10763 1 1 1 GLN HA H -6.157 -1.942 -6.556 1.00 . A A . 22 GLN HA 1 1 20 10764 1 1 1 GLN HB2 H -4.690 0.510 -5.476 1.00 . A A . 22 GLN HB2 1 1 20 10765 1 1 1 GLN HB3 H -4.003 -1.117 -5.576 1.00 . A A . 22 GLN HB3 1 1 20 10766 1 1 1 GLN HE21 H -3.034 0.795 -9.554 1.00 . A A . 22 GLN HE21 1 1 20 10767 1 1 1 GLN HE22 H -1.481 1.164 -8.812 1.00 . A A . 22 GLN HE22 1 1 20 10768 1 1 1 GLN HG2 H -4.329 -1.104 -8.049 1.00 . A A . 22 GLN HG2 1 1 20 10769 1 1 1 GLN HG3 H -4.942 0.551 -7.946 1.00 . A A . 22 GLN HG3 1 1 20 10770 1 1 1 GLN N N -7.204 -0.125 -6.325 1.00 . A A . 22 GLN N 1 1 20 10771 1 1 1 GLN NE2 N -2.424 0.812 -8.749 1.00 . A A . 22 GLN NE2 1 1 20 10772 1 1 1 GLN O O -6.531 -0.670 -3.605 1.00 . A A . 22 GLN O 1 1 20 10773 1 1 1 GLN OE1 O -2.069 0.398 -6.636 1.00 . A A . 22 GLN OE1 1 1 20 10774 1 1 2 THR C C -5.928 -2.819 -1.747 1.00 . A A . 23 THR C 1 1 20 10775 1 1 2 THR CA C -6.732 -3.416 -2.907 1.00 . A A . 23 THR CA 1 1 20 10776 1 1 2 THR CB C -6.541 -4.943 -2.951 1.00 . A A . 23 THR CB 1 1 20 10777 1 1 2 THR CG2 C -7.160 -5.662 -1.752 1.00 . A A . 23 THR CG2 1 1 20 10778 1 1 2 THR H H -6.269 -3.479 -4.981 1.00 . A A . 23 THR H 1 1 20 10779 1 1 2 THR HA H -7.781 -3.218 -2.712 1.00 . A A . 23 THR HA 1 1 20 10780 1 1 2 THR HB H -5.476 -5.174 -3.003 1.00 . A A . 23 THR HB 1 1 20 10781 1 1 2 THR HG1 H -6.961 -6.401 -4.170 1.00 . A A . 23 THR HG1 1 1 20 10782 1 1 2 THR HG21 H -8.226 -5.442 -1.695 1.00 . A A . 23 THR HG21 1 1 20 10783 1 1 2 THR HG22 H -7.024 -6.739 -1.860 1.00 . A A . 23 THR HG22 1 1 20 10784 1 1 2 THR HG23 H -6.670 -5.350 -0.829 1.00 . A A . 23 THR HG23 1 1 20 10785 1 1 2 THR N N -6.400 -2.823 -4.222 1.00 . A A . 23 THR N 1 1 20 10786 1 1 2 THR O O -4.716 -2.632 -1.862 1.00 . A A . 23 THR O 1 1 20 10787 1 1 2 THR OG1 O -7.181 -5.455 -4.102 1.00 . A A . 23 THR OG1 1 1 20 10788 1 1 3 CYS C C -4.870 -2.795 1.190 1.00 . A A . 24 CYS C 1 1 20 10789 1 1 3 CYS CA C -6.025 -1.965 0.590 1.00 . A A . 24 CYS CA 1 1 20 10790 1 1 3 CYS CB C -7.164 -1.853 1.606 1.00 . A A . 24 CYS CB 1 1 20 10791 1 1 3 CYS H H -7.604 -2.660 -0.647 1.00 . A A . 24 CYS H 1 1 20 10792 1 1 3 CYS HA H -5.659 -0.962 0.361 1.00 . A A . 24 CYS HA 1 1 20 10793 1 1 3 CYS HB2 H -8.045 -1.434 1.126 1.00 . A A . 24 CYS HB2 1 1 20 10794 1 1 3 CYS HB3 H -7.417 -2.849 1.971 1.00 . A A . 24 CYS HB3 1 1 20 10795 1 1 3 CYS N N -6.602 -2.533 -0.631 1.00 . A A . 24 CYS N 1 1 20 10796 1 1 3 CYS O O -4.864 -4.027 1.109 1.00 . A A . 24 CYS O 1 1 20 10797 1 1 3 CYS SG S -6.654 -0.788 2.978 1.00 . A A . 24 CYS SG 1 1 20 10798 1 1 4 TYR C C -3.569 -3.450 4.015 1.00 . A A . 25 TYR C 1 1 20 10799 1 1 4 TYR CA C -2.962 -2.770 2.768 1.00 . A A . 25 TYR CA 1 1 20 10800 1 1 4 TYR CB C -1.881 -1.755 3.183 1.00 . A A . 25 TYR CB 1 1 20 10801 1 1 4 TYR CD1 C -3.249 -0.013 4.462 1.00 . A A . 25 TYR CD1 1 1 20 10802 1 1 4 TYR CD2 C -1.373 -1.097 5.576 1.00 . A A . 25 TYR CD2 1 1 20 10803 1 1 4 TYR CE1 C -3.526 0.715 5.636 1.00 . A A . 25 TYR CE1 1 1 20 10804 1 1 4 TYR CE2 C -1.638 -0.364 6.747 1.00 . A A . 25 TYR CE2 1 1 20 10805 1 1 4 TYR CG C -2.175 -0.927 4.428 1.00 . A A . 25 TYR CG 1 1 20 10806 1 1 4 TYR CZ C -2.719 0.543 6.780 1.00 . A A . 25 TYR CZ 1 1 20 10807 1 1 4 TYR H H -4.027 -1.117 1.924 1.00 . A A . 25 TYR H 1 1 20 10808 1 1 4 TYR HA H -2.475 -3.556 2.195 1.00 . A A . 25 TYR HA 1 1 20 10809 1 1 4 TYR HB2 H -0.977 -2.332 3.373 1.00 . A A . 25 TYR HB2 1 1 20 10810 1 1 4 TYR HB3 H -1.658 -1.088 2.352 1.00 . A A . 25 TYR HB3 1 1 20 10811 1 1 4 TYR HD1 H -3.878 0.121 3.592 1.00 . A A . 25 TYR HD1 1 1 20 10812 1 1 4 TYR HD2 H -0.551 -1.802 5.563 1.00 . A A . 25 TYR HD2 1 1 20 10813 1 1 4 TYR HE1 H -4.363 1.392 5.677 1.00 . A A . 25 TYR HE1 1 1 20 10814 1 1 4 TYR HE2 H -1.022 -0.500 7.625 1.00 . A A . 25 TYR HE2 1 1 20 10815 1 1 4 TYR HH H -2.382 1.014 8.636 1.00 . A A . 25 TYR HH 1 1 20 10816 1 1 4 TYR N N -3.947 -2.125 1.888 1.00 . A A . 25 TYR N 1 1 20 10817 1 1 4 TYR O O -2.894 -4.251 4.666 1.00 . A A . 25 TYR O 1 1 20 10818 1 1 4 TYR OH O -2.997 1.241 7.915 1.00 . A A . 25 TYR OH 1 1 20 10819 1 1 5 ASN C C -6.917 -4.038 5.423 1.00 . A A . 26 ASN C 1 1 20 10820 1 1 5 ASN CA C -5.479 -3.515 5.612 1.00 . A A . 26 ASN CA 1 1 20 10821 1 1 5 ASN CB C -5.459 -2.264 6.512 1.00 . A A . 26 ASN CB 1 1 20 10822 1 1 5 ASN CG C -6.240 -2.452 7.803 1.00 . A A . 26 ASN CG 1 1 20 10823 1 1 5 ASN H H -5.300 -2.460 3.766 1.00 . A A . 26 ASN H 1 1 20 10824 1 1 5 ASN HA H -4.913 -4.307 6.108 1.00 . A A . 26 ASN HA 1 1 20 10825 1 1 5 ASN HB2 H -4.428 -2.022 6.767 1.00 . A A . 26 ASN HB2 1 1 20 10826 1 1 5 ASN HB3 H -5.878 -1.413 5.973 1.00 . A A . 26 ASN HB3 1 1 20 10827 1 1 5 ASN HD21 H -7.923 -1.615 7.034 1.00 . A A . 26 ASN HD21 1 1 20 10828 1 1 5 ASN HD22 H -8.003 -2.158 8.703 1.00 . A A . 26 ASN HD22 1 1 20 10829 1 1 5 ASN N N -4.829 -3.140 4.350 1.00 . A A . 26 ASN N 1 1 20 10830 1 1 5 ASN ND2 N -7.484 -2.028 7.849 1.00 . A A . 26 ASN ND2 1 1 20 10831 1 1 5 ASN O O -7.278 -5.073 5.989 1.00 . A A . 26 ASN O 1 1 20 10832 1 1 5 ASN OD1 O -5.743 -2.989 8.783 1.00 . A A . 26 ASN OD1 1 1 20 10833 1 1 6 CYS C C -9.648 -4.666 3.642 1.00 . A A . 27 CYS C 1 1 20 10834 1 1 6 CYS CA C -9.185 -3.515 4.569 1.00 . A A . 27 CYS CA 1 1 20 10835 1 1 6 CYS CB C -9.805 -2.172 4.147 1.00 . A A . 27 CYS CB 1 1 20 10836 1 1 6 CYS H H -7.370 -2.487 4.214 1.00 . A A . 27 CYS H 1 1 20 10837 1 1 6 CYS HA H -9.545 -3.745 5.574 1.00 . A A . 27 CYS HA 1 1 20 10838 1 1 6 CYS HB2 H -9.525 -1.954 3.114 1.00 . A A . 27 CYS HB2 1 1 20 10839 1 1 6 CYS HB3 H -10.895 -2.261 4.187 1.00 . A A . 27 CYS HB3 1 1 20 10840 1 1 6 CYS N N -7.732 -3.332 4.635 1.00 . A A . 27 CYS N 1 1 20 10841 1 1 6 CYS O O -10.835 -4.997 3.626 1.00 . A A . 27 CYS O 1 1 20 10842 1 1 6 CYS SG S -9.270 -0.825 5.248 1.00 . A A . 27 CYS SG 1 1 20 10843 1 1 7 GLY C C -10.081 -6.016 0.847 1.00 . A A . 28 GLY C 1 1 20 10844 1 1 7 GLY CA C -9.038 -6.364 1.924 1.00 . A A . 28 GLY CA 1 1 20 10845 1 1 7 GLY H H -7.777 -4.973 2.956 1.00 . A A . 28 GLY H 1 1 20 10846 1 1 7 GLY HA2 H -9.397 -7.225 2.487 1.00 . A A . 28 GLY HA2 1 1 20 10847 1 1 7 GLY HA3 H -8.117 -6.647 1.414 1.00 . A A . 28 GLY HA3 1 1 20 10848 1 1 7 GLY N N -8.738 -5.266 2.860 1.00 . A A . 28 GLY N 1 1 20 10849 1 1 7 GLY O O -10.885 -6.870 0.464 1.00 . A A . 28 GLY O 1 1 20 10850 1 1 8 LYS C C -10.575 -3.489 -1.691 1.00 . A A . 29 LYS C 1 1 20 10851 1 1 8 LYS CA C -11.162 -4.144 -0.423 1.00 . A A . 29 LYS CA 1 1 20 10852 1 1 8 LYS CB C -11.899 -3.140 0.489 1.00 . A A . 29 LYS CB 1 1 20 10853 1 1 8 LYS CD C -14.257 -3.272 -0.592 1.00 . A A . 29 LYS CD 1 1 20 10854 1 1 8 LYS CE C -14.870 -4.121 0.536 1.00 . A A . 29 LYS CE 1 1 20 10855 1 1 8 LYS CG C -13.074 -2.386 -0.160 1.00 . A A . 29 LYS CG 1 1 20 10856 1 1 8 LYS H H -9.384 -4.140 0.759 1.00 . A A . 29 LYS H 1 1 20 10857 1 1 8 LYS HA H -11.883 -4.909 -0.707 1.00 . A A . 29 LYS HA 1 1 20 10858 1 1 8 LYS HB2 H -12.265 -3.668 1.370 1.00 . A A . 29 LYS HB2 1 1 20 10859 1 1 8 LYS HB3 H -11.179 -2.408 0.848 1.00 . A A . 29 LYS HB3 1 1 20 10860 1 1 8 LYS HD2 H -15.033 -2.634 -1.018 1.00 . A A . 29 LYS HD2 1 1 20 10861 1 1 8 LYS HD3 H -13.924 -3.944 -1.384 1.00 . A A . 29 LYS HD3 1 1 20 10862 1 1 8 LYS HE2 H -15.621 -4.784 0.093 1.00 . A A . 29 LYS HE2 1 1 20 10863 1 1 8 LYS HE3 H -14.094 -4.757 0.971 1.00 . A A . 29 LYS HE3 1 1 20 10864 1 1 8 LYS HG2 H -13.436 -1.642 0.551 1.00 . A A . 29 LYS HG2 1 1 20 10865 1 1 8 LYS HG3 H -12.713 -1.840 -1.033 1.00 . A A . 29 LYS HG3 1 1 20 10866 1 1 8 LYS HZ1 H -16.241 -2.708 1.211 1.00 . A A . 29 LYS HZ1 1 1 20 10867 1 1 8 LYS HZ2 H -15.934 -3.876 2.303 1.00 . A A . 29 LYS HZ2 1 1 20 10868 1 1 8 LYS HZ3 H -14.842 -2.693 2.059 1.00 . A A . 29 LYS HZ3 1 1 20 10869 1 1 8 LYS N N -10.095 -4.756 0.389 1.00 . A A . 29 LYS N 1 1 20 10870 1 1 8 LYS NZ N -15.510 -3.291 1.594 1.00 . A A . 29 LYS NZ 1 1 20 10871 1 1 8 LYS O O -9.853 -2.498 -1.550 1.00 . A A . 29 LYS O 1 1 20 10872 1 1 9 PRO C C -10.434 -2.014 -4.468 1.00 . A A . 30 PRO C 1 1 20 10873 1 1 9 PRO CA C -10.291 -3.519 -4.187 1.00 . A A . 30 PRO CA 1 1 20 10874 1 1 9 PRO CB C -10.990 -4.337 -5.277 1.00 . A A . 30 PRO CB 1 1 20 10875 1 1 9 PRO CD C -11.577 -5.251 -3.154 1.00 . A A . 30 PRO CD 1 1 20 10876 1 1 9 PRO CG C -11.254 -5.668 -4.587 1.00 . A A . 30 PRO CG 1 1 20 10877 1 1 9 PRO HA H -9.232 -3.767 -4.219 1.00 . A A . 30 PRO HA 1 1 20 10878 1 1 9 PRO HB2 H -11.942 -3.876 -5.547 1.00 . A A . 30 PRO HB2 1 1 20 10879 1 1 9 PRO HB3 H -10.360 -4.459 -6.158 1.00 . A A . 30 PRO HB3 1 1 20 10880 1 1 9 PRO HD2 H -12.647 -5.061 -3.064 1.00 . A A . 30 PRO HD2 1 1 20 10881 1 1 9 PRO HD3 H -11.275 -6.045 -2.471 1.00 . A A . 30 PRO HD3 1 1 20 10882 1 1 9 PRO HG2 H -12.084 -6.208 -5.048 1.00 . A A . 30 PRO HG2 1 1 20 10883 1 1 9 PRO HG3 H -10.348 -6.276 -4.596 1.00 . A A . 30 PRO HG3 1 1 20 10884 1 1 9 PRO N N -10.839 -4.014 -2.910 1.00 . A A . 30 PRO N 1 1 20 10885 1 1 9 PRO O O -9.549 -1.421 -5.088 1.00 . A A . 30 PRO O 1 1 20 10886 1 1 10 GLY C C -11.039 1.039 -3.387 1.00 . A A . 31 GLY C 1 1 20 10887 1 1 10 GLY CA C -11.852 0.034 -4.215 1.00 . A A . 31 GLY CA 1 1 20 10888 1 1 10 GLY H H -12.200 -1.946 -3.509 1.00 . A A . 31 GLY H 1 1 20 10889 1 1 10 GLY HA2 H -12.909 0.185 -3.993 1.00 . A A . 31 GLY HA2 1 1 20 10890 1 1 10 GLY HA3 H -11.695 0.269 -5.268 1.00 . A A . 31 GLY HA3 1 1 20 10891 1 1 10 GLY N N -11.515 -1.384 -3.994 1.00 . A A . 31 GLY N 1 1 20 10892 1 1 10 GLY O O -11.577 2.063 -2.954 1.00 . A A . 31 GLY O 1 1 20 10893 1 1 11 HIS C C -7.852 2.364 -3.249 1.00 . A A . 32 HIS C 1 1 20 10894 1 1 11 HIS CA C -8.848 1.595 -2.367 1.00 . A A . 32 HIS CA 1 1 20 10895 1 1 11 HIS CB C -8.146 0.758 -1.285 1.00 . A A . 32 HIS CB 1 1 20 10896 1 1 11 HIS CD2 C -8.583 1.320 1.173 1.00 . A A . 32 HIS CD2 1 1 20 10897 1 1 11 HIS CE1 C -10.449 0.217 1.504 1.00 . A A . 32 HIS CE1 1 1 20 10898 1 1 11 HIS CG C -8.923 0.711 0.000 1.00 . A A . 32 HIS CG 1 1 20 10899 1 1 11 HIS H H -9.386 -0.100 -3.536 1.00 . A A . 32 HIS H 1 1 20 10900 1 1 11 HIS HA H -9.431 2.357 -1.853 1.00 . A A . 32 HIS HA 1 1 20 10901 1 1 11 HIS HB2 H -8.004 -0.262 -1.635 1.00 . A A . 32 HIS HB2 1 1 20 10902 1 1 11 HIS HB3 H -7.160 1.175 -1.072 1.00 . A A . 32 HIS HB3 1 1 20 10903 1 1 11 HIS HD1 H -10.552 -0.578 -0.449 1.00 . A A . 32 HIS HD1 1 1 20 10904 1 1 11 HIS HD2 H -7.710 1.940 1.324 1.00 . A A . 32 HIS HD2 1 1 20 10905 1 1 11 HIS HE1 H -11.326 -0.213 1.975 1.00 . A A . 32 HIS HE1 1 1 20 10906 1 1 11 HIS N N -9.763 0.747 -3.132 1.00 . A A . 32 HIS N 1 1 20 10907 1 1 11 HIS ND1 N -10.089 0.024 0.222 1.00 . A A . 32 HIS ND1 1 1 20 10908 1 1 11 HIS NE2 N -9.541 0.983 2.138 1.00 . A A . 32 HIS NE2 1 1 20 10909 1 1 11 HIS O O -7.583 2.022 -4.404 1.00 . A A . 32 HIS O 1 1 20 10910 1 1 12 LEU C C -5.626 5.064 -2.049 1.00 . A A . 33 LEU C 1 1 20 10911 1 1 12 LEU CA C -6.432 4.454 -3.211 1.00 . A A . 33 LEU CA 1 1 20 10912 1 1 12 LEU CB C -7.268 5.571 -3.883 1.00 . A A . 33 LEU CB 1 1 20 10913 1 1 12 LEU CD1 C -8.874 6.387 -5.626 1.00 . A A . 33 LEU CD1 1 1 20 10914 1 1 12 LEU CD2 C -7.089 4.814 -6.310 1.00 . A A . 33 LEU CD2 1 1 20 10915 1 1 12 LEU CG C -8.033 5.196 -5.166 1.00 . A A . 33 LEU CG 1 1 20 10916 1 1 12 LEU H H -7.570 3.580 -1.687 1.00 . A A . 33 LEU H 1 1 20 10917 1 1 12 LEU HA H -5.737 4.008 -3.924 1.00 . A A . 33 LEU HA 1 1 20 10918 1 1 12 LEU HB2 H -7.990 5.937 -3.151 1.00 . A A . 33 LEU HB2 1 1 20 10919 1 1 12 LEU HB3 H -6.608 6.406 -4.129 1.00 . A A . 33 LEU HB3 1 1 20 10920 1 1 12 LEU HD11 H -9.577 6.664 -4.840 1.00 . A A . 33 LEU HD11 1 1 20 10921 1 1 12 LEU HD12 H -8.231 7.241 -5.847 1.00 . A A . 33 LEU HD12 1 1 20 10922 1 1 12 LEU HD13 H -9.438 6.119 -6.519 1.00 . A A . 33 LEU HD13 1 1 20 10923 1 1 12 LEU HD21 H -6.399 5.632 -6.517 1.00 . A A . 33 LEU HD21 1 1 20 10924 1 1 12 LEU HD22 H -6.523 3.923 -6.045 1.00 . A A . 33 LEU HD22 1 1 20 10925 1 1 12 LEU HD23 H -7.669 4.599 -7.207 1.00 . A A . 33 LEU HD23 1 1 20 10926 1 1 12 LEU HG H -8.712 4.370 -4.965 1.00 . A A . 33 LEU HG 1 1 20 10927 1 1 12 LEU N N -7.333 3.443 -2.660 1.00 . A A . 33 LEU N 1 1 20 10928 1 1 12 LEU O O -5.982 4.878 -0.881 1.00 . A A . 33 LEU O 1 1 20 10929 1 1 13 SER C C -4.802 7.745 -0.638 1.00 . A A . 34 SER C 1 1 20 10930 1 1 13 SER CA C -3.906 6.742 -1.396 1.00 . A A . 34 SER CA 1 1 20 10931 1 1 13 SER CB C -2.797 7.506 -2.130 1.00 . A A . 34 SER CB 1 1 20 10932 1 1 13 SER H H -4.398 6.022 -3.337 1.00 . A A . 34 SER H 1 1 20 10933 1 1 13 SER HA H -3.435 6.104 -0.647 1.00 . A A . 34 SER HA 1 1 20 10934 1 1 13 SER HB2 H -2.311 8.199 -1.440 1.00 . A A . 34 SER HB2 1 1 20 10935 1 1 13 SER HB3 H -2.056 6.793 -2.494 1.00 . A A . 34 SER HB3 1 1 20 10936 1 1 13 SER HG H -2.609 8.700 -3.677 1.00 . A A . 34 SER HG 1 1 20 10937 1 1 13 SER N N -4.619 5.882 -2.360 1.00 . A A . 34 SER N 1 1 20 10938 1 1 13 SER O O -4.402 8.272 0.402 1.00 . A A . 34 SER O 1 1 20 10939 1 1 13 SER OG O -3.336 8.223 -3.232 1.00 . A A . 34 SER OG 1 1 20 10940 1 1 14 SER C C -8.078 7.982 0.326 1.00 . A A . 35 SER C 1 1 20 10941 1 1 14 SER CA C -7.067 8.805 -0.495 1.00 . A A . 35 SER CA 1 1 20 10942 1 1 14 SER CB C -7.814 9.592 -1.578 1.00 . A A . 35 SER CB 1 1 20 10943 1 1 14 SER H H -6.242 7.607 -2.040 1.00 . A A . 35 SER H 1 1 20 10944 1 1 14 SER HA H -6.608 9.525 0.182 1.00 . A A . 35 SER HA 1 1 20 10945 1 1 14 SER HB2 H -8.623 10.167 -1.122 1.00 . A A . 35 SER HB2 1 1 20 10946 1 1 14 SER HB3 H -7.121 10.286 -2.055 1.00 . A A . 35 SER HB3 1 1 20 10947 1 1 14 SER HG H -8.823 9.243 -3.221 1.00 . A A . 35 SER HG 1 1 20 10948 1 1 14 SER N N -6.018 7.996 -1.136 1.00 . A A . 35 SER N 1 1 20 10949 1 1 14 SER O O -8.886 8.561 1.058 1.00 . A A . 35 SER O 1 1 20 10950 1 1 14 SER OG O -8.343 8.708 -2.558 1.00 . A A . 35 SER OG 1 1 20 10951 1 1 15 GLN C C -8.287 5.159 2.222 1.00 . A A . 36 GLN C 1 1 20 10952 1 1 15 GLN CA C -8.946 5.730 0.947 1.00 . A A . 36 GLN CA 1 1 20 10953 1 1 15 GLN CB C -9.364 4.605 -0.022 1.00 . A A . 36 GLN CB 1 1 20 10954 1 1 15 GLN CD C -11.909 4.664 -0.106 1.00 . A A . 36 GLN CD 1 1 20 10955 1 1 15 GLN CG C -10.675 3.902 0.372 1.00 . A A . 36 GLN CG 1 1 20 10956 1 1 15 GLN H H -7.319 6.237 -0.343 1.00 . A A . 36 GLN H 1 1 20 10957 1 1 15 GLN HA H -9.843 6.274 1.244 1.00 . A A . 36 GLN HA 1 1 20 10958 1 1 15 GLN HB2 H -9.486 5.012 -1.027 1.00 . A A . 36 GLN HB2 1 1 20 10959 1 1 15 GLN HB3 H -8.565 3.867 -0.059 1.00 . A A . 36 GLN HB3 1 1 20 10960 1 1 15 GLN HE21 H -12.094 3.541 -1.797 1.00 . A A . 36 GLN HE21 1 1 20 10961 1 1 15 GLN HE22 H -13.279 4.823 -1.561 1.00 . A A . 36 GLN HE22 1 1 20 10962 1 1 15 GLN HG2 H -10.696 2.913 -0.084 1.00 . A A . 36 GLN HG2 1 1 20 10963 1 1 15 GLN HG3 H -10.723 3.765 1.451 1.00 . A A . 36 GLN HG3 1 1 20 10964 1 1 15 GLN N N -8.038 6.645 0.239 1.00 . A A . 36 GLN N 1 1 20 10965 1 1 15 GLN NE2 N -12.464 4.316 -1.250 1.00 . A A . 36 GLN NE2 1 1 20 10966 1 1 15 GLN O O -8.917 5.155 3.281 1.00 . A A . 36 GLN O 1 1 20 10967 1 1 15 GLN OE1 O -12.391 5.589 0.534 1.00 . A A . 36 GLN OE1 1 1 20 10968 1 1 16 CYS C C -4.663 4.932 2.922 1.00 . A A . 37 CYS C 1 1 20 10969 1 1 16 CYS CA C -6.091 4.426 3.223 1.00 . A A . 37 CYS CA 1 1 20 10970 1 1 16 CYS CB C -6.075 2.898 3.447 1.00 . A A . 37 CYS CB 1 1 20 10971 1 1 16 CYS H H -6.572 4.856 1.210 1.00 . A A . 37 CYS H 1 1 20 10972 1 1 16 CYS HA H -6.421 4.911 4.141 1.00 . A A . 37 CYS HA 1 1 20 10973 1 1 16 CYS HB2 H -6.034 2.379 2.488 1.00 . A A . 37 CYS HB2 1 1 20 10974 1 1 16 CYS HB3 H -5.171 2.620 3.988 1.00 . A A . 37 CYS HB3 1 1 20 10975 1 1 16 CYS N N -7.003 4.778 2.125 1.00 . A A . 37 CYS N 1 1 20 10976 1 1 16 CYS O O -4.367 5.399 1.819 1.00 . A A . 37 CYS O 1 1 20 10977 1 1 16 CYS SG S -7.493 2.362 4.439 1.00 . A A . 37 CYS SG 1 1 20 10978 1 1 17 ARG C C -1.585 4.676 2.640 1.00 . A A . 38 ARG C 1 1 20 10979 1 1 17 ARG CA C -2.356 5.248 3.839 1.00 . A A . 38 ARG CA 1 1 20 10980 1 1 17 ARG CB C -1.620 4.932 5.157 1.00 . A A . 38 ARG CB 1 1 20 10981 1 1 17 ARG CD C -3.119 4.469 7.165 1.00 . A A . 38 ARG CD 1 1 20 10982 1 1 17 ARG CG C -2.298 5.523 6.409 1.00 . A A . 38 ARG CG 1 1 20 10983 1 1 17 ARG CZ C -4.920 4.446 8.895 1.00 . A A . 38 ARG CZ 1 1 20 10984 1 1 17 ARG H H -4.103 4.417 4.776 1.00 . A A . 38 ARG H 1 1 20 10985 1 1 17 ARG HA H -2.349 6.331 3.701 1.00 . A A . 38 ARG HA 1 1 20 10986 1 1 17 ARG HB2 H -1.522 3.852 5.271 1.00 . A A . 38 ARG HB2 1 1 20 10987 1 1 17 ARG HB3 H -0.613 5.351 5.088 1.00 . A A . 38 ARG HB3 1 1 20 10988 1 1 17 ARG HD2 H -3.686 3.865 6.456 1.00 . A A . 38 ARG HD2 1 1 20 10989 1 1 17 ARG HD3 H -2.427 3.812 7.696 1.00 . A A . 38 ARG HD3 1 1 20 10990 1 1 17 ARG HE H -4.069 6.091 8.174 1.00 . A A . 38 ARG HE 1 1 20 10991 1 1 17 ARG HG2 H -1.530 5.903 7.083 1.00 . A A . 38 ARG HG2 1 1 20 10992 1 1 17 ARG HG3 H -2.935 6.361 6.119 1.00 . A A . 38 ARG HG3 1 1 20 10993 1 1 17 ARG HH11 H -4.312 2.595 8.423 1.00 . A A . 38 ARG HH11 1 1 20 10994 1 1 17 ARG HH12 H -5.646 2.688 9.544 1.00 . A A . 38 ARG HH12 1 1 20 10995 1 1 17 ARG HH21 H -5.748 6.121 9.633 1.00 . A A . 38 ARG HH21 1 1 20 10996 1 1 17 ARG HH22 H -6.411 4.628 10.227 1.00 . A A . 38 ARG HH22 1 1 20 10997 1 1 17 ARG N N -3.764 4.805 3.908 1.00 . A A . 38 ARG N 1 1 20 10998 1 1 17 ARG NE N -4.056 5.085 8.123 1.00 . A A . 38 ARG NE 1 1 20 10999 1 1 17 ARG NH1 N -4.982 3.145 8.945 1.00 . A A . 38 ARG NH1 1 1 20 11000 1 1 17 ARG NH2 N -5.752 5.115 9.642 1.00 . A A . 38 ARG NH2 1 1 20 11001 1 1 17 ARG O O -0.749 5.382 2.073 1.00 . A A . 38 ARG O 1 1 20 11002 1 1 18 ALA C C -2.292 1.643 0.540 1.00 . A A . 39 ALA C 1 1 20 11003 1 1 18 ALA CA C -1.395 2.820 0.997 1.00 . A A . 39 ALA CA 1 1 20 11004 1 1 18 ALA CB C 0.033 2.308 1.252 1.00 . A A . 39 ALA CB 1 1 20 11005 1 1 18 ALA H H -2.574 2.930 2.759 1.00 . A A . 39 ALA H 1 1 20 11006 1 1 18 ALA HA H -1.373 3.573 0.209 1.00 . A A . 39 ALA HA 1 1 20 11007 1 1 18 ALA HB1 H 0.011 1.557 2.041 1.00 . A A . 39 ALA HB1 1 1 20 11008 1 1 18 ALA HB2 H 0.433 1.847 0.349 1.00 . A A . 39 ALA HB2 1 1 20 11009 1 1 18 ALA HB3 H 0.685 3.130 1.547 1.00 . A A . 39 ALA HB3 1 1 20 11010 1 1 18 ALA N N -1.887 3.443 2.228 1.00 . A A . 39 ALA N 1 1 20 11011 1 1 18 ALA O O -3.002 1.053 1.361 1.00 . A A . 39 ALA O 1 1 20 11012 1 1 19 PRO C C -1.698 -1.189 -0.735 1.00 . A A . 40 PRO C 1 1 20 11013 1 1 19 PRO CA C -2.676 -0.083 -1.191 1.00 . A A . 40 PRO CA 1 1 20 11014 1 1 19 PRO CB C -2.751 0.033 -2.718 1.00 . A A . 40 PRO CB 1 1 20 11015 1 1 19 PRO CD C -1.632 1.973 -1.858 1.00 . A A . 40 PRO CD 1 1 20 11016 1 1 19 PRO CG C -1.627 1.015 -3.048 1.00 . A A . 40 PRO CG 1 1 20 11017 1 1 19 PRO HA H -3.667 -0.305 -0.797 1.00 . A A . 40 PRO HA 1 1 20 11018 1 1 19 PRO HB2 H -2.616 -0.923 -3.224 1.00 . A A . 40 PRO HB2 1 1 20 11019 1 1 19 PRO HB3 H -3.710 0.474 -2.997 1.00 . A A . 40 PRO HB3 1 1 20 11020 1 1 19 PRO HD2 H -0.614 2.294 -1.637 1.00 . A A . 40 PRO HD2 1 1 20 11021 1 1 19 PRO HD3 H -2.254 2.840 -2.089 1.00 . A A . 40 PRO HD3 1 1 20 11022 1 1 19 PRO HG2 H -0.675 0.484 -3.085 1.00 . A A . 40 PRO HG2 1 1 20 11023 1 1 19 PRO HG3 H -1.810 1.539 -3.986 1.00 . A A . 40 PRO HG3 1 1 20 11024 1 1 19 PRO N N -2.228 1.239 -0.745 1.00 . A A . 40 PRO N 1 1 20 11025 1 1 19 PRO O O -0.613 -0.909 -0.219 1.00 . A A . 40 PRO O 1 1 20 11026 1 1 20 LYS C C 0.142 -3.762 -1.122 1.00 . A A . 41 LYS C 1 1 20 11027 1 1 20 LYS CA C -1.314 -3.690 -0.629 1.00 . A A . 41 LYS CA 1 1 20 11028 1 1 20 LYS CB C -2.152 -4.896 -1.103 1.00 . A A . 41 LYS CB 1 1 20 11029 1 1 20 LYS CD C -2.746 -7.340 -0.812 1.00 . A A . 41 LYS CD 1 1 20 11030 1 1 20 LYS CE C -2.346 -8.645 -0.112 1.00 . A A . 41 LYS CE 1 1 20 11031 1 1 20 LYS CG C -1.779 -6.217 -0.411 1.00 . A A . 41 LYS CG 1 1 20 11032 1 1 20 LYS H H -2.967 -2.583 -1.415 1.00 . A A . 41 LYS H 1 1 20 11033 1 1 20 LYS HA H -1.251 -3.727 0.457 1.00 . A A . 41 LYS HA 1 1 20 11034 1 1 20 LYS HB2 H -3.202 -4.699 -0.887 1.00 . A A . 41 LYS HB2 1 1 20 11035 1 1 20 LYS HB3 H -2.047 -5.007 -2.184 1.00 . A A . 41 LYS HB3 1 1 20 11036 1 1 20 LYS HD2 H -3.762 -7.065 -0.520 1.00 . A A . 41 LYS HD2 1 1 20 11037 1 1 20 LYS HD3 H -2.709 -7.478 -1.894 1.00 . A A . 41 LYS HD3 1 1 20 11038 1 1 20 LYS HE2 H -1.314 -8.887 -0.381 1.00 . A A . 41 LYS HE2 1 1 20 11039 1 1 20 LYS HE3 H -2.382 -8.490 0.970 1.00 . A A . 41 LYS HE3 1 1 20 11040 1 1 20 LYS HG2 H -0.769 -6.510 -0.694 1.00 . A A . 41 LYS HG2 1 1 20 11041 1 1 20 LYS HG3 H -1.821 -6.078 0.672 1.00 . A A . 41 LYS HG3 1 1 20 11042 1 1 20 LYS HZ1 H -3.212 -9.944 -1.489 1.00 . A A . 41 LYS HZ1 1 1 20 11043 1 1 20 LYS HZ2 H -2.970 -10.624 -0.027 1.00 . A A . 41 LYS HZ2 1 1 20 11044 1 1 20 LYS HZ3 H -4.202 -9.578 -0.240 1.00 . A A . 41 LYS HZ3 1 1 20 11045 1 1 20 LYS N N -2.054 -2.456 -0.986 1.00 . A A . 41 LYS N 1 1 20 11046 1 1 20 LYS NZ N -3.242 -9.769 -0.494 1.00 . A A . 41 LYS NZ 1 1 20 11047 1 1 20 LYS O O 0.916 -4.589 -0.641 1.00 . A A . 41 LYS O 1 1 20 11048 1 1 21 VAL C C 2.837 -2.239 -1.212 1.00 . A A . 42 VAL C 1 1 20 11049 1 1 21 VAL CA C 1.940 -2.597 -2.413 1.00 . A A . 42 VAL CA 1 1 20 11050 1 1 21 VAL CB C 1.963 -1.452 -3.452 1.00 . A A . 42 VAL CB 1 1 20 11051 1 1 21 VAL CG1 C 3.374 -1.133 -3.951 1.00 . A A . 42 VAL CG1 1 1 20 11052 1 1 21 VAL CG2 C 1.112 -1.788 -4.688 1.00 . A A . 42 VAL CG2 1 1 20 11053 1 1 21 VAL H H -0.166 -2.243 -2.374 1.00 . A A . 42 VAL H 1 1 20 11054 1 1 21 VAL HA H 2.353 -3.493 -2.877 1.00 . A A . 42 VAL HA 1 1 20 11055 1 1 21 VAL HB H 1.556 -0.552 -2.992 1.00 . A A . 42 VAL HB 1 1 20 11056 1 1 21 VAL HG11 H 3.829 -2.031 -4.370 1.00 . A A . 42 VAL HG11 1 1 20 11057 1 1 21 VAL HG12 H 3.335 -0.360 -4.718 1.00 . A A . 42 VAL HG12 1 1 20 11058 1 1 21 VAL HG13 H 3.989 -0.762 -3.132 1.00 . A A . 42 VAL HG13 1 1 20 11059 1 1 21 VAL HG21 H 1.472 -2.707 -5.152 1.00 . A A . 42 VAL HG21 1 1 20 11060 1 1 21 VAL HG22 H 0.065 -1.910 -4.417 1.00 . A A . 42 VAL HG22 1 1 20 11061 1 1 21 VAL HG23 H 1.175 -0.976 -5.413 1.00 . A A . 42 VAL HG23 1 1 20 11062 1 1 21 VAL N N 0.543 -2.864 -2.021 1.00 . A A . 42 VAL N 1 1 20 11063 1 1 21 VAL O O 3.998 -2.642 -1.176 1.00 . A A . 42 VAL O 1 1 20 11064 1 1 22 CYS C C 2.178 -0.802 2.157 1.00 . A A . 43 CYS C 1 1 20 11065 1 1 22 CYS CA C 3.052 -0.893 0.880 1.00 . A A . 43 CYS CA 1 1 20 11066 1 1 22 CYS CB C 3.550 0.474 0.362 1.00 . A A . 43 CYS CB 1 1 20 11067 1 1 22 CYS H H 1.318 -1.277 -0.286 1.00 . A A . 43 CYS H 1 1 20 11068 1 1 22 CYS HA H 3.922 -1.506 1.115 1.00 . A A . 43 CYS HA 1 1 20 11069 1 1 22 CYS HB2 H 4.001 0.328 -0.622 1.00 . A A . 43 CYS HB2 1 1 20 11070 1 1 22 CYS HB3 H 2.703 1.153 0.248 1.00 . A A . 43 CYS HB3 1 1 20 11071 1 1 22 CYS N N 2.305 -1.504 -0.227 1.00 . A A . 43 CYS N 1 1 20 11072 1 1 22 CYS O O 1.266 -1.604 2.366 1.00 . A A . 43 CYS O 1 1 20 11073 1 1 22 CYS SG S 4.799 1.209 1.456 1.00 . A A . 43 CYS SG 1 1 20 11074 1 1 23 PHE C C 1.657 2.104 4.385 1.00 . A A . 44 PHE C 1 1 20 11075 1 1 23 PHE CA C 1.688 0.572 4.188 1.00 . A A . 44 PHE CA 1 1 20 11076 1 1 23 PHE CB C 2.222 -0.124 5.451 1.00 . A A . 44 PHE CB 1 1 20 11077 1 1 23 PHE CD1 C 4.751 0.157 5.440 1.00 . A A . 44 PHE CD1 1 1 20 11078 1 1 23 PHE CD2 C 3.440 1.391 7.079 1.00 . A A . 44 PHE CD2 1 1 20 11079 1 1 23 PHE CE1 C 5.924 0.751 5.938 1.00 . A A . 44 PHE CE1 1 1 20 11080 1 1 23 PHE CE2 C 4.615 1.985 7.575 1.00 . A A . 44 PHE CE2 1 1 20 11081 1 1 23 PHE CG C 3.503 0.478 6.008 1.00 . A A . 44 PHE CG 1 1 20 11082 1 1 23 PHE CZ C 5.857 1.667 7.003 1.00 . A A . 44 PHE CZ 1 1 20 11083 1 1 23 PHE H H 3.303 0.695 2.789 1.00 . A A . 44 PHE H 1 1 20 11084 1 1 23 PHE HA H 0.657 0.250 4.038 1.00 . A A . 44 PHE HA 1 1 20 11085 1 1 23 PHE HB2 H 1.452 -0.063 6.220 1.00 . A A . 44 PHE HB2 1 1 20 11086 1 1 23 PHE HB3 H 2.380 -1.183 5.244 1.00 . A A . 44 PHE HB3 1 1 20 11087 1 1 23 PHE HD1 H 4.812 -0.543 4.619 1.00 . A A . 44 PHE HD1 1 1 20 11088 1 1 23 PHE HD2 H 2.484 1.648 7.518 1.00 . A A . 44 PHE HD2 1 1 20 11089 1 1 23 PHE HE1 H 6.883 0.503 5.501 1.00 . A A . 44 PHE HE1 1 1 20 11090 1 1 23 PHE HE2 H 4.560 2.689 8.396 1.00 . A A . 44 PHE HE2 1 1 20 11091 1 1 23 PHE HZ H 6.762 2.125 7.382 1.00 . A A . 44 PHE HZ 1 1 20 11092 1 1 23 PHE N N 2.480 0.160 3.026 1.00 . A A . 44 PHE N 1 1 20 11093 1 1 23 PHE O O 0.756 2.601 5.061 1.00 . A A . 44 PHE O 1 1 20 11094 1 1 24 LYS C C 3.472 5.016 2.803 1.00 . A A . 45 LYS C 1 1 20 11095 1 1 24 LYS CA C 2.714 4.325 3.946 1.00 . A A . 45 LYS CA 1 1 20 11096 1 1 24 LYS CB C 3.381 4.626 5.306 1.00 . A A . 45 LYS CB 1 1 20 11097 1 1 24 LYS CD C 4.046 6.348 7.027 1.00 . A A . 45 LYS CD 1 1 20 11098 1 1 24 LYS CE C 4.055 7.842 7.372 1.00 . A A . 45 LYS CE 1 1 20 11099 1 1 24 LYS CG C 3.412 6.124 5.647 1.00 . A A . 45 LYS CG 1 1 20 11100 1 1 24 LYS H H 3.315 2.383 3.253 1.00 . A A . 45 LYS H 1 1 20 11101 1 1 24 LYS HA H 1.708 4.751 3.955 1.00 . A A . 45 LYS HA 1 1 20 11102 1 1 24 LYS HB2 H 2.824 4.116 6.092 1.00 . A A . 45 LYS HB2 1 1 20 11103 1 1 24 LYS HB3 H 4.401 4.235 5.308 1.00 . A A . 45 LYS HB3 1 1 20 11104 1 1 24 LYS HD2 H 3.474 5.804 7.780 1.00 . A A . 45 LYS HD2 1 1 20 11105 1 1 24 LYS HD3 H 5.070 5.969 7.016 1.00 . A A . 45 LYS HD3 1 1 20 11106 1 1 24 LYS HE2 H 4.607 8.380 6.596 1.00 . A A . 45 LYS HE2 1 1 20 11107 1 1 24 LYS HE3 H 3.026 8.210 7.368 1.00 . A A . 45 LYS HE3 1 1 20 11108 1 1 24 LYS HG2 H 3.995 6.663 4.899 1.00 . A A . 45 LYS HG2 1 1 20 11109 1 1 24 LYS HG3 H 2.393 6.513 5.650 1.00 . A A . 45 LYS HG3 1 1 20 11110 1 1 24 LYS HZ1 H 4.179 7.613 9.437 1.00 . A A . 45 LYS HZ1 1 1 20 11111 1 1 24 LYS HZ2 H 5.640 7.780 8.721 1.00 . A A . 45 LYS HZ2 1 1 20 11112 1 1 24 LYS HZ3 H 4.674 9.078 8.922 1.00 . A A . 45 LYS HZ3 1 1 20 11113 1 1 24 LYS N N 2.611 2.857 3.799 1.00 . A A . 45 LYS N 1 1 20 11114 1 1 24 LYS NZ N 4.677 8.091 8.699 1.00 . A A . 45 LYS NZ 1 1 20 11115 1 1 24 LYS O O 2.914 5.913 2.170 1.00 . A A . 45 LYS O 1 1 20 11116 1 1 25 CYS C C 5.374 5.086 0.128 1.00 . A A . 46 CYS C 1 1 20 11117 1 1 25 CYS CA C 5.639 5.319 1.632 1.00 . A A . 46 CYS CA 1 1 20 11118 1 1 25 CYS CB C 7.087 5.000 2.048 1.00 . A A . 46 CYS CB 1 1 20 11119 1 1 25 CYS H H 5.127 3.893 3.106 1.00 . A A . 46 CYS H 1 1 20 11120 1 1 25 CYS HA H 5.505 6.390 1.791 1.00 . A A . 46 CYS HA 1 1 20 11121 1 1 25 CYS HB2 H 7.763 5.229 1.219 1.00 . A A . 46 CYS HB2 1 1 20 11122 1 1 25 CYS HB3 H 7.356 5.656 2.878 1.00 . A A . 46 CYS HB3 1 1 20 11123 1 1 25 CYS N N 4.720 4.622 2.540 1.00 . A A . 46 CYS N 1 1 20 11124 1 1 25 CYS O O 5.598 6.004 -0.664 1.00 . A A . 46 CYS O 1 1 20 11125 1 1 25 CYS SG S 7.317 3.280 2.582 1.00 . A A . 46 CYS SG 1 1 20 11126 1 1 26 LYS C C 4.923 4.049 -2.859 1.00 . A A . 47 LYS C 1 1 20 11127 1 1 26 LYS CA C 4.201 3.588 -1.569 1.00 . A A . 47 LYS CA 1 1 20 11128 1 1 26 LYS CB C 2.697 3.950 -1.520 1.00 . A A . 47 LYS CB 1 1 20 11129 1 1 26 LYS CD C 0.911 5.747 -1.243 1.00 . A A . 47 LYS CD 1 1 20 11130 1 1 26 LYS CE C 0.674 7.174 -0.721 1.00 . A A . 47 LYS CE 1 1 20 11131 1 1 26 LYS CG C 2.413 5.451 -1.338 1.00 . A A . 47 LYS CG 1 1 20 11132 1 1 26 LYS H H 4.721 3.230 0.477 1.00 . A A . 47 LYS H 1 1 20 11133 1 1 26 LYS HA H 4.229 2.502 -1.646 1.00 . A A . 47 LYS HA 1 1 20 11134 1 1 26 LYS HB2 H 2.209 3.602 -2.433 1.00 . A A . 47 LYS HB2 1 1 20 11135 1 1 26 LYS HB3 H 2.246 3.412 -0.686 1.00 . A A . 47 LYS HB3 1 1 20 11136 1 1 26 LYS HD2 H 0.470 5.649 -2.236 1.00 . A A . 47 LYS HD2 1 1 20 11137 1 1 26 LYS HD3 H 0.424 5.033 -0.575 1.00 . A A . 47 LYS HD3 1 1 20 11138 1 1 26 LYS HE2 H 1.347 7.858 -1.246 1.00 . A A . 47 LYS HE2 1 1 20 11139 1 1 26 LYS HE3 H -0.350 7.467 -0.960 1.00 . A A . 47 LYS HE3 1 1 20 11140 1 1 26 LYS HG2 H 2.885 5.790 -0.420 1.00 . A A . 47 LYS HG2 1 1 20 11141 1 1 26 LYS HG3 H 2.838 6.012 -2.170 1.00 . A A . 47 LYS HG3 1 1 20 11142 1 1 26 LYS HZ1 H 1.805 6.952 1.028 1.00 . A A . 47 LYS HZ1 1 1 20 11143 1 1 26 LYS HZ2 H 0.759 8.216 1.081 1.00 . A A . 47 LYS HZ2 1 1 20 11144 1 1 26 LYS HZ3 H 0.221 6.674 1.247 1.00 . A A . 47 LYS HZ3 1 1 20 11145 1 1 26 LYS N N 4.822 3.923 -0.258 1.00 . A A . 47 LYS N 1 1 20 11146 1 1 26 LYS NZ N 0.879 7.269 0.748 1.00 . A A . 47 LYS NZ 1 1 20 11147 1 1 26 LYS O O 4.280 4.230 -3.896 1.00 . A A . 47 LYS O 1 1 20 11148 1 1 27 GLN C C 7.117 3.518 -5.087 1.00 . A A . 48 GLN C 1 1 20 11149 1 1 27 GLN CA C 7.056 4.624 -3.999 1.00 . A A . 48 GLN CA 1 1 20 11150 1 1 27 GLN CB C 8.475 5.023 -3.546 1.00 . A A . 48 GLN CB 1 1 20 11151 1 1 27 GLN CD C 7.846 7.458 -3.092 1.00 . A A . 48 GLN CD 1 1 20 11152 1 1 27 GLN CG C 8.521 6.196 -2.552 1.00 . A A . 48 GLN CG 1 1 20 11153 1 1 27 GLN H H 6.716 4.082 -1.948 1.00 . A A . 48 GLN H 1 1 20 11154 1 1 27 GLN HA H 6.574 5.499 -4.430 1.00 . A A . 48 GLN HA 1 1 20 11155 1 1 27 GLN HB2 H 8.960 4.165 -3.083 1.00 . A A . 48 GLN HB2 1 1 20 11156 1 1 27 GLN HB3 H 9.065 5.300 -4.421 1.00 . A A . 48 GLN HB3 1 1 20 11157 1 1 27 GLN HE21 H 6.253 7.255 -1.861 1.00 . A A . 48 GLN HE21 1 1 20 11158 1 1 27 GLN HE22 H 6.240 8.652 -2.945 1.00 . A A . 48 GLN HE22 1 1 20 11159 1 1 27 GLN HG2 H 8.057 5.900 -1.612 1.00 . A A . 48 GLN HG2 1 1 20 11160 1 1 27 GLN HG3 H 9.563 6.431 -2.335 1.00 . A A . 48 GLN HG3 1 1 20 11161 1 1 27 GLN N N 6.249 4.224 -2.830 1.00 . A A . 48 GLN N 1 1 20 11162 1 1 27 GLN NE2 N 6.686 7.821 -2.590 1.00 . A A . 48 GLN NE2 1 1 20 11163 1 1 27 GLN O O 7.032 2.337 -4.733 1.00 . A A . 48 GLN O 1 1 20 11164 1 1 27 GLN OE1 O 8.344 8.127 -3.988 1.00 . A A . 48 GLN OE1 1 1 20 11165 1 1 28 PRO C C 7.859 1.587 -7.565 1.00 . A A . 49 PRO C 1 1 20 11166 1 1 28 PRO CA C 7.143 2.955 -7.541 1.00 . A A . 49 PRO CA 1 1 20 11167 1 1 28 PRO CB C 7.568 3.773 -8.764 1.00 . A A . 49 PRO CB 1 1 20 11168 1 1 28 PRO CD C 7.529 5.220 -6.874 1.00 . A A . 49 PRO CD 1 1 20 11169 1 1 28 PRO CG C 7.222 5.201 -8.369 1.00 . A A . 49 PRO CG 1 1 20 11170 1 1 28 PRO HA H 6.074 2.755 -7.628 1.00 . A A . 49 PRO HA 1 1 20 11171 1 1 28 PRO HB2 H 8.647 3.692 -8.914 1.00 . A A . 49 PRO HB2 1 1 20 11172 1 1 28 PRO HB3 H 7.033 3.464 -9.664 1.00 . A A . 49 PRO HB3 1 1 20 11173 1 1 28 PRO HD2 H 8.573 5.499 -6.724 1.00 . A A . 49 PRO HD2 1 1 20 11174 1 1 28 PRO HD3 H 6.876 5.946 -6.393 1.00 . A A . 49 PRO HD3 1 1 20 11175 1 1 28 PRO HG2 H 7.819 5.931 -8.915 1.00 . A A . 49 PRO HG2 1 1 20 11176 1 1 28 PRO HG3 H 6.157 5.377 -8.526 1.00 . A A . 49 PRO HG3 1 1 20 11177 1 1 28 PRO N N 7.314 3.856 -6.384 1.00 . A A . 49 PRO N 1 1 20 11178 1 1 28 PRO O O 7.444 0.718 -8.334 1.00 . A A . 49 PRO O 1 1 20 11179 1 1 29 GLY C C 10.364 -0.242 -5.408 1.00 . A A . 50 GLY C 1 1 20 11180 1 1 29 GLY CA C 9.657 0.097 -6.728 1.00 . A A . 50 GLY CA 1 1 20 11181 1 1 29 GLY H H 9.252 2.153 -6.227 1.00 . A A . 50 GLY H 1 1 20 11182 1 1 29 GLY HA2 H 10.413 0.114 -7.514 1.00 . A A . 50 GLY HA2 1 1 20 11183 1 1 29 GLY HA3 H 8.974 -0.726 -6.942 1.00 . A A . 50 GLY HA3 1 1 20 11184 1 1 29 GLY N N 8.913 1.373 -6.769 1.00 . A A . 50 GLY N 1 1 20 11185 1 1 29 GLY O O 11.002 -1.290 -5.306 1.00 . A A . 50 GLY O 1 1 20 11186 1 1 30 HIS C C 10.484 -0.798 -2.297 1.00 . A A . 51 HIS C 1 1 20 11187 1 1 30 HIS CA C 10.930 0.453 -3.086 1.00 . A A . 51 HIS CA 1 1 20 11188 1 1 30 HIS CB C 10.674 1.716 -2.244 1.00 . A A . 51 HIS CB 1 1 20 11189 1 1 30 HIS CD2 C 9.130 1.485 -0.222 1.00 . A A . 51 HIS CD2 1 1 20 11190 1 1 30 HIS CE1 C 7.171 1.403 -1.208 1.00 . A A . 51 HIS CE1 1 1 20 11191 1 1 30 HIS CG C 9.326 1.708 -1.557 1.00 . A A . 51 HIS CG 1 1 20 11192 1 1 30 HIS H H 9.729 1.460 -4.533 1.00 . A A . 51 HIS H 1 1 20 11193 1 1 30 HIS HA H 12.005 0.369 -3.262 1.00 . A A . 51 HIS HA 1 1 20 11194 1 1 30 HIS HB2 H 11.447 1.771 -1.474 1.00 . A A . 51 HIS HB2 1 1 20 11195 1 1 30 HIS HB3 H 10.771 2.607 -2.863 1.00 . A A . 51 HIS HB3 1 1 20 11196 1 1 30 HIS HD1 H 7.865 1.792 -3.143 1.00 . A A . 51 HIS HD1 1 1 20 11197 1 1 30 HIS HD2 H 9.911 1.382 0.520 1.00 . A A . 51 HIS HD2 1 1 20 11198 1 1 30 HIS HE1 H 6.110 1.279 -1.385 1.00 . A A . 51 HIS HE1 1 1 20 11199 1 1 30 HIS N N 10.260 0.618 -4.387 1.00 . A A . 51 HIS N 1 1 20 11200 1 1 30 HIS ND1 N 8.082 1.664 -2.155 1.00 . A A . 51 HIS ND1 1 1 20 11201 1 1 30 HIS NE2 N 7.761 1.291 -0.009 1.00 . A A . 51 HIS NE2 1 1 20 11202 1 1 30 HIS O O 11.230 -1.331 -1.473 1.00 . A A . 51 HIS O 1 1 20 11203 1 1 31 PHE C C 9.295 -3.608 -1.697 1.00 . A A . 52 PHE C 1 1 20 11204 1 1 31 PHE CA C 8.572 -2.256 -1.686 1.00 . A A . 52 PHE CA 1 1 20 11205 1 1 31 PHE CB C 7.102 -2.367 -2.119 1.00 . A A . 52 PHE CB 1 1 20 11206 1 1 31 PHE CD1 C 6.878 -3.615 -4.324 1.00 . A A . 52 PHE CD1 1 1 20 11207 1 1 31 PHE CD2 C 6.604 -1.196 -4.313 1.00 . A A . 52 PHE CD2 1 1 20 11208 1 1 31 PHE CE1 C 6.663 -3.629 -5.715 1.00 . A A . 52 PHE CE1 1 1 20 11209 1 1 31 PHE CE2 C 6.377 -1.214 -5.699 1.00 . A A . 52 PHE CE2 1 1 20 11210 1 1 31 PHE CG C 6.856 -2.399 -3.619 1.00 . A A . 52 PHE CG 1 1 20 11211 1 1 31 PHE CZ C 6.412 -2.429 -6.402 1.00 . A A . 52 PHE CZ 1 1 20 11212 1 1 31 PHE H H 8.697 -0.784 -3.217 1.00 . A A . 52 PHE H 1 1 20 11213 1 1 31 PHE HA H 8.581 -1.906 -0.653 1.00 . A A . 52 PHE HA 1 1 20 11214 1 1 31 PHE HB2 H 6.667 -3.258 -1.670 1.00 . A A . 52 PHE HB2 1 1 20 11215 1 1 31 PHE HB3 H 6.565 -1.513 -1.705 1.00 . A A . 52 PHE HB3 1 1 20 11216 1 1 31 PHE HD1 H 7.067 -4.544 -3.804 1.00 . A A . 52 PHE HD1 1 1 20 11217 1 1 31 PHE HD2 H 6.556 -0.259 -3.780 1.00 . A A . 52 PHE HD2 1 1 20 11218 1 1 31 PHE HE1 H 6.689 -4.566 -6.254 1.00 . A A . 52 PHE HE1 1 1 20 11219 1 1 31 PHE HE2 H 6.160 -0.292 -6.219 1.00 . A A . 52 PHE HE2 1 1 20 11220 1 1 31 PHE HZ H 6.240 -2.440 -7.471 1.00 . A A . 52 PHE HZ 1 1 20 11221 1 1 31 PHE N N 9.245 -1.252 -2.512 1.00 . A A . 52 PHE N 1 1 20 11222 1 1 31 PHE O O 9.507 -4.190 -0.633 1.00 . A A . 52 PHE O 1 1 20 11223 1 1 32 SER C C 11.899 -5.349 -2.319 1.00 . A A . 53 SER C 1 1 20 11224 1 1 32 SER CA C 10.544 -5.297 -3.050 1.00 . A A . 53 SER CA 1 1 20 11225 1 1 32 SER CB C 10.776 -5.538 -4.549 1.00 . A A . 53 SER CB 1 1 20 11226 1 1 32 SER H H 9.555 -3.522 -3.694 1.00 . A A . 53 SER H 1 1 20 11227 1 1 32 SER HA H 9.944 -6.123 -2.668 1.00 . A A . 53 SER HA 1 1 20 11228 1 1 32 SER HB2 H 11.400 -4.739 -4.952 1.00 . A A . 53 SER HB2 1 1 20 11229 1 1 32 SER HB3 H 11.291 -6.491 -4.687 1.00 . A A . 53 SER HB3 1 1 20 11230 1 1 32 SER HG H 9.722 -5.762 -6.186 1.00 . A A . 53 SER HG 1 1 20 11231 1 1 32 SER N N 9.779 -4.050 -2.860 1.00 . A A . 53 SER N 1 1 20 11232 1 1 32 SER O O 12.565 -6.388 -2.344 1.00 . A A . 53 SER O 1 1 20 11233 1 1 32 SER OG O 9.539 -5.574 -5.245 1.00 . A A . 53 SER OG 1 1 20 11234 1 1 33 LYS C C 13.385 -3.446 0.491 1.00 . A A . 54 LYS C 1 1 20 11235 1 1 33 LYS CA C 13.558 -4.135 -0.878 1.00 . A A . 54 LYS CA 1 1 20 11236 1 1 33 LYS CB C 14.640 -3.458 -1.747 1.00 . A A . 54 LYS CB 1 1 20 11237 1 1 33 LYS CD C 15.433 -1.292 -2.871 1.00 . A A . 54 LYS CD 1 1 20 11238 1 1 33 LYS CE C 16.475 -0.853 -1.833 1.00 . A A . 54 LYS CE 1 1 20 11239 1 1 33 LYS CG C 14.266 -2.035 -2.208 1.00 . A A . 54 LYS CG 1 1 20 11240 1 1 33 LYS H H 11.731 -3.430 -1.729 1.00 . A A . 54 LYS H 1 1 20 11241 1 1 33 LYS HA H 13.920 -5.137 -0.643 1.00 . A A . 54 LYS HA 1 1 20 11242 1 1 33 LYS HB2 H 15.572 -3.428 -1.182 1.00 . A A . 54 LYS HB2 1 1 20 11243 1 1 33 LYS HB3 H 14.817 -4.073 -2.631 1.00 . A A . 54 LYS HB3 1 1 20 11244 1 1 33 LYS HD2 H 15.896 -1.938 -3.621 1.00 . A A . 54 LYS HD2 1 1 20 11245 1 1 33 LYS HD3 H 15.036 -0.407 -3.373 1.00 . A A . 54 LYS HD3 1 1 20 11246 1 1 33 LYS HE2 H 15.980 -0.219 -1.090 1.00 . A A . 54 LYS HE2 1 1 20 11247 1 1 33 LYS HE3 H 16.860 -1.735 -1.314 1.00 . A A . 54 LYS HE3 1 1 20 11248 1 1 33 LYS HG2 H 13.452 -2.107 -2.931 1.00 . A A . 54 LYS HG2 1 1 20 11249 1 1 33 LYS HG3 H 13.918 -1.447 -1.357 1.00 . A A . 54 LYS HG3 1 1 20 11250 1 1 33 LYS HZ1 H 17.268 0.716 -2.944 1.00 . A A . 54 LYS HZ1 1 1 20 11251 1 1 33 LYS HZ2 H 18.269 0.192 -1.767 1.00 . A A . 54 LYS HZ2 1 1 20 11252 1 1 33 LYS HZ3 H 18.091 -0.685 -3.131 1.00 . A A . 54 LYS HZ3 1 1 20 11253 1 1 33 LYS N N 12.312 -4.257 -1.656 1.00 . A A . 54 LYS N 1 1 20 11254 1 1 33 LYS NZ N 17.597 -0.109 -2.463 1.00 . A A . 54 LYS NZ 1 1 20 11255 1 1 33 LYS O O 14.388 -3.112 1.128 1.00 . A A . 54 LYS O 1 1 20 11256 1 1 34 GLN C C 10.557 -3.040 2.911 1.00 . A A . 55 GLN C 1 1 20 11257 1 1 34 GLN CA C 11.873 -2.581 2.251 1.00 . A A . 55 GLN CA 1 1 20 11258 1 1 34 GLN CB C 11.874 -1.051 2.056 1.00 . A A . 55 GLN CB 1 1 20 11259 1 1 34 GLN CD C 11.725 1.212 3.191 1.00 . A A . 55 GLN CD 1 1 20 11260 1 1 34 GLN CG C 11.839 -0.296 3.395 1.00 . A A . 55 GLN CG 1 1 20 11261 1 1 34 GLN H H 11.370 -3.559 0.402 1.00 . A A . 55 GLN H 1 1 20 11262 1 1 34 GLN HA H 12.679 -2.834 2.944 1.00 . A A . 55 GLN HA 1 1 20 11263 1 1 34 GLN HB2 H 12.776 -0.754 1.519 1.00 . A A . 55 GLN HB2 1 1 20 11264 1 1 34 GLN HB3 H 11.012 -0.760 1.453 1.00 . A A . 55 GLN HB3 1 1 20 11265 1 1 34 GLN HE21 H 9.715 1.165 3.359 1.00 . A A . 55 GLN HE21 1 1 20 11266 1 1 34 GLN HE22 H 10.434 2.752 3.105 1.00 . A A . 55 GLN HE22 1 1 20 11267 1 1 34 GLN HG2 H 10.990 -0.631 3.990 1.00 . A A . 55 GLN HG2 1 1 20 11268 1 1 34 GLN HG3 H 12.751 -0.511 3.953 1.00 . A A . 55 GLN HG3 1 1 20 11269 1 1 34 GLN N N 12.147 -3.225 0.954 1.00 . A A . 55 GLN N 1 1 20 11270 1 1 34 GLN NE2 N 10.528 1.755 3.226 1.00 . A A . 55 GLN NE2 1 1 20 11271 1 1 34 GLN O O 10.580 -3.501 4.055 1.00 . A A . 55 GLN O 1 1 20 11272 1 1 34 GLN OE1 O 12.704 1.924 2.998 1.00 . A A . 55 GLN OE1 1 1 20 11273 1 1 35 CYS C C 7.352 -4.336 2.480 1.00 . A A . 56 CYS C 1 1 20 11274 1 1 35 CYS CA C 8.080 -3.013 2.800 1.00 . A A . 56 CYS CA 1 1 20 11275 1 1 35 CYS CB C 7.255 -1.799 2.341 1.00 . A A . 56 CYS CB 1 1 20 11276 1 1 35 CYS H H 9.490 -2.500 1.293 1.00 . A A . 56 CYS H 1 1 20 11277 1 1 35 CYS HA H 8.163 -2.955 3.887 1.00 . A A . 56 CYS HA 1 1 20 11278 1 1 35 CYS HB2 H 7.163 -1.799 1.253 1.00 . A A . 56 CYS HB2 1 1 20 11279 1 1 35 CYS HB3 H 6.252 -1.871 2.768 1.00 . A A . 56 CYS HB3 1 1 20 11280 1 1 35 CYS N N 9.424 -2.913 2.209 1.00 . A A . 56 CYS N 1 1 20 11281 1 1 35 CYS O O 6.387 -4.691 3.164 1.00 . A A . 56 CYS O 1 1 20 11282 1 1 35 CYS SG S 8.040 -0.266 2.913 1.00 . A A . 56 CYS SG 1 1 20 11283 1 1 36 ARG C C 8.276 -7.386 0.579 1.00 . A A . 57 ARG C 1 1 20 11284 1 1 36 ARG CA C 7.218 -6.328 0.958 1.00 . A A . 57 ARG CA 1 1 20 11285 1 1 36 ARG CB C 6.289 -6.004 -0.236 1.00 . A A . 57 ARG CB 1 1 20 11286 1 1 36 ARG CD C 3.778 -5.982 0.311 1.00 . A A . 57 ARG CD 1 1 20 11287 1 1 36 ARG CG C 4.970 -6.800 -0.214 1.00 . A A . 57 ARG CG 1 1 20 11288 1 1 36 ARG CZ C 3.242 -4.534 2.279 1.00 . A A . 57 ARG CZ 1 1 20 11289 1 1 36 ARG H H 8.568 -4.667 0.920 1.00 . A A . 57 ARG H 1 1 20 11290 1 1 36 ARG HA H 6.638 -6.779 1.764 1.00 . A A . 57 ARG HA 1 1 20 11291 1 1 36 ARG HB2 H 6.049 -4.939 -0.249 1.00 . A A . 57 ARG HB2 1 1 20 11292 1 1 36 ARG HB3 H 6.818 -6.216 -1.166 1.00 . A A . 57 ARG HB3 1 1 20 11293 1 1 36 ARG HD2 H 3.556 -5.199 -0.416 1.00 . A A . 57 ARG HD2 1 1 20 11294 1 1 36 ARG HD3 H 2.908 -6.638 0.381 1.00 . A A . 57 ARG HD3 1 1 20 11295 1 1 36 ARG HE H 4.956 -5.480 2.030 1.00 . A A . 57 ARG HE 1 1 20 11296 1 1 36 ARG HG2 H 4.735 -7.106 -1.234 1.00 . A A . 57 ARG HG2 1 1 20 11297 1 1 36 ARG HG3 H 5.084 -7.706 0.383 1.00 . A A . 57 ARG HG3 1 1 20 11298 1 1 36 ARG HH11 H 1.735 -4.623 0.983 1.00 . A A . 57 ARG HH11 1 1 20 11299 1 1 36 ARG HH12 H 1.556 -3.457 2.271 1.00 . A A . 57 ARG HH12 1 1 20 11300 1 1 36 ARG HH21 H 4.610 -4.145 3.672 1.00 . A A . 57 ARG HH21 1 1 20 11301 1 1 36 ARG HH22 H 3.045 -3.378 3.906 1.00 . A A . 57 ARG HH22 1 1 20 11302 1 1 36 ARG N N 7.805 -5.068 1.457 1.00 . A A . 57 ARG N 1 1 20 11303 1 1 36 ARG NE N 4.037 -5.359 1.625 1.00 . A A . 57 ARG NE 1 1 20 11304 1 1 36 ARG NH1 N 2.046 -4.247 1.871 1.00 . A A . 57 ARG NH1 1 1 20 11305 1 1 36 ARG NH2 N 3.660 -3.962 3.368 1.00 . A A . 57 ARG NH2 1 1 20 11306 1 1 36 ARG O O 7.922 -8.456 0.076 1.00 . A A . 57 ARG O 1 1 20 11307 1 1 37 SER C C 10.621 -9.289 1.447 1.00 . A A . 58 SER C 1 1 20 11308 1 1 37 SER CA C 10.727 -7.975 0.657 1.00 . A A . 58 SER CA 1 1 20 11309 1 1 37 SER CB C 12.010 -7.219 1.020 1.00 . A A . 58 SER CB 1 1 20 11310 1 1 37 SER H H 9.742 -6.196 1.252 1.00 . A A . 58 SER H 1 1 20 11311 1 1 37 SER HA H 10.804 -8.255 -0.394 1.00 . A A . 58 SER HA 1 1 20 11312 1 1 37 SER HB2 H 12.841 -7.924 1.115 1.00 . A A . 58 SER HB2 1 1 20 11313 1 1 37 SER HB3 H 12.247 -6.525 0.216 1.00 . A A . 58 SER HB3 1 1 20 11314 1 1 37 SER HG H 11.634 -7.103 2.943 1.00 . A A . 58 SER HG 1 1 20 11315 1 1 37 SER N N 9.559 -7.086 0.814 1.00 . A A . 58 SER N 1 1 20 11316 1 1 37 SER O O 10.218 -9.261 2.634 1.00 . A A . 58 SER O 1 1 20 11317 1 1 37 SER OXT O 10.964 -10.348 0.874 1.00 . A A . 58 SER OXT 1 1 20 11318 1 1 37 SER OG O 11.849 -6.479 2.222 1.00 . A A . 58 SER OG 1 1 20 11319 2 2 1 ZN ZN ZN -8.283 0.462 3.781 1.00 . B A . 1059 ZN ZN 1 1 20 11320 3 2 1 ZN ZN ZN 6.932 1.266 1.875 1.00 . C A . 1060 ZN ZN 1 1 21 11321 1 1 1 GLN C C -6.321 -1.700 -4.508 1.00 . A A . 22 GLN C 1 1 21 11322 1 1 1 GLN CA C -6.121 -1.342 -5.979 1.00 . A A . 22 GLN CA 1 1 21 11323 1 1 1 GLN CB C -4.660 -0.929 -6.270 1.00 . A A . 22 GLN CB 1 1 21 11324 1 1 1 GLN CD C -3.764 -3.299 -6.698 1.00 . A A . 22 GLN CD 1 1 21 11325 1 1 1 GLN CG C -3.593 -1.989 -5.929 1.00 . A A . 22 GLN CG 1 1 21 11326 1 1 1 GLN H1 H -6.947 0.545 -5.793 1.00 . A A . 22 GLN H1 1 1 21 11327 1 1 1 GLN H2 H -6.966 -0.029 -7.339 1.00 . A A . 22 GLN H2 1 1 21 11328 1 1 1 GLN H3 H -8.029 -0.603 -6.223 1.00 . A A . 22 GLN H3 1 1 21 11329 1 1 1 GLN HA H -6.348 -2.230 -6.570 1.00 . A A . 22 GLN HA 1 1 21 11330 1 1 1 GLN HB2 H -4.570 -0.688 -7.330 1.00 . A A . 22 GLN HB2 1 1 21 11331 1 1 1 GLN HB3 H -4.429 -0.024 -5.705 1.00 . A A . 22 GLN HB3 1 1 21 11332 1 1 1 GLN HE21 H -1.930 -3.205 -7.552 1.00 . A A . 22 GLN HE21 1 1 21 11333 1 1 1 GLN HE22 H -2.924 -4.598 -7.961 1.00 . A A . 22 GLN HE22 1 1 21 11334 1 1 1 GLN HG2 H -2.612 -1.566 -6.152 1.00 . A A . 22 GLN HG2 1 1 21 11335 1 1 1 GLN HG3 H -3.612 -2.210 -4.863 1.00 . A A . 22 GLN HG3 1 1 21 11336 1 1 1 GLN N N -7.081 -0.279 -6.368 1.00 . A A . 22 GLN N 1 1 21 11337 1 1 1 GLN NE2 N -2.789 -3.728 -7.466 1.00 . A A . 22 GLN NE2 1 1 21 11338 1 1 1 GLN O O -6.463 -0.805 -3.681 1.00 . A A . 22 GLN O 1 1 21 11339 1 1 1 GLN OE1 O -4.787 -3.962 -6.617 1.00 . A A . 22 GLN OE1 1 1 21 11340 1 1 2 THR C C -5.937 -2.885 -1.694 1.00 . A A . 23 THR C 1 1 21 11341 1 1 2 THR CA C -6.721 -3.523 -2.847 1.00 . A A . 23 THR CA 1 1 21 11342 1 1 2 THR CB C -6.554 -5.053 -2.821 1.00 . A A . 23 THR CB 1 1 21 11343 1 1 2 THR CG2 C -7.183 -5.702 -1.589 1.00 . A A . 23 THR CG2 1 1 21 11344 1 1 2 THR H H -6.218 -3.687 -4.909 1.00 . A A . 23 THR H 1 1 21 11345 1 1 2 THR HA H -7.772 -3.309 -2.684 1.00 . A A . 23 THR HA 1 1 21 11346 1 1 2 THR HB H -5.492 -5.304 -2.864 1.00 . A A . 23 THR HB 1 1 21 11347 1 1 2 THR HG1 H -7.000 -6.559 -3.969 1.00 . A A . 23 THR HG1 1 1 21 11348 1 1 2 THR HG21 H -8.236 -5.431 -1.526 1.00 . A A . 23 THR HG21 1 1 21 11349 1 1 2 THR HG22 H -7.097 -6.787 -1.660 1.00 . A A . 23 THR HG22 1 1 21 11350 1 1 2 THR HG23 H -6.665 -5.379 -0.686 1.00 . A A . 23 THR HG23 1 1 21 11351 1 1 2 THR N N -6.364 -2.995 -4.179 1.00 . A A . 23 THR N 1 1 21 11352 1 1 2 THR O O -4.721 -2.709 -1.790 1.00 . A A . 23 THR O 1 1 21 11353 1 1 2 THR OG1 O -7.206 -5.609 -3.946 1.00 . A A . 23 THR OG1 1 1 21 11354 1 1 3 CYS C C -4.965 -2.838 1.269 1.00 . A A . 24 CYS C 1 1 21 11355 1 1 3 CYS CA C -6.070 -1.979 0.623 1.00 . A A . 24 CYS CA 1 1 21 11356 1 1 3 CYS CB C -7.227 -1.806 1.613 1.00 . A A . 24 CYS CB 1 1 21 11357 1 1 3 CYS H H -7.635 -2.691 -0.627 1.00 . A A . 24 CYS H 1 1 21 11358 1 1 3 CYS HA H -5.664 -0.995 0.381 1.00 . A A . 24 CYS HA 1 1 21 11359 1 1 3 CYS HB2 H -8.082 -1.368 1.105 1.00 . A A . 24 CYS HB2 1 1 21 11360 1 1 3 CYS HB3 H -7.520 -2.787 1.984 1.00 . A A . 24 CYS HB3 1 1 21 11361 1 1 3 CYS N N -6.632 -2.560 -0.599 1.00 . A A . 24 CYS N 1 1 21 11362 1 1 3 CYS O O -5.007 -4.070 1.222 1.00 . A A . 24 CYS O 1 1 21 11363 1 1 3 CYS SG S -6.715 -0.743 2.989 1.00 . A A . 24 CYS SG 1 1 21 11364 1 1 4 TYR C C -3.737 -3.495 4.120 1.00 . A A . 25 TYR C 1 1 21 11365 1 1 4 TYR CA C -3.087 -2.848 2.878 1.00 . A A . 25 TYR CA 1 1 21 11366 1 1 4 TYR CB C -1.980 -1.863 3.296 1.00 . A A . 25 TYR CB 1 1 21 11367 1 1 4 TYR CD1 C -3.355 -0.081 4.500 1.00 . A A . 25 TYR CD1 1 1 21 11368 1 1 4 TYR CD2 C -1.486 -1.117 5.669 1.00 . A A . 25 TYR CD2 1 1 21 11369 1 1 4 TYR CE1 C -3.642 0.689 5.642 1.00 . A A . 25 TYR CE1 1 1 21 11370 1 1 4 TYR CE2 C -1.762 -0.336 6.809 1.00 . A A . 25 TYR CE2 1 1 21 11371 1 1 4 TYR CG C -2.279 -0.991 4.509 1.00 . A A . 25 TYR CG 1 1 21 11372 1 1 4 TYR CZ C -2.845 0.568 6.797 1.00 . A A . 25 TYR CZ 1 1 21 11373 1 1 4 TYR H H -4.073 -1.174 1.978 1.00 . A A . 25 TYR H 1 1 21 11374 1 1 4 TYR HA H -2.619 -3.659 2.325 1.00 . A A . 25 TYR HA 1 1 21 11375 1 1 4 TYR HB2 H -1.099 -2.463 3.523 1.00 . A A . 25 TYR HB2 1 1 21 11376 1 1 4 TYR HB3 H -1.716 -1.225 2.453 1.00 . A A . 25 TYR HB3 1 1 21 11377 1 1 4 TYR HD1 H -3.978 0.023 3.623 1.00 . A A . 25 TYR HD1 1 1 21 11378 1 1 4 TYR HD2 H -0.663 -1.819 5.689 1.00 . A A . 25 TYR HD2 1 1 21 11379 1 1 4 TYR HE1 H -4.486 1.360 5.647 1.00 . A A . 25 TYR HE1 1 1 21 11380 1 1 4 TYR HE2 H -1.149 -0.433 7.694 1.00 . A A . 25 TYR HE2 1 1 21 11381 1 1 4 TYR HH H -2.546 1.117 8.640 1.00 . A A . 25 TYR HH 1 1 21 11382 1 1 4 TYR N N -4.032 -2.185 1.969 1.00 . A A . 25 TYR N 1 1 21 11383 1 1 4 TYR O O -3.095 -4.318 4.776 1.00 . A A . 25 TYR O 1 1 21 11384 1 1 4 TYR OH O -3.139 1.317 7.895 1.00 . A A . 25 TYR OH 1 1 21 11385 1 1 5 ASN C C -7.143 -3.895 5.552 1.00 . A A . 26 ASN C 1 1 21 11386 1 1 5 ASN CA C -5.647 -3.543 5.703 1.00 . A A . 26 ASN CA 1 1 21 11387 1 1 5 ASN CB C -5.434 -2.401 6.713 1.00 . A A . 26 ASN CB 1 1 21 11388 1 1 5 ASN CG C -5.944 -2.754 8.099 1.00 . A A . 26 ASN CG 1 1 21 11389 1 1 5 ASN H H -5.443 -2.444 3.875 1.00 . A A . 26 ASN H 1 1 21 11390 1 1 5 ASN HA H -5.159 -4.438 6.093 1.00 . A A . 26 ASN HA 1 1 21 11391 1 1 5 ASN HB2 H -4.370 -2.172 6.784 1.00 . A A . 26 ASN HB2 1 1 21 11392 1 1 5 ASN HB3 H -5.946 -1.503 6.369 1.00 . A A . 26 ASN HB3 1 1 21 11393 1 1 5 ASN HD21 H -4.233 -3.714 8.584 1.00 . A A . 26 ASN HD21 1 1 21 11394 1 1 5 ASN HD22 H -5.487 -3.680 9.815 1.00 . A A . 26 ASN HD22 1 1 21 11395 1 1 5 ASN N N -4.989 -3.142 4.451 1.00 . A A . 26 ASN N 1 1 21 11396 1 1 5 ASN ND2 N -5.155 -3.445 8.892 1.00 . A A . 26 ASN ND2 1 1 21 11397 1 1 5 ASN O O -7.587 -4.898 6.115 1.00 . A A . 26 ASN O 1 1 21 11398 1 1 5 ASN OD1 O -7.055 -2.419 8.486 1.00 . A A . 26 ASN OD1 1 1 21 11399 1 1 6 CYS C C -9.767 -4.485 3.735 1.00 . A A . 27 CYS C 1 1 21 11400 1 1 6 CYS CA C -9.366 -3.288 4.627 1.00 . A A . 27 CYS CA 1 1 21 11401 1 1 6 CYS CB C -9.958 -1.988 4.050 1.00 . A A . 27 CYS CB 1 1 21 11402 1 1 6 CYS H H -7.507 -2.287 4.374 1.00 . A A . 27 CYS H 1 1 21 11403 1 1 6 CYS HA H -9.802 -3.450 5.613 1.00 . A A . 27 CYS HA 1 1 21 11404 1 1 6 CYS HB2 H -9.587 -1.836 3.035 1.00 . A A . 27 CYS HB2 1 1 21 11405 1 1 6 CYS HB3 H -11.044 -2.095 3.999 1.00 . A A . 27 CYS HB3 1 1 21 11406 1 1 6 CYS N N -7.915 -3.117 4.782 1.00 . A A . 27 CYS N 1 1 21 11407 1 1 6 CYS O O -10.891 -4.982 3.831 1.00 . A A . 27 CYS O 1 1 21 11408 1 1 6 CYS SG S -9.556 -0.549 5.083 1.00 . A A . 27 CYS SG 1 1 21 11409 1 1 7 GLY C C -10.132 -5.589 0.704 1.00 . A A . 28 GLY C 1 1 21 11410 1 1 7 GLY CA C -9.150 -5.969 1.830 1.00 . A A . 28 GLY CA 1 1 21 11411 1 1 7 GLY H H -7.962 -4.508 2.843 1.00 . A A . 28 GLY H 1 1 21 11412 1 1 7 GLY HA2 H -9.544 -6.849 2.339 1.00 . A A . 28 GLY HA2 1 1 21 11413 1 1 7 GLY HA3 H -8.205 -6.249 1.364 1.00 . A A . 28 GLY HA3 1 1 21 11414 1 1 7 GLY N N -8.883 -4.922 2.829 1.00 . A A . 28 GLY N 1 1 21 11415 1 1 7 GLY O O -10.512 -6.456 -0.082 1.00 . A A . 28 GLY O 1 1 21 11416 1 1 8 LYS C C -10.658 -3.414 -1.703 1.00 . A A . 29 LYS C 1 1 21 11417 1 1 8 LYS CA C -11.462 -3.801 -0.442 1.00 . A A . 29 LYS CA 1 1 21 11418 1 1 8 LYS CB C -12.233 -2.571 0.084 1.00 . A A . 29 LYS CB 1 1 21 11419 1 1 8 LYS CD C -13.563 -3.653 2.046 1.00 . A A . 29 LYS CD 1 1 21 11420 1 1 8 LYS CE C -13.585 -5.171 1.813 1.00 . A A . 29 LYS CE 1 1 21 11421 1 1 8 LYS CG C -13.599 -2.854 0.734 1.00 . A A . 29 LYS CG 1 1 21 11422 1 1 8 LYS H H -10.200 -3.664 1.288 1.00 . A A . 29 LYS H 1 1 21 11423 1 1 8 LYS HA H -12.194 -4.562 -0.709 1.00 . A A . 29 LYS HA 1 1 21 11424 1 1 8 LYS HB2 H -11.612 -2.025 0.793 1.00 . A A . 29 LYS HB2 1 1 21 11425 1 1 8 LYS HB3 H -12.431 -1.900 -0.755 1.00 . A A . 29 LYS HB3 1 1 21 11426 1 1 8 LYS HD2 H -12.681 -3.366 2.618 1.00 . A A . 29 LYS HD2 1 1 21 11427 1 1 8 LYS HD3 H -14.445 -3.387 2.630 1.00 . A A . 29 LYS HD3 1 1 21 11428 1 1 8 LYS HE2 H -14.519 -5.435 1.310 1.00 . A A . 29 LYS HE2 1 1 21 11429 1 1 8 LYS HE3 H -12.760 -5.446 1.155 1.00 . A A . 29 LYS HE3 1 1 21 11430 1 1 8 LYS HG2 H -14.049 -1.885 0.956 1.00 . A A . 29 LYS HG2 1 1 21 11431 1 1 8 LYS HG3 H -14.249 -3.355 0.015 1.00 . A A . 29 LYS HG3 1 1 21 11432 1 1 8 LYS HZ1 H -14.224 -5.679 3.725 1.00 . A A . 29 LYS HZ1 1 1 21 11433 1 1 8 LYS HZ2 H -13.485 -6.909 2.946 1.00 . A A . 29 LYS HZ2 1 1 21 11434 1 1 8 LYS HZ3 H -12.592 -5.679 3.560 1.00 . A A . 29 LYS HZ3 1 1 21 11435 1 1 8 LYS N N -10.567 -4.323 0.615 1.00 . A A . 29 LYS N 1 1 21 11436 1 1 8 LYS NZ N -13.469 -5.910 3.097 1.00 . A A . 29 LYS NZ 1 1 21 11437 1 1 8 LYS O O -9.773 -2.563 -1.582 1.00 . A A . 29 LYS O 1 1 21 11438 1 1 9 PRO C C -10.347 -2.107 -4.545 1.00 . A A . 30 PRO C 1 1 21 11439 1 1 9 PRO CA C -10.317 -3.600 -4.178 1.00 . A A . 30 PRO CA 1 1 21 11440 1 1 9 PRO CB C -11.041 -4.422 -5.252 1.00 . A A . 30 PRO CB 1 1 21 11441 1 1 9 PRO CD C -11.876 -5.080 -3.120 1.00 . A A . 30 PRO CD 1 1 21 11442 1 1 9 PRO CG C -11.530 -5.648 -4.493 1.00 . A A . 30 PRO CG 1 1 21 11443 1 1 9 PRO HA H -9.280 -3.928 -4.147 1.00 . A A . 30 PRO HA 1 1 21 11444 1 1 9 PRO HB2 H -11.903 -3.872 -5.634 1.00 . A A . 30 PRO HB2 1 1 21 11445 1 1 9 PRO HB3 H -10.372 -4.695 -6.070 1.00 . A A . 30 PRO HB3 1 1 21 11446 1 1 9 PRO HD2 H -12.903 -4.711 -3.122 1.00 . A A . 30 PRO HD2 1 1 21 11447 1 1 9 PRO HD3 H -11.755 -5.859 -2.369 1.00 . A A . 30 PRO HD3 1 1 21 11448 1 1 9 PRO HG2 H -12.397 -6.106 -4.972 1.00 . A A . 30 PRO HG2 1 1 21 11449 1 1 9 PRO HG3 H -10.716 -6.368 -4.396 1.00 . A A . 30 PRO HG3 1 1 21 11450 1 1 9 PRO N N -10.958 -3.966 -2.901 1.00 . A A . 30 PRO N 1 1 21 11451 1 1 9 PRO O O -9.406 -1.603 -5.162 1.00 . A A . 30 PRO O 1 1 21 11452 1 1 10 GLY C C -10.827 1.055 -3.692 1.00 . A A . 31 GLY C 1 1 21 11453 1 1 10 GLY CA C -11.647 0.031 -4.494 1.00 . A A . 31 GLY CA 1 1 21 11454 1 1 10 GLY H H -12.139 -1.867 -3.660 1.00 . A A . 31 GLY H 1 1 21 11455 1 1 10 GLY HA2 H -12.704 0.254 -4.345 1.00 . A A . 31 GLY HA2 1 1 21 11456 1 1 10 GLY HA3 H -11.419 0.180 -5.549 1.00 . A A . 31 GLY HA3 1 1 21 11457 1 1 10 GLY N N -11.402 -1.382 -4.150 1.00 . A A . 31 GLY N 1 1 21 11458 1 1 10 GLY O O -11.288 2.177 -3.461 1.00 . A A . 31 GLY O 1 1 21 11459 1 1 11 HIS C C -7.743 2.310 -3.379 1.00 . A A . 32 HIS C 1 1 21 11460 1 1 11 HIS CA C -8.729 1.545 -2.482 1.00 . A A . 32 HIS CA 1 1 21 11461 1 1 11 HIS CB C -8.025 0.739 -1.380 1.00 . A A . 32 HIS CB 1 1 21 11462 1 1 11 HIS CD2 C -8.410 1.393 1.063 1.00 . A A . 32 HIS CD2 1 1 21 11463 1 1 11 HIS CE1 C -10.369 0.468 1.418 1.00 . A A . 32 HIS CE1 1 1 21 11464 1 1 11 HIS CG C -8.794 0.772 -0.091 1.00 . A A . 32 HIS CG 1 1 21 11465 1 1 11 HIS H H -9.310 -0.254 -3.463 1.00 . A A . 32 HIS H 1 1 21 11466 1 1 11 HIS HA H -9.322 2.310 -1.985 1.00 . A A . 32 HIS HA 1 1 21 11467 1 1 11 HIS HB2 H -7.911 -0.298 -1.687 1.00 . A A . 32 HIS HB2 1 1 21 11468 1 1 11 HIS HB3 H -7.029 1.144 -1.197 1.00 . A A . 32 HIS HB3 1 1 21 11469 1 1 11 HIS HD1 H -10.551 -0.355 -0.515 1.00 . A A . 32 HIS HD1 1 1 21 11470 1 1 11 HIS HD2 H -7.493 1.946 1.195 1.00 . A A . 32 HIS HD2 1 1 21 11471 1 1 11 HIS HE1 H -11.289 0.146 1.892 1.00 . A A . 32 HIS HE1 1 1 21 11472 1 1 11 HIS N N -9.637 0.671 -3.223 1.00 . A A . 32 HIS N 1 1 21 11473 1 1 11 HIS ND1 N -10.021 0.199 0.147 1.00 . A A . 32 HIS ND1 1 1 21 11474 1 1 11 HIS NE2 N -9.404 1.180 2.027 1.00 . A A . 32 HIS NE2 1 1 21 11475 1 1 11 HIS O O -7.488 1.960 -4.535 1.00 . A A . 32 HIS O 1 1 21 11476 1 1 12 LEU C C -5.433 4.992 -2.313 1.00 . A A . 33 LEU C 1 1 21 11477 1 1 12 LEU CA C -6.354 4.416 -3.404 1.00 . A A . 33 LEU CA 1 1 21 11478 1 1 12 LEU CB C -7.235 5.555 -3.975 1.00 . A A . 33 LEU CB 1 1 21 11479 1 1 12 LEU CD1 C -9.015 6.397 -5.525 1.00 . A A . 33 LEU CD1 1 1 21 11480 1 1 12 LEU CD2 C -7.304 4.849 -6.421 1.00 . A A . 33 LEU CD2 1 1 21 11481 1 1 12 LEU CG C -8.128 5.201 -5.179 1.00 . A A . 33 LEU CG 1 1 21 11482 1 1 12 LEU H H -7.422 3.533 -1.827 1.00 . A A . 33 LEU H 1 1 21 11483 1 1 12 LEU HA H -5.732 3.982 -4.189 1.00 . A A . 33 LEU HA 1 1 21 11484 1 1 12 LEU HB2 H -7.876 5.924 -3.171 1.00 . A A . 33 LEU HB2 1 1 21 11485 1 1 12 LEU HB3 H -6.590 6.382 -4.276 1.00 . A A . 33 LEU HB3 1 1 21 11486 1 1 12 LEU HD11 H -9.640 6.650 -4.668 1.00 . A A . 33 LEU HD11 1 1 21 11487 1 1 12 LEU HD12 H -8.403 7.259 -5.788 1.00 . A A . 33 LEU HD12 1 1 21 11488 1 1 12 LEU HD13 H -9.665 6.144 -6.364 1.00 . A A . 33 LEU HD13 1 1 21 11489 1 1 12 LEU HD21 H -6.644 5.676 -6.681 1.00 . A A . 33 LEU HD21 1 1 21 11490 1 1 12 LEU HD22 H -6.710 3.956 -6.234 1.00 . A A . 33 LEU HD22 1 1 21 11491 1 1 12 LEU HD23 H -7.974 4.646 -7.258 1.00 . A A . 33 LEU HD23 1 1 21 11492 1 1 12 LEU HG H -8.777 4.365 -4.929 1.00 . A A . 33 LEU HG 1 1 21 11493 1 1 12 LEU N N -7.215 3.394 -2.805 1.00 . A A . 33 LEU N 1 1 21 11494 1 1 12 LEU O O -5.684 4.806 -1.119 1.00 . A A . 33 LEU O 1 1 21 11495 1 1 13 SER C C -4.272 7.586 -0.920 1.00 . A A . 34 SER C 1 1 21 11496 1 1 13 SER CA C -3.552 6.575 -1.836 1.00 . A A . 34 SER CA 1 1 21 11497 1 1 13 SER CB C -2.525 7.313 -2.702 1.00 . A A . 34 SER CB 1 1 21 11498 1 1 13 SER H H -4.317 5.926 -3.710 1.00 . A A . 34 SER H 1 1 21 11499 1 1 13 SER HA H -3.013 5.887 -1.184 1.00 . A A . 34 SER HA 1 1 21 11500 1 1 13 SER HB2 H -1.913 7.964 -2.076 1.00 . A A . 34 SER HB2 1 1 21 11501 1 1 13 SER HB3 H -1.877 6.582 -3.188 1.00 . A A . 34 SER HB3 1 1 21 11502 1 1 13 SER HG H -2.501 8.551 -4.227 1.00 . A A . 34 SER HG 1 1 21 11503 1 1 13 SER N N -4.434 5.780 -2.715 1.00 . A A . 34 SER N 1 1 21 11504 1 1 13 SER O O -3.662 8.108 0.016 1.00 . A A . 34 SER O 1 1 21 11505 1 1 13 SER OG O -3.181 8.089 -3.696 1.00 . A A . 34 SER OG 1 1 21 11506 1 1 14 SER C C -7.538 7.940 0.402 1.00 . A A . 35 SER C 1 1 21 11507 1 1 14 SER CA C -6.446 8.710 -0.364 1.00 . A A . 35 SER CA 1 1 21 11508 1 1 14 SER CB C -7.104 9.737 -1.292 1.00 . A A . 35 SER CB 1 1 21 11509 1 1 14 SER H H -5.951 7.476 -2.017 1.00 . A A . 35 SER H 1 1 21 11510 1 1 14 SER HA H -5.859 9.255 0.374 1.00 . A A . 35 SER HA 1 1 21 11511 1 1 14 SER HB2 H -7.785 10.368 -0.717 1.00 . A A . 35 SER HB2 1 1 21 11512 1 1 14 SER HB3 H -6.331 10.371 -1.729 1.00 . A A . 35 SER HB3 1 1 21 11513 1 1 14 SER HG H -8.236 9.757 -2.895 1.00 . A A . 35 SER HG 1 1 21 11514 1 1 14 SER N N -5.560 7.849 -1.164 1.00 . A A . 35 SER N 1 1 21 11515 1 1 14 SER O O -8.201 8.517 1.266 1.00 . A A . 35 SER O 1 1 21 11516 1 1 14 SER OG O -7.818 9.077 -2.331 1.00 . A A . 35 SER OG 1 1 21 11517 1 1 15 GLN C C -8.160 5.222 2.119 1.00 . A A . 36 GLN C 1 1 21 11518 1 1 15 GLN CA C -8.715 5.785 0.791 1.00 . A A . 36 GLN CA 1 1 21 11519 1 1 15 GLN CB C -9.119 4.655 -0.174 1.00 . A A . 36 GLN CB 1 1 21 11520 1 1 15 GLN CD C -11.640 4.834 -0.476 1.00 . A A . 36 GLN CD 1 1 21 11521 1 1 15 GLN CG C -10.493 4.033 0.137 1.00 . A A . 36 GLN CG 1 1 21 11522 1 1 15 GLN H H -7.105 6.214 -0.553 1.00 . A A . 36 GLN H 1 1 21 11523 1 1 15 GLN HA H -9.600 6.381 1.017 1.00 . A A . 36 GLN HA 1 1 21 11524 1 1 15 GLN HB2 H -9.150 5.038 -1.195 1.00 . A A . 36 GLN HB2 1 1 21 11525 1 1 15 GLN HB3 H -8.358 3.878 -0.137 1.00 . A A . 36 GLN HB3 1 1 21 11526 1 1 15 GLN HE21 H -11.721 3.682 -2.163 1.00 . A A . 36 GLN HE21 1 1 21 11527 1 1 15 GLN HE22 H -12.857 5.016 -2.056 1.00 . A A . 36 GLN HE22 1 1 21 11528 1 1 15 GLN HG2 H -10.529 3.026 -0.273 1.00 . A A . 36 GLN HG2 1 1 21 11529 1 1 15 GLN HG3 H -10.636 3.951 1.215 1.00 . A A . 36 GLN HG3 1 1 21 11530 1 1 15 GLN N N -7.727 6.643 0.120 1.00 . A A . 36 GLN N 1 1 21 11531 1 1 15 GLN NE2 N -12.101 4.480 -1.661 1.00 . A A . 36 GLN NE2 1 1 21 11532 1 1 15 GLN O O -8.867 5.218 3.129 1.00 . A A . 36 GLN O 1 1 21 11533 1 1 15 GLN OE1 O -12.138 5.796 0.092 1.00 . A A . 36 GLN OE1 1 1 21 11534 1 1 16 CYS C C -4.581 4.978 3.025 1.00 . A A . 37 CYS C 1 1 21 11535 1 1 16 CYS CA C -6.028 4.491 3.263 1.00 . A A . 37 CYS CA 1 1 21 11536 1 1 16 CYS CB C -6.040 2.965 3.495 1.00 . A A . 37 CYS CB 1 1 21 11537 1 1 16 CYS H H -6.385 4.920 1.231 1.00 . A A . 37 CYS H 1 1 21 11538 1 1 16 CYS HA H -6.400 4.990 4.160 1.00 . A A . 37 CYS HA 1 1 21 11539 1 1 16 CYS HB2 H -6.005 2.439 2.540 1.00 . A A . 37 CYS HB2 1 1 21 11540 1 1 16 CYS HB3 H -5.144 2.672 4.039 1.00 . A A . 37 CYS HB3 1 1 21 11541 1 1 16 CYS N N -6.873 4.839 2.113 1.00 . A A . 37 CYS N 1 1 21 11542 1 1 16 CYS O O -4.240 5.466 1.944 1.00 . A A . 37 CYS O 1 1 21 11543 1 1 16 CYS SG S -7.473 2.460 4.483 1.00 . A A . 37 CYS SG 1 1 21 11544 1 1 17 ARG C C -1.523 4.501 2.823 1.00 . A A . 38 ARG C 1 1 21 11545 1 1 17 ARG CA C -2.279 5.138 3.995 1.00 . A A . 38 ARG CA 1 1 21 11546 1 1 17 ARG CB C -1.632 4.769 5.343 1.00 . A A . 38 ARG CB 1 1 21 11547 1 1 17 ARG CD C -2.467 4.984 7.767 1.00 . A A . 38 ARG CD 1 1 21 11548 1 1 17 ARG CG C -2.069 5.718 6.477 1.00 . A A . 38 ARG CG 1 1 21 11549 1 1 17 ARG CZ C -4.951 4.631 7.569 1.00 . A A . 38 ARG CZ 1 1 21 11550 1 1 17 ARG H H -4.086 4.405 4.888 1.00 . A A . 38 ARG H 1 1 21 11551 1 1 17 ARG HA H -2.178 6.216 3.850 1.00 . A A . 38 ARG HA 1 1 21 11552 1 1 17 ARG HB2 H -1.879 3.733 5.586 1.00 . A A . 38 ARG HB2 1 1 21 11553 1 1 17 ARG HB3 H -0.548 4.835 5.250 1.00 . A A . 38 ARG HB3 1 1 21 11554 1 1 17 ARG HD2 H -1.651 4.319 8.059 1.00 . A A . 38 ARG HD2 1 1 21 11555 1 1 17 ARG HD3 H -2.597 5.715 8.568 1.00 . A A . 38 ARG HD3 1 1 21 11556 1 1 17 ARG HE H -3.589 3.184 7.594 1.00 . A A . 38 ARG HE 1 1 21 11557 1 1 17 ARG HG2 H -1.236 6.385 6.704 1.00 . A A . 38 ARG HG2 1 1 21 11558 1 1 17 ARG HG3 H -2.902 6.342 6.153 1.00 . A A . 38 ARG HG3 1 1 21 11559 1 1 17 ARG HH11 H -4.522 6.566 7.817 1.00 . A A . 38 ARG HH11 1 1 21 11560 1 1 17 ARG HH12 H -6.214 6.194 7.650 1.00 . A A . 38 ARG HH12 1 1 21 11561 1 1 17 ARG HH21 H -5.749 2.804 7.342 1.00 . A A . 38 ARG HH21 1 1 21 11562 1 1 17 ARG HH22 H -6.877 4.122 7.323 1.00 . A A . 38 ARG HH22 1 1 21 11563 1 1 17 ARG N N -3.717 4.803 4.035 1.00 . A A . 38 ARG N 1 1 21 11564 1 1 17 ARG NE N -3.705 4.190 7.610 1.00 . A A . 38 ARG NE 1 1 21 11565 1 1 17 ARG NH1 N -5.254 5.895 7.664 1.00 . A A . 38 ARG NH1 1 1 21 11566 1 1 17 ARG NH2 N -5.930 3.792 7.412 1.00 . A A . 38 ARG NH2 1 1 21 11567 1 1 17 ARG O O -0.618 5.145 2.291 1.00 . A A . 38 ARG O 1 1 21 11568 1 1 18 ALA C C -2.342 1.541 0.635 1.00 . A A . 39 ALA C 1 1 21 11569 1 1 18 ALA CA C -1.418 2.674 1.145 1.00 . A A . 39 ALA CA 1 1 21 11570 1 1 18 ALA CB C -0.018 2.100 1.410 1.00 . A A . 39 ALA CB 1 1 21 11571 1 1 18 ALA H H -2.639 2.825 2.883 1.00 . A A . 39 ALA H 1 1 21 11572 1 1 18 ALA HA H -1.353 3.442 0.375 1.00 . A A . 39 ALA HA 1 1 21 11573 1 1 18 ALA HB1 H 0.665 2.888 1.724 1.00 . A A . 39 ALA HB1 1 1 21 11574 1 1 18 ALA HB2 H -0.083 1.337 2.185 1.00 . A A . 39 ALA HB2 1 1 21 11575 1 1 18 ALA HB3 H 0.376 1.639 0.505 1.00 . A A . 39 ALA HB3 1 1 21 11576 1 1 18 ALA N N -1.905 3.299 2.381 1.00 . A A . 39 ALA N 1 1 21 11577 1 1 18 ALA O O -3.084 0.946 1.423 1.00 . A A . 39 ALA O 1 1 21 11578 1 1 19 PRO C C -1.693 -1.252 -0.650 1.00 . A A . 40 PRO C 1 1 21 11579 1 1 19 PRO CA C -2.665 -0.155 -1.132 1.00 . A A . 40 PRO CA 1 1 21 11580 1 1 19 PRO CB C -2.674 -0.032 -2.659 1.00 . A A . 40 PRO CB 1 1 21 11581 1 1 19 PRO CD C -1.619 1.916 -1.739 1.00 . A A . 40 PRO CD 1 1 21 11582 1 1 19 PRO CG C -1.550 0.966 -2.935 1.00 . A A . 40 PRO CG 1 1 21 11583 1 1 19 PRO HA H -3.671 -0.390 -0.782 1.00 . A A . 40 PRO HA 1 1 21 11584 1 1 19 PRO HB2 H -2.496 -0.985 -3.156 1.00 . A A . 40 PRO HB2 1 1 21 11585 1 1 19 PRO HB3 H -3.626 0.392 -2.984 1.00 . A A . 40 PRO HB3 1 1 21 11586 1 1 19 PRO HD2 H -0.614 2.250 -1.477 1.00 . A A . 40 PRO HD2 1 1 21 11587 1 1 19 PRO HD3 H -2.243 2.776 -1.990 1.00 . A A . 40 PRO HD3 1 1 21 11588 1 1 19 PRO HG2 H -0.590 0.447 -2.933 1.00 . A A . 40 PRO HG2 1 1 21 11589 1 1 19 PRO HG3 H -1.698 1.491 -3.878 1.00 . A A . 40 PRO HG3 1 1 21 11590 1 1 19 PRO N N -2.249 1.165 -0.658 1.00 . A A . 40 PRO N 1 1 21 11591 1 1 19 PRO O O -0.597 -0.963 -0.164 1.00 . A A . 40 PRO O 1 1 21 11592 1 1 20 LYS C C 0.117 -3.857 -0.835 1.00 . A A . 41 LYS C 1 1 21 11593 1 1 20 LYS CA C -1.346 -3.737 -0.380 1.00 . A A . 41 LYS CA 1 1 21 11594 1 1 20 LYS CB C -2.181 -4.969 -0.781 1.00 . A A . 41 LYS CB 1 1 21 11595 1 1 20 LYS CD C -2.843 -7.359 -0.281 1.00 . A A . 41 LYS CD 1 1 21 11596 1 1 20 LYS CE C -2.678 -8.578 0.640 1.00 . A A . 41 LYS CE 1 1 21 11597 1 1 20 LYS CG C -1.882 -6.212 0.074 1.00 . A A . 41 LYS CG 1 1 21 11598 1 1 20 LYS H H -2.980 -2.667 -1.259 1.00 . A A . 41 LYS H 1 1 21 11599 1 1 20 LYS HA H -1.296 -3.692 0.707 1.00 . A A . 41 LYS HA 1 1 21 11600 1 1 20 LYS HB2 H -3.239 -4.732 -0.656 1.00 . A A . 41 LYS HB2 1 1 21 11601 1 1 20 LYS HB3 H -2.013 -5.198 -1.835 1.00 . A A . 41 LYS HB3 1 1 21 11602 1 1 20 LYS HD2 H -3.869 -7.000 -0.177 1.00 . A A . 41 LYS HD2 1 1 21 11603 1 1 20 LYS HD3 H -2.693 -7.660 -1.319 1.00 . A A . 41 LYS HD3 1 1 21 11604 1 1 20 LYS HE2 H -2.779 -8.252 1.679 1.00 . A A . 41 LYS HE2 1 1 21 11605 1 1 20 LYS HE3 H -3.498 -9.273 0.435 1.00 . A A . 41 LYS HE3 1 1 21 11606 1 1 20 LYS HG2 H -0.856 -6.535 -0.099 1.00 . A A . 41 LYS HG2 1 1 21 11607 1 1 20 LYS HG3 H -2.004 -5.957 1.128 1.00 . A A . 41 LYS HG3 1 1 21 11608 1 1 20 LYS HZ1 H -1.269 -9.588 -0.511 1.00 . A A . 41 LYS HZ1 1 1 21 11609 1 1 20 LYS HZ2 H -0.597 -8.680 0.676 1.00 . A A . 41 LYS HZ2 1 1 21 11610 1 1 20 LYS HZ3 H -1.318 -10.096 1.036 1.00 . A A . 41 LYS HZ3 1 1 21 11611 1 1 20 LYS N N -2.066 -2.526 -0.838 1.00 . A A . 41 LYS N 1 1 21 11612 1 1 20 LYS NZ N -1.379 -9.277 0.444 1.00 . A A . 41 LYS NZ 1 1 21 11613 1 1 20 LYS O O 0.885 -4.611 -0.240 1.00 . A A . 41 LYS O 1 1 21 11614 1 1 21 VAL C C 2.848 -2.450 -1.126 1.00 . A A . 42 VAL C 1 1 21 11615 1 1 21 VAL CA C 1.928 -2.900 -2.279 1.00 . A A . 42 VAL CA 1 1 21 11616 1 1 21 VAL CB C 1.975 -1.866 -3.430 1.00 . A A . 42 VAL CB 1 1 21 11617 1 1 21 VAL CG1 C 3.387 -1.658 -3.986 1.00 . A A . 42 VAL CG1 1 1 21 11618 1 1 21 VAL CG2 C 1.081 -2.287 -4.607 1.00 . A A . 42 VAL CG2 1 1 21 11619 1 1 21 VAL H H -0.178 -2.520 -2.286 1.00 . A A . 42 VAL H 1 1 21 11620 1 1 21 VAL HA H 2.312 -3.847 -2.655 1.00 . A A . 42 VAL HA 1 1 21 11621 1 1 21 VAL HB H 1.614 -0.907 -3.055 1.00 . A A . 42 VAL HB 1 1 21 11622 1 1 21 VAL HG11 H 3.804 -2.611 -4.312 1.00 . A A . 42 VAL HG11 1 1 21 11623 1 1 21 VAL HG12 H 3.359 -0.972 -4.834 1.00 . A A . 42 VAL HG12 1 1 21 11624 1 1 21 VAL HG13 H 4.033 -1.220 -3.226 1.00 . A A . 42 VAL HG13 1 1 21 11625 1 1 21 VAL HG21 H 1.390 -3.265 -4.978 1.00 . A A . 42 VAL HG21 1 1 21 11626 1 1 21 VAL HG22 H 0.035 -2.329 -4.305 1.00 . A A . 42 VAL HG22 1 1 21 11627 1 1 21 VAL HG23 H 1.166 -1.559 -5.415 1.00 . A A . 42 VAL HG23 1 1 21 11628 1 1 21 VAL N N 0.528 -3.090 -1.846 1.00 . A A . 42 VAL N 1 1 21 11629 1 1 21 VAL O O 4.026 -2.812 -1.101 1.00 . A A . 42 VAL O 1 1 21 11630 1 1 22 CYS C C 2.131 -0.995 2.210 1.00 . A A . 43 CYS C 1 1 21 11631 1 1 22 CYS CA C 3.026 -1.058 0.943 1.00 . A A . 43 CYS CA 1 1 21 11632 1 1 22 CYS CB C 3.468 0.323 0.420 1.00 . A A . 43 CYS CB 1 1 21 11633 1 1 22 CYS H H 1.316 -1.496 -0.222 1.00 . A A . 43 CYS H 1 1 21 11634 1 1 22 CYS HA H 3.916 -1.637 1.187 1.00 . A A . 43 CYS HA 1 1 21 11635 1 1 22 CYS HB2 H 3.922 0.191 -0.565 1.00 . A A . 43 CYS HB2 1 1 21 11636 1 1 22 CYS HB3 H 2.595 0.969 0.306 1.00 . A A . 43 CYS HB3 1 1 21 11637 1 1 22 CYS N N 2.308 -1.696 -0.162 1.00 . A A . 43 CYS N 1 1 21 11638 1 1 22 CYS O O 1.191 -1.774 2.371 1.00 . A A . 43 CYS O 1 1 21 11639 1 1 22 CYS SG S 4.684 1.103 1.513 1.00 . A A . 43 CYS SG 1 1 21 11640 1 1 23 PHE C C 1.593 1.877 4.470 1.00 . A A . 44 PHE C 1 1 21 11641 1 1 23 PHE CA C 1.647 0.346 4.272 1.00 . A A . 44 PHE CA 1 1 21 11642 1 1 23 PHE CB C 2.203 -0.341 5.532 1.00 . A A . 44 PHE CB 1 1 21 11643 1 1 23 PHE CD1 C 4.728 -0.030 5.484 1.00 . A A . 44 PHE CD1 1 1 21 11644 1 1 23 PHE CD2 C 3.427 1.185 7.145 1.00 . A A . 44 PHE CD2 1 1 21 11645 1 1 23 PHE CE1 C 5.902 0.579 5.962 1.00 . A A . 44 PHE CE1 1 1 21 11646 1 1 23 PHE CE2 C 4.602 1.794 7.624 1.00 . A A . 44 PHE CE2 1 1 21 11647 1 1 23 PHE CG C 3.484 0.273 6.072 1.00 . A A . 44 PHE CG 1 1 21 11648 1 1 23 PHE CZ C 5.840 1.493 7.029 1.00 . A A . 44 PHE CZ 1 1 21 11649 1 1 23 PHE H H 3.273 0.469 2.890 1.00 . A A . 44 PHE H 1 1 21 11650 1 1 23 PHE HA H 0.622 0.006 4.129 1.00 . A A . 44 PHE HA 1 1 21 11651 1 1 23 PHE HB2 H 1.440 -0.286 6.310 1.00 . A A . 44 PHE HB2 1 1 21 11652 1 1 23 PHE HB3 H 2.369 -1.400 5.325 1.00 . A A . 44 PHE HB3 1 1 21 11653 1 1 23 PHE HD1 H 4.785 -0.730 4.660 1.00 . A A . 44 PHE HD1 1 1 21 11654 1 1 23 PHE HD2 H 2.475 1.429 7.600 1.00 . A A . 44 PHE HD2 1 1 21 11655 1 1 23 PHE HE1 H 6.855 0.345 5.508 1.00 . A A . 44 PHE HE1 1 1 21 11656 1 1 23 PHE HE2 H 4.552 2.494 8.445 1.00 . A A . 44 PHE HE2 1 1 21 11657 1 1 23 PHE HZ H 6.744 1.960 7.394 1.00 . A A . 44 PHE HZ 1 1 21 11658 1 1 23 PHE N N 2.438 -0.057 3.106 1.00 . A A . 44 PHE N 1 1 21 11659 1 1 23 PHE O O 0.672 2.362 5.131 1.00 . A A . 44 PHE O 1 1 21 11660 1 1 24 LYS C C 3.394 4.828 2.929 1.00 . A A . 45 LYS C 1 1 21 11661 1 1 24 LYS CA C 2.631 4.114 4.055 1.00 . A A . 45 LYS CA 1 1 21 11662 1 1 24 LYS CB C 3.279 4.412 5.424 1.00 . A A . 45 LYS CB 1 1 21 11663 1 1 24 LYS CD C 3.900 6.124 7.171 1.00 . A A . 45 LYS CD 1 1 21 11664 1 1 24 LYS CE C 3.933 7.620 7.512 1.00 . A A . 45 LYS CE 1 1 21 11665 1 1 24 LYS CG C 3.307 5.909 5.772 1.00 . A A . 45 LYS CG 1 1 21 11666 1 1 24 LYS H H 3.257 2.181 3.353 1.00 . A A . 45 LYS H 1 1 21 11667 1 1 24 LYS HA H 1.621 4.527 4.055 1.00 . A A . 45 LYS HA 1 1 21 11668 1 1 24 LYS HB2 H 2.710 3.899 6.200 1.00 . A A . 45 LYS HB2 1 1 21 11669 1 1 24 LYS HB3 H 4.297 4.021 5.439 1.00 . A A . 45 LYS HB3 1 1 21 11670 1 1 24 LYS HD2 H 3.291 5.596 7.906 1.00 . A A . 45 LYS HD2 1 1 21 11671 1 1 24 LYS HD3 H 4.916 5.724 7.197 1.00 . A A . 45 LYS HD3 1 1 21 11672 1 1 24 LYS HE2 H 4.532 8.139 6.758 1.00 . A A . 45 LYS HE2 1 1 21 11673 1 1 24 LYS HE3 H 2.913 8.015 7.459 1.00 . A A . 45 LYS HE3 1 1 21 11674 1 1 24 LYS HG2 H 3.917 6.447 5.043 1.00 . A A . 45 LYS HG2 1 1 21 11675 1 1 24 LYS HG3 H 2.290 6.305 5.745 1.00 . A A . 45 LYS HG3 1 1 21 11676 1 1 24 LYS HZ1 H 3.952 7.400 9.580 1.00 . A A . 45 LYS HZ1 1 1 21 11677 1 1 24 LYS HZ2 H 5.449 7.519 8.933 1.00 . A A . 45 LYS HZ2 1 1 21 11678 1 1 24 LYS HZ3 H 4.516 8.846 9.081 1.00 . A A . 45 LYS HZ3 1 1 21 11679 1 1 24 LYS N N 2.544 2.646 3.899 1.00 . A A . 45 LYS N 1 1 21 11680 1 1 24 LYS NZ N 4.499 7.860 8.865 1.00 . A A . 45 LYS NZ 1 1 21 11681 1 1 24 LYS O O 2.846 5.751 2.325 1.00 . A A . 45 LYS O 1 1 21 11682 1 1 25 CYS C C 5.210 4.951 0.231 1.00 . A A . 46 CYS C 1 1 21 11683 1 1 25 CYS CA C 5.546 5.127 1.729 1.00 . A A . 46 CYS CA 1 1 21 11684 1 1 25 CYS CB C 7.003 4.754 2.073 1.00 . A A . 46 CYS CB 1 1 21 11685 1 1 25 CYS H H 5.043 3.681 3.190 1.00 . A A . 46 CYS H 1 1 21 11686 1 1 25 CYS HA H 5.451 6.197 1.926 1.00 . A A . 46 CYS HA 1 1 21 11687 1 1 25 CYS HB2 H 7.634 4.908 1.196 1.00 . A A . 46 CYS HB2 1 1 21 11688 1 1 25 CYS HB3 H 7.352 5.436 2.849 1.00 . A A . 46 CYS HB3 1 1 21 11689 1 1 25 CYS N N 4.637 4.431 2.648 1.00 . A A . 46 CYS N 1 1 21 11690 1 1 25 CYS O O 5.405 5.893 -0.539 1.00 . A A . 46 CYS O 1 1 21 11691 1 1 25 CYS SG S 7.195 3.053 2.686 1.00 . A A . 46 CYS SG 1 1 21 11692 1 1 26 LYS C C 4.622 3.980 -2.772 1.00 . A A . 47 LYS C 1 1 21 11693 1 1 26 LYS CA C 3.958 3.502 -1.456 1.00 . A A . 47 LYS CA 1 1 21 11694 1 1 26 LYS CB C 2.461 3.878 -1.342 1.00 . A A . 47 LYS CB 1 1 21 11695 1 1 26 LYS CD C 0.705 5.689 -0.995 1.00 . A A . 47 LYS CD 1 1 21 11696 1 1 26 LYS CE C 0.487 7.108 -0.448 1.00 . A A . 47 LYS CE 1 1 21 11697 1 1 26 LYS CG C 2.200 5.383 -1.156 1.00 . A A . 47 LYS CG 1 1 21 11698 1 1 26 LYS H H 4.562 3.090 0.552 1.00 . A A . 47 LYS H 1 1 21 11699 1 1 26 LYS HA H 3.974 2.417 -1.555 1.00 . A A . 47 LYS HA 1 1 21 11700 1 1 26 LYS HB2 H 1.928 3.530 -2.228 1.00 . A A . 47 LYS HB2 1 1 21 11701 1 1 26 LYS HB3 H 2.044 3.347 -0.485 1.00 . A A . 47 LYS HB3 1 1 21 11702 1 1 26 LYS HD2 H 0.223 5.601 -1.970 1.00 . A A . 47 LYS HD2 1 1 21 11703 1 1 26 LYS HD3 H 0.246 4.969 -0.319 1.00 . A A . 47 LYS HD3 1 1 21 11704 1 1 26 LYS HE2 H 1.103 7.810 -1.018 1.00 . A A . 47 LYS HE2 1 1 21 11705 1 1 26 LYS HE3 H -0.560 7.384 -0.595 1.00 . A A . 47 LYS HE3 1 1 21 11706 1 1 26 LYS HG2 H 2.717 5.723 -0.265 1.00 . A A . 47 LYS HG2 1 1 21 11707 1 1 26 LYS HG3 H 2.589 5.936 -2.011 1.00 . A A . 47 LYS HG3 1 1 21 11708 1 1 26 LYS HZ1 H 1.756 6.894 1.206 1.00 . A A . 47 LYS HZ1 1 1 21 11709 1 1 26 LYS HZ2 H 0.687 8.134 1.357 1.00 . A A . 47 LYS HZ2 1 1 21 11710 1 1 26 LYS HZ3 H 0.205 6.574 1.538 1.00 . A A . 47 LYS HZ3 1 1 21 11711 1 1 26 LYS N N 4.634 3.804 -0.166 1.00 . A A . 47 LYS N 1 1 21 11712 1 1 26 LYS NZ N 0.807 7.195 1.002 1.00 . A A . 47 LYS NZ 1 1 21 11713 1 1 26 LYS O O 3.939 4.134 -3.785 1.00 . A A . 47 LYS O 1 1 21 11714 1 1 27 GLN C C 6.729 3.491 -5.071 1.00 . A A . 48 GLN C 1 1 21 11715 1 1 27 GLN CA C 6.687 4.608 -3.993 1.00 . A A . 48 GLN CA 1 1 21 11716 1 1 27 GLN CB C 8.114 5.043 -3.607 1.00 . A A . 48 GLN CB 1 1 21 11717 1 1 27 GLN CD C 7.427 7.452 -3.095 1.00 . A A . 48 GLN CD 1 1 21 11718 1 1 27 GLN CG C 8.179 6.212 -2.610 1.00 . A A . 48 GLN CG 1 1 21 11719 1 1 27 GLN H H 6.446 4.071 -1.924 1.00 . A A . 48 GLN H 1 1 21 11720 1 1 27 GLN HA H 6.166 5.466 -4.411 1.00 . A A . 48 GLN HA 1 1 21 11721 1 1 27 GLN HB2 H 8.637 4.196 -3.171 1.00 . A A . 48 GLN HB2 1 1 21 11722 1 1 27 GLN HB3 H 8.653 5.336 -4.509 1.00 . A A . 48 GLN HB3 1 1 21 11723 1 1 27 GLN HE21 H 5.931 7.190 -1.760 1.00 . A A . 48 GLN HE21 1 1 21 11724 1 1 27 GLN HE22 H 5.797 8.589 -2.830 1.00 . A A . 48 GLN HE22 1 1 21 11725 1 1 27 GLN HG2 H 7.788 5.894 -1.645 1.00 . A A . 48 GLN HG2 1 1 21 11726 1 1 27 GLN HG3 H 9.225 6.482 -2.456 1.00 . A A . 48 GLN HG3 1 1 21 11727 1 1 27 GLN N N 5.942 4.194 -2.790 1.00 . A A . 48 GLN N 1 1 21 11728 1 1 27 GLN NE2 N 6.293 7.772 -2.512 1.00 . A A . 48 GLN NE2 1 1 21 11729 1 1 27 GLN O O 6.716 2.312 -4.697 1.00 . A A . 48 GLN O 1 1 21 11730 1 1 27 GLN OE1 O 7.840 8.142 -4.018 1.00 . A A . 48 GLN OE1 1 1 21 11731 1 1 28 PRO C C 7.390 1.549 -7.526 1.00 . A A . 49 PRO C 1 1 21 11732 1 1 28 PRO CA C 6.623 2.886 -7.506 1.00 . A A . 49 PRO CA 1 1 21 11733 1 1 28 PRO CB C 6.962 3.691 -8.767 1.00 . A A . 49 PRO CB 1 1 21 11734 1 1 28 PRO CD C 6.959 5.179 -6.902 1.00 . A A . 49 PRO CD 1 1 21 11735 1 1 28 PRO CG C 6.587 5.116 -8.381 1.00 . A A . 49 PRO CG 1 1 21 11736 1 1 28 PRO HA H 5.558 2.649 -7.535 1.00 . A A . 49 PRO HA 1 1 21 11737 1 1 28 PRO HB2 H 8.032 3.641 -8.967 1.00 . A A . 49 PRO HB2 1 1 21 11738 1 1 28 PRO HB3 H 6.394 3.345 -9.631 1.00 . A A . 49 PRO HB3 1 1 21 11739 1 1 28 PRO HD2 H 7.995 5.505 -6.803 1.00 . A A . 49 PRO HD2 1 1 21 11740 1 1 28 PRO HD3 H 6.294 5.884 -6.404 1.00 . A A . 49 PRO HD3 1 1 21 11741 1 1 28 PRO HG2 H 7.133 5.853 -8.970 1.00 . A A . 49 PRO HG2 1 1 21 11742 1 1 28 PRO HG3 H 5.509 5.255 -8.494 1.00 . A A . 49 PRO HG3 1 1 21 11743 1 1 28 PRO N N 6.826 3.818 -6.380 1.00 . A A . 49 PRO N 1 1 21 11744 1 1 28 PRO O O 6.928 0.608 -8.173 1.00 . A A . 49 PRO O 1 1 21 11745 1 1 29 GLY C C 10.225 0.005 -5.586 1.00 . A A . 50 GLY C 1 1 21 11746 1 1 29 GLY CA C 9.372 0.221 -6.842 1.00 . A A . 50 GLY CA 1 1 21 11747 1 1 29 GLY H H 8.904 2.276 -6.416 1.00 . A A . 50 GLY H 1 1 21 11748 1 1 29 GLY HA2 H 10.041 0.246 -7.702 1.00 . A A . 50 GLY HA2 1 1 21 11749 1 1 29 GLY HA3 H 8.730 -0.655 -6.941 1.00 . A A . 50 GLY HA3 1 1 21 11750 1 1 29 GLY N N 8.542 1.441 -6.853 1.00 . A A . 50 GLY N 1 1 21 11751 1 1 29 GLY O O 11.109 -0.854 -5.584 1.00 . A A . 50 GLY O 1 1 21 11752 1 1 30 HIS C C 10.496 -0.628 -2.480 1.00 . A A . 51 HIS C 1 1 21 11753 1 1 30 HIS CA C 10.756 0.677 -3.260 1.00 . A A . 51 HIS CA 1 1 21 11754 1 1 30 HIS CB C 10.412 1.888 -2.373 1.00 . A A . 51 HIS CB 1 1 21 11755 1 1 30 HIS CD2 C 8.988 1.483 -0.287 1.00 . A A . 51 HIS CD2 1 1 21 11756 1 1 30 HIS CE1 C 6.989 1.304 -1.180 1.00 . A A . 51 HIS CE1 1 1 21 11757 1 1 30 HIS CG C 9.103 1.743 -1.626 1.00 . A A . 51 HIS CG 1 1 21 11758 1 1 30 HIS H H 9.271 1.471 -4.582 1.00 . A A . 51 HIS H 1 1 21 11759 1 1 30 HIS HA H 11.821 0.720 -3.492 1.00 . A A . 51 HIS HA 1 1 21 11760 1 1 30 HIS HB2 H 11.210 2.004 -1.636 1.00 . A A . 51 HIS HB2 1 1 21 11761 1 1 30 HIS HB3 H 10.402 2.796 -2.976 1.00 . A A . 51 HIS HB3 1 1 21 11762 1 1 30 HIS HD1 H 7.560 1.780 -3.133 1.00 . A A . 51 HIS HD1 1 1 21 11763 1 1 30 HIS HD2 H 9.805 1.429 0.420 1.00 . A A . 51 HIS HD2 1 1 21 11764 1 1 30 HIS HE1 H 5.928 1.131 -1.309 1.00 . A A . 51 HIS HE1 1 1 21 11765 1 1 30 HIS N N 9.999 0.775 -4.518 1.00 . A A . 51 HIS N 1 1 21 11766 1 1 30 HIS ND1 N 7.837 1.634 -2.164 1.00 . A A . 51 HIS ND1 1 1 21 11767 1 1 30 HIS NE2 N 7.644 1.201 -0.013 1.00 . A A . 51 HIS NE2 1 1 21 11768 1 1 30 HIS O O 11.364 -1.109 -1.748 1.00 . A A . 51 HIS O 1 1 21 11769 1 1 31 PHE C C 9.604 -3.498 -1.715 1.00 . A A . 52 PHE C 1 1 21 11770 1 1 31 PHE CA C 8.754 -2.223 -1.720 1.00 . A A . 52 PHE CA 1 1 21 11771 1 1 31 PHE CB C 7.278 -2.492 -2.060 1.00 . A A . 52 PHE CB 1 1 21 11772 1 1 31 PHE CD1 C 6.684 -1.742 -4.413 1.00 . A A . 52 PHE CD1 1 1 21 11773 1 1 31 PHE CD2 C 6.997 -4.119 -3.991 1.00 . A A . 52 PHE CD2 1 1 21 11774 1 1 31 PHE CE1 C 6.413 -2.017 -5.764 1.00 . A A . 52 PHE CE1 1 1 21 11775 1 1 31 PHE CE2 C 6.729 -4.393 -5.343 1.00 . A A . 52 PHE CE2 1 1 21 11776 1 1 31 PHE CG C 6.983 -2.791 -3.521 1.00 . A A . 52 PHE CG 1 1 21 11777 1 1 31 PHE CZ C 6.438 -3.342 -6.232 1.00 . A A . 52 PHE CZ 1 1 21 11778 1 1 31 PHE H H 8.644 -0.753 -3.250 1.00 . A A . 52 PHE H 1 1 21 11779 1 1 31 PHE HA H 8.780 -1.829 -0.702 1.00 . A A . 52 PHE HA 1 1 21 11780 1 1 31 PHE HB2 H 6.920 -3.319 -1.446 1.00 . A A . 52 PHE HB2 1 1 21 11781 1 1 31 PHE HB3 H 6.697 -1.615 -1.769 1.00 . A A . 52 PHE HB3 1 1 21 11782 1 1 31 PHE HD1 H 6.642 -0.720 -4.060 1.00 . A A . 52 PHE HD1 1 1 21 11783 1 1 31 PHE HD2 H 7.221 -4.932 -3.316 1.00 . A A . 52 PHE HD2 1 1 21 11784 1 1 31 PHE HE1 H 6.170 -1.212 -6.443 1.00 . A A . 52 PHE HE1 1 1 21 11785 1 1 31 PHE HE2 H 6.750 -5.414 -5.702 1.00 . A A . 52 PHE HE2 1 1 21 11786 1 1 31 PHE HZ H 6.227 -3.554 -7.272 1.00 . A A . 52 PHE HZ 1 1 21 11787 1 1 31 PHE N N 9.287 -1.188 -2.610 1.00 . A A . 52 PHE N 1 1 21 11788 1 1 31 PHE O O 9.922 -4.004 -0.640 1.00 . A A . 52 PHE O 1 1 21 11789 1 1 32 SER C C 12.346 -4.976 -2.286 1.00 . A A . 53 SER C 1 1 21 11790 1 1 32 SER CA C 10.995 -5.106 -3.019 1.00 . A A . 53 SER CA 1 1 21 11791 1 1 32 SER CB C 11.249 -5.382 -4.508 1.00 . A A . 53 SER CB 1 1 21 11792 1 1 32 SER H H 9.769 -3.506 -3.725 1.00 . A A . 53 SER H 1 1 21 11793 1 1 32 SER HA H 10.493 -5.979 -2.602 1.00 . A A . 53 SER HA 1 1 21 11794 1 1 32 SER HB2 H 11.790 -4.543 -4.946 1.00 . A A . 53 SER HB2 1 1 21 11795 1 1 32 SER HB3 H 11.855 -6.284 -4.612 1.00 . A A . 53 SER HB3 1 1 21 11796 1 1 32 SER HG H 10.218 -5.762 -6.132 1.00 . A A . 53 SER HG 1 1 21 11797 1 1 32 SER N N 10.089 -3.948 -2.873 1.00 . A A . 53 SER N 1 1 21 11798 1 1 32 SER O O 13.120 -5.935 -2.264 1.00 . A A . 53 SER O 1 1 21 11799 1 1 32 SER OG O 10.020 -5.563 -5.197 1.00 . A A . 53 SER OG 1 1 21 11800 1 1 33 LYS C C 13.550 -2.950 0.513 1.00 . A A . 54 LYS C 1 1 21 11801 1 1 33 LYS CA C 13.849 -3.507 -0.898 1.00 . A A . 54 LYS CA 1 1 21 11802 1 1 33 LYS CB C 14.758 -2.550 -1.702 1.00 . A A . 54 LYS CB 1 1 21 11803 1 1 33 LYS CD C 14.447 -2.771 -4.276 1.00 . A A . 54 LYS CD 1 1 21 11804 1 1 33 LYS CE C 14.647 -1.304 -4.680 1.00 . A A . 54 LYS CE 1 1 21 11805 1 1 33 LYS CG C 15.277 -3.135 -3.032 1.00 . A A . 54 LYS CG 1 1 21 11806 1 1 33 LYS H H 11.965 -3.059 -1.787 1.00 . A A . 54 LYS H 1 1 21 11807 1 1 33 LYS HA H 14.408 -4.428 -0.730 1.00 . A A . 54 LYS HA 1 1 21 11808 1 1 33 LYS HB2 H 14.238 -1.607 -1.879 1.00 . A A . 54 LYS HB2 1 1 21 11809 1 1 33 LYS HB3 H 15.636 -2.329 -1.093 1.00 . A A . 54 LYS HB3 1 1 21 11810 1 1 33 LYS HD2 H 14.776 -3.411 -5.099 1.00 . A A . 54 LYS HD2 1 1 21 11811 1 1 33 LYS HD3 H 13.391 -2.960 -4.097 1.00 . A A . 54 LYS HD3 1 1 21 11812 1 1 33 LYS HE2 H 14.289 -0.659 -3.873 1.00 . A A . 54 LYS HE2 1 1 21 11813 1 1 33 LYS HE3 H 15.718 -1.121 -4.806 1.00 . A A . 54 LYS HE3 1 1 21 11814 1 1 33 LYS HG2 H 16.295 -2.777 -3.191 1.00 . A A . 54 LYS HG2 1 1 21 11815 1 1 33 LYS HG3 H 15.332 -4.221 -2.946 1.00 . A A . 54 LYS HG3 1 1 21 11816 1 1 33 LYS HZ1 H 14.235 -1.584 -6.699 1.00 . A A . 54 LYS HZ1 1 1 21 11817 1 1 33 LYS HZ2 H 12.927 -1.102 -5.835 1.00 . A A . 54 LYS HZ2 1 1 21 11818 1 1 33 LYS HZ3 H 14.098 -0.029 -6.224 1.00 . A A . 54 LYS HZ3 1 1 21 11819 1 1 33 LYS N N 12.636 -3.813 -1.676 1.00 . A A . 54 LYS N 1 1 21 11820 1 1 33 LYS NZ N 13.931 -0.987 -5.942 1.00 . A A . 54 LYS NZ 1 1 21 11821 1 1 33 LYS O O 14.487 -2.553 1.209 1.00 . A A . 54 LYS O 1 1 21 11822 1 1 34 GLN C C 10.605 -3.004 2.868 1.00 . A A . 55 GLN C 1 1 21 11823 1 1 34 GLN CA C 11.899 -2.396 2.282 1.00 . A A . 55 GLN CA 1 1 21 11824 1 1 34 GLN CB C 11.756 -0.864 2.187 1.00 . A A . 55 GLN CB 1 1 21 11825 1 1 34 GLN CD C 11.321 1.277 3.463 1.00 . A A . 55 GLN CD 1 1 21 11826 1 1 34 GLN CG C 11.685 -0.200 3.570 1.00 . A A . 55 GLN CG 1 1 21 11827 1 1 34 GLN H H 11.565 -3.300 0.353 1.00 . A A . 55 GLN H 1 1 21 11828 1 1 34 GLN HA H 12.703 -2.621 2.985 1.00 . A A . 55 GLN HA 1 1 21 11829 1 1 34 GLN HB2 H 12.612 -0.446 1.656 1.00 . A A . 55 GLN HB2 1 1 21 11830 1 1 34 GLN HB3 H 10.856 -0.623 1.618 1.00 . A A . 55 GLN HB3 1 1 21 11831 1 1 34 GLN HE21 H 9.351 0.856 3.517 1.00 . A A . 55 GLN HE21 1 1 21 11832 1 1 34 GLN HE22 H 9.766 2.557 3.383 1.00 . A A . 55 GLN HE22 1 1 21 11833 1 1 34 GLN HG2 H 10.933 -0.693 4.186 1.00 . A A . 55 GLN HG2 1 1 21 11834 1 1 34 GLN HG3 H 12.649 -0.298 4.070 1.00 . A A . 55 GLN HG3 1 1 21 11835 1 1 34 GLN N N 12.281 -2.914 0.951 1.00 . A A . 55 GLN N 1 1 21 11836 1 1 34 GLN NE2 N 10.044 1.591 3.467 1.00 . A A . 55 GLN NE2 1 1 21 11837 1 1 34 GLN O O 10.602 -3.424 4.029 1.00 . A A . 55 GLN O 1 1 21 11838 1 1 34 GLN OE1 O 12.164 2.160 3.369 1.00 . A A . 55 GLN OE1 1 1 21 11839 1 1 35 CYS C C 7.627 -4.736 2.063 1.00 . A A . 56 CYS C 1 1 21 11840 1 1 35 CYS CA C 8.154 -3.362 2.550 1.00 . A A . 56 CYS CA 1 1 21 11841 1 1 35 CYS CB C 7.227 -2.207 2.122 1.00 . A A . 56 CYS CB 1 1 21 11842 1 1 35 CYS H H 9.609 -2.698 1.149 1.00 . A A . 56 CYS H 1 1 21 11843 1 1 35 CYS HA H 8.148 -3.394 3.641 1.00 . A A . 56 CYS HA 1 1 21 11844 1 1 35 CYS HB2 H 7.184 -2.153 1.033 1.00 . A A . 56 CYS HB2 1 1 21 11845 1 1 35 CYS HB3 H 6.219 -2.414 2.488 1.00 . A A . 56 CYS HB3 1 1 21 11846 1 1 35 CYS N N 9.519 -3.057 2.086 1.00 . A A . 56 CYS N 1 1 21 11847 1 1 35 CYS O O 6.534 -5.168 2.446 1.00 . A A . 56 CYS O 1 1 21 11848 1 1 35 CYS SG S 7.800 -0.624 2.809 1.00 . A A . 56 CYS SG 1 1 21 11849 1 1 36 ARG C C 9.406 -7.566 0.340 1.00 . A A . 57 ARG C 1 1 21 11850 1 1 36 ARG CA C 8.134 -6.743 0.624 1.00 . A A . 57 ARG CA 1 1 21 11851 1 1 36 ARG CB C 7.300 -6.527 -0.660 1.00 . A A . 57 ARG CB 1 1 21 11852 1 1 36 ARG CD C 5.362 -8.044 0.149 1.00 . A A . 57 ARG CD 1 1 21 11853 1 1 36 ARG CG C 6.311 -7.659 -1.000 1.00 . A A . 57 ARG CG 1 1 21 11854 1 1 36 ARG CZ C 3.668 -6.235 0.563 1.00 . A A . 57 ARG CZ 1 1 21 11855 1 1 36 ARG H H 9.217 -4.919 0.870 1.00 . A A . 57 ARG H 1 1 21 11856 1 1 36 ARG HA H 7.567 -7.318 1.355 1.00 . A A . 57 ARG HA 1 1 21 11857 1 1 36 ARG HB2 H 6.715 -5.611 -0.561 1.00 . A A . 57 ARG HB2 1 1 21 11858 1 1 36 ARG HB3 H 7.974 -6.378 -1.504 1.00 . A A . 57 ARG HB3 1 1 21 11859 1 1 36 ARG HD2 H 4.569 -8.686 -0.240 1.00 . A A . 57 ARG HD2 1 1 21 11860 1 1 36 ARG HD3 H 5.916 -8.637 0.878 1.00 . A A . 57 ARG HD3 1 1 21 11861 1 1 36 ARG HE H 5.369 -6.432 1.550 1.00 . A A . 57 ARG HE 1 1 21 11862 1 1 36 ARG HG2 H 5.710 -7.334 -1.851 1.00 . A A . 57 ARG HG2 1 1 21 11863 1 1 36 ARG HG3 H 6.864 -8.547 -1.308 1.00 . A A . 57 ARG HG3 1 1 21 11864 1 1 36 ARG HH11 H 3.070 -7.421 -0.935 1.00 . A A . 57 ARG HH11 1 1 21 11865 1 1 36 ARG HH12 H 2.010 -6.076 -0.527 1.00 . A A . 57 ARG HH12 1 1 21 11866 1 1 36 ARG HH21 H 3.939 -4.825 1.955 1.00 . A A . 57 ARG HH21 1 1 21 11867 1 1 36 ARG HH22 H 2.464 -4.711 1.004 1.00 . A A . 57 ARG HH22 1 1 21 11868 1 1 36 ARG N N 8.406 -5.421 1.216 1.00 . A A . 57 ARG N 1 1 21 11869 1 1 36 ARG NE N 4.795 -6.862 0.832 1.00 . A A . 57 ARG NE 1 1 21 11870 1 1 36 ARG NH1 N 2.850 -6.620 -0.371 1.00 . A A . 57 ARG NH1 1 1 21 11871 1 1 36 ARG NH2 N 3.327 -5.181 1.242 1.00 . A A . 57 ARG NH2 1 1 21 11872 1 1 36 ARG O O 9.318 -8.663 -0.218 1.00 . A A . 57 ARG O 1 1 21 11873 1 1 37 SER C C 11.968 -9.020 1.447 1.00 . A A . 58 SER C 1 1 21 11874 1 1 37 SER CA C 11.900 -7.702 0.661 1.00 . A A . 58 SER CA 1 1 21 11875 1 1 37 SER CB C 12.988 -6.729 1.130 1.00 . A A . 58 SER CB 1 1 21 11876 1 1 37 SER H H 10.551 -6.161 1.200 1.00 . A A . 58 SER H 1 1 21 11877 1 1 37 SER HA H 12.115 -7.952 -0.377 1.00 . A A . 58 SER HA 1 1 21 11878 1 1 37 SER HB2 H 13.916 -7.274 1.318 1.00 . A A . 58 SER HB2 1 1 21 11879 1 1 37 SER HB3 H 13.177 -6.008 0.336 1.00 . A A . 58 SER HB3 1 1 21 11880 1 1 37 SER HG H 12.440 -6.669 3.014 1.00 . A A . 58 SER HG 1 1 21 11881 1 1 37 SER N N 10.580 -7.043 0.713 1.00 . A A . 58 SER N 1 1 21 11882 1 1 37 SER O O 12.566 -9.987 0.923 1.00 . A A . 58 SER O 1 1 21 11883 1 1 37 SER OXT O 11.446 -9.083 2.585 1.00 . A A . 58 SER OXT 1 1 21 11884 1 1 37 SER OG O 12.580 -6.023 2.294 1.00 . A A . 58 SER OG 1 1 21 11885 2 2 1 ZN ZN ZN -8.293 0.607 3.736 1.00 . B A . 1059 ZN ZN 1 1 21 11886 3 2 1 ZN ZN ZN 6.823 1.069 1.875 1.00 . C A . 1060 ZN ZN 1 1 22 11887 1 1 1 GLN C C -6.396 -1.650 -4.485 1.00 . A A . 22 GLN C 1 1 22 11888 1 1 1 GLN CA C -6.231 -1.264 -5.954 1.00 . A A . 22 GLN CA 1 1 22 11889 1 1 1 GLN CB C -4.792 -0.794 -6.253 1.00 . A A . 22 GLN CB 1 1 22 11890 1 1 1 GLN CD C -2.344 -1.479 -6.467 1.00 . A A . 22 GLN CD 1 1 22 11891 1 1 1 GLN CG C -3.757 -1.922 -6.088 1.00 . A A . 22 GLN CG 1 1 22 11892 1 1 1 GLN H1 H -7.096 0.598 -5.724 1.00 . A A . 22 GLN H1 1 1 22 11893 1 1 1 GLN H2 H -7.134 0.051 -7.278 1.00 . A A . 22 GLN H2 1 1 22 11894 1 1 1 GLN H3 H -8.163 -0.564 -6.152 1.00 . A A . 22 GLN H3 1 1 22 11895 1 1 1 GLN HA H -6.432 -2.148 -6.563 1.00 . A A . 22 GLN HA 1 1 22 11896 1 1 1 GLN HB2 H -4.745 -0.439 -7.285 1.00 . A A . 22 GLN HB2 1 1 22 11897 1 1 1 GLN HB3 H -4.536 0.037 -5.591 1.00 . A A . 22 GLN HB3 1 1 22 11898 1 1 1 GLN HE21 H -1.867 -3.278 -7.266 1.00 . A A . 22 GLN HE21 1 1 22 11899 1 1 1 GLN HE22 H -0.620 -2.041 -7.303 1.00 . A A . 22 GLN HE22 1 1 22 11900 1 1 1 GLN HG2 H -3.737 -2.270 -5.055 1.00 . A A . 22 GLN HG2 1 1 22 11901 1 1 1 GLN HG3 H -4.047 -2.759 -6.724 1.00 . A A . 22 GLN HG3 1 1 22 11902 1 1 1 GLN N N -7.223 -0.218 -6.311 1.00 . A A . 22 GLN N 1 1 22 11903 1 1 1 GLN NE2 N -1.550 -2.342 -7.062 1.00 . A A . 22 GLN NE2 1 1 22 11904 1 1 1 GLN O O -6.462 -0.767 -3.635 1.00 . A A . 22 GLN O 1 1 22 11905 1 1 1 GLN OE1 O -1.919 -0.356 -6.235 1.00 . A A . 22 GLN OE1 1 1 22 11906 1 1 2 THR C C -5.936 -2.886 -1.710 1.00 . A A . 23 THR C 1 1 22 11907 1 1 2 THR CA C -6.791 -3.485 -2.833 1.00 . A A . 23 THR CA 1 1 22 11908 1 1 2 THR CB C -6.658 -5.019 -2.834 1.00 . A A . 23 THR CB 1 1 22 11909 1 1 2 THR CG2 C -7.280 -5.679 -1.602 1.00 . A A . 23 THR CG2 1 1 22 11910 1 1 2 THR H H -6.436 -3.635 -4.920 1.00 . A A . 23 THR H 1 1 22 11911 1 1 2 THR HA H -7.827 -3.249 -2.618 1.00 . A A . 23 THR HA 1 1 22 11912 1 1 2 THR HB H -5.604 -5.292 -2.900 1.00 . A A . 23 THR HB 1 1 22 11913 1 1 2 THR HG1 H -7.158 -6.497 -3.998 1.00 . A A . 23 THR HG1 1 1 22 11914 1 1 2 THR HG21 H -8.333 -5.405 -1.522 1.00 . A A . 23 THR HG21 1 1 22 11915 1 1 2 THR HG22 H -7.200 -6.762 -1.686 1.00 . A A . 23 THR HG22 1 1 22 11916 1 1 2 THR HG23 H -6.752 -5.368 -0.700 1.00 . A A . 23 THR HG23 1 1 22 11917 1 1 2 THR N N -6.485 -2.948 -4.177 1.00 . A A . 23 THR N 1 1 22 11918 1 1 2 THR O O -4.724 -2.733 -1.859 1.00 . A A . 23 THR O 1 1 22 11919 1 1 2 THR OG1 O -7.340 -5.541 -3.957 1.00 . A A . 23 THR OG1 1 1 22 11920 1 1 3 CYS C C -4.811 -2.860 1.201 1.00 . A A . 24 CYS C 1 1 22 11921 1 1 3 CYS CA C -5.959 -2.006 0.626 1.00 . A A . 24 CYS CA 1 1 22 11922 1 1 3 CYS CB C -7.069 -1.867 1.671 1.00 . A A . 24 CYS CB 1 1 22 11923 1 1 3 CYS H H -7.579 -2.676 -0.567 1.00 . A A . 24 CYS H 1 1 22 11924 1 1 3 CYS HA H -5.578 -1.011 0.387 1.00 . A A . 24 CYS HA 1 1 22 11925 1 1 3 CYS HB2 H -7.958 -1.447 1.207 1.00 . A A . 24 CYS HB2 1 1 22 11926 1 1 3 CYS HB3 H -7.323 -2.856 2.052 1.00 . A A . 24 CYS HB3 1 1 22 11927 1 1 3 CYS N N -6.576 -2.565 -0.579 1.00 . A A . 24 CYS N 1 1 22 11928 1 1 3 CYS O O -4.825 -4.091 1.106 1.00 . A A . 24 CYS O 1 1 22 11929 1 1 3 CYS SG S -6.522 -0.789 3.019 1.00 . A A . 24 CYS SG 1 1 22 11930 1 1 4 TYR C C -3.525 -3.573 4.011 1.00 . A A . 25 TYR C 1 1 22 11931 1 1 4 TYR CA C -2.901 -2.888 2.772 1.00 . A A . 25 TYR CA 1 1 22 11932 1 1 4 TYR CB C -1.801 -1.900 3.199 1.00 . A A . 25 TYR CB 1 1 22 11933 1 1 4 TYR CD1 C -3.155 -0.201 4.539 1.00 . A A . 25 TYR CD1 1 1 22 11934 1 1 4 TYR CD2 C -1.258 -1.303 5.600 1.00 . A A . 25 TYR CD2 1 1 22 11935 1 1 4 TYR CE1 C -3.443 0.468 5.746 1.00 . A A . 25 TYR CE1 1 1 22 11936 1 1 4 TYR CE2 C -1.530 -0.621 6.801 1.00 . A A . 25 TYR CE2 1 1 22 11937 1 1 4 TYR CG C -2.073 -1.102 4.467 1.00 . A A . 25 TYR CG 1 1 22 11938 1 1 4 TYR CZ C -2.632 0.256 6.882 1.00 . A A . 25 TYR CZ 1 1 22 11939 1 1 4 TYR H H -3.939 -1.204 1.953 1.00 . A A . 25 TYR H 1 1 22 11940 1 1 4 TYR HA H -2.430 -3.677 2.188 1.00 . A A . 25 TYR HA 1 1 22 11941 1 1 4 TYR HB2 H -0.902 -2.491 3.364 1.00 . A A . 25 TYR HB2 1 1 22 11942 1 1 4 TYR HB3 H -1.579 -1.214 2.381 1.00 . A A . 25 TYR HB3 1 1 22 11943 1 1 4 TYR HD1 H -3.788 -0.039 3.678 1.00 . A A . 25 TYR HD1 1 1 22 11944 1 1 4 TYR HD2 H -0.429 -1.997 5.554 1.00 . A A . 25 TYR HD2 1 1 22 11945 1 1 4 TYR HE1 H -4.299 1.123 5.804 1.00 . A A . 25 TYR HE1 1 1 22 11946 1 1 4 TYR HE2 H -0.913 -0.782 7.673 1.00 . A A . 25 TYR HE2 1 1 22 11947 1 1 4 TYR HH H -3.735 1.387 8.034 1.00 . A A . 25 TYR HH 1 1 22 11948 1 1 4 TYR N N -3.875 -2.214 1.902 1.00 . A A . 25 TYR N 1 1 22 11949 1 1 4 TYR O O -2.868 -4.398 4.650 1.00 . A A . 25 TYR O 1 1 22 11950 1 1 4 TYR OH O -2.917 0.865 8.067 1.00 . A A . 25 TYR OH 1 1 22 11951 1 1 5 ASN C C -6.904 -4.074 5.421 1.00 . A A . 26 ASN C 1 1 22 11952 1 1 5 ASN CA C -5.439 -3.629 5.606 1.00 . A A . 26 ASN CA 1 1 22 11953 1 1 5 ASN CB C -5.352 -2.410 6.545 1.00 . A A . 26 ASN CB 1 1 22 11954 1 1 5 ASN CG C -6.137 -2.595 7.834 1.00 . A A . 26 ASN CG 1 1 22 11955 1 1 5 ASN H H -5.239 -2.548 3.776 1.00 . A A . 26 ASN H 1 1 22 11956 1 1 5 ASN HA H -4.909 -4.463 6.070 1.00 . A A . 26 ASN HA 1 1 22 11957 1 1 5 ASN HB2 H -4.307 -2.233 6.803 1.00 . A A . 26 ASN HB2 1 1 22 11958 1 1 5 ASN HB3 H -5.723 -1.521 6.035 1.00 . A A . 26 ASN HB3 1 1 22 11959 1 1 5 ASN HD21 H -7.766 -1.625 7.104 1.00 . A A . 26 ASN HD21 1 1 22 11960 1 1 5 ASN HD22 H -7.873 -2.217 8.754 1.00 . A A . 26 ASN HD22 1 1 22 11961 1 1 5 ASN N N -4.780 -3.246 4.350 1.00 . A A . 26 ASN N 1 1 22 11962 1 1 5 ASN ND2 N -7.352 -2.094 7.901 1.00 . A A . 26 ASN ND2 1 1 22 11963 1 1 5 ASN O O -7.304 -5.117 5.942 1.00 . A A . 26 ASN O 1 1 22 11964 1 1 5 ASN OD1 O -5.672 -3.199 8.790 1.00 . A A . 26 ASN OD1 1 1 22 11965 1 1 6 CYS C C -9.719 -4.501 3.742 1.00 . A A . 27 CYS C 1 1 22 11966 1 1 6 CYS CA C -9.164 -3.386 4.664 1.00 . A A . 27 CYS CA 1 1 22 11967 1 1 6 CYS CB C -9.715 -2.011 4.256 1.00 . A A . 27 CYS CB 1 1 22 11968 1 1 6 CYS H H -7.305 -2.442 4.301 1.00 . A A . 27 CYS H 1 1 22 11969 1 1 6 CYS HA H -9.510 -3.600 5.676 1.00 . A A . 27 CYS HA 1 1 22 11970 1 1 6 CYS HB2 H -9.439 -1.809 3.220 1.00 . A A . 27 CYS HB2 1 1 22 11971 1 1 6 CYS HB3 H -10.806 -2.038 4.319 1.00 . A A . 27 CYS HB3 1 1 22 11972 1 1 6 CYS N N -7.701 -3.289 4.692 1.00 . A A . 27 CYS N 1 1 22 11973 1 1 6 CYS O O -10.920 -4.778 3.769 1.00 . A A . 27 CYS O 1 1 22 11974 1 1 6 CYS SG S -9.081 -0.701 5.348 1.00 . A A . 27 CYS SG 1 1 22 11975 1 1 7 GLY C C -10.287 -5.783 0.909 1.00 . A A . 28 GLY C 1 1 22 11976 1 1 7 GLY CA C -9.262 -6.198 1.979 1.00 . A A . 28 GLY CA 1 1 22 11977 1 1 7 GLY H H -7.894 -4.886 2.977 1.00 . A A . 28 GLY H 1 1 22 11978 1 1 7 GLY HA2 H -9.675 -7.032 2.546 1.00 . A A . 28 GLY HA2 1 1 22 11979 1 1 7 GLY HA3 H -8.367 -6.548 1.463 1.00 . A A . 28 GLY HA3 1 1 22 11980 1 1 7 GLY N N -8.872 -5.129 2.914 1.00 . A A . 28 GLY N 1 1 22 11981 1 1 7 GLY O O -11.072 -6.618 0.453 1.00 . A A . 28 GLY O 1 1 22 11982 1 1 8 LYS C C -10.636 -3.342 -1.659 1.00 . A A . 29 LYS C 1 1 22 11983 1 1 8 LYS CA C -11.295 -3.873 -0.372 1.00 . A A . 29 LYS CA 1 1 22 11984 1 1 8 LYS CB C -12.020 -2.748 0.401 1.00 . A A . 29 LYS CB 1 1 22 11985 1 1 8 LYS CD C -14.467 -3.312 -0.006 1.00 . A A . 29 LYS CD 1 1 22 11986 1 1 8 LYS CE C -15.786 -3.709 0.666 1.00 . A A . 29 LYS CE 1 1 22 11987 1 1 8 LYS CG C -13.343 -3.198 1.037 1.00 . A A . 29 LYS CG 1 1 22 11988 1 1 8 LYS H H -9.612 -3.894 0.948 1.00 . A A . 29 LYS H 1 1 22 11989 1 1 8 LYS HA H -12.041 -4.616 -0.644 1.00 . A A . 29 LYS HA 1 1 22 11990 1 1 8 LYS HB2 H -11.368 -2.373 1.191 1.00 . A A . 29 LYS HB2 1 1 22 11991 1 1 8 LYS HB3 H -12.235 -1.912 -0.268 1.00 . A A . 29 LYS HB3 1 1 22 11992 1 1 8 LYS HD2 H -14.593 -2.345 -0.500 1.00 . A A . 29 LYS HD2 1 1 22 11993 1 1 8 LYS HD3 H -14.207 -4.059 -0.758 1.00 . A A . 29 LYS HD3 1 1 22 11994 1 1 8 LYS HE2 H -15.657 -4.684 1.145 1.00 . A A . 29 LYS HE2 1 1 22 11995 1 1 8 LYS HE3 H -16.018 -2.979 1.446 1.00 . A A . 29 LYS HE3 1 1 22 11996 1 1 8 LYS HG2 H -13.201 -4.156 1.541 1.00 . A A . 29 LYS HG2 1 1 22 11997 1 1 8 LYS HG3 H -13.636 -2.458 1.783 1.00 . A A . 29 LYS HG3 1 1 22 11998 1 1 8 LYS HZ1 H -16.715 -4.443 -1.046 1.00 . A A . 29 LYS HZ1 1 1 22 11999 1 1 8 LYS HZ2 H -17.767 -4.034 0.131 1.00 . A A . 29 LYS HZ2 1 1 22 12000 1 1 8 LYS HZ3 H -17.051 -2.870 -0.756 1.00 . A A . 29 LYS HZ3 1 1 22 12001 1 1 8 LYS N N -10.298 -4.499 0.520 1.00 . A A . 29 LYS N 1 1 22 12002 1 1 8 LYS NZ N -16.901 -3.767 -0.317 1.00 . A A . 29 LYS NZ 1 1 22 12003 1 1 8 LYS O O -9.849 -2.396 -1.556 1.00 . A A . 29 LYS O 1 1 22 12004 1 1 9 PRO C C -10.462 -1.990 -4.478 1.00 . A A . 30 PRO C 1 1 22 12005 1 1 9 PRO CA C -10.374 -3.488 -4.150 1.00 . A A . 30 PRO CA 1 1 22 12006 1 1 9 PRO CB C -11.121 -4.313 -5.202 1.00 . A A . 30 PRO CB 1 1 22 12007 1 1 9 PRO CD C -11.753 -5.100 -3.044 1.00 . A A . 30 PRO CD 1 1 22 12008 1 1 9 PRO CG C -11.467 -5.596 -4.458 1.00 . A A . 30 PRO CG 1 1 22 12009 1 1 9 PRO HA H -9.326 -3.780 -4.178 1.00 . A A . 30 PRO HA 1 1 22 12010 1 1 9 PRO HB2 H -12.045 -3.809 -5.496 1.00 . A A . 30 PRO HB2 1 1 22 12011 1 1 9 PRO HB3 H -10.501 -4.510 -6.077 1.00 . A A . 30 PRO HB3 1 1 22 12012 1 1 9 PRO HD2 H -12.808 -4.834 -2.957 1.00 . A A . 30 PRO HD2 1 1 22 12013 1 1 9 PRO HD3 H -11.501 -5.883 -2.328 1.00 . A A . 30 PRO HD3 1 1 22 12014 1 1 9 PRO HG2 H -12.331 -6.100 -4.893 1.00 . A A . 30 PRO HG2 1 1 22 12015 1 1 9 PRO HG3 H -10.600 -6.258 -4.445 1.00 . A A . 30 PRO HG3 1 1 22 12016 1 1 9 PRO N N -10.933 -3.906 -2.852 1.00 . A A . 30 PRO N 1 1 22 12017 1 1 9 PRO O O -9.557 -1.450 -5.119 1.00 . A A . 30 PRO O 1 1 22 12018 1 1 10 GLY C C -10.912 1.115 -3.472 1.00 . A A . 31 GLY C 1 1 22 12019 1 1 10 GLY CA C -11.777 0.129 -4.272 1.00 . A A . 31 GLY CA 1 1 22 12020 1 1 10 GLY H H -12.217 -1.813 -3.509 1.00 . A A . 31 GLY H 1 1 22 12021 1 1 10 GLY HA2 H -12.823 0.338 -4.052 1.00 . A A . 31 GLY HA2 1 1 22 12022 1 1 10 GLY HA3 H -11.613 0.329 -5.331 1.00 . A A . 31 GLY HA3 1 1 22 12023 1 1 10 GLY N N -11.510 -1.299 -4.017 1.00 . A A . 31 GLY N 1 1 22 12024 1 1 10 GLY O O -11.353 2.232 -3.186 1.00 . A A . 31 GLY O 1 1 22 12025 1 1 11 HIS C C -7.784 2.312 -3.252 1.00 . A A . 32 HIS C 1 1 22 12026 1 1 11 HIS CA C -8.755 1.546 -2.339 1.00 . A A . 32 HIS CA 1 1 22 12027 1 1 11 HIS CB C -8.024 0.706 -1.283 1.00 . A A . 32 HIS CB 1 1 22 12028 1 1 11 HIS CD2 C -8.365 1.351 1.170 1.00 . A A . 32 HIS CD2 1 1 22 12029 1 1 11 HIS CE1 C -10.238 0.295 1.601 1.00 . A A . 32 HIS CE1 1 1 22 12030 1 1 11 HIS CG C -8.749 0.699 0.033 1.00 . A A . 32 HIS CG 1 1 22 12031 1 1 11 HIS H H -9.403 -0.216 -3.343 1.00 . A A . 32 HIS H 1 1 22 12032 1 1 11 HIS HA H -9.318 2.309 -1.806 1.00 . A A . 32 HIS HA 1 1 22 12033 1 1 11 HIS HB2 H -7.920 -0.322 -1.627 1.00 . A A . 32 HIS HB2 1 1 22 12034 1 1 11 HIS HB3 H -7.021 1.103 -1.119 1.00 . A A . 32 HIS HB3 1 1 22 12035 1 1 11 HIS HD1 H -10.419 -0.568 -0.320 1.00 . A A . 32 HIS HD1 1 1 22 12036 1 1 11 HIS HD2 H -7.487 1.971 1.261 1.00 . A A . 32 HIS HD2 1 1 22 12037 1 1 11 HIS HE1 H -11.112 -0.095 2.111 1.00 . A A . 32 HIS HE1 1 1 22 12038 1 1 11 HIS N N -9.707 0.708 -3.067 1.00 . A A . 32 HIS N 1 1 22 12039 1 1 11 HIS ND1 N -9.920 0.044 0.318 1.00 . A A . 32 HIS ND1 1 1 22 12040 1 1 11 HIS NE2 N -9.300 1.071 2.176 1.00 . A A . 32 HIS NE2 1 1 22 12041 1 1 11 HIS O O -7.530 1.951 -4.404 1.00 . A A . 32 HIS O 1 1 22 12042 1 1 12 LEU C C -5.572 5.066 -2.129 1.00 . A A . 33 LEU C 1 1 22 12043 1 1 12 LEU CA C -6.377 4.413 -3.271 1.00 . A A . 33 LEU CA 1 1 22 12044 1 1 12 LEU CB C -7.232 5.506 -3.962 1.00 . A A . 33 LEU CB 1 1 22 12045 1 1 12 LEU CD1 C -8.850 6.270 -5.717 1.00 . A A . 33 LEU CD1 1 1 22 12046 1 1 12 LEU CD2 C -7.052 4.702 -6.373 1.00 . A A . 33 LEU CD2 1 1 22 12047 1 1 12 LEU CG C -7.996 5.095 -5.236 1.00 . A A . 33 LEU CG 1 1 22 12048 1 1 12 LEU H H -7.488 3.558 -1.716 1.00 . A A . 33 LEU H 1 1 22 12049 1 1 12 LEU HA H -5.681 3.960 -3.978 1.00 . A A . 33 LEU HA 1 1 22 12050 1 1 12 LEU HB2 H -7.956 5.877 -3.236 1.00 . A A . 33 LEU HB2 1 1 22 12051 1 1 12 LEU HB3 H -6.586 6.344 -4.229 1.00 . A A . 33 LEU HB3 1 1 22 12052 1 1 12 LEU HD11 H -9.556 6.553 -4.934 1.00 . A A . 33 LEU HD11 1 1 22 12053 1 1 12 LEU HD12 H -8.217 7.124 -5.956 1.00 . A A . 33 LEU HD12 1 1 22 12054 1 1 12 LEU HD13 H -9.414 5.978 -6.603 1.00 . A A . 33 LEU HD13 1 1 22 12055 1 1 12 LEU HD21 H -6.370 5.522 -6.597 1.00 . A A . 33 LEU HD21 1 1 22 12056 1 1 12 LEU HD22 H -6.475 3.821 -6.095 1.00 . A A . 33 LEU HD22 1 1 22 12057 1 1 12 LEU HD23 H -7.631 4.463 -7.265 1.00 . A A . 33 LEU HD23 1 1 22 12058 1 1 12 LEU HG H -8.666 4.265 -5.017 1.00 . A A . 33 LEU HG 1 1 22 12059 1 1 12 LEU N N -7.263 3.404 -2.689 1.00 . A A . 33 LEU N 1 1 22 12060 1 1 12 LEU O O -5.914 4.900 -0.954 1.00 . A A . 33 LEU O 1 1 22 12061 1 1 13 SER C C -4.759 7.745 -0.727 1.00 . A A . 34 SER C 1 1 22 12062 1 1 13 SER CA C -3.861 6.788 -1.538 1.00 . A A . 34 SER CA 1 1 22 12063 1 1 13 SER CB C -2.855 7.630 -2.330 1.00 . A A . 34 SER CB 1 1 22 12064 1 1 13 SER H H -4.320 5.952 -3.444 1.00 . A A . 34 SER H 1 1 22 12065 1 1 13 SER HA H -3.310 6.172 -0.827 1.00 . A A . 34 SER HA 1 1 22 12066 1 1 13 SER HB2 H -3.394 8.277 -3.023 1.00 . A A . 34 SER HB2 1 1 22 12067 1 1 13 SER HB3 H -2.280 8.256 -1.646 1.00 . A A . 34 SER HB3 1 1 22 12068 1 1 13 SER HG H -1.456 7.343 -3.674 1.00 . A A . 34 SER HG 1 1 22 12069 1 1 13 SER N N -4.586 5.900 -2.470 1.00 . A A . 34 SER N 1 1 22 12070 1 1 13 SER O O -4.330 8.284 0.294 1.00 . A A . 34 SER O 1 1 22 12071 1 1 13 SER OG O -1.973 6.789 -3.059 1.00 . A A . 34 SER OG 1 1 22 12072 1 1 14 SER C C -8.051 7.928 0.307 1.00 . A A . 35 SER C 1 1 22 12073 1 1 14 SER CA C -7.044 8.761 -0.510 1.00 . A A . 35 SER CA 1 1 22 12074 1 1 14 SER CB C -7.792 9.566 -1.580 1.00 . A A . 35 SER CB 1 1 22 12075 1 1 14 SER H H -6.261 7.546 -2.057 1.00 . A A . 35 SER H 1 1 22 12076 1 1 14 SER HA H -6.578 9.469 0.176 1.00 . A A . 35 SER HA 1 1 22 12077 1 1 14 SER HB2 H -8.605 10.130 -1.117 1.00 . A A . 35 SER HB2 1 1 22 12078 1 1 14 SER HB3 H -7.099 10.274 -2.040 1.00 . A A . 35 SER HB3 1 1 22 12079 1 1 14 SER HG H -8.787 9.243 -3.237 1.00 . A A . 35 SER HG 1 1 22 12080 1 1 14 SER N N -6.002 7.960 -1.173 1.00 . A A . 35 SER N 1 1 22 12081 1 1 14 SER O O -8.903 8.499 0.992 1.00 . A A . 35 SER O 1 1 22 12082 1 1 14 SER OG O -8.310 8.699 -2.580 1.00 . A A . 35 SER OG 1 1 22 12083 1 1 15 GLN C C -8.183 5.048 2.209 1.00 . A A . 36 GLN C 1 1 22 12084 1 1 15 GLN CA C -8.856 5.658 0.959 1.00 . A A . 36 GLN CA 1 1 22 12085 1 1 15 GLN CB C -9.290 4.567 -0.040 1.00 . A A . 36 GLN CB 1 1 22 12086 1 1 15 GLN CD C -11.831 4.633 -0.140 1.00 . A A . 36 GLN CD 1 1 22 12087 1 1 15 GLN CG C -10.604 3.864 0.343 1.00 . A A . 36 GLN CG 1 1 22 12088 1 1 15 GLN H H -7.206 6.196 -0.288 1.00 . A A . 36 GLN H 1 1 22 12089 1 1 15 GLN HA H -9.748 6.194 1.286 1.00 . A A . 36 GLN HA 1 1 22 12090 1 1 15 GLN HB2 H -9.413 5.005 -1.032 1.00 . A A . 36 GLN HB2 1 1 22 12091 1 1 15 GLN HB3 H -8.495 3.826 -0.105 1.00 . A A . 36 GLN HB3 1 1 22 12092 1 1 15 GLN HE21 H -11.928 3.615 -1.903 1.00 . A A . 36 GLN HE21 1 1 22 12093 1 1 15 GLN HE22 H -13.148 4.854 -1.635 1.00 . A A . 36 GLN HE22 1 1 22 12094 1 1 15 GLN HG2 H -10.626 2.876 -0.116 1.00 . A A . 36 GLN HG2 1 1 22 12095 1 1 15 GLN HG3 H -10.658 3.721 1.422 1.00 . A A . 36 GLN HG3 1 1 22 12096 1 1 15 GLN N N -7.954 6.592 0.266 1.00 . A A . 36 GLN N 1 1 22 12097 1 1 15 GLN NE2 N -12.337 4.342 -1.322 1.00 . A A . 36 GLN NE2 1 1 22 12098 1 1 15 GLN O O -8.815 4.984 3.265 1.00 . A A . 36 GLN O 1 1 22 12099 1 1 15 GLN OE1 O -12.355 5.511 0.534 1.00 . A A . 36 GLN OE1 1 1 22 12100 1 1 16 CYS C C -4.556 4.928 2.913 1.00 . A A . 37 CYS C 1 1 22 12101 1 1 16 CYS CA C -5.972 4.398 3.209 1.00 . A A . 37 CYS CA 1 1 22 12102 1 1 16 CYS CB C -5.915 2.878 3.494 1.00 . A A . 37 CYS CB 1 1 22 12103 1 1 16 CYS H H -6.458 4.807 1.192 1.00 . A A . 37 CYS H 1 1 22 12104 1 1 16 CYS HA H -6.319 4.913 4.102 1.00 . A A . 37 CYS HA 1 1 22 12105 1 1 16 CYS HB2 H -5.964 2.317 2.560 1.00 . A A . 37 CYS HB2 1 1 22 12106 1 1 16 CYS HB3 H -4.958 2.616 3.945 1.00 . A A . 37 CYS HB3 1 1 22 12107 1 1 16 CYS N N -6.891 4.699 2.102 1.00 . A A . 37 CYS N 1 1 22 12108 1 1 16 CYS O O -4.241 5.359 1.799 1.00 . A A . 37 CYS O 1 1 22 12109 1 1 16 CYS SG S -7.214 2.372 4.648 1.00 . A A . 37 CYS SG 1 1 22 12110 1 1 17 ARG C C -1.508 4.555 2.701 1.00 . A A . 38 ARG C 1 1 22 12111 1 1 17 ARG CA C -2.256 5.162 3.898 1.00 . A A . 38 ARG CA 1 1 22 12112 1 1 17 ARG CB C -1.610 4.726 5.225 1.00 . A A . 38 ARG CB 1 1 22 12113 1 1 17 ARG CD C -3.036 4.494 7.383 1.00 . A A . 38 ARG CD 1 1 22 12114 1 1 17 ARG CG C -2.182 5.411 6.485 1.00 . A A . 38 ARG CG 1 1 22 12115 1 1 17 ARG CZ C -5.461 5.086 7.107 1.00 . A A . 38 ARG CZ 1 1 22 12116 1 1 17 ARG H H -4.061 4.499 4.803 1.00 . A A . 38 ARG H 1 1 22 12117 1 1 17 ARG HA H -2.150 6.245 3.801 1.00 . A A . 38 ARG HA 1 1 22 12118 1 1 17 ARG HB2 H -1.689 3.642 5.328 1.00 . A A . 38 ARG HB2 1 1 22 12119 1 1 17 ARG HB3 H -0.548 4.970 5.171 1.00 . A A . 38 ARG HB3 1 1 22 12120 1 1 17 ARG HD2 H -2.531 3.531 7.479 1.00 . A A . 38 ARG HD2 1 1 22 12121 1 1 17 ARG HD3 H -3.067 4.927 8.385 1.00 . A A . 38 ARG HD3 1 1 22 12122 1 1 17 ARG HE H -4.650 3.374 6.539 1.00 . A A . 38 ARG HE 1 1 22 12123 1 1 17 ARG HG2 H -1.333 5.739 7.085 1.00 . A A . 38 ARG HG2 1 1 22 12124 1 1 17 ARG HG3 H -2.744 6.304 6.213 1.00 . A A . 38 ARG HG3 1 1 22 12125 1 1 17 ARG HH11 H -4.446 6.530 8.042 1.00 . A A . 38 ARG HH11 1 1 22 12126 1 1 17 ARG HH12 H -6.152 6.820 7.850 1.00 . A A . 38 ARG HH12 1 1 22 12127 1 1 17 ARG HH21 H -6.791 3.894 6.156 1.00 . A A . 38 ARG HH21 1 1 22 12128 1 1 17 ARG HH22 H -7.432 5.352 6.854 1.00 . A A . 38 ARG HH22 1 1 22 12129 1 1 17 ARG N N -3.688 4.831 3.927 1.00 . A A . 38 ARG N 1 1 22 12130 1 1 17 ARG NE N -4.424 4.286 6.903 1.00 . A A . 38 ARG NE 1 1 22 12131 1 1 17 ARG NH1 N -5.347 6.235 7.705 1.00 . A A . 38 ARG NH1 1 1 22 12132 1 1 17 ARG NH2 N -6.647 4.744 6.694 1.00 . A A . 38 ARG NH2 1 1 22 12133 1 1 17 ARG O O -0.656 5.233 2.127 1.00 . A A . 38 ARG O 1 1 22 12134 1 1 18 ALA C C -2.307 1.539 0.593 1.00 . A A . 39 ALA C 1 1 22 12135 1 1 18 ALA CA C -1.395 2.707 1.046 1.00 . A A . 39 ALA CA 1 1 22 12136 1 1 18 ALA CB C 0.032 2.178 1.257 1.00 . A A . 39 ALA CB 1 1 22 12137 1 1 18 ALA H H -2.543 2.832 2.830 1.00 . A A . 39 ALA H 1 1 22 12138 1 1 18 ALA HA H -1.390 3.466 0.263 1.00 . A A . 39 ALA HA 1 1 22 12139 1 1 18 ALA HB1 H 0.701 2.991 1.541 1.00 . A A . 39 ALA HB1 1 1 22 12140 1 1 18 ALA HB2 H 0.022 1.419 2.037 1.00 . A A . 39 ALA HB2 1 1 22 12141 1 1 18 ALA HB3 H 0.404 1.724 0.339 1.00 . A A . 39 ALA HB3 1 1 22 12142 1 1 18 ALA N N -1.850 3.330 2.293 1.00 . A A . 39 ALA N 1 1 22 12143 1 1 18 ALA O O -2.997 0.936 1.423 1.00 . A A . 39 ALA O 1 1 22 12144 1 1 19 PRO C C -1.703 -1.270 -0.724 1.00 . A A . 40 PRO C 1 1 22 12145 1 1 19 PRO CA C -2.701 -0.171 -1.152 1.00 . A A . 40 PRO CA 1 1 22 12146 1 1 19 PRO CB C -2.798 -0.041 -2.676 1.00 . A A . 40 PRO CB 1 1 22 12147 1 1 19 PRO CD C -1.701 1.908 -1.812 1.00 . A A . 40 PRO CD 1 1 22 12148 1 1 19 PRO CG C -1.696 0.962 -3.013 1.00 . A A . 40 PRO CG 1 1 22 12149 1 1 19 PRO HA H -3.685 -0.410 -0.749 1.00 . A A . 40 PRO HA 1 1 22 12150 1 1 19 PRO HB2 H -2.652 -0.990 -3.193 1.00 . A A . 40 PRO HB2 1 1 22 12151 1 1 19 PRO HB3 H -3.768 0.385 -2.941 1.00 . A A . 40 PRO HB3 1 1 22 12152 1 1 19 PRO HD2 H -0.684 2.243 -1.605 1.00 . A A . 40 PRO HD2 1 1 22 12153 1 1 19 PRO HD3 H -2.340 2.766 -2.026 1.00 . A A . 40 PRO HD3 1 1 22 12154 1 1 19 PRO HG2 H -0.736 0.447 -3.069 1.00 . A A . 40 PRO HG2 1 1 22 12155 1 1 19 PRO HG3 H -1.901 1.491 -3.944 1.00 . A A . 40 PRO HG3 1 1 22 12156 1 1 19 PRO N N -2.266 1.152 -0.698 1.00 . A A . 40 PRO N 1 1 22 12157 1 1 19 PRO O O -0.616 -0.982 -0.219 1.00 . A A . 40 PRO O 1 1 22 12158 1 1 20 LYS C C 0.172 -3.806 -1.147 1.00 . A A . 41 LYS C 1 1 22 12159 1 1 20 LYS CA C -1.281 -3.761 -0.636 1.00 . A A . 41 LYS CA 1 1 22 12160 1 1 20 LYS CB C -2.102 -4.982 -1.098 1.00 . A A . 41 LYS CB 1 1 22 12161 1 1 20 LYS CD C -2.635 -7.439 -0.778 1.00 . A A . 41 LYS CD 1 1 22 12162 1 1 20 LYS CE C -2.164 -8.739 -0.112 1.00 . A A . 41 LYS CE 1 1 22 12163 1 1 20 LYS CG C -1.667 -6.299 -0.434 1.00 . A A . 41 LYS CG 1 1 22 12164 1 1 20 LYS H H -2.962 -2.679 -1.399 1.00 . A A . 41 LYS H 1 1 22 12165 1 1 20 LYS HA H -1.202 -3.798 0.450 1.00 . A A . 41 LYS HA 1 1 22 12166 1 1 20 LYS HB2 H -3.149 -4.814 -0.844 1.00 . A A . 41 LYS HB2 1 1 22 12167 1 1 20 LYS HB3 H -2.031 -5.080 -2.183 1.00 . A A . 41 LYS HB3 1 1 22 12168 1 1 20 LYS HD2 H -3.634 -7.186 -0.421 1.00 . A A . 41 LYS HD2 1 1 22 12169 1 1 20 LYS HD3 H -2.664 -7.573 -1.861 1.00 . A A . 41 LYS HD3 1 1 22 12170 1 1 20 LYS HE2 H -1.153 -8.967 -0.461 1.00 . A A . 41 LYS HE2 1 1 22 12171 1 1 20 LYS HE3 H -2.116 -8.581 0.969 1.00 . A A . 41 LYS HE3 1 1 22 12172 1 1 20 LYS HG2 H -0.670 -6.571 -0.777 1.00 . A A . 41 LYS HG2 1 1 22 12173 1 1 20 LYS HG3 H -1.646 -6.165 0.650 1.00 . A A . 41 LYS HG3 1 1 22 12174 1 1 20 LYS HZ1 H -3.120 -10.052 -1.413 1.00 . A A . 41 LYS HZ1 1 1 22 12175 1 1 20 LYS HZ2 H -2.750 -10.726 0.025 1.00 . A A . 41 LYS HZ2 1 1 22 12176 1 1 20 LYS HZ3 H -4.010 -9.697 -0.086 1.00 . A A . 41 LYS HZ3 1 1 22 12177 1 1 20 LYS N N -2.046 -2.539 -0.982 1.00 . A A . 41 LYS N 1 1 22 12178 1 1 20 LYS NZ N -3.073 -9.875 -0.418 1.00 . A A . 41 LYS NZ 1 1 22 12179 1 1 20 LYS O O 0.973 -4.602 -0.657 1.00 . A A . 41 LYS O 1 1 22 12180 1 1 21 VAL C C 2.838 -2.262 -1.295 1.00 . A A . 42 VAL C 1 1 22 12181 1 1 21 VAL CA C 1.927 -2.628 -2.481 1.00 . A A . 42 VAL CA 1 1 22 12182 1 1 21 VAL CB C 1.927 -1.484 -3.521 1.00 . A A . 42 VAL CB 1 1 22 12183 1 1 21 VAL CG1 C 3.327 -1.145 -4.038 1.00 . A A . 42 VAL CG1 1 1 22 12184 1 1 21 VAL CG2 C 1.067 -1.832 -4.744 1.00 . A A . 42 VAL CG2 1 1 22 12185 1 1 21 VAL H H -0.187 -2.317 -2.424 1.00 . A A . 42 VAL H 1 1 22 12186 1 1 21 VAL HA H 2.344 -3.519 -2.953 1.00 . A A . 42 VAL HA 1 1 22 12187 1 1 21 VAL HB H 1.513 -0.587 -3.056 1.00 . A A . 42 VAL HB 1 1 22 12188 1 1 21 VAL HG11 H 3.795 -2.038 -4.454 1.00 . A A . 42 VAL HG11 1 1 22 12189 1 1 21 VAL HG12 H 3.267 -0.378 -4.811 1.00 . A A . 42 VAL HG12 1 1 22 12190 1 1 21 VAL HG13 H 3.945 -0.755 -3.230 1.00 . A A . 42 VAL HG13 1 1 22 12191 1 1 21 VAL HG21 H 1.437 -2.745 -5.213 1.00 . A A . 42 VAL HG21 1 1 22 12192 1 1 21 VAL HG22 H 0.026 -1.973 -4.455 1.00 . A A . 42 VAL HG22 1 1 22 12193 1 1 21 VAL HG23 H 1.104 -1.016 -5.467 1.00 . A A . 42 VAL HG23 1 1 22 12194 1 1 21 VAL N N 0.541 -2.915 -2.066 1.00 . A A . 42 VAL N 1 1 22 12195 1 1 21 VAL O O 4.015 -2.617 -1.301 1.00 . A A . 42 VAL O 1 1 22 12196 1 1 22 CYS C C 2.220 -0.918 2.122 1.00 . A A . 43 CYS C 1 1 22 12197 1 1 22 CYS CA C 3.063 -0.968 0.821 1.00 . A A . 43 CYS CA 1 1 22 12198 1 1 22 CYS CB C 3.515 0.416 0.312 1.00 . A A . 43 CYS CB 1 1 22 12199 1 1 22 CYS H H 1.311 -1.376 -0.307 1.00 . A A . 43 CYS H 1 1 22 12200 1 1 22 CYS HA H 3.953 -1.565 1.027 1.00 . A A . 43 CYS HA 1 1 22 12201 1 1 22 CYS HB2 H 3.941 0.296 -0.686 1.00 . A A . 43 CYS HB2 1 1 22 12202 1 1 22 CYS HB3 H 2.653 1.078 0.235 1.00 . A A . 43 CYS HB3 1 1 22 12203 1 1 22 CYS N N 2.306 -1.575 -0.276 1.00 . A A . 43 CYS N 1 1 22 12204 1 1 22 CYS O O 1.348 -1.758 2.351 1.00 . A A . 43 CYS O 1 1 22 12205 1 1 22 CYS SG S 4.778 1.151 1.385 1.00 . A A . 43 CYS SG 1 1 22 12206 1 1 23 PHE C C 1.631 1.975 4.341 1.00 . A A . 44 PHE C 1 1 22 12207 1 1 23 PHE CA C 1.723 0.443 4.163 1.00 . A A . 44 PHE CA 1 1 22 12208 1 1 23 PHE CB C 2.319 -0.214 5.419 1.00 . A A . 44 PHE CB 1 1 22 12209 1 1 23 PHE CD1 C 4.824 0.225 5.360 1.00 . A A . 44 PHE CD1 1 1 22 12210 1 1 23 PHE CD2 C 3.467 1.378 7.023 1.00 . A A . 44 PHE CD2 1 1 22 12211 1 1 23 PHE CE1 C 5.966 0.896 5.832 1.00 . A A . 44 PHE CE1 1 1 22 12212 1 1 23 PHE CE2 C 4.611 2.048 7.494 1.00 . A A . 44 PHE CE2 1 1 22 12213 1 1 23 PHE CG C 3.569 0.466 5.953 1.00 . A A . 44 PHE CG 1 1 22 12214 1 1 23 PHE CZ C 5.860 1.809 6.897 1.00 . A A . 44 PHE CZ 1 1 22 12215 1 1 23 PHE H H 3.298 0.624 2.726 1.00 . A A . 44 PHE H 1 1 22 12216 1 1 23 PHE HA H 0.705 0.073 4.040 1.00 . A A . 44 PHE HA 1 1 22 12217 1 1 23 PHE HB2 H 1.557 -0.195 6.202 1.00 . A A . 44 PHE HB2 1 1 22 12218 1 1 23 PHE HB3 H 2.536 -1.263 5.215 1.00 . A A . 44 PHE HB3 1 1 22 12219 1 1 23 PHE HD1 H 4.913 -0.473 4.540 1.00 . A A . 44 PHE HD1 1 1 22 12220 1 1 23 PHE HD2 H 2.508 1.575 7.479 1.00 . A A . 44 PHE HD2 1 1 22 12221 1 1 23 PHE HE1 H 6.929 0.710 5.376 1.00 . A A . 44 PHE HE1 1 1 22 12222 1 1 23 PHE HE2 H 4.528 2.751 8.313 1.00 . A A . 44 PHE HE2 1 1 22 12223 1 1 23 PHE HZ H 6.741 2.326 7.257 1.00 . A A . 44 PHE HZ 1 1 22 12224 1 1 23 PHE N N 2.503 0.054 2.984 1.00 . A A . 44 PHE N 1 1 22 12225 1 1 23 PHE O O 0.693 2.447 4.986 1.00 . A A . 44 PHE O 1 1 22 12226 1 1 24 LYS C C 3.370 4.913 2.719 1.00 . A A . 45 LYS C 1 1 22 12227 1 1 24 LYS CA C 2.597 4.230 3.857 1.00 . A A . 45 LYS CA 1 1 22 12228 1 1 24 LYS CB C 3.198 4.613 5.227 1.00 . A A . 45 LYS CB 1 1 22 12229 1 1 24 LYS CD C 3.734 6.436 6.892 1.00 . A A . 45 LYS CD 1 1 22 12230 1 1 24 LYS CE C 3.700 7.948 7.150 1.00 . A A . 45 LYS CE 1 1 22 12231 1 1 24 LYS CG C 3.160 6.125 5.502 1.00 . A A . 45 LYS CG 1 1 22 12232 1 1 24 LYS H H 3.304 2.297 3.248 1.00 . A A . 45 LYS H 1 1 22 12233 1 1 24 LYS HA H 1.575 4.609 3.812 1.00 . A A . 45 LYS HA 1 1 22 12234 1 1 24 LYS HB2 H 2.632 4.113 6.013 1.00 . A A . 45 LYS HB2 1 1 22 12235 1 1 24 LYS HB3 H 4.230 4.263 5.283 1.00 . A A . 45 LYS HB3 1 1 22 12236 1 1 24 LYS HD2 H 3.141 5.922 7.651 1.00 . A A . 45 LYS HD2 1 1 22 12237 1 1 24 LYS HD3 H 4.765 6.081 6.943 1.00 . A A . 45 LYS HD3 1 1 22 12238 1 1 24 LYS HE2 H 4.272 8.453 6.365 1.00 . A A . 45 LYS HE2 1 1 22 12239 1 1 24 LYS HE3 H 2.664 8.293 7.084 1.00 . A A . 45 LYS HE3 1 1 22 12240 1 1 24 LYS HG2 H 3.753 6.652 4.753 1.00 . A A . 45 LYS HG2 1 1 22 12241 1 1 24 LYS HG3 H 2.128 6.474 5.450 1.00 . A A . 45 LYS HG3 1 1 22 12242 1 1 24 LYS HZ1 H 3.743 7.843 9.227 1.00 . A A . 45 LYS HZ1 1 1 22 12243 1 1 24 LYS HZ2 H 5.228 7.995 8.561 1.00 . A A . 45 LYS HZ2 1 1 22 12244 1 1 24 LYS HZ3 H 4.235 9.286 8.646 1.00 . A A . 45 LYS HZ3 1 1 22 12245 1 1 24 LYS N N 2.566 2.755 3.763 1.00 . A A . 45 LYS N 1 1 22 12246 1 1 24 LYS NZ N 4.264 8.287 8.483 1.00 . A A . 45 LYS NZ 1 1 22 12247 1 1 24 LYS O O 2.815 5.792 2.056 1.00 . A A . 45 LYS O 1 1 22 12248 1 1 25 CYS C C 5.286 5.016 0.089 1.00 . A A . 46 CYS C 1 1 22 12249 1 1 25 CYS CA C 5.561 5.231 1.595 1.00 . A A . 46 CYS CA 1 1 22 12250 1 1 25 CYS CB C 7.007 4.889 2.004 1.00 . A A . 46 CYS CB 1 1 22 12251 1 1 25 CYS H H 5.038 3.825 3.084 1.00 . A A . 46 CYS H 1 1 22 12252 1 1 25 CYS HA H 5.440 6.303 1.765 1.00 . A A . 46 CYS HA 1 1 22 12253 1 1 25 CYS HB2 H 7.676 5.065 1.159 1.00 . A A . 46 CYS HB2 1 1 22 12254 1 1 25 CYS HB3 H 7.304 5.575 2.800 1.00 . A A . 46 CYS HB3 1 1 22 12255 1 1 25 CYS N N 4.632 4.540 2.497 1.00 . A A . 46 CYS N 1 1 22 12256 1 1 25 CYS O O 5.475 5.953 -0.690 1.00 . A A . 46 CYS O 1 1 22 12257 1 1 25 CYS SG S 7.211 3.190 2.618 1.00 . A A . 46 CYS SG 1 1 22 12258 1 1 26 LYS C C 4.867 3.989 -2.913 1.00 . A A . 47 LYS C 1 1 22 12259 1 1 26 LYS CA C 4.169 3.490 -1.624 1.00 . A A . 47 LYS CA 1 1 22 12260 1 1 26 LYS CB C 2.651 3.779 -1.574 1.00 . A A . 47 LYS CB 1 1 22 12261 1 1 26 LYS CD C 0.780 5.467 -1.268 1.00 . A A . 47 LYS CD 1 1 22 12262 1 1 26 LYS CE C 0.463 6.901 -0.828 1.00 . A A . 47 LYS CE 1 1 22 12263 1 1 26 LYS CG C 2.293 5.266 -1.424 1.00 . A A . 47 LYS CG 1 1 22 12264 1 1 26 LYS H H 4.691 3.141 0.420 1.00 . A A . 47 LYS H 1 1 22 12265 1 1 26 LYS HA H 4.245 2.407 -1.707 1.00 . A A . 47 LYS HA 1 1 22 12266 1 1 26 LYS HB2 H 2.176 3.387 -2.476 1.00 . A A . 47 LYS HB2 1 1 22 12267 1 1 26 LYS HB3 H 2.232 3.236 -0.726 1.00 . A A . 47 LYS HB3 1 1 22 12268 1 1 26 LYS HD2 H 0.300 5.271 -2.227 1.00 . A A . 47 LYS HD2 1 1 22 12269 1 1 26 LYS HD3 H 0.382 4.768 -0.533 1.00 . A A . 47 LYS HD3 1 1 22 12270 1 1 26 LYS HE2 H 1.029 7.598 -1.452 1.00 . A A . 47 LYS HE2 1 1 22 12271 1 1 26 LYS HE3 H -0.600 7.084 -1.000 1.00 . A A . 47 LYS HE3 1 1 22 12272 1 1 26 LYS HG2 H 2.784 5.663 -0.540 1.00 . A A . 47 LYS HG2 1 1 22 12273 1 1 26 LYS HG3 H 2.644 5.822 -2.293 1.00 . A A . 47 LYS HG3 1 1 22 12274 1 1 26 LYS HZ1 H 1.724 6.867 0.845 1.00 . A A . 47 LYS HZ1 1 1 22 12275 1 1 26 LYS HZ2 H 0.615 8.081 0.885 1.00 . A A . 47 LYS HZ2 1 1 22 12276 1 1 26 LYS HZ3 H 0.183 6.529 1.195 1.00 . A A . 47 LYS HZ3 1 1 22 12277 1 1 26 LYS N N 4.770 3.841 -0.309 1.00 . A A . 47 LYS N 1 1 22 12278 1 1 26 LYS NZ N 0.768 7.121 0.612 1.00 . A A . 47 LYS NZ 1 1 22 12279 1 1 26 LYS O O 4.218 4.135 -3.950 1.00 . A A . 47 LYS O 1 1 22 12280 1 1 27 GLN C C 7.074 3.556 -5.132 1.00 . A A . 48 GLN C 1 1 22 12281 1 1 27 GLN CA C 6.973 4.661 -4.046 1.00 . A A . 48 GLN CA 1 1 22 12282 1 1 27 GLN CB C 8.375 5.114 -3.596 1.00 . A A . 48 GLN CB 1 1 22 12283 1 1 27 GLN CD C 7.642 7.517 -3.129 1.00 . A A . 48 GLN CD 1 1 22 12284 1 1 27 GLN CG C 8.375 6.284 -2.598 1.00 . A A . 48 GLN CG 1 1 22 12285 1 1 27 GLN H H 6.652 4.117 -1.994 1.00 . A A . 48 GLN H 1 1 22 12286 1 1 27 GLN HA H 6.457 5.516 -4.480 1.00 . A A . 48 GLN HA 1 1 22 12287 1 1 27 GLN HB2 H 8.893 4.274 -3.136 1.00 . A A . 48 GLN HB2 1 1 22 12288 1 1 27 GLN HB3 H 8.951 5.416 -4.471 1.00 . A A . 48 GLN HB3 1 1 22 12289 1 1 27 GLN HE21 H 6.067 7.238 -1.888 1.00 . A A . 48 GLN HE21 1 1 22 12290 1 1 27 GLN HE22 H 5.985 8.636 -2.966 1.00 . A A . 48 GLN HE22 1 1 22 12291 1 1 27 GLN HG2 H 7.931 5.964 -1.656 1.00 . A A . 48 GLN HG2 1 1 22 12292 1 1 27 GLN HG3 H 9.407 6.564 -2.386 1.00 . A A . 48 GLN HG3 1 1 22 12293 1 1 27 GLN N N 6.181 4.231 -2.879 1.00 . A A . 48 GLN N 1 1 22 12294 1 1 27 GLN NE2 N 6.469 7.825 -2.617 1.00 . A A . 48 GLN NE2 1 1 22 12295 1 1 27 GLN O O 7.039 2.374 -4.770 1.00 . A A . 48 GLN O 1 1 22 12296 1 1 27 GLN OE1 O 8.102 8.213 -4.023 1.00 . A A . 48 GLN OE1 1 1 22 12297 1 1 28 PRO C C 7.837 1.639 -7.610 1.00 . A A . 49 PRO C 1 1 22 12298 1 1 28 PRO CA C 7.089 2.987 -7.586 1.00 . A A . 49 PRO CA 1 1 22 12299 1 1 28 PRO CB C 7.492 3.814 -8.811 1.00 . A A . 49 PRO CB 1 1 22 12300 1 1 28 PRO CD C 7.409 5.265 -6.925 1.00 . A A . 49 PRO CD 1 1 22 12301 1 1 28 PRO CG C 7.102 5.232 -8.420 1.00 . A A . 49 PRO CG 1 1 22 12302 1 1 28 PRO HA H 6.025 2.763 -7.668 1.00 . A A . 49 PRO HA 1 1 22 12303 1 1 28 PRO HB2 H 8.572 3.764 -8.960 1.00 . A A . 49 PRO HB2 1 1 22 12304 1 1 28 PRO HB3 H 6.967 3.488 -9.710 1.00 . A A . 49 PRO HB3 1 1 22 12305 1 1 28 PRO HD2 H 8.441 5.583 -6.775 1.00 . A A . 49 PRO HD2 1 1 22 12306 1 1 28 PRO HD3 H 6.729 5.968 -6.446 1.00 . A A . 49 PRO HD3 1 1 22 12307 1 1 28 PRO HG2 H 7.678 5.978 -8.968 1.00 . A A . 49 PRO HG2 1 1 22 12308 1 1 28 PRO HG3 H 6.031 5.376 -8.578 1.00 . A A . 49 PRO HG3 1 1 22 12309 1 1 28 PRO N N 7.243 3.897 -6.432 1.00 . A A . 49 PRO N 1 1 22 12310 1 1 28 PRO O O 7.434 0.753 -8.368 1.00 . A A . 49 PRO O 1 1 22 12311 1 1 29 GLY C C 10.399 -0.114 -5.460 1.00 . A A . 50 GLY C 1 1 22 12312 1 1 29 GLY CA C 9.675 0.195 -6.779 1.00 . A A . 50 GLY CA 1 1 22 12313 1 1 29 GLY H H 9.231 2.245 -6.291 1.00 . A A . 50 GLY H 1 1 22 12314 1 1 29 GLY HA2 H 10.424 0.222 -7.571 1.00 . A A . 50 GLY HA2 1 1 22 12315 1 1 29 GLY HA3 H 9.007 -0.643 -6.978 1.00 . A A . 50 GLY HA3 1 1 22 12316 1 1 29 GLY N N 8.904 1.454 -6.823 1.00 . A A . 50 GLY N 1 1 22 12317 1 1 29 GLY O O 11.076 -1.139 -5.362 1.00 . A A . 50 GLY O 1 1 22 12318 1 1 30 HIS C C 10.533 -0.668 -2.356 1.00 . A A . 51 HIS C 1 1 22 12319 1 1 30 HIS CA C 10.948 0.595 -3.142 1.00 . A A . 51 HIS CA 1 1 22 12320 1 1 30 HIS CB C 10.667 1.852 -2.295 1.00 . A A . 51 HIS CB 1 1 22 12321 1 1 30 HIS CD2 C 9.161 1.561 -0.251 1.00 . A A . 51 HIS CD2 1 1 22 12322 1 1 30 HIS CE1 C 7.190 1.449 -1.210 1.00 . A A . 51 HIS CE1 1 1 22 12323 1 1 30 HIS CG C 9.331 1.809 -1.585 1.00 . A A . 51 HIS CG 1 1 22 12324 1 1 30 HIS H H 9.699 1.562 -4.581 1.00 . A A . 51 HIS H 1 1 22 12325 1 1 30 HIS HA H 12.022 0.536 -3.323 1.00 . A A . 51 HIS HA 1 1 22 12326 1 1 30 HIS HB2 H 11.448 1.929 -1.538 1.00 . A A . 51 HIS HB2 1 1 22 12327 1 1 30 HIS HB3 H 10.729 2.746 -2.917 1.00 . A A . 51 HIS HB3 1 1 22 12328 1 1 30 HIS HD1 H 7.848 1.878 -3.151 1.00 . A A . 51 HIS HD1 1 1 22 12329 1 1 30 HIS HD2 H 9.955 1.464 0.476 1.00 . A A . 51 HIS HD2 1 1 22 12330 1 1 30 HIS HE1 H 6.130 1.296 -1.375 1.00 . A A . 51 HIS HE1 1 1 22 12331 1 1 30 HIS N N 10.266 0.741 -4.440 1.00 . A A . 51 HIS N 1 1 22 12332 1 1 30 HIS ND1 N 8.080 1.747 -2.168 1.00 . A A . 51 HIS ND1 1 1 22 12333 1 1 30 HIS NE2 N 7.800 1.332 -0.021 1.00 . A A . 51 HIS NE2 1 1 22 12334 1 1 30 HIS O O 11.307 -1.205 -1.559 1.00 . A A . 51 HIS O 1 1 22 12335 1 1 31 PHE C C 9.316 -3.449 -1.641 1.00 . A A . 52 PHE C 1 1 22 12336 1 1 31 PHE CA C 8.610 -2.092 -1.680 1.00 . A A . 52 PHE CA 1 1 22 12337 1 1 31 PHE CB C 7.138 -2.215 -2.102 1.00 . A A . 52 PHE CB 1 1 22 12338 1 1 31 PHE CD1 C 6.927 -3.546 -4.262 1.00 . A A . 52 PHE CD1 1 1 22 12339 1 1 31 PHE CD2 C 6.613 -1.133 -4.335 1.00 . A A . 52 PHE CD2 1 1 22 12340 1 1 31 PHE CE1 C 6.714 -3.613 -5.650 1.00 . A A . 52 PHE CE1 1 1 22 12341 1 1 31 PHE CE2 C 6.389 -1.203 -5.719 1.00 . A A . 52 PHE CE2 1 1 22 12342 1 1 31 PHE CG C 6.887 -2.303 -3.599 1.00 . A A . 52 PHE CG 1 1 22 12343 1 1 31 PHE CZ C 6.447 -2.440 -6.380 1.00 . A A . 52 PHE CZ 1 1 22 12344 1 1 31 PHE H H 8.729 -0.653 -3.239 1.00 . A A . 52 PHE H 1 1 22 12345 1 1 31 PHE HA H 8.625 -1.704 -0.660 1.00 . A A . 52 PHE HA 1 1 22 12346 1 1 31 PHE HB2 H 6.709 -3.092 -1.620 1.00 . A A . 52 PHE HB2 1 1 22 12347 1 1 31 PHE HB3 H 6.599 -1.350 -1.716 1.00 . A A . 52 PHE HB3 1 1 22 12348 1 1 31 PHE HD1 H 7.130 -4.453 -3.709 1.00 . A A . 52 PHE HD1 1 1 22 12349 1 1 31 PHE HD2 H 6.551 -0.177 -3.835 1.00 . A A . 52 PHE HD2 1 1 22 12350 1 1 31 PHE HE1 H 6.758 -4.568 -6.157 1.00 . A A . 52 PHE HE1 1 1 22 12351 1 1 31 PHE HE2 H 6.160 -0.303 -6.273 1.00 . A A . 52 PHE HE2 1 1 22 12352 1 1 31 PHE HZ H 6.277 -2.493 -7.448 1.00 . A A . 52 PHE HZ 1 1 22 12353 1 1 31 PHE N N 9.289 -1.123 -2.545 1.00 . A A . 52 PHE N 1 1 22 12354 1 1 31 PHE O O 9.502 -4.001 -0.556 1.00 . A A . 52 PHE O 1 1 22 12355 1 1 32 SER C C 11.904 -5.206 -2.136 1.00 . A A . 53 SER C 1 1 22 12356 1 1 32 SER CA C 10.576 -5.188 -2.912 1.00 . A A . 53 SER CA 1 1 22 12357 1 1 32 SER CB C 10.863 -5.466 -4.394 1.00 . A A . 53 SER CB 1 1 22 12358 1 1 32 SER H H 9.596 -3.438 -3.638 1.00 . A A . 53 SER H 1 1 22 12359 1 1 32 SER HA H 9.967 -6.007 -2.527 1.00 . A A . 53 SER HA 1 1 22 12360 1 1 32 SER HB2 H 11.511 -4.681 -4.791 1.00 . A A . 53 SER HB2 1 1 22 12361 1 1 32 SER HB3 H 11.375 -6.426 -4.490 1.00 . A A . 53 SER HB3 1 1 22 12362 1 1 32 SER HG H 9.874 -5.703 -6.070 1.00 . A A . 53 SER HG 1 1 22 12363 1 1 32 SER N N 9.806 -3.937 -2.782 1.00 . A A . 53 SER N 1 1 22 12364 1 1 32 SER O O 12.555 -6.251 -2.069 1.00 . A A . 53 SER O 1 1 22 12365 1 1 32 SER OG O 9.654 -5.504 -5.138 1.00 . A A . 53 SER OG 1 1 22 12366 1 1 33 LYS C C 13.355 -3.276 0.604 1.00 . A A . 54 LYS C 1 1 22 12367 1 1 33 LYS CA C 13.569 -3.860 -0.809 1.00 . A A . 54 LYS CA 1 1 22 12368 1 1 33 LYS CB C 14.494 -2.944 -1.643 1.00 . A A . 54 LYS CB 1 1 22 12369 1 1 33 LYS CD C 15.535 -4.724 -3.182 1.00 . A A . 54 LYS CD 1 1 22 12370 1 1 33 LYS CE C 15.698 -5.126 -4.653 1.00 . A A . 54 LYS CE 1 1 22 12371 1 1 33 LYS CG C 14.769 -3.396 -3.090 1.00 . A A . 54 LYS CG 1 1 22 12372 1 1 33 LYS H H 11.731 -3.250 -1.692 1.00 . A A . 54 LYS H 1 1 22 12373 1 1 33 LYS HA H 14.070 -4.818 -0.660 1.00 . A A . 54 LYS HA 1 1 22 12374 1 1 33 LYS HB2 H 14.045 -1.950 -1.684 1.00 . A A . 54 LYS HB2 1 1 22 12375 1 1 33 LYS HB3 H 15.453 -2.847 -1.132 1.00 . A A . 54 LYS HB3 1 1 22 12376 1 1 33 LYS HD2 H 16.515 -4.606 -2.719 1.00 . A A . 54 LYS HD2 1 1 22 12377 1 1 33 LYS HD3 H 14.988 -5.507 -2.658 1.00 . A A . 54 LYS HD3 1 1 22 12378 1 1 33 LYS HE2 H 14.708 -5.189 -5.113 1.00 . A A . 54 LYS HE2 1 1 22 12379 1 1 33 LYS HE3 H 16.258 -4.341 -5.172 1.00 . A A . 54 LYS HE3 1 1 22 12380 1 1 33 LYS HG2 H 13.826 -3.478 -3.634 1.00 . A A . 54 LYS HG2 1 1 22 12381 1 1 33 LYS HG3 H 15.362 -2.622 -3.579 1.00 . A A . 54 LYS HG3 1 1 22 12382 1 1 33 LYS HZ1 H 15.895 -7.171 -4.326 1.00 . A A . 54 LYS HZ1 1 1 22 12383 1 1 33 LYS HZ2 H 16.500 -6.688 -5.762 1.00 . A A . 54 LYS HZ2 1 1 22 12384 1 1 33 LYS HZ3 H 17.330 -6.388 -4.389 1.00 . A A . 54 LYS HZ3 1 1 22 12385 1 1 33 LYS N N 12.310 -4.071 -1.546 1.00 . A A . 54 LYS N 1 1 22 12386 1 1 33 LYS NZ N 16.402 -6.429 -4.790 1.00 . A A . 54 LYS NZ 1 1 22 12387 1 1 33 LYS O O 14.340 -2.968 1.278 1.00 . A A . 54 LYS O 1 1 22 12388 1 1 34 GLN C C 10.484 -2.991 3.014 1.00 . A A . 55 GLN C 1 1 22 12389 1 1 34 GLN CA C 11.786 -2.486 2.354 1.00 . A A . 55 GLN CA 1 1 22 12390 1 1 34 GLN CB C 11.710 -0.960 2.154 1.00 . A A . 55 GLN CB 1 1 22 12391 1 1 34 GLN CD C 11.411 1.292 3.278 1.00 . A A . 55 GLN CD 1 1 22 12392 1 1 34 GLN CG C 11.694 -0.192 3.485 1.00 . A A . 55 GLN CG 1 1 22 12393 1 1 34 GLN H H 11.347 -3.429 0.469 1.00 . A A . 55 GLN H 1 1 22 12394 1 1 34 GLN HA H 12.598 -2.699 3.052 1.00 . A A . 55 GLN HA 1 1 22 12395 1 1 34 GLN HB2 H 12.574 -0.622 1.579 1.00 . A A . 55 GLN HB2 1 1 22 12396 1 1 34 GLN HB3 H 10.812 -0.719 1.583 1.00 . A A . 55 GLN HB3 1 1 22 12397 1 1 34 GLN HE21 H 9.425 1.000 3.454 1.00 . A A . 55 GLN HE21 1 1 22 12398 1 1 34 GLN HE22 H 9.935 2.661 3.188 1.00 . A A . 55 GLN HE22 1 1 22 12399 1 1 34 GLN HG2 H 10.925 -0.597 4.142 1.00 . A A . 55 GLN HG2 1 1 22 12400 1 1 34 GLN HG3 H 12.658 -0.307 3.981 1.00 . A A . 55 GLN HG3 1 1 22 12401 1 1 34 GLN N N 12.104 -3.109 1.055 1.00 . A A . 55 GLN N 1 1 22 12402 1 1 34 GLN NE2 N 10.157 1.686 3.319 1.00 . A A . 55 GLN NE2 1 1 22 12403 1 1 34 GLN O O 10.484 -3.261 4.217 1.00 . A A . 55 GLN O 1 1 22 12404 1 1 34 GLN OE1 O 12.297 2.112 3.075 1.00 . A A . 55 GLN OE1 1 1 22 12405 1 1 35 CYS C C 7.385 -4.629 2.447 1.00 . A A . 56 CYS C 1 1 22 12406 1 1 35 CYS CA C 8.026 -3.268 2.784 1.00 . A A . 56 CYS CA 1 1 22 12407 1 1 35 CYS CB C 7.162 -2.102 2.263 1.00 . A A . 56 CYS CB 1 1 22 12408 1 1 35 CYS H H 9.475 -2.886 1.272 1.00 . A A . 56 CYS H 1 1 22 12409 1 1 35 CYS HA H 8.050 -3.189 3.873 1.00 . A A . 56 CYS HA 1 1 22 12410 1 1 35 CYS HB2 H 7.105 -2.141 1.174 1.00 . A A . 56 CYS HB2 1 1 22 12411 1 1 35 CYS HB3 H 6.149 -2.211 2.658 1.00 . A A . 56 CYS HB3 1 1 22 12412 1 1 35 CYS N N 9.389 -3.114 2.251 1.00 . A A . 56 CYS N 1 1 22 12413 1 1 35 CYS O O 6.553 -5.129 3.210 1.00 . A A . 56 CYS O 1 1 22 12414 1 1 35 CYS SG S 7.842 -0.505 2.797 1.00 . A A . 56 CYS SG 1 1 22 12415 1 1 36 ARG C C 8.558 -7.531 0.628 1.00 . A A . 57 ARG C 1 1 22 12416 1 1 36 ARG CA C 7.368 -6.566 0.815 1.00 . A A . 57 ARG CA 1 1 22 12417 1 1 36 ARG CB C 6.622 -6.388 -0.527 1.00 . A A . 57 ARG CB 1 1 22 12418 1 1 36 ARG CD C 4.183 -6.050 0.297 1.00 . A A . 57 ARG CD 1 1 22 12419 1 1 36 ARG CG C 5.358 -5.507 -0.528 1.00 . A A . 57 ARG CG 1 1 22 12420 1 1 36 ARG CZ C 3.420 -4.729 2.298 1.00 . A A . 57 ARG CZ 1 1 22 12421 1 1 36 ARG H H 8.455 -4.729 0.759 1.00 . A A . 57 ARG H 1 1 22 12422 1 1 36 ARG HA H 6.704 -7.050 1.533 1.00 . A A . 57 ARG HA 1 1 22 12423 1 1 36 ARG HB2 H 7.322 -5.962 -1.247 1.00 . A A . 57 ARG HB2 1 1 22 12424 1 1 36 ARG HB3 H 6.335 -7.372 -0.903 1.00 . A A . 57 ARG HB3 1 1 22 12425 1 1 36 ARG HD2 H 3.258 -5.722 -0.179 1.00 . A A . 57 ARG HD2 1 1 22 12426 1 1 36 ARG HD3 H 4.194 -7.141 0.281 1.00 . A A . 57 ARG HD3 1 1 22 12427 1 1 36 ARG HE H 5.083 -5.774 2.206 1.00 . A A . 57 ARG HE 1 1 22 12428 1 1 36 ARG HG2 H 5.608 -4.503 -0.185 1.00 . A A . 57 ARG HG2 1 1 22 12429 1 1 36 ARG HG3 H 5.025 -5.425 -1.563 1.00 . A A . 57 ARG HG3 1 1 22 12430 1 1 36 ARG HH11 H 2.011 -4.674 0.875 1.00 . A A . 57 ARG HH11 1 1 22 12431 1 1 36 ARG HH12 H 1.780 -3.572 2.205 1.00 . A A . 57 ARG HH12 1 1 22 12432 1 1 36 ARG HH21 H 4.650 -4.504 3.848 1.00 . A A . 57 ARG HH21 1 1 22 12433 1 1 36 ARG HH22 H 3.124 -3.649 3.961 1.00 . A A . 57 ARG HH22 1 1 22 12434 1 1 36 ARG N N 7.790 -5.245 1.329 1.00 . A A . 57 ARG N 1 1 22 12435 1 1 36 ARG NE N 4.240 -5.564 1.687 1.00 . A A . 57 ARG NE 1 1 22 12436 1 1 36 ARG NH1 N 2.291 -4.341 1.788 1.00 . A A . 57 ARG NH1 1 1 22 12437 1 1 36 ARG NH2 N 3.752 -4.250 3.459 1.00 . A A . 57 ARG NH2 1 1 22 12438 1 1 36 ARG O O 8.359 -8.676 0.213 1.00 . A A . 57 ARG O 1 1 22 12439 1 1 37 SER C C 11.020 -9.107 1.761 1.00 . A A . 58 SER C 1 1 22 12440 1 1 37 SER CA C 11.047 -7.831 0.906 1.00 . A A . 58 SER CA 1 1 22 12441 1 1 37 SER CB C 12.210 -6.920 1.319 1.00 . A A . 58 SER CB 1 1 22 12442 1 1 37 SER H H 9.835 -6.132 1.284 1.00 . A A . 58 SER H 1 1 22 12443 1 1 37 SER HA H 11.240 -8.152 -0.117 1.00 . A A . 58 SER HA 1 1 22 12444 1 1 37 SER HB2 H 13.102 -7.523 1.508 1.00 . A A . 58 SER HB2 1 1 22 12445 1 1 37 SER HB3 H 12.432 -6.236 0.501 1.00 . A A . 58 SER HB3 1 1 22 12446 1 1 37 SER HG H 11.658 -6.773 3.195 1.00 . A A . 58 SER HG 1 1 22 12447 1 1 37 SER N N 9.782 -7.070 0.919 1.00 . A A . 58 SER N 1 1 22 12448 1 1 37 SER O O 11.502 -10.154 1.271 1.00 . A A . 58 SER O 1 1 22 12449 1 1 37 SER OXT O 10.544 -9.059 2.919 1.00 . A A . 58 SER OXT 1 1 22 12450 1 1 37 SER OG O 11.876 -6.156 2.468 1.00 . A A . 58 SER OG 1 1 22 12451 2 2 1 ZN ZN ZN -8.076 0.545 3.853 1.00 . B A . 1059 ZN ZN 1 1 22 12452 3 2 1 ZN ZN ZN 6.901 1.187 1.829 1.00 . C A . 1060 ZN ZN 1 1 23 12453 1 1 1 GLN C C -6.961 -1.374 -5.123 1.00 . A A . 22 GLN C 1 1 23 12454 1 1 1 GLN CA C -6.263 -0.645 -6.286 1.00 . A A . 22 GLN CA 1 1 23 12455 1 1 1 GLN CB C -4.892 -0.048 -5.863 1.00 . A A . 22 GLN CB 1 1 23 12456 1 1 1 GLN CD C -3.846 0.056 -8.206 1.00 . A A . 22 GLN CD 1 1 23 12457 1 1 1 GLN CG C -4.146 0.804 -6.908 1.00 . A A . 22 GLN CG 1 1 23 12458 1 1 1 GLN H1 H -8.059 -0.026 -7.095 1.00 . A A . 22 GLN H1 1 1 23 12459 1 1 1 GLN H2 H -7.317 1.127 -6.194 1.00 . A A . 22 GLN H2 1 1 23 12460 1 1 1 GLN H3 H -6.769 0.775 -7.709 1.00 . A A . 22 GLN H3 1 1 23 12461 1 1 1 GLN HA H -6.076 -1.396 -7.053 1.00 . A A . 22 GLN HA 1 1 23 12462 1 1 1 GLN HB2 H -5.037 0.572 -4.978 1.00 . A A . 22 GLN HB2 1 1 23 12463 1 1 1 GLN HB3 H -4.228 -0.865 -5.578 1.00 . A A . 22 GLN HB3 1 1 23 12464 1 1 1 GLN HE21 H -1.844 0.346 -8.081 1.00 . A A . 22 GLN HE21 1 1 23 12465 1 1 1 GLN HE22 H -2.429 -0.555 -9.476 1.00 . A A . 22 GLN HE22 1 1 23 12466 1 1 1 GLN HG2 H -4.718 1.702 -7.143 1.00 . A A . 22 GLN HG2 1 1 23 12467 1 1 1 GLN HG3 H -3.206 1.136 -6.462 1.00 . A A . 22 GLN HG3 1 1 23 12468 1 1 1 GLN N N -7.165 0.385 -6.867 1.00 . A A . 22 GLN N 1 1 23 12469 1 1 1 GLN NE2 N -2.601 -0.062 -8.612 1.00 . A A . 22 GLN NE2 1 1 23 12470 1 1 1 GLN O O -8.160 -1.181 -4.906 1.00 . A A . 22 GLN O 1 1 23 12471 1 1 1 GLN OE1 O -4.739 -0.438 -8.880 1.00 . A A . 22 GLN OE1 1 1 23 12472 1 1 2 THR C C -5.978 -2.629 -1.950 1.00 . A A . 23 THR C 1 1 23 12473 1 1 2 THR CA C -6.728 -3.008 -3.231 1.00 . A A . 23 THR CA 1 1 23 12474 1 1 2 THR CB C -6.550 -4.510 -3.534 1.00 . A A . 23 THR CB 1 1 23 12475 1 1 2 THR CG2 C -7.033 -5.448 -2.425 1.00 . A A . 23 THR CG2 1 1 23 12476 1 1 2 THR H H -5.243 -2.293 -4.578 1.00 . A A . 23 THR H 1 1 23 12477 1 1 2 THR HA H -7.788 -2.817 -3.075 1.00 . A A . 23 THR HA 1 1 23 12478 1 1 2 THR HB H -5.495 -4.713 -3.720 1.00 . A A . 23 THR HB 1 1 23 12479 1 1 2 THR HG1 H -6.847 -4.456 -5.455 1.00 . A A . 23 THR HG1 1 1 23 12480 1 1 2 THR HG21 H -8.084 -5.268 -2.209 1.00 . A A . 23 THR HG21 1 1 23 12481 1 1 2 THR HG22 H -6.911 -6.482 -2.751 1.00 . A A . 23 THR HG22 1 1 23 12482 1 1 2 THR HG23 H -6.441 -5.306 -1.521 1.00 . A A . 23 THR HG23 1 1 23 12483 1 1 2 THR N N -6.229 -2.202 -4.367 1.00 . A A . 23 THR N 1 1 23 12484 1 1 2 THR O O -4.780 -2.343 -2.002 1.00 . A A . 23 THR O 1 1 23 12485 1 1 2 THR OG1 O -7.293 -4.851 -4.686 1.00 . A A . 23 THR OG1 1 1 23 12486 1 1 3 CYS C C -4.975 -2.934 1.042 1.00 . A A . 24 CYS C 1 1 23 12487 1 1 3 CYS CA C -6.148 -2.110 0.470 1.00 . A A . 24 CYS CA 1 1 23 12488 1 1 3 CYS CB C -7.303 -2.096 1.473 1.00 . A A . 24 CYS CB 1 1 23 12489 1 1 3 CYS H H -7.659 -2.829 -0.851 1.00 . A A . 24 CYS H 1 1 23 12490 1 1 3 CYS HA H -5.809 -1.082 0.319 1.00 . A A . 24 CYS HA 1 1 23 12491 1 1 3 CYS HB2 H -8.208 -1.719 0.995 1.00 . A A . 24 CYS HB2 1 1 23 12492 1 1 3 CYS HB3 H -7.496 -3.111 1.824 1.00 . A A . 24 CYS HB3 1 1 23 12493 1 1 3 CYS N N -6.673 -2.594 -0.810 1.00 . A A . 24 CYS N 1 1 23 12494 1 1 3 CYS O O -4.917 -4.157 0.896 1.00 . A A . 24 CYS O 1 1 23 12495 1 1 3 CYS SG S -6.838 -1.023 2.855 1.00 . A A . 24 CYS SG 1 1 23 12496 1 1 4 TYR C C -3.675 -3.534 3.946 1.00 . A A . 25 TYR C 1 1 23 12497 1 1 4 TYR CA C -3.096 -2.882 2.671 1.00 . A A . 25 TYR CA 1 1 23 12498 1 1 4 TYR CB C -2.030 -1.842 3.054 1.00 . A A . 25 TYR CB 1 1 23 12499 1 1 4 TYR CD1 C -3.439 -0.061 4.229 1.00 . A A . 25 TYR CD1 1 1 23 12500 1 1 4 TYR CD2 C -1.559 -1.051 5.418 1.00 . A A . 25 TYR CD2 1 1 23 12501 1 1 4 TYR CE1 C -3.741 0.721 5.360 1.00 . A A . 25 TYR CE1 1 1 23 12502 1 1 4 TYR CE2 C -1.850 -0.262 6.547 1.00 . A A . 25 TYR CE2 1 1 23 12503 1 1 4 TYR CG C -2.349 -0.956 4.254 1.00 . A A . 25 TYR CG 1 1 23 12504 1 1 4 TYR CZ C -2.949 0.624 6.520 1.00 . A A . 25 TYR CZ 1 1 23 12505 1 1 4 TYR H H -4.232 -1.261 1.869 1.00 . A A . 25 TYR H 1 1 23 12506 1 1 4 TYR HA H -2.607 -3.676 2.111 1.00 . A A . 25 TYR HA 1 1 23 12507 1 1 4 TYR HB2 H -1.124 -2.400 3.284 1.00 . A A . 25 TYR HB2 1 1 23 12508 1 1 4 TYR HB3 H -1.802 -1.211 2.195 1.00 . A A . 25 TYR HB3 1 1 23 12509 1 1 4 TYR HD1 H -4.061 0.020 3.350 1.00 . A A . 25 TYR HD1 1 1 23 12510 1 1 4 TYR HD2 H -0.725 -1.742 5.450 1.00 . A A . 25 TYR HD2 1 1 23 12511 1 1 4 TYR HE1 H -4.594 1.379 5.354 1.00 . A A . 25 TYR HE1 1 1 23 12512 1 1 4 TYR HE2 H -1.242 -0.342 7.438 1.00 . A A . 25 TYR HE2 1 1 23 12513 1 1 4 TYR HH H -2.675 1.187 8.364 1.00 . A A . 25 TYR HH 1 1 23 12514 1 1 4 TYR N N -4.097 -2.260 1.792 1.00 . A A . 25 TYR N 1 1 23 12515 1 1 4 TYR O O -2.982 -4.324 4.594 1.00 . A A . 25 TYR O 1 1 23 12516 1 1 4 TYR OH O -3.264 1.371 7.613 1.00 . A A . 25 TYR OH 1 1 23 12517 1 1 5 ASN C C -6.951 -4.010 5.570 1.00 . A A . 26 ASN C 1 1 23 12518 1 1 5 ASN CA C -5.495 -3.511 5.636 1.00 . A A . 26 ASN CA 1 1 23 12519 1 1 5 ASN CB C -5.394 -2.223 6.474 1.00 . A A . 26 ASN CB 1 1 23 12520 1 1 5 ASN CG C -6.092 -2.336 7.821 1.00 . A A . 26 ASN CG 1 1 23 12521 1 1 5 ASN H H -5.419 -2.556 3.727 1.00 . A A . 26 ASN H 1 1 23 12522 1 1 5 ASN HA H -4.914 -4.292 6.132 1.00 . A A . 26 ASN HA 1 1 23 12523 1 1 5 ASN HB2 H -4.343 -1.997 6.653 1.00 . A A . 26 ASN HB2 1 1 23 12524 1 1 5 ASN HB3 H -5.828 -1.388 5.925 1.00 . A A . 26 ASN HB3 1 1 23 12525 1 1 5 ASN HD21 H -7.785 -1.457 7.132 1.00 . A A . 26 ASN HD21 1 1 23 12526 1 1 5 ASN HD22 H -7.778 -1.939 8.821 1.00 . A A . 26 ASN HD22 1 1 23 12527 1 1 5 ASN N N -4.920 -3.211 4.318 1.00 . A A . 26 ASN N 1 1 23 12528 1 1 5 ASN ND2 N -7.312 -1.860 7.931 1.00 . A A . 26 ASN ND2 1 1 23 12529 1 1 5 ASN O O -7.286 -5.015 6.202 1.00 . A A . 26 ASN O 1 1 23 12530 1 1 5 ASN OD1 O -5.551 -2.862 8.785 1.00 . A A . 26 ASN OD1 1 1 23 12531 1 1 6 CYS C C -9.668 -4.827 4.028 1.00 . A A . 27 CYS C 1 1 23 12532 1 1 6 CYS CA C -9.257 -3.546 4.787 1.00 . A A . 27 CYS CA 1 1 23 12533 1 1 6 CYS CB C -9.923 -2.303 4.172 1.00 . A A . 27 CYS CB 1 1 23 12534 1 1 6 CYS H H -7.473 -2.499 4.331 1.00 . A A . 27 CYS H 1 1 23 12535 1 1 6 CYS HA H -9.610 -3.646 5.814 1.00 . A A . 27 CYS HA 1 1 23 12536 1 1 6 CYS HB2 H -9.630 -2.211 3.125 1.00 . A A . 27 CYS HB2 1 1 23 12537 1 1 6 CYS HB3 H -11.008 -2.435 4.208 1.00 . A A . 27 CYS HB3 1 1 23 12538 1 1 6 CYS N N -7.811 -3.319 4.817 1.00 . A A . 27 CYS N 1 1 23 12539 1 1 6 CYS O O -10.803 -5.288 4.171 1.00 . A A . 27 CYS O 1 1 23 12540 1 1 6 CYS SG S -9.472 -0.798 5.092 1.00 . A A . 27 CYS SG 1 1 23 12541 1 1 7 GLY C C -10.182 -6.259 1.332 1.00 . A A . 28 GLY C 1 1 23 12542 1 1 7 GLY CA C -9.067 -6.548 2.344 1.00 . A A . 28 GLY CA 1 1 23 12543 1 1 7 GLY H H -7.847 -4.998 3.177 1.00 . A A . 28 GLY H 1 1 23 12544 1 1 7 GLY HA2 H -9.361 -7.400 2.958 1.00 . A A . 28 GLY HA2 1 1 23 12545 1 1 7 GLY HA3 H -8.166 -6.816 1.790 1.00 . A A . 28 GLY HA3 1 1 23 12546 1 1 7 GLY N N -8.773 -5.399 3.209 1.00 . A A . 28 GLY N 1 1 23 12547 1 1 7 GLY O O -11.128 -7.044 1.213 1.00 . A A . 28 GLY O 1 1 23 12548 1 1 8 LYS C C -10.566 -3.885 -1.472 1.00 . A A . 29 LYS C 1 1 23 12549 1 1 8 LYS CA C -11.165 -4.551 -0.220 1.00 . A A . 29 LYS CA 1 1 23 12550 1 1 8 LYS CB C -12.003 -3.514 0.572 1.00 . A A . 29 LYS CB 1 1 23 12551 1 1 8 LYS CD C -13.976 -5.101 1.155 1.00 . A A . 29 LYS CD 1 1 23 12552 1 1 8 LYS CE C -13.535 -5.273 2.613 1.00 . A A . 29 LYS CE 1 1 23 12553 1 1 8 LYS CG C -13.526 -3.749 0.576 1.00 . A A . 29 LYS CG 1 1 23 12554 1 1 8 LYS H H -9.298 -4.521 0.820 1.00 . A A . 29 LYS H 1 1 23 12555 1 1 8 LYS HA H -11.794 -5.377 -0.543 1.00 . A A . 29 LYS HA 1 1 23 12556 1 1 8 LYS HB2 H -11.653 -3.454 1.603 1.00 . A A . 29 LYS HB2 1 1 23 12557 1 1 8 LYS HB3 H -11.834 -2.523 0.149 1.00 . A A . 29 LYS HB3 1 1 23 12558 1 1 8 LYS HD2 H -15.064 -5.163 1.105 1.00 . A A . 29 LYS HD2 1 1 23 12559 1 1 8 LYS HD3 H -13.573 -5.907 0.543 1.00 . A A . 29 LYS HD3 1 1 23 12560 1 1 8 LYS HE2 H -12.541 -4.838 2.735 1.00 . A A . 29 LYS HE2 1 1 23 12561 1 1 8 LYS HE3 H -14.219 -4.720 3.265 1.00 . A A . 29 LYS HE3 1 1 23 12562 1 1 8 LYS HG2 H -13.991 -2.952 1.159 1.00 . A A . 29 LYS HG2 1 1 23 12563 1 1 8 LYS HG3 H -13.899 -3.663 -0.444 1.00 . A A . 29 LYS HG3 1 1 23 12564 1 1 8 LYS HZ1 H -12.809 -7.194 2.414 1.00 . A A . 29 LYS HZ1 1 1 23 12565 1 1 8 LYS HZ2 H -13.157 -6.797 3.958 1.00 . A A . 29 LYS HZ2 1 1 23 12566 1 1 8 LYS HZ3 H -14.376 -7.152 2.920 1.00 . A A . 29 LYS HZ3 1 1 23 12567 1 1 8 LYS N N -10.116 -5.096 0.664 1.00 . A A . 29 LYS N 1 1 23 12568 1 1 8 LYS NZ N -13.475 -6.703 3.003 1.00 . A A . 29 LYS NZ 1 1 23 12569 1 1 8 LYS O O -9.528 -3.224 -1.345 1.00 . A A . 29 LYS O 1 1 23 12570 1 1 9 PRO C C -11.401 -1.695 -3.585 1.00 . A A . 30 PRO C 1 1 23 12571 1 1 9 PRO CA C -10.932 -3.148 -3.816 1.00 . A A . 30 PRO CA 1 1 23 12572 1 1 9 PRO CB C -11.662 -3.843 -4.977 1.00 . A A . 30 PRO CB 1 1 23 12573 1 1 9 PRO CD C -12.350 -4.865 -2.938 1.00 . A A . 30 PRO CD 1 1 23 12574 1 1 9 PRO CG C -12.891 -4.440 -4.301 1.00 . A A . 30 PRO CG 1 1 23 12575 1 1 9 PRO HA H -9.863 -3.137 -4.031 1.00 . A A . 30 PRO HA 1 1 23 12576 1 1 9 PRO HB2 H -11.937 -3.167 -5.787 1.00 . A A . 30 PRO HB2 1 1 23 12577 1 1 9 PRO HB3 H -11.037 -4.650 -5.363 1.00 . A A . 30 PRO HB3 1 1 23 12578 1 1 9 PRO HD2 H -13.137 -4.778 -2.192 1.00 . A A . 30 PRO HD2 1 1 23 12579 1 1 9 PRO HD3 H -12.000 -5.897 -2.991 1.00 . A A . 30 PRO HD3 1 1 23 12580 1 1 9 PRO HG2 H -13.652 -3.668 -4.170 1.00 . A A . 30 PRO HG2 1 1 23 12581 1 1 9 PRO HG3 H -13.292 -5.285 -4.859 1.00 . A A . 30 PRO HG3 1 1 23 12582 1 1 9 PRO N N -11.217 -3.987 -2.649 1.00 . A A . 30 PRO N 1 1 23 12583 1 1 9 PRO O O -11.756 -1.310 -2.466 1.00 . A A . 30 PRO O 1 1 23 12584 1 1 10 GLY C C -10.932 1.405 -3.647 1.00 . A A . 31 GLY C 1 1 23 12585 1 1 10 GLY CA C -11.823 0.543 -4.552 1.00 . A A . 31 GLY CA 1 1 23 12586 1 1 10 GLY H H -11.084 -1.217 -5.525 1.00 . A A . 31 GLY H 1 1 23 12587 1 1 10 GLY HA2 H -12.846 0.590 -4.175 1.00 . A A . 31 GLY HA2 1 1 23 12588 1 1 10 GLY HA3 H -11.805 0.977 -5.552 1.00 . A A . 31 GLY HA3 1 1 23 12589 1 1 10 GLY N N -11.393 -0.861 -4.632 1.00 . A A . 31 GLY N 1 1 23 12590 1 1 10 GLY O O -11.401 2.372 -3.042 1.00 . A A . 31 GLY O 1 1 23 12591 1 1 11 HIS C C -7.565 2.365 -3.370 1.00 . A A . 32 HIS C 1 1 23 12592 1 1 11 HIS CA C -8.684 1.639 -2.617 1.00 . A A . 32 HIS CA 1 1 23 12593 1 1 11 HIS CB C -8.138 0.567 -1.665 1.00 . A A . 32 HIS CB 1 1 23 12594 1 1 11 HIS CD2 C -8.614 0.945 0.817 1.00 . A A . 32 HIS CD2 1 1 23 12595 1 1 11 HIS CE1 C -10.570 -0.026 1.013 1.00 . A A . 32 HIS CE1 1 1 23 12596 1 1 11 HIS CG C -8.959 0.449 -0.409 1.00 . A A . 32 HIS CG 1 1 23 12597 1 1 11 HIS H H -9.346 0.224 -4.058 1.00 . A A . 32 HIS H 1 1 23 12598 1 1 11 HIS HA H -9.189 2.391 -2.012 1.00 . A A . 32 HIS HA 1 1 23 12599 1 1 11 HIS HB2 H -8.103 -0.401 -2.166 1.00 . A A . 32 HIS HB2 1 1 23 12600 1 1 11 HIS HB3 H -7.118 0.824 -1.375 1.00 . A A . 32 HIS HB3 1 1 23 12601 1 1 11 HIS HD1 H -10.730 -0.598 -1.011 1.00 . A A . 32 HIS HD1 1 1 23 12602 1 1 11 HIS HD2 H -7.699 1.477 1.038 1.00 . A A . 32 HIS HD2 1 1 23 12603 1 1 11 HIS HE1 H -11.502 -0.399 1.421 1.00 . A A . 32 HIS HE1 1 1 23 12604 1 1 11 HIS N N -9.655 1.031 -3.526 1.00 . A A . 32 HIS N 1 1 23 12605 1 1 11 HIS ND1 N -10.191 -0.146 -0.271 1.00 . A A . 32 HIS ND1 1 1 23 12606 1 1 11 HIS NE2 N -9.629 0.623 1.727 1.00 . A A . 32 HIS NE2 1 1 23 12607 1 1 11 HIS O O -7.150 1.966 -4.459 1.00 . A A . 32 HIS O 1 1 23 12608 1 1 12 LEU C C -5.483 5.145 -2.059 1.00 . A A . 33 LEU C 1 1 23 12609 1 1 12 LEU CA C -6.153 4.452 -3.260 1.00 . A A . 33 LEU CA 1 1 23 12610 1 1 12 LEU CB C -6.927 5.518 -4.077 1.00 . A A . 33 LEU CB 1 1 23 12611 1 1 12 LEU CD1 C -8.349 6.224 -6.016 1.00 . A A . 33 LEU CD1 1 1 23 12612 1 1 12 LEU CD2 C -6.486 4.644 -6.427 1.00 . A A . 33 LEU CD2 1 1 23 12613 1 1 12 LEU CG C -7.549 5.069 -5.412 1.00 . A A . 33 LEU CG 1 1 23 12614 1 1 12 LEU H H -7.460 3.644 -1.831 1.00 . A A . 33 LEU H 1 1 23 12615 1 1 12 LEU HA H -5.382 3.980 -3.870 1.00 . A A . 33 LEU HA 1 1 23 12616 1 1 12 LEU HB2 H -7.729 5.906 -3.444 1.00 . A A . 33 LEU HB2 1 1 23 12617 1 1 12 LEU HB3 H -6.258 6.351 -4.296 1.00 . A A . 33 LEU HB3 1 1 23 12618 1 1 12 LEU HD11 H -9.134 6.526 -5.323 1.00 . A A . 33 LEU HD11 1 1 23 12619 1 1 12 LEU HD12 H -7.696 7.074 -6.211 1.00 . A A . 33 LEU HD12 1 1 23 12620 1 1 12 LEU HD13 H -8.813 5.904 -6.949 1.00 . A A . 33 LEU HD13 1 1 23 12621 1 1 12 LEU HD21 H -5.790 5.465 -6.607 1.00 . A A . 33 LEU HD21 1 1 23 12622 1 1 12 LEU HD22 H -5.935 3.782 -6.056 1.00 . A A . 33 LEU HD22 1 1 23 12623 1 1 12 LEU HD23 H -6.966 4.370 -7.368 1.00 . A A . 33 LEU HD23 1 1 23 12624 1 1 12 LEU HG H -8.238 4.244 -5.243 1.00 . A A . 33 LEU HG 1 1 23 12625 1 1 12 LEU N N -7.103 3.456 -2.758 1.00 . A A . 33 LEU N 1 1 23 12626 1 1 12 LEU O O -5.942 5.004 -0.922 1.00 . A A . 33 LEU O 1 1 23 12627 1 1 13 SER C C -4.887 7.872 -0.662 1.00 . A A . 34 SER C 1 1 23 12628 1 1 13 SER CA C -3.880 6.926 -1.348 1.00 . A A . 34 SER CA 1 1 23 12629 1 1 13 SER CB C -2.828 7.781 -2.061 1.00 . A A . 34 SER CB 1 1 23 12630 1 1 13 SER H H -4.114 6.020 -3.261 1.00 . A A . 34 SER H 1 1 23 12631 1 1 13 SER HA H -3.383 6.348 -0.568 1.00 . A A . 34 SER HA 1 1 23 12632 1 1 13 SER HB2 H -3.327 8.436 -2.778 1.00 . A A . 34 SER HB2 1 1 23 12633 1 1 13 SER HB3 H -2.300 8.398 -1.332 1.00 . A A . 34 SER HB3 1 1 23 12634 1 1 13 SER HG H -1.363 7.524 -3.338 1.00 . A A . 34 SER HG 1 1 23 12635 1 1 13 SER N N -4.482 5.990 -2.320 1.00 . A A . 34 SER N 1 1 23 12636 1 1 13 SER O O -4.601 8.423 0.403 1.00 . A A . 34 SER O 1 1 23 12637 1 1 13 SER OG O -1.900 6.957 -2.751 1.00 . A A . 34 SER OG 1 1 23 12638 1 1 14 SER C C -8.220 8.030 0.064 1.00 . A A . 35 SER C 1 1 23 12639 1 1 14 SER CA C -7.195 8.855 -0.737 1.00 . A A . 35 SER CA 1 1 23 12640 1 1 14 SER CB C -7.901 9.546 -1.911 1.00 . A A . 35 SER CB 1 1 23 12641 1 1 14 SER H H -6.212 7.639 -2.167 1.00 . A A . 35 SER H 1 1 23 12642 1 1 14 SER HA H -6.814 9.631 -0.075 1.00 . A A . 35 SER HA 1 1 23 12643 1 1 14 SER HB2 H -8.772 10.093 -1.549 1.00 . A A . 35 SER HB2 1 1 23 12644 1 1 14 SER HB3 H -7.211 10.259 -2.369 1.00 . A A . 35 SER HB3 1 1 23 12645 1 1 14 SER HG H -8.751 9.063 -3.609 1.00 . A A . 35 SER HG 1 1 23 12646 1 1 14 SER N N -6.067 8.069 -1.264 1.00 . A A . 35 SER N 1 1 23 12647 1 1 14 SER O O -9.129 8.607 0.668 1.00 . A A . 35 SER O 1 1 23 12648 1 1 14 SER OG O -8.295 8.591 -2.886 1.00 . A A . 35 SER OG 1 1 23 12649 1 1 15 GLN C C -8.289 5.231 2.103 1.00 . A A . 36 GLN C 1 1 23 12650 1 1 15 GLN CA C -8.963 5.771 0.825 1.00 . A A . 36 GLN CA 1 1 23 12651 1 1 15 GLN CB C -9.344 4.620 -0.130 1.00 . A A . 36 GLN CB 1 1 23 12652 1 1 15 GLN CD C -11.884 4.514 0.045 1.00 . A A . 36 GLN CD 1 1 23 12653 1 1 15 GLN CG C -10.563 3.802 0.326 1.00 . A A . 36 GLN CG 1 1 23 12654 1 1 15 GLN H H -7.291 6.301 -0.393 1.00 . A A . 36 GLN H 1 1 23 12655 1 1 15 GLN HA H -9.875 6.291 1.117 1.00 . A A . 36 GLN HA 1 1 23 12656 1 1 15 GLN HB2 H -9.554 5.022 -1.122 1.00 . A A . 36 GLN HB2 1 1 23 12657 1 1 15 GLN HB3 H -8.490 3.945 -0.216 1.00 . A A . 36 GLN HB3 1 1 23 12658 1 1 15 GLN HE21 H -12.110 3.604 -1.758 1.00 . A A . 36 GLN HE21 1 1 23 12659 1 1 15 GLN HE22 H -13.378 4.731 -1.276 1.00 . A A . 36 GLN HE22 1 1 23 12660 1 1 15 GLN HG2 H -10.571 2.857 -0.214 1.00 . A A . 36 GLN HG2 1 1 23 12661 1 1 15 GLN HG3 H -10.489 3.573 1.389 1.00 . A A . 36 GLN HG3 1 1 23 12662 1 1 15 GLN N N -8.077 6.699 0.104 1.00 . A A . 36 GLN N 1 1 23 12663 1 1 15 GLN NE2 N -12.504 4.264 -1.090 1.00 . A A . 36 GLN NE2 1 1 23 12664 1 1 15 GLN O O -8.916 5.213 3.164 1.00 . A A . 36 GLN O 1 1 23 12665 1 1 15 GLN OE1 O -12.380 5.308 0.834 1.00 . A A . 36 GLN OE1 1 1 23 12666 1 1 16 CYS C C -4.684 4.945 2.884 1.00 . A A . 37 CYS C 1 1 23 12667 1 1 16 CYS CA C -6.120 4.409 3.078 1.00 . A A . 37 CYS CA 1 1 23 12668 1 1 16 CYS CB C -6.123 2.868 3.096 1.00 . A A . 37 CYS CB 1 1 23 12669 1 1 16 CYS H H -6.565 4.971 1.091 1.00 . A A . 37 CYS H 1 1 23 12670 1 1 16 CYS HA H -6.481 4.778 4.040 1.00 . A A . 37 CYS HA 1 1 23 12671 1 1 16 CYS HB2 H -6.085 2.488 2.075 1.00 . A A . 37 CYS HB2 1 1 23 12672 1 1 16 CYS HB3 H -5.228 2.508 3.600 1.00 . A A . 37 CYS HB3 1 1 23 12673 1 1 16 CYS N N -7.000 4.878 2.001 1.00 . A A . 37 CYS N 1 1 23 12674 1 1 16 CYS O O -4.337 5.485 1.830 1.00 . A A . 37 CYS O 1 1 23 12675 1 1 16 CYS SG S -7.575 2.231 3.979 1.00 . A A . 37 CYS SG 1 1 23 12676 1 1 17 ARG C C -1.593 4.608 2.743 1.00 . A A . 38 ARG C 1 1 23 12677 1 1 17 ARG CA C -2.414 5.185 3.903 1.00 . A A . 38 ARG CA 1 1 23 12678 1 1 17 ARG CB C -1.774 4.847 5.261 1.00 . A A . 38 ARG CB 1 1 23 12679 1 1 17 ARG CD C -2.790 5.007 7.626 1.00 . A A . 38 ARG CD 1 1 23 12680 1 1 17 ARG CG C -2.290 5.767 6.388 1.00 . A A . 38 ARG CG 1 1 23 12681 1 1 17 ARG CZ C -5.244 4.616 7.221 1.00 . A A . 38 ARG CZ 1 1 23 12682 1 1 17 ARG H H -4.192 4.309 4.730 1.00 . A A . 38 ARG H 1 1 23 12683 1 1 17 ARG HA H -2.376 6.268 3.766 1.00 . A A . 38 ARG HA 1 1 23 12684 1 1 17 ARG HB2 H -1.959 3.798 5.500 1.00 . A A . 38 ARG HB2 1 1 23 12685 1 1 17 ARG HB3 H -0.693 4.984 5.188 1.00 . A A . 38 ARG HB3 1 1 23 12686 1 1 17 ARG HD2 H -1.992 4.350 7.979 1.00 . A A . 38 ARG HD2 1 1 23 12687 1 1 17 ARG HD3 H -2.999 5.723 8.425 1.00 . A A . 38 ARG HD3 1 1 23 12688 1 1 17 ARG HE H -3.860 3.195 7.341 1.00 . A A . 38 ARG HE 1 1 23 12689 1 1 17 ARG HG2 H -1.471 6.419 6.698 1.00 . A A . 38 ARG HG2 1 1 23 12690 1 1 17 ARG HG3 H -3.089 6.410 6.020 1.00 . A A . 38 ARG HG3 1 1 23 12691 1 1 17 ARG HH11 H -4.868 6.557 7.509 1.00 . A A . 38 ARG HH11 1 1 23 12692 1 1 17 ARG HH12 H -6.536 6.157 7.211 1.00 . A A . 38 ARG HH12 1 1 23 12693 1 1 17 ARG HH21 H -5.993 2.778 6.932 1.00 . A A . 38 ARG HH21 1 1 23 12694 1 1 17 ARG HH22 H -7.137 4.075 6.833 1.00 . A A . 38 ARG HH22 1 1 23 12695 1 1 17 ARG N N -3.829 4.761 3.903 1.00 . A A . 38 ARG N 1 1 23 12696 1 1 17 ARG NE N -3.997 4.199 7.355 1.00 . A A . 38 ARG NE 1 1 23 12697 1 1 17 ARG NH1 N -5.575 5.874 7.298 1.00 . A A . 38 ARG NH1 1 1 23 12698 1 1 17 ARG NH2 N -6.193 3.761 6.982 1.00 . A A . 38 ARG NH2 1 1 23 12699 1 1 17 ARG O O -0.700 5.296 2.245 1.00 . A A . 38 ARG O 1 1 23 12700 1 1 18 ALA C C -2.313 1.692 0.493 1.00 . A A . 39 ALA C 1 1 23 12701 1 1 18 ALA CA C -1.404 2.822 1.031 1.00 . A A . 39 ALA CA 1 1 23 12702 1 1 18 ALA CB C 0.001 2.263 1.302 1.00 . A A . 39 ALA CB 1 1 23 12703 1 1 18 ALA H H -2.649 2.896 2.750 1.00 . A A . 39 ALA H 1 1 23 12704 1 1 18 ALA HA H -1.345 3.608 0.278 1.00 . A A . 39 ALA HA 1 1 23 12705 1 1 18 ALA HB1 H 0.669 3.056 1.639 1.00 . A A . 39 ALA HB1 1 1 23 12706 1 1 18 ALA HB2 H -0.060 1.486 2.063 1.00 . A A . 39 ALA HB2 1 1 23 12707 1 1 18 ALA HB3 H 0.414 1.823 0.395 1.00 . A A . 39 ALA HB3 1 1 23 12708 1 1 18 ALA N N -1.919 3.402 2.273 1.00 . A A . 39 ALA N 1 1 23 12709 1 1 18 ALA O O -3.070 1.091 1.262 1.00 . A A . 39 ALA O 1 1 23 12710 1 1 19 PRO C C -1.700 -1.088 -0.855 1.00 . A A . 40 PRO C 1 1 23 12711 1 1 19 PRO CA C -2.649 0.041 -1.307 1.00 . A A . 40 PRO CA 1 1 23 12712 1 1 19 PRO CB C -2.665 0.208 -2.830 1.00 . A A . 40 PRO CB 1 1 23 12713 1 1 19 PRO CD C -1.558 2.103 -1.867 1.00 . A A . 40 PRO CD 1 1 23 12714 1 1 19 PRO CG C -1.512 1.178 -3.085 1.00 . A A . 40 PRO CG 1 1 23 12715 1 1 19 PRO HA H -3.659 -0.184 -0.956 1.00 . A A . 40 PRO HA 1 1 23 12716 1 1 19 PRO HB2 H -2.530 -0.735 -3.361 1.00 . A A . 40 PRO HB2 1 1 23 12717 1 1 19 PRO HB3 H -3.604 0.677 -3.123 1.00 . A A . 40 PRO HB3 1 1 23 12718 1 1 19 PRO HD2 H -0.546 2.402 -1.595 1.00 . A A . 40 PRO HD2 1 1 23 12719 1 1 19 PRO HD3 H -2.160 2.982 -2.096 1.00 . A A . 40 PRO HD3 1 1 23 12720 1 1 19 PRO HG2 H -0.568 0.633 -3.096 1.00 . A A . 40 PRO HG2 1 1 23 12721 1 1 19 PRO HG3 H -1.648 1.731 -4.014 1.00 . A A . 40 PRO HG3 1 1 23 12722 1 1 19 PRO N N -2.206 1.340 -0.803 1.00 . A A . 40 PRO N 1 1 23 12723 1 1 19 PRO O O -0.610 -0.833 -0.336 1.00 . A A . 40 PRO O 1 1 23 12724 1 1 20 LYS C C 0.094 -3.687 -1.072 1.00 . A A . 41 LYS C 1 1 23 12725 1 1 20 LYS CA C -1.396 -3.592 -0.703 1.00 . A A . 41 LYS CA 1 1 23 12726 1 1 20 LYS CB C -2.205 -4.783 -1.257 1.00 . A A . 41 LYS CB 1 1 23 12727 1 1 20 LYS CD C -2.876 -7.210 -1.022 1.00 . A A . 41 LYS CD 1 1 23 12728 1 1 20 LYS CE C -2.721 -8.524 -0.242 1.00 . A A . 41 LYS CE 1 1 23 12729 1 1 20 LYS CG C -1.927 -6.106 -0.526 1.00 . A A . 41 LYS CG 1 1 23 12730 1 1 20 LYS H H -3.002 -2.449 -1.537 1.00 . A A . 41 LYS H 1 1 23 12731 1 1 20 LYS HA H -1.420 -3.640 0.384 1.00 . A A . 41 LYS HA 1 1 23 12732 1 1 20 LYS HB2 H -3.268 -4.563 -1.153 1.00 . A A . 41 LYS HB2 1 1 23 12733 1 1 20 LYS HB3 H -1.993 -4.903 -2.322 1.00 . A A . 41 LYS HB3 1 1 23 12734 1 1 20 LYS HD2 H -3.905 -6.866 -0.894 1.00 . A A . 41 LYS HD2 1 1 23 12735 1 1 20 LYS HD3 H -2.710 -7.390 -2.084 1.00 . A A . 41 LYS HD3 1 1 23 12736 1 1 20 LYS HE2 H -2.824 -8.316 0.827 1.00 . A A . 41 LYS HE2 1 1 23 12737 1 1 20 LYS HE3 H -3.544 -9.187 -0.528 1.00 . A A . 41 LYS HE3 1 1 23 12738 1 1 20 LYS HG2 H -0.896 -6.411 -0.700 1.00 . A A . 41 LYS HG2 1 1 23 12739 1 1 20 LYS HG3 H -2.080 -5.960 0.545 1.00 . A A . 41 LYS HG3 1 1 23 12740 1 1 20 LYS HZ1 H -1.315 -9.407 -1.497 1.00 . A A . 41 LYS HZ1 1 1 23 12741 1 1 20 LYS HZ2 H -0.640 -8.644 -0.214 1.00 . A A . 41 LYS HZ2 1 1 23 12742 1 1 20 LYS HZ3 H -1.372 -10.085 -0.017 1.00 . A A . 41 LYS HZ3 1 1 23 12743 1 1 20 LYS N N -2.088 -2.345 -1.107 1.00 . A A . 41 LYS N 1 1 23 12744 1 1 20 LYS NZ N -1.426 -9.205 -0.512 1.00 . A A . 41 LYS NZ 1 1 23 12745 1 1 20 LYS O O 0.832 -4.455 -0.456 1.00 . A A . 41 LYS O 1 1 23 12746 1 1 21 VAL C C 2.857 -2.305 -1.205 1.00 . A A . 42 VAL C 1 1 23 12747 1 1 21 VAL CA C 1.970 -2.688 -2.407 1.00 . A A . 42 VAL CA 1 1 23 12748 1 1 21 VAL CB C 2.062 -1.594 -3.497 1.00 . A A . 42 VAL CB 1 1 23 12749 1 1 21 VAL CG1 C 3.494 -1.361 -3.989 1.00 . A A . 42 VAL CG1 1 1 23 12750 1 1 21 VAL CG2 C 1.214 -1.948 -4.730 1.00 . A A . 42 VAL CG2 1 1 23 12751 1 1 21 VAL H H -0.134 -2.308 -2.492 1.00 . A A . 42 VAL H 1 1 23 12752 1 1 21 VAL HA H 2.358 -3.619 -2.819 1.00 . A A . 42 VAL HA 1 1 23 12753 1 1 21 VAL HB H 1.688 -0.656 -3.087 1.00 . A A . 42 VAL HB 1 1 23 12754 1 1 21 VAL HG11 H 3.918 -2.297 -4.352 1.00 . A A . 42 VAL HG11 1 1 23 12755 1 1 21 VAL HG12 H 3.499 -0.629 -4.795 1.00 . A A . 42 VAL HG12 1 1 23 12756 1 1 21 VAL HG13 H 4.113 -0.972 -3.182 1.00 . A A . 42 VAL HG13 1 1 23 12757 1 1 21 VAL HG21 H 1.533 -2.906 -5.141 1.00 . A A . 42 VAL HG21 1 1 23 12758 1 1 21 VAL HG22 H 0.157 -2.002 -4.471 1.00 . A A . 42 VAL HG22 1 1 23 12759 1 1 21 VAL HG23 H 1.330 -1.177 -5.493 1.00 . A A . 42 VAL HG23 1 1 23 12760 1 1 21 VAL N N 0.552 -2.887 -2.035 1.00 . A A . 42 VAL N 1 1 23 12761 1 1 21 VAL O O 4.023 -2.697 -1.153 1.00 . A A . 42 VAL O 1 1 23 12762 1 1 22 CYS C C 2.087 -0.867 2.134 1.00 . A A . 43 CYS C 1 1 23 12763 1 1 22 CYS CA C 3.009 -0.956 0.891 1.00 . A A . 43 CYS CA 1 1 23 12764 1 1 22 CYS CB C 3.508 0.415 0.388 1.00 . A A . 43 CYS CB 1 1 23 12765 1 1 22 CYS H H 1.316 -1.345 -0.319 1.00 . A A . 43 CYS H 1 1 23 12766 1 1 22 CYS HA H 3.875 -1.563 1.156 1.00 . A A . 43 CYS HA 1 1 23 12767 1 1 22 CYS HB2 H 3.983 0.276 -0.586 1.00 . A A . 43 CYS HB2 1 1 23 12768 1 1 22 CYS HB3 H 2.655 1.084 0.256 1.00 . A A . 43 CYS HB3 1 1 23 12769 1 1 22 CYS N N 2.304 -1.566 -0.238 1.00 . A A . 43 CYS N 1 1 23 12770 1 1 22 CYS O O 1.106 -1.602 2.256 1.00 . A A . 43 CYS O 1 1 23 12771 1 1 22 CYS SG S 4.717 1.157 1.516 1.00 . A A . 43 CYS SG 1 1 23 12772 1 1 23 PHE C C 1.612 2.012 4.398 1.00 . A A . 44 PHE C 1 1 23 12773 1 1 23 PHE CA C 1.600 0.479 4.194 1.00 . A A . 44 PHE CA 1 1 23 12774 1 1 23 PHE CB C 2.094 -0.234 5.465 1.00 . A A . 44 PHE CB 1 1 23 12775 1 1 23 PHE CD1 C 4.633 -0.052 5.459 1.00 . A A . 44 PHE CD1 1 1 23 12776 1 1 23 PHE CD2 C 3.370 1.207 7.117 1.00 . A A . 44 PHE CD2 1 1 23 12777 1 1 23 PHE CE1 C 5.831 0.482 5.968 1.00 . A A . 44 PHE CE1 1 1 23 12778 1 1 23 PHE CE2 C 4.569 1.741 7.626 1.00 . A A . 44 PHE CE2 1 1 23 12779 1 1 23 PHE CG C 3.397 0.310 6.030 1.00 . A A . 44 PHE CG 1 1 23 12780 1 1 23 PHE CZ C 5.800 1.379 7.050 1.00 . A A . 44 PHE CZ 1 1 23 12781 1 1 23 PHE H H 3.279 0.525 2.872 1.00 . A A . 44 PHE H 1 1 23 12782 1 1 23 PHE HA H 0.564 0.187 4.022 1.00 . A A . 44 PHE HA 1 1 23 12783 1 1 23 PHE HB2 H 1.320 -0.137 6.228 1.00 . A A . 44 PHE HB2 1 1 23 12784 1 1 23 PHE HB3 H 2.208 -1.300 5.261 1.00 . A A . 44 PHE HB3 1 1 23 12785 1 1 23 PHE HD1 H 4.667 -0.744 4.628 1.00 . A A . 44 PHE HD1 1 1 23 12786 1 1 23 PHE HD2 H 2.427 1.496 7.558 1.00 . A A . 44 PHE HD2 1 1 23 12787 1 1 23 PHE HE1 H 6.777 0.200 5.528 1.00 . A A . 44 PHE HE1 1 1 23 12788 1 1 23 PHE HE2 H 4.542 2.427 8.461 1.00 . A A . 44 PHE HE2 1 1 23 12789 1 1 23 PHE HZ H 6.723 1.785 7.443 1.00 . A A . 44 PHE HZ 1 1 23 12790 1 1 23 PHE N N 2.408 0.045 3.049 1.00 . A A . 44 PHE N 1 1 23 12791 1 1 23 PHE O O 0.746 2.535 5.102 1.00 . A A . 44 PHE O 1 1 23 12792 1 1 24 LYS C C 3.511 4.865 2.820 1.00 . A A . 45 LYS C 1 1 23 12793 1 1 24 LYS CA C 2.784 4.187 3.991 1.00 . A A . 45 LYS CA 1 1 23 12794 1 1 24 LYS CB C 3.573 4.367 5.306 1.00 . A A . 45 LYS CB 1 1 23 12795 1 1 24 LYS CD C 4.684 5.977 6.953 1.00 . A A . 45 LYS CD 1 1 23 12796 1 1 24 LYS CE C 6.102 5.401 6.811 1.00 . A A . 45 LYS CE 1 1 23 12797 1 1 24 LYS CG C 3.871 5.836 5.657 1.00 . A A . 45 LYS CG 1 1 23 12798 1 1 24 LYS H H 3.227 2.243 3.198 1.00 . A A . 45 LYS H 1 1 23 12799 1 1 24 LYS HA H 1.817 4.683 4.092 1.00 . A A . 45 LYS HA 1 1 23 12800 1 1 24 LYS HB2 H 2.993 3.937 6.124 1.00 . A A . 45 LYS HB2 1 1 23 12801 1 1 24 LYS HB3 H 4.509 3.812 5.232 1.00 . A A . 45 LYS HB3 1 1 23 12802 1 1 24 LYS HD2 H 4.756 7.039 7.196 1.00 . A A . 45 LYS HD2 1 1 23 12803 1 1 24 LYS HD3 H 4.160 5.474 7.767 1.00 . A A . 45 LYS HD3 1 1 23 12804 1 1 24 LYS HE2 H 6.032 4.328 6.611 1.00 . A A . 45 LYS HE2 1 1 23 12805 1 1 24 LYS HE3 H 6.585 5.869 5.948 1.00 . A A . 45 LYS HE3 1 1 23 12806 1 1 24 LYS HG2 H 4.428 6.312 4.850 1.00 . A A . 45 LYS HG2 1 1 23 12807 1 1 24 LYS HG3 H 2.924 6.366 5.779 1.00 . A A . 45 LYS HG3 1 1 23 12808 1 1 24 LYS HZ1 H 6.495 5.203 8.844 1.00 . A A . 45 LYS HZ1 1 1 23 12809 1 1 24 LYS HZ2 H 7.846 5.251 7.930 1.00 . A A . 45 LYS HZ2 1 1 23 12810 1 1 24 LYS HZ3 H 7.015 6.621 8.224 1.00 . A A . 45 LYS HZ3 1 1 23 12811 1 1 24 LYS N N 2.573 2.738 3.791 1.00 . A A . 45 LYS N 1 1 23 12812 1 1 24 LYS NZ N 6.915 5.633 8.033 1.00 . A A . 45 LYS NZ 1 1 23 12813 1 1 24 LYS O O 2.952 5.767 2.196 1.00 . A A . 45 LYS O 1 1 23 12814 1 1 25 CYS C C 5.365 4.951 0.133 1.00 . A A . 46 CYS C 1 1 23 12815 1 1 25 CYS CA C 5.681 5.134 1.634 1.00 . A A . 46 CYS CA 1 1 23 12816 1 1 25 CYS CB C 7.125 4.728 2.002 1.00 . A A . 46 CYS CB 1 1 23 12817 1 1 25 CYS H H 5.146 3.710 3.095 1.00 . A A . 46 CYS H 1 1 23 12818 1 1 25 CYS HA H 5.601 6.205 1.824 1.00 . A A . 46 CYS HA 1 1 23 12819 1 1 25 CYS HB2 H 7.762 4.802 1.118 1.00 . A A . 46 CYS HB2 1 1 23 12820 1 1 25 CYS HB3 H 7.500 5.451 2.731 1.00 . A A . 46 CYS HB3 1 1 23 12821 1 1 25 CYS N N 4.749 4.455 2.540 1.00 . A A . 46 CYS N 1 1 23 12822 1 1 25 CYS O O 5.559 5.894 -0.637 1.00 . A A . 46 CYS O 1 1 23 12823 1 1 25 CYS SG S 7.264 3.067 2.732 1.00 . A A . 46 CYS SG 1 1 23 12824 1 1 26 LYS C C 4.861 3.967 -2.867 1.00 . A A . 47 LYS C 1 1 23 12825 1 1 26 LYS CA C 4.171 3.476 -1.571 1.00 . A A . 47 LYS CA 1 1 23 12826 1 1 26 LYS CB C 2.665 3.817 -1.488 1.00 . A A . 47 LYS CB 1 1 23 12827 1 1 26 LYS CD C 0.860 5.564 -1.130 1.00 . A A . 47 LYS CD 1 1 23 12828 1 1 26 LYS CE C 0.593 6.991 -0.632 1.00 . A A . 47 LYS CE 1 1 23 12829 1 1 26 LYS CG C 2.362 5.311 -1.297 1.00 . A A . 47 LYS CG 1 1 23 12830 1 1 26 LYS H H 4.725 3.089 0.458 1.00 . A A . 47 LYS H 1 1 23 12831 1 1 26 LYS HA H 4.210 2.392 -1.667 1.00 . A A . 47 LYS HA 1 1 23 12832 1 1 26 LYS HB2 H 2.160 3.464 -2.390 1.00 . A A . 47 LYS HB2 1 1 23 12833 1 1 26 LYS HB3 H 2.241 3.270 -0.645 1.00 . A A . 47 LYS HB3 1 1 23 12834 1 1 26 LYS HD2 H 0.372 5.422 -2.095 1.00 . A A . 47 LYS HD2 1 1 23 12835 1 1 26 LYS HD3 H 0.436 4.853 -0.421 1.00 . A A . 47 LYS HD3 1 1 23 12836 1 1 26 LYS HE2 H 1.198 7.689 -1.218 1.00 . A A . 47 LYS HE2 1 1 23 12837 1 1 26 LYS HE3 H -0.458 7.226 -0.810 1.00 . A A . 47 LYS HE3 1 1 23 12838 1 1 26 LYS HG2 H 2.869 5.666 -0.405 1.00 . A A . 47 LYS HG2 1 1 23 12839 1 1 26 LYS HG3 H 2.731 5.879 -2.152 1.00 . A A . 47 LYS HG3 1 1 23 12840 1 1 26 LYS HZ1 H 1.830 6.839 1.052 1.00 . A A . 47 LYS HZ1 1 1 23 12841 1 1 26 LYS HZ2 H 0.767 8.090 1.128 1.00 . A A . 47 LYS HZ2 1 1 23 12842 1 1 26 LYS HZ3 H 0.267 6.547 1.369 1.00 . A A . 47 LYS HZ3 1 1 23 12843 1 1 26 LYS N N 4.810 3.794 -0.266 1.00 . A A . 47 LYS N 1 1 23 12844 1 1 26 LYS NZ N 0.887 7.136 0.819 1.00 . A A . 47 LYS NZ 1 1 23 12845 1 1 26 LYS O O 4.201 4.132 -3.894 1.00 . A A . 47 LYS O 1 1 23 12846 1 1 27 GLN C C 7.046 3.458 -5.097 1.00 . A A . 48 GLN C 1 1 23 12847 1 1 27 GLN CA C 6.966 4.583 -4.031 1.00 . A A . 48 GLN CA 1 1 23 12848 1 1 27 GLN CB C 8.378 5.025 -3.598 1.00 . A A . 48 GLN CB 1 1 23 12849 1 1 27 GLN CD C 7.668 7.435 -3.130 1.00 . A A . 48 GLN CD 1 1 23 12850 1 1 27 GLN CG C 8.405 6.202 -2.608 1.00 . A A . 48 GLN CG 1 1 23 12851 1 1 27 GLN H H 6.662 4.042 -1.976 1.00 . A A . 48 GLN H 1 1 23 12852 1 1 27 GLN HA H 6.456 5.436 -4.473 1.00 . A A . 48 GLN HA 1 1 23 12853 1 1 27 GLN HB2 H 8.888 4.182 -3.137 1.00 . A A . 48 GLN HB2 1 1 23 12854 1 1 27 GLN HB3 H 8.948 5.313 -4.482 1.00 . A A . 48 GLN HB3 1 1 23 12855 1 1 27 GLN HE21 H 6.125 7.180 -1.848 1.00 . A A . 48 GLN HE21 1 1 23 12856 1 1 27 GLN HE22 H 6.027 8.572 -2.934 1.00 . A A . 48 GLN HE22 1 1 23 12857 1 1 27 GLN HG2 H 7.979 5.890 -1.656 1.00 . A A . 48 GLN HG2 1 1 23 12858 1 1 27 GLN HG3 H 9.443 6.474 -2.419 1.00 . A A . 48 GLN HG3 1 1 23 12859 1 1 27 GLN N N 6.181 4.176 -2.851 1.00 . A A . 48 GLN N 1 1 23 12860 1 1 27 GLN NE2 N 6.513 7.759 -2.591 1.00 . A A . 48 GLN NE2 1 1 23 12861 1 1 27 GLN O O 6.999 2.282 -4.717 1.00 . A A . 48 GLN O 1 1 23 12862 1 1 27 GLN OE1 O 8.113 8.119 -4.045 1.00 . A A . 48 GLN OE1 1 1 23 12863 1 1 28 PRO C C 7.822 1.498 -7.520 1.00 . A A . 49 PRO C 1 1 23 12864 1 1 28 PRO CA C 7.061 2.840 -7.535 1.00 . A A . 49 PRO CA 1 1 23 12865 1 1 28 PRO CB C 7.458 3.641 -8.781 1.00 . A A . 49 PRO CB 1 1 23 12866 1 1 28 PRO CD C 7.382 5.132 -6.924 1.00 . A A . 49 PRO CD 1 1 23 12867 1 1 28 PRO CG C 7.070 5.067 -8.417 1.00 . A A . 49 PRO CG 1 1 23 12868 1 1 28 PRO HA H 5.999 2.606 -7.611 1.00 . A A . 49 PRO HA 1 1 23 12869 1 1 28 PRO HB2 H 8.537 3.589 -8.933 1.00 . A A . 49 PRO HB2 1 1 23 12870 1 1 28 PRO HB3 H 6.928 3.294 -9.670 1.00 . A A . 49 PRO HB3 1 1 23 12871 1 1 28 PRO HD2 H 8.415 5.450 -6.784 1.00 . A A . 49 PRO HD2 1 1 23 12872 1 1 28 PRO HD3 H 6.704 5.847 -6.457 1.00 . A A . 49 PRO HD3 1 1 23 12873 1 1 28 PRO HG2 H 7.642 5.802 -8.984 1.00 . A A . 49 PRO HG2 1 1 23 12874 1 1 28 PRO HG3 H 6.000 5.207 -8.574 1.00 . A A . 49 PRO HG3 1 1 23 12875 1 1 28 PRO N N 7.215 3.775 -6.402 1.00 . A A . 49 PRO N 1 1 23 12876 1 1 28 PRO O O 7.412 0.578 -8.231 1.00 . A A . 49 PRO O 1 1 23 12877 1 1 29 GLY C C 10.440 -0.143 -5.358 1.00 . A A . 50 GLY C 1 1 23 12878 1 1 29 GLY CA C 9.709 0.120 -6.682 1.00 . A A . 50 GLY CA 1 1 23 12879 1 1 29 GLY H H 9.240 2.179 -6.266 1.00 . A A . 50 GLY H 1 1 23 12880 1 1 29 GLY HA2 H 10.456 0.146 -7.476 1.00 . A A . 50 GLY HA2 1 1 23 12881 1 1 29 GLY HA3 H 9.061 -0.739 -6.862 1.00 . A A . 50 GLY HA3 1 1 23 12882 1 1 29 GLY N N 8.910 1.359 -6.752 1.00 . A A . 50 GLY N 1 1 23 12883 1 1 29 GLY O O 11.163 -1.133 -5.244 1.00 . A A . 50 GLY O 1 1 23 12884 1 1 30 HIS C C 10.577 -0.673 -2.254 1.00 . A A . 51 HIS C 1 1 23 12885 1 1 30 HIS CA C 10.938 0.606 -3.041 1.00 . A A . 51 HIS CA 1 1 23 12886 1 1 30 HIS CB C 10.596 1.848 -2.197 1.00 . A A . 51 HIS CB 1 1 23 12887 1 1 30 HIS CD2 C 9.060 1.519 -0.178 1.00 . A A . 51 HIS CD2 1 1 23 12888 1 1 30 HIS CE1 C 7.113 1.321 -1.174 1.00 . A A . 51 HIS CE1 1 1 23 12889 1 1 30 HIS CG C 9.248 1.755 -1.514 1.00 . A A . 51 HIS CG 1 1 23 12890 1 1 30 HIS H H 9.661 1.508 -4.497 1.00 . A A . 51 HIS H 1 1 23 12891 1 1 30 HIS HA H 12.016 0.596 -3.212 1.00 . A A . 51 HIS HA 1 1 23 12892 1 1 30 HIS HB2 H 11.359 1.950 -1.423 1.00 . A A . 51 HIS HB2 1 1 23 12893 1 1 30 HIS HB3 H 10.644 2.744 -2.815 1.00 . A A . 51 HIS HB3 1 1 23 12894 1 1 30 HIS HD1 H 7.791 1.759 -3.105 1.00 . A A . 51 HIS HD1 1 1 23 12895 1 1 30 HIS HD2 H 9.841 1.464 0.568 1.00 . A A . 51 HIS HD2 1 1 23 12896 1 1 30 HIS HE1 H 6.063 1.135 -1.357 1.00 . A A . 51 HIS HE1 1 1 23 12897 1 1 30 HIS N N 10.264 0.715 -4.345 1.00 . A A . 51 HIS N 1 1 23 12898 1 1 30 HIS ND1 N 8.011 1.639 -2.118 1.00 . A A . 51 HIS ND1 1 1 23 12899 1 1 30 HIS NE2 N 7.704 1.244 0.028 1.00 . A A . 51 HIS NE2 1 1 23 12900 1 1 30 HIS O O 11.370 -1.164 -1.451 1.00 . A A . 51 HIS O 1 1 23 12901 1 1 31 PHE C C 9.605 -3.555 -1.703 1.00 . A A . 52 PHE C 1 1 23 12902 1 1 31 PHE CA C 8.782 -2.265 -1.640 1.00 . A A . 52 PHE CA 1 1 23 12903 1 1 31 PHE CB C 7.309 -2.475 -2.030 1.00 . A A . 52 PHE CB 1 1 23 12904 1 1 31 PHE CD1 C 6.780 -1.546 -4.332 1.00 . A A . 52 PHE CD1 1 1 23 12905 1 1 31 PHE CD2 C 7.050 -3.954 -4.079 1.00 . A A . 52 PHE CD2 1 1 23 12906 1 1 31 PHE CE1 C 6.533 -1.719 -5.704 1.00 . A A . 52 PHE CE1 1 1 23 12907 1 1 31 PHE CE2 C 6.808 -4.123 -5.455 1.00 . A A . 52 PHE CE2 1 1 23 12908 1 1 31 PHE CG C 7.042 -2.664 -3.513 1.00 . A A . 52 PHE CG 1 1 23 12909 1 1 31 PHE CZ C 6.551 -3.006 -6.269 1.00 . A A . 52 PHE CZ 1 1 23 12910 1 1 31 PHE H H 8.772 -0.756 -3.141 1.00 . A A . 52 PHE H 1 1 23 12911 1 1 31 PHE HA H 8.796 -1.935 -0.602 1.00 . A A . 52 PHE HA 1 1 23 12912 1 1 31 PHE HB2 H 6.920 -3.335 -1.483 1.00 . A A . 52 PHE HB2 1 1 23 12913 1 1 31 PHE HB3 H 6.742 -1.608 -1.689 1.00 . A A . 52 PHE HB3 1 1 23 12914 1 1 31 PHE HD1 H 6.743 -0.553 -3.907 1.00 . A A . 52 PHE HD1 1 1 23 12915 1 1 31 PHE HD2 H 7.248 -4.818 -3.462 1.00 . A A . 52 PHE HD2 1 1 23 12916 1 1 31 PHE HE1 H 6.315 -0.862 -6.325 1.00 . A A . 52 PHE HE1 1 1 23 12917 1 1 31 PHE HE2 H 6.824 -5.114 -5.887 1.00 . A A . 52 PHE HE2 1 1 23 12918 1 1 31 PHE HZ H 6.361 -3.137 -7.325 1.00 . A A . 52 PHE HZ 1 1 23 12919 1 1 31 PHE N N 9.364 -1.198 -2.457 1.00 . A A . 52 PHE N 1 1 23 12920 1 1 31 PHE O O 9.881 -4.146 -0.661 1.00 . A A . 52 PHE O 1 1 23 12921 1 1 32 SER C C 12.308 -5.097 -2.302 1.00 . A A . 53 SER C 1 1 23 12922 1 1 32 SER CA C 10.988 -5.097 -3.102 1.00 . A A . 53 SER CA 1 1 23 12923 1 1 32 SER CB C 11.312 -5.221 -4.596 1.00 . A A . 53 SER CB 1 1 23 12924 1 1 32 SER H H 9.844 -3.401 -3.699 1.00 . A A . 53 SER H 1 1 23 12925 1 1 32 SER HA H 10.438 -5.989 -2.805 1.00 . A A . 53 SER HA 1 1 23 12926 1 1 32 SER HB2 H 11.897 -4.354 -4.914 1.00 . A A . 53 SER HB2 1 1 23 12927 1 1 32 SER HB3 H 11.901 -6.124 -4.767 1.00 . A A . 53 SER HB3 1 1 23 12928 1 1 32 SER HG H 10.360 -5.391 -6.303 1.00 . A A . 53 SER HG 1 1 23 12929 1 1 32 SER N N 10.118 -3.927 -2.880 1.00 . A A . 53 SER N 1 1 23 12930 1 1 32 SER O O 13.023 -6.102 -2.308 1.00 . A A . 53 SER O 1 1 23 12931 1 1 32 SER OG O 10.118 -5.291 -5.363 1.00 . A A . 53 SER OG 1 1 23 12932 1 1 33 LYS C C 13.517 -3.168 0.614 1.00 . A A . 54 LYS C 1 1 23 12933 1 1 33 LYS CA C 13.817 -3.829 -0.748 1.00 . A A . 54 LYS CA 1 1 23 12934 1 1 33 LYS CB C 14.927 -3.106 -1.541 1.00 . A A . 54 LYS CB 1 1 23 12935 1 1 33 LYS CD C 15.716 -0.927 -2.642 1.00 . A A . 54 LYS CD 1 1 23 12936 1 1 33 LYS CE C 16.104 -1.551 -3.990 1.00 . A A . 54 LYS CE 1 1 23 12937 1 1 33 LYS CG C 14.554 -1.674 -1.971 1.00 . A A . 54 LYS CG 1 1 23 12938 1 1 33 LYS H H 12.013 -3.197 -1.695 1.00 . A A . 54 LYS H 1 1 23 12939 1 1 33 LYS HA H 14.193 -4.821 -0.492 1.00 . A A . 54 LYS HA 1 1 23 12940 1 1 33 LYS HB2 H 15.831 -3.072 -0.932 1.00 . A A . 54 LYS HB2 1 1 23 12941 1 1 33 LYS HB3 H 15.152 -3.699 -2.429 1.00 . A A . 54 LYS HB3 1 1 23 12942 1 1 33 LYS HD2 H 15.409 0.108 -2.804 1.00 . A A . 54 LYS HD2 1 1 23 12943 1 1 33 LYS HD3 H 16.578 -0.928 -1.972 1.00 . A A . 54 LYS HD3 1 1 23 12944 1 1 33 LYS HE2 H 16.407 -2.589 -3.829 1.00 . A A . 54 LYS HE2 1 1 23 12945 1 1 33 LYS HE3 H 15.224 -1.554 -4.641 1.00 . A A . 54 LYS HE3 1 1 23 12946 1 1 33 LYS HG2 H 13.714 -1.707 -2.665 1.00 . A A . 54 LYS HG2 1 1 23 12947 1 1 33 LYS HG3 H 14.252 -1.104 -1.091 1.00 . A A . 54 LYS HG3 1 1 23 12948 1 1 33 LYS HZ1 H 16.951 0.162 -4.813 1.00 . A A . 54 LYS HZ1 1 1 23 12949 1 1 33 LYS HZ2 H 18.042 -0.800 -4.064 1.00 . A A . 54 LYS HZ2 1 1 23 12950 1 1 33 LYS HZ3 H 17.457 -1.212 -5.530 1.00 . A A . 54 LYS HZ3 1 1 23 12951 1 1 33 LYS N N 12.634 -3.993 -1.609 1.00 . A A . 54 LYS N 1 1 23 12952 1 1 33 LYS NZ N 17.210 -0.799 -4.639 1.00 . A A . 54 LYS NZ 1 1 23 12953 1 1 33 LYS O O 14.450 -2.752 1.303 1.00 . A A . 54 LYS O 1 1 23 12954 1 1 34 GLN C C 10.538 -3.135 2.887 1.00 . A A . 55 GLN C 1 1 23 12955 1 1 34 GLN CA C 11.846 -2.530 2.331 1.00 . A A . 55 GLN CA 1 1 23 12956 1 1 34 GLN CB C 11.724 -0.998 2.227 1.00 . A A . 55 GLN CB 1 1 23 12957 1 1 34 GLN CD C 11.293 1.144 3.507 1.00 . A A . 55 GLN CD 1 1 23 12958 1 1 34 GLN CG C 11.634 -0.338 3.613 1.00 . A A . 55 GLN CG 1 1 23 12959 1 1 34 GLN H H 11.532 -3.475 0.422 1.00 . A A . 55 GLN H 1 1 23 12960 1 1 34 GLN HA H 12.633 -2.761 3.049 1.00 . A A . 55 GLN HA 1 1 23 12961 1 1 34 GLN HB2 H 12.600 -0.593 1.717 1.00 . A A . 55 GLN HB2 1 1 23 12962 1 1 34 GLN HB3 H 10.843 -0.741 1.640 1.00 . A A . 55 GLN HB3 1 1 23 12963 1 1 34 GLN HE21 H 9.317 0.754 3.573 1.00 . A A . 55 GLN HE21 1 1 23 12964 1 1 34 GLN HE22 H 9.758 2.449 3.436 1.00 . A A . 55 GLN HE22 1 1 23 12965 1 1 34 GLN HG2 H 10.863 -0.827 4.209 1.00 . A A . 55 GLN HG2 1 1 23 12966 1 1 34 GLN HG3 H 12.586 -0.452 4.132 1.00 . A A . 55 GLN HG3 1 1 23 12967 1 1 34 GLN N N 12.240 -3.066 1.015 1.00 . A A . 55 GLN N 1 1 23 12968 1 1 34 GLN NE2 N 10.022 1.478 3.520 1.00 . A A . 55 GLN NE2 1 1 23 12969 1 1 34 GLN O O 10.530 -3.639 4.013 1.00 . A A . 55 GLN O 1 1 23 12970 1 1 34 GLN OE1 O 12.150 2.013 3.405 1.00 . A A . 55 GLN OE1 1 1 23 12971 1 1 35 CYS C C 7.559 -4.784 2.063 1.00 . A A . 56 CYS C 1 1 23 12972 1 1 35 CYS CA C 8.081 -3.411 2.560 1.00 . A A . 56 CYS CA 1 1 23 12973 1 1 35 CYS CB C 7.159 -2.254 2.126 1.00 . A A . 56 CYS CB 1 1 23 12974 1 1 35 CYS H H 9.541 -2.667 1.205 1.00 . A A . 56 CYS H 1 1 23 12975 1 1 35 CYS HA H 8.066 -3.445 3.649 1.00 . A A . 56 CYS HA 1 1 23 12976 1 1 35 CYS HB2 H 7.115 -2.204 1.036 1.00 . A A . 56 CYS HB2 1 1 23 12977 1 1 35 CYS HB3 H 6.150 -2.453 2.492 1.00 . A A . 56 CYS HB3 1 1 23 12978 1 1 35 CYS N N 9.449 -3.102 2.109 1.00 . A A . 56 CYS N 1 1 23 12979 1 1 35 CYS O O 6.448 -5.201 2.409 1.00 . A A . 56 CYS O 1 1 23 12980 1 1 35 CYS SG S 7.740 -0.669 2.801 1.00 . A A . 56 CYS SG 1 1 23 12981 1 1 36 ARG C C 9.314 -7.599 0.275 1.00 . A A . 57 ARG C 1 1 23 12982 1 1 36 ARG CA C 8.051 -6.764 0.583 1.00 . A A . 57 ARG CA 1 1 23 12983 1 1 36 ARG CB C 7.227 -6.465 -0.694 1.00 . A A . 57 ARG CB 1 1 23 12984 1 1 36 ARG CD C 5.241 -7.962 0.027 1.00 . A A . 57 ARG CD 1 1 23 12985 1 1 36 ARG CG C 6.220 -7.560 -1.093 1.00 . A A . 57 ARG CG 1 1 23 12986 1 1 36 ARG CZ C 3.564 -6.137 0.430 1.00 . A A . 57 ARG CZ 1 1 23 12987 1 1 36 ARG H H 9.192 -4.997 0.930 1.00 . A A . 57 ARG H 1 1 23 12988 1 1 36 ARG HA H 7.466 -7.358 1.283 1.00 . A A . 57 ARG HA 1 1 23 12989 1 1 36 ARG HB2 H 6.659 -5.544 -0.549 1.00 . A A . 57 ARG HB2 1 1 23 12990 1 1 36 ARG HB3 H 7.905 -6.281 -1.528 1.00 . A A . 57 ARG HB3 1 1 23 12991 1 1 36 ARG HD2 H 4.452 -8.585 -0.395 1.00 . A A . 57 ARG HD2 1 1 23 12992 1 1 36 ARG HD3 H 5.773 -8.578 0.754 1.00 . A A . 57 ARG HD3 1 1 23 12993 1 1 36 ARG HE H 5.228 -6.388 1.469 1.00 . A A . 57 ARG HE 1 1 23 12994 1 1 36 ARG HG2 H 5.641 -7.189 -1.940 1.00 . A A . 57 ARG HG2 1 1 23 12995 1 1 36 ARG HG3 H 6.755 -8.450 -1.424 1.00 . A A . 57 ARG HG3 1 1 23 12996 1 1 36 ARG HH11 H 3.009 -7.273 -1.124 1.00 . A A . 57 ARG HH11 1 1 23 12997 1 1 36 ARG HH12 H 1.953 -5.923 -0.720 1.00 . A A . 57 ARG HH12 1 1 23 12998 1 1 36 ARG HH21 H 3.799 -4.766 1.866 1.00 . A A . 57 ARG HH21 1 1 23 12999 1 1 36 ARG HH22 H 2.365 -4.606 0.860 1.00 . A A . 57 ARG HH22 1 1 23 13000 1 1 36 ARG N N 8.354 -5.479 1.238 1.00 . A A . 57 ARG N 1 1 23 13001 1 1 36 ARG NE N 4.671 -6.790 0.722 1.00 . A A . 57 ARG NE 1 1 23 13002 1 1 36 ARG NH1 N 2.776 -6.485 -0.546 1.00 . A A . 57 ARG NH1 1 1 23 13003 1 1 36 ARG NH2 N 3.211 -5.096 1.119 1.00 . A A . 57 ARG NH2 1 1 23 13004 1 1 36 ARG O O 9.284 -8.475 -0.593 1.00 . A A . 57 ARG O 1 1 23 13005 1 1 37 SER C C 11.704 -9.487 0.871 1.00 . A A . 58 SER C 1 1 23 13006 1 1 37 SER CA C 11.751 -7.952 0.838 1.00 . A A . 58 SER CA 1 1 23 13007 1 1 37 SER CB C 12.681 -7.455 1.946 1.00 . A A . 58 SER CB 1 1 23 13008 1 1 37 SER H H 10.356 -6.564 1.644 1.00 . A A . 58 SER H 1 1 23 13009 1 1 37 SER HA H 12.187 -7.663 -0.116 1.00 . A A . 58 SER HA 1 1 23 13010 1 1 37 SER HB2 H 12.305 -7.794 2.916 1.00 . A A . 58 SER HB2 1 1 23 13011 1 1 37 SER HB3 H 13.677 -7.878 1.796 1.00 . A A . 58 SER HB3 1 1 23 13012 1 1 37 SER HG H 13.337 -5.744 2.645 1.00 . A A . 58 SER HG 1 1 23 13013 1 1 37 SER N N 10.427 -7.304 0.963 1.00 . A A . 58 SER N 1 1 23 13014 1 1 37 SER O O 11.059 -10.057 1.781 1.00 . A A . 58 SER O 1 1 23 13015 1 1 37 SER OXT O 12.350 -10.117 0.001 1.00 . A A . 58 SER OXT 1 1 23 13016 1 1 37 SER OG O 12.748 -6.038 1.922 1.00 . A A . 58 SER OG 1 1 23 13017 2 2 1 ZN ZN ZN -8.465 0.308 3.497 1.00 . B A . 1059 ZN ZN 1 1 23 13018 3 2 1 ZN ZN ZN 6.850 1.091 1.899 1.00 . C A . 1060 ZN ZN 1 1 24 13019 1 1 1 GLN C C -6.356 -1.533 -4.543 1.00 . A A . 22 GLN C 1 1 24 13020 1 1 1 GLN CA C -6.161 -1.109 -5.998 1.00 . A A . 22 GLN CA 1 1 24 13021 1 1 1 GLN CB C -4.719 -0.619 -6.259 1.00 . A A . 22 GLN CB 1 1 24 13022 1 1 1 GLN CD C -3.712 -2.913 -6.822 1.00 . A A . 22 GLN CD 1 1 24 13023 1 1 1 GLN CG C -3.611 -1.650 -5.967 1.00 . A A . 22 GLN CG 1 1 24 13024 1 1 1 GLN H1 H -8.097 -0.428 -6.217 1.00 . A A . 22 GLN H1 1 1 24 13025 1 1 1 GLN H2 H -7.051 0.740 -5.752 1.00 . A A . 22 GLN H2 1 1 24 13026 1 1 1 GLN H3 H -7.055 0.218 -7.313 1.00 . A A . 22 GLN H3 1 1 24 13027 1 1 1 GLN HA H -6.347 -1.980 -6.625 1.00 . A A . 22 GLN HA 1 1 24 13028 1 1 1 GLN HB2 H -4.635 -0.321 -7.305 1.00 . A A . 22 GLN HB2 1 1 24 13029 1 1 1 GLN HB3 H -4.528 0.265 -5.648 1.00 . A A . 22 GLN HB3 1 1 24 13030 1 1 1 GLN HE21 H -1.877 -2.672 -7.645 1.00 . A A . 22 GLN HE21 1 1 24 13031 1 1 1 GLN HE22 H -2.796 -4.080 -8.158 1.00 . A A . 22 GLN HE22 1 1 24 13032 1 1 1 GLN HG2 H -2.646 -1.171 -6.142 1.00 . A A . 22 GLN HG2 1 1 24 13033 1 1 1 GLN HG3 H -3.639 -1.943 -4.918 1.00 . A A . 22 GLN HG3 1 1 24 13034 1 1 1 GLN N N -7.160 -0.069 -6.353 1.00 . A A . 22 GLN N 1 1 24 13035 1 1 1 GLN NE2 N -2.709 -3.241 -7.604 1.00 . A A . 22 GLN NE2 1 1 24 13036 1 1 1 GLN O O -6.509 -0.676 -3.678 1.00 . A A . 22 GLN O 1 1 24 13037 1 1 1 GLN OE1 O -4.703 -3.626 -6.796 1.00 . A A . 22 GLN OE1 1 1 24 13038 1 1 2 THR C C -5.907 -2.820 -1.783 1.00 . A A . 23 THR C 1 1 24 13039 1 1 2 THR CA C -6.704 -3.424 -2.947 1.00 . A A . 23 THR CA 1 1 24 13040 1 1 2 THR CB C -6.515 -4.950 -2.985 1.00 . A A . 23 THR CB 1 1 24 13041 1 1 2 THR CG2 C -7.102 -5.662 -1.764 1.00 . A A . 23 THR CG2 1 1 24 13042 1 1 2 THR H H -6.226 -3.501 -5.020 1.00 . A A . 23 THR H 1 1 24 13043 1 1 2 THR HA H -7.755 -3.229 -2.754 1.00 . A A . 23 THR HA 1 1 24 13044 1 1 2 THR HB H -5.453 -5.184 -3.066 1.00 . A A . 23 THR HB 1 1 24 13045 1 1 2 THR HG1 H -6.967 -6.412 -4.186 1.00 . A A . 23 THR HG1 1 1 24 13046 1 1 2 THR HG21 H -8.163 -5.433 -1.675 1.00 . A A . 23 THR HG21 1 1 24 13047 1 1 2 THR HG22 H -6.980 -6.741 -1.876 1.00 . A A . 23 THR HG22 1 1 24 13048 1 1 2 THR HG23 H -6.581 -5.354 -0.858 1.00 . A A . 23 THR HG23 1 1 24 13049 1 1 2 THR N N -6.376 -2.840 -4.265 1.00 . A A . 23 THR N 1 1 24 13050 1 1 2 THR O O -4.695 -2.628 -1.886 1.00 . A A . 23 THR O 1 1 24 13051 1 1 2 THR OG1 O -7.192 -5.469 -4.112 1.00 . A A . 23 THR OG1 1 1 24 13052 1 1 3 CYS C C -4.914 -2.807 1.198 1.00 . A A . 24 CYS C 1 1 24 13053 1 1 3 CYS CA C -6.043 -1.970 0.560 1.00 . A A . 24 CYS CA 1 1 24 13054 1 1 3 CYS CB C -7.210 -1.844 1.545 1.00 . A A . 24 CYS CB 1 1 24 13055 1 1 3 CYS H H -7.596 -2.676 -0.700 1.00 . A A . 24 CYS H 1 1 24 13056 1 1 3 CYS HA H -5.663 -0.971 0.338 1.00 . A A . 24 CYS HA 1 1 24 13057 1 1 3 CYS HB2 H -8.074 -1.426 1.037 1.00 . A A . 24 CYS HB2 1 1 24 13058 1 1 3 CYS HB3 H -7.477 -2.836 1.909 1.00 . A A . 24 CYS HB3 1 1 24 13059 1 1 3 CYS N N -6.595 -2.538 -0.671 1.00 . A A . 24 CYS N 1 1 24 13060 1 1 3 CYS O O -4.923 -4.041 1.132 1.00 . A A . 24 CYS O 1 1 24 13061 1 1 3 CYS SG S -6.739 -0.772 2.926 1.00 . A A . 24 CYS SG 1 1 24 13062 1 1 4 TYR C C -3.686 -3.418 4.084 1.00 . A A . 25 TYR C 1 1 24 13063 1 1 4 TYR CA C -3.049 -2.776 2.832 1.00 . A A . 25 TYR CA 1 1 24 13064 1 1 4 TYR CB C -1.964 -1.766 3.243 1.00 . A A . 25 TYR CB 1 1 24 13065 1 1 4 TYR CD1 C -3.378 -0.003 4.434 1.00 . A A . 25 TYR CD1 1 1 24 13066 1 1 4 TYR CD2 C -1.486 -0.990 5.609 1.00 . A A . 25 TYR CD2 1 1 24 13067 1 1 4 TYR CE1 C -3.683 0.765 5.573 1.00 . A A . 25 TYR CE1 1 1 24 13068 1 1 4 TYR CE2 C -1.780 -0.211 6.746 1.00 . A A . 25 TYR CE2 1 1 24 13069 1 1 4 TYR CG C -2.281 -0.889 4.447 1.00 . A A . 25 TYR CG 1 1 24 13070 1 1 4 TYR CZ C -2.885 0.666 6.730 1.00 . A A . 25 TYR CZ 1 1 24 13071 1 1 4 TYR H H -4.075 -1.130 1.930 1.00 . A A . 25 TYR H 1 1 24 13072 1 1 4 TYR HA H -2.563 -3.586 2.292 1.00 . A A . 25 TYR HA 1 1 24 13073 1 1 4 TYR HB2 H -1.072 -2.346 3.479 1.00 . A A . 25 TYR HB2 1 1 24 13074 1 1 4 TYR HB3 H -1.710 -1.130 2.394 1.00 . A A . 25 TYR HB3 1 1 24 13075 1 1 4 TYR HD1 H -4.002 0.081 3.556 1.00 . A A . 25 TYR HD1 1 1 24 13076 1 1 4 TYR HD2 H -0.648 -1.674 5.633 1.00 . A A . 25 TYR HD2 1 1 24 13077 1 1 4 TYR HE1 H -4.543 1.415 5.576 1.00 . A A . 25 TYR HE1 1 1 24 13078 1 1 4 TYR HE2 H -1.168 -0.292 7.631 1.00 . A A . 25 TYR HE2 1 1 24 13079 1 1 4 TYR HH H -2.606 1.224 8.573 1.00 . A A . 25 TYR HH 1 1 24 13080 1 1 4 TYR N N -4.006 -2.139 1.915 1.00 . A A . 25 TYR N 1 1 24 13081 1 1 4 TYR O O -3.030 -4.208 4.769 1.00 . A A . 25 TYR O 1 1 24 13082 1 1 4 TYR OH O -3.201 1.408 7.826 1.00 . A A . 25 TYR OH 1 1 24 13083 1 1 5 ASN C C -7.057 -3.963 5.436 1.00 . A A . 26 ASN C 1 1 24 13084 1 1 5 ASN CA C -5.624 -3.435 5.645 1.00 . A A . 26 ASN CA 1 1 24 13085 1 1 5 ASN CB C -5.624 -2.162 6.515 1.00 . A A . 26 ASN CB 1 1 24 13086 1 1 5 ASN CG C -6.426 -2.324 7.797 1.00 . A A . 26 ASN CG 1 1 24 13087 1 1 5 ASN H H -5.405 -2.424 3.778 1.00 . A A . 26 ASN H 1 1 24 13088 1 1 5 ASN HA H -5.070 -4.214 6.173 1.00 . A A . 26 ASN HA 1 1 24 13089 1 1 5 ASN HB2 H -4.598 -1.910 6.782 1.00 . A A . 26 ASN HB2 1 1 24 13090 1 1 5 ASN HB3 H -6.035 -1.326 5.949 1.00 . A A . 26 ASN HB3 1 1 24 13091 1 1 5 ASN HD21 H -8.103 -1.519 6.977 1.00 . A A . 26 ASN HD21 1 1 24 13092 1 1 5 ASN HD22 H -8.206 -2.017 8.659 1.00 . A A . 26 ASN HD22 1 1 24 13093 1 1 5 ASN N N -4.948 -3.091 4.388 1.00 . A A . 26 ASN N 1 1 24 13094 1 1 5 ASN ND2 N -7.673 -1.906 7.811 1.00 . A A . 26 ASN ND2 1 1 24 13095 1 1 5 ASN O O -7.431 -4.984 6.017 1.00 . A A . 26 ASN O 1 1 24 13096 1 1 5 ASN OD1 O -5.942 -2.832 8.799 1.00 . A A . 26 ASN OD1 1 1 24 13097 1 1 6 CYS C C -9.711 -4.628 3.555 1.00 . A A . 27 CYS C 1 1 24 13098 1 1 6 CYS CA C -9.299 -3.472 4.500 1.00 . A A . 27 CYS CA 1 1 24 13099 1 1 6 CYS CB C -9.916 -2.137 4.051 1.00 . A A . 27 CYS CB 1 1 24 13100 1 1 6 CYS H H -7.479 -2.438 4.184 1.00 . A A . 27 CYS H 1 1 24 13101 1 1 6 CYS HA H -9.692 -3.706 5.491 1.00 . A A . 27 CYS HA 1 1 24 13102 1 1 6 CYS HB2 H -9.609 -1.926 3.026 1.00 . A A . 27 CYS HB2 1 1 24 13103 1 1 6 CYS HB3 H -11.006 -2.232 4.064 1.00 . A A . 27 CYS HB3 1 1 24 13104 1 1 6 CYS N N -7.852 -3.275 4.613 1.00 . A A . 27 CYS N 1 1 24 13105 1 1 6 CYS O O -10.886 -4.998 3.514 1.00 . A A . 27 CYS O 1 1 24 13106 1 1 6 CYS SG S -9.415 -0.778 5.154 1.00 . A A . 27 CYS SG 1 1 24 13107 1 1 7 GLY C C -10.024 -5.974 0.728 1.00 . A A . 28 GLY C 1 1 24 13108 1 1 7 GLY CA C -9.005 -6.289 1.836 1.00 . A A . 28 GLY CA 1 1 24 13109 1 1 7 GLY H H -7.817 -4.868 2.907 1.00 . A A . 28 GLY H 1 1 24 13110 1 1 7 GLY HA2 H -9.352 -7.164 2.383 1.00 . A A . 28 GLY HA2 1 1 24 13111 1 1 7 GLY HA3 H -8.060 -6.541 1.353 1.00 . A A . 28 GLY HA3 1 1 24 13112 1 1 7 GLY N N -8.767 -5.191 2.787 1.00 . A A . 28 GLY N 1 1 24 13113 1 1 7 GLY O O -10.735 -6.873 0.270 1.00 . A A . 28 GLY O 1 1 24 13114 1 1 8 LYS C C -10.571 -3.479 -1.802 1.00 . A A . 29 LYS C 1 1 24 13115 1 1 8 LYS CA C -11.180 -4.155 -0.556 1.00 . A A . 29 LYS CA 1 1 24 13116 1 1 8 LYS CB C -12.020 -3.185 0.300 1.00 . A A . 29 LYS CB 1 1 24 13117 1 1 8 LYS CD C -14.356 -3.596 -0.662 1.00 . A A . 29 LYS CD 1 1 24 13118 1 1 8 LYS CE C -15.590 -2.900 -1.253 1.00 . A A . 29 LYS CE 1 1 24 13119 1 1 8 LYS CG C -13.242 -2.571 -0.402 1.00 . A A . 29 LYS CG 1 1 24 13120 1 1 8 LYS H H -9.486 -4.040 0.742 1.00 . A A . 29 LYS H 1 1 24 13121 1 1 8 LYS HA H -11.838 -4.966 -0.860 1.00 . A A . 29 LYS HA 1 1 24 13122 1 1 8 LYS HB2 H -12.369 -3.711 1.193 1.00 . A A . 29 LYS HB2 1 1 24 13123 1 1 8 LYS HB3 H -11.378 -2.376 0.643 1.00 . A A . 29 LYS HB3 1 1 24 13124 1 1 8 LYS HD2 H -14.004 -4.361 -1.354 1.00 . A A . 29 LYS HD2 1 1 24 13125 1 1 8 LYS HD3 H -14.630 -4.072 0.282 1.00 . A A . 29 LYS HD3 1 1 24 13126 1 1 8 LYS HE2 H -15.906 -2.107 -0.569 1.00 . A A . 29 LYS HE2 1 1 24 13127 1 1 8 LYS HE3 H -15.310 -2.432 -2.202 1.00 . A A . 29 LYS HE3 1 1 24 13128 1 1 8 LYS HG2 H -13.641 -1.786 0.242 1.00 . A A . 29 LYS HG2 1 1 24 13129 1 1 8 LYS HG3 H -12.939 -2.110 -1.343 1.00 . A A . 29 LYS HG3 1 1 24 13130 1 1 8 LYS HZ1 H -16.994 -4.288 -0.598 1.00 . A A . 29 LYS HZ1 1 1 24 13131 1 1 8 LYS HZ2 H -17.517 -3.389 -1.854 1.00 . A A . 29 LYS HZ2 1 1 24 13132 1 1 8 LYS HZ3 H -16.448 -4.594 -2.108 1.00 . A A . 29 LYS HZ3 1 1 24 13133 1 1 8 LYS N N -10.120 -4.700 0.314 1.00 . A A . 29 LYS N 1 1 24 13134 1 1 8 LYS NZ N -16.708 -3.857 -1.467 1.00 . A A . 29 LYS NZ 1 1 24 13135 1 1 8 LYS O O -9.847 -2.495 -1.629 1.00 . A A . 29 LYS O 1 1 24 13136 1 1 9 PRO C C -10.391 -1.938 -4.544 1.00 . A A . 30 PRO C 1 1 24 13137 1 1 9 PRO CA C -10.260 -3.449 -4.293 1.00 . A A . 30 PRO CA 1 1 24 13138 1 1 9 PRO CB C -10.952 -4.234 -5.412 1.00 . A A . 30 PRO CB 1 1 24 13139 1 1 9 PRO CD C -11.582 -5.189 -3.321 1.00 . A A . 30 PRO CD 1 1 24 13140 1 1 9 PRO CG C -11.247 -5.578 -4.758 1.00 . A A . 30 PRO CG 1 1 24 13141 1 1 9 PRO HA H -9.203 -3.705 -4.317 1.00 . A A . 30 PRO HA 1 1 24 13142 1 1 9 PRO HB2 H -11.894 -3.755 -5.688 1.00 . A A . 30 PRO HB2 1 1 24 13143 1 1 9 PRO HB3 H -10.310 -4.344 -6.286 1.00 . A A . 30 PRO HB3 1 1 24 13144 1 1 9 PRO HD2 H -12.650 -4.986 -3.240 1.00 . A A . 30 PRO HD2 1 1 24 13145 1 1 9 PRO HD3 H -11.301 -6.005 -2.654 1.00 . A A . 30 PRO HD3 1 1 24 13146 1 1 9 PRO HG2 H -12.077 -6.093 -5.243 1.00 . A A . 30 PRO HG2 1 1 24 13147 1 1 9 PRO HG3 H -10.349 -6.197 -4.771 1.00 . A A . 30 PRO HG3 1 1 24 13148 1 1 9 PRO N N -10.830 -3.970 -3.037 1.00 . A A . 30 PRO N 1 1 24 13149 1 1 9 PRO O O -9.500 -1.342 -5.155 1.00 . A A . 30 PRO O 1 1 24 13150 1 1 10 GLY C C -10.979 1.113 -3.441 1.00 . A A . 31 GLY C 1 1 24 13151 1 1 10 GLY CA C -11.796 0.114 -4.273 1.00 . A A . 31 GLY CA 1 1 24 13152 1 1 10 GLY H H -12.155 -1.869 -3.585 1.00 . A A . 31 GLY H 1 1 24 13153 1 1 10 GLY HA2 H -12.852 0.270 -4.051 1.00 . A A . 31 GLY HA2 1 1 24 13154 1 1 10 GLY HA3 H -11.639 0.356 -5.326 1.00 . A A . 31 GLY HA3 1 1 24 13155 1 1 10 GLY N N -11.465 -1.306 -4.062 1.00 . A A . 31 GLY N 1 1 24 13156 1 1 10 GLY O O -11.515 2.134 -3.001 1.00 . A A . 31 GLY O 1 1 24 13157 1 1 11 HIS C C -7.779 2.426 -3.273 1.00 . A A . 32 HIS C 1 1 24 13158 1 1 11 HIS CA C -8.788 1.654 -2.408 1.00 . A A . 32 HIS CA 1 1 24 13159 1 1 11 HIS CB C -8.107 0.807 -1.324 1.00 . A A . 32 HIS CB 1 1 24 13160 1 1 11 HIS CD2 C -8.632 1.361 1.119 1.00 . A A . 32 HIS CD2 1 1 24 13161 1 1 11 HIS CE1 C -10.479 0.209 1.397 1.00 . A A . 32 HIS CE1 1 1 24 13162 1 1 11 HIS CG C -8.918 0.737 -0.061 1.00 . A A . 32 HIS CG 1 1 24 13163 1 1 11 HIS H H -9.326 -0.028 -3.599 1.00 . A A . 32 HIS H 1 1 24 13164 1 1 11 HIS HA H -9.374 2.417 -1.896 1.00 . A A . 32 HIS HA 1 1 24 13165 1 1 11 HIS HB2 H -7.944 -0.206 -1.685 1.00 . A A . 32 HIS HB2 1 1 24 13166 1 1 11 HIS HB3 H -7.132 1.232 -1.079 1.00 . A A . 32 HIS HB3 1 1 24 13167 1 1 11 HIS HD1 H -10.499 -0.602 -0.553 1.00 . A A . 32 HIS HD1 1 1 24 13168 1 1 11 HIS HD2 H -7.784 2.006 1.293 1.00 . A A . 32 HIS HD2 1 1 24 13169 1 1 11 HIS HE1 H -11.359 -0.241 1.842 1.00 . A A . 32 HIS HE1 1 1 24 13170 1 1 11 HIS N N -9.701 0.817 -3.189 1.00 . A A . 32 HIS N 1 1 24 13171 1 1 11 HIS ND1 N -10.074 0.020 0.129 1.00 . A A . 32 HIS ND1 1 1 24 13172 1 1 11 HIS NE2 N -9.612 1.003 2.054 1.00 . A A . 32 HIS NE2 1 1 24 13173 1 1 11 HIS O O -7.484 2.077 -4.420 1.00 . A A . 32 HIS O 1 1 24 13174 1 1 12 LEU C C -5.607 5.190 -2.096 1.00 . A A . 33 LEU C 1 1 24 13175 1 1 12 LEU CA C -6.406 4.545 -3.247 1.00 . A A . 33 LEU CA 1 1 24 13176 1 1 12 LEU CB C -7.275 5.638 -3.921 1.00 . A A . 33 LEU CB 1 1 24 13177 1 1 12 LEU CD1 C -8.929 6.400 -5.643 1.00 . A A . 33 LEU CD1 1 1 24 13178 1 1 12 LEU CD2 C -7.111 4.874 -6.345 1.00 . A A . 33 LEU CD2 1 1 24 13179 1 1 12 LEU CG C -8.048 5.235 -5.191 1.00 . A A . 33 LEU CG 1 1 24 13180 1 1 12 LEU H H -7.532 3.657 -1.716 1.00 . A A . 33 LEU H 1 1 24 13181 1 1 12 LEU HA H -5.707 4.111 -3.961 1.00 . A A . 33 LEU HA 1 1 24 13182 1 1 12 LEU HB2 H -7.997 5.998 -3.183 1.00 . A A . 33 LEU HB2 1 1 24 13183 1 1 12 LEU HB3 H -6.635 6.483 -4.185 1.00 . A A . 33 LEU HB3 1 1 24 13184 1 1 12 LEU HD11 H -9.634 6.655 -4.851 1.00 . A A . 33 LEU HD11 1 1 24 13185 1 1 12 LEU HD12 H -8.314 7.271 -5.874 1.00 . A A . 33 LEU HD12 1 1 24 13186 1 1 12 LEU HD13 H -9.494 6.112 -6.529 1.00 . A A . 33 LEU HD13 1 1 24 13187 1 1 12 LEU HD21 H -6.450 5.712 -6.569 1.00 . A A . 33 LEU HD21 1 1 24 13188 1 1 12 LEU HD22 H -6.512 4.004 -6.084 1.00 . A A . 33 LEU HD22 1 1 24 13189 1 1 12 LEU HD23 H -7.696 4.633 -7.232 1.00 . A A . 33 LEU HD23 1 1 24 13190 1 1 12 LEU HG H -8.702 4.390 -4.977 1.00 . A A . 33 LEU HG 1 1 24 13191 1 1 12 LEU N N -7.282 3.515 -2.685 1.00 . A A . 33 LEU N 1 1 24 13192 1 1 12 LEU O O -5.962 5.024 -0.925 1.00 . A A . 33 LEU O 1 1 24 13193 1 1 13 SER C C -4.680 7.840 -0.638 1.00 . A A . 34 SER C 1 1 24 13194 1 1 13 SER CA C -3.844 6.866 -1.494 1.00 . A A . 34 SER CA 1 1 24 13195 1 1 13 SER CB C -2.816 7.680 -2.289 1.00 . A A . 34 SER CB 1 1 24 13196 1 1 13 SER H H -4.351 6.071 -3.403 1.00 . A A . 34 SER H 1 1 24 13197 1 1 13 SER HA H -3.305 6.214 -0.806 1.00 . A A . 34 SER HA 1 1 24 13198 1 1 13 SER HB2 H -3.339 8.343 -2.979 1.00 . A A . 34 SER HB2 1 1 24 13199 1 1 13 SER HB3 H -2.220 8.287 -1.605 1.00 . A A . 34 SER HB3 1 1 24 13200 1 1 13 SER HG H -1.421 7.352 -3.627 1.00 . A A . 34 SER HG 1 1 24 13201 1 1 13 SER N N -4.614 6.018 -2.429 1.00 . A A . 34 SER N 1 1 24 13202 1 1 13 SER O O -4.161 8.413 0.322 1.00 . A A . 34 SER O 1 1 24 13203 1 1 13 SER OG O -1.962 6.813 -3.019 1.00 . A A . 34 SER OG 1 1 24 13204 1 1 14 SER C C -8.067 8.037 0.427 1.00 . A A . 35 SER C 1 1 24 13205 1 1 14 SER CA C -6.939 8.853 -0.232 1.00 . A A . 35 SER CA 1 1 24 13206 1 1 14 SER CB C -7.536 9.912 -1.170 1.00 . A A . 35 SER CB 1 1 24 13207 1 1 14 SER H H -6.284 7.587 -1.819 1.00 . A A . 35 SER H 1 1 24 13208 1 1 14 SER HA H -6.426 9.381 0.572 1.00 . A A . 35 SER HA 1 1 24 13209 1 1 14 SER HB2 H -8.114 9.416 -1.954 1.00 . A A . 35 SER HB2 1 1 24 13210 1 1 14 SER HB3 H -8.206 10.561 -0.602 1.00 . A A . 35 SER HB3 1 1 24 13211 1 1 14 SER HG H -6.936 11.375 -2.333 1.00 . A A . 35 SER HG 1 1 24 13212 1 1 14 SER N N -5.967 8.019 -0.966 1.00 . A A . 35 SER N 1 1 24 13213 1 1 14 SER O O -8.941 8.613 1.079 1.00 . A A . 35 SER O 1 1 24 13214 1 1 14 SER OG O -6.514 10.702 -1.764 1.00 . A A . 35 SER OG 1 1 24 13215 1 1 15 GLN C C -8.352 5.190 2.230 1.00 . A A . 36 GLN C 1 1 24 13216 1 1 15 GLN CA C -8.987 5.778 0.950 1.00 . A A . 36 GLN CA 1 1 24 13217 1 1 15 GLN CB C -9.376 4.669 -0.045 1.00 . A A . 36 GLN CB 1 1 24 13218 1 1 15 GLN CD C -11.921 4.702 -0.168 1.00 . A A . 36 GLN CD 1 1 24 13219 1 1 15 GLN CG C -10.685 3.944 0.312 1.00 . A A . 36 GLN CG 1 1 24 13220 1 1 15 GLN H H -7.286 6.296 -0.231 1.00 . A A . 36 GLN H 1 1 24 13221 1 1 15 GLN HA H -9.890 6.319 1.235 1.00 . A A . 36 GLN HA 1 1 24 13222 1 1 15 GLN HB2 H -9.486 5.096 -1.045 1.00 . A A . 36 GLN HB2 1 1 24 13223 1 1 15 GLN HB3 H -8.567 3.942 -0.086 1.00 . A A . 36 GLN HB3 1 1 24 13224 1 1 15 GLN HE21 H -12.080 3.599 -1.870 1.00 . A A . 36 GLN HE21 1 1 24 13225 1 1 15 GLN HE22 H -13.278 4.868 -1.633 1.00 . A A . 36 GLN HE22 1 1 24 13226 1 1 15 GLN HG2 H -10.688 2.965 -0.163 1.00 . A A . 36 GLN HG2 1 1 24 13227 1 1 15 GLN HG3 H -10.747 3.783 1.388 1.00 . A A . 36 GLN HG3 1 1 24 13228 1 1 15 GLN N N -8.055 6.704 0.285 1.00 . A A . 36 GLN N 1 1 24 13229 1 1 15 GLN NE2 N -12.463 4.365 -1.321 1.00 . A A . 36 GLN NE2 1 1 24 13230 1 1 15 GLN O O -9.009 5.142 3.272 1.00 . A A . 36 GLN O 1 1 24 13231 1 1 15 GLN OE1 O -12.416 5.617 0.479 1.00 . A A . 36 GLN OE1 1 1 24 13232 1 1 16 CYS C C -4.734 5.002 2.996 1.00 . A A . 37 CYS C 1 1 24 13233 1 1 16 CYS CA C -6.161 4.469 3.259 1.00 . A A . 37 CYS CA 1 1 24 13234 1 1 16 CYS CB C -6.132 2.936 3.423 1.00 . A A . 37 CYS CB 1 1 24 13235 1 1 16 CYS H H -6.609 4.949 1.254 1.00 . A A . 37 CYS H 1 1 24 13236 1 1 16 CYS HA H -6.514 4.919 4.187 1.00 . A A . 37 CYS HA 1 1 24 13237 1 1 16 CYS HB2 H -6.102 2.453 2.445 1.00 . A A . 37 CYS HB2 1 1 24 13238 1 1 16 CYS HB3 H -5.218 2.645 3.937 1.00 . A A . 37 CYS HB3 1 1 24 13239 1 1 16 CYS N N -7.059 4.841 2.155 1.00 . A A . 37 CYS N 1 1 24 13240 1 1 16 CYS O O -4.431 5.516 1.915 1.00 . A A . 37 CYS O 1 1 24 13241 1 1 16 CYS SG S -7.536 2.353 4.412 1.00 . A A . 37 CYS SG 1 1 24 13242 1 1 17 ARG C C -1.651 4.629 2.744 1.00 . A A . 38 ARG C 1 1 24 13243 1 1 17 ARG CA C -2.421 5.239 3.922 1.00 . A A . 38 ARG CA 1 1 24 13244 1 1 17 ARG CB C -1.738 4.902 5.261 1.00 . A A . 38 ARG CB 1 1 24 13245 1 1 17 ARG CD C -2.598 5.081 7.682 1.00 . A A . 38 ARG CD 1 1 24 13246 1 1 17 ARG CG C -2.201 5.832 6.402 1.00 . A A . 38 ARG CG 1 1 24 13247 1 1 17 ARG CZ C -5.073 4.676 7.472 1.00 . A A . 38 ARG CZ 1 1 24 13248 1 1 17 ARG H H -4.179 4.418 4.838 1.00 . A A . 38 ARG H 1 1 24 13249 1 1 17 ARG HA H -2.368 6.319 3.771 1.00 . A A . 38 ARG HA 1 1 24 13250 1 1 17 ARG HB2 H -1.932 3.857 5.510 1.00 . A A . 38 ARG HB2 1 1 24 13251 1 1 17 ARG HB3 H -0.659 5.018 5.151 1.00 . A A . 38 ARG HB3 1 1 24 13252 1 1 17 ARG HD2 H -1.770 4.431 7.976 1.00 . A A . 38 ARG HD2 1 1 24 13253 1 1 17 ARG HD3 H -2.748 5.802 8.487 1.00 . A A . 38 ARG HD3 1 1 24 13254 1 1 17 ARG HE H -3.682 3.261 7.494 1.00 . A A . 38 ARG HE 1 1 24 13255 1 1 17 ARG HG2 H -1.383 6.511 6.641 1.00 . A A . 38 ARG HG2 1 1 24 13256 1 1 17 ARG HG3 H -3.041 6.445 6.076 1.00 . A A . 38 ARG HG3 1 1 24 13257 1 1 17 ARG HH11 H -4.686 6.620 7.728 1.00 . A A . 38 ARG HH11 1 1 24 13258 1 1 17 ARG HH12 H -6.370 6.212 7.559 1.00 . A A . 38 ARG HH12 1 1 24 13259 1 1 17 ARG HH21 H -5.831 2.835 7.239 1.00 . A A . 38 ARG HH21 1 1 24 13260 1 1 17 ARG HH22 H -6.988 4.127 7.227 1.00 . A A . 38 ARG HH22 1 1 24 13261 1 1 17 ARG N N -3.843 4.843 3.984 1.00 . A A . 38 ARG N 1 1 24 13262 1 1 17 ARG NE N -3.818 4.264 7.510 1.00 . A A . 38 ARG NE 1 1 24 13263 1 1 17 ARG NH1 N -5.403 5.933 7.573 1.00 . A A . 38 ARG NH1 1 1 24 13264 1 1 17 ARG NH2 N -6.034 3.817 7.310 1.00 . A A . 38 ARG NH2 1 1 24 13265 1 1 17 ARG O O -0.769 5.299 2.204 1.00 . A A . 38 ARG O 1 1 24 13266 1 1 18 ALA C C -2.357 1.629 0.579 1.00 . A A . 39 ALA C 1 1 24 13267 1 1 18 ALA CA C -1.466 2.784 1.098 1.00 . A A . 39 ALA CA 1 1 24 13268 1 1 18 ALA CB C -0.061 2.241 1.404 1.00 . A A . 39 ALA CB 1 1 24 13269 1 1 18 ALA H H -2.715 2.918 2.817 1.00 . A A . 39 ALA H 1 1 24 13270 1 1 18 ALA HA H -1.400 3.545 0.320 1.00 . A A . 39 ALA HA 1 1 24 13271 1 1 18 ALA HB1 H 0.599 3.048 1.722 1.00 . A A . 39 ALA HB1 1 1 24 13272 1 1 18 ALA HB2 H -0.128 1.490 2.190 1.00 . A A . 39 ALA HB2 1 1 24 13273 1 1 18 ALA HB3 H 0.365 1.772 0.517 1.00 . A A . 39 ALA HB3 1 1 24 13274 1 1 18 ALA N N -1.993 3.411 2.313 1.00 . A A . 39 ALA N 1 1 24 13275 1 1 18 ALA O O -3.103 1.027 1.357 1.00 . A A . 39 ALA O 1 1 24 13276 1 1 19 PRO C C -1.682 -1.169 -0.694 1.00 . A A . 40 PRO C 1 1 24 13277 1 1 19 PRO CA C -2.641 -0.068 -1.194 1.00 . A A . 40 PRO CA 1 1 24 13278 1 1 19 PRO CB C -2.618 0.056 -2.721 1.00 . A A . 40 PRO CB 1 1 24 13279 1 1 19 PRO CD C -1.584 2.004 -1.779 1.00 . A A . 40 PRO CD 1 1 24 13280 1 1 19 PRO CG C -1.491 1.057 -2.974 1.00 . A A . 40 PRO CG 1 1 24 13281 1 1 19 PRO HA H -3.654 -0.301 -0.865 1.00 . A A . 40 PRO HA 1 1 24 13282 1 1 19 PRO HB2 H -2.426 -0.897 -3.214 1.00 . A A . 40 PRO HB2 1 1 24 13283 1 1 19 PRO HB3 H -3.564 0.478 -3.065 1.00 . A A . 40 PRO HB3 1 1 24 13284 1 1 19 PRO HD2 H -0.586 2.339 -1.497 1.00 . A A . 40 PRO HD2 1 1 24 13285 1 1 19 PRO HD3 H -2.205 2.863 -2.042 1.00 . A A . 40 PRO HD3 1 1 24 13286 1 1 19 PRO HG2 H -0.530 0.538 -2.954 1.00 . A A . 40 PRO HG2 1 1 24 13287 1 1 19 PRO HG3 H -1.621 1.583 -3.920 1.00 . A A . 40 PRO HG3 1 1 24 13288 1 1 19 PRO N N -2.233 1.252 -0.710 1.00 . A A . 40 PRO N 1 1 24 13289 1 1 19 PRO O O -0.597 -0.885 -0.181 1.00 . A A . 40 PRO O 1 1 24 13290 1 1 20 LYS C C 0.142 -3.744 -0.859 1.00 . A A . 41 LYS C 1 1 24 13291 1 1 20 LYS CA C -1.342 -3.661 -0.469 1.00 . A A . 41 LYS CA 1 1 24 13292 1 1 20 LYS CB C -2.143 -4.882 -0.968 1.00 . A A . 41 LYS CB 1 1 24 13293 1 1 20 LYS CD C -2.702 -7.332 -0.681 1.00 . A A . 41 LYS CD 1 1 24 13294 1 1 20 LYS CE C -2.317 -8.625 0.052 1.00 . A A . 41 LYS CE 1 1 24 13295 1 1 20 LYS CG C -1.777 -6.188 -0.246 1.00 . A A . 41 LYS CG 1 1 24 13296 1 1 20 LYS H H -2.960 -2.571 -1.348 1.00 . A A . 41 LYS H 1 1 24 13297 1 1 20 LYS HA H -1.346 -3.670 0.619 1.00 . A A . 41 LYS HA 1 1 24 13298 1 1 20 LYS HB2 H -3.204 -4.696 -0.799 1.00 . A A . 41 LYS HB2 1 1 24 13299 1 1 20 LYS HB3 H -1.989 -5.003 -2.041 1.00 . A A . 41 LYS HB3 1 1 24 13300 1 1 20 LYS HD2 H -3.737 -7.073 -0.443 1.00 . A A . 41 LYS HD2 1 1 24 13301 1 1 20 LYS HD3 H -2.610 -7.481 -1.759 1.00 . A A . 41 LYS HD3 1 1 24 13302 1 1 20 LYS HE2 H -1.270 -8.854 -0.166 1.00 . A A . 41 LYS HE2 1 1 24 13303 1 1 20 LYS HE3 H -2.405 -8.457 1.130 1.00 . A A . 41 LYS HE3 1 1 24 13304 1 1 20 LYS HG2 H -0.748 -6.462 -0.479 1.00 . A A . 41 LYS HG2 1 1 24 13305 1 1 20 LYS HG3 H -1.871 -6.041 0.831 1.00 . A A . 41 LYS HG3 1 1 24 13306 1 1 20 LYS HZ1 H -4.153 -9.585 -0.148 1.00 . A A . 41 LYS HZ1 1 1 24 13307 1 1 20 LYS HZ2 H -3.102 -9.952 -1.346 1.00 . A A . 41 LYS HZ2 1 1 24 13308 1 1 20 LYS HZ3 H -2.917 -10.611 0.134 1.00 . A A . 41 LYS HZ3 1 1 24 13309 1 1 20 LYS N N -2.053 -2.438 -0.908 1.00 . A A . 41 LYS N 1 1 24 13310 1 1 20 LYS NZ N -3.180 -9.766 -0.355 1.00 . A A . 41 LYS NZ 1 1 24 13311 1 1 20 LYS O O 0.905 -4.463 -0.215 1.00 . A A . 41 LYS O 1 1 24 13312 1 1 21 VAL C C 2.879 -2.349 -1.098 1.00 . A A . 42 VAL C 1 1 24 13313 1 1 21 VAL CA C 1.976 -2.777 -2.270 1.00 . A A . 42 VAL CA 1 1 24 13314 1 1 21 VAL CB C 2.039 -1.722 -3.400 1.00 . A A . 42 VAL CB 1 1 24 13315 1 1 21 VAL CG1 C 3.457 -1.518 -3.943 1.00 . A A . 42 VAL CG1 1 1 24 13316 1 1 21 VAL CG2 C 1.151 -2.109 -4.594 1.00 . A A . 42 VAL CG2 1 1 24 13317 1 1 21 VAL H H -0.136 -2.441 -2.342 1.00 . A A . 42 VAL H 1 1 24 13318 1 1 21 VAL HA H 2.367 -3.718 -2.659 1.00 . A A . 42 VAL HA 1 1 24 13319 1 1 21 VAL HB H 1.685 -0.768 -3.010 1.00 . A A . 42 VAL HB 1 1 24 13320 1 1 21 VAL HG11 H 3.861 -2.470 -4.290 1.00 . A A . 42 VAL HG11 1 1 24 13321 1 1 21 VAL HG12 H 3.444 -0.811 -4.771 1.00 . A A . 42 VAL HG12 1 1 24 13322 1 1 21 VAL HG13 H 4.105 -1.110 -3.168 1.00 . A A . 42 VAL HG13 1 1 24 13323 1 1 21 VAL HG21 H 1.447 -3.087 -4.979 1.00 . A A . 42 VAL HG21 1 1 24 13324 1 1 21 VAL HG22 H 0.101 -2.139 -4.304 1.00 . A A . 42 VAL HG22 1 1 24 13325 1 1 21 VAL HG23 H 1.254 -1.369 -5.388 1.00 . A A . 42 VAL HG23 1 1 24 13326 1 1 21 VAL N N 0.568 -2.982 -1.866 1.00 . A A . 42 VAL N 1 1 24 13327 1 1 21 VAL O O 4.052 -2.722 -1.056 1.00 . A A . 42 VAL O 1 1 24 13328 1 1 22 CYS C C 2.137 -0.867 2.228 1.00 . A A . 43 CYS C 1 1 24 13329 1 1 22 CYS CA C 3.046 -0.967 0.977 1.00 . A A . 43 CYS CA 1 1 24 13330 1 1 22 CYS CB C 3.532 0.399 0.451 1.00 . A A . 43 CYS CB 1 1 24 13331 1 1 22 CYS H H 1.342 -1.390 -0.206 1.00 . A A . 43 CYS H 1 1 24 13332 1 1 22 CYS HA H 3.919 -1.567 1.240 1.00 . A A . 43 CYS HA 1 1 24 13333 1 1 22 CYS HB2 H 3.990 0.249 -0.527 1.00 . A A . 43 CYS HB2 1 1 24 13334 1 1 22 CYS HB3 H 2.676 1.065 0.331 1.00 . A A . 43 CYS HB3 1 1 24 13335 1 1 22 CYS N N 2.333 -1.596 -0.136 1.00 . A A . 43 CYS N 1 1 24 13336 1 1 22 CYS O O 1.179 -1.627 2.385 1.00 . A A . 43 CYS O 1 1 24 13337 1 1 22 CYS SG S 4.762 1.150 1.551 1.00 . A A . 43 CYS SG 1 1 24 13338 1 1 23 PHE C C 1.641 2.056 4.437 1.00 . A A . 44 PHE C 1 1 24 13339 1 1 23 PHE CA C 1.647 0.522 4.258 1.00 . A A . 44 PHE CA 1 1 24 13340 1 1 23 PHE CB C 2.155 -0.169 5.535 1.00 . A A . 44 PHE CB 1 1 24 13341 1 1 23 PHE CD1 C 4.692 0.027 5.513 1.00 . A A . 44 PHE CD1 1 1 24 13342 1 1 23 PHE CD2 C 3.429 1.321 7.143 1.00 . A A . 44 PHE CD2 1 1 24 13343 1 1 23 PHE CE1 C 5.888 0.586 5.999 1.00 . A A . 44 PHE CE1 1 1 24 13344 1 1 23 PHE CE2 C 4.626 1.878 7.630 1.00 . A A . 44 PHE CE2 1 1 24 13345 1 1 23 PHE CG C 3.457 0.396 6.081 1.00 . A A . 44 PHE CG 1 1 24 13346 1 1 23 PHE CZ C 5.855 1.512 7.056 1.00 . A A . 44 PHE CZ 1 1 24 13347 1 1 23 PHE H H 3.304 0.576 2.908 1.00 . A A . 44 PHE H 1 1 24 13348 1 1 23 PHE HA H 0.612 0.214 4.099 1.00 . A A . 44 PHE HA 1 1 24 13349 1 1 23 PHE HB2 H 1.387 -0.067 6.303 1.00 . A A . 44 PHE HB2 1 1 24 13350 1 1 23 PHE HB3 H 2.277 -1.236 5.346 1.00 . A A . 44 PHE HB3 1 1 24 13351 1 1 23 PHE HD1 H 4.726 -0.684 4.699 1.00 . A A . 44 PHE HD1 1 1 24 13352 1 1 23 PHE HD2 H 2.485 1.614 7.583 1.00 . A A . 44 PHE HD2 1 1 24 13353 1 1 23 PHE HE1 H 6.836 0.301 5.561 1.00 . A A . 44 PHE HE1 1 1 24 13354 1 1 23 PHE HE2 H 4.599 2.592 8.444 1.00 . A A . 44 PHE HE2 1 1 24 13355 1 1 23 PHE HZ H 6.777 1.942 7.429 1.00 . A A . 44 PHE HZ 1 1 24 13356 1 1 23 PHE N N 2.448 0.078 3.114 1.00 . A A . 44 PHE N 1 1 24 13357 1 1 23 PHE O O 0.759 2.579 5.122 1.00 . A A . 44 PHE O 1 1 24 13358 1 1 24 LYS C C 3.471 4.927 2.807 1.00 . A A . 45 LYS C 1 1 24 13359 1 1 24 LYS CA C 2.755 4.250 3.984 1.00 . A A . 45 LYS CA 1 1 24 13360 1 1 24 LYS CB C 3.508 4.506 5.309 1.00 . A A . 45 LYS CB 1 1 24 13361 1 1 24 LYS CD C 2.500 6.804 5.871 1.00 . A A . 45 LYS CD 1 1 24 13362 1 1 24 LYS CE C 2.880 8.215 6.339 1.00 . A A . 45 LYS CE 1 1 24 13363 1 1 24 LYS CG C 3.778 5.980 5.655 1.00 . A A . 45 LYS CG 1 1 24 13364 1 1 24 LYS H H 3.277 2.294 3.265 1.00 . A A . 45 LYS H 1 1 24 13365 1 1 24 LYS HA H 1.765 4.704 4.050 1.00 . A A . 45 LYS HA 1 1 24 13366 1 1 24 LYS HB2 H 2.936 4.070 6.130 1.00 . A A . 45 LYS HB2 1 1 24 13367 1 1 24 LYS HB3 H 4.469 3.990 5.277 1.00 . A A . 45 LYS HB3 1 1 24 13368 1 1 24 LYS HD2 H 1.936 6.867 4.939 1.00 . A A . 45 LYS HD2 1 1 24 13369 1 1 24 LYS HD3 H 1.884 6.319 6.633 1.00 . A A . 45 LYS HD3 1 1 24 13370 1 1 24 LYS HE2 H 3.493 8.130 7.242 1.00 . A A . 45 LYS HE2 1 1 24 13371 1 1 24 LYS HE3 H 3.492 8.689 5.565 1.00 . A A . 45 LYS HE3 1 1 24 13372 1 1 24 LYS HG2 H 4.365 6.003 6.574 1.00 . A A . 45 LYS HG2 1 1 24 13373 1 1 24 LYS HG3 H 4.377 6.441 4.867 1.00 . A A . 45 LYS HG3 1 1 24 13374 1 1 24 LYS HZ1 H 1.105 9.158 5.799 1.00 . A A . 45 LYS HZ1 1 1 24 13375 1 1 24 LYS HZ2 H 1.115 8.643 7.353 1.00 . A A . 45 LYS HZ2 1 1 24 13376 1 1 24 LYS HZ3 H 1.951 9.974 6.929 1.00 . A A . 45 LYS HZ3 1 1 24 13377 1 1 24 LYS N N 2.597 2.788 3.829 1.00 . A A . 45 LYS N 1 1 24 13378 1 1 24 LYS NZ N 1.683 9.048 6.622 1.00 . A A . 45 LYS NZ 1 1 24 13379 1 1 24 LYS O O 2.890 5.812 2.176 1.00 . A A . 45 LYS O 1 1 24 13380 1 1 25 CYS C C 5.303 4.963 0.084 1.00 . A A . 46 CYS C 1 1 24 13381 1 1 25 CYS CA C 5.608 5.224 1.575 1.00 . A A . 46 CYS CA 1 1 24 13382 1 1 25 CYS CB C 7.068 4.913 1.960 1.00 . A A . 46 CYS CB 1 1 24 13383 1 1 25 CYS H H 5.137 3.809 3.075 1.00 . A A . 46 CYS H 1 1 24 13384 1 1 25 CYS HA H 5.474 6.298 1.720 1.00 . A A . 46 CYS HA 1 1 24 13385 1 1 25 CYS HB2 H 7.725 5.162 1.124 1.00 . A A . 46 CYS HB2 1 1 24 13386 1 1 25 CYS HB3 H 7.343 5.557 2.798 1.00 . A A . 46 CYS HB3 1 1 24 13387 1 1 25 CYS N N 4.716 4.538 2.516 1.00 . A A . 46 CYS N 1 1 24 13388 1 1 25 CYS O O 5.481 5.873 -0.729 1.00 . A A . 46 CYS O 1 1 24 13389 1 1 25 CYS SG S 7.323 3.185 2.461 1.00 . A A . 46 CYS SG 1 1 24 13390 1 1 26 LYS C C 4.772 3.853 -2.871 1.00 . A A . 47 LYS C 1 1 24 13391 1 1 26 LYS CA C 4.116 3.400 -1.544 1.00 . A A . 47 LYS CA 1 1 24 13392 1 1 26 LYS CB C 2.605 3.717 -1.450 1.00 . A A . 47 LYS CB 1 1 24 13393 1 1 26 LYS CD C 0.776 5.454 -1.157 1.00 . A A . 47 LYS CD 1 1 24 13394 1 1 26 LYS CE C 0.494 6.896 -0.718 1.00 . A A . 47 LYS CE 1 1 24 13395 1 1 26 LYS CG C 2.283 5.214 -1.316 1.00 . A A . 47 LYS CG 1 1 24 13396 1 1 26 LYS H H 4.709 3.101 0.488 1.00 . A A . 47 LYS H 1 1 24 13397 1 1 26 LYS HA H 4.175 2.315 -1.601 1.00 . A A . 47 LYS HA 1 1 24 13398 1 1 26 LYS HB2 H 2.093 3.319 -2.327 1.00 . A A . 47 LYS HB2 1 1 24 13399 1 1 26 LYS HB3 H 2.203 3.201 -0.576 1.00 . A A . 47 LYS HB3 1 1 24 13400 1 1 26 LYS HD2 H 0.288 5.268 -2.116 1.00 . A A . 47 LYS HD2 1 1 24 13401 1 1 26 LYS HD3 H 0.364 4.767 -0.420 1.00 . A A . 47 LYS HD3 1 1 24 13402 1 1 26 LYS HE2 H 1.083 7.577 -1.340 1.00 . A A . 47 LYS HE2 1 1 24 13403 1 1 26 LYS HE3 H -0.562 7.107 -0.897 1.00 . A A . 47 LYS HE3 1 1 24 13404 1 1 26 LYS HG2 H 2.784 5.610 -0.437 1.00 . A A . 47 LYS HG2 1 1 24 13405 1 1 26 LYS HG3 H 2.644 5.754 -2.192 1.00 . A A . 47 LYS HG3 1 1 24 13406 1 1 26 LYS HZ1 H 1.750 6.832 0.959 1.00 . A A . 47 LYS HZ1 1 1 24 13407 1 1 26 LYS HZ2 H 0.669 8.071 0.994 1.00 . A A . 47 LYS HZ2 1 1 24 13408 1 1 26 LYS HZ3 H 0.193 6.532 1.304 1.00 . A A . 47 LYS HZ3 1 1 24 13409 1 1 26 LYS N N 4.770 3.781 -0.264 1.00 . A A . 47 LYS N 1 1 24 13410 1 1 26 LYS NZ N 0.800 7.106 0.722 1.00 . A A . 47 LYS NZ 1 1 24 13411 1 1 26 LYS O O 4.088 3.980 -3.887 1.00 . A A . 47 LYS O 1 1 24 13412 1 1 27 GLN C C 6.889 3.329 -5.155 1.00 . A A . 48 GLN C 1 1 24 13413 1 1 27 GLN CA C 6.836 4.468 -4.102 1.00 . A A . 48 GLN CA 1 1 24 13414 1 1 27 GLN CB C 8.258 4.922 -3.718 1.00 . A A . 48 GLN CB 1 1 24 13415 1 1 27 GLN CD C 7.563 7.345 -3.295 1.00 . A A . 48 GLN CD 1 1 24 13416 1 1 27 GLN CG C 8.306 6.122 -2.757 1.00 . A A . 48 GLN CG 1 1 24 13417 1 1 27 GLN H H 6.593 3.976 -2.024 1.00 . A A . 48 GLN H 1 1 24 13418 1 1 27 GLN HA H 6.310 5.314 -4.541 1.00 . A A . 48 GLN HA 1 1 24 13419 1 1 27 GLN HB2 H 8.781 4.090 -3.250 1.00 . A A . 48 GLN HB2 1 1 24 13420 1 1 27 GLN HB3 H 8.803 5.190 -4.623 1.00 . A A . 48 GLN HB3 1 1 24 13421 1 1 27 GLN HE21 H 6.037 7.119 -1.986 1.00 . A A . 48 GLN HE21 1 1 24 13422 1 1 27 GLN HE22 H 5.925 8.486 -3.099 1.00 . A A . 48 GLN HE22 1 1 24 13423 1 1 27 GLN HG2 H 7.897 5.834 -1.789 1.00 . A A . 48 GLN HG2 1 1 24 13424 1 1 27 GLN HG3 H 9.350 6.397 -2.595 1.00 . A A . 48 GLN HG3 1 1 24 13425 1 1 27 GLN N N 6.089 4.079 -2.893 1.00 . A A . 48 GLN N 1 1 24 13426 1 1 27 GLN NE2 N 6.415 7.680 -2.747 1.00 . A A . 48 GLN NE2 1 1 24 13427 1 1 27 GLN O O 6.871 2.157 -4.758 1.00 . A A . 48 GLN O 1 1 24 13428 1 1 27 GLN OE1 O 7.995 8.011 -4.228 1.00 . A A . 48 GLN OE1 1 1 24 13429 1 1 28 PRO C C 7.576 1.339 -7.570 1.00 . A A . 49 PRO C 1 1 24 13430 1 1 28 PRO CA C 6.802 2.673 -7.578 1.00 . A A . 49 PRO CA 1 1 24 13431 1 1 28 PRO CB C 7.139 3.453 -8.853 1.00 . A A . 49 PRO CB 1 1 24 13432 1 1 28 PRO CD C 7.128 4.978 -7.020 1.00 . A A . 49 PRO CD 1 1 24 13433 1 1 28 PRO CG C 6.758 4.885 -8.498 1.00 . A A . 49 PRO CG 1 1 24 13434 1 1 28 PRO HA H 5.740 2.429 -7.606 1.00 . A A . 49 PRO HA 1 1 24 13435 1 1 28 PRO HB2 H 8.212 3.407 -9.051 1.00 . A A . 49 PRO HB2 1 1 24 13436 1 1 28 PRO HB3 H 6.576 3.089 -9.712 1.00 . A A . 49 PRO HB3 1 1 24 13437 1 1 28 PRO HD2 H 8.163 5.309 -6.926 1.00 . A A . 49 PRO HD2 1 1 24 13438 1 1 28 PRO HD3 H 6.462 5.692 -6.538 1.00 . A A . 49 PRO HD3 1 1 24 13439 1 1 28 PRO HG2 H 7.302 5.612 -9.099 1.00 . A A . 49 PRO HG2 1 1 24 13440 1 1 28 PRO HG3 H 5.680 5.015 -8.614 1.00 . A A . 49 PRO HG3 1 1 24 13441 1 1 28 PRO N N 6.996 3.628 -6.470 1.00 . A A . 49 PRO N 1 1 24 13442 1 1 28 PRO O O 7.130 0.391 -8.221 1.00 . A A . 49 PRO O 1 1 24 13443 1 1 29 GLY C C 10.363 -0.196 -5.554 1.00 . A A . 50 GLY C 1 1 24 13444 1 1 29 GLY CA C 9.547 0.017 -6.835 1.00 . A A . 50 GLY CA 1 1 24 13445 1 1 29 GLY H H 9.068 2.077 -6.437 1.00 . A A . 50 GLY H 1 1 24 13446 1 1 29 GLY HA2 H 10.241 0.043 -7.675 1.00 . A A . 50 GLY HA2 1 1 24 13447 1 1 29 GLY HA3 H 8.909 -0.859 -6.954 1.00 . A A . 50 GLY HA3 1 1 24 13448 1 1 29 GLY N N 8.716 1.239 -6.874 1.00 . A A . 50 GLY N 1 1 24 13449 1 1 29 GLY O O 11.211 -1.091 -5.505 1.00 . A A . 50 GLY O 1 1 24 13450 1 1 30 HIS C C 10.538 -0.770 -2.430 1.00 . A A . 51 HIS C 1 1 24 13451 1 1 30 HIS CA C 10.852 0.515 -3.228 1.00 . A A . 51 HIS CA 1 1 24 13452 1 1 30 HIS CB C 10.516 1.751 -2.376 1.00 . A A . 51 HIS CB 1 1 24 13453 1 1 30 HIS CD2 C 9.065 1.384 -0.302 1.00 . A A . 51 HIS CD2 1 1 24 13454 1 1 30 HIS CE1 C 7.077 1.202 -1.218 1.00 . A A . 51 HIS CE1 1 1 24 13455 1 1 30 HIS CG C 9.198 1.639 -1.640 1.00 . A A . 51 HIS CG 1 1 24 13456 1 1 30 HIS H H 9.431 1.323 -4.609 1.00 . A A . 51 HIS H 1 1 24 13457 1 1 30 HIS HA H 11.924 0.524 -3.434 1.00 . A A . 51 HIS HA 1 1 24 13458 1 1 30 HIS HB2 H 11.305 1.873 -1.633 1.00 . A A . 51 HIS HB2 1 1 24 13459 1 1 30 HIS HB3 H 10.523 2.646 -2.999 1.00 . A A . 51 HIS HB3 1 1 24 13460 1 1 30 HIS HD1 H 7.675 1.662 -3.170 1.00 . A A . 51 HIS HD1 1 1 24 13461 1 1 30 HIS HD2 H 9.875 1.325 0.412 1.00 . A A . 51 HIS HD2 1 1 24 13462 1 1 30 HIS HE1 H 6.021 1.020 -1.360 1.00 . A A . 51 HIS HE1 1 1 24 13463 1 1 30 HIS N N 10.132 0.607 -4.509 1.00 . A A . 51 HIS N 1 1 24 13464 1 1 30 HIS ND1 N 7.937 1.529 -2.194 1.00 . A A . 51 HIS ND1 1 1 24 13465 1 1 30 HIS NE2 N 7.718 1.104 -0.044 1.00 . A A . 51 HIS NE2 1 1 24 13466 1 1 30 HIS O O 11.366 -1.244 -1.654 1.00 . A A . 51 HIS O 1 1 24 13467 1 1 31 PHE C C 9.548 -3.605 -1.640 1.00 . A A . 52 PHE C 1 1 24 13468 1 1 31 PHE CA C 8.742 -2.302 -1.679 1.00 . A A . 52 PHE CA 1 1 24 13469 1 1 31 PHE CB C 7.261 -2.530 -2.026 1.00 . A A . 52 PHE CB 1 1 24 13470 1 1 31 PHE CD1 C 6.732 -1.825 -4.407 1.00 . A A . 52 PHE CD1 1 1 24 13471 1 1 31 PHE CD2 C 6.921 -4.201 -3.908 1.00 . A A . 52 PHE CD2 1 1 24 13472 1 1 31 PHE CE1 C 6.461 -2.131 -5.751 1.00 . A A . 52 PHE CE1 1 1 24 13473 1 1 31 PHE CE2 C 6.653 -4.505 -5.254 1.00 . A A . 52 PHE CE2 1 1 24 13474 1 1 31 PHE CG C 6.968 -2.860 -3.479 1.00 . A A . 52 PHE CG 1 1 24 13475 1 1 31 PHE CZ C 6.426 -3.469 -6.177 1.00 . A A . 52 PHE CZ 1 1 24 13476 1 1 31 PHE H H 8.708 -0.879 -3.260 1.00 . A A . 52 PHE H 1 1 24 13477 1 1 31 PHE HA H 8.773 -1.889 -0.670 1.00 . A A . 52 PHE HA 1 1 24 13478 1 1 31 PHE HB2 H 6.874 -3.329 -1.392 1.00 . A A . 52 PHE HB2 1 1 24 13479 1 1 31 PHE HB3 H 6.708 -1.628 -1.762 1.00 . A A . 52 PHE HB3 1 1 24 13480 1 1 31 PHE HD1 H 6.736 -0.792 -4.088 1.00 . A A . 52 PHE HD1 1 1 24 13481 1 1 31 PHE HD2 H 7.097 -5.003 -3.204 1.00 . A A . 52 PHE HD2 1 1 24 13482 1 1 31 PHE HE1 H 6.266 -1.336 -6.458 1.00 . A A . 52 PHE HE1 1 1 24 13483 1 1 31 PHE HE2 H 6.628 -5.536 -5.580 1.00 . A A . 52 PHE HE2 1 1 24 13484 1 1 31 PHE HZ H 6.215 -3.703 -7.213 1.00 . A A . 52 PHE HZ 1 1 24 13485 1 1 31 PHE N N 9.322 -1.308 -2.586 1.00 . A A . 52 PHE N 1 1 24 13486 1 1 31 PHE O O 9.864 -4.081 -0.552 1.00 . A A . 52 PHE O 1 1 24 13487 1 1 32 SER C C 12.233 -5.188 -2.178 1.00 . A A . 53 SER C 1 1 24 13488 1 1 32 SER CA C 10.881 -5.291 -2.914 1.00 . A A . 53 SER CA 1 1 24 13489 1 1 32 SER CB C 11.148 -5.577 -4.398 1.00 . A A . 53 SER CB 1 1 24 13490 1 1 32 SER H H 9.694 -3.678 -3.649 1.00 . A A . 53 SER H 1 1 24 13491 1 1 32 SER HA H 10.352 -6.149 -2.496 1.00 . A A . 53 SER HA 1 1 24 13492 1 1 32 SER HB2 H 11.732 -4.759 -4.823 1.00 . A A . 53 SER HB2 1 1 24 13493 1 1 32 SER HB3 H 11.720 -6.501 -4.493 1.00 . A A . 53 SER HB3 1 1 24 13494 1 1 32 SER HG H 10.137 -5.900 -6.047 1.00 . A A . 53 SER HG 1 1 24 13495 1 1 32 SER N N 10.007 -4.107 -2.789 1.00 . A A . 53 SER N 1 1 24 13496 1 1 32 SER O O 12.984 -6.165 -2.133 1.00 . A A . 53 SER O 1 1 24 13497 1 1 32 SER OG O 9.928 -5.706 -5.113 1.00 . A A . 53 SER OG 1 1 24 13498 1 1 33 LYS C C 13.580 -3.056 0.474 1.00 . A A . 54 LYS C 1 1 24 13499 1 1 33 LYS CA C 13.806 -3.674 -0.921 1.00 . A A . 54 LYS CA 1 1 24 13500 1 1 33 LYS CB C 14.620 -2.724 -1.827 1.00 . A A . 54 LYS CB 1 1 24 13501 1 1 33 LYS CD C 15.727 -2.360 -4.115 1.00 . A A . 54 LYS CD 1 1 24 13502 1 1 33 LYS CE C 14.804 -1.225 -4.589 1.00 . A A . 54 LYS CE 1 1 24 13503 1 1 33 LYS CG C 14.991 -3.341 -3.190 1.00 . A A . 54 LYS CG 1 1 24 13504 1 1 33 LYS H H 11.886 -3.259 -1.729 1.00 . A A . 54 LYS H 1 1 24 13505 1 1 33 LYS HA H 14.388 -4.584 -0.757 1.00 . A A . 54 LYS HA 1 1 24 13506 1 1 33 LYS HB2 H 14.042 -1.814 -1.980 1.00 . A A . 54 LYS HB2 1 1 24 13507 1 1 33 LYS HB3 H 15.547 -2.453 -1.319 1.00 . A A . 54 LYS HB3 1 1 24 13508 1 1 33 LYS HD2 H 16.590 -1.945 -3.592 1.00 . A A . 54 LYS HD2 1 1 24 13509 1 1 33 LYS HD3 H 16.083 -2.915 -4.984 1.00 . A A . 54 LYS HD3 1 1 24 13510 1 1 33 LYS HE2 H 13.913 -1.664 -5.051 1.00 . A A . 54 LYS HE2 1 1 24 13511 1 1 33 LYS HE3 H 14.481 -0.644 -3.722 1.00 . A A . 54 LYS HE3 1 1 24 13512 1 1 33 LYS HG2 H 15.633 -4.205 -3.017 1.00 . A A . 54 LYS HG2 1 1 24 13513 1 1 33 LYS HG3 H 14.094 -3.682 -3.709 1.00 . A A . 54 LYS HG3 1 1 24 13514 1 1 33 LYS HZ1 H 15.785 -0.851 -6.385 1.00 . A A . 54 LYS HZ1 1 1 24 13515 1 1 33 LYS HZ2 H 14.879 0.406 -5.875 1.00 . A A . 54 LYS HZ2 1 1 24 13516 1 1 33 LYS HZ3 H 16.311 0.091 -5.159 1.00 . A A . 54 LYS HZ3 1 1 24 13517 1 1 33 LYS N N 12.552 -4.014 -1.613 1.00 . A A . 54 LYS N 1 1 24 13518 1 1 33 LYS NZ N 15.491 -0.337 -5.565 1.00 . A A . 54 LYS NZ 1 1 24 13519 1 1 33 LYS O O 14.552 -2.647 1.115 1.00 . A A . 54 LYS O 1 1 24 13520 1 1 34 GLN C C 10.713 -2.987 2.905 1.00 . A A . 55 GLN C 1 1 24 13521 1 1 34 GLN CA C 11.996 -2.402 2.273 1.00 . A A . 55 GLN CA 1 1 24 13522 1 1 34 GLN CB C 11.862 -0.873 2.125 1.00 . A A . 55 GLN CB 1 1 24 13523 1 1 34 GLN CD C 11.466 1.322 3.320 1.00 . A A . 55 GLN CD 1 1 24 13524 1 1 34 GLN CG C 11.788 -0.160 3.484 1.00 . A A . 55 GLN CG 1 1 24 13525 1 1 34 GLN H H 11.591 -3.381 0.399 1.00 . A A . 55 GLN H 1 1 24 13526 1 1 34 GLN HA H 12.816 -2.609 2.961 1.00 . A A . 55 GLN HA 1 1 24 13527 1 1 34 GLN HB2 H 12.727 -0.482 1.585 1.00 . A A . 55 GLN HB2 1 1 24 13528 1 1 34 GLN HB3 H 10.969 -0.643 1.543 1.00 . A A . 55 GLN HB3 1 1 24 13529 1 1 34 GLN HE21 H 9.486 0.968 3.440 1.00 . A A . 55 GLN HE21 1 1 24 13530 1 1 34 GLN HE22 H 9.955 2.649 3.216 1.00 . A A . 55 GLN HE22 1 1 24 13531 1 1 34 GLN HG2 H 11.015 -0.615 4.104 1.00 . A A . 55 GLN HG2 1 1 24 13532 1 1 34 GLN HG3 H 12.742 -0.266 4.001 1.00 . A A . 55 GLN HG3 1 1 24 13533 1 1 34 GLN N N 12.330 -2.972 0.955 1.00 . A A . 55 GLN N 1 1 24 13534 1 1 34 GLN NE2 N 10.201 1.678 3.338 1.00 . A A . 55 GLN NE2 1 1 24 13535 1 1 34 GLN O O 10.750 -3.438 4.053 1.00 . A A . 55 GLN O 1 1 24 13536 1 1 34 GLN OE1 O 12.335 2.171 3.166 1.00 . A A . 55 GLN OE1 1 1 24 13537 1 1 35 CYS C C 7.697 -4.661 2.262 1.00 . A A . 56 CYS C 1 1 24 13538 1 1 35 CYS CA C 8.241 -3.272 2.685 1.00 . A A . 56 CYS CA 1 1 24 13539 1 1 35 CYS CB C 7.309 -2.128 2.242 1.00 . A A . 56 CYS CB 1 1 24 13540 1 1 35 CYS H H 9.651 -2.607 1.240 1.00 . A A . 56 CYS H 1 1 24 13541 1 1 35 CYS HA H 8.269 -3.265 3.776 1.00 . A A . 56 CYS HA 1 1 24 13542 1 1 35 CYS HB2 H 7.244 -2.107 1.152 1.00 . A A . 56 CYS HB2 1 1 24 13543 1 1 35 CYS HB3 H 6.308 -2.320 2.636 1.00 . A A . 56 CYS HB3 1 1 24 13544 1 1 35 CYS N N 9.593 -2.989 2.172 1.00 . A A . 56 CYS N 1 1 24 13545 1 1 35 CYS O O 6.592 -5.055 2.656 1.00 . A A . 56 CYS O 1 1 24 13546 1 1 35 CYS SG S 7.898 -0.525 2.867 1.00 . A A . 56 CYS SG 1 1 24 13547 1 1 36 ARG C C 9.388 -7.571 0.570 1.00 . A A . 57 ARG C 1 1 24 13548 1 1 36 ARG CA C 8.139 -6.714 0.867 1.00 . A A . 57 ARG CA 1 1 24 13549 1 1 36 ARG CB C 7.283 -6.475 -0.399 1.00 . A A . 57 ARG CB 1 1 24 13550 1 1 36 ARG CD C 5.310 -7.919 0.454 1.00 . A A . 57 ARG CD 1 1 24 13551 1 1 36 ARG CG C 6.258 -7.584 -0.712 1.00 . A A . 57 ARG CG 1 1 24 13552 1 1 36 ARG CZ C 3.634 -6.079 0.773 1.00 . A A . 57 ARG CZ 1 1 24 13553 1 1 36 ARG H H 9.293 -4.933 1.091 1.00 . A A . 57 ARG H 1 1 24 13554 1 1 36 ARG HA H 7.570 -7.265 1.613 1.00 . A A . 57 ARG HA 1 1 24 13555 1 1 36 ARG HB2 H 6.723 -5.544 -0.290 1.00 . A A . 57 ARG HB2 1 1 24 13556 1 1 36 ARG HB3 H 7.938 -6.343 -1.261 1.00 . A A . 57 ARG HB3 1 1 24 13557 1 1 36 ARG HD2 H 4.512 -8.569 0.089 1.00 . A A . 57 ARG HD2 1 1 24 13558 1 1 36 ARG HD3 H 5.860 -8.487 1.206 1.00 . A A . 57 ARG HD3 1 1 24 13559 1 1 36 ARG HE H 5.323 -6.254 1.791 1.00 . A A . 57 ARG HE 1 1 24 13560 1 1 36 ARG HG2 H 5.660 -7.258 -1.564 1.00 . A A . 57 ARG HG2 1 1 24 13561 1 1 36 ARG HG3 H 6.782 -8.494 -1.006 1.00 . A A . 57 ARG HG3 1 1 24 13562 1 1 36 ARG HH11 H 3.038 -7.341 -0.664 1.00 . A A . 57 ARG HH11 1 1 24 13563 1 1 36 ARG HH12 H 1.993 -5.961 -0.348 1.00 . A A . 57 ARG HH12 1 1 24 13564 1 1 36 ARG HH21 H 3.894 -4.603 2.098 1.00 . A A . 57 ARG HH21 1 1 24 13565 1 1 36 ARG HH22 H 2.442 -4.520 1.108 1.00 . A A . 57 ARG HH22 1 1 24 13566 1 1 36 ARG N N 8.465 -5.397 1.449 1.00 . A A . 57 ARG N 1 1 24 13567 1 1 36 ARG NE N 4.750 -6.706 1.086 1.00 . A A . 57 ARG NE 1 1 24 13568 1 1 36 ARG NH1 N 2.825 -6.502 -0.154 1.00 . A A . 57 ARG NH1 1 1 24 13569 1 1 36 ARG NH2 N 3.294 -4.988 1.389 1.00 . A A . 57 ARG NH2 1 1 24 13570 1 1 36 ARG O O 9.327 -8.496 -0.241 1.00 . A A . 57 ARG O 1 1 24 13571 1 1 37 SER C C 11.789 -9.431 1.222 1.00 . A A . 58 SER C 1 1 24 13572 1 1 37 SER CA C 11.837 -7.903 1.077 1.00 . A A . 58 SER CA 1 1 24 13573 1 1 37 SER CB C 12.812 -7.330 2.109 1.00 . A A . 58 SER CB 1 1 24 13574 1 1 37 SER H H 10.476 -6.460 1.839 1.00 . A A . 58 SER H 1 1 24 13575 1 1 37 SER HA H 12.241 -7.687 0.086 1.00 . A A . 58 SER HA 1 1 24 13576 1 1 37 SER HB2 H 12.473 -7.591 3.114 1.00 . A A . 58 SER HB2 1 1 24 13577 1 1 37 SER HB3 H 13.800 -7.769 1.952 1.00 . A A . 58 SER HB3 1 1 24 13578 1 1 37 SER HG H 13.513 -5.575 2.637 1.00 . A A . 58 SER HG 1 1 24 13579 1 1 37 SER N N 10.522 -7.240 1.202 1.00 . A A . 58 SER N 1 1 24 13580 1 1 37 SER O O 11.170 -9.928 2.194 1.00 . A A . 58 SER O 1 1 24 13581 1 1 37 SER OXT O 12.402 -10.126 0.383 1.00 . A A . 58 SER OXT 1 1 24 13582 1 1 37 SER OG O 12.880 -5.918 1.974 1.00 . A A . 58 SER OG 1 1 24 13583 2 2 1 ZN ZN ZN -8.374 0.489 3.708 1.00 . B A . 1059 ZN ZN 1 1 24 13584 3 2 1 ZN ZN ZN 6.913 1.125 1.859 1.00 . C A . 1060 ZN ZN 1 1 25 13585 1 1 1 GLN C C -6.783 -1.513 -5.167 1.00 . A A . 22 GLN C 1 1 25 13586 1 1 1 GLN CA C -6.057 -0.877 -6.371 1.00 . A A . 22 GLN CA 1 1 25 13587 1 1 1 GLN CB C -4.646 -0.319 -6.021 1.00 . A A . 22 GLN CB 1 1 25 13588 1 1 1 GLN CD C -3.989 1.303 -7.918 1.00 . A A . 22 GLN CD 1 1 25 13589 1 1 1 GLN CG C -3.720 -0.027 -7.220 1.00 . A A . 22 GLN CG 1 1 25 13590 1 1 1 GLN H1 H -7.824 -0.239 -7.233 1.00 . A A . 22 GLN H1 1 1 25 13591 1 1 1 GLN H2 H -7.090 0.904 -6.313 1.00 . A A . 22 GLN H2 1 1 25 13592 1 1 1 GLN H3 H -6.502 0.554 -7.805 1.00 . A A . 22 GLN H3 1 1 25 13593 1 1 1 GLN HA H -5.921 -1.679 -7.100 1.00 . A A . 22 GLN HA 1 1 25 13594 1 1 1 GLN HB2 H -4.731 0.574 -5.404 1.00 . A A . 22 GLN HB2 1 1 25 13595 1 1 1 GLN HB3 H -4.118 -1.065 -5.428 1.00 . A A . 22 GLN HB3 1 1 25 13596 1 1 1 GLN HE21 H -2.206 2.110 -7.395 1.00 . A A . 22 GLN HE21 1 1 25 13597 1 1 1 GLN HE22 H -3.289 3.123 -8.341 1.00 . A A . 22 GLN HE22 1 1 25 13598 1 1 1 GLN HG2 H -2.691 -0.020 -6.852 1.00 . A A . 22 GLN HG2 1 1 25 13599 1 1 1 GLN HG3 H -3.792 -0.835 -7.949 1.00 . A A . 22 GLN HG3 1 1 25 13600 1 1 1 GLN N N -6.932 0.160 -6.980 1.00 . A A . 22 GLN N 1 1 25 13601 1 1 1 GLN NE2 N -3.085 2.255 -7.870 1.00 . A A . 22 GLN NE2 1 1 25 13602 1 1 1 GLN O O -7.991 -1.320 -5.007 1.00 . A A . 22 GLN O 1 1 25 13603 1 1 1 GLN OE1 O -5.033 1.514 -8.516 1.00 . A A . 22 GLN OE1 1 1 25 13604 1 1 2 THR C C -5.917 -2.657 -1.892 1.00 . A A . 23 THR C 1 1 25 13605 1 1 2 THR CA C -6.621 -3.053 -3.192 1.00 . A A . 23 THR CA 1 1 25 13606 1 1 2 THR CB C -6.434 -4.558 -3.468 1.00 . A A . 23 THR CB 1 1 25 13607 1 1 2 THR CG2 C -7.023 -5.480 -2.400 1.00 . A A . 23 THR CG2 1 1 25 13608 1 1 2 THR H H -5.083 -2.373 -4.490 1.00 . A A . 23 THR H 1 1 25 13609 1 1 2 THR HA H -7.686 -2.857 -3.084 1.00 . A A . 23 THR HA 1 1 25 13610 1 1 2 THR HB H -5.366 -4.768 -3.562 1.00 . A A . 23 THR HB 1 1 25 13611 1 1 2 THR HG1 H -6.823 -5.803 -4.910 1.00 . A A . 23 THR HG1 1 1 25 13612 1 1 2 THR HG21 H -8.092 -5.306 -2.301 1.00 . A A . 23 THR HG21 1 1 25 13613 1 1 2 THR HG22 H -6.856 -6.520 -2.683 1.00 . A A . 23 THR HG22 1 1 25 13614 1 1 2 THR HG23 H -6.533 -5.310 -1.440 1.00 . A A . 23 THR HG23 1 1 25 13615 1 1 2 THR N N -6.074 -2.267 -4.319 1.00 . A A . 23 THR N 1 1 25 13616 1 1 2 THR O O -4.718 -2.377 -1.905 1.00 . A A . 23 THR O 1 1 25 13617 1 1 2 THR OG1 O -7.073 -4.891 -4.685 1.00 . A A . 23 THR OG1 1 1 25 13618 1 1 3 CYS C C -5.033 -2.913 1.142 1.00 . A A . 24 CYS C 1 1 25 13619 1 1 3 CYS CA C -6.167 -2.086 0.505 1.00 . A A . 24 CYS CA 1 1 25 13620 1 1 3 CYS CB C -7.356 -2.025 1.466 1.00 . A A . 24 CYS CB 1 1 25 13621 1 1 3 CYS H H -7.636 -2.834 -0.846 1.00 . A A . 24 CYS H 1 1 25 13622 1 1 3 CYS HA H -5.806 -1.068 0.340 1.00 . A A . 24 CYS HA 1 1 25 13623 1 1 3 CYS HB2 H -8.235 -1.642 0.949 1.00 . A A . 24 CYS HB2 1 1 25 13624 1 1 3 CYS HB3 H -7.580 -3.028 1.834 1.00 . A A . 24 CYS HB3 1 1 25 13625 1 1 3 CYS N N -6.651 -2.597 -0.778 1.00 . A A . 24 CYS N 1 1 25 13626 1 1 3 CYS O O -5.014 -4.144 1.063 1.00 . A A . 24 CYS O 1 1 25 13627 1 1 3 CYS SG S -6.910 -0.930 2.837 1.00 . A A . 24 CYS SG 1 1 25 13628 1 1 4 TYR C C -3.807 -3.478 4.051 1.00 . A A . 25 TYR C 1 1 25 13629 1 1 4 TYR CA C -3.180 -2.840 2.793 1.00 . A A . 25 TYR CA 1 1 25 13630 1 1 4 TYR CB C -2.120 -1.797 3.196 1.00 . A A . 25 TYR CB 1 1 25 13631 1 1 4 TYR CD1 C -3.591 -0.028 4.306 1.00 . A A . 25 TYR CD1 1 1 25 13632 1 1 4 TYR CD2 C -1.708 -0.944 5.550 1.00 . A A . 25 TYR CD2 1 1 25 13633 1 1 4 TYR CE1 C -3.945 0.757 5.419 1.00 . A A . 25 TYR CE1 1 1 25 13634 1 1 4 TYR CE2 C -2.048 -0.144 6.659 1.00 . A A . 25 TYR CE2 1 1 25 13635 1 1 4 TYR CG C -2.479 -0.892 4.369 1.00 . A A . 25 TYR CG 1 1 25 13636 1 1 4 TYR CZ C -3.174 0.703 6.597 1.00 . A A . 25 TYR CZ 1 1 25 13637 1 1 4 TYR H H -4.248 -1.224 1.896 1.00 . A A . 25 TYR H 1 1 25 13638 1 1 4 TYR HA H -2.675 -3.641 2.258 1.00 . A A . 25 TYR HA 1 1 25 13639 1 1 4 TYR HB2 H -1.220 -2.352 3.461 1.00 . A A . 25 TYR HB2 1 1 25 13640 1 1 4 TYR HB3 H -1.866 -1.180 2.333 1.00 . A A . 25 TYR HB3 1 1 25 13641 1 1 4 TYR HD1 H -4.196 0.023 3.413 1.00 . A A . 25 TYR HD1 1 1 25 13642 1 1 4 TYR HD2 H -0.858 -1.610 5.611 1.00 . A A . 25 TYR HD2 1 1 25 13643 1 1 4 TYR HE1 H -4.822 1.382 5.386 1.00 . A A . 25 TYR HE1 1 1 25 13644 1 1 4 TYR HE2 H -1.456 -0.191 7.563 1.00 . A A . 25 TYR HE2 1 1 25 13645 1 1 4 TYR HH H -2.963 1.313 8.434 1.00 . A A . 25 TYR HH 1 1 25 13646 1 1 4 TYR N N -4.147 -2.228 1.872 1.00 . A A . 25 TYR N 1 1 25 13647 1 1 4 TYR O O -3.147 -4.284 4.712 1.00 . A A . 25 TYR O 1 1 25 13648 1 1 4 TYR OH O -3.544 1.455 7.668 1.00 . A A . 25 TYR OH 1 1 25 13649 1 1 5 ASN C C -7.153 -3.850 5.628 1.00 . A A . 26 ASN C 1 1 25 13650 1 1 5 ASN CA C -5.664 -3.449 5.701 1.00 . A A . 26 ASN CA 1 1 25 13651 1 1 5 ASN CB C -5.475 -2.214 6.601 1.00 . A A . 26 ASN CB 1 1 25 13652 1 1 5 ASN CG C -6.073 -2.408 7.985 1.00 . A A . 26 ASN CG 1 1 25 13653 1 1 5 ASN H H -5.531 -2.461 3.804 1.00 . A A . 26 ASN H 1 1 25 13654 1 1 5 ASN HA H -5.137 -4.288 6.158 1.00 . A A . 26 ASN HA 1 1 25 13655 1 1 5 ASN HB2 H -4.410 -2.018 6.721 1.00 . A A . 26 ASN HB2 1 1 25 13656 1 1 5 ASN HB3 H -5.929 -1.341 6.131 1.00 . A A . 26 ASN HB3 1 1 25 13657 1 1 5 ASN HD21 H -7.653 -1.210 7.580 1.00 . A A . 26 ASN HD21 1 1 25 13658 1 1 5 ASN HD22 H -7.596 -1.918 9.187 1.00 . A A . 26 ASN HD22 1 1 25 13659 1 1 5 ASN N N -5.057 -3.131 4.398 1.00 . A A . 26 ASN N 1 1 25 13660 1 1 5 ASN ND2 N -7.198 -1.788 8.270 1.00 . A A . 26 ASN ND2 1 1 25 13661 1 1 5 ASN O O -7.555 -4.810 6.289 1.00 . A A . 26 ASN O 1 1 25 13662 1 1 5 ASN OD1 O -5.540 -3.121 8.824 1.00 . A A . 26 ASN OD1 1 1 25 13663 1 1 6 CYS C C -9.836 -4.659 4.055 1.00 . A A . 27 CYS C 1 1 25 13664 1 1 6 CYS CA C -9.420 -3.344 4.755 1.00 . A A . 27 CYS CA 1 1 25 13665 1 1 6 CYS CB C -10.044 -2.134 4.035 1.00 . A A . 27 CYS CB 1 1 25 13666 1 1 6 CYS H H -7.588 -2.356 4.331 1.00 . A A . 27 CYS H 1 1 25 13667 1 1 6 CYS HA H -9.816 -3.374 5.771 1.00 . A A . 27 CYS HA 1 1 25 13668 1 1 6 CYS HB2 H -9.665 -2.084 3.013 1.00 . A A . 27 CYS HB2 1 1 25 13669 1 1 6 CYS HB3 H -11.126 -2.279 3.985 1.00 . A A . 27 CYS HB3 1 1 25 13670 1 1 6 CYS N N -7.967 -3.146 4.834 1.00 . A A . 27 CYS N 1 1 25 13671 1 1 6 CYS O O -10.987 -5.085 4.187 1.00 . A A . 27 CYS O 1 1 25 13672 1 1 6 CYS SG S -9.692 -0.585 4.919 1.00 . A A . 27 CYS SG 1 1 25 13673 1 1 7 GLY C C -10.243 -6.161 1.344 1.00 . A A . 28 GLY C 1 1 25 13674 1 1 7 GLY CA C -9.237 -6.466 2.464 1.00 . A A . 28 GLY CA 1 1 25 13675 1 1 7 GLY H H -7.992 -4.921 3.278 1.00 . A A . 28 GLY H 1 1 25 13676 1 1 7 GLY HA2 H -9.638 -7.262 3.090 1.00 . A A . 28 GLY HA2 1 1 25 13677 1 1 7 GLY HA3 H -8.314 -6.820 2.003 1.00 . A A . 28 GLY HA3 1 1 25 13678 1 1 7 GLY N N -8.930 -5.294 3.298 1.00 . A A . 28 GLY N 1 1 25 13679 1 1 7 GLY O O -11.108 -6.989 1.042 1.00 . A A . 28 GLY O 1 1 25 13680 1 1 8 LYS C C -10.511 -3.831 -1.443 1.00 . A A . 29 LYS C 1 1 25 13681 1 1 8 LYS CA C -11.156 -4.365 -0.153 1.00 . A A . 29 LYS CA 1 1 25 13682 1 1 8 LYS CB C -11.856 -3.195 0.569 1.00 . A A . 29 LYS CB 1 1 25 13683 1 1 8 LYS CD C -14.294 -4.044 0.776 1.00 . A A . 29 LYS CD 1 1 25 13684 1 1 8 LYS CE C -14.893 -2.924 -0.091 1.00 . A A . 29 LYS CE 1 1 25 13685 1 1 8 LYS CG C -13.009 -3.604 1.499 1.00 . A A . 29 LYS CG 1 1 25 13686 1 1 8 LYS H H -9.391 -4.366 1.044 1.00 . A A . 29 LYS H 1 1 25 13687 1 1 8 LYS HA H -11.889 -5.125 -0.413 1.00 . A A . 29 LYS HA 1 1 25 13688 1 1 8 LYS HB2 H -11.113 -2.656 1.159 1.00 . A A . 29 LYS HB2 1 1 25 13689 1 1 8 LYS HB3 H -12.236 -2.485 -0.166 1.00 . A A . 29 LYS HB3 1 1 25 13690 1 1 8 LYS HD2 H -14.088 -4.921 0.160 1.00 . A A . 29 LYS HD2 1 1 25 13691 1 1 8 LYS HD3 H -15.024 -4.332 1.536 1.00 . A A . 29 LYS HD3 1 1 25 13692 1 1 8 LYS HE2 H -15.020 -2.031 0.529 1.00 . A A . 29 LYS HE2 1 1 25 13693 1 1 8 LYS HE3 H -14.190 -2.675 -0.892 1.00 . A A . 29 LYS HE3 1 1 25 13694 1 1 8 LYS HG2 H -12.676 -4.412 2.148 1.00 . A A . 29 LYS HG2 1 1 25 13695 1 1 8 LYS HG3 H -13.253 -2.750 2.134 1.00 . A A . 29 LYS HG3 1 1 25 13696 1 1 8 LYS HZ1 H -16.119 -4.145 -1.254 1.00 . A A . 29 LYS HZ1 1 1 25 13697 1 1 8 LYS HZ2 H -16.882 -3.513 0.046 1.00 . A A . 29 LYS HZ2 1 1 25 13698 1 1 8 LYS HZ3 H -16.578 -2.580 -1.254 1.00 . A A . 29 LYS HZ3 1 1 25 13699 1 1 8 LYS N N -10.160 -4.956 0.760 1.00 . A A . 29 LYS N 1 1 25 13700 1 1 8 LYS NZ N -16.201 -3.319 -0.676 1.00 . A A . 29 LYS NZ 1 1 25 13701 1 1 8 LYS O O -9.440 -3.224 -1.360 1.00 . A A . 29 LYS O 1 1 25 13702 1 1 9 PRO C C -11.280 -1.749 -3.698 1.00 . A A . 30 PRO C 1 1 25 13703 1 1 9 PRO CA C -10.848 -3.225 -3.828 1.00 . A A . 30 PRO CA 1 1 25 13704 1 1 9 PRO CB C -11.595 -3.974 -4.940 1.00 . A A . 30 PRO CB 1 1 25 13705 1 1 9 PRO CD C -12.378 -4.769 -2.829 1.00 . A A . 30 PRO CD 1 1 25 13706 1 1 9 PRO CG C -12.867 -4.445 -4.240 1.00 . A A . 30 PRO CG 1 1 25 13707 1 1 9 PRO HA H -9.778 -3.260 -4.032 1.00 . A A . 30 PRO HA 1 1 25 13708 1 1 9 PRO HB2 H -11.818 -3.357 -5.809 1.00 . A A . 30 PRO HB2 1 1 25 13709 1 1 9 PRO HB3 H -11.009 -4.843 -5.244 1.00 . A A . 30 PRO HB3 1 1 25 13710 1 1 9 PRO HD2 H -13.158 -4.525 -2.109 1.00 . A A . 30 PRO HD2 1 1 25 13711 1 1 9 PRO HD3 H -12.125 -5.828 -2.765 1.00 . A A . 30 PRO HD3 1 1 25 13712 1 1 9 PRO HG2 H -13.589 -3.628 -4.200 1.00 . A A . 30 PRO HG2 1 1 25 13713 1 1 9 PRO HG3 H -13.300 -5.319 -4.729 1.00 . A A . 30 PRO HG3 1 1 25 13714 1 1 9 PRO N N -11.173 -3.970 -2.609 1.00 . A A . 30 PRO N 1 1 25 13715 1 1 9 PRO O O -11.649 -1.287 -2.611 1.00 . A A . 30 PRO O 1 1 25 13716 1 1 10 GLY C C -10.751 1.319 -3.925 1.00 . A A . 31 GLY C 1 1 25 13717 1 1 10 GLY CA C -11.630 0.432 -4.815 1.00 . A A . 31 GLY CA 1 1 25 13718 1 1 10 GLY H H -10.916 -1.405 -5.658 1.00 . A A . 31 GLY H 1 1 25 13719 1 1 10 GLY HA2 H -12.666 0.524 -4.482 1.00 . A A . 31 GLY HA2 1 1 25 13720 1 1 10 GLY HA3 H -11.562 0.805 -5.836 1.00 . A A . 31 GLY HA3 1 1 25 13721 1 1 10 GLY N N -11.234 -0.985 -4.795 1.00 . A A . 31 GLY N 1 1 25 13722 1 1 10 GLY O O -11.226 2.313 -3.367 1.00 . A A . 31 GLY O 1 1 25 13723 1 1 11 HIS C C -7.348 2.185 -3.501 1.00 . A A . 32 HIS C 1 1 25 13724 1 1 11 HIS CA C -8.543 1.524 -2.806 1.00 . A A . 32 HIS CA 1 1 25 13725 1 1 11 HIS CB C -8.101 0.453 -1.799 1.00 . A A . 32 HIS CB 1 1 25 13726 1 1 11 HIS CD2 C -8.544 1.016 0.655 1.00 . A A . 32 HIS CD2 1 1 25 13727 1 1 11 HIS CE1 C -10.560 0.190 0.903 1.00 . A A . 32 HIS CE1 1 1 25 13728 1 1 11 HIS CG C -8.924 0.473 -0.541 1.00 . A A . 32 HIS CG 1 1 25 13729 1 1 11 HIS H H -9.173 0.107 -4.255 1.00 . A A . 32 HIS H 1 1 25 13730 1 1 11 HIS HA H -9.051 2.312 -2.251 1.00 . A A . 32 HIS HA 1 1 25 13731 1 1 11 HIS HB2 H -8.159 -0.537 -2.252 1.00 . A A . 32 HIS HB2 1 1 25 13732 1 1 11 HIS HB3 H -7.058 0.623 -1.520 1.00 . A A . 32 HIS HB3 1 1 25 13733 1 1 11 HIS HD1 H -10.757 -0.490 -1.089 1.00 . A A . 32 HIS HD1 1 1 25 13734 1 1 11 HIS HD2 H -7.595 1.493 0.845 1.00 . A A . 32 HIS HD2 1 1 25 13735 1 1 11 HIS HE1 H -11.514 -0.098 1.331 1.00 . A A . 32 HIS HE1 1 1 25 13736 1 1 11 HIS N N -9.484 0.934 -3.757 1.00 . A A . 32 HIS N 1 1 25 13737 1 1 11 HIS ND1 N -10.193 -0.033 -0.372 1.00 . A A . 32 HIS ND1 1 1 25 13738 1 1 11 HIS NE2 N -9.575 0.814 1.581 1.00 . A A . 32 HIS NE2 1 1 25 13739 1 1 11 HIS O O -6.882 1.742 -4.554 1.00 . A A . 32 HIS O 1 1 25 13740 1 1 12 LEU C C -5.225 4.886 -2.095 1.00 . A A . 33 LEU C 1 1 25 13741 1 1 12 LEU CA C -5.850 4.203 -3.329 1.00 . A A . 33 LEU CA 1 1 25 13742 1 1 12 LEU CB C -6.516 5.286 -4.215 1.00 . A A . 33 LEU CB 1 1 25 13743 1 1 12 LEU CD1 C -7.731 6.017 -6.282 1.00 . A A . 33 LEU CD1 1 1 25 13744 1 1 12 LEU CD2 C -5.897 4.370 -6.509 1.00 . A A . 33 LEU CD2 1 1 25 13745 1 1 12 LEU CG C -7.032 4.843 -5.597 1.00 . A A . 33 LEU CG 1 1 25 13746 1 1 12 LEU H H -7.285 3.484 -1.981 1.00 . A A . 33 LEU H 1 1 25 13747 1 1 12 LEU HA H -5.061 3.684 -3.877 1.00 . A A . 33 LEU HA 1 1 25 13748 1 1 12 LEU HB2 H -7.356 5.703 -3.657 1.00 . A A . 33 LEU HB2 1 1 25 13749 1 1 12 LEU HB3 H -5.805 6.097 -4.383 1.00 . A A . 33 LEU HB3 1 1 25 13750 1 1 12 LEU HD11 H -8.566 6.354 -5.665 1.00 . A A . 33 LEU HD11 1 1 25 13751 1 1 12 LEU HD12 H -7.034 6.843 -6.422 1.00 . A A . 33 LEU HD12 1 1 25 13752 1 1 12 LEU HD13 H -8.120 5.703 -7.252 1.00 . A A . 33 LEU HD13 1 1 25 13753 1 1 12 LEU HD21 H -5.155 5.161 -6.623 1.00 . A A . 33 LEU HD21 1 1 25 13754 1 1 12 LEU HD22 H -5.421 3.486 -6.087 1.00 . A A . 33 LEU HD22 1 1 25 13755 1 1 12 LEU HD23 H -6.298 4.110 -7.488 1.00 . A A . 33 LEU HD23 1 1 25 13756 1 1 12 LEU HG H -7.761 4.044 -5.485 1.00 . A A . 33 LEU HG 1 1 25 13757 1 1 12 LEU N N -6.876 3.263 -2.878 1.00 . A A . 33 LEU N 1 1 25 13758 1 1 12 LEU O O -5.745 4.766 -0.982 1.00 . A A . 33 LEU O 1 1 25 13759 1 1 13 SER C C -4.676 7.673 -0.789 1.00 . A A . 34 SER C 1 1 25 13760 1 1 13 SER CA C -3.648 6.654 -1.323 1.00 . A A . 34 SER CA 1 1 25 13761 1 1 13 SER CB C -2.472 7.405 -1.953 1.00 . A A . 34 SER CB 1 1 25 13762 1 1 13 SER H H -3.827 5.773 -3.251 1.00 . A A . 34 SER H 1 1 25 13763 1 1 13 SER HA H -3.270 6.094 -0.467 1.00 . A A . 34 SER HA 1 1 25 13764 1 1 13 SER HB2 H -2.102 8.159 -1.257 1.00 . A A . 34 SER HB2 1 1 25 13765 1 1 13 SER HB3 H -1.672 6.694 -2.164 1.00 . A A . 34 SER HB3 1 1 25 13766 1 1 13 SER HG H -2.104 8.496 -3.544 1.00 . A A . 34 SER HG 1 1 25 13767 1 1 13 SER N N -4.185 5.696 -2.309 1.00 . A A . 34 SER N 1 1 25 13768 1 1 13 SER O O -4.463 8.278 0.264 1.00 . A A . 34 SER O 1 1 25 13769 1 1 13 SER OG O -2.872 8.024 -3.168 1.00 . A A . 34 SER OG 1 1 25 13770 1 1 14 SER C C -8.053 7.912 -0.343 1.00 . A A . 35 SER C 1 1 25 13771 1 1 14 SER CA C -6.951 8.686 -1.093 1.00 . A A . 35 SER CA 1 1 25 13772 1 1 14 SER CB C -7.539 9.350 -2.344 1.00 . A A . 35 SER CB 1 1 25 13773 1 1 14 SER H H -5.870 7.400 -2.389 1.00 . A A . 35 SER H 1 1 25 13774 1 1 14 SER HA H -6.607 9.479 -0.429 1.00 . A A . 35 SER HA 1 1 25 13775 1 1 14 SER HB2 H -8.409 9.947 -2.069 1.00 . A A . 35 SER HB2 1 1 25 13776 1 1 14 SER HB3 H -6.788 10.013 -2.777 1.00 . A A . 35 SER HB3 1 1 25 13777 1 1 14 SER HG H -8.291 8.830 -4.075 1.00 . A A . 35 SER HG 1 1 25 13778 1 1 14 SER N N -5.800 7.857 -1.492 1.00 . A A . 35 SER N 1 1 25 13779 1 1 14 SER O O -9.038 8.516 0.090 1.00 . A A . 35 SER O 1 1 25 13780 1 1 14 SER OG O -7.908 8.370 -3.303 1.00 . A A . 35 SER OG 1 1 25 13781 1 1 15 GLN C C -8.273 5.146 1.845 1.00 . A A . 36 GLN C 1 1 25 13782 1 1 15 GLN CA C -8.852 5.709 0.529 1.00 . A A . 36 GLN CA 1 1 25 13783 1 1 15 GLN CB C -9.241 4.575 -0.439 1.00 . A A . 36 GLN CB 1 1 25 13784 1 1 15 GLN CD C -11.790 4.604 -0.434 1.00 . A A . 36 GLN CD 1 1 25 13785 1 1 15 GLN CG C -10.529 3.831 -0.054 1.00 . A A . 36 GLN CG 1 1 25 13786 1 1 15 GLN H H -7.050 6.173 -0.523 1.00 . A A . 36 GLN H 1 1 25 13787 1 1 15 GLN HA H -9.752 6.272 0.776 1.00 . A A . 36 GLN HA 1 1 25 13788 1 1 15 GLN HB2 H -9.369 4.978 -1.446 1.00 . A A . 36 GLN HB2 1 1 25 13789 1 1 15 GLN HB3 H -8.423 3.855 -0.470 1.00 . A A . 36 GLN HB3 1 1 25 13790 1 1 15 GLN HE21 H -11.969 3.639 -2.211 1.00 . A A . 36 GLN HE21 1 1 25 13791 1 1 15 GLN HE22 H -13.196 4.852 -1.843 1.00 . A A . 36 GLN HE22 1 1 25 13792 1 1 15 GLN HG2 H -10.550 2.877 -0.579 1.00 . A A . 36 GLN HG2 1 1 25 13793 1 1 15 GLN HG3 H -10.539 3.616 1.015 1.00 . A A . 36 GLN HG3 1 1 25 13794 1 1 15 GLN N N -7.891 6.595 -0.152 1.00 . A A . 36 GLN N 1 1 25 13795 1 1 15 GLN NE2 N -12.362 4.345 -1.591 1.00 . A A . 36 GLN NE2 1 1 25 13796 1 1 15 GLN O O -8.983 5.103 2.853 1.00 . A A . 36 GLN O 1 1 25 13797 1 1 15 GLN OE1 O -12.282 5.453 0.299 1.00 . A A . 36 GLN OE1 1 1 25 13798 1 1 16 CYS C C -4.730 4.950 2.883 1.00 . A A . 37 CYS C 1 1 25 13799 1 1 16 CYS CA C -6.168 4.402 2.999 1.00 . A A . 37 CYS CA 1 1 25 13800 1 1 16 CYS CB C -6.153 2.864 3.099 1.00 . A A . 37 CYS CB 1 1 25 13801 1 1 16 CYS H H -6.475 4.892 0.967 1.00 . A A . 37 CYS H 1 1 25 13802 1 1 16 CYS HA H -6.598 4.816 3.910 1.00 . A A . 37 CYS HA 1 1 25 13803 1 1 16 CYS HB2 H -6.175 2.426 2.100 1.00 . A A . 37 CYS HB2 1 1 25 13804 1 1 16 CYS HB3 H -5.225 2.531 3.561 1.00 . A A . 37 CYS HB3 1 1 25 13805 1 1 16 CYS N N -6.977 4.806 1.843 1.00 . A A . 37 CYS N 1 1 25 13806 1 1 16 CYS O O -4.327 5.476 1.842 1.00 . A A . 37 CYS O 1 1 25 13807 1 1 16 CYS SG S -7.541 2.275 4.107 1.00 . A A . 37 CYS SG 1 1 25 13808 1 1 17 ARG C C -1.655 4.622 2.890 1.00 . A A . 38 ARG C 1 1 25 13809 1 1 17 ARG CA C -2.518 5.185 4.027 1.00 . A A . 38 ARG CA 1 1 25 13810 1 1 17 ARG CB C -1.942 4.800 5.403 1.00 . A A . 38 ARG CB 1 1 25 13811 1 1 17 ARG CD C -3.261 4.832 7.624 1.00 . A A . 38 ARG CD 1 1 25 13812 1 1 17 ARG CG C -2.519 5.648 6.555 1.00 . A A . 38 ARG CG 1 1 25 13813 1 1 17 ARG CZ C -5.706 4.878 7.064 1.00 . A A . 38 ARG CZ 1 1 25 13814 1 1 17 ARG H H -4.348 4.351 4.765 1.00 . A A . 38 ARG H 1 1 25 13815 1 1 17 ARG HA H -2.458 6.270 3.923 1.00 . A A . 38 ARG HA 1 1 25 13816 1 1 17 ARG HB2 H -2.108 3.736 5.586 1.00 . A A . 38 ARG HB2 1 1 25 13817 1 1 17 ARG HB3 H -0.862 4.960 5.382 1.00 . A A . 38 ARG HB3 1 1 25 13818 1 1 17 ARG HD2 H -2.608 4.024 7.960 1.00 . A A . 38 ARG HD2 1 1 25 13819 1 1 17 ARG HD3 H -3.447 5.470 8.490 1.00 . A A . 38 ARG HD3 1 1 25 13820 1 1 17 ARG HE H -4.544 3.260 7.001 1.00 . A A . 38 ARG HE 1 1 25 13821 1 1 17 ARG HG2 H -1.688 6.157 7.045 1.00 . A A . 38 ARG HG2 1 1 25 13822 1 1 17 ARG HG3 H -3.183 6.422 6.166 1.00 . A A . 38 ARG HG3 1 1 25 13823 1 1 17 ARG HH11 H -5.075 6.633 7.782 1.00 . A A . 38 ARG HH11 1 1 25 13824 1 1 17 ARG HH12 H -6.761 6.567 7.354 1.00 . A A . 38 ARG HH12 1 1 25 13825 1 1 17 ARG HH21 H -6.697 3.332 6.221 1.00 . A A . 38 ARG HH21 1 1 25 13826 1 1 17 ARG HH22 H -7.637 4.745 6.546 1.00 . A A . 38 ARG HH22 1 1 25 13827 1 1 17 ARG N N -3.936 4.784 3.952 1.00 . A A . 38 ARG N 1 1 25 13828 1 1 17 ARG NE N -4.539 4.262 7.142 1.00 . A A . 38 ARG NE 1 1 25 13829 1 1 17 ARG NH1 N -5.860 6.124 7.415 1.00 . A A . 38 ARG NH1 1 1 25 13830 1 1 17 ARG NH2 N -6.757 4.261 6.608 1.00 . A A . 38 ARG NH2 1 1 25 13831 1 1 17 ARG O O -0.742 5.314 2.432 1.00 . A A . 38 ARG O 1 1 25 13832 1 1 18 ALA C C -2.342 1.730 0.602 1.00 . A A . 39 ALA C 1 1 25 13833 1 1 18 ALA CA C -1.434 2.855 1.155 1.00 . A A . 39 ALA CA 1 1 25 13834 1 1 18 ALA CB C -0.033 2.291 1.444 1.00 . A A . 39 ALA CB 1 1 25 13835 1 1 18 ALA H H -2.713 2.915 2.848 1.00 . A A . 39 ALA H 1 1 25 13836 1 1 18 ALA HA H -1.361 3.646 0.409 1.00 . A A . 39 ALA HA 1 1 25 13837 1 1 18 ALA HB1 H 0.628 3.079 1.807 1.00 . A A . 39 ALA HB1 1 1 25 13838 1 1 18 ALA HB2 H -0.108 1.503 2.194 1.00 . A A . 39 ALA HB2 1 1 25 13839 1 1 18 ALA HB3 H 0.394 1.867 0.537 1.00 . A A . 39 ALA HB3 1 1 25 13840 1 1 18 ALA N N -1.968 3.423 2.397 1.00 . A A . 39 ALA N 1 1 25 13841 1 1 18 ALA O O -3.092 1.113 1.366 1.00 . A A . 39 ALA O 1 1 25 13842 1 1 19 PRO C C -1.689 -1.022 -0.744 1.00 . A A . 40 PRO C 1 1 25 13843 1 1 19 PRO CA C -2.662 0.083 -1.205 1.00 . A A . 40 PRO CA 1 1 25 13844 1 1 19 PRO CB C -2.675 0.246 -2.729 1.00 . A A . 40 PRO CB 1 1 25 13845 1 1 19 PRO CD C -1.604 2.165 -1.758 1.00 . A A . 40 PRO CD 1 1 25 13846 1 1 19 PRO CG C -1.547 1.247 -2.980 1.00 . A A . 40 PRO CG 1 1 25 13847 1 1 19 PRO HA H -3.667 -0.159 -0.858 1.00 . A A . 40 PRO HA 1 1 25 13848 1 1 19 PRO HB2 H -2.507 -0.695 -3.253 1.00 . A A . 40 PRO HB2 1 1 25 13849 1 1 19 PRO HB3 H -3.624 0.685 -3.034 1.00 . A A . 40 PRO HB3 1 1 25 13850 1 1 19 PRO HD2 H -0.596 2.477 -1.482 1.00 . A A . 40 PRO HD2 1 1 25 13851 1 1 19 PRO HD3 H -2.218 3.039 -1.983 1.00 . A A . 40 PRO HD3 1 1 25 13852 1 1 19 PRO HG2 H -0.589 0.723 -2.999 1.00 . A A . 40 PRO HG2 1 1 25 13853 1 1 19 PRO HG3 H -1.697 1.800 -3.908 1.00 . A A . 40 PRO HG3 1 1 25 13854 1 1 19 PRO N N -2.243 1.390 -0.699 1.00 . A A . 40 PRO N 1 1 25 13855 1 1 19 PRO O O -0.588 -0.740 -0.265 1.00 . A A . 40 PRO O 1 1 25 13856 1 1 20 LYS C C 0.116 -3.627 -0.896 1.00 . A A . 41 LYS C 1 1 25 13857 1 1 20 LYS CA C -1.362 -3.514 -0.486 1.00 . A A . 41 LYS CA 1 1 25 13858 1 1 20 LYS CB C -2.178 -4.736 -0.949 1.00 . A A . 41 LYS CB 1 1 25 13859 1 1 20 LYS CD C -2.810 -7.156 -0.561 1.00 . A A . 41 LYS CD 1 1 25 13860 1 1 20 LYS CE C -2.448 -8.492 0.107 1.00 . A A . 41 LYS CE 1 1 25 13861 1 1 20 LYS CG C -1.846 -6.022 -0.174 1.00 . A A . 41 LYS CG 1 1 25 13862 1 1 20 LYS H H -2.986 -2.423 -1.356 1.00 . A A . 41 LYS H 1 1 25 13863 1 1 20 LYS HA H -1.351 -3.499 0.602 1.00 . A A . 41 LYS HA 1 1 25 13864 1 1 20 LYS HB2 H -3.238 -4.527 -0.807 1.00 . A A . 41 LYS HB2 1 1 25 13865 1 1 20 LYS HB3 H -2.015 -4.902 -2.016 1.00 . A A . 41 LYS HB3 1 1 25 13866 1 1 20 LYS HD2 H -3.831 -6.879 -0.297 1.00 . A A . 41 LYS HD2 1 1 25 13867 1 1 20 LYS HD3 H -2.766 -7.298 -1.642 1.00 . A A . 41 LYS HD3 1 1 25 13868 1 1 20 LYS HE2 H -3.064 -9.276 -0.344 1.00 . A A . 41 LYS HE2 1 1 25 13869 1 1 20 LYS HE3 H -1.402 -8.728 -0.117 1.00 . A A . 41 LYS HE3 1 1 25 13870 1 1 20 LYS HG2 H -0.826 -6.334 -0.403 1.00 . A A . 41 LYS HG2 1 1 25 13871 1 1 20 LYS HG3 H -1.929 -5.823 0.894 1.00 . A A . 41 LYS HG3 1 1 25 13872 1 1 20 LYS HZ1 H -3.629 -8.263 1.804 1.00 . A A . 41 LYS HZ1 1 1 25 13873 1 1 20 LYS HZ2 H -2.458 -9.380 1.983 1.00 . A A . 41 LYS HZ2 1 1 25 13874 1 1 20 LYS HZ3 H -2.076 -7.797 2.037 1.00 . A A . 41 LYS HZ3 1 1 25 13875 1 1 20 LYS N N -2.068 -2.293 -0.939 1.00 . A A . 41 LYS N 1 1 25 13876 1 1 20 LYS NZ N -2.669 -8.476 1.578 1.00 . A A . 41 LYS NZ 1 1 25 13877 1 1 20 LYS O O 0.872 -4.371 -0.271 1.00 . A A . 41 LYS O 1 1 25 13878 1 1 21 VAL C C 2.852 -2.244 -1.115 1.00 . A A . 42 VAL C 1 1 25 13879 1 1 21 VAL CA C 1.956 -2.662 -2.298 1.00 . A A . 42 VAL CA 1 1 25 13880 1 1 21 VAL CB C 2.025 -1.596 -3.418 1.00 . A A . 42 VAL CB 1 1 25 13881 1 1 21 VAL CG1 C 3.446 -1.385 -3.947 1.00 . A A . 42 VAL CG1 1 1 25 13882 1 1 21 VAL CG2 C 1.146 -1.974 -4.621 1.00 . A A . 42 VAL CG2 1 1 25 13883 1 1 21 VAL H H -0.152 -2.304 -2.362 1.00 . A A . 42 VAL H 1 1 25 13884 1 1 21 VAL HA H 2.347 -3.599 -2.693 1.00 . A A . 42 VAL HA 1 1 25 13885 1 1 21 VAL HB H 1.666 -0.646 -3.021 1.00 . A A . 42 VAL HB 1 1 25 13886 1 1 21 VAL HG11 H 3.854 -2.334 -4.300 1.00 . A A . 42 VAL HG11 1 1 25 13887 1 1 21 VAL HG12 H 3.438 -0.671 -4.769 1.00 . A A . 42 VAL HG12 1 1 25 13888 1 1 21 VAL HG13 H 4.088 -0.985 -3.163 1.00 . A A . 42 VAL HG13 1 1 25 13889 1 1 21 VAL HG21 H 1.447 -2.947 -5.011 1.00 . A A . 42 VAL HG21 1 1 25 13890 1 1 21 VAL HG22 H 0.094 -2.008 -4.338 1.00 . A A . 42 VAL HG22 1 1 25 13891 1 1 21 VAL HG23 H 1.252 -1.227 -5.407 1.00 . A A . 42 VAL HG23 1 1 25 13892 1 1 21 VAL N N 0.547 -2.865 -1.901 1.00 . A A . 42 VAL N 1 1 25 13893 1 1 21 VAL O O 4.022 -2.628 -1.064 1.00 . A A . 42 VAL O 1 1 25 13894 1 1 22 CYS C C 2.031 -0.828 2.218 1.00 . A A . 43 CYS C 1 1 25 13895 1 1 22 CYS CA C 2.987 -0.917 0.998 1.00 . A A . 43 CYS CA 1 1 25 13896 1 1 22 CYS CB C 3.527 0.450 0.533 1.00 . A A . 43 CYS CB 1 1 25 13897 1 1 22 CYS H H 1.311 -1.278 -0.241 1.00 . A A . 43 CYS H 1 1 25 13898 1 1 22 CYS HA H 3.831 -1.547 1.275 1.00 . A A . 43 CYS HA 1 1 25 13899 1 1 22 CYS HB2 H 4.006 0.321 -0.439 1.00 . A A . 43 CYS HB2 1 1 25 13900 1 1 22 CYS HB3 H 2.696 1.148 0.413 1.00 . A A . 43 CYS HB3 1 1 25 13901 1 1 22 CYS N N 2.298 -1.497 -0.155 1.00 . A A . 43 CYS N 1 1 25 13902 1 1 22 CYS O O 1.018 -1.524 2.295 1.00 . A A . 43 CYS O 1 1 25 13903 1 1 22 CYS SG S 4.751 1.123 1.691 1.00 . A A . 43 CYS SG 1 1 25 13904 1 1 23 PHE C C 1.674 1.984 4.597 1.00 . A A . 44 PHE C 1 1 25 13905 1 1 23 PHE CA C 1.567 0.467 4.317 1.00 . A A . 44 PHE CA 1 1 25 13906 1 1 23 PHE CB C 1.993 -0.343 5.554 1.00 . A A . 44 PHE CB 1 1 25 13907 1 1 23 PHE CD1 C 4.534 -0.477 5.504 1.00 . A A . 44 PHE CD1 1 1 25 13908 1 1 23 PHE CD2 C 3.467 0.883 7.218 1.00 . A A . 44 PHE CD2 1 1 25 13909 1 1 23 PHE CE1 C 5.797 -0.112 6.002 1.00 . A A . 44 PHE CE1 1 1 25 13910 1 1 23 PHE CE2 C 4.731 1.246 7.718 1.00 . A A . 44 PHE CE2 1 1 25 13911 1 1 23 PHE CG C 3.362 0.023 6.108 1.00 . A A . 44 PHE CG 1 1 25 13912 1 1 23 PHE CZ C 5.897 0.749 7.109 1.00 . A A . 44 PHE CZ 1 1 25 13913 1 1 23 PHE H H 3.271 0.481 3.025 1.00 . A A . 44 PHE H 1 1 25 13914 1 1 23 PHE HA H 0.517 0.249 4.113 1.00 . A A . 44 PHE HA 1 1 25 13915 1 1 23 PHE HB2 H 1.248 -0.185 6.335 1.00 . A A . 44 PHE HB2 1 1 25 13916 1 1 23 PHE HB3 H 1.977 -1.405 5.311 1.00 . A A . 44 PHE HB3 1 1 25 13917 1 1 23 PHE HD1 H 4.467 -1.144 4.654 1.00 . A A . 44 PHE HD1 1 1 25 13918 1 1 23 PHE HD2 H 2.574 1.273 7.687 1.00 . A A . 44 PHE HD2 1 1 25 13919 1 1 23 PHE HE1 H 6.694 -0.498 5.536 1.00 . A A . 44 PHE HE1 1 1 25 13920 1 1 23 PHE HE2 H 4.805 1.903 8.574 1.00 . A A . 44 PHE HE2 1 1 25 13921 1 1 23 PHE HZ H 6.869 1.023 7.494 1.00 . A A . 44 PHE HZ 1 1 25 13922 1 1 23 PHE N N 2.372 0.042 3.167 1.00 . A A . 44 PHE N 1 1 25 13923 1 1 23 PHE O O 0.865 2.520 5.358 1.00 . A A . 44 PHE O 1 1 25 13924 1 1 24 LYS C C 3.717 4.783 3.130 1.00 . A A . 45 LYS C 1 1 25 13925 1 1 24 LYS CA C 3.006 4.083 4.296 1.00 . A A . 45 LYS CA 1 1 25 13926 1 1 24 LYS CB C 3.888 4.080 5.563 1.00 . A A . 45 LYS CB 1 1 25 13927 1 1 24 LYS CD C 5.285 5.417 7.236 1.00 . A A . 45 LYS CD 1 1 25 13928 1 1 24 LYS CE C 6.607 4.685 6.952 1.00 . A A . 45 LYS CE 1 1 25 13929 1 1 24 LYS CG C 4.379 5.473 5.996 1.00 . A A . 45 LYS CG 1 1 25 13930 1 1 24 LYS H H 3.256 2.175 3.353 1.00 . A A . 45 LYS H 1 1 25 13931 1 1 24 LYS HA H 2.096 4.648 4.502 1.00 . A A . 45 LYS HA 1 1 25 13932 1 1 24 LYS HB2 H 3.313 3.656 6.387 1.00 . A A . 45 LYS HB2 1 1 25 13933 1 1 24 LYS HB3 H 4.748 3.431 5.390 1.00 . A A . 45 LYS HB3 1 1 25 13934 1 1 24 LYS HD2 H 5.504 6.441 7.544 1.00 . A A . 45 LYS HD2 1 1 25 13935 1 1 24 LYS HD3 H 4.755 4.919 8.050 1.00 . A A . 45 LYS HD3 1 1 25 13936 1 1 24 LYS HE2 H 6.391 3.646 6.690 1.00 . A A . 45 LYS HE2 1 1 25 13937 1 1 24 LYS HE3 H 7.089 5.154 6.088 1.00 . A A . 45 LYS HE3 1 1 25 13938 1 1 24 LYS HG2 H 4.936 5.945 5.187 1.00 . A A . 45 LYS HG2 1 1 25 13939 1 1 24 LYS HG3 H 3.512 6.095 6.224 1.00 . A A . 45 LYS HG3 1 1 25 13940 1 1 24 LYS HZ1 H 7.103 4.295 8.936 1.00 . A A . 45 LYS HZ1 1 1 25 13941 1 1 24 LYS HZ2 H 8.386 4.244 7.929 1.00 . A A . 45 LYS HZ2 1 1 25 13942 1 1 24 LYS HZ3 H 7.757 5.680 8.370 1.00 . A A . 45 LYS HZ3 1 1 25 13943 1 1 24 LYS N N 2.661 2.678 3.999 1.00 . A A . 45 LYS N 1 1 25 13944 1 1 24 LYS NZ N 7.522 4.729 8.124 1.00 . A A . 45 LYS NZ 1 1 25 13945 1 1 24 LYS O O 3.188 5.754 2.587 1.00 . A A . 45 LYS O 1 1 25 13946 1 1 25 CYS C C 5.406 4.903 0.357 1.00 . A A . 46 CYS C 1 1 25 13947 1 1 25 CYS CA C 5.844 4.952 1.837 1.00 . A A . 46 CYS CA 1 1 25 13948 1 1 25 CYS CB C 7.265 4.375 2.045 1.00 . A A . 46 CYS CB 1 1 25 13949 1 1 25 CYS H H 5.276 3.515 3.268 1.00 . A A . 46 CYS H 1 1 25 13950 1 1 25 CYS HA H 5.888 6.008 2.108 1.00 . A A . 46 CYS HA 1 1 25 13951 1 1 25 CYS HB2 H 7.715 4.150 1.074 1.00 . A A . 46 CYS HB2 1 1 25 13952 1 1 25 CYS HB3 H 7.878 5.156 2.499 1.00 . A A . 46 CYS HB3 1 1 25 13953 1 1 25 CYS N N 4.906 4.305 2.759 1.00 . A A . 46 CYS N 1 1 25 13954 1 1 25 CYS O O 5.595 5.887 -0.360 1.00 . A A . 46 CYS O 1 1 25 13955 1 1 25 CYS SG S 7.346 2.897 3.109 1.00 . A A . 46 CYS SG 1 1 25 13956 1 1 26 LYS C C 4.731 4.092 -2.665 1.00 . A A . 47 LYS C 1 1 25 13957 1 1 26 LYS CA C 4.064 3.582 -1.364 1.00 . A A . 47 LYS CA 1 1 25 13958 1 1 26 LYS CB C 2.587 4.013 -1.204 1.00 . A A . 47 LYS CB 1 1 25 13959 1 1 26 LYS CD C 0.924 5.881 -0.731 1.00 . A A . 47 LYS CD 1 1 25 13960 1 1 26 LYS CE C 0.783 7.265 -0.079 1.00 . A A . 47 LYS CE 1 1 25 13961 1 1 26 LYS CG C 2.402 5.510 -0.902 1.00 . A A . 47 LYS CG 1 1 25 13962 1 1 26 LYS H H 4.698 3.054 0.609 1.00 . A A . 47 LYS H 1 1 25 13963 1 1 26 LYS HA H 4.032 2.503 -1.512 1.00 . A A . 47 LYS HA 1 1 25 13964 1 1 26 LYS HB2 H 2.031 3.757 -2.107 1.00 . A A . 47 LYS HB2 1 1 25 13965 1 1 26 LYS HB3 H 2.154 3.441 -0.382 1.00 . A A . 47 LYS HB3 1 1 25 13966 1 1 26 LYS HD2 H 0.457 5.894 -1.717 1.00 . A A . 47 LYS HD2 1 1 25 13967 1 1 26 LYS HD3 H 0.417 5.138 -0.116 1.00 . A A . 47 LYS HD3 1 1 25 13968 1 1 26 LYS HE2 H 1.465 7.963 -0.574 1.00 . A A . 47 LYS HE2 1 1 25 13969 1 1 26 LYS HE3 H -0.237 7.625 -0.239 1.00 . A A . 47 LYS HE3 1 1 25 13970 1 1 26 LYS HG2 H 2.921 5.750 0.019 1.00 . A A . 47 LYS HG2 1 1 25 13971 1 1 26 LYS HG3 H 2.831 6.107 -1.707 1.00 . A A . 47 LYS HG3 1 1 25 13972 1 1 26 LYS HZ1 H 1.981 6.848 1.590 1.00 . A A . 47 LYS HZ1 1 1 25 13973 1 1 26 LYS HZ2 H 0.986 8.135 1.803 1.00 . A A . 47 LYS HZ2 1 1 25 13974 1 1 26 LYS HZ3 H 0.393 6.606 1.850 1.00 . A A . 47 LYS HZ3 1 1 25 13975 1 1 26 LYS N N 4.773 3.799 -0.077 1.00 . A A . 47 LYS N 1 1 25 13976 1 1 26 LYS NZ N 1.057 7.218 1.382 1.00 . A A . 47 LYS NZ 1 1 25 13977 1 1 26 LYS O O 4.044 4.309 -3.663 1.00 . A A . 47 LYS O 1 1 25 13978 1 1 27 GLN C C 6.828 3.563 -4.969 1.00 . A A . 48 GLN C 1 1 25 13979 1 1 27 GLN CA C 6.810 4.672 -3.886 1.00 . A A . 48 GLN CA 1 1 25 13980 1 1 27 GLN CB C 8.247 5.076 -3.497 1.00 . A A . 48 GLN CB 1 1 25 13981 1 1 27 GLN CD C 7.594 7.479 -2.918 1.00 . A A . 48 GLN CD 1 1 25 13982 1 1 27 GLN CG C 8.338 6.220 -2.472 1.00 . A A . 48 GLN CG 1 1 25 13983 1 1 27 GLN H H 6.565 4.086 -1.833 1.00 . A A . 48 GLN H 1 1 25 13984 1 1 27 GLN HA H 6.306 5.547 -4.294 1.00 . A A . 48 GLN HA 1 1 25 13985 1 1 27 GLN HB2 H 8.759 4.210 -3.086 1.00 . A A . 48 GLN HB2 1 1 25 13986 1 1 27 GLN HB3 H 8.784 5.382 -4.396 1.00 . A A . 48 GLN HB3 1 1 25 13987 1 1 27 GLN HE21 H 6.123 7.209 -1.556 1.00 . A A . 48 GLN HE21 1 1 25 13988 1 1 27 GLN HE22 H 5.988 8.634 -2.595 1.00 . A A . 48 GLN HE22 1 1 25 13989 1 1 27 GLN HG2 H 7.956 5.880 -1.511 1.00 . A A . 48 GLN HG2 1 1 25 13990 1 1 27 GLN HG3 H 9.388 6.474 -2.326 1.00 . A A . 48 GLN HG3 1 1 25 13991 1 1 27 GLN N N 6.057 4.263 -2.687 1.00 . A A . 48 GLN N 1 1 25 13992 1 1 27 GLN NE2 N 6.477 7.803 -2.303 1.00 . A A . 48 GLN NE2 1 1 25 13993 1 1 27 GLN O O 6.790 2.382 -4.603 1.00 . A A . 48 GLN O 1 1 25 13994 1 1 27 GLN OE1 O 7.998 8.183 -3.835 1.00 . A A . 48 GLN OE1 1 1 25 13995 1 1 28 PRO C C 7.481 1.635 -7.446 1.00 . A A . 49 PRO C 1 1 25 13996 1 1 28 PRO CA C 6.724 2.978 -7.411 1.00 . A A . 49 PRO CA 1 1 25 13997 1 1 28 PRO CB C 7.063 3.792 -8.664 1.00 . A A . 49 PRO CB 1 1 25 13998 1 1 28 PRO CD C 7.088 5.261 -6.789 1.00 . A A . 49 PRO CD 1 1 25 13999 1 1 28 PRO CG C 6.705 5.217 -8.265 1.00 . A A . 49 PRO CG 1 1 25 14000 1 1 28 PRO HA H 5.657 2.749 -7.438 1.00 . A A . 49 PRO HA 1 1 25 14001 1 1 28 PRO HB2 H 8.134 3.733 -8.871 1.00 . A A . 49 PRO HB2 1 1 25 14002 1 1 28 PRO HB3 H 6.489 3.461 -9.530 1.00 . A A . 49 PRO HB3 1 1 25 14003 1 1 28 PRO HD2 H 8.131 5.569 -6.692 1.00 . A A . 49 PRO HD2 1 1 25 14004 1 1 28 PRO HD3 H 6.439 5.973 -6.282 1.00 . A A . 49 PRO HD3 1 1 25 14005 1 1 28 PRO HG2 H 7.256 5.954 -8.849 1.00 . A A . 49 PRO HG2 1 1 25 14006 1 1 28 PRO HG3 H 5.630 5.367 -8.369 1.00 . A A . 49 PRO HG3 1 1 25 14007 1 1 28 PRO N N 6.936 3.898 -6.276 1.00 . A A . 49 PRO N 1 1 25 14008 1 1 28 PRO O O 7.030 0.720 -8.140 1.00 . A A . 49 PRO O 1 1 25 14009 1 1 29 GLY C C 10.198 -0.039 -5.443 1.00 . A A . 50 GLY C 1 1 25 14010 1 1 29 GLY CA C 9.418 0.257 -6.733 1.00 . A A . 50 GLY CA 1 1 25 14011 1 1 29 GLY H H 8.964 2.307 -6.266 1.00 . A A . 50 GLY H 1 1 25 14012 1 1 29 GLY HA2 H 10.137 0.312 -7.550 1.00 . A A . 50 GLY HA2 1 1 25 14013 1 1 29 GLY HA3 H 8.771 -0.604 -6.915 1.00 . A A . 50 GLY HA3 1 1 25 14014 1 1 29 GLY N N 8.609 1.491 -6.739 1.00 . A A . 50 GLY N 1 1 25 14015 1 1 29 GLY O O 10.920 -1.034 -5.382 1.00 . A A . 50 GLY O 1 1 25 14016 1 1 30 HIS C C 10.497 -0.643 -2.370 1.00 . A A . 51 HIS C 1 1 25 14017 1 1 30 HIS CA C 10.803 0.661 -3.136 1.00 . A A . 51 HIS CA 1 1 25 14018 1 1 30 HIS CB C 10.494 1.875 -2.241 1.00 . A A . 51 HIS CB 1 1 25 14019 1 1 30 HIS CD2 C 9.032 1.587 -0.157 1.00 . A A . 51 HIS CD2 1 1 25 14020 1 1 30 HIS CE1 C 7.044 1.406 -1.070 1.00 . A A . 51 HIS CE1 1 1 25 14021 1 1 30 HIS CG C 9.173 1.778 -1.505 1.00 . A A . 51 HIS CG 1 1 25 14022 1 1 30 HIS H H 9.463 1.598 -4.515 1.00 . A A . 51 HIS H 1 1 25 14023 1 1 30 HIS HA H 11.870 0.668 -3.361 1.00 . A A . 51 HIS HA 1 1 25 14024 1 1 30 HIS HB2 H 11.287 1.951 -1.496 1.00 . A A . 51 HIS HB2 1 1 25 14025 1 1 30 HIS HB3 H 10.526 2.790 -2.833 1.00 . A A . 51 HIS HB3 1 1 25 14026 1 1 30 HIS HD1 H 7.651 1.783 -3.037 1.00 . A A . 51 HIS HD1 1 1 25 14027 1 1 30 HIS HD2 H 9.838 1.553 0.563 1.00 . A A . 51 HIS HD2 1 1 25 14028 1 1 30 HIS HE1 H 5.981 1.248 -1.209 1.00 . A A . 51 HIS HE1 1 1 25 14029 1 1 30 HIS N N 10.066 0.798 -4.405 1.00 . A A . 51 HIS N 1 1 25 14030 1 1 30 HIS ND1 N 7.912 1.674 -2.058 1.00 . A A . 51 HIS ND1 1 1 25 14031 1 1 30 HIS NE2 N 7.677 1.357 0.112 1.00 . A A . 51 HIS NE2 1 1 25 14032 1 1 30 HIS O O 11.347 -1.162 -1.642 1.00 . A A . 51 HIS O 1 1 25 14033 1 1 31 PHE C C 9.559 -3.541 -1.817 1.00 . A A . 52 PHE C 1 1 25 14034 1 1 31 PHE CA C 8.732 -2.254 -1.701 1.00 . A A . 52 PHE CA 1 1 25 14035 1 1 31 PHE CB C 7.250 -2.469 -2.047 1.00 . A A . 52 PHE CB 1 1 25 14036 1 1 31 PHE CD1 C 6.705 -1.640 -4.386 1.00 . A A . 52 PHE CD1 1 1 25 14037 1 1 31 PHE CD2 C 6.905 -4.038 -4.014 1.00 . A A . 52 PHE CD2 1 1 25 14038 1 1 31 PHE CE1 C 6.427 -1.875 -5.744 1.00 . A A . 52 PHE CE1 1 1 25 14039 1 1 31 PHE CE2 C 6.632 -4.271 -5.374 1.00 . A A . 52 PHE CE2 1 1 25 14040 1 1 31 PHE CG C 6.949 -2.722 -3.516 1.00 . A A . 52 PHE CG 1 1 25 14041 1 1 31 PHE CZ C 6.393 -3.190 -6.239 1.00 . A A . 52 PHE CZ 1 1 25 14042 1 1 31 PHE H H 8.642 -0.695 -3.142 1.00 . A A . 52 PHE H 1 1 25 14043 1 1 31 PHE HA H 8.778 -1.945 -0.656 1.00 . A A . 52 PHE HA 1 1 25 14044 1 1 31 PHE HB2 H 6.871 -3.305 -1.458 1.00 . A A . 52 PHE HB2 1 1 25 14045 1 1 31 PHE HB3 H 6.694 -1.584 -1.731 1.00 . A A . 52 PHE HB3 1 1 25 14046 1 1 31 PHE HD1 H 6.706 -0.625 -4.014 1.00 . A A . 52 PHE HD1 1 1 25 14047 1 1 31 PHE HD2 H 7.086 -4.876 -3.357 1.00 . A A . 52 PHE HD2 1 1 25 14048 1 1 31 PHE HE1 H 6.224 -1.046 -6.406 1.00 . A A . 52 PHE HE1 1 1 25 14049 1 1 31 PHE HE2 H 6.607 -5.284 -5.755 1.00 . A A . 52 PHE HE2 1 1 25 14050 1 1 31 PHE HZ H 6.180 -3.369 -7.286 1.00 . A A . 52 PHE HZ 1 1 25 14051 1 1 31 PHE N N 9.273 -1.164 -2.513 1.00 . A A . 52 PHE N 1 1 25 14052 1 1 31 PHE O O 9.874 -4.150 -0.797 1.00 . A A . 52 PHE O 1 1 25 14053 1 1 32 SER C C 12.244 -5.036 -2.517 1.00 . A A . 53 SER C 1 1 25 14054 1 1 32 SER CA C 10.905 -5.047 -3.280 1.00 . A A . 53 SER CA 1 1 25 14055 1 1 32 SER CB C 11.199 -5.142 -4.783 1.00 . A A . 53 SER CB 1 1 25 14056 1 1 32 SER H H 9.722 -3.357 -3.819 1.00 . A A . 53 SER H 1 1 25 14057 1 1 32 SER HA H 10.374 -5.952 -2.983 1.00 . A A . 53 SER HA 1 1 25 14058 1 1 32 SER HB2 H 11.767 -4.263 -5.097 1.00 . A A . 53 SER HB2 1 1 25 14059 1 1 32 SER HB3 H 11.797 -6.035 -4.980 1.00 . A A . 53 SER HB3 1 1 25 14060 1 1 32 SER HG H 10.217 -5.290 -6.474 1.00 . A A . 53 SER HG 1 1 25 14061 1 1 32 SER N N 10.029 -3.890 -3.018 1.00 . A A . 53 SER N 1 1 25 14062 1 1 32 SER O O 12.951 -6.045 -2.517 1.00 . A A . 53 SER O 1 1 25 14063 1 1 32 SER OG O 9.992 -5.215 -5.527 1.00 . A A . 53 SER OG 1 1 25 14064 1 1 33 LYS C C 13.599 -3.179 0.320 1.00 . A A . 54 LYS C 1 1 25 14065 1 1 33 LYS CA C 13.842 -3.684 -1.118 1.00 . A A . 54 LYS CA 1 1 25 14066 1 1 33 LYS CB C 14.735 -2.698 -1.905 1.00 . A A . 54 LYS CB 1 1 25 14067 1 1 33 LYS CD C 15.891 -4.375 -3.479 1.00 . A A . 54 LYS CD 1 1 25 14068 1 1 33 LYS CE C 16.090 -4.729 -4.958 1.00 . A A . 54 LYS CE 1 1 25 14069 1 1 33 LYS CG C 15.053 -3.092 -3.362 1.00 . A A . 54 LYS CG 1 1 25 14070 1 1 33 LYS H H 11.964 -3.123 -1.952 1.00 . A A . 54 LYS H 1 1 25 14071 1 1 33 LYS HA H 14.372 -4.630 -1.005 1.00 . A A . 54 LYS HA 1 1 25 14072 1 1 33 LYS HB2 H 14.240 -1.726 -1.925 1.00 . A A . 54 LYS HB2 1 1 25 14073 1 1 33 LYS HB3 H 15.680 -2.574 -1.376 1.00 . A A . 54 LYS HB3 1 1 25 14074 1 1 33 LYS HD2 H 16.860 -4.217 -3.004 1.00 . A A . 54 LYS HD2 1 1 25 14075 1 1 33 LYS HD3 H 15.383 -5.199 -2.980 1.00 . A A . 54 LYS HD3 1 1 25 14076 1 1 33 LYS HE2 H 15.107 -4.830 -5.430 1.00 . A A . 54 LYS HE2 1 1 25 14077 1 1 33 LYS HE3 H 16.615 -3.907 -5.451 1.00 . A A . 54 LYS HE3 1 1 25 14078 1 1 33 LYS HG2 H 14.125 -3.209 -3.921 1.00 . A A . 54 LYS HG2 1 1 25 14079 1 1 33 LYS HG3 H 15.612 -2.275 -3.819 1.00 . A A . 54 LYS HG3 1 1 25 14080 1 1 33 LYS HZ1 H 16.382 -6.770 -4.678 1.00 . A A . 54 LYS HZ1 1 1 25 14081 1 1 33 LYS HZ2 H 16.976 -6.223 -6.096 1.00 . A A . 54 LYS HZ2 1 1 25 14082 1 1 33 LYS HZ3 H 17.778 -5.919 -4.708 1.00 . A A . 54 LYS HZ3 1 1 25 14083 1 1 33 LYS N N 12.596 -3.913 -1.870 1.00 . A A . 54 LYS N 1 1 25 14084 1 1 33 LYS NZ N 16.857 -5.992 -5.118 1.00 . A A . 54 LYS NZ 1 1 25 14085 1 1 33 LYS O O 14.566 -2.839 1.007 1.00 . A A . 54 LYS O 1 1 25 14086 1 1 34 GLN C C 10.710 -3.317 2.698 1.00 . A A . 55 GLN C 1 1 25 14087 1 1 34 GLN CA C 11.998 -2.671 2.145 1.00 . A A . 55 GLN CA 1 1 25 14088 1 1 34 GLN CB C 11.882 -1.133 2.142 1.00 . A A . 55 GLN CB 1 1 25 14089 1 1 34 GLN CD C 11.497 0.944 3.534 1.00 . A A . 55 GLN CD 1 1 25 14090 1 1 34 GLN CG C 11.777 -0.555 3.562 1.00 . A A . 55 GLN CG 1 1 25 14091 1 1 34 GLN H H 11.606 -3.464 0.187 1.00 . A A . 55 GLN H 1 1 25 14092 1 1 34 GLN HA H 12.810 -2.947 2.821 1.00 . A A . 55 GLN HA 1 1 25 14093 1 1 34 GLN HB2 H 12.764 -0.703 1.667 1.00 . A A . 55 GLN HB2 1 1 25 14094 1 1 34 GLN HB3 H 11.009 -0.832 1.560 1.00 . A A . 55 GLN HB3 1 1 25 14095 1 1 34 GLN HE21 H 9.505 0.639 3.499 1.00 . A A . 55 GLN HE21 1 1 25 14096 1 1 34 GLN HE22 H 10.023 2.317 3.500 1.00 . A A . 55 GLN HE22 1 1 25 14097 1 1 34 GLN HG2 H 10.971 -1.046 4.107 1.00 . A A . 55 GLN HG2 1 1 25 14098 1 1 34 GLN HG3 H 12.709 -0.736 4.096 1.00 . A A . 55 GLN HG3 1 1 25 14099 1 1 34 GLN N N 12.342 -3.117 0.785 1.00 . A A . 55 GLN N 1 1 25 14100 1 1 34 GLN NE2 N 10.242 1.333 3.512 1.00 . A A . 55 GLN NE2 1 1 25 14101 1 1 34 GLN O O 10.753 -3.982 3.735 1.00 . A A . 55 GLN O 1 1 25 14102 1 1 34 GLN OE1 O 12.391 1.783 3.527 1.00 . A A . 55 GLN OE1 1 1 25 14103 1 1 35 CYS C C 7.701 -4.836 2.042 1.00 . A A . 56 CYS C 1 1 25 14104 1 1 35 CYS CA C 8.228 -3.458 2.517 1.00 . A A . 56 CYS CA 1 1 25 14105 1 1 35 CYS CB C 7.278 -2.316 2.113 1.00 . A A . 56 CYS CB 1 1 25 14106 1 1 35 CYS H H 9.618 -2.553 1.192 1.00 . A A . 56 CYS H 1 1 25 14107 1 1 35 CYS HA H 8.259 -3.488 3.608 1.00 . A A . 56 CYS HA 1 1 25 14108 1 1 35 CYS HB2 H 7.184 -2.278 1.027 1.00 . A A . 56 CYS HB2 1 1 25 14109 1 1 35 CYS HB3 H 6.289 -2.516 2.531 1.00 . A A . 56 CYS HB3 1 1 25 14110 1 1 35 CYS N N 9.573 -3.128 2.018 1.00 . A A . 56 CYS N 1 1 25 14111 1 1 35 CYS O O 6.614 -5.266 2.441 1.00 . A A . 56 CYS O 1 1 25 14112 1 1 35 CYS SG S 7.886 -0.724 2.747 1.00 . A A . 56 CYS SG 1 1 25 14113 1 1 36 ARG C C 9.352 -7.639 0.136 1.00 . A A . 57 ARG C 1 1 25 14114 1 1 36 ARG CA C 8.115 -6.796 0.515 1.00 . A A . 57 ARG CA 1 1 25 14115 1 1 36 ARG CB C 7.234 -6.475 -0.717 1.00 . A A . 57 ARG CB 1 1 25 14116 1 1 36 ARG CD C 5.251 -7.936 0.082 1.00 . A A . 57 ARG CD 1 1 25 14117 1 1 36 ARG CG C 6.190 -7.551 -1.075 1.00 . A A . 57 ARG CG 1 1 25 14118 1 1 36 ARG CZ C 3.604 -6.094 0.533 1.00 . A A . 57 ARG CZ 1 1 25 14119 1 1 36 ARG H H 9.272 -5.026 0.818 1.00 . A A . 57 ARG H 1 1 25 14120 1 1 36 ARG HA H 7.558 -7.392 1.234 1.00 . A A . 57 ARG HA 1 1 25 14121 1 1 36 ARG HB2 H 6.690 -5.546 -0.543 1.00 . A A . 57 ARG HB2 1 1 25 14122 1 1 36 ARG HB3 H 7.877 -6.299 -1.581 1.00 . A A . 57 ARG HB3 1 1 25 14123 1 1 36 ARG HD2 H 4.440 -8.552 -0.307 1.00 . A A . 57 ARG HD2 1 1 25 14124 1 1 36 ARG HD3 H 5.801 -8.554 0.794 1.00 . A A . 57 ARG HD3 1 1 25 14125 1 1 36 ARG HE H 5.306 -6.355 1.514 1.00 . A A . 57 ARG HE 1 1 25 14126 1 1 36 ARG HG2 H 5.585 -7.170 -1.898 1.00 . A A . 57 ARG HG2 1 1 25 14127 1 1 36 ARG HG3 H 6.695 -8.450 -1.428 1.00 . A A . 57 ARG HG3 1 1 25 14128 1 1 36 ARG HH11 H 2.964 -7.256 -0.965 1.00 . A A . 57 ARG HH11 1 1 25 14129 1 1 36 ARG HH12 H 1.944 -5.885 -0.543 1.00 . A A . 57 ARG HH12 1 1 25 14130 1 1 36 ARG HH21 H 3.907 -4.707 1.943 1.00 . A A . 57 ARG HH21 1 1 25 14131 1 1 36 ARG HH22 H 2.441 -4.544 0.983 1.00 . A A . 57 ARG HH22 1 1 25 14132 1 1 36 ARG N N 8.458 -5.519 1.170 1.00 . A A . 57 ARG N 1 1 25 14133 1 1 36 ARG NE N 4.718 -6.753 0.791 1.00 . A A . 57 ARG NE 1 1 25 14134 1 1 36 ARG NH1 N 2.772 -6.447 -0.402 1.00 . A A . 57 ARG NH1 1 1 25 14135 1 1 36 ARG NH2 N 3.290 -5.039 1.222 1.00 . A A . 57 ARG NH2 1 1 25 14136 1 1 36 ARG O O 9.262 -8.514 -0.728 1.00 . A A . 57 ARG O 1 1 25 14137 1 1 37 SER C C 11.748 -9.555 0.589 1.00 . A A . 58 SER C 1 1 25 14138 1 1 37 SER CA C 11.810 -8.020 0.557 1.00 . A A . 58 SER CA 1 1 25 14139 1 1 37 SER CB C 12.812 -7.538 1.607 1.00 . A A . 58 SER CB 1 1 25 14140 1 1 37 SER H H 10.482 -6.615 1.442 1.00 . A A . 58 SER H 1 1 25 14141 1 1 37 SER HA H 12.194 -7.735 -0.422 1.00 . A A . 58 SER HA 1 1 25 14142 1 1 37 SER HB2 H 12.484 -7.862 2.598 1.00 . A A . 58 SER HB2 1 1 25 14143 1 1 37 SER HB3 H 13.789 -7.983 1.402 1.00 . A A . 58 SER HB3 1 1 25 14144 1 1 37 SER HG H 13.548 -5.837 2.250 1.00 . A A . 58 SER HG 1 1 25 14145 1 1 37 SER N N 10.504 -7.355 0.758 1.00 . A A . 58 SER N 1 1 25 14146 1 1 37 SER O O 12.331 -10.191 -0.318 1.00 . A A . 58 SER O 1 1 25 14147 1 1 37 SER OXT O 11.154 -10.118 1.538 1.00 . A A . 58 SER OXT 1 1 25 14148 1 1 37 SER OG O 12.907 -6.122 1.568 1.00 . A A . 58 SER OG 1 1 25 14149 2 2 1 ZN ZN ZN -8.510 0.458 3.412 1.00 . B A . 1059 ZN ZN 1 1 25 14150 3 2 1 ZN ZN ZN 6.900 1.058 2.015 1.00 . C A . 1060 ZN ZN 1 1 26 14151 1 1 1 GLN C C -6.557 -1.630 -4.524 1.00 . A A . 22 GLN C 1 1 26 14152 1 1 1 GLN CA C -6.414 -1.251 -5.998 1.00 . A A . 22 GLN CA 1 1 26 14153 1 1 1 GLN CB C -4.997 -0.720 -6.302 1.00 . A A . 22 GLN CB 1 1 26 14154 1 1 1 GLN CD C -2.518 -1.301 -6.504 1.00 . A A . 22 GLN CD 1 1 26 14155 1 1 1 GLN CG C -3.913 -1.799 -6.126 1.00 . A A . 22 GLN CG 1 1 26 14156 1 1 1 GLN H1 H -8.378 -0.643 -6.186 1.00 . A A . 22 GLN H1 1 1 26 14157 1 1 1 GLN H2 H -7.361 0.573 -5.789 1.00 . A A . 22 GLN H2 1 1 26 14158 1 1 1 GLN H3 H -7.388 -0.001 -7.333 1.00 . A A . 22 GLN H3 1 1 26 14159 1 1 1 GLN HA H -6.575 -2.150 -6.595 1.00 . A A . 22 GLN HA 1 1 26 14160 1 1 1 GLN HB2 H -4.966 -0.373 -7.337 1.00 . A A . 22 GLN HB2 1 1 26 14161 1 1 1 GLN HB3 H -4.778 0.127 -5.651 1.00 . A A . 22 GLN HB3 1 1 26 14162 1 1 1 GLN HE21 H -1.971 -3.079 -7.304 1.00 . A A . 22 GLN HE21 1 1 26 14163 1 1 1 GLN HE22 H -0.772 -1.793 -7.340 1.00 . A A . 22 GLN HE22 1 1 26 14164 1 1 1 GLN HG2 H -3.882 -2.139 -5.090 1.00 . A A . 22 GLN HG2 1 1 26 14165 1 1 1 GLN HG3 H -4.167 -2.654 -6.755 1.00 . A A . 22 GLN HG3 1 1 26 14166 1 1 1 GLN N N -7.457 -0.258 -6.360 1.00 . A A . 22 GLN N 1 1 26 14167 1 1 1 GLN NE2 N -1.690 -2.133 -7.096 1.00 . A A . 22 GLN NE2 1 1 26 14168 1 1 1 GLN O O -6.642 -0.744 -3.679 1.00 . A A . 22 GLN O 1 1 26 14169 1 1 1 GLN OE1 O -2.139 -0.163 -6.271 1.00 . A A . 22 GLN OE1 1 1 26 14170 1 1 2 THR C C -6.031 -2.843 -1.749 1.00 . A A . 23 THR C 1 1 26 14171 1 1 2 THR CA C -6.881 -3.471 -2.862 1.00 . A A . 23 THR CA 1 1 26 14172 1 1 2 THR CB C -6.700 -5.000 -2.867 1.00 . A A . 23 THR CB 1 1 26 14173 1 1 2 THR CG2 C -7.300 -5.686 -1.639 1.00 . A A . 23 THR CG2 1 1 26 14174 1 1 2 THR H H -6.546 -3.615 -4.950 1.00 . A A . 23 THR H 1 1 26 14175 1 1 2 THR HA H -7.923 -3.265 -2.633 1.00 . A A . 23 THR HA 1 1 26 14176 1 1 2 THR HB H -5.638 -5.238 -2.936 1.00 . A A . 23 THR HB 1 1 26 14177 1 1 2 THR HG1 H -7.152 -6.487 -4.038 1.00 . A A . 23 THR HG1 1 1 26 14178 1 1 2 THR HG21 H -8.362 -5.460 -1.571 1.00 . A A . 23 THR HG21 1 1 26 14179 1 1 2 THR HG22 H -7.172 -6.766 -1.726 1.00 . A A . 23 THR HG22 1 1 26 14180 1 1 2 THR HG23 H -6.791 -5.357 -0.735 1.00 . A A . 23 THR HG23 1 1 26 14181 1 1 2 THR N N -6.608 -2.927 -4.208 1.00 . A A . 23 THR N 1 1 26 14182 1 1 2 THR O O -4.832 -2.622 -1.923 1.00 . A A . 23 THR O 1 1 26 14183 1 1 2 THR OG1 O -7.365 -5.538 -3.992 1.00 . A A . 23 THR OG1 1 1 26 14184 1 1 3 CYS C C -4.872 -2.835 1.163 1.00 . A A . 24 CYS C 1 1 26 14185 1 1 3 CYS CA C -6.041 -1.999 0.599 1.00 . A A . 24 CYS CA 1 1 26 14186 1 1 3 CYS CB C -7.149 -1.884 1.652 1.00 . A A . 24 CYS CB 1 1 26 14187 1 1 3 CYS H H -7.655 -2.735 -0.565 1.00 . A A . 24 CYS H 1 1 26 14188 1 1 3 CYS HA H -5.682 -0.999 0.357 1.00 . A A . 24 CYS HA 1 1 26 14189 1 1 3 CYS HB2 H -8.051 -1.482 1.193 1.00 . A A . 24 CYS HB2 1 1 26 14190 1 1 3 CYS HB3 H -7.380 -2.879 2.034 1.00 . A A . 24 CYS HB3 1 1 26 14191 1 1 3 CYS N N -6.658 -2.572 -0.600 1.00 . A A . 24 CYS N 1 1 26 14192 1 1 3 CYS O O -4.865 -4.064 1.067 1.00 . A A . 24 CYS O 1 1 26 14193 1 1 3 CYS SG S -6.618 -0.795 2.997 1.00 . A A . 24 CYS SG 1 1 26 14194 1 1 4 TYR C C -3.546 -3.500 3.975 1.00 . A A . 25 TYR C 1 1 26 14195 1 1 4 TYR CA C -2.948 -2.824 2.722 1.00 . A A . 25 TYR CA 1 1 26 14196 1 1 4 TYR CB C -1.857 -1.818 3.129 1.00 . A A . 25 TYR CB 1 1 26 14197 1 1 4 TYR CD1 C -3.250 -0.080 4.372 1.00 . A A . 25 TYR CD1 1 1 26 14198 1 1 4 TYR CD2 C -1.328 -1.063 5.494 1.00 . A A . 25 TYR CD2 1 1 26 14199 1 1 4 TYR CE1 C -3.532 0.680 5.521 1.00 . A A . 25 TYR CE1 1 1 26 14200 1 1 4 TYR CE2 C -1.594 -0.286 6.641 1.00 . A A . 25 TYR CE2 1 1 26 14201 1 1 4 TYR CG C -2.151 -0.959 4.353 1.00 . A A . 25 TYR CG 1 1 26 14202 1 1 4 TYR CZ C -2.701 0.588 6.657 1.00 . A A . 25 TYR CZ 1 1 26 14203 1 1 4 TYR H H -4.020 -1.163 1.901 1.00 . A A . 25 TYR H 1 1 26 14204 1 1 4 TYR HA H -2.471 -3.612 2.143 1.00 . A A . 25 TYR HA 1 1 26 14205 1 1 4 TYR HB2 H -0.961 -2.400 3.338 1.00 . A A . 25 TYR HB2 1 1 26 14206 1 1 4 TYR HB3 H -1.623 -1.167 2.286 1.00 . A A . 25 TYR HB3 1 1 26 14207 1 1 4 TYR HD1 H -3.896 0.010 3.511 1.00 . A A . 25 TYR HD1 1 1 26 14208 1 1 4 TYR HD2 H -0.486 -1.743 5.494 1.00 . A A . 25 TYR HD2 1 1 26 14209 1 1 4 TYR HE1 H -4.394 1.321 5.547 1.00 . A A . 25 TYR HE1 1 1 26 14210 1 1 4 TYR HE2 H -0.958 -0.366 7.510 1.00 . A A . 25 TYR HE2 1 1 26 14211 1 1 4 TYR HH H -2.362 1.167 8.483 1.00 . A A . 25 TYR HH 1 1 26 14212 1 1 4 TYR N N -3.940 -2.171 1.854 1.00 . A A . 25 TYR N 1 1 26 14213 1 1 4 TYR O O -2.873 -4.314 4.612 1.00 . A A . 25 TYR O 1 1 26 14214 1 1 4 TYR OH O -2.987 1.336 7.758 1.00 . A A . 25 TYR OH 1 1 26 14215 1 1 5 ASN C C -6.872 -4.046 5.448 1.00 . A A . 26 ASN C 1 1 26 14216 1 1 5 ASN CA C -5.427 -3.536 5.606 1.00 . A A . 26 ASN CA 1 1 26 14217 1 1 5 ASN CB C -5.379 -2.279 6.498 1.00 . A A . 26 ASN CB 1 1 26 14218 1 1 5 ASN CG C -6.135 -2.452 7.805 1.00 . A A . 26 ASN CG 1 1 26 14219 1 1 5 ASN H H -5.269 -2.489 3.755 1.00 . A A . 26 ASN H 1 1 26 14220 1 1 5 ASN HA H -4.860 -4.330 6.098 1.00 . A A . 26 ASN HA 1 1 26 14221 1 1 5 ASN HB2 H -4.340 -2.045 6.731 1.00 . A A . 26 ASN HB2 1 1 26 14222 1 1 5 ASN HB3 H -5.799 -1.429 5.962 1.00 . A A . 26 ASN HB3 1 1 26 14223 1 1 5 ASN HD21 H -7.829 -1.610 7.060 1.00 . A A . 26 ASN HD21 1 1 26 14224 1 1 5 ASN HD22 H -7.878 -2.135 8.737 1.00 . A A . 26 ASN HD22 1 1 26 14225 1 1 5 ASN N N -4.796 -3.175 4.331 1.00 . A A . 26 ASN N 1 1 26 14226 1 1 5 ASN ND2 N -7.376 -2.017 7.871 1.00 . A A . 26 ASN ND2 1 1 26 14227 1 1 5 ASN O O -7.230 -5.079 6.016 1.00 . A A . 26 ASN O 1 1 26 14228 1 1 5 ASN OD1 O -5.624 -2.986 8.779 1.00 . A A . 26 ASN OD1 1 1 26 14229 1 1 6 CYS C C -9.642 -4.650 3.733 1.00 . A A . 27 CYS C 1 1 26 14230 1 1 6 CYS CA C -9.154 -3.499 4.647 1.00 . A A . 27 CYS CA 1 1 26 14231 1 1 6 CYS CB C -9.773 -2.155 4.225 1.00 . A A . 27 CYS CB 1 1 26 14232 1 1 6 CYS H H -7.339 -2.481 4.262 1.00 . A A . 27 CYS H 1 1 26 14233 1 1 6 CYS HA H -9.498 -3.720 5.659 1.00 . A A . 27 CYS HA 1 1 26 14234 1 1 6 CYS HB2 H -9.510 -1.945 3.187 1.00 . A A . 27 CYS HB2 1 1 26 14235 1 1 6 CYS HB3 H -10.861 -2.234 4.288 1.00 . A A . 27 CYS HB3 1 1 26 14236 1 1 6 CYS N N -7.700 -3.326 4.686 1.00 . A A . 27 CYS N 1 1 26 14237 1 1 6 CYS O O -10.828 -4.986 3.752 1.00 . A A . 27 CYS O 1 1 26 14238 1 1 6 CYS SG S -9.204 -0.806 5.308 1.00 . A A . 27 CYS SG 1 1 26 14239 1 1 7 GLY C C -10.141 -6.011 0.949 1.00 . A A . 28 GLY C 1 1 26 14240 1 1 7 GLY CA C -9.070 -6.348 2.001 1.00 . A A . 28 GLY CA 1 1 26 14241 1 1 7 GLY H H -7.790 -4.952 2.998 1.00 . A A . 28 GLY H 1 1 26 14242 1 1 7 GLY HA2 H -9.411 -7.209 2.576 1.00 . A A . 28 GLY HA2 1 1 26 14243 1 1 7 GLY HA3 H -8.160 -6.629 1.471 1.00 . A A . 28 GLY HA3 1 1 26 14244 1 1 7 GLY N N -8.752 -5.246 2.926 1.00 . A A . 28 GLY N 1 1 26 14245 1 1 7 GLY O O -10.929 -6.880 0.568 1.00 . A A . 28 GLY O 1 1 26 14246 1 1 8 LYS C C -10.732 -3.525 -1.594 1.00 . A A . 29 LYS C 1 1 26 14247 1 1 8 LYS CA C -11.286 -4.164 -0.302 1.00 . A A . 29 LYS CA 1 1 26 14248 1 1 8 LYS CB C -12.027 -3.152 0.596 1.00 . A A . 29 LYS CB 1 1 26 14249 1 1 8 LYS CD C -14.445 -3.488 -0.289 1.00 . A A . 29 LYS CD 1 1 26 14250 1 1 8 LYS CE C -14.944 -4.149 1.006 1.00 . A A . 29 LYS CE 1 1 26 14251 1 1 8 LYS CG C -13.281 -2.515 -0.031 1.00 . A A . 29 LYS CG 1 1 26 14252 1 1 8 LYS H H -9.501 -4.112 0.871 1.00 . A A . 29 LYS H 1 1 26 14253 1 1 8 LYS HA H -11.994 -4.950 -0.555 1.00 . A A . 29 LYS HA 1 1 26 14254 1 1 8 LYS HB2 H -12.309 -3.644 1.528 1.00 . A A . 29 LYS HB2 1 1 26 14255 1 1 8 LYS HB3 H -11.337 -2.356 0.867 1.00 . A A . 29 LYS HB3 1 1 26 14256 1 1 8 LYS HD2 H -15.264 -2.924 -0.738 1.00 . A A . 29 LYS HD2 1 1 26 14257 1 1 8 LYS HD3 H -14.136 -4.255 -0.999 1.00 . A A . 29 LYS HD3 1 1 26 14258 1 1 8 LYS HE2 H -14.132 -4.742 1.439 1.00 . A A . 29 LYS HE2 1 1 26 14259 1 1 8 LYS HE3 H -15.203 -3.364 1.722 1.00 . A A . 29 LYS HE3 1 1 26 14260 1 1 8 LYS HG2 H -13.635 -1.733 0.643 1.00 . A A . 29 LYS HG2 1 1 26 14261 1 1 8 LYS HG3 H -13.009 -2.034 -0.971 1.00 . A A . 29 LYS HG3 1 1 26 14262 1 1 8 LYS HZ1 H -15.907 -5.764 0.113 1.00 . A A . 29 LYS HZ1 1 1 26 14263 1 1 8 LYS HZ2 H -16.443 -5.447 1.620 1.00 . A A . 29 LYS HZ2 1 1 26 14264 1 1 8 LYS HZ3 H -16.898 -4.490 0.381 1.00 . A A . 29 LYS HZ3 1 1 26 14265 1 1 8 LYS N N -10.196 -4.745 0.505 1.00 . A A . 29 LYS N 1 1 26 14266 1 1 8 LYS NZ N -16.124 -5.018 0.762 1.00 . A A . 29 LYS NZ 1 1 26 14267 1 1 8 LYS O O -9.999 -2.538 -1.484 1.00 . A A . 29 LYS O 1 1 26 14268 1 1 9 PRO C C -10.624 -2.088 -4.394 1.00 . A A . 30 PRO C 1 1 26 14269 1 1 9 PRO CA C -10.505 -3.590 -4.093 1.00 . A A . 30 PRO CA 1 1 26 14270 1 1 9 PRO CB C -11.243 -4.406 -5.159 1.00 . A A . 30 PRO CB 1 1 26 14271 1 1 9 PRO CD C -11.812 -5.279 -3.015 1.00 . A A . 30 PRO CD 1 1 26 14272 1 1 9 PRO CG C -11.531 -5.722 -4.448 1.00 . A A . 30 PRO CG 1 1 26 14273 1 1 9 PRO HA H -9.452 -3.861 -4.139 1.00 . A A . 30 PRO HA 1 1 26 14274 1 1 9 PRO HB2 H -12.188 -3.925 -5.420 1.00 . A A . 30 PRO HB2 1 1 26 14275 1 1 9 PRO HB3 H -10.632 -4.555 -6.050 1.00 . A A . 30 PRO HB3 1 1 26 14276 1 1 9 PRO HD2 H -12.875 -5.060 -2.903 1.00 . A A . 30 PRO HD2 1 1 26 14277 1 1 9 PRO HD3 H -11.514 -6.073 -2.328 1.00 . A A . 30 PRO HD3 1 1 26 14278 1 1 9 PRO HG2 H -12.384 -6.243 -4.885 1.00 . A A . 30 PRO HG2 1 1 26 14279 1 1 9 PRO HG3 H -10.641 -6.353 -4.469 1.00 . A A . 30 PRO HG3 1 1 26 14280 1 1 9 PRO N N -11.038 -4.058 -2.800 1.00 . A A . 30 PRO N 1 1 26 14281 1 1 9 PRO O O -9.742 -1.527 -5.049 1.00 . A A . 30 PRO O 1 1 26 14282 1 1 10 GLY C C -11.102 1.008 -3.381 1.00 . A A . 31 GLY C 1 1 26 14283 1 1 10 GLY CA C -11.977 0.001 -4.145 1.00 . A A . 31 GLY CA 1 1 26 14284 1 1 10 GLY H H -12.358 -1.953 -3.386 1.00 . A A . 31 GLY H 1 1 26 14285 1 1 10 GLY HA2 H -13.019 0.191 -3.884 1.00 . A A . 31 GLY HA2 1 1 26 14286 1 1 10 GLY HA3 H -11.859 0.204 -5.211 1.00 . A A . 31 GLY HA3 1 1 26 14287 1 1 10 GLY N N -11.673 -1.421 -3.902 1.00 . A A . 31 GLY N 1 1 26 14288 1 1 10 GLY O O -11.554 2.118 -3.085 1.00 . A A . 31 GLY O 1 1 26 14289 1 1 11 HIS C C -7.962 2.228 -3.294 1.00 . A A . 32 HIS C 1 1 26 14290 1 1 11 HIS CA C -8.908 1.485 -2.338 1.00 . A A . 32 HIS CA 1 1 26 14291 1 1 11 HIS CB C -8.161 0.671 -1.272 1.00 . A A . 32 HIS CB 1 1 26 14292 1 1 11 HIS CD2 C -8.522 1.280 1.190 1.00 . A A . 32 HIS CD2 1 1 26 14293 1 1 11 HIS CE1 C -10.408 0.228 1.581 1.00 . A A . 32 HIS CE1 1 1 26 14294 1 1 11 HIS CG C -8.900 0.653 0.038 1.00 . A A . 32 HIS CG 1 1 26 14295 1 1 11 HIS H H -9.561 -0.287 -3.319 1.00 . A A . 32 HIS H 1 1 26 14296 1 1 11 HIS HA H -9.457 2.266 -1.815 1.00 . A A . 32 HIS HA 1 1 26 14297 1 1 11 HIS HB2 H -8.031 -0.355 -1.609 1.00 . A A . 32 HIS HB2 1 1 26 14298 1 1 11 HIS HB3 H -7.171 1.092 -1.100 1.00 . A A . 32 HIS HB3 1 1 26 14299 1 1 11 HIS HD1 H -10.575 -0.600 -0.353 1.00 . A A . 32 HIS HD1 1 1 26 14300 1 1 11 HIS HD2 H -7.634 1.884 1.310 1.00 . A A . 32 HIS HD2 1 1 26 14301 1 1 11 HIS HE1 H -11.288 -0.167 2.077 1.00 . A A . 32 HIS HE1 1 1 26 14302 1 1 11 HIS N N -9.874 0.628 -3.025 1.00 . A A . 32 HIS N 1 1 26 14303 1 1 11 HIS ND1 N -10.079 0.000 0.298 1.00 . A A . 32 HIS ND1 1 1 26 14304 1 1 11 HIS NE2 N -9.471 0.989 2.179 1.00 . A A . 32 HIS NE2 1 1 26 14305 1 1 11 HIS O O -7.828 1.908 -4.478 1.00 . A A . 32 HIS O 1 1 26 14306 1 1 12 LEU C C -5.468 4.810 -2.390 1.00 . A A . 33 LEU C 1 1 26 14307 1 1 12 LEU CA C -6.497 4.272 -3.401 1.00 . A A . 33 LEU CA 1 1 26 14308 1 1 12 LEU CB C -7.391 5.444 -3.883 1.00 . A A . 33 LEU CB 1 1 26 14309 1 1 12 LEU CD1 C -9.248 6.366 -5.291 1.00 . A A . 33 LEU CD1 1 1 26 14310 1 1 12 LEU CD2 C -7.645 4.791 -6.332 1.00 . A A . 33 LEU CD2 1 1 26 14311 1 1 12 LEU CG C -8.374 5.139 -5.031 1.00 . A A . 33 LEU CG 1 1 26 14312 1 1 12 LEU H H -7.440 3.386 -1.745 1.00 . A A . 33 LEU H 1 1 26 14313 1 1 12 LEU HA H -5.957 3.830 -4.240 1.00 . A A . 33 LEU HA 1 1 26 14314 1 1 12 LEU HB2 H -7.966 5.807 -3.030 1.00 . A A . 33 LEU HB2 1 1 26 14315 1 1 12 LEU HB3 H -6.755 6.265 -4.212 1.00 . A A . 33 LEU HB3 1 1 26 14316 1 1 12 LEU HD11 H -9.805 6.616 -4.388 1.00 . A A . 33 LEU HD11 1 1 26 14317 1 1 12 LEU HD12 H -8.628 7.217 -5.577 1.00 . A A . 33 LEU HD12 1 1 26 14318 1 1 12 LEU HD13 H -9.958 6.151 -6.089 1.00 . A A . 33 LEU HD13 1 1 26 14319 1 1 12 LEU HD21 H -6.979 5.605 -6.619 1.00 . A A . 33 LEU HD21 1 1 26 14320 1 1 12 LEU HD22 H -7.067 3.879 -6.206 1.00 . A A . 33 LEU HD22 1 1 26 14321 1 1 12 LEU HD23 H -8.374 4.628 -7.125 1.00 . A A . 33 LEU HD23 1 1 26 14322 1 1 12 LEU HG H -9.029 4.316 -4.752 1.00 . A A . 33 LEU HG 1 1 26 14323 1 1 12 LEU N N -7.335 3.268 -2.743 1.00 . A A . 33 LEU N 1 1 26 14324 1 1 12 LEU O O -5.600 4.586 -1.184 1.00 . A A . 33 LEU O 1 1 26 14325 1 1 13 SER C C -4.180 7.330 -1.015 1.00 . A A . 34 SER C 1 1 26 14326 1 1 13 SER CA C -3.548 6.392 -2.071 1.00 . A A . 34 SER CA 1 1 26 14327 1 1 13 SER CB C -2.678 7.195 -3.046 1.00 . A A . 34 SER CB 1 1 26 14328 1 1 13 SER H H -4.484 5.734 -3.876 1.00 . A A . 34 SER H 1 1 26 14329 1 1 13 SER HA H -2.905 5.689 -1.541 1.00 . A A . 34 SER HA 1 1 26 14330 1 1 13 SER HB2 H -2.315 6.530 -3.832 1.00 . A A . 34 SER HB2 1 1 26 14331 1 1 13 SER HB3 H -3.280 7.981 -3.505 1.00 . A A . 34 SER HB3 1 1 26 14332 1 1 13 SER HG H -1.071 8.302 -3.063 1.00 . A A . 34 SER HG 1 1 26 14333 1 1 13 SER N N -4.516 5.615 -2.873 1.00 . A A . 34 SER N 1 1 26 14334 1 1 13 SER O O -3.484 7.808 -0.115 1.00 . A A . 34 SER O 1 1 26 14335 1 1 13 SER OG O -1.558 7.773 -2.400 1.00 . A A . 34 SER OG 1 1 26 14336 1 1 14 SER C C -7.440 7.727 0.515 1.00 . A A . 35 SER C 1 1 26 14337 1 1 14 SER CA C -6.283 8.442 -0.209 1.00 . A A . 35 SER CA 1 1 26 14338 1 1 14 SER CB C -6.838 9.615 -1.025 1.00 . A A . 35 SER CB 1 1 26 14339 1 1 14 SER H H -5.970 7.234 -1.920 1.00 . A A . 35 SER H 1 1 26 14340 1 1 14 SER HA H -5.635 8.855 0.565 1.00 . A A . 35 SER HA 1 1 26 14341 1 1 14 SER HB2 H -7.451 10.252 -0.384 1.00 . A A . 35 SER HB2 1 1 26 14342 1 1 14 SER HB3 H -6.006 10.206 -1.412 1.00 . A A . 35 SER HB3 1 1 26 14343 1 1 14 SER HG H -7.961 9.895 -2.609 1.00 . A A . 35 SER HG 1 1 26 14344 1 1 14 SER N N -5.492 7.578 -1.103 1.00 . A A . 35 SER N 1 1 26 14345 1 1 14 SER O O -8.011 8.294 1.450 1.00 . A A . 35 SER O 1 1 26 14346 1 1 14 SER OG O -7.617 9.128 -2.112 1.00 . A A . 35 SER OG 1 1 26 14347 1 1 15 GLN C C -8.269 5.124 2.162 1.00 . A A . 36 GLN C 1 1 26 14348 1 1 15 GLN CA C -8.809 5.680 0.825 1.00 . A A . 36 GLN CA 1 1 26 14349 1 1 15 GLN CB C -9.265 4.541 -0.104 1.00 . A A . 36 GLN CB 1 1 26 14350 1 1 15 GLN CD C -11.806 4.714 -0.198 1.00 . A A . 36 GLN CD 1 1 26 14351 1 1 15 GLN CG C -10.609 3.908 0.303 1.00 . A A . 36 GLN CG 1 1 26 14352 1 1 15 GLN H H -7.250 6.054 -0.603 1.00 . A A . 36 GLN H 1 1 26 14353 1 1 15 GLN HA H -9.667 6.317 1.043 1.00 . A A . 36 GLN HA 1 1 26 14354 1 1 15 GLN HB2 H -9.363 4.917 -1.124 1.00 . A A . 36 GLN HB2 1 1 26 14355 1 1 15 GLN HB3 H -8.495 3.770 -0.109 1.00 . A A . 36 GLN HB3 1 1 26 14356 1 1 15 GLN HE21 H -12.013 3.593 -1.889 1.00 . A A . 36 GLN HE21 1 1 26 14357 1 1 15 GLN HE22 H -13.150 4.918 -1.669 1.00 . A A . 36 GLN HE22 1 1 26 14358 1 1 15 GLN HG2 H -10.677 2.908 -0.122 1.00 . A A . 36 GLN HG2 1 1 26 14359 1 1 15 GLN HG3 H -10.666 3.801 1.385 1.00 . A A . 36 GLN HG3 1 1 26 14360 1 1 15 GLN N N -7.787 6.488 0.133 1.00 . A A . 36 GLN N 1 1 26 14361 1 1 15 GLN NE2 N -12.360 4.381 -1.347 1.00 . A A . 36 GLN NE2 1 1 26 14362 1 1 15 GLN O O -8.973 5.139 3.174 1.00 . A A . 36 GLN O 1 1 26 14363 1 1 15 GLN OE1 O -12.259 5.663 0.429 1.00 . A A . 36 GLN OE1 1 1 26 14364 1 1 16 CYS C C -4.713 4.992 3.044 1.00 . A A . 37 CYS C 1 1 26 14365 1 1 16 CYS CA C -6.129 4.428 3.305 1.00 . A A . 37 CYS CA 1 1 26 14366 1 1 16 CYS CB C -6.085 2.908 3.556 1.00 . A A . 37 CYS CB 1 1 26 14367 1 1 16 CYS H H -6.505 4.795 1.270 1.00 . A A . 37 CYS H 1 1 26 14368 1 1 16 CYS HA H -6.522 4.926 4.189 1.00 . A A . 37 CYS HA 1 1 26 14369 1 1 16 CYS HB2 H -6.046 2.370 2.608 1.00 . A A . 37 CYS HB2 1 1 26 14370 1 1 16 CYS HB3 H -5.172 2.656 4.091 1.00 . A A . 37 CYS HB3 1 1 26 14371 1 1 16 CYS N N -6.990 4.725 2.156 1.00 . A A . 37 CYS N 1 1 26 14372 1 1 16 CYS O O -4.449 5.557 1.979 1.00 . A A . 37 CYS O 1 1 26 14373 1 1 16 CYS SG S -7.490 2.369 4.569 1.00 . A A . 37 CYS SG 1 1 26 14374 1 1 17 ARG C C -1.692 4.747 2.633 1.00 . A A . 38 ARG C 1 1 26 14375 1 1 17 ARG CA C -2.388 5.266 3.899 1.00 . A A . 38 ARG CA 1 1 26 14376 1 1 17 ARG CB C -1.581 4.858 5.146 1.00 . A A . 38 ARG CB 1 1 26 14377 1 1 17 ARG CD C -2.926 4.929 7.370 1.00 . A A . 38 ARG CD 1 1 26 14378 1 1 17 ARG CG C -1.905 5.616 6.449 1.00 . A A . 38 ARG CG 1 1 26 14379 1 1 17 ARG CZ C -5.373 4.464 7.053 1.00 . A A . 38 ARG CZ 1 1 26 14380 1 1 17 ARG H H -4.082 4.362 4.855 1.00 . A A . 38 ARG H 1 1 26 14381 1 1 17 ARG HA H -2.371 6.355 3.819 1.00 . A A . 38 ARG HA 1 1 26 14382 1 1 17 ARG HB2 H -1.671 3.783 5.309 1.00 . A A . 38 ARG HB2 1 1 26 14383 1 1 17 ARG HB3 H -0.533 5.064 4.925 1.00 . A A . 38 ARG HB3 1 1 26 14384 1 1 17 ARG HD2 H -2.756 3.853 7.340 1.00 . A A . 38 ARG HD2 1 1 26 14385 1 1 17 ARG HD3 H -2.732 5.262 8.393 1.00 . A A . 38 ARG HD3 1 1 26 14386 1 1 17 ARG HE H -4.519 6.245 6.873 1.00 . A A . 38 ARG HE 1 1 26 14387 1 1 17 ARG HG2 H -0.973 5.680 7.014 1.00 . A A . 38 ARG HG2 1 1 26 14388 1 1 17 ARG HG3 H -2.216 6.638 6.229 1.00 . A A . 38 ARG HG3 1 1 26 14389 1 1 17 ARG HH11 H -4.389 2.772 7.519 1.00 . A A . 38 ARG HH11 1 1 26 14390 1 1 17 ARG HH12 H -6.104 2.612 7.238 1.00 . A A . 38 ARG HH12 1 1 26 14391 1 1 17 ARG HH21 H -6.701 5.916 6.642 1.00 . A A . 38 ARG HH21 1 1 26 14392 1 1 17 ARG HH22 H -7.331 4.296 6.684 1.00 . A A . 38 ARG HH22 1 1 26 14393 1 1 17 ARG N N -3.792 4.823 4.005 1.00 . A A . 38 ARG N 1 1 26 14394 1 1 17 ARG NE N -4.326 5.270 7.044 1.00 . A A . 38 ARG NE 1 1 26 14395 1 1 17 ARG NH1 N -5.280 3.187 7.281 1.00 . A A . 38 ARG NH1 1 1 26 14396 1 1 17 ARG NH2 N -6.558 4.933 6.796 1.00 . A A . 38 ARG NH2 1 1 26 14397 1 1 17 ARG O O -0.950 5.503 2.006 1.00 . A A . 38 ARG O 1 1 26 14398 1 1 18 ALA C C -2.357 1.700 0.534 1.00 . A A . 39 ALA C 1 1 26 14399 1 1 18 ALA CA C -1.475 2.892 0.988 1.00 . A A . 39 ALA CA 1 1 26 14400 1 1 18 ALA CB C -0.035 2.406 1.222 1.00 . A A . 39 ALA CB 1 1 26 14401 1 1 18 ALA H H -2.575 2.945 2.805 1.00 . A A . 39 ALA H 1 1 26 14402 1 1 18 ALA HA H -1.475 3.651 0.205 1.00 . A A . 39 ALA HA 1 1 26 14403 1 1 18 ALA HB1 H -0.033 1.639 1.998 1.00 . A A . 39 ALA HB1 1 1 26 14404 1 1 18 ALA HB2 H 0.369 1.973 0.307 1.00 . A A . 39 ALA HB2 1 1 26 14405 1 1 18 ALA HB3 H 0.601 3.235 1.531 1.00 . A A . 39 ALA HB3 1 1 26 14406 1 1 18 ALA N N -1.958 3.500 2.233 1.00 . A A . 39 ALA N 1 1 26 14407 1 1 18 ALA O O -3.031 1.083 1.365 1.00 . A A . 39 ALA O 1 1 26 14408 1 1 19 PRO C C -1.790 -1.116 -0.801 1.00 . A A . 40 PRO C 1 1 26 14409 1 1 19 PRO CA C -2.774 0.000 -1.215 1.00 . A A . 40 PRO CA 1 1 26 14410 1 1 19 PRO CB C -2.880 0.139 -2.739 1.00 . A A . 40 PRO CB 1 1 26 14411 1 1 19 PRO CD C -1.756 2.072 -1.871 1.00 . A A . 40 PRO CD 1 1 26 14412 1 1 19 PRO CG C -1.767 1.131 -3.076 1.00 . A A . 40 PRO CG 1 1 26 14413 1 1 19 PRO HA H -3.759 -0.231 -0.809 1.00 . A A . 40 PRO HA 1 1 26 14414 1 1 19 PRO HB2 H -2.748 -0.807 -3.262 1.00 . A A . 40 PRO HB2 1 1 26 14415 1 1 19 PRO HB3 H -3.845 0.578 -2.995 1.00 . A A . 40 PRO HB3 1 1 26 14416 1 1 19 PRO HD2 H -0.735 2.398 -1.667 1.00 . A A . 40 PRO HD2 1 1 26 14417 1 1 19 PRO HD3 H -2.391 2.935 -2.076 1.00 . A A . 40 PRO HD3 1 1 26 14418 1 1 19 PRO HG2 H -0.813 0.606 -3.137 1.00 . A A . 40 PRO HG2 1 1 26 14419 1 1 19 PRO HG3 H -1.969 1.667 -4.002 1.00 . A A . 40 PRO HG3 1 1 26 14420 1 1 19 PRO N N -2.318 1.314 -0.758 1.00 . A A . 40 PRO N 1 1 26 14421 1 1 19 PRO O O -0.703 -0.848 -0.284 1.00 . A A . 40 PRO O 1 1 26 14422 1 1 20 LYS C C 0.066 -3.665 -1.233 1.00 . A A . 41 LYS C 1 1 26 14423 1 1 20 LYS CA C -1.399 -3.621 -0.763 1.00 . A A . 41 LYS CA 1 1 26 14424 1 1 20 LYS CB C -2.222 -4.810 -1.308 1.00 . A A . 41 LYS CB 1 1 26 14425 1 1 20 LYS CD C -1.868 -6.372 0.706 1.00 . A A . 41 LYS CD 1 1 26 14426 1 1 20 LYS CE C -1.784 -7.840 1.150 1.00 . A A . 41 LYS CE 1 1 26 14427 1 1 20 LYS CG C -1.814 -6.213 -0.824 1.00 . A A . 41 LYS CG 1 1 26 14428 1 1 20 LYS H H -3.060 -2.497 -1.508 1.00 . A A . 41 LYS H 1 1 26 14429 1 1 20 LYS HA H -1.356 -3.693 0.321 1.00 . A A . 41 LYS HA 1 1 26 14430 1 1 20 LYS HB2 H -3.266 -4.667 -1.030 1.00 . A A . 41 LYS HB2 1 1 26 14431 1 1 20 LYS HB3 H -2.175 -4.797 -2.399 1.00 . A A . 41 LYS HB3 1 1 26 14432 1 1 20 LYS HD2 H -1.060 -5.803 1.171 1.00 . A A . 41 LYS HD2 1 1 26 14433 1 1 20 LYS HD3 H -2.817 -5.970 1.065 1.00 . A A . 41 LYS HD3 1 1 26 14434 1 1 20 LYS HE2 H -1.971 -7.883 2.228 1.00 . A A . 41 LYS HE2 1 1 26 14435 1 1 20 LYS HE3 H -2.581 -8.402 0.655 1.00 . A A . 41 LYS HE3 1 1 26 14436 1 1 20 LYS HG2 H -2.506 -6.929 -1.272 1.00 . A A . 41 LYS HG2 1 1 26 14437 1 1 20 LYS HG3 H -0.813 -6.449 -1.185 1.00 . A A . 41 LYS HG3 1 1 26 14438 1 1 20 LYS HZ1 H 0.288 -7.967 1.317 1.00 . A A . 41 LYS HZ1 1 1 26 14439 1 1 20 LYS HZ2 H -0.437 -9.419 1.167 1.00 . A A . 41 LYS HZ2 1 1 26 14440 1 1 20 LYS HZ3 H -0.272 -8.464 -0.142 1.00 . A A . 41 LYS HZ3 1 1 26 14441 1 1 20 LYS N N -2.143 -2.378 -1.085 1.00 . A A . 41 LYS N 1 1 26 14442 1 1 20 LYS NZ N -0.462 -8.457 0.851 1.00 . A A . 41 LYS NZ 1 1 26 14443 1 1 20 LYS O O 0.840 -4.492 -0.751 1.00 . A A . 41 LYS O 1 1 26 14444 1 1 21 VAL C C 2.768 -2.125 -1.304 1.00 . A A . 42 VAL C 1 1 26 14445 1 1 21 VAL CA C 1.866 -2.477 -2.505 1.00 . A A . 42 VAL CA 1 1 26 14446 1 1 21 VAL CB C 1.887 -1.325 -3.535 1.00 . A A . 42 VAL CB 1 1 26 14447 1 1 21 VAL CG1 C 3.297 -0.996 -4.031 1.00 . A A . 42 VAL CG1 1 1 26 14448 1 1 21 VAL CG2 C 1.038 -1.655 -4.773 1.00 . A A . 42 VAL CG2 1 1 26 14449 1 1 21 VAL H H -0.239 -2.128 -2.461 1.00 . A A . 42 VAL H 1 1 26 14450 1 1 21 VAL HA H 2.281 -3.369 -2.977 1.00 . A A . 42 VAL HA 1 1 26 14451 1 1 21 VAL HB H 1.476 -0.429 -3.070 1.00 . A A . 42 VAL HB 1 1 26 14452 1 1 21 VAL HG11 H 3.760 -1.890 -4.453 1.00 . A A . 42 VAL HG11 1 1 26 14453 1 1 21 VAL HG12 H 3.255 -0.220 -4.796 1.00 . A A . 42 VAL HG12 1 1 26 14454 1 1 21 VAL HG13 H 3.909 -0.625 -3.212 1.00 . A A . 42 VAL HG13 1 1 26 14455 1 1 21 VAL HG21 H 1.404 -2.569 -5.243 1.00 . A A . 42 VAL HG21 1 1 26 14456 1 1 21 VAL HG22 H -0.008 -1.786 -4.500 1.00 . A A . 42 VAL HG22 1 1 26 14457 1 1 21 VAL HG23 H 1.095 -0.836 -5.490 1.00 . A A . 42 VAL HG23 1 1 26 14458 1 1 21 VAL N N 0.471 -2.752 -2.113 1.00 . A A . 42 VAL N 1 1 26 14459 1 1 21 VAL O O 3.929 -2.529 -1.277 1.00 . A A . 42 VAL O 1 1 26 14460 1 1 22 CYS C C 2.146 -0.724 2.085 1.00 . A A . 43 CYS C 1 1 26 14461 1 1 22 CYS CA C 2.999 -0.794 0.792 1.00 . A A . 43 CYS CA 1 1 26 14462 1 1 22 CYS CB C 3.488 0.583 0.287 1.00 . A A . 43 CYS CB 1 1 26 14463 1 1 22 CYS H H 1.253 -1.171 -0.362 1.00 . A A . 43 CYS H 1 1 26 14464 1 1 22 CYS HA H 3.875 -1.407 1.010 1.00 . A A . 43 CYS HA 1 1 26 14465 1 1 22 CYS HB2 H 3.920 0.453 -0.708 1.00 . A A . 43 CYS HB2 1 1 26 14466 1 1 22 CYS HB3 H 2.641 1.264 0.202 1.00 . A A . 43 CYS HB3 1 1 26 14467 1 1 22 CYS N N 2.241 -1.397 -0.310 1.00 . A A . 43 CYS N 1 1 26 14468 1 1 22 CYS O O 1.243 -1.534 2.299 1.00 . A A . 43 CYS O 1 1 26 14469 1 1 22 CYS SG S 4.759 1.294 1.372 1.00 . A A . 43 CYS SG 1 1 26 14470 1 1 23 PHE C C 1.687 2.157 4.369 1.00 . A A . 44 PHE C 1 1 26 14471 1 1 23 PHE CA C 1.685 0.629 4.138 1.00 . A A . 44 PHE CA 1 1 26 14472 1 1 23 PHE CB C 2.220 -0.104 5.381 1.00 . A A . 44 PHE CB 1 1 26 14473 1 1 23 PHE CD1 C 4.746 0.199 5.369 1.00 . A A . 44 PHE CD1 1 1 26 14474 1 1 23 PHE CD2 C 3.434 1.338 7.075 1.00 . A A . 44 PHE CD2 1 1 26 14475 1 1 23 PHE CE1 C 5.918 0.781 5.888 1.00 . A A . 44 PHE CE1 1 1 26 14476 1 1 23 PHE CE2 C 4.606 1.917 7.593 1.00 . A A . 44 PHE CE2 1 1 26 14477 1 1 23 PHE CG C 3.499 0.479 5.960 1.00 . A A . 44 PHE CG 1 1 26 14478 1 1 23 PHE CZ C 5.848 1.641 6.998 1.00 . A A . 44 PHE CZ 1 1 26 14479 1 1 23 PHE H H 3.272 0.773 2.709 1.00 . A A . 44 PHE H 1 1 26 14480 1 1 23 PHE HA H 0.646 0.329 3.989 1.00 . A A . 44 PHE HA 1 1 26 14481 1 1 23 PHE HB2 H 1.449 -0.065 6.151 1.00 . A A . 44 PHE HB2 1 1 26 14482 1 1 23 PHE HB3 H 2.378 -1.157 5.143 1.00 . A A . 44 PHE HB3 1 1 26 14483 1 1 23 PHE HD1 H 4.809 -0.458 4.513 1.00 . A A . 44 PHE HD1 1 1 26 14484 1 1 23 PHE HD2 H 2.479 1.565 7.531 1.00 . A A . 44 PHE HD2 1 1 26 14485 1 1 23 PHE HE1 H 6.874 0.568 5.431 1.00 . A A . 44 PHE HE1 1 1 26 14486 1 1 23 PHE HE2 H 4.551 2.579 8.447 1.00 . A A . 44 PHE HE2 1 1 26 14487 1 1 23 PHE HZ H 6.751 2.089 7.393 1.00 . A A . 44 PHE HZ 1 1 26 14488 1 1 23 PHE N N 2.458 0.229 2.959 1.00 . A A . 44 PHE N 1 1 26 14489 1 1 23 PHE O O 0.794 2.661 5.051 1.00 . A A . 44 PHE O 1 1 26 14490 1 1 24 LYS C C 3.638 5.027 2.873 1.00 . A A . 45 LYS C 1 1 26 14491 1 1 24 LYS CA C 2.821 4.354 3.987 1.00 . A A . 45 LYS CA 1 1 26 14492 1 1 24 LYS CB C 3.486 4.594 5.363 1.00 . A A . 45 LYS CB 1 1 26 14493 1 1 24 LYS CD C 2.479 6.913 5.834 1.00 . A A . 45 LYS CD 1 1 26 14494 1 1 24 LYS CE C 2.849 8.323 6.315 1.00 . A A . 45 LYS CE 1 1 26 14495 1 1 24 LYS CG C 3.754 6.063 5.731 1.00 . A A . 45 LYS CG 1 1 26 14496 1 1 24 LYS H H 3.353 2.412 3.250 1.00 . A A . 45 LYS H 1 1 26 14497 1 1 24 LYS HA H 1.836 4.820 3.984 1.00 . A A . 45 LYS HA 1 1 26 14498 1 1 24 LYS HB2 H 2.853 4.163 6.140 1.00 . A A . 45 LYS HB2 1 1 26 14499 1 1 24 LYS HB3 H 4.439 4.063 5.390 1.00 . A A . 45 LYS HB3 1 1 26 14500 1 1 24 LYS HD2 H 1.996 6.978 4.859 1.00 . A A . 45 LYS HD2 1 1 26 14501 1 1 24 LYS HD3 H 1.793 6.450 6.547 1.00 . A A . 45 LYS HD3 1 1 26 14502 1 1 24 LYS HE2 H 3.371 8.240 7.274 1.00 . A A . 45 LYS HE2 1 1 26 14503 1 1 24 LYS HE3 H 3.544 8.767 5.596 1.00 . A A . 45 LYS HE3 1 1 26 14504 1 1 24 LYS HG2 H 4.260 6.076 6.698 1.00 . A A . 45 LYS HG2 1 1 26 14505 1 1 24 LYS HG3 H 4.429 6.507 4.999 1.00 . A A . 45 LYS HG3 1 1 26 14506 1 1 24 LYS HZ1 H 1.160 9.298 5.591 1.00 . A A . 45 LYS HZ1 1 1 26 14507 1 1 24 LYS HZ2 H 1.006 8.811 7.147 1.00 . A A . 45 LYS HZ2 1 1 26 14508 1 1 24 LYS HZ3 H 1.913 10.114 6.783 1.00 . A A . 45 LYS HZ3 1 1 26 14509 1 1 24 LYS N N 2.661 2.897 3.805 1.00 . A A . 45 LYS N 1 1 26 14510 1 1 24 LYS NZ N 1.651 9.189 6.467 1.00 . A A . 45 LYS NZ 1 1 26 14511 1 1 24 LYS O O 3.157 5.986 2.269 1.00 . A A . 45 LYS O 1 1 26 14512 1 1 25 CYS C C 5.470 5.131 0.224 1.00 . A A . 46 CYS C 1 1 26 14513 1 1 25 CYS CA C 5.842 5.169 1.722 1.00 . A A . 46 CYS CA 1 1 26 14514 1 1 25 CYS CB C 7.246 4.566 1.976 1.00 . A A . 46 CYS CB 1 1 26 14515 1 1 25 CYS H H 5.198 3.784 3.178 1.00 . A A . 46 CYS H 1 1 26 14516 1 1 25 CYS HA H 5.900 6.224 1.996 1.00 . A A . 46 CYS HA 1 1 26 14517 1 1 25 CYS HB2 H 7.725 4.336 1.020 1.00 . A A . 46 CYS HB2 1 1 26 14518 1 1 25 CYS HB3 H 7.858 5.334 2.456 1.00 . A A . 46 CYS HB3 1 1 26 14519 1 1 25 CYS N N 4.855 4.545 2.610 1.00 . A A . 46 CYS N 1 1 26 14520 1 1 25 CYS O O 5.721 6.109 -0.484 1.00 . A A . 46 CYS O 1 1 26 14521 1 1 25 CYS SG S 7.261 3.084 3.032 1.00 . A A . 46 CYS SG 1 1 26 14522 1 1 26 LYS C C 4.950 4.347 -2.818 1.00 . A A . 47 LYS C 1 1 26 14523 1 1 26 LYS CA C 4.203 3.828 -1.564 1.00 . A A . 47 LYS CA 1 1 26 14524 1 1 26 LYS CB C 2.716 4.241 -1.477 1.00 . A A . 47 LYS CB 1 1 26 14525 1 1 26 LYS CD C 1.012 6.010 -0.829 1.00 . A A . 47 LYS CD 1 1 26 14526 1 1 26 LYS CE C 0.897 7.416 -0.227 1.00 . A A . 47 LYS CE 1 1 26 14527 1 1 26 LYS CG C 2.472 5.737 -1.208 1.00 . A A . 47 LYS CG 1 1 26 14528 1 1 26 LYS H H 4.711 3.297 0.441 1.00 . A A . 47 LYS H 1 1 26 14529 1 1 26 LYS HA H 4.187 2.750 -1.720 1.00 . A A . 47 LYS HA 1 1 26 14530 1 1 26 LYS HB2 H 2.201 3.958 -2.397 1.00 . A A . 47 LYS HB2 1 1 26 14531 1 1 26 LYS HB3 H 2.265 3.665 -0.667 1.00 . A A . 47 LYS HB3 1 1 26 14532 1 1 26 LYS HD2 H 0.378 5.918 -1.712 1.00 . A A . 47 LYS HD2 1 1 26 14533 1 1 26 LYS HD3 H 0.693 5.283 -0.082 1.00 . A A . 47 LYS HD3 1 1 26 14534 1 1 26 LYS HE2 H 1.597 7.491 0.611 1.00 . A A . 47 LYS HE2 1 1 26 14535 1 1 26 LYS HE3 H 1.187 8.153 -0.981 1.00 . A A . 47 LYS HE3 1 1 26 14536 1 1 26 LYS HG2 H 3.089 6.062 -0.376 1.00 . A A . 47 LYS HG2 1 1 26 14537 1 1 26 LYS HG3 H 2.739 6.323 -2.088 1.00 . A A . 47 LYS HG3 1 1 26 14538 1 1 26 LYS HZ1 H -0.775 6.978 0.914 1.00 . A A . 47 LYS HZ1 1 1 26 14539 1 1 26 LYS HZ2 H -0.547 8.590 0.700 1.00 . A A . 47 LYS HZ2 1 1 26 14540 1 1 26 LYS HZ3 H -1.134 7.686 -0.530 1.00 . A A . 47 LYS HZ3 1 1 26 14541 1 1 26 LYS N N 4.840 4.039 -0.240 1.00 . A A . 47 LYS N 1 1 26 14542 1 1 26 LYS NZ N -0.480 7.688 0.250 1.00 . A A . 47 LYS NZ 1 1 26 14543 1 1 26 LYS O O 4.323 4.638 -3.838 1.00 . A A . 47 LYS O 1 1 26 14544 1 1 27 GLN C C 7.156 3.766 -5.025 1.00 . A A . 48 GLN C 1 1 26 14545 1 1 27 GLN CA C 7.127 4.842 -3.909 1.00 . A A . 48 GLN CA 1 1 26 14546 1 1 27 GLN CB C 8.560 5.152 -3.424 1.00 . A A . 48 GLN CB 1 1 26 14547 1 1 27 GLN CD C 8.038 7.584 -2.841 1.00 . A A . 48 GLN CD 1 1 26 14548 1 1 27 GLN CG C 8.652 6.267 -2.369 1.00 . A A . 48 GLN CG 1 1 26 14549 1 1 27 GLN H H 6.733 4.208 -1.898 1.00 . A A . 48 GLN H 1 1 26 14550 1 1 27 GLN HA H 6.697 5.755 -4.316 1.00 . A A . 48 GLN HA 1 1 26 14551 1 1 27 GLN HB2 H 8.998 4.249 -3.004 1.00 . A A . 48 GLN HB2 1 1 26 14552 1 1 27 GLN HB3 H 9.168 5.445 -4.280 1.00 . A A . 48 GLN HB3 1 1 26 14553 1 1 27 GLN HE21 H 6.440 7.395 -1.615 1.00 . A A . 48 GLN HE21 1 1 26 14554 1 1 27 GLN HE22 H 6.494 8.844 -2.623 1.00 . A A . 48 GLN HE22 1 1 26 14555 1 1 27 GLN HG2 H 8.173 5.940 -1.448 1.00 . A A . 48 GLN HG2 1 1 26 14556 1 1 27 GLN HG3 H 9.704 6.441 -2.137 1.00 . A A . 48 GLN HG3 1 1 26 14557 1 1 27 GLN N N 6.284 4.439 -2.769 1.00 . A A . 48 GLN N 1 1 26 14558 1 1 27 GLN NE2 N 6.898 7.975 -2.314 1.00 . A A . 48 GLN NE2 1 1 26 14559 1 1 27 GLN O O 7.043 2.578 -4.700 1.00 . A A . 48 GLN O 1 1 26 14560 1 1 27 GLN OE1 O 8.565 8.275 -3.703 1.00 . A A . 48 GLN OE1 1 1 26 14561 1 1 28 PRO C C 7.808 1.885 -7.545 1.00 . A A . 49 PRO C 1 1 26 14562 1 1 28 PRO CA C 7.141 3.274 -7.492 1.00 . A A . 49 PRO CA 1 1 26 14563 1 1 28 PRO CB C 7.606 4.106 -8.693 1.00 . A A . 49 PRO CB 1 1 26 14564 1 1 28 PRO CD C 7.616 5.504 -6.764 1.00 . A A . 49 PRO CD 1 1 26 14565 1 1 28 PRO CG C 7.321 5.536 -8.262 1.00 . A A . 49 PRO CG 1 1 26 14566 1 1 28 PRO HA H 6.065 3.120 -7.587 1.00 . A A . 49 PRO HA 1 1 26 14567 1 1 28 PRO HB2 H 8.680 3.982 -8.843 1.00 . A A . 49 PRO HB2 1 1 26 14568 1 1 28 PRO HB3 H 7.062 3.843 -9.602 1.00 . A A . 49 PRO HB3 1 1 26 14569 1 1 28 PRO HD2 H 8.667 5.742 -6.597 1.00 . A A . 49 PRO HD2 1 1 26 14570 1 1 28 PRO HD3 H 6.983 6.239 -6.269 1.00 . A A . 49 PRO HD3 1 1 26 14571 1 1 28 PRO HG2 H 7.954 6.253 -8.784 1.00 . A A . 49 PRO HG2 1 1 26 14572 1 1 28 PRO HG3 H 6.266 5.764 -8.423 1.00 . A A . 49 PRO HG3 1 1 26 14573 1 1 28 PRO N N 7.350 4.137 -6.313 1.00 . A A . 49 PRO N 1 1 26 14574 1 1 28 PRO O O 7.333 1.026 -8.292 1.00 . A A . 49 PRO O 1 1 26 14575 1 1 29 GLY C C 10.435 0.039 -5.558 1.00 . A A . 50 GLY C 1 1 26 14576 1 1 29 GLY CA C 9.622 0.362 -6.817 1.00 . A A . 50 GLY CA 1 1 26 14577 1 1 29 GLY H H 9.274 2.414 -6.268 1.00 . A A . 50 GLY H 1 1 26 14578 1 1 29 GLY HA2 H 10.303 0.360 -7.668 1.00 . A A . 50 GLY HA2 1 1 26 14579 1 1 29 GLY HA3 H 8.912 -0.454 -6.952 1.00 . A A . 50 GLY HA3 1 1 26 14580 1 1 29 GLY N N 8.890 1.643 -6.796 1.00 . A A . 50 GLY N 1 1 26 14581 1 1 29 GLY O O 11.328 -0.808 -5.607 1.00 . A A . 50 GLY O 1 1 26 14582 1 1 30 HIS C C 10.488 -0.756 -2.404 1.00 . A A . 51 HIS C 1 1 26 14583 1 1 30 HIS CA C 10.891 0.526 -3.165 1.00 . A A . 51 HIS CA 1 1 26 14584 1 1 30 HIS CB C 10.647 1.760 -2.275 1.00 . A A . 51 HIS CB 1 1 26 14585 1 1 30 HIS CD2 C 9.144 1.578 -0.209 1.00 . A A . 51 HIS CD2 1 1 26 14586 1 1 30 HIS CE1 C 7.156 1.573 -1.144 1.00 . A A . 51 HIS CE1 1 1 26 14587 1 1 30 HIS CG C 9.314 1.756 -1.556 1.00 . A A . 51 HIS CG 1 1 26 14588 1 1 30 HIS H H 9.438 1.410 -4.469 1.00 . A A . 51 HIS H 1 1 26 14589 1 1 30 HIS HA H 11.959 0.467 -3.375 1.00 . A A . 51 HIS HA 1 1 26 14590 1 1 30 HIS HB2 H 11.435 1.790 -1.520 1.00 . A A . 51 HIS HB2 1 1 26 14591 1 1 30 HIS HB3 H 10.741 2.669 -2.870 1.00 . A A . 51 HIS HB3 1 1 26 14592 1 1 30 HIS HD1 H 7.812 1.914 -3.099 1.00 . A A . 51 HIS HD1 1 1 26 14593 1 1 30 HIS HD2 H 9.938 1.479 0.521 1.00 . A A . 51 HIS HD2 1 1 26 14594 1 1 30 HIS HE1 H 6.086 1.509 -1.290 1.00 . A A . 51 HIS HE1 1 1 26 14595 1 1 30 HIS N N 10.170 0.717 -4.435 1.00 . A A . 51 HIS N 1 1 26 14596 1 1 30 HIS ND1 N 8.054 1.765 -2.122 1.00 . A A . 51 HIS ND1 1 1 26 14597 1 1 30 HIS NE2 N 7.772 1.468 0.045 1.00 . A A . 51 HIS NE2 1 1 26 14598 1 1 30 HIS O O 11.284 -1.331 -1.658 1.00 . A A . 51 HIS O 1 1 26 14599 1 1 31 PHE C C 9.225 -3.525 -1.640 1.00 . A A . 52 PHE C 1 1 26 14600 1 1 31 PHE CA C 8.548 -2.150 -1.699 1.00 . A A . 52 PHE CA 1 1 26 14601 1 1 31 PHE CB C 7.071 -2.244 -2.119 1.00 . A A . 52 PHE CB 1 1 26 14602 1 1 31 PHE CD1 C 6.858 -3.458 -4.347 1.00 . A A . 52 PHE CD1 1 1 26 14603 1 1 31 PHE CD2 C 6.559 -1.042 -4.293 1.00 . A A . 52 PHE CD2 1 1 26 14604 1 1 31 PHE CE1 C 6.659 -3.447 -5.739 1.00 . A A . 52 PHE CE1 1 1 26 14605 1 1 31 PHE CE2 C 6.349 -1.035 -5.682 1.00 . A A . 52 PHE CE2 1 1 26 14606 1 1 31 PHE CG C 6.817 -2.252 -3.619 1.00 . A A . 52 PHE CG 1 1 26 14607 1 1 31 PHE CZ C 6.405 -2.237 -6.408 1.00 . A A . 52 PHE CZ 1 1 26 14608 1 1 31 PHE H H 8.667 -0.699 -3.242 1.00 . A A . 52 PHE H 1 1 26 14609 1 1 31 PHE HA H 8.568 -1.757 -0.681 1.00 . A A . 52 PHE HA 1 1 26 14610 1 1 31 PHE HB2 H 6.628 -3.134 -1.677 1.00 . A A . 52 PHE HB2 1 1 26 14611 1 1 31 PHE HB3 H 6.547 -1.387 -1.693 1.00 . A A . 52 PHE HB3 1 1 26 14612 1 1 31 PHE HD1 H 7.051 -4.394 -3.842 1.00 . A A . 52 PHE HD1 1 1 26 14613 1 1 31 PHE HD2 H 6.497 -0.114 -3.743 1.00 . A A . 52 PHE HD2 1 1 26 14614 1 1 31 PHE HE1 H 6.703 -4.374 -6.297 1.00 . A A . 52 PHE HE1 1 1 26 14615 1 1 31 PHE HE2 H 6.134 -0.105 -6.190 1.00 . A A . 52 PHE HE2 1 1 26 14616 1 1 31 PHE HZ H 6.247 -2.229 -7.478 1.00 . A A . 52 PHE HZ 1 1 26 14617 1 1 31 PHE N N 9.236 -1.191 -2.570 1.00 . A A . 52 PHE N 1 1 26 14618 1 1 31 PHE O O 9.407 -4.064 -0.548 1.00 . A A . 52 PHE O 1 1 26 14619 1 1 32 SER C C 11.751 -5.407 -2.126 1.00 . A A . 53 SER C 1 1 26 14620 1 1 32 SER CA C 10.403 -5.345 -2.874 1.00 . A A . 53 SER CA 1 1 26 14621 1 1 32 SER CB C 10.638 -5.692 -4.350 1.00 . A A . 53 SER CB 1 1 26 14622 1 1 32 SER H H 9.486 -3.574 -3.638 1.00 . A A . 53 SER H 1 1 26 14623 1 1 32 SER HA H 9.764 -6.117 -2.445 1.00 . A A . 53 SER HA 1 1 26 14624 1 1 32 SER HB2 H 11.338 -4.975 -4.783 1.00 . A A . 53 SER HB2 1 1 26 14625 1 1 32 SER HB3 H 11.070 -6.692 -4.423 1.00 . A A . 53 SER HB3 1 1 26 14626 1 1 32 SER HG H 9.599 -5.922 -5.997 1.00 . A A . 53 SER HG 1 1 26 14627 1 1 32 SER N N 9.696 -4.053 -2.773 1.00 . A A . 53 SER N 1 1 26 14628 1 1 32 SER O O 12.387 -6.464 -2.095 1.00 . A A . 53 SER O 1 1 26 14629 1 1 32 SER OG O 9.417 -5.656 -5.074 1.00 . A A . 53 SER OG 1 1 26 14630 1 1 33 LYS C C 13.295 -3.505 0.582 1.00 . A A . 54 LYS C 1 1 26 14631 1 1 33 LYS CA C 13.476 -4.108 -0.825 1.00 . A A . 54 LYS CA 1 1 26 14632 1 1 33 LYS CB C 14.406 -3.240 -1.697 1.00 . A A . 54 LYS CB 1 1 26 14633 1 1 33 LYS CD C 15.195 -2.983 -4.125 1.00 . A A . 54 LYS CD 1 1 26 14634 1 1 33 LYS CE C 13.889 -2.404 -4.688 1.00 . A A . 54 LYS CE 1 1 26 14635 1 1 33 LYS CG C 14.885 -3.955 -2.977 1.00 . A A . 54 LYS CG 1 1 26 14636 1 1 33 LYS H H 11.624 -3.457 -1.651 1.00 . A A . 54 LYS H 1 1 26 14637 1 1 33 LYS HA H 13.947 -5.081 -0.672 1.00 . A A . 54 LYS HA 1 1 26 14638 1 1 33 LYS HB2 H 13.878 -2.318 -1.945 1.00 . A A . 54 LYS HB2 1 1 26 14639 1 1 33 LYS HB3 H 15.293 -2.958 -1.127 1.00 . A A . 54 LYS HB3 1 1 26 14640 1 1 33 LYS HD2 H 15.844 -2.181 -3.765 1.00 . A A . 54 LYS HD2 1 1 26 14641 1 1 33 LYS HD3 H 15.715 -3.529 -4.913 1.00 . A A . 54 LYS HD3 1 1 26 14642 1 1 33 LYS HE2 H 13.242 -3.231 -4.994 1.00 . A A . 54 LYS HE2 1 1 26 14643 1 1 33 LYS HE3 H 13.369 -1.856 -3.897 1.00 . A A . 54 LYS HE3 1 1 26 14644 1 1 33 LYS HG2 H 15.787 -4.522 -2.737 1.00 . A A . 54 LYS HG2 1 1 26 14645 1 1 33 LYS HG3 H 14.138 -4.663 -3.332 1.00 . A A . 54 LYS HG3 1 1 26 14646 1 1 33 LYS HZ1 H 14.723 -0.729 -5.596 1.00 . A A . 54 LYS HZ1 1 1 26 14647 1 1 33 LYS HZ2 H 14.541 -1.994 -6.620 1.00 . A A . 54 LYS HZ2 1 1 26 14648 1 1 33 LYS HZ3 H 13.233 -1.119 -6.154 1.00 . A A . 54 LYS HZ3 1 1 26 14649 1 1 33 LYS N N 12.198 -4.284 -1.542 1.00 . A A . 54 LYS N 1 1 26 14650 1 1 33 LYS NZ N 14.121 -1.502 -5.843 1.00 . A A . 54 LYS NZ 1 1 26 14651 1 1 33 LYS O O 14.293 -3.222 1.250 1.00 . A A . 54 LYS O 1 1 26 14652 1 1 34 GLN C C 10.416 -3.331 2.946 1.00 . A A . 55 GLN C 1 1 26 14653 1 1 34 GLN CA C 11.752 -2.797 2.391 1.00 . A A . 55 GLN CA 1 1 26 14654 1 1 34 GLN CB C 11.762 -1.255 2.349 1.00 . A A . 55 GLN CB 1 1 26 14655 1 1 34 GLN CD C 11.535 0.898 3.665 1.00 . A A . 55 GLN CD 1 1 26 14656 1 1 34 GLN CG C 11.610 -0.625 3.741 1.00 . A A . 55 GLN CG 1 1 26 14657 1 1 34 GLN H H 11.286 -3.626 0.470 1.00 . A A . 55 GLN H 1 1 26 14658 1 1 34 GLN HA H 12.535 -3.122 3.078 1.00 . A A . 55 GLN HA 1 1 26 14659 1 1 34 GLN HB2 H 12.708 -0.915 1.922 1.00 . A A . 55 GLN HB2 1 1 26 14660 1 1 34 GLN HB3 H 10.959 -0.900 1.700 1.00 . A A . 55 GLN HB3 1 1 26 14661 1 1 34 GLN HE21 H 9.522 0.872 3.501 1.00 . A A . 55 GLN HE21 1 1 26 14662 1 1 34 GLN HE22 H 10.277 2.460 3.514 1.00 . A A . 55 GLN HE22 1 1 26 14663 1 1 34 GLN HG2 H 10.703 -0.994 4.220 1.00 . A A . 55 GLN HG2 1 1 26 14664 1 1 34 GLN HG3 H 12.461 -0.909 4.362 1.00 . A A . 55 GLN HG3 1 1 26 14665 1 1 34 GLN N N 12.053 -3.310 1.046 1.00 . A A . 55 GLN N 1 1 26 14666 1 1 34 GLN NE2 N 10.350 1.456 3.547 1.00 . A A . 55 GLN NE2 1 1 26 14667 1 1 34 GLN O O 10.405 -4.050 3.949 1.00 . A A . 55 GLN O 1 1 26 14668 1 1 34 GLN OE1 O 12.532 1.607 3.706 1.00 . A A . 55 GLN OE1 1 1 26 14669 1 1 35 CYS C C 7.287 -4.501 2.514 1.00 . A A . 56 CYS C 1 1 26 14670 1 1 35 CYS CA C 7.944 -3.147 2.856 1.00 . A A . 56 CYS CA 1 1 26 14671 1 1 35 CYS CB C 7.082 -1.984 2.338 1.00 . A A . 56 CYS CB 1 1 26 14672 1 1 35 CYS H H 9.382 -2.366 1.513 1.00 . A A . 56 CYS H 1 1 26 14673 1 1 35 CYS HA H 7.992 -3.071 3.944 1.00 . A A . 56 CYS HA 1 1 26 14674 1 1 35 CYS HB2 H 6.988 -2.048 1.251 1.00 . A A . 56 CYS HB2 1 1 26 14675 1 1 35 CYS HB3 H 6.083 -2.057 2.773 1.00 . A A . 56 CYS HB3 1 1 26 14676 1 1 35 CYS N N 9.294 -2.978 2.308 1.00 . A A . 56 CYS N 1 1 26 14677 1 1 35 CYS O O 6.318 -4.901 3.163 1.00 . A A . 56 CYS O 1 1 26 14678 1 1 35 CYS SG S 7.839 -0.408 2.813 1.00 . A A . 56 CYS SG 1 1 26 14679 1 1 36 ARG C C 8.221 -7.440 0.430 1.00 . A A . 57 ARG C 1 1 26 14680 1 1 36 ARG CA C 7.180 -6.386 0.864 1.00 . A A . 57 ARG CA 1 1 26 14681 1 1 36 ARG CB C 6.295 -5.926 -0.322 1.00 . A A . 57 ARG CB 1 1 26 14682 1 1 36 ARG CD C 3.764 -5.884 0.135 1.00 . A A . 57 ARG CD 1 1 26 14683 1 1 36 ARG CG C 4.958 -6.690 -0.407 1.00 . A A . 57 ARG CG 1 1 26 14684 1 1 36 ARG CZ C 3.218 -4.523 2.160 1.00 . A A . 57 ARG CZ 1 1 26 14685 1 1 36 ARG H H 8.555 -4.752 0.982 1.00 . A A . 57 ARG H 1 1 26 14686 1 1 36 ARG HA H 6.563 -6.882 1.615 1.00 . A A . 57 ARG HA 1 1 26 14687 1 1 36 ARG HB2 H 6.079 -4.859 -0.241 1.00 . A A . 57 ARG HB2 1 1 26 14688 1 1 36 ARG HB3 H 6.844 -6.059 -1.255 1.00 . A A . 57 ARG HB3 1 1 26 14689 1 1 36 ARG HD2 H 3.581 -5.051 -0.546 1.00 . A A . 57 ARG HD2 1 1 26 14690 1 1 36 ARG HD3 H 2.881 -6.525 0.133 1.00 . A A . 57 ARG HD3 1 1 26 14691 1 1 36 ARG HE H 4.883 -5.553 1.933 1.00 . A A . 57 ARG HE 1 1 26 14692 1 1 36 ARG HG2 H 4.756 -6.913 -1.456 1.00 . A A . 57 ARG HG2 1 1 26 14693 1 1 36 ARG HG3 H 5.029 -7.639 0.123 1.00 . A A . 57 ARG HG3 1 1 26 14694 1 1 36 ARG HH11 H 1.747 -4.479 0.815 1.00 . A A . 57 ARG HH11 1 1 26 14695 1 1 36 ARG HH12 H 1.577 -3.370 2.153 1.00 . A A . 57 ARG HH12 1 1 26 14696 1 1 36 ARG HH21 H 4.545 -4.280 3.624 1.00 . A A . 57 ARG HH21 1 1 26 14697 1 1 36 ARG HH22 H 3.017 -3.436 3.836 1.00 . A A . 57 ARG HH22 1 1 26 14698 1 1 36 ARG N N 7.785 -5.190 1.481 1.00 . A A . 57 ARG N 1 1 26 14699 1 1 36 ARG NE N 3.993 -5.356 1.494 1.00 . A A . 57 ARG NE 1 1 26 14700 1 1 36 ARG NH1 N 2.051 -4.155 1.724 1.00 . A A . 57 ARG NH1 1 1 26 14701 1 1 36 ARG NH2 N 3.619 -4.029 3.294 1.00 . A A . 57 ARG NH2 1 1 26 14702 1 1 36 ARG O O 7.900 -8.334 -0.356 1.00 . A A . 57 ARG O 1 1 26 14703 1 1 37 SER C C 10.333 -9.687 0.767 1.00 . A A . 58 SER C 1 1 26 14704 1 1 37 SER CA C 10.628 -8.184 0.664 1.00 . A A . 58 SER CA 1 1 26 14705 1 1 37 SER CB C 11.765 -7.827 1.624 1.00 . A A . 58 SER CB 1 1 26 14706 1 1 37 SER H H 9.621 -6.536 1.545 1.00 . A A . 58 SER H 1 1 26 14707 1 1 37 SER HA H 10.980 -7.993 -0.349 1.00 . A A . 58 SER HA 1 1 26 14708 1 1 37 SER HB2 H 11.477 -8.098 2.644 1.00 . A A . 58 SER HB2 1 1 26 14709 1 1 37 SER HB3 H 12.656 -8.399 1.354 1.00 . A A . 58 SER HB3 1 1 26 14710 1 1 37 SER HG H 12.753 -6.233 2.197 1.00 . A A . 58 SER HG 1 1 26 14711 1 1 37 SER N N 9.460 -7.314 0.924 1.00 . A A . 58 SER N 1 1 26 14712 1 1 37 SER O O 10.717 -10.432 -0.166 1.00 . A A . 58 SER O 1 1 26 14713 1 1 37 SER OXT O 9.755 -10.126 1.788 1.00 . A A . 58 SER OXT 1 1 26 14714 1 1 37 SER OG O 12.040 -6.435 1.558 1.00 . A A . 58 SER OG 1 1 26 14715 2 2 1 ZN ZN ZN -8.231 0.474 3.826 1.00 . B A . 1059 ZN ZN 1 1 26 14716 3 2 1 ZN ZN ZN 6.872 1.278 1.899 1.00 . C A . 1060 ZN ZN 1 1 27 14717 1 1 1 GLN C C -6.175 -1.764 -4.417 1.00 . A A . 22 GLN C 1 1 27 14718 1 1 1 GLN CA C -5.860 -1.431 -5.872 1.00 . A A . 22 GLN CA 1 1 27 14719 1 1 1 GLN CB C -4.434 -0.845 -5.978 1.00 . A A . 22 GLN CB 1 1 27 14720 1 1 1 GLN CD C -3.532 -2.188 -7.982 1.00 . A A . 22 GLN CD 1 1 27 14721 1 1 1 GLN CG C -3.854 -0.807 -7.406 1.00 . A A . 22 GLN CG 1 1 27 14722 1 1 1 GLN H1 H -7.814 -0.923 -6.308 1.00 . A A . 22 GLN H1 1 1 27 14723 1 1 1 GLN H2 H -6.894 0.357 -5.883 1.00 . A A . 22 GLN H2 1 1 27 14724 1 1 1 GLN H3 H -6.733 -0.306 -7.382 1.00 . A A . 22 GLN H3 1 1 27 14725 1 1 1 GLN HA H -5.897 -2.365 -6.432 1.00 . A A . 22 GLN HA 1 1 27 14726 1 1 1 GLN HB2 H -4.434 0.169 -5.576 1.00 . A A . 22 GLN HB2 1 1 27 14727 1 1 1 GLN HB3 H -3.758 -1.440 -5.361 1.00 . A A . 22 GLN HB3 1 1 27 14728 1 1 1 GLN HE21 H -2.116 -1.467 -9.234 1.00 . A A . 22 GLN HE21 1 1 27 14729 1 1 1 GLN HE22 H -2.400 -3.204 -9.279 1.00 . A A . 22 GLN HE22 1 1 27 14730 1 1 1 GLN HG2 H -4.535 -0.287 -8.081 1.00 . A A . 22 GLN HG2 1 1 27 14731 1 1 1 GLN HG3 H -2.929 -0.231 -7.371 1.00 . A A . 22 GLN HG3 1 1 27 14732 1 1 1 GLN N N -6.895 -0.510 -6.408 1.00 . A A . 22 GLN N 1 1 27 14733 1 1 1 GLN NE2 N -2.604 -2.288 -8.906 1.00 . A A . 22 GLN NE2 1 1 27 14734 1 1 1 GLN O O -6.345 -0.854 -3.610 1.00 . A A . 22 GLN O 1 1 27 14735 1 1 1 GLN OE1 O -4.105 -3.205 -7.615 1.00 . A A . 22 GLN OE1 1 1 27 14736 1 1 2 THR C C -5.972 -2.891 -1.579 1.00 . A A . 23 THR C 1 1 27 14737 1 1 2 THR CA C -6.720 -3.540 -2.750 1.00 . A A . 23 THR CA 1 1 27 14738 1 1 2 THR CB C -6.583 -5.072 -2.683 1.00 . A A . 23 THR CB 1 1 27 14739 1 1 2 THR CG2 C -7.308 -5.690 -1.487 1.00 . A A . 23 THR CG2 1 1 27 14740 1 1 2 THR H H -6.140 -3.760 -4.782 1.00 . A A . 23 THR H 1 1 27 14741 1 1 2 THR HA H -7.773 -3.299 -2.642 1.00 . A A . 23 THR HA 1 1 27 14742 1 1 2 THR HB H -5.527 -5.341 -2.649 1.00 . A A . 23 THR HB 1 1 27 14743 1 1 2 THR HG1 H -6.976 -6.592 -3.833 1.00 . A A . 23 THR HG1 1 1 27 14744 1 1 2 THR HG21 H -8.366 -5.435 -1.523 1.00 . A A . 23 THR HG21 1 1 27 14745 1 1 2 THR HG22 H -7.201 -6.775 -1.515 1.00 . A A . 23 THR HG22 1 1 27 14746 1 1 2 THR HG23 H -6.873 -5.330 -0.555 1.00 . A A . 23 THR HG23 1 1 27 14747 1 1 2 THR N N -6.284 -3.050 -4.074 1.00 . A A . 23 THR N 1 1 27 14748 1 1 2 THR O O -4.750 -2.738 -1.623 1.00 . A A . 23 THR O 1 1 27 14749 1 1 2 THR OG1 O -7.166 -5.638 -3.841 1.00 . A A . 23 THR OG1 1 1 27 14750 1 1 3 CYS C C -5.078 -2.669 1.384 1.00 . A A . 24 CYS C 1 1 27 14751 1 1 3 CYS CA C -6.200 -1.875 0.686 1.00 . A A . 24 CYS CA 1 1 27 14752 1 1 3 CYS CB C -7.386 -1.721 1.643 1.00 . A A . 24 CYS CB 1 1 27 14753 1 1 3 CYS H H -7.712 -2.630 -0.600 1.00 . A A . 24 CYS H 1 1 27 14754 1 1 3 CYS HA H -5.827 -0.885 0.424 1.00 . A A . 24 CYS HA 1 1 27 14755 1 1 3 CYS HB2 H -8.245 -1.326 1.104 1.00 . A A . 24 CYS HB2 1 1 27 14756 1 1 3 CYS HB3 H -7.656 -2.701 2.033 1.00 . A A . 24 CYS HB3 1 1 27 14757 1 1 3 CYS N N -6.712 -2.515 -0.529 1.00 . A A . 24 CYS N 1 1 27 14758 1 1 3 CYS O O -5.092 -3.903 1.394 1.00 . A A . 24 CYS O 1 1 27 14759 1 1 3 CYS SG S -6.937 -0.603 2.995 1.00 . A A . 24 CYS SG 1 1 27 14760 1 1 4 TYR C C -3.892 -3.269 4.219 1.00 . A A . 25 TYR C 1 1 27 14761 1 1 4 TYR CA C -3.225 -2.579 3.009 1.00 . A A . 25 TYR CA 1 1 27 14762 1 1 4 TYR CB C -2.162 -1.558 3.457 1.00 . A A . 25 TYR CB 1 1 27 14763 1 1 4 TYR CD1 C -3.636 0.119 4.698 1.00 . A A . 25 TYR CD1 1 1 27 14764 1 1 4 TYR CD2 C -1.680 -0.801 5.823 1.00 . A A . 25 TYR CD2 1 1 27 14765 1 1 4 TYR CE1 C -3.973 0.833 5.867 1.00 . A A . 25 TYR CE1 1 1 27 14766 1 1 4 TYR CE2 C -1.998 -0.068 6.982 1.00 . A A . 25 TYR CE2 1 1 27 14767 1 1 4 TYR CG C -2.500 -0.716 4.679 1.00 . A A . 25 TYR CG 1 1 27 14768 1 1 4 TYR CZ C -3.154 0.739 7.012 1.00 . A A . 25 TYR CZ 1 1 27 14769 1 1 4 TYR H H -4.223 -0.953 2.032 1.00 . A A . 25 TYR H 1 1 27 14770 1 1 4 TYR HA H -2.705 -3.359 2.466 1.00 . A A . 25 TYR HA 1 1 27 14771 1 1 4 TYR HB2 H -1.263 -2.132 3.688 1.00 . A A . 25 TYR HB2 1 1 27 14772 1 1 4 TYR HB3 H -1.904 -0.904 2.626 1.00 . A A . 25 TYR HB3 1 1 27 14773 1 1 4 TYR HD1 H -4.269 0.198 3.824 1.00 . A A . 25 TYR HD1 1 1 27 14774 1 1 4 TYR HD2 H -0.807 -1.439 5.818 1.00 . A A . 25 TYR HD2 1 1 27 14775 1 1 4 TYR HE1 H -4.866 1.438 5.892 1.00 . A A . 25 TYR HE1 1 1 27 14776 1 1 4 TYR HE2 H -1.374 -0.137 7.861 1.00 . A A . 25 TYR HE2 1 1 27 14777 1 1 4 TYR HH H -4.339 1.852 8.092 1.00 . A A . 25 TYR HH 1 1 27 14778 1 1 4 TYR N N -4.169 -1.964 2.068 1.00 . A A . 25 TYR N 1 1 27 14779 1 1 4 TYR O O -3.272 -4.128 4.852 1.00 . A A . 25 TYR O 1 1 27 14780 1 1 4 TYR OH O -3.481 1.402 8.155 1.00 . A A . 25 TYR OH 1 1 27 14781 1 1 5 ASN C C -7.303 -3.835 5.467 1.00 . A A . 26 ASN C 1 1 27 14782 1 1 5 ASN CA C -5.872 -3.324 5.736 1.00 . A A . 26 ASN CA 1 1 27 14783 1 1 5 ASN CB C -5.895 -2.088 6.656 1.00 . A A . 26 ASN CB 1 1 27 14784 1 1 5 ASN CG C -6.757 -2.285 7.893 1.00 . A A . 26 ASN CG 1 1 27 14785 1 1 5 ASN H H -5.585 -2.225 3.931 1.00 . A A . 26 ASN H 1 1 27 14786 1 1 5 ASN HA H -5.337 -4.126 6.248 1.00 . A A . 26 ASN HA 1 1 27 14787 1 1 5 ASN HB2 H -4.877 -1.862 6.978 1.00 . A A . 26 ASN HB2 1 1 27 14788 1 1 5 ASN HB3 H -6.268 -1.224 6.106 1.00 . A A . 26 ASN HB3 1 1 27 14789 1 1 5 ASN HD21 H -8.374 -1.401 7.036 1.00 . A A . 26 ASN HD21 1 1 27 14790 1 1 5 ASN HD22 H -8.567 -1.969 8.688 1.00 . A A . 26 ASN HD22 1 1 27 14791 1 1 5 ASN N N -5.154 -2.929 4.518 1.00 . A A . 26 ASN N 1 1 27 14792 1 1 5 ASN ND2 N -7.994 -1.836 7.869 1.00 . A A . 26 ASN ND2 1 1 27 14793 1 1 5 ASN O O -7.692 -4.882 5.987 1.00 . A A . 26 ASN O 1 1 27 14794 1 1 5 ASN OD1 O -6.332 -2.850 8.891 1.00 . A A . 26 ASN OD1 1 1 27 14795 1 1 6 CYS C C -9.969 -4.447 3.625 1.00 . A A . 27 CYS C 1 1 27 14796 1 1 6 CYS CA C -9.537 -3.275 4.542 1.00 . A A . 27 CYS CA 1 1 27 14797 1 1 6 CYS CB C -10.131 -1.942 4.054 1.00 . A A . 27 CYS CB 1 1 27 14798 1 1 6 CYS H H -7.703 -2.249 4.279 1.00 . A A . 27 CYS H 1 1 27 14799 1 1 6 CYS HA H -9.942 -3.477 5.534 1.00 . A A . 27 CYS HA 1 1 27 14800 1 1 6 CYS HB2 H -9.808 -1.753 3.029 1.00 . A A . 27 CYS HB2 1 1 27 14801 1 1 6 CYS HB3 H -11.222 -2.026 4.050 1.00 . A A . 27 CYS HB3 1 1 27 14802 1 1 6 CYS N N -8.086 -3.100 4.669 1.00 . A A . 27 CYS N 1 1 27 14803 1 1 6 CYS O O -11.152 -4.791 3.588 1.00 . A A . 27 CYS O 1 1 27 14804 1 1 6 CYS SG S -9.640 -0.568 5.142 1.00 . A A . 27 CYS SG 1 1 27 14805 1 1 7 GLY C C -10.296 -5.859 0.826 1.00 . A A . 28 GLY C 1 1 27 14806 1 1 7 GLY CA C -9.305 -6.174 1.961 1.00 . A A . 28 GLY CA 1 1 27 14807 1 1 7 GLY H H -8.081 -4.749 2.988 1.00 . A A . 28 GLY H 1 1 27 14808 1 1 7 GLY HA2 H -9.695 -7.015 2.534 1.00 . A A . 28 GLY HA2 1 1 27 14809 1 1 7 GLY HA3 H -8.364 -6.482 1.503 1.00 . A A . 28 GLY HA3 1 1 27 14810 1 1 7 GLY N N -9.037 -5.052 2.875 1.00 . A A . 28 GLY N 1 1 27 14811 1 1 7 GLY O O -11.027 -6.748 0.383 1.00 . A A . 28 GLY O 1 1 27 14812 1 1 8 LYS C C -10.670 -3.469 -1.817 1.00 . A A . 29 LYS C 1 1 27 14813 1 1 8 LYS CA C -11.347 -4.048 -0.555 1.00 . A A . 29 LYS CA 1 1 27 14814 1 1 8 LYS CB C -12.159 -2.995 0.228 1.00 . A A . 29 LYS CB 1 1 27 14815 1 1 8 LYS CD C -14.475 -3.305 -0.820 1.00 . A A . 29 LYS CD 1 1 27 14816 1 1 8 LYS CE C -15.639 -2.559 -1.488 1.00 . A A . 29 LYS CE 1 1 27 14817 1 1 8 LYS CG C -13.313 -2.338 -0.548 1.00 . A A . 29 LYS CG 1 1 27 14818 1 1 8 LYS H H -9.691 -3.946 0.791 1.00 . A A . 29 LYS H 1 1 27 14819 1 1 8 LYS HA H -12.038 -4.840 -0.837 1.00 . A A . 29 LYS HA 1 1 27 14820 1 1 8 LYS HB2 H -12.572 -3.462 1.124 1.00 . A A . 29 LYS HB2 1 1 27 14821 1 1 8 LYS HB3 H -11.481 -2.213 0.564 1.00 . A A . 29 LYS HB3 1 1 27 14822 1 1 8 LYS HD2 H -14.142 -4.114 -1.470 1.00 . A A . 29 LYS HD2 1 1 27 14823 1 1 8 LYS HD3 H -14.817 -3.729 0.127 1.00 . A A . 29 LYS HD3 1 1 27 14824 1 1 8 LYS HE2 H -15.933 -1.723 -0.847 1.00 . A A . 29 LYS HE2 1 1 27 14825 1 1 8 LYS HE3 H -15.294 -2.145 -2.440 1.00 . A A . 29 LYS HE3 1 1 27 14826 1 1 8 LYS HG2 H -13.690 -1.508 0.052 1.00 . A A . 29 LYS HG2 1 1 27 14827 1 1 8 LYS HG3 H -12.946 -1.930 -1.490 1.00 . A A . 29 LYS HG3 1 1 27 14828 1 1 8 LYS HZ1 H -16.565 -4.230 -2.317 1.00 . A A . 29 LYS HZ1 1 1 27 14829 1 1 8 LYS HZ2 H -17.153 -3.833 -0.846 1.00 . A A . 29 LYS HZ2 1 1 27 14830 1 1 8 LYS HZ3 H -17.566 -2.953 -2.153 1.00 . A A . 29 LYS HZ3 1 1 27 14831 1 1 8 LYS N N -10.338 -4.599 0.369 1.00 . A A . 29 LYS N 1 1 27 14832 1 1 8 LYS NZ N -16.804 -3.454 -1.716 1.00 . A A . 29 LYS NZ 1 1 27 14833 1 1 8 LYS O O -9.911 -2.506 -1.675 1.00 . A A . 29 LYS O 1 1 27 14834 1 1 9 PRO C C -10.286 -2.123 -4.641 1.00 . A A . 30 PRO C 1 1 27 14835 1 1 9 PRO CA C -10.247 -3.619 -4.285 1.00 . A A . 30 PRO CA 1 1 27 14836 1 1 9 PRO CB C -10.925 -4.441 -5.386 1.00 . A A . 30 PRO CB 1 1 27 14837 1 1 9 PRO CD C -11.708 -5.220 -3.273 1.00 . A A . 30 PRO CD 1 1 27 14838 1 1 9 PRO CG C -11.329 -5.720 -4.664 1.00 . A A . 30 PRO CG 1 1 27 14839 1 1 9 PRO HA H -9.203 -3.927 -4.235 1.00 . A A . 30 PRO HA 1 1 27 14840 1 1 9 PRO HB2 H -11.822 -3.932 -5.743 1.00 . A A . 30 PRO HB2 1 1 27 14841 1 1 9 PRO HB3 H -10.247 -4.645 -6.217 1.00 . A A . 30 PRO HB3 1 1 27 14842 1 1 9 PRO HD2 H -12.765 -4.955 -3.257 1.00 . A A . 30 PRO HD2 1 1 27 14843 1 1 9 PRO HD3 H -11.504 -6.003 -2.543 1.00 . A A . 30 PRO HD3 1 1 27 14844 1 1 9 PRO HG2 H -12.165 -6.218 -5.156 1.00 . A A . 30 PRO HG2 1 1 27 14845 1 1 9 PRO HG3 H -10.469 -6.387 -4.591 1.00 . A A . 30 PRO HG3 1 1 27 14846 1 1 9 PRO N N -10.903 -4.025 -3.028 1.00 . A A . 30 PRO N 1 1 27 14847 1 1 9 PRO O O -9.331 -1.612 -5.227 1.00 . A A . 30 PRO O 1 1 27 14848 1 1 10 GLY C C -10.778 1.021 -3.785 1.00 . A A . 31 GLY C 1 1 27 14849 1 1 10 GLY CA C -11.602 0.006 -4.591 1.00 . A A . 31 GLY CA 1 1 27 14850 1 1 10 GLY H H -12.100 -1.909 -3.801 1.00 . A A . 31 GLY H 1 1 27 14851 1 1 10 GLY HA2 H -12.658 0.227 -4.437 1.00 . A A . 31 GLY HA2 1 1 27 14852 1 1 10 GLY HA3 H -11.379 0.165 -5.647 1.00 . A A . 31 GLY HA3 1 1 27 14853 1 1 10 GLY N N -11.356 -1.412 -4.269 1.00 . A A . 31 GLY N 1 1 27 14854 1 1 10 GLY O O -11.243 2.135 -3.526 1.00 . A A . 31 GLY O 1 1 27 14855 1 1 11 HIS C C -7.554 2.114 -3.491 1.00 . A A . 32 HIS C 1 1 27 14856 1 1 11 HIS CA C -8.648 1.493 -2.607 1.00 . A A . 32 HIS CA 1 1 27 14857 1 1 11 HIS CB C -8.071 0.704 -1.422 1.00 . A A . 32 HIS CB 1 1 27 14858 1 1 11 HIS CD2 C -8.676 1.399 0.969 1.00 . A A . 32 HIS CD2 1 1 27 14859 1 1 11 HIS CE1 C -10.614 0.391 1.193 1.00 . A A . 32 HIS CE1 1 1 27 14860 1 1 11 HIS CG C -8.955 0.759 -0.206 1.00 . A A . 32 HIS CG 1 1 27 14861 1 1 11 HIS H H -9.247 -0.276 -3.627 1.00 . A A . 32 HIS H 1 1 27 14862 1 1 11 HIS HA H -9.200 2.334 -2.196 1.00 . A A . 32 HIS HA 1 1 27 14863 1 1 11 HIS HB2 H -7.936 -0.339 -1.703 1.00 . A A . 32 HIS HB2 1 1 27 14864 1 1 11 HIS HB3 H -7.091 1.098 -1.146 1.00 . A A . 32 HIS HB3 1 1 27 14865 1 1 11 HIS HD1 H -10.607 -0.476 -0.731 1.00 . A A . 32 HIS HD1 1 1 27 14866 1 1 11 HIS HD2 H -7.785 1.973 1.171 1.00 . A A . 32 HIS HD2 1 1 27 14867 1 1 11 HIS HE1 H -11.544 0.018 1.608 1.00 . A A . 32 HIS HE1 1 1 27 14868 1 1 11 HIS N N -9.573 0.642 -3.353 1.00 . A A . 32 HIS N 1 1 27 14869 1 1 11 HIS ND1 N -10.167 0.133 -0.049 1.00 . A A . 32 HIS ND1 1 1 27 14870 1 1 11 HIS NE2 N -9.722 1.141 1.866 1.00 . A A . 32 HIS NE2 1 1 27 14871 1 1 11 HIS O O -7.332 1.732 -4.643 1.00 . A A . 32 HIS O 1 1 27 14872 1 1 12 LEU C C -4.946 4.468 -2.354 1.00 . A A . 33 LEU C 1 1 27 14873 1 1 12 LEU CA C -5.855 3.973 -3.490 1.00 . A A . 33 LEU CA 1 1 27 14874 1 1 12 LEU CB C -6.517 5.195 -4.174 1.00 . A A . 33 LEU CB 1 1 27 14875 1 1 12 LEU CD1 C -7.980 6.215 -5.932 1.00 . A A . 33 LEU CD1 1 1 27 14876 1 1 12 LEU CD2 C -6.436 4.396 -6.592 1.00 . A A . 33 LEU CD2 1 1 27 14877 1 1 12 LEU CG C -7.322 4.919 -5.458 1.00 . A A . 33 LEU CG 1 1 27 14878 1 1 12 LEU H H -7.101 3.300 -1.942 1.00 . A A . 33 LEU H 1 1 27 14879 1 1 12 LEU HA H -5.247 3.413 -4.203 1.00 . A A . 33 LEU HA 1 1 27 14880 1 1 12 LEU HB2 H -7.179 5.673 -3.451 1.00 . A A . 33 LEU HB2 1 1 27 14881 1 1 12 LEU HB3 H -5.742 5.920 -4.428 1.00 . A A . 33 LEU HB3 1 1 27 14882 1 1 12 LEU HD11 H -8.643 6.597 -5.154 1.00 . A A . 33 LEU HD11 1 1 27 14883 1 1 12 LEU HD12 H -7.220 6.967 -6.153 1.00 . A A . 33 LEU HD12 1 1 27 14884 1 1 12 LEU HD13 H -8.569 6.025 -6.828 1.00 . A A . 33 LEU HD13 1 1 27 14885 1 1 12 LEU HD21 H -5.633 5.105 -6.798 1.00 . A A . 33 LEU HD21 1 1 27 14886 1 1 12 LEU HD22 H -6.009 3.433 -6.319 1.00 . A A . 33 LEU HD22 1 1 27 14887 1 1 12 LEU HD23 H -7.035 4.263 -7.493 1.00 . A A . 33 LEU HD23 1 1 27 14888 1 1 12 LEU HG H -8.113 4.201 -5.255 1.00 . A A . 33 LEU HG 1 1 27 14889 1 1 12 LEU N N -6.894 3.120 -2.916 1.00 . A A . 33 LEU N 1 1 27 14890 1 1 12 LEU O O -5.306 4.373 -1.176 1.00 . A A . 33 LEU O 1 1 27 14891 1 1 13 SER C C -3.556 6.981 -0.994 1.00 . A A . 34 SER C 1 1 27 14892 1 1 13 SER CA C -2.918 5.840 -1.812 1.00 . A A . 34 SER CA 1 1 27 14893 1 1 13 SER CB C -1.757 6.398 -2.647 1.00 . A A . 34 SER CB 1 1 27 14894 1 1 13 SER H H -3.584 5.105 -3.692 1.00 . A A . 34 SER H 1 1 27 14895 1 1 13 SER HA H -2.507 5.132 -1.093 1.00 . A A . 34 SER HA 1 1 27 14896 1 1 13 SER HB2 H -2.151 7.060 -3.420 1.00 . A A . 34 SER HB2 1 1 27 14897 1 1 13 SER HB3 H -1.082 6.970 -2.010 1.00 . A A . 34 SER HB3 1 1 27 14898 1 1 13 SER HG H -0.353 5.697 -3.822 1.00 . A A . 34 SER HG 1 1 27 14899 1 1 13 SER N N -3.831 5.108 -2.711 1.00 . A A . 34 SER N 1 1 27 14900 1 1 13 SER O O -2.873 7.587 -0.166 1.00 . A A . 34 SER O 1 1 27 14901 1 1 13 SER OG O -1.048 5.325 -3.246 1.00 . A A . 34 SER OG 1 1 27 14902 1 1 14 SER C C -6.961 7.739 0.098 1.00 . A A . 35 SER C 1 1 27 14903 1 1 14 SER CA C -5.651 8.284 -0.504 1.00 . A A . 35 SER CA 1 1 27 14904 1 1 14 SER CB C -5.970 9.423 -1.479 1.00 . A A . 35 SER CB 1 1 27 14905 1 1 14 SER H H -5.293 6.806 -1.981 1.00 . A A . 35 SER H 1 1 27 14906 1 1 14 SER HA H -5.071 8.701 0.319 1.00 . A A . 35 SER HA 1 1 27 14907 1 1 14 SER HB2 H -6.588 10.172 -0.980 1.00 . A A . 35 SER HB2 1 1 27 14908 1 1 14 SER HB3 H -5.038 9.893 -1.796 1.00 . A A . 35 SER HB3 1 1 27 14909 1 1 14 SER HG H -6.848 9.661 -3.218 1.00 . A A . 35 SER HG 1 1 27 14910 1 1 14 SER N N -4.844 7.271 -1.208 1.00 . A A . 35 SER N 1 1 27 14911 1 1 14 SER O O -7.590 8.429 0.904 1.00 . A A . 35 SER O 1 1 27 14912 1 1 14 SER OG O -6.655 8.915 -2.619 1.00 . A A . 35 SER OG 1 1 27 14913 1 1 15 GLN C C -8.198 5.342 1.795 1.00 . A A . 36 GLN C 1 1 27 14914 1 1 15 GLN CA C -8.537 5.838 0.372 1.00 . A A . 36 GLN CA 1 1 27 14915 1 1 15 GLN CB C -8.976 4.669 -0.531 1.00 . A A . 36 GLN CB 1 1 27 14916 1 1 15 GLN CD C -11.479 4.991 -0.892 1.00 . A A . 36 GLN CD 1 1 27 14917 1 1 15 GLN CG C -10.394 4.146 -0.229 1.00 . A A . 36 GLN CG 1 1 27 14918 1 1 15 GLN H H -6.792 5.969 -0.865 1.00 . A A . 36 GLN H 1 1 27 14919 1 1 15 GLN HA H -9.357 6.553 0.443 1.00 . A A . 36 GLN HA 1 1 27 14920 1 1 15 GLN HB2 H -8.944 4.983 -1.575 1.00 . A A . 36 GLN HB2 1 1 27 14921 1 1 15 GLN HB3 H -8.266 3.853 -0.408 1.00 . A A . 36 GLN HB3 1 1 27 14922 1 1 15 GLN HE21 H -11.652 3.741 -2.494 1.00 . A A . 36 GLN HE21 1 1 27 14923 1 1 15 GLN HE22 H -12.686 5.164 -2.481 1.00 . A A . 36 GLN HE22 1 1 27 14924 1 1 15 GLN HG2 H -10.486 3.127 -0.603 1.00 . A A . 36 GLN HG2 1 1 27 14925 1 1 15 GLN HG3 H -10.565 4.108 0.846 1.00 . A A . 36 GLN HG3 1 1 27 14926 1 1 15 GLN N N -7.375 6.507 -0.242 1.00 . A A . 36 GLN N 1 1 27 14927 1 1 15 GLN NE2 N -11.970 4.600 -2.050 1.00 . A A . 36 GLN NE2 1 1 27 14928 1 1 15 GLN O O -9.001 5.499 2.719 1.00 . A A . 36 GLN O 1 1 27 14929 1 1 15 GLN OE1 O -11.900 6.024 -0.385 1.00 . A A . 36 GLN OE1 1 1 27 14930 1 1 16 CYS C C -4.808 4.989 3.113 1.00 . A A . 37 CYS C 1 1 27 14931 1 1 16 CYS CA C -6.277 4.522 3.210 1.00 . A A . 37 CYS CA 1 1 27 14932 1 1 16 CYS CB C -6.379 3.011 3.507 1.00 . A A . 37 CYS CB 1 1 27 14933 1 1 16 CYS H H -6.393 4.790 1.128 1.00 . A A . 37 CYS H 1 1 27 14934 1 1 16 CYS HA H -6.741 5.070 4.029 1.00 . A A . 37 CYS HA 1 1 27 14935 1 1 16 CYS HB2 H -6.240 2.437 2.588 1.00 . A A . 37 CYS HB2 1 1 27 14936 1 1 16 CYS HB3 H -5.586 2.712 4.191 1.00 . A A . 37 CYS HB3 1 1 27 14937 1 1 16 CYS N N -6.971 4.831 1.956 1.00 . A A . 37 CYS N 1 1 27 14938 1 1 16 CYS O O -4.395 5.570 2.103 1.00 . A A . 37 CYS O 1 1 27 14939 1 1 16 CYS SG S -7.963 2.623 4.299 1.00 . A A . 37 CYS SG 1 1 27 14940 1 1 17 ARG C C -1.779 4.579 3.032 1.00 . A A . 38 ARG C 1 1 27 14941 1 1 17 ARG CA C -2.582 5.089 4.236 1.00 . A A . 38 ARG CA 1 1 27 14942 1 1 17 ARG CB C -1.949 4.580 5.546 1.00 . A A . 38 ARG CB 1 1 27 14943 1 1 17 ARG CD C -3.727 5.107 7.384 1.00 . A A . 38 ARG CD 1 1 27 14944 1 1 17 ARG CG C -2.309 5.340 6.836 1.00 . A A . 38 ARG CG 1 1 27 14945 1 1 17 ARG CZ C -6.030 5.848 6.722 1.00 . A A . 38 ARG CZ 1 1 27 14946 1 1 17 ARG H H -4.430 4.265 4.954 1.00 . A A . 38 ARG H 1 1 27 14947 1 1 17 ARG HA H -2.493 6.176 4.212 1.00 . A A . 38 ARG HA 1 1 27 14948 1 1 17 ARG HB2 H -2.166 3.518 5.673 1.00 . A A . 38 ARG HB2 1 1 27 14949 1 1 17 ARG HB3 H -0.867 4.675 5.436 1.00 . A A . 38 ARG HB3 1 1 27 14950 1 1 17 ARG HD2 H -4.003 4.067 7.208 1.00 . A A . 38 ARG HD2 1 1 27 14951 1 1 17 ARG HD3 H -3.702 5.271 8.463 1.00 . A A . 38 ARG HD3 1 1 27 14952 1 1 17 ARG HE H -4.375 6.913 6.455 1.00 . A A . 38 ARG HE 1 1 27 14953 1 1 17 ARG HG2 H -1.613 5.000 7.605 1.00 . A A . 38 ARG HG2 1 1 27 14954 1 1 17 ARG HG3 H -2.135 6.408 6.696 1.00 . A A . 38 ARG HG3 1 1 27 14955 1 1 17 ARG HH11 H -6.066 4.079 7.651 1.00 . A A . 38 ARG HH11 1 1 27 14956 1 1 17 ARG HH12 H -7.596 4.627 7.029 1.00 . A A . 38 ARG HH12 1 1 27 14957 1 1 17 ARG HH21 H -6.394 7.614 5.834 1.00 . A A . 38 ARG HH21 1 1 27 14958 1 1 17 ARG HH22 H -7.782 6.604 6.108 1.00 . A A . 38 ARG HH22 1 1 27 14959 1 1 17 ARG N N -4.010 4.728 4.160 1.00 . A A . 38 ARG N 1 1 27 14960 1 1 17 ARG NE N -4.723 6.032 6.803 1.00 . A A . 38 ARG NE 1 1 27 14961 1 1 17 ARG NH1 N -6.609 4.769 7.162 1.00 . A A . 38 ARG NH1 1 1 27 14962 1 1 17 ARG NH2 N -6.788 6.750 6.170 1.00 . A A . 38 ARG NH2 1 1 27 14963 1 1 17 ARG O O -0.918 5.309 2.543 1.00 . A A . 38 ARG O 1 1 27 14964 1 1 18 ALA C C -2.473 1.665 0.753 1.00 . A A . 39 ALA C 1 1 27 14965 1 1 18 ALA CA C -1.569 2.808 1.286 1.00 . A A . 39 ALA CA 1 1 27 14966 1 1 18 ALA CB C -0.160 2.262 1.569 1.00 . A A . 39 ALA CB 1 1 27 14967 1 1 18 ALA H H -2.807 2.852 3.007 1.00 . A A . 39 ALA H 1 1 27 14968 1 1 18 ALA HA H -1.507 3.594 0.530 1.00 . A A . 39 ALA HA 1 1 27 14969 1 1 18 ALA HB1 H 0.490 3.057 1.935 1.00 . A A . 39 ALA HB1 1 1 27 14970 1 1 18 ALA HB2 H -0.221 1.471 2.315 1.00 . A A . 39 ALA HB2 1 1 27 14971 1 1 18 ALA HB3 H 0.274 1.848 0.659 1.00 . A A . 39 ALA HB3 1 1 27 14972 1 1 18 ALA N N -2.093 3.381 2.529 1.00 . A A . 39 ALA N 1 1 27 14973 1 1 18 ALA O O -3.237 1.076 1.527 1.00 . A A . 39 ALA O 1 1 27 14974 1 1 19 PRO C C -1.764 -1.128 -0.500 1.00 . A A . 40 PRO C 1 1 27 14975 1 1 19 PRO CA C -2.751 -0.053 -1.002 1.00 . A A . 40 PRO CA 1 1 27 14976 1 1 19 PRO CB C -2.750 0.061 -2.531 1.00 . A A . 40 PRO CB 1 1 27 14977 1 1 19 PRO CD C -1.711 2.022 -1.613 1.00 . A A . 40 PRO CD 1 1 27 14978 1 1 19 PRO CG C -1.630 1.064 -2.803 1.00 . A A . 40 PRO CG 1 1 27 14979 1 1 19 PRO HA H -3.755 -0.302 -0.657 1.00 . A A . 40 PRO HA 1 1 27 14980 1 1 19 PRO HB2 H -2.569 -0.896 -3.022 1.00 . A A . 40 PRO HB2 1 1 27 14981 1 1 19 PRO HB3 H -3.702 0.480 -2.862 1.00 . A A . 40 PRO HB3 1 1 27 14982 1 1 19 PRO HD2 H -0.710 2.357 -1.339 1.00 . A A . 40 PRO HD2 1 1 27 14983 1 1 19 PRO HD3 H -2.331 2.877 -1.878 1.00 . A A . 40 PRO HD3 1 1 27 14984 1 1 19 PRO HG2 H -0.667 0.551 -2.792 1.00 . A A . 40 PRO HG2 1 1 27 14985 1 1 19 PRO HG3 H -1.775 1.585 -3.749 1.00 . A A . 40 PRO HG3 1 1 27 14986 1 1 19 PRO N N -2.355 1.278 -0.534 1.00 . A A . 40 PRO N 1 1 27 14987 1 1 19 PRO O O -0.672 -0.808 -0.025 1.00 . A A . 40 PRO O 1 1 27 14988 1 1 20 LYS C C 0.100 -3.698 -0.605 1.00 . A A . 41 LYS C 1 1 27 14989 1 1 20 LYS CA C -1.360 -3.590 -0.142 1.00 . A A . 41 LYS CA 1 1 27 14990 1 1 20 LYS CB C -2.165 -4.867 -0.471 1.00 . A A . 41 LYS CB 1 1 27 14991 1 1 20 LYS CD C -2.009 -5.968 1.844 1.00 . A A . 41 LYS CD 1 1 27 14992 1 1 20 LYS CE C -1.805 -7.291 2.588 1.00 . A A . 41 LYS CE 1 1 27 14993 1 1 20 LYS CG C -1.796 -6.131 0.332 1.00 . A A . 41 LYS CG 1 1 27 14994 1 1 20 LYS H H -3.020 -2.594 -1.067 1.00 . A A . 41 LYS H 1 1 27 14995 1 1 20 LYS HA H -1.294 -3.475 0.937 1.00 . A A . 41 LYS HA 1 1 27 14996 1 1 20 LYS HB2 H -3.223 -4.674 -0.298 1.00 . A A . 41 LYS HB2 1 1 27 14997 1 1 20 LYS HB3 H -2.052 -5.088 -1.534 1.00 . A A . 41 LYS HB3 1 1 27 14998 1 1 20 LYS HD2 H -1.299 -5.238 2.236 1.00 . A A . 41 LYS HD2 1 1 27 14999 1 1 20 LYS HD3 H -3.027 -5.619 2.022 1.00 . A A . 41 LYS HD3 1 1 27 15000 1 1 20 LYS HE2 H -2.506 -8.032 2.187 1.00 . A A . 41 LYS HE2 1 1 27 15001 1 1 20 LYS HE3 H -0.791 -7.653 2.398 1.00 . A A . 41 LYS HE3 1 1 27 15002 1 1 20 LYS HG2 H -2.429 -6.946 -0.021 1.00 . A A . 41 LYS HG2 1 1 27 15003 1 1 20 LYS HG3 H -0.760 -6.408 0.137 1.00 . A A . 41 LYS HG3 1 1 27 15004 1 1 20 LYS HZ1 H -2.955 -6.779 4.248 1.00 . A A . 41 LYS HZ1 1 1 27 15005 1 1 20 LYS HZ2 H -1.913 -8.004 4.537 1.00 . A A . 41 LYS HZ2 1 1 27 15006 1 1 20 LYS HZ3 H -1.368 -6.467 4.449 1.00 . A A . 41 LYS HZ3 1 1 27 15007 1 1 20 LYS N N -2.111 -2.416 -0.648 1.00 . A A . 41 LYS N 1 1 27 15008 1 1 20 LYS NZ N -2.025 -7.124 4.050 1.00 . A A . 41 LYS NZ 1 1 27 15009 1 1 20 LYS O O 0.888 -4.416 0.011 1.00 . A A . 41 LYS O 1 1 27 15010 1 1 21 VAL C C 2.787 -2.260 -0.922 1.00 . A A . 42 VAL C 1 1 27 15011 1 1 21 VAL CA C 1.876 -2.719 -2.079 1.00 . A A . 42 VAL CA 1 1 27 15012 1 1 21 VAL CB C 1.890 -1.665 -3.210 1.00 . A A . 42 VAL CB 1 1 27 15013 1 1 21 VAL CG1 C 3.291 -1.430 -3.780 1.00 . A A . 42 VAL CG1 1 1 27 15014 1 1 21 VAL CG2 C 0.987 -2.071 -4.385 1.00 . A A . 42 VAL CG2 1 1 27 15015 1 1 21 VAL H H -0.241 -2.422 -2.098 1.00 . A A . 42 VAL H 1 1 27 15016 1 1 21 VAL HA H 2.284 -3.652 -2.471 1.00 . A A . 42 VAL HA 1 1 27 15017 1 1 21 VAL HB H 1.524 -0.718 -2.812 1.00 . A A . 42 VAL HB 1 1 27 15018 1 1 21 VAL HG11 H 3.706 -2.373 -4.140 1.00 . A A . 42 VAL HG11 1 1 27 15019 1 1 21 VAL HG12 H 3.247 -0.719 -4.606 1.00 . A A . 42 VAL HG12 1 1 27 15020 1 1 21 VAL HG13 H 3.948 -1.014 -3.017 1.00 . A A . 42 VAL HG13 1 1 27 15021 1 1 21 VAL HG21 H 1.298 -3.041 -4.776 1.00 . A A . 42 VAL HG21 1 1 27 15022 1 1 21 VAL HG22 H -0.055 -2.126 -4.073 1.00 . A A . 42 VAL HG22 1 1 27 15023 1 1 21 VAL HG23 H 1.057 -1.328 -5.180 1.00 . A A . 42 VAL HG23 1 1 27 15024 1 1 21 VAL N N 0.484 -2.954 -1.643 1.00 . A A . 42 VAL N 1 1 27 15025 1 1 21 VAL O O 3.964 -2.619 -0.886 1.00 . A A . 42 VAL O 1 1 27 15026 1 1 22 CYS C C 2.023 -0.761 2.391 1.00 . A A . 43 CYS C 1 1 27 15027 1 1 22 CYS CA C 2.942 -0.870 1.147 1.00 . A A . 43 CYS CA 1 1 27 15028 1 1 22 CYS CB C 3.435 0.495 0.625 1.00 . A A . 43 CYS CB 1 1 27 15029 1 1 22 CYS H H 1.243 -1.301 -0.037 1.00 . A A . 43 CYS H 1 1 27 15030 1 1 22 CYS HA H 3.810 -1.471 1.420 1.00 . A A . 43 CYS HA 1 1 27 15031 1 1 22 CYS HB2 H 3.888 0.347 -0.358 1.00 . A A . 43 CYS HB2 1 1 27 15032 1 1 22 CYS HB3 H 2.585 1.170 0.508 1.00 . A A . 43 CYS HB3 1 1 27 15033 1 1 22 CYS N N 2.237 -1.501 0.032 1.00 . A A . 43 CYS N 1 1 27 15034 1 1 22 CYS O O 1.023 -1.470 2.521 1.00 . A A . 43 CYS O 1 1 27 15035 1 1 22 CYS SG S 4.675 1.227 1.725 1.00 . A A . 43 CYS SG 1 1 27 15036 1 1 23 PHE C C 1.690 2.118 4.693 1.00 . A A . 44 PHE C 1 1 27 15037 1 1 23 PHE CA C 1.597 0.593 4.458 1.00 . A A . 44 PHE CA 1 1 27 15038 1 1 23 PHE CB C 2.056 -0.172 5.711 1.00 . A A . 44 PHE CB 1 1 27 15039 1 1 23 PHE CD1 C 4.598 -0.218 5.647 1.00 . A A . 44 PHE CD1 1 1 27 15040 1 1 23 PHE CD2 C 3.493 1.159 7.322 1.00 . A A . 44 PHE CD2 1 1 27 15041 1 1 23 PHE CE1 C 5.850 0.215 6.117 1.00 . A A . 44 PHE CE1 1 1 27 15042 1 1 23 PHE CE2 C 4.746 1.591 7.796 1.00 . A A . 44 PHE CE2 1 1 27 15043 1 1 23 PHE CG C 3.414 0.255 6.244 1.00 . A A . 44 PHE CG 1 1 27 15044 1 1 23 PHE CZ C 5.925 1.122 7.190 1.00 . A A . 44 PHE CZ 1 1 27 15045 1 1 23 PHE H H 3.257 0.601 3.114 1.00 . A A . 44 PHE H 1 1 27 15046 1 1 23 PHE HA H 0.547 0.358 4.285 1.00 . A A . 44 PHE HA 1 1 27 15047 1 1 23 PHE HB2 H 1.312 -0.020 6.494 1.00 . A A . 44 PHE HB2 1 1 27 15048 1 1 23 PHE HB3 H 2.075 -1.241 5.494 1.00 . A A . 44 PHE HB3 1 1 27 15049 1 1 23 PHE HD1 H 4.550 -0.914 4.821 1.00 . A A . 44 PHE HD1 1 1 27 15050 1 1 23 PHE HD2 H 2.590 1.532 7.785 1.00 . A A . 44 PHE HD2 1 1 27 15051 1 1 23 PHE HE1 H 6.758 -0.148 5.652 1.00 . A A . 44 PHE HE1 1 1 27 15052 1 1 23 PHE HE2 H 4.802 2.287 8.622 1.00 . A A . 44 PHE HE2 1 1 27 15053 1 1 23 PHE HZ H 6.889 1.455 7.551 1.00 . A A . 44 PHE HZ 1 1 27 15054 1 1 23 PHE N N 2.377 0.142 3.303 1.00 . A A . 44 PHE N 1 1 27 15055 1 1 23 PHE O O 0.860 2.661 5.424 1.00 . A A . 44 PHE O 1 1 27 15056 1 1 24 LYS C C 3.683 4.934 3.152 1.00 . A A . 45 LYS C 1 1 27 15057 1 1 24 LYS CA C 2.931 4.255 4.308 1.00 . A A . 45 LYS CA 1 1 27 15058 1 1 24 LYS CB C 3.710 4.406 5.632 1.00 . A A . 45 LYS CB 1 1 27 15059 1 1 24 LYS CD C 4.724 5.938 7.367 1.00 . A A . 45 LYS CD 1 1 27 15060 1 1 24 LYS CE C 5.001 7.397 7.744 1.00 . A A . 45 LYS CE 1 1 27 15061 1 1 24 LYS CG C 3.984 5.867 6.023 1.00 . A A . 45 LYS CG 1 1 27 15062 1 1 24 LYS H H 3.302 2.310 3.479 1.00 . A A . 45 LYS H 1 1 27 15063 1 1 24 LYS HA H 1.978 4.777 4.409 1.00 . A A . 45 LYS HA 1 1 27 15064 1 1 24 LYS HB2 H 3.129 3.948 6.434 1.00 . A A . 45 LYS HB2 1 1 27 15065 1 1 24 LYS HB3 H 4.659 3.872 5.559 1.00 . A A . 45 LYS HB3 1 1 27 15066 1 1 24 LYS HD2 H 4.111 5.471 8.140 1.00 . A A . 45 LYS HD2 1 1 27 15067 1 1 24 LYS HD3 H 5.668 5.397 7.287 1.00 . A A . 45 LYS HD3 1 1 27 15068 1 1 24 LYS HE2 H 5.595 7.860 6.949 1.00 . A A . 45 LYS HE2 1 1 27 15069 1 1 24 LYS HE3 H 4.050 7.932 7.805 1.00 . A A . 45 LYS HE3 1 1 27 15070 1 1 24 LYS HG2 H 4.599 6.345 5.259 1.00 . A A . 45 LYS HG2 1 1 27 15071 1 1 24 LYS HG3 H 3.037 6.403 6.102 1.00 . A A . 45 LYS HG3 1 1 27 15072 1 1 24 LYS HZ1 H 5.190 7.092 9.794 1.00 . A A . 45 LYS HZ1 1 1 27 15073 1 1 24 LYS HZ2 H 6.618 7.028 9.000 1.00 . A A . 45 LYS HZ2 1 1 27 15074 1 1 24 LYS HZ3 H 5.902 8.466 9.281 1.00 . A A . 45 LYS HZ3 1 1 27 15075 1 1 24 LYS N N 2.674 2.816 4.089 1.00 . A A . 45 LYS N 1 1 27 15076 1 1 24 LYS NZ N 5.725 7.500 9.039 1.00 . A A . 45 LYS NZ 1 1 27 15077 1 1 24 LYS O O 3.158 5.878 2.561 1.00 . A A . 45 LYS O 1 1 27 15078 1 1 25 CYS C C 5.406 5.008 0.412 1.00 . A A . 46 CYS C 1 1 27 15079 1 1 25 CYS CA C 5.827 5.114 1.895 1.00 . A A . 46 CYS CA 1 1 27 15080 1 1 25 CYS CB C 7.261 4.599 2.147 1.00 . A A . 46 CYS CB 1 1 27 15081 1 1 25 CYS H H 5.277 3.710 3.376 1.00 . A A . 46 CYS H 1 1 27 15082 1 1 25 CYS HA H 5.836 6.180 2.123 1.00 . A A . 46 CYS HA 1 1 27 15083 1 1 25 CYS HB2 H 7.809 4.569 1.203 1.00 . A A . 46 CYS HB2 1 1 27 15084 1 1 25 CYS HB3 H 7.769 5.324 2.789 1.00 . A A . 46 CYS HB3 1 1 27 15085 1 1 25 CYS N N 4.898 4.478 2.840 1.00 . A A . 46 CYS N 1 1 27 15086 1 1 25 CYS O O 5.636 5.953 -0.343 1.00 . A A . 46 CYS O 1 1 27 15087 1 1 25 CYS SG S 7.343 2.973 2.961 1.00 . A A . 46 CYS SG 1 1 27 15088 1 1 26 LYS C C 4.553 4.169 -2.574 1.00 . A A . 47 LYS C 1 1 27 15089 1 1 26 LYS CA C 3.968 3.673 -1.230 1.00 . A A . 47 LYS CA 1 1 27 15090 1 1 26 LYS CB C 2.498 4.078 -0.981 1.00 . A A . 47 LYS CB 1 1 27 15091 1 1 26 LYS CD C 0.965 5.872 -0.066 1.00 . A A . 47 LYS CD 1 1 27 15092 1 1 26 LYS CE C 0.854 7.369 0.251 1.00 . A A . 47 LYS CE 1 1 27 15093 1 1 26 LYS CG C 2.255 5.593 -0.842 1.00 . A A . 47 LYS CG 1 1 27 15094 1 1 26 LYS H H 4.656 3.191 0.731 1.00 . A A . 47 LYS H 1 1 27 15095 1 1 26 LYS HA H 3.946 2.591 -1.358 1.00 . A A . 47 LYS HA 1 1 27 15096 1 1 26 LYS HB2 H 1.871 3.695 -1.787 1.00 . A A . 47 LYS HB2 1 1 27 15097 1 1 26 LYS HB3 H 2.176 3.581 -0.064 1.00 . A A . 47 LYS HB3 1 1 27 15098 1 1 26 LYS HD2 H 0.104 5.532 -0.637 1.00 . A A . 47 LYS HD2 1 1 27 15099 1 1 26 LYS HD3 H 1.005 5.323 0.874 1.00 . A A . 47 LYS HD3 1 1 27 15100 1 1 26 LYS HE2 H 1.765 7.667 0.782 1.00 . A A . 47 LYS HE2 1 1 27 15101 1 1 26 LYS HE3 H 0.807 7.941 -0.681 1.00 . A A . 47 LYS HE3 1 1 27 15102 1 1 26 LYS HG2 H 3.072 6.055 -0.294 1.00 . A A . 47 LYS HG2 1 1 27 15103 1 1 26 LYS HG3 H 2.202 6.050 -1.830 1.00 . A A . 47 LYS HG3 1 1 27 15104 1 1 26 LYS HZ1 H -0.390 6.989 1.863 1.00 . A A . 47 LYS HZ1 1 1 27 15105 1 1 26 LYS HZ2 H -0.281 8.591 1.493 1.00 . A A . 47 LYS HZ2 1 1 27 15106 1 1 26 LYS HZ3 H -1.197 7.592 0.581 1.00 . A A . 47 LYS HZ3 1 1 27 15107 1 1 26 LYS N N 4.740 3.910 0.020 1.00 . A A . 47 LYS N 1 1 27 15108 1 1 26 LYS NZ N -0.326 7.659 1.102 1.00 . A A . 47 LYS NZ 1 1 27 15109 1 1 26 LYS O O 3.805 4.379 -3.529 1.00 . A A . 47 LYS O 1 1 27 15110 1 1 27 GLN C C 6.513 3.579 -4.993 1.00 . A A . 48 GLN C 1 1 27 15111 1 1 27 GLN CA C 6.561 4.709 -3.931 1.00 . A A . 48 GLN CA 1 1 27 15112 1 1 27 GLN CB C 8.019 5.108 -3.636 1.00 . A A . 48 GLN CB 1 1 27 15113 1 1 27 GLN CD C 7.408 7.521 -3.055 1.00 . A A . 48 GLN CD 1 1 27 15114 1 1 27 GLN CG C 8.185 6.271 -2.643 1.00 . A A . 48 GLN CG 1 1 27 15115 1 1 27 GLN H H 6.433 4.161 -1.857 1.00 . A A . 48 GLN H 1 1 27 15116 1 1 27 GLN HA H 6.038 5.577 -4.328 1.00 . A A . 48 GLN HA 1 1 27 15117 1 1 27 GLN HB2 H 8.548 4.245 -3.238 1.00 . A A . 48 GLN HB2 1 1 27 15118 1 1 27 GLN HB3 H 8.506 5.391 -4.570 1.00 . A A . 48 GLN HB3 1 1 27 15119 1 1 27 GLN HE21 H 6.043 7.273 -1.584 1.00 . A A . 48 GLN HE21 1 1 27 15120 1 1 27 GLN HE22 H 5.824 8.681 -2.634 1.00 . A A . 48 GLN HE22 1 1 27 15121 1 1 27 GLN HG2 H 7.874 5.948 -1.651 1.00 . A A . 48 GLN HG2 1 1 27 15122 1 1 27 GLN HG3 H 9.242 6.527 -2.578 1.00 . A A . 48 GLN HG3 1 1 27 15123 1 1 27 GLN N N 5.877 4.326 -2.683 1.00 . A A . 48 GLN N 1 1 27 15124 1 1 27 GLN NE2 N 6.339 7.855 -2.365 1.00 . A A . 48 GLN NE2 1 1 27 15125 1 1 27 GLN O O 6.476 2.406 -4.607 1.00 . A A . 48 GLN O 1 1 27 15126 1 1 27 GLN OE1 O 7.740 8.208 -4.012 1.00 . A A . 48 GLN OE1 1 1 27 15127 1 1 28 PRO C C 7.080 1.607 -7.456 1.00 . A A . 49 PRO C 1 1 27 15128 1 1 28 PRO CA C 6.318 2.947 -7.417 1.00 . A A . 49 PRO CA 1 1 27 15129 1 1 28 PRO CB C 6.602 3.736 -8.699 1.00 . A A . 49 PRO CB 1 1 27 15130 1 1 28 PRO CD C 6.702 5.241 -6.854 1.00 . A A . 49 PRO CD 1 1 27 15131 1 1 28 PRO CG C 6.259 5.168 -8.313 1.00 . A A . 49 PRO CG 1 1 27 15132 1 1 28 PRO HA H 5.252 2.711 -7.397 1.00 . A A . 49 PRO HA 1 1 27 15133 1 1 28 PRO HB2 H 7.664 3.676 -8.949 1.00 . A A . 49 PRO HB2 1 1 27 15134 1 1 28 PRO HB3 H 5.994 3.387 -9.533 1.00 . A A . 49 PRO HB3 1 1 27 15135 1 1 28 PRO HD2 H 7.748 5.550 -6.808 1.00 . A A . 49 PRO HD2 1 1 27 15136 1 1 28 PRO HD3 H 6.075 5.964 -6.334 1.00 . A A . 49 PRO HD3 1 1 27 15137 1 1 28 PRO HG2 H 6.785 5.895 -8.934 1.00 . A A . 49 PRO HG2 1 1 27 15138 1 1 28 PRO HG3 H 5.181 5.316 -8.375 1.00 . A A . 49 PRO HG3 1 1 27 15139 1 1 28 PRO N N 6.570 3.889 -6.310 1.00 . A A . 49 PRO N 1 1 27 15140 1 1 28 PRO O O 6.606 0.676 -8.110 1.00 . A A . 49 PRO O 1 1 27 15141 1 1 29 GLY C C 9.897 -0.017 -5.551 1.00 . A A . 50 GLY C 1 1 27 15142 1 1 29 GLY CA C 9.065 0.260 -6.814 1.00 . A A . 50 GLY CA 1 1 27 15143 1 1 29 GLY H H 8.612 2.314 -6.357 1.00 . A A . 50 GLY H 1 1 27 15144 1 1 29 GLY HA2 H 9.753 0.321 -7.656 1.00 . A A . 50 GLY HA2 1 1 27 15145 1 1 29 GLY HA3 H 8.425 -0.609 -6.968 1.00 . A A . 50 GLY HA3 1 1 27 15146 1 1 29 GLY N N 8.240 1.485 -6.797 1.00 . A A . 50 GLY N 1 1 27 15147 1 1 29 GLY O O 10.628 -1.007 -5.508 1.00 . A A . 50 GLY O 1 1 27 15148 1 1 30 HIS C C 10.316 -0.590 -2.484 1.00 . A A . 51 HIS C 1 1 27 15149 1 1 30 HIS CA C 10.580 0.708 -3.275 1.00 . A A . 51 HIS CA 1 1 27 15150 1 1 30 HIS CB C 10.293 1.928 -2.381 1.00 . A A . 51 HIS CB 1 1 27 15151 1 1 30 HIS CD2 C 8.896 1.619 -0.257 1.00 . A A . 51 HIS CD2 1 1 27 15152 1 1 30 HIS CE1 C 6.884 1.424 -1.113 1.00 . A A . 51 HIS CE1 1 1 27 15153 1 1 30 HIS CG C 8.995 1.824 -1.607 1.00 . A A . 51 HIS CG 1 1 27 15154 1 1 30 HIS H H 9.185 1.622 -4.613 1.00 . A A . 51 HIS H 1 1 27 15155 1 1 30 HIS HA H 11.639 0.722 -3.538 1.00 . A A . 51 HIS HA 1 1 27 15156 1 1 30 HIS HB2 H 11.107 2.014 -1.660 1.00 . A A . 51 HIS HB2 1 1 27 15157 1 1 30 HIS HB3 H 10.300 2.837 -2.981 1.00 . A A . 51 HIS HB3 1 1 27 15158 1 1 30 HIS HD1 H 7.428 1.822 -3.092 1.00 . A A . 51 HIS HD1 1 1 27 15159 1 1 30 HIS HD2 H 9.724 1.584 0.439 1.00 . A A . 51 HIS HD2 1 1 27 15160 1 1 30 HIS HE1 H 5.820 1.254 -1.221 1.00 . A A . 51 HIS HE1 1 1 27 15161 1 1 30 HIS N N 9.797 0.827 -4.516 1.00 . A A . 51 HIS N 1 1 27 15162 1 1 30 HIS ND1 N 7.719 1.707 -2.123 1.00 . A A . 51 HIS ND1 1 1 27 15163 1 1 30 HIS NE2 N 7.552 1.368 0.048 1.00 . A A . 51 HIS NE2 1 1 27 15164 1 1 30 HIS O O 11.191 -1.078 -1.767 1.00 . A A . 51 HIS O 1 1 27 15165 1 1 31 PHE C C 9.462 -3.501 -1.877 1.00 . A A . 52 PHE C 1 1 27 15166 1 1 31 PHE CA C 8.607 -2.233 -1.751 1.00 . A A . 52 PHE CA 1 1 27 15167 1 1 31 PHE CB C 7.122 -2.485 -2.056 1.00 . A A . 52 PHE CB 1 1 27 15168 1 1 31 PHE CD1 C 6.509 -1.725 -4.401 1.00 . A A . 52 PHE CD1 1 1 27 15169 1 1 31 PHE CD2 C 6.750 -4.110 -3.973 1.00 . A A . 52 PHE CD2 1 1 27 15170 1 1 31 PHE CE1 C 6.196 -2.001 -5.744 1.00 . A A . 52 PHE CE1 1 1 27 15171 1 1 31 PHE CE2 C 6.444 -4.381 -5.318 1.00 . A A . 52 PHE CE2 1 1 27 15172 1 1 31 PHE CG C 6.789 -2.780 -3.510 1.00 . A A . 52 PHE CG 1 1 27 15173 1 1 31 PHE CZ C 6.169 -3.326 -6.204 1.00 . A A . 52 PHE CZ 1 1 27 15174 1 1 31 PHE H H 8.441 -0.689 -3.203 1.00 . A A . 52 PHE H 1 1 27 15175 1 1 31 PHE HA H 8.673 -1.913 -0.711 1.00 . A A . 52 PHE HA 1 1 27 15176 1 1 31 PHE HB2 H 6.774 -3.315 -1.437 1.00 . A A . 52 PHE HB2 1 1 27 15177 1 1 31 PHE HB3 H 6.556 -1.605 -1.745 1.00 . A A . 52 PHE HB3 1 1 27 15178 1 1 31 PHE HD1 H 6.506 -0.701 -4.055 1.00 . A A . 52 PHE HD1 1 1 27 15179 1 1 31 PHE HD2 H 6.960 -4.927 -3.298 1.00 . A A . 52 PHE HD2 1 1 27 15180 1 1 31 PHE HE1 H 5.964 -1.191 -6.421 1.00 . A A . 52 PHE HE1 1 1 27 15181 1 1 31 PHE HE2 H 6.425 -5.404 -5.670 1.00 . A A . 52 PHE HE2 1 1 27 15182 1 1 31 PHE HZ H 5.929 -3.537 -7.239 1.00 . A A . 52 PHE HZ 1 1 27 15183 1 1 31 PHE N N 9.100 -1.138 -2.588 1.00 . A A . 52 PHE N 1 1 27 15184 1 1 31 PHE O O 9.825 -4.089 -0.859 1.00 . A A . 52 PHE O 1 1 27 15185 1 1 32 SER C C 12.178 -4.903 -2.658 1.00 . A A . 53 SER C 1 1 27 15186 1 1 32 SER CA C 10.810 -4.983 -3.363 1.00 . A A . 53 SER CA 1 1 27 15187 1 1 32 SER CB C 11.044 -5.102 -4.876 1.00 . A A . 53 SER CB 1 1 27 15188 1 1 32 SER H H 9.555 -3.338 -3.885 1.00 . A A . 53 SER H 1 1 27 15189 1 1 32 SER HA H 10.327 -5.900 -3.024 1.00 . A A . 53 SER HA 1 1 27 15190 1 1 32 SER HB2 H 11.562 -4.208 -5.230 1.00 . A A . 53 SER HB2 1 1 27 15191 1 1 32 SER HB3 H 11.667 -5.974 -5.078 1.00 . A A . 53 SER HB3 1 1 27 15192 1 1 32 SER HG H 9.999 -5.326 -6.519 1.00 . A A . 53 SER HG 1 1 27 15193 1 1 32 SER N N 9.903 -3.853 -3.087 1.00 . A A . 53 SER N 1 1 27 15194 1 1 32 SER O O 12.931 -5.880 -2.682 1.00 . A A . 53 SER O 1 1 27 15195 1 1 32 SER OG O 9.811 -5.238 -5.565 1.00 . A A . 53 SER OG 1 1 27 15196 1 1 33 LYS C C 13.564 -2.984 0.109 1.00 . A A . 54 LYS C 1 1 27 15197 1 1 33 LYS CA C 13.769 -3.462 -1.344 1.00 . A A . 54 LYS CA 1 1 27 15198 1 1 33 LYS CB C 14.561 -2.414 -2.159 1.00 . A A . 54 LYS CB 1 1 27 15199 1 1 33 LYS CD C 15.698 -3.998 -3.837 1.00 . A A . 54 LYS CD 1 1 27 15200 1 1 33 LYS CE C 15.827 -4.311 -5.333 1.00 . A A . 54 LYS CE 1 1 27 15201 1 1 33 LYS CG C 14.811 -2.760 -3.641 1.00 . A A . 54 LYS CG 1 1 27 15202 1 1 33 LYS H H 11.834 -3.001 -2.098 1.00 . A A . 54 LYS H 1 1 27 15203 1 1 33 LYS HA H 14.362 -4.374 -1.269 1.00 . A A . 54 LYS HA 1 1 27 15204 1 1 33 LYS HB2 H 14.015 -1.469 -2.126 1.00 . A A . 54 LYS HB2 1 1 27 15205 1 1 33 LYS HB3 H 15.528 -2.248 -1.682 1.00 . A A . 54 LYS HB3 1 1 27 15206 1 1 33 LYS HD2 H 16.685 -3.805 -3.414 1.00 . A A . 54 LYS HD2 1 1 27 15207 1 1 33 LYS HD3 H 15.259 -4.855 -3.329 1.00 . A A . 54 LYS HD3 1 1 27 15208 1 1 33 LYS HE2 H 14.824 -4.455 -5.747 1.00 . A A . 54 LYS HE2 1 1 27 15209 1 1 33 LYS HE3 H 16.276 -3.451 -5.836 1.00 . A A . 54 LYS HE3 1 1 27 15210 1 1 33 LYS HG2 H 13.858 -2.909 -4.148 1.00 . A A . 54 LYS HG2 1 1 27 15211 1 1 33 LYS HG3 H 15.302 -1.906 -4.109 1.00 . A A . 54 LYS HG3 1 1 27 15212 1 1 33 LYS HZ1 H 16.242 -6.338 -5.118 1.00 . A A . 54 LYS HZ1 1 1 27 15213 1 1 33 LYS HZ2 H 16.719 -5.732 -6.556 1.00 . A A . 54 LYS HZ2 1 1 27 15214 1 1 33 LYS HZ3 H 17.586 -5.412 -5.213 1.00 . A A . 54 LYS HZ3 1 1 27 15215 1 1 33 LYS N N 12.504 -3.759 -2.037 1.00 . A A . 54 LYS N 1 1 27 15216 1 1 33 LYS NZ N 16.647 -5.528 -5.568 1.00 . A A . 54 LYS NZ 1 1 27 15217 1 1 33 LYS O O 14.545 -2.626 0.767 1.00 . A A . 54 LYS O 1 1 27 15218 1 1 34 GLN C C 10.757 -3.257 2.565 1.00 . A A . 55 GLN C 1 1 27 15219 1 1 34 GLN CA C 12.012 -2.560 1.999 1.00 . A A . 55 GLN CA 1 1 27 15220 1 1 34 GLN CB C 11.863 -1.026 2.038 1.00 . A A . 55 GLN CB 1 1 27 15221 1 1 34 GLN CD C 11.451 1.008 3.483 1.00 . A A . 55 GLN CD 1 1 27 15222 1 1 34 GLN CG C 11.770 -0.484 3.473 1.00 . A A . 55 GLN CG 1 1 27 15223 1 1 34 GLN H H 11.578 -3.323 0.039 1.00 . A A . 55 GLN H 1 1 27 15224 1 1 34 GLN HA H 12.849 -2.837 2.643 1.00 . A A . 55 GLN HA 1 1 27 15225 1 1 34 GLN HB2 H 12.730 -0.566 1.559 1.00 . A A . 55 GLN HB2 1 1 27 15226 1 1 34 GLN HB3 H 10.977 -0.729 1.476 1.00 . A A . 55 GLN HB3 1 1 27 15227 1 1 34 GLN HE21 H 9.466 0.654 3.455 1.00 . A A . 55 GLN HE21 1 1 27 15228 1 1 34 GLN HE22 H 9.943 2.344 3.480 1.00 . A A . 55 GLN HE22 1 1 27 15229 1 1 34 GLN HG2 H 10.987 -1.008 4.021 1.00 . A A . 55 GLN HG2 1 1 27 15230 1 1 34 GLN HG3 H 12.717 -0.652 3.986 1.00 . A A . 55 GLN HG3 1 1 27 15231 1 1 34 GLN N N 12.324 -2.966 0.619 1.00 . A A . 55 GLN N 1 1 27 15232 1 1 34 GLN NE2 N 10.186 1.365 3.478 1.00 . A A . 55 GLN NE2 1 1 27 15233 1 1 34 GLN O O 10.855 -4.021 3.528 1.00 . A A . 55 GLN O 1 1 27 15234 1 1 34 GLN OE1 O 12.324 1.868 3.489 1.00 . A A . 55 GLN OE1 1 1 27 15235 1 1 35 CYS C C 7.784 -4.790 2.095 1.00 . A A . 56 CYS C 1 1 27 15236 1 1 35 CYS CA C 8.269 -3.382 2.525 1.00 . A A . 56 CYS CA 1 1 27 15237 1 1 35 CYS CB C 7.259 -2.292 2.125 1.00 . A A . 56 CYS CB 1 1 27 15238 1 1 35 CYS H H 9.576 -2.340 1.217 1.00 . A A . 56 CYS H 1 1 27 15239 1 1 35 CYS HA H 8.336 -3.386 3.612 1.00 . A A . 56 CYS HA 1 1 27 15240 1 1 35 CYS HB2 H 7.139 -2.273 1.040 1.00 . A A . 56 CYS HB2 1 1 27 15241 1 1 35 CYS HB3 H 6.288 -2.530 2.567 1.00 . A A . 56 CYS HB3 1 1 27 15242 1 1 35 CYS N N 9.581 -3.000 1.978 1.00 . A A . 56 CYS N 1 1 27 15243 1 1 35 CYS O O 6.738 -5.259 2.558 1.00 . A A . 56 CYS O 1 1 27 15244 1 1 35 CYS SG S 7.808 -0.667 2.724 1.00 . A A . 56 CYS SG 1 1 27 15245 1 1 36 ARG C C 9.414 -7.559 0.126 1.00 . A A . 57 ARG C 1 1 27 15246 1 1 36 ARG CA C 8.178 -6.741 0.559 1.00 . A A . 57 ARG CA 1 1 27 15247 1 1 36 ARG CB C 7.232 -6.452 -0.630 1.00 . A A . 57 ARG CB 1 1 27 15248 1 1 36 ARG CD C 5.310 -7.932 0.279 1.00 . A A . 57 ARG CD 1 1 27 15249 1 1 36 ARG CG C 6.191 -7.551 -0.925 1.00 . A A . 57 ARG CG 1 1 27 15250 1 1 36 ARG CZ C 3.659 -6.102 0.755 1.00 . A A . 57 ARG CZ 1 1 27 15251 1 1 36 ARG H H 9.296 -4.934 0.790 1.00 . A A . 57 ARG H 1 1 27 15252 1 1 36 ARG HA H 7.671 -7.348 1.308 1.00 . A A . 57 ARG HA 1 1 27 15253 1 1 36 ARG HB2 H 6.680 -5.530 -0.441 1.00 . A A . 57 ARG HB2 1 1 27 15254 1 1 36 ARG HB3 H 7.826 -6.276 -1.527 1.00 . A A . 57 ARG HB3 1 1 27 15255 1 1 36 ARG HD2 H 4.494 -8.570 -0.064 1.00 . A A . 57 ARG HD2 1 1 27 15256 1 1 36 ARG HD3 H 5.901 -8.527 0.977 1.00 . A A . 57 ARG HD3 1 1 27 15257 1 1 36 ARG HE H 5.389 -6.336 1.691 1.00 . A A . 57 ARG HE 1 1 27 15258 1 1 36 ARG HG2 H 5.545 -7.193 -1.727 1.00 . A A . 57 ARG HG2 1 1 27 15259 1 1 36 ARG HG3 H 6.696 -8.448 -1.284 1.00 . A A . 57 ARG HG3 1 1 27 15260 1 1 36 ARG HH11 H 2.984 -7.293 -0.708 1.00 . A A . 57 ARG HH11 1 1 27 15261 1 1 36 ARG HH12 H 1.964 -5.925 -0.279 1.00 . A A . 57 ARG HH12 1 1 27 15262 1 1 36 ARG HH21 H 3.984 -4.689 2.135 1.00 . A A . 57 ARG HH21 1 1 27 15263 1 1 36 ARG HH22 H 2.494 -4.553 1.211 1.00 . A A . 57 ARG HH22 1 1 27 15264 1 1 36 ARG N N 8.520 -5.451 1.191 1.00 . A A . 57 ARG N 1 1 27 15265 1 1 36 ARG NE N 4.784 -6.747 0.988 1.00 . A A . 57 ARG NE 1 1 27 15266 1 1 36 ARG NH1 N 2.803 -6.477 -0.151 1.00 . A A . 57 ARG NH1 1 1 27 15267 1 1 36 ARG NH2 N 3.352 -5.040 1.436 1.00 . A A . 57 ARG NH2 1 1 27 15268 1 1 36 ARG O O 9.298 -8.448 -0.723 1.00 . A A . 57 ARG O 1 1 27 15269 1 1 37 SER C C 11.869 -9.419 0.466 1.00 . A A . 58 SER C 1 1 27 15270 1 1 37 SER CA C 11.899 -7.884 0.415 1.00 . A A . 58 SER CA 1 1 27 15271 1 1 37 SER CB C 12.946 -7.371 1.404 1.00 . A A . 58 SER CB 1 1 27 15272 1 1 37 SER H H 10.591 -6.492 1.354 1.00 . A A . 58 SER H 1 1 27 15273 1 1 37 SER HA H 12.223 -7.602 -0.587 1.00 . A A . 58 SER HA 1 1 27 15274 1 1 37 SER HB2 H 12.676 -7.682 2.416 1.00 . A A . 58 SER HB2 1 1 27 15275 1 1 37 SER HB3 H 13.919 -7.806 1.154 1.00 . A A . 58 SER HB3 1 1 27 15276 1 1 37 SER HG H 13.688 -5.651 1.981 1.00 . A A . 58 SER HG 1 1 27 15277 1 1 37 SER N N 10.591 -7.242 0.681 1.00 . A A . 58 SER N 1 1 27 15278 1 1 37 SER O O 11.341 -9.983 1.452 1.00 . A A . 58 SER O 1 1 27 15279 1 1 37 SER OXT O 12.410 -10.054 -0.468 1.00 . A A . 58 SER OXT 1 1 27 15280 1 1 37 SER OG O 13.020 -5.956 1.337 1.00 . A A . 58 SER OG 1 1 27 15281 2 2 1 ZN ZN ZN -8.623 0.670 3.648 1.00 . B A . 1059 ZN ZN 1 1 27 15282 3 2 1 ZN ZN ZN 6.827 1.107 1.970 1.00 . C A . 1060 ZN ZN 1 1 28 15283 1 1 1 GLN C C -6.312 -1.605 -4.446 1.00 . A A . 22 GLN C 1 1 28 15284 1 1 1 GLN CA C -6.108 -1.202 -5.909 1.00 . A A . 22 GLN CA 1 1 28 15285 1 1 1 GLN CB C -4.644 -0.800 -6.184 1.00 . A A . 22 GLN CB 1 1 28 15286 1 1 1 GLN CD C -2.233 -1.614 -6.412 1.00 . A A . 22 GLN CD 1 1 28 15287 1 1 1 GLN CG C -3.668 -1.981 -6.036 1.00 . A A . 22 GLN CG 1 1 28 15288 1 1 1 GLN H1 H -6.894 0.694 -5.654 1.00 . A A . 22 GLN H1 1 1 28 15289 1 1 1 GLN H2 H -6.926 0.179 -7.220 1.00 . A A . 22 GLN H2 1 1 28 15290 1 1 1 GLN H3 H -8.003 -0.411 -6.126 1.00 . A A . 22 GLN H3 1 1 28 15291 1 1 1 GLN HA H -6.345 -2.063 -6.532 1.00 . A A . 22 GLN HA 1 1 28 15292 1 1 1 GLN HB2 H -4.569 -0.426 -7.207 1.00 . A A . 22 GLN HB2 1 1 28 15293 1 1 1 GLN HB3 H -4.351 0.003 -5.505 1.00 . A A . 22 GLN HB3 1 1 28 15294 1 1 1 GLN HE21 H -1.866 -3.418 -7.255 1.00 . A A . 22 GLN HE21 1 1 28 15295 1 1 1 GLN HE22 H -0.551 -2.254 -7.275 1.00 . A A . 22 GLN HE22 1 1 28 15296 1 1 1 GLN HG2 H -3.665 -2.343 -5.008 1.00 . A A . 22 GLN HG2 1 1 28 15297 1 1 1 GLN HG3 H -4.006 -2.795 -6.680 1.00 . A A . 22 GLN HG3 1 1 28 15298 1 1 1 GLN N N -7.046 -0.105 -6.258 1.00 . A A . 22 GLN N 1 1 28 15299 1 1 1 GLN NE2 N -1.495 -2.507 -7.032 1.00 . A A . 22 GLN NE2 1 1 28 15300 1 1 1 GLN O O -6.426 -0.736 -3.588 1.00 . A A . 22 GLN O 1 1 28 15301 1 1 1 GLN OE1 O -1.744 -0.523 -6.159 1.00 . A A . 22 GLN OE1 1 1 28 15302 1 1 2 THR C C -5.926 -2.858 -1.672 1.00 . A A . 23 THR C 1 1 28 15303 1 1 2 THR CA C -6.719 -3.471 -2.832 1.00 . A A . 23 THR CA 1 1 28 15304 1 1 2 THR CB C -6.538 -5.000 -2.849 1.00 . A A . 23 THR CB 1 1 28 15305 1 1 2 THR CG2 C -7.165 -5.692 -1.638 1.00 . A A . 23 THR CG2 1 1 28 15306 1 1 2 THR H H -6.293 -3.584 -4.906 1.00 . A A . 23 THR H 1 1 28 15307 1 1 2 THR HA H -7.772 -3.272 -2.650 1.00 . A A . 23 THR HA 1 1 28 15308 1 1 2 THR HB H -5.474 -5.239 -2.895 1.00 . A A . 23 THR HB 1 1 28 15309 1 1 2 THR HG1 H -6.968 -6.473 -4.044 1.00 . A A . 23 THR HG1 1 1 28 15310 1 1 2 THR HG21 H -8.231 -5.475 -1.600 1.00 . A A . 23 THR HG21 1 1 28 15311 1 1 2 THR HG22 H -7.023 -6.770 -1.721 1.00 . A A . 23 THR HG22 1 1 28 15312 1 1 2 THR HG23 H -6.686 -5.355 -0.719 1.00 . A A . 23 THR HG23 1 1 28 15313 1 1 2 THR N N -6.384 -2.909 -4.157 1.00 . A A . 23 THR N 1 1 28 15314 1 1 2 THR O O -4.704 -2.727 -1.750 1.00 . A A . 23 THR O 1 1 28 15315 1 1 2 THR OG1 O -7.180 -5.525 -3.993 1.00 . A A . 23 THR OG1 1 1 28 15316 1 1 3 CYS C C -4.949 -2.704 1.285 1.00 . A A . 24 CYS C 1 1 28 15317 1 1 3 CYS CA C -6.090 -1.899 0.630 1.00 . A A . 24 CYS CA 1 1 28 15318 1 1 3 CYS CB C -7.256 -1.785 1.615 1.00 . A A . 24 CYS CB 1 1 28 15319 1 1 3 CYS H H -7.635 -2.595 -0.645 1.00 . A A . 24 CYS H 1 1 28 15320 1 1 3 CYS HA H -5.729 -0.897 0.391 1.00 . A A . 24 CYS HA 1 1 28 15321 1 1 3 CYS HB2 H -8.127 -1.379 1.107 1.00 . A A . 24 CYS HB2 1 1 28 15322 1 1 3 CYS HB3 H -7.512 -2.781 1.979 1.00 . A A . 24 CYS HB3 1 1 28 15323 1 1 3 CYS N N -6.630 -2.501 -0.593 1.00 . A A . 24 CYS N 1 1 28 15324 1 1 3 CYS O O -4.959 -3.937 1.266 1.00 . A A . 24 CYS O 1 1 28 15325 1 1 3 CYS SG S -6.792 -0.711 2.994 1.00 . A A . 24 CYS SG 1 1 28 15326 1 1 4 TYR C C -3.703 -3.368 4.080 1.00 . A A . 25 TYR C 1 1 28 15327 1 1 4 TYR CA C -3.066 -2.632 2.882 1.00 . A A . 25 TYR CA 1 1 28 15328 1 1 4 TYR CB C -2.025 -1.603 3.355 1.00 . A A . 25 TYR CB 1 1 28 15329 1 1 4 TYR CD1 C -3.504 0.084 4.577 1.00 . A A . 25 TYR CD1 1 1 28 15330 1 1 4 TYR CD2 C -1.633 -0.930 5.765 1.00 . A A . 25 TYR CD2 1 1 28 15331 1 1 4 TYR CE1 C -3.870 0.780 5.747 1.00 . A A . 25 TYR CE1 1 1 28 15332 1 1 4 TYR CE2 C -1.978 -0.217 6.928 1.00 . A A . 25 TYR CE2 1 1 28 15333 1 1 4 TYR CG C -2.394 -0.787 4.586 1.00 . A A . 25 TYR CG 1 1 28 15334 1 1 4 TYR CZ C -3.105 0.631 6.926 1.00 . A A . 25 TYR CZ 1 1 28 15335 1 1 4 TYR H H -4.088 -0.998 1.947 1.00 . A A . 25 TYR H 1 1 28 15336 1 1 4 TYR HA H -2.533 -3.385 2.314 1.00 . A A . 25 TYR HA 1 1 28 15337 1 1 4 TYR HB2 H -1.121 -2.164 3.590 1.00 . A A . 25 TYR HB2 1 1 28 15338 1 1 4 TYR HB3 H -1.768 -0.931 2.537 1.00 . A A . 25 TYR HB3 1 1 28 15339 1 1 4 TYR HD1 H -4.096 0.203 3.681 1.00 . A A . 25 TYR HD1 1 1 28 15340 1 1 4 TYR HD2 H -0.784 -1.601 5.783 1.00 . A A . 25 TYR HD2 1 1 28 15341 1 1 4 TYR HE1 H -4.743 1.413 5.752 1.00 . A A . 25 TYR HE1 1 1 28 15342 1 1 4 TYR HE2 H -1.399 -0.329 7.832 1.00 . A A . 25 TYR HE2 1 1 28 15343 1 1 4 TYR HH H -4.298 1.767 7.968 1.00 . A A . 25 TYR HH 1 1 28 15344 1 1 4 TYR N N -4.032 -2.009 1.968 1.00 . A A . 25 TYR N 1 1 28 15345 1 1 4 TYR O O -3.073 -4.260 4.655 1.00 . A A . 25 TYR O 1 1 28 15346 1 1 4 TYR OH O -3.464 1.281 8.067 1.00 . A A . 25 TYR OH 1 1 28 15347 1 1 5 ASN C C -7.053 -3.977 5.435 1.00 . A A . 26 ASN C 1 1 28 15348 1 1 5 ASN CA C -5.622 -3.451 5.668 1.00 . A A . 26 ASN CA 1 1 28 15349 1 1 5 ASN CB C -5.630 -2.228 6.608 1.00 . A A . 26 ASN CB 1 1 28 15350 1 1 5 ASN CG C -6.450 -2.453 7.868 1.00 . A A . 26 ASN CG 1 1 28 15351 1 1 5 ASN H H -5.391 -2.297 3.890 1.00 . A A . 26 ASN H 1 1 28 15352 1 1 5 ASN HA H -5.059 -4.252 6.150 1.00 . A A . 26 ASN HA 1 1 28 15353 1 1 5 ASN HB2 H -4.606 -1.996 6.899 1.00 . A A . 26 ASN HB2 1 1 28 15354 1 1 5 ASN HB3 H -6.031 -1.362 6.082 1.00 . A A . 26 ASN HB3 1 1 28 15355 1 1 5 ASN HD21 H -8.106 -1.584 7.072 1.00 . A A . 26 ASN HD21 1 1 28 15356 1 1 5 ASN HD22 H -8.239 -2.174 8.722 1.00 . A A . 26 ASN HD22 1 1 28 15357 1 1 5 ASN N N -4.950 -3.030 4.432 1.00 . A A . 26 ASN N 1 1 28 15358 1 1 5 ASN ND2 N -7.694 -2.023 7.888 1.00 . A A . 26 ASN ND2 1 1 28 15359 1 1 5 ASN O O -7.418 -5.030 5.961 1.00 . A A . 26 ASN O 1 1 28 15360 1 1 5 ASN OD1 O -5.986 -3.023 8.845 1.00 . A A . 26 ASN OD1 1 1 28 15361 1 1 6 CYS C C -9.739 -4.589 3.614 1.00 . A A . 27 CYS C 1 1 28 15362 1 1 6 CYS CA C -9.311 -3.439 4.560 1.00 . A A . 27 CYS CA 1 1 28 15363 1 1 6 CYS CB C -9.934 -2.102 4.129 1.00 . A A . 27 CYS CB 1 1 28 15364 1 1 6 CYS H H -7.496 -2.390 4.266 1.00 . A A . 27 CYS H 1 1 28 15365 1 1 6 CYS HA H -9.691 -3.680 5.554 1.00 . A A . 27 CYS HA 1 1 28 15366 1 1 6 CYS HB2 H -9.635 -1.879 3.104 1.00 . A A . 27 CYS HB2 1 1 28 15367 1 1 6 CYS HB3 H -11.023 -2.200 4.148 1.00 . A A . 27 CYS HB3 1 1 28 15368 1 1 6 CYS N N -7.861 -3.247 4.661 1.00 . A A . 27 CYS N 1 1 28 15369 1 1 6 CYS O O -10.917 -4.951 3.582 1.00 . A A . 27 CYS O 1 1 28 15370 1 1 6 CYS SG S -9.432 -0.753 5.244 1.00 . A A . 27 CYS SG 1 1 28 15371 1 1 7 GLY C C -10.096 -5.956 0.805 1.00 . A A . 28 GLY C 1 1 28 15372 1 1 7 GLY CA C -9.061 -6.262 1.900 1.00 . A A . 28 GLY CA 1 1 28 15373 1 1 7 GLY H H -7.854 -4.837 2.943 1.00 . A A . 28 GLY H 1 1 28 15374 1 1 7 GLY HA2 H -9.401 -7.133 2.462 1.00 . A A . 28 GLY HA2 1 1 28 15375 1 1 7 GLY HA3 H -8.124 -6.523 1.406 1.00 . A A . 28 GLY HA3 1 1 28 15376 1 1 7 GLY N N -8.806 -5.155 2.835 1.00 . A A . 28 GLY N 1 1 28 15377 1 1 7 GLY O O -10.843 -6.849 0.397 1.00 . A A . 28 GLY O 1 1 28 15378 1 1 8 LYS C C -10.578 -3.482 -1.784 1.00 . A A . 29 LYS C 1 1 28 15379 1 1 8 LYS CA C -11.209 -4.172 -0.555 1.00 . A A . 29 LYS CA 1 1 28 15380 1 1 8 LYS CB C -12.100 -3.217 0.265 1.00 . A A . 29 LYS CB 1 1 28 15381 1 1 8 LYS CD C -14.634 -3.566 -0.064 1.00 . A A . 29 LYS CD 1 1 28 15382 1 1 8 LYS CE C -14.526 -5.062 -0.387 1.00 . A A . 29 LYS CE 1 1 28 15383 1 1 8 LYS CG C -13.384 -2.761 -0.456 1.00 . A A . 29 LYS CG 1 1 28 15384 1 1 8 LYS H H -9.513 -4.033 0.742 1.00 . A A . 29 LYS H 1 1 28 15385 1 1 8 LYS HA H -11.831 -4.999 -0.884 1.00 . A A . 29 LYS HA 1 1 28 15386 1 1 8 LYS HB2 H -12.374 -3.692 1.209 1.00 . A A . 29 LYS HB2 1 1 28 15387 1 1 8 LYS HB3 H -11.516 -2.336 0.520 1.00 . A A . 29 LYS HB3 1 1 28 15388 1 1 8 LYS HD2 H -14.811 -3.439 1.007 1.00 . A A . 29 LYS HD2 1 1 28 15389 1 1 8 LYS HD3 H -15.490 -3.147 -0.597 1.00 . A A . 29 LYS HD3 1 1 28 15390 1 1 8 LYS HE2 H -14.344 -5.179 -1.459 1.00 . A A . 29 LYS HE2 1 1 28 15391 1 1 8 LYS HE3 H -13.671 -5.480 0.151 1.00 . A A . 29 LYS HE3 1 1 28 15392 1 1 8 LYS HG2 H -13.569 -1.720 -0.187 1.00 . A A . 29 LYS HG2 1 1 28 15393 1 1 8 LYS HG3 H -13.248 -2.800 -1.538 1.00 . A A . 29 LYS HG3 1 1 28 15394 1 1 8 LYS HZ1 H -16.571 -5.434 -0.494 1.00 . A A . 29 LYS HZ1 1 1 28 15395 1 1 8 LYS HZ2 H -15.687 -6.777 -0.217 1.00 . A A . 29 LYS HZ2 1 1 28 15396 1 1 8 LYS HZ3 H -15.944 -5.712 0.990 1.00 . A A . 29 LYS HZ3 1 1 28 15397 1 1 8 LYS N N -10.166 -4.696 0.347 1.00 . A A . 29 LYS N 1 1 28 15398 1 1 8 LYS NZ N -15.763 -5.791 -0.003 1.00 . A A . 29 LYS NZ 1 1 28 15399 1 1 8 LYS O O -9.849 -2.505 -1.585 1.00 . A A . 29 LYS O 1 1 28 15400 1 1 9 PRO C C -10.347 -1.901 -4.500 1.00 . A A . 30 PRO C 1 1 28 15401 1 1 9 PRO CA C -10.235 -3.416 -4.269 1.00 . A A . 30 PRO CA 1 1 28 15402 1 1 9 PRO CB C -10.923 -4.173 -5.412 1.00 . A A . 30 PRO CB 1 1 28 15403 1 1 9 PRO CD C -11.596 -5.152 -3.344 1.00 . A A . 30 PRO CD 1 1 28 15404 1 1 9 PRO CG C -11.251 -5.522 -4.784 1.00 . A A . 30 PRO CG 1 1 28 15405 1 1 9 PRO HA H -9.180 -3.684 -4.284 1.00 . A A . 30 PRO HA 1 1 28 15406 1 1 9 PRO HB2 H -11.852 -3.674 -5.695 1.00 . A A . 30 PRO HB2 1 1 28 15407 1 1 9 PRO HB3 H -10.269 -4.281 -6.278 1.00 . A A . 30 PRO HB3 1 1 28 15408 1 1 9 PRO HD2 H -12.662 -4.932 -3.269 1.00 . A A . 30 PRO HD2 1 1 28 15409 1 1 9 PRO HD3 H -11.333 -5.984 -2.691 1.00 . A A . 30 PRO HD3 1 1 28 15410 1 1 9 PRO HG2 H -12.085 -6.013 -5.288 1.00 . A A . 30 PRO HG2 1 1 28 15411 1 1 9 PRO HG3 H -10.364 -6.158 -4.797 1.00 . A A . 30 PRO HG3 1 1 28 15412 1 1 9 PRO N N -10.827 -3.951 -3.029 1.00 . A A . 30 PRO N 1 1 28 15413 1 1 9 PRO O O -9.445 -1.305 -5.093 1.00 . A A . 30 PRO O 1 1 28 15414 1 1 10 GLY C C -10.938 1.148 -3.388 1.00 . A A . 31 GLY C 1 1 28 15415 1 1 10 GLY CA C -11.750 0.156 -4.231 1.00 . A A . 31 GLY CA 1 1 28 15416 1 1 10 GLY H H -12.121 -1.828 -3.556 1.00 . A A . 31 GLY H 1 1 28 15417 1 1 10 GLY HA2 H -12.807 0.313 -4.017 1.00 . A A . 31 GLY HA2 1 1 28 15418 1 1 10 GLY HA3 H -11.582 0.400 -5.281 1.00 . A A . 31 GLY HA3 1 1 28 15419 1 1 10 GLY N N -11.424 -1.265 -4.021 1.00 . A A . 31 GLY N 1 1 28 15420 1 1 10 GLY O O -11.482 2.151 -2.919 1.00 . A A . 31 GLY O 1 1 28 15421 1 1 11 HIS C C -7.692 2.429 -3.210 1.00 . A A . 32 HIS C 1 1 28 15422 1 1 11 HIS CA C -8.741 1.693 -2.366 1.00 . A A . 32 HIS CA 1 1 28 15423 1 1 11 HIS CB C -8.102 0.838 -1.261 1.00 . A A . 32 HIS CB 1 1 28 15424 1 1 11 HIS CD2 C -8.719 1.383 1.162 1.00 . A A . 32 HIS CD2 1 1 28 15425 1 1 11 HIS CE1 C -10.540 0.181 1.387 1.00 . A A . 32 HIS CE1 1 1 28 15426 1 1 11 HIS CG C -8.957 0.756 -0.028 1.00 . A A . 32 HIS CG 1 1 28 15427 1 1 11 HIS H H -9.272 0.037 -3.598 1.00 . A A . 32 HIS H 1 1 28 15428 1 1 11 HIS HA H -9.321 2.471 -1.872 1.00 . A A . 32 HIS HA 1 1 28 15429 1 1 11 HIS HB2 H -7.920 -0.170 -1.627 1.00 . A A . 32 HIS HB2 1 1 28 15430 1 1 11 HIS HB3 H -7.139 1.266 -0.976 1.00 . A A . 32 HIS HB3 1 1 28 15431 1 1 11 HIS HD1 H -10.487 -0.624 -0.564 1.00 . A A . 32 HIS HD1 1 1 28 15432 1 1 11 HIS HD2 H -7.892 2.046 1.361 1.00 . A A . 32 HIS HD2 1 1 28 15433 1 1 11 HIS HE1 H -11.420 -0.294 1.808 1.00 . A A . 32 HIS HE1 1 1 28 15434 1 1 11 HIS N N -9.652 0.868 -3.163 1.00 . A A . 32 HIS N 1 1 28 15435 1 1 11 HIS ND1 N -10.098 0.008 0.128 1.00 . A A . 32 HIS ND1 1 1 28 15436 1 1 11 HIS NE2 N -9.711 0.994 2.070 1.00 . A A . 32 HIS NE2 1 1 28 15437 1 1 11 HIS O O -7.351 2.043 -4.332 1.00 . A A . 32 HIS O 1 1 28 15438 1 1 12 LEU C C -5.577 5.224 -2.001 1.00 . A A . 33 LEU C 1 1 28 15439 1 1 12 LEU CA C -6.305 4.541 -3.176 1.00 . A A . 33 LEU CA 1 1 28 15440 1 1 12 LEU CB C -7.130 5.610 -3.936 1.00 . A A . 33 LEU CB 1 1 28 15441 1 1 12 LEU CD1 C -8.665 6.320 -5.785 1.00 . A A . 33 LEU CD1 1 1 28 15442 1 1 12 LEU CD2 C -6.816 4.764 -6.318 1.00 . A A . 33 LEU CD2 1 1 28 15443 1 1 12 LEU CG C -7.823 5.168 -5.238 1.00 . A A . 33 LEU CG 1 1 28 15444 1 1 12 LEU H H -7.511 3.706 -1.681 1.00 . A A . 33 LEU H 1 1 28 15445 1 1 12 LEU HA H -5.563 4.083 -3.832 1.00 . A A . 33 LEU HA 1 1 28 15446 1 1 12 LEU HB2 H -7.895 5.988 -3.256 1.00 . A A . 33 LEU HB2 1 1 28 15447 1 1 12 LEU HB3 H -6.478 6.449 -4.184 1.00 . A A . 33 LEU HB3 1 1 28 15448 1 1 12 LEU HD11 H -9.412 6.609 -5.046 1.00 . A A . 33 LEU HD11 1 1 28 15449 1 1 12 LEU HD12 H -8.031 7.179 -6.007 1.00 . A A . 33 LEU HD12 1 1 28 15450 1 1 12 LEU HD13 H -9.179 6.004 -6.693 1.00 . A A . 33 LEU HD13 1 1 28 15451 1 1 12 LEU HD21 H -6.136 5.590 -6.526 1.00 . A A . 33 LEU HD21 1 1 28 15452 1 1 12 LEU HD22 H -6.242 3.898 -5.991 1.00 . A A . 33 LEU HD22 1 1 28 15453 1 1 12 LEU HD23 H -7.346 4.498 -7.233 1.00 . A A . 33 LEU HD23 1 1 28 15454 1 1 12 LEU HG H -8.494 4.335 -5.039 1.00 . A A . 33 LEU HG 1 1 28 15455 1 1 12 LEU N N -7.214 3.532 -2.631 1.00 . A A . 33 LEU N 1 1 28 15456 1 1 12 LEU O O -5.985 5.072 -0.844 1.00 . A A . 33 LEU O 1 1 28 15457 1 1 13 SER C C -4.891 7.928 -0.597 1.00 . A A . 34 SER C 1 1 28 15458 1 1 13 SER CA C -3.928 6.979 -1.339 1.00 . A A . 34 SER CA 1 1 28 15459 1 1 13 SER CB C -2.894 7.831 -2.084 1.00 . A A . 34 SER CB 1 1 28 15460 1 1 13 SER H H -4.261 6.106 -3.254 1.00 . A A . 34 SER H 1 1 28 15461 1 1 13 SER HA H -3.408 6.382 -0.588 1.00 . A A . 34 SER HA 1 1 28 15462 1 1 13 SER HB2 H -3.412 8.497 -2.776 1.00 . A A . 34 SER HB2 1 1 28 15463 1 1 13 SER HB3 H -2.335 8.437 -1.368 1.00 . A A . 34 SER HB3 1 1 28 15464 1 1 13 SER HG H -1.473 7.572 -3.410 1.00 . A A . 34 SER HG 1 1 28 15465 1 1 13 SER N N -4.585 6.066 -2.297 1.00 . A A . 34 SER N 1 1 28 15466 1 1 13 SER O O -4.547 8.469 0.456 1.00 . A A . 34 SER O 1 1 28 15467 1 1 13 SER OG O -2.001 7.005 -2.814 1.00 . A A . 34 SER OG 1 1 28 15468 1 1 14 SER C C -8.207 8.106 0.251 1.00 . A A . 35 SER C 1 1 28 15469 1 1 14 SER CA C -7.191 8.934 -0.559 1.00 . A A . 35 SER CA 1 1 28 15470 1 1 14 SER CB C -7.918 9.667 -1.693 1.00 . A A . 35 SER CB 1 1 28 15471 1 1 14 SER H H -6.287 7.718 -2.038 1.00 . A A . 35 SER H 1 1 28 15472 1 1 14 SER HA H -6.776 9.685 0.114 1.00 . A A . 35 SER HA 1 1 28 15473 1 1 14 SER HB2 H -8.767 10.221 -1.291 1.00 . A A . 35 SER HB2 1 1 28 15474 1 1 14 SER HB3 H -7.229 10.376 -2.153 1.00 . A A . 35 SER HB3 1 1 28 15475 1 1 14 SER HG H -8.830 9.239 -3.373 1.00 . A A . 35 SER HG 1 1 28 15476 1 1 14 SER N N -6.096 8.139 -1.140 1.00 . A A . 35 SER N 1 1 28 15477 1 1 14 SER O O -9.101 8.680 0.878 1.00 . A A . 35 SER O 1 1 28 15478 1 1 14 SER OG O -8.362 8.741 -2.676 1.00 . A A . 35 SER OG 1 1 28 15479 1 1 15 GLN C C -8.343 5.269 2.238 1.00 . A A . 36 GLN C 1 1 28 15480 1 1 15 GLN CA C -8.986 5.841 0.956 1.00 . A A . 36 GLN CA 1 1 28 15481 1 1 15 GLN CB C -9.376 4.724 -0.031 1.00 . A A . 36 GLN CB 1 1 28 15482 1 1 15 GLN CD C -11.919 4.758 -0.156 1.00 . A A . 36 GLN CD 1 1 28 15483 1 1 15 GLN CG C -10.685 4.001 0.331 1.00 . A A . 36 GLN CG 1 1 28 15484 1 1 15 GLN H H -7.295 6.374 -0.238 1.00 . A A . 36 GLN H 1 1 28 15485 1 1 15 GLN HA H -9.893 6.373 1.244 1.00 . A A . 36 GLN HA 1 1 28 15486 1 1 15 GLN HB2 H -9.485 5.139 -1.036 1.00 . A A . 36 GLN HB2 1 1 28 15487 1 1 15 GLN HB3 H -8.569 3.993 -0.064 1.00 . A A . 36 GLN HB3 1 1 28 15488 1 1 15 GLN HE21 H -12.075 3.639 -1.848 1.00 . A A . 36 GLN HE21 1 1 28 15489 1 1 15 GLN HE22 H -13.273 4.913 -1.626 1.00 . A A . 36 GLN HE22 1 1 28 15490 1 1 15 GLN HG2 H -10.688 3.020 -0.140 1.00 . A A . 36 GLN HG2 1 1 28 15491 1 1 15 GLN HG3 H -10.748 3.848 1.408 1.00 . A A . 36 GLN HG3 1 1 28 15492 1 1 15 GLN N N -8.075 6.773 0.271 1.00 . A A . 36 GLN N 1 1 28 15493 1 1 15 GLN NE2 N -12.460 4.410 -1.305 1.00 . A A . 36 GLN NE2 1 1 28 15494 1 1 15 GLN O O -8.986 5.271 3.290 1.00 . A A . 36 GLN O 1 1 28 15495 1 1 15 GLN OE1 O -12.417 5.676 0.484 1.00 . A A . 36 GLN OE1 1 1 28 15496 1 1 16 CYS C C -4.734 4.967 3.006 1.00 . A A . 37 CYS C 1 1 28 15497 1 1 16 CYS CA C -6.178 4.478 3.259 1.00 . A A . 37 CYS CA 1 1 28 15498 1 1 16 CYS CB C -6.206 2.946 3.438 1.00 . A A . 37 CYS CB 1 1 28 15499 1 1 16 CYS H H -6.616 4.962 1.248 1.00 . A A . 37 CYS H 1 1 28 15500 1 1 16 CYS HA H -6.520 4.942 4.185 1.00 . A A . 37 CYS HA 1 1 28 15501 1 1 16 CYS HB2 H -6.160 2.453 2.466 1.00 . A A . 37 CYS HB2 1 1 28 15502 1 1 16 CYS HB3 H -5.322 2.627 3.989 1.00 . A A . 37 CYS HB3 1 1 28 15503 1 1 16 CYS N N -7.062 4.877 2.155 1.00 . A A . 37 CYS N 1 1 28 15504 1 1 16 CYS O O -4.424 5.522 1.947 1.00 . A A . 37 CYS O 1 1 28 15505 1 1 16 CYS SG S -7.664 2.425 4.384 1.00 . A A . 37 CYS SG 1 1 28 15506 1 1 17 ARG C C -1.695 4.581 2.680 1.00 . A A . 38 ARG C 1 1 28 15507 1 1 17 ARG CA C -2.415 5.122 3.923 1.00 . A A . 38 ARG CA 1 1 28 15508 1 1 17 ARG CB C -1.670 4.660 5.193 1.00 . A A . 38 ARG CB 1 1 28 15509 1 1 17 ARG CD C -3.289 5.090 7.195 1.00 . A A . 38 ARG CD 1 1 28 15510 1 1 17 ARG CG C -1.963 5.431 6.495 1.00 . A A . 38 ARG CG 1 1 28 15511 1 1 17 ARG CZ C -5.702 5.731 7.001 1.00 . A A . 38 ARG CZ 1 1 28 15512 1 1 17 ARG H H -4.177 4.285 4.816 1.00 . A A . 38 ARG H 1 1 28 15513 1 1 17 ARG HA H -2.343 6.210 3.857 1.00 . A A . 38 ARG HA 1 1 28 15514 1 1 17 ARG HB2 H -1.843 3.594 5.354 1.00 . A A . 38 ARG HB2 1 1 28 15515 1 1 17 ARG HB3 H -0.604 4.787 5.003 1.00 . A A . 38 ARG HB3 1 1 28 15516 1 1 17 ARG HD2 H -3.486 4.024 7.080 1.00 . A A . 38 ARG HD2 1 1 28 15517 1 1 17 ARG HD3 H -3.169 5.301 8.259 1.00 . A A . 38 ARG HD3 1 1 28 15518 1 1 17 ARG HE H -4.205 6.669 6.088 1.00 . A A . 38 ARG HE 1 1 28 15519 1 1 17 ARG HG2 H -1.165 5.175 7.195 1.00 . A A . 38 ARG HG2 1 1 28 15520 1 1 17 ARG HG3 H -1.899 6.504 6.315 1.00 . A A . 38 ARG HG3 1 1 28 15521 1 1 17 ARG HH11 H -5.428 4.213 8.268 1.00 . A A . 38 ARG HH11 1 1 28 15522 1 1 17 ARG HH12 H -7.085 4.688 8.020 1.00 . A A . 38 ARG HH12 1 1 28 15523 1 1 17 ARG HH21 H -6.343 7.270 5.879 1.00 . A A . 38 ARG HH21 1 1 28 15524 1 1 17 ARG HH22 H -7.576 6.375 6.712 1.00 . A A . 38 ARG HH22 1 1 28 15525 1 1 17 ARG N N -3.838 4.737 3.979 1.00 . A A . 38 ARG N 1 1 28 15526 1 1 17 ARG NE N -4.426 5.891 6.693 1.00 . A A . 38 ARG NE 1 1 28 15527 1 1 17 ARG NH1 N -6.106 4.799 7.815 1.00 . A A . 38 ARG NH1 1 1 28 15528 1 1 17 ARG NH2 N -6.606 6.513 6.488 1.00 . A A . 38 ARG NH2 1 1 28 15529 1 1 17 ARG O O -0.864 5.290 2.111 1.00 . A A . 38 ARG O 1 1 28 15530 1 1 18 ALA C C -2.401 1.568 0.536 1.00 . A A . 39 ALA C 1 1 28 15531 1 1 18 ALA CA C -1.516 2.745 1.014 1.00 . A A . 39 ALA CA 1 1 28 15532 1 1 18 ALA CB C -0.089 2.237 1.285 1.00 . A A . 39 ALA CB 1 1 28 15533 1 1 18 ALA H H -2.703 2.842 2.775 1.00 . A A . 39 ALA H 1 1 28 15534 1 1 18 ALA HA H -1.489 3.502 0.232 1.00 . A A . 39 ALA HA 1 1 28 15535 1 1 18 ALA HB1 H 0.561 3.061 1.577 1.00 . A A . 39 ALA HB1 1 1 28 15536 1 1 18 ALA HB2 H -0.114 1.493 2.082 1.00 . A A . 39 ALA HB2 1 1 28 15537 1 1 18 ALA HB3 H 0.322 1.769 0.390 1.00 . A A . 39 ALA HB3 1 1 28 15538 1 1 18 ALA N N -2.020 3.361 2.245 1.00 . A A . 39 ALA N 1 1 28 15539 1 1 18 ALA O O -3.130 0.977 1.341 1.00 . A A . 39 ALA O 1 1 28 15540 1 1 19 PRO C C -1.687 -1.242 -0.699 1.00 . A A . 40 PRO C 1 1 28 15541 1 1 19 PRO CA C -2.689 -0.178 -1.190 1.00 . A A . 40 PRO CA 1 1 28 15542 1 1 19 PRO CB C -2.713 -0.083 -2.719 1.00 . A A . 40 PRO CB 1 1 28 15543 1 1 19 PRO CD C -1.689 1.902 -1.847 1.00 . A A . 40 PRO CD 1 1 28 15544 1 1 19 PRO CG C -1.610 0.929 -3.023 1.00 . A A . 40 PRO CG 1 1 28 15545 1 1 19 PRO HA H -3.685 -0.428 -0.827 1.00 . A A . 40 PRO HA 1 1 28 15546 1 1 19 PRO HB2 H -2.527 -1.043 -3.201 1.00 . A A . 40 PRO HB2 1 1 28 15547 1 1 19 PRO HB3 H -3.675 0.321 -3.040 1.00 . A A . 40 PRO HB3 1 1 28 15548 1 1 19 PRO HD2 H -0.689 2.258 -1.597 1.00 . A A . 40 PRO HD2 1 1 28 15549 1 1 19 PRO HD3 H -2.330 2.745 -2.110 1.00 . A A . 40 PRO HD3 1 1 28 15550 1 1 19 PRO HG2 H -0.641 0.428 -3.020 1.00 . A A . 40 PRO HG2 1 1 28 15551 1 1 19 PRO HG3 H -1.776 1.436 -3.975 1.00 . A A . 40 PRO HG3 1 1 28 15552 1 1 19 PRO N N -2.299 1.161 -0.746 1.00 . A A . 40 PRO N 1 1 28 15553 1 1 19 PRO O O -0.589 -0.916 -0.243 1.00 . A A . 40 PRO O 1 1 28 15554 1 1 20 LYS C C 0.167 -3.828 -0.783 1.00 . A A . 41 LYS C 1 1 28 15555 1 1 20 LYS CA C -1.290 -3.700 -0.317 1.00 . A A . 41 LYS CA 1 1 28 15556 1 1 20 LYS CB C -2.106 -4.977 -0.618 1.00 . A A . 41 LYS CB 1 1 28 15557 1 1 20 LYS CD C -1.886 -6.021 1.721 1.00 . A A . 41 LYS CD 1 1 28 15558 1 1 20 LYS CE C -1.711 -7.331 2.495 1.00 . A A . 41 LYS CE 1 1 28 15559 1 1 20 LYS CG C -1.740 -6.229 0.205 1.00 . A A . 41 LYS CG 1 1 28 15560 1 1 20 LYS H H -2.953 -2.708 -1.237 1.00 . A A . 41 LYS H 1 1 28 15561 1 1 20 LYS HA H -1.214 -3.567 0.757 1.00 . A A . 41 LYS HA 1 1 28 15562 1 1 20 LYS HB2 H -3.162 -4.771 -0.438 1.00 . A A . 41 LYS HB2 1 1 28 15563 1 1 20 LYS HB3 H -2.005 -5.218 -1.677 1.00 . A A . 41 LYS HB3 1 1 28 15564 1 1 20 LYS HD2 H -1.136 -5.310 2.065 1.00 . A A . 41 LYS HD2 1 1 28 15565 1 1 20 LYS HD3 H -2.883 -5.628 1.926 1.00 . A A . 41 LYS HD3 1 1 28 15566 1 1 20 LYS HE2 H -2.483 -8.036 2.171 1.00 . A A . 41 LYS HE2 1 1 28 15567 1 1 20 LYS HE3 H -0.736 -7.763 2.247 1.00 . A A . 41 LYS HE3 1 1 28 15568 1 1 20 LYS HG2 H -2.404 -7.037 -0.102 1.00 . A A . 41 LYS HG2 1 1 28 15569 1 1 20 LYS HG3 H -0.718 -6.538 -0.022 1.00 . A A . 41 LYS HG3 1 1 28 15570 1 1 20 LYS HZ1 H -2.683 -6.651 4.207 1.00 . A A . 41 LYS HZ1 1 1 28 15571 1 1 20 LYS HZ2 H -1.756 -7.975 4.471 1.00 . A A . 41 LYS HZ2 1 1 28 15572 1 1 20 LYS HZ3 H -1.064 -6.507 4.292 1.00 . A A . 41 LYS HZ3 1 1 28 15573 1 1 20 LYS N N -2.037 -2.530 -0.835 1.00 . A A . 41 LYS N 1 1 28 15574 1 1 20 LYS NZ N -1.811 -7.102 3.961 1.00 . A A . 41 LYS NZ 1 1 28 15575 1 1 20 LYS O O 0.945 -4.543 -0.153 1.00 . A A . 41 LYS O 1 1 28 15576 1 1 21 VAL C C 2.872 -2.426 -1.118 1.00 . A A . 42 VAL C 1 1 28 15577 1 1 21 VAL CA C 1.962 -2.907 -2.265 1.00 . A A . 42 VAL CA 1 1 28 15578 1 1 21 VAL CB C 2.002 -1.897 -3.434 1.00 . A A . 42 VAL CB 1 1 28 15579 1 1 21 VAL CG1 C 3.415 -1.668 -3.977 1.00 . A A . 42 VAL CG1 1 1 28 15580 1 1 21 VAL CG2 C 1.133 -2.362 -4.613 1.00 . A A . 42 VAL CG2 1 1 28 15581 1 1 21 VAL H H -0.151 -2.563 -2.292 1.00 . A A . 42 VAL H 1 1 28 15582 1 1 21 VAL HA H 2.357 -3.859 -2.620 1.00 . A A . 42 VAL HA 1 1 28 15583 1 1 21 VAL HB H 1.614 -0.939 -3.083 1.00 . A A . 42 VAL HB 1 1 28 15584 1 1 21 VAL HG11 H 3.858 -2.618 -4.279 1.00 . A A . 42 VAL HG11 1 1 28 15585 1 1 21 VAL HG12 H 3.383 -0.999 -4.837 1.00 . A A . 42 VAL HG12 1 1 28 15586 1 1 21 VAL HG13 H 4.042 -1.204 -3.217 1.00 . A A . 42 VAL HG13 1 1 28 15587 1 1 21 VAL HG21 H 1.471 -3.339 -4.963 1.00 . A A . 42 VAL HG21 1 1 28 15588 1 1 21 VAL HG22 H 0.087 -2.427 -4.320 1.00 . A A . 42 VAL HG22 1 1 28 15589 1 1 21 VAL HG23 H 1.206 -1.643 -5.430 1.00 . A A . 42 VAL HG23 1 1 28 15590 1 1 21 VAL N N 0.563 -3.104 -1.830 1.00 . A A . 42 VAL N 1 1 28 15591 1 1 21 VAL O O 4.047 -2.793 -1.068 1.00 . A A . 42 VAL O 1 1 28 15592 1 1 22 CYS C C 2.073 -0.939 2.176 1.00 . A A . 43 CYS C 1 1 28 15593 1 1 22 CYS CA C 3.011 -1.021 0.945 1.00 . A A . 43 CYS CA 1 1 28 15594 1 1 22 CYS CB C 3.495 0.355 0.439 1.00 . A A . 43 CYS CB 1 1 28 15595 1 1 22 CYS H H 1.331 -1.444 -0.265 1.00 . A A . 43 CYS H 1 1 28 15596 1 1 22 CYS HA H 3.883 -1.615 1.221 1.00 . A A . 43 CYS HA 1 1 28 15597 1 1 22 CYS HB2 H 3.968 0.217 -0.535 1.00 . A A . 43 CYS HB2 1 1 28 15598 1 1 22 CYS HB3 H 2.637 1.017 0.310 1.00 . A A . 43 CYS HB3 1 1 28 15599 1 1 22 CYS N N 2.321 -1.647 -0.181 1.00 . A A . 43 CYS N 1 1 28 15600 1 1 22 CYS O O 1.087 -1.670 2.284 1.00 . A A . 43 CYS O 1 1 28 15601 1 1 22 CYS SG S 4.703 1.102 1.565 1.00 . A A . 43 CYS SG 1 1 28 15602 1 1 23 PHE C C 1.612 1.946 4.426 1.00 . A A . 44 PHE C 1 1 28 15603 1 1 23 PHE CA C 1.573 0.414 4.228 1.00 . A A . 44 PHE CA 1 1 28 15604 1 1 23 PHE CB C 2.039 -0.306 5.505 1.00 . A A . 44 PHE CB 1 1 28 15605 1 1 23 PHE CD1 C 4.584 -0.322 5.488 1.00 . A A . 44 PHE CD1 1 1 28 15606 1 1 23 PHE CD2 C 3.433 1.113 7.082 1.00 . A A . 44 PHE CD2 1 1 28 15607 1 1 23 PHE CE1 C 5.822 0.139 5.969 1.00 . A A . 44 PHE CE1 1 1 28 15608 1 1 23 PHE CE2 C 4.671 1.573 7.565 1.00 . A A . 44 PHE CE2 1 1 28 15609 1 1 23 PHE CG C 3.383 0.165 6.040 1.00 . A A . 44 PHE CG 1 1 28 15610 1 1 23 PHE CZ C 5.866 1.088 7.007 1.00 . A A . 44 PHE CZ 1 1 28 15611 1 1 23 PHE H H 3.276 0.430 2.939 1.00 . A A . 44 PHE H 1 1 28 15612 1 1 23 PHE HA H 0.535 0.139 4.042 1.00 . A A . 44 PHE HA 1 1 28 15613 1 1 23 PHE HB2 H 1.286 -0.151 6.278 1.00 . A A . 44 PHE HB2 1 1 28 15614 1 1 23 PHE HB3 H 2.085 -1.380 5.315 1.00 . A A . 44 PHE HB3 1 1 28 15615 1 1 23 PHE HD1 H 4.559 -1.052 4.691 1.00 . A A . 44 PHE HD1 1 1 28 15616 1 1 23 PHE HD2 H 2.517 1.496 7.511 1.00 . A A . 44 PHE HD2 1 1 28 15617 1 1 23 PHE HE1 H 6.742 -0.240 5.545 1.00 . A A . 44 PHE HE1 1 1 28 15618 1 1 23 PHE HE2 H 4.702 2.298 8.367 1.00 . A A . 44 PHE HE2 1 1 28 15619 1 1 23 PHE HZ H 6.822 1.435 7.380 1.00 . A A . 44 PHE HZ 1 1 28 15620 1 1 23 PHE N N 2.392 -0.033 3.098 1.00 . A A . 44 PHE N 1 1 28 15621 1 1 23 PHE O O 0.816 2.479 5.201 1.00 . A A . 44 PHE O 1 1 28 15622 1 1 24 LYS C C 3.492 4.745 2.730 1.00 . A A . 45 LYS C 1 1 28 15623 1 1 24 LYS CA C 2.801 4.099 3.941 1.00 . A A . 45 LYS CA 1 1 28 15624 1 1 24 LYS CB C 3.675 4.230 5.209 1.00 . A A . 45 LYS CB 1 1 28 15625 1 1 24 LYS CD C 5.020 5.738 6.774 1.00 . A A . 45 LYS CD 1 1 28 15626 1 1 24 LYS CE C 6.369 5.039 6.537 1.00 . A A . 45 LYS CE 1 1 28 15627 1 1 24 LYS CG C 4.110 5.670 5.538 1.00 . A A . 45 LYS CG 1 1 28 15628 1 1 24 LYS H H 3.120 2.156 3.096 1.00 . A A . 45 LYS H 1 1 28 15629 1 1 24 LYS HA H 1.864 4.633 4.101 1.00 . A A . 45 LYS HA 1 1 28 15630 1 1 24 LYS HB2 H 3.114 3.847 6.061 1.00 . A A . 45 LYS HB2 1 1 28 15631 1 1 24 LYS HB3 H 4.560 3.605 5.087 1.00 . A A . 45 LYS HB3 1 1 28 15632 1 1 24 LYS HD2 H 5.200 6.789 7.008 1.00 . A A . 45 LYS HD2 1 1 28 15633 1 1 24 LYS HD3 H 4.510 5.279 7.624 1.00 . A A . 45 LYS HD3 1 1 28 15634 1 1 24 LYS HE2 H 6.194 3.976 6.346 1.00 . A A . 45 LYS HE2 1 1 28 15635 1 1 24 LYS HE3 H 6.832 5.465 5.640 1.00 . A A . 45 LYS HE3 1 1 28 15636 1 1 24 LYS HG2 H 4.647 6.106 4.695 1.00 . A A . 45 LYS HG2 1 1 28 15637 1 1 24 LYS HG3 H 3.219 6.271 5.724 1.00 . A A . 45 LYS HG3 1 1 28 15638 1 1 24 LYS HZ1 H 6.881 4.805 8.541 1.00 . A A . 45 LYS HZ1 1 1 28 15639 1 1 24 LYS HZ2 H 8.164 4.732 7.535 1.00 . A A . 45 LYS HZ2 1 1 28 15640 1 1 24 LYS HZ3 H 7.482 6.173 7.879 1.00 . A A . 45 LYS HZ3 1 1 28 15641 1 1 24 LYS N N 2.530 2.660 3.745 1.00 . A A . 45 LYS N 1 1 28 15642 1 1 24 LYS NZ N 7.282 5.197 7.700 1.00 . A A . 45 LYS NZ 1 1 28 15643 1 1 24 LYS O O 2.926 5.650 2.110 1.00 . A A . 45 LYS O 1 1 28 15644 1 1 25 CYS C C 5.228 4.813 -0.001 1.00 . A A . 46 CYS C 1 1 28 15645 1 1 25 CYS CA C 5.644 4.924 1.480 1.00 . A A . 46 CYS CA 1 1 28 15646 1 1 25 CYS CB C 7.070 4.369 1.718 1.00 . A A . 46 CYS CB 1 1 28 15647 1 1 25 CYS H H 5.094 3.558 2.982 1.00 . A A . 46 CYS H 1 1 28 15648 1 1 25 CYS HA H 5.670 5.989 1.719 1.00 . A A . 46 CYS HA 1 1 28 15649 1 1 25 CYS HB2 H 7.478 3.999 0.776 1.00 . A A . 46 CYS HB2 1 1 28 15650 1 1 25 CYS HB3 H 7.707 5.203 2.024 1.00 . A A . 46 CYS HB3 1 1 28 15651 1 1 25 CYS N N 4.705 4.293 2.411 1.00 . A A . 46 CYS N 1 1 28 15652 1 1 25 CYS O O 5.383 5.780 -0.748 1.00 . A A . 46 CYS O 1 1 28 15653 1 1 25 CYS SG S 7.190 3.059 2.984 1.00 . A A . 46 CYS SG 1 1 28 15654 1 1 26 LYS C C 4.712 3.844 -3.002 1.00 . A A . 47 LYS C 1 1 28 15655 1 1 26 LYS CA C 4.011 3.359 -1.709 1.00 . A A . 47 LYS CA 1 1 28 15656 1 1 26 LYS CB C 2.510 3.726 -1.625 1.00 . A A . 47 LYS CB 1 1 28 15657 1 1 26 LYS CD C 0.743 5.516 -1.239 1.00 . A A . 47 LYS CD 1 1 28 15658 1 1 26 LYS CE C 0.527 6.942 -0.714 1.00 . A A . 47 LYS CE 1 1 28 15659 1 1 26 LYS CG C 2.239 5.223 -1.402 1.00 . A A . 47 LYS CG 1 1 28 15660 1 1 26 LYS H H 4.596 2.944 0.308 1.00 . A A . 47 LYS H 1 1 28 15661 1 1 26 LYS HA H 4.032 2.275 -1.811 1.00 . A A . 47 LYS HA 1 1 28 15662 1 1 26 LYS HB2 H 2.002 3.402 -2.534 1.00 . A A . 47 LYS HB2 1 1 28 15663 1 1 26 LYS HB3 H 2.074 3.171 -0.793 1.00 . A A . 47 LYS HB3 1 1 28 15664 1 1 26 LYS HD2 H 0.258 5.411 -2.210 1.00 . A A . 47 LYS HD2 1 1 28 15665 1 1 26 LYS HD3 H 0.292 4.805 -0.547 1.00 . A A . 47 LYS HD3 1 1 28 15666 1 1 26 LYS HE2 H 1.146 7.631 -1.297 1.00 . A A . 47 LYS HE2 1 1 28 15667 1 1 26 LYS HE3 H -0.519 7.212 -0.878 1.00 . A A . 47 LYS HE3 1 1 28 15668 1 1 26 LYS HG2 H 2.743 5.542 -0.496 1.00 . A A . 47 LYS HG2 1 1 28 15669 1 1 26 LYS HG3 H 2.631 5.799 -2.239 1.00 . A A . 47 LYS HG3 1 1 28 15670 1 1 26 LYS HZ1 H 1.775 6.727 0.956 1.00 . A A . 47 LYS HZ1 1 1 28 15671 1 1 26 LYS HZ2 H 0.756 8.010 1.058 1.00 . A A . 47 LYS HZ2 1 1 28 15672 1 1 26 LYS HZ3 H 0.202 6.484 1.283 1.00 . A A . 47 LYS HZ3 1 1 28 15673 1 1 26 LYS N N 4.659 3.663 -0.406 1.00 . A A . 47 LYS N 1 1 28 15674 1 1 26 LYS NZ N 0.840 7.056 0.736 1.00 . A A . 47 LYS NZ 1 1 28 15675 1 1 26 LYS O O 4.062 3.986 -4.039 1.00 . A A . 47 LYS O 1 1 28 15676 1 1 27 GLN C C 6.962 3.314 -5.182 1.00 . A A . 48 GLN C 1 1 28 15677 1 1 27 GLN CA C 6.824 4.466 -4.152 1.00 . A A . 48 GLN CA 1 1 28 15678 1 1 27 GLN CB C 8.216 4.960 -3.712 1.00 . A A . 48 GLN CB 1 1 28 15679 1 1 27 GLN CD C 7.422 7.351 -3.282 1.00 . A A . 48 GLN CD 1 1 28 15680 1 1 27 GLN CG C 8.201 6.152 -2.741 1.00 . A A . 48 GLN CG 1 1 28 15681 1 1 27 GLN H H 6.503 3.954 -2.093 1.00 . A A . 48 GLN H 1 1 28 15682 1 1 27 GLN HA H 6.298 5.294 -4.625 1.00 . A A . 48 GLN HA 1 1 28 15683 1 1 27 GLN HB2 H 8.747 4.139 -3.233 1.00 . A A . 48 GLN HB2 1 1 28 15684 1 1 27 GLN HB3 H 8.786 5.249 -4.596 1.00 . A A . 48 GLN HB3 1 1 28 15685 1 1 27 GLN HE21 H 5.898 7.074 -1.981 1.00 . A A . 48 GLN HE21 1 1 28 15686 1 1 27 GLN HE22 H 5.748 8.440 -3.094 1.00 . A A . 48 GLN HE22 1 1 28 15687 1 1 27 GLN HG2 H 7.785 5.839 -1.784 1.00 . A A . 48 GLN HG2 1 1 28 15688 1 1 27 GLN HG3 H 9.229 6.464 -2.555 1.00 . A A . 48 GLN HG3 1 1 28 15689 1 1 27 GLN N N 6.030 4.070 -2.975 1.00 . A A . 48 GLN N 1 1 28 15690 1 1 27 GLN NE2 N 6.262 7.649 -2.739 1.00 . A A . 48 GLN NE2 1 1 28 15691 1 1 27 GLN O O 6.980 2.150 -4.764 1.00 . A A . 48 GLN O 1 1 28 15692 1 1 27 GLN OE1 O 7.837 8.030 -4.212 1.00 . A A . 48 GLN OE1 1 1 28 15693 1 1 28 PRO C C 7.857 1.332 -7.554 1.00 . A A . 49 PRO C 1 1 28 15694 1 1 28 PRO CA C 7.017 2.625 -7.603 1.00 . A A . 49 PRO CA 1 1 28 15695 1 1 28 PRO CB C 7.366 3.409 -8.872 1.00 . A A . 49 PRO CB 1 1 28 15696 1 1 28 PRO CD C 7.207 4.947 -7.060 1.00 . A A . 49 PRO CD 1 1 28 15697 1 1 28 PRO CG C 6.902 4.822 -8.550 1.00 . A A . 49 PRO CG 1 1 28 15698 1 1 28 PRO HA H 5.970 2.326 -7.671 1.00 . A A . 49 PRO HA 1 1 28 15699 1 1 28 PRO HB2 H 8.447 3.412 -9.026 1.00 . A A . 49 PRO HB2 1 1 28 15700 1 1 28 PRO HB3 H 6.856 3.009 -9.748 1.00 . A A . 49 PRO HB3 1 1 28 15701 1 1 28 PRO HD2 H 8.221 5.326 -6.928 1.00 . A A . 49 PRO HD2 1 1 28 15702 1 1 28 PRO HD3 H 6.491 5.637 -6.616 1.00 . A A . 49 PRO HD3 1 1 28 15703 1 1 28 PRO HG2 H 7.436 5.569 -9.138 1.00 . A A . 49 PRO HG2 1 1 28 15704 1 1 28 PRO HG3 H 5.826 4.901 -8.712 1.00 . A A . 49 PRO HG3 1 1 28 15705 1 1 28 PRO N N 7.114 3.599 -6.498 1.00 . A A . 49 PRO N 1 1 28 15706 1 1 28 PRO O O 7.510 0.372 -8.245 1.00 . A A . 49 PRO O 1 1 28 15707 1 1 29 GLY C C 10.579 -0.070 -5.358 1.00 . A A . 50 GLY C 1 1 28 15708 1 1 29 GLY CA C 9.828 0.096 -6.684 1.00 . A A . 50 GLY CA 1 1 28 15709 1 1 29 GLY H H 9.224 2.128 -6.309 1.00 . A A . 50 GLY H 1 1 28 15710 1 1 29 GLY HA2 H 10.564 0.143 -7.487 1.00 . A A . 50 GLY HA2 1 1 28 15711 1 1 29 GLY HA3 H 9.233 -0.807 -6.826 1.00 . A A . 50 GLY HA3 1 1 28 15712 1 1 29 GLY N N 8.948 1.279 -6.780 1.00 . A A . 50 GLY N 1 1 28 15713 1 1 29 GLY O O 11.493 -0.895 -5.263 1.00 . A A . 50 GLY O 1 1 28 15714 1 1 30 HIS C C 10.496 -0.643 -2.219 1.00 . A A . 51 HIS C 1 1 28 15715 1 1 30 HIS CA C 10.866 0.633 -3.003 1.00 . A A . 51 HIS CA 1 1 28 15716 1 1 30 HIS CB C 10.487 1.883 -2.191 1.00 . A A . 51 HIS CB 1 1 28 15717 1 1 30 HIS CD2 C 8.970 1.595 -0.153 1.00 . A A . 51 HIS CD2 1 1 28 15718 1 1 30 HIS CE1 C 7.021 1.334 -1.126 1.00 . A A . 51 HIS CE1 1 1 28 15719 1 1 30 HIS CG C 9.146 1.778 -1.499 1.00 . A A . 51 HIS CG 1 1 28 15720 1 1 30 HIS H H 9.482 1.370 -4.463 1.00 . A A . 51 HIS H 1 1 28 15721 1 1 30 HIS HA H 11.948 0.636 -3.140 1.00 . A A . 51 HIS HA 1 1 28 15722 1 1 30 HIS HB2 H 11.249 2.026 -1.422 1.00 . A A . 51 HIS HB2 1 1 28 15723 1 1 30 HIS HB3 H 10.512 2.766 -2.831 1.00 . A A . 51 HIS HB3 1 1 28 15724 1 1 30 HIS HD1 H 7.680 1.705 -3.080 1.00 . A A . 51 HIS HD1 1 1 28 15725 1 1 30 HIS HD2 H 9.757 1.587 0.588 1.00 . A A . 51 HIS HD2 1 1 28 15726 1 1 30 HIS HE1 H 5.970 1.129 -1.293 1.00 . A A . 51 HIS HE1 1 1 28 15727 1 1 30 HIS N N 10.228 0.705 -4.327 1.00 . A A . 51 HIS N 1 1 28 15728 1 1 30 HIS ND1 N 7.908 1.625 -2.090 1.00 . A A . 51 HIS ND1 1 1 28 15729 1 1 30 HIS NE2 N 7.619 1.320 0.075 1.00 . A A . 51 HIS NE2 1 1 28 15730 1 1 30 HIS O O 11.272 -1.114 -1.387 1.00 . A A . 51 HIS O 1 1 28 15731 1 1 31 PHE C C 9.550 -3.549 -1.683 1.00 . A A . 52 PHE C 1 1 28 15732 1 1 31 PHE CA C 8.720 -2.261 -1.636 1.00 . A A . 52 PHE CA 1 1 28 15733 1 1 31 PHE CB C 7.249 -2.482 -2.022 1.00 . A A . 52 PHE CB 1 1 28 15734 1 1 31 PHE CD1 C 6.714 -1.571 -4.329 1.00 . A A . 52 PHE CD1 1 1 28 15735 1 1 31 PHE CD2 C 6.971 -3.977 -4.057 1.00 . A A . 52 PHE CD2 1 1 28 15736 1 1 31 PHE CE1 C 6.460 -1.753 -5.699 1.00 . A A . 52 PHE CE1 1 1 28 15737 1 1 31 PHE CE2 C 6.721 -4.157 -5.429 1.00 . A A . 52 PHE CE2 1 1 28 15738 1 1 31 PHE CG C 6.976 -2.682 -3.503 1.00 . A A . 52 PHE CG 1 1 28 15739 1 1 31 PHE CZ C 6.468 -3.045 -6.252 1.00 . A A . 52 PHE CZ 1 1 28 15740 1 1 31 PHE H H 8.724 -0.782 -3.170 1.00 . A A . 52 PHE H 1 1 28 15741 1 1 31 PHE HA H 8.730 -1.922 -0.599 1.00 . A A . 52 PHE HA 1 1 28 15742 1 1 31 PHE HB2 H 6.866 -3.341 -1.469 1.00 . A A . 52 PHE HB2 1 1 28 15743 1 1 31 PHE HB3 H 6.676 -1.615 -1.685 1.00 . A A . 52 PHE HB3 1 1 28 15744 1 1 31 PHE HD1 H 6.683 -0.574 -3.912 1.00 . A A . 52 PHE HD1 1 1 28 15745 1 1 31 PHE HD2 H 7.164 -4.838 -3.432 1.00 . A A . 52 PHE HD2 1 1 28 15746 1 1 31 PHE HE1 H 6.243 -0.899 -6.326 1.00 . A A . 52 PHE HE1 1 1 28 15747 1 1 31 PHE HE2 H 6.729 -5.153 -5.853 1.00 . A A . 52 PHE HE2 1 1 28 15748 1 1 31 PHE HZ H 6.272 -3.184 -7.307 1.00 . A A . 52 PHE HZ 1 1 28 15749 1 1 31 PHE N N 9.304 -1.199 -2.458 1.00 . A A . 52 PHE N 1 1 28 15750 1 1 31 PHE O O 9.886 -4.085 -0.629 1.00 . A A . 52 PHE O 1 1 28 15751 1 1 32 SER C C 12.243 -5.082 -2.343 1.00 . A A . 53 SER C 1 1 28 15752 1 1 32 SER CA C 10.882 -5.146 -3.068 1.00 . A A . 53 SER CA 1 1 28 15753 1 1 32 SER CB C 11.128 -5.352 -4.568 1.00 . A A . 53 SER CB 1 1 28 15754 1 1 32 SER H H 9.675 -3.502 -3.696 1.00 . A A . 53 SER H 1 1 28 15755 1 1 32 SER HA H 10.361 -6.026 -2.690 1.00 . A A . 53 SER HA 1 1 28 15756 1 1 32 SER HB2 H 11.701 -4.510 -4.959 1.00 . A A . 53 SER HB2 1 1 28 15757 1 1 32 SER HB3 H 11.704 -6.268 -4.719 1.00 . A A . 53 SER HB3 1 1 28 15758 1 1 32 SER HG H 10.094 -5.614 -6.212 1.00 . A A . 53 SER HG 1 1 28 15759 1 1 32 SER N N 10.006 -3.973 -2.863 1.00 . A A . 53 SER N 1 1 28 15760 1 1 32 SER O O 12.993 -6.061 -2.364 1.00 . A A . 53 SER O 1 1 28 15761 1 1 32 SER OG O 9.898 -5.454 -5.269 1.00 . A A . 53 SER OG 1 1 28 15762 1 1 33 LYS C C 13.577 -2.977 0.394 1.00 . A A . 54 LYS C 1 1 28 15763 1 1 33 LYS CA C 13.806 -3.688 -0.957 1.00 . A A . 54 LYS CA 1 1 28 15764 1 1 33 LYS CB C 14.807 -2.958 -1.878 1.00 . A A . 54 LYS CB 1 1 28 15765 1 1 33 LYS CD C 15.358 -0.879 -3.269 1.00 . A A . 54 LYS CD 1 1 28 15766 1 1 33 LYS CE C 15.461 -1.515 -4.665 1.00 . A A . 54 LYS CE 1 1 28 15767 1 1 33 LYS CG C 14.333 -1.570 -2.354 1.00 . A A . 54 LYS CG 1 1 28 15768 1 1 33 LYS H H 11.903 -3.184 -1.768 1.00 . A A . 54 LYS H 1 1 28 15769 1 1 33 LYS HA H 14.248 -4.650 -0.690 1.00 . A A . 54 LYS HA 1 1 28 15770 1 1 33 LYS HB2 H 15.756 -2.846 -1.352 1.00 . A A . 54 LYS HB2 1 1 28 15771 1 1 33 LYS HB3 H 14.990 -3.590 -2.747 1.00 . A A . 54 LYS HB3 1 1 28 15772 1 1 33 LYS HD2 H 15.096 0.175 -3.370 1.00 . A A . 54 LYS HD2 1 1 28 15773 1 1 33 LYS HD3 H 16.337 -0.927 -2.790 1.00 . A A . 54 LYS HD3 1 1 28 15774 1 1 33 LYS HE2 H 16.415 -1.212 -5.107 1.00 . A A . 54 LYS HE2 1 1 28 15775 1 1 33 LYS HE3 H 15.481 -2.604 -4.566 1.00 . A A . 54 LYS HE3 1 1 28 15776 1 1 33 LYS HG2 H 13.390 -1.664 -2.894 1.00 . A A . 54 LYS HG2 1 1 28 15777 1 1 33 LYS HG3 H 14.170 -0.935 -1.483 1.00 . A A . 54 LYS HG3 1 1 28 15778 1 1 33 LYS HZ1 H 13.436 -1.318 -5.195 1.00 . A A . 54 LYS HZ1 1 1 28 15779 1 1 33 LYS HZ2 H 14.379 -0.098 -5.732 1.00 . A A . 54 LYS HZ2 1 1 28 15780 1 1 33 LYS HZ3 H 14.430 -1.547 -6.469 1.00 . A A . 54 LYS HZ3 1 1 28 15781 1 1 33 LYS N N 12.569 -3.944 -1.711 1.00 . A A . 54 LYS N 1 1 28 15782 1 1 33 LYS NZ N 14.354 -1.095 -5.568 1.00 . A A . 54 LYS NZ 1 1 28 15783 1 1 33 LYS O O 14.540 -2.495 0.996 1.00 . A A . 54 LYS O 1 1 28 15784 1 1 34 GLN C C 10.734 -2.979 2.844 1.00 . A A . 55 GLN C 1 1 28 15785 1 1 34 GLN CA C 11.997 -2.358 2.208 1.00 . A A . 55 GLN CA 1 1 28 15786 1 1 34 GLN CB C 11.833 -0.831 2.082 1.00 . A A . 55 GLN CB 1 1 28 15787 1 1 34 GLN CD C 11.424 1.330 3.341 1.00 . A A . 55 GLN CD 1 1 28 15788 1 1 34 GLN CG C 11.784 -0.147 3.458 1.00 . A A . 55 GLN CG 1 1 28 15789 1 1 34 GLN H H 11.601 -3.369 0.354 1.00 . A A . 55 GLN H 1 1 28 15790 1 1 34 GLN HA H 12.828 -2.556 2.887 1.00 . A A . 55 GLN HA 1 1 28 15791 1 1 34 GLN HB2 H 12.675 -0.415 1.527 1.00 . A A . 55 GLN HB2 1 1 28 15792 1 1 34 GLN HB3 H 10.920 -0.606 1.530 1.00 . A A . 55 GLN HB3 1 1 28 15793 1 1 34 GLN HE21 H 9.455 0.928 3.506 1.00 . A A . 55 GLN HE21 1 1 28 15794 1 1 34 GLN HE22 H 9.880 2.624 3.339 1.00 . A A . 55 GLN HE22 1 1 28 15795 1 1 34 GLN HG2 H 11.040 -0.632 4.091 1.00 . A A . 55 GLN HG2 1 1 28 15796 1 1 34 GLN HG3 H 12.755 -0.242 3.945 1.00 . A A . 55 GLN HG3 1 1 28 15797 1 1 34 GLN N N 12.331 -2.915 0.886 1.00 . A A . 55 GLN N 1 1 28 15798 1 1 34 GLN NE2 N 10.152 1.657 3.407 1.00 . A A . 55 GLN NE2 1 1 28 15799 1 1 34 GLN O O 10.793 -3.455 3.980 1.00 . A A . 55 GLN O 1 1 28 15800 1 1 34 GLN OE1 O 12.267 2.205 3.187 1.00 . A A . 55 GLN OE1 1 1 28 15801 1 1 35 CYS C C 7.743 -4.698 2.218 1.00 . A A . 56 CYS C 1 1 28 15802 1 1 35 CYS CA C 8.265 -3.303 2.649 1.00 . A A . 56 CYS CA 1 1 28 15803 1 1 35 CYS CB C 7.302 -2.176 2.230 1.00 . A A . 56 CYS CB 1 1 28 15804 1 1 35 CYS H H 9.643 -2.568 1.206 1.00 . A A . 56 CYS H 1 1 28 15805 1 1 35 CYS HA H 8.306 -3.306 3.740 1.00 . A A . 56 CYS HA 1 1 28 15806 1 1 35 CYS HB2 H 7.202 -2.160 1.142 1.00 . A A . 56 CYS HB2 1 1 28 15807 1 1 35 CYS HB3 H 6.317 -2.380 2.654 1.00 . A A . 56 CYS HB3 1 1 28 15808 1 1 35 CYS N N 9.605 -2.985 2.122 1.00 . A A . 56 CYS N 1 1 28 15809 1 1 35 CYS O O 6.654 -5.119 2.625 1.00 . A A . 56 CYS O 1 1 28 15810 1 1 35 CYS SG S 7.888 -0.563 2.829 1.00 . A A . 56 CYS SG 1 1 28 15811 1 1 36 ARG C C 9.460 -7.538 0.438 1.00 . A A . 57 ARG C 1 1 28 15812 1 1 36 ARG CA C 8.198 -6.715 0.777 1.00 . A A . 57 ARG CA 1 1 28 15813 1 1 36 ARG CB C 7.309 -6.470 -0.467 1.00 . A A . 57 ARG CB 1 1 28 15814 1 1 36 ARG CD C 5.384 -7.969 0.399 1.00 . A A . 57 ARG CD 1 1 28 15815 1 1 36 ARG CG C 6.303 -7.595 -0.778 1.00 . A A . 57 ARG CG 1 1 28 15816 1 1 36 ARG CZ C 3.689 -6.157 0.768 1.00 . A A . 57 ARG CZ 1 1 28 15817 1 1 36 ARG H H 9.321 -4.917 1.014 1.00 . A A . 57 ARG H 1 1 28 15818 1 1 36 ARG HA H 7.657 -7.294 1.523 1.00 . A A . 57 ARG HA 1 1 28 15819 1 1 36 ARG HB2 H 6.735 -5.553 -0.329 1.00 . A A . 57 ARG HB2 1 1 28 15820 1 1 36 ARG HB3 H 7.944 -6.307 -1.340 1.00 . A A . 57 ARG HB3 1 1 28 15821 1 1 36 ARG HD2 H 4.592 -8.627 0.040 1.00 . A A . 57 ARG HD2 1 1 28 15822 1 1 36 ARG HD3 H 5.959 -8.538 1.131 1.00 . A A . 57 ARG HD3 1 1 28 15823 1 1 36 ARG HE H 5.390 -6.328 1.766 1.00 . A A . 57 ARG HE 1 1 28 15824 1 1 36 ARG HG2 H 5.682 -7.269 -1.612 1.00 . A A . 57 ARG HG2 1 1 28 15825 1 1 36 ARG HG3 H 6.839 -8.490 -1.098 1.00 . A A . 57 ARG HG3 1 1 28 15826 1 1 36 ARG HH11 H 3.085 -7.409 -0.672 1.00 . A A . 57 ARG HH11 1 1 28 15827 1 1 36 ARG HH12 H 2.034 -6.040 -0.333 1.00 . A A . 57 ARG HH12 1 1 28 15828 1 1 36 ARG HH21 H 3.955 -4.689 2.103 1.00 . A A . 57 ARG HH21 1 1 28 15829 1 1 36 ARG HH22 H 2.494 -4.607 1.127 1.00 . A A . 57 ARG HH22 1 1 28 15830 1 1 36 ARG N N 8.509 -5.405 1.377 1.00 . A A . 57 ARG N 1 1 28 15831 1 1 36 ARG NE N 4.815 -6.776 1.062 1.00 . A A . 57 ARG NE 1 1 28 15832 1 1 36 ARG NH1 N 2.873 -6.576 -0.152 1.00 . A A . 57 ARG NH1 1 1 28 15833 1 1 36 ARG NH2 N 3.347 -5.074 1.400 1.00 . A A . 57 ARG NH2 1 1 28 15834 1 1 36 ARG O O 9.403 -8.446 -0.394 1.00 . A A . 57 ARG O 1 1 28 15835 1 1 37 SER C C 11.910 -9.361 0.996 1.00 . A A . 58 SER C 1 1 28 15836 1 1 37 SER CA C 11.926 -7.829 0.891 1.00 . A A . 58 SER CA 1 1 28 15837 1 1 37 SER CB C 12.903 -7.266 1.926 1.00 . A A . 58 SER CB 1 1 28 15838 1 1 37 SER H H 10.548 -6.433 1.712 1.00 . A A . 58 SER H 1 1 28 15839 1 1 37 SER HA H 12.308 -7.578 -0.097 1.00 . A A . 58 SER HA 1 1 28 15840 1 1 37 SER HB2 H 12.583 -7.563 2.929 1.00 . A A . 58 SER HB2 1 1 28 15841 1 1 37 SER HB3 H 13.897 -7.680 1.743 1.00 . A A . 58 SER HB3 1 1 28 15842 1 1 37 SER HG H 13.566 -5.514 2.508 1.00 . A A . 58 SER HG 1 1 28 15843 1 1 37 SER N N 10.599 -7.197 1.056 1.00 . A A . 58 SER N 1 1 28 15844 1 1 37 SER O O 12.523 -10.021 0.125 1.00 . A A . 58 SER O 1 1 28 15845 1 1 37 SER OXT O 11.320 -9.899 1.962 1.00 . A A . 58 SER OXT 1 1 28 15846 1 1 37 SER OG O 12.942 -5.850 1.833 1.00 . A A . 58 SER OG 1 1 28 15847 2 2 1 ZN ZN ZN -8.460 0.518 3.754 1.00 . B A . 1059 ZN ZN 1 1 28 15848 3 2 1 ZN ZN ZN 6.839 1.137 1.990 1.00 . C A . 1060 ZN ZN 1 1 29 15849 1 1 1 GLN C C -6.691 -1.672 -5.106 1.00 . A A . 22 GLN C 1 1 29 15850 1 1 1 GLN CA C -5.927 -1.086 -6.309 1.00 . A A . 22 GLN CA 1 1 29 15851 1 1 1 GLN CB C -4.535 -0.523 -5.916 1.00 . A A . 22 GLN CB 1 1 29 15852 1 1 1 GLN CD C -2.314 0.467 -6.672 1.00 . A A . 22 GLN CD 1 1 29 15853 1 1 1 GLN CG C -3.714 0.022 -7.099 1.00 . A A . 22 GLN CG 1 1 29 15854 1 1 1 GLN H1 H -7.668 -0.457 -7.220 1.00 . A A . 22 GLN H1 1 1 29 15855 1 1 1 GLN H2 H -6.910 0.726 -6.378 1.00 . A A . 22 GLN H2 1 1 29 15856 1 1 1 GLN H3 H -6.329 0.250 -7.847 1.00 . A A . 22 GLN H3 1 1 29 15857 1 1 1 GLN HA H -5.764 -1.912 -7.002 1.00 . A A . 22 GLN HA 1 1 29 15858 1 1 1 GLN HB2 H -4.651 0.271 -5.176 1.00 . A A . 22 GLN HB2 1 1 29 15859 1 1 1 GLN HB3 H -3.954 -1.324 -5.456 1.00 . A A . 22 GLN HB3 1 1 29 15860 1 1 1 GLN HE21 H -2.414 2.207 -7.704 1.00 . A A . 22 GLN HE21 1 1 29 15861 1 1 1 GLN HE22 H -0.930 1.900 -6.810 1.00 . A A . 22 GLN HE22 1 1 29 15862 1 1 1 GLN HG2 H -3.609 -0.752 -7.860 1.00 . A A . 22 GLN HG2 1 1 29 15863 1 1 1 GLN HG3 H -4.232 0.872 -7.543 1.00 . A A . 22 GLN HG3 1 1 29 15864 1 1 1 GLN N N -6.765 -0.066 -6.994 1.00 . A A . 22 GLN N 1 1 29 15865 1 1 1 GLN NE2 N -1.858 1.626 -7.094 1.00 . A A . 22 GLN NE2 1 1 29 15866 1 1 1 GLN O O -7.905 -1.478 -4.994 1.00 . A A . 22 GLN O 1 1 29 15867 1 1 1 GLN OE1 O -1.602 -0.213 -5.947 1.00 . A A . 22 GLN OE1 1 1 29 15868 1 1 2 THR C C -5.908 -2.701 -1.763 1.00 . A A . 23 THR C 1 1 29 15869 1 1 2 THR CA C -6.582 -3.132 -3.068 1.00 . A A . 23 THR CA 1 1 29 15870 1 1 2 THR CB C -6.384 -4.644 -3.293 1.00 . A A . 23 THR CB 1 1 29 15871 1 1 2 THR CG2 C -6.995 -5.532 -2.206 1.00 . A A . 23 THR CG2 1 1 29 15872 1 1 2 THR H H -5.007 -2.483 -4.336 1.00 . A A . 23 THR H 1 1 29 15873 1 1 2 THR HA H -7.649 -2.933 -2.998 1.00 . A A . 23 THR HA 1 1 29 15874 1 1 2 THR HB H -5.315 -4.852 -3.352 1.00 . A A . 23 THR HB 1 1 29 15875 1 1 2 THR HG1 H -6.734 -5.940 -4.701 1.00 . A A . 23 THR HG1 1 1 29 15876 1 1 2 THR HG21 H -6.546 -5.312 -1.238 1.00 . A A . 23 THR HG21 1 1 29 15877 1 1 2 THR HG22 H -8.071 -5.375 -2.153 1.00 . A A . 23 THR HG22 1 1 29 15878 1 1 2 THR HG23 H -6.800 -6.579 -2.439 1.00 . A A . 23 THR HG23 1 1 29 15879 1 1 2 THR N N -6.003 -2.381 -4.202 1.00 . A A . 23 THR N 1 1 29 15880 1 1 2 THR O O -4.692 -2.506 -1.744 1.00 . A A . 23 THR O 1 1 29 15881 1 1 2 THR OG1 O -6.991 -5.019 -4.513 1.00 . A A . 23 THR OG1 1 1 29 15882 1 1 3 CYS C C -5.096 -2.814 1.257 1.00 . A A . 24 CYS C 1 1 29 15883 1 1 3 CYS CA C -6.203 -1.979 0.590 1.00 . A A . 24 CYS CA 1 1 29 15884 1 1 3 CYS CB C -7.395 -1.884 1.545 1.00 . A A . 24 CYS CB 1 1 29 15885 1 1 3 CYS H H -7.669 -2.717 -0.778 1.00 . A A . 24 CYS H 1 1 29 15886 1 1 3 CYS HA H -5.823 -0.974 0.405 1.00 . A A . 24 CYS HA 1 1 29 15887 1 1 3 CYS HB2 H -8.270 -1.509 1.015 1.00 . A A . 24 CYS HB2 1 1 29 15888 1 1 3 CYS HB3 H -7.629 -2.877 1.930 1.00 . A A . 24 CYS HB3 1 1 29 15889 1 1 3 CYS N N -6.677 -2.525 -0.686 1.00 . A A . 24 CYS N 1 1 29 15890 1 1 3 CYS O O -5.121 -4.047 1.214 1.00 . A A . 24 CYS O 1 1 29 15891 1 1 3 CYS SG S -6.946 -0.767 2.901 1.00 . A A . 24 CYS SG 1 1 29 15892 1 1 4 TYR C C -3.911 -3.452 4.117 1.00 . A A . 25 TYR C 1 1 29 15893 1 1 4 TYR CA C -3.245 -2.811 2.882 1.00 . A A . 25 TYR CA 1 1 29 15894 1 1 4 TYR CB C -2.120 -1.849 3.297 1.00 . A A . 25 TYR CB 1 1 29 15895 1 1 4 TYR CD1 C -3.441 -0.054 4.549 1.00 . A A . 25 TYR CD1 1 1 29 15896 1 1 4 TYR CD2 C -1.544 -1.115 5.652 1.00 . A A . 25 TYR CD2 1 1 29 15897 1 1 4 TYR CE1 C -3.669 0.735 5.692 1.00 . A A . 25 TYR CE1 1 1 29 15898 1 1 4 TYR CE2 C -1.763 -0.324 6.794 1.00 . A A . 25 TYR CE2 1 1 29 15899 1 1 4 TYR CG C -2.379 -0.982 4.522 1.00 . A A . 25 TYR CG 1 1 29 15900 1 1 4 TYR CZ C -2.827 0.601 6.820 1.00 . A A . 25 TYR CZ 1 1 29 15901 1 1 4 TYR H H -4.225 -1.135 1.974 1.00 . A A . 25 TYR H 1 1 29 15902 1 1 4 TYR HA H -2.785 -3.627 2.329 1.00 . A A . 25 TYR HA 1 1 29 15903 1 1 4 TYR HB2 H -1.245 -2.465 3.504 1.00 . A A . 25 TYR HB2 1 1 29 15904 1 1 4 TYR HB3 H -1.854 -1.208 2.457 1.00 . A A . 25 TYR HB3 1 1 29 15905 1 1 4 TYR HD1 H -4.096 0.051 3.696 1.00 . A A . 25 TYR HD1 1 1 29 15906 1 1 4 TYR HD2 H -0.731 -1.829 5.642 1.00 . A A . 25 TYR HD2 1 1 29 15907 1 1 4 TYR HE1 H -4.492 1.432 5.714 1.00 . A A . 25 TYR HE1 1 1 29 15908 1 1 4 TYR HE2 H -1.124 -0.423 7.661 1.00 . A A . 25 TYR HE2 1 1 29 15909 1 1 4 TYR HH H -3.826 1.915 7.844 1.00 . A A . 25 TYR HH 1 1 29 15910 1 1 4 TYR N N -4.182 -2.147 1.969 1.00 . A A . 25 TYR N 1 1 29 15911 1 1 4 TYR O O -3.335 -4.381 4.689 1.00 . A A . 25 TYR O 1 1 29 15912 1 1 4 TYR OH O -3.048 1.343 7.937 1.00 . A A . 25 TYR OH 1 1 29 15913 1 1 5 ASN C C -7.235 -3.721 5.704 1.00 . A A . 26 ASN C 1 1 29 15914 1 1 5 ASN CA C -5.740 -3.347 5.792 1.00 . A A . 26 ASN CA 1 1 29 15915 1 1 5 ASN CB C -5.523 -2.145 6.729 1.00 . A A . 26 ASN CB 1 1 29 15916 1 1 5 ASN CG C -6.114 -2.372 8.111 1.00 . A A . 26 ASN CG 1 1 29 15917 1 1 5 ASN H H -5.533 -2.267 3.956 1.00 . A A . 26 ASN H 1 1 29 15918 1 1 5 ASN HA H -5.231 -4.209 6.232 1.00 . A A . 26 ASN HA 1 1 29 15919 1 1 5 ASN HB2 H -4.454 -1.969 6.847 1.00 . A A . 26 ASN HB2 1 1 29 15920 1 1 5 ASN HB3 H -5.964 -1.250 6.287 1.00 . A A . 26 ASN HB3 1 1 29 15921 1 1 5 ASN HD21 H -7.635 -1.079 7.785 1.00 . A A . 26 ASN HD21 1 1 29 15922 1 1 5 ASN HD22 H -7.598 -1.864 9.354 1.00 . A A . 26 ASN HD22 1 1 29 15923 1 1 5 ASN N N -5.117 -3.012 4.504 1.00 . A A . 26 ASN N 1 1 29 15924 1 1 5 ASN ND2 N -7.202 -1.710 8.439 1.00 . A A . 26 ASN ND2 1 1 29 15925 1 1 5 ASN O O -7.658 -4.676 6.360 1.00 . A A . 26 ASN O 1 1 29 15926 1 1 5 ASN OD1 O -5.609 -3.149 8.909 1.00 . A A . 26 ASN OD1 1 1 29 15927 1 1 6 CYS C C -9.836 -4.554 4.020 1.00 . A A . 27 CYS C 1 1 29 15928 1 1 6 CYS CA C -9.478 -3.241 4.757 1.00 . A A . 27 CYS CA 1 1 29 15929 1 1 6 CYS CB C -10.107 -2.035 4.030 1.00 . A A . 27 CYS CB 1 1 29 15930 1 1 6 CYS H H -7.644 -2.223 4.396 1.00 . A A . 27 CYS H 1 1 29 15931 1 1 6 CYS HA H -9.912 -3.296 5.756 1.00 . A A . 27 CYS HA 1 1 29 15932 1 1 6 CYS HB2 H -9.732 -1.988 3.006 1.00 . A A . 27 CYS HB2 1 1 29 15933 1 1 6 CYS HB3 H -11.188 -2.184 3.984 1.00 . A A . 27 CYS HB3 1 1 29 15934 1 1 6 CYS N N -8.031 -3.015 4.892 1.00 . A A . 27 CYS N 1 1 29 15935 1 1 6 CYS O O -10.981 -5.012 4.083 1.00 . A A . 27 CYS O 1 1 29 15936 1 1 6 CYS SG S -9.768 -0.476 4.898 1.00 . A A . 27 CYS SG 1 1 29 15937 1 1 7 GLY C C -10.122 -6.032 1.278 1.00 . A A . 28 GLY C 1 1 29 15938 1 1 7 GLY CA C -9.117 -6.303 2.409 1.00 . A A . 28 GLY CA 1 1 29 15939 1 1 7 GLY H H -7.958 -4.747 3.313 1.00 . A A . 28 GLY H 1 1 29 15940 1 1 7 GLY HA2 H -9.483 -7.138 3.007 1.00 . A A . 28 GLY HA2 1 1 29 15941 1 1 7 GLY HA3 H -8.170 -6.593 1.954 1.00 . A A . 28 GLY HA3 1 1 29 15942 1 1 7 GLY N N -8.885 -5.145 3.285 1.00 . A A . 28 GLY N 1 1 29 15943 1 1 7 GLY O O -10.832 -6.945 0.854 1.00 . A A . 28 GLY O 1 1 29 15944 1 1 8 LYS C C -10.519 -3.832 -1.467 1.00 . A A . 29 LYS C 1 1 29 15945 1 1 8 LYS CA C -11.203 -4.287 -0.168 1.00 . A A . 29 LYS CA 1 1 29 15946 1 1 8 LYS CB C -11.956 -3.065 0.396 1.00 . A A . 29 LYS CB 1 1 29 15947 1 1 8 LYS CD C -14.087 -4.200 1.346 1.00 . A A . 29 LYS CD 1 1 29 15948 1 1 8 LYS CE C -13.809 -5.686 1.613 1.00 . A A . 29 LYS CE 1 1 29 15949 1 1 8 LYS CG C -12.890 -3.269 1.597 1.00 . A A . 29 LYS CG 1 1 29 15950 1 1 8 LYS H H -9.577 -4.097 1.203 1.00 . A A . 29 LYS H 1 1 29 15951 1 1 8 LYS HA H -11.910 -5.078 -0.404 1.00 . A A . 29 LYS HA 1 1 29 15952 1 1 8 LYS HB2 H -11.212 -2.326 0.689 1.00 . A A . 29 LYS HB2 1 1 29 15953 1 1 8 LYS HB3 H -12.551 -2.621 -0.404 1.00 . A A . 29 LYS HB3 1 1 29 15954 1 1 8 LYS HD2 H -14.910 -3.884 1.990 1.00 . A A . 29 LYS HD2 1 1 29 15955 1 1 8 LYS HD3 H -14.424 -4.078 0.315 1.00 . A A . 29 LYS HD3 1 1 29 15956 1 1 8 LYS HE2 H -14.693 -6.254 1.310 1.00 . A A . 29 LYS HE2 1 1 29 15957 1 1 8 LYS HE3 H -12.979 -6.019 0.988 1.00 . A A . 29 LYS HE3 1 1 29 15958 1 1 8 LYS HG2 H -12.316 -3.606 2.453 1.00 . A A . 29 LYS HG2 1 1 29 15959 1 1 8 LYS HG3 H -13.288 -2.285 1.854 1.00 . A A . 29 LYS HG3 1 1 29 15960 1 1 8 LYS HZ1 H -14.264 -5.640 3.643 1.00 . A A . 29 LYS HZ1 1 1 29 15961 1 1 8 LYS HZ2 H -13.395 -6.951 3.206 1.00 . A A . 29 LYS HZ2 1 1 29 15962 1 1 8 LYS HZ3 H -12.656 -5.504 3.350 1.00 . A A . 29 LYS HZ3 1 1 29 15963 1 1 8 LYS N N -10.226 -4.772 0.824 1.00 . A A . 29 LYS N 1 1 29 15964 1 1 8 LYS NZ N -13.514 -5.959 3.045 1.00 . A A . 29 LYS NZ 1 1 29 15965 1 1 8 LYS O O -9.432 -3.250 -1.388 1.00 . A A . 29 LYS O 1 1 29 15966 1 1 9 PRO C C -11.235 -1.784 -3.757 1.00 . A A . 30 PRO C 1 1 29 15967 1 1 9 PRO CA C -10.828 -3.271 -3.866 1.00 . A A . 30 PRO CA 1 1 29 15968 1 1 9 PRO CB C -11.589 -4.024 -4.965 1.00 . A A . 30 PRO CB 1 1 29 15969 1 1 9 PRO CD C -12.399 -4.756 -2.841 1.00 . A A . 30 PRO CD 1 1 29 15970 1 1 9 PRO CG C -12.874 -4.450 -4.259 1.00 . A A . 30 PRO CG 1 1 29 15971 1 1 9 PRO HA H -9.758 -3.330 -4.066 1.00 . A A . 30 PRO HA 1 1 29 15972 1 1 9 PRO HB2 H -11.795 -3.417 -5.847 1.00 . A A . 30 PRO HB2 1 1 29 15973 1 1 9 PRO HB3 H -11.024 -4.913 -5.252 1.00 . A A . 30 PRO HB3 1 1 29 15974 1 1 9 PRO HD2 H -13.172 -4.469 -2.127 1.00 . A A . 30 PRO HD2 1 1 29 15975 1 1 9 PRO HD3 H -12.180 -5.822 -2.750 1.00 . A A . 30 PRO HD3 1 1 29 15976 1 1 9 PRO HG2 H -13.576 -3.615 -4.239 1.00 . A A . 30 PRO HG2 1 1 29 15977 1 1 9 PRO HG3 H -13.328 -5.321 -4.732 1.00 . A A . 30 PRO HG3 1 1 29 15978 1 1 9 PRO N N -11.170 -3.991 -2.637 1.00 . A A . 30 PRO N 1 1 29 15979 1 1 9 PRO O O -11.583 -1.296 -2.676 1.00 . A A . 30 PRO O 1 1 29 15980 1 1 10 GLY C C -10.685 1.271 -4.019 1.00 . A A . 31 GLY C 1 1 29 15981 1 1 10 GLY CA C -11.570 0.383 -4.901 1.00 . A A . 31 GLY CA 1 1 29 15982 1 1 10 GLY H H -10.894 -1.477 -5.729 1.00 . A A . 31 GLY H 1 1 29 15983 1 1 10 GLY HA2 H -12.606 0.488 -4.572 1.00 . A A . 31 GLY HA2 1 1 29 15984 1 1 10 GLY HA3 H -11.498 0.745 -5.927 1.00 . A A . 31 GLY HA3 1 1 29 15985 1 1 10 GLY N N -11.190 -1.039 -4.867 1.00 . A A . 31 GLY N 1 1 29 15986 1 1 10 GLY O O -11.150 2.276 -3.474 1.00 . A A . 31 GLY O 1 1 29 15987 1 1 11 HIS C C -7.262 2.075 -3.594 1.00 . A A . 32 HIS C 1 1 29 15988 1 1 11 HIS CA C -8.479 1.468 -2.894 1.00 . A A . 32 HIS CA 1 1 29 15989 1 1 11 HIS CB C -8.076 0.419 -1.850 1.00 . A A . 32 HIS CB 1 1 29 15990 1 1 11 HIS CD2 C -8.549 1.055 0.582 1.00 . A A . 32 HIS CD2 1 1 29 15991 1 1 11 HIS CE1 C -10.604 0.316 0.798 1.00 . A A . 32 HIS CE1 1 1 29 15992 1 1 11 HIS CG C -8.923 0.499 -0.610 1.00 . A A . 32 HIS CG 1 1 29 15993 1 1 11 HIS H H -9.119 0.036 -4.323 1.00 . A A . 32 HIS H 1 1 29 15994 1 1 11 HIS HA H -8.973 2.285 -2.370 1.00 . A A . 32 HIS HA 1 1 29 15995 1 1 11 HIS HB2 H -8.152 -0.583 -2.274 1.00 . A A . 32 HIS HB2 1 1 29 15996 1 1 11 HIS HB3 H -7.035 0.573 -1.557 1.00 . A A . 32 HIS HB3 1 1 29 15997 1 1 11 HIS HD1 H -10.775 -0.413 -1.180 1.00 . A A . 32 HIS HD1 1 1 29 15998 1 1 11 HIS HD2 H -7.587 1.502 0.788 1.00 . A A . 32 HIS HD2 1 1 29 15999 1 1 11 HIS HE1 H -11.579 0.076 1.208 1.00 . A A . 32 HIS HE1 1 1 29 16000 1 1 11 HIS N N -9.422 0.873 -3.839 1.00 . A A . 32 HIS N 1 1 29 16001 1 1 11 HIS ND1 N -10.213 0.047 -0.462 1.00 . A A . 32 HIS ND1 1 1 29 16002 1 1 11 HIS NE2 N -9.611 0.911 1.485 1.00 . A A . 32 HIS NE2 1 1 29 16003 1 1 11 HIS O O -6.803 1.596 -4.634 1.00 . A A . 32 HIS O 1 1 29 16004 1 1 12 LEU C C -5.059 4.780 -2.319 1.00 . A A . 33 LEU C 1 1 29 16005 1 1 12 LEU CA C -5.733 4.066 -3.504 1.00 . A A . 33 LEU CA 1 1 29 16006 1 1 12 LEU CB C -6.402 5.132 -4.409 1.00 . A A . 33 LEU CB 1 1 29 16007 1 1 12 LEU CD1 C -7.646 5.818 -6.472 1.00 . A A . 33 LEU CD1 1 1 29 16008 1 1 12 LEU CD2 C -5.840 4.136 -6.683 1.00 . A A . 33 LEU CD2 1 1 29 16009 1 1 12 LEU CG C -6.951 4.655 -5.766 1.00 . A A . 33 LEU CG 1 1 29 16010 1 1 12 LEU H H -7.161 3.415 -2.106 1.00 . A A . 33 LEU H 1 1 29 16011 1 1 12 LEU HA H -4.969 3.514 -4.056 1.00 . A A . 33 LEU HA 1 1 29 16012 1 1 12 LEU HB2 H -7.223 5.584 -3.849 1.00 . A A . 33 LEU HB2 1 1 29 16013 1 1 12 LEU HB3 H -5.682 5.925 -4.616 1.00 . A A . 33 LEU HB3 1 1 29 16014 1 1 12 LEU HD11 H -8.463 6.187 -5.850 1.00 . A A . 33 LEU HD11 1 1 29 16015 1 1 12 LEU HD12 H -6.938 6.629 -6.649 1.00 . A A . 33 LEU HD12 1 1 29 16016 1 1 12 LEU HD13 H -8.056 5.481 -7.424 1.00 . A A . 33 LEU HD13 1 1 29 16017 1 1 12 LEU HD21 H -5.085 4.909 -6.831 1.00 . A A . 33 LEU HD21 1 1 29 16018 1 1 12 LEU HD22 H -5.373 3.255 -6.245 1.00 . A A . 33 LEU HD22 1 1 29 16019 1 1 12 LEU HD23 H -6.262 3.858 -7.649 1.00 . A A . 33 LEU HD23 1 1 29 16020 1 1 12 LEU HG H -7.691 3.872 -5.616 1.00 . A A . 33 LEU HG 1 1 29 16021 1 1 12 LEU N N -6.763 3.159 -3.000 1.00 . A A . 33 LEU N 1 1 29 16022 1 1 12 LEU O O -5.566 4.748 -1.193 1.00 . A A . 33 LEU O 1 1 29 16023 1 1 13 SER C C -4.244 7.528 -1.052 1.00 . A A . 34 SER C 1 1 29 16024 1 1 13 SER CA C -3.318 6.481 -1.703 1.00 . A A . 34 SER CA 1 1 29 16025 1 1 13 SER CB C -2.244 7.233 -2.502 1.00 . A A . 34 SER CB 1 1 29 16026 1 1 13 SER H H -3.602 5.459 -3.537 1.00 . A A . 34 SER H 1 1 29 16027 1 1 13 SER HA H -2.831 5.923 -0.903 1.00 . A A . 34 SER HA 1 1 29 16028 1 1 13 SER HB2 H -2.735 7.899 -3.214 1.00 . A A . 34 SER HB2 1 1 29 16029 1 1 13 SER HB3 H -1.635 7.835 -1.827 1.00 . A A . 34 SER HB3 1 1 29 16030 1 1 13 SER HG H -0.806 6.838 -3.775 1.00 . A A . 34 SER HG 1 1 29 16031 1 1 13 SER N N -3.990 5.526 -2.604 1.00 . A A . 34 SER N 1 1 29 16032 1 1 13 SER O O -3.873 8.147 -0.052 1.00 . A A . 34 SER O 1 1 29 16033 1 1 13 SER OG O -1.421 6.325 -3.215 1.00 . A A . 34 SER OG 1 1 29 16034 1 1 14 SER C C -7.637 7.973 -0.398 1.00 . A A . 35 SER C 1 1 29 16035 1 1 14 SER CA C -6.482 8.664 -1.146 1.00 . A A . 35 SER CA 1 1 29 16036 1 1 14 SER CB C -7.040 9.425 -2.354 1.00 . A A . 35 SER CB 1 1 29 16037 1 1 14 SER H H -5.639 7.254 -2.480 1.00 . A A . 35 SER H 1 1 29 16038 1 1 14 SER HA H -6.043 9.393 -0.464 1.00 . A A . 35 SER HA 1 1 29 16039 1 1 14 SER HB2 H -7.856 10.074 -2.035 1.00 . A A . 35 SER HB2 1 1 29 16040 1 1 14 SER HB3 H -6.249 10.044 -2.780 1.00 . A A . 35 SER HB3 1 1 29 16041 1 1 14 SER HG H -7.860 9.026 -4.090 1.00 . A A . 35 SER HG 1 1 29 16042 1 1 14 SER N N -5.438 7.739 -1.618 1.00 . A A . 35 SER N 1 1 29 16043 1 1 14 SER O O -8.446 8.656 0.235 1.00 . A A . 35 SER O 1 1 29 16044 1 1 14 SER OG O -7.502 8.510 -3.341 1.00 . A A . 35 SER OG 1 1 29 16045 1 1 15 GLN C C -8.246 5.401 1.656 1.00 . A A . 36 GLN C 1 1 29 16046 1 1 15 GLN CA C -8.740 5.843 0.263 1.00 . A A . 36 GLN CA 1 1 29 16047 1 1 15 GLN CB C -9.104 4.628 -0.610 1.00 . A A . 36 GLN CB 1 1 29 16048 1 1 15 GLN CD C -11.659 4.673 -0.591 1.00 . A A . 36 GLN CD 1 1 29 16049 1 1 15 GLN CG C -10.397 3.913 -0.185 1.00 . A A . 36 GLN CG 1 1 29 16050 1 1 15 GLN H H -6.994 6.137 -0.936 1.00 . A A . 36 GLN H 1 1 29 16051 1 1 15 GLN HA H -9.635 6.452 0.397 1.00 . A A . 36 GLN HA 1 1 29 16052 1 1 15 GLN HB2 H -9.216 4.946 -1.649 1.00 . A A . 36 GLN HB2 1 1 29 16053 1 1 15 GLN HB3 H -8.284 3.911 -0.568 1.00 . A A . 36 GLN HB3 1 1 29 16054 1 1 15 GLN HE21 H -11.858 3.625 -2.320 1.00 . A A . 36 GLN HE21 1 1 29 16055 1 1 15 GLN HE22 H -13.081 4.853 -1.993 1.00 . A A . 36 GLN HE22 1 1 29 16056 1 1 15 GLN HG2 H -10.426 2.937 -0.667 1.00 . A A . 36 GLN HG2 1 1 29 16057 1 1 15 GLN HG3 H -10.402 3.747 0.891 1.00 . A A . 36 GLN HG3 1 1 29 16058 1 1 15 GLN N N -7.719 6.636 -0.437 1.00 . A A . 36 GLN N 1 1 29 16059 1 1 15 GLN NE2 N -12.243 4.359 -1.730 1.00 . A A . 36 GLN NE2 1 1 29 16060 1 1 15 GLN O O -8.986 5.529 2.635 1.00 . A A . 36 GLN O 1 1 29 16061 1 1 15 GLN OE1 O -12.142 5.557 0.103 1.00 . A A . 36 GLN OE1 1 1 29 16062 1 1 16 CYS C C -4.779 4.983 2.893 1.00 . A A . 37 CYS C 1 1 29 16063 1 1 16 CYS CA C -6.261 4.554 2.951 1.00 . A A . 37 CYS CA 1 1 29 16064 1 1 16 CYS CB C -6.373 3.024 3.122 1.00 . A A . 37 CYS CB 1 1 29 16065 1 1 16 CYS H H -6.443 4.948 0.879 1.00 . A A . 37 CYS H 1 1 29 16066 1 1 16 CYS HA H -6.706 5.040 3.821 1.00 . A A . 37 CYS HA 1 1 29 16067 1 1 16 CYS HB2 H -6.236 2.534 2.156 1.00 . A A . 37 CYS HB2 1 1 29 16068 1 1 16 CYS HB3 H -5.582 2.664 3.781 1.00 . A A . 37 CYS HB3 1 1 29 16069 1 1 16 CYS N N -6.980 4.964 1.738 1.00 . A A . 37 CYS N 1 1 29 16070 1 1 16 CYS O O -4.281 5.447 1.863 1.00 . A A . 37 CYS O 1 1 29 16071 1 1 16 CYS SG S -7.964 2.572 3.863 1.00 . A A . 37 CYS SG 1 1 29 16072 1 1 17 ARG C C -1.739 4.438 3.088 1.00 . A A . 38 ARG C 1 1 29 16073 1 1 17 ARG CA C -2.622 5.055 4.179 1.00 . A A . 38 ARG CA 1 1 29 16074 1 1 17 ARG CB C -2.186 4.600 5.586 1.00 . A A . 38 ARG CB 1 1 29 16075 1 1 17 ARG CD C -2.518 5.099 8.075 1.00 . A A . 38 ARG CD 1 1 29 16076 1 1 17 ARG CG C -2.534 5.661 6.646 1.00 . A A . 38 ARG CG 1 1 29 16077 1 1 17 ARG CZ C -4.158 4.022 9.629 1.00 . A A . 38 ARG CZ 1 1 29 16078 1 1 17 ARG H H -4.571 4.409 4.803 1.00 . A A . 38 ARG H 1 1 29 16079 1 1 17 ARG HA H -2.461 6.131 4.100 1.00 . A A . 38 ARG HA 1 1 29 16080 1 1 17 ARG HB2 H -2.662 3.649 5.827 1.00 . A A . 38 ARG HB2 1 1 29 16081 1 1 17 ARG HB3 H -1.106 4.452 5.604 1.00 . A A . 38 ARG HB3 1 1 29 16082 1 1 17 ARG HD2 H -1.735 4.341 8.158 1.00 . A A . 38 ARG HD2 1 1 29 16083 1 1 17 ARG HD3 H -2.282 5.918 8.758 1.00 . A A . 38 ARG HD3 1 1 29 16084 1 1 17 ARG HE H -4.575 4.606 7.779 1.00 . A A . 38 ARG HE 1 1 29 16085 1 1 17 ARG HG2 H -1.795 6.460 6.578 1.00 . A A . 38 ARG HG2 1 1 29 16086 1 1 17 ARG HG3 H -3.514 6.096 6.444 1.00 . A A . 38 ARG HG3 1 1 29 16087 1 1 17 ARG HH11 H -2.343 4.173 10.442 1.00 . A A . 38 ARG HH11 1 1 29 16088 1 1 17 ARG HH12 H -3.571 3.498 11.479 1.00 . A A . 38 ARG HH12 1 1 29 16089 1 1 17 ARG HH21 H -6.086 3.721 9.145 1.00 . A A . 38 ARG HH21 1 1 29 16090 1 1 17 ARG HH22 H -5.629 3.244 10.751 1.00 . A A . 38 ARG HH22 1 1 29 16091 1 1 17 ARG N N -4.066 4.783 4.011 1.00 . A A . 38 ARG N 1 1 29 16092 1 1 17 ARG NE N -3.830 4.530 8.453 1.00 . A A . 38 ARG NE 1 1 29 16093 1 1 17 ARG NH1 N -3.296 3.895 10.598 1.00 . A A . 38 ARG NH1 1 1 29 16094 1 1 17 ARG NH2 N -5.379 3.626 9.855 1.00 . A A . 38 ARG NH2 1 1 29 16095 1 1 17 ARG O O -0.777 5.087 2.671 1.00 . A A . 38 ARG O 1 1 29 16096 1 1 18 ALA C C -2.431 1.543 0.785 1.00 . A A . 39 ALA C 1 1 29 16097 1 1 18 ALA CA C -1.531 2.667 1.356 1.00 . A A . 39 ALA CA 1 1 29 16098 1 1 18 ALA CB C -0.141 2.094 1.673 1.00 . A A . 39 ALA CB 1 1 29 16099 1 1 18 ALA H H -2.872 2.779 3.000 1.00 . A A . 39 ALA H 1 1 29 16100 1 1 18 ALA HA H -1.439 3.452 0.606 1.00 . A A . 39 ALA HA 1 1 29 16101 1 1 18 ALA HB1 H 0.521 2.876 2.040 1.00 . A A . 39 ALA HB1 1 1 29 16102 1 1 18 ALA HB2 H -0.235 1.311 2.427 1.00 . A A . 39 ALA HB2 1 1 29 16103 1 1 18 ALA HB3 H 0.300 1.658 0.777 1.00 . A A . 39 ALA HB3 1 1 29 16104 1 1 18 ALA N N -2.087 3.254 2.581 1.00 . A A . 39 ALA N 1 1 29 16105 1 1 18 ALA O O -3.214 0.941 1.528 1.00 . A A . 39 ALA O 1 1 29 16106 1 1 19 PRO C C -1.702 -1.224 -0.524 1.00 . A A . 40 PRO C 1 1 29 16107 1 1 19 PRO CA C -2.679 -0.130 -1.009 1.00 . A A . 40 PRO CA 1 1 29 16108 1 1 19 PRO CB C -2.667 0.024 -2.533 1.00 . A A . 40 PRO CB 1 1 29 16109 1 1 19 PRO CD C -1.631 1.962 -1.555 1.00 . A A . 40 PRO CD 1 1 29 16110 1 1 19 PRO CG C -1.553 1.044 -2.775 1.00 . A A . 40 PRO CG 1 1 29 16111 1 1 19 PRO HA H -3.687 -0.378 -0.677 1.00 . A A . 40 PRO HA 1 1 29 16112 1 1 19 PRO HB2 H -2.477 -0.918 -3.049 1.00 . A A . 40 PRO HB2 1 1 29 16113 1 1 19 PRO HB3 H -3.621 0.445 -2.857 1.00 . A A . 40 PRO HB3 1 1 29 16114 1 1 19 PRO HD2 H -0.627 2.274 -1.265 1.00 . A A . 40 PRO HD2 1 1 29 16115 1 1 19 PRO HD3 H -2.240 2.835 -1.791 1.00 . A A . 40 PRO HD3 1 1 29 16116 1 1 19 PRO HG2 H -0.589 0.535 -2.790 1.00 . A A . 40 PRO HG2 1 1 29 16117 1 1 19 PRO HG3 H -1.709 1.597 -3.701 1.00 . A A . 40 PRO HG3 1 1 29 16118 1 1 19 PRO N N -2.286 1.187 -0.505 1.00 . A A . 40 PRO N 1 1 29 16119 1 1 19 PRO O O -0.604 -0.923 -0.048 1.00 . A A . 40 PRO O 1 1 29 16120 1 1 20 LYS C C 0.136 -3.789 -0.672 1.00 . A A . 41 LYS C 1 1 29 16121 1 1 20 LYS CA C -1.334 -3.707 -0.228 1.00 . A A . 41 LYS CA 1 1 29 16122 1 1 20 LYS CB C -2.137 -4.958 -0.653 1.00 . A A . 41 LYS CB 1 1 29 16123 1 1 20 LYS CD C -1.722 -6.488 1.421 1.00 . A A . 41 LYS CD 1 1 29 16124 1 1 20 LYS CE C -3.170 -6.698 1.886 1.00 . A A . 41 LYS CE 1 1 29 16125 1 1 20 LYS CG C -1.639 -6.312 -0.106 1.00 . A A . 41 LYS CG 1 1 29 16126 1 1 20 LYS H H -2.986 -2.653 -1.104 1.00 . A A . 41 LYS H 1 1 29 16127 1 1 20 LYS HA H -1.289 -3.667 0.858 1.00 . A A . 41 LYS HA 1 1 29 16128 1 1 20 LYS HB2 H -3.176 -4.832 -0.353 1.00 . A A . 41 LYS HB2 1 1 29 16129 1 1 20 LYS HB3 H -2.125 -5.015 -1.745 1.00 . A A . 41 LYS HB3 1 1 29 16130 1 1 20 LYS HD2 H -1.140 -7.370 1.690 1.00 . A A . 41 LYS HD2 1 1 29 16131 1 1 20 LYS HD3 H -1.282 -5.628 1.926 1.00 . A A . 41 LYS HD3 1 1 29 16132 1 1 20 LYS HE2 H -3.770 -5.828 1.607 1.00 . A A . 41 LYS HE2 1 1 29 16133 1 1 20 LYS HE3 H -3.578 -7.564 1.355 1.00 . A A . 41 LYS HE3 1 1 29 16134 1 1 20 LYS HG2 H -2.227 -7.104 -0.574 1.00 . A A . 41 LYS HG2 1 1 29 16135 1 1 20 LYS HG3 H -0.609 -6.470 -0.421 1.00 . A A . 41 LYS HG3 1 1 29 16136 1 1 20 LYS HZ1 H -2.654 -7.687 3.645 1.00 . A A . 41 LYS HZ1 1 1 29 16137 1 1 20 LYS HZ2 H -3.000 -6.098 3.881 1.00 . A A . 41 LYS HZ2 1 1 29 16138 1 1 20 LYS HZ3 H -4.198 -7.171 3.626 1.00 . A A . 41 LYS HZ3 1 1 29 16139 1 1 20 LYS N N -2.071 -2.505 -0.686 1.00 . A A . 41 LYS N 1 1 29 16140 1 1 20 LYS NZ N -3.256 -6.929 3.353 1.00 . A A . 41 LYS NZ 1 1 29 16141 1 1 20 LYS O O 0.930 -4.484 -0.038 1.00 . A A . 41 LYS O 1 1 29 16142 1 1 21 VAL C C 2.833 -2.369 -0.993 1.00 . A A . 42 VAL C 1 1 29 16143 1 1 21 VAL CA C 1.913 -2.815 -2.148 1.00 . A A . 42 VAL CA 1 1 29 16144 1 1 21 VAL CB C 1.928 -1.759 -3.278 1.00 . A A . 42 VAL CB 1 1 29 16145 1 1 21 VAL CG1 C 3.330 -1.510 -3.840 1.00 . A A . 42 VAL CG1 1 1 29 16146 1 1 21 VAL CG2 C 1.036 -2.175 -4.457 1.00 . A A . 42 VAL CG2 1 1 29 16147 1 1 21 VAL H H -0.205 -2.529 -2.181 1.00 . A A . 42 VAL H 1 1 29 16148 1 1 21 VAL HA H 2.316 -3.747 -2.545 1.00 . A A . 42 VAL HA 1 1 29 16149 1 1 21 VAL HB H 1.549 -0.816 -2.881 1.00 . A A . 42 VAL HB 1 1 29 16150 1 1 21 VAL HG11 H 3.760 -2.446 -4.198 1.00 . A A . 42 VAL HG11 1 1 29 16151 1 1 21 VAL HG12 H 3.282 -0.801 -4.667 1.00 . A A . 42 VAL HG12 1 1 29 16152 1 1 21 VAL HG13 H 3.977 -1.084 -3.074 1.00 . A A . 42 VAL HG13 1 1 29 16153 1 1 21 VAL HG21 H 1.356 -3.143 -4.845 1.00 . A A . 42 VAL HG21 1 1 29 16154 1 1 21 VAL HG22 H -0.008 -2.236 -4.153 1.00 . A A . 42 VAL HG22 1 1 29 16155 1 1 21 VAL HG23 H 1.102 -1.432 -5.253 1.00 . A A . 42 VAL HG23 1 1 29 16156 1 1 21 VAL N N 0.521 -3.047 -1.713 1.00 . A A . 42 VAL N 1 1 29 16157 1 1 21 VAL O O 4.012 -2.723 -0.975 1.00 . A A . 42 VAL O 1 1 29 16158 1 1 22 CYS C C 2.077 -0.972 2.364 1.00 . A A . 43 CYS C 1 1 29 16159 1 1 22 CYS CA C 2.995 -1.038 1.116 1.00 . A A . 43 CYS CA 1 1 29 16160 1 1 22 CYS CB C 3.485 0.342 0.634 1.00 . A A . 43 CYS CB 1 1 29 16161 1 1 22 CYS H H 1.296 -1.435 -0.077 1.00 . A A . 43 CYS H 1 1 29 16162 1 1 22 CYS HA H 3.864 -1.647 1.367 1.00 . A A . 43 CYS HA 1 1 29 16163 1 1 22 CYS HB2 H 3.943 0.223 -0.350 1.00 . A A . 43 CYS HB2 1 1 29 16164 1 1 22 CYS HB3 H 2.632 1.015 0.535 1.00 . A A . 43 CYS HB3 1 1 29 16165 1 1 22 CYS N N 2.289 -1.634 -0.017 1.00 . A A . 43 CYS N 1 1 29 16166 1 1 22 CYS O O 1.103 -1.717 2.488 1.00 . A A . 43 CYS O 1 1 29 16167 1 1 22 CYS SG S 4.717 1.045 1.762 1.00 . A A . 43 CYS SG 1 1 29 16168 1 1 23 PHE C C 1.624 1.866 4.687 1.00 . A A . 44 PHE C 1 1 29 16169 1 1 23 PHE CA C 1.607 0.340 4.448 1.00 . A A . 44 PHE CA 1 1 29 16170 1 1 23 PHE CB C 2.105 -0.408 5.695 1.00 . A A . 44 PHE CB 1 1 29 16171 1 1 23 PHE CD1 C 4.642 -0.222 5.675 1.00 . A A . 44 PHE CD1 1 1 29 16172 1 1 23 PHE CD2 C 3.390 0.984 7.381 1.00 . A A . 44 PHE CD2 1 1 29 16173 1 1 23 PHE CE1 C 5.842 0.306 6.185 1.00 . A A . 44 PHE CE1 1 1 29 16174 1 1 23 PHE CE2 C 4.591 1.510 7.891 1.00 . A A . 44 PHE CE2 1 1 29 16175 1 1 23 PHE CG C 3.411 0.119 6.268 1.00 . A A . 44 PHE CG 1 1 29 16176 1 1 23 PHE CZ C 5.816 1.174 7.292 1.00 . A A . 44 PHE CZ 1 1 29 16177 1 1 23 PHE H H 3.263 0.427 3.099 1.00 . A A . 44 PHE H 1 1 29 16178 1 1 23 PHE HA H 0.569 0.055 4.275 1.00 . A A . 44 PHE HA 1 1 29 16179 1 1 23 PHE HB2 H 1.335 -0.332 6.465 1.00 . A A . 44 PHE HB2 1 1 29 16180 1 1 23 PHE HB3 H 2.216 -1.468 5.462 1.00 . A A . 44 PHE HB3 1 1 29 16181 1 1 23 PHE HD1 H 4.671 -0.889 4.823 1.00 . A A . 44 PHE HD1 1 1 29 16182 1 1 23 PHE HD2 H 2.449 1.256 7.839 1.00 . A A . 44 PHE HD2 1 1 29 16183 1 1 23 PHE HE1 H 6.786 0.044 5.726 1.00 . A A . 44 PHE HE1 1 1 29 16184 1 1 23 PHE HE2 H 4.570 2.177 8.744 1.00 . A A . 44 PHE HE2 1 1 29 16185 1 1 23 PHE HZ H 6.740 1.580 7.683 1.00 . A A . 44 PHE HZ 1 1 29 16186 1 1 23 PHE N N 2.401 -0.068 3.287 1.00 . A A . 44 PHE N 1 1 29 16187 1 1 23 PHE O O 0.732 2.377 5.368 1.00 . A A . 44 PHE O 1 1 29 16188 1 1 24 LYS C C 3.546 4.775 3.229 1.00 . A A . 45 LYS C 1 1 29 16189 1 1 24 LYS CA C 2.782 4.055 4.351 1.00 . A A . 45 LYS CA 1 1 29 16190 1 1 24 LYS CB C 3.484 4.257 5.711 1.00 . A A . 45 LYS CB 1 1 29 16191 1 1 24 LYS CD C 4.217 5.854 7.522 1.00 . A A . 45 LYS CD 1 1 29 16192 1 1 24 LYS CE C 4.297 7.327 7.942 1.00 . A A . 45 LYS CE 1 1 29 16193 1 1 24 LYS CG C 3.588 5.733 6.127 1.00 . A A . 45 LYS CG 1 1 29 16194 1 1 24 LYS H H 3.297 2.122 3.570 1.00 . A A . 45 LYS H 1 1 29 16195 1 1 24 LYS HA H 1.796 4.521 4.402 1.00 . A A . 45 LYS HA 1 1 29 16196 1 1 24 LYS HB2 H 2.914 3.732 6.479 1.00 . A A . 45 LYS HB2 1 1 29 16197 1 1 24 LYS HB3 H 4.483 3.820 5.676 1.00 . A A . 45 LYS HB3 1 1 29 16198 1 1 24 LYS HD2 H 3.608 5.303 8.242 1.00 . A A . 45 LYS HD2 1 1 29 16199 1 1 24 LYS HD3 H 5.221 5.424 7.503 1.00 . A A . 45 LYS HD3 1 1 29 16200 1 1 24 LYS HE2 H 4.901 7.871 7.209 1.00 . A A . 45 LYS HE2 1 1 29 16201 1 1 24 LYS HE3 H 3.288 7.752 7.927 1.00 . A A . 45 LYS HE3 1 1 29 16202 1 1 24 LYS HG2 H 4.205 6.276 5.410 1.00 . A A . 45 LYS HG2 1 1 29 16203 1 1 24 LYS HG3 H 2.590 6.172 6.142 1.00 . A A . 45 LYS HG3 1 1 29 16204 1 1 24 LYS HZ1 H 4.340 6.994 9.995 1.00 . A A . 45 LYS HZ1 1 1 29 16205 1 1 24 LYS HZ2 H 5.830 7.108 9.333 1.00 . A A . 45 LYS HZ2 1 1 29 16206 1 1 24 LYS HZ3 H 4.935 8.451 9.568 1.00 . A A . 45 LYS HZ3 1 1 29 16207 1 1 24 LYS N N 2.610 2.603 4.134 1.00 . A A . 45 LYS N 1 1 29 16208 1 1 24 LYS NZ N 4.888 7.477 9.298 1.00 . A A . 45 LYS NZ 1 1 29 16209 1 1 24 LYS O O 3.012 5.726 2.657 1.00 . A A . 45 LYS O 1 1 29 16210 1 1 25 CYS C C 5.307 4.896 0.498 1.00 . A A . 46 CYS C 1 1 29 16211 1 1 25 CYS CA C 5.688 5.028 1.991 1.00 . A A . 46 CYS CA 1 1 29 16212 1 1 25 CYS CB C 7.138 4.587 2.284 1.00 . A A . 46 CYS CB 1 1 29 16213 1 1 25 CYS H H 5.163 3.573 3.435 1.00 . A A . 46 CYS H 1 1 29 16214 1 1 25 CYS HA H 5.640 6.095 2.214 1.00 . A A . 46 CYS HA 1 1 29 16215 1 1 25 CYS HB2 H 7.736 4.670 1.372 1.00 . A A . 46 CYS HB2 1 1 29 16216 1 1 25 CYS HB3 H 7.560 5.283 3.011 1.00 . A A . 46 CYS HB3 1 1 29 16217 1 1 25 CYS N N 4.772 4.347 2.916 1.00 . A A . 46 CYS N 1 1 29 16218 1 1 25 CYS O O 5.465 5.865 -0.246 1.00 . A A . 46 CYS O 1 1 29 16219 1 1 25 CYS SG S 7.281 2.907 2.965 1.00 . A A . 46 CYS SG 1 1 29 16220 1 1 26 LYS C C 4.661 4.014 -2.512 1.00 . A A . 47 LYS C 1 1 29 16221 1 1 26 LYS CA C 4.036 3.479 -1.199 1.00 . A A . 47 LYS CA 1 1 29 16222 1 1 26 LYS CB C 2.537 3.813 -1.030 1.00 . A A . 47 LYS CB 1 1 29 16223 1 1 26 LYS CD C 0.747 5.525 -0.508 1.00 . A A . 47 LYS CD 1 1 29 16224 1 1 26 LYS CE C 0.483 6.944 0.015 1.00 . A A . 47 LYS CE 1 1 29 16225 1 1 26 LYS CG C 2.238 5.302 -0.779 1.00 . A A . 47 LYS CG 1 1 29 16226 1 1 26 LYS H H 4.687 3.021 0.785 1.00 . A A . 47 LYS H 1 1 29 16227 1 1 26 LYS HA H 4.071 2.399 -1.335 1.00 . A A . 47 LYS HA 1 1 29 16228 1 1 26 LYS HB2 H 1.987 3.484 -1.914 1.00 . A A . 47 LYS HB2 1 1 29 16229 1 1 26 LYS HB3 H 2.158 3.241 -0.182 1.00 . A A . 47 LYS HB3 1 1 29 16230 1 1 26 LYS HD2 H 0.201 5.373 -1.439 1.00 . A A . 47 LYS HD2 1 1 29 16231 1 1 26 LYS HD3 H 0.388 4.799 0.221 1.00 . A A . 47 LYS HD3 1 1 29 16232 1 1 26 LYS HE2 H 1.056 7.657 -0.584 1.00 . A A . 47 LYS HE2 1 1 29 16233 1 1 26 LYS HE3 H -0.580 7.170 -0.114 1.00 . A A . 47 LYS HE3 1 1 29 16234 1 1 26 LYS HG2 H 2.798 5.641 0.086 1.00 . A A . 47 LYS HG2 1 1 29 16235 1 1 26 LYS HG3 H 2.545 5.892 -1.643 1.00 . A A . 47 LYS HG3 1 1 29 16236 1 1 26 LYS HZ1 H 1.790 6.790 1.645 1.00 . A A . 47 LYS HZ1 1 1 29 16237 1 1 26 LYS HZ2 H 0.702 8.015 1.789 1.00 . A A . 47 LYS HZ2 1 1 29 16238 1 1 26 LYS HZ3 H 0.242 6.454 2.014 1.00 . A A . 47 LYS HZ3 1 1 29 16239 1 1 26 LYS N N 4.738 3.753 0.084 1.00 . A A . 47 LYS N 1 1 29 16240 1 1 26 LYS NZ N 0.829 7.070 1.456 1.00 . A A . 47 LYS NZ 1 1 29 16241 1 1 26 LYS O O 3.949 4.211 -3.498 1.00 . A A . 47 LYS O 1 1 29 16242 1 1 27 GLN C C 6.754 3.614 -4.876 1.00 . A A . 48 GLN C 1 1 29 16243 1 1 27 GLN CA C 6.699 4.690 -3.759 1.00 . A A . 48 GLN CA 1 1 29 16244 1 1 27 GLN CB C 8.121 5.144 -3.378 1.00 . A A . 48 GLN CB 1 1 29 16245 1 1 27 GLN CD C 7.381 7.525 -2.815 1.00 . A A . 48 GLN CD 1 1 29 16246 1 1 27 GLN CG C 8.174 6.298 -2.363 1.00 . A A . 48 GLN CG 1 1 29 16247 1 1 27 GLN H H 6.508 4.062 -1.714 1.00 . A A . 48 GLN H 1 1 29 16248 1 1 27 GLN HA H 6.152 5.550 -4.142 1.00 . A A . 48 GLN HA 1 1 29 16249 1 1 27 GLN HB2 H 8.663 4.299 -2.961 1.00 . A A . 48 GLN HB2 1 1 29 16250 1 1 27 GLN HB3 H 8.646 5.462 -4.278 1.00 . A A . 48 GLN HB3 1 1 29 16251 1 1 27 GLN HE21 H 5.909 7.192 -1.469 1.00 . A A . 48 GLN HE21 1 1 29 16252 1 1 27 GLN HE22 H 5.718 8.605 -2.513 1.00 . A A . 48 GLN HE22 1 1 29 16253 1 1 27 GLN HG2 H 7.807 5.953 -1.397 1.00 . A A . 48 GLN HG2 1 1 29 16254 1 1 27 GLN HG3 H 9.215 6.592 -2.222 1.00 . A A . 48 GLN HG3 1 1 29 16255 1 1 27 GLN N N 5.980 4.227 -2.557 1.00 . A A . 48 GLN N 1 1 29 16256 1 1 27 GLN NE2 N 6.243 7.798 -2.216 1.00 . A A . 48 GLN NE2 1 1 29 16257 1 1 27 GLN O O 6.767 2.421 -4.546 1.00 . A A . 48 GLN O 1 1 29 16258 1 1 27 GLN OE1 O 7.763 8.246 -3.729 1.00 . A A . 48 GLN OE1 1 1 29 16259 1 1 28 PRO C C 7.496 1.799 -7.426 1.00 . A A . 49 PRO C 1 1 29 16260 1 1 28 PRO CA C 6.673 3.100 -7.338 1.00 . A A . 49 PRO CA 1 1 29 16261 1 1 28 PRO CB C 6.971 3.971 -8.564 1.00 . A A . 49 PRO CB 1 1 29 16262 1 1 28 PRO CD C 6.924 5.377 -6.641 1.00 . A A . 49 PRO CD 1 1 29 16263 1 1 28 PRO CG C 6.544 5.363 -8.117 1.00 . A A . 49 PRO CG 1 1 29 16264 1 1 28 PRO HA H 5.620 2.820 -7.375 1.00 . A A . 49 PRO HA 1 1 29 16265 1 1 28 PRO HB2 H 8.043 3.975 -8.772 1.00 . A A . 49 PRO HB2 1 1 29 16266 1 1 28 PRO HB3 H 6.413 3.641 -9.442 1.00 . A A . 49 PRO HB3 1 1 29 16267 1 1 28 PRO HD2 H 7.949 5.734 -6.534 1.00 . A A . 49 PRO HD2 1 1 29 16268 1 1 28 PRO HD3 H 6.240 6.039 -6.113 1.00 . A A . 49 PRO HD3 1 1 29 16269 1 1 28 PRO HG2 H 7.059 6.145 -8.677 1.00 . A A . 49 PRO HG2 1 1 29 16270 1 1 28 PRO HG3 H 5.462 5.464 -8.220 1.00 . A A . 49 PRO HG3 1 1 29 16271 1 1 28 PRO N N 6.840 3.991 -6.173 1.00 . A A . 49 PRO N 1 1 29 16272 1 1 28 PRO O O 7.099 0.895 -8.164 1.00 . A A . 49 PRO O 1 1 29 16273 1 1 29 GLY C C 10.309 0.218 -5.481 1.00 . A A . 50 GLY C 1 1 29 16274 1 1 29 GLY CA C 9.494 0.486 -6.753 1.00 . A A . 50 GLY CA 1 1 29 16275 1 1 29 GLY H H 8.939 2.491 -6.205 1.00 . A A . 50 GLY H 1 1 29 16276 1 1 29 GLY HA2 H 10.192 0.585 -7.585 1.00 . A A . 50 GLY HA2 1 1 29 16277 1 1 29 GLY HA3 H 8.882 -0.399 -6.929 1.00 . A A . 50 GLY HA3 1 1 29 16278 1 1 29 GLY N N 8.627 1.680 -6.717 1.00 . A A . 50 GLY N 1 1 29 16279 1 1 29 GLY O O 11.218 -0.615 -5.491 1.00 . A A . 50 GLY O 1 1 29 16280 1 1 30 HIS C C 10.379 -0.576 -2.384 1.00 . A A . 51 HIS C 1 1 29 16281 1 1 30 HIS CA C 10.717 0.749 -3.098 1.00 . A A . 51 HIS CA 1 1 29 16282 1 1 30 HIS CB C 10.385 1.939 -2.182 1.00 . A A . 51 HIS CB 1 1 29 16283 1 1 30 HIS CD2 C 8.955 1.501 -0.110 1.00 . A A . 51 HIS CD2 1 1 29 16284 1 1 30 HIS CE1 C 6.966 1.303 -1.017 1.00 . A A . 51 HIS CE1 1 1 29 16285 1 1 30 HIS CG C 9.073 1.788 -1.442 1.00 . A A . 51 HIS CG 1 1 29 16286 1 1 30 HIS H H 9.269 1.593 -4.432 1.00 . A A . 51 HIS H 1 1 29 16287 1 1 30 HIS HA H 11.791 0.760 -3.288 1.00 . A A . 51 HIS HA 1 1 29 16288 1 1 30 HIS HB2 H 11.180 2.022 -1.439 1.00 . A A . 51 HIS HB2 1 1 29 16289 1 1 30 HIS HB3 H 10.389 2.864 -2.757 1.00 . A A . 51 HIS HB3 1 1 29 16290 1 1 30 HIS HD1 H 7.540 1.832 -2.959 1.00 . A A . 51 HIS HD1 1 1 29 16291 1 1 30 HIS HD2 H 9.773 1.438 0.596 1.00 . A A . 51 HIS HD2 1 1 29 16292 1 1 30 HIS HE1 H 5.912 1.107 -1.156 1.00 . A A . 51 HIS HE1 1 1 29 16293 1 1 30 HIS N N 10.015 0.918 -4.380 1.00 . A A . 51 HIS N 1 1 29 16294 1 1 30 HIS ND1 N 7.812 1.672 -1.990 1.00 . A A . 51 HIS ND1 1 1 29 16295 1 1 30 HIS NE2 N 7.615 1.193 0.151 1.00 . A A . 51 HIS NE2 1 1 29 16296 1 1 30 HIS O O 11.183 -1.094 -1.612 1.00 . A A . 51 HIS O 1 1 29 16297 1 1 31 PHE C C 9.455 -3.506 -1.967 1.00 . A A . 52 PHE C 1 1 29 16298 1 1 31 PHE CA C 8.621 -2.227 -1.831 1.00 . A A . 52 PHE CA 1 1 29 16299 1 1 31 PHE CB C 7.141 -2.433 -2.184 1.00 . A A . 52 PHE CB 1 1 29 16300 1 1 31 PHE CD1 C 6.563 -1.447 -4.451 1.00 . A A . 52 PHE CD1 1 1 29 16301 1 1 31 PHE CD2 C 6.779 -3.864 -4.251 1.00 . A A . 52 PHE CD2 1 1 29 16302 1 1 31 PHE CE1 C 6.260 -1.588 -5.816 1.00 . A A . 52 PHE CE1 1 1 29 16303 1 1 31 PHE CE2 C 6.481 -4.003 -5.619 1.00 . A A . 52 PHE CE2 1 1 29 16304 1 1 31 PHE CG C 6.826 -2.586 -3.663 1.00 . A A . 52 PHE CG 1 1 29 16305 1 1 31 PHE CZ C 6.225 -2.864 -6.403 1.00 . A A . 52 PHE CZ 1 1 29 16306 1 1 31 PHE H H 8.572 -0.662 -3.276 1.00 . A A . 52 PHE H 1 1 29 16307 1 1 31 PHE HA H 8.660 -1.941 -0.779 1.00 . A A . 52 PHE HA 1 1 29 16308 1 1 31 PHE HB2 H 6.773 -3.310 -1.649 1.00 . A A . 52 PHE HB2 1 1 29 16309 1 1 31 PHE HB3 H 6.579 -1.578 -1.805 1.00 . A A . 52 PHE HB3 1 1 29 16310 1 1 31 PHE HD1 H 6.565 -0.462 -4.008 1.00 . A A . 52 PHE HD1 1 1 29 16311 1 1 31 PHE HD2 H 6.972 -4.745 -3.654 1.00 . A A . 52 PHE HD2 1 1 29 16312 1 1 31 PHE HE1 H 6.042 -0.714 -6.414 1.00 . A A . 52 PHE HE1 1 1 29 16313 1 1 31 PHE HE2 H 6.453 -4.986 -6.068 1.00 . A A . 52 PHE HE2 1 1 29 16314 1 1 31 PHE HZ H 5.991 -2.972 -7.453 1.00 . A A . 52 PHE HZ 1 1 29 16315 1 1 31 PHE N N 9.178 -1.120 -2.614 1.00 . A A . 52 PHE N 1 1 29 16316 1 1 31 PHE O O 9.833 -4.088 -0.954 1.00 . A A . 52 PHE O 1 1 29 16317 1 1 32 SER C C 12.136 -4.977 -2.806 1.00 . A A . 53 SER C 1 1 29 16318 1 1 32 SER CA C 10.747 -5.020 -3.478 1.00 . A A . 53 SER CA 1 1 29 16319 1 1 32 SER CB C 10.939 -5.150 -4.995 1.00 . A A . 53 SER CB 1 1 29 16320 1 1 32 SER H H 9.504 -3.361 -3.978 1.00 . A A . 53 SER H 1 1 29 16321 1 1 32 SER HA H 10.250 -5.924 -3.125 1.00 . A A . 53 SER HA 1 1 29 16322 1 1 32 SER HB2 H 11.490 -4.281 -5.364 1.00 . A A . 53 SER HB2 1 1 29 16323 1 1 32 SER HB3 H 11.516 -6.051 -5.213 1.00 . A A . 53 SER HB3 1 1 29 16324 1 1 32 SER HG H 9.847 -5.334 -6.613 1.00 . A A . 53 SER HG 1 1 29 16325 1 1 32 SER N N 9.870 -3.870 -3.184 1.00 . A A . 53 SER N 1 1 29 16326 1 1 32 SER O O 12.899 -5.940 -2.914 1.00 . A A . 53 SER O 1 1 29 16327 1 1 32 SER OG O 9.685 -5.226 -5.655 1.00 . A A . 53 SER OG 1 1 29 16328 1 1 33 LYS C C 13.549 -2.993 -0.013 1.00 . A A . 54 LYS C 1 1 29 16329 1 1 33 LYS CA C 13.735 -3.641 -1.402 1.00 . A A . 54 LYS CA 1 1 29 16330 1 1 33 LYS CB C 14.697 -2.868 -2.327 1.00 . A A . 54 LYS CB 1 1 29 16331 1 1 33 LYS CD C 15.181 -0.748 -3.677 1.00 . A A . 54 LYS CD 1 1 29 16332 1 1 33 LYS CE C 15.190 -1.325 -5.104 1.00 . A A . 54 LYS CE 1 1 29 16333 1 1 33 LYS CG C 14.200 -1.465 -2.736 1.00 . A A . 54 LYS CG 1 1 29 16334 1 1 33 LYS H H 11.794 -3.121 -2.106 1.00 . A A . 54 LYS H 1 1 29 16335 1 1 33 LYS HA H 14.189 -4.610 -1.193 1.00 . A A . 54 LYS HA 1 1 29 16336 1 1 33 LYS HB2 H 15.664 -2.769 -1.829 1.00 . A A . 54 LYS HB2 1 1 29 16337 1 1 33 LYS HB3 H 14.855 -3.465 -3.226 1.00 . A A . 54 LYS HB3 1 1 29 16338 1 1 33 LYS HD2 H 14.930 0.312 -3.717 1.00 . A A . 54 LYS HD2 1 1 29 16339 1 1 33 LYS HD3 H 16.186 -0.829 -3.260 1.00 . A A . 54 LYS HD3 1 1 29 16340 1 1 33 LYS HE2 H 16.133 -1.037 -5.580 1.00 . A A . 54 LYS HE2 1 1 29 16341 1 1 33 LYS HE3 H 15.174 -2.417 -5.052 1.00 . A A . 54 LYS HE3 1 1 29 16342 1 1 33 LYS HG2 H 13.233 -1.543 -3.230 1.00 . A A . 54 LYS HG2 1 1 29 16343 1 1 33 LYS HG3 H 14.081 -0.860 -1.836 1.00 . A A . 54 LYS HG3 1 1 29 16344 1 1 33 LYS HZ1 H 13.150 -1.040 -5.523 1.00 . A A . 54 LYS HZ1 1 1 29 16345 1 1 33 LYS HZ2 H 14.106 0.176 -6.046 1.00 . A A . 54 LYS HZ2 1 1 29 16346 1 1 33 LYS HZ3 H 14.076 -1.235 -6.853 1.00 . A A . 54 LYS HZ3 1 1 29 16347 1 1 33 LYS N N 12.472 -3.874 -2.122 1.00 . A A . 54 LYS N 1 1 29 16348 1 1 33 LYS NZ N 14.056 -0.825 -5.929 1.00 . A A . 54 LYS NZ 1 1 29 16349 1 1 33 LYS O O 14.531 -2.523 0.572 1.00 . A A . 54 LYS O 1 1 29 16350 1 1 34 GLN C C 10.807 -3.177 2.537 1.00 . A A . 55 GLN C 1 1 29 16351 1 1 34 GLN CA C 12.037 -2.498 1.895 1.00 . A A . 55 GLN CA 1 1 29 16352 1 1 34 GLN CB C 11.854 -0.967 1.871 1.00 . A A . 55 GLN CB 1 1 29 16353 1 1 34 GLN CD C 11.452 1.104 3.275 1.00 . A A . 55 GLN CD 1 1 29 16354 1 1 34 GLN CG C 11.846 -0.370 3.287 1.00 . A A . 55 GLN CG 1 1 29 16355 1 1 34 GLN H H 11.579 -3.409 0.006 1.00 . A A . 55 GLN H 1 1 29 16356 1 1 34 GLN HA H 12.897 -2.727 2.528 1.00 . A A . 55 GLN HA 1 1 29 16357 1 1 34 GLN HB2 H 12.671 -0.507 1.313 1.00 . A A . 55 GLN HB2 1 1 29 16358 1 1 34 GLN HB3 H 10.920 -0.720 1.364 1.00 . A A . 55 GLN HB3 1 1 29 16359 1 1 34 GLN HE21 H 9.505 0.652 3.540 1.00 . A A . 55 GLN HE21 1 1 29 16360 1 1 34 GLN HE22 H 9.887 2.363 3.424 1.00 . A A . 55 GLN HE22 1 1 29 16361 1 1 34 GLN HG2 H 11.137 -0.910 3.916 1.00 . A A . 55 GLN HG2 1 1 29 16362 1 1 34 GLN HG3 H 12.837 -0.474 3.729 1.00 . A A . 55 GLN HG3 1 1 29 16363 1 1 34 GLN N N 12.324 -2.972 0.530 1.00 . A A . 55 GLN N 1 1 29 16364 1 1 34 GLN NE2 N 10.182 1.398 3.439 1.00 . A A . 55 GLN NE2 1 1 29 16365 1 1 34 GLN O O 10.928 -3.773 3.609 1.00 . A A . 55 GLN O 1 1 29 16366 1 1 34 GLN OE1 O 12.268 2.003 3.113 1.00 . A A . 55 GLN OE1 1 1 29 16367 1 1 35 CYS C C 7.813 -4.853 1.973 1.00 . A A . 56 CYS C 1 1 29 16368 1 1 35 CYS CA C 8.330 -3.475 2.458 1.00 . A A . 56 CYS CA 1 1 29 16369 1 1 35 CYS CB C 7.327 -2.347 2.148 1.00 . A A . 56 CYS CB 1 1 29 16370 1 1 35 CYS H H 9.622 -2.579 1.026 1.00 . A A . 56 CYS H 1 1 29 16371 1 1 35 CYS HA H 8.423 -3.538 3.543 1.00 . A A . 56 CYS HA 1 1 29 16372 1 1 35 CYS HB2 H 7.204 -2.246 1.067 1.00 . A A . 56 CYS HB2 1 1 29 16373 1 1 35 CYS HB3 H 6.356 -2.614 2.572 1.00 . A A . 56 CYS HB3 1 1 29 16374 1 1 35 CYS N N 9.636 -3.096 1.891 1.00 . A A . 56 CYS N 1 1 29 16375 1 1 35 CYS O O 6.755 -5.321 2.410 1.00 . A A . 56 CYS O 1 1 29 16376 1 1 35 CYS SG S 7.880 -0.774 2.871 1.00 . A A . 56 CYS SG 1 1 29 16377 1 1 36 ARG C C 9.459 -7.547 -0.086 1.00 . A A . 57 ARG C 1 1 29 16378 1 1 36 ARG CA C 8.210 -6.762 0.376 1.00 . A A . 57 ARG CA 1 1 29 16379 1 1 36 ARG CB C 7.259 -6.437 -0.803 1.00 . A A . 57 ARG CB 1 1 29 16380 1 1 36 ARG CD C 5.367 -7.983 0.055 1.00 . A A . 57 ARG CD 1 1 29 16381 1 1 36 ARG CG C 6.235 -7.540 -1.135 1.00 . A A . 57 ARG CG 1 1 29 16382 1 1 36 ARG CZ C 3.705 -6.189 0.620 1.00 . A A . 57 ARG CZ 1 1 29 16383 1 1 36 ARG H H 9.331 -4.972 0.678 1.00 . A A . 57 ARG H 1 1 29 16384 1 1 36 ARG HA H 7.712 -7.397 1.104 1.00 . A A . 57 ARG HA 1 1 29 16385 1 1 36 ARG HB2 H 6.695 -5.532 -0.575 1.00 . A A . 57 ARG HB2 1 1 29 16386 1 1 36 ARG HB3 H 7.849 -6.217 -1.694 1.00 . A A . 57 ARG HB3 1 1 29 16387 1 1 36 ARG HD2 H 4.555 -8.614 -0.308 1.00 . A A . 57 ARG HD2 1 1 29 16388 1 1 36 ARG HD3 H 5.971 -8.601 0.723 1.00 . A A . 57 ARG HD3 1 1 29 16389 1 1 36 ARG HE H 5.445 -6.443 1.530 1.00 . A A . 57 ARG HE 1 1 29 16390 1 1 36 ARG HG2 H 5.579 -7.161 -1.921 1.00 . A A . 57 ARG HG2 1 1 29 16391 1 1 36 ARG HG3 H 6.754 -8.414 -1.533 1.00 . A A . 57 ARG HG3 1 1 29 16392 1 1 36 ARG HH11 H 3.024 -7.330 -0.878 1.00 . A A . 57 ARG HH11 1 1 29 16393 1 1 36 ARG HH12 H 2.001 -5.985 -0.387 1.00 . A A . 57 ARG HH12 1 1 29 16394 1 1 36 ARG HH21 H 4.038 -4.826 2.049 1.00 . A A . 57 ARG HH21 1 1 29 16395 1 1 36 ARG HH22 H 2.537 -4.665 1.147 1.00 . A A . 57 ARG HH22 1 1 29 16396 1 1 36 ARG N N 8.544 -5.493 1.051 1.00 . A A . 57 ARG N 1 1 29 16397 1 1 36 ARG NE N 4.836 -6.835 0.821 1.00 . A A . 57 ARG NE 1 1 29 16398 1 1 36 ARG NH1 N 2.844 -6.535 -0.290 1.00 . A A . 57 ARG NH1 1 1 29 16399 1 1 36 ARG NH2 N 3.400 -5.155 1.344 1.00 . A A . 57 ARG NH2 1 1 29 16400 1 1 36 ARG O O 9.363 -8.391 -0.981 1.00 . A A . 57 ARG O 1 1 29 16401 1 1 37 SER C C 11.944 -9.383 0.197 1.00 . A A . 58 SER C 1 1 29 16402 1 1 37 SER CA C 11.946 -7.848 0.219 1.00 . A A . 58 SER CA 1 1 29 16403 1 1 37 SER CB C 12.971 -7.362 1.246 1.00 . A A . 58 SER CB 1 1 29 16404 1 1 37 SER H H 10.605 -6.531 1.211 1.00 . A A . 58 SER H 1 1 29 16405 1 1 37 SER HA H 12.278 -7.514 -0.763 1.00 . A A . 58 SER HA 1 1 29 16406 1 1 37 SER HB2 H 12.704 -7.744 2.235 1.00 . A A . 58 SER HB2 1 1 29 16407 1 1 37 SER HB3 H 13.959 -7.752 0.979 1.00 . A A . 58 SER HB3 1 1 29 16408 1 1 37 SER HG H 13.646 -5.659 1.943 1.00 . A A . 58 SER HG 1 1 29 16409 1 1 37 SER N N 10.625 -7.244 0.499 1.00 . A A . 58 SER N 1 1 29 16410 1 1 37 SER O O 11.410 -10.004 1.146 1.00 . A A . 58 SER O 1 1 29 16411 1 1 37 SER OXT O 12.515 -9.964 -0.756 1.00 . A A . 58 SER OXT 1 1 29 16412 1 1 37 SER OG O 12.999 -5.944 1.267 1.00 . A A . 58 SER OG 1 1 29 16413 2 2 1 ZN ZN ZN -8.627 0.575 3.361 1.00 . B A . 1059 ZN ZN 1 1 29 16414 3 2 1 ZN ZN ZN 6.865 0.966 2.065 1.00 . C A . 1060 ZN ZN 1 1 30 16415 1 1 1 GLN C C -6.890 -1.829 -5.134 1.00 . A A . 22 GLN C 1 1 30 16416 1 1 1 GLN CA C -6.151 -1.248 -6.355 1.00 . A A . 22 GLN CA 1 1 30 16417 1 1 1 GLN CB C -4.736 -0.718 -5.997 1.00 . A A . 22 GLN CB 1 1 30 16418 1 1 1 GLN CD C -2.525 0.269 -6.810 1.00 . A A . 22 GLN CD 1 1 30 16419 1 1 1 GLN CG C -3.943 -0.157 -7.193 1.00 . A A . 22 GLN CG 1 1 30 16420 1 1 1 GLN H1 H -7.907 -0.570 -7.205 1.00 . A A . 22 GLN H1 1 1 30 16421 1 1 1 GLN H2 H -7.091 0.588 -6.377 1.00 . A A . 22 GLN H2 1 1 30 16422 1 1 1 GLN H3 H -6.572 0.112 -7.867 1.00 . A A . 22 GLN H3 1 1 30 16423 1 1 1 GLN HA H -6.026 -2.069 -7.061 1.00 . A A . 22 GLN HA 1 1 30 16424 1 1 1 GLN HB2 H -4.812 0.057 -5.234 1.00 . A A . 22 GLN HB2 1 1 30 16425 1 1 1 GLN HB3 H -4.157 -1.543 -5.579 1.00 . A A . 22 GLN HB3 1 1 30 16426 1 1 1 GLN HE21 H -2.510 1.824 -8.110 1.00 . A A . 22 GLN HE21 1 1 30 16427 1 1 1 GLN HE22 H -1.058 1.583 -7.147 1.00 . A A . 22 GLN HE22 1 1 30 16428 1 1 1 GLN HG2 H -3.874 -0.914 -7.975 1.00 . A A . 22 GLN HG2 1 1 30 16429 1 1 1 GLN HG3 H -4.465 0.710 -7.599 1.00 . A A . 22 GLN HG3 1 1 30 16430 1 1 1 GLN N N -6.987 -0.202 -7.002 1.00 . A A . 22 GLN N 1 1 30 16431 1 1 1 GLN NE2 N -1.997 1.317 -7.403 1.00 . A A . 22 GLN NE2 1 1 30 16432 1 1 1 GLN O O -8.098 -1.620 -4.989 1.00 . A A . 22 GLN O 1 1 30 16433 1 1 1 GLN OE1 O -1.860 -0.321 -5.971 1.00 . A A . 22 GLN OE1 1 1 30 16434 1 1 2 THR C C -6.028 -2.732 -1.801 1.00 . A A . 23 THR C 1 1 30 16435 1 1 2 THR CA C -6.730 -3.240 -3.062 1.00 . A A . 23 THR CA 1 1 30 16436 1 1 2 THR CB C -6.529 -4.762 -3.221 1.00 . A A . 23 THR CB 1 1 30 16437 1 1 2 THR CG2 C -7.099 -5.609 -2.081 1.00 . A A . 23 THR CG2 1 1 30 16438 1 1 2 THR H H -5.197 -2.658 -4.412 1.00 . A A . 23 THR H 1 1 30 16439 1 1 2 THR HA H -7.797 -3.046 -2.968 1.00 . A A . 23 THR HA 1 1 30 16440 1 1 2 THR HB H -5.461 -4.967 -3.306 1.00 . A A . 23 THR HB 1 1 30 16441 1 1 2 THR HG1 H -6.921 -6.121 -4.556 1.00 . A A . 23 THR HG1 1 1 30 16442 1 1 2 THR HG21 H -8.168 -5.429 -1.977 1.00 . A A . 23 THR HG21 1 1 30 16443 1 1 2 THR HG22 H -6.937 -6.666 -2.294 1.00 . A A . 23 THR HG22 1 1 30 16444 1 1 2 THR HG23 H -6.595 -5.374 -1.144 1.00 . A A . 23 THR HG23 1 1 30 16445 1 1 2 THR N N -6.188 -2.542 -4.248 1.00 . A A . 23 THR N 1 1 30 16446 1 1 2 THR O O -4.853 -2.367 -1.859 1.00 . A A . 23 THR O 1 1 30 16447 1 1 2 THR OG1 O -7.172 -5.194 -4.404 1.00 . A A . 23 THR OG1 1 1 30 16448 1 1 3 CYS C C -5.069 -2.913 1.214 1.00 . A A . 24 CYS C 1 1 30 16449 1 1 3 CYS CA C -6.224 -2.107 0.581 1.00 . A A . 24 CYS CA 1 1 30 16450 1 1 3 CYS CB C -7.392 -2.021 1.564 1.00 . A A . 24 CYS CB 1 1 30 16451 1 1 3 CYS H H -7.706 -2.959 -0.696 1.00 . A A . 24 CYS H 1 1 30 16452 1 1 3 CYS HA H -5.871 -1.094 0.374 1.00 . A A . 24 CYS HA 1 1 30 16453 1 1 3 CYS HB2 H -8.283 -1.656 1.052 1.00 . A A . 24 CYS HB2 1 1 30 16454 1 1 3 CYS HB3 H -7.606 -3.012 1.959 1.00 . A A . 24 CYS HB3 1 1 30 16455 1 1 3 CYS N N -6.735 -2.668 -0.671 1.00 . A A . 24 CYS N 1 1 30 16456 1 1 3 CYS O O -5.040 -4.146 1.154 1.00 . A A . 24 CYS O 1 1 30 16457 1 1 3 CYS SG S -6.932 -0.887 2.901 1.00 . A A . 24 CYS SG 1 1 30 16458 1 1 4 TYR C C -3.788 -3.408 4.116 1.00 . A A . 25 TYR C 1 1 30 16459 1 1 4 TYR CA C -3.187 -2.797 2.832 1.00 . A A . 25 TYR CA 1 1 30 16460 1 1 4 TYR CB C -2.130 -1.740 3.201 1.00 . A A . 25 TYR CB 1 1 30 16461 1 1 4 TYR CD1 C -3.619 0.037 4.265 1.00 . A A . 25 TYR CD1 1 1 30 16462 1 1 4 TYR CD2 C -1.715 -0.802 5.525 1.00 . A A . 25 TYR CD2 1 1 30 16463 1 1 4 TYR CE1 C -3.977 0.854 5.350 1.00 . A A . 25 TYR CE1 1 1 30 16464 1 1 4 TYR CE2 C -2.055 0.039 6.606 1.00 . A A . 25 TYR CE2 1 1 30 16465 1 1 4 TYR CG C -2.492 -0.804 4.349 1.00 . A A . 25 TYR CG 1 1 30 16466 1 1 4 TYR CZ C -3.194 0.868 6.520 1.00 . A A . 25 TYR CZ 1 1 30 16467 1 1 4 TYR H H -4.282 -1.206 1.922 1.00 . A A . 25 TYR H 1 1 30 16468 1 1 4 TYR HA H -2.682 -3.607 2.304 1.00 . A A . 25 TYR HA 1 1 30 16469 1 1 4 TYR HB2 H -1.229 -2.283 3.483 1.00 . A A . 25 TYR HB2 1 1 30 16470 1 1 4 TYR HB3 H -1.882 -1.145 2.321 1.00 . A A . 25 TYR HB3 1 1 30 16471 1 1 4 TYR HD1 H -4.233 0.048 3.377 1.00 . A A . 25 TYR HD1 1 1 30 16472 1 1 4 TYR HD2 H -0.855 -1.456 5.606 1.00 . A A . 25 TYR HD2 1 1 30 16473 1 1 4 TYR HE1 H -4.869 1.452 5.302 1.00 . A A . 25 TYR HE1 1 1 30 16474 1 1 4 TYR HE2 H -1.453 0.039 7.504 1.00 . A A . 25 TYR HE2 1 1 30 16475 1 1 4 TYR HH H -2.969 1.566 8.322 1.00 . A A . 25 TYR HH 1 1 30 16476 1 1 4 TYR N N -4.175 -2.211 1.914 1.00 . A A . 25 TYR N 1 1 30 16477 1 1 4 TYR O O -3.116 -4.200 4.782 1.00 . A A . 25 TYR O 1 1 30 16478 1 1 4 TYR OH O -3.560 1.669 7.556 1.00 . A A . 25 TYR OH 1 1 30 16479 1 1 5 ASN C C -7.090 -3.792 5.724 1.00 . A A . 26 ASN C 1 1 30 16480 1 1 5 ASN CA C -5.620 -3.336 5.792 1.00 . A A . 26 ASN CA 1 1 30 16481 1 1 5 ASN CB C -5.475 -2.062 6.644 1.00 . A A . 26 ASN CB 1 1 30 16482 1 1 5 ASN CG C -6.104 -2.208 8.021 1.00 . A A . 26 ASN CG 1 1 30 16483 1 1 5 ASN H H -5.513 -2.394 3.874 1.00 . A A . 26 ASN H 1 1 30 16484 1 1 5 ASN HA H -5.065 -4.138 6.283 1.00 . A A . 26 ASN HA 1 1 30 16485 1 1 5 ASN HB2 H -4.417 -1.839 6.779 1.00 . A A . 26 ASN HB2 1 1 30 16486 1 1 5 ASN HB3 H -5.934 -1.219 6.129 1.00 . A A . 26 ASN HB3 1 1 30 16487 1 1 5 ASN HD21 H -7.761 -1.174 7.485 1.00 . A A . 26 ASN HD21 1 1 30 16488 1 1 5 ASN HD22 H -7.704 -1.763 9.137 1.00 . A A . 26 ASN HD22 1 1 30 16489 1 1 5 ASN N N -5.029 -3.051 4.476 1.00 . A A . 26 ASN N 1 1 30 16490 1 1 5 ASN ND2 N -7.284 -1.663 8.227 1.00 . A A . 26 ASN ND2 1 1 30 16491 1 1 5 ASN O O -7.449 -4.790 6.352 1.00 . A A . 26 ASN O 1 1 30 16492 1 1 5 ASN OD1 O -5.550 -2.823 8.921 1.00 . A A . 26 ASN OD1 1 1 30 16493 1 1 6 CYS C C -9.658 -4.683 4.068 1.00 . A A . 27 CYS C 1 1 30 16494 1 1 6 CYS CA C -9.367 -3.373 4.836 1.00 . A A . 27 CYS CA 1 1 30 16495 1 1 6 CYS CB C -10.043 -2.178 4.135 1.00 . A A . 27 CYS CB 1 1 30 16496 1 1 6 CYS H H -7.589 -2.266 4.485 1.00 . A A . 27 CYS H 1 1 30 16497 1 1 6 CYS HA H -9.790 -3.469 5.837 1.00 . A A . 27 CYS HA 1 1 30 16498 1 1 6 CYS HB2 H -9.710 -2.126 3.098 1.00 . A A . 27 CYS HB2 1 1 30 16499 1 1 6 CYS HB3 H -11.124 -2.342 4.132 1.00 . A A . 27 CYS HB3 1 1 30 16500 1 1 6 CYS N N -7.934 -3.091 4.960 1.00 . A A . 27 CYS N 1 1 30 16501 1 1 6 CYS O O -10.736 -5.263 4.208 1.00 . A A . 27 CYS O 1 1 30 16502 1 1 6 CYS SG S -9.686 -0.603 4.975 1.00 . A A . 27 CYS SG 1 1 30 16503 1 1 7 GLY C C -9.867 -5.955 1.101 1.00 . A A . 28 GLY C 1 1 30 16504 1 1 7 GLY CA C -8.896 -6.233 2.263 1.00 . A A . 28 GLY CA 1 1 30 16505 1 1 7 GLY H H -7.850 -4.621 3.192 1.00 . A A . 28 GLY H 1 1 30 16506 1 1 7 GLY HA2 H -9.258 -7.108 2.805 1.00 . A A . 28 GLY HA2 1 1 30 16507 1 1 7 GLY HA3 H -7.924 -6.478 1.836 1.00 . A A . 28 GLY HA3 1 1 30 16508 1 1 7 GLY N N -8.727 -5.121 3.211 1.00 . A A . 28 GLY N 1 1 30 16509 1 1 7 GLY O O -10.097 -6.838 0.272 1.00 . A A . 28 GLY O 1 1 30 16510 1 1 8 LYS C C -10.682 -3.900 -1.307 1.00 . A A . 29 LYS C 1 1 30 16511 1 1 8 LYS CA C -11.405 -4.330 -0.015 1.00 . A A . 29 LYS CA 1 1 30 16512 1 1 8 LYS CB C -12.259 -3.148 0.499 1.00 . A A . 29 LYS CB 1 1 30 16513 1 1 8 LYS CD C -13.537 -4.272 2.468 1.00 . A A . 29 LYS CD 1 1 30 16514 1 1 8 LYS CE C -13.403 -5.788 2.286 1.00 . A A . 29 LYS CE 1 1 30 16515 1 1 8 LYS CG C -13.611 -3.516 1.135 1.00 . A A . 29 LYS CG 1 1 30 16516 1 1 8 LYS H H -10.192 -4.073 1.728 1.00 . A A . 29 LYS H 1 1 30 16517 1 1 8 LYS HA H -12.057 -5.168 -0.256 1.00 . A A . 29 LYS HA 1 1 30 16518 1 1 8 LYS HB2 H -11.679 -2.548 1.203 1.00 . A A . 29 LYS HB2 1 1 30 16519 1 1 8 LYS HB3 H -12.496 -2.497 -0.343 1.00 . A A . 29 LYS HB3 1 1 30 16520 1 1 8 LYS HD2 H -12.705 -3.882 3.057 1.00 . A A . 29 LYS HD2 1 1 30 16521 1 1 8 LYS HD3 H -14.458 -4.077 3.020 1.00 . A A . 29 LYS HD3 1 1 30 16522 1 1 8 LYS HE2 H -14.299 -6.162 1.780 1.00 . A A . 29 LYS HE2 1 1 30 16523 1 1 8 LYS HE3 H -12.545 -6.000 1.645 1.00 . A A . 29 LYS HE3 1 1 30 16524 1 1 8 LYS HG2 H -14.137 -2.578 1.322 1.00 . A A . 29 LYS HG2 1 1 30 16525 1 1 8 LYS HG3 H -14.209 -4.085 0.421 1.00 . A A . 29 LYS HG3 1 1 30 16526 1 1 8 LYS HZ1 H -14.006 -6.291 4.211 1.00 . A A . 29 LYS HZ1 1 1 30 16527 1 1 8 LYS HZ2 H -13.151 -7.473 3.476 1.00 . A A . 29 LYS HZ2 1 1 30 16528 1 1 8 LYS HZ3 H -12.380 -6.145 4.048 1.00 . A A . 29 LYS HZ3 1 1 30 16529 1 1 8 LYS N N -10.459 -4.753 1.033 1.00 . A A . 29 LYS N 1 1 30 16530 1 1 8 LYS NZ N -13.229 -6.472 3.591 1.00 . A A . 29 LYS NZ 1 1 30 16531 1 1 8 LYS O O -9.582 -3.342 -1.223 1.00 . A A . 29 LYS O 1 1 30 16532 1 1 9 PRO C C -11.325 -1.890 -3.667 1.00 . A A . 30 PRO C 1 1 30 16533 1 1 9 PRO CA C -10.943 -3.386 -3.727 1.00 . A A . 30 PRO CA 1 1 30 16534 1 1 9 PRO CB C -11.696 -4.157 -4.820 1.00 . A A . 30 PRO CB 1 1 30 16535 1 1 9 PRO CD C -12.554 -4.819 -2.693 1.00 . A A . 30 PRO CD 1 1 30 16536 1 1 9 PRO CG C -13.000 -4.542 -4.128 1.00 . A A . 30 PRO CG 1 1 30 16537 1 1 9 PRO HA H -9.870 -3.468 -3.909 1.00 . A A . 30 PRO HA 1 1 30 16538 1 1 9 PRO HB2 H -11.874 -3.572 -5.723 1.00 . A A . 30 PRO HB2 1 1 30 16539 1 1 9 PRO HB3 H -11.139 -5.063 -5.071 1.00 . A A . 30 PRO HB3 1 1 30 16540 1 1 9 PRO HD2 H -13.335 -4.502 -2.000 1.00 . A A . 30 PRO HD2 1 1 30 16541 1 1 9 PRO HD3 H -12.353 -5.885 -2.572 1.00 . A A . 30 PRO HD3 1 1 30 16542 1 1 9 PRO HG2 H -13.688 -3.696 -4.142 1.00 . A A . 30 PRO HG2 1 1 30 16543 1 1 9 PRO HG3 H -13.458 -5.418 -4.585 1.00 . A A . 30 PRO HG3 1 1 30 16544 1 1 9 PRO N N -11.317 -4.069 -2.485 1.00 . A A . 30 PRO N 1 1 30 16545 1 1 9 PRO O O -11.663 -1.362 -2.600 1.00 . A A . 30 PRO O 1 1 30 16546 1 1 10 GLY C C -10.738 1.148 -4.012 1.00 . A A . 31 GLY C 1 1 30 16547 1 1 10 GLY CA C -11.626 0.247 -4.881 1.00 . A A . 31 GLY CA 1 1 30 16548 1 1 10 GLY H H -10.974 -1.648 -5.644 1.00 . A A . 31 GLY H 1 1 30 16549 1 1 10 GLY HA2 H -12.663 0.379 -4.570 1.00 . A A . 31 GLY HA2 1 1 30 16550 1 1 10 GLY HA3 H -11.532 0.576 -5.916 1.00 . A A . 31 GLY HA3 1 1 30 16551 1 1 10 GLY N N -11.270 -1.180 -4.799 1.00 . A A . 31 GLY N 1 1 30 16552 1 1 10 GLY O O -11.185 2.188 -3.522 1.00 . A A . 31 GLY O 1 1 30 16553 1 1 11 HIS C C -7.334 1.937 -3.590 1.00 . A A . 32 HIS C 1 1 30 16554 1 1 11 HIS CA C -8.543 1.341 -2.863 1.00 . A A . 32 HIS CA 1 1 30 16555 1 1 11 HIS CB C -8.123 0.309 -1.806 1.00 . A A . 32 HIS CB 1 1 30 16556 1 1 11 HIS CD2 C -8.556 0.961 0.630 1.00 . A A . 32 HIS CD2 1 1 30 16557 1 1 11 HIS CE1 C -10.586 0.180 0.906 1.00 . A A . 32 HIS CE1 1 1 30 16558 1 1 11 HIS CG C -8.951 0.394 -0.550 1.00 . A A . 32 HIS CG 1 1 30 16559 1 1 11 HIS H H -9.200 -0.136 -4.240 1.00 . A A . 32 HIS H 1 1 30 16560 1 1 11 HIS HA H -9.034 2.164 -2.350 1.00 . A A . 32 HIS HA 1 1 30 16561 1 1 11 HIS HB2 H -8.200 -0.698 -2.215 1.00 . A A . 32 HIS HB2 1 1 30 16562 1 1 11 HIS HB3 H -7.081 0.472 -1.531 1.00 . A A . 32 HIS HB3 1 1 30 16563 1 1 11 HIS HD1 H -10.801 -0.553 -1.065 1.00 . A A . 32 HIS HD1 1 1 30 16564 1 1 11 HIS HD2 H -7.595 1.416 0.808 1.00 . A A . 32 HIS HD2 1 1 30 16565 1 1 11 HIS HE1 H -11.545 -0.076 1.342 1.00 . A A . 32 HIS HE1 1 1 30 16566 1 1 11 HIS N N -9.491 0.726 -3.791 1.00 . A A . 32 HIS N 1 1 30 16567 1 1 11 HIS ND1 N -10.227 -0.084 -0.364 1.00 . A A . 32 HIS ND1 1 1 30 16568 1 1 11 HIS NE2 N -9.589 0.804 1.565 1.00 . A A . 32 HIS NE2 1 1 30 16569 1 1 11 HIS O O -6.910 1.460 -4.645 1.00 . A A . 32 HIS O 1 1 30 16570 1 1 12 LEU C C -5.025 4.556 -2.340 1.00 . A A . 33 LEU C 1 1 30 16571 1 1 12 LEU CA C -5.754 3.887 -3.518 1.00 . A A . 33 LEU CA 1 1 30 16572 1 1 12 LEU CB C -6.405 4.989 -4.394 1.00 . A A . 33 LEU CB 1 1 30 16573 1 1 12 LEU CD1 C -7.671 5.741 -6.419 1.00 . A A . 33 LEU CD1 1 1 30 16574 1 1 12 LEU CD2 C -5.939 3.993 -6.693 1.00 . A A . 33 LEU CD2 1 1 30 16575 1 1 12 LEU CG C -7.005 4.544 -5.741 1.00 . A A . 33 LEU CG 1 1 30 16576 1 1 12 LEU H H -7.168 3.261 -2.093 1.00 . A A . 33 LEU H 1 1 30 16577 1 1 12 LEU HA H -5.024 3.317 -4.094 1.00 . A A . 33 LEU HA 1 1 30 16578 1 1 12 LEU HB2 H -7.193 5.468 -3.808 1.00 . A A . 33 LEU HB2 1 1 30 16579 1 1 12 LEU HB3 H -5.660 5.755 -4.613 1.00 . A A . 33 LEU HB3 1 1 30 16580 1 1 12 LEU HD11 H -8.456 6.138 -5.774 1.00 . A A . 33 LEU HD11 1 1 30 16581 1 1 12 LEU HD12 H -6.937 6.525 -6.612 1.00 . A A . 33 LEU HD12 1 1 30 16582 1 1 12 LEU HD13 H -8.120 5.429 -7.362 1.00 . A A . 33 LEU HD13 1 1 30 16583 1 1 12 LEU HD21 H -5.162 4.741 -6.856 1.00 . A A . 33 LEU HD21 1 1 30 16584 1 1 12 LEU HD22 H -5.490 3.095 -6.275 1.00 . A A . 33 LEU HD22 1 1 30 16585 1 1 12 LEU HD23 H -6.397 3.739 -7.648 1.00 . A A . 33 LEU HD23 1 1 30 16586 1 1 12 LEU HG H -7.769 3.788 -5.579 1.00 . A A . 33 LEU HG 1 1 30 16587 1 1 12 LEU N N -6.803 3.007 -3.000 1.00 . A A . 33 LEU N 1 1 30 16588 1 1 12 LEU O O -5.492 4.507 -1.198 1.00 . A A . 33 LEU O 1 1 30 16589 1 1 13 SER C C -3.964 7.259 -1.023 1.00 . A A . 34 SER C 1 1 30 16590 1 1 13 SER CA C -3.166 6.157 -1.754 1.00 . A A . 34 SER CA 1 1 30 16591 1 1 13 SER CB C -2.067 6.826 -2.591 1.00 . A A . 34 SER CB 1 1 30 16592 1 1 13 SER H H -3.608 5.224 -3.599 1.00 . A A . 34 SER H 1 1 30 16593 1 1 13 SER HA H -2.691 5.540 -0.992 1.00 . A A . 34 SER HA 1 1 30 16594 1 1 13 SER HB2 H -2.527 7.534 -3.283 1.00 . A A . 34 SER HB2 1 1 30 16595 1 1 13 SER HB3 H -1.386 7.371 -1.938 1.00 . A A . 34 SER HB3 1 1 30 16596 1 1 13 SER HG H -0.716 6.310 -3.915 1.00 . A A . 34 SER HG 1 1 30 16597 1 1 13 SER N N -3.947 5.279 -2.647 1.00 . A A . 34 SER N 1 1 30 16598 1 1 13 SER O O -3.406 7.960 -0.175 1.00 . A A . 34 SER O 1 1 30 16599 1 1 13 SER OG O -1.348 5.850 -3.332 1.00 . A A . 34 SER OG 1 1 30 16600 1 1 14 SER C C -7.433 7.732 -0.125 1.00 . A A . 35 SER C 1 1 30 16601 1 1 14 SER CA C -6.195 8.389 -0.763 1.00 . A A . 35 SER CA 1 1 30 16602 1 1 14 SER CB C -6.638 9.374 -1.850 1.00 . A A . 35 SER CB 1 1 30 16603 1 1 14 SER H H -5.593 6.888 -2.132 1.00 . A A . 35 SER H 1 1 30 16604 1 1 14 SER HA H -5.697 8.959 0.020 1.00 . A A . 35 SER HA 1 1 30 16605 1 1 14 SER HB2 H -7.366 10.074 -1.436 1.00 . A A . 35 SER HB2 1 1 30 16606 1 1 14 SER HB3 H -5.771 9.937 -2.198 1.00 . A A . 35 SER HB3 1 1 30 16607 1 1 14 SER HG H -7.490 9.321 -3.618 1.00 . A A . 35 SER HG 1 1 30 16608 1 1 14 SER N N -5.249 7.426 -1.351 1.00 . A A . 35 SER N 1 1 30 16609 1 1 14 SER O O -8.136 8.385 0.650 1.00 . A A . 35 SER O 1 1 30 16610 1 1 14 SER OG O -7.212 8.669 -2.945 1.00 . A A . 35 SER OG 1 1 30 16611 1 1 15 GLN C C -8.263 5.166 1.655 1.00 . A A . 36 GLN C 1 1 30 16612 1 1 15 GLN CA C -8.741 5.657 0.272 1.00 . A A . 36 GLN CA 1 1 30 16613 1 1 15 GLN CB C -9.123 4.467 -0.629 1.00 . A A . 36 GLN CB 1 1 30 16614 1 1 15 GLN CD C -11.672 4.601 -0.673 1.00 . A A . 36 GLN CD 1 1 30 16615 1 1 15 GLN CG C -10.450 3.791 -0.243 1.00 . A A . 36 GLN CG 1 1 30 16616 1 1 15 GLN H H -7.055 5.956 -1.008 1.00 . A A . 36 GLN H 1 1 30 16617 1 1 15 GLN HA H -9.620 6.288 0.416 1.00 . A A . 36 GLN HA 1 1 30 16618 1 1 15 GLN HB2 H -9.200 4.805 -1.664 1.00 . A A . 36 GLN HB2 1 1 30 16619 1 1 15 GLN HB3 H -8.327 3.725 -0.576 1.00 . A A . 36 GLN HB3 1 1 30 16620 1 1 15 GLN HE21 H -11.870 3.577 -2.416 1.00 . A A . 36 GLN HE21 1 1 30 16621 1 1 15 GLN HE22 H -13.047 4.855 -2.111 1.00 . A A . 36 GLN HE22 1 1 30 16622 1 1 15 GLN HG2 H -10.503 2.820 -0.732 1.00 . A A . 36 GLN HG2 1 1 30 16623 1 1 15 GLN HG3 H -10.491 3.616 0.832 1.00 . A A . 36 GLN HG3 1 1 30 16624 1 1 15 GLN N N -7.695 6.446 -0.399 1.00 . A A . 36 GLN N 1 1 30 16625 1 1 15 GLN NE2 N -12.238 4.323 -1.829 1.00 . A A . 36 GLN NE2 1 1 30 16626 1 1 15 GLN O O -9.033 5.173 2.619 1.00 . A A . 36 GLN O 1 1 30 16627 1 1 15 GLN OE1 O -12.138 5.499 0.018 1.00 . A A . 36 GLN OE1 1 1 30 16628 1 1 16 CYS C C -4.792 4.992 2.902 1.00 . A A . 37 CYS C 1 1 30 16629 1 1 16 CYS CA C -6.234 4.437 2.951 1.00 . A A . 37 CYS CA 1 1 30 16630 1 1 16 CYS CB C -6.248 2.903 3.091 1.00 . A A . 37 CYS CB 1 1 30 16631 1 1 16 CYS H H -6.424 4.871 0.896 1.00 . A A . 37 CYS H 1 1 30 16632 1 1 16 CYS HA H -6.720 4.880 3.816 1.00 . A A . 37 CYS HA 1 1 30 16633 1 1 16 CYS HB2 H -6.298 2.440 2.106 1.00 . A A . 37 CYS HB2 1 1 30 16634 1 1 16 CYS HB3 H -5.317 2.565 3.541 1.00 . A A . 37 CYS HB3 1 1 30 16635 1 1 16 CYS N N -6.974 4.811 1.743 1.00 . A A . 37 CYS N 1 1 30 16636 1 1 16 CYS O O -4.373 5.572 1.896 1.00 . A A . 37 CYS O 1 1 30 16637 1 1 16 CYS SG S -7.634 2.369 4.138 1.00 . A A . 37 CYS SG 1 1 30 16638 1 1 17 ARG C C -1.731 4.673 2.947 1.00 . A A . 38 ARG C 1 1 30 16639 1 1 17 ARG CA C -2.607 5.203 4.093 1.00 . A A . 38 ARG CA 1 1 30 16640 1 1 17 ARG CB C -2.010 4.790 5.454 1.00 . A A . 38 ARG CB 1 1 30 16641 1 1 17 ARG CD C -3.516 5.251 7.541 1.00 . A A . 38 ARG CD 1 1 30 16642 1 1 17 ARG CG C -2.357 5.711 6.642 1.00 . A A . 38 ARG CG 1 1 30 16643 1 1 17 ARG CZ C -5.846 4.855 6.677 1.00 . A A . 38 ARG CZ 1 1 30 16644 1 1 17 ARG H H -4.439 4.303 4.765 1.00 . A A . 38 ARG H 1 1 30 16645 1 1 17 ARG HA H -2.556 6.291 4.010 1.00 . A A . 38 ARG HA 1 1 30 16646 1 1 17 ARG HB2 H -2.267 3.755 5.685 1.00 . A A . 38 ARG HB2 1 1 30 16647 1 1 17 ARG HB3 H -0.923 4.827 5.352 1.00 . A A . 38 ARG HB3 1 1 30 16648 1 1 17 ARG HD2 H -3.444 4.180 7.705 1.00 . A A . 38 ARG HD2 1 1 30 16649 1 1 17 ARG HD3 H -3.387 5.728 8.515 1.00 . A A . 38 ARG HD3 1 1 30 16650 1 1 17 ARG HE H -5.037 6.633 7.002 1.00 . A A . 38 ARG HE 1 1 30 16651 1 1 17 ARG HG2 H -1.472 5.744 7.281 1.00 . A A . 38 ARG HG2 1 1 30 16652 1 1 17 ARG HG3 H -2.533 6.730 6.294 1.00 . A A . 38 ARG HG3 1 1 30 16653 1 1 17 ARG HH11 H -4.927 3.102 7.027 1.00 . A A . 38 ARG HH11 1 1 30 16654 1 1 17 ARG HH12 H -6.511 3.009 6.282 1.00 . A A . 38 ARG HH12 1 1 30 16655 1 1 17 ARG HH21 H -7.130 6.359 6.320 1.00 . A A . 38 ARG HH21 1 1 30 16656 1 1 17 ARG HH22 H -7.723 4.758 5.987 1.00 . A A . 38 ARG HH22 1 1 30 16657 1 1 17 ARG N N -4.021 4.788 3.985 1.00 . A A . 38 ARG N 1 1 30 16658 1 1 17 ARG NE N -4.847 5.643 7.031 1.00 . A A . 38 ARG NE 1 1 30 16659 1 1 17 ARG NH1 N -5.745 3.558 6.643 1.00 . A A . 38 ARG NH1 1 1 30 16660 1 1 17 ARG NH2 N -6.981 5.364 6.300 1.00 . A A . 38 ARG NH2 1 1 30 16661 1 1 17 ARG O O -0.814 5.375 2.520 1.00 . A A . 38 ARG O 1 1 30 16662 1 1 18 ALA C C -2.408 1.822 0.611 1.00 . A A . 39 ALA C 1 1 30 16663 1 1 18 ALA CA C -1.495 2.935 1.179 1.00 . A A . 39 ALA CA 1 1 30 16664 1 1 18 ALA CB C -0.099 2.362 1.471 1.00 . A A . 39 ALA CB 1 1 30 16665 1 1 18 ALA H H -2.785 2.964 2.859 1.00 . A A . 39 ALA H 1 1 30 16666 1 1 18 ALA HA H -1.414 3.738 0.443 1.00 . A A . 39 ALA HA 1 1 30 16667 1 1 18 ALA HB1 H 0.560 3.139 1.859 1.00 . A A . 39 ALA HB1 1 1 30 16668 1 1 18 ALA HB2 H -0.185 1.559 2.202 1.00 . A A . 39 ALA HB2 1 1 30 16669 1 1 18 ALA HB3 H 0.337 1.956 0.558 1.00 . A A . 39 ALA HB3 1 1 30 16670 1 1 18 ALA N N -2.038 3.485 2.423 1.00 . A A . 39 ALA N 1 1 30 16671 1 1 18 ALA O O -3.167 1.207 1.367 1.00 . A A . 39 ALA O 1 1 30 16672 1 1 19 PRO C C -1.790 -0.930 -0.759 1.00 . A A . 40 PRO C 1 1 30 16673 1 1 19 PRO CA C -2.749 0.194 -1.205 1.00 . A A . 40 PRO CA 1 1 30 16674 1 1 19 PRO CB C -2.768 0.373 -2.727 1.00 . A A . 40 PRO CB 1 1 30 16675 1 1 19 PRO CD C -1.647 2.258 -1.741 1.00 . A A . 40 PRO CD 1 1 30 16676 1 1 19 PRO CG C -1.623 1.354 -2.975 1.00 . A A . 40 PRO CG 1 1 30 16677 1 1 19 PRO HA H -3.756 -0.039 -0.856 1.00 . A A . 40 PRO HA 1 1 30 16678 1 1 19 PRO HB2 H -2.624 -0.567 -3.260 1.00 . A A . 40 PRO HB2 1 1 30 16679 1 1 19 PRO HB3 H -3.711 0.833 -3.023 1.00 . A A . 40 PRO HB3 1 1 30 16680 1 1 19 PRO HD2 H -0.629 2.533 -1.465 1.00 . A A . 40 PRO HD2 1 1 30 16681 1 1 19 PRO HD3 H -2.231 3.153 -1.955 1.00 . A A . 40 PRO HD3 1 1 30 16682 1 1 19 PRO HG2 H -0.678 0.812 -3.013 1.00 . A A . 40 PRO HG2 1 1 30 16683 1 1 19 PRO HG3 H -1.772 1.924 -3.894 1.00 . A A . 40 PRO HG3 1 1 30 16684 1 1 19 PRO N N -2.308 1.491 -0.691 1.00 . A A . 40 PRO N 1 1 30 16685 1 1 19 PRO O O -0.693 -0.668 -0.262 1.00 . A A . 40 PRO O 1 1 30 16686 1 1 20 LYS C C 0.000 -3.529 -0.958 1.00 . A A . 41 LYS C 1 1 30 16687 1 1 20 LYS CA C -1.486 -3.434 -0.575 1.00 . A A . 41 LYS CA 1 1 30 16688 1 1 20 LYS CB C -2.300 -4.628 -1.113 1.00 . A A . 41 LYS CB 1 1 30 16689 1 1 20 LYS CD C -2.863 -7.090 -0.958 1.00 . A A . 41 LYS CD 1 1 30 16690 1 1 20 LYS CE C -2.408 -8.490 -0.519 1.00 . A A . 41 LYS CE 1 1 30 16691 1 1 20 LYS CG C -1.890 -5.985 -0.517 1.00 . A A . 41 LYS CG 1 1 30 16692 1 1 20 LYS H H -3.098 -2.304 -1.408 1.00 . A A . 41 LYS H 1 1 30 16693 1 1 20 LYS HA H -1.502 -3.474 0.513 1.00 . A A . 41 LYS HA 1 1 30 16694 1 1 20 LYS HB2 H -3.351 -4.465 -0.875 1.00 . A A . 41 LYS HB2 1 1 30 16695 1 1 20 LYS HB3 H -2.206 -4.669 -2.199 1.00 . A A . 41 LYS HB3 1 1 30 16696 1 1 20 LYS HD2 H -3.859 -6.884 -0.560 1.00 . A A . 41 LYS HD2 1 1 30 16697 1 1 20 LYS HD3 H -2.928 -7.085 -2.047 1.00 . A A . 41 LYS HD3 1 1 30 16698 1 1 20 LYS HE2 H -3.058 -9.227 -0.999 1.00 . A A . 41 LYS HE2 1 1 30 16699 1 1 20 LYS HE3 H -1.392 -8.663 -0.887 1.00 . A A . 41 LYS HE3 1 1 30 16700 1 1 20 LYS HG2 H -0.888 -6.244 -0.861 1.00 . A A . 41 LYS HG2 1 1 30 16701 1 1 20 LYS HG3 H -1.889 -5.910 0.570 1.00 . A A . 41 LYS HG3 1 1 30 16702 1 1 20 LYS HZ1 H -3.392 -8.525 1.315 1.00 . A A . 41 LYS HZ1 1 1 30 16703 1 1 20 LYS HZ2 H -2.187 -9.618 1.211 1.00 . A A . 41 LYS HZ2 1 1 30 16704 1 1 20 LYS HZ3 H -1.831 -8.044 1.434 1.00 . A A . 41 LYS HZ3 1 1 30 16705 1 1 20 LYS N N -2.179 -2.192 -0.986 1.00 . A A . 41 LYS N 1 1 30 16706 1 1 20 LYS NZ N -2.459 -8.676 0.958 1.00 . A A . 41 LYS NZ 1 1 30 16707 1 1 20 LYS O O 0.748 -4.282 -0.334 1.00 . A A . 41 LYS O 1 1 30 16708 1 1 21 VAL C C 2.756 -2.159 -1.129 1.00 . A A . 42 VAL C 1 1 30 16709 1 1 21 VAL CA C 1.862 -2.552 -2.322 1.00 . A A . 42 VAL CA 1 1 30 16710 1 1 21 VAL CB C 1.952 -1.476 -3.431 1.00 . A A . 42 VAL CB 1 1 30 16711 1 1 21 VAL CG1 C 3.381 -1.252 -3.930 1.00 . A A . 42 VAL CG1 1 1 30 16712 1 1 21 VAL CG2 C 1.102 -1.854 -4.654 1.00 . A A . 42 VAL CG2 1 1 30 16713 1 1 21 VAL H H -0.242 -2.178 -2.404 1.00 . A A . 42 VAL H 1 1 30 16714 1 1 21 VAL HA H 2.249 -3.489 -2.726 1.00 . A A . 42 VAL HA 1 1 30 16715 1 1 21 VAL HB H 1.578 -0.532 -3.033 1.00 . A A . 42 VAL HB 1 1 30 16716 1 1 21 VAL HG11 H 3.801 -2.193 -4.284 1.00 . A A . 42 VAL HG11 1 1 30 16717 1 1 21 VAL HG12 H 3.385 -0.530 -4.746 1.00 . A A . 42 VAL HG12 1 1 30 16718 1 1 21 VAL HG13 H 4.008 -0.854 -3.131 1.00 . A A . 42 VAL HG13 1 1 30 16719 1 1 21 VAL HG21 H 1.425 -2.818 -5.051 1.00 . A A . 42 VAL HG21 1 1 30 16720 1 1 21 VAL HG22 H 0.047 -1.907 -4.392 1.00 . A A . 42 VAL HG22 1 1 30 16721 1 1 21 VAL HG23 H 1.211 -1.096 -5.429 1.00 . A A . 42 VAL HG23 1 1 30 16722 1 1 21 VAL N N 0.448 -2.748 -1.941 1.00 . A A . 42 VAL N 1 1 30 16723 1 1 21 VAL O O 3.921 -2.554 -1.079 1.00 . A A . 42 VAL O 1 1 30 16724 1 1 22 CYS C C 1.969 -0.754 2.219 1.00 . A A . 43 CYS C 1 1 30 16725 1 1 22 CYS CA C 2.911 -0.849 0.992 1.00 . A A . 43 CYS CA 1 1 30 16726 1 1 22 CYS CB C 3.468 0.514 0.532 1.00 . A A . 43 CYS CB 1 1 30 16727 1 1 22 CYS H H 1.223 -1.189 -0.242 1.00 . A A . 43 CYS H 1 1 30 16728 1 1 22 CYS HA H 3.750 -1.492 1.260 1.00 . A A . 43 CYS HA 1 1 30 16729 1 1 22 CYS HB2 H 3.939 0.385 -0.443 1.00 . A A . 43 CYS HB2 1 1 30 16730 1 1 22 CYS HB3 H 2.645 1.223 0.420 1.00 . A A . 43 CYS HB3 1 1 30 16731 1 1 22 CYS N N 2.208 -1.417 -0.161 1.00 . A A . 43 CYS N 1 1 30 16732 1 1 22 CYS O O 0.969 -1.464 2.317 1.00 . A A . 43 CYS O 1 1 30 16733 1 1 22 CYS SG S 4.704 1.158 1.690 1.00 . A A . 43 CYS SG 1 1 30 16734 1 1 23 PHE C C 1.620 2.045 4.638 1.00 . A A . 44 PHE C 1 1 30 16735 1 1 23 PHE CA C 1.518 0.534 4.324 1.00 . A A . 44 PHE CA 1 1 30 16736 1 1 23 PHE CB C 1.954 -0.297 5.543 1.00 . A A . 44 PHE CB 1 1 30 16737 1 1 23 PHE CD1 C 4.495 -0.405 5.495 1.00 . A A . 44 PHE CD1 1 1 30 16738 1 1 23 PHE CD2 C 3.409 0.907 7.235 1.00 . A A . 44 PHE CD2 1 1 30 16739 1 1 23 PHE CE1 C 5.753 -0.033 6.003 1.00 . A A . 44 PHE CE1 1 1 30 16740 1 1 23 PHE CE2 C 4.668 1.278 7.742 1.00 . A A . 44 PHE CE2 1 1 30 16741 1 1 23 PHE CG C 3.317 0.068 6.107 1.00 . A A . 44 PHE CG 1 1 30 16742 1 1 23 PHE CZ C 5.840 0.810 7.125 1.00 . A A . 44 PHE CZ 1 1 30 16743 1 1 23 PHE H H 3.190 0.594 2.992 1.00 . A A . 44 PHE H 1 1 30 16744 1 1 23 PHE HA H 0.468 0.320 4.126 1.00 . A A . 44 PHE HA 1 1 30 16745 1 1 23 PHE HB2 H 1.207 -0.164 6.328 1.00 . A A . 44 PHE HB2 1 1 30 16746 1 1 23 PHE HB3 H 1.949 -1.356 5.276 1.00 . A A . 44 PHE HB3 1 1 30 16747 1 1 23 PHE HD1 H 4.437 -1.054 4.633 1.00 . A A . 44 PHE HD1 1 1 30 16748 1 1 23 PHE HD2 H 2.511 1.278 7.710 1.00 . A A . 44 PHE HD2 1 1 30 16749 1 1 23 PHE HE1 H 6.655 -0.399 5.531 1.00 . A A . 44 PHE HE1 1 1 30 16750 1 1 23 PHE HE2 H 4.733 1.926 8.607 1.00 . A A . 44 PHE HE2 1 1 30 16751 1 1 23 PHE HZ H 6.809 1.095 7.512 1.00 . A A . 44 PHE HZ 1 1 30 16752 1 1 23 PHE N N 2.308 0.130 3.158 1.00 . A A . 44 PHE N 1 1 30 16753 1 1 23 PHE O O 0.765 2.568 5.356 1.00 . A A . 44 PHE O 1 1 30 16754 1 1 24 LYS C C 3.671 4.930 3.339 1.00 . A A . 45 LYS C 1 1 30 16755 1 1 24 LYS CA C 2.915 4.171 4.439 1.00 . A A . 45 LYS CA 1 1 30 16756 1 1 24 LYS CB C 3.697 4.207 5.770 1.00 . A A . 45 LYS CB 1 1 30 16757 1 1 24 LYS CD C 2.766 6.432 6.649 1.00 . A A . 45 LYS CD 1 1 30 16758 1 1 24 LYS CE C 3.090 7.679 7.486 1.00 . A A . 45 LYS CE 1 1 30 16759 1 1 24 LYS CG C 4.023 5.607 6.320 1.00 . A A . 45 LYS CG 1 1 30 16760 1 1 24 LYS H H 3.292 2.269 3.512 1.00 . A A . 45 LYS H 1 1 30 16761 1 1 24 LYS HA H 1.964 4.688 4.576 1.00 . A A . 45 LYS HA 1 1 30 16762 1 1 24 LYS HB2 H 3.118 3.682 6.532 1.00 . A A . 45 LYS HB2 1 1 30 16763 1 1 24 LYS HB3 H 4.637 3.665 5.649 1.00 . A A . 45 LYS HB3 1 1 30 16764 1 1 24 LYS HD2 H 2.261 6.728 5.728 1.00 . A A . 45 LYS HD2 1 1 30 16765 1 1 24 LYS HD3 H 2.081 5.809 7.228 1.00 . A A . 45 LYS HD3 1 1 30 16766 1 1 24 LYS HE2 H 2.147 8.131 7.806 1.00 . A A . 45 LYS HE2 1 1 30 16767 1 1 24 LYS HE3 H 3.625 7.365 8.388 1.00 . A A . 45 LYS HE3 1 1 30 16768 1 1 24 LYS HG2 H 4.603 5.476 7.234 1.00 . A A . 45 LYS HG2 1 1 30 16769 1 1 24 LYS HG3 H 4.642 6.147 5.603 1.00 . A A . 45 LYS HG3 1 1 30 16770 1 1 24 LYS HZ1 H 3.411 8.997 5.907 1.00 . A A . 45 LYS HZ1 1 1 30 16771 1 1 24 LYS HZ2 H 4.071 9.499 7.311 1.00 . A A . 45 LYS HZ2 1 1 30 16772 1 1 24 LYS HZ3 H 4.792 8.311 6.463 1.00 . A A . 45 LYS HZ3 1 1 30 16773 1 1 24 LYS N N 2.640 2.754 4.113 1.00 . A A . 45 LYS N 1 1 30 16774 1 1 24 LYS NZ N 3.893 8.683 6.738 1.00 . A A . 45 LYS NZ 1 1 30 16775 1 1 24 LYS O O 3.159 5.937 2.848 1.00 . A A . 45 LYS O 1 1 30 16776 1 1 25 CYS C C 5.474 5.060 0.570 1.00 . A A . 46 CYS C 1 1 30 16777 1 1 25 CYS CA C 5.799 5.181 2.077 1.00 . A A . 46 CYS CA 1 1 30 16778 1 1 25 CYS CB C 7.234 4.741 2.420 1.00 . A A . 46 CYS CB 1 1 30 16779 1 1 25 CYS H H 5.235 3.650 3.419 1.00 . A A . 46 CYS H 1 1 30 16780 1 1 25 CYS HA H 5.736 6.246 2.310 1.00 . A A . 46 CYS HA 1 1 30 16781 1 1 25 CYS HB2 H 7.907 5.025 1.606 1.00 . A A . 46 CYS HB2 1 1 30 16782 1 1 25 CYS HB3 H 7.554 5.282 3.314 1.00 . A A . 46 CYS HB3 1 1 30 16783 1 1 25 CYS N N 4.868 4.473 2.963 1.00 . A A . 46 CYS N 1 1 30 16784 1 1 25 CYS O O 5.693 6.022 -0.168 1.00 . A A . 46 CYS O 1 1 30 16785 1 1 25 CYS SG S 7.371 2.961 2.750 1.00 . A A . 46 CYS SG 1 1 30 16786 1 1 26 LYS C C 4.820 4.241 -2.452 1.00 . A A . 47 LYS C 1 1 30 16787 1 1 26 LYS CA C 4.168 3.711 -1.151 1.00 . A A . 47 LYS CA 1 1 30 16788 1 1 26 LYS CB C 2.684 4.109 -0.986 1.00 . A A . 47 LYS CB 1 1 30 16789 1 1 26 LYS CD C 0.973 5.922 -0.518 1.00 . A A . 47 LYS CD 1 1 30 16790 1 1 26 LYS CE C 0.762 7.313 0.099 1.00 . A A . 47 LYS CE 1 1 30 16791 1 1 26 LYS CG C 2.463 5.596 -0.662 1.00 . A A . 47 LYS CG 1 1 30 16792 1 1 26 LYS H H 4.787 3.203 0.830 1.00 . A A . 47 LYS H 1 1 30 16793 1 1 26 LYS HA H 4.160 2.632 -1.303 1.00 . A A . 47 LYS HA 1 1 30 16794 1 1 26 LYS HB2 H 2.132 3.853 -1.893 1.00 . A A . 47 LYS HB2 1 1 30 16795 1 1 26 LYS HB3 H 2.261 3.516 -0.173 1.00 . A A . 47 LYS HB3 1 1 30 16796 1 1 26 LYS HD2 H 0.526 5.898 -1.509 1.00 . A A . 47 LYS HD2 1 1 30 16797 1 1 26 LYS HD3 H 0.479 5.173 0.101 1.00 . A A . 47 LYS HD3 1 1 30 16798 1 1 26 LYS HE2 H 1.427 8.028 -0.398 1.00 . A A . 47 LYS HE2 1 1 30 16799 1 1 26 LYS HE3 H -0.268 7.627 -0.093 1.00 . A A . 47 LYS HE3 1 1 30 16800 1 1 26 LYS HG2 H 2.958 5.832 0.275 1.00 . A A . 47 LYS HG2 1 1 30 16801 1 1 26 LYS HG3 H 2.891 6.215 -1.449 1.00 . A A . 47 LYS HG3 1 1 30 16802 1 1 26 LYS HZ1 H 1.934 6.976 1.802 1.00 . A A . 47 LYS HZ1 1 1 30 16803 1 1 26 LYS HZ2 H 0.886 8.232 1.961 1.00 . A A . 47 LYS HZ2 1 1 30 16804 1 1 26 LYS HZ3 H 0.345 6.685 2.025 1.00 . A A . 47 LYS HZ3 1 1 30 16805 1 1 26 LYS N N 4.873 3.940 0.137 1.00 . A A . 47 LYS N 1 1 30 16806 1 1 26 LYS NZ N 1.003 7.309 1.565 1.00 . A A . 47 LYS NZ 1 1 30 16807 1 1 26 LYS O O 4.119 4.511 -3.429 1.00 . A A . 47 LYS O 1 1 30 16808 1 1 27 GLN C C 6.856 3.753 -4.827 1.00 . A A . 48 GLN C 1 1 30 16809 1 1 27 GLN CA C 6.890 4.813 -3.693 1.00 . A A . 48 GLN CA 1 1 30 16810 1 1 27 GLN CB C 8.341 5.162 -3.310 1.00 . A A . 48 GLN CB 1 1 30 16811 1 1 27 GLN CD C 7.777 7.575 -2.689 1.00 . A A . 48 GLN CD 1 1 30 16812 1 1 27 GLN CG C 8.472 6.281 -2.264 1.00 . A A . 48 GLN CG 1 1 30 16813 1 1 27 GLN H H 6.666 4.154 -1.659 1.00 . A A . 48 GLN H 1 1 30 16814 1 1 27 GLN HA H 6.403 5.716 -4.059 1.00 . A A . 48 GLN HA 1 1 30 16815 1 1 27 GLN HB2 H 8.827 4.271 -2.917 1.00 . A A . 48 GLN HB2 1 1 30 16816 1 1 27 GLN HB3 H 8.883 5.466 -4.205 1.00 . A A . 48 GLN HB3 1 1 30 16817 1 1 27 GLN HE21 H 6.280 7.328 -1.350 1.00 . A A . 48 GLN HE21 1 1 30 16818 1 1 27 GLN HE22 H 6.204 8.777 -2.359 1.00 . A A . 48 GLN HE22 1 1 30 16819 1 1 27 GLN HG2 H 8.073 5.941 -1.311 1.00 . A A . 48 GLN HG2 1 1 30 16820 1 1 27 GLN HG3 H 9.531 6.494 -2.112 1.00 . A A . 48 GLN HG3 1 1 30 16821 1 1 27 GLN N N 6.148 4.376 -2.495 1.00 . A A . 48 GLN N 1 1 30 16822 1 1 27 GLN NE2 N 6.663 7.924 -2.081 1.00 . A A . 48 GLN NE2 1 1 30 16823 1 1 27 GLN O O 6.755 2.560 -4.518 1.00 . A A . 48 GLN O 1 1 30 16824 1 1 27 GLN OE1 O 8.213 8.284 -3.586 1.00 . A A . 48 GLN OE1 1 1 30 16825 1 1 28 PRO C C 7.416 1.900 -7.375 1.00 . A A . 49 PRO C 1 1 30 16826 1 1 28 PRO CA C 6.726 3.278 -7.289 1.00 . A A . 49 PRO CA 1 1 30 16827 1 1 28 PRO CB C 7.108 4.123 -8.508 1.00 . A A . 49 PRO CB 1 1 30 16828 1 1 28 PRO CD C 7.198 5.513 -6.572 1.00 . A A . 49 PRO CD 1 1 30 16829 1 1 28 PRO CG C 6.817 5.545 -8.050 1.00 . A A . 49 PRO CG 1 1 30 16830 1 1 28 PRO HA H 5.650 3.103 -7.324 1.00 . A A . 49 PRO HA 1 1 30 16831 1 1 28 PRO HB2 H 8.175 4.023 -8.716 1.00 . A A . 49 PRO HB2 1 1 30 16832 1 1 28 PRO HB3 H 6.520 3.854 -9.386 1.00 . A A . 49 PRO HB3 1 1 30 16833 1 1 28 PRO HD2 H 8.253 5.768 -6.465 1.00 . A A . 49 PRO HD2 1 1 30 16834 1 1 28 PRO HD3 H 6.582 6.233 -6.034 1.00 . A A . 49 PRO HD3 1 1 30 16835 1 1 28 PRO HG2 H 7.404 6.280 -8.604 1.00 . A A . 49 PRO HG2 1 1 30 16836 1 1 28 PRO HG3 H 5.749 5.751 -8.149 1.00 . A A . 49 PRO HG3 1 1 30 16837 1 1 28 PRO N N 6.982 4.139 -6.118 1.00 . A A . 49 PRO N 1 1 30 16838 1 1 28 PRO O O 6.897 1.021 -8.066 1.00 . A A . 49 PRO O 1 1 30 16839 1 1 29 GLY C C 10.107 0.052 -5.503 1.00 . A A . 50 GLY C 1 1 30 16840 1 1 29 GLY CA C 9.321 0.426 -6.767 1.00 . A A . 50 GLY CA 1 1 30 16841 1 1 29 GLY H H 8.970 2.480 -6.236 1.00 . A A . 50 GLY H 1 1 30 16842 1 1 29 GLY HA2 H 10.029 0.488 -7.593 1.00 . A A . 50 GLY HA2 1 1 30 16843 1 1 29 GLY HA3 H 8.640 -0.400 -6.973 1.00 . A A . 50 GLY HA3 1 1 30 16844 1 1 29 GLY N N 8.559 1.690 -6.710 1.00 . A A . 50 GLY N 1 1 30 16845 1 1 29 GLY O O 10.818 -0.954 -5.498 1.00 . A A . 50 GLY O 1 1 30 16846 1 1 30 HIS C C 10.377 -0.692 -2.437 1.00 . A A . 51 HIS C 1 1 30 16847 1 1 30 HIS CA C 10.725 0.626 -3.163 1.00 . A A . 51 HIS CA 1 1 30 16848 1 1 30 HIS CB C 10.448 1.813 -2.225 1.00 . A A . 51 HIS CB 1 1 30 16849 1 1 30 HIS CD2 C 8.976 1.370 -0.182 1.00 . A A . 51 HIS CD2 1 1 30 16850 1 1 30 HIS CE1 C 6.989 1.299 -1.115 1.00 . A A . 51 HIS CE1 1 1 30 16851 1 1 30 HIS CG C 9.123 1.702 -1.501 1.00 . A A . 51 HIS CG 1 1 30 16852 1 1 30 HIS H H 9.397 1.643 -4.490 1.00 . A A . 51 HIS H 1 1 30 16853 1 1 30 HIS HA H 11.793 0.608 -3.387 1.00 . A A . 51 HIS HA 1 1 30 16854 1 1 30 HIS HB2 H 11.241 1.845 -1.476 1.00 . A A . 51 HIS HB2 1 1 30 16855 1 1 30 HIS HB3 H 10.497 2.748 -2.783 1.00 . A A . 51 HIS HB3 1 1 30 16856 1 1 30 HIS HD1 H 7.607 1.861 -3.031 1.00 . A A . 51 HIS HD1 1 1 30 16857 1 1 30 HIS HD2 H 9.781 1.242 0.529 1.00 . A A . 51 HIS HD2 1 1 30 16858 1 1 30 HIS HE1 H 5.927 1.159 -1.271 1.00 . A A . 51 HIS HE1 1 1 30 16859 1 1 30 HIS N N 9.992 0.834 -4.424 1.00 . A A . 51 HIS N 1 1 30 16860 1 1 30 HIS ND1 N 7.863 1.661 -2.064 1.00 . A A . 51 HIS ND1 1 1 30 16861 1 1 30 HIS NE2 N 7.620 1.116 0.055 1.00 . A A . 51 HIS NE2 1 1 30 16862 1 1 30 HIS O O 11.180 -1.216 -1.666 1.00 . A A . 51 HIS O 1 1 30 16863 1 1 31 PHE C C 9.437 -3.586 -1.943 1.00 . A A . 52 PHE C 1 1 30 16864 1 1 31 PHE CA C 8.600 -2.303 -1.845 1.00 . A A . 52 PHE CA 1 1 30 16865 1 1 31 PHE CB C 7.124 -2.514 -2.220 1.00 . A A . 52 PHE CB 1 1 30 16866 1 1 31 PHE CD1 C 6.606 -1.625 -4.542 1.00 . A A . 52 PHE CD1 1 1 30 16867 1 1 31 PHE CD2 C 6.797 -4.032 -4.229 1.00 . A A . 52 PHE CD2 1 1 30 16868 1 1 31 PHE CE1 C 6.334 -1.825 -5.906 1.00 . A A . 52 PHE CE1 1 1 30 16869 1 1 31 PHE CE2 C 6.531 -4.230 -5.595 1.00 . A A . 52 PHE CE2 1 1 30 16870 1 1 31 PHE CG C 6.841 -2.729 -3.698 1.00 . A A . 52 PHE CG 1 1 30 16871 1 1 31 PHE CZ C 6.300 -3.127 -6.435 1.00 . A A . 52 PHE CZ 1 1 30 16872 1 1 31 PHE H H 8.554 -0.740 -3.291 1.00 . A A . 52 PHE H 1 1 30 16873 1 1 31 PHE HA H 8.622 -1.996 -0.798 1.00 . A A . 52 PHE HA 1 1 30 16874 1 1 31 PHE HB2 H 6.737 -3.363 -1.654 1.00 . A A . 52 PHE HB2 1 1 30 16875 1 1 31 PHE HB3 H 6.562 -1.638 -1.889 1.00 . A A . 52 PHE HB3 1 1 30 16876 1 1 31 PHE HD1 H 6.608 -0.619 -4.143 1.00 . A A . 52 PHE HD1 1 1 30 16877 1 1 31 PHE HD2 H 6.974 -4.886 -3.591 1.00 . A A . 52 PHE HD2 1 1 30 16878 1 1 31 PHE HE1 H 6.138 -0.978 -6.549 1.00 . A A . 52 PHE HE1 1 1 30 16879 1 1 31 PHE HE2 H 6.506 -5.233 -6.001 1.00 . A A . 52 PHE HE2 1 1 30 16880 1 1 31 PHE HZ H 6.090 -3.280 -7.486 1.00 . A A . 52 PHE HZ 1 1 30 16881 1 1 31 PHE N N 9.162 -1.210 -2.640 1.00 . A A . 52 PHE N 1 1 30 16882 1 1 31 PHE O O 9.751 -4.181 -0.914 1.00 . A A . 52 PHE O 1 1 30 16883 1 1 32 SER C C 12.136 -5.095 -2.636 1.00 . A A . 53 SER C 1 1 30 16884 1 1 32 SER CA C 10.795 -5.097 -3.397 1.00 . A A . 53 SER CA 1 1 30 16885 1 1 32 SER CB C 11.078 -5.204 -4.902 1.00 . A A . 53 SER CB 1 1 30 16886 1 1 32 SER H H 9.614 -3.409 -3.944 1.00 . A A . 53 SER H 1 1 30 16887 1 1 32 SER HA H 10.260 -5.997 -3.094 1.00 . A A . 53 SER HA 1 1 30 16888 1 1 32 SER HB2 H 11.646 -4.328 -5.226 1.00 . A A . 53 SER HB2 1 1 30 16889 1 1 32 SER HB3 H 11.671 -6.098 -5.097 1.00 . A A . 53 SER HB3 1 1 30 16890 1 1 32 SER HG H 10.081 -5.364 -6.582 1.00 . A A . 53 SER HG 1 1 30 16891 1 1 32 SER N N 9.920 -3.938 -3.138 1.00 . A A . 53 SER N 1 1 30 16892 1 1 32 SER O O 12.844 -6.106 -2.652 1.00 . A A . 53 SER O 1 1 30 16893 1 1 32 SER OG O 9.864 -5.278 -5.634 1.00 . A A . 53 SER OG 1 1 30 16894 1 1 33 LYS C C 13.447 -3.266 0.273 1.00 . A A . 54 LYS C 1 1 30 16895 1 1 33 LYS CA C 13.706 -3.824 -1.143 1.00 . A A . 54 LYS CA 1 1 30 16896 1 1 33 LYS CB C 14.744 -2.995 -1.931 1.00 . A A . 54 LYS CB 1 1 30 16897 1 1 33 LYS CD C 15.378 -0.692 -2.868 1.00 . A A . 54 LYS CD 1 1 30 16898 1 1 33 LYS CE C 16.359 -0.251 -1.773 1.00 . A A . 54 LYS CE 1 1 30 16899 1 1 33 LYS CG C 14.263 -1.578 -2.295 1.00 . A A . 54 LYS CG 1 1 30 16900 1 1 33 LYS H H 11.867 -3.193 -2.027 1.00 . A A . 54 LYS H 1 1 30 16901 1 1 33 LYS HA H 14.152 -4.804 -0.978 1.00 . A A . 54 LYS HA 1 1 30 16902 1 1 33 LYS HB2 H 15.658 -2.934 -1.342 1.00 . A A . 54 LYS HB2 1 1 30 16903 1 1 33 LYS HB3 H 14.987 -3.526 -2.854 1.00 . A A . 54 LYS HB3 1 1 30 16904 1 1 33 LYS HD2 H 15.909 -1.235 -3.652 1.00 . A A . 54 LYS HD2 1 1 30 16905 1 1 33 LYS HD3 H 14.919 0.194 -3.311 1.00 . A A . 54 LYS HD3 1 1 30 16906 1 1 33 LYS HE2 H 15.797 0.272 -0.992 1.00 . A A . 54 LYS HE2 1 1 30 16907 1 1 33 LYS HE3 H 16.813 -1.136 -1.319 1.00 . A A . 54 LYS HE3 1 1 30 16908 1 1 33 LYS HG2 H 13.477 -1.660 -3.046 1.00 . A A . 54 LYS HG2 1 1 30 16909 1 1 33 LYS HG3 H 13.849 -1.087 -1.414 1.00 . A A . 54 LYS HG3 1 1 30 16910 1 1 33 LYS HZ1 H 17.024 1.473 -2.729 1.00 . A A . 54 LYS HZ1 1 1 30 16911 1 1 33 LYS HZ2 H 18.048 0.941 -1.579 1.00 . A A . 54 LYS HZ2 1 1 30 16912 1 1 33 LYS HZ3 H 17.971 0.172 -3.015 1.00 . A A . 54 LYS HZ3 1 1 30 16913 1 1 33 LYS N N 12.487 -3.992 -1.955 1.00 . A A . 54 LYS N 1 1 30 16914 1 1 33 LYS NZ N 17.419 0.641 -2.311 1.00 . A A . 54 LYS NZ 1 1 30 16915 1 1 33 LYS O O 14.408 -2.911 0.961 1.00 . A A . 54 LYS O 1 1 30 16916 1 1 34 GLN C C 10.536 -3.253 2.658 1.00 . A A . 55 GLN C 1 1 30 16917 1 1 34 GLN CA C 11.839 -2.675 2.062 1.00 . A A . 55 GLN CA 1 1 30 16918 1 1 34 GLN CB C 11.747 -1.138 1.992 1.00 . A A . 55 GLN CB 1 1 30 16919 1 1 34 GLN CD C 11.415 0.989 3.322 1.00 . A A . 55 GLN CD 1 1 30 16920 1 1 34 GLN CG C 11.742 -0.499 3.389 1.00 . A A . 55 GLN CG 1 1 30 16921 1 1 34 GLN H H 11.450 -3.526 0.120 1.00 . A A . 55 GLN H 1 1 30 16922 1 1 34 GLN HA H 12.645 -2.936 2.753 1.00 . A A . 55 GLN HA 1 1 30 16923 1 1 34 GLN HB2 H 12.601 -0.741 1.441 1.00 . A A . 55 GLN HB2 1 1 30 16924 1 1 34 GLN HB3 H 10.840 -0.858 1.455 1.00 . A A . 55 GLN HB3 1 1 30 16925 1 1 34 GLN HE21 H 9.441 0.624 3.494 1.00 . A A . 55 GLN HE21 1 1 30 16926 1 1 34 GLN HE22 H 9.895 2.314 3.353 1.00 . A A . 55 GLN HE22 1 1 30 16927 1 1 34 GLN HG2 H 10.999 -0.983 4.021 1.00 . A A . 55 GLN HG2 1 1 30 16928 1 1 34 GLN HG3 H 12.719 -0.631 3.852 1.00 . A A . 55 GLN HG3 1 1 30 16929 1 1 34 GLN N N 12.187 -3.188 0.722 1.00 . A A . 55 GLN N 1 1 30 16930 1 1 34 GLN NE2 N 10.151 1.340 3.411 1.00 . A A . 55 GLN NE2 1 1 30 16931 1 1 34 GLN O O 10.542 -3.704 3.805 1.00 . A A . 55 GLN O 1 1 30 16932 1 1 34 GLN OE1 O 12.276 1.849 3.181 1.00 . A A . 55 GLN OE1 1 1 30 16933 1 1 35 CYS C C 7.482 -4.860 1.852 1.00 . A A . 56 CYS C 1 1 30 16934 1 1 35 CYS CA C 8.071 -3.527 2.380 1.00 . A A . 56 CYS CA 1 1 30 16935 1 1 35 CYS CB C 7.176 -2.321 2.031 1.00 . A A . 56 CYS CB 1 1 30 16936 1 1 35 CYS H H 9.519 -2.866 0.965 1.00 . A A . 56 CYS H 1 1 30 16937 1 1 35 CYS HA H 8.093 -3.608 3.467 1.00 . A A . 56 CYS HA 1 1 30 16938 1 1 35 CYS HB2 H 7.112 -2.208 0.947 1.00 . A A . 56 CYS HB2 1 1 30 16939 1 1 35 CYS HB3 H 6.169 -2.513 2.407 1.00 . A A . 56 CYS HB3 1 1 30 16940 1 1 35 CYS N N 9.436 -3.253 1.892 1.00 . A A . 56 CYS N 1 1 30 16941 1 1 35 CYS O O 6.380 -5.263 2.245 1.00 . A A . 56 CYS O 1 1 30 16942 1 1 35 CYS SG S 7.809 -0.792 2.786 1.00 . A A . 56 CYS SG 1 1 30 16943 1 1 36 ARG C C 9.096 -7.673 -0.067 1.00 . A A . 57 ARG C 1 1 30 16944 1 1 36 ARG CA C 7.863 -6.826 0.317 1.00 . A A . 57 ARG CA 1 1 30 16945 1 1 36 ARG CB C 6.981 -6.516 -0.914 1.00 . A A . 57 ARG CB 1 1 30 16946 1 1 36 ARG CD C 5.014 -7.985 -0.092 1.00 . A A . 57 ARG CD 1 1 30 16947 1 1 36 ARG CG C 5.936 -7.595 -1.261 1.00 . A A . 57 ARG CG 1 1 30 16948 1 1 36 ARG CZ C 3.418 -6.111 0.410 1.00 . A A . 57 ARG CZ 1 1 30 16949 1 1 36 ARG H H 9.042 -5.071 0.621 1.00 . A A . 57 ARG H 1 1 30 16950 1 1 36 ARG HA H 7.312 -7.417 1.044 1.00 . A A . 57 ARG HA 1 1 30 16951 1 1 36 ARG HB2 H 6.437 -5.585 -0.747 1.00 . A A . 57 ARG HB2 1 1 30 16952 1 1 36 ARG HB3 H 7.621 -6.349 -1.782 1.00 . A A . 57 ARG HB3 1 1 30 16953 1 1 36 ARG HD2 H 4.185 -8.585 -0.473 1.00 . A A . 57 ARG HD2 1 1 30 16954 1 1 36 ARG HD3 H 5.570 -8.620 0.599 1.00 . A A . 57 ARG HD3 1 1 30 16955 1 1 36 ARG HE H 5.121 -6.428 1.362 1.00 . A A . 57 ARG HE 1 1 30 16956 1 1 36 ARG HG2 H 5.319 -7.213 -2.076 1.00 . A A . 57 ARG HG2 1 1 30 16957 1 1 36 ARG HG3 H 6.439 -8.490 -1.622 1.00 . A A . 57 ARG HG3 1 1 30 16958 1 1 36 ARG HH11 H 2.722 -7.237 -1.092 1.00 . A A . 57 ARG HH11 1 1 30 16959 1 1 36 ARG HH12 H 1.753 -5.836 -0.646 1.00 . A A . 57 ARG HH12 1 1 30 16960 1 1 36 ARG HH21 H 3.795 -4.741 1.817 1.00 . A A . 57 ARG HH21 1 1 30 16961 1 1 36 ARG HH22 H 2.316 -4.524 0.889 1.00 . A A . 57 ARG HH22 1 1 30 16962 1 1 36 ARG N N 8.212 -5.544 0.961 1.00 . A A . 57 ARG N 1 1 30 16963 1 1 36 ARG NE N 4.513 -6.806 0.645 1.00 . A A . 57 ARG NE 1 1 30 16964 1 1 36 ARG NH1 N 2.563 -6.429 -0.518 1.00 . A A . 57 ARG NH1 1 1 30 16965 1 1 36 ARG NH2 N 3.150 -5.053 1.110 1.00 . A A . 57 ARG NH2 1 1 30 16966 1 1 36 ARG O O 8.966 -8.657 -0.798 1.00 . A A . 57 ARG O 1 1 30 16967 1 1 37 SER C C 11.574 -9.409 0.865 1.00 . A A . 58 SER C 1 1 30 16968 1 1 37 SER CA C 11.568 -7.998 0.250 1.00 . A A . 58 SER CA 1 1 30 16969 1 1 37 SER CB C 12.716 -7.151 0.813 1.00 . A A . 58 SER CB 1 1 30 16970 1 1 37 SER H H 10.296 -6.500 1.040 1.00 . A A . 58 SER H 1 1 30 16971 1 1 37 SER HA H 11.759 -8.133 -0.815 1.00 . A A . 58 SER HA 1 1 30 16972 1 1 37 SER HB2 H 13.607 -7.774 0.924 1.00 . A A . 58 SER HB2 1 1 30 16973 1 1 37 SER HB3 H 12.944 -6.358 0.100 1.00 . A A . 58 SER HB3 1 1 30 16974 1 1 37 SER HG H 13.165 -6.217 2.493 1.00 . A A . 58 SER HG 1 1 30 16975 1 1 37 SER N N 10.287 -7.279 0.401 1.00 . A A . 58 SER N 1 1 30 16976 1 1 37 SER O O 10.845 -9.668 1.851 1.00 . A A . 58 SER O 1 1 30 16977 1 1 37 SER OXT O 12.320 -10.266 0.340 1.00 . A A . 58 SER OXT 1 1 30 16978 1 1 37 SER OG O 12.359 -6.566 2.058 1.00 . A A . 58 SER OG 1 1 30 16979 2 2 1 ZN ZN ZN -8.551 0.503 3.450 1.00 . B A . 1059 ZN ZN 1 1 30 16980 3 2 1 ZN ZN ZN 6.853 0.981 1.967 1.00 . C A . 1060 ZN ZN 1 1 stop_ save_
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